prompt
stringlengths 49
262
| first_mask_count
int64 0
16
| first_start_index
int64 0
216
| first_mask_gen_count
int64 1
16
| first_mask_tokens
stringlengths 0
16
| first_mask_gen_count_real
int64 0
18
| generated_smiles
stringlengths 12
233
| original_smiles
stringlengths 12
224
| generated_tokens
stringlengths 0
18
|
|---|---|---|---|---|---|---|---|---|
<|startoftext|><L>COC(=O)[C@<mask_1:7>1C(=O)C2=C(C[C@@H]1C)Nc1ccccc1N[C@H]2c1c(F)cccc1Cl<mask_1:7> | 2 | 10 | 7 | H] | 7 | COC(=O)[C@@H](C)N1C(=O)C2=C(C[C@@H]1C)Nc1ccccc1N[C@H]2c1c(F)cccc1Cl | COC(=O)[C@H]1C(=O)C2=C(C[C@@H]1C)Nc1ccccc1N[C@H]2c1c(F)cccc1Cl | @H](C)N |
<|startoftext|><L>COC(=O)[C@H]1C(=O)C2=C(C[C@@H]1C)Nc1ccccc1N[C@H]2<mask_1:9>cc1Cl<mask_1:9> | 8 | 49 | 9 | c1c(F)cc | 9 | COC(=O)[C@H]1C(=O)C2=C(C[C@@H]1C)Nc1ccccc1N[C@H]2c1c(Cl)cccc1Cl | COC(=O)[C@H]1C(=O)C2=C(C[C@@H]1C)Nc1ccccc1N[C@H]2c1c(F)cccc1Cl | c1c(Cl)cc |
<|startoftext|><L>COC(=O)[C@H]1C(=O)C2=C(C[C@@H]1C)Nc1ccc<mask_1:9>]2c1c(F)cccc1Cl<mask_1:9> | 8 | 39 | 9 | cc1N[C@H | 9 | COC(=O)[C@H]1C(=O)C2=C(C[C@@H]1C)Nc1ccccc1N[C@@H]2c1c(F)cccc1Cl | COC(=O)[C@H]1C(=O)C2=C(C[C@@H]1C)Nc1ccccc1N[C@H]2c1c(F)cccc1Cl | cc1N[C@@H |
<|startoftext|><L>COC(=O)[C@H]1C(=O)C2=C<mask_1:5>]1C)Nc1ccccc1N[C@H]2c1c(F)cccc1Cl<mask_1:5> | 7 | 22 | 5 | (C[C@@H | 5 | COC(=O)[C@H]1C(=O)C2=C(C[C@]1C)Nc1ccccc1N[C@H]2c1c(F)cccc1Cl | COC(=O)[C@H]1C(=O)C2=C(C[C@@H]1C)Nc1ccccc1N[C@H]2c1c(F)cccc1Cl | (C[C@ |
<|startoftext|><L>COC(=O)[C@H]1C<mask_1:2>C(C[C@@H]1C)Nc1ccccc1N[C@H]2c1c(F)cccc1Cl<mask_1:2> | 7 | 14 | 2 | (=O)C2= | 2 | COC(=O)[C@H]1C2=C(C[C@@H]1C)Nc1ccccc1N[C@H]2c1c(F)cccc1Cl | COC(=O)[C@H]1C(=O)C2=C(C[C@@H]1C)Nc1ccccc1N[C@H]2c1c(F)cccc1Cl | 2= |
<|startoftext|><L>COC<mask_1:7>O)[C@H]1C(=O)C2=C(C[C@@H]1C)Nc1ccccc1N[C@H]2c1c(F)cccc1Cl<mask_1:7> | 2 | 3 | 7 | (= | 7 | COCCCCNC(=O)[C@H]1C(=O)C2=C(C[C@@H]1C)Nc1ccccc1N[C@H]2c1c(F)cccc1Cl | COC(=O)[C@H]1C(=O)C2=C(C[C@@H]1C)Nc1ccccc1N[C@H]2c1c(F)cccc1Cl | CCCNC(= |
<|startoftext|><L>COC(=O)[C@H]1C(=O)C2=C<mask_1:4>]1C)Nc1ccccc1N[C@H]2c1c(F)cccc1Cl<mask_1:4> | 7 | 22 | 4 | (C[C@@H | 4 | COC(=O)[C@H]1C(=O)C2=C(C[C]1C)Nc1ccccc1N[C@H]2c1c(F)cccc1Cl | COC(=O)[C@H]1C(=O)C2=C(C[C@@H]1C)Nc1ccccc1N[C@H]2c1c(F)cccc1Cl | (C[C |
<|startoftext|><L>COC(=O)<mask_1:8>O)C2=C(C[C@@H]1C)Nc1ccccc1N[C@H]2c1c(F)cccc1Cl<mask_1:8> | 9 | 7 | 8 | [C@H]1C(= | 8 | COC(=O)[C@H]1C(O)C2=C(C[C@@H]1C)Nc1ccccc1N[C@H]2c1c(F)cccc1Cl | COC(=O)[C@H]1C(=O)C2=C(C[C@@H]1C)Nc1ccccc1N[C@H]2c1c(F)cccc1Cl | [C@H]1C( |
<|startoftext|><L>COC(=O)[C@H]1C(=O)C2=C(C[C@@H]1C)Nc1ccccc1N[C@H]2c1c(F)<mask_1:6>Cl<mask_1:6> | 5 | 55 | 6 | cccc1 | 6 | COC(=O)[C@H]1C(=O)C2=C(C[C@@H]1C)Nc1ccccc1N[C@H]2c1c(F)cccc1CCl | COC(=O)[C@H]1C(=O)C2=C(C[C@@H]1C)Nc1ccccc1N[C@H]2c1c(F)cccc1Cl | cccc1C |
<|startoftext|><L>COC(<mask_1:7>@H]1C(=O)C2=C(C[C@@H]1C)Nc1ccccc1N[C@H]2c1c(F)cccc1Cl<mask_1:7> | 5 | 4 | 7 | =O)[C | 7 | COC(=O)C[C@@H]1C(=O)C2=C(C[C@@H]1C)Nc1ccccc1N[C@H]2c1c(F)cccc1Cl | COC(=O)[C@H]1C(=O)C2=C(C[C@@H]1C)Nc1ccccc1N[C@H]2c1c(F)cccc1Cl | =O)C[C@ |
<|startoftext|><L>CN(Cc<mask_1:3>ccc(Cl)s1)c1nc2ccccc2o1<mask_1:3> | 1 | 5 | 3 | 1 | 3 | CN(Cc1ccccc(Cl)s1)c1nc2ccccc2o1 | CN(Cc1ccc(Cl)s1)c1nc2ccccc2o1 | 1cc |
<|startoftext|><L>CN(Cc1ccc(Cl)<mask_1:4>1)c1nc2ccccc2o1<mask_1:4> | 1 | 13 | 4 | s | 4 | CN(Cc1ccc(Cl)[nH]1)c1nc2ccccc2o1 | CN(Cc1ccc(Cl)s1)c1nc2ccccc2o1 | [nH] |
<|startoftext|><L>CN(Cc1ccc(C<mask_1:1>l)s1)c1nc2ccccc2o1<mask_1:1> | 0 | 11 | 1 | 1 | CN(Cc1ccc(CCl)s1)c1nc2ccccc2o1 | CN(Cc1ccc(Cl)s1)c1nc2ccccc2o1 | C |
|
<|startoftext|><L>CN(Cc1ccc(Cl)s1)<mask_1:4>c2ccccc2o1<mask_1:4> | 3 | 16 | 4 | c1n | 4 | CN(Cc1ccc(Cl)s1)Cc1nc2ccccc2o1 | CN(Cc1ccc(Cl)s1)c1nc2ccccc2o1 | Cc1n |
<|startoftext|><L>CN<mask_1:1>(Cc1ccc(Cl)s1)c1nc2ccccc2o1<mask_1:1> | 0 | 2 | 1 | 1 | CNN(Cc1ccc(Cl)s1)c1nc2ccccc2o1 | CN(Cc1ccc(Cl)s1)c1nc2ccccc2o1 | N |
|
<|startoftext|><L>CN(Cc1ccc(Cl)s1)c1nc2c<mask_1:3>2o1<mask_1:3> | 4 | 22 | 3 | cccc | 3 | CN(Cc1ccc(Cl)s1)c1nc2ccsc2o1 | CN(Cc1ccc(Cl)s1)c1nc2ccccc2o1 | csc |
<|startoftext|><L>CN(<mask_1:4>1ccc(Cl)s1)c1nc2ccccc2o1<mask_1:4> | 2 | 3 | 4 | Cc | 4 | CN(CCOc1ccc(Cl)s1)c1nc2ccccc2o1 | CN(Cc1ccc(Cl)s1)c1nc2ccccc2o1 | CCOc |
<|startoftext|><L>CN(Cc1c<mask_1:4>Cl)s1)c1nc2ccccc2o1<mask_1:4> | 3 | 7 | 4 | cc( | 4 | CN(Cc1ccc(CCl)s1)c1nc2ccccc2o1 | CN(Cc1ccc(Cl)s1)c1nc2ccccc2o1 | cc(C |
<|startoftext|><L>CN(C<mask_1:3>c1ccc(Cl)s1)c1nc2ccccc2o1<mask_1:3> | 0 | 4 | 3 | 3 | CN(CCCOc1ccc(Cl)s1)c1nc2ccccc2o1 | CN(Cc1ccc(Cl)s1)c1nc2ccccc2o1 | CCO |
|
<|startoftext|><L>CN(Cc1ccc(Cl)s1)c1nc2c<mask_1:1>cc2o1<mask_1:1> | 2 | 22 | 1 | cc | 1 | CN(Cc1ccc(Cl)s1)c1nc2cscc2o1 | CN(Cc1ccc(Cl)s1)c1nc2ccccc2o1 | s |
<|startoftext|><L>Cc1cc(S(=O)(=O)N2C<mask_1:3>nnc3C2)sc1Br<mask_1:3> | 4 | 18 | 3 | Cn3c | 3 | Cc1cc(S(=O)(=O)N2Cn3cnnc3C2)sc1Br | Cc1cc(S(=O)(=O)N2CCn3cnnc3C2)sc1Br | n3c |
<|startoftext|><L>Cc1cc(S(=O)(=O)N2CCn3c<mask_1:4>2)sc1Br<mask_1:4> | 5 | 22 | 4 | nnc3C | 4 | Cc1cc(S(=O)(=O)N2CCn3ccnc32)sc1Br | Cc1cc(S(=O)(=O)N2CCn3cnnc3C2)sc1Br | cnc3 |
<|startoftext|><L>Cc1cc(S(=O)(=<mask_1:5>CCn3cnnc3C2)sc1Br<mask_1:5> | 4 | 13 | 5 | O)N2 | 5 | Cc1cc(S(=O)(=O)N2CCCn3cnnc3C2)sc1Br | Cc1cc(S(=O)(=O)N2CCn3cnnc3C2)sc1Br | O)N2C |
<|startoftext|><L>Cc1cc(S(=O)(=O)N2CCn3cnnc<mask_1:2>c1Br<mask_1:2> | 5 | 25 | 2 | 3C2)s | 3 | Cc1cc(S(=O)(=O)N2CCn3cnnc32)c1Br | Cc1cc(S(=O)(=O)N2CCn3cnnc3C2)sc1Br | 32) |
<|startoftext|><L>Cc1cc(S(=O)(=O)N2C<mask_1:3>nnc3C2)sc1Br<mask_1:3> | 4 | 18 | 3 | Cn3c | 3 | Cc1cc(S(=O)(=O)N2Cn3cnnc3C2)sc1Br | Cc1cc(S(=O)(=O)N2CCn3cnnc3C2)sc1Br | n3c |
<|startoftext|><L>Cc1cc(S(=O)(=O)N2CCn3cn<mask_1:3>2)sc1Br<mask_1:3> | 4 | 23 | 3 | nc3C | 3 | Cc1cc(S(=O)(=O)N2CCn3cncc32)sc1Br | Cc1cc(S(=O)(=O)N2CCn3cnnc3C2)sc1Br | cc3 |
<|startoftext|><L>Cc1cc(S(=O)(=O)N2CCn3cnnc3C2<mask_1:5>Br<mask_1:5> | 4 | 28 | 5 | )sc1 | 5 | Cc1cc(S(=O)(=O)N2CCn3cnnc3C2)ccc1Br | Cc1cc(S(=O)(=O)N2CCn3cnnc3C2)sc1Br | )ccc1 |
<|startoftext|><L>Cc1cc(S(=O)(<mask_1:5>2CCn3cnnc3C2)sc1Br<mask_1:5> | 4 | 12 | 5 | =O)N | 5 | Cc1cc(S(=O)(=O)NC2CCn3cnnc3C2)sc1Br | Cc1cc(S(=O)(=O)N2CCn3cnnc3C2)sc1Br | =O)NC |
<|startoftext|><L>Cc1cc(S(=O)(=O)N<mask_1:1>Cn3cnnc3C2)sc1Br<mask_1:1> | 2 | 16 | 1 | 2C | 1 | Cc1cc(S(=O)(=O)N2Cn3cnnc3C2)sc1Br | Cc1cc(S(=O)(=O)N2CCn3cnnc3C2)sc1Br | 2 |
<|startoftext|><L>Cc1cc(<mask_1:1>S(=O)(=O)N2CCn3cnnc3C2)sc1Br<mask_1:1> | 0 | 6 | 1 | 1 | Cc1cc(CS(=O)(=O)N2CCn3cnnc3C2)sc1Br | Cc1cc(S(=O)(=O)N2CCn3cnnc3C2)sc1Br | C |
|
<|startoftext|><L>CSc1ccc([C@H]2C(C(=O)OC3CCCCC<mask_1:2>Nc3ncnn32)cc1<mask_1:2> | 7 | 29 | 2 | 3)=C(C) | 2 | CSc1ccc([C@H]2C(C(=O)OC3CCCCC3)Nc3ncnn32)cc1 | CSc1ccc([C@H]2C(C(=O)OC3CCCCC3)=C(C)Nc3ncnn32)cc1 | 3) |
<|startoftext|><L>CSc1ccc([C@H]2C<mask_1:7>=O)OC3CCCCC3)=C(C)Nc3ncnn32)cc1<mask_1:7> | 3 | 15 | 7 | (C( | 7 | CSc1ccc([C@H]2C(C)C(C(=O)OC3CCCCC3)=C(C)Nc3ncnn32)cc1 | CSc1ccc([C@H]2C(C(=O)OC3CCCCC3)=C(C)Nc3ncnn32)cc1 | (C)C(C( |
<|startoftext|><L>CSc1ccc([C@H]2C(C(=O)OC3CCCCC3)=C(C)Nc3ncn<mask_1:5>n32)cc1<mask_1:5> | 0 | 42 | 5 | 5 | CSc1ccc([C@H]2C(C(=O)OC3CCCCC3)=C(C)Nc3ncnc(=O)n32)cc1 | CSc1ccc([C@H]2C(C(=O)OC3CCCCC3)=C(C)Nc3ncnn32)cc1 | c(=O) |
|
<|startoftext|><L>CSc1ccc([C@H]2C(C(=O)OC3CC<mask_1:3>CC3)=C(C)Nc3ncnn32)cc1<mask_1:3> | 1 | 26 | 3 | C | 3 | CSc1ccc([C@H]2C(C(=O)OC3CCCCCCC3)=C(C)Nc3ncnn32)cc1 | CSc1ccc([C@H]2C(C(=O)OC3CCCCC3)=C(C)Nc3ncnn32)cc1 | CCC |
<|startoftext|><L>CSc1ccc([C@H]2C(C(=O)O<mask_1:7>CCCCC3)=C(C)Nc3ncnn32)cc1<mask_1:7> | 2 | 22 | 7 | C3 | 7 | CSc1ccc([C@H]2C(C(=O)OCCOC3=CCCCCC3)=C(C)Nc3ncnn32)cc1 | CSc1ccc([C@H]2C(C(=O)OC3CCCCC3)=C(C)Nc3ncnn32)cc1 | CCOC3=C |
<|startoftext|><L>CSc1ccc([C@H]2C(C(=O)OC3CCCCC3)=C(<mask_1:2>c3ncnn32)cc1<mask_1:2> | 3 | 34 | 2 | C)N | 2 | CSc1ccc([C@H]2C(C(=O)OC3CCCCC3)=C(C)c3ncnn32)cc1 | CSc1ccc([C@H]2C(C(=O)OC3CCCCC3)=C(C)Nc3ncnn32)cc1 | C) |
<|startoftext|><L>CSc1ccc([C@H]2C(C(=O)OC3CCCCC3)=C(C)<mask_1:7>Nc3ncnn32)cc1<mask_1:7> | 0 | 36 | 7 | 7 | CSc1ccc([C@H]2C(C(=O)OC3CCCCC3)=C(C)NC(N)=NNc3ncnn32)cc1 | CSc1ccc([C@H]2C(C(=O)OC3CCCCC3)=C(C)Nc3ncnn32)cc1 | NC(N)=N |
|
<|startoftext|><L>CSc1ccc([C@H]2C(C<mask_1:6>(=O)OC3CCCCC3)=C(C)Nc3ncnn32)cc1<mask_1:6> | 0 | 17 | 6 | 6 | CSc1ccc([C@H]2C(C(=O)CC(=O)OC3CCCCC3)=C(C)Nc3ncnn32)cc1 | CSc1ccc([C@H]2C(C(=O)OC3CCCCC3)=C(C)Nc3ncnn32)cc1 | (=O)CC |
|
<|startoftext|><L>CSc1ccc<mask_1:3>C@H]2C(C(=O)OC3CCCCC3)=C(C)Nc3ncnn32)cc1<mask_1:3> | 2 | 7 | 3 | ([ | 3 | CSc1ccc(C[C@H]2C(C(=O)OC3CCCCC3)=C(C)Nc3ncnn32)cc1 | CSc1ccc([C@H]2C(C(=O)OC3CCCCC3)=C(C)Nc3ncnn32)cc1 | (C[ |
<|startoftext|><L><mask_1:5>1ccc([C@H]2C(C(=O)OC3CCCCC3)=C(C)Nc3ncnn32)cc1<mask_1:5> | 3 | 0 | 5 | CSc | 5 | CCCOc1ccc([C@H]2C(C(=O)OC3CCCCC3)=C(C)Nc3ncnn32)cc1 | CSc1ccc([C@H]2C(C(=O)OC3CCCCC3)=C(C)Nc3ncnn32)cc1 | CCCOc |
<|startoftext|><L>Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](C(N<mask_1:7>O)c1ccccc1<mask_1:7> | 2 | 42 | 7 | )= | 7 | Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](C(N)=O)C(=O)c1ccccc1 | Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](C(N)=O)c1ccccc1 | )=O)C(= |
<|startoftext|><L>Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](<mask_1:7>O)c1ccccc1<mask_1:7> | 5 | 39 | 7 | C(N)= | 7 | Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](CCO)C(=O)c1ccccc1 | Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](C(N)=O)c1ccccc1 | CCO)C(= |
<|startoftext|><L>Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](C(N)=O<mask_1:5>)c1ccccc1<mask_1:5> | 0 | 45 | 5 | 5 | Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](C(N)=O)C(=O)c1ccccc1 | Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](C(N)=O)c1ccccc1 | )C(=O |
|
<|startoftext|><L>Cc1ccc([N+](=O)[O-])cc<mask_1:7>=O)(=O)N[C@H](C(N)=O)c1ccccc1<mask_1:7> | 3 | 22 | 7 | 1S( | 7 | Cc1ccc([N+](=O)[O-])cc1N(C)S(=O)(=O)N[C@H](C(N)=O)c1ccccc1 | Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](C(N)=O)c1ccccc1 | 1N(C)S( |
<|startoftext|><L>Cc1ccc([N+](=O)[O-])cc1S(=O<mask_1:3>@H](C(N)=O)c1ccccc1<mask_1:3> | 8 | 27 | 3 | )(=O)N[C | 3 | Cc1ccc([N+](=O)[O-])cc1S(=O)[C@H](C(N)=O)c1ccccc1 | Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](C(N)=O)c1ccccc1 | )[C |
<|startoftext|><L>Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N<mask_1:2>(N)=O)c1ccccc1<mask_1:2> | 7 | 33 | 2 | [C@H](C | 2 | Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C(N)=O)c1ccccc1 | Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](C(N)=O)c1ccccc1 | (C |
<|startoftext|><L>Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N<mask_1:8>@H](C(N)=O)c1ccccc1<mask_1:8> | 2 | 33 | 8 | [C | 8 | Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC(=O)N[C@H](C(N)=O)c1ccccc1 | Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](C(N)=O)c1ccccc1 | C(=O)N[C |
<|startoftext|><L>Cc1ccc([N+](=O)[O-])cc<mask_1:6>)(=O)N[C@H](C(N)=O)c1ccccc1<mask_1:6> | 5 | 22 | 6 | 1S(=O | 6 | Cc1ccc([N+](=O)[O-])cc1CS(=O)(=O)N[C@H](C(N)=O)c1ccccc1 | Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](C(N)=O)c1ccccc1 | 1CS(=O |
<|startoftext|><L>C<mask_1:3>c([N+](=O)[O-])cc1S(=O)(=O)N[C@H](C(N)=O)c1ccccc1<mask_1:3> | 4 | 1 | 3 | c1cc | 3 | Cn1cc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](C(N)=O)c1ccccc1 | Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](C(N)=O)c1ccccc1 | n1c |
<|startoftext|><L>Cc1ccc([N+](=O)[O-])cc1S(=O)(=<mask_1:5>[C@H](C(N)=O)c1ccccc1<mask_1:5> | 3 | 30 | 5 | O)N | 5 | Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCC[C@H](C(N)=O)c1ccccc1 | Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H](C(N)=O)c1ccccc1 | O)NCC |
<|startoftext|><L>C<mask_1:5>)CN(CC)C(=O)C1CCN(Cc2ccccc2O)CC1<mask_1:5> | 4 | 1 | 5 | =C(C | 5 | CNC(=O)CN(CC)C(=O)C1CCN(Cc2ccccc2O)CC1 | C=C(C)CN(CC)C(=O)C1CCN(Cc2ccccc2O)CC1 | NC(=O |
<|startoftext|><L>C=C(C)CN(CC<mask_1:1>(=O)C1CCN(Cc2ccccc2O)CC1<mask_1:1> | 2 | 11 | 1 | )C | 1 | C=C(C)CN(CC)(=O)C1CCN(Cc2ccccc2O)CC1 | C=C(C)CN(CC)C(=O)C1CCN(Cc2ccccc2O)CC1 | ) |
<|startoftext|><L>C=C(<mask_1:2>CC)C(=O)C1CCN(Cc2ccccc2O)CC1<mask_1:2> | 5 | 4 | 2 | C)CN( | 2 | C=C(COCC)C(=O)C1CCN(Cc2ccccc2O)CC1 | C=C(C)CN(CC)C(=O)C1CCN(Cc2ccccc2O)CC1 | CO |
<|startoftext|><L>C=C(C)<mask_1:2>CC)C(=O)C1CCN(Cc2ccccc2O)CC1<mask_1:2> | 3 | 6 | 2 | CN( | 2 | C=C(C)N(CC)C(=O)C1CCN(Cc2ccccc2O)CC1 | C=C(C)CN(CC)C(=O)C1CCN(Cc2ccccc2O)CC1 | N( |
<|startoftext|><L>C=C(C)CN(CC)C(=O)C1CC<mask_1:4>N(Cc2ccccc2O)CC1<mask_1:4> | 0 | 21 | 4 | 4 | C=C(C)CN(CC)C(=O)C1CCC(C)N(Cc2ccccc2O)CC1 | C=C(C)CN(CC)C(=O)C1CCN(Cc2ccccc2O)CC1 | C(C) |
|
<|startoftext|><L>C=C(C)CN(CC)C(=O)C1CCN(Cc2<mask_1:3>c2O)CC1<mask_1:3> | 4 | 26 | 3 | cccc | 3 | C=C(C)CN(CC)C(=O)C1CCN(Cc2nonc2O)CC1 | C=C(C)CN(CC)C(=O)C1CCN(Cc2ccccc2O)CC1 | non |
<|startoftext|><L>C=C(C)CN(CC)C(=O<mask_1:5>1CCN(Cc2ccccc2O)CC1<mask_1:5> | 2 | 16 | 5 | )C | 5 | C=C(C)CN(CC)C(=O)NCCN1CCN(Cc2ccccc2O)CC1 | C=C(C)CN(CC)C(=O)C1CCN(Cc2ccccc2O)CC1 | )NCCN |
<|startoftext|><L>C=C(C)CN(CC)C(=O)<mask_1:5>CN(Cc2ccccc2O)CC1<mask_1:5> | 3 | 17 | 5 | C1C | 5 | C=C(C)CN(CC)C(=O)NCC1CCN(Cc2ccccc2O)CC1 | C=C(C)CN(CC)C(=O)C1CCN(Cc2ccccc2O)CC1 | NCC1C |
<|startoftext|><L>C=C(<mask_1:5>CN(CC)C(=O)C1CCN(Cc2ccccc2O)CC1<mask_1:5> | 2 | 4 | 5 | C) | 5 | C=C(Cl)CCCN(CC)C(=O)C1CCN(Cc2ccccc2O)CC1 | C=C(C)CN(CC)C(=O)C1CCN(Cc2ccccc2O)CC1 | Cl)CC |
<|startoftext|><L>C=C(C)CN(CC)C(=O)C1CCN(Cc2cccc<mask_1:2>)CC1<mask_1:2> | 3 | 30 | 2 | c2O | 2 | C=C(C)CN(CC)C(=O)C1CCN(Cc2ccccn2)CC1 | C=C(C)CN(CC)C(=O)C1CCN(Cc2ccccc2O)CC1 | n2 |
<|startoftext|><L>O=C(Nc1ccc(N2CCCCC2)nc1)N<mask_1:4>C@@H]1CCOC1)C1CC1<mask_1:4> | 3 | 25 | 4 | (C[ | 4 | O=C(Nc1ccc(N2CCCCC2)nc1)N(CC[C@@H]1CCOC1)C1CC1 | O=C(Nc1ccc(N2CCCCC2)nc1)N(C[C@@H]1CCOC1)C1CC1 | (CC[ |
<|startoftext|><L>O=C(Nc1ccc(N2CCCCC2)nc1)N(C[C@@H]1CCO<mask_1:2>C1CC1<mask_1:2> | 3 | 37 | 2 | C1) | 2 | O=C(Nc1ccc(N2CCCCC2)nc1)N(C[C@@H]1CCO1)C1CC1 | O=C(Nc1ccc(N2CCCCC2)nc1)N(C[C@@H]1CCOC1)C1CC1 | 1) |
<|startoftext|><L>O=C(Nc1ccc(N2CCCCC2)nc1)N(C[C@@H]1CCOC1)C1<mask_1:4>C1<mask_1:4> | 1 | 42 | 4 | C | 4 | O=C(Nc1ccc(N2CCCCC2)nc1)N(C[C@@H]1CCOC1)C1CCCCC1 | O=C(Nc1ccc(N2CCCCC2)nc1)N(C[C@@H]1CCOC1)C1CC1 | CCCC |
<|startoftext|><L>O=C(Nc1ccc<mask_1:6>CCCCC2)nc1)N(C[C@@H]1CCOC1)C1CC1<mask_1:6> | 3 | 10 | 6 | (N2 | 6 | O=C(Nc1ccc(OCCN2CCCCC2)nc1)N(C[C@@H]1CCOC1)C1CC1 | O=C(Nc1ccc(N2CCCCC2)nc1)N(C[C@@H]1CCOC1)C1CC1 | (OCCN2 |
<|startoftext|><L>O=C(Nc1ccc(N2CCCCC2)nc1)N(C[C@@<mask_1:6>OC1)C1CC1<mask_1:6> | 5 | 31 | 6 | H]1CC | 6 | O=C(Nc1ccc(N2CCCCC2)nc1)N(C[C@@H]1CCCOC1)C1CC1 | O=C(Nc1ccc(N2CCCCC2)nc1)N(C[C@@H]1CCOC1)C1CC1 | H]1CCC |
<|startoftext|><L>O=C(Nc1ccc(N2CCCCC2)nc1)N(C[C@@H]1CCOC1)C<mask_1:3>C1<mask_1:3> | 2 | 41 | 3 | 1C | 3 | O=C(Nc1ccc(N2CCCCC2)nc1)N(C[C@@H]1CCOC1)C1CCC1 | O=C(Nc1ccc(N2CCCCC2)nc1)N(C[C@@H]1CCOC1)C1CC1 | 1CC |
<|startoftext|><L>O=C(Nc1ccc(N2CCCCC2)nc1)N(C[C@<mask_1:3>CCOC1)C1CC1<mask_1:3> | 4 | 30 | 3 | @H]1 | 3 | O=C(Nc1ccc(N2CCCCC2)nc1)N(C[C@H]1CCOC1)C1CC1 | O=C(Nc1ccc(N2CCCCC2)nc1)N(C[C@@H]1CCOC1)C1CC1 | H]1 |
<|startoftext|><L>O=C(Nc1ccc(N2<mask_1:3>C2)nc1)N(C[C@@H]1CCOC1)C1CC1<mask_1:3> | 4 | 13 | 3 | CCCC | 3 | O=C(Nc1ccc(N2CCCC2)nc1)N(C[C@@H]1CCOC1)C1CC1 | O=C(Nc1ccc(N2CCCCC2)nc1)N(C[C@@H]1CCOC1)C1CC1 | CCC |
<|startoftext|><L>O=C(Nc1ccc(N2CCCCC<mask_1:5>1)N(C[C@@H]1CCOC1)C1CC1<mask_1:5> | 4 | 18 | 5 | 2)nc | 5 | O=C(Nc1ccc(N2CCCCCC2)cn1)N(C[C@@H]1CCOC1)C1CC1 | O=C(Nc1ccc(N2CCCCC2)nc1)N(C[C@@H]1CCOC1)C1CC1 | C2)cn |
<|startoftext|><L>O=C(Nc1cc<mask_1:3>N2CCCCC2)nc1)N(C[C@@H]1CCOC1)C1CC1<mask_1:3> | 2 | 9 | 3 | c( | 3 | O=C(Nc1ccc(CN2CCCCC2)nc1)N(C[C@@H]1CCOC1)C1CC1 | O=C(Nc1ccc(N2CCCCC2)nc1)N(C[C@@H]1CCOC1)C1CC1 | c(C |
<|startoftext|><L>C<mask_1:4>CCNCc1ccc2c(c1)n(C)c(=O)n2C<mask_1:4> | 1 | 1 | 4 | = | 4 | C=CCNCCNCc1ccc2c(c1)n(C)c(=O)n2C | C=CCNCc1ccc2c(c1)n(C)c(=O)n2C | =CCN |
<|startoftext|><L>C<mask_1:3>=CCNCc1ccc2c(c1)n(C)c(=O)n2C<mask_1:3> | 0 | 1 | 3 | 3 | CCOC=CCNCc1ccc2c(c1)n(C)c(=O)n2C | C=CCNCc1ccc2c(c1)n(C)c(=O)n2C | COC |
|
<|startoftext|><L>C=CCNCc1ccc2c(c1<mask_1:3>n(C)c(=O)n2C<mask_1:3> | 1 | 16 | 3 | ) | 3 | C=CCNCc1ccc2c(c1)ccn(C)c(=O)n2C | C=CCNCc1ccc2c(c1)n(C)c(=O)n2C | )cc |
<|startoftext|><L>C=CCNCc1ccc2c(c1<mask_1:2>C)c(=O)n2C<mask_1:2> | 3 | 16 | 2 | )n( | 2 | C=CCNCc1ccc2c(c1OCC)c(=O)n2C | C=CCNCc1ccc2c(c1)n(C)c(=O)n2C | OC |
<|startoftext|><L><mask_1:4>C=CCNCc1ccc2c(c1)n(C)c(=O)n2C<mask_1:4> | 0 | 0 | 4 | 4 | CCCCC=CCNCc1ccc2c(c1)n(C)c(=O)n2C | C=CCNCc1ccc2c(c1)n(C)c(=O)n2C | CCCC |
|
<|startoftext|><L>C<mask_1:1>CNCc1ccc2c(c1)n(C)c(=O)n2C<mask_1:1> | 2 | 1 | 1 | =C | 1 | CCCNCc1ccc2c(c1)n(C)c(=O)n2C | C=CCNCc1ccc2c(c1)n(C)c(=O)n2C | C |
<|startoftext|><L>C=CCNCc1ccc2c(c1)<mask_1:4>)c(=O)n2C<mask_1:4> | 3 | 17 | 4 | n(C | 4 | C=CCNCc1ccc2c(c1)n(CC)c(=O)n2C | C=CCNCc1ccc2c(c1)n(C)c(=O)n2C | n(CC |
<|startoftext|><L>C=CCNCc1c<mask_1:4>cc2c(c1)n(C)c(=O)n2C<mask_1:4> | 0 | 9 | 4 | 4 | C=CCNCc1c(Br)cc2c(c1)n(C)c(=O)n2C | C=CCNCc1ccc2c(c1)n(C)c(=O)n2C | (Br) |
|
<|startoftext|><L>C=CCNCc<mask_1:1>c2c(c1)n(C)c(=O)n2C<mask_1:1> | 3 | 7 | 1 | 1cc | 1 | C=CCNCc1c2c(c1)n(C)c(=O)n2C | C=CCNCc1ccc2c(c1)n(C)c(=O)n2C | 1 |
<|startoftext|><L>C=CCNCc1ccc2c(c1)n<mask_1:4>)c(=O)n2C<mask_1:4> | 2 | 18 | 4 | (C | 4 | C=CCNCc1ccc2c(c1)n(CCO)c(=O)n2C | C=CCNCc1ccc2c(c1)n(C)c(=O)n2C | (CCO |
<|startoftext|><L>O=C(C<mask_1:5>O)c1cccc2ccccc12)Nc1c(Cl)cccc1Cl<mask_1:5> | 4 | 5 | 5 | OC(= | 5 | O=C(CCNC(=O)c1cccc2ccccc12)Nc1c(Cl)cccc1Cl | O=C(COC(=O)c1cccc2ccccc12)Nc1c(Cl)cccc1Cl | CNC(= |
<|startoftext|><L>O=C(COC(=O)c1cccc2ccccc12<mask_1:6>c1c(Cl)cccc1Cl<mask_1:6> | 2 | 25 | 6 | )N | 6 | O=C(COC(=O)c1cccc2ccccc12)NCCSCc1c(Cl)cccc1Cl | O=C(COC(=O)c1cccc2ccccc12)Nc1c(Cl)cccc1Cl | )NCCSC |
<|startoftext|><L>O=C(COC(=O)c1<mask_1:4>ccccc12)Nc1c(Cl)cccc1Cl<mask_1:4> | 5 | 13 | 4 | cccc2 | 4 | O=C(COC(=O)c1noc2ccccc12)Nc1c(Cl)cccc1Cl | O=C(COC(=O)c1cccc2ccccc12)Nc1c(Cl)cccc1Cl | noc2 |
<|startoftext|><L>O=C(COC(=O)c1cccc2<mask_1:1>ccc12)Nc1c(Cl)cccc1Cl<mask_1:1> | 2 | 18 | 1 | cc | 1 | O=C(COC(=O)c1cccc2sccc12)Nc1c(Cl)cccc1Cl | O=C(COC(=O)c1cccc2ccccc12)Nc1c(Cl)cccc1Cl | s |
<|startoftext|><L>O=C(C<mask_1:3>OC(=O)c1cccc2ccccc12)Nc1c(Cl)cccc1Cl<mask_1:3> | 0 | 5 | 3 | 3 | O=C(CCCCOC(=O)c1cccc2ccccc12)Nc1c(Cl)cccc1Cl | O=C(COC(=O)c1cccc2ccccc12)Nc1c(Cl)cccc1Cl | CCC |
|
<|startoftext|><L>O=C(COC(=O)c1ccc<mask_1:5>2ccccc12)Nc1c(Cl)cccc1Cl<mask_1:5> | 1 | 16 | 5 | c | 5 | O=C(COC(=O)c1ccc(Cl)c2ccccc12)Nc1c(Cl)cccc1Cl | O=C(COC(=O)c1cccc2ccccc12)Nc1c(Cl)cccc1Cl | (Cl)c |
<|startoftext|><L>O=C(COC(=O)c1cccc2ccccc12)Nc1c<mask_1:1>cc1Cl<mask_1:1> | 6 | 30 | 1 | (Cl)cc | 1 | O=C(COC(=O)c1cccc2ccccc12)Nc1cscc1Cl | O=C(COC(=O)c1cccc2ccccc12)Nc1c(Cl)cccc1Cl | s |
<|startoftext|><L>O=C(COC(=O)c1cccc2ccccc12)Nc1c(Cl)c<mask_1:4>l<mask_1:4> | 5 | 35 | 4 | ccc1C | 4 | O=C(COC(=O)c1cccc2ccccc12)Nc1c(Cl)csc1Cl | O=C(COC(=O)c1cccc2ccccc12)Nc1c(Cl)cccc1Cl | sc1C |
<|startoftext|><L>O=C(COC(=O)c1cccc2ccccc12)Nc1c(Cl<mask_1:4>1Cl<mask_1:4> | 5 | 33 | 4 | )cccc | 4 | O=C(COC(=O)c1cccc2ccccc12)Nc1c(Cl)nsc1Cl | O=C(COC(=O)c1cccc2ccccc12)Nc1c(Cl)cccc1Cl | )nsc |
<|startoftext|><L>O<mask_1:6>OC(=O)c1cccc2ccccc12)Nc1c(Cl)cccc1Cl<mask_1:6> | 4 | 1 | 6 | =C(C | 6 | O=C(NCCOC(=O)c1cccc2ccccc12)Nc1c(Cl)cccc1Cl | O=C(COC(=O)c1cccc2ccccc12)Nc1c(Cl)cccc1Cl | =C(NCC |
<|startoftext|><L>C<mask_1:4>CCn1nnnc1COc1ccc2c(C)cc(=O)oc2c1C<mask_1:4> | 1 | 1 | 4 | C | 4 | CC(C)CCn1nnnc1COc1ccc2c(C)cc(=O)oc2c1C | CCCCn1nnnc1COc1ccc2c(C)cc(=O)oc2c1C | C(C) |
<|startoftext|><L>CCCCn1nnnc1<mask_1:5>1ccc2c(C)cc(=O)oc2c1C<mask_1:5> | 3 | 11 | 5 | COc | 4 | CCCCn1nnnc1CNCc1ccc2c(C)cc(=O)oc2c1C | CCCCn1nnnc1COc1ccc2c(C)cc(=O)oc2c1C | CNCc |
<|startoftext|><L>CCCCn1nnnc1COc1ccc2c(C)cc(=O<mask_1:5>)oc2c1C<mask_1:5> | 0 | 28 | 5 | 5 | CCCCn1nnnc1COc1ccc2c(C)cc(=O)c(=O)oc2c1C | CCCCn1nnnc1COc1ccc2c(C)cc(=O)oc2c1C | )c(=O |
|
<|startoftext|><L>CCCCn1nnnc<mask_1:5>1ccc2c(C)cc(=O)oc2c1C<mask_1:5> | 4 | 10 | 5 | 1COc | 6 | CCCCn1nnnc1SCCOc1ccc2c(C)cc(=O)oc2c1C | CCCCn1nnnc1COc1ccc2c(C)cc(=O)oc2c1C | 1SCCOc |
<|startoftext|><L>CCCCn1nn<mask_1:5>Oc1ccc2c(C)cc(=O)oc2c1C<mask_1:5> | 4 | 8 | 5 | nc1C | 5 | CCCCn1nnnc1SCOc1ccc2c(C)cc(=O)oc2c1C | CCCCn1nnnc1COc1ccc2c(C)cc(=O)oc2c1C | nc1SC |
<|startoftext|><L>CCCCn1nnnc1<mask_1:3>cc2c(C)cc(=O)oc2c1C<mask_1:3> | 5 | 11 | 3 | COc1c | 3 | CCCCn1nnnc1Cn1cc2c(C)cc(=O)oc2c1C | CCCCn1nnnc1COc1ccc2c(C)cc(=O)oc2c1C | Cn1 |
<|startoftext|><L>C<mask_1:5>CCn1nnnc1COc1ccc2c(C)cc(=O)oc2c1C<mask_1:5> | 1 | 1 | 5 | C | 5 | C=CCCOCCn1nnnc1COc1ccc2c(C)cc(=O)oc2c1C | CCCCn1nnnc1COc1ccc2c(C)cc(=O)oc2c1C | =CCCO |
<|startoftext|><L>CC<mask_1:1>1nnnc1COc1ccc2c(C)cc(=O)oc2c1C<mask_1:1> | 3 | 2 | 1 | CCn | 1 | CCn1nnnc1COc1ccc2c(C)cc(=O)oc2c1C | CCCCn1nnnc1COc1ccc2c(C)cc(=O)oc2c1C | n |
<|startoftext|><L>CCCCn1nnnc1C<mask_1:5>1ccc2c(C)cc(=O)oc2c1C<mask_1:5> | 2 | 12 | 5 | Oc | 5 | CCCCn1nnnc1CN(C)c1ccc2c(C)cc(=O)oc2c1C | CCCCn1nnnc1COc1ccc2c(C)cc(=O)oc2c1C | N(C)c |
<|startoftext|><L>CCCCn1nnn<mask_1:5>Oc1ccc2c(C)cc(=O)oc2c1C<mask_1:5> | 3 | 9 | 5 | c1C | 5 | CCCCn1nnnc1SCCOc1ccc2c(C)cc(=O)oc2c1C | CCCCn1nnnc1COc1ccc2c(C)cc(=O)oc2c1C | c1SCC |