smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C(c1cc2c(ccc3ccccc23)o1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000218494291 568236585 /nfs/dbraw/zinc/23/65/85/568236585.db2.gz DVHHIIVFMRTKCY-UHFFFAOYSA-N 1 2 370.452 4.544 40 70 FJIBLO COc1cc2c(cc1OC)C([C@@]13C[C@H]4C[C@@H](C1)C[C@](Cl)(C4)C3)=[NH+]CC2 ZINC000217373040 568180327 /nfs/dbraw/zinc/18/03/27/568180327.db2.gz JZAAMTICFFUNDT-HVEVLSQBSA-N 1 2 359.897 4.627 40 70 FJIBLO