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<|startoftext|><L>O=C1N[C@H](c2cccc(Br)c2)Nc2cccc<mask_1:3>c21<mask_1:3> | 0 | 31 | 3 | 3 | O=C1N[C@H](c2cccc(Br)c2)Nc2cccc(O)c21 | O=C1N[C@H](c2cccc(Br)c2)Nc2ccccc21 | (O) |
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<|startoftext|><L>O=C1N[C@H<mask_1:5>2cccc(Br)c2)Nc2ccccc21<mask_1:5> | 3 | 9 | 5 | ](c | 5 | O=C1N[C@H](COc2cccc(Br)c2)Nc2ccccc21 | O=C1N[C@H](c2cccc(Br)c2)Nc2ccccc21 | ](COc |
<|startoftext|><L>O=C1N[C@H](c2cccc(Br)c2)Nc2c<mask_1:4>cc21<mask_1:4> | 2 | 28 | 4 | cc | 4 | O=C1N[C@H](c2cccc(Br)c2)Nc2c[nH]cc21 | O=C1N[C@H](c2cccc(Br)c2)Nc2ccccc21 | [nH] |
<|startoftext|><L>O=C1N[C@H](c2c<mask_1:4>r)c2)Nc2ccccc21<mask_1:4> | 5 | 14 | 4 | ccc(B | 4 | O=C1N[C@H](c2csc(Br)c2)Nc2ccccc21 | O=C1N[C@H](c2cccc(Br)c2)Nc2ccccc21 | sc(B |
<|startoftext|><L>O=C1N[C@H](<mask_1:5>cccc(Br)c2)Nc2ccccc21<mask_1:5> | 2 | 11 | 5 | c2 | 5 | O=C1N[C@H](COCc2cccc(Br)c2)Nc2ccccc21 | O=C1N[C@H](c2cccc(Br)c2)Nc2ccccc21 | COCc2 |
<|startoftext|><L>O=C1N[C@H](c2cccc(Br)<mask_1:4>2ccccc21<mask_1:4> | 5 | 21 | 4 | c2)Nc | 4 | O=C1N[C@H](c2cccc(Br)c2)c2ccccc21 | O=C1N[C@H](c2cccc(Br)c2)Nc2ccccc21 | c2)c |
<|startoftext|><L>O=C1N[C@H](c2cccc(Br)c2)Nc<mask_1:1>ccc21<mask_1:1> | 3 | 26 | 1 | 2cc | 1 | O=C1N[C@H](c2cccc(Br)c2)Nc2ccc21 | O=C1N[C@H](c2cccc(Br)c2)Nc2ccccc21 | 2 |
<|startoftext|><L>O=C1<mask_1:3>H](c2cccc(Br)c2)Nc2ccccc21<mask_1:3> | 4 | 4 | 3 | N[C@ | 3 | O=C1[C@H](c2cccc(Br)c2)Nc2ccccc21 | O=C1N[C@H](c2cccc(Br)c2)Nc2ccccc21 | [C@ |
<|startoftext|><L>O=C1N[C@H](c2c<mask_1:1>(Br)c2)Nc2ccccc21<mask_1:1> | 3 | 14 | 1 | ccc | 1 | O=C1N[C@H](c2cc(Br)c2)Nc2ccccc21 | O=C1N[C@H](c2cccc(Br)c2)Nc2ccccc21 | c |
<|startoftext|><L>O=C1N[C@H](c2cccc(Br)c2)Nc2cc<mask_1:5>21<mask_1:5> | 3 | 29 | 5 | ccc | 5 | O=C1N[C@H](c2cccc(Br)c2)Nc2cc(F)sc21 | O=C1N[C@H](c2cccc(Br)c2)Nc2ccccc21 | (F)sc |
<|startoftext|><L>Cc1c(C(=O)N2<mask_1:5>CCC[C@@H](C(=O)c3cccs3)C2)oc2c(F)cccc12<mask_1:5> | 0 | 12 | 5 | 5 | Cc1c(C(=O)N2C(=O)CCC[C@@H](C(=O)c3cccs3)C2)oc2c(F)cccc12 | Cc1c(C(=O)N2CCC[C@@H](C(=O)c3cccs3)C2)oc2c(F)cccc12 | C(=O) |
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<|startoftext|><L>Cc1c<mask_1:5>O)N2CCC[C@@H](C(=O)c3cccs3)C2)oc2c(F)cccc12<mask_1:5> | 4 | 4 | 5 | (C(= | 5 | Cc1c(CC(=O)N2CCC[C@@H](C(=O)c3cccs3)C2)oc2c(F)cccc12 | Cc1c(C(=O)N2CCC[C@@H](C(=O)c3cccs3)C2)oc2c(F)cccc12 | (CC(= |
<|startoftext|><L>Cc1c(C(=O)N2CCC[C@@H](C(=O)c3ccc<mask_1:6>2)oc2c(F)cccc12<mask_1:6> | 4 | 32 | 6 | s3)C | 6 | Cc1c(C(=O)N2CCC[C@@H](C(=O)c3ccccn3)CC2)oc2c(F)cccc12 | Cc1c(C(=O)N2CCC[C@@H](C(=O)c3cccs3)C2)oc2c(F)cccc12 | cn3)CC |
<|startoftext|><L>Cc1c(C(=O)N2CCC[C@@H](C(=<mask_1:5>O)c3cccs3)C2)oc2c(F)cccc12<mask_1:5> | 0 | 25 | 5 | 5 | Cc1c(C(=O)N2CCC[C@@H](C(=O)C(=O)c3cccs3)C2)oc2c(F)cccc12 | Cc1c(C(=O)N2CCC[C@@H](C(=O)c3cccs3)C2)oc2c(F)cccc12 | O)C(= |
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<|startoftext|><L>Cc1c(C(=O)<mask_1:2>N2CCC[C@@H](C(=O)c3cccs3)C2)oc2c(F)cccc12<mask_1:2> | 0 | 10 | 2 | 2 | Cc1c(C(=O)NCN2CCC[C@@H](C(=O)c3cccs3)C2)oc2c(F)cccc12 | Cc1c(C(=O)N2CCC[C@@H](C(=O)c3cccs3)C2)oc2c(F)cccc12 | NC |
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<|startoftext|><L>Cc1c(C(<mask_1:5>=O)N2CCC[C@@H](C(=O)c3cccs3)C2)oc2c(F)cccc12<mask_1:5> | 0 | 7 | 5 | 5 | Cc1c(C(=O)C(=O)N2CCC[C@@H](C(=O)c3cccs3)C2)oc2c(F)cccc12 | Cc1c(C(=O)N2CCC[C@@H](C(=O)c3cccs3)C2)oc2c(F)cccc12 | =O)C( |
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<|startoftext|><L>Cc1c(C(=O)N2CCC[C@@H](C(=O)c3cccs3)<mask_1:1>C2)oc2c(F)cccc12<mask_1:1> | 0 | 35 | 1 | 1 | Cc1c(C(=O)N2CCC[C@@H](C(=O)c3cccs3)CC2)oc2c(F)cccc12 | Cc1c(C(=O)N2CCC[C@@H](C(=O)c3cccs3)C2)oc2c(F)cccc12 | C |
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<|startoftext|><L>Cc1c(C(=O)N2<mask_1:7>C@@H](C(=O)c3cccs3)C2)oc2c(F)cccc12<mask_1:7> | 4 | 12 | 7 | CCC[ | 7 | Cc1c(C(=O)N2CCN(C)[C@@H](C(=O)c3cccs3)C2)oc2c(F)cccc12 | Cc1c(C(=O)N2CCC[C@@H](C(=O)c3cccs3)C2)oc2c(F)cccc12 | CCN(C)[ |
<|startoftext|><L>Cc1c(C(=O<mask_1:5>2CCC[C@@H](C(=O)c3cccs3)C2)oc2c(F)cccc12<mask_1:5> | 2 | 9 | 5 | )N | 5 | Cc1c(C(=O)NCCN2CCC[C@@H](C(=O)c3cccs3)C2)oc2c(F)cccc12 | Cc1c(C(=O)N2CCC[C@@H](C(=O)c3cccs3)C2)oc2c(F)cccc12 | )NCCN |
<|startoftext|><L>Cc1c(C(=O)N2C<mask_1:7>C@@H](C(=O)c3cccs3)C2)oc2c(F)cccc12<mask_1:7> | 3 | 13 | 7 | CC[ | 8 | Cc1c(C(=O)N2CCNC(=O)[C@@H](C(=O)c3cccs3)C2)oc2c(F)cccc12 | Cc1c(C(=O)N2CCC[C@@H](C(=O)c3cccs3)C2)oc2c(F)cccc12 | CNC(=O)[ |
<|startoftext|><L>CC(C)c1ncc(S(=O)(=O)NC<mask_1:5>c2ccoc2C(=O)O)[nH]1<mask_1:5> | 0 | 22 | 5 | 5 | CC(C)c1ncc(S(=O)(=O)NC(=O)Cc2ccoc2C(=O)O)[nH]1 | CC(C)c1ncc(S(=O)(=O)NCc2ccoc2C(=O)O)[nH]1 | (=O)C |
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<|startoftext|><L>CC(C)c1ncc(S(=O)(<mask_1:4>c2ccoc2C(=O)O)[nH]1<mask_1:4> | 5 | 17 | 4 | =O)NC | 4 | CC(C)c1ncc(S(=O)(=O)Cc2ccoc2C(=O)O)[nH]1 | CC(C)c1ncc(S(=O)(=O)NCc2ccoc2C(=O)O)[nH]1 | =O)C |
<|startoftext|><L>CC(C)c1ncc(S(=O)(=<mask_1:2>c2ccoc2C(=O)O)[nH]1<mask_1:2> | 4 | 18 | 2 | O)NC | 2 | CC(C)c1ncc(S(=O)(=O)c2ccoc2C(=O)O)[nH]1 | CC(C)c1ncc(S(=O)(=O)NCc2ccoc2C(=O)O)[nH]1 | O) |
<|startoftext|><L>CC(C)c1ncc(S(=O)<mask_1:5>c2ccoc2C(=O)O)[nH]1<mask_1:5> | 6 | 16 | 5 | (=O)NC | 5 | CC(C)c1ncc(S(=O)(=O)Cc2ccoc2C(=O)O)[nH]1 | CC(C)c1ncc(S(=O)(=O)NCc2ccoc2C(=O)O)[nH]1 | (=O)C |
<|startoftext|><L>CC(C)c1ncc(S(=O)(=O)NCc2ccoc2C<mask_1:3>O)[nH]1<mask_1:3> | 4 | 30 | 3 | (=O) | 3 | CC(C)c1ncc(S(=O)(=O)NCc2ccoc2COCCO)[nH]1 | CC(C)c1ncc(S(=O)(=O)NCc2ccoc2C(=O)O)[nH]1 | OCC |
<|startoftext|><L>CC(C<mask_1:4>ncc(S(=O)(=O)NCc2ccoc2C(=O)O)[nH]1<mask_1:4> | 3 | 4 | 4 | )c1 | 4 | CC(C)Cc1ncc(S(=O)(=O)NCc2ccoc2C(=O)O)[nH]1 | CC(C)c1ncc(S(=O)(=O)NCc2ccoc2C(=O)O)[nH]1 | )Cc1 |
<|startoftext|><L>CC<mask_1:2>C)c1ncc(S(=O)(=O)NCc2ccoc2C(=O)O)[nH]1<mask_1:2> | 1 | 2 | 2 | ( | 2 | CCN(C)c1ncc(S(=O)(=O)NCc2ccoc2C(=O)O)[nH]1 | CC(C)c1ncc(S(=O)(=O)NCc2ccoc2C(=O)O)[nH]1 | N( |
<|startoftext|><L>CC(C)c1ncc(S(=O)(=O)NCc2ccoc2C(=<mask_1:3>O)[nH]1<mask_1:3> | 2 | 32 | 3 | O) | 3 | CC(C)c1ncc(S(=O)(=O)NCc2ccoc2C(=O)CO)[nH]1 | CC(C)c1ncc(S(=O)(=O)NCc2ccoc2C(=O)O)[nH]1 | O)C |
<|startoftext|><L>CC(C<mask_1:3>c1ncc(S(=O)(=O)NCc2ccoc2C(=O)O)[nH]1<mask_1:3> | 1 | 4 | 3 | ) | 3 | CC(C)CCc1ncc(S(=O)(=O)NCc2ccoc2C(=O)O)[nH]1 | CC(C)c1ncc(S(=O)(=O)NCc2ccoc2C(=O)O)[nH]1 | )CC |
<|startoftext|><L>CC(C)c1ncc(S(=O)(=O)<mask_1:4>oc2C(=O)O)[nH]1<mask_1:4> | 6 | 20 | 4 | NCc2cc | 4 | CC(C)c1ncc(S(=O)(=O)c2ccoc2C(=O)O)[nH]1 | CC(C)c1ncc(S(=O)(=O)NCc2ccoc2C(=O)O)[nH]1 | c2cc |
<|startoftext|><L>O=CN1CCN<mask_1:2>C(=O)c2ccc(I)cc2)CC1<mask_1:2> | 1 | 8 | 2 | ( | 2 | O=CN1CCN(NC(=O)c2ccc(I)cc2)CC1 | O=CN1CCN(C(=O)c2ccc(I)cc2)CC1 | (N |
<|startoftext|><L>O=C<mask_1:4>1CCN(C(=O)c2ccc(I)cc2)CC1<mask_1:4> | 1 | 3 | 4 | N | 4 | O=C(O)C1CCN(C(=O)c2ccc(I)cc2)CC1 | O=CN1CCN(C(=O)c2ccc(I)cc2)CC1 | (O)C |
<|startoftext|><L>O=CN1CCN(C(=O)c<mask_1:1>c(I)cc2)CC1<mask_1:1> | 3 | 15 | 1 | 2cc | 1 | O=CN1CCN(C(=O)c2c(I)cc2)CC1 | O=CN1CCN(C(=O)c2ccc(I)cc2)CC1 | 2 |
<|startoftext|><L>O=CN1CCN(C(=O)c2ccc(I)cc<mask_1:3>CC1<mask_1:3> | 2 | 24 | 3 | 2) | 3 | O=CN1CCN(C(=O)c2ccc(I)cc2F)CC1 | O=CN1CCN(C(=O)c2ccc(I)cc2)CC1 | 2F) |
<|startoftext|><L>O=CN1CCN(C(=O)<mask_1:4>c2ccc(I)cc2)CC1<mask_1:4> | 0 | 14 | 4 | 4 | O=CN1CCN(C(=O)CCCOc2ccc(I)cc2)CC1 | O=CN1CCN(C(=O)c2ccc(I)cc2)CC1 | CCCO |
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<|startoftext|><L>O=CN1CCN(C(=O)c2ccc(<mask_1:4>)cc2)CC1<mask_1:4> | 1 | 20 | 4 | I | 4 | O=CN1CCN(C(=O)c2ccc(SCCO)cc2)CC1 | O=CN1CCN(C(=O)c2ccc(I)cc2)CC1 | SCCO |
<|startoftext|><L>O=CN1CCN(C(=O)c2<mask_1:2>I)cc2)CC1<mask_1:2> | 4 | 16 | 2 | ccc( | 2 | O=CN1CCN(C(=O)c2c(I)cc2)CC1 | O=CN1CCN(C(=O)c2ccc(I)cc2)CC1 | c( |
<|startoftext|><L>O=CN1CC<mask_1:1>C(=O)c2ccc(I)cc2)CC1<mask_1:1> | 2 | 7 | 1 | N( | 1 | O=CN1CC(C(=O)c2ccc(I)cc2)CC1 | O=CN1CCN(C(=O)c2ccc(I)cc2)CC1 | ( |
<|startoftext|><L>O=CN1CCN(C(=O)c2cc<mask_1:4>(I)cc2)CC1<mask_1:4> | 1 | 18 | 4 | c | 4 | O=CN1CCN(C(=O)c2cc(O)c(I)cc2)CC1 | O=CN1CCN(C(=O)c2ccc(I)cc2)CC1 | (O)c |
<|startoftext|><L>O=CN1CCN(C(=<mask_1:4>c2ccc(I)cc2)CC1<mask_1:4> | 2 | 12 | 4 | O) | 4 | O=CN1CCN(C(=S)COc2ccc(I)cc2)CC1 | O=CN1CCN(C(=O)c2ccc(I)cc2)CC1 | S)CO |
<|startoftext|><L>C<mask_1:7>(OC)c(NC(=O)CN2CCc3[nH]c4ccc(F)cc4c(=O)c3C2)c1<mask_1:7> | 6 | 1 | 7 | Oc1ccc | 7 | CCOc1ccc(OC)c(NC(=O)CN2CCc3[nH]c4ccc(F)cc4c(=O)c3C2)c1 | COc1ccc(OC)c(NC(=O)CN2CCc3[nH]c4ccc(F)cc4c(=O)c3C2)c1 | COc1ccc |
<|startoftext|><L>COc1ccc(O<mask_1:7>(=O)CN2CCc3[nH]c4ccc(F)cc4c(=O)c3C2)c1<mask_1:7> | 6 | 9 | 7 | C)c(NC | 7 | COc1ccc(OC)c(CNC(=O)CN2CCc3[nH]c4ccc(F)cc4c(=O)c3C2)c1 | COc1ccc(OC)c(NC(=O)CN2CCc3[nH]c4ccc(F)cc4c(=O)c3C2)c1 | C)c(CNC |
<|startoftext|><L>COc1cc<mask_1:5>)c(NC(=O)CN2CCc3[nH]c4ccc(F)cc4c(=O)c3C2)c1<mask_1:5> | 4 | 6 | 5 | c(OC | 5 | COc1ccc(OCC)c(NC(=O)CN2CCc3[nH]c4ccc(F)cc4c(=O)c3C2)c1 | COc1ccc(OC)c(NC(=O)CN2CCc3[nH]c4ccc(F)cc4c(=O)c3C2)c1 | c(OCC |
<|startoftext|><L>COc1ccc(O<mask_1:7>C(=O)CN2CCc3[nH]c4ccc(F)cc4c(=O)c3C2)c1<mask_1:7> | 5 | 9 | 7 | C)c(N | 7 | COc1ccc(OC)c(CCNC(=O)CN2CCc3[nH]c4ccc(F)cc4c(=O)c3C2)c1 | COc1ccc(OC)c(NC(=O)CN2CCc3[nH]c4ccc(F)cc4c(=O)c3C2)c1 | C)c(CCN |
<|startoftext|><L>COc1ccc(OC)c(NC(=O)CN2CCc3[nH]c4ccc(F)cc4c<mask_1:5>(=O)c3C2)c1<mask_1:5> | 0 | 42 | 5 | 5 | COc1ccc(OC)c(NC(=O)CN2CCc3[nH]c4ccc(F)cc4c(=O)c(=O)c3C2)c1 | COc1ccc(OC)c(NC(=O)CN2CCc3[nH]c4ccc(F)cc4c(=O)c3C2)c1 | (=O)c |
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<|startoftext|><L>COc1cc<mask_1:3>NC(=O)CN2CCc3[nH]c4ccc(F)cc4c(=O)c3C2)c1<mask_1:3> | 7 | 6 | 3 | c(OC)c( | 3 | COc1cccc(NC(=O)CN2CCc3[nH]c4ccc(F)cc4c(=O)c3C2)c1 | COc1ccc(OC)c(NC(=O)CN2CCc3[nH]c4ccc(F)cc4c(=O)c3C2)c1 | cc( |
<|startoftext|><L>COc1ccc(OC)c(N<mask_1:4>N2CCc3[nH]c4ccc(F)cc4c(=O)c3C2)c1<mask_1:4> | 6 | 14 | 4 | C(=O)C | 4 | COc1ccc(OC)c(N(C)CN2CCc3[nH]c4ccc(F)cc4c(=O)c3C2)c1 | COc1ccc(OC)c(NC(=O)CN2CCc3[nH]c4ccc(F)cc4c(=O)c3C2)c1 | (C)C |
<|startoftext|><L>COc1ccc(OC)c(NC(=O)CN2CCc3[nH]c4ccc(F)cc4c(<mask_1:2>O)c3C2)c1<mask_1:2> | 1 | 43 | 2 | = | 2 | COc1ccc(OC)c(NC(=O)CN2CCc3[nH]c4ccc(F)cc4c(=NO)c3C2)c1 | COc1ccc(OC)c(NC(=O)CN2CCc3[nH]c4ccc(F)cc4c(=O)c3C2)c1 | =N |
<|startoftext|><L>CO<mask_1:5>c(OC)c(NC(=O)CN2CCc3[nH]c4ccc(F)cc4c(=O)c3C2)c1<mask_1:5> | 4 | 2 | 5 | c1cc | 5 | COCc1ccc(OC)c(NC(=O)CN2CCc3[nH]c4ccc(F)cc4c(=O)c3C2)c1 | COc1ccc(OC)c(NC(=O)CN2CCc3[nH]c4ccc(F)cc4c(=O)c3C2)c1 | Cc1cc |
<|startoftext|><L>CO<mask_1:7>(OC)c(NC(=O)CN2CCc3[nH]c4ccc(F)cc4c(=O)c3C2)c1<mask_1:7> | 5 | 2 | 7 | c1ccc | 7 | COc1cc(C)(OC)c(NC(=O)CN2CCc3[nH]c4ccc(F)cc4c(=O)c3C2)c1 | COc1ccc(OC)c(NC(=O)CN2CCc3[nH]c4ccc(F)cc4c(=O)c3C2)c1 | c1cc(C) |
<|startoftext|><L>Cc1cn(CCS(C)(=O)=O)c(=O)n1-c1c<mask_1:5>ccc1[N+](=O)[O-]<mask_1:5> | 1 | 30 | 5 | c | 5 | Cc1cn(CCS(C)(=O)=O)c(=O)n1-c1c(Cl)cccc1[N+](=O)[O-] | Cc1cn(CCS(C)(=O)=O)c(=O)n1-c1ccccc1[N+](=O)[O-] | (Cl)c |
<|startoftext|><L>Cc1cn(CCS(C)(=O)=O)c(=<mask_1:6>n1-c1ccccc1[N+](=O)[O-]<mask_1:6> | 2 | 22 | 6 | O) | 6 | Cc1cn(CCS(C)(=O)=O)c(=O)[nH]n1-c1ccccc1[N+](=O)[O-] | Cc1cn(CCS(C)(=O)=O)c(=O)n1-c1ccccc1[N+](=O)[O-] | O)[nH] |
<|startoftext|><L>Cc1cn(CC<mask_1:2>O)=O)c(=O)n1-c1ccccc1[N+](=O)[O-]<mask_1:2> | 6 | 8 | 2 | S(C)(= | 2 | Cc1cn(CCC(O)=O)c(=O)n1-c1ccccc1[N+](=O)[O-] | Cc1cn(CCS(C)(=O)=O)c(=O)n1-c1ccccc1[N+](=O)[O-] | C( |
<|startoftext|><L>Cc1cn(CCS(C)(=O)=O)c(=O)n1-c1ccccc1<mask_1:7>+](=O)[O-]<mask_1:7> | 2 | 35 | 7 | [N | 7 | Cc1cn(CCS(C)(=O)=O)c(=O)n1-c1ccccc1/C=C/[N+](=O)[O-] | Cc1cn(CCS(C)(=O)=O)c(=O)n1-c1ccccc1[N+](=O)[O-] | /C=C/[N |
<|startoftext|><L>Cc1cn(CCS(C)(=O)=O)c(=O)<mask_1:3>1-c1ccccc1[N+](=O)[O-]<mask_1:3> | 1 | 24 | 3 | n | 3 | Cc1cn(CCS(C)(=O)=O)c(=O)nc-1-c1ccccc1[N+](=O)[O-] | Cc1cn(CCS(C)(=O)=O)c(=O)n1-c1ccccc1[N+](=O)[O-] | nc- |
<|startoftext|><L>Cc<mask_1:2>(CCS(C)(=O)=O)c(=O)n1-c1ccccc1[N+](=O)[O-]<mask_1:2> | 3 | 2 | 2 | 1cn | 2 | Cc1c(CCS(C)(=O)=O)c(=O)n1-c1ccccc1[N+](=O)[O-] | Cc1cn(CCS(C)(=O)=O)c(=O)n1-c1ccccc1[N+](=O)[O-] | 1c |
<|startoftext|><L>Cc1cn(CCS(C)(=O)=O)<mask_1:6>(=O)n1-c1ccccc1[N+](=O)[O-]<mask_1:6> | 1 | 19 | 6 | c | 6 | Cc1cn(CCS(C)(=O)=O)c(=O)c(=O)n1-c1ccccc1[N+](=O)[O-] | Cc1cn(CCS(C)(=O)=O)c(=O)n1-c1ccccc1[N+](=O)[O-] | c(=O)c |
<|startoftext|><L>Cc1cn(CCS(C)(=O)=O)c(=O)n1-c1ccccc1[N+](<mask_1:6>[O-]<mask_1:6> | 3 | 40 | 6 | =O) | 6 | Cc1cn(CCS(C)(=O)=O)c(=O)n1-c1ccccc1[N+](=O)[O][O-] | Cc1cn(CCS(C)(=O)=O)c(=O)n1-c1ccccc1[N+](=O)[O-] | =O)[O] |
<|startoftext|><L>Cc1cn(CCS(C)(=O)=O)c(=O)n1-c1<mask_1:5>cccc1[N+](=O)[O-]<mask_1:5> | 1 | 29 | 5 | c | 5 | Cc1cn(CCS(C)(=O)=O)c(=O)n1-c1c(Br)cccc1[N+](=O)[O-] | Cc1cn(CCS(C)(=O)=O)c(=O)n1-c1ccccc1[N+](=O)[O-] | c(Br) |
<|startoftext|><L><mask_1:2>c1cn(CCS(C)(=O)=O)c(=O)n1-c1ccccc1[N+](=O)[O-]<mask_1:2> | 1 | 0 | 2 | C | 2 | COc1cn(CCS(C)(=O)=O)c(=O)n1-c1ccccc1[N+](=O)[O-] | Cc1cn(CCS(C)(=O)=O)c(=O)n1-c1ccccc1[N+](=O)[O-] | CO |
<|startoftext|><L>Cc1cc(C)nc(N/<mask_1:3>=C2/C(O)=Nc3ccc(Cl)cc32)n1<mask_1:3> | 1 | 13 | 3 | N | 3 | Cc1cc(C)nc(N/N=C=C2/C(O)=Nc3ccc(Cl)cc32)n1 | Cc1cc(C)nc(N/N=C2/C(O)=Nc3ccc(Cl)cc32)n1 | N=C |
<|startoftext|><L>Cc1cc(C)nc(N/N=C2/C(O)<mask_1:3>c3ccc(Cl)cc32)n1<mask_1:3> | 2 | 22 | 3 | =N | 3 | Cc1cc(C)nc(N/N=C2/C(O)=NCc3ccc(Cl)cc32)n1 | Cc1cc(C)nc(N/N=C2/C(O)=Nc3ccc(Cl)cc32)n1 | =NC |
<|startoftext|><L>Cc1cc(C)nc(N/N=C2/C<mask_1:4>)=Nc3ccc(Cl)cc32)n1<mask_1:4> | 2 | 19 | 4 | (O | 4 | Cc1cc(C)nc(N/N=C2/CCC(O)=Nc3ccc(Cl)cc32)n1 | Cc1cc(C)nc(N/N=C2/C(O)=Nc3ccc(Cl)cc32)n1 | CC(O |
<|startoftext|><L>Cc1cc(C<mask_1:2>)nc(N/N=C2/C(O)=Nc3ccc(Cl)cc32)n1<mask_1:2> | 0 | 7 | 2 | 2 | Cc1cc(C#N)nc(N/N=C2/C(O)=Nc3ccc(Cl)cc32)n1 | Cc1cc(C)nc(N/N=C2/C(O)=Nc3ccc(Cl)cc32)n1 | #N |
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<|startoftext|><L>C<mask_1:5>(C)nc(N/N=C2/C(O)=Nc3ccc(Cl)cc32)n1<mask_1:5> | 4 | 1 | 5 | c1cc | 5 | COc1cc(C)nc(N/N=C2/C(O)=Nc3ccc(Cl)cc32)n1 | Cc1cc(C)nc(N/N=C2/C(O)=Nc3ccc(Cl)cc32)n1 | Oc1cc |
<|startoftext|><L>C<mask_1:6>c(C)nc(N/N=C2/C(O)=Nc3ccc(Cl)cc32)n1<mask_1:6> | 3 | 1 | 6 | c1c | 6 | CCCOc1cc(C)nc(N/N=C2/C(O)=Nc3ccc(Cl)cc32)n1 | Cc1cc(C)nc(N/N=C2/C(O)=Nc3ccc(Cl)cc32)n1 | CCOc1c |
<|startoftext|><L><mask_1:5>c1cc(C)nc(N/N=C2/C(O)=Nc3ccc(Cl)cc32)n1<mask_1:5> | 1 | 0 | 5 | C | 5 | CCCCCc1cc(C)nc(N/N=C2/C(O)=Nc3ccc(Cl)cc32)n1 | Cc1cc(C)nc(N/N=C2/C(O)=Nc3ccc(Cl)cc32)n1 | CCCCC |
<|startoftext|><L>Cc1cc(C)nc(N/N=C<mask_1:3>C(O)=Nc3ccc(Cl)cc32)n1<mask_1:3> | 2 | 16 | 3 | 2/ | 3 | Cc1cc(C)nc(N/N=C2\CC(O)=Nc3ccc(Cl)cc32)n1 | Cc1cc(C)nc(N/N=C2/C(O)=Nc3ccc(Cl)cc32)n1 | 2\C |
<|startoftext|><L>Cc1c<mask_1:5>)nc(N/N=C2/C(O)=Nc3ccc(Cl)cc32)n1<mask_1:5> | 3 | 4 | 5 | c(C | 5 | Cc1cc(C#N)nc(N/N=C2/C(O)=Nc3ccc(Cl)cc32)n1 | Cc1cc(C)nc(N/N=C2/C(O)=Nc3ccc(Cl)cc32)n1 | c(C#N |
<|startoftext|><L>Cc1cc(C)nc(N/N=C2/C<mask_1:2>O)=Nc3ccc(Cl)cc32)n1<mask_1:2> | 1 | 19 | 2 | ( | 2 | Cc1cc(C)nc(N/N=C2/CC(O)=Nc3ccc(Cl)cc32)n1 | Cc1cc(C)nc(N/N=C2/C(O)=Nc3ccc(Cl)cc32)n1 | C( |
<|startoftext|><L>C[C@H]1CCC[C<mask_1:5>@H]3OC(=O)[C@H](CN4CCC(N5CCCCC5)CC4)[C@H]3C=C12<mask_1:5> | 9 | 12 | 5 | @]2(C)C[C | 6 | C[C@H]1CCC[C@H]2[C@H]3OC(=O)[C@H](CN4CCC(N5CCCCC5)CC4)[C@H]3C=C12 | C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)[C@H](CN4CCC(N5CCCCC5)CC4)[C@H]3C=C12 | @H]2[C |
<|startoftext|><L>C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)[C@H](CN4CCC(N5C<mask_1:9>4)[C@H]3C=C12<mask_1:9> | 8 | 47 | 9 | CCCC5)CC | 9 | C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)[C@H](CN4CCC(N5CCCCCC5)CC4)[C@H]3C=C12 | C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)[C@H](CN4CCC(N5CCCCC5)CC4)[C@H]3C=C12 | CCCCC5)CC |
<|startoftext|><L>C[C@H]1CCC[C@]<mask_1:3>H]3OC(=O)[C@H](CN4CCC(N5CCCCC5)CC4)[C@H]3C=C12<mask_1:3> | 8 | 14 | 3 | 2(C)C[C@ | 3 | C[C@H]1CCC[C@]2[CH]3OC(=O)[C@H](CN4CCC(N5CCCCC5)CC4)[C@H]3C=C12 | C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)[C@H](CN4CCC(N5CCCCC5)CC4)[C@H]3C=C12 | 2[C |
<|startoftext|><L>C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)[C@H](CN4CCC(N5CCCCC5)CC<mask_1:10>)[C@H]3C=C12<mask_1:10> | 1 | 55 | 10 | 4 | 10 | C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)[C@H](CN4CCC(N5CCCCC5)CC4)[C@@H](O)[C@H]3C=C12 | C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)[C@H](CN4CCC(N5CCCCC5)CC4)[C@H]3C=C12 | 4)[C@@H](O |
<|startoftext|><L>C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)[C@H](CN4CCC(N5CCCCC5)CC<mask_1:7>C12<mask_1:7> | 10 | 55 | 7 | 4)[C@H]3C= | 7 | C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)[C@H](CN4CCC(N5CCCCC5)CC4)[CH]3C12 | C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)[C@H](CN4CCC(N5CCCCC5)CC4)[C@H]3C=C12 | 4)[CH]3 |
<|startoftext|><L>C[C@H]1CCC[C@]2(<mask_1:2>[C@H]3OC(=O)[C@H](CN4CCC(N5CCCCC5)CC4)[C@H]3C=C12<mask_1:2> | 3 | 16 | 2 | C)C | 2 | C[C@H]1CCC[C@]2(C)[C@H]3OC(=O)[C@H](CN4CCC(N5CCCCC5)CC4)[C@H]3C=C12 | C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)[C@H](CN4CCC(N5CCCCC5)CC4)[C@H]3C=C12 | C) |
<|startoftext|><L>C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)[C@H](CN4CCC(N5CCCCC5)CC4)[C@<mask_1:5>2<mask_1:5> | 7 | 60 | 5 | H]3C=C1 | 5 | C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)[C@H](CN4CCC(N5CCCCC5)CC4)[C@H]3C12 | C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)[C@H](CN4CCC(N5CCCCC5)CC4)[C@H]3C=C12 | H]3C1 |
<|startoftext|><L>C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)[C@H](CN4CCC(N5CCCCC<mask_1:7>[C@H]3C=C12<mask_1:7> | 6 | 51 | 7 | 5)CC4) | 7 | C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)[C@H](CN4CCC(N5CCCCC5)CC4)C[C@H]3C=C12 | C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)[C@H](CN4CCC(N5CCCCC5)CC4)[C@H]3C=C12 | 5)CC4)C |
<|startoftext|><L>C[C@H]1CCC[C@]2(C)C[C@H]<mask_1:4>@H](CN4CCC(N5CCCCC5)CC4)[C@H]3C=C12<mask_1:4> | 9 | 24 | 4 | 3OC(=O)[C | 4 | C[C@H]1CCC[C@]2(C)C[C@H]3O[C@H](CN4CCC(N5CCCCC5)CC4)[C@H]3C=C12 | C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)[C@H](CN4CCC(N5CCCCC5)CC4)[C@H]3C=C12 | 3O[C |
<|startoftext|><L>C[C@<mask_1:6>2(C)C[C@H]3OC(=O)[C@H](CN4CCC(N5CCCCC5)CC4)[C@H]3C=C12<mask_1:6> | 10 | 4 | 6 | H]1CCC[C@] | 6 | C[C@H]1CCC2(C)C[C@H]3OC(=O)[C@H](CN4CCC(N5CCCCC5)CC4)[C@H]3C=C12 | C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)[C@H](CN4CCC(N5CCCCC5)CC4)[C@H]3C=C12 | H]1CCC |
<|startoftext|><L>CN1CC[C@@H](NC(=O)Nc2cccc(N3C<mask_1:1>CC3)c2)C1=O<mask_1:1> | 3 | 29 | 1 | CCC | 1 | CN1CC[C@@H](NC(=O)Nc2cccc(N3CCCC3)c2)C1=O | CN1CC[C@@H](NC(=O)Nc2cccc(N3CCCCCC3)c2)C1=O | C |
<|startoftext|><L>CN1CC[C@@H](NC(=O)Nc2cccc(N3C<mask_1:2>)c2)C1=O<mask_1:2> | 6 | 29 | 2 | CCCCC3 | 2 | CN1CC[C@@H](NC(=O)Nc2cccc(N3CC3)c2)C1=O | CN1CC[C@@H](NC(=O)Nc2cccc(N3CCCCCC3)c2)C1=O | C3 |
<|startoftext|><L>CN1CC<mask_1:5>@@H](NC(=O)Nc2cccc(N3CCCCCC3)c2)C1=O<mask_1:5> | 2 | 5 | 5 | [C | 5 | CN1CCCCC[C@@H](NC(=O)Nc2cccc(N3CCCCCC3)c2)C1=O | CN1CC[C@@H](NC(=O)Nc2cccc(N3CCCCCC3)c2)C1=O | CCC[C |
<|startoftext|><L>CN<mask_1:6>C[C@@H](NC(=O)Nc2cccc(N3CCCCCC3)c2)C1=O<mask_1:6> | 2 | 2 | 6 | 1C | 6 | CN1C(=O)C[C@@H](NC(=O)Nc2cccc(N3CCCCCC3)c2)C1=O | CN1CC[C@@H](NC(=O)Nc2cccc(N3CCCCCC3)c2)C1=O | 1C(=O) |
<|startoftext|><L>CN1CC[C@@H](NC(=O)Nc2<mask_1:5>3CCCCCC3)c2)C1=O<mask_1:5> | 6 | 21 | 5 | cccc(N | 5 | CN1CC[C@@H](NC(=O)Nc2cnn(C3CCCCCC3)c2)C1=O | CN1CC[C@@H](NC(=O)Nc2cccc(N3CCCCCC3)c2)C1=O | cnn(C |
<|startoftext|><L>CN1CC[C@@H](NC(=O)N<mask_1:6>ccc(N3CCCCCC3)c2)C1=O<mask_1:6> | 3 | 19 | 6 | c2c | 6 | CN1CC[C@@H](NC(=O)N(C)c2cccc(N3CCCCCC3)c2)C1=O | CN1CC[C@@H](NC(=O)Nc2cccc(N3CCCCCC3)c2)C1=O | (C)c2c |
<|startoftext|><L>CN1CC[C@@H](NC(<mask_1:4>2cccc(N3CCCCCC3)c2)C1=O<mask_1:4> | 5 | 15 | 4 | =O)Nc | 4 | CN1CC[C@@H](NC(=O)c2cccc(N3CCCCCC3)c2)C1=O | CN1CC[C@@H](NC(=O)Nc2cccc(N3CCCCCC3)c2)C1=O | =O)c |
<|startoftext|><L>CN1CC[C@@H](NC(=O)Nc2ccc<mask_1:6>3CCCCCC3)c2)C1=O<mask_1:6> | 3 | 24 | 6 | c(N | 6 | CN1CC[C@@H](NC(=O)Nc2cccc(OCCN3CCCCCC3)c2)C1=O | CN1CC[C@@H](NC(=O)Nc2cccc(N3CCCCCC3)c2)C1=O | c(OCCN |
<|startoftext|><L>CN1CC[C@@H](NC(=<mask_1:5>O)Nc2cccc(N3CCCCCC3)c2)C1=O<mask_1:5> | 0 | 16 | 5 | 5 | CN1CC[C@@H](NC(=O)C(=O)Nc2cccc(N3CCCCCC3)c2)C1=O | CN1CC[C@@H](NC(=O)Nc2cccc(N3CCCCCC3)c2)C1=O | O)C(= |
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<|startoftext|><L>CN1CC<mask_1:5>[C@@H](NC(=O)Nc2cccc(N3CCCCCC3)c2)C1=O<mask_1:5> | 0 | 5 | 5 | 5 | CN1CCN(C)C[C@@H](NC(=O)Nc2cccc(N3CCCCCC3)c2)C1=O | CN1CC[C@@H](NC(=O)Nc2cccc(N3CCCCCC3)c2)C1=O | N(C)C |
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<|startoftext|><L>CC(=O)Nc1ccc(-c2ccc(S(=O)(=O)Oc3<mask_1:6>Cl)c3)cc2)cc1<mask_1:6> | 5 | 32 | 6 | cccc( | 6 | CC(=O)Nc1ccc(-c2ccc(S(=O)(=O)Oc3cccc(CCl)c3)cc2)cc1 | CC(=O)Nc1ccc(-c2ccc(S(=O)(=O)Oc3cccc(Cl)c3)cc2)cc1 | cccc(C |
<|startoftext|><L>CC(=O)Nc1ccc(-c2ccc(S(=O)(=O)<mask_1:2>c3cccc(Cl)c3)cc2)cc1<mask_1:2> | 1 | 29 | 2 | O | 2 | CC(=O)Nc1ccc(-c2ccc(S(=O)(=O)NCc3cccc(Cl)c3)cc2)cc1 | CC(=O)Nc1ccc(-c2ccc(S(=O)(=O)Oc3cccc(Cl)c3)cc2)cc1 | NC |
<|startoftext|><L>CC(=O)Nc1ccc(-c2ccc(S(=O)(=O)Oc3cccc(Cl)<mask_1:4>2)cc1<mask_1:4> | 5 | 40 | 4 | c3)cc | 4 | CC(=O)Nc1ccc(-c2ccc(S(=O)(=O)Oc3cccc(Cl)c3)o2)cc1 | CC(=O)Nc1ccc(-c2ccc(S(=O)(=O)Oc3cccc(Cl)c3)cc2)cc1 | c3)o |
<|startoftext|><L>CC<mask_1:6>=O)Nc1ccc(-c2ccc(S(=O)(=O)Oc3cccc(Cl)c3)cc2)cc1<mask_1:6> | 1 | 2 | 6 | ( | 6 | CC(C)CC(=O)Nc1ccc(-c2ccc(S(=O)(=O)Oc3cccc(Cl)c3)cc2)cc1 | CC(=O)Nc1ccc(-c2ccc(S(=O)(=O)Oc3cccc(Cl)c3)cc2)cc1 | (C)CC( |
<|startoftext|><L>CC(=O)Nc1ccc(-c2ccc(S(=O)(=O)O<mask_1:5>cccc(Cl)c3)cc2)cc1<mask_1:5> | 2 | 30 | 5 | c3 | 5 | CC(=O)Nc1ccc(-c2ccc(S(=O)(=O)O)N(c3cccc(Cl)c3)cc2)cc1 | CC(=O)Nc1ccc(-c2ccc(S(=O)(=O)Oc3cccc(Cl)c3)cc2)cc1 | )N(c3 |
<|startoftext|><L>CC(<mask_1:6>1ccc(-c2ccc(S(=O)(=O)Oc3cccc(Cl)c3)cc2)cc1<mask_1:6> | 5 | 3 | 6 | =O)Nc | 6 | CC(C)(C)c1ccc(-c2ccc(S(=O)(=O)Oc3cccc(Cl)c3)cc2)cc1 | CC(=O)Nc1ccc(-c2ccc(S(=O)(=O)Oc3cccc(Cl)c3)cc2)cc1 | C)(C)c |
<|startoftext|><L>CC(=O)Nc1ccc(-c2ccc(S(=O)<mask_1:1>O)Oc3cccc(Cl)c3)cc2)cc1<mask_1:1> | 2 | 25 | 1 | (= | 1 | CC(=O)Nc1ccc(-c2ccc(S(=O)(O)Oc3cccc(Cl)c3)cc2)cc1 | CC(=O)Nc1ccc(-c2ccc(S(=O)(=O)Oc3cccc(Cl)c3)cc2)cc1 | ( |
<|startoftext|><L>CC(=O)Nc1ccc(-c2ccc(<mask_1:2>S(=O)(=O)Oc3cccc(Cl)c3)cc2)cc1<mask_1:2> | 0 | 20 | 2 | 2 | CC(=O)Nc1ccc(-c2ccc(CNS(=O)(=O)Oc3cccc(Cl)c3)cc2)cc1 | CC(=O)Nc1ccc(-c2ccc(S(=O)(=O)Oc3cccc(Cl)c3)cc2)cc1 | CN |
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<|startoftext|><L>CC(=O)Nc1ccc(-c2ccc(S(=O)(=O)Oc3cc<mask_1:4>cc(Cl)c3)cc2)cc1<mask_1:4> | 0 | 34 | 4 | 4 | CC(=O)Nc1ccc(-c2ccc(S(=O)(=O)Oc3cc(Cl)cc(Cl)c3)cc2)cc1 | CC(=O)Nc1ccc(-c2ccc(S(=O)(=O)Oc3cccc(Cl)c3)cc2)cc1 | (Cl) |
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<|startoftext|><L>CC(=O)Nc1ccc(-c2<mask_1:7>(S(=O)(=O)Oc3cccc(Cl)c3)cc2)cc1<mask_1:7> | 3 | 16 | 7 | ccc | 7 | CC(=O)Nc1ccc(-c2cc(Cl)c(S(=O)(=O)Oc3cccc(Cl)c3)cc2)cc1 | CC(=O)Nc1ccc(-c2ccc(S(=O)(=O)Oc3cccc(Cl)c3)cc2)cc1 | cc(Cl)c |