smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=[N+]([O-])c1ccc2ccc(N3CCC[C@]4(CCN4Cc4cccc(F)c4)C3)nc2c1	ZINC001164994968	722197178	/nfs/dbraw/zinc/19/71/78/722197178.db2.gz	RCUMESKHCVTZDF-QHCPKHFHSA-N	0	3	406.461	4.527	20	5		HJBDHN
Clc1ccc2ccc3ccc(N4CC[C@H]5[C@H]4CCN5Cc4cccnc4)nc3c2n1	ZINC001164725064	720389549	/nfs/dbraw/zinc/38/95/49/720389549.db2.gz	LNEFWZDLAOUUCW-VQTJNVASSA-N	0	3	415.928	4.685	20	5		HJBDHN
O=[N+]([O-])c1cccc2nc(N3CCC[C@]4(CCN4Cc4cccc(F)c4)C3)ccc21	ZINC001164994948	722198831	/nfs/dbraw/zinc/19/88/31/722198831.db2.gz	QZCSCALMAQHEJO-QHCPKHFHSA-N	0	3	406.461	4.527	20	5		HJBDHN
Clc1ccc2ccc3ccc(N4CC[C@H]5[C@@H]4CCN5Cc4cccnc4)nc3c2n1	ZINC001164725062	720390096	/nfs/dbraw/zinc/39/00/96/720390096.db2.gz	LNEFWZDLAOUUCW-PMACEKPBSA-N	0	3	415.928	4.685	20	5		HJBDHN
Clc1ccc2ccc3ccc(N4CC[C@@H]5[C@H]4CCN5Cc4cccnc4)nc3c2n1	ZINC001164725065	720390352	/nfs/dbraw/zinc/39/03/52/720390352.db2.gz	LNEFWZDLAOUUCW-WOJBJXKFSA-N	0	3	415.928	4.685	20	5		HJBDHN
O=[N+]([O-])c1cccc2ccc(N3CCC[C@@]4(CCN4Cc4cccc(F)c4)C3)nc21	ZINC001164994609	722198132	/nfs/dbraw/zinc/19/81/32/722198132.db2.gz	OIZOESVGRSYPBZ-HSZRJFAPSA-N	0	3	406.461	4.527	20	5		HJBDHN
O=[N+]([O-])c1cnc(N2CCC[C@@]3(CCN3Cc3cccc(F)c3)C2)c2ccccc21	ZINC001164992851	722198479	/nfs/dbraw/zinc/19/84/79/722198479.db2.gz	BFVHYBXOZNXDHG-HSZRJFAPSA-N	0	3	406.461	4.527	20	5		HJBDHN
O=[N+]([O-])c1cnc(N2CCC[C@]3(CCN3Cc3cccc(F)c3)C2)c2ccccc21	ZINC001164992852	722198359	/nfs/dbraw/zinc/19/83/59/722198359.db2.gz	BFVHYBXOZNXDHG-QHCPKHFHSA-N	0	3	406.461	4.527	20	5		HJBDHN
Clc1ccc2ccc3ccc(N4CC[C@@H]5[C@@H]4CCN5Cc4cccnc4)nc3c2n1	ZINC001164725063	720389758	/nfs/dbraw/zinc/38/97/58/720389758.db2.gz	LNEFWZDLAOUUCW-UXHICEINSA-N	0	3	415.928	4.685	20	5		HJBDHN
O=[N+]([O-])c1ccc2ccc(N3CCC[C@@]4(CCN4Cc4cccc(F)c4)C3)nc2c1	ZINC001164994966	722197408	/nfs/dbraw/zinc/19/74/08/722197408.db2.gz	RCUMESKHCVTZDF-HSZRJFAPSA-N	0	3	406.461	4.527	20	5		HJBDHN
O=[N+]([O-])c1cccc2nc(N3CCC[C@@]4(CCN4Cc4cccc(F)c4)C3)ccc21	ZINC001164994947	722199243	/nfs/dbraw/zinc/19/92/43/722199243.db2.gz	QZCSCALMAQHEJO-HSZRJFAPSA-N	0	3	406.461	4.527	20	5		HJBDHN
O=[N+]([O-])c1cccc2ccc(N3CCC[C@]4(CCN4Cc4cccc(F)c4)C3)nc21	ZINC001164994611	722198441	/nfs/dbraw/zinc/19/84/41/722198441.db2.gz	OIZOESVGRSYPBZ-QHCPKHFHSA-N	0	3	406.461	4.527	20	5		HJBDHN
O=[N+]([O-])c1ccc2c(ccnc2N2CCC[C@@]3(CCN3Cc3cccc(F)c3)C2)c1	ZINC001164996586	722212937	/nfs/dbraw/zinc/21/29/37/722212937.db2.gz	ODONAAJIYJNDID-HSZRJFAPSA-N	0	3	406.461	4.527	20	5		HJBDHN
O=[N+]([O-])c1ccc2c(ccnc2N2CCC[C@]3(CCN3Cc3cccc(F)c3)C2)c1	ZINC001164996587	722213202	/nfs/dbraw/zinc/21/32/02/722213202.db2.gz	ODONAAJIYJNDID-QHCPKHFHSA-N	0	3	406.461	4.527	20	5		HJBDHN