smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=S(=O)([N-]c1ccc([O-])c(Br)c1)c1cccc2ccccc21 ZINC000039987023 206192966 /nfs/dbraw/zinc/19/29/66/206192966.db2.gz RLGZAEZIEQOMAM-UHFFFAOYSA-N -2 3 378.247 4.109 10 10 GICEHL O=C1[N-]C(=S)N(c2ccc(Cl)cc2)C(=O)C1=Cc1cc(Cl)ccc1[O-] ZINC000020458019 570259642 /nfs/dbraw/zinc/25/96/42/570259642.db2.gz KXJAXAPJZLOCDE-JYRVWZFOSA-N -2 3 393.251 4.371 10 10 GICEHL