smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name NC(=[NH2+])Nc1ncc(Cl)c2ccc(S(=O)(=O)N3CCCC[C@@H]3C(=O)[O-])cc21 ZINC000014960824 581097284 /nfs/dbraw/zinc/09/72/84/581097284.db2.gz SFSCYVUZGPRXIE-CYBMUJFWSA-N 0 1 411.871 1.421 1 30 HDEFMN N#Cc1cnc(Nc2cc(N3CCN(CCCN4CCOCC4)CC3)ncn2)s1 ZINC000028570553 581096592 /nfs/dbraw/zinc/09/65/92/581096592.db2.gz GOEFOVAJSQGKCV-UHFFFAOYSA-N 0 1 414.539 1.393 1 30 HDEFMN