smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CN(C)c1ccc(/C=c2\[n-]c(=O)/c(=C/c3ccc(N(C)C)cc3)[nH]c2=O)cc1	ZINC000005319358	204125384	/nfs/dbraw/zinc/12/53/84/204125384.db2.gz	YBDCSKNFSXQMSN-AXPXABNXSA-N	-1	0	376.460	0.853	50	10		GCCARM
NS(=O)(=O)c1ccc(NC=C2C(=O)[N-]C(=O)N(c3ccccc3)C2=O)cc1	ZINC000006196340	204169503	/nfs/dbraw/zinc/16/95/03/204169503.db2.gz	IMIKHMMGDHQERO-UVTDQMKNSA-N	-1	0	386.389	0.913	50	10		GCCARM
COc1ccc(CCN2C(=O)[N-]C(=O)C(=CNCCCO)C2=O)cc1OC	ZINC000006092035	570242359	/nfs/dbraw/zinc/24/23/59/570242359.db2.gz	MTPAVFDOSQFLJQ-ACCUITESSA-N	-1	0	377.397	0.181	50	10		GCCARM
COc1ccc(CN2C(=O)[N-]C(=O)C(=CNCCN3CCOCC3)C2=O)cc1	ZINC000100793796	570447680	/nfs/dbraw/zinc/44/76/80/570447680.db2.gz	WMXSWHJZHRPUFD-FOWTUZBSSA-N	-1	0	388.424	0.079	50	10		GCCARM
COc1ccc(N(CC(=O)[O-])CC(=O)N2CCN(c3ncccn3)CC2)cc1	ZINC000034926541	570548279	/nfs/dbraw/zinc/54/82/79/570548279.db2.gz	FKWLMLUFBLLNND-UHFFFAOYSA-N	-1	0	385.424	0.725	50	10		GCCARM
O=C1[N-]C(=O)N(CCc2ccccc2)C(=O)C1=CN[C@@H]1C=CS(=O)(=O)C1	ZINC000102694277	570857247	/nfs/dbraw/zinc/85/72/47/570857247.db2.gz	IBNUFWRZDMAMBP-JFBXQDQPSA-N	-1	0	375.406	0.932	50	10		GCCARM
O=C1[N-]C(=S)N(c2cccc(Cl)c2)C(=O)C1=CNCCN1CCOCC1	ZINC000019994688	210311419	/nfs/dbraw/zinc/31/14/19/210311419.db2.gz	GAFZXHCAXCVODJ-SDNWHVSQSA-N	-1	0	394.884	0.893	50	10		GCCARM
COc1ccc([C@H](CC(=O)[O-])NC=C2C(=O)N(C)C(=O)N(C)C2=O)cc1OC	ZINC000020624075	570273189	/nfs/dbraw/zinc/27/31/89/570273189.db2.gz	VKYWPJXQMMUNLE-LBPRGKRZSA-N	-1	0	391.380	0.744	50	10		GCCARM
COc1ccc(N2CCN(C(=O)CSc3nc(=O)c(C)n[n-]3)CC2)cc1	ZINC000018152720	210215403	/nfs/dbraw/zinc/21/54/03/210215403.db2.gz	BARKCVIYGVDVOJ-UHFFFAOYSA-N	-1	0	375.454	0.923	50	10		GCCARM
O=C([O-])COc1ccc(C=C2C(=O)NC(=S)NC2=O)cc1Br	ZINC000001198432	530137382	/nfs/dbraw/zinc/13/73/82/530137382.db2.gz	SOOXLOAJWAGFDZ-UHFFFAOYSA-N	-1	0	385.195	0.827	50	10		GCCARM
O=C1[N-]C(=O)N(c2cccc(Cl)c2)C(=O)C1=CN[C@H]1C=CS(=O)(=O)C1	ZINC000020592017	530148213	/nfs/dbraw/zinc/14/82/13/530148213.db2.gz	RPSWWIZJOIEFGG-QVIVLVACSA-N	-1	0	381.797	0.707	50	10		GCCARM
COc1ccc(N2C(=O)C(=CNCCN3CCOCC3)C(=O)[N-]C2=S)cc1	ZINC000020024748	210312449	/nfs/dbraw/zinc/31/24/49/210312449.db2.gz	UODXZOINWMBHFD-NTCAYCPXSA-N	-1	0	390.465	0.249	50	10		GCCARM
CC(C)OC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC=C1C(=O)[N-]C(=O)NC1=O	ZINC000005825597	570794733	/nfs/dbraw/zinc/79/47/33/570794733.db2.gz	CKDZRCMOEXRERP-OAHLLOKOSA-N	-1	0	384.392	0.870	50	10	biogenic	GCCARM
CCC(=O)N1N=C(c2c(=O)[nH]c(=O)n(C)c2[O-])C[C@@H]1c1ccc(N(C)C)cc1	ZINC000101766149	570830834	/nfs/dbraw/zinc/83/08/34/570830834.db2.gz	KRNZDODLQTVCDG-CQSZACIVSA-N	-1	0	385.424	0.933	50	10		GCCARM
O=C1[N-]C(=O)N(c2cccc(Cl)c2)C(=O)C1=CN[C@@H]1C=CS(=O)(=O)C1	ZINC000020592019	530147829	/nfs/dbraw/zinc/14/78/29/530147829.db2.gz	RPSWWIZJOIEFGG-CEXMDJMXSA-N	-1	0	381.797	0.707	50	10		GCCARM
COc1ccc(N2C(=O)[N-]C(=O)C(=CN[C@H]3C=CS(=O)(=O)C3)C2=O)cc1	ZINC000020622501	210353380	/nfs/dbraw/zinc/35/33/80/210353380.db2.gz	SHLKIIIUKLAPKY-XNFYSYIQSA-N	-1	0	377.378	0.062	50	10		GCCARM
CN1C(=O)C(=CN[C@H](Cc2c[nH]c3ccccc23)C(=O)[O-])C(=O)N(C)C1=S	ZINC000020502064	210343074	/nfs/dbraw/zinc/34/30/74/210343074.db2.gz	YRKGYKXEORUCFS-CQSZACIVSA-N	-1	0	386.433	0.852	50	10		GCCARM
COc1ccc(CN2C(=O)[N-]C(=O)C(=CNCCN3CCOCC3)C2=O)cc1	ZINC000020024896	210313423	/nfs/dbraw/zinc/31/34/23/210313423.db2.gz	WMXSWHJZHRPUFD-VBKFSLOCSA-N	-1	0	388.424	0.079	50	10		GCCARM
CCOc1ccc(N2C(=O)[N-]C(=O)C(=CNCCN3CCOCC3)C2=O)cc1	ZINC000100752571	136195955	/nfs/dbraw/zinc/19/59/55/136195955.db2.gz	ZRFVATDAZKJTTN-DTQAZKPQSA-N	-1	0	388.424	0.474	50	10		GCCARM
O=C1[N-]C(=S)N(c2ccccc2F)C(=O)C1=CNCCN1CCOCC1	ZINC000019949215	570233169	/nfs/dbraw/zinc/23/31/69/570233169.db2.gz	OZBHXPWVHRHXMT-VAWYXSNFSA-N	-1	0	378.429	0.379	50	10		GCCARM
Cc1c2c(cc(=O)n1N1CCOCC1)[n-]n(-c1nc3ccccc3s1)c2=O	ZINC000669637760	570436944	/nfs/dbraw/zinc/43/69/44/570436944.db2.gz	WUKFZNWYWGZKRP-UHFFFAOYSA-O	-1	0	384.441	0.432	50	10		GCCARM
CN1C(=O)C(=CNc2ccc(C(=O)NCC(=O)[O-])cc2)C(=O)N(C)C1=S	ZINC000009305499	1200362902	/nfs/dbraw/zinc/36/29/02/1200362902.db2.gz	HZYRMMKDKDSWPC-UHFFFAOYSA-N	-1	0	376.394	0.012	50	10		GCCARM
CC(CO)(CO)NC=C1C(=O)[N-]C(=O)N(c2ccc(Br)cc2)C1=O	ZINC000007009742	204229706	/nfs/dbraw/zinc/22/97/06/204229706.db2.gz	KFWSOFMQFRIXQM-WDZFZDKYSA-N	-1	0	398.213	0.249	50	10		GCCARM
O=C([O-])COc1ccc(/C=C2/SC(N3CCN(CCO)CC3)=NC2=O)cc1	ZINC000008569705	204279262	/nfs/dbraw/zinc/27/92/62/204279262.db2.gz	IVGVJWBYWGQTLU-RVDMUPIBSA-N	-1	0	391.449	0.730	50	10		GCCARM
Cc1cc(=O)oc2c1ccc([O-])c2CN1CCN(S(=O)(=O)N(C)C)CC1	ZINC000079479864	211156108	/nfs/dbraw/zinc/15/61/08/211156108.db2.gz	LFRWBTLRSMKXDB-UHFFFAOYSA-N	-1	0	381.454	0.731	50	10	biogenic	GCCARM
O=C1[N-]C(=O)N(Cc2ccc(F)cc2)C(=O)C1=CNCCN1CCOCC1	ZINC000020332966	570252510	/nfs/dbraw/zinc/25/25/10/570252510.db2.gz	XEZCKLOUAASXMC-RVDMUPIBSA-N	-1	0	376.388	0.210	50	10		GCCARM
O=C1[N-]C(=O)N(CCc2ccccc2)C(=O)C1=CN[C@H]1C=CS(=O)(=O)C1	ZINC000102694273	570857269	/nfs/dbraw/zinc/85/72/69/570857269.db2.gz	IBNUFWRZDMAMBP-ODUNQGDFSA-N	-1	0	375.406	0.932	50	10		GCCARM
O=C1[N-]C(=S)N(c2ccc(F)cc2)C(=O)C1=CNCCN1CCOCC1	ZINC000020025766	570235411	/nfs/dbraw/zinc/23/54/11/570235411.db2.gz	VWDFXQYFRFXFQG-SDNWHVSQSA-N	-1	0	378.429	0.379	50	10		GCCARM
O=C1[N-]C(=O)N(CCc2ccccc2)C(=O)C1=CN[C@H]1C=CS(=O)(=O)C1	ZINC000020622909	570272874	/nfs/dbraw/zinc/27/28/74/570272874.db2.gz	IBNUFWRZDMAMBP-LFGHMXSPSA-N	-1	0	375.406	0.092	50	10		GCCARM
CC(C)OC(=O)[C@H](Cc1c[nH]c2ccccc12)NC=C1C(=O)[N-]C(=O)NC1=O	ZINC000005825600	570794847	/nfs/dbraw/zinc/79/48/47/570794847.db2.gz	CKDZRCMOEXRERP-HNNXBMFYSA-N	-1	0	384.392	0.870	50	10	biogenic	GCCARM
COC(=O)COc1ccc(C=C2C(=O)[N-]C(=O)NC2=O)cc1Br	ZINC000001198652	530114490	/nfs/dbraw/zinc/11/44/90/530114490.db2.gz	FDVBWUMJARASPQ-UHFFFAOYSA-N	-1	0	383.154	0.750	50	10		GCCARM
COCCCN1C(=O)[N-]C(=O)C(=CNCc2nc(-c3ccccc3)no2)C1=O	ZINC000020622342	210354276	/nfs/dbraw/zinc/35/42/76/210354276.db2.gz	HMTSIZRUPFRZKM-JLHYYAGUSA-N	-1	0	385.380	0.825	50	10		GCCARM
O=C1[N-]C(=O)N(CCc2ccccc2)C(=O)C1=CN[C@@H]1C=CS(=O)(=O)C1	ZINC000020622911	570272995	/nfs/dbraw/zinc/27/29/95/570272995.db2.gz	IBNUFWRZDMAMBP-PCRWRXJSSA-N	-1	0	375.406	0.092	50	10		GCCARM
O=C1[N-]C(=O)N(c2ccccc2Cl)C(=O)C1=CNCCN1CCOCC1	ZINC000020025399	210312222	/nfs/dbraw/zinc/31/22/22/210312222.db2.gz	OFTUJFJFJIENOZ-QXMHVHEDSA-N	-1	0	378.816	0.729	50	10		GCCARM
COc1ccc(N2C(=O)[N-]C(=O)C(=CN[C@H]3C=CS(=O)(=O)C3)C2=O)cc1	ZINC000102705884	136196568	/nfs/dbraw/zinc/19/65/68/136196568.db2.gz	SHLKIIIUKLAPKY-AAIQCTMTSA-N	-1	0	377.378	0.903	50	10		GCCARM
COc1ccc(N2C(=O)[N-]C(=O)C(=CN[C@@H]3C=CS(=O)(=O)C3)C2=O)cc1	ZINC000102705886	536662067	/nfs/dbraw/zinc/66/20/67/536662067.db2.gz	SHLKIIIUKLAPKY-GARZTLJTSA-N	-1	0	377.378	0.903	50	10		GCCARM
COc1ccc(N2C(=O)C(=CN[C@@H]3C=CS(=O)(=O)C3)C(=O)[N-]C2=S)cc1	ZINC000020624031	570273229	/nfs/dbraw/zinc/27/32/29/570273229.db2.gz	CXQAWUUYHIWDSL-SEEODLKFSA-N	-1	0	393.446	0.227	50	10		GCCARM
CCOC(=O)N1CCN(C(=O)CN(CC(=O)[O-])c2ccc(OC)cc2)CC1	ZINC000034926537	570548141	/nfs/dbraw/zinc/54/81/41/570548141.db2.gz	FVMNLZZJTNOWGN-UHFFFAOYSA-N	-1	0	379.413	0.887	50	10		GCCARM
COc1ccc(CN2C(=O)[N-]C(=O)C(=CN[C@@H]3C=CS(=O)(=O)C3)C2=O)cc1	ZINC000020624008	570273157	/nfs/dbraw/zinc/27/31/57/570273157.db2.gz	OZJPVROGEVQSRO-ZBQKXELDSA-N	-1	0	391.405	0.058	50	10		GCCARM
COc1cc(/C=C2/C(=O)[N-]C(=O)N(Cc3ccco3)C2=O)ccc1OCC(N)=O	ZINC000000876906	570504174	/nfs/dbraw/zinc/50/41/74/570504174.db2.gz	XOHJHLXXFBAQIE-QPEQYQDCSA-N	-1	0	399.359	0.814	50	10		GCCARM
CCC(=O)N1N=C(c2c(=O)[nH]c(=O)n(C)c2[O-])C[C@H]1c1ccc(N(C)C)cc1	ZINC000101766146	570830588	/nfs/dbraw/zinc/83/05/88/570830588.db2.gz	KRNZDODLQTVCDG-AWEZNQCLSA-N	-1	0	385.424	0.933	50	10		GCCARM
CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2C=C2C(=O)[N-]C(=O)NC2=O)CC1	ZINC000009009781	1200303473	/nfs/dbraw/zinc/30/34/73/1200303473.db2.gz	VKXWAMLSQMPKPN-UHFFFAOYSA-N	-1	0	387.352	0.853	50	10		GCCARM
Cc1c2c(cc(=O)n1N1CCN(C)CC1)[n-]n(-c1nc3ccccc3s1)c2=O	ZINC000669637759	570436845	/nfs/dbraw/zinc/43/68/45/570436845.db2.gz	VNOKSMRTQHKADD-UHFFFAOYSA-O	-1	0	397.484	0.347	50	10		GCCARM
O=C1[N-]C(=O)N(CCc2ccc(F)cc2)C(=O)C1=CNCCN1CCOCC1	ZINC000100756537	570440429	/nfs/dbraw/zinc/44/04/29/570440429.db2.gz	GYBQVZGUACCGHY-DTQAZKPQSA-N	-1	0	390.415	0.252	50	10		GCCARM
CC(=O)N1N=C(c2c([O-])n(C)c(=O)n(C)c2=O)C[C@@H]1c1ccc(N(C)C)cc1	ZINC000101763823	208399334	/nfs/dbraw/zinc/39/93/34/208399334.db2.gz	PYGRWCFFXZCEAV-OAHLLOKOSA-N	-1	0	385.424	0.553	50	10		GCCARM
NC(=O)COc1ccccc1/C=C1\C(=O)[N-]C(=O)N(c2ccc(O)cc2)C1=O	ZINC000001105926	570755287	/nfs/dbraw/zinc/75/52/87/570755287.db2.gz	AJIGBDBZUSDCIO-NTEUORMPSA-N	-1	0	381.344	0.923	50	10		GCCARM
COc1ccc(CN2C(=O)[N-]C(=O)C(=CN[C@H]3C=CS(=O)(=O)C3)C2=O)cc1	ZINC000102706871	570857688	/nfs/dbraw/zinc/85/76/88/570857688.db2.gz	OZJPVROGEVQSRO-QENILXLESA-N	-1	0	391.405	0.898	50	10		GCCARM
COc1cccc(N2C(=O)C(=CNCCN3CCOCC3)C(=O)[N-]C2=S)c1	ZINC000019948867	207173134	/nfs/dbraw/zinc/17/31/34/207173134.db2.gz	WPCXJOPPTMHYNL-NTCAYCPXSA-N	-1	0	390.465	0.249	50	10		GCCARM
COCCCN1C(=O)[N-]C(=O)C(=CNCc2noc(-c3ccccc3)n2)C1=O	ZINC000020623903	570273238	/nfs/dbraw/zinc/27/32/38/570273238.db2.gz	VBRSZTKFDIHOHM-JLHYYAGUSA-N	-1	0	385.380	0.825	50	10		GCCARM
O=C([O-])COc1ccc(/C=C2\SC(N3CCN(CCO)CC3)=NC2=O)cc1	ZINC000036617537	570755528	/nfs/dbraw/zinc/75/55/28/570755528.db2.gz	IVGVJWBYWGQTLU-PTNGSMBKSA-N	-1	0	391.449	0.730	50	10		GCCARM
COc1ccc(CN2C(=O)[N-]C(=O)C(=CN[C@@H]3C=CS(=O)(=O)C3)C2=O)cc1	ZINC000102706873	570857699	/nfs/dbraw/zinc/85/76/99/570857699.db2.gz	OZJPVROGEVQSRO-UGMNDJHYSA-N	-1	0	391.405	0.898	50	10		GCCARM
COc1ccc(N2C(=O)[N-]C(=O)C(=CN[C@@H]3C=CS(=O)(=O)C3)C2=O)cc1	ZINC000020622504	207208330	/nfs/dbraw/zinc/20/83/30/207208330.db2.gz	SHLKIIIUKLAPKY-SEEODLKFSA-N	-1	0	377.378	0.062	50	10		GCCARM
CN1C(=O)C(=CN[C@@H](Cc2c[nH]c3ccccc23)C(=O)[O-])C(=O)N(C)C1=S	ZINC000020502062	207199991	/nfs/dbraw/zinc/19/99/91/207199991.db2.gz	YRKGYKXEORUCFS-AWEZNQCLSA-N	-1	0	386.433	0.852	50	10		GCCARM
CC(=O)N1N=C(c2c([O-])n(C)c(=O)n(C)c2=O)C[C@H]1c1ccc(N(C)C)cc1	ZINC000101763819	208399463	/nfs/dbraw/zinc/39/94/63/208399463.db2.gz	PYGRWCFFXZCEAV-HNNXBMFYSA-N	-1	0	385.424	0.553	50	10		GCCARM
COc1ccc(N2C(=O)C(=CN[C@H]3C=CS(=O)(=O)C3)C(=O)[N-]C2=S)cc1	ZINC000102689983	536657115	/nfs/dbraw/zinc/65/71/15/536657115.db2.gz	CXQAWUUYHIWDSL-AAIQCTMTSA-N	-1	0	393.446	0.638	50	10		GCCARM
COc1ccc(N2C(=O)C(=CN[C@@H]3C=CS(=O)(=O)C3)C(=O)[N-]C2=S)cc1	ZINC000102689988	536657757	/nfs/dbraw/zinc/65/77/57/536657757.db2.gz	CXQAWUUYHIWDSL-GARZTLJTSA-N	-1	0	393.446	0.638	50	10		GCCARM
O=C1[N-]C(=S)N(c2ccccc2Cl)C(=O)C1=CNCCN1CCOCC1	ZINC000019998018	570234651	/nfs/dbraw/zinc/23/46/51/570234651.db2.gz	OSBMQVAITOGYOB-VAWYXSNFSA-N	-1	0	394.884	0.893	50	10		GCCARM
O=C1[N-]C(=O)N(c2cccc(Cl)c2)C(=O)C1=CNCCN1CCOCC1	ZINC000020024565	570235467	/nfs/dbraw/zinc/23/54/67/570235467.db2.gz	UETYHQAMSQMPDI-SDNWHVSQSA-N	-1	0	378.816	0.729	50	10		GCCARM
COc1ccc(N2C(=O)C(=CN[C@H]3C=CS(=O)(=O)C3)C(=O)[N-]C2=S)cc1	ZINC000020624028	570273181	/nfs/dbraw/zinc/27/31/81/570273181.db2.gz	CXQAWUUYHIWDSL-XNFYSYIQSA-N	-1	0	393.446	0.227	50	10		GCCARM
COc1ccc([C@@H](CC(=O)[O-])NC=C2C(=O)N(C)C(=O)N(C)C2=O)cc1OC	ZINC000020624071	207208362	/nfs/dbraw/zinc/20/83/62/207208362.db2.gz	VKYWPJXQMMUNLE-GFCCVEGCSA-N	-1	0	391.380	0.744	50	10		GCCARM
COc1ccc(CN2C(=O)[N-]C(=O)C(=CN[C@H]3C=CS(=O)(=O)C3)C2=O)cc1	ZINC000020624005	207209543	/nfs/dbraw/zinc/20/95/43/207209543.db2.gz	OZJPVROGEVQSRO-ACLQVGRQSA-N	-1	0	391.405	0.058	50	10		GCCARM
O=C1[N-]C(=O)N(c2ccccc2Cl)C(=O)C1=CNCCN1CCOCC1	ZINC000100796593	136196068	/nfs/dbraw/zinc/19/60/68/136196068.db2.gz	OFTUJFJFJIENOZ-VAWYXSNFSA-N	-1	0	378.816	0.729	50	10		GCCARM
COC(=O)c1sc(NC=C2C(=O)NC(=S)NC2=O)c(C(=O)OC)c1C	ZINC000028976144	530153485	/nfs/dbraw/zinc/15/34/85/530153485.db2.gz	IVMPOKUOEFULJP-UHFFFAOYSA-N	-1	0	383.407	0.456	50	10		GCCARM
NC(=O)C1CCN(c2ccc([N+](=O)[O-])cc2C=C2C(=O)[N-]C(=O)NC2=O)CC1	ZINC000020076689	207177016	/nfs/dbraw/zinc/17/70/16/207177016.db2.gz	MNMNFAFKYMGCRJ-UHFFFAOYSA-N	-1	0	387.352	0.886	50	10		GCCARM
O=C1[N-]C(=O)N(CCc2ccc(F)cc2)C(=O)C1=CNCCN1CCOCC1	ZINC000019949770	207173033	/nfs/dbraw/zinc/17/30/33/207173033.db2.gz	GYBQVZGUACCGHY-SSZFMOIBSA-N	-1	0	390.415	0.252	50	10		GCCARM
CC(=O)Nc1nnc(S(=O)(=O)[N-]Cc2ccc(N3CCOCC3)cc2)s1	ZINC000062027294	136156328	/nfs/dbraw/zinc/15/63/28/136156328.db2.gz	DNHNREGGBZLQCM-UHFFFAOYSA-N	-1	0	397.482	0.812	50	10		GCCARM
O=C1[N-]C(=O)N(c2ccc(Cl)cc2)C(=O)C1=CNCCN1CCOCC1	ZINC000100765087	136196058	/nfs/dbraw/zinc/19/60/58/136196058.db2.gz	NWPZAVZVXHLPJS-SDNWHVSQSA-N	-1	0	378.816	0.729	50	10		GCCARM
O=C1[N-]C(=S)N(c2ccc(Cl)cc2)C(=O)C1=CNCCN1CCOCC1	ZINC000019608041	207143151	/nfs/dbraw/zinc/14/31/51/207143151.db2.gz	OETFHNANJWSMHS-SDNWHVSQSA-N	-1	0	394.884	0.893	50	10		GCCARM
CCOc1ccc(N2C(=O)[N-]C(=O)C(=CNCCN3CCOCC3)C2=O)cc1	ZINC000019948887	570233481	/nfs/dbraw/zinc/23/34/81/570233481.db2.gz	ZRFVATDAZKJTTN-SSZFMOIBSA-N	-1	0	388.424	0.474	50	10		GCCARM
O=C(Cn1cc(C=C2C(=O)[N-]C(=O)NC2=O)c2ccccc21)N1CCOCC1	ZINC000009111540	570549995	/nfs/dbraw/zinc/54/99/95/570549995.db2.gz	ABPFTXFSLCMJCH-UHFFFAOYSA-N	-1	0	382.376	0.250	50	10		GCCARM