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](NC[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(N2CCC(O)CC2)cc1	ZINC000195137886	888649318	/nfs/dbraw/zinc/64/93/18/888649318.db2.gz	MWPWVAXHUJLTOD-IRLDBZIGSA-N	1	3	393.575	3.820	10	10		GHCEHO
C[C@@H](NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(N2CCC(O)CC2)cc1	ZINC000195137886	888649324	/nfs/dbraw/zinc/64/93/24/888649324.db2.gz	MWPWVAXHUJLTOD-IRLDBZIGSA-N	1	3	393.575	3.820	10	10		GHCEHO
C[C@@H](NC[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(N2CCC(O)CC2)cc1	ZINC000195137905	888649723	/nfs/dbraw/zinc/64/97/23/888649723.db2.gz	MWPWVAXHUJLTOD-IFMALSPDSA-N	1	3	393.575	3.820	10	10		GHCEHO
C[C@@H](NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(N2CCC(O)CC2)cc1	ZINC000195137905	888649744	/nfs/dbraw/zinc/64/97/44/888649744.db2.gz	MWPWVAXHUJLTOD-IFMALSPDSA-N	1	3	393.575	3.820	10	10		GHCEHO
C[C@@H]([NH2+]C1CCN(CC2CCCC2)CC1)c1ccc(N2CCC(O)CC2)cc1	ZINC000120726725	876251339	/nfs/dbraw/zinc/25/13/39/876251339.db2.gz	LFNLIMOHKVGVAG-LJQANCHMSA-N	1	3	385.596	3.953	10	10		GHCEHO
C[C@H](NC[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(N2CCC(O)CC2)cc1	ZINC000195137896	888649423	/nfs/dbraw/zinc/64/94/23/888649423.db2.gz	MWPWVAXHUJLTOD-RBBKRZOGSA-N	1	3	393.575	3.820	10	10		GHCEHO
C[C@H](NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(N2CCC(O)CC2)cc1	ZINC000195137896	888649431	/nfs/dbraw/zinc/64/94/31/888649431.db2.gz	MWPWVAXHUJLTOD-RBBKRZOGSA-N	1	3	393.575	3.820	10	10		GHCEHO
C[C@H]([NH2+]C1CCN(CC2CCCC2)CC1)c1ccc(N2CCC(O)CC2)cc1	ZINC000120726601	876250111	/nfs/dbraw/zinc/25/01/11/876250111.db2.gz	LFNLIMOHKVGVAG-IBGZPJMESA-N	1	3	385.596	3.953	10	10		GHCEHO
C[C@H](NC[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(N2CCC(O)CC2)cc1	ZINC000195137870	888650041	/nfs/dbraw/zinc/65/00/41/888650041.db2.gz	MWPWVAXHUJLTOD-UNMCSNQZSA-N	1	3	393.575	3.820	10	10		GHCEHO
C[C@H](NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc(N2CCC(O)CC2)cc1	ZINC000195137870	888650049	/nfs/dbraw/zinc/65/00/49/888650049.db2.gz	MWPWVAXHUJLTOD-UNMCSNQZSA-N	1	3	393.575	3.820	10	10		GHCEHO