smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[NH+](C)CCCn1c(CCc2ccccc2)[nH+]c2cc(/C=C/C(=O)NO)ccc21 ZINC000038308372 205035952 /nfs/dbraw/zinc/03/59/52/205035952.db2.gz RSGFYZCTBZEMGX-SDNWHVSQSA-N 2 2 392.503 3.292 1 30 GGEFLP CCCNC(=[NH2+])Nc1ccc2cc3ccc(NC(=[NH2+])NCCC)cc3[nH+]c2c1 ZINC000095553342 208232757 /nfs/dbraw/zinc/23/27/57/208232757.db2.gz OFNAVECHGCNWLG-UHFFFAOYSA-N 3 2 377.496 3.470 1 30 GGEFLP