smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCn1c2ccccc2c2cc(N=C3NC(=[NH2+])c4ccccc43)ccc21	ZINC000040802456	213388549	/nfs/dbraw/zinc/38/85/49/213388549.db2.gz	YZUHWMXCUGZHDG-UHFFFAOYSA-N	1	1	338.414	4.612	10	30		EJEEMO
Cc1ccsc1C[N@H+](Cc1cccc(C#N)c1)Cc1ccccn1	ZINC000055108923	214274647	/nfs/dbraw/zinc/27/46/47/214274647.db2.gz	ZVIANGZWUJSUDT-UHFFFAOYSA-N	1	1	333.460	4.526	10	30		EJEEMO
Cc1ccsc1C[N@@H+](Cc1cccc(C#N)c1)Cc1ccccn1	ZINC000055108923	214274650	/nfs/dbraw/zinc/27/46/50/214274650.db2.gz	ZVIANGZWUJSUDT-UHFFFAOYSA-N	1	1	333.460	4.526	10	30		EJEEMO
C=C1C[C@H](C)[C@H]2[C@H]3Cc4ccc(O)cc4[C@@]2(CC[N@H+]3CC2CCC2)C1	ZINC000004217628	210145169	/nfs/dbraw/zinc/14/51/69/210145169.db2.gz	AZJPPZHRNFQRRE-AZIXLERZSA-N	1	1	337.507	4.663	10	30	in-man	EJEEMO
[NH2+]=C1NC(=Nc2cc(Cl)ccc2Oc2ccccc2)c2ccccc21	ZINC000040802515	213388208	/nfs/dbraw/zinc/38/82/08/213388208.db2.gz	MZIDKZUJISFGEP-UHFFFAOYSA-N	1	1	347.805	4.930	10	30		EJEEMO
C=CC[C@@H]1CC=C[C@@H](C)[N@@H+]1Cc1nc(-c2ccc(F)cc2)oc1C	ZINC000012090399	211289865	/nfs/dbraw/zinc/28/98/65/211289865.db2.gz	HBYGDWXTOQPIFJ-RDTXWAMCSA-N	1	1	326.415	4.884	10	30		EJEEMO
CCCCCCCCCCCCCCCC[C@@H](O)CNCC[NH3+]	ZINC000100306637	219097034	/nfs/dbraw/zinc/09/70/34/219097034.db2.gz	HUUDYFZAGJOSBT-HXUWFJFHSA-N	1	1	328.585	4.767	10	30		EJEEMO