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Upload s2.csv

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  1. s2.csv +14 -0
s2.csv ADDED
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+ Compound_ID,SMILES,R1_10uM,R2_10uM,Mean_10uM
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+ BRD-K01826531,CN1CCC[C@@H](CC2c3ccccc3Sc3ccccc32)C1,0.058558997,0.059541308,0.059050153
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+ BRD-K66433595,NCc1cn(nc1C12CC3CC(CC(C3)C2)C1)-c1ccccc1,0.058685391,0.062335373,0.060510382
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+ BRD-K22127577,CC1(COC1)COc1ccc2n(cnc2c1)-c1ccc2cccc(c2n1)N1CCC(N)CC1,0.06045083,0.062972826,0.061711828
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+ BRD-K95435023,Cc1[nH]c(c(c1C(=O)N1CCC[C@@H]1CN1CCCC1)C)/C=C/1\C(=O)Nc2ccc(cc21)S(=O)(=O)Cc1c(cccc1Cl)Cl,0.061299768,0.065213744,0.063256756
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+ BRD-K69694239,COC(=O)[C@@]12CCC(C)(C)C[C@H]2[C@H]2C(=O)C=C3[C@@](C)(CC[C@H]4C(C)(C)C(=O)C(=C[C@@]43C)C#N)[C@]2(C)CC1,0.063381419,0.06407489,0.063728155
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+ BRD-K97764662,CCN(CC)CCCCNc1ncc2cc(c(nc2n1)NC(=O)NC(C)(C)C)-c1cc(cc(c1)OC)OC,0.065686148,0.06388288,0.064784514
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+ BRD-K59437938,COC(=O)[C@]12CCC(C)(C)C[C@@H]2[C@@H]2C(=O)C=C3[C@](C)(CC[C@@H]4C(C)(C)C(=O)C(=C[C@]43C)C#N)[C@@]2(C)CC1,0.062139944,0.069449377,0.06579466
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+ BRD-K47546584,Cc1ccc(cc1)S(=O)(=O)N(c1cccc(c1)-n1cc(nn1)CCC(=O)NO)S(=O)(=O)c1ccc(cc1)C,0.06659543,0.065064389,0.065829909
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+ BRD-K00003362,COC1=C(OC)C(=O)C(=C(C)C1=O)CCCCCCCCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1,0.065619872,0.066585119,0.066102495
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+ BRD-K00003205,COc1ccc2c(c1)N(CCN)C(=O)N2C(=O)[C@@H]1C[C@H](C)CC[C@H]1C(C)C,0.065693918,0.066835128,0.066264523
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+ BRD-K00003510,CCCNc1nc(ncc1C#CCCCNC(=O)[C@H](C)N(C)C(=O)/C=C/CN(C)C)Nc1ccc(cc1)C#N,0.066989891,0.066023249,0.06650657
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+ BRD-K82051706,C[C@@H]1CCCCO[C@H](CN(C)CC2CCCCC2)[C@H](C)CN([C@@H](C)CO)C(=O)c2cc(ccc2O1)NC(=O)Nc1ccc(cc1)C(F)(F)F,0.067375026,0.067050911,0.067212969
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+ BRD-K00004676,COCCN1CCC(CC1)N(Cc1ccc(cc1)-c1ccc(cc1)C(F)(F)F)C(=O)CN1C(=CC(=O)c2ccccc21)SCc1cccc(c1F)F,0.067896401,0.066845936,0.067371168