smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features C[C@H](C(=O)NNC(=S)NCC1CC1)n1nnc(N2CCOCC2)n1 12368435 RSQOGWSTHHPFHC-SECBINFHSA-N 354.440 -1.024 50 30 FAGC CSCC[C@H]1C(=O)N(C[C@H](C)C(=O)NN)C(=O)N1CCC(=O)NN 38656156 OUKWFLVXMRCNMD-IUCAKERBSA-N 360.440 -1.622 50 30 FAGC O=C(Cn1nnc(N2CCOCC2)n1)NNC(=S)NC(=O)C1CC1 2146156 JERFIKNBWBHEQX-UHFFFAOYSA-N 354.396 -2.058 50 30 FAGC O=C(CCSSCCC(=O)OC[C@H](O)CO)OC[C@@H](O)CO 31362235 JNJIFNOOWWLQIE-AOOOYVTPSA-N 358.434 -1.059 50 30 FAGC O=C(CCSSCCC(=O)OC[C@@H](O)CO)OC[C@@H](O)CO 5113846 JNJIFNOOWWLQIE-UWVGGRQHSA-N 358.434 -1.059 50 30 FAGC NCC(=O)N[C@@H](CSSC[C@H](NC(=O)CN)C(=O)O)C(=O)O 5328769 FHEXRJMTJAKHSB-WDSKDSINSA-N 354.410 -2.576 50 30 FAGC O=C(CCSSCCC(=O)OC[C@H](O)CO)OC[C@H](O)CO 5113843 JNJIFNOOWWLQIE-NXEZZACHSA-N 358.434 -1.059 50 30 FAGC CSCC[C@@H]1C(=O)N(C[C@H](C)C(=O)NN)C(=O)N1CCC(=O)NN 38656161 OUKWFLVXMRCNMD-DTWKUNHWSA-N 360.440 -1.622 50 30 FAGC CSCC[C@H]1C(=O)N(C[C@@H](C)C(=O)NN)C(=O)N1CCC(=O)NN 38656159 OUKWFLVXMRCNMD-BDAKNGLRSA-N 360.440 -1.622 50 30 FAGC CSCC[C@@H]1C(=O)N(C[C@@H](C)C(=O)NN)C(=O)N1CCC(=O)NN 38656163 OUKWFLVXMRCNMD-RKDXNWHRSA-N 360.440 -1.622 50 30 FAGC O=C(COc1ccc(BO)cc1)OOC(=O)COc1ccc(B(O)O)cc1 604934434 UXTDKUIAHVOQOQ-UHFFFAOYSA-N 373.919 -2.205 50 30 FAGC C[C@@H](C(=O)NNC(=S)NCC1CC1)n1nnc(N2CCOCC2)n1 8648154 RSQOGWSTHHPFHC-VIFPVBQESA-N 354.440 -1.024 50 30 FAGC