smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1cccc(OC)c1CN1CCC(N(C)c2ncccc2NC(=O)CCl)CC1 ZINC001165021247 721843498 /nfs/dbraw/zinc/84/34/98/721843498.db2.gz JGKOCEHNAVPBAX-UHFFFAOYSA-N 0 1 432.952 3.377 20 50 IGGDMN COc1cccc(OC)c1CN1CCC(N(C)c2ccc(NC(=O)CCl)cn2)CC1 ZINC001165029793 721844878 /nfs/dbraw/zinc/84/48/78/721844878.db2.gz DJIRRYABIDJUSK-UHFFFAOYSA-N 0 1 432.952 3.377 20 50 IGGDMN Cc1ccc(CN2CCOC3(CCN(c4ccc(NC(=O)CCl)cn4)CC3)C2)cc1 ZINC001164938988 721932778 /nfs/dbraw/zinc/93/27/78/721932778.db2.gz FZSYTRRRTFUPKE-UHFFFAOYSA-N 0 1 428.964 3.439 20 50 IGGDMN Cc1ccc(CN2CCOC3(CCN(c4ncccc4NC(=O)CCl)CC3)C2)cc1 ZINC001164938691 721930663 /nfs/dbraw/zinc/93/06/63/721930663.db2.gz DRQRSJFMUTYACJ-UHFFFAOYSA-N 0 1 428.964 3.439 20 50 IGGDMN