smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1cc2ccccc2s1 ZINC000423502013 337723432 /nfs/dbraw/zinc/72/34/32/337723432.db2.gz DRBLSZLEVUOOEX-MAUKXSAKSA-N 2 0 324.493 5.032 20 0 DKADRP C[C@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1cc2ccccc2s1 ZINC000423502017 337723324 /nfs/dbraw/zinc/72/33/24/337723324.db2.gz DRBLSZLEVUOOEX-YJBOKZPZSA-N 2 0 324.493 5.032 20 0 DKADRP