smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCCNc1c2ccccc2[nH+]c2c(C(=O)NCC[NH+](C)C)cccc12 ZINC000005973633 204232493 /nfs/dbraw/zinc/23/24/93/204232493.db2.gz IFOGRHUSMJFXSD-UHFFFAOYSA-N 2 0 364.493 3.891 1 10 FHCFRP COc1ccc2[nH+]c3ccccc3c(NCCC[NH+](C)C)c2c1[N+](=O)[O-] ZINC000005940541 207124014 /nfs/dbraw/zinc/12/40/14/207124014.db2.gz YQAUNOAVZPAGQA-UHFFFAOYSA-N 2 0 354.410 3.668 1 10 FHCFRP Oc1c(C[NH+]2CCCC2)cc(Nc2cc[nH+]cc2)cc1C[NH+]1CCCC1 ZINC000000597034 210250890 /nfs/dbraw/zinc/25/08/90/210250890.db2.gz YCZYEYIMCKSFFO-UHFFFAOYSA-N 3 0 352.482 3.722 1 10 FHCFRP