smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
OCC[NH2+]CCNc1c2ccccc2[nH+]c2cc(Cl)ccc21	ZINC000004428561	181109100	/nfs/dbraw/zinc/10/91/00/181109100.db2.gz	NECKSCNRKKDNBP-UHFFFAOYSA-N	2	0	315.804	3.035	40	10		DGCBRP
COc1ccc2[nH+]c3cc(Cl)ccc3c(NCC[NH3+])c2c1	ZINC000004748021	181147758	/nfs/dbraw/zinc/14/77/58/181147758.db2.gz	BBHBBFNAIGRZEZ-UHFFFAOYSA-N	2	0	301.777	3.421	40	10		DGCBRP
Oc1cc(O)c(C[NH+]2CCCCC2)cc1C[NH+]1CCCCC1	ZINC000001701305	180888880	/nfs/dbraw/zinc/88/88/80/180888880.db2.gz	QMPPIHGUQGYOHK-UHFFFAOYSA-N	2	0	304.434	3.070	40	10		DGCBRP
C[NH+](C)Cc1cc(OCc2ccccc2)cc(C[NH+](C)C)c1O	ZINC000001717653	431236871	/nfs/dbraw/zinc/23/68/71/431236871.db2.gz	PFAJIWVJZFTNHT-UHFFFAOYSA-N	2	0	314.429	3.094	40	10		DGCBRP