smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC[NH+](CC)CCCCN1c2ccccc2Oc2ccccc21	ZINC000001535465	134445988	/nfs/dbraw/zinc/44/59/88/134445988.db2.gz	WXBJYCLFEXXZJY-UHFFFAOYSA-N	1	0	310.441	5.052	10	10		DKCERO
CC(C)(C)c1cccc(N[N+](=O)c2cccc(C(C)(C)C)c2)c1	ZINC000004276949	181091337	/nfs/dbraw/zinc/09/13/37/181091337.db2.gz	HSVGDUHQFYXDIY-DQRAZIAOSA-N	1	0	310.441	6.207	10	10		DKCERO
C[C@@H]([NH2+]C1CCCCC1)c1ccc(N2CCCCCC2)c(F)c1	ZINC000020550991	182229959	/nfs/dbraw/zinc/22/99/59/182229959.db2.gz	AAPQJMAHOIPZFJ-MRXNPFEDSA-N	1	0	318.480	5.189	10	10		DKCERO
C[C@H]([NH2+]C1CCCCC1)c1ccc(N2CCCCCC2)c(F)c1	ZINC000020550993	182230151	/nfs/dbraw/zinc/23/01/51/182230151.db2.gz	AAPQJMAHOIPZFJ-INIZCTEOSA-N	1	0	318.480	5.189	10	10		DKCERO
C[C@@H]([NH2+]C1CCCCC1)c1ccc(N2CCC[C@@H](C)C2)c(F)c1	ZINC000020569975	563961636	/nfs/dbraw/zinc/96/16/36/563961636.db2.gz	SJPSYOBIPVSHJX-HZPDHXFCSA-N	1	0	318.480	5.045	10	10		DKCERO
C[C@@H]([NH2+]C1CCCCC1)c1ccc(N2CCC[C@H](C)C2)c(F)c1	ZINC000020569977	563961692	/nfs/dbraw/zinc/96/16/92/563961692.db2.gz	SJPSYOBIPVSHJX-JKSUJKDBSA-N	1	0	318.480	5.045	10	10		DKCERO
C[C@@H]([NH2+]C1CCCCC1)c1ccc(N2CCC(C)CC2)c(F)c1	ZINC000020572049	563961628	/nfs/dbraw/zinc/96/16/28/563961628.db2.gz	LXENNHGPPXIIJM-MRXNPFEDSA-N	1	0	318.480	5.045	10	10		DKCERO
C[C@H]([NH2+]C1CCCCC1)c1ccc(N2CCC(C)CC2)c(F)c1	ZINC000020572050	134648028	/nfs/dbraw/zinc/64/80/28/134648028.db2.gz	LXENNHGPPXIIJM-INIZCTEOSA-N	1	0	318.480	5.045	10	10		DKCERO
CCCCC[NH2+][C@@H](C)c1ccc(N2CCCCCC2)c(F)c1	ZINC000020582627	182234701	/nfs/dbraw/zinc/23/47/01/182234701.db2.gz	CCIIZSFRLGCVQG-INIZCTEOSA-N	1	0	306.469	5.047	10	10		DKCERO
CCCCC[NH2+][C@H](C)c1ccc(N2CCCCCC2)c(F)c1	ZINC000020582631	182234675	/nfs/dbraw/zinc/23/46/75/182234675.db2.gz	CCIIZSFRLGCVQG-MRXNPFEDSA-N	1	0	306.469	5.047	10	10		DKCERO
CC(C)(C)c1cccc(N[N+](=O)c2cccc(C(C)(C)C)c2)c1	ZINC000100287311	193798112	/nfs/dbraw/zinc/79/81/12/193798112.db2.gz	HSVGDUHQFYXDIY-QURGRASLSA-N	1	0	310.441	6.207	10	10		DKCERO
C[C@H]([NH2+]C1CCCCC1)c1ccc(N2CCC[C@@H](C)C2)c(F)c1	ZINC000253495328	563900942	/nfs/dbraw/zinc/90/09/42/563900942.db2.gz	SJPSYOBIPVSHJX-CVEARBPZSA-N	1	0	318.480	5.045	10	10		DKCERO
C[C@H]([NH2+]C1CCCCC1)c1ccc(N2CCC[C@H](C)C2)c(F)c1	ZINC000253495329	202893206	/nfs/dbraw/zinc/89/32/06/202893206.db2.gz	SJPSYOBIPVSHJX-HOTGVXAUSA-N	1	0	318.480	5.045	10	10		DKCERO
CC(C)(C)c1cccc(N[N+](=O)c2cccc(C(C)(C)C)c2)c1	ZINC000255003964	202907214	/nfs/dbraw/zinc/90/72/14/202907214.db2.gz	HSVGDUHQFYXDIY-UHFFFAOYSA-N	1	0	310.441	6.207	10	10		DKCERO
Cc1cc([N+](=O)Nc2ccccc2)ccc1/N=N/c1ccccc1	ZINC000504221729	340143338	/nfs/dbraw/zinc/14/33/38/340143338.db2.gz	MDISKSHSYBTZDQ-QZQOTICOSA-N	1	0	317.372	5.848	10	10		DKCERO
O=[N+](Nc1ccccc1)c1ccc(/N=N/c2ccccc2)cc1	ZINC000504767078	340152398	/nfs/dbraw/zinc/15/23/98/340152398.db2.gz	ZRIXIGWEFBWFPY-FMQUCBEESA-N	1	0	303.345	5.540	10	10		DKCERO