smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Nc1ccc2c(c1)[nH+]c1ccccc1c2Nc1ccccc1	ZINC000005162468	170072641	/nfs/dbraw/zinc/07/26/41/170072641.db2.gz	XMXGTVGMHSFSBO-UHFFFAOYSA-N	1	0	285.350	4.714	1	10		CJCFRO
Nc1c2ccccc2[nH+]c2ccc(-c3ccccc3)cc12	ZINC000005934588	170157719	/nfs/dbraw/zinc/15/77/19/170157719.db2.gz	YHGAGMNSWODGFY-UHFFFAOYSA-N	1	0	270.335	4.637	1	10		CJCFRO
CCC[NH+](CCC)[C@@H]1CCn2c(ccc2-c2ccccc2)C1	ZINC000013642175	170571767	/nfs/dbraw/zinc/57/17/67/170571767.db2.gz	QNMSZPXZAGXMKV-GOSISDBHSA-N	1	0	296.458	4.592	1	10		CJCFRO
CCC[NH+](CCC)[C@H]1CCn2c(ccc2-c2ccccc2)C1	ZINC000013642178	170572195	/nfs/dbraw/zinc/57/21/95/170572195.db2.gz	QNMSZPXZAGXMKV-SFHVURJKSA-N	1	0	296.458	4.592	1	10		CJCFRO
C[N+](C)(C)c1ccc(/C=C/c2ccnc3ccccc23)cc1	ZINC000036382715	172628216	/nfs/dbraw/zinc/62/82/16/172628216.db2.gz	IHWKHRJJKZZWOZ-DHZHZOJOSA-N	1	0	289.402	4.602	1	10		CJCFRO
Cc1cccc2c(NCc3ccco3)c3ccccc3[nH+]c12	ZINC000045285810	175353335	/nfs/dbraw/zinc/35/33/35/175353335.db2.gz	STLFALYGOLFGDT-UHFFFAOYSA-N	1	0	288.350	4.902	1	10		CJCFRO
Cc1ccc(/N=N/c2ccc(NCCC[NH+](C)C)cc2)cc1	ZINC000045320898	175359346	/nfs/dbraw/zinc/35/93/46/175359346.db2.gz	NFDFFDOHXUMIIW-QZQOTICOSA-N	1	0	296.418	4.774	1	10		CJCFRO
C[n+]1c2ccccc2c(Nc2ccccc2)c2ccccc21	ZINC000055878657	525397836	/nfs/dbraw/zinc/39/78/36/525397836.db2.gz	QHOFMRHCWSWZSG-UHFFFAOYSA-O	1	0	285.370	4.561	1	10		CJCFRO