smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
[NH3+]CCNC(=O)[C@@H]1CCC[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1	ZINC000261967631	139240458	/nfs/dbraw/zinc/24/04/58/139240458.db2.gz	YPDYOXSQLAWGSE-GFCCVEGCSA-N	2	1	340.811	1.535	10	5		EDBEMP
[NH3+]CCNC(=O)[C@@H]1CCC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1	ZINC000261967631	139240459	/nfs/dbraw/zinc/24/04/59/139240459.db2.gz	YPDYOXSQLAWGSE-GFCCVEGCSA-N	2	1	340.811	1.535	10	5		EDBEMP
Cc1cccc(NC[C@H]2CC[N@H+](CCn3cc([N+](=O)[O-])cn3)C2)[nH+]1	ZINC000174839233	231322654	/nfs/dbraw/zinc/32/26/54/231322654.db2.gz	SSWGDRSUQXRNKY-CQSZACIVSA-N	2	1	330.392	1.929	10	5		EDBEMP
Cc1cccc(NC[C@H]2CC[N@@H+](CCn3cc([N+](=O)[O-])cn3)C2)[nH+]1	ZINC000174839233	231322657	/nfs/dbraw/zinc/32/26/57/231322657.db2.gz	SSWGDRSUQXRNKY-CQSZACIVSA-N	2	1	330.392	1.929	10	5		EDBEMP
[NH3+]CCNC(=O)[C@H]1CCC[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1	ZINC000261967636	139240518	/nfs/dbraw/zinc/24/05/18/139240518.db2.gz	YPDYOXSQLAWGSE-LBPRGKRZSA-N	2	1	340.811	1.535	10	5		EDBEMP
[NH3+]CCNC(=O)[C@H]1CCC[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1	ZINC000261967636	139240519	/nfs/dbraw/zinc/24/05/19/139240519.db2.gz	YPDYOXSQLAWGSE-LBPRGKRZSA-N	2	1	340.811	1.535	10	5		EDBEMP
Cc1cccc(NC[C@@H]2CC[N@H+](CCn3ccc([N+](=O)[O-])n3)C2)[nH+]1	ZINC000176223893	442194581	/nfs/dbraw/zinc/19/45/81/442194581.db2.gz	CPIOLROZOLMISL-AWEZNQCLSA-N	2	1	330.392	1.929	10	5		EDBEMP
Cc1cccc(NC[C@@H]2CC[N@@H+](CCn3ccc([N+](=O)[O-])n3)C2)[nH+]1	ZINC000176223893	442194584	/nfs/dbraw/zinc/19/45/84/442194584.db2.gz	CPIOLROZOLMISL-AWEZNQCLSA-N	2	1	330.392	1.929	10	5		EDBEMP
Cc1cccc(NC[C@H]2CC[N@H+](CCn3ccc([N+](=O)[O-])n3)C2)[nH+]1	ZINC000176223907	442194522	/nfs/dbraw/zinc/19/45/22/442194522.db2.gz	CPIOLROZOLMISL-CQSZACIVSA-N	2	1	330.392	1.929	10	5		EDBEMP
Cc1cccc(NC[C@H]2CC[N@@H+](CCn3ccc([N+](=O)[O-])n3)C2)[nH+]1	ZINC000176223907	442194524	/nfs/dbraw/zinc/19/45/24/442194524.db2.gz	CPIOLROZOLMISL-CQSZACIVSA-N	2	1	330.392	1.929	10	5		EDBEMP