smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C=CCN1CCC[C@H]1CNC(=O)[C@]12C[NH2+]C[C@H]1C[NH2+]CC2	ZINC001220868146	825114709	/nfs/dbraw/zinc/11/47/09/825114709.db2.gz	CKDKKGBKXGJPFD-IJEWVQPXSA-N	2	3	292.427	-0.048	20	30		CBEDHP
CCN1CCC[C@@H]1CNC(=[NH2+])NC[C@@]1(O)CC[N@H+](C)C1	ZINC000262275205	279303408	/nfs/dbraw/zinc/30/34/08/279303408.db2.gz	HVFUBDHXEHDDEU-OCCSQVGLSA-N	2	3	283.420	-0.558	20	30		CBEDHP
CCN1CCC[C@@H]1CNC(=[NH2+])NC[C@@]1(O)CC[N@@H+](C)C1	ZINC000262275205	279303409	/nfs/dbraw/zinc/30/34/09/279303409.db2.gz	HVFUBDHXEHDDEU-OCCSQVGLSA-N	2	3	283.420	-0.558	20	30		CBEDHP
CCN1CCC[C@@H]1CNC(=[NH2+])NC[C@]1(O)CC[N@H+](C)C1	ZINC000262275206	276170439	/nfs/dbraw/zinc/17/04/39/276170439.db2.gz	HVFUBDHXEHDDEU-TZMCWYRMSA-N	2	3	283.420	-0.558	20	30		CBEDHP
CCN1CCC[C@@H]1CNC(=[NH2+])NC[C@]1(O)CC[N@@H+](C)C1	ZINC000262275206	276170441	/nfs/dbraw/zinc/17/04/41/276170441.db2.gz	HVFUBDHXEHDDEU-TZMCWYRMSA-N	2	3	283.420	-0.558	20	30		CBEDHP
CCN1CCC[C@H]1CNC(=[NH2+])NC[C@]1(O)CC[N@H+](C)C1	ZINC000262275203	276378044	/nfs/dbraw/zinc/37/80/44/276378044.db2.gz	HVFUBDHXEHDDEU-GXTWGEPZSA-N	2	3	283.420	-0.558	20	30		CBEDHP
CCN1CCC[C@H]1CNC(=[NH2+])NC[C@]1(O)CC[N@@H+](C)C1	ZINC000262275203	276378045	/nfs/dbraw/zinc/37/80/45/276378045.db2.gz	HVFUBDHXEHDDEU-GXTWGEPZSA-N	2	3	283.420	-0.558	20	30		CBEDHP
CCN1CCC[C@H]1CNC(=[NH2+])NC[C@@]1(O)CC[N@H+](C)C1	ZINC000262275204	220250127	/nfs/dbraw/zinc/25/01/27/220250127.db2.gz	HVFUBDHXEHDDEU-JSGCOSHPSA-N	2	3	283.420	-0.558	20	30		CBEDHP
CCN1CCC[C@H]1CNC(=[NH2+])NC[C@@]1(O)CC[N@@H+](C)C1	ZINC000262275204	220250129	/nfs/dbraw/zinc/25/01/29/220250129.db2.gz	HVFUBDHXEHDDEU-JSGCOSHPSA-N	2	3	283.420	-0.558	20	30		CBEDHP