smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1ccc(O)c(C[N@H+](Cc2ccccn2)C2CC(C)(C)[NH2+]C(C)(C)C2)c1	ZINC000036740512	571081488	/nfs/dbraw/zinc/08/14/88/571081488.db2.gz	BRGJONURCUUWHV-UHFFFAOYSA-N	2	1	367.537	4.407	40	10		FICBMP
Cc1ccc(O)c(C[N@@H+](Cc2ccccn2)C2CC(C)(C)[NH2+]C(C)(C)C2)c1	ZINC000036740512	571081490	/nfs/dbraw/zinc/08/14/90/571081490.db2.gz	BRGJONURCUUWHV-UHFFFAOYSA-N	2	1	367.537	4.407	40	10		FICBMP
C[NH+](C)CCCCCNc1c2ccccc2[nH+]c2cccc([N+](=O)[O-])c21	ZINC000005812031	570636585	/nfs/dbraw/zinc/63/65/85/570636585.db2.gz	WYLQXVOPFMBFJQ-UHFFFAOYSA-N	2	1	352.438	4.440	40	10		FICBMP
Cc1ccc(O)c(C[N@H+](Cc2ccncc2)C2CC(C)(C)[NH2+]C(C)(C)C2)c1	ZINC000036740561	571081567	/nfs/dbraw/zinc/08/15/67/571081567.db2.gz	AYWNXXULPRAYKN-UHFFFAOYSA-N	2	1	367.537	4.407	40	10		FICBMP
Cc1ccc(O)c(C[N@@H+](Cc2ccncc2)C2CC(C)(C)[NH2+]C(C)(C)C2)c1	ZINC000036740561	571081571	/nfs/dbraw/zinc/08/15/71/571081571.db2.gz	AYWNXXULPRAYKN-UHFFFAOYSA-N	2	1	367.537	4.407	40	10		FICBMP
Cc1cccc2c(NCCC[NH+](C)C)c3c([N+](=O)[O-])ccc(C)c3[nH+]c12	ZINC000005843938	570636990	/nfs/dbraw/zinc/63/69/90/570636990.db2.gz	QBJNJPAZWDZISN-UHFFFAOYSA-N	2	1	352.438	4.277	40	10		FICBMP