smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C(=[NH+]/Cc1cccnc1)\c1ccccc1	103287694	166047605	/nfs/dbraw/zinc/04/76/05/166047605.db2.gz	ZPIXENBXSCJWDP-OQLLNIDSSA-N	1	2	196.253	2.701	1	30		AFEFLO
C=C(C)[C@H](C)N(O)c1cccc(C)[nH+]1	73141946	166129236	/nfs/dbraw/zinc/12/92/36/166129236.db2.gz	UNENTKVJNFDYSK-JTQLQIEISA-N	1	2	192.262	2.550	1	30		AFEFLO
C=C(C)[C@H](C)N(O)c1[nH+]cccc1C	73156893	166129409	/nfs/dbraw/zinc/12/94/09/166129409.db2.gz	VEGGAAGSOCLRHU-JTQLQIEISA-N	1	2	192.262	2.550	1	30		AFEFLO
C=C(C)[C@H](C)N(O)c1cc(C)cc[nH+]1	73156884	166129619	/nfs/dbraw/zinc/12/96/19/166129619.db2.gz	SYEYMWDNAQECHI-JTQLQIEISA-N	1	2	192.262	2.550	1	30		AFEFLO
c1cncc(C[NH+]=C2CCCCC2)c1	103286398	171147043	/nfs/dbraw/zinc/14/70/43/171147043.db2.gz	ZDOBALRUDAVRPF-UHFFFAOYSA-N	1	2	188.274	2.987	1	30		AFEFLO
C=C(C)[C@@H](C)N(O)c1cc(C)cc[nH+]1	73156888	171194744	/nfs/dbraw/zinc/19/47/44/171194744.db2.gz	SYEYMWDNAQECHI-SNVBAGLBSA-N	1	2	192.262	2.550	1	30		AFEFLO
C=C(C)[C@@H](C)N(O)c1cccc(C)[nH+]1	73141948	171194883	/nfs/dbraw/zinc/19/48/83/171194883.db2.gz	UNENTKVJNFDYSK-SNVBAGLBSA-N	1	2	192.262	2.550	1	30		AFEFLO
C=C(C)[C@@H](C)N(O)c1[nH+]cccc1C	73156896	171195318	/nfs/dbraw/zinc/19/53/18/171195318.db2.gz	VEGGAAGSOCLRHU-SNVBAGLBSA-N	1	2	192.262	2.550	1	30		AFEFLO