smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCCCCCCCCCCCCCC/C=C/[C@@H](CC(=O)O)C(=O)[O-] ZINC000060073112 571132771 /nfs/dbraw/zinc/13/27/71/571132771.db2.gz GYTGJCPXNGAJFT-PCYKQNFTSA-N -1 2 368.558 6.590 50 30 FKEALM CCCCCCCCCCCCCCCC/C=C/[C@H](CC(=O)O)C(=O)[O-] ZINC000060073117 571132691 /nfs/dbraw/zinc/13/26/91/571132691.db2.gz GYTGJCPXNGAJFT-CECJQHFESA-N -1 2 368.558 6.590 50 30 FKEALM CCCCCCCCCCCCCCCCCC/C(=C/C(=O)[O-])C(=O)O ZINC000112966343 571311024 /nfs/dbraw/zinc/31/10/24/571311024.db2.gz DORSXXCBNVVKKP-VXPUYCOJSA-N -1 2 368.558 6.734 50 30 FKEALM Oc1ccc([NH+]=C/C=C\c2ccccc2)cc1-c1nc2ccccc2s1 ZINC000252641594 571292094 /nfs/dbraw/zinc/29/20/94/571292094.db2.gz ZFGRYOLTBCGXQA-LQSQFJFCSA-N -1 2 356.450 6.085 50 30 FKEALM