smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[N+](C)(C)/N=C(\CCC/C(=N\[N+](C)(C)C)c1ccccc1)c1ccccc1	ZINC000017060789	570865437	/nfs/dbraw/zinc/86/54/37/570865437.db2.gz	SXYPCUIYGVGESV-BQASJOSNSA-N	2	0	366.553	4.378	40	30		FIEBRP
C[N+](C)(C)/N=C(/CCC/C(=N/[N+](C)(C)C)c1ccccc1)c1ccccc1	ZINC000017060793	204646859	/nfs/dbraw/zinc/64/68/59/204646859.db2.gz	SXYPCUIYGVGESV-HKOLQMFGSA-N	2	0	366.553	4.378	40	30		FIEBRP
O=C1C=CC(=C[NH2+]Nc2scc(-c3ccccc3)[n+]2-c2ccccc2)C=C1	ZINC000038174120	205040327	/nfs/dbraw/zinc/04/03/27/205040327.db2.gz	GEJFVZPCEOCMFA-UHFFFAOYSA-O	2	0	372.473	4.187	40	30		FIEBRP
COc1cc(C[S+]2CCCC2)c(SC)cc1C[S+]1CCCC1	ZINC000005808238	522506473	/nfs/dbraw/zinc/50/64/73/522506473.db2.gz	SHDCVEWKXMZAJE-UHFFFAOYSA-N	2	0	356.622	4.241	40	30		FIEBRP
c1ccc(/[NH+]=C(/N(CC[NH+]2CCCC2)c2ccccc2)N2CCCC2)cc1	ZINC000016958693	211172671	/nfs/dbraw/zinc/17/26/71/211172671.db2.gz	CXTDIZWTRIBIJF-WCWDXBQESA-N	2	0	362.521	4.372	40	30		FIEBRP
C[N+](C)(C)/N=C(\CCC/C(=N/[N+](C)(C)C)c1ccccc1)c1ccccc1	ZINC000017060791	211175180	/nfs/dbraw/zinc/17/51/80/211175180.db2.gz	SXYPCUIYGVGESV-XNMKTSCDSA-N	2	0	366.553	4.378	40	30		FIEBRP
c1ccc(/[NH+]=C(\N(CC[NH+]2CCCC2)c2ccccc2)N2CCCC2)cc1	ZINC000001644238	210364480	/nfs/dbraw/zinc/36/44/80/210364480.db2.gz	CXTDIZWTRIBIJF-VHXPQNKSSA-N	2	0	362.521	4.372	40	30		FIEBRP