smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1nnc([C@H]2C[C@H]3OCC[C@H]3[N@@H+](Cc3ccoc3)C2)o1	ZINC000096041302	185068728	/nfs/dbraw/zinc/06/87/28/185068728.db2.gz	XAQBJPFRYQCPPP-BFHYXJOUSA-N	1	1	289.335	2.118	40	0		CEABMO
Cn1ncc2c1C[N@@H+](CC1CC1)C[C@H]2COc1cccnc1	ZINC000096044664	185071259	/nfs/dbraw/zinc/07/12/59/185071259.db2.gz	DJVHDSRPUZCCMX-AWEZNQCLSA-N	1	1	298.390	2.203	40	0		CEABMO
Cc1nc(C[NH+]2CCC3(CCCC(=O)N3)CC2)cs1	ZINC000096047389	185072851	/nfs/dbraw/zinc/07/28/51/185072851.db2.gz	IABSXGAGZQXRAL-UHFFFAOYSA-N	1	1	279.409	2.086	40	0		CEABMO
O=C1[C@H]2C[N@H+](Cc3nccs3)C[C@H]2CN1c1ccccc1	ZINC000096053578	185073863	/nfs/dbraw/zinc/07/38/63/185073863.db2.gz	OHYFPUCVDPFUIH-JSGCOSHPSA-N	1	1	299.399	2.238	40	0		CEABMO
O=C1[C@H]2C[N@@H+](Cc3nccs3)C[C@H]2CN1c1ccccc1	ZINC000096053578	185073865	/nfs/dbraw/zinc/07/38/65/185073865.db2.gz	OHYFPUCVDPFUIH-JSGCOSHPSA-N	1	1	299.399	2.238	40	0		CEABMO
Cc1ccc(C[N@H+]2CCC[C@@]3(CCCC(=O)N3)C2)o1	ZINC000096049940	185074365	/nfs/dbraw/zinc/07/43/65/185074365.db2.gz	SUFXQZXCARATNO-HNNXBMFYSA-N	1	1	262.353	2.223	40	0		CEABMO
COCCO[C@H]1CC[N@@H+](CC2CC2)[C@H]1Cc1cccnc1	ZINC000096069934	185085180	/nfs/dbraw/zinc/08/51/80/185085180.db2.gz	VNZPZKKRWVRABS-IRXDYDNUSA-N	1	1	290.407	2.140	40	0		CEABMO
O[C@H]1CC[N@@H+](Cc2ccncc2)[C@H]1Cc1ccccc1	ZINC000096069894	185086011	/nfs/dbraw/zinc/08/60/11/185086011.db2.gz	WQFUXMMDJKIKSU-IRXDYDNUSA-N	1	1	268.360	2.260	40	0		CEABMO
O=C1C[C@@H]2[C@H](CC[N@H+]2Cc2ccoc2)N1c1cccnc1	ZINC000096110717	185101368	/nfs/dbraw/zinc/10/13/68/185101368.db2.gz	FDXKKSVLPFZXLW-LSDHHAIUSA-N	1	1	283.331	2.054	40	0		CEABMO
C[C@@H](CCN1C[C@@H]2C[C@@H](O)C[N@H+]2C[C@@H]1C)c1ccccc1	ZINC000019575840	343374691	/nfs/dbraw/zinc/37/46/91/343374691.db2.gz	OQWLLWPCXDAZNO-UOVPBQLFSA-N	1	1	288.435	2.320	40	0		CEABMO
C[C@@H](CC[N@@H+]1C[C@@H]2C[C@@H](O)CN2C[C@@H]1C)c1ccccc1	ZINC000019575840	343374693	/nfs/dbraw/zinc/37/46/93/343374693.db2.gz	OQWLLWPCXDAZNO-UOVPBQLFSA-N	1	1	288.435	2.320	40	0		CEABMO
C[C@@H](CC[N@H+]1C[C@@H]2C[C@@H](O)CN2C[C@@H]1C)c1ccccc1	ZINC000019575840	343374696	/nfs/dbraw/zinc/37/46/96/343374696.db2.gz	OQWLLWPCXDAZNO-UOVPBQLFSA-N	1	1	288.435	2.320	40	0		CEABMO
CNc1cc(N2CCc3cc([C@H](C)O)ccc3C2)[nH+]c(C)n1	ZINC000329012107	136377332	/nfs/dbraw/zinc/37/73/32/136377332.db2.gz	MJLIRJSHIGKKFI-NSHDSACASA-N	1	1	298.390	2.443	40	0		CEABMO
COc1ccccc1C[NH2+]CC(=O)NCc1ccc(C)cc1	ZINC000057466994	362581445	/nfs/dbraw/zinc/58/14/45/362581445.db2.gz	GGPDDTCGJZHJEP-UHFFFAOYSA-N	1	1	298.386	2.410	40	0		CEABMO
CC(C)(C)C(=O)NCc1cccc(C[NH+]2CCOCC2)c1	ZINC000058459177	362630472	/nfs/dbraw/zinc/63/04/72/362630472.db2.gz	KNSDACIAEGXJOO-UHFFFAOYSA-N	1	1	290.407	2.181	40	0		CEABMO
OCCN(C[C@H]1CCCC[N@H+]1Cc1ccccc1)C1CC1	ZINC000079393550	363594264	/nfs/dbraw/zinc/59/42/64/363594264.db2.gz	IEQTULLHKUGKQD-GOSISDBHSA-N	1	1	288.435	2.498	40	0		CEABMO
OCC[N@H+](C[C@H]1CCCCN1Cc1ccccc1)C1CC1	ZINC000079393550	363594269	/nfs/dbraw/zinc/59/42/69/363594269.db2.gz	IEQTULLHKUGKQD-GOSISDBHSA-N	1	1	288.435	2.498	40	0		CEABMO
OCC[N@@H+](C[C@H]1CCCCN1Cc1ccccc1)C1CC1	ZINC000079393550	363594275	/nfs/dbraw/zinc/59/42/75/363594275.db2.gz	IEQTULLHKUGKQD-GOSISDBHSA-N	1	1	288.435	2.498	40	0		CEABMO
CC(C)N(C[C@H]1CCC[N@H+]1CCO)C(=O)OC(C)(C)C	ZINC000079408078	363595130	/nfs/dbraw/zinc/59/51/30/363595130.db2.gz	ZHVLTSMOZCQNNF-CYBMUJFWSA-N	1	1	286.416	2.089	40	0		CEABMO
Cc1c[nH]nc1[C@@H]1CCC[N@H+](Cc2cnn(C)c2C)C1	ZINC000011789303	361365077	/nfs/dbraw/zinc/36/50/77/361365077.db2.gz	HNFWVPHAYZVSIW-CYBMUJFWSA-N	1	1	273.384	2.140	40	0		CEABMO
O=C1NCC[NH2+][C@H]1Cc1ccccc1-c1cccs1	ZINC000019348547	361528486	/nfs/dbraw/zinc/52/84/86/361528486.db2.gz	BTKBKRLTHJGULB-ZDUSSCGKSA-N	1	1	272.373	2.046	40	0		CEABMO
CCn1cc(C[N@H+]2CC[C@@H](CO)C2)c2cc(OC)ccc21	ZINC000019524745	361541553	/nfs/dbraw/zinc/54/15/53/361541553.db2.gz	NFPSIHVMCBYDBF-CYBMUJFWSA-N	1	1	288.391	2.484	40	0		CEABMO
C[C@H](CCN1C[C@@H]2C[C@@H](O)C[N@H+]2C[C@@H]1C)c1ccccc1	ZINC000019575842	361543081	/nfs/dbraw/zinc/54/30/81/361543081.db2.gz	OQWLLWPCXDAZNO-MXSMSXNCSA-N	1	1	288.435	2.320	40	0		CEABMO
C[C@H](CC[N@@H+]1C[C@@H]2C[C@@H](O)CN2C[C@@H]1C)c1ccccc1	ZINC000019575842	361543085	/nfs/dbraw/zinc/54/30/85/361543085.db2.gz	OQWLLWPCXDAZNO-MXSMSXNCSA-N	1	1	288.435	2.320	40	0		CEABMO
C[C@H](CC[N@H+]1C[C@@H]2C[C@@H](O)CN2C[C@@H]1C)c1ccccc1	ZINC000019575842	361543089	/nfs/dbraw/zinc/54/30/89/361543089.db2.gz	OQWLLWPCXDAZNO-MXSMSXNCSA-N	1	1	288.435	2.320	40	0		CEABMO
Cc1c2cc(F)ccc2[nH]c1C(=O)N[C@H]1CCC[N@H+](C)C1	ZINC000019565404	361544083	/nfs/dbraw/zinc/54/40/83/361544083.db2.gz	VXIPIJWUFSKVMN-LBPRGKRZSA-N	1	1	289.354	2.439	40	0		CEABMO
CCOC(=O)[C@@H]1[C@H]2CC[C@@H]1[N@@H+](Cc1ccccc1)C2	ZINC000026895312	361647544	/nfs/dbraw/zinc/64/75/44/361647544.db2.gz	HDLAPPYOWZTRFN-SOUVJXGZSA-N	1	1	259.349	2.460	40	0		CEABMO
c1cnc(N2CCC[C@]3(CC[N@H+](CC4CC4)C3)C2)nc1	ZINC000096047165	364398595	/nfs/dbraw/zinc/39/85/95/364398595.db2.gz	JPKKMKHDIIKISI-MRXNPFEDSA-N	1	1	272.396	2.179	40	0		CEABMO
CCn1c(=O)ccc2c1CC[N@@H+](Cc1ccoc1)CC2	ZINC000096196640	364408728	/nfs/dbraw/zinc/40/87/28/364408728.db2.gz	FBHURKMPACZDHD-UHFFFAOYSA-N	1	1	272.348	2.062	40	0		CEABMO
O[C@H]1CC[N@@H+](Cc2ccoc2)[C@H]1Cc1ccccc1	ZINC000096200338	364411382	/nfs/dbraw/zinc/41/13/82/364411382.db2.gz	GIRNUCOHFXCUFY-HOTGVXAUSA-N	1	1	257.333	2.458	40	0		CEABMO
O=C1[C@H]2C[N@@H+](Cc3ccco3)C[C@H]2CN1c1ccsc1	ZINC000096245218	364416257	/nfs/dbraw/zinc/41/62/57/364416257.db2.gz	DAABTUWJQYZITM-FZMZJTMJSA-N	1	1	288.372	2.436	40	0		CEABMO
c1ccc(C[N@H+]2CCc3ncnc(C4CC4)c3CC2)nc1	ZINC000096255084	364418563	/nfs/dbraw/zinc/41/85/63/364418563.db2.gz	ZGLBTFWCWGYNLX-UHFFFAOYSA-N	1	1	280.375	2.350	40	0		CEABMO
CCCNC(=O)NCCC[N@H+]1CCCC[C@@H]1CC	ZINC000225774411	370315955	/nfs/dbraw/zinc/31/59/55/370315955.db2.gz	OBFHCSABFKURFO-ZDUSSCGKSA-N	1	1	255.406	2.350	40	0		CEABMO
O=C(c1ccco1)N1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccco1)C2	ZINC000247875043	371145013	/nfs/dbraw/zinc/14/50/13/371145013.db2.gz	NJSHLPKBSUORBJ-STQMWFEESA-N	1	1	286.331	2.219	40	0		CEABMO
O=C(c1ccco1)N1C[C@H]2C[C@@H](C1)[N@@H+](Cc1ccco1)C2	ZINC000247875043	371145014	/nfs/dbraw/zinc/14/50/14/371145014.db2.gz	NJSHLPKBSUORBJ-STQMWFEESA-N	1	1	286.331	2.219	40	0		CEABMO
CNc1cc([C@H]2CCCN(c3ncccn3)C2)cc[nH+]1	ZINC000257200344	371610626	/nfs/dbraw/zinc/61/06/26/371610626.db2.gz	ACXQDIRUBQAAMT-ZDUSSCGKSA-N	1	1	269.352	2.297	40	0		CEABMO
Cc1c[nH]nc1C[C@H]1CCC[N@@H+](Cc2[nH]cnc2C)C1	ZINC000257228117	190015824	/nfs/dbraw/zinc/01/58/24/190015824.db2.gz	FSJCSFONPJAOLG-CYBMUJFWSA-N	1	1	273.384	2.204	40	0		CEABMO
COc1ccc([C@@H]2C[C@]3(C)NC(=O)CCC[C@@H]3[N@H+]2C)cc1	ZINC000257246623	190019182	/nfs/dbraw/zinc/01/91/82/190019182.db2.gz	IUYZADBRLKFOOI-ZOBUZTSGSA-N	1	1	288.391	2.499	40	0		CEABMO
Cc1ccc(C[N@H+]2CC[C@@H](c3nccc(C)n3)C2)cn1	ZINC000257264706	190022968	/nfs/dbraw/zinc/02/29/68/190022968.db2.gz	LVSOEPGIDXOKPG-OAHLLOKOSA-N	1	1	268.364	2.478	40	0		CEABMO
CCOCC[N@H+]1CCC[C@@H]1c1cc(NC)nc(C)n1	ZINC000257259420	190021831	/nfs/dbraw/zinc/02/18/31/190021831.db2.gz	KYGTUWXKBVHHRP-CYBMUJFWSA-N	1	1	264.373	2.000	40	0		CEABMO
Cc1cccc(C[N@H+]2CC[C@@]3(CCCO3)[C@@H](O)C2)c1	ZINC000257276682	190025768	/nfs/dbraw/zinc/02/57/68/190025768.db2.gz	NUSCTFFIZRYISP-HOTGVXAUSA-N	1	1	261.365	2.111	40	0		CEABMO
CCOc1ccccc1C[N@H+]1CC[C@@]2(CCCO2)[C@@H](O)C1	ZINC000257281390	190026114	/nfs/dbraw/zinc/02/61/14/190026114.db2.gz	OOYOEZWWBDIHOT-IRXDYDNUSA-N	1	1	291.391	2.201	40	0		CEABMO
O[C@H]1C[N@@H+](Cc2ccc3[nH]ccc3c2)CC[C@@]12CCCO2	ZINC000257271341	190024368	/nfs/dbraw/zinc/02/43/68/190024368.db2.gz	MXXUEQQBPVCWGL-IRXDYDNUSA-N	1	1	286.375	2.284	40	0		CEABMO
CC(C)n1ccnc1C[N@@H+]1CC[C@@H](c2cc[nH]n2)C1	ZINC000257293749	190028285	/nfs/dbraw/zinc/02/82/85/190028285.db2.gz	QQZVCZFPAHXFCI-GFCCVEGCSA-N	1	1	259.357	2.177	40	0		CEABMO
CC(C)n1ccnc1C[N@H+]1CC[C@@H](c2cc[nH]n2)C1	ZINC000257293749	190028286	/nfs/dbraw/zinc/02/82/86/190028286.db2.gz	QQZVCZFPAHXFCI-GFCCVEGCSA-N	1	1	259.357	2.177	40	0		CEABMO
C[N@H+]1CCC[C@@H]1c1ccnc(C(=O)NCC2CCC2)c1	ZINC000257299066	190029187	/nfs/dbraw/zinc/02/91/87/190029187.db2.gz	ROPNACTUHTXGMR-OAHLLOKOSA-N	1	1	273.380	2.378	40	0		CEABMO
CO[C@H]1CC[N@@H+](CCOc2ccccc2)C[C@@]12CCCO2	ZINC000257299866	190029306	/nfs/dbraw/zinc/02/93/06/190029306.db2.gz	RRZJJSQOMZLNQS-IRXDYDNUSA-N	1	1	291.391	2.335	40	0		CEABMO
Cc1c[nH]c([C@H]2CCC[N@@H+](Cc3cc(C)on3)C2)n1	ZINC000257297491	190029848	/nfs/dbraw/zinc/02/98/48/190029848.db2.gz	RHLMNZXPSRGROP-LBPRGKRZSA-N	1	1	260.341	2.394	40	0		CEABMO
Cc1c[nH]c([C@H]2CCC[N@H+](Cc3cc(C)on3)C2)n1	ZINC000257297491	190029849	/nfs/dbraw/zinc/02/98/49/190029849.db2.gz	RHLMNZXPSRGROP-LBPRGKRZSA-N	1	1	260.341	2.394	40	0		CEABMO
CCN1CCC([N@@H+]2CC[C@@H](c3nc(C)cc(C)n3)C2)CC1	ZINC000257313418	190031922	/nfs/dbraw/zinc/03/19/22/190031922.db2.gz	USHNNOOJYFGJOY-OAHLLOKOSA-N	1	1	288.439	2.367	40	0		CEABMO
CCN1CCC([N@H+]2CC[C@@H](c3nc(C)cc(C)n3)C2)CC1	ZINC000257313418	190031923	/nfs/dbraw/zinc/03/19/23/190031923.db2.gz	USHNNOOJYFGJOY-OAHLLOKOSA-N	1	1	288.439	2.367	40	0		CEABMO
Cc1cc(N)cc([C@H]2CN(Cc3cncs3)CCO2)[nH+]1	ZINC000257328674	190034608	/nfs/dbraw/zinc/03/46/08/190034608.db2.gz	XGQUWSCYMJRCHQ-CQSZACIVSA-N	1	1	290.392	2.002	40	0		CEABMO
O=C(c1ccncc1)N1CCC2(CCc3[nH+]ccn3C2)CC1	ZINC000306141189	376539975	/nfs/dbraw/zinc/53/99/75/376539975.db2.gz	VOAFCXTTWVHZNO-UHFFFAOYSA-N	1	1	296.374	2.147	40	0		CEABMO
C[NH+](C)Cc1cn2c(n1)CN(Cc1cccc(F)c1)CC2	ZINC000096197171	256819008	/nfs/dbraw/zinc/81/90/08/256819008.db2.gz	RMZRRUZNARBSLP-UHFFFAOYSA-N	1	1	288.370	2.100	40	0		CEABMO
CCC[N@H+]1CCC[C@H]1c1cccnc1N1CCOCC1	ZINC000072216224	394593306	/nfs/dbraw/zinc/59/33/06/394593306.db2.gz	ZKEHSAHONRMGKA-HNNXBMFYSA-N	1	1	275.396	2.465	40	0		CEABMO
COC(=O)[C@@H]1C[N@@H+](C)C[C@H]1c1cccc(Br)c1	ZINC000252516821	394571997	/nfs/dbraw/zinc/57/19/97/394571997.db2.gz	XBPKBJLBWHOMCJ-NWDGAFQWSA-N	1	1	298.180	2.267	40	0		CEABMO
Cc1cccc(N2C(=O)[C@H]([NH3+])[C@H]2c2ccccc2)c1	ZINC000072227396	394595521	/nfs/dbraw/zinc/59/55/21/394595521.db2.gz	SXKSANYKZLGAMA-HUUCEWRRSA-N	1	1	252.317	2.410	40	0		CEABMO
[NH3+][C@@H]1C(=O)N(c2ccc(F)cc2)[C@@H]1c1cccs1	ZINC000072227198	394595557	/nfs/dbraw/zinc/59/55/57/394595557.db2.gz	RRJYLPIQTIKPMO-NWDGAFQWSA-N	1	1	262.309	2.302	40	0		CEABMO
CCN1CCN(c2ccc([C@H]([NH3+])c3ccccc3)cn2)CC1	ZINC000072225555	394595566	/nfs/dbraw/zinc/59/55/66/394595566.db2.gz	VZCUPVFRCXWNGG-GOSISDBHSA-N	1	1	296.418	2.272	40	0		CEABMO
COc1cccc([C@@H]2[C@@H]([NH3+])C(=O)N2Cc2ccccc2)c1	ZINC000072228144	394596077	/nfs/dbraw/zinc/59/60/77/394596077.db2.gz	ZXWJWTCOHDJEDI-HZPDHXFCSA-N	1	1	282.343	2.106	40	0		CEABMO
C[N@H+]1CC[C@]2(C1)COCc1cnc(-c3ccccc3)nc12	ZINC000096080385	394675602	/nfs/dbraw/zinc/67/56/02/394675602.db2.gz	YLCQPSWLMCIPQB-KRWDZBQOSA-N	1	1	281.359	2.247	40	0		CEABMO
CC(C)[N@H+]1CCC[C@@H]1c1cnc(-c2ccnn2C)cn1	ZINC000257205893	400317290	/nfs/dbraw/zinc/31/72/90/400317290.db2.gz	BAZLQWTWEDRHOI-OAHLLOKOSA-N	1	1	271.368	2.422	40	0		CEABMO
Cc1cc(Nc2ncccn2)nc([C@H]2CCC[N@H+](C)C2)n1	ZINC000072359946	176376743	/nfs/dbraw/zinc/37/67/43/176376743.db2.gz	LKOFNRCYYAMZTH-LBPRGKRZSA-N	1	1	284.367	2.128	40	0		CEABMO
CC[N@H+]1CCC[C@@H](c2nccnc2Nc2cnccn2)C1	ZINC000072361583	176377314	/nfs/dbraw/zinc/37/73/14/176377314.db2.gz	UOXXUOBJMIQXHS-GFCCVEGCSA-N	1	1	284.367	2.210	40	0		CEABMO
CC(C)(C)C[N@H+]1CCC[C@H]1c1cc(CCO)n[nH]1	ZINC000072361186	176377485	/nfs/dbraw/zinc/37/74/85/176377485.db2.gz	TVADGCXWYNLUEV-ZDUSSCGKSA-N	1	1	251.374	2.128	40	0		CEABMO
OCc1cc([C@@H]2CCC[N@@H+](CCc3ccccc3)C2)n[nH]1	ZINC000072363743	176378039	/nfs/dbraw/zinc/37/80/39/176378039.db2.gz	QSYWFJNBNXRWNO-OAHLLOKOSA-N	1	1	285.391	2.324	40	0		CEABMO
OCc1cc([C@@H]2CCC[N@H+](CCc3ccccc3)C2)[nH]n1	ZINC000072363743	176378041	/nfs/dbraw/zinc/37/80/41/176378041.db2.gz	QSYWFJNBNXRWNO-OAHLLOKOSA-N	1	1	285.391	2.324	40	0		CEABMO
OCc1cc([C@@H]2CCC[N@@H+](CCc3ccccc3)C2)[nH]n1	ZINC000072363743	176378042	/nfs/dbraw/zinc/37/80/42/176378042.db2.gz	QSYWFJNBNXRWNO-OAHLLOKOSA-N	1	1	285.391	2.324	40	0		CEABMO
C[N@H+]1CCC[C@@H](c2cncc(NCCc3ccccn3)n2)C1	ZINC000072365199	176380766	/nfs/dbraw/zinc/38/07/66/176380766.db2.gz	VVOBNUOHOYQLJD-CQSZACIVSA-N	1	1	297.406	2.335	40	0		CEABMO
CC(C)[N@H+]1CCC[C@](CCCc2ccccn2)(C(N)=O)C1	ZINC000072366371	176380854	/nfs/dbraw/zinc/38/08/54/176380854.db2.gz	LBLMAYGPOKJVQT-KRWDZBQOSA-N	1	1	289.423	2.380	40	0		CEABMO
Cn1ccnc1C[N@@H+]1CCC[C@@H](c2ccncc2)C1	ZINC000072368045	176382148	/nfs/dbraw/zinc/38/21/48/176382148.db2.gz	LTRGOZKDZHZMSA-CQSZACIVSA-N	1	1	256.353	2.195	40	0		CEABMO
Cn1ccnc1C[N@H+]1CCC[C@@H](c2ccncc2)C1	ZINC000072368045	176382149	/nfs/dbraw/zinc/38/21/49/176382149.db2.gz	LTRGOZKDZHZMSA-CQSZACIVSA-N	1	1	256.353	2.195	40	0		CEABMO
Cc1cc(C)nc(Nc2cncc([C@@H]3CCC[N@@H+]3C)n2)n1	ZINC000072376199	176385242	/nfs/dbraw/zinc/38/52/42/176385242.db2.gz	BVORFYARVWWPOR-ZDUSSCGKSA-N	1	1	284.367	2.394	40	0		CEABMO
Cn1cc(C[N@H+]2CCC[C@H](Cc3cccnc3)C2)cn1	ZINC000072385811	176390465	/nfs/dbraw/zinc/39/04/65/176390465.db2.gz	RHBGBSUMXXQDDZ-OAHLLOKOSA-N	1	1	270.380	2.270	40	0		CEABMO
Cc1nc(N)cc([C@H]2CC[N@@H+]2CCOc2ccccc2)n1	ZINC000072387606	176392471	/nfs/dbraw/zinc/39/24/71/176392471.db2.gz	HXTSQTOUUXSTOX-OAHLLOKOSA-N	1	1	284.363	2.193	40	0		CEABMO
Cc1nc(N)cc([C@H]2CC[N@H+]2CCOc2ccccc2)n1	ZINC000072387606	176392472	/nfs/dbraw/zinc/39/24/72/176392472.db2.gz	HXTSQTOUUXSTOX-OAHLLOKOSA-N	1	1	284.363	2.193	40	0		CEABMO
C[NH+]1CCN(c2c(N)cc(Cl)cc2Cl)CC1	ZINC000045885944	273899302	/nfs/dbraw/zinc/89/93/02/273899302.db2.gz	YHMFJGBKWNWTHE-UHFFFAOYSA-N	1	1	260.168	2.327	40	0		CEABMO
Cc1ccc(N2C(=O)[C@H]([NH3+])[C@H]2c2ccccc2)cc1	ZINC000015014824	274747131	/nfs/dbraw/zinc/74/71/31/274747131.db2.gz	OJTHEDVIZPWWAU-HUUCEWRRSA-N	1	1	252.317	2.410	40	0		CEABMO
CCN1CCC([N@@H+]2CCC[C@H]2c2ccnc(C)n2)CC1	ZINC000257204930	276358918	/nfs/dbraw/zinc/35/89/18/276358918.db2.gz	AWXRMTKEURLRIC-INIZCTEOSA-N	1	1	274.412	2.406	40	0		CEABMO
CCN1CCC([N@H+]2CCC[C@H]2c2ccnc(C)n2)CC1	ZINC000257204930	276358919	/nfs/dbraw/zinc/35/89/19/276358919.db2.gz	AWXRMTKEURLRIC-INIZCTEOSA-N	1	1	274.412	2.406	40	0		CEABMO
CCn1cc(C[N@H+]2CCC[C@@H](c3cc[nH]n3)C2)cn1	ZINC000121192002	365533497	/nfs/dbraw/zinc/53/34/97/365533497.db2.gz	PXDLOQHUFQZOAH-CYBMUJFWSA-N	1	1	259.357	2.006	40	0		CEABMO
OC[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C(F)(F)F	ZINC000095932014	185032742	/nfs/dbraw/zinc/03/27/42/185032742.db2.gz	JVJIYCXIYVNRHB-NWDGAFQWSA-N	1	1	259.271	2.289	40	0		CEABMO
C[N@H+]1CC[C@@H]2OCCC[C@]2(COc2ncccc2F)C1	ZINC000096040485	185069101	/nfs/dbraw/zinc/06/91/01/185069101.db2.gz	JDMVDVDTOQKFQM-DZGCQCFKSA-N	1	1	280.343	2.100	40	0		CEABMO
CC[C@@H]1[N@@H+](Cc2cccnc2)CCC[C@]12CCC(=O)N2	ZINC000096052398	185074121	/nfs/dbraw/zinc/07/41/21/185074121.db2.gz	KVGWFVNTZZQQSF-HOCLYGCPSA-N	1	1	273.380	2.105	40	0		CEABMO
COC[C@@H]1CCC[C@@]12C[N@H+](Cc1cccnc1)CCO2	ZINC000096051846	185074728	/nfs/dbraw/zinc/07/47/28/185074728.db2.gz	HMUUGDNCQAQMBV-JKSUJKDBSA-N	1	1	276.380	2.099	40	0		CEABMO
COC[C@@H]1CCC[C@@]12C[N@@H+](Cc1cccnc1)CCO2	ZINC000096051846	185074730	/nfs/dbraw/zinc/07/47/30/185074730.db2.gz	HMUUGDNCQAQMBV-JKSUJKDBSA-N	1	1	276.380	2.099	40	0		CEABMO
CCOC[C@@]12CCCO[C@@H]1CC[N@@H+](CC1CC1)C2	ZINC000096056855	185077757	/nfs/dbraw/zinc/07/77/57/185077757.db2.gz	VOVNQHXCLCNOQM-CABCVRRESA-N	1	1	253.386	2.304	40	0		CEABMO
Cc1ccc(C[N@H+]2CC[C@@H]3[C@H](C[NH+](C)C)OC[C@@H]3C2)s1	ZINC000096057582	185078191	/nfs/dbraw/zinc/07/81/91/185078191.db2.gz	OLPSVGWCRZSDNB-BPUTZDHNSA-N	1	1	294.464	2.455	40	0		CEABMO
CCN1C(=O)CC[C@@]12CCC[N@H+](Cc1nccs1)C2	ZINC000096071174	185087034	/nfs/dbraw/zinc/08/70/34/185087034.db2.gz	WMRWRGBFOPDSRM-CQSZACIVSA-N	1	1	279.409	2.120	40	0		CEABMO
CCN1C(=O)CC[C@@]12CCC[N@@H+](Cc1nccs1)C2	ZINC000096071174	185087035	/nfs/dbraw/zinc/08/70/35/185087035.db2.gz	WMRWRGBFOPDSRM-CQSZACIVSA-N	1	1	279.409	2.120	40	0		CEABMO
CC(C)[N@H+]1CCC[C@]2(CCN(Cc3ccncc3)C2=O)C1	ZINC000096074018	185088636	/nfs/dbraw/zinc/08/86/36/185088636.db2.gz	VHUSUEASKPTLBN-KRWDZBQOSA-N	1	1	287.407	2.305	40	0		CEABMO
C[N@H+]1CCOC[C@]2(CCCN(C(=O)CC3CCCC3)C2)C1	ZINC000096076209	185089478	/nfs/dbraw/zinc/08/94/78/185089478.db2.gz	DEZZJVDSTPJPQM-QGZVFWFLSA-N	1	1	294.439	2.138	40	0		CEABMO
CC[N@H+]1CCOC[C@@]2(CCCN(Cc3nccs3)C2)C1	ZINC000096076494	185090042	/nfs/dbraw/zinc/09/00/42/185090042.db2.gz	CGUCYLYYQCJWEC-HNNXBMFYSA-N	1	1	295.452	2.077	40	0		CEABMO
C[N@H+]1CCCC12CCN(Cc1nccs1)CC2	ZINC000096075199	185090206	/nfs/dbraw/zinc/09/02/06/185090206.db2.gz	SHKMMNNLNOTBEL-UHFFFAOYSA-N	1	1	251.399	2.203	40	0		CEABMO
CC[N@@H+](CCO)Cc1cccc(Br)c1	ZINC000042222171	362071308	/nfs/dbraw/zinc/07/13/08/362071308.db2.gz	DDXHBWFDWWZTHB-UHFFFAOYSA-N	1	1	258.159	2.263	40	0		CEABMO
O=C(C1CC1)N1C[C@@H]2CC[C@H](CC1=O)[N@H+]2Cc1ccccc1	ZINC000019371554	343374538	/nfs/dbraw/zinc/37/45/38/343374538.db2.gz	ROIRYEOBPOJFJK-CVEARBPZSA-N	1	1	298.386	2.189	40	0		CEABMO
Cc1cccc(OC[C@]2(O)CC[N@@H+](Cc3ccncc3)C2)c1	ZINC000585269204	345009424	/nfs/dbraw/zinc/00/94/24/345009424.db2.gz	LLIWZMNIMWNRSH-SFHVURJKSA-N	1	1	298.386	2.406	40	0		CEABMO
c1cn([C@H]2CO[C@]3(C2)CCC[N@H+](Cc2ccncc2)C3)cn1	ZINC000107731413	186189237	/nfs/dbraw/zinc/18/92/37/186189237.db2.gz	QDQCLGDBADXANC-SJORKVTESA-N	1	1	298.390	2.274	40	0		CEABMO
O=C1[C@@H]2C[N@@H+](Cc3cccnc3)C[C@@H]2CN1c1ccccc1	ZINC000107742917	186189282	/nfs/dbraw/zinc/18/92/82/186189282.db2.gz	OGHHDTIIPQZBSA-NVXWUHKLSA-N	1	1	293.370	2.176	40	0		CEABMO
CCN1CC[C@@]2(CCC[N@@H+](Cc3ccncc3)CC2)C1=O	ZINC000108528550	186221299	/nfs/dbraw/zinc/22/12/99/186221299.db2.gz	SDLPMSZZJVONON-KRWDZBQOSA-N	1	1	287.407	2.306	40	0		CEABMO
O=C([C@@H]1CCC[C@]12CC[N@@H+](CC1CC1)C2)N1CC(F)(F)C1	ZINC000108531105	186221806	/nfs/dbraw/zinc/22/18/06/186221806.db2.gz	HKEHDJZHPRFTIW-DZGCQCFKSA-N	1	1	298.377	2.366	40	0		CEABMO
CN(C)c1cc([C@@H]2CCCN(c3ncccn3)C2)cc[nH+]1	ZINC000072356635	363131442	/nfs/dbraw/zinc/13/14/42/363131442.db2.gz	WKYSEUOBBPKGTO-CQSZACIVSA-N	1	1	283.379	2.322	40	0		CEABMO
CN(C)c1cc([C@H]2CCCN(c3ncccn3)C2)cc[nH+]1	ZINC000072356636	363131871	/nfs/dbraw/zinc/13/18/71/363131871.db2.gz	WKYSEUOBBPKGTO-AWEZNQCLSA-N	1	1	283.379	2.322	40	0		CEABMO
C[N@@H+]1[C@@H]2CC[C@H]1CC(O)(c1ccc(Cl)cn1)C2	ZINC000002529347	361237685	/nfs/dbraw/zinc/23/76/85/361237685.db2.gz	FESHDPFQCTYRRL-QYJAPNMZSA-N	1	1	252.745	2.179	40	0		CEABMO
COc1ccc(C[N@H+]2CC[C@@H](c3nc(C)cc(=O)[nH]3)C2)cc1	ZINC000019118457	361519065	/nfs/dbraw/zinc/51/90/65/361519065.db2.gz	IRIPJNBZGPCWAX-CQSZACIVSA-N	1	1	299.374	2.076	40	0		CEABMO
COc1cccc(CN2C[C@H]3CCC[N@H+]3C[C@H]2C)c1	ZINC000019575146	361544218	/nfs/dbraw/zinc/54/42/18/361544218.db2.gz	YWXCEYSSIJOVDP-UKRRQHHQSA-N	1	1	260.381	2.364	40	0		CEABMO
O[C@]1(c2ccccc2)C[N@H+](Cc2ccccc2)CCO1	ZINC000031947457	361722724	/nfs/dbraw/zinc/72/27/24/361722724.db2.gz	IUEKXKKLULRIKE-QGZVFWFLSA-N	1	1	269.344	2.364	40	0		CEABMO
O[C@]1(c2ccccc2)C[N@@H+](Cc2ccccc2)CCO1	ZINC000031947457	361722730	/nfs/dbraw/zinc/72/27/30/361722730.db2.gz	IUEKXKKLULRIKE-QGZVFWFLSA-N	1	1	269.344	2.364	40	0		CEABMO
CCO[C@H]1CC[C@H]2[C@H]1OCC[N@@H+]2Cc1ccc(OC)cc1	ZINC000096041970	364397575	/nfs/dbraw/zinc/39/75/75/364397575.db2.gz	AKZIEAIERRRGCE-YESZJQIVSA-N	1	1	291.391	2.464	40	0		CEABMO
CCO[C@H]1CC[C@H]2[C@H]1OCC[N@H+]2Cc1ccc(OC)cc1	ZINC000096041970	364397581	/nfs/dbraw/zinc/39/75/81/364397581.db2.gz	AKZIEAIERRRGCE-YESZJQIVSA-N	1	1	291.391	2.464	40	0		CEABMO
COc1ccc(C[N@H+]2CC[C@@H](O)[C@@H]2Cc2cccnc2)cc1	ZINC000096200100	364409053	/nfs/dbraw/zinc/40/90/53/364409053.db2.gz	ZWQJRIHGQLHUGM-ZWKOTPCHSA-N	1	1	298.386	2.268	40	0		CEABMO
O=C1NCC[C@]12C[N@@H+](Cc1ccoc1)C[C@H]2c1ccccc1	ZINC000096201809	364410634	/nfs/dbraw/zinc/41/06/34/364410634.db2.gz	VZUURYZNGLAAOO-FUHWJXTLSA-N	1	1	296.370	2.385	40	0		CEABMO
Cc1ccc(N2CCC[C@@]3(CC[N@@H+](CC4CC4)C3)C2)nn1	ZINC000096217105	364413466	/nfs/dbraw/zinc/41/34/66/364413466.db2.gz	GKZDYSAZOBGJMR-KRWDZBQOSA-N	1	1	286.423	2.487	40	0		CEABMO
CC[N@H+]1CC[C@@]2(c3ccccc3)CCN(C(C)=O)C[C@H]12	ZINC000096251897	364415953	/nfs/dbraw/zinc/41/59/53/364415953.db2.gz	ADFKGDUQBPZDFV-IRXDYDNUSA-N	1	1	272.392	2.271	40	0		CEABMO
CCC(=O)N1CC[C@]2(c3ccccc3)CC[N@@H+](C)[C@@H]2C1	ZINC000096251817	364417164	/nfs/dbraw/zinc/41/71/64/364417164.db2.gz	BWMHZOIKSIBNDQ-WBVHZDCISA-N	1	1	272.392	2.271	40	0		CEABMO
CN(C)c1ncnc2c1CC[N@@H+](Cc1ccccc1)CC2	ZINC000096255386	364418331	/nfs/dbraw/zinc/41/83/31/364418331.db2.gz	BSDIRYLODDUMNC-UHFFFAOYSA-N	1	1	282.391	2.143	40	0		CEABMO
CC(C)C[N@H+]1CCC[C@@]2(CN(Cc3cncs3)C2=O)C1	ZINC000585099631	367177618	/nfs/dbraw/zinc/17/76/18/367177618.db2.gz	TXXHTLMLUZJPQC-HNNXBMFYSA-N	1	1	293.436	2.224	40	0		CEABMO
COC(=O)[C@H]([NH3+])[C@H](C)Sc1ccc(Cl)cc1	ZINC000169726754	367370998	/nfs/dbraw/zinc/37/09/98/367370998.db2.gz	VLQBMHHVFGIEPR-OIBJUYFYSA-N	1	1	259.758	2.321	40	0		CEABMO
CCC[N@H+](Cc1ccc(C)cc1)[C@H]1CCS(=O)(=O)C1	ZINC000350055908	369492278	/nfs/dbraw/zinc/49/22/78/369492278.db2.gz	WNBFAKKTMNOIKY-HNNXBMFYSA-N	1	1	281.421	2.394	40	0		CEABMO
CCC[N@@H+](Cc1ccc(C)cc1)[C@H]1CCS(=O)(=O)C1	ZINC000350055908	369492283	/nfs/dbraw/zinc/49/22/83/369492283.db2.gz	WNBFAKKTMNOIKY-HNNXBMFYSA-N	1	1	281.421	2.394	40	0		CEABMO
Cc1ccc2c(n1)N(C)[C@H](CO)CC[N@@H+](CC(C)(C)C)C2	ZINC000225428456	370293893	/nfs/dbraw/zinc/29/38/93/370293893.db2.gz	CDBYBHABQUOBKE-HNNXBMFYSA-N	1	1	291.439	2.439	40	0	biogenic,in-vitro	CEABMO
O[C@H](COc1ccccc1)C[N@H+]1CC[C@@H]2C=CC=C[C@H]2C1	ZINC000252444350	371438111	/nfs/dbraw/zinc/43/81/11/371438111.db2.gz	HSIIBDBKJDPQQR-ULQDDVLXSA-N	1	1	285.387	2.490	40	0		CEABMO
Cc1cccc(N2CCC[C@H]([N@@H+](C)Cc3cnc[nH]3)C2)n1	ZINC000257328540	371613333	/nfs/dbraw/zinc/61/33/33/371613333.db2.gz	XGCSEJOMVWWDTF-HNNXBMFYSA-N	1	1	285.395	2.214	40	0		CEABMO
Cc1cccc(N2CCC[C@H]([N@H+](C)Cc3c[nH]cn3)C2)n1	ZINC000257328540	371613340	/nfs/dbraw/zinc/61/33/40/371613340.db2.gz	XGCSEJOMVWWDTF-HNNXBMFYSA-N	1	1	285.395	2.214	40	0		CEABMO
CCN(CC)CC[NH2+]Cc1cnn(C2CCCC2)c1	ZINC000256053613	190004769	/nfs/dbraw/zinc/00/47/69/190004769.db2.gz	SCIIJOHFPVTPMI-UHFFFAOYSA-N	1	1	264.417	2.430	40	0		CEABMO
CC[C@@H](C)n1nccc1C[NH2+]Cc1cnn(CC)c1	ZINC000256050986	190003833	/nfs/dbraw/zinc/00/38/33/190003833.db2.gz	HHFVCAUHHZKFMS-GFCCVEGCSA-N	1	1	261.373	2.360	40	0		CEABMO
FCCn1cc(C[NH2+]Cc2cccc(F)c2F)cn1	ZINC000256055145	190005600	/nfs/dbraw/zinc/00/56/00/190005600.db2.gz	ZJHCSPBDCVWRGK-UHFFFAOYSA-N	1	1	269.270	2.421	40	0		CEABMO
CC(C)[N@H+]1CC[C@H](Cc2cnc(-c3ncco3)cn2)C1	ZINC000257200995	190011038	/nfs/dbraw/zinc/01/10/38/190011038.db2.gz	AFRXXXOHPMGSTK-GFCCVEGCSA-N	1	1	272.352	2.404	40	0		CEABMO
CNc1cc([C@@H]2CCC[N@@H+]2Cc2cncn2C)ccn1	ZINC000257200219	190011122	/nfs/dbraw/zinc/01/11/22/190011122.db2.gz	ACMFNHVFUPHFMA-AWEZNQCLSA-N	1	1	271.368	2.194	40	0		CEABMO
CNc1cc([C@@H]2CCC[N@H+]2Cc2cncn2C)ccn1	ZINC000257200219	190011123	/nfs/dbraw/zinc/01/11/23/190011123.db2.gz	ACMFNHVFUPHFMA-AWEZNQCLSA-N	1	1	271.368	2.194	40	0		CEABMO
CO[C@@H]1CCCOC12CC[NH+](Cc1ncccc1F)CC2	ZINC000257208700	190012131	/nfs/dbraw/zinc/01/21/31/190012131.db2.gz	BNHCSHCXJABMBR-OAHLLOKOSA-N	1	1	294.370	2.381	40	0		CEABMO
Cc1c[nH]nc1[C@H]1CC[N@H+](Cc2ccnn2C(C)C)C1	ZINC000257210310	190012544	/nfs/dbraw/zinc/01/25/44/190012544.db2.gz	BUBHZMNNGCLVKF-ZDUSSCGKSA-N	1	1	273.384	2.485	40	0		CEABMO
Cc1cc(C)n2ncc(C[N@H+]3CC[C@@H](c4cc[nH]n4)C3)c2n1	ZINC000257251849	190019786	/nfs/dbraw/zinc/01/97/86/190019786.db2.gz	JSNBNUQNOBRHKI-CYBMUJFWSA-N	1	1	296.378	2.059	40	0		CEABMO
CCc1nc(C)c(C[N@H+]2CCC[C@H](c3cc[nH]n3)C2)[nH]1	ZINC000257255009	190021001	/nfs/dbraw/zinc/02/10/01/190021001.db2.gz	KFSNPQLOQKEEJX-LBPRGKRZSA-N	1	1	273.384	2.383	40	0		CEABMO
CNc1ncccc1C[N@H+]1CCC[C@H](c2ccncn2)C1	ZINC000257281403	190026576	/nfs/dbraw/zinc/02/65/76/190026576.db2.gz	OOZUPSRKNYMKON-ZDUSSCGKSA-N	1	1	283.379	2.293	40	0		CEABMO
Cn1cc(C[N@@H+]2CCCC[C@H]2c2ccn3nccc3n2)cn1	ZINC000257333432	190035368	/nfs/dbraw/zinc/03/53/68/190035368.db2.gz	YBNDCKZMMRMVIU-HNNXBMFYSA-N	1	1	296.378	2.190	40	0		CEABMO
Cn1cc(C[N@H+]2CCCC[C@H]2c2ccn3nccc3n2)cn1	ZINC000257333432	190035369	/nfs/dbraw/zinc/03/53/69/190035369.db2.gz	YBNDCKZMMRMVIU-HNNXBMFYSA-N	1	1	296.378	2.190	40	0		CEABMO
CC(=O)N1CC[N@@H+](CC2CC2)[C@H](c2ccccc2)C1	ZINC000257338387	190036121	/nfs/dbraw/zinc/03/61/21/190036121.db2.gz	YXDJWAGKOUHAJQ-INIZCTEOSA-N	1	1	258.365	2.302	40	0		CEABMO
Cn1ccc(C[NH+]2CCC(Cc3ccncc3)CC2)n1	ZINC000257344848	190037517	/nfs/dbraw/zinc/03/75/17/190037517.db2.gz	ZYWQRBSRCSGSCM-UHFFFAOYSA-N	1	1	270.380	2.270	40	0		CEABMO
c1ccc(N2CC[C@@H]3[C@H]2CC[N@@H+]3CC2CCOCC2)nc1	ZINC000306143940	376542477	/nfs/dbraw/zinc/54/24/77/376542477.db2.gz	YRHITWJVNXSXKP-HZPDHXFCSA-N	1	1	287.407	2.161	40	0		CEABMO
CCc1ccc(OC[C@@H](O)C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1	ZINC000035031448	394493098	/nfs/dbraw/zinc/49/30/98/394493098.db2.gz	IUQTWVYKRPQSDB-FMKPAKJESA-N	1	1	293.407	2.098	40	0		CEABMO
COc1ccc([C@H]2[C@H]([NH3+])C(=O)N2c2ccc(C)cc2)cc1	ZINC000039189385	394499232	/nfs/dbraw/zinc/49/92/32/394499232.db2.gz	HKRXNPCMTVJDJM-HOTGVXAUSA-N	1	1	282.343	2.419	40	0		CEABMO
CC[N@H+]1CCCC[C@H]1c1ccc(N2CCOCC2)nc1	ZINC000072216179	394593139	/nfs/dbraw/zinc/59/31/39/394593139.db2.gz	QHNAMJQGCIHUHM-HNNXBMFYSA-N	1	1	275.396	2.465	40	0		CEABMO
CC[N@H+]1CCCC[C@H]1c1cccnc1N1CCOCC1	ZINC000072216239	394593258	/nfs/dbraw/zinc/59/32/58/394593258.db2.gz	IWONFYSGKVFFII-HNNXBMFYSA-N	1	1	275.396	2.465	40	0		CEABMO
CC(C)[N@H+]1CCC[C@H]1c1ccc(N2CCOCC2)nc1	ZINC000072216162	394593500	/nfs/dbraw/zinc/59/35/00/394593500.db2.gz	QOLXMYIPOPDACE-HNNXBMFYSA-N	1	1	275.396	2.464	40	0		CEABMO
CCN1CCN(c2ccc([C@@H]([NH3+])c3ccccc3)cn2)CC1	ZINC000072225556	394595549	/nfs/dbraw/zinc/59/55/49/394595549.db2.gz	VZCUPVFRCXWNGG-SFHVURJKSA-N	1	1	296.418	2.272	40	0		CEABMO
[NH3+][C@H]1C(=O)N(Cc2ccc(F)cc2)[C@H]1c1ccccc1F	ZINC000072228237	394596318	/nfs/dbraw/zinc/59/63/18/394596318.db2.gz	LCRLBTDJPNMCGY-CABCVRRESA-N	1	1	288.297	2.376	40	0		CEABMO
[NH3+][C@H]1C(=O)N(Cc2ccccc2)[C@H]1c1ccccc1F	ZINC000072228165	394596583	/nfs/dbraw/zinc/59/65/83/394596583.db2.gz	PTSQGZAVHPDLIL-CABCVRRESA-N	1	1	270.307	2.237	40	0		CEABMO
CCOC[C@@]12CCCO[C@H]1CC[N@@H+](CC1CC1)C2	ZINC000096056857	394675994	/nfs/dbraw/zinc/67/59/94/394675994.db2.gz	VOVNQHXCLCNOQM-GJZGRUSLSA-N	1	1	253.386	2.304	40	0		CEABMO
CC(C)C[N@H+]1CC[C@@H]2[C@@H]1CCN2C(=O)c1ccco1	ZINC000096083006	394676921	/nfs/dbraw/zinc/67/69/21/394676921.db2.gz	XUEKWUWOAXYEOU-QWHCGFSZSA-N	1	1	262.353	2.224	40	0		CEABMO
COC(=O)[C@H]1C[N@@H+](C)C[C@@H]1c1ccccc1Cl	ZINC000217669268	400307726	/nfs/dbraw/zinc/30/77/26/400307726.db2.gz	YVCKOEIZBOKVIO-MNOVXSKESA-N	1	1	253.729	2.158	40	0		CEABMO
C[C@H]1OC(=O)[C@H]2CC[C@H]3c4ccccc4CC[N@H+]3[C@H]12	ZINC000005530719	170109352	/nfs/dbraw/zinc/10/93/52/170109352.db2.gz	RFAUXYMFAVVSFU-SDJAHQOYSA-N	1	1	257.333	2.310	40	0		CEABMO
COc1ccccc1NC(=S)NC[C@H]1CCC[N@@H+](C)C1	ZINC000009876349	170388500	/nfs/dbraw/zinc/38/85/00/170388500.db2.gz	SKZOXFPKXWNCEV-GFCCVEGCSA-N	1	1	293.436	2.323	40	0		CEABMO
C[C@H]1CN(Cc2nc3ccc(Cl)cc3[nH]2)CC[NH2+]1	ZINC000022122124	171354017	/nfs/dbraw/zinc/35/40/17/171354017.db2.gz	VVXHUGNLADTCAF-VIFPVBQESA-N	1	1	264.760	2.010	40	0		CEABMO
C[N@@H+]1[C@@H]2CC[C@H]1CC(OC(=O)CNCc1cccs1)C2	ZINC000035311378	172122272	/nfs/dbraw/zinc/12/22/72/172122272.db2.gz	VHXRYLXKGSAVQA-FUNVUKJBSA-N	1	1	294.420	2.006	40	0		CEABMO
Cc1[nH+]ccn1Cc1ccc(C(=O)N2CCCC2)cc1	ZINC000038832684	174157307	/nfs/dbraw/zinc/15/73/07/174157307.db2.gz	RDIMFBFBCMRFBT-UHFFFAOYSA-N	1	1	269.348	2.476	40	0		CEABMO
CC(=O)N1CCC[C@H](c2cccc(-n3cc[nH+]c3C)n2)C1	ZINC000072355661	176374631	/nfs/dbraw/zinc/37/46/31/176374631.db2.gz	RVVVFIRVJGJXFS-AWEZNQCLSA-N	1	1	284.363	2.302	40	0		CEABMO
CCOC[C@]12CCCO[C@H]1CC[N@@H+](CC1CCOCC1)C2	ZINC000096056862	276334490	/nfs/dbraw/zinc/33/44/90/276334490.db2.gz	FXKMOSYEZHUKCQ-DLBZAZTESA-N	1	1	297.439	2.321	40	0		CEABMO
CCO[C@H]1C[N@@H+](Cc2ccc(C)o2)[C@@H]2CCCO[C@@H]21	ZINC000096057433	276359934	/nfs/dbraw/zinc/35/99/34/276359934.db2.gz	LNYYZJFSAOSWHY-ILXRZTDVSA-N	1	1	265.353	2.356	40	0		CEABMO
CO[C@H]1CC[C@H]2[C@H]1OCC[N@@H+]2Cc1ccsc1	ZINC000097953718	277343545	/nfs/dbraw/zinc/34/35/45/277343545.db2.gz	NCKFUSYYPXUNBN-RWMBFGLXSA-N	1	1	253.367	2.126	40	0		CEABMO
CO[C@H]1CC[C@H]2[C@H]1OCC[N@H+]2Cc1ccsc1	ZINC000097953718	277343546	/nfs/dbraw/zinc/34/35/46/277343546.db2.gz	NCKFUSYYPXUNBN-RWMBFGLXSA-N	1	1	253.367	2.126	40	0		CEABMO
C=Cn1ncc(C[N@H+]2CC[C@@]3(O)CCCC[C@H]3C2)c1C	ZINC000257329533	327136610	/nfs/dbraw/zinc/13/66/10/327136610.db2.gz	XKJBIGFPYFIZLS-HOTGVXAUSA-N	1	1	275.396	2.419	40	0		CEABMO
COC(=O)C1CC[NH+](Cc2cc(F)cc(F)c2)CC1	ZINC000095738942	185024123	/nfs/dbraw/zinc/02/41/23/185024123.db2.gz	YFSKQYAGMAJJAJ-UHFFFAOYSA-N	1	1	269.291	2.350	40	0		CEABMO
CO[C@@H]1CC[C@H]2[C@H]1OCC[N@@H+]2Cc1cccs1	ZINC000096041390	185069305	/nfs/dbraw/zinc/06/93/05/185069305.db2.gz	JUUIHGWUWWFIBK-YNEHKIRRSA-N	1	1	253.367	2.126	40	0		CEABMO
CO[C@@H]1CC[C@H]2[C@H]1OCC[N@H+]2Cc1cccs1	ZINC000096041390	185069306	/nfs/dbraw/zinc/06/93/06/185069306.db2.gz	JUUIHGWUWWFIBK-YNEHKIRRSA-N	1	1	253.367	2.126	40	0		CEABMO
Cc1nnc([C@H]2C[C@@H]3CC[N@@H+](Cc4ccoc4)C[C@H]3O2)[nH]1	ZINC000096046197	185071507	/nfs/dbraw/zinc/07/15/07/185071507.db2.gz	OZQVXAPNDIICPT-BFHYXJOUSA-N	1	1	288.351	2.058	40	0		CEABMO
Cc1noc([C@@H]2C[C@H]3C[N@@H+](Cc4ccsc4)C[C@H]3O2)n1	ZINC000096045789	185071860	/nfs/dbraw/zinc/07/18/60/185071860.db2.gz	KQSVEJKDDNQWGT-RWMBFGLXSA-N	1	1	291.376	2.402	40	0		CEABMO
C[C@H]1C[NH+](C[C@H](O)COc2ccc(Cl)cc2)C[C@H](C)O1	ZINC000033296230	361776410	/nfs/dbraw/zinc/77/64/10/361776410.db2.gz	UAKNBHWNSUIDPO-OBJOEFQTSA-N	1	1	299.798	2.189	40	0		CEABMO
CC(C)N1CCO[C@H]2C[N@@H+](Cc3ccc(F)cc3)C[C@H]21	ZINC000096054279	185075459	/nfs/dbraw/zinc/07/54/59/185075459.db2.gz	DFZPTOKEBFKAAL-CVEARBPZSA-N	1	1	278.371	2.119	40	0		CEABMO
CC(C)[N@@H+]1CCO[C@H]2CN(Cc3ccc(F)cc3)C[C@H]21	ZINC000096054279	185075461	/nfs/dbraw/zinc/07/54/61/185075461.db2.gz	DFZPTOKEBFKAAL-CVEARBPZSA-N	1	1	278.371	2.119	40	0		CEABMO
CC(C)[N@H+]1CCO[C@H]2CN(Cc3ccc(F)cc3)C[C@H]21	ZINC000096054279	185075462	/nfs/dbraw/zinc/07/54/62/185075462.db2.gz	DFZPTOKEBFKAAL-CVEARBPZSA-N	1	1	278.371	2.119	40	0		CEABMO
COC[C@]12CCCO[C@H]1CC[N@@H+](Cc1scnc1C)C2	ZINC000096065001	185084335	/nfs/dbraw/zinc/08/43/35/185084335.db2.gz	MPWGFTVATGFOKA-LSDHHAIUSA-N	1	1	296.436	2.469	40	0		CEABMO
COc1ncccc1C[N@H+]1CCC[C@@]2(C[C@@H](C)CO2)C1	ZINC000096073318	185087582	/nfs/dbraw/zinc/08/75/82/185087582.db2.gz	PZNARHRGJCPOAI-CZUORRHYSA-N	1	1	276.380	2.481	40	0		CEABMO
COc1ccc(C[N@@H+]2CCC[C@]3(C[C@H](OC)CO3)C2)cc1	ZINC000096107417	185099674	/nfs/dbraw/zinc/09/96/74/185099674.db2.gz	RQXYGPPQFBFRSS-IRXDYDNUSA-N	1	1	291.391	2.465	40	0		CEABMO
CCCC[N@H+](Cc1ccccc1)[C@@H]1CCS(=O)(=O)C1	ZINC000078681288	343961482	/nfs/dbraw/zinc/96/14/82/343961482.db2.gz	ZUEWJCBMLOCBFZ-OAHLLOKOSA-N	1	1	281.421	2.476	40	0		CEABMO
CCCC[N@@H+](Cc1ccccc1)[C@@H]1CCS(=O)(=O)C1	ZINC000078681288	343961484	/nfs/dbraw/zinc/96/14/84/343961484.db2.gz	ZUEWJCBMLOCBFZ-OAHLLOKOSA-N	1	1	281.421	2.476	40	0		CEABMO
COc1ccc(Nc2cc(N)[nH+]c(C)n2)c(OC)c1	ZINC000049467343	362364703	/nfs/dbraw/zinc/36/47/03/362364703.db2.gz	QEGXKWHVPJUYSI-UHFFFAOYSA-N	1	1	260.297	2.128	40	0		CEABMO
O[C@H]1CCC[N@H+](Cc2cc[nH]n2)[C@H]1Cc1ccccc1F	ZINC000585275077	345010044	/nfs/dbraw/zinc/01/00/44/345010044.db2.gz	VWNDAZSGDBEBHW-HOTGVXAUSA-N	1	1	289.354	2.117	40	0		CEABMO
O[C@H]1CCC[N@@H+](Cc2cc[nH]n2)[C@H]1Cc1ccccc1F	ZINC000585275077	345010047	/nfs/dbraw/zinc/01/00/47/345010047.db2.gz	VWNDAZSGDBEBHW-HOTGVXAUSA-N	1	1	289.354	2.117	40	0		CEABMO
CC(C)(C)OC(=O)N1CC[C@@H](Nc2[nH+]cccc2N)C1	ZINC000091364387	180142342	/nfs/dbraw/zinc/14/23/42/180142342.db2.gz	NEUIHEJKMNHETP-SNVBAGLBSA-N	1	1	278.356	2.085	40	0		CEABMO
O=C(C[C@H]1[C@H]2C[N@H+](Cc3ccco3)C[C@@H]12)Nc1cccnc1	ZINC000107745985	186189191	/nfs/dbraw/zinc/18/91/91/186189191.db2.gz	DTSITRYRBUPYIU-MUJYYYPQSA-N	1	1	297.358	2.381	40	0		CEABMO
CNc1cc([C@H]2CN(c3[nH+]cccc3C)CCO2)nc(C)n1	ZINC000072387752	363133137	/nfs/dbraw/zinc/13/31/37/363133137.db2.gz	LDGZDLWMTYRZEA-CQSZACIVSA-N	1	1	299.378	2.108	40	0		CEABMO
CC(C)[N@@H+](Cc1ccccc1)[C@H]1CCCN(CCO)C1	ZINC000079414286	363597635	/nfs/dbraw/zinc/59/76/35/363597635.db2.gz	WCGALKBOUZMJNF-KRWDZBQOSA-N	1	1	276.424	2.354	40	0		CEABMO
C[N@H+]1CCC[C@H](NC(=O)c2cc(-c3cccs3)no2)C1	ZINC000012183384	361376233	/nfs/dbraw/zinc/37/62/33/361376233.db2.gz	WXDRKDWXONLYAI-JTQLQIEISA-N	1	1	291.376	2.227	40	0		CEABMO
COc1cccc(C[N@H+]2CC[C@@H](c3nc(C)cc(=O)[nH]3)C2)c1	ZINC000019118472	361520153	/nfs/dbraw/zinc/52/01/53/361520153.db2.gz	DJSJTSHPPORLPG-CQSZACIVSA-N	1	1	299.374	2.076	40	0		CEABMO
CCn1cc(C[N@H+]2CC[C@H](CO)C2)c2cc(OC)ccc21	ZINC000019524746	361541637	/nfs/dbraw/zinc/54/16/37/361541637.db2.gz	NFPSIHVMCBYDBF-ZDUSSCGKSA-N	1	1	288.391	2.484	40	0		CEABMO
COc1ccccc1CN1C[C@@H]2CCC[N@H+]2C[C@@H]1C	ZINC000019575790	361542886	/nfs/dbraw/zinc/54/28/86/361542886.db2.gz	KCENCVINDMTRRT-ZFWWWQNUSA-N	1	1	260.381	2.364	40	0		CEABMO
COc1ccc(OC)c(CN2C[C@H]3CCC[N@H+]3C[C@H]2C)c1	ZINC000019575082	361543170	/nfs/dbraw/zinc/54/31/70/361543170.db2.gz	VSJROCKNJFVGFJ-UKRRQHHQSA-N	1	1	290.407	2.372	40	0		CEABMO
C[C@@H]1C[N@H+]2CCC[C@@H]2CN1Cc1[nH]nnc1-c1ccccc1	ZINC000019575056	361543183	/nfs/dbraw/zinc/54/31/83/361543183.db2.gz	WUUMZCWPQSDLDY-UKRRQHHQSA-N	1	1	297.406	2.140	40	0		CEABMO
C[C@@H]1C[N@@H+]2CCC[C@@H]2CN1Cc1n[nH]nc1-c1ccccc1	ZINC000019575056	361543188	/nfs/dbraw/zinc/54/31/88/361543188.db2.gz	WUUMZCWPQSDLDY-UKRRQHHQSA-N	1	1	297.406	2.140	40	0		CEABMO
C[C@@H]1C[N@H+]2CCC[C@@H]2CN1Cc1n[nH]nc1-c1ccccc1	ZINC000019575056	361543191	/nfs/dbraw/zinc/54/31/91/361543191.db2.gz	WUUMZCWPQSDLDY-UKRRQHHQSA-N	1	1	297.406	2.140	40	0		CEABMO
CCO[C@@H]1COC2(C1)CC[NH+](Cc1nccs1)CC2	ZINC000096158718	364403539	/nfs/dbraw/zinc/40/35/39/364403539.db2.gz	CJKPACADZIPACQ-LBPRGKRZSA-N	1	1	282.409	2.303	40	0		CEABMO
c1coc(CN2CC[C@]3(C2)C[C@@H]([NH+]2CCCC2)CCO3)c1	ZINC000096206799	364410202	/nfs/dbraw/zinc/41/02/02/364410202.db2.gz	GMGLZJRYAMFBOY-DOTOQJQBSA-N	1	1	290.407	2.499	40	0		CEABMO
CC(=O)N1CC[C@]2(C1)CCC[N@@H+](Cc1ccc(C)o1)C2	ZINC000096215944	364412645	/nfs/dbraw/zinc/41/26/45/364412645.db2.gz	SBPFMWIHTIFWCI-MRXNPFEDSA-N	1	1	276.380	2.422	40	0		CEABMO
COC[C@H]1C[N@@H+](C)C[C@@]12CCN(Cc1ccc(F)cc1)C2	ZINC000096218891	364413391	/nfs/dbraw/zinc/41/33/91/364413391.db2.gz	YKSHZSBFCPEVME-NVXWUHKLSA-N	1	1	292.398	2.226	40	0		CEABMO
O=C1CCC[C@@]2(CCC[N@@H+](Cc3ccsc3)C2)N1	ZINC000096229651	364414989	/nfs/dbraw/zinc/41/49/89/364414989.db2.gz	BGKOFRSCEKCTAY-AWEZNQCLSA-N	1	1	264.394	2.383	40	0		CEABMO
O=C1[C@H]2C[N@@H+](Cc3ccncc3)C[C@H]2CN1c1ccccc1	ZINC000096245158	364416639	/nfs/dbraw/zinc/41/66/39/364416639.db2.gz	WUDNXVQDKGVUHG-RDJZCZTQSA-N	1	1	293.370	2.176	40	0		CEABMO
C[N@H+]1CCC[C@]2(CCN(C(=O)c3ccccc3)C2)C1	ZINC000096268562	364420919	/nfs/dbraw/zinc/42/09/19/364420919.db2.gz	BCNOKJURHQLPAE-INIZCTEOSA-N	1	1	258.365	2.245	40	0		CEABMO
CCC[N@H+](Cc1ccc(C)cc1)[C@@H]1CCS(=O)(=O)C1	ZINC000350055909	369491982	/nfs/dbraw/zinc/49/19/82/369491982.db2.gz	WNBFAKKTMNOIKY-OAHLLOKOSA-N	1	1	281.421	2.394	40	0		CEABMO
CCC[N@@H+](Cc1ccc(C)cc1)[C@@H]1CCS(=O)(=O)C1	ZINC000350055909	369491987	/nfs/dbraw/zinc/49/19/87/369491987.db2.gz	WNBFAKKTMNOIKY-OAHLLOKOSA-N	1	1	281.421	2.394	40	0		CEABMO
[NH3+]CCSc1nc(-c2ccc(Br)cc2)n[nH]1	ZINC000224978610	370284073	/nfs/dbraw/zinc/28/40/73/370284073.db2.gz	BTYCDNIGCGUXOO-UHFFFAOYSA-N	1	1	299.197	2.285	40	0		CEABMO
C[N@@H+](CC1(O)CCCCCC1)[C@H]1CCCC[C@H]1O	ZINC000249593976	371344005	/nfs/dbraw/zinc/34/40/05/371344005.db2.gz	WGPJETARVFOASI-UONOGXRCSA-N	1	1	255.402	2.307	40	0		CEABMO
c1cc(CN2CC[N@H+]3C[C@@H](OCC4CC4)C[C@H]3C2)cs1	ZINC000253588906	371529809	/nfs/dbraw/zinc/52/98/09/371529809.db2.gz	YPRUUDNUVOBELJ-HOTGVXAUSA-N	1	1	292.448	2.433	40	0		CEABMO
CNc1cc(C)nc([C@@]2(C)CCC[N@H+]2C2CCOCC2)n1	ZINC000257306329	371612787	/nfs/dbraw/zinc/61/27/87/371612787.db2.gz	STVOUURMJSFTTJ-MRXNPFEDSA-N	1	1	290.411	2.317	40	0		CEABMO
COc1ccc2[nH]c(C[N@H+]3C[C@@H]4C[C@@H](O)C[C@@H]4C3)cc2c1	ZINC000257202777	190010974	/nfs/dbraw/zinc/01/09/74/190010974.db2.gz	ANKHLSKJRJCLEW-NHAGDIPZSA-N	1	1	286.375	2.379	40	0		CEABMO
C[N@H+]1CCC[C@@H](c2cncc(N3C(=O)OCC3(C)C)n2)C1	ZINC000257212078	190013134	/nfs/dbraw/zinc/01/31/34/190013134.db2.gz	CBVIEAUMDWLTSW-LLVKDONJSA-N	1	1	290.367	2.021	40	0		CEABMO
Cc1cc(C)nc([C@H]2CC[N@@H+](CC3CCOCC3)C2)n1	ZINC000257225715	190015311	/nfs/dbraw/zinc/01/53/11/190015311.db2.gz	FHLCSSAPNALSLB-HNNXBMFYSA-N	1	1	275.396	2.309	40	0		CEABMO
c1cn2c(n1)nccc2[C@H]1CCC[N@@H+]1Cc1ccncc1	ZINC000257228025	190016332	/nfs/dbraw/zinc/01/63/32/190016332.db2.gz	FRZZEROJNCWHLI-CQSZACIVSA-N	1	1	279.347	2.461	40	0		CEABMO
Cc1cccc(C[N@H+]2CCCC[C@]3(C)NC(=O)CC[C@H]23)n1	ZINC000257223517	190014451	/nfs/dbraw/zinc/01/44/51/190014451.db2.gz	DXSFHTMQTFJUEG-RDJZCZTQSA-N	1	1	287.407	2.413	40	0		CEABMO
CN(C(=O)c1c[nH]nc1[C@@H]1CCC[NH2+]1)c1ccccc1	ZINC000257244198	190019623	/nfs/dbraw/zinc/01/96/23/190019623.db2.gz	IKISEWKRMXFEPC-ZDUSSCGKSA-N	1	1	270.336	2.111	40	0		CEABMO
Cc1nc[nH]c1C[N@@H+]1CCCC[C@@H]1c1ccn2nccc2n1	ZINC000257253283	190021064	/nfs/dbraw/zinc/02/10/64/190021064.db2.gz	JYGOQXDQLBIXKW-OAHLLOKOSA-N	1	1	296.378	2.488	40	0		CEABMO
Cc1nc[nH]c1C[N@H+]1CCCC[C@@H]1c1ccn2nccc2n1	ZINC000257253283	190021065	/nfs/dbraw/zinc/02/10/65/190021065.db2.gz	JYGOQXDQLBIXKW-OAHLLOKOSA-N	1	1	296.378	2.488	40	0		CEABMO
CNC(=O)[C@@]1(C)C[N@@H+](Cc2ccc3ccccc3c2)CCO1	ZINC000257301883	190030218	/nfs/dbraw/zinc/03/02/18/190030218.db2.gz	SAJQHKPIUJAOEB-GOSISDBHSA-N	1	1	298.386	2.177	40	0		CEABMO
Cc1c(C[N@H+]2CC[C@H](Cc3nccs3)C2)cnn1C	ZINC000257301143	190030665	/nfs/dbraw/zinc/03/06/65/190030665.db2.gz	RXDOWZIUABEXGQ-GFCCVEGCSA-N	1	1	276.409	2.250	40	0		CEABMO
Cc1cccnc1C(=O)N1CCC[C@@]2(C)[C@@H]1CCC[N@@H+]2C	ZINC000257317110	190032977	/nfs/dbraw/zinc/03/29/77/190032977.db2.gz	VILOLMSCECBULV-YOEHRIQHSA-N	1	1	287.407	2.479	40	0		CEABMO
CN(C)c1cc([C@@H]2CCC[N@@H+](Cc3ccn(C)n3)C2)ccn1	ZINC000257340588	190036819	/nfs/dbraw/zinc/03/68/19/190036819.db2.gz	ZGUTVNQPEOVQEB-OAHLLOKOSA-N	1	1	299.422	2.261	40	0		CEABMO
CC(C)C[N@H+]1CC[C@@H]2[C@@H]1CCN2C(=O)c1ccncc1	ZINC000096184277	256815312	/nfs/dbraw/zinc/81/53/12/256815312.db2.gz	ADHOWNKMEARKCE-LSDHHAIUSA-N	1	1	273.380	2.026	40	0		CEABMO
COC(=O)[C@@H]1C[C@H]2c3[nH]c4ccccc4c3CC[N@@H+]2C1	ZINC000031719759	394487006	/nfs/dbraw/zinc/48/70/06/394487006.db2.gz	XKJYWJCEEMLZSB-YGRLFVJLSA-N	1	1	270.332	2.260	40	0		CEABMO
CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC[C@H](O)C[NH+]1CCOCC1	ZINC000034792196	394493209	/nfs/dbraw/zinc/49/32/09/394493209.db2.gz	VWOCGUKYAHXHNT-WCXIOVBPSA-N	1	1	299.455	2.157	40	0		CEABMO
CCOC(=O)[C@@H]([NH3+])[C@H](Nc1ccccc1)C(C)C	ZINC000072210540	394592276	/nfs/dbraw/zinc/59/22/76/394592276.db2.gz	SNMKQNUYWSGTCT-QWHCGFSZSA-N	1	1	250.342	2.014	40	0		CEABMO
Cc1cccc(N2C(=O)[C@@H]([NH3+])[C@@H]2c2ccccc2)c1	ZINC000072227395	394595394	/nfs/dbraw/zinc/59/53/94/394595394.db2.gz	SXKSANYKZLGAMA-GJZGRUSLSA-N	1	1	252.317	2.410	40	0		CEABMO
[NH3+][C@H]1C(=O)N(c2ccc(F)cc2)[C@@H]1c1ccccc1	ZINC000072227192	394595446	/nfs/dbraw/zinc/59/54/46/394595446.db2.gz	WYYXBPDQRSEFSN-ZIAGYGMSSA-N	1	1	256.280	2.241	40	0		CEABMO
COc1cccc([C@H]2[C@H]([NH3+])C(=O)N2c2ccc(F)cc2)c1	ZINC000072227223	394595490	/nfs/dbraw/zinc/59/54/90/394595490.db2.gz	QLMHZURZFQDQGH-GJZGRUSLSA-N	1	1	286.306	2.250	40	0		CEABMO
COc1ccc([C@H]2[C@@H]([NH3+])C(=O)N2c2cccc(OC)c2)cc1	ZINC000072227725	394596051	/nfs/dbraw/zinc/59/60/51/394596051.db2.gz	VTYUFUMOUPBLBY-CVEARBPZSA-N	1	1	298.342	2.119	40	0		CEABMO
COc1ccc([C@H]2[C@H]([NH3+])C(=O)N2c2cccc(F)c2)cc1	ZINC000072227611	394596624	/nfs/dbraw/zinc/59/66/24/394596624.db2.gz	IWLCLUMGVIPJOY-GJZGRUSLSA-N	1	1	286.306	2.250	40	0		CEABMO
CCN1C(=O)[C@H]([NH3+])[C@@H]1c1ccc(Cl)cc1Cl	ZINC000096526083	394697132	/nfs/dbraw/zinc/69/71/32/394697132.db2.gz	WTJUGUHOEKJQEP-ZJUUUORDSA-N	1	1	259.136	2.224	40	0		CEABMO
CC[NH+]1CCN(C(=O)c2ccc(OC(C)C)cc2)CC1	ZINC000006438649	170201428	/nfs/dbraw/zinc/20/14/28/170201428.db2.gz	XDEJWABPJQBPNR-UHFFFAOYSA-N	1	1	276.380	2.252	40	0		CEABMO
CCCNC(=O)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1	ZINC000038857450	174157868	/nfs/dbraw/zinc/15/78/68/174157868.db2.gz	NHTWGAXDXYMUJZ-OAHLLOKOSA-N	1	1	260.381	2.425	40	0		CEABMO
Nc1cccc2c1C(=O)c1cnn(-c3cc[nH+]cc3)c1-2	ZINC000218817345	414843592	/nfs/dbraw/zinc/84/35/92/414843592.db2.gz	LZBJRZHAYMVKOL-UHFFFAOYSA-N	1	1	262.272	2.061	40	0		CEABMO
CCN1CC[NH2+][C@@H](Cc2ccc(-c3cccnc3)cc2)C1=O	ZINC000072343608	176372277	/nfs/dbraw/zinc/37/22/77/176372277.db2.gz	LKHNTAVVTHOHJW-KRWDZBQOSA-N	1	1	295.386	2.111	40	0		CEABMO
Cc1nccn1-c1cccc([C@@H]2CCC[N@H+](C)C2)n1	ZINC000072355667	176375147	/nfs/dbraw/zinc/37/51/47/176375147.db2.gz	CMHJUKZFOODYNP-CYBMUJFWSA-N	1	1	256.353	2.385	40	0		CEABMO
CC(=O)N1CCC(CCc2cc[nH+]c(N(C)C)c2)CC1	ZINC000072381121	176387744	/nfs/dbraw/zinc/38/77/44/176387744.db2.gz	WTPVLDCMRTZRQI-UHFFFAOYSA-N	1	1	275.396	2.339	40	0		CEABMO
OC[C@@H]1CCC[N@@H+](Cc2cccn2-c2cccnc2)C1	ZINC000072397793	176395674	/nfs/dbraw/zinc/39/56/74/176395674.db2.gz	WJIKCWUJUHFSAM-CQSZACIVSA-N	1	1	271.364	2.077	40	0		CEABMO
CNC(=O)c1sc2nc([C@H]3CCC[N@H+]3C)ccc2c1N	ZINC000257328139	277262458	/nfs/dbraw/zinc/26/24/58/277262458.db2.gz	XEIIAEWHJZFPKD-SNVBAGLBSA-N	1	1	290.392	2.005	40	0		CEABMO
Cc1cccc(OC[C@@H](O)C[N@@H+]2CCC[C@@H](C)C2)c1	ZINC000002696076	281250525	/nfs/dbraw/zinc/25/05/25/281250525.db2.gz	SVKRAUOKQPVBIT-CABCVRRESA-N	1	1	263.381	2.467	40	0		CEABMO
c1coc(C[N@H+]2CCC[C@@]3(C[C@H](n4ccnc4)CO3)C2)c1	ZINC000096048545	185073034	/nfs/dbraw/zinc/07/30/34/185073034.db2.gz	ODJOIXLINXIUPZ-GOEBONIOSA-N	1	1	287.363	2.472	40	0		CEABMO
Cc1nc(C[N@H+]2CCC[C@@]3(CCC(=O)N3)CC2)cs1	ZINC000096047450	185073087	/nfs/dbraw/zinc/07/30/87/185073087.db2.gz	AKQHMSPYTFMNPL-CQSZACIVSA-N	1	1	279.409	2.086	40	0		CEABMO
Cc1nc(C[N@H+]2CCC[C@]3(CCC(=O)N3)CC2)cs1	ZINC000096047451	185073639	/nfs/dbraw/zinc/07/36/39/185073639.db2.gz	AKQHMSPYTFMNPL-AWEZNQCLSA-N	1	1	279.409	2.086	40	0		CEABMO
CN1C(=O)CCC[C@]12CCC[N@@H+](Cc1cccnc1)C2	ZINC000096049970	185074229	/nfs/dbraw/zinc/07/42/29/185074229.db2.gz	LJXJXJRYWSAPDB-MRXNPFEDSA-N	1	1	273.380	2.059	40	0		CEABMO
CCOC[C@@H]1Cn2nccc2C[N@H+](Cc2ccc(C)o2)C1	ZINC000096059213	185078651	/nfs/dbraw/zinc/07/86/51/185078651.db2.gz	JBNYKGIPCNMNSS-AWEZNQCLSA-N	1	1	289.379	2.453	40	0		CEABMO
CCOC[C@@H]1Cn2nccc2C[N@@H+](Cc2ccc(C)o2)C1	ZINC000096059213	185078652	/nfs/dbraw/zinc/07/86/52/185078652.db2.gz	JBNYKGIPCNMNSS-AWEZNQCLSA-N	1	1	289.379	2.453	40	0		CEABMO
O[C@@H]1CC[N@@H+](Cc2cccs2)[C@H]1Cc1cccnc1	ZINC000096061599	185082624	/nfs/dbraw/zinc/08/26/24/185082624.db2.gz	YPWUYYGQDDDCOQ-LSDHHAIUSA-N	1	1	274.389	2.321	40	0		CEABMO
C[N@H+]1CCC[C@@]2(CCN(Cc3cccc(F)c3)C2=O)C1	ZINC000096074101	185088290	/nfs/dbraw/zinc/08/82/90/185088290.db2.gz	NYZLNQASSTUCDJ-MRXNPFEDSA-N	1	1	276.355	2.270	40	0		CEABMO
COCC[N@H+]1CC[C@@H]2CN(Cc3ccccc3F)C[C@@H]2C1	ZINC000096081396	185091740	/nfs/dbraw/zinc/09/17/40/185091740.db2.gz	HLONYWFVFKSJIE-ZBFHGGJFSA-N	1	1	292.398	2.226	40	0		CEABMO
COCCN1CC[C@@H]2C[N@H+](Cc3ccccc3F)C[C@@H]2C1	ZINC000096081396	185091750	/nfs/dbraw/zinc/09/17/50/185091750.db2.gz	HLONYWFVFKSJIE-ZBFHGGJFSA-N	1	1	292.398	2.226	40	0		CEABMO
COCCN1CC[C@@H]2C[N@@H+](Cc3ccccc3F)C[C@@H]2C1	ZINC000096081396	185091751	/nfs/dbraw/zinc/09/17/51/185091751.db2.gz	HLONYWFVFKSJIE-ZBFHGGJFSA-N	1	1	292.398	2.226	40	0		CEABMO
CNc1cc(N2CCc3cc(OC)ccc3C2)[nH+]c(C)n1	ZINC000328976808	136396985	/nfs/dbraw/zinc/39/69/85/136396985.db2.gz	FQGURFJWTFKNNR-UHFFFAOYSA-N	1	1	284.363	2.398	40	0		CEABMO
CC(C)[N@H+]1CC[C@H](c2nnc(-c3cccnc3)o2)C1	ZINC000049169709	362343065	/nfs/dbraw/zinc/34/30/65/362343065.db2.gz	VFMCPOFROHWYOO-LBPRGKRZSA-N	1	1	258.325	2.329	40	0	biogenic,in-vitro	CEABMO
CC[NH+]1CCN(C(=O)CCc2ccc(Cl)cc2)CC1	ZINC000054483335	362536141	/nfs/dbraw/zinc/53/61/41/362536141.db2.gz	OCQGIXLMNMEFKB-UHFFFAOYSA-N	1	1	280.799	2.437	40	0		CEABMO
CO[C@H]1COCC[N@H+](Cc2cccc(Cl)c2)C1	ZINC000085435983	179063101	/nfs/dbraw/zinc/06/31/01/179063101.db2.gz	HLVHEIVIBPKLSY-CYBMUJFWSA-N	1	1	255.745	2.187	40	0	biogenic,in-vitro	CEABMO
CO[C@H]1COCC[N@@H+](Cc2cccc(Cl)c2)C1	ZINC000085435983	179063103	/nfs/dbraw/zinc/06/31/03/179063103.db2.gz	HLVHEIVIBPKLSY-CYBMUJFWSA-N	1	1	255.745	2.187	40	0	biogenic,in-vitro	CEABMO
CC(C)(C)OC(=O)N[C@@H]1CC[N@H+](Cc2ccccn2)C1	ZINC000067800951	362925972	/nfs/dbraw/zinc/92/59/72/362925972.db2.gz	VWNHCZMLIIXBDI-CYBMUJFWSA-N	1	1	277.368	2.181	40	0		CEABMO
CC(C)(C)OC(=O)N[C@@H]1CC[N@@H+](Cc2ccccn2)C1	ZINC000067800951	362925975	/nfs/dbraw/zinc/92/59/75/362925975.db2.gz	VWNHCZMLIIXBDI-CYBMUJFWSA-N	1	1	277.368	2.181	40	0		CEABMO
O=C1NCC[C@@]12CCC[N@@H+](Cc1ccsc1)CC2	ZINC000108532377	186222471	/nfs/dbraw/zinc/22/24/71/186222471.db2.gz	LRNZOGHWDQEIKA-CQSZACIVSA-N	1	1	264.394	2.240	40	0		CEABMO
O=C([O-])C[N@H+](C1CC1)C1CC[NH+](Cc2ccccc2)CC1	ZINC000079393459	363594248	/nfs/dbraw/zinc/59/42/48/363594248.db2.gz	QAQYBVBFINBYQK-UHFFFAOYSA-N	1	1	288.391	2.200	40	0		CEABMO
O=C([O-])C[N@@H+](C1CC1)C1CC[NH+](Cc2ccccc2)CC1	ZINC000079393459	363594255	/nfs/dbraw/zinc/59/42/55/363594255.db2.gz	QAQYBVBFINBYQK-UHFFFAOYSA-N	1	1	288.391	2.200	40	0		CEABMO
C[C@H](NC(=O)[C@@H]1CCC[N@@H+](C)C1)c1ccc(F)cc1	ZINC000081229408	363706459	/nfs/dbraw/zinc/70/64/59/363706459.db2.gz	NFDYWPSMUKIVND-WCQYABFASA-N	1	1	264.344	2.345	40	0		CEABMO
Cc1c(C[N@H+]2[C@@H]3CC[C@H]2Cc2nc(C)ncc23)cnn1C	ZINC000019553549	361543524	/nfs/dbraw/zinc/54/35/24/361543524.db2.gz	KYBUIMOHRGSLKU-XJKSGUPXSA-N	1	1	283.379	2.089	40	0		CEABMO
Cc1c(C[N@@H+]2[C@@H]3CC[C@H]2Cc2nc(C)ncc23)cnn1C	ZINC000019553549	361543529	/nfs/dbraw/zinc/54/35/29/361543529.db2.gz	KYBUIMOHRGSLKU-XJKSGUPXSA-N	1	1	283.379	2.089	40	0		CEABMO
COC[C@@H]1Cn2nccc2C[N@H+](Cc2cccc(F)c2)C1	ZINC000096188914	364407001	/nfs/dbraw/zinc/40/70/01/364407001.db2.gz	CCLPLEFHZONVAB-AWEZNQCLSA-N	1	1	289.354	2.301	40	0		CEABMO
COC[C@@H]1Cn2nccc2C[N@@H+](Cc2cccc(F)c2)C1	ZINC000096188914	364407008	/nfs/dbraw/zinc/40/70/08/364407008.db2.gz	CCLPLEFHZONVAB-AWEZNQCLSA-N	1	1	289.354	2.301	40	0		CEABMO
Cc1nc(-c2ccccc2)nc2c1CC[N@@H+](C)CC2	ZINC000096083789	364400532	/nfs/dbraw/zinc/40/05/32/364400532.db2.gz	HBSQPCLIACHKSW-UHFFFAOYSA-N	1	1	253.349	2.482	40	0		CEABMO
C[NH+](C)Cc1cn2c(n1)CN(Cc1ccc(F)cc1)CC2	ZINC000096197152	364408691	/nfs/dbraw/zinc/40/86/91/364408691.db2.gz	AWUGJMLULPWJSG-UHFFFAOYSA-N	1	1	288.370	2.100	40	0		CEABMO
O=C(C1CC1)N1CC[C@]2(CC[N@H+]2Cc2ccc(F)cc2)C1	ZINC000096228689	364414816	/nfs/dbraw/zinc/41/48/16/364414816.db2.gz	LJUAGMZBRBMJAB-KRWDZBQOSA-N	1	1	288.366	2.413	40	0		CEABMO
O=C(C1CC1)N1CC[C@]2(CC[N@@H+]2Cc2ccc(F)cc2)C1	ZINC000096228689	364414821	/nfs/dbraw/zinc/41/48/21/364414821.db2.gz	LJUAGMZBRBMJAB-KRWDZBQOSA-N	1	1	288.366	2.413	40	0		CEABMO
Cc1nc(C[NH+]2CCC3(C[C@@H]3C(=O)N(C)C)CC2)cs1	ZINC000096227794	364415135	/nfs/dbraw/zinc/41/51/35/364415135.db2.gz	IMMIYJRULZAUMU-CYBMUJFWSA-N	1	1	293.436	2.142	40	0		CEABMO
CN1c2ccccc2[C@@]2(CC[N@@H+](CC3CCC3)C2)C1=O	ZINC000096244808	364417087	/nfs/dbraw/zinc/41/70/87/364417087.db2.gz	BFWZCPNOBWAAIT-KRWDZBQOSA-N	1	1	270.376	2.407	40	0		CEABMO
Cc1nc(C[N@@H+]2CCc3ncnc(C)c3CC2)cs1	ZINC000096254951	364418219	/nfs/dbraw/zinc/41/82/19/364418219.db2.gz	IEPDWXCLWXWDEU-UHFFFAOYSA-N	1	1	274.393	2.151	40	0		CEABMO
Cc1nc(C[N@H+]2CCc3ncnc(C)c3CC2)cs1	ZINC000096254951	364418224	/nfs/dbraw/zinc/41/82/24/364418224.db2.gz	IEPDWXCLWXWDEU-UHFFFAOYSA-N	1	1	274.393	2.151	40	0		CEABMO
CC(C)Nc1ncnc2c1CC[N@@H+](CC1CC1)CC2	ZINC000096255538	364418537	/nfs/dbraw/zinc/41/85/37/364418537.db2.gz	VPIAVHZNWDFEFB-UHFFFAOYSA-N	1	1	260.385	2.108	40	0		CEABMO
[NH3+]CC(=O)c1cc(Cl)cc(OC(F)(F)F)c1	ZINC000097447171	364504042	/nfs/dbraw/zinc/50/40/42/364504042.db2.gz	GFJOCHPEACLVEK-UHFFFAOYSA-N	1	1	253.607	2.380	40	0		CEABMO
C[C@@H]1c2ncc(CCOCc3ccccn3)n2CC[N@@H+]1C	ZINC000585096837	367177606	/nfs/dbraw/zinc/17/76/06/367177606.db2.gz	BMVWNXZPCWNUCP-CYBMUJFWSA-N	1	1	286.379	2.044	40	0		CEABMO
C[N@H+]1CC[C@H]2OCCC[C@@]2(COc2ncccc2F)C1	ZINC000248021966	371155638	/nfs/dbraw/zinc/15/56/38/371155638.db2.gz	JDMVDVDTOQKFQM-HIFRSBDPSA-N	1	1	280.343	2.100	40	0		CEABMO
COc1ccccc1[C@@H]1CN(c2cc(C)ncn2)CC[N@@H+]1C	ZINC000257285704	371610763	/nfs/dbraw/zinc/61/07/63/371610763.db2.gz	PIJOTXCDGAMIOZ-HNNXBMFYSA-N	1	1	298.390	2.287	40	0		CEABMO
COc1ccccc1[C@@H]1CN(c2cc(C)ncn2)CC[N@H+]1C	ZINC000257285704	371610769	/nfs/dbraw/zinc/61/07/69/371610769.db2.gz	PIJOTXCDGAMIOZ-HNNXBMFYSA-N	1	1	298.390	2.287	40	0		CEABMO
Cn1ncc(C[NH2+]Cc2ccco2)c1C(F)(F)F	ZINC000256053155	190004119	/nfs/dbraw/zinc/00/41/19/190004119.db2.gz	QGTCLBRTQKDMIB-UHFFFAOYSA-N	1	1	259.231	2.322	40	0		CEABMO
Cn1nc(C(F)(F)F)cc1C[NH2+]Cc1ccco1	ZINC000256053381	190004720	/nfs/dbraw/zinc/00/47/20/190004720.db2.gz	RFIMOWQYGWCXMX-UHFFFAOYSA-N	1	1	259.231	2.322	40	0		CEABMO
CCn1nccc1-c1cncc(C[C@H]2CCC[N@@H+](C)C2)n1	ZINC000257203020	190010737	/nfs/dbraw/zinc/01/07/37/190010737.db2.gz	AOICLKCFLTUYFE-CYBMUJFWSA-N	1	1	285.395	2.244	40	0		CEABMO
Nc1nccnc1[C@@H]1C[N@H+](CC2CCCCC2)CCO1	ZINC000257211562	190012719	/nfs/dbraw/zinc/01/27/19/190012719.db2.gz	BZIPFNHZYVBHBN-ZDUSSCGKSA-N	1	1	276.384	2.012	40	0		CEABMO
Nc1nccnc1[C@@H]1C[N@@H+](CC2CCCCC2)CCO1	ZINC000257211562	190012720	/nfs/dbraw/zinc/01/27/20/190012720.db2.gz	BZIPFNHZYVBHBN-ZDUSSCGKSA-N	1	1	276.384	2.012	40	0		CEABMO
CCCN1CCO[C@H](c2cc(N(C)C)cc(C)[nH+]2)C1	ZINC000257243966	190019256	/nfs/dbraw/zinc/01/92/56/190019256.db2.gz	IJIKSZCRRCBMAI-HNNXBMFYSA-N	1	1	263.385	2.239	40	0		CEABMO
Cc1c[nH]nc1C[C@@H]1CCC[N@@H+](Cc2ccnc(C)n2)C1	ZINC000257308613	190031496	/nfs/dbraw/zinc/03/14/96/190031496.db2.gz	TXJQPROJDQSXQR-AWEZNQCLSA-N	1	1	285.395	2.271	40	0		CEABMO
CC(C)[N@H+]1CCC[C@@H](c2cncc(-c3ncc[nH]3)n2)C1	ZINC000257335820	190036499	/nfs/dbraw/zinc/03/64/99/190036499.db2.gz	YMAMGRZGKSKAKW-GFCCVEGCSA-N	1	1	271.368	2.455	40	0		CEABMO
Nc1nccnc1C[C@@H]1CCC[N@@H+](CCC(F)(F)F)C1	ZINC000257341417	190037233	/nfs/dbraw/zinc/03/72/33/190037233.db2.gz	ZKEZVWAKJDAUJU-JTQLQIEISA-N	1	1	288.317	2.266	40	0		CEABMO
Cc1ccc(N2CC[C@H]3[C@H]2CC[N@H+]3Cc2ccccn2)nn1	ZINC000306127594	376540629	/nfs/dbraw/zinc/54/06/29/376540629.db2.gz	GCYODMMXAMATDJ-JKSUJKDBSA-N	1	1	295.390	2.033	40	0		CEABMO
CC[N@@H+](Cc1ccccc1)[C@H]1CC[C@H]([NH2+]CC(=O)[O-])CC1	ZINC000100177948	285116474	/nfs/dbraw/zinc/11/64/74/285116474.db2.gz	SYVYCADJXVQLMC-IYBDPMFKSA-N	1	1	290.407	2.494	40	0		CEABMO
C[C@H]1c2cc(-c3csc(NC(N)=[NH2+])n3)ccc2NC1=O	ZINC000004993900	394456489	/nfs/dbraw/zinc/45/64/89/394456489.db2.gz	CQUNHLZVPLLHNG-LURJTMIESA-N	1	1	287.348	2.171	40	0		CEABMO
CC[NH+](CC)[C@]1([C@@H](CN)CO)C[C@H]2CC[C@]1(C)C2(C)C	ZINC000072210466	394592422	/nfs/dbraw/zinc/59/24/22/394592422.db2.gz	MYMMFPISRPMSER-WTTBNOFXSA-N	1	1	282.472	2.480	40	0		CEABMO
[NH3+][C@H]1C(=O)N(c2ccc(F)cc2)[C@@H]1c1ccccc1F	ZINC000072227244	394595541	/nfs/dbraw/zinc/59/55/41/394595541.db2.gz	ISINHULIJDRCSJ-ZIAGYGMSSA-N	1	1	274.270	2.380	40	0		CEABMO
[NH3+][C@H]1C(=O)N(Cc2ccccc2)[C@@H]1c1ccccc1F	ZINC000072228164	394596589	/nfs/dbraw/zinc/59/65/89/394596589.db2.gz	PTSQGZAVHPDLIL-HUUCEWRRSA-N	1	1	270.307	2.237	40	0		CEABMO
Clc1ccc2c(c1)N[C@@H]([C@H]1CCOC1)N1CC[NH+]=C21	ZINC000012188529	400105891	/nfs/dbraw/zinc/10/58/91/400105891.db2.gz	LRZYVJLYMHUBMS-TVQRCGJNSA-N	1	1	277.755	2.190	40	0		CEABMO
O[C@@H](COc1ccccc1)C[N@H+]1CCc2ccccc2C1	ZINC000006529952	170210894	/nfs/dbraw/zinc/21/08/94/170210894.db2.gz	YXZACQIXSNSCCQ-QGZVFWFLSA-N	1	1	283.371	2.485	40	0		CEABMO
Cc1cccc(NC(=O)NC[C@@H]2CCC[N@H+](C)C2)c1	ZINC000009876662	170388230	/nfs/dbraw/zinc/38/82/30/170388230.db2.gz	TYLVPGWQYQRUDW-ZDUSSCGKSA-N	1	1	261.369	2.458	40	0		CEABMO
COC(=O)[C@H]([NH3+])Cc1ccc(OCc2ccccc2)cc1	ZINC000021982232	171344222	/nfs/dbraw/zinc/34/42/22/171344222.db2.gz	IUXVIPGPIFGSEU-MRXNPFEDSA-N	1	1	285.343	2.308	40	0		CEABMO
Cn1ccnc1C[NH+]1CCC(c2ccncc2)CC1	ZINC000072351196	176374372	/nfs/dbraw/zinc/37/43/72/176374372.db2.gz	BJERXQIIWTZZRR-UHFFFAOYSA-N	1	1	256.353	2.195	40	0		CEABMO
Cc1nccn1CCNc1cccc([C@@H]2CCC[N@@H+]2C)n1	ZINC000072365342	176380473	/nfs/dbraw/zinc/38/04/73/176380473.db2.gz	RHZSXONPDUSARO-HNNXBMFYSA-N	1	1	285.395	2.465	40	0		CEABMO
COc1ccc([C@@H]2C[N@H+](C(C)C)CCN2C(C)=O)cc1	ZINC000072366565	176381790	/nfs/dbraw/zinc/38/17/90/176381790.db2.gz	ZMFLRCQXBJTEQX-INIZCTEOSA-N	1	1	276.380	2.309	40	0		CEABMO
Cc1cccc(C[N@@H+]2CCCN(c3cc(C)ncn3)CC2)n1	ZINC000072368988	176383561	/nfs/dbraw/zinc/38/35/61/176383561.db2.gz	LYCRMJFFAALBIM-UHFFFAOYSA-N	1	1	297.406	2.201	40	0		CEABMO
CNc1ncccc1C[N@H+]1CCC[C@@H](c2cc[nH]n2)C1	ZINC000072386194	176391752	/nfs/dbraw/zinc/39/17/52/176391752.db2.gz	YSNOQJADAJMTBT-GFCCVEGCSA-N	1	1	271.368	2.226	40	0		CEABMO
C[N@H+]1CCC[C@@H]1c1cccc(NCC2(C)COC2)n1	ZINC000072386982	176392515	/nfs/dbraw/zinc/39/25/15/176392515.db2.gz	FCSPHGXXPUJFSD-CYBMUJFWSA-N	1	1	261.369	2.297	40	0		CEABMO
C[C@@H]1C[N@H+]2CCC[C@H]2CN1Cc1coc2ccccc2c1=O	ZINC000072397547	176395020	/nfs/dbraw/zinc/39/50/20/176395020.db2.gz	AUCJMMXJAUJMQV-HIFRSBDPSA-N	1	1	298.386	2.462	40	0		CEABMO
c1cc(C[N@H+]2CCc3ncnc([C@@H]4CCOC4)c3CC2)co1	ZINC000096058631	275064350	/nfs/dbraw/zinc/06/43/50/275064350.db2.gz	DHSHRMIYPQPIPT-CQSZACIVSA-N	1	1	299.374	2.174	40	0		CEABMO
C[N@H+]1CCC[C@@H]1c1ccnc(C(=O)Nc2ccon2)c1	ZINC000257309077	277066174	/nfs/dbraw/zinc/06/61/74/277066174.db2.gz	TZLDJEFWPNPTJM-GFCCVEGCSA-N	1	1	272.308	2.089	40	0		CEABMO
CNc1nc(N2Cc3ccccc3C(C)(C)C2)cc[nH+]1	ZINC000329012048	277221120	/nfs/dbraw/zinc/22/11/20/277221120.db2.gz	MHYGSHHXTHYBGZ-UHFFFAOYSA-N	1	1	268.364	2.238	40	0		CEABMO
COCC[N@H+]1CCc2ncnc(-c3ccsc3)c2CC1	ZINC000096084004	277227622	/nfs/dbraw/zinc/22/76/22/277227622.db2.gz	LUDXOHQHWFUIRD-UHFFFAOYSA-N	1	1	289.404	2.252	40	0		CEABMO
c1cc(CN2CCC3(C[C@H]([NH+]4CCCC4)CO3)CC2)co1	ZINC000096047942	185072971	/nfs/dbraw/zinc/07/29/71/185072971.db2.gz	COYTVOBLSUOMBJ-INIZCTEOSA-N	1	1	290.407	2.499	40	0		CEABMO
c1coc(CN2CCC3(CC2)COCC[N@@H+]3CC2CC2)c1	ZINC000096048911	185073106	/nfs/dbraw/zinc/07/31/06/185073106.db2.gz	PJNKAWZNVKHRRH-UHFFFAOYSA-N	1	1	290.407	2.356	40	0		CEABMO
c1coc(C[NH+]2CCC3(CC2)COCCN3CC2CC2)c1	ZINC000096048911	185073107	/nfs/dbraw/zinc/07/31/07/185073107.db2.gz	PJNKAWZNVKHRRH-UHFFFAOYSA-N	1	1	290.407	2.356	40	0		CEABMO
c1cc(CN2CC[N@H+]3C[C@H](OCC4CC4)C[C@@H]3C2)cs1	ZINC000096054993	185076124	/nfs/dbraw/zinc/07/61/24/185076124.db2.gz	YPRUUDNUVOBELJ-HZPDHXFCSA-N	1	1	292.448	2.433	40	0		CEABMO
COC[C@@]12CCCO[C@H]1CC[N@@H+](Cc1ccncc1)C2	ZINC000096056729	185077197	/nfs/dbraw/zinc/07/71/97/185077197.db2.gz	HVXOOPYFHMJWMJ-HOTGVXAUSA-N	1	1	276.380	2.099	40	0		CEABMO
COC[C@@H]1C[N@H+](Cc2ccc(C)o2)Cc2cnn(C)c21	ZINC000096060010	185079974	/nfs/dbraw/zinc/07/99/74/185079974.db2.gz	VDRPXWZTTBIOIP-ZDUSSCGKSA-N	1	1	275.352	2.067	40	0		CEABMO
COC[C@@H]1C[N@@H+](Cc2ccc(C)o2)Cc2cnn(C)c21	ZINC000096060010	185079977	/nfs/dbraw/zinc/07/99/77/185079977.db2.gz	VDRPXWZTTBIOIP-ZDUSSCGKSA-N	1	1	275.352	2.067	40	0		CEABMO
Cc1cccc(C[N@H+]2CC[C@@H]3[C@@H]2CCN3c2ncccn2)n1	ZINC000096064032	185083794	/nfs/dbraw/zinc/08/37/94/185083794.db2.gz	JURDHVGAHBNIKR-JKSUJKDBSA-N	1	1	295.390	2.033	40	0		CEABMO
CC[N@H+]1CCOCC12CCN(C(=O)CC1CCCC1)CC2	ZINC000096074602	185088552	/nfs/dbraw/zinc/08/85/52/185088552.db2.gz	JZSFCDIIKWAETM-UHFFFAOYSA-N	1	1	294.439	2.280	40	0		CEABMO
C[C@H](CCN1C[C@H]2C[C@@H](O)C[N@H+]2C[C@H]1C)c1ccccc1	ZINC000036718966	361852186	/nfs/dbraw/zinc/85/21/86/361852186.db2.gz	OQWLLWPCXDAZNO-JOCBIADPSA-N	1	1	288.435	2.320	40	0		CEABMO
C[C@H](CC[N@@H+]1C[C@H]2C[C@@H](O)CN2C[C@H]1C)c1ccccc1	ZINC000036718966	361852192	/nfs/dbraw/zinc/85/21/92/361852192.db2.gz	OQWLLWPCXDAZNO-JOCBIADPSA-N	1	1	288.435	2.320	40	0		CEABMO
C[C@H](CC[N@H+]1C[C@H]2C[C@@H](O)CN2C[C@H]1C)c1ccccc1	ZINC000036718966	361852200	/nfs/dbraw/zinc/85/22/00/361852200.db2.gz	OQWLLWPCXDAZNO-JOCBIADPSA-N	1	1	288.435	2.320	40	0		CEABMO
O=C(C[NH+]1CCCCC1)N/N=C/c1ccccc1Cl	ZINC000020247890	343375755	/nfs/dbraw/zinc/37/57/55/343375755.db2.gz	OZNXVUZMDSGZCO-MHWRWJLKSA-N	1	1	279.771	2.276	40	0		CEABMO
CCNc1nc(N2Cc3ccccc3C[C@@H]2C)cc[nH+]1	ZINC000329020794	136377584	/nfs/dbraw/zinc/37/75/84/136377584.db2.gz	OCODZIPWDISZDY-LBPRGKRZSA-N	1	1	268.364	2.282	40	0		CEABMO
OC[C@@H]1CC[N@H+](Cc2cc(Br)cs2)C1	ZINC000051887335	362444221	/nfs/dbraw/zinc/44/42/21/362444221.db2.gz	YOWQMSRNOZQANZ-MRVPVSSYSA-N	1	1	276.199	2.325	40	0		CEABMO
OC[C@@H]1CC[N@@H+](Cc2cc(Br)cs2)C1	ZINC000051887335	362444227	/nfs/dbraw/zinc/44/42/27/362444227.db2.gz	YOWQMSRNOZQANZ-MRVPVSSYSA-N	1	1	276.199	2.325	40	0		CEABMO
Cc1cccc(OC[C@@]2(O)CC[N@@H+](Cc3ccncc3)C2)c1	ZINC000585269203	345009011	/nfs/dbraw/zinc/00/90/11/345009011.db2.gz	LLIWZMNIMWNRSH-GOSISDBHSA-N	1	1	298.386	2.406	40	0		CEABMO
CCCCOC(=O)[C@@H]([NH3+])Cc1c[nH]c2ccccc12	ZINC000055145677	362544642	/nfs/dbraw/zinc/54/46/42/362544642.db2.gz	YBWXYSUDFGURNJ-ZDUSSCGKSA-N	1	1	260.337	2.381	40	0		CEABMO
CC[NH+]1CCN(c2c(C)cc(N)cc2Cl)CC1	ZINC000045886033	136480598	/nfs/dbraw/zinc/48/05/98/136480598.db2.gz	JRQZXTUTXUFDCN-UHFFFAOYSA-N	1	1	253.777	2.373	40	0		CEABMO
CC(C)(C)OC(=O)N1CC[C@H](Nc2[nH+]cccc2N)C1	ZINC000091351807	180137584	/nfs/dbraw/zinc/13/75/84/180137584.db2.gz	NEUIHEJKMNHETP-JTQLQIEISA-N	1	1	278.356	2.085	40	0		CEABMO
CC(C)NC(=O)C[C@H]1[C@H]2C[N@H+](Cc3ccsc3)C[C@@H]12	ZINC000107745849	186188921	/nfs/dbraw/zinc/18/89/21/186188921.db2.gz	ZZQJNSGUJRCUSH-BTTYYORXSA-N	1	1	278.421	2.341	40	0		CEABMO
CNC(=O)[C@H]1CCC[C@]12CC[N@@H+](Cc1ccc(C)o1)C2	ZINC000108524165	186220359	/nfs/dbraw/zinc/22/03/59/186220359.db2.gz	AADFEFUVLPSMDS-GDBMZVCRSA-N	1	1	276.380	2.326	40	0		CEABMO
CNc1cccc(C2CCN(c3ncccn3)CC2)[nH+]1	ZINC000072356592	363131670	/nfs/dbraw/zinc/13/16/70/363131670.db2.gz	ALZIJLPLRJUIKV-UHFFFAOYSA-N	1	1	269.352	2.297	40	0		CEABMO
CC[N@H+](CC(=O)[O-])C1CC[NH+](Cc2ccccc2)CC1	ZINC000079393390	363593580	/nfs/dbraw/zinc/59/35/80/363593580.db2.gz	XJMZZSGIVPQNIW-UHFFFAOYSA-N	1	1	276.380	2.058	40	0		CEABMO
CC[N@@H+](CC(=O)[O-])C1CC[NH+](Cc2ccccc2)CC1	ZINC000079393390	363593585	/nfs/dbraw/zinc/59/35/85/363593585.db2.gz	XJMZZSGIVPQNIW-UHFFFAOYSA-N	1	1	276.380	2.058	40	0		CEABMO
C[N@H+]1CCC[C@@H](C(=O)Nc2ccc(F)c(F)c2)C1	ZINC000082339218	363767904	/nfs/dbraw/zinc/76/79/04/363767904.db2.gz	NFXDAXSOEKSJRV-SECBINFHSA-N	1	1	254.280	2.245	40	0		CEABMO
CCOc1ccc(C(=O)[C@@H](C)C[NH+]2CCN(C)CC2)cc1	ZINC000019366343	361528758	/nfs/dbraw/zinc/52/87/58/361528758.db2.gz	BVFITKDNSDTIBL-AWEZNQCLSA-N	1	1	290.407	2.152	40	0		CEABMO
C[N@H+]1CCC[C@@H](NC(=O)CCCOc2ccccc2F)C1	ZINC000019588506	361545478	/nfs/dbraw/zinc/54/54/78/361545478.db2.gz	HJRIFPPCIXSQMB-CYBMUJFWSA-N	1	1	294.370	2.195	40	0		CEABMO
COCCNC(=O)c1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1	ZINC000030752127	361702882	/nfs/dbraw/zinc/70/28/82/361702882.db2.gz	IPGVFHXILRSASR-CQSZACIVSA-N	1	1	290.407	2.295	40	0		CEABMO
Cc1ccc(CN2CC[C@@H]3[C@@H]2CC[N@H+]3C2CCOCC2)o1	ZINC000096184703	364407253	/nfs/dbraw/zinc/40/72/53/364407253.db2.gz	RELXPYDLXMMGIA-DLBZAZTESA-N	1	1	290.407	2.416	40	0		CEABMO
Cc1cc(C)cc(C[N@H+]2CC[C@@H]3NC(=O)CC[C@@H]32)c1	ZINC000096186179	364407593	/nfs/dbraw/zinc/40/75/93/364407593.db2.gz	INRYSUCHTNIHAW-GJZGRUSLSA-N	1	1	258.365	2.156	40	0		CEABMO
O=C(c1ccco1)N1CC[C@H]2[C@H]1CC[N@@H+]2Cc1cccnc1	ZINC000096055840	364399230	/nfs/dbraw/zinc/39/92/30/364399230.db2.gz	WSKJRWNZTCVWKX-LSDHHAIUSA-N	1	1	297.358	2.164	40	0		CEABMO
O=C(c1ccco1)N1CC[C@H]2[C@H]1CC[N@H+]2Cc1cccnc1	ZINC000096055840	364399235	/nfs/dbraw/zinc/39/92/35/364399235.db2.gz	WSKJRWNZTCVWKX-LSDHHAIUSA-N	1	1	297.358	2.164	40	0		CEABMO
CC(C)C[N@H+]1CCC[C@@]12CCN(c1nncs1)C2	ZINC000096203046	364411202	/nfs/dbraw/zinc/41/12/02/364411202.db2.gz	JWWVPWMKUQSJGT-ZDUSSCGKSA-N	1	1	266.414	2.239	40	0		CEABMO
COc1ccc(C[N@H+]2CC[C@H](O)[C@@H]2Cc2cccnc2)cc1	ZINC000096200435	364411262	/nfs/dbraw/zinc/41/12/62/364411262.db2.gz	ZWQJRIHGQLHUGM-ROUUACIJSA-N	1	1	298.386	2.268	40	0		CEABMO
Cc1ccc(N2CCC[C@]3(CC[N@@H+](CC4CC4)C3)C2)nn1	ZINC000096217102	364412186	/nfs/dbraw/zinc/41/21/86/364412186.db2.gz	GKZDYSAZOBGJMR-QGZVFWFLSA-N	1	1	286.423	2.487	40	0		CEABMO
C[N@H+]1CC[C@@]2(c3ccccc3)CCN(C(=O)C3CC3)C[C@H]12	ZINC000096251819	364416415	/nfs/dbraw/zinc/41/64/15/364416415.db2.gz	KHUQSPQHMNEIHO-WMZOPIPTSA-N	1	1	284.403	2.271	40	0		CEABMO
CN(C)[C@@H]1CC[N@H+](Cc2cnn(C)c2)[C@H]1Cc1ccccc1	ZINC000096261351	364418678	/nfs/dbraw/zinc/41/86/78/364418678.db2.gz	FPEZNCYDPMFABX-MSOLQXFVSA-N	1	1	298.434	2.167	40	0		CEABMO
CN(C)[C@@H]1CC[N@@H+](Cc2cnn(C)c2)[C@H]1Cc1ccccc1	ZINC000096261351	364418682	/nfs/dbraw/zinc/41/86/82/364418682.db2.gz	FPEZNCYDPMFABX-MSOLQXFVSA-N	1	1	298.434	2.167	40	0		CEABMO
CC1=N[C@@]2(CC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)C(=O)N1C	ZINC000096261396	364418745	/nfs/dbraw/zinc/41/87/45/364418745.db2.gz	JGTWHFYCDHSRFX-SOLBZPMBSA-N	1	1	297.402	2.158	40	0		CEABMO
COC[C@@H]1CCn2nccc2C[N@@H+]1Cc1ncccc1C	ZINC000585097661	367177228	/nfs/dbraw/zinc/17/72/28/367177228.db2.gz	PDWOHEHOKRJTIF-HNNXBMFYSA-N	1	1	286.379	2.007	40	0		CEABMO
COC[C@@H]1CCn2nccc2C[N@H+]1Cc1ncccc1C	ZINC000585097661	367177230	/nfs/dbraw/zinc/17/72/30/367177230.db2.gz	PDWOHEHOKRJTIF-HNNXBMFYSA-N	1	1	286.379	2.007	40	0		CEABMO
CCC[C@H](C)[N@H+]1CCC[C@]2(CN(c3ncccn3)C2=O)C1	ZINC000585099698	367178208	/nfs/dbraw/zinc/17/82/08/367178208.db2.gz	YMCUZPKWOHVKKM-XJKSGUPXSA-N	1	1	288.395	2.094	40	0		CEABMO
[NH3+]CCSc1nc(-c2cccc(Cl)c2)n[nH]1	ZINC000224978663	370284542	/nfs/dbraw/zinc/28/45/42/370284542.db2.gz	DGZZNKHXIYPCIO-UHFFFAOYSA-N	1	1	254.746	2.176	40	0		CEABMO
CC[C@@H]1CCCC[N@H+]1CCCNC(=O)c1cccnc1	ZINC000225430512	370294101	/nfs/dbraw/zinc/29/41/01/370294101.db2.gz	SPNRBSZGQJPSNA-OAHLLOKOSA-N	1	1	275.396	2.466	40	0		CEABMO
COCCN1C(=O)CCC[C@H]2C[N@@H+](C3CCCC3)CC[C@H]21	ZINC000257319084	371613817	/nfs/dbraw/zinc/61/38/17/371613817.db2.gz	VQQLCCUTHILGBJ-GOEBONIOSA-N	1	1	294.439	2.278	40	0		CEABMO
CO[C@H]1CSC2(C[NH+](Cc3ccc4c(c3)OCO4)C2)C1	ZINC000247901017	189942151	/nfs/dbraw/zinc/94/21/51/189942151.db2.gz	VWNPHXCWXWOUCB-GFCCVEGCSA-N	1	1	293.388	2.122	40	0		CEABMO
CC[C@H](C)n1nccc1C[NH2+]Cc1ccnn1CCF	ZINC000256050176	190003058	/nfs/dbraw/zinc/00/30/58/190003058.db2.gz	DAUQBVDLMWPJNI-LBPRGKRZSA-N	1	1	279.363	2.310	40	0		CEABMO
CCCn1cc(C[N@H+]2CCC[C@H](Cc3cc[nH]n3)C2)cn1	ZINC000257208582	190012621	/nfs/dbraw/zinc/01/26/21/190012621.db2.gz	BMTJMYIZPJRJCU-CQSZACIVSA-N	1	1	287.411	2.471	40	0		CEABMO
C[N@H+]1CC[C@@H](Cc2cccc(Br)n2)C1	ZINC000257197572	190010157	/nfs/dbraw/zinc/01/01/57/190010157.db2.gz	CYMYINAIDURXHI-VIFPVBQESA-N	1	1	255.159	2.338	40	0		CEABMO
C[N@H+]1CC[C@@]2(C)[C@@H]1CCC(=O)N2Cc1ccccc1F	ZINC000257225431	190015400	/nfs/dbraw/zinc/01/54/00/190015400.db2.gz	FGEICAVWEPQOPI-HOCLYGCPSA-N	1	1	276.355	2.411	40	0		CEABMO
Cc1c[nH]nc1[C@H]1CC[N@@H+](CC2(O)CCCCC2)C1	ZINC000257224327	190015109	/nfs/dbraw/zinc/01/51/09/190015109.db2.gz	FBIHYVSXXWNNTC-ZDUSSCGKSA-N	1	1	263.385	2.203	40	0		CEABMO
O[C@H]1C[N@H+](Cc2c(F)cccc2F)CC[C@@]12CCCO2	ZINC000257265052	190023240	/nfs/dbraw/zinc/02/32/40/190023240.db2.gz	LXCLRQZKVGSPQP-GJZGRUSLSA-N	1	1	283.318	2.081	40	0		CEABMO
O[C@H]1C[N@@H+](Cc2c(F)cccc2F)CC[C@@]12CCCO2	ZINC000257265052	190023241	/nfs/dbraw/zinc/02/32/41/190023241.db2.gz	LXCLRQZKVGSPQP-GJZGRUSLSA-N	1	1	283.318	2.081	40	0		CEABMO
Cc1cc(-c2cncc(C[C@H]3CCC[N@H+](C)C3)n2)n[nH]1	ZINC000257266957	190022795	/nfs/dbraw/zinc/02/27/95/190022795.db2.gz	MFIKSQKIAQBZGH-GFCCVEGCSA-N	1	1	271.368	2.059	40	0		CEABMO
COc1cccc(OC)c1C[N@H+]1CC[C@@H](c2cc[nH]n2)C1	ZINC000257283652	190026493	/nfs/dbraw/zinc/02/64/93/190026493.db2.gz	OZFPERYVYYLLSH-GFCCVEGCSA-N	1	1	287.363	2.416	40	0		CEABMO
CNc1cc([C@H]2CCC[N@@H+]2Cc2[nH]cnc2C)nc(C)n1	ZINC000257287327	190027169	/nfs/dbraw/zinc/02/71/69/190027169.db2.gz	PPMDGYGSZUXVJL-CQSZACIVSA-N	1	1	286.383	2.195	40	0		CEABMO
CNc1cc([C@H]2CCC[N@H+]2Cc2[nH]cnc2C)nc(C)n1	ZINC000257287327	190027170	/nfs/dbraw/zinc/02/71/70/190027170.db2.gz	PPMDGYGSZUXVJL-CQSZACIVSA-N	1	1	286.383	2.195	40	0		CEABMO
c1ccc(C[N@@H+]2CCOC[C@@H](Cc3cnccn3)C2)cc1	ZINC000257272577	190024383	/nfs/dbraw/zinc/02/43/83/190024383.db2.gz	NCXYPTXISOBWIT-INIZCTEOSA-N	1	1	283.375	2.168	40	0		CEABMO
O=c1[nH]cccc1-c1noc(C[NH+]2CCCCCC2)n1	ZINC000257338974	190037414	/nfs/dbraw/zinc/03/74/14/190037414.db2.gz	YZQZWJVYVZTJHO-UHFFFAOYSA-N	1	1	274.324	2.213	40	0		CEABMO
C[C@]1(O)C[N@@H+](CC2CC2)CC[C@@H]1Oc1ccccc1	ZINC000257343991	190037616	/nfs/dbraw/zinc/03/76/16/190037616.db2.gz	ZVHFRWIHKUNPPE-HOTGVXAUSA-N	1	1	261.365	2.301	40	0		CEABMO
CN1C(=O)c2ccccc2O[C@H]2C[N@@H+](C3CCCC3)C[C@H]21	ZINC000514289369	379129679	/nfs/dbraw/zinc/12/96/79/379129679.db2.gz	JDGWZIJBZRGXRK-ZBFHGGJFSA-N	1	1	286.375	2.146	40	0	biogenic,in-vitro	CEABMO
CN(C)c1cccc(C2CCN(c3cnccn3)CC2)[nH+]1	ZINC000072356714	134985320	/nfs/dbraw/zinc/98/53/20/134985320.db2.gz	OXWNUKLVOCDYNM-UHFFFAOYSA-N	1	1	283.379	2.322	40	0		CEABMO
COc1cccc([C@@H]2[C@@H]([NH3+])C(=O)N2c2ccc(F)cc2)c1	ZINC000072227224	394595287	/nfs/dbraw/zinc/59/52/87/394595287.db2.gz	QLMHZURZFQDQGH-HUUCEWRRSA-N	1	1	286.306	2.250	40	0		CEABMO
Cc1ccc([C@H]2[C@@H]([NH3+])C(=O)N2c2ccc(F)cc2)o1	ZINC000072227221	394595607	/nfs/dbraw/zinc/59/56/07/394595607.db2.gz	LTKGARFDKBEJDE-OLZOCXBDSA-N	1	1	260.268	2.142	40	0		CEABMO
CN1CC[NH2+][C@H](Cc2ccccc2-c2ccccc2)C1=O	ZINC000072352857	394598772	/nfs/dbraw/zinc/59/87/72/394598772.db2.gz	RPVPILULXPZJAP-QGZVFWFLSA-N	1	1	280.371	2.326	40	0		CEABMO
CC(C)[N@H+](C)C[C@H]1C[C@@H]2CN(Cc3ccco3)C[C@@H]2O1	ZINC000096056657	394676060	/nfs/dbraw/zinc/67/60/60/394676060.db2.gz	SIBHYXQXPRBGCI-BMFZPTHFSA-N	1	1	278.396	2.209	40	0		CEABMO
CC(C)[N@@H+](C)C[C@H]1C[C@@H]2CN(Cc3ccco3)C[C@@H]2O1	ZINC000096056657	394676063	/nfs/dbraw/zinc/67/60/63/394676063.db2.gz	SIBHYXQXPRBGCI-BMFZPTHFSA-N	1	1	278.396	2.209	40	0		CEABMO
NC(=O)C[C@H]([NH3+])c1ccc(-c2ccccc2Cl)o1	ZINC000044252950	175156425	/nfs/dbraw/zinc/15/64/25/175156425.db2.gz	FIZZASVNJWAOJH-JTQLQIEISA-N	1	1	264.712	2.475	40	0		CEABMO
C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)Cc1ccccc1)C2	ZINC000063527686	175687323	/nfs/dbraw/zinc/68/73/23/175687323.db2.gz	LGTKLYXZCDAJEQ-QGZVFWFLSA-N	1	1	272.392	2.173	40	0		CEABMO
CN1CC[NH2+][C@@H](Cc2ccc(-c3ccccc3)cc2)C1=O	ZINC000072352832	176374168	/nfs/dbraw/zinc/37/41/68/176374168.db2.gz	GCHXDZDUUJNPHF-KRWDZBQOSA-N	1	1	280.371	2.326	40	0		CEABMO
COCCNc1cccc(C[C@@H]2CCC[N@@H+](C)CC2)n1	ZINC000072386649	176392085	/nfs/dbraw/zinc/39/20/85/176392085.db2.gz	ADLQUAMUAZTTRI-CQSZACIVSA-N	1	1	277.412	2.414	40	0		CEABMO
Cc1nc2c(c(=O)[nH]1)C[N@@H+](Cc1c[nH]c3ccccc13)CC2	ZINC000072389560	176393871	/nfs/dbraw/zinc/39/38/71/176393871.db2.gz	KBXIYVGKTBFGNP-UHFFFAOYSA-N	1	1	294.358	2.118	40	0		CEABMO
Cc1ccc([C@@H]2[C@H]([NH3+])C(=O)N2c2ccccc2)cc1	ZINC000059103823	274759181	/nfs/dbraw/zinc/75/91/81/274759181.db2.gz	QIKATRSAPXONBD-LSDHHAIUSA-N	1	1	252.317	2.410	40	0		CEABMO
CNc1cc([C@H]2CCC[N@H+]2C2CCOCC2)nc(C)n1	ZINC000257205046	277043425	/nfs/dbraw/zinc/04/34/25/277043425.db2.gz	AXKFUOFCOBHMBN-CQSZACIVSA-N	1	1	276.384	2.143	40	0		CEABMO
C[C@@H]1Cc2ccccc2N1C(=O)[C@@H]1CCC[N@@H+](C)C1	ZINC000082337167	279019209	/nfs/dbraw/zinc/01/92/09/279019209.db2.gz	KQPIBFWLXXQLNF-TZMCWYRMSA-N	1	1	258.365	2.306	40	0		CEABMO
C[C@]12CC[N@@H+](CCc3ccc(F)cc3)[C@H]1CCC(=O)N2	ZINC000257336387	280177097	/nfs/dbraw/zinc/17/70/97/280177097.db2.gz	YOESPSKMHRZGMJ-HOCLYGCPSA-N	1	1	276.355	2.111	40	0		CEABMO
CN1c2ccccc2O[C@H]2C[C@@H](C1=O)[N@H+](C1CCCC1)C2	ZINC000096111904	290320591	/nfs/dbraw/zinc/32/05/91/290320591.db2.gz	ZUDBOSPJAHJYKR-ZFWWWQNUSA-N	1	1	286.375	2.427	40	0	biogenic,in-vitro	CEABMO
COC[C@]12CCCO[C@@H]1CC[N@H+](Cc1nccs1)C2	ZINC000096038981	185069794	/nfs/dbraw/zinc/06/97/94/185069794.db2.gz	ICEGIXBQEWTQGY-TZMCWYRMSA-N	1	1	282.409	2.161	40	0		CEABMO
COC[C@]12CCCO[C@@H]1CC[N@@H+](Cc1nccs1)C2	ZINC000096038981	185069796	/nfs/dbraw/zinc/06/97/96/185069796.db2.gz	ICEGIXBQEWTQGY-TZMCWYRMSA-N	1	1	282.409	2.161	40	0		CEABMO
COc1ccc(C[N@H+]2CCC[C@]3(CCCC(=O)N3)C2)cc1	ZINC000096049945	185074457	/nfs/dbraw/zinc/07/44/57/185074457.db2.gz	OUKKDIVLTZNWJP-QGZVFWFLSA-N	1	1	288.391	2.330	40	0		CEABMO
Fc1cccc(O[C@@H]2C[C@H]3C[N@@H+](CC4CC4)CCN3C2)c1	ZINC000096055157	185075854	/nfs/dbraw/zinc/07/58/54/185075854.db2.gz	NJDAHRFTRCEKOQ-DOTOQJQBSA-N	1	1	290.382	2.373	40	0		CEABMO
Fc1cccc(O[C@@H]2C[C@H]3CN(CC4CC4)CC[N@@H+]3C2)c1	ZINC000096055157	185075856	/nfs/dbraw/zinc/07/58/56/185075856.db2.gz	NJDAHRFTRCEKOQ-DOTOQJQBSA-N	1	1	290.382	2.373	40	0		CEABMO
Fc1cccc(O[C@@H]2C[C@H]3CN(CC4CC4)CC[N@H+]3C2)c1	ZINC000096055157	185075858	/nfs/dbraw/zinc/07/58/58/185075858.db2.gz	NJDAHRFTRCEKOQ-DOTOQJQBSA-N	1	1	290.382	2.373	40	0		CEABMO
COC[C@@H]1C[N@H+](Cc2ccsc2)Cc2cnn(C)c21	ZINC000096060007	185080008	/nfs/dbraw/zinc/08/00/08/185080008.db2.gz	QSYPAZNVGBFQFQ-ZDUSSCGKSA-N	1	1	277.393	2.227	40	0		CEABMO
COC[C@@H]1C[N@@H+](Cc2ccsc2)Cc2cnn(C)c21	ZINC000096060007	185080010	/nfs/dbraw/zinc/08/00/10/185080010.db2.gz	QSYPAZNVGBFQFQ-ZDUSSCGKSA-N	1	1	277.393	2.227	40	0		CEABMO
C[N@H+]1CCC[C@@]2(CCN(C(=O)c3ccsc3)C2)C1	ZINC000096071569	185086291	/nfs/dbraw/zinc/08/62/91/185086291.db2.gz	XCLXNTAOOWJNGR-CQSZACIVSA-N	1	1	264.394	2.306	40	0		CEABMO
CCNc1nc(N2CCc3ccccc3[C@H]2C)cc[nH+]1	ZINC000328965263	136377037	/nfs/dbraw/zinc/37/70/37/136377037.db2.gz	CCBTXCNSJYCOIO-GFCCVEGCSA-N	1	1	268.364	2.454	40	0		CEABMO
CC(C)(C)OC(=O)N[C@@H](C(=[NH2+])NO)c1cccs1	ZINC000409438530	344889686	/nfs/dbraw/zinc/88/96/86/344889686.db2.gz	CYCSEVSITFMWOA-MRVPVSSYSA-N	1	1	271.342	2.270	40	0		CEABMO
CO[C@@]1(COc2ccccc2)CC[N@H+](Cc2c[nH]cn2)C1	ZINC000585275127	345009680	/nfs/dbraw/zinc/00/96/80/345009680.db2.gz	XTKUIHKQHUARDO-INIZCTEOSA-N	1	1	287.363	2.080	40	0		CEABMO
CO[C@@]1(COc2ccccc2)CC[N@@H+](Cc2c[nH]cn2)C1	ZINC000585275127	345009683	/nfs/dbraw/zinc/00/96/83/345009683.db2.gz	XTKUIHKQHUARDO-INIZCTEOSA-N	1	1	287.363	2.080	40	0		CEABMO
Cc1ccccc1C[C@H]1CC[N@H+](Cc2c[nH]cn2)C[C@H]1O	ZINC000585279832	345009736	/nfs/dbraw/zinc/00/97/36/345009736.db2.gz	ZLMMOIJULRHYFT-NVXWUHKLSA-N	1	1	285.391	2.144	40	0		CEABMO
Cc1ccccc1C[C@H]1CC[N@@H+](Cc2c[nH]cn2)C[C@H]1O	ZINC000585279832	345009737	/nfs/dbraw/zinc/00/97/37/345009737.db2.gz	ZLMMOIJULRHYFT-NVXWUHKLSA-N	1	1	285.391	2.144	40	0		CEABMO
Cc1ccccc1C[C@H]1CC[N@H+](Cc2cnc[nH]2)C[C@H]1O	ZINC000585279832	345009739	/nfs/dbraw/zinc/00/97/39/345009739.db2.gz	ZLMMOIJULRHYFT-NVXWUHKLSA-N	1	1	285.391	2.144	40	0		CEABMO
Cc1ccccc1C[C@H]1CC[N@@H+](Cc2cnc[nH]2)C[C@H]1O	ZINC000585279832	345009741	/nfs/dbraw/zinc/00/97/41/345009741.db2.gz	ZLMMOIJULRHYFT-NVXWUHKLSA-N	1	1	285.391	2.144	40	0		CEABMO
O[C@@H]1C[N@@H+](Cc2ccc[nH]2)C[C@]12C[C@H](c1ccccc1)CO2	ZINC000585292105	345010421	/nfs/dbraw/zinc/01/04/21/345010421.db2.gz	XKKUELFLKQUNJT-CGTJXYLNSA-N	1	1	298.386	2.134	40	0		CEABMO
c1cnc(NC2CC3(C2)CC[N@H+](Cc2cccnc2)C3)nc1	ZINC000108528352	186221499	/nfs/dbraw/zinc/22/14/99/186221499.db2.gz	PXOOWTQXGHRPLO-UHFFFAOYSA-N	1	1	295.390	2.338	40	0		CEABMO
OCC[N@H+]1CCC[C@@H]1CN(Cc1ccccc1)C1CC1	ZINC000079414361	363596659	/nfs/dbraw/zinc/59/66/59/363596659.db2.gz	ZXMYKCCVNPAYGO-QGZVFWFLSA-N	1	1	274.408	2.108	40	0		CEABMO
OCCN1CCC[C@@H]1C[N@H+](Cc1ccccc1)C1CC1	ZINC000079414361	363596665	/nfs/dbraw/zinc/59/66/65/363596665.db2.gz	ZXMYKCCVNPAYGO-QGZVFWFLSA-N	1	1	274.408	2.108	40	0		CEABMO
OCCN1CCC[C@@H]1C[N@@H+](Cc1ccccc1)C1CC1	ZINC000079414361	363596669	/nfs/dbraw/zinc/59/66/69/363596669.db2.gz	ZXMYKCCVNPAYGO-QGZVFWFLSA-N	1	1	274.408	2.108	40	0		CEABMO
C[N@H+]1CCC[C@H](C(=O)Nc2ccc(F)c(F)c2)C1	ZINC000082339217	363767948	/nfs/dbraw/zinc/76/79/48/363767948.db2.gz	NFXDAXSOEKSJRV-VIFPVBQESA-N	1	1	254.280	2.245	40	0		CEABMO
Cc1cccc2cc(C[NH2+]Cc3ccco3)c3nnnn3c12	ZINC000013998134	361446571	/nfs/dbraw/zinc/44/65/71/361446571.db2.gz	WKYRCRBBOCASSL-UHFFFAOYSA-N	1	1	293.330	2.469	40	0		CEABMO
O=C(CCC[NH+]1CCOCC1)Nc1ccc(Cl)cc1	ZINC000019204049	361521095	/nfs/dbraw/zinc/52/10/95/361521095.db2.gz	ODPILOLHSUSYAG-UHFFFAOYSA-N	1	1	282.771	2.391	40	0		CEABMO
COc1cccc(CN2C[C@@H]3CCC[N@H+]3C[C@@H]2C)c1	ZINC000019575780	361543413	/nfs/dbraw/zinc/54/34/13/361543413.db2.gz	YWXCEYSSIJOVDP-ZFWWWQNUSA-N	1	1	260.381	2.364	40	0		CEABMO
CCOC(=O)N1CC[NH+](Cc2c[nH]c3ccccc23)CC1	ZINC000027417049	361652847	/nfs/dbraw/zinc/65/28/47/361652847.db2.gz	IWSHHUVABSTWOO-UHFFFAOYSA-N	1	1	287.363	2.442	40	0		CEABMO
CO[C@@H]1CC[C@H]2[C@H]1OCC[N@H+]2Cc1ccc(C)s1	ZINC000096057760	364399791	/nfs/dbraw/zinc/39/97/91/364399791.db2.gz	KQWWXAYANNAFOW-BFHYXJOUSA-N	1	1	267.394	2.435	40	0		CEABMO
c1ccc2c(c1)[C@@H]1C[N@@H+](CC3CC3)C[C@@H]1[C@H]2N1CCOCC1	ZINC000096058354	364400027	/nfs/dbraw/zinc/40/00/27/364400027.db2.gz	JFFKPXSIPRWKCA-FHWLQOOXSA-N	1	1	298.430	2.499	40	0		CEABMO
CC(C)[C@H]1CO[C@]2(CC[N@@H+](Cc3cnn(C)c3)C2)C1	ZINC000096218244	364412437	/nfs/dbraw/zinc/41/24/37/364412437.db2.gz	ODYKVAIZCSTCFV-HUUCEWRRSA-N	1	1	263.385	2.057	40	0		CEABMO
COC[C@H]1C[N@H+](C)C[C@@]12CCN(Cc1sccc1C)C2	ZINC000096219841	364413303	/nfs/dbraw/zinc/41/33/03/364413303.db2.gz	JCWZMNMZPIKEIM-GDBMZVCRSA-N	1	1	294.464	2.457	40	0		CEABMO
COC[C@H]1C[N@@H+](C)C[C@@]12CCN(Cc1sccc1C)C2	ZINC000096219841	364413308	/nfs/dbraw/zinc/41/33/08/364413308.db2.gz	JCWZMNMZPIKEIM-GDBMZVCRSA-N	1	1	294.464	2.457	40	0		CEABMO
COC[C@H]1CN(C)C[C@@]12CC[N@H+](Cc1sccc1C)C2	ZINC000096219841	364413311	/nfs/dbraw/zinc/41/33/11/364413311.db2.gz	JCWZMNMZPIKEIM-GDBMZVCRSA-N	1	1	294.464	2.457	40	0		CEABMO
COC[C@H]1CN(C)C[C@@]12CC[N@@H+](Cc1sccc1C)C2	ZINC000096219841	364413315	/nfs/dbraw/zinc/41/33/15/364413315.db2.gz	JCWZMNMZPIKEIM-GDBMZVCRSA-N	1	1	294.464	2.457	40	0		CEABMO
COc1nn(C)c2c1CCC[N@H+](Cc1cccs1)C2	ZINC000096254420	364416387	/nfs/dbraw/zinc/41/63/87/364416387.db2.gz	MNBPRFNTUIBWIK-UHFFFAOYSA-N	1	1	277.393	2.439	40	0		CEABMO
COc1nn(C)c2c1CCC[N@@H+](Cc1cccs1)C2	ZINC000096254420	364416398	/nfs/dbraw/zinc/41/63/98/364416398.db2.gz	MNBPRFNTUIBWIK-UHFFFAOYSA-N	1	1	277.393	2.439	40	0		CEABMO
C[N@H+]1CC[C@@H]2OCCC[C@@]2(COc2ncccc2F)C1	ZINC000248021971	371155517	/nfs/dbraw/zinc/15/55/17/371155517.db2.gz	JDMVDVDTOQKFQM-ZFWWWQNUSA-N	1	1	280.343	2.100	40	0		CEABMO
Cc1c[nH]nc1[C@H]1CC[N@@H+](Cc2ncccc2C)C1	ZINC000257224483	190015106	/nfs/dbraw/zinc/01/51/06/190015106.db2.gz	FBZNHWVFLUHMOC-ZDUSSCGKSA-N	1	1	256.353	2.411	40	0		CEABMO
O[C@H]1C[N@@H+](Cc2ccc3cc[nH]c3c2)CC[C@@]12CCCO2	ZINC000257226188	190015271	/nfs/dbraw/zinc/01/52/71/190015271.db2.gz	FJMZZACRXRXYJY-IRXDYDNUSA-N	1	1	286.375	2.284	40	0		CEABMO
Cc1cncc([C@@H]2CCC[N@@H+](CC3CCOCC3)C2)n1	ZINC000257255410	190020688	/nfs/dbraw/zinc/02/06/88/190020688.db2.gz	KHIXFXBGUXBKAV-OAHLLOKOSA-N	1	1	275.396	2.391	40	0		CEABMO
Cc1cn(C)c([C@H]2CCC[N@@H+](Cc3cnc(C)nc3)C2)n1	ZINC000257238171	190017920	/nfs/dbraw/zinc/01/79/20/190017920.db2.gz	HJWJDRNPCMHCGK-HNNXBMFYSA-N	1	1	285.395	2.207	40	0		CEABMO
Cc1nccc([C@H]2C[N@@H+](C3CCCCC3)CCO2)n1	ZINC000257278491	190025490	/nfs/dbraw/zinc/02/54/90/190025490.db2.gz	OCLOVHRDXQERQP-OAHLLOKOSA-N	1	1	261.369	2.491	40	0		CEABMO
Cc1nccc([C@H]2C[N@H+](C3CCCCC3)CCO2)n1	ZINC000257278491	190025491	/nfs/dbraw/zinc/02/54/91/190025491.db2.gz	OCLOVHRDXQERQP-OAHLLOKOSA-N	1	1	261.369	2.491	40	0		CEABMO
O[C@H]1CCCOC12CC[NH+](Cc1cc(F)ccc1F)CC2	ZINC000257282870	190026249	/nfs/dbraw/zinc/02/62/49/190026249.db2.gz	OVQAIWBYJHKITB-HNNXBMFYSA-N	1	1	297.345	2.471	40	0		CEABMO
Cc1c[nH]nc1[C@@H]1CC[N@@H+](Cc2ccc(C)nc2)C1	ZINC000257285045	190027349	/nfs/dbraw/zinc/02/73/49/190027349.db2.gz	PFKBCBBBYLFGGM-CQSZACIVSA-N	1	1	256.353	2.411	40	0		CEABMO
Cc1cc(-c2cnc(C[C@@H]3CC[N@H+](C(C)C)C3)cn2)n[nH]1	ZINC000257273979	190025031	/nfs/dbraw/zinc/02/50/31/190025031.db2.gz	NJAHNQXYGRUQGL-ZDUSSCGKSA-N	1	1	285.395	2.448	40	0		CEABMO
C[N@H+]1C[C@@H](c2cc(F)cc(F)c2)[C@]2(C1)CCCCC(=O)N2	ZINC000257293751	190028434	/nfs/dbraw/zinc/02/84/34/190028434.db2.gz	QQZVLBQBFHCMPO-GOEBONIOSA-N	1	1	294.345	2.423	40	0		CEABMO
Cc1cn(C)c([C@@H]2CC[N@@H+](Cc3csc(C)n3)C2)n1	ZINC000257297133	190029874	/nfs/dbraw/zinc/02/98/74/190029874.db2.gz	RGAJMTQBBKDDOS-GFCCVEGCSA-N	1	1	276.409	2.483	40	0		CEABMO
Cc1cc(-c2nccnc2C[C@@H]2CCC[N@H+](C)C2)n[nH]1	ZINC000257328770	190034559	/nfs/dbraw/zinc/03/45/59/190034559.db2.gz	XHBAJTIFIIVBCR-LBPRGKRZSA-N	1	1	271.368	2.059	40	0		CEABMO
CCn1cc(-c2cnc([C@@H]3CCC[N@@H+](C)C3)cn2)cn1	ZINC000257331824	190035371	/nfs/dbraw/zinc/03/53/71/190035371.db2.gz	XUKPQCADAVDZTB-GFCCVEGCSA-N	1	1	271.368	2.169	40	0		CEABMO
COc1ccccc1[C@@H]1CN(C(C)=O)CC[N@@H+]1CC1CC1	ZINC000257333293	190035555	/nfs/dbraw/zinc/03/55/55/190035555.db2.gz	YAZIIVBFCILWHQ-INIZCTEOSA-N	1	1	288.391	2.310	40	0		CEABMO
COc1ccccc1[C@@H]1CN(C(C)=O)CC[N@H+]1CC1CC1	ZINC000257333293	190035556	/nfs/dbraw/zinc/03/55/56/190035556.db2.gz	YAZIIVBFCILWHQ-INIZCTEOSA-N	1	1	288.391	2.310	40	0		CEABMO
O[C@H]1CC[N@@H+](CC2CCOCC2)[C@H]1Cc1ccccc1	ZINC000306128231	376541055	/nfs/dbraw/zinc/54/10/55/376541055.db2.gz	GUUZJJLCXBFHHS-IRXDYDNUSA-N	1	1	275.392	2.091	40	0		CEABMO
Cc1cccc(N2CC[C@H]3[C@H]2CCN3c2ncccn2)[nH+]1	ZINC000306124042	376541223	/nfs/dbraw/zinc/54/12/23/376541223.db2.gz	BEABPCHWYLZVKL-KGLIPLIRSA-N	1	1	281.363	2.038	40	0		CEABMO
O=C1c2ccccc2[C@H]2C[N@@H+](C3CCCC3)CCN12	ZINC000096088818	285026896	/nfs/dbraw/zinc/02/68/96/285026896.db2.gz	BSAUWOOWEHWNAT-OAHLLOKOSA-N	1	1	256.349	2.442	40	0		CEABMO
OCC[N@H+]1CCCC[C@@H]1CN(Cc1ccccc1)C1CC1	ZINC000079414407	285259087	/nfs/dbraw/zinc/25/90/87/285259087.db2.gz	IRGAEBXJYHMMRC-GOSISDBHSA-N	1	1	288.435	2.498	40	0		CEABMO
OCCN1CCCC[C@@H]1C[N@H+](Cc1ccccc1)C1CC1	ZINC000079414407	285259089	/nfs/dbraw/zinc/25/90/89/285259089.db2.gz	IRGAEBXJYHMMRC-GOSISDBHSA-N	1	1	288.435	2.498	40	0		CEABMO
OCCN1CCCC[C@@H]1C[N@@H+](Cc1ccccc1)C1CC1	ZINC000079414407	285259090	/nfs/dbraw/zinc/25/90/90/285259090.db2.gz	IRGAEBXJYHMMRC-GOSISDBHSA-N	1	1	288.435	2.498	40	0		CEABMO
Cc1nc2c(c(=O)[nH]1)CC[N@@H+](CC1CCCCC1)C2	ZINC000019576573	394468450	/nfs/dbraw/zinc/46/84/50/394468450.db2.gz	KACCRSKZQOGAEM-UHFFFAOYSA-N	1	1	261.369	2.429	40	0		CEABMO
Cc1cc(-c2cc(C)nc([C@@H]3CCC[N@H+](C)C3)n2)n[nH]1	ZINC000257258287	394595582	/nfs/dbraw/zinc/59/55/82/394595582.db2.gz	KTEIRCCEZJDBSZ-GFCCVEGCSA-N	1	1	271.368	2.293	40	0		CEABMO
COc1cccc([C@H]2[C@H]([NH3+])C(=O)N2c2cccc(F)c2)c1	ZINC000072227627	394596633	/nfs/dbraw/zinc/59/66/33/394596633.db2.gz	JCCNXIYOKNTTFY-GJZGRUSLSA-N	1	1	286.306	2.250	40	0		CEABMO
CC(C)C[N@@H+](Cc1ccccc1)[C@H]1CCS(=O)(=O)C1	ZINC000072953121	394602487	/nfs/dbraw/zinc/60/24/87/394602487.db2.gz	GNNRZPHFKMGXRH-HNNXBMFYSA-N	1	1	281.421	2.332	40	0		CEABMO
CC(C)N(C[C@@H]1CCC[N@H+]1CCO)C(=O)OC(C)(C)C	ZINC000079408072	394631322	/nfs/dbraw/zinc/63/13/22/394631322.db2.gz	ZHVLTSMOZCQNNF-ZDUSSCGKSA-N	1	1	286.416	2.089	40	0		CEABMO
CCn1ncc2c1[C@H](COC)C[N@H+](Cc1ccncc1)C2	ZINC000096060155	394675807	/nfs/dbraw/zinc/67/58/07/394675807.db2.gz	JNQROEFXPBSUOZ-HNNXBMFYSA-N	1	1	286.379	2.044	40	0		CEABMO
CCn1ncc2c1[C@H](COC)C[N@@H+](Cc1ccncc1)C2	ZINC000096060155	394675813	/nfs/dbraw/zinc/67/58/13/394675813.db2.gz	JNQROEFXPBSUOZ-HNNXBMFYSA-N	1	1	286.379	2.044	40	0		CEABMO
COC[C@@]12CCO[C@@H]1CC[N@@H+](Cc1ccc(F)cc1)C2	ZINC000096110320	394677237	/nfs/dbraw/zinc/67/72/37/394677237.db2.gz	BOLQCTQFBZFHBM-CVEARBPZSA-N	1	1	279.355	2.453	40	0		CEABMO
CC[NH+]1CCN(C(=S)Nc2ccc(C)cc2)CC1	ZINC000007522485	170288366	/nfs/dbraw/zinc/28/83/66/170288366.db2.gz	XTKNGWQKBXLJCW-UHFFFAOYSA-N	1	1	263.410	2.329	40	0		CEABMO
CC[NH+]1CCN(C(=O)CCc2ccc(C)cc2)CC1	ZINC000022914100	171403064	/nfs/dbraw/zinc/40/30/64/171403064.db2.gz	PLVPKCIOSCLIPA-UHFFFAOYSA-N	1	1	260.381	2.092	40	0		CEABMO
CN1CC[NH2+][C@@H](Cc2ccccc2-c2ccc(F)cc2)C1=O	ZINC000072352868	176374288	/nfs/dbraw/zinc/37/42/88/176374288.db2.gz	BMGOLDSFODAARR-KRWDZBQOSA-N	1	1	298.361	2.465	40	0		CEABMO
CCN1CC[NH2+][C@@H](Cc2ccc(-c3ccncc3)cc2)C1=O	ZINC000072352884	176374311	/nfs/dbraw/zinc/37/43/11/176374311.db2.gz	JYASSLXGEUNJDX-KRWDZBQOSA-N	1	1	295.386	2.111	40	0		CEABMO
CC(=O)N1CC[N@@H+](C)C[C@@H]1c1ccc(OC(C)C)cc1	ZINC000072366537	176381550	/nfs/dbraw/zinc/38/15/50/176381550.db2.gz	QKFYPKYFWDZVLV-MRXNPFEDSA-N	1	1	276.380	2.309	40	0		CEABMO
CC(=O)N1CC[N@H+](C)C[C@@H]1c1ccc(OC(C)C)cc1	ZINC000072366537	176381551	/nfs/dbraw/zinc/38/15/51/176381551.db2.gz	QKFYPKYFWDZVLV-MRXNPFEDSA-N	1	1	276.380	2.309	40	0		CEABMO
Cc1nc(C(=O)N2CCC[C@H](Cn3cc[nH+]c3C)C2)co1	ZINC000072368587	176383831	/nfs/dbraw/zinc/38/38/31/176383831.db2.gz	ILMNNHYUYBBMAO-CYBMUJFWSA-N	1	1	288.351	2.040	40	0		CEABMO
C[N@H+]1CCC[C@@H](c2ccnc(C(=O)N3CCCC3)c2)C1	ZINC000072387015	176392892	/nfs/dbraw/zinc/39/28/92/176392892.db2.gz	MUKRORNPQQABBI-CQSZACIVSA-N	1	1	273.380	2.127	40	0		CEABMO
CCOC(=O)C1CC[NH+](c2ccc(N)cc2C)CC1	ZINC000216931604	276275031	/nfs/dbraw/zinc/27/50/31/276275031.db2.gz	VKDMHLJGFYFGKA-UHFFFAOYSA-N	1	1	262.353	2.357	40	0		CEABMO
CC(=O)Nc1ccc(CN2C[C@H]3CCC[N@@H+]3C[C@H]2C)cc1	ZINC000072397534	277074935	/nfs/dbraw/zinc/07/49/35/277074935.db2.gz	KRPIUDZFESOZPM-CXAGYDPISA-N	1	1	287.407	2.314	40	0		CEABMO
Clc1ccc2c(c1)N[C@@H]([C@@H]1CCOC1)N1CC[NH+]=C21	ZINC000012188526	279292741	/nfs/dbraw/zinc/29/27/41/279292741.db2.gz	LRZYVJLYMHUBMS-NOZJJQNGSA-N	1	1	277.755	2.190	40	0		CEABMO
Cc1ccc2c(n1)N(C)CC[N@H+](Cc1ccoc1)C2	ZINC000248058893	281136946	/nfs/dbraw/zinc/13/69/46/281136946.db2.gz	UCPMORWLBXTPCE-UHFFFAOYSA-N	1	1	257.337	2.435	40	0		CEABMO
Cc1ccc2c(n1)N(C)CC[N@@H+](Cc1ccoc1)C2	ZINC000248058893	281136951	/nfs/dbraw/zinc/13/69/51/281136951.db2.gz	UCPMORWLBXTPCE-UHFFFAOYSA-N	1	1	257.337	2.435	40	0		CEABMO
COc1cccc([C@@H]([NH3+])c2nnc(CC(C)C)[nH]2)c1	ZINC000095533606	185006251	/nfs/dbraw/zinc/00/62/51/185006251.db2.gz	STBODSMQBMTFRE-CYBMUJFWSA-N	1	1	260.341	2.060	40	0		CEABMO
COc1ccc(-c2n[nH]c([C@H]([NH3+])C(C)C)n2)cc1OC	ZINC000095534771	185007956	/nfs/dbraw/zinc/00/79/56/185007956.db2.gz	PUFOZBXKMPUDOR-GFCCVEGCSA-N	1	1	276.340	2.145	40	0		CEABMO
[NH3+][C@H](Cc1ccccc1)c1nc(-c2ccc(O)cc2)n[nH]1	ZINC000095534849	185008039	/nfs/dbraw/zinc/00/80/39/185008039.db2.gz	ZYSYUSDORFFEJK-CQSZACIVSA-N	1	1	280.331	2.420	40	0		CEABMO
COC[C@@]12CCCO[C@@H]1CC[N@H+](Cc1nccs1)C2	ZINC000096038980	185068681	/nfs/dbraw/zinc/06/86/81/185068681.db2.gz	ICEGIXBQEWTQGY-OCCSQVGLSA-N	1	1	282.409	2.161	40	0		CEABMO
COC[C@@]12CCCO[C@@H]1CC[N@@H+](Cc1nccs1)C2	ZINC000096038980	185068682	/nfs/dbraw/zinc/06/86/82/185068682.db2.gz	ICEGIXBQEWTQGY-OCCSQVGLSA-N	1	1	282.409	2.161	40	0		CEABMO
CC[C@H]1[N@@H+](C)CCC[C@]12CCC(=O)N2Cc1ccncc1	ZINC000096045697	185071753	/nfs/dbraw/zinc/07/17/53/185071753.db2.gz	YMLYZPJBXUMTSQ-WBVHZDCISA-N	1	1	287.407	2.447	40	0		CEABMO
C[N@H+]1CCC[C@@]2(CN(Cc3cccs3)CCO2)C1	ZINC000096049060	185072945	/nfs/dbraw/zinc/07/29/45/185072945.db2.gz	KPDQBGYWMBSKGJ-AWEZNQCLSA-N	1	1	266.410	2.045	40	0		CEABMO
Cc1nc(CN2C(=O)C[C@@H]3[C@@H]2CC[N@H+]3CC2CC2)cs1	ZINC000096055656	185075536	/nfs/dbraw/zinc/07/55/36/185075536.db2.gz	NGLOSXBJQSNQAH-UONOGXRCSA-N	1	1	291.420	2.037	40	0		CEABMO
OC[C@H]1C[N@@H+](Cc2ccccc2)CCN1Cc1ccccc1	ZINC000034064128	361787652	/nfs/dbraw/zinc/78/76/52/361787652.db2.gz	SOUPGWGAPDMYFM-LJQANCHMSA-N	1	1	296.414	2.365	40	0		CEABMO
OC[C@H]1CN(Cc2ccccc2)CC[N@@H+]1Cc1ccccc1	ZINC000034064128	361787657	/nfs/dbraw/zinc/78/76/57/361787657.db2.gz	SOUPGWGAPDMYFM-LJQANCHMSA-N	1	1	296.414	2.365	40	0		CEABMO
OC[C@H]1CN(Cc2ccccc2)CC[N@H+]1Cc1ccccc1	ZINC000034064128	361787663	/nfs/dbraw/zinc/78/76/63/361787663.db2.gz	SOUPGWGAPDMYFM-LJQANCHMSA-N	1	1	296.414	2.365	40	0		CEABMO
c1csc(CN2CC[N@H+]3C[C@H](OCC4CC4)C[C@@H]3C2)c1	ZINC000096054991	185076756	/nfs/dbraw/zinc/07/67/56/185076756.db2.gz	NRAXYOAGABLPCC-HUUCEWRRSA-N	1	1	292.448	2.433	40	0		CEABMO
C[C@H]1C(=O)NC[C@H]2C[N@H+](Cc3ccc4ccccc4n3)C[C@H]21	ZINC000096100625	185098262	/nfs/dbraw/zinc/09/82/62/185098262.db2.gz	KXJOLSSIYMRVEJ-INWMFGNUSA-N	1	1	295.386	2.049	40	0		CEABMO
CC(C)(C)NC(=S)N1CC[NH+](Cc2ccccc2)CC1	ZINC000054921964	343595862	/nfs/dbraw/zinc/59/58/62/343595862.db2.gz	LGLDWAQRUVSQLK-UHFFFAOYSA-N	1	1	291.464	2.477	40	0		CEABMO
Fc1ccc2[nH]c([C@H]3CC[N@H+](Cc4ncc[nH]4)C3)nc2c1	ZINC000049169023	362343009	/nfs/dbraw/zinc/34/30/09/362343009.db2.gz	UCJAHDPBOBXGTB-JTQLQIEISA-N	1	1	285.326	2.415	40	0	biogenic,in-vitro	CEABMO
Fc1ccc2[nH]c([C@H]3CC[N@@H+](Cc4ncc[nH]4)C3)nc2c1	ZINC000049169023	362343011	/nfs/dbraw/zinc/34/30/11/362343011.db2.gz	UCJAHDPBOBXGTB-JTQLQIEISA-N	1	1	285.326	2.415	40	0	biogenic,in-vitro	CEABMO
CC(C)(C)c1cc(CN2CCCC[C@H]2C[NH3+])n[nH]1	ZINC000096523571	344240382	/nfs/dbraw/zinc/24/03/82/344240382.db2.gz	HYSSLUMJEPOROM-LBPRGKRZSA-N	1	1	250.390	2.020	40	0		CEABMO
COC(=O)[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C1CC1	ZINC000143407359	344405775	/nfs/dbraw/zinc/40/57/75/344405775.db2.gz	ZDMJGGAGLPQNCB-CABCVRRESA-N	1	1	259.349	2.318	40	0		CEABMO
CCC[NH+](CCC)CN1C(=O)c2ccccc2C1=O	ZINC000053204530	362487406	/nfs/dbraw/zinc/48/74/06/362487406.db2.gz	MQRWFRAFKLPMBJ-UHFFFAOYSA-N	1	1	260.337	2.362	40	0		CEABMO
CC(C)(C)OC(=O)N[C@H](C(=[NH2+])NO)c1cccs1	ZINC000409438536	344889637	/nfs/dbraw/zinc/88/96/37/344889637.db2.gz	CYCSEVSITFMWOA-QMMMGPOBSA-N	1	1	271.342	2.270	40	0		CEABMO
Cc1nccc(C[N@H+]2CC[C@H](O)[C@H](Cc3ccccc3)C2)n1	ZINC000585268889	345009354	/nfs/dbraw/zinc/00/93/54/345009354.db2.gz	CSAVEWRVFHHDQO-AEFFLSMTSA-N	1	1	297.402	2.211	40	0		CEABMO
Cc1ccccc1C[C@H]1CC[N@@H+](Cc2cn(C)cn2)C[C@H]1O	ZINC000585280062	345009844	/nfs/dbraw/zinc/00/98/44/345009844.db2.gz	XQEBUFURPVGLDO-SJLPKXTDSA-N	1	1	299.418	2.154	40	0		CEABMO
Cc1ccccc1C[C@H]1CC[N@H+](Cc2cn(C)cn2)C[C@H]1O	ZINC000585280062	345009847	/nfs/dbraw/zinc/00/98/47/345009847.db2.gz	XQEBUFURPVGLDO-SJLPKXTDSA-N	1	1	299.418	2.154	40	0		CEABMO
CO[C@]1(COc2ccccc2)CC[N@H+](Cc2c[nH]cn2)C1	ZINC000585275128	345009887	/nfs/dbraw/zinc/00/98/87/345009887.db2.gz	XTKUIHKQHUARDO-MRXNPFEDSA-N	1	1	287.363	2.080	40	0		CEABMO
CO[C@]1(COc2ccccc2)CC[N@@H+](Cc2c[nH]cn2)C1	ZINC000585275128	345009888	/nfs/dbraw/zinc/00/98/88/345009888.db2.gz	XTKUIHKQHUARDO-MRXNPFEDSA-N	1	1	287.363	2.080	40	0		CEABMO
CC(C)(C)OC(=O)N[C@@H]1CC[N@@H+](CC2CCC2)C1	ZINC000067800945	362925463	/nfs/dbraw/zinc/92/54/63/362925463.db2.gz	JAEIGTZUFFYNQO-GFCCVEGCSA-N	1	1	254.374	2.386	40	0		CEABMO
COC[C@@]12CCCO[C@@H]1CC[N@@H+](Cc1c(C)noc1C)C2	ZINC000107711051	186188072	/nfs/dbraw/zinc/18/80/72/186188072.db2.gz	GZUKRQBPKZRFIF-CVEARBPZSA-N	1	1	294.395	2.309	40	0		CEABMO
O=C([C@@H]1CCC[C@@]12CC[N@@H+](CC1CC1)C2)N1CC(F)(F)C1	ZINC000108531114	186222208	/nfs/dbraw/zinc/22/22/08/186222208.db2.gz	HKEHDJZHPRFTIW-ZFWWWQNUSA-N	1	1	298.377	2.366	40	0		CEABMO
CC[N@@H+](CCO)C[C@H]1CCCCN1Cc1ccccc1	ZINC000079393518	363594570	/nfs/dbraw/zinc/59/45/70/363594570.db2.gz	MTUJIOUUKYCJHE-QGZVFWFLSA-N	1	1	276.424	2.355	40	0		CEABMO
CCN(CCO)C[C@H]1CCCC[N@@H+]1Cc1ccccc1	ZINC000079393518	363594575	/nfs/dbraw/zinc/59/45/75/363594575.db2.gz	MTUJIOUUKYCJHE-QGZVFWFLSA-N	1	1	276.424	2.355	40	0		CEABMO
CCN(CCO)C[C@H]1CCCC[N@H+]1Cc1ccccc1	ZINC000079393518	363594581	/nfs/dbraw/zinc/59/45/81/363594581.db2.gz	MTUJIOUUKYCJHE-QGZVFWFLSA-N	1	1	276.424	2.355	40	0		CEABMO
CC(C)(C)OC(=O)N(C[C@@H]1CCC[N@@H+](CCO)C1)C1CC1	ZINC000079408227	363596221	/nfs/dbraw/zinc/59/62/21/363596221.db2.gz	GVONRHMNXDNATN-CYBMUJFWSA-N	1	1	298.427	2.090	40	0		CEABMO
CCN(CC)C(=O)COC[C@@H]1CCC[N@H+]2CCCC[C@H]12	ZINC000005708326	361335489	/nfs/dbraw/zinc/33/54/89/361335489.db2.gz	YXGLGZVQMGKEBH-LSDHHAIUSA-N	1	1	282.428	2.136	40	0		CEABMO
CCc1ncc(C[N@H+](CCO)Cc2cccs2)cn1	ZINC000013997520	361446581	/nfs/dbraw/zinc/44/65/81/361446581.db2.gz	GIZLAXMILKYPQG-UHFFFAOYSA-N	1	1	277.393	2.095	40	0		CEABMO
CCc1ncc(C[N@@H+](CCO)Cc2cccs2)cn1	ZINC000013997520	361446584	/nfs/dbraw/zinc/44/65/84/361446584.db2.gz	GIZLAXMILKYPQG-UHFFFAOYSA-N	1	1	277.393	2.095	40	0		CEABMO
Cc1nc([C@H]2CC[N@@H+](Cc3cccc(F)c3)C2)cc(=O)[nH]1	ZINC000019285256	361526554	/nfs/dbraw/zinc/52/65/54/361526554.db2.gz	QFQXWYAXZGLQQN-ZDUSSCGKSA-N	1	1	287.338	2.207	40	0		CEABMO
COc1ccccc1CN1C[C@@H]2CCC[N@H+]2C[C@H]1C	ZINC000019575160	361543353	/nfs/dbraw/zinc/54/33/53/361543353.db2.gz	KCENCVINDMTRRT-HIFRSBDPSA-N	1	1	260.381	2.364	40	0		CEABMO
Cc1ccc2c(n1)N(C)CC[N@H+](Cc1ccco1)C2	ZINC000096198997	364408910	/nfs/dbraw/zinc/40/89/10/364408910.db2.gz	IJXJPSSJGHNYAJ-UHFFFAOYSA-N	1	1	257.337	2.435	40	0		CEABMO
Cc1ccc2c(n1)N(C)CC[N@@H+](Cc1ccco1)C2	ZINC000096198997	364408912	/nfs/dbraw/zinc/40/89/12/364408912.db2.gz	IJXJPSSJGHNYAJ-UHFFFAOYSA-N	1	1	257.337	2.435	40	0		CEABMO
COC[C@@H]1CCC[C@]12C[N@H+](Cc1c(C)noc1C)CCO2	ZINC000096160842	364403377	/nfs/dbraw/zinc/40/33/77/364403377.db2.gz	PFGVIWBUHPDZET-HOCLYGCPSA-N	1	1	294.395	2.309	40	0		CEABMO
COC[C@@H]1CCC[C@]12C[N@@H+](Cc1c(C)noc1C)CCO2	ZINC000096160842	364403381	/nfs/dbraw/zinc/40/33/81/364403381.db2.gz	PFGVIWBUHPDZET-HOCLYGCPSA-N	1	1	294.395	2.309	40	0		CEABMO
C[N@H+]1CC[C@@]2(C1)CCC[C@H](CNC(=O)c1ccsc1)O2	ZINC000096206742	364410134	/nfs/dbraw/zinc/41/01/34/364410134.db2.gz	BAIYODQYLBSSFB-UKRRQHHQSA-N	1	1	294.420	2.121	40	0		CEABMO
C[N@H+]1CCC[C@]2(CCN(C(=O)Cc3ccccc3)C2)C1	ZINC000096268564	364420173	/nfs/dbraw/zinc/42/01/73/364420173.db2.gz	UJMUZCMSWUNXBD-KRWDZBQOSA-N	1	1	272.392	2.173	40	0		CEABMO
Cn1c2ccccc2nc1CN1CC[C@@]2(C1)CCC[N@@H+](C)C2	ZINC000096268578	364420701	/nfs/dbraw/zinc/42/07/01/364420701.db2.gz	KORVTTKRNXMDIQ-SFHVURJKSA-N	1	1	298.434	2.491	40	0		CEABMO
CC(C)C[N@H+]1CCC[C@@]2(CCC(=O)N2CCF)CC1	ZINC000585099886	367177357	/nfs/dbraw/zinc/17/73/57/367177357.db2.gz	QMRFDJXCMSEMFP-OAHLLOKOSA-N	1	1	270.392	2.459	40	0		CEABMO
COCC[C@@H]1C[N@@H+](CC2CCCC2)Cc2ccnn21	ZINC000247910884	371146721	/nfs/dbraw/zinc/14/67/21/371146721.db2.gz	YHUCIBRRKZUYDG-OAHLLOKOSA-N	1	1	263.385	2.467	40	0		CEABMO
COc1ccc(C[NH2+]Cc2ccn(CCF)n2)cc1	ZINC000256054994	190005465	/nfs/dbraw/zinc/00/54/65/190005465.db2.gz	YRSHQZXTTOMXMU-UHFFFAOYSA-N	1	1	263.316	2.151	40	0		CEABMO
CCCn1cc(C[NH2+]Cc2cc(C)nn2CCC)cn1	ZINC000256055118	190005661	/nfs/dbraw/zinc/00/56/61/190005661.db2.gz	ZHDFSSSVUAKIBK-UHFFFAOYSA-N	1	1	275.400	2.498	40	0		CEABMO
Cc1ccnc([C@@H]2CC[N@H+](Cc3cccn3C)C2)n1	ZINC000257212424	190012734	/nfs/dbraw/zinc/01/27/34/190012734.db2.gz	CDIOVHLEUBIEFR-CYBMUJFWSA-N	1	1	256.353	2.113	40	0		CEABMO
Cc1n[nH]cc1-c1cnc(C[C@@H]2CCC[N@H+](C)C2)cn1	ZINC000257257915	190021869	/nfs/dbraw/zinc/02/18/69/190021869.db2.gz	KRPLVXHAIRBZJG-LBPRGKRZSA-N	1	1	271.368	2.059	40	0		CEABMO
Cc1cc(C)nc([C@@H]2CC[N@H+](Cc3cccn3C)C2)n1	ZINC000257260439	190022068	/nfs/dbraw/zinc/02/20/68/190022068.db2.gz	LCVKBGBIUWNSJL-CQSZACIVSA-N	1	1	270.380	2.421	40	0		CEABMO
COc1ccccc1[C@H]1C[N@H+](C2CCOCC2)CCN1C	ZINC000257300781	190029085	/nfs/dbraw/zinc/02/90/85/190029085.db2.gz	RVQPZGCJSLNRQP-MRXNPFEDSA-N	1	1	290.407	2.163	40	0		CEABMO
CCn1nc(C)c(C[N@H+]2CC[C@H](c3cc[nH]n3)C2)c1C	ZINC000257304680	190030689	/nfs/dbraw/zinc/03/06/89/190030689.db2.gz	SMRZFIRWGUQAHL-ZDUSSCGKSA-N	1	1	273.384	2.232	40	0		CEABMO
Nc1nccnc1C[C@H]1CCC[N@@H+](CCC(F)(F)F)C1	ZINC000257341418	190037441	/nfs/dbraw/zinc/03/74/41/190037441.db2.gz	ZKEZVWAKJDAUJU-SNVBAGLBSA-N	1	1	288.317	2.266	40	0		CEABMO
CC(C)n1nccc1C[N@H+]1CC[C@H](c2cc[nH]n2)C1	ZINC000257309926	190032131	/nfs/dbraw/zinc/03/21/31/190032131.db2.gz	UCXWGLNYYFUCHC-LBPRGKRZSA-N	1	1	259.357	2.177	40	0		CEABMO
c1c[nH]c(C[N@@H+]2CCC[C@@H]2CCc2ccncc2)n1	ZINC000257326754	190035179	/nfs/dbraw/zinc/03/51/79/190035179.db2.gz	WYLVITFBMABDTI-CQSZACIVSA-N	1	1	256.353	2.402	40	0		CEABMO
Cc1cc(C[NH+]2CCC(c3ccn4nccc4n3)CC2)no1	ZINC000257337179	190036207	/nfs/dbraw/zinc/03/62/07/190036207.db2.gz	YRSXIWAZTXSALB-UHFFFAOYSA-N	1	1	297.362	2.405	40	0		CEABMO
CC(C)[N@@H+]1CCC[C@H]1c1ccc(N2CCN(C)CC2)nc1	ZINC000072216522	394593738	/nfs/dbraw/zinc/59/37/38/394593738.db2.gz	DBJFHLGKXOWNFC-INIZCTEOSA-N	1	1	288.439	2.379	40	0		CEABMO
CC(C)[N@H+]1CCC[C@H]1c1ccc(N2CCN(C)CC2)nc1	ZINC000072216522	394593743	/nfs/dbraw/zinc/59/37/43/394593743.db2.gz	DBJFHLGKXOWNFC-INIZCTEOSA-N	1	1	288.439	2.379	40	0		CEABMO
CCOC(=O)[C@@H]([NH3+])[C@@H](Nc1ccccc1)C(C)C	ZINC000072210542	394592239	/nfs/dbraw/zinc/59/22/39/394592239.db2.gz	SNMKQNUYWSGTCT-STQMWFEESA-N	1	1	250.342	2.014	40	0		CEABMO
COc1ccc(N2C(=O)[C@H]([NH3+])[C@@H]2c2ccccc2F)cc1	ZINC000072227177	394595423	/nfs/dbraw/zinc/59/54/23/394595423.db2.gz	XKWPSGICQZPRNH-CABCVRRESA-N	1	1	286.306	2.250	40	0		CEABMO
[NH3+][C@H]1C(=O)N(Cc2ccc(F)cc2)[C@H]1c1ccccc1	ZINC000072228181	394596136	/nfs/dbraw/zinc/59/61/36/394596136.db2.gz	AMOPJKHITPCODS-CABCVRRESA-N	1	1	270.307	2.237	40	0		CEABMO
Cc1ccc(N2C(=O)[C@@H]([NH3+])[C@@H]2c2ccc3c(c2)OCO3)cc1	ZINC000072227463	394596169	/nfs/dbraw/zinc/59/61/69/394596169.db2.gz	HHNIEFVQXKKMLP-HOTGVXAUSA-N	1	1	296.326	2.139	40	0		CEABMO
[NH3+][C@@H]1C(=O)N(c2cccc(F)c2)[C@@H]1c1ccccc1	ZINC000072227606	394596463	/nfs/dbraw/zinc/59/64/63/394596463.db2.gz	QPRORUXQTBIEBL-UONOGXRCSA-N	1	1	256.280	2.241	40	0		CEABMO
CC(C)[N@@H+](C)C[C@H]1C[C@@H]2CN(Cc3nccs3)C[C@@H]2O1	ZINC000096100361	394677043	/nfs/dbraw/zinc/67/70/43/394677043.db2.gz	CQEPVOZBKYVDFX-MCIONIFRSA-N	1	1	295.452	2.073	40	0		CEABMO
Cc1cc(N2C[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)ncn1	ZINC000359893613	155160632	/nfs/dbraw/zinc/16/06/32/155160632.db2.gz	BBFNVPBISXVUNP-CALCHBBNSA-N	1	1	294.402	2.353	40	0		CEABMO
CCn1cc(C[NH2+]Cc2cc(F)ccc2F)cn1	ZINC000020354201	171156590	/nfs/dbraw/zinc/15/65/90/171156590.db2.gz	KNZNHIMUMSALMV-UHFFFAOYSA-N	1	1	251.280	2.471	40	0		CEABMO
CC[NH+]1CCN(C(=O)c2cc(C)cc(Cl)c2OC)CC1	ZINC000072206607	176342425	/nfs/dbraw/zinc/34/24/25/176342425.db2.gz	BJAGOFKGMROXLG-UHFFFAOYSA-N	1	1	296.798	2.435	40	0		CEABMO
Cc1ccc(-c2ccc(C[C@@H]3[NH2+]CCNC3=O)cc2)cc1	ZINC000072352888	176374446	/nfs/dbraw/zinc/37/44/46/176374446.db2.gz	UTRSXXUYXMIGSY-KRWDZBQOSA-N	1	1	280.371	2.293	40	0		CEABMO
C[N@H+]1CCC[C@H]1CCc1cnc(Br)cn1	ZINC000072363348	176377551	/nfs/dbraw/zinc/37/75/51/176377551.db2.gz	UWTUBLPALRKEQQ-JTQLQIEISA-N	1	1	270.174	2.266	40	0		CEABMO
c1cnc2c(n[nH]c2[C@@H]2CCC[N@H+](C3CCCC3)C2)n1	ZINC000072395870	176394469	/nfs/dbraw/zinc/39/44/69/176394469.db2.gz	BLJONTVNWDEAGF-LLVKDONJSA-N	1	1	271.368	2.475	40	0		CEABMO
C[N@H+]1CCc2nc(NCc3ccccc3)ncc2C1	ZINC000072415043	176399794	/nfs/dbraw/zinc/39/97/94/176399794.db2.gz	BETDOHQZWRLVMD-UHFFFAOYSA-N	1	1	254.337	2.077	40	0		CEABMO
CN1CC[N@H+](C2CCOCC2)C[C@H]1c1ccccc1	ZINC000257268219	277104139	/nfs/dbraw/zinc/10/41/39/277104139.db2.gz	MKSPTYXCZQVDMR-INIZCTEOSA-N	1	1	260.381	2.154	40	0		CEABMO
COC[C@@H]1C[N@@H+](CC2CC2)Cc2ncn(CC3CC3)c21	ZINC000096060290	277254127	/nfs/dbraw/zinc/25/41/27/277254127.db2.gz	DJIZTOGMZVXEDV-AWEZNQCLSA-N	1	1	275.396	2.249	40	0		CEABMO
COC(=O)[C@@H]1C[C@@H]2Cc3c4ccccc4[nH]c3C[N@H+]2C1	ZINC000095828945	277369107	/nfs/dbraw/zinc/36/91/07/277369107.db2.gz	OVDBJAVMIFIMFA-GHMZBOCLSA-N	1	1	270.332	2.088	40	0		CEABMO
O=C1CC[C@H]2[C@H](CC[N@H+]2[C@H]2CCOC2)N1c1ccccc1	ZINC000096186447	280261671	/nfs/dbraw/zinc/26/16/71/280261671.db2.gz	TYHFUJUVUHHYOE-JYJNAYRXSA-N	1	1	286.375	2.045	40	0		CEABMO
COc1ccc(Br)cc1C[N@@H+]1CC[C@@H](O)C1	ZINC000061708163	523497519	/nfs/dbraw/zinc/49/75/19/523497519.db2.gz	JFQMDGKJTRAPMQ-LLVKDONJSA-N	1	1	286.169	2.024	40	0		CEABMO
COc1ccc(Br)cc1C[N@H+]1CC[C@@H](O)C1	ZINC000061708163	523497528	/nfs/dbraw/zinc/49/75/28/523497528.db2.gz	JFQMDGKJTRAPMQ-LLVKDONJSA-N	1	1	286.169	2.024	40	0		CEABMO
CC[N@@H+]1C[C@@H](N(C)Cc2ccco2)[C@H]2OCCC[C@H]2C1	ZINC000096040676	185069258	/nfs/dbraw/zinc/06/92/58/185069258.db2.gz	CPXYMVKVSJLIQR-IMJJTQAJSA-N	1	1	278.396	2.211	40	0		CEABMO
O=C1CC[C@@]2(CCC[N@H+](Cc3ccc(F)cc3)CC2)N1	ZINC000096047452	185072924	/nfs/dbraw/zinc/07/29/24/185072924.db2.gz	UQIAJWMACFJVBU-MRXNPFEDSA-N	1	1	276.355	2.460	40	0		CEABMO
c1coc(CN2C[C@@H]3C[NH+](Cc4cccnc4)C[C@H]3C2)c1	ZINC000096053721	185074964	/nfs/dbraw/zinc/07/49/64/185074964.db2.gz	BYTKRPZSTBUPQP-HOTGVXAUSA-N	1	1	283.375	2.238	40	0		CEABMO
c1coc(CN2C[C@@H]3C[N@H+](CC4CC4)CC[C@@H]3C2)c1	ZINC000096054128	185076167	/nfs/dbraw/zinc/07/61/67/185076167.db2.gz	NZWQMPOAODMOMW-CABCVRRESA-N	1	1	260.381	2.443	40	0		CEABMO
c1coc(CN2C[C@@H]3C[N@@H+](CC4CC4)CC[C@@H]3C2)c1	ZINC000096054128	185076168	/nfs/dbraw/zinc/07/61/68/185076168.db2.gz	NZWQMPOAODMOMW-CABCVRRESA-N	1	1	260.381	2.443	40	0		CEABMO
COC[C@H]1CC[C@@H]2[C@@H](CC[N@H+]2Cc2ccc(C)o2)O1	ZINC000096056378	185077102	/nfs/dbraw/zinc/07/71/02/185077102.db2.gz	CPQYEYCRSDJMBQ-RBSFLKMASA-N	1	1	265.353	2.356	40	0		CEABMO
CC(C)Oc1ncnc2c1CC[N@@H+](Cc1ccco1)CC2	ZINC000096058777	185078987	/nfs/dbraw/zinc/07/89/87/185078987.db2.gz	RGZCFPIEPZJCPH-UHFFFAOYSA-N	1	1	287.363	2.458	40	0		CEABMO
COC[C@H]1C[N@H+](Cc2ccc(F)cc2)Cc2cnn(C)c21	ZINC000096060014	185081101	/nfs/dbraw/zinc/08/11/01/185081101.db2.gz	CUVMPBQDMIRTAM-CQSZACIVSA-N	1	1	289.354	2.305	40	0		CEABMO
COC[C@H]1C[N@@H+](Cc2ccc(F)cc2)Cc2cnn(C)c21	ZINC000096060014	185081102	/nfs/dbraw/zinc/08/11/02/185081102.db2.gz	CUVMPBQDMIRTAM-CQSZACIVSA-N	1	1	289.354	2.305	40	0		CEABMO
Cc1cncc(COCc2cnc3n2CC[N@H+](C)[C@H]3C)c1	ZINC000096109909	185099539	/nfs/dbraw/zinc/09/95/39/185099539.db2.gz	ULZRUHXYFWYJJJ-ZDUSSCGKSA-N	1	1	286.379	2.310	40	0		CEABMO
C[C@H](C[NH2+]CC(C)(C)CN(C)C)C(=O)OC(C)(C)C	ZINC000047219145	362202040	/nfs/dbraw/zinc/20/20/40/362202040.db2.gz	BFPUNVDZQBNHES-GFCCVEGCSA-N	1	1	272.433	2.142	40	0		CEABMO
Cc1ccc(CN2CC[C@@H]3[C@@H]2CC[N@H+]3C[C@@H]2CCOC2)o1	ZINC000096184701	344238930	/nfs/dbraw/zinc/23/89/30/344238930.db2.gz	RDGLFDMMYMMNSZ-UAGQMJEPSA-N	1	1	290.407	2.273	40	0		CEABMO
CC[NH+](CC)[C@]1([C@H](CN)CO)C[C@@H]2CC[C@@]1(C)C2(C)C	ZINC000225467525	344545839	/nfs/dbraw/zinc/54/58/39/344545839.db2.gz	MYMMFPISRPMSER-FSDCSDTHSA-N	1	1	282.472	2.480	40	0		CEABMO
Cc1cncc(C[N@H+]2CCC[C@@]3(CCC(=O)O3)C2)c1	ZINC000585283459	345009720	/nfs/dbraw/zinc/00/97/20/345009720.db2.gz	OMCFLNJKXHQWGN-OAHLLOKOSA-N	1	1	260.337	2.062	40	0		CEABMO
COc1ccccc1C[N@H+]1CC[C@]2(CCN(C(C)=O)C2)C1	ZINC000063527619	362768373	/nfs/dbraw/zinc/76/83/73/362768373.db2.gz	OOVFTNZHNZQELC-KRWDZBQOSA-N	1	1	288.391	2.140	40	0		CEABMO
Cc1[nH+]ccn1-c1ccccc1CNC(=O)C(C)C	ZINC000065739731	362845725	/nfs/dbraw/zinc/84/57/25/362845725.db2.gz	KOSIXHZDIAGVQR-UHFFFAOYSA-N	1	1	257.337	2.453	40	0		CEABMO
O=C1[C@@H]2C[N@H+](Cc3nccs3)C[C@@H]2CN1c1ccccc1	ZINC000107742866	186188808	/nfs/dbraw/zinc/18/88/08/186188808.db2.gz	OHYFPUCVDPFUIH-TZMCWYRMSA-N	1	1	299.399	2.238	40	0		CEABMO
O=C1[C@@H]2C[N@@H+](Cc3nccs3)C[C@@H]2CN1c1ccccc1	ZINC000107742866	186188809	/nfs/dbraw/zinc/18/88/09/186188809.db2.gz	OHYFPUCVDPFUIH-TZMCWYRMSA-N	1	1	299.399	2.238	40	0		CEABMO
CNc1cc([C@@H]2CN(c3[nH+]cccc3C)CCO2)nc(C)n1	ZINC000072387751	363132931	/nfs/dbraw/zinc/13/29/31/363132931.db2.gz	LDGZDLWMTYRZEA-AWEZNQCLSA-N	1	1	299.378	2.108	40	0		CEABMO
CC(=O)O[C@H]1CC[N@H+](Cc2ccco2)[C@@H](C)[C@@H]1C	ZINC000004127442	361301152	/nfs/dbraw/zinc/30/11/52/361301152.db2.gz	HAVUOHMCCLLASZ-MJVIPROJSA-N	1	1	251.326	2.442	40	0		CEABMO
COC(=O)c1ccc(CN2C[C@H]3CCC[N@H+]3C[C@H]2C)cc1	ZINC000019575106	361543990	/nfs/dbraw/zinc/54/39/90/361543990.db2.gz	XIPUQLOHVWTLQE-CZUORRHYSA-N	1	1	288.391	2.142	40	0		CEABMO
C[C@H]1C[N@H+]2CCC[C@H]2CN1Cc1ccc2c(c1)CCO2	ZINC000019575766	361544096	/nfs/dbraw/zinc/54/40/96/361544096.db2.gz	PKDZNVJCOUGVNA-BBRMVZONSA-N	1	1	272.392	2.290	40	0		CEABMO
CCN1CC[C@]2(CCCN(c3cccc(C)[nH+]3)C2)C1=O	ZINC000096093266	364399355	/nfs/dbraw/zinc/39/93/55/364399355.db2.gz	RERRRNZFNJCHGX-INIZCTEOSA-N	1	1	273.380	2.229	40	0		CEABMO
C[N@H+]1CCC[C@@]2(CCN(c3ccsc3)C2=O)C1	ZINC000096074057	364399988	/nfs/dbraw/zinc/39/99/88/364399988.db2.gz	VLECHKLEELVGDZ-CYBMUJFWSA-N	1	1	250.367	2.197	40	0		CEABMO
O=C1Nc2ccccc2O[C@H]2C[C@@H]1[N@H+](C1CCCC1)C2	ZINC000096111766	364400569	/nfs/dbraw/zinc/40/05/69/364400569.db2.gz	FVXZRXFNUZZAQF-JSGCOSHPSA-N	1	1	272.348	2.403	40	0	biogenic,in-vitro	CEABMO
O[C@@H]1CC[N@@H+](Cc2ccco2)[C@H]1Cc1ccccc1	ZINC000096200001	364409036	/nfs/dbraw/zinc/40/90/36/364409036.db2.gz	YQWFUKSGKBQPCS-JKSUJKDBSA-N	1	1	257.333	2.458	40	0		CEABMO
Cc1ccc(C[N@@H+]2CCc3ccc(=O)[nH]c3CC2)cc1	ZINC000096196629	364408635	/nfs/dbraw/zinc/40/86/35/364408635.db2.gz	OUYIYRXYZGOOPX-UHFFFAOYSA-N	1	1	268.360	2.284	40	0		CEABMO
CO[C@H]1COC2(C1)CC[NH+](Cc1csc(C)n1)CC2	ZINC000096158770	364403550	/nfs/dbraw/zinc/40/35/50/364403550.db2.gz	UAJIUSMDRDBQOG-CYBMUJFWSA-N	1	1	282.409	2.221	40	0		CEABMO
C[N@H+]1CC[C@@]2(C1)CCC[C@H](CNC(=O)c1ccccc1)O2	ZINC000096208426	364411498	/nfs/dbraw/zinc/41/14/98/364411498.db2.gz	DNJQBMXPRMQFSS-NVXWUHKLSA-N	1	1	288.391	2.060	40	0		CEABMO
c1nnc(N2CC[C@@]3(C2)CCC[N@H+](CC2CC2)C3)s1	ZINC000096215563	364412595	/nfs/dbraw/zinc/41/25/95/364412595.db2.gz	FMZJNCFJOHXMPB-AWEZNQCLSA-N	1	1	278.425	2.240	40	0		CEABMO
C[N@H+]1CC[C@]2(c3ccccc3)CCN(C(=O)C3CC3)C[C@H]12	ZINC000096251821	364415789	/nfs/dbraw/zinc/41/57/89/364415789.db2.gz	KHUQSPQHMNEIHO-FUHWJXTLSA-N	1	1	284.403	2.271	40	0		CEABMO
COC1C[C@@H]2COC[C@H](C1)[N@H+]2Cc1cccc(C)c1	ZINC000096252500	364416152	/nfs/dbraw/zinc/41/61/52/364416152.db2.gz	SQBSGBYQSGMXDQ-XYPWUTKMSA-N	1	1	261.365	2.373	40	0		CEABMO
Cc1ccc2c(c1)C1(C[C@@H]2N2CCOCC2)CC[NH2+]CC1	ZINC000096241751	364417098	/nfs/dbraw/zinc/41/70/98/364417098.db2.gz	OICVZJXFMFNBDD-KRWDZBQOSA-N	1	1	286.419	2.393	40	0		CEABMO
O=C1[C@H]2C[N@@H+](CC3CC3)C[C@H]2CN1c1ccsc1	ZINC000096245212	364417195	/nfs/dbraw/zinc/41/71/95/364417195.db2.gz	MMKJKQIPWGEDDE-AAEUAGOBSA-N	1	1	262.378	2.053	40	0		CEABMO
Cn1c[nH+]c(-c2ccccc2Br)c1N	ZINC000100761156	364550832	/nfs/dbraw/zinc/55/08/32/364550832.db2.gz	ZZAMCLQSPYDDDH-UHFFFAOYSA-N	1	1	252.115	2.432	40	0		CEABMO
C(O[C@@H]1[C@H]2CC[C@@H]1[N@@H+](CC1CC1)CCO2)C1CC1	ZINC000247978653	371152500	/nfs/dbraw/zinc/15/25/00/371152500.db2.gz	WXHHRBMHULUJSW-ZNMIVQPWSA-N	1	1	251.370	2.055	40	0		CEABMO
Cc1cccc(N2CCC[C@@H]([N@@H+](C)Cc3cnc[nH]3)C2)n1	ZINC000257328541	371613571	/nfs/dbraw/zinc/61/35/71/371613571.db2.gz	XGCSEJOMVWWDTF-OAHLLOKOSA-N	1	1	285.395	2.214	40	0		CEABMO
Cc1cccc(N2CCC[C@@H]([N@H+](C)Cc3c[nH]cn3)C2)n1	ZINC000257328541	371613576	/nfs/dbraw/zinc/61/35/76/371613576.db2.gz	XGCSEJOMVWWDTF-OAHLLOKOSA-N	1	1	285.395	2.214	40	0		CEABMO
Cn1cccc1C[NH2+]Cc1cc(C(F)(F)F)n(C)n1	ZINC000256053907	190004788	/nfs/dbraw/zinc/00/47/88/190004788.db2.gz	UCZRAGFHVCUOJP-UHFFFAOYSA-N	1	1	272.274	2.067	40	0		CEABMO
CC[C@@H](C)n1nccc1C[NH2+]Cc1ccnn1CC	ZINC000256053658	190005128	/nfs/dbraw/zinc/00/51/28/190005128.db2.gz	SHOXWPMWIBDGFY-GFCCVEGCSA-N	1	1	261.373	2.360	40	0		CEABMO
c1ccc(C[C@@H]2COCC[N@@H+](Cc3ccccn3)C2)nc1	ZINC000257208340	190012360	/nfs/dbraw/zinc/01/23/60/190012360.db2.gz	BLTHNOQMDMAQSP-HNNXBMFYSA-N	1	1	283.375	2.168	40	0		CEABMO
CN(C(=O)c1cc([C@H]2CCC[N@H+]2C)ccn1)C1CCC1	ZINC000257212726	190013011	/nfs/dbraw/zinc/01/30/11/190013011.db2.gz	CERLADNWEUDAIJ-OAHLLOKOSA-N	1	1	273.380	2.473	40	0		CEABMO
c1ccc(CC[N@H+]2CCOC[C@@H](Cc3ncccn3)C2)cc1	ZINC000257230186	190016135	/nfs/dbraw/zinc/01/61/35/190016135.db2.gz	GBFIMVOBWJOLCP-KRWDZBQOSA-N	1	1	297.402	2.210	40	0		CEABMO
CCn1cc(C[N@H+]2CCC[C@H](Cc3n[nH]cc3C)C2)cn1	ZINC000257242983	190018247	/nfs/dbraw/zinc/01/82/47/190018247.db2.gz	IFBLANPSVXYIEP-CQSZACIVSA-N	1	1	287.411	2.389	40	0		CEABMO
CC1CC[NH+](Cc2nc(-c3ccc[nH]c3=O)no2)CC1	ZINC000257262992	190022163	/nfs/dbraw/zinc/02/21/63/190022163.db2.gz	LNXFHVOGBSSUBO-UHFFFAOYSA-N	1	1	274.324	2.069	40	0		CEABMO
Cn1ccnc1C[N@@H+]1CCC[C@H](c2ccc3c[nH]nc3n2)C1	ZINC000257339467	190036998	/nfs/dbraw/zinc/03/69/98/190036998.db2.gz	ZBVWOAQAJZGCBB-ZDUSSCGKSA-N	1	1	296.378	2.071	40	0		CEABMO
Cn1ccnc1C[N@H+]1CCC[C@H](c2ccc3c[nH]nc3n2)C1	ZINC000257339467	190036999	/nfs/dbraw/zinc/03/69/99/190036999.db2.gz	ZBVWOAQAJZGCBB-ZDUSSCGKSA-N	1	1	296.378	2.071	40	0		CEABMO
Cc1ccc(NC(=O)[C@H]2C[N@H+](C)Cc3cn(C)nc32)c(C)c1	ZINC000019701311	394469527	/nfs/dbraw/zinc/46/95/27/394469527.db2.gz	KPUJCUJVBAJJHE-AWEZNQCLSA-N	1	1	298.390	2.205	40	0		CEABMO
Cc1cc(N2CCN(C)CC2)ncc1[C@@H]([NH3+])c1ccccc1	ZINC000072223612	394594312	/nfs/dbraw/zinc/59/43/12/394594312.db2.gz	DTVAIGHJYZXREG-SFHVURJKSA-N	1	1	296.418	2.190	40	0		CEABMO
COc1ccc(N2C(=O)[C@H]([NH3+])[C@H]2c2ccc(C)o2)cc1	ZINC000072227156	394595456	/nfs/dbraw/zinc/59/54/56/394595456.db2.gz	PQYHEDNPDKFEOF-ZIAGYGMSSA-N	1	1	272.304	2.012	40	0		CEABMO
[NH3+][C@@H]1C(=O)N(c2ccc(F)cc2)[C@H]1c1ccccc1	ZINC000072227191	394595461	/nfs/dbraw/zinc/59/54/61/394595461.db2.gz	WYYXBPDQRSEFSN-KBPBESRZSA-N	1	1	256.280	2.241	40	0		CEABMO
[NH3+][C@H]1C(=O)N(Cc2ccc(F)cc2)[C@@H]1c1ccccc1	ZINC000072228180	394596222	/nfs/dbraw/zinc/59/62/22/394596222.db2.gz	AMOPJKHITPCODS-HUUCEWRRSA-N	1	1	270.307	2.237	40	0		CEABMO
C[C@@H]1C[N@H+]2CCC[C@H]2CN1Cc1ccc2nccnc2c1	ZINC000072397553	394598220	/nfs/dbraw/zinc/59/82/20/394598220.db2.gz	DGNKJJSYRULZBU-HIFRSBDPSA-N	1	1	282.391	2.298	40	0		CEABMO
COc1c2c(cc3c1C[N@@H+](C(C)(C)C)C[C@H]3O)OCO2	ZINC000261829822	286188585	/nfs/dbraw/zinc/18/85/85/286188585.db2.gz	SZTAGXSUDJPRAO-LLVKDONJSA-N	1	1	279.336	2.071	40	0		CEABMO
COc1c2c(cc3c1C[N@H+](C(C)(C)C)C[C@H]3O)OCO2	ZINC000261829822	286188586	/nfs/dbraw/zinc/18/85/86/286188586.db2.gz	SZTAGXSUDJPRAO-LLVKDONJSA-N	1	1	279.336	2.071	40	0		CEABMO
COc1ccc(OCCc2cc([C@H]3CC[NH2+]C3)n[nH]2)cc1	ZINC000072374096	176385385	/nfs/dbraw/zinc/38/53/85/176385385.db2.gz	VODKTFDSFFEVAH-LBPRGKRZSA-N	1	1	287.363	2.117	40	0		CEABMO
COC[C@@H](O)C[N@H+]1C[C@@H](c2ccc(F)cc2)C[C@@H]1C	ZINC000077177250	177230913	/nfs/dbraw/zinc/23/09/13/177230913.db2.gz	ABCPPHYURVKKRG-WHOFXGATSA-N	1	1	267.344	2.011	40	0		CEABMO
COc1cccc([C@H]([NH3+])c2nc(-c3ccoc3C)n[nH]2)c1	ZINC000095533537	185005686	/nfs/dbraw/zinc/00/56/86/185005686.db2.gz	BHXAKWLHSYZZBT-ZDUSSCGKSA-N	1	1	284.319	2.430	40	0		CEABMO
COC[C@@]12CCCO[C@@H]1CC[N@@H+](Cc1ccoc1)C2	ZINC000096038970	185069743	/nfs/dbraw/zinc/06/97/43/185069743.db2.gz	RPAIPOFUMNRCFZ-CABCVRRESA-N	1	1	265.353	2.297	40	0		CEABMO
c1cncc(O[C@@H]2C[N@H+](C3CCC3)[C@@H]3CCCO[C@H]23)c1	ZINC000096042450	185070236	/nfs/dbraw/zinc/07/02/36/185070236.db2.gz	YQQALFRWHLEBBG-OAGGEKHMSA-N	1	1	274.364	2.245	40	0		CEABMO
CN1C(=O)CCC[C@]12CCC[N@H+](Cc1nccs1)C2	ZINC000096049958	185074694	/nfs/dbraw/zinc/07/46/94/185074694.db2.gz	VXBHDAGMIJSWMI-CQSZACIVSA-N	1	1	279.409	2.120	40	0		CEABMO
CN1C(=O)CCC[C@]12CCC[N@@H+](Cc1nccs1)C2	ZINC000096049958	185074695	/nfs/dbraw/zinc/07/46/95/185074695.db2.gz	VXBHDAGMIJSWMI-CQSZACIVSA-N	1	1	279.409	2.120	40	0		CEABMO
CC(C)C[N@H+]1CC[C@@H]2[C@@H]1CCN2Cc1ccccn1	ZINC000096055779	185076651	/nfs/dbraw/zinc/07/66/51/185076651.db2.gz	SBBHTYNSOLBOTH-JKSUJKDBSA-N	1	1	259.397	2.386	40	0		CEABMO
c1cncc(O[C@H]2C[N@H+](CC3CC3)[C@H]3CCCO[C@H]23)c1	ZINC000096058088	185078856	/nfs/dbraw/zinc/07/88/56/185078856.db2.gz	AWBDSCWTNQXCSO-JYJNAYRXSA-N	1	1	274.364	2.102	40	0		CEABMO
CN1CC[C@@]2(CCC[N@@H+](Cc3cccs3)C2)C1=O	ZINC000096073923	185088785	/nfs/dbraw/zinc/08/87/85/185088785.db2.gz	USHQMXXIUJFMBS-CQSZACIVSA-N	1	1	264.394	2.192	40	0		CEABMO
O=C1[C@H]2C[N@@H+](Cc3ccsc3)C[C@H]2CN1c1ccoc1	ZINC000096080733	185091149	/nfs/dbraw/zinc/09/11/49/185091149.db2.gz	AHWJNYXLTFRFEF-JSGCOSHPSA-N	1	1	288.372	2.436	40	0		CEABMO
Cc1ccc2c(c1)[C@@H](N1CCOCC1)CC21CC[NH2+]CC1	ZINC000096079410	185091183	/nfs/dbraw/zinc/09/11/83/185091183.db2.gz	HBOOFELTRHJXPO-KRWDZBQOSA-N	1	1	286.419	2.393	40	0		CEABMO
CO[C@H]1CO[C@]2(C1)CCC[N@@H+](Cc1c(C)noc1C)C2	ZINC000096107181	185100382	/nfs/dbraw/zinc/10/03/82/185100382.db2.gz	KETKEZNFVJJWFM-HIFRSBDPSA-N	1	1	280.368	2.061	40	0		CEABMO
CCOc1cccc(NC(=O)[C@H]2CCC[N@@H+](C)C2)c1	ZINC000096629202	185107897	/nfs/dbraw/zinc/10/78/97/185107897.db2.gz	PQIJWKREXJLICT-LBPRGKRZSA-N	1	1	262.353	2.366	40	0		CEABMO
C[C@@H]1CC[C@@H](C)[NH+]1c1ccc(N2CCOCC2)c(N)c1	ZINC000008701412	343362868	/nfs/dbraw/zinc/36/28/68/343362868.db2.gz	OLOLGOYRPYYLEQ-CHWSQXEVSA-N	1	1	275.396	2.483	40	0		CEABMO
CC(C)(C)OC(=O)N[C@H]1CCCN(c2ccc(N)c[nH+]2)C1	ZINC000114036689	344278636	/nfs/dbraw/zinc/27/86/36/344278636.db2.gz	NBTNDUBSJWWOMC-LBPRGKRZSA-N	1	1	292.383	2.157	40	0		CEABMO
O=C(N[C@@H]1CCC[C@H]1[NH2+]C1CCCC1)C(F)(F)F	ZINC000409439616	344889824	/nfs/dbraw/zinc/88/98/24/344889824.db2.gz	HRFGSGJDFQTKIY-NXEZZACHSA-N	1	1	264.291	2.118	40	0		CEABMO
c1coc(C[N@H+]2CCC[C@@]3(C[C@@H](n4ccnc4)CO3)C2)c1	ZINC000107731331	186189359	/nfs/dbraw/zinc/18/93/59/186189359.db2.gz	ODJOIXLINXIUPZ-GDBMZVCRSA-N	1	1	287.363	2.472	40	0		CEABMO
CC(C)[N@@H+](CCO)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000079395096	363596181	/nfs/dbraw/zinc/59/61/81/363596181.db2.gz	ZFCBPDQQOVKMTB-QGZVFWFLSA-N	1	1	276.424	2.354	40	0		CEABMO
CCC[N@H+]1C[C@@H]2CC[C@]3(CC(C)=NN3C(C)=O)[C@H]2C1	ZINC000306134560	283354336	/nfs/dbraw/zinc/35/43/36/283354336.db2.gz	NRUNORKAOHBWII-KKUMJFAQSA-N	1	1	263.385	2.105	40	0		CEABMO
CO[C@@H]1CC=C2CC[N@H+]3CCC4=C(CCOC4)[C@@]23C1	ZINC000005248456	361332362	/nfs/dbraw/zinc/33/23/62/361332362.db2.gz	QUJGKXLFHIGUGU-GDBMZVCRSA-N	1	1	261.365	2.287	40	0		CEABMO
c1ccc(CN2CCN(c3cc[nH+]cc3)CC2)cc1	ZINC000006096301	361335279	/nfs/dbraw/zinc/33/52/79/361335279.db2.gz	GSKPQNFOPJYZEC-UHFFFAOYSA-N	1	1	253.349	2.404	40	0		CEABMO
Nc1ccc(C(=O)NC[C@@H]2CCC[N@H+]3CCCC[C@@H]23)cc1	ZINC000017466790	361510191	/nfs/dbraw/zinc/51/01/91/361510191.db2.gz	MKNQZZGCGYYGOH-HOCLYGCPSA-N	1	1	287.407	2.263	40	0		CEABMO
COc1cccc(C[N@H+]2CC[C@H](c3cc(=O)[nH]c(C)n3)C2)c1	ZINC000019285258	361527320	/nfs/dbraw/zinc/52/73/20/361527320.db2.gz	PIZJRIXZJITVMN-AWEZNQCLSA-N	1	1	299.374	2.076	40	0		CEABMO
CCc1noc(C)c1C(=O)NC[C@H]1CCCC[N@@H+]1CC	ZINC000019521277	361542082	/nfs/dbraw/zinc/54/20/82/361542082.db2.gz	CSAINSJXKBKGSK-GFCCVEGCSA-N	1	1	279.384	2.150	40	0		CEABMO
CCCNc1nc(NCCC)[nH+]c(N2CCCC2)n1	ZINC000089065432	363927114	/nfs/dbraw/zinc/92/71/14/363927114.db2.gz	LVCBAFSCJHAZDQ-UHFFFAOYSA-N	1	1	264.377	2.116	40	0		CEABMO
CC[N@H+]1CCC[C@H](n2ncc3cnc(Cl)nc32)C1	ZINC000095097372	364340331	/nfs/dbraw/zinc/34/03/31/364340331.db2.gz	SBTACHXIMUIIKD-JTQLQIEISA-N	1	1	265.748	2.137	40	0		CEABMO
C[N@H+]1CCC[C@]2(CCN(c3ccsc3)C2=O)C1	ZINC000096074056	364400446	/nfs/dbraw/zinc/40/04/46/364400446.db2.gz	VLECHKLEELVGDZ-ZDUSSCGKSA-N	1	1	250.367	2.197	40	0		CEABMO
Cc1ccc2c([nH+]1)N(CC1CC1)CCN(C(=O)N(C)C)C2	ZINC000096199087	364409452	/nfs/dbraw/zinc/40/94/52/364409452.db2.gz	BNBDHSZQFNMEQF-UHFFFAOYSA-N	1	1	288.395	2.104	40	0		CEABMO
CO[C@H]1CC[N@@H+](Cc2nccn2C)[C@H]1Cc1ccccc1	ZINC000096200377	364410345	/nfs/dbraw/zinc/41/03/45/364410345.db2.gz	FSQRSBODWQPDFY-HOTGVXAUSA-N	1	1	285.391	2.252	40	0		CEABMO
COC[C@@H]1CCC2(CCN(Cc3ccoc3)CC2)[N@H+]1C	ZINC000096208154	364410357	/nfs/dbraw/zinc/41/03/57/364410357.db2.gz	AMUFGPXPRRJJOR-HNNXBMFYSA-N	1	1	278.396	2.355	40	0		CEABMO
C[N@H+]1CCC[C@@]2(CCN(C(=O)Cc3ccsc3)C2)C1	ZINC000096215251	364412532	/nfs/dbraw/zinc/41/25/32/364412532.db2.gz	YHDWRDSACVMGEU-OAHLLOKOSA-N	1	1	278.421	2.235	40	0		CEABMO
CC(C)[C@@H]1CO[C@]2(CC[N@@H+](Cc3cnn(C)c3)C2)C1	ZINC000096218246	364413175	/nfs/dbraw/zinc/41/31/75/364413175.db2.gz	ODYKVAIZCSTCFV-LSDHHAIUSA-N	1	1	263.385	2.057	40	0		CEABMO
CCC(=O)N1CC[C@@]2(c3ccccc3)CC[N@@H+](C)[C@@H]2C1	ZINC000096251818	364415727	/nfs/dbraw/zinc/41/57/27/364415727.db2.gz	BWMHZOIKSIBNDQ-NVXWUHKLSA-N	1	1	272.392	2.271	40	0		CEABMO
CC(C)Nc1ncnc2c1CC[N@@H+](Cc1ccncc1)CC2	ZINC000096255514	364418529	/nfs/dbraw/zinc/41/85/29/364418529.db2.gz	NKQWTDSHQISKKO-UHFFFAOYSA-N	1	1	297.406	2.293	40	0		CEABMO
CCc1ccnc(C(=O)N2CCC(Cc3[nH]cc[nH+]3)CC2)c1	ZINC000330616735	203043865	/nfs/dbraw/zinc/04/38/65/203043865.db2.gz	VSCWKUOEGDHCFV-UHFFFAOYSA-N	1	1	298.390	2.462	40	0		CEABMO
COC[C@@H]1CCOC12C[NH+](Cc1cccc3[nH]ccc31)C2	ZINC000247893313	371145425	/nfs/dbraw/zinc/14/54/25/371145425.db2.gz	ULDIFWLFDXJIRB-AWEZNQCLSA-N	1	1	286.375	2.405	40	0		CEABMO
CCn1ncc(C[NH2+]Cc2ccc(OC)cc2)c1F	ZINC000256054857	190005677	/nfs/dbraw/zinc/00/56/77/190005677.db2.gz	YBQOLFRYILACBK-UHFFFAOYSA-N	1	1	263.316	2.341	40	0		CEABMO
CC(C)[N@H+]1CC[C@@H](Cc2cnc(-c3ncco3)cn2)C1	ZINC000257200996	190010659	/nfs/dbraw/zinc/01/06/59/190010659.db2.gz	AFRXXXOHPMGSTK-LBPRGKRZSA-N	1	1	272.352	2.404	40	0		CEABMO
CNc1cc(C)nc([C@@H]2CC[N@H+](Cc3cnn(C)c3)C2)c1	ZINC000257217219	190014033	/nfs/dbraw/zinc/01/40/33/190014033.db2.gz	CYBRFAPCIWITOP-CQSZACIVSA-N	1	1	285.395	2.155	40	0		CEABMO
CNc1cc(C)nc([C@@H]2CC[N@@H+](Cc3cnn(C)c3)C2)c1	ZINC000257217219	190014034	/nfs/dbraw/zinc/01/40/34/190014034.db2.gz	CYBRFAPCIWITOP-CQSZACIVSA-N	1	1	285.395	2.155	40	0		CEABMO
COCC[N@H+]1CCC[C@@H](c2cccc(-c3cc[nH]n3)n2)C1	ZINC000257249942	190019819	/nfs/dbraw/zinc/01/98/19/190019819.db2.gz	JKIZXPTUOJHNTF-CYBMUJFWSA-N	1	1	286.379	2.298	40	0		CEABMO
CCn1cc(CN2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cn1	ZINC000257265047	190022999	/nfs/dbraw/zinc/02/29/99/190022999.db2.gz	LXBCCSCABXWYFS-QGZVFWFLSA-N	1	1	284.407	2.392	40	0		CEABMO
Cc1n[nH]cc1C[N@H+]1CCC[C@H](c2ccnc(C)n2)C1	ZINC000257284971	190026725	/nfs/dbraw/zinc/02/67/25/190026725.db2.gz	PFCJBCRZUOXKTH-ZDUSSCGKSA-N	1	1	271.368	2.196	40	0		CEABMO
Cc1n[nH]cc1C[N@H+]1CCC[C@@H](c2ccnc(C)n2)C1	ZINC000257284970	190027358	/nfs/dbraw/zinc/02/73/58/190027358.db2.gz	PFCJBCRZUOXKTH-CYBMUJFWSA-N	1	1	271.368	2.196	40	0		CEABMO
COc1ccc(N2C(=O)[C@@H]([NH3+])[C@@H]2c2ccc(C)cc2)cc1	ZINC000072227135	256703491	/nfs/dbraw/zinc/70/34/91/256703491.db2.gz	FHJGRFNZBYNQNN-HOTGVXAUSA-N	1	1	282.343	2.419	40	0		CEABMO
CC[N@H+]1CC[C@]2(c3ccccc3)CCN(C(C)=O)C[C@H]12	ZINC000096251898	256834547	/nfs/dbraw/zinc/83/45/47/256834547.db2.gz	ADFKGDUQBPZDFV-DLBZAZTESA-N	1	1	272.392	2.271	40	0		CEABMO
COc1ccc2c3c1O[C@@H]1C[C@H](O)C=C(CC[N@H+](C)C2)[C@H]31	ZINC000242473299	394495896	/nfs/dbraw/zinc/49/58/96/394495896.db2.gz	FFQKTDKDUHFQKE-YUELXQCFSA-N	1	1	287.359	2.066	40	0		CEABMO
C[N@H+]1CCCC[C@H]1c1ccc(N2CCOCC2)nc1	ZINC000072216177	394593705	/nfs/dbraw/zinc/59/37/05/394593705.db2.gz	PGFVPJUPXFNDRH-AWEZNQCLSA-N	1	1	261.369	2.075	40	0		CEABMO
[NH3+][C@@H]1C(=O)N(Cc2ccc(F)cc2)[C@H]1c1ccccc1F	ZINC000072228235	394596639	/nfs/dbraw/zinc/59/66/39/394596639.db2.gz	LCRLBTDJPNMCGY-GJZGRUSLSA-N	1	1	288.297	2.376	40	0		CEABMO
NC(=O)[C@H]1Cc2ccccc2C[N@@H+]1Cc1ccccc1	ZINC000078395378	394626154	/nfs/dbraw/zinc/62/61/54/394626154.db2.gz	DEVGNEAMNMQZRC-MRXNPFEDSA-N	1	1	266.344	2.099	40	0		CEABMO
NC(=O)[C@H]1Cc2ccccc2C[N@H+]1Cc1ccccc1	ZINC000078395378	394626157	/nfs/dbraw/zinc/62/61/57/394626157.db2.gz	DEVGNEAMNMQZRC-MRXNPFEDSA-N	1	1	266.344	2.099	40	0		CEABMO
CO[C@H]1C[N@@H+](Cc2cccs2)[C@@H]2CCCO[C@@H]21	ZINC000096057403	394675792	/nfs/dbraw/zinc/67/57/92/394675792.db2.gz	CBFAJJAPTOIZKT-AGIUHOORSA-N	1	1	253.367	2.126	40	0		CEABMO
CC[C@H](C)[N@@H+]1C[C@@H]2[C@H](C1)OCCN2Cc1cccc(C)n1	ZINC000096081821	394676122	/nfs/dbraw/zinc/67/61/22/394676122.db2.gz	YMFCTVLMXBBOSO-UAGQMJEPSA-N	1	1	289.423	2.074	40	0		CEABMO
C[N@H+]1CCc2nc(Cl)c(Br)cc2C1	ZINC000096510601	394694236	/nfs/dbraw/zinc/69/42/36/394694236.db2.gz	ZILVJFVRGMGQER-UHFFFAOYSA-N	1	1	261.550	2.485	40	0		CEABMO
COC(=O)[C@H]1C[N@@H+](C)C[C@@H]1c1cccc(Cl)c1	ZINC000217669467	400308059	/nfs/dbraw/zinc/30/80/59/400308059.db2.gz	GRUWZCAOPKGXBQ-NEPJUHHUSA-N	1	1	253.729	2.158	40	0		CEABMO
COc1ccc(N2C(=O)[C@H]([NH3+])[C@@H]2c2ccccc2)cc1	ZINC000072227126	286324905	/nfs/dbraw/zinc/32/49/05/286324905.db2.gz	XTSXQGSRHGCKDD-CABCVRRESA-N	1	1	268.316	2.110	40	0		CEABMO
CCn1cc(C[NH2+]Cc2cccc(F)c2F)cn1	ZINC000020349199	171155340	/nfs/dbraw/zinc/15/53/40/171155340.db2.gz	OETOADIRRANQRI-UHFFFAOYSA-N	1	1	251.280	2.471	40	0		CEABMO
COc1ccc(-c2ccc([C@H]([NH3+])CC(N)=O)o2)cc1Cl	ZINC000044253047	175156298	/nfs/dbraw/zinc/15/62/98/175156298.db2.gz	ODDITLNVCRNVAG-SNVBAGLBSA-N	1	1	294.738	2.484	40	0		CEABMO
COc1ccccc1C[N@H+]1CC[C@@H](c2cc[nH]n2)C1	ZINC000072385092	176389601	/nfs/dbraw/zinc/38/96/01/176389601.db2.gz	IIXIIHNJDARDBR-GFCCVEGCSA-N	1	1	257.337	2.408	40	0		CEABMO
CC(=O)OCc1ccc(CN2C[C@@H]3CCC[N@@H+]3C[C@H]2C)o1	ZINC000072397549	176395098	/nfs/dbraw/zinc/39/50/98/176395098.db2.gz	PZLFJHQRYKIHEQ-OCCSQVGLSA-N	1	1	292.379	2.011	40	0		CEABMO
c1ccc(O[C@H]2COCC[N@@H+](Cc3ccccn3)C2)cc1	ZINC000077265839	177246607	/nfs/dbraw/zinc/24/66/07/177246607.db2.gz	VIBVZHKYECKWQQ-QGZVFWFLSA-N	1	1	284.359	2.361	40	0	biogenic,in-vitro	CEABMO
c1ccc(O[C@H]2COCC[N@H+](Cc3ccccn3)C2)cc1	ZINC000077265839	177246609	/nfs/dbraw/zinc/24/66/09/177246609.db2.gz	VIBVZHKYECKWQQ-QGZVFWFLSA-N	1	1	284.359	2.361	40	0	biogenic,in-vitro	CEABMO
Cc1[nH+]ccn1CC(=O)N1CCC[C@H](Cc2ccccn2)C1	ZINC000257338350	279169905	/nfs/dbraw/zinc/16/99/05/279169905.db2.gz	YWZGNASAEDCXGH-OAHLLOKOSA-N	1	1	298.390	2.068	40	0		CEABMO
Cc1ccc2c([nH+]1)N(C)CCN(c1ccccn1)C2	ZINC000096069214	281136872	/nfs/dbraw/zinc/13/68/72/281136872.db2.gz	HQPMGIIUTGXZLW-UHFFFAOYSA-N	1	1	254.337	2.241	40	0		CEABMO
C[N@H+]1CCC[C@]2(CN(Cc3ccc(F)cc3)CCO2)C1	ZINC000096049065	185072303	/nfs/dbraw/zinc/07/23/03/185072303.db2.gz	CQZBSGHCUGRSDI-MRXNPFEDSA-N	1	1	278.371	2.122	40	0		CEABMO
CC[N@H+]1CCOC[C@]2(CCCN(Cc3ccccn3)C2)C1	ZINC000096049597	185073021	/nfs/dbraw/zinc/07/30/21/185073021.db2.gz	WVUBZOQEFIPAAZ-QGZVFWFLSA-N	1	1	289.423	2.016	40	0		CEABMO
c1nc(COCC2CC2)c2n1CCC[N@H+](CC1CC1)C2	ZINC000096059028	185078863	/nfs/dbraw/zinc/07/88/63/185078863.db2.gz	GDKFBLQTNBSZBM-UHFFFAOYSA-N	1	1	275.396	2.425	40	0		CEABMO
c1ncc(C[NH+]2CCC3(C[C@@H](c4cccnc4)CO3)CC2)[nH]1	ZINC000096073008	185088820	/nfs/dbraw/zinc/08/88/20/185088820.db2.gz	WXTBMCINQWCSHK-OAHLLOKOSA-N	1	1	298.390	2.343	40	0		CEABMO
CC(C)C[N@H+]1C[C@@H]2CN(C(=O)Nc3ccccc3)C[C@@H]21	ZINC000096080580	185090683	/nfs/dbraw/zinc/09/06/83/185090683.db2.gz	MILOUHMKHQMEJO-HIFRSBDPSA-N	1	1	273.380	2.491	40	0		CEABMO
C[N@H+]1CCC[C@H](Cc2cnc(Br)cn2)C1	ZINC000205706495	539185161	/nfs/dbraw/zinc/18/51/61/539185161.db2.gz	XGTIAASFPAIINX-SECBINFHSA-N	1	1	270.174	2.123	40	0		CEABMO
c1ccc(C[N@@H+]2C[C@H]3CN(c4ncccn4)C[C@H]3C2)cc1	ZINC000039348997	343435976	/nfs/dbraw/zinc/43/59/76/343435976.db2.gz	JJRLPUYJOZKMFO-IYBDPMFKSA-N	1	1	280.375	2.045	40	0		CEABMO
CCCNc1ncc(C[NH2+]Cc2nc3ccccc3[nH]2)cn1	ZINC000062718474	343672446	/nfs/dbraw/zinc/67/24/46/343672446.db2.gz	HGINJJSDNXFBRS-UHFFFAOYSA-N	1	1	296.378	2.465	40	0		CEABMO
OC[C@@H]1CC[N@@H+](Cc2cccc(Br)c2)C1	ZINC000051887055	362444704	/nfs/dbraw/zinc/44/47/04/362444704.db2.gz	JOKZZLUKCYXRJI-LLVKDONJSA-N	1	1	270.170	2.263	40	0		CEABMO
CC[NH+]1CCN(C(=O)c2ccc(Cl)cc2F)CC1	ZINC000052538451	362471458	/nfs/dbraw/zinc/47/14/58/362471458.db2.gz	COMVASNGSNMVJU-UHFFFAOYSA-N	1	1	270.735	2.257	40	0		CEABMO
CC[N@@H+](CCO)C[C@H]1CCCN(Cc2ccccc2)C1	ZINC000079393520	363593740	/nfs/dbraw/zinc/59/37/40/363593740.db2.gz	GBGJOVWOEAVFAF-QGZVFWFLSA-N	1	1	276.424	2.213	40	0		CEABMO
OC[C@@H]1CCC[N@H+](Cc2ccc(Br)o2)C1	ZINC000000209142	361145960	/nfs/dbraw/zinc/14/59/60/361145960.db2.gz	UZLQTQLPMQPQKD-SECBINFHSA-N	1	1	274.158	2.246	40	0		CEABMO
OC[C@@H]1CCC[N@@H+](Cc2ccc(Br)o2)C1	ZINC000000209142	361145963	/nfs/dbraw/zinc/14/59/63/361145963.db2.gz	UZLQTQLPMQPQKD-SECBINFHSA-N	1	1	274.158	2.246	40	0		CEABMO
C[N@H+]1CCC[C@H](C(=O)NCCC2=CCCCC2)C1	ZINC000082301893	363761704	/nfs/dbraw/zinc/76/17/04/363761704.db2.gz	MIRUCWZIVVLJBW-AWEZNQCLSA-N	1	1	250.386	2.335	40	0		CEABMO
O=c1[nH]c2ccccc2cc1C[NH2+]Cc1ccco1	ZINC000013998872	361445818	/nfs/dbraw/zinc/44/58/18/361445818.db2.gz	IXKKGJSGHNQSFN-UHFFFAOYSA-N	1	1	254.289	2.411	40	0		CEABMO
c1cnc(NCc2cncc3c2CC[N@@H+](CC2CC2)C3)nc1	ZINC000096189538	364407231	/nfs/dbraw/zinc/40/72/31/364407231.db2.gz	MJHYOSGPQFWXFK-UHFFFAOYSA-N	1	1	295.390	2.252	40	0		CEABMO
CC[C@@H](C)[N@@H+]1C[C@@H]2[C@H](C1)OCCN2Cc1cccc(C)n1	ZINC000096081820	364400746	/nfs/dbraw/zinc/40/07/46/364400746.db2.gz	YMFCTVLMXBBOSO-OIISXLGYSA-N	1	1	289.423	2.074	40	0		CEABMO
CC(C)C[N@@H+]1C[C@H]2CN(Cc3ccccn3)C[C@H]2C1	ZINC000096161604	364404805	/nfs/dbraw/zinc/40/48/05/364404805.db2.gz	HVQGCDBJNSSMQV-GASCZTMLSA-N	1	1	259.397	2.101	40	0		CEABMO
CO[C@H]1CC[N@@H+](Cc2cnn(C)c2)[C@H]1Cc1ccccc1	ZINC000096200376	364410082	/nfs/dbraw/zinc/41/00/82/364410082.db2.gz	NCUFDGSMLJRIFD-IRXDYDNUSA-N	1	1	285.391	2.252	40	0		CEABMO
c1cc(C[N@@H+]2CC[C@@]3(C[C@H](OCC4CC4)CO3)C2)ccn1	ZINC000096218377	364413326	/nfs/dbraw/zinc/41/33/26/364413326.db2.gz	HYDQXXYKNSXRQR-DLBZAZTESA-N	1	1	288.391	2.242	40	0		CEABMO
CC[N@H+]1C[C@@H](COC)[C@]2(CCN(Cc3ccoc3)C2)C1	ZINC000096220065	364415285	/nfs/dbraw/zinc/41/52/85/364415285.db2.gz	NLYQIEAQPCLCEY-JKSUJKDBSA-N	1	1	278.396	2.070	40	0		CEABMO
c1cc(-c2ncnc3c2CC[N@@H+](C[C@H]2CCOC2)CC3)co1	ZINC000096255179	364418827	/nfs/dbraw/zinc/41/88/27/364418827.db2.gz	QXVWLJBKJFVSPH-CYBMUJFWSA-N	1	1	299.374	2.174	40	0		CEABMO
C[C@H]1CCC[N@@H+](CCCNC(=S)Nc2ccncc2)C1	ZINC000225738234	370315221	/nfs/dbraw/zinc/31/52/21/370315221.db2.gz	QQRWBQPMADYGAC-ZDUSSCGKSA-N	1	1	292.452	2.490	40	0		CEABMO
CCO[C@H]1CSC2(C[NH+](Cc3cccnc3)C2)C1	ZINC000253385809	371513336	/nfs/dbraw/zinc/51/33/36/371513336.db2.gz	UQLPXGDPQAVOMY-CYBMUJFWSA-N	1	1	264.394	2.178	40	0		CEABMO
C[C@]12CCC[N@H+](Cc3ccccc3C(=O)[O-])[C@@H]1CCC[NH2+]2	ZINC000257269911	371610404	/nfs/dbraw/zinc/61/04/04/371610404.db2.gz	MRYCRACWZLSLHS-WBVHZDCISA-N	1	1	288.391	2.491	40	0		CEABMO
C[C@]12CCC[N@@H+](Cc3ccccc3C(=O)[O-])[C@@H]1CCC[NH2+]2	ZINC000257269911	371610410	/nfs/dbraw/zinc/61/04/10/371610410.db2.gz	MRYCRACWZLSLHS-WBVHZDCISA-N	1	1	288.391	2.491	40	0		CEABMO
Cc1cn[nH]c1[C@H]1CCCCN1Cc1cnccn1	ZINC000257224532	371610729	/nfs/dbraw/zinc/61/07/29/371610729.db2.gz	FCEYIJKJKWDVIU-CYBMUJFWSA-N	1	1	257.341	2.235	40	0		CEABMO
Cc1c[nH]c([C@@H]2CCCN(c3cc(C)ncn3)C2)[nH+]1	ZINC000257261218	371610985	/nfs/dbraw/zinc/61/09/85/371610985.db2.gz	LGFPBMUAAZGRQX-GFCCVEGCSA-N	1	1	257.341	2.201	40	0		CEABMO
COc1ccccc1[C@H]1CN(C(C)=O)CC[N@@H+]1CC1CC1	ZINC000257333294	371613647	/nfs/dbraw/zinc/61/36/47/371613647.db2.gz	YAZIIVBFCILWHQ-MRXNPFEDSA-N	1	1	288.391	2.310	40	0		CEABMO
COc1ccccc1[C@H]1CN(C(C)=O)CC[N@H+]1CC1CC1	ZINC000257333294	371613653	/nfs/dbraw/zinc/61/36/53/371613653.db2.gz	YAZIIVBFCILWHQ-MRXNPFEDSA-N	1	1	288.391	2.310	40	0		CEABMO
Cn1nc(C(F)(F)F)cc1C[NH2+]Cc1cccc(O)c1	ZINC000256050656	190003055	/nfs/dbraw/zinc/00/30/55/190003055.db2.gz	GACORSNNRBLFOM-UHFFFAOYSA-N	1	1	285.269	2.434	40	0		CEABMO
CCN(CC)CC[NH2+]Cc1cnn(C(C)C)c1C	ZINC000256052153	190004034	/nfs/dbraw/zinc/00/40/34/190004034.db2.gz	MCBVIKKNFAUEEP-UHFFFAOYSA-N	1	1	252.406	2.204	40	0		CEABMO
COc1cc(C[NH2+]Cc2ccn(CC(F)F)n2)ccc1O	ZINC000256053029	190004372	/nfs/dbraw/zinc/00/43/72/190004372.db2.gz	PRZKEGGXICYSIE-UHFFFAOYSA-N	1	1	297.305	2.152	40	0		CEABMO
COc1cc(C[NH2+]Cc2ccn(C(C)C)n2)ccc1O	ZINC000256054596	190005745	/nfs/dbraw/zinc/00/57/45/190005745.db2.gz	WYABIRVWUMPNFC-UHFFFAOYSA-N	1	1	275.352	2.468	40	0		CEABMO
Cc1cc(CN2CC[N@@H+](C)[C@H](c3ccccc3)C2)no1	ZINC000257203335	190011647	/nfs/dbraw/zinc/01/16/47/190011647.db2.gz	APOVHXINAXPTSD-INIZCTEOSA-N	1	1	271.364	2.472	40	0		CEABMO
Cc1cc(CN2CC[N@H+](C)[C@H](c3ccccc3)C2)no1	ZINC000257203335	190011648	/nfs/dbraw/zinc/01/16/48/190011648.db2.gz	APOVHXINAXPTSD-INIZCTEOSA-N	1	1	271.364	2.472	40	0		CEABMO
OC1(C[N@H+]2CCC[C@@H]2CCc2ccncc2)CCOCC1	ZINC000257206692	190011711	/nfs/dbraw/zinc/01/17/11/190011711.db2.gz	BENWPOZOAKHXDJ-MRXNPFEDSA-N	1	1	290.407	2.020	40	0		CEABMO
Cc1cc(C)n2ncc(C[N@H+]3CC[C@H](c4cc[nH]n4)C3)c2n1	ZINC000257251850	190019918	/nfs/dbraw/zinc/01/99/18/190019918.db2.gz	JSNBNUQNOBRHKI-ZDUSSCGKSA-N	1	1	296.378	2.059	40	0		CEABMO
CN(C)C(=O)C[N@H+]1CC[C@H](Cc2ccnc3ccccc23)C1	ZINC000257256364	190021278	/nfs/dbraw/zinc/02/12/78/190021278.db2.gz	KLCJDKOBQAQGAY-CQSZACIVSA-N	1	1	297.402	2.187	40	0		CEABMO
C[N@H+]1CCC[C@H]1c1ccnc(C(=O)NCC2CCC2)c1	ZINC000257299065	190029281	/nfs/dbraw/zinc/02/92/81/190029281.db2.gz	ROPNACTUHTXGMR-HNNXBMFYSA-N	1	1	273.380	2.378	40	0		CEABMO
CNC(=O)C[N@H+]1CCC[C@H](Cc2ccnc3ccccc23)C1	ZINC000257301960	190030071	/nfs/dbraw/zinc/03/00/71/190030071.db2.gz	SATMQXTYDLJWBH-CQSZACIVSA-N	1	1	297.402	2.235	40	0		CEABMO
Cc1c[nH]c([C@@H]2CC[N@@H+](Cc3cccc(C)n3)C2)n1	ZINC000257314831	190032418	/nfs/dbraw/zinc/03/24/18/190032418.db2.gz	UYQYGLOYQGJEBG-CYBMUJFWSA-N	1	1	256.353	2.411	40	0		CEABMO
Cc1c[nH]c([C@@H]2CCC[N@@H+](Cc3cnc(C)nc3)C2)n1	ZINC000257336817	190036201	/nfs/dbraw/zinc/03/62/01/190036201.db2.gz	YQDWZIKPSZRBOA-CQSZACIVSA-N	1	1	271.368	2.196	40	0		CEABMO
Cc1c[nH]c([C@H]2CC[N@H+](Cc3nccn3C(C)C)C2)n1	ZINC000257341307	190037082	/nfs/dbraw/zinc/03/70/82/190037082.db2.gz	ZJTUOMNAJHRKDQ-ZDUSSCGKSA-N	1	1	273.384	2.485	40	0		CEABMO
C[C@H]1C[C@@H](c2nc(Cc3cncs3)no2)CC[N@H+]1C	ZINC000333873858	380169352	/nfs/dbraw/zinc/16/93/52/380169352.db2.gz	SLJAEIDRJMUJCP-UWVGGRQHSA-N	1	1	278.381	2.315	40	0		CEABMO
Cc1cc([C@@H]2CCCC[N@@H+]2C)cnc1N1CCOCC1	ZINC000072219354	256707660	/nfs/dbraw/zinc/70/76/60/256707660.db2.gz	PVFLDBQEPOWSBI-HNNXBMFYSA-N	1	1	275.396	2.383	40	0		CEABMO
C[N@H+]1C[C@@H](CO)C[C@H]2c3cccc4[nH]cc(c43)C[C@@H]21	ZINC000005525668	394458158	/nfs/dbraw/zinc/45/81/58/394458158.db2.gz	UFKTZIXVYHGAES-XEGUGMAKSA-N	1	1	256.349	2.120	40	0		CEABMO
CC(C)[N@@H+]1CCC[C@@H]1c1cccnc1N1CCN(C)CC1	ZINC000072216581	394593109	/nfs/dbraw/zinc/59/31/09/394593109.db2.gz	URPAHDFOTZAADV-MRXNPFEDSA-N	1	1	288.439	2.379	40	0		CEABMO
CC(C)[N@H+]1CCC[C@@H]1c1cccnc1N1CCN(C)CC1	ZINC000072216581	394593111	/nfs/dbraw/zinc/59/31/11/394593111.db2.gz	URPAHDFOTZAADV-MRXNPFEDSA-N	1	1	288.439	2.379	40	0		CEABMO
CCC(=O)c1cnc(N2CC[NH+](CC)CC2)cc1C	ZINC000072223625	394594422	/nfs/dbraw/zinc/59/44/22/394594422.db2.gz	YDTBZBUWQKVSBM-UHFFFAOYSA-N	1	1	261.369	2.125	40	0		CEABMO
C[N@H+]1[C@H](Cc2ccccc2)C[C@@H]2NC(=O)CCCC[C@H]21	ZINC000257314795	394595384	/nfs/dbraw/zinc/59/53/84/394595384.db2.gz	UYMADQTZQSNKRL-OWCLPIDISA-N	1	1	272.392	2.361	40	0		CEABMO
[NH3+][C@@H]1C(=O)N(c2ccc(F)cc2)[C@@H]1c1ccccc1F	ZINC000072227242	394595553	/nfs/dbraw/zinc/59/55/53/394595553.db2.gz	ISINHULIJDRCSJ-UONOGXRCSA-N	1	1	274.270	2.380	40	0		CEABMO
COC(=O)[C@H]1C[C@@H]2Cc3c4ccccc4[nH]c3C[N@H+]2C1	ZINC000095828946	394674530	/nfs/dbraw/zinc/67/45/30/394674530.db2.gz	OVDBJAVMIFIMFA-WDEREUQCSA-N	1	1	270.332	2.088	40	0		CEABMO
Cc1[nH+]ccn1Cc1ccc(C(=O)NC[C@H]2CCCO2)cc1	ZINC000038849109	174158469	/nfs/dbraw/zinc/15/84/69/174158469.db2.gz	SQWNPNKWMFFRSG-MRXNPFEDSA-N	1	1	299.374	2.149	40	0		CEABMO
O=C1NCC[NH2+][C@H]1Cc1ccccc1-c1ccc(F)cc1	ZINC000072352866	176374305	/nfs/dbraw/zinc/37/43/05/176374305.db2.gz	PBYAARISYWMKCB-INIZCTEOSA-N	1	1	284.334	2.123	40	0		CEABMO
Cc1cc(Nc2cnccn2)nc([C@H]2CCC[N@H+](C)C2)n1	ZINC000072359948	176376639	/nfs/dbraw/zinc/37/66/39/176376639.db2.gz	OOWFHNZAELRRSJ-LBPRGKRZSA-N	1	1	284.367	2.128	40	0		CEABMO
CC(C)(C)C[N@H+]1CCC[C@@H]1c1cc(CCO)n[nH]1	ZINC000072361185	176377754	/nfs/dbraw/zinc/37/77/54/176377754.db2.gz	TVADGCXWYNLUEV-CYBMUJFWSA-N	1	1	251.374	2.128	40	0		CEABMO
Cn1ccnc1C[N@H+]1CC[C@@H](Cc2cnc3[nH]ccc3c2)C1	ZINC000072367629	176382635	/nfs/dbraw/zinc/38/26/35/176382635.db2.gz	YRVZWOROUXBZLH-ZDUSSCGKSA-N	1	1	295.390	2.361	40	0		CEABMO
Cc1nc(C(=O)N2CCC[C@@H](Cn3cc[nH+]c3C)C2)co1	ZINC000072368586	176383579	/nfs/dbraw/zinc/38/35/79/176383579.db2.gz	ILMNNHYUYBBMAO-ZDUSSCGKSA-N	1	1	288.351	2.040	40	0		CEABMO
COc1ccccc1C[N@H+]1CC[C@H](c2cc[nH]n2)C1	ZINC000072385091	176389292	/nfs/dbraw/zinc/38/92/92/176389292.db2.gz	IIXIIHNJDARDBR-LBPRGKRZSA-N	1	1	257.337	2.408	40	0		CEABMO
CNc1cncc([C@@H]2CCC[N@H+]2CC2CCOCC2)n1	ZINC000072386143	176390938	/nfs/dbraw/zinc/39/09/38/176390938.db2.gz	KOCHMYYWFWBQEA-AWEZNQCLSA-N	1	1	276.384	2.082	40	0		CEABMO
C[C@@H]1C[N@H+]2CCC[C@@H]2CN1Cc1ccc2nccnc2c1	ZINC000072397552	176394982	/nfs/dbraw/zinc/39/49/82/176394982.db2.gz	DGNKJJSYRULZBU-UKRRQHHQSA-N	1	1	282.391	2.298	40	0		CEABMO
CNC(=O)[C@@]1(C)CCC[N@@H+](CCc2ccccc2)C1	ZINC000072363744	277246942	/nfs/dbraw/zinc/24/69/42/277246942.db2.gz	QWHWSTJRZRVUHJ-INIZCTEOSA-N	1	1	260.381	2.077	40	0		CEABMO
CNC(=O)c1sc2nc([C@@H]3CCC[N@H+]3C)ccc2c1N	ZINC000257328138	277262408	/nfs/dbraw/zinc/26/24/08/277262408.db2.gz	XEIIAEWHJZFPKD-JTQLQIEISA-N	1	1	290.392	2.005	40	0		CEABMO
CC[C@H]1CO[C@@]2(C1)CCCN(CCC[NH+](C)C)C2	ZINC000096089830	281213650	/nfs/dbraw/zinc/21/36/50/281213650.db2.gz	YVLONVXWSIRREV-HUUCEWRRSA-N	1	1	254.418	2.219	40	0		CEABMO
[NH3+][C@H](c1nc(-c2cccnc2)n[nH]1)c1ccc(F)cc1	ZINC000095533269	185005605	/nfs/dbraw/zinc/00/56/05/185005605.db2.gz	OGBPYRGBKXBVKA-LBPRGKRZSA-N	1	1	269.283	2.054	40	0		CEABMO
c1cc(C[N@H+]2CC[C@H]3C[C@@H](c4ccncn4)O[C@@H]3C2)co1	ZINC000096046320	185071986	/nfs/dbraw/zinc/07/19/86/185071986.db2.gz	RZOJRIJHZIEZQV-CWRNSKLLSA-N	1	1	285.347	2.422	40	0		CEABMO
Cc1ccc(C[N@H+]2CCC[C@@]3(CCC(=O)N3)CC2)o1	ZINC000096047446	185073655	/nfs/dbraw/zinc/07/36/55/185073655.db2.gz	AGJNDVKMEDECIK-OAHLLOKOSA-N	1	1	262.353	2.223	40	0		CEABMO
Cc1ccc(C[N@H+]2CC[C@H]3[C@H]2CCN3c2nncs2)o1	ZINC000096055864	185075434	/nfs/dbraw/zinc/07/54/34/185075434.db2.gz	WXFRSUPFPQXLEZ-OLZOCXBDSA-N	1	1	290.392	2.293	40	0		CEABMO
c1csc(C[N@H+]2CC[C@H]3[C@H]2CCN3c2nncs2)c1	ZINC000096055860	185076448	/nfs/dbraw/zinc/07/64/48/185076448.db2.gz	SGCLYRBCVBYYGT-NEPJUHHUSA-N	1	1	292.433	2.453	40	0		CEABMO
c1csc(CN2C[C@H]3C[C@@H](C2)[N@@H+](CC2CC2)C3)n1	ZINC000096058488	185078558	/nfs/dbraw/zinc/07/85/58/185078558.db2.gz	GAELOKHALGISRV-OLZOCXBDSA-N	1	1	263.410	2.059	40	0		CEABMO
C[C@@H]1CO[C@]2(CC[N@H+](Cc3ccncc3F)C2)C1	ZINC000096071987	185086879	/nfs/dbraw/zinc/08/68/79/185086879.db2.gz	GKZYVOPGVFRSEM-SMDDNHRTSA-N	1	1	250.317	2.222	40	0		CEABMO
C[C@@H]1CO[C@]2(CC[N@@H+](Cc3ccncc3F)C2)C1	ZINC000096071987	185086880	/nfs/dbraw/zinc/08/68/80/185086880.db2.gz	GKZYVOPGVFRSEM-SMDDNHRTSA-N	1	1	250.317	2.222	40	0		CEABMO
Cc1cccc(C[N@H+]2CC[C@@H]3[C@@H]2CCN3C(=O)CC2CC2)n1	ZINC000096064038	185084541	/nfs/dbraw/zinc/08/45/41/185084541.db2.gz	FOLVORGUAWZTQQ-DLBZAZTESA-N	1	1	299.418	2.365	40	0		CEABMO
COc1ncccc1C[N@H+]1CCC[C@]2(C[C@@H](C)CO2)C1	ZINC000096073320	185088070	/nfs/dbraw/zinc/08/80/70/185088070.db2.gz	PZNARHRGJCPOAI-CJNGLKHVSA-N	1	1	276.380	2.481	40	0		CEABMO
COCC[C@H]1CO[C@@]2(C1)CCC[N@@H+](Cc1ccncc1)C2	ZINC000096089850	185094718	/nfs/dbraw/zinc/09/47/18/185094718.db2.gz	HVAHXPKUFJYZSK-IAGOWNOFSA-N	1	1	290.407	2.489	40	0		CEABMO
OC[C@@H]1CC[N@H+](Cc2ccc(Br)s2)C1	ZINC000051886907	362444787	/nfs/dbraw/zinc/44/47/87/362444787.db2.gz	IXLDBECTSVKLKO-MRVPVSSYSA-N	1	1	276.199	2.325	40	0		CEABMO
OC[C@@H]1CC[N@@H+](Cc2ccc(Br)s2)C1	ZINC000051886907	362444793	/nfs/dbraw/zinc/44/47/93/362444793.db2.gz	IXLDBECTSVKLKO-MRVPVSSYSA-N	1	1	276.199	2.325	40	0		CEABMO
O=C(N[C@@H]1CCC[C@@H]1[NH2+]C1CCCC1)C(F)(F)F	ZINC000409439623	344889780	/nfs/dbraw/zinc/88/97/80/344889780.db2.gz	HRFGSGJDFQTKIY-VHSXEESVSA-N	1	1	264.291	2.118	40	0		CEABMO
CC(C)CC[N@H+]1C[C@H]2CN(c3ncccn3)CC[C@@H]21	ZINC000585107981	345006118	/nfs/dbraw/zinc/00/61/18/345006118.db2.gz	PYXNWZCQMGQFSB-KBPBESRZSA-N	1	1	260.385	2.033	40	0		CEABMO
Cc1ccccc1C[C@H]1CC[N@H+](Cc2cc[nH]n2)C[C@@H]1O	ZINC000585277703	345010178	/nfs/dbraw/zinc/01/01/78/345010178.db2.gz	KROPUGYZLNSLCL-WBVHZDCISA-N	1	1	285.391	2.144	40	0		CEABMO
Cc1ccccc1C[C@H]1CC[N@@H+](Cc2cc[nH]n2)C[C@@H]1O	ZINC000585277703	345010181	/nfs/dbraw/zinc/01/01/81/345010181.db2.gz	KROPUGYZLNSLCL-WBVHZDCISA-N	1	1	285.391	2.144	40	0		CEABMO
C[NH+](C)[C@@H](C(=O)NCCOc1ccccc1)c1ccccc1	ZINC000066041700	362849749	/nfs/dbraw/zinc/84/97/49/362849749.db2.gz	GXYHVUPZGMRDAP-QGZVFWFLSA-N	1	1	298.386	2.485	40	0		CEABMO
CCOC(=O)c1ccc(NC(=O)[C@H]2CCC[N@@H+](C)C2)cc1	ZINC000081223415	363706438	/nfs/dbraw/zinc/70/64/38/363706438.db2.gz	BJHHWNNCPGMSSF-ZDUSSCGKSA-N	1	1	290.363	2.144	40	0		CEABMO
COc1ccc2c(c1)CC[N@@H+]([C@H]1CCC[C@H](O)C1)C2	ZINC000001672615	361215839	/nfs/dbraw/zinc/21/58/39/361215839.db2.gz	FWTBJEAJFRCRAA-GJZGRUSLSA-N	1	1	261.365	2.357	40	0		CEABMO
Cc1cc(C)n(-c2cccc(C[N@H+]3CC[C@@H](CO)C3)c2)n1	ZINC000012182978	361374601	/nfs/dbraw/zinc/37/46/01/361374601.db2.gz	PWVVSECIEMSCFF-MRXNPFEDSA-N	1	1	285.391	2.303	40	0		CEABMO
C[N@H+]1CCC[C@@H](NC(=O)c2cc(-c3cccs3)no2)C1	ZINC000012183381	361376147	/nfs/dbraw/zinc/37/61/47/361376147.db2.gz	WXDRKDWXONLYAI-SNVBAGLBSA-N	1	1	291.376	2.227	40	0		CEABMO
OC[C@@H]1CCC[N@@H+](Cc2c[nH]nc2-c2cccs2)C1	ZINC000019343909	361528403	/nfs/dbraw/zinc/52/84/03/361528403.db2.gz	WKDVEJYTSKGIDE-LLVKDONJSA-N	1	1	277.393	2.343	40	0		CEABMO
COC(=O)[C@H]1C[C@H]2c3[nH]c4ccccc4c3CC[N@@H+]2C1	ZINC000031719760	361716860	/nfs/dbraw/zinc/71/68/60/361716860.db2.gz	XKJYWJCEEMLZSB-HZMBPMFUSA-N	1	1	270.332	2.260	40	0		CEABMO
CN(C)c1ccc(C(=O)[C@@H]([NH2+]CCO)c2ccccc2)cc1	ZINC000031923993	361722966	/nfs/dbraw/zinc/72/29/66/361722966.db2.gz	CGIOYKJMHUKLCS-KRWDZBQOSA-N	1	1	298.386	2.259	40	0		CEABMO
C[N@H+]1CC[C@]2(c3ccccc3)CCN(C(=O)NC3CC3)C[C@H]12	ZINC000096251832	364415970	/nfs/dbraw/zinc/41/59/70/364415970.db2.gz	UHTREDXJIPCEJL-FUHWJXTLSA-N	1	1	299.418	2.206	40	0		CEABMO
CCOc1ncnc2c1CC[N@@H+](Cc1ccco1)CC2	ZINC000096255595	364418427	/nfs/dbraw/zinc/41/84/27/364418427.db2.gz	CVZMLRKOAQXMAZ-UHFFFAOYSA-N	1	1	273.336	2.069	40	0		CEABMO
O=C(C1CC(F)C1)N1CC[C@]2(CCC[N@H+]2CC2CC2)C1	ZINC000585099446	367177290	/nfs/dbraw/zinc/17/72/90/367177290.db2.gz	JQWITSVSWLRZDA-ZBCRRDGASA-N	1	1	280.387	2.211	40	0		CEABMO
C[C@@H]1c2ncc(CCOCc3cccnc3)n2CC[N@@H+]1C	ZINC000585098498	367177368	/nfs/dbraw/zinc/17/73/68/367177368.db2.gz	UFFJNVXQLWWGEF-CYBMUJFWSA-N	1	1	286.379	2.044	40	0		CEABMO
C[C@@H](c1ccccc1)[N@H+]1CCC[C@]2(CN(C)C2=O)C1	ZINC000585099434	367178248	/nfs/dbraw/zinc/17/82/48/367178248.db2.gz	JIYHEDORYCDKBB-BBRMVZONSA-N	1	1	258.365	2.302	40	0		CEABMO
CO[C@H]1Cn2nccc2C[N@@H+](Cc2cccc3[nH]ccc32)C1	ZINC000247887421	371145008	/nfs/dbraw/zinc/14/50/08/371145008.db2.gz	RYHGMHMVWRJVIR-OAHLLOKOSA-N	1	1	296.374	2.395	40	0		CEABMO
CCCn1nccc1C[NH2+]Cc1ccnn1C(F)F	ZINC000256053091	190004524	/nfs/dbraw/zinc/00/45/24/190004524.db2.gz	PYMPTLVHUKPZOU-UHFFFAOYSA-N	1	1	269.299	2.175	40	0		CEABMO
Cc1cc(-c2cccc(C[C@H]3CC[N@H+](C)C3)n2)n[nH]1	ZINC000257228237	190015862	/nfs/dbraw/zinc/01/58/62/190015862.db2.gz	FSYXVKKUTKPCQJ-GFCCVEGCSA-N	1	1	256.353	2.274	40	0		CEABMO
Nc1nccc([C@@H]2CCCC[N@@H+]2Cc2ccoc2)n1	ZINC000257216218	190014308	/nfs/dbraw/zinc/01/43/08/190014308.db2.gz	CTPHEJYLSGOSDZ-ZDUSSCGKSA-N	1	1	258.325	2.379	40	0		CEABMO
Nc1nccc([C@@H]2CCCC[N@H+]2Cc2ccoc2)n1	ZINC000257216218	190014309	/nfs/dbraw/zinc/01/43/09/190014309.db2.gz	CTPHEJYLSGOSDZ-ZDUSSCGKSA-N	1	1	258.325	2.379	40	0		CEABMO
COc1ncc(C[NH+]2CC(Cc3ccccc3)C2)cn1	ZINC000257246398	190019385	/nfs/dbraw/zinc/01/93/85/190019385.db2.gz	ITYYJCWCQRTQJS-UHFFFAOYSA-N	1	1	269.348	2.160	40	0		CEABMO
CN(C)C(=O)C[N@H+]1CC[C@@H](Cc2ccnc3ccccc23)C1	ZINC000257256363	190021726	/nfs/dbraw/zinc/02/17/26/190021726.db2.gz	KLCJDKOBQAQGAY-AWEZNQCLSA-N	1	1	297.402	2.187	40	0		CEABMO
CCN1CCC([N@@H+]2CCC[C@H]2c2cncc(NC)n2)CC1	ZINC000257279022	190025442	/nfs/dbraw/zinc/02/54/42/190025442.db2.gz	OERJLGCCLVYGMV-HNNXBMFYSA-N	1	1	289.427	2.140	40	0		CEABMO
CCN1CCC([N@H+]2CCC[C@H]2c2cncc(NC)n2)CC1	ZINC000257279022	190025443	/nfs/dbraw/zinc/02/54/43/190025443.db2.gz	OERJLGCCLVYGMV-HNNXBMFYSA-N	1	1	289.427	2.140	40	0		CEABMO
CCN1CCC([N@H+]2CCC[C@@H](Cc3cc[nH]n3)C2)CC1	ZINC000257279207	190025657	/nfs/dbraw/zinc/02/56/57/190025657.db2.gz	OFNJQCAGCXYEDY-AWEZNQCLSA-N	1	1	276.428	2.149	40	0		CEABMO
CCCn1ccnc1C[N@@H+]1CCC[C@H](Cc2cc[nH]n2)C1	ZINC000257296170	190028637	/nfs/dbraw/zinc/02/86/37/190028637.db2.gz	RBNBSYAIRVKEHB-CQSZACIVSA-N	1	1	287.411	2.471	40	0		CEABMO
CCCn1ccnc1C[N@H+]1CCC[C@H](Cc2cc[nH]n2)C1	ZINC000257296170	190028638	/nfs/dbraw/zinc/02/86/38/190028638.db2.gz	RBNBSYAIRVKEHB-CQSZACIVSA-N	1	1	287.411	2.471	40	0		CEABMO
Cc1c[nH]c([C@H]2CC[N@@H+](Cc3ccc4c(c3)OCCO4)C2)n1	ZINC000257302311	190030121	/nfs/dbraw/zinc/03/01/21/190030121.db2.gz	SCLOOZZVXGRDNI-AWEZNQCLSA-N	1	1	299.374	2.479	40	0		CEABMO
CNc1cc([C@H]2CCC[N@@H+](Cc3cnc[nH]3)C2)ccn1	ZINC000257306601	190031029	/nfs/dbraw/zinc/03/10/29/190031029.db2.gz	SUZQPSZYLGEKGB-ZDUSSCGKSA-N	1	1	271.368	2.226	40	0		CEABMO
CNc1cc([C@H]2CCC[N@H+](Cc3c[nH]cn3)C2)ccn1	ZINC000257306601	190031030	/nfs/dbraw/zinc/03/10/30/190031030.db2.gz	SUZQPSZYLGEKGB-ZDUSSCGKSA-N	1	1	271.368	2.226	40	0		CEABMO
CNc1cc([C@H]2CCC[N@@H+](Cc3c[nH]cn3)C2)ccn1	ZINC000257306601	190031031	/nfs/dbraw/zinc/03/10/31/190031031.db2.gz	SUZQPSZYLGEKGB-ZDUSSCGKSA-N	1	1	271.368	2.226	40	0		CEABMO
Cc1nccnc1CC[C@@H]1COCC[N@H+]1C1CCCC1	ZINC000257311252	190032025	/nfs/dbraw/zinc/03/20/25/190032025.db2.gz	UIRQYHKKPBEYEY-OAHLLOKOSA-N	1	1	275.396	2.361	40	0		CEABMO
CCN1CCC([N@@H+]2CC[C@H](c3nc(C)cc(C)n3)C2)CC1	ZINC000257313417	190032092	/nfs/dbraw/zinc/03/20/92/190032092.db2.gz	USHNNOOJYFGJOY-HNNXBMFYSA-N	1	1	288.439	2.367	40	0		CEABMO
CCN1CCC([N@H+]2CC[C@H](c3nc(C)cc(C)n3)C2)CC1	ZINC000257313417	190032093	/nfs/dbraw/zinc/03/20/93/190032093.db2.gz	USHNNOOJYFGJOY-HNNXBMFYSA-N	1	1	288.439	2.367	40	0		CEABMO
CCC[N@H+]1CC[C@@](C)(O)[C@@H](NC(C)=O)[C@@H]1c1ccccc1	ZINC000514289045	379130057	/nfs/dbraw/zinc/13/00/57/379130057.db2.gz	FKNOUTVFSJYEMD-YESZJQIVSA-N	1	1	290.407	2.099	40	0	biogenic,in-vitro	CEABMO
Cc1cccc(N2CCc3ncnc(C)c3CC2)[nH+]1	ZINC000096254962	256835950	/nfs/dbraw/zinc/83/59/50/256835950.db2.gz	XUPGQAJRWXSOSG-UHFFFAOYSA-N	1	1	254.337	2.094	40	0		CEABMO
C/C=C1\C[N@H+]2CC[C@]34c5ccccc5N[C@H]3[C@@H](CO)[C@H]1C[C@H]24	ZINC000004000056	394454090	/nfs/dbraw/zinc/45/40/90/394454090.db2.gz	GNFMIIWVXDLWDU-ODYUKXNZSA-N	1	1	296.414	2.381	40	0		CEABMO
CC[N@H+]1CCC[C@H]1c1cnc(N2CCOCC2)cc1C	ZINC000072219392	394594303	/nfs/dbraw/zinc/59/43/03/394594303.db2.gz	UZIOCKPUEFRHDM-HNNXBMFYSA-N	1	1	275.396	2.383	40	0		CEABMO
O=C1[C@@H]2C[N@@H+](Cc3ccoc3)C[C@H]2CN1c1ccccc1	ZINC000247754059	394535401	/nfs/dbraw/zinc/53/54/01/394535401.db2.gz	UYUUZRNEUPLYLI-GOEBONIOSA-N	1	1	282.343	2.374	40	0		CEABMO
Cc1ccc([C@@H]2[C@H]([NH3+])C(=O)N2Cc2ccc(F)cc2)o1	ZINC000072228210	394596618	/nfs/dbraw/zinc/59/66/18/394596618.db2.gz	HSLBPAIYUNHBMV-UONOGXRCSA-N	1	1	274.295	2.138	40	0		CEABMO
COc1ccc([C@H]2[C@H]([NH3+])C(=O)N2c2ccccc2)cc1	ZINC000072227335	286380855	/nfs/dbraw/zinc/38/08/55/286380855.db2.gz	ZFSHBMDUBOZWOL-GJZGRUSLSA-N	1	1	268.316	2.110	40	0		CEABMO
C[C@H]1CCCC[N@H+]1C[C@H](O)COc1ccc(F)cc1	ZINC000006007985	170168004	/nfs/dbraw/zinc/16/80/04/170168004.db2.gz	WWQSPLICWQFGRY-JSGCOSHPSA-N	1	1	267.344	2.440	40	0		CEABMO
C[N@H+]1CCC[C@H](CNC(=S)NC2CCCCC2)C1	ZINC000009876487	170388473	/nfs/dbraw/zinc/38/84/73/170388473.db2.gz	BDYLCLLFPJYFFA-GFCCVEGCSA-N	1	1	269.458	2.125	40	0		CEABMO
Cn1ccnc1C[NH+]1CCC(Cc2ccccn2)CC1	ZINC000072364314	176379437	/nfs/dbraw/zinc/37/94/37/176379437.db2.gz	BIOOZUJYVJUYHO-UHFFFAOYSA-N	1	1	270.380	2.270	40	0		CEABMO
Nc1nccc([C@H]2CCCC[N@@H+]2Cc2ccncc2)n1	ZINC000072385030	176389391	/nfs/dbraw/zinc/38/93/91/176389391.db2.gz	INPYOAXAKFBOBX-CQSZACIVSA-N	1	1	269.352	2.181	40	0		CEABMO
Nc1nccc([C@H]2CCCC[N@H+]2Cc2ccncc2)n1	ZINC000072385030	176389392	/nfs/dbraw/zinc/38/93/92/176389392.db2.gz	INPYOAXAKFBOBX-CQSZACIVSA-N	1	1	269.352	2.181	40	0		CEABMO
CSc1ccc(CN2C[C@@H]3C[C@@H](O)C[N@H+]3C[C@@H]2C)cc1	ZINC000072397603	176395095	/nfs/dbraw/zinc/39/50/95/176395095.db2.gz	QERHHOFNCGADLU-AEGPPILISA-N	1	1	292.448	2.048	40	0		CEABMO
O[C@@H]1CCC[N@@H+](Cc2ccc3cc(F)ccc3n2)C1	ZINC000072397881	176395556	/nfs/dbraw/zinc/39/55/56/176395556.db2.gz	NLZAFJLPHIHDAB-CQSZACIVSA-N	1	1	260.312	2.331	40	0		CEABMO
C[N@H+]1CCC[C@@H](C(=O)NCCSc2ccccc2)C1	ZINC000078578500	177355985	/nfs/dbraw/zinc/35/59/85/177355985.db2.gz	MBXBTNNRZOOMDP-CYBMUJFWSA-N	1	1	278.421	2.237	40	0		CEABMO
CC[N@H+]1CCCC12CCN(C(=O)C1CCC1)CC2	ZINC000096075211	276152641	/nfs/dbraw/zinc/15/26/41/276152641.db2.gz	QYYKUWAGKAZNDX-UHFFFAOYSA-N	1	1	250.386	2.263	40	0		CEABMO
C[N@@H+]1CCC[C@H](Cn2c(=O)c3ccccc3[nH]c2=S)C1	ZINC000009876570	277074069	/nfs/dbraw/zinc/07/40/69/277074069.db2.gz	QKSSWUPLNHXNGD-NSHDSACASA-N	1	1	289.404	2.401	40	0		CEABMO
C[N@H+]1CCC[C@H](Cn2c(=O)c3ccccc3[nH]c2=S)C1	ZINC000009876570	277074071	/nfs/dbraw/zinc/07/40/71/277074071.db2.gz	QKSSWUPLNHXNGD-NSHDSACASA-N	1	1	289.404	2.401	40	0		CEABMO
CCN1CCC([N@@H+]2CCC[C@@H]2c2ccnc(C)n2)CC1	ZINC000257204931	279258676	/nfs/dbraw/zinc/25/86/76/279258676.db2.gz	AWXRMTKEURLRIC-MRXNPFEDSA-N	1	1	274.412	2.406	40	0		CEABMO
CCN1CCC([N@H+]2CCC[C@@H]2c2ccnc(C)n2)CC1	ZINC000257204931	279258677	/nfs/dbraw/zinc/25/86/77/279258677.db2.gz	AWXRMTKEURLRIC-MRXNPFEDSA-N	1	1	274.412	2.406	40	0		CEABMO
CC[NH+]1CCN(C(=O)c2ccc(C)cc2Cl)CC1	ZINC000204013095	652553455	/nfs/dbraw/zinc/55/34/55/652553455.db2.gz	JWIMNLSOJZEGLT-UHFFFAOYSA-N	1	1	266.772	2.426	40	0		CEABMO
c1ccc(COC[C@H]2[NH2+]CCc3c2nnn3CC2CC2)cc1	ZINC000096045424	185071629	/nfs/dbraw/zinc/07/16/29/185071629.db2.gz	WGBJRDKPXGBEAF-OAHLLOKOSA-N	1	1	298.390	2.092	40	0		CEABMO
Cn1ncc2c1C[N@@H+](CC1CC1)C[C@@H]2COc1cccnc1	ZINC000096044665	185072024	/nfs/dbraw/zinc/07/20/24/185072024.db2.gz	DJVHDSRPUZCCMX-CQSZACIVSA-N	1	1	298.390	2.203	40	0		CEABMO
c1cn([C@@H]2CO[C@@]3(C2)CCC[N@H+](Cc2cccnc2)C3)cn1	ZINC000096048565	185073285	/nfs/dbraw/zinc/07/32/85/185073285.db2.gz	SVZHDVPNTPYDSM-DLBZAZTESA-N	1	1	298.390	2.274	40	0		CEABMO
c1cncc(O[C@@H]2CO[C@@]3(C2)CCC[N@H+](CC2CC2)C3)c1	ZINC000096048279	185073345	/nfs/dbraw/zinc/07/33/45/185073345.db2.gz	ZBFMLLPEFXQEAR-DLBZAZTESA-N	1	1	288.391	2.494	40	0		CEABMO
CC[NH+]1CCN(C(=O)CCc2ccc(C)c(C)c2)CC1	ZINC000096621646	185108237	/nfs/dbraw/zinc/10/82/37/185108237.db2.gz	CBLVGNPYVNWISR-UHFFFAOYSA-N	1	1	274.408	2.400	40	0		CEABMO
OC[C@@H]1CCC[N@H+]1Cc1ccc2cc(F)ccc2n1	ZINC000096836636	185116049	/nfs/dbraw/zinc/11/60/49/185116049.db2.gz	DXORDVFADAXAKL-AWEZNQCLSA-N	1	1	260.312	2.331	40	0		CEABMO
COc1ccccc1-c1nnc([C@H]2CC[N@@H+](C)C2)o1	ZINC000049170012	362343398	/nfs/dbraw/zinc/34/33/98/362343398.db2.gz	NOJIXMROCHCFLR-JTQLQIEISA-N	1	1	259.309	2.164	40	0	biogenic,in-vitro	CEABMO
CC(C)[N@H+]1CCC[C@H](c2cncc(-c3cn[nH]c3)n2)C1	ZINC000585177420	345009122	/nfs/dbraw/zinc/00/91/22/345009122.db2.gz	HAXGOSBMMNFPLA-LBPRGKRZSA-N	1	1	271.368	2.455	40	0		CEABMO
CCCCOC(=O)[C@H]([NH3+])Cc1c[nH]c2ccccc12	ZINC000055145674	362544662	/nfs/dbraw/zinc/54/46/62/362544662.db2.gz	YBWXYSUDFGURNJ-CYBMUJFWSA-N	1	1	260.337	2.381	40	0		CEABMO
C[N@H+]1CC[C@]2(C1)CCCN(C(=O)Cc1ccccc1)C2	ZINC000063527687	362769597	/nfs/dbraw/zinc/76/95/97/362769597.db2.gz	LGTKLYXZCDAJEQ-KRWDZBQOSA-N	1	1	272.392	2.173	40	0		CEABMO
CC(C)(C)OC(=O)N[C@H]1CC[N@@H+](CC2CCC2)C1	ZINC000067800921	362925864	/nfs/dbraw/zinc/92/58/64/362925864.db2.gz	JAEIGTZUFFYNQO-LBPRGKRZSA-N	1	1	254.374	2.386	40	0		CEABMO
CNc1cccc([C@@H]2CCC[N@H+]2C2CCOCC2)n1	ZINC000072364350	363131319	/nfs/dbraw/zinc/13/13/19/363131319.db2.gz	HCJXIIZDKDOSPO-AWEZNQCLSA-N	1	1	261.369	2.439	40	0		CEABMO
OCC[N@H+](C[C@@H]1CCCN(Cc2ccccc2)C1)C1CC1	ZINC000079393555	363593827	/nfs/dbraw/zinc/59/38/27/363593827.db2.gz	CXELYOQSQLGQQG-QGZVFWFLSA-N	1	1	288.435	2.355	40	0		CEABMO
OCC[N@@H+](C[C@@H]1CCCN(Cc2ccccc2)C1)C1CC1	ZINC000079393555	363593832	/nfs/dbraw/zinc/59/38/32/363593832.db2.gz	CXELYOQSQLGQQG-QGZVFWFLSA-N	1	1	288.435	2.355	40	0		CEABMO
OCCN1CCC[C@@H]([N@@H+](Cc2ccccc2)C2CC2)C1	ZINC000079414385	363597259	/nfs/dbraw/zinc/59/72/59/363597259.db2.gz	JXRXSROUZBNDSX-QGZVFWFLSA-N	1	1	274.408	2.108	40	0		CEABMO
OCC[N@@H+]1CCC[C@@H](N(Cc2ccccc2)C2CC2)C1	ZINC000079414385	363597268	/nfs/dbraw/zinc/59/72/68/363597268.db2.gz	JXRXSROUZBNDSX-QGZVFWFLSA-N	1	1	274.408	2.108	40	0		CEABMO
OCC[N@H+]1CCC[C@@H](N(Cc2ccccc2)C2CC2)C1	ZINC000079414385	363597273	/nfs/dbraw/zinc/59/72/73/363597273.db2.gz	JXRXSROUZBNDSX-QGZVFWFLSA-N	1	1	274.408	2.108	40	0		CEABMO
CCC[N@H+]1C[C@@H]2CC[C@@]3(CC(C)=NN3C(C)=O)[C@H]2C1	ZINC000306134562	283354651	/nfs/dbraw/zinc/35/46/51/283354651.db2.gz	NRUNORKAOHBWII-SOUVJXGZSA-N	1	1	263.385	2.105	40	0		CEABMO
Nc1ccc(C(=O)NC[C@H]2CCC[N@H+]3CCCC[C@H]23)cc1	ZINC000005394827	361332543	/nfs/dbraw/zinc/33/25/43/361332543.db2.gz	MKNQZZGCGYYGOH-GDBMZVCRSA-N	1	1	287.407	2.263	40	0		CEABMO
CCn1cc(C[N@H+](CCO)Cc2cccs2)c(C)n1	ZINC000013997507	361446440	/nfs/dbraw/zinc/44/64/40/361446440.db2.gz	BOAHCJIOMAPHAQ-UHFFFAOYSA-N	1	1	279.409	2.267	40	0		CEABMO
CCn1cc(C[N@@H+](CCO)Cc2cccs2)c(C)n1	ZINC000013997507	361446444	/nfs/dbraw/zinc/44/64/44/361446444.db2.gz	BOAHCJIOMAPHAQ-UHFFFAOYSA-N	1	1	279.409	2.267	40	0		CEABMO
Cc1c(C[N@H+]2CC[C@H](CO)C2)cnn1Cc1ccccc1	ZINC000019554516	361543544	/nfs/dbraw/zinc/54/35/44/361543544.db2.gz	OSMQXVRCEJBKQR-INIZCTEOSA-N	1	1	285.391	2.054	40	0		CEABMO
C[C@H]1CCCC[N@H+]1C[C@@H](O)COc1ccc(F)cc1	ZINC000026781224	361644693	/nfs/dbraw/zinc/64/46/93/361644693.db2.gz	WWQSPLICWQFGRY-GXTWGEPZSA-N	1	1	267.344	2.440	40	0		CEABMO
Cc1ccc(C[N@H+]2CC[C@@H]3[C@@H]2CCN3C(=O)c2ccc[nH]2)o1	ZINC000096184687	364407514	/nfs/dbraw/zinc/40/75/14/364407514.db2.gz	DUJGFDNVRZJCEX-JKSUJKDBSA-N	1	1	299.374	2.405	40	0		CEABMO
CCC[N@H+]1CC[C@]2(C[C@@H]2C(=O)N(C)Cc2ccccn2)C1	ZINC000096159202	364403116	/nfs/dbraw/zinc/40/31/16/364403116.db2.gz	LKCKXOLVHVLMBV-WBVHZDCISA-N	1	1	287.407	2.162	40	0		CEABMO
CC[C@@H](C)[N@@H+]1C[C@H]2CN(Cc3ccccn3)C[C@H]2C1	ZINC000096161606	364404858	/nfs/dbraw/zinc/40/48/58/364404858.db2.gz	NQIJXWNUFWUPJI-KFWWJZLASA-N	1	1	259.397	2.244	40	0		CEABMO
COC[C@@H]1c2c(cnn2C)CC[N@H+]1Cc1cccc(C)c1	ZINC000096197726	364409111	/nfs/dbraw/zinc/40/91/11/364409111.db2.gz	UJKDVKJBBQVYPK-MRXNPFEDSA-N	1	1	285.391	2.474	40	0		CEABMO
COC[C@@H]1c2c(cnn2C)CC[N@@H+]1Cc1cccc(C)c1	ZINC000096197726	364409115	/nfs/dbraw/zinc/40/91/15/364409115.db2.gz	UJKDVKJBBQVYPK-MRXNPFEDSA-N	1	1	285.391	2.474	40	0		CEABMO
C[N@@H+](Cc1ccccc1)[C@H]1CC[C@H]([NH2+]CC(=O)[O-])CC1	ZINC000100177959	364540970	/nfs/dbraw/zinc/54/09/70/364540970.db2.gz	RWTUSEAGUBNKIB-GASCZTMLSA-N	1	1	276.380	2.104	40	0		CEABMO
CC[C@H](C)[N@H+]1CCC[C@@]2(CN(Cc3cncs3)C2=O)C1	ZINC000585099714	367177243	/nfs/dbraw/zinc/17/72/43/367177243.db2.gz	ZJARAEIXWPJORA-WFASDCNBSA-N	1	1	293.436	2.366	40	0		CEABMO
C[N@H+]1CC[C@@]2(c3ccccc3)CCN(C(=O)C3CC3)C[C@@H]12	ZINC000248121705	371161734	/nfs/dbraw/zinc/16/17/34/371161734.db2.gz	KHUQSPQHMNEIHO-AEFFLSMTSA-N	1	1	284.403	2.271	40	0		CEABMO
CCCn1cc(C[NH2+]Cc2c(C)nn(CC)c2F)cn1	ZINC000256050304	190003377	/nfs/dbraw/zinc/00/33/77/190003377.db2.gz	DOBVFZLPTPNQNQ-UHFFFAOYSA-N	1	1	279.363	2.247	40	0		CEABMO
Cn1nccc1C[NH2+]Cc1cnn(C2CCCC2)c1	ZINC000256052274	190004175	/nfs/dbraw/zinc/00/41/75/190004175.db2.gz	MQPOOTOMSMSQEN-UHFFFAOYSA-N	1	1	259.357	2.022	40	0		CEABMO
c1c[nH]c(C[N@@H+]2CCC[C@@H](c3ccc4c[nH]nc4n3)C2)n1	ZINC000257229494	190016222	/nfs/dbraw/zinc/01/62/22/190016222.db2.gz	FYIKORUXSIHQOH-GFCCVEGCSA-N	1	1	282.351	2.061	40	0		CEABMO
c1c[nH]c(C[N@H+]2CCC[C@@H](c3ccc4c[nH]nc4n3)C2)n1	ZINC000257229494	190016223	/nfs/dbraw/zinc/01/62/23/190016223.db2.gz	FYIKORUXSIHQOH-GFCCVEGCSA-N	1	1	282.351	2.061	40	0		CEABMO
CN(C)c1cc([C@@H]2CCC[N@@H+]2Cc2cncn2C)ccn1	ZINC000257220979	190014464	/nfs/dbraw/zinc/01/44/64/190014464.db2.gz	DNASGFXURPADIX-HNNXBMFYSA-N	1	1	285.395	2.218	40	0		CEABMO
CN(C)c1cc([C@@H]2CCC[N@H+]2Cc2cncn2C)ccn1	ZINC000257220979	190014465	/nfs/dbraw/zinc/01/44/65/190014465.db2.gz	DNASGFXURPADIX-HNNXBMFYSA-N	1	1	285.395	2.218	40	0		CEABMO
CCc1nc(C)c(C[N@H+]2CC[C@H](OC)[C@]3(CCCO3)C2)[nH]1	ZINC000257242297	190018606	/nfs/dbraw/zinc/01/86/06/190018606.db2.gz	IBVDZHVHYPERGI-HOCLYGCPSA-N	1	1	293.411	2.050	40	0		CEABMO
CCCN1CCO[C@@H](c2cc(N(C)C)cc(C)[nH+]2)C1	ZINC000257243967	190019519	/nfs/dbraw/zinc/01/95/19/190019519.db2.gz	IJIKSZCRRCBMAI-OAHLLOKOSA-N	1	1	263.385	2.239	40	0		CEABMO
O=C(C[N@H+]1CCC[C@@H]1CCc1ccncc1)N1CCCC1	ZINC000257272072	190023877	/nfs/dbraw/zinc/02/38/77/190023877.db2.gz	NAYZAAWLXWNNJE-MRXNPFEDSA-N	1	1	287.407	2.101	40	0		CEABMO
Cc1[nH+]ccn1CC(=O)N1CCC(Cc2ccncc2)CC1	ZINC000257260833	190022086	/nfs/dbraw/zinc/02/20/86/190022086.db2.gz	LEOZLNGPGIVKDW-UHFFFAOYSA-N	1	1	298.390	2.068	40	0		CEABMO
c1csc(C[NH+]2CCN(c3nccn4ccnc34)CC2)c1	ZINC000306136031	376539701	/nfs/dbraw/zinc/53/97/01/376539701.db2.gz	PHACYKRGJCJLHF-UHFFFAOYSA-N	1	1	299.403	2.113	40	0		CEABMO
CC1(C)CN(c2cc[nH+]c(NCCO)n2)Cc2ccccc21	ZINC000329066129	376930234	/nfs/dbraw/zinc/93/02/34/376930234.db2.gz	XXDRZVSMZGTMEU-UHFFFAOYSA-N	1	1	298.390	2.179	40	0		CEABMO
Cc1[nH+]ccn1-c1ccccc1CNC(=O)C1CC1	ZINC000065740116	184569031	/nfs/dbraw/zinc/56/90/31/184569031.db2.gz	FJVXTVWXVPEOIB-UHFFFAOYSA-N	1	1	255.321	2.207	40	0		CEABMO
COC(=O)[C@@H]1C[N@@H+](C)C[C@@H]1c1ccccc1Cl	ZINC000217669189	130762700	/nfs/dbraw/zinc/76/27/00/130762700.db2.gz	YVCKOEIZBOKVIO-GHMZBOCLSA-N	1	1	253.729	2.158	40	0		CEABMO
CC[N@H+]1CCC[C@@H]1c1ccc(N2CCOCC2)nc1	ZINC000072216153	394592701	/nfs/dbraw/zinc/59/27/01/394592701.db2.gz	AGEWXVOSXOUIDE-CQSZACIVSA-N	1	1	261.369	2.075	40	0		CEABMO
COC(=O)[C@H]1C[N@@H+](C)C[C@H]1c1cccc(Br)c1	ZINC000252516822	394572089	/nfs/dbraw/zinc/57/20/89/394572089.db2.gz	XBPKBJLBWHOMCJ-RYUDHWBXSA-N	1	1	298.180	2.267	40	0		CEABMO
Cc1[nH+]c(N2CCc3ccccc3C2)ccc1CCO	ZINC000072224946	394594369	/nfs/dbraw/zinc/59/43/69/394594369.db2.gz	QNPQMLHPXQAOAT-UHFFFAOYSA-N	1	1	268.360	2.488	40	0		CEABMO
COc1ccc(N2C(=O)[C@@H]([NH3+])[C@@H]2c2ccc(C)o2)cc1	ZINC000072227155	394595296	/nfs/dbraw/zinc/59/52/96/394595296.db2.gz	PQYHEDNPDKFEOF-KBPBESRZSA-N	1	1	272.304	2.012	40	0		CEABMO
COc1ccc([C@@H]2[C@@H]([NH3+])C(=O)N2c2cccc(F)c2)cc1	ZINC000072227612	394596503	/nfs/dbraw/zinc/59/65/03/394596503.db2.gz	IWLCLUMGVIPJOY-HUUCEWRRSA-N	1	1	286.306	2.250	40	0		CEABMO
Cc1cc(N(C)C)nc([C@H]2CCC[N@H+]2C2CCOCC2)n1	ZINC000072364359	394598588	/nfs/dbraw/zinc/59/85/88/394598588.db2.gz	AKEKKBRYTSKRMT-CQSZACIVSA-N	1	1	290.411	2.167	40	0		CEABMO
COc1ccc(Nc2cc(C)[nH+]c(N)n2)c(OC)c1	ZINC000043532221	175062358	/nfs/dbraw/zinc/06/23/58/175062358.db2.gz	DFZAERPYSWIVOK-UHFFFAOYSA-N	1	1	260.297	2.128	40	0		CEABMO
CC[N@@H+]1CCC[C@@H]1c1nc(C)cc(Nc2ncccn2)n1	ZINC000072383488	176388659	/nfs/dbraw/zinc/38/86/59/176388659.db2.gz	OIOZYQBAGACDNW-GFCCVEGCSA-N	1	1	284.367	2.475	40	0		CEABMO
CC[N@H+]1CCC[C@@H]1c1nc(C)cc(Nc2ncccn2)n1	ZINC000072383488	176388661	/nfs/dbraw/zinc/38/86/61/176388661.db2.gz	OIOZYQBAGACDNW-GFCCVEGCSA-N	1	1	284.367	2.475	40	0		CEABMO
CC[N@H+]1CCc2nc(NCc3ccco3)ncc2C1	ZINC000072415047	176399499	/nfs/dbraw/zinc/39/94/99/176399499.db2.gz	ZKQNCPCTZPMNHR-UHFFFAOYSA-N	1	1	258.325	2.060	40	0		CEABMO
CCO[C@H]1CSC2(C[NH+](Cc3c(C)noc3C)C2)C1	ZINC000253385026	276361161	/nfs/dbraw/zinc/36/11/61/276361161.db2.gz	RAEJECJVCQHDMZ-GFCCVEGCSA-N	1	1	282.409	2.388	40	0		CEABMO
COc1cccc([C@H]([NH3+])c2nc(-c3ccccc3O)n[nH]2)c1	ZINC000095533512	185007679	/nfs/dbraw/zinc/00/76/79/185007679.db2.gz	ZYFGNJWCMPQHOM-AWEZNQCLSA-N	1	1	296.330	2.234	40	0		CEABMO
COC[C@]12CCCO[C@@H]1CC[N@@H+](Cc1ccco1)C2	ZINC000096056710	185077341	/nfs/dbraw/zinc/07/73/41/185077341.db2.gz	MSHWUFSCDKMXQC-HUUCEWRRSA-N	1	1	265.353	2.297	40	0		CEABMO
O[C@H]1CC[N@@H+](Cc2ccc(F)cc2)[C@H]1Cc1ccncc1	ZINC000096061650	185082192	/nfs/dbraw/zinc/08/21/92/185082192.db2.gz	UHQXDVKDSNLODR-IRXDYDNUSA-N	1	1	286.350	2.399	40	0		CEABMO
CC[N@H+]1CCCC12CCN(C(=O)c1ccoc1)CC2	ZINC000096075209	185089990	/nfs/dbraw/zinc/08/99/90/185089990.db2.gz	PECNTNZUCDDXHV-UHFFFAOYSA-N	1	1	262.353	2.370	40	0		CEABMO
CC(C)(C)C[N@@H+]1C[C@H]2CN(C(=O)c3cscn3)C[C@H]2C1	ZINC000096080982	185091628	/nfs/dbraw/zinc/09/16/28/185091628.db2.gz	MTJZVUDMNFVSCO-TXEJJXNPSA-N	1	1	293.436	2.193	40	0		CEABMO
Cc1ccccc1OC[C@@]1(O)CC[N@@H+](Cc2ccccn2)C1	ZINC000585274273	345009219	/nfs/dbraw/zinc/00/92/19/345009219.db2.gz	ICJLSAJABVPESA-GOSISDBHSA-N	1	1	298.386	2.406	40	0		CEABMO
CC(C)Oc1cccc(CNC(=O)[C@H]2CCC[N@@H+](C)C2)c1	ZINC000072984104	363189796	/nfs/dbraw/zinc/18/97/96/363189796.db2.gz	OTWYYZASRMSQLY-HNNXBMFYSA-N	1	1	290.407	2.432	40	0		CEABMO
CC[N@H+](Cc1ccccc1)C[C@@H]1CCCCN1CCO	ZINC000079414214	363596829	/nfs/dbraw/zinc/59/68/29/363596829.db2.gz	KVNDXFIABUZSGL-KRWDZBQOSA-N	1	1	276.424	2.355	40	0		CEABMO
CCN(Cc1ccccc1)C[C@@H]1CCCC[N@@H+]1CCO	ZINC000079414214	363596835	/nfs/dbraw/zinc/59/68/35/363596835.db2.gz	KVNDXFIABUZSGL-KRWDZBQOSA-N	1	1	276.424	2.355	40	0		CEABMO
CCN(Cc1ccccc1)C[C@@H]1CCCC[N@H+]1CCO	ZINC000079414214	363596837	/nfs/dbraw/zinc/59/68/37/363596837.db2.gz	KVNDXFIABUZSGL-KRWDZBQOSA-N	1	1	276.424	2.355	40	0		CEABMO
CC(C)[N@H+](Cc1ccccc1)C1CC[NH+](CC(=O)[O-])CC1	ZINC000079416175	363598938	/nfs/dbraw/zinc/59/89/38/363598938.db2.gz	CHXZVFNJVPUPGY-UHFFFAOYSA-N	1	1	290.407	2.446	40	0		CEABMO
CC(C)[N@@H+](Cc1ccccc1)C1CC[NH+](CC(=O)[O-])CC1	ZINC000079416175	363598942	/nfs/dbraw/zinc/59/89/42/363598942.db2.gz	CHXZVFNJVPUPGY-UHFFFAOYSA-N	1	1	290.407	2.446	40	0		CEABMO
Cc1cc(C)n(-c2cccc(C[N@H+]3CC[C@H](CO)C3)c2)n1	ZINC000012182982	361374692	/nfs/dbraw/zinc/37/46/92/361374692.db2.gz	PWVVSECIEMSCFF-INIZCTEOSA-N	1	1	285.391	2.303	40	0		CEABMO
CSc1ncc(C[N@H+](CCO)Cc2cccs2)cn1	ZINC000013997559	361446688	/nfs/dbraw/zinc/44/66/88/361446688.db2.gz	GFAUXLVQFUBXQG-UHFFFAOYSA-N	1	1	295.433	2.255	40	0		CEABMO
CSc1ncc(C[N@@H+](CCO)Cc2cccs2)cn1	ZINC000013997559	361446691	/nfs/dbraw/zinc/44/66/91/361446691.db2.gz	GFAUXLVQFUBXQG-UHFFFAOYSA-N	1	1	295.433	2.255	40	0		CEABMO
Cc1nc([C@H]2CC[N@@H+](Cc3ccccc3)C2)cc(=O)[nH]1	ZINC000019285267	361526645	/nfs/dbraw/zinc/52/66/45/361526645.db2.gz	GSLXRSXVXKOFMX-AWEZNQCLSA-N	1	1	269.348	2.068	40	0		CEABMO
COc1ccc(CN2C[C@@H]3CCC[N@H+]3C[C@H]2C)c(OC)c1	ZINC000019575120	361543802	/nfs/dbraw/zinc/54/38/02/361543802.db2.gz	FADZAKJCSKJSIQ-HIFRSBDPSA-N	1	1	290.407	2.372	40	0		CEABMO
C[C@@H]([NH3+])c1nc(-c2ccccc2OC(F)F)no1	ZINC000089262326	363952128	/nfs/dbraw/zinc/95/21/28/363952128.db2.gz	WMYBWNFNPTYTRD-ZCFIWIBFSA-N	1	1	255.224	2.358	40	0		CEABMO
CC(C)C[N@H+]1CC[C@@H]2[C@@H]1CCN2C(=O)N1CCCC1	ZINC000096055793	364400071	/nfs/dbraw/zinc/40/00/71/364400071.db2.gz	KGLPCNBJKYJXSE-UONOGXRCSA-N	1	1	265.401	2.007	40	0		CEABMO
C[NH+](C)Cc1cn2c(n1)CN(Cc1ccsc1)CC2	ZINC000096197147	364408895	/nfs/dbraw/zinc/40/88/95/364408895.db2.gz	BUVHDDGLVYQMQJ-UHFFFAOYSA-N	1	1	276.409	2.022	40	0		CEABMO
C[N@H+]1CCC[C@]2(CCN(C(=O)Cc3ccsc3)C2)C1	ZINC000096215249	364413251	/nfs/dbraw/zinc/41/32/51/364413251.db2.gz	YHDWRDSACVMGEU-HNNXBMFYSA-N	1	1	278.421	2.235	40	0		CEABMO
CC(=O)N1CCC[C@@]2(C1)C[N@@H+](CC1CCCCC1)CCO2	ZINC000096268744	364419848	/nfs/dbraw/zinc/41/98/48/364419848.db2.gz	KOZMBNCTBCNIER-KRWDZBQOSA-N	1	1	294.439	2.280	40	0		CEABMO
CCCn1nccc1C[NH2+]Cc1cnn(CC(F)F)c1	ZINC000256054264	190005576	/nfs/dbraw/zinc/00/55/76/190005576.db2.gz	VQFKFNZQMWFISI-UHFFFAOYSA-N	1	1	283.326	2.045	40	0		CEABMO
CCCn1nccc1-c1cnc(C[C@@H]2CC[N@@H+](C)C2)cn1	ZINC000257221303	190014571	/nfs/dbraw/zinc/01/45/71/190014571.db2.gz	DOJMZVLOJYEMNL-ZDUSSCGKSA-N	1	1	285.395	2.244	40	0		CEABMO
Cc1c[nH]c([C@H]2CC[N@@H+](CC3(O)CCCCC3)C2)n1	ZINC000257238014	190017827	/nfs/dbraw/zinc/01/78/27/190017827.db2.gz	HJFFKSZCTLBLIH-ZDUSSCGKSA-N	1	1	263.385	2.203	40	0		CEABMO
CNc1ncccc1C[N@H+]1CCC[C@](C)(c2cc[nH]n2)C1	ZINC000257238681	190017879	/nfs/dbraw/zinc/01/78/79/190017879.db2.gz	HMBGDUWHBFKQBM-INIZCTEOSA-N	1	1	285.395	2.400	40	0		CEABMO
CNC(=O)C[N@H+]1CCC[C@@H](Cc2cccc3ncccc23)C1	ZINC000257243910	190018495	/nfs/dbraw/zinc/01/84/95/190018495.db2.gz	IJBLKEWCVYDNNA-AWEZNQCLSA-N	1	1	297.402	2.235	40	0		CEABMO
C[NH+](C)Cc1cncc([C@H]2CCCN2Cc2ccncc2)n1	ZINC000257240653	190018906	/nfs/dbraw/zinc/01/89/06/190018906.db2.gz	HUNMIEVAUBRWBG-QGZVFWFLSA-N	1	1	297.406	2.270	40	0		CEABMO
Cn1cc(C[N@@H+]2C[C@@H]3[C@H](Oc4cccnc4)CC[C@@H]3C2)cn1	ZINC000257252047	190020320	/nfs/dbraw/zinc/02/03/20/190020320.db2.gz	JTIWFHDHVQJXSX-HYVNUMGLSA-N	1	1	298.390	2.105	40	0		CEABMO
CC(C)[N@H+]1CCC[C@H](c2cnc(-c3ccnn3C)cn2)C1	ZINC000257255814	190021305	/nfs/dbraw/zinc/02/13/05/190021305.db2.gz	KIYQJNVWXMZNSC-ZDUSSCGKSA-N	1	1	285.395	2.465	40	0		CEABMO
CNc1cc(C)nc([C@@H]2CC[N@H+](Cc3cnn(C)c3C)C2)c1	ZINC000257256952	190021941	/nfs/dbraw/zinc/02/19/41/190021941.db2.gz	KNNCHKCZQXOZGN-CQSZACIVSA-N	1	1	299.422	2.463	40	0		CEABMO
CNc1cc(C)nc([C@@H]2CC[N@@H+](Cc3cnn(C)c3C)C2)c1	ZINC000257256952	190021942	/nfs/dbraw/zinc/02/19/42/190021942.db2.gz	KNNCHKCZQXOZGN-CQSZACIVSA-N	1	1	299.422	2.463	40	0		CEABMO
C[N@H+]1C[C@H](c2ccccc2)[C@H]2CN(Cc3ncc[nH]3)CC[C@H]21	ZINC000257260921	190022438	/nfs/dbraw/zinc/02/24/38/190022438.db2.gz	LFBMYKUOSNQUHU-BRWVUGGUSA-N	1	1	296.418	2.329	40	0		CEABMO
CNc1nccnc1C[C@@H]1CCC[N@@H+](Cc2ccncc2)C1	ZINC000257274537	190024595	/nfs/dbraw/zinc/02/45/95/190024595.db2.gz	NLMJIQNKBMDFAG-HNNXBMFYSA-N	1	1	297.406	2.368	40	0		CEABMO
C[N@H+]1CCC[C@H](c2cncc(-c3cccc(C(N)=O)c3)n2)C1	ZINC000257307187	190031558	/nfs/dbraw/zinc/03/15/58/190031558.db2.gz	SXOIDNAWVLXMKJ-AWEZNQCLSA-N	1	1	296.374	2.052	40	0		CEABMO
COc1ccccc1C[N@@H+]1CC[C@H](OC)[C@]2(CCCO2)C1	ZINC000257314843	190032899	/nfs/dbraw/zinc/03/28/99/190032899.db2.gz	UYSUSARHPNKGEL-IRXDYDNUSA-N	1	1	291.391	2.465	40	0		CEABMO
c1[nH]nc2nc([C@@H]3CCC[N@H+](Cc4cnccn4)C3)ccc12	ZINC000257327800	190034755	/nfs/dbraw/zinc/03/47/55/190034755.db2.gz	XCUCRQQAEUQGGD-CYBMUJFWSA-N	1	1	294.362	2.128	40	0		CEABMO
CN(C)C(=O)N1CC[C@@]2(c3ccccc3)CC[N@@H+](C)[C@@H]2C1	ZINC000306136592	376540698	/nfs/dbraw/zinc/54/06/98/376540698.db2.gz	PXSZZMGCICPJRP-NVXWUHKLSA-N	1	1	287.407	2.016	40	0		CEABMO
c1ccn(C[C@H]2CC[C@H]3[C@@H]2OCC[N@@H+]3Cc2ccc[nH]2)c1	ZINC000096250201	256834844	/nfs/dbraw/zinc/83/48/44/256834844.db2.gz	UDUCYYMVLBHZHH-HYVNUMGLSA-N	1	1	285.391	2.496	40	0		CEABMO
c1ccn(C[C@H]2CC[C@H]3[C@@H]2OCC[N@H+]3Cc2ccc[nH]2)c1	ZINC000096250201	256834845	/nfs/dbraw/zinc/83/48/45/256834845.db2.gz	UDUCYYMVLBHZHH-HYVNUMGLSA-N	1	1	285.391	2.496	40	0		CEABMO
CC[C@@H]1C[N@H+]2CCc3cc(OC)c(OC)cc3[C@@H]2C[C@@H]1O	ZINC000005339256	394457657	/nfs/dbraw/zinc/45/76/57/394457657.db2.gz	LYDWUTUOAGCHNM-UGFHNGPFSA-N	1	1	291.391	2.394	40	0		CEABMO
CC[N@@H+]1CCCC[C@H]1c1cccnc1N1CCN(C)CC1	ZINC000072216599	394593587	/nfs/dbraw/zinc/59/35/87/394593587.db2.gz	HNVBLAOTGGDUMO-INIZCTEOSA-N	1	1	288.439	2.380	40	0		CEABMO
CC[N@H+]1CCCC[C@H]1c1cccnc1N1CCN(C)CC1	ZINC000072216599	394593589	/nfs/dbraw/zinc/59/35/89/394593589.db2.gz	HNVBLAOTGGDUMO-INIZCTEOSA-N	1	1	288.439	2.380	40	0		CEABMO
COc1ccc(N2C(=O)[C@H]([NH3+])[C@H]2c2cccs2)cc1	ZINC000072227132	394595221	/nfs/dbraw/zinc/59/52/21/394595221.db2.gz	TUGVCJNUHGCWQR-CHWSQXEVSA-N	1	1	274.345	2.172	40	0		CEABMO
[NH3+][C@H]1C(=O)N(Cc2ccc(F)cc2)[C@@H]1c1cccs1	ZINC000072228188	394596515	/nfs/dbraw/zinc/59/65/15/394596515.db2.gz	DLWZEQFIBPOGAK-CHWSQXEVSA-N	1	1	276.336	2.298	40	0		CEABMO
COC(=O)[C@H]1C[N@@H+](C)C[C@@H]1c1cccc(Br)c1	ZINC000217668695	400307916	/nfs/dbraw/zinc/30/79/16/400307916.db2.gz	XBPKBJLBWHOMCJ-NEPJUHHUSA-N	1	1	298.180	2.267	40	0		CEABMO
CC[N@H+](Cc1cccc(F)c1)[C@@]1(C)CCS(=O)(=O)C1	ZINC000575422227	400608871	/nfs/dbraw/zinc/60/88/71/400608871.db2.gz	TZOHRHVRYBSCDZ-AWEZNQCLSA-N	1	1	285.384	2.225	40	0		CEABMO
CC[N@@H+](Cc1cccc(F)c1)[C@@]1(C)CCS(=O)(=O)C1	ZINC000575422227	400608875	/nfs/dbraw/zinc/60/88/75/400608875.db2.gz	TZOHRHVRYBSCDZ-AWEZNQCLSA-N	1	1	285.384	2.225	40	0		CEABMO
C[C@H]1CCC[N@H+](Cc2nnnn2CCc2ccccc2)C1	ZINC000004860097	170032244	/nfs/dbraw/zinc/03/22/44/170032244.db2.gz	WYRSAODIYBWNNZ-AWEZNQCLSA-N	1	1	285.395	2.148	40	0		CEABMO
C[C@H]1CCC[N@@H+](Cc2nnnn2CCc2ccccc2)C1	ZINC000004860097	170032246	/nfs/dbraw/zinc/03/22/46/170032246.db2.gz	WYRSAODIYBWNNZ-AWEZNQCLSA-N	1	1	285.395	2.148	40	0		CEABMO
CC[NH+]1CCN(C(=O)CSCc2ccc(F)cc2)CC1	ZINC000022522470	171389831	/nfs/dbraw/zinc/38/98/31/171389831.db2.gz	RRESYKPPTPZRNJ-UHFFFAOYSA-N	1	1	296.411	2.223	40	0		CEABMO
CC1CC[NH+]([C@H](CN)c2ccc3c(c2)CCO3)CC1	ZINC000037363612	173152796	/nfs/dbraw/zinc/15/27/96/173152796.db2.gz	YVDHXORJDUXSIS-OAHLLOKOSA-N	1	1	260.381	2.353	40	0		CEABMO
Cc1nc([C@@H]2CCC[N@H+](C(C)C)C2)ncc1C(=O)N(C)C	ZINC000072352004	176374587	/nfs/dbraw/zinc/37/45/87/176374587.db2.gz	HMGITVOGNNLUPS-CYBMUJFWSA-N	1	1	290.411	2.075	40	0		CEABMO
COCCNc1cccc(C[C@H]2CCC[N@@H+](C)CC2)n1	ZINC000072386648	176392348	/nfs/dbraw/zinc/39/23/48/176392348.db2.gz	ADLQUAMUAZTTRI-AWEZNQCLSA-N	1	1	277.412	2.414	40	0		CEABMO
Cc1cccnc1-n1cccc1C[N@H+]1CCC[C@@H](CO)C1	ZINC000072397857	176395698	/nfs/dbraw/zinc/39/56/98/176395698.db2.gz	LJZSYCIDBKWIJK-OAHLLOKOSA-N	1	1	285.391	2.385	40	0		CEABMO
O=C1N(Cc2cccnc2)CC[C@@]12CCC[N@@H+](CC1CC1)C2	ZINC000096048647	185072283	/nfs/dbraw/zinc/07/22/83/185072283.db2.gz	KUYRFVVJNHWPHP-GOSISDBHSA-N	1	1	299.418	2.306	40	0		CEABMO
c1cncc(O[C@H]2CO[C@@]3(C2)CCC[N@H+](CC2CC2)C3)c1	ZINC000096048278	185072825	/nfs/dbraw/zinc/07/28/25/185072825.db2.gz	ZBFMLLPEFXQEAR-IAGOWNOFSA-N	1	1	288.391	2.494	40	0		CEABMO
CCOC[C@]12CCCO[C@H]1CC[N@@H+](Cc1cccnc1)C2	ZINC000096056810	185077400	/nfs/dbraw/zinc/07/74/00/185077400.db2.gz	QGEMVTUHWNOLFE-DLBZAZTESA-N	1	1	290.407	2.489	40	0		CEABMO
CCO[C@@H]1CC[C@H]2[C@H]1OCC[N@@H+]2Cc1ccc(C)o1	ZINC000096057791	185079204	/nfs/dbraw/zinc/07/92/04/185079204.db2.gz	JMTBVGKAGCQJKL-RRFJBIMHSA-N	1	1	265.353	2.356	40	0		CEABMO
CCO[C@@H]1CC[C@H]2[C@H]1OCC[N@H+]2Cc1ccc(C)o1	ZINC000096057791	185079206	/nfs/dbraw/zinc/07/92/06/185079206.db2.gz	JMTBVGKAGCQJKL-RRFJBIMHSA-N	1	1	265.353	2.356	40	0		CEABMO
CC(C)[N@@H+](C)Cc1cnc2n1CCN(Cc1ccoc1)C2	ZINC000096061774	185082925	/nfs/dbraw/zinc/08/29/25/185082925.db2.gz	WHRGRQURLPYRCE-UHFFFAOYSA-N	1	1	288.395	2.332	40	0		CEABMO
CC(C)C(=O)N1CCC[C@@]12CC[N@H+](Cc1nccs1)C2	ZINC000096071022	185086720	/nfs/dbraw/zinc/08/67/20/185086720.db2.gz	ZITSRGNRKAWAPI-HNNXBMFYSA-N	1	1	293.436	2.366	40	0		CEABMO
CC(C)C(=O)N1CCC[C@@]12CC[N@@H+](Cc1nccs1)C2	ZINC000096071022	185086722	/nfs/dbraw/zinc/08/67/22/185086722.db2.gz	ZITSRGNRKAWAPI-HNNXBMFYSA-N	1	1	293.436	2.366	40	0		CEABMO
COC[C@H]1CC2(CO1)CC[NH+](Cc1nccs1)CC2	ZINC000096105753	185098508	/nfs/dbraw/zinc/09/85/08/185098508.db2.gz	LBGZMXBJGPMQJC-GFCCVEGCSA-N	1	1	282.409	2.161	40	0		CEABMO
C[C@H]1CC[C@H](C)[NH+]1c1ccc(N2CCOCC2)c(N)c1	ZINC000008701410	343362854	/nfs/dbraw/zinc/36/28/54/343362854.db2.gz	OLOLGOYRPYYLEQ-STQMWFEESA-N	1	1	275.396	2.483	40	0		CEABMO
Cc1cnc([C@H]2C[N@@H+](C3CCCCC3)CCO2)cn1	ZINC000585180720	345009075	/nfs/dbraw/zinc/00/90/75/345009075.db2.gz	DXEQOYDSRYQJIV-OAHLLOKOSA-N	1	1	261.369	2.491	40	0		CEABMO
Cc1cnc([C@H]2C[N@H+](C3CCCCC3)CCO2)cn1	ZINC000585180720	345009078	/nfs/dbraw/zinc/00/90/78/345009078.db2.gz	DXEQOYDSRYQJIV-OAHLLOKOSA-N	1	1	261.369	2.491	40	0		CEABMO
c1cnc(N2CC[C@@H]3C[N@H+](CC4CCC4)C[C@@H]3C2)cn1	ZINC000063527406	362769519	/nfs/dbraw/zinc/76/95/19/362769519.db2.gz	SFLZTVOMSXTWTP-HUUCEWRRSA-N	1	1	272.396	2.035	40	0		CEABMO
CC(C)Oc1cccc(CNC(=O)[C@@H]2CCC[N@@H+](C)C2)c1	ZINC000072984103	363189570	/nfs/dbraw/zinc/18/95/70/363189570.db2.gz	OTWYYZASRMSQLY-OAHLLOKOSA-N	1	1	290.407	2.432	40	0		CEABMO
Cc1ccccc1OC[C@@H](C)NC(=O)[C@H]1CCC[N@@H+](C)C1	ZINC000073048707	363194250	/nfs/dbraw/zinc/19/42/50/363194250.db2.gz	QZJQGRTYWPIMOH-CABCVRRESA-N	1	1	290.407	2.220	40	0		CEABMO
Fc1cnc(N2CCC3(CCC[N@H+]3CC3CC3)CC2)nc1	ZINC000096063188	283033322	/nfs/dbraw/zinc/03/33/22/283033322.db2.gz	PPHSJEMCCDBSFG-UHFFFAOYSA-N	1	1	290.386	2.461	40	0		CEABMO
OCC[N@@H+](C1CC1)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000079393547	363593397	/nfs/dbraw/zinc/59/33/97/363593397.db2.gz	LDSRLKQLUBAIQE-QGZVFWFLSA-N	1	1	274.408	2.108	40	0		CEABMO
OCCN(C1CC1)[C@@H]1CCC[N@H+](Cc2ccccc2)C1	ZINC000079393547	363593401	/nfs/dbraw/zinc/59/34/01/363593401.db2.gz	LDSRLKQLUBAIQE-QGZVFWFLSA-N	1	1	274.408	2.108	40	0		CEABMO
OCCN(C1CC1)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1	ZINC000079393547	363593406	/nfs/dbraw/zinc/59/34/06/363593406.db2.gz	LDSRLKQLUBAIQE-QGZVFWFLSA-N	1	1	274.408	2.108	40	0		CEABMO
Cc1cc(C[N@H+]2CCc3nc(C)[nH]c(=O)c3CC2)cs1	ZINC000019572072	361542867	/nfs/dbraw/zinc/54/28/67/361542867.db2.gz	PFJOVWCRYLTUBS-UHFFFAOYSA-N	1	1	289.404	2.049	40	0		CEABMO
C[N@@H+]1[C@@H]2CC[C@H]1CC(O)(c1ccc(Cl)nc1)C2	ZINC000027640677	361655857	/nfs/dbraw/zinc/65/58/57/361655857.db2.gz	FXMMVMRYFLUIGL-QYJAPNMZSA-N	1	1	252.745	2.179	40	0		CEABMO
c1coc(C[N@H+]2CCc3ncnc(N4CCCC4)c3CC2)c1	ZINC000096058714	364400679	/nfs/dbraw/zinc/40/06/79/364400679.db2.gz	QMRMMRDKVVOPOL-UHFFFAOYSA-N	1	1	298.390	2.271	40	0		CEABMO
c1ncn2c1C[N@H+](C1CCC1)C[C@H](COc1cccnc1)C2	ZINC000096206791	364410314	/nfs/dbraw/zinc/41/03/14/364410314.db2.gz	WNBAONWZGZSUSI-AWEZNQCLSA-N	1	1	298.390	2.341	40	0		CEABMO
CCOc1ncnc2c1CC[N@@H+](Cc1ccc(C)o1)CC2	ZINC000096255601	364418898	/nfs/dbraw/zinc/41/88/98/364418898.db2.gz	ZQCRPBYQRKYASK-UHFFFAOYSA-N	1	1	287.363	2.378	40	0		CEABMO
COCc1nnc2n1CC[N@@H+](CCc1ccccc1)[C@H]2C	ZINC000585097639	367177165	/nfs/dbraw/zinc/17/71/65/367177165.db2.gz	OMBPHYBICMJLQM-ZDUSSCGKSA-N	1	1	286.379	2.044	40	0		CEABMO
COCc1nnc2n1CC[N@H+](CCc1ccccc1)[C@H]2C	ZINC000585097639	367177168	/nfs/dbraw/zinc/17/71/68/367177168.db2.gz	OMBPHYBICMJLQM-ZDUSSCGKSA-N	1	1	286.379	2.044	40	0		CEABMO
Cc1nn(C)c(F)c1C[NH2+]Cc1cnn(CC(C)C)c1	ZINC000256049524	190002240	/nfs/dbraw/zinc/00/22/40/190002240.db2.gz	AHYZNVVFRQHCJH-UHFFFAOYSA-N	1	1	279.363	2.010	40	0		CEABMO
Cc1ncsc1C[N@H+]1C[C@@H](O)[C@H](Oc2ccccc2)C1	ZINC000257209453	190012180	/nfs/dbraw/zinc/01/21/80/190012180.db2.gz	BQKVYVSFVJQENF-ZIAGYGMSSA-N	1	1	290.388	2.076	40	0		CEABMO
Cn1ccnc1C[N@H+]1CCC[C@@H]1CCc1ccncc1	ZINC000257209576	190012434	/nfs/dbraw/zinc/01/24/34/190012434.db2.gz	BQXMNTZYQLRJKK-OAHLLOKOSA-N	1	1	270.380	2.412	40	0		CEABMO
Cc1c[nH]nc1[C@@H]1CC[N@H+](Cc2ccnn2C(C)C)C1	ZINC000257210309	190012486	/nfs/dbraw/zinc/01/24/86/190012486.db2.gz	BUBHZMNNGCLVKF-CYBMUJFWSA-N	1	1	273.384	2.485	40	0		CEABMO
CN(C(=O)c1cc([C@@H]2CCC[N@H+]2C)ccn1)C1CCC1	ZINC000257212725	190013328	/nfs/dbraw/zinc/01/33/28/190013328.db2.gz	CERLADNWEUDAIJ-HNNXBMFYSA-N	1	1	273.380	2.473	40	0		CEABMO
Cc1ncoc1C(=O)N1CCC[C@@H]2[N@@H+](C)CCC[C@@]21C	ZINC000257220895	190014765	/nfs/dbraw/zinc/01/47/65/190014765.db2.gz	DMRFOBKAPUKTGI-WFASDCNBSA-N	1	1	277.368	2.072	40	0		CEABMO
CCn1nccc1-c1cnc([C@H]2CCC[N@H+]2C)cn1	ZINC000257224548	190015172	/nfs/dbraw/zinc/01/51/72/190015172.db2.gz	FCGINBSAMSOYLW-CYBMUJFWSA-N	1	1	257.341	2.127	40	0		CEABMO
CNC(=O)C[N@H+]1CCC[C@H](Cc2cccc3ncccc23)C1	ZINC000257243911	190018284	/nfs/dbraw/zinc/01/82/84/190018284.db2.gz	IJBLKEWCVYDNNA-CQSZACIVSA-N	1	1	297.402	2.235	40	0		CEABMO
Cn1ccc(C[N@@H+]2C[C@@H]3[C@H](Oc4cccnc4)CC[C@@H]3C2)n1	ZINC000257247603	190019455	/nfs/dbraw/zinc/01/94/55/190019455.db2.gz	IZRCKOMJULZQFF-XOKHGSTOSA-N	1	1	298.390	2.105	40	0		CEABMO
CC1(c2nccs2)CC[NH+](CC(=O)N2CCCC2)CC1	ZINC000257245929	190019497	/nfs/dbraw/zinc/01/94/97/190019497.db2.gz	IRSNRTUNLQPEBY-UHFFFAOYSA-N	1	1	293.436	2.119	40	0		CEABMO
Cc1c(CN2CC[N@@H+](C)[C@@H](c3ccccc3)C2)cnn1C	ZINC000257265373	190022939	/nfs/dbraw/zinc/02/29/39/190022939.db2.gz	LYJYESWOWCELET-QGZVFWFLSA-N	1	1	284.407	2.217	40	0		CEABMO
Cc1c(C[N@@H+]2CCN(C)[C@@H](c3ccccc3)C2)cnn1C	ZINC000257265373	190022940	/nfs/dbraw/zinc/02/29/40/190022940.db2.gz	LYJYESWOWCELET-QGZVFWFLSA-N	1	1	284.407	2.217	40	0		CEABMO
Cc1c(C[N@H+]2CCN(C)[C@@H](c3ccccc3)C2)cnn1C	ZINC000257265373	190022941	/nfs/dbraw/zinc/02/29/41/190022941.db2.gz	LYJYESWOWCELET-QGZVFWFLSA-N	1	1	284.407	2.217	40	0		CEABMO
O=C(C[N@H+]1CCC[C@H]1CCc1ccncc1)N1CCCC1	ZINC000257272071	190023783	/nfs/dbraw/zinc/02/37/83/190023783.db2.gz	NAYZAAWLXWNNJE-INIZCTEOSA-N	1	1	287.407	2.101	40	0		CEABMO
CC(C)[N@H+]1CCC[C@@H](c2cnc(-c3ccnn3C)cn2)C1	ZINC000257255813	190021454	/nfs/dbraw/zinc/02/14/54/190021454.db2.gz	KIYQJNVWXMZNSC-CYBMUJFWSA-N	1	1	285.395	2.465	40	0		CEABMO
COc1cc(C[N@@H+]2C[C@H](OC)[C@]3(CCCO3)C2)ccc1F	ZINC000257261951	190022332	/nfs/dbraw/zinc/02/23/32/190022332.db2.gz	LJKLVFOUOQBCEI-HOTGVXAUSA-N	1	1	295.354	2.214	40	0		CEABMO
Cc1c[nH]c([C@H]2CCC[N@@H+](Cc3[nH]cnc3C)C2)n1	ZINC000257283066	190026524	/nfs/dbraw/zinc/02/65/24/190026524.db2.gz	OWQFAIRSPFEVBH-LBPRGKRZSA-N	1	1	259.357	2.129	40	0		CEABMO
c1cncc(O[C@@H]2CC[C@@H]3C[N@H+](Cc4cnccn4)C[C@H]23)c1	ZINC000257319910	190033805	/nfs/dbraw/zinc/03/38/05/190033805.db2.gz	VUOQSXYQAAPUFH-XOKHGSTOSA-N	1	1	296.374	2.161	40	0		CEABMO
CCC[N@H+]1C[C@@H]2CC[C@]3(CC(C)=NN3C(C)=O)[C@@H]2C1	ZINC000306134563	376540257	/nfs/dbraw/zinc/54/02/57/376540257.db2.gz	NRUNORKAOHBWII-ZNMIVQPWSA-N	1	1	263.385	2.105	40	0		CEABMO
O[C@@H]1CC[N@@H+](Cc2ccncc2)[C@H]1Cc1ccccc1	ZINC000096200006	256820006	/nfs/dbraw/zinc/82/00/06/256820006.db2.gz	WQFUXMMDJKIKSU-DLBZAZTESA-N	1	1	268.360	2.260	40	0		CEABMO
CNc1ncc(C[NH2+]Cc2ccccc2Cl)cn1	ZINC000062717437	394570586	/nfs/dbraw/zinc/57/05/86/394570586.db2.gz	QDQLSTYJLCLWMI-UHFFFAOYSA-N	1	1	262.744	2.462	40	0		CEABMO
CCOC(=O)[C@H]([NH3+])[C@@H](Nc1ccc(OC)cc1)C(C)C	ZINC000072210545	394592108	/nfs/dbraw/zinc/59/21/08/394592108.db2.gz	NYBCONNMWWWMLE-KGLIPLIRSA-N	1	1	280.368	2.022	40	0		CEABMO
COc1cccc([C@@H]2[C@@H]([NH3+])C(=O)N2c2ccc(C)cc2)c1	ZINC000072227460	394596470	/nfs/dbraw/zinc/59/64/70/394596470.db2.gz	DLDMZBPFWPHYBU-HZPDHXFCSA-N	1	1	282.343	2.419	40	0		CEABMO
Cc1ccc(N2C[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)nn1	ZINC000396185144	395216106	/nfs/dbraw/zinc/21/61/06/395216106.db2.gz	UBHAOKIFMKUUSO-CALCHBBNSA-N	1	1	294.402	2.353	40	0		CEABMO
CC[N@H+](Cc1cccc(F)c1)[C@]1(C)CCS(=O)(=O)C1	ZINC000575422228	400608693	/nfs/dbraw/zinc/60/86/93/400608693.db2.gz	TZOHRHVRYBSCDZ-CQSZACIVSA-N	1	1	285.384	2.225	40	0		CEABMO
CC[N@@H+](Cc1cccc(F)c1)[C@]1(C)CCS(=O)(=O)C1	ZINC000575422228	400608696	/nfs/dbraw/zinc/60/86/96/400608696.db2.gz	TZOHRHVRYBSCDZ-CQSZACIVSA-N	1	1	285.384	2.225	40	0		CEABMO
COc1ccc([C@H]2C[N@@H+](C)[C@@H]3CCCN(C(C)=O)[C@@H]32)cc1	ZINC000257327490	286379074	/nfs/dbraw/zinc/37/90/74/286379074.db2.gz	XBNXWXMTEAOEET-BRWVUGGUSA-N	1	1	288.391	2.104	40	0		CEABMO
CCN(CC)C(=O)COC[C@H]1CCC[N@H+]2CCCC[C@H]12	ZINC000005708327	170131783	/nfs/dbraw/zinc/13/17/83/170131783.db2.gz	YXGLGZVQMGKEBH-HUUCEWRRSA-N	1	1	282.428	2.136	40	0		CEABMO
CC[NH+](CC)CCNCc1ccc(OC)c(OC)c1	ZINC000019919132	170927140	/nfs/dbraw/zinc/92/71/40/170927140.db2.gz	YMDHOYMGWDTNAF-UHFFFAOYSA-N	1	1	266.385	2.135	40	0		CEABMO
C[C@]1([NH2+]Cc2ccccc2Cl)CCS(=O)(=O)C1	ZINC000035223099	172067468	/nfs/dbraw/zinc/06/74/68/172067468.db2.gz	NKJOJFAOWKIUOY-LBPRGKRZSA-N	1	1	273.785	2.007	40	0		CEABMO
COc1cccc(CN2C[C@@H]3CCC[N@H+]3C[C@H]2C)c1OC	ZINC000072397537	176395277	/nfs/dbraw/zinc/39/52/77/176395277.db2.gz	JKVMYIBCSWDHCB-HIFRSBDPSA-N	1	1	290.407	2.372	40	0		CEABMO
COc1ccc(CN2C[C@@H]3CCC[N@H+]3C[C@@H]2C)cc1OC	ZINC000072397515	176395297	/nfs/dbraw/zinc/39/52/97/176395297.db2.gz	AACBDFFUMQVXBK-ZFWWWQNUSA-N	1	1	290.407	2.372	40	0		CEABMO
COC(=O)c1ccc(-c2ccc3c(c2)[C@@H]([NH3+])C(=O)N3)cc1	ZINC000254286876	274001057	/nfs/dbraw/zinc/00/10/57/274001057.db2.gz	NKMHIPKCLQVQFF-CQSZACIVSA-N	1	1	282.299	2.092	40	0		CEABMO
c1ccc(N2CCC[C@@]3(CC[N@H+]([C@H]4CCOC4)C3)C2)nc1	ZINC000253596880	275067683	/nfs/dbraw/zinc/06/76/83/275067683.db2.gz	XHXQCHGEJUTSKP-RDJZCZTQSA-N	1	1	287.407	2.163	40	0		CEABMO
CCOC[C@H]1Cn2nccc2C[N@H+](Cc2ccoc2)C1	ZINC000096059208	276334510	/nfs/dbraw/zinc/33/45/10/276334510.db2.gz	IZAPXTJTTZFZMG-CQSZACIVSA-N	1	1	275.352	2.145	40	0		CEABMO
CCOC[C@H]1Cn2nccc2C[N@@H+](Cc2ccoc2)C1	ZINC000096059208	276334511	/nfs/dbraw/zinc/33/45/11/276334511.db2.gz	IZAPXTJTTZFZMG-CQSZACIVSA-N	1	1	275.352	2.145	40	0		CEABMO
CN1CC[N@H+](C2CCOCC2)C[C@@H]1c1ccccc1	ZINC000257268220	277103978	/nfs/dbraw/zinc/10/39/78/277103978.db2.gz	MKSPTYXCZQVDMR-MRXNPFEDSA-N	1	1	260.381	2.154	40	0		CEABMO
NC(=O)c1cccc([C@H]2CCC[N@H+]2C2CCCC2)n1	ZINC000257333332	295189299	/nfs/dbraw/zinc/18/92/99/295189299.db2.gz	YBCYZOPJQIADGX-CQSZACIVSA-N	1	1	259.353	2.260	40	0		CEABMO
O=C1[C@H]2C[N@H+](Cc3nccs3)C[C@@H]2CN1c1ccccc1	ZINC000096053579	185074968	/nfs/dbraw/zinc/07/49/68/185074968.db2.gz	OHYFPUCVDPFUIH-OCCSQVGLSA-N	1	1	299.399	2.238	40	0		CEABMO
O=C1[C@H]2C[N@@H+](Cc3nccs3)C[C@@H]2CN1c1ccccc1	ZINC000096053579	185074969	/nfs/dbraw/zinc/07/49/69/185074969.db2.gz	OHYFPUCVDPFUIH-OCCSQVGLSA-N	1	1	299.399	2.238	40	0		CEABMO
CC(C)[N@@H+](C)Cc1cnc2n1CCN(Cc1cccnc1)C2	ZINC000096061778	185083039	/nfs/dbraw/zinc/08/30/39/185083039.db2.gz	AQRQVDIXQMBOAT-UHFFFAOYSA-N	1	1	299.422	2.134	40	0		CEABMO
Cc1ccc(N2CC[C@H]3[C@@H]2CC[N@H+]3Cc2ccccn2)nn1	ZINC000096064062	185083746	/nfs/dbraw/zinc/08/37/46/185083746.db2.gz	GCYODMMXAMATDJ-HOTGVXAUSA-N	1	1	295.390	2.033	40	0		CEABMO
COC[C@]12CCCO[C@@H]1CC[N@@H+](Cc1scnc1C)C2	ZINC000096065000	185084254	/nfs/dbraw/zinc/08/42/54/185084254.db2.gz	MPWGFTVATGFOKA-HUUCEWRRSA-N	1	1	296.436	2.469	40	0		CEABMO
C[C@@H]1CO[C@@]2(CC[N@H+](Cc3ccncc3F)C2)C1	ZINC000096071989	185086861	/nfs/dbraw/zinc/08/68/61/185086861.db2.gz	GKZYVOPGVFRSEM-FZMZJTMJSA-N	1	1	250.317	2.222	40	0		CEABMO
C[C@@H]1CO[C@@]2(CC[N@@H+](Cc3ccncc3F)C2)C1	ZINC000096071989	185086862	/nfs/dbraw/zinc/08/68/62/185086862.db2.gz	GKZYVOPGVFRSEM-FZMZJTMJSA-N	1	1	250.317	2.222	40	0		CEABMO
CC(C)[N@H+](C)C[C@H]1C[C@@H]2CN(Cc3ccncc3)C[C@@H]2O1	ZINC000096100363	185098073	/nfs/dbraw/zinc/09/80/73/185098073.db2.gz	AHGDRSMYOQUJSC-ZACQAIPSSA-N	1	1	289.423	2.011	40	0		CEABMO
CC(C)[N@@H+](C)C[C@H]1C[C@@H]2CN(Cc3ccncc3)C[C@@H]2O1	ZINC000096100363	185098074	/nfs/dbraw/zinc/09/80/74/185098074.db2.gz	AHGDRSMYOQUJSC-ZACQAIPSSA-N	1	1	289.423	2.011	40	0		CEABMO
Cc1ccc(C[NH2+]Cc2cccnc2N2CCOCC2)o1	ZINC000075773589	539171089	/nfs/dbraw/zinc/17/10/89/539171089.db2.gz	BNQIUMQFKFINTO-UHFFFAOYSA-N	1	1	287.363	2.109	40	0		CEABMO
c1ccc(C[N@@H+]2C[C@H]3CC[C@@H](C2)C32OCCO2)cc1	ZINC000095642755	344237441	/nfs/dbraw/zinc/23/74/41/344237441.db2.gz	JWYXZJIPWLIKSZ-GASCZTMLSA-N	1	1	259.349	2.272	40	0		CEABMO
[NH3+]Cc1nc(C2(n3cccc3)CCCCCC2)no1	ZINC000409438549	344889869	/nfs/dbraw/zinc/88/98/69/344889869.db2.gz	CZXCZBMGSISYND-UHFFFAOYSA-N	1	1	260.341	2.428	40	0		CEABMO
CNC(=O)c1cnc([C@@H]2CCC[N@@H+]2CC(C)C)s1	ZINC000585182451	345008985	/nfs/dbraw/zinc/00/89/85/345008985.db2.gz	WQNKHJITMXOZSZ-JTQLQIEISA-N	1	1	267.398	2.296	40	0		CEABMO
CNC(=O)c1cnc([C@@H]2CCC[N@H+]2CC(C)C)s1	ZINC000585182451	345008987	/nfs/dbraw/zinc/00/89/87/345008987.db2.gz	WQNKHJITMXOZSZ-JTQLQIEISA-N	1	1	267.398	2.296	40	0		CEABMO
Cc1cccc(OC[C@]2(O)CC[N@@H+](Cc3ccccn3)C2)c1	ZINC000585268936	345008995	/nfs/dbraw/zinc/00/89/95/345008995.db2.gz	DZEMVCQBESEHDZ-SFHVURJKSA-N	1	1	298.386	2.406	40	0		CEABMO
Cc1n[nH]c(C)c1C[N@H+]1CC[C@H](Cc2ccccc2)[C@H](O)C1	ZINC000585278792	345009939	/nfs/dbraw/zinc/00/99/39/345009939.db2.gz	GHKMUWRCSTYQFK-SJLPKXTDSA-N	1	1	299.418	2.452	40	0		CEABMO
O=C1[C@@H]2C[N@@H+](Cc3ccco3)C[C@@H]2CN1c1ccccc1	ZINC000107742831	186189196	/nfs/dbraw/zinc/18/91/96/186189196.db2.gz	BGDQONXEAPMOTO-CZUORRHYSA-N	1	1	282.343	2.374	40	0		CEABMO
OCCN(C[C@@H]1CCCC[N@H+]1Cc1ccccc1)C1CC1	ZINC000079393551	363593591	/nfs/dbraw/zinc/59/35/91/363593591.db2.gz	IEQTULLHKUGKQD-SFHVURJKSA-N	1	1	288.435	2.498	40	0		CEABMO
OCC[N@H+](C[C@@H]1CCCCN1Cc1ccccc1)C1CC1	ZINC000079393551	363593596	/nfs/dbraw/zinc/59/35/96/363593596.db2.gz	IEQTULLHKUGKQD-SFHVURJKSA-N	1	1	288.435	2.498	40	0		CEABMO
OCC[N@@H+](C[C@@H]1CCCCN1Cc1ccccc1)C1CC1	ZINC000079393551	363593600	/nfs/dbraw/zinc/59/36/00/363593600.db2.gz	IEQTULLHKUGKQD-SFHVURJKSA-N	1	1	288.435	2.498	40	0		CEABMO
O=C([O-])C[N@H+]1CC[C@@H](C[NH+](Cc2ccccc2)C2CC2)C1	ZINC000079416236	363598396	/nfs/dbraw/zinc/59/83/96/363598396.db2.gz	ZBXQQJHMZLWEKY-OAHLLOKOSA-N	1	1	288.391	2.058	40	0		CEABMO
O=C([O-])C[NH+]1CC[C@@H](C[N@H+](Cc2ccccc2)C2CC2)C1	ZINC000079416236	363598401	/nfs/dbraw/zinc/59/84/01/363598401.db2.gz	ZBXQQJHMZLWEKY-OAHLLOKOSA-N	1	1	288.391	2.058	40	0		CEABMO
O=C([O-])C[NH+]1CC[C@@H](C[N@@H+](Cc2ccccc2)C2CC2)C1	ZINC000079416236	363598406	/nfs/dbraw/zinc/59/84/06/363598406.db2.gz	ZBXQQJHMZLWEKY-OAHLLOKOSA-N	1	1	288.391	2.058	40	0		CEABMO
[NH2+]=C(NC(=O)NC1CCCCC1)NC1CCCCC1	ZINC000001665039	361214482	/nfs/dbraw/zinc/21/44/82/361214482.db2.gz	XMYCRGRWWSFISV-UHFFFAOYSA-N	1	1	266.389	2.475	40	0		CEABMO
CCN(CC)C(=O)COC[C@H]1CCC[N@H+]2CCCC[C@@H]12	ZINC000013424999	361428217	/nfs/dbraw/zinc/42/82/17/361428217.db2.gz	YXGLGZVQMGKEBH-CABCVRRESA-N	1	1	282.428	2.136	40	0		CEABMO
COC(=O)[C@H]1C[C@@H]2c3cccc4[nH]cc(c43)C[C@H]2[N@@H+](C)C1	ZINC000029483542	361685246	/nfs/dbraw/zinc/68/52/46/361685246.db2.gz	OSKZYLPFYNARRX-NJZAAPMLSA-N	1	1	284.359	2.301	40	0		CEABMO
CN(Cc1ccco1)[C@@H]1C[N@@H+](CC2CC2)[C@@H]2CCCO[C@H]12	ZINC000096185988	364407408	/nfs/dbraw/zinc/40/74/08/364407408.db2.gz	QWTOXKXZQXKRJH-ZACQAIPSSA-N	1	1	290.407	2.353	40	0		CEABMO
c1ccc(C[N@H+]2C[C@H]3CCN(c4cccnc4)C[C@H]3C2)nc1	ZINC000096081459	364399251	/nfs/dbraw/zinc/39/92/51/364399251.db2.gz	OEFKMRUZQSFEIH-HZPDHXFCSA-N	1	1	294.402	2.435	40	0		CEABMO
C(O[C@@H]1CC[C@H]2[C@H]1OCC[N@H+]2C1CCC1)C1CC1	ZINC000096065782	364399816	/nfs/dbraw/zinc/39/98/16/364399816.db2.gz	JBYROLVYWAISFN-RRFJBIMHSA-N	1	1	251.370	2.197	40	0		CEABMO
COc1ccc(C[N@@H+]2C[C@H](OC)[C@H]3OCCC[C@H]32)cc1	ZINC000096057409	364400657	/nfs/dbraw/zinc/40/06/57/364400657.db2.gz	WZEPJAZABBYNLP-PMPSAXMXSA-N	1	1	277.364	2.073	40	0		CEABMO
CC[N@@H+]1C[C@H](COC)[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC000096216599	364412288	/nfs/dbraw/zinc/41/22/88/364412288.db2.gz	FTNDXSLTRILPGJ-QZTJIDSGSA-N	1	1	288.435	2.477	40	0		CEABMO
CC[N@H+]1C[C@H](COC)[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC000096216599	364412294	/nfs/dbraw/zinc/41/22/94/364412294.db2.gz	FTNDXSLTRILPGJ-QZTJIDSGSA-N	1	1	288.435	2.477	40	0		CEABMO
c1ncn2c1C[N@@H+](CC1CC1)C[C@@H](COc1cccnc1)C2	ZINC000096209343	364412909	/nfs/dbraw/zinc/41/29/09/364412909.db2.gz	ZOWFYNIPKFWMFH-OAHLLOKOSA-N	1	1	298.390	2.199	40	0		CEABMO
C[N@H+]1CCCC[C@]12CCCN(C(=O)c1cccnc1)C2	ZINC000096217572	364413230	/nfs/dbraw/zinc/41/32/30/364413230.db2.gz	NMTDSXGPBCBHBM-MRXNPFEDSA-N	1	1	273.380	2.172	40	0		CEABMO
CC(C)C[N@H+]1CCc2nc(NC(C)C)nc(N(C)C)c2C1	ZINC000096254058	364417024	/nfs/dbraw/zinc/41/70/24/364417024.db2.gz	FRAGDLFVAAAWOV-UHFFFAOYSA-N	1	1	291.443	2.377	40	0		CEABMO
Cc1nc(C)c2c(n1)CC[N@H+](Cc1ccco1)CC2	ZINC000096254508	364418038	/nfs/dbraw/zinc/41/80/38/364418038.db2.gz	JOSAGRRBRNCWFB-UHFFFAOYSA-N	1	1	257.337	2.287	40	0		CEABMO
Cc1ncnc2c1CC[N@@H+](Cc1ccc3c(c1)OCO3)CC2	ZINC000096254955	364418186	/nfs/dbraw/zinc/41/81/86/364418186.db2.gz	QBZYIMXAJNBSEX-UHFFFAOYSA-N	1	1	297.358	2.115	40	0		CEABMO
CC(=O)N1CCC[C@]2(CC[N@@H+](Cc3ccoc3)C2)C1	ZINC000096268728	364419771	/nfs/dbraw/zinc/41/97/71/364419771.db2.gz	MMIILQJHOYMBLC-OAHLLOKOSA-N	1	1	262.353	2.114	40	0		CEABMO
COc1cccc(C(=O)N2CC[C@@]3(C2)CCC[N@@H+](C)C3)c1	ZINC000096268566	364420001	/nfs/dbraw/zinc/42/00/01/364420001.db2.gz	PDEJUARFCIHTIZ-KRWDZBQOSA-N	1	1	288.391	2.253	40	0		CEABMO
CC(C)C[N@H+]1CCC[C@]2(CCC(=O)N2CCF)CC1	ZINC000585099885	367177960	/nfs/dbraw/zinc/17/79/60/367177960.db2.gz	QMRFDJXCMSEMFP-HNNXBMFYSA-N	1	1	270.392	2.459	40	0		CEABMO
CN1c2ncccc2C[N@H+](Cc2ccccc2)CC[C@H]1CO	ZINC000225492302	370299757	/nfs/dbraw/zinc/29/97/57/370299757.db2.gz	ZIXVEXMTSCKYPZ-KRWDZBQOSA-N	1	1	297.402	2.285	40	0	biogenic,in-vitro	CEABMO
CC[C@H](C)n1nccc1C[NH2+]Cc1cnn(CCF)c1	ZINC000256050236	190002906	/nfs/dbraw/zinc/00/29/06/190002906.db2.gz	DGOZNJXAOWKUGQ-LBPRGKRZSA-N	1	1	279.363	2.310	40	0		CEABMO
Cc1nn(C)c(F)c1C[NH2+]Cc1ccc(F)s1	ZINC000256051503	190003487	/nfs/dbraw/zinc/00/34/87/190003487.db2.gz	JKGVIQZGNMVCDX-UHFFFAOYSA-N	1	1	257.309	2.358	40	0		CEABMO
C[C@@]1(O)CC[N@@H+](Cc2ccncc2)C[C@H]1Oc1ccccc1	ZINC000257226273	190015230	/nfs/dbraw/zinc/01/52/30/190015230.db2.gz	FJYIJAFFIFWZIO-QZTJIDSGSA-N	1	1	298.386	2.486	40	0		CEABMO
c1cn2c(n1)nccc2[C@@H]1CC[N@H+](Cc2cccnc2)C1	ZINC000257276849	190025314	/nfs/dbraw/zinc/02/53/14/190025314.db2.gz	NVJLWZFDALSBOM-CQSZACIVSA-N	1	1	279.347	2.114	40	0		CEABMO
C[N@H+]1[C@H](Cc2ccccc2)C[C@H]2NC(=O)CCCC[C@@H]21	ZINC000257314794	190032610	/nfs/dbraw/zinc/03/26/10/190032610.db2.gz	UYMADQTZQSNKRL-OAGGEKHMSA-N	1	1	272.392	2.361	40	0		CEABMO
Cc1nc(N)sc1-c1cncc([C@@H]2CCC[N@H+](C)C2)n1	ZINC000257327227	190034840	/nfs/dbraw/zinc/03/48/40/190034840.db2.gz	XAOFQNFTSRRGKC-SNVBAGLBSA-N	1	1	289.408	2.300	40	0		CEABMO
COc1ccc(N2C(=O)[C@@H]([NH3+])[C@H]2c2cccc(OC)c2)cc1	ZINC000072227158	256703159	/nfs/dbraw/zinc/70/31/59/256703159.db2.gz	MVYYIMXSSCWNDH-JKSUJKDBSA-N	1	1	298.342	2.119	40	0		CEABMO
CCC(=O)c1cnc(N2CC[NH+](CC)CC2)c(C)c1	ZINC000072222583	394594712	/nfs/dbraw/zinc/59/47/12/394594712.db2.gz	CJOCRCZYDISKMX-UHFFFAOYSA-N	1	1	261.369	2.125	40	0		CEABMO
O=C1[C@@H]2C[N@@H+](Cc3ccco3)C[C@H]2CN1c1ccccc1	ZINC000247703188	394534667	/nfs/dbraw/zinc/53/46/67/394534667.db2.gz	BGDQONXEAPMOTO-XJKSGUPXSA-N	1	1	282.343	2.374	40	0		CEABMO
CCC(=O)c1ccc(N2CC[NH+](C(C)C)CC2)nc1	ZINC000072225608	394595277	/nfs/dbraw/zinc/59/52/77/394595277.db2.gz	MSPPRENUDUWCFV-UHFFFAOYSA-N	1	1	261.369	2.205	40	0		CEABMO
[NH3+][C@@H]1C(=O)N(c2cccc(F)c2)[C@H]1c1ccccc1	ZINC000072227607	394596261	/nfs/dbraw/zinc/59/62/61/394596261.db2.gz	QPRORUXQTBIEBL-KBPBESRZSA-N	1	1	256.280	2.241	40	0		CEABMO
[NH3+][C@@H]1C(=O)N(Cc2ccccc2)[C@@H]1c1ccccc1F	ZINC000072228162	394596355	/nfs/dbraw/zinc/59/63/55/394596355.db2.gz	PTSQGZAVHPDLIL-LSDHHAIUSA-N	1	1	270.307	2.237	40	0		CEABMO
CC[NH2+][C@H]1CCN(C(=O)OC(C)(C)C)CC1(F)F	ZINC000169804938	400285040	/nfs/dbraw/zinc/28/50/40/400285040.db2.gz	JUILZUHYPYRALQ-VIFPVBQESA-N	1	1	264.316	2.241	40	0		CEABMO
C[C@@H](NO)[C@H](c1ccc2c(c1)OCO2)[NH+]1CCCCC1	ZINC000006824227	287043004	/nfs/dbraw/zinc/04/30/04/287043004.db2.gz	SJOLSPFJDYHXJK-IAQYHMDHSA-N	1	1	278.352	2.310	40	0		CEABMO
C[C@@H]1CCC[N@@H+](C[C@@H](O)COc2ccc(F)cc2)C1	ZINC000006007641	170167543	/nfs/dbraw/zinc/16/75/43/170167543.db2.gz	NERBENWZMZEVBI-TZMCWYRMSA-N	1	1	267.344	2.297	40	0		CEABMO
CC(C)(C)OC(=O)N1CCC([NH+]2CCC(=O)CC2)CC1	ZINC000071257247	176095930	/nfs/dbraw/zinc/09/59/30/176095930.db2.gz	FXZGHIFLLWIBQD-UHFFFAOYSA-N	1	1	282.384	2.051	40	0		CEABMO
Cc1cc(Nc2cnccn2)nc([C@@H]2CCC[N@H+](C)C2)n1	ZINC000072359947	176377087	/nfs/dbraw/zinc/37/70/87/176377087.db2.gz	OOWFHNZAELRRSJ-GFCCVEGCSA-N	1	1	284.367	2.128	40	0		CEABMO
c1cn2c(n1)nccc2[C@@H]1CC[N@H+](Cc2ccncc2)C1	ZINC000072367947	176382129	/nfs/dbraw/zinc/38/21/29/176382129.db2.gz	LNYRJIPXBSYOCP-CQSZACIVSA-N	1	1	279.347	2.114	40	0		CEABMO
CC(=O)N1CCC[C@H](CCc2cc[nH+]c(N(C)C)c2)C1	ZINC000072381122	176387488	/nfs/dbraw/zinc/38/74/88/176387488.db2.gz	YPQYMJBNPQZQJW-OAHLLOKOSA-N	1	1	275.396	2.339	40	0		CEABMO
Cc1c(C[N@@H+]2CCCC[C@H]2c2ccncn2)cnn1C	ZINC000072385659	176390720	/nfs/dbraw/zinc/39/07/20/176390720.db2.gz	QNHBYAIVDVMIGK-HNNXBMFYSA-N	1	1	271.368	2.246	40	0		CEABMO
Cc1c(C[N@H+]2CCCC[C@H]2c2ccncn2)cnn1C	ZINC000072385659	176390721	/nfs/dbraw/zinc/39/07/21/176390721.db2.gz	QNHBYAIVDVMIGK-HNNXBMFYSA-N	1	1	271.368	2.246	40	0		CEABMO
c1cnc2c(n[nH]c2[C@H]2CCC[N@H+](C3CCCC3)C2)n1	ZINC000072395871	176394492	/nfs/dbraw/zinc/39/44/92/176394492.db2.gz	BLJONTVNWDEAGF-NSHDSACASA-N	1	1	271.368	2.475	40	0		CEABMO
Cc1cccnc1-n1cccc1C[N@H+]1CCC[C@H](CO)C1	ZINC000072397856	176395368	/nfs/dbraw/zinc/39/53/68/176395368.db2.gz	LJZSYCIDBKWIJK-HNNXBMFYSA-N	1	1	285.391	2.385	40	0		CEABMO
CC(=O)NCc1cc([C@H]2CCC[N@@H+]2C(C)C)ccn1	ZINC000257284344	278124074	/nfs/dbraw/zinc/12/40/74/278124074.db2.gz	PCHGPFRHCHSVDU-OAHLLOKOSA-N	1	1	261.369	2.263	40	0		CEABMO
Cc1c[nH]c([C@@H]2CC[N@@H+](CC3(O)CCCCC3)C2)n1	ZINC000257238013	280279115	/nfs/dbraw/zinc/27/91/15/280279115.db2.gz	HJFFKSZCTLBLIH-CYBMUJFWSA-N	1	1	263.385	2.203	40	0		CEABMO
CCNc1ncc(C[NH2+]Cc2ccccc2OC)cn1	ZINC000062717567	333175885	/nfs/dbraw/zinc/17/58/85/333175885.db2.gz	HDFAEQHIFUNSNR-UHFFFAOYSA-N	1	1	272.352	2.207	40	0		CEABMO
CCOC[C@@H]1CCC[C@@]12C[N@@H+](CC1CCOCC1)CCO2	ZINC000096051878	185074250	/nfs/dbraw/zinc/07/42/50/185074250.db2.gz	YWEOLEHBYKGXFN-DLBZAZTESA-N	1	1	297.439	2.321	40	0		CEABMO
CO[C@H]1CO[C@@]2(CC[N@@H+](Cc3ccccc3F)C2)C1	ZINC000096072178	185088036	/nfs/dbraw/zinc/08/80/36/185088036.db2.gz	CRADNAIOGBRIIJ-HIFRSBDPSA-N	1	1	265.328	2.206	40	0		CEABMO
COCC[C@@H]1CO[C@]2(C1)CCC[N@@H+](Cc1ccncc1)C2	ZINC000096089853	185094988	/nfs/dbraw/zinc/09/49/88/185094988.db2.gz	HVAHXPKUFJYZSK-IRXDYDNUSA-N	1	1	290.407	2.489	40	0		CEABMO
Cc1cc[nH+]c(N2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000040434873	361992731	/nfs/dbraw/zinc/99/27/31/361992731.db2.gz	CNUPZJGHICNMJM-UHFFFAOYSA-N	1	1	277.368	2.447	40	0		CEABMO
CNc1cc(N2CCc3cc([C@@H](C)O)ccc3C2)[nH+]c(C)n1	ZINC000329012106	136377434	/nfs/dbraw/zinc/37/74/34/136377434.db2.gz	MJLIRJSHIGKKFI-LLVKDONJSA-N	1	1	298.390	2.443	40	0		CEABMO
Brc1ccc2c(c1)OCC[C@]21COCC[NH2+]1	ZINC000306145842	539438945	/nfs/dbraw/zinc/43/89/45/539438945.db2.gz	SBCAHBAJYVKWNL-LBPRGKRZSA-N	1	1	284.153	2.047	40	0		CEABMO
CN(C)C(=O)[C@H]1CCC[C@]12CC[N@@H+](Cc1ccncc1)C2	ZINC000108526821	186221312	/nfs/dbraw/zinc/22/13/12/186221312.db2.gz	FQJZGXQTMMNVHU-NVXWUHKLSA-N	1	1	287.407	2.162	40	0		CEABMO
CN(C)C(=O)[C@H]1CCC[C@]12CC[N@@H+](Cc1cccnc1)C2	ZINC000108535621	186221898	/nfs/dbraw/zinc/22/18/98/186221898.db2.gz	NJSPWOZGJRDLMX-NVXWUHKLSA-N	1	1	287.407	2.162	40	0		CEABMO
O=C1NCC[C@]12CCC[N@@H+](Cc1ccsc1)CC2	ZINC000108532376	186222086	/nfs/dbraw/zinc/22/20/86/186222086.db2.gz	LRNZOGHWDQEIKA-AWEZNQCLSA-N	1	1	264.394	2.240	40	0		CEABMO
Brc1ccc([C@@H]2C[C@@H]2C[NH+]2CCNCC2)cc1	ZINC000575424320	366284229	/nfs/dbraw/zinc/28/42/29/366284229.db2.gz	YWNHAKLRYRIPIH-OCCSQVGLSA-N	1	1	295.224	2.458	40	0		CEABMO
Cc1cccc(N2C(=N)NC(=[NH2+])NC23CCCCC3)c1	ZINC000000203634	361144757	/nfs/dbraw/zinc/14/47/57/361144757.db2.gz	YNNMFPKTGNGOMS-UHFFFAOYSA-N	1	1	271.368	2.105	40	0		CEABMO
Nc1ccc(C(=O)NC[C@@H]2CCC[N@H+]3CCCC[C@H]23)cc1	ZINC000000055272	361122365	/nfs/dbraw/zinc/12/23/65/361122365.db2.gz	MKNQZZGCGYYGOH-GOEBONIOSA-N	1	1	287.407	2.263	40	0		CEABMO
COc1ccc(C[C@H]([NH3+])C(=O)OCCc2ccccc2)cc1	ZINC000001679154	361216468	/nfs/dbraw/zinc/21/64/68/361216468.db2.gz	LQAKRDXSVHMAMG-KRWDZBQOSA-N	1	1	299.370	2.351	40	0		CEABMO
COc1ccc(C)cc1NC(=O)[C@H]1CCC[N@@H+](C)C1	ZINC000082326191	363765391	/nfs/dbraw/zinc/76/53/91/363765391.db2.gz	NOMUHRXMJSXSEN-LBPRGKRZSA-N	1	1	262.353	2.284	40	0		CEABMO
C=Cn1ncc(C[N@H+]2CC[C@@]3(O)CCCC[C@@H]3C2)c1C	ZINC000012146534	361374699	/nfs/dbraw/zinc/37/46/99/361374699.db2.gz	XKJBIGFPYFIZLS-CVEARBPZSA-N	1	1	275.396	2.419	40	0		CEABMO
CC(C)(COC(=O)c1ccccc1)[N@H+]1C[C@H]2CC[C@@H](C1)O2	ZINC000016918806	361498594	/nfs/dbraw/zinc/49/85/94/361498594.db2.gz	PBCDVKWDWPYURB-GASCZTMLSA-N	1	1	289.375	2.485	40	0		CEABMO
CC(C)(COC(=O)c1ccccc1)[N@@H+]1C[C@H]2CC[C@@H](C1)O2	ZINC000016918806	361498597	/nfs/dbraw/zinc/49/85/97/361498597.db2.gz	PBCDVKWDWPYURB-GASCZTMLSA-N	1	1	289.375	2.485	40	0		CEABMO
COc1ccc(C[N@H+]2CC[C@@H](c3cc(=O)[nH]c(C)n3)C2)cc1	ZINC000019285244	361525655	/nfs/dbraw/zinc/52/56/55/361525655.db2.gz	WBMJTKMHUYYTFG-CQSZACIVSA-N	1	1	299.374	2.076	40	0		CEABMO
CCc1noc(C)c1C(=O)NC[C@@H]1CCCC[N@@H+]1CC	ZINC000019521278	361541969	/nfs/dbraw/zinc/54/19/69/361541969.db2.gz	CSAINSJXKBKGSK-LBPRGKRZSA-N	1	1	279.384	2.150	40	0		CEABMO
Cc1nn(C)cc1C[N@H+]1[C@@H]2CC[C@H]1Cc1nc(C)ncc12	ZINC000019583721	361545067	/nfs/dbraw/zinc/54/50/67/361545067.db2.gz	ZRGDOQYMJHJKDG-XJKSGUPXSA-N	1	1	283.379	2.089	40	0		CEABMO
Cc1nn(C)cc1C[N@@H+]1[C@@H]2CC[C@H]1Cc1nc(C)ncc12	ZINC000019583721	361545072	/nfs/dbraw/zinc/54/50/72/361545072.db2.gz	ZRGDOQYMJHJKDG-XJKSGUPXSA-N	1	1	283.379	2.089	40	0		CEABMO
c1ccc(N2CC[C@H]3[C@@H]2CC[N@@H+]3CC2CCOCC2)nc1	ZINC000096184435	364407677	/nfs/dbraw/zinc/40/76/77/364407677.db2.gz	YRHITWJVNXSXKP-HOTGVXAUSA-N	1	1	287.407	2.161	40	0		CEABMO
C[N@H+]1CC[C@@]2(C1)CCC[C@@H](CNC(=O)c1ccsc1)O2	ZINC000096208639	364412852	/nfs/dbraw/zinc/41/28/52/364412852.db2.gz	BAIYODQYLBSSFB-DZGCQCFKSA-N	1	1	294.420	2.121	40	0		CEABMO
O=C([C@@H]1CCCO1)N1CCC2(CCC[N@H+]2CC2CC2)CC1	ZINC000096227894	364415320	/nfs/dbraw/zinc/41/53/20/364415320.db2.gz	RVGCVEUINIQISH-HNNXBMFYSA-N	1	1	292.423	2.032	40	0		CEABMO
CC[N@H+]1CC[C@@]2(C1)COCc1cnc(-c3cccnc3)nc12	ZINC000096244282	364416859	/nfs/dbraw/zinc/41/68/59/364416859.db2.gz	DUUDUSBRGORMPC-QGZVFWFLSA-N	1	1	296.374	2.032	40	0		CEABMO
O=C1C[C@H]2[C@H](CC[N@H+]2Cc2ccsc2)N1CC1CC1	ZINC000096245874	364416983	/nfs/dbraw/zinc/41/69/83/364416983.db2.gz	PSBXRYJPWORANQ-KBPBESRZSA-N	1	1	276.405	2.333	40	0		CEABMO
O=C(Nc1ccccc1)[C@H]1C[C@@H]2C[N@@H+](CC3CC3)C[C@H]1O2	ZINC000096253405	364417319	/nfs/dbraw/zinc/41/73/19/364417319.db2.gz	NHHKKJZQVBRHEV-OWCLPIDISA-N	1	1	286.375	2.124	40	0		CEABMO
c1ccc(-c2ncnc3c2CC[N@@H+]([C@H]2CCOC2)CC3)cc1	ZINC000096255375	364418940	/nfs/dbraw/zinc/41/89/40/364418940.db2.gz	BRSYLANQGCFRAR-HNNXBMFYSA-N	1	1	295.386	2.333	40	0		CEABMO
CCc1ncnc2c1CC[N@@H+](Cc1ccccn1)CC2	ZINC000096255021	364419094	/nfs/dbraw/zinc/41/90/94/364419094.db2.gz	VRKGDJBZAIPRRS-UHFFFAOYSA-N	1	1	268.364	2.035	40	0		CEABMO
COc1ccc2c3c1O[C@@H]1C=CC=C4[C@H](C2)[N@@H+](C)CC[C@]341	ZINC000096316386	364420987	/nfs/dbraw/zinc/42/09/87/364420987.db2.gz	UYDXNVYSAYJCMN-JOQOYGCGSA-N	1	1	281.355	2.450	40	0	biogenic,in-vitro	CEABMO
CC[C@@H](C)[N@H+]1CCC[C@@]2(CN(Cc3cncs3)C2=O)C1	ZINC000585099711	367177154	/nfs/dbraw/zinc/17/71/54/367177154.db2.gz	ZJARAEIXWPJORA-DOMZBBRYSA-N	1	1	293.436	2.366	40	0		CEABMO
C[N@H+]1CCC[C@@]12CCCN(C(=O)c1ccncc1)CC2	ZINC000585100140	367177299	/nfs/dbraw/zinc/17/72/99/367177299.db2.gz	GRMJMJMBNWDUNP-INIZCTEOSA-N	1	1	273.380	2.172	40	0		CEABMO
CN1C[C@@]2(CCC[N@@H+](CC3CCCCC3)C2)C1=O	ZINC000585099352	367177321	/nfs/dbraw/zinc/17/73/21/367177321.db2.gz	GXCCMVQNPAVUCT-OAHLLOKOSA-N	1	1	250.386	2.121	40	0		CEABMO
COC[C@H]1CCn2nccc2C[N@@H+]1Cc1ncccc1C	ZINC000585097662	367177691	/nfs/dbraw/zinc/17/76/91/367177691.db2.gz	PDWOHEHOKRJTIF-OAHLLOKOSA-N	1	1	286.379	2.007	40	0		CEABMO
COC[C@H]1CCn2nccc2C[N@H+]1Cc1ncccc1C	ZINC000585097662	367177700	/nfs/dbraw/zinc/17/77/00/367177700.db2.gz	PDWOHEHOKRJTIF-OAHLLOKOSA-N	1	1	286.379	2.007	40	0		CEABMO
O=C([C@H]1CCC[C@@]12CC[N@@H+](CC1CC1)C2)N1CC(F)(F)C1	ZINC000108531117	296116724	/nfs/dbraw/zinc/11/67/24/296116724.db2.gz	HKEHDJZHPRFTIW-HIFRSBDPSA-N	1	1	298.377	2.366	40	0		CEABMO
C(O[C@H]1[C@H]2CC[C@@H]1[N@@H+](CC1CC1)CCO2)C1CC1	ZINC000247978649	371151929	/nfs/dbraw/zinc/15/19/29/371151929.db2.gz	WXHHRBMHULUJSW-RRFJBIMHSA-N	1	1	251.370	2.055	40	0		CEABMO
FCCn1nccc1C[NH2+]Cc1cnn(C2CCCC2)c1	ZINC000256053853	190004983	/nfs/dbraw/zinc/00/49/83/190004983.db2.gz	TXFOUDWRLVMVJL-UHFFFAOYSA-N	1	1	291.374	2.454	40	0		CEABMO
O[C@@H]1C[C@H]2C[N@@H+](Cc3ccc4ncccc4c3)C[C@H]2C1	ZINC000257222441	190014655	/nfs/dbraw/zinc/01/46/55/190014655.db2.gz	DTHXHPMQNXNBFJ-ZSHCYNCHSA-N	1	1	268.360	2.438	40	0		CEABMO
CCN(CC)C(=O)c1cnc([C@@H]2CCCC[NH2+]2)nc1C	ZINC000257247109	190019395	/nfs/dbraw/zinc/01/93/95/190019395.db2.gz	IXNCGFVFWBMPLM-ZDUSSCGKSA-N	1	1	276.384	2.082	40	0		CEABMO
CN(C(=O)c1c[nH]nc1[C@H]1CCC[NH2+]1)c1ccccc1	ZINC000257244197	190019403	/nfs/dbraw/zinc/01/94/03/190019403.db2.gz	IKISEWKRMXFEPC-CYBMUJFWSA-N	1	1	270.336	2.111	40	0		CEABMO
CCN(CC)C(=O)c1cnc([C@H]2CCCC[NH2+]2)nc1C	ZINC000257247108	190019612	/nfs/dbraw/zinc/01/96/12/190019612.db2.gz	IXNCGFVFWBMPLM-CYBMUJFWSA-N	1	1	276.384	2.082	40	0		CEABMO
CC[NH+]1CCC(N2CCN(C)[C@H](c3ccccc3)C2)CC1	ZINC000257268129	190023682	/nfs/dbraw/zinc/02/36/82/190023682.db2.gz	MKJDQVWEDPSGTG-SFHVURJKSA-N	1	1	287.451	2.459	40	0		CEABMO
Cc1cn(C)c([C@@H]2CCC[N@@H+](Cc3[nH]cnc3C)C2)n1	ZINC000257272261	190023964	/nfs/dbraw/zinc/02/39/64/190023964.db2.gz	NBRRDXRGHAQQFD-CYBMUJFWSA-N	1	1	273.384	2.140	40	0		CEABMO
CC(C)[N@H+]1CCC[C@@H](c2cncc(-c3cnn(C)c3)n2)C1	ZINC000257277982	190025420	/nfs/dbraw/zinc/02/54/20/190025420.db2.gz	OAGLMZYWOKFKPP-CYBMUJFWSA-N	1	1	285.395	2.465	40	0		CEABMO
OCC[N@H+]1CCC[C@@H]1c1cccc(Oc2cccnc2)n1	ZINC000257279375	190025764	/nfs/dbraw/zinc/02/57/64/190025764.db2.gz	OGGWYYZPXXSFOR-OAHLLOKOSA-N	1	1	285.347	2.398	40	0		CEABMO
Cc1cc(C[NH+]2CCC(c3ccnc4ccnn43)CC2)no1	ZINC000257312250	190031637	/nfs/dbraw/zinc/03/16/37/190031637.db2.gz	UNAKNGXKJZJUDT-UHFFFAOYSA-N	1	1	297.362	2.405	40	0		CEABMO
CC(C)[N@H+]1CC[C@H](c2n[nH]cc2-c2ccnc(N)c2)C1	ZINC000257290440	190028023	/nfs/dbraw/zinc/02/80/23/190028023.db2.gz	QCYUQGNILGDDAJ-LBPRGKRZSA-N	1	1	271.368	2.252	40	0		CEABMO
Cc1nc[nH]c1C[N@H+]1CCC[C@@H](c2ccc3c[nH]nc3n2)C1	ZINC000257317848	190032766	/nfs/dbraw/zinc/03/27/66/190032766.db2.gz	VLLGSVSFJHNQKH-CYBMUJFWSA-N	1	1	296.378	2.369	40	0		CEABMO
CN(C)c1cc([C@@H]2CCC[N@@H+](Cc3cnn(C)c3)C2)ccn1	ZINC000257314577	190032886	/nfs/dbraw/zinc/03/28/86/190032886.db2.gz	UXOOSTUIZGVYKV-MRXNPFEDSA-N	1	1	299.422	2.261	40	0		CEABMO
Cc1ccc([C@@H]2[C@H]([NH3+])C(=O)N2c2ccc(F)cc2)o1	ZINC000072227218	394595188	/nfs/dbraw/zinc/59/51/88/394595188.db2.gz	LTKGARFDKBEJDE-QWHCGFSZSA-N	1	1	260.268	2.142	40	0		CEABMO
COc1cccc([C@@H]2[C@H]([NH3+])C(=O)N2c2ccc(F)cc2)c1	ZINC000072227222	394595268	/nfs/dbraw/zinc/59/52/68/394595268.db2.gz	QLMHZURZFQDQGH-LSDHHAIUSA-N	1	1	286.306	2.250	40	0		CEABMO
Cc1cccc(N2C(=O)[C@H]([NH3+])[C@H]2c2ccc3c(c2)OCO3)c1	ZINC000072227420	394596415	/nfs/dbraw/zinc/59/64/15/394596415.db2.gz	QSFRUXLWQVPDDO-HZPDHXFCSA-N	1	1	296.326	2.139	40	0		CEABMO
Cc1ccc([C@H]2[C@@H]([NH3+])C(=O)N2Cc2ccccc2)cc1	ZINC000072228121	394596696	/nfs/dbraw/zinc/59/66/96/394596696.db2.gz	SZTPIZQQBNMZEM-CVEARBPZSA-N	1	1	266.344	2.406	40	0		CEABMO
COc1cccc([C@@H]2[C@@H]([NH3+])C(=O)N2c2cccc(F)c2)c1	ZINC000072227628	394596724	/nfs/dbraw/zinc/59/67/24/394596724.db2.gz	JCCNXIYOKNTTFY-HUUCEWRRSA-N	1	1	286.306	2.250	40	0		CEABMO
Cc1ccc(N2C(=O)[C@H]([NH3+])[C@H]2c2ccc3c(c2)OCO3)cc1	ZINC000072227464	394596738	/nfs/dbraw/zinc/59/67/38/394596738.db2.gz	HHNIEFVQXKKMLP-HZPDHXFCSA-N	1	1	296.326	2.139	40	0		CEABMO
CCN1C(=O)[C@@H]([NH3+])[C@@H]1c1ccc(Cl)cc1Cl	ZINC000096526079	394697449	/nfs/dbraw/zinc/69/74/49/394697449.db2.gz	WTJUGUHOEKJQEP-UWVGGRQHSA-N	1	1	259.136	2.224	40	0		CEABMO
CC(=O)N1CCC[C@@H]([N@H+]2CCc3ccccc3C2)C1	ZINC000408604103	395302063	/nfs/dbraw/zinc/30/20/63/395302063.db2.gz	DJJKNZXVUDAVQI-MRXNPFEDSA-N	1	1	258.365	2.056	40	0		CEABMO
COC(=O)[C@@H]1C[N@@H+](C)C[C@@H]1c1cccc(Cl)c1	ZINC000217669378	400307776	/nfs/dbraw/zinc/30/77/76/400307776.db2.gz	GRUWZCAOPKGXBQ-VXGBXAGGSA-N	1	1	253.729	2.158	40	0		CEABMO
C[C@@]1([NH2+]Cc2ccccc2Cl)CCS(=O)(=O)C1	ZINC000035223100	172067394	/nfs/dbraw/zinc/06/73/94/172067394.db2.gz	NKJOJFAOWKIUOY-GFCCVEGCSA-N	1	1	273.785	2.007	40	0		CEABMO
C[NH+]1CCN(C(=O)COc2ccccc2C(C)(C)C)CC1	ZINC000035448526	172203135	/nfs/dbraw/zinc/20/31/35/172203135.db2.gz	FGTQQIUIHKIBBD-UHFFFAOYSA-N	1	1	290.407	2.137	40	0		CEABMO
NC(=O)C[C@@H]([NH3+])c1ccc(-c2ccccc2Cl)o1	ZINC000044252947	175156405	/nfs/dbraw/zinc/15/64/05/175156405.db2.gz	FIZZASVNJWAOJH-SNVBAGLBSA-N	1	1	264.712	2.475	40	0		CEABMO
C[N@H+]1CCC[C@@H]1CCc1cnc(Br)cn1	ZINC000072363347	176377480	/nfs/dbraw/zinc/37/74/80/176377480.db2.gz	UWTUBLPALRKEQQ-SNVBAGLBSA-N	1	1	270.174	2.266	40	0		CEABMO
COc1cccc(OCCc2cc([C@H]3CC[NH2+]C3)n[nH]2)c1	ZINC000072374098	176385176	/nfs/dbraw/zinc/38/51/76/176385176.db2.gz	QDPWFEGGXYYZRE-LBPRGKRZSA-N	1	1	287.363	2.117	40	0		CEABMO
Cn1cc(C[N@H+]2CCC[C@H](Cc3nccs3)C2)cn1	ZINC000072385813	176390706	/nfs/dbraw/zinc/39/07/06/176390706.db2.gz	RQUKBPDBUNWAHU-GFCCVEGCSA-N	1	1	276.409	2.331	40	0		CEABMO
C[N@H+]1CCCC[C@H]1c1cncc(NCC2(C)COC2)n1	ZINC000072388947	176393984	/nfs/dbraw/zinc/39/39/84/176393984.db2.gz	GLVPXGRHQKNQEA-ZDUSSCGKSA-N	1	1	276.384	2.082	40	0		CEABMO
O[C@H]1CCC[N@H+](Cc2ccc(Sc3ncccn3)o2)C1	ZINC000072397816	176395423	/nfs/dbraw/zinc/39/54/23/176395423.db2.gz	NOYUCLORMBMNJA-NSHDSACASA-N	1	1	291.376	2.178	40	0		CEABMO
O[C@H]1CCC[N@@H+](Cc2ccc(Sc3ncccn3)o2)C1	ZINC000072397816	176395424	/nfs/dbraw/zinc/39/54/24/176395424.db2.gz	NOYUCLORMBMNJA-NSHDSACASA-N	1	1	291.376	2.178	40	0		CEABMO
CC(C)C[N@@H+]1CCCC[C@H]1c1ncc(C(N)=O)s1	ZINC000257339717	277388803	/nfs/dbraw/zinc/38/88/03/277388803.db2.gz	ZCWZNYFVXVIWCQ-JTQLQIEISA-N	1	1	267.398	2.425	40	0		CEABMO
CC(C)C[N@H+]1CCCC[C@H]1c1ncc(C(N)=O)s1	ZINC000257339717	277388804	/nfs/dbraw/zinc/38/88/04/277388804.db2.gz	ZCWZNYFVXVIWCQ-JTQLQIEISA-N	1	1	267.398	2.425	40	0		CEABMO
C[C@]12CCC[N@@H+](Cc3ccccc3)[C@H]1CCC(=O)N2	ZINC000095951582	185039691	/nfs/dbraw/zinc/03/96/91/185039691.db2.gz	OUVJUMLVGZIMIZ-HOCLYGCPSA-N	1	1	258.365	2.320	40	0		CEABMO
CN1C(=O)CCC[C@@]12CCC[N@@H+](Cc1ccccn1)C2	ZINC000096049967	185073979	/nfs/dbraw/zinc/07/39/79/185073979.db2.gz	KBVZWKUZKRZQPF-INIZCTEOSA-N	1	1	273.380	2.059	40	0		CEABMO
c1coc(C[N@H+]2C[C@H]3CN(Cc4cccnc4)C[C@H]3C2)c1	ZINC000096053720	185074493	/nfs/dbraw/zinc/07/44/93/185074493.db2.gz	BYTKRPZSTBUPQP-IYBDPMFKSA-N	1	1	283.375	2.238	40	0		CEABMO
c1coc(CN2C[C@@H]3C[N@@H+](Cc4cccnc4)C[C@@H]3C2)c1	ZINC000096053720	185074494	/nfs/dbraw/zinc/07/44/94/185074494.db2.gz	BYTKRPZSTBUPQP-IYBDPMFKSA-N	1	1	283.375	2.238	40	0		CEABMO
c1coc(CN2C[C@@H]3C[N@H+](Cc4cccnc4)C[C@@H]3C2)c1	ZINC000096053720	185074497	/nfs/dbraw/zinc/07/44/97/185074497.db2.gz	BYTKRPZSTBUPQP-IYBDPMFKSA-N	1	1	283.375	2.238	40	0		CEABMO
CCOC[C@@]12CCCO[C@H]1CC[N@@H+](Cc1ccncc1)C2	ZINC000096056813	185077962	/nfs/dbraw/zinc/07/79/62/185077962.db2.gz	PBORYDSXKKSBKD-IRXDYDNUSA-N	1	1	290.407	2.489	40	0		CEABMO
CCn1ncc2c1[C@@H](COC)C[N@H+](Cc1cccnc1)C2	ZINC000096060152	185081546	/nfs/dbraw/zinc/08/15/46/185081546.db2.gz	HPGFFAVLLRYQSY-OAHLLOKOSA-N	1	1	286.379	2.044	40	0		CEABMO
CCn1ncc2c1[C@@H](COC)C[N@@H+](Cc1cccnc1)C2	ZINC000096060152	185081547	/nfs/dbraw/zinc/08/15/47/185081547.db2.gz	HPGFFAVLLRYQSY-OAHLLOKOSA-N	1	1	286.379	2.044	40	0		CEABMO
CC(C)[N@@H+](C)Cc1cnc2n1CCN(c1ccccn1)CC2	ZINC000096067884	185085745	/nfs/dbraw/zinc/08/57/45/185085745.db2.gz	WFCWKGBVQHYAAT-UHFFFAOYSA-N	1	1	299.422	2.181	40	0		CEABMO
C[NH+](C)Cc1[nH]nc2c1CCN(Cc1ccc(F)cc1)C2	ZINC000096084097	185091769	/nfs/dbraw/zinc/09/17/69/185091769.db2.gz	NNSFCBWEGWQCQO-UHFFFAOYSA-N	1	1	288.370	2.169	40	0		CEABMO
CO[C@H]1CC=C2CC[N@H+]3CCC4=C(CCOC4)[C@]23C1	ZINC000025540716	343386585	/nfs/dbraw/zinc/38/65/85/343386585.db2.gz	QUJGKXLFHIGUGU-HOCLYGCPSA-N	1	1	261.365	2.287	40	0		CEABMO
C[C@@H](C[NH2+]CC(C)(C)CN(C)C)C(=O)OC(C)(C)C	ZINC000047219144	362201829	/nfs/dbraw/zinc/20/18/29/362201829.db2.gz	BFPUNVDZQBNHES-LBPRGKRZSA-N	1	1	272.433	2.142	40	0		CEABMO
Cn1c2ccccc2nc1[C@H]1CC[N@H+](Cc2ncc[nH]2)C1	ZINC000049171214	362343948	/nfs/dbraw/zinc/34/39/48/362343948.db2.gz	HNEYWLKIGVQXFA-LBPRGKRZSA-N	1	1	281.363	2.286	40	0	biogenic,in-vitro	CEABMO
Cn1c2ccccc2nc1[C@H]1CC[N@@H+](Cc2ncc[nH]2)C1	ZINC000049171214	362343952	/nfs/dbraw/zinc/34/39/52/362343952.db2.gz	HNEYWLKIGVQXFA-LBPRGKRZSA-N	1	1	281.363	2.286	40	0	biogenic,in-vitro	CEABMO
CC(C)C[N@H+]1CC[C@H](c2nc3c(cccc3C(N)=O)[nH]2)C1	ZINC000049171125	362343997	/nfs/dbraw/zinc/34/39/97/362343997.db2.gz	YHDDSUVESRGAMC-NSHDSACASA-N	1	1	286.379	2.107	40	0	biogenic,in-vitro	CEABMO
CC(C)C[N@@H+]1CC[C@H](c2nc3cccc(C(N)=O)c3[nH]2)C1	ZINC000049171125	362344000	/nfs/dbraw/zinc/34/40/00/362344000.db2.gz	YHDDSUVESRGAMC-NSHDSACASA-N	1	1	286.379	2.107	40	0	biogenic,in-vitro	CEABMO
CC(C)C[N@H+]1CC[C@H](c2nc3cccc(C(N)=O)c3[nH]2)C1	ZINC000049171125	362344004	/nfs/dbraw/zinc/34/40/04/362344004.db2.gz	YHDDSUVESRGAMC-NSHDSACASA-N	1	1	286.379	2.107	40	0	biogenic,in-vitro	CEABMO
c1cc(C[N@@H+]2CC[C@]3(C[C@@H](OCC4CC4)CO3)C2)ccn1	ZINC000107225671	186163528	/nfs/dbraw/zinc/16/35/28/186163528.db2.gz	HYDQXXYKNSXRQR-SJORKVTESA-N	1	1	288.391	2.242	40	0		CEABMO
CCC(=O)N1CC[C@@]2(c3ccccc3)CC[N@@H+](C)[C@H]2C1	ZINC000107260303	186164835	/nfs/dbraw/zinc/16/48/35/186164835.db2.gz	BWMHZOIKSIBNDQ-DOTOQJQBSA-N	1	1	272.392	2.271	40	0		CEABMO
Cc1ccccc1OC[C@H](C)NC(=O)[C@@H]1CCC[N@@H+](C)C1	ZINC000073048704	363194271	/nfs/dbraw/zinc/19/42/71/363194271.db2.gz	QZJQGRTYWPIMOH-LSDHHAIUSA-N	1	1	290.407	2.220	40	0		CEABMO
CC(C)[N@@H+](CCO)C[C@@H]1CCCN1Cc1ccccc1	ZINC000079395085	363595619	/nfs/dbraw/zinc/59/56/19/363595619.db2.gz	JZTICFJSVCLETF-KRWDZBQOSA-N	1	1	276.424	2.354	40	0		CEABMO
CC(C)N(CCO)C[C@@H]1CCC[N@@H+]1Cc1ccccc1	ZINC000079395085	363595626	/nfs/dbraw/zinc/59/56/26/363595626.db2.gz	JZTICFJSVCLETF-KRWDZBQOSA-N	1	1	276.424	2.354	40	0		CEABMO
CC(C)N(CCO)C[C@@H]1CCC[N@H+]1Cc1ccccc1	ZINC000079395085	363595631	/nfs/dbraw/zinc/59/56/31/363595631.db2.gz	JZTICFJSVCLETF-KRWDZBQOSA-N	1	1	276.424	2.354	40	0		CEABMO
C[N@H+]1CCC[C@@H](C(=O)NCc2ccccc2Cl)C1	ZINC000082307039	363762332	/nfs/dbraw/zinc/76/23/32/363762332.db2.gz	AMYPANUACMCPMU-GFCCVEGCSA-N	1	1	266.772	2.298	40	0		CEABMO
C[N@H+]1CCC[C@H](C(=O)NCc2ccccc2Cl)C1	ZINC000082307036	363763032	/nfs/dbraw/zinc/76/30/32/363763032.db2.gz	AMYPANUACMCPMU-LBPRGKRZSA-N	1	1	266.772	2.298	40	0		CEABMO
COc1ccc(C[N@H+]2CC[C@H](c3cc(=O)[nH]c(C)n3)C2)cc1	ZINC000019285245	361525332	/nfs/dbraw/zinc/52/53/32/361525332.db2.gz	WBMJTKMHUYYTFG-AWEZNQCLSA-N	1	1	299.374	2.076	40	0		CEABMO
CCOc1ncccc1-c1noc(C[NH+]2CCCC2)n1	ZINC000019531587	361542028	/nfs/dbraw/zinc/54/20/28/361542028.db2.gz	ZCEKFYMPUUKINN-UHFFFAOYSA-N	1	1	274.324	2.126	40	0		CEABMO
COC(=O)c1ccc(CN2C[C@@H]3CCC[N@H+]3C[C@H]2C)cc1	ZINC000019575104	361543696	/nfs/dbraw/zinc/54/36/96/361543696.db2.gz	XIPUQLOHVWTLQE-CJNGLKHVSA-N	1	1	288.391	2.142	40	0		CEABMO
O=C(c1ccccc1)[C@H]([NH2+]CCO)c1ccccc1	ZINC000031923928	361722362	/nfs/dbraw/zinc/72/23/62/361722362.db2.gz	KMVJBLJDQFGNPO-OAHLLOKOSA-N	1	1	255.317	2.193	40	0		CEABMO
CCC[N@H+]1CC[C@@]2(C[C@@H]2C(=O)N(C)Cc2ccccn2)C1	ZINC000096159203	364402723	/nfs/dbraw/zinc/40/27/23/364402723.db2.gz	LKCKXOLVHVLMBV-NVXWUHKLSA-N	1	1	287.407	2.162	40	0		CEABMO
Cc1ccc(C[N@H+]2CCN(C)c3ncccc3C2)o1	ZINC000096198783	364408713	/nfs/dbraw/zinc/40/87/13/364408713.db2.gz	OMFBCWAJMTYUHV-UHFFFAOYSA-N	1	1	257.337	2.435	40	0		CEABMO
Cc1ccc(C[N@@H+]2CCN(C)c3ncccc3C2)o1	ZINC000096198783	364408716	/nfs/dbraw/zinc/40/87/16/364408716.db2.gz	OMFBCWAJMTYUHV-UHFFFAOYSA-N	1	1	257.337	2.435	40	0		CEABMO
O[C@H]1CC[N@@H+](Cc2ccc(F)cc2)[C@H]1Cc1cccnc1	ZINC000096200434	364410891	/nfs/dbraw/zinc/41/08/91/364410891.db2.gz	YAEWDXCHBMSKBU-IRXDYDNUSA-N	1	1	286.350	2.399	40	0		CEABMO
Cc1nc(N2CCCC2)nc2c1C[N@@H+](C(C)C)CC2	ZINC000096253838	364416003	/nfs/dbraw/zinc/41/60/03/364416003.db2.gz	ODOFMQJHHZCKBW-UHFFFAOYSA-N	1	1	260.385	2.152	40	0		CEABMO
c1csc(CN2CC[N@H+]3C[C@H](OCC4CC4)C[C@H]3C2)c1	ZINC000253588672	371530369	/nfs/dbraw/zinc/53/03/69/371530369.db2.gz	NRAXYOAGABLPCC-LSDHHAIUSA-N	1	1	292.448	2.433	40	0		CEABMO
FCCn1nccc1C[NH2+]Cc1cc(F)ccc1F	ZINC000256052615	190004173	/nfs/dbraw/zinc/00/41/73/190004173.db2.gz	OAXFIDOCOUBEOT-UHFFFAOYSA-N	1	1	269.270	2.421	40	0		CEABMO
FCCn1nccc1C[NH2+]Cc1cccc(F)c1F	ZINC000256052429	190004623	/nfs/dbraw/zinc/00/46/23/190004623.db2.gz	NGGMDKXRDIWYHA-UHFFFAOYSA-N	1	1	269.270	2.421	40	0		CEABMO
CCCn1cc(C[N@H+]2CCC[C@@H](Cc3cc[nH]n3)C2)cn1	ZINC000257208581	190012550	/nfs/dbraw/zinc/01/25/50/190012550.db2.gz	BMTJMYIZPJRJCU-AWEZNQCLSA-N	1	1	287.411	2.471	40	0		CEABMO
CCN1CCC([N@H+]2CCC[C@@H](c3n[nH]cc3C)C2)CC1	ZINC000257214803	190012888	/nfs/dbraw/zinc/01/28/88/190012888.db2.gz	CNMAHDHURPIVAA-CQSZACIVSA-N	1	1	276.428	2.382	40	0		CEABMO
Fc1ccc(OCC[N@H+]2CC[C@H](c3cc[nH]n3)C2)cc1	ZINC000257215229	190013406	/nfs/dbraw/zinc/01/34/06/190013406.db2.gz	CPFBIBJORCNXFG-LBPRGKRZSA-N	1	1	275.327	2.417	40	0		CEABMO
CCn1nccc1-c1cc(C)nc([C@@H]2CCC[N@@H+](C)C2)n1	ZINC000257235786	190016692	/nfs/dbraw/zinc/01/66/92/190016692.db2.gz	GZLNZXIDNNTHNX-CYBMUJFWSA-N	1	1	285.395	2.478	40	0		CEABMO
CCn1nccc1-c1cc([C@H]2CCC[N@H+]2C)nc(C)n1	ZINC000257223444	190014578	/nfs/dbraw/zinc/01/45/78/190014578.db2.gz	DXJFVLHENFHJTA-CQSZACIVSA-N	1	1	271.368	2.435	40	0		CEABMO
CCn1nccc1-c1cncc([C@H]2CCC[N@H+]2C)n1	ZINC000257243294	190018716	/nfs/dbraw/zinc/01/87/16/190018716.db2.gz	IGGJMFCIBRWUQO-CYBMUJFWSA-N	1	1	257.341	2.127	40	0		CEABMO
Cc1nn(C)c(C)c1-c1cnc([C@@H]2CCC[N@@H+](C)C2)cn1	ZINC000257247901	190018968	/nfs/dbraw/zinc/01/89/68/190018968.db2.gz	JBBYOXWLKRNODH-CYBMUJFWSA-N	1	1	285.395	2.303	40	0		CEABMO
C[C@]1(O)C[N@@H+](Cc2cccnc2)CC[C@@H]1Oc1ccccc1	ZINC000257250528	190019914	/nfs/dbraw/zinc/01/99/14/190019914.db2.gz	JMXFBVLTYBJYPN-ROUUACIJSA-N	1	1	298.386	2.486	40	0		CEABMO
Cn1ccc(C[N@H+]2CCC[C@@H](Cc3cccnc3)C2)n1	ZINC000257280312	190025467	/nfs/dbraw/zinc/02/54/67/190025467.db2.gz	OKJDUTDNZLDIBI-HNNXBMFYSA-N	1	1	270.380	2.270	40	0		CEABMO
CC(=O)NCc1cccc([C@@H]2CCC[N@H+]2CC2CC2)n1	ZINC000257284587	190025932	/nfs/dbraw/zinc/02/59/32/190025932.db2.gz	PDGSDDXHJSPLNV-INIZCTEOSA-N	1	1	273.380	2.265	40	0		CEABMO
Cc1ccccc1C[N@H+]1CC[C@@]2(CCCO2)[C@@H](O)C1	ZINC000257307675	190031493	/nfs/dbraw/zinc/03/14/93/190031493.db2.gz	SZTWLWZWDWTSMS-HOTGVXAUSA-N	1	1	261.365	2.111	40	0		CEABMO
Cc1nc(-c2cc[nH]n2)cc([C@H]2CC[N@H+](C(C)C)C2)n1	ZINC000257309459	190030884	/nfs/dbraw/zinc/03/08/84/190030884.db2.gz	UBAMZKGEBDLEGA-LBPRGKRZSA-N	1	1	271.368	2.373	40	0		CEABMO
COc1ccccc1C[N@H+]1CC[C@@]2(CCCO2)[C@@H](OC)C1	ZINC000257333836	190035599	/nfs/dbraw/zinc/03/55/99/190035599.db2.gz	YDGXOVSXTUCOMP-IRXDYDNUSA-N	1	1	291.391	2.465	40	0		CEABMO
Cc1cccnc1C(=O)N1[C@H]2C[C@@]3(C)[C@@H]1CCC[C@H]3[N@@H+](C)C2	ZINC000257330931	190035746	/nfs/dbraw/zinc/03/57/46/190035746.db2.gz	XQQLDWRDFSEIMW-JTOWHCCKSA-N	1	1	299.418	2.477	40	0		CEABMO
Cc1cccc(C[N@H+]2CCc3ncnc(C)c3CC2)n1	ZINC000096254961	256835432	/nfs/dbraw/zinc/83/54/32/256835432.db2.gz	BGWDFMASZAXVDR-UHFFFAOYSA-N	1	1	268.364	2.089	40	0		CEABMO
CC(=O)N1CCCC2=C[C@H]3C[C@H](C[N@H+]4CCCC[C@H]34)[C@@H]21	ZINC000006733567	394460354	/nfs/dbraw/zinc/46/03/54/394460354.db2.gz	BJNVRMJGVUDEPS-YLFCFFPRSA-N	1	1	274.408	2.428	40	0		CEABMO
CC1(C)[C@H]2CC[C@]1(C)[C@@]([C@@H](CN)CO)([NH+]1CCCC1)C2	ZINC000072210468	394592365	/nfs/dbraw/zinc/59/23/65/394592365.db2.gz	HBUPWEWXZGYSEF-NXNVCVFFSA-N	1	1	280.456	2.234	40	0		CEABMO
C[N@H+]1CCCC[C@@H]1c1cccnc1N1CCOCC1	ZINC000072216236	394592758	/nfs/dbraw/zinc/59/27/58/394592758.db2.gz	SFHHAQJPVLWVON-CQSZACIVSA-N	1	1	261.369	2.075	40	0		CEABMO
CC(C)[N@@H+]1CCC[C@@H]1c1ccc(N2CCN(C)CC2)nc1	ZINC000072216521	394593071	/nfs/dbraw/zinc/59/30/71/394593071.db2.gz	DBJFHLGKXOWNFC-MRXNPFEDSA-N	1	1	288.439	2.379	40	0		CEABMO
CC(C)[N@H+]1CCC[C@@H]1c1ccc(N2CCN(C)CC2)nc1	ZINC000072216521	394593076	/nfs/dbraw/zinc/59/30/76/394593076.db2.gz	DBJFHLGKXOWNFC-MRXNPFEDSA-N	1	1	288.439	2.379	40	0		CEABMO
CCC[N@H+]1CCC[C@@H]1c1ccc(N2CCOCC2)nc1	ZINC000072216163	394593337	/nfs/dbraw/zinc/59/33/37/394593337.db2.gz	BIRQEUBSBLGFBK-OAHLLOKOSA-N	1	1	275.396	2.465	40	0		CEABMO
CC[N@H+]1CCC[C@@H]1c1ccc(N2CCOCC2)nc1C	ZINC000072219616	394594499	/nfs/dbraw/zinc/59/44/99/394594499.db2.gz	UCVIXKWXANQIQC-OAHLLOKOSA-N	1	1	275.396	2.383	40	0		CEABMO
CCC(=O)c1ccc(N2CC[NH+](CC)CC2)nc1C	ZINC000072224670	394594631	/nfs/dbraw/zinc/59/46/31/394594631.db2.gz	DMEWYHFQXUWTQV-UHFFFAOYSA-N	1	1	261.369	2.125	40	0		CEABMO
[NH3+][C@@H]1C(=O)N(Cc2ccccc2)[C@H]1c1cccs1	ZINC000072228115	394596436	/nfs/dbraw/zinc/59/64/36/394596436.db2.gz	OEQATJNDAUGNDQ-STQMWFEESA-N	1	1	258.346	2.159	40	0		CEABMO
CCc1ncnc2c1CC[N@@H+](Cc1ccoc1)CC2	ZINC000096058604	394675865	/nfs/dbraw/zinc/67/58/65/394675865.db2.gz	WMOLOYAOACVLIZ-UHFFFAOYSA-N	1	1	257.337	2.233	40	0		CEABMO
COc1c(Br)ccc(Cl)c1C(=O)C[NH3+]	ZINC000169805281	400285050	/nfs/dbraw/zinc/28/50/50/400285050.db2.gz	CCCWCBSJTWGPJG-UHFFFAOYSA-N	1	1	278.533	2.253	40	0		CEABMO
COC(=O)[C@H](c1ccccc1)[C@@]1(O)C[C@H](C)[N@@H+](C)C[C@H]1C	ZINC000004474246	169970433	/nfs/dbraw/zinc/97/04/33/169970433.db2.gz	XGFOAXWEGYBKCA-RPCCPQHDSA-N	1	1	291.391	2.034	40	0		CEABMO
CCc1nccn1-c1cncc([C@H]2CCC[N@@H+](C)C2)n1	ZINC000072355466	176375002	/nfs/dbraw/zinc/37/50/02/176375002.db2.gz	OJSXZGGKDZJOIR-LBPRGKRZSA-N	1	1	271.368	2.034	40	0		CEABMO
C[N@H+]1CCCC[C@@H]1c1ccnc(Nc2cnccn2)n1	ZINC000072377386	176385807	/nfs/dbraw/zinc/38/58/07/176385807.db2.gz	IJASLZUKUFLSCO-GFCCVEGCSA-N	1	1	270.340	2.167	40	0		CEABMO
CNc1cncc([C@H]2CCC[N@@H+]2Cc2ccccn2)n1	ZINC000072385071	176389429	/nfs/dbraw/zinc/38/94/29/176389429.db2.gz	BLCOSDHJSDOXAE-CQSZACIVSA-N	1	1	269.352	2.250	40	0		CEABMO
CNc1cncc([C@H]2CCC[N@H+]2Cc2ccccn2)n1	ZINC000072385071	176389430	/nfs/dbraw/zinc/38/94/30/176389430.db2.gz	BLCOSDHJSDOXAE-CQSZACIVSA-N	1	1	269.352	2.250	40	0		CEABMO
CNc1ccc(C[C@@H]2CCC[N@@H+](Cc3cccnc3)C2)nn1	ZINC000072387311	176392496	/nfs/dbraw/zinc/39/24/96/176392496.db2.gz	UKEPVTDTKSSVIU-AWEZNQCLSA-N	1	1	297.406	2.368	40	0		CEABMO
COC[C@@H](O)C[N@H+]1C[C@@H](c2ccc(F)cc2)C[C@H]1C	ZINC000077177249	177230859	/nfs/dbraw/zinc/23/08/59/177230859.db2.gz	ABCPPHYURVKKRG-ZLDLUXBVSA-N	1	1	267.344	2.011	40	0		CEABMO
C[N@H+]1CCC[C@H](C(=O)N2CCCc3ccccc32)C1	ZINC000078578577	277073159	/nfs/dbraw/zinc/07/31/59/277073159.db2.gz	UWAWCIPZQWWYAG-AWEZNQCLSA-N	1	1	258.365	2.308	40	0		CEABMO
COc1c(Br)cc(C=O)cc1C[NH+](C)C	ZINC000225721523	333182184	/nfs/dbraw/zinc/18/21/84/333182184.db2.gz	VWFAEZBQYQCMCY-UHFFFAOYSA-N	1	1	272.142	2.332	40	0		CEABMO
CC[N@H+]1CCC[C@@H]1CNc1cc(Cl)nc(C)n1	ZINC000052835978	521640994	/nfs/dbraw/zinc/64/09/94/521640994.db2.gz	OLQNRDUNSFETGB-SNVBAGLBSA-N	1	1	254.765	2.335	40	0		CEABMO
COc1cccc([C@@H]([NH3+])c2nc(-c3ccco3)n[nH]2)c1	ZINC000095533505	185007568	/nfs/dbraw/zinc/00/75/68/185007568.db2.gz	VEVQFIYKOGPUHM-GFCCVEGCSA-N	1	1	270.292	2.121	40	0		CEABMO
O=C1N(Cc2ccncc2)CC[C@]12CCC[N@@H+](CC1CC1)C2	ZINC000096048690	185072503	/nfs/dbraw/zinc/07/25/03/185072503.db2.gz	HEFLPLCKYLQLHZ-SFHVURJKSA-N	1	1	299.418	2.306	40	0		CEABMO
O=C1[C@H]2C[N@@H+](Cc3ccoc3)C[C@H]2CN1c1ccsc1	ZINC000096053680	185074391	/nfs/dbraw/zinc/07/43/91/185074391.db2.gz	HTCMTAUQLQUVPH-JSGCOSHPSA-N	1	1	288.372	2.436	40	0		CEABMO
Cc1noc([C@H]2CC[C@@H]3[C@@H](CC[N@H+]3CC3CC3)O2)n1	ZINC000096057523	185077093	/nfs/dbraw/zinc/07/70/93/185077093.db2.gz	RUNVERXBNOPNKQ-JHJVBQTASA-N	1	1	263.341	2.082	40	0		CEABMO
Cc1noc([C@@H]2CC[C@@H]3[C@@H](CC[N@H+]3CC3CC3)O2)n1	ZINC000096057360	185077301	/nfs/dbraw/zinc/07/73/01/185077301.db2.gz	RUNVERXBNOPNKQ-UPJWGTAASA-N	1	1	263.341	2.082	40	0		CEABMO
COC[C@H]1CC[C@@H]2[C@@H](CC[N@H+]2Cc2ccco2)O1	ZINC000096056375	185078007	/nfs/dbraw/zinc/07/80/07/185078007.db2.gz	RNIZNQJNFAKUAI-MGPQQGTHSA-N	1	1	251.326	2.048	40	0		CEABMO
c1cncc(CO[C@@H]2C[N@@H+](CC3CC3)[C@H]3CCCO[C@H]23)c1	ZINC000096058113	185078561	/nfs/dbraw/zinc/07/85/61/185078561.db2.gz	RCVPHZJETGYFFF-BBWFWOEESA-N	1	1	288.391	2.240	40	0		CEABMO
c1cncc(CO[C@@H]2CC[C@H]3[C@H]2OCC[N@H+]3CC2CC2)c1	ZINC000096057993	185078655	/nfs/dbraw/zinc/07/86/55/185078655.db2.gz	LOOQGPKFTYJUDD-GVDBMIGSSA-N	1	1	288.391	2.240	40	0		CEABMO
COCc1cncc2c1CC[N@H+](Cc1cccnc1)C2	ZINC000096059261	185078910	/nfs/dbraw/zinc/07/89/10/185078910.db2.gz	CAJDVJJTOSDPLB-UHFFFAOYSA-N	1	1	269.348	2.181	40	0		CEABMO
COCc1cncc2c1CC[N@@H+](Cc1cccnc1)C2	ZINC000096059261	185078911	/nfs/dbraw/zinc/07/89/11/185078911.db2.gz	CAJDVJJTOSDPLB-UHFFFAOYSA-N	1	1	269.348	2.181	40	0		CEABMO
COC[C@@]12CCO[C@@H]1CC[N@@H+](Cc1ccccc1F)C2	ZINC000096110329	185101290	/nfs/dbraw/zinc/10/12/90/185101290.db2.gz	NHAGCVKGIQROMW-CVEARBPZSA-N	1	1	279.355	2.453	40	0		CEABMO
C[C@H]1c2ccccc2CCN1c1cc[nH+]c(NCCO)n1	ZINC000328964243	136377365	/nfs/dbraw/zinc/37/73/65/136377365.db2.gz	BUEUHOUONYILJL-LBPRGKRZSA-N	1	1	284.363	2.005	40	0		CEABMO
CCC[N@H+](Cc1cccc(F)c1)[C@H]1CCS(=O)(=O)C1	ZINC000071014306	343799083	/nfs/dbraw/zinc/79/90/83/343799083.db2.gz	TYWWADKSUZYLMC-AWEZNQCLSA-N	1	1	285.384	2.225	40	0		CEABMO
CCC[N@@H+](Cc1cccc(F)c1)[C@H]1CCS(=O)(=O)C1	ZINC000071014306	343799085	/nfs/dbraw/zinc/79/90/85/343799085.db2.gz	TYWWADKSUZYLMC-AWEZNQCLSA-N	1	1	285.384	2.225	40	0		CEABMO
COc1ccccc1C[N@H+]1CC[C@H](c2nnc(C)o2)C1	ZINC000049169215	362343380	/nfs/dbraw/zinc/34/33/80/362343380.db2.gz	JKFFBJOKGRLYDF-ZDUSSCGKSA-N	1	1	273.336	2.376	40	0	biogenic,in-vitro	CEABMO
O=C([O-])C[N@H+]1CC[C@H](C[NH+](Cc2ccccc2)C2CC2)C1	ZINC000079416241	363598953	/nfs/dbraw/zinc/59/89/53/363598953.db2.gz	ZBXQQJHMZLWEKY-HNNXBMFYSA-N	1	1	288.391	2.058	40	0		CEABMO
O=C([O-])C[NH+]1CC[C@H](C[N@H+](Cc2ccccc2)C2CC2)C1	ZINC000079416241	363598959	/nfs/dbraw/zinc/59/89/59/363598959.db2.gz	ZBXQQJHMZLWEKY-HNNXBMFYSA-N	1	1	288.391	2.058	40	0		CEABMO
O=C([O-])C[NH+]1CC[C@H](C[N@@H+](Cc2ccccc2)C2CC2)C1	ZINC000079416241	363598964	/nfs/dbraw/zinc/59/89/64/363598964.db2.gz	ZBXQQJHMZLWEKY-HNNXBMFYSA-N	1	1	288.391	2.058	40	0		CEABMO
CC(C)[N@@H+](CCO)Cc1ccc(Br)nc1	ZINC000079421508	363598651	/nfs/dbraw/zinc/59/86/51/363598651.db2.gz	IBKZNHOTNHVJNQ-UHFFFAOYSA-N	1	1	273.174	2.047	40	0		CEABMO
Nc1cc(NC(=O)C[NH+]2CCCCC2)ccc1Cl	ZINC000000411539	361171693	/nfs/dbraw/zinc/17/16/93/361171693.db2.gz	IGYKCIFEJZLARN-UHFFFAOYSA-N	1	1	267.760	2.347	40	0		CEABMO
COC(=O)[C@@]12CCC[C@@H]1C[N@@H+](Cc1ccccc1)C2	ZINC000004203344	361304911	/nfs/dbraw/zinc/30/49/11/361304911.db2.gz	DFKYQTUJTMSPII-GDBMZVCRSA-N	1	1	259.349	2.462	40	0		CEABMO
CC[N@H+]1CCC[C@H]1CNCc1cc2ccccc2[nH]c1=O	ZINC000023247896	361596121	/nfs/dbraw/zinc/59/61/21/361596121.db2.gz	DRSRDWJTYXPTQW-HNNXBMFYSA-N	1	1	285.391	2.102	40	0		CEABMO
CCN1CCC[C@H]1C[NH2+]Cc1cc2ccccc2[nH]c1=O	ZINC000023247896	361596122	/nfs/dbraw/zinc/59/61/22/361596122.db2.gz	DRSRDWJTYXPTQW-HNNXBMFYSA-N	1	1	285.391	2.102	40	0		CEABMO
O[C@@H]1CC[N@@H+](Cc2cccnc2)[C@H]1Cc1ccccc1	ZINC000096200005	364408974	/nfs/dbraw/zinc/40/89/74/364408974.db2.gz	SHHJJYVUXFXGRJ-DLBZAZTESA-N	1	1	268.360	2.260	40	0		CEABMO
CC[C@@H](C)[N@H+]1CC[C@]2(CCN(Cc3ccccn3)C2=O)C1	ZINC000096159488	364403534	/nfs/dbraw/zinc/40/35/34/364403534.db2.gz	CMLSGLZDEUOFTP-RHSMWYFYSA-N	1	1	287.407	2.305	40	0		CEABMO
c1nnc(N2CC[C@]3(C2)CCC[N@H+](CC2CC2)C3)s1	ZINC000096215565	364412673	/nfs/dbraw/zinc/41/26/73/364412673.db2.gz	FMZJNCFJOHXMPB-CQSZACIVSA-N	1	1	278.425	2.240	40	0		CEABMO
c1ccn(C[C@@H]2CC[C@@H]3[C@@H]2OCC[N@@H+]3Cc2ccc[nH]2)c1	ZINC000096250198	364416593	/nfs/dbraw/zinc/41/65/93/364416593.db2.gz	UDUCYYMVLBHZHH-USXIJHARSA-N	1	1	285.391	2.496	40	0		CEABMO
c1ccn(C[C@@H]2CC[C@@H]3[C@@H]2OCC[N@H+]3Cc2ccc[nH]2)c1	ZINC000096250198	364416601	/nfs/dbraw/zinc/41/66/01/364416601.db2.gz	UDUCYYMVLBHZHH-USXIJHARSA-N	1	1	285.391	2.496	40	0		CEABMO
C[N@H+]1CC[C@]2(C1)c1ccccc1N(CC1CC1)C2=O	ZINC000096244836	364416728	/nfs/dbraw/zinc/41/67/28/364416728.db2.gz	FFJBFTAHQQYHIP-INIZCTEOSA-N	1	1	256.349	2.017	40	0		CEABMO
COC[C@@H]1CC2(CN1Cc1csc(C)n1)CC[NH2+]CC2	ZINC000096240354	364417156	/nfs/dbraw/zinc/41/71/56/364417156.db2.gz	KUMAYTZUVCXBKJ-AWEZNQCLSA-N	1	1	295.452	2.042	40	0		CEABMO
COCc1nnc2n1CC[N@@H+](CCc1ccccc1)[C@@H]2C	ZINC000585097638	367177564	/nfs/dbraw/zinc/17/75/64/367177564.db2.gz	OMBPHYBICMJLQM-CYBMUJFWSA-N	1	1	286.379	2.044	40	0		CEABMO
COCc1nnc2n1CC[N@H+](CCc1ccccc1)[C@@H]2C	ZINC000585097638	367177570	/nfs/dbraw/zinc/17/75/70/367177570.db2.gz	OMBPHYBICMJLQM-CYBMUJFWSA-N	1	1	286.379	2.044	40	0		CEABMO
C[C@H]1c2ncc(CCOCc3cccnc3)n2CC[N@@H+]1C	ZINC000585098499	367177638	/nfs/dbraw/zinc/17/76/38/367177638.db2.gz	UFFJNVXQLWWGEF-ZDUSSCGKSA-N	1	1	286.379	2.044	40	0		CEABMO
COC(=O)[C@@H]([NH3+])[C@H](C)Sc1ccc(Cl)cc1	ZINC000169726752	367371099	/nfs/dbraw/zinc/37/10/99/367371099.db2.gz	VLQBMHHVFGIEPR-XVKPBYJWSA-N	1	1	259.758	2.321	40	0		CEABMO
C[C@H]1CCC[N@@H+](CCCNC(=S)Nc2cccnc2)C1	ZINC000225738170	370314470	/nfs/dbraw/zinc/31/44/70/370314470.db2.gz	LLFOIJNNKHMPLE-ZDUSSCGKSA-N	1	1	292.452	2.490	40	0		CEABMO
CC[C@H](C)[N@H+]1CC[C@@]2(CCN(Cc3ccccn3)C2=O)C1	ZINC000248209656	371170266	/nfs/dbraw/zinc/17/02/66/371170266.db2.gz	CMLSGLZDEUOFTP-YOEHRIQHSA-N	1	1	287.407	2.305	40	0		CEABMO
CN1C[C@@H]2C[N@H+](Cc3ccccc3)[C@@H](C3CC3)[C@@H]2C1	ZINC000409427702	375524221	/nfs/dbraw/zinc/52/42/21/375524221.db2.gz	BUHGYPQOLLDKKM-ZACQAIPSSA-N	1	1	256.393	2.459	40	0		CEABMO
CN1C[C@@H]2C[N@@H+](Cc3ccccc3)[C@@H](C3CC3)[C@@H]2C1	ZINC000409427702	375524223	/nfs/dbraw/zinc/52/42/23/375524223.db2.gz	BUHGYPQOLLDKKM-ZACQAIPSSA-N	1	1	256.393	2.459	40	0		CEABMO
Cc1c[nH]nc1C[C@H]1CCC[N@H+](Cc2cnn(C)c2C)C1	ZINC000257201154	190010823	/nfs/dbraw/zinc/01/08/23/190010823.db2.gz	AGNOWOWNIJNTCS-CQSZACIVSA-N	1	1	287.411	2.215	40	0		CEABMO
Cc1cccc(C(=O)N2C[C@@H]3C[C@@]4(C)[C@H](CCC[C@@H]24)[N@H+]3C)n1	ZINC000257232190	190016664	/nfs/dbraw/zinc/01/66/64/190016664.db2.gz	GJTVZEZVWIBBEI-SCNOPHJPSA-N	1	1	299.418	2.477	40	0		CEABMO
COCC[N@H+]1CCC[C@H](c2cccc(-c3cc[nH]n3)n2)C1	ZINC000257249943	190019842	/nfs/dbraw/zinc/01/98/42/190019842.db2.gz	JKIZXPTUOJHNTF-ZDUSSCGKSA-N	1	1	286.379	2.298	40	0		CEABMO
CCn1nccc1-c1nccnc1[C@H]1CCC[N@@H+](C)C1	ZINC000257287782	190026709	/nfs/dbraw/zinc/02/67/09/190026709.db2.gz	PRMRUMBIKSOESD-LBPRGKRZSA-N	1	1	271.368	2.169	40	0		CEABMO
Cc1cc(-c2cnc(C[C@H]3CCC[N@H+](C)C3)cn2)n[nH]1	ZINC000257329383	190035057	/nfs/dbraw/zinc/03/50/57/190035057.db2.gz	XJTOTBKNTIVXLA-GFCCVEGCSA-N	1	1	271.368	2.059	40	0		CEABMO
CCC[N@H+]1CCC[C@H]1c1ccc(N2CCOCC2)nc1	ZINC000072216164	256711386	/nfs/dbraw/zinc/71/13/86/256711386.db2.gz	BIRQEUBSBLGFBK-HNNXBMFYSA-N	1	1	275.396	2.465	40	0		CEABMO
Cc1ccc(C[N@H+]2CC[C@H]3[C@H]2CCN3c2ncccn2)o1	ZINC000096184801	256814080	/nfs/dbraw/zinc/81/40/80/256814080.db2.gz	KWKMQUNPKHCCEZ-CABCVRRESA-N	1	1	284.363	2.231	40	0		CEABMO
CCOC(=O)[C@H]1[C@H]2CC[C@@H]1[N@@H+](Cc1ccccc1)C2	ZINC000026895315	394479320	/nfs/dbraw/zinc/47/93/20/394479320.db2.gz	HDLAPPYOWZTRFN-KKUMJFAQSA-N	1	1	259.349	2.460	40	0		CEABMO
Cc1ccc([C@H]2[C@@H]([NH3+])C(=O)N2Cc2ccc(F)cc2)o1	ZINC000072228213	394596303	/nfs/dbraw/zinc/59/63/03/394596303.db2.gz	HSLBPAIYUNHBMV-KGLIPLIRSA-N	1	1	274.295	2.138	40	0		CEABMO
CCn1ncc2c1[C@H](COC)C[N@H+](Cc1cccnc1)C2	ZINC000096060153	394675567	/nfs/dbraw/zinc/67/55/67/394675567.db2.gz	HPGFFAVLLRYQSY-HNNXBMFYSA-N	1	1	286.379	2.044	40	0		CEABMO
CCn1ncc2c1[C@H](COC)C[N@@H+](Cc1cccnc1)C2	ZINC000096060153	394675570	/nfs/dbraw/zinc/67/55/70/394675570.db2.gz	HPGFFAVLLRYQSY-HNNXBMFYSA-N	1	1	286.379	2.044	40	0		CEABMO
Cc1ccc(CN2CC[C@@H]3[C@@H]2CC[N@H+]3C[C@H]2CCOC2)o1	ZINC000107200317	394727311	/nfs/dbraw/zinc/72/73/11/394727311.db2.gz	RDGLFDMMYMMNSZ-OIISXLGYSA-N	1	1	290.407	2.273	40	0		CEABMO
Cc1ccc(C[N@@H+](C)[C@@]2(C)CCS(=O)(=O)C2)cc1	ZINC000575421883	400608808	/nfs/dbraw/zinc/60/88/08/400608808.db2.gz	SPANYAYSRIENAT-AWEZNQCLSA-N	1	1	267.394	2.004	40	0		CEABMO
Cc1ccc(C[N@H+](C)[C@@]2(C)CCS(=O)(=O)C2)cc1	ZINC000575421883	400608811	/nfs/dbraw/zinc/60/88/11/400608811.db2.gz	SPANYAYSRIENAT-AWEZNQCLSA-N	1	1	267.394	2.004	40	0		CEABMO
COc1ccc2c(c1)CC[C@H]([N@H+]1CCC[C@H](O)C1)C2	ZINC000004792359	170017628	/nfs/dbraw/zinc/01/76/28/170017628.db2.gz	UCSWLBFIWMGEFO-GJZGRUSLSA-N	1	1	261.365	2.009	40	0		CEABMO
Cc1[nH+]ccn1C[C@H]1CCCN(C(=O)c2cncs2)C1	ZINC000072368384	176383120	/nfs/dbraw/zinc/38/31/20/176383120.db2.gz	KGIKGCOBOXUGPQ-GFCCVEGCSA-N	1	1	290.392	2.200	40	0		CEABMO
Oc1ccc(C[N@H+]2CCOC[C@@H](Cc3ccccn3)C2)cc1	ZINC000072385362	176389886	/nfs/dbraw/zinc/38/98/86/176389886.db2.gz	CKJCFSNUPYUEMQ-INIZCTEOSA-N	1	1	298.386	2.478	40	0		CEABMO
CN1CC[NH2+][C@@H](Cc2ccccc2-c2ccccc2)C1=O	ZINC000072352858	277117211	/nfs/dbraw/zinc/11/72/11/277117211.db2.gz	RPVPILULXPZJAP-KRWDZBQOSA-N	1	1	280.371	2.326	40	0		CEABMO
C=C1[NH+]=C(SC)N[C@@H](CCC)C1C(=O)OCC	ZINC000408730559	570219173	/nfs/dbraw/zinc/21/91/73/570219173.db2.gz	HYPAQDPDEMLLPS-VIFPVBQESA-N	1	1	256.371	2.314	40	0		CEABMO
CCOC[C@]12CCCO[C@H]1CC[N@H+](Cc1cc(C)on1)C2	ZINC000096039433	185069226	/nfs/dbraw/zinc/06/92/26/185069226.db2.gz	PESAIUXESGOVHU-JKSUJKDBSA-N	1	1	294.395	2.391	40	0		CEABMO
CCOC[C@]12CCCO[C@H]1CC[N@@H+](Cc1cc(C)on1)C2	ZINC000096039433	185069227	/nfs/dbraw/zinc/06/92/27/185069227.db2.gz	PESAIUXESGOVHU-JKSUJKDBSA-N	1	1	294.395	2.391	40	0		CEABMO
O=C1CCC[C@]2(CCC[N@@H+](Cc3cccs3)C2)N1	ZINC000096049931	185075118	/nfs/dbraw/zinc/07/51/18/185075118.db2.gz	RKQNOLQBNYLTTP-CQSZACIVSA-N	1	1	264.394	2.383	40	0		CEABMO
c1cc(C[N@H+]2CC[C@H]3[C@H]2CCN3c2nncs2)cs1	ZINC000096055861	185076190	/nfs/dbraw/zinc/07/61/90/185076190.db2.gz	WKYDLOYONQDSHN-NEPJUHHUSA-N	1	1	292.433	2.453	40	0		CEABMO
CNc1cc(N2CCc3ccccc3C2)[nH+]c(C)n1	ZINC000122757283	365631701	/nfs/dbraw/zinc/63/17/01/365631701.db2.gz	OCROGTACMRJOAG-UHFFFAOYSA-N	1	1	254.337	2.389	40	0		CEABMO
CO[C@@H]1CO[C@@]2(CC[N@@H+](Cc3ccccc3F)C2)C1	ZINC000096072179	185088237	/nfs/dbraw/zinc/08/82/37/185088237.db2.gz	CRADNAIOGBRIIJ-ZFWWWQNUSA-N	1	1	265.328	2.206	40	0		CEABMO
O=C1CC[C@@H]2[C@@H](CC[N@H+]2Cc2ccoc2)N1CC1CC1	ZINC000096083145	185092967	/nfs/dbraw/zinc/09/29/67/185092967.db2.gz	XXHNEABBPVFBOA-HUUCEWRRSA-N	1	1	274.364	2.255	40	0		CEABMO
COC[C@]12COC[C@H]1C[N@@H+](Cc1ccc(F)c(F)c1)C2	ZINC000096108639	185099278	/nfs/dbraw/zinc/09/92/78/185099278.db2.gz	SVKPDJMBBHLZBF-IUODEOHRSA-N	1	1	283.318	2.060	40	0		CEABMO
CCOC(=O)c1cccc(NC(=O)[C@@H]2CCC[N@@H+](C)C2)c1	ZINC000096629294	185108032	/nfs/dbraw/zinc/10/80/32/185108032.db2.gz	ZBDYBEQJLPNGRN-CYBMUJFWSA-N	1	1	290.363	2.144	40	0		CEABMO
COc1ccc(C[N@H+]2CC[C@H](c3nnc(C)o3)C2)cc1	ZINC000049169157	362342779	/nfs/dbraw/zinc/34/27/79/362342779.db2.gz	VBPPIUKSGHNGDF-ZDUSSCGKSA-N	1	1	273.336	2.376	40	0	biogenic,in-vitro	CEABMO
CC(C)(C)c1cc(CN2CCCC[C@@H]2C[NH3+])n[nH]1	ZINC000096523570	344240185	/nfs/dbraw/zinc/24/01/85/344240185.db2.gz	HYSSLUMJEPOROM-GFCCVEGCSA-N	1	1	250.390	2.020	40	0		CEABMO
Cc1noc(C)c1C(=O)N1CCC[C@@]2(CCC[N@@H+]2C)CC1	ZINC000585110396	345005998	/nfs/dbraw/zinc/00/59/98/345005998.db2.gz	PDXIHOOKFIOWRW-INIZCTEOSA-N	1	1	291.395	2.382	40	0		CEABMO
Cc1ccc(OC[C@@]2(O)CC[N@@H+](Cc3ccccn3)C2)cc1	ZINC000585269292	345009481	/nfs/dbraw/zinc/00/94/81/345009481.db2.gz	OJLMTJMJLQTKCX-GOSISDBHSA-N	1	1	298.386	2.406	40	0		CEABMO
CC[NH+]1CCN(c2ccc(NC(N)=S)cc2Cl)CC1	ZINC000057332258	362576892	/nfs/dbraw/zinc/57/68/92/362576892.db2.gz	UZTHURDQQQYRHW-UHFFFAOYSA-N	1	1	298.843	2.137	40	0		CEABMO
CC(C)(C)OC(=O)N[C@@H]1CC[N@H+](Cc2ccncc2)C1	ZINC000067801156	362925481	/nfs/dbraw/zinc/92/54/81/362925481.db2.gz	BLXINULUCAENHC-CYBMUJFWSA-N	1	1	277.368	2.181	40	0		CEABMO
CC(C)(C)OC(=O)N[C@@H]1CC[N@@H+](Cc2ccncc2)C1	ZINC000067801156	362925485	/nfs/dbraw/zinc/92/54/85/362925485.db2.gz	BLXINULUCAENHC-CYBMUJFWSA-N	1	1	277.368	2.181	40	0		CEABMO
CC[S@@](=O)CCC[N@H+]1CCc2ccccc2C1	ZINC000004213151	361305023	/nfs/dbraw/zinc/30/50/23/361305023.db2.gz	YKKQKMDOWYCXEX-KRWDZBQOSA-N	1	1	251.395	2.203	40	0	in-man	CEABMO
Cc1c(C[NH2+]Cc2cc(F)ccc2F)cnn1C	ZINC000012395502	361382689	/nfs/dbraw/zinc/38/26/89/361382689.db2.gz	UZMFUOAGVXNXDS-UHFFFAOYSA-N	1	1	251.280	2.297	40	0		CEABMO
COc1cccc(C[N@H+]2CC[C@@H](c3cc(=O)[nH]c(C)n3)C2)c1	ZINC000019285257	361527209	/nfs/dbraw/zinc/52/72/09/361527209.db2.gz	PIZJRIXZJITVMN-CQSZACIVSA-N	1	1	299.374	2.076	40	0		CEABMO
C[C@H]([NH3+])c1nc(-c2ccc(OC(F)F)cc2)no1	ZINC000089262331	363952180	/nfs/dbraw/zinc/95/21/80/363952180.db2.gz	SYUZYSFMMRMWRU-LURJTMIESA-N	1	1	255.224	2.358	40	0		CEABMO
c1ccc(CN2C[C@@H]3C[N@@H+](CC4CCC4)C[C@@H]3C2)nc1	ZINC000096161613	364404464	/nfs/dbraw/zinc/40/44/64/364404464.db2.gz	DVPHUMCKBYJZRD-IYBDPMFKSA-N	1	1	271.408	2.245	40	0		CEABMO
Fc1cccc(C[N@@H+]2C[C@H]3CN(c4ncccn4)C[C@H]3C2)c1	ZINC000096161690	364404704	/nfs/dbraw/zinc/40/47/04/364404704.db2.gz	ALEBMQQYHNWJTG-GASCZTMLSA-N	1	1	298.365	2.184	40	0		CEABMO
O=C1NCC[C@]12C[N@@H+](Cc1ccco1)C[C@H]2c1ccccc1	ZINC000096201807	364410557	/nfs/dbraw/zinc/41/05/57/364410557.db2.gz	HHGUOJUOUQAUIB-FUHWJXTLSA-N	1	1	296.370	2.385	40	0		CEABMO
c1ccc(N2CC3(C2)CC[N@H+](Cc2cccnc2)C3)nc1	ZINC000096202496	364411031	/nfs/dbraw/zinc/41/10/31/364411031.db2.gz	CRDQBYDAQCSXTJ-UHFFFAOYSA-N	1	1	280.375	2.189	40	0		CEABMO
CC(C)[N@H+]1CC[C@H]2CN(C(=O)c3ccncc3F)C[C@H]2C1	ZINC000096246085	364416032	/nfs/dbraw/zinc/41/60/32/364416032.db2.gz	MCHYLLDISAIRNA-QWHCGFSZSA-N	1	1	291.370	2.023	40	0		CEABMO
CC(C)CN1c2ccccc2[C@@]2(CC[N@@H+](C)C2)C1=O	ZINC000096244820	364416347	/nfs/dbraw/zinc/41/63/47/364416347.db2.gz	AJZUFCQOSPEPBC-INIZCTEOSA-N	1	1	258.365	2.263	40	0		CEABMO
COc1ncccc1CN1C[C@@H]2C[N@@H+](C(C)C)CC[C@@H]2C1	ZINC000096246083	364417266	/nfs/dbraw/zinc/41/72/66/364417266.db2.gz	IHHZVKZFKKBQFJ-GDBMZVCRSA-N	1	1	289.423	2.252	40	0		CEABMO
COc1ncnc2c1CC[N@@H+](CC1CCCC1)CC2	ZINC000096255583	364418839	/nfs/dbraw/zinc/41/88/39/364418839.db2.gz	UKFVNZNVQBNUFC-UHFFFAOYSA-N	1	1	261.369	2.076	40	0		CEABMO
O=C1CC[C@@]2(CCC[N@@H+](CC3CC3)CC2)N1CCF	ZINC000585100203	367177728	/nfs/dbraw/zinc/17/77/28/367177728.db2.gz	HMPQQWDIIUADDI-OAHLLOKOSA-N	1	1	268.376	2.213	40	0		CEABMO
COC(=O)[C@@H]([NH3+])[C@@H](C)Sc1ccc(Cl)cc1	ZINC000169726753	367371083	/nfs/dbraw/zinc/37/10/83/367371083.db2.gz	VLQBMHHVFGIEPR-XCBNKYQSSA-N	1	1	259.758	2.321	40	0		CEABMO
CNC(=O)[C@@H]1CCC[C@@]12CC[N@@H+](Cc1ccsc1)C2	ZINC000247957426	371150556	/nfs/dbraw/zinc/15/05/56/371150556.db2.gz	PCOOAHQOSIDBAW-ZFWWWQNUSA-N	1	1	278.421	2.486	40	0		CEABMO
CN1C(=O)CCC[C@H]2C[N@H+](CCC(F)(F)F)CC[C@H]21	ZINC000257306404	371612985	/nfs/dbraw/zinc/61/29/85/371612985.db2.gz	SUEJAJGXNHZRHN-WDEREUQCSA-N	1	1	278.318	2.272	40	0		CEABMO
C(O[C@@H]1CCOC2(C[NH+](C3CCC3)C2)C1)C1CCOCC1	ZINC000247972588	189942876	/nfs/dbraw/zinc/94/28/76/189942876.db2.gz	VDKFTZHWPDZZHZ-MRXNPFEDSA-N	1	1	295.423	2.216	40	0		CEABMO
O=Cc1cccc(-c2cn[nH]c2[C@H]2CCC[NH2+]C2)c1	ZINC000257197850	190009848	/nfs/dbraw/zinc/00/98/48/190009848.db2.gz	KWXDARGCEHODKE-ZDUSSCGKSA-N	1	1	255.321	2.356	40	0		CEABMO
O=Cc1cccc(-c2cn[nH]c2[C@@H]2CCC[NH2+]C2)c1	ZINC000257197849	190010213	/nfs/dbraw/zinc/01/02/13/190010213.db2.gz	KWXDARGCEHODKE-CYBMUJFWSA-N	1	1	255.321	2.356	40	0		CEABMO
Cc1cc(C[N@@H+]2CC[C@@H](c3nc(C)cc(C)n3)C2)no1	ZINC000257214286	190012844	/nfs/dbraw/zinc/01/28/44/190012844.db2.gz	CLKQFTCDHHUNEZ-CYBMUJFWSA-N	1	1	272.352	2.379	40	0		CEABMO
Cc1cc(C[N@H+]2CC[C@@H](c3nc(C)cc(C)n3)C2)no1	ZINC000257214286	190012845	/nfs/dbraw/zinc/01/28/45/190012845.db2.gz	CLKQFTCDHHUNEZ-CYBMUJFWSA-N	1	1	272.352	2.379	40	0		CEABMO
CCN1CCC([N@H+]2CCC[C@H](c3n[nH]cc3C)C2)CC1	ZINC000257214802	190013245	/nfs/dbraw/zinc/01/32/45/190013245.db2.gz	CNMAHDHURPIVAA-AWEZNQCLSA-N	1	1	276.428	2.382	40	0		CEABMO
Cc1nn(C)c(C)c1-c1cnc([C@H]2CCC[N@@H+](C)C2)cn1	ZINC000257247902	190019123	/nfs/dbraw/zinc/01/91/23/190019123.db2.gz	JBBYOXWLKRNODH-ZDUSSCGKSA-N	1	1	285.395	2.303	40	0		CEABMO
C[N@H+]1CCC[C@H](c2ccnc(C(=O)NCC3CC3)c2)C1	ZINC000257245183	190019178	/nfs/dbraw/zinc/01/91/78/190019178.db2.gz	IOKONQJFVQYGPM-AWEZNQCLSA-N	1	1	273.380	2.031	40	0		CEABMO
CCn1cc(C[N@H+]2CCC[C@H](c3nc(C)c[nH]3)C2)cn1	ZINC000257251164	190020164	/nfs/dbraw/zinc/02/01/64/190020164.db2.gz	JPRYTVGHTSREFD-AWEZNQCLSA-N	1	1	273.384	2.314	40	0		CEABMO
CNc1cc(C)[nH+]c([C@H]2CCN(Cc3cncn3C)C2)c1	ZINC000257271532	190023833	/nfs/dbraw/zinc/02/38/33/190023833.db2.gz	MYRNTEVPBFDTBB-ZDUSSCGKSA-N	1	1	285.395	2.155	40	0		CEABMO
Cc1cncc([C@H]2CCC[N@@H+](Cc3ccnc(C)n3)C2)n1	ZINC000257256824	190021961	/nfs/dbraw/zinc/02/19/61/190021961.db2.gz	KNBBPCJWXXZFPY-AWEZNQCLSA-N	1	1	283.379	2.263	40	0		CEABMO
CN1CC[N@@H+](CC2CCOCC2)C[C@@H]1c1ccccc1	ZINC000257276968	190025376	/nfs/dbraw/zinc/02/53/76/190025376.db2.gz	NVXIWKSFLGNMOR-QGZVFWFLSA-N	1	1	274.408	2.402	40	0		CEABMO
CC(=O)N1CC[N@H+](C2CCOCC2)C[C@H]1c1ccccc1	ZINC000257273854	190024691	/nfs/dbraw/zinc/02/46/91/190024691.db2.gz	NINARTLNWNNPGU-KRWDZBQOSA-N	1	1	288.391	2.071	40	0		CEABMO
Cc1[nH+]ccn1CC(=O)N1CCC[C@H](Cc2cccnc2)C1	ZINC000257315651	190032365	/nfs/dbraw/zinc/03/23/65/190032365.db2.gz	VCHBDDLVILBMOJ-MRXNPFEDSA-N	1	1	298.390	2.068	40	0		CEABMO
Cc1nc(Nc2nccs2)cc([C@@H]2CC[N@H+](C)C2)n1	ZINC000257326440	190035103	/nfs/dbraw/zinc/03/51/03/190035103.db2.gz	WXFQOWZEHGEQRD-SNVBAGLBSA-N	1	1	275.381	2.404	40	0		CEABMO
CCN(C[C@H]1CCCC[N@H+]1CCO)C(=O)OC(C)(C)C	ZINC000079408014	285083247	/nfs/dbraw/zinc/08/32/47/285083247.db2.gz	MDVPSSCHAXHKJZ-CYBMUJFWSA-N	1	1	286.416	2.090	40	0		CEABMO
CC[C@@H]([C@@H]([NH3+])c1ccccc1F)S(=O)(=O)CC	ZINC000096524961	256730344	/nfs/dbraw/zinc/73/03/44/256730344.db2.gz	ZUGJWTPBVBGUMN-RYUDHWBXSA-N	1	1	259.346	2.039	40	0		CEABMO
CC[NH+]1CCN(C(=O)CCc2ccc(OC)c(C)c2)CC1	ZINC000224762398	394467325	/nfs/dbraw/zinc/46/73/25/394467325.db2.gz	JUTSQRUVQHYYPV-UHFFFAOYSA-N	1	1	290.407	2.100	40	0		CEABMO
Cc1[nH+]c(N2CCCC2)ccc1[C@H]1CCCN1C=O	ZINC000072218908	394592991	/nfs/dbraw/zinc/59/29/91/394592991.db2.gz	MHXXYZYMIBEQBD-CQSZACIVSA-N	1	1	259.353	2.284	40	0		CEABMO
CCSc1ncc(C[NH2+]Cc2cccnc2)cn1	ZINC000062717289	394571346	/nfs/dbraw/zinc/57/13/46/394571346.db2.gz	DLMDEGMQXDBHBE-UHFFFAOYSA-N	1	1	260.366	2.273	40	0		CEABMO
CCC[N@H+]1CCC[C@@H]1c1cccnc1N1CCOCC1	ZINC000072216223	394593750	/nfs/dbraw/zinc/59/37/50/394593750.db2.gz	ZKEHSAHONRMGKA-OAHLLOKOSA-N	1	1	275.396	2.465	40	0		CEABMO
[NH3+][C@H]1C(=O)N(c2ccc(F)cc2)[C@H]1c1ccccc1	ZINC000072227193	394595533	/nfs/dbraw/zinc/59/55/33/394595533.db2.gz	WYYXBPDQRSEFSN-KGLIPLIRSA-N	1	1	256.280	2.241	40	0		CEABMO
CC[C@H]1[N@@H+](Cc2scnc2C)CCC[C@]12CCC(=O)N2	ZINC000096045692	394675962	/nfs/dbraw/zinc/67/59/62/394675962.db2.gz	FESZVCFWLDMAKC-HIFRSBDPSA-N	1	1	293.436	2.475	40	0		CEABMO
CC[N@H+](Cc1ccc(C)cc1)[C@@H]1CCS(=O)(=O)C1	ZINC000071006058	176020731	/nfs/dbraw/zinc/02/07/31/176020731.db2.gz	FMDRCYUIUSUAKF-CQSZACIVSA-N	1	1	267.394	2.004	40	0		CEABMO
CC[N@@H+](Cc1ccc(C)cc1)[C@@H]1CCS(=O)(=O)C1	ZINC000071006058	176020733	/nfs/dbraw/zinc/02/07/33/176020733.db2.gz	FMDRCYUIUSUAKF-CQSZACIVSA-N	1	1	267.394	2.004	40	0		CEABMO
Cc1cccc(-c2ccccc2C[C@@H]2[NH2+]CCNC2=O)c1	ZINC000072352864	176374590	/nfs/dbraw/zinc/37/45/90/176374590.db2.gz	ZTMHAUGWEIGCCD-KRWDZBQOSA-N	1	1	280.371	2.293	40	0		CEABMO
CC[N@H+]1CCC[C@H](c2nccnc2Nc2cnccn2)C1	ZINC000072361582	176377489	/nfs/dbraw/zinc/37/74/89/176377489.db2.gz	UOXXUOBJMIQXHS-LBPRGKRZSA-N	1	1	284.367	2.210	40	0		CEABMO
C[N@H+]1CCC[C@@H](c2nccnc2Nc2nccs2)C1	ZINC000072364726	176379778	/nfs/dbraw/zinc/37/97/78/176379778.db2.gz	ONSQBBYKCJNLRL-SNVBAGLBSA-N	1	1	275.381	2.486	40	0		CEABMO
COc1ccccc1[C@@H]1C[N@@H+](C(C)C)CCN1C(C)=O	ZINC000072366563	176381572	/nfs/dbraw/zinc/38/15/72/176381572.db2.gz	CFHLAUOFWOPNTH-HNNXBMFYSA-N	1	1	276.380	2.309	40	0		CEABMO
COc1ccccc1[C@@H]1C[N@H+](C(C)C)CCN1C(C)=O	ZINC000072366563	176381574	/nfs/dbraw/zinc/38/15/74/176381574.db2.gz	CFHLAUOFWOPNTH-HNNXBMFYSA-N	1	1	276.380	2.309	40	0		CEABMO
CNc1cncc([C@@H]2CCC[N@@H+]2Cc2ccccn2)n1	ZINC000072385070	176389369	/nfs/dbraw/zinc/38/93/69/176389369.db2.gz	BLCOSDHJSDOXAE-AWEZNQCLSA-N	1	1	269.352	2.250	40	0		CEABMO
CNc1cncc([C@@H]2CCC[N@H+]2Cc2ccccn2)n1	ZINC000072385070	176389370	/nfs/dbraw/zinc/38/93/70/176389370.db2.gz	BLCOSDHJSDOXAE-AWEZNQCLSA-N	1	1	269.352	2.250	40	0		CEABMO
CCO[C@H]1C[N@@H+](Cc2ccoc2)[C@@H]2CCCO[C@@H]21	ZINC000096083181	276360086	/nfs/dbraw/zinc/36/00/86/276360086.db2.gz	APTRNFIUKIRMGZ-RDBSUJKOSA-N	1	1	251.326	2.048	40	0		CEABMO
O[C@H]1CC[N@H+](Cc2ccc(Br)cc2)C1	ZINC000061708116	526309874	/nfs/dbraw/zinc/30/98/74/526309874.db2.gz	PPZFUFKRHOBDAO-NSHDSACASA-N	1	1	256.143	2.016	40	0		CEABMO
O[C@H]1CC[N@@H+](Cc2ccc(Br)cc2)C1	ZINC000061708116	526309879	/nfs/dbraw/zinc/30/98/79/526309879.db2.gz	PPZFUFKRHOBDAO-NSHDSACASA-N	1	1	256.143	2.016	40	0		CEABMO
CCOc1ccc([C@@H]([NH3+])c2nnc(CC)[nH]2)cc1OCC	ZINC000095534586	185006670	/nfs/dbraw/zinc/00/66/70/185006670.db2.gz	QKLUCSIKRFULLQ-CQSZACIVSA-N	1	1	290.367	2.213	40	0		CEABMO
Cc1cccc(CN2CC[C@@H]3[C@@H]2CC[N@H+]3CC2CC2)n1	ZINC000096038575	185069151	/nfs/dbraw/zinc/06/91/51/185069151.db2.gz	FDEQFWXUFSFAIX-SJORKVTESA-N	1	1	271.408	2.449	40	0		CEABMO
CO[C@@H]1CC[C@H]2[C@H]1OCC[N@H+]2CCOCc1ccccc1	ZINC000096041410	185070439	/nfs/dbraw/zinc/07/04/39/185070439.db2.gz	BIRCTPOYJKSWCM-GVDBMIGSSA-N	1	1	291.391	2.081	40	0		CEABMO
O=C1CC[C@@]2(CCC[N@@H+](Cc3ccsc3)CC2)N1	ZINC000096047440	185073516	/nfs/dbraw/zinc/07/35/16/185073516.db2.gz	HMSWASPJGMMJLA-CQSZACIVSA-N	1	1	264.394	2.383	40	0		CEABMO
CN1C(=O)CCC[C@]12CCC[N@@H+](Cc1ccccn1)C2	ZINC000096049968	185075107	/nfs/dbraw/zinc/07/51/07/185075107.db2.gz	KBVZWKUZKRZQPF-MRXNPFEDSA-N	1	1	273.380	2.059	40	0		CEABMO
CCOC[C@]12CCCO[C@@H]1CC[N@@H+](Cc1ccncc1)C2	ZINC000096056812	185077406	/nfs/dbraw/zinc/07/74/06/185077406.db2.gz	PBORYDSXKKSBKD-IAGOWNOFSA-N	1	1	290.407	2.489	40	0		CEABMO
CCc1ncnc2c1CC[N@@H+](Cc1cccnc1)CC2	ZINC000096058607	185078513	/nfs/dbraw/zinc/07/85/13/185078513.db2.gz	GEABEENMJGRINO-UHFFFAOYSA-N	1	1	268.364	2.035	40	0		CEABMO
CCOC[C@H]1Cn2nccc2C[N@H+](Cc2ccco2)C1	ZINC000096059204	185078619	/nfs/dbraw/zinc/07/86/19/185078619.db2.gz	WOSBIYDKAVKJDN-CYBMUJFWSA-N	1	1	275.352	2.145	40	0		CEABMO
CCOC[C@H]1Cn2nccc2C[N@@H+](Cc2ccco2)C1	ZINC000096059204	185078620	/nfs/dbraw/zinc/07/86/20/185078620.db2.gz	WOSBIYDKAVKJDN-CYBMUJFWSA-N	1	1	275.352	2.145	40	0		CEABMO
CCOC[C@@H]1C[N@H+](Cc2ccc(C)o2)Cc2cn(C)nc21	ZINC000096059836	185080501	/nfs/dbraw/zinc/08/05/01/185080501.db2.gz	XGWUBDGUJNXORJ-AWEZNQCLSA-N	1	1	289.379	2.457	40	0		CEABMO
CCOC[C@@H]1C[N@@H+](Cc2ccc(C)o2)Cc2cn(C)nc21	ZINC000096059836	185080503	/nfs/dbraw/zinc/08/05/03/185080503.db2.gz	XGWUBDGUJNXORJ-AWEZNQCLSA-N	1	1	289.379	2.457	40	0		CEABMO
CCNc1nc(N2CCc3ccccc3C2)cc[nH+]1	ZINC000122759238	365631081	/nfs/dbraw/zinc/63/10/81/365631081.db2.gz	RWIQAUPEMGKEMD-UHFFFAOYSA-N	1	1	254.337	2.471	40	0		CEABMO
COc1ccc2c3c1O[C@H]1C=CC=C4[C@@H](C2)[N@@H+](C)CC[C@@]341	ZINC000038258179	361985218	/nfs/dbraw/zinc/98/52/18/361985218.db2.gz	UYDXNVYSAYJCMN-QIIPPGSGSA-N	1	1	281.355	2.450	40	0	biogenic,in-vitro	CEABMO
CCOC(=O)c1c[nH+]c2cc(OC)c(OC)cc2c1N	ZINC000050843251	362424058	/nfs/dbraw/zinc/42/40/58/362424058.db2.gz	FJCDOASSZHSOFT-UHFFFAOYSA-N	1	1	276.292	2.011	40	0		CEABMO
[NH3+]Cc1nc([C@H](c2cccs2)n2cccc2)no1	ZINC000409439806	344889596	/nfs/dbraw/zinc/88/95/96/344889596.db2.gz	IPEYQDKFWIRDPG-NSHDSACASA-N	1	1	260.322	2.029	40	0		CEABMO
O=C(N[C@H]1CCC[C@@H]1[NH2+]C1CCCC1)C(F)(F)F	ZINC000409439622	344889739	/nfs/dbraw/zinc/88/97/39/344889739.db2.gz	HRFGSGJDFQTKIY-UWVGGRQHSA-N	1	1	264.291	2.118	40	0		CEABMO
c1ccc(O[C@H]2CCOC3(C[NH+](CC4CC4)C3)C2)nc1	ZINC000585105406	345006101	/nfs/dbraw/zinc/00/61/01/345006101.db2.gz	WBJMOFGMOAKEMT-AWEZNQCLSA-N	1	1	274.364	2.104	40	0		CEABMO
C[NH+]1CCN(C(=O)c2ccc3c4c(cccc42)CC3)CC1	ZINC000059843219	362652442	/nfs/dbraw/zinc/65/24/42/362652442.db2.gz	ONIOFPKUAWJLRE-UHFFFAOYSA-N	1	1	280.371	2.326	40	0		CEABMO
c1cn([C@H]2CO[C@@]3(C2)CCC[N@H+](Cc2ccoc2)C3)cn1	ZINC000107731344	186189507	/nfs/dbraw/zinc/18/95/07/186189507.db2.gz	RHHJWYHNAPOFFG-HZPDHXFCSA-N	1	1	287.363	2.472	40	0		CEABMO
CN(C)C(=O)[C@@H]1CCC[C@]12CC[N@@H+](Cc1ccncc1)C2	ZINC000108536197	186222625	/nfs/dbraw/zinc/22/26/25/186222625.db2.gz	FQJZGXQTMMNVHU-DOTOQJQBSA-N	1	1	287.407	2.162	40	0		CEABMO
CCN1C(=O)O[C@]2(CCC[N@@H+](Cc3ccccc3)C2)C1=O	ZINC000196702964	540171465	/nfs/dbraw/zinc/17/14/65/540171465.db2.gz	IUJRDSQLIGVYHT-INIZCTEOSA-N	1	1	288.347	2.020	40	0		CEABMO
CCN1C(=O)O[C@@]2(CCC[N@@H+](Cc3ccccc3)C2)C1=O	ZINC000196702979	538772693	/nfs/dbraw/zinc/77/26/93/538772693.db2.gz	IUJRDSQLIGVYHT-MRXNPFEDSA-N	1	1	288.347	2.020	40	0		CEABMO
CC[N@H+](CC(=O)[O-])C[C@H]1CCC[NH+](Cc2ccccc2)C1	ZINC000079393401	363594330	/nfs/dbraw/zinc/59/43/30/363594330.db2.gz	VKTHBJSYRBBIES-MRXNPFEDSA-N	1	1	290.407	2.305	40	0		CEABMO
CC[NH+](CC(=O)[O-])C[C@H]1CCC[N@H+](Cc2ccccc2)C1	ZINC000079393401	363594337	/nfs/dbraw/zinc/59/43/37/363594337.db2.gz	VKTHBJSYRBBIES-MRXNPFEDSA-N	1	1	290.407	2.305	40	0		CEABMO
CC[NH+](CC(=O)[O-])C[C@H]1CCC[N@@H+](Cc2ccccc2)C1	ZINC000079393401	363594341	/nfs/dbraw/zinc/59/43/41/363594341.db2.gz	VKTHBJSYRBBIES-MRXNPFEDSA-N	1	1	290.407	2.305	40	0		CEABMO
O=C([O-])C[N@@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)C1CC1	ZINC000079393446	363594366	/nfs/dbraw/zinc/59/43/66/363594366.db2.gz	NSEGXCOUTCRDLP-HNNXBMFYSA-N	1	1	288.391	2.058	40	0		CEABMO
O=C([O-])C[NH+](C[C@H]1CC[N@H+](Cc2ccccc2)C1)C1CC1	ZINC000079393446	363594369	/nfs/dbraw/zinc/59/43/69/363594369.db2.gz	NSEGXCOUTCRDLP-HNNXBMFYSA-N	1	1	288.391	2.058	40	0		CEABMO
O=C([O-])C[NH+](C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C1CC1	ZINC000079393446	363594377	/nfs/dbraw/zinc/59/43/77/363594377.db2.gz	NSEGXCOUTCRDLP-HNNXBMFYSA-N	1	1	288.391	2.058	40	0		CEABMO
COC(=O)[C@@]1([NH3+])C[C@@H]1c1ccc(C(F)(F)F)cc1	ZINC000217737837	540412957	/nfs/dbraw/zinc/41/29/57/540412957.db2.gz	YDAZBKZPZWAQGX-MWLCHTKSSA-N	1	1	259.227	2.063	40	0		CEABMO
CCOc1ccc(NC(=O)[C@@H]2CCC[N@@H+](C)C2)cc1	ZINC000004429620	361316149	/nfs/dbraw/zinc/31/61/49/361316149.db2.gz	BCVGPQOKYDOMHP-GFCCVEGCSA-N	1	1	262.353	2.366	40	0		CEABMO
C[NH+]1CCN(C(=O)CCCOc2ccc(Cl)cc2)CC1	ZINC000014401386	361457160	/nfs/dbraw/zinc/45/71/60/361457160.db2.gz	TXWKVWPCOYNJIH-UHFFFAOYSA-N	1	1	296.798	2.273	40	0		CEABMO
Fc1cnc(N2CCC[C@@]3(CC[N@@H+](CC4CC4)C3)C2)nc1	ZINC000096047182	364400773	/nfs/dbraw/zinc/40/07/73/364400773.db2.gz	OGMILMMRXDGYPG-INIZCTEOSA-N	1	1	290.386	2.318	40	0		CEABMO
Cc1ccc2c([nH+]1)N(CC1CC1)CCN(c1ncccn1)C2	ZINC000096199070	364409536	/nfs/dbraw/zinc/40/95/36/364409536.db2.gz	KYPKGXPRQLRYFH-UHFFFAOYSA-N	1	1	295.390	2.417	40	0		CEABMO
c1ncn2c1C[N@H+](C1CCC1)C[C@@H](COc1cccnc1)C2	ZINC000096206792	364410612	/nfs/dbraw/zinc/41/06/12/364410612.db2.gz	WNBAONWZGZSUSI-CQSZACIVSA-N	1	1	298.390	2.341	40	0		CEABMO
COC[C@H]1CCC2(CCN(Cc3ccoc3)CC2)[N@H+]1C	ZINC000096208155	364410853	/nfs/dbraw/zinc/41/08/53/364410853.db2.gz	AMUFGPXPRRJJOR-OAHLLOKOSA-N	1	1	278.396	2.355	40	0		CEABMO
O=C(c1ccno1)N1CC[C@@]2(C1)CCC[N@@H+](CC1CC1)C2	ZINC000096215534	364413284	/nfs/dbraw/zinc/41/32/84/364413284.db2.gz	MEBLVZDRXMPNMR-INIZCTEOSA-N	1	1	289.379	2.013	40	0		CEABMO
O=C(C1CC1)N1CC[C@@]2(CC[N@H+]2Cc2ccc(F)cc2)C1	ZINC000096228688	364414162	/nfs/dbraw/zinc/41/41/62/364414162.db2.gz	LJUAGMZBRBMJAB-QGZVFWFLSA-N	1	1	288.366	2.413	40	0		CEABMO
O=C(C1CC1)N1CC[C@@]2(CC[N@@H+]2Cc2ccc(F)cc2)C1	ZINC000096228688	364414170	/nfs/dbraw/zinc/41/41/70/364414170.db2.gz	LJUAGMZBRBMJAB-QGZVFWFLSA-N	1	1	288.366	2.413	40	0		CEABMO
Cc1ccc(C[N@H+]2CC[C@@]3(C[C@@H]3C(=O)NCC3CC3)C2)o1	ZINC000096228635	364414711	/nfs/dbraw/zinc/41/47/11/364414711.db2.gz	IIXRSHWVXRQTTH-NVXWUHKLSA-N	1	1	288.391	2.326	40	0		CEABMO
O=C1C[C@]2(CC[N@@H+](Cc3ccco3)C2)CN1c1ccccn1	ZINC000096239153	364417174	/nfs/dbraw/zinc/41/71/74/364417174.db2.gz	OWOXVTQZNHAIBM-KRWDZBQOSA-N	1	1	297.358	2.304	40	0		CEABMO
O=C1Nc2ccccc2[C@]12CC[N@@H+](CC1CCC1)C2	ZINC000096244788	364417300	/nfs/dbraw/zinc/41/73/00/364417300.db2.gz	ACPTYNFQFLLJPP-MRXNPFEDSA-N	1	1	256.349	2.382	40	0		CEABMO
CC(C)NC(=O)C[C@H]1[C@H]2C[N@H+](Cc3cccs3)C[C@@H]12	ZINC000101910972	364578046	/nfs/dbraw/zinc/57/80/46/364578046.db2.gz	MDGKLETYYBUKDP-BTTYYORXSA-N	1	1	278.421	2.341	40	0		CEABMO
c1ccc(N2CCC[C@]3(CC[N@H+]([C@H]4CCOC4)C3)C2)nc1	ZINC000107224775	364709142	/nfs/dbraw/zinc/70/91/42/364709142.db2.gz	XHXQCHGEJUTSKP-DOTOQJQBSA-N	1	1	287.407	2.163	40	0		CEABMO
C[N@H+]1CC[C@@]12CCCN(C(=O)CCc1ccccc1)C2	ZINC000585101745	367177462	/nfs/dbraw/zinc/17/74/62/367177462.db2.gz	DHIGYMMVLQXNMP-QGZVFWFLSA-N	1	1	272.392	2.316	40	0		CEABMO
COc1ccc(C[N@@H+]2CC[C@H](OC)[C@]3(CCCO3)C2)cc1	ZINC000257207605	190011595	/nfs/dbraw/zinc/01/15/95/190011595.db2.gz	BILRSTUMDONCNA-IRXDYDNUSA-N	1	1	291.391	2.465	40	0		CEABMO
Cc1ccc(C[N@H+]2CC[C@H](c3nccc(C)n3)C2)cn1	ZINC000257264705	190023587	/nfs/dbraw/zinc/02/35/87/190023587.db2.gz	LVSOEPGIDXOKPG-HNNXBMFYSA-N	1	1	268.364	2.478	40	0		CEABMO
O[C@@H]1C[C@H]2C[N@@H+](CCCOc3ccccc3F)C[C@H]2C1	ZINC000257256139	190021439	/nfs/dbraw/zinc/02/14/39/190021439.db2.gz	KKGAZOXINZVUEI-WDNDVIMCSA-N	1	1	279.355	2.297	40	0		CEABMO
CCOCC[N@H+]1CCC[C@H]1c1cc(NC)nc(C)n1	ZINC000257259421	190021488	/nfs/dbraw/zinc/02/14/88/190021488.db2.gz	KYGTUWXKBVHHRP-ZDUSSCGKSA-N	1	1	264.373	2.000	40	0		CEABMO
Cc1c[nH]c([C@H]2CCC[N@@H+](Cc3cnc(C)nc3)C2)n1	ZINC000257336816	190036301	/nfs/dbraw/zinc/03/63/01/190036301.db2.gz	YQDWZIKPSZRBOA-AWEZNQCLSA-N	1	1	271.368	2.196	40	0		CEABMO
Cc1ccc(CN2CC[N@H+]3C[C@H](OCC4CC4)C[C@H]3C2)o1	ZINC000096249535	256834404	/nfs/dbraw/zinc/83/44/04/256834404.db2.gz	UCDXQSWTHRXNLD-DOTOQJQBSA-N	1	1	290.407	2.273	40	0		CEABMO
CC(C)[C@H]1CC[C@H](C)C[C@H]1OC[C@H](O)C[NH+]1CCOCC1	ZINC000034792194	394493462	/nfs/dbraw/zinc/49/34/62/394493462.db2.gz	VWOCGUKYAHXHNT-YLFCFFPRSA-N	1	1	299.455	2.157	40	0		CEABMO
COC(=O)[C@H]1C[N@@H+](C)C[C@H]1c1ccc(Cl)cc1	ZINC000252516686	394572013	/nfs/dbraw/zinc/57/20/13/394572013.db2.gz	VXRLOWUNYIQIGZ-RYUDHWBXSA-N	1	1	253.729	2.158	40	0		CEABMO
O=C1[C@@H]2C[N@@H+](Cc3cccnc3)C[C@H]2CN1c1ccccc1	ZINC000253615448	394578437	/nfs/dbraw/zinc/57/84/37/394578437.db2.gz	OGHHDTIIPQZBSA-DOTOQJQBSA-N	1	1	293.370	2.176	40	0		CEABMO
CC(C)[N@H+]1CCC[C@@H]1c1cncc(-c2cc[nH]n2)n1	ZINC000257283229	394595437	/nfs/dbraw/zinc/59/54/37/394595437.db2.gz	OXIPUSVYXFTSKQ-CQSZACIVSA-N	1	1	257.341	2.412	40	0		CEABMO
CC(C)C[N@H+](Cc1cccc(F)c1)[C@@H]1CCS(=O)(=O)C1	ZINC000575421791	400608857	/nfs/dbraw/zinc/60/88/57/400608857.db2.gz	RRGPLWIBWHNPLA-OAHLLOKOSA-N	1	1	299.411	2.471	40	0		CEABMO
CC(C)C[N@@H+](Cc1cccc(F)c1)[C@@H]1CCS(=O)(=O)C1	ZINC000575421791	400608860	/nfs/dbraw/zinc/60/88/60/400608860.db2.gz	RRGPLWIBWHNPLA-OAHLLOKOSA-N	1	1	299.411	2.471	40	0		CEABMO
C[C@@H]1CCC[N@@H+]([C@@H](CN)c2ccc3c(c2)CCO3)C1	ZINC000037363645	173152183	/nfs/dbraw/zinc/15/21/83/173152183.db2.gz	KTBRIIPUKAOJDI-DOMZBBRYSA-N	1	1	260.381	2.353	40	0		CEABMO
C[C@@H]1CCC[N@H+]([C@@H](CN)c2ccc3c(c2)CCO3)C1	ZINC000037363645	173152184	/nfs/dbraw/zinc/15/21/84/173152184.db2.gz	KTBRIIPUKAOJDI-DOMZBBRYSA-N	1	1	260.381	2.353	40	0		CEABMO
COc1cccc(C[N@@H+]2CCc3c(nc(C)[nH]c3=O)C2)c1	ZINC000072373669	176385026	/nfs/dbraw/zinc/38/50/26/176385026.db2.gz	HDMUQHMYPQBPGI-UHFFFAOYSA-N	1	1	285.347	2.058	40	0		CEABMO
COc1cccc(C[N@H+]2CCc3c(nc(C)[nH]c3=O)C2)c1	ZINC000072373669	176385027	/nfs/dbraw/zinc/38/50/27/176385027.db2.gz	HDMUQHMYPQBPGI-UHFFFAOYSA-N	1	1	285.347	2.058	40	0		CEABMO
Cc1nc(CN2C[C@@H]3CCC[N@H+]3C[C@H]2C)c2ccccn12	ZINC000072397556	176395006	/nfs/dbraw/zinc/39/50/06/176395006.db2.gz	IFBMKCAVZBSSAN-HIFRSBDPSA-N	1	1	284.407	2.311	40	0		CEABMO
Cc1nc(CN2C[C@@H]3CCC[N@@H+]3C[C@H]2C)c2ccccn12	ZINC000072397556	176395008	/nfs/dbraw/zinc/39/50/08/176395008.db2.gz	IFBMKCAVZBSSAN-HIFRSBDPSA-N	1	1	284.407	2.311	40	0		CEABMO
Cc1ccc2c(n1)N(C)[C@H](CO)CC[N@H+](C1CCCC1)C2	ZINC000225493828	281137028	/nfs/dbraw/zinc/13/70/28/281137028.db2.gz	LKSPLZWRCDOJTI-INIZCTEOSA-N	1	1	289.423	2.335	40	0	biogenic,in-vitro	CEABMO
COc1ccc([C@@H]([NH3+])c2nnc(CC(C)C)[nH]2)cc1	ZINC000095533748	185005664	/nfs/dbraw/zinc/00/56/64/185005664.db2.gz	JZXFTPHKOHSIFI-CYBMUJFWSA-N	1	1	260.341	2.060	40	0		CEABMO
COC[C@@H]1CCC[C@@]12C[N@H+](Cc1ccco1)CCO2	ZINC000096051836	185074304	/nfs/dbraw/zinc/07/43/04/185074304.db2.gz	OKDQSHHDVNWMPZ-DZGCQCFKSA-N	1	1	265.353	2.297	40	0		CEABMO
COC[C@@H]1CCC[C@@]12C[N@@H+](Cc1ccco1)CCO2	ZINC000096051836	185074305	/nfs/dbraw/zinc/07/43/05/185074305.db2.gz	OKDQSHHDVNWMPZ-DZGCQCFKSA-N	1	1	265.353	2.297	40	0		CEABMO
c1ccc(C[N@H+]2C[C@H]3CN(Cc4cccnc4)C[C@H]3C2)nc1	ZINC000096053738	185074895	/nfs/dbraw/zinc/07/48/95/185074895.db2.gz	KKKJJFQEUFFWDH-CALCHBBNSA-N	1	1	294.402	2.040	40	0		CEABMO
c1ccc(CN2C[C@@H]3C[N@@H+](Cc4cccnc4)C[C@@H]3C2)nc1	ZINC000096053738	185074896	/nfs/dbraw/zinc/07/48/96/185074896.db2.gz	KKKJJFQEUFFWDH-CALCHBBNSA-N	1	1	294.402	2.040	40	0		CEABMO
c1ccc(CN2C[C@@H]3C[N@H+](Cc4cccnc4)C[C@@H]3C2)nc1	ZINC000096053738	185074897	/nfs/dbraw/zinc/07/48/97/185074897.db2.gz	KKKJJFQEUFFWDH-CALCHBBNSA-N	1	1	294.402	2.040	40	0		CEABMO
c1ccc(CN2C[C@@H]3C[N@H+](Cc4ccncc4)C[C@@H]3C2)nc1	ZINC000096053804	185075662	/nfs/dbraw/zinc/07/56/62/185075662.db2.gz	RICPREWXZGIYFW-CALCHBBNSA-N	1	1	294.402	2.040	40	0		CEABMO
c1ccc(C[N@@H+]2C[C@H]3CN(Cc4ccncc4)C[C@H]3C2)nc1	ZINC000096053804	185075664	/nfs/dbraw/zinc/07/56/64/185075664.db2.gz	RICPREWXZGIYFW-CALCHBBNSA-N	1	1	294.402	2.040	40	0		CEABMO
c1ccc(C[N@H+]2C[C@H]3CN(Cc4ccncc4)C[C@H]3C2)nc1	ZINC000096053804	185075666	/nfs/dbraw/zinc/07/56/66/185075666.db2.gz	RICPREWXZGIYFW-CALCHBBNSA-N	1	1	294.402	2.040	40	0		CEABMO
CC(C)Oc1ncnc2c1CC[N@@H+](Cc1ccoc1)CC2	ZINC000096058779	185079350	/nfs/dbraw/zinc/07/93/50/185079350.db2.gz	FMCFSGHDZHBGMH-UHFFFAOYSA-N	1	1	287.363	2.458	40	0		CEABMO
c1cncc(O[C@@H]2CO[C@@]3(CC[N@H+](CC4CCC4)C3)C2)c1	ZINC000096072453	185088211	/nfs/dbraw/zinc/08/82/11/185088211.db2.gz	LVHJIQZLIHSNQM-IRXDYDNUSA-N	1	1	288.391	2.494	40	0		CEABMO
c1csc([C@@H](C2CCOCC2)[NH+]2CCNCC2)c1	ZINC000076703774	343896047	/nfs/dbraw/zinc/89/60/47/343896047.db2.gz	SMTZRGXVQVTDGF-CQSZACIVSA-N	1	1	266.410	2.121	40	0		CEABMO
c1c[nH]c(C[N@@H+]2CC[C@H](c3nnc(-c4ccccc4)o3)C2)n1	ZINC000049169379	362342673	/nfs/dbraw/zinc/34/26/73/362342673.db2.gz	SBQZFKSJAGRCPA-ZDUSSCGKSA-N	1	1	295.346	2.449	40	0	biogenic,in-vitro	CEABMO
c1c[nH]c(C[N@H+]2CC[C@H](c3nnc(-c4ccccc4)o3)C2)n1	ZINC000049169379	362342679	/nfs/dbraw/zinc/34/26/79/362342679.db2.gz	SBQZFKSJAGRCPA-ZDUSSCGKSA-N	1	1	295.346	2.449	40	0	biogenic,in-vitro	CEABMO
O=C(N[C@H]1CCC[C@H]1[NH2+]C1CCCC1)C(F)(F)F	ZINC000409439624	344889877	/nfs/dbraw/zinc/88/98/77/344889877.db2.gz	HRFGSGJDFQTKIY-ZJUUUORDSA-N	1	1	264.291	2.118	40	0		CEABMO
Cc1ccc(-c2cc(C(=O)N3CCC([NH3+])CC3)n[nH]2)c(C)c1	ZINC000070451519	363082851	/nfs/dbraw/zinc/08/28/51/363082851.db2.gz	NEQJJUXOKGQDFF-UHFFFAOYSA-N	1	1	298.390	2.257	40	0		CEABMO
Cc1cc(C)nc([C@H]2CC[N@H+](C3CCOCC3)C2)n1	ZINC000072385947	363132540	/nfs/dbraw/zinc/13/25/40/363132540.db2.gz	XNJSSLPUZHOOMS-ZDUSSCGKSA-N	1	1	261.369	2.062	40	0		CEABMO
CC(C)[N@H+](CC(=O)[O-])C1CC[NH+](Cc2ccccc2)CC1	ZINC000079393424	363594067	/nfs/dbraw/zinc/59/40/67/363594067.db2.gz	GVGUALMMKFDEBO-UHFFFAOYSA-N	1	1	290.407	2.446	40	0		CEABMO
CC(C)[N@@H+](CC(=O)[O-])C1CC[NH+](Cc2ccccc2)CC1	ZINC000079393424	363594069	/nfs/dbraw/zinc/59/40/69/363594069.db2.gz	GVGUALMMKFDEBO-UHFFFAOYSA-N	1	1	290.407	2.446	40	0		CEABMO
CC(C)[N@H+](CC(=O)[O-])C[C@@H]1CC[NH+](Cc2ccccc2)C1	ZINC000079393416	363594075	/nfs/dbraw/zinc/59/40/75/363594075.db2.gz	LVLBVBVGFMOPGJ-MRXNPFEDSA-N	1	1	290.407	2.304	40	0		CEABMO
CC(C)[NH+](CC(=O)[O-])C[C@@H]1CC[N@H+](Cc2ccccc2)C1	ZINC000079393416	363594077	/nfs/dbraw/zinc/59/40/77/363594077.db2.gz	LVLBVBVGFMOPGJ-MRXNPFEDSA-N	1	1	290.407	2.304	40	0		CEABMO
CC(C)[NH+](CC(=O)[O-])C[C@@H]1CC[N@@H+](Cc2ccccc2)C1	ZINC000079393416	363594082	/nfs/dbraw/zinc/59/40/82/363594082.db2.gz	LVLBVBVGFMOPGJ-MRXNPFEDSA-N	1	1	290.407	2.304	40	0		CEABMO
CC[NH+]1CCN(C(=O)CCSCc2ccccc2)CC1	ZINC000013688097	361437196	/nfs/dbraw/zinc/43/71/96/361437196.db2.gz	LTWXLTVLCACZGT-UHFFFAOYSA-N	1	1	292.448	2.474	40	0		CEABMO
Cc1cccc(C[NH2+]CC(=O)CN2CCC(C)CC2)c1	ZINC000016349220	361487564	/nfs/dbraw/zinc/48/75/64/361487564.db2.gz	XWDQBZQIPXEYAU-UHFFFAOYSA-N	1	1	274.408	2.386	40	0		CEABMO
CCc1noc(C)c1C(=O)NCC[N@H+]1CCCC[C@@H]1C	ZINC000019521283	361541859	/nfs/dbraw/zinc/54/18/59/361541859.db2.gz	CDFYQTWBDYSUHU-NSHDSACASA-N	1	1	279.384	2.150	40	0		CEABMO
CCc1noc(C)c1C(=O)NCC[N@H+]1CCCC[C@H]1C	ZINC000019521284	361542014	/nfs/dbraw/zinc/54/20/14/361542014.db2.gz	CDFYQTWBDYSUHU-LLVKDONJSA-N	1	1	279.384	2.150	40	0		CEABMO
COc1ccc(OC)c(CN2C[C@@H]3CCC[N@H+]3C[C@@H]2C)c1	ZINC000019575736	361544190	/nfs/dbraw/zinc/54/41/90/361544190.db2.gz	VSJROCKNJFVGFJ-ZFWWWQNUSA-N	1	1	290.407	2.372	40	0		CEABMO
COC(=O)[C@@H](c1ccccc1)[C@@]1(O)C[C@@H](C)[N@@H+](C)C[C@@H]1C	ZINC000013122901	291284868	/nfs/dbraw/zinc/28/48/68/291284868.db2.gz	XGFOAXWEGYBKCA-TZDHZFECSA-N	1	1	291.391	2.034	40	0		CEABMO
CCn1nnc2c1CC[N@H+](CC1CCCC1)[C@H]2COC	ZINC000096198483	364408664	/nfs/dbraw/zinc/40/86/64/364408664.db2.gz	JZIDOMJNZXALJI-AWEZNQCLSA-N	1	1	278.400	2.034	40	0		CEABMO
CCn1nnc2c1CC[N@@H+](CC1CCCC1)[C@H]2COC	ZINC000096198483	364408667	/nfs/dbraw/zinc/40/86/67/364408667.db2.gz	JZIDOMJNZXALJI-AWEZNQCLSA-N	1	1	278.400	2.034	40	0		CEABMO
CN(C)Cc1cnc2n1CC[N@H+](Cc1ccccc1)CC2	ZINC000096196782	364408827	/nfs/dbraw/zinc/40/88/27/364408827.db2.gz	SLRBEJREWZWKGP-UHFFFAOYSA-N	1	1	284.407	2.003	40	0		CEABMO
c1nc2n(c1CNc1ccccn1)CC[N@H+](CC1CC1)CC2	ZINC000096197120	364409343	/nfs/dbraw/zinc/40/93/43/364409343.db2.gz	WPQQDAVTKDLJPS-UHFFFAOYSA-N	1	1	297.406	2.158	40	0		CEABMO
COC[C@H]1C[N@H+](C)C[C@@]12CCN(Cc1ccc(C)s1)C2	ZINC000096218076	364412242	/nfs/dbraw/zinc/41/22/42/364412242.db2.gz	NCAOHZAKRYPZIM-GDBMZVCRSA-N	1	1	294.464	2.457	40	0		CEABMO
COC[C@H]1C[N@@H+](C)C[C@@]12CCN(Cc1ccc(C)s1)C2	ZINC000096218076	364412249	/nfs/dbraw/zinc/41/22/49/364412249.db2.gz	NCAOHZAKRYPZIM-GDBMZVCRSA-N	1	1	294.464	2.457	40	0		CEABMO
C[N@H+]1CC[C@@]2(C1)c1ccccc1N(CC1CC1)C2=O	ZINC000096244835	364417054	/nfs/dbraw/zinc/41/70/54/364417054.db2.gz	FFJBFTAHQQYHIP-MRXNPFEDSA-N	1	1	256.349	2.017	40	0		CEABMO
C[N@@H+]1CC[C@]12CCCN(C(=O)c1ccc(Cl)cc1O)C2	ZINC000585102281	367177539	/nfs/dbraw/zinc/17/75/39/367177539.db2.gz	WCUYYHPEVYNIEM-HNNXBMFYSA-N	1	1	294.782	2.356	40	0		CEABMO
C[N@H+]1CC[C@]12CCCN(C(=O)c1ccc(Cl)cc1O)C2	ZINC000585102281	367177543	/nfs/dbraw/zinc/17/75/43/367177543.db2.gz	WCUYYHPEVYNIEM-HNNXBMFYSA-N	1	1	294.782	2.356	40	0		CEABMO
CCOC[C@H]1CC[N@@H+](C)C2(CN(Cc3cccnc3)C2)C1	ZINC000248099185	371160505	/nfs/dbraw/zinc/16/05/05/371160505.db2.gz	DKLDJTHCQFWKDO-HNNXBMFYSA-N	1	1	289.423	2.014	40	0		CEABMO
C[N@@H+]1Cc2cccn2[C@@H](CCOc2ccccn2)C1	ZINC000248159645	371164687	/nfs/dbraw/zinc/16/46/87/371164687.db2.gz	WYVVNRAAHVKLNQ-AWEZNQCLSA-N	1	1	257.337	2.339	40	0		CEABMO
c1cc2n(n1)[C@@H](COCc1ccccn1)C[N@@H+](C1CCC1)C2	ZINC000253596803	371530882	/nfs/dbraw/zinc/53/08/82/371530882.db2.gz	WEGRDBDRVJCPME-QGZVFWFLSA-N	1	1	298.390	2.404	40	0		CEABMO
c1cc2n(n1)[C@@H](COCc1ccccn1)C[N@H+](C1CCC1)C2	ZINC000253596803	371530886	/nfs/dbraw/zinc/53/08/86/371530886.db2.gz	WEGRDBDRVJCPME-QGZVFWFLSA-N	1	1	298.390	2.404	40	0		CEABMO
COc1ccccc1[C@H]1CN(c2ccnc(C)n2)CC[N@@H+]1C	ZINC000257240023	371610468	/nfs/dbraw/zinc/61/04/68/371610468.db2.gz	HRTBLBQGZBKXFF-OAHLLOKOSA-N	1	1	298.390	2.287	40	0		CEABMO
COc1ccccc1[C@H]1CN(c2ccnc(C)n2)CC[N@H+]1C	ZINC000257240023	371610471	/nfs/dbraw/zinc/61/04/71/371610471.db2.gz	HRTBLBQGZBKXFF-OAHLLOKOSA-N	1	1	298.390	2.287	40	0		CEABMO
Cc1c(C[NH2+]Cc2ccco2)cnn1CC(F)F	ZINC000256053998	190004936	/nfs/dbraw/zinc/00/49/36/190004936.db2.gz	UNNRCRXKOHLSEV-UHFFFAOYSA-N	1	1	255.268	2.339	40	0		CEABMO
Cn1cccc1C[NH2+]Cc1ccn(CC(F)(F)F)n1	ZINC000256051954	190004006	/nfs/dbraw/zinc/00/40/06/190004006.db2.gz	LGQQRSFZLXPISM-UHFFFAOYSA-N	1	1	272.274	2.074	40	0		CEABMO
c1cc([C@H]2CCC[N@H+](CC3CCOCC3)C2)ncn1	ZINC000257211348	190011996	/nfs/dbraw/zinc/01/19/96/190011996.db2.gz	BYNVBAGQDWKFSX-AWEZNQCLSA-N	1	1	261.369	2.083	40	0		CEABMO
Cc1n[nH]cc1C[N@@H+]1CCCC[C@@H]1c1ccn2ccnc2n1	ZINC000257230835	190015966	/nfs/dbraw/zinc/01/59/66/190015966.db2.gz	GECYKIQTOMHNBJ-OAHLLOKOSA-N	1	1	296.378	2.488	40	0		CEABMO
Cc1n[nH]cc1C[N@H+]1CCCC[C@@H]1c1ccn2ccnc2n1	ZINC000257230835	190015967	/nfs/dbraw/zinc/01/59/67/190015967.db2.gz	GECYKIQTOMHNBJ-OAHLLOKOSA-N	1	1	296.378	2.488	40	0		CEABMO
c1ncc(C[N@H+]2CCC[C@@H](c3ccncn3)C2)s1	ZINC000257267879	190023078	/nfs/dbraw/zinc/02/30/78/190023078.db2.gz	MJEPKFLZEUHSHM-LLVKDONJSA-N	1	1	260.366	2.313	40	0		CEABMO
CCn1cc(C[N@H+]2CC[C@@H](c3nccc(C)n3)C2)c(C)n1	ZINC000257284033	190026221	/nfs/dbraw/zinc/02/62/21/190026221.db2.gz	PAZOQNVAVOTRQY-CQSZACIVSA-N	1	1	285.395	2.299	40	0		CEABMO
Cc1cn(C)c([C@H]2CC[N@@H+](Cc3scnc3C)C2)n1	ZINC000257273529	190024422	/nfs/dbraw/zinc/02/44/22/190024422.db2.gz	NGZGKIRIMXBYGV-LBPRGKRZSA-N	1	1	276.409	2.483	40	0		CEABMO
Cc1ncc(-c2cc(C)nc([C@H]3CCC[N@@H+](C)C3)n2)n1C	ZINC000257295684	190028289	/nfs/dbraw/zinc/02/82/89/190028289.db2.gz	QZLCODUGTMTZHK-ZDUSSCGKSA-N	1	1	285.395	2.303	40	0		CEABMO
CC(C)[N@H+]1CC[C@@H](Cc2cc(-c3nccn3C)ncn2)C1	ZINC000257321338	190033198	/nfs/dbraw/zinc/03/31/98/190033198.db2.gz	WBFAPNGCVMCNKC-ZDUSSCGKSA-N	1	1	285.395	2.150	40	0		CEABMO
CCCn1cc(C[N@H+]2CCC[C@H](c3ccncn3)C2)cn1	ZINC000257321848	190033844	/nfs/dbraw/zinc/03/38/44/190033844.db2.gz	WDNMMULLDYDIRF-HNNXBMFYSA-N	1	1	285.395	2.463	40	0		CEABMO
Fc1cccc(OCc2cc([C@H]3CC[NH2+]C3)[nH]n2)c1	ZINC000257344137	190037690	/nfs/dbraw/zinc/03/76/90/190037690.db2.gz	ZVXXZHDYCLMMRU-JTQLQIEISA-N	1	1	261.300	2.205	40	0		CEABMO
c1ccc(NC[C@H]2CO[C@@H]3C[N@H+](C4CCCC4)C[C@H]23)nc1	ZINC000306126526	376539630	/nfs/dbraw/zinc/53/96/30/376539630.db2.gz	DYINQGNQFIRBAU-NUEKZKHPSA-N	1	1	287.407	2.383	40	0		CEABMO
O=C1C[C@@]2(CC[N@@H+](Cc3ccco3)C2)CN1c1cccnc1	ZINC000096239106	256829744	/nfs/dbraw/zinc/82/97/44/256829744.db2.gz	NEXDJRZXDKLQQD-QGZVFWFLSA-N	1	1	297.358	2.304	40	0		CEABMO
CCSc1ncc(C[NH2+]CCN(CC)CC)cn1	ZINC000062718348	394571061	/nfs/dbraw/zinc/57/10/61/394571061.db2.gz	DOWJYFNLFCEKEU-UHFFFAOYSA-N	1	1	268.430	2.020	40	0		CEABMO
Cc1cccc(N2C(=O)[C@H]([NH3+])[C@@H]2c2ccc3c(c2)OCO3)c1	ZINC000072227421	394596541	/nfs/dbraw/zinc/59/65/41/394596541.db2.gz	QSFRUXLWQVPDDO-CVEARBPZSA-N	1	1	296.326	2.139	40	0		CEABMO
COc1ccc([C@@H]2[C@@H]([NH3+])C(=O)N2c2cccc(OC)c2)cc1	ZINC000072227724	394596547	/nfs/dbraw/zinc/59/65/47/394596547.db2.gz	VTYUFUMOUPBLBY-HZPDHXFCSA-N	1	1	298.342	2.119	40	0		CEABMO
CCOC(=O)c1[nH]nc(C)c1C[C@@H]([NH3+])c1ccccc1	ZINC000005387021	170093268	/nfs/dbraw/zinc/09/32/68/170093268.db2.gz	YYMJRCDFZQRMSL-CYBMUJFWSA-N	1	1	273.336	2.137	40	0		CEABMO
CCCCCc1ccc(C(=O)NN2CC[NH+](C)CC2)cc1	ZINC000005614865	170120049	/nfs/dbraw/zinc/12/00/49/170120049.db2.gz	OCBJDBIVGRIPMT-UHFFFAOYSA-N	1	1	289.423	2.312	40	0		CEABMO
[NH3+][C@H]1CCCC[C@H]1N1CCN(Cc2ccccc2)CC1	ZINC000040431790	174260341	/nfs/dbraw/zinc/26/03/41/174260341.db2.gz	DNIGNRKTSONDSF-DLBZAZTESA-N	1	1	273.424	2.074	40	0		CEABMO
CC(C)[N@H+]1CCC[C@@](CCCc2ccccn2)(C(N)=O)C1	ZINC000072366370	176381250	/nfs/dbraw/zinc/38/12/50/176381250.db2.gz	LBLMAYGPOKJVQT-QGZVFWFLSA-N	1	1	289.423	2.380	40	0		CEABMO
CC(=O)N1CCC[C@H]1c1cccc(-n2cc[nH+]c2C)n1	ZINC000072378537	176386153	/nfs/dbraw/zinc/38/61/53/176386153.db2.gz	GOUGVIWHKQSSTM-AWEZNQCLSA-N	1	1	270.336	2.259	40	0		CEABMO
Cc1c[nH]nc1[C@@H]1CCC[N@@H+](CC2CCOCC2)C1	ZINC000072386141	176391132	/nfs/dbraw/zinc/39/11/32/176391132.db2.gz	RIXJCOOMEXOIGL-CQSZACIVSA-N	1	1	263.385	2.324	40	0		CEABMO
COc1cccc(CN2C[C@H]3CCC[N@H+]3C[C@H]2C)c1OC	ZINC000072397536	176394751	/nfs/dbraw/zinc/39/47/51/176394751.db2.gz	JKVMYIBCSWDHCB-UKRRQHHQSA-N	1	1	290.407	2.372	40	0		CEABMO
C[N@H+]1CCC[C@H](C(=O)NCCSc2ccccc2)C1	ZINC000078578492	177356174	/nfs/dbraw/zinc/35/61/74/177356174.db2.gz	MBXBTNNRZOOMDP-ZDUSSCGKSA-N	1	1	278.421	2.237	40	0		CEABMO
CCOc1ccc(Cl)cc1-c1noc(C[NH3+])n1	ZINC000256054850	419470076	/nfs/dbraw/zinc/47/00/76/419470076.db2.gz	YAWVRRKGHBMUTO-UHFFFAOYSA-N	1	1	253.689	2.247	40	0		CEABMO
C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@]1(N)C(F)(F)F	ZINC000228906073	260316811	/nfs/dbraw/zinc/31/68/11/260316811.db2.gz	NWNOBEWRLOTQFH-PWSUYJOCSA-N	1	1	258.287	2.398	40	0		CEABMO
CCSc1ncc(C[NH2+]Cc2ccccn2)cn1	ZINC000062717321	262298874	/nfs/dbraw/zinc/29/88/74/262298874.db2.gz	LXYKJPYXXAARKF-UHFFFAOYSA-N	1	1	260.366	2.273	40	0		CEABMO
COc1cccc(CN2C[C@@H]3CCC[N@H+]3C[C@H]2C)c1	ZINC000019575144	278011381	/nfs/dbraw/zinc/01/13/81/278011381.db2.gz	YWXCEYSSIJOVDP-HIFRSBDPSA-N	1	1	260.381	2.364	40	0		CEABMO
CC[C@@H]1[N@@H+](Cc2cccnc2)CCC[C@]12CCC(=O)N2C	ZINC000096052421	185074210	/nfs/dbraw/zinc/07/42/10/185074210.db2.gz	SUJYFDCOHZRITD-RDJZCZTQSA-N	1	1	287.407	2.447	40	0		CEABMO
c1ccc(OC[C@@H]2C[C@H]3OCC[N@@H+](CC4CC4)[C@@H]3C2)nc1	ZINC000096055493	185076214	/nfs/dbraw/zinc/07/62/14/185076214.db2.gz	NMVZUPDNUAFYQR-ARFHVFGLSA-N	1	1	288.391	2.350	40	0		CEABMO
COC[C@]12CCCO[C@@H]1CC[N@@H+](Cc1ccncc1)C2	ZINC000096056728	185077654	/nfs/dbraw/zinc/07/76/54/185077654.db2.gz	HVXOOPYFHMJWMJ-HZPDHXFCSA-N	1	1	276.380	2.099	40	0		CEABMO
COC[C@@H]1C[N@H+](Cc2ccc(F)cc2)Cc2cnn(C)c21	ZINC000096060015	185079761	/nfs/dbraw/zinc/07/97/61/185079761.db2.gz	CUVMPBQDMIRTAM-AWEZNQCLSA-N	1	1	289.354	2.305	40	0		CEABMO
COC[C@@H]1C[N@@H+](Cc2ccc(F)cc2)Cc2cnn(C)c21	ZINC000096060015	185079762	/nfs/dbraw/zinc/07/97/62/185079762.db2.gz	CUVMPBQDMIRTAM-AWEZNQCLSA-N	1	1	289.354	2.305	40	0		CEABMO
O=C(c1cccnc1)N1CCC2(C[NH+](Cc3ccoc3)C2)C1	ZINC000096070917	185087416	/nfs/dbraw/zinc/08/74/16/185087416.db2.gz	JEKBWUDTGAPXJS-UHFFFAOYSA-N	1	1	297.358	2.023	40	0		CEABMO
Brc1cccc(CNC2CC[NH2+]CC2)c1	ZINC000042418877	362092243	/nfs/dbraw/zinc/09/22/43/362092243.db2.gz	CTNAVTOSHLSDCU-UHFFFAOYSA-N	1	1	269.186	2.291	40	0		CEABMO
C[C@H]1CCC[N@@H+]([C@H](CN)c2ccc3c(c2)CCO3)C1	ZINC000108350019	344264854	/nfs/dbraw/zinc/26/48/54/344264854.db2.gz	KTBRIIPUKAOJDI-SWLSCSKDSA-N	1	1	260.381	2.353	40	0		CEABMO
C[C@H]1CCC[N@H+]([C@H](CN)c2ccc3c(c2)CCO3)C1	ZINC000108350019	344264856	/nfs/dbraw/zinc/26/48/56/344264856.db2.gz	KTBRIIPUKAOJDI-SWLSCSKDSA-N	1	1	260.381	2.353	40	0		CEABMO
CC(C)N1CC2(C1)C[C@@H](COc1ccccn1)CC[N@H+]2C	ZINC000585103528	345006005	/nfs/dbraw/zinc/00/60/05/345006005.db2.gz	XNNLQRPGXNGQML-HNNXBMFYSA-N	1	1	289.423	2.265	40	0		CEABMO
CC(C)[NH+]1CC2(C1)C[C@@H](COc1ccccn1)CCN2C	ZINC000585103528	345006007	/nfs/dbraw/zinc/00/60/07/345006007.db2.gz	XNNLQRPGXNGQML-HNNXBMFYSA-N	1	1	289.423	2.265	40	0		CEABMO
Cc1cccc(C[C@H]2CC[N@@H+](Cc3cncnc3)C[C@H]2O)c1	ZINC000585279672	345009930	/nfs/dbraw/zinc/00/99/30/345009930.db2.gz	XASGUNXAWSAIKZ-QZTJIDSGSA-N	1	1	297.402	2.211	40	0		CEABMO
Cc1ccc(CN2CC[C@@H]3[C@@H]2CC[N@H+]3[C@H]2CCOC2)o1	ZINC000107200322	186162690	/nfs/dbraw/zinc/16/26/90/186162690.db2.gz	LKROGKHWLIOURS-CWRNSKLLSA-N	1	1	276.380	2.026	40	0		CEABMO
Cc1ccc(C[N@H+]2CC[C@]3(C[C@H]3C(=O)NCC3CC3)C2)o1	ZINC000107235828	186163101	/nfs/dbraw/zinc/16/31/01/186163101.db2.gz	IIXRSHWVXRQTTH-RDJZCZTQSA-N	1	1	288.391	2.326	40	0		CEABMO
c1cn([C@H]2CO[C@@]3(C2)CCC[N@H+](Cc2cccnc2)C3)cn1	ZINC000107731402	186189265	/nfs/dbraw/zinc/18/92/65/186189265.db2.gz	SVZHDVPNTPYDSM-IAGOWNOFSA-N	1	1	298.390	2.274	40	0		CEABMO
O=C1NCC[C@@]12CCC[N@H+](Cc1cncc(Cl)c1)CC2	ZINC000108528102	186221257	/nfs/dbraw/zinc/22/12/57/186221257.db2.gz	MYTQYAQKEWGIRB-OAHLLOKOSA-N	1	1	293.798	2.227	40	0		CEABMO
Cc1nc(NC#N)nc2c1C[N@H+](Cc1ccccc1)CC2	ZINC000072415028	363133075	/nfs/dbraw/zinc/13/30/75/363133075.db2.gz	FBZYVRSOLSIRNN-UHFFFAOYSA-N	1	1	279.347	2.236	40	0		CEABMO
Cc1nc(NC#N)nc2c1C[N@@H+](Cc1ccccc1)CC2	ZINC000072415028	363133080	/nfs/dbraw/zinc/13/30/80/363133080.db2.gz	FBZYVRSOLSIRNN-UHFFFAOYSA-N	1	1	279.347	2.236	40	0		CEABMO
OCC[N@H+]1CCCC[C@H]1CN(Cc1ccccc1)C1CC1	ZINC000079414403	363597436	/nfs/dbraw/zinc/59/74/36/363597436.db2.gz	IRGAEBXJYHMMRC-SFHVURJKSA-N	1	1	288.435	2.498	40	0		CEABMO
OCCN1CCCC[C@H]1C[N@H+](Cc1ccccc1)C1CC1	ZINC000079414403	363597440	/nfs/dbraw/zinc/59/74/40/363597440.db2.gz	IRGAEBXJYHMMRC-SFHVURJKSA-N	1	1	288.435	2.498	40	0		CEABMO
OCCN1CCCC[C@H]1C[N@@H+](Cc1ccccc1)C1CC1	ZINC000079414403	363597444	/nfs/dbraw/zinc/59/74/44/363597444.db2.gz	IRGAEBXJYHMMRC-SFHVURJKSA-N	1	1	288.435	2.498	40	0		CEABMO
CCOc1ccccc1NC(=O)[C@H]1CCC[N@@H+](C)C1	ZINC000082326028	363765551	/nfs/dbraw/zinc/76/55/51/363765551.db2.gz	XDEIKPCOHKPNLE-LBPRGKRZSA-N	1	1	262.353	2.366	40	0		CEABMO
Cc1cccc(OC[C@H](O)C[N@@H+]2CCC[C@@H](C)C2)c1	ZINC000017135481	361504697	/nfs/dbraw/zinc/50/46/97/361504697.db2.gz	SVKRAUOKQPVBIT-HUUCEWRRSA-N	1	1	263.381	2.467	40	0		CEABMO
CCOC(=O)CC(=O)[C@@H]1CCC[N@@H+]1Cc1ccccc1	ZINC000026896620	361647475	/nfs/dbraw/zinc/64/74/75/361647475.db2.gz	AYYUONFQYZPRRR-AWEZNQCLSA-N	1	1	275.348	2.173	40	0		CEABMO
CCOC(=O)CC(=O)[C@@H]1CCC[N@H+]1Cc1ccccc1	ZINC000026896620	361647477	/nfs/dbraw/zinc/64/74/77/361647477.db2.gz	AYYUONFQYZPRRR-AWEZNQCLSA-N	1	1	275.348	2.173	40	0		CEABMO
CN(C)c1ccc(C(=O)[C@H]([NH2+]CCO)c2ccccc2)cc1	ZINC000031923996	361722800	/nfs/dbraw/zinc/72/28/00/361722800.db2.gz	CGIOYKJMHUKLCS-QGZVFWFLSA-N	1	1	298.386	2.259	40	0		CEABMO
Cc1cccc(N2CC[C@H]3[C@@H]2CCN3c2ncccn2)[nH+]1	ZINC000096184809	364407707	/nfs/dbraw/zinc/40/77/07/364407707.db2.gz	BEABPCHWYLZVKL-KBPBESRZSA-N	1	1	281.363	2.038	40	0		CEABMO
c1coc(C[N@H+]2C[C@@H](N3CCCC3)[C@H]3OCCC[C@H]3C2)c1	ZINC000096057099	364399590	/nfs/dbraw/zinc/39/95/90/364399590.db2.gz	ZELOTAUDEHCJAO-UAGQMJEPSA-N	1	1	290.407	2.355	40	0		CEABMO
c1coc(C[N@@H+]2C[C@@H](N3CCCC3)[C@H]3OCCC[C@H]3C2)c1	ZINC000096057099	364399600	/nfs/dbraw/zinc/39/96/00/364399600.db2.gz	ZELOTAUDEHCJAO-UAGQMJEPSA-N	1	1	290.407	2.355	40	0		CEABMO
COC[C@H]1CCC[C@]12C[N@H+](Cc1c(C)noc1C)CCO2	ZINC000096159855	364402965	/nfs/dbraw/zinc/40/29/65/364402965.db2.gz	PFGVIWBUHPDZET-ZBFHGGJFSA-N	1	1	294.395	2.309	40	0		CEABMO
COC[C@H]1CCC[C@]12C[N@@H+](Cc1c(C)noc1C)CCO2	ZINC000096159855	364402973	/nfs/dbraw/zinc/40/29/73/364402973.db2.gz	PFGVIWBUHPDZET-ZBFHGGJFSA-N	1	1	294.395	2.309	40	0		CEABMO
COC[C@H]1CCC[C@]12C[N@H+](Cc1cccc(C)n1)CCO2	ZINC000096159856	364403555	/nfs/dbraw/zinc/40/35/55/364403555.db2.gz	GBJHZCNNFYCAIU-WBVHZDCISA-N	1	1	290.407	2.408	40	0		CEABMO
COC[C@H]1CCC[C@]12C[N@@H+](Cc1cccc(C)n1)CCO2	ZINC000096159856	364403556	/nfs/dbraw/zinc/40/35/56/364403556.db2.gz	GBJHZCNNFYCAIU-WBVHZDCISA-N	1	1	290.407	2.408	40	0		CEABMO
Cc1cnc(N2CC[C@]3(CCC[N@H+]3CC3CC3)C2)nc1	ZINC000096203050	364410496	/nfs/dbraw/zinc/41/04/96/364410496.db2.gz	POHHTZHUTRRTBT-MRXNPFEDSA-N	1	1	272.396	2.240	40	0		CEABMO
CO[C@@H]1CC[N@@H+](Cc2sccc2C)[C@H]2CCO[C@@H]21	ZINC000096219170	364412568	/nfs/dbraw/zinc/41/25/68/364412568.db2.gz	SGEOJLCHKQWUOB-SCRDCRAPSA-N	1	1	267.394	2.435	40	0		CEABMO
C[N@H+]1CC[C@@]2(C1)CCC[C@H](CNc1ccccn1)O2	ZINC000096216918	364413092	/nfs/dbraw/zinc/41/30/92/364413092.db2.gz	MKYVTTSWJAHNSI-UKRRQHHQSA-N	1	1	261.369	2.137	40	0		CEABMO
CC(=O)N[C@H]1c2cccc(F)c2[C@H]2C[N@@H+](C(C)C)C[C@@H]12	ZINC000096261713	364418135	/nfs/dbraw/zinc/41/81/35/364418135.db2.gz	HWYOERBWYGVHTG-ZENOOKHLSA-N	1	1	276.355	2.440	40	0		CEABMO
Cc1ccc(CN2CCc3c(C[NH+](C)C)[nH]nc3C2)s1	ZINC000096255836	364418815	/nfs/dbraw/zinc/41/88/15/364418815.db2.gz	CZBGZKMRFGWLAQ-UHFFFAOYSA-N	1	1	290.436	2.400	40	0		CEABMO
OCC[N@@H+]1CCC[C@@H]1c1n[nH]cc1-c1ccccc1F	ZINC000257330569	371612954	/nfs/dbraw/zinc/61/29/54/371612954.db2.gz	XOYICFBYNDLDDJ-CQSZACIVSA-N	1	1	275.327	2.345	40	0		CEABMO
OCC[N@H+]1CCC[C@@H]1c1n[nH]cc1-c1ccccc1F	ZINC000257330569	371612959	/nfs/dbraw/zinc/61/29/59/371612959.db2.gz	XOYICFBYNDLDDJ-CQSZACIVSA-N	1	1	275.327	2.345	40	0		CEABMO
FC(F)(F)Cn1cc(C[NH2+]Cc2ccco2)cn1	ZINC000256053138	190004116	/nfs/dbraw/zinc/00/41/16/190004116.db2.gz	QELJOCCHHPCEGH-UHFFFAOYSA-N	1	1	259.231	2.328	40	0		CEABMO
Cc1ccc(C[N@H+]2CC[C@H](O)[C@]3(CCCO3)C2)cc1	ZINC000257213542	190012854	/nfs/dbraw/zinc/01/28/54/190012854.db2.gz	CIAFGVNFKDSCEN-HOTGVXAUSA-N	1	1	261.365	2.111	40	0		CEABMO
C[N@H+]1[C@H]2C[C@@]3(C)[C@@H]1CCC[C@H]3N(C(=O)c1cncs1)C2	ZINC000257236823	190017591	/nfs/dbraw/zinc/01/75/91/190017591.db2.gz	HDXUXXUWVXJKFL-DNVSUFBTSA-N	1	1	291.420	2.230	40	0		CEABMO
CCCn1ccnc1C[N@@H+]1CCC[C@@H](c2cc[nH]n2)C1	ZINC000257268448	190023975	/nfs/dbraw/zinc/02/39/75/190023975.db2.gz	MLSMUXCXURCBJC-CYBMUJFWSA-N	1	1	273.384	2.396	40	0		CEABMO
CCCn1ccnc1C[N@H+]1CCC[C@@H](c2cc[nH]n2)C1	ZINC000257268448	190023976	/nfs/dbraw/zinc/02/39/76/190023976.db2.gz	MLSMUXCXURCBJC-CYBMUJFWSA-N	1	1	273.384	2.396	40	0		CEABMO
Cc1cc(-c2ccnn2C)nc([C@@H]2CCCC[N@@H+]2C)n1	ZINC000257255509	190021036	/nfs/dbraw/zinc/02/10/36/190021036.db2.gz	KHTUVJIAOIOYPS-AWEZNQCLSA-N	1	1	271.368	2.342	40	0		CEABMO
Cc1cc(-c2ccnn2C)nc([C@@H]2CCCC[N@H+]2C)n1	ZINC000257255509	190021037	/nfs/dbraw/zinc/02/10/37/190021037.db2.gz	KHTUVJIAOIOYPS-AWEZNQCLSA-N	1	1	271.368	2.342	40	0		CEABMO
Fc1ccccc1OCc1cc([C@H]2CC[NH2+]C2)[nH]n1	ZINC000257259042	190021513	/nfs/dbraw/zinc/02/15/13/190021513.db2.gz	KWPDZYSIGCNVQZ-JTQLQIEISA-N	1	1	261.300	2.205	40	0		CEABMO
CN(C)Cc1cncc([C@H]2CCC[N@H+]2CC2CC2)n1	ZINC000257262425	190022686	/nfs/dbraw/zinc/02/26/86/190022686.db2.gz	LLIRCDJYKSUIDU-OAHLLOKOSA-N	1	1	260.385	2.085	40	0		CEABMO
Cc1cc(C[N@@H+]2CCC[C@H](c3n[nH]cc3C)C2)no1	ZINC000257288388	190027229	/nfs/dbraw/zinc/02/72/29/190027229.db2.gz	PTZZVQZLGLBECZ-LBPRGKRZSA-N	1	1	260.341	2.394	40	0		CEABMO
Cc1cc(C[N@H+]2CCC[C@H](c3n[nH]cc3C)C2)no1	ZINC000257288388	190027230	/nfs/dbraw/zinc/02/72/30/190027230.db2.gz	PTZZVQZLGLBECZ-LBPRGKRZSA-N	1	1	260.341	2.394	40	0		CEABMO
COc1ccc2c(c1)CCN1[C@H]3CCC[N@@H+]3CC[C@@H]21	ZINC000019326986	394468655	/nfs/dbraw/zinc/46/86/55/394468655.db2.gz	XDZYAXIEADIXLB-HOTGVXAUSA-N	1	1	258.365	2.420	40	0		CEABMO
Cc1cc([C@H]([NH3+])c2ccccc2)cnc1N1CCN(C)CC1	ZINC000072222569	394594504	/nfs/dbraw/zinc/59/45/04/394594504.db2.gz	QZVCYHDBQDTCEV-QGZVFWFLSA-N	1	1	296.418	2.190	40	0		CEABMO
CCOC(=O)[C@H]([NH3+])[C@H](Nc1ccccc1)C(C)C	ZINC000072210539	394592178	/nfs/dbraw/zinc/59/21/78/394592178.db2.gz	SNMKQNUYWSGTCT-CHWSQXEVSA-N	1	1	250.342	2.014	40	0		CEABMO
CC(C)[N@H+]1CCC[C@@H](c2nccnc2-c2ncc[nH]2)C1	ZINC000257240437	394595544	/nfs/dbraw/zinc/59/55/44/394595544.db2.gz	HTMURXPWLKNAQA-GFCCVEGCSA-N	1	1	271.368	2.455	40	0		CEABMO
Cc1cc(NC2CC3(C2)CC[N@@H+](CC2CC2)C3)ncn1	ZINC000257307762	394595595	/nfs/dbraw/zinc/59/55/95/394595595.db2.gz	TUAAJFQBYMYEFG-UHFFFAOYSA-N	1	1	272.396	2.461	40	0		CEABMO
COc1cccc(N2C(=O)[C@H]([NH3+])[C@@H]2c2ccccc2)c1	ZINC000072227721	394596364	/nfs/dbraw/zinc/59/63/64/394596364.db2.gz	ORSDLZMGXSGCNS-CABCVRRESA-N	1	1	268.316	2.110	40	0		CEABMO
CCOC[C@]12CCCO[C@@H]1CC[N@@H+](CC1CCOCC1)C2	ZINC000096056860	394676111	/nfs/dbraw/zinc/67/61/11/394676111.db2.gz	FXKMOSYEZHUKCQ-IAGOWNOFSA-N	1	1	297.439	2.321	40	0		CEABMO
Cc1cccc(N2CCC3(CCCC(=O)N3)CC2)[nH+]1	ZINC000096158568	394677147	/nfs/dbraw/zinc/67/71/47/394677147.db2.gz	RMGANFOMKPPLSR-UHFFFAOYSA-N	1	1	259.353	2.029	40	0		CEABMO
CCOC[C@@H]1CCC[C@@]12C[N@@H+](CC1CC1)CCO2	ZINC000096051877	286151420	/nfs/dbraw/zinc/15/14/20/286151420.db2.gz	ZIRZDEJMXNBWGB-LSDHHAIUSA-N	1	1	253.386	2.304	40	0		CEABMO
C[C@@H](NO)[C@@H](c1ccc2c(c1)OCO2)[NH+]1CCCCC1	ZINC000001685605	287042547	/nfs/dbraw/zinc/04/25/47/287042547.db2.gz	SJOLSPFJDYHXJK-ABAIWWIYSA-N	1	1	278.352	2.310	40	0		CEABMO
Cn1cccc1C[N@H+]1CCC[C@@H](c2cnccn2)C1	ZINC000072369367	176384066	/nfs/dbraw/zinc/38/40/66/176384066.db2.gz	VIIYNUBXSVLGGR-CYBMUJFWSA-N	1	1	256.353	2.195	40	0		CEABMO
Cc1cc(Nc2cccc([C@@H]3CCC[N@H+]3CCO)n2)no1	ZINC000072383039	176388443	/nfs/dbraw/zinc/38/84/43/176388443.db2.gz	ZUYKMGCTTZYUQL-ZDUSSCGKSA-N	1	1	288.351	2.251	40	0		CEABMO
CN(C)c1cncc([C@H]2CCC[N@@H+]2Cc2ccncc2)n1	ZINC000072385041	176389273	/nfs/dbraw/zinc/38/92/73/176389273.db2.gz	JETHMSGYDFWPRC-OAHLLOKOSA-N	1	1	283.379	2.275	40	0		CEABMO
CN(C)c1cncc([C@H]2CCC[N@H+]2Cc2ccncc2)n1	ZINC000072385041	176389275	/nfs/dbraw/zinc/38/92/75/176389275.db2.gz	JETHMSGYDFWPRC-OAHLLOKOSA-N	1	1	283.379	2.275	40	0		CEABMO
CC(=O)OCc1ccc(CN2C[C@H]3CCC[N@@H+]3C[C@H]2C)o1	ZINC000072397548	176394683	/nfs/dbraw/zinc/39/46/83/176394683.db2.gz	PZLFJHQRYKIHEQ-TZMCWYRMSA-N	1	1	292.379	2.011	40	0		CEABMO
C[C@@H]1C[N@H+]2CCC[C@H]2CN1Cc1cccc2nccnc12	ZINC000072397545	176394805	/nfs/dbraw/zinc/39/48/05/176394805.db2.gz	QSQAIYIXQLYKIS-HIFRSBDPSA-N	1	1	282.391	2.298	40	0		CEABMO
COCC[C@H]1C[N@@H+](CC2CCCC2)Cc2ccnn21	ZINC000247910883	277241511	/nfs/dbraw/zinc/24/15/11/277241511.db2.gz	YHUCIBRRKZUYDG-HNNXBMFYSA-N	1	1	263.385	2.467	40	0		CEABMO
COc1ncnc2c1CC[N@@H+](Cc1ccc(F)cc1)CC2	ZINC000096058738	278098964	/nfs/dbraw/zinc/09/89/64/278098964.db2.gz	ULPXCBJDLWFASY-UHFFFAOYSA-N	1	1	287.338	2.225	40	0		CEABMO
Cc1occc1-c1n[nH]c([C@H]([NH3+])c2ccccc2)n1	ZINC000095533408	185005804	/nfs/dbraw/zinc/00/58/04/185005804.db2.gz	BUSZDKPGFWYYJM-GFCCVEGCSA-N	1	1	254.293	2.421	40	0		CEABMO
CO[C@H]1CC[C@H]2[C@H]1OCC[N@H+]2CCOCc1ccccc1	ZINC000096041940	185070000	/nfs/dbraw/zinc/07/00/00/185070000.db2.gz	BIRCTPOYJKSWCM-YESZJQIVSA-N	1	1	291.391	2.081	40	0		CEABMO
Cc1csc(C[N@H+]2CC[C@H]3C[C@H](C)O[C@@H]3C2)n1	ZINC000096046039	185071826	/nfs/dbraw/zinc/07/18/26/185071826.db2.gz	UKUADHISIUIRTJ-SDDRHHMPSA-N	1	1	252.383	2.451	40	0		CEABMO
Cc1csc(C[N@@H+]2CC[C@H]3C[C@H](C)O[C@@H]3C2)n1	ZINC000096046039	185071828	/nfs/dbraw/zinc/07/18/28/185071828.db2.gz	UKUADHISIUIRTJ-SDDRHHMPSA-N	1	1	252.383	2.451	40	0		CEABMO
CCOC[C@]12CCCO[C@@H]1CC[N@@H+](Cc1ccccn1)C2	ZINC000096056804	185077233	/nfs/dbraw/zinc/07/72/33/185077233.db2.gz	BSKDQECSJKCUNS-IAGOWNOFSA-N	1	1	290.407	2.489	40	0		CEABMO
COC[C@]12CCCO[C@H]1CC[N@@H+](Cc1ccncc1)C2	ZINC000096056730	185078182	/nfs/dbraw/zinc/07/81/82/185078182.db2.gz	HVXOOPYFHMJWMJ-JKSUJKDBSA-N	1	1	276.380	2.099	40	0		CEABMO
C[C@@H]1CCCC[N@H+]1C[C@H](O)COc1ccc(F)cc1	ZINC000035031497	361804405	/nfs/dbraw/zinc/80/44/05/361804405.db2.gz	WWQSPLICWQFGRY-OCCSQVGLSA-N	1	1	267.344	2.440	40	0		CEABMO
c1cncc(O[C@H]2CO[C@@]3(CC[N@H+](CC4CCC4)C3)C2)c1	ZINC000096072452	185088346	/nfs/dbraw/zinc/08/83/46/185088346.db2.gz	LVHJIQZLIHSNQM-SJORKVTESA-N	1	1	288.391	2.494	40	0		CEABMO
c1ccc(C[N@@H+]2CC[C@H]3[C@H]2CCN3Cc2cccnc2)nc1	ZINC000096083014	185093232	/nfs/dbraw/zinc/09/32/32/185093232.db2.gz	AEHQUODIIJBNPO-ZWKOTPCHSA-N	1	1	294.402	2.325	40	0		CEABMO
c1ccc(CN2CC[C@H]3[C@H]2CC[N@@H+]3Cc2cccnc2)nc1	ZINC000096083014	185093233	/nfs/dbraw/zinc/09/32/33/185093233.db2.gz	AEHQUODIIJBNPO-ZWKOTPCHSA-N	1	1	294.402	2.325	40	0		CEABMO
c1ccc(CN2CC[C@H]3[C@H]2CC[N@H+]3Cc2cccnc2)nc1	ZINC000096083014	185093235	/nfs/dbraw/zinc/09/32/35/185093235.db2.gz	AEHQUODIIJBNPO-ZWKOTPCHSA-N	1	1	294.402	2.325	40	0		CEABMO
Cc1ccsc1C[N@H+]1C[C@@H]2COC[C@]2(CN(C)C)C1	ZINC000096108261	185099648	/nfs/dbraw/zinc/09/96/48/185099648.db2.gz	FFAOMBLMPIOZMK-HIFRSBDPSA-N	1	1	280.437	2.067	40	0		CEABMO
Cc1ccsc1C[N@@H+]1C[C@@H]2COC[C@]2(CN(C)C)C1	ZINC000096108261	185099649	/nfs/dbraw/zinc/09/96/49/185099649.db2.gz	FFAOMBLMPIOZMK-HIFRSBDPSA-N	1	1	280.437	2.067	40	0		CEABMO
Cc1ccsc1CN1C[C@@H]2COC[C@]2(C[NH+](C)C)C1	ZINC000096108261	185099650	/nfs/dbraw/zinc/09/96/50/185099650.db2.gz	FFAOMBLMPIOZMK-HIFRSBDPSA-N	1	1	280.437	2.067	40	0		CEABMO
C[C@@H]1CC[C@H](C)[N@H+]1c1ccc(N2CCOCC2)c(N)c1	ZINC000017957897	343373435	/nfs/dbraw/zinc/37/34/35/343373435.db2.gz	OLOLGOYRPYYLEQ-BETUJISGSA-N	1	1	275.396	2.483	40	0		CEABMO
C[C@@H]1CC[C@H](C)[N@@H+]1c1ccc(N2CCOCC2)c(N)c1	ZINC000017957897	343373437	/nfs/dbraw/zinc/37/34/37/343373437.db2.gz	OLOLGOYRPYYLEQ-BETUJISGSA-N	1	1	275.396	2.483	40	0		CEABMO
c1coc(-c2nnc([C@H]3CC[N@H+](C4CCOCC4)C3)o2)c1	ZINC000049169521	362343118	/nfs/dbraw/zinc/34/31/18/362343118.db2.gz	KEWTTZDQZJQVBV-NSHDSACASA-N	1	1	289.335	2.298	40	0	biogenic,in-vitro	CEABMO
CC(C)[N@H+]1CC[C@H](NC(=O)OCc2ccccc2)C1	ZINC000307369443	344721951	/nfs/dbraw/zinc/72/19/51/344721951.db2.gz	QYRHPZBDSVGXKW-AWEZNQCLSA-N	1	1	262.353	2.396	40	0		CEABMO
[NH3+]Cc1noc([C@H](C2CCCCC2)n2cccc2)n1	ZINC000409439429	344889804	/nfs/dbraw/zinc/88/98/04/344889804.db2.gz	HJDNOABGYKYIFA-ZDUSSCGKSA-N	1	1	260.341	2.500	40	0		CEABMO
Cc1n[nH]c(C)c1C[N@H+]1CC[C@H](Cc2ccccc2)[C@@H](O)C1	ZINC000585278790	345009786	/nfs/dbraw/zinc/00/97/86/345009786.db2.gz	GHKMUWRCSTYQFK-AEFFLSMTSA-N	1	1	299.418	2.452	40	0		CEABMO
Cc1ccc(C[N@H+]2CC[C@@]3(C[C@H]3C(=O)NCC3CC3)C2)o1	ZINC000107235834	186163921	/nfs/dbraw/zinc/16/39/21/186163921.db2.gz	IIXRSHWVXRQTTH-DOTOQJQBSA-N	1	1	288.391	2.326	40	0		CEABMO
OCC[N@H+]1CCC[C@H]1CN(Cc1ccccc1)C1CC1	ZINC000079414352	363596903	/nfs/dbraw/zinc/59/69/03/363596903.db2.gz	ZXMYKCCVNPAYGO-KRWDZBQOSA-N	1	1	274.408	2.108	40	0		CEABMO
OCCN1CCC[C@H]1C[N@H+](Cc1ccccc1)C1CC1	ZINC000079414352	363596908	/nfs/dbraw/zinc/59/69/08/363596908.db2.gz	ZXMYKCCVNPAYGO-KRWDZBQOSA-N	1	1	274.408	2.108	40	0		CEABMO
OCCN1CCC[C@H]1C[N@@H+](Cc1ccccc1)C1CC1	ZINC000079414352	363596911	/nfs/dbraw/zinc/59/69/11/363596911.db2.gz	ZXMYKCCVNPAYGO-KRWDZBQOSA-N	1	1	274.408	2.108	40	0		CEABMO
CC(C)[N@H+](Cc1ccccc1)C[C@@H]1CCN(CCO)C1	ZINC000079414271	363597619	/nfs/dbraw/zinc/59/76/19/363597619.db2.gz	YXJXMEXEEPTZLI-QGZVFWFLSA-N	1	1	276.424	2.211	40	0		CEABMO
CC[N@H+](Cc1ccccc1)CC1CC[NH+](CC(=O)[O-])CC1	ZINC000079416119	363599144	/nfs/dbraw/zinc/59/91/44/363599144.db2.gz	GJKYXNNMKRXIDL-UHFFFAOYSA-N	1	1	290.407	2.305	40	0		CEABMO
Cc1c[nH]nc1[C@H]1CCC[N@H+](Cc2cnn(C)c2C)C1	ZINC000011789304	361364980	/nfs/dbraw/zinc/36/49/80/361364980.db2.gz	HNFWVPHAYZVSIW-ZDUSSCGKSA-N	1	1	273.384	2.140	40	0		CEABMO
COc1ccc(OC)c(CN2C[C@H]3CCC[N@H+]3C[C@@H]2C)c1	ZINC000019575738	361543672	/nfs/dbraw/zinc/54/36/72/361543672.db2.gz	VSJROCKNJFVGFJ-DZGCQCFKSA-N	1	1	290.407	2.372	40	0		CEABMO
C(C1CCCCC1)[N@H+]1CCC[C@@H]1c1nnc2n1CCNC2	ZINC000019705504	361549260	/nfs/dbraw/zinc/54/92/60/361549260.db2.gz	ZCCXUVULJFCERL-CQSZACIVSA-N	1	1	289.427	2.099	40	0		CEABMO
C[C@H]([NH3+])c1nc(-c2ccccc2OC(F)F)no1	ZINC000089262323	363952394	/nfs/dbraw/zinc/95/23/94/363952394.db2.gz	WMYBWNFNPTYTRD-LURJTMIESA-N	1	1	255.224	2.358	40	0		CEABMO
O=C(Cc1cccs1)N1CC[C@H]2[C@H]1CC[N@H+]2CC1CC1	ZINC000096184417	364406784	/nfs/dbraw/zinc/40/67/84/364406784.db2.gz	CFMYHMDSOOJAAZ-LSDHHAIUSA-N	1	1	290.432	2.376	40	0		CEABMO
c1cc(C[N@@H+]2C[C@H]3CN(c4ncccn4)C[C@H]3C2)cs1	ZINC000096053985	364399469	/nfs/dbraw/zinc/39/94/69/364399469.db2.gz	NODGTYBVIOHWOS-OKILXGFUSA-N	1	1	286.404	2.106	40	0		CEABMO
CO[C@@H]1CC[C@H]2[C@H]1OCC[N@@H+]2Cc1ccc(F)cc1	ZINC000096057763	364400704	/nfs/dbraw/zinc/40/07/04/364400704.db2.gz	UGXOQTUIIMBSCD-RRFJBIMHSA-N	1	1	265.328	2.204	40	0		CEABMO
CO[C@@H]1CC[C@H]2[C@H]1OCC[N@H+]2Cc1ccc(F)cc1	ZINC000096057763	364400707	/nfs/dbraw/zinc/40/07/07/364400707.db2.gz	UGXOQTUIIMBSCD-RRFJBIMHSA-N	1	1	265.328	2.204	40	0		CEABMO
COC[C@@H]1CC2(C[N@H+]1C)CCN(C(=O)C1=CCCC1)CC2	ZINC000096207526	364410997	/nfs/dbraw/zinc/41/09/97/364410997.db2.gz	MYKBTKISHQXEPL-HNNXBMFYSA-N	1	1	292.423	2.056	40	0		CEABMO
CC(C)[N@@H+](C)[C@@H]1CCN(CC2CC2)[C@H]1Cc1cnn(C)c1	ZINC000096200944	364411469	/nfs/dbraw/zinc/41/14/69/364411469.db2.gz	YROJZRUVMMEVTI-SJORKVTESA-N	1	1	290.455	2.156	40	0		CEABMO
CC(C)N(C)[C@@H]1CC[N@H+](CC2CC2)[C@H]1Cc1cnn(C)c1	ZINC000096200944	364411473	/nfs/dbraw/zinc/41/14/73/364411473.db2.gz	YROJZRUVMMEVTI-SJORKVTESA-N	1	1	290.455	2.156	40	0		CEABMO
CC(C)N(C)[C@@H]1CC[N@@H+](CC2CC2)[C@H]1Cc1cnn(C)c1	ZINC000096200944	364411477	/nfs/dbraw/zinc/41/14/77/364411477.db2.gz	YROJZRUVMMEVTI-SJORKVTESA-N	1	1	290.455	2.156	40	0		CEABMO
O=C1CC[C@@H]2[C@@H](CC[N@H+]2Cc2ccco2)N1CC1CC1	ZINC000096316710	364419988	/nfs/dbraw/zinc/41/99/88/364419988.db2.gz	SOZKAXVKIOGMNC-HUUCEWRRSA-N	1	1	274.364	2.255	40	0		CEABMO
C[N@H+]1CCC[C@@]2(CCN(C(=O)Cc3ccccc3)C2)C1	ZINC000096268565	364420261	/nfs/dbraw/zinc/42/02/61/364420261.db2.gz	UJMUZCMSWUNXBD-QGZVFWFLSA-N	1	1	272.392	2.173	40	0		CEABMO
CC[NH+](CC)CCN[C@H](C)C(=O)N1[C@H](C)CCC[C@H]1C	ZINC000245229679	370806874	/nfs/dbraw/zinc/80/68/74/370806874.db2.gz	CXSVMOSHBAQULZ-RBSFLKMASA-N	1	1	283.460	2.096	40	0		CEABMO
C[C@H](c1ccccc1)[N@H+]1CCC[C@]2(CN(C)C2=O)C1	ZINC000585099436	367177187	/nfs/dbraw/zinc/17/71/87/367177187.db2.gz	JIYHEDORYCDKBB-CJNGLKHVSA-N	1	1	258.365	2.302	40	0		CEABMO
CCCn1cc(C[NH2+]Cc2ccnn2C(F)F)c(C)n1	ZINC000256052963	190004178	/nfs/dbraw/zinc/00/41/78/190004178.db2.gz	PJVZKQXTFQJUGS-UHFFFAOYSA-N	1	1	283.326	2.483	40	0		CEABMO
C[N@H+]1CC[C@H](Cc2cccc(Br)n2)C1	ZINC000257197571	190009856	/nfs/dbraw/zinc/00/98/56/190009856.db2.gz	CYMYINAIDURXHI-SECBINFHSA-N	1	1	255.159	2.338	40	0		CEABMO
CCCn1nccc1C[NH2+]Cc1cnn(CC(C)C)c1	ZINC000256055234	190005572	/nfs/dbraw/zinc/00/55/72/190005572.db2.gz	ZVGQEYNOYVBCTK-UHFFFAOYSA-N	1	1	275.400	2.435	40	0		CEABMO
CCn1cc(C[NH2+]Cc2c(C)nn(CC)c2F)c(C)n1	ZINC000256055181	190005581	/nfs/dbraw/zinc/00/55/81/190005581.db2.gz	ZPBOHXOXFGABHJ-UHFFFAOYSA-N	1	1	279.363	2.165	40	0		CEABMO
CN1CCC([N@H+]2CCC[C@H](c3ccc4c[nH]nc4n3)C2)CC1	ZINC000257210088	190012249	/nfs/dbraw/zinc/01/22/49/190012249.db2.gz	BTCNHNCGMFUNGB-AWEZNQCLSA-N	1	1	299.422	2.232	40	0		CEABMO
Cc1cncc([C@H]2CCC[N@@H+](CC3CCOCC3)C2)n1	ZINC000257255409	190020514	/nfs/dbraw/zinc/02/05/14/190020514.db2.gz	KHIXFXBGUXBKAV-HNNXBMFYSA-N	1	1	275.396	2.391	40	0		CEABMO
Cc1cn(C)c([C@@H]2CCC[N@@H+](Cc3cnc(C)nc3)C2)n1	ZINC000257238172	190017605	/nfs/dbraw/zinc/01/76/05/190017605.db2.gz	HJWJDRNPCMHCGK-OAHLLOKOSA-N	1	1	285.395	2.207	40	0		CEABMO
OCCOc1cccc(C[N@H+]2CCC[C@@H]2c2ccncn2)c1	ZINC000257244494	190019389	/nfs/dbraw/zinc/01/93/89/190019389.db2.gz	ILOQIFRFOINAMS-QGZVFWFLSA-N	1	1	299.374	2.185	40	0		CEABMO
OCCOc1cccc(C[N@H+]2CCC[C@H]2c2ccncn2)c1	ZINC000257244493	190019515	/nfs/dbraw/zinc/01/95/15/190019515.db2.gz	ILOQIFRFOINAMS-KRWDZBQOSA-N	1	1	299.374	2.185	40	0		CEABMO
c1ccc(C[N@H+]2CCC3(CC(Nc4ccncn4)C3)C2)nc1	ZINC000257258453	190021415	/nfs/dbraw/zinc/02/14/15/190021415.db2.gz	KTXWOOPGTWAURI-UHFFFAOYSA-N	1	1	295.390	2.338	40	0		CEABMO
COc1cccc(C[N@H+]2C[C@H](OC)[C@]3(CCCO3)C2)c1F	ZINC000257273220	190025113	/nfs/dbraw/zinc/02/51/13/190025113.db2.gz	NFSTXUMVLNSHDU-HOCLYGCPSA-N	1	1	295.354	2.214	40	0		CEABMO
COc1cccc(C[N@@H+]2C[C@H](OC)[C@]3(CCCO3)C2)c1F	ZINC000257273220	190025114	/nfs/dbraw/zinc/02/51/14/190025114.db2.gz	NFSTXUMVLNSHDU-HOCLYGCPSA-N	1	1	295.354	2.214	40	0		CEABMO
CC(C)[N@H+]1CCC[C@@H](c2cncc(-c3ccnn3C)n2)C1	ZINC000257290679	190027791	/nfs/dbraw/zinc/02/77/91/190027791.db2.gz	QDXHBZDXLAVSIZ-CYBMUJFWSA-N	1	1	285.395	2.465	40	0		CEABMO
CNC(=O)C[N@H+]1CCC[C@@H](Cc2ccnc3ccccc23)C1	ZINC000257301959	190030207	/nfs/dbraw/zinc/03/02/07/190030207.db2.gz	SATMQXTYDLJWBH-AWEZNQCLSA-N	1	1	297.402	2.235	40	0		CEABMO
Cc1ncc(CN2CC[N@H+](C)[C@H](c3ccccc3)C2)cn1	ZINC000257305981	190030948	/nfs/dbraw/zinc/03/09/48/190030948.db2.gz	SSIQLVWUAHLEAZ-KRWDZBQOSA-N	1	1	282.391	2.274	40	0		CEABMO
Cc1ccc([C@@H]2[C@@H]([NH3+])C(=O)N2c2ccc(F)cc2)o1	ZINC000072227220	394595591	/nfs/dbraw/zinc/59/55/91/394595591.db2.gz	LTKGARFDKBEJDE-CHWSQXEVSA-N	1	1	260.268	2.142	40	0		CEABMO
COc1cccc(N2C(=O)[C@@H]([NH3+])[C@@H]2c2ccc(C)cc2)c1	ZINC000072227727	394596151	/nfs/dbraw/zinc/59/61/51/394596151.db2.gz	ATICMZPWYIMLJQ-HOTGVXAUSA-N	1	1	282.343	2.419	40	0		CEABMO
[NH3+][C@H]1C(=O)N(c2cccc(F)c2)[C@H]1c1ccccc1F	ZINC000072227649	394596490	/nfs/dbraw/zinc/59/64/90/394596490.db2.gz	VCFIPGMTGKAAPU-KGLIPLIRSA-N	1	1	274.270	2.380	40	0		CEABMO
COc1c2c(cc3c1C[N@@H+](C(C)(C)C)C[C@@H]3O)OCO2	ZINC000261829824	394608568	/nfs/dbraw/zinc/60/85/68/394608568.db2.gz	SZTAGXSUDJPRAO-NSHDSACASA-N	1	1	279.336	2.071	40	0		CEABMO
COc1c2c(cc3c1C[N@H+](C(C)(C)C)C[C@@H]3O)OCO2	ZINC000261829824	394608573	/nfs/dbraw/zinc/60/85/73/394608573.db2.gz	SZTAGXSUDJPRAO-NSHDSACASA-N	1	1	279.336	2.071	40	0		CEABMO
CC(C)[N@H+]1CCN2C(=O)N(C3CCCCC3)C[C@H]2C1	ZINC000085436207	394642902	/nfs/dbraw/zinc/64/29/02/394642902.db2.gz	HEFARGMCRBKVFE-CQSZACIVSA-N	1	1	265.401	2.149	40	0	biogenic,in-vitro	CEABMO
Cc1cccc(C[N@H+]2CC[C@]3(CCN3c3ncccn3)C2)n1	ZINC000096076133	394675351	/nfs/dbraw/zinc/67/53/51/394675351.db2.gz	VSMXCCSJYCVVIY-KRWDZBQOSA-N	1	1	295.390	2.035	40	0		CEABMO
Cc1ccc2c(c1)[C@H](N1CCOCC1)CC21CC[NH2+]CC1	ZINC000096079409	394675516	/nfs/dbraw/zinc/67/55/16/394675516.db2.gz	HBOOFELTRHJXPO-QGZVFWFLSA-N	1	1	286.419	2.393	40	0		CEABMO
CC[C@@H]1CO[C@]2(C1)CCCN(CCC[NH+](C)C)C2	ZINC000096089833	394676859	/nfs/dbraw/zinc/67/68/59/394676859.db2.gz	YVLONVXWSIRREV-GJZGRUSLSA-N	1	1	254.418	2.219	40	0		CEABMO
CCn1nccc1C[NH2+]Cc1cccc(F)c1F	ZINC000020349298	171155187	/nfs/dbraw/zinc/15/51/87/171155187.db2.gz	ZLDJQLUTASQZPI-UHFFFAOYSA-N	1	1	251.280	2.471	40	0		CEABMO
[NH3+][C@@H]1CCCC[C@@H]1N1CCN(Cc2ccccc2)CC1	ZINC000040431793	174260159	/nfs/dbraw/zinc/26/01/59/174260159.db2.gz	DNIGNRKTSONDSF-SJORKVTESA-N	1	1	273.424	2.074	40	0		CEABMO
CC[C@@H]1[N@@H+](CC2CCOCC2)CCC[C@]12CCC(=O)N2C	ZINC000096052433	287312773	/nfs/dbraw/zinc/31/27/73/287312773.db2.gz	HQABLBGESPKEFI-RDJZCZTQSA-N	1	1	294.439	2.278	40	0		CEABMO
[NH3+][C@H]1C(=O)N(Cc2ccccc2)[C@@H]1c1ccccc1	ZINC000072228112	176343464	/nfs/dbraw/zinc/34/34/64/176343464.db2.gz	JAUNCKDTAJDBHE-HUUCEWRRSA-N	1	1	252.317	2.097	40	0		CEABMO
COCC[N@H+]1CCC[C@H](c2cccc(-n3ccnc3)n2)C1	ZINC000072355536	176374871	/nfs/dbraw/zinc/37/48/71/176374871.db2.gz	FEMVDCIXKLACHN-AWEZNQCLSA-N	1	1	286.379	2.093	40	0		CEABMO
C[N@H+]1CCC[C@H](c2ccc(NCC3(C)COC3)cn2)C1	ZINC000072386984	176392617	/nfs/dbraw/zinc/39/26/17/176392617.db2.gz	FOWGCEQSLDVALK-ZDUSSCGKSA-N	1	1	275.396	2.339	40	0		CEABMO
C[N@H+]1CCC[C@H]1c1cccc(NCC2(C)COC2)n1	ZINC000072386981	176392978	/nfs/dbraw/zinc/39/29/78/176392978.db2.gz	FCSPHGXXPUJFSD-ZDUSSCGKSA-N	1	1	261.369	2.297	40	0		CEABMO
CC1=CCC[C@@H](C)[C@@H]1C[N@H+](C)[C@@H](C)CS(C)(=O)=O	ZINC000191070832	262188726	/nfs/dbraw/zinc/18/87/26/262188726.db2.gz	NPIUSJCKCVLBNT-HZSPNIEDSA-N	1	1	273.442	2.344	40	0		CEABMO
Brc1ccc2c(c1)[C@@]1(CCO2)COCC[NH2+]1	ZINC000306145558	275371951	/nfs/dbraw/zinc/37/19/51/275371951.db2.gz	ILTPKJLBTIAMPZ-GFCCVEGCSA-N	1	1	284.153	2.047	40	0		CEABMO
Cc1ccc([C@@H]([NH3+])c2nc(-c3ccco3)n[nH]2)cc1	ZINC000095534073	280948102	/nfs/dbraw/zinc/94/81/02/280948102.db2.gz	QUMRWPSYYHZLNC-GFCCVEGCSA-N	1	1	254.293	2.421	40	0		CEABMO
Cc1[nH+]ccn1-c1nc2nonc2nc1Nc1ccccc1	ZINC000408722519	534972788	/nfs/dbraw/zinc/97/27/88/534972788.db2.gz	VFPMQDAWMDYAJR-UHFFFAOYSA-N	1	1	293.290	2.251	40	0		CEABMO
COC[C@]12CCCO[C@@H]1CC[N@@H+](Cc1cccc(C)n1)C2	ZINC000096038996	185069106	/nfs/dbraw/zinc/06/91/06/185069106.db2.gz	HHSVDHNVSJBKDN-IAGOWNOFSA-N	1	1	290.407	2.408	40	0		CEABMO
COc1ccc(C[N@H+]2CCC[C@@]3(CCC(=O)N3)CC2)cc1	ZINC000096047454	185072310	/nfs/dbraw/zinc/07/23/10/185072310.db2.gz	FOPGNETWZQZDLY-QGZVFWFLSA-N	1	1	288.391	2.330	40	0		CEABMO
c1cn([C@@H]2CO[C@]3(C2)CCC[N@H+](Cc2ccccn2)C3)cn1	ZINC000096048562	185072412	/nfs/dbraw/zinc/07/24/12/185072412.db2.gz	DCZVGCNCDNMRRP-IRXDYDNUSA-N	1	1	298.390	2.274	40	0		CEABMO
c1cncc(CN2C[C@@H]3C[N@H+](Cc4ccncc4)C[C@@H]3C2)c1	ZINC000096053743	185074275	/nfs/dbraw/zinc/07/42/75/185074275.db2.gz	GEEIIYLNXYZEPQ-HDICACEKSA-N	1	1	294.402	2.040	40	0		CEABMO
c1cncc(C[N@@H+]2C[C@H]3CN(Cc4ccncc4)C[C@H]3C2)c1	ZINC000096053743	185074276	/nfs/dbraw/zinc/07/42/76/185074276.db2.gz	GEEIIYLNXYZEPQ-HDICACEKSA-N	1	1	294.402	2.040	40	0		CEABMO
c1cncc(C[N@H+]2C[C@H]3CN(Cc4ccncc4)C[C@H]3C2)c1	ZINC000096053743	185074277	/nfs/dbraw/zinc/07/42/77/185074277.db2.gz	GEEIIYLNXYZEPQ-HDICACEKSA-N	1	1	294.402	2.040	40	0		CEABMO
COC[C@@H]1CCC[C@@]12C[N@H+](Cc1ccncc1)CCO2	ZINC000096051847	185074621	/nfs/dbraw/zinc/07/46/21/185074621.db2.gz	LDQDSPKLJXIJEY-JKSUJKDBSA-N	1	1	276.380	2.099	40	0		CEABMO
COC[C@@H]1CCC[C@@]12C[N@@H+](Cc1ccncc1)CCO2	ZINC000096051847	185074622	/nfs/dbraw/zinc/07/46/22/185074622.db2.gz	LDQDSPKLJXIJEY-JKSUJKDBSA-N	1	1	276.380	2.099	40	0		CEABMO
c1coc(CN2C[C@@H]3C[NH+](Cc4ccccn4)C[C@H]3C2)c1	ZINC000096053777	185074819	/nfs/dbraw/zinc/07/48/19/185074819.db2.gz	JEGHGWHLFFTGSN-GJZGRUSLSA-N	1	1	283.375	2.238	40	0		CEABMO
Fc1cccc(O[C@H]2C[C@H]3C[N@@H+](CC4CC4)CCN3C2)c1	ZINC000096055158	185076749	/nfs/dbraw/zinc/07/67/49/185076749.db2.gz	NJDAHRFTRCEKOQ-RDJZCZTQSA-N	1	1	290.382	2.373	40	0		CEABMO
Fc1cccc(O[C@H]2C[C@H]3CN(CC4CC4)CC[N@@H+]3C2)c1	ZINC000096055158	185076750	/nfs/dbraw/zinc/07/67/50/185076750.db2.gz	NJDAHRFTRCEKOQ-RDJZCZTQSA-N	1	1	290.382	2.373	40	0		CEABMO
Fc1cccc(O[C@H]2C[C@H]3CN(CC4CC4)CC[N@H+]3C2)c1	ZINC000096055158	185076751	/nfs/dbraw/zinc/07/67/51/185076751.db2.gz	NJDAHRFTRCEKOQ-RDJZCZTQSA-N	1	1	290.382	2.373	40	0		CEABMO
C(O[C@@H]1CC[C@H]2[C@H]1OCC[N@H+]2CC1CCOCC1)C1CC1	ZINC000096057899	185079304	/nfs/dbraw/zinc/07/93/04/185079304.db2.gz	HANHVUDOZONGRF-GVDBMIGSSA-N	1	1	295.423	2.071	40	0		CEABMO
O=C1C[C@H]2[C@@H](CC[N@H+]2Cc2ccoc2)N1Cc1cccnc1	ZINC000096063867	185083964	/nfs/dbraw/zinc/08/39/64/185083964.db2.gz	RRXXKPVNLNWYEA-CVEARBPZSA-N	1	1	297.358	2.050	40	0		CEABMO
CO[C@H]1CO[C@]2(CC[N@@H+](Cc3ccccc3F)C2)C1	ZINC000096072176	185088118	/nfs/dbraw/zinc/08/81/18/185088118.db2.gz	CRADNAIOGBRIIJ-UKRRQHHQSA-N	1	1	265.328	2.206	40	0		CEABMO
COCC[N@H+]1CC[C@H]2CN(Cc3ccc(C)o3)CC[C@H]21	ZINC000096099920	185098051	/nfs/dbraw/zinc/09/80/51/185098051.db2.gz	RWDMXRINAFFJNY-GOEBONIOSA-N	1	1	278.396	2.131	40	0		CEABMO
Cn1cc(C[N@H+]2C[C@H]3CCC[C@@]3(COCC3CC3)C2)cn1	ZINC000096109181	185099161	/nfs/dbraw/zinc/09/91/61/185099161.db2.gz	NXBNPQXVENHAAY-SJORKVTESA-N	1	1	289.423	2.449	40	0		CEABMO
Cc1ccc(C[N@H+]2C[C@@H]3COC[C@]3(CN(C)C)C2)s1	ZINC000096108240	185100390	/nfs/dbraw/zinc/10/03/90/185100390.db2.gz	DNUKXWNPNLBKMY-HIFRSBDPSA-N	1	1	280.437	2.067	40	0		CEABMO
Cc1ccc(C[N@@H+]2C[C@@H]3COC[C@]3(CN(C)C)C2)s1	ZINC000096108240	185100391	/nfs/dbraw/zinc/10/03/91/185100391.db2.gz	DNUKXWNPNLBKMY-HIFRSBDPSA-N	1	1	280.437	2.067	40	0		CEABMO
Cc1cc2nc(CO[C@H]3C[N@H+](C)C[C@H]3F)[nH]c2cc1C	ZINC000096112338	185101580	/nfs/dbraw/zinc/10/15/80/185101580.db2.gz	CLLINKCBQODAAY-RISCZKNCSA-N	1	1	277.343	2.348	40	0	biogenic,in-vitro	CEABMO
Cc1cc2nc(CO[C@H]3C[N@@H+](C)C[C@H]3F)[nH]c2cc1C	ZINC000096112338	185101582	/nfs/dbraw/zinc/10/15/82/185101582.db2.gz	CLLINKCBQODAAY-RISCZKNCSA-N	1	1	277.343	2.348	40	0	biogenic,in-vitro	CEABMO
CC(C)[N@H+]1CC[C@H](c2nnc(-c3ccncc3)o2)C1	ZINC000049169620	362342648	/nfs/dbraw/zinc/34/26/48/362342648.db2.gz	KQQNQESJBKTNDP-LBPRGKRZSA-N	1	1	258.325	2.329	40	0	biogenic,in-vitro	CEABMO
CC(C)[N@H+]1CCC[C@@H](c2cncc(-c3cn[nH]c3)n2)C1	ZINC000585177419	345009058	/nfs/dbraw/zinc/00/90/58/345009058.db2.gz	HAXGOSBMMNFPLA-GFCCVEGCSA-N	1	1	271.368	2.455	40	0		CEABMO
CNc1cc([C@H]2CCC[N@@H+](Cc3ccccn3)C2)ccn1	ZINC000585181503	345009227	/nfs/dbraw/zinc/00/92/27/345009227.db2.gz	UBORTOUMFMUNRX-HNNXBMFYSA-N	1	1	282.391	2.320	40	0		CEABMO
Cc1n[nH]cc1C[N@H+]1CC[C@H](Cc2ccccc2)[C@@H](O)C1	ZINC000585278838	345010060	/nfs/dbraw/zinc/01/00/60/345010060.db2.gz	HJDNJVMBIFAZFY-WBVHZDCISA-N	1	1	285.391	2.144	40	0		CEABMO
CC[N@H+]1CCN[C@@H](c2ccc(Br)cc2)C1	ZINC000056894791	362564707	/nfs/dbraw/zinc/56/47/07/362564707.db2.gz	XEEGRBYLTRRLJW-GFCCVEGCSA-N	1	1	269.186	2.415	40	0		CEABMO
CCN1CC[NH2+][C@@H](c2ccc(Br)cc2)C1	ZINC000056894791	362564712	/nfs/dbraw/zinc/56/47/12/362564712.db2.gz	XEEGRBYLTRRLJW-GFCCVEGCSA-N	1	1	269.186	2.415	40	0		CEABMO
c1ccc(N2CC[NH+](Cn3nnc4ccccc43)CC2)cc1	ZINC000057598563	362587567	/nfs/dbraw/zinc/58/75/67/362587567.db2.gz	RLRNLCTUUYVLCA-UHFFFAOYSA-N	1	1	293.374	2.211	40	0		CEABMO
CC(C)(C)OC(=O)N[C@H]1CC[N@@H+](CC2CCOCC2)C1	ZINC000067801307	362925901	/nfs/dbraw/zinc/92/59/01/362925901.db2.gz	BCTFNJAAWPWZKN-ZDUSSCGKSA-N	1	1	284.400	2.012	40	0		CEABMO
O=C(c1cscn1)N1C[C@H]2C[N@H+](Cc3ccccc3)[C@@H]2C1	ZINC000107249453	186164231	/nfs/dbraw/zinc/16/42/31/186164231.db2.gz	KNCIKAUEZBWCAT-UKRRQHHQSA-N	1	1	299.399	2.100	40	0		CEABMO
O=C(c1cscn1)N1C[C@H]2C[N@@H+](Cc3ccccc3)[C@@H]2C1	ZINC000107249453	186164232	/nfs/dbraw/zinc/16/42/32/186164232.db2.gz	KNCIKAUEZBWCAT-UKRRQHHQSA-N	1	1	299.399	2.100	40	0		CEABMO
CNC(=O)[C@H]1CCC[C@]12CC[N@@H+](Cc1cccs1)C2	ZINC000108534964	186222698	/nfs/dbraw/zinc/22/26/98/186222698.db2.gz	GHRGYHOTMDJJIQ-UKRRQHHQSA-N	1	1	278.421	2.486	40	0		CEABMO
C[C@@H](NC(=O)[C@@H]1CCC[N@@H+](C)C1)c1ccc(F)cc1	ZINC000081229409	363706824	/nfs/dbraw/zinc/70/68/24/363706824.db2.gz	NFDYWPSMUKIVND-DGCLKSJQSA-N	1	1	264.344	2.345	40	0		CEABMO
N[C@H](CC[C@@H]([NH3+])C(=O)c1ccccc1)C(=O)c1ccccc1	ZINC000001608371	361211398	/nfs/dbraw/zinc/21/13/98/361211398.db2.gz	NXDLNLVUCIDRBX-HZPDHXFCSA-N	1	1	296.370	2.187	40	0		CEABMO
Oc1ccc(CNCCC[NH2+]Cc2ccc(O)cc2)cc1	ZINC000001723549	361219679	/nfs/dbraw/zinc/21/96/79/361219679.db2.gz	VLFRFJKKUOCSSX-UHFFFAOYSA-N	1	1	286.375	2.367	40	0		CEABMO
Cc1ccccc1N1C(=O)C[C@@H]([NH+]2CCCCC2)C1=O	ZINC000004615347	361324630	/nfs/dbraw/zinc/32/46/30/361324630.db2.gz	MNGDRNWHDBNCGN-CQSZACIVSA-N	1	1	272.348	2.113	40	0		CEABMO
CC[NH+]1CCN(C(=O)Cc2coc3cc(C)ccc23)CC1	ZINC000027587532	361656438	/nfs/dbraw/zinc/65/64/38/361656438.db2.gz	FYNYYJFQNYKNNP-UHFFFAOYSA-N	1	1	286.375	2.448	40	0		CEABMO
COCCNC(=O)c1ccc(C[N@H+]2CCC[C@H](C)C2)cc1	ZINC000030752131	361702832	/nfs/dbraw/zinc/70/28/32/361702832.db2.gz	IPGVFHXILRSASR-AWEZNQCLSA-N	1	1	290.407	2.295	40	0		CEABMO
O[C@@H]1CC[N@@H+](Cc2cccc(F)c2)[C@H]1Cc1cccnc1	ZINC000096200126	364408244	/nfs/dbraw/zinc/40/82/44/364408244.db2.gz	QJGNHSCRXUDRHG-DLBZAZTESA-N	1	1	286.350	2.399	40	0		CEABMO
CC(C)C[N@H+]1CC[C@]2(CCN(Cc3ccccn3)C2=O)C1	ZINC000096159486	364403302	/nfs/dbraw/zinc/40/33/02/364403302.db2.gz	BABSSZUTTLNUPW-KRWDZBQOSA-N	1	1	287.407	2.162	40	0		CEABMO
c1cc(C[N@@H+]2CC[C@]3(C[C@@H](OCC4CC4)CO3)C2)co1	ZINC000096208587	364410182	/nfs/dbraw/zinc/41/01/82/364410182.db2.gz	FBMZXZRPQRSTHG-CVEARBPZSA-N	1	1	277.364	2.440	40	0		CEABMO
CC(=O)N1CCC[C@]2(CC[N@@H+](Cc3cccc(C)n3)C2)C1	ZINC000096216305	364413470	/nfs/dbraw/zinc/41/34/70/364413470.db2.gz	NKGYHDOIQSNUGZ-QGZVFWFLSA-N	1	1	287.407	2.224	40	0		CEABMO
O=C1C[C@]2(CC[N@@H+](Cc3ccco3)C2)CN1c1cccnc1	ZINC000096239105	364416816	/nfs/dbraw/zinc/41/68/16/364416816.db2.gz	NEXDJRZXDKLQQD-KRWDZBQOSA-N	1	1	297.358	2.304	40	0		CEABMO
CC(=O)N1C[C@H]2CCC[N@@H+](Cc3ccc(C)o3)[C@H]2C1	ZINC000096246250	364417202	/nfs/dbraw/zinc/41/72/02/364417202.db2.gz	OJCBXZGZDVSPGS-HIFRSBDPSA-N	1	1	262.353	2.031	40	0		CEABMO
CC(C)[N@H+]1C[C@@H]2CCN(Cc3ccccc3)C(=O)[C@]2(F)C1	ZINC000096261733	364417837	/nfs/dbraw/zinc/41/78/37/364417837.db2.gz	BZJQUFUZGCOTRI-RDJZCZTQSA-N	1	1	290.382	2.467	40	0		CEABMO
c1coc(C[N@@H+]2CC[C@@H]3OCCN(CC4CC4)[C@H]3CC2)c1	ZINC000107254924	364709445	/nfs/dbraw/zinc/70/94/45/364709445.db2.gz	OXKNUNVMFCNJIV-IRXDYDNUSA-N	1	1	290.407	2.355	40	0		CEABMO
c1coc(CN2CC[C@@H]3OCC[N@@H+](CC4CC4)[C@H]3CC2)c1	ZINC000107254924	364709451	/nfs/dbraw/zinc/70/94/51/364709451.db2.gz	OXKNUNVMFCNJIV-IRXDYDNUSA-N	1	1	290.407	2.355	40	0		CEABMO
c1coc(CN2CC[C@@H]3OCC[N@H+](CC4CC4)[C@H]3CC2)c1	ZINC000107254924	364709458	/nfs/dbraw/zinc/70/94/58/364709458.db2.gz	OXKNUNVMFCNJIV-IRXDYDNUSA-N	1	1	290.407	2.355	40	0		CEABMO
Cc1ncc(C[N@@H+]2CCC[C@]3(CN(C(C)C)C3=O)C2)s1	ZINC000585099344	367177415	/nfs/dbraw/zinc/17/74/15/367177415.db2.gz	GMCPPCJXYPUDSE-OAHLLOKOSA-N	1	1	293.436	2.284	40	0		CEABMO
Cn1ccc(C(=O)N2CCC[C@@]23CCC[N@@H+](C)CC3)c1	ZINC000585100057	367177478	/nfs/dbraw/zinc/17/74/78/367177478.db2.gz	DLARTBVCBMKICX-MRXNPFEDSA-N	1	1	275.396	2.116	40	0		CEABMO
CNC(=O)C1CC[NH+](Cc2ccc(Cl)cc2F)CC1	ZINC000188945666	369432928	/nfs/dbraw/zinc/43/29/28/369432928.db2.gz	XLNCJVAEIPZNOS-UHFFFAOYSA-N	1	1	284.762	2.437	40	0		CEABMO
CCO[C@H]1CSC2(C[NH+](Cc3ccncc3)C2)C1	ZINC000253383260	371513249	/nfs/dbraw/zinc/51/32/49/371513249.db2.gz	KYGZPSJIQBBALY-CYBMUJFWSA-N	1	1	264.394	2.178	40	0		CEABMO
COc1ccc2c3c1O[C@@H]1C=CC=C4[C@@H](C2)[N@@H+](C)CC[C@@]341	ZINC000253505392	371525694	/nfs/dbraw/zinc/52/56/94/371525694.db2.gz	UYDXNVYSAYJCMN-DDUZABMNSA-N	1	1	281.355	2.450	40	0	biogenic,in-vitro	CEABMO
CC(C)Cn1nccc1C[NH2+]Cc1ccnn1C(F)F	ZINC000256050696	190003267	/nfs/dbraw/zinc/00/32/67/190003267.db2.gz	GEAZAOKQHJYHKZ-UHFFFAOYSA-N	1	1	283.326	2.421	40	0		CEABMO
CCn1ncc(C)c1C[NH2+]Cc1ccnn1C(F)F	ZINC000256051193	190003502	/nfs/dbraw/zinc/00/35/02/190003502.db2.gz	ICCXURHGKYZARD-UHFFFAOYSA-N	1	1	269.299	2.093	40	0		CEABMO
CCCn1nccc1C[NH2+]Cc1cc(C(C)C)nn1C	ZINC000256051689	190003971	/nfs/dbraw/zinc/00/39/71/190003971.db2.gz	KDZXJLHILIMBIK-UHFFFAOYSA-N	1	1	275.400	2.440	40	0		CEABMO
CCCn1cc(C[N@H+]2CC[C@H](c3cc[nH]n3)C2)cn1	ZINC000257214043	190012839	/nfs/dbraw/zinc/01/28/39/190012839.db2.gz	CKGUYASJBXCIDJ-ZDUSSCGKSA-N	1	1	259.357	2.006	40	0		CEABMO
Cc1c[nH]nc1[C@@H]1CC[N@@H+](CC2(O)CCCCC2)C1	ZINC000257224326	190015684	/nfs/dbraw/zinc/01/56/84/190015684.db2.gz	FBIHYVSXXWNNTC-CYBMUJFWSA-N	1	1	263.385	2.203	40	0		CEABMO
c1ccc(CC[N@H+]2CCOC[C@H](Cc3ncccn3)C2)cc1	ZINC000257230187	190015896	/nfs/dbraw/zinc/01/58/96/190015896.db2.gz	GBFIMVOBWJOLCP-QGZVFWFLSA-N	1	1	297.402	2.210	40	0		CEABMO
CCn1nccc1-c1cc(C[C@H]2CC[N@@H+](C)C2)ccn1	ZINC000257223049	190014356	/nfs/dbraw/zinc/01/43/56/190014356.db2.gz	DVRSHAMTSVBAIB-CQSZACIVSA-N	1	1	270.380	2.459	40	0		CEABMO
CCOc1ccccc1C[N@H+]1CC[C@H](O)[C@]2(CCCO2)C1	ZINC000257239522	190018114	/nfs/dbraw/zinc/01/81/14/190018114.db2.gz	HPSSUAJBDIWEOC-IRXDYDNUSA-N	1	1	291.391	2.201	40	0		CEABMO
CO[C@H]1C[N@@H+](Cc2cncc(C)c2)CC[C@@]12CCCO2	ZINC000257271595	190023748	/nfs/dbraw/zinc/02/37/48/190023748.db2.gz	MYYQDJQWMXEYJU-HOTGVXAUSA-N	1	1	276.380	2.160	40	0		CEABMO
CNc1cc([C@H]2CCC[N@@H+](Cc3cncn3C)C2)ccn1	ZINC000257268921	190024022	/nfs/dbraw/zinc/02/40/22/190024022.db2.gz	MNUPAMOMPBUFKL-AWEZNQCLSA-N	1	1	285.395	2.236	40	0		CEABMO
CNc1ncccc1C[N@H+]1CCC[C@@H](c2ccncn2)C1	ZINC000257281402	190026215	/nfs/dbraw/zinc/02/62/15/190026215.db2.gz	OOZUPSRKNYMKON-CYBMUJFWSA-N	1	1	283.379	2.293	40	0		CEABMO
Cc1nc([C@@H]2CCCC[NH2+]2)ncc1C(=O)N1CCCCC1	ZINC000257338266	190036173	/nfs/dbraw/zinc/03/61/73/190036173.db2.gz	YWRRBGJLSJUSAA-AWEZNQCLSA-N	1	1	288.395	2.226	40	0		CEABMO
c1ccn(C[C@H]2CC[C@@H]3[C@@H]2OCC[N@@H+]3Cc2ccc[nH]2)c1	ZINC000096250199	256834553	/nfs/dbraw/zinc/83/45/53/256834553.db2.gz	UDUCYYMVLBHZHH-DJIMGWMZSA-N	1	1	285.391	2.496	40	0		CEABMO
c1ccn(C[C@H]2CC[C@@H]3[C@@H]2OCC[N@H+]3Cc2ccc[nH]2)c1	ZINC000096250199	256834555	/nfs/dbraw/zinc/83/45/55/256834555.db2.gz	UDUCYYMVLBHZHH-DJIMGWMZSA-N	1	1	285.391	2.496	40	0		CEABMO
CC[N@H+]1CCC[C@H]1c1cccnc1N1CCOCC1	ZINC000072216214	394593600	/nfs/dbraw/zinc/59/36/00/394593600.db2.gz	FGXWEXFSRCNSDW-AWEZNQCLSA-N	1	1	261.369	2.075	40	0		CEABMO
C[N@H+]1C[C@@H]2CN(C3CCCCC3)CCN2C(C)(C)C1	ZINC000253400856	394577778	/nfs/dbraw/zinc/57/77/78/394577778.db2.gz	MBIZTNAYXGLTLO-OAHLLOKOSA-N	1	1	265.445	2.029	40	0	biogenic,in-vitro	CEABMO
COc1cccc([C@H]2[C@H]([NH3+])C(=O)N2c2cccc(OC)c2)c1	ZINC000072227739	394596283	/nfs/dbraw/zinc/59/62/83/394596283.db2.gz	AHZUWXRMCSFCAV-HOTGVXAUSA-N	1	1	298.342	2.119	40	0		CEABMO
COc1ccc([C@H]2[C@@H]([NH3+])C(=O)N2c2cccc(F)c2)cc1	ZINC000072227613	394596552	/nfs/dbraw/zinc/59/65/52/394596552.db2.gz	IWLCLUMGVIPJOY-CABCVRRESA-N	1	1	286.306	2.250	40	0		CEABMO
Cc1ccc([C@H]2[C@H]([NH3+])C(=O)N2Cc2ccccc2)cc1	ZINC000072228119	394596718	/nfs/dbraw/zinc/59/67/18/394596718.db2.gz	SZTPIZQQBNMZEM-HOTGVXAUSA-N	1	1	266.344	2.406	40	0		CEABMO
C[N@@H+](Cc1ccccc1)[C@H]1CC[C@H]([NH2+]CC(=O)[O-])CC1	ZINC000242649218	400315409	/nfs/dbraw/zinc/31/54/09/400315409.db2.gz	RWTUSEAGUBNKIB-SHTZXODSSA-N	1	1	276.380	2.104	40	0		CEABMO
CC(=O)N1CC[N@@H+](CC2CC2)C[C@H]1c1ccccc1	ZINC000257229492	400317361	/nfs/dbraw/zinc/31/73/61/400317361.db2.gz	FYIAFFBDGYHKBN-INIZCTEOSA-N	1	1	258.365	2.302	40	0		CEABMO
COc1ccc2c(c1)CC[C@@H]([N@H+]1CCC[C@H](O)C1)C2	ZINC000004792360	170017701	/nfs/dbraw/zinc/01/77/01/170017701.db2.gz	UCSWLBFIWMGEFO-CABCVRRESA-N	1	1	261.365	2.009	40	0		CEABMO
Cc1[nH+]ccn1Cc1ccc(C(=O)NC[C@@H]2CCCO2)cc1	ZINC000038849108	174157845	/nfs/dbraw/zinc/15/78/45/174157845.db2.gz	SQWNPNKWMFFRSG-INIZCTEOSA-N	1	1	299.374	2.149	40	0		CEABMO
O=C1NCC[NH2+][C@H]1Cc1cccc(-c2cccc(F)c2)c1	ZINC000072352840	176374436	/nfs/dbraw/zinc/37/44/36/176374436.db2.gz	RSVDAKHVGAUUIH-INIZCTEOSA-N	1	1	284.334	2.123	40	0		CEABMO
COCC[N@H+]1CCC[C@@H](c2cccc(-n3ccnc3)n2)C1	ZINC000072355537	176374982	/nfs/dbraw/zinc/37/49/82/176374982.db2.gz	FEMVDCIXKLACHN-CQSZACIVSA-N	1	1	286.379	2.093	40	0		CEABMO
Nc1nccc([C@@H]2CCCC[N@@H+]2Cc2ccncc2)n1	ZINC000072385031	176389341	/nfs/dbraw/zinc/38/93/41/176389341.db2.gz	INPYOAXAKFBOBX-AWEZNQCLSA-N	1	1	269.352	2.181	40	0		CEABMO
Nc1nccc([C@@H]2CCCC[N@H+]2Cc2ccncc2)n1	ZINC000072385031	176389342	/nfs/dbraw/zinc/38/93/42/176389342.db2.gz	INPYOAXAKFBOBX-AWEZNQCLSA-N	1	1	269.352	2.181	40	0		CEABMO
Cc1nc(N)cc([C@@H]2C[N@@H+](C3CCCCC3)CCO2)n1	ZINC000072387729	176392559	/nfs/dbraw/zinc/39/25/59/176392559.db2.gz	KDEYUIXGHMDHOJ-AWEZNQCLSA-N	1	1	276.384	2.073	40	0		CEABMO
Cc1nc(N)cc([C@@H]2C[N@H+](C3CCCCC3)CCO2)n1	ZINC000072387729	176392560	/nfs/dbraw/zinc/39/25/60/176392560.db2.gz	KDEYUIXGHMDHOJ-AWEZNQCLSA-N	1	1	276.384	2.073	40	0		CEABMO
Cc1nc(N)cc([C@@H]2CC[N@@H+]2CCOc2ccccc2)n1	ZINC000072387605	176392883	/nfs/dbraw/zinc/39/28/83/176392883.db2.gz	HXTSQTOUUXSTOX-HNNXBMFYSA-N	1	1	284.363	2.193	40	0		CEABMO
Cc1nc(N)cc([C@@H]2CC[N@H+]2CCOc2ccccc2)n1	ZINC000072387605	176392884	/nfs/dbraw/zinc/39/28/84/176392884.db2.gz	HXTSQTOUUXSTOX-HNNXBMFYSA-N	1	1	284.363	2.193	40	0		CEABMO
COc1cccc(CN2C[C@@H]3CCC[N@H+]3C[C@@H]2C)c1OC	ZINC000072397521	176395076	/nfs/dbraw/zinc/39/50/76/176395076.db2.gz	JKVMYIBCSWDHCB-ZFWWWQNUSA-N	1	1	290.407	2.372	40	0		CEABMO
CSc1ccc(CN2C[C@H]3C[C@@H](O)C[N@H+]3C[C@H]2C)cc1	ZINC000072397666	176395190	/nfs/dbraw/zinc/39/51/90/176395190.db2.gz	QERHHOFNCGADLU-BPLDGKMQSA-N	1	1	292.448	2.048	40	0		CEABMO
C[C@@H](CO)Nc1nc(N2CCc3ccccc3[C@@H]2C)cc[nH+]1	ZINC000328982540	274228999	/nfs/dbraw/zinc/22/89/99/274228999.db2.gz	HBKRCAADMVSRQT-STQMWFEESA-N	1	1	298.390	2.393	40	0		CEABMO
Cc1cc(N(C)C)nc([C@@H]2CCC[N@H+]2C2CCOCC2)n1	ZINC000072364358	301329397	/nfs/dbraw/zinc/32/93/97/301329397.db2.gz	AKEKKBRYTSKRMT-AWEZNQCLSA-N	1	1	290.411	2.167	40	0		CEABMO
NC[C@@H]([NH3+])c1cc(Br)cc(Br)c1	ZINC000044472003	327134519	/nfs/dbraw/zinc/13/45/19/327134519.db2.gz	SSQNWRFNXOLVKK-MRVPVSSYSA-N	1	1	293.990	2.170	40	0		CEABMO
CCOc1ccc([C@H]([NH3+])c2nnc(CC)[nH]2)cc1OCC	ZINC000095534587	185007639	/nfs/dbraw/zinc/00/76/39/185007639.db2.gz	QKLUCSIKRFULLQ-AWEZNQCLSA-N	1	1	290.367	2.213	40	0		CEABMO
Cc1nnc([C@H]2C[C@@H]3CC[N@@H+](Cc4ccco4)C[C@H]3O2)[nH]1	ZINC000096046195	185071903	/nfs/dbraw/zinc/07/19/03/185071903.db2.gz	XQSMOLLNMJQKBD-IACUBPJLSA-N	1	1	288.351	2.058	40	0		CEABMO
c1cn([C@@H]2CO[C@@]3(C2)CCC[N@H+](Cc2ccoc2)C3)cn1	ZINC000096048549	185072376	/nfs/dbraw/zinc/07/23/76/185072376.db2.gz	RHHJWYHNAPOFFG-JKSUJKDBSA-N	1	1	287.363	2.472	40	0		CEABMO
O=C1N(Cc2cccnc2)CC[C@]12CCC[N@@H+](CC1CC1)C2	ZINC000096048646	185073447	/nfs/dbraw/zinc/07/34/47/185073447.db2.gz	KUYRFVVJNHWPHP-SFHVURJKSA-N	1	1	299.418	2.306	40	0		CEABMO
c1cncc(C[NH+]2C[C@@H]3CN(Cc4ccncc4)C[C@H]3C2)c1	ZINC000096053745	185074941	/nfs/dbraw/zinc/07/49/41/185074941.db2.gz	GEEIIYLNXYZEPQ-ROUUACIJSA-N	1	1	294.402	2.040	40	0		CEABMO
c1coc(CN2C[C@H]3C[NH+](Cc4ccccn4)C[C@@H]3C2)c1	ZINC000096053778	185074996	/nfs/dbraw/zinc/07/49/96/185074996.db2.gz	JEGHGWHLFFTGSN-HUUCEWRRSA-N	1	1	283.375	2.238	40	0		CEABMO
Cn1cnc2c1[C@@H](COCC1CC1)C[N@@H+](CC1CC1)C2	ZINC000096060251	185081720	/nfs/dbraw/zinc/08/17/20/185081720.db2.gz	ISTQBXCUGMWNDR-CQSZACIVSA-N	1	1	275.396	2.156	40	0		CEABMO
O=C(c1cccc(F)c1)N1C[C@H]2C[C@@H](C1)[N@@H+](CC1CC1)C2	ZINC000096058505	185078594	/nfs/dbraw/zinc/07/85/94/185078594.db2.gz	LQBNBDNKRDTJKI-BBRMVZONSA-N	1	1	288.366	2.382	40	0		CEABMO
COC[C@H]1C[N@H+](Cc2ccsc2)Cc2cnn(C)c21	ZINC000096060006	185080059	/nfs/dbraw/zinc/08/00/59/185080059.db2.gz	QSYPAZNVGBFQFQ-CYBMUJFWSA-N	1	1	277.393	2.227	40	0		CEABMO
COC[C@H]1C[N@@H+](Cc2ccsc2)Cc2cnn(C)c21	ZINC000096060006	185080061	/nfs/dbraw/zinc/08/00/61/185080061.db2.gz	QSYPAZNVGBFQFQ-CYBMUJFWSA-N	1	1	277.393	2.227	40	0		CEABMO
O[C@@H]1CC[N@@H+](Cc2ccoc2)[C@H]1Cc1ccccc1	ZINC000096061555	185082382	/nfs/dbraw/zinc/08/23/82/185082382.db2.gz	GIRNUCOHFXCUFY-JKSUJKDBSA-N	1	1	257.333	2.458	40	0		CEABMO
CCOC(=O)c1cccc(NC(=O)[C@H]2CCC[N@@H+](C)C2)c1	ZINC000096629295	185108280	/nfs/dbraw/zinc/10/82/80/185108280.db2.gz	ZBDYBEQJLPNGRN-ZDUSSCGKSA-N	1	1	290.363	2.144	40	0		CEABMO
Nc1cc[nH+]c2c(I)cccc12	ZINC000039221583	361987590	/nfs/dbraw/zinc/98/75/90/361987590.db2.gz	OFTBYPABMHHZAK-UHFFFAOYSA-N	1	1	270.073	2.422	40	0		CEABMO
Cc1nc(NCCCO)cc(N2CCc3ccccc3C2)[nH+]1	ZINC000328958530	136377234	/nfs/dbraw/zinc/37/72/34/136377234.db2.gz	APUPBCUBWYNYFX-UHFFFAOYSA-N	1	1	298.390	2.142	40	0		CEABMO
CCOC(=O)c1ccccc1Nc1cc(N)[nH+]c(C)n1	ZINC000049467318	362364311	/nfs/dbraw/zinc/36/43/11/362364311.db2.gz	RWCQNBUJCQCUBR-UHFFFAOYSA-N	1	1	272.308	2.288	40	0		CEABMO
OC[C@H]1CC[N@H+](Cc2ccc(F)c(Br)c2)C1	ZINC000051887060	362444318	/nfs/dbraw/zinc/44/43/18/362444318.db2.gz	FUUDHQFVPQYWMY-JTQLQIEISA-N	1	1	288.160	2.402	40	0		CEABMO
OC[C@H]1CC[N@@H+](Cc2ccc(F)c(Br)c2)C1	ZINC000051887060	362444321	/nfs/dbraw/zinc/44/43/21/362444321.db2.gz	FUUDHQFVPQYWMY-JTQLQIEISA-N	1	1	288.160	2.402	40	0		CEABMO
CN(C(=O)OC(C)(C)C)[C@@H](C(=[NH2+])NO)c1ccco1	ZINC000409438423	344889766	/nfs/dbraw/zinc/88/97/66/344889766.db2.gz	CODPRFCTOXCOBP-SECBINFHSA-N	1	1	269.301	2.144	40	0		CEABMO
[NH3+]Cc1noc([C@@H](c2cccs2)n2cccc2)n1	ZINC000409441241	344889833	/nfs/dbraw/zinc/88/98/33/344889833.db2.gz	OFYIPMCWVZGULK-LLVKDONJSA-N	1	1	260.322	2.029	40	0		CEABMO
Cc1cccc(C[N@H+]2CC[C@@](O)(COc3ccccc3)C2)n1	ZINC000585269496	345009065	/nfs/dbraw/zinc/00/90/65/345009065.db2.gz	XBVGIURQBUGSKZ-SFHVURJKSA-N	1	1	298.386	2.406	40	0		CEABMO
O[C@@]1(COc2ccccc2)CC[N@@H+](Cc2ccccn2)C1	ZINC000585269477	345009104	/nfs/dbraw/zinc/00/91/04/345009104.db2.gz	VZLLOUVYYQXOKJ-KRWDZBQOSA-N	1	1	284.359	2.097	40	0		CEABMO
Cc1ccccc1[C@H]1C[N@@H+](CC(C)(C)C)[C@H](CO)[C@@H]1O	ZINC000585295158	345010400	/nfs/dbraw/zinc/01/04/00/345010400.db2.gz	NOYRWCUEDLNFCO-BZUAXINKSA-N	1	1	277.408	2.162	40	0		CEABMO
CC[N@H+]1C[C@H]2CCC[C@]3(C1)C(=O)NC1(CCCCC1)N=C23	ZINC000000519327	361182743	/nfs/dbraw/zinc/18/27/43/361182743.db2.gz	ICFQVBLKMFUCBQ-CZUORRHYSA-N	1	1	289.423	2.340	40	0		CEABMO
Cc1cccc(OC[C@@H](O)C[N@@H+]2CCC[C@H](C)C2)c1	ZINC000004276562	361309293	/nfs/dbraw/zinc/30/92/93/361309293.db2.gz	SVKRAUOKQPVBIT-GJZGRUSLSA-N	1	1	263.381	2.467	40	0		CEABMO
CC(C)[NH+](Cc1c(O)nc2ccccn2c1=O)C(C)C	ZINC000016575384	361490631	/nfs/dbraw/zinc/49/06/31/361490631.db2.gz	WZHFFOCBUADZRK-UHFFFAOYSA-N	1	1	275.352	2.019	40	0		CEABMO
COc1ccc(C[NH2+]Cc2nc3ccccc3c(=O)[nH]2)cc1	ZINC000019555891	361543967	/nfs/dbraw/zinc/54/39/67/361543967.db2.gz	DANXOXZZNPGNAE-UHFFFAOYSA-N	1	1	295.342	2.222	40	0		CEABMO
CC(C)[N@@H+]1C[C@H]2CN(C(=O)c3cccs3)C[C@H]2C1	ZINC000096182228	364406160	/nfs/dbraw/zinc/40/61/60/364406160.db2.gz	OAVOKHXKQIUEEB-TXEJJXNPSA-N	1	1	264.394	2.160	40	0		CEABMO
CC(C)C[N@H+]1CC[C@@H]2[C@@H]1CCN2Cc1ccncc1	ZINC000096184274	364407500	/nfs/dbraw/zinc/40/75/00/364407500.db2.gz	ZDVPNWSUZLZKLE-JKSUJKDBSA-N	1	1	259.397	2.386	40	0		CEABMO
COC[C@@H]1C[N@H+](Cc2cccs2)Cc2cn(C)nc21	ZINC000096197961	364409060	/nfs/dbraw/zinc/40/90/60/364409060.db2.gz	FTYOOUNQYDQSDG-LBPRGKRZSA-N	1	1	277.393	2.227	40	0		CEABMO
COC[C@@H]1C[N@@H+](Cc2cccs2)Cc2cn(C)nc21	ZINC000096197961	364409063	/nfs/dbraw/zinc/40/90/63/364409063.db2.gz	FTYOOUNQYDQSDG-LBPRGKRZSA-N	1	1	277.393	2.227	40	0		CEABMO
Cn1cc(C[N@@H+]2CCC3(CN(Cc4ccccc4)C3)C2)cn1	ZINC000096202672	364410819	/nfs/dbraw/zinc/41/08/19/364410819.db2.gz	POMZRLBVMDVZKP-UHFFFAOYSA-N	1	1	296.418	2.128	40	0		CEABMO
Cn1cc(C[N@H+]2CCC3(CN(Cc4ccccc4)C3)C2)cn1	ZINC000096202672	364410827	/nfs/dbraw/zinc/41/08/27/364410827.db2.gz	POMZRLBVMDVZKP-UHFFFAOYSA-N	1	1	296.418	2.128	40	0		CEABMO
O[C@H]1CC[N@@H+](Cc2ccsc2)[C@H]1Cc1cccnc1	ZINC000096200432	364411144	/nfs/dbraw/zinc/41/11/44/364411144.db2.gz	JHKJUWKWRPYCAI-GJZGRUSLSA-N	1	1	274.389	2.321	40	0		CEABMO
c1ccc(N2CCC[C@]3(CC[N@H+]([C@@H]4CCOC4)C3)C2)nc1	ZINC000096216792	364413434	/nfs/dbraw/zinc/41/34/34/364413434.db2.gz	XHXQCHGEJUTSKP-NVXWUHKLSA-N	1	1	287.407	2.163	40	0		CEABMO
CO[C@@H]1Cn2cccc2C[N@H+](Cc2cccc(C)n2)C1	ZINC000247901444	371145370	/nfs/dbraw/zinc/14/53/70/371145370.db2.gz	ZAHMXYYEOWUDBL-INIZCTEOSA-N	1	1	271.364	2.222	40	0		CEABMO
CO[C@@H]1Cn2cccc2C[N@@H+](Cc2cccc(C)n2)C1	ZINC000247901444	371145375	/nfs/dbraw/zinc/14/53/75/371145375.db2.gz	ZAHMXYYEOWUDBL-INIZCTEOSA-N	1	1	271.364	2.222	40	0		CEABMO
COc1ccccc1C[NH2+]Cc1ccnn1CCF	ZINC000256055012	190005315	/nfs/dbraw/zinc/00/53/15/190005315.db2.gz	YUKZSGOACNCEJR-UHFFFAOYSA-N	1	1	263.316	2.151	40	0		CEABMO
CCCn1nc(C)cc1C[NH2+]Cc1ccnn1CC	ZINC000256050524	190003277	/nfs/dbraw/zinc/00/32/77/190003277.db2.gz	FIYLSAJDCBNFAA-UHFFFAOYSA-N	1	1	261.373	2.108	40	0		CEABMO
Cn1cncc1C[NH+]1CC2(C1)CO[C@@H](Cc1ccccc1)C2	ZINC000257207770	190012274	/nfs/dbraw/zinc/01/22/74/190012274.db2.gz	BJDPCUGQVUZLBV-KRWDZBQOSA-N	1	1	297.402	2.254	40	0		CEABMO
CCCn1cc(C[N@H+]2CC[C@@H](c3cc[nH]n3)C2)cn1	ZINC000257214042	190012872	/nfs/dbraw/zinc/01/28/72/190012872.db2.gz	CKGUYASJBXCIDJ-CYBMUJFWSA-N	1	1	259.357	2.006	40	0		CEABMO
c1c[nH]c(C[N@@H+]2CCC[C@H](c3ccc4c[nH]nc4n3)C2)n1	ZINC000257229495	190016452	/nfs/dbraw/zinc/01/64/52/190016452.db2.gz	FYIKORUXSIHQOH-LBPRGKRZSA-N	1	1	282.351	2.061	40	0		CEABMO
c1c[nH]c(C[N@H+]2CCC[C@H](c3ccc4c[nH]nc4n3)C2)n1	ZINC000257229495	190016453	/nfs/dbraw/zinc/01/64/53/190016453.db2.gz	FYIKORUXSIHQOH-LBPRGKRZSA-N	1	1	282.351	2.061	40	0		CEABMO
CN(C)Cc1ccnc([C@H]2CCC[N@H+]2CC2CC2)n1	ZINC000257228676	190016535	/nfs/dbraw/zinc/01/65/35/190016535.db2.gz	FUVAHSUXRXKFDR-CQSZACIVSA-N	1	1	260.385	2.085	40	0		CEABMO
CNc1cc([C@@H]2CCC[N@H+]2Cc2[nH]cnc2C)ccn1	ZINC000257231989	190017236	/nfs/dbraw/zinc/01/72/36/190017236.db2.gz	GIXUGJDOBGBFQL-AWEZNQCLSA-N	1	1	271.368	2.492	40	0		CEABMO
C[C@]1(O)C[N@@H+](Cc2ccncc2)CC[C@@H]1Oc1ccccc1	ZINC000257259825	190022674	/nfs/dbraw/zinc/02/26/74/190022674.db2.gz	LAFGVYXNQQRGGW-ROUUACIJSA-N	1	1	298.386	2.486	40	0		CEABMO
CNc1cc([C@@H]2CCC[N@H+]2C2CCN(C)CC2)ccn1	ZINC000257288059	190026862	/nfs/dbraw/zinc/02/68/62/190026862.db2.gz	PSQFEDQOAPGJOK-HNNXBMFYSA-N	1	1	274.412	2.354	40	0		CEABMO
Cc1nccc(CN2CC[N@H+](C)[C@H](c3ccccc3)C2)n1	ZINC000257284915	190026986	/nfs/dbraw/zinc/02/69/86/190026986.db2.gz	PEVKAHAWXKZGSN-KRWDZBQOSA-N	1	1	282.391	2.274	40	0		CEABMO
CNC(=O)[C@]1(C)C[N@@H+](Cc2ccc3ccccc3c2)CCO1	ZINC000257301884	190030464	/nfs/dbraw/zinc/03/04/64/190030464.db2.gz	SAJQHKPIUJAOEB-SFHVURJKSA-N	1	1	298.386	2.177	40	0		CEABMO
CCC[N@H+]1C[C@@H]2CC[C@@]3(CC(C)=NN3C(C)=O)[C@@H]2C1	ZINC000306134561	376541633	/nfs/dbraw/zinc/54/16/33/376541633.db2.gz	NRUNORKAOHBWII-RRFJBIMHSA-N	1	1	263.385	2.105	40	0		CEABMO
CC(C)[N@H+]1C[C@H]2N(C)C(=O)c3ccccc3C(=O)[C@@]2(C)C1	ZINC000019448641	394468051	/nfs/dbraw/zinc/46/80/51/394468051.db2.gz	HVLSZXJEGDWXPS-PBHICJAKSA-N	1	1	286.375	2.054	40	0		CEABMO
C[N@H+]1CCCC[C@@H]1c1ccc(N2CCOCC2)nc1	ZINC000072216176	394593574	/nfs/dbraw/zinc/59/35/74/394593574.db2.gz	PGFVPJUPXFNDRH-CQSZACIVSA-N	1	1	261.369	2.075	40	0		CEABMO
C[C@H]1CCCC[N@@H+]1c1ccc(N)cc1-n1cnnc1	ZINC000070461815	394587094	/nfs/dbraw/zinc/58/70/94/394587094.db2.gz	FTEFAUKEBHJSLZ-NSHDSACASA-N	1	1	257.341	2.228	40	0		CEABMO
C[C@H]1CCCC[N@H+]1c1ccc(N)cc1-n1cnnc1	ZINC000070461815	394587097	/nfs/dbraw/zinc/58/70/97/394587097.db2.gz	FTEFAUKEBHJSLZ-NSHDSACASA-N	1	1	257.341	2.228	40	0		CEABMO
C[N@H+]1C[C@H](c2ccccc2)[C@H]2CN(Cc3c[nH]cn3)CC[C@H]21	ZINC000257315175	394595392	/nfs/dbraw/zinc/59/53/92/394595392.db2.gz	VAFMSOPWMWQPML-KZNAEPCWSA-N	1	1	296.418	2.329	40	0		CEABMO
C[N@@H+]1C[C@H](c2ccccc2)[C@H]2CN(Cc3cnc[nH]3)CC[C@H]21	ZINC000257315175	394595395	/nfs/dbraw/zinc/59/53/95/394595395.db2.gz	VAFMSOPWMWQPML-KZNAEPCWSA-N	1	1	296.418	2.329	40	0		CEABMO
COc1ccc([C@H]2[C@@H]([NH3+])C(=O)N2c2ccc(OC)cc2)cc1	ZINC000072227129	394595510	/nfs/dbraw/zinc/59/55/10/394595510.db2.gz	ODABPKUONBXULF-CVEARBPZSA-N	1	1	298.342	2.119	40	0		CEABMO
CO[C@H]1C[N@H+](Cc2nccn2C(C)C)CC[C@@]12CCCO2	ZINC000257305257	394595658	/nfs/dbraw/zinc/59/56/58/394595658.db2.gz	SPDMYKBJOJLUDF-HOCLYGCPSA-N	1	1	293.411	2.234	40	0		CEABMO
CO[C@H]1C[N@@H+](Cc2nccn2C(C)C)CC[C@@]12CCCO2	ZINC000257305257	394595659	/nfs/dbraw/zinc/59/56/59/394595659.db2.gz	SPDMYKBJOJLUDF-HOCLYGCPSA-N	1	1	293.411	2.234	40	0		CEABMO
Cc1ccc([C@@H]2[C@H]([NH3+])C(=O)N2c2ccc3c(c2)OCO3)cc1	ZINC000072227558	394596734	/nfs/dbraw/zinc/59/67/34/394596734.db2.gz	UQRUKIMKBPJUPX-JKSUJKDBSA-N	1	1	296.326	2.139	40	0		CEABMO
COc1ccc(CN2C[C@H]3CCC[N@H+]3C[C@@H]2C)cc1	ZINC000019575750	286309503	/nfs/dbraw/zinc/30/95/03/286309503.db2.gz	YIBMDJHUYQYHFA-DZGCQCFKSA-N	1	1	260.381	2.364	40	0		CEABMO
O[C@@H]1CC[N@H+](Cc2ccccc2Br)C1	ZINC000038538698	174145555	/nfs/dbraw/zinc/14/55/55/174145555.db2.gz	HVLQYTLXQYMTJA-SNVBAGLBSA-N	1	1	256.143	2.016	40	0		CEABMO
O[C@@H]1CC[N@@H+](Cc2ccccc2Br)C1	ZINC000038538698	174145556	/nfs/dbraw/zinc/14/55/56/174145556.db2.gz	HVLQYTLXQYMTJA-SNVBAGLBSA-N	1	1	256.143	2.016	40	0		CEABMO
CNC(=O)[C@]1(C)CCC[N@@H+](CCc2ccccc2)C1	ZINC000072363745	176378545	/nfs/dbraw/zinc/37/85/45/176378545.db2.gz	QWHWSTJRZRVUHJ-MRXNPFEDSA-N	1	1	260.381	2.077	40	0		CEABMO
Cc1cc(NC2CCOCC2)nc([C@H]2CCC[N@H+](C)C2)n1	ZINC000072365462	176380395	/nfs/dbraw/zinc/38/03/95/176380395.db2.gz	SZONHBDAEGUMNU-ZDUSSCGKSA-N	1	1	290.411	2.185	40	0		CEABMO
CC(=O)N1CCC[C@@H]1c1cccc(-n2cc[nH+]c2C)n1	ZINC000072378538	176385673	/nfs/dbraw/zinc/38/56/73/176385673.db2.gz	GOUGVIWHKQSSTM-CQSZACIVSA-N	1	1	270.336	2.259	40	0		CEABMO
Cc1cncc([C@@H]2CCC[N@H+](C3CCOCC3)C2)n1	ZINC000072385940	176391212	/nfs/dbraw/zinc/39/12/12/176391212.db2.gz	IXRXFQLOFAIQGV-CYBMUJFWSA-N	1	1	261.369	2.143	40	0		CEABMO
C[C@@H]1C[N@H+]2CCC[C@@H]2CN1Cc1coc2ccccc2c1=O	ZINC000072397546	176394814	/nfs/dbraw/zinc/39/48/14/176394814.db2.gz	AUCJMMXJAUJMQV-UKRRQHHQSA-N	1	1	298.386	2.462	40	0		CEABMO
CSc1ccc(CN2C[C@H]3C[C@@H](O)C[N@H+]3C[C@@H]2C)cc1	ZINC000072397602	176394931	/nfs/dbraw/zinc/39/49/31/176394931.db2.gz	QERHHOFNCGADLU-NWANDNLSSA-N	1	1	292.448	2.048	40	0		CEABMO
COc1ccc([C@H]2C[C@H](C)[N@H+]([C@@H]3CCOC3=O)C2)cc1	ZINC000076393312	177014148	/nfs/dbraw/zinc/01/41/48/177014148.db2.gz	MMFOAHXNTPHLHP-CORIIIEPSA-N	1	1	275.348	2.189	40	0		CEABMO
CCOC[C@@H]1Cn2nccc2C[N@H+](Cc2ccco2)C1	ZINC000096059203	276331830	/nfs/dbraw/zinc/33/18/30/276331830.db2.gz	WOSBIYDKAVKJDN-ZDUSSCGKSA-N	1	1	275.352	2.145	40	0		CEABMO
CCOC[C@@H]1Cn2nccc2C[N@@H+](Cc2ccco2)C1	ZINC000096059203	276331832	/nfs/dbraw/zinc/33/18/32/276331832.db2.gz	WOSBIYDKAVKJDN-ZDUSSCGKSA-N	1	1	275.352	2.145	40	0		CEABMO
COc1cc2c(cc1OC)[C@H](c1cc(C)no1)[NH2+]CC2	ZINC000072397745	277856243	/nfs/dbraw/zinc/85/62/43/277856243.db2.gz	SNBHEEXWVLYICK-OAHLLOKOSA-N	1	1	274.320	2.235	40	0		CEABMO
Cc1cc(-c2cc[nH]n2)nc([C@H]2CCCC[N@H+]2C)n1	ZINC000257253107	280284633	/nfs/dbraw/zinc/28/46/33/280284633.db2.gz	JXPHMDWXSOHVKM-CYBMUJFWSA-N	1	1	257.341	2.332	40	0		CEABMO
Cc1cc(-c2cc[nH]n2)nc([C@H]2CCCC[N@@H+]2C)n1	ZINC000257253107	280284636	/nfs/dbraw/zinc/28/46/36/280284636.db2.gz	JXPHMDWXSOHVKM-CYBMUJFWSA-N	1	1	257.341	2.332	40	0		CEABMO
COc1ccc([C@H]([NH3+])c2nc(-c3ccccc3O)n[nH]2)cc1	ZINC000095533654	185006650	/nfs/dbraw/zinc/00/66/50/185006650.db2.gz	SMRMUCQYZOJKSZ-AWEZNQCLSA-N	1	1	296.330	2.234	40	0		CEABMO
Cc1occc1-c1n[nH]c([C@@H]([NH3+])c2ccccc2)n1	ZINC000095533409	185006780	/nfs/dbraw/zinc/00/67/80/185006780.db2.gz	BUSZDKPGFWYYJM-LBPRGKRZSA-N	1	1	254.293	2.421	40	0		CEABMO
c1ccc(CO[C@@H]2CC[C@H]3[C@H]2OCC[N@H+]3CC2CC2)nc1	ZINC000096041829	185070787	/nfs/dbraw/zinc/07/07/87/185070787.db2.gz	AYYQNIQQKXIDSI-GVDBMIGSSA-N	1	1	288.391	2.240	40	0		CEABMO
c1cc(CN2CC3(C2)CC[N@@H+](Cc2ccncc2)C3)co1	ZINC000096046427	185071394	/nfs/dbraw/zinc/07/13/94/185071394.db2.gz	QKLASLDRBAJQMO-UHFFFAOYSA-N	1	1	283.375	2.383	40	0		CEABMO
O=C1CC[C@]2(CCC[N@@H+](Cc3cccs3)CC2)N1	ZINC000096047437	185073182	/nfs/dbraw/zinc/07/31/82/185073182.db2.gz	LPHLDWYPNPQVAS-AWEZNQCLSA-N	1	1	264.394	2.383	40	0		CEABMO
Cc1[nH+]ccn1C[C@@H]1CCCN(c2cc(C)ncn2)C1	ZINC000072368993	282210867	/nfs/dbraw/zinc/21/08/67/282210867.db2.gz	HIMWHMXKJYXREB-AWEZNQCLSA-N	1	1	271.368	2.207	40	0		CEABMO
c1csc([C@H](C2CCOCC2)[NH+]2CCNCC2)c1	ZINC000076703775	343895916	/nfs/dbraw/zinc/89/59/16/343895916.db2.gz	SMTZRGXVQVTDGF-AWEZNQCLSA-N	1	1	266.410	2.121	40	0		CEABMO
Cc1nnc2n1[C@H]1C[N@H+](Cc3cccs3)C[C@H]1CC2	ZINC000019288371	282365639	/nfs/dbraw/zinc/36/56/39/282365639.db2.gz	PQLQAVDKVYSRTE-YPMHNXCESA-N	1	1	274.393	2.267	40	0		CEABMO
Cc1ccc(CN2C[C@@H]3C[N@@H+]([C@H]4CCOC4)C[C@@H]3C2)cc1	ZINC000107196341	186162358	/nfs/dbraw/zinc/16/23/58/186162358.db2.gz	MFMWQNLJODQSEO-KSZLIROESA-N	1	1	286.419	2.148	40	0		CEABMO
COC[C@@]12CCCO[C@@H]1CC[N@H+](Cc1cc(C)on1)C2	ZINC000107711210	186188587	/nfs/dbraw/zinc/18/85/87/186188587.db2.gz	UQCRHJTUBHNXHD-CABCVRRESA-N	1	1	280.368	2.001	40	0		CEABMO
COC[C@@]12CCCO[C@@H]1CC[N@@H+](Cc1cc(C)on1)C2	ZINC000107711210	186188589	/nfs/dbraw/zinc/18/85/89/186188589.db2.gz	UQCRHJTUBHNXHD-CABCVRRESA-N	1	1	280.368	2.001	40	0		CEABMO
CC(C)[N@H+](CC(=O)[O-])C[C@H]1CC[NH+](Cc2ccccc2)C1	ZINC000079393419	363594636	/nfs/dbraw/zinc/59/46/36/363594636.db2.gz	LVLBVBVGFMOPGJ-INIZCTEOSA-N	1	1	290.407	2.304	40	0		CEABMO
CC(C)[NH+](CC(=O)[O-])C[C@H]1CC[N@H+](Cc2ccccc2)C1	ZINC000079393419	363594643	/nfs/dbraw/zinc/59/46/43/363594643.db2.gz	LVLBVBVGFMOPGJ-INIZCTEOSA-N	1	1	290.407	2.304	40	0		CEABMO
CC(C)[NH+](CC(=O)[O-])C[C@H]1CC[N@@H+](Cc2ccccc2)C1	ZINC000079393419	363594647	/nfs/dbraw/zinc/59/46/47/363594647.db2.gz	LVLBVBVGFMOPGJ-INIZCTEOSA-N	1	1	290.407	2.304	40	0		CEABMO
C[N@H+]1CCC[C@@H](C(=O)NCCC2=CCCCC2)C1	ZINC000082301897	363761625	/nfs/dbraw/zinc/76/16/25/363761625.db2.gz	MIRUCWZIVVLJBW-CQSZACIVSA-N	1	1	250.386	2.335	40	0		CEABMO
CC(=O)N1C[C@H]2CCC[N@@H+](Cc3ccc(F)cc3)[C@H]2C1	ZINC000019019584	361519282	/nfs/dbraw/zinc/51/92/82/361519282.db2.gz	WITUKUBOMUSWGC-ZBFHGGJFSA-N	1	1	276.355	2.268	40	0		CEABMO
Cc1c(C[N@H+]2CC[C@@H](CO)C2)cnn1Cc1ccccc1	ZINC000019554513	361543562	/nfs/dbraw/zinc/54/35/62/361543562.db2.gz	OSMQXVRCEJBKQR-MRXNPFEDSA-N	1	1	285.391	2.054	40	0		CEABMO
Cc1[nH+]ccn1CCNC(=O)c1c(C)oc2c1CCCC2	ZINC000019657120	361547097	/nfs/dbraw/zinc/54/70/97/361547097.db2.gz	IZXJOERWFBBHBM-UHFFFAOYSA-N	1	1	287.363	2.402	40	0		CEABMO
C(OC[C@@]12CCO[C@@H]1CC[N@H+](C1CCC1)C2)C1CC1	ZINC000096217251	364413441	/nfs/dbraw/zinc/41/34/41/364413441.db2.gz	MBHRJQATOPOUAY-CVEARBPZSA-N	1	1	265.397	2.447	40	0		CEABMO
C[N@@H+]1CC[C@@]12CCCN(C(=O)c1ccc(Cl)cc1O)C2	ZINC000585102286	367177592	/nfs/dbraw/zinc/17/75/92/367177592.db2.gz	WCUYYHPEVYNIEM-OAHLLOKOSA-N	1	1	294.782	2.356	40	0		CEABMO
C[N@H+]1CC[C@@]12CCCN(C(=O)c1ccc(Cl)cc1O)C2	ZINC000585102286	367177596	/nfs/dbraw/zinc/17/75/96/367177596.db2.gz	WCUYYHPEVYNIEM-OAHLLOKOSA-N	1	1	294.782	2.356	40	0		CEABMO
CC[C@H](C)[N@H+]1CCC[C@]2(CN(Cc3cncs3)C2=O)C1	ZINC000585099713	367177776	/nfs/dbraw/zinc/17/77/76/367177776.db2.gz	ZJARAEIXWPJORA-SWLSCSKDSA-N	1	1	293.436	2.366	40	0		CEABMO
Cc1ccc(OC[C@@H](O)C[NH+]2C[C@H](C)O[C@@H](C)C2)cc1C	ZINC000195528924	370137302	/nfs/dbraw/zinc/13/73/02/370137302.db2.gz	QUVZIQUWTPJJTD-JYJNAYRXSA-N	1	1	293.407	2.152	40	0		CEABMO
COC(=O)[C@@H]1C[N@@H+](C)C[C@@H]1c1ccc(Cl)cc1	ZINC000209230680	370159843	/nfs/dbraw/zinc/15/98/43/370159843.db2.gz	VXRLOWUNYIQIGZ-VXGBXAGGSA-N	1	1	253.729	2.158	40	0		CEABMO
c1cc(CN2CC[N@H+]3C[C@H](OCC4CC4)C[C@H]3C2)cs1	ZINC000253588907	371530105	/nfs/dbraw/zinc/53/01/05/371530105.db2.gz	YPRUUDNUVOBELJ-JKSUJKDBSA-N	1	1	292.448	2.433	40	0		CEABMO
Cc1cncc(COCC[C@H]2CCOC3(C[NH+](C)C3)C2)c1	ZINC000253602668	371532499	/nfs/dbraw/zinc/53/24/99/371532499.db2.gz	DPEQWTHAGWMGDC-HNNXBMFYSA-N	1	1	290.407	2.408	40	0		CEABMO
CC[C@H](C)n1nccc1C[NH2+]Cc1cnn(CC)c1	ZINC000256050987	190003418	/nfs/dbraw/zinc/00/34/18/190003418.db2.gz	HHFVCAUHHZKFMS-LBPRGKRZSA-N	1	1	261.373	2.360	40	0		CEABMO
OC1(C[N@H+]2CCC[C@H]2CCc2ccncc2)CCOCC1	ZINC000257206691	190011159	/nfs/dbraw/zinc/01/11/59/190011159.db2.gz	BENWPOZOAKHXDJ-INIZCTEOSA-N	1	1	290.407	2.020	40	0		CEABMO
CCC[N@H+]1CCC[C@@H]1c1cccc(CNC(C)=O)n1	ZINC000257204151	190011734	/nfs/dbraw/zinc/01/17/34/190011734.db2.gz	ATFQIWFUOJTHGA-OAHLLOKOSA-N	1	1	261.369	2.265	40	0		CEABMO
C[N@H+]1CC[C@H](OCc2ccccc2)[C@]2(CCCO2)C1	ZINC000257210912	190012294	/nfs/dbraw/zinc/01/22/94/190012294.db2.gz	BWQJOXSEOQHCRL-HOTGVXAUSA-N	1	1	261.365	2.457	40	0		CEABMO
Cc1c[nH]nc1C[C@@H]1CCC[N@@H+](Cc2[nH]cnc2C)C1	ZINC000257228118	190016328	/nfs/dbraw/zinc/01/63/28/190016328.db2.gz	FSJCSFONPJAOLG-ZDUSSCGKSA-N	1	1	273.384	2.204	40	0		CEABMO
CNc1cc([C@H]2CCC[N@@H+](Cc3ccn(C)n3)C2)ccn1	ZINC000257231902	190016850	/nfs/dbraw/zinc/01/68/50/190016850.db2.gz	GIQNUHVJIBEEDY-AWEZNQCLSA-N	1	1	285.395	2.236	40	0		CEABMO
CCn1nccc1-c1cc(C[C@@H]2CC[N@@H+](C)C2)ccn1	ZINC000257223048	190014627	/nfs/dbraw/zinc/01/46/27/190014627.db2.gz	DVRSHAMTSVBAIB-AWEZNQCLSA-N	1	1	270.380	2.459	40	0		CEABMO
CNc1ncccc1C[N@@H+]1CCC[C@@H]1c1cnccn1	ZINC000257253301	190021158	/nfs/dbraw/zinc/02/11/58/190021158.db2.gz	JYIYFMXGINAVKL-CQSZACIVSA-N	1	1	269.352	2.250	40	0		CEABMO
CNc1ncccc1C[N@H+]1CCC[C@@H]1c1cnccn1	ZINC000257253301	190021159	/nfs/dbraw/zinc/02/11/59/190021159.db2.gz	JYIYFMXGINAVKL-CQSZACIVSA-N	1	1	269.352	2.250	40	0		CEABMO
c1ncc(C[N@@H+]2CCC[C@@H](Cc3cccnc3)C2)[nH]1	ZINC000257264898	190022804	/nfs/dbraw/zinc/02/28/04/190022804.db2.gz	LWKZPFDMFMDUJR-AWEZNQCLSA-N	1	1	256.353	2.259	40	0		CEABMO
c1nc(C[N@H+]2CCC[C@@H](Cc3cccnc3)C2)c[nH]1	ZINC000257264898	190022805	/nfs/dbraw/zinc/02/28/05/190022805.db2.gz	LWKZPFDMFMDUJR-AWEZNQCLSA-N	1	1	256.353	2.259	40	0		CEABMO
c1nc(C[N@@H+]2CCC[C@@H](Cc3cccnc3)C2)c[nH]1	ZINC000257264898	190022806	/nfs/dbraw/zinc/02/28/06/190022806.db2.gz	LWKZPFDMFMDUJR-AWEZNQCLSA-N	1	1	256.353	2.259	40	0		CEABMO
Cc1c[nH]c([C@@H]2CCC[N@@H+](Cc3[nH]cnc3C)C2)n1	ZINC000257283065	190025950	/nfs/dbraw/zinc/02/59/50/190025950.db2.gz	OWQFAIRSPFEVBH-GFCCVEGCSA-N	1	1	259.357	2.129	40	0		CEABMO
CCn1nccc1-c1nccnc1[C@@H]1CCC[N@@H+](C)C1	ZINC000257287781	190026881	/nfs/dbraw/zinc/02/68/81/190026881.db2.gz	PRMRUMBIKSOESD-GFCCVEGCSA-N	1	1	271.368	2.169	40	0		CEABMO
CC(C)[N@H+]1CC[C@H](Cc2cnc(-c3cn[nH]c3)cn2)C1	ZINC000257316069	190032758	/nfs/dbraw/zinc/03/27/58/190032758.db2.gz	VDZKZQCRFIQBFP-GFCCVEGCSA-N	1	1	271.368	2.140	40	0		CEABMO
Cc1ncoc1C(=O)N1C[C@@H]2C[C@@]3(C)[C@H](CCC[C@@H]13)[N@H+]2C	ZINC000257329326	190035022	/nfs/dbraw/zinc/03/50/22/190035022.db2.gz	XJKKXGDAKVAQHQ-JFILPPLUSA-N	1	1	289.379	2.070	40	0		CEABMO
Cc1c[nH]c([C@@H]2CC[N@H+](Cc3nccn3C(C)C)C2)n1	ZINC000257341306	190037062	/nfs/dbraw/zinc/03/70/62/190037062.db2.gz	ZJTUOMNAJHRKDQ-CYBMUJFWSA-N	1	1	273.384	2.485	40	0		CEABMO
COC[C@H]1CC[N@@H+](C)C2(CN(C(=O)C3=CCCCC3)C2)C1	ZINC000306134436	376539784	/nfs/dbraw/zinc/53/97/84/376539784.db2.gz	NNIFZLIKCYABEH-AWEZNQCLSA-N	1	1	292.423	2.056	40	0		CEABMO
COc1cccc([C@@H]2[C@@H]([NH3+])C(=O)N2c2ccccc2)c1	ZINC000072227360	256703128	/nfs/dbraw/zinc/70/31/28/256703128.db2.gz	JHEVKFFYJWGGPY-HUUCEWRRSA-N	1	1	268.316	2.110	40	0		CEABMO
Cc1ccsc1C[N@H+]1CCc2nc(C)[nH]c(=O)c2CC1	ZINC000019238703	394468600	/nfs/dbraw/zinc/46/86/00/394468600.db2.gz	KNWZUHJZFOXOSC-UHFFFAOYSA-N	1	1	289.404	2.049	40	0		CEABMO
C[N@H+]1CC[C@]2(CN(Cc3cccnc3)c3cccnc32)C1	ZINC000306130305	394513856	/nfs/dbraw/zinc/51/38/56/394513856.db2.gz	JBYCANWEQZACIQ-QGZVFWFLSA-N	1	1	280.375	2.070	40	0		CEABMO
COc1ccc([C@H]2[C@@H]([NH3+])C(=O)N2c2ccc(C)cc2)cc1	ZINC000039189389	394499466	/nfs/dbraw/zinc/49/94/66/394499466.db2.gz	HKRXNPCMTVJDJM-CVEARBPZSA-N	1	1	282.343	2.419	40	0		CEABMO
CCC[N@@H+]1CCC[C@@H]1c1ccc(N2CCN(C)CC2)nc1	ZINC000072216523	394593284	/nfs/dbraw/zinc/59/32/84/394593284.db2.gz	FTZHLJLEEYBRPR-MRXNPFEDSA-N	1	1	288.439	2.380	40	0		CEABMO
CCC[N@H+]1CCC[C@@H]1c1ccc(N2CCN(C)CC2)nc1	ZINC000072216523	394593286	/nfs/dbraw/zinc/59/32/86/394593286.db2.gz	FTZHLJLEEYBRPR-MRXNPFEDSA-N	1	1	288.439	2.380	40	0		CEABMO
[NH3+][C@H]1C(=O)N(c2cccc(F)c2)[C@@H]1c1ccccc1	ZINC000072227608	394596511	/nfs/dbraw/zinc/59/65/11/394596511.db2.gz	QPRORUXQTBIEBL-ZIAGYGMSSA-N	1	1	256.280	2.241	40	0		CEABMO
COc1cccc([C@@H]2[C@H]([NH3+])C(=O)N2Cc2ccccc2)c1	ZINC000072228142	394596676	/nfs/dbraw/zinc/59/66/76/394596676.db2.gz	ZXWJWTCOHDJEDI-JKSUJKDBSA-N	1	1	282.343	2.106	40	0		CEABMO
Cc1cc(N2CCCC2)nc([C@H]2CCC[N@H+](C)C2)n1	ZINC000072364625	394598419	/nfs/dbraw/zinc/59/84/19/394598419.db2.gz	ALHWBULBEGQOTD-ZDUSSCGKSA-N	1	1	260.385	2.194	40	0		CEABMO
COc1ccc2c3c1O[C@@H]1C[C@H](O)C=C(CC[N@H+](C)C2)[C@@H]31	ZINC000085224991	394643077	/nfs/dbraw/zinc/64/30/77/394643077.db2.gz	FFQKTDKDUHFQKE-BPLDGKMQSA-N	1	1	287.359	2.066	40	0		CEABMO
Fc1ccc(C[N@H+]2CC[C@]23CCN(c2ncccn2)C3)cc1	ZINC000096076079	394675522	/nfs/dbraw/zinc/67/55/22/394675522.db2.gz	UIEDIYBXDGIJKB-KRWDZBQOSA-N	1	1	298.365	2.471	40	0		CEABMO
CC[NH2+][C@@H]1CCN(C(=O)OC(C)(C)C)CC1(F)F	ZINC000169804936	400285054	/nfs/dbraw/zinc/28/50/54/400285054.db2.gz	JUILZUHYPYRALQ-SECBINFHSA-N	1	1	264.316	2.241	40	0		CEABMO
COc1ccc2[nH]c([C@H]3CC[N@H+](Cc4ncc[nH]4)C3)nc2c1	ZINC000035446812	172203203	/nfs/dbraw/zinc/20/32/03/172203203.db2.gz	BIEUZTXFCRDJRY-NSHDSACASA-N	1	1	297.362	2.284	40	0	biogenic,in-vitro	CEABMO
COc1ccc2[nH]c([C@H]3CC[N@@H+](Cc4ncc[nH]4)C3)nc2c1	ZINC000035446812	172203206	/nfs/dbraw/zinc/20/32/06/172203206.db2.gz	BIEUZTXFCRDJRY-NSHDSACASA-N	1	1	297.362	2.284	40	0	biogenic,in-vitro	CEABMO
CCOC(=O)c1cnn(-c2cc[nH+]cc2)c1Br	ZINC000072190389	176335800	/nfs/dbraw/zinc/33/58/00/176335800.db2.gz	XECFLUKHRCBUGC-UHFFFAOYSA-N	1	1	296.124	2.207	40	0		CEABMO
[NH3+][C@@H]1C(=O)N(Cc2ccccc2)[C@@H]1c1ccccc1	ZINC000072228110	176343279	/nfs/dbraw/zinc/34/32/79/176343279.db2.gz	JAUNCKDTAJDBHE-LSDHHAIUSA-N	1	1	252.317	2.097	40	0		CEABMO
COc1ccc([C@H]2C[N@H+](C(C)C)CCN2C(C)=O)cc1	ZINC000072366566	176382014	/nfs/dbraw/zinc/38/20/14/176382014.db2.gz	ZMFLRCQXBJTEQX-MRXNPFEDSA-N	1	1	276.380	2.309	40	0		CEABMO
COCCn1cc(C[N@H+]2CCC[C@H](O)C2)c2ccccc21	ZINC000072397850	176395383	/nfs/dbraw/zinc/39/53/83/176395383.db2.gz	YMCMEQQBWNRWFF-HNNXBMFYSA-N	1	1	288.391	2.244	40	0		CEABMO
CC[NH+]1CCC(N2CCN(C)[C@@H](c3ccccc3)C2)CC1	ZINC000257268128	276149829	/nfs/dbraw/zinc/14/98/29/276149829.db2.gz	MKJDQVWEDPSGTG-GOSISDBHSA-N	1	1	287.451	2.459	40	0		CEABMO
[NH3+][C@@H](c1nc(-c2ccccn2)n[nH]1)c1ccc(F)cc1	ZINC000095533272	185007523	/nfs/dbraw/zinc/00/75/23/185007523.db2.gz	OPXCTJUORZRYMO-GFCCVEGCSA-N	1	1	269.283	2.054	40	0		CEABMO
COC[C@@]12CCCO[C@H]1CC[N@H+](Cc1nccs1)C2	ZINC000096038982	185069601	/nfs/dbraw/zinc/06/96/01/185069601.db2.gz	ICEGIXBQEWTQGY-JSGCOSHPSA-N	1	1	282.409	2.161	40	0		CEABMO
COC[C@@]12CCCO[C@H]1CC[N@@H+](Cc1nccs1)C2	ZINC000096038982	185069603	/nfs/dbraw/zinc/06/96/03/185069603.db2.gz	ICEGIXBQEWTQGY-JSGCOSHPSA-N	1	1	282.409	2.161	40	0		CEABMO
C[C@H]1C[C@@H]2CC[N@@H+](Cc3ccc4c(c3)OCO4)C[C@H]2O1	ZINC000096046015	185072050	/nfs/dbraw/zinc/07/20/50/185072050.db2.gz	OQDBKTHPFDLCMX-DETPVDSQSA-N	1	1	275.348	2.415	40	0		CEABMO
O=C1[C@H]2C[N@@H+](Cc3ccccn3)C[C@H]2CN1c1ccccc1	ZINC000096053592	185074810	/nfs/dbraw/zinc/07/48/10/185074810.db2.gz	CEDUHCXFNALMTE-YOEHRIQHSA-N	1	1	293.370	2.176	40	0		CEABMO
CCOC[C@]12CCCO[C@H]1CC[N@@H+](Cc1ccncc1)C2	ZINC000096056814	185077008	/nfs/dbraw/zinc/07/70/08/185077008.db2.gz	PBORYDSXKKSBKD-DLBZAZTESA-N	1	1	290.407	2.489	40	0		CEABMO
CCn1cc2c(n1)[C@H](COC)C[N@@H+](Cc1cccnc1)C2	ZINC000096059890	185079942	/nfs/dbraw/zinc/07/99/42/185079942.db2.gz	UGTBVSMWOMXGDN-HNNXBMFYSA-N	1	1	286.379	2.044	40	0		CEABMO
CCn1cc2c(n1)[C@H](COC)C[N@H+](Cc1cccnc1)C2	ZINC000096059890	185079944	/nfs/dbraw/zinc/07/99/44/185079944.db2.gz	UGTBVSMWOMXGDN-HNNXBMFYSA-N	1	1	286.379	2.044	40	0		CEABMO
O[C@@H]1CC[N@@H+](Cc2ccccn2)[C@H]1Cc1ccccc1	ZINC000096061562	185082517	/nfs/dbraw/zinc/08/25/17/185082517.db2.gz	UVVQSOHHETWCGE-DLBZAZTESA-N	1	1	268.360	2.260	40	0		CEABMO
CC(C)[N@@H+](C)Cc1cnc2n1CCN(Cc1ccco1)C2	ZINC000096061773	185082801	/nfs/dbraw/zinc/08/28/01/185082801.db2.gz	DGWFPBIXLXIWSS-UHFFFAOYSA-N	1	1	288.395	2.332	40	0		CEABMO
CC(C)C(=O)N1CCC[C@]12CC[N@H+](Cc1nccs1)C2	ZINC000096071023	185087261	/nfs/dbraw/zinc/08/72/61/185087261.db2.gz	ZITSRGNRKAWAPI-OAHLLOKOSA-N	1	1	293.436	2.366	40	0		CEABMO
CC(C)C(=O)N1CCC[C@]12CC[N@@H+](Cc1nccs1)C2	ZINC000096071023	185087263	/nfs/dbraw/zinc/08/72/63/185087263.db2.gz	ZITSRGNRKAWAPI-OAHLLOKOSA-N	1	1	293.436	2.366	40	0		CEABMO
c1cncc(O[C@@H]2CO[C@]3(CC[N@H+](CC4CCC4)C3)C2)c1	ZINC000096072451	185087693	/nfs/dbraw/zinc/08/76/93/185087693.db2.gz	LVHJIQZLIHSNQM-DLBZAZTESA-N	1	1	288.391	2.494	40	0		CEABMO
Cc1ccccc1C[N@H+]1C[C@@H]2COC[C@]2(CN(C)C)C1	ZINC000096108257	185099913	/nfs/dbraw/zinc/09/99/13/185099913.db2.gz	ALNIXLYDRDNKDZ-SJORKVTESA-N	1	1	274.408	2.005	40	0		CEABMO
Cc1ccccc1C[N@@H+]1C[C@@H]2COC[C@]2(CN(C)C)C1	ZINC000096108257	185099915	/nfs/dbraw/zinc/09/99/15/185099915.db2.gz	ALNIXLYDRDNKDZ-SJORKVTESA-N	1	1	274.408	2.005	40	0		CEABMO
Cc1nnc([C@H]2CC[N@@H+](Cc3ccc4c(c3)OCO4)C2)o1	ZINC000049169225	362343088	/nfs/dbraw/zinc/34/30/88/362343088.db2.gz	NIZQVPCZMYHTOU-LBPRGKRZSA-N	1	1	287.319	2.096	40	0	biogenic,in-vitro	CEABMO
CNc1cc([C@@H]2CCC[N@@H+](Cc3ccccn3)C2)ccn1	ZINC000585181505	345009171	/nfs/dbraw/zinc/00/91/71/345009171.db2.gz	UBORTOUMFMUNRX-OAHLLOKOSA-N	1	1	282.391	2.320	40	0		CEABMO
Cc1ccc(C[C@H]2[C@@H](O)CCC[N@H+]2Cc2ncc[nH]2)cc1	ZINC000585274332	345009447	/nfs/dbraw/zinc/00/94/47/345009447.db2.gz	JDYMDLZSZMHBAE-HOTGVXAUSA-N	1	1	285.391	2.286	40	0		CEABMO
c1cn([C@H]2CO[C@]3(C2)CCC[N@H+](Cc2ccccn2)C3)cn1	ZINC000107731399	186189159	/nfs/dbraw/zinc/18/91/59/186189159.db2.gz	DCZVGCNCDNMRRP-SJORKVTESA-N	1	1	298.390	2.274	40	0		CEABMO
COC[C@@]12CCCO[C@@H]1CC[N@@H+](Cc1cccc(C)n1)C2	ZINC000107711063	186187664	/nfs/dbraw/zinc/18/76/64/186187664.db2.gz	HHSVDHNVSJBKDN-SJORKVTESA-N	1	1	290.407	2.408	40	0		CEABMO
COC[C@@]12CCCO[C@H]1CC[N@@H+](Cc1cccc(C)n1)C2	ZINC000107711066	186188237	/nfs/dbraw/zinc/18/82/37/186188237.db2.gz	HHSVDHNVSJBKDN-IRXDYDNUSA-N	1	1	290.407	2.408	40	0		CEABMO
CN(C)C(=O)NC1CC2(C1)CC[N@@H+](Cc1cccs1)C2	ZINC000108525097	186220370	/nfs/dbraw/zinc/22/03/70/186220370.db2.gz	ADZIBVWNFZHEMF-UHFFFAOYSA-N	1	1	293.436	2.374	40	0		CEABMO
COC(=O)[C@H]([NH3+])CSCSCc1ccccc1	ZINC000031947108	361722880	/nfs/dbraw/zinc/72/28/80/361722880.db2.gz	JKQLAVUXTLXBIB-LLVKDONJSA-N	1	1	271.407	2.111	40	0		CEABMO
CC(C)C[N@H+]1CCC[C@]12CCN(C(=O)c1ccno1)C2	ZINC000096203043	364411305	/nfs/dbraw/zinc/41/13/05/364411305.db2.gz	WYHMHLBKPWNALR-OAHLLOKOSA-N	1	1	277.368	2.011	40	0		CEABMO
COc1ccc(C[N@H+]2CCc3ncnc(C)c3CC2)cc1	ZINC000096254954	364418316	/nfs/dbraw/zinc/41/83/16/364418316.db2.gz	OBGJYKSEGFHAFY-UHFFFAOYSA-N	1	1	283.375	2.394	40	0		CEABMO
CC(C)C(=O)N[C@H]1CC[N@@H+](CC2CCCCC2)CC[C@@H]1O	ZINC000257210010	190011932	/nfs/dbraw/zinc/01/19/32/190011932.db2.gz	BSTKOLYBSSHWIZ-HOTGVXAUSA-N	1	1	296.455	2.164	40	0		CEABMO
CNc1ncccc1C[N@@H+]1CCC[C@H]1c1cnccn1	ZINC000257253300	190020486	/nfs/dbraw/zinc/02/04/86/190020486.db2.gz	JYIYFMXGINAVKL-AWEZNQCLSA-N	1	1	269.352	2.250	40	0		CEABMO
CNc1ncccc1C[N@H+]1CCC[C@H]1c1cnccn1	ZINC000257253300	190020487	/nfs/dbraw/zinc/02/04/87/190020487.db2.gz	JYIYFMXGINAVKL-AWEZNQCLSA-N	1	1	269.352	2.250	40	0		CEABMO
Cc1nc[nH]c1C[N@@H+]1CCCC[C@H]1c1ccn2nccc2n1	ZINC000257253282	190020765	/nfs/dbraw/zinc/02/07/65/190020765.db2.gz	JYGOQXDQLBIXKW-HNNXBMFYSA-N	1	1	296.378	2.488	40	0		CEABMO
Cc1nc[nH]c1C[N@H+]1CCCC[C@H]1c1ccn2nccc2n1	ZINC000257253282	190020766	/nfs/dbraw/zinc/02/07/66/190020766.db2.gz	JYGOQXDQLBIXKW-HNNXBMFYSA-N	1	1	296.378	2.488	40	0		CEABMO
Cc1cc(-c2ccnn2C)nc([C@H]2CCCC[N@@H+]2C)n1	ZINC000257255510	190020823	/nfs/dbraw/zinc/02/08/23/190020823.db2.gz	KHTUVJIAOIOYPS-CQSZACIVSA-N	1	1	271.368	2.342	40	0		CEABMO
Cc1cc(-c2ccnn2C)nc([C@H]2CCCC[N@H+]2C)n1	ZINC000257255510	190020824	/nfs/dbraw/zinc/02/08/24/190020824.db2.gz	KHTUVJIAOIOYPS-CQSZACIVSA-N	1	1	271.368	2.342	40	0		CEABMO
CO[C@H]1C[N@@H+](Cc2ccnn2C(C)C)CC[C@@]12CCCO2	ZINC000257246913	190019329	/nfs/dbraw/zinc/01/93/29/190019329.db2.gz	IWMCFYSSQSFBCS-HOTGVXAUSA-N	1	1	293.411	2.234	40	0		CEABMO
Cn1cncc1C[N@@H+]1C[C@@H]2[C@H](Oc3cccnc3)CC[C@@H]2C1	ZINC000257266020	190022821	/nfs/dbraw/zinc/02/28/21/190022821.db2.gz	MBGSAWYHZDBDTA-XOKHGSTOSA-N	1	1	298.390	2.105	40	0		CEABMO
Cc1n[nH]cc1C[N@@H+]1CCC[C@H]1c1ccnc(C)n1	ZINC000257288252	190026740	/nfs/dbraw/zinc/02/67/40/190026740.db2.gz	PTNFHKRJNCYYPQ-AWEZNQCLSA-N	1	1	257.341	2.154	40	0		CEABMO
Cc1n[nH]cc1C[N@H+]1CCC[C@H]1c1ccnc(C)n1	ZINC000257288252	190026741	/nfs/dbraw/zinc/02/67/41/190026741.db2.gz	PTNFHKRJNCYYPQ-AWEZNQCLSA-N	1	1	257.341	2.154	40	0		CEABMO
OCC[N@H+]1CCC[C@H]1c1cccc(Oc2cccnc2)n1	ZINC000257279374	190025173	/nfs/dbraw/zinc/02/51/73/190025173.db2.gz	OGGWYYZPXXSFOR-HNNXBMFYSA-N	1	1	285.347	2.398	40	0		CEABMO
Cc1cn(C)c([C@H]2CC[N@@H+](Cc3cncs3)C2)n1	ZINC000257338795	190036926	/nfs/dbraw/zinc/03/69/26/190036926.db2.gz	YZABAKPTYJKFSD-NSHDSACASA-N	1	1	262.382	2.175	40	0		CEABMO
CC(C)C[N@H+]1C[C@@H]2CN(C(=O)Nc3ccccc3)C[C@H]21	ZINC000306133327	376540735	/nfs/dbraw/zinc/54/07/35/376540735.db2.gz	MILOUHMKHQMEJO-UKRRQHHQSA-N	1	1	273.380	2.491	40	0		CEABMO
CC[C@@H]([NH3+])c1cnc(N2CCN(C(C)C)CC2)c(C)c1	ZINC000072222672	394594344	/nfs/dbraw/zinc/59/43/44/394594344.db2.gz	LGJAGRIHMIOCND-OAHLLOKOSA-N	1	1	276.428	2.330	40	0		CEABMO
CCOC(=O)[C@H]([NH3+])[C@@H](Nc1ccccc1)C(C)C	ZINC000072210541	394592171	/nfs/dbraw/zinc/59/21/71/394592171.db2.gz	SNMKQNUYWSGTCT-OLZOCXBDSA-N	1	1	250.342	2.014	40	0		CEABMO
[NH3+][C@@H]1C(=O)N(c2ccc(F)cc2)[C@@H]1c1ccccc1	ZINC000072227190	394595352	/nfs/dbraw/zinc/59/53/52/394595352.db2.gz	WYYXBPDQRSEFSN-UONOGXRCSA-N	1	1	256.280	2.241	40	0		CEABMO
COc1ccc(N2C(=O)[C@H]([NH3+])[C@@H]2c2ccc(C)o2)cc1	ZINC000072227157	394595451	/nfs/dbraw/zinc/59/54/51/394595451.db2.gz	PQYHEDNPDKFEOF-KGLIPLIRSA-N	1	1	272.304	2.012	40	0		CEABMO
COc1cccc([C@H]2[C@H]([NH3+])C(=O)N2Cc2ccccc2)c1	ZINC000072228143	394596691	/nfs/dbraw/zinc/59/66/91/394596691.db2.gz	ZXWJWTCOHDJEDI-HOTGVXAUSA-N	1	1	282.343	2.106	40	0		CEABMO
CCN1C(=O)[C@H]([NH3+])[C@H]1c1ccc(Cl)cc1Cl	ZINC000096526081	394697151	/nfs/dbraw/zinc/69/71/51/394697151.db2.gz	WTJUGUHOEKJQEP-NXEZZACHSA-N	1	1	259.136	2.224	40	0		CEABMO
CNc1cc(C)[nH+]c(CC2CCN(c3ncccn3)CC2)n1	ZINC000072352118	176374385	/nfs/dbraw/zinc/37/43/85/176374385.db2.gz	UFGDVZZININPET-UHFFFAOYSA-N	1	1	298.394	2.076	40	0		CEABMO
c1cnc([C@@H]2CCC[N@H+](Cc3ccncc3)C2)cn1	ZINC000072363789	176378354	/nfs/dbraw/zinc/37/83/54/176378354.db2.gz	YVRHPRAEKCXGLO-CQSZACIVSA-N	1	1	254.337	2.251	40	0		CEABMO
C[N@H+]1CCC[C@H](c2ccnc(Nc3ncccn3)c2)C1	ZINC000072364983	176380030	/nfs/dbraw/zinc/38/00/30/176380030.db2.gz	YBLXHANYXPZSNS-ZDUSSCGKSA-N	1	1	269.352	2.424	40	0		CEABMO
c1cn2c(n1)nccc2[C@H]1CC[N@H+](Cc2ccncc2)C1	ZINC000072367946	176382500	/nfs/dbraw/zinc/38/25/00/176382500.db2.gz	LNYRJIPXBSYOCP-AWEZNQCLSA-N	1	1	279.347	2.114	40	0		CEABMO
Oc1ccc(C[N@H+]2CCOC[C@H](Cc3ccccn3)C2)cc1	ZINC000072385361	176389984	/nfs/dbraw/zinc/38/99/84/176389984.db2.gz	CKJCFSNUPYUEMQ-MRXNPFEDSA-N	1	1	298.386	2.478	40	0		CEABMO
C[N@H+]1CCCC[C@@H]1c1cncc(NCC2(C)COC2)n1	ZINC000072388948	176394069	/nfs/dbraw/zinc/39/40/69/176394069.db2.gz	GLVPXGRHQKNQEA-CYBMUJFWSA-N	1	1	276.384	2.082	40	0		CEABMO
CC(C)[N@H+]1C[C@H]2CN(Cc3ccccc3)C(=O)[C@@]2(F)C1	ZINC000096261728	265349286	/nfs/dbraw/zinc/34/92/86/265349286.db2.gz	LIVSAJSCTIREET-GDBMZVCRSA-N	1	1	276.355	2.077	40	0		CEABMO
COc1ncnc2c1CC[N@@H+](Cc1ccsc1)CC2	ZINC000096058735	278098961	/nfs/dbraw/zinc/09/89/61/278098961.db2.gz	FGGHWVSHTRCVQG-UHFFFAOYSA-N	1	1	275.377	2.148	40	0		CEABMO
c1cn([C@@H]2CO[C@]3(C2)CCC[N@H+](Cc2ccoc2)C3)cn1	ZINC000096048548	185073140	/nfs/dbraw/zinc/07/31/40/185073140.db2.gz	RHHJWYHNAPOFFG-HOTGVXAUSA-N	1	1	287.363	2.472	40	0		CEABMO
c1coc(CN2C[C@H]3C[NH+](Cc4cccnc4)C[C@@H]3C2)c1	ZINC000096053722	185074130	/nfs/dbraw/zinc/07/41/30/185074130.db2.gz	BYTKRPZSTBUPQP-HZPDHXFCSA-N	1	1	283.375	2.238	40	0		CEABMO
c1cc(CN2C[C@@H]3C[N@H+](Cc4ccccn4)C[C@@H]3C2)co1	ZINC000096053782	185074876	/nfs/dbraw/zinc/07/48/76/185074876.db2.gz	CVYSNAJBYFRQLK-IYBDPMFKSA-N	1	1	283.375	2.238	40	0		CEABMO
c1cc(C[N@@H+]2C[C@H]3CN(Cc4ccccn4)C[C@H]3C2)co1	ZINC000096053782	185074877	/nfs/dbraw/zinc/07/48/77/185074877.db2.gz	CVYSNAJBYFRQLK-IYBDPMFKSA-N	1	1	283.375	2.238	40	0		CEABMO
c1cc(C[N@H+]2C[C@H]3CN(Cc4ccccn4)C[C@H]3C2)co1	ZINC000096053782	185074878	/nfs/dbraw/zinc/07/48/78/185074878.db2.gz	CVYSNAJBYFRQLK-IYBDPMFKSA-N	1	1	283.375	2.238	40	0		CEABMO
COC[C@]12CCCO[C@@H]1CC[N@@H+](Cc1ccccn1)C2	ZINC000096056720	185076993	/nfs/dbraw/zinc/07/69/93/185076993.db2.gz	YLSCRXPAZCUAOA-HZPDHXFCSA-N	1	1	276.380	2.099	40	0		CEABMO
C(O[C@@H]1CC[C@H]2[C@H]1OCC[N@H+]2CC1CC1)C1CC1	ZINC000096057898	185079410	/nfs/dbraw/zinc/07/94/10/185079410.db2.gz	HWHUTKFBNHYBEB-RRFJBIMHSA-N	1	1	251.370	2.055	40	0		CEABMO
CO[C@H]1CC[N@@H+](CC2CCCC2)[C@H]1Cc1cnn(C)c1	ZINC000096069959	185085660	/nfs/dbraw/zinc/08/56/60/185085660.db2.gz	GZHOHFKKASSXDD-HOTGVXAUSA-N	1	1	277.412	2.242	40	0		CEABMO
Cc1noc(C)c1C[N@@H+]1CCC[C@@]2(CCCC(=O)N2C)C1	ZINC000096077020	185089320	/nfs/dbraw/zinc/08/93/20/185089320.db2.gz	KPPSIKPWOBSXPQ-INIZCTEOSA-N	1	1	291.395	2.268	40	0		CEABMO
CC(C)C[N@H+]1C[C@H]2CN(C(=O)Nc3ccccc3)C[C@@H]21	ZINC000096080579	185090660	/nfs/dbraw/zinc/09/06/60/185090660.db2.gz	MILOUHMKHQMEJO-ZFWWWQNUSA-N	1	1	273.380	2.491	40	0		CEABMO
CC(C)C[N@H+]1C[C@H]2C[C@H](C(=O)Nc3ccccc3)[C@@H](C1)O2	ZINC000096083634	185093117	/nfs/dbraw/zinc/09/31/17/185093117.db2.gz	DVLGTTZGGQHXLC-OWCLPIDISA-N	1	1	288.391	2.370	40	0		CEABMO
CC(C)[C@@H]1[C@@H]2OC(=O)[C@H]1[C@@H]1CC[C@@H]3C[N@@H+](C)[C@H]2[C@@]31C	ZINC000031576075	343409058	/nfs/dbraw/zinc/40/90/58/343409058.db2.gz	RYAHJFGVOCZDEI-HJRIULOKSA-N	1	1	263.381	2.160	40	0		CEABMO
CNc1nc(N2CCc3ccccc3[C@@H]2C)cc[nH+]1	ZINC000328960101	344758369	/nfs/dbraw/zinc/75/83/69/344758369.db2.gz	AWTSTBAHOGJYGH-NSHDSACASA-N	1	1	254.337	2.064	40	0		CEABMO
C[C@]12CCC[N@@H+](CC3(O)CCCCC3)[C@H]1CCCC(=O)N2	ZINC000585283371	345010116	/nfs/dbraw/zinc/01/01/16/345010116.db2.gz	NWNIKECNLVROLP-HOCLYGCPSA-N	1	1	294.439	2.205	40	0		CEABMO
CCNC(=O)N1CCC(Cn2cc[nH+]c2C(C)C)CC1	ZINC000085436360	179062893	/nfs/dbraw/zinc/06/28/93/179062893.db2.gz	IMCWLUCQICXBJR-UHFFFAOYSA-N	1	1	278.400	2.448	40	0		CEABMO
COC[C@@]12CCCO[C@H]1CC[N@H+](Cc1cc(C)on1)C2	ZINC000107711212	186188457	/nfs/dbraw/zinc/18/84/57/186188457.db2.gz	UQCRHJTUBHNXHD-GJZGRUSLSA-N	1	1	280.368	2.001	40	0		CEABMO
COC[C@@]12CCCO[C@H]1CC[N@@H+](Cc1cc(C)on1)C2	ZINC000107711212	186188459	/nfs/dbraw/zinc/18/84/59/186188459.db2.gz	UQCRHJTUBHNXHD-GJZGRUSLSA-N	1	1	280.368	2.001	40	0		CEABMO
Brc1ccc([C@H]2C[C@H]2C[NH+]2CCNCC2)cc1	ZINC000575424318	366284484	/nfs/dbraw/zinc/28/44/84/366284484.db2.gz	YWNHAKLRYRIPIH-GXTWGEPZSA-N	1	1	295.224	2.458	40	0		CEABMO
OCC[N@@H+](C1CC1)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000079393545	363593929	/nfs/dbraw/zinc/59/39/29/363593929.db2.gz	LDSRLKQLUBAIQE-KRWDZBQOSA-N	1	1	274.408	2.108	40	0		CEABMO
OCCN(C1CC1)[C@H]1CCC[N@H+](Cc2ccccc2)C1	ZINC000079393545	363593935	/nfs/dbraw/zinc/59/39/35/363593935.db2.gz	LDSRLKQLUBAIQE-KRWDZBQOSA-N	1	1	274.408	2.108	40	0		CEABMO
OCCN(C1CC1)[C@H]1CCC[N@@H+](Cc2ccccc2)C1	ZINC000079393545	363593938	/nfs/dbraw/zinc/59/39/38/363593938.db2.gz	LDSRLKQLUBAIQE-KRWDZBQOSA-N	1	1	274.408	2.108	40	0		CEABMO
CC(C)[N@H+](Cc1ccccc1)C[C@@H]1CC[NH+](CC(=O)[O-])C1	ZINC000079416157	363599540	/nfs/dbraw/zinc/59/95/40/363599540.db2.gz	OFKWMWSGNPCZEP-MRXNPFEDSA-N	1	1	290.407	2.304	40	0		CEABMO
CC(C)[NH+](Cc1ccccc1)C[C@@H]1CC[N@H+](CC(=O)[O-])C1	ZINC000079416157	363599548	/nfs/dbraw/zinc/59/95/48/363599548.db2.gz	OFKWMWSGNPCZEP-MRXNPFEDSA-N	1	1	290.407	2.304	40	0		CEABMO
CC(C)[NH+](Cc1ccccc1)C[C@@H]1CC[N@@H+](CC(=O)[O-])C1	ZINC000079416157	363599553	/nfs/dbraw/zinc/59/95/53/363599553.db2.gz	OFKWMWSGNPCZEP-MRXNPFEDSA-N	1	1	290.407	2.304	40	0		CEABMO
O[C@@]1(c2ccccn2)CC[C@H]2C[N@@H+](Cc3ccccn3)C[C@H]21	ZINC000019401898	361531327	/nfs/dbraw/zinc/53/13/27/361531327.db2.gz	PLXNUAPBDCSVCJ-LESCRADOSA-N	1	1	295.386	2.206	40	0		CEABMO
CO[C@H]1C[N@@H+](Cc2ccc(F)cc2)[C@@H]2CCCO[C@@H]21	ZINC000096186999	364406530	/nfs/dbraw/zinc/40/65/30/364406530.db2.gz	JPTZMXRBWLMQRE-ILXRZTDVSA-N	1	1	265.328	2.204	40	0		CEABMO
O[C@@H]1CC[N@@H+](Cc2ccsc2)[C@H]1Cc1cccnc1	ZINC000096200098	364408327	/nfs/dbraw/zinc/40/83/27/364408327.db2.gz	JHKJUWKWRPYCAI-LSDHHAIUSA-N	1	1	274.389	2.321	40	0		CEABMO
c1cncc(N2CC[C@@H]3C[N@H+](CC4CC4)C[C@@H]3C2)c1	ZINC000096081462	364400175	/nfs/dbraw/zinc/40/01/75/364400175.db2.gz	XNJLQENLVMHYPQ-HUUCEWRRSA-N	1	1	257.381	2.250	40	0		CEABMO
COC[C@@H]1C[N@H+](C)C[C@@]12CCN(Cc1ccccc1)C2	ZINC000096216561	364413410	/nfs/dbraw/zinc/41/34/10/364413410.db2.gz	UIEMNURGRVOCJH-DLBZAZTESA-N	1	1	274.408	2.087	40	0		CEABMO
COC[C@@H]1C[N@@H+](C)C[C@@]12CCN(Cc1ccccc1)C2	ZINC000096216561	364413411	/nfs/dbraw/zinc/41/34/11/364413411.db2.gz	UIEMNURGRVOCJH-DLBZAZTESA-N	1	1	274.408	2.087	40	0		CEABMO
COC[C@@H]1CN(C)C[C@@]12CC[N@H+](Cc1ccccc1)C2	ZINC000096216561	364413412	/nfs/dbraw/zinc/41/34/12/364413412.db2.gz	UIEMNURGRVOCJH-DLBZAZTESA-N	1	1	274.408	2.087	40	0		CEABMO
COC[C@@H]1CN(C)C[C@@]12CC[N@@H+](Cc1ccccc1)C2	ZINC000096216561	364413413	/nfs/dbraw/zinc/41/34/13/364413413.db2.gz	UIEMNURGRVOCJH-DLBZAZTESA-N	1	1	274.408	2.087	40	0		CEABMO
CCO[C@@H]1CC[N@@H+](Cc2ccccc2OC)[C@H]2CCO[C@@H]21	ZINC000096217351	364413461	/nfs/dbraw/zinc/41/34/61/364413461.db2.gz	SNFMYNCOGUDHJW-UAGQMJEPSA-N	1	1	291.391	2.464	40	0		CEABMO
c1ccc(N2CC[C@H]3[C@H]2CC[N@@H+]3CC2CCOCC2)nc1	ZINC000107199362	364709659	/nfs/dbraw/zinc/70/96/59/364709659.db2.gz	YRHITWJVNXSXKP-JKSUJKDBSA-N	1	1	287.407	2.161	40	0		CEABMO
CCOC[C@@H]1CC[N@@H+](C)C2(CN(Cc3cccnc3)C2)C1	ZINC000248099187	371160087	/nfs/dbraw/zinc/16/00/87/371160087.db2.gz	DKLDJTHCQFWKDO-OAHLLOKOSA-N	1	1	289.423	2.014	40	0		CEABMO
O=c1[nH]c(CN2CC[N@H+]3CCCC[C@H]3C2)nc2ccccc21	ZINC000253615639	371532213	/nfs/dbraw/zinc/53/22/13/371532213.db2.gz	YGKOGHZPEDWOCB-ZDUSSCGKSA-N	1	1	298.390	2.006	40	0		CEABMO
CN1C[C@@H]2C[N@H+](Cc3ccccc3)[C@H](C3CC3)[C@H]2C1	ZINC000409427701	375524305	/nfs/dbraw/zinc/52/43/05/375524305.db2.gz	BUHGYPQOLLDKKM-IXDOHACOSA-N	1	1	256.393	2.459	40	0		CEABMO
CN1C[C@@H]2C[N@@H+](Cc3ccccc3)[C@H](C3CC3)[C@H]2C1	ZINC000409427701	375524310	/nfs/dbraw/zinc/52/43/10/375524310.db2.gz	BUHGYPQOLLDKKM-IXDOHACOSA-N	1	1	256.393	2.459	40	0		CEABMO
Cc1c(NC(=O)Nc2ccc(C)cc2)[s+]nn1C	ZINC000256055630	190005559	/nfs/dbraw/zinc/00/55/59/190005559.db2.gz	NWRJQZPFGMVQDN-UHFFFAOYSA-O	1	1	263.346	2.228	40	0		CEABMO
Nc1nccc([C@H]2CCCC[N@@H+]2Cc2ccoc2)n1	ZINC000257216217	190014277	/nfs/dbraw/zinc/01/42/77/190014277.db2.gz	CTPHEJYLSGOSDZ-CYBMUJFWSA-N	1	1	258.325	2.379	40	0		CEABMO
Nc1nccc([C@H]2CCCC[N@H+]2Cc2ccoc2)n1	ZINC000257216217	190014278	/nfs/dbraw/zinc/01/42/78/190014278.db2.gz	CTPHEJYLSGOSDZ-CYBMUJFWSA-N	1	1	258.325	2.379	40	0		CEABMO
CO[C@H]1C[N@@H+](Cc2ccncc2C)CC[C@@]12CCCO2	ZINC000257317985	190032440	/nfs/dbraw/zinc/03/24/40/190032440.db2.gz	VMAJVFGYWHKXRJ-HOTGVXAUSA-N	1	1	276.380	2.160	40	0		CEABMO
c1cnc([C@H]2C[N@H+](CC3CCCCC3)CCO2)cn1	ZINC000257317517	190032728	/nfs/dbraw/zinc/03/27/28/190032728.db2.gz	VKBPCHVEWQLUEG-OAHLLOKOSA-N	1	1	261.369	2.430	40	0		CEABMO
c1cnc([C@H]2C[N@@H+](CC3CCCCC3)CCO2)cn1	ZINC000257317517	190032729	/nfs/dbraw/zinc/03/27/29/190032729.db2.gz	VKBPCHVEWQLUEG-OAHLLOKOSA-N	1	1	261.369	2.430	40	0		CEABMO
C[N@@H+]1Cc2cccn2[C@@H](COCc2ccncc2)C1	ZINC000306131539	376541503	/nfs/dbraw/zinc/54/15/03/376541503.db2.gz	KICUCZIDYQLQGS-OAHLLOKOSA-N	1	1	257.337	2.086	40	0		CEABMO
c1cc(-c2ncnc3c2CC[N@@H+](CC2CC2)CC3)ccn1	ZINC000096255259	256835739	/nfs/dbraw/zinc/83/57/39/256835739.db2.gz	VQWVTAHKNRUBIJ-UHFFFAOYSA-N	1	1	280.375	2.349	40	0		CEABMO
CC[N@H+]1CC[C@H]2COC(=O)N2c2ccc(OC)cc2C1	ZINC000225490456	394469458	/nfs/dbraw/zinc/46/94/58/394469458.db2.gz	DZOGKSSVVRHTSR-LBPRGKRZSA-N	1	1	276.336	2.246	40	0	biogenic,in-vitro	CEABMO
CCOC(=O)[C@@H]([NH3+])[C@H](Nc1ccc(OC)cc1)C(C)C	ZINC000072210544	394592327	/nfs/dbraw/zinc/59/23/27/394592327.db2.gz	NYBCONNMWWWMLE-UONOGXRCSA-N	1	1	280.368	2.022	40	0		CEABMO
CC[N@H+]1CCCC[C@@H]1c1cccnc1N1CCOCC1	ZINC000072216238	394593467	/nfs/dbraw/zinc/59/34/67/394593467.db2.gz	IWONFYSGKVFFII-OAHLLOKOSA-N	1	1	275.396	2.465	40	0		CEABMO
COc1ccc(N2C(=O)[C@@H]([NH3+])[C@H]2c2ccc(C)o2)cc1	ZINC000072227154	394595206	/nfs/dbraw/zinc/59/52/06/394595206.db2.gz	PQYHEDNPDKFEOF-UONOGXRCSA-N	1	1	272.304	2.012	40	0		CEABMO
COc1cccc([C@H]2[C@H]([NH3+])C(=O)N2c2ccccc2)c1	ZINC000072227359	394595312	/nfs/dbraw/zinc/59/53/12/394595312.db2.gz	JHEVKFFYJWGGPY-GJZGRUSLSA-N	1	1	268.316	2.110	40	0		CEABMO
CC[NH+]1CCN(c2ccc(C(=O)c3ccccc3)cn2)CC1	ZINC000072225544	394595617	/nfs/dbraw/zinc/59/56/17/394595617.db2.gz	IRHVKRSHCRUXIU-UHFFFAOYSA-N	1	1	295.386	2.455	40	0		CEABMO
COc1ccc(N2C(=O)[C@H]([NH3+])[C@@H]2c2cccs2)cc1	ZINC000072227133	394595631	/nfs/dbraw/zinc/59/56/31/394595631.db2.gz	TUGVCJNUHGCWQR-OLZOCXBDSA-N	1	1	274.345	2.172	40	0		CEABMO
Cc1ccc([C@@H]2[C@@H]([NH3+])C(=O)N2Cc2ccc(F)cc2)o1	ZINC000072228212	394596383	/nfs/dbraw/zinc/59/63/83/394596383.db2.gz	HSLBPAIYUNHBMV-ZIAGYGMSSA-N	1	1	274.295	2.138	40	0		CEABMO
[NH3+][C@H]1C(=O)N(Cc2ccc(F)cc2)[C@@H]1c1ccccc1F	ZINC000072228236	394596663	/nfs/dbraw/zinc/59/66/63/394596663.db2.gz	LCRLBTDJPNMCGY-HUUCEWRRSA-N	1	1	288.297	2.376	40	0		CEABMO
C[C@H]1C[N@H+]2C[C@H](O)C[C@@H]2CN1Cc1cccc2ccccc21	ZINC000072324764	394598458	/nfs/dbraw/zinc/59/84/58/394598458.db2.gz	ZGBDGAFMTAUITL-BMGDILEWSA-N	1	1	296.414	2.479	40	0		CEABMO
CCOC[C@@]12CCCO[C@H]1CC[N@@H+](CC1CCOCC1)C2	ZINC000096056861	394676217	/nfs/dbraw/zinc/67/62/17/394676217.db2.gz	FXKMOSYEZHUKCQ-IRXDYDNUSA-N	1	1	297.439	2.321	40	0		CEABMO
CC[C@H]([C@@H]([NH3+])c1ccccc1F)S(=O)(=O)CC	ZINC000096524962	394697394	/nfs/dbraw/zinc/69/73/94/394697394.db2.gz	ZUGJWTPBVBGUMN-NEPJUHHUSA-N	1	1	259.346	2.039	40	0		CEABMO
COc1ccc(C(=O)[C@H]([NH2+]CCO)c2ccccc2)cc1	ZINC000006484216	170204647	/nfs/dbraw/zinc/20/46/47/170204647.db2.gz	FOQBXFBGHNBNIL-MRXNPFEDSA-N	1	1	285.343	2.201	40	0		CEABMO
CCn1nccc1C[NH2+]Cc1cc(F)ccc1F	ZINC000020354209	171156615	/nfs/dbraw/zinc/15/66/15/171156615.db2.gz	QQVAXBGUSCHLKH-UHFFFAOYSA-N	1	1	251.280	2.471	40	0		CEABMO
Cc1nc2ccc(NC(=O)CC3CC[NH2+]CC3)cc2[nH]1	ZINC000038075488	174085848	/nfs/dbraw/zinc/08/58/48/174085848.db2.gz	PBWFYCJLTJZDFU-UHFFFAOYSA-N	1	1	272.352	2.200	40	0		CEABMO
CN1CC[NH2+][C@H](Cc2ccc(-c3cccs3)cc2)C1=O	ZINC000072352851	176374119	/nfs/dbraw/zinc/37/41/19/176374119.db2.gz	HSTBOIIKHKTORF-CQSZACIVSA-N	1	1	286.400	2.388	40	0		CEABMO
[NH3+][C@@H](c1nc(-c2ccccc2O)n[nH]1)c1ccc(F)cc1	ZINC000095533246	185007049	/nfs/dbraw/zinc/00/70/49/185007049.db2.gz	HRTRHZFMSJDIOJ-CYBMUJFWSA-N	1	1	284.294	2.365	40	0		CEABMO
CCN1C(=O)CC[C@]12CCC[N@@H+](Cc1ccccn1)CC2	ZINC000096047505	185072869	/nfs/dbraw/zinc/07/28/69/185072869.db2.gz	FBDQBYLYIACXTE-KRWDZBQOSA-N	1	1	287.407	2.449	40	0		CEABMO
CC[N@H+]1CCOC[C@@]2(CCCN(Cc3cccnc3)C2)C1	ZINC000096049600	185073080	/nfs/dbraw/zinc/07/30/80/185073080.db2.gz	WSZUPJUTBFKXLZ-KRWDZBQOSA-N	1	1	289.423	2.016	40	0		CEABMO
C[C@H]1C[NH+](C[C@H](O)COc2ccccc2Cl)C[C@H](C)O1	ZINC000034118504	361786966	/nfs/dbraw/zinc/78/69/66/361786966.db2.gz	WWKBKXVDKZSHOW-AVGNSLFASA-N	1	1	299.798	2.189	40	0		CEABMO
COC[C@@]12CCCO[C@@H]1CC[N@@H+](Cc1ccco1)C2	ZINC000096056709	185077269	/nfs/dbraw/zinc/07/72/69/185077269.db2.gz	MSHWUFSCDKMXQC-CABCVRRESA-N	1	1	265.353	2.297	40	0		CEABMO
COC[C@@]12CCCO[C@@H]1CC[N@@H+](Cc1ccncc1)C2	ZINC000096056727	185077347	/nfs/dbraw/zinc/07/73/47/185077347.db2.gz	HVXOOPYFHMJWMJ-CVEARBPZSA-N	1	1	276.380	2.099	40	0		CEABMO
CCOC[C@H]1C[N@@H+](CC2CC2)Cc2cn(CC)nc21	ZINC000096059923	185080124	/nfs/dbraw/zinc/08/01/24/185080124.db2.gz	ASDXBXUSYRDNSR-CQSZACIVSA-N	1	1	263.385	2.249	40	0		CEABMO
C[C@H]1CCC[N@@H+](C[C@H](O)COc2ccc(F)cc2)C1	ZINC000035031494	361804491	/nfs/dbraw/zinc/80/44/91/361804491.db2.gz	NERBENWZMZEVBI-JSGCOSHPSA-N	1	1	267.344	2.297	40	0		CEABMO
CCN1C(=O)CC[C@@]12CCC[N@H+](Cc1ccncc1F)C2	ZINC000096071172	185087200	/nfs/dbraw/zinc/08/72/00/185087200.db2.gz	ITODSNHPNNRBSP-MRXNPFEDSA-N	1	1	291.370	2.198	40	0		CEABMO
CCN1C(=O)CC[C@@]12CCC[N@@H+](Cc1ccncc1F)C2	ZINC000096071172	185087202	/nfs/dbraw/zinc/08/72/02/185087202.db2.gz	ITODSNHPNNRBSP-MRXNPFEDSA-N	1	1	291.370	2.198	40	0		CEABMO
COC[C@@H]1CC2(CO1)CC[NH+](Cc1nccs1)CC2	ZINC000096105752	185098879	/nfs/dbraw/zinc/09/88/79/185098879.db2.gz	LBGZMXBJGPMQJC-LBPRGKRZSA-N	1	1	282.409	2.161	40	0		CEABMO
CCOC[C@]12COC[C@H]1C[N@@H+](Cc1cccc(OC)c1)C2	ZINC000096108671	185099411	/nfs/dbraw/zinc/09/94/11/185099411.db2.gz	SZDQLRNAGWIFQP-NVXWUHKLSA-N	1	1	291.391	2.180	40	0		CEABMO
OCC[N@H+](Cc1ccccc1Br)C1CC1	ZINC000048065349	362243615	/nfs/dbraw/zinc/24/36/15/362243615.db2.gz	CURSABGJGPVBFU-UHFFFAOYSA-N	1	1	270.170	2.406	40	0		CEABMO
OCC[N@@H+](Cc1ccccc1Br)C1CC1	ZINC000048065349	362243620	/nfs/dbraw/zinc/24/36/20/362243620.db2.gz	CURSABGJGPVBFU-UHFFFAOYSA-N	1	1	270.170	2.406	40	0		CEABMO
C[N@@H+]1C[C@H]2c3ccccc3[C@@H](NC(=O)c3ccncc3)[C@H]2C1	ZINC000585109722	345005719	/nfs/dbraw/zinc/00/57/19/345005719.db2.gz	LQHJEBGAUOJVID-YESZJQIVSA-N	1	1	293.370	2.212	40	0		CEABMO
O[C@@]1(COc2ccccc2)COCC[N@H+](C2CCCC2)C1	ZINC000585269044	345009416	/nfs/dbraw/zinc/00/94/16/345009416.db2.gz	IRCJPLBHPGGJNP-QGZVFWFLSA-N	1	1	291.391	2.071	40	0		CEABMO
CC(C)[N@H+]1CCC[C@H]1c1cncc(-c2nccn2C)n1	ZINC000585178863	345009439	/nfs/dbraw/zinc/00/94/39/345009439.db2.gz	UBYVYLCPNQCPSL-AWEZNQCLSA-N	1	1	271.368	2.422	40	0		CEABMO
O=C1CC[C@@]2(CCC[N@@H+](CCOc3ccccc3)C2)O1	ZINC000585282261	345009897	/nfs/dbraw/zinc/00/98/97/345009897.db2.gz	CFFRVEKENJRPCS-MRXNPFEDSA-N	1	1	275.348	2.237	40	0		CEABMO
CCOC[C@H]1CC[C@H]2[C@H](CC[N@H+]2Cc2c(C)noc2C)O1	ZINC000107206309	186162166	/nfs/dbraw/zinc/16/21/66/186162166.db2.gz	VAUHOWLAXWIMEE-KBMXLJTQSA-N	1	1	294.395	2.450	40	0		CEABMO
c1cn([C@H]2CO[C@@]3(C2)CCC[N@H+](Cc2ccncc2)C3)cn1	ZINC000107731411	186189184	/nfs/dbraw/zinc/18/91/84/186189184.db2.gz	QDQCLGDBADXANC-IAGOWNOFSA-N	1	1	298.390	2.274	40	0		CEABMO
CC[NH+]1CCN(C(=O)c2ccc(OC)c(Cl)c2)CC1	ZINC000074946807	363424865	/nfs/dbraw/zinc/42/48/65/363424865.db2.gz	UWECFAKKGRAJRF-UHFFFAOYSA-N	1	1	282.771	2.126	40	0		CEABMO
Brc1ccc([C@@H]2C[C@H]2C[NH+]2CCNCC2)cc1	ZINC000575424319	366284100	/nfs/dbraw/zinc/28/41/00/366284100.db2.gz	YWNHAKLRYRIPIH-JSGCOSHPSA-N	1	1	295.224	2.458	40	0		CEABMO
CC(C)[N@H+](Cc1ccccc1)C[C@@H]1CCCN1CCO	ZINC000079414264	363597566	/nfs/dbraw/zinc/59/75/66/363597566.db2.gz	RJKYNHGNVDGRTA-KRWDZBQOSA-N	1	1	276.424	2.354	40	0		CEABMO
CC(C)N(Cc1ccccc1)C[C@@H]1CCC[N@@H+]1CCO	ZINC000079414264	363597568	/nfs/dbraw/zinc/59/75/68/363597568.db2.gz	RJKYNHGNVDGRTA-KRWDZBQOSA-N	1	1	276.424	2.354	40	0		CEABMO
CC(C)N(Cc1ccccc1)C[C@@H]1CCC[N@H+]1CCO	ZINC000079414264	363597570	/nfs/dbraw/zinc/59/75/70/363597570.db2.gz	RJKYNHGNVDGRTA-KRWDZBQOSA-N	1	1	276.424	2.354	40	0		CEABMO
C[N@@H+]1[C@@H]2CC[C@H]1CC(OC(=O)c1cccc(O)c1)C2	ZINC000000394485	361169300	/nfs/dbraw/zinc/16/93/00/361169300.db2.gz	OJADCNKLFKWRHJ-ONXXMXGDSA-N	1	1	261.321	2.174	40	0		CEABMO
C[C@H]1CCCC[N@H+]1CCCNC(=O)c1ccc(N)cc1	ZINC000001733842	361220907	/nfs/dbraw/zinc/22/09/07/361220907.db2.gz	HIIVEEDTMISUOQ-ZDUSSCGKSA-N	1	1	275.396	2.263	40	0		CEABMO
CC(=O)c1cccc(NC(=O)[C@H]2CCC[N@H+](C)C2)c1	ZINC000082333254	363767072	/nfs/dbraw/zinc/76/70/72/363767072.db2.gz	PZIFUDLUTOHULH-ZDUSSCGKSA-N	1	1	260.337	2.170	40	0		CEABMO
COc1cccc(C[N@@H+]2CCN(C(=O)C3CC3)[C@@H](C)C2)c1	ZINC000013565507	361431682	/nfs/dbraw/zinc/43/16/82/361431682.db2.gz	AIDUVRZUTLIPMN-ZDUSSCGKSA-N	1	1	288.391	2.138	40	0		CEABMO
COc1cccc(C[N@H+]2CCN(C(=O)C3CC3)[C@@H](C)C2)c1	ZINC000013565507	361431692	/nfs/dbraw/zinc/43/16/92/361431692.db2.gz	AIDUVRZUTLIPMN-ZDUSSCGKSA-N	1	1	288.391	2.138	40	0		CEABMO
CCC[N@H+]1CCc2nc(-c3cccnc3)[nH]c(=O)c2C1	ZINC000019503489	361539072	/nfs/dbraw/zinc/53/90/72/361539072.db2.gz	MPBLZKYALAXPCR-UHFFFAOYSA-N	1	1	270.336	2.012	40	0		CEABMO
COc1cc(CN2C[C@@H]3CCC[N@H+]3C[C@@H]2C)cc(OC)c1	ZINC000019575720	361544213	/nfs/dbraw/zinc/54/42/13/361544213.db2.gz	FZINEIJGXRZIID-ZFWWWQNUSA-N	1	1	290.407	2.372	40	0		CEABMO
Cc1ccc(C)c(OC[C@@H](O)C[NH+]2C[C@@H](C)O[C@H](C)C2)c1	ZINC000019790666	361555518	/nfs/dbraw/zinc/55/55/18/361555518.db2.gz	WJVXZXXDCYHFKU-OAGGEKHMSA-N	1	1	293.407	2.152	40	0		CEABMO
CCc1c(N)n(Cc2ccccc2)nc1C[NH+](C)C	ZINC000026512165	361642818	/nfs/dbraw/zinc/64/28/18/361642818.db2.gz	ZXKLSZIOZNZOMN-UHFFFAOYSA-N	1	1	258.369	2.138	40	0		CEABMO
O[C@@]1(c2ccccc2)C[N@H+](Cc2ccccc2)CCO1	ZINC000031947455	361722427	/nfs/dbraw/zinc/72/24/27/361722427.db2.gz	IUEKXKKLULRIKE-KRWDZBQOSA-N	1	1	269.344	2.364	40	0		CEABMO
O[C@@]1(c2ccccc2)C[N@@H+](Cc2ccccc2)CCO1	ZINC000031947455	361722430	/nfs/dbraw/zinc/72/24/30/361722430.db2.gz	IUEKXKKLULRIKE-KRWDZBQOSA-N	1	1	269.344	2.364	40	0		CEABMO
C[NH+]1CCN(c2nc(-c3cccc(N)c3)cs2)CC1	ZINC000095097227	364339970	/nfs/dbraw/zinc/33/99/70/364339970.db2.gz	SBHXRIWTRDMPNF-UHFFFAOYSA-N	1	1	274.393	2.144	40	0		CEABMO
C[N@H+]1CC[C@@H]2[C@@H]1CCN2C(=O)c1ccc2[nH]ccc2c1	ZINC000096184252	364406371	/nfs/dbraw/zinc/40/63/71/364406371.db2.gz	BPIMRLWNTBFWRJ-LSDHHAIUSA-N	1	1	269.348	2.087	40	0		CEABMO
CC(C)C[N@H+]1CC[C@@H]2[C@@H]1CCN2Cc1nccs1	ZINC000096184266	364407608	/nfs/dbraw/zinc/40/76/08/364407608.db2.gz	KLWJCTJXSVBLCV-QWHCGFSZSA-N	1	1	265.426	2.448	40	0		CEABMO
c1cc(C[N@H+]2CCc3ncnc(N4CCCC4)c3CC2)co1	ZINC000096058716	364400618	/nfs/dbraw/zinc/40/06/18/364400618.db2.gz	UMJTWYOYBMMAGF-UHFFFAOYSA-N	1	1	298.390	2.271	40	0		CEABMO
COC[C@H]1CN(C)C[C@@]12CC[N@H+](Cc1ccccc1C)C2	ZINC000096220051	364414895	/nfs/dbraw/zinc/41/48/95/364414895.db2.gz	ZWQIIRZOMQBFRO-QZTJIDSGSA-N	1	1	288.435	2.395	40	0		CEABMO
COC[C@H]1CN(C)C[C@@]12CC[N@@H+](Cc1ccccc1C)C2	ZINC000096220051	364414901	/nfs/dbraw/zinc/41/49/01/364414901.db2.gz	ZWQIIRZOMQBFRO-QZTJIDSGSA-N	1	1	288.435	2.395	40	0		CEABMO
Cc1nc(N2CCCC2)nc2c1C[N@@H+](CC(C)C)CC2	ZINC000096253839	364416838	/nfs/dbraw/zinc/41/68/38/364416838.db2.gz	BPKALYZURQVCBC-UHFFFAOYSA-N	1	1	274.412	2.399	40	0		CEABMO
CN1CCO[C@@]2(CCC[N@@H+](Cc3cccs3)C2)C1	ZINC000096268627	364420223	/nfs/dbraw/zinc/42/02/23/364420223.db2.gz	AQSFSFPAVZSNHN-AWEZNQCLSA-N	1	1	266.410	2.045	40	0		CEABMO
COCC[N@H+]1CCC[C@]2(CN(CC3CCCCC3)C2=O)C1	ZINC000585099402	367177182	/nfs/dbraw/zinc/17/71/82/367177182.db2.gz	ICUHPWCSWBVVHO-QGZVFWFLSA-N	1	1	294.439	2.138	40	0		CEABMO
Cn1ccc(C(=O)N2CCC[C@]23CCC[N@@H+](C)CC3)c1	ZINC000585100056	367177394	/nfs/dbraw/zinc/17/73/94/367177394.db2.gz	DLARTBVCBMKICX-INIZCTEOSA-N	1	1	275.396	2.116	40	0		CEABMO
CC[N@H+]1CC[C@H]2COC(=O)N2c2cc(F)ccc2C1	ZINC000225484272	370298469	/nfs/dbraw/zinc/29/84/69/370298469.db2.gz	HNJNIPOBPMSQPD-LBPRGKRZSA-N	1	1	264.300	2.377	40	0	biogenic,in-vitro	CEABMO
CCCn1nccc1C[NH2+]Cc1cc(C)nn1CCC	ZINC000256054500	190005365	/nfs/dbraw/zinc/00/53/65/190005365.db2.gz	WPDLMDAZRZLUFW-UHFFFAOYSA-N	1	1	275.400	2.498	40	0		CEABMO
CC(C)n1cc(C[NH2+]Cc2ccnn2C(F)F)cn1	ZINC000256049814	190003363	/nfs/dbraw/zinc/00/33/63/190003363.db2.gz	BNVLYRCBPRMGIN-UHFFFAOYSA-N	1	1	269.299	2.345	40	0		CEABMO
CC(C)Cn1cc(C[NH2+]Cc2ccnn2C(F)F)cn1	ZINC000256055245	190005730	/nfs/dbraw/zinc/00/57/30/190005730.db2.gz	ZWMLSIRRYUUQEY-UHFFFAOYSA-N	1	1	283.326	2.421	40	0		CEABMO
Cc1cc(C[N@@H+]2CC[C@H](c3nc(C)cc(C)n3)C2)no1	ZINC000257214287	190013228	/nfs/dbraw/zinc/01/32/28/190013228.db2.gz	CLKQFTCDHHUNEZ-ZDUSSCGKSA-N	1	1	272.352	2.379	40	0		CEABMO
Cc1cc(C[N@H+]2CC[C@H](c3nc(C)cc(C)n3)C2)no1	ZINC000257214287	190013229	/nfs/dbraw/zinc/01/32/29/190013229.db2.gz	CLKQFTCDHHUNEZ-ZDUSSCGKSA-N	1	1	272.352	2.379	40	0		CEABMO
Cc1c[nH]c([C@H]2CCC[N@H+](Cc3cccn3C)C2)n1	ZINC000257257592	190021682	/nfs/dbraw/zinc/02/16/82/190021682.db2.gz	KQHRQTRASQKBDO-ZDUSSCGKSA-N	1	1	258.369	2.436	40	0		CEABMO
CC(C)[N@H+]1CC[C@H](Cc2cnc(-c3ccnn3C)cn2)C1	ZINC000257282213	190026296	/nfs/dbraw/zinc/02/62/96/190026296.db2.gz	OSXIFUZPJAPSAX-CYBMUJFWSA-N	1	1	285.395	2.150	40	0		CEABMO
Cc1c[nH]nc1[C@H]1CCC[N@@H+](Cc2[nH]cnc2C)C1	ZINC000257282237	190026402	/nfs/dbraw/zinc/02/64/02/190026402.db2.gz	OSZCTUCPMDXIKM-LBPRGKRZSA-N	1	1	259.357	2.129	40	0		CEABMO
OC1(C[N@H+]2CCC[C@H]2c2cnccn2)CCCCC1	ZINC000257299419	190029791	/nfs/dbraw/zinc/02/97/91/190029791.db2.gz	RPZXYGIIZGFEHF-AWEZNQCLSA-N	1	1	261.369	2.309	40	0		CEABMO
Cn1ccnc1C[NH+]1CCC(Cc2ccncc2)CC1	ZINC000257310120	190032082	/nfs/dbraw/zinc/03/20/82/190032082.db2.gz	UDTMMVHHIUHGCZ-UHFFFAOYSA-N	1	1	270.380	2.270	40	0		CEABMO
Cc1c[nH]c([C@H]2CC[N@@H+](Cc3cccc(C)n3)C2)n1	ZINC000257314832	190032652	/nfs/dbraw/zinc/03/26/52/190032652.db2.gz	UYQYGLOYQGJEBG-ZDUSSCGKSA-N	1	1	256.353	2.411	40	0		CEABMO
Cc1c[nH]nc1[C@@H]1CCC[N@H+](Cc2cccn2C)C1	ZINC000257344014	190037685	/nfs/dbraw/zinc/03/76/85/190037685.db2.gz	ZVLBDGVHJKFUBZ-CYBMUJFWSA-N	1	1	258.369	2.436	40	0		CEABMO
COC(=O)[C@@H]1C[C@@H]2c3cccc4[nH]cc(c43)C[C@H]2[N@@H+](C)C1	ZINC000029483539	394482656	/nfs/dbraw/zinc/48/26/56/394482656.db2.gz	OSKZYLPFYNARRX-UXIGCNINSA-N	1	1	284.359	2.301	40	0		CEABMO
COC(=O)[C@H]1C[N@@H+](C)C[C@H]1c1cccc(Cl)c1	ZINC000242495900	394495854	/nfs/dbraw/zinc/49/58/54/394495854.db2.gz	GRUWZCAOPKGXBQ-RYUDHWBXSA-N	1	1	253.729	2.158	40	0		CEABMO
CC[N@H+]1CCC[C@H]1c1cnc(N2CCOCC2)c(C)c1	ZINC000072219332	394593249	/nfs/dbraw/zinc/59/32/49/394593249.db2.gz	IRALUGSUEXLGFR-HNNXBMFYSA-N	1	1	275.396	2.383	40	0		CEABMO
Cc1cc(N(C)C)[nH+]cc1CNC(=O)OC(C)(C)C	ZINC000072223101	394594266	/nfs/dbraw/zinc/59/42/66/394594266.db2.gz	BDCMQAMKDVYAOH-UHFFFAOYSA-N	1	1	265.357	2.481	40	0		CEABMO
CCOc1cc([C@@H]([NH3+])c2nnc(C(C)C)[nH]2)ccc1OC	ZINC000095534365	394673474	/nfs/dbraw/zinc/67/34/74/394673474.db2.gz	QFBOQUIJVIBLBC-CYBMUJFWSA-N	1	1	290.367	2.384	40	0		CEABMO
Fc1ccc(C[N@H+]2CC[C@H]3[C@H]2CCN3c2ncccn2)cc1	ZINC000096055849	394675238	/nfs/dbraw/zinc/67/52/38/394675238.db2.gz	XHBUQLORAMXZJA-CVEARBPZSA-N	1	1	298.365	2.469	40	0		CEABMO
C[N@@H+]1[C@@H]2CC[C@H]1CC(OC(=O)c1ccc(O)cc1)C2	ZINC000004773077	170014857	/nfs/dbraw/zinc/01/48/57/170014857.db2.gz	VXNQEEYJSNEORM-ONXXMXGDSA-N	1	1	261.321	2.174	40	0		CEABMO
Cc1ccc(NC(=O)NC[C@@H]2CCC[N@H+](C)C2)cc1	ZINC000009876597	170388466	/nfs/dbraw/zinc/38/84/66/170388466.db2.gz	BERVLBQEFXJNPB-ZDUSSCGKSA-N	1	1	261.369	2.458	40	0		CEABMO
C[N@H+]1CCC[C@H](CNC(=S)Nc2ccc(F)cc2)C1	ZINC000009876286	170388539	/nfs/dbraw/zinc/38/85/39/170388539.db2.gz	DCZCCACBTACIPT-LLVKDONJSA-N	1	1	281.400	2.454	40	0		CEABMO
C[C@H]1CCC[N@@H+]([C@@H](CN)c2ccc3c(c2)CCO3)C1	ZINC000037363647	173152291	/nfs/dbraw/zinc/15/22/91/173152291.db2.gz	KTBRIIPUKAOJDI-WFASDCNBSA-N	1	1	260.381	2.353	40	0		CEABMO
C[C@H]1CCC[N@H+]([C@@H](CN)c2ccc3c(c2)CCO3)C1	ZINC000037363647	173152293	/nfs/dbraw/zinc/15/22/93/173152293.db2.gz	KTBRIIPUKAOJDI-WFASDCNBSA-N	1	1	260.381	2.353	40	0		CEABMO
C[N@H+]1CCC[C@@H](c2cncc(Nc3ccccn3)n2)C1	ZINC000072354313	176374667	/nfs/dbraw/zinc/37/46/67/176374667.db2.gz	IQAMLWZONWLZML-GFCCVEGCSA-N	1	1	269.352	2.424	40	0		CEABMO
C[N@H+]1CCC[C@H](c2nccnc2Nc2nccs2)C1	ZINC000072364725	176379812	/nfs/dbraw/zinc/37/98/12/176379812.db2.gz	ONSQBBYKCJNLRL-JTQLQIEISA-N	1	1	275.381	2.486	40	0		CEABMO
CNc1cncc([C@H]2CCC[N@H+]2CC2CCOCC2)n1	ZINC000072386144	176391239	/nfs/dbraw/zinc/39/12/39/176391239.db2.gz	KOCHMYYWFWBQEA-CQSZACIVSA-N	1	1	276.384	2.082	40	0		CEABMO
CNc1ccc(C[C@@H]2CCC[N@@H+](Cc3ccncc3)C2)nn1	ZINC000072387305	176392487	/nfs/dbraw/zinc/39/24/87/176392487.db2.gz	GNELTGSHCDFXEZ-HNNXBMFYSA-N	1	1	297.406	2.368	40	0		CEABMO
C[N@H+]1CCC[C@@H](c2cccc(NC3CCOCC3)n2)C1	ZINC000072386972	176392549	/nfs/dbraw/zinc/39/25/49/176392549.db2.gz	XUUMKHWIMUAXPE-CYBMUJFWSA-N	1	1	275.396	2.482	40	0		CEABMO
COc1ccc(N2C(=O)[C@@H]([NH3+])[C@H]2c2ccccc2)cc1	ZINC000015014828	274112880	/nfs/dbraw/zinc/11/28/80/274112880.db2.gz	XTSXQGSRHGCKDD-LSDHHAIUSA-N	1	1	268.316	2.110	40	0		CEABMO
C(C1CCCCC1)[N@H+]1CCC[C@H]1c1nnc2n1CCNC2	ZINC000019705505	275389990	/nfs/dbraw/zinc/38/99/90/275389990.db2.gz	ZCCXUVULJFCERL-AWEZNQCLSA-N	1	1	289.427	2.099	40	0		CEABMO
CCO[C@H]1C[N@@H+](Cc2scnc2C)[C@@H]2CCCO[C@@H]21	ZINC000107207307	276360144	/nfs/dbraw/zinc/36/01/44/276360144.db2.gz	MATZKZKNIXWPCL-DYEKYZERSA-N	1	1	282.409	2.220	40	0		CEABMO
Cc1ccc2c(n1)N(CC1CC1)CC[N@H+]([C@H]1CCOC1)C2	ZINC000107215291	281136780	/nfs/dbraw/zinc/13/67/80/281136780.db2.gz	XLMDXNIQMYPJRK-INIZCTEOSA-N	1	1	287.407	2.211	40	0		CEABMO
Cc1ccc2c(n1)N(CC1CC1)CC[N@@H+]([C@H]1CCOC1)C2	ZINC000107215291	281136782	/nfs/dbraw/zinc/13/67/82/281136782.db2.gz	XLMDXNIQMYPJRK-INIZCTEOSA-N	1	1	287.407	2.211	40	0		CEABMO
CC[C@@H]1[N@@H+](Cc2ccco2)CCC[C@]12CCC(=O)N2	ZINC000096038490	185069352	/nfs/dbraw/zinc/06/93/52/185069352.db2.gz	KPPFYYLQBYBTLG-ZFWWWQNUSA-N	1	1	262.353	2.303	40	0		CEABMO
CC(C)C[N@H+]1C[C@@H](OCc2ccccn2)[C@H]2OCCC[C@H]21	ZINC000096042556	185070090	/nfs/dbraw/zinc/07/00/90/185070090.db2.gz	KOZXAIHNEUVMOG-ZACQAIPSSA-N	1	1	290.407	2.486	40	0		CEABMO
c1cc(C[NH+]2C[C@H]3CN(Cc4ccccn4)C[C@@H]3C2)co1	ZINC000096053784	185074983	/nfs/dbraw/zinc/07/49/83/185074983.db2.gz	CVYSNAJBYFRQLK-HOTGVXAUSA-N	1	1	283.375	2.238	40	0		CEABMO
c1csc(C[N@@H+]2C[C@H]3CN(c4ncccn4)C[C@H]3C2)c1	ZINC000096053982	185075444	/nfs/dbraw/zinc/07/54/44/185075444.db2.gz	ANIIWYBBFQLODF-BETUJISGSA-N	1	1	286.404	2.106	40	0		CEABMO
CN1C(=O)CC[C@@H]2[C@H]1CC[N@H+]2Cc1ccc(F)cc1	ZINC000096056467	185077504	/nfs/dbraw/zinc/07/75/04/185077504.db2.gz	XYCBHOGUNAKMPR-ZIAGYGMSSA-N	1	1	262.328	2.021	40	0		CEABMO
COC[C@@]12CCCO[C@@H]1CC[N@@H+](Cc1cccnc1)C2	ZINC000096056723	185077809	/nfs/dbraw/zinc/07/78/09/185077809.db2.gz	MUKJZWFPHMTUTQ-CVEARBPZSA-N	1	1	276.380	2.099	40	0		CEABMO
CCOC[C@@H]1C[N@@H+](CC2CC2)Cc2cn(CC)nc21	ZINC000096059922	185080926	/nfs/dbraw/zinc/08/09/26/185080926.db2.gz	ASDXBXUSYRDNSR-AWEZNQCLSA-N	1	1	263.385	2.249	40	0		CEABMO
C[C@H]1C[C@H]2C[N@@H+](Cc3ccc4c(c3)OCO4)CC[C@H]2O1	ZINC000096066460	185084273	/nfs/dbraw/zinc/08/42/73/185084273.db2.gz	MNAWBLXHYPBYCP-FPMFFAJLSA-N	1	1	275.348	2.415	40	0		CEABMO
COC[C@]12COC[C@H]1C[N@@H+](Cc1ccc3ccccc3n1)C2	ZINC000096108641	185099524	/nfs/dbraw/zinc/09/95/24/185099524.db2.gz	JVVYNXVQGSBEDW-CRAIPNDOSA-N	1	1	298.386	2.330	40	0		CEABMO
COC(=O)[C@@H]1C[N@@H+](C)C[C@H]1c1ccc(Cl)cc1	ZINC000209230716	344530294	/nfs/dbraw/zinc/53/02/94/344530294.db2.gz	VXRLOWUNYIQIGZ-NWDGAFQWSA-N	1	1	253.729	2.158	40	0		CEABMO
Cc1nc(N[C@H](C)CO)cc(N2CCc3ccccc3C2)[nH+]1	ZINC000328960471	344758403	/nfs/dbraw/zinc/75/84/03/344758403.db2.gz	AYFXUGFJUPCMHS-GFCCVEGCSA-N	1	1	298.390	2.140	40	0		CEABMO
CC(C)CC[N@H+]1C[C@@H]2CN(c3ncccn3)CC[C@@H]21	ZINC000585107982	345005769	/nfs/dbraw/zinc/00/57/69/345005769.db2.gz	PYXNWZCQMGQFSB-KGLIPLIRSA-N	1	1	260.385	2.033	40	0		CEABMO
Cc1cnc([C@@H]2C[N@@H+](C3CCCCC3)CCO2)cn1	ZINC000585180719	345009343	/nfs/dbraw/zinc/00/93/43/345009343.db2.gz	DXEQOYDSRYQJIV-HNNXBMFYSA-N	1	1	261.369	2.491	40	0		CEABMO
Cc1cnc([C@@H]2C[N@H+](C3CCCCC3)CCO2)cn1	ZINC000585180719	345009344	/nfs/dbraw/zinc/00/93/44/345009344.db2.gz	DXEQOYDSRYQJIV-HNNXBMFYSA-N	1	1	261.369	2.491	40	0		CEABMO
COc1cccc(CCCNC(=O)[C@@H]2CCC[N@@H+](C)C2)c1	ZINC000073306978	363209490	/nfs/dbraw/zinc/20/94/90/363209490.db2.gz	CDYHDGZVDLWOIG-OAHLLOKOSA-N	1	1	290.407	2.086	40	0		CEABMO
COC(=O)[C@]12CCC[C@H]1C[N@@H+](Cc1ccccc1)C2	ZINC000001437838	361206350	/nfs/dbraw/zinc/20/63/50/361206350.db2.gz	DFKYQTUJTMSPII-HOCLYGCPSA-N	1	1	259.349	2.462	40	0		CEABMO
COC(=O)[C@H](c1ccccc1)[C@@]1(O)C[C@@H](C)[N@@H+](C)C[C@@H]1C	ZINC000013122902	361419073	/nfs/dbraw/zinc/41/90/73/361419073.db2.gz	XGFOAXWEGYBKCA-UICACZKSSA-N	1	1	291.391	2.034	40	0		CEABMO
CC[NH+](CC)[C@H](CN)c1cc(OC)cc(OC)c1	ZINC000019840874	361560980	/nfs/dbraw/zinc/56/09/80/361560980.db2.gz	JTGMSFFSSBPGRA-CQSZACIVSA-N	1	1	252.358	2.045	40	0		CEABMO
CCc1noc(C)c1C(=O)NCC[N@@H+]1C[C@H](C)C[C@H](C)C1	ZINC000019521279	361541347	/nfs/dbraw/zinc/54/13/47/361541347.db2.gz	NHUFTFRNDTUMSC-TXEJJXNPSA-N	1	1	293.411	2.253	40	0		CEABMO
CCSc1nc(=NN)c2c3c(sc2[nH]1)C[N@H+](C)CC3	ZINC000019882135	361565054	/nfs/dbraw/zinc/56/50/54/361565054.db2.gz	JAMZSUVBVZQBGW-UHFFFAOYSA-N	1	1	295.437	2.077	40	0		CEABMO
COc1ccccc1CN1C[C@H]2CCC[N@H+]2C[C@@H]1C	ZINC000019575792	361543707	/nfs/dbraw/zinc/54/37/07/361543707.db2.gz	KCENCVINDMTRRT-DZGCQCFKSA-N	1	1	260.381	2.364	40	0		CEABMO
Cc1ccc(OC[C@@H](O)C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1C	ZINC000019607322	361545748	/nfs/dbraw/zinc/54/57/48/361545748.db2.gz	QUVZIQUWTPJJTD-OAGGEKHMSA-N	1	1	293.407	2.152	40	0		CEABMO
C[NH+](C)[C@H](C(=O)NCC1(C)COC1)c1ccc(Cl)cc1	ZINC000019656182	361546940	/nfs/dbraw/zinc/54/69/40/361546940.db2.gz	ADNHNGTVOSYISS-ZDUSSCGKSA-N	1	1	296.798	2.095	40	0		CEABMO
CC[NH+](CC)CCN[C@H](C)C(=O)N1[C@H](C)CCC[C@@H]1C	ZINC000022931231	361590938	/nfs/dbraw/zinc/59/09/38/361590938.db2.gz	CXSVMOSHBAQULZ-QLFBSQMISA-N	1	1	283.460	2.096	40	0		CEABMO
Cc1ccc2cc(CNCC[NH+]3CCCC3)c(=O)[nH]c2c1	ZINC000023247906	361596642	/nfs/dbraw/zinc/59/66/42/361596642.db2.gz	FRNNTPMCWPFBRE-UHFFFAOYSA-N	1	1	285.391	2.022	40	0		CEABMO
c1cc(CN2CC[C@H]3[C@H]2CC[N@@H+]3CC2CCOCC2)co1	ZINC000096055807	364400086	/nfs/dbraw/zinc/40/00/86/364400086.db2.gz	GAXMHOMYLBQFGP-DLBZAZTESA-N	1	1	290.407	2.355	40	0		CEABMO
Cc1cnc(N2CC[C@@]3(CCC[N@H+]3CC3CC3)C2)nc1	ZINC000096203051	364410431	/nfs/dbraw/zinc/41/04/31/364410431.db2.gz	POHHTZHUTRRTBT-INIZCTEOSA-N	1	1	272.396	2.240	40	0		CEABMO
c1coc(C[N@@H+]2C[C@@H]3COC[C@]3(CNc3ccccn3)C2)c1	ZINC000096220551	364414594	/nfs/dbraw/zinc/41/45/94/364414594.db2.gz	PKNIGGQFKYXCPO-PBHICJAKSA-N	1	1	299.374	2.235	40	0		CEABMO
COc1ncnc2c1CC[N@@H+](Cc1ccc(C)s1)CC2	ZINC000096255560	364418867	/nfs/dbraw/zinc/41/88/67/364418867.db2.gz	JPJQLJFDQAJOTG-UHFFFAOYSA-N	1	1	289.404	2.456	40	0		CEABMO
C[N@H+]1CC[C@]2(CCN(C(=O)C3CCCCC3)C2)C1	ZINC000096268644	364420874	/nfs/dbraw/zinc/42/08/74/364420874.db2.gz	RLWOFVCKJCIBQM-HNNXBMFYSA-N	1	1	250.386	2.121	40	0		CEABMO
CN1C[C@]2(CCC[N@@H+](CC3CCCCC3)C2)C1=O	ZINC000585099351	367177892	/nfs/dbraw/zinc/17/78/92/367177892.db2.gz	GXCCMVQNPAVUCT-HNNXBMFYSA-N	1	1	250.386	2.121	40	0		CEABMO
CCOc1ccccc1C(=O)N1CCC[C@]2(CC[N@H+]2C)C1	ZINC000585101931	367177990	/nfs/dbraw/zinc/17/79/90/367177990.db2.gz	LWLLRDWMCMXZMY-KRWDZBQOSA-N	1	1	288.391	2.396	40	0		CEABMO
COC(=O)[C@H]([NH3+])[C@@H](C)Sc1ccc(Cl)cc1	ZINC000169726755	367371054	/nfs/dbraw/zinc/37/10/54/367371054.db2.gz	VLQBMHHVFGIEPR-GMSGAONNSA-N	1	1	259.758	2.321	40	0		CEABMO
COc1ccccc1C[NH+]1CC2(C1)C[C@H](OC)CS2	ZINC000248132525	371163358	/nfs/dbraw/zinc/16/33/58/371163358.db2.gz	LMLJJINXLFDGNA-ZDUSSCGKSA-N	1	1	279.405	2.402	40	0		CEABMO
CC1(c2nccs2)CC[NH+](Cc2c[nH]cn2)CC1	ZINC000257257145	190021347	/nfs/dbraw/zinc/02/13/47/190021347.db2.gz	KOFRPOIYECEVGO-UHFFFAOYSA-N	1	1	262.382	2.420	40	0		CEABMO
O[C@@H]1CCCOC12CC[NH+](Cc1cc(F)ccc1F)CC2	ZINC000257282871	190026327	/nfs/dbraw/zinc/02/63/27/190026327.db2.gz	OVQAIWBYJHKITB-OAHLLOKOSA-N	1	1	297.345	2.471	40	0		CEABMO
C[N@H+]1CCCC[C@@H]1c1cncc(NCC2CCOCC2)n1	ZINC000257314721	190032869	/nfs/dbraw/zinc/03/28/69/190032869.db2.gz	UYEHIZZCPBIONY-OAHLLOKOSA-N	1	1	290.411	2.472	40	0		CEABMO
CC(C)[N@H+]1C[C@@H]2Cc3nc(NCC4CC4)ncc3[C@@H]2C1	ZINC000306144973	394513636	/nfs/dbraw/zinc/51/36/36/394513636.db2.gz	ZTUHRCQNILDEKU-GXTWGEPZSA-N	1	1	272.396	2.278	40	0		CEABMO
COc1ccc([C@@H]2[C@@H]([NH3+])C(=O)N2c2ccc(C)cc2)cc1	ZINC000039189387	394498889	/nfs/dbraw/zinc/49/88/89/394498889.db2.gz	HKRXNPCMTVJDJM-HZPDHXFCSA-N	1	1	282.343	2.419	40	0		CEABMO
CC[N@@H+]1CCCC[C@@H]1c1ccc(N2CCN(C)CC2)nc1	ZINC000072216538	394593182	/nfs/dbraw/zinc/59/31/82/394593182.db2.gz	XKJDOOTVQLVMMU-MRXNPFEDSA-N	1	1	288.439	2.380	40	0		CEABMO
CC[N@H+]1CCCC[C@@H]1c1ccc(N2CCN(C)CC2)nc1	ZINC000072216538	394593186	/nfs/dbraw/zinc/59/31/86/394593186.db2.gz	XKJDOOTVQLVMMU-MRXNPFEDSA-N	1	1	288.439	2.380	40	0		CEABMO
COc1cccc([C@H]2[C@@H]([NH3+])C(=O)N2Cc2ccccc2)c1	ZINC000072228145	394596142	/nfs/dbraw/zinc/59/61/42/394596142.db2.gz	ZXWJWTCOHDJEDI-CVEARBPZSA-N	1	1	282.343	2.106	40	0		CEABMO
COc1cccc([C@H]2[C@@H]([NH3+])C(=O)N2c2ccc(C)cc2)c1	ZINC000072227461	394596557	/nfs/dbraw/zinc/59/65/57/394596557.db2.gz	DLDMZBPFWPHYBU-CVEARBPZSA-N	1	1	282.343	2.419	40	0		CEABMO
CCOc1ccc([C@H]([NH3+])c2nnc(C(C)C)[nH]2)cc1OC	ZINC000095534220	394672860	/nfs/dbraw/zinc/67/28/60/394672860.db2.gz	LBLRLGINSKOJIV-ZDUSSCGKSA-N	1	1	290.367	2.384	40	0		CEABMO
c1ccc(O[C@H]2COCC[N@@H+](Cc3cccnc3)C2)cc1	ZINC000096296488	394678963	/nfs/dbraw/zinc/67/89/63/394678963.db2.gz	HDHMLDGTBNBVDG-QGZVFWFLSA-N	1	1	284.359	2.361	40	0	biogenic,in-vitro	CEABMO
c1ccc(O[C@H]2COCC[N@H+](Cc3cccnc3)C2)cc1	ZINC000096296488	394678966	/nfs/dbraw/zinc/67/89/66/394678966.db2.gz	HDHMLDGTBNBVDG-QGZVFWFLSA-N	1	1	284.359	2.361	40	0	biogenic,in-vitro	CEABMO
COc1ccc([C@H]2CN(C(C)=O)[C@@H]3CCC[N@@H+](C)[C@@H]32)cc1	ZINC000257252997	286378593	/nfs/dbraw/zinc/37/85/93/286378593.db2.gz	JXDFFWGOKYYFHE-BRWVUGGUSA-N	1	1	288.391	2.104	40	0		CEABMO
CCc1ccc(OC)c(C(=O)N2CC[NH+](CC)CC2)c1	ZINC000072206493	176342418	/nfs/dbraw/zinc/34/24/18/176342418.db2.gz	RDIMSONAMFULHT-UHFFFAOYSA-N	1	1	276.380	2.035	40	0		CEABMO
Cc1cccc(C[N@@H+]2CCCN(C(=O)C3CCC3)CC2)n1	ZINC000072351023	176373419	/nfs/dbraw/zinc/37/34/19/176373419.db2.gz	YKUUBQNINIVPLO-UHFFFAOYSA-N	1	1	287.407	2.224	40	0		CEABMO
Cc1cccc(C[N@H+]2CCCN(C(=O)C3CCC3)CC2)n1	ZINC000072351023	176373421	/nfs/dbraw/zinc/37/34/21/176373421.db2.gz	YKUUBQNINIVPLO-UHFFFAOYSA-N	1	1	287.407	2.224	40	0		CEABMO
O=C1NCC[NH2+][C@@H]1Cc1ccccc1-c1ccc(F)cc1	ZINC000072352865	176374052	/nfs/dbraw/zinc/37/40/52/176374052.db2.gz	PBYAARISYWMKCB-MRXNPFEDSA-N	1	1	284.334	2.123	40	0		CEABMO
CC(=O)N1CCC[C@@H](CCc2cc[nH+]c(N(C)C)c2)C1	ZINC000072381123	176387749	/nfs/dbraw/zinc/38/77/49/176387749.db2.gz	YPQYMJBNPQZQJW-HNNXBMFYSA-N	1	1	275.396	2.339	40	0		CEABMO
Cc1cc(Nc2ncccn2)nc([C@H]2CCC[N@H+]2C)n1	ZINC000072382348	176388274	/nfs/dbraw/zinc/38/82/74/176388274.db2.gz	CIWOAGHMYPQUCG-LLVKDONJSA-N	1	1	270.340	2.085	40	0		CEABMO
Cc1cc(Nc2ncccn2)nc([C@H]2CCC[N@@H+]2C)n1	ZINC000072382348	176388276	/nfs/dbraw/zinc/38/82/76/176388276.db2.gz	CIWOAGHMYPQUCG-LLVKDONJSA-N	1	1	270.340	2.085	40	0		CEABMO
C[N@H+]1CCC[C@@H](C(=O)NCCSCc2ccccc2)C1	ZINC000078578508	177356243	/nfs/dbraw/zinc/35/62/43/177356243.db2.gz	GWMBJIYUXPRHEP-OAHLLOKOSA-N	1	1	292.448	2.378	40	0		CEABMO
C[C@@H]1CCCC[N@H+]1[C@H]1CC(=O)N(c2ccccc2)C1=O	ZINC000248127803	274287098	/nfs/dbraw/zinc/28/70/98/274287098.db2.gz	XOJZOOPMSCPKHK-OCCSQVGLSA-N	1	1	272.348	2.193	40	0		CEABMO
C[C@H](CO)Nc1nc(N2CCc3ccccc3[C@@H]2C)cc[nH+]1	ZINC000328982538	274494528	/nfs/dbraw/zinc/49/45/28/274494528.db2.gz	HBKRCAADMVSRQT-OLZOCXBDSA-N	1	1	298.390	2.393	40	0		CEABMO
C[N@@H+]1CCC[C@H]1c1nc(-c2ccnc(N3CCCC3)c2)no1	ZINC000035426331	277082778	/nfs/dbraw/zinc/08/27/78/277082778.db2.gz	VYWGJOVKLNQUGA-ZDUSSCGKSA-N	1	1	299.378	2.499	40	0	biogenic,in-vitro	CEABMO
C[N@H+]1CCC[C@H]1c1nc(-c2ccnc(N3CCCC3)c2)no1	ZINC000035426331	277082780	/nfs/dbraw/zinc/08/27/80/277082780.db2.gz	VYWGJOVKLNQUGA-ZDUSSCGKSA-N	1	1	299.378	2.499	40	0	biogenic,in-vitro	CEABMO
Cc1ccc2c(n1)N(C)[C@H](CO)CC[N@H+](CCC(C)C)C2	ZINC000225494251	281136802	/nfs/dbraw/zinc/13/68/02/281136802.db2.gz	IVSTWUYTMHHKBS-INIZCTEOSA-N	1	1	291.439	2.439	40	0	biogenic,in-vitro	CEABMO
C(O[C@@H]1CC[C@H]2[C@H]1OCC[N@H+]2C1CCC1)C1CCOCC1	ZINC000096041662	185069926	/nfs/dbraw/zinc/06/99/26/185069926.db2.gz	PDFVFOVPZHPBLO-GVDBMIGSSA-N	1	1	295.423	2.214	40	0		CEABMO
c1cncc(C[N@H+]2CC[C@H]3C[C@H](c4ccncn4)O[C@@H]3C2)c1	ZINC000096046121	185071413	/nfs/dbraw/zinc/07/14/13/185071413.db2.gz	GNMKHTUKZWUTOC-USXIJHARSA-N	1	1	296.374	2.224	40	0		CEABMO
c1coc(CN2CCC3(C[C@@H]([NH+]4CCCC4)CO3)CC2)c1	ZINC000096047939	185072383	/nfs/dbraw/zinc/07/23/83/185072383.db2.gz	GOBAULULGVSJNM-OAHLLOKOSA-N	1	1	290.407	2.499	40	0		CEABMO
c1coc(CN2CCC3(C[C@H]([NH+]4CCCC4)CO3)CC2)c1	ZINC000096047938	185073661	/nfs/dbraw/zinc/07/36/61/185073661.db2.gz	GOBAULULGVSJNM-HNNXBMFYSA-N	1	1	290.407	2.499	40	0		CEABMO
O=C1[C@H]2C[N@@H+](Cc3ccncc3)C[C@H]2CN1c1ccsc1	ZINC000096053689	185074040	/nfs/dbraw/zinc/07/40/40/185074040.db2.gz	WANGWNSHGBCIGH-ZFWWWQNUSA-N	1	1	299.399	2.238	40	0		CEABMO
O=C1[C@H]2C[N@@H+](Cc3ccco3)C[C@@H]2CN1c1ccccc1	ZINC000096053571	185074272	/nfs/dbraw/zinc/07/42/72/185074272.db2.gz	BGDQONXEAPMOTO-CJNGLKHVSA-N	1	1	282.343	2.374	40	0		CEABMO
COC[C@]12CCCO[C@@H]1CC[N@@H+](Cc1cccnc1)C2	ZINC000096056724	185077049	/nfs/dbraw/zinc/07/70/49/185077049.db2.gz	MUKJZWFPHMTUTQ-HZPDHXFCSA-N	1	1	276.380	2.099	40	0		CEABMO
COC[C@H]1C[N@H+](Cc2cccs2)Cc2cnn(C)c21	ZINC000096060002	185079934	/nfs/dbraw/zinc/07/99/34/185079934.db2.gz	XXSQANJEYINRAE-GFCCVEGCSA-N	1	1	277.393	2.227	40	0		CEABMO
COC[C@H]1C[N@@H+](Cc2cccs2)Cc2cnn(C)c21	ZINC000096060002	185079936	/nfs/dbraw/zinc/07/99/36/185079936.db2.gz	XXSQANJEYINRAE-GFCCVEGCSA-N	1	1	277.393	2.227	40	0		CEABMO
C[N@H+]1CCC[C@@]12CCCN(C(=O)Cc1cccs1)C2	ZINC000096071402	185086601	/nfs/dbraw/zinc/08/66/01/185086601.db2.gz	ISPAALWOZRBGHF-HNNXBMFYSA-N	1	1	278.421	2.377	40	0		CEABMO
O=C(N1CCCC1)C12CC(C1)C[N@H+]2Cc1cccc(F)c1	ZINC000096083535	185092898	/nfs/dbraw/zinc/09/28/98/185092898.db2.gz	HQZWJKRPXXBPBQ-UHFFFAOYSA-N	1	1	288.366	2.413	40	0		CEABMO
O=C(N1CCCC1)C12CC(C1)C[N@@H+]2Cc1cccc(F)c1	ZINC000096083535	185092899	/nfs/dbraw/zinc/09/28/99/185092899.db2.gz	HQZWJKRPXXBPBQ-UHFFFAOYSA-N	1	1	288.366	2.413	40	0		CEABMO
COC[C@H]1COCCC12CC[NH+](Cc1nccs1)CC2	ZINC000096106255	185099010	/nfs/dbraw/zinc/09/90/10/185099010.db2.gz	XMLWOCNOCYRAIZ-ZDUSSCGKSA-N	1	1	296.436	2.408	40	0		CEABMO
CCOc1cccc(NC(=O)[C@@H]2CCC[N@@H+](C)C2)c1	ZINC000096629201	185107642	/nfs/dbraw/zinc/10/76/42/185107642.db2.gz	PQIJWKREXJLICT-GFCCVEGCSA-N	1	1	262.353	2.366	40	0		CEABMO
C[C@@H](CCN1C[C@@H]2C[C@@H](O)C[N@H+]2C[C@H]1C)c1ccccc1	ZINC000019575208	343374833	/nfs/dbraw/zinc/37/48/33/343374833.db2.gz	OQWLLWPCXDAZNO-CIRFHOKZSA-N	1	1	288.435	2.320	40	0		CEABMO
C[C@@H](CC[N@@H+]1C[C@@H]2C[C@@H](O)CN2C[C@H]1C)c1ccccc1	ZINC000019575208	343374836	/nfs/dbraw/zinc/37/48/36/343374836.db2.gz	OQWLLWPCXDAZNO-CIRFHOKZSA-N	1	1	288.435	2.320	40	0		CEABMO
C[C@@H](CC[N@H+]1C[C@@H]2C[C@@H](O)CN2C[C@H]1C)c1ccccc1	ZINC000019575208	343374839	/nfs/dbraw/zinc/37/48/39/343374839.db2.gz	OQWLLWPCXDAZNO-CIRFHOKZSA-N	1	1	288.435	2.320	40	0		CEABMO
COC(=O)C1CC[NH+](Cc2ccc(OC)c(F)c2)CC1	ZINC000047916517	362231920	/nfs/dbraw/zinc/23/19/20/362231920.db2.gz	NHCLUFRNAPVOBK-UHFFFAOYSA-N	1	1	281.327	2.219	40	0		CEABMO
OC[C@H]1CC[N@H+](Cc2ccc(Br)s2)C1	ZINC000051886906	362444688	/nfs/dbraw/zinc/44/46/88/362444688.db2.gz	IXLDBECTSVKLKO-QMMMGPOBSA-N	1	1	276.199	2.325	40	0		CEABMO
OC[C@H]1CC[N@@H+](Cc2ccc(Br)s2)C1	ZINC000051886906	362444693	/nfs/dbraw/zinc/44/46/93/362444693.db2.gz	IXLDBECTSVKLKO-QMMMGPOBSA-N	1	1	276.199	2.325	40	0		CEABMO
CCCOc1ccc(C(=O)OCC[N@@H+](C)CC)cc1N	ZINC000584578837	344959328	/nfs/dbraw/zinc/95/93/28/344959328.db2.gz	DBPXXZJFLFQDTO-UHFFFAOYSA-N	1	1	280.368	2.166	40	0		CEABMO
Cc1ccc(C[C@H]2CC[N@H+](Cc3cc[nH]n3)C[C@@H]2O)cc1	ZINC000585279714	345009918	/nfs/dbraw/zinc/00/99/18/345009918.db2.gz	XXOIRQGKOJEDLD-WBVHZDCISA-N	1	1	285.391	2.144	40	0		CEABMO
Cc1ccc(C[C@H]2CC[N@@H+](Cc3cc[nH]n3)C[C@@H]2O)cc1	ZINC000585279714	345009919	/nfs/dbraw/zinc/00/99/19/345009919.db2.gz	XXOIRQGKOJEDLD-WBVHZDCISA-N	1	1	285.391	2.144	40	0		CEABMO
CC[NH+](CC)C1(Cc2cc(-c3ccccn3)on2)COC1	ZINC000067898232	362931438	/nfs/dbraw/zinc/93/14/38/362931438.db2.gz	UGRGJCRVBAQIGY-UHFFFAOYSA-N	1	1	287.363	2.390	40	0	biogenic,in-vitro	CEABMO
c1cc(CN2CC[N@H+]3C[C@@H](OCC4CC4)C[C@@H]3C2)cs1	ZINC000107746640	186189220	/nfs/dbraw/zinc/18/92/20/186189220.db2.gz	YPRUUDNUVOBELJ-CVEARBPZSA-N	1	1	292.448	2.433	40	0		CEABMO
CNC(=O)[C@H]1CCC[C@@]12CC[N@@H+](Cc1cccs1)C2	ZINC000108534972	186222335	/nfs/dbraw/zinc/22/23/35/186222335.db2.gz	GHRGYHOTMDJJIQ-HIFRSBDPSA-N	1	1	278.421	2.486	40	0		CEABMO
CC[NH+]1CCN(C(=O)c2ccc3c(c2)CCCC3)CC1	ZINC000074946458	363424985	/nfs/dbraw/zinc/42/49/85/363424985.db2.gz	DDFNJGVWLRPUTN-UHFFFAOYSA-N	1	1	272.392	2.343	40	0		CEABMO
CCOc1ccc(C(=O)N2CC[NH+](C)CC2)cc1Cl	ZINC000074949304	363426149	/nfs/dbraw/zinc/42/61/49/363426149.db2.gz	UCFANSWTBWDWSZ-UHFFFAOYSA-N	1	1	282.771	2.126	40	0		CEABMO
CC(C)[N@H+](Cc1ccccc1)C[C@H]1CCCN1CCO	ZINC000079414268	363597543	/nfs/dbraw/zinc/59/75/43/363597543.db2.gz	RJKYNHGNVDGRTA-QGZVFWFLSA-N	1	1	276.424	2.354	40	0		CEABMO
CC(C)N(Cc1ccccc1)C[C@H]1CCC[N@@H+]1CCO	ZINC000079414268	363597545	/nfs/dbraw/zinc/59/75/45/363597545.db2.gz	RJKYNHGNVDGRTA-QGZVFWFLSA-N	1	1	276.424	2.354	40	0		CEABMO
CC(C)N(Cc1ccccc1)C[C@H]1CCC[N@H+]1CCO	ZINC000079414268	363597547	/nfs/dbraw/zinc/59/75/47/363597547.db2.gz	RJKYNHGNVDGRTA-QGZVFWFLSA-N	1	1	276.424	2.354	40	0		CEABMO
CCCNc1nc(N(CC)CC)nc(N(CC)CC)[nH+]1	ZINC000003099662	361263857	/nfs/dbraw/zinc/26/38/57/361263857.db2.gz	UGDDEEVHUCKKJA-UHFFFAOYSA-N	1	1	280.420	2.386	40	0		CEABMO
C[C@H]([NH+]1CCOCC1)[C@](O)(c1ccccc1)c1ccccn1	ZINC000013099523	361418161	/nfs/dbraw/zinc/41/81/61/361418161.db2.gz	RCUZQOAGXSJBDW-YJBOKZPZSA-N	1	1	298.386	2.038	40	0	in-vitro	CEABMO
Nc1ccccc1C(=O)N1CC[NH+](Cc2ccccc2)CC1	ZINC000019798187	361555533	/nfs/dbraw/zinc/55/55/33/361555533.db2.gz	CGHPGCCCJJTBAM-UHFFFAOYSA-N	1	1	295.386	2.227	40	0		CEABMO
CCOC[C@@H]1Cn2cncc2C[N@@H+](CC2CCC2)C1	ZINC000096207643	364410448	/nfs/dbraw/zinc/41/04/48/364410448.db2.gz	KVWINNQXAXBOER-AWEZNQCLSA-N	1	1	263.385	2.152	40	0		CEABMO
CCc1ncnc2c1CC[N@@H+](Cc1c(C)noc1C)CC2	ZINC000096255017	364418365	/nfs/dbraw/zinc/41/83/65/364418365.db2.gz	OEQPPUZTGDSEHN-UHFFFAOYSA-N	1	1	286.379	2.245	40	0		CEABMO
O=C(C1CC(F)C1)N1CC[C@@]2(CCC[N@H+]2CC2CC2)C1	ZINC000585099445	367177133	/nfs/dbraw/zinc/17/71/33/367177133.db2.gz	JQWITSVSWLRZDA-XUJLQICISA-N	1	1	280.387	2.211	40	0		CEABMO
CN(N)c1[nH+]cc(Br)c2ccccc21	ZINC000199544802	370148900	/nfs/dbraw/zinc/14/89/00/370148900.db2.gz	IVJGDIRGJGDWPT-UHFFFAOYSA-N	1	1	252.115	2.307	40	0		CEABMO
C[NH+]1CC2(C1)C[C@H](CCOCc1ccccn1)CCO2	ZINC000247965522	371150658	/nfs/dbraw/zinc/15/06/58/371150658.db2.gz	HKNWSAHYDAATGE-CQSZACIVSA-N	1	1	276.380	2.099	40	0		CEABMO
c1cc2n(c1)C[C@@H](Oc1ncccn1)C[N@H+](C1CCC1)C2	ZINC000253588371	371529886	/nfs/dbraw/zinc/52/98/86/371529886.db2.gz	ABYAVUPSOTWCIM-OAHLLOKOSA-N	1	1	284.363	2.094	40	0		CEABMO
COc1cc(C[NH2+]Cc2ccn(C(F)F)n2)ccc1O	ZINC000256052329	190004567	/nfs/dbraw/zinc/00/45/67/190004567.db2.gz	MWXSNJHFXCTCQW-UHFFFAOYSA-N	1	1	283.278	2.282	40	0		CEABMO
CCn1cc(C[NH2+]Cc2ccnn2C(F)F)c(C)n1	ZINC000256053609	190004639	/nfs/dbraw/zinc/00/46/39/190004639.db2.gz	SCBZZSSNHMNABG-UHFFFAOYSA-N	1	1	269.299	2.093	40	0		CEABMO
CN1CCC([N@H+]2CCC[C@@H](c3ccc4c[nH]nc4n3)C2)CC1	ZINC000257210089	190012133	/nfs/dbraw/zinc/01/21/33/190012133.db2.gz	BTCNHNCGMFUNGB-CQSZACIVSA-N	1	1	299.422	2.232	40	0		CEABMO
Cc1cncc(C[N@H+]2C[C@@H](O)[C@H](Oc3ccccc3)C2)c1	ZINC000257212847	190013025	/nfs/dbraw/zinc/01/30/25/190013025.db2.gz	CFFBYZCGAGOFBS-IAGOWNOFSA-N	1	1	284.359	2.014	40	0		CEABMO
CCn1cc(C[N@H+]2CCC[C@H](c3cc[nH]n3)C2)c(C)n1	ZINC000257213472	190013500	/nfs/dbraw/zinc/01/35/00/190013500.db2.gz	CHSKOOHPETVVGI-ZDUSSCGKSA-N	1	1	273.384	2.314	40	0		CEABMO
c1ccc(C[C@@H]2COCC[N@H+](C3CCOCC3)C2)cc1	ZINC000257226729	190015612	/nfs/dbraw/zinc/01/56/12/190015612.db2.gz	FLWHIFQLCQVPRJ-INIZCTEOSA-N	1	1	275.392	2.357	40	0		CEABMO
CNc1nccnc1C[C@H]1CCC[N@@H+](Cc2cccn2C)C1	ZINC000257233161	190016807	/nfs/dbraw/zinc/01/68/07/190016807.db2.gz	GOBNKKCHBHQBCW-CQSZACIVSA-N	1	1	299.422	2.312	40	0		CEABMO
CCn1nccc1-c1cc(C)nc([C@H]2CCC[N@@H+](C)C2)n1	ZINC000257235787	190016936	/nfs/dbraw/zinc/01/69/36/190016936.db2.gz	GZLNZXIDNNTHNX-ZDUSSCGKSA-N	1	1	285.395	2.478	40	0		CEABMO
CN1CCC([N@H+]2CC[C@H](c3ncn4ccsc34)C2)CC1	ZINC000257271880	190023981	/nfs/dbraw/zinc/02/39/81/190023981.db2.gz	NADWQYCGYOKNIZ-LBPRGKRZSA-N	1	1	290.436	2.279	40	0		CEABMO
C[NH+]1CCC(N2CC[C@H](c3ncn4ccsc34)C2)CC1	ZINC000257271880	190023982	/nfs/dbraw/zinc/02/39/82/190023982.db2.gz	NADWQYCGYOKNIZ-LBPRGKRZSA-N	1	1	290.436	2.279	40	0		CEABMO
Cc1nc[nH]c1C[N@H+]1CCC[C@@H](c2ccnc(C)n2)C1	ZINC000257288205	190027381	/nfs/dbraw/zinc/02/73/81/190027381.db2.gz	PTIDKTKHYIFMEA-CYBMUJFWSA-N	1	1	271.368	2.196	40	0		CEABMO
Cc1cc(-c2cc(C)nc([C@@H]3CCC[N@H+]3C)n2)n[nH]1	ZINC000257314191	190031784	/nfs/dbraw/zinc/03/17/84/190031784.db2.gz	UVRNTQRBKLMNBQ-ZDUSSCGKSA-N	1	1	257.341	2.250	40	0		CEABMO
Cc1cc(-c2cc(C)nc([C@@H]3CCC[N@@H+]3C)n2)n[nH]1	ZINC000257314191	190031785	/nfs/dbraw/zinc/03/17/85/190031785.db2.gz	UVRNTQRBKLMNBQ-ZDUSSCGKSA-N	1	1	257.341	2.250	40	0		CEABMO
CCCn1ccnc1C[N@@H+]1CCC[C@@H](Cc2cc[nH]n2)C1	ZINC000257296169	190028299	/nfs/dbraw/zinc/02/82/99/190028299.db2.gz	RBNBSYAIRVKEHB-AWEZNQCLSA-N	1	1	287.411	2.471	40	0		CEABMO
CCCn1ccnc1C[N@H+]1CCC[C@@H](Cc2cc[nH]n2)C1	ZINC000257296169	190028300	/nfs/dbraw/zinc/02/83/00/190028300.db2.gz	RBNBSYAIRVKEHB-AWEZNQCLSA-N	1	1	287.411	2.471	40	0		CEABMO
CCN1CCC([N@H+]2CC[C@H](c3nc(C)cn3C)C2)CC1	ZINC000257300402	190029980	/nfs/dbraw/zinc/02/99/80/190029980.db2.gz	RUDJNQLNRVCTMV-AWEZNQCLSA-N	1	1	276.428	2.002	40	0		CEABMO
O[C@H]1CC[N@@H+](Cc2ccc3ncccc3c2)C[C@@]12CCCO2	ZINC000257334775	190036124	/nfs/dbraw/zinc/03/61/24/190036124.db2.gz	YHIQMPRHJALORW-ROUUACIJSA-N	1	1	298.386	2.351	40	0		CEABMO
CCCCC(=O)N1CC2(C1)C[C@H](COCC)CC[N@H+]2C	ZINC000306126097	376541439	/nfs/dbraw/zinc/54/14/39/376541439.db2.gz	DMQGHXGKDVSOOM-CQSZACIVSA-N	1	1	282.428	2.136	40	0		CEABMO
COc1ccc(CC[NH2+][C@H]2CCCC[C@H]2N)cc1OC	ZINC000218854476	394457651	/nfs/dbraw/zinc/45/76/51/394457651.db2.gz	VYLYNSDJXFXCBX-KGLIPLIRSA-N	1	1	278.396	2.106	40	0		CEABMO
COc1cccc([C@@H]2[C@H]([NH3+])C(=O)N2c2cccc(C)c2)c1	ZINC000072227414	394595214	/nfs/dbraw/zinc/59/52/14/394595214.db2.gz	FBMKIGLWJDKQQE-JKSUJKDBSA-N	1	1	282.343	2.419	40	0		CEABMO
COc1cccc([C@H]2[C@@H]([NH3+])C(=O)N2c2ccccc2)c1	ZINC000072227361	394595588	/nfs/dbraw/zinc/59/55/88/394595588.db2.gz	JHEVKFFYJWGGPY-CABCVRRESA-N	1	1	268.316	2.110	40	0		CEABMO
COc1cccc([C@@H]2[C@H]([NH3+])C(=O)N2c2ccc(C)cc2)c1	ZINC000072227458	394596671	/nfs/dbraw/zinc/59/66/71/394596671.db2.gz	DLDMZBPFWPHYBU-JKSUJKDBSA-N	1	1	282.343	2.419	40	0		CEABMO
Cc1cc(F)ccc1C[N@@H+]1CC[C@@H]2OCCN(C)[C@H]2C1	ZINC000108528081	394732119	/nfs/dbraw/zinc/73/21/19/394732119.db2.gz	KTPWPEQSYMHQNB-HOTGVXAUSA-N	1	1	278.371	2.039	40	0		CEABMO
CCn1ncc2c1[C@@H](COC)C[N@H+](Cc1ccncc1)C2	ZINC000096060154	394675459	/nfs/dbraw/zinc/67/54/59/394675459.db2.gz	JNQROEFXPBSUOZ-OAHLLOKOSA-N	1	1	286.379	2.044	40	0		CEABMO
CCn1ncc2c1[C@@H](COC)C[N@@H+](Cc1ccncc1)C2	ZINC000096060154	394675460	/nfs/dbraw/zinc/67/54/60/394675460.db2.gz	JNQROEFXPBSUOZ-OAHLLOKOSA-N	1	1	286.379	2.044	40	0		CEABMO
Cc1cnc2cc(Cl)ccc2c1NCC[NH2+]CCO	ZINC000001700233	169744826	/nfs/dbraw/zinc/74/48/26/169744826.db2.gz	XGUHVRFNPDUDES-UHFFFAOYSA-N	1	1	279.771	2.190	40	0		CEABMO
COCCNC(=S)SCC[NH+](C(C)C)C(C)C	ZINC000005455009	170100682	/nfs/dbraw/zinc/10/06/82/170100682.db2.gz	VEUXVECNIJYNLD-UHFFFAOYSA-N	1	1	278.487	2.359	40	0		CEABMO
C[C@H]1C[N@H+]2CCC[C@@H]2CN1Cc1[nH]nnc1-c1ccccc1	ZINC000072324563	176369752	/nfs/dbraw/zinc/36/97/52/176369752.db2.gz	WUUMZCWPQSDLDY-DZGCQCFKSA-N	1	1	297.406	2.140	40	0		CEABMO
C[C@H]1C[N@@H+]2CCC[C@@H]2CN1Cc1n[nH]nc1-c1ccccc1	ZINC000072324563	176369753	/nfs/dbraw/zinc/36/97/53/176369753.db2.gz	WUUMZCWPQSDLDY-DZGCQCFKSA-N	1	1	297.406	2.140	40	0		CEABMO
C[C@H]1C[N@H+]2CCC[C@@H]2CN1Cc1n[nH]nc1-c1ccccc1	ZINC000072324563	176369755	/nfs/dbraw/zinc/36/97/55/176369755.db2.gz	WUUMZCWPQSDLDY-DZGCQCFKSA-N	1	1	297.406	2.140	40	0		CEABMO
Cn1ccnc1C[N@H+]1CC[C@H](Cc2cnc3[nH]ccc3c2)C1	ZINC000072367628	176382561	/nfs/dbraw/zinc/38/25/61/176382561.db2.gz	YRVZWOROUXBZLH-CYBMUJFWSA-N	1	1	295.390	2.361	40	0		CEABMO
Fc1ccccc1OCCc1cc([C@@H]2CC[NH2+]C2)n[nH]1	ZINC000072374089	176385254	/nfs/dbraw/zinc/38/52/54/176385254.db2.gz	HJLRSTNAMRKZQT-LLVKDONJSA-N	1	1	275.327	2.247	40	0		CEABMO
CO[C@H]1CCN(Cc2ccoc2)[C@@H]2C[N@@H+](CC3CC3)C[C@@H]21	ZINC000096109431	274080794	/nfs/dbraw/zinc/08/07/94/274080794.db2.gz	GBDQZUMWGULCLB-BBWFWOEESA-N	1	1	290.407	2.211	40	0		CEABMO
C[C@@H]1Cc2ccccc2N1C(=O)[C@H]1CCC[N@@H+](C)C1	ZINC000082337169	279019114	/nfs/dbraw/zinc/01/91/14/279019114.db2.gz	KQPIBFWLXXQLNF-OCCSQVGLSA-N	1	1	258.365	2.306	40	0		CEABMO
CC1(C)NC(=N)NC(=[NH2+])N1c1ccc2ccccc2c1	ZINC000001626908	538737727	/nfs/dbraw/zinc/73/77/27/538737727.db2.gz	HVUMULOFKBCXQE-UHFFFAOYSA-N	1	1	267.336	2.025	40	0		CEABMO
COC[C@]12CCCO[C@H]1CC[N@H+](Cc1nccs1)C2	ZINC000096038983	185069450	/nfs/dbraw/zinc/06/94/50/185069450.db2.gz	ICEGIXBQEWTQGY-GXTWGEPZSA-N	1	1	282.409	2.161	40	0		CEABMO
COC[C@]12CCCO[C@H]1CC[N@@H+](Cc1nccs1)C2	ZINC000096038983	185069452	/nfs/dbraw/zinc/06/94/52/185069452.db2.gz	ICEGIXBQEWTQGY-GXTWGEPZSA-N	1	1	282.409	2.161	40	0		CEABMO
CC[N@H+]1CCOC[C@@]2(CCCN(Cc3ccncc3)C2)C1	ZINC000096049602	185072955	/nfs/dbraw/zinc/07/29/55/185072955.db2.gz	ROSWHBLOMLYGJU-KRWDZBQOSA-N	1	1	289.423	2.016	40	0		CEABMO
CCN1CCOC[C@@]2(CCC[N@H+](Cc3ccncc3)C2)C1	ZINC000096049602	185072956	/nfs/dbraw/zinc/07/29/56/185072956.db2.gz	ROSWHBLOMLYGJU-KRWDZBQOSA-N	1	1	289.423	2.016	40	0		CEABMO
CCN1CCOC[C@@]2(CCC[N@@H+](Cc3ccncc3)C2)C1	ZINC000096049602	185072957	/nfs/dbraw/zinc/07/29/57/185072957.db2.gz	ROSWHBLOMLYGJU-KRWDZBQOSA-N	1	1	289.423	2.016	40	0		CEABMO
C[N@H+]1CCCCC12CCN(C(=O)c1ccoc1)CC2	ZINC000096051203	185074956	/nfs/dbraw/zinc/07/49/56/185074956.db2.gz	JNHXRKBJUVNBOH-UHFFFAOYSA-N	1	1	262.353	2.370	40	0		CEABMO
CCOC[C@@]12CCCO[C@H]1CC[N@@H+](Cc1ccccn1)C2	ZINC000096056805	185077444	/nfs/dbraw/zinc/07/74/44/185077444.db2.gz	BSKDQECSJKCUNS-IRXDYDNUSA-N	1	1	290.407	2.489	40	0		CEABMO
Cc1nc(CO[C@@H]2C[N@@H+](CC3CC3)[C@@H]3COC[C@H]23)cs1	ZINC000096055886	185077306	/nfs/dbraw/zinc/07/73/06/185077306.db2.gz	YSBSZZSYXVCXEG-RRFJBIMHSA-N	1	1	294.420	2.077	40	0		CEABMO
COC[C@H]1C[N@@H+](CC2CC2)Cc2ncn(CC3CC3)c21	ZINC000096060291	185081921	/nfs/dbraw/zinc/08/19/21/185081921.db2.gz	DJIZTOGMZVXEDV-CQSZACIVSA-N	1	1	275.396	2.249	40	0		CEABMO
CCN1C(=O)CC[C@]12CCC[N@H+](Cc1ccncc1F)C2	ZINC000096071173	185086974	/nfs/dbraw/zinc/08/69/74/185086974.db2.gz	ITODSNHPNNRBSP-INIZCTEOSA-N	1	1	291.370	2.198	40	0		CEABMO
CCN1C(=O)CC[C@]12CCC[N@@H+](Cc1ccncc1F)C2	ZINC000096071173	185086975	/nfs/dbraw/zinc/08/69/75/185086975.db2.gz	ITODSNHPNNRBSP-INIZCTEOSA-N	1	1	291.370	2.198	40	0		CEABMO
C[N@H+]1CCC[C@@H](Cc2cnc(Br)cn2)C1	ZINC000205706516	539185169	/nfs/dbraw/zinc/18/51/69/539185169.db2.gz	XGTIAASFPAIINX-VIFPVBQESA-N	1	1	270.174	2.123	40	0		CEABMO
CC[NH+]1CCN(c2c(Cl)cc(N)cc2OC)CC1	ZINC000045886000	362169834	/nfs/dbraw/zinc/16/98/34/362169834.db2.gz	IPTOYDDWIGUYFD-UHFFFAOYSA-N	1	1	269.776	2.073	40	0		CEABMO
C[C@@H](CO)Nc1nc(N2CCc3ccccc3[C@H]2C)cc[nH+]1	ZINC000328982539	136377277	/nfs/dbraw/zinc/37/72/77/136377277.db2.gz	HBKRCAADMVSRQT-QWHCGFSZSA-N	1	1	298.390	2.393	40	0		CEABMO
CCNc1nc(N2CCc3ccccc3[C@@H]2C)cc[nH+]1	ZINC000328965264	136377307	/nfs/dbraw/zinc/37/73/07/136377307.db2.gz	CCBTXCNSJYCOIO-LBPRGKRZSA-N	1	1	268.364	2.454	40	0		CEABMO
COC(=O)c1ccccc1Nc1cc(N)[nH+]c(C2CC2)n1	ZINC000049467642	362363917	/nfs/dbraw/zinc/36/39/17/362363917.db2.gz	XIGKGROZWVCTLD-UHFFFAOYSA-N	1	1	284.319	2.466	40	0		CEABMO
COCC[C@@H]1CCOC12CC[NH+](Cc1cc(C)on1)CC2	ZINC000585104760	345005791	/nfs/dbraw/zinc/00/57/91/345005791.db2.gz	MCGBJWBKDAXEHO-CQSZACIVSA-N	1	1	294.395	2.391	40	0		CEABMO
Cc1ncc(-c2cncc(C[C@@H]3CCC[N@@H+](C)C3)n2)n1C	ZINC000585260987	345009017	/nfs/dbraw/zinc/00/90/17/345009017.db2.gz	HODHFHIALJDNHL-ZDUSSCGKSA-N	1	1	285.395	2.070	40	0		CEABMO
CC(=O)N1CCCC[C@@H]2[C@H]1CCC[N@H+]2CC1(O)CCCC1	ZINC000585282835	345010210	/nfs/dbraw/zinc/01/02/10/345010210.db2.gz	IKKRMCKPEHXGJX-HZPDHXFCSA-N	1	1	294.439	2.157	40	0		CEABMO
Nc1cccnc1N[C@H]1CC[N@@H+](Cc2ccccc2)C1	ZINC000091352096	180137673	/nfs/dbraw/zinc/13/76/73/180137673.db2.gz	VCOCTBVOMHSTTI-AWEZNQCLSA-N	1	1	268.364	2.350	40	0		CEABMO
O=C(c1cscn1)N1C[C@@H]2C[N@H+](Cc3ccccc3)[C@@H]2C1	ZINC000107249456	186164374	/nfs/dbraw/zinc/16/43/74/186164374.db2.gz	KNCIKAUEZBWCAT-DZGCQCFKSA-N	1	1	299.399	2.100	40	0		CEABMO
O=C(c1cscn1)N1C[C@@H]2C[N@@H+](Cc3ccccc3)[C@@H]2C1	ZINC000107249456	186164376	/nfs/dbraw/zinc/16/43/76/186164376.db2.gz	KNCIKAUEZBWCAT-DZGCQCFKSA-N	1	1	299.399	2.100	40	0		CEABMO
c1coc(CN2C[C@H]3C[C@@H](C2)C[N@H+](C[C@H]2CCOC2)C3)c1	ZINC000107261579	186164535	/nfs/dbraw/zinc/16/45/35/186164535.db2.gz	CDHZTPDFSWQDBP-OAGGEKHMSA-N	1	1	290.407	2.070	40	0		CEABMO
c1cn([C@H]2CO[C@]3(C2)CCC[N@H+](Cc2cccnc2)C3)cn1	ZINC000107731406	186188780	/nfs/dbraw/zinc/18/87/80/186188780.db2.gz	SVZHDVPNTPYDSM-SJORKVTESA-N	1	1	298.390	2.274	40	0		CEABMO
Cc1ccc(C[N@@H+]2C[C@@H]3[C@H](CC(=O)N4CCCC4)[C@@H]3C2)o1	ZINC000107745899	186188818	/nfs/dbraw/zinc/18/88/18/186188818.db2.gz	UYKNHDKWAUYKKS-MUJYYYPQSA-N	1	1	288.391	2.278	40	0		CEABMO
CC(C)NC(=O)C[C@H]1[C@H]2C[N@H+](Cc3ccc(F)cc3)C[C@@H]12	ZINC000107745872	186189312	/nfs/dbraw/zinc/18/93/12/186189312.db2.gz	XORUQTWUSHUEEJ-MUJYYYPQSA-N	1	1	290.382	2.418	40	0		CEABMO
CC[N@@H+](Cc1ccccc1)C1CCC([NH2+]CC(=O)[O-])CC1	ZINC000079416124	363599155	/nfs/dbraw/zinc/59/91/55/363599155.db2.gz	SYVYCADJXVQLMC-UHFFFAOYSA-N	1	1	290.407	2.494	40	0		CEABMO
CC[S@](=O)CCC[N@H+]1CCc2ccccc2C1	ZINC000001752012	361220850	/nfs/dbraw/zinc/22/08/50/361220850.db2.gz	YKKQKMDOWYCXEX-QGZVFWFLSA-N	1	1	251.395	2.203	40	0	in-man	CEABMO
Cc1cccc(OC[C@H](O)C[N@@H+]2CCC[C@H](C)C2)c1	ZINC000004276561	361308692	/nfs/dbraw/zinc/30/86/92/361308692.db2.gz	SVKRAUOKQPVBIT-LSDHHAIUSA-N	1	1	263.381	2.467	40	0		CEABMO
CN(C)C(=O)[C@H]1CC[C@@H]2[C@@H](CC[N@H+]2CC2CCCCC2)O1	ZINC000096187235	364407346	/nfs/dbraw/zinc/40/73/46/364407346.db2.gz	OPKOFOWADLEQQV-BZUAXINKSA-N	1	1	294.439	2.277	40	0		CEABMO
COC(=O)[C@H]1C[C@H]2Cc3c4ccccc4[nH]c3C[N@H+]2C1	ZINC000095828948	364393512	/nfs/dbraw/zinc/39/35/12/364393512.db2.gz	OVDBJAVMIFIMFA-QWRGUYRKSA-N	1	1	270.332	2.088	40	0		CEABMO
Cc1noc(C)c1C[N@H+]1CC[C@@H](O)[C@@H]1Cc1ccccc1	ZINC000096200003	364408696	/nfs/dbraw/zinc/40/86/96/364408696.db2.gz	SZSGZWUITAWOMM-DLBZAZTESA-N	1	1	286.375	2.469	40	0		CEABMO
CC(=O)N1CCC[C@@]2(CC[N@@H+](Cc3cccc(C)n3)C2)C1	ZINC000096216307	364413419	/nfs/dbraw/zinc/41/34/19/364413419.db2.gz	NKGYHDOIQSNUGZ-KRWDZBQOSA-N	1	1	287.407	2.224	40	0		CEABMO
C[N@H+]1CCC[C@@]2(CCN(C(=O)c3ccccc3)C2)C1	ZINC000096268563	364420310	/nfs/dbraw/zinc/42/03/10/364420310.db2.gz	BCNOKJURHQLPAE-MRXNPFEDSA-N	1	1	258.365	2.245	40	0		CEABMO
C[C@H]1C[N@@H+](Cc2ccccc2)C[C@]1(N)C(F)(F)F	ZINC000199548594	370148837	/nfs/dbraw/zinc/14/88/37/370148837.db2.gz	NWNOBEWRLOTQFH-CMPLNLGQSA-N	1	1	258.287	2.398	40	0		CEABMO
Nc1cc(NCc2ccc(Cl)cc2Cl)nc[nH+]1	ZINC000409428729	375523867	/nfs/dbraw/zinc/52/38/67/375523867.db2.gz	HJGHWTJBNALXMC-UHFFFAOYSA-N	1	1	269.135	2.400	40	0		CEABMO
Nc1cc(NCc2ccc(Cl)cc2Cl)[nH+]cn1	ZINC000409428729	375523875	/nfs/dbraw/zinc/52/38/75/375523875.db2.gz	HJGHWTJBNALXMC-UHFFFAOYSA-N	1	1	269.135	2.400	40	0		CEABMO
CCCn1cc(C[NH2+]Cc2ccnn2C(C)C)cn1	ZINC000256053874	190004748	/nfs/dbraw/zinc/00/47/48/190004748.db2.gz	TZELHCPVLOVRHJ-UHFFFAOYSA-N	1	1	261.373	2.360	40	0		CEABMO
CC[C@H](C)n1nccc1C[NH2+]Cc1ccnn1CC	ZINC000256053659	190004817	/nfs/dbraw/zinc/00/48/17/190004817.db2.gz	SHOXWPMWIBDGFY-LBPRGKRZSA-N	1	1	261.373	2.360	40	0		CEABMO
CC[C@@H](C)n1nccc1C[NH2+]CCN(CC)CC	ZINC000256053522	190005169	/nfs/dbraw/zinc/00/51/69/190005169.db2.gz	RTXGBJCCWLJPOE-CYBMUJFWSA-N	1	1	252.406	2.286	40	0		CEABMO
CCCn1cc(C[NH2+]Cc2cc(C(C)C)nn2C)cn1	ZINC000256050058	190003047	/nfs/dbraw/zinc/00/30/47/190003047.db2.gz	CMBWNZZBUCBVCZ-UHFFFAOYSA-N	1	1	275.400	2.440	40	0		CEABMO
FCCn1cc(C[NH2+]Cc2cc(F)ccc2F)cn1	ZINC000256050577	190003269	/nfs/dbraw/zinc/00/32/69/190003269.db2.gz	FPPCHOQUSMRFQD-UHFFFAOYSA-N	1	1	269.270	2.421	40	0		CEABMO
CCCn1ccnc1C[N@@H+]1CCC[C@H](c2cc[nH]n2)C1	ZINC000257268449	190024083	/nfs/dbraw/zinc/02/40/83/190024083.db2.gz	MLSMUXCXURCBJC-ZDUSSCGKSA-N	1	1	273.384	2.396	40	0		CEABMO
CCCn1ccnc1C[N@H+]1CCC[C@H](c2cc[nH]n2)C1	ZINC000257268449	190024084	/nfs/dbraw/zinc/02/40/84/190024084.db2.gz	MLSMUXCXURCBJC-ZDUSSCGKSA-N	1	1	273.384	2.396	40	0		CEABMO
Cc1nccc([C@@H]2C[N@@H+](C3CCCCC3)CCO2)n1	ZINC000257278490	190025774	/nfs/dbraw/zinc/02/57/74/190025774.db2.gz	OCLOVHRDXQERQP-HNNXBMFYSA-N	1	1	261.369	2.491	40	0		CEABMO
Cc1nccc([C@@H]2C[N@H+](C3CCCCC3)CCO2)n1	ZINC000257278490	190025775	/nfs/dbraw/zinc/02/57/75/190025775.db2.gz	OCLOVHRDXQERQP-HNNXBMFYSA-N	1	1	261.369	2.491	40	0		CEABMO
Cc1nc(-c2cc[nH]n2)cc([C@@H]2CC[N@H+](C(C)C)C2)n1	ZINC000257309458	190031011	/nfs/dbraw/zinc/03/10/11/190031011.db2.gz	UBAMZKGEBDLEGA-GFCCVEGCSA-N	1	1	271.368	2.373	40	0		CEABMO
Cc1cc(C[N@@H+]2CCC[C@@H](c3cncc(C)n3)C2)no1	ZINC000257320727	190033880	/nfs/dbraw/zinc/03/38/80/190033880.db2.gz	VYHBKRCVGZOTQK-CYBMUJFWSA-N	1	1	272.352	2.461	40	0		CEABMO
Cc1cc(C[N@H+]2CCC[C@@H](c3cncc(C)n3)C2)no1	ZINC000257320727	190033881	/nfs/dbraw/zinc/03/38/81/190033881.db2.gz	VYHBKRCVGZOTQK-CYBMUJFWSA-N	1	1	272.352	2.461	40	0		CEABMO
C[N@H+]1C[C@@H](CO)[C@@H](c2cccc(Br)c2)C1	ZINC000225609240	394469445	/nfs/dbraw/zinc/46/94/45/394469445.db2.gz	UOALQWUFZSXGPE-CMPLNLGQSA-N	1	1	270.170	2.087	40	0		CEABMO
COC(=O)[C@@H]1C[N@@H+](C)C[C@H]1c1cccc(Cl)c1	ZINC000242495899	394495881	/nfs/dbraw/zinc/49/58/81/394495881.db2.gz	GRUWZCAOPKGXBQ-NWDGAFQWSA-N	1	1	253.729	2.158	40	0		CEABMO
CC(C)[N@H+]1CCC[C@H]1c1cnc(-c2cc[nH]n2)cn1	ZINC000257234370	394595647	/nfs/dbraw/zinc/59/56/47/394595647.db2.gz	GTFQWLQYKSORQY-AWEZNQCLSA-N	1	1	257.341	2.412	40	0		CEABMO
COc1ccc([C@@H]2[C@H]([NH3+])C(=O)N2c2cccc(OC)c2)cc1	ZINC000072227722	394596714	/nfs/dbraw/zinc/59/67/14/394596714.db2.gz	VTYUFUMOUPBLBY-JKSUJKDBSA-N	1	1	298.342	2.119	40	0		CEABMO
CC(C)C[N@H+](Cc1cccc(F)c1)[C@H]1CCS(=O)(=O)C1	ZINC000575421788	400608654	/nfs/dbraw/zinc/60/86/54/400608654.db2.gz	RRGPLWIBWHNPLA-HNNXBMFYSA-N	1	1	299.411	2.471	40	0		CEABMO
CC(C)C[N@@H+](Cc1cccc(F)c1)[C@H]1CCS(=O)(=O)C1	ZINC000575421788	400608659	/nfs/dbraw/zinc/60/86/59/400608659.db2.gz	RRGPLWIBWHNPLA-HNNXBMFYSA-N	1	1	299.411	2.471	40	0		CEABMO
COc1ccccc1NC(=S)NC[C@@H]1CCC[N@@H+](C)C1	ZINC000009876358	170388492	/nfs/dbraw/zinc/38/84/92/170388492.db2.gz	SKZOXFPKXWNCEV-LBPRGKRZSA-N	1	1	293.436	2.323	40	0		CEABMO
CCOc1ccc(C(=O)N2CC[NH+](CC)CC2)cc1C	ZINC000022250750	171382314	/nfs/dbraw/zinc/38/23/14/171382314.db2.gz	HYULFZKQVXOHHD-UHFFFAOYSA-N	1	1	276.380	2.171	40	0		CEABMO
COc1ccc(C[NH+]2CCC(O)CC2)cc1Cl	ZINC000038539706	174145468	/nfs/dbraw/zinc/14/54/68/174145468.db2.gz	VDEBDMKFGTZXEB-UHFFFAOYSA-N	1	1	255.745	2.305	40	0		CEABMO
CCc1nccn1-c1cncc([C@@H]2CCC[N@@H+](C)C2)n1	ZINC000072355465	176374950	/nfs/dbraw/zinc/37/49/50/176374950.db2.gz	OJSXZGGKDZJOIR-GFCCVEGCSA-N	1	1	271.368	2.034	40	0		CEABMO
C[N@H+]1CCC[C@@H](c2ccnc(Nc3ncccn3)c2)C1	ZINC000072364984	176380075	/nfs/dbraw/zinc/38/00/75/176380075.db2.gz	YBLXHANYXPZSNS-CYBMUJFWSA-N	1	1	269.352	2.424	40	0		CEABMO
COc1ccccc1[C@H]1C[N@@H+](C(C)C)CCN1C(C)=O	ZINC000072366564	176381582	/nfs/dbraw/zinc/38/15/82/176381582.db2.gz	CFHLAUOFWOPNTH-OAHLLOKOSA-N	1	1	276.380	2.309	40	0		CEABMO
COc1ccccc1[C@H]1C[N@H+](C(C)C)CCN1C(C)=O	ZINC000072366564	176381584	/nfs/dbraw/zinc/38/15/84/176381584.db2.gz	CFHLAUOFWOPNTH-OAHLLOKOSA-N	1	1	276.380	2.309	40	0		CEABMO
Cn1cccc1C[N@H+]1CCC[C@H](c2cnccn2)C1	ZINC000072369366	176384097	/nfs/dbraw/zinc/38/40/97/176384097.db2.gz	VIIYNUBXSVLGGR-ZDUSSCGKSA-N	1	1	256.353	2.195	40	0		CEABMO
Cn1cc(C[N@H+]2CCC[C@@H](Cc3nccs3)C2)cn1	ZINC000072385814	176390485	/nfs/dbraw/zinc/39/04/85/176390485.db2.gz	RQUKBPDBUNWAHU-LBPRGKRZSA-N	1	1	276.409	2.331	40	0		CEABMO
C[N@H+]1CCC[C@H](c2ccnc(C(=O)N3CCCC3)c2)C1	ZINC000072387014	176392798	/nfs/dbraw/zinc/39/27/98/176392798.db2.gz	MUKRORNPQQABBI-AWEZNQCLSA-N	1	1	273.380	2.127	40	0		CEABMO
COc1ccc(CN2C[C@H]3CCC[N@H+]3C[C@H]2C)cc1OC	ZINC000072397532	176395011	/nfs/dbraw/zinc/39/50/11/176395011.db2.gz	AACBDFFUMQVXBK-UKRRQHHQSA-N	1	1	290.407	2.372	40	0		CEABMO
CC(=O)Nc1ccc(CN2C[C@@H]3CCC[N@@H+]3C[C@H]2C)cc1	ZINC000072397535	277074930	/nfs/dbraw/zinc/07/49/30/277074930.db2.gz	KRPIUDZFESOZPM-DYVFJYSZSA-N	1	1	287.407	2.314	40	0		CEABMO
COc1ccc([C@@H]2[C@H]([NH3+])C(=O)N2c2ccccc2)cc1	ZINC000072227334	277427874	/nfs/dbraw/zinc/42/78/74/277427874.db2.gz	ZFSHBMDUBOZWOL-LSDHHAIUSA-N	1	1	268.316	2.110	40	0		CEABMO
Cc1ccc([C@H]([NH3+])c2nc(-c3cccnc3)n[nH]2)cc1	ZINC000095534102	185006022	/nfs/dbraw/zinc/00/60/22/185006022.db2.gz	XNFWIWWBAIPCBB-ZDUSSCGKSA-N	1	1	265.320	2.223	40	0		CEABMO
COC[C@]12CCCO[C@@H]1CC[N@H+](Cc1cc(C)on1)C2	ZINC000096039134	185069132	/nfs/dbraw/zinc/06/91/32/185069132.db2.gz	UQCRHJTUBHNXHD-HUUCEWRRSA-N	1	1	280.368	2.001	40	0		CEABMO
COC[C@]12CCCO[C@@H]1CC[N@@H+](Cc1cc(C)on1)C2	ZINC000096039134	185069133	/nfs/dbraw/zinc/06/91/33/185069133.db2.gz	UQCRHJTUBHNXHD-HUUCEWRRSA-N	1	1	280.368	2.001	40	0		CEABMO
c1cc(CN2CCC3(CC2)COCC[N@@H+]3CC2CC2)co1	ZINC000096048913	185072591	/nfs/dbraw/zinc/07/25/91/185072591.db2.gz	CKKYADADJGMRMP-UHFFFAOYSA-N	1	1	290.407	2.356	40	0		CEABMO
c1cc(C[NH+]2CCC3(CC2)COCCN3CC2CC2)co1	ZINC000096048913	185072593	/nfs/dbraw/zinc/07/25/93/185072593.db2.gz	CKKYADADJGMRMP-UHFFFAOYSA-N	1	1	290.407	2.356	40	0		CEABMO
O=C1[C@H]2C[N@@H+](Cc3ccco3)C[C@H]2CN1c1ccccc1	ZINC000096053570	185074421	/nfs/dbraw/zinc/07/44/21/185074421.db2.gz	BGDQONXEAPMOTO-BBRMVZONSA-N	1	1	282.343	2.374	40	0		CEABMO
CN1C(=O)CCC[C@]12CCC[N@@H+](Cc1ccncc1)C2	ZINC000096049972	185074986	/nfs/dbraw/zinc/07/49/86/185074986.db2.gz	MACGVZNIRVAHMG-MRXNPFEDSA-N	1	1	273.380	2.059	40	0		CEABMO
c1ccc(C[NH+]2C[C@H]3CN(Cc4ccncc4)C[C@@H]3C2)nc1	ZINC000096053805	185076151	/nfs/dbraw/zinc/07/61/51/185076151.db2.gz	RICPREWXZGIYFW-IAGOWNOFSA-N	1	1	294.402	2.040	40	0		CEABMO
c1ccc(C[NH+]2C[C@@H]3CN(Cc4ccncc4)C[C@H]3C2)nc1	ZINC000096053806	185076361	/nfs/dbraw/zinc/07/63/61/185076361.db2.gz	RICPREWXZGIYFW-IRXDYDNUSA-N	1	1	294.402	2.040	40	0		CEABMO
COC[C@H]1CC[C@@H]2[C@@H](CC[N@H+]2Cc2ccoc2)O1	ZINC000096056376	185077076	/nfs/dbraw/zinc/07/70/76/185077076.db2.gz	BHPAZLGBQJOAOP-MGPQQGTHSA-N	1	1	251.326	2.048	40	0		CEABMO
COC[C@]12CCCO[C@H]1CC[N@@H+](Cc1ccccn1)C2	ZINC000096056722	185077289	/nfs/dbraw/zinc/07/72/89/185077289.db2.gz	YLSCRXPAZCUAOA-JKSUJKDBSA-N	1	1	276.380	2.099	40	0		CEABMO
CCOC[C@@]12CCCO[C@@H]1CC[N@@H+](Cc1ccccn1)C2	ZINC000096056803	185077344	/nfs/dbraw/zinc/07/73/44/185077344.db2.gz	BSKDQECSJKCUNS-SJORKVTESA-N	1	1	290.407	2.489	40	0		CEABMO
Cn1cccc1C(=O)N1CCC2(CCCC[N@H+]2C)CC1	ZINC000096078144	185089210	/nfs/dbraw/zinc/08/92/10/185089210.db2.gz	YSHWKHFRBPJFKD-UHFFFAOYSA-N	1	1	275.396	2.116	40	0		CEABMO
CCc1ccc(C[N@H+]2CCc3ncnc(OC)c3CC2)o1	ZINC000096084042	185092510	/nfs/dbraw/zinc/09/25/10/185092510.db2.gz	SGJGWVRYIRUMRS-UHFFFAOYSA-N	1	1	287.363	2.241	40	0		CEABMO
CC[N@H+]1C[C@H]2[C@@H](C1)N(CCc1ccccc1)CC[C@@H]2OC	ZINC000096109406	185100237	/nfs/dbraw/zinc/10/02/37/185100237.db2.gz	WASOUAFSLNQJDO-KSZLIROESA-N	1	1	288.435	2.270	40	0		CEABMO
CCN1C[C@H]2[C@@H](C1)[N@H+](CCc1ccccc1)CC[C@@H]2OC	ZINC000096109406	185100239	/nfs/dbraw/zinc/10/02/39/185100239.db2.gz	WASOUAFSLNQJDO-KSZLIROESA-N	1	1	288.435	2.270	40	0		CEABMO
CCN1C[C@H]2[C@@H](C1)[N@@H+](CCc1ccccc1)CC[C@@H]2OC	ZINC000096109406	185100240	/nfs/dbraw/zinc/10/02/40/185100240.db2.gz	WASOUAFSLNQJDO-KSZLIROESA-N	1	1	288.435	2.270	40	0		CEABMO
Brc1ccc(CNC2CC[NH2+]CC2)cc1	ZINC000042340295	362085080	/nfs/dbraw/zinc/08/50/80/362085080.db2.gz	QKXFDFDSHFFHJC-UHFFFAOYSA-N	1	1	269.186	2.291	40	0		CEABMO
[NH3+][C@@H](C[C@@H](c1ccc(Cl)cc1)[NH+]1CCCC1)C(=O)[O-]	ZINC000409440111	344889488	/nfs/dbraw/zinc/88/94/88/344889488.db2.gz	JPBIMQFWRADWCT-STQMWFEESA-N	1	1	282.771	2.279	40	0		CEABMO
Cc1ncc(-c2cncc(C[C@H]3CCC[N@@H+](C)C3)n2)n1C	ZINC000585260986	345009040	/nfs/dbraw/zinc/00/90/40/345009040.db2.gz	HODHFHIALJDNHL-CYBMUJFWSA-N	1	1	285.395	2.070	40	0		CEABMO
Cc1ccccc1OC[C@]1(O)CC[N@@H+](Cc2ccccn2)C1	ZINC000585274274	345009156	/nfs/dbraw/zinc/00/91/56/345009156.db2.gz	ICJLSAJABVPESA-SFHVURJKSA-N	1	1	298.386	2.406	40	0		CEABMO
Cc1ccc(C[C@H]2[C@@H](O)CCC[N@@H+]2Cc2nccn2C)cc1	ZINC000585274275	345009303	/nfs/dbraw/zinc/00/93/03/345009303.db2.gz	IDBAKMLAVYBCSM-IRXDYDNUSA-N	1	1	299.418	2.297	40	0		CEABMO
CC(C)(C)OC(=O)N[C@H]1CC[N@H+](Cc2ccncc2)C1	ZINC000067801140	362925653	/nfs/dbraw/zinc/92/56/53/362925653.db2.gz	BLXINULUCAENHC-ZDUSSCGKSA-N	1	1	277.368	2.181	40	0		CEABMO
CC(C)(C)OC(=O)N[C@H]1CC[N@@H+](Cc2ccncc2)C1	ZINC000067801140	362925659	/nfs/dbraw/zinc/92/56/59/362925659.db2.gz	BLXINULUCAENHC-ZDUSSCGKSA-N	1	1	277.368	2.181	40	0		CEABMO
CNc1cccc([C@H]2CCCN(c3ncccn3)C2)[nH+]1	ZINC000072356624	363131690	/nfs/dbraw/zinc/13/16/90/363131690.db2.gz	USMKRFOHACEPLX-LBPRGKRZSA-N	1	1	269.352	2.297	40	0		CEABMO
CC[N@H+](CC(=O)[O-])CC1CC[NH+](Cc2ccccc2)CC1	ZINC000079393403	363593860	/nfs/dbraw/zinc/59/38/60/363593860.db2.gz	CVOLWZGWEAXELW-UHFFFAOYSA-N	1	1	290.407	2.305	40	0		CEABMO
OC[C@H]1CCC[N@H+](Cc2ccc(Br)o2)C1	ZINC000000209145	361145949	/nfs/dbraw/zinc/14/59/49/361145949.db2.gz	UZLQTQLPMQPQKD-VIFPVBQESA-N	1	1	274.158	2.246	40	0		CEABMO
OC[C@H]1CCC[N@@H+](Cc2ccc(Br)o2)C1	ZINC000000209145	361145951	/nfs/dbraw/zinc/14/59/51/361145951.db2.gz	UZLQTQLPMQPQKD-VIFPVBQESA-N	1	1	274.158	2.246	40	0		CEABMO
COc1ccccc1C[N@H+]1C[C@H]2CCc3nnc(C)n3[C@H]2C1	ZINC000019288367	361526984	/nfs/dbraw/zinc/52/69/84/361526984.db2.gz	JOPYEFMYLFPKTQ-HIFRSBDPSA-N	1	1	298.390	2.214	40	0		CEABMO
C[C@H]1C[N@H+]2CCC[C@@H]2CN1Cc1ccc2c(c1)CCO2	ZINC000019575764	361543681	/nfs/dbraw/zinc/54/36/81/361543681.db2.gz	PKDZNVJCOUGVNA-XJKSGUPXSA-N	1	1	272.392	2.290	40	0		CEABMO
C[C@H](CCN1C[C@@H]2C[C@@H](O)C[N@H+]2C[C@H]1C)c1ccccc1	ZINC000019575210	361544024	/nfs/dbraw/zinc/54/40/24/361544024.db2.gz	OQWLLWPCXDAZNO-XYVMCAHJSA-N	1	1	288.435	2.320	40	0		CEABMO
C[C@H](CC[N@@H+]1C[C@@H]2C[C@@H](O)CN2C[C@H]1C)c1ccccc1	ZINC000019575210	361544031	/nfs/dbraw/zinc/54/40/31/361544031.db2.gz	OQWLLWPCXDAZNO-XYVMCAHJSA-N	1	1	288.435	2.320	40	0		CEABMO
C[C@H](CC[N@H+]1C[C@@H]2C[C@@H](O)CN2C[C@H]1C)c1ccccc1	ZINC000019575210	361544037	/nfs/dbraw/zinc/54/40/37/361544037.db2.gz	OQWLLWPCXDAZNO-XYVMCAHJSA-N	1	1	288.435	2.320	40	0		CEABMO
Cc1ccc(C)n1CC[NH+]1CCN(C(=O)C(C)(C)C)CC1	ZINC000024102806	361607075	/nfs/dbraw/zinc/60/70/75/361607075.db2.gz	QOKAWHFIXFZBDH-UHFFFAOYSA-N	1	1	291.439	2.295	40	0		CEABMO
C[C@H]1CCC[N@@H+](C[C@@H](O)COc2ccc(F)cc2)C1	ZINC000026781220	361644854	/nfs/dbraw/zinc/64/48/54/361644854.db2.gz	NERBENWZMZEVBI-GXTWGEPZSA-N	1	1	267.344	2.297	40	0		CEABMO
COC[C@H]1Cn2nccc2C[N@H+](Cc2ccc(F)cc2)C1	ZINC000096188891	364407182	/nfs/dbraw/zinc/40/71/82/364407182.db2.gz	ZVKVXYXIUUCQLD-CQSZACIVSA-N	1	1	289.354	2.301	40	0		CEABMO
COC[C@H]1Cn2nccc2C[N@@H+](Cc2ccc(F)cc2)C1	ZINC000096188891	364407187	/nfs/dbraw/zinc/40/71/87/364407187.db2.gz	ZVKVXYXIUUCQLD-CQSZACIVSA-N	1	1	289.354	2.301	40	0		CEABMO
Cc1ccc(CN2CCn3cc(C[NH+](C)C)nc3C2)s1	ZINC000096197150	364408965	/nfs/dbraw/zinc/40/89/65/364408965.db2.gz	IYOWWVUZWXHQEY-UHFFFAOYSA-N	1	1	290.436	2.330	40	0		CEABMO
c1nc2c(c(C3CC3)n1)CC[N@@H+](CC1CCOCC1)CC2	ZINC000096058623	364400769	/nfs/dbraw/zinc/40/07/69/364400769.db2.gz	FUGFCZKJPCKGRN-UHFFFAOYSA-N	1	1	287.407	2.181	40	0		CEABMO
CC(C)C[N@H+]1CCC[C@@]12CCN(C(=O)c1ccno1)C2	ZINC000096203042	364411428	/nfs/dbraw/zinc/41/14/28/364411428.db2.gz	WYHMHLBKPWNALR-HNNXBMFYSA-N	1	1	277.368	2.011	40	0		CEABMO
COc1ncnc2c1CC[N@@H+](Cc1ccccc1)CC2	ZINC000096255562	364417804	/nfs/dbraw/zinc/41/78/04/364417804.db2.gz	INZVDFYXZHHNJY-UHFFFAOYSA-N	1	1	269.348	2.086	40	0		CEABMO
C[C@@H](c1ccccc1)[N@H+]1CCC[C@@]2(CN(C)C2=O)C1	ZINC000585099438	367177600	/nfs/dbraw/zinc/17/76/00/367177600.db2.gz	JIYHEDORYCDKBB-XJKSGUPXSA-N	1	1	258.365	2.302	40	0		CEABMO
CC[C@H]1CCCC[N@H+]1CCCNC(=O)c1cccnc1	ZINC000225430560	370294307	/nfs/dbraw/zinc/29/43/07/370294307.db2.gz	SPNRBSZGQJPSNA-HNNXBMFYSA-N	1	1	275.396	2.466	40	0		CEABMO
CCCn1nccc1C[NH2+]Cc1cnn(C(C)C)c1	ZINC000256054899	190005244	/nfs/dbraw/zinc/00/52/44/190005244.db2.gz	YGIOCOJMKUYSPX-UHFFFAOYSA-N	1	1	261.373	2.360	40	0		CEABMO
CCn1nccc1C[NH2+]Cc1cc(C(C)C)nn1C	ZINC000256052361	190004606	/nfs/dbraw/zinc/00/46/06/190004606.db2.gz	NAIAEJADCIRQPM-UHFFFAOYSA-N	1	1	261.373	2.050	40	0		CEABMO
CCn1ncc(C)c1C[NH2+]Cc1cc(C(C)C)nn1C	ZINC000256054279	190005788	/nfs/dbraw/zinc/00/57/88/190005788.db2.gz	VSEXIQSTNANUQV-UHFFFAOYSA-N	1	1	275.400	2.358	40	0		CEABMO
C[N@H+]1CCC[C@H](Cc2cncc(-c3ncco3)n2)C1	ZINC000257200831	190011028	/nfs/dbraw/zinc/01/10/28/190011028.db2.gz	AFBJBNIGFMZBBI-LLVKDONJSA-N	1	1	258.325	2.016	40	0		CEABMO
CCn1nccc1-c1cncc(C[C@@H]2CCC[N@@H+](C)C2)n1	ZINC000257203021	190011788	/nfs/dbraw/zinc/01/17/88/190011788.db2.gz	AOICLKCFLTUYFE-ZDUSSCGKSA-N	1	1	285.395	2.244	40	0		CEABMO
Cn1cncc1C[NH+]1CC2(C1)CO[C@H](Cc1ccccc1)C2	ZINC000257207771	190012437	/nfs/dbraw/zinc/01/24/37/190012437.db2.gz	BJDPCUGQVUZLBV-QGZVFWFLSA-N	1	1	297.402	2.254	40	0		CEABMO
CCn1cc(-c2cncc(C[C@@H]3CCC[N@@H+](C)C3)n2)cn1	ZINC000257236609	190017964	/nfs/dbraw/zinc/01/79/64/190017964.db2.gz	HCYVBGSTERHBNU-ZDUSSCGKSA-N	1	1	285.395	2.244	40	0		CEABMO
CNc1cc(C)nc([C@H]2CC[N@H+](Cc3cnn(C)c3C)C2)c1	ZINC000257256951	190021449	/nfs/dbraw/zinc/02/14/49/190021449.db2.gz	KNNCHKCZQXOZGN-AWEZNQCLSA-N	1	1	299.422	2.463	40	0		CEABMO
CNc1cc(C)nc([C@H]2CC[N@@H+](Cc3cnn(C)c3C)C2)c1	ZINC000257256951	190021450	/nfs/dbraw/zinc/02/14/50/190021450.db2.gz	KNNCHKCZQXOZGN-AWEZNQCLSA-N	1	1	299.422	2.463	40	0		CEABMO
Fc1ccccc1OCc1cc([C@@H]2CC[NH2+]C2)[nH]n1	ZINC000257259043	190021553	/nfs/dbraw/zinc/02/15/53/190021553.db2.gz	KWPDZYSIGCNVQZ-SNVBAGLBSA-N	1	1	261.300	2.205	40	0		CEABMO
Cc1cn(C)c([C@H]2CCC[N@@H+](CC3CCOCC3)C2)n1	ZINC000257283413	190026068	/nfs/dbraw/zinc/02/60/68/190026068.db2.gz	OYFCSSHXZGNDHJ-HNNXBMFYSA-N	1	1	277.412	2.335	40	0		CEABMO
CC(C)[N@H+]1CC[C@@H](Cc2cnc(-c3ccnn3C)cn2)C1	ZINC000257282214	190026145	/nfs/dbraw/zinc/02/61/45/190026145.db2.gz	OSXIFUZPJAPSAX-ZDUSSCGKSA-N	1	1	285.395	2.150	40	0		CEABMO
CCn1nccc1-c1cnc(C[C@H]2CCC[N@@H+](C)C2)cn1	ZINC000257286437	190026697	/nfs/dbraw/zinc/02/66/97/190026697.db2.gz	PLPILFNRIWDLCW-CYBMUJFWSA-N	1	1	285.395	2.244	40	0		CEABMO
Cn1nccc1-c1cc(C[C@H]2CCC[N@@H+](C)C2)ccn1	ZINC000257286935	190027055	/nfs/dbraw/zinc/02/70/55/190027055.db2.gz	PNSFLBKAJFFEJD-CQSZACIVSA-N	1	1	270.380	2.366	40	0		CEABMO
CCN1CCC([N@H+]2CC[C@@H](c3nc(C)cn3C)C2)CC1	ZINC000257300403	190029388	/nfs/dbraw/zinc/02/93/88/190029388.db2.gz	RUDJNQLNRVCTMV-CQSZACIVSA-N	1	1	276.428	2.002	40	0		CEABMO
Cc1c[nH]nc1C[C@H]1CCC[N@@H+](Cc2ccnc(C)n2)C1	ZINC000257308614	190030873	/nfs/dbraw/zinc/03/08/73/190030873.db2.gz	TXJQPROJDQSXQR-CQSZACIVSA-N	1	1	285.395	2.271	40	0		CEABMO
CN(C)c1cc([C@H]2CCC[N@@H+]2Cc2cnccn2)ccn1	ZINC000257309463	190031121	/nfs/dbraw/zinc/03/11/21/190031121.db2.gz	UBAUZQYAZQTJFA-OAHLLOKOSA-N	1	1	283.379	2.275	40	0		CEABMO
CN(C)c1cc([C@H]2CCC[N@H+]2Cc2cnccn2)ccn1	ZINC000257309463	190031122	/nfs/dbraw/zinc/03/11/22/190031122.db2.gz	UBAUZQYAZQTJFA-OAHLLOKOSA-N	1	1	283.379	2.275	40	0		CEABMO
COC[C@@H]1CC[N@@H+](C)C2(CN(C(=O)C3=CCCCC3)C2)C1	ZINC000306134437	376540660	/nfs/dbraw/zinc/54/06/60/376540660.db2.gz	NNIFZLIKCYABEH-CQSZACIVSA-N	1	1	292.423	2.056	40	0		CEABMO
CC(C)C[N@H+]1C[C@H]2CN(C(=O)Nc3ccccc3)C[C@H]21	ZINC000306133326	376541523	/nfs/dbraw/zinc/54/15/23/376541523.db2.gz	MILOUHMKHQMEJO-DZGCQCFKSA-N	1	1	273.380	2.491	40	0		CEABMO
CCOc1cc([C@H]([NH3+])c2nnc(C(C)C)[nH]2)ccc1OC	ZINC000095534364	256744407	/nfs/dbraw/zinc/74/44/07/256744407.db2.gz	QFBOQUIJVIBLBC-ZDUSSCGKSA-N	1	1	290.367	2.384	40	0		CEABMO
Cc1cc(N2CCOCC2)ncc1[C@@H]1CCCC[N@@H+]1C	ZINC000072219414	256707780	/nfs/dbraw/zinc/70/77/80/256707780.db2.gz	DFYMOXQTQOPXJI-HNNXBMFYSA-N	1	1	275.396	2.383	40	0		CEABMO
C[N@H+]1C[C@@H]2CCC[C@H](C1)C2CC(=O)NCc1ccco1	ZINC000096252226	256834306	/nfs/dbraw/zinc/83/43/06/256834306.db2.gz	OLCGMYRVTWEGHS-NNQSOWQGSA-N	1	1	276.380	2.264	40	0		CEABMO
C[N@@H+]1CCN2c3ccccc3Cn3cccc3[C@@H]2C1	ZINC000000000050	394447796	/nfs/dbraw/zinc/44/77/96/394447796.db2.gz	MNHDDERDSNZCCK-INIZCTEOSA-N	1	1	253.349	2.343	40	0	in-man	CEABMO
C[N@H+]1CCN2c3ccccc3Cn3cccc3[C@@H]2C1	ZINC000000000050	394447797	/nfs/dbraw/zinc/44/77/97/394447797.db2.gz	MNHDDERDSNZCCK-INIZCTEOSA-N	1	1	253.349	2.343	40	0	in-man	CEABMO
C[N@@H+](C[C@H]1CCCCC1=O)C[C@@H]1CCCCC1=O	ZINC000001706453	394452254	/nfs/dbraw/zinc/45/22/54/394452254.db2.gz	AHSWXWCMUKTJBE-BETUJISGSA-N	1	1	251.370	2.437	40	0		CEABMO
COc1ccc(CC[NH2+][C@@H]2CCCC[C@@H]2N)cc1OC	ZINC000218854284	394457485	/nfs/dbraw/zinc/45/74/85/394457485.db2.gz	VYLYNSDJXFXCBX-UONOGXRCSA-N	1	1	278.396	2.106	40	0		CEABMO
COc1ccc([C@@H]2[C@@H]([NH3+])C(=O)N2c2ccc(OC)cc2)cc1	ZINC000038242695	394498012	/nfs/dbraw/zinc/49/80/12/394498012.db2.gz	ODABPKUONBXULF-HZPDHXFCSA-N	1	1	298.342	2.119	40	0		CEABMO
CC[N@H+]1CCC[C@@H]1c1cnc(N2CCOCC2)cc1C	ZINC000072219391	394594461	/nfs/dbraw/zinc/59/44/61/394594461.db2.gz	UZIOCKPUEFRHDM-OAHLLOKOSA-N	1	1	275.396	2.383	40	0		CEABMO
Cc1cccc(N2C(=O)[C@H]([NH3+])[C@@H]2c2ccccc2)c1	ZINC000072227397	394595637	/nfs/dbraw/zinc/59/56/37/394595637.db2.gz	SXKSANYKZLGAMA-CABCVRRESA-N	1	1	252.317	2.410	40	0		CEABMO
CCSc1ccccc1C(=O)N1CC[NH+](C)CC1	ZINC000007068863	170266226	/nfs/dbraw/zinc/26/62/26/170266226.db2.gz	BBPQVEVPSVNKPA-UHFFFAOYSA-N	1	1	264.394	2.186	40	0		CEABMO
O=C(NC1CC1)[C@H]1CCC[N@@H+](Cc2ccccc2)C1	ZINC000038850066	174158000	/nfs/dbraw/zinc/15/80/00/174158000.db2.gz	HAQHTXXFBMZFQN-AWEZNQCLSA-N	1	1	258.365	2.177	40	0		CEABMO
NC(=O)C[C@@H]([NH3+])c1ccc(-c2ccc(Cl)cc2)o1	ZINC000044252975	175156443	/nfs/dbraw/zinc/15/64/43/175156443.db2.gz	XGPGKLCFKDIWRM-SNVBAGLBSA-N	1	1	264.712	2.475	40	0		CEABMO
C[C@H]1C[N@H+]2CCC[C@H]2CN1Cc1[nH]nnc1-c1ccccc1	ZINC000072324565	176369558	/nfs/dbraw/zinc/36/95/58/176369558.db2.gz	WUUMZCWPQSDLDY-ZFWWWQNUSA-N	1	1	297.406	2.140	40	0		CEABMO
C[C@H]1C[N@@H+]2CCC[C@H]2CN1Cc1n[nH]nc1-c1ccccc1	ZINC000072324565	176369560	/nfs/dbraw/zinc/36/95/60/176369560.db2.gz	WUUMZCWPQSDLDY-ZFWWWQNUSA-N	1	1	297.406	2.140	40	0		CEABMO
C[C@H]1C[N@H+]2CCC[C@H]2CN1Cc1n[nH]nc1-c1ccccc1	ZINC000072324565	176369561	/nfs/dbraw/zinc/36/95/61/176369561.db2.gz	WUUMZCWPQSDLDY-ZFWWWQNUSA-N	1	1	297.406	2.140	40	0		CEABMO
CCc1nccn1-c1nccnc1[C@H]1CCC[N@@H+](C)C1	ZINC000072350496	176373398	/nfs/dbraw/zinc/37/33/98/176373398.db2.gz	FFTLGYUFGDLTDH-LBPRGKRZSA-N	1	1	271.368	2.034	40	0		CEABMO
OCc1cc([C@H]2CCC[N@@H+](CCc3ccccc3)C2)n[nH]1	ZINC000072363742	176378220	/nfs/dbraw/zinc/37/82/20/176378220.db2.gz	QSYWFJNBNXRWNO-HNNXBMFYSA-N	1	1	285.391	2.324	40	0		CEABMO
OCc1cc([C@H]2CCC[N@H+](CCc3ccccc3)C2)[nH]n1	ZINC000072363742	176378221	/nfs/dbraw/zinc/37/82/21/176378221.db2.gz	QSYWFJNBNXRWNO-HNNXBMFYSA-N	1	1	285.391	2.324	40	0		CEABMO
OCc1cc([C@H]2CCC[N@@H+](CCc3ccccc3)C2)[nH]n1	ZINC000072363742	176378223	/nfs/dbraw/zinc/37/82/23/176378223.db2.gz	QSYWFJNBNXRWNO-HNNXBMFYSA-N	1	1	285.391	2.324	40	0		CEABMO
Cc1nc(Nc2ncccn2)cc([C@@H]2CCC[N@@H+]2C)n1	ZINC000072382616	176388356	/nfs/dbraw/zinc/38/83/56/176388356.db2.gz	YPVFHVYNZZQPNC-LBPRGKRZSA-N	1	1	270.340	2.085	40	0		CEABMO
CC(C)C[N@H+]1CCC[C@@H](c2[nH]nc3nccnc32)C1	ZINC000072395873	176394315	/nfs/dbraw/zinc/39/43/15/176394315.db2.gz	BXLJATFNJHXGPX-LLVKDONJSA-N	1	1	259.357	2.188	40	0		CEABMO
COC[C@@H](O)C[N@H+]1C[C@H](c2ccc(F)cc2)C[C@@H]1C	ZINC000077177252	177230765	/nfs/dbraw/zinc/23/07/65/177230765.db2.gz	ABCPPHYURVKKRG-LNSITVRQSA-N	1	1	267.344	2.011	40	0		CEABMO
COc1ccc([C@H]([NH3+])c2nc(-c3ccoc3C)n[nH]2)cc1	ZINC000095533679	185005824	/nfs/dbraw/zinc/00/58/24/185005824.db2.gz	NKOGKPHCOUJVMM-ZDUSSCGKSA-N	1	1	284.319	2.430	40	0		CEABMO
CCOC[C@@]12CCCO[C@H]1CC[N@H+](Cc1cc(C)on1)C2	ZINC000096039432	185069273	/nfs/dbraw/zinc/06/92/73/185069273.db2.gz	PESAIUXESGOVHU-HOTGVXAUSA-N	1	1	294.395	2.391	40	0		CEABMO
CCOC[C@@]12CCCO[C@H]1CC[N@@H+](Cc1cc(C)on1)C2	ZINC000096039432	185069274	/nfs/dbraw/zinc/06/92/74/185069274.db2.gz	PESAIUXESGOVHU-HOTGVXAUSA-N	1	1	294.395	2.391	40	0		CEABMO
O=C1C[C@]2(CC[N@@H+](Cc3ccoc3)C2)CN1c1ccccn1	ZINC000096050787	185075113	/nfs/dbraw/zinc/07/51/13/185075113.db2.gz	UULUUCMSLMACPF-KRWDZBQOSA-N	1	1	297.358	2.304	40	0		CEABMO
c1ccc(CO[C@@H]2C[N@@H+](CC3CC3)[C@H]3CCCO[C@@H]23)nc1	ZINC000096058160	185078775	/nfs/dbraw/zinc/07/87/75/185078775.db2.gz	FGUFNSSWVQECAT-GVDBMIGSSA-N	1	1	288.391	2.240	40	0		CEABMO
C[C@@H]1CCC[N@@H+](C[C@H](O)COc2ccc(F)cc2)C1	ZINC000035031491	361804484	/nfs/dbraw/zinc/80/44/84/361804484.db2.gz	NERBENWZMZEVBI-OCCSQVGLSA-N	1	1	267.344	2.297	40	0		CEABMO
O[C@H]1CC[N@@H+](Cc2cccs2)[C@H]1Cc1cccnc1	ZINC000096061632	185083173	/nfs/dbraw/zinc/08/31/73/185083173.db2.gz	YPWUYYGQDDDCOQ-GJZGRUSLSA-N	1	1	274.389	2.321	40	0		CEABMO
CC(=O)N1CCC2(CCC[N@H+]2Cc2csc(C)n2)CC1	ZINC000096075385	185090351	/nfs/dbraw/zinc/09/03/51/185090351.db2.gz	KEBXUMJAMFFROA-UHFFFAOYSA-N	1	1	293.436	2.428	40	0		CEABMO
Cc1ccc(CN2CC[C@@H]3[C@@H]2CC[N@H+]3[C@@H]2CCOC2)o1	ZINC000096184702	344238853	/nfs/dbraw/zinc/23/88/53/344238853.db2.gz	LKROGKHWLIOURS-VNQPRFMTSA-N	1	1	276.380	2.026	40	0		CEABMO
COc1ccc2c3c1O[C@@H]1C[C@@H](O)C=C(CC[N@H+](C)C2)[C@H]31	ZINC000101729130	344249091	/nfs/dbraw/zinc/24/90/91/344249091.db2.gz	FFQKTDKDUHFQKE-CFVMTHIKSA-N	1	1	287.359	2.066	40	0		CEABMO
CCOC(=O)[C@H]1C[N@@H+](Cc2ccccc2)CC12CC2	ZINC000148843135	344414537	/nfs/dbraw/zinc/41/45/37/344414537.db2.gz	JEZLFPHQDRWQJL-CQSZACIVSA-N	1	1	259.349	2.462	40	0		CEABMO
CC[NH+]1CCN(C(=O)c2ccnc(C(C)(C)C)c2)CC1	ZINC000054177602	362516237	/nfs/dbraw/zinc/51/62/37/362516237.db2.gz	QHQNMBNWQZFTKL-UHFFFAOYSA-N	1	1	275.396	2.157	40	0		CEABMO
Cc1[nH+]ccn1-c1ccc(CNC(=O)C2CC2)cc1	ZINC000065201767	362804326	/nfs/dbraw/zinc/80/43/26/362804326.db2.gz	LPJCUNVGEHMKKG-UHFFFAOYSA-N	1	1	255.321	2.207	40	0		CEABMO
c1ccc([C@H]2CNCC[N@@H+]2CC2CCOCC2)cc1	ZINC000068696161	362944693	/nfs/dbraw/zinc/94/46/93/362944693.db2.gz	RIQUVGITKWYUDX-MRXNPFEDSA-N	1	1	260.381	2.060	40	0		CEABMO
c1ccc([C@H]2C[NH2+]CCN2CC2CCOCC2)cc1	ZINC000068696161	362944697	/nfs/dbraw/zinc/94/46/97/362944697.db2.gz	RIQUVGITKWYUDX-MRXNPFEDSA-N	1	1	260.381	2.060	40	0		CEABMO
O=C1NCC[N@H+](CCc2ccccc2)[C@H]1c1ccccc1	ZINC000090662035	180019702	/nfs/dbraw/zinc/01/97/02/180019702.db2.gz	PWCWFEULDOSSJE-KRWDZBQOSA-N	1	1	280.371	2.402	40	0		CEABMO
O=C1NCC[N@@H+](CCc2ccccc2)[C@H]1c1ccccc1	ZINC000090662035	180019704	/nfs/dbraw/zinc/01/97/04/180019704.db2.gz	PWCWFEULDOSSJE-KRWDZBQOSA-N	1	1	280.371	2.402	40	0		CEABMO
O=C1[C@@H]2C[N@@H+](Cc3ccccn3)C[C@@H]2CN1c1ccccc1	ZINC000107742910	186188895	/nfs/dbraw/zinc/18/88/95/186188895.db2.gz	CEDUHCXFNALMTE-RHSMWYFYSA-N	1	1	293.370	2.176	40	0		CEABMO
Cc1nc([C@@H]2CCC[N@H+]2C2CCCCC2)ncc1C(N)=O	ZINC000072345419	363130072	/nfs/dbraw/zinc/13/00/72/363130072.db2.gz	NKZPAILZPDZDOF-AWEZNQCLSA-N	1	1	288.395	2.354	40	0		CEABMO
CNc1cccc([C@@H]2CCCN(c3cnccn3)C2)[nH+]1	ZINC000072380917	363131186	/nfs/dbraw/zinc/13/11/86/363131186.db2.gz	CDFJZKYYYPWCRY-GFCCVEGCSA-N	1	1	269.352	2.297	40	0		CEABMO
CC[N@@H+](CCO)C[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000079393519	363594521	/nfs/dbraw/zinc/59/45/21/363594521.db2.gz	GBGJOVWOEAVFAF-KRWDZBQOSA-N	1	1	276.424	2.213	40	0		CEABMO
O=C([O-])C[NH+]1CCC([N@H+](Cc2ccccc2)C2CC2)CC1	ZINC000079416255	363599342	/nfs/dbraw/zinc/59/93/42/363599342.db2.gz	ZHZZMYBWMUJCDA-UHFFFAOYSA-N	1	1	288.391	2.200	40	0		CEABMO
O=C([O-])C[NH+]1CCC([N@@H+](Cc2ccccc2)C2CC2)CC1	ZINC000079416255	363599348	/nfs/dbraw/zinc/59/93/48/363599348.db2.gz	ZHZZMYBWMUJCDA-UHFFFAOYSA-N	1	1	288.391	2.200	40	0		CEABMO
C[NH+]1CCN(C(=O)CCSCc2ccccc2)CC1	ZINC000013688090	361437367	/nfs/dbraw/zinc/43/73/67/361437367.db2.gz	PYTTWBSYWFLYDY-UHFFFAOYSA-N	1	1	278.421	2.084	40	0		CEABMO
COc1ccc(CN2C[C@@H]3CCC[N@H+]3C[C@@H]2C)c(OC)c1	ZINC000019575760	361543745	/nfs/dbraw/zinc/54/37/45/361543745.db2.gz	FADZAKJCSKJSIQ-ZFWWWQNUSA-N	1	1	290.407	2.372	40	0		CEABMO
COC[C@@H]1C[N@@H+](C)C[C@@]12CCN(Cc1cccs1)C2	ZINC000096218078	364413039	/nfs/dbraw/zinc/41/30/39/364413039.db2.gz	SNUDYNPFHTZCHQ-DZGCQCFKSA-N	1	1	280.437	2.148	40	0		CEABMO
CC[N@H+]1CCOCC12CCN(C(=O)c1cccs1)CC2	ZINC000096226159	364414478	/nfs/dbraw/zinc/41/44/78/364414478.db2.gz	JGGWVMDTHIPHDD-UHFFFAOYSA-N	1	1	294.420	2.075	40	0		CEABMO
c1coc(C[N@@H+]2CC[C@H]3OCCN(CC4CC4)[C@H]3CC2)c1	ZINC000096249303	364416083	/nfs/dbraw/zinc/41/60/83/364416083.db2.gz	OXKNUNVMFCNJIV-DLBZAZTESA-N	1	1	290.407	2.355	40	0		CEABMO
c1coc(CN2CC[C@H]3OCC[N@@H+](CC4CC4)[C@H]3CC2)c1	ZINC000096249303	364416093	/nfs/dbraw/zinc/41/60/93/364416093.db2.gz	OXKNUNVMFCNJIV-DLBZAZTESA-N	1	1	290.407	2.355	40	0		CEABMO
c1coc(CN2CC[C@H]3OCC[N@H+](CC4CC4)[C@H]3CC2)c1	ZINC000096249303	364416098	/nfs/dbraw/zinc/41/60/98/364416098.db2.gz	OXKNUNVMFCNJIV-DLBZAZTESA-N	1	1	290.407	2.355	40	0		CEABMO
COCC[N@H+]1CCc2ncnc(-c3ccccc3)c2CC1	ZINC000096255372	364418467	/nfs/dbraw/zinc/41/84/67/364418467.db2.gz	RLAVLYONHDQYGJ-UHFFFAOYSA-N	1	1	283.375	2.191	40	0		CEABMO
Cc1nc(C[N@@H+]2CCc3nc(C)nc(C)c3CC2)cs1	ZINC000096254516	364419135	/nfs/dbraw/zinc/41/91/35/364419135.db2.gz	FMINAZSSOZHUCZ-UHFFFAOYSA-N	1	1	288.420	2.459	40	0		CEABMO
Cc1nc(C[N@H+]2CCc3nc(C)nc(C)c3CC2)cs1	ZINC000096254516	364419140	/nfs/dbraw/zinc/41/91/40/364419140.db2.gz	FMINAZSSOZHUCZ-UHFFFAOYSA-N	1	1	288.420	2.459	40	0		CEABMO
CC(C)(C)OC(=O)CC[C@H]([NH3+])C(=O)OCc1ccccc1	ZINC000098181730	364536552	/nfs/dbraw/zinc/53/65/52/364536552.db2.gz	NIMSPPYFNNQHCP-ZDUSSCGKSA-N	1	1	293.363	2.179	40	0		CEABMO
CN1C(=O)CC[C@]12CCC[N@@H+](Cc1nccs1)CC2	ZINC000585100516	367178231	/nfs/dbraw/zinc/17/82/31/367178231.db2.gz	LWMQWFQFXKEOQY-AWEZNQCLSA-N	1	1	279.409	2.120	40	0		CEABMO
CCCNC(=O)NCc1ccc(-n2cc[nH+]c2C)cc1	ZINC000225773271	370316240	/nfs/dbraw/zinc/31/62/40/370316240.db2.gz	MWHMNAIPAHECNF-UHFFFAOYSA-N	1	1	272.352	2.390	40	0		CEABMO
CC[N@H+]1CC[C@@]2(c3ccccc3)CCN(C(C)=O)C[C@@H]12	ZINC000247898983	371145584	/nfs/dbraw/zinc/14/55/84/371145584.db2.gz	ADFKGDUQBPZDFV-SJORKVTESA-N	1	1	272.392	2.271	40	0		CEABMO
Oc1cccc(C[NH2+]Cc2ccnn2C(F)F)c1	ZINC000256049908	190003115	/nfs/dbraw/zinc/00/31/15/190003115.db2.gz	BYCVCSKCQRYNMD-UHFFFAOYSA-N	1	1	253.252	2.274	40	0		CEABMO
CC[C@H](C)n1nccc1C[NH2+]CCN(CC)CC	ZINC000256053523	190004700	/nfs/dbraw/zinc/00/47/00/190004700.db2.gz	RTXGBJCCWLJPOE-ZDUSSCGKSA-N	1	1	252.406	2.286	40	0		CEABMO
Cn1ccnc1C[N@H+]1C[C@@H]2[C@H](Oc3cccnc3)CC[C@@H]2C1	ZINC000257204325	190011197	/nfs/dbraw/zinc/01/11/97/190011197.db2.gz	ATZJXZNDVLYDRE-VNQPRFMTSA-N	1	1	298.390	2.105	40	0		CEABMO
Cn1ccnc1C[N@@H+]1C[C@@H]2[C@H](Oc3cccnc3)CC[C@@H]2C1	ZINC000257204325	190011198	/nfs/dbraw/zinc/01/11/98/190011198.db2.gz	ATZJXZNDVLYDRE-VNQPRFMTSA-N	1	1	298.390	2.105	40	0		CEABMO
Cc1ccnc([C@H]2CC[N@H+](Cc3cccn3C)C2)n1	ZINC000257212425	190013192	/nfs/dbraw/zinc/01/31/92/190013192.db2.gz	CDIOVHLEUBIEFR-ZDUSSCGKSA-N	1	1	256.353	2.113	40	0		CEABMO
c1ccc(C[C@H]2COCC[N@H+](C3CCOCC3)C2)cc1	ZINC000257226730	190015324	/nfs/dbraw/zinc/01/53/24/190015324.db2.gz	FLWHIFQLCQVPRJ-MRXNPFEDSA-N	1	1	275.392	2.357	40	0		CEABMO
c1cn2c(n1)nccc2[C@@H]1CCC[N@@H+]1Cc1ccncc1	ZINC000257228024	190015949	/nfs/dbraw/zinc/01/59/49/190015949.db2.gz	FRZZEROJNCWHLI-AWEZNQCLSA-N	1	1	279.347	2.461	40	0		CEABMO
CCn1nccc1-c1cc([C@@H]2CCC[N@H+]2C)nc(C)n1	ZINC000257223443	190015010	/nfs/dbraw/zinc/01/50/10/190015010.db2.gz	DXJFVLHENFHJTA-AWEZNQCLSA-N	1	1	271.368	2.435	40	0		CEABMO
CCn1cc(-c2nccnc2C[C@@H]2CCC[N@@H+](C)C2)cn1	ZINC000257243166	190018386	/nfs/dbraw/zinc/01/83/86/190018386.db2.gz	IFRMHXNINWBTLQ-ZDUSSCGKSA-N	1	1	285.395	2.244	40	0		CEABMO
CCn1nccc1-c1cncc([C@@H]2CCC[N@H+]2C)n1	ZINC000257243295	190018825	/nfs/dbraw/zinc/01/88/25/190018825.db2.gz	IGGJMFCIBRWUQO-ZDUSSCGKSA-N	1	1	257.341	2.127	40	0		CEABMO
CNc1cc(C)[nH+]c([C@@H]2CCN(Cc3cncn3C)C2)c1	ZINC000257271531	190023791	/nfs/dbraw/zinc/02/37/91/190023791.db2.gz	MYRNTEVPBFDTBB-CYBMUJFWSA-N	1	1	285.395	2.155	40	0		CEABMO
C[C@]12CCCC[N@H+](Cc3cscn3)[C@H]1CCC(=O)N2	ZINC000257262504	190022060	/nfs/dbraw/zinc/02/20/60/190022060.db2.gz	LLRPPVQGXYLGHX-JSGCOSHPSA-N	1	1	279.409	2.166	40	0		CEABMO
C[C@]12CCCC[N@@H+](Cc3cscn3)[C@H]1CCC(=O)N2	ZINC000257262504	190022061	/nfs/dbraw/zinc/02/20/61/190022061.db2.gz	LLRPPVQGXYLGHX-JSGCOSHPSA-N	1	1	279.409	2.166	40	0		CEABMO
Cc1c[nH]nc1[C@H]1CC[N@@H+](Cc2ccc(C)nc2)C1	ZINC000257285044	190026922	/nfs/dbraw/zinc/02/69/22/190026922.db2.gz	PFKBCBBBYLFGGM-AWEZNQCLSA-N	1	1	256.353	2.411	40	0		CEABMO
CC(C)[N@H+]1CCC[C@H](c2cncc(-c3ccnn3C)n2)C1	ZINC000257290680	190027828	/nfs/dbraw/zinc/02/78/28/190027828.db2.gz	QDXHBZDXLAVSIZ-ZDUSSCGKSA-N	1	1	285.395	2.465	40	0		CEABMO
Cc1cc(C[N@@H+]2CCC[C@H](c3cncc(C)n3)C2)no1	ZINC000257320728	190033738	/nfs/dbraw/zinc/03/37/38/190033738.db2.gz	VYHBKRCVGZOTQK-ZDUSSCGKSA-N	1	1	272.352	2.461	40	0		CEABMO
Cc1cc(C[N@H+]2CCC[C@H](c3cncc(C)n3)C2)no1	ZINC000257320728	190033739	/nfs/dbraw/zinc/03/37/39/190033739.db2.gz	VYHBKRCVGZOTQK-ZDUSSCGKSA-N	1	1	272.352	2.461	40	0		CEABMO
Cc1cc(-c2nccnc2C[C@H]2CCC[N@H+](C)C2)n[nH]1	ZINC000257328769	190034635	/nfs/dbraw/zinc/03/46/35/190034635.db2.gz	XHBAJTIFIIVBCR-GFCCVEGCSA-N	1	1	271.368	2.059	40	0		CEABMO
Cc1ccnc([C@@H]2CC[N@@H+](Cc3ncccc3C)C2)n1	ZINC000257332127	190035259	/nfs/dbraw/zinc/03/52/59/190035259.db2.gz	XVWFXHFDFMEDPA-CQSZACIVSA-N	1	1	268.364	2.478	40	0		CEABMO
O=C1CCC[C@@]2(CCC[N@H+](Cc3ccc(F)cc3)C2)N1	ZINC000096049944	296321513	/nfs/dbraw/zinc/32/15/13/296321513.db2.gz	RHZNYTVNCMYEST-INIZCTEOSA-N	1	1	276.355	2.460	40	0		CEABMO
Cc1[nH+]c(N(C)C)ccc1CNC(=O)OC(C)(C)C	ZINC000072224143	394594248	/nfs/dbraw/zinc/59/42/48/394594248.db2.gz	BAQXBGPJNWNLHZ-UHFFFAOYSA-N	1	1	265.357	2.481	40	0		CEABMO
CC(=O)N1CC[N@@H+](CC2CC2)C[C@@H]1c1ccccc1	ZINC000257229493	394595421	/nfs/dbraw/zinc/59/54/21/394595421.db2.gz	FYIAFFBDGYHKBN-MRXNPFEDSA-N	1	1	258.365	2.302	40	0		CEABMO
Cc1cc(-c2cc(C)nc([C@H]3CCC[N@H+](C)C3)n2)n[nH]1	ZINC000257258288	394595621	/nfs/dbraw/zinc/59/56/21/394595621.db2.gz	KTEIRCCEZJDBSZ-LBPRGKRZSA-N	1	1	271.368	2.293	40	0		CEABMO
Cc1ccc([C@@H]2[C@H]([NH3+])C(=O)N2Cc2ccccc2)cc1	ZINC000072228118	394596113	/nfs/dbraw/zinc/59/61/13/394596113.db2.gz	SZTPIZQQBNMZEM-JKSUJKDBSA-N	1	1	266.344	2.406	40	0		CEABMO
COc1cccc([C@H]2[C@@H]([NH3+])C(=O)N2c2cccc(F)c2)c1	ZINC000072227629	394596702	/nfs/dbraw/zinc/59/67/02/394596702.db2.gz	JCCNXIYOKNTTFY-CABCVRRESA-N	1	1	286.306	2.250	40	0		CEABMO
C[N@H+]1CCC[C@@H](Nc2cncc(Br)c2)C1	ZINC000096510503	394694188	/nfs/dbraw/zinc/69/41/88/394694188.db2.gz	UGBBFMZUPNGDOF-SNVBAGLBSA-N	1	1	270.174	2.350	40	0		CEABMO
CCN1C(=O)[C@@H]([NH3+])[C@H]1c1ccc(Cl)cc1Cl	ZINC000096526077	394697258	/nfs/dbraw/zinc/69/72/58/394697258.db2.gz	WTJUGUHOEKJQEP-VHSXEESVSA-N	1	1	259.136	2.224	40	0		CEABMO
COc1ccc(OC[C@H](O)C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1	ZINC000006008122	286346380	/nfs/dbraw/zinc/34/63/80/286346380.db2.gz	RHMRQCVSUOJGHE-QLFBSQMISA-N	1	1	293.407	2.413	40	0		CEABMO
Nc1ncc(-c2ccccc2)c([C@H]2CCCC[N@H+]2CCO)n1	ZINC000072354571	176375009	/nfs/dbraw/zinc/37/50/09/176375009.db2.gz	DJYSVJGZYVLTEV-OAHLLOKOSA-N	1	1	298.390	2.245	40	0		CEABMO
C[N@H+]1CCC[C@@H](c2cnc(Nc3nccs3)cn2)C1	ZINC000072361544	176377780	/nfs/dbraw/zinc/37/77/80/176377780.db2.gz	LRKNQVBPEFZRQM-SNVBAGLBSA-N	1	1	275.381	2.486	40	0		CEABMO
CC(C)(C)OC(=O)N1CC[NH2+][C@H](c2ccc(O)cc2)C1	ZINC000022016137	277189414	/nfs/dbraw/zinc/18/94/14/277189414.db2.gz	RIFREXHZVUBIOK-ZDUSSCGKSA-N	1	1	278.352	2.274	40	0		CEABMO
C[C@@H]1c2ccccc2CCN1c1cc[nH+]c(NCCO)n1	ZINC000328964242	279134440	/nfs/dbraw/zinc/13/44/40/279134440.db2.gz	BUEUHOUONYILJL-GFCCVEGCSA-N	1	1	284.363	2.005	40	0		CEABMO
CCOC(=O)CC(=O)[C@H]1CCC[N@@H+]1Cc1ccccc1	ZINC000026896622	327132913	/nfs/dbraw/zinc/13/29/13/327132913.db2.gz	AYYUONFQYZPRRR-CQSZACIVSA-N	1	1	275.348	2.173	40	0		CEABMO
CCOC(=O)CC(=O)[C@H]1CCC[N@H+]1Cc1ccccc1	ZINC000026896622	327132914	/nfs/dbraw/zinc/13/29/14/327132914.db2.gz	AYYUONFQYZPRRR-CQSZACIVSA-N	1	1	275.348	2.173	40	0		CEABMO
CC(C)[N@@H+](C1CCCCC1)[C@@H]1CNCC[C@@]1(C)O	ZINC000685936217	567104929	/nfs/dbraw/zinc/10/49/29/567104929.db2.gz	KQGQPKSUPVGZKW-HUUCEWRRSA-N	1	1	254.418	2.142	40	0		CEABMO
C=C1[NH+]=C(SC)N[C@H](CCC)C1C(=O)OCC	ZINC000408730558	570219252	/nfs/dbraw/zinc/21/92/52/570219252.db2.gz	HYPAQDPDEMLLPS-SECBINFHSA-N	1	1	256.371	2.314	40	0		CEABMO
COC[C@H]1c2nnn(CC3CC3)c2CC[N@H+]1CC1CCC1	ZINC000096045381	185071956	/nfs/dbraw/zinc/07/19/56/185071956.db2.gz	ZVQNECYVFXVSGU-HNNXBMFYSA-N	1	1	290.411	2.034	40	0		CEABMO
COC[C@H]1c2nnn(CC3CC3)c2CC[N@@H+]1CC1CCC1	ZINC000096045381	185071957	/nfs/dbraw/zinc/07/19/57/185071957.db2.gz	ZVQNECYVFXVSGU-HNNXBMFYSA-N	1	1	290.411	2.034	40	0		CEABMO
O=C1CC[C@@]2(CCC[N@@H+](Cc3cccs3)CC2)N1	ZINC000096047436	185073147	/nfs/dbraw/zinc/07/31/47/185073147.db2.gz	LPHLDWYPNPQVAS-CQSZACIVSA-N	1	1	264.394	2.383	40	0		CEABMO
c1ccc(CN2C[C@H]3C[NH+](Cc4cccnc4)C[C@@H]3C2)nc1	ZINC000096053739	185073966	/nfs/dbraw/zinc/07/39/66/185073966.db2.gz	KKKJJFQEUFFWDH-IAGOWNOFSA-N	1	1	294.402	2.040	40	0		CEABMO
O=C1C[C@@H]2[C@H](CC[N@H+]2Cc2ccco2)N1Cc1ccncc1	ZINC000096055672	185075362	/nfs/dbraw/zinc/07/53/62/185075362.db2.gz	PHMKLVMOKRBPNK-JKSUJKDBSA-N	1	1	297.358	2.050	40	0		CEABMO
c1cncc(O[C@@H]2CC[C@H]3[C@H]2OCC[N@@H+]3CC2CC2)c1	ZINC000096057981	185078425	/nfs/dbraw/zinc/07/84/25/185078425.db2.gz	DHTVSABXAQZHEG-ARFHVFGLSA-N	1	1	274.364	2.102	40	0		CEABMO
CCOC[C@H]1Cn2nccc2C[N@H+](Cc2ccc(C)o2)C1	ZINC000096059214	185078623	/nfs/dbraw/zinc/07/86/23/185078623.db2.gz	JBNYKGIPCNMNSS-CQSZACIVSA-N	1	1	289.379	2.453	40	0		CEABMO
CCOC[C@H]1Cn2nccc2C[N@@H+](Cc2ccc(C)o2)C1	ZINC000096059214	185078624	/nfs/dbraw/zinc/07/86/24/185078624.db2.gz	JBNYKGIPCNMNSS-CQSZACIVSA-N	1	1	289.379	2.453	40	0		CEABMO
O=C1CC[C@]2(c3ccc(Cl)cc3)[NH2+]CCCCN12	ZINC000035572421	361821227	/nfs/dbraw/zinc/82/12/27/361821227.db2.gz	UIYOOZDJBDNOBF-AWEZNQCLSA-N	1	1	264.756	2.499	40	0		CEABMO
COc1ncccc1C[N@H+]1CC[C@@H]2O[C@@H](C)C[C@H]2C1	ZINC000096070513	185085695	/nfs/dbraw/zinc/08/56/95/185085695.db2.gz	RRRVNUSHBZVOTM-UBHSHLNASA-N	1	1	262.353	2.090	40	0		CEABMO
CC1(C)[C@@H]2CC[C@@]1(C)[C@H](NC(=O)CC[NH+]1CCOCC1)C2	ZINC000035930605	361823739	/nfs/dbraw/zinc/82/37/39/361823739.db2.gz	YXXRVERJCNRUEY-CPUCHLNUSA-N	1	1	294.439	2.040	40	0		CEABMO
O=C(Cc1cccs1)N1CC[C@@]2(CC[N@H+]2CC2CC2)C1	ZINC000096076004	185089498	/nfs/dbraw/zinc/08/94/98/185089498.db2.gz	FHZNXFYBJNEPKR-MRXNPFEDSA-N	1	1	290.432	2.377	40	0		CEABMO
Clc1cccc(OCCCC[NH+]2CCNCC2)c1	ZINC000041388972	362032729	/nfs/dbraw/zinc/03/27/29/362032729.db2.gz	AKHJTGBZUAZSTP-UHFFFAOYSA-N	1	1	268.788	2.404	40	0		CEABMO
C[C@H]1CCC[N@@H+](CCCNC(=O)C2CCCC2)C1	ZINC000046960004	362192279	/nfs/dbraw/zinc/19/22/79/362192279.db2.gz	FHYVGIFKIHUBBH-ZDUSSCGKSA-N	1	1	252.402	2.415	40	0		CEABMO
Cc1nc(NCCO)cc(N2Cc3ccccc3C[C@@H]2C)[nH+]1	ZINC000329042609	136377593	/nfs/dbraw/zinc/37/75/93/136377593.db2.gz	SOYBEKZQZPRYHW-LBPRGKRZSA-N	1	1	298.390	2.140	40	0		CEABMO
Cn1cncc1-c1nnc([C@H]2CC[N@@H+](Cc3ccco3)C2)o1	ZINC000049170461	362343181	/nfs/dbraw/zinc/34/31/81/362343181.db2.gz	YJEQAJXIBXAHCU-NSHDSACASA-N	1	1	299.334	2.053	40	0	biogenic,in-vitro	CEABMO
O=C1CC[C@H]2[C@H](CC[N@H+]2CC2CC2)N1Cc1ccncc1	ZINC000096186400	344238966	/nfs/dbraw/zinc/23/89/66/344238966.db2.gz	TWWABEJEFQYZHL-HOTGVXAUSA-N	1	1	285.391	2.057	40	0		CEABMO
O=C1C[C@H]2[C@@H](CC[N@H+]2CC2CC2)N1c1ccsc1	ZINC000096184146	344238897	/nfs/dbraw/zinc/23/88/97/344238897.db2.gz	NMRYPNDWZVQNNK-OLZOCXBDSA-N	1	1	262.378	2.338	40	0		CEABMO
Cc1ccc(OC[C@]2(O)CC[N@@H+](Cc3ccccn3)C2)cc1	ZINC000585269293	345009328	/nfs/dbraw/zinc/00/93/28/345009328.db2.gz	OJLMTJMJLQTKCX-SFHVURJKSA-N	1	1	298.386	2.406	40	0		CEABMO
Cc1nc(C[N@@H+]2CC[C@H](Cc3ccccc3)[C@H](O)C2)co1	ZINC000585279819	345009949	/nfs/dbraw/zinc/00/99/49/345009949.db2.gz	PXGGXJLQSCIMOV-NVXWUHKLSA-N	1	1	286.375	2.409	40	0		CEABMO
Cc1nc(C[N@H+]2CC[C@H](Cc3ccccc3)[C@H](O)C2)co1	ZINC000585279819	345009952	/nfs/dbraw/zinc/00/99/52/345009952.db2.gz	PXGGXJLQSCIMOV-NVXWUHKLSA-N	1	1	286.375	2.409	40	0		CEABMO
CO[C@@H]1C[N@H+](Cc2cc[nH]n2)CC[C@@H]1Cc1ccccc1	ZINC000585278574	345010158	/nfs/dbraw/zinc/01/01/58/345010158.db2.gz	PFQPYHMOLGCXCL-NVXWUHKLSA-N	1	1	285.391	2.489	40	0		CEABMO
CO[C@@H]1C[N@@H+](Cc2cc[nH]n2)CC[C@@H]1Cc1ccccc1	ZINC000585278574	345010161	/nfs/dbraw/zinc/01/01/61/345010161.db2.gz	PFQPYHMOLGCXCL-NVXWUHKLSA-N	1	1	285.391	2.489	40	0		CEABMO
c1ccc([C@@H]2CNCC[N@@H+]2CC2CCOCC2)cc1	ZINC000068696157	362944348	/nfs/dbraw/zinc/94/43/48/362944348.db2.gz	RIQUVGITKWYUDX-INIZCTEOSA-N	1	1	260.381	2.060	40	0		CEABMO
c1ccc([C@@H]2C[NH2+]CCN2CC2CCOCC2)cc1	ZINC000068696157	362944352	/nfs/dbraw/zinc/94/43/52/362944352.db2.gz	RIQUVGITKWYUDX-INIZCTEOSA-N	1	1	260.381	2.060	40	0		CEABMO
NC(=O)C[C@@H]([NH3+])c1ccc(-c2cccc(Cl)c2)o1	ZINC000090586007	180009129	/nfs/dbraw/zinc/00/91/29/180009129.db2.gz	DFQDDRATPQBIGH-SNVBAGLBSA-N	1	1	264.712	2.475	40	0		CEABMO
CCN1CC[C@]2(CCC[N@@H+](Cc3ccncc3)CC2)C1=O	ZINC000108528546	186220612	/nfs/dbraw/zinc/22/06/12/186220612.db2.gz	SDLPMSZZJVONON-QGZVFWFLSA-N	1	1	287.407	2.306	40	0		CEABMO
CC[N@H+](Cc1ccccc1)C[C@H]1CCCN(CCO)C1	ZINC000079414232	363597366	/nfs/dbraw/zinc/59/73/66/363597366.db2.gz	ICHYVSCXFWXEHL-QGZVFWFLSA-N	1	1	276.424	2.213	40	0		CEABMO
CC(C)[C@@H](c1nnnn1C[C@H]1CCCO1)[NH+]1CCCCC1	ZINC000000883952	361195061	/nfs/dbraw/zinc/19/50/61/361195061.db2.gz	UPCNQTQSEZLSPX-KGLIPLIRSA-N	1	1	293.415	2.035	40	0		CEABMO
C[C@@H]1C[N@H+]2CCC[C@H]2CN1Cc1[nH]nnc1-c1ccccc1	ZINC000019575058	361543893	/nfs/dbraw/zinc/54/38/93/361543893.db2.gz	WUUMZCWPQSDLDY-HIFRSBDPSA-N	1	1	297.406	2.140	40	0		CEABMO
C[C@@H]1C[N@@H+]2CCC[C@H]2CN1Cc1n[nH]nc1-c1ccccc1	ZINC000019575058	361543897	/nfs/dbraw/zinc/54/38/97/361543897.db2.gz	WUUMZCWPQSDLDY-HIFRSBDPSA-N	1	1	297.406	2.140	40	0		CEABMO
C[C@@H]1C[N@H+]2CCC[C@H]2CN1Cc1n[nH]nc1-c1ccccc1	ZINC000019575058	361543901	/nfs/dbraw/zinc/54/39/01/361543901.db2.gz	WUUMZCWPQSDLDY-HIFRSBDPSA-N	1	1	297.406	2.140	40	0		CEABMO
COc1ncccc1CN1CC[C@H]2[C@H]1CC[N@H+]2CC1CC1	ZINC000096184398	364407310	/nfs/dbraw/zinc/40/73/10/364407310.db2.gz	GNOKISZZHQTDFF-JKSUJKDBSA-N	1	1	287.407	2.149	40	0		CEABMO
c1cnc(N2CCC[C@@]3(CC[N@H+](CC4CC4)C3)C2)nc1	ZINC000096047166	364397848	/nfs/dbraw/zinc/39/78/48/364397848.db2.gz	JPKKMKHDIIKISI-INIZCTEOSA-N	1	1	272.396	2.179	40	0		CEABMO
CO[C@@H]1CC[N@@H+](Cc2nccn2C)[C@H]1Cc1ccccc1	ZINC000096200054	364408760	/nfs/dbraw/zinc/40/87/60/364408760.db2.gz	FSQRSBODWQPDFY-JKSUJKDBSA-N	1	1	285.391	2.252	40	0		CEABMO
c1ncn2c1C[N@@H+](CC1CC1)C[C@H](COc1cccnc1)C2	ZINC000096209342	364412952	/nfs/dbraw/zinc/41/29/52/364412952.db2.gz	ZOWFYNIPKFWMFH-HNNXBMFYSA-N	1	1	298.390	2.199	40	0		CEABMO
CC(=O)N1CC[C@@]2(C1)CCC[N@@H+](Cc1ccc(C)o1)C2	ZINC000096215942	364413430	/nfs/dbraw/zinc/41/34/30/364413430.db2.gz	SBPFMWIHTIFWCI-INIZCTEOSA-N	1	1	276.380	2.422	40	0		CEABMO
COCC[N@H+]1CCCC12CCN(Cc1nccs1)CC2	ZINC000096227881	364414804	/nfs/dbraw/zinc/41/48/04/364414804.db2.gz	BKVKYRGQEBHXNV-UHFFFAOYSA-N	1	1	295.452	2.220	40	0		CEABMO
Cn1nc(COCC2CC2)c2c1C[N@@H+](CC1CC1)CC2	ZINC000096259895	364418618	/nfs/dbraw/zinc/41/86/18/364418618.db2.gz	ODJDBABHMNNHON-UHFFFAOYSA-N	1	1	275.396	2.115	40	0		CEABMO
COc1cccc(C(=O)N2CC[C@]3(C2)CCC[N@@H+](C)C3)c1	ZINC000096268567	364420841	/nfs/dbraw/zinc/42/08/41/364420841.db2.gz	PDEJUARFCIHTIZ-QGZVFWFLSA-N	1	1	288.391	2.253	40	0		CEABMO
C[C@H]1c2ncc(CCOCc3ccncc3)n2CC[N@@H+]1C	ZINC000585097775	367177202	/nfs/dbraw/zinc/17/72/02/367177202.db2.gz	OLDHWSARQUNESW-ZDUSSCGKSA-N	1	1	286.379	2.044	40	0		CEABMO
COCC[N@H+]1CCC[C@@]2(CN(CC3CCCCC3)C2=O)C1	ZINC000585099399	367177510	/nfs/dbraw/zinc/17/75/10/367177510.db2.gz	ICUHPWCSWBVVHO-KRWDZBQOSA-N	1	1	294.439	2.138	40	0		CEABMO
CC(C)(C)OC(=O)Nc1cn(-c2cc[nH+]cc2)nn1	ZINC000218797548	370212819	/nfs/dbraw/zinc/21/28/19/370212819.db2.gz	PUHGULCWHPKDGK-UHFFFAOYSA-N	1	1	261.285	2.009	40	0		CEABMO
[NH3+]C[C@H]1[C@H]2CN(Cc3ccc(Cl)c(F)c3)C[C@@H]12	ZINC000247636757	371131137	/nfs/dbraw/zinc/13/11/37/371131137.db2.gz	FAAZCSOJONMFIE-JGPRNRPPSA-N	1	1	254.736	2.116	40	0		CEABMO
Cc1cccc(N2CCC[C@H]([N@@H+](C)Cc3ccn(C)n3)C2)n1	ZINC000257306720	371613135	/nfs/dbraw/zinc/61/31/35/371613135.db2.gz	SVNJDDDMIBGTNR-INIZCTEOSA-N	1	1	299.422	2.224	40	0		CEABMO
Cc1cccc(N2CCC[C@H]([N@H+](C)Cc3ccn(C)n3)C2)n1	ZINC000257306720	371613139	/nfs/dbraw/zinc/61/31/39/371613139.db2.gz	SVNJDDDMIBGTNR-INIZCTEOSA-N	1	1	299.422	2.224	40	0		CEABMO
COc1cccc(C[NH2+]Cc2ccn(CC(F)F)n2)c1	ZINC000256054555	190005401	/nfs/dbraw/zinc/00/54/01/190005401.db2.gz	WUAMZBRSXRTEGH-UHFFFAOYSA-N	1	1	281.306	2.447	40	0		CEABMO
CCCn1nc(C)cc1C[NH2+]Cc1ccnn1CCF	ZINC000256049942	190003137	/nfs/dbraw/zinc/00/31/37/190003137.db2.gz	CAKZBCUUYQBOAA-UHFFFAOYSA-N	1	1	279.363	2.057	40	0		CEABMO
CC(C)[N@H+]1CCC[C@@H](c2nccnc2-c2ccnn2C)C1	ZINC000257229032	190016228	/nfs/dbraw/zinc/01/62/28/190016228.db2.gz	FWKKCMXBDLXBSK-CYBMUJFWSA-N	1	1	285.395	2.465	40	0		CEABMO
CC(C)CNC(=O)c1cc([C@@H]2CCC[N@H+]2C)ccn1	ZINC000257254030	190020476	/nfs/dbraw/zinc/02/04/76/190020476.db2.gz	KBHCSBFCSDZVPK-AWEZNQCLSA-N	1	1	261.369	2.234	40	0		CEABMO
c1cncc(O[C@@H]2CC[C@@H]3C[N@H+](Cc4cncnc4)C[C@H]23)c1	ZINC000257246757	190019144	/nfs/dbraw/zinc/01/91/44/190019144.db2.gz	IVSCFTCYMRCTAX-HYVNUMGLSA-N	1	1	296.374	2.161	40	0		CEABMO
CCn1cc(CN2CC[N@@H+](C)[C@H](c3ccccc3)C2)cn1	ZINC000257265046	190023299	/nfs/dbraw/zinc/02/32/99/190023299.db2.gz	LXBCCSCABXWYFS-KRWDZBQOSA-N	1	1	284.407	2.392	40	0		CEABMO
Cc1cn(C)c([C@@H]2CCC[N@@H+](CC3CCOCC3)C2)n1	ZINC000257283414	190026608	/nfs/dbraw/zinc/02/66/08/190026608.db2.gz	OYFCSSHXZGNDHJ-OAHLLOKOSA-N	1	1	277.412	2.335	40	0		CEABMO
Cc1cc(C[N@@H+]2CCC[C@H](Cc3n[nH]cc3C)C2)no1	ZINC000257276361	190024536	/nfs/dbraw/zinc/02/45/36/190024536.db2.gz	NTJJBYMYERHTOR-CYBMUJFWSA-N	1	1	274.368	2.469	40	0		CEABMO
Cc1cc(C[N@H+]2CCC[C@H](Cc3n[nH]cc3C)C2)no1	ZINC000257276361	190024537	/nfs/dbraw/zinc/02/45/37/190024537.db2.gz	NTJJBYMYERHTOR-CYBMUJFWSA-N	1	1	274.368	2.469	40	0		CEABMO
CCN(CC)C(=O)c1cc([C@@H]2CCC[N@H+]2C)ccn1	ZINC000257274596	190024751	/nfs/dbraw/zinc/02/47/51/190024751.db2.gz	NLUIAYFETPUVBI-AWEZNQCLSA-N	1	1	261.369	2.330	40	0		CEABMO
C[N@H+]1CCCC[C@H]1c1cncc(NCC2CCOCC2)n1	ZINC000257314720	190032969	/nfs/dbraw/zinc/03/29/69/190032969.db2.gz	UYEHIZZCPBIONY-HNNXBMFYSA-N	1	1	290.411	2.472	40	0		CEABMO
CCCn1cc(C[N@H+]2CC[C@H](OC)[C@]3(CCCO3)C2)cn1	ZINC000257332726	190035567	/nfs/dbraw/zinc/03/55/67/190035567.db2.gz	XYKADCOMMDZCHW-HOTGVXAUSA-N	1	1	293.411	2.063	40	0		CEABMO
C[C@]12CCCC[N@@H+](Cc3ccccn3)[C@H]1CCCC(=O)N2	ZINC000257344622	190037839	/nfs/dbraw/zinc/03/78/39/190037839.db2.gz	ZYADBCGDUUHAAJ-RDJZCZTQSA-N	1	1	287.407	2.495	40	0		CEABMO
Cc1ccoc1C(=O)N1CC[C@H]2[C@H]1CC[N@H+]2CC1CC1	ZINC000306143061	376542449	/nfs/dbraw/zinc/54/24/49/376542449.db2.gz	XSCCDNOAKBMWMR-UONOGXRCSA-N	1	1	274.364	2.287	40	0		CEABMO
COc1ccc([C@H]([NH3+])c2nnc(CC(C)C)[nH]2)cc1OC	ZINC000095533891	256745242	/nfs/dbraw/zinc/74/52/42/256745242.db2.gz	AUMZLLDZEPWCMY-AWEZNQCLSA-N	1	1	290.367	2.069	40	0		CEABMO
CC(C)[N@H+]1CCC[C@@H]1c1ccc(N2CCOCC2)nc1	ZINC000072216161	256711732	/nfs/dbraw/zinc/71/17/32/256711732.db2.gz	QOLXMYIPOPDACE-OAHLLOKOSA-N	1	1	275.396	2.464	40	0		CEABMO
O=C(c1ccno1)N1CC[C@]2(C1)CCC[N@@H+](CC1CC1)C2	ZINC000096215537	256825960	/nfs/dbraw/zinc/82/59/60/256825960.db2.gz	MEBLVZDRXMPNMR-MRXNPFEDSA-N	1	1	289.379	2.013	40	0		CEABMO
Cc1cc(N2CCc3ccccc3C2)[nH+]cc1CO	ZINC000072223882	394594469	/nfs/dbraw/zinc/59/44/69/394594469.db2.gz	WVEPTLRCXAITAQ-UHFFFAOYSA-N	1	1	254.333	2.445	40	0		CEABMO
COc1ccc(N2C(=O)[C@@H]([NH3+])[C@@H]2c2cccc(OC)c2)cc1	ZINC000072227159	394595383	/nfs/dbraw/zinc/59/53/83/394595383.db2.gz	MVYYIMXSSCWNDH-HOTGVXAUSA-N	1	1	298.342	2.119	40	0		CEABMO
COc1cccc(N2C(=O)[C@@H]([NH3+])[C@H]2c2ccccc2F)c1	ZINC000072227758	394596208	/nfs/dbraw/zinc/59/62/08/394596208.db2.gz	WLKLXUJSOBBTIW-LSDHHAIUSA-N	1	1	286.306	2.250	40	0		CEABMO
[NH3+][C@@H]1C(=O)N(Cc2ccccc2)[C@@H]1c1cccs1	ZINC000072228114	394596729	/nfs/dbraw/zinc/59/67/29/394596729.db2.gz	OEQATJNDAUGNDQ-QWHCGFSZSA-N	1	1	258.346	2.159	40	0		CEABMO
CC[C@@H]([C@H]([NH3+])c1ccccc1F)S(=O)(=O)CC	ZINC000096524959	394697504	/nfs/dbraw/zinc/69/75/04/394697504.db2.gz	ZUGJWTPBVBGUMN-NWDGAFQWSA-N	1	1	259.346	2.039	40	0		CEABMO
C[N@@H+]1C[C@@H](c2cccc(Br)c2)[C@H](CO)C1	ZINC000217673271	400307763	/nfs/dbraw/zinc/30/77/63/400307763.db2.gz	UOALQWUFZSXGPE-JQWIXIFHSA-N	1	1	270.170	2.087	40	0		CEABMO
O=C(C[NH2+]Cc1ccco1)NC1CCCCCC1	ZINC000004895503	170037366	/nfs/dbraw/zinc/03/73/66/170037366.db2.gz	FDTZVPJJFNQSAJ-UHFFFAOYSA-N	1	1	250.342	2.208	40	0		CEABMO
Cc1ccc(C(C)C)c(OCC(=O)N2CC[NH+](C)CC2)c1	ZINC000039842763	174174403	/nfs/dbraw/zinc/17/44/03/174174403.db2.gz	ASUOVKHUKMFYKL-UHFFFAOYSA-N	1	1	290.407	2.271	40	0		CEABMO
NC(=O)C[C@H]([NH3+])c1ccc(-c2ccc(Cl)cc2)o1	ZINC000044252978	175156423	/nfs/dbraw/zinc/15/64/23/175156423.db2.gz	XGPGKLCFKDIWRM-JTQLQIEISA-N	1	1	264.712	2.475	40	0		CEABMO
CN1CC[NH2+][C@@H](Cc2ccc(-c3cccs3)cc2)C1=O	ZINC000072352852	176374326	/nfs/dbraw/zinc/37/43/26/176374326.db2.gz	HSTBOIIKHKTORF-AWEZNQCLSA-N	1	1	286.400	2.388	40	0		CEABMO
CN(C)c1cccc(C2CC[NH+](Cc3nccn3C)CC2)n1	ZINC000072364313	176379692	/nfs/dbraw/zinc/37/96/92/176379692.db2.gz	WDDVQVALQWIIRA-UHFFFAOYSA-N	1	1	299.422	2.261	40	0		CEABMO
Fc1cccc(OCCc2cc([C@@H]3CC[NH2+]C3)n[nH]2)c1	ZINC000072374091	176385372	/nfs/dbraw/zinc/38/53/72/176385372.db2.gz	IFOOVNJOPKYTPR-LLVKDONJSA-N	1	1	275.327	2.247	40	0		CEABMO
CN(Cc1ccc(Cl)cc1)C(=O)[C@]1(C)C[N@H+](C)CCO1	ZINC000072379379	176386406	/nfs/dbraw/zinc/38/64/06/176386406.db2.gz	AJHJKRQIWKHXRV-HNNXBMFYSA-N	1	1	296.798	2.019	40	0		CEABMO
CN(Cc1ccc(Cl)cc1)C(=O)[C@]1(C)C[N@@H+](C)CCO1	ZINC000072379379	176386408	/nfs/dbraw/zinc/38/64/08/176386408.db2.gz	AJHJKRQIWKHXRV-HNNXBMFYSA-N	1	1	296.798	2.019	40	0		CEABMO
CC(=O)N1CCC2(CC1)C[N@@H+](C)CC[C@H]2C(F)(F)F	ZINC000299842096	419473371	/nfs/dbraw/zinc/47/33/71/419473371.db2.gz	CWVGBWMCWVSQKF-LLVKDONJSA-N	1	1	278.318	2.129	40	0		CEABMO
C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@]1(N)C(F)(F)F	ZINC000228906085	260316784	/nfs/dbraw/zinc/31/67/84/260316784.db2.gz	NWNOBEWRLOTQFH-JQWIXIFHSA-N	1	1	258.287	2.398	40	0		CEABMO
C[N@H+]1CCC[C@@]2(C)[C@@H]1CCCN2C(=O)c1ccccn1	ZINC000257269818	277071008	/nfs/dbraw/zinc/07/10/08/277071008.db2.gz	MRNFHBVRLGNJJM-HOCLYGCPSA-N	1	1	273.380	2.171	40	0		CEABMO
Cc1ccc(N2C(=O)[C@@H]([NH3+])[C@H]2c2ccccc2)cc1	ZINC000059103818	280860542	/nfs/dbraw/zinc/86/05/42/280860542.db2.gz	OJTHEDVIZPWWAU-LSDHHAIUSA-N	1	1	252.317	2.410	40	0		CEABMO
Cc1cccc(N2CC[C@@H]3[C@H]2CCN3c2ncccn2)[nH+]1	ZINC000306124043	281229175	/nfs/dbraw/zinc/22/91/75/281229175.db2.gz	BEABPCHWYLZVKL-ZIAGYGMSSA-N	1	1	281.363	2.038	40	0		CEABMO
COc1ccc(CN2C[C@@H]3CCC[N@H+]3C[C@H]2C)cc1	ZINC000019575112	295131729	/nfs/dbraw/zinc/13/17/29/295131729.db2.gz	YIBMDJHUYQYHFA-HIFRSBDPSA-N	1	1	260.381	2.364	40	0		CEABMO
Cc1ccnc([C@@H]2CC[N@H+](Cc3nccs3)C2)n1	ZINC000205695150	538836142	/nfs/dbraw/zinc/83/61/42/538836142.db2.gz	XNMWBGXIWDPOCF-LLVKDONJSA-N	1	1	260.366	2.231	40	0		CEABMO
Cc1ccnc([C@@H]2CC[N@@H+](Cc3nccs3)C2)n1	ZINC000205695150	538836146	/nfs/dbraw/zinc/83/61/46/538836146.db2.gz	XNMWBGXIWDPOCF-LLVKDONJSA-N	1	1	260.366	2.231	40	0		CEABMO
c1ccc(O[C@H]2CC[C@H]3[C@H]2OCC[N@@H+]3C2CCC2)nc1	ZINC000097953767	230388502	/nfs/dbraw/zinc/38/85/02/230388502.db2.gz	DUFATYHRRWZFKL-OFQRWUPVSA-N	1	1	274.364	2.245	40	0		CEABMO
CCOC[C@]12CCCO[C@@H]1CC[N@H+](Cc1cc(C)on1)C2	ZINC000096039431	185069688	/nfs/dbraw/zinc/06/96/88/185069688.db2.gz	PESAIUXESGOVHU-HZPDHXFCSA-N	1	1	294.395	2.391	40	0		CEABMO
CCOC[C@]12CCCO[C@@H]1CC[N@@H+](Cc1cc(C)on1)C2	ZINC000096039431	185069690	/nfs/dbraw/zinc/06/96/90/185069690.db2.gz	PESAIUXESGOVHU-HZPDHXFCSA-N	1	1	294.395	2.391	40	0		CEABMO
CCO[C@@H]1CC[C@H]2[C@H]1OCC[N@@H+]2Cc1ccc(OC)cc1	ZINC000096041438	185070498	/nfs/dbraw/zinc/07/04/98/185070498.db2.gz	AKZIEAIERRRGCE-GVDBMIGSSA-N	1	1	291.391	2.464	40	0		CEABMO
CCO[C@@H]1CC[C@H]2[C@H]1OCC[N@H+]2Cc1ccc(OC)cc1	ZINC000096041438	185070499	/nfs/dbraw/zinc/07/04/99/185070499.db2.gz	AKZIEAIERRRGCE-GVDBMIGSSA-N	1	1	291.391	2.464	40	0		CEABMO
CN1C(=O)CCC[C@]12CCC[N@@H+](Cc1ccoc1)C2	ZINC000096049952	185073917	/nfs/dbraw/zinc/07/39/17/185073917.db2.gz	OCESUUAMAUJNIC-OAHLLOKOSA-N	1	1	262.353	2.257	40	0		CEABMO
CC[C@@H]1[N@@H+](CC2CC2)CCC[C@]12CCC(=O)N2C	ZINC000096052432	185074815	/nfs/dbraw/zinc/07/48/15/185074815.db2.gz	XOXFDYCQDPLBQY-ZFWWWQNUSA-N	1	1	250.386	2.262	40	0		CEABMO
c1ccc(OC[C@@H]2C[C@H]3OCC[N@@H+](CC4CC4)[C@H]3C2)nc1	ZINC000096055495	185076837	/nfs/dbraw/zinc/07/68/37/185076837.db2.gz	NMVZUPDNUAFYQR-HRCADAONSA-N	1	1	288.391	2.350	40	0		CEABMO
CCOC[C@@]12CCCO[C@@H]1CC[N@@H+](Cc1cccnc1)C2	ZINC000096056807	185077991	/nfs/dbraw/zinc/07/79/91/185077991.db2.gz	QGEMVTUHWNOLFE-SJORKVTESA-N	1	1	290.407	2.489	40	0		CEABMO
COc1ncccc1C[N@H+]1CCC[C@]2(C[C@H](C)CO2)C1	ZINC000096073321	185088080	/nfs/dbraw/zinc/08/80/80/185088080.db2.gz	PZNARHRGJCPOAI-BBRMVZONSA-N	1	1	276.380	2.481	40	0		CEABMO
CO[C@@H]1CO[C@]2(CC[N@@H+](Cc3ccccc3F)C2)C1	ZINC000096072177	185088100	/nfs/dbraw/zinc/08/81/00/185088100.db2.gz	CRADNAIOGBRIIJ-DZGCQCFKSA-N	1	1	265.328	2.206	40	0		CEABMO
c1coc(C[N@@H+]2C[C@@H]3COC[C@]3(COCC3CC3)C2)c1	ZINC000096108712	185099577	/nfs/dbraw/zinc/09/95/77/185099577.db2.gz	KOELHJANHOXOHI-GDBMZVCRSA-N	1	1	277.364	2.155	40	0		CEABMO
CC[NH+]1CCN(c2c(N)cc(C)cc2Cl)CC1	ZINC000045886072	362169350	/nfs/dbraw/zinc/16/93/50/362169350.db2.gz	PKRWNLYTRIAXAE-UHFFFAOYSA-N	1	1	253.777	2.373	40	0		CEABMO
CCNc1nc(N2Cc3ccccc3C[C@H]2C)cc[nH+]1	ZINC000329020792	136377567	/nfs/dbraw/zinc/37/75/67/136377567.db2.gz	OCODZIPWDISZDY-GFCCVEGCSA-N	1	1	268.364	2.282	40	0		CEABMO
CCC[N@H+](Cc1cccc(F)c1)[C@@H]1CCS(=O)(=O)C1	ZINC000071014303	343799030	/nfs/dbraw/zinc/79/90/30/343799030.db2.gz	TYWWADKSUZYLMC-CQSZACIVSA-N	1	1	285.384	2.225	40	0		CEABMO
CCC[N@@H+](Cc1cccc(F)c1)[C@@H]1CCS(=O)(=O)C1	ZINC000071014303	343799033	/nfs/dbraw/zinc/79/90/33/343799033.db2.gz	TYWWADKSUZYLMC-CQSZACIVSA-N	1	1	285.384	2.225	40	0		CEABMO
CCOC(=O)c1ccccc1Nc1cc(C)[nH+]c(N)n1	ZINC000049468260	362366024	/nfs/dbraw/zinc/36/60/24/362366024.db2.gz	ZKXYJCHXPBDSGD-UHFFFAOYSA-N	1	1	272.308	2.288	40	0		CEABMO
Cc1nnc2n1[C@H]1C[N@H+](Cc3cccc(F)c3)C[C@H]1CC2	ZINC000019288362	282365748	/nfs/dbraw/zinc/36/57/48/282365748.db2.gz	GMLMMRFTSGQNJI-HIFRSBDPSA-N	1	1	286.354	2.345	40	0		CEABMO
Cc1noc(C)c1C(=O)N1CCC[C@]2(CCC[N@@H+]2C)CC1	ZINC000585110397	345005987	/nfs/dbraw/zinc/00/59/87/345005987.db2.gz	PDXIHOOKFIOWRW-MRXNPFEDSA-N	1	1	291.395	2.382	40	0		CEABMO
Cc1ccc(C[N@H+]2C[C@@H]3[C@H](CC(=O)NC(C)C)[C@@H]3C2)o1	ZINC000107745863	186189125	/nfs/dbraw/zinc/18/91/25/186189125.db2.gz	FUMGOZUSSWVVSF-QDMKHBRRSA-N	1	1	276.380	2.181	40	0		CEABMO
Cn1c[nH+]c(-c2cccc(Br)c2)c1N	ZINC000100761160	282765937	/nfs/dbraw/zinc/76/59/37/282765937.db2.gz	GWJDMMHXKYROJU-UHFFFAOYSA-N	1	1	252.115	2.432	40	0		CEABMO
CNc1cccc([C@H]2CCC[N@H+]2C2CCOCC2)n1	ZINC000072364351	363130793	/nfs/dbraw/zinc/13/07/93/363130793.db2.gz	HCJXIIZDKDOSPO-CQSZACIVSA-N	1	1	261.369	2.439	40	0		CEABMO
CCOC(=O)c1ccccc1NC(=O)[C@H]1CCC[N@@H+](C)C1	ZINC000073381388	363214619	/nfs/dbraw/zinc/21/46/19/363214619.db2.gz	RZDPTCZYEIQELI-LBPRGKRZSA-N	1	1	290.363	2.144	40	0		CEABMO
CC(C)[C@@H](c1nnnn1C[C@@H]1CCCO1)[NH+]1CCCCC1	ZINC000000883954	361194548	/nfs/dbraw/zinc/19/45/48/361194548.db2.gz	UPCNQTQSEZLSPX-KBPBESRZSA-N	1	1	293.415	2.035	40	0		CEABMO
CC(=O)O[C@H]1CC[N@H+](Cc2ccco2)[C@H](C)[C@@H]1C	ZINC000001080750	361198858	/nfs/dbraw/zinc/19/88/58/361198858.db2.gz	HAVUOHMCCLLASZ-WDMOLILDSA-N	1	1	251.326	2.442	40	0		CEABMO
Cc1nn(C)cc1C[NH2+]Cc1cc(F)ccc1F	ZINC000012395500	361382555	/nfs/dbraw/zinc/38/25/55/361382555.db2.gz	UVUWSHZNMDQPBA-UHFFFAOYSA-N	1	1	251.280	2.297	40	0		CEABMO
Cn1cnc2ccc(NC(=O)C[C@@H]3CCCC[N@H+]3C)cc21	ZINC000019655675	361547144	/nfs/dbraw/zinc/54/71/44/361547144.db2.gz	BCYSBVBWIULBDZ-ZDUSSCGKSA-N	1	1	286.379	2.386	40	0		CEABMO
C[C@@H]([NH+]1CCOCC1)[C@@](O)(c1ccccc1)c1ccccn1	ZINC000031769257	361718919	/nfs/dbraw/zinc/71/89/19/361718919.db2.gz	RCUZQOAGXSJBDW-CRAIPNDOSA-N	1	1	298.386	2.038	40	0	in-vitro	CEABMO
COC[C@H]1Cn2nccc2C[N@H+](Cc2cccc(F)c2)C1	ZINC000096188915	364406898	/nfs/dbraw/zinc/40/68/98/364406898.db2.gz	CCLPLEFHZONVAB-CQSZACIVSA-N	1	1	289.354	2.301	40	0		CEABMO
COC[C@H]1Cn2nccc2C[N@@H+](Cc2cccc(F)c2)C1	ZINC000096188915	364406904	/nfs/dbraw/zinc/40/69/04/364406904.db2.gz	CCLPLEFHZONVAB-CQSZACIVSA-N	1	1	289.354	2.301	40	0		CEABMO
Cc1ccc2c(n1)N(CC1CC1)CC[N@H+]([C@@H]1CCOC1)C2	ZINC000096199080	364409154	/nfs/dbraw/zinc/40/91/54/364409154.db2.gz	XLMDXNIQMYPJRK-MRXNPFEDSA-N	1	1	287.407	2.211	40	0		CEABMO
Cc1ccc2c(n1)N(CC1CC1)CC[N@@H+]([C@@H]1CCOC1)C2	ZINC000096199080	364409157	/nfs/dbraw/zinc/40/91/57/364409157.db2.gz	XLMDXNIQMYPJRK-MRXNPFEDSA-N	1	1	287.407	2.211	40	0		CEABMO
c1coc(CN2CC3(C2)CC[N@@H+](Cc2cccnc2)C3)c1	ZINC000096202506	364411545	/nfs/dbraw/zinc/41/15/45/364411545.db2.gz	JGBXYLPGBQJCEK-UHFFFAOYSA-N	1	1	283.375	2.383	40	0		CEABMO
CCC[N@H+]1CC[C@@]2(C1)CCCN(c1ccc(C)nn1)C2	ZINC000096217089	364411980	/nfs/dbraw/zinc/41/19/80/364411980.db2.gz	USTDXZPJMGVJAQ-MRXNPFEDSA-N	1	1	274.412	2.487	40	0		CEABMO
C[N@H+]1CCCC[C@]12CCCN(C(=O)c1ccccn1)C2	ZINC000096217580	364413425	/nfs/dbraw/zinc/41/34/25/364413425.db2.gz	GZCSOBHEVYZEIE-MRXNPFEDSA-N	1	1	273.380	2.172	40	0		CEABMO
Cc1nc(C[NH+]2CCC3(C[C@H]3C(=O)N(C)C)CC2)cs1	ZINC000096227795	364414833	/nfs/dbraw/zinc/41/48/33/364414833.db2.gz	IMMIYJRULZAUMU-ZDUSSCGKSA-N	1	1	293.436	2.142	40	0		CEABMO
O[C@H](COc1ccccc1)C[N@H+]1CC[C@H]2C=CC=C[C@@H]2C1	ZINC000103529751	364663899	/nfs/dbraw/zinc/66/38/99/364663899.db2.gz	HSIIBDBKJDPQQR-ZACQAIPSSA-N	1	1	285.387	2.490	40	0		CEABMO
C[C@@H]1c2ncc(CCOCc3ccncc3)n2CC[N@@H+]1C	ZINC000585097774	367178124	/nfs/dbraw/zinc/17/81/24/367178124.db2.gz	OLDHWSARQUNESW-CYBMUJFWSA-N	1	1	286.379	2.044	40	0		CEABMO
CCOC[C@@H]1CC[N@@H+](C)C2(CN(Cc3ccco3)C2)C1	ZINC000585103115	367178654	/nfs/dbraw/zinc/17/86/54/367178654.db2.gz	QNPDRIOKRMWICX-CQSZACIVSA-N	1	1	278.396	2.212	40	0		CEABMO
COCCNC(=O)c1cc(N)ccc1[NH+]1CCCCCC1	ZINC000225486243	370298177	/nfs/dbraw/zinc/29/81/77/370298177.db2.gz	NHNKQJPDLYEWMW-UHFFFAOYSA-N	1	1	291.395	2.025	40	0		CEABMO
CO[C@@H]1CSC2(C[NH+](Cc3ccc4c(c3)OCO4)C2)C1	ZINC000247901020	371145011	/nfs/dbraw/zinc/14/50/11/371145011.db2.gz	VWNPHXCWXWOUCB-LBPRGKRZSA-N	1	1	293.388	2.122	40	0		CEABMO
COC[C@@H]1CC[N@@H+](C)C2(CN(Cc3ccccc3F)C2)C1	ZINC000248155564	371165689	/nfs/dbraw/zinc/16/56/89/371165689.db2.gz	VPHZRGLTQKMQEK-CQSZACIVSA-N	1	1	292.398	2.368	40	0		CEABMO
C[N@H+]1C[C@@H]2CN(Cc3ccc(F)cc3)CCN2C(C)(C)C1	ZINC000253409242	371516734	/nfs/dbraw/zinc/51/67/34/371516734.db2.gz	ZVAQHYWVVSQAJL-MRXNPFEDSA-N	1	1	291.414	2.036	40	0	biogenic,in-vitro	CEABMO
CCCn1cc(C[NH2+]Cc2ccnn2CCC)cn1	ZINC000256053391	190005108	/nfs/dbraw/zinc/00/51/08/190005108.db2.gz	RGFBDYLNFYGQRT-UHFFFAOYSA-N	1	1	261.373	2.189	40	0		CEABMO
CCCn1nc(C)cc1C[NH2+]CCN(CC)CC	ZINC000256052697	190004142	/nfs/dbraw/zinc/00/41/42/190004142.db2.gz	OIBMDIPFTBSXPJ-UHFFFAOYSA-N	1	1	252.406	2.033	40	0		CEABMO
c1cc([C@@H]2CCC[N@H+](CC3CCOCC3)C2)ncn1	ZINC000257211349	190011915	/nfs/dbraw/zinc/01/19/15/190011915.db2.gz	BYNVBAGQDWKFSX-CQSZACIVSA-N	1	1	261.369	2.083	40	0		CEABMO
COCC[N@@H+]1C[C@@H]2[C@@H](Cc3cccnc3)CC[C@@H]2C1	ZINC000257219907	190013771	/nfs/dbraw/zinc/01/37/71/190013771.db2.gz	DITNBGWQGFBYRM-BZUAXINKSA-N	1	1	260.381	2.229	40	0		CEABMO
CCc1nnc(Nc2cc(C)nc([C@H]3CC[NH2+]C3)n2)s1	ZINC000257252837	190020586	/nfs/dbraw/zinc/02/05/86/190020586.db2.gz	JWGZZWMUUBZGME-VIFPVBQESA-N	1	1	290.396	2.019	40	0		CEABMO
O[C@H]1C[N@H+](Cc2cc(F)cc(F)c2)CC[C@@]12CCCO2	ZINC000257242844	190018753	/nfs/dbraw/zinc/01/87/53/190018753.db2.gz	IEKZWJZHOHRIGX-GJZGRUSLSA-N	1	1	283.318	2.081	40	0		CEABMO
O[C@H]1C[N@@H+](Cc2cc(F)cc(F)c2)CC[C@@]12CCCO2	ZINC000257242844	190018754	/nfs/dbraw/zinc/01/87/54/190018754.db2.gz	IEKZWJZHOHRIGX-GJZGRUSLSA-N	1	1	283.318	2.081	40	0		CEABMO
CCn1nccc1-c1cncc([C@H]2CCC[N@@H+](C)C2)n1	ZINC000257262923	190022008	/nfs/dbraw/zinc/02/20/08/190022008.db2.gz	LNQOMPKHBKSNLT-LBPRGKRZSA-N	1	1	271.368	2.169	40	0		CEABMO
CC(C)[N@H+]1CCC[C@H](c2cncc(-c3cnn(C)c3)n2)C1	ZINC000257277983	190025842	/nfs/dbraw/zinc/02/58/42/190025842.db2.gz	OAGLMZYWOKFKPP-ZDUSSCGKSA-N	1	1	285.395	2.465	40	0		CEABMO
CC(C)[N@H+]1CCC[C@H]1c1cncc(-c2cc[nH]n2)n1	ZINC000257283228	190026301	/nfs/dbraw/zinc/02/63/01/190026301.db2.gz	OXIPUSVYXFTSKQ-AWEZNQCLSA-N	1	1	257.341	2.412	40	0		CEABMO
Cc1cc(N(C)C)cc([C@H]2CC[N@@H+](C3CCOCC3)C2)n1	ZINC000257286876	190027102	/nfs/dbraw/zinc/02/71/02/190027102.db2.gz	PNKXYOVGDRLZPD-AWEZNQCLSA-N	1	1	289.423	2.424	40	0		CEABMO
Cc1cc(N(C)C)cc([C@H]2CC[N@H+](C3CCOCC3)C2)n1	ZINC000257286876	190027103	/nfs/dbraw/zinc/02/71/03/190027103.db2.gz	PNKXYOVGDRLZPD-AWEZNQCLSA-N	1	1	289.423	2.424	40	0		CEABMO
CC(C)C[N@H+]1CC[C@H](Cc2cncc(-c3nccn3C)n2)C1	ZINC000257275662	190024607	/nfs/dbraw/zinc/02/46/07/190024607.db2.gz	NQHUAVDCOMMHBE-CQSZACIVSA-N	1	1	299.422	2.398	40	0		CEABMO
CNc1cc([C@@H]2CCC[N@@H+](Cc3cnc[nH]3)C2)ccn1	ZINC000257306600	190031433	/nfs/dbraw/zinc/03/14/33/190031433.db2.gz	SUZQPSZYLGEKGB-CYBMUJFWSA-N	1	1	271.368	2.226	40	0		CEABMO
CNc1cc([C@@H]2CCC[N@H+](Cc3c[nH]cn3)C2)ccn1	ZINC000257306600	190031434	/nfs/dbraw/zinc/03/14/34/190031434.db2.gz	SUZQPSZYLGEKGB-CYBMUJFWSA-N	1	1	271.368	2.226	40	0		CEABMO
CNc1cc([C@@H]2CCC[N@@H+](Cc3c[nH]cn3)C2)ccn1	ZINC000257306600	190031435	/nfs/dbraw/zinc/03/14/35/190031435.db2.gz	SUZQPSZYLGEKGB-CYBMUJFWSA-N	1	1	271.368	2.226	40	0		CEABMO
C[N@H+]1CCC[C@@H](c2cncc(-c3cccc(C(N)=O)c3)n2)C1	ZINC000257307188	190031173	/nfs/dbraw/zinc/03/11/73/190031173.db2.gz	SXOIDNAWVLXMKJ-CQSZACIVSA-N	1	1	296.374	2.052	40	0		CEABMO
COc1ccc(C[C@@H]2C[N@H+](C3CCOCC3)CCO2)cc1	ZINC000257311310	190031951	/nfs/dbraw/zinc/03/19/51/190031951.db2.gz	UIVXUIDZOJVULO-QGZVFWFLSA-N	1	1	291.391	2.118	40	0		CEABMO
CC(C)[N@H+]1CCC[C@H](c2cncc(-c3ncc[nH]3)n2)C1	ZINC000257335821	190036358	/nfs/dbraw/zinc/03/63/58/190036358.db2.gz	YMAMGRZGKSKAKW-LBPRGKRZSA-N	1	1	271.368	2.455	40	0		CEABMO
Cc1noc(C[C@]23COC[C@H]2C[N@@H+](CC2CCCC2)C3)n1	ZINC000096217734	256825964	/nfs/dbraw/zinc/82/59/64/256825964.db2.gz	FGJSBKCWTGCAMR-ZBFHGGJFSA-N	1	1	291.395	2.059	40	0		CEABMO
COc1ccc([C@@H]2[C@H]([NH3+])C(=O)N2c2ccc(C)cc2)cc1	ZINC000039189384	394499310	/nfs/dbraw/zinc/49/93/10/394499310.db2.gz	HKRXNPCMTVJDJM-JKSUJKDBSA-N	1	1	282.343	2.419	40	0		CEABMO
CC(C)[NH+]1CC2(C1)C[C@@H](CCOc1cnccn1)CCO2	ZINC000248171980	394537836	/nfs/dbraw/zinc/53/78/36/394537836.db2.gz	SNGONGPVVKYGGZ-AWEZNQCLSA-N	1	1	291.395	2.135	40	0		CEABMO
CC(C)[N@H+]1CCC[C@@H]1c1cnc(-c2cc[nH]n2)cn1	ZINC000257234371	394595537	/nfs/dbraw/zinc/59/55/37/394595537.db2.gz	GTFQWLQYKSORQY-CQSZACIVSA-N	1	1	257.341	2.412	40	0		CEABMO
COc1cccc([C@@H]2[C@H]([NH3+])C(=O)N2c2cccc(F)c2)c1	ZINC000072227626	394596579	/nfs/dbraw/zinc/59/65/79/394596579.db2.gz	JCCNXIYOKNTTFY-LSDHHAIUSA-N	1	1	286.306	2.250	40	0		CEABMO
C[N@H+]1CCC[C@@H](CNC(=S)Nc2ccc(F)cc2)C1	ZINC000009876298	170388533	/nfs/dbraw/zinc/38/85/33/170388533.db2.gz	DCZCCACBTACIPT-NSHDSACASA-N	1	1	281.400	2.454	40	0		CEABMO
O[C@H]1CC[N@@H+](Cc2ccc(Br)s2)C1	ZINC000038539038	174145478	/nfs/dbraw/zinc/14/54/78/174145478.db2.gz	ATXQCLBGTIMYCV-ZETCQYMHSA-N	1	1	262.172	2.077	40	0		CEABMO
O[C@H]1CC[N@H+](Cc2ccc(Br)s2)C1	ZINC000038539038	174145476	/nfs/dbraw/zinc/14/54/76/174145476.db2.gz	ATXQCLBGTIMYCV-ZETCQYMHSA-N	1	1	262.172	2.077	40	0		CEABMO
O[C@H]1CC[N@H+](Cc2cccc(Br)c2)C1	ZINC000038538841	174145492	/nfs/dbraw/zinc/14/54/92/174145492.db2.gz	KUHNXHDKPBPCBD-NSHDSACASA-N	1	1	256.143	2.016	40	0		CEABMO
O[C@H]1CC[N@@H+](Cc2cccc(Br)c2)C1	ZINC000038538841	174145493	/nfs/dbraw/zinc/14/54/93/174145493.db2.gz	KUHNXHDKPBPCBD-NSHDSACASA-N	1	1	256.143	2.016	40	0		CEABMO
Cc1cccc(-c2ccccc2C[C@H]2[NH2+]CCNC2=O)c1	ZINC000072352863	176374500	/nfs/dbraw/zinc/37/45/00/176374500.db2.gz	ZTMHAUGWEIGCCD-QGZVFWFLSA-N	1	1	280.371	2.293	40	0		CEABMO
Cc1cccc([C@H]2CCC[N@H+](Cc3ncc[nH]3)C2)n1	ZINC000072356618	176375814	/nfs/dbraw/zinc/37/58/14/176375814.db2.gz	PVEWKQFGNKUUAN-ZDUSSCGKSA-N	1	1	256.353	2.493	40	0		CEABMO
Cc1cccc([C@H]2CCC[N@@H+](Cc3ncc[nH]3)C2)n1	ZINC000072356618	176375815	/nfs/dbraw/zinc/37/58/15/176375815.db2.gz	PVEWKQFGNKUUAN-ZDUSSCGKSA-N	1	1	256.353	2.493	40	0		CEABMO
CNc1cccc([C@H]2CCC[N@@H+](Cc3cnn(C)c3)C2)n1	ZINC000072364261	176379060	/nfs/dbraw/zinc/37/90/60/176379060.db2.gz	QIYLVHNOCCOPRD-AWEZNQCLSA-N	1	1	285.395	2.236	40	0		CEABMO
Cc1ccsc1C[N@H+]1CCc2c(nc(C)[nH]c2=O)C1	ZINC000072373673	176385313	/nfs/dbraw/zinc/38/53/13/176385313.db2.gz	HBPREOSLYLVJHD-UHFFFAOYSA-N	1	1	275.377	2.419	40	0		CEABMO
Cc1cncc([C@H]2CCC[N@H+](C3CCOCC3)C2)n1	ZINC000072385941	176391274	/nfs/dbraw/zinc/39/12/74/176391274.db2.gz	IXRXFQLOFAIQGV-ZDUSSCGKSA-N	1	1	261.369	2.143	40	0		CEABMO
CNc1ncccc1C[N@H+]1CC[C@H](c2n[nH]cc2C)C1	ZINC000072386199	176391573	/nfs/dbraw/zinc/39/15/73/176391573.db2.gz	MIUCRBHEBFJAMB-LBPRGKRZSA-N	1	1	271.368	2.144	40	0		CEABMO
C[C@@H](CO)Nc1nc(N2Cc3ccccc3C[C@@H]2C)cc[nH+]1	ZINC000329066648	278291013	/nfs/dbraw/zinc/29/10/13/278291013.db2.gz	YDCZIBDFVHDHBB-STQMWFEESA-N	1	1	298.390	2.221	40	0		CEABMO
O=C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc2c(c1)OCO2	ZINC000061675084	527035191	/nfs/dbraw/zinc/03/51/91/527035191.db2.gz	VAZCAZWEXNXLAP-TXEJJXNPSA-N	1	1	259.305	2.111	40	0		CEABMO
CC(C)[N@@H+](C1CCCCC1)[C@H]1CNCC[C@@]1(C)O	ZINC000685936218	567104957	/nfs/dbraw/zinc/10/49/57/567104957.db2.gz	KQGQPKSUPVGZKW-LSDHHAIUSA-N	1	1	254.418	2.142	40	0		CEABMO
COC[C@]12CCCO[C@@H]1CC[N@@H+](Cc1ccoc1)C2	ZINC000096038971	185069394	/nfs/dbraw/zinc/06/93/94/185069394.db2.gz	RPAIPOFUMNRCFZ-HUUCEWRRSA-N	1	1	265.353	2.297	40	0		CEABMO
c1cc(CO[C@@H]2CC[C@H]3[C@H]2OCC[N@H+]3C2CCC2)ccn1	ZINC000096041805	185070246	/nfs/dbraw/zinc/07/02/46/185070246.db2.gz	RTKOZBZAMRUDDN-GVDBMIGSSA-N	1	1	288.391	2.383	40	0		CEABMO
O=C(c1cccnc1)N1CCC[C@@]2(CC[N@@H+](CC3CC3)C2)C1	ZINC000096047062	185072352	/nfs/dbraw/zinc/07/23/52/185072352.db2.gz	NXJFTFCNSBHZHN-SFHVURJKSA-N	1	1	299.418	2.420	40	0		CEABMO
CCN1C(=O)CC[C@]12CCC[N@@H+](CC1CC1)CC2	ZINC000096047509	185073136	/nfs/dbraw/zinc/07/31/36/185073136.db2.gz	XSKIZTLWHDLUKM-HNNXBMFYSA-N	1	1	250.386	2.263	40	0		CEABMO
O=C1[C@H]2C[N@@H+](Cc3cccnc3)C[C@H]2CN1c1ccsc1	ZINC000096053688	185074950	/nfs/dbraw/zinc/07/49/50/185074950.db2.gz	FGZLFJWCIIIVQQ-ZFWWWQNUSA-N	1	1	299.399	2.238	40	0		CEABMO
O[C@@H]1CC[N@@H+](Cc2nccs2)[C@H]1Cc1ccccc1	ZINC000096061557	185082783	/nfs/dbraw/zinc/08/27/83/185082783.db2.gz	OWFIDTXUAKETSG-UONOGXRCSA-N	1	1	274.389	2.321	40	0		CEABMO
CCN1C(=O)CC[C@]12CCC[N@@H+](Cc1ccncc1)CC2	ZINC000096071917	185087335	/nfs/dbraw/zinc/08/73/35/185087335.db2.gz	BCPMJYLFIDKZIJ-KRWDZBQOSA-N	1	1	287.407	2.449	40	0		CEABMO
Oc1ccc(-c2nc3ccc(N4CC[NH2+]CC4)cc3[nH]2)cc1	ZINC000045206854	362160310	/nfs/dbraw/zinc/16/03/10/362160310.db2.gz	ZSDZPOMFIUCIJA-UHFFFAOYSA-N	1	1	294.358	2.345	40	0		CEABMO
Cc1nc(NCCO)cc(N2Cc3ccccc3C[C@H]2C)[nH+]1	ZINC000329042608	136377694	/nfs/dbraw/zinc/37/76/94/136377694.db2.gz	SOYBEKZQZPRYHW-GFCCVEGCSA-N	1	1	298.390	2.140	40	0		CEABMO
Cc1ccccc1C[C@H]1CC[N@@H+](Cc2cncnc2)C[C@H]1O	ZINC000585277027	345009972	/nfs/dbraw/zinc/00/99/72/345009972.db2.gz	FIUCUMDNSFLUJB-QZTJIDSGSA-N	1	1	297.402	2.211	40	0		CEABMO
O=C(C[C@H]1[C@H]2C[N@H+](Cc3cccs3)C[C@@H]12)N1CCCC1	ZINC000107253896	186165035	/nfs/dbraw/zinc/16/50/35/186165035.db2.gz	CZPSIJDSXIWIQO-QDMKHBRRSA-N	1	1	290.432	2.438	40	0		CEABMO
O=C1NCC[C@@]12CCC[N@@H+](Cc1cccs1)CC2	ZINC000108530425	186222444	/nfs/dbraw/zinc/22/24/44/186222444.db2.gz	CRCXRIMXKQWMDM-CQSZACIVSA-N	1	1	264.394	2.240	40	0		CEABMO
CC(C)[N@@H+](Cc1ccccc1)C1CCN(CCO)CC1	ZINC000079414296	363597501	/nfs/dbraw/zinc/59/75/01/363597501.db2.gz	QSZNNUKCOVZFMJ-UHFFFAOYSA-N	1	1	276.424	2.354	40	0		CEABMO
COC(=O)[C@H]1C[N@@H+](C)C[C@H]1c1ccccc1Cl	ZINC000242728144	540424204	/nfs/dbraw/zinc/42/42/04/540424204.db2.gz	YVCKOEIZBOKVIO-QWRGUYRKSA-N	1	1	253.729	2.158	40	0		CEABMO
COC(=O)[C@]12CCC[C@@H]1C[N@@H+](Cc1ccccc1)C2	ZINC000004203345	361305598	/nfs/dbraw/zinc/30/55/98/361305598.db2.gz	DFKYQTUJTMSPII-ZBFHGGJFSA-N	1	1	259.349	2.462	40	0		CEABMO
C[C@H](NO)[C@H](c1ccc2c(c1)OCO2)[NH+]1CCCCC1	ZINC000006763482	299325758	/nfs/dbraw/zinc/32/57/58/299325758.db2.gz	SJOLSPFJDYHXJK-XHDPSFHLSA-N	1	1	278.352	2.310	40	0		CEABMO
C[N@H+]1CCC[C@H](C(=O)Nc2ccc(F)cc2F)C1	ZINC000082336773	363768053	/nfs/dbraw/zinc/76/80/53/363768053.db2.gz	FVASUJIRQBSLBJ-VIFPVBQESA-N	1	1	254.280	2.245	40	0		CEABMO
CCn1cc(C[N@H+]2CCC[C@H](c3cnccn3)C2)cn1	ZINC000012252730	361375826	/nfs/dbraw/zinc/37/58/26/361375826.db2.gz	HVVXFSAWJWYWQD-AWEZNQCLSA-N	1	1	271.368	2.073	40	0		CEABMO
OCCC[N@@H+](Cc1ccncc1)Cc1cccc(O)c1	ZINC000013568164	361432524	/nfs/dbraw/zinc/43/25/24/361432524.db2.gz	JARKLRWKVSMUJQ-UHFFFAOYSA-N	1	1	272.348	2.172	40	0		CEABMO
COc1ccc(CN2C[C@H]3CCC[N@H+]3C[C@H]2C)cc1	ZINC000019575114	361543939	/nfs/dbraw/zinc/54/39/39/361543939.db2.gz	YIBMDJHUYQYHFA-UKRRQHHQSA-N	1	1	260.381	2.364	40	0		CEABMO
Cc1cccc(OC[C@@H](O)C[NH+]2C[C@@H](C)O[C@H](C)C2)c1C	ZINC000023643343	361602342	/nfs/dbraw/zinc/60/23/42/361602342.db2.gz	FNFXKRIGICWPOJ-FMKPAKJESA-N	1	1	293.407	2.152	40	0		CEABMO
Cc1ccc(-c2csc(N3CC[NH+](C)CC3)n2)cc1N	ZINC000095097233	364340241	/nfs/dbraw/zinc/34/02/41/364340241.db2.gz	CPNZEVMVLJHSPV-UHFFFAOYSA-N	1	1	288.420	2.453	40	0		CEABMO
CC(C)CC[N@@H+]1C[C@H]2CN(Cc3ccccn3)C[C@H]2C1	ZINC000096161610	364404092	/nfs/dbraw/zinc/40/40/92/364404092.db2.gz	XYHDXTJMCRZPQX-IYBDPMFKSA-N	1	1	273.424	2.491	40	0		CEABMO
CN(C)Cc1cnc2n1CC[N@H+](Cc1cccs1)CC2	ZINC000096196773	364409372	/nfs/dbraw/zinc/40/93/72/364409372.db2.gz	MWRXMUIJGXHPDQ-UHFFFAOYSA-N	1	1	290.436	2.065	40	0		CEABMO
CC[N@H+]1CCC[C@]12CCCN(C(=O)c1ccccn1)C2	ZINC000096203217	364410305	/nfs/dbraw/zinc/41/03/05/364410305.db2.gz	NKBCFHWJSMBBIW-INIZCTEOSA-N	1	1	273.380	2.172	40	0		CEABMO
c1cc(CN2CC[C@]3(C2)C[C@@H]([NH+]2CCCC2)CCO3)co1	ZINC000096206871	364410675	/nfs/dbraw/zinc/41/06/75/364410675.db2.gz	KWJPSRYSNHYJOB-DLBZAZTESA-N	1	1	290.407	2.499	40	0		CEABMO
CC(C)[N@H+]1CC[C@]2(C1)C[C@H](NC(=O)c1ccco1)CCO2	ZINC000096206486	364411455	/nfs/dbraw/zinc/41/14/55/364411455.db2.gz	IYMLNYOSEXBSDT-CZUORRHYSA-N	1	1	292.379	2.041	40	0		CEABMO
c1cncc(C[N@@H+]2CC[C@@H](OCC3CC3)[C@H]3OCC[C@@H]32)c1	ZINC000096220194	364414347	/nfs/dbraw/zinc/41/43/47/364414347.db2.gz	HSVGQOQFWXTMKL-BBWFWOEESA-N	1	1	288.391	2.240	40	0		CEABMO
Cc1cccc(C[N@H+]2CC[C@]3(C2)c2ccccc2NC3=O)n1	ZINC000096244786	364416922	/nfs/dbraw/zinc/41/69/22/364416922.db2.gz	HJPPPKVWQCLCGQ-SFHVURJKSA-N	1	1	293.370	2.486	40	0		CEABMO
C[C@H](c1ccccc1)[N@H+]1CCC[C@@]2(CN(C)C2=O)C1	ZINC000585099437	367177332	/nfs/dbraw/zinc/17/73/32/367177332.db2.gz	JIYHEDORYCDKBB-CZUORRHYSA-N	1	1	258.365	2.302	40	0		CEABMO
C[NH+](C)[C@H](C(=O)NCCOc1ccccc1)c1ccccc1	ZINC000195286548	370122167	/nfs/dbraw/zinc/12/21/67/370122167.db2.gz	GXYHVUPZGMRDAP-KRWDZBQOSA-N	1	1	298.386	2.485	40	0		CEABMO
CNC(=O)[C@H]1CCC[C@@]12CC[N@@H+](Cc1ccsc1)C2	ZINC000247957421	371150088	/nfs/dbraw/zinc/15/00/88/371150088.db2.gz	PCOOAHQOSIDBAW-HIFRSBDPSA-N	1	1	278.421	2.486	40	0		CEABMO
O[C@H](COc1ccccc1)C[N@H+]1CC[C@H]2C=CC=C[C@H]2C1	ZINC000252444349	371438194	/nfs/dbraw/zinc/43/81/94/371438194.db2.gz	HSIIBDBKJDPQQR-IKGGRYGDSA-N	1	1	285.387	2.490	40	0		CEABMO
CN1C[C@@H]2C[N@H+](Cc3ccccc3)[C@@H](C3CC3)[C@H]2C1	ZINC000409427699	375523941	/nfs/dbraw/zinc/52/39/41/375523941.db2.gz	BUHGYPQOLLDKKM-IKGGRYGDSA-N	1	1	256.393	2.459	40	0		CEABMO
CN1C[C@@H]2C[N@@H+](Cc3ccccc3)[C@@H](C3CC3)[C@H]2C1	ZINC000409427699	375523949	/nfs/dbraw/zinc/52/39/49/375523949.db2.gz	BUHGYPQOLLDKKM-IKGGRYGDSA-N	1	1	256.393	2.459	40	0		CEABMO
CCCn1nccc1C[NH2+]Cc1ccnn1CCC	ZINC000256053235	190005072	/nfs/dbraw/zinc/00/50/72/190005072.db2.gz	QPRKICCVTIUKIS-UHFFFAOYSA-N	1	1	261.373	2.189	40	0		CEABMO
Cc1c[nH]c([C@H]2CC[N@H+](Cc3csc(C)n3)C2)n1	ZINC000257203938	190011756	/nfs/dbraw/zinc/01/17/56/190011756.db2.gz	ASGXJLRMKXTGCQ-NSHDSACASA-N	1	1	262.382	2.473	40	0		CEABMO
Cc1cc(N)cc([C@H]2CN(Cc3cscn3)CCO2)[nH+]1	ZINC000257281734	190026376	/nfs/dbraw/zinc/02/63/76/190026376.db2.gz	OQTGVIFSQPWNMX-CQSZACIVSA-N	1	1	290.392	2.002	40	0		CEABMO
C[N@H+]1CCC[C@@H]2N(C(=O)c3cccnc3)CCC[C@@]21C	ZINC000257292950	190027766	/nfs/dbraw/zinc/02/77/66/190027766.db2.gz	QNORVPKLQWLUEO-HOCLYGCPSA-N	1	1	273.380	2.171	40	0		CEABMO
C[N@H+]1C[C@H](c2ccccc2)[C@H]2CN(Cc3cc[nH]n3)CC[C@H]21	ZINC000257310525	190031846	/nfs/dbraw/zinc/03/18/46/190031846.db2.gz	UFKWLUHZHJRLGH-KZNAEPCWSA-N	1	1	296.418	2.329	40	0		CEABMO
Cc1ncc(-c2cc(C)nc([C@@H]3CCC[N@@H+](C)C3)n2)n1C	ZINC000257295683	190028672	/nfs/dbraw/zinc/02/86/72/190028672.db2.gz	QZLCODUGTMTZHK-CYBMUJFWSA-N	1	1	285.395	2.303	40	0		CEABMO
Cc1cn(C)c([C@@H]2CCC[N@@H+](Cc3ccnc(C)n3)C2)n1	ZINC000257342606	190037019	/nfs/dbraw/zinc/03/70/19/190037019.db2.gz	ZPKUHMHWWFJSIU-CQSZACIVSA-N	1	1	285.395	2.207	40	0		CEABMO
COc1ccc([C@H]2[C@@H]([NH3+])C(=O)N2c2ccccc2)cc1OC	ZINC000072227345	256703568	/nfs/dbraw/zinc/70/35/68/256703568.db2.gz	VEIVVGZNCWAKLY-CVEARBPZSA-N	1	1	298.342	2.119	40	0		CEABMO
COc1ccccc1C[N@@H+]1CC[C@H](OC)[C@H]2OCC[C@@H]21	ZINC000096216714	256825968	/nfs/dbraw/zinc/82/59/68/256825968.db2.gz	KBUCCWSCWDLPKW-BPUTZDHNSA-N	1	1	277.364	2.073	40	0		CEABMO
Cc1cc(N(CC(=O)N(C)C)Cc2ccccc2)nc(C)[nH+]1	ZINC000005541399	394457740	/nfs/dbraw/zinc/45/77/40/394457740.db2.gz	JLRKQNRIBFXYPI-UHFFFAOYSA-N	1	1	298.390	2.188	40	0		CEABMO
C[N@H+]1C[C@H](CO)[C@@H](c2cccc(Br)c2)C1	ZINC000225609271	394469465	/nfs/dbraw/zinc/46/94/65/394469465.db2.gz	UOALQWUFZSXGPE-ZYHUDNBSSA-N	1	1	270.170	2.087	40	0		CEABMO
CC[N@@H+]1CCCC[C@H]1c1ccc(N2CCN(C)CC2)nc1	ZINC000072216539	394592878	/nfs/dbraw/zinc/59/28/78/394592878.db2.gz	XKJDOOTVQLVMMU-INIZCTEOSA-N	1	1	288.439	2.380	40	0		CEABMO
CC[N@H+]1CCCC[C@H]1c1ccc(N2CCN(C)CC2)nc1	ZINC000072216539	394592883	/nfs/dbraw/zinc/59/28/83/394592883.db2.gz	XKJDOOTVQLVMMU-INIZCTEOSA-N	1	1	288.439	2.380	40	0		CEABMO
CCSc1ncc(CNC[C@@H]2CCC[N@@H+]2CC)cn1	ZINC000062718364	394571254	/nfs/dbraw/zinc/57/12/54/394571254.db2.gz	WROVRKSWLBYTMX-ZDUSSCGKSA-N	1	1	280.441	2.163	40	0		CEABMO
CCSc1ncc(CNC[C@@H]2CCC[N@H+]2CC)cn1	ZINC000062718364	394571256	/nfs/dbraw/zinc/57/12/56/394571256.db2.gz	WROVRKSWLBYTMX-ZDUSSCGKSA-N	1	1	280.441	2.163	40	0		CEABMO
C[C@H]1CCCC[N@H+]1[C@H]1CC(=O)N(c2ccccc2)C1=O	ZINC000248127800	394537353	/nfs/dbraw/zinc/53/73/53/394537353.db2.gz	XOJZOOPMSCPKHK-JSGCOSHPSA-N	1	1	272.348	2.193	40	0		CEABMO
C[N@H+]1CC[C@@]2(C1)COCc1cnc(-c3ccccc3)nc12	ZINC000096080384	394675885	/nfs/dbraw/zinc/67/58/85/394675885.db2.gz	YLCQPSWLMCIPQB-QGZVFWFLSA-N	1	1	281.359	2.247	40	0		CEABMO
CN(C)C(=O)COC[C@@]12CCC[C@@H]1C[N@H+](C1CCCC1)C2	ZINC000096109180	394677250	/nfs/dbraw/zinc/67/72/50/394677250.db2.gz	OSMRJBHVOPWDHG-PBHICJAKSA-N	1	1	294.439	2.136	40	0		CEABMO
C[NH+]1CCN(NC(=O)Nc2cccc3ccccc32)CC1	ZINC000006638957	170220966	/nfs/dbraw/zinc/22/09/66/170220966.db2.gz	ZEHYWVLWJUSZHP-UHFFFAOYSA-N	1	1	284.363	2.124	40	0		CEABMO
C[N@@H+]1[C@@H]2CC[C@H]1CC(OC(=O)CNC1CCCCC1)C2	ZINC000006703232	170230370	/nfs/dbraw/zinc/23/03/70/170230370.db2.gz	IDCOFRHAGSNQQY-YIONKMFJSA-N	1	1	280.412	2.077	40	0		CEABMO
COC(=O)N[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1C	ZINC000021987929	171345815	/nfs/dbraw/zinc/34/58/15/171345815.db2.gz	PECKJJLXPJQABJ-OCCSQVGLSA-N	1	1	262.353	2.253	40	0		CEABMO
CC(C)(C)OC(=O)N1CC[NH2+][C@@H](c2ccc(O)cc2)C1	ZINC000022016133	171349717	/nfs/dbraw/zinc/34/97/17/171349717.db2.gz	RIFREXHZVUBIOK-CYBMUJFWSA-N	1	1	278.352	2.274	40	0		CEABMO
[NH3+][C@@H]1CCCC[C@H]1N1CCN(Cc2ccccc2)CC1	ZINC000040431792	174260130	/nfs/dbraw/zinc/26/01/30/174260130.db2.gz	DNIGNRKTSONDSF-IAGOWNOFSA-N	1	1	273.424	2.074	40	0		CEABMO
CCN1CC[NH2+][C@H](Cc2ccc(-c3cccnc3)cc2)C1=O	ZINC000072343607	176371915	/nfs/dbraw/zinc/37/19/15/176371915.db2.gz	LKHNTAVVTHOHJW-QGZVFWFLSA-N	1	1	295.386	2.111	40	0		CEABMO
Cc1ccc(-c2ccc(C[C@H]3[NH2+]CCNC3=O)cc2)cc1	ZINC000072352887	176374546	/nfs/dbraw/zinc/37/45/46/176374546.db2.gz	UTRSXXUYXMIGSY-QGZVFWFLSA-N	1	1	280.371	2.293	40	0		CEABMO
Cn1ccnc1C[N@@H+]1CCC[C@H](c2ccncc2)C1	ZINC000072368044	176382413	/nfs/dbraw/zinc/38/24/13/176382413.db2.gz	LTRGOZKDZHZMSA-AWEZNQCLSA-N	1	1	256.353	2.195	40	0		CEABMO
Cn1ccnc1C[N@H+]1CCC[C@H](c2ccncc2)C1	ZINC000072368044	176382415	/nfs/dbraw/zinc/38/24/15/176382415.db2.gz	LTRGOZKDZHZMSA-AWEZNQCLSA-N	1	1	256.353	2.195	40	0		CEABMO
CSc1ccc(CN2C[C@@H]3C[C@@H](O)C[N@H+]3C[C@H]2C)cc1	ZINC000072397667	176395059	/nfs/dbraw/zinc/39/50/59/176395059.db2.gz	QERHHOFNCGADLU-VHDGCEQUSA-N	1	1	292.448	2.048	40	0		CEABMO
O[C@H]1CCC[N@@H+](Cc2ccc3cc(F)ccc3n2)C1	ZINC000072397880	176395633	/nfs/dbraw/zinc/39/56/33/176395633.db2.gz	NLZAFJLPHIHDAB-AWEZNQCLSA-N	1	1	260.312	2.331	40	0		CEABMO
c1ccc([C@H](C2CCOCC2)[NH+]2CCNCC2)cc1	ZINC000076671303	177053568	/nfs/dbraw/zinc/05/35/68/177053568.db2.gz	ZWPXMZZSZZZDSK-MRXNPFEDSA-N	1	1	260.381	2.060	40	0		CEABMO
C[N@H+]1CCC[C@@]2(C)[C@H]1CCCN2C(=O)c1ccccn1	ZINC000257269819	277070987	/nfs/dbraw/zinc/07/09/87/277070987.db2.gz	MRNFHBVRLGNJJM-ZBFHGGJFSA-N	1	1	273.380	2.171	40	0		CEABMO
CC[NH+]1CCN(C(=O)Cc2cccc(Cl)c2)CC1	ZINC000069543958	500689075	/nfs/dbraw/zinc/68/90/75/500689075.db2.gz	BYEZIXXSQVGFAD-UHFFFAOYSA-N	1	1	266.772	2.047	40	0		CEABMO
COc1ccc([C@H]([NH3+])c2nnc(CC(C)C)[nH]2)cc1	ZINC000095533749	185006728	/nfs/dbraw/zinc/00/67/28/185006728.db2.gz	JZXFTPHKOHSIFI-ZDUSSCGKSA-N	1	1	260.341	2.060	40	0		CEABMO
Fc1cccnc1O[C@H]1CC[C@H]2[C@H]1OCC[N@H+]2C1CCC1	ZINC000096042324	185069977	/nfs/dbraw/zinc/06/99/77/185069977.db2.gz	HYAULEHHASJOBF-SOUVJXGZSA-N	1	1	292.354	2.384	40	0		CEABMO
Cc1noc(C)c1C[N@@H+]1CC[C@H]2C[C@H](C)O[C@@H]2C1	ZINC000096046014	185071673	/nfs/dbraw/zinc/07/16/73/185071673.db2.gz	LKUAANZEFSRWDV-DUFXMDAXSA-N	1	1	250.342	2.291	40	0		CEABMO
Cc1ccc(C[N@H+]2CCC[C@]3(CCCC(=O)N3)C2)o1	ZINC000096049939	185074372	/nfs/dbraw/zinc/07/43/72/185074372.db2.gz	SUFXQZXCARATNO-OAHLLOKOSA-N	1	1	262.353	2.223	40	0		CEABMO
C[N@H+]1CCCCC12CCN(C(=O)c1ccco1)CC2	ZINC000096051202	185074490	/nfs/dbraw/zinc/07/44/90/185074490.db2.gz	HYECCFFAPINIHG-UHFFFAOYSA-N	1	1	262.353	2.370	40	0		CEABMO
CN1C(=O)CCC[C@@]12CCC[N@@H+](Cc1ccoc1)C2	ZINC000096049951	185074516	/nfs/dbraw/zinc/07/45/16/185074516.db2.gz	OCESUUAMAUJNIC-HNNXBMFYSA-N	1	1	262.353	2.257	40	0		CEABMO
CN1C(=O)CCC[C@]12CCC[N@@H+](Cc1ccco1)C2	ZINC000096049948	185074953	/nfs/dbraw/zinc/07/49/53/185074953.db2.gz	GGAZXMHGTBQHDT-OAHLLOKOSA-N	1	1	262.353	2.257	40	0		CEABMO
O=C1[C@H]2C[N@@H+](Cc3ccoc3)C[C@H]2CN1c1ccccc1	ZINC000096053574	185075092	/nfs/dbraw/zinc/07/50/92/185075092.db2.gz	UYUUZRNEUPLYLI-HOCLYGCPSA-N	1	1	282.343	2.374	40	0		CEABMO
COC[C@@]12CCCO[C@H]1CC[N@@H+](Cc1ccco1)C2	ZINC000096056711	185078059	/nfs/dbraw/zinc/07/80/59/185078059.db2.gz	MSHWUFSCDKMXQC-GJZGRUSLSA-N	1	1	265.353	2.297	40	0		CEABMO
Cc1ccc(C[N@@H+]2CC[C@@H]3[C@H]2CCC(=O)N3C)s1	ZINC000096056466	185078077	/nfs/dbraw/zinc/07/80/77/185078077.db2.gz	JYQVWFJWUHHMFZ-CHWSQXEVSA-N	1	1	264.394	2.252	40	0		CEABMO
CCOC[C@H]1C[N@H+](Cc2ccc(C)o2)Cc2cnn(C)c21	ZINC000096060061	185081475	/nfs/dbraw/zinc/08/14/75/185081475.db2.gz	KDMYYJGGQMGQOX-CQSZACIVSA-N	1	1	289.379	2.457	40	0		CEABMO
CCOC[C@H]1C[N@@H+](Cc2ccc(C)o2)Cc2cnn(C)c21	ZINC000096060061	185081476	/nfs/dbraw/zinc/08/14/76/185081476.db2.gz	KDMYYJGGQMGQOX-CQSZACIVSA-N	1	1	289.379	2.457	40	0		CEABMO
O[C@@H]1CC[N@@H+](Cc2ccc(F)cc2)[C@H]1Cc1cccnc1	ZINC000096061604	185082652	/nfs/dbraw/zinc/08/26/52/185082652.db2.gz	YAEWDXCHBMSKBU-DLBZAZTESA-N	1	1	286.350	2.399	40	0		CEABMO
C[C@H]1CO[C@]2(CC[N@H+](Cc3ccncc3F)C2)C1	ZINC000096071986	185087247	/nfs/dbraw/zinc/08/72/47/185087247.db2.gz	GKZYVOPGVFRSEM-BXUZGUMPSA-N	1	1	250.317	2.222	40	0		CEABMO
C[C@H]1CO[C@]2(CC[N@@H+](Cc3ccncc3F)C2)C1	ZINC000096071986	185087248	/nfs/dbraw/zinc/08/72/48/185087248.db2.gz	GKZYVOPGVFRSEM-BXUZGUMPSA-N	1	1	250.317	2.222	40	0		CEABMO
c1cncc(OCc2noc3c2C[N@@H+](CC2CC2)CC3)c1	ZINC000096085102	185092919	/nfs/dbraw/zinc/09/29/19/185092919.db2.gz	JXJHJYNLTZSTDQ-UHFFFAOYSA-N	1	1	285.347	2.417	40	0		CEABMO
c1ccc(N2CC[C@@H]3[C@@H]2CC[N@@H+]3CC2CCOCC2)nc1	ZINC000096184434	344239100	/nfs/dbraw/zinc/23/91/00/344239100.db2.gz	YRHITWJVNXSXKP-CVEARBPZSA-N	1	1	287.407	2.161	40	0		CEABMO
O=C1NCC[N@H+](CCc2ccccc2)[C@@H]1c1ccccc1	ZINC000090662036	180019364	/nfs/dbraw/zinc/01/93/64/180019364.db2.gz	PWCWFEULDOSSJE-QGZVFWFLSA-N	1	1	280.371	2.402	40	0		CEABMO
O=C1NCC[N@@H+](CCc2ccccc2)[C@@H]1c1ccccc1	ZINC000090662036	180019366	/nfs/dbraw/zinc/01/93/66/180019366.db2.gz	PWCWFEULDOSSJE-QGZVFWFLSA-N	1	1	280.371	2.402	40	0		CEABMO
CC(C)[N@@H+](CCO)C[C@H]1CCN(Cc2ccccc2)C1	ZINC000079395093	363595399	/nfs/dbraw/zinc/59/53/99/363595399.db2.gz	YWKRMJPLPIUQDH-KRWDZBQOSA-N	1	1	276.424	2.211	40	0		CEABMO
CCN(CC)C(=O)COC[C@@H]1CCC[N@H+]2CCCC[C@@H]12	ZINC000013424998	361427937	/nfs/dbraw/zinc/42/79/37/361427937.db2.gz	YXGLGZVQMGKEBH-GJZGRUSLSA-N	1	1	282.428	2.136	40	0		CEABMO
CCn1ncc(C[N@H+](CCO)Cc2cccs2)c1C	ZINC000013997491	361446268	/nfs/dbraw/zinc/44/62/68/361446268.db2.gz	XIYCOVWNTMTMGK-UHFFFAOYSA-N	1	1	279.409	2.267	40	0		CEABMO
CCn1ncc(C[N@@H+](CCO)Cc2cccs2)c1C	ZINC000013997491	361446274	/nfs/dbraw/zinc/44/62/74/361446274.db2.gz	XIYCOVWNTMTMGK-UHFFFAOYSA-N	1	1	279.409	2.267	40	0		CEABMO
COc1cc(CN2C[C@H]3CCC[N@H+]3C[C@@H]2C)cc(OC)c1	ZINC000019575722	361542819	/nfs/dbraw/zinc/54/28/19/361542819.db2.gz	FZINEIJGXRZIID-DZGCQCFKSA-N	1	1	290.407	2.372	40	0		CEABMO
O[C@H](COc1ccccc1)C[N@H+]1CC[C@@H]2C=CC=C[C@@H]2C1	ZINC000026531227	361642603	/nfs/dbraw/zinc/64/26/03/361642603.db2.gz	HSIIBDBKJDPQQR-BBWFWOEESA-N	1	1	285.387	2.490	40	0		CEABMO
Cc1ccc(C[N@@H+]2CC[C@@H]3[C@@H]2CCN3C(=O)NC(C)C)o1	ZINC000096184708	364406652	/nfs/dbraw/zinc/40/66/52/364406652.db2.gz	MBONFTJDWSFUCG-LSDHHAIUSA-N	1	1	291.395	2.355	40	0		CEABMO
Fc1ccc(C[NH+]2CC3(C2)CCN(c2ncccn2)C3)cc1	ZINC000096202593	364410123	/nfs/dbraw/zinc/41/01/23/364410123.db2.gz	XGOJUXHQTBYEKU-UHFFFAOYSA-N	1	1	298.365	2.328	40	0		CEABMO
CO[C@H]1CC[N@@H+](Cc2ccsc2)[C@H]1Cc1cnn(C)c1	ZINC000096200594	364410262	/nfs/dbraw/zinc/41/02/62/364410262.db2.gz	CWZKEVZDYHJFHB-GJZGRUSLSA-N	1	1	291.420	2.314	40	0		CEABMO
COc1ccc(C[N@H+]2CC[C@H](O)[C@@H]2Cc2ccncc2)cc1	ZINC000096200715	364410572	/nfs/dbraw/zinc/41/05/72/364410572.db2.gz	YXODIXGVYCKSIP-ROUUACIJSA-N	1	1	298.386	2.268	40	0		CEABMO
O=C1Nc2ccccc2[C@@]12CC[N@@H+](CC1CCC1)C2	ZINC000096244787	364415888	/nfs/dbraw/zinc/41/58/88/364415888.db2.gz	ACPTYNFQFLLJPP-INIZCTEOSA-N	1	1	256.349	2.382	40	0		CEABMO
O=C(NCC1CC1)C12CC(C1)C[N@@H+]2Cc1ccsc1	ZINC000096252608	364416529	/nfs/dbraw/zinc/41/65/29/364416529.db2.gz	YRZUXZVFTUXVLM-UHFFFAOYSA-N	1	1	276.405	2.239	40	0		CEABMO
O=C(NCC1CC1)C12CC(C1)C[N@H+]2Cc1ccsc1	ZINC000096252608	364416538	/nfs/dbraw/zinc/41/65/38/364416538.db2.gz	YRZUXZVFTUXVLM-UHFFFAOYSA-N	1	1	276.405	2.239	40	0		CEABMO
Cc1ccc2c(n1)N(C)[C@H](CO)CC[N@H+](CC(C)C)C2	ZINC000225494202	370299395	/nfs/dbraw/zinc/29/93/95/370299395.db2.gz	DLMPWCMQOPGKRA-HNNXBMFYSA-N	1	1	277.412	2.049	40	0	biogenic,in-vitro	CEABMO
COC[C@H]1CCOC12C[NH+](Cc1cccc3[nH]ccc31)C2	ZINC000247893317	371145088	/nfs/dbraw/zinc/14/50/88/371145088.db2.gz	ULDIFWLFDXJIRB-CQSZACIVSA-N	1	1	286.375	2.405	40	0		CEABMO
CC(=O)N1CCC[C@H]([N@H+]2CCc3ccccc3C2)C1	ZINC000408604100	375513645	/nfs/dbraw/zinc/51/36/45/375513645.db2.gz	DJJKNZXVUDAVQI-INIZCTEOSA-N	1	1	258.365	2.056	40	0		CEABMO
CCn1ncc(C[NH2+]Cc2cnn(CC(C)C)c2)c1F	ZINC000256054524	190005344	/nfs/dbraw/zinc/00/53/44/190005344.db2.gz	WROFMATWHZITBU-UHFFFAOYSA-N	1	1	279.363	2.184	40	0		CEABMO
CCN(CC)CC[NH2+]Cc1cn(C(C)C)nc1C	ZINC000256051567	190003902	/nfs/dbraw/zinc/00/39/02/190003902.db2.gz	JRPUMQGZHQORHI-UHFFFAOYSA-N	1	1	252.406	2.204	40	0		CEABMO
CNC(=O)C[N@H+]1CCC[C@@H](Cc2cnc3ccccc3c2)C1	ZINC000257205984	190011640	/nfs/dbraw/zinc/01/16/40/190011640.db2.gz	BBJWOAOUPSJHQM-AWEZNQCLSA-N	1	1	297.402	2.235	40	0		CEABMO
Cn1nccc1-c1cc(C[C@@H]2CCC[N@@H+](C)C2)ccn1	ZINC000257286934	190026837	/nfs/dbraw/zinc/02/68/37/190026837.db2.gz	PNSFLBKAJFFEJD-AWEZNQCLSA-N	1	1	270.380	2.366	40	0		CEABMO
c1cn2ccnc(N3CC[NH+](Cc4ccsc4)CC3)c2n1	ZINC000306141652	376540062	/nfs/dbraw/zinc/54/00/62/376540062.db2.gz	WCYNLIKEUXVHFG-UHFFFAOYSA-N	1	1	299.403	2.113	40	0		CEABMO
CCC[N@@H+]1CCC[C@H]1c1ccc(N2CCN(C)CC2)nc1	ZINC000072216524	394592792	/nfs/dbraw/zinc/59/27/92/394592792.db2.gz	FTZHLJLEEYBRPR-INIZCTEOSA-N	1	1	288.439	2.380	40	0		CEABMO
CCC[N@H+]1CCC[C@H]1c1ccc(N2CCN(C)CC2)nc1	ZINC000072216524	394592797	/nfs/dbraw/zinc/59/27/97/394592797.db2.gz	FTZHLJLEEYBRPR-INIZCTEOSA-N	1	1	288.439	2.380	40	0		CEABMO
[NH3+][C@H]1C(=O)N(c2ccc(F)cc2)[C@H]1c1cccs1	ZINC000072227201	394595413	/nfs/dbraw/zinc/59/54/13/394595413.db2.gz	RRJYLPIQTIKPMO-NEPJUHHUSA-N	1	1	262.309	2.302	40	0		CEABMO
COc1ccc(N2C(=O)[C@H]([NH3+])[C@H]2c2ccccc2F)cc1	ZINC000072227176	394595483	/nfs/dbraw/zinc/59/54/83/394595483.db2.gz	XKWPSGICQZPRNH-HUUCEWRRSA-N	1	1	286.306	2.250	40	0		CEABMO
COc1ccc(N2C(=O)[C@@H]([NH3+])[C@H]2c2ccc(C)cc2)cc1	ZINC000072227134	394595531	/nfs/dbraw/zinc/59/55/31/394595531.db2.gz	FHJGRFNZBYNQNN-JKSUJKDBSA-N	1	1	282.343	2.419	40	0		CEABMO
COc1cccc([C@H]2[C@@H]([NH3+])C(=O)N2c2ccc(F)cc2)c1	ZINC000072227225	394595586	/nfs/dbraw/zinc/59/55/86/394595586.db2.gz	QLMHZURZFQDQGH-CABCVRRESA-N	1	1	286.306	2.250	40	0		CEABMO
COc1ccc([C@@H]2[C@@H]([NH3+])C(=O)N2c2cccc(C)c2)cc1	ZINC000072227400	394595611	/nfs/dbraw/zinc/59/56/11/394595611.db2.gz	JVLQZDFTFIYYDA-HZPDHXFCSA-N	1	1	282.343	2.419	40	0		CEABMO
COc1cccc(N2C(=O)[C@H]([NH3+])[C@H]2c2ccc(C)cc2)c1	ZINC000072227728	394596250	/nfs/dbraw/zinc/59/62/50/394596250.db2.gz	ATICMZPWYIMLJQ-HZPDHXFCSA-N	1	1	282.343	2.419	40	0		CEABMO
Cc1ccc(N2C(=O)[C@H]([NH3+])[C@@H]2c2ccc3c(c2)OCO3)cc1	ZINC000072227465	394596645	/nfs/dbraw/zinc/59/66/45/394596645.db2.gz	HHNIEFVQXKKMLP-CVEARBPZSA-N	1	1	296.326	2.139	40	0		CEABMO
Cc1cccc(C[N@H+]2CC[C@H]3[C@@H]2CCN3c2ncccn2)n1	ZINC000096064033	394675619	/nfs/dbraw/zinc/67/56/19/394675619.db2.gz	JURDHVGAHBNIKR-HOTGVXAUSA-N	1	1	295.390	2.033	40	0		CEABMO
Cc1ccc(OC[C@@H](O)C[NH+]2C[C@@H](C)O[C@H](C)C2)c(C)c1	ZINC000019790693	170868077	/nfs/dbraw/zinc/86/80/77/170868077.db2.gz	OBGXCUHUUMTQLW-OAGGEKHMSA-N	1	1	293.407	2.152	40	0		CEABMO
CC1CC[NH+]([C@@H](CN)c2ccc3c(c2)CCO3)CC1	ZINC000037363610	173153242	/nfs/dbraw/zinc/15/32/42/173153242.db2.gz	YVDHXORJDUXSIS-HNNXBMFYSA-N	1	1	260.381	2.353	40	0		CEABMO
C[N@H+]1CCC[C@H](c2cncc(Nc3ccccn3)n2)C1	ZINC000072354312	176374911	/nfs/dbraw/zinc/37/49/11/176374911.db2.gz	IQAMLWZONWLZML-LBPRGKRZSA-N	1	1	269.352	2.424	40	0		CEABMO
Cc1cc(NC2CCOCC2)nc([C@@H]2CCC[N@H+](C)C2)n1	ZINC000072365461	176380528	/nfs/dbraw/zinc/38/05/28/176380528.db2.gz	SZONHBDAEGUMNU-CYBMUJFWSA-N	1	1	290.411	2.185	40	0		CEABMO
CN(C)c1cncc([C@@H]2CCC[N@@H+]2Cc2ccncc2)n1	ZINC000072385040	176389220	/nfs/dbraw/zinc/38/92/20/176389220.db2.gz	JETHMSGYDFWPRC-HNNXBMFYSA-N	1	1	283.379	2.275	40	0		CEABMO
CN(C)c1cncc([C@@H]2CCC[N@H+]2Cc2ccncc2)n1	ZINC000072385040	176389221	/nfs/dbraw/zinc/38/92/21/176389221.db2.gz	JETHMSGYDFWPRC-HNNXBMFYSA-N	1	1	283.379	2.275	40	0		CEABMO
[NH3+][C@@H](Cc1ccccc1)c1nc(-c2ccc(O)cc2)n[nH]1	ZINC000095534848	185008028	/nfs/dbraw/zinc/00/80/28/185008028.db2.gz	ZYSYUSDORFFEJK-AWEZNQCLSA-N	1	1	280.331	2.420	40	0		CEABMO
OC[C@@H]1C[N@@H+](Cc2ccccc2)CCN1Cc1ccccc1	ZINC000095829840	185029219	/nfs/dbraw/zinc/02/92/19/185029219.db2.gz	SOUPGWGAPDMYFM-IBGZPJMESA-N	1	1	296.414	2.365	40	0		CEABMO
OC[C@@H]1CN(Cc2ccccc2)CC[N@@H+]1Cc1ccccc1	ZINC000095829840	185029222	/nfs/dbraw/zinc/02/92/22/185029222.db2.gz	SOUPGWGAPDMYFM-IBGZPJMESA-N	1	1	296.414	2.365	40	0		CEABMO
OC[C@@H]1CN(Cc2ccccc2)CC[N@H+]1Cc1ccccc1	ZINC000095829840	185029224	/nfs/dbraw/zinc/02/92/24/185029224.db2.gz	SOUPGWGAPDMYFM-IBGZPJMESA-N	1	1	296.414	2.365	40	0		CEABMO
COC[C@]12CCCO[C@H]1CC[N@@H+](Cc1ccoc1)C2	ZINC000096038973	185069580	/nfs/dbraw/zinc/06/95/80/185069580.db2.gz	RPAIPOFUMNRCFZ-LSDHHAIUSA-N	1	1	265.353	2.297	40	0		CEABMO
CC[N@H+]1CCOC[C@]2(CCCN(Cc3ccncc3)C2)C1	ZINC000096049601	185072316	/nfs/dbraw/zinc/07/23/16/185072316.db2.gz	ROSWHBLOMLYGJU-QGZVFWFLSA-N	1	1	289.423	2.016	40	0		CEABMO
CCN1CCOC[C@]2(CCC[N@H+](Cc3ccncc3)C2)C1	ZINC000096049601	185072317	/nfs/dbraw/zinc/07/23/17/185072317.db2.gz	ROSWHBLOMLYGJU-QGZVFWFLSA-N	1	1	289.423	2.016	40	0		CEABMO
CCN1CCOC[C@]2(CCC[N@@H+](Cc3ccncc3)C2)C1	ZINC000096049601	185072318	/nfs/dbraw/zinc/07/23/18/185072318.db2.gz	ROSWHBLOMLYGJU-QGZVFWFLSA-N	1	1	289.423	2.016	40	0		CEABMO
O=C1CC[C@]2(CCC[N@@H+](Cc3ccsc3)CC2)N1	ZINC000096047441	185073093	/nfs/dbraw/zinc/07/30/93/185073093.db2.gz	HMSWASPJGMMJLA-AWEZNQCLSA-N	1	1	264.394	2.383	40	0		CEABMO
CC(C)N1CCO[C@H]2C[N@@H+](Cc3cccs3)C[C@H]21	ZINC000096054274	185076202	/nfs/dbraw/zinc/07/62/02/185076202.db2.gz	LIWBDFGQWLSTSF-KGLIPLIRSA-N	1	1	266.410	2.042	40	0		CEABMO
CCOC[C@@]12CCCO[C@@H]1CC[N@@H+](Cc1ccncc1)C2	ZINC000096056811	185077363	/nfs/dbraw/zinc/07/73/63/185077363.db2.gz	PBORYDSXKKSBKD-SJORKVTESA-N	1	1	290.407	2.489	40	0		CEABMO
CCOC[C@@]12CCCO[C@H]1CC[N@@H+](Cc1cccnc1)C2	ZINC000096056809	185078116	/nfs/dbraw/zinc/07/81/16/185078116.db2.gz	QGEMVTUHWNOLFE-IRXDYDNUSA-N	1	1	290.407	2.489	40	0		CEABMO
CCN1C(=O)CC[C@@]12CCC[N@@H+](Cc1ccncc1)CC2	ZINC000096071916	185086899	/nfs/dbraw/zinc/08/68/99/185086899.db2.gz	BCPMJYLFIDKZIJ-QGZVFWFLSA-N	1	1	287.407	2.449	40	0		CEABMO
Cc1ccc(C[N@H+]2C[C@@H]3COC[C@]3(COCC3CC3)C2)o1	ZINC000096108714	185099496	/nfs/dbraw/zinc/09/94/96/185099496.db2.gz	USAAWORXHJYMBS-NVXWUHKLSA-N	1	1	291.391	2.463	40	0		CEABMO
Cc1nc(C)c(C(=O)NCC[N@@H+]2C[C@H](C)C[C@H](C)C2)s1	ZINC000046882135	362189557	/nfs/dbraw/zinc/18/95/57/362189557.db2.gz	RKGHATGFEOVQIO-PHIMTYICSA-N	1	1	295.452	2.468	40	0		CEABMO
c1coc(-c2nnc([C@H]3CC[N@@H+](Cc4ncc[nH]4)C3)o2)c1	ZINC000049169538	362343105	/nfs/dbraw/zinc/34/31/05/362343105.db2.gz	ZYCPLRYMEZNAMB-JTQLQIEISA-N	1	1	285.307	2.042	40	0	biogenic,in-vitro	CEABMO
c1coc(-c2nnc([C@H]3CC[N@H+](Cc4ncc[nH]4)C3)o2)c1	ZINC000049169538	362343110	/nfs/dbraw/zinc/34/31/10/362343110.db2.gz	ZYCPLRYMEZNAMB-JTQLQIEISA-N	1	1	285.307	2.042	40	0	biogenic,in-vitro	CEABMO
CN1CCC([N@H+]2CC[C@H](c3nnc(C(C)(C)C)o3)C2)CC1	ZINC000049170648	362344443	/nfs/dbraw/zinc/34/44/43/362344443.db2.gz	ZUIGYIUMPQDQQD-LBPRGKRZSA-N	1	1	292.427	2.251	40	0	biogenic,in-vitro	CEABMO
C[NH+]1CCC(N2CC[C@H](c3nnc(C(C)(C)C)o3)C2)CC1	ZINC000049170648	362344448	/nfs/dbraw/zinc/34/44/48/362344448.db2.gz	ZUIGYIUMPQDQQD-LBPRGKRZSA-N	1	1	292.427	2.251	40	0	biogenic,in-vitro	CEABMO
CC(C)CC[N@H+]1C[C@@H]2CN(c3ncccn3)CC[C@H]21	ZINC000585107984	345006084	/nfs/dbraw/zinc/00/60/84/345006084.db2.gz	PYXNWZCQMGQFSB-ZIAGYGMSSA-N	1	1	260.385	2.033	40	0		CEABMO
Cc1cccc(OC[C@@]2(O)CC[N@@H+](Cc3ccccn3)C2)c1	ZINC000585268935	345009369	/nfs/dbraw/zinc/00/93/69/345009369.db2.gz	DZEMVCQBESEHDZ-GOSISDBHSA-N	1	1	298.386	2.406	40	0		CEABMO
CCC(=O)N1CC[C@]2(c3ccccc3)CC[N@@H+](C)[C@H]2C1	ZINC000107260307	186164567	/nfs/dbraw/zinc/16/45/67/186164567.db2.gz	BWMHZOIKSIBNDQ-RDJZCZTQSA-N	1	1	272.392	2.271	40	0		CEABMO
COC[C@@]12CCCO[C@H]1CC[N@@H+](Cc1scnc1C)C2	ZINC000107771335	186190737	/nfs/dbraw/zinc/19/07/37/186190737.db2.gz	MPWGFTVATGFOKA-GJZGRUSLSA-N	1	1	296.436	2.469	40	0		CEABMO
Cn1cc(C[NH2+]Cc2ccco2)c(C(F)(F)F)n1	ZINC000130728759	365983811	/nfs/dbraw/zinc/98/38/11/365983811.db2.gz	JPVXICHLOVOTCG-UHFFFAOYSA-N	1	1	259.231	2.322	40	0		CEABMO
Cc1[nH+]ccn1CCNC(=O)c1cc(C)c2ccccc2n1	ZINC000019657358	361546594	/nfs/dbraw/zinc/54/65/94/361546594.db2.gz	RSZWDXDMTQNSDA-UHFFFAOYSA-N	1	1	294.358	2.478	40	0		CEABMO
C[N@H+]1CC[C@@]23CC(=O)CC[C@@H]2[C@@H]1Cc1ccc(O)cc13	ZINC000029221936	361682630	/nfs/dbraw/zinc/68/26/30/361682630.db2.gz	DRLCTBKVUWSSIT-HYVNUMGLSA-N	1	1	271.360	2.259	40	0	biogenic,in-vitro	CEABMO
Cc1nc(CO[C@H]2C[N@H+](C(C)C)[C@@H]3COC[C@H]23)cs1	ZINC000096185092	364407379	/nfs/dbraw/zinc/40/73/79/364407379.db2.gz	RJJSZHUSJQQQEV-MJBXVCDLSA-N	1	1	282.409	2.076	40	0		CEABMO
O=C1C[C@H]2[C@@H](CC[N@H+]2C2CCOCC2)N1c1ccsc1	ZINC000096063912	364400496	/nfs/dbraw/zinc/40/04/96/364400496.db2.gz	BGLZRAPRBGDXTH-KGLIPLIRSA-N	1	1	292.404	2.107	40	0		CEABMO
CN1C(=O)CCC[C@@]12CCC[N@@H+](Cc1ccncc1)C2	ZINC000096049971	364400717	/nfs/dbraw/zinc/40/07/17/364400717.db2.gz	MACGVZNIRVAHMG-INIZCTEOSA-N	1	1	273.380	2.059	40	0		CEABMO
Cc1cc(C[N@@H+]2C[C@@H](C)[C@@]3(CCN(C)C3=O)C2)oc1C	ZINC000096201636	364410295	/nfs/dbraw/zinc/41/02/95/364410295.db2.gz	SDCMDFATSIKZEZ-MLGOLLRUSA-N	1	1	276.380	2.197	40	0		CEABMO
CC(C)C[N@H+]1CCC[C@]12CCN(c1nncs1)C2	ZINC000096203047	364411535	/nfs/dbraw/zinc/41/15/35/364411535.db2.gz	JWWVPWMKUQSJGT-CYBMUJFWSA-N	1	1	266.414	2.239	40	0		CEABMO
Cc1ccc(C[N@H+]2CC[C@]3(C[C@@H]3C(=O)NCC3CC3)C2)o1	ZINC000096228634	364414522	/nfs/dbraw/zinc/41/45/22/364414522.db2.gz	IIXRSHWVXRQTTH-WBVHZDCISA-N	1	1	288.391	2.326	40	0		CEABMO
COC[C@H]1CC2(CN1Cc1csc(C)n1)CC[NH2+]CC2	ZINC000096240353	364417262	/nfs/dbraw/zinc/41/72/62/364417262.db2.gz	KUMAYTZUVCXBKJ-CQSZACIVSA-N	1	1	295.452	2.042	40	0		CEABMO
CCC1=N[C@@]2(CC[C@@H]3C[N@@H+](CC4CC4)C[C@@H]32)C(=O)N1CC	ZINC000096261620	364418795	/nfs/dbraw/zinc/41/87/95/364418795.db2.gz	YFIOEZLKLJSAGW-JKIFEVAISA-N	1	1	289.423	2.148	40	0		CEABMO
C[N@H+]1CC[C@@]2(CCN(C(=O)C3CCCCC3)C2)C1	ZINC000096268645	364420331	/nfs/dbraw/zinc/42/03/31/364420331.db2.gz	RLWOFVCKJCIBQM-OAHLLOKOSA-N	1	1	250.386	2.121	40	0		CEABMO
CN1C(=O)CC[C@@]12CCC[N@@H+](Cc1nccs1)CC2	ZINC000585100517	367178060	/nfs/dbraw/zinc/17/80/60/367178060.db2.gz	LWMQWFQFXKEOQY-CQSZACIVSA-N	1	1	279.409	2.120	40	0		CEABMO
COC(=O)[C@@H]1C[C@H]2C(=O)CCC[C@H]2[N@@H+]1Cc1ccccc1	ZINC000226086315	370328795	/nfs/dbraw/zinc/32/87/95/370328795.db2.gz	GZNHZBDIIAIIAS-KFWWJZLASA-N	1	1	287.359	2.172	40	0		CEABMO
COC(=O)[C@@H]1C[C@H]2C(=O)CCC[C@H]2[N@H+]1Cc1ccccc1	ZINC000226086315	370328801	/nfs/dbraw/zinc/32/88/01/370328801.db2.gz	GZNHZBDIIAIIAS-KFWWJZLASA-N	1	1	287.359	2.172	40	0		CEABMO
c1ccc(OC[C@H]2C[C@@H]3[C@H](C2)OCC[N@H+]3CC2CC2)nc1	ZINC000253591453	371530607	/nfs/dbraw/zinc/53/06/07/371530607.db2.gz	NMVZUPDNUAFYQR-XHSDSOJGSA-N	1	1	288.391	2.350	40	0		CEABMO
CCCn1cc(C[NH2+]Cc2cnn(CC)c2F)c(C)n1	ZINC000256054602	190005296	/nfs/dbraw/zinc/00/52/96/190005296.db2.gz	WYTRGWGLJIYIRH-UHFFFAOYSA-N	1	1	279.363	2.247	40	0		CEABMO
CCCn1nccc1C[NH2+]Cc1ccnn1CC(C)C	ZINC000256050833	190003199	/nfs/dbraw/zinc/00/31/99/190003199.db2.gz	GQSFOQLFDRAFSJ-UHFFFAOYSA-N	1	1	275.400	2.435	40	0		CEABMO
CCn1ncc(C)c1C[NH2+]Cc1ccnn1C(C)C	ZINC000256052127	190004309	/nfs/dbraw/zinc/00/43/09/190004309.db2.gz	LZZPYBAIDIAZCY-UHFFFAOYSA-N	1	1	261.373	2.279	40	0		CEABMO
CNC(=O)C[N@H+]1CCC[C@H](Cc2cnc3ccccc3c2)C1	ZINC000257205985	190011801	/nfs/dbraw/zinc/01/18/01/190011801.db2.gz	BBJWOAOUPSJHQM-CQSZACIVSA-N	1	1	297.402	2.235	40	0		CEABMO
c1ncc(C[N@H+]2CCC[C@@H](c3ccc4c[nH]nc4n3)C2)[nH]1	ZINC000257221437	190014374	/nfs/dbraw/zinc/01/43/74/190014374.db2.gz	DPAAJBHTMBUVFJ-GFCCVEGCSA-N	1	1	282.351	2.061	40	0		CEABMO
c1nc(C[N@@H+]2CCC[C@@H](c3ccc4c[nH]nc4n3)C2)c[nH]1	ZINC000257221437	190014375	/nfs/dbraw/zinc/01/43/75/190014375.db2.gz	DPAAJBHTMBUVFJ-GFCCVEGCSA-N	1	1	282.351	2.061	40	0		CEABMO
c1nc(C[N@H+]2CCC[C@@H](c3ccc4c[nH]nc4n3)C2)c[nH]1	ZINC000257221437	190014376	/nfs/dbraw/zinc/01/43/76/190014376.db2.gz	DPAAJBHTMBUVFJ-GFCCVEGCSA-N	1	1	282.351	2.061	40	0		CEABMO
Cc1cc(C)nc([C@H]2CC[N@H+](Cc3cccn3C)C2)n1	ZINC000257260438	190022530	/nfs/dbraw/zinc/02/25/30/190022530.db2.gz	LCVKBGBIUWNSJL-AWEZNQCLSA-N	1	1	270.380	2.421	40	0		CEABMO
CC(C)[N@H+]1CCC[C@H](c2cnc(-c3cn[nH]c3)cn2)C1	ZINC000257279703	190025888	/nfs/dbraw/zinc/02/58/88/190025888.db2.gz	OHUIMLUBNLNZBO-LBPRGKRZSA-N	1	1	271.368	2.455	40	0		CEABMO
CNc1cc([C@H]2CCC[N@H+]2CC2CCOCC2)nc(C)n1	ZINC000257288972	190027521	/nfs/dbraw/zinc/02/75/21/190027521.db2.gz	PWLYWPSSTHRCJN-OAHLLOKOSA-N	1	1	290.411	2.390	40	0		CEABMO
O[C@H]1CC[N@@H+](CCCc2ccccc2)C[C@@]12CCCO2	ZINC000257308248	190031373	/nfs/dbraw/zinc/03/13/73/190031373.db2.gz	TVZZFGYRCXBEKW-IRXDYDNUSA-N	1	1	275.392	2.235	40	0		CEABMO
Cc1nc(CO[C@H]2C[N@@H+](CC3CC3)[C@@H]3COC[C@H]23)cs1	ZINC000096185093	256814808	/nfs/dbraw/zinc/81/48/08/256814808.db2.gz	YSBSZZSYXVCXEG-ZNMIVQPWSA-N	1	1	294.420	2.077	40	0		CEABMO
C[N@H+]1CC[C@@]2(CN(Cc3cccnc3)c3cccnc32)C1	ZINC000306130304	394513603	/nfs/dbraw/zinc/51/36/03/394513603.db2.gz	JBYCANWEQZACIQ-KRWDZBQOSA-N	1	1	280.375	2.070	40	0		CEABMO
CC(C)[NH+]1CCC2(CC1)CN(C)Cc1cccnc12	ZINC000306133686	394513846	/nfs/dbraw/zinc/51/38/46/394513846.db2.gz	MSQDSTLHMMKSCG-UHFFFAOYSA-N	1	1	259.397	2.269	40	0		CEABMO
Cc1cccc(C[N@H+]2CC[C@@H]3[C@H]2CCN3c2ncccn2)n1	ZINC000306131009	394513872	/nfs/dbraw/zinc/51/38/72/394513872.db2.gz	JURDHVGAHBNIKR-HZPDHXFCSA-N	1	1	295.390	2.033	40	0		CEABMO
CNc1[nH+]cc(CNC(=O)OC(C)(C)C)cc1C	ZINC000072222014	394594429	/nfs/dbraw/zinc/59/44/29/394594429.db2.gz	MNIBHRNJYRGUKG-UHFFFAOYSA-N	1	1	251.330	2.456	40	0		CEABMO
[NH3+][C@H]1C(=O)N(c2ccccc2)[C@H]1c1ccccc1F	ZINC000072227381	394595242	/nfs/dbraw/zinc/59/52/42/394595242.db2.gz	MPFLSNBXZVSLMS-KGLIPLIRSA-N	1	1	256.280	2.241	40	0		CEABMO
COc1ccc(N2C(=O)[C@H]([NH3+])[C@H]2c2ccc(C)cc2)cc1	ZINC000072227136	394595389	/nfs/dbraw/zinc/59/53/89/394595389.db2.gz	FHJGRFNZBYNQNN-HZPDHXFCSA-N	1	1	282.343	2.419	40	0		CEABMO
CC(C)[N@H+]1CCC[C@@H](c2cnc(-c3cnn(C)c3)cn2)C1	ZINC000257288349	394595506	/nfs/dbraw/zinc/59/55/06/394595506.db2.gz	PTWLGKGKEVWEGK-CYBMUJFWSA-N	1	1	285.395	2.465	40	0		CEABMO
Cc1cccc(N2C(=O)[C@@H]([NH3+])[C@H]2c2ccc3c(c2)OCO3)c1	ZINC000072227418	394596160	/nfs/dbraw/zinc/59/61/60/394596160.db2.gz	QSFRUXLWQVPDDO-JKSUJKDBSA-N	1	1	296.326	2.139	40	0		CEABMO
[NH3+][C@H]1C(=O)N(Cc2ccccc2)[C@@H]1c1cccs1	ZINC000072228116	394596292	/nfs/dbraw/zinc/59/62/92/394596292.db2.gz	OEQATJNDAUGNDQ-CHWSQXEVSA-N	1	1	258.346	2.159	40	0		CEABMO
CCOc1ccc([C@H]([NH3+])c2nnc(C3CC3)[nH]2)cc1OC	ZINC000095534302	394673308	/nfs/dbraw/zinc/67/33/08/394673308.db2.gz	USWQEDCZQZOUOK-ZDUSSCGKSA-N	1	1	288.351	2.138	40	0		CEABMO
COc1ccc(N2C(=O)[C@@H]([NH3+])[C@@H]2c2ccccc2)cc1	ZINC000072227124	286323987	/nfs/dbraw/zinc/32/39/87/286323987.db2.gz	XTSXQGSRHGCKDD-GJZGRUSLSA-N	1	1	268.316	2.110	40	0		CEABMO
CC(C)NC(=O)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1	ZINC000038832181	174157168	/nfs/dbraw/zinc/15/71/68/174157168.db2.gz	YLMKBINVCFQWPO-OAHLLOKOSA-N	1	1	260.381	2.423	40	0		CEABMO
Cc1nc([C@H]2CCC[N@H+]2C2CCCCC2)ncc1C(N)=O	ZINC000072345420	176372968	/nfs/dbraw/zinc/37/29/68/176372968.db2.gz	NKZPAILZPDZDOF-CQSZACIVSA-N	1	1	288.395	2.354	40	0		CEABMO
OCC[N@H+]1CCC[C@@H](c2cncc(Oc3ccccc3)n2)C1	ZINC000072361617	176377900	/nfs/dbraw/zinc/37/79/00/176377900.db2.gz	OXPKOGYPFIZBQL-CQSZACIVSA-N	1	1	299.374	2.441	40	0		CEABMO
CNC(=O)CCc1cc(C)nc([C@H]2CCC[N@H+]2C(C)C)n1	ZINC000072366556	176381695	/nfs/dbraw/zinc/38/16/95/176381695.db2.gz	AJBRTMRCCITECS-CQSZACIVSA-N	1	1	290.411	2.009	40	0		CEABMO
COc1ccc(OCCc2cc([C@@H]3CC[NH2+]C3)n[nH]2)cc1	ZINC000072374095	176385340	/nfs/dbraw/zinc/38/53/40/176385340.db2.gz	VODKTFDSFFEVAH-GFCCVEGCSA-N	1	1	287.363	2.117	40	0		CEABMO
CNc1ccc(C[C@H]2CCC[N@@H+](Cc3ccncc3)C2)nn1	ZINC000072387306	176392636	/nfs/dbraw/zinc/39/26/36/176392636.db2.gz	GNELTGSHCDFXEZ-OAHLLOKOSA-N	1	1	297.406	2.368	40	0		CEABMO
CC(C)C[N@H+]1CCC[C@H](c2[nH]nc3nccnc32)C1	ZINC000072395872	176394434	/nfs/dbraw/zinc/39/44/34/176394434.db2.gz	BXLJATFNJHXGPX-NSHDSACASA-N	1	1	259.357	2.188	40	0		CEABMO
CO[C@H]1COCC[N@@H+](Cc2cn(C)c3ccccc23)C1	ZINC000077265966	177247570	/nfs/dbraw/zinc/24/75/70/177247570.db2.gz	BVLITXVTOZYOQD-CQSZACIVSA-N	1	1	274.364	2.026	40	0	biogenic,in-vitro	CEABMO
Cc1cc(-c2cc([C@@H]3CCC[N@H+](C)C3)nc(C)n2)n[nH]1	ZINC000257205134	280284361	/nfs/dbraw/zinc/28/43/61/280284361.db2.gz	AXVASQYIWWRRGM-GFCCVEGCSA-N	1	1	271.368	2.293	40	0		CEABMO
Cc1cc(-c2cc([C@H]3CCC[N@H+](C)C3)nc(C)n2)n[nH]1	ZINC000257205135	280284499	/nfs/dbraw/zinc/28/44/99/280284499.db2.gz	AXVASQYIWWRRGM-LBPRGKRZSA-N	1	1	271.368	2.293	40	0		CEABMO
CC(C)[N@@H+](C1CCCCC1)[C@@H]1CNCC[C@]1(C)O	ZINC000685936215	570388461	/nfs/dbraw/zinc/38/84/61/570388461.db2.gz	KQGQPKSUPVGZKW-CABCVRRESA-N	1	1	254.418	2.142	40	0		CEABMO
[NH3+][C@@H](c1nc(-c2ccco2)n[nH]1)c1ccc(F)cc1	ZINC000095533238	185005962	/nfs/dbraw/zinc/00/59/62/185005962.db2.gz	DXDMQVNUDHDTSJ-LLVKDONJSA-N	1	1	258.256	2.252	40	0		CEABMO
COC[C@@]12CCCO[C@H]1CC[N@@H+](Cc1ccoc1)C2	ZINC000096038972	185069276	/nfs/dbraw/zinc/06/92/76/185069276.db2.gz	RPAIPOFUMNRCFZ-GJZGRUSLSA-N	1	1	265.353	2.297	40	0		CEABMO
c1coc(CN2CC3(C2)CC[N@@H+](Cc2ccncc2)C3)c1	ZINC000096046425	185071638	/nfs/dbraw/zinc/07/16/38/185071638.db2.gz	CNLLBLBSJPVRCB-UHFFFAOYSA-N	1	1	283.375	2.383	40	0		CEABMO
Cc1nnc([C@@H]2C[C@H]3C[N@@H+](Cc4ccc(C)cc4)C[C@H]3O2)[nH]1	ZINC000096045875	185071811	/nfs/dbraw/zinc/07/18/11/185071811.db2.gz	CBISIMXLTWJMNE-HRCADAONSA-N	1	1	298.390	2.384	40	0		CEABMO
Cc1nc([C@@H]2C[C@H]3C[N@H+](Cc4ccc(C)cc4)C[C@H]3O2)n[nH]1	ZINC000096045875	185071812	/nfs/dbraw/zinc/07/18/12/185071812.db2.gz	CBISIMXLTWJMNE-HRCADAONSA-N	1	1	298.390	2.384	40	0		CEABMO
Cc1nc([C@@H]2C[C@H]3C[N@@H+](Cc4ccc(C)cc4)C[C@H]3O2)n[nH]1	ZINC000096045875	185071813	/nfs/dbraw/zinc/07/18/13/185071813.db2.gz	CBISIMXLTWJMNE-HRCADAONSA-N	1	1	298.390	2.384	40	0		CEABMO
c1cncc(O[C@@H]2CO[C@]3(C2)CCC[N@H+](CC2CC2)C3)c1	ZINC000096048281	185072495	/nfs/dbraw/zinc/07/24/95/185072495.db2.gz	ZBFMLLPEFXQEAR-IRXDYDNUSA-N	1	1	288.391	2.494	40	0		CEABMO
c1cc(CN2CCC3(C[C@@H]([NH+]4CCCC4)CO3)CC2)co1	ZINC000096047943	185073104	/nfs/dbraw/zinc/07/31/04/185073104.db2.gz	COYTVOBLSUOMBJ-MRXNPFEDSA-N	1	1	290.407	2.499	40	0		CEABMO
CN1C(=O)CCC[C@@]12CCC[N@@H+](Cc1ccco1)C2	ZINC000096049947	185074191	/nfs/dbraw/zinc/07/41/91/185074191.db2.gz	GGAZXMHGTBQHDT-HNNXBMFYSA-N	1	1	262.353	2.257	40	0		CEABMO
O=C1CC[C@@H]2[C@@H](CC[N@H+]2Cc2ccccn2)N1CC1CC1	ZINC000096056549	185077589	/nfs/dbraw/zinc/07/75/89/185077589.db2.gz	RJAJISDRUPJLMO-HZPDHXFCSA-N	1	1	285.391	2.057	40	0		CEABMO
COCc1cncc2c1CC[N@@H+](Cc1ccncc1)C2	ZINC000096059262	185078525	/nfs/dbraw/zinc/07/85/25/185078525.db2.gz	OUCYSONWAXWRAQ-UHFFFAOYSA-N	1	1	269.348	2.181	40	0		CEABMO
C(O[C@@H]1CC[C@H]2[C@H]1OCC[N@H+]2CC1CC1)C1CCOCC1	ZINC000096057949	185079295	/nfs/dbraw/zinc/07/92/95/185079295.db2.gz	RFTOJAIRTOXMAK-GVDBMIGSSA-N	1	1	295.423	2.071	40	0		CEABMO
COC[C@H]1C[N@@H+](CC2CC2)Cc2nn(CC3CC3)cc21	ZINC000096060465	185080080	/nfs/dbraw/zinc/08/00/80/185080080.db2.gz	XRHAUKRBIMBTAP-CQSZACIVSA-N	1	1	275.396	2.249	40	0		CEABMO
Cc1ccc(C[N@H+]2CC[C@@H](O)[C@@H]2Cc2cccnc2)o1	ZINC000096061602	185082606	/nfs/dbraw/zinc/08/26/06/185082606.db2.gz	RYIKOVHHJPAZBX-JKSUJKDBSA-N	1	1	272.348	2.161	40	0		CEABMO
CC(C)[N@H+]1CCC[C@@]2(CCN(Cc3ccncc3)C2=O)C1	ZINC000096074019	185088235	/nfs/dbraw/zinc/08/82/35/185088235.db2.gz	VHUSUEASKPTLBN-QGZVFWFLSA-N	1	1	287.407	2.305	40	0		CEABMO
Cc1ccc(C(=O)N2CC[C@@]3(CC[N@H+]3CC3CC3)C2)cn1	ZINC000096076002	185089696	/nfs/dbraw/zinc/08/96/96/185089696.db2.gz	SNTCGSQPTBGBHB-QGZVFWFLSA-N	1	1	285.391	2.090	40	0		CEABMO
COC[C@@H]1CCC[C@@]12C[N@H+](Cc1ccoc1)CCO2	ZINC000096110627	185100813	/nfs/dbraw/zinc/10/08/13/185100813.db2.gz	HRGGUTPYXWMBLC-LSDHHAIUSA-N	1	1	265.353	2.297	40	0		CEABMO
COC[C@@H]1CCC[C@@]12C[N@@H+](Cc1ccoc1)CCO2	ZINC000096110627	185100815	/nfs/dbraw/zinc/10/08/15/185100815.db2.gz	HRGGUTPYXWMBLC-LSDHHAIUSA-N	1	1	265.353	2.297	40	0		CEABMO
O=C1c2ccccc2C(=O)N1[C@H]1CCC[N@H+]2CCCC[C@H]12	ZINC000005776238	343355503	/nfs/dbraw/zinc/35/55/03/343355503.db2.gz	KNEGFGGZBIDYHX-CABCVRRESA-N	1	1	284.359	2.300	40	0		CEABMO
CCc1[nH+]ccn1CCCNC(=O)c1ccc(F)cc1	ZINC000010358468	343364574	/nfs/dbraw/zinc/36/45/74/343364574.db2.gz	VGNMYWFVJFYBSL-UHFFFAOYSA-N	1	1	275.327	2.405	40	0		CEABMO
CCCC[N@H+](Cc1ccccc1)[C@H]1CCS(=O)(=O)C1	ZINC000078681289	343961379	/nfs/dbraw/zinc/96/13/79/343961379.db2.gz	ZUEWJCBMLOCBFZ-HNNXBMFYSA-N	1	1	281.421	2.476	40	0		CEABMO
CCCC[N@@H+](Cc1ccccc1)[C@H]1CCS(=O)(=O)C1	ZINC000078681289	343961380	/nfs/dbraw/zinc/96/13/80/343961380.db2.gz	ZUEWJCBMLOCBFZ-HNNXBMFYSA-N	1	1	281.421	2.476	40	0		CEABMO
CC[NH+](CC)[C@@]1([C@@H](CN)CO)C[C@@H]2CC[C@@]1(C)C2(C)C	ZINC000216351226	344534872	/nfs/dbraw/zinc/53/48/72/344534872.db2.gz	MYMMFPISRPMSER-NXNVCVFFSA-N	1	1	282.472	2.480	40	0		CEABMO
CN(C(=O)OC(C)(C)C)[C@H](C(=[NH2+])NO)c1ccco1	ZINC000409438426	344889746	/nfs/dbraw/zinc/88/97/46/344889746.db2.gz	CODPRFCTOXCOBP-VIFPVBQESA-N	1	1	269.301	2.144	40	0		CEABMO
O=C([O-])C[N@@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)C1CC1	ZINC000079393451	363594012	/nfs/dbraw/zinc/59/40/12/363594012.db2.gz	NSEGXCOUTCRDLP-OAHLLOKOSA-N	1	1	288.391	2.058	40	0		CEABMO
O=C([O-])C[NH+](C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C1CC1	ZINC000079393451	363594014	/nfs/dbraw/zinc/59/40/14/363594014.db2.gz	NSEGXCOUTCRDLP-OAHLLOKOSA-N	1	1	288.391	2.058	40	0		CEABMO
O=C([O-])C[NH+](C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C1CC1	ZINC000079393451	363594016	/nfs/dbraw/zinc/59/40/16/363594016.db2.gz	NSEGXCOUTCRDLP-OAHLLOKOSA-N	1	1	288.391	2.058	40	0		CEABMO
COC(=O)[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1Cl	ZINC000242728145	540424246	/nfs/dbraw/zinc/42/42/46/540424246.db2.gz	YVCKOEIZBOKVIO-WDEREUQCSA-N	1	1	253.729	2.158	40	0		CEABMO
Cc1cccc(C)c1NC(=O)[C@H]1CCCC[N@@H+]1CCO	ZINC000004213063	361304979	/nfs/dbraw/zinc/30/49/79/361304979.db2.gz	NVASAXNGHUPVJX-CQSZACIVSA-N	1	1	276.380	2.089	40	0	in-man	CEABMO
Cc1cccc(C)c1NC(=O)[C@H]1CCCC[N@H+]1CCO	ZINC000004213063	361304982	/nfs/dbraw/zinc/30/49/82/361304982.db2.gz	NVASAXNGHUPVJX-CQSZACIVSA-N	1	1	276.380	2.089	40	0	in-man	CEABMO
O=C1NC2(CC[NH+](Cc3ccco3)CC2)Oc2ccccc21	ZINC000013566603	361432205	/nfs/dbraw/zinc/43/22/05/361432205.db2.gz	YGKHPFXNQPIKLL-UHFFFAOYSA-N	1	1	298.342	2.394	40	0		CEABMO
Cc1ccsc1C[N@@H+](Cc1cncn1C)C[C@H](C)O	ZINC000019238601	361523144	/nfs/dbraw/zinc/52/31/44/361523144.db2.gz	CDVNIQYBWRRTCK-LBPRGKRZSA-N	1	1	279.409	2.173	40	0		CEABMO
Cc1ccsc1C[N@H+](Cc1cncn1C)C[C@H](C)O	ZINC000019238601	361523151	/nfs/dbraw/zinc/52/31/51/361523151.db2.gz	CDVNIQYBWRRTCK-LBPRGKRZSA-N	1	1	279.409	2.173	40	0		CEABMO
Cc1cccc(C)c1OC[C@@H](O)C[NH+]1C[C@@H](C)O[C@H](C)C1	ZINC000019607352	361545522	/nfs/dbraw/zinc/54/55/22/361545522.db2.gz	MHADDIGFUZSSIJ-OAGGEKHMSA-N	1	1	293.407	2.152	40	0		CEABMO
CC[NH+]1CCN(C(=O)Cc2ccc(C)c(C)c2)CC1	ZINC000026114441	361635651	/nfs/dbraw/zinc/63/56/51/361635651.db2.gz	KJQFLOGJKUBKBT-UHFFFAOYSA-N	1	1	260.381	2.010	40	0		CEABMO
O=C(c1ccccc1)[C@@H]([NH2+]CCO)c1ccccc1	ZINC000031923931	361722692	/nfs/dbraw/zinc/72/26/92/361722692.db2.gz	KMVJBLJDQFGNPO-HNNXBMFYSA-N	1	1	255.317	2.193	40	0		CEABMO
c1cnc(N2CCC3(CCC[N@@H+]3CC3CC3)CC2)nc1	ZINC000096049302	364400646	/nfs/dbraw/zinc/40/06/46/364400646.db2.gz	NYEPUJBWVKOUIF-UHFFFAOYSA-N	1	1	272.396	2.321	40	0		CEABMO
CC[C@H](C)[N@@H+]1C[C@H]2CN(Cc3cccnc3)C[C@H]2C1	ZINC000096161504	364403236	/nfs/dbraw/zinc/40/32/36/364403236.db2.gz	ZSHXRWJNOGVFSR-CWRNSKLLSA-N	1	1	259.397	2.244	40	0		CEABMO
CC(C)[N@H+]1CCC2(C1)CCN(C(=O)c1cccnc1)CC2	ZINC000096157648	364403519	/nfs/dbraw/zinc/40/35/19/364403519.db2.gz	LAWARXCGMNWBDX-UHFFFAOYSA-N	1	1	287.407	2.418	40	0		CEABMO
Cc1ccc(OC[C@@H]2CO[C@@H]3C[N@H+](C4CCC4)C[C@H]23)cn1	ZINC000096215899	364412364	/nfs/dbraw/zinc/41/23/64/364412364.db2.gz	QLGLEMDBGNTKAH-KBRIMQKVSA-N	1	1	288.391	2.268	40	0		CEABMO
c1csc(C[N@@H+]2CCc3ncnc(C4CC4)c3CC2)n1	ZINC000096255073	364417900	/nfs/dbraw/zinc/41/79/00/364417900.db2.gz	ZDSWMBNSXCEVQP-UHFFFAOYSA-N	1	1	286.404	2.411	40	0		CEABMO
c1csc(C[N@H+]2CCc3ncnc(C4CC4)c3CC2)n1	ZINC000096255073	364417910	/nfs/dbraw/zinc/41/79/10/364417910.db2.gz	ZDSWMBNSXCEVQP-UHFFFAOYSA-N	1	1	286.404	2.411	40	0		CEABMO
COc1ncnc2c1CC[N@@H+](Cc1cccs1)CC2	ZINC000096255555	364418378	/nfs/dbraw/zinc/41/83/78/364418378.db2.gz	FGGYPWSKTGFJGJ-UHFFFAOYSA-N	1	1	275.377	2.148	40	0		CEABMO
Cc1nc(C)c2c(n1)CC[N@H+](Cc1cccnc1)CC2	ZINC000096254513	364418958	/nfs/dbraw/zinc/41/89/58/364418958.db2.gz	QVHHPCNDNXPNSH-UHFFFAOYSA-N	1	1	268.364	2.089	40	0		CEABMO
CC(=O)N1CCC[C@]2(C1)C[N@@H+](CC1CCCCC1)CCO2	ZINC000096268745	364420239	/nfs/dbraw/zinc/42/02/39/364420239.db2.gz	KOZMBNCTBCNIER-QGZVFWFLSA-N	1	1	294.439	2.280	40	0		CEABMO
c1ccc(C[C@@H]2C[N@H+](C3CCOCC3)CCO2)cc1	ZINC000161679540	367105107	/nfs/dbraw/zinc/10/51/07/367105107.db2.gz	OAUSKDBSWDQYQN-MRXNPFEDSA-N	1	1	261.365	2.109	40	0		CEABMO
COC(=O)[C@H]1C[N@@H+](C)C[C@@H]1c1ccc(Cl)cc1	ZINC000201757396	370151884	/nfs/dbraw/zinc/15/18/84/370151884.db2.gz	VXRLOWUNYIQIGZ-NEPJUHHUSA-N	1	1	253.729	2.158	40	0		CEABMO
CO[C@H]1CSC2(C[NH+](Cc3ccc(C)o3)C2)C1	ZINC000248063255	371158462	/nfs/dbraw/zinc/15/84/62/371158462.db2.gz	DLPHNIJPMGIBTP-GFCCVEGCSA-N	1	1	253.367	2.294	40	0		CEABMO
CCn1nc(C)c(C[NH2+]Cc2cnn(CC(C)C)c2)c1F	ZINC000256054130	190004819	/nfs/dbraw/zinc/00/48/19/190004819.db2.gz	VANZFXFUMCWQOB-UHFFFAOYSA-N	1	1	293.390	2.493	40	0		CEABMO
Cc1cc(C)nc([C@@H]2CC[N@@H+](CC3CCOCC3)C2)n1	ZINC000257225716	190015623	/nfs/dbraw/zinc/01/56/23/190015623.db2.gz	FHLCSSAPNALSLB-OAHLLOKOSA-N	1	1	275.396	2.309	40	0		CEABMO
CCN(CC)C(=O)c1cncc(C[C@H]2CCC[N@@H+](C)C2)c1	ZINC000257222121	190015039	/nfs/dbraw/zinc/01/50/39/190015039.db2.gz	DRZYPFNJTKQLKP-CQSZACIVSA-N	1	1	289.423	2.448	40	0		CEABMO
COc1cccc(C[N@H+]2CC[C@@H](c3cc[nH]n3)C2)c1OC	ZINC000257238492	190017865	/nfs/dbraw/zinc/01/78/65/190017865.db2.gz	HLFHISNGBQCFRY-GFCCVEGCSA-N	1	1	287.363	2.416	40	0		CEABMO
c1ncc(C[N@H+]2CCC[C@H](c3ccncn3)C2)s1	ZINC000257267880	190023357	/nfs/dbraw/zinc/02/33/57/190023357.db2.gz	MJEPKFLZEUHSHM-NSHDSACASA-N	1	1	260.366	2.313	40	0		CEABMO
CC(=O)NCc1cccc([C@H]2CCC[N@H+]2CC2CC2)n1	ZINC000257284588	190026324	/nfs/dbraw/zinc/02/63/24/190026324.db2.gz	PDGSDDXHJSPLNV-MRXNPFEDSA-N	1	1	273.380	2.265	40	0		CEABMO
Cc1c[nH]c([C@@H]2CC[N@@H+](Cc3ccc4c(c3)OCCO4)C2)n1	ZINC000257302312	190030625	/nfs/dbraw/zinc/03/06/25/190030625.db2.gz	SCLOOZZVXGRDNI-CQSZACIVSA-N	1	1	299.374	2.479	40	0		CEABMO
Cc1nccnc1CC[C@H]1COCC[N@H+]1C1CCCC1	ZINC000257311251	190032309	/nfs/dbraw/zinc/03/23/09/190032309.db2.gz	UIRQYHKKPBEYEY-HNNXBMFYSA-N	1	1	275.396	2.361	40	0		CEABMO
c1ccc(-c2ncnc3c2CC[N@@H+]([C@@H]2CCOC2)CC3)cc1	ZINC000096255374	256835563	/nfs/dbraw/zinc/83/55/63/256835563.db2.gz	BRSYLANQGCFRAR-OAHLLOKOSA-N	1	1	295.386	2.333	40	0		CEABMO
COc1ccc(CC[NH2+][C@@H]2CCCC[C@H]2N)cc1OC	ZINC000218854414	394457501	/nfs/dbraw/zinc/45/75/01/394457501.db2.gz	VYLYNSDJXFXCBX-ZIAGYGMSSA-N	1	1	278.396	2.106	40	0		CEABMO
CC(C)[N@H+]1CCC[C@@H]1c1cccnc1N1CCOCC1	ZINC000072216221	394592829	/nfs/dbraw/zinc/59/28/29/394592829.db2.gz	SJRBXFIGOABRLX-OAHLLOKOSA-N	1	1	275.396	2.464	40	0		CEABMO
CCOc1ccc([C@@H]([NH3+])c2nnc(C(C)C)[nH]2)cc1OC	ZINC000095534221	394673645	/nfs/dbraw/zinc/67/36/45/394673645.db2.gz	LBLRLGINSKOJIV-CYBMUJFWSA-N	1	1	290.367	2.384	40	0		CEABMO
CN(C)CC[N@H+]1CCCC12CCN(c1cccnc1)CC2	ZINC000096075239	394675440	/nfs/dbraw/zinc/67/54/40/394675440.db2.gz	GTFXSVKQIGRABI-UHFFFAOYSA-N	1	1	288.439	2.078	40	0		CEABMO
COC[C@@H]1C[N@H+](Cc2cccs2)Cc2cnn(C)c21	ZINC000096060003	394676145	/nfs/dbraw/zinc/67/61/45/394676145.db2.gz	XXSQANJEYINRAE-LBPRGKRZSA-N	1	1	277.393	2.227	40	0		CEABMO
COC[C@@H]1C[N@@H+](Cc2cccs2)Cc2cnn(C)c21	ZINC000096060003	394676148	/nfs/dbraw/zinc/67/61/48/394676148.db2.gz	XXSQANJEYINRAE-LBPRGKRZSA-N	1	1	277.393	2.227	40	0		CEABMO
Nc1cc(Cl)ccc1NC(=O)C[NH+]1CCCCC1	ZINC000008732433	170351681	/nfs/dbraw/zinc/35/16/81/170351681.db2.gz	BJPFMMXKCYEPAE-UHFFFAOYSA-N	1	1	267.760	2.347	40	0		CEABMO
Nc1ccc(C(=O)N2CC[NH+](Cc3ccccc3)CC2)cc1	ZINC000020193396	171059554	/nfs/dbraw/zinc/05/95/54/171059554.db2.gz	VKYBNVFDZNAUTC-UHFFFAOYSA-N	1	1	295.386	2.227	40	0		CEABMO
CCOc1cncc(N2CC[C@@]3(CCC[N@H+]3C)C2)c1	ZINC000044138530	175146305	/nfs/dbraw/zinc/14/63/05/175146305.db2.gz	HHNMXHMUQGXCJL-HNNXBMFYSA-N	1	1	261.369	2.155	40	0		CEABMO
Cc1[nH+]ccn1C[C@@H]1CCCN(C(=O)c2cncs2)C1	ZINC000072368383	176383308	/nfs/dbraw/zinc/38/33/08/176383308.db2.gz	KGIKGCOBOXUGPQ-LBPRGKRZSA-N	1	1	290.392	2.200	40	0		CEABMO
Cc1cc(C)nc(Nc2cncc([C@H]3CCC[N@@H+]3C)n2)n1	ZINC000072376200	176385295	/nfs/dbraw/zinc/38/52/95/176385295.db2.gz	BVORFYARVWWPOR-CYBMUJFWSA-N	1	1	284.367	2.394	40	0		CEABMO
C[N@H+]1CCCC[C@H]1c1ccnc(Nc2cnccn2)n1	ZINC000072377387	176385844	/nfs/dbraw/zinc/38/58/44/176385844.db2.gz	IJASLZUKUFLSCO-LBPRGKRZSA-N	1	1	270.340	2.167	40	0		CEABMO
C[N@H+]1CCC[C@H](c2cccc(NC3CCOCC3)n2)C1	ZINC000072386971	176392588	/nfs/dbraw/zinc/39/25/88/176392588.db2.gz	XUUMKHWIMUAXPE-ZDUSSCGKSA-N	1	1	275.396	2.482	40	0		CEABMO
Cc1nc[nH]c1C[NH+]1CCC(NC(=O)OC(C)(C)C)CC1	ZINC000665887185	419469524	/nfs/dbraw/zinc/46/95/24/419469524.db2.gz	FZMGITWDHXTWRQ-UHFFFAOYSA-N	1	1	294.399	2.207	40	0		CEABMO
CNC(=O)[C@@H]1CCC[N@@H+](Cc2ccc(Cl)cc2)C1	ZINC000028220868	277241634	/nfs/dbraw/zinc/24/16/34/277241634.db2.gz	KNYSEWHMZXNEQO-GFCCVEGCSA-N	1	1	266.772	2.298	40	0		CEABMO
Cn1cc(CN2CCC[C@]3(CC[N@@H+](CC4CC4)C3)C2)cn1	ZINC000096100149	279336151	/nfs/dbraw/zinc/33/61/51/279336151.db2.gz	ILIIEBSWRGWCIF-KRWDZBQOSA-N	1	1	288.439	2.118	40	0		CEABMO
C[C@H](CO)Nc1nc(N2CCc3ccccc3[C@H]2C)cc[nH+]1	ZINC000328982537	279360932	/nfs/dbraw/zinc/36/09/32/279360932.db2.gz	HBKRCAADMVSRQT-CHWSQXEVSA-N	1	1	298.390	2.393	40	0		CEABMO
Cc1nc2c(c(=O)[nH]1)C[N@H+](Cc1ccc(Cl)cc1)CC2	ZINC000012145333	282007460	/nfs/dbraw/zinc/00/74/60/282007460.db2.gz	VJWCOGMQFDCXLN-UHFFFAOYSA-N	1	1	289.766	2.290	40	0		CEABMO
Cc1nc2c(c(=O)[nH]1)C[N@@H+](Cc1ccc(Cl)cc1)CC2	ZINC000012145333	282007461	/nfs/dbraw/zinc/00/74/61/282007461.db2.gz	VJWCOGMQFDCXLN-UHFFFAOYSA-N	1	1	289.766	2.290	40	0		CEABMO
c1ccc(C[N@@H+]2C[C@H]3CN(c4cccnn4)C[C@H]3C2)cc1	ZINC000306842006	333010191	/nfs/dbraw/zinc/01/01/91/333010191.db2.gz	AZECRCPBZLVCQL-IYBDPMFKSA-N	1	1	280.375	2.045	40	0		CEABMO
C[C@@H](CCN1C[C@H]2C[C@@H](O)C[N@H+]2C[C@H]1C)c1ccccc1	ZINC000248241456	334297472	/nfs/dbraw/zinc/29/74/72/334297472.db2.gz	OQWLLWPCXDAZNO-BURFUSLBSA-N	1	1	288.435	2.320	40	0		CEABMO
C[C@@H](CC[N@@H+]1C[C@H]2C[C@@H](O)CN2C[C@H]1C)c1ccccc1	ZINC000248241456	334297473	/nfs/dbraw/zinc/29/74/73/334297473.db2.gz	OQWLLWPCXDAZNO-BURFUSLBSA-N	1	1	288.435	2.320	40	0		CEABMO
C[C@@H](CC[N@H+]1C[C@H]2C[C@@H](O)CN2C[C@H]1C)c1ccccc1	ZINC000248241456	334297474	/nfs/dbraw/zinc/29/74/74/334297474.db2.gz	OQWLLWPCXDAZNO-BURFUSLBSA-N	1	1	288.435	2.320	40	0		CEABMO
COc1ccc([C@@H]([NH3+])c2nc(-c3ccoc3C)n[nH]2)cc1	ZINC000095533678	185006221	/nfs/dbraw/zinc/00/62/21/185006221.db2.gz	NKOGKPHCOUJVMM-CYBMUJFWSA-N	1	1	284.319	2.430	40	0		CEABMO
CCN1C(=O)CC[C@]12CCC[N@@H+](Cc1cccnc1)CC2	ZINC000096047507	185072661	/nfs/dbraw/zinc/07/26/61/185072661.db2.gz	GHGNXBRVRWHBFS-KRWDZBQOSA-N	1	1	287.407	2.449	40	0		CEABMO
Cc1ccc(C[N@H+]2CCC[C@]3(CCC(=O)N3)CC2)o1	ZINC000096047447	185073255	/nfs/dbraw/zinc/07/32/55/185073255.db2.gz	AGJNDVKMEDECIK-HNNXBMFYSA-N	1	1	262.353	2.223	40	0		CEABMO
CC[C@@H]1[N@H+](Cc2nccs2)CCC[C@]12CCC(=O)N2	ZINC000096052394	185075085	/nfs/dbraw/zinc/07/50/85/185075085.db2.gz	YFQHRZUAJXPADS-FZMZJTMJSA-N	1	1	279.409	2.166	40	0		CEABMO
CC[C@@H]1[N@@H+](Cc2nccs2)CCC[C@]12CCC(=O)N2	ZINC000096052394	185075087	/nfs/dbraw/zinc/07/50/87/185075087.db2.gz	YFQHRZUAJXPADS-FZMZJTMJSA-N	1	1	279.409	2.166	40	0		CEABMO
C[NH+](C)C[C@@H]1OC[C@@H]2C[N@@H+](Cc3cccs3)CC[C@H]12	ZINC000096057579	185077889	/nfs/dbraw/zinc/07/78/89/185077889.db2.gz	QYTLMNQSZFILOU-QEJZJMRPSA-N	1	1	280.437	2.147	40	0		CEABMO
CCc1ncnc2c1CC[N@H+](Cc1nccs1)CC2	ZINC000096058605	185079469	/nfs/dbraw/zinc/07/94/69/185079469.db2.gz	PJXODESQGAUWAL-UHFFFAOYSA-N	1	1	274.393	2.096	40	0		CEABMO
CCc1ncnc2c1CC[N@@H+](Cc1nccs1)CC2	ZINC000096058605	185079470	/nfs/dbraw/zinc/07/94/70/185079470.db2.gz	PJXODESQGAUWAL-UHFFFAOYSA-N	1	1	274.393	2.096	40	0		CEABMO
O=C1C[C@H]2[C@@H](CC[N@H+]2Cc2ccco2)N1Cc1cccnc1	ZINC000096063866	185083926	/nfs/dbraw/zinc/08/39/26/185083926.db2.gz	NFCFDGDBUCPOQP-CVEARBPZSA-N	1	1	297.358	2.050	40	0		CEABMO
O=C(N1CC2(C1)CC[N@@H+](Cc1ccoc1)C2)N1CCCC1	ZINC000096070923	185086430	/nfs/dbraw/zinc/08/64/30/185086430.db2.gz	MOGRSHOKARCDMD-UHFFFAOYSA-N	1	1	289.379	2.003	40	0		CEABMO
CCN1C(=O)CC[C@]12CCC[N@@H+](Cc1ccccn1)C2	ZINC000096071171	185087267	/nfs/dbraw/zinc/08/72/67/185087267.db2.gz	RYTDSRPHSIOJQP-INIZCTEOSA-N	1	1	273.380	2.059	40	0		CEABMO
CN1CC[C@]2(CCC[N@@H+](Cc3cccs3)C2)C1=O	ZINC000096073922	185087965	/nfs/dbraw/zinc/08/79/65/185087965.db2.gz	USHQMXXIUJFMBS-AWEZNQCLSA-N	1	1	264.394	2.192	40	0		CEABMO
COC[C@@H]1COCCC12CC[NH+](Cc1nccs1)CC2	ZINC000096106254	185099039	/nfs/dbraw/zinc/09/90/39/185099039.db2.gz	XMLWOCNOCYRAIZ-CYBMUJFWSA-N	1	1	296.436	2.408	40	0		CEABMO
C[N@H+]1CCC2(C1)CCN(C(=O)Cc1ccccc1)CC2	ZINC000063527654	362768887	/nfs/dbraw/zinc/76/88/87/362768887.db2.gz	OHIBOZRUUXRBRU-UHFFFAOYSA-N	1	1	272.392	2.173	40	0		CEABMO
CCOC(=O)c1ccccc1NC(=O)[C@@H]1CCC[N@@H+](C)C1	ZINC000073381373	363215135	/nfs/dbraw/zinc/21/51/35/363215135.db2.gz	RZDPTCZYEIQELI-GFCCVEGCSA-N	1	1	290.363	2.144	40	0		CEABMO
CC[N@@H+](CCO)C[C@@H]1CCCCN1Cc1ccccc1	ZINC000079393517	363593476	/nfs/dbraw/zinc/59/34/76/363593476.db2.gz	MTUJIOUUKYCJHE-KRWDZBQOSA-N	1	1	276.424	2.355	40	0		CEABMO
CCN(CCO)C[C@@H]1CCCC[N@@H+]1Cc1ccccc1	ZINC000079393517	363593481	/nfs/dbraw/zinc/59/34/81/363593481.db2.gz	MTUJIOUUKYCJHE-KRWDZBQOSA-N	1	1	276.424	2.355	40	0		CEABMO
CCN(CCO)C[C@@H]1CCCC[N@H+]1Cc1ccccc1	ZINC000079393517	363593485	/nfs/dbraw/zinc/59/34/85/363593485.db2.gz	MTUJIOUUKYCJHE-KRWDZBQOSA-N	1	1	276.424	2.355	40	0		CEABMO
OCC[N@H+](C[C@H]1CCCN(Cc2ccccc2)C1)C1CC1	ZINC000079393553	363593625	/nfs/dbraw/zinc/59/36/25/363593625.db2.gz	CXELYOQSQLGQQG-KRWDZBQOSA-N	1	1	288.435	2.355	40	0		CEABMO
OCC[N@@H+](C[C@H]1CCCN(Cc2ccccc2)C1)C1CC1	ZINC000079393553	363593629	/nfs/dbraw/zinc/59/36/29/363593629.db2.gz	CXELYOQSQLGQQG-KRWDZBQOSA-N	1	1	288.435	2.355	40	0		CEABMO
CC[N@H+](Cc1ccccc1)C[C@@H]1CCCN(CCO)C1	ZINC000079414227	363597286	/nfs/dbraw/zinc/59/72/86/363597286.db2.gz	ICHYVSCXFWXEHL-KRWDZBQOSA-N	1	1	276.424	2.213	40	0		CEABMO
COc1ccc(C)cc1NC(=O)[C@@H]1CCC[N@@H+](C)C1	ZINC000082326190	363765127	/nfs/dbraw/zinc/76/51/27/363765127.db2.gz	NOMUHRXMJSXSEN-GFCCVEGCSA-N	1	1	262.353	2.284	40	0		CEABMO
O[C@@H](COc1ccccc1)C[N@H+]1CC[C@@H]2C=CC=C[C@@H]2C1	ZINC000026531221	361643513	/nfs/dbraw/zinc/64/35/13/361643513.db2.gz	HSIIBDBKJDPQQR-GVDBMIGSSA-N	1	1	285.387	2.490	40	0		CEABMO
C[C@@H]([NH3+])c1nc(-c2ccc(OC(F)F)cc2)no1	ZINC000089262333	363951501	/nfs/dbraw/zinc/95/15/01/363951501.db2.gz	SYUZYSFMMRMWRU-ZCFIWIBFSA-N	1	1	255.224	2.358	40	0		CEABMO
CC[N@H+]1CCC[C@@H](n2ncc3cnc(Cl)nc32)C1	ZINC000095097373	364340172	/nfs/dbraw/zinc/34/01/72/364340172.db2.gz	SBTACHXIMUIIKD-SNVBAGLBSA-N	1	1	265.748	2.137	40	0		CEABMO
O=C(Cc1ccsc1)N1CC[C@H]2[C@H]1CC[N@H+]2CC1CC1	ZINC000096184418	364407222	/nfs/dbraw/zinc/40/72/22/364407222.db2.gz	XPKGKPQQWAJYGZ-LSDHHAIUSA-N	1	1	290.432	2.376	40	0		CEABMO
CO[C@@H]1CC[N@@H+](Cc2ccsc2)[C@H]1Cc1cnn(C)c1	ZINC000096200189	364408812	/nfs/dbraw/zinc/40/88/12/364408812.db2.gz	CWZKEVZDYHJFHB-LSDHHAIUSA-N	1	1	291.420	2.314	40	0		CEABMO
COC[C@H]1C[N@@H+](C)C[C@@]12CCN(Cc1ccccc1F)C2	ZINC000096216774	364412138	/nfs/dbraw/zinc/41/21/38/364412138.db2.gz	ISSNBVRGKYBSCA-NVXWUHKLSA-N	1	1	292.398	2.226	40	0		CEABMO
O=C([C@H]1CCCO1)N1CCC2(CCC[N@H+]2CC2CC2)CC1	ZINC000096227893	364414307	/nfs/dbraw/zinc/41/43/07/364414307.db2.gz	RVGCVEUINIQISH-OAHLLOKOSA-N	1	1	292.423	2.032	40	0		CEABMO
CN(C)C(=O)N1CC[C@@]2(c3ccccc3)CC[N@@H+](C)[C@H]2C1	ZINC000096251829	364415907	/nfs/dbraw/zinc/41/59/07/364415907.db2.gz	PXSZZMGCICPJRP-DOTOQJQBSA-N	1	1	287.407	2.016	40	0		CEABMO
C[N@H+]1CCCCC12CCN(C(=O)c1ccccn1)CC2	ZINC000096239829	364416233	/nfs/dbraw/zinc/41/62/33/364416233.db2.gz	VRZZWEUUZHGLGC-UHFFFAOYSA-N	1	1	273.380	2.172	40	0		CEABMO
Cc1cccc(C[N@H+]2CC[C@@]3(C2)c2ccccc2NC3=O)n1	ZINC000096244785	364416884	/nfs/dbraw/zinc/41/68/84/364416884.db2.gz	HJPPPKVWQCLCGQ-GOSISDBHSA-N	1	1	293.370	2.486	40	0		CEABMO
COc1cc(C(=O)O[C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)ccc1O	ZINC000100375730	364544583	/nfs/dbraw/zinc/54/45/83/364544583.db2.gz	OZKTVDIYALBSMA-ITGUQSILSA-N	1	1	291.347	2.183	40	0	in-vitro	CEABMO
CCNC(=O)c1cc(N)ccc1[NH+]1CCCCCC1	ZINC000225486104	370297856	/nfs/dbraw/zinc/29/78/56/370297856.db2.gz	BMGBYVVJNKRCAR-UHFFFAOYSA-N	1	1	261.369	2.399	40	0		CEABMO
CO[C@@H]1CSC2(C[NH+](Cc3ccc(C)o3)C2)C1	ZINC000248063261	371158558	/nfs/dbraw/zinc/15/85/58/371158558.db2.gz	DLPHNIJPMGIBTP-LBPRGKRZSA-N	1	1	253.367	2.294	40	0		CEABMO
CCC[N@H+]1CC[C@]2(C[C@H]2C(=O)N(C)Cc2ccccn2)C1	ZINC000248115900	371161888	/nfs/dbraw/zinc/16/18/88/371161888.db2.gz	LKCKXOLVHVLMBV-RDJZCZTQSA-N	1	1	287.407	2.162	40	0		CEABMO
c1cc2ccnc(CC3C[NH+](Cc4cncnc4)C3)c2[nH]1	ZINC000257204880	190011580	/nfs/dbraw/zinc/01/15/80/190011580.db2.gz	AWRNLDHYAUPJOT-UHFFFAOYSA-N	1	1	279.347	2.027	40	0		CEABMO
CO[C@H]1C[N@@H+](CCOc2ccccc2)CC[C@@]12CCCO2	ZINC000257216131	190014291	/nfs/dbraw/zinc/01/42/91/190014291.db2.gz	CTFODRUPGGNSED-IRXDYDNUSA-N	1	1	291.391	2.335	40	0		CEABMO
Cn1cccc1C[N@H+]1CCC[C@H](Cc2cc[nH]n2)C1	ZINC000257250979	190020308	/nfs/dbraw/zinc/02/03/08/190020308.db2.gz	JOVDRASFPWWZDJ-CYBMUJFWSA-N	1	1	258.369	2.203	40	0		CEABMO
Cn1cccc1C[N@@H+]1CCC[C@H](Cc2ccn[nH]2)C1	ZINC000257250979	190020309	/nfs/dbraw/zinc/02/03/09/190020309.db2.gz	JOVDRASFPWWZDJ-CYBMUJFWSA-N	1	1	258.369	2.203	40	0		CEABMO
Cn1cccc1C[N@H+]1CCC[C@H](Cc2ccn[nH]2)C1	ZINC000257250979	190020310	/nfs/dbraw/zinc/02/03/10/190020310.db2.gz	JOVDRASFPWWZDJ-CYBMUJFWSA-N	1	1	258.369	2.203	40	0		CEABMO
CCOCC[N@H+]1CC[C@H](O)[C@@H](Oc2ccc(F)cc2)CC1	ZINC000257258986	190021719	/nfs/dbraw/zinc/02/17/19/190021719.db2.gz	KWJGVCYGUOBZLZ-HOTGVXAUSA-N	1	1	297.370	2.066	40	0		CEABMO
CC(C)[N@H+]1CCC[C@H](c2cncc(N3CCOC3=O)n2)C1	ZINC000257263102	190022255	/nfs/dbraw/zinc/02/22/55/190022255.db2.gz	LOJOGOHTWCXGJK-LBPRGKRZSA-N	1	1	290.367	2.021	40	0		CEABMO
Cc1cc(C[N@@H+]2CCC[C@@H](c3n[nH]cc3C)C2)no1	ZINC000257288387	190027274	/nfs/dbraw/zinc/02/72/74/190027274.db2.gz	PTZZVQZLGLBECZ-GFCCVEGCSA-N	1	1	260.341	2.394	40	0		CEABMO
Cc1cc(C[N@H+]2CCC[C@@H](c3n[nH]cc3C)C2)no1	ZINC000257288387	190027275	/nfs/dbraw/zinc/02/72/75/190027275.db2.gz	PTZZVQZLGLBECZ-GFCCVEGCSA-N	1	1	260.341	2.394	40	0		CEABMO
CNc1cc([C@@H]2CCC[N@H+](Cc3nccn3C)C2)ccn1	ZINC000257296091	190028703	/nfs/dbraw/zinc/02/87/03/190028703.db2.gz	RBEMAZTVVMMVIQ-CQSZACIVSA-N	1	1	285.395	2.236	40	0		CEABMO
CNc1cc([C@@H]2CCC[N@@H+](Cc3nccn3C)C2)ccn1	ZINC000257296091	190028704	/nfs/dbraw/zinc/02/87/04/190028704.db2.gz	RBEMAZTVVMMVIQ-CQSZACIVSA-N	1	1	285.395	2.236	40	0		CEABMO
C[N@@H+]1CCN(C(=O)Cc2cccnc2)C[C@H]1c1ccccc1	ZINC000257316102	190032630	/nfs/dbraw/zinc/03/26/30/190032630.db2.gz	VEDITLYHXURDFC-KRWDZBQOSA-N	1	1	295.386	2.139	40	0		CEABMO
C[N@H+]1CCN(C(=O)Cc2cccnc2)C[C@H]1c1ccccc1	ZINC000257316102	190032631	/nfs/dbraw/zinc/03/26/31/190032631.db2.gz	VEDITLYHXURDFC-KRWDZBQOSA-N	1	1	295.386	2.139	40	0		CEABMO
C[N@H+]1C[C@@H](c2ccccc2F)[C@]2(C1)CCCCC(=O)N2	ZINC000257320313	190033642	/nfs/dbraw/zinc/03/36/42/190033642.db2.gz	VWFDFBQCWGKOKE-XJKSGUPXSA-N	1	1	276.355	2.284	40	0		CEABMO
CC(=O)N1CC[N@@H+](CC2CC2)[C@@H](c2ccccc2)C1	ZINC000257338388	190036370	/nfs/dbraw/zinc/03/63/70/190036370.db2.gz	YXDJWAGKOUHAJQ-MRXNPFEDSA-N	1	1	258.365	2.302	40	0		CEABMO
COc1ccc(OC[C@@H](O)C[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1	ZINC000033542066	394492399	/nfs/dbraw/zinc/49/23/99/394492399.db2.gz	RHMRQCVSUOJGHE-ZNMIVQPWSA-N	1	1	293.407	2.413	40	0		CEABMO
CC[N@H+]1CCC[C@H]1c1ccc(N2CCOCC2)nc1C	ZINC000072219617	394594255	/nfs/dbraw/zinc/59/42/55/394594255.db2.gz	UCVIXKWXANQIQC-HNNXBMFYSA-N	1	1	275.396	2.383	40	0		CEABMO
[NH3+][C@H]1C(=O)N(Cc2ccc(F)cc2)[C@H]1c1cccs1	ZINC000072228189	394596185	/nfs/dbraw/zinc/59/61/85/394596185.db2.gz	DLWZEQFIBPOGAK-OLZOCXBDSA-N	1	1	276.336	2.298	40	0		CEABMO
COc1cccc([C@H]2[C@H]([NH3+])C(=O)N2c2ccc(C)cc2)c1	ZINC000072227459	394596332	/nfs/dbraw/zinc/59/63/32/394596332.db2.gz	DLDMZBPFWPHYBU-HOTGVXAUSA-N	1	1	282.343	2.419	40	0		CEABMO
COc1cccc(N2C(=O)[C@H]([NH3+])[C@H]2c2ccccc2F)c1	ZINC000072227760	394596594	/nfs/dbraw/zinc/59/65/94/394596594.db2.gz	WLKLXUJSOBBTIW-HUUCEWRRSA-N	1	1	286.306	2.250	40	0		CEABMO
Cc1cc(N2CCCC2)nc([C@@H]2CCC[N@H+](C)C2)n1	ZINC000072364624	394598520	/nfs/dbraw/zinc/59/85/20/394598520.db2.gz	ALHWBULBEGQOTD-CYBMUJFWSA-N	1	1	260.385	2.194	40	0		CEABMO
COc1ccc2c3c1O[C@@H]1C[C@@H](O)C=C(CC[N@H+](C)C2)[C@@H]31	ZINC000085224988	394642608	/nfs/dbraw/zinc/64/26/08/394642608.db2.gz	FFQKTDKDUHFQKE-NWANDNLSSA-N	1	1	287.359	2.066	40	0		CEABMO
CCOC(=O)c1cnn(C)c1C[N@@H+]1CCCC[C@@H]1CC	ZINC000132199190	394926275	/nfs/dbraw/zinc/92/62/75/394926275.db2.gz	NMEFRUBPFXCZIP-LBPRGKRZSA-N	1	1	279.384	2.361	40	0		CEABMO
CCOC(=O)c1cnn(C)c1C[N@H+]1CCCC[C@@H]1CC	ZINC000132199190	394926276	/nfs/dbraw/zinc/92/62/76/394926276.db2.gz	NMEFRUBPFXCZIP-LBPRGKRZSA-N	1	1	279.384	2.361	40	0		CEABMO
C[N@H+]1C[C@H](CO)[C@H](c2cccc(Br)c2)C1	ZINC000217673368	400307862	/nfs/dbraw/zinc/30/78/62/400307862.db2.gz	UOALQWUFZSXGPE-PWSUYJOCSA-N	1	1	270.170	2.087	40	0		CEABMO
CCc1ccc(CCC(=O)N2CC[NH+](CC)CC2)cc1	ZINC000025778589	171466006	/nfs/dbraw/zinc/46/60/06/171466006.db2.gz	ICCMAUSQYRLLLQ-UHFFFAOYSA-N	1	1	274.408	2.346	40	0		CEABMO
CCc1nccn1-c1nccnc1[C@@H]1CCC[N@@H+](C)C1	ZINC000072350495	176373807	/nfs/dbraw/zinc/37/38/07/176373807.db2.gz	FFTLGYUFGDLTDH-GFCCVEGCSA-N	1	1	271.368	2.034	40	0		CEABMO
Cc1nc([C@H]2CCC[N@H+](C(C)C)C2)ncc1C(=O)N(C)C	ZINC000072352005	176374267	/nfs/dbraw/zinc/37/42/67/176374267.db2.gz	HMGITVOGNNLUPS-ZDUSSCGKSA-N	1	1	290.411	2.075	40	0		CEABMO
CCCNC(=O)c1cncc(C[C@H]2CCC[N@@H+](C)C2)c1	ZINC000072369330	176383905	/nfs/dbraw/zinc/38/39/05/176383905.db2.gz	QHYKUTGPWWJLBK-CYBMUJFWSA-N	1	1	275.396	2.106	40	0		CEABMO
COc1ccc2c(C[N@H+]3CCC[C@@H](O)C3)cn(C)c2c1	ZINC000072397837	176395743	/nfs/dbraw/zinc/39/57/43/176395743.db2.gz	GNRTYECGJXQSPO-CYBMUJFWSA-N	1	1	274.364	2.144	40	0		CEABMO
COc1ccccc1[C@@H]1C[N@H+](C2CCOCC2)CCN1C	ZINC000257300780	278060711	/nfs/dbraw/zinc/06/07/11/278060711.db2.gz	RVQPZGCJSLNRQP-INIZCTEOSA-N	1	1	290.407	2.163	40	0		CEABMO
COc1ccc(Br)cc1C[N@@H+]1CC[C@H](O)C1	ZINC000061708162	523496284	/nfs/dbraw/zinc/49/62/84/523496284.db2.gz	JFQMDGKJTRAPMQ-NSHDSACASA-N	1	1	286.169	2.024	40	0		CEABMO
COc1ccc(Br)cc1C[N@H+]1CC[C@H](O)C1	ZINC000061708162	523496297	/nfs/dbraw/zinc/49/62/97/523496297.db2.gz	JFQMDGKJTRAPMQ-NSHDSACASA-N	1	1	286.169	2.024	40	0		CEABMO
CC(C)[N@@H+](C1CCCCC1)[C@H]1CNCC[C@]1(C)O	ZINC000685936216	570388487	/nfs/dbraw/zinc/38/84/87/570388487.db2.gz	KQGQPKSUPVGZKW-GJZGRUSLSA-N	1	1	254.418	2.142	40	0		CEABMO
COC[C@]12CCCO[C@H]1CC[N@@H+](Cc1cccc(C)n1)C2	ZINC000096038997	185069032	/nfs/dbraw/zinc/06/90/32/185069032.db2.gz	HHSVDHNVSJBKDN-DLBZAZTESA-N	1	1	290.407	2.408	40	0		CEABMO
c1ccc(COC[C@@H]2[NH2+]CCc3c2nnn3CC2CC2)cc1	ZINC000096045425	185072015	/nfs/dbraw/zinc/07/20/15/185072015.db2.gz	WGBJRDKPXGBEAF-HNNXBMFYSA-N	1	1	298.390	2.092	40	0		CEABMO
CN1C(=O)CCC[C@@]12CCC[N@@H+](Cc1cccnc1)C2	ZINC000096049969	185073900	/nfs/dbraw/zinc/07/39/00/185073900.db2.gz	LJXJXJRYWSAPDB-INIZCTEOSA-N	1	1	273.380	2.059	40	0		CEABMO
CCOC[C@@H]1CCC[C@@]12C[N@H+](Cc1ccccn1)CCO2	ZINC000096051874	185074462	/nfs/dbraw/zinc/07/44/62/185074462.db2.gz	CHPBYPAPZPIFSO-DOTOQJQBSA-N	1	1	290.407	2.489	40	0		CEABMO
CCOC[C@@H]1CCC[C@@]12C[N@@H+](Cc1ccccn1)CCO2	ZINC000096051874	185074464	/nfs/dbraw/zinc/07/44/64/185074464.db2.gz	CHPBYPAPZPIFSO-DOTOQJQBSA-N	1	1	290.407	2.489	40	0		CEABMO
Cc1noc(C)c1CN1C[C@H]2C[C@@H](C1)[N@@H+](CC1CC1)C2	ZINC000096058497	185079395	/nfs/dbraw/zinc/07/93/95/185079395.db2.gz	GBVBGEPXUKJFSN-CABCVRRESA-N	1	1	275.396	2.208	40	0		CEABMO
CC(C)[N@@H+](C)Cc1cnc2n1CCN(Cc1ccccn1)C2	ZINC000096061777	185082337	/nfs/dbraw/zinc/08/23/37/185082337.db2.gz	ALLOIIDKHQXXHS-UHFFFAOYSA-N	1	1	299.422	2.134	40	0		CEABMO
O=C(c1cccnc1)N1C[C@@H]2C[N@H+](CC3CCCC3)C[C@@H]2C1	ZINC000096063675	185084642	/nfs/dbraw/zinc/08/46/42/185084642.db2.gz	MJQUXFVLJQAUSY-CALCHBBNSA-N	1	1	299.418	2.276	40	0		CEABMO
C[N@H+]1CCOC[C@@]2(CCCN(C(=O)CC3CCCC3)C2)C1	ZINC000096076210	185089457	/nfs/dbraw/zinc/08/94/57/185089457.db2.gz	DEZZJVDSTPJPQM-KRWDZBQOSA-N	1	1	294.439	2.138	40	0		CEABMO
CCNc1ncc(C[NH2+]Cc2nc3ccccc3[nH]2)cn1	ZINC000062718435	343672619	/nfs/dbraw/zinc/67/26/19/343672619.db2.gz	CGRDXERRPREXTD-UHFFFAOYSA-N	1	1	282.351	2.075	40	0		CEABMO
CC(C)[NH+]1CC2(C1)C[C@H](Oc1ncccc1F)CCO2	ZINC000585104472	345006028	/nfs/dbraw/zinc/00/60/28/345006028.db2.gz	IYXUNATXTLXGLT-GFCCVEGCSA-N	1	1	280.343	2.241	40	0		CEABMO
O[C@]1(COc2ccccc2)CC[N@@H+](Cc2ccccn2)C1	ZINC000585269478	345009244	/nfs/dbraw/zinc/00/92/44/345009244.db2.gz	VZLLOUVYYQXOKJ-QGZVFWFLSA-N	1	1	284.359	2.097	40	0		CEABMO
COc1ccc(C[C@@H]([NH3+])C(=O)OCc2ccccc2)cc1	ZINC000001594229	538735849	/nfs/dbraw/zinc/73/58/49/538735849.db2.gz	JYRNVSKKZGIZOA-MRXNPFEDSA-N	1	1	285.343	2.308	40	0		CEABMO
[NH3+]CC(=O)c1cc(Cl)c(Br)cc1F	ZINC000097447177	283421296	/nfs/dbraw/zinc/42/12/96/283421296.db2.gz	RYMZHHDGWKUPTO-UHFFFAOYSA-N	1	1	266.497	2.383	40	0		CEABMO
CC[N@H+]1C[C@@H]2CCC[C@@]3(C1)C(=O)NC1(CCCCC1)N=C23	ZINC000002700779	361245041	/nfs/dbraw/zinc/24/50/41/361245041.db2.gz	ICFQVBLKMFUCBQ-BBRMVZONSA-N	1	1	289.423	2.340	40	0		CEABMO
CNC(=S)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2CC(C)C	ZINC000008577831	361343718	/nfs/dbraw/zinc/34/37/18/361343718.db2.gz	HHZGAMUEDOQGOH-YHWZYXNKSA-N	1	1	269.458	2.122	40	0		CEABMO
OC1CC[NH+](Cc2ccc(Sc3ncccn3)o2)CC1	ZINC000012146533	361374281	/nfs/dbraw/zinc/37/42/81/361374281.db2.gz	ABXMCXUFDDOUSL-UHFFFAOYSA-N	1	1	291.376	2.178	40	0		CEABMO
COC(=O)[C@@H](c1ccccc1)[C@]1(O)C[C@@H](C)[N@@H+](C)C[C@@H]1C	ZINC000013122903	361419727	/nfs/dbraw/zinc/41/97/27/361419727.db2.gz	XGFOAXWEGYBKCA-SHFYGJNESA-N	1	1	291.391	2.034	40	0		CEABMO
COc1ccccc1C[N@H+]1CC[C@H](c2cc(=O)[nH]c(C)n2)C1	ZINC000019285276	361526430	/nfs/dbraw/zinc/52/64/30/361526430.db2.gz	ZADOTEKMGLFTIQ-ZDUSSCGKSA-N	1	1	299.374	2.076	40	0		CEABMO
O=C(c1ccoc1)N1CC[C@H]2[C@H]1CC[N@@H+]2Cc1cccnc1	ZINC000096184645	364407161	/nfs/dbraw/zinc/40/71/61/364407161.db2.gz	FEFIAEIXPDCWHO-JKSUJKDBSA-N	1	1	297.358	2.164	40	0		CEABMO
O=C(c1ccoc1)N1CC[C@H]2[C@H]1CC[N@H+]2Cc1cccnc1	ZINC000096184645	364407165	/nfs/dbraw/zinc/40/71/65/364407165.db2.gz	FEFIAEIXPDCWHO-JKSUJKDBSA-N	1	1	297.358	2.164	40	0		CEABMO
CC(C)[N@@H+](C)Cc1cn2c(n1)CN(Cc1ccoc1)CC2	ZINC000096197199	364409090	/nfs/dbraw/zinc/40/90/90/364409090.db2.gz	NICQYGPHGUHPAO-UHFFFAOYSA-N	1	1	288.395	2.332	40	0		CEABMO
c1cc(C[N@@H+]2CC[C@]3(C[C@H](OCC4CC4)CO3)C2)ccn1	ZINC000096218375	364413266	/nfs/dbraw/zinc/41/32/66/364413266.db2.gz	HYDQXXYKNSXRQR-IRXDYDNUSA-N	1	1	288.391	2.242	40	0		CEABMO
CN(C)c1ncnc2c1CC[N@@H+](CC1CCCC1)CC2	ZINC000096255414	364419030	/nfs/dbraw/zinc/41/90/30/364419030.db2.gz	UWECUJRVQHPQFZ-UHFFFAOYSA-N	1	1	274.412	2.133	40	0		CEABMO
CCCn1nccc1C[NH2+]Cc1c(C)cnn1CC	ZINC000256055157	190005232	/nfs/dbraw/zinc/00/52/32/190005232.db2.gz	ZLQGYZFAOBIBEX-UHFFFAOYSA-N	1	1	261.373	2.108	40	0		CEABMO
CCn1cc(C[NH2+]Cc2ccnn2CC(C)C)cn1	ZINC000256054318	190005319	/nfs/dbraw/zinc/00/53/19/190005319.db2.gz	VVYOZMLRZHFLHE-UHFFFAOYSA-N	1	1	261.373	2.045	40	0		CEABMO
CCCn1nccc1C[NH2+]Cc1ccnn1C(C)C	ZINC000256050346	190002933	/nfs/dbraw/zinc/00/29/33/190002933.db2.gz	DRWXTMQNFVHLDY-UHFFFAOYSA-N	1	1	261.373	2.360	40	0		CEABMO
CC[C@@H](C)n1nccc1C[NH2+]Cc1cnn(CCF)c1	ZINC000256050235	190003287	/nfs/dbraw/zinc/00/32/87/190003287.db2.gz	DGOZNJXAOWKUGQ-GFCCVEGCSA-N	1	1	279.363	2.310	40	0		CEABMO
FC(F)Cn1ccc(C[NH2+]Cc2cccs2)n1	ZINC000256052530	190004138	/nfs/dbraw/zinc/00/41/38/190004138.db2.gz	NSBSVBRPGDMIPY-UHFFFAOYSA-N	1	1	257.309	2.500	40	0		CEABMO
CC(C)n1nccc1C[NH2+]Cc1cnn(CC(F)F)c1	ZINC000256052846	190004227	/nfs/dbraw/zinc/00/42/27/190004227.db2.gz	OWSNHIOMOQLALS-UHFFFAOYSA-N	1	1	283.326	2.215	40	0		CEABMO
COc1cccc(C[NH2+]Cc2ccn(CCF)n2)c1	ZINC000256052724	190004272	/nfs/dbraw/zinc/00/42/72/190004272.db2.gz	OKEKWKUCEKPNSV-UHFFFAOYSA-N	1	1	263.316	2.151	40	0		CEABMO
CNc1cc([C@H]2CCC[N@@H+]2Cc2cncn2C)ccn1	ZINC000257200220	190010609	/nfs/dbraw/zinc/01/06/09/190010609.db2.gz	ACMFNHVFUPHFMA-CQSZACIVSA-N	1	1	271.368	2.194	40	0		CEABMO
CNc1cc([C@H]2CCC[N@H+]2Cc2cncn2C)ccn1	ZINC000257200220	190010610	/nfs/dbraw/zinc/01/06/10/190010610.db2.gz	ACMFNHVFUPHFMA-CQSZACIVSA-N	1	1	271.368	2.194	40	0		CEABMO
CO[C@H]1CCCOC12CC[NH+](Cc1ncccc1F)CC2	ZINC000257208699	190011968	/nfs/dbraw/zinc/01/19/68/190011968.db2.gz	BNHCSHCXJABMBR-HNNXBMFYSA-N	1	1	294.370	2.381	40	0		CEABMO
c1cncc(C[N@H+]2CCC3(CC(Nc4ccncn4)C3)C2)c1	ZINC000257214502	190013283	/nfs/dbraw/zinc/01/32/83/190013283.db2.gz	CMFGJCVQJKQYJC-UHFFFAOYSA-N	1	1	295.390	2.338	40	0		CEABMO
CNc1ncccc1C[N@H+]1CCC[C@H](Cc2cc[nH]n2)C1	ZINC000257216164	190013863	/nfs/dbraw/zinc/01/38/63/190013863.db2.gz	CTKRMWAWFLTGDQ-CYBMUJFWSA-N	1	1	285.395	2.301	40	0		CEABMO
CC(C)CNC(=O)c1cc([C@H]2CCC[N@H+]2C)ccn1	ZINC000257254031	190020710	/nfs/dbraw/zinc/02/07/10/190020710.db2.gz	KBHCSBFCSDZVPK-CQSZACIVSA-N	1	1	261.369	2.234	40	0		CEABMO
CC(C)[N@H+]1CCC[C@@H](c2nccnc2-c2cc[nH]n2)C1	ZINC000257243875	190018894	/nfs/dbraw/zinc/01/88/94/190018894.db2.gz	IIYJAMZHHXHNQK-GFCCVEGCSA-N	1	1	271.368	2.455	40	0		CEABMO
CCn1nccc1-c1cnc(C[C@@H]2CCC[N@@H+](C)C2)cn1	ZINC000257286438	190027242	/nfs/dbraw/zinc/02/72/42/190027242.db2.gz	PLPILFNRIWDLCW-ZDUSSCGKSA-N	1	1	285.395	2.244	40	0		CEABMO
Cn1cc(C[N@@H+]2CCCC[C@@H]2c2ccn3nccc3n2)cn1	ZINC000257333433	190035303	/nfs/dbraw/zinc/03/53/03/190035303.db2.gz	YBNDCKZMMRMVIU-OAHLLOKOSA-N	1	1	296.378	2.190	40	0		CEABMO
Cn1cc(C[N@H+]2CCCC[C@@H]2c2ccn3nccc3n2)cn1	ZINC000257333433	190035304	/nfs/dbraw/zinc/03/53/04/190035304.db2.gz	YBNDCKZMMRMVIU-OAHLLOKOSA-N	1	1	296.378	2.190	40	0		CEABMO
NC(=O)c1cccc([C@@H]2CCC[N@H+]2C2CCCC2)n1	ZINC000257333331	190035618	/nfs/dbraw/zinc/03/56/18/190035618.db2.gz	YBCYZOPJQIADGX-AWEZNQCLSA-N	1	1	259.353	2.260	40	0		CEABMO
O[C@H]1CC[N@@H+](Cc2ccccc2)CC[C@@H]1n1ccnc1	ZINC000257341657	190036908	/nfs/dbraw/zinc/03/69/08/190036908.db2.gz	ZLIDIHGBLBVAQK-HOTGVXAUSA-N	1	1	271.364	2.081	40	0		CEABMO
c1ccc(NC[C@@H]2CO[C@@H]3C[N@H+](C4CCCC4)C[C@H]23)nc1	ZINC000306126525	376540973	/nfs/dbraw/zinc/54/09/73/376540973.db2.gz	DYINQGNQFIRBAU-FVQBIDKESA-N	1	1	287.407	2.383	40	0		CEABMO
CCC[N@@H+]1CCC[C@H]1c1cccnc1N1CCN(C)CC1	ZINC000072216584	256710627	/nfs/dbraw/zinc/71/06/27/256710627.db2.gz	CTMNVLLKNHPFBN-INIZCTEOSA-N	1	1	288.439	2.380	40	0		CEABMO
CCC[N@H+]1CCC[C@H]1c1cccnc1N1CCN(C)CC1	ZINC000072216584	256710628	/nfs/dbraw/zinc/71/06/28/256710628.db2.gz	CTMNVLLKNHPFBN-INIZCTEOSA-N	1	1	288.439	2.380	40	0		CEABMO
C[C@H]1CCCC[N@H+]1[C@@H]1CC(=O)N(c2ccccc2)C1=O	ZINC000004019073	394453726	/nfs/dbraw/zinc/45/37/26/394453726.db2.gz	XOJZOOPMSCPKHK-GXTWGEPZSA-N	1	1	272.348	2.193	40	0		CEABMO
COc1c2c(c(C(F)(F)F)c3c1C[N@@H+](C)CC3)OCO2	ZINC000252508150	394571381	/nfs/dbraw/zinc/57/13/81/394571381.db2.gz	XEKQTQPWVKBQHC-UHFFFAOYSA-N	1	1	289.253	2.431	40	0		CEABMO
Cc1nc(N2CCOCC2)ccc1[C@H]1CCCC[N@@H+]1C	ZINC000072219640	394594704	/nfs/dbraw/zinc/59/47/04/394594704.db2.gz	ROFHTNGNDVYMKN-OAHLLOKOSA-N	1	1	275.396	2.383	40	0		CEABMO
COc1ccc(N2C(=O)[C@H]([NH3+])[C@@H]2c2ccc(C)cc2)cc1	ZINC000072227137	394595376	/nfs/dbraw/zinc/59/53/76/394595376.db2.gz	FHJGRFNZBYNQNN-CVEARBPZSA-N	1	1	282.343	2.419	40	0		CEABMO
Cc1ccc([C@H]2[C@H]([NH3+])C(=O)N2c2ccc(F)cc2)o1	ZINC000072227219	394595564	/nfs/dbraw/zinc/59/55/64/394595564.db2.gz	LTKGARFDKBEJDE-STQMWFEESA-N	1	1	260.268	2.142	40	0		CEABMO
[NH3+][C@@H]1C(=O)N(c2ccc(F)cc2)[C@H]1c1ccccc1F	ZINC000072227243	394595575	/nfs/dbraw/zinc/59/55/75/394595575.db2.gz	ISINHULIJDRCSJ-KBPBESRZSA-N	1	1	274.270	2.380	40	0		CEABMO
[NH3+][C@@H]1C(=O)N(c2ccccc2)[C@@H]1c1ccccc1F	ZINC000072227378	394595593	/nfs/dbraw/zinc/59/55/93/394595593.db2.gz	MPFLSNBXZVSLMS-UONOGXRCSA-N	1	1	256.280	2.241	40	0		CEABMO
Cc1ccc([C@H]2[C@@H]([NH3+])C(=O)N2c2ccc3c(c2)OCO3)cc1	ZINC000072227561	394596527	/nfs/dbraw/zinc/59/65/27/394596527.db2.gz	UQRUKIMKBPJUPX-CVEARBPZSA-N	1	1	296.326	2.139	40	0		CEABMO
Cc1ccc(N2C(=O)[C@@H]([NH3+])[C@H]2c2ccc3c(c2)OCO3)cc1	ZINC000072227462	394596657	/nfs/dbraw/zinc/59/66/57/394596657.db2.gz	HHNIEFVQXKKMLP-JKSUJKDBSA-N	1	1	296.326	2.139	40	0		CEABMO
CC(C)[N@H+]1CCC[C@H](c2nccnc2-c2cn[nH]c2)C1	ZINC000072382188	394598674	/nfs/dbraw/zinc/59/86/74/394598674.db2.gz	YAPDVDCZNCJGEG-LBPRGKRZSA-N	1	1	271.368	2.455	40	0		CEABMO
NC(=O)[C@@H]1Cc2ccccc2C[N@@H+]1Cc1ccccc1	ZINC000078395381	394626097	/nfs/dbraw/zinc/62/60/97/394626097.db2.gz	DEVGNEAMNMQZRC-INIZCTEOSA-N	1	1	266.344	2.099	40	0		CEABMO
NC(=O)[C@@H]1Cc2ccccc2C[N@H+]1Cc1ccccc1	ZINC000078395381	394626101	/nfs/dbraw/zinc/62/61/01/394626101.db2.gz	DEVGNEAMNMQZRC-INIZCTEOSA-N	1	1	266.344	2.099	40	0		CEABMO
CC(C)C[N@H+]1CC[C@@]2(C1)CCCN(c1ncccn1)C2	ZINC000096071626	394675430	/nfs/dbraw/zinc/67/54/30/394675430.db2.gz	FZAWAWBVZWRZQL-MRXNPFEDSA-N	1	1	274.412	2.425	40	0		CEABMO
C[N@H+]1CCC[C@H](CNC(=S)Nc2ccccc2)C1	ZINC000009876091	170388036	/nfs/dbraw/zinc/38/80/36/170388036.db2.gz	XPCBNUOPRIYXMJ-GFCCVEGCSA-N	1	1	263.410	2.315	40	0		CEABMO
O[C@@H]1CC[N@H+](Cc2cc(Br)cs2)C1	ZINC000038539048	174145622	/nfs/dbraw/zinc/14/56/22/174145622.db2.gz	ZZEJLNNATPUHNO-MRVPVSSYSA-N	1	1	262.172	2.077	40	0		CEABMO
O[C@@H]1CC[N@@H+](Cc2cc(Br)cs2)C1	ZINC000038539048	174145623	/nfs/dbraw/zinc/14/56/23/174145623.db2.gz	ZZEJLNNATPUHNO-MRVPVSSYSA-N	1	1	262.172	2.077	40	0		CEABMO
Cc1[nH+]ccn1Cc1ccc(C(=O)NC2CC2)cc1	ZINC000038850113	174157959	/nfs/dbraw/zinc/15/79/59/174157959.db2.gz	XJSLTAZOACHKJO-UHFFFAOYSA-N	1	1	255.321	2.132	40	0		CEABMO
COc1cccc(OCCc2cc([C@@H]3CC[NH2+]C3)n[nH]2)c1	ZINC000072374097	176384929	/nfs/dbraw/zinc/38/49/29/176384929.db2.gz	QDPWFEGGXYYZRE-GFCCVEGCSA-N	1	1	287.363	2.117	40	0		CEABMO
COc1ccc(CN2C[C@@H]3CCC[N@H+]3C[C@H]2C)cc1OC	ZINC000072397533	176395092	/nfs/dbraw/zinc/39/50/92/176395092.db2.gz	AACBDFFUMQVXBK-HIFRSBDPSA-N	1	1	290.407	2.372	40	0		CEABMO
OC[C@H]1CCC[N@@H+](Cc2cccn2-c2cccnc2)C1	ZINC000072397792	176395454	/nfs/dbraw/zinc/39/54/54/176395454.db2.gz	WJIKCWUJUHFSAM-AWEZNQCLSA-N	1	1	271.364	2.077	40	0		CEABMO
CC[N@@H+](Cc1ccccc1)[C@H]1CC[C@H]([NH2+]CC(=O)[O-])CC1	ZINC000242677120	261267689	/nfs/dbraw/zinc/26/76/89/261267689.db2.gz	SYVYCADJXVQLMC-WKILWMFISA-N	1	1	290.407	2.494	40	0		CEABMO
CCN1CCC([N@@H+]2CCC[C@@H]2c2cncc(NC)n2)CC1	ZINC000257279023	279258701	/nfs/dbraw/zinc/25/87/01/279258701.db2.gz	OERJLGCCLVYGMV-OAHLLOKOSA-N	1	1	289.427	2.140	40	0		CEABMO
CCN1CCC([N@H+]2CCC[C@@H]2c2cncc(NC)n2)CC1	ZINC000257279023	279258702	/nfs/dbraw/zinc/25/87/02/279258702.db2.gz	OERJLGCCLVYGMV-OAHLLOKOSA-N	1	1	289.427	2.140	40	0		CEABMO
[NH3+][C@@H](c1nc(-c2cccnc2)n[nH]1)c1ccc(F)cc1	ZINC000095533268	185005719	/nfs/dbraw/zinc/00/57/19/185005719.db2.gz	OGBPYRGBKXBVKA-GFCCVEGCSA-N	1	1	269.283	2.054	40	0		CEABMO
CCN1C(=O)CC[C@@]12CCC[N@@H+](Cc1ccccn1)CC2	ZINC000096047504	185072840	/nfs/dbraw/zinc/07/28/40/185072840.db2.gz	FBDQBYLYIACXTE-QGZVFWFLSA-N	1	1	287.407	2.449	40	0		CEABMO
O=C1N(Cc2ccncc2)CC[C@@]12CCC[N@@H+](CC1CC1)C2	ZINC000096048691	185073319	/nfs/dbraw/zinc/07/33/19/185073319.db2.gz	HEFLPLCKYLQLHZ-GOSISDBHSA-N	1	1	299.418	2.306	40	0		CEABMO
CC(C)Oc1ncnc2c1CC[N@@H+](CC1CC1)CC2	ZINC000096058785	185078496	/nfs/dbraw/zinc/07/84/96/185078496.db2.gz	MUFHXKNROOISTP-UHFFFAOYSA-N	1	1	261.369	2.074	40	0		CEABMO
c1ccc(O[C@@H]2CC[C@H]3[C@H]2OCC[N@@H+]3CC2CC2)nc1	ZINC000096058051	185079381	/nfs/dbraw/zinc/07/93/81/185079381.db2.gz	GMIWAQWZFNNNTK-SQWLQELKSA-N	1	1	274.364	2.102	40	0		CEABMO
C[N@H+]1CCC[C@]2(CCN(Cc3cccc(F)c3)C2=O)C1	ZINC000096074100	185087636	/nfs/dbraw/zinc/08/76/36/185087636.db2.gz	NYZLNQASSTUCDJ-INIZCTEOSA-N	1	1	276.355	2.270	40	0		CEABMO
c1ncc(C[NH+]2CCC3(C[C@H](c4cccnc4)CO3)CC2)[nH]1	ZINC000096073009	185088809	/nfs/dbraw/zinc/08/88/09/185088809.db2.gz	WXTBMCINQWCSHK-HNNXBMFYSA-N	1	1	298.390	2.343	40	0		CEABMO
c1ccc(O[C@H]2CO[C@@]3(CC[N@H+](C4CCC4)C3)C2)nc1	ZINC000096107845	185099621	/nfs/dbraw/zinc/09/96/21/185099621.db2.gz	UDUJFRSEEMIXON-ZBFHGGJFSA-N	1	1	274.364	2.246	40	0		CEABMO
C[N@@H+]1CCN2c3ccccc3Cn3cccc3[C@H]2C1	ZINC000004211990	343352724	/nfs/dbraw/zinc/35/27/24/343352724.db2.gz	MNHDDERDSNZCCK-MRXNPFEDSA-N	1	1	253.349	2.343	40	0	in-man	CEABMO
C[N@H+]1CCN2c3ccccc3Cn3cccc3[C@H]2C1	ZINC000004211990	343352730	/nfs/dbraw/zinc/35/27/30/343352730.db2.gz	MNHDDERDSNZCCK-MRXNPFEDSA-N	1	1	253.349	2.343	40	0	in-man	CEABMO
CNc1nc(N2CCc3ccccc3[C@H]2C)cc[nH+]1	ZINC000328960098	344758413	/nfs/dbraw/zinc/75/84/13/344758413.db2.gz	AWTSTBAHOGJYGH-LLVKDONJSA-N	1	1	254.337	2.064	40	0		CEABMO
[NH3+][C@H](C[C@H](c1ccc(Cl)cc1)[NH+]1CCCC1)C(=O)[O-]	ZINC000409440103	344889726	/nfs/dbraw/zinc/88/97/26/344889726.db2.gz	JPBIMQFWRADWCT-CHWSQXEVSA-N	1	1	282.771	2.279	40	0		CEABMO
Cc1ccc(C[C@H]2[C@@H](O)CCC[N@H+]2Cc2cc[nH]n2)cc1	ZINC000585274365	345009453	/nfs/dbraw/zinc/00/94/53/345009453.db2.gz	JTCUNUPKGKJNHL-IRXDYDNUSA-N	1	1	285.391	2.286	40	0		CEABMO
c1cc(C[N@@H+]2CC[C@@]3(C[C@@H](OCC4CC4)CO3)C2)ccn1	ZINC000107225668	186163370	/nfs/dbraw/zinc/16/33/70/186163370.db2.gz	HYDQXXYKNSXRQR-IAGOWNOFSA-N	1	1	288.391	2.242	40	0		CEABMO
O=C1NCC[C@]12CCC[N@H+](Cc1cncc(Cl)c1)CC2	ZINC000108528098	186220763	/nfs/dbraw/zinc/22/07/63/186220763.db2.gz	MYTQYAQKEWGIRB-HNNXBMFYSA-N	1	1	293.798	2.227	40	0		CEABMO
CNC(=O)[C@H]1CCC[C@]12CC[N@@H+](Cc1ccco1)C2	ZINC000108524624	186221227	/nfs/dbraw/zinc/22/12/27/186221227.db2.gz	YLFKXFAUQCEXAA-UKRRQHHQSA-N	1	1	262.353	2.018	40	0		CEABMO
CN(C)c1nc2ccccc2cc1C[N@H+]1CCC[C@@H](O)C1	ZINC000072397805	363132593	/nfs/dbraw/zinc/13/25/93/363132593.db2.gz	ONMVZLKPZWGFPT-OAHLLOKOSA-N	1	1	285.391	2.258	40	0		CEABMO
C[C@@H]([NH+]1CCOCC1)[C@](O)(c1ccccc1)c1ccccn1	ZINC000013099522	361417865	/nfs/dbraw/zinc/41/78/65/361417865.db2.gz	RCUZQOAGXSJBDW-QAPCUYQASA-N	1	1	298.386	2.038	40	0	in-vitro	CEABMO
O[C@@H]1C[C@@H](c2nc(-c3ccccc3)no2)[N@@H+](CC2CC2)C1	ZINC000015674124	361476385	/nfs/dbraw/zinc/47/63/85/361476385.db2.gz	NEDGEJRAGACATF-KGLIPLIRSA-N	1	1	285.347	2.254	40	0	biogenic,in-vitro	CEABMO
CCc1cc(=O)[nH]c([C@H]2CCC[N@@H+](Cc3ccncc3)C2)n1	ZINC000019522519	361541425	/nfs/dbraw/zinc/54/14/25/361541425.db2.gz	AFDAUQGIYIERMF-AWEZNQCLSA-N	1	1	298.390	2.107	40	0		CEABMO
c1cc(C[N@@H+]2C[C@@H]3COC[C@]3(COCC3CC3)C2)co1	ZINC000096206873	364410934	/nfs/dbraw/zinc/41/09/34/364410934.db2.gz	HFZCUYYKFNNQFY-HZPDHXFCSA-N	1	1	277.364	2.155	40	0		CEABMO
CCOC[C@H]1Cn2cncc2C[N@@H+](CC2CCC2)C1	ZINC000096207644	364411323	/nfs/dbraw/zinc/41/13/23/364411323.db2.gz	KVWINNQXAXBOER-CQSZACIVSA-N	1	1	263.385	2.152	40	0		CEABMO
CO[C@@H]1CO[C@]2(C1)CCC[N@@H+](Cc1ccc(C)o1)C2	ZINC000096218403	364412999	/nfs/dbraw/zinc/41/29/99/364412999.db2.gz	KCHYSWAQCJBRHZ-GJZGRUSLSA-N	1	1	265.353	2.358	40	0		CEABMO
CNS(=O)(=O)c1ccccc1C(=[NH2+])c1ccccc1	ZINC000100137014	364539874	/nfs/dbraw/zinc/53/98/74/364539874.db2.gz	FEAMUAJBSQUFRM-UHFFFAOYSA-N	1	1	274.345	2.011	40	0	in-vitro	CEABMO
C[C@@H]1C[C@H](NCc2ccc3c(c2)OCO3)[C@@H](C)C[N@H+]1C	ZINC000101912042	364578416	/nfs/dbraw/zinc/57/84/16/364578416.db2.gz	RSTSMVMSMDWOHJ-SCRDCRAPSA-N	1	1	276.380	2.234	40	0		CEABMO
c1ccc(C[C@H]2C[N@H+](C3CCOCC3)CCO2)cc1	ZINC000161679672	367104990	/nfs/dbraw/zinc/10/49/90/367104990.db2.gz	OAUSKDBSWDQYQN-INIZCTEOSA-N	1	1	261.365	2.109	40	0		CEABMO
CCOc1ccccc1C(=O)N1CCC[C@@]2(CC[N@H+]2C)C1	ZINC000585101933	367177851	/nfs/dbraw/zinc/17/78/51/367177851.db2.gz	LWLLRDWMCMXZMY-QGZVFWFLSA-N	1	1	288.391	2.396	40	0		CEABMO
OC[C@H]1CCn2nccc2C[N@@H+]1Cc1ccc2c(c1)CCC2	ZINC000585098645	367178283	/nfs/dbraw/zinc/17/82/83/367178283.db2.gz	ZYGSMIXTAVIBGT-GOSISDBHSA-N	1	1	297.402	2.139	40	0		CEABMO
OC[C@H]1CCn2nccc2C[N@H+]1Cc1ccc2c(c1)CCC2	ZINC000585098645	367178289	/nfs/dbraw/zinc/17/82/89/367178289.db2.gz	ZYGSMIXTAVIBGT-GOSISDBHSA-N	1	1	297.402	2.139	40	0		CEABMO
CCOC(=O)c1noc2c1C[N@H+](Cc1ccccc1)CC2	ZINC000228964620	370416485	/nfs/dbraw/zinc/41/64/85/370416485.db2.gz	DXBLGQFYQVIKEZ-UHFFFAOYSA-N	1	1	286.331	2.410	40	0		CEABMO
CCOC(=O)c1noc2c1C[N@@H+](Cc1ccccc1)CC2	ZINC000228964620	370416487	/nfs/dbraw/zinc/41/64/87/370416487.db2.gz	DXBLGQFYQVIKEZ-UHFFFAOYSA-N	1	1	286.331	2.410	40	0		CEABMO
CCO[C@@H]1CSC2(C[NH+](Cc3ccncc3)C2)C1	ZINC000253383261	371513729	/nfs/dbraw/zinc/51/37/29/371513729.db2.gz	KYGZPSJIQBBALY-ZDUSSCGKSA-N	1	1	264.394	2.178	40	0		CEABMO
Fc1cccc(OCc2cc([C@@H]3CC[NH2+]C3)[nH]n2)c1	ZINC000257344138	371613695	/nfs/dbraw/zinc/61/36/95/371613695.db2.gz	ZVXXZHDYCLMMRU-SNVBAGLBSA-N	1	1	261.300	2.205	40	0		CEABMO
CCCn1cc(C[NH2+]Cc2ccnn2C(F)F)cn1	ZINC000256052986	190004126	/nfs/dbraw/zinc/00/41/26/190004126.db2.gz	PNZDTIJENSIPDH-UHFFFAOYSA-N	1	1	269.299	2.175	40	0		CEABMO
CC(C)[N@H+]1CCC[C@H](c2cnc(-c3cnn(C)c3)cn2)C1	ZINC000257288350	190026878	/nfs/dbraw/zinc/02/68/78/190026878.db2.gz	PTWLGKGKEVWEGK-ZDUSSCGKSA-N	1	1	285.395	2.465	40	0		CEABMO
Cc1n[nH]cc1C[N@@H+]1CCC[C@@H]1c1ccnc(C)n1	ZINC000257288253	190026931	/nfs/dbraw/zinc/02/69/31/190026931.db2.gz	PTNFHKRJNCYYPQ-CQSZACIVSA-N	1	1	257.341	2.154	40	0		CEABMO
Cc1n[nH]cc1C[N@H+]1CCC[C@@H]1c1ccnc(C)n1	ZINC000257288253	190026932	/nfs/dbraw/zinc/02/69/32/190026932.db2.gz	PTNFHKRJNCYYPQ-CQSZACIVSA-N	1	1	257.341	2.154	40	0		CEABMO
CC(C)C[N@H+]1CC[C@@H](Cc2cncc(-c3nccn3C)n2)C1	ZINC000257275661	190024816	/nfs/dbraw/zinc/02/48/16/190024816.db2.gz	NQHUAVDCOMMHBE-AWEZNQCLSA-N	1	1	299.422	2.398	40	0		CEABMO
c1cnc([C@@H]2C[N@H+](CC3CCCCC3)CCO2)cn1	ZINC000257317516	190032563	/nfs/dbraw/zinc/03/25/63/190032563.db2.gz	VKBPCHVEWQLUEG-HNNXBMFYSA-N	1	1	261.369	2.430	40	0		CEABMO
c1cnc([C@@H]2C[N@@H+](CC3CCCCC3)CCO2)cn1	ZINC000257317516	190032564	/nfs/dbraw/zinc/03/25/64/190032564.db2.gz	VKBPCHVEWQLUEG-HNNXBMFYSA-N	1	1	261.369	2.430	40	0		CEABMO
CCc1nc(C)c(C[N@H+]2CC[C@@]3(CCCO3)[C@@H](OC)C2)[nH]1	ZINC000257327914	190034590	/nfs/dbraw/zinc/03/45/90/190034590.db2.gz	XDINEOJKYUSODN-HOCLYGCPSA-N	1	1	293.411	2.050	40	0		CEABMO
CC[N@H+]1CC[C@H](O)[C@@H](Oc2ccc(F)cc2)CC1	ZINC000257329965	190034763	/nfs/dbraw/zinc/03/47/63/190034763.db2.gz	XMFOWSKXNFUWFL-KBPBESRZSA-N	1	1	253.317	2.050	40	0		CEABMO
c1cncc(C[C@H]2CCC[N@@H+](Cc3cnccn3)C2)c1	ZINC000257327385	190035046	/nfs/dbraw/zinc/03/50/46/190035046.db2.gz	XBCWHXDTDYGQNR-OAHLLOKOSA-N	1	1	268.364	2.326	40	0		CEABMO
Cc1cc(C[N@@H+]2CC[C@H](c3nccc(C)n3)C2)no1	ZINC000257334060	190035943	/nfs/dbraw/zinc/03/59/43/190035943.db2.gz	YEINZEZGKWZFMV-LBPRGKRZSA-N	1	1	258.325	2.071	40	0		CEABMO
Cc1cc(C[N@H+]2CC[C@H](c3nccc(C)n3)C2)no1	ZINC000257334060	190035944	/nfs/dbraw/zinc/03/59/44/190035944.db2.gz	YEINZEZGKWZFMV-LBPRGKRZSA-N	1	1	258.325	2.071	40	0		CEABMO
CC[C@H]1C[N@H+]2CCc3cc(OC)c(OC)cc3[C@@H]2C[C@@H]1O	ZINC000005339257	394458040	/nfs/dbraw/zinc/45/80/40/394458040.db2.gz	LYDWUTUOAGCHNM-CQDKDKBSSA-N	1	1	291.391	2.394	40	0		CEABMO
Cc1cc([C@@H]([NH3+])c2ccccc2)cnc1N1CCN(C)CC1	ZINC000072222570	394594565	/nfs/dbraw/zinc/59/45/65/394594565.db2.gz	QZVCYHDBQDTCEV-KRWDZBQOSA-N	1	1	296.418	2.190	40	0		CEABMO
Cc1nc(N2CCN(C)CC2)ccc1[C@@H]([NH3+])c1ccccc1	ZINC000072224657	394594612	/nfs/dbraw/zinc/59/46/12/394594612.db2.gz	KBPQFABCQAIEIG-SFHVURJKSA-N	1	1	296.418	2.190	40	0		CEABMO
[NH3+][C@@H]1C(=O)N(Cc2ccc(F)cc2)[C@@H]1c1cccs1	ZINC000072228186	394596569	/nfs/dbraw/zinc/59/65/69/394596569.db2.gz	DLWZEQFIBPOGAK-QWHCGFSZSA-N	1	1	276.336	2.298	40	0		CEABMO
CC(=O)N1CC[N@@H+](C)C[C@H]1c1ccc(OC(C)C)cc1	ZINC000072366536	394598246	/nfs/dbraw/zinc/59/82/46/394598246.db2.gz	QKFYPKYFWDZVLV-INIZCTEOSA-N	1	1	276.380	2.309	40	0		CEABMO
CC(=O)N1CC[N@H+](C)C[C@H]1c1ccc(OC(C)C)cc1	ZINC000072366536	394598249	/nfs/dbraw/zinc/59/82/49/394598249.db2.gz	QKFYPKYFWDZVLV-INIZCTEOSA-N	1	1	276.380	2.309	40	0		CEABMO
CN(C)C(=O)c1sc2ncccc2c1[C@@H]1CC[N@@H+](C)C1	ZINC000072352551	394598495	/nfs/dbraw/zinc/59/84/95/394598495.db2.gz	VVAKWBLADKTCFQ-SNVBAGLBSA-N	1	1	289.404	2.417	40	0		CEABMO
CC(C)C[N@@H+](Cc1ccccc1)[C@@H]1CCS(=O)(=O)C1	ZINC000072953120	394602328	/nfs/dbraw/zinc/60/23/28/394602328.db2.gz	GNNRZPHFKMGXRH-OAHLLOKOSA-N	1	1	281.421	2.332	40	0		CEABMO
CCOc1ccc([C@@H]([NH3+])c2nnc(C3CC3)[nH]2)cc1OC	ZINC000095534303	394673682	/nfs/dbraw/zinc/67/36/82/394673682.db2.gz	USWQEDCZQZOUOK-CYBMUJFWSA-N	1	1	288.351	2.138	40	0		CEABMO
CCc1ncnc2c1CC[N@@H+](Cc1ccco1)CC2	ZINC000096058603	394675257	/nfs/dbraw/zinc/67/52/57/394675257.db2.gz	VKQPEECUODFFCE-UHFFFAOYSA-N	1	1	257.337	2.233	40	0		CEABMO
Cc1ccc(N2C(=O)[C@@H]([NH3+])[C@@H]2c2ccccc2)cc1	ZINC000015014826	292127581	/nfs/dbraw/zinc/12/75/81/292127581.db2.gz	OJTHEDVIZPWWAU-GJZGRUSLSA-N	1	1	252.317	2.410	40	0		CEABMO
O[C@H](COc1ccccc1)C[N@H+]1CCc2ccccc2C1	ZINC000006529955	170210948	/nfs/dbraw/zinc/21/09/48/170210948.db2.gz	YXZACQIXSNSCCQ-KRWDZBQOSA-N	1	1	283.371	2.485	40	0		CEABMO
Cc1cccc(NC(=O)CNCC[NH+]2CCCCC2)c1C	ZINC000035311501	172122358	/nfs/dbraw/zinc/12/23/58/172122358.db2.gz	NIPONSOSPMCAPK-UHFFFAOYSA-N	1	1	289.423	2.317	40	0		CEABMO
O=C(NC1CC1)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1	ZINC000038850067	174157995	/nfs/dbraw/zinc/15/79/95/174157995.db2.gz	HAQHTXXFBMZFQN-CQSZACIVSA-N	1	1	258.365	2.177	40	0		CEABMO
CCCNC(=O)[C@H]1CCC[N@@H+](Cc2ccccc2)C1	ZINC000038857451	174158198	/nfs/dbraw/zinc/15/81/98/174158198.db2.gz	NHTWGAXDXYMUJZ-HNNXBMFYSA-N	1	1	260.381	2.425	40	0		CEABMO
c1ccc(N2CCC[N@H+](Cc3ccncc3)CC2)nc1	ZINC000072351001	176373501	/nfs/dbraw/zinc/37/35/01/176373501.db2.gz	WEJXQOYCYYWEFT-UHFFFAOYSA-N	1	1	268.364	2.189	40	0		CEABMO
CN(Cc1ccc(Cl)cc1)C(=O)[C@@]1(C)C[N@H+](C)CCO1	ZINC000072379378	176386593	/nfs/dbraw/zinc/38/65/93/176386593.db2.gz	AJHJKRQIWKHXRV-OAHLLOKOSA-N	1	1	296.798	2.019	40	0		CEABMO
CN(Cc1ccc(Cl)cc1)C(=O)[C@@]1(C)C[N@@H+](C)CCO1	ZINC000072379378	176386594	/nfs/dbraw/zinc/38/65/94/176386594.db2.gz	AJHJKRQIWKHXRV-OAHLLOKOSA-N	1	1	296.798	2.019	40	0		CEABMO
C[C@H](CO)Nc1nc(N2Cc3ccccc3C[C@H]2C)cc[nH+]1	ZINC000329066645	274494533	/nfs/dbraw/zinc/49/45/33/274494533.db2.gz	YDCZIBDFVHDHBB-CHWSQXEVSA-N	1	1	298.390	2.221	40	0		CEABMO
[NH3+][C@H](c1nc(-c2ccccc2O)n[nH]1)c1ccccc1	ZINC000095533384	185005567	/nfs/dbraw/zinc/00/55/67/185005567.db2.gz	GWNFELRNQCMAAH-ZDUSSCGKSA-N	1	1	266.304	2.225	40	0		CEABMO
[NH3+][C@H](c1nc(-c2ccco2)n[nH]1)c1ccc(F)cc1	ZINC000095533239	185007625	/nfs/dbraw/zinc/00/76/25/185007625.db2.gz	DXDMQVNUDHDTSJ-NSHDSACASA-N	1	1	258.256	2.252	40	0		CEABMO
Cc1nnc([C@@H]2CC[C@@H]3[C@@H](CC[N@H+]3C3CCC3)O2)o1	ZINC000096040922	185069385	/nfs/dbraw/zinc/06/93/85/185069385.db2.gz	FECKZCIDNKMEBZ-UPJWGTAASA-N	1	1	263.341	2.225	40	0		CEABMO
CC[C@@H]1[N@@H+](CC2CC2)CCC[C@]12CCC(=O)N2CCOC	ZINC000096052451	185074299	/nfs/dbraw/zinc/07/42/99/185074299.db2.gz	TWXCPHVIGWLQLZ-RDJZCZTQSA-N	1	1	294.439	2.278	40	0		CEABMO
CC(C)C[N@H+]1CC[C@@H]2[C@@H]1CCN2Cc1cccnc1	ZINC000096055780	185076769	/nfs/dbraw/zinc/07/67/69/185076769.db2.gz	BBGONHDMDWWHFS-JKSUJKDBSA-N	1	1	259.397	2.386	40	0		CEABMO
CCOC[C@]12CCCO[C@@H]1CC[N@@H+](CC1CC1)C2	ZINC000096056856	185077716	/nfs/dbraw/zinc/07/77/16/185077716.db2.gz	VOVNQHXCLCNOQM-HUUCEWRRSA-N	1	1	253.386	2.304	40	0		CEABMO
COc1ccc(C[N@H+]2CCc3ncnc(OC)c3CC2)cc1	ZINC000096058739	185078976	/nfs/dbraw/zinc/07/89/76/185078976.db2.gz	QTLHKXHWZFNRKQ-UHFFFAOYSA-N	1	1	299.374	2.095	40	0		CEABMO
Cn1cc2c(n1)[C@H](COCC1CC1)C[N@H+](CC1CC1)C2	ZINC000096059864	185081552	/nfs/dbraw/zinc/08/15/52/185081552.db2.gz	JDUDVFQXSXKBOK-HNNXBMFYSA-N	1	1	275.396	2.156	40	0		CEABMO
Cc1ccc(CCC(=O)N2CC[NH+](C)CC2)cc1C	ZINC000096621645	185107793	/nfs/dbraw/zinc/10/77/93/185107793.db2.gz	GGYSTCCRXQIRAU-UHFFFAOYSA-N	1	1	260.381	2.010	40	0		CEABMO
OC[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ccccc2)C1	ZINC000090726867	180032848	/nfs/dbraw/zinc/03/28/48/180032848.db2.gz	JFGJABRNVYTSPQ-GFCCVEGCSA-N	1	1	259.271	2.433	40	0		CEABMO
O=C(C[C@H]1[C@H]2C[N@H+](Cc3ccsc3)C[C@@H]12)N1CCCC1	ZINC000107745886	186189169	/nfs/dbraw/zinc/18/91/69/186189169.db2.gz	QBABJBRIZZQOLL-QDMKHBRRSA-N	1	1	290.432	2.438	40	0		CEABMO
Cc1noc([C@@H]2C[C@H]3OCC[C@H]3[N@@H+](Cc3ccco3)C2)n1	ZINC000107710872	186187964	/nfs/dbraw/zinc/18/79/64/186187964.db2.gz	NOYSDUDNYSKUBB-MRVWCRGKSA-N	1	1	289.335	2.118	40	0		CEABMO
CNc1nc(N2Cc3ccccc3CC2(C)C)cc[nH+]1	ZINC000329056121	283273088	/nfs/dbraw/zinc/27/30/88/283273088.db2.gz	VRDYABRRZWRING-UHFFFAOYSA-N	1	1	268.364	2.282	40	0		CEABMO
CCOc1ccc(NC(=O)[C@H]2CCC[N@@H+](C)C2)cc1	ZINC000001845598	361223182	/nfs/dbraw/zinc/22/31/82/361223182.db2.gz	BCVGPQOKYDOMHP-LBPRGKRZSA-N	1	1	262.353	2.366	40	0		CEABMO
CC(C)NC(=S)N1CC[NH+](Cc2ccccc2)CC1	ZINC000013828032	361444185	/nfs/dbraw/zinc/44/41/85/361444185.db2.gz	GLFPZXCKSYHDAR-UHFFFAOYSA-N	1	1	277.437	2.087	40	0		CEABMO
O=C1NCC[NH2+][C@@H]1Cc1ccccc1-c1cccs1	ZINC000019348545	361528360	/nfs/dbraw/zinc/52/83/60/361528360.db2.gz	BTKBKRLTHJGULB-CYBMUJFWSA-N	1	1	272.373	2.046	40	0		CEABMO
CC[C@H](C)[N@H+]1CC[C@]2(CCN(Cc3ccccn3)C2=O)C1	ZINC000096159489	364403288	/nfs/dbraw/zinc/40/32/88/364403288.db2.gz	CMLSGLZDEUOFTP-WMLDXEAASA-N	1	1	287.407	2.305	40	0		CEABMO
COCCN1CC[N@@H+](CC2CC2)Cc2ccc(C)nc21	ZINC000096199041	364408872	/nfs/dbraw/zinc/40/88/72/364408872.db2.gz	WQFZFDUWZQCXIH-UHFFFAOYSA-N	1	1	275.396	2.068	40	0		CEABMO
CN(C)[C@@H]1CC[N@@H+](CC2CC2)[C@H]1Cc1ccncc1	ZINC000096201008	364411247	/nfs/dbraw/zinc/41/12/47/364411247.db2.gz	ZPJXZJUYBZOURR-CVEARBPZSA-N	1	1	259.397	2.039	40	0		CEABMO
C[NH+](C)[C@@H]1CCN(CC2CC2)[C@H]1Cc1ccncc1	ZINC000096201008	364411254	/nfs/dbraw/zinc/41/12/54/364411254.db2.gz	ZPJXZJUYBZOURR-CVEARBPZSA-N	1	1	259.397	2.039	40	0		CEABMO
Cc1cc(C(=O)N2CC[C@]3(C2)CCC[N@H+](C)C3)c(C)o1	ZINC000096215247	364413066	/nfs/dbraw/zinc/41/30/66/364413066.db2.gz	CWOYANSJXZHWHZ-MRXNPFEDSA-N	1	1	276.380	2.454	40	0		CEABMO
C[N@H+]1CCCC[C@@]12CCCN(C(=O)c1ccccn1)C2	ZINC000096217578	364413422	/nfs/dbraw/zinc/41/34/22/364413422.db2.gz	GZCSOBHEVYZEIE-INIZCTEOSA-N	1	1	273.380	2.172	40	0		CEABMO
O=C1[C@H]2C[N@H+](CC3CC3)C[C@H]2CN1Cc1cccc(F)c1	ZINC000096245300	364417007	/nfs/dbraw/zinc/41/70/07/364417007.db2.gz	BXADLIJUVKFDHQ-HOCLYGCPSA-N	1	1	288.366	2.126	40	0		CEABMO
CNC(=O)[C@@H]1CCC[C@]12CC[N@@H+](Cc1ccsc1)C2	ZINC000247957414	371150875	/nfs/dbraw/zinc/15/08/75/371150875.db2.gz	PCOOAHQOSIDBAW-DZGCQCFKSA-N	1	1	278.421	2.486	40	0		CEABMO
CCO[C@@H]1CSC2(C[NH+](Cc3c(C)noc3C)C2)C1	ZINC000253385027	371513945	/nfs/dbraw/zinc/51/39/45/371513945.db2.gz	RAEJECJVCQHDMZ-LBPRGKRZSA-N	1	1	282.409	2.388	40	0		CEABMO
CC(C)c1cc(C[NH2+]Cc2ccnn2C(F)F)n(C)n1	ZINC000256049474	190002105	/nfs/dbraw/zinc/00/21/05/190002105.db2.gz	ABVFGADXCLGCCT-UHFFFAOYSA-N	1	1	283.326	2.425	40	0		CEABMO
CCCn1nc(C)cc1C[NH2+]Cc1ccnn1C(F)F	ZINC000256049811	190003129	/nfs/dbraw/zinc/00/31/29/190003129.db2.gz	BNIVRHFWKJACEN-UHFFFAOYSA-N	1	1	283.326	2.483	40	0		CEABMO
CCn1cc(C[NH2+]Cc2cc(C(C)C)nn2C)cn1	ZINC000256050701	190003397	/nfs/dbraw/zinc/00/33/97/190003397.db2.gz	GEIYVNYUYQJIOE-UHFFFAOYSA-N	1	1	261.373	2.050	40	0		CEABMO
CCn1nc(C)c(C[NH2+]Cc2cc(C(C)C)nn2C)c1F	ZINC000256053037	190004158	/nfs/dbraw/zinc/00/41/58/190004158.db2.gz	PSVCFYFELSUFCX-UHFFFAOYSA-N	1	1	293.390	2.497	40	0		CEABMO
Cc1c[nH]c([C@@H]2CCC[N@@H+](Cc3cccnc3)C2)n1	ZINC000257211446	190012167	/nfs/dbraw/zinc/01/21/67/190012167.db2.gz	BYWRYLPVNJFTLE-CQSZACIVSA-N	1	1	256.353	2.493	40	0		CEABMO
C[N@H+]1CCC[C@H](c2cncc(N3C(=O)OCC3(C)C)n2)C1	ZINC000257212079	190013225	/nfs/dbraw/zinc/01/32/25/190013225.db2.gz	CBVIEAUMDWLTSW-NSHDSACASA-N	1	1	290.367	2.021	40	0		CEABMO
CNc1ncccc1C[N@@H+]1CCC[C@H]1c1ccncn1	ZINC000257219877	190014142	/nfs/dbraw/zinc/01/41/42/190014142.db2.gz	DIPLCJQTGSKYLJ-AWEZNQCLSA-N	1	1	269.352	2.250	40	0		CEABMO
CNc1ncccc1C[N@H+]1CCC[C@H]1c1ccncn1	ZINC000257219877	190014143	/nfs/dbraw/zinc/01/41/43/190014143.db2.gz	DIPLCJQTGSKYLJ-AWEZNQCLSA-N	1	1	269.352	2.250	40	0		CEABMO
CCn1cc(-c2cncc(C[C@H]3CCC[N@@H+](C)C3)n2)cn1	ZINC000257236608	190017517	/nfs/dbraw/zinc/01/75/17/190017517.db2.gz	HCYVBGSTERHBNU-CYBMUJFWSA-N	1	1	285.395	2.244	40	0		CEABMO
CCn1cc(C[N@H+]2CCC[C@@H](c3ccncn3)C2)c(C)n1	ZINC000257290726	190027438	/nfs/dbraw/zinc/02/74/38/190027438.db2.gz	QEBPXZUSMXUDMJ-CQSZACIVSA-N	1	1	285.395	2.381	40	0		CEABMO
c1ccc(C[N@@H+]2CCOC[C@H](Cc3cnccn3)C2)cc1	ZINC000257272578	190024474	/nfs/dbraw/zinc/02/44/74/190024474.db2.gz	NCXYPTXISOBWIT-MRXNPFEDSA-N	1	1	283.375	2.168	40	0		CEABMO
Cc1cn(C)c([C@@H]2CC[N@@H+](Cc3cncs3)C2)n1	ZINC000257338794	190037319	/nfs/dbraw/zinc/03/73/19/190037319.db2.gz	YZABAKPTYJKFSD-LLVKDONJSA-N	1	1	262.382	2.175	40	0		CEABMO
CC1(CNc2ccc3c(c2)C[N@@H+](CC(N)=O)CC3)COC1	ZINC000329089049	376930162	/nfs/dbraw/zinc/93/01/62/376930162.db2.gz	VYNVNJLOPJXZMA-UHFFFAOYSA-N	1	1	289.379	2.028	40	0		CEABMO
CC1(CNc2ccc3c(c2)C[N@H+](CC(N)=O)CC3)COC1	ZINC000329089049	376930172	/nfs/dbraw/zinc/93/01/72/376930172.db2.gz	VYNVNJLOPJXZMA-UHFFFAOYSA-N	1	1	289.379	2.028	40	0		CEABMO
COC[C@@]12CCO[C@@H]1CC[N@@H+](Cc1ccccc1)C2	ZINC000096110319	285326203	/nfs/dbraw/zinc/32/62/03/285326203.db2.gz	SGMVSQUWDMOKFX-CVEARBPZSA-N	1	1	261.365	2.314	40	0		CEABMO
CNc1ccc(CNC(=O)OC(C)(C)C)c(C)[nH+]1	ZINC000072224095	394594223	/nfs/dbraw/zinc/59/42/23/394594223.db2.gz	KHRMKCOHOYLTAJ-UHFFFAOYSA-N	1	1	251.330	2.456	40	0		CEABMO
COc1ccc(N2C(=O)[C@@H]([NH3+])[C@@H]2c2cccs2)cc1	ZINC000072227131	394595235	/nfs/dbraw/zinc/59/52/35/394595235.db2.gz	TUGVCJNUHGCWQR-STQMWFEESA-N	1	1	274.345	2.172	40	0		CEABMO
COc1ccc([C@@H]2C[N@H+](C3CCOCC3)CCN2C)cc1	ZINC000257282442	394595570	/nfs/dbraw/zinc/59/55/70/394595570.db2.gz	OTUGADXVVWEWDK-KRWDZBQOSA-N	1	1	290.407	2.163	40	0		CEABMO
Cc1cc(-c2cc[nH]n2)nc([C@@H]2CCCC[N@H+]2C)n1	ZINC000257253108	394595636	/nfs/dbraw/zinc/59/56/36/394595636.db2.gz	JXPHMDWXSOHVKM-ZDUSSCGKSA-N	1	1	257.341	2.332	40	0		CEABMO
Cc1cc(-c2cc[nH]n2)nc([C@@H]2CCCC[N@@H+]2C)n1	ZINC000257253108	394595639	/nfs/dbraw/zinc/59/56/39/394595639.db2.gz	JXPHMDWXSOHVKM-ZDUSSCGKSA-N	1	1	257.341	2.332	40	0		CEABMO
[NH3+][C@@H]1C(=O)N(Cc2ccc(F)cc2)[C@@H]1c1ccccc1	ZINC000072228178	394596340	/nfs/dbraw/zinc/59/63/40/394596340.db2.gz	AMOPJKHITPCODS-LSDHHAIUSA-N	1	1	270.307	2.237	40	0		CEABMO
COc1ccc(C[C@@H]([NH3+])C(=O)OCCc2ccccc2)cc1	ZINC000006484334	170205030	/nfs/dbraw/zinc/20/50/30/170205030.db2.gz	LQAKRDXSVHMAMG-QGZVFWFLSA-N	1	1	299.370	2.351	40	0		CEABMO
C[C@H]([NH+]1CCOCC1)[C@@](O)(c1ccccc1)c1ccccn1	ZINC000013099521	170531565	/nfs/dbraw/zinc/53/15/65/170531565.db2.gz	RCUZQOAGXSJBDW-MAUKXSAKSA-N	1	1	298.386	2.038	40	0	in-vitro	CEABMO
CC[C@@H](Oc1cccc(C)c1)C(=O)N1CC[NH+](CC)CC1	ZINC000020461781	171209667	/nfs/dbraw/zinc/20/96/67/171209667.db2.gz	CDFUUSOWTDUOPW-MRXNPFEDSA-N	1	1	290.407	2.317	40	0		CEABMO
CNc1ncccc1C[N@@H+]1CCCC[C@H]1c1ccnc(N)n1	ZINC000072386207	176391372	/nfs/dbraw/zinc/39/13/72/176391372.db2.gz	QVBIRDPMMALNBH-AWEZNQCLSA-N	1	1	298.394	2.223	40	0		CEABMO
CNc1ncccc1C[N@H+]1CCCC[C@H]1c1ccnc(N)n1	ZINC000072386207	176391374	/nfs/dbraw/zinc/39/13/74/176391374.db2.gz	QVBIRDPMMALNBH-AWEZNQCLSA-N	1	1	298.394	2.223	40	0		CEABMO
COc1cccc(CN2C[C@H]3CCC[N@H+]3C[C@@H]2C)c1OC	ZINC000072397520	176394869	/nfs/dbraw/zinc/39/48/69/176394869.db2.gz	JKVMYIBCSWDHCB-DZGCQCFKSA-N	1	1	290.407	2.372	40	0		CEABMO
CCOC[C@@H]1Cn2nccc2C[N@H+](Cc2ccoc2)C1	ZINC000096059207	276331906	/nfs/dbraw/zinc/33/19/06/276331906.db2.gz	IZAPXTJTTZFZMG-AWEZNQCLSA-N	1	1	275.352	2.145	40	0		CEABMO
CCOC[C@@H]1Cn2nccc2C[N@@H+](Cc2ccoc2)C1	ZINC000096059207	276331908	/nfs/dbraw/zinc/33/19/08/276331908.db2.gz	IZAPXTJTTZFZMG-AWEZNQCLSA-N	1	1	275.352	2.145	40	0		CEABMO
C[NH+](C)Cc1ccccc1I	ZINC000016124458	276812685	/nfs/dbraw/zinc/81/26/85/276812685.db2.gz	ACPMQWGJRGTBGB-UHFFFAOYSA-N	1	1	261.106	2.353	40	0		CEABMO
CO[C@H]1CC[C@H]2[C@H]1OCC[N@@H+]2Cc1ccc(F)cc1	ZINC000096041919	277343478	/nfs/dbraw/zinc/34/34/78/277343478.db2.gz	UGXOQTUIIMBSCD-SOUVJXGZSA-N	1	1	265.328	2.204	40	0		CEABMO
CO[C@H]1CC[C@H]2[C@H]1OCC[N@H+]2Cc1ccc(F)cc1	ZINC000096041919	277343480	/nfs/dbraw/zinc/34/34/80/277343480.db2.gz	UGXOQTUIIMBSCD-SOUVJXGZSA-N	1	1	265.328	2.204	40	0		CEABMO
COC(=O)[C@@H]1C[C@H]2Cc3c4ccccc4[nH]c3C[N@H+]2C1	ZINC000095828947	277371095	/nfs/dbraw/zinc/37/10/95/277371095.db2.gz	OVDBJAVMIFIMFA-MNOVXSKESA-N	1	1	270.332	2.088	40	0		CEABMO
Cc1nnc2n1[C@H]1C[N@H+](C[C@H]3CC=CCC3)C[C@H]1CC2	ZINC000019288357	279242045	/nfs/dbraw/zinc/24/20/45/279242045.db2.gz	PZTLEYNTALQUML-ZNMIVQPWSA-N	1	1	272.396	2.362	40	0		CEABMO
c1cnc(N2CCCC2)c(-c2noc(C[NH+]3CCCC3)n2)c1	ZINC000072398390	526541860	/nfs/dbraw/zinc/54/18/60/526541860.db2.gz	IEQVNLSYPBDWCH-UHFFFAOYSA-N	1	1	299.378	2.328	40	0		CEABMO
CO[C@H]1CC[C@H]2[C@H]1OCC[N@@H+]2Cc1cccs1	ZINC000096041918	185070420	/nfs/dbraw/zinc/07/04/20/185070420.db2.gz	JUUIHGWUWWFIBK-RWMBFGLXSA-N	1	1	253.367	2.126	40	0		CEABMO
CO[C@H]1CC[C@H]2[C@H]1OCC[N@H+]2Cc1cccs1	ZINC000096041918	185070421	/nfs/dbraw/zinc/07/04/21/185070421.db2.gz	JUUIHGWUWWFIBK-RWMBFGLXSA-N	1	1	253.367	2.126	40	0		CEABMO
CC1(C)[C@H]2CC[C@]1(C)[C@H](NC(=O)CC[NH+]1CCOCC1)C2	ZINC000033319424	361775974	/nfs/dbraw/zinc/77/59/74/361775974.db2.gz	YXXRVERJCNRUEY-JJRVBVJISA-N	1	1	294.439	2.040	40	0		CEABMO
O=C(c1cccnc1)N1CCC[C@]2(CC[N@@H+](CC3CC3)C2)C1	ZINC000096047061	185073645	/nfs/dbraw/zinc/07/36/45/185073645.db2.gz	NXJFTFCNSBHZHN-GOSISDBHSA-N	1	1	299.418	2.420	40	0		CEABMO
C[N@H+]1CCCCC12CCN(C(=O)c1ccncc1)CC2	ZINC000096051205	185074527	/nfs/dbraw/zinc/07/45/27/185074527.db2.gz	BJMZLQTYYPFQCZ-UHFFFAOYSA-N	1	1	273.380	2.172	40	0		CEABMO
CC[C@@H]1[N@@H+](Cc2ccncc2)CCC[C@]12CCC(=O)N2C	ZINC000096052422	185075058	/nfs/dbraw/zinc/07/50/58/185075058.db2.gz	OEJAVFFXJVVWCO-RDJZCZTQSA-N	1	1	287.407	2.447	40	0		CEABMO
O=C(c1ccco1)N1C[C@H]2CCC[N@@H+](CC3CC3)[C@H]2C1	ZINC000096054199	185076099	/nfs/dbraw/zinc/07/60/99/185076099.db2.gz	YJPZIYFLUBHQIX-KGLIPLIRSA-N	1	1	274.364	2.226	40	0		CEABMO
c1cncc(CN2CC[C@H]3[C@H]2CC[N@H+]3Cc2cccnc2)c1	ZINC000096055839	185076113	/nfs/dbraw/zinc/07/61/13/185076113.db2.gz	ZOXMDKOUXSTWNU-HDICACEKSA-N	1	1	294.402	2.325	40	0		CEABMO
c1cncc(CN2CC[C@@H]3[C@@H]2CC[N@@H+]3Cc2cccnc2)c1	ZINC000096055839	185076114	/nfs/dbraw/zinc/07/61/14/185076114.db2.gz	ZOXMDKOUXSTWNU-HDICACEKSA-N	1	1	294.402	2.325	40	0		CEABMO
c1cncc(CN2CC[C@@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)c1	ZINC000096055839	185076115	/nfs/dbraw/zinc/07/61/15/185076115.db2.gz	ZOXMDKOUXSTWNU-HDICACEKSA-N	1	1	294.402	2.325	40	0		CEABMO
COC[C@H]1CC[C@@H]2[C@@H](CC[N@H+]2Cc2ccc(OC)cc2)O1	ZINC000096056380	185077258	/nfs/dbraw/zinc/07/72/58/185077258.db2.gz	UOZXZUPJFRUUCN-BRWVUGGUSA-N	1	1	291.391	2.464	40	0		CEABMO
c1cc(CO[C@@H]2CC[C@H]3[C@H]2OCC[N@H+]3CC2CC2)ccn1	ZINC000096058006	185079210	/nfs/dbraw/zinc/07/92/10/185079210.db2.gz	LFOWWASNEKEAAP-GVDBMIGSSA-N	1	1	288.391	2.240	40	0		CEABMO
c1ccc(N2CC[C@]3(C2)COCC[N@H+](CC2CC2)C3)nc1	ZINC000096062488	185082446	/nfs/dbraw/zinc/08/24/46/185082446.db2.gz	QKXNXKFYCODMCP-KRWDZBQOSA-N	1	1	287.407	2.020	40	0		CEABMO
COCC[N@H+]1CC[C@H](OCC2CC2)[C@@H]1Cc1ccncc1	ZINC000096070004	185085262	/nfs/dbraw/zinc/08/52/62/185085262.db2.gz	SPEJJSLEXYQSMK-IRXDYDNUSA-N	1	1	290.407	2.140	40	0		CEABMO
C[C@H]1CO[C@@]2(CC[N@H+](Cc3ccncc3F)C2)C1	ZINC000096071988	185087359	/nfs/dbraw/zinc/08/73/59/185087359.db2.gz	GKZYVOPGVFRSEM-RISCZKNCSA-N	1	1	250.317	2.222	40	0		CEABMO
C[C@H]1CO[C@@]2(CC[N@@H+](Cc3ccncc3F)C2)C1	ZINC000096071988	185087360	/nfs/dbraw/zinc/08/73/60/185087360.db2.gz	GKZYVOPGVFRSEM-RISCZKNCSA-N	1	1	250.317	2.222	40	0		CEABMO
Cc1nc(COCc2cnc3n2CC[N@H+](C)[C@H]3C)cs1	ZINC000096109867	185099603	/nfs/dbraw/zinc/09/96/03/185099603.db2.gz	ODWVECWOCMMKOC-JTQLQIEISA-N	1	1	292.408	2.371	40	0		CEABMO
CCOC[C@]12COC[C@H]1C[N@@H+](Cc1ccc(F)c(F)c1)C2	ZINC000096108672	185100369	/nfs/dbraw/zinc/10/03/69/185100369.db2.gz	MXTGTQRIINLVPX-CZUORRHYSA-N	1	1	297.345	2.450	40	0		CEABMO
CO[C@@H]1CO[C@]2(C1)CCC[N@@H+](Cc1c(C)noc1C)C2	ZINC000096110853	185101099	/nfs/dbraw/zinc/10/10/99/185101099.db2.gz	KETKEZNFVJJWFM-ZFWWWQNUSA-N	1	1	280.368	2.061	40	0		CEABMO
Cc1ccc(N2CCN(C(=O)OC(C)(C)C)CC2)[nH+]c1	ZINC000040434887	361993023	/nfs/dbraw/zinc/99/30/23/361993023.db2.gz	CFVAYMJNEFGOFR-UHFFFAOYSA-N	1	1	277.368	2.447	40	0		CEABMO
CCOC(=O)c1ccc(Nc2cc(C)[nH+]c(N)n2)cc1	ZINC000049468252	362363935	/nfs/dbraw/zinc/36/39/35/362363935.db2.gz	FQSUNJXICIJVCS-UHFFFAOYSA-N	1	1	272.308	2.288	40	0		CEABMO
CC[NH+](CC)CC[C@@H]1CN(CC2CC2)Cc2ccnn21	ZINC000585112133	345005852	/nfs/dbraw/zinc/00/58/52/345005852.db2.gz	IMLUIIWVBYKXKK-MRXNPFEDSA-N	1	1	276.428	2.382	40	0		CEABMO
CC[NH+]1CCN(c2ccc(-n3cnnc3)cc2Cl)CC1	ZINC000057332396	362577411	/nfs/dbraw/zinc/57/74/11/362577411.db2.gz	QTOLWBCOSZEDDF-UHFFFAOYSA-N	1	1	291.786	2.063	40	0		CEABMO
CC(C)CCO[C@H]1COCC[N@H+](Cc2ccccn2)C1	ZINC000085436031	179062983	/nfs/dbraw/zinc/06/29/83/179062983.db2.gz	ZQIJHOFEKOUDBW-MRXNPFEDSA-N	1	1	278.396	2.345	40	0	biogenic,in-vitro	CEABMO
CC(C)CCO[C@H]1COCC[N@@H+](Cc2ccccn2)C1	ZINC000085436031	179062985	/nfs/dbraw/zinc/06/29/85/179062985.db2.gz	ZQIJHOFEKOUDBW-MRXNPFEDSA-N	1	1	278.396	2.345	40	0	biogenic,in-vitro	CEABMO
Cc1cc(C)nc([C@@H]2CC[N@H+](C3CCOCC3)C2)n1	ZINC000072385946	363133066	/nfs/dbraw/zinc/13/30/66/363133066.db2.gz	XNJSSLPUZHOOMS-CYBMUJFWSA-N	1	1	261.369	2.062	40	0		CEABMO
CC(C)[N@H+](Cc1ccccc1)C[C@H]1CCN(CCO)C1	ZINC000079414278	363596874	/nfs/dbraw/zinc/59/68/74/363596874.db2.gz	YXJXMEXEEPTZLI-KRWDZBQOSA-N	1	1	276.424	2.211	40	0		CEABMO
CC[N@H+](Cc1ccccc1)C1CC[NH+](CC(=O)[O-])CC1	ZINC000079416095	363598796	/nfs/dbraw/zinc/59/87/96/363598796.db2.gz	UFZDJRQCPWPZAI-UHFFFAOYSA-N	1	1	276.380	2.058	40	0		CEABMO
CC[N@@H+](Cc1ccccc1)C1CC[NH+](CC(=O)[O-])CC1	ZINC000079416095	363598799	/nfs/dbraw/zinc/59/87/99/363598799.db2.gz	UFZDJRQCPWPZAI-UHFFFAOYSA-N	1	1	276.380	2.058	40	0		CEABMO
CC[N@H+](Cc1ccccc1)C[C@@H]1CCC[NH+](CC(=O)[O-])C1	ZINC000079416098	363599168	/nfs/dbraw/zinc/59/91/68/363599168.db2.gz	WOFLSSMFJFPPCE-INIZCTEOSA-N	1	1	290.407	2.305	40	0		CEABMO
CC[NH+](Cc1ccccc1)C[C@@H]1CCC[N@H+](CC(=O)[O-])C1	ZINC000079416098	363599173	/nfs/dbraw/zinc/59/91/73/363599173.db2.gz	WOFLSSMFJFPPCE-INIZCTEOSA-N	1	1	290.407	2.305	40	0		CEABMO
CC[NH+](Cc1ccccc1)C[C@@H]1CCC[N@@H+](CC(=O)[O-])C1	ZINC000079416098	363599179	/nfs/dbraw/zinc/59/91/79/363599179.db2.gz	WOFLSSMFJFPPCE-INIZCTEOSA-N	1	1	290.407	2.305	40	0		CEABMO
S=c1[nH]cnc2c1C[N@@H+](Cc1ccccc1)CC2	ZINC000006575026	361336899	/nfs/dbraw/zinc/33/68/99/361336899.db2.gz	XEDNNPJNCXRMLD-UHFFFAOYSA-N	1	1	257.362	2.324	40	0		CEABMO
Cc1ccc2cc(C[NH2+]Cc3ccco3)c3nnnn3c2c1	ZINC000013998155	361445871	/nfs/dbraw/zinc/44/58/71/361445871.db2.gz	KZJRCLIQAHOBFO-UHFFFAOYSA-N	1	1	293.330	2.469	40	0		CEABMO
Cc1cc(=O)[nH]c([C@@H]2CC[N@@H+](Cc3ccccc3F)C2)n1	ZINC000019118478	361520108	/nfs/dbraw/zinc/52/01/08/361520108.db2.gz	XPDDWESROHOWLD-CYBMUJFWSA-N	1	1	287.338	2.207	40	0		CEABMO
CCN(CC)CC[NH2+]Cc1ccc(OC)c(OC)c1OC	ZINC000019919150	361567784	/nfs/dbraw/zinc/56/77/84/361567784.db2.gz	YLGLWFDGTDAHLI-UHFFFAOYSA-N	1	1	296.411	2.144	40	0		CEABMO
O[C@H]1CC[N@@H+](Cc2cccc(F)c2)[C@H]1Cc1cccnc1	ZINC000096200465	364411173	/nfs/dbraw/zinc/41/11/73/364411173.db2.gz	QJGNHSCRXUDRHG-IRXDYDNUSA-N	1	1	286.350	2.399	40	0		CEABMO
Cc1cc(C(=O)N2CC[C@@]3(C2)CCC[N@H+](C)C3)c(C)o1	ZINC000096215246	364412734	/nfs/dbraw/zinc/41/27/34/364412734.db2.gz	CWOYANSJXZHWHZ-INIZCTEOSA-N	1	1	276.380	2.454	40	0		CEABMO
CCC1=N[C@@]2(CC[C@@H]3C[N@@H+](CC(C)C)C[C@@H]32)C(=O)N1CC	ZINC000096261619	364418005	/nfs/dbraw/zinc/41/80/05/364418005.db2.gz	NINHQLXMZRZIFR-JKIFEVAISA-N	1	1	291.439	2.394	40	0		CEABMO
CNC(=O)N[C@H]1c2cccc(F)c2[C@H]2C[N@@H+](C(C)C)C[C@@H]12	ZINC000096261714	364418392	/nfs/dbraw/zinc/41/83/92/364418392.db2.gz	QVRUSRPEZSWQGA-ZOWXZIJZSA-N	1	1	291.370	2.233	40	0		CEABMO
OC[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C(F)(F)F	ZINC000102225120	364587474	/nfs/dbraw/zinc/58/74/74/364587474.db2.gz	JVJIYCXIYVNRHB-NEPJUHHUSA-N	1	1	259.271	2.289	40	0		CEABMO
C[N@H+]1CC[C@]12CCCN(C(=O)CCc1ccccc1)C2	ZINC000585101744	367177120	/nfs/dbraw/zinc/17/71/20/367177120.db2.gz	DHIGYMMVLQXNMP-KRWDZBQOSA-N	1	1	272.392	2.316	40	0		CEABMO
CC(C)C[N@H+]1CCC[C@]2(CN(Cc3cncs3)C2=O)C1	ZINC000585099632	367177660	/nfs/dbraw/zinc/17/76/60/367177660.db2.gz	TXXHTLMLUZJPQC-OAHLLOKOSA-N	1	1	293.436	2.224	40	0		CEABMO
CC(C)N1C[C@]2(CCC[N@@H+](CC3CC(F)(F)C3)C2)C1=O	ZINC000585099334	367177920	/nfs/dbraw/zinc/17/79/20/367177920.db2.gz	FYTLARQUYQUGKZ-CQSZACIVSA-N	1	1	286.366	2.365	40	0		CEABMO
CC(C)[NH+]1CC2(C1)C[C@H](CCOc1cnccn1)CCO2	ZINC000248171984	371167990	/nfs/dbraw/zinc/16/79/90/371167990.db2.gz	SNGONGPVVKYGGZ-CQSZACIVSA-N	1	1	291.395	2.135	40	0		CEABMO
C[N@@H+](CC1CCOCC1)[C@H]1CCCN(c2ccccn2)C1	ZINC000257319553	371613866	/nfs/dbraw/zinc/61/38/66/371613866.db2.gz	VSZPZYAXLFDEQB-INIZCTEOSA-N	1	1	289.423	2.409	40	0		CEABMO
CCn1nccc1C[NH2+]Cc1ccnn1CC(C)C	ZINC000256053377	190004904	/nfs/dbraw/zinc/00/49/04/190004904.db2.gz	REQNPDUHGWFNFO-UHFFFAOYSA-N	1	1	261.373	2.045	40	0		CEABMO
CCCn1cc(C[NH2+]CCN(CC)CC)c(C)n1	ZINC000256054781	190005383	/nfs/dbraw/zinc/00/53/83/190005383.db2.gz	XSXNDKDOKBDHLO-UHFFFAOYSA-N	1	1	252.406	2.033	40	0		CEABMO
CCn1nccc1C[NH2+]Cc1cnn(CC(C)C)c1	ZINC000256053222	190004377	/nfs/dbraw/zinc/00/43/77/190004377.db2.gz	QNYMGBKYKOCIHI-UHFFFAOYSA-N	1	1	261.373	2.045	40	0		CEABMO
CCCn1nccc1C[NH2+]Cc1c(C)nn(CC)c1F	ZINC000256054811	190005689	/nfs/dbraw/zinc/00/56/89/190005689.db2.gz	XWXZBRPAPYOPLU-UHFFFAOYSA-N	1	1	279.363	2.247	40	0		CEABMO
CC(C)[N@H+]1CCC[C@H](c2nccnc2-c2ccnn2C)C1	ZINC000257229033	190016107	/nfs/dbraw/zinc/01/61/07/190016107.db2.gz	FWKKCMXBDLXBSK-ZDUSSCGKSA-N	1	1	285.395	2.465	40	0		CEABMO
CNc1cc([C@@H]2CCC[N@@H+](Cc3ccn(C)n3)C2)ccn1	ZINC000257231903	190016671	/nfs/dbraw/zinc/01/66/71/190016671.db2.gz	GIQNUHVJIBEEDY-CQSZACIVSA-N	1	1	285.395	2.236	40	0		CEABMO
C[N@H+]1CCC[C@@H](c2ccnc(C(=O)NCC3CC3)c2)C1	ZINC000257245184	190019154	/nfs/dbraw/zinc/01/91/54/190019154.db2.gz	IOKONQJFVQYGPM-CQSZACIVSA-N	1	1	273.380	2.031	40	0		CEABMO
CCc1nc(C)c(C[N@H+]2CCC[C@@H](c3cc[nH]n3)C2)[nH]1	ZINC000257255008	190021225	/nfs/dbraw/zinc/02/12/25/190021225.db2.gz	KFSNPQLOQKEEJX-GFCCVEGCSA-N	1	1	273.384	2.383	40	0		CEABMO
Cc1cc(N)cc([C@@H]2CN(Cc3cscn3)CCO2)[nH+]1	ZINC000257281733	190026564	/nfs/dbraw/zinc/02/65/64/190026564.db2.gz	OQTGVIFSQPWNMX-AWEZNQCLSA-N	1	1	290.392	2.002	40	0		CEABMO
O[C@H]1CC[N@@H+](Cc2ccnc3ccccc23)C[C@@]12CCCO2	ZINC000257297520	190029768	/nfs/dbraw/zinc/02/97/68/190029768.db2.gz	RHPZAQGNZZTMLS-ROUUACIJSA-N	1	1	298.386	2.351	40	0		CEABMO
CC(C)n1nccc1C[N@H+]1CC[C@@H](c2cc[nH]n2)C1	ZINC000257309925	190032227	/nfs/dbraw/zinc/03/22/27/190032227.db2.gz	UCXWGLNYYFUCHC-GFCCVEGCSA-N	1	1	259.357	2.177	40	0		CEABMO
CC(C)[N@H+]1CC[C@H](Cc2cc(-c3nccn3C)ncn2)C1	ZINC000257321337	190033163	/nfs/dbraw/zinc/03/31/63/190033163.db2.gz	WBFAPNGCVMCNKC-CYBMUJFWSA-N	1	1	285.395	2.150	40	0		CEABMO
CO[C@H]1CC[N@@H+](Cc2ccnn2C(C)C)C[C@@]12CCCO2	ZINC000257336986	190036226	/nfs/dbraw/zinc/03/62/26/190036226.db2.gz	YQXJMHIEIZADFK-HOTGVXAUSA-N	1	1	293.411	2.234	40	0		CEABMO
CN(C)c1cc([C@H]2CCC[N@@H+](Cc3ccn(C)n3)C2)ccn1	ZINC000257340587	190037301	/nfs/dbraw/zinc/03/73/01/190037301.db2.gz	ZGUTVNQPEOVQEB-HNNXBMFYSA-N	1	1	299.422	2.261	40	0		CEABMO
CN(C)C(=O)N1CC[C@]2(c3ccccc3)CC[N@@H+](C)[C@@H]2C1	ZINC000306136593	376541540	/nfs/dbraw/zinc/54/15/40/376541540.db2.gz	PXSZZMGCICPJRP-WBVHZDCISA-N	1	1	287.407	2.016	40	0		CEABMO
CC(C)C[N@H+]1CC[C@@H]2[C@@H]1CCN2C(=O)c1ccoc1	ZINC000096184275	256814870	/nfs/dbraw/zinc/81/48/70/256814870.db2.gz	CNFOJVWZAWTFOX-UONOGXRCSA-N	1	1	262.353	2.224	40	0		CEABMO
CO[C@@H]1CCN(Cc2ccoc2)[C@@H]2C[N@@H+](CC3CC3)C[C@@H]21	ZINC000096208899	256824454	/nfs/dbraw/zinc/82/44/54/256824454.db2.gz	GBDQZUMWGULCLB-GVDBMIGSSA-N	1	1	290.407	2.211	40	0		CEABMO
CC(C)[N@H+]1C[C@@H]2Cc3nc(NCC4CC4)ncc3[C@H]2C1	ZINC000306144974	394513832	/nfs/dbraw/zinc/51/38/32/394513832.db2.gz	ZTUHRCQNILDEKU-JSGCOSHPSA-N	1	1	272.396	2.278	40	0		CEABMO
CC[N@H+]1CCC[C@H]1c1ccc(N2CCOCC2)nc1	ZINC000072216154	394593684	/nfs/dbraw/zinc/59/36/84/394593684.db2.gz	AGEWXVOSXOUIDE-AWEZNQCLSA-N	1	1	261.369	2.075	40	0		CEABMO
COc1ccc(N2C(=O)[C@H]([NH3+])[C@@H]2c2cccc(OC)c2)cc1	ZINC000072227161	394595578	/nfs/dbraw/zinc/59/55/78/394595578.db2.gz	MVYYIMXSSCWNDH-CVEARBPZSA-N	1	1	298.342	2.119	40	0		CEABMO
CC(C)[N@H+]1CCC[C@@H](c2nccnc2-c2cn[nH]c2)C1	ZINC000072382189	394598190	/nfs/dbraw/zinc/59/81/90/394598190.db2.gz	YAPDVDCZNCJGEG-GFCCVEGCSA-N	1	1	271.368	2.455	40	0		CEABMO
CC(C)[N@H+](C)C[C@H]1C[C@@H]2CN(Cc3ccoc3)C[C@@H]2O1	ZINC000096100359	394677309	/nfs/dbraw/zinc/67/73/09/394677309.db2.gz	SKMYFPBVPBAZDP-OAGGEKHMSA-N	1	1	278.396	2.209	40	0		CEABMO
CC(C)[N@@H+](C)C[C@H]1C[C@@H]2CN(Cc3ccoc3)C[C@@H]2O1	ZINC000096100359	394677312	/nfs/dbraw/zinc/67/73/12/394677312.db2.gz	SKMYFPBVPBAZDP-OAGGEKHMSA-N	1	1	278.396	2.209	40	0		CEABMO
Cc1ccc(NC(=O)NC[C@H]2CCC[N@H+](C)C2)cc1	ZINC000009876605	170388400	/nfs/dbraw/zinc/38/84/00/170388400.db2.gz	BERVLBQEFXJNPB-CYBMUJFWSA-N	1	1	261.369	2.458	40	0		CEABMO
CCCNC(=O)c1ccc(Cn2cc[nH+]c2C)cc1	ZINC000038857518	174158237	/nfs/dbraw/zinc/15/82/37/174158237.db2.gz	NNDRUQBSISRWNW-UHFFFAOYSA-N	1	1	257.337	2.380	40	0		CEABMO
CNc1cncc([C@@H]2CCC[N@@H+]2Cc2cccnc2NC)n1	ZINC000072386196	176391355	/nfs/dbraw/zinc/39/13/55/176391355.db2.gz	TZVOXPGSCHEUMV-AWEZNQCLSA-N	1	1	298.394	2.292	40	0		CEABMO
CNc1cncc([C@@H]2CCC[N@H+]2Cc2cccnc2NC)n1	ZINC000072386196	176391356	/nfs/dbraw/zinc/39/13/56/176391356.db2.gz	TZVOXPGSCHEUMV-AWEZNQCLSA-N	1	1	298.394	2.292	40	0		CEABMO
C[N@H+]1CCC[C@@H](c2ccc(NCC3(C)COC3)cn2)C1	ZINC000072386983	176392896	/nfs/dbraw/zinc/39/28/96/176392896.db2.gz	FOWGCEQSLDVALK-CYBMUJFWSA-N	1	1	275.396	2.339	40	0		CEABMO
COc1cc2c(cc1OC)[C@@H](c1cc(C)no1)[NH2+]CC2	ZINC000072397744	176395524	/nfs/dbraw/zinc/39/55/24/176395524.db2.gz	SNBHEEXWVLYICK-HNNXBMFYSA-N	1	1	274.320	2.235	40	0		CEABMO
O[C@@H]1CCC[N@H+](Cc2ccc(Sc3ncccn3)o2)C1	ZINC000072397817	176395764	/nfs/dbraw/zinc/39/57/64/176395764.db2.gz	NOYUCLORMBMNJA-LLVKDONJSA-N	1	1	291.376	2.178	40	0		CEABMO
O[C@@H]1CCC[N@@H+](Cc2ccc(Sc3ncccn3)o2)C1	ZINC000072397817	176395765	/nfs/dbraw/zinc/39/57/65/176395765.db2.gz	NOYUCLORMBMNJA-LLVKDONJSA-N	1	1	291.376	2.178	40	0		CEABMO
CC[N@H+]1CCc2nc(NCc3ccccc3)ncc2C1	ZINC000072415044	176399754	/nfs/dbraw/zinc/39/97/54/176399754.db2.gz	APBDSALWQYWDMD-UHFFFAOYSA-N	1	1	268.364	2.467	40	0		CEABMO
CCO[C@H]1C[N@@H+](Cc2ccco2)[C@@H]2CCCO[C@@H]21	ZINC000096057429	276359962	/nfs/dbraw/zinc/35/99/62/276359962.db2.gz	IQDBIHWFHKNVQC-RDBSUJKOSA-N	1	1	251.326	2.048	40	0		CEABMO
C[N@H+]1CCc2nc(-c3ccc(Cl)cc3)[nH]c(=O)c2C1	ZINC000139230585	277186880	/nfs/dbraw/zinc/18/68/80/277186880.db2.gz	SPCRZPFTOGRHNP-UHFFFAOYSA-N	1	1	275.739	2.078	40	0		CEABMO
C[N@H+]1[C@H](c2ccccc2)C[C@]2(C)NC(=O)CCC[C@H]12	ZINC000257265858	277215583	/nfs/dbraw/zinc/21/55/83/277215583.db2.gz	MAQSVTBHJAZEQD-DZKIICNBSA-N	1	1	258.365	2.491	40	0		CEABMO
CC(C)(C)OC(=O)N(C[C@H]1CCCC[N@H+]1CCO)C1CC1	ZINC000079408222	278377765	/nfs/dbraw/zinc/37/77/65/278377765.db2.gz	OFZATQAUJWWBLP-CQSZACIVSA-N	1	1	298.427	2.233	40	0		CEABMO
C[C@H]1Cc2ccccc2N1C(=O)[C@@H]1CCC[N@@H+](C)C1	ZINC000082337168	280031116	/nfs/dbraw/zinc/03/11/16/280031116.db2.gz	KQPIBFWLXXQLNF-GXTWGEPZSA-N	1	1	258.365	2.306	40	0		CEABMO
COc1cccc([C@H]([NH3+])c2nc(-c3ccco3)n[nH]2)c1	ZINC000095533504	185007627	/nfs/dbraw/zinc/00/76/27/185007627.db2.gz	VEVQFIYKOGPUHM-LBPRGKRZSA-N	1	1	270.292	2.121	40	0		CEABMO
CCCn1cc(C[N@H+]2CCC[C@H](c3cc[nH]n3)C2)cn1	ZINC000121227062	365537188	/nfs/dbraw/zinc/53/71/88/365537188.db2.gz	IATGUWSQRPVGLW-AWEZNQCLSA-N	1	1	273.384	2.396	40	0		CEABMO
C[N@H+]1CC[C@H]2OCCC[C@]2(COc2ncccc2F)C1	ZINC000096040484	185068838	/nfs/dbraw/zinc/06/88/38/185068838.db2.gz	JDMVDVDTOQKFQM-UKRRQHHQSA-N	1	1	280.343	2.100	40	0		CEABMO
O=C1CC[C@]2(CCC[N@H+](Cc3ccc(F)cc3)CC2)N1	ZINC000096047453	185072880	/nfs/dbraw/zinc/07/28/80/185072880.db2.gz	UQIAJWMACFJVBU-INIZCTEOSA-N	1	1	276.355	2.460	40	0		CEABMO
CC[C@@H]1[N@@H+](Cc2ccccn2)CCC[C@]12CCC(=O)N2C	ZINC000096052420	185073704	/nfs/dbraw/zinc/07/37/04/185073704.db2.gz	VNWJYZFXJXAKKT-RDJZCZTQSA-N	1	1	287.407	2.447	40	0		CEABMO
CC[C@@H]1[N@@H+](Cc2ccccn2)CCC[C@]12CCC(=O)N2	ZINC000096052397	185074976	/nfs/dbraw/zinc/07/49/76/185074976.db2.gz	MKXDQDVUKNQPCA-HOCLYGCPSA-N	1	1	273.380	2.105	40	0		CEABMO
c1coc(C[N@H+]2C[C@H]3CN(Cc4ccccn4)C[C@H]3C2)c1	ZINC000096053776	185075022	/nfs/dbraw/zinc/07/50/22/185075022.db2.gz	JEGHGWHLFFTGSN-GASCZTMLSA-N	1	1	283.375	2.238	40	0		CEABMO
c1coc(CN2C[C@@H]3C[N@@H+](Cc4ccccn4)C[C@@H]3C2)c1	ZINC000096053776	185075024	/nfs/dbraw/zinc/07/50/24/185075024.db2.gz	JEGHGWHLFFTGSN-GASCZTMLSA-N	1	1	283.375	2.238	40	0		CEABMO
c1coc(CN2C[C@@H]3C[N@H+](Cc4ccccn4)C[C@@H]3C2)c1	ZINC000096053776	185075025	/nfs/dbraw/zinc/07/50/25/185075025.db2.gz	JEGHGWHLFFTGSN-GASCZTMLSA-N	1	1	283.375	2.238	40	0		CEABMO
CN(C)[C@@H]1C[N@@H+](Cc2cccs2)[C@@H]2CCCO[C@H]12	ZINC000096056315	185077123	/nfs/dbraw/zinc/07/71/23/185077123.db2.gz	BNCPLSDIGAZGGC-MCIONIFRSA-N	1	1	266.410	2.042	40	0		CEABMO
C[NH+](C)[C@@H]1CN(Cc2cccs2)[C@@H]2CCCO[C@H]12	ZINC000096056315	185077124	/nfs/dbraw/zinc/07/71/24/185077124.db2.gz	BNCPLSDIGAZGGC-MCIONIFRSA-N	1	1	266.410	2.042	40	0		CEABMO
CC[N@H+]1CCOCC12CCN(C(=O)c1ccsc1)CC2	ZINC000096074601	185088464	/nfs/dbraw/zinc/08/84/64/185088464.db2.gz	NWDZYMOHPWTPSD-UHFFFAOYSA-N	1	1	294.420	2.075	40	0		CEABMO
Cc1nc(C)c2c(n1)CC[N@H+](Cc1ccncc1)CC2	ZINC000096083771	185092790	/nfs/dbraw/zinc/09/27/90/185092790.db2.gz	SQXMAJCRPVOZBL-UHFFFAOYSA-N	1	1	268.364	2.089	40	0		CEABMO
COCC[C@@H]1CO[C@@]2(C1)CCC[N@@H+](Cc1ccncc1)C2	ZINC000096089851	185095233	/nfs/dbraw/zinc/09/52/33/185095233.db2.gz	HVAHXPKUFJYZSK-DLBZAZTESA-N	1	1	290.407	2.489	40	0		CEABMO
COC[C@]12COC[C@H]1C[N@@H+](Cc1sccc1C)C2	ZINC000096108640	185099477	/nfs/dbraw/zinc/09/94/77/185099477.db2.gz	GFVVPHCFJZRMRE-TZMCWYRMSA-N	1	1	267.394	2.151	40	0		CEABMO
CC(C)(C)OC(=O)N[C@@H]1CCCN(c2ccc(N)c[nH+]2)C1	ZINC000114036686	344278969	/nfs/dbraw/zinc/27/89/69/344278969.db2.gz	NBTNDUBSJWWOMC-GFCCVEGCSA-N	1	1	292.383	2.157	40	0		CEABMO
OC[C@@H]1CC[N@H+](Cc2ccc(F)c(Br)c2)C1	ZINC000051887061	362443770	/nfs/dbraw/zinc/44/37/70/362443770.db2.gz	FUUDHQFVPQYWMY-SNVBAGLBSA-N	1	1	288.160	2.402	40	0		CEABMO
OC[C@@H]1CC[N@@H+](Cc2ccc(F)c(Br)c2)C1	ZINC000051887061	362443776	/nfs/dbraw/zinc/44/37/76/362443776.db2.gz	FUUDHQFVPQYWMY-SNVBAGLBSA-N	1	1	288.160	2.402	40	0		CEABMO
Cc1nnc2n1[C@H]1C[N@H+](Cc3ccccc3)C[C@H]1CC2	ZINC000019288364	282365631	/nfs/dbraw/zinc/36/56/31/282365631.db2.gz	HVSLYLZPURNMIX-CABCVRRESA-N	1	1	268.364	2.206	40	0		CEABMO
CC1CC(C(=O)N2CC[C@H]3[C@H]2CC[N@H+]3Cc2cccnc2)C1	ZINC000585108115	345005541	/nfs/dbraw/zinc/00/55/41/345005541.db2.gz	KZFCAIRVLAOTLA-MHVXSEJMSA-N	1	1	299.418	2.303	40	0		CEABMO
O[C@]1(COc2ccccc2)COCC[N@H+](C2CCCC2)C1	ZINC000585269043	345009319	/nfs/dbraw/zinc/00/93/19/345009319.db2.gz	IRCJPLBHPGGJNP-KRWDZBQOSA-N	1	1	291.391	2.071	40	0		CEABMO
c1ccc(CO[C@H]2COCC[N@H+](Cc3ccccn3)C2)cc1	ZINC000085436027	179062940	/nfs/dbraw/zinc/06/29/40/179062940.db2.gz	LIRSXAJAKWDMLC-GOSISDBHSA-N	1	1	298.386	2.499	40	0	biogenic,in-vitro	CEABMO
c1ccc(CO[C@H]2COCC[N@@H+](Cc3ccccn3)C2)cc1	ZINC000085436027	179062943	/nfs/dbraw/zinc/06/29/43/179062943.db2.gz	LIRSXAJAKWDMLC-GOSISDBHSA-N	1	1	298.386	2.499	40	0	biogenic,in-vitro	CEABMO
CC(C)(C)OC(=O)N[C@H]1CC[N@H+](Cc2cccnc2)C1	ZINC000067801207	362926015	/nfs/dbraw/zinc/92/60/15/362926015.db2.gz	RHHIPAUQALUPAC-ZDUSSCGKSA-N	1	1	277.368	2.181	40	0		CEABMO
CC(C)(C)OC(=O)N[C@H]1CC[N@@H+](Cc2cccnc2)C1	ZINC000067801207	362926016	/nfs/dbraw/zinc/92/60/16/362926016.db2.gz	RHHIPAUQALUPAC-ZDUSSCGKSA-N	1	1	277.368	2.181	40	0		CEABMO
CNC(=O)[C@@H]1CCC[C@]12CC[N@@H+](Cc1cccs1)C2	ZINC000108534960	186222125	/nfs/dbraw/zinc/22/21/25/186222125.db2.gz	GHRGYHOTMDJJIQ-DZGCQCFKSA-N	1	1	278.421	2.486	40	0		CEABMO
CN(C)c1cccc(C2CCN(c3ncccn3)CC2)[nH+]1	ZINC000072356713	363131865	/nfs/dbraw/zinc/13/18/65/363131865.db2.gz	CZHVRSMVDBJDSG-UHFFFAOYSA-N	1	1	283.379	2.322	40	0		CEABMO
CC(C)[C@H](c1nnnn1C[C@H]1CCCO1)[NH+]1CCCCC1	ZINC000000883953	361194716	/nfs/dbraw/zinc/19/47/16/361194716.db2.gz	UPCNQTQSEZLSPX-ZIAGYGMSSA-N	1	1	293.415	2.035	40	0		CEABMO
Cc1ccc(N2CC[C@@H]3[C@@H]2CC[N@H+]3Cc2cccnc2)nn1	ZINC000096184859	364407458	/nfs/dbraw/zinc/40/74/58/364407458.db2.gz	LLINXBNORFCRTL-CVEARBPZSA-N	1	1	295.390	2.033	40	0		CEABMO
Fc1cnc(N2CCC[C@]3(CC[N@@H+](CC4CC4)C3)C2)nc1	ZINC000096047181	364398223	/nfs/dbraw/zinc/39/82/23/364398223.db2.gz	OGMILMMRXDGYPG-MRXNPFEDSA-N	1	1	290.386	2.318	40	0		CEABMO
c1ccc(C[N@@H+]2C[C@H]3CN(c4ccccn4)C[C@H]3C2)nc1	ZINC000096161574	364404640	/nfs/dbraw/zinc/40/46/40/364404640.db2.gz	OTGJKNCQBBCPLL-GASCZTMLSA-N	1	1	280.375	2.045	40	0		CEABMO
Cc1noc(C)c1C[N@H+]1CCN(C)c2ncccc2C1	ZINC000096198784	364409236	/nfs/dbraw/zinc/40/92/36/364409236.db2.gz	QVMSQOZPPWCPES-UHFFFAOYSA-N	1	1	272.352	2.138	40	0		CEABMO
Cc1noc(C)c1C[N@@H+]1CCN(C)c2ncccc2C1	ZINC000096198784	364409243	/nfs/dbraw/zinc/40/92/43/364409243.db2.gz	QVMSQOZPPWCPES-UHFFFAOYSA-N	1	1	272.352	2.138	40	0		CEABMO
O[C@@H]1CC[N@@H+](Cc2ccsc2)[C@H]1Cc1ccncc1	ZINC000096200277	364409266	/nfs/dbraw/zinc/40/92/66/364409266.db2.gz	XIJBPPCNNHFGAZ-LSDHHAIUSA-N	1	1	274.389	2.321	40	0		CEABMO
Cc1cccnc1N1CC2(C1)CC[N@@H+](Cc1cccnc1)C2	ZINC000096202502	364410747	/nfs/dbraw/zinc/41/07/47/364410747.db2.gz	HQUZGYAFRRDBKL-UHFFFAOYSA-N	1	1	294.402	2.497	40	0		CEABMO
CO[C@@H]1CC[N@@H+](Cc2ccccc2F)[C@H]2CCO[C@@H]21	ZINC000096217218	364413474	/nfs/dbraw/zinc/41/34/74/364413474.db2.gz	ANWIREBJMLWLCP-ZNMIVQPWSA-N	1	1	265.328	2.204	40	0		CEABMO
CC(C)[N@@H+]1C[C@H]2CC[C@@H](C1)N2Cc1nccs1	ZINC000096252555	364417182	/nfs/dbraw/zinc/41/71/82/364417182.db2.gz	SGSQIXQODCDKRH-TXEJJXNPSA-N	1	1	251.399	2.200	40	0		CEABMO
CC(C)n1nc(C[NH+]2CCCCC2)c2c1CN(C)C2	ZINC000096259169	364418556	/nfs/dbraw/zinc/41/85/56/364418556.db2.gz	CHSMSGVGBBJQPM-UHFFFAOYSA-N	1	1	262.401	2.395	40	0		CEABMO
CO[C@@H]1Cn2nccc2C[N@@H+](Cc2cccc3[nH]ccc32)C1	ZINC000247887417	371145313	/nfs/dbraw/zinc/14/53/13/371145313.db2.gz	RYHGMHMVWRJVIR-HNNXBMFYSA-N	1	1	296.374	2.395	40	0		CEABMO
c1cc2n(n1)[C@H](COCc1ccccn1)C[N@@H+](C1CCC1)C2	ZINC000253596802	371530811	/nfs/dbraw/zinc/53/08/11/371530811.db2.gz	WEGRDBDRVJCPME-KRWDZBQOSA-N	1	1	298.390	2.404	40	0		CEABMO
c1cc2n(n1)[C@H](COCc1ccccn1)C[N@H+](C1CCC1)C2	ZINC000253596802	371530814	/nfs/dbraw/zinc/53/08/14/371530814.db2.gz	WEGRDBDRVJCPME-KRWDZBQOSA-N	1	1	298.390	2.404	40	0		CEABMO
CCCn1ccc(C[NH2+]Cc2ccc(O)c(OC)c2)n1	ZINC000256049578	190002509	/nfs/dbraw/zinc/00/25/09/190002509.db2.gz	AMWIYKWYIWSVFV-UHFFFAOYSA-N	1	1	275.352	2.297	40	0		CEABMO
Cc1cccnc1C[N@H+]1C[C@@H](O)[C@H](Oc2ccccc2)C1	ZINC000257230063	190016165	/nfs/dbraw/zinc/01/61/65/190016165.db2.gz	GAPUPISXECDOGW-IAGOWNOFSA-N	1	1	284.359	2.014	40	0		CEABMO
c1c[nH]c(C[NH+]2CCC(Cc3ccncc3)CC2)n1	ZINC000257251839	190019902	/nfs/dbraw/zinc/01/99/02/190019902.db2.gz	JSLZGPJVVAVBPF-UHFFFAOYSA-N	1	1	256.353	2.259	40	0		CEABMO
Cc1c[nH]nc1[C@@H]1CCC[N@@H+](Cc2[nH]cnc2C)C1	ZINC000257282236	190026240	/nfs/dbraw/zinc/02/62/40/190026240.db2.gz	OSZCTUCPMDXIKM-GFCCVEGCSA-N	1	1	259.357	2.129	40	0		CEABMO
CNc1cc([C@H]2CCC[N@H+]2C2CCN(C)CC2)ccn1	ZINC000257288060	190027323	/nfs/dbraw/zinc/02/73/23/190027323.db2.gz	PSQFEDQOAPGJOK-OAHLLOKOSA-N	1	1	274.412	2.354	40	0		CEABMO
c1[nH]nc2nc([C@H]3CCC[N@H+](Cc4cnccn4)C3)ccc12	ZINC000257327801	190034729	/nfs/dbraw/zinc/03/47/29/190034729.db2.gz	XCUCRQQAEUQGGD-ZDUSSCGKSA-N	1	1	294.362	2.128	40	0		CEABMO
Cc1cc(-c2cnc(C[C@@H]3CCC[N@H+](C)C3)cn2)n[nH]1	ZINC000257329384	190035154	/nfs/dbraw/zinc/03/51/54/190035154.db2.gz	XJTOTBKNTIVXLA-LBPRGKRZSA-N	1	1	271.368	2.059	40	0		CEABMO
Cc1ccnc([C@H]2CC[N@@H+](Cc3ncccc3C)C2)n1	ZINC000257332126	190035287	/nfs/dbraw/zinc/03/52/87/190035287.db2.gz	XVWFXHFDFMEDPA-AWEZNQCLSA-N	1	1	268.364	2.478	40	0		CEABMO
Cc1[nH+]ccn1CC(=O)N1CCC[C@@H](Cc2ccccn2)C1	ZINC000257338349	190036544	/nfs/dbraw/zinc/03/65/44/190036544.db2.gz	YWZGNASAEDCXGH-HNNXBMFYSA-N	1	1	298.390	2.068	40	0		CEABMO
CC(C)CC[N@@H+]1C[C@@H]2[C@H](C1)Oc1ccccc1C(=O)N2C	ZINC000514290191	379129246	/nfs/dbraw/zinc/12/92/46/379129246.db2.gz	UYUSWMQGKOQYDI-ZBFHGGJFSA-N	1	1	288.391	2.250	40	0	biogenic,in-vitro	CEABMO
COc1ccc([C@H]2[C@@H]([NH3+])C(=O)N2c2cccc(C)c2)cc1	ZINC000072227401	394595498	/nfs/dbraw/zinc/59/54/98/394595498.db2.gz	JVLQZDFTFIYYDA-CVEARBPZSA-N	1	1	282.343	2.419	40	0		CEABMO
[NH3+][C@@H]1C(=O)N(Cc2ccc(F)cc2)[C@H]1c1ccccc1	ZINC000072228179	394596245	/nfs/dbraw/zinc/59/62/45/394596245.db2.gz	AMOPJKHITPCODS-GJZGRUSLSA-N	1	1	270.307	2.237	40	0		CEABMO
CC[N@H+](Cc1ccc(C)cc1)[C@]1(C)CCS(=O)(=O)C1	ZINC000575421786	400608738	/nfs/dbraw/zinc/60/87/38/400608738.db2.gz	RMRZOYLQHSIVJX-OAHLLOKOSA-N	1	1	281.421	2.394	40	0		CEABMO
CC[N@@H+](Cc1ccc(C)cc1)[C@]1(C)CCS(=O)(=O)C1	ZINC000575421786	400608740	/nfs/dbraw/zinc/60/87/40/400608740.db2.gz	RMRZOYLQHSIVJX-OAHLLOKOSA-N	1	1	281.421	2.394	40	0		CEABMO
C[NH+]1CCN(C(=O)C23CC4C[C@H](C2)CC[C@@H](C4)C3)CC1	ZINC000005043884	170059790	/nfs/dbraw/zinc/05/97/90/170059790.db2.gz	YQKPMZXPYHVBMX-KWOWKCNFSA-N	1	1	276.424	2.367	40	0		CEABMO
Cc1ccccc1N1C(=O)C[C@H]([NH+]2CCCCC2)C1=O	ZINC000022079855	171352498	/nfs/dbraw/zinc/35/24/98/171352498.db2.gz	MNGDRNWHDBNCGN-AWEZNQCLSA-N	1	1	272.348	2.113	40	0		CEABMO
O[C@@H]1CC[N@H+](Cc2cccc(Br)c2)C1	ZINC000038538843	174145595	/nfs/dbraw/zinc/14/55/95/174145595.db2.gz	KUHNXHDKPBPCBD-LLVKDONJSA-N	1	1	256.143	2.016	40	0		CEABMO
O[C@@H]1CC[N@@H+](Cc2cccc(Br)c2)C1	ZINC000038538843	174145596	/nfs/dbraw/zinc/14/55/96/174145596.db2.gz	KUHNXHDKPBPCBD-LLVKDONJSA-N	1	1	256.143	2.016	40	0		CEABMO
[NH3+][C@H]1CCCC[C@@H]1N1CCN(Cc2ccccc2)CC1	ZINC000040431791	174260384	/nfs/dbraw/zinc/26/03/84/174260384.db2.gz	DNIGNRKTSONDSF-IRXDYDNUSA-N	1	1	273.424	2.074	40	0		CEABMO
[NH3+][C@H]1C(=O)N(Cc2ccccc2)[C@H]1c1ccccc1	ZINC000072228113	176343284	/nfs/dbraw/zinc/34/32/84/176343284.db2.gz	JAUNCKDTAJDBHE-CABCVRRESA-N	1	1	252.317	2.097	40	0		CEABMO
COc1ccccc1[C@H]1CN(C(C)=O)CC[N@@H+]1C(C)C	ZINC000072366561	176382038	/nfs/dbraw/zinc/38/20/38/176382038.db2.gz	NBKKONMMTITWQJ-OAHLLOKOSA-N	1	1	276.380	2.309	40	0		CEABMO
COc1ccccc1[C@H]1CN(C(C)=O)CC[N@H+]1C(C)C	ZINC000072366561	176382039	/nfs/dbraw/zinc/38/20/39/176382039.db2.gz	NBKKONMMTITWQJ-OAHLLOKOSA-N	1	1	276.380	2.309	40	0		CEABMO
Cn1cc(C[N@H+]2CCC[C@@H](Cc3cccnc3)C2)cn1	ZINC000072385812	176390512	/nfs/dbraw/zinc/39/05/12/176390512.db2.gz	RHBGBSUMXXQDDZ-HNNXBMFYSA-N	1	1	270.380	2.270	40	0		CEABMO
CCOC(=O)c1c(/C=C/[NH+](C)C)nc2ccccn21	ZINC000072415052	176399420	/nfs/dbraw/zinc/39/94/20/176399420.db2.gz	WTHQVDPGXVCOHA-CSKARUKUSA-N	1	1	259.309	2.043	40	0		CEABMO
CC1=CCC[C@@H](C)[C@H]1C[N@H+](C)[C@@H](C)CS(C)(=O)=O	ZINC000191070797	262188942	/nfs/dbraw/zinc/18/89/42/262188942.db2.gz	NPIUSJCKCVLBNT-RDBSUJKOSA-N	1	1	273.442	2.344	40	0		CEABMO
CC[NH+](CC)CCN[C@@H](C)C(=O)N1[C@@H](C)CCC[C@@H]1C	ZINC000022586298	279107497	/nfs/dbraw/zinc/10/74/97/279107497.db2.gz	CXSVMOSHBAQULZ-KKUMJFAQSA-N	1	1	283.460	2.096	40	0		CEABMO
Cc1nnc([C@@]23CCO[C@@H]2CC[N@H+](C2CCCCC2)C3)o1	ZINC000097953372	279232374	/nfs/dbraw/zinc/23/23/74/279232374.db2.gz	KCLUFOXPWHZRRS-GDBMZVCRSA-N	1	1	291.395	2.443	40	0		CEABMO
Cc1noc([C@H]2C[C@H]3OCC[C@H]3[N@@H+](Cc3ccoc3)C2)n1	ZINC000097953659	230388621	/nfs/dbraw/zinc/38/86/21/230388621.db2.gz	ULNFMKREJYHTCM-BFHYXJOUSA-N	1	1	289.335	2.118	40	0		CEABMO
C[N@H+]1CCC[C@]2(CN(Cc3cccs3)CCO2)C1	ZINC000096049059	185072750	/nfs/dbraw/zinc/07/27/50/185072750.db2.gz	KPDQBGYWMBSKGJ-CQSZACIVSA-N	1	1	266.410	2.045	40	0		CEABMO
COc1cccc(C[N@@H+]2CCC[C@]3(C[C@@H](OC)CO3)C2)c1	ZINC000096107193	185100085	/nfs/dbraw/zinc/10/00/85/185100085.db2.gz	QXRDKWZSBDPMSJ-SJORKVTESA-N	1	1	291.391	2.465	40	0		CEABMO
CC[N@@H+](CCO)Cc1ccc(Br)cc1	ZINC000042222167	362071512	/nfs/dbraw/zinc/07/15/12/362071512.db2.gz	CVUXUVPJKXIVII-UHFFFAOYSA-N	1	1	258.159	2.263	40	0		CEABMO
CNc1nc(N2CCc3cc(Cl)ccc3C2)cc[nH+]1	ZINC000329014374	136377329	/nfs/dbraw/zinc/37/73/29/136377329.db2.gz	MVJIOAQRXJARAL-UHFFFAOYSA-N	1	1	274.755	2.156	40	0		CEABMO
CCCNC(=O)NCCC[N@H+]1CCc2ccccc2C1	ZINC000047676085	362221233	/nfs/dbraw/zinc/22/12/33/362221233.db2.gz	QSIFIMXXYYDVDY-UHFFFAOYSA-N	1	1	275.396	2.144	40	0		CEABMO
c1cc(-c2nnc([C@H]3CC[N@H+](CC4CC4)C3)o2)ccn1	ZINC000049169629	362342797	/nfs/dbraw/zinc/34/27/97/362342797.db2.gz	GXVNOHLLIGVYDO-ZDUSSCGKSA-N	1	1	270.336	2.331	40	0	biogenic,in-vitro	CEABMO
Cc1cc(C(=O)N[C@@H]2c3ccccc3[C@@H]3C[N@@H+](C)C[C@@H]32)no1	ZINC000585109835	345005605	/nfs/dbraw/zinc/00/56/05/345005605.db2.gz	ZINAPSNKBRGMDN-OFQRWUPVSA-N	1	1	297.358	2.113	40	0		CEABMO
CCn1c(C)c(-c2noc(C[NH3+])n2)c2ccccc21	ZINC000085397306	179050144	/nfs/dbraw/zinc/05/01/44/179050144.db2.gz	IRWXLCNYEDRMTR-UHFFFAOYSA-N	1	1	256.309	2.478	40	0		CEABMO
CC(C)(C)OC(=O)N[C@@H]1CC[N@H+](Cc2cccnc2)C1	ZINC000067801155	362925930	/nfs/dbraw/zinc/92/59/30/362925930.db2.gz	RHHIPAUQALUPAC-CYBMUJFWSA-N	1	1	277.368	2.181	40	0		CEABMO
CC(C)(C)OC(=O)N[C@@H]1CC[N@@H+](Cc2cccnc2)C1	ZINC000067801155	362925932	/nfs/dbraw/zinc/92/59/32/362925932.db2.gz	RHHIPAUQALUPAC-CYBMUJFWSA-N	1	1	277.368	2.181	40	0		CEABMO
OCCN1CCC[C@@H](C[N@@H+](Cc2ccccc2)C2CC2)C1	ZINC000079414409	363596547	/nfs/dbraw/zinc/59/65/47/363596547.db2.gz	RJRPCZJXJYIDFV-QGZVFWFLSA-N	1	1	288.435	2.355	40	0		CEABMO
COc1ccc2c(c1)CC[N@@H+]([C@@H]1CCC[C@H](O)C1)C2	ZINC000001672616	361216424	/nfs/dbraw/zinc/21/64/24/361216424.db2.gz	FWTBJEAJFRCRAA-CABCVRRESA-N	1	1	261.365	2.357	40	0		CEABMO
CC(C)[C@@H]1[C@H]2OC(=O)[C@@H]1[C@@H]1CC[C@@H]3C[N@@H+](C)[C@H]2[C@@]31C	ZINC000004098437	361300289	/nfs/dbraw/zinc/30/02/89/361300289.db2.gz	RYAHJFGVOCZDEI-UFFNCVEVSA-N	1	1	263.381	2.160	40	0	in-vitro	CEABMO
Cc1ccc(N2C(=O)[C@H]([NH3+])[C@@H]2c2ccccc2)cc1	ZINC000015014822	361465234	/nfs/dbraw/zinc/46/52/34/361465234.db2.gz	OJTHEDVIZPWWAU-CABCVRRESA-N	1	1	252.317	2.410	40	0		CEABMO
OC[C@H]1CCC[N@@H+](Cc2c[nH]nc2-c2cccs2)C1	ZINC000019343912	361528311	/nfs/dbraw/zinc/52/83/11/361528311.db2.gz	WKDVEJYTSKGIDE-NSHDSACASA-N	1	1	277.393	2.343	40	0		CEABMO
Cc1ccsc1C[N@H+](CCCO)Cc1cn(C)nc1C	ZINC000019238590	361522434	/nfs/dbraw/zinc/52/24/34/361522434.db2.gz	OISBDRQOPRDEJN-UHFFFAOYSA-N	1	1	293.436	2.483	40	0		CEABMO
COc1ccc(CN2C[C@@H]3CCC[N@H+]3C[C@@H]2C)cc1	ZINC000019575748	361543231	/nfs/dbraw/zinc/54/32/31/361543231.db2.gz	YIBMDJHUYQYHFA-ZFWWWQNUSA-N	1	1	260.381	2.364	40	0		CEABMO
CNC(=O)[C@@]1(C)CCC[N@@H+](CCOc2ccc(C)cc2)C1	ZINC000019746652	361550405	/nfs/dbraw/zinc/55/04/05/361550405.db2.gz	UJBUBNFCUQBXAM-KRWDZBQOSA-N	1	1	290.407	2.222	40	0		CEABMO
O=C(C1CC1)N1C[C@H]2CC[C@@H](CC1=O)[N@H+]2Cc1ccccc1	ZINC000019371556	361530116	/nfs/dbraw/zinc/53/01/16/361530116.db2.gz	ROIRYEOBPOJFJK-JKSUJKDBSA-N	1	1	298.386	2.189	40	0		CEABMO
CC1(C)C[C@]2(C)C[C@H]1C[C@@H]2NC(=O)CC[NH+]1CCOCC1	ZINC000025627395	361630200	/nfs/dbraw/zinc/63/02/00/361630200.db2.gz	QQKWCXWZHDEURB-KEYYUXOJSA-N	1	1	294.439	2.040	40	0		CEABMO
C[NH+](C)C[C@H](CN1CCCC1)C(=O)c1ccccc1	ZINC000031959522	361724169	/nfs/dbraw/zinc/72/41/69/361724169.db2.gz	PESNANQSYBTIMQ-OAHLLOKOSA-N	1	1	260.381	2.143	40	0		CEABMO
CO[C@H]1C[N@@H+](Cc2ccccc2F)[C@@H]2CCCO[C@@H]21	ZINC000096187008	364407034	/nfs/dbraw/zinc/40/70/34/364407034.db2.gz	FJICGEZFGKRXPF-ILXRZTDVSA-N	1	1	265.328	2.204	40	0		CEABMO
Cn1cc(C[N@@H+]2CCN(CC3CC3)c3ncccc3C2)cn1	ZINC000096198903	364408382	/nfs/dbraw/zinc/40/83/82/364408382.db2.gz	XMMOPRYCYAINGQ-UHFFFAOYSA-N	1	1	297.406	2.047	40	0		CEABMO
Cn1cc(C[N@H+]2CCN(CC3CC3)c3ncccc3C2)cn1	ZINC000096198903	364408387	/nfs/dbraw/zinc/40/83/87/364408387.db2.gz	XMMOPRYCYAINGQ-UHFFFAOYSA-N	1	1	297.406	2.047	40	0		CEABMO
COC[C@H]1C[N@@H+](C)C[C@@]12CCN(Cc1cccs1)C2	ZINC000096217067	364413135	/nfs/dbraw/zinc/41/31/35/364413135.db2.gz	SNUDYNPFHTZCHQ-UKRRQHHQSA-N	1	1	280.437	2.148	40	0		CEABMO
O=C(c1cscn1)N1C[C@@H]2C[N@H+](Cc3ccccc3)[C@H]2C1	ZINC000096244893	364417294	/nfs/dbraw/zinc/41/72/94/364417294.db2.gz	KNCIKAUEZBWCAT-ZFWWWQNUSA-N	1	1	299.399	2.100	40	0		CEABMO
O=C(c1cscn1)N1C[C@@H]2C[N@@H+](Cc3ccccc3)[C@H]2C1	ZINC000096244893	364417297	/nfs/dbraw/zinc/41/72/97/364417297.db2.gz	KNCIKAUEZBWCAT-ZFWWWQNUSA-N	1	1	299.399	2.100	40	0		CEABMO
CC(=O)N1CCC[C@@]2(CC[N@@H+](Cc3ccoc3)C2)C1	ZINC000096268729	364419744	/nfs/dbraw/zinc/41/97/44/364419744.db2.gz	MMIILQJHOYMBLC-HNNXBMFYSA-N	1	1	262.353	2.114	40	0		CEABMO
Cn1c2ccccc2nc1CN1CC[C@]2(C1)CCC[N@@H+](C)C2	ZINC000096268579	364420474	/nfs/dbraw/zinc/42/04/74/364420474.db2.gz	KORVTTKRNXMDIQ-GOSISDBHSA-N	1	1	298.434	2.491	40	0		CEABMO
CCOC[C@H]1CC[N@@H+](C)C2(CN(Cc3ccco3)C2)C1	ZINC000585103114	367178885	/nfs/dbraw/zinc/17/88/85/367178885.db2.gz	QNPDRIOKRMWICX-AWEZNQCLSA-N	1	1	278.396	2.212	40	0		CEABMO
C[N@@H+](CC1(O)CCCCCC1)[C@H]1CCCC[C@@H]1O	ZINC000187329377	369141171	/nfs/dbraw/zinc/14/11/71/369141171.db2.gz	WGPJETARVFOASI-KBPBESRZSA-N	1	1	255.402	2.307	40	0		CEABMO
C[N@@H+]1Cc2cccn2[C@H](CCOc2ccccn2)C1	ZINC000248159648	371165844	/nfs/dbraw/zinc/16/58/44/371165844.db2.gz	WYVVNRAAHVKLNQ-CQSZACIVSA-N	1	1	257.337	2.339	40	0		CEABMO
CNc1cccc([C@@H]2CN(c3cccc(C)[nH+]3)CCO2)n1	ZINC000257285037	371611408	/nfs/dbraw/zinc/61/14/08/371611408.db2.gz	PFIKZDFEZSXJIZ-AWEZNQCLSA-N	1	1	284.363	2.405	40	0		CEABMO
Cc1cc(CC[C@@H]2CN(c3cccc(C)[nH+]3)CCO2)ncn1	ZINC000257270311	371611709	/nfs/dbraw/zinc/61/17/09/371611709.db2.gz	MTQPQGKISSLDNT-MRXNPFEDSA-N	1	1	298.390	2.326	40	0		CEABMO
CC(C)[NH+]1CC2(C1)C[C@H](Oc1ccccn1)CCO2	ZINC000248141506	189945580	/nfs/dbraw/zinc/94/55/80/189945580.db2.gz	CCQIGUOEUJKQJU-CYBMUJFWSA-N	1	1	262.353	2.102	40	0		CEABMO
CCCn1cc(C[NH2+]Cc2ccnn2CC(C)C)cn1	ZINC000256051246	190003425	/nfs/dbraw/zinc/00/34/25/190003425.db2.gz	IJQDFOAECPQXHL-UHFFFAOYSA-N	1	1	275.400	2.435	40	0		CEABMO
C[N@@H+]1CCC[C@H]1c1cncc(C(=O)NCc2ccccc2)n1	ZINC000257214704	190013289	/nfs/dbraw/zinc/01/32/89/190013289.db2.gz	CNDMQVKIUOJLQT-INIZCTEOSA-N	1	1	296.374	2.173	40	0		CEABMO
C[N@H+]1CCC[C@H]1c1cncc(C(=O)NCc2ccccc2)n1	ZINC000257214704	190013290	/nfs/dbraw/zinc/01/32/90/190013290.db2.gz	CNDMQVKIUOJLQT-INIZCTEOSA-N	1	1	296.374	2.173	40	0		CEABMO
CN(C)c1cc([C@H]2CCC[N@@H+]2Cc2cncn2C)ccn1	ZINC000257220980	190014683	/nfs/dbraw/zinc/01/46/83/190014683.db2.gz	DNASGFXURPADIX-OAHLLOKOSA-N	1	1	285.395	2.218	40	0		CEABMO
CN(C)c1cc([C@H]2CCC[N@H+]2Cc2cncn2C)ccn1	ZINC000257220980	190014684	/nfs/dbraw/zinc/01/46/84/190014684.db2.gz	DNASGFXURPADIX-OAHLLOKOSA-N	1	1	285.395	2.218	40	0		CEABMO
Cc1cc2nccc(C3CC[NH+](Cc4c[nH]cn4)CC3)n2n1	ZINC000257223196	190014882	/nfs/dbraw/zinc/01/48/82/190014882.db2.gz	DWICTOFISSIZEI-UHFFFAOYSA-N	1	1	296.378	2.140	40	0		CEABMO
Cc1cc2nccc(C3CC[NH+](Cc4cnc[nH]4)CC3)n2n1	ZINC000257223196	190014883	/nfs/dbraw/zinc/01/48/83/190014883.db2.gz	DWICTOFISSIZEI-UHFFFAOYSA-N	1	1	296.378	2.140	40	0		CEABMO
CC(C)[N@H+]1CCC[C@H](c2cnc(N3CCOC3=O)cn2)C1	ZINC000257257196	190021422	/nfs/dbraw/zinc/02/14/22/190021422.db2.gz	KOMICXPVSREAOB-LBPRGKRZSA-N	1	1	290.367	2.021	40	0		CEABMO
CNc1cc([C@@H]2CCC[N@@H+]2Cc2[nH]cnc2C)nc(C)n1	ZINC000257287326	190027088	/nfs/dbraw/zinc/02/70/88/190027088.db2.gz	PPMDGYGSZUXVJL-AWEZNQCLSA-N	1	1	286.383	2.195	40	0		CEABMO
CNc1cc([C@@H]2CCC[N@H+]2Cc2[nH]cnc2C)nc(C)n1	ZINC000257287326	190027089	/nfs/dbraw/zinc/02/70/89/190027089.db2.gz	PPMDGYGSZUXVJL-AWEZNQCLSA-N	1	1	286.383	2.195	40	0		CEABMO
O[C@H]1C[N@@H+](Cc2ccnc3ccccc23)CC[C@@]12CCCO2	ZINC000257309653	190031406	/nfs/dbraw/zinc/03/14/06/190031406.db2.gz	UBVAGRVEHTZBGI-ROUUACIJSA-N	1	1	298.386	2.351	40	0		CEABMO
CC(C)[N@H+]1CC[C@@H](c2n[nH]cc2-c2ccnc(N)c2)C1	ZINC000257290439	190027684	/nfs/dbraw/zinc/02/76/84/190027684.db2.gz	QCYUQGNILGDDAJ-GFCCVEGCSA-N	1	1	271.368	2.252	40	0		CEABMO
CCN1C(=O)CC[C@@]12CCC[N@@H+](CC1CC1)CC2	ZINC000096047508	285160093	/nfs/dbraw/zinc/16/00/93/285160093.db2.gz	XSKIZTLWHDLUKM-OAHLLOKOSA-N	1	1	250.386	2.263	40	0		CEABMO
Cc1[nH+]c(N2CCCC2)ccc1[C@@H]1CCCN1C=O	ZINC000072218907	394593360	/nfs/dbraw/zinc/59/33/60/394593360.db2.gz	MHXXYZYMIBEQBD-AWEZNQCLSA-N	1	1	259.353	2.284	40	0		CEABMO
CC[N@H+]1CCC[C@@H]1c1cnc(N2CCOCC2)c(C)c1	ZINC000072219331	394593439	/nfs/dbraw/zinc/59/34/39/394593439.db2.gz	IRALUGSUEXLGFR-OAHLLOKOSA-N	1	1	275.396	2.383	40	0		CEABMO
Cc1cc(N2CCN(C)CC2)ncc1[C@H]([NH3+])c1ccccc1	ZINC000072223611	394594227	/nfs/dbraw/zinc/59/42/27/394594227.db2.gz	DTVAIGHJYZXREG-GOSISDBHSA-N	1	1	296.418	2.190	40	0		CEABMO
Cc1cc(N2CCOCC2)ncc1[C@H]1CCCC[N@@H+]1C	ZINC000072219415	394594536	/nfs/dbraw/zinc/59/45/36/394594536.db2.gz	DFYMOXQTQOPXJI-OAHLLOKOSA-N	1	1	275.396	2.383	40	0		CEABMO
COc1cccc([C@@H]2[C@@H]([NH3+])C(=O)N2c2cccc(C)c2)c1	ZINC000072227416	394595528	/nfs/dbraw/zinc/59/55/28/394595528.db2.gz	FBMKIGLWJDKQQE-HZPDHXFCSA-N	1	1	282.343	2.419	40	0		CEABMO
CC(C)[N@H+]1CCC[C@H](c2nccnc2-c2ncc[nH]2)C1	ZINC000257240438	394595603	/nfs/dbraw/zinc/59/56/03/394595603.db2.gz	HTMURXPWLKNAQA-LBPRGKRZSA-N	1	1	271.368	2.455	40	0		CEABMO
COc1ccc(N2C(=O)[C@@H]([NH3+])[C@H]2c2ccccc2F)cc1	ZINC000072227174	394595625	/nfs/dbraw/zinc/59/56/25/394595625.db2.gz	XKWPSGICQZPRNH-LSDHHAIUSA-N	1	1	286.306	2.250	40	0		CEABMO
COc1ccc([C@H]2[C@H]([NH3+])C(=O)N2c2cccc(OC)c2)cc1	ZINC000072227723	394596200	/nfs/dbraw/zinc/59/62/00/394596200.db2.gz	VTYUFUMOUPBLBY-HOTGVXAUSA-N	1	1	298.342	2.119	40	0		CEABMO
[NH3+][C@@H]1C(=O)N(c2cccc(F)c2)[C@@H]1c1ccccc1F	ZINC000072227646	394596454	/nfs/dbraw/zinc/59/64/54/394596454.db2.gz	VCFIPGMTGKAAPU-UONOGXRCSA-N	1	1	274.270	2.380	40	0		CEABMO
Cc1ccc(C[N@@H+](C)[C@]2(C)CCS(=O)(=O)C2)cc1	ZINC000575421885	400608637	/nfs/dbraw/zinc/60/86/37/400608637.db2.gz	SPANYAYSRIENAT-CQSZACIVSA-N	1	1	267.394	2.004	40	0		CEABMO
Cc1ccc(C[N@H+](C)[C@]2(C)CCS(=O)(=O)C2)cc1	ZINC000575421885	400608642	/nfs/dbraw/zinc/60/86/42/400608642.db2.gz	SPANYAYSRIENAT-CQSZACIVSA-N	1	1	267.394	2.004	40	0		CEABMO
C[C@@H]1CCC[N@H+](Cc2nnnn2CCc2ccccc2)C1	ZINC000004860095	170031979	/nfs/dbraw/zinc/03/19/79/170031979.db2.gz	WYRSAODIYBWNNZ-CQSZACIVSA-N	1	1	285.395	2.148	40	0		CEABMO
C[C@@H]1CCC[N@@H+](Cc2nnnn2CCc2ccccc2)C1	ZINC000004860095	170031982	/nfs/dbraw/zinc/03/19/82/170031982.db2.gz	WYRSAODIYBWNNZ-CQSZACIVSA-N	1	1	285.395	2.148	40	0		CEABMO
CC(C)NC(=O)[C@H]1CCC[N@@H+](Cc2ccccc2)C1	ZINC000038832182	174157061	/nfs/dbraw/zinc/15/70/61/174157061.db2.gz	YLMKBINVCFQWPO-HNNXBMFYSA-N	1	1	260.381	2.423	40	0		CEABMO
CC[C@@H]1[N@@H+](Cc2ccoc2)CCC[C@]12CCC(=O)N2	ZINC000096052392	287312901	/nfs/dbraw/zinc/31/29/01/287312901.db2.gz	OPGVFVNCYNEIQL-ZFWWWQNUSA-N	1	1	262.353	2.303	40	0		CEABMO
OCC[N@H+]1CCC[C@H](c2cncc(Oc3ccccc3)n2)C1	ZINC000072361618	176377400	/nfs/dbraw/zinc/37/74/00/176377400.db2.gz	OXPKOGYPFIZBQL-AWEZNQCLSA-N	1	1	299.374	2.441	40	0		CEABMO
CC[N@@H+]1CCC[C@H]1c1nc(C)cc(Nc2ncccn2)n1	ZINC000072383489	176388602	/nfs/dbraw/zinc/38/86/02/176388602.db2.gz	OIOZYQBAGACDNW-LBPRGKRZSA-N	1	1	284.367	2.475	40	0		CEABMO
CC[N@H+]1CCC[C@H]1c1nc(C)cc(Nc2ncccn2)n1	ZINC000072383489	176388603	/nfs/dbraw/zinc/38/86/03/176388603.db2.gz	OIOZYQBAGACDNW-LBPRGKRZSA-N	1	1	284.367	2.475	40	0		CEABMO
CNc1cncc([C@@H]2CCC[N@@H+]2Cc2cccnc2)n1	ZINC000072385044	176389528	/nfs/dbraw/zinc/38/95/28/176389528.db2.gz	AANNDHNANGPMJB-AWEZNQCLSA-N	1	1	269.352	2.250	40	0		CEABMO
CNc1cncc([C@@H]2CCC[N@H+]2Cc2cccnc2)n1	ZINC000072385044	176389529	/nfs/dbraw/zinc/38/95/29/176389529.db2.gz	AANNDHNANGPMJB-AWEZNQCLSA-N	1	1	269.352	2.250	40	0		CEABMO
C[C@@H]1C[N@H+]2CCC[C@@H]2CN1Cc1cccc2nccnc12	ZINC000072397544	176395198	/nfs/dbraw/zinc/39/51/98/176395198.db2.gz	QSQAIYIXQLYKIS-UKRRQHHQSA-N	1	1	282.391	2.298	40	0		CEABMO
c1ccc([C@@H](C2CCOCC2)[NH+]2CCNCC2)cc1	ZINC000076671300	177053666	/nfs/dbraw/zinc/05/36/66/177053666.db2.gz	ZWPXMZZSZZZDSK-INIZCTEOSA-N	1	1	260.381	2.060	40	0		CEABMO
COc1cccc([C@@H]([NH3+])c2nc(-c3ccccc3O)n[nH]2)c1	ZINC000095533513	185007511	/nfs/dbraw/zinc/00/75/11/185007511.db2.gz	ZYFGNJWCMPQHOM-CQSZACIVSA-N	1	1	296.330	2.234	40	0		CEABMO
CO[C@@H]1CC[C@H]2[C@H]1OCC[N@H+]2Cc1ccccc1C	ZINC000096041407	185068892	/nfs/dbraw/zinc/06/88/92/185068892.db2.gz	SMXIZWHURSLCSS-ARFHVFGLSA-N	1	1	261.365	2.373	40	0		CEABMO
O=C1CCC[C@@]2(CCC[N@@H+](Cc3cccs3)C2)N1	ZINC000096049932	185073741	/nfs/dbraw/zinc/07/37/41/185073741.db2.gz	RKQNOLQBNYLTTP-AWEZNQCLSA-N	1	1	264.394	2.383	40	0		CEABMO
c1ccc(N2CC[C@@]3(C2)COCC[N@H+](CC2CC2)C3)nc1	ZINC000096062489	185083291	/nfs/dbraw/zinc/08/32/91/185083291.db2.gz	QKXNXKFYCODMCP-QGZVFWFLSA-N	1	1	287.407	2.020	40	0		CEABMO
Cn1nc(COc2cccnc2)c2c1CC[N@@H+](CC1CC1)C2	ZINC000096084910	185091825	/nfs/dbraw/zinc/09/18/25/185091825.db2.gz	ZQUSWTSVDGQXQU-UHFFFAOYSA-N	1	1	298.390	2.162	40	0		CEABMO
C1CC1c1nnc([C@]23COC[C@H]2C[N@H+](C2CCCC2)C3)o1	ZINC000096110127	185101092	/nfs/dbraw/zinc/10/10/92/185101092.db2.gz	RATPSRRMVHEGRV-MLGOLLRUSA-N	1	1	289.379	2.089	40	0		CEABMO
O=C1C[C@H]2[C@@H](CC[N@H+]2Cc2ccco2)N1c1cccnc1	ZINC000096184085	344238796	/nfs/dbraw/zinc/23/87/96/344238796.db2.gz	VGKRUFAXDVPWMK-CABCVRRESA-N	1	1	283.331	2.054	40	0		CEABMO
Cc1nc(N[C@@H](C)CO)cc(N2CCc3ccccc3C2)[nH+]1	ZINC000328960472	344758394	/nfs/dbraw/zinc/75/83/94/344758394.db2.gz	AYFXUGFJUPCMHS-LBPRGKRZSA-N	1	1	298.390	2.140	40	0		CEABMO
OC[C@]1(C(F)(F)F)CC[N@@H+](Cc2ccccc2)C1	ZINC000090726869	180032575	/nfs/dbraw/zinc/03/25/75/180032575.db2.gz	JFGJABRNVYTSPQ-LBPRGKRZSA-N	1	1	259.271	2.433	40	0		CEABMO
Cc1c(F)cccc1C[N@@H+]1CC[C@@H]2OCCN(C)[C@H]2C1	ZINC000108526165	186220601	/nfs/dbraw/zinc/22/06/01/186220601.db2.gz	ANKZCIBCLOIDFW-HOTGVXAUSA-N	1	1	278.371	2.039	40	0		CEABMO
OCC[N@@H+](C1CC1)C1CCN(Cc2ccccc2)CC1	ZINC000079393549	363593647	/nfs/dbraw/zinc/59/36/47/363593647.db2.gz	CHFSULRHEGRYOQ-UHFFFAOYSA-N	1	1	274.408	2.108	40	0		CEABMO
OCCN1CCC[C@H](C[N@@H+](Cc2ccccc2)C2CC2)C1	ZINC000079414416	363597327	/nfs/dbraw/zinc/59/73/27/363597327.db2.gz	RJRPCZJXJYIDFV-KRWDZBQOSA-N	1	1	288.435	2.355	40	0		CEABMO
CC(C)[N@H+](Cc1ccccc1)C[C@H]1CC[NH+](CC(=O)[O-])C1	ZINC000079416162	363598683	/nfs/dbraw/zinc/59/86/83/363598683.db2.gz	OFKWMWSGNPCZEP-INIZCTEOSA-N	1	1	290.407	2.304	40	0		CEABMO
CC(C)[NH+](Cc1ccccc1)C[C@H]1CC[N@H+](CC(=O)[O-])C1	ZINC000079416162	363598686	/nfs/dbraw/zinc/59/86/86/363598686.db2.gz	OFKWMWSGNPCZEP-INIZCTEOSA-N	1	1	290.407	2.304	40	0		CEABMO
CC(C)[NH+](Cc1ccccc1)C[C@H]1CC[N@@H+](CC(=O)[O-])C1	ZINC000079416162	363598689	/nfs/dbraw/zinc/59/86/89/363598689.db2.gz	OFKWMWSGNPCZEP-INIZCTEOSA-N	1	1	290.407	2.304	40	0		CEABMO
Cc1cc[nH+]c(N[C@@H](O)C(Cl)(Cl)Cl)c1	ZINC000001723790	361219570	/nfs/dbraw/zinc/21/95/70/361219570.db2.gz	MYVVGGQDTSYSSK-ZETCQYMHSA-N	1	1	255.532	2.491	40	0		CEABMO
C[C@H](NO)[C@@H](c1ccc2c(c1)OCO2)[NH+]1CCCCC1	ZINC000002045867	361226334	/nfs/dbraw/zinc/22/63/34/361226334.db2.gz	SJOLSPFJDYHXJK-NHYWBVRUSA-N	1	1	278.352	2.310	40	0		CEABMO
C[N@H+]1CCC[C@H](C(=O)NCc2ccc(Cl)cc2)C1	ZINC000082307239	363762809	/nfs/dbraw/zinc/76/28/09/363762809.db2.gz	RGLGIXJQHWUFFW-LBPRGKRZSA-N	1	1	266.772	2.298	40	0		CEABMO
Cc1ccc(C[N@@H+]2C[C@@H](N(C)C)[C@H]3OCCC[C@H]32)s1	ZINC000096185752	364406698	/nfs/dbraw/zinc/40/66/98/364406698.db2.gz	TXQRXFHGXUHKOX-KFWWJZLASA-N	1	1	280.437	2.350	40	0		CEABMO
Cc1ccc(CN2C[C@@H]([NH+](C)C)[C@H]3OCCC[C@H]32)s1	ZINC000096185752	364406702	/nfs/dbraw/zinc/40/67/02/364406702.db2.gz	TXQRXFHGXUHKOX-KFWWJZLASA-N	1	1	280.437	2.350	40	0		CEABMO
COC[C@@H]1c2c(cnn2C)CC[N@H+]1Cc1ccc(C)cc1	ZINC000096197708	364409000	/nfs/dbraw/zinc/40/90/00/364409000.db2.gz	CURLUINJKUTKLO-MRXNPFEDSA-N	1	1	285.391	2.474	40	0		CEABMO
COC[C@@H]1c2c(cnn2C)CC[N@@H+]1Cc1ccc(C)cc1	ZINC000096197708	364409002	/nfs/dbraw/zinc/40/90/02/364409002.db2.gz	CURLUINJKUTKLO-MRXNPFEDSA-N	1	1	285.391	2.474	40	0		CEABMO
CCO[C@H]1C[N@@H+](Cc2ccc(OC)cc2)[C@@H]2CCCO[C@@H]21	ZINC000096057436	364399424	/nfs/dbraw/zinc/39/94/24/364399424.db2.gz	DNTCGJJVJNCIIL-IKGGRYGDSA-N	1	1	291.391	2.464	40	0		CEABMO
COC[C@H]1CC2(C[N@H+]1C)CCN(C(=O)C1=CCCC1)CC2	ZINC000096207525	364410597	/nfs/dbraw/zinc/41/05/97/364410597.db2.gz	MYKBTKISHQXEPL-OAHLLOKOSA-N	1	1	292.423	2.056	40	0		CEABMO
Cc1cnc(N2CC[C@]3(CCC[N@@H+]3CC(C)C)C2)nc1	ZINC000096203040	364410800	/nfs/dbraw/zinc/41/08/00/364410800.db2.gz	ODOHAVAPOFUHEW-MRXNPFEDSA-N	1	1	274.412	2.486	40	0		CEABMO
COC[C@@H]1CN(C)C[C@@]12CC[N@H+](Cc1ccccc1C)C2	ZINC000096209612	364411847	/nfs/dbraw/zinc/41/18/47/364411847.db2.gz	ZWQIIRZOMQBFRO-ZWKOTPCHSA-N	1	1	288.435	2.395	40	0		CEABMO
COC[C@@H]1CN(C)C[C@@]12CC[N@@H+](Cc1ccccc1C)C2	ZINC000096209612	364411851	/nfs/dbraw/zinc/41/18/51/364411851.db2.gz	ZWQIIRZOMQBFRO-ZWKOTPCHSA-N	1	1	288.435	2.395	40	0		CEABMO
CCC[N@H+]1CC[C@]2(C1)CCCN(c1ccc(C)nn1)C2	ZINC000096217092	364413417	/nfs/dbraw/zinc/41/34/17/364413417.db2.gz	USTDXZPJMGVJAQ-INIZCTEOSA-N	1	1	274.412	2.487	40	0		CEABMO
Cc1ncc(C[N@@H+]2CCC[C@@]3(CN(C(C)C)C3=O)C2)s1	ZINC000585099343	367177448	/nfs/dbraw/zinc/17/74/48/367177448.db2.gz	GMCPPCJXYPUDSE-HNNXBMFYSA-N	1	1	293.436	2.284	40	0		CEABMO
COc1ccc(N2C[C@H]([NH2+]Cc3ccccc3)C2=O)cc1	ZINC000217461709	370196572	/nfs/dbraw/zinc/19/65/72/370196572.db2.gz	WUTPKJFPHFADNH-INIZCTEOSA-N	1	1	282.343	2.200	40	0		CEABMO
C[C@@H]1CCC[N@@H+](CCCNC(=S)Nc2ccncc2)C1	ZINC000225738208	370315261	/nfs/dbraw/zinc/31/52/61/370315261.db2.gz	QQRWBQPMADYGAC-CYBMUJFWSA-N	1	1	292.452	2.490	40	0		CEABMO
COC[C@H]1CC[N@@H+](C)C2(CN(Cc3ccccc3F)C2)C1	ZINC000248155558	371164723	/nfs/dbraw/zinc/16/47/23/371164723.db2.gz	VPHZRGLTQKMQEK-AWEZNQCLSA-N	1	1	292.398	2.368	40	0		CEABMO
OCC[N@@H+]1CCC[C@H]1c1n[nH]cc1-c1ccccc1F	ZINC000257330568	371613293	/nfs/dbraw/zinc/61/32/93/371613293.db2.gz	XOYICFBYNDLDDJ-AWEZNQCLSA-N	1	1	275.327	2.345	40	0		CEABMO
OCC[N@H+]1CCC[C@H]1c1n[nH]cc1-c1ccccc1F	ZINC000257330568	371613305	/nfs/dbraw/zinc/61/33/05/371613305.db2.gz	XOYICFBYNDLDDJ-AWEZNQCLSA-N	1	1	275.327	2.345	40	0		CEABMO
FCCn1ccc(C[NH2+]Cc2ccc(F)cc2)n1	ZINC000256052165	190004257	/nfs/dbraw/zinc/00/42/57/190004257.db2.gz	MDJBDZHOCYVHDA-UHFFFAOYSA-N	1	1	251.280	2.282	40	0		CEABMO
Nc1nccnc1[C@H]1C[N@H+](CC2CCCCC2)CCO1	ZINC000257211561	190012368	/nfs/dbraw/zinc/01/23/68/190012368.db2.gz	BZIPFNHZYVBHBN-CYBMUJFWSA-N	1	1	276.384	2.012	40	0		CEABMO
Nc1nccnc1[C@H]1C[N@@H+](CC2CCCCC2)CCO1	ZINC000257211561	190012369	/nfs/dbraw/zinc/01/23/69/190012369.db2.gz	BZIPFNHZYVBHBN-CYBMUJFWSA-N	1	1	276.384	2.012	40	0		CEABMO
CNc1ncccc1C[N@H+]1CCC[C@@H](Cc2cc[nH]n2)C1	ZINC000257216165	190013728	/nfs/dbraw/zinc/01/37/28/190013728.db2.gz	CTKRMWAWFLTGDQ-ZDUSSCGKSA-N	1	1	285.395	2.301	40	0		CEABMO
CN(C)Cc1ccnc([C@@H]2CCC[N@H+]2CC2CC2)n1	ZINC000257228675	190016297	/nfs/dbraw/zinc/01/62/97/190016297.db2.gz	FUVAHSUXRXKFDR-AWEZNQCLSA-N	1	1	260.385	2.085	40	0		CEABMO
Cc1c[nH]nc1[C@@H]1CC[N@@H+](Cc2ncccc2C)C1	ZINC000257224482	190015252	/nfs/dbraw/zinc/01/52/52/190015252.db2.gz	FBZNHWVFLUHMOC-CYBMUJFWSA-N	1	1	256.353	2.411	40	0		CEABMO
CNc1cc([C@H]2CCC[N@H+]2Cc2[nH]cnc2C)ccn1	ZINC000257231990	190017395	/nfs/dbraw/zinc/01/73/95/190017395.db2.gz	GIXUGJDOBGBFQL-CQSZACIVSA-N	1	1	271.368	2.492	40	0		CEABMO
Cn1ncc2ccc([C@H]3CCC[N@@H+](Cc4cc[nH]n4)C3)nc21	ZINC000257266114	190023054	/nfs/dbraw/zinc/02/30/54/190023054.db2.gz	MBQFEQQIRXWHKT-ZDUSSCGKSA-N	1	1	296.378	2.071	40	0		CEABMO
Cc1c[nH]c([C@@H]2CCC[N@H+](Cc3cccn3C)C2)n1	ZINC000257257591	190021545	/nfs/dbraw/zinc/02/15/45/190021545.db2.gz	KQHRQTRASQKBDO-CYBMUJFWSA-N	1	1	258.369	2.436	40	0		CEABMO
Cc1ncc(CN2CC[N@H+](C)[C@@H](c3ccccc3)C2)cn1	ZINC000257305982	190031456	/nfs/dbraw/zinc/03/14/56/190031456.db2.gz	SSIQLVWUAHLEAZ-QGZVFWFLSA-N	1	1	282.391	2.274	40	0		CEABMO
CNc1cc([C@@H]2CCC[N@H+]2CC2CCOCC2)nc(C)n1	ZINC000257288971	190027867	/nfs/dbraw/zinc/02/78/67/190027867.db2.gz	PWLYWPSSTHRCJN-HNNXBMFYSA-N	1	1	290.411	2.390	40	0		CEABMO
Cn1ccc(C[N@H+]2CCC[C@H](Cc3ccccn3)C2)n1	ZINC000257306690	190031199	/nfs/dbraw/zinc/03/11/99/190031199.db2.gz	SVJOLQPKMZGKKS-CQSZACIVSA-N	1	1	270.380	2.270	40	0		CEABMO
COc1ccc(C[C@H]2C[N@H+](C3CCOCC3)CCO2)cc1	ZINC000257311309	190032323	/nfs/dbraw/zinc/03/23/23/190032323.db2.gz	UIVXUIDZOJVULO-KRWDZBQOSA-N	1	1	291.391	2.118	40	0		CEABMO
Cc1ccnc([C@@H]2CC[N@@H+](Cc3cccnc3)C2)n1	ZINC000257318694	190033425	/nfs/dbraw/zinc/03/34/25/190033425.db2.gz	VPABUMCZLGLZBY-CQSZACIVSA-N	1	1	254.337	2.170	40	0		CEABMO
c1cncc(C[C@@H]2CCC[N@@H+](Cc3cnccn3)C2)c1	ZINC000257327384	190034892	/nfs/dbraw/zinc/03/48/92/190034892.db2.gz	XBCWHXDTDYGQNR-HNNXBMFYSA-N	1	1	268.364	2.326	40	0		CEABMO
c1c[nH]c(C[N@@H+]2CCC[C@H]2CCc2ccncc2)n1	ZINC000257326753	190034925	/nfs/dbraw/zinc/03/49/25/190034925.db2.gz	WYLVITFBMABDTI-AWEZNQCLSA-N	1	1	256.353	2.402	40	0		CEABMO
CC1(C)Cc2ccccc2CN1c1cc[nH+]c(NCCO)n1	ZINC000329070228	376929597	/nfs/dbraw/zinc/92/95/97/376929597.db2.gz	ZFAGUVVATBUILR-UHFFFAOYSA-N	1	1	298.390	2.222	40	0		CEABMO
CCc1cnc(N2CC[C@H]3[C@H]2CC[N@H+]3CC2CC2)nc1	ZINC000096184400	256814713	/nfs/dbraw/zinc/81/47/13/256814713.db2.gz	FEYNJXILYUHJJY-LSDHHAIUSA-N	1	1	272.396	2.102	40	0		CEABMO
COc1ccc([C@H]2[C@H]([NH3+])C(=O)N2c2ccc(F)cc2)cc1	ZINC000072227195	394595328	/nfs/dbraw/zinc/59/53/28/394595328.db2.gz	VBNMIFZYFRVQMV-GJZGRUSLSA-N	1	1	286.306	2.250	40	0		CEABMO
COc1ccc([C@H]2[C@H]([NH3+])C(=O)N2c2ccc(OC)cc2)cc1	ZINC000072227128	394595502	/nfs/dbraw/zinc/59/55/02/394595502.db2.gz	ODABPKUONBXULF-HOTGVXAUSA-N	1	1	298.342	2.119	40	0		CEABMO
[NH3+][C@@H]1C(=O)N(Cc2ccccc2)[C@H]1c1ccccc1F	ZINC000072228163	394596477	/nfs/dbraw/zinc/59/64/77/394596477.db2.gz	PTSQGZAVHPDLIL-GJZGRUSLSA-N	1	1	270.307	2.237	40	0		CEABMO
CCOC(=O)c1[nH]nc(C)c1C[C@H]([NH3+])c1ccccc1	ZINC000005502122	170105115	/nfs/dbraw/zinc/10/51/15/170105115.db2.gz	YYMJRCDFZQRMSL-ZDUSSCGKSA-N	1	1	273.336	2.137	40	0		CEABMO
C[C@@H](NCC[NH+](C)C)C(=O)Nc1cccc2ccccc21	ZINC000022584096	171392399	/nfs/dbraw/zinc/39/23/99/171392399.db2.gz	UAHYIZDOYKYDDC-CYBMUJFWSA-N	1	1	285.391	2.318	40	0		CEABMO
C[C@H](NCC[NH+](C)C)C(=O)Nc1cccc2ccccc21	ZINC000022584092	171392423	/nfs/dbraw/zinc/39/24/23/171392423.db2.gz	UAHYIZDOYKYDDC-ZDUSSCGKSA-N	1	1	285.391	2.318	40	0		CEABMO
COc1cc[nH+]c(CCc2nc3cccnc3[nH]2)c1	ZINC000035636062	172320761	/nfs/dbraw/zinc/32/07/61/172320761.db2.gz	YBOCDKFRGBOOFO-UHFFFAOYSA-N	1	1	254.293	2.147	40	0	in-vitro	CEABMO
COc1ccc(C[N@@H+]2CCC[C@@H](O)C2)cc1Cl	ZINC000038539702	174145685	/nfs/dbraw/zinc/14/56/85/174145685.db2.gz	TXWHXRCXHHYCPW-LLVKDONJSA-N	1	1	255.745	2.305	40	0		CEABMO
COc1ccc(C[N@H+]2CCC[C@@H](O)C2)cc1Cl	ZINC000038539702	174145686	/nfs/dbraw/zinc/14/56/86/174145686.db2.gz	TXWHXRCXHHYCPW-LLVKDONJSA-N	1	1	255.745	2.305	40	0		CEABMO
CC(=O)N1CC[N@H+](C(C)C)C[C@@H](COc2ccccc2)C1	ZINC000072374466	176385139	/nfs/dbraw/zinc/38/51/39/176385139.db2.gz	YVTYUKQOZHZGJD-MRXNPFEDSA-N	1	1	290.407	2.254	40	0		CEABMO
CC(C)[NH+]1CC2(C1)C[C@@H](Oc1ccccn1)CCO2	ZINC000248141508	273529017	/nfs/dbraw/zinc/52/90/17/273529017.db2.gz	CCQIGUOEUJKQJU-ZDUSSCGKSA-N	1	1	262.353	2.102	40	0		CEABMO
Cc1noc([C@@H]2C[C@H]3OCC[C@H]3[N@@H+](Cc3ccoc3)C2)n1	ZINC000097953407	534467880	/nfs/dbraw/zinc/46/78/80/534467880.db2.gz	ULNFMKREJYHTCM-MGPQQGTHSA-N	1	1	289.335	2.118	40	0		CEABMO
CO[C@H]1CC[C@H]2[C@H]1OCC[N@H+]2Cc1ccccc1C	ZINC000096041936	185070094	/nfs/dbraw/zinc/07/00/94/185070094.db2.gz	SMXIZWHURSLCSS-HRCADAONSA-N	1	1	261.365	2.373	40	0		CEABMO
CCOC[C@]12CCCO[C@H]1CC[N@@H+](CC1CC1)C2	ZINC000096056858	185077821	/nfs/dbraw/zinc/07/78/21/185077821.db2.gz	VOVNQHXCLCNOQM-LSDHHAIUSA-N	1	1	253.386	2.304	40	0		CEABMO
COC[C@]12CCCO[C@H]1CC[N@@H+](Cc1ccco1)C2	ZINC000096056712	185078090	/nfs/dbraw/zinc/07/80/90/185078090.db2.gz	MSHWUFSCDKMXQC-LSDHHAIUSA-N	1	1	265.353	2.297	40	0		CEABMO
Cn1cnc2c1[C@H](COCC1CC1)C[N@@H+](CC1CC1)C2	ZINC000096060250	185079837	/nfs/dbraw/zinc/07/98/37/185079837.db2.gz	ISTQBXCUGMWNDR-AWEZNQCLSA-N	1	1	275.396	2.156	40	0		CEABMO
CCn1cc2c(n1)[C@@H](COC)C[N@@H+](Cc1cccnc1)C2	ZINC000096059891	185080387	/nfs/dbraw/zinc/08/03/87/185080387.db2.gz	UGTBVSMWOMXGDN-OAHLLOKOSA-N	1	1	286.379	2.044	40	0		CEABMO
CCn1cc2c(n1)[C@@H](COC)C[N@H+](Cc1cccnc1)C2	ZINC000096059891	185080388	/nfs/dbraw/zinc/08/03/88/185080388.db2.gz	UGTBVSMWOMXGDN-OAHLLOKOSA-N	1	1	286.379	2.044	40	0		CEABMO
Cn1ncc2c1[C@H](COCC1CC1)C[N@@H+](CC1CC1)C2	ZINC000096060123	185081343	/nfs/dbraw/zinc/08/13/43/185081343.db2.gz	NIRIUKAYSLEWPH-HNNXBMFYSA-N	1	1	275.396	2.156	40	0		CEABMO
Cc1ccc(C[N@H+]2C[C@H]3CN(C(=O)N(C)C)C[C@H]3C2)cc1	ZINC000096088870	185094411	/nfs/dbraw/zinc/09/44/11/185094411.db2.gz	ZECKJJGZUMHHEP-IYBDPMFKSA-N	1	1	287.407	2.040	40	0		CEABMO
c1ccc(O[C@@H]2CO[C@@]3(CC[N@H+](C4CCC4)C3)C2)nc1	ZINC000096107668	185099383	/nfs/dbraw/zinc/09/93/83/185099383.db2.gz	UDUJFRSEEMIXON-HOCLYGCPSA-N	1	1	274.364	2.246	40	0		CEABMO
CC(C)Nc1ncc(C[NH2+]Cc2nc3ccccc3[nH]2)cn1	ZINC000062718455	343672634	/nfs/dbraw/zinc/67/26/34/343672634.db2.gz	NCYWXPPVQATQOX-UHFFFAOYSA-N	1	1	296.378	2.463	40	0		CEABMO
CCOC(=O)c1ccc(Nc2cc(N)[nH+]c(C)n2)cc1	ZINC000049467310	362364283	/nfs/dbraw/zinc/36/42/83/362364283.db2.gz	SFPJDVHJZJQEQU-UHFFFAOYSA-N	1	1	272.308	2.288	40	0		CEABMO
CC1CC(C(=O)N2C[C@@H]3CC[N@@H+](Cc4cccnc4)[C@@H]3C2)C1	ZINC000585107684	345005673	/nfs/dbraw/zinc/00/56/73/345005673.db2.gz	UQKLPGOJGJNQFO-LRSKPHEKSA-N	1	1	299.418	2.160	40	0		CEABMO
c1ccc(O[C@@H]2CCOC3(C[NH+](CC4CC4)C3)C2)nc1	ZINC000585105407	345006022	/nfs/dbraw/zinc/00/60/22/345006022.db2.gz	WBJMOFGMOAKEMT-CQSZACIVSA-N	1	1	274.364	2.104	40	0		CEABMO
COCCN1CC[C@@H]2C[N@H+](CCc3ccccc3)C[C@@H]2C1	ZINC000063527345	362768766	/nfs/dbraw/zinc/76/87/66/362768766.db2.gz	HXICOGUCDBUBCO-MSOLQXFVSA-N	1	1	288.435	2.129	40	0		CEABMO
COCCN1CC[C@@H]2C[N@@H+](CCc3ccccc3)C[C@@H]2C1	ZINC000063527345	362768774	/nfs/dbraw/zinc/76/87/74/362768774.db2.gz	HXICOGUCDBUBCO-MSOLQXFVSA-N	1	1	288.435	2.129	40	0		CEABMO
c1coc(C[N@H+]2CC[C@@H]3[C@H](CC2)OCCN3CC2CC2)c1	ZINC000107254926	186164353	/nfs/dbraw/zinc/16/43/53/186164353.db2.gz	OXKNUNVMFCNJIV-SJORKVTESA-N	1	1	290.407	2.355	40	0		CEABMO
c1coc(CN2CC[C@@H]3[C@H](CC2)OCC[N@H+]3CC2CC2)c1	ZINC000107254926	186164354	/nfs/dbraw/zinc/16/43/54/186164354.db2.gz	OXKNUNVMFCNJIV-SJORKVTESA-N	1	1	290.407	2.355	40	0		CEABMO
c1coc(CN2CC[C@@H]3[C@H](CC2)OCC[N@@H+]3CC2CC2)c1	ZINC000107254926	186164356	/nfs/dbraw/zinc/16/43/56/186164356.db2.gz	OXKNUNVMFCNJIV-SJORKVTESA-N	1	1	290.407	2.355	40	0		CEABMO
Cc1[nH+]ccn1C[C@H]1CCCN(c2cc(C)ncn2)C1	ZINC000072368992	363130978	/nfs/dbraw/zinc/13/09/78/363130978.db2.gz	HIMWHMXKJYXREB-CQSZACIVSA-N	1	1	271.368	2.207	40	0		CEABMO
COC(=O)c1cccc(NC(=O)[C@@H]2CCC[N@@H+](C)C2)c1C	ZINC000072865972	363172261	/nfs/dbraw/zinc/17/22/61/363172261.db2.gz	XDJNSHRCAFNUPI-GFCCVEGCSA-N	1	1	290.363	2.062	40	0		CEABMO
O=C1c2ccccc2C(=O)N1[C@@H]1CCC[N@H+]2CCCC[C@@H]12	ZINC000005648216	361333895	/nfs/dbraw/zinc/33/38/95/361333895.db2.gz	KNEGFGGZBIDYHX-LSDHHAIUSA-N	1	1	284.359	2.300	40	0		CEABMO
Cc1c(C[NH2+]Cc2cccc(F)c2F)cnn1C	ZINC000012395234	361382855	/nfs/dbraw/zinc/38/28/55/361382855.db2.gz	PLAHWXTWOOEJAC-UHFFFAOYSA-N	1	1	251.280	2.297	40	0		CEABMO
CC(C)[N@@H+]1C[C@H](O)C[C@H]1c1nc(-c2ccccc2)no1	ZINC000015674114	361476989	/nfs/dbraw/zinc/47/69/89/361476989.db2.gz	AMDILLOZEYUFMG-OLZOCXBDSA-N	1	1	273.336	2.253	40	0	biogenic,in-vitro	CEABMO
CC(C)[N@H+]1C[C@H](O)C[C@H]1c1nc(-c2ccccc2)no1	ZINC000015674114	361476992	/nfs/dbraw/zinc/47/69/92/361476992.db2.gz	AMDILLOZEYUFMG-OLZOCXBDSA-N	1	1	273.336	2.253	40	0	biogenic,in-vitro	CEABMO
c1[nH]c2ccccc2c1[C@@H]1CC[N@H+](CCN2CCOCC2)C1	ZINC000019369257	361528635	/nfs/dbraw/zinc/52/86/35/361528635.db2.gz	JMFQVIVSVILMKK-OAHLLOKOSA-N	1	1	299.418	2.289	40	0	in-vitro	CEABMO
Cc1cc(C)c(C(=O)NCCC[NH+]2CCOCC2)c(C)c1	ZINC000019855986	361563350	/nfs/dbraw/zinc/56/33/50/361563350.db2.gz	FNRPYSCKGGHXFS-UHFFFAOYSA-N	1	1	290.407	2.064	40	0		CEABMO
COc1ccccc1CN1C[C@H]2CCC[N@H+]2C[C@H]1C	ZINC000019575162	361544072	/nfs/dbraw/zinc/54/40/72/361544072.db2.gz	KCENCVINDMTRRT-UKRRQHHQSA-N	1	1	260.381	2.364	40	0		CEABMO
Cc1[nH+]ccn1CCNC(=O)c1cc(C)nc2ccccc21	ZINC000019657108	361547222	/nfs/dbraw/zinc/54/72/22/361547222.db2.gz	DZELLHXMAPJFNH-UHFFFAOYSA-N	1	1	294.358	2.478	40	0		CEABMO
[NH3+]Cc1nc(COc2cccc3ccccc32)no1	ZINC000019786235	361553412	/nfs/dbraw/zinc/55/34/12/361553412.db2.gz	JLMMNUYEFVDAMW-UHFFFAOYSA-N	1	1	255.277	2.261	40	0		CEABMO
CCOc1ccc(C(=O)[C@H](C)C[NH+]2CCN(C)CC2)cc1	ZINC000022871905	361590103	/nfs/dbraw/zinc/59/01/03/361590103.db2.gz	BVFITKDNSDTIBL-CQSZACIVSA-N	1	1	290.407	2.152	40	0		CEABMO
C[C@@H]([NH3+])c1nc(-c2cccc(OC(F)F)c2)no1	ZINC000089262329	363951958	/nfs/dbraw/zinc/95/19/58/363951958.db2.gz	BDQMCWVCYRCZQP-ZCFIWIBFSA-N	1	1	255.224	2.358	40	0		CEABMO
CC[C@@H](C)[N@@H+]1C[C@H]2CN(Cc3cccnc3)C[C@H]2C1	ZINC000096161502	364403567	/nfs/dbraw/zinc/40/35/67/364403567.db2.gz	ZSHXRWJNOGVFSR-BMFZPTHFSA-N	1	1	259.397	2.244	40	0		CEABMO
COc1nn(C)c2c1CCC[N@H+](Cc1ccsc1)C2	ZINC000096254419	364417073	/nfs/dbraw/zinc/41/70/73/364417073.db2.gz	CQJKJGCADANINC-UHFFFAOYSA-N	1	1	277.393	2.439	40	0		CEABMO
COc1nn(C)c2c1CCC[N@@H+](Cc1ccsc1)C2	ZINC000096254419	364417076	/nfs/dbraw/zinc/41/70/76/364417076.db2.gz	CQJKJGCADANINC-UHFFFAOYSA-N	1	1	277.393	2.439	40	0		CEABMO
c1cc(-c2ncnc3c2CC[N@@H+](C[C@@H]2CCOC2)CC3)co1	ZINC000096255178	364418918	/nfs/dbraw/zinc/41/89/18/364418918.db2.gz	QXVWLJBKJFVSPH-ZDUSSCGKSA-N	1	1	299.374	2.174	40	0		CEABMO
O=C1CC[C@]2(CCC[N@@H+](CC3CC3)CC2)N1CCF	ZINC000585100201	367178262	/nfs/dbraw/zinc/17/82/62/367178262.db2.gz	HMPQQWDIIUADDI-HNNXBMFYSA-N	1	1	268.376	2.213	40	0		CEABMO
C[N@@H+](CC1CCOCC1)[C@@H]1CCCN(c2ccccn2)C1	ZINC000257319554	371613727	/nfs/dbraw/zinc/61/37/27/371613727.db2.gz	VSZPZYAXLFDEQB-MRXNPFEDSA-N	1	1	289.423	2.409	40	0		CEABMO
Fc1ccc(OCC[N@H+]2CC[C@@H](c3cc[nH]n3)C2)cc1	ZINC000257215228	190012999	/nfs/dbraw/zinc/01/29/99/190012999.db2.gz	CPFBIBJORCNXFG-GFCCVEGCSA-N	1	1	275.327	2.417	40	0		CEABMO
CCn1cc(-c2cnc(C[C@H]3CCC[N@@H+](C)C3)cn2)cn1	ZINC000257247668	190019083	/nfs/dbraw/zinc/01/90/83/190019083.db2.gz	IZZUGRJQXOCHFJ-CYBMUJFWSA-N	1	1	285.395	2.244	40	0		CEABMO
CCn1cc(C[N@H+]2CCC[C@@H](c3nc(C)c[nH]3)C2)cn1	ZINC000257251165	190019960	/nfs/dbraw/zinc/01/99/60/190019960.db2.gz	JPRYTVGHTSREFD-CQSZACIVSA-N	1	1	273.384	2.314	40	0		CEABMO
Cc1cncc([C@@H]2CCC[N@@H+](Cc3ccnc(C)n3)C2)n1	ZINC000257256825	190021769	/nfs/dbraw/zinc/02/17/69/190021769.db2.gz	KNBBPCJWXXZFPY-CQSZACIVSA-N	1	1	283.379	2.263	40	0		CEABMO
CNc1nccnc1C[C@H]1CCC[N@@H+](Cc2ccncc2)C1	ZINC000257274538	190025128	/nfs/dbraw/zinc/02/51/28/190025128.db2.gz	NLMJIQNKBMDFAG-OAHLLOKOSA-N	1	1	297.406	2.368	40	0		CEABMO
CC(C)CN1c2ccc(F)cc2[C@@H]2C[N@H+](CCO)CC[C@@H]21	ZINC000096251727	256834740	/nfs/dbraw/zinc/83/47/40/256834740.db2.gz	UOOAFRRCHJKSJF-RDJZCZTQSA-N	1	1	292.398	2.452	40	0		CEABMO
CCN1C(C)=N[C@@]2(CC[C@@H]3C[N@@H+](CC(C)C)C[C@@H]32)C1=O	ZINC000096261446	256837828	/nfs/dbraw/zinc/83/78/28/256837828.db2.gz	RVACJRHSNDUTQL-IJEWVQPXSA-N	1	1	277.412	2.004	40	0		CEABMO
CC(C)[N@H+]1C[C@H]2Cc3nc(NCC4CC4)ncc3[C@H]2C1	ZINC000306144975	394513862	/nfs/dbraw/zinc/51/38/62/394513862.db2.gz	ZTUHRCQNILDEKU-OCCSQVGLSA-N	1	1	272.396	2.278	40	0		CEABMO
COc1ccccc1C[NH2+]Cc1cnc(SC)nc1	ZINC000062717250	394571136	/nfs/dbraw/zinc/57/11/36/394571136.db2.gz	CZDLHAAMEXMHQL-UHFFFAOYSA-N	1	1	275.377	2.497	40	0		CEABMO
O=C1[C@@H]2C[N@H+](Cc3nccs3)C[C@H]2CN1c1ccccc1	ZINC000253615450	394578376	/nfs/dbraw/zinc/57/83/76/394578376.db2.gz	OHYFPUCVDPFUIH-GXTWGEPZSA-N	1	1	299.399	2.238	40	0		CEABMO
O=C1[C@@H]2C[N@@H+](Cc3nccs3)C[C@H]2CN1c1ccccc1	ZINC000253615450	394578381	/nfs/dbraw/zinc/57/83/81/394578381.db2.gz	OHYFPUCVDPFUIH-GXTWGEPZSA-N	1	1	299.399	2.238	40	0		CEABMO
COc1ccc([C@@H]2[C@H]([NH3+])C(=O)N2c2ccc(OC)cc2)cc1	ZINC000072227127	394595468	/nfs/dbraw/zinc/59/54/68/394595468.db2.gz	ODABPKUONBXULF-JKSUJKDBSA-N	1	1	298.342	2.119	40	0		CEABMO
Fc1ccc(C[N@H+]2CC[C@@]23CCN(c2ncccn2)C3)cc1	ZINC000096076080	394676097	/nfs/dbraw/zinc/67/60/97/394676097.db2.gz	UIEDIYBXDGIJKB-QGZVFWFLSA-N	1	1	298.365	2.471	40	0		CEABMO
C[N@H+]1CCC[C@@H](C(=O)N2CCCc3ccccc32)C1	ZINC000078578581	400244504	/nfs/dbraw/zinc/24/45/04/400244504.db2.gz	UWAWCIPZQWWYAG-CQSZACIVSA-N	1	1	258.365	2.308	40	0		CEABMO
CCCC[N@@H+](CCOc1ccnc(=O)[nH]1)CC(C)C	ZINC000005423950	170097524	/nfs/dbraw/zinc/09/75/24/170097524.db2.gz	JAJDYYSPRUNZBY-UHFFFAOYSA-N	1	1	267.373	2.319	40	0		CEABMO
CC1(C)[C@H]2CC[C@]1(C)[C@@H](NC(=O)CC[NH+]1CCOCC1)C2	ZINC000013763803	170590510	/nfs/dbraw/zinc/59/05/10/170590510.db2.gz	YXXRVERJCNRUEY-GRDNDAEWSA-N	1	1	294.439	2.040	40	0		CEABMO
O[C@@H]1CC[N@H+](Cc2ccc(Br)s2)C1	ZINC000038539040	174145520	/nfs/dbraw/zinc/14/55/20/174145520.db2.gz	ATXQCLBGTIMYCV-SSDOTTSWSA-N	1	1	262.172	2.077	40	0		CEABMO
O[C@@H]1CC[N@@H+](Cc2ccc(Br)s2)C1	ZINC000038539040	174145521	/nfs/dbraw/zinc/14/55/21/174145521.db2.gz	ATXQCLBGTIMYCV-SSDOTTSWSA-N	1	1	262.172	2.077	40	0		CEABMO
Cc1cccc([C@@H]2CCC[N@H+](Cc3ncc[nH]3)C2)n1	ZINC000072356617	176375783	/nfs/dbraw/zinc/37/57/83/176375783.db2.gz	PVEWKQFGNKUUAN-CYBMUJFWSA-N	1	1	256.353	2.493	40	0		CEABMO
Cc1cccc([C@@H]2CCC[N@@H+](Cc3ncc[nH]3)C2)n1	ZINC000072356617	176375784	/nfs/dbraw/zinc/37/57/84/176375784.db2.gz	PVEWKQFGNKUUAN-CYBMUJFWSA-N	1	1	256.353	2.493	40	0		CEABMO
Fc1cccc(OCCc2cc([C@H]3CC[NH2+]C3)n[nH]2)c1	ZINC000072374092	176385134	/nfs/dbraw/zinc/38/51/34/176385134.db2.gz	IFOOVNJOPKYTPR-NSHDSACASA-N	1	1	275.327	2.247	40	0		CEABMO
C[N@H+]1CCCC[C@H]1c1ccnc(Nc2cncnc2)n1	ZINC000072377393	176385828	/nfs/dbraw/zinc/38/58/28/176385828.db2.gz	ZYRHFHJPZBBVEP-ZDUSSCGKSA-N	1	1	270.340	2.167	40	0		CEABMO
Cn1c(C[N@H+]2CC[C@@H](c3cc[nH]n3)C2)nc2ccccc21	ZINC000072385300	176390040	/nfs/dbraw/zinc/39/00/40/176390040.db2.gz	JIFMVJWGZCNXFY-GFCCVEGCSA-N	1	1	281.363	2.286	40	0		CEABMO
Cc1c(C[N@@H+]2CCCC[C@@H]2c2ccncn2)cnn1C	ZINC000072385658	176390260	/nfs/dbraw/zinc/39/02/60/176390260.db2.gz	QNHBYAIVDVMIGK-OAHLLOKOSA-N	1	1	271.368	2.246	40	0		CEABMO
Cc1c(C[N@H+]2CCCC[C@@H]2c2ccncn2)cnn1C	ZINC000072385658	176390261	/nfs/dbraw/zinc/39/02/61/176390261.db2.gz	QNHBYAIVDVMIGK-OAHLLOKOSA-N	1	1	271.368	2.246	40	0		CEABMO
CNc1cncc([C@H]2CCC[N@@H+]2Cc2cccnc2NC)n1	ZINC000072386197	277044949	/nfs/dbraw/zinc/04/49/49/277044949.db2.gz	TZVOXPGSCHEUMV-CQSZACIVSA-N	1	1	298.394	2.292	40	0		CEABMO
CNc1cncc([C@H]2CCC[N@H+]2Cc2cccnc2NC)n1	ZINC000072386197	277044951	/nfs/dbraw/zinc/04/49/51/277044951.db2.gz	TZVOXPGSCHEUMV-CQSZACIVSA-N	1	1	298.394	2.292	40	0		CEABMO
COc1cc2c(cc1OC)[C@@H]1CC[N@H+]3CCC[C@@H]3N1CC2	ZINC000019326989	277394678	/nfs/dbraw/zinc/39/46/78/277394678.db2.gz	JBLQTGBNLYFHRP-YOEHRIQHSA-N	1	1	288.391	2.429	40	0		CEABMO
C[C@H](CCN1C[C@H]2C[C@@H](O)C[N@H+]2C[C@@H]1C)c1ccccc1	ZINC000036718962	279264899	/nfs/dbraw/zinc/26/48/99/279264899.db2.gz	OQWLLWPCXDAZNO-CYGHRXIMSA-N	1	1	288.435	2.320	40	0		CEABMO
C[C@H](CC[N@@H+]1C[C@H]2C[C@@H](O)CN2C[C@@H]1C)c1ccccc1	ZINC000036718962	279264900	/nfs/dbraw/zinc/26/49/00/279264900.db2.gz	OQWLLWPCXDAZNO-CYGHRXIMSA-N	1	1	288.435	2.320	40	0		CEABMO
C[C@H](CC[N@H+]1C[C@H]2C[C@@H](O)CN2C[C@@H]1C)c1ccccc1	ZINC000036718962	279264901	/nfs/dbraw/zinc/26/49/01/279264901.db2.gz	OQWLLWPCXDAZNO-CYGHRXIMSA-N	1	1	288.435	2.320	40	0		CEABMO
Cc1ccc([C@H]([NH3+])c2nc(-c3ccco3)n[nH]2)cc1	ZINC000095534072	185006713	/nfs/dbraw/zinc/00/67/13/185006713.db2.gz	QUMRWPSYYHZLNC-LBPRGKRZSA-N	1	1	254.293	2.421	40	0		CEABMO
Cc1ccc([C@H]([NH3+])c2nc(-c3ccccn3)n[nH]2)cc1	ZINC000095534106	185007227	/nfs/dbraw/zinc/00/72/27/185007227.db2.gz	GPIUTYDPJWUIEB-ZDUSSCGKSA-N	1	1	265.320	2.223	40	0		CEABMO
COc1ccc(-c2n[nH]c([C@@H]([NH3+])C(C)C)n2)cc1OC	ZINC000095534770	185008615	/nfs/dbraw/zinc/00/86/15/185008615.db2.gz	PUFOZBXKMPUDOR-LBPRGKRZSA-N	1	1	276.340	2.145	40	0		CEABMO
CO[C@@H]1CC[C@H]2[C@H]1OCC[N@@H+]2Cc1cccc(F)c1	ZINC000096041403	185069624	/nfs/dbraw/zinc/06/96/24/185069624.db2.gz	FGJKNCXLFKCCGS-RRFJBIMHSA-N	1	1	265.328	2.204	40	0		CEABMO
CO[C@@H]1CC[C@H]2[C@H]1OCC[N@H+]2Cc1cccc(F)c1	ZINC000096041403	185069626	/nfs/dbraw/zinc/06/96/26/185069626.db2.gz	FGJKNCXLFKCCGS-RRFJBIMHSA-N	1	1	265.328	2.204	40	0		CEABMO
Cc1noc(C)c1C[N@H+]1CC[C@H]2O[C@@H](C)C[C@H]2C1	ZINC000096043549	185069912	/nfs/dbraw/zinc/06/99/12/185069912.db2.gz	AQVBUYGXXJKITB-DUFXMDAXSA-N	1	1	250.342	2.291	40	0		CEABMO
CCO[C@@H]1C[N@@H+](Cc2scnc2C)[C@@H]2CCCO[C@H]12	ZINC000096042348	185069970	/nfs/dbraw/zinc/06/99/70/185069970.db2.gz	MATZKZKNIXWPCL-BZPMIXESSA-N	1	1	282.409	2.220	40	0		CEABMO
Cc1noc([C@@H]2C[C@H]3C[N@@H+](Cc4cccs4)C[C@H]3O2)n1	ZINC000096045788	185071092	/nfs/dbraw/zinc/07/10/92/185071092.db2.gz	LUXGFLJXQLDFFI-WCFLWFBJSA-N	1	1	291.376	2.402	40	0		CEABMO
CC[N@H+]1CCOC[C@]2(CCCN(Cc3cccnc3)C2)C1	ZINC000096049599	185072888	/nfs/dbraw/zinc/07/28/88/185072888.db2.gz	WSZUPJUTBFKXLZ-QGZVFWFLSA-N	1	1	289.423	2.016	40	0		CEABMO
CC(C)N1CCO[C@H]2C[N@@H+](Cc3ccsc3)C[C@H]21	ZINC000096054276	185076027	/nfs/dbraw/zinc/07/60/27/185076027.db2.gz	AXPOYMYXGBOMCC-KGLIPLIRSA-N	1	1	266.410	2.042	40	0		CEABMO
Fc1cccc(O[C@H]2C[C@@H]3C[N@@H+](CC4CC4)CCN3C2)c1	ZINC000096055156	185076422	/nfs/dbraw/zinc/07/64/22/185076422.db2.gz	NJDAHRFTRCEKOQ-WBVHZDCISA-N	1	1	290.382	2.373	40	0		CEABMO
Fc1cccc(O[C@H]2C[C@@H]3CN(CC4CC4)CC[N@@H+]3C2)c1	ZINC000096055156	185076424	/nfs/dbraw/zinc/07/64/24/185076424.db2.gz	NJDAHRFTRCEKOQ-WBVHZDCISA-N	1	1	290.382	2.373	40	0		CEABMO
Fc1cccc(O[C@H]2C[C@@H]3CN(CC4CC4)CC[N@H+]3C2)c1	ZINC000096055156	185076425	/nfs/dbraw/zinc/07/64/25/185076425.db2.gz	NJDAHRFTRCEKOQ-WBVHZDCISA-N	1	1	290.382	2.373	40	0		CEABMO
C(OC[C@H]1CC[C@@H]2[C@@H](CC[N@H+]2CC2CC2)O1)C1CC1	ZINC000096056419	185077293	/nfs/dbraw/zinc/07/72/93/185077293.db2.gz	ZWGLWVYXBLRTQJ-BZUAXINKSA-N	1	1	265.397	2.445	40	0		CEABMO
COC[C@@]12CCCO[C@@H]1CC[N@@H+](Cc1ccccn1)C2	ZINC000096056719	185077369	/nfs/dbraw/zinc/07/73/69/185077369.db2.gz	YLSCRXPAZCUAOA-CVEARBPZSA-N	1	1	276.380	2.099	40	0		CEABMO
Cc1noc([C@H]2C[C@@H]3CC[N@H+](Cc4ccco4)C[C@H]3O2)n1	ZINC000096058184	185078569	/nfs/dbraw/zinc/07/85/69/185078569.db2.gz	QWBUZOKLIYBDPZ-IACUBPJLSA-N	1	1	289.335	2.323	40	0		CEABMO
Cc1noc([C@H]2C[C@@H]3CC[N@@H+](Cc4ccco4)C[C@H]3O2)n1	ZINC000096058184	185078571	/nfs/dbraw/zinc/07/85/71/185078571.db2.gz	QWBUZOKLIYBDPZ-IACUBPJLSA-N	1	1	289.335	2.323	40	0		CEABMO
Cn1ncc2c1[C@@H](COCC1CC1)C[N@@H+](CC1CC1)C2	ZINC000096060122	185080431	/nfs/dbraw/zinc/08/04/31/185080431.db2.gz	NIRIUKAYSLEWPH-OAHLLOKOSA-N	1	1	275.396	2.156	40	0		CEABMO
O=C(c1ccco1)N1CC2(C1)CC[N@@H+](Cc1ccncc1)C2	ZINC000096070832	185086529	/nfs/dbraw/zinc/08/65/29/185086529.db2.gz	JTGUYVYFAVCQCT-UHFFFAOYSA-N	1	1	297.358	2.023	40	0		CEABMO
Cc1cccc(C[N@H+]2CC[C@@]3(CCN3c3ncccn3)C2)n1	ZINC000096076134	185089019	/nfs/dbraw/zinc/08/90/19/185089019.db2.gz	VSMXCCSJYCVVIY-QGZVFWFLSA-N	1	1	295.390	2.035	40	0		CEABMO
CC[N@H+]1CCOC[C@]2(CCCN(Cc3nccs3)C2)C1	ZINC000096076493	185089656	/nfs/dbraw/zinc/08/96/56/185089656.db2.gz	CGUCYLYYQCJWEC-OAHLLOKOSA-N	1	1	295.452	2.077	40	0		CEABMO
OC[C@H]1CCC[N@H+]1Cc1ccc2cc(F)ccc2n1	ZINC000096836635	185115783	/nfs/dbraw/zinc/11/57/83/185115783.db2.gz	DXORDVFADAXAKL-CQSZACIVSA-N	1	1	260.312	2.331	40	0		CEABMO
CN(C)[C@@H]1C[N@H+](Cc2ccsc2)[C@@H]2CCCO[C@H]12	ZINC000096056317	282227737	/nfs/dbraw/zinc/22/77/37/282227737.db2.gz	YQUIMXMURRLTCB-MCIONIFRSA-N	1	1	266.410	2.042	40	0		CEABMO
CN(C)[C@@H]1C[N@@H+](Cc2ccsc2)[C@@H]2CCCO[C@H]12	ZINC000096056317	282227739	/nfs/dbraw/zinc/22/77/39/282227739.db2.gz	YQUIMXMURRLTCB-MCIONIFRSA-N	1	1	266.410	2.042	40	0		CEABMO
COc1cccc(C[N@H+]2CC[C@H](c3nnc(C)o3)C2)c1	ZINC000049169217	362342466	/nfs/dbraw/zinc/34/24/66/362342466.db2.gz	AAZNFJYSYZUSEN-ZDUSSCGKSA-N	1	1	273.336	2.376	40	0	biogenic,in-vitro	CEABMO
Cc1nnc2n1[C@H]1C[N@H+](C[C@@H]3CC=CCC3)C[C@H]1CC2	ZINC000019288358	282365733	/nfs/dbraw/zinc/36/57/33/282365733.db2.gz	PZTLEYNTALQUML-KFWWJZLASA-N	1	1	272.396	2.362	40	0		CEABMO
[NH3+]Cc1nc([C@@H](c2cccs2)n2cccc2)no1	ZINC000409439804	344889556	/nfs/dbraw/zinc/88/95/56/344889556.db2.gz	IPEYQDKFWIRDPG-LLVKDONJSA-N	1	1	260.322	2.029	40	0		CEABMO
CC(C)[NH+]1CC2(C1)C[C@@H](Oc1ncccc1F)CCO2	ZINC000585104481	345005530	/nfs/dbraw/zinc/00/55/30/345005530.db2.gz	IYXUNATXTLXGLT-LBPRGKRZSA-N	1	1	280.343	2.241	40	0		CEABMO
CC(=O)N1CC[C@H]2[C@@H](C1)CCCC[N@H+]2CC1(O)CCCC1	ZINC000585287134	345010074	/nfs/dbraw/zinc/01/00/74/345010074.db2.gz	UIERFIWNIZLPNX-CVEARBPZSA-N	1	1	294.439	2.014	40	0		CEABMO
O=C1[C@@H]2C[N@@H+](Cc3ccoc3)C[C@@H]2CN1c1ccccc1	ZINC000107742847	186188879	/nfs/dbraw/zinc/18/88/79/186188879.db2.gz	UYUUZRNEUPLYLI-GDBMZVCRSA-N	1	1	282.343	2.374	40	0		CEABMO
CCO[C@H]1CC[C@H]2[C@H]1OCC[N@@H+]2Cc1cccc(OC)c1	ZINC000107716427	186188264	/nfs/dbraw/zinc/18/82/64/186188264.db2.gz	UCMKQJAKVPTCLE-YESZJQIVSA-N	1	1	291.391	2.464	40	0		CEABMO
CCO[C@H]1CC[C@H]2[C@H]1OCC[N@H+]2Cc1cccc(OC)c1	ZINC000107716427	186188265	/nfs/dbraw/zinc/18/82/65/186188265.db2.gz	UCMKQJAKVPTCLE-YESZJQIVSA-N	1	1	291.391	2.464	40	0		CEABMO
CN(C)c1cc([C@H]2CCCN(c3ccncn3)C2)cc[nH+]1	ZINC000072380928	363131682	/nfs/dbraw/zinc/13/16/82/363131682.db2.gz	VRTJBDDDJNCSQB-AWEZNQCLSA-N	1	1	283.379	2.322	40	0		CEABMO
OCCN(C[C@@H]1CCC[N@H+]1Cc1ccccc1)C1CC1	ZINC000079393542	363594474	/nfs/dbraw/zinc/59/44/74/363594474.db2.gz	HDYFYZOEHXYRNR-KRWDZBQOSA-N	1	1	274.408	2.108	40	0		CEABMO
OCC[N@H+](C[C@@H]1CCCN1Cc1ccccc1)C1CC1	ZINC000079393542	363594479	/nfs/dbraw/zinc/59/44/79/363594479.db2.gz	HDYFYZOEHXYRNR-KRWDZBQOSA-N	1	1	274.408	2.108	40	0		CEABMO
OCC[N@@H+](C[C@@H]1CCCN1Cc1ccccc1)C1CC1	ZINC000079393542	363594483	/nfs/dbraw/zinc/59/44/83/363594483.db2.gz	HDYFYZOEHXYRNR-KRWDZBQOSA-N	1	1	274.408	2.108	40	0		CEABMO
C[N@@H+](Cc1ccccc1)C1CCC([NH2+]CC(=O)[O-])CC1	ZINC000079416046	363598315	/nfs/dbraw/zinc/59/83/15/363598315.db2.gz	RWTUSEAGUBNKIB-UHFFFAOYSA-N	1	1	276.380	2.104	40	0		CEABMO
Cc1cccc(C)c1NC(=O)[C@@H]1CCCC[N@@H+]1CCO	ZINC000000000245	361116516	/nfs/dbraw/zinc/11/65/16/361116516.db2.gz	NVASAXNGHUPVJX-AWEZNQCLSA-N	1	1	276.380	2.089	40	0	in-man	CEABMO
Cc1cccc(C)c1NC(=O)[C@@H]1CCCC[N@H+]1CCO	ZINC000000000245	361116518	/nfs/dbraw/zinc/11/65/18/361116518.db2.gz	NVASAXNGHUPVJX-AWEZNQCLSA-N	1	1	276.380	2.089	40	0	in-man	CEABMO
CC(=O)O[C@H]1CC[N@H+](Cc2ccco2)[C@@H](C)[C@H]1C	ZINC000000111486	361130272	/nfs/dbraw/zinc/13/02/72/361130272.db2.gz	HAVUOHMCCLLASZ-SUNKGSAMSA-N	1	1	251.326	2.442	40	0		CEABMO
COC(=O)[C@@]12CCC[C@H]1C[N@@H+](Cc1ccccc1)C2	ZINC000004203346	361305691	/nfs/dbraw/zinc/30/56/91/361305691.db2.gz	DFKYQTUJTMSPII-GOEBONIOSA-N	1	1	259.349	2.462	40	0		CEABMO
COCCn1cc(C[N@H+]2CC[C@@H](CO)C2)c2ccccc21	ZINC000019594206	361545323	/nfs/dbraw/zinc/54/53/23/361545323.db2.gz	UOFACYKJPDPFLY-CQSZACIVSA-N	1	1	288.391	2.102	40	0		CEABMO
CCN(CC)CC[NH2+]Cc1cccc(OC)c1OC	ZINC000019919616	361567857	/nfs/dbraw/zinc/56/78/57/361567857.db2.gz	FWBVSBIJUMLBGP-UHFFFAOYSA-N	1	1	266.385	2.135	40	0		CEABMO
C[C@H]([NH3+])c1nc(-c2cccc(OC(F)F)c2)no1	ZINC000089262327	363952233	/nfs/dbraw/zinc/95/22/33/363952233.db2.gz	BDQMCWVCYRCZQP-LURJTMIESA-N	1	1	255.224	2.358	40	0		CEABMO
C[N@@H+](Cc1cccs1)[C@@H]1CCC[C@@H]2CN(C(N)=O)C[C@@H]21	ZINC000096183126	364407728	/nfs/dbraw/zinc/40/77/28/364407728.db2.gz	UERJJLIMCJTDDG-KWCYVHTRSA-N	1	1	293.436	2.359	40	0		CEABMO
Cc1nc(COC[C@@H]2CCC[C@@]23C[N@@H+](C)CCO3)cs1	ZINC000096160004	364403484	/nfs/dbraw/zinc/40/34/84/364403484.db2.gz	DWYMUJSKBPNCGW-DZGCQCFKSA-N	1	1	296.436	2.469	40	0		CEABMO
Cc1ccc(C[N@@H+]2C[C@H]3CN(c4ncccn4)C[C@H]3C2)cc1	ZINC000096161724	364404040	/nfs/dbraw/zinc/40/40/40/364404040.db2.gz	QREJTKFEEONQDS-CALCHBBNSA-N	1	1	294.402	2.353	40	0		CEABMO
COC[C@H]1c2c(cnn2C)CC[N@H+]1Cc1ccc(C)cc1	ZINC000096197707	364409299	/nfs/dbraw/zinc/40/92/99/364409299.db2.gz	CURLUINJKUTKLO-INIZCTEOSA-N	1	1	285.391	2.474	40	0		CEABMO
COC[C@H]1c2c(cnn2C)CC[N@@H+]1Cc1ccc(C)cc1	ZINC000096197707	364409304	/nfs/dbraw/zinc/40/93/04/364409304.db2.gz	CURLUINJKUTKLO-INIZCTEOSA-N	1	1	285.391	2.474	40	0		CEABMO
CN1CC[C@]2(C[N@@H+](CC3CC3)C[C@H]2c2ccccc2)C1=O	ZINC000096201861	364410285	/nfs/dbraw/zinc/41/02/85/364410285.db2.gz	CDVRPSSPPXWEOQ-FUHWJXTLSA-N	1	1	284.403	2.344	40	0		CEABMO
c1cc(CN2CC[C@]3(C2)C[C@H]([NH+]2CCCC2)CCO3)co1	ZINC000096206236	364411593	/nfs/dbraw/zinc/41/15/93/364411593.db2.gz	KWJPSRYSNHYJOB-IAGOWNOFSA-N	1	1	290.407	2.499	40	0		CEABMO
CC(=O)N1CCC2(CC[N@@H+](Cc3ccoc3)C2)CC1	ZINC000096268709	364420598	/nfs/dbraw/zinc/42/05/98/364420598.db2.gz	PPEBFYQTVTWXLS-UHFFFAOYSA-N	1	1	262.353	2.114	40	0		CEABMO
CCC[C@@H](C)[N@H+]1CCC[C@@]2(CN(c3ncccn3)C2=O)C1	ZINC000585099696	367178074	/nfs/dbraw/zinc/17/80/74/367178074.db2.gz	YMCUZPKWOHVKKM-CJNGLKHVSA-N	1	1	288.395	2.094	40	0		CEABMO
CC[C@@H](C)[N@H+]1CCC[C@]2(CN(Cc3cncs3)C2=O)C1	ZINC000585099712	367178099	/nfs/dbraw/zinc/17/80/99/367178099.db2.gz	ZJARAEIXWPJORA-IUODEOHRSA-N	1	1	293.436	2.366	40	0		CEABMO
c1ccc(OC[C@@H]2C[C@@H]3OCC[N@@H+](CC4CC4)[C@H]3C2)nc1	ZINC000253591452	371530713	/nfs/dbraw/zinc/53/07/13/371530713.db2.gz	NMVZUPDNUAFYQR-JYJNAYRXSA-N	1	1	288.391	2.350	40	0		CEABMO
CNc1cc([C@@H]2CCCN(c3ccncn3)C2)cc[nH+]1	ZINC000257263001	371609920	/nfs/dbraw/zinc/60/99/20/371609920.db2.gz	LNXZFMOIEONQEC-CYBMUJFWSA-N	1	1	269.352	2.297	40	0		CEABMO
CNc1cc(C)nc([C@]2(C)CCC[N@H+]2C2CCOCC2)n1	ZINC000257306328	371613498	/nfs/dbraw/zinc/61/34/98/371613498.db2.gz	STVOUURMJSFTTJ-INIZCTEOSA-N	1	1	290.411	2.317	40	0		CEABMO
CC(C)n1nc(C2CC2)cc1C[NH2+]Cc1ccnn1C	ZINC000256049748	190002460	/nfs/dbraw/zinc/00/24/60/190002460.db2.gz	BGMRLHAHCIXUDX-UHFFFAOYSA-N	1	1	273.384	2.365	40	0		CEABMO
Cc1nn(C)c(F)c1C[NH2+]Cc1ccc(F)cc1	ZINC000256049996	190003155	/nfs/dbraw/zinc/00/31/55/190003155.db2.gz	CETMTRNPZVOYLY-UHFFFAOYSA-N	1	1	251.280	2.297	40	0		CEABMO
C[N@H+]1CCC[C@H](c2cncc(-c3ccc(CO)cc3)n2)C1	ZINC000257198282	190010863	/nfs/dbraw/zinc/01/08/63/190010863.db2.gz	YBMLRUCEBXYVSF-HNNXBMFYSA-N	1	1	283.375	2.445	40	0		CEABMO
CC(=O)N1CC[N@H+](Cc2ccncc2)C[C@H]1c1ccccc1	ZINC000257227166	190015428	/nfs/dbraw/zinc/01/54/28/190015428.db2.gz	FNZHBKAEZSHPNT-SFHVURJKSA-N	1	1	295.386	2.487	40	0		CEABMO
CC(=O)N1CC[N@@H+](Cc2ccncc2)C[C@H]1c1ccccc1	ZINC000257227166	190015429	/nfs/dbraw/zinc/01/54/29/190015429.db2.gz	FNZHBKAEZSHPNT-SFHVURJKSA-N	1	1	295.386	2.487	40	0		CEABMO
C[NH+](C)Cc1cncc([C@@H]2CCCN2Cc2ccncc2)n1	ZINC000257240652	190018225	/nfs/dbraw/zinc/01/82/25/190018225.db2.gz	HUNMIEVAUBRWBG-KRWDZBQOSA-N	1	1	297.406	2.270	40	0		CEABMO
CC(C)[N@H+]1CCC[C@@H](c2cnc(N3CCOC3=O)cn2)C1	ZINC000257257195	190021373	/nfs/dbraw/zinc/02/13/73/190021373.db2.gz	KOMICXPVSREAOB-GFCCVEGCSA-N	1	1	290.367	2.021	40	0		CEABMO
Cc1ccnc([C@H]2CC[N@@H+](CC3CCOCC3)C2)n1	ZINC000257276559	190025327	/nfs/dbraw/zinc/02/53/27/190025327.db2.gz	NUHCJVSQMLFSIO-AWEZNQCLSA-N	1	1	261.369	2.001	40	0		CEABMO
CNc1cc([C@H]2CCC[N@H+](Cc3nccn3C)C2)ccn1	ZINC000257296090	190028574	/nfs/dbraw/zinc/02/85/74/190028574.db2.gz	RBEMAZTVVMMVIQ-AWEZNQCLSA-N	1	1	285.395	2.236	40	0		CEABMO
CNc1cc([C@H]2CCC[N@@H+](Cc3nccn3C)C2)ccn1	ZINC000257296090	190028575	/nfs/dbraw/zinc/02/85/75/190028575.db2.gz	RBEMAZTVVMMVIQ-AWEZNQCLSA-N	1	1	285.395	2.236	40	0		CEABMO
CC1(c2nccs2)CC[NH+](Cc2cc[nH]n2)CC1	ZINC000257308951	190030868	/nfs/dbraw/zinc/03/08/68/190030868.db2.gz	TYWZWSFEBUZXNW-UHFFFAOYSA-N	1	1	262.382	2.420	40	0		CEABMO
C[N@@H+]1CCN(C(=O)Cc2cccnc2)C[C@@H]1c1ccccc1	ZINC000257316103	190033108	/nfs/dbraw/zinc/03/31/08/190033108.db2.gz	VEDITLYHXURDFC-QGZVFWFLSA-N	1	1	295.386	2.139	40	0		CEABMO
C[N@H+]1CCN(C(=O)Cc2cccnc2)C[C@@H]1c1ccccc1	ZINC000257316103	190033109	/nfs/dbraw/zinc/03/31/09/190033109.db2.gz	VEDITLYHXURDFC-QGZVFWFLSA-N	1	1	295.386	2.139	40	0		CEABMO
O=C(c1cccnc1)N1CCC2(CC[N@@H+](CC3CC3)C2)CC1	ZINC000096157649	256813102	/nfs/dbraw/zinc/81/31/02/256813102.db2.gz	PLSNSGVIBZOPSC-UHFFFAOYSA-N	1	1	299.418	2.420	40	0		CEABMO
CC[N@@H+]1CCCC[C@@H]1c1cccnc1N1CCN(C)CC1	ZINC000072216598	394593048	/nfs/dbraw/zinc/59/30/48/394593048.db2.gz	HNVBLAOTGGDUMO-MRXNPFEDSA-N	1	1	288.439	2.380	40	0		CEABMO
CC[N@H+]1CCCC[C@@H]1c1cccnc1N1CCN(C)CC1	ZINC000072216598	394593052	/nfs/dbraw/zinc/59/30/52/394593052.db2.gz	HNVBLAOTGGDUMO-MRXNPFEDSA-N	1	1	288.439	2.380	40	0		CEABMO
CCSc1ncc(CNC[C@H]2CCC[N@@H+]2CC)cn1	ZINC000062718361	394571340	/nfs/dbraw/zinc/57/13/40/394571340.db2.gz	WROVRKSWLBYTMX-CYBMUJFWSA-N	1	1	280.441	2.163	40	0		CEABMO
CCSc1ncc(CNC[C@H]2CCC[N@H+]2CC)cn1	ZINC000062718361	394571342	/nfs/dbraw/zinc/57/13/42/394571342.db2.gz	WROVRKSWLBYTMX-CYBMUJFWSA-N	1	1	280.441	2.163	40	0		CEABMO
CC[C@H]([NH3+])c1cnc(N2CCN(C(C)C)CC2)c(C)c1	ZINC000072222671	394594639	/nfs/dbraw/zinc/59/46/39/394594639.db2.gz	LGJAGRIHMIOCND-HNNXBMFYSA-N	1	1	276.428	2.330	40	0		CEABMO
[NH3+][C@H]1C(=O)N(c2ccccc2)[C@@H]1c1ccccc1F	ZINC000072227380	394595524	/nfs/dbraw/zinc/59/55/24/394595524.db2.gz	MPFLSNBXZVSLMS-ZIAGYGMSSA-N	1	1	256.280	2.241	40	0		CEABMO
CO[C@H]1C[N@@H+](Cc2ccsc2)[C@@H]2CCCO[C@@H]21	ZINC000096057404	394675319	/nfs/dbraw/zinc/67/53/19/394675319.db2.gz	UGJNWLSCEHHESE-AGIUHOORSA-N	1	1	253.367	2.126	40	0		CEABMO
C[N@H+]1CCC[C@H](Nc2cncc(Br)c2)C1	ZINC000096510502	394694272	/nfs/dbraw/zinc/69/42/72/394694272.db2.gz	UGBBFMZUPNGDOF-JTQLQIEISA-N	1	1	270.174	2.350	40	0		CEABMO
COC(=O)[C@@H]1C[N@@H+](C)C[C@@H]1c1cccc(Br)c1	ZINC000217668618	400307894	/nfs/dbraw/zinc/30/78/94/400307894.db2.gz	XBPKBJLBWHOMCJ-VXGBXAGGSA-N	1	1	298.180	2.267	40	0		CEABMO
CC[C@H](Oc1cccc(C)c1)C(=O)N1CC[NH+](CC)CC1	ZINC000020461783	171209204	/nfs/dbraw/zinc/20/92/04/171209204.db2.gz	CDFUUSOWTDUOPW-INIZCTEOSA-N	1	1	290.407	2.317	40	0		CEABMO
COc1ccc(C[N@@H+]2CCC[C@H](O)C2)cc1Cl	ZINC000038539710	174145560	/nfs/dbraw/zinc/14/55/60/174145560.db2.gz	TXWHXRCXHHYCPW-NSHDSACASA-N	1	1	255.745	2.305	40	0		CEABMO
COc1ccc(C[N@H+]2CCC[C@H](O)C2)cc1Cl	ZINC000038539710	174145561	/nfs/dbraw/zinc/14/55/61/174145561.db2.gz	TXWHXRCXHHYCPW-NSHDSACASA-N	1	1	255.745	2.305	40	0		CEABMO
CCOc1cncc(N2CC[C@]3(CCC[N@H+]3C)C2)c1	ZINC000044138528	175146358	/nfs/dbraw/zinc/14/63/58/175146358.db2.gz	HHNMXHMUQGXCJL-OAHLLOKOSA-N	1	1	261.369	2.155	40	0		CEABMO
CC(=O)N1CC[N@H+](C(C)C)C[C@H](COc2ccccc2)C1	ZINC000072374467	176384915	/nfs/dbraw/zinc/38/49/15/176384915.db2.gz	YVTYUKQOZHZGJD-INIZCTEOSA-N	1	1	290.407	2.254	40	0		CEABMO
Cc1nc(Nc2ccccn2)cc([C@H]2CC[N@H+](C)C2)n1	ZINC000072382609	176388481	/nfs/dbraw/zinc/38/84/81/176388481.db2.gz	GYMYTPWKPQTRFA-LBPRGKRZSA-N	1	1	269.352	2.343	40	0		CEABMO
CNc1ncccc1C[N@H+]1CC[C@@H](c2n[nH]cc2C)C1	ZINC000072386198	176391531	/nfs/dbraw/zinc/39/15/31/176391531.db2.gz	MIUCRBHEBFJAMB-GFCCVEGCSA-N	1	1	271.368	2.144	40	0		CEABMO
CC(=O)Oc1ccc(CN2C[C@H]3CCC[N@@H+]3C[C@H]2C)cc1	ZINC000072397550	176394920	/nfs/dbraw/zinc/39/49/20/176394920.db2.gz	DJHQGWZGQNFFAR-CZUORRHYSA-N	1	1	288.391	2.280	40	0		CEABMO
COC(=O)[C@H](c1ccccc1)[C@@]1(O)C[C@@H](C)[N@@H+](C)C[C@H]1C	ZINC000004474245	277386324	/nfs/dbraw/zinc/38/63/24/277386324.db2.gz	XGFOAXWEGYBKCA-LNCBFAARSA-N	1	1	291.391	2.034	40	0		CEABMO
COc1cccc([C@@H]([NH3+])c2nc(-c3ccoc3C)n[nH]2)c1	ZINC000095533536	185006179	/nfs/dbraw/zinc/00/61/79/185006179.db2.gz	BHXAKWLHSYZZBT-CYBMUJFWSA-N	1	1	284.319	2.430	40	0		CEABMO
c1coc(C[N@H+]2CCC[C@]3(C[C@H](n4ccnc4)CO3)C2)c1	ZINC000096048544	185072804	/nfs/dbraw/zinc/07/28/04/185072804.db2.gz	ODJOIXLINXIUPZ-HOCLYGCPSA-N	1	1	287.363	2.472	40	0		CEABMO
C[N@@H+]1CCOCC12CCN(Cc1ccc(F)cc1)CC2	ZINC000096048904	185073522	/nfs/dbraw/zinc/07/35/22/185073522.db2.gz	QCDAZINIUZFJAJ-UHFFFAOYSA-N	1	1	278.371	2.122	40	0		CEABMO
C[N@H+]1CCOCC12CCN(Cc1ccc(F)cc1)CC2	ZINC000096048904	185073524	/nfs/dbraw/zinc/07/35/24/185073524.db2.gz	QCDAZINIUZFJAJ-UHFFFAOYSA-N	1	1	278.371	2.122	40	0		CEABMO
C[NH+](C)C[C@@H]1OC[C@@H]2C[N@@H+](Cc3ccsc3)CC[C@H]12	ZINC000096057580	185077318	/nfs/dbraw/zinc/07/73/18/185077318.db2.gz	GQYAOYJVISIDGV-KKUMJFAQSA-N	1	1	280.437	2.147	40	0		CEABMO
O=C1CC[C@@H]2[C@@H](CC[N@H+]2Cc2ccncc2)N1CC1CC1	ZINC000096056551	185077382	/nfs/dbraw/zinc/07/73/82/185077382.db2.gz	QYUNRVGHTDJDQL-HZPDHXFCSA-N	1	1	285.391	2.057	40	0		CEABMO
O=C1CC[C@@]2(c3ccc(Cl)cc3)[NH2+]CCCCN12	ZINC000035572419	361822127	/nfs/dbraw/zinc/82/21/27/361822127.db2.gz	UIYOOZDJBDNOBF-CQSZACIVSA-N	1	1	264.756	2.499	40	0		CEABMO
O=C(Cc1cccs1)N1CC[C@]2(CC[N@H+]2CC2CC2)C1	ZINC000096076003	185090223	/nfs/dbraw/zinc/09/02/23/185090223.db2.gz	FHZNXFYBJNEPKR-INIZCTEOSA-N	1	1	290.432	2.377	40	0		CEABMO
Cc1nc(COCc2cnc3n2CC[N@H+](C)[C@@H]3C)cs1	ZINC000096109866	185099721	/nfs/dbraw/zinc/09/97/21/185099721.db2.gz	ODWVECWOCMMKOC-SNVBAGLBSA-N	1	1	292.408	2.371	40	0		CEABMO
OCC[N@@H+](Cc1ccc(Br)cc1)C1CC1	ZINC000048065474	362243166	/nfs/dbraw/zinc/24/31/66/362243166.db2.gz	SQLKDDHXDGYZEI-UHFFFAOYSA-N	1	1	270.170	2.406	40	0		CEABMO
[NH3+]Cc1noc([C@H](c2cccs2)n2cccc2)n1	ZINC000409441243	344889863	/nfs/dbraw/zinc/88/98/63/344889863.db2.gz	OFYIPMCWVZGULK-NSHDSACASA-N	1	1	260.322	2.029	40	0		CEABMO
[NH3+]CC(=O)c1cc(Cl)cc(I)c1	ZINC000097447178	185607447	/nfs/dbraw/zinc/60/74/47/185607447.db2.gz	ZXWNEYRWUAOCKI-UHFFFAOYSA-N	1	1	295.507	2.086	40	0		CEABMO
CC(C)(C)OC(=O)N(C[C@H]1CCC[N@@H+](CCO)C1)C1CC1	ZINC000079408233	363595834	/nfs/dbraw/zinc/59/58/34/363595834.db2.gz	GVONRHMNXDNATN-ZDUSSCGKSA-N	1	1	298.427	2.090	40	0		CEABMO
CN(C(=O)c1ccn[nH]1)C1CC(C)(C)[NH+](C)C(C)(C)C1	ZINC000000034376	361118507	/nfs/dbraw/zinc/11/85/07/361118507.db2.gz	RNBARUZKTHQASX-UHFFFAOYSA-N	1	1	278.400	2.133	40	0		CEABMO
O=c1cccc2n1C[C@@H]1C[C@H]2C[N@H+](Cc2ccccc2)C1	ZINC000005010309	361330521	/nfs/dbraw/zinc/33/05/21/361330521.db2.gz	OKPJEOSIUJHZFG-CVEARBPZSA-N	1	1	280.371	2.468	40	0		CEABMO
CC[NH+]1CCN(C(=O)Nc2ccc(F)cc2F)CC1	ZINC000016681502	361495307	/nfs/dbraw/zinc/49/53/07/361495307.db2.gz	IYQCTOKSYKGWQE-UHFFFAOYSA-N	1	1	269.295	2.134	40	0		CEABMO
CC[NH+](CC)[C@@H](CN)c1cc(OC)cc(OC)c1	ZINC000019840870	361561162	/nfs/dbraw/zinc/56/11/62/361561162.db2.gz	JTGMSFFSSBPGRA-AWEZNQCLSA-N	1	1	252.358	2.045	40	0		CEABMO
COCCn1cc(C[N@H+]2CC[C@H](CO)C2)c2ccccc21	ZINC000019594207	361545104	/nfs/dbraw/zinc/54/51/04/361545104.db2.gz	UOFACYKJPDPFLY-AWEZNQCLSA-N	1	1	288.391	2.102	40	0		CEABMO
CCN(CC)CC[NH2+]Cc1ccc(OC)cc1OC	ZINC000019919136	361566865	/nfs/dbraw/zinc/56/68/65/361566865.db2.gz	MSAAOSURZXKPRP-UHFFFAOYSA-N	1	1	266.385	2.135	40	0		CEABMO
C[NH+](C)[C@@H](C(=O)NCC1(C)COC1)c1ccc(Cl)cc1	ZINC000019656180	361546265	/nfs/dbraw/zinc/54/62/65/361546265.db2.gz	ADNHNGTVOSYISS-CYBMUJFWSA-N	1	1	296.798	2.095	40	0		CEABMO
Nc1cc(NCc2ccc(Br)cc2)nc[nH+]1	ZINC000087801460	363871089	/nfs/dbraw/zinc/87/10/89/363871089.db2.gz	PUDJWJRVMUEBPW-UHFFFAOYSA-N	1	1	279.141	2.433	40	0		CEABMO
Nc1cc(NCc2ccc(Br)cc2)[nH+]cn1	ZINC000087801460	363871094	/nfs/dbraw/zinc/87/10/94/363871094.db2.gz	PUDJWJRVMUEBPW-UHFFFAOYSA-N	1	1	279.141	2.433	40	0		CEABMO
CCC[N@H+]1CCN(CCOC)c2nc(C)ccc2C1	ZINC000096199040	364408917	/nfs/dbraw/zinc/40/89/17/364408917.db2.gz	OJAZWBVJEQEYGM-UHFFFAOYSA-N	1	1	263.385	2.068	40	0		CEABMO
CC(C)[N@H+](C)C[C@H]1C[C@@H]2CN(Cc3cccnc3)C[C@@H]2O1	ZINC000096251654	364416782	/nfs/dbraw/zinc/41/67/82/364416782.db2.gz	QHWYUHPSNPBTHN-ZACQAIPSSA-N	1	1	289.423	2.011	40	0		CEABMO
CC(C)[N@@H+](C)C[C@H]1C[C@@H]2CN(Cc3cccnc3)C[C@@H]2O1	ZINC000096251654	364416787	/nfs/dbraw/zinc/41/67/87/364416787.db2.gz	QHWYUHPSNPBTHN-ZACQAIPSSA-N	1	1	289.423	2.011	40	0		CEABMO
c1coc(C[N@@H+]2CC[C@H]3OCCN(CC4CC4)[C@@H]3CC2)c1	ZINC000096249302	364416935	/nfs/dbraw/zinc/41/69/35/364416935.db2.gz	OXKNUNVMFCNJIV-IAGOWNOFSA-N	1	1	290.407	2.355	40	0		CEABMO
c1coc(CN2CC[C@H]3OCC[N@@H+](CC4CC4)[C@@H]3CC2)c1	ZINC000096249302	364416939	/nfs/dbraw/zinc/41/69/39/364416939.db2.gz	OXKNUNVMFCNJIV-IAGOWNOFSA-N	1	1	290.407	2.355	40	0		CEABMO
c1coc(CN2CC[C@H]3OCC[N@H+](CC4CC4)[C@@H]3CC2)c1	ZINC000096249302	364416944	/nfs/dbraw/zinc/41/69/44/364416944.db2.gz	OXKNUNVMFCNJIV-IAGOWNOFSA-N	1	1	290.407	2.355	40	0		CEABMO
O=C1[C@H]2C[N@@H+](Cc3ccsc3)C[C@H]2CN1c1cccnc1	ZINC000096245174	364417115	/nfs/dbraw/zinc/41/71/15/364417115.db2.gz	DNZGVNIZPUTSIK-ZFWWWQNUSA-N	1	1	299.399	2.238	40	0		CEABMO
CN1CCO[C@]2(CCC[N@@H+](Cc3cccs3)C2)C1	ZINC000096268626	364419890	/nfs/dbraw/zinc/41/98/90/364419890.db2.gz	AQSFSFPAVZSNHN-CQSZACIVSA-N	1	1	266.410	2.045	40	0		CEABMO
OC[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C(F)(F)F	ZINC000102225116	364587791	/nfs/dbraw/zinc/58/77/91/364587791.db2.gz	JVJIYCXIYVNRHB-RYUDHWBXSA-N	1	1	259.271	2.289	40	0		CEABMO
CN1c2cccnc2C[N@@H+](C2CCCCC2)CC[C@H]1CO	ZINC000225496892	370299276	/nfs/dbraw/zinc/29/92/76/370299276.db2.gz	RODGZJKUDWMGLG-HNNXBMFYSA-N	1	1	289.423	2.417	40	0	biogenic,in-vitro	CEABMO
CNc1cc([C@@H]2CCCN(c3ncccn3)C2)cc[nH+]1	ZINC000257200343	371610928	/nfs/dbraw/zinc/61/09/28/371610928.db2.gz	ACXQDIRUBQAAMT-CYBMUJFWSA-N	1	1	269.352	2.297	40	0		CEABMO
Cc1c[nH]c([C@H]2CCCN(c3cc(C)ncn3)C2)[nH+]1	ZINC000257261219	371611126	/nfs/dbraw/zinc/61/11/26/371611126.db2.gz	LGFPBMUAAZGRQX-LBPRGKRZSA-N	1	1	257.341	2.201	40	0		CEABMO
Cc1cccc(N2CCO[C@H](c3cccc(N(C)C)n3)C2)[nH+]1	ZINC000257283123	371611647	/nfs/dbraw/zinc/61/16/47/371611647.db2.gz	OWVVLVDYQKHAOI-HNNXBMFYSA-N	1	1	298.390	2.429	40	0		CEABMO
FC(F)Cn1cc(C[NH2+]Cc2ccnn2C(F)F)cn1	ZINC000256050031	190002960	/nfs/dbraw/zinc/00/29/60/190002960.db2.gz	CKDLJRRWPLBDMT-UHFFFAOYSA-N	1	1	291.252	2.030	40	0		CEABMO
CCCn1cc(C[NH2+]Cc2c(C)nn(C)c2F)c(C)n1	ZINC000256051568	190003480	/nfs/dbraw/zinc/00/34/80/190003480.db2.gz	JRQQEINTFXHGJR-UHFFFAOYSA-N	1	1	279.363	2.072	40	0		CEABMO
CCn1nc(C)c(C[NH2+]Cc2ccnn2C(C)C)c1F	ZINC000256054964	190005486	/nfs/dbraw/zinc/00/54/86/190005486.db2.gz	YNEIRBLJCQHWKO-UHFFFAOYSA-N	1	1	279.363	2.418	40	0		CEABMO
CC(C)[N@H+]1CCC[C@H](c2nccnc2-c2cc[nH]n2)C1	ZINC000257243876	190018338	/nfs/dbraw/zinc/01/83/38/190018338.db2.gz	IIYJAMZHHXHNQK-LBPRGKRZSA-N	1	1	271.368	2.455	40	0		CEABMO
CCn1cc(-c2cnc(C[C@@H]3CCC[N@@H+](C)C3)cn2)cn1	ZINC000257247669	190019225	/nfs/dbraw/zinc/01/92/25/190019225.db2.gz	IZZUGRJQXOCHFJ-ZDUSSCGKSA-N	1	1	285.395	2.244	40	0		CEABMO
CCn1nccc1-c1cncc([C@@H]2CCC[N@@H+](C)C2)n1	ZINC000257262922	190022241	/nfs/dbraw/zinc/02/22/41/190022241.db2.gz	LNQOMPKHBKSNLT-GFCCVEGCSA-N	1	1	271.368	2.169	40	0		CEABMO
CC(C)[N@H+]1CCC[C@@H](c2cncc(N3CCOC3=O)n2)C1	ZINC000257263101	190022691	/nfs/dbraw/zinc/02/26/91/190022691.db2.gz	LOJOGOHTWCXGJK-GFCCVEGCSA-N	1	1	290.367	2.021	40	0		CEABMO
CN1CC[N@@H+](CC2CCOCC2)C[C@H]1c1ccccc1	ZINC000257276967	190025815	/nfs/dbraw/zinc/02/58/15/190025815.db2.gz	NVXIWKSFLGNMOR-KRWDZBQOSA-N	1	1	274.408	2.402	40	0		CEABMO
CCn1nc(C)c(C[N@H+]2CC[C@@H](c3cc[nH]n3)C2)c1C	ZINC000257304679	190030525	/nfs/dbraw/zinc/03/05/25/190030525.db2.gz	SMRZFIRWGUQAHL-CYBMUJFWSA-N	1	1	273.384	2.232	40	0		CEABMO
CN(C)c1cc([C@@H]2CCC[N@@H+]2Cc2cnccn2)ccn1	ZINC000257309462	190030966	/nfs/dbraw/zinc/03/09/66/190030966.db2.gz	UBAUZQYAZQTJFA-HNNXBMFYSA-N	1	1	283.379	2.275	40	0		CEABMO
CN(C)c1cc([C@@H]2CCC[N@H+]2Cc2cnccn2)ccn1	ZINC000257309462	190030967	/nfs/dbraw/zinc/03/09/67/190030967.db2.gz	UBAUZQYAZQTJFA-HNNXBMFYSA-N	1	1	283.379	2.275	40	0		CEABMO
Cc1ccnc([C@H]2CC[N@@H+](Cc3cccnc3)C2)n1	ZINC000257318693	190033622	/nfs/dbraw/zinc/03/36/22/190033622.db2.gz	VPABUMCZLGLZBY-AWEZNQCLSA-N	1	1	254.337	2.170	40	0		CEABMO
Cc1cn(C)c([C@H]2CCC[N@@H+](Cc3ccnc(C)n3)C2)n1	ZINC000257342605	190037131	/nfs/dbraw/zinc/03/71/31/190037131.db2.gz	ZPKUHMHWWFJSIU-AWEZNQCLSA-N	1	1	285.395	2.207	40	0		CEABMO
CC(C)[N@@H+]1CCC[C@H]1c1cccnc1N1CCN(C)CC1	ZINC000072216582	394593365	/nfs/dbraw/zinc/59/33/65/394593365.db2.gz	URPAHDFOTZAADV-INIZCTEOSA-N	1	1	288.439	2.379	40	0		CEABMO
CC(C)[N@H+]1CCC[C@H]1c1cccnc1N1CCN(C)CC1	ZINC000072216582	394593367	/nfs/dbraw/zinc/59/33/67/394593367.db2.gz	URPAHDFOTZAADV-INIZCTEOSA-N	1	1	288.439	2.379	40	0		CEABMO
Cc1cc([C@H]2CCCC[N@@H+]2C)cnc1N1CCOCC1	ZINC000072219355	394594282	/nfs/dbraw/zinc/59/42/82/394594282.db2.gz	PVFLDBQEPOWSBI-OAHLLOKOSA-N	1	1	275.396	2.383	40	0		CEABMO
[NH3+][C@@H]1C(=O)N(Cc2ccc(F)cc2)[C@H]1c1cccs1	ZINC000072228187	394596324	/nfs/dbraw/zinc/59/63/24/394596324.db2.gz	DLWZEQFIBPOGAK-STQMWFEESA-N	1	1	276.336	2.298	40	0		CEABMO
COc1cccc(N2C(=O)[C@@H]([NH3+])[C@@H]2c2ccccc2)c1	ZINC000072227719	394596349	/nfs/dbraw/zinc/59/63/49/394596349.db2.gz	ORSDLZMGXSGCNS-GJZGRUSLSA-N	1	1	268.316	2.110	40	0		CEABMO
COc1cccc(N2C(=O)[C@@H]([NH3+])[C@@H]2c2ccccc2F)c1	ZINC000072227759	394596428	/nfs/dbraw/zinc/59/64/28/394596428.db2.gz	WLKLXUJSOBBTIW-GJZGRUSLSA-N	1	1	286.306	2.250	40	0		CEABMO
Nc1ccc(C(=O)NC[C@H]2CCC[N@H+]3CCCC[C@@H]23)cc1	ZINC000005553179	170112403	/nfs/dbraw/zinc/11/24/03/170112403.db2.gz	MKNQZZGCGYYGOH-ZBFHGGJFSA-N	1	1	287.407	2.263	40	0		CEABMO
CC(C)(C)OC(=O)N1CCCN(c2[nH+]cccc2N)CC1	ZINC000020286652	171133384	/nfs/dbraw/zinc/13/33/84/171133384.db2.gz	YXTFNICVWBTAPU-UHFFFAOYSA-N	1	1	292.383	2.111	40	0		CEABMO
CC(=O)N1CCC(c2cccc(-n3cc[nH+]c3C)n2)CC1	ZINC000072355664	176375221	/nfs/dbraw/zinc/37/52/21/176375221.db2.gz	FWDXWPSEFGFYSR-UHFFFAOYSA-N	1	1	284.363	2.302	40	0		CEABMO
Cc1cc(Nc2cccc([C@H]3CCC[N@H+]3CCO)n2)no1	ZINC000072383040	176388115	/nfs/dbraw/zinc/38/81/15/176388115.db2.gz	ZUYKMGCTTZYUQL-CYBMUJFWSA-N	1	1	288.351	2.251	40	0		CEABMO
O=C1N(c2ccccc2)C[C@H]2C[N@H+](CC3CC3)CCN12	ZINC000077266523	177247244	/nfs/dbraw/zinc/24/72/44/177247244.db2.gz	JASVDHBQAZOAHE-OAHLLOKOSA-N	1	1	271.364	2.023	40	0	biogenic,in-vitro	CEABMO
Cc1ccc([C@@H]2[C@@H]([NH3+])C(=O)N2c2ccccc2)cc1	ZINC000059103825	274759390	/nfs/dbraw/zinc/75/93/90/274759390.db2.gz	QIKATRSAPXONBD-HUUCEWRRSA-N	1	1	252.317	2.410	40	0		CEABMO
C[C@H](CO)Nc1nc(N2Cc3ccccc3C[C@@H]2C)cc[nH+]1	ZINC000329066646	279360937	/nfs/dbraw/zinc/36/09/37/279360937.db2.gz	YDCZIBDFVHDHBB-OLZOCXBDSA-N	1	1	298.390	2.221	40	0		CEABMO
COC[C@]12CCCO[C@@H]1CC[N@@H+](Cc1c(C)noc1C)C2	ZINC000096038986	185068814	/nfs/dbraw/zinc/06/88/14/185068814.db2.gz	GZUKRQBPKZRFIF-HZPDHXFCSA-N	1	1	294.395	2.309	40	0		CEABMO
O=C1[C@H]2C[N@@H+](Cc3ccccn3)C[C@H]2CN1c1ccsc1	ZINC000096053687	185074905	/nfs/dbraw/zinc/07/49/05/185074905.db2.gz	KHGWGRKYLPWAMZ-WFASDCNBSA-N	1	1	299.399	2.238	40	0		CEABMO
CC(C)C[N@H+]1CC[C@@H]2[C@@H]1CCN2C(=O)c1ccccn1	ZINC000096055786	185075429	/nfs/dbraw/zinc/07/54/29/185075429.db2.gz	LYIZLWUPFKMNCC-LSDHHAIUSA-N	1	1	273.380	2.026	40	0		CEABMO
COC[C@@]12CCCO[C@H]1CC[N@@H+](Cc1ccccn1)C2	ZINC000096056721	185077709	/nfs/dbraw/zinc/07/77/09/185077709.db2.gz	YLSCRXPAZCUAOA-HOTGVXAUSA-N	1	1	276.380	2.099	40	0		CEABMO
CC(C)OCc1ncn2c1C[N@@H+](CC1CC1)CCC2	ZINC000096059054	185078832	/nfs/dbraw/zinc/07/88/32/185078832.db2.gz	YUQFDFIHAYEPRY-UHFFFAOYSA-N	1	1	263.385	2.424	40	0		CEABMO
c1cc(CO[C@@H]2C[N@@H+](CC3CC3)[C@H]3CCCO[C@@H]23)ccn1	ZINC000096058140	185079174	/nfs/dbraw/zinc/07/91/74/185079174.db2.gz	IONLEICGGFTNQG-GVDBMIGSSA-N	1	1	288.391	2.240	40	0		CEABMO
CC(C)OCc1nn(C)c2c1CC[N@@H+](CC1CC1)C2	ZINC000096058975	185079437	/nfs/dbraw/zinc/07/94/37/185079437.db2.gz	KAYBBWVVSBHSMM-UHFFFAOYSA-N	1	1	263.385	2.113	40	0		CEABMO
Cn1cc2c(n1)[C@@H](COCC1CC1)C[N@H+](CC1CC1)C2	ZINC000096059865	185080817	/nfs/dbraw/zinc/08/08/17/185080817.db2.gz	JDUDVFQXSXKBOK-OAHLLOKOSA-N	1	1	275.396	2.156	40	0		CEABMO
COC[C@@H]1C[N@@H+](CC2CC2)Cc2nn(CC3CC3)cc21	ZINC000096060464	185081092	/nfs/dbraw/zinc/08/10/92/185081092.db2.gz	XRHAUKRBIMBTAP-AWEZNQCLSA-N	1	1	275.396	2.249	40	0		CEABMO
CCOC[C@@H]1C[N@H+](Cc2ccc(C)o2)Cc2cnn(C)c21	ZINC000096060060	185081481	/nfs/dbraw/zinc/08/14/81/185081481.db2.gz	KDMYYJGGQMGQOX-AWEZNQCLSA-N	1	1	289.379	2.457	40	0		CEABMO
CCOC[C@@H]1C[N@@H+](Cc2ccc(C)o2)Cc2cnn(C)c21	ZINC000096060060	185081482	/nfs/dbraw/zinc/08/14/82/185081482.db2.gz	KDMYYJGGQMGQOX-AWEZNQCLSA-N	1	1	289.379	2.457	40	0		CEABMO
C[N@H+]1CCC[C@]2(CCN(C(=O)c3ccsc3)C2)C1	ZINC000096071568	185086745	/nfs/dbraw/zinc/08/67/45/185086745.db2.gz	XCLXNTAOOWJNGR-AWEZNQCLSA-N	1	1	264.394	2.306	40	0		CEABMO
COc1ncccc1C[N@H+]1CCC[C@@]2(C[C@H](C)CO2)C1	ZINC000096073319	185087876	/nfs/dbraw/zinc/08/78/76/185087876.db2.gz	PZNARHRGJCPOAI-XJKSGUPXSA-N	1	1	276.380	2.481	40	0		CEABMO
COc1ccccc1C[N@@H+]1CC[C@]2(C[C@@H](OC)CO2)C1	ZINC000096107686	185099697	/nfs/dbraw/zinc/09/96/97/185099697.db2.gz	DQMDGMOIYJJWNS-ZBFHGGJFSA-N	1	1	277.364	2.075	40	0		CEABMO
Cc1cncc(COCc2cnc3n2CC[N@H+](C)[C@@H]3C)c1	ZINC000096109908	185100253	/nfs/dbraw/zinc/10/02/53/185100253.db2.gz	ULZRUHXYFWYJJJ-CYBMUJFWSA-N	1	1	286.379	2.310	40	0		CEABMO
O=C1C[C@@H]2[C@H](CC[N@H+]2Cc2ccoc2)N1Cc1ccncc1	ZINC000096110715	185101564	/nfs/dbraw/zinc/10/15/64/185101564.db2.gz	NMQAKDBSYCNCTJ-JKSUJKDBSA-N	1	1	297.358	2.050	40	0		CEABMO
CO[C@@H]1CC=C2CC[N@H+]3CCC4=C(CCOC4)[C@]23C1	ZINC000001303481	343351027	/nfs/dbraw/zinc/35/10/27/343351027.db2.gz	QUJGKXLFHIGUGU-ZBFHGGJFSA-N	1	1	261.365	2.287	40	0		CEABMO
c1coc(CN2CC[C@H]3[C@H]2CC[N@@H+]3CC2CCOCC2)c1	ZINC000107199313	186162496	/nfs/dbraw/zinc/16/24/96/186162496.db2.gz	UBRITZGULJHKDT-DLBZAZTESA-N	1	1	290.407	2.355	40	0		CEABMO
CNC(=O)[C@@H]1CCC[C@@]12CC[N@@H+](Cc1cccs1)C2	ZINC000108534968	186222060	/nfs/dbraw/zinc/22/20/60/186222060.db2.gz	GHRGYHOTMDJJIQ-ZFWWWQNUSA-N	1	1	278.421	2.486	40	0		CEABMO
Cc1ccc(F)cc1C[N@@H+]1CC[C@@H]2OCCN(C)[C@H]2C1	ZINC000108529404	186222466	/nfs/dbraw/zinc/22/24/66/186222466.db2.gz	BYOWABIPLBYZHN-HOTGVXAUSA-N	1	1	278.371	2.039	40	0		CEABMO
CCNC(=O)COc1cc(C)[nH+]c2cc(OC)ccc21	ZINC000070503729	363092944	/nfs/dbraw/zinc/09/29/44/363092944.db2.gz	GCPKXSTZRPUFQU-UHFFFAOYSA-N	1	1	274.320	2.067	40	0		CEABMO
CNc1cccc([C@H]2CCCN(c3cnccn3)C2)[nH+]1	ZINC000072380918	363131801	/nfs/dbraw/zinc/13/18/01/363131801.db2.gz	CDFJZKYYYPWCRY-LBPRGKRZSA-N	1	1	269.352	2.297	40	0		CEABMO
COC(=O)c1cccc(NC(=O)[C@H]2CCC[N@@H+](C)C2)c1C	ZINC000072865974	363171935	/nfs/dbraw/zinc/17/19/35/363171935.db2.gz	XDJNSHRCAFNUPI-LBPRGKRZSA-N	1	1	290.363	2.062	40	0		CEABMO
COC(=O)[C@]1([NH3+])C[C@@H]1c1ccc(C(F)(F)F)cc1	ZINC000217738115	540168736	/nfs/dbraw/zinc/16/87/36/540168736.db2.gz	YDAZBKZPZWAQGX-KOLCDFICSA-N	1	1	259.227	2.063	40	0		CEABMO
CC(C)[N@@H+](CCO)C1CCN(Cc2ccccc2)CC1	ZINC000079395100	363596206	/nfs/dbraw/zinc/59/62/06/363596206.db2.gz	UWEGEBVJKPVVRO-UHFFFAOYSA-N	1	1	276.424	2.354	40	0		CEABMO
C[C@@H](NC(=O)[C@H]1CCC[N@@H+](C)C1)c1ccc(F)cc1	ZINC000081229411	363706349	/nfs/dbraw/zinc/70/63/49/363706349.db2.gz	NFDYWPSMUKIVND-YPMHNXCESA-N	1	1	264.344	2.345	40	0		CEABMO
c1nc2c(ncnc2NCCC[NH+]2CCCCCC2)[nH]1	ZINC000002719648	361246875	/nfs/dbraw/zinc/24/68/75/361246875.db2.gz	QXVDNTUNTAOCEP-UHFFFAOYSA-N	1	1	274.372	2.031	40	0		CEABMO
C[C@@H]1CCCC[N@H+]1[C@@H]1CC(=O)N(c2ccccc2)C1=O	ZINC000004019072	361297131	/nfs/dbraw/zinc/29/71/31/361297131.db2.gz	XOJZOOPMSCPKHK-TZMCWYRMSA-N	1	1	272.348	2.193	40	0		CEABMO
C[N@H+]1CCC[C@@H](C(=O)Nc2ccc(F)cc2F)C1	ZINC000082336774	363767879	/nfs/dbraw/zinc/76/78/79/363767879.db2.gz	FVASUJIRQBSLBJ-SECBINFHSA-N	1	1	254.280	2.245	40	0		CEABMO
O[C@@H]1C[C@@H](c2nc(Cc3ccccc3)no2)[N@H+](CC2CC2)C1	ZINC000015674656	361476645	/nfs/dbraw/zinc/47/66/45/361476645.db2.gz	GODIIWOWXJFXCM-CABCVRRESA-N	1	1	299.374	2.178	40	0	biogenic,in-vitro	CEABMO
O[C@@H]1C[C@@H](c2nc(Cc3ccccc3)no2)[N@@H+](CC2CC2)C1	ZINC000015674656	361476653	/nfs/dbraw/zinc/47/66/53/361476653.db2.gz	GODIIWOWXJFXCM-CABCVRRESA-N	1	1	299.374	2.178	40	0	biogenic,in-vitro	CEABMO
Cc1cc[nH+]c(N[C@H](O)C(Cl)(Cl)Cl)c1	ZINC000016954092	361500309	/nfs/dbraw/zinc/50/03/09/361500309.db2.gz	MYVVGGQDTSYSSK-SSDOTTSWSA-N	1	1	255.532	2.491	40	0		CEABMO
Cc1ncc2c(n1)C[C@H]1CC[C@@H]2[N@H+]1Cc1ccncc1	ZINC000019287513	361526970	/nfs/dbraw/zinc/52/69/70/361526970.db2.gz	DCNPDQBSPUDKOG-CJNGLKHVSA-N	1	1	266.348	2.442	40	0		CEABMO
Cc1ncc2c(n1)C[C@H]1CC[C@@H]2[N@@H+]1Cc1ccncc1	ZINC000019287513	361526976	/nfs/dbraw/zinc/52/69/76/361526976.db2.gz	DCNPDQBSPUDKOG-CJNGLKHVSA-N	1	1	266.348	2.442	40	0		CEABMO
CNC(=O)[C@]1(C)CCC[N@@H+](CCOc2ccc(C)cc2)C1	ZINC000019746653	361550737	/nfs/dbraw/zinc/55/07/37/361550737.db2.gz	UJBUBNFCUQBXAM-QGZVFWFLSA-N	1	1	290.407	2.222	40	0		CEABMO
C[NH+]1CCN(c2nc(-c3ccc(N)cc3)cs2)CC1	ZINC000095097226	364339608	/nfs/dbraw/zinc/33/96/08/364339608.db2.gz	INQODWLQZLCQNX-UHFFFAOYSA-N	1	1	274.393	2.144	40	0		CEABMO
Cc1ccc(CN2CCO[C@H]3C[N@H+](CC(C)C)C[C@H]32)o1	ZINC000096248806	364416289	/nfs/dbraw/zinc/41/62/89/364416289.db2.gz	QFZULKYZOXAHAH-CVEARBPZSA-N	1	1	278.396	2.129	40	0		CEABMO
C[N@H+]1CC[C@@]2(c3ccccc3)CCN(C(=O)NC3CC3)C[C@H]12	ZINC000096251830	364416614	/nfs/dbraw/zinc/41/66/14/364416614.db2.gz	UHTREDXJIPCEJL-WMZOPIPTSA-N	1	1	299.418	2.206	40	0		CEABMO
CCCNC(=O)C1=NO[C@@]2(C1)CCC[N@@H+](CCC(C)C)C2	ZINC000585101209	367177219	/nfs/dbraw/zinc/17/72/19/367177219.db2.gz	OBCULYIJHIEIKN-MRXNPFEDSA-N	1	1	295.427	2.170	40	0		CEABMO
CC(C)N1C[C@@]2(CCC[N@@H+](CC3CC(F)(F)C3)C2)C1=O	ZINC000585099333	367177432	/nfs/dbraw/zinc/17/74/32/367177432.db2.gz	FYTLARQUYQUGKZ-AWEZNQCLSA-N	1	1	286.366	2.365	40	0		CEABMO
CNc1cc([C@H]2CCCN(c3ccncn3)C2)cc[nH+]1	ZINC000257263002	371609659	/nfs/dbraw/zinc/60/96/59/371609659.db2.gz	LNXZFMOIEONQEC-ZDUSSCGKSA-N	1	1	269.352	2.297	40	0		CEABMO
Cc1c[nH]c([C@@H]2CCC[N@@H+](Cc3ccccn3)C2)n1	ZINC000257214261	190013519	/nfs/dbraw/zinc/01/35/19/190013519.db2.gz	CLHNKVHCOOTQFK-CYBMUJFWSA-N	1	1	256.353	2.493	40	0		CEABMO
CCn1nccc1-c1cnc([C@@H]2CCC[N@H+]2C)cn1	ZINC000257224549	190015701	/nfs/dbraw/zinc/01/57/01/190015701.db2.gz	FCGINBSAMSOYLW-ZDUSSCGKSA-N	1	1	257.341	2.127	40	0		CEABMO
Cc1cc(C2CC[NH+](Cc3cc[nH]n3)CC2)nc2ccnn21	ZINC000257252852	190020889	/nfs/dbraw/zinc/02/08/89/190020889.db2.gz	JWIKLEWBGJMUPB-UHFFFAOYSA-N	1	1	296.378	2.140	40	0		CEABMO
Cc1cc(N(C)C)cc([C@@H]2CC[N@@H+](C3CCOCC3)C2)n1	ZINC000257286877	190027216	/nfs/dbraw/zinc/02/72/16/190027216.db2.gz	PNKXYOVGDRLZPD-CQSZACIVSA-N	1	1	289.423	2.424	40	0		CEABMO
Cc1cc(N(C)C)cc([C@@H]2CC[N@H+](C3CCOCC3)C2)n1	ZINC000257286877	190027217	/nfs/dbraw/zinc/02/72/17/190027217.db2.gz	PNKXYOVGDRLZPD-CQSZACIVSA-N	1	1	289.423	2.424	40	0		CEABMO
Cc1cc(-c2cnc(C[C@H]3CC[N@H+](C(C)C)C3)cn2)n[nH]1	ZINC000257273978	190024920	/nfs/dbraw/zinc/02/49/20/190024920.db2.gz	NJAHNQXYGRUQGL-CYBMUJFWSA-N	1	1	285.395	2.448	40	0		CEABMO
Cc1nc[nH]c1C[N@H+]1CCC[C@H](c2ccc3c[nH]nc3n2)C1	ZINC000257317849	190032892	/nfs/dbraw/zinc/03/28/92/190032892.db2.gz	VLLGSVSFJHNQKH-ZDUSSCGKSA-N	1	1	296.378	2.369	40	0		CEABMO
Cc1[nH+]ccn1CC(=O)N1CCC[C@@H](Cc2cccnc2)C1	ZINC000257315650	190033029	/nfs/dbraw/zinc/03/30/29/190033029.db2.gz	VCHBDDLVILBMOJ-INIZCTEOSA-N	1	1	298.390	2.068	40	0		CEABMO
C[N@H+]1CCCCC[C@@H]2N(c3ncccn3)CC[C@@]21C	ZINC000257336370	190036604	/nfs/dbraw/zinc/03/66/04/190036604.db2.gz	YODITIKOMYEMCM-ZFWWWQNUSA-N	1	1	260.385	2.320	40	0		CEABMO
CNc1cncc([C@H]2CCC[N@@H+]2Cc2ccncc2)n1	ZINC000257343621	190037752	/nfs/dbraw/zinc/03/77/52/190037752.db2.gz	ZTTQEJNUWPEZDT-CQSZACIVSA-N	1	1	269.352	2.250	40	0		CEABMO
CNc1cncc([C@H]2CCC[N@H+]2Cc2ccncc2)n1	ZINC000257343621	190037753	/nfs/dbraw/zinc/03/77/53/190037753.db2.gz	ZTTQEJNUWPEZDT-CQSZACIVSA-N	1	1	269.352	2.250	40	0		CEABMO
Cc1ccc(N2CC[C@@H]3[C@H]2CC[N@H+]3Cc2ccccn2)nn1	ZINC000306127593	376540296	/nfs/dbraw/zinc/54/02/96/376540296.db2.gz	GCYODMMXAMATDJ-HZPDHXFCSA-N	1	1	295.390	2.033	40	0		CEABMO
O=C1CCC[C@]2(CCC[N@H+](Cc3ccc(F)cc3)C2)N1	ZINC000096049943	296321963	/nfs/dbraw/zinc/32/19/63/296321963.db2.gz	RHZNYTVNCMYEST-MRXNPFEDSA-N	1	1	276.355	2.460	40	0		CEABMO
Cc1cc(C)cc(OC[C@@H](O)C[NH+]2C[C@@H](C)O[C@H](C)C2)c1	ZINC000021487178	291848587	/nfs/dbraw/zinc/84/85/87/291848587.db2.gz	RBTQZJCHJLPEED-OAGGEKHMSA-N	1	1	293.407	2.152	40	0		CEABMO
CC(C)[N@@H+]1C[C@H]2c3cnc(NCC4CC4)nc3C[C@@H]2C1	ZINC000306144976	394513722	/nfs/dbraw/zinc/51/37/22/394513722.db2.gz	ZTUHRCQNILDEKU-TZMCWYRMSA-N	1	1	272.396	2.278	40	0		CEABMO
COc1c2c(c(C(F)F)c3c1C[N@@H+](C)CC3)OCO2	ZINC000242390143	394495838	/nfs/dbraw/zinc/49/58/38/394495838.db2.gz	AAJCQVZATBJHCH-UHFFFAOYSA-N	1	1	271.263	2.349	40	0		CEABMO
CC[N@H+]1CCC[C@@H]1c1cccnc1N1CCOCC1	ZINC000072216213	394593619	/nfs/dbraw/zinc/59/36/19/394593619.db2.gz	FGXWEXFSRCNSDW-CQSZACIVSA-N	1	1	261.369	2.075	40	0		CEABMO
COc1ccc([C@@H]2[C@H]([NH3+])C(=O)N2c2ccccc2)cc1OC	ZINC000072227342	394595356	/nfs/dbraw/zinc/59/53/56/394595356.db2.gz	VEIVVGZNCWAKLY-JKSUJKDBSA-N	1	1	298.342	2.119	40	0		CEABMO
COc1cccc(N2C(=O)[C@H]([NH3+])[C@H]2c2ccccc2)c1	ZINC000072227720	394596682	/nfs/dbraw/zinc/59/66/82/394596682.db2.gz	ORSDLZMGXSGCNS-HUUCEWRRSA-N	1	1	268.316	2.110	40	0		CEABMO
C[NH+](C)Cc1cc2c(cc1Br)OCCO2	ZINC000096515720	394694474	/nfs/dbraw/zinc/69/44/74/394694474.db2.gz	ITKPBICVDVNLSL-UHFFFAOYSA-N	1	1	272.142	2.282	40	0		CEABMO
CCCCOC[C@H](O)C[N@H+]1CCc2ccccc2C1	ZINC000008844775	170357399	/nfs/dbraw/zinc/35/73/99/170357399.db2.gz	OEEALKPMNGSFLR-MRXNPFEDSA-N	1	1	263.381	2.222	40	0		CEABMO
COc1ccc(-c2ccc([C@@H]([NH3+])CC(N)=O)o2)cc1Cl	ZINC000044253050	175156510	/nfs/dbraw/zinc/15/65/10/175156510.db2.gz	ODDITLNVCRNVAG-JTQLQIEISA-N	1	1	294.738	2.484	40	0		CEABMO
CC[N@H+](Cc1ccc(C)cc1)[C@H]1CCS(=O)(=O)C1	ZINC000071006060	176020565	/nfs/dbraw/zinc/02/05/65/176020565.db2.gz	FMDRCYUIUSUAKF-AWEZNQCLSA-N	1	1	267.394	2.004	40	0		CEABMO
CC[N@@H+](Cc1ccc(C)cc1)[C@H]1CCS(=O)(=O)C1	ZINC000071006060	176020567	/nfs/dbraw/zinc/02/05/67/176020567.db2.gz	FMDRCYUIUSUAKF-AWEZNQCLSA-N	1	1	267.394	2.004	40	0		CEABMO
Cc1nccn1-c1cccc([C@H]2CCC[N@H+](C)C2)n1	ZINC000072355668	176375026	/nfs/dbraw/zinc/37/50/26/176375026.db2.gz	CMHJUKZFOODYNP-ZDUSSCGKSA-N	1	1	256.353	2.385	40	0		CEABMO
Cc1cc(Nc2ncccn2)nc([C@@H]2CCC[N@H+](C)C2)n1	ZINC000072359945	176376945	/nfs/dbraw/zinc/37/69/45/176376945.db2.gz	LKOFNRCYYAMZTH-GFCCVEGCSA-N	1	1	284.367	2.128	40	0		CEABMO
C[N@H+]1CCC[C@H](c2cnc(Nc3nccs3)cn2)C1	ZINC000072361543	176377882	/nfs/dbraw/zinc/37/78/82/176377882.db2.gz	LRKNQVBPEFZRQM-JTQLQIEISA-N	1	1	275.381	2.486	40	0		CEABMO
CNc1ccc(C[C@H]2CCC[N@@H+](Cc3cccnc3)C2)nn1	ZINC000072387312	176392765	/nfs/dbraw/zinc/39/27/65/176392765.db2.gz	UKEPVTDTKSSVIU-CQSZACIVSA-N	1	1	297.406	2.368	40	0		CEABMO
COc1ccccc1[C@@H]1CN(c2ccnc(C)n2)CC[N@@H+]1C	ZINC000257240022	274162863	/nfs/dbraw/zinc/16/28/63/274162863.db2.gz	HRTBLBQGZBKXFF-HNNXBMFYSA-N	1	1	298.390	2.287	40	0		CEABMO
COc1ccccc1[C@@H]1CN(c2ccnc(C)n2)CC[N@H+]1C	ZINC000257240022	274162865	/nfs/dbraw/zinc/16/28/65/274162865.db2.gz	HRTBLBQGZBKXFF-HNNXBMFYSA-N	1	1	298.390	2.287	40	0		CEABMO
CC(C)N(C(=O)OC(C)(C)C)[C@H]1CCC[N@@H+](CCO)C1	ZINC000079408103	279299513	/nfs/dbraw/zinc/29/95/13/279299513.db2.gz	RVHXBXMKCHWOOA-ZDUSSCGKSA-N	1	1	286.416	2.089	40	0		CEABMO
[NH3+][C@@H](c1nc(-c2ccccc2O)n[nH]1)c1ccccc1	ZINC000095533385	185006039	/nfs/dbraw/zinc/00/60/39/185006039.db2.gz	GWNFELRNQCMAAH-CYBMUJFWSA-N	1	1	266.304	2.225	40	0		CEABMO
c1cncc(C[N@H+]2CC[C@H]3C[C@@H](c4ccncn4)O[C@@H]3C2)c1	ZINC000096046326	185071855	/nfs/dbraw/zinc/07/18/55/185071855.db2.gz	GNMKHTUKZWUTOC-BHYGNILZSA-N	1	1	296.374	2.224	40	0		CEABMO
CCOC[C@]12CCCO[C@@H]1CC[N@@H+](Cc1cccnc1)C2	ZINC000096056808	185078024	/nfs/dbraw/zinc/07/80/24/185078024.db2.gz	QGEMVTUHWNOLFE-IAGOWNOFSA-N	1	1	290.407	2.489	40	0		CEABMO
CCN(C)c1ncnc2c1CC[N@@H+](Cc1ccoc1)CC2	ZINC000096058789	185079400	/nfs/dbraw/zinc/07/94/00/185079400.db2.gz	IZDOXZPHHSSYTH-UHFFFAOYSA-N	1	1	286.379	2.127	40	0		CEABMO
CCOC[C@]12COC[C@H]1C[N@@H+](Cc1ccccc1OC)C2	ZINC000096108674	185099258	/nfs/dbraw/zinc/09/92/58/185099258.db2.gz	QWZPHFFFWUUZAJ-NVXWUHKLSA-N	1	1	291.391	2.180	40	0		CEABMO
F[C@@H]1C[N@@H+](C2CCC2)C[C@@H]1OCc1nc2cccnc2[nH]1	ZINC000096112143	185100930	/nfs/dbraw/zinc/10/09/30/185100930.db2.gz	MUSVYNZABMFTTQ-YPMHNXCESA-N	1	1	290.342	2.049	40	0	biogenic,in-vitro	CEABMO
F[C@@H]1C[N@H+](C2CCC2)C[C@@H]1OCc1nc2cccnc2[nH]1	ZINC000096112143	185100931	/nfs/dbraw/zinc/10/09/31/185100931.db2.gz	MUSVYNZABMFTTQ-YPMHNXCESA-N	1	1	290.342	2.049	40	0	biogenic,in-vitro	CEABMO
C[C@@H]1CCC[N@@H+](CCCNC(=O)C2CCCC2)C1	ZINC000046960002	362191690	/nfs/dbraw/zinc/19/16/90/362191690.db2.gz	FHYVGIFKIHUBBH-CYBMUJFWSA-N	1	1	252.402	2.415	40	0		CEABMO
c1cncc(-c2nnc([C@H]3CC[N@H+](C4CCC4)C3)o2)c1	ZINC000049169650	362343080	/nfs/dbraw/zinc/34/30/80/362343080.db2.gz	CZGWCOYWQNUJPD-LBPRGKRZSA-N	1	1	270.336	2.473	40	0	biogenic,in-vitro	CEABMO
c1c[nH]c(C[N@@H+]2CC[C@H](c3nc4ccccc4[nH]3)C2)n1	ZINC000049169080	362343407	/nfs/dbraw/zinc/34/34/07/362343407.db2.gz	UHHRDILJRYAXCL-NSHDSACASA-N	1	1	267.336	2.276	40	0	biogenic,in-vitro	CEABMO
c1c[nH]c(C[N@H+]2CC[C@H](c3nc4ccccc4[nH]3)C2)n1	ZINC000049169080	362343412	/nfs/dbraw/zinc/34/34/12/362343412.db2.gz	UHHRDILJRYAXCL-NSHDSACASA-N	1	1	267.336	2.276	40	0	biogenic,in-vitro	CEABMO
CC(C)[N@H+]1CCC[C@@H]1c1cncc(-c2nccn2C)n1	ZINC000585178864	345009206	/nfs/dbraw/zinc/00/92/06/345009206.db2.gz	UBYVYLCPNQCPSL-CQSZACIVSA-N	1	1	271.368	2.422	40	0		CEABMO
O=C1CC[C@]2(CCC[N@@H+](CCOc3ccccc3)C2)O1	ZINC000585282260	345009909	/nfs/dbraw/zinc/00/99/09/345009909.db2.gz	CFFRVEKENJRPCS-INIZCTEOSA-N	1	1	275.348	2.237	40	0		CEABMO
C[C@]12CC[N@@H+](CC3(O)CCCCC3)[C@H]1CCCCC(=O)N2	ZINC000585283492	345009914	/nfs/dbraw/zinc/00/99/14/345009914.db2.gz	OTGAWZIMVBMYFL-HOCLYGCPSA-N	1	1	294.439	2.205	40	0		CEABMO
Cc1n[nH]cc1C[N@H+]1CC[C@H](Cc2ccccc2)[C@H](O)C1	ZINC000585278836	345010018	/nfs/dbraw/zinc/01/00/18/345010018.db2.gz	HJDNJVMBIFAZFY-NVXWUHKLSA-N	1	1	285.391	2.144	40	0		CEABMO
Cc1cncc(C[N@H+]2CCC[C@]3(CCC(=O)O3)C2)c1	ZINC000585283457	345010034	/nfs/dbraw/zinc/01/00/34/345010034.db2.gz	OMCFLNJKXHQWGN-HNNXBMFYSA-N	1	1	260.337	2.062	40	0		CEABMO
Oc1ccc(Cl)c2ccc(CC[NH+]3CCOCC3)nc12	ZINC000059474704	362649595	/nfs/dbraw/zinc/64/95/95/362649595.db2.gz	APPYGHNKECJIEM-UHFFFAOYSA-N	1	1	292.766	2.469	40	0		CEABMO
CC(C)(C)OC(=O)N1CCC(Nc2ccc(N)c[nH+]2)CC1	ZINC000067800652	362925222	/nfs/dbraw/zinc/92/52/22/362925222.db2.gz	FQTYGHIEYTTWFB-UHFFFAOYSA-N	1	1	292.383	2.475	40	0		CEABMO
c1coc(C[N@H+]2CCC[C@]3(C[C@@H](n4ccnc4)CO3)C2)c1	ZINC000107731326	186189081	/nfs/dbraw/zinc/18/90/81/186189081.db2.gz	ODJOIXLINXIUPZ-ZBFHGGJFSA-N	1	1	287.363	2.472	40	0		CEABMO
COC[C@@]12CCCO[C@H]1CC[N@@H+](Cc1c(C)noc1C)C2	ZINC000107711053	186188144	/nfs/dbraw/zinc/18/81/44/186188144.db2.gz	GZUKRQBPKZRFIF-HOTGVXAUSA-N	1	1	294.395	2.309	40	0		CEABMO
O=C([C@H]1CCC[C@]12CC[N@@H+](CC1CC1)C2)N1CC(F)(F)C1	ZINC000108531109	186221590	/nfs/dbraw/zinc/22/15/90/186221590.db2.gz	HKEHDJZHPRFTIW-UKRRQHHQSA-N	1	1	298.377	2.366	40	0		CEABMO
CNC(=O)[C@H]1CCC[C@]12CC[N@@H+](Cc1ncccc1C)C2	ZINC000108530796	186221886	/nfs/dbraw/zinc/22/18/86/186221886.db2.gz	LTDMHYXTONCYPG-RHSMWYFYSA-N	1	1	287.407	2.128	40	0		CEABMO
Cc1ccccc1OC[C@H](C)NC(=O)[C@H]1CCC[N@@H+](C)C1	ZINC000073048711	363194185	/nfs/dbraw/zinc/19/41/85/363194185.db2.gz	QZJQGRTYWPIMOH-GJZGRUSLSA-N	1	1	290.407	2.220	40	0		CEABMO
Cc1ccccc1OC[C@@H](C)NC(=O)[C@@H]1CCC[N@@H+](C)C1	ZINC000073048701	363194474	/nfs/dbraw/zinc/19/44/74/363194474.db2.gz	QZJQGRTYWPIMOH-HUUCEWRRSA-N	1	1	290.407	2.220	40	0		CEABMO
CCOc1ccccc1NC(=O)[C@@H]1CCC[N@@H+](C)C1	ZINC000082326027	363765450	/nfs/dbraw/zinc/76/54/50/363765450.db2.gz	XDEIKPCOHKPNLE-GFCCVEGCSA-N	1	1	262.353	2.366	40	0		CEABMO
Cc1nc([C@@H]2CC[N@@H+](Cc3ccccc3)C2)cc(=O)[nH]1	ZINC000019285266	361526461	/nfs/dbraw/zinc/52/64/61/361526461.db2.gz	GSLXRSXVXKOFMX-CQSZACIVSA-N	1	1	269.348	2.068	40	0		CEABMO
CC(C)C[N@H+]1C[C@H](OCc2ccccn2)[C@H]2OCCC[C@H]21	ZINC000096187175	364406920	/nfs/dbraw/zinc/40/69/20/364406920.db2.gz	KOZXAIHNEUVMOG-IKGGRYGDSA-N	1	1	290.407	2.486	40	0		CEABMO
Cc1ccc(C[N@@H+]2CC[C@H]3[C@H]2CC(=O)N3c2cccnc2)o1	ZINC000096184090	364407645	/nfs/dbraw/zinc/40/76/45/364407645.db2.gz	UAHKTVBTYQPKOZ-JKSUJKDBSA-N	1	1	297.358	2.363	40	0		CEABMO
Cc1ccc(C[N@H+]2CC[C@H]3[C@H]2CC(=O)N3c2cccnc2)o1	ZINC000096184090	364407647	/nfs/dbraw/zinc/40/76/47/364407647.db2.gz	UAHKTVBTYQPKOZ-JKSUJKDBSA-N	1	1	297.358	2.363	40	0		CEABMO
O[C@H]1CC[N@@H+](Cc2ccsc2)[C@H]1Cc1ccncc1	ZINC000096200713	364411095	/nfs/dbraw/zinc/41/10/95/364411095.db2.gz	XIJBPPCNNHFGAZ-GJZGRUSLSA-N	1	1	274.389	2.321	40	0		CEABMO
Cc1ccc(CN2CCO[C@H]3C[N@@H+](CC4CCC4)C[C@H]32)o1	ZINC000096248808	364417215	/nfs/dbraw/zinc/41/72/15/364417215.db2.gz	DCRBQDHFKYFLKI-SJORKVTESA-N	1	1	290.407	2.273	40	0		CEABMO
CN(C)C(=O)N1CC[C@]2(c3ccccc3)CC[N@@H+](C)[C@H]2C1	ZINC000096251827	364417237	/nfs/dbraw/zinc/41/72/37/364417237.db2.gz	PXSZZMGCICPJRP-RDJZCZTQSA-N	1	1	287.407	2.016	40	0		CEABMO
CCc1ncnc2c1CC[N@@H+](Cc1cccc(C)n1)CC2	ZINC000096255023	364418118	/nfs/dbraw/zinc/41/81/18/364418118.db2.gz	QNOKZAOUPGAKTJ-UHFFFAOYSA-N	1	1	282.391	2.343	40	0		CEABMO
Cc1ccc(C[N@H+]2CCc3ncnc(C)c3CC2)o1	ZINC000096254947	364418159	/nfs/dbraw/zinc/41/81/59/364418159.db2.gz	JRBROGRFIBPUJY-UHFFFAOYSA-N	1	1	257.337	2.287	40	0		CEABMO
COc1cccc(C(=O)N2CCC3(CC[N@@H+](C)C3)CC2)c1	ZINC000096268531	364420671	/nfs/dbraw/zinc/42/06/71/364420671.db2.gz	WAPJLWKAWYUCCF-UHFFFAOYSA-N	1	1	288.391	2.253	40	0		CEABMO
OC[C@@H]1CCn2nccc2C[N@@H+]1Cc1ccc2c(c1)CCC2	ZINC000585098649	367177751	/nfs/dbraw/zinc/17/77/51/367177751.db2.gz	ZYGSMIXTAVIBGT-SFHVURJKSA-N	1	1	297.402	2.139	40	0		CEABMO
OC[C@@H]1CCn2nccc2C[N@H+]1Cc1ccc2c(c1)CCC2	ZINC000585098649	367177760	/nfs/dbraw/zinc/17/77/60/367177760.db2.gz	ZYGSMIXTAVIBGT-SFHVURJKSA-N	1	1	297.402	2.139	40	0		CEABMO
Cc1cc(C)c(C(=O)NCCC[NH+]2CCOCC2)cc1C	ZINC000225649614	370310175	/nfs/dbraw/zinc/31/01/75/370310175.db2.gz	ANZCCYZGGAGMJP-UHFFFAOYSA-N	1	1	290.407	2.064	40	0		CEABMO
c1csc(CN2CC[C@H]3[C@H]2CC[N@@H+]3CC2CC2)n1	ZINC000253590786	371530311	/nfs/dbraw/zinc/53/03/11/371530311.db2.gz	FROUFMGEDWSKDO-QWHCGFSZSA-N	1	1	263.410	2.202	40	0		CEABMO
CC[C@@H](C)n1nccc1C[NH2+]Cc1ccnn1CCF	ZINC000256050175	190003201	/nfs/dbraw/zinc/00/32/01/190003201.db2.gz	DAUQBVDLMWPJNI-GFCCVEGCSA-N	1	1	279.363	2.310	40	0		CEABMO
FC(F)n1nccc1C[NH2+]Cc1ccnn1C(F)F	ZINC000256050578	190003332	/nfs/dbraw/zinc/00/33/32/190003332.db2.gz	FPPNANALFDAKPB-UHFFFAOYSA-N	1	1	277.225	2.160	40	0		CEABMO
CCn1cc(C[NH2+]Cc2cc(C(C)C)nn2C)c(C)n1	ZINC000256052308	190004426	/nfs/dbraw/zinc/00/44/26/190004426.db2.gz	MUVJPLDMPYHENO-UHFFFAOYSA-N	1	1	275.400	2.358	40	0		CEABMO
Cc1cc2nccc(C3CC[NH+](Cc4cc[nH]n4)CC3)n2n1	ZINC000257230850	190016019	/nfs/dbraw/zinc/01/60/19/190016019.db2.gz	GEECSGRSYUPYEH-UHFFFAOYSA-N	1	1	296.378	2.140	40	0		CEABMO
Cc1nccn1C[C@H]1CCC[N@@H+](Cc2ccncc2)C1	ZINC000257243796	190018240	/nfs/dbraw/zinc/01/82/40/190018240.db2.gz	IIOPGNQRTGIAJS-INIZCTEOSA-N	1	1	270.380	2.499	40	0		CEABMO
CCn1cc(-c2nccnc2C[C@H]2CCC[N@@H+](C)C2)cn1	ZINC000257243165	190018442	/nfs/dbraw/zinc/01/84/42/190018442.db2.gz	IFRMHXNINWBTLQ-CYBMUJFWSA-N	1	1	285.395	2.244	40	0		CEABMO
CCN1CCC([N@H+]2CCC[C@H](Cc3cc[nH]n3)C2)CC1	ZINC000257279208	190025331	/nfs/dbraw/zinc/02/53/31/190025331.db2.gz	OFNJQCAGCXYEDY-CQSZACIVSA-N	1	1	276.428	2.149	40	0		CEABMO
CC(C)n1ccnc1C[N@@H+]1CC[C@H](c2cc[nH]n2)C1	ZINC000257293750	190028552	/nfs/dbraw/zinc/02/85/52/190028552.db2.gz	QQZVCZFPAHXFCI-LBPRGKRZSA-N	1	1	259.357	2.177	40	0		CEABMO
CC(C)n1ccnc1C[N@H+]1CC[C@H](c2cc[nH]n2)C1	ZINC000257293750	190028553	/nfs/dbraw/zinc/02/85/53/190028553.db2.gz	QQZVCZFPAHXFCI-LBPRGKRZSA-N	1	1	259.357	2.177	40	0		CEABMO
Cc1cccc(C[N@H+]2CC[C@H](c3nccc(C)n3)C2)n1	ZINC000257293389	190028783	/nfs/dbraw/zinc/02/87/83/190028783.db2.gz	QPGSNILBQSWVDJ-AWEZNQCLSA-N	1	1	268.364	2.478	40	0		CEABMO
Cc1c(C[N@H+]2CC[C@@H](Cc3nccs3)C2)cnn1C	ZINC000257301144	190030298	/nfs/dbraw/zinc/03/02/98/190030298.db2.gz	RXDOWZIUABEXGQ-LBPRGKRZSA-N	1	1	276.409	2.250	40	0		CEABMO
COC(=O)[C@H]1C[C@@H]2CC(=O)C[C@H](C1)[N@@H+]2Cc1ccccc1	ZINC000265540973	190189180	/nfs/dbraw/zinc/18/91/80/190189180.db2.gz	YQUMDJWPDFMASF-QDMKHBRRSA-N	1	1	287.359	2.172	40	0		CEABMO
Cc1nc(N2CCOCC2)ccc1[C@@H]1CCCC[N@@H+]1C	ZINC000072219639	394594494	/nfs/dbraw/zinc/59/44/94/394594494.db2.gz	ROFHTNGNDVYMKN-HNNXBMFYSA-N	1	1	275.396	2.383	40	0		CEABMO
COc1ccc([C@@H]2[C@@H]([NH3+])C(=O)N2c2ccc(F)cc2)cc1	ZINC000072227196	394595305	/nfs/dbraw/zinc/59/53/05/394595305.db2.gz	VBNMIFZYFRVQMV-HUUCEWRRSA-N	1	1	286.306	2.250	40	0		CEABMO
COc1ccc([C@@H]2[C@H]([NH3+])C(=O)N2c2cccc(C)c2)cc1	ZINC000072227398	394595347	/nfs/dbraw/zinc/59/53/47/394595347.db2.gz	JVLQZDFTFIYYDA-JKSUJKDBSA-N	1	1	282.343	2.419	40	0		CEABMO
COc1ccc([C@H]2[C@@H]([NH3+])C(=O)N2c2ccc(F)cc2)cc1	ZINC000072227197	394595441	/nfs/dbraw/zinc/59/54/41/394595441.db2.gz	VBNMIFZYFRVQMV-CABCVRRESA-N	1	1	286.306	2.250	40	0		CEABMO
[NH3+][C@@H]1C(=O)N(c2ccccc2)[C@H]1c1ccccc1F	ZINC000072227379	394595535	/nfs/dbraw/zinc/59/55/35/394595535.db2.gz	MPFLSNBXZVSLMS-KBPBESRZSA-N	1	1	256.280	2.241	40	0		CEABMO
COc1cccc(N2C(=O)[C@@H]([NH3+])[C@H]2c2ccc(C)cc2)c1	ZINC000072227726	394596058	/nfs/dbraw/zinc/59/60/58/394596058.db2.gz	ATICMZPWYIMLJQ-JKSUJKDBSA-N	1	1	282.343	2.419	40	0		CEABMO
COc1cccc([C@@H]2[C@@H]([NH3+])C(=O)N2c2cccc(OC)c2)c1	ZINC000072227740	394596239	/nfs/dbraw/zinc/59/62/39/394596239.db2.gz	AHZUWXRMCSFCAV-HZPDHXFCSA-N	1	1	298.342	2.119	40	0		CEABMO
CC(=O)N1CCC[C@@H](c2cccc(-n3cc[nH+]c3C)n2)C1	ZINC000072355660	176374624	/nfs/dbraw/zinc/37/46/24/176374624.db2.gz	RVVVFIRVJGJXFS-CQSZACIVSA-N	1	1	284.363	2.302	40	0		CEABMO
CNC(=O)CCc1cc(C)nc([C@@H]2CCC[N@H+]2C(C)C)n1	ZINC000072366555	176382058	/nfs/dbraw/zinc/38/20/58/176382058.db2.gz	AJBRTMRCCITECS-AWEZNQCLSA-N	1	1	290.411	2.009	40	0		CEABMO
Fc1ccccc1OCCc1cc([C@H]2CC[NH2+]C2)n[nH]1	ZINC000072374090	176385352	/nfs/dbraw/zinc/38/53/52/176385352.db2.gz	HJLRSTNAMRKZQT-NSHDSACASA-N	1	1	275.327	2.247	40	0		CEABMO
C[N@H+]1CCCC[C@@H]1c1ccnc(Nc2cncnc2)n1	ZINC000072377392	176385734	/nfs/dbraw/zinc/38/57/34/176385734.db2.gz	ZYRHFHJPZBBVEP-CYBMUJFWSA-N	1	1	270.340	2.167	40	0		CEABMO
Cc1cc(Nc2ncccn2)nc([C@@H]2CCC[N@H+]2C)n1	ZINC000072382347	176388317	/nfs/dbraw/zinc/38/83/17/176388317.db2.gz	CIWOAGHMYPQUCG-NSHDSACASA-N	1	1	270.340	2.085	40	0		CEABMO
Cc1cc(Nc2ncccn2)nc([C@@H]2CCC[N@@H+]2C)n1	ZINC000072382347	176388319	/nfs/dbraw/zinc/38/83/19/176388319.db2.gz	CIWOAGHMYPQUCG-NSHDSACASA-N	1	1	270.340	2.085	40	0		CEABMO
c1cc([C@H]2CC[N@H+](CCOc3ccccc3)C2)n[nH]1	ZINC000072385396	176389966	/nfs/dbraw/zinc/38/99/66/176389966.db2.gz	YCTYCXMVGCFEHI-ZDUSSCGKSA-N	1	1	257.337	2.278	40	0		CEABMO
CNc1ncccc1C[N@H+]1CCC[C@H](c2cc[nH]n2)C1	ZINC000072386193	176391746	/nfs/dbraw/zinc/39/17/46/176391746.db2.gz	YSNOQJADAJMTBT-LBPRGKRZSA-N	1	1	271.368	2.226	40	0		CEABMO
COC(=O)c1ccc(-c2ccc3c(c2)[C@H]([NH3+])C(=O)N3)cc1	ZINC000254286875	274001059	/nfs/dbraw/zinc/00/10/59/274001059.db2.gz	NKMHIPKCLQVQFF-AWEZNQCLSA-N	1	1	282.299	2.092	40	0		CEABMO
CC(=O)Oc1ccc(CN2C[C@@H]3CCC[N@@H+]3C[C@H]2C)cc1	ZINC000072397551	277094473	/nfs/dbraw/zinc/09/44/73/277094473.db2.gz	DJHQGWZGQNFFAR-CJNGLKHVSA-N	1	1	288.391	2.280	40	0		CEABMO
CC(C)N(C(=O)OC(C)(C)C)[C@@H]1CCC[N@@H+](CCO)C1	ZINC000079408094	279299570	/nfs/dbraw/zinc/29/95/70/279299570.db2.gz	RVHXBXMKCHWOOA-CYBMUJFWSA-N	1	1	286.416	2.089	40	0		CEABMO
C[C@@H](CCN1C[C@H]2C[C@@H](O)C[N@H+]2C[C@@H]1C)c1ccccc1	ZINC000248241458	334297480	/nfs/dbraw/zinc/29/74/80/334297480.db2.gz	OQWLLWPCXDAZNO-CWLKWCNXSA-N	1	1	288.435	2.320	40	0		CEABMO
C[C@@H](CC[N@@H+]1C[C@H]2C[C@@H](O)CN2C[C@@H]1C)c1ccccc1	ZINC000248241458	334297481	/nfs/dbraw/zinc/29/74/81/334297481.db2.gz	OQWLLWPCXDAZNO-CWLKWCNXSA-N	1	1	288.435	2.320	40	0		CEABMO
C[C@@H](CC[N@H+]1C[C@H]2C[C@@H](O)CN2C[C@@H]1C)c1ccccc1	ZINC000248241458	334297482	/nfs/dbraw/zinc/29/74/82/334297482.db2.gz	OQWLLWPCXDAZNO-CWLKWCNXSA-N	1	1	288.435	2.320	40	0		CEABMO
CC[NH+]1CCN(C(=O)CCCOc2ccc(C)cc2)CC1	ZINC000014396506	529123645	/nfs/dbraw/zinc/12/36/45/529123645.db2.gz	QKDVEHNXSUUCDY-UHFFFAOYSA-N	1	1	290.407	2.318	40	0		CEABMO
CCCn1cc(C[N@H+]2CCC[C@@H](c3cc[nH]n3)C2)cn1	ZINC000121227221	365538149	/nfs/dbraw/zinc/53/81/49/365538149.db2.gz	IATGUWSQRPVGLW-CQSZACIVSA-N	1	1	273.384	2.396	40	0		CEABMO
COC[C@]12CCCO[C@H]1CC[N@@H+](Cc1c(C)noc1C)C2	ZINC000096038987	185069187	/nfs/dbraw/zinc/06/91/87/185069187.db2.gz	GZUKRQBPKZRFIF-JKSUJKDBSA-N	1	1	294.395	2.309	40	0		CEABMO
COC[C@@H]1CCC[C@]12C[N@H+](Cc1ccoc1)CCO2	ZINC000096063536	185084588	/nfs/dbraw/zinc/08/45/88/185084588.db2.gz	HRGGUTPYXWMBLC-GJZGRUSLSA-N	1	1	265.353	2.297	40	0		CEABMO
COC[C@@H]1CCC[C@]12C[N@@H+](Cc1ccoc1)CCO2	ZINC000096063536	185084590	/nfs/dbraw/zinc/08/45/90/185084590.db2.gz	HRGGUTPYXWMBLC-GJZGRUSLSA-N	1	1	265.353	2.297	40	0		CEABMO
CCO[C@@H]1CC[N@@H+](C[C@@H]2CCOC2)[C@@H]1Cc1cccnc1	ZINC000096069931	185085559	/nfs/dbraw/zinc/08/55/59/185085559.db2.gz	BUVGIZXXMFFHGR-GVDBMIGSSA-N	1	1	290.407	2.140	40	0		CEABMO
CCN1C(=O)CC[C@@]12CCC[N@@H+](Cc1ccccn1)C2	ZINC000096071170	185087108	/nfs/dbraw/zinc/08/71/08/185087108.db2.gz	RYTDSRPHSIOJQP-MRXNPFEDSA-N	1	1	273.380	2.059	40	0		CEABMO
C[NH+]1CCN(C(=O)CCc2ncc(-c3ccccc3)o2)CC1	ZINC000041018855	362013430	/nfs/dbraw/zinc/01/34/30/362013430.db2.gz	PCDMJUBQAGVZSS-UHFFFAOYSA-N	1	1	299.374	2.048	40	0		CEABMO
CN(C)c1ccc(-c2nnc([C@H]3CC[N@@H+](C)C3)o2)cc1	ZINC000049170204	362342845	/nfs/dbraw/zinc/34/28/45/362342845.db2.gz	BSTUVQIRZYRSCA-LBPRGKRZSA-N	1	1	272.352	2.222	40	0	biogenic,in-vitro	CEABMO
CCOC(=O)[C@@H]1C[N@@H+](Cc2ccccc2)CC12CC2	ZINC000148842911	344414548	/nfs/dbraw/zinc/41/45/48/344414548.db2.gz	JEZLFPHQDRWQJL-AWEZNQCLSA-N	1	1	259.349	2.462	40	0		CEABMO
CC[NH+](CC)[C@]1([C@@H](CN)CO)C[C@@H]2CC[C@@]1(C)C2(C)C	ZINC000216351179	344534890	/nfs/dbraw/zinc/53/48/90/344534890.db2.gz	MYMMFPISRPMSER-OTRWWLKZSA-N	1	1	282.472	2.480	40	0		CEABMO
c1ccc(C[N@H+]2CCOC3(C[C@H]4CC[C@@H](C3)[NH2+]4)C2)cc1	ZINC000231560827	344575018	/nfs/dbraw/zinc/57/50/18/344575018.db2.gz	AUVBBPRQWVVQSA-SJPCQFCGSA-N	1	1	272.392	2.172	40	0		CEABMO
c1ccc(CN2CCOC3(C[C@H]4CC[C@@H](C3)[NH2+]4)C2)cc1	ZINC000231560827	344575021	/nfs/dbraw/zinc/57/50/21/344575021.db2.gz	AUVBBPRQWVVQSA-SJPCQFCGSA-N	1	1	272.392	2.172	40	0		CEABMO
Cc1ccccc1C[C@]1(CO)C[N@@H+](C(C)C)CCO1	ZINC000585277410	345010078	/nfs/dbraw/zinc/01/00/78/345010078.db2.gz	WEGLDXWHDMQFRQ-MRXNPFEDSA-N	1	1	263.381	2.009	40	0		CEABMO
CCOC(=O)c1c(C)nc(CC)cc1C[NH+](C)C	ZINC000055153012	362545821	/nfs/dbraw/zinc/54/58/21/362545821.db2.gz	YVNHPAOATTVCGV-UHFFFAOYSA-N	1	1	250.342	2.191	40	0		CEABMO
Clc1ccc2c(c1)N[C@H]([C@H]1CCOC1)N1CC[NH+]=C21	ZINC000012188528	282518324	/nfs/dbraw/zinc/51/83/24/282518324.db2.gz	LRZYVJLYMHUBMS-ZANVPECISA-N	1	1	277.755	2.190	40	0		CEABMO
Cc1cccc(Nc2cc(N3CC[NH+](C)CC3)ncn2)c1	ZINC000203894388	538828888	/nfs/dbraw/zinc/82/88/88/538828888.db2.gz	JZSSNFOYYYRUDT-UHFFFAOYSA-N	1	1	283.379	2.280	40	0		CEABMO
CC(C)[N@@H+](CCO)C[C@@H]1CCN(Cc2ccccc2)C1	ZINC000079395090	363595538	/nfs/dbraw/zinc/59/55/38/363595538.db2.gz	YWKRMJPLPIUQDH-QGZVFWFLSA-N	1	1	276.424	2.211	40	0		CEABMO
CC(C)[N@@H+](CCO)C[C@H]1CCCN1Cc1ccccc1	ZINC000079395087	363595693	/nfs/dbraw/zinc/59/56/93/363595693.db2.gz	JZTICFJSVCLETF-QGZVFWFLSA-N	1	1	276.424	2.354	40	0		CEABMO
CC(C)N(CCO)C[C@H]1CCC[N@@H+]1Cc1ccccc1	ZINC000079395087	363595696	/nfs/dbraw/zinc/59/56/96/363595696.db2.gz	JZTICFJSVCLETF-QGZVFWFLSA-N	1	1	276.424	2.354	40	0		CEABMO
CC(C)N(CCO)C[C@H]1CCC[N@H+]1Cc1ccccc1	ZINC000079395087	363595705	/nfs/dbraw/zinc/59/57/05/363595705.db2.gz	JZTICFJSVCLETF-QGZVFWFLSA-N	1	1	276.424	2.354	40	0		CEABMO
CC(C)[N@@H+](Cc1ccccc1)[C@@H]1CCCN(CCO)C1	ZINC000079414283	363596802	/nfs/dbraw/zinc/59/68/02/363596802.db2.gz	WCGALKBOUZMJNF-QGZVFWFLSA-N	1	1	276.424	2.354	40	0		CEABMO
OCCN1CCC([N@@H+](Cc2ccccc2)C2CC2)CC1	ZINC000079414396	363597223	/nfs/dbraw/zinc/59/72/23/363597223.db2.gz	ZMSBQXVUZJBLOH-UHFFFAOYSA-N	1	1	274.408	2.108	40	0		CEABMO
CO[C@H]1CC=C2CC[N@H+]3CCC4=C(CCOC4)[C@@]23C1	ZINC000000401267	361170373	/nfs/dbraw/zinc/17/03/73/361170373.db2.gz	QUJGKXLFHIGUGU-GOEBONIOSA-N	1	1	261.365	2.287	40	0		CEABMO
C[C@@H]1CCCC[N@H+]1CCCNC(=O)c1ccc(N)cc1	ZINC000002042269	361225900	/nfs/dbraw/zinc/22/59/00/361225900.db2.gz	HIIVEEDTMISUOQ-CYBMUJFWSA-N	1	1	275.396	2.263	40	0		CEABMO
Cc1ccsc1C[N@@H+](Cc1cncn1C)C[C@@H](C)O	ZINC000019238600	361523198	/nfs/dbraw/zinc/52/31/98/361523198.db2.gz	CDVNIQYBWRRTCK-GFCCVEGCSA-N	1	1	279.409	2.173	40	0		CEABMO
Cc1ccsc1C[N@H+](Cc1cncn1C)C[C@@H](C)O	ZINC000019238600	361523205	/nfs/dbraw/zinc/52/32/05/361523205.db2.gz	CDVNIQYBWRRTCK-GFCCVEGCSA-N	1	1	279.409	2.173	40	0		CEABMO
C[C@@H]([NH2+]CCN[C@@H](C)c1cccnc1)c1cccnc1	ZINC000023478002	361599248	/nfs/dbraw/zinc/59/92/48/361599248.db2.gz	VJQJDYZVAVUECB-OKILXGFUSA-N	1	1	270.380	2.478	40	0		CEABMO
COC[C@@H]1C[N@H+](Cc2ccsc2)Cc2cn(C)nc21	ZINC000096197963	364409022	/nfs/dbraw/zinc/40/90/22/364409022.db2.gz	YHPYMQYDIXWRMC-ZDUSSCGKSA-N	1	1	277.393	2.227	40	0		CEABMO
COC[C@@H]1C[N@@H+](Cc2ccsc2)Cc2cn(C)nc21	ZINC000096197963	364409025	/nfs/dbraw/zinc/40/90/25/364409025.db2.gz	YHPYMQYDIXWRMC-ZDUSSCGKSA-N	1	1	277.393	2.227	40	0		CEABMO
COC[C@H]1C[N@H+](Cc2ccsc2)Cc2cn(C)nc21	ZINC000096197964	364408739	/nfs/dbraw/zinc/40/87/39/364408739.db2.gz	YHPYMQYDIXWRMC-CYBMUJFWSA-N	1	1	277.393	2.227	40	0		CEABMO
COC[C@H]1C[N@@H+](Cc2ccsc2)Cc2cn(C)nc21	ZINC000096197964	364408743	/nfs/dbraw/zinc/40/87/43/364408743.db2.gz	YHPYMQYDIXWRMC-CYBMUJFWSA-N	1	1	277.393	2.227	40	0		CEABMO
CCn1nnc2c1CC[N@H+](CC1CCCC1)[C@@H]2COC	ZINC000096198484	364409476	/nfs/dbraw/zinc/40/94/76/364409476.db2.gz	JZIDOMJNZXALJI-CQSZACIVSA-N	1	1	278.400	2.034	40	0		CEABMO
CCn1nnc2c1CC[N@@H+](CC1CCCC1)[C@@H]2COC	ZINC000096198484	364409483	/nfs/dbraw/zinc/40/94/83/364409483.db2.gz	JZIDOMJNZXALJI-CQSZACIVSA-N	1	1	278.400	2.034	40	0		CEABMO
CCOc1ncnc2c1CC[N@@H+](Cc1ccoc1)CC2	ZINC000096255597	364418236	/nfs/dbraw/zinc/41/82/36/364418236.db2.gz	SXEDQFOFYXJKFA-UHFFFAOYSA-N	1	1	273.336	2.069	40	0		CEABMO
CC(C)Nc1ncnc2c1CC[N@@H+](Cc1ccoc1)CC2	ZINC000096255509	364418496	/nfs/dbraw/zinc/41/84/96/364418496.db2.gz	XRHFFPPVIMYZQI-UHFFFAOYSA-N	1	1	286.379	2.491	40	0		CEABMO
C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@]1(N)C(F)(F)F	ZINC000199548581	370148863	/nfs/dbraw/zinc/14/88/63/370148863.db2.gz	NWNOBEWRLOTQFH-ZYHUDNBSSA-N	1	1	258.287	2.398	40	0		CEABMO
COc1ccc(N2C[C@@H]([NH2+]Cc3ccccc3)C2=O)cc1	ZINC000217461622	370197281	/nfs/dbraw/zinc/19/72/81/370197281.db2.gz	WUTPKJFPHFADNH-MRXNPFEDSA-N	1	1	282.343	2.200	40	0		CEABMO
[NH3+]CCSc1nc(-c2ccccc2Br)n[nH]1	ZINC000224979134	370284197	/nfs/dbraw/zinc/28/41/97/370284197.db2.gz	PJMNANNHMQOLPO-UHFFFAOYSA-N	1	1	299.197	2.285	40	0		CEABMO
CC[N@H+]1CC[C@]2(c3ccccc3)CCN(C(C)=O)C[C@@H]12	ZINC000247898979	371145021	/nfs/dbraw/zinc/14/50/21/371145021.db2.gz	ADFKGDUQBPZDFV-IAGOWNOFSA-N	1	1	272.392	2.271	40	0		CEABMO
Cc1cc(CC[C@H]2CN(c3cccc(C)[nH+]3)CCO2)ncn1	ZINC000257270310	371611104	/nfs/dbraw/zinc/61/11/04/371611104.db2.gz	MTQPQGKISSLDNT-INIZCTEOSA-N	1	1	298.390	2.326	40	0		CEABMO
CC(C)n1nccc1C[NH2+]Cc1ccnn1C(F)F	ZINC000256054550	190005748	/nfs/dbraw/zinc/00/57/48/190005748.db2.gz	WTODOGUQJAWLNX-UHFFFAOYSA-N	1	1	269.299	2.345	40	0		CEABMO
Cc1c[nH]c([C@@H]2CC[N@H+](Cc3csc(C)n3)C2)n1	ZINC000257203937	190011477	/nfs/dbraw/zinc/01/14/77/190011477.db2.gz	ASGXJLRMKXTGCQ-LLVKDONJSA-N	1	1	262.382	2.473	40	0		CEABMO
C[N@@H+]1CCC[C@@H]1c1cncc(C(=O)NCc2ccccc2)n1	ZINC000257214705	190012969	/nfs/dbraw/zinc/01/29/69/190012969.db2.gz	CNDMQVKIUOJLQT-MRXNPFEDSA-N	1	1	296.374	2.173	40	0		CEABMO
C[N@H+]1CCC[C@@H]1c1cncc(C(=O)NCc2ccccc2)n1	ZINC000257214705	190012970	/nfs/dbraw/zinc/01/29/70/190012970.db2.gz	CNDMQVKIUOJLQT-MRXNPFEDSA-N	1	1	296.374	2.173	40	0		CEABMO
CC(=O)N1CC[N@H+](Cc2ccncc2)C[C@@H]1c1ccccc1	ZINC000257227165	190015496	/nfs/dbraw/zinc/01/54/96/190015496.db2.gz	FNZHBKAEZSHPNT-GOSISDBHSA-N	1	1	295.386	2.487	40	0		CEABMO
CC(=O)N1CC[N@@H+](Cc2ccncc2)C[C@@H]1c1ccccc1	ZINC000257227165	190015497	/nfs/dbraw/zinc/01/54/97/190015497.db2.gz	FNZHBKAEZSHPNT-GOSISDBHSA-N	1	1	295.386	2.487	40	0		CEABMO
Cc1nccn1C[C@@H]1CCC[N@@H+](Cc2ccncc2)C1	ZINC000257243797	190018541	/nfs/dbraw/zinc/01/85/41/190018541.db2.gz	IIOPGNQRTGIAJS-MRXNPFEDSA-N	1	1	270.380	2.499	40	0		CEABMO
Cn1cccc1C[N@H+]1CCC[C@@H](Cc2cc[nH]n2)C1	ZINC000257250980	190020104	/nfs/dbraw/zinc/02/01/04/190020104.db2.gz	JOVDRASFPWWZDJ-ZDUSSCGKSA-N	1	1	258.369	2.203	40	0		CEABMO
Cn1cccc1C[N@@H+]1CCC[C@@H](Cc2ccn[nH]2)C1	ZINC000257250980	190020105	/nfs/dbraw/zinc/02/01/05/190020105.db2.gz	JOVDRASFPWWZDJ-ZDUSSCGKSA-N	1	1	258.369	2.203	40	0		CEABMO
Cn1cccc1C[N@H+]1CCC[C@@H](Cc2ccn[nH]2)C1	ZINC000257250980	190020106	/nfs/dbraw/zinc/02/01/06/190020106.db2.gz	JOVDRASFPWWZDJ-ZDUSSCGKSA-N	1	1	258.369	2.203	40	0		CEABMO
c1cn2c(n1)nccc2[C@H]1CC[N@H+](Cc2cccnc2)C1	ZINC000257276848	190025608	/nfs/dbraw/zinc/02/56/08/190025608.db2.gz	NVJLWZFDALSBOM-AWEZNQCLSA-N	1	1	279.347	2.114	40	0		CEABMO
COc1cccc(OC)c1C[N@H+]1CC[C@H](c2cc[nH]n2)C1	ZINC000257283653	190026367	/nfs/dbraw/zinc/02/63/67/190026367.db2.gz	OZFPERYVYYLLSH-LBPRGKRZSA-N	1	1	287.363	2.416	40	0		CEABMO
Cc1cn(C)c([C@H]2CC[N@@H+](Cc3csc(C)n3)C2)n1	ZINC000257297134	190029920	/nfs/dbraw/zinc/02/99/20/190029920.db2.gz	RGAJMTQBBKDDOS-LBPRGKRZSA-N	1	1	276.409	2.483	40	0		CEABMO
Cn1cccc1C(=O)N1CC[N@H+](C)[C@H](c2ccccc2)C1	ZINC000257302433	190030721	/nfs/dbraw/zinc/03/07/21/190030721.db2.gz	SCXVQJCWXUHENV-INIZCTEOSA-N	1	1	283.375	2.154	40	0		CEABMO
Cn1cccc1C(=O)N1CC[N@@H+](C)[C@H](c2ccccc2)C1	ZINC000257302433	190030722	/nfs/dbraw/zinc/03/07/22/190030722.db2.gz	SCXVQJCWXUHENV-INIZCTEOSA-N	1	1	283.375	2.154	40	0		CEABMO
CN(C)c1cc([C@H]2CCC[N@@H+](Cc3cnn(C)c3)C2)ccn1	ZINC000257314576	190032881	/nfs/dbraw/zinc/03/28/81/190032881.db2.gz	UXOOSTUIZGVYKV-INIZCTEOSA-N	1	1	299.422	2.261	40	0		CEABMO
C[NH+](C)Cc1cn(-c2ccccc2C(=O)N2CCCC2)cn1	ZINC000257340276	190036975	/nfs/dbraw/zinc/03/69/75/190036975.db2.gz	ZFHSXCXWAIMTIK-UHFFFAOYSA-N	1	1	298.390	2.170	40	0		CEABMO
COC(=O)[C@@H]1C[C@@H]2CC(=O)C[C@H](C1)[N@@H+]2Cc1ccccc1	ZINC000265540975	190188981	/nfs/dbraw/zinc/18/89/81/190188981.db2.gz	YQUMDJWPDFMASF-QKDCVEJESA-N	1	1	287.359	2.172	40	0		CEABMO
CCOC(=O)[C@@H]([NH3+])[C@@H](Nc1ccc(OC)cc1)C(C)C	ZINC000072210546	394592213	/nfs/dbraw/zinc/59/22/13/394592213.db2.gz	NYBCONNMWWWMLE-KBPBESRZSA-N	1	1	280.368	2.022	40	0		CEABMO
[NH3+][C@H]1C(=O)N(c2ccc(F)cc2)[C@H]1c1ccccc1F	ZINC000072227245	394595340	/nfs/dbraw/zinc/59/53/40/394595340.db2.gz	ISINHULIJDRCSJ-KGLIPLIRSA-N	1	1	274.270	2.380	40	0		CEABMO
Cc1ccc([C@@H]2[C@@H]([NH3+])C(=O)N2Cc2ccccc2)cc1	ZINC000072228120	394596066	/nfs/dbraw/zinc/59/60/66/394596066.db2.gz	SZTPIZQQBNMZEM-HZPDHXFCSA-N	1	1	266.344	2.406	40	0		CEABMO
[NH3+][C@H]1C(=O)N(c2cccc(F)c2)[C@H]1c1ccccc1	ZINC000072227609	394596309	/nfs/dbraw/zinc/59/63/09/394596309.db2.gz	QPRORUXQTBIEBL-KGLIPLIRSA-N	1	1	256.280	2.241	40	0		CEABMO
COc1cccc([C@H]2[C@@H]([NH3+])C(=O)N2c2cccc(C)c2)c1	ZINC000072227417	394596610	/nfs/dbraw/zinc/59/66/10/394596610.db2.gz	FBMKIGLWJDKQQE-CVEARBPZSA-N	1	1	282.343	2.419	40	0		CEABMO
CC[C@@H]1CO[C@@]2(C1)CCCN(CCC[NH+](C)C)C2	ZINC000096089831	394677094	/nfs/dbraw/zinc/67/70/94/394677094.db2.gz	YVLONVXWSIRREV-LSDHHAIUSA-N	1	1	254.418	2.219	40	0		CEABMO
CC[N@H+](Cc1ccccc1)[C@]1(C)CCS(=O)(=O)C1	ZINC000575420399	400608819	/nfs/dbraw/zinc/60/88/19/400608819.db2.gz	HICZPZJOXAUQSL-CQSZACIVSA-N	1	1	267.394	2.086	40	0		CEABMO
CC[N@@H+](Cc1ccccc1)[C@]1(C)CCS(=O)(=O)C1	ZINC000575420399	400608821	/nfs/dbraw/zinc/60/88/21/400608821.db2.gz	HICZPZJOXAUQSL-CQSZACIVSA-N	1	1	267.394	2.086	40	0		CEABMO
CNC(=S)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2Cc1ccco1	ZINC000008663975	170344885	/nfs/dbraw/zinc/34/48/85/170344885.db2.gz	WIXWFUFLGBEEFY-YHWZYXNKSA-N	1	1	293.436	2.259	40	0		CEABMO
COC(=O)[C@H]([NH3+])Cc1ccc(-c2ccccc2)cc1	ZINC000021983966	171344638	/nfs/dbraw/zinc/34/46/38/171344638.db2.gz	ZABGKWGFGXZMDE-OAHLLOKOSA-N	1	1	255.317	2.396	40	0		CEABMO
COCCCNC(=O)[C@H]1CCC[N@@H+](Cc2ccccc2)C1	ZINC000038833025	174157449	/nfs/dbraw/zinc/15/74/49/174157449.db2.gz	NQTXEIMQRBVCKY-INIZCTEOSA-N	1	1	290.407	2.051	40	0		CEABMO
CN1CC[NH2+][C@H](Cc2ccc(-c3ccccc3)cc2)C1=O	ZINC000072352831	176374056	/nfs/dbraw/zinc/37/40/56/176374056.db2.gz	GCHXDZDUUJNPHF-QGZVFWFLSA-N	1	1	280.371	2.326	40	0		CEABMO
CCN1CC[NH2+][C@H](Cc2ccc(-c3ccncc3)cc2)C1=O	ZINC000072352883	176374245	/nfs/dbraw/zinc/37/42/45/176374245.db2.gz	JYASSLXGEUNJDX-QGZVFWFLSA-N	1	1	295.386	2.111	40	0		CEABMO
Cc1nc2c(c(=O)[nH]1)CC[N@H+](Cc1c[nH]c3ccccc13)C2	ZINC000072373671	176384966	/nfs/dbraw/zinc/38/49/66/176384966.db2.gz	DNFRHIUVGVKLMM-UHFFFAOYSA-N	1	1	294.358	2.118	40	0		CEABMO
Cc1nc2c(c(=O)[nH]1)CC[N@@H+](Cc1c[nH]c3ccccc13)C2	ZINC000072373671	176384968	/nfs/dbraw/zinc/38/49/68/176384968.db2.gz	DNFRHIUVGVKLMM-UHFFFAOYSA-N	1	1	294.358	2.118	40	0		CEABMO
CNc1cncc([C@H]2CCC[N@@H+]2Cc2cccnc2)n1	ZINC000072385045	176389265	/nfs/dbraw/zinc/38/92/65/176389265.db2.gz	AANNDHNANGPMJB-CQSZACIVSA-N	1	1	269.352	2.250	40	0		CEABMO
CNc1cncc([C@H]2CCC[N@H+]2Cc2cccnc2)n1	ZINC000072385045	176389267	/nfs/dbraw/zinc/38/92/67/176389267.db2.gz	AANNDHNANGPMJB-CQSZACIVSA-N	1	1	269.352	2.250	40	0		CEABMO
c1cc([C@@H]2CC[N@H+](CCOc3ccccc3)C2)n[nH]1	ZINC000072385397	176389711	/nfs/dbraw/zinc/38/97/11/176389711.db2.gz	YCTYCXMVGCFEHI-CYBMUJFWSA-N	1	1	257.337	2.278	40	0		CEABMO
CO[C@H]1COCC[N@@H+](Cc2cnc3ccccc3c2)C1	ZINC000077265950	177246596	/nfs/dbraw/zinc/24/65/96/177246596.db2.gz	KNWQDVOAMDXMFQ-OAHLLOKOSA-N	1	1	272.348	2.082	40	0	biogenic,in-vitro	CEABMO
C[N@H+]1CCC[C@H](C(=O)NCCSCc2ccccc2)C1	ZINC000078578503	177356277	/nfs/dbraw/zinc/35/62/77/177356277.db2.gz	GWMBJIYUXPRHEP-HNNXBMFYSA-N	1	1	292.448	2.378	40	0		CEABMO
Cc1c[nH]nc1[C@H]1CCC[N@@H+](CC2CCOCC2)C1	ZINC000072386142	280284548	/nfs/dbraw/zinc/28/45/48/280284548.db2.gz	RIXJCOOMEXOIGL-AWEZNQCLSA-N	1	1	263.385	2.324	40	0		CEABMO
CC[N@H+]1CCC[C@H]1CNc1cc(Cl)nc(C)n1	ZINC000052835979	521659032	/nfs/dbraw/zinc/65/90/32/521659032.db2.gz	OLQNRDUNSFETGB-JTQLQIEISA-N	1	1	254.765	2.335	40	0		CEABMO
COC(=O)COc1cc(C)[nH+]c2cc(OC)c(OC)cc21	ZINC000062718746	523218707	/nfs/dbraw/zinc/21/87/07/523218707.db2.gz	OGIJDNFXFWAIPZ-UHFFFAOYSA-N	1	1	291.303	2.112	40	0		CEABMO
Cc1ccc([C@@H]([NH3+])c2nc(-c3cccnc3)n[nH]2)cc1	ZINC000095534103	185005656	/nfs/dbraw/zinc/00/56/56/185005656.db2.gz	XNFWIWWBAIPCBB-CYBMUJFWSA-N	1	1	265.320	2.223	40	0		CEABMO
COc1cccc([C@H]([NH3+])c2nnc(CC(C)C)[nH]2)c1	ZINC000095533607	185006770	/nfs/dbraw/zinc/00/67/70/185006770.db2.gz	STBODSMQBMTFRE-ZDUSSCGKSA-N	1	1	260.341	2.060	40	0		CEABMO
[NH3+][C@H](c1nc(-c2ccccc2O)n[nH]1)c1ccc(F)cc1	ZINC000095533247	185007136	/nfs/dbraw/zinc/00/71/36/185007136.db2.gz	HRTRHZFMSJDIOJ-ZDUSSCGKSA-N	1	1	284.294	2.365	40	0		CEABMO
COc1ccc([C@@H]([NH3+])c2nc(-c3ccco3)n[nH]2)cc1	ZINC000095533647	185007172	/nfs/dbraw/zinc/00/71/72/185007172.db2.gz	MYVURWKMKWIVJZ-GFCCVEGCSA-N	1	1	270.292	2.121	40	0		CEABMO
Cc1ccc(C[N@H+]2C[C@@H]3C[C@@H](c4nc(C)no4)O[C@@H]3C2)o1	ZINC000096045791	185071295	/nfs/dbraw/zinc/07/12/95/185071295.db2.gz	HBGBKBFAWGALCL-FPMFFAJLSA-N	1	1	289.335	2.241	40	0		CEABMO
C[C@H]1C[C@H]2C[N@@H+](Cc3ccc4c(c3)OCO4)CC[C@@H]2O1	ZINC000096045895	185071770	/nfs/dbraw/zinc/07/17/70/185071770.db2.gz	MNAWBLXHYPBYCP-UBHSHLNASA-N	1	1	275.348	2.415	40	0		CEABMO
O=C(c1cccnc1)N1CCC2(C[NH+](Cc3ccco3)C2)C1	ZINC000096046454	185071912	/nfs/dbraw/zinc/07/19/12/185071912.db2.gz	RAQGARWCXNNIFS-UHFFFAOYSA-N	1	1	297.358	2.023	40	0		CEABMO
CC[N@H+]1CCOC[C@@]2(CCCN(Cc3ccccn3)C2)C1	ZINC000096049598	185073039	/nfs/dbraw/zinc/07/30/39/185073039.db2.gz	WVUBZOQEFIPAAZ-KRWDZBQOSA-N	1	1	289.423	2.016	40	0		CEABMO
c1cn([C@@H]2CO[C@]3(C2)CCC[N@H+](Cc2cccnc2)C3)cn1	ZINC000096048564	185073184	/nfs/dbraw/zinc/07/31/84/185073184.db2.gz	SVZHDVPNTPYDSM-IRXDYDNUSA-N	1	1	298.390	2.274	40	0		CEABMO
c1cn([C@@H]2CO[C@@]3(C2)CCC[N@H+](Cc2ccncc2)C3)cn1	ZINC000096048567	185073395	/nfs/dbraw/zinc/07/33/95/185073395.db2.gz	QDQCLGDBADXANC-DLBZAZTESA-N	1	1	298.390	2.274	40	0		CEABMO
c1cn([C@@H]2CO[C@]3(C2)CCC[N@H+](Cc2ccncc2)C3)cn1	ZINC000096048566	185073582	/nfs/dbraw/zinc/07/35/82/185073582.db2.gz	QDQCLGDBADXANC-IRXDYDNUSA-N	1	1	298.390	2.274	40	0		CEABMO
CCN1C(=O)CC[C@@]12CCC[N@@H+](Cc1cccnc1)CC2	ZINC000096047506	185073666	/nfs/dbraw/zinc/07/36/66/185073666.db2.gz	GHGNXBRVRWHBFS-QGZVFWFLSA-N	1	1	287.407	2.449	40	0		CEABMO
CCOC[C@@H]1CCC[C@@]12C[N@H+](Cc1cccnc1)CCO2	ZINC000096051875	185074127	/nfs/dbraw/zinc/07/41/27/185074127.db2.gz	FSRHXKFRZXAIDB-DLBZAZTESA-N	1	1	290.407	2.489	40	0		CEABMO
CCOC[C@@H]1CCC[C@@]12C[N@@H+](Cc1cccnc1)CCO2	ZINC000096051875	185074128	/nfs/dbraw/zinc/07/41/28/185074128.db2.gz	FSRHXKFRZXAIDB-DLBZAZTESA-N	1	1	290.407	2.489	40	0		CEABMO
CC[C@@H]1[N@@H+](Cc2ccncc2)CCC[C@]12CCC(=O)N2	ZINC000096052399	185074141	/nfs/dbraw/zinc/07/41/41/185074141.db2.gz	AGWUGOMDSNSGNR-HOCLYGCPSA-N	1	1	273.380	2.105	40	0		CEABMO
CCOC[C@]12CCCO[C@H]1CC[N@@H+](Cc1ccccn1)C2	ZINC000096056806	185077416	/nfs/dbraw/zinc/07/74/16/185077416.db2.gz	BSKDQECSJKCUNS-DLBZAZTESA-N	1	1	290.407	2.489	40	0		CEABMO
Cc1noc([C@@H]2C[C@@H]3CC[N@H+](Cc4ccco4)C[C@H]3O2)n1	ZINC000096058235	185078957	/nfs/dbraw/zinc/07/89/57/185078957.db2.gz	QWBUZOKLIYBDPZ-FPMFFAJLSA-N	1	1	289.335	2.323	40	0		CEABMO
Cc1noc([C@@H]2C[C@@H]3CC[N@@H+](Cc4ccco4)C[C@H]3O2)n1	ZINC000096058235	185078959	/nfs/dbraw/zinc/07/89/59/185078959.db2.gz	QWBUZOKLIYBDPZ-FPMFFAJLSA-N	1	1	289.335	2.323	40	0		CEABMO
CCN1C(=O)CC[C@]12CCC[N@H+](Cc1nccs1)C2	ZINC000096071175	185086926	/nfs/dbraw/zinc/08/69/26/185086926.db2.gz	WMRWRGBFOPDSRM-AWEZNQCLSA-N	1	1	279.409	2.120	40	0		CEABMO
CCN1C(=O)CC[C@]12CCC[N@@H+](Cc1nccs1)C2	ZINC000096071175	185086927	/nfs/dbraw/zinc/08/69/27/185086927.db2.gz	WMRWRGBFOPDSRM-AWEZNQCLSA-N	1	1	279.409	2.120	40	0		CEABMO
Cc1nc(COCc2cnc3n2CC[NH2+][C@@H]3C)cs1	ZINC000096109864	185099514	/nfs/dbraw/zinc/09/95/14/185099514.db2.gz	WAWVWFIXEOFDTO-SECBINFHSA-N	1	1	278.381	2.029	40	0		CEABMO
CO[C@H]1CO[C@]2(C1)CCC[N@@H+](Cc1ccc(C)o1)C2	ZINC000096107179	185099766	/nfs/dbraw/zinc/09/97/66/185099766.db2.gz	KCHYSWAQCJBRHZ-CABCVRRESA-N	1	1	265.353	2.358	40	0		CEABMO
Cn1cncc1-c1nnc([C@H]2CC[N@@H+](CC(C)(C)C)C2)o1	ZINC000049170479	362343881	/nfs/dbraw/zinc/34/38/81/362343881.db2.gz	AZGPACKWUCTJQK-NSHDSACASA-N	1	1	289.383	2.306	40	0	biogenic,in-vitro	CEABMO
OC[C@H]1CC[N@@H+](Cc2cccc(Br)c2)C1	ZINC000051887054	362444842	/nfs/dbraw/zinc/44/48/42/362444842.db2.gz	JOKZZLUKCYXRJI-NSHDSACASA-N	1	1	270.170	2.263	40	0		CEABMO
CCn1cc(C[N@H+]2CC[C@H](c3nc(C)c[nH]3)C2)c(C)n1	ZINC000585181413	345009136	/nfs/dbraw/zinc/00/91/36/345009136.db2.gz	ISCUSGFWRFSICN-ZDUSSCGKSA-N	1	1	273.384	2.232	40	0		CEABMO
CNC(=O)c1cnc([C@H]2CCC[N@@H+]2CC(C)C)s1	ZINC000585182452	345009253	/nfs/dbraw/zinc/00/92/53/345009253.db2.gz	WQNKHJITMXOZSZ-SNVBAGLBSA-N	1	1	267.398	2.296	40	0		CEABMO
CNC(=O)c1cnc([C@H]2CCC[N@H+]2CC(C)C)s1	ZINC000585182452	345009255	/nfs/dbraw/zinc/00/92/55/345009255.db2.gz	WQNKHJITMXOZSZ-SNVBAGLBSA-N	1	1	267.398	2.296	40	0		CEABMO
O=C1CCCC[C@@H]2[C@H](CC[N@@H+]2CC2(O)CCCCCC2)N1	ZINC000585285561	345009694	/nfs/dbraw/zinc/00/96/94/345009694.db2.gz	ZXQWZUHWIBPRPS-LSDHHAIUSA-N	1	1	294.439	2.205	40	0		CEABMO
CO[C@H]1C[N@H+](Cc2cnc[nH]2)CC[C@@H]1Cc1ccccc1	ZINC000585277624	345009901	/nfs/dbraw/zinc/00/99/01/345009901.db2.gz	JOBZZAVKCRDLNN-WBVHZDCISA-N	1	1	285.391	2.489	40	0		CEABMO
CO[C@H]1C[N@@H+](Cc2cnc[nH]2)CC[C@@H]1Cc1ccccc1	ZINC000585277624	345009902	/nfs/dbraw/zinc/00/99/02/345009902.db2.gz	JOBZZAVKCRDLNN-WBVHZDCISA-N	1	1	285.391	2.489	40	0		CEABMO
CO[C@H]1C[N@H+](Cc2c[nH]cn2)CC[C@@H]1Cc1ccccc1	ZINC000585277624	345009904	/nfs/dbraw/zinc/00/99/04/345009904.db2.gz	JOBZZAVKCRDLNN-WBVHZDCISA-N	1	1	285.391	2.489	40	0		CEABMO
CO[C@H]1C[N@@H+](Cc2c[nH]cn2)CC[C@@H]1Cc1ccccc1	ZINC000585277624	345009905	/nfs/dbraw/zinc/00/99/05/345009905.db2.gz	JOBZZAVKCRDLNN-WBVHZDCISA-N	1	1	285.391	2.489	40	0		CEABMO
c1cn([C@H]2CO[C@@]3(C2)CCC[N@H+](Cc2ccccn2)C3)cn1	ZINC000107731397	186189523	/nfs/dbraw/zinc/18/95/23/186189523.db2.gz	DCZVGCNCDNMRRP-IAGOWNOFSA-N	1	1	298.390	2.274	40	0		CEABMO
c1cn([C@H]2CO[C@]3(C2)CCC[N@H+](Cc2ccoc2)C3)cn1	ZINC000107731341	186189605	/nfs/dbraw/zinc/18/96/05/186189605.db2.gz	RHHJWYHNAPOFFG-CVEARBPZSA-N	1	1	287.363	2.472	40	0		CEABMO
CC[N@H+](Cc1ccccc1)C[C@H]1CCCCN1CCO	ZINC000079414220	363597069	/nfs/dbraw/zinc/59/70/69/363597069.db2.gz	KVNDXFIABUZSGL-QGZVFWFLSA-N	1	1	276.424	2.355	40	0		CEABMO
CCN(Cc1ccccc1)C[C@H]1CCCC[N@@H+]1CCO	ZINC000079414220	363597075	/nfs/dbraw/zinc/59/70/75/363597075.db2.gz	KVNDXFIABUZSGL-QGZVFWFLSA-N	1	1	276.424	2.355	40	0		CEABMO
CCN(Cc1ccccc1)C[C@H]1CCCC[N@H+]1CCO	ZINC000079414220	363597078	/nfs/dbraw/zinc/59/70/78/363597078.db2.gz	KVNDXFIABUZSGL-QGZVFWFLSA-N	1	1	276.424	2.355	40	0		CEABMO
CC(C)[N@@H+](CCO)Cc1ccnc(Br)c1	ZINC000079421551	363598329	/nfs/dbraw/zinc/59/83/29/363598329.db2.gz	XCAIBBFRQINZBZ-UHFFFAOYSA-N	1	1	273.174	2.047	40	0		CEABMO
CC[N@H+]1CCC[C@@H]1CNCc1cc2ccccc2[nH]c1=O	ZINC000023247895	361596379	/nfs/dbraw/zinc/59/63/79/361596379.db2.gz	DRSRDWJTYXPTQW-OAHLLOKOSA-N	1	1	285.391	2.102	40	0		CEABMO
CCN1CCC[C@@H]1C[NH2+]Cc1cc2ccccc2[nH]c1=O	ZINC000023247895	361596385	/nfs/dbraw/zinc/59/63/85/361596385.db2.gz	DRSRDWJTYXPTQW-OAHLLOKOSA-N	1	1	285.391	2.102	40	0		CEABMO
COC[C@@H]1C[N@H+](Cc2ccc(F)cc2)Cc2cn(C)nc21	ZINC000096197965	364409015	/nfs/dbraw/zinc/40/90/15/364409015.db2.gz	ALGKKWJOBPKJQW-AWEZNQCLSA-N	1	1	289.354	2.305	40	0		CEABMO
COC[C@@H]1C[N@@H+](Cc2ccc(F)cc2)Cc2cn(C)nc21	ZINC000096197965	364409017	/nfs/dbraw/zinc/40/90/17/364409017.db2.gz	ALGKKWJOBPKJQW-AWEZNQCLSA-N	1	1	289.354	2.305	40	0		CEABMO
COC[C@H]1C[N@H+](Cc2cccs2)Cc2cn(C)nc21	ZINC000096197962	364409045	/nfs/dbraw/zinc/40/90/45/364409045.db2.gz	FTYOOUNQYDQSDG-GFCCVEGCSA-N	1	1	277.393	2.227	40	0		CEABMO
COC[C@H]1C[N@@H+](Cc2cccs2)Cc2cn(C)nc21	ZINC000096197962	364409047	/nfs/dbraw/zinc/40/90/47/364409047.db2.gz	FTYOOUNQYDQSDG-GFCCVEGCSA-N	1	1	277.393	2.227	40	0		CEABMO
COC[C@H]1C[N@H+](Cc2ccc(F)cc2)Cc2cn(C)nc21	ZINC000096197966	364409217	/nfs/dbraw/zinc/40/92/17/364409217.db2.gz	ALGKKWJOBPKJQW-CQSZACIVSA-N	1	1	289.354	2.305	40	0		CEABMO
COC[C@H]1C[N@@H+](Cc2ccc(F)cc2)Cc2cn(C)nc21	ZINC000096197966	364409222	/nfs/dbraw/zinc/40/92/22/364409222.db2.gz	ALGKKWJOBPKJQW-CQSZACIVSA-N	1	1	289.354	2.305	40	0		CEABMO
CC[N@H+]1CC[C@]2(C1)COCc1cnc(-c3cccnc3)nc12	ZINC000096244283	364415742	/nfs/dbraw/zinc/41/57/42/364415742.db2.gz	DUUDUSBRGORMPC-KRWDZBQOSA-N	1	1	296.374	2.032	40	0		CEABMO
O=C1C[C@@]2(CC[N@@H+](Cc3ccco3)C2)CN1c1ccccn1	ZINC000096239154	364416204	/nfs/dbraw/zinc/41/62/04/364416204.db2.gz	OWOXVTQZNHAIBM-QGZVFWFLSA-N	1	1	297.358	2.304	40	0		CEABMO
C[NH+](C)Cc1[nH]nc2c1CCN(Cc1cccs1)C2	ZINC000096255834	364418442	/nfs/dbraw/zinc/41/84/42/364418442.db2.gz	CODFBZBQPJOYBH-UHFFFAOYSA-N	1	1	276.409	2.091	40	0		CEABMO
C[N@H+]1CCc2c(c(COc3ccccn3)nn2CC2CC2)C1	ZINC000096259833	364418591	/nfs/dbraw/zinc/41/85/91/364418591.db2.gz	WAQCRUKMJZMDGK-UHFFFAOYSA-N	1	1	298.390	2.255	40	0		CEABMO
CCC[N@H+]1CC[C@@]2(C[C@H]2C(=O)N(C)Cc2ccccn2)C1	ZINC000248115898	371162061	/nfs/dbraw/zinc/16/20/61/371162061.db2.gz	LKCKXOLVHVLMBV-DOTOQJQBSA-N	1	1	287.407	2.162	40	0		CEABMO
CC[C@@H](C)[N@H+]1CC[C@@]2(CCN(Cc3ccccn3)C2=O)C1	ZINC000248209655	371169749	/nfs/dbraw/zinc/16/97/49/371169749.db2.gz	CMLSGLZDEUOFTP-PBHICJAKSA-N	1	1	287.407	2.305	40	0		CEABMO
CNc1cccc([C@H]2CN(c3cccc(C)[nH+]3)CCO2)n1	ZINC000257285038	371609748	/nfs/dbraw/zinc/60/97/48/371609748.db2.gz	PFIKZDFEZSXJIZ-CQSZACIVSA-N	1	1	284.363	2.405	40	0		CEABMO
CC(C)c1cc(C[NH2+]Cc2cnn(CC(F)F)c2)n(C)n1	ZINC000256050936	190003519	/nfs/dbraw/zinc/00/35/19/190003519.db2.gz	HBLWFFMUCKJILO-UHFFFAOYSA-N	1	1	297.353	2.295	40	0		CEABMO
CCc1nnc(Nc2cc(C)nc([C@@H]3CC[NH2+]C3)n2)s1	ZINC000257252836	190020848	/nfs/dbraw/zinc/02/08/48/190020848.db2.gz	JWGZZWMUUBZGME-SECBINFHSA-N	1	1	290.396	2.019	40	0		CEABMO
Cc1cc(-c2cncc(C[C@@H]3CCC[N@H+](C)C3)n2)n[nH]1	ZINC000257266958	190022891	/nfs/dbraw/zinc/02/28/91/190022891.db2.gz	MFIKSQKIAQBZGH-LBPRGKRZSA-N	1	1	271.368	2.059	40	0		CEABMO
c1ncc(C[N@@H+]2CCC[C@H](Cc3cccnc3)C2)[nH]1	ZINC000257264899	190022925	/nfs/dbraw/zinc/02/29/25/190022925.db2.gz	LWKZPFDMFMDUJR-CQSZACIVSA-N	1	1	256.353	2.259	40	0		CEABMO
c1nc(C[N@H+]2CCC[C@H](Cc3cccnc3)C2)c[nH]1	ZINC000257264899	190022926	/nfs/dbraw/zinc/02/29/26/190022926.db2.gz	LWKZPFDMFMDUJR-CQSZACIVSA-N	1	1	256.353	2.259	40	0		CEABMO
c1nc(C[N@@H+]2CCC[C@H](Cc3cccnc3)C2)c[nH]1	ZINC000257264899	190022927	/nfs/dbraw/zinc/02/29/27/190022927.db2.gz	LWKZPFDMFMDUJR-CQSZACIVSA-N	1	1	256.353	2.259	40	0		CEABMO
Cc1nc[nH]c1C[N@H+]1CCC[C@H](c2ccnc(C)n2)C1	ZINC000257288206	190026821	/nfs/dbraw/zinc/02/68/21/190026821.db2.gz	PTIDKTKHYIFMEA-ZDUSSCGKSA-N	1	1	271.368	2.196	40	0		CEABMO
Cc1cc(C[N@@H+]2CCC[C@@H](Cc3n[nH]cc3C)C2)no1	ZINC000257276362	190024947	/nfs/dbraw/zinc/02/49/47/190024947.db2.gz	NTJJBYMYERHTOR-ZDUSSCGKSA-N	1	1	274.368	2.469	40	0		CEABMO
Cc1cc(C[N@H+]2CCC[C@@H](Cc3n[nH]cc3C)C2)no1	ZINC000257276362	190024948	/nfs/dbraw/zinc/02/49/48/190024948.db2.gz	NTJJBYMYERHTOR-ZDUSSCGKSA-N	1	1	274.368	2.469	40	0		CEABMO
Cc1cnccc1C[N@@H+]1CC[C@@H]2[C@@H](C1)CCCC(=O)N2C	ZINC000257315514	190032517	/nfs/dbraw/zinc/03/25/17/190032517.db2.gz	VBTFNZBAGDUZJZ-HZPDHXFCSA-N	1	1	287.407	2.223	40	0		CEABMO
c1csc(C[NH+]2CCC(c3cnccn3)CC2)n1	ZINC000257339802	190037314	/nfs/dbraw/zinc/03/73/14/190037314.db2.gz	ZDGSBURDPSSACC-UHFFFAOYSA-N	1	1	260.366	2.313	40	0		CEABMO
C[N@H+]1CC[C@@]2(c3ccccc3)CCN(C(=O)NC3CC3)C[C@@H]12	ZINC000306140031	376541415	/nfs/dbraw/zinc/54/14/15/376541415.db2.gz	UHTREDXJIPCEJL-AEFFLSMTSA-N	1	1	299.418	2.206	40	0		CEABMO
[NH3+][C@@H]1C(=O)N(c2ccc(F)cc2)[C@H]1c1cccs1	ZINC000072227199	256703523	/nfs/dbraw/zinc/70/35/23/256703523.db2.gz	RRJYLPIQTIKPMO-RYUDHWBXSA-N	1	1	262.309	2.302	40	0		CEABMO
[NH3+]Cc1nc(C2=Cc3cc(Cl)ccc3OC2)no1	ZINC000062716601	256723030	/nfs/dbraw/zinc/72/30/30/256723030.db2.gz	QTBTUJVLZJCXKF-UHFFFAOYSA-N	1	1	263.684	2.115	40	0		CEABMO
Cc1cnc(N2CC[C@@]3(CCC[N@@H+]3CC(C)C)C2)nc1	ZINC000096203041	256822491	/nfs/dbraw/zinc/82/24/91/256822491.db2.gz	ODOHAVAPOFUHEW-INIZCTEOSA-N	1	1	274.412	2.486	40	0		CEABMO
c1ccn(C[C@@H]2CC[C@H]3[C@@H]2OCC[N@@H+]3Cc2ccc[nH]2)c1	ZINC000096250200	256834765	/nfs/dbraw/zinc/83/47/65/256834765.db2.gz	UDUCYYMVLBHZHH-BHYGNILZSA-N	1	1	285.391	2.496	40	0		CEABMO
c1ccn(C[C@@H]2CC[C@H]3[C@@H]2OCC[N@H+]3Cc2ccc[nH]2)c1	ZINC000096250200	256834766	/nfs/dbraw/zinc/83/47/66/256834766.db2.gz	UDUCYYMVLBHZHH-BHYGNILZSA-N	1	1	285.391	2.496	40	0		CEABMO
CC(C)[N@H+]1CCC[C@H]1c1cccnc1N1CCOCC1	ZINC000072216222	394593295	/nfs/dbraw/zinc/59/32/95/394593295.db2.gz	SJRBXFIGOABRLX-HNNXBMFYSA-N	1	1	275.396	2.464	40	0		CEABMO
CC[N@H+]1CCCC[C@@H]1c1ccc(N2CCOCC2)nc1	ZINC000072216178	394593421	/nfs/dbraw/zinc/59/34/21/394593421.db2.gz	QHNAMJQGCIHUHM-OAHLLOKOSA-N	1	1	275.396	2.465	40	0		CEABMO
Cc1cc(N2CCCC2)[nH+]cc1[C@@H]1CCCN1C=O	ZINC000072218847	394593476	/nfs/dbraw/zinc/59/34/76/394593476.db2.gz	NQFZRTNOAOBTOH-AWEZNQCLSA-N	1	1	259.353	2.284	40	0		CEABMO
CCC[N@@H+]1CCC[C@@H]1c1cccnc1N1CCN(C)CC1	ZINC000072216583	394593486	/nfs/dbraw/zinc/59/34/86/394593486.db2.gz	CTMNVLLKNHPFBN-MRXNPFEDSA-N	1	1	288.439	2.380	40	0		CEABMO
CCC[N@H+]1CCC[C@@H]1c1cccnc1N1CCN(C)CC1	ZINC000072216583	394593490	/nfs/dbraw/zinc/59/34/90/394593490.db2.gz	CTMNVLLKNHPFBN-MRXNPFEDSA-N	1	1	288.439	2.380	40	0		CEABMO
COc1ccc(N2C(=O)[C@@H]([NH3+])[C@@H]2c2ccccc2F)cc1	ZINC000072227175	394595418	/nfs/dbraw/zinc/59/54/18/394595418.db2.gz	XKWPSGICQZPRNH-GJZGRUSLSA-N	1	1	286.306	2.250	40	0		CEABMO
COc1ccc([C@H]2[C@H]([NH3+])C(=O)N2c2cccc(C)c2)cc1	ZINC000072227399	394595428	/nfs/dbraw/zinc/59/54/28/394595428.db2.gz	JVLQZDFTFIYYDA-HOTGVXAUSA-N	1	1	282.343	2.419	40	0		CEABMO
Cc1ccc([C@H]2[C@H]([NH3+])C(=O)N2Cc2ccc(F)cc2)o1	ZINC000072228211	394596231	/nfs/dbraw/zinc/59/62/31/394596231.db2.gz	HSLBPAIYUNHBMV-KBPBESRZSA-N	1	1	274.295	2.138	40	0		CEABMO
[NH3+]CC(=O)c1c(F)ccc(Br)c1Cl	ZINC000169800936	400285018	/nfs/dbraw/zinc/28/50/18/400285018.db2.gz	ANXKFZRFLUCUEY-UHFFFAOYSA-N	1	1	266.497	2.383	40	0		CEABMO
CC(C)[N@H+]1CCC[C@H]1c1cnc(-c2ccnn2C)cn1	ZINC000257205892	400317318	/nfs/dbraw/zinc/31/73/18/400317318.db2.gz	BAZLQWTWEDRHOI-HNNXBMFYSA-N	1	1	271.368	2.422	40	0		CEABMO
Nc1ncc(-c2ccccc2)c([C@@H]2CCCC[N@H+]2CCO)n1	ZINC000072354570	176374816	/nfs/dbraw/zinc/37/48/16/176374816.db2.gz	DJYSVJGZYVLTEV-HNNXBMFYSA-N	1	1	298.390	2.245	40	0		CEABMO
Cc1nc[nH]c1C[N@H+]1CC[C@H](c2nc(C)cc(C)n2)C1	ZINC000072369806	176384200	/nfs/dbraw/zinc/38/42/00/176384200.db2.gz	OMOCPVCIVLOTGZ-ZDUSSCGKSA-N	1	1	271.368	2.114	40	0		CEABMO
C[C@H]1OC(=O)[C@H]2CC[C@H]3c4ccccc4CC[N@H+]3[C@@H]12	ZINC000005530788	280052365	/nfs/dbraw/zinc/05/23/65/280052365.db2.gz	RFAUXYMFAVVSFU-KJEVXHAQSA-N	1	1	257.333	2.310	40	0		CEABMO
CN1c2ccccc2O[C@H]2C[C@@H](C1=O)[N@H+](C1CCC1)C2	ZINC000096111902	290320816	/nfs/dbraw/zinc/32/08/16/290320816.db2.gz	FITWSLKYNCCIQN-JSGCOSHPSA-N	1	1	272.348	2.037	40	0	biogenic,in-vitro	CEABMO
O[C@@H]1CC[N@H+](Cc2ccc(Br)cc2)C1	ZINC000061708117	527674512	/nfs/dbraw/zinc/67/45/12/527674512.db2.gz	PPZFUFKRHOBDAO-LLVKDONJSA-N	1	1	256.143	2.016	40	0		CEABMO
O[C@@H]1CC[N@@H+](Cc2ccc(Br)cc2)C1	ZINC000061708117	527674516	/nfs/dbraw/zinc/67/45/16/527674516.db2.gz	PPZFUFKRHOBDAO-LLVKDONJSA-N	1	1	256.143	2.016	40	0		CEABMO
COc1ccc([C@@H]([NH3+])c2nc(-c3ccccc3O)n[nH]2)cc1	ZINC000095533655	185007650	/nfs/dbraw/zinc/00/76/50/185007650.db2.gz	SMRMUCQYZOJKSZ-CQSZACIVSA-N	1	1	296.330	2.234	40	0		CEABMO
O=C1[C@H]2C[N@@H+](Cc3cccnc3)C[C@@H]2CN1c1ccccc1	ZINC000096053595	185074509	/nfs/dbraw/zinc/07/45/09/185074509.db2.gz	OGHHDTIIPQZBSA-WBVHZDCISA-N	1	1	293.370	2.176	40	0		CEABMO
COC[C@@]12CCCO[C@H]1CC[N@@H+](Cc1cccnc1)C2	ZINC000096056725	185077969	/nfs/dbraw/zinc/07/79/69/185077969.db2.gz	MUKJZWFPHMTUTQ-HOTGVXAUSA-N	1	1	276.380	2.099	40	0		CEABMO
Cc1noc([C@H]2C[C@@H]3CC[N@H+](Cc4ccoc4)C[C@H]3O2)n1	ZINC000096058186	185079451	/nfs/dbraw/zinc/07/94/51/185079451.db2.gz	OHBQHAYZDQNONR-BFHYXJOUSA-N	1	1	289.335	2.323	40	0		CEABMO
Cc1noc([C@H]2C[C@@H]3CC[N@@H+](Cc4ccoc4)C[C@H]3O2)n1	ZINC000096058186	185079452	/nfs/dbraw/zinc/07/94/52/185079452.db2.gz	OHBQHAYZDQNONR-BFHYXJOUSA-N	1	1	289.335	2.323	40	0		CEABMO
COC[C@H]1C[N@H+](Cc2ccc(C)o2)Cc2cnn(C)c21	ZINC000096060011	185080423	/nfs/dbraw/zinc/08/04/23/185080423.db2.gz	VDRPXWZTTBIOIP-CYBMUJFWSA-N	1	1	275.352	2.067	40	0		CEABMO
COC[C@H]1C[N@@H+](Cc2ccc(C)o2)Cc2cnn(C)c21	ZINC000096060011	185080424	/nfs/dbraw/zinc/08/04/24/185080424.db2.gz	VDRPXWZTTBIOIP-CYBMUJFWSA-N	1	1	275.352	2.067	40	0		CEABMO
CCOC[C@H]1C[N@H+](Cc2ccc(C)o2)Cc2cn(C)nc21	ZINC000096059837	185081390	/nfs/dbraw/zinc/08/13/90/185081390.db2.gz	XGWUBDGUJNXORJ-CQSZACIVSA-N	1	1	289.379	2.457	40	0		CEABMO
CCOC[C@H]1C[N@@H+](Cc2ccc(C)o2)Cc2cn(C)nc21	ZINC000096059837	185081391	/nfs/dbraw/zinc/08/13/91/185081391.db2.gz	XGWUBDGUJNXORJ-CQSZACIVSA-N	1	1	289.379	2.457	40	0		CEABMO
CCO[C@@H]1CO[C@]2(C1)CCC[N@H+](Cc1cc(C)on1)C2	ZINC000096107456	185100393	/nfs/dbraw/zinc/10/03/93/185100393.db2.gz	BGGLIUCFDBYKLH-GJZGRUSLSA-N	1	1	280.368	2.143	40	0		CEABMO
CCO[C@@H]1CO[C@]2(C1)CCC[N@@H+](Cc1cc(C)on1)C2	ZINC000096107456	185100394	/nfs/dbraw/zinc/10/03/94/185100394.db2.gz	BGGLIUCFDBYKLH-GJZGRUSLSA-N	1	1	280.368	2.143	40	0		CEABMO
Cc1ncnc2c1CC[N@@H+](Cc1ccsc1)CC2	ZINC000096058589	282225336	/nfs/dbraw/zinc/22/53/36/282225336.db2.gz	YRINONXTHBYRGS-UHFFFAOYSA-N	1	1	259.378	2.447	40	0		CEABMO
COC(=O)C1CC[NH+](Cc2ccccc2F)CC1	ZINC000047916409	362232076	/nfs/dbraw/zinc/23/20/76/362232076.db2.gz	NSHODWLKRZSGTF-UHFFFAOYSA-N	1	1	251.301	2.211	40	0		CEABMO
[NH3+]Cc1noc([C@@H](C2CCCCC2)n2cccc2)n1	ZINC000409439428	344889697	/nfs/dbraw/zinc/88/96/97/344889697.db2.gz	HJDNOABGYKYIFA-CYBMUJFWSA-N	1	1	260.341	2.500	40	0		CEABMO
[NH3+][C@@H](C[C@H](c1ccc(Cl)cc1)[NH+]1CCCC1)C(=O)[O-]	ZINC000409440108	344889793	/nfs/dbraw/zinc/88/97/93/344889793.db2.gz	JPBIMQFWRADWCT-QWHCGFSZSA-N	1	1	282.771	2.279	40	0		CEABMO
CC(C)CC[N@H+]1C[C@H]2CN(c3ncccn3)CC[C@H]21	ZINC000585107983	345005576	/nfs/dbraw/zinc/00/55/76/345005576.db2.gz	PYXNWZCQMGQFSB-UONOGXRCSA-N	1	1	260.385	2.033	40	0		CEABMO
CN(C)c1cc([C@@H]2CCCN(c3ccncn3)C2)cc[nH+]1	ZINC000072380927	363130750	/nfs/dbraw/zinc/13/07/50/363130750.db2.gz	VRTJBDDDJNCSQB-CQSZACIVSA-N	1	1	283.379	2.322	40	0		CEABMO
COC(=O)C1CC[NH+](Cc2ccc(F)c(F)c2)CC1	ZINC000072801891	363166077	/nfs/dbraw/zinc/16/60/77/363166077.db2.gz	ZCPXGRGJTMPETP-UHFFFAOYSA-N	1	1	269.291	2.350	40	0		CEABMO
O=C1N(c2ccccc2)C[C@H]2C[N@@H+](C3CCC3)CCN12	ZINC000077266474	363545734	/nfs/dbraw/zinc/54/57/34/363545734.db2.gz	PYZLRDUVURGAJS-OAHLLOKOSA-N	1	1	271.364	2.165	40	0	biogenic,in-vitro	CEABMO
O[C@H]1CCC[N@H+](Cc2cc(Br)cs2)C1	ZINC000000200669	361144226	/nfs/dbraw/zinc/14/42/26/361144226.db2.gz	BNRKCYBLYMEXOX-VIFPVBQESA-N	1	1	276.199	2.467	40	0		CEABMO
O[C@H]1CCC[N@@H+](Cc2cc(Br)cs2)C1	ZINC000000200669	361144229	/nfs/dbraw/zinc/14/42/29/361144229.db2.gz	BNRKCYBLYMEXOX-VIFPVBQESA-N	1	1	276.199	2.467	40	0		CEABMO
c1cncc(C[N@H+]2CCC[C@@H](c3[nH]nc4nccnc43)C2)c1	ZINC000019339041	361528388	/nfs/dbraw/zinc/52/83/88/361528388.db2.gz	JHSJWLYRGHNTAQ-CYBMUJFWSA-N	1	1	294.362	2.128	40	0		CEABMO
COc1cccc(CN2C[C@H]3CCC[N@H+]3C[C@@H]2C)c1	ZINC000019575782	361543977	/nfs/dbraw/zinc/54/39/77/361543977.db2.gz	YWXCEYSSIJOVDP-DZGCQCFKSA-N	1	1	260.381	2.364	40	0		CEABMO
CCN(CC)CC[NH2+]Cc1cc(OC)c(OC)cc1OC	ZINC000019919168	361567659	/nfs/dbraw/zinc/56/76/59/361567659.db2.gz	DFGIPAJXZVQHJQ-UHFFFAOYSA-N	1	1	296.411	2.144	40	0		CEABMO
CCOC[C@@H]1CC[C@H]2[C@H](CC[N@H+]2Cc2c(C)noc2C)O1	ZINC000096186048	364406806	/nfs/dbraw/zinc/40/68/06/364406806.db2.gz	VAUHOWLAXWIMEE-BPUTZDHNSA-N	1	1	294.395	2.450	40	0		CEABMO
Cc1cccc(N2CC[C@@H]3[C@@H]2CCN3c2ncccn2)[nH+]1	ZINC000096184808	364407721	/nfs/dbraw/zinc/40/77/21/364407721.db2.gz	BEABPCHWYLZVKL-UONOGXRCSA-N	1	1	281.363	2.038	40	0		CEABMO
COC[C@H]1c2c(cnn2C)CC[N@H+]1Cc1cccc(C)c1	ZINC000096197725	364408798	/nfs/dbraw/zinc/40/87/98/364408798.db2.gz	UJKDVKJBBQVYPK-INIZCTEOSA-N	1	1	285.391	2.474	40	0		CEABMO
COC[C@H]1c2c(cnn2C)CC[N@@H+]1Cc1cccc(C)c1	ZINC000096197725	364408801	/nfs/dbraw/zinc/40/88/01/364408801.db2.gz	UJKDVKJBBQVYPK-INIZCTEOSA-N	1	1	285.391	2.474	40	0		CEABMO
COc1ccc(C[N@H+]2CC[C@@H](O)[C@@H]2Cc2ccncc2)cc1	ZINC000096200279	364411280	/nfs/dbraw/zinc/41/12/80/364411280.db2.gz	YXODIXGVYCKSIP-ZWKOTPCHSA-N	1	1	298.386	2.268	40	0		CEABMO
COC[C@@H]1C[N@H+](C)C[C@@]12CCN(Cc1sccc1C)C2	ZINC000096209616	364412081	/nfs/dbraw/zinc/41/20/81/364412081.db2.gz	JCWZMNMZPIKEIM-GOEBONIOSA-N	1	1	294.464	2.457	40	0		CEABMO
COC[C@@H]1C[N@@H+](C)C[C@@]12CCN(Cc1sccc1C)C2	ZINC000096209616	364412089	/nfs/dbraw/zinc/41/20/89/364412089.db2.gz	JCWZMNMZPIKEIM-GOEBONIOSA-N	1	1	294.464	2.457	40	0		CEABMO
COC[C@@H]1CN(C)C[C@@]12CC[N@H+](Cc1sccc1C)C2	ZINC000096209616	364412093	/nfs/dbraw/zinc/41/20/93/364412093.db2.gz	JCWZMNMZPIKEIM-GOEBONIOSA-N	1	1	294.464	2.457	40	0		CEABMO
COC[C@@H]1CN(C)C[C@@]12CC[N@@H+](Cc1sccc1C)C2	ZINC000096209616	364412101	/nfs/dbraw/zinc/41/21/01/364412101.db2.gz	JCWZMNMZPIKEIM-GOEBONIOSA-N	1	1	294.464	2.457	40	0		CEABMO
c1coc(CN2C[C@H]3C[C@@H](C2)C[N@H+](C[C@@H]2CCOC2)C3)c1	ZINC000096252324	364416479	/nfs/dbraw/zinc/41/64/79/364416479.db2.gz	CDHZTPDFSWQDBP-HRCADAONSA-N	1	1	290.407	2.070	40	0		CEABMO
[NH3+]CCSc1nc(-c2ccc(Cl)cc2)n[nH]1	ZINC000224978776	370284628	/nfs/dbraw/zinc/28/46/28/370284628.db2.gz	XZPKNDSNSQRGBT-UHFFFAOYSA-N	1	1	254.746	2.176	40	0		CEABMO
Cc1cccc(N2CCO[C@@H](c3cccc(N(C)C)n3)C2)[nH+]1	ZINC000257283124	371610286	/nfs/dbraw/zinc/61/02/86/371610286.db2.gz	OWVVLVDYQKHAOI-OAHLLOKOSA-N	1	1	298.390	2.429	40	0		CEABMO
FCCn1ccc(C[NH2+]Cc2cccc(F)c2)n1	ZINC000256054178	190004832	/nfs/dbraw/zinc/00/48/32/190004832.db2.gz	VFKDEKSQTFXREX-UHFFFAOYSA-N	1	1	251.280	2.282	40	0		CEABMO
CCn1ncc(C[NH2+]Cc2ccc(F)cc2)c1F	ZINC000256052039	190003825	/nfs/dbraw/zinc/00/38/25/190003825.db2.gz	LRKRNWHVYGZZFG-UHFFFAOYSA-N	1	1	251.280	2.471	40	0		CEABMO
Cn1ccnc1C[N@H+]1CCC[C@H]1CCc1ccncc1	ZINC000257209575	190012095	/nfs/dbraw/zinc/01/20/95/190012095.db2.gz	BQXMNTZYQLRJKK-HNNXBMFYSA-N	1	1	270.380	2.412	40	0		CEABMO
c1ccc(C[C@H]2COCC[N@@H+](Cc3ccccn3)C2)nc1	ZINC000257208341	190012388	/nfs/dbraw/zinc/01/23/88/190012388.db2.gz	BLTHNOQMDMAQSP-OAHLLOKOSA-N	1	1	283.375	2.168	40	0		CEABMO
Cc1c[nH]c([C@H]2CCC[N@@H+](Cc3ccccn3)C2)n1	ZINC000257214262	190012813	/nfs/dbraw/zinc/01/28/13/190012813.db2.gz	CLHNKVHCOOTQFK-ZDUSSCGKSA-N	1	1	256.353	2.493	40	0		CEABMO
C[C@@]1(O)CC[N@@H+](Cc2cccnc2)C[C@H]1Oc1ccccc1	ZINC000257225499	190015665	/nfs/dbraw/zinc/01/56/65/190015665.db2.gz	FGMZAYMZRFXXNS-QZTJIDSGSA-N	1	1	298.386	2.486	40	0		CEABMO
Cn1ccc(C[N@H+]2CCC[C@H](Cc3cccnc3)C2)n1	ZINC000257280313	190025601	/nfs/dbraw/zinc/02/56/01/190025601.db2.gz	OKJDUTDNZLDIBI-OAHLLOKOSA-N	1	1	270.380	2.270	40	0		CEABMO
CC(C)[N@H+]1CCC[C@@H](c2cnc(-c3cn[nH]c3)cn2)C1	ZINC000257279702	190025682	/nfs/dbraw/zinc/02/56/82/190025682.db2.gz	OHUIMLUBNLNZBO-GFCCVEGCSA-N	1	1	271.368	2.455	40	0		CEABMO
CCn1cc(C[N@H+]2CC[C@H](c3nccc(C)n3)C2)c(C)n1	ZINC000257284032	190025959	/nfs/dbraw/zinc/02/59/59/190025959.db2.gz	PAZOQNVAVOTRQY-AWEZNQCLSA-N	1	1	285.395	2.299	40	0		CEABMO
Cn1ccc(C[N@H+]2CCC[C@@H](Cc3ccccn3)C2)n1	ZINC000257306689	190031426	/nfs/dbraw/zinc/03/14/26/190031426.db2.gz	SVJOLQPKMZGKKS-AWEZNQCLSA-N	1	1	270.380	2.270	40	0		CEABMO
CCn1cc(C[N@H+]2CCC[C@H](c3ccncn3)C2)c(C)n1	ZINC000257290725	190027923	/nfs/dbraw/zinc/02/79/23/190027923.db2.gz	QEBPXZUSMXUDMJ-AWEZNQCLSA-N	1	1	285.395	2.381	40	0		CEABMO
Cc1cc(-c2cc(C)nc([C@H]3CCC[N@H+]3C)n2)n[nH]1	ZINC000257314190	190032197	/nfs/dbraw/zinc/03/21/97/190032197.db2.gz	UVRNTQRBKLMNBQ-CYBMUJFWSA-N	1	1	257.341	2.250	40	0		CEABMO
Cc1cc(-c2cc(C)nc([C@H]3CCC[N@@H+]3C)n2)n[nH]1	ZINC000257314190	190032198	/nfs/dbraw/zinc/03/21/98/190032198.db2.gz	UVRNTQRBKLMNBQ-CYBMUJFWSA-N	1	1	257.341	2.250	40	0		CEABMO
CCCn1cc(C[N@H+]2CCC[C@@H](c3ccncn3)C2)cn1	ZINC000257321849	190033774	/nfs/dbraw/zinc/03/37/74/190033774.db2.gz	WDNMMULLDYDIRF-OAHLLOKOSA-N	1	1	285.395	2.463	40	0		CEABMO
Cc1nc(Nc2nccs2)cc([C@H]2CC[N@H+](C)C2)n1	ZINC000257326439	190035071	/nfs/dbraw/zinc/03/50/71/190035071.db2.gz	WXFQOWZEHGEQRD-JTQLQIEISA-N	1	1	275.381	2.404	40	0		CEABMO
CNc1cncc([C@@H]2CCC[N@@H+]2Cc2ccncc2)n1	ZINC000257343620	190037609	/nfs/dbraw/zinc/03/76/09/190037609.db2.gz	ZTTQEJNUWPEZDT-AWEZNQCLSA-N	1	1	269.352	2.250	40	0		CEABMO
CNc1cncc([C@@H]2CCC[N@H+]2Cc2ccncc2)n1	ZINC000257343620	190037610	/nfs/dbraw/zinc/03/76/10/190037610.db2.gz	ZTTQEJNUWPEZDT-AWEZNQCLSA-N	1	1	269.352	2.250	40	0		CEABMO
O=C1CC[C@H]2[C@H](CC[N@H+]2[C@@H]2CCOC2)N1c1ccccc1	ZINC000096186446	296331407	/nfs/dbraw/zinc/33/14/07/296331407.db2.gz	TYHFUJUVUHHYOE-PMPSAXMXSA-N	1	1	286.375	2.045	40	0		CEABMO
Cc1cccc(N2C(=O)[C@@H]([NH3+])[C@H]2c2ccccc2)c1	ZINC000072227394	394595173	/nfs/dbraw/zinc/59/51/73/394595173.db2.gz	SXKSANYKZLGAMA-LSDHHAIUSA-N	1	1	252.317	2.410	40	0		CEABMO
Cc1ccc([C@H]2[C@@H]([NH3+])C(=O)N2c2ccccc2)cc1	ZINC000059103827	292279982	/nfs/dbraw/zinc/27/99/82/292279982.db2.gz	QIKATRSAPXONBD-CABCVRRESA-N	1	1	252.317	2.410	40	0		CEABMO
COC(=O)C([NH3+])(Cc1ccccc1)Cc1ccccc1	ZINC000021297887	171300994	/nfs/dbraw/zinc/30/09/94/171300994.db2.gz	INZREICDVRSJDB-UHFFFAOYSA-N	1	1	269.344	2.342	40	0		CEABMO
CC(C)C[N@@H+]1CCCC[C@@H]1c1ncc(C(N)=O)s1	ZINC000257339718	277387867	/nfs/dbraw/zinc/38/78/67/277387867.db2.gz	ZCWZNYFVXVIWCQ-SNVBAGLBSA-N	1	1	267.398	2.425	40	0		CEABMO
CC(C)C[N@H+]1CCCC[C@@H]1c1ncc(C(N)=O)s1	ZINC000257339718	277387869	/nfs/dbraw/zinc/38/78/69/277387869.db2.gz	ZCWZNYFVXVIWCQ-SNVBAGLBSA-N	1	1	267.398	2.425	40	0		CEABMO
CCn1cc(C[N@H+]2CCC[C@H](c3cc[nH]n3)C2)cn1	ZINC000121191843	365534065	/nfs/dbraw/zinc/53/40/65/365534065.db2.gz	PXDLOQHUFQZOAH-ZDUSSCGKSA-N	1	1	259.357	2.006	40	0		CEABMO
CCO[C@@H]1CC[C@H]2[C@H]1OCC[N@@H+]2Cc1cccc(OC)c1	ZINC000096041452	185070450	/nfs/dbraw/zinc/07/04/50/185070450.db2.gz	UCMKQJAKVPTCLE-GVDBMIGSSA-N	1	1	291.391	2.464	40	0		CEABMO
CCO[C@@H]1CC[C@H]2[C@H]1OCC[N@H+]2Cc1cccc(OC)c1	ZINC000096041452	185070451	/nfs/dbraw/zinc/07/04/51/185070451.db2.gz	UCMKQJAKVPTCLE-GVDBMIGSSA-N	1	1	291.391	2.464	40	0		CEABMO
c1cc(C[NH+]2C[C@@H]3CN(Cc4ccccn4)C[C@H]3C2)co1	ZINC000096053783	185074482	/nfs/dbraw/zinc/07/44/82/185074482.db2.gz	CVYSNAJBYFRQLK-HZPDHXFCSA-N	1	1	283.375	2.238	40	0		CEABMO
Fc1cccnc1O[C@@H]1CC[C@H]2[C@H]1OCC[N@H+]2CC1CC1	ZINC000096058069	185079446	/nfs/dbraw/zinc/07/94/46/185079446.db2.gz	YZQZJPINPYHAPD-RRFJBIMHSA-N	1	1	292.354	2.241	40	0		CEABMO
COC[C@H]1C[N@H+](Cc2ccc(C)o2)Cc2cn(C)nc21	ZINC000096059809	185080342	/nfs/dbraw/zinc/08/03/42/185080342.db2.gz	LJCQNZIKDFKURA-CYBMUJFWSA-N	1	1	275.352	2.067	40	0		CEABMO
COC[C@H]1C[N@@H+](Cc2ccc(C)o2)Cc2cn(C)nc21	ZINC000096059809	185080344	/nfs/dbraw/zinc/08/03/44/185080344.db2.gz	LJCQNZIKDFKURA-CYBMUJFWSA-N	1	1	275.352	2.067	40	0		CEABMO
CO[C@@H]1CO[C@]2(C1)CCC[N@H+](Cc1nc(C)cs1)C2	ZINC000096107431	185099706	/nfs/dbraw/zinc/09/97/06/185099706.db2.gz	GYBZXMCMOKNNSJ-JSGCOSHPSA-N	1	1	282.409	2.221	40	0		CEABMO
CO[C@@H]1CO[C@]2(C1)CCC[N@@H+](Cc1nc(C)cs1)C2	ZINC000096107431	185099707	/nfs/dbraw/zinc/09/97/07/185099707.db2.gz	GYBZXMCMOKNNSJ-JSGCOSHPSA-N	1	1	282.409	2.221	40	0		CEABMO
CCOC[C@]12COC[C@H]1C[N@@H+](CCc1ccccc1)C2	ZINC000096108670	185099716	/nfs/dbraw/zinc/09/97/16/185099716.db2.gz	GVAJTTGOWQBCEL-IAGOWNOFSA-N	1	1	275.392	2.214	40	0		CEABMO
COC[C@@]12CCO[C@@H]1CC[N@@H+](Cc1ccccc1OC)C2	ZINC000096110332	185100591	/nfs/dbraw/zinc/10/05/91/185100591.db2.gz	USBAKSFFVGPQAL-SJORKVTESA-N	1	1	291.391	2.323	40	0		CEABMO
F[C@@H]1C[N@@H+](C2CCC2)C[C@@H]1OCc1nc2cc[nH]cc-2n1	ZINC000096112119	185101086	/nfs/dbraw/zinc/10/10/86/185101086.db2.gz	XIHTWYYGNZBSOY-RISCZKNCSA-N	1	1	290.342	2.049	40	0	biogenic,in-vitro	CEABMO
F[C@@H]1C[N@H+](C2CCC2)C[C@@H]1OCc1nc2cc[nH]cc-2n1	ZINC000096112119	185101087	/nfs/dbraw/zinc/10/10/87/185101087.db2.gz	XIHTWYYGNZBSOY-RISCZKNCSA-N	1	1	290.342	2.049	40	0	biogenic,in-vitro	CEABMO
O=C1CCC[C@@H]2[C@@H](CC[N@H+]2Cc2ccnc3ccccc23)N1	ZINC000019713249	343374932	/nfs/dbraw/zinc/37/49/32/343374932.db2.gz	JSSVZFJWZKRMAT-IAGOWNOFSA-N	1	1	295.386	2.478	40	0		CEABMO
O=C(N1C[C@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C1)C(F)(F)F	ZINC000230825087	344573887	/nfs/dbraw/zinc/57/38/87/344573887.db2.gz	GSFJOXSSOIZLBU-OLZOCXBDSA-N	1	1	298.308	2.282	40	0		CEABMO
Cc1ccccc1C[C@H]1CC[N@@H+](Cc2cncnc2)C[C@@H]1O	ZINC000585277025	345009714	/nfs/dbraw/zinc/00/97/14/345009714.db2.gz	FIUCUMDNSFLUJB-MSOLQXFVSA-N	1	1	297.402	2.211	40	0		CEABMO
CN(C)C(=O)[C@@H]1CCC[C@]12CC[N@@H+](Cc1cccnc1)C2	ZINC000108535373	186222163	/nfs/dbraw/zinc/22/21/63/186222163.db2.gz	NJSPWOZGJRDLMX-DOTOQJQBSA-N	1	1	287.407	2.162	40	0		CEABMO
CC[NH+]1CCN(C(=O)c2cc(C)c(C)cc2C)CC1	ZINC000074951586	363426066	/nfs/dbraw/zinc/42/60/66/363426066.db2.gz	KLKMSADTLUVVFF-UHFFFAOYSA-N	1	1	260.381	2.390	40	0		CEABMO
COc1cccc(C[N@H+]2CC[C@H](c3nc(C)cc(=O)[nH]3)C2)c1	ZINC000019118475	361520053	/nfs/dbraw/zinc/52/00/53/361520053.db2.gz	DJSJTSHPPORLPG-AWEZNQCLSA-N	1	1	299.374	2.076	40	0		CEABMO
COc1ccc(C[N@H+]2C[C@H]3CCc4nnc(C)n4[C@H]3C2)cc1	ZINC000019288361	361526489	/nfs/dbraw/zinc/52/64/89/361526489.db2.gz	IDRWRHKHLSZTTM-ZBFHGGJFSA-N	1	1	298.390	2.214	40	0		CEABMO
C[C@]12C[N@H+](C3CCCC3)C[C@H]1NC(=O)c1ccccc1C2=O	ZINC000019576449	361543124	/nfs/dbraw/zinc/54/31/24/361543124.db2.gz	VLZGMMPXCNIEBT-QAPCUYQASA-N	1	1	298.386	2.246	40	0		CEABMO
CC[NH+](CC)CCN[C@@H](C)C(=O)N1[C@H](C)CCC[C@@H]1C	ZINC000022931228	361590127	/nfs/dbraw/zinc/59/01/27/361590127.db2.gz	CXSVMOSHBAQULZ-ZNMIVQPWSA-N	1	1	283.460	2.096	40	0		CEABMO
Fc1ccc(C[N@@H+]2C[C@H]3CN(c4ncccn4)C[C@H]3C2)cc1	ZINC000096182365	364406225	/nfs/dbraw/zinc/40/62/25/364406225.db2.gz	HKEADEHYYLWZHY-GASCZTMLSA-N	1	1	298.365	2.184	40	0		CEABMO
c1ccc(N[C@@H]2C[N@@H+](CC3CC3)C[C@@H]3CCCO[C@H]23)nc1	ZINC000096040698	364398292	/nfs/dbraw/zinc/39/82/92/364398292.db2.gz	KDRYFBQYHYPINM-UXLLHSPISA-N	1	1	287.407	2.383	40	0		CEABMO
CCO[C@H]1COC2(C1)CC[NH+](Cc1nccs1)CC2	ZINC000096158717	364402480	/nfs/dbraw/zinc/40/24/80/364402480.db2.gz	CJKPACADZIPACQ-GFCCVEGCSA-N	1	1	282.409	2.303	40	0		CEABMO
C[N@H+]1CCCC[C@@]12CCCN(C(=O)c1cccnc1)C2	ZINC000096217569	364413449	/nfs/dbraw/zinc/41/34/49/364413449.db2.gz	NMTDSXGPBCBHBM-INIZCTEOSA-N	1	1	273.380	2.172	40	0		CEABMO
O=C(c1cscn1)N1C[C@H]2[C@H](C[N@@H+]2Cc2ccccc2)C1	ZINC000096244894	364415757	/nfs/dbraw/zinc/41/57/57/364415757.db2.gz	KNCIKAUEZBWCAT-HIFRSBDPSA-N	1	1	299.399	2.100	40	0		CEABMO
O=C(c1cscn1)N1C[C@H]2[C@H](C[N@H+]2Cc2ccccc2)C1	ZINC000096244894	364415760	/nfs/dbraw/zinc/41/57/60/364415760.db2.gz	KNCIKAUEZBWCAT-HIFRSBDPSA-N	1	1	299.399	2.100	40	0		CEABMO
COc1ccc2c(c1)C1(CCN(C)CC1)[N@H+](C)CC2	ZINC000096242674	364416554	/nfs/dbraw/zinc/41/65/54/364416554.db2.gz	QCWNJEMNPBGJHN-UHFFFAOYSA-N	1	1	260.381	2.104	40	0		CEABMO
COc1ccc2c(c1)C1(CC[NH+](C)CC1)N(C)CC2	ZINC000096242674	364416556	/nfs/dbraw/zinc/41/65/56/364416556.db2.gz	QCWNJEMNPBGJHN-UHFFFAOYSA-N	1	1	260.381	2.104	40	0		CEABMO
c1cncc(C[N@H+]2CCc3ncnc(C4CC4)c3CC2)c1	ZINC000096255085	364418285	/nfs/dbraw/zinc/41/82/85/364418285.db2.gz	XDACXFWHNNJQRU-UHFFFAOYSA-N	1	1	280.375	2.350	40	0		CEABMO
C[C@H]1c2ncc(CCOCc3ccccn3)n2CC[N@@H+]1C	ZINC000585096840	367177137	/nfs/dbraw/zinc/17/71/37/367177137.db2.gz	BMVWNXZPCWNUCP-ZDUSSCGKSA-N	1	1	286.379	2.044	40	0		CEABMO
COc1ccc(C[NH2+]Cc2ccn(CC(F)F)n2)cc1	ZINC000256052175	190004339	/nfs/dbraw/zinc/00/43/39/190004339.db2.gz	MEXQBWBOWSVFIV-UHFFFAOYSA-N	1	1	281.306	2.447	40	0		CEABMO
CCC[N@H+]1CCC[C@H]1c1cccc(CNC(C)=O)n1	ZINC000257204150	190011613	/nfs/dbraw/zinc/01/16/13/190011613.db2.gz	ATFQIWFUOJTHGA-HNNXBMFYSA-N	1	1	261.369	2.265	40	0		CEABMO
Cc1cn(C)c([C@H]2CCC[N@H+](C3CCN(C)CC3)C2)n1	ZINC000257232444	190017376	/nfs/dbraw/zinc/01/73/76/190017376.db2.gz	GKWMCHURAVLAPX-AWEZNQCLSA-N	1	1	276.428	2.002	40	0		CEABMO
O[C@H]1C[N@@H+](Cc2ccc3ncccc3c2)CC[C@@]12CCCO2	ZINC000257236199	190017806	/nfs/dbraw/zinc/01/78/06/190017806.db2.gz	HBECKHMQRWRIII-ROUUACIJSA-N	1	1	298.386	2.351	40	0		CEABMO
Cc1cccnc1C(=O)N1C[C@@H]2C[C@@]3(C)[C@H](CCC[C@@H]13)[N@H+]2C	ZINC000257242841	190018458	/nfs/dbraw/zinc/01/84/58/190018458.db2.gz	IEKGSJPCNIQOOR-AFIMGQEJSA-N	1	1	299.418	2.477	40	0		CEABMO
Cc1c[nH]c([C@@H]2CCC[N@@H+](Cc3cc(C)on3)C2)n1	ZINC000257297490	190029335	/nfs/dbraw/zinc/02/93/35/190029335.db2.gz	RHLMNZXPSRGROP-GFCCVEGCSA-N	1	1	260.341	2.394	40	0		CEABMO
Cc1c[nH]c([C@@H]2CCC[N@H+](Cc3cc(C)on3)C2)n1	ZINC000257297490	190029336	/nfs/dbraw/zinc/02/93/36/190029336.db2.gz	RHLMNZXPSRGROP-GFCCVEGCSA-N	1	1	260.341	2.394	40	0		CEABMO
Cc1nc(N)cc([C@@H]2CCC[N@H+]2CCC(F)(F)F)n1	ZINC000257301131	190030734	/nfs/dbraw/zinc/03/07/34/190030734.db2.gz	RXCQMJKKHUHWJN-JTQLQIEISA-N	1	1	274.290	2.457	40	0		CEABMO
CCn1cc(-c2cnc([C@H]3CCC[N@@H+](C)C3)cn2)cn1	ZINC000257331825	190035602	/nfs/dbraw/zinc/03/56/02/190035602.db2.gz	XUKPQCADAVDZTB-LBPRGKRZSA-N	1	1	271.368	2.169	40	0		CEABMO
Cc1cc(C[N@@H+]2CC[C@@H](c3nccc(C)n3)C2)no1	ZINC000257334059	190035682	/nfs/dbraw/zinc/03/56/82/190035682.db2.gz	YEINZEZGKWZFMV-GFCCVEGCSA-N	1	1	258.325	2.071	40	0		CEABMO
Cc1cc(C[N@H+]2CC[C@@H](c3nccc(C)n3)C2)no1	ZINC000257334059	190035683	/nfs/dbraw/zinc/03/56/83/190035683.db2.gz	YEINZEZGKWZFMV-GFCCVEGCSA-N	1	1	258.325	2.071	40	0		CEABMO
O=C1c2ccccc2C(=O)N1[C@H]1CCC[N@H+]2CCCC[C@@H]12	ZINC000000049578	285021807	/nfs/dbraw/zinc/02/18/07/285021807.db2.gz	KNEGFGGZBIDYHX-GJZGRUSLSA-N	1	1	284.359	2.300	40	0		CEABMO
O=Cc1cc2c[nH+]ccc2n1S(=O)(=O)c1ccccc1	ZINC000034639562	285031053	/nfs/dbraw/zinc/03/10/53/285031053.db2.gz	BOVXSSYSWCHQMX-UHFFFAOYSA-N	1	1	286.312	2.086	40	0		CEABMO
C[N@H+]1CCCC[C@H]1c1cccnc1N1CCOCC1	ZINC000072216237	394593235	/nfs/dbraw/zinc/59/32/35/394593235.db2.gz	SFHHAQJPVLWVON-AWEZNQCLSA-N	1	1	261.369	2.075	40	0		CEABMO
COc1cccc([C@H]2[C@H]([NH3+])C(=O)N2c2cccc(C)c2)c1	ZINC000072227415	394595325	/nfs/dbraw/zinc/59/53/25/394595325.db2.gz	FBMKIGLWJDKQQE-HOTGVXAUSA-N	1	1	282.343	2.419	40	0		CEABMO
Cc1ccc([C@H]2[C@H]([NH3+])C(=O)N2c2ccc3c(c2)OCO3)cc1	ZINC000072227559	394596374	/nfs/dbraw/zinc/59/63/74/394596374.db2.gz	UQRUKIMKBPJUPX-HOTGVXAUSA-N	1	1	296.326	2.139	40	0		CEABMO
[NH3+][C@H]1C(=O)N(c2cccc(F)c2)[C@@H]1c1ccccc1F	ZINC000072227648	394596389	/nfs/dbraw/zinc/59/63/89/394596389.db2.gz	VCFIPGMTGKAAPU-ZIAGYGMSSA-N	1	1	274.270	2.380	40	0		CEABMO
COc1ccc([C@@H]2[C@H]([NH3+])C(=O)N2c2cccc(F)c2)cc1	ZINC000072227610	394596563	/nfs/dbraw/zinc/59/65/63/394596563.db2.gz	IWLCLUMGVIPJOY-LSDHHAIUSA-N	1	1	286.306	2.250	40	0		CEABMO
[NH3+][C@@H]1C(=O)N(Cc2ccc(F)cc2)[C@@H]1c1ccccc1F	ZINC000072228234	394596601	/nfs/dbraw/zinc/59/66/01/394596601.db2.gz	LCRLBTDJPNMCGY-LSDHHAIUSA-N	1	1	288.297	2.376	40	0		CEABMO
CN(C)C(=O)c1sc2ncccc2c1[C@H]1CC[N@@H+](C)C1	ZINC000072352550	394598503	/nfs/dbraw/zinc/59/85/03/394598503.db2.gz	VVAKWBLADKTCFQ-JTQLQIEISA-N	1	1	289.404	2.417	40	0		CEABMO
CC[C@H]([C@H]([NH3+])c1ccccc1F)S(=O)(=O)CC	ZINC000096524960	394697293	/nfs/dbraw/zinc/69/72/93/394697293.db2.gz	ZUGJWTPBVBGUMN-VXGBXAGGSA-N	1	1	259.346	2.039	40	0		CEABMO
CC[NH+]1CCN(C(=O)c2c(Cl)ccc(F)c2F)CC1	ZINC000004861061	170032348	/nfs/dbraw/zinc/03/23/48/170032348.db2.gz	DEDUECWCNJLYDP-UHFFFAOYSA-N	1	1	288.725	2.396	40	0		CEABMO
Cc1[nH+]ccn1Cc1ccc(C(=O)NC(C)C)cc1	ZINC000038832216	174157175	/nfs/dbraw/zinc/15/71/75/174157175.db2.gz	ANHRQSIDXFONRX-UHFFFAOYSA-N	1	1	257.337	2.378	40	0		CEABMO
CC[NH+]1CCN(C(=O)CCSc2ccccc2)CC1	ZINC000046465794	175396770	/nfs/dbraw/zinc/39/67/70/175396770.db2.gz	IRKPHZLIFBHJOG-UHFFFAOYSA-N	1	1	278.421	2.333	40	0		CEABMO
C[N@H+]1CCC[C@H]1c1ccnc(Nc2cnccn2)c1	ZINC000072386720	176392185	/nfs/dbraw/zinc/39/21/85/176392185.db2.gz	HHOHHEHXGTZZMR-LBPRGKRZSA-N	1	1	255.325	2.382	40	0		CEABMO
C[N@H+]1CCC[C@@H]1c1ccnc(Nc2cnccn2)c1	ZINC000072386719	176392299	/nfs/dbraw/zinc/39/22/99/176392299.db2.gz	HHOHHEHXGTZZMR-GFCCVEGCSA-N	1	1	255.325	2.382	40	0		CEABMO
COc1ccc2c(C[N@H+]3CCC[C@H](O)C3)cn(C)c2c1	ZINC000072397836	176395494	/nfs/dbraw/zinc/39/54/94/176395494.db2.gz	GNRTYECGJXQSPO-ZDUSSCGKSA-N	1	1	274.364	2.144	40	0		CEABMO
COCCn1cc(C[N@H+]2CCC[C@@H](O)C2)c2ccccc21	ZINC000072397851	176395738	/nfs/dbraw/zinc/39/57/38/176395738.db2.gz	YMCMEQQBWNRWFF-OAHLLOKOSA-N	1	1	288.391	2.244	40	0		CEABMO
CC[NH+]1CCN(C(=O)Cc2ccc(C)cc2C)CC1	ZINC000074960072	260288770	/nfs/dbraw/zinc/28/87/70/260288770.db2.gz	VXQZQKWQDLHVAB-UHFFFAOYSA-N	1	1	260.381	2.010	40	0		CEABMO
COC[C@@H]1c2nnn(CC3CC3)c2CC[N@H+]1CC1CCC1	ZINC000096045380	277255480	/nfs/dbraw/zinc/25/54/80/277255480.db2.gz	ZVQNECYVFXVSGU-OAHLLOKOSA-N	1	1	290.411	2.034	40	0		CEABMO
COC[C@@H]1c2nnn(CC3CC3)c2CC[N@@H+]1CC1CCC1	ZINC000096045380	277255481	/nfs/dbraw/zinc/25/54/81/277255481.db2.gz	ZVQNECYVFXVSGU-OAHLLOKOSA-N	1	1	290.411	2.034	40	0		CEABMO
COC(=O)[C@@H]1C[C@@H]2c3[nH]c4ccccc4c3CC[N@@H+]2C1	ZINC000031719761	277369078	/nfs/dbraw/zinc/36/90/78/277369078.db2.gz	XKJYWJCEEMLZSB-QMTHXVAHSA-N	1	1	270.332	2.260	40	0		CEABMO
COC[C@]12CCCO[C@H]1CC[N@H+](Cc1cc(C)on1)C2	ZINC000096039135	185068769	/nfs/dbraw/zinc/06/87/69/185068769.db2.gz	UQCRHJTUBHNXHD-LSDHHAIUSA-N	1	1	280.368	2.001	40	0		CEABMO
COC[C@]12CCCO[C@H]1CC[N@@H+](Cc1cc(C)on1)C2	ZINC000096039135	185068771	/nfs/dbraw/zinc/06/87/71/185068771.db2.gz	UQCRHJTUBHNXHD-LSDHHAIUSA-N	1	1	280.368	2.001	40	0		CEABMO
CCOC[C@@]12CCCO[C@@H]1CC[N@H+](Cc1cc(C)on1)C2	ZINC000096039430	185068973	/nfs/dbraw/zinc/06/89/73/185068973.db2.gz	PESAIUXESGOVHU-CVEARBPZSA-N	1	1	294.395	2.391	40	0		CEABMO
CCOC[C@@]12CCCO[C@@H]1CC[N@@H+](Cc1cc(C)on1)C2	ZINC000096039430	185068974	/nfs/dbraw/zinc/06/89/74/185068974.db2.gz	PESAIUXESGOVHU-CVEARBPZSA-N	1	1	294.395	2.391	40	0		CEABMO
COc1ccc(C[N@H+]2CCC[C@]3(CCC(=O)N3)CC2)cc1	ZINC000096047455	185072680	/nfs/dbraw/zinc/07/26/80/185072680.db2.gz	FOPGNETWZQZDLY-KRWDZBQOSA-N	1	1	288.391	2.330	40	0		CEABMO
COC[C@@H]1CCC[C@@]12C[N@H+](Cc1ccccn1)CCO2	ZINC000096051845	185074395	/nfs/dbraw/zinc/07/43/95/185074395.db2.gz	IQBTUXSFWWFSHV-GOEBONIOSA-N	1	1	276.380	2.099	40	0		CEABMO
COC[C@@H]1CCC[C@@]12C[N@@H+](Cc1ccccn1)CCO2	ZINC000096051845	185074397	/nfs/dbraw/zinc/07/43/97/185074397.db2.gz	IQBTUXSFWWFSHV-GOEBONIOSA-N	1	1	276.380	2.099	40	0		CEABMO
O=C1[C@H]2C[N@@H+](Cc3ccoc3)C[C@@H]2CN1c1ccccc1	ZINC000096053575	185074628	/nfs/dbraw/zinc/07/46/28/185074628.db2.gz	UYUUZRNEUPLYLI-ZBFHGGJFSA-N	1	1	282.343	2.374	40	0		CEABMO
c1cncc(C[NH+]2C[C@H]3CN(Cc4ccncc4)C[C@@H]3C2)c1	ZINC000096053744	185075036	/nfs/dbraw/zinc/07/50/36/185075036.db2.gz	GEEIIYLNXYZEPQ-QZTJIDSGSA-N	1	1	294.402	2.040	40	0		CEABMO
Cc1nnc([C@@H]2C[C@H]3OCC[C@H]3[N@@H+](Cc3ccco3)C2)o1	ZINC000096064957	185084221	/nfs/dbraw/zinc/08/42/21/185084221.db2.gz	JIVPBINSBKFBEV-MRVWCRGKSA-N	1	1	289.335	2.118	40	0		CEABMO
Cc1ccc(N2CC[C@@H]3[C@@H]2CC[N@H+]3Cc2ccccn2)nn1	ZINC000096064061	185084773	/nfs/dbraw/zinc/08/47/73/185084773.db2.gz	GCYODMMXAMATDJ-CVEARBPZSA-N	1	1	295.390	2.033	40	0		CEABMO
CC[NH+](CC)CCCNCCC(=O)OC(C)(C)C	ZINC000047219002	362201912	/nfs/dbraw/zinc/20/19/12/362201912.db2.gz	GOECRJWTZXAXKZ-UHFFFAOYSA-N	1	1	258.406	2.040	40	0		CEABMO
COCC[C@H]1CCOC12CC[NH+](Cc1cc(C)on1)CC2	ZINC000585104759	345005861	/nfs/dbraw/zinc/00/58/61/345005861.db2.gz	MCGBJWBKDAXEHO-AWEZNQCLSA-N	1	1	294.395	2.391	40	0		CEABMO
CC[NH+](CC)CC[C@H]1CN(CC2CC2)Cc2ccnn21	ZINC000585112132	345006051	/nfs/dbraw/zinc/00/60/51/345006051.db2.gz	IMLUIIWVBYKXKK-INIZCTEOSA-N	1	1	276.428	2.382	40	0		CEABMO
Cc1cccc(C[C@H]2CC[N@H+](Cc3cc[nH]n3)C[C@@H]2O)c1	ZINC000585278728	345009965	/nfs/dbraw/zinc/00/99/65/345009965.db2.gz	RKNFWGSHDCKIPN-WBVHZDCISA-N	1	1	285.391	2.144	40	0		CEABMO
Cc1cccc(C[C@H]2CC[N@@H+](Cc3cc[nH]n3)C[C@@H]2O)c1	ZINC000585278728	345009967	/nfs/dbraw/zinc/00/99/67/345009967.db2.gz	RKNFWGSHDCKIPN-WBVHZDCISA-N	1	1	285.391	2.144	40	0		CEABMO
CNC(=O)[C@H]1CCC[C@]12CC[N@@H+](Cc1ccsc1)C2	ZINC000108531899	186221761	/nfs/dbraw/zinc/22/17/61/186221761.db2.gz	PCOOAHQOSIDBAW-UKRRQHHQSA-N	1	1	278.421	2.486	40	0		CEABMO
CN(C)c1nc2ccccc2cc1C[N@H+]1CCC[C@H](O)C1	ZINC000072397804	363133028	/nfs/dbraw/zinc/13/30/28/363133028.db2.gz	ONMVZLKPZWGFPT-HNNXBMFYSA-N	1	1	285.391	2.258	40	0		CEABMO
COc1cccc(CCCNC(=O)[C@H]2CCC[N@@H+](C)C2)c1	ZINC000073306977	363210093	/nfs/dbraw/zinc/21/00/93/363210093.db2.gz	CDYHDGZVDLWOIG-HNNXBMFYSA-N	1	1	290.407	2.086	40	0		CEABMO
CC[N@H+](Cc1ccccc1)C[C@H]1CCC[NH+](CC(=O)[O-])C1	ZINC000079416106	363598474	/nfs/dbraw/zinc/59/84/74/363598474.db2.gz	WOFLSSMFJFPPCE-MRXNPFEDSA-N	1	1	290.407	2.305	40	0		CEABMO
CC[NH+](Cc1ccccc1)C[C@H]1CCC[N@H+](CC(=O)[O-])C1	ZINC000079416106	363598477	/nfs/dbraw/zinc/59/84/77/363598477.db2.gz	WOFLSSMFJFPPCE-MRXNPFEDSA-N	1	1	290.407	2.305	40	0		CEABMO
CC[NH+](Cc1ccccc1)C[C@H]1CCC[N@@H+](CC(=O)[O-])C1	ZINC000079416106	363598482	/nfs/dbraw/zinc/59/84/82/363598482.db2.gz	WOFLSSMFJFPPCE-MRXNPFEDSA-N	1	1	290.407	2.305	40	0		CEABMO
O[C@@H]1CCC[N@H+](Cc2cc(Br)cs2)C1	ZINC000000200666	361144173	/nfs/dbraw/zinc/14/41/73/361144173.db2.gz	BNRKCYBLYMEXOX-SECBINFHSA-N	1	1	276.199	2.467	40	0		CEABMO
O[C@@H]1CCC[N@@H+](Cc2cc(Br)cs2)C1	ZINC000000200666	361144178	/nfs/dbraw/zinc/14/41/78/361144178.db2.gz	BNRKCYBLYMEXOX-SECBINFHSA-N	1	1	276.199	2.467	40	0		CEABMO
CN(C)[PH+](CCPc1ccccc1)N(C)C	ZINC000016957307	361499855	/nfs/dbraw/zinc/49/98/55/361499855.db2.gz	ZTGNALXWFMOCFA-UHFFFAOYSA-N	1	1	256.270	2.426	40	0		CEABMO
c1cncc(C[N@H+]2CCC[C@H](c3[nH]nc4nccnc43)C2)c1	ZINC000019339045	361527674	/nfs/dbraw/zinc/52/76/74/361527674.db2.gz	JHSJWLYRGHNTAQ-ZDUSSCGKSA-N	1	1	294.362	2.128	40	0		CEABMO
COc1ccc(CN2C[C@H]3CCC[N@H+]3C[C@H]2C)c(OC)c1	ZINC000019575122	361543927	/nfs/dbraw/zinc/54/39/27/361543927.db2.gz	FADZAKJCSKJSIQ-UKRRQHHQSA-N	1	1	290.407	2.372	40	0		CEABMO
CCOC(=O)/C=C\c1c[nH+]cc(Br)c1N	ZINC000029786660	361690398	/nfs/dbraw/zinc/69/03/98/361690398.db2.gz	KRCHHJLLXKLSBJ-ARJAWSKDSA-N	1	1	271.114	2.003	40	0		CEABMO
COC(=O)[C@@H]([NH3+])CSCSCc1ccccc1	ZINC000031947106	361723157	/nfs/dbraw/zinc/72/31/57/361723157.db2.gz	JKQLAVUXTLXBIB-NSHDSACASA-N	1	1	271.407	2.111	40	0		CEABMO
CO[C@@H]1CC[N@@H+](Cc2cnn(C)c2)[C@H]1Cc1ccccc1	ZINC000096200053	364408704	/nfs/dbraw/zinc/40/87/04/364408704.db2.gz	NCUFDGSMLJRIFD-DLBZAZTESA-N	1	1	285.391	2.252	40	0		CEABMO
C[N@H+]1CC[C@@]2(C1)CCC[C@@H](CNC(=O)c1ccccc1)O2	ZINC000096207694	364410150	/nfs/dbraw/zinc/41/01/50/364410150.db2.gz	DNJQBMXPRMQFSS-DOTOQJQBSA-N	1	1	288.391	2.060	40	0		CEABMO
Cc1ncnc2c1CC[N@@H+](Cc1cccs1)CC2	ZINC000096254944	364419151	/nfs/dbraw/zinc/41/91/51/364419151.db2.gz	XFMXEHOLUAITPR-UHFFFAOYSA-N	1	1	259.378	2.447	40	0		CEABMO
CN1c2cccnc2C[N@H+](Cc2ccccc2)CC[C@H]1CO	ZINC000225495639	370299683	/nfs/dbraw/zinc/29/96/83/370299683.db2.gz	AOYPNWIFLQUSQY-INIZCTEOSA-N	1	1	297.402	2.285	40	0	biogenic,in-vitro	CEABMO
FC(F)Cn1ccc(C[NH2+]Cc2ccccc2)n1	ZINC000256054216	190005119	/nfs/dbraw/zinc/00/51/19/190005119.db2.gz	VMCGNFGBUYCTIQ-UHFFFAOYSA-N	1	1	251.280	2.438	40	0		CEABMO
CC(C)n1nc(C2CC2)cc1C[NH2+]Cc1cnn(C)c1	ZINC000256053134	190004561	/nfs/dbraw/zinc/00/45/61/190004561.db2.gz	QDVIDUBEICPZQN-UHFFFAOYSA-N	1	1	273.384	2.365	40	0		CEABMO
CCCn1nc(C)cc1C[NH2+]Cc1cnn(CCF)c1	ZINC000256053194	190004612	/nfs/dbraw/zinc/00/46/12/190004612.db2.gz	QLYLCTXOTVJYKE-UHFFFAOYSA-N	1	1	279.363	2.057	40	0		CEABMO
Cc1n[nH]cc1C[N@@H+]1CCCC[C@H]1c1ccn2ccnc2n1	ZINC000257230834	190016138	/nfs/dbraw/zinc/01/61/38/190016138.db2.gz	GECYKIQTOMHNBJ-HNNXBMFYSA-N	1	1	296.378	2.488	40	0		CEABMO
Cc1n[nH]cc1C[N@H+]1CCCC[C@H]1c1ccn2ccnc2n1	ZINC000257230834	190016139	/nfs/dbraw/zinc/01/61/39/190016139.db2.gz	GECYKIQTOMHNBJ-HNNXBMFYSA-N	1	1	296.378	2.488	40	0		CEABMO
CNc1ncccc1C[N@@H+]1CCC[C@@H]1c1ccncn1	ZINC000257219878	190014257	/nfs/dbraw/zinc/01/42/57/190014257.db2.gz	DIPLCJQTGSKYLJ-CQSZACIVSA-N	1	1	269.352	2.250	40	0		CEABMO
CNc1ncccc1C[N@H+]1CCC[C@@H]1c1ccncn1	ZINC000257219878	190014258	/nfs/dbraw/zinc/01/42/58/190014258.db2.gz	DIPLCJQTGSKYLJ-CQSZACIVSA-N	1	1	269.352	2.250	40	0		CEABMO
CN(C)Cc1cncc([C@@H]2CCC[N@H+]2CC2CC2)n1	ZINC000257262424	190021992	/nfs/dbraw/zinc/02/19/92/190021992.db2.gz	LLIRCDJYKSUIDU-HNNXBMFYSA-N	1	1	260.385	2.085	40	0		CEABMO
Cc1ccnc([C@@H]2CC[N@@H+](CC3CCOCC3)C2)n1	ZINC000257276560	190025228	/nfs/dbraw/zinc/02/52/28/190025228.db2.gz	NUHCJVSQMLFSIO-CQSZACIVSA-N	1	1	261.369	2.001	40	0		CEABMO
CC(=O)NCc1cc([C@@H]2CCC[N@@H+]2C(C)C)ccn1	ZINC000257284343	190026436	/nfs/dbraw/zinc/02/64/36/190026436.db2.gz	PCHGPFRHCHSVDU-HNNXBMFYSA-N	1	1	261.369	2.263	40	0		CEABMO
Cc1nccc(CN2CC[N@H+](C)[C@@H](c3ccccc3)C2)n1	ZINC000257284916	190027011	/nfs/dbraw/zinc/02/70/11/190027011.db2.gz	PEVKAHAWXKZGSN-QGZVFWFLSA-N	1	1	282.391	2.274	40	0		CEABMO
Cc1nc(N)cc([C@H]2CCC[N@H+]2CCC(F)(F)F)n1	ZINC000257301132	190030324	/nfs/dbraw/zinc/03/03/24/190030324.db2.gz	RXCQMJKKHUHWJN-SNVBAGLBSA-N	1	1	274.290	2.457	40	0		CEABMO
C[N@@H+]1Cc2cccn2[C@H](COCc2ccncc2)C1	ZINC000306131538	376540222	/nfs/dbraw/zinc/54/02/22/376540222.db2.gz	KICUCZIDYQLQGS-HNNXBMFYSA-N	1	1	257.337	2.086	40	0		CEABMO
COc1ccc(CC[NH2+][C@H]2CCCC[C@@H]2N)cc1OC	ZINC000218854343	394457610	/nfs/dbraw/zinc/45/76/10/394457610.db2.gz	VYLYNSDJXFXCBX-KBPBESRZSA-N	1	1	278.396	2.106	40	0		CEABMO
CC[NH+](CC)[C@@]1([C@@H](CN)CO)C[C@H]2CC[C@]1(C)C2(C)C	ZINC000072210467	394592335	/nfs/dbraw/zinc/59/23/35/394592335.db2.gz	MYMMFPISRPMSER-YALNPMBYSA-N	1	1	282.472	2.480	40	0		CEABMO
CCOC(=O)[C@H]([NH3+])[C@H](Nc1ccc(OC)cc1)C(C)C	ZINC000072210543	394592383	/nfs/dbraw/zinc/59/23/83/394592383.db2.gz	NYBCONNMWWWMLE-ZIAGYGMSSA-N	1	1	280.368	2.022	40	0		CEABMO
NNc1[nH+]cnc(-c2ccccc2)c1Br	ZINC000071256293	394587930	/nfs/dbraw/zinc/58/79/30/394587930.db2.gz	HHGQVLSAPPQSEB-UHFFFAOYSA-N	1	1	265.114	2.192	40	0		CEABMO
COc1ccc(N2C(=O)[C@H]([NH3+])[C@H]2c2cccc(OC)c2)cc1	ZINC000072227160	394595370	/nfs/dbraw/zinc/59/53/70/394595370.db2.gz	MVYYIMXSSCWNDH-HZPDHXFCSA-N	1	1	298.342	2.119	40	0		CEABMO
COc1ccc([C@H]2[C@H]([NH3+])C(=O)N2c2ccccc2)cc1OC	ZINC000072227343	394595409	/nfs/dbraw/zinc/59/54/09/394595409.db2.gz	VEIVVGZNCWAKLY-HOTGVXAUSA-N	1	1	298.342	2.119	40	0		CEABMO
COc1ccc([C@@H]2[C@H]([NH3+])C(=O)N2c2ccc(F)cc2)cc1	ZINC000072227194	394595472	/nfs/dbraw/zinc/59/54/72/394595472.db2.gz	VBNMIFZYFRVQMV-LSDHHAIUSA-N	1	1	286.306	2.250	40	0		CEABMO
COc1cccc([C@H]2[C@@H]([NH3+])C(=O)N2c2cccc(OC)c2)c1	ZINC000072227741	394596193	/nfs/dbraw/zinc/59/61/93/394596193.db2.gz	AHZUWXRMCSFCAV-CVEARBPZSA-N	1	1	298.342	2.119	40	0		CEABMO
COc1ccc([C@H]2C[C@@H](C)[N@H+]([C@@H]3CCOC3=O)C2)cc1	ZINC000076393307	394617426	/nfs/dbraw/zinc/61/74/26/394617426.db2.gz	MMFOAHXNTPHLHP-OSAQELSMSA-N	1	1	275.348	2.189	40	0		CEABMO
CCOc1cc([C@H]([NH3+])c2nnc(C3CC3)[nH]2)ccc1OC	ZINC000095534446	394673533	/nfs/dbraw/zinc/67/35/33/394673533.db2.gz	MKTOOJGDMXQLLG-ZDUSSCGKSA-N	1	1	288.351	2.138	40	0		CEABMO
CCO[C@@H]1CC[N@@H+](C[C@H]2CCOC2)[C@@H]1Cc1cccnc1	ZINC000096069932	394675585	/nfs/dbraw/zinc/67/55/85/394675585.db2.gz	BUVGIZXXMFFHGR-BRWVUGGUSA-N	1	1	290.407	2.140	40	0		CEABMO
COC[C@@H]1C[N@H+](Cc2ccc(C)o2)Cc2cn(C)nc21	ZINC000096059808	394676180	/nfs/dbraw/zinc/67/61/80/394676180.db2.gz	LJCQNZIKDFKURA-ZDUSSCGKSA-N	1	1	275.352	2.067	40	0		CEABMO
COC[C@@H]1C[N@@H+](Cc2ccc(C)o2)Cc2cn(C)nc21	ZINC000096059808	394676183	/nfs/dbraw/zinc/67/61/83/394676183.db2.gz	LJCQNZIKDFKURA-ZDUSSCGKSA-N	1	1	275.352	2.067	40	0		CEABMO
COCCCNC(=O)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1	ZINC000038833024	174157286	/nfs/dbraw/zinc/15/72/86/174157286.db2.gz	NQTXEIMQRBVCKY-MRXNPFEDSA-N	1	1	290.407	2.051	40	0		CEABMO
CNc1cccc([C@@H]2CCC[N@@H+](Cc3cnn(C)c3)C2)n1	ZINC000072364260	176378753	/nfs/dbraw/zinc/37/87/53/176378753.db2.gz	QIYLVHNOCCOPRD-CQSZACIVSA-N	1	1	285.395	2.236	40	0		CEABMO
CNc1ncccc1C[N@H+]1CCC[C@H](c2cnccn2)C1	ZINC000072386204	176391634	/nfs/dbraw/zinc/39/16/34/176391634.db2.gz	XLBFYMMUMRQEEQ-ZDUSSCGKSA-N	1	1	283.379	2.293	40	0		CEABMO
Nc1c(-c2ccc3c(c2)OCO3)[nH+]c2ccccn21	ZINC000006740866	274963754	/nfs/dbraw/zinc/96/37/54/274963754.db2.gz	UJFFWQWRBYMLAG-UHFFFAOYSA-N	1	1	253.261	2.312	40	0		CEABMO
Brc1ccc2c(c1)OCC[C@@]21COCC[NH2+]1	ZINC000306145841	275371676	/nfs/dbraw/zinc/37/16/76/275371676.db2.gz	SBCAHBAJYVKWNL-GFCCVEGCSA-N	1	1	284.153	2.047	40	0		CEABMO
CC(C)(C)OC(=O)NC1CCN(c2ccc(N)c[nH+]2)CC1	ZINC000067800688	534871837	/nfs/dbraw/zinc/87/18/37/534871837.db2.gz	PEPDLOXDPHPNSA-UHFFFAOYSA-N	1	1	292.383	2.157	40	0		CEABMO
CCOC(=O)c1cnn(C)c1C[N@@H+](C)C1CCCCC1	ZINC000132191728	528311281	/nfs/dbraw/zinc/31/12/81/528311281.db2.gz	CNFIEMJRBNPMSR-UHFFFAOYSA-N	1	1	279.384	2.361	40	0		CEABMO
c1cn([C@@H]2CO[C@@]3(C2)CCC[N@H+](Cc2ccccn2)C3)cn1	ZINC000096048563	185072537	/nfs/dbraw/zinc/07/25/37/185072537.db2.gz	DCZVGCNCDNMRRP-DLBZAZTESA-N	1	1	298.390	2.274	40	0		CEABMO
Cn1cc(CN2CC[C@@]3(C2)CCC[N@@H+](CC2CC2)C3)cn1	ZINC000096046933	185073069	/nfs/dbraw/zinc/07/30/69/185073069.db2.gz	MGCGQGONTAEEHU-KRWDZBQOSA-N	1	1	288.439	2.118	40	0		CEABMO
O=C1C[C@@]2(CC[N@@H+](Cc3ccoc3)C2)CN1c1ccccn1	ZINC000096050788	185074160	/nfs/dbraw/zinc/07/41/60/185074160.db2.gz	UULUUCMSLMACPF-QGZVFWFLSA-N	1	1	297.358	2.304	40	0		CEABMO
O=C(c1ccoc1)N1CCC2(C[NH+](Cc3cccnc3)C2)C1	ZINC000096070910	185086954	/nfs/dbraw/zinc/08/69/54/185086954.db2.gz	TXDOJEUQQSAHKR-UHFFFAOYSA-N	1	1	297.358	2.023	40	0		CEABMO
CC[N@@H+]1CCOCC12CCN(Cc1cccc(C)n1)CC2	ZINC000096074593	185088311	/nfs/dbraw/zinc/08/83/11/185088311.db2.gz	WHDOLXDGBKNDDY-UHFFFAOYSA-N	1	1	289.423	2.077	40	0		CEABMO
CC[N@H+]1CCOCC12CCN(Cc1cccc(C)n1)CC2	ZINC000096074593	185088312	/nfs/dbraw/zinc/08/83/12/185088312.db2.gz	WHDOLXDGBKNDDY-UHFFFAOYSA-N	1	1	289.423	2.077	40	0		CEABMO
c1ccc(COC[C@]23COC[C@H]2C[N@H+](C2CCC2)C3)nc1	ZINC000096109030	185100294	/nfs/dbraw/zinc/10/02/94/185100294.db2.gz	ABYKMZWXEZRMRZ-PBHICJAKSA-N	1	1	288.391	2.099	40	0		CEABMO
CN1CCC([N@H+]2CC[C@H](c3nc4ccccc4[nH]3)C2)CC1	ZINC000049169065	362342727	/nfs/dbraw/zinc/34/27/27/362342727.db2.gz	PPINVMYDOUKZRM-ZDUSSCGKSA-N	1	1	284.407	2.446	40	0	biogenic,in-vitro	CEABMO
Cc1ncccc1C[N@H+]1CC[C@](O)(COc2ccccc2)C1	ZINC000585274253	345009262	/nfs/dbraw/zinc/00/92/62/345009262.db2.gz	HUUMIAVVSUBYHQ-GOSISDBHSA-N	1	1	298.386	2.406	40	0		CEABMO
CC[N@H+]1CCN[C@H](c2ccc(Br)cc2)C1	ZINC000056894789	362564614	/nfs/dbraw/zinc/56/46/14/362564614.db2.gz	XEEGRBYLTRRLJW-LBPRGKRZSA-N	1	1	269.186	2.415	40	0		CEABMO
CCN1CC[NH2+][C@H](c2ccc(Br)cc2)C1	ZINC000056894789	362564620	/nfs/dbraw/zinc/56/46/20/362564620.db2.gz	XEEGRBYLTRRLJW-LBPRGKRZSA-N	1	1	269.186	2.415	40	0		CEABMO
COc1ccccc1C[N@H+]1CC[C@@]2(CCN(C(C)=O)C2)C1	ZINC000063527620	362768346	/nfs/dbraw/zinc/76/83/46/362768346.db2.gz	OOVFTNZHNZQELC-QGZVFWFLSA-N	1	1	288.391	2.140	40	0		CEABMO
COC[C@@]12CCCO[C@@H]1CC[N@@H+](Cc1scnc1C)C2	ZINC000107771332	186189720	/nfs/dbraw/zinc/18/97/20/186189720.db2.gz	MPWGFTVATGFOKA-CABCVRRESA-N	1	1	296.436	2.469	40	0		CEABMO
Brc1ccc([C@H]2C[C@@H]2C[NH+]2CCNCC2)cc1	ZINC000575424321	366284202	/nfs/dbraw/zinc/28/42/02/366284202.db2.gz	YWNHAKLRYRIPIH-TZMCWYRMSA-N	1	1	295.224	2.458	40	0		CEABMO
C[C@H](NC(=O)[C@H]1CCC[N@@H+](C)C1)c1ccc(F)cc1	ZINC000081229410	363706613	/nfs/dbraw/zinc/70/66/13/363706613.db2.gz	NFDYWPSMUKIVND-AAEUAGOBSA-N	1	1	264.344	2.345	40	0		CEABMO
C=Cn1ncc(C[N@H+]2CC[C@]3(O)CCCC[C@@H]3C2)c1C	ZINC000012146535	361374584	/nfs/dbraw/zinc/37/45/84/361374584.db2.gz	XKJBIGFPYFIZLS-HZPDHXFCSA-N	1	1	275.396	2.419	40	0		CEABMO
Cc1nc([C@@H]2CC[N@@H+](Cc3cccc(F)c3)C2)cc(=O)[nH]1	ZINC000019285255	361525180	/nfs/dbraw/zinc/52/51/80/361525180.db2.gz	QFQXWYAXZGLQQN-CYBMUJFWSA-N	1	1	287.338	2.207	40	0		CEABMO
Cc1c2cc(F)ccc2[nH]c1C(=O)N[C@@H]1CCC[N@H+](C)C1	ZINC000019565401	361542846	/nfs/dbraw/zinc/54/28/46/361542846.db2.gz	VXIPIJWUFSKVMN-GFCCVEGCSA-N	1	1	289.354	2.439	40	0		CEABMO
C[N@H+]1CCC[C@H](NC(=O)CCCOc2ccccc2F)C1	ZINC000019588509	361544952	/nfs/dbraw/zinc/54/49/52/361544952.db2.gz	HJRIFPPCIXSQMB-ZDUSSCGKSA-N	1	1	294.370	2.195	40	0		CEABMO
c1ccc(N2CCN(C3[C@@H]4CCC[C@H]3C[NH2+]C4)CC2)cc1	ZINC000019372972	361529740	/nfs/dbraw/zinc/52/97/40/361529740.db2.gz	ARXWSAZGRNWATQ-BYICEURKSA-N	1	1	285.435	2.197	40	0		CEABMO
Cc1ccc(C[N@@H+]2C[C@H]3CN(C(=O)C4CC4)C[C@H]3C2)cc1	ZINC000096161740	364404726	/nfs/dbraw/zinc/40/47/26/364404726.db2.gz	AKDJCSKHGKODCI-CALCHBBNSA-N	1	1	284.403	2.295	40	0		CEABMO
CC(C)[C@H]1CO[C@@]2(CC[N@@H+](Cc3cnn(C)c3)C2)C1	ZINC000096218249	364411931	/nfs/dbraw/zinc/41/19/31/364411931.db2.gz	ODYKVAIZCSTCFV-CABCVRRESA-N	1	1	263.385	2.057	40	0		CEABMO
c1ccc(N2CCC[C@@]3(CC[N@H+]([C@@H]4CCOC4)C3)C2)nc1	ZINC000096216796	364412025	/nfs/dbraw/zinc/41/20/25/364412025.db2.gz	XHXQCHGEJUTSKP-WBVHZDCISA-N	1	1	287.407	2.163	40	0		CEABMO
Cc1nnc([C@H]2CO[C@@H]3C[N@@H+](CC4CCCCC4)C[C@H]23)o1	ZINC000096216486	364412397	/nfs/dbraw/zinc/41/23/97/364412397.db2.gz	XHMZTIMNILVKLS-QLFBSQMISA-N	1	1	291.395	2.373	40	0		CEABMO
Cc1ccc2c(c1)C1(C[C@H]2N2CCOCC2)CC[NH2+]CC1	ZINC000096241752	364415780	/nfs/dbraw/zinc/41/57/80/364415780.db2.gz	OICVZJXFMFNBDD-QGZVFWFLSA-N	1	1	286.419	2.393	40	0		CEABMO
CC(C)[N@@H+](C)[C@H]1c2ccccc2[C@@H]2CN(CCO)C[C@@H]21	ZINC000096251701	364417284	/nfs/dbraw/zinc/41/72/84/364417284.db2.gz	YXCAZWHBGHFHAV-ULQDDVLXSA-N	1	1	274.408	2.089	40	0		CEABMO
CCc1ncnc2c1CC[N@@H+](Cc1ccncc1)CC2	ZINC000096255022	364418760	/nfs/dbraw/zinc/41/87/60/364418760.db2.gz	RZWCEBVMGUNAPD-UHFFFAOYSA-N	1	1	268.364	2.035	40	0		CEABMO
NC(=O)C1CC[NH+](Cc2ccc(Cl)cc2F)CC1	ZINC000188950867	369434227	/nfs/dbraw/zinc/43/42/27/369434227.db2.gz	WQWCZIIRZLCQKM-UHFFFAOYSA-N	1	1	270.735	2.176	40	0		CEABMO
C(O[C@H]1CCOC2(C[NH+](C3CCC3)C2)C1)C1CCOCC1	ZINC000247972587	371152047	/nfs/dbraw/zinc/15/20/47/371152047.db2.gz	VDKFTZHWPDZZHZ-INIZCTEOSA-N	1	1	295.423	2.216	40	0		CEABMO
c1cc2n(c1)C[C@H](Oc1ncccn1)C[N@H+](C1CCC1)C2	ZINC000253588370	371530736	/nfs/dbraw/zinc/53/07/36/371530736.db2.gz	ABYAVUPSOTWCIM-HNNXBMFYSA-N	1	1	284.363	2.094	40	0		CEABMO
Cc1cncc(COCC[C@@H]2CCOC3(C[NH+](C)C3)C2)c1	ZINC000253602670	371532630	/nfs/dbraw/zinc/53/26/30/371532630.db2.gz	DPEQWTHAGWMGDC-OAHLLOKOSA-N	1	1	290.407	2.408	40	0		CEABMO
Cc1nn(C)c(F)c1C[NH2+]Cc1cc(C(C)C)nn1C	ZINC000256051200	190003724	/nfs/dbraw/zinc/00/37/24/190003724.db2.gz	ICKZTIWZQHNSMW-UHFFFAOYSA-N	1	1	279.363	2.014	40	0		CEABMO
Cc1c[nH]nc1C[C@@H]1CCC[N@H+](Cc2cnn(C)c2C)C1	ZINC000257201153	190010623	/nfs/dbraw/zinc/01/06/23/190010623.db2.gz	AGNOWOWNIJNTCS-AWEZNQCLSA-N	1	1	287.411	2.215	40	0		CEABMO
C[N@H+]1CCC[C@@H](Cc2cncc(-c3ncco3)n2)C1	ZINC000257200832	190011097	/nfs/dbraw/zinc/01/10/97/190011097.db2.gz	AFBJBNIGFMZBBI-NSHDSACASA-N	1	1	258.325	2.016	40	0		CEABMO
CO[C@H]1C[N@@H+](Cc2ccccc2F)C[C@@]12CCCO2	ZINC000257204499	190011223	/nfs/dbraw/zinc/01/12/23/190011223.db2.gz	AUXIPTNMPPWUKI-GJZGRUSLSA-N	1	1	265.328	2.206	40	0		CEABMO
Cc1c[nH]c([C@H]2CCC[N@@H+](Cc3cccnc3)C2)n1	ZINC000257211445	190012000	/nfs/dbraw/zinc/01/20/00/190012000.db2.gz	BYWRYLPVNJFTLE-AWEZNQCLSA-N	1	1	256.353	2.493	40	0		CEABMO
Cc1cc(-c2cccc(C[C@@H]3CC[N@H+](C)C3)n2)n[nH]1	ZINC000257228238	190015937	/nfs/dbraw/zinc/01/59/37/190015937.db2.gz	FSYXVKKUTKPCQJ-LBPRGKRZSA-N	1	1	256.353	2.274	40	0		CEABMO
CNc1nccnc1C[C@@H]1CCC[N@@H+](Cc2cccn2C)C1	ZINC000257233160	190016727	/nfs/dbraw/zinc/01/67/27/190016727.db2.gz	GOBNKKCHBHQBCW-AWEZNQCLSA-N	1	1	299.422	2.312	40	0		CEABMO
CCCn1nccc1-c1cnc(C[C@H]2CC[N@@H+](C)C2)cn1	ZINC000257221302	190014758	/nfs/dbraw/zinc/01/47/58/190014758.db2.gz	DOJMZVLOJYEMNL-CYBMUJFWSA-N	1	1	285.395	2.244	40	0		CEABMO
c1ncc(C[N@H+]2CCC[C@H](c3ccc4c[nH]nc4n3)C2)[nH]1	ZINC000257221438	190014924	/nfs/dbraw/zinc/01/49/24/190014924.db2.gz	DPAAJBHTMBUVFJ-LBPRGKRZSA-N	1	1	282.351	2.061	40	0		CEABMO
c1nc(C[N@@H+]2CCC[C@H](c3ccc4c[nH]nc4n3)C2)c[nH]1	ZINC000257221438	190014925	/nfs/dbraw/zinc/01/49/25/190014925.db2.gz	DPAAJBHTMBUVFJ-LBPRGKRZSA-N	1	1	282.351	2.061	40	0		CEABMO
c1nc(C[N@H+]2CCC[C@H](c3ccc4c[nH]nc4n3)C2)c[nH]1	ZINC000257221438	190014926	/nfs/dbraw/zinc/01/49/26/190014926.db2.gz	DPAAJBHTMBUVFJ-LBPRGKRZSA-N	1	1	282.351	2.061	40	0		CEABMO
C[C@]1(O)C[N@H+](C2CCOCC2)CC[C@@H]1Oc1ccccc1	ZINC000257236844	190017495	/nfs/dbraw/zinc/01/74/95/190017495.db2.gz	HEABEMRLXCWIBB-IRXDYDNUSA-N	1	1	291.391	2.070	40	0		CEABMO
CCn1cc(C[N@H+]2CCC[C@@H](Cc3n[nH]cc3C)C2)cn1	ZINC000257242982	190018698	/nfs/dbraw/zinc/01/86/98/190018698.db2.gz	IFBLANPSVXYIEP-AWEZNQCLSA-N	1	1	287.411	2.389	40	0		CEABMO
Cc1c(CN2CC[N@@H+](C)[C@H](c3ccccc3)C2)cnn1C	ZINC000257265372	190023306	/nfs/dbraw/zinc/02/33/06/190023306.db2.gz	LYJYESWOWCELET-KRWDZBQOSA-N	1	1	284.407	2.217	40	0		CEABMO
Cc1c(C[N@@H+]2CCN(C)[C@H](c3ccccc3)C2)cnn1C	ZINC000257265372	190023307	/nfs/dbraw/zinc/02/33/07/190023307.db2.gz	LYJYESWOWCELET-KRWDZBQOSA-N	1	1	284.407	2.217	40	0		CEABMO
Cc1c(C[N@H+]2CCN(C)[C@H](c3ccccc3)C2)cnn1C	ZINC000257265372	190023308	/nfs/dbraw/zinc/02/33/08/190023308.db2.gz	LYJYESWOWCELET-KRWDZBQOSA-N	1	1	284.407	2.217	40	0		CEABMO
Cc1cn(C)c([C@H]2CCC[N@@H+](Cc3[nH]cnc3C)C2)n1	ZINC000257272262	190024054	/nfs/dbraw/zinc/02/40/54/190024054.db2.gz	NBRRDXRGHAQQFD-ZDUSSCGKSA-N	1	1	273.384	2.140	40	0		CEABMO
COc1ccc(C[C@H]2CC[C@@H]3C[N@@H+](CCO)C[C@H]23)cc1	ZINC000257287912	190027299	/nfs/dbraw/zinc/02/72/99/190027299.db2.gz	PRYKQDDSFRLHOW-BFYDXBDKSA-N	1	1	275.392	2.188	40	0		CEABMO
Cc1nc([C@H]2CCCC[NH2+]2)ncc1C(=O)N1CCCCC1	ZINC000257338267	190036025	/nfs/dbraw/zinc/03/60/25/190036025.db2.gz	YWRRBGJLSJUSAA-CQSZACIVSA-N	1	1	288.395	2.226	40	0		CEABMO
COc1ccc([C@@H]([NH3+])c2nnc(CC(C)C)[nH]2)cc1OC	ZINC000095533890	256745347	/nfs/dbraw/zinc/74/53/47/256745347.db2.gz	AUMZLLDZEPWCMY-CQSZACIVSA-N	1	1	290.367	2.069	40	0		CEABMO
CC(C)[N@H+]1C[C@@H]2CC[C@H](C1)C2C(=O)NCc1ccco1	ZINC000096252352	256834786	/nfs/dbraw/zinc/83/47/86/256834786.db2.gz	RLWHKKMEDXGKQJ-NNQSOWQGSA-N	1	1	276.380	2.262	40	0		CEABMO
Cc1nc(N2CCN(C)CC2)ccc1[C@H]([NH3+])c1ccccc1	ZINC000072224656	394594444	/nfs/dbraw/zinc/59/44/44/394594444.db2.gz	KBPQFABCQAIEIG-GOSISDBHSA-N	1	1	296.418	2.190	40	0		CEABMO
CC1CC[NH+](c2ccc(N)cc2-n2cnnc2)CC1	ZINC000070461816	394586584	/nfs/dbraw/zinc/58/65/84/394586584.db2.gz	KQVSEFVMLAPLSU-UHFFFAOYSA-N	1	1	257.341	2.086	40	0		CEABMO
COc1cccc([C@@H]2[C@H]([NH3+])C(=O)N2c2ccccc2)c1	ZINC000072227358	394595543	/nfs/dbraw/zinc/59/55/43/394595543.db2.gz	JHEVKFFYJWGGPY-LSDHHAIUSA-N	1	1	268.316	2.110	40	0		CEABMO
CC(=O)N1CCC[C@H]2[N@H+](Cc3coc(C)n3)CCC[C@@]21C	ZINC000257246410	394595612	/nfs/dbraw/zinc/59/56/12/394595612.db2.gz	ITZSUCCGOYRVSV-CVEARBPZSA-N	1	1	291.395	2.348	40	0		CEABMO
CC(=O)N1CCC[C@H]2[N@@H+](Cc3coc(C)n3)CCC[C@@]21C	ZINC000257246410	394595616	/nfs/dbraw/zinc/59/56/16/394595616.db2.gz	ITZSUCCGOYRVSV-CVEARBPZSA-N	1	1	291.395	2.348	40	0		CEABMO
Cc1ccc([C@@H]([NH3+])c2nc(-c3ccccn3)n[nH]2)cc1	ZINC000095534107	394672831	/nfs/dbraw/zinc/67/28/31/394672831.db2.gz	GPIUTYDPJWUIEB-CYBMUJFWSA-N	1	1	265.320	2.223	40	0		CEABMO
CCOc1cc([C@@H]([NH3+])c2nnc(C3CC3)[nH]2)ccc1OC	ZINC000095534447	394673368	/nfs/dbraw/zinc/67/33/68/394673368.db2.gz	MKTOOJGDMXQLLG-CYBMUJFWSA-N	1	1	288.351	2.138	40	0		CEABMO
Cc1ccc(C(=O)N2CC[C@]3(CC[N@H+]3CC3CC3)C2)cn1	ZINC000096076001	394675543	/nfs/dbraw/zinc/67/55/43/394675543.db2.gz	SNTCGSQPTBGBHB-KRWDZBQOSA-N	1	1	285.391	2.090	40	0		CEABMO
C[N@@H+]1[C@@H]2CC[C@H]1CC(OC(=O)c1ccccc1O)C2	ZINC000004773087	170014510	/nfs/dbraw/zinc/01/45/10/170014510.db2.gz	LOUPXMATWIQUJK-FOSCPWQOSA-N	1	1	261.321	2.174	40	0		CEABMO
C[N@H+]1CCC[C@@H](CNC(=S)NC2CCCCC2)C1	ZINC000009876491	170388353	/nfs/dbraw/zinc/38/83/53/170388353.db2.gz	BDYLCLLFPJYFFA-LBPRGKRZSA-N	1	1	269.458	2.125	40	0		CEABMO
C[C@@H]1CCCC[N@H+]1C[C@@H](O)COc1ccc(F)cc1	ZINC000026781222	171499264	/nfs/dbraw/zinc/49/92/64/171499264.db2.gz	WWQSPLICWQFGRY-TZMCWYRMSA-N	1	1	267.344	2.440	40	0		CEABMO
O[C@H]1CC[N@H+](Cc2ccccc2Br)C1	ZINC000038538695	174145408	/nfs/dbraw/zinc/14/54/08/174145408.db2.gz	HVLQYTLXQYMTJA-JTQLQIEISA-N	1	1	256.143	2.016	40	0		CEABMO
O[C@H]1CC[N@@H+](Cc2ccccc2Br)C1	ZINC000038538695	174145409	/nfs/dbraw/zinc/14/54/09/174145409.db2.gz	HVLQYTLXQYMTJA-JTQLQIEISA-N	1	1	256.143	2.016	40	0		CEABMO
CC(C)C(=O)NCCC[N@H+]1CCc2ccccc2C1	ZINC000046239343	175395231	/nfs/dbraw/zinc/39/52/31/175395231.db2.gz	JRURFABZADYSNM-UHFFFAOYSA-N	1	1	260.381	2.207	40	0		CEABMO
C[C@H]1C[N@H+]2C[C@H](O)C[C@H]2CN1Cc1cccc2ccccc21	ZINC000072324766	176369550	/nfs/dbraw/zinc/36/95/50/176369550.db2.gz	ZGBDGAFMTAUITL-JCGIZDLHSA-N	1	1	296.414	2.479	40	0		CEABMO
COC(=O)c1ccc(CN2C[C@@H]3CCC[N@H+]3C[C@@H]2C)cc1	ZINC000072324457	176369914	/nfs/dbraw/zinc/36/99/14/176369914.db2.gz	XIPUQLOHVWTLQE-BBRMVZONSA-N	1	1	288.391	2.142	40	0		CEABMO
c1c[nH]c(C[NH+]2CCC(Cc3ccccn3)CC2)n1	ZINC000072356717	176375943	/nfs/dbraw/zinc/37/59/43/176375943.db2.gz	FNNMGUYJSINNOD-UHFFFAOYSA-N	1	1	256.353	2.259	40	0		CEABMO
OCC[N@H+]1CCC[C@H]1c1ccnc(Nc2ccccn2)c1	ZINC000072367766	176382788	/nfs/dbraw/zinc/38/27/88/176382788.db2.gz	CODQHAYKTLHIDW-AWEZNQCLSA-N	1	1	284.363	2.349	40	0		CEABMO
CNc1ncccc1C[N@@H+]1CCCC[C@@H]1c1ccnc(N)n1	ZINC000072386206	176391514	/nfs/dbraw/zinc/39/15/14/176391514.db2.gz	QVBIRDPMMALNBH-CQSZACIVSA-N	1	1	298.394	2.223	40	0		CEABMO
CNc1ncccc1C[N@H+]1CCCC[C@@H]1c1ccnc(N)n1	ZINC000072386206	176391517	/nfs/dbraw/zinc/39/15/17/176391517.db2.gz	QVBIRDPMMALNBH-CQSZACIVSA-N	1	1	298.394	2.223	40	0		CEABMO
COC[C@@H](O)C[N@H+]1C[C@H](c2ccc(F)cc2)C[C@H]1C	ZINC000077177251	177230752	/nfs/dbraw/zinc/23/07/52/177230752.db2.gz	ABCPPHYURVKKRG-KYOSRNDESA-N	1	1	267.344	2.011	40	0		CEABMO
COc1ccccc1[C@H]1CN(c2cc(C)ncn2)CC[N@@H+]1C	ZINC000257285705	274163319	/nfs/dbraw/zinc/16/33/19/274163319.db2.gz	PIJOTXCDGAMIOZ-OAHLLOKOSA-N	1	1	298.390	2.287	40	0		CEABMO
COc1ccccc1[C@H]1CN(c2cc(C)ncn2)CC[N@H+]1C	ZINC000257285705	274163321	/nfs/dbraw/zinc/16/33/21/274163321.db2.gz	PIJOTXCDGAMIOZ-OAHLLOKOSA-N	1	1	298.390	2.287	40	0		CEABMO
C[N@@H+]1CCC[C@@H](Cn2c(=O)c3ccccc3[nH]c2=S)C1	ZINC000009876579	277053861	/nfs/dbraw/zinc/05/38/61/277053861.db2.gz	QKSSWUPLNHXNGD-LLVKDONJSA-N	1	1	289.404	2.401	40	0		CEABMO
C[N@H+]1CCC[C@@H](Cn2c(=O)c3ccccc3[nH]c2=S)C1	ZINC000009876579	277053862	/nfs/dbraw/zinc/05/38/62/277053862.db2.gz	QKSSWUPLNHXNGD-LLVKDONJSA-N	1	1	289.404	2.401	40	0		CEABMO
COc1ccc(C[N@H+]2CCO[C@H]3[C@H](OC)CC[C@@H]32)cc1	ZINC000096041392	185069207	/nfs/dbraw/zinc/06/92/07/185069207.db2.gz	GHXNKDHKWHZZDB-ARFHVFGLSA-N	1	1	277.364	2.073	40	0		CEABMO
COc1ccc(C[N@@H+]2CCO[C@H]3[C@H](OC)CC[C@@H]32)cc1	ZINC000096041392	185069208	/nfs/dbraw/zinc/06/92/08/185069208.db2.gz	GHXNKDHKWHZZDB-ARFHVFGLSA-N	1	1	277.364	2.073	40	0		CEABMO
c1cncc(O[C@H]2CC[C@H]3[C@H]2OCC[N@@H+]3C2CCC2)c1	ZINC000096042144	185070383	/nfs/dbraw/zinc/07/03/83/185070383.db2.gz	LTAYJRNCKHPMIG-HRCADAONSA-N	1	1	274.364	2.245	40	0		CEABMO
c1coc(C[N@H+]2CC[C@H]3C[C@H](c4ccncn4)O[C@@H]3C2)c1	ZINC000096046109	185071133	/nfs/dbraw/zinc/07/11/33/185071133.db2.gz	BQGMDGWVORPEED-APHBMKBZSA-N	1	1	285.347	2.422	40	0		CEABMO
c1cncc(O[C@H]2CO[C@]3(C2)CCC[N@H+](CC2CC2)C3)c1	ZINC000096048280	185073119	/nfs/dbraw/zinc/07/31/19/185073119.db2.gz	ZBFMLLPEFXQEAR-SJORKVTESA-N	1	1	288.391	2.494	40	0		CEABMO
CC(C)[N@@H+](C)Cc1cnc2n1CCN(Cc1ccncc1)C2	ZINC000096061779	185082362	/nfs/dbraw/zinc/08/23/62/185082362.db2.gz	NREOCRGAOACIHT-UHFFFAOYSA-N	1	1	299.422	2.134	40	0		CEABMO
Cc1noc(C)c1C[N@@H+]1CCC[C@]2(CCCC(=O)N2C)C1	ZINC000096077019	185089089	/nfs/dbraw/zinc/08/90/89/185089089.db2.gz	KPPSIKPWOBSXPQ-MRXNPFEDSA-N	1	1	291.395	2.268	40	0		CEABMO
Cn1cc(CN2CCC[C@@]3(CC[N@@H+](CC4CC4)C3)C2)cn1	ZINC000096100150	185098159	/nfs/dbraw/zinc/09/81/59/185098159.db2.gz	ILIIEBSWRGWCIF-QGZVFWFLSA-N	1	1	288.439	2.118	40	0		CEABMO
COc1ccc(C[N@@H+]2CCC[C@]3(C[C@@H](OC)CO3)C2)cc1	ZINC000096107182	185099611	/nfs/dbraw/zinc/09/96/11/185099611.db2.gz	RQXYGPPQFBFRSS-SJORKVTESA-N	1	1	291.391	2.465	40	0		CEABMO
O=C1c2ccccc2C(=O)N1[C@@H]1CCC[N@H+]2CCCC[C@H]12	ZINC000005776232	343355245	/nfs/dbraw/zinc/35/52/45/343355245.db2.gz	KNEGFGGZBIDYHX-HUUCEWRRSA-N	1	1	284.359	2.300	40	0		CEABMO
Cc1nnc2n1[C@H]1C[N@H+](Cc3ccccc3F)C[C@H]1CC2	ZINC000019288366	282365877	/nfs/dbraw/zinc/36/58/77/282365877.db2.gz	VEEFAYMXOGETNA-HIFRSBDPSA-N	1	1	286.354	2.345	40	0		CEABMO
Cc1cccc(C[N@H+]2CC[C@](O)(COc3ccccc3)C2)n1	ZINC000585269495	345009003	/nfs/dbraw/zinc/00/90/03/345009003.db2.gz	XBVGIURQBUGSKZ-GOSISDBHSA-N	1	1	298.386	2.406	40	0		CEABMO
CC(C)(C)c1ccc(-c2n[nH]c(CN3CC[NH2+]CC3)n2)cc1	ZINC000064875469	362799047	/nfs/dbraw/zinc/79/90/47/362799047.db2.gz	WKOFFIURUMBIOX-UHFFFAOYSA-N	1	1	299.422	2.174	40	0		CEABMO
CC(C)(C)c1ccc(-c2nc(CN3CC[NH2+]CC3)n[nH]2)cc1	ZINC000064875469	362799050	/nfs/dbraw/zinc/79/90/50/362799050.db2.gz	WKOFFIURUMBIOX-UHFFFAOYSA-N	1	1	299.422	2.174	40	0		CEABMO
CC(C)(C)OC(=O)N[C@@H]1CC[N@@H+](CC2CCOCC2)C1	ZINC000067801214	362925323	/nfs/dbraw/zinc/92/53/23/362925323.db2.gz	BCTFNJAAWPWZKN-CYBMUJFWSA-N	1	1	284.400	2.012	40	0		CEABMO
CC(C)[N@@H+](CCO)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000079395098	363595115	/nfs/dbraw/zinc/59/51/15/363595115.db2.gz	ZFCBPDQQOVKMTB-KRWDZBQOSA-N	1	1	276.424	2.354	40	0		CEABMO
COc1ccccc1C[N@H+](CCCO)Cc1ccncc1	ZINC000013568166	361432342	/nfs/dbraw/zinc/43/23/42/361432342.db2.gz	BFPFRBRJRTVQFK-UHFFFAOYSA-N	1	1	286.375	2.475	40	0		CEABMO
COc1ccccc1C[N@@H+](CCCO)Cc1ccncc1	ZINC000013568166	361432347	/nfs/dbraw/zinc/43/23/47/361432347.db2.gz	BFPFRBRJRTVQFK-UHFFFAOYSA-N	1	1	286.375	2.475	40	0		CEABMO
CC(C)[N@@H+]1C[C@H](O)C[C@H]1c1nc(-c2ccc(F)cc2)no1	ZINC000015674938	361476449	/nfs/dbraw/zinc/47/64/49/361476449.db2.gz	DHEJVOCJUTVCSP-OLZOCXBDSA-N	1	1	291.326	2.392	40	0	biogenic,in-vitro	CEABMO
CC(C)[N@H+]1C[C@H](O)C[C@H]1c1nc(-c2ccc(F)cc2)no1	ZINC000015674938	361476457	/nfs/dbraw/zinc/47/64/57/361476457.db2.gz	DHEJVOCJUTVCSP-OLZOCXBDSA-N	1	1	291.326	2.392	40	0	biogenic,in-vitro	CEABMO
Cn1cnc2ccc(NC(=O)C[C@H]3CCCC[N@H+]3C)cc21	ZINC000019655673	361546746	/nfs/dbraw/zinc/54/67/46/361546746.db2.gz	BCYSBVBWIULBDZ-CYBMUJFWSA-N	1	1	286.379	2.386	40	0		CEABMO
Cc1nn(C)cc1-c1cncn1CC[N@@H+](C)C1CCCC1	ZINC000019719508	361548845	/nfs/dbraw/zinc/54/88/45/361548845.db2.gz	ARMYAOQCLYBIMZ-UHFFFAOYSA-N	1	1	287.411	2.466	40	0		CEABMO
COC[C@@H]1Cn2nccc2C[N@H+](Cc2ccc(F)cc2)C1	ZINC000096188890	364407300	/nfs/dbraw/zinc/40/73/00/364407300.db2.gz	ZVKVXYXIUUCQLD-AWEZNQCLSA-N	1	1	289.354	2.301	40	0		CEABMO
COC[C@@H]1Cn2nccc2C[N@@H+](Cc2ccc(F)cc2)C1	ZINC000096188890	364407304	/nfs/dbraw/zinc/40/73/04/364407304.db2.gz	ZVKVXYXIUUCQLD-AWEZNQCLSA-N	1	1	289.354	2.301	40	0		CEABMO
O=C1CCCC[C@H]2[C@H](CC[N@H+]2Cc2ccccc2)N1	ZINC000095951699	364394940	/nfs/dbraw/zinc/39/49/40/364394940.db2.gz	WASRQIFITMWSCC-GJZGRUSLSA-N	1	1	258.365	2.320	40	0		CEABMO
c1coc(C[N@H+]2CCc3ncnc([C@@H]4CCOC4)c3CC2)c1	ZINC000096058627	364400506	/nfs/dbraw/zinc/40/05/06/364400506.db2.gz	JKCCSEIPJVVDTP-CYBMUJFWSA-N	1	1	299.374	2.174	40	0		CEABMO
Cn1cccc1CN1CC2(C1)CC[N@@H+](Cc1cccnc1)C2	ZINC000096202501	364411359	/nfs/dbraw/zinc/41/13/59/364411359.db2.gz	YWTVOAGYUKTZOQ-UHFFFAOYSA-N	1	1	296.418	2.128	40	0		CEABMO
CN1c2ccccc2[C@]2(CC[N@@H+](CC3CCC3)C2)C1=O	ZINC000096244807	364417246	/nfs/dbraw/zinc/41/72/46/364417246.db2.gz	BFWZCPNOBWAAIT-QGZVFWFLSA-N	1	1	270.376	2.407	40	0		CEABMO
CC(C)[N@H+]1CC[C@H]2CN(C(=O)Cc3ccsc3)C[C@H]2C1	ZINC000096246086	364417258	/nfs/dbraw/zinc/41/72/58/364417258.db2.gz	AWBHWVCUBZNANU-LSDHHAIUSA-N	1	1	292.448	2.479	40	0		CEABMO
CCc1cnc(N2CCN(C)c3[nH+]c(C)ccc3C2)nc1	ZINC000096260859	364419015	/nfs/dbraw/zinc/41/90/15/364419015.db2.gz	SZAPINFNZVZPDX-UHFFFAOYSA-N	1	1	283.379	2.199	40	0		CEABMO
CCC[C@@]12CNC[C@@](CCC)(C[N@H+](CC(C)C)C1)[C@H]2O	ZINC000100795077	364550709	/nfs/dbraw/zinc/55/07/09/364550709.db2.gz	GMWSLXRQAAJTGS-BJWYYQGGSA-N	1	1	282.472	2.495	40	0		CEABMO
CCC[C@@]12CNC[C@@](CCC)(C[N@@H+](CC(C)C)C1)[C@H]2O	ZINC000100795077	364550712	/nfs/dbraw/zinc/55/07/12/364550712.db2.gz	GMWSLXRQAAJTGS-BJWYYQGGSA-N	1	1	282.472	2.495	40	0		CEABMO
CCCNC(=O)C1=NO[C@]2(C1)CCC[N@@H+](CCC(C)C)C2	ZINC000585101208	367177194	/nfs/dbraw/zinc/17/71/94/367177194.db2.gz	OBCULYIJHIEIKN-INIZCTEOSA-N	1	1	295.427	2.170	40	0		CEABMO
CCC[C@H](C)[N@H+]1CCC[C@@]2(CN(c3ncccn3)C2=O)C1	ZINC000585099695	367177490	/nfs/dbraw/zinc/17/74/90/367177490.db2.gz	YMCUZPKWOHVKKM-BBRMVZONSA-N	1	1	288.395	2.094	40	0		CEABMO
COc1ccc(OC)c2c(NCCC[NH3+])cc(C)nc12	ZINC000222691404	370257091	/nfs/dbraw/zinc/25/70/91/370257091.db2.gz	NOWYURWEOAXAQN-UHFFFAOYSA-N	1	1	275.352	2.321	40	0		CEABMO
CO[C@H]1Cn2cccc2C[N@H+](Cc2cccc(C)n2)C1	ZINC000247901448	371145832	/nfs/dbraw/zinc/14/58/32/371145832.db2.gz	ZAHMXYYEOWUDBL-MRXNPFEDSA-N	1	1	271.364	2.222	40	0		CEABMO
CO[C@H]1Cn2cccc2C[N@@H+](Cc2cccc(C)n2)C1	ZINC000247901448	371145837	/nfs/dbraw/zinc/14/58/37/371145837.db2.gz	ZAHMXYYEOWUDBL-MRXNPFEDSA-N	1	1	271.364	2.222	40	0		CEABMO
C[N@H+]1CC[C@]2(c3ccccc3)CCN(C(=O)C3CC3)C[C@@H]12	ZINC000248121708	371162323	/nfs/dbraw/zinc/16/23/23/371162323.db2.gz	KHUQSPQHMNEIHO-SJLPKXTDSA-N	1	1	284.403	2.271	40	0		CEABMO
Cc1cc(CN2CC[N@@H+](C)[C@@H](c3ccccc3)C2)no1	ZINC000257203336	190011774	/nfs/dbraw/zinc/01/17/74/190011774.db2.gz	APOVHXINAXPTSD-MRXNPFEDSA-N	1	1	271.364	2.472	40	0		CEABMO
Cc1cc(CN2CC[N@H+](C)[C@@H](c3ccccc3)C2)no1	ZINC000257203336	190011775	/nfs/dbraw/zinc/01/17/75/190011775.db2.gz	APOVHXINAXPTSD-MRXNPFEDSA-N	1	1	271.364	2.472	40	0		CEABMO
CNc1cc(C)nc([C@H]2CC[N@H+](Cc3cnn(C)c3)C2)c1	ZINC000257217218	190013776	/nfs/dbraw/zinc/01/37/76/190013776.db2.gz	CYBRFAPCIWITOP-AWEZNQCLSA-N	1	1	285.395	2.155	40	0		CEABMO
CNc1cc(C)nc([C@H]2CC[N@@H+](Cc3cnn(C)c3)C2)c1	ZINC000257217218	190013777	/nfs/dbraw/zinc/01/37/77/190013777.db2.gz	CYBRFAPCIWITOP-AWEZNQCLSA-N	1	1	285.395	2.155	40	0		CEABMO
CNc1cc([C@@H]2CCC[N@@H+](Cc3cncn3C)C2)ccn1	ZINC000257268922	190023929	/nfs/dbraw/zinc/02/39/29/190023929.db2.gz	MNUPAMOMPBUFKL-CQSZACIVSA-N	1	1	285.395	2.236	40	0		CEABMO
CN1CCC([N@H+]2CC[C@@H](c3ncn4ccsc34)C2)CC1	ZINC000257271879	190024357	/nfs/dbraw/zinc/02/43/57/190024357.db2.gz	NADWQYCGYOKNIZ-GFCCVEGCSA-N	1	1	290.436	2.279	40	0		CEABMO
C[NH+]1CCC(N2CC[C@@H](c3ncn4ccsc34)C2)CC1	ZINC000257271879	190024358	/nfs/dbraw/zinc/02/43/58/190024358.db2.gz	NADWQYCGYOKNIZ-GFCCVEGCSA-N	1	1	290.436	2.279	40	0		CEABMO
Cc1cccc(C[N@H+]2CC[C@@H](c3nccc(C)n3)C2)n1	ZINC000257293390	190028788	/nfs/dbraw/zinc/02/87/88/190028788.db2.gz	QPGSNILBQSWVDJ-CQSZACIVSA-N	1	1	268.364	2.478	40	0		CEABMO
Cn1cccc1C(=O)N1CC[N@H+](C)[C@@H](c2ccccc2)C1	ZINC000257302434	190030633	/nfs/dbraw/zinc/03/06/33/190030633.db2.gz	SCXVQJCWXUHENV-MRXNPFEDSA-N	1	1	283.375	2.154	40	0		CEABMO
Cn1cccc1C(=O)N1CC[N@@H+](C)[C@@H](c2ccccc2)C1	ZINC000257302434	190030634	/nfs/dbraw/zinc/03/06/34/190030634.db2.gz	SCXVQJCWXUHENV-MRXNPFEDSA-N	1	1	283.375	2.154	40	0		CEABMO
O[C@H]1CC[N@@H+](Cc2ccc3[nH]ccc3c2)C[C@@]12CCCO2	ZINC000257319236	190033684	/nfs/dbraw/zinc/03/36/84/190033684.db2.gz	VRLDNBFWWHVDIE-IRXDYDNUSA-N	1	1	286.375	2.284	40	0		CEABMO
CO[C@H]1CC[N@@H+](Cc2scnc2C)C[C@@]12CCCO2	ZINC000257332463	190035959	/nfs/dbraw/zinc/03/59/59/190035959.db2.gz	XXKNXPSDCRAXNF-KBPBESRZSA-N	1	1	282.409	2.221	40	0		CEABMO
CC(C)[C@@H]1CC[C@H](C)C[C@H]1OC[C@H](O)C[NH+]1CCOCC1	ZINC000034792198	394493538	/nfs/dbraw/zinc/49/35/38/394493538.db2.gz	VWOCGUKYAHXHNT-VVLHAWIVSA-N	1	1	299.455	2.157	40	0		CEABMO
COc1cccc(N2C(=O)[C@H]([NH3+])[C@@H]2c2ccc(C)cc2)c1	ZINC000072227729	394596084	/nfs/dbraw/zinc/59/60/84/394596084.db2.gz	ATICMZPWYIMLJQ-CVEARBPZSA-N	1	1	282.343	2.419	40	0		CEABMO
COc1cccc(N2C(=O)[C@@H]([NH3+])[C@H]2c2ccccc2)c1	ZINC000072227718	394596483	/nfs/dbraw/zinc/59/64/83/394596483.db2.gz	ORSDLZMGXSGCNS-LSDHHAIUSA-N	1	1	268.316	2.110	40	0		CEABMO
CN1CC[NH2+][C@H](Cc2ccccc2-c2ccc(F)cc2)C1=O	ZINC000072352867	394598513	/nfs/dbraw/zinc/59/85/13/394598513.db2.gz	BMGOLDSFODAARR-QGZVFWFLSA-N	1	1	298.361	2.465	40	0		CEABMO
Cc1nc(N)cc([C@H]2C[N@@H+](C3CCCCC3)CCO2)n1	ZINC000072387730	394598612	/nfs/dbraw/zinc/59/86/12/394598612.db2.gz	KDEYUIXGHMDHOJ-CQSZACIVSA-N	1	1	276.384	2.073	40	0		CEABMO
Cc1nc(N)cc([C@H]2C[N@H+](C3CCCCC3)CCO2)n1	ZINC000072387730	394598614	/nfs/dbraw/zinc/59/86/14/394598614.db2.gz	KDEYUIXGHMDHOJ-CQSZACIVSA-N	1	1	276.384	2.073	40	0		CEABMO
CC(C)C[N@H+]1CC[C@]2(C1)CCCN(c1ncccn1)C2	ZINC000096071627	394675552	/nfs/dbraw/zinc/67/55/52/394675552.db2.gz	FZAWAWBVZWRZQL-INIZCTEOSA-N	1	1	274.412	2.425	40	0		CEABMO
COc1ccc(N2C(=O)[C@H]([NH3+])[C@H]2c2ccccc2)cc1	ZINC000072227125	286324852	/nfs/dbraw/zinc/32/48/52/286324852.db2.gz	XTSXQGSRHGCKDD-HUUCEWRRSA-N	1	1	268.316	2.110	40	0		CEABMO
C[C@@H]1CN(Cc2nc3ccc(Cl)cc3[nH]2)CC[NH2+]1	ZINC000022122120	171353680	/nfs/dbraw/zinc/35/36/80/171353680.db2.gz	VVXHUGNLADTCAF-SECBINFHSA-N	1	1	264.760	2.010	40	0		CEABMO
O=C1NCC[NH2+][C@@H]1Cc1cccc(-c2cccc(F)c2)c1	ZINC000072352839	176374585	/nfs/dbraw/zinc/37/45/85/176374585.db2.gz	RSVDAKHVGAUUIH-MRXNPFEDSA-N	1	1	284.334	2.123	40	0		CEABMO
OCC[N@H+]1CCC[C@@H]1c1ccnc(Nc2ccccn2)c1	ZINC000072367767	176382229	/nfs/dbraw/zinc/38/22/29/176382229.db2.gz	CODQHAYKTLHIDW-CQSZACIVSA-N	1	1	284.363	2.349	40	0		CEABMO
Cc1nc[nH]c1C[N@H+]1CC[C@@H](c2nc(C)cc(C)n2)C1	ZINC000072369805	176384057	/nfs/dbraw/zinc/38/40/57/176384057.db2.gz	OMOCPVCIVLOTGZ-CYBMUJFWSA-N	1	1	271.368	2.114	40	0		CEABMO
COc1ccc(CN2C[C@H]3CCC[N@H+]3C[C@@H]2C)cc1OC	ZINC000072397514	176394917	/nfs/dbraw/zinc/39/49/17/176394917.db2.gz	AACBDFFUMQVXBK-DZGCQCFKSA-N	1	1	290.407	2.372	40	0		CEABMO
CCOC[C@@]12CCCO[C@@H]1CC[N@@H+](CC1CCOCC1)C2	ZINC000096056859	276331730	/nfs/dbraw/zinc/33/17/30/276331730.db2.gz	FXKMOSYEZHUKCQ-SJORKVTESA-N	1	1	297.439	2.321	40	0		CEABMO
Brc1ccc2c(c1)[C@]1(CCO2)COCC[NH2+]1	ZINC000306145559	276768468	/nfs/dbraw/zinc/76/84/68/276768468.db2.gz	ILTPKJLBTIAMPZ-LBPRGKRZSA-N	1	1	284.153	2.047	40	0		CEABMO
C[N@@H+]1CC(=O)N2CCCC[C@H]2[C@@H](c2ccccc2)C1	ZINC000001717675	277022457	/nfs/dbraw/zinc/02/24/57/277022457.db2.gz	XLQKRJBDBSWEHZ-CABCVRRESA-N	1	1	258.365	2.097	40	0		CEABMO
C=Cn1ncc(C[N@H+]2CC[C@]3(O)CCCC[C@H]3C2)c1C	ZINC000257329534	327136683	/nfs/dbraw/zinc/13/66/83/327136683.db2.gz	XKJBIGFPYFIZLS-JKSUJKDBSA-N	1	1	275.396	2.419	40	0		CEABMO
CCOC(=O)c1cnn(C)c1C[N@@H+]1CCCC[C@H]1CC	ZINC000132198987	528310319	/nfs/dbraw/zinc/31/03/19/528310319.db2.gz	NMEFRUBPFXCZIP-GFCCVEGCSA-N	1	1	279.384	2.361	40	0		CEABMO
CCOC(=O)c1cnn(C)c1C[N@H+]1CCCC[C@H]1CC	ZINC000132198987	528310323	/nfs/dbraw/zinc/31/03/23/528310323.db2.gz	NMEFRUBPFXCZIP-GFCCVEGCSA-N	1	1	279.384	2.361	40	0		CEABMO
CO[C@@H]1C[N@@H+](Cc2sccc2C)[C@@H]2CCCO[C@H]12	ZINC000096042335	185070705	/nfs/dbraw/zinc/07/07/05/185070705.db2.gz	DGMFIODLNALDST-BZPMIXESSA-N	1	1	267.394	2.435	40	0		CEABMO
C[N@H+]1CCCCC12CCN(C(=O)c1cccnc1)CC2	ZINC000096051206	185074227	/nfs/dbraw/zinc/07/42/27/185074227.db2.gz	UNHXTZUHVLZYHS-UHFFFAOYSA-N	1	1	273.380	2.172	40	0		CEABMO
O=c1ccc2c(n1CC1CC1)CC[N@@H+](Cc1ccco1)CC2	ZINC000096059349	185081033	/nfs/dbraw/zinc/08/10/33/185081033.db2.gz	RTDGEJQKRXXQGI-UHFFFAOYSA-N	1	1	298.386	2.452	40	0		CEABMO
CC(C)[N@H+]1CC[C@H]2CN(C(=O)C3CCCC3)C[C@H]2C1	ZINC000096081395	185091000	/nfs/dbraw/zinc/09/10/00/185091000.db2.gz	WMIOWGGTPHCWRW-LSDHHAIUSA-N	1	1	264.413	2.365	40	0		CEABMO
CC[NH+](CC)[C@@]1([C@H](CN)CO)C[C@@H]2CC[C@@]1(C)C2(C)C	ZINC000225467487	344545818	/nfs/dbraw/zinc/54/58/18/344545818.db2.gz	MYMMFPISRPMSER-HDEZJCGLSA-N	1	1	282.472	2.480	40	0		CEABMO
CCn1cc(C[N@H+]2CC[C@H](Cc3ccccc3)[C@H](O)C2)cn1	ZINC000585280053	345010189	/nfs/dbraw/zinc/01/01/89/345010189.db2.gz	XIAQEGMPSNDTQJ-QZTJIDSGSA-N	1	1	299.418	2.329	40	0		CEABMO
Clc1ccc2c(c1)N[C@H]([C@@H]1CCOC1)N1CC[NH+]=C21	ZINC000012188524	282518332	/nfs/dbraw/zinc/51/83/32/282518332.db2.gz	LRZYVJLYMHUBMS-RNCFNFMXSA-N	1	1	277.755	2.190	40	0		CEABMO
c1csc(CN2CC[N@H+]3C[C@@H](OCC4CC4)C[C@@H]3C2)c1	ZINC000107746629	186189094	/nfs/dbraw/zinc/18/90/94/186189094.db2.gz	NRAXYOAGABLPCC-CABCVRRESA-N	1	1	292.448	2.433	40	0		CEABMO
CC(=O)O[C@H]1CC[N@H+](Cc2ccco2)[C@H](C)[C@H]1C	ZINC000004127443	361301810	/nfs/dbraw/zinc/30/18/10/361301810.db2.gz	HAVUOHMCCLLASZ-GYSYKLTISA-N	1	1	251.326	2.442	40	0		CEABMO
C[N@H+]1CCC[C@@H](C(=O)NCc2ccc(Cl)cc2)C1	ZINC000082307242	363763112	/nfs/dbraw/zinc/76/31/12/363763112.db2.gz	RGLGIXJQHWUFFW-GFCCVEGCSA-N	1	1	266.772	2.298	40	0		CEABMO
COc1ccccc1C[N@H+]1CC[C@@H](c2cc(=O)[nH]c(C)n2)C1	ZINC000019285275	361527011	/nfs/dbraw/zinc/52/70/11/361527011.db2.gz	ZADOTEKMGLFTIQ-CYBMUJFWSA-N	1	1	299.374	2.076	40	0		CEABMO
CCCCNC(=S)N1CC[NH+](Cc2ccccc2)CC1	ZINC000020097948	361580493	/nfs/dbraw/zinc/58/04/93/361580493.db2.gz	YDGMELWLLAQPNA-UHFFFAOYSA-N	1	1	291.464	2.479	40	0		CEABMO
CCN1CC[C@@]2(CCCN(c3cccc(C)[nH+]3)C2)C1=O	ZINC000096093267	364399447	/nfs/dbraw/zinc/39/94/47/364399447.db2.gz	RERRRNZFNJCHGX-MRXNPFEDSA-N	1	1	273.380	2.229	40	0		CEABMO
CO[C@@H]1COC2(C1)CC[NH+](Cc1csc(C)n1)CC2	ZINC000096158769	364403543	/nfs/dbraw/zinc/40/35/43/364403543.db2.gz	UAJIUSMDRDBQOG-ZDUSSCGKSA-N	1	1	282.409	2.221	40	0		CEABMO
CC[C@H](C)[N@@H+]1C[C@H]2CN(Cc3ccccn3)C[C@H]2C1	ZINC000096161608	364404880	/nfs/dbraw/zinc/40/48/80/364404880.db2.gz	NQIJXWNUFWUPJI-SOUVJXGZSA-N	1	1	259.397	2.244	40	0		CEABMO
COC[C@@H]1C[N@H+](C)C[C@@]12CCN(Cc1ccc(C)s1)C2	ZINC000096218023	364413366	/nfs/dbraw/zinc/41/33/66/364413366.db2.gz	NCAOHZAKRYPZIM-GOEBONIOSA-N	1	1	294.464	2.457	40	0		CEABMO
COC[C@@H]1C[N@@H+](C)C[C@@]12CCN(Cc1ccc(C)s1)C2	ZINC000096218023	364413370	/nfs/dbraw/zinc/41/33/70/364413370.db2.gz	NCAOHZAKRYPZIM-GOEBONIOSA-N	1	1	294.464	2.457	40	0		CEABMO
Cc1cccc(N2CCC[C@@H]([N@@H+](C)Cc3ccn(C)n3)C2)n1	ZINC000257306721	371613077	/nfs/dbraw/zinc/61/30/77/371613077.db2.gz	SVNJDDDMIBGTNR-MRXNPFEDSA-N	1	1	299.422	2.224	40	0		CEABMO
Cc1cccc(N2CCC[C@@H]([N@H+](C)Cc3ccn(C)n3)C2)n1	ZINC000257306721	371613084	/nfs/dbraw/zinc/61/30/84/371613084.db2.gz	SVNJDDDMIBGTNR-MRXNPFEDSA-N	1	1	299.422	2.224	40	0		CEABMO
CN1C[C@@H]2C[N@H+](Cc3ccccc3)[C@H](C3CC3)[C@@H]2C1	ZINC000409427688	375524398	/nfs/dbraw/zinc/52/43/98/375524398.db2.gz	BUHGYPQOLLDKKM-BRWVUGGUSA-N	1	1	256.393	2.459	40	0		CEABMO
CN1C[C@@H]2C[N@@H+](Cc3ccccc3)[C@H](C3CC3)[C@@H]2C1	ZINC000409427688	375524401	/nfs/dbraw/zinc/52/44/01/375524401.db2.gz	BUHGYPQOLLDKKM-BRWVUGGUSA-N	1	1	256.393	2.459	40	0		CEABMO
CCCn1nc(C)cc1C[NH2+]Cc1cnn(CC)c1	ZINC000256050741	190003151	/nfs/dbraw/zinc/00/31/51/190003151.db2.gz	GICFOEIFVUEGGK-UHFFFAOYSA-N	1	1	261.373	2.108	40	0		CEABMO
CCN(CC)C(=O)c1cncc(C[C@@H]2CCC[N@@H+](C)C2)c1	ZINC000257222120	190014489	/nfs/dbraw/zinc/01/44/89/190014489.db2.gz	DRZYPFNJTKQLKP-AWEZNQCLSA-N	1	1	289.423	2.448	40	0		CEABMO
Cn1ncc2ccc([C@@H]3CCC[N@@H+](Cc4cc[nH]n4)C3)nc21	ZINC000257266113	190022922	/nfs/dbraw/zinc/02/29/22/190022922.db2.gz	MBQFEQQIRXWHKT-CYBMUJFWSA-N	1	1	296.378	2.071	40	0		CEABMO
Cc1cccnc1C[N@H+]1CCCC[C@]2(C)NC(=O)CC[C@H]12	ZINC000257269618	190023868	/nfs/dbraw/zinc/02/38/68/190023868.db2.gz	MQRWCCSOSWRVSE-RDJZCZTQSA-N	1	1	287.407	2.413	40	0		CEABMO
CCN(CC)C(=O)c1cc([C@H]2CCC[N@H+]2C)ccn1	ZINC000257274597	190025103	/nfs/dbraw/zinc/02/51/03/190025103.db2.gz	NLUIAYFETPUVBI-CQSZACIVSA-N	1	1	261.369	2.330	40	0		CEABMO
Cc1ccn(CCNc2ccc([C@@H]3CCC[N@@H+]3C)nc2)n1	ZINC000257335496	190036034	/nfs/dbraw/zinc/03/60/34/190036034.db2.gz	YKJQWBSSWOXBLK-INIZCTEOSA-N	1	1	285.395	2.465	40	0		CEABMO
Cc1ccn(CCNc2ccc([C@H]3CCC[N@@H+]3C)nc2)n1	ZINC000257335497	190036231	/nfs/dbraw/zinc/03/62/31/190036231.db2.gz	YKJQWBSSWOXBLK-MRXNPFEDSA-N	1	1	285.395	2.465	40	0		CEABMO
CCCCC(=O)N1CC2(C1)C[C@@H](COCC)CC[N@H+]2C	ZINC000306126096	376540456	/nfs/dbraw/zinc/54/04/56/376540456.db2.gz	DMQGHXGKDVSOOM-AWEZNQCLSA-N	1	1	282.428	2.136	40	0		CEABMO
CCN(C[C@@H]1CCCC[N@H+]1CCO)C(=O)OC(C)(C)C	ZINC000079408012	285022231	/nfs/dbraw/zinc/02/22/31/285022231.db2.gz	MDVPSSCHAXHKJZ-ZDUSSCGKSA-N	1	1	286.416	2.090	40	0		CEABMO
CNc1cc(C)c(CNC(=O)OC(C)(C)C)c[nH+]1	ZINC000072223053	256705906	/nfs/dbraw/zinc/70/59/06/256705906.db2.gz	VRBYBAFEACNTLE-UHFFFAOYSA-N	1	1	251.330	2.456	40	0		CEABMO
CC(C)[N@H+]1C[C@@H](c2ccccc2)[C@@]2(CCN(C)C2=O)C1	ZINC000096201860	256820824	/nfs/dbraw/zinc/82/08/24/256820824.db2.gz	JYHOBYGPAYKLRH-DOTOQJQBSA-N	1	1	272.392	2.343	40	0		CEABMO
CC(C)[N@H+]1CC[C@@]2(C1)CCC[C@H](CNc1ncccn1)O2	ZINC000096219187	256826647	/nfs/dbraw/zinc/82/66/47/256826647.db2.gz	MZQUFQMYDGEQSO-GDBMZVCRSA-N	1	1	290.411	2.311	40	0		CEABMO
COC(=O)[C@H]1C[C@@H]2c3[nH]c4ccccc4c3CC[N@@H+]2C1	ZINC000031719762	394487203	/nfs/dbraw/zinc/48/72/03/394487203.db2.gz	XKJYWJCEEMLZSB-IINYFYTJSA-N	1	1	270.332	2.260	40	0		CEABMO
Cc1cc(N2CCCC2)[nH+]cc1[C@H]1CCCN1C=O	ZINC000072218848	394593267	/nfs/dbraw/zinc/59/32/67/394593267.db2.gz	NQFZRTNOAOBTOH-CQSZACIVSA-N	1	1	259.353	2.284	40	0		CEABMO
CC1(C)[C@@H]2CC[C@@]1(C)[C@@]([C@@H](CN)CO)([NH+]1CCCC1)C2	ZINC000072210469	394592134	/nfs/dbraw/zinc/59/21/34/394592134.db2.gz	HBUPWEWXZGYSEF-YALNPMBYSA-N	1	1	280.456	2.234	40	0		CEABMO
COc1ccc([C@H]2[C@@H]([NH3+])C(=O)N2c2ccccc2)cc1	ZINC000072227337	394595400	/nfs/dbraw/zinc/59/54/00/394595400.db2.gz	ZFSHBMDUBOZWOL-CABCVRRESA-N	1	1	268.316	2.110	40	0		CEABMO
COc1cccc([C@@H]2[C@H]([NH3+])C(=O)N2c2cccc(OC)c2)c1	ZINC000072227738	394596444	/nfs/dbraw/zinc/59/64/44/394596444.db2.gz	AHZUWXRMCSFCAV-JKSUJKDBSA-N	1	1	298.342	2.119	40	0		CEABMO
COCC[C@H]1CO[C@]2(C1)CCC[N@@H+](Cc1ccncc1)C2	ZINC000096089852	394677351	/nfs/dbraw/zinc/67/73/51/394677351.db2.gz	HVAHXPKUFJYZSK-SJORKVTESA-N	1	1	290.407	2.489	40	0		CEABMO
CC[N@H+](Cc1ccc(C)cc1)[C@@]1(C)CCS(=O)(=O)C1	ZINC000575421785	400608747	/nfs/dbraw/zinc/60/87/47/400608747.db2.gz	RMRZOYLQHSIVJX-HNNXBMFYSA-N	1	1	281.421	2.394	40	0		CEABMO
CC[N@@H+](Cc1ccc(C)cc1)[C@@]1(C)CCS(=O)(=O)C1	ZINC000575421785	400608752	/nfs/dbraw/zinc/60/87/52/400608752.db2.gz	RMRZOYLQHSIVJX-HNNXBMFYSA-N	1	1	281.421	2.394	40	0		CEABMO
C[N@H+]1CCC[C@@H](CNC(=S)Nc2ccccc2)C1	ZINC000009876099	170387968	/nfs/dbraw/zinc/38/79/68/170387968.db2.gz	XPCBNUOPRIYXMJ-LBPRGKRZSA-N	1	1	263.410	2.315	40	0		CEABMO
Cc1cccc(NC(=O)NC[C@H]2CCC[N@H+](C)C2)c1	ZINC000009876668	170388316	/nfs/dbraw/zinc/38/83/16/170388316.db2.gz	TYLVPGWQYQRUDW-CYBMUJFWSA-N	1	1	261.369	2.458	40	0		CEABMO
COc1ccc(C[N@H+]2CC[C@H](c3nc(C)cc(=O)[nH]3)C2)cc1	ZINC000019118461	170752523	/nfs/dbraw/zinc/75/25/23/170752523.db2.gz	IRIPJNBZGPCWAX-AWEZNQCLSA-N	1	1	299.374	2.076	40	0		CEABMO
CC[NH+](CC)CCN[C@H](C)C(=O)N1[C@@H](C)CCC[C@@H]1C	ZINC000022586295	171393207	/nfs/dbraw/zinc/39/32/07/171393207.db2.gz	CXSVMOSHBAQULZ-SOUVJXGZSA-N	1	1	283.460	2.096	40	0		CEABMO
COCCCNC(=O)c1ccc(Cn2cc[nH+]c2C)cc1	ZINC000038833059	174157347	/nfs/dbraw/zinc/15/73/47/174157347.db2.gz	KCZOBDAMNZQRGV-UHFFFAOYSA-N	1	1	287.363	2.006	40	0		CEABMO
c1cnc([C@H]2CCC[N@H+](Cc3ccncc3)C2)cn1	ZINC000072363788	176378500	/nfs/dbraw/zinc/37/85/00/176378500.db2.gz	YVRHPRAEKCXGLO-AWEZNQCLSA-N	1	1	254.337	2.251	40	0		CEABMO
C[N@H+]1CCC[C@@H](c2ccnc(Nc3cnccn3)c2)C1	ZINC000072364990	176380119	/nfs/dbraw/zinc/38/01/19/176380119.db2.gz	JGYJGKZGDZEEGU-CYBMUJFWSA-N	1	1	269.352	2.424	40	0		CEABMO
Cc1nc(Nc2ccccn2)cc([C@@H]2CC[N@H+](C)C2)n1	ZINC000072382608	176387990	/nfs/dbraw/zinc/38/79/90/176387990.db2.gz	GYMYTPWKPQTRFA-GFCCVEGCSA-N	1	1	269.352	2.343	40	0		CEABMO
O=C1NC2(CC[NH+](Cc3ccco3)CC2)Nc2ccccc21	ZINC000019374673	275022327	/nfs/dbraw/zinc/02/23/27/275022327.db2.gz	AKNLXFVIGYHLBO-UHFFFAOYSA-N	1	1	297.358	2.427	40	0		CEABMO
COc1cc2c(cc1OC)[C@H]1CC[N@H+]3CCC[C@@H]3N1CC2	ZINC000019326991	277395290	/nfs/dbraw/zinc/39/52/90/277395290.db2.gz	JBLQTGBNLYFHRP-PBHICJAKSA-N	1	1	288.391	2.429	40	0		CEABMO
CC(C)(C)OC(=O)N(C[C@@H]1CCCC[N@H+]1CCO)C1CC1	ZINC000079408216	278377688	/nfs/dbraw/zinc/37/76/88/278377688.db2.gz	OFZATQAUJWWBLP-AWEZNQCLSA-N	1	1	298.427	2.233	40	0		CEABMO
C[N@H+]1C[C@@H]2C[C@@]3(C)[C@H](CCCC[C@@H]13)N2C(=O)c1cnco1	ZINC000257267658	290289652	/nfs/dbraw/zinc/28/96/52/290289652.db2.gz	MIGOOPDAFOTMIO-ZGMNHVEMSA-N	1	1	289.379	2.152	40	0		CEABMO
NC[C@H]([NH3+])c1cc(Br)cc(Br)c1	ZINC000044472006	327134525	/nfs/dbraw/zinc/13/45/25/327134525.db2.gz	SSQNWRFNXOLVKK-QMMMGPOBSA-N	1	1	293.990	2.170	40	0		CEABMO
[NH3+][C@H](c1nc(-c2ccccn2)n[nH]1)c1ccc(F)cc1	ZINC000095533273	185007152	/nfs/dbraw/zinc/00/71/52/185007152.db2.gz	OPXCTJUORZRYMO-LBPRGKRZSA-N	1	1	269.283	2.054	40	0		CEABMO
C[N@H+]1CCC[C@@]2(CN(Cc3ccc(F)cc3)CCO2)C1	ZINC000096049066	185073355	/nfs/dbraw/zinc/07/33/55/185073355.db2.gz	CQZBSGHCUGRSDI-INIZCTEOSA-N	1	1	278.371	2.122	40	0		CEABMO
CCOC[C@@H]1CCC[C@@]12C[N@H+](Cc1ccncc1)CCO2	ZINC000096051876	185073751	/nfs/dbraw/zinc/07/37/51/185073751.db2.gz	MFZCTHZQDVQTBX-DLBZAZTESA-N	1	1	290.407	2.489	40	0		CEABMO
CCOC[C@@H]1CCC[C@@]12C[N@@H+](Cc1ccncc1)CCO2	ZINC000096051876	185073752	/nfs/dbraw/zinc/07/37/52/185073752.db2.gz	MFZCTHZQDVQTBX-DLBZAZTESA-N	1	1	290.407	2.489	40	0		CEABMO
O=C1[C@H]2C[N@@H+](Cc3cccnc3)C[C@H]2CN1c1ccccc1	ZINC000096053594	185073796	/nfs/dbraw/zinc/07/37/96/185073796.db2.gz	OGHHDTIIPQZBSA-RDJZCZTQSA-N	1	1	293.370	2.176	40	0		CEABMO
COc1ccc(C[N@H+]2CCC[C@@]3(CCCC(=O)N3)C2)cc1	ZINC000096049946	185074055	/nfs/dbraw/zinc/07/40/55/185074055.db2.gz	OUKKDIVLTZNWJP-KRWDZBQOSA-N	1	1	288.391	2.330	40	0		CEABMO
O=C1[C@H]2C[N@@H+](Cc3ccccn3)C[C@@H]2CN1c1ccccc1	ZINC000096053593	185075013	/nfs/dbraw/zinc/07/50/13/185075013.db2.gz	CEDUHCXFNALMTE-PBHICJAKSA-N	1	1	293.370	2.176	40	0		CEABMO
Fc1cccc(O[C@@H]2C[C@@H]3C[N@@H+](CC4CC4)CCN3C2)c1	ZINC000096055155	185076343	/nfs/dbraw/zinc/07/63/43/185076343.db2.gz	NJDAHRFTRCEKOQ-NVXWUHKLSA-N	1	1	290.382	2.373	40	0		CEABMO
Fc1cccc(O[C@@H]2C[C@@H]3CN(CC4CC4)CC[N@@H+]3C2)c1	ZINC000096055155	185076345	/nfs/dbraw/zinc/07/63/45/185076345.db2.gz	NJDAHRFTRCEKOQ-NVXWUHKLSA-N	1	1	290.382	2.373	40	0		CEABMO
Fc1cccc(O[C@@H]2C[C@@H]3CN(CC4CC4)CC[N@H+]3C2)c1	ZINC000096055155	185076347	/nfs/dbraw/zinc/07/63/47/185076347.db2.gz	NJDAHRFTRCEKOQ-NVXWUHKLSA-N	1	1	290.382	2.373	40	0		CEABMO
c1coc(C[N@H+]2CCc3ncnc([C@H]4CCOC4)c3CC2)c1	ZINC000096058628	185078816	/nfs/dbraw/zinc/07/88/16/185078816.db2.gz	JKCCSEIPJVVDTP-ZDUSSCGKSA-N	1	1	299.374	2.174	40	0		CEABMO
Cc1noc([C@@H]2C[C@@H]3CC[N@H+](Cc4ccoc4)C[C@H]3O2)n1	ZINC000096058237	185079377	/nfs/dbraw/zinc/07/93/77/185079377.db2.gz	OHBQHAYZDQNONR-MELADBBJSA-N	1	1	289.335	2.323	40	0		CEABMO
Cc1noc([C@@H]2C[C@@H]3CC[N@@H+](Cc4ccoc4)C[C@H]3O2)n1	ZINC000096058237	185079378	/nfs/dbraw/zinc/07/93/78/185079378.db2.gz	OHBQHAYZDQNONR-MELADBBJSA-N	1	1	289.335	2.323	40	0		CEABMO
CN1C(=O)CCCC[C@H]2[N@@H+](CC3CC3)CC[C@]21C	ZINC000019695467	343374501	/nfs/dbraw/zinc/37/45/01/343374501.db2.gz	DXWHSFPXMSRXIJ-UKRRQHHQSA-N	1	1	250.386	2.262	40	0		CEABMO
CCOc1ccc(Nc2cc(N)nc(CCOC)[nH+]2)cc1	ZINC000049467744	362364073	/nfs/dbraw/zinc/36/40/73/362364073.db2.gz	GCPRXQRJVMBPET-UHFFFAOYSA-N	1	1	288.351	2.390	40	0		CEABMO
OC[C@H]1CC[N@H+](Cc2cc(Br)cs2)C1	ZINC000051887334	362444053	/nfs/dbraw/zinc/44/40/53/362444053.db2.gz	YOWQMSRNOZQANZ-QMMMGPOBSA-N	1	1	276.199	2.325	40	0		CEABMO
OC[C@H]1CC[N@@H+](Cc2cc(Br)cs2)C1	ZINC000051887334	362444059	/nfs/dbraw/zinc/44/40/59/362444059.db2.gz	YOWQMSRNOZQANZ-QMMMGPOBSA-N	1	1	276.199	2.325	40	0		CEABMO
CC[NH+](CC)CC[C@H]1CN(C(C)C)Cc2ccnn21	ZINC000585111854	345005697	/nfs/dbraw/zinc/00/56/97/345005697.db2.gz	CWVOWYHKIKGTKU-HNNXBMFYSA-N	1	1	264.417	2.380	40	0		CEABMO
CC(C)N1CC2(C1)C[C@H](COc1ccccn1)CC[N@H+]2C	ZINC000585103536	345005968	/nfs/dbraw/zinc/00/59/68/345005968.db2.gz	XNNLQRPGXNGQML-OAHLLOKOSA-N	1	1	289.423	2.265	40	0		CEABMO
CC(C)[NH+]1CC2(C1)C[C@H](COc1ccccn1)CCN2C	ZINC000585103536	345005972	/nfs/dbraw/zinc/00/59/72/345005972.db2.gz	XNNLQRPGXNGQML-OAHLLOKOSA-N	1	1	289.423	2.265	40	0		CEABMO
CC[NH+](CC)CC[C@@H]1CN(C(C)C)Cc2ccnn21	ZINC000585111856	345006094	/nfs/dbraw/zinc/00/60/94/345006094.db2.gz	CWVOWYHKIKGTKU-OAHLLOKOSA-N	1	1	264.417	2.380	40	0		CEABMO
O[C@H]1CCC[N@@H+](Cc2cc[nH]n2)[C@H]1Cc1ccc(F)cc1	ZINC000585269040	345009409	/nfs/dbraw/zinc/00/94/09/345009409.db2.gz	IPUWPBNOLGXLGL-HOTGVXAUSA-N	1	1	289.354	2.117	40	0		CEABMO
Cc1ccccc1C[C@@]1(CO)C[N@@H+](C(C)C)CCO1	ZINC000585277404	345009770	/nfs/dbraw/zinc/00/97/70/345009770.db2.gz	WEGLDXWHDMQFRQ-INIZCTEOSA-N	1	1	263.381	2.009	40	0		CEABMO
NC(=O)C[C@H]([NH3+])c1ccc(-c2cccc(Cl)c2)o1	ZINC000090586012	180009340	/nfs/dbraw/zinc/00/93/40/180009340.db2.gz	DFQDDRATPQBIGH-JTQLQIEISA-N	1	1	264.712	2.475	40	0		CEABMO
Nc1cccnc1N[C@@H]1CC[N@@H+](Cc2ccccc2)C1	ZINC000091352097	180137917	/nfs/dbraw/zinc/13/79/17/180137917.db2.gz	VCOCTBVOMHSTTI-CQSZACIVSA-N	1	1	268.364	2.350	40	0		CEABMO
COC(=O)c1ccc(CN2C[C@H]3CCC[N@H+]3C[C@@H]2C)cc1	ZINC000072324455	363130263	/nfs/dbraw/zinc/13/02/63/363130263.db2.gz	XIPUQLOHVWTLQE-XJKSGUPXSA-N	1	1	288.391	2.142	40	0		CEABMO
OCCN(C[C@H]1CCC[N@H+]1Cc1ccccc1)C1CC1	ZINC000079393541	363593976	/nfs/dbraw/zinc/59/39/76/363593976.db2.gz	HDYFYZOEHXYRNR-QGZVFWFLSA-N	1	1	274.408	2.108	40	0		CEABMO
OCC[N@H+](C[C@H]1CCCN1Cc1ccccc1)C1CC1	ZINC000079393541	363593978	/nfs/dbraw/zinc/59/39/78/363593978.db2.gz	HDYFYZOEHXYRNR-QGZVFWFLSA-N	1	1	274.408	2.108	40	0		CEABMO
OCC[N@@H+](C[C@H]1CCCN1Cc1ccccc1)C1CC1	ZINC000079393541	363593984	/nfs/dbraw/zinc/59/39/84/363593984.db2.gz	HDYFYZOEHXYRNR-QGZVFWFLSA-N	1	1	274.408	2.108	40	0		CEABMO
OCCN1CCC[C@H]([N@@H+](Cc2ccccc2)C2CC2)C1	ZINC000079414394	363597641	/nfs/dbraw/zinc/59/76/41/363597641.db2.gz	JXRXSROUZBNDSX-KRWDZBQOSA-N	1	1	274.408	2.108	40	0		CEABMO
OCC[N@@H+]1CCC[C@H](N(Cc2ccccc2)C2CC2)C1	ZINC000079414394	363597643	/nfs/dbraw/zinc/59/76/43/363597643.db2.gz	JXRXSROUZBNDSX-KRWDZBQOSA-N	1	1	274.408	2.108	40	0		CEABMO
OCC[N@H+]1CCC[C@H](N(Cc2ccccc2)C2CC2)C1	ZINC000079414394	363597645	/nfs/dbraw/zinc/59/76/45/363597645.db2.gz	JXRXSROUZBNDSX-KRWDZBQOSA-N	1	1	274.408	2.108	40	0		CEABMO
c1[nH]c2ccccc2c1[C@H]1CC[N@H+](CCN2CCOCC2)C1	ZINC000019366073	361528706	/nfs/dbraw/zinc/52/87/06/361528706.db2.gz	JMFQVIVSVILMKK-HNNXBMFYSA-N	1	1	299.418	2.289	40	0	in-vitro	CEABMO
Cc1cc(=O)[nH]c([C@H]2CC[N@@H+](Cc3ccccc3F)C2)n1	ZINC000019118481	361519393	/nfs/dbraw/zinc/51/93/93/361519393.db2.gz	XPDDWESROHOWLD-ZDUSSCGKSA-N	1	1	287.338	2.207	40	0		CEABMO
COc1ccc(CN2C[C@H]3CCC[N@H+]3C[C@@H]2C)c(OC)c1	ZINC000019575762	361543066	/nfs/dbraw/zinc/54/30/66/361543066.db2.gz	FADZAKJCSKJSIQ-DZGCQCFKSA-N	1	1	290.407	2.372	40	0		CEABMO
C[NH+]1CCN(CC(=O)Nc2ccc3ccccc3c2)CC1	ZINC000019590000	361545426	/nfs/dbraw/zinc/54/54/26/361545426.db2.gz	LJCRUPOPCLMHKE-UHFFFAOYSA-N	1	1	283.375	2.026	40	0		CEABMO
O[C@@H]1CC[N@@H+](CC2CCOCC2)[C@H]1Cc1ccccc1	ZINC000096200040	364408994	/nfs/dbraw/zinc/40/89/94/364408994.db2.gz	GUUZJJLCXBFHHS-DLBZAZTESA-N	1	1	275.392	2.091	40	0		CEABMO
CCN1C(=O)CC[C@@H]2[C@H]1CC[N@H+]2Cc1ccccc1	ZINC000096186201	364407583	/nfs/dbraw/zinc/40/75/83/364407583.db2.gz	TVWPAEXQDVQYSX-HUUCEWRRSA-N	1	1	258.365	2.272	40	0		CEABMO
c1cc(C[N@H+]2CCc3ncnc([C@H]4CCOC4)c3CC2)co1	ZINC000096058632	364400192	/nfs/dbraw/zinc/40/01/92/364400192.db2.gz	DHSHRMIYPQPIPT-AWEZNQCLSA-N	1	1	299.374	2.174	40	0		CEABMO
Cc1noc([C@H]2CO[C@@H]3C[N@@H+](Cc4cccs4)C[C@H]23)n1	ZINC000096218989	364412619	/nfs/dbraw/zinc/41/26/19/364412619.db2.gz	NOTDNTRBGMEXID-FRRDWIJNSA-N	1	1	291.376	2.054	40	0		CEABMO
CC(C)CN1c2ccccc2[C@]2(CC[N@@H+](C)C2)C1=O	ZINC000096244819	364415866	/nfs/dbraw/zinc/41/58/66/364415866.db2.gz	AJZUFCQOSPEPBC-MRXNPFEDSA-N	1	1	258.365	2.263	40	0		CEABMO
C[N@H+]1CCC[C@]12CCCN(C(=O)c1ccncc1)CC2	ZINC000585100141	367177834	/nfs/dbraw/zinc/17/78/34/367177834.db2.gz	GRMJMJMBNWDUNP-MRXNPFEDSA-N	1	1	273.380	2.172	40	0		CEABMO
O=C1[C@@H]2C[N@@H+](Cc3ccccn3)C[C@H]2CN1c1ccccc1	ZINC000247704311	371136422	/nfs/dbraw/zinc/13/64/22/371136422.db2.gz	CEDUHCXFNALMTE-WMLDXEAASA-N	1	1	293.370	2.176	40	0		CEABMO
COc1ccc(C[NH2+]Cc2c(C)nn(C)c2F)cc1	ZINC000256050617	190003162	/nfs/dbraw/zinc/00/31/62/190003162.db2.gz	FUUGFQFPUOECKO-UHFFFAOYSA-N	1	1	263.316	2.166	40	0		CEABMO
CCn1cc(C[N@H+]2CCC[C@@H](c3cc[nH]n3)C2)c(C)n1	ZINC000257213471	190013545	/nfs/dbraw/zinc/01/35/45/190013545.db2.gz	CHSKOOHPETVVGI-CYBMUJFWSA-N	1	1	273.384	2.314	40	0		CEABMO
Cc1cn(C)c([C@@H]2CCC[N@H+](C3CCN(C)CC3)C2)n1	ZINC000257232445	190017184	/nfs/dbraw/zinc/01/71/84/190017184.db2.gz	GKWMCHURAVLAPX-CQSZACIVSA-N	1	1	276.428	2.002	40	0		CEABMO
COc1cccc(C[N@H+]2CC[C@H](c3cc[nH]n3)C2)c1OC	ZINC000257238493	190017561	/nfs/dbraw/zinc/01/75/61/190017561.db2.gz	HLFHISNGBQCFRY-LBPRGKRZSA-N	1	1	287.363	2.416	40	0		CEABMO
CC(=O)N1C[C@H](c2ccc(F)cc2)[C@@H]2[C@H]1CCC[N@@H+]2C	ZINC000257254627	190020461	/nfs/dbraw/zinc/02/04/61/190020461.db2.gz	KEADVBYDPMDLQE-BZUAXINKSA-N	1	1	276.355	2.234	40	0		CEABMO
CC(C)[N@H+]1CC[C@@H](Cc2cnc(-c3cn[nH]c3)cn2)C1	ZINC000257316070	190032433	/nfs/dbraw/zinc/03/24/33/190032433.db2.gz	VDZKZQCRFIQBFP-LBPRGKRZSA-N	1	1	271.368	2.140	40	0		CEABMO
C[N@@H+]1[C@H](c2ccccc2)C[C@H]2NC(=O)CCCC[C@@H]21	ZINC000257315954	190032676	/nfs/dbraw/zinc/03/26/76/190032676.db2.gz	VDLUOGSNGSFKDM-ILXRZTDVSA-N	1	1	258.365	2.491	40	0		CEABMO
Cn1ccnc1C[N@@H+]1CCC[C@@H](c2ccc3c[nH]nc3n2)C1	ZINC000257339466	190037288	/nfs/dbraw/zinc/03/72/88/190037288.db2.gz	ZBVWOAQAJZGCBB-CYBMUJFWSA-N	1	1	296.378	2.071	40	0		CEABMO
Cn1ccnc1C[N@H+]1CCC[C@@H](c2ccc3c[nH]nc3n2)C1	ZINC000257339466	190037289	/nfs/dbraw/zinc/03/72/89/190037289.db2.gz	ZBVWOAQAJZGCBB-CYBMUJFWSA-N	1	1	296.378	2.071	40	0		CEABMO
C[N@H+]1CC[C@]2(c3ccccc3)CCN(C(=O)NC3CC3)C[C@@H]12	ZINC000306140032	376539922	/nfs/dbraw/zinc/53/99/22/376539922.db2.gz	UHTREDXJIPCEJL-SJLPKXTDSA-N	1	1	299.418	2.206	40	0		CEABMO
[NH3+][C@H]1C(=O)N(c2ccc(F)cc2)[C@@H]1c1cccs1	ZINC000072227200	256703583	/nfs/dbraw/zinc/70/35/83/256703583.db2.gz	RRJYLPIQTIKPMO-VXGBXAGGSA-N	1	1	262.309	2.302	40	0		CEABMO
COc1ccc2c(c1)CCN1[C@H]3CCC[N@@H+]3CC[C@H]21	ZINC000019326983	394468687	/nfs/dbraw/zinc/46/86/87/394468687.db2.gz	XDZYAXIEADIXLB-CVEARBPZSA-N	1	1	258.365	2.420	40	0		CEABMO
[NH3+][C@@H]1C(=O)N(c2cccc(F)c2)[C@H]1c1ccccc1F	ZINC000072227647	394596104	/nfs/dbraw/zinc/59/61/04/394596104.db2.gz	VCFIPGMTGKAAPU-KBPBESRZSA-N	1	1	274.270	2.380	40	0		CEABMO
CC[N@H+](Cc1ccccc1)[C@@]1(C)CCS(=O)(=O)C1	ZINC000575420398	400608793	/nfs/dbraw/zinc/60/87/93/400608793.db2.gz	HICZPZJOXAUQSL-AWEZNQCLSA-N	1	1	267.394	2.086	40	0		CEABMO
CC[N@@H+](Cc1ccccc1)[C@@]1(C)CCS(=O)(=O)C1	ZINC000575420398	400608798	/nfs/dbraw/zinc/60/87/98/400608798.db2.gz	HICZPZJOXAUQSL-AWEZNQCLSA-N	1	1	267.394	2.086	40	0		CEABMO
CCCCOC[C@@H](O)C[N@H+]1CCc2ccccc2C1	ZINC000008844776	170357472	/nfs/dbraw/zinc/35/74/72/170357472.db2.gz	OEEALKPMNGSFLR-INIZCTEOSA-N	1	1	263.381	2.222	40	0		CEABMO
Cc1nc(NCc2ccccc2)nc2c1C[N@@H+](C)CC2	ZINC000072415031	176399861	/nfs/dbraw/zinc/39/98/61/176399861.db2.gz	ZOAWDYWSOAQONP-UHFFFAOYSA-N	1	1	268.364	2.385	40	0		CEABMO
C[C@@H](CO)Nc1nc(N2Cc3ccccc3C[C@H]2C)cc[nH+]1	ZINC000329066647	274228882	/nfs/dbraw/zinc/22/88/82/274228882.db2.gz	YDCZIBDFVHDHBB-QWHCGFSZSA-N	1	1	298.390	2.221	40	0		CEABMO
C[N@H+]1CCC[C@H]1c1ccnc(C(=O)Nc2ccon2)c1	ZINC000257309078	277082769	/nfs/dbraw/zinc/08/27/69/277082769.db2.gz	TZLDJEFWPNPTJM-LBPRGKRZSA-N	1	1	272.308	2.089	40	0		CEABMO
Cn1cc(CN2CC[C@]3(C2)CCC[N@@H+](CC2CC2)C3)cn1	ZINC000096046934	185072482	/nfs/dbraw/zinc/07/24/82/185072482.db2.gz	MGCGQGONTAEEHU-QGZVFWFLSA-N	1	1	288.439	2.118	40	0		CEABMO
c1ccc(CN2C[C@@H]3C[NH+](Cc4cccnc4)C[C@H]3C2)nc1	ZINC000096053740	185074046	/nfs/dbraw/zinc/07/40/46/185074046.db2.gz	KKKJJFQEUFFWDH-IRXDYDNUSA-N	1	1	294.402	2.040	40	0		CEABMO
COC[C@]12CCCO[C@H]1CC[N@@H+](Cc1cccnc1)C2	ZINC000096056726	185078021	/nfs/dbraw/zinc/07/80/21/185078021.db2.gz	MUKJZWFPHMTUTQ-JKSUJKDBSA-N	1	1	276.380	2.099	40	0		CEABMO
c1cncc(O[C@H]2CO[C@]3(CC[N@H+](CC4CCC4)C3)C2)c1	ZINC000096072450	185088559	/nfs/dbraw/zinc/08/85/59/185088559.db2.gz	LVHJIQZLIHSNQM-IAGOWNOFSA-N	1	1	288.391	2.494	40	0		CEABMO
CCO[C@H]1CO[C@]2(C1)CCC[N@H+](Cc1cc(C)on1)C2	ZINC000096107226	185099838	/nfs/dbraw/zinc/09/98/38/185099838.db2.gz	BGGLIUCFDBYKLH-CABCVRRESA-N	1	1	280.368	2.143	40	0		CEABMO
CCO[C@H]1CO[C@]2(C1)CCC[N@@H+](Cc1cc(C)on1)C2	ZINC000096107226	185099840	/nfs/dbraw/zinc/09/98/40/185099840.db2.gz	BGGLIUCFDBYKLH-CABCVRRESA-N	1	1	280.368	2.143	40	0		CEABMO
Cc1nc(COCc2cnc3n2CC[NH2+][C@H]3C)cs1	ZINC000096109865	185100154	/nfs/dbraw/zinc/10/01/54/185100154.db2.gz	WAWVWFIXEOFDTO-VIFPVBQESA-N	1	1	278.381	2.029	40	0		CEABMO
Cc1ccc(CN2C[C@@H]3C[N@@H+]([C@@H]4CCOC4)C[C@@H]3C2)cc1	ZINC000107196342	186162429	/nfs/dbraw/zinc/16/24/29/186162429.db2.gz	MFMWQNLJODQSEO-FGTMMUONSA-N	1	1	286.419	2.148	40	0		CEABMO
O=C1NCC[C@]12CCC[N@@H+](Cc1cccs1)CC2	ZINC000108530422	186222736	/nfs/dbraw/zinc/22/27/36/186222736.db2.gz	CRCXRIMXKQWMDM-AWEZNQCLSA-N	1	1	264.394	2.240	40	0		CEABMO
COc1ccccc1[C@@H]1CN(C(C)=O)CC[N@@H+]1C(C)C	ZINC000072366562	363131618	/nfs/dbraw/zinc/13/16/18/363131618.db2.gz	NBKKONMMTITWQJ-HNNXBMFYSA-N	1	1	276.380	2.309	40	0		CEABMO
COc1ccccc1[C@@H]1CN(C(C)=O)CC[N@H+]1C(C)C	ZINC000072366562	363131625	/nfs/dbraw/zinc/13/16/25/363131625.db2.gz	NBKKONMMTITWQJ-HNNXBMFYSA-N	1	1	276.380	2.309	40	0		CEABMO
O=C1N(C2CCCCC2)C[C@H]2C[N@H+](C3CCC3)CCN12	ZINC000077266870	363546511	/nfs/dbraw/zinc/54/65/11/363546511.db2.gz	XMZAXWSEPOPAMD-OAHLLOKOSA-N	1	1	277.412	2.293	40	0	biogenic,in-vitro	CEABMO
CN1c2cccnc2C[N@@H+](C2CCCC2)CC[C@H]1CO	ZINC000225496049	283267592	/nfs/dbraw/zinc/26/75/92/283267592.db2.gz	AZOQNDLDAAABDG-AWEZNQCLSA-N	1	1	275.396	2.027	40	0	biogenic,in-vitro	CEABMO
N[C@@H](CC[C@H]([NH3+])C(=O)c1ccccc1)C(=O)c1ccccc1	ZINC000001608370	361211589	/nfs/dbraw/zinc/21/15/89/361211589.db2.gz	NXDLNLVUCIDRBX-HOTGVXAUSA-N	1	1	296.370	2.187	40	0		CEABMO
CC(=O)c1cccc(NC(=O)[C@@H]2CCC[N@H+](C)C2)c1	ZINC000082333252	363766579	/nfs/dbraw/zinc/76/65/79/363766579.db2.gz	PZIFUDLUTOHULH-CYBMUJFWSA-N	1	1	260.337	2.170	40	0		CEABMO
CCn1cc(C[N@H+]2CCC[C@@H](c3cnccn3)C2)cn1	ZINC000012252724	361375236	/nfs/dbraw/zinc/37/52/36/361375236.db2.gz	HVVXFSAWJWYWQD-CQSZACIVSA-N	1	1	271.368	2.073	40	0		CEABMO
Cc1nn(C)cc1C[NH2+]Cc1cccc(F)c1F	ZINC000012395225	361382327	/nfs/dbraw/zinc/38/23/27/361382327.db2.gz	HNHCDVSOVXJXCJ-UHFFFAOYSA-N	1	1	251.280	2.297	40	0		CEABMO
COc1ccc(OC)c(CN2C[C@@H]3CCC[N@H+]3C[C@H]2C)c1	ZINC000019575080	361542981	/nfs/dbraw/zinc/54/29/81/361542981.db2.gz	VSJROCKNJFVGFJ-HIFRSBDPSA-N	1	1	290.407	2.372	40	0		CEABMO
CC[NH+]1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000028210995	361668267	/nfs/dbraw/zinc/66/82/67/361668267.db2.gz	JDACWCRWZDVTHR-UHFFFAOYSA-N	1	1	286.297	2.483	40	0		CEABMO
C[N@@H+](Cc1cccs1)[C@H]1CCC[C@@H]2CN(C(N)=O)C[C@@H]21	ZINC000096183128	364407401	/nfs/dbraw/zinc/40/74/01/364407401.db2.gz	UERJJLIMCJTDDG-XBFCOCLRSA-N	1	1	293.436	2.359	40	0		CEABMO
CC(C)C[N@H+]1CC[C@@]2(CCN(Cc3ccccn3)C2=O)C1	ZINC000096159487	364403561	/nfs/dbraw/zinc/40/35/61/364403561.db2.gz	BABSSZUTTLNUPW-QGZVFWFLSA-N	1	1	287.407	2.162	40	0		CEABMO
Cc1ccc(C[N@H+]2C[C@@H]3[C@H](C2)OCCN3C(C)C)cc1	ZINC000096248681	364417139	/nfs/dbraw/zinc/41/71/39/364417139.db2.gz	GEXFPRQFOCPIDD-SJORKVTESA-N	1	1	274.408	2.288	40	0		CEABMO
CCC[C@@H](C)[N@H+]1CCC[C@]2(CN(c3ncccn3)C2=O)C1	ZINC000585099697	367177343	/nfs/dbraw/zinc/17/73/43/367177343.db2.gz	YMCUZPKWOHVKKM-CZUORRHYSA-N	1	1	288.395	2.094	40	0		CEABMO
C[NH+]1CC2(C1)C[C@@H](CCOCc1ccccn1)CCO2	ZINC000247965519	371150112	/nfs/dbraw/zinc/15/01/12/371150112.db2.gz	HKNWSAHYDAATGE-AWEZNQCLSA-N	1	1	276.380	2.099	40	0		CEABMO
CCO[C@@H]1CSC2(C[NH+](Cc3cccnc3)C2)C1	ZINC000253385810	371513263	/nfs/dbraw/zinc/51/32/63/371513263.db2.gz	UQLPXGDPQAVOMY-ZDUSSCGKSA-N	1	1	264.394	2.178	40	0		CEABMO
c1csc(CN2CC[N@H+]3C[C@@H](OCC4CC4)C[C@H]3C2)c1	ZINC000253588671	371529971	/nfs/dbraw/zinc/52/99/71/371529971.db2.gz	NRAXYOAGABLPCC-GJZGRUSLSA-N	1	1	292.448	2.433	40	0		CEABMO
FC(F)(F)Cn1nccc1C[NH2+]Cc1ccco1	ZINC000256051382	190003974	/nfs/dbraw/zinc/00/39/74/190003974.db2.gz	IYEXZARFKDCVIT-UHFFFAOYSA-N	1	1	259.231	2.328	40	0		CEABMO
Cc1cccc(C[N@H+]2C[C@@H](O)[C@H](Oc3ccccc3)C2)n1	ZINC000257200123	190011048	/nfs/dbraw/zinc/01/10/48/190011048.db2.gz	ACCLYKMPMCTHNR-IAGOWNOFSA-N	1	1	284.359	2.014	40	0		CEABMO
CC(=O)N1CCC[C@H]2[N@@H+](Cc3cccnc3)CCC[C@@]21C	ZINC000257247345	190019560	/nfs/dbraw/zinc/01/95/60/190019560.db2.gz	IYOMIUFTIZUEOD-SJORKVTESA-N	1	1	287.407	2.447	40	0		CEABMO
CCOc1ccc(C[N@H+]2CC[C@@]3(CCCO3)[C@@H](O)C2)cc1	ZINC000257250098	190019804	/nfs/dbraw/zinc/01/98/04/190019804.db2.gz	JLAPQXRBFSIJNC-IRXDYDNUSA-N	1	1	291.391	2.201	40	0		CEABMO
Cc1cn(C)c([C@@H]2CC[N@@H+](Cc3scnc3C)C2)n1	ZINC000257273528	190024576	/nfs/dbraw/zinc/02/45/76/190024576.db2.gz	NGZGKIRIMXBYGV-GFCCVEGCSA-N	1	1	276.409	2.483	40	0		CEABMO
Cc1ccnc([C@@H]2CC[N@@H+](Cc3ccccn3)C2)n1	ZINC000257299908	190029131	/nfs/dbraw/zinc/02/91/31/190029131.db2.gz	RSDLFLKZDBCAMS-CYBMUJFWSA-N	1	1	254.337	2.170	40	0		CEABMO
Cc1ccnc([C@H]2CC[N@@H+](Cc3ccccn3)C2)n1	ZINC000257299909	190029717	/nfs/dbraw/zinc/02/97/17/190029717.db2.gz	RSDLFLKZDBCAMS-ZDUSSCGKSA-N	1	1	254.337	2.170	40	0		CEABMO
Cc1cc(N)cc([C@@H]2CN(Cc3cncs3)CCO2)[nH+]1	ZINC000257328673	190034616	/nfs/dbraw/zinc/03/46/16/190034616.db2.gz	XGQUWSCYMJRCHQ-AWEZNQCLSA-N	1	1	290.392	2.002	40	0		CEABMO
Cc1nc(N)sc1-c1cncc([C@H]2CCC[N@H+](C)C2)n1	ZINC000257327226	190034876	/nfs/dbraw/zinc/03/48/76/190034876.db2.gz	XAOFQNFTSRRGKC-JTQLQIEISA-N	1	1	289.408	2.300	40	0		CEABMO
COc1ccc([C@@H]2[C@@H]([NH3+])C(=O)N2c2ccccc2)cc1OC	ZINC000072227344	394595514	/nfs/dbraw/zinc/59/55/14/394595514.db2.gz	VEIVVGZNCWAKLY-HZPDHXFCSA-N	1	1	298.342	2.119	40	0		CEABMO
[NH3+][C@H]1C(=O)N(Cc2ccccc2)[C@H]1c1cccs1	ZINC000072228117	394596092	/nfs/dbraw/zinc/59/60/92/394596092.db2.gz	OEQATJNDAUGNDQ-OLZOCXBDSA-N	1	1	258.346	2.159	40	0		CEABMO
Cc1ccc([C@@H]2[C@@H]([NH3+])C(=O)N2c2ccc3c(c2)OCO3)cc1	ZINC000072227560	394596395	/nfs/dbraw/zinc/59/63/95/394596395.db2.gz	UQRUKIMKBPJUPX-HZPDHXFCSA-N	1	1	296.326	2.139	40	0		CEABMO
COCCC(=O)N1CCC[C@@H]2[C@H]1CCCC[N@H+]2CC1CC1	ZINC000257235822	292270922	/nfs/dbraw/zinc/27/09/22/292270922.db2.gz	GZQXVGHTDSXQNI-HZPDHXFCSA-N	1	1	294.439	2.278	40	0		CEABMO
Cc1ccc([C@H]2[C@H]([NH3+])C(=O)N2c2ccccc2)cc1	ZINC000059103824	292280152	/nfs/dbraw/zinc/28/01/52/292280152.db2.gz	QIKATRSAPXONBD-GJZGRUSLSA-N	1	1	252.317	2.410	40	0		CEABMO
COc1ccc(C[C@H]([NH3+])C(=O)OCc2ccccc2)cc1	ZINC000006484328	170204940	/nfs/dbraw/zinc/20/49/40/170204940.db2.gz	JYRNVSKKZGIZOA-INIZCTEOSA-N	1	1	285.343	2.308	40	0		CEABMO
CCCNC(=O)c1cncc(C[C@@H]2CCC[N@@H+](C)C2)c1	ZINC000072369329	176383965	/nfs/dbraw/zinc/38/39/65/176383965.db2.gz	QHYKUTGPWWJLBK-ZDUSSCGKSA-N	1	1	275.396	2.106	40	0		CEABMO
Cc1nc(Nc2ncccn2)cc([C@H]2CCC[N@@H+]2C)n1	ZINC000072382617	176388398	/nfs/dbraw/zinc/38/83/98/176388398.db2.gz	YPVFHVYNZZQPNC-GFCCVEGCSA-N	1	1	270.340	2.085	40	0		CEABMO
CNc1cccc([C@@H]2CCCN(c3ncccn3)C2)[nH+]1	ZINC000072356623	273975647	/nfs/dbraw/zinc/97/56/47/273975647.db2.gz	USMKRFOHACEPLX-GFCCVEGCSA-N	1	1	269.352	2.297	40	0		CEABMO
CNC(=O)[C@H]1CCC[N@@H+](Cc2ccc(Cl)cc2)C1	ZINC000028220872	277251260	/nfs/dbraw/zinc/25/12/60/277251260.db2.gz	KNYSEWHMZXNEQO-LBPRGKRZSA-N	1	1	266.772	2.298	40	0		CEABMO
CCOC(=O)c1c[nH+]c2cc(OC)c(OC)cc2c1NC	ZINC000050843254	521576660	/nfs/dbraw/zinc/57/66/60/521576660.db2.gz	UBDZRAHEYKQEGT-UHFFFAOYSA-N	1	1	290.319	2.470	40	0		CEABMO
COc1ccc([C@H]([NH3+])c2nc(-c3ccco3)n[nH]2)cc1	ZINC000095533646	185007480	/nfs/dbraw/zinc/00/74/80/185007480.db2.gz	MYVURWKMKWIVJZ-LBPRGKRZSA-N	1	1	270.292	2.121	40	0		CEABMO
OC[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C(F)(F)F	ZINC000095932013	185032680	/nfs/dbraw/zinc/03/26/80/185032680.db2.gz	JVJIYCXIYVNRHB-VXGBXAGGSA-N	1	1	259.271	2.289	40	0		CEABMO
CO[C@@H]1CC[C@H]2[C@H]1OCC[N@@H+]2Cc1ccsc1	ZINC000096041391	185069138	/nfs/dbraw/zinc/06/91/38/185069138.db2.gz	NCKFUSYYPXUNBN-YNEHKIRRSA-N	1	1	253.367	2.126	40	0		CEABMO
CO[C@@H]1CC[C@H]2[C@H]1OCC[N@H+]2Cc1ccsc1	ZINC000096041391	185069139	/nfs/dbraw/zinc/06/91/39/185069139.db2.gz	NCKFUSYYPXUNBN-YNEHKIRRSA-N	1	1	253.367	2.126	40	0		CEABMO
c1ccc(C[N@H+]2CC[C@H]3C[C@H](c4ccncn4)O[C@@H]3C2)nc1	ZINC000096046120	185071399	/nfs/dbraw/zinc/07/13/99/185071399.db2.gz	WXXFJQKVQNJFMP-IAOVAPTHSA-N	1	1	296.374	2.224	40	0		CEABMO
CN1C(=O)CCC[C@@]12CCC[N@H+](Cc1nccs1)C2	ZINC000096049957	185074870	/nfs/dbraw/zinc/07/48/70/185074870.db2.gz	VXBHDAGMIJSWMI-AWEZNQCLSA-N	1	1	279.409	2.120	40	0		CEABMO
CN1C(=O)CCC[C@@]12CCC[N@@H+](Cc1nccs1)C2	ZINC000096049957	185074871	/nfs/dbraw/zinc/07/48/71/185074871.db2.gz	VXBHDAGMIJSWMI-AWEZNQCLSA-N	1	1	279.409	2.120	40	0		CEABMO
O=C1CC[C@@H]2[C@@H](CC[N@H+]2Cc2cccnc2)N1CC1CC1	ZINC000096056550	185077724	/nfs/dbraw/zinc/07/77/24/185077724.db2.gz	MOJGEUIEIYRFGH-HZPDHXFCSA-N	1	1	285.391	2.057	40	0		CEABMO
Cc1noc(C)c1C[N@@H+]1CC[C@H]2C[C@@H](C)O[C@@H]2C1	ZINC000096070658	185086882	/nfs/dbraw/zinc/08/68/82/185086882.db2.gz	LKUAANZEFSRWDV-LJWDBELGSA-N	1	1	250.342	2.291	40	0		CEABMO
C[N@H+]1CCC[C@]12CCCN(C(=O)Cc1cccs1)C2	ZINC000096071403	185087167	/nfs/dbraw/zinc/08/71/67/185087167.db2.gz	ISPAALWOZRBGHF-OAHLLOKOSA-N	1	1	278.421	2.377	40	0		CEABMO
COc1ccccc1C[N@@H+]1CC[C@]2(C[C@H](OC)CO2)C1	ZINC000096107580	185099449	/nfs/dbraw/zinc/09/94/49/185099449.db2.gz	DQMDGMOIYJJWNS-HOCLYGCPSA-N	1	1	277.364	2.075	40	0		CEABMO
C[N@H+]1CC[C@H](c2nnc(COc3ccc(F)cc3)o2)C1	ZINC000049170383	362342892	/nfs/dbraw/zinc/34/28/92/362342892.db2.gz	DYBFRVJYYXLAGI-JTQLQIEISA-N	1	1	277.299	2.207	40	0	biogenic,in-vitro	CEABMO
c1cncc(-c2nnc([C@H]3CC[N@H+](CC4CC4)C3)o2)c1	ZINC000049169718	362343224	/nfs/dbraw/zinc/34/32/24/362343224.db2.gz	YTJGGQYSNXJCEL-ZDUSSCGKSA-N	1	1	270.336	2.331	40	0	biogenic,in-vitro	CEABMO
[NH3+][C@H](C[C@@H](c1ccc(Cl)cc1)[NH+]1CCCC1)C(=O)[O-]	ZINC000409440106	344889827	/nfs/dbraw/zinc/88/98/27/344889827.db2.gz	JPBIMQFWRADWCT-OLZOCXBDSA-N	1	1	282.771	2.279	40	0		CEABMO
CCn1cc(C[N@H+]2CC[C@@H](c3nc(C)c[nH]3)C2)c(C)n1	ZINC000585181412	345009025	/nfs/dbraw/zinc/00/90/25/345009025.db2.gz	ISCUSGFWRFSICN-CYBMUJFWSA-N	1	1	273.384	2.232	40	0		CEABMO
Cc1ncccc1C[N@H+]1CC[C@@](O)(COc2ccccc2)C1	ZINC000585274255	345009295	/nfs/dbraw/zinc/00/92/95/345009295.db2.gz	HUUMIAVVSUBYHQ-SFHVURJKSA-N	1	1	298.386	2.406	40	0		CEABMO
CC(=O)N1CC[C@@H]2[C@H]1CCCC[N@H+]2CC1(O)CCCCC1	ZINC000585282220	345009883	/nfs/dbraw/zinc/00/98/83/345009883.db2.gz	BVIIFSLLWGMIJK-HZPDHXFCSA-N	1	1	294.439	2.157	40	0		CEABMO
C[C@@H]1CCCC[N@@H+]1c1ccc(N)cc1-n1cnnc1	ZINC000070461814	363088434	/nfs/dbraw/zinc/08/84/34/363088434.db2.gz	FTEFAUKEBHJSLZ-LLVKDONJSA-N	1	1	257.341	2.228	40	0		CEABMO
C[C@@H]1CCCC[N@H+]1c1ccc(N)cc1-n1cnnc1	ZINC000070461814	363088440	/nfs/dbraw/zinc/08/84/40/363088440.db2.gz	FTEFAUKEBHJSLZ-LLVKDONJSA-N	1	1	257.341	2.228	40	0		CEABMO
CC[N@H+](CC(=O)[O-])C[C@@H]1CCC[NH+](Cc2ccccc2)C1	ZINC000079393399	363594287	/nfs/dbraw/zinc/59/42/87/363594287.db2.gz	VKTHBJSYRBBIES-INIZCTEOSA-N	1	1	290.407	2.305	40	0		CEABMO
CC[NH+](CC(=O)[O-])C[C@@H]1CCC[N@H+](Cc2ccccc2)C1	ZINC000079393399	363594295	/nfs/dbraw/zinc/59/42/95/363594295.db2.gz	VKTHBJSYRBBIES-INIZCTEOSA-N	1	1	290.407	2.305	40	0		CEABMO
CC[NH+](CC(=O)[O-])C[C@@H]1CCC[N@@H+](Cc2ccccc2)C1	ZINC000079393399	363594299	/nfs/dbraw/zinc/59/42/99/363594299.db2.gz	VKTHBJSYRBBIES-INIZCTEOSA-N	1	1	290.407	2.305	40	0		CEABMO
CCOC(=O)c1ccc(NC(=O)[C@@H]2CCC[N@@H+](C)C2)cc1	ZINC000081223412	363706764	/nfs/dbraw/zinc/70/67/64/363706764.db2.gz	BJHHWNNCPGMSSF-CYBMUJFWSA-N	1	1	290.363	2.144	40	0		CEABMO
CC(C)[C@H](c1nnnn1C[C@@H]1CCCO1)[NH+]1CCCCC1	ZINC000000883955	361194140	/nfs/dbraw/zinc/19/41/40/361194140.db2.gz	UPCNQTQSEZLSPX-UONOGXRCSA-N	1	1	293.415	2.035	40	0		CEABMO
C[NH+](C)C[C@@H](CN1CCCC1)C(=O)c1ccccc1	ZINC000001571872	361209076	/nfs/dbraw/zinc/20/90/76/361209076.db2.gz	PESNANQSYBTIMQ-HNNXBMFYSA-N	1	1	260.381	2.143	40	0		CEABMO
COc1ccc(C(=O)[C@@H]([NH2+]CCO)c2ccccc2)cc1	ZINC000001667198	361214953	/nfs/dbraw/zinc/21/49/53/361214953.db2.gz	FOQBXFBGHNBNIL-INIZCTEOSA-N	1	1	285.343	2.201	40	0		CEABMO
C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@]1(O)CC[NH2+]Cc1ccccc1	ZINC000002260874	361231855	/nfs/dbraw/zinc/23/18/55/361231855.db2.gz	JKYJLJRYZGZWSE-HLLBOEOZSA-N	1	1	276.424	2.258	40	0		CEABMO
C[n+]1ccc(-c2[nH][nH]c(=O)c2-c2ccccc2)cc1	ZINC000004396720	361316369	/nfs/dbraw/zinc/31/63/69/361316369.db2.gz	ACLIJOBPOIFOEW-UHFFFAOYSA-O	1	1	252.297	2.274	40	0		CEABMO
C[N@@H+]1CC(=O)N2CCCC[C@H]2[C@H](c2ccccc2)C1	ZINC000004962031	361328219	/nfs/dbraw/zinc/32/82/19/361328219.db2.gz	XLQKRJBDBSWEHZ-GJZGRUSLSA-N	1	1	258.365	2.097	40	0		CEABMO
COc1ccc2c(c1)[C@@]1(C)C[C@H](C[N@H+](C)CC1)[C@@H]2O	ZINC000005492769	361333433	/nfs/dbraw/zinc/33/34/33/361333433.db2.gz	LMCITFOGXAUPRN-XFBWCDHKSA-N	1	1	261.365	2.342	40	0		CEABMO
Cc1ncc2c(n1)C[C@@H]1CC[C@H]2[N@H+]1Cc1ccncc1	ZINC000019287512	361526844	/nfs/dbraw/zinc/52/68/44/361526844.db2.gz	DCNPDQBSPUDKOG-XJKSGUPXSA-N	1	1	266.348	2.442	40	0		CEABMO
Cc1ncc2c(n1)C[C@@H]1CC[C@H]2[N@@H+]1Cc1ccncc1	ZINC000019287512	361526850	/nfs/dbraw/zinc/52/68/50/361526850.db2.gz	DCNPDQBSPUDKOG-XJKSGUPXSA-N	1	1	266.348	2.442	40	0		CEABMO
CCc1cc(=O)[nH]c([C@@H]2CCC[N@@H+](Cc3ccncc3)C2)n1	ZINC000019522518	361541066	/nfs/dbraw/zinc/54/10/66/361541066.db2.gz	AFDAUQGIYIERMF-CQSZACIVSA-N	1	1	298.390	2.107	40	0		CEABMO
CCN(CC)CC[NH2+]Cc1cc(OC)c(OC)c(OC)c1	ZINC000019919124	361567697	/nfs/dbraw/zinc/56/76/97/361567697.db2.gz	PYOMOFZNPNZSPQ-UHFFFAOYSA-N	1	1	296.411	2.144	40	0		CEABMO
c1cnc2c(c1)[nH]c(-c1cccnc1)c2C[NH+]1CCOCC1	ZINC000019718039	361547877	/nfs/dbraw/zinc/54/78/77/361547877.db2.gz	PGCOVXFCVCSQSW-UHFFFAOYSA-N	1	1	294.358	2.457	40	0		CEABMO
COC[C@@H]1CCC[C@]12C[N@H+](Cc1cccc(C)n1)CCO2	ZINC000096160843	364402675	/nfs/dbraw/zinc/40/26/75/364402675.db2.gz	GBJHZCNNFYCAIU-RDJZCZTQSA-N	1	1	290.407	2.408	40	0		CEABMO
COC[C@@H]1CCC[C@]12C[N@@H+](Cc1cccc(C)n1)CCO2	ZINC000096160843	364402683	/nfs/dbraw/zinc/40/26/83/364402683.db2.gz	GBJHZCNNFYCAIU-RDJZCZTQSA-N	1	1	290.407	2.408	40	0		CEABMO
CC[N@H+]1CCC[C@@]12CCCN(C(=O)c1ccccn1)C2	ZINC000096203216	364410624	/nfs/dbraw/zinc/41/06/24/364410624.db2.gz	NKBCFHWJSMBBIW-MRXNPFEDSA-N	1	1	273.380	2.172	40	0		CEABMO
CC(C)[C@@H]1CO[C@@]2(CC[N@@H+](Cc3cnn(C)c3)C2)C1	ZINC000096218252	364413194	/nfs/dbraw/zinc/41/31/94/364413194.db2.gz	ODYKVAIZCSTCFV-GJZGRUSLSA-N	1	1	263.385	2.057	40	0		CEABMO
O=C1CCC[C@]2(CCC[N@@H+](Cc3ccsc3)C2)N1	ZINC000096229650	364414559	/nfs/dbraw/zinc/41/45/59/364414559.db2.gz	BGKOFRSCEKCTAY-CQSZACIVSA-N	1	1	264.394	2.383	40	0		CEABMO
CC(C)Nc1ncnc2c1CC[N@@H+](Cc1ccco1)CC2	ZINC000096255508	364417970	/nfs/dbraw/zinc/41/79/70/364417970.db2.gz	SGRXLOHRASPIOZ-UHFFFAOYSA-N	1	1	286.379	2.491	40	0		CEABMO
c1cc(C[N@H+]2CCc3ncnc(C4CC4)c3CC2)ccn1	ZINC000096255086	364418753	/nfs/dbraw/zinc/41/87/53/364418753.db2.gz	SRRKZNJZHIXVKJ-UHFFFAOYSA-N	1	1	280.375	2.350	40	0		CEABMO
CCOC(=O)c1cn(-c2cc(C)[nH+]c3ccccc32)nn1	ZINC000218790368	370212990	/nfs/dbraw/zinc/21/29/90/370212990.db2.gz	ZDFRYXBTBUNLLH-UHFFFAOYSA-N	1	1	282.303	2.301	40	0		CEABMO
C[C@@H]1CCC[N@@H+](CCCNC(=S)Nc2cccnc2)C1	ZINC000225738152	370315098	/nfs/dbraw/zinc/31/50/98/370315098.db2.gz	LLFOIJNNKHMPLE-CYBMUJFWSA-N	1	1	292.452	2.490	40	0		CEABMO
CCCNC(=O)NCc1ccccc1-n1cc[nH+]c1C	ZINC000225773242	370316077	/nfs/dbraw/zinc/31/60/77/370316077.db2.gz	KKDHFUHQVUZYRH-UHFFFAOYSA-N	1	1	272.352	2.390	40	0		CEABMO
[NH3+]C[C@@H]1[C@H]2CN(Cc3ccc(Cl)c(F)c3)C[C@H]21	ZINC000247636761	371131156	/nfs/dbraw/zinc/13/11/56/371131156.db2.gz	FAAZCSOJONMFIE-RTCCRHLQSA-N	1	1	254.736	2.116	40	0		CEABMO
COc1ccccc1C[NH+]1CC2(C1)C[C@@H](OC)CS2	ZINC000248132522	371163712	/nfs/dbraw/zinc/16/37/12/371163712.db2.gz	LMLJJINXLFDGNA-CYBMUJFWSA-N	1	1	279.405	2.402	40	0		CEABMO
C[N@H+]1CCC[C@@H](c2cncc(-c3ccc(CO)cc3)n2)C1	ZINC000257198283	190010749	/nfs/dbraw/zinc/01/07/49/190010749.db2.gz	YBMLRUCEBXYVSF-OAHLLOKOSA-N	1	1	283.375	2.445	40	0		CEABMO
CNc1ncccc1C[N@H+]1CCC[C@@](C)(c2cc[nH]n2)C1	ZINC000257238682	190017834	/nfs/dbraw/zinc/01/78/34/190017834.db2.gz	HMBGDUWHBFKQBM-MRXNPFEDSA-N	1	1	285.395	2.400	40	0		CEABMO
O[C@H]1C[N@@H+](CCCc2ccccc2)CC[C@@]12CCCO2	ZINC000257250295	190019861	/nfs/dbraw/zinc/01/98/61/190019861.db2.gz	JLYACPVCJHWCEA-IRXDYDNUSA-N	1	1	275.392	2.235	40	0		CEABMO
Cc1n[nH]cc1-c1cnc(C[C@H]2CCC[N@H+](C)C2)cn1	ZINC000257257914	190021378	/nfs/dbraw/zinc/02/13/78/190021378.db2.gz	KRPLVXHAIRBZJG-GFCCVEGCSA-N	1	1	271.368	2.059	40	0		CEABMO
Cc1cccc(C[N@H+]2CC[C@H]3[C@H]2CCN3c2ncccn2)n1	ZINC000306131008	376539501	/nfs/dbraw/zinc/53/95/01/376539501.db2.gz	JURDHVGAHBNIKR-CVEARBPZSA-N	1	1	295.390	2.033	40	0		CEABMO
c1cncc(CN2CC[C@@H]3[C@@H]2CC[N@@H+]3CC2CC2)c1	ZINC000503726552	379071545	/nfs/dbraw/zinc/07/15/45/379071545.db2.gz	ZHEVNBPFRNKSDM-CVEARBPZSA-N	1	1	257.381	2.140	40	0		CEABMO
Cc1ccc(NC(=O)[C@@H]2C[N@H+](C)Cc3cn(C)nc32)c(C)c1	ZINC000019701310	394469947	/nfs/dbraw/zinc/46/99/47/394469947.db2.gz	KPUJCUJVBAJJHE-CQSZACIVSA-N	1	1	298.390	2.205	40	0		CEABMO
Cc1cc(CCO)c[nH+]c1N1CCc2ccccc2C1	ZINC000072222860	394594655	/nfs/dbraw/zinc/59/46/55/394594655.db2.gz	KCOMLIRDXHRIPO-UHFFFAOYSA-N	1	1	268.360	2.488	40	0		CEABMO
COc1ccc([C@@H]2[C@@H]([NH3+])C(=O)N2c2ccccc2)cc1	ZINC000072227336	394595258	/nfs/dbraw/zinc/59/52/58/394595258.db2.gz	ZFSHBMDUBOZWOL-HUUCEWRRSA-N	1	1	268.316	2.110	40	0		CEABMO
COc1ccc(N2C(=O)[C@@H]([NH3+])[C@H]2c2cccs2)cc1	ZINC000072227130	394595561	/nfs/dbraw/zinc/59/55/61/394595561.db2.gz	TUGVCJNUHGCWQR-QWHCGFSZSA-N	1	1	274.345	2.172	40	0		CEABMO
COc1cccc(N2C(=O)[C@H]([NH3+])[C@@H]2c2ccccc2F)c1	ZINC000072227761	394596405	/nfs/dbraw/zinc/59/64/05/394596405.db2.gz	WLKLXUJSOBBTIW-CABCVRRESA-N	1	1	286.306	2.250	40	0		CEABMO
Cc1cccc(N2C(=O)[C@@H]([NH3+])[C@@H]2c2ccc3c(c2)OCO3)c1	ZINC000072227419	394596521	/nfs/dbraw/zinc/59/65/21/394596521.db2.gz	QSFRUXLWQVPDDO-HOTGVXAUSA-N	1	1	296.326	2.139	40	0		CEABMO
CC[C@H]1CO[C@]2(C1)CCCN(CCC[NH+](C)C)C2	ZINC000096089832	394676987	/nfs/dbraw/zinc/67/69/87/394676987.db2.gz	YVLONVXWSIRREV-CABCVRRESA-N	1	1	254.418	2.219	40	0		CEABMO
O[C@H]1CC[N@H+](Cc2cc(Br)cs2)C1	ZINC000038539046	174145464	/nfs/dbraw/zinc/14/54/64/174145464.db2.gz	ZZEJLNNATPUHNO-QMMMGPOBSA-N	1	1	262.172	2.077	40	0		CEABMO
O[C@H]1CC[N@@H+](Cc2cc(Br)cs2)C1	ZINC000038539046	174145466	/nfs/dbraw/zinc/14/54/66/174145466.db2.gz	ZZEJLNNATPUHNO-QMMMGPOBSA-N	1	1	262.172	2.077	40	0		CEABMO
[NH3+][C@@H]1C(=O)N(Cc2ccccc2)[C@H]1c1ccccc1	ZINC000072228111	176343220	/nfs/dbraw/zinc/34/32/20/176343220.db2.gz	JAUNCKDTAJDBHE-GJZGRUSLSA-N	1	1	252.317	2.097	40	0		CEABMO
C[N@H+]1CCC[C@H](c2ccnc(Nc3cnccn3)c2)C1	ZINC000072364989	176380140	/nfs/dbraw/zinc/38/01/40/176380140.db2.gz	JGYJGKZGDZEEGU-ZDUSSCGKSA-N	1	1	269.352	2.424	40	0		CEABMO
C[N@H+]1CCC[C@H](c2cncc(NCCc3ccccn3)n2)C1	ZINC000072365198	176380774	/nfs/dbraw/zinc/38/07/74/176380774.db2.gz	VVOBNUOHOYQLJD-AWEZNQCLSA-N	1	1	297.406	2.335	40	0		CEABMO
Cc1nccn1CCNc1cccc([C@H]2CCC[N@@H+]2C)n1	ZINC000072365343	176380779	/nfs/dbraw/zinc/38/07/79/176380779.db2.gz	RHZSXONPDUSARO-OAHLLOKOSA-N	1	1	285.395	2.465	40	0		CEABMO
Cn1c(C[N@H+]2CC[C@H](c3cc[nH]n3)C2)nc2ccccc21	ZINC000072385299	176390155	/nfs/dbraw/zinc/39/01/55/176390155.db2.gz	JIFMVJWGZCNXFY-LBPRGKRZSA-N	1	1	281.363	2.286	40	0		CEABMO
CNc1ncccc1C[N@H+]1CCC[C@@H](c2cnccn2)C1	ZINC000072386205	176391365	/nfs/dbraw/zinc/39/13/65/176391365.db2.gz	XLBFYMMUMRQEEQ-CYBMUJFWSA-N	1	1	283.379	2.293	40	0		CEABMO
Cc1nc(CN2C[C@H]3CCC[N@H+]3C[C@H]2C)c2ccccn12	ZINC000072397557	176394940	/nfs/dbraw/zinc/39/49/40/176394940.db2.gz	IFBMKCAVZBSSAN-UKRRQHHQSA-N	1	1	284.407	2.311	40	0		CEABMO
Cc1nc(CN2C[C@H]3CCC[N@@H+]3C[C@H]2C)c2ccccn12	ZINC000072397557	176394941	/nfs/dbraw/zinc/39/49/41/176394941.db2.gz	IFBMKCAVZBSSAN-UKRRQHHQSA-N	1	1	284.407	2.311	40	0		CEABMO
C[C@H]1Cc2ccccc2N1C(=O)[C@H]1CCC[N@@H+](C)C1	ZINC000082337170	280031382	/nfs/dbraw/zinc/03/13/82/280031382.db2.gz	KQPIBFWLXXQLNF-JSGCOSHPSA-N	1	1	258.365	2.306	40	0		CEABMO
CCCNC(=O)NCCC[N@H+]1CCCC[C@H]1CC	ZINC000260802872	328070928	/nfs/dbraw/zinc/07/09/28/328070928.db2.gz	OBFHCSABFKURFO-CYBMUJFWSA-N	1	1	255.406	2.350	40	0		CEABMO
COc1ccccc1C[NH2+]Cc1cnc(N2CCCC2)nc1	ZINC000062717821	333176159	/nfs/dbraw/zinc/17/61/59/333176159.db2.gz	ZMBPYBSKQFMZSJ-UHFFFAOYSA-N	1	1	298.390	2.375	40	0		CEABMO