smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1cc(NCCC[NH+](C)C)c2ccc3c(ccc4c(NCCC[NH+](C)C)cc(C)[nH+]c43)c2[nH+]1	ZINC000001568218	194128308	/nfs/dbraw/zinc/12/83/08/194128308.db2.gz	WJUPENLNVUCETH-UHFFFAOYSA-N	4	2	458.654	5.280	40	5		JKBBLP
Cc1cc(NCCC[NH+](C)C)c2ccc3c(ccc4c(NCCC[NH+](C)C)cc(C)[nH+]c43)c2n1	ZINC000001568218	194128311	/nfs/dbraw/zinc/12/83/11/194128311.db2.gz	WJUPENLNVUCETH-UHFFFAOYSA-N	3	2	458.654	5.280	40	5		JKBBLP
c1ccc2c(c1)[nH+]c1ccccc1c2CCCCCCCc1c2ccccc2[nH+]c2ccccc21	ZINC000034497989	569640211	/nfs/dbraw/zinc/64/02/11/569640211.db2.gz	YDTZWEXADJYOBJ-UHFFFAOYSA-N	2	2	454.617	8.825	40	5		JKBBLP
CC[NH+](CC)CCNc1cc(C)[nH+]c2c1ccc1c2ccc2c(NCC[NH+](CC)CC)cc(C)[nH+]c21	ZINC000001574053	553978741	/nfs/dbraw/zinc/97/87/41/553978741.db2.gz	YDXDIPBVWWLCOL-UHFFFAOYSA-N	4	2	486.708	6.060	40	5		JKBBLP
CC[NH+](CC)CCNc1cc(C)nc2c1ccc1c2ccc2c(NCC[NH+](CC)CC)cc(C)[nH+]c21	ZINC000001574053	553978744	/nfs/dbraw/zinc/97/87/44/553978744.db2.gz	YDXDIPBVWWLCOL-UHFFFAOYSA-N	3	2	486.708	6.060	40	5		JKBBLP
O=C(Nc1ccc(Nc2cc[nH+]cc2)cc1)c1ccc(Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)cc1	ZINC000005103461	554486622	/nfs/dbraw/zinc/48/66/22/554486622.db2.gz	KUBNLSZSAIOAMS-UHFFFAOYSA-N	2	2	476.496	6.278	40	5		JKBBLP