smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC[NH+](CC)CCCNc1[nH+]cc(C)c2c1c1ccc3c([O-])cccc3c1n2C ZINC000001633630 212251955 /nfs/dbraw/zinc/25/19/55/212251955.db2.gz ZGFDERDLOYHFHS-UHFFFAOYSA-N 1 3 390.531 5.038 40 5 GKBBHO CC[NH+](CC)CCCNc1nc2ccccc2c2[nH]c3ccc(OC)cc3c21 ZINC000001639179 206388826 /nfs/dbraw/zinc/38/88/26/206388826.db2.gz HGILUFKJFSZULZ-UHFFFAOYSA-N 1 3 376.504 5.022 40 5 GKBBHO