smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H]1c1ccco1	ZINC000116295350	267137859	/nfs/dbraw/zinc/13/78/59/267137859.db2.gz	GJLJEHKPJWLHRD-IUODEOHRSA-N	1	1	286.331	4.086	10	5		CIBEMO
C[C@@H]([NH2+]Cc1ccsc1Cl)c1ccccc1[N+](=O)[O-]	ZINC000312767440	326964991	/nfs/dbraw/zinc/96/49/91/326964991.db2.gz	TXTOWTRUDOYYGR-SECBINFHSA-N	1	1	296.779	4.161	10	5		CIBEMO
C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccc(Cl)cc1	ZINC000037562555	333534979	/nfs/dbraw/zinc/53/49/79/333534979.db2.gz	RNBNCMFNZIKNJA-SECBINFHSA-N	1	1	296.779	4.161	10	5		CIBEMO
C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1ccc(Cl)cc1	ZINC000037562554	333534941	/nfs/dbraw/zinc/53/49/41/333534941.db2.gz	RNBNCMFNZIKNJA-VIFPVBQESA-N	1	1	296.779	4.161	10	5		CIBEMO
C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1cccc(Cl)c1	ZINC000037562569	173272779	/nfs/dbraw/zinc/27/27/79/173272779.db2.gz	SLVOVLYRONELMT-VIFPVBQESA-N	1	1	296.779	4.161	10	5		CIBEMO
Cc1ccc([C@H](C)[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])o1	ZINC000093632767	327131747	/nfs/dbraw/zinc/13/17/47/327131747.db2.gz	RTTBCZIESNKESW-JTQLQIEISA-N	1	1	294.738	4.000	10	5		CIBEMO
CC(C)C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C(C)C	ZINC000042582379	174806348	/nfs/dbraw/zinc/80/63/48/174806348.db2.gz	VXGGPMZWFXWKOD-UHFFFAOYSA-N	1	1	284.787	4.115	10	5		CIBEMO
C[C@H]([NH2+]Cc1ccccc1Cl)c1ccccc1[N+](=O)[O-]	ZINC000020525988	262245170	/nfs/dbraw/zinc/24/51/70/262245170.db2.gz	IKDAYDUBNNQCPP-NSHDSACASA-N	1	1	290.750	4.099	10	5		CIBEMO
C[C@@H]([NH2+]Cc1ccccc1Cl)c1ccccc1[N+](=O)[O-]	ZINC000020525987	262245344	/nfs/dbraw/zinc/24/53/44/262245344.db2.gz	IKDAYDUBNNQCPP-LLVKDONJSA-N	1	1	290.750	4.099	10	5		CIBEMO
CC[N@@H+](CCCO)Cc1c2ccccc2cc2ccccc21	ZINC000021994735	171347395	/nfs/dbraw/zinc/34/73/95/171347395.db2.gz	NDOSNEOXZGVPCN-UHFFFAOYSA-N	1	1	293.410	4.197	10	5		CIBEMO
C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H]1c1ccco1	ZINC000116295348	267138201	/nfs/dbraw/zinc/13/82/01/267138201.db2.gz	GJLJEHKPJWLHRD-SWLSCSKDSA-N	1	1	286.331	4.086	10	5		CIBEMO
Cc1ccc([C@@H](C)[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])o1	ZINC000093632766	327131745	/nfs/dbraw/zinc/13/17/45/327131745.db2.gz	RTTBCZIESNKESW-SNVBAGLBSA-N	1	1	294.738	4.000	10	5		CIBEMO