smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Fc1cccc(Sc2nccc(N3CC[NH2+]CC3)n2)c1	ZINC000084739660	135035057	/nfs/dbraw/zinc/03/50/57/135035057.db2.gz	BTIMKDLQOJYTJL-UHFFFAOYSA-N	1	0	290.367	2.177	1	0		CEAFRO
COc1cccc2c1OC[C@@H]([NH2+]CCc1ccccn1)C2	ZINC000011667912	170432224	/nfs/dbraw/zinc/43/22/24/170432224.db2.gz	PTXBCUDKRWQUCE-HNNXBMFYSA-N	1	0	284.359	2.226	1	0		CEAFRO
CCCOC(=O)c1cc(OC)c(C[C@H](C)[NH3+])cc1OC	ZINC000013450430	170551162	/nfs/dbraw/zinc/55/11/62/170551162.db2.gz	WCFHJUFPNNTMGG-JTQLQIEISA-N	1	0	281.352	2.160	1	0		CEAFRO
COC(=O)[C@@H]1C[NH2+]CC[C@@H]1c1ccc(Cl)cc1	ZINC000026945696	171503742	/nfs/dbraw/zinc/50/37/42/171503742.db2.gz	DXRLHHQCJXYHPB-VXGBXAGGSA-N	1	0	253.729	2.206	1	0		CEAFRO
CCOC(=O)Nc1cccc(O[C@@H](C)C2=[NH+]CCN2)c1C	ZINC000027704165	171529332	/nfs/dbraw/zinc/52/93/32/171529332.db2.gz	ZNCZQVVDMCPVPO-NSHDSACASA-N	1	0	291.351	2.332	1	0		CEAFRO
Cc1ccc(OC[C@H](O)[C@@H](C)[NH2+]C(C)C)cc1C	ZINC000028226948	171552131	/nfs/dbraw/zinc/55/21/31/171552131.db2.gz	DYBVOBOVLLZZSV-HIFRSBDPSA-N	1	0	251.370	2.430	1	0		CEAFRO
CO[C@H](CO)[C@@H]([NH2+]C(C)(C)C)c1ccc(C)cc1	ZINC000040429386	174259440	/nfs/dbraw/zinc/25/94/40/174259440.db2.gz	VBPXUXBDTHUSIJ-KGLIPLIRSA-N	1	0	251.370	2.432	1	0		CEAFRO
O=C1c2ccccc2[N+](=O)C1c1ccc(CO)cc1	ZINC000045245165	175336310	/nfs/dbraw/zinc/33/63/10/175336310.db2.gz	MYBPORWQRKNLDG-UHFFFAOYSA-N	1	0	253.257	2.006	1	0		CEAFRO
COc1ccc2c(c1)oc1c2C[n+]2ccccc2NC1=O	ZINC000045369291	175363582	/nfs/dbraw/zinc/36/35/82/175363582.db2.gz	IADROWGKULIMIX-UHFFFAOYSA-O	1	0	281.291	2.343	1	0		CEAFRO
c1ccc(CCCc2ncc3c(n2)C[NH2+]CC3)cc1	ZINC000071331670	176125300	/nfs/dbraw/zinc/12/53/00/176125300.db2.gz	VZNGMUCKRQCWJI-UHFFFAOYSA-N	1	0	253.349	2.298	1	0		CEAFRO
CCC1=N[C@]2(CC[C@H]3C[N@H+](CC4CC4)C[C@H]32)C(=O)N1CC	ZINC000299842775	333187812	/nfs/dbraw/zinc/18/78/12/333187812.db2.gz	YFIOEZLKLJSAGW-VBQJREDUSA-N	1	0	289.423	2.148	1	0		CEAFRO
CC1(C)[C@@H]2CC[C@@H](C2)[C@@]1(C)NC(=O)C[NH+]1CCCC1	ZINC000005000558	170052571	/nfs/dbraw/zinc/05/25/71/170052571.db2.gz	ZDNKVMDVRGYNRM-DVOMOZLQSA-N	1	0	264.413	2.413	1	0		CEAFRO
C[C@H]1Nc2cc(N)[nH+]c(N)c2N=C1c1ccccc1	ZINC000006487715	170205531	/nfs/dbraw/zinc/20/55/31/170205531.db2.gz	UMTLVJKJSQGHJX-MRVPVSSYSA-N	1	0	253.309	2.181	1	0		CEAFRO
NC(=O)c1cccc2c1[C@@H]1CC[N@H+](CCCF)[C@@H]1CC2	ZINC000013740520	170585415	/nfs/dbraw/zinc/58/54/15/170585415.db2.gz	GGENIZGCFCBFDF-TZMCWYRMSA-N	1	0	276.355	2.249	1	0		CEAFRO
C[C@H](COc1ccccc1)[NH2+]C[C@H](O)c1ccc(O)cc1	ZINC000026725196	171496641	/nfs/dbraw/zinc/49/66/41/171496641.db2.gz	DRIXYVOPANOMAC-DYVFJYSZSA-N	1	0	287.359	2.483	1	0		CEAFRO
Clc1ccc2c(c1Cl)O[C@@H](C1=[NH+]CCN1)C2	ZINC000027647381	171526504	/nfs/dbraw/zinc/52/65/04/171526504.db2.gz	NKBMNIKXSHVKLV-MRVPVSSYSA-N	1	0	257.120	2.299	1	0		CEAFRO
CC(C)=CCC[C@H](C)C/C=C/C(=O)NC[C@@H]([NH3+])CCO	ZINC000040395303	174252642	/nfs/dbraw/zinc/25/26/42/174252642.db2.gz	BHXGDBUBPJCRLN-WSQYCBKMSA-N	1	0	282.428	2.141	1	0		CEAFRO
CC(C)Nc1nccc(-c2c[nH]nc2[C@@H]2CCC[NH2+]C2)n1	ZINC000040937007	174437135	/nfs/dbraw/zinc/43/71/35/174437135.db2.gz	TXSNMVXCTIATMX-LLVKDONJSA-N	1	0	286.383	2.154	1	0		CEAFRO
CC[NH2+]Cc1ccc(-n2cc3cccc(C(N)=O)c3n2)cc1	ZINC000049125572	519995816	/nfs/dbraw/zinc/99/58/16/519995816.db2.gz	LFRJYXYHAKNOIJ-UHFFFAOYSA-N	1	0	294.358	2.234	1	0		CEAFRO
C[NH+](C)CC[C@@H](c1ccc2ccccc2c1)n1ncnn1	ZINC000058590628	521811740	/nfs/dbraw/zinc/81/17/40/521811740.db2.gz	WHNHYVQHXLVZHR-INIZCTEOSA-N	1	0	281.363	2.367	1	0		CEAFRO
[NH3+]CCNc1nc(-c2ccncc2)cc2ccncc21	ZINC000095563183	185008815	/nfs/dbraw/zinc/00/88/15/185008815.db2.gz	WMHOCZAKJFCHBH-UHFFFAOYSA-N	1	0	265.320	2.062	1	0		CEAFRO
CCc1cc(Cl)c2c(c1)[C@H]1C[NH2+]C[C@@H]1N(C)C2=O	ZINC000095587396	185013002	/nfs/dbraw/zinc/01/30/02/185013002.db2.gz	SPLKWJXBPRSCNB-PWSUYJOCSA-N	1	0	264.756	2.043	1	0		CEAFRO
c1cc2n(c1)-c1ccc[nH+]c1NN[C@@]21CCSC1	ZINC000005581249	170115838	/nfs/dbraw/zinc/11/58/38/170115838.db2.gz	RKGLORGXPXVVIZ-CYBMUJFWSA-N	1	0	258.350	2.135	1	0		CEAFRO
COC(=O)[C@@H]1C[C@@H]2CC[C@@H](O)C[C@@H]2[N@@H+]1CC1CCCCC1	ZINC000008679964	170345227	/nfs/dbraw/zinc/34/52/27/170345227.db2.gz	ZWLNBYWWGZZDEZ-FZKCQIBNSA-N	1	0	295.423	2.344	1	0		CEAFRO
O[C@H]1c2ccccc2-c2c3c(cc4c2[C@H]1[NH2+]CC4)OCO3	ZINC000014615640	290849019	/nfs/dbraw/zinc/84/90/19/290849019.db2.gz	CKIYSMRPIBQTHQ-CVEARBPZSA-N	1	0	281.311	2.316	1	0	biogenic,in-vitro	CEAFRO
C[NH2+]C[C@@H]1CCc2c(OC)ccc(Cl)c2C1=O	ZINC000169319198	188657264	/nfs/dbraw/zinc/65/72/64/188657264.db2.gz	PRRIHCBZJBRBNH-QMMMGPOBSA-N	1	0	253.729	2.313	1	0		CEAFRO
CN1c2c(cc(Cl)cc2Cl)C[C@H]1C1=[NH+]CCN1	ZINC000029340102	171594396	/nfs/dbraw/zinc/59/43/96/171594396.db2.gz	ZTOGAQRDWLUFPP-JTQLQIEISA-N	1	0	270.163	2.356	1	0		CEAFRO
C[NH2+][C@@]1(c2ccccc2Cl)CCCN(C)C1=O	ZINC000071318213	176122199	/nfs/dbraw/zinc/12/21/99/176122199.db2.gz	PHTVCPQXHIZASR-CYBMUJFWSA-N	1	0	252.745	2.007	1	0		CEAFRO
C[N@@H+]1CC[C@]23CC(=O)CC[C@]2(Cc2ccc(O)cc23)C1	ZINC000072170766	176333306	/nfs/dbraw/zinc/33/33/06/176333306.db2.gz	WUCQEQZEZVRUJS-DLBZAZTESA-N	1	0	271.360	2.261	1	0		CEAFRO
Cc1ccc(C2=CN(O)[C@H]3CCCC[C@@H]3[N+]2=O)cc1	ZINC000101180819	280802170	/nfs/dbraw/zinc/80/21/70/280802170.db2.gz	PQVNHRORXCBZCV-KBPBESRZSA-N	1	0	258.321	2.200	1	0		CEAFRO
CCC[NH+](CCC)[C@@H]1Cc2cccc3c2N(CC(=O)N3)C1	ZINC000013452275	535327646	/nfs/dbraw/zinc/32/76/46/535327646.db2.gz	LFWCFBPVPREGJJ-CQSZACIVSA-N	1	0	287.407	2.492	1	0		CEAFRO
CO[C@@H]1C=CC2=CC[N@@H+]3CCc4cc5c(cc4[C@]23C1)OCO5	ZINC000085730718	571788097	/nfs/dbraw/zinc/78/80/97/571788097.db2.gz	TVOFUERNMZTYRM-KDOFPFPSSA-N	1	0	297.354	2.384	1	0	endogenous,in-man	CEAFRO
[NH3+][C@H]1CC[C@@H](n2cnc3cnc4[nH]ccc4c32)CC1	ZINC000101537460	185743320	/nfs/dbraw/zinc/74/33/20/185743320.db2.gz	YWFKBVSIOXRKIU-MGCOHNPYSA-N	1	0	255.325	2.355	1	0		CEAFRO
CC(C)[NH2+]C[C@@H](O)COc1ccc(O)c2c1CCCC2	ZINC000169319530	188657266	/nfs/dbraw/zinc/65/72/66/188657266.db2.gz	SLJQHWRZECBGJS-GFCCVEGCSA-N	1	0	279.380	2.009	1	0		CEAFRO
COCC[NH2+][C@H]1CCC(=O)c2[nH]c3ccccc3c21	ZINC000006006915	170167751	/nfs/dbraw/zinc/16/77/51/170167751.db2.gz	GNUWKYIUQKLQTH-LBPRGKRZSA-N	1	0	258.321	2.422	1	0		CEAFRO
CC(C)Cc1ccc([C@@H](C)C(=O)NCCC[NH3+])cc1	ZINC000013646136	170572980	/nfs/dbraw/zinc/57/29/80/170572980.db2.gz	ODOWPKIXAANQJK-CYBMUJFWSA-N	1	0	262.397	2.454	1	0		CEAFRO
CC/C(=C\c1ccccc1OC[C@@H](O)C[NH2+]C(C)C)CO	ZINC000040466423	174275039	/nfs/dbraw/zinc/27/50/39/174275039.db2.gz	NSELJLYSHRXTMA-IDJPSDCMSA-N	1	0	293.407	2.210	1	0		CEAFRO
C[N@@H+]1C[C@@H]2C[C@H]1CN2c1ncc(-c2ccccc2)cn1	ZINC000049109364	524018497	/nfs/dbraw/zinc/01/84/97/524018497.db2.gz	OODPDBZXZQDRMJ-GJZGRUSLSA-N	1	0	266.348	2.036	1	0		CEAFRO
[NH3+]CCn1nc2c3c1cccc3C(=O)c1ccccc1-2	ZINC000049583206	527200980	/nfs/dbraw/zinc/20/09/80/527200980.db2.gz	BELLEOUYTCSNAZ-UHFFFAOYSA-N	1	0	263.300	2.206	1	0	in-vivo	CEAFRO
CC(C)(c1nc2c(cccc2C(N)=O)[nH]1)[NH+]1CCCCC1	ZINC000040936594	581095007	/nfs/dbraw/zinc/09/50/07/581095007.db2.gz	DGRRONUEGQIKCT-UHFFFAOYSA-N	1	0	286.379	2.383	1	0		CEAFRO
CC(=O)Nc1nc(CCc2ccc(CC[NH3+])cc2)cs1	ZINC000095581380	185011300	/nfs/dbraw/zinc/01/13/00/185011300.db2.gz	MVESDSWTNCLUPC-UHFFFAOYSA-N	1	0	289.404	2.388	1	0		CEAFRO
O=c1[nH]ccc2cc(OC[C@@H]3CC[NH2+]C3)c(Cl)cc21	ZINC000095920662	185031422	/nfs/dbraw/zinc/03/14/22/185031422.db2.gz	RCMBOTAAIQVYEO-SECBINFHSA-N	1	0	278.739	2.170	1	0	in-vitro	CEAFRO
O=C1C=C(C(F)(F)F)[C@H]2C=CC([NH2+]C3CCC3)=C[C@@H]2N1	ZINC000102202162	185771774	/nfs/dbraw/zinc/77/17/74/185771774.db2.gz	YPJAPHLMGLPEGR-PWSUYJOCSA-N	1	0	284.281	2.186	1	0		CEAFRO
CC[NH+](CC)CC(=O)Nc1cc(OC)ccc1C	ZINC000152239596	188004123	/nfs/dbraw/zinc/00/41/23/188004123.db2.gz	PJFVXHMFFVPRJG-UHFFFAOYSA-N	1	0	250.342	2.284	1	0		CEAFRO
CC[NH+](CC)CC[C@H]1CN(C)C(=S)c2cccnc2O1	ZINC000026271461	171477643	/nfs/dbraw/zinc/47/76/43/171477643.db2.gz	MWGQRUIDZMAPNQ-LBPRGKRZSA-N	1	0	293.436	2.182	1	0		CEAFRO
CCCOCn1c2ccccc2nc1N1CC[NH+](C)CC1	ZINC000038142534	174134435	/nfs/dbraw/zinc/13/44/35/174134435.db2.gz	UDRSGWPVIQGVPP-UHFFFAOYSA-N	1	0	288.395	2.172	1	0		CEAFRO
CCC[N@@H+]1CCO[C@@H]2c3cc4c(cc3CC[C@H]21)COC4=O	ZINC000040413903	174254853	/nfs/dbraw/zinc/25/48/53/174254853.db2.gz	PEJRVVYNELAPOR-HZPDHXFCSA-N	1	0	287.359	2.455	1	0		CEAFRO
C[NH2+]C[C@@H](O)[C@@H](c1ccccc1)N(C)c1ccccc1	ZINC000040848589	174419926	/nfs/dbraw/zinc/41/99/26/174419926.db2.gz	KWAYIPPRBHZSBU-IAGOWNOFSA-N	1	0	270.376	2.444	1	0		CEAFRO
CC(C)c1[nH]nc2c1ncnc2N[C@H]1CCCC[C@H]1[NH3+]	ZINC000072108878	176316817	/nfs/dbraw/zinc/31/68/17/176316817.db2.gz	BWBUYVQHCZMJLO-ZJUUUORDSA-N	1	0	274.372	2.158	1	0		CEAFRO
C[NH2+]C1CN(c2ncnc3c4cc(Cl)ccc4oc32)C1	ZINC000049070614	521953600	/nfs/dbraw/zinc/95/36/00/521953600.db2.gz	OYMJTEMKKMATMC-UHFFFAOYSA-N	1	0	288.738	2.437	1	0		CEAFRO
COCCNC(=O)[C@@H]1CCC[N@H+](Cc2ccccc2)CC1	ZINC000061930990	523911627	/nfs/dbraw/zinc/91/16/27/523911627.db2.gz	LFEMEQPOJFSFFF-MRXNPFEDSA-N	1	0	290.407	2.051	3	0		CEAFRO
C[NH2+]CCNc1nc(-c2ccncc2)cc2cnccc21	ZINC000095558302	185008849	/nfs/dbraw/zinc/00/88/49/185008849.db2.gz	GIVLJYSTNKNCGZ-UHFFFAOYSA-N	1	0	279.347	2.323	1	0		CEAFRO
CCOC(=O)[C@@]1(c2ccc(F)cc2)C[C@H]1C[NH+](C)C	ZINC000002021347	169768235	/nfs/dbraw/zinc/76/82/35/169768235.db2.gz	QFVUCTGVTNQNJX-SWLSCSKDSA-N	1	0	265.328	2.208	1	0		CEAFRO
CC(C)[C@@H]([NH3+])C(=O)NCc1cccc(OC(F)(F)F)c1	ZINC000072123394	176320181	/nfs/dbraw/zinc/32/01/81/176320181.db2.gz	FARIEFPCHKGZFJ-LLVKDONJSA-N	1	0	290.285	2.185	1	0		CEAFRO
[NH3+][C@@H]1C(=O)N(c2ccccc2)[C@@H]1/C=C/c1ccccc1	ZINC000072175061	176334093	/nfs/dbraw/zinc/33/40/93/176334093.db2.gz	ZZZFIWAJGSSWAB-OEPMCUGXSA-N	1	0	264.328	2.443	1	0		CEAFRO
O=C(C[NH2+]C[C@H]1CCCO1)Nc1ccccc1-n1cccc1	ZINC000004926778	170041709	/nfs/dbraw/zinc/04/17/09/170041709.db2.gz	HOFDDOTWFNDAOG-CQSZACIVSA-N	1	0	299.374	2.184	3	0		CEAFRO
Clc1cc(N2CCC[NH2+]CC2)cnc1Br	ZINC000013703919	170580432	/nfs/dbraw/zinc/58/04/32/170580432.db2.gz	WPYTXBRSQCLTAR-UHFFFAOYSA-N	1	0	290.592	2.297	1	0		CEAFRO
Oc1cccc(-c2noc([C@H]3C[NH+]4CCC3CC4)n2)c1	ZINC000013860862	170604971	/nfs/dbraw/zinc/60/49/71/170604971.db2.gz	VBPRZVPNKNRXFP-ZDUSSCGKSA-N	1	0	271.320	2.251	1	0		CEAFRO
Oc1ccc(-c2noc([C@H]3C[NH+]4CCC3CC4)n2)cc1	ZINC000013860866	170605111	/nfs/dbraw/zinc/60/51/11/170605111.db2.gz	YENRWVJVTKYVTL-ZDUSSCGKSA-N	1	0	271.320	2.251	1	0		CEAFRO
CCCCCN1c2nccc[n+]2C[C@@]1(O)c1ccccc1	ZINC000072105116	176315793	/nfs/dbraw/zinc/31/57/93/176315793.db2.gz	JDRIHEKAYOKQLH-QGZVFWFLSA-N	1	0	284.383	2.225	1	0		CEAFRO
NC(=[NH2+])NCCCc1nccc2c3ccccc3[nH]c21	ZINC000072179481	176334646	/nfs/dbraw/zinc/33/46/46/176334646.db2.gz	KZIBFBLFUXMPFG-UHFFFAOYSA-N	1	0	267.336	2.132	1	0		CEAFRO
CC1=C[C@@H]2Cc3[nH]c(=O)ccc3[C@@]3(C1)[NH2+]CCC[C@@H]23	ZINC000013442447	581091689	/nfs/dbraw/zinc/09/16/89/581091689.db2.gz	YYWGABLTRMRUIT-WQGACYEGSA-N	1	0	256.349	2.092	1	0	investigational	CEAFRO
O=c1[nH]c2cc(C[NH2+]C3CC3)ccc2n2cccc12	ZINC000042988875	581101169	/nfs/dbraw/zinc/10/11/69/581101169.db2.gz	PZMMEFILQJSARI-UHFFFAOYSA-N	1	0	253.305	2.033	1	0		CEAFRO
Cc1cc(NC2CC[NH+](C(C)C)CC2)n2nccc2n1	ZINC000095557944	185009318	/nfs/dbraw/zinc/00/93/18/185009318.db2.gz	WHGKPSPGQCWPBC-UHFFFAOYSA-N	1	0	273.384	2.322	1	0		CEAFRO
COc1ccc(CC(=O)Nc2c([N+]#N)c(C)nn2C)cc1	ZINC000095571853	185010511	/nfs/dbraw/zinc/01/05/11/185010511.db2.gz	WYRDBUMLOBFBRL-UHFFFAOYSA-O	1	0	286.315	2.403	1	0		CEAFRO
COc1ccc(C(F)(F)F)c[n+]1CCCCCO	ZINC000096938835	185132750	/nfs/dbraw/zinc/13/27/50/185132750.db2.gz	RLSBFGUVZDGEMG-UHFFFAOYSA-N	1	0	264.267	2.164	1	0		CEAFRO
C[NH2+]CCCNc1c2c(C)nn(C)c2nc2ccccc21	ZINC000169329064	188658941	/nfs/dbraw/zinc/65/89/41/188658941.db2.gz	MWLYIABTIDQXCA-UHFFFAOYSA-N	1	0	283.379	2.451	1	0		CEAFRO
C[N@H+](CCc1cn[nH]c1)C[C@H]1CCCN(c2ccccn2)C1	ZINC000019741710	134703336	/nfs/dbraw/zinc/70/33/36/134703336.db2.gz	YOPZCKOYAZNORS-MRXNPFEDSA-N	1	0	299.422	2.196	1	0		CEAFRO
COc1ccccc1-c1nccc(NC2CC[NH2+]CC2)n1	ZINC000004264993	169950495	/nfs/dbraw/zinc/95/04/95/169950495.db2.gz	AHSFPOLLSQLDSF-UHFFFAOYSA-N	1	0	284.363	2.316	1	0		CEAFRO
COc1cc(Br)c2c3c1C[C@H]([NH3+])C[C@H]3CO2	ZINC000013779775	170592893	/nfs/dbraw/zinc/59/28/93/170592893.db2.gz	CLZKGXPLDDUCQZ-NKWVEPMBSA-N	1	0	284.153	2.207	1	0		CEAFRO
CCN(CC)C(=O)[C@]1(c2ccccc2)C[C@@H]1C[NH+](C)C	ZINC000029127899	171587036	/nfs/dbraw/zinc/58/70/36/171587036.db2.gz	NMRSWXVEITZBIQ-WBVHZDCISA-N	1	0	274.408	2.374	1	0	in-vivo	CEAFRO
c1ccc([C@@H](Cc2ccncc2)N2CC[NH2+]CC2)cc1	ZINC000036093343	172436845	/nfs/dbraw/zinc/43/68/45/172436845.db2.gz	QVONDVLKKQSPCH-QGZVFWFLSA-N	1	0	267.376	2.271	1	0	in-vivo	CEAFRO
c1ccc(-c2cccc3c2OC[C@H](C2=[NH+]CCN2)O3)cc1	ZINC000040431293	174259748	/nfs/dbraw/zinc/25/97/48/174259748.db2.gz	MQSPJCMZCOHHPI-OAHLLOKOSA-N	1	0	280.327	2.495	1	0		CEAFRO
C[C@@H]1C[N@H+](C)[C@@H]2Cc3c[nH]c4cccc(c34)[C@@H]2[C@@H]1O	ZINC000015219699	571736641	/nfs/dbraw/zinc/73/66/41/571736641.db2.gz	JUXRVSRUBIFVKE-LFIODWAZSA-N	1	0	256.349	2.119	1	0	endogenous,in-man	CEAFRO
Nc1nc2cc3c(cc2s1)CC[N@@H+](C1CC1)CC3	ZINC000095581919	185011045	/nfs/dbraw/zinc/01/10/45/185011045.db2.gz	OTVFQSZCLHMKKL-UHFFFAOYSA-N	1	0	259.378	2.442	1	0		CEAFRO
CCOC(=O)[C@H]1Nc2ccccc2[N@H+](C)n2cccc21	ZINC000096908751	185127383	/nfs/dbraw/zinc/12/73/83/185127383.db2.gz	LMBGWWFEDJCRGK-AWEZNQCLSA-N	1	0	271.320	2.417	1	0		CEAFRO
[NH3+][C@H](C(=O)N1CCc2ccccc2C1)C1CCCCC1	ZINC000014949337	170649768	/nfs/dbraw/zinc/64/97/68/170649768.db2.gz	JZWIQUOOJPLTGM-INIZCTEOSA-N	1	0	272.392	2.479	1	0		CEAFRO
COc1ccccc1CC[C@@H](O)C[NH2+]C(C)(C)C	ZINC000027902545	171537797	/nfs/dbraw/zinc/53/77/97/171537797.db2.gz	LKQILHSRJVPHBU-CYBMUJFWSA-N	1	0	251.370	2.377	1	0		CEAFRO
Cn1cc[n+](C)c1/C=C/c1ccc(Br)o1	ZINC000040393425	174252326	/nfs/dbraw/zinc/25/23/26/174252326.db2.gz	CMZRBVUTKBBMOO-GQCTYLIASA-N	1	0	268.134	2.376	1	0		CEAFRO
CC[NH2+]Cc1nc2c(cnc3ccccc23)n1CC(C)(C)O	ZINC000040891658	174429024	/nfs/dbraw/zinc/42/90/24/174429024.db2.gz	PJUFHSKPZMMWLC-UHFFFAOYSA-N	1	0	298.390	2.465	1	0		CEAFRO
O[C@@]1(c2ccccc2)C[n+]2cccnc2N1C1CCCCC1	ZINC000072111469	176317736	/nfs/dbraw/zinc/31/77/36/176317736.db2.gz	QQJDKXWAVKCCDR-GOSISDBHSA-N	1	0	296.394	2.367	1	0		CEAFRO
C[NH+](C)C[C@H]1CCOc2ccc(Cl)cc2C1=O	ZINC000062625170	521879646	/nfs/dbraw/zinc/87/96/46/521879646.db2.gz	HWCODPOCDUCBGO-SECBINFHSA-N	1	0	253.729	2.483	1	0		CEAFRO
CC(=O)O[C@@H]1C[C@@H]2CC[C@H]([C@@H]1[C@H](O)c1ccccc1)[N@@H+]2C	ZINC000005857620	560203725	/nfs/dbraw/zinc/20/37/25/560203725.db2.gz	RNAIYSUVIULACI-JZAWBGDQSA-N	1	0	289.375	2.134	1	0	in-vitro	CEAFRO
Cc1nc2cnc3[nH]ccc3c2n1[C@@H]1CC[NH2+]C[C@@H]1F	ZINC000095572044	185010199	/nfs/dbraw/zinc/01/01/99/185010199.db2.gz	LLIVYAMDALVWBN-CMPLNLGQSA-N	1	0	273.315	2.094	1	0		CEAFRO
CC1(n2cnc3cnc4[nH]ccc4c32)CC[NH2+]CC1	ZINC000095579468	185011132	/nfs/dbraw/zinc/01/11/32/185011132.db2.gz	JOZYKFXMIQCMFR-UHFFFAOYSA-N	1	0	255.325	2.011	1	0		CEAFRO
C[NH+]1CCC2(CC1)c1cc(Br)ccc1N[C@@H]2O	ZINC000205436720	344528399	/nfs/dbraw/zinc/52/83/99/344528399.db2.gz	DDNYHBDMEJGJCC-GFCCVEGCSA-N	1	0	297.196	2.156	2	0		CEAFRO
C[NH2+]C[C@@H]1[C@H]2[C@H]3C=C[C@@H]1[C@H]([C@H](C)c1ccc(C=O)cc1)N32	ZINC000085547883	290841229	/nfs/dbraw/zinc/84/12/29/290841229.db2.gz	SUIGORHBHKDJMV-UOPYUGATSA-N	1	0	282.387	2.059	1	0	biogenic,in-vitro	CEAFRO
C[N@@H+]1C[C@H]2CC[C@@H]1[C@@H](CNC(=O)c1ccc(F)cc1)C2	ZINC000195524378	130745393	/nfs/dbraw/zinc/74/53/93/130745393.db2.gz	HBZPQTWKJIXHHX-NJZAAPMLSA-N	1	0	276.355	2.286	1	0		CEAFRO
Clc1ncc(OC[C@@H]2CC[NH2+]2)cc1Br	ZINC000003936831	169925630	/nfs/dbraw/zinc/92/56/30/169925630.db2.gz	VPTKVDUTWQSRCJ-LURJTMIESA-N	1	0	277.549	2.238	1	0		CEAFRO
CCC(=O)Nc1ccc2[nH]cc(C3CC[NH2+]CC3)c2n1	ZINC000013523817	170558299	/nfs/dbraw/zinc/55/82/99/170558299.db2.gz	WSXYJBWPQGSQLD-UHFFFAOYSA-N	1	0	272.352	2.378	1	0		CEAFRO
O=C1NCCn2c(C[NH+]3CCCCC3)cc3cccc1c32	ZINC000040411729	174254547	/nfs/dbraw/zinc/25/45/47/174254547.db2.gz	SNFSUXQPFNJBTC-UHFFFAOYSA-N	1	0	283.375	2.371	1	0		CEAFRO
NC(=[NH2+])NCCN(Cc1ccccc1)c1ccccc1	ZINC000045226935	175333485	/nfs/dbraw/zinc/33/34/85/175333485.db2.gz	UPNBOYQMIPELOP-UHFFFAOYSA-N	1	0	268.364	2.176	1	0		CEAFRO
CCC[NH+]1CCN(c2nc3cnccc3s2)CC1	ZINC000045289523	175353940	/nfs/dbraw/zinc/35/39/40/175353940.db2.gz	LXUYYRCOPIHUEM-UHFFFAOYSA-N	1	0	262.382	2.223	1	0		CEAFRO
Cc1cc(Nc2ccccc2)nc(N2CCC[NH2+]CC2)n1	ZINC000045355613	175362191	/nfs/dbraw/zinc/36/21/91/175362191.db2.gz	HPVLVGVPUBQVOX-UHFFFAOYSA-N	1	0	283.379	2.328	1	0		CEAFRO
CC[C@@H]1C[N@@H+]2CC[C@@]34c5ccccc5N[C@H]3[C@H](CO)[C@@H]1C[C@@H]24	ZINC000070454121	560048570	/nfs/dbraw/zinc/04/85/70/560048570.db2.gz	FAQGZHFLASTWAV-XFRGTPKLSA-N	1	0	298.430	2.461	1	0	biogenic,in-vitro	CEAFRO
c1ccc(Cc2ccc(OC[C@@H]3C[NH2+]CCN3)cc2)cc1	ZINC000049089881	581092001	/nfs/dbraw/zinc/09/20/01/581092001.db2.gz	NQEDMJQVVYPBBZ-KRWDZBQOSA-N	1	0	282.387	2.218	1	0	in-vivo	CEAFRO
c1ccc(C(CNC2=[NH+]CCN2)c2ccccc2)cc1	ZINC000000012989	169506033	/nfs/dbraw/zinc/50/60/33/169506033.db2.gz	WNDHOTXNLWWJNT-UHFFFAOYSA-N	1	0	265.360	2.367	1	0		CEAFRO
CCCOC(=O)c1cc(OC)c(C[C@@H](C)[NH3+])cc1OC	ZINC000013450425	170551129	/nfs/dbraw/zinc/55/11/29/170551129.db2.gz	WCFHJUFPNNTMGG-SNVBAGLBSA-N	1	0	281.352	2.160	1	0		CEAFRO
COC(=O)C[C@@H](C[NH3+])c1c[nH]c2cc(Cl)ccc21	ZINC000027769325	171532662	/nfs/dbraw/zinc/53/26/62/171532662.db2.gz	JCUDXCCEQYQMCY-QMMMGPOBSA-N	1	0	266.728	2.427	1	0		CEAFRO
CC(=O)Nc1ccc(OC[C@H](O)[C@@H](C)[NH2+]C(C)(C)C)cc1	ZINC000028769758	171574262	/nfs/dbraw/zinc/57/42/62/171574262.db2.gz	YXABSTVHPRQVFH-ABAIWWIYSA-N	1	0	294.395	2.161	1	0		CEAFRO
Cc1ccccc1CN([C@H]1CC[NH2+]C1)C1CCOCC1	ZINC000028948828	171581456	/nfs/dbraw/zinc/58/14/56/171581456.db2.gz	WMWARSGGACJLII-KRWDZBQOSA-N	1	0	274.408	2.338	1	0		CEAFRO
CCN(CC)C(=O)[C@@]1(c2ccc(Cl)s2)C[C@H]1C[NH3+]	ZINC000029043074	171584073	/nfs/dbraw/zinc/58/40/73/171584073.db2.gz	LLAFUUNOXYVHHL-ZANVPECISA-N	1	0	286.828	2.486	1	0		CEAFRO
C[N@@H+]1CCC=C([C@H]2SCC(=O)N2c2ccccc2)C1	ZINC000045286475	175353477	/nfs/dbraw/zinc/35/34/77/175353477.db2.gz	BSRXRTYLTBWZAC-OAHLLOKOSA-N	1	0	274.389	2.354	1	0		CEAFRO
CC(C)CC[NH+]1CCC2(CC1)OCCc1c2cnn1C	ZINC000072114705	176318199	/nfs/dbraw/zinc/31/81/99/176318199.db2.gz	MEBBHSQCAMGZLL-UHFFFAOYSA-N	1	0	277.412	2.330	1	0		CEAFRO
C[NH2+]CC[C@H](c1ccc2ccccc2c1)n1nnc(C)n1	ZINC000058590833	522019341	/nfs/dbraw/zinc/01/93/41/522019341.db2.gz	VSRNUBMEUKSAAJ-MRXNPFEDSA-N	1	0	281.363	2.334	1	0		CEAFRO
COc1cc2c(cc1OC)[C@H]1[C@@H]3C(=CC[C@@H]1O)CC[N@@H+]3C2	ZINC000085531588	560073218	/nfs/dbraw/zinc/07/32/18/560073218.db2.gz	PPXDSINXGXMGAE-XKQJLSEDSA-N	1	0	287.359	2.066	1	0	biogenic,in-vitro	CEAFRO
CO[C@H]1C=C2CC[N@@H+]3CCc4ccc(O)cc4[C@@H](C1)[C@@H]23	ZINC000033830265	560088590	/nfs/dbraw/zinc/08/85/90/560088590.db2.gz	UIMPDKMBSQVICT-USXIJHARSA-N	1	0	271.360	2.451	1	0	biogenic,in-vitro	CEAFRO
COc1cc2c(cc1O)[C@]13C[C@@H](OC)C=CC1=CC[N@@H+]3CC2	ZINC000015203660	560229157	/nfs/dbraw/zinc/22/91/57/560229157.db2.gz	IHPMURIXWRKEKD-KSSFIOAISA-N	1	0	299.370	2.369	1	0	biogenic,in-vitro	CEAFRO
Cc1nc(COC[C@H]2CCC[C@@]23C[N@H+](C)CCO3)cs1	ZINC000096063544	185084944	/nfs/dbraw/zinc/08/49/44/185084944.db2.gz	DWYMUJSKBPNCGW-UKRRQHHQSA-N	1	0	296.436	2.469	1	0		CEAFRO
CC(C)C[NH2+]C1=CC=C[C@](C)(NC(=O)C(C)(C)C)N1	ZINC000205428219	344528416	/nfs/dbraw/zinc/52/84/16/344528416.db2.gz	YPVXTPWYOIGPSR-HNNXBMFYSA-N	1	0	265.401	2.111	2	0		CEAFRO
C/C=C\[C@](O)(C(=O)O[C@H]1C[NH+]2CCC1CC2)C1CCCC1	ZINC000005954610	170162015	/nfs/dbraw/zinc/16/20/15/170162015.db2.gz	KFIKGORTYFCONO-RCOCFKTFSA-N	1	0	293.407	2.121	1	0		CEAFRO
C[NH+]1CCN(Cc2csc3c2CCCC3)CC1	ZINC000020514305	171231654	/nfs/dbraw/zinc/23/16/54/171231654.db2.gz	VUBWZYPKJLZPGM-UHFFFAOYSA-N	1	0	250.411	2.374	1	0		CEAFRO
Cc1ccc(OC[C@@H](O)[C@@H](C)[NH2+]C(C)C)cc1C	ZINC000028226955	171551972	/nfs/dbraw/zinc/55/19/72/171551972.db2.gz	DYBVOBOVLLZZSV-UKRRQHHQSA-N	1	0	251.370	2.430	1	0		CEAFRO
Nc1ccccc1NC(=O)OCC[NH+]1CCCCC1	ZINC000029477367	171600015	/nfs/dbraw/zinc/60/00/15/171600015.db2.gz	RJHKCUBJAACDMC-UHFFFAOYSA-N	1	0	263.341	2.303	1	0		CEAFRO
Cc1ccccc1Cc1ncc2c(n1)CC[NH2+]CC2	ZINC000071340434	176130374	/nfs/dbraw/zinc/13/03/74/176130374.db2.gz	DICIIRRAADPBNB-UHFFFAOYSA-N	1	0	253.349	2.064	1	0		CEAFRO
C[C@@H]([NH3+])C(=O)Nc1ccc(Cl)cc1C(=O)c1ccc[nH]1	ZINC000072137636	176322924	/nfs/dbraw/zinc/32/29/24/176322924.db2.gz	GMVYSAQXLALKBY-MRVPVSSYSA-N	1	0	291.738	2.185	3	0		CEAFRO
Nc1ncc([C@H]2C[C@@H]3CC[C@H]2[NH2+]3)cc1Br	ZINC000013491723	170556395	/nfs/dbraw/zinc/55/63/95/170556395.db2.gz	IXUZOXDIVNIWSJ-QXFUBDJGSA-N	1	0	268.158	2.034	1	0		CEAFRO
COc1cc2cccc3c2c(c1)CN(C(=[NH2+])NO)C3	ZINC000027762623	171532228	/nfs/dbraw/zinc/53/22/28/171532228.db2.gz	VBFINEQLTLSUPP-UHFFFAOYSA-N	1	0	257.293	2.078	1	0		CEAFRO
CCCc1[nH+]c(C)c2ccnc(Nc3cc[nH]n3)n21	ZINC000029404083	171597372	/nfs/dbraw/zinc/59/73/72/171597372.db2.gz	LMXTWUFOMLOBDA-UHFFFAOYSA-N	1	0	256.313	2.457	1	0		CEAFRO
COC(=O)[C@@H](C)Oc1cccc2sc(C(N)=[NH2+])cc21	ZINC000045337086	175360883	/nfs/dbraw/zinc/36/08/83/175360883.db2.gz	XQRCKSBCQMSIKE-SSDOTTSWSA-N	1	0	278.333	2.126	1	0		CEAFRO
OCC[C@H]1[C@@H]2C[NH2+]C[C@]12c1ccc(Cl)c(Cl)c1	ZINC000045365104	175362367	/nfs/dbraw/zinc/36/23/67/175362367.db2.gz	ZVZFXZCYKJIUGR-KWBADKCTSA-N	1	0	272.175	2.463	1	0		CEAFRO
COc1ccc(C(=O)OC2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1	ZINC000014590377	560222742	/nfs/dbraw/zinc/22/27/42/560222742.db2.gz	JOROTINCCHPFDK-NNQSOWQGSA-N	1	0	275.348	2.477	1	0	biogenic,in-vitro	CEAFRO
FCC[C@H]1C[C@@H]1c1cncc(OC[C@@H]2CC[NH2+]2)c1	ZINC000095564666	185010193	/nfs/dbraw/zinc/01/01/93/185010193.db2.gz	XJDTUPZAYLTURR-JKOKRWQUSA-N	1	0	250.317	2.285	1	0		CEAFRO
Cc1nc2cnc3[nH]ccc3c2n1[C@H]1CCC[NH2+]C1	ZINC000095574941	185011012	/nfs/dbraw/zinc/01/10/12/185011012.db2.gz	JLXMMTXJUXILOC-JTQLQIEISA-N	1	0	255.325	2.146	1	0		CEAFRO
CCc1cc(-c2cncc(OC[C@@H]3CC[NH2+]3)c2)on1	ZINC000095575775	185011435	/nfs/dbraw/zinc/01/14/35/185011435.db2.gz	ZDKWIWBHZBARRN-LBPRGKRZSA-N	1	0	259.309	2.040	1	0		CEAFRO
COC(=O)[C@H]1[C@H]2CC[C@@H](C[C@H]1c1ccccc1)[N@@H+]2C	ZINC000002383042	169789207	/nfs/dbraw/zinc/78/92/07/169789207.db2.gz	OMBOXYLBBHNWHL-BYNSBNAKSA-N	1	0	259.349	2.426	1	0	in-vivo	CEAFRO
CC(C)=CCC[C@@H](C)C/C=C/C(=O)NC[C@@H]([NH3+])CCO	ZINC000040395304	174252849	/nfs/dbraw/zinc/25/28/49/174252849.db2.gz	BHXGDBUBPJCRLN-LTBMOJJQSA-N	1	0	282.428	2.141	1	0		CEAFRO
CC(C)[N@@H+]1CC[C@](C)(c2nc3c(cccc3C(N)=O)[nH]2)C1	ZINC000040431359	174260344	/nfs/dbraw/zinc/26/03/44/174260344.db2.gz	MXVHYHSXVGUFLG-INIZCTEOSA-N	1	0	286.379	2.034	1	0		CEAFRO
Cc1cc(C[N@H+]2C[C@H](C)[C@@]3(CCN(C)C3=O)C2)oc1C	ZINC000299842557	260208791	/nfs/dbraw/zinc/20/87/91/260208791.db2.gz	SDCMDFATSIKZEZ-BLLLJJGKSA-N	1	0	276.380	2.197	1	0		CEAFRO
CCc1cc2c(c(C(F)(F)F)c1)C(=O)N[C@H]1C[NH2+]C[C@H]21	ZINC000095587306	185012638	/nfs/dbraw/zinc/01/26/38/185012638.db2.gz	ZGBJXYZTHWMREU-KOLCDFICSA-N	1	0	284.281	2.067	1	0		CEAFRO
CSc1ccc(Cl)cc1NCC1=[NH+]CCN1	ZINC000013473774	170553592	/nfs/dbraw/zinc/55/35/92/170553592.db2.gz	ZHDIISZEXUGDAJ-UHFFFAOYSA-N	1	0	255.774	2.476	1	0		CEAFRO
Fc1ncc(OC[C@@H]2CC[NH2+]2)cc1-c1cccnc1	ZINC000013560800	170562921	/nfs/dbraw/zinc/56/29/21/170562921.db2.gz	XOYXAMSZYGJXCQ-NSHDSACASA-N	1	0	259.284	2.023	1	0		CEAFRO
C[NH+](C)CCCNC(=O)c1nc2cccc3cccc([nH]1)c32	ZINC000026182000	171475562	/nfs/dbraw/zinc/47/55/62/171475562.db2.gz	MDIOMHYPZJIKGR-UHFFFAOYSA-N	1	0	296.374	2.398	1	0		CEAFRO
COc1ccccc1COc1cccc2[nH+]c(N)nc(N)c21	ZINC000028971289	171582522	/nfs/dbraw/zinc/58/25/22/171582522.db2.gz	SVEQCXRVXAYAOK-UHFFFAOYSA-N	1	0	296.330	2.382	1	0		CEAFRO
[NH3+]C[C@H]1C[C@@]1(C(=O)N1CCCCCC1)c1ccccc1	ZINC000029128096	171587080	/nfs/dbraw/zinc/58/70/80/171587080.db2.gz	PZVMCTLCQFNWSD-NVXWUHKLSA-N	1	0	272.392	2.306	1	0		CEAFRO
COC(=O)[C@H]1[C@@H]2CC[C@H](C[C@@H]1c1ccc(C)cc1)[NH2+]2	ZINC000034219365	171834763	/nfs/dbraw/zinc/83/47/63/171834763.db2.gz	YUMUSCBAOZYAIX-APIJFGDWSA-N	1	0	259.349	2.392	1	0		CEAFRO
Nc1[nH]c2ccc(NC(=O)c3ccccc3)cc2[nH+]1	ZINC000045365046	175362712	/nfs/dbraw/zinc/36/27/12/175362712.db2.gz	CTYAYRIFIFAVFA-UHFFFAOYSA-N	1	0	252.277	2.397	1	0		CEAFRO
NC(=[NH2+])SCCN1C(=O)c2cccc3cccc(c32)C1=O	ZINC000072178106	176334162	/nfs/dbraw/zinc/33/41/62/176334162.db2.gz	VNGWUTAIEDNBDZ-UHFFFAOYSA-N	1	0	299.355	2.062	1	0		CEAFRO
O=C(N[C@@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)OCc1ccccc1	ZINC000306121245	328423883	/nfs/dbraw/zinc/42/38/83/328423883.db2.gz	DKBABMXWUIOAQU-BTTYYORXSA-N	1	0	260.337	2.196	2	0		CEAFRO
O=C(c1ccco1)N1C[C@H]2CCC[N@H+](CC3CC3)[C@@H]2C1	ZINC000299843798	333187756	/nfs/dbraw/zinc/18/77/56/333187756.db2.gz	YJPZIYFLUBHQIX-ZIAGYGMSSA-N	1	0	274.364	2.226	1	0		CEAFRO
OCC1CC[NH+](Cc2ccc(O)c3ncccc23)CC1	ZINC000095564670	185010330	/nfs/dbraw/zinc/01/03/30/185010330.db2.gz	JLHUNPVPIUVCLR-UHFFFAOYSA-N	1	0	272.348	2.145	1	0		CEAFRO
CCOC(=O)[C@@H]1Nc2ccccc2[N@H+](C)n2cccc21	ZINC000096908752	185128662	/nfs/dbraw/zinc/12/86/62/185128662.db2.gz	LMBGWWFEDJCRGK-CQSZACIVSA-N	1	0	271.320	2.417	1	0		CEAFRO
Cn1cccc1-c1ccccc1NCC1=[NH+]CCN1	ZINC000000026363	169507654	/nfs/dbraw/zinc/50/76/54/169507654.db2.gz	XSSNKDIFQCVNLK-UHFFFAOYSA-N	1	0	254.337	2.106	1	0		CEAFRO
CC[C@H](C)[C@H]1C[NH+]=C(N)N1CCc1cccc(F)c1	ZINC000012726998	170505400	/nfs/dbraw/zinc/50/54/00/170505400.db2.gz	FBBZOKNCVYWTCP-SMDDNHRTSA-N	1	0	263.360	2.413	3	0		CEAFRO
CC(C)[N@@H+]1CCN(Cc2ccsc2)C[C@@H]1CCO	ZINC000022932665	171404658	/nfs/dbraw/zinc/40/46/58/171404658.db2.gz	NKQSMBWTEGWFJJ-AWEZNQCLSA-N	1	0	268.426	2.025	3	0		CEAFRO
O[C@@H]1CCC[C@@H]([NH+]2CCC(c3ccccc3)CC2)[C@@H]1O	ZINC000028235488	171552786	/nfs/dbraw/zinc/55/27/86/171552786.db2.gz	CPFZIDAWUZVSDF-ZACQAIPSSA-N	1	0	275.392	2.140	1	0		CEAFRO
CC(=O)[C@@H]1[C@@H]2CC[C@H](C[C@@H]1OC(=O)c1ccccc1)[N@H+]2C	ZINC000040492256	174292941	/nfs/dbraw/zinc/29/29/41/174292941.db2.gz	OOXDBWQLHDXAPK-FXUDXRNXSA-N	1	0	287.359	2.284	1	0		CEAFRO
COCCC[C@@H]1c2cc(O)c(OC)cc2CC[N@H+]1C	ZINC000045350485	175361569	/nfs/dbraw/zinc/36/15/69/175361569.db2.gz	BUCUOGKPLMRUIA-CYBMUJFWSA-N	1	0	265.353	2.356	1	0		CEAFRO
Clc1ccc([C@H](c2cncnc2)N2CC[NH2+]CC2)cc1	ZINC000072103251	176315685	/nfs/dbraw/zinc/31/56/85/176315685.db2.gz	BLBQNOVBVFXQBO-OAHLLOKOSA-N	1	0	288.782	2.125	1	0		CEAFRO
Clc1ccc([C@@H](c2cncnc2)N2CC[NH2+]CC2)cc1	ZINC000072103250	176315773	/nfs/dbraw/zinc/31/57/73/176315773.db2.gz	BLBQNOVBVFXQBO-HNNXBMFYSA-N	1	0	288.782	2.125	1	0		CEAFRO
CC(C)NC(=O)N1CC[C@H]([NH+](C)C)[C@@H]1Cc1ccccc1	ZINC000299842426	333187950	/nfs/dbraw/zinc/18/79/50/333187950.db2.gz	QSXBZVUCLLYXIO-HOTGVXAUSA-N	1	0	289.423	2.352	1	0		CEAFRO
On1cc(C2CC[NH2+]CC2)c(Cc2ccccc2)n1	ZINC000049112041	526383219	/nfs/dbraw/zinc/38/32/19/526383219.db2.gz	WQXQQWPMVZCNML-UHFFFAOYSA-N	1	0	257.337	2.178	1	0		CEAFRO
C[C@H]1C[N@H+](C)[C@@H]2Cc3c[nH]c4cccc(c34)[C@@H]2[C@@H]1O	ZINC000015219701	571736527	/nfs/dbraw/zinc/73/65/27/571736527.db2.gz	JUXRVSRUBIFVKE-DOXNRDAMSA-N	1	0	256.349	2.119	1	0	endogenous,in-man	CEAFRO
C[C@H](OCC1CC1)c1ccc2c(n1)N1[C@H](C2)C[NH2+]C[C@H]1C	ZINC000082155016	177924704	/nfs/dbraw/zinc/92/47/04/177924704.db2.gz	HBPFKRQLQBROKQ-TYNCELHUSA-N	1	0	287.407	2.292	1	0		CEAFRO
Cc1[nH]c2c(ccn(C3CC[NH2+]CC3)c2=O)c1Cl	ZINC000096933979	185132939	/nfs/dbraw/zinc/13/29/39/185132939.db2.gz	JIMNVRSFGPZTTQ-UHFFFAOYSA-N	1	0	265.744	2.216	1	0		CEAFRO
C[C@H]1C[C@@]23CC[N@H+](C)[C@@H](Cc4ccc(O)cc42)[C@@]3(C)O1	ZINC000169347106	188660596	/nfs/dbraw/zinc/66/05/96/188660596.db2.gz	KOIWWLNSZWPHPI-UQCMEYCASA-N	1	0	273.376	2.458	1	0		CEAFRO
COC(=O)[C@H]1[C@@H]2CC[C@H](C[C@@H]1c1ccccc1)[N@@H+]2C	ZINC000026982517	171505006	/nfs/dbraw/zinc/50/50/06/171505006.db2.gz	OMBOXYLBBHNWHL-APIJFGDWSA-N	1	0	259.349	2.426	1	0		CEAFRO
Cc1ccc(Cc2ncc3c(n2)CC[NH2+]CC3)cc1	ZINC000071341720	176130468	/nfs/dbraw/zinc/13/04/68/176130468.db2.gz	DKUNOOHPVPVBLY-UHFFFAOYSA-N	1	0	253.349	2.064	1	0		CEAFRO
CC1(C)O[C@@]2([C@H]3CCC[C@@H](CO)C3)CC[C@@H]1[C@H]([NH3+])C2	ZINC000085543324	560071179	/nfs/dbraw/zinc/07/11/79/560071179.db2.gz	XCUDIIBRTJPDMX-SGPHBRAGSA-N	1	0	267.413	2.460	1	0	biogenic,in-vitro	CEAFRO
COc1ccc(CN(c2ccccn2)[C@H](C)[NH3+])cc1	ZINC000205414311	395473038	/nfs/dbraw/zinc/47/30/38/395473038.db2.gz	QNYPBZYGWFUJRK-GFCCVEGCSA-N	1	0	257.337	2.402	2	0		CEAFRO
Clc1ncc(N2CCC[NH2+]CC2)cc1Br	ZINC000013703921	170580478	/nfs/dbraw/zinc/58/04/78/170580478.db2.gz	CKEZLGKKMUHEMS-UHFFFAOYSA-N	1	0	290.592	2.297	1	0		CEAFRO
CCc1ccc(OC[C@@H](O)[C@H](C)[NH2+]C(C)C)cc1	ZINC000028226937	171551997	/nfs/dbraw/zinc/55/19/97/171551997.db2.gz	CUZFGTDGZMBXRB-SWLSCSKDSA-N	1	0	251.370	2.375	1	0		CEAFRO
CO[C@@]1(C[NH+]2CCCCC2)COc2ccccc2O1	ZINC000029476379	171600052	/nfs/dbraw/zinc/60/00/52/171600052.db2.gz	ZIAUHHNPLPFGKQ-OAHLLOKOSA-N	1	0	263.337	2.286	1	0		CEAFRO
Oc1cc2c(cc1Cl)CC[NH+]=C(NC1CC1)N2	ZINC000045261499	175337318	/nfs/dbraw/zinc/33/73/18/175337318.db2.gz	VHPBTYVRFOMVKX-UHFFFAOYSA-N	1	0	251.717	2.122	1	0		CEAFRO
Cc1[nH+]c(N)nc(N)c1Oc1cccc(Cl)c1	ZINC000045334508	175360968	/nfs/dbraw/zinc/36/09/68/175360968.db2.gz	TVZMVSXLAQMECY-UHFFFAOYSA-N	1	0	250.689	2.395	1	0		CEAFRO
Cc1ccc2nc(N3CC[NH+]4CCC3CC4)oc2c1	ZINC000045389011	175373864	/nfs/dbraw/zinc/37/38/64/175373864.db2.gz	AJQZLGNJRZQIRM-UHFFFAOYSA-N	1	0	257.337	2.421	1	0		CEAFRO
C[NH2+][C@]1(c2ccccc2Cl)CCCN(C)C1=O	ZINC000071318212	176121971	/nfs/dbraw/zinc/12/19/71/176121971.db2.gz	PHTVCPQXHIZASR-ZDUSSCGKSA-N	1	0	252.745	2.007	1	0		CEAFRO
c1cncc(O[C@@H]2CC[C@@H]3[C@H]2OCC[N@H+]3C2CCC2)c1	ZINC000299843068	333187816	/nfs/dbraw/zinc/18/78/16/333187816.db2.gz	LTAYJRNCKHPMIG-BZUAXINKSA-N	1	0	274.364	2.245	1	0		CEAFRO
c1ccc(Cc2ccc(OC[C@H]3C[NH2+]CCN3)cc2)cc1	ZINC000049089882	581092043	/nfs/dbraw/zinc/09/20/43/581092043.db2.gz	NQEDMJQVVYPBBZ-QGZVFWFLSA-N	1	0	282.387	2.218	1	0	in-vivo	CEAFRO
COc1cc(-c2nn(C(C)C)c3ncnc(N)c23)ccc1O	ZINC000008581954	170341669	/nfs/dbraw/zinc/34/16/69/170341669.db2.gz	BZYKWEQWEPHEQZ-UHFFFAOYSA-N	1	0	299.334	2.371	1	0		CEAFRO
Nc1ncc([C@H]2C[C@H]3CC[C@@H]2[NH2+]3)cc1Br	ZINC000027546541	171520090	/nfs/dbraw/zinc/52/00/90/171520090.db2.gz	IXUZOXDIVNIWSJ-MRTMQBJTSA-N	1	0	268.158	2.034	1	0		CEAFRO
COC(=O)[C@H]1[C@H]2CC[C@@H](C[C@@H]1c1cc(F)cc(F)c1)[NH2+]2	ZINC000028521692	171561368	/nfs/dbraw/zinc/56/13/68/171561368.db2.gz	BTXOQFKISOWLCT-REWJHTLYSA-N	1	0	281.302	2.362	1	0		CEAFRO
COc1ccc(F)cc1C[C@H]1CC[C@H](CC[NH3+])O1	ZINC000040390899	174252271	/nfs/dbraw/zinc/25/22/71/174252271.db2.gz	PJDWTDSVCNJUGD-CHWSQXEVSA-N	1	0	253.317	2.273	1	0		CEAFRO
NC1=[NH+]CC[C@@H](c2c[nH]c3cc(Br)ccc32)N1	ZINC000045300187	175355040	/nfs/dbraw/zinc/35/50/40/175355040.db2.gz	XUHUKWLCFVXPBL-JTQLQIEISA-N	1	0	293.168	2.280	1	0		CEAFRO
Cc1nc2cnc3[nH]ccc3c2n1C1CC[NH2+]CC1	ZINC000095577907	185011568	/nfs/dbraw/zinc/01/15/68/185011568.db2.gz	XTQACRIFOIASKV-UHFFFAOYSA-N	1	0	255.325	2.146	1	0	in-vitro	CEAFRO
Nc1nccc(-n2cc(-c3ccncc3)c3c[nH+]ccc32)n1	ZINC000095601791	185015241	/nfs/dbraw/zinc/01/52/41/185015241.db2.gz	JMBGZDQTEDTGBR-UHFFFAOYSA-N	1	0	288.314	2.460	1	0		CEAFRO
[NH3+]CCCOc1cncc(/C=C\c2ccncc2)c1	ZINC000084577654	178900277	/nfs/dbraw/zinc/90/02/77/178900277.db2.gz	KVYKDXMRLMPSGQ-IHWYPQMZSA-N	1	0	255.321	2.375	1	0		CEAFRO
O=c1ccc2cc(OCC[NH+]3CCCCC3)c(O)cc2o1	ZINC000103262179	185822434	/nfs/dbraw/zinc/82/24/34/185822434.db2.gz	QEKXMOAIGXZEAE-UHFFFAOYSA-N	1	0	289.331	2.363	1	0		CEAFRO
CC(=O)N(CC[NH3+])[C@@H](c1ccccc1)[C@@H](O)c1ccccc1	ZINC000169344995	188660490	/nfs/dbraw/zinc/66/04/90/188660490.db2.gz	HSPPUPMSEWOCKX-ROUUACIJSA-N	1	0	298.386	2.269	1	0		CEAFRO
C[n+]1cc2ccccc2c([C@@H](O)c2ccc3c(c2)OCO3)c1	ZINC000006483092	170204738	/nfs/dbraw/zinc/20/47/38/170204738.db2.gz	PGVYBQIJEBYLAD-SFHVURJKSA-N	1	0	294.330	2.475	1	0		CEAFRO
C[NH2+]C[C@]1(O)Cc2ccccc2[C@@H]1Oc1ccc(O)cc1C	ZINC000040379533	174249870	/nfs/dbraw/zinc/24/98/70/174249870.db2.gz	JZKRUQHCKJXZSS-ZWKOTPCHSA-N	1	0	299.370	2.327	1	0		CEAFRO
CC(C)C[NH2+]C1=CC=C[C@@](C)(NC(=O)C(C)(C)C)N1	ZINC000205428200	344528427	/nfs/dbraw/zinc/52/84/27/344528427.db2.gz	YPVXTPWYOIGPSR-OAHLLOKOSA-N	1	0	265.401	2.111	2	0		CEAFRO
C[NH2+]C[C@H](O)CN1c2ccccc2[C@@H]2CCCC[C@@H]21	ZINC000169358501	188661012	/nfs/dbraw/zinc/66/10/12/188661012.db2.gz	CLEGTFPJUAEKOX-NOLJZWGESA-N	1	0	260.381	2.113	1	0		CEAFRO
C[NH+]1CCC2(CCN(C(=O)c3ccncc3)CC2)CC1	ZINC000003955870	169926318	/nfs/dbraw/zinc/92/63/18/169926318.db2.gz	KHKGVYOGZWYNIQ-UHFFFAOYSA-N	1	0	273.380	2.030	1	0		CEAFRO
COC(=O)[C@H]1[C@H]2CC[C@@H](C[C@@H]1c1ccc(C)cc1)[NH2+]2	ZINC000026476978	171486592	/nfs/dbraw/zinc/48/65/92/171486592.db2.gz	YUMUSCBAOZYAIX-GBJTYRQASA-N	1	0	259.349	2.392	1	0	in-vivo	CEAFRO
CC1(C)C=C(c2nc3c(cccc3C(N)=O)[nH]2)C(C)(C)[NH2+]1	ZINC000040395175	174252924	/nfs/dbraw/zinc/25/29/24/174252924.db2.gz	VWCGEOSDLJAFAX-UHFFFAOYSA-N	1	0	284.363	2.206	1	0		CEAFRO
c1ccc(-c2nn(NC3=[NH+]CCN3)c3ccccc32)cc1	ZINC000040411970	174254553	/nfs/dbraw/zinc/25/45/53/174254553.db2.gz	LGHIUFSVZOSYAH-UHFFFAOYSA-N	1	0	277.331	2.206	1	0		CEAFRO
C[NH2+]C[C@H]1CCc2c(OC)ccc(Cl)c2C1=O	ZINC000169319200	188657300	/nfs/dbraw/zinc/65/73/00/188657300.db2.gz	PRRIHCBZJBRBNH-MRVPVSSYSA-N	1	0	253.729	2.313	1	0		CEAFRO
CCN(CC)C(=O)[C@]1(c2ccccc2)C[C@H]1C[NH2+]C	ZINC000026946973	171503573	/nfs/dbraw/zinc/50/35/73/171503573.db2.gz	OCYYUEJRVUGFGH-HOCLYGCPSA-N	1	0	260.381	2.032	1	0		CEAFRO
O=C(N[C@H]1C[NH+]2CCC1CC2)c1cc2ccsc2cn1	ZINC000034600405	171845321	/nfs/dbraw/zinc/84/53/21/171845321.db2.gz	NJNIZJCRCANYGV-ZDUSSCGKSA-N	1	0	287.388	2.120	1	0		CEAFRO
COc1ccc2c3c1O[C@H]1C[C@@H](O)CC[C@]31CC[N@@H+](C)C2	ZINC000071404392	176155363	/nfs/dbraw/zinc/15/53/63/176155363.db2.gz	GJRMHIXYLGOZSE-RVSPLBMKSA-N	1	0	289.375	2.074	1	0		CEAFRO
C[N@@H+]1CCCN(Cc2coc(-c3ccc(O)cc3)n2)CC1	ZINC000072182000	176335072	/nfs/dbraw/zinc/33/50/72/176335072.db2.gz	NUYGUKKPPVOSSD-UHFFFAOYSA-N	1	0	287.363	2.185	1	0		CEAFRO
[NH3+]C[C@@H]1CCCc2cc(S(=O)(=O)c3cc[nH]c3)ccc21	ZINC000049126108	527216545	/nfs/dbraw/zinc/21/65/45/527216545.db2.gz	LKMQZMYQTGQFSV-LBPRGKRZSA-N	1	0	290.388	2.226	1	0		CEAFRO
OC1([C@@H](CN2CC[NH2+]CC2)c2cccs2)CCCCC1	ZINC000049113266	527512059	/nfs/dbraw/zinc/51/20/59/527512059.db2.gz	IWXNUOQJTVYMHH-AWEZNQCLSA-N	1	0	294.464	2.432	1	0		CEAFRO
C[C@@]12CCC[C@@H]3C[C@@](C)(C[C@@]([NH3+])(CCCO)[C@@H]31)O2	ZINC000085543344	560071005	/nfs/dbraw/zinc/07/10/05/560071005.db2.gz	RJFVLUHFNIRNGH-FQKPHLNHSA-N	1	0	253.386	2.214	1	0	biogenic,in-vitro	CEAFRO
CC(C)(C)c1ccc(-c2cc(CNC(N)=[NH2+])ncn2)cc1	ZINC000095579062	185011428	/nfs/dbraw/zinc/01/14/28/185011428.db2.gz	SYBBBKSBZURCAU-UHFFFAOYSA-N	1	0	283.379	2.424	1	0		CEAFRO
CC1(C)[C@H]2CC[C@H](C2)[C@@]1(C)NC(=O)C[NH+]1CCCC1	ZINC000005000559	170052724	/nfs/dbraw/zinc/05/27/24/170052724.db2.gz	ZDNKVMDVRGYNRM-WOSRLPQWSA-N	1	0	264.413	2.413	1	0		CEAFRO
C[NH+](C)CCCN1C(=O)CS[C@@H]1c1cccc(F)c1	ZINC000013650865	170573937	/nfs/dbraw/zinc/57/39/37/170573937.db2.gz	KTGFDMVQZJCWQK-CQSZACIVSA-N	1	0	282.384	2.351	1	0		CEAFRO
Cn1cc(-c2noc(CC[NH+](C)C)n2)c2ccccc21	ZINC000013860823	170605027	/nfs/dbraw/zinc/60/50/27/170605027.db2.gz	AVEBCHZFMXCIIB-UHFFFAOYSA-N	1	0	270.336	2.332	1	0		CEAFRO
CC(C)[NH2+]C[C@H](O)COc1ccc(Cl)cc1/C=C/CO	ZINC000040465874	174274686	/nfs/dbraw/zinc/27/46/86/174274686.db2.gz	CNIQQVZICULXPB-XGACYXMMSA-N	1	0	299.798	2.083	1	0		CEAFRO
Fc1ccc2cc(CCN3CC[NH2+]CC3)ccc2c1	ZINC000040895436	174429393	/nfs/dbraw/zinc/42/93/93/174429393.db2.gz	AVSJNVNTDDYDEP-UHFFFAOYSA-N	1	0	258.340	2.427	1	0	in-vivo	CEAFRO
O=S(=O)(c1ccccc1)c1ccc2c(c1)CC[NH2+]CC2	ZINC000040951679	174438399	/nfs/dbraw/zinc/43/83/99/174438399.db2.gz	MXLYGGPBHQMGJW-UHFFFAOYSA-N	1	0	287.384	2.208	1	0		CEAFRO
C[NH2+]CC[C@@H](c1ccc2cc(C)ccc2c1)n1ncnn1	ZINC000058591821	522016532	/nfs/dbraw/zinc/01/65/32/522016532.db2.gz	UNCNBGAOAXFUFU-INIZCTEOSA-N	1	0	281.363	2.334	1	0		CEAFRO
COc1ccc2[nH]cc(C(=O)N[C@H]3C[C@H]4CC[C@@H](C3)[NH2+]4)c2c1	ZINC000101798363	185758815	/nfs/dbraw/zinc/75/88/15/185758815.db2.gz	YGIAISDOARLTNV-GDNZZTSVSA-N	1	0	299.374	2.189	1	0		CEAFRO
[NH3+]CCNc1cc2c(cn1)ncnc2NC1CCCCC1	ZINC000040379459	174250301	/nfs/dbraw/zinc/25/03/01/174250301.db2.gz	LZBYMXZGKZKUKM-UHFFFAOYSA-N	1	0	286.383	2.140	1	0		CEAFRO
[NH3+]Cc1ccc(-c2cn3c(cn2)ncc3-c2cn[nH]c2)cc1	ZINC000053282612	175546635	/nfs/dbraw/zinc/54/66/35/175546635.db2.gz	HRKWURYEAYZSRP-UHFFFAOYSA-N	1	0	290.330	2.245	1	0		CEAFRO
O=C1OCC(OCC[NH+]2CCCC2)=C1c1ccccc1	ZINC000072173623	176333536	/nfs/dbraw/zinc/33/35/36/176333536.db2.gz	BDLUUSDNELKBHN-UHFFFAOYSA-N	1	0	273.332	2.067	1	0		CEAFRO
COC(=O)[C@H](c1cccc(OC)c1)[C@@]1(C)CCCC[NH2+]1	ZINC000064491815	523938825	/nfs/dbraw/zinc/93/88/25/523938825.db2.gz	WAQPAKBHMIGANH-GOEBONIOSA-N	1	0	277.364	2.484	1	0		CEAFRO
Cn1c2ccccc2c2c1[C@@H]1[C@H]([NH3+])CSCON1CC2	ZINC000026965088	171504021	/nfs/dbraw/zinc/50/40/21/171504021.db2.gz	DROZCQHDCHBUIV-DOMZBBRYSA-N	1	0	289.404	2.041	1	0		CEAFRO
[NH3+]C12C[C@H]3C[C@@H](C1)CC(n1cnc(Br)n1)(C3)C2	ZINC000045355338	175362146	/nfs/dbraw/zinc/36/21/46/175362146.db2.gz	LQEFAGWHUJLCGR-LRSDLPTKSA-N	1	0	297.200	2.047	1	0		CEAFRO
O=c1[nH]c2ccc(C[NH2+]C3CC3)cc2n2cccc12	ZINC000043013742	581101241	/nfs/dbraw/zinc/10/12/41/581101241.db2.gz	LHTGYYKFWBHLFV-UHFFFAOYSA-N	1	0	253.305	2.033	1	0		CEAFRO
O=c1[nH]ccc2cc(O[C@@H]3CCC[NH2+]C3)c(Cl)cc21	ZINC000096923497	185131638	/nfs/dbraw/zinc/13/16/38/185131638.db2.gz	RLERAEKWKCREHL-SNVBAGLBSA-N	1	0	278.739	2.312	1	0		CEAFRO
CC(C)(C)[NH2+]C[C@H](O)COc1ccc(O)c2c1CCCC2	ZINC000169319521	188657515	/nfs/dbraw/zinc/65/75/15/188657515.db2.gz	SFIZKDNZALFCPX-LBPRGKRZSA-N	1	0	293.407	2.399	1	0		CEAFRO
CN(c1cc[nH+]cc1)c1ccc(C2=NNC(=O)CC2)cc1	ZINC000040504132	174300640	/nfs/dbraw/zinc/30/06/40/174300640.db2.gz	XSSSZXXKWGDVJM-UHFFFAOYSA-N	1	0	280.331	2.464	1	0		CEAFRO
CCc1[nH+]c(N)nc(N)c1-c1ccc(F)c(F)c1	ZINC000045168554	175319896	/nfs/dbraw/zinc/31/98/96/175319896.db2.gz	IXNAWEINAFMZFK-UHFFFAOYSA-N	1	0	250.252	2.149	1	0		CEAFRO
Cc1ncn(C23C[C@@H]4C[C@@H](CC([C@@H](C)[NH3+])(C4)C2)C3)n1	ZINC000045355341	175361995	/nfs/dbraw/zinc/36/19/95/175361995.db2.gz	JZUKYOLBGIDVEH-GXJGTPHTSA-N	1	0	260.385	2.229	1	0		CEAFRO
[NH3+]CC[C@@H]1CCOC2(O1)C1CC3CC(C1)CC2C3	ZINC000071281974	176108902	/nfs/dbraw/zinc/10/89/02/176108902.db2.gz	YUAWOUDSFVMGIZ-DUTNFGBUSA-N	1	0	251.370	2.293	1	0		CEAFRO
CC(C)n1cnc2c1ncnc2NC1CCC([NH3+])CC1	ZINC000072107824	176317057	/nfs/dbraw/zinc/31/70/57/176317057.db2.gz	ISTZKPFDMYJBHY-UHFFFAOYSA-N	1	0	274.372	2.089	1	0		CEAFRO
CC(C)c1[nH]nc2c1ncnc2NC1CCC([NH3+])CC1	ZINC000072107823	176317110	/nfs/dbraw/zinc/31/71/10/176317110.db2.gz	SEHAXYJFDFRAFZ-UHFFFAOYSA-N	1	0	274.372	2.158	1	0		CEAFRO
C[NH2+]CC[C@H](c1ccc2cc(F)ccc2c1)n1ncnn1	ZINC000064373453	522018616	/nfs/dbraw/zinc/01/86/16/522018616.db2.gz	NSQVIEVBUSYQLK-OAHLLOKOSA-N	1	0	285.326	2.164	1	0		CEAFRO
CC1=C[C@H]2Cc3[nH]c(=O)ccc3[C@]3(C1)[NH2+]CCC[C@@H]23	ZINC000013442449	560104011	/nfs/dbraw/zinc/10/40/11/560104011.db2.gz	YYWGABLTRMRUIT-MQIPJXDCSA-N	1	0	256.349	2.092	1	0	biogenic,investigational	CEAFRO
CCC[NH+]1CCC(N2c3ccccc3C(=O)C2=O)CC1	ZINC000095563743	185010260	/nfs/dbraw/zinc/01/02/60/185010260.db2.gz	ZMHLLOSHNNKANA-UHFFFAOYSA-N	1	0	272.348	2.090	1	0		CEAFRO
CC(C)[N@H+]1C[C@@H]2C[C@@H](CN(C(=O)c3ccccc3)C2)C1	ZINC000000005064	169504479	/nfs/dbraw/zinc/50/44/79/169504479.db2.gz	UXOFXTUCXRNLFA-GASCZTMLSA-N	1	0	272.392	2.489	1	0		CEAFRO
CCN(CC)C(=O)[C@@]1(c2cccc(Cl)c2)C[C@H]1C[NH3+]	ZINC000001846953	169759675	/nfs/dbraw/zinc/75/96/75/169759675.db2.gz	DINLEIZQTNLLQD-SWLSCSKDSA-N	1	0	280.799	2.425	1	0		CEAFRO
c1ccc(Cc2noc([C@H]3C[NH+]4CCC3CC4)n2)cc1	ZINC000013887300	170606522	/nfs/dbraw/zinc/60/65/22/170606522.db2.gz	LLJIPPDBBZVYLL-AWEZNQCLSA-N	1	0	269.348	2.470	1	0		CEAFRO
C[C@@H]1C[NH2+]C[C@H]2Cc3ccc(C(F)(F)F)cc3N21	ZINC000028463118	171558922	/nfs/dbraw/zinc/55/89/22/171558922.db2.gz	YKTTWLUBVRMVLB-LDYMZIIASA-N	1	0	256.271	2.428	1	0		CEAFRO
CC(C)([NH2+]C1CCCC1)c1nc2c(cccc2C(N)=O)[nH]1	ZINC000040420549	174257563	/nfs/dbraw/zinc/25/75/63/174257563.db2.gz	POHXYUMXWOBJKO-UHFFFAOYSA-N	1	0	286.379	2.429	1	0		CEAFRO
COc1ccc(-c2nc(Cn3cnc(CC[NH3+])c3)co2)cc1	ZINC000072182126	176335154	/nfs/dbraw/zinc/33/51/54/176335154.db2.gz	DDFPQVVXEMDQMP-UHFFFAOYSA-N	1	0	298.346	2.096	1	0		CEAFRO
Clc1c[nH]c2ncnc(N3CCC4(C3)CC[NH2+]CC4)c12	ZINC000053297574	526925275	/nfs/dbraw/zinc/92/52/75/526925275.db2.gz	UFQMVEIAGMGCOD-UHFFFAOYSA-N	1	0	291.786	2.191	1	0		CEAFRO
C[NH+](C)[C@H]1C[C@H](c2c[nH]c3ccc(C(N)=O)cc32)C1	ZINC000100957835	185730139	/nfs/dbraw/zinc/73/01/39/185730139.db2.gz	WHLKSQOCYRUNEX-PHIMTYICSA-N	1	0	257.337	2.074	1	0		CEAFRO
CC(C)n1nc(-c2ccc(O)cc2)c2c1ncnc2N	ZINC000008581886	170341863	/nfs/dbraw/zinc/34/18/63/170341863.db2.gz	KLQFKOVDEHUNHU-UHFFFAOYSA-N	1	0	269.308	2.362	1	0		CEAFRO
NC(=[NH2+])NCC[C@H](c1ccc(F)cc1)c1ccccn1	ZINC000029569517	171604366	/nfs/dbraw/zinc/60/43/66/171604366.db2.gz	KIKDYOMNMIMECQ-CYBMUJFWSA-N	1	0	272.327	2.226	1	0		CEAFRO
COCCC[C@H]1c2cc(O)c(OC)cc2CC[N@H+]1C	ZINC000045350483	175361627	/nfs/dbraw/zinc/36/16/27/175361627.db2.gz	BUCUOGKPLMRUIA-ZDUSSCGKSA-N	1	0	265.353	2.356	1	0		CEAFRO
c1cc(C[N@@H+]2CCCC3(COC3)C2)cc2c1OCO2	ZINC000049111134	526422141	/nfs/dbraw/zinc/42/21/41/526422141.db2.gz	YVIHSPUQYDDGFN-UHFFFAOYSA-N	1	0	261.321	2.028	1	0		CEAFRO
COc1ccc(C(=O)OC2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1	ZINC000013375132	560215420	/nfs/dbraw/zinc/21/54/20/560215420.db2.gz	FEHHOXDSQFCXRO-ONXXMXGDSA-N	1	0	261.321	2.135	1	0	biogenic,in-vitro	CEAFRO
COC(=O)[C@@H](c1cccc(OC)c1)[C@@H]1CCCC[NH2+]1	ZINC000013747244	170587907	/nfs/dbraw/zinc/58/79/07/170587907.db2.gz	JYWKQWJGQMLJCO-KBPBESRZSA-N	1	0	263.337	2.094	1	0		CEAFRO
Cc1ccc(OCCCCCN2CC[NH2+]CC2)cc1	ZINC000022577135	171392269	/nfs/dbraw/zinc/39/22/69/171392269.db2.gz	WBMFBEHHYNXPFM-UHFFFAOYSA-N	1	0	262.397	2.449	1	0		CEAFRO
Cc1cc(C)nc(N(CC[NH2+]C(C)C)C(=O)N(C)C)c1	ZINC000027620901	171524802	/nfs/dbraw/zinc/52/48/02/171524802.db2.gz	PGLOERAMHHWEKZ-UHFFFAOYSA-N	1	0	278.400	2.184	1	0		CEAFRO
CCCOc1cc(OC)c(C[C@H](C)[NH3+])cc1OC	ZINC000027755825	171531729	/nfs/dbraw/zinc/53/17/29/171531729.db2.gz	YORRDSMCIGRARV-JTQLQIEISA-N	1	0	253.342	2.382	1	0		CEAFRO
NC(=O)c1cccc2[nH]c([C@H]3CC[N@@H+](C4CCCC4)C3)nc21	ZINC000040379373	174250077	/nfs/dbraw/zinc/25/00/77/174250077.db2.gz	NMAVQCGGQINJLI-NSHDSACASA-N	1	0	298.390	2.394	1	0		CEAFRO
O=C(Nc1ccc(O)c2ccccc12)[C@@H]1CCC[NH2+]1	ZINC000045290961	175354094	/nfs/dbraw/zinc/35/40/94/175354094.db2.gz	AAVFYNPSRQIHGH-ZDUSSCGKSA-N	1	0	256.305	2.236	1	0		CEAFRO
Cc1cn2c(n1)c1c(nc2Cc2ccccc2)CC[NH2+]CC1	ZINC000045299082	175354542	/nfs/dbraw/zinc/35/45/42/175354542.db2.gz	ASEMPVRCVLEMRC-UHFFFAOYSA-N	1	0	292.386	2.317	1	0		CEAFRO
C[N@@H+]1CCC[C@H]1CCCOC(=O)c1ccc(N)cc1	ZINC000045337297	175360735	/nfs/dbraw/zinc/36/07/35/175360735.db2.gz	BMSRBIUHEPPDRN-AWEZNQCLSA-N	1	0	262.353	2.300	1	0		CEAFRO
CC[C@@H](C)[C@H]([NH3+])C(=O)N1Cc2cccc(F)c2C1	ZINC000045496307	522367368	/nfs/dbraw/zinc/36/73/68/522367368.db2.gz	WMTZTXQJZSAPGO-RNCFNFMXSA-N	1	0	250.317	2.041	1	0		CEAFRO
C[NH+](C)CCN1C(=O)C[C@]2(C)Sc3ccccc3N=C12	ZINC000000480331	169652239	/nfs/dbraw/zinc/65/22/39/169652239.db2.gz	VXBHOZLTAYQRMN-HNNXBMFYSA-N	1	0	289.404	2.375	1	0		CEAFRO
OC[C@@H](O)C[NH2+]CCCn1c2ccccc2c2ccccc21	ZINC000205411907	395473036	/nfs/dbraw/zinc/47/30/36/395473036.db2.gz	WTUVGPIGHQUJCL-AWEZNQCLSA-N	1	0	298.386	2.127	2	0		CEAFRO
COCC[NH2+][C@@H]1CCC(=O)c2[nH]c3ccccc3c21	ZINC000006385382	170197271	/nfs/dbraw/zinc/19/72/71/170197271.db2.gz	GNUWKYIUQKLQTH-GFCCVEGCSA-N	1	0	258.321	2.422	1	0		CEAFRO
Clc1ncc(O[C@@H]2CC[NH2+]C2)cc1Br	ZINC000026010393	171470461	/nfs/dbraw/zinc/47/04/61/171470461.db2.gz	SSZZSICQMXUHQC-ZCFIWIBFSA-N	1	0	277.549	2.238	1	0		CEAFRO
CCN1CCCN(CCC[NH+]2CCC(C)CC2)C1=O	ZINC000027732950	171530539	/nfs/dbraw/zinc/53/05/39/171530539.db2.gz	KIBIECXPZZOYPB-UHFFFAOYSA-N	1	0	267.417	2.256	1	0		CEAFRO
CCC[N@@H+]1CCO[C@@H]2c3cc(C(=O)NC)ccc3CC[C@H]21	ZINC000040421094	174258161	/nfs/dbraw/zinc/25/81/61/174258161.db2.gz	GVOGXTVYHLDSDH-HZPDHXFCSA-N	1	0	288.391	2.144	1	0		CEAFRO
CC/C(=C/c1ccccc1OC[C@@H](O)C[NH2+]C(C)C)CO	ZINC000040466424	174274867	/nfs/dbraw/zinc/27/48/67/174274867.db2.gz	NSELJLYSHRXTMA-MBSJSRAVSA-N	1	0	293.407	2.210	1	0		CEAFRO
NC(=[NH2+])N1N=C(c2ccccc2)C[C@H]1c1ccncc1	ZINC000072175535	176334345	/nfs/dbraw/zinc/33/43/45/176334345.db2.gz	UMWXHHKHCCQXSZ-AWEZNQCLSA-N	1	0	265.320	2.126	1	0		CEAFRO
[NH3+]CCCNC(=O)c1ccc(-c2n[nH]c3ccccc32)cc1	ZINC000072178887	176334732	/nfs/dbraw/zinc/33/47/32/176334732.db2.gz	LOIBJZYMXKAYQI-UHFFFAOYSA-N	1	0	294.358	2.309	1	0		CEAFRO
O=c1[nH]c2ccc(C[NH+]3CCCC3)cc2n2cccc12	ZINC000042922094	581101185	/nfs/dbraw/zinc/10/11/85/581101185.db2.gz	PCWMEZNUFYUIRN-UHFFFAOYSA-N	1	0	267.332	2.377	1	0		CEAFRO
C[C@@H]([NH2+]Cc1ccc(OCc2ccsc2)cc1)C(N)=O	ZINC000096903333	185128548	/nfs/dbraw/zinc/12/85/48/185128548.db2.gz	GQVAIEVSBSVLLQ-LLVKDONJSA-N	1	0	290.388	2.291	1	0		CEAFRO
COC(=O)[C@@H](c1ccccc1OC)[C@@H]1CCCC[NH2+]1	ZINC000013747242	170588066	/nfs/dbraw/zinc/58/80/66/170588066.db2.gz	WTAVBYHGJYGHET-JSGCOSHPSA-N	1	0	263.337	2.094	1	0		CEAFRO
CC[C@H](C)[C@H]([NH3+])C(=O)N1Cc2cccc(F)c2C1	ZINC000040395505	174252946	/nfs/dbraw/zinc/25/29/46/174252946.db2.gz	WMTZTXQJZSAPGO-ZANVPECISA-N	1	0	250.317	2.041	1	0		CEAFRO
CC[NH+](CC)CCNC(=O)c1ccc(-c2ncc[nH]2)cc1	ZINC000040465208	174274459	/nfs/dbraw/zinc/27/44/59/174274459.db2.gz	GRDAOZOYDMVEKO-UHFFFAOYSA-N	1	0	286.379	2.148	1	0		CEAFRO
C[N@@H+]1CCC[C@@H]1CCCOC(=O)c1ccc(N)cc1	ZINC000045337295	175360694	/nfs/dbraw/zinc/36/06/94/175360694.db2.gz	BMSRBIUHEPPDRN-CQSZACIVSA-N	1	0	262.353	2.300	1	0		CEAFRO
[NH3+]CCN1C(=O)S[C@@H](CCCc2ccccc2)C1=O	ZINC000058633059	527186901	/nfs/dbraw/zinc/18/69/01/527186901.db2.gz	KYZSHIGUEDWRKO-LBPRGKRZSA-N	1	0	278.377	2.032	1	0		CEAFRO
C[C@H](CN1CCc2c3ccccc3oc(=O)c2C1)[NH+](C)C	ZINC000027757090	171531930	/nfs/dbraw/zinc/53/19/30/171531930.db2.gz	NMWHCTHSUBOKAC-GFCCVEGCSA-N	1	0	286.375	2.101	1	0		CEAFRO
COc1cccc(C2(C)CN(c3cc(N)cc[nH+]3)C2)c1	ZINC000040429899	174259285	/nfs/dbraw/zinc/25/92/85/174259285.db2.gz	PSAGNQSIEQQFKW-UHFFFAOYSA-N	1	0	269.348	2.450	1	0		CEAFRO
N=C1NC(=[NH2+])NC2(CCCCC2)N1OCC1CCCCC1	ZINC000045302837	175355818	/nfs/dbraw/zinc/35/58/18/175355818.db2.gz	XRQKJYAKEYJMFD-UHFFFAOYSA-N	1	0	293.415	2.313	1	0		CEAFRO
Cc1ccc(N2C[C@@H]3CCC[C@H](C[NH+](C)C)[C@@H]3C2)nn1	ZINC000299842622	333187689	/nfs/dbraw/zinc/18/76/89/333187689.db2.gz	VYWIOTLSSJDXTJ-ILXRZTDVSA-N	1	0	274.412	2.199	1	0		CEAFRO
C[NH2+][C@H]1Cc2c[nH]c3cccc(c23)[C@H]1/C=C(\C)CO	ZINC000012153580	560211514	/nfs/dbraw/zinc/21/15/14/560211514.db2.gz	SAHHMCVYMGARBT-ZSDOXGQDSA-N	1	0	256.349	2.334	1	0	in-vitro	CEAFRO
C[NH2+]CCc1c[nH]c(=S)n1[C@H]1COc2ccccc2C1	ZINC000013681203	170577166	/nfs/dbraw/zinc/57/71/66/170577166.db2.gz	CIZSXHJFJOUTBA-CYBMUJFWSA-N	1	0	289.404	2.484	1	0		CEAFRO
COc1ccc2[nH]ccc2c1C(=O)N[C@H]1C[NH+]2CCC1CC2	ZINC000027524221	171519049	/nfs/dbraw/zinc/51/90/49/171519049.db2.gz	HMOMXYPGOQVVIY-AWEZNQCLSA-N	1	0	299.374	2.001	1	0		CEAFRO
CC(C)C[N@@H+]1CC[C@H]2[C@@H]1CCN2C(=O)N1CCCC1	ZINC000299842923	333187975	/nfs/dbraw/zinc/18/79/75/333187975.db2.gz	KGLPCNBJKYJXSE-KBPBESRZSA-N	1	0	265.401	2.007	1	0		CEAFRO
Cc1nc2cnc3[nH]ccc3c2n1[C@@H]1CC[NH2+]C[C@H]1F	ZINC000095576724	185011309	/nfs/dbraw/zinc/01/13/09/185011309.db2.gz	LLIVYAMDALVWBN-ZYHUDNBSSA-N	1	0	273.315	2.094	1	0		CEAFRO
C[C@]1(c2cccc(Nc3ccon3)c2)COCC(=[NH2+])N1	ZINC000169335900	188659345	/nfs/dbraw/zinc/65/93/45/188659345.db2.gz	CRVBAIKEFVZIOQ-CQSZACIVSA-N	1	0	272.308	2.021	1	0		CEAFRO
Clc1cc2ncc(N3CC[NH2+]CC3)nc2cc1Cl	ZINC000025967036	361634550	/nfs/dbraw/zinc/63/45/50/361634550.db2.gz	YHIIYPAPGGCWLA-UHFFFAOYSA-N	1	0	283.162	2.346	1	0		CEAFRO
NC(=[NH2+])c1ccc(/C=C2/N=C(c3ccccc3)OC2=O)cc1	ZINC000006733270	170235870	/nfs/dbraw/zinc/23/58/70/170235870.db2.gz	JBHISGPWLXASFE-GXDHUFHOSA-N	1	0	291.310	2.315	1	0		CEAFRO
CCOC(=O)c1[nH]c2ccccc2c1CC[NH+](C)C	ZINC000013864767	170605598	/nfs/dbraw/zinc/60/55/98/170605598.db2.gz	DHMRDBMKJIHQOM-UHFFFAOYSA-N	1	0	260.337	2.449	1	0		CEAFRO
CCCOC(=O)[C@@]1(c2ccccc2)C[C@@H]1C[NH+](C)C	ZINC000026989970	171505263	/nfs/dbraw/zinc/50/52/63/171505263.db2.gz	IKAJUOJCFVXTST-GDBMZVCRSA-N	1	0	261.365	2.459	1	0		CEAFRO
COc1ccc2c(c1)[C@](C)(CCC[NH+](C)C)C(=O)N2C	ZINC000045202667	175327256	/nfs/dbraw/zinc/32/72/56/175327256.db2.gz	OZGRNKLIRVSEIF-INIZCTEOSA-N	1	0	276.380	2.271	1	0		CEAFRO
Clc1cnc2oc(N3CC[NH+]4CCC3CC4)nc2c1	ZINC000045358233	175362207	/nfs/dbraw/zinc/36/22/07/175362207.db2.gz	KZCFXYPUJPOLMF-UHFFFAOYSA-N	1	0	278.743	2.161	1	0		CEAFRO
Cc1cccc(O[C@H]2COCC[N@@H+](C3CCC3)C2)n1	ZINC000077265570	177246510	/nfs/dbraw/zinc/24/65/10/177246510.db2.gz	UQXOJIVAZFUTTE-CQSZACIVSA-N	1	0	262.353	2.022	1	0		CEAFRO
C[NH2+]CC[C@H](c1ccc2cc(F)ccc2c1)n1nnc(C)n1	ZINC000058592523	522018000	/nfs/dbraw/zinc/01/80/00/522018000.db2.gz	MGURNBDIUXGJTO-MRXNPFEDSA-N	1	0	299.353	2.473	1	0		CEAFRO
O=c1cc(-c2ccccc2)c(NCC[NH+]2CCCCC2)n[nH]1	ZINC000095604774	185015173	/nfs/dbraw/zinc/01/51/73/185015173.db2.gz	LXQYIUPKMFXKCS-UHFFFAOYSA-N	1	0	298.390	2.335	1	0		CEAFRO
C(=C\c1cncc(O[C@@H]2CC[NH2+]C2)c1)\c1ccncc1	ZINC000084581604	178900582	/nfs/dbraw/zinc/90/05/82/178900582.db2.gz	BEJGILHFZNTYCX-DJYNDVHFSA-N	1	0	267.332	2.388	1	0		CEAFRO
OC[C@H](O)C[NH2+]CCCn1c2ccccc2c2ccccc21	ZINC000205411918	395472760	/nfs/dbraw/zinc/47/27/60/395472760.db2.gz	WTUVGPIGHQUJCL-CQSZACIVSA-N	1	0	298.386	2.127	2	0		CEAFRO
CCOc1ccc(OCC)c2c1CC[C@]1(C[NH+]=CN1)C2	ZINC000013743744	170586685	/nfs/dbraw/zinc/58/66/85/170586685.db2.gz	GMPOBTDQVDFGRQ-MRXNPFEDSA-N	1	0	274.364	2.343	1	0		CEAFRO
Cn1c(-c2ccc(C(N)=S)cc2)c[n+]2ccccc12	ZINC000026834947	171500428	/nfs/dbraw/zinc/50/04/28/171500428.db2.gz	PSBNSGKTYRSESL-UHFFFAOYSA-O	1	0	268.365	2.065	1	0		CEAFRO
C[C@]([NH3+])(CO)C(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000035994585	172428075	/nfs/dbraw/zinc/42/80/75/172428075.db2.gz	FBYVWZSQRLJDIC-INIZCTEOSA-N	1	0	270.332	2.002	1	0		CEAFRO
c1ccc([C@H](Cc2ccncc2)N2CC[NH2+]CC2)cc1	ZINC000036093344	172437230	/nfs/dbraw/zinc/43/72/30/172437230.db2.gz	QVONDVLKKQSPCH-KRWDZBQOSA-N	1	0	267.376	2.271	1	0	in-vivo	CEAFRO
COc1ccc2c(c1)C(=O)C(c1ccc(N)cc1)[N+]2=O	ZINC000045300864	175355153	/nfs/dbraw/zinc/35/51/53/175355153.db2.gz	HTBDGBPUYWVYCA-UHFFFAOYSA-N	1	0	268.272	2.105	1	0	in-vitro	CEAFRO
CCNc1[nH+]cc(C(N)=O)c2[nH]c3ccc(F)cc3c21	ZINC000072122824	176320104	/nfs/dbraw/zinc/32/01/04/176320104.db2.gz	VYCZGZDYYGZFCM-UHFFFAOYSA-N	1	0	272.283	2.386	1	0		CEAFRO
CC[C@H](C)[C@H]1CNC(=S)N1CC1CC[NH+](CC)CC1	ZINC000061924317	522008968	/nfs/dbraw/zinc/00/89/68/522008968.db2.gz	FGSIBOPHHIQYLQ-GXTWGEPZSA-N	1	0	283.485	2.323	3	0		CEAFRO
NC(=[NH2+])c1ccc2[nH]c(-c3nc4ccccc4[nH]3)nc2c1	ZINC000028568775	581101045	/nfs/dbraw/zinc/10/10/45/581101045.db2.gz	LRSKOSQIRCGSNJ-UHFFFAOYSA-N	1	0	276.303	2.390	1	0		CEAFRO
C[C@H]([NH3+])CNc1nc(-c2ccncc2)cc2cnccc21	ZINC000095560828	185008994	/nfs/dbraw/zinc/00/89/94/185008994.db2.gz	YUJAAMQBNNAQRP-NSHDSACASA-N	1	0	279.347	2.451	1	0		CEAFRO
COc1ccc2c3c1O[C@@H]1C[C@@H](O)CC[C@]31CC[N@@H+](C)C2	ZINC000095884323	394674577	/nfs/dbraw/zinc/67/45/77/394674577.db2.gz	GJRMHIXYLGOZSE-DXCKQFNASA-N	1	0	289.375	2.074	2	0		CEAFRO
COc1ccc(-c2nn(C(C)C)c3ncnc(N)c23)cc1O	ZINC000008581958	170341961	/nfs/dbraw/zinc/34/19/61/170341961.db2.gz	KUUKOPMICNKRGE-UHFFFAOYSA-N	1	0	299.334	2.371	1	0		CEAFRO
CCCN(CC)C(=O)[C@]1(c2ccccc2)C[C@@H]1C[NH3+]	ZINC000029127623	171587394	/nfs/dbraw/zinc/58/73/94/171587394.db2.gz	UJXZJZLGZRRPNH-ZBFHGGJFSA-N	1	0	260.381	2.162	1	0		CEAFRO
C[C@]([NH3+])(CO)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000040402945	174253862	/nfs/dbraw/zinc/25/38/62/174253862.db2.gz	SXDHMBGHFLDSDV-INIZCTEOSA-N	1	0	286.331	2.127	1	0		CEAFRO
Cc1nn(C)c(NC(=O)Cc2ccccc2)c1[N+]#N	ZINC000095576061	185011135	/nfs/dbraw/zinc/01/11/35/185011135.db2.gz	XPPPBANSHMOOJT-UHFFFAOYSA-O	1	0	256.289	2.394	1	0		CEAFRO
CC[NH+](CC)CCCNC(=O)c1[nH]c(C)c(C)c1C	ZINC000027757409	171531891	/nfs/dbraw/zinc/53/18/91/171531891.db2.gz	WUROVXJKQZYPQI-UHFFFAOYSA-N	1	0	265.401	2.402	1	0		CEAFRO
OC[C@H]1CC[C@@H](O)[C@H]([NH+]2CCC(c3ccccc3)CC2)C1	ZINC000028239909	171553223	/nfs/dbraw/zinc/55/32/23/171553223.db2.gz	JFNQWJIRYFURGB-BMGDILEWSA-N	1	0	289.419	2.388	1	0		CEAFRO
CN1CC[C@](c2ccccc2)([NH+]2CCCCC2)C1=O	ZINC000071318896	176122602	/nfs/dbraw/zinc/12/26/02/176122602.db2.gz	LBPAWUSEFJACHD-MRXNPFEDSA-N	1	0	258.365	2.230	1	0		CEAFRO
CC[NH2+]C[C@H]1C[C@H]([C@H](C)c2ccc(C=O)cc2)N2C[C@@H]12	ZINC000085547893	290840332	/nfs/dbraw/zinc/84/03/32/290840332.db2.gz	YQKFLZKZXDGNJM-VMMLNQTBSA-N	1	0	272.392	2.285	1	0	biogenic,in-vitro	CEAFRO
Cc1ccc(C2=CN(O)[C@@H]3CCCC[C@@H]3[N+]2=O)cc1	ZINC000101180825	364555687	/nfs/dbraw/zinc/55/56/87/364555687.db2.gz	PQVNHRORXCBZCV-KGLIPLIRSA-N	1	0	258.321	2.200	1	0		CEAFRO
C[C@H]1C[C@H]2CC(=O)C[C@@]3(C1)[C@@H]2CCC[N@@H+]3CCCO	ZINC000005812814	170142338	/nfs/dbraw/zinc/14/23/38/170142338.db2.gz	YCNYNASSMKILCM-UGQVUOCMSA-N	1	0	265.397	2.229	1	0		CEAFRO
OCC[C@H]1CN(C2CCSCC2)CC[N@@H+]1C1CCCC1	ZINC000020905469	171279424	/nfs/dbraw/zinc/27/94/24/171279424.db2.gz	IZQOHXHIIDOEJF-INIZCTEOSA-N	1	0	298.496	2.193	3	0		CEAFRO
CCC(=O)OC1(c2cccc(O)c2)CC[NH+](C)CC1	ZINC000027878765	171535530	/nfs/dbraw/zinc/53/55/30/171535530.db2.gz	MJKVIILPAOMVFT-UHFFFAOYSA-N	1	0	263.337	2.266	1	0		CEAFRO
[NH3+]CCCNc1cccc(-c2cnc3ccccn32)n1	ZINC000029044256	171584166	/nfs/dbraw/zinc/58/41/66/171584166.db2.gz	IIYVXYXKYNUIAE-UHFFFAOYSA-N	1	0	267.336	2.157	1	0		CEAFRO
CC[NH2+]Cc1cncc(-c2ccc(F)cc2OC)n1	ZINC000071332074	176125131	/nfs/dbraw/zinc/12/51/31/176125131.db2.gz	WPBRGSPFSJGKNQ-UHFFFAOYSA-N	1	0	261.300	2.401	1	0		CEAFRO
CC(C)(C)CN1CC[NH2+]C[C@H]1Cc1ccc(O)cc1	ZINC000061711164	518663604	/nfs/dbraw/zinc/66/36/04/518663604.db2.gz	HCTSTJCPGHCNRB-CQSZACIVSA-N	1	0	262.397	2.255	3	0		CEAFRO
C[NH+](C)Cc1ccc(-n2cc3cccc(C(N)=O)c3n2)cc1	ZINC000049111091	521894004	/nfs/dbraw/zinc/89/40/04/521894004.db2.gz	HPJWGBHPCIQMHS-UHFFFAOYSA-N	1	0	294.358	2.186	1	0		CEAFRO
COC1=CC=C2[C@H]3Cc4ccc(O)c5c4[C@@]2(CC[N@@H+]3C)[C@@H]1O5	ZINC000000896053	574411103	/nfs/dbraw/zinc/41/11/03/574411103.db2.gz	ZKLXUUYLEHCAMF-PJSAGSTRSA-N	1	0	297.354	2.122	1	0	endogenous,in-man	CEAFRO
Nc1sc(-c2ccccc2)cc1C(=O)N1CC[NH2+]CC1	ZINC000095603461	185015539	/nfs/dbraw/zinc/01/55/39/185015539.db2.gz	RRONWBJQOCELMN-UHFFFAOYSA-N	1	0	287.388	2.043	3	0		CEAFRO
C[NH+]1CCC2(CC1)c1cc(Br)ccc1N[C@H]2O	ZINC000205436732	344528481	/nfs/dbraw/zinc/52/84/81/344528481.db2.gz	DDNYHBDMEJGJCC-LBPRGKRZSA-N	1	0	297.196	2.156	2	0		CEAFRO
Clc1ccc2c(c1Cl)O[C@H](C1=[NH+]CCN1)C2	ZINC000027647376	171526481	/nfs/dbraw/zinc/52/64/81/171526481.db2.gz	NKBMNIKXSHVKLV-QMMMGPOBSA-N	1	0	257.120	2.299	1	0		CEAFRO
Cc1ccccc1O[C@@H]1c2ccccc2C[C@@]1(O)C[NH3+]	ZINC000040845580	174418946	/nfs/dbraw/zinc/41/89/46/174418946.db2.gz	LXXOMHAIVSCBSY-IAGOWNOFSA-N	1	0	269.344	2.361	1	0		CEAFRO
CC(C)=CCC/C(C)=C/C=C/C(=O)NC[C@H]([NH3+])CCO	ZINC000040863796	174426315	/nfs/dbraw/zinc/42/63/15/174426315.db2.gz	DYDZAFPFZIJXKB-WPOLDJQQSA-N	1	0	280.412	2.061	1	0		CEAFRO
COC[C@@H](C)[NH2+]Cc1coc(-c2ccc(OC)cc2)n1	ZINC000072185607	176335591	/nfs/dbraw/zinc/33/55/91/176335591.db2.gz	FLBYTWHKDSKMQM-LLVKDONJSA-N	1	0	276.336	2.475	1	0		CEAFRO
C[NH2+][C@@H](C)c1ccc(-n2cc3cccc(C(N)=O)c3n2)cc1	ZINC000049113076	522330652	/nfs/dbraw/zinc/33/06/52/522330652.db2.gz	PGTMEVUZFLFYQD-NSHDSACASA-N	1	0	294.358	2.405	1	0		CEAFRO
C[N@H+](C1CCC1)C(C)(C)c1nc2c(cccc2C(N)=O)[nH]1	ZINC000040919243	581098880	/nfs/dbraw/zinc/09/88/80/581098880.db2.gz	YFOLFXVCGRQQMD-UHFFFAOYSA-N	1	0	286.379	2.381	1	0		CEAFRO
Clc1cncc(OCc2cc(OC[C@@H]3CC[NH2+]3)no2)c1	ZINC000095562896	185008978	/nfs/dbraw/zinc/00/89/78/185008978.db2.gz	WDBLHIYRGWVIPR-JTQLQIEISA-N	1	0	295.726	2.043	1	0		CEAFRO
COc1ccc([C@@]23CC[N@H+](C)[C@H]2CC(=O)CC3)cc1OC	ZINC000086036403	179221660	/nfs/dbraw/zinc/22/16/60/179221660.db2.gz	DAHIQPJTGIHDGO-DLBZAZTESA-N	1	0	289.375	2.399	2	0		CEAFRO
CC1(C)[C@@H]2CC[C@@]1([C@@H](O)C[NH+]1CCCCC1)C(=O)C2	ZINC000169333701	188659201	/nfs/dbraw/zinc/65/92/01/188659201.db2.gz	HBXPJSRVQDQRSN-INWMFGNUSA-N	1	0	265.397	2.229	1	0		CEAFRO
NC(=O)c1cccc2[nH]c([C@@H]3CC[N@@H+](C4CCCC4)C3)nc21	ZINC000040379372	174249939	/nfs/dbraw/zinc/24/99/39/174249939.db2.gz	NMAVQCGGQINJLI-LLVKDONJSA-N	1	0	298.390	2.394	1	0		CEAFRO
CC(C)[N@@H+]1CC[C@@](C)(c2nc3c(cccc3C(N)=O)[nH]2)C1	ZINC000040431357	174260321	/nfs/dbraw/zinc/26/03/21/174260321.db2.gz	MXVHYHSXVGUFLG-MRXNPFEDSA-N	1	0	286.379	2.034	1	0		CEAFRO
Cc1ccc(OC[C@H](O)C[NH2+]C(C)(C)C)c(/C=C/CO)c1	ZINC000040465693	174274408	/nfs/dbraw/zinc/27/44/08/174274408.db2.gz	RYLROWMVCUSYIK-LLYBFZRZSA-N	1	0	293.407	2.128	1	0		CEAFRO
NC1=[NH+]CC[C@H](c2c[nH]c3ccc(Br)cc32)N1	ZINC000045256611	175336613	/nfs/dbraw/zinc/33/66/13/175336613.db2.gz	VVONRGQMZKFFRP-LLVKDONJSA-N	1	0	293.168	2.280	1	0		CEAFRO
CC(C)n1cnc2c1ncnc2N[C@@H]1CCCC[C@H]1[NH3+]	ZINC000072108232	176317015	/nfs/dbraw/zinc/31/70/15/176317015.db2.gz	SWLBUASPUHFXAX-GHMZBOCLSA-N	1	0	274.372	2.089	1	0		CEAFRO
C[NH+](C)C[C@@H]1CCOc2ccc(Cl)cc2C1=O	ZINC000062625168	521849947	/nfs/dbraw/zinc/84/99/47/521849947.db2.gz	HWCODPOCDUCBGO-VIFPVBQESA-N	1	0	253.729	2.483	1	0		CEAFRO
CNc1nc(N2CC([NH+](C)C)C2)nc2ccc(Cl)cc21	ZINC000095555911	185008164	/nfs/dbraw/zinc/00/81/64/185008164.db2.gz	FBESFXOTONWCII-UHFFFAOYSA-N	1	0	291.786	2.075	1	0		CEAFRO
NC(=O)[C@]12C[C@@]1(c1ccc(Cl)c(Cl)c1)CC[NH2+]C2	ZINC000096900645	185127029	/nfs/dbraw/zinc/12/70/29/185127029.db2.gz	RFTBXAYWUQYHOQ-CHWSQXEVSA-N	1	0	285.174	2.100	1	0		CEAFRO
COc1ccc(CCC[NH+]2CCC(CO)CC2)cc1	ZINC000026000030	171470197	/nfs/dbraw/zinc/47/01/97/171470197.db2.gz	FVOSZXJHBWHIQM-UHFFFAOYSA-N	1	0	263.381	2.332	1	0		CEAFRO
C[NH2+]C[C@@H](O)[C@H](c1ccccc1)N1CCc2ccccc21	ZINC000035940943	172426130	/nfs/dbraw/zinc/42/61/30/172426130.db2.gz	QGRXBVDPAGZYDU-MSOLQXFVSA-N	1	0	282.387	2.371	1	0		CEAFRO
CN(CC[NH+](C)C)Cc1coc(-c2ccc(O)cc2)n1	ZINC000072186150	176335841	/nfs/dbraw/zinc/33/58/41/176335841.db2.gz	MJNPFJPISCTVEX-UHFFFAOYSA-N	1	0	275.352	2.041	1	0		CEAFRO
CC(C)[NH2+]C1=C[C@H]2NC(=O)C=C(C(F)(F)F)[C@H]2C=C1	ZINC000101426598	185741291	/nfs/dbraw/zinc/74/12/91/185741291.db2.gz	DSFOSETVQOUXLU-MWLCHTKSSA-N	1	0	272.270	2.041	1	0		CEAFRO
CCC[NH+](CCC)[C@H]1Cc2cccc3c2N(C1)C(=O)CO3	ZINC000012356014	535326796	/nfs/dbraw/zinc/32/67/96/535326796.db2.gz	HTTOQWRXSYPSPD-AWEZNQCLSA-N	1	0	288.391	2.459	1	0		CEAFRO
CC(C)=C[N@H+]1Cc2cccc3[nH]c(=O)n(c32)C[C@@H]1C	ZINC000006495338	170207404	/nfs/dbraw/zinc/20/74/04/170207404.db2.gz	MVDZFLSDBWTBCG-NSHDSACASA-N	1	0	257.337	2.457	1	0		CEAFRO
CCC[NH+](CCC)[C@H]1CCn2c(CO)ccc2C1	ZINC000013642112	170571906	/nfs/dbraw/zinc/57/19/06/170571906.db2.gz	FFZALGRQJRVCKO-ZDUSSCGKSA-N	1	0	250.386	2.417	1	0		CEAFRO
CCC[NH2+][C@@H]1CCc2ccc3[nH]c(C(N)=O)cc3c2C1	ZINC000013832096	170601932	/nfs/dbraw/zinc/60/19/32/170601932.db2.gz	XVRLZUUEOHNLID-LLVKDONJSA-N	1	0	271.364	2.124	1	0		CEAFRO
[NH3+]CCCC[C@H]1CNC(=S)N1CCc1cccc(F)c1	ZINC000015952983	170683498	/nfs/dbraw/zinc/68/34/98/170683498.db2.gz	ZEYIQFJVSAAJAX-AWEZNQCLSA-N	1	0	295.427	2.467	3	0		CEAFRO
COC(=O)[C@H]1[C@H]2CC[C@@H](C[C@@H]1c1cccc(F)c1)[NH2+]2	ZINC000028476726	171560141	/nfs/dbraw/zinc/56/01/41/171560141.db2.gz	CKYDEMLAGYDNBA-REWJHTLYSA-N	1	0	263.312	2.223	1	0		CEAFRO
O=C1c2cc3c(cc2[N+](=O)C1c1ccc(F)cc1)OCO3	ZINC000045290066	175354181	/nfs/dbraw/zinc/35/41/81/175354181.db2.gz	HGDZIUAHHKLGFQ-UHFFFAOYSA-N	1	0	285.230	2.382	1	0		CEAFRO
CC(C)C1=[NH+]c2cc(C(N)=O)ccc2CN1C1CC1	ZINC000045300397	175355087	/nfs/dbraw/zinc/35/50/87/175355087.db2.gz	VVEMCVOYZBKBEA-UHFFFAOYSA-N	1	0	257.337	2.450	1	0		CEAFRO
Clc1cccc(Cc2ncc3c(n2)CC[NH2+]CC3)c1	ZINC000071341905	176130638	/nfs/dbraw/zinc/13/06/38/176130638.db2.gz	QBQLRABAJGBGHY-UHFFFAOYSA-N	1	0	273.767	2.409	1	0		CEAFRO
O=c1ccc(-c2ccc(OCCC[NH+]3CCCC3)cc2)n[nH]1	ZINC000072112291	176317776	/nfs/dbraw/zinc/31/77/76/176317776.db2.gz	ZOYICIUZAKWQLX-UHFFFAOYSA-N	1	0	299.374	2.302	1	0		CEAFRO
CCCC[NH2+]CCOC1=C(c2ccccc2)C(=O)OC1	ZINC000072173573	176333519	/nfs/dbraw/zinc/33/35/19/176333519.db2.gz	DMULDJSFJMNWKC-UHFFFAOYSA-N	1	0	275.348	2.361	1	0		CEAFRO
CC[NH2+]Cc1nc2c(cnc3ccccc23)n1CCCO	ZINC000072175116	176334359	/nfs/dbraw/zinc/33/43/59/176334359.db2.gz	SQLGWKPLVKYASX-UHFFFAOYSA-N	1	0	284.363	2.076	1	0		CEAFRO
Nc1nccc(-n2cc(-c3cccnc3)c3c[nH+]ccc32)n1	ZINC000095602600	185015686	/nfs/dbraw/zinc/01/56/86/185015686.db2.gz	AWCHMFGQIYZKHQ-UHFFFAOYSA-N	1	0	288.314	2.460	1	0		CEAFRO
Cc1cc(N)nc(COc2cccc(OCCC[NH3+])c2)c1	ZINC000095921106	185031836	/nfs/dbraw/zinc/03/18/36/185031836.db2.gz	USONDHXIUNXLQT-UHFFFAOYSA-N	1	0	287.363	2.279	1	0	in-vitro	CEAFRO
C[C@@H]1C[C@]23CC[N@H+](C)[C@H](Cc4ccc(O)cc42)[C@@]3(C)O1	ZINC000169316839	188657335	/nfs/dbraw/zinc/65/73/35/188657335.db2.gz	KOIWWLNSZWPHPI-GAEVZRCVSA-N	1	0	273.376	2.458	1	0		CEAFRO
C[C@H]1C[N@H+](C)[C@@H](C)C[C@@H]1NCc1ccc2c(c1)OCO2	ZINC000005574330	170115210	/nfs/dbraw/zinc/11/52/10/170115210.db2.gz	RSTSMVMSMDWOHJ-OBJOEFQTSA-N	1	0	276.380	2.234	1	0		CEAFRO
CC/C=C\C/C=C\[C@@H]1CC(=O)NCCC[NH2+]CCCC[NH2+]1	ZINC000005813135	170142481	/nfs/dbraw/zinc/14/24/81/170142481.db2.gz	LUOMCXKCIGOCHI-LBLOSMJHSA-N	1	0	293.455	2.137	1	0		CEAFRO
[NH3+]CCc1ccc(OCC(=O)c2ccccc2)cc1	ZINC000013681023	170577028	/nfs/dbraw/zinc/57/70/28/170577028.db2.gz	XSJKCEYNHKPKTH-UHFFFAOYSA-N	1	0	255.317	2.450	1	0		CEAFRO
CCN(CC)C(=O)[C@]1(c2ccc(Cl)cc2)C[C@H]1C[NH3+]	ZINC000026977681	171504872	/nfs/dbraw/zinc/50/48/72/171504872.db2.gz	NBBIANDDBKBHLU-WFASDCNBSA-N	1	0	280.799	2.425	1	0		CEAFRO
CCc1ccc(OC[C@H](O)[C@@H](C)[NH2+]C(C)C)cc1	ZINC000028226934	171552186	/nfs/dbraw/zinc/55/21/86/171552186.db2.gz	CUZFGTDGZMBXRB-DOMZBBRYSA-N	1	0	251.370	2.375	1	0		CEAFRO
Cc1nc2nc(N3CC[NH+]4CCC3CC4)oc2cc1Cl	ZINC000045387954	175373601	/nfs/dbraw/zinc/37/36/01/175373601.db2.gz	PKPRDSSAMMLSLJ-UHFFFAOYSA-N	1	0	292.770	2.469	1	0		CEAFRO
Cc1cccc(Cc2ncc3c(n2)CC[NH2+]CC3)c1	ZINC000071341052	176130639	/nfs/dbraw/zinc/13/06/39/176130639.db2.gz	YJSHACXMERNKPI-UHFFFAOYSA-N	1	0	253.349	2.064	1	0		CEAFRO
C[NH2+][C@H](C)c1ccc(-n2cc3cccc(C(N)=O)c3n2)cc1	ZINC000049113077	522447257	/nfs/dbraw/zinc/44/72/57/522447257.db2.gz	PGTMEVUZFLFYQD-LLVKDONJSA-N	1	0	294.358	2.405	1	0		CEAFRO
[NH3+][C@H]1CCC[C@H](Oc2ccc3c(cc[nH]c3=O)c2)C1	ZINC000066065886	527407563	/nfs/dbraw/zinc/40/75/63/527407563.db2.gz	KVMDQFUADAHBKC-RYUDHWBXSA-N	1	0	258.321	2.177	1	0		CEAFRO
Nc1cc([C@@H]2CCC[NH2+]C2)nc2c(-c3ccoc3)cnn21	ZINC000066099495	527460388	/nfs/dbraw/zinc/46/03/88/527460388.db2.gz	RHSKGYLLXUHXJP-SNVBAGLBSA-N	1	0	283.335	2.039	1	0		CEAFRO
C[C@@H]1C[N@H+](C)[C@@H]2Cc3c[nH]c4cccc(c34)[C@@H]2[C@H]1O	ZINC000095635912	574417130	/nfs/dbraw/zinc/41/71/30/574417130.db2.gz	JUXRVSRUBIFVKE-HJJSQFDVSA-N	1	0	256.349	2.119	1	0	endogenous,in-man	CEAFRO
c1cnc(N2C[C@H]3CCC[C@@H](C[NH+]4CCCC4)[C@H]3C2)nc1	ZINC000096090766	185095326	/nfs/dbraw/zinc/09/53/26/185095326.db2.gz	MYCPZKRETXCWLJ-ARFHVFGLSA-N	1	0	286.423	2.425	1	0		CEAFRO
C[NH+](C)CCSc1nnc2[nH]c3ccccc3c2n1	ZINC000008855166	170357518	/nfs/dbraw/zinc/35/75/18/170357518.db2.gz	ZQQKWPBAZWLBKA-UHFFFAOYSA-N	1	0	273.365	2.111	3	0		CEAFRO
CCC[NH+](CCC)[C@H]1Cc2cccc3c2n(c(=O)n3C)C1	ZINC000013452199	170551120	/nfs/dbraw/zinc/55/11/20/170551120.db2.gz	VKYJURCBISNWGU-AWEZNQCLSA-N	1	0	287.407	2.387	1	0		CEAFRO
CCCCOc1cccc(C[C@H]2CNC(=[NH2+])N=C2N)c1	ZINC000013757752	170589386	/nfs/dbraw/zinc/58/93/86/170589386.db2.gz	HLGWCVIFHQFDSK-LBPRGKRZSA-N	1	0	274.368	2.129	1	0		CEAFRO
COC(=O)[C@H](c1ccc(OC)cc1)[C@H]1CCCC[NH2+]1	ZINC000013778324	170593305	/nfs/dbraw/zinc/59/33/05/170593305.db2.gz	FCAMCDYOMMHOJE-ZIAGYGMSSA-N	1	0	263.337	2.094	1	0		CEAFRO
COC(=O)[C@@H]1[C@@H]2CC[C@H](C[C@@H]1c1ccc(C)cc1)[NH2+]2	ZINC000036270836	172565041	/nfs/dbraw/zinc/56/50/41/172565041.db2.gz	YUMUSCBAOZYAIX-KBXIAJHMSA-N	1	0	259.349	2.392	1	0		CEAFRO
O=C1NCCC[C@]1(c1ccccc1)[NH+]1CCCCC1	ZINC000071315978	176122004	/nfs/dbraw/zinc/12/20/04/176122004.db2.gz	YCKNLLPKOYSTDK-MRXNPFEDSA-N	1	0	258.365	2.278	1	0		CEAFRO
NC(=[NH2+])N1N=C(c2ccccc2)C[C@@H]1c1ccncc1	ZINC000072175536	176334125	/nfs/dbraw/zinc/33/41/25/176334125.db2.gz	UMWXHHKHCCQXSZ-CQSZACIVSA-N	1	0	265.320	2.126	1	0		CEAFRO
CCCC[C@@H]1NC(=[NH2+])NC(=N)N1c1ccc(Cl)cc1	ZINC000013809210	534953828	/nfs/dbraw/zinc/95/38/28/534953828.db2.gz	VWHBREVXFNULBX-LLVKDONJSA-N	1	0	279.775	2.306	1	0		CEAFRO
Nc1ccc(Cc2ccccc2)cc1CN1CC[NH2+]CC1	ZINC000086860340	179360694	/nfs/dbraw/zinc/36/06/94/179360694.db2.gz	SNXGDXWNFPWCGY-UHFFFAOYSA-N	1	0	281.403	2.265	2	0		CEAFRO
O=C(C[NH2+]C[C@@H]1CCCO1)Nc1ccccc1-n1cccc1	ZINC000004926773	170041861	/nfs/dbraw/zinc/04/18/61/170041861.db2.gz	HOFDDOTWFNDAOG-AWEZNQCLSA-N	1	0	299.374	2.184	3	0		CEAFRO
CCCS(=O)(=O)n1cc(CC[NH+](C)C)c2ccccc21	ZINC000028883903	171579864	/nfs/dbraw/zinc/57/98/64/171579864.db2.gz	CGKILAXPMDJZSS-UHFFFAOYSA-N	1	0	294.420	2.333	1	0		CEAFRO
Cc1[nH]nc2c1c(OCC[NH3+])nc1ccc(Cl)cc21	ZINC000028957026	171581279	/nfs/dbraw/zinc/58/12/79/171581279.db2.gz	IFXYIEBIUMTSCX-UHFFFAOYSA-N	1	0	276.727	2.410	1	0		CEAFRO
c1ccc(-c2cccc3c2OC[C@@H](C2=[NH+]CCN2)O3)cc1	ZINC000040431295	174260318	/nfs/dbraw/zinc/26/03/18/174260318.db2.gz	MQSPJCMZCOHHPI-HNNXBMFYSA-N	1	0	280.327	2.495	1	0		CEAFRO
CC(C)[NH2+]C[C@@H](O)COc1ccc(Cl)cc1/C=C/CO	ZINC000040465876	174274863	/nfs/dbraw/zinc/27/48/63/174274863.db2.gz	CNIQQVZICULXPB-RDFMZFSFSA-N	1	0	299.798	2.083	1	0		CEAFRO
Cc1ccccc1OCCCc1c(C)[nH+]c(N)nc1N	ZINC000045334650	175360813	/nfs/dbraw/zinc/36/08/13/175360813.db2.gz	CAHPRNOYKDWVJW-UHFFFAOYSA-N	1	0	272.352	2.269	1	0		CEAFRO
C[NH+](C)[C@H]1CCN(c2ccc(-c3ccccc3)nn2)C1	ZINC000045338051	175360905	/nfs/dbraw/zinc/36/09/05/175360905.db2.gz	HTERZDRXYCFQHS-AWEZNQCLSA-N	1	0	268.364	2.284	1	0		CEAFRO
CO[C@H]1C=C[C@@]23CC[N@H+](Cc4cc5c(cc42)OCO5)[C@H]3C1	ZINC000085924468	560066304	/nfs/dbraw/zinc/06/63/04/560066304.db2.gz	HATSAIPBKRRCME-AFAVFJNCSA-N	1	0	285.343	2.216	1	0	biogenic,in-vitro	CEAFRO
CCCOc1cc(C)c(N(C)C(=O)C[NH3+])c(C)c1	ZINC000082312593	177956443	/nfs/dbraw/zinc/95/64/43/177956443.db2.gz	FWCCKLIBOKNETL-UHFFFAOYSA-N	1	0	250.342	2.014	1	0		CEAFRO
COc1cc(Br)c2c3c1C[C@H]([NH3+])C[C@@H]3CO2	ZINC000013525285	170558148	/nfs/dbraw/zinc/55/81/48/170558148.db2.gz	CLZKGXPLDDUCQZ-RNFRBKRXSA-N	1	0	284.153	2.207	1	0		CEAFRO
C[C@H](C(c1ccccc1)c1ccccc1)[NH+](CCO)CCO	ZINC000026013734	171470743	/nfs/dbraw/zinc/47/07/43/171470743.db2.gz	DZVCYTCABASWEJ-MRXNPFEDSA-N	1	0	299.414	2.494	1	0		CEAFRO
CN1C[C@@H](CC[NH+](C)C)Oc2ccccc2C1=S	ZINC000026287120	171478343	/nfs/dbraw/zinc/47/83/43/171478343.db2.gz	TUTQSIQOKDRNIA-LLVKDONJSA-N	1	0	264.394	2.007	1	0		CEAFRO
c1cnc(NCCC[NH2+]C[C@@H]2CCc3ccccc3O2)nc1	ZINC000026648560	171494647	/nfs/dbraw/zinc/49/46/47/171494647.db2.gz	UBKPEZPIHJFKRG-HNNXBMFYSA-N	1	0	298.390	2.262	1	0		CEAFRO
Cc1nn(C)c2c1C(c1cccc(Cl)c1)[N+](=O)CCN2	ZINC000028101037	171547349	/nfs/dbraw/zinc/54/73/49/171547349.db2.gz	GJPPNJSAGLCCOZ-UHFFFAOYSA-N	1	0	290.754	2.155	1	0		CEAFRO
CC(=O)NCCNc1[nH+]ccc2[nH]c3ccccc3c21	ZINC000040425284	174258828	/nfs/dbraw/zinc/25/88/28/174258828.db2.gz	KCKQNIXWPLAQKH-UHFFFAOYSA-N	1	0	268.320	2.264	1	0		CEAFRO
CC(C)n1cnc2c1ncnc2N[C@H]1CCCC[C@@H]1[NH3+]	ZINC000072108231	176317104	/nfs/dbraw/zinc/31/71/04/176317104.db2.gz	SWLBUASPUHFXAX-QWRGUYRKSA-N	1	0	274.372	2.089	1	0		CEAFRO
C[C@@H]1C[N@H+](C)[C@@H]2Cc3c[nH]c4cccc(c34)[C@H]2[C@@H]1O	ZINC000145855450	571850604	/nfs/dbraw/zinc/85/06/04/571850604.db2.gz	JUXRVSRUBIFVKE-BYRYDROYSA-N	1	0	256.349	2.119	1	0	endogenous,in-man	CEAFRO
Nc1nccc(-n2cc(C3=CCOCC3)c3c[nH+]ccc32)n1	ZINC000095603644	185015526	/nfs/dbraw/zinc/01/55/26/185015526.db2.gz	CSGCDMVLAQPKKB-UHFFFAOYSA-N	1	0	293.330	2.201	1	0		CEAFRO
O=C1CCc2cccc(OC[C@H](O)C[NH+]3CCCCC3)c21	ZINC000096941786	185134012	/nfs/dbraw/zinc/13/40/12/185134012.db2.gz	YMVZHRHXNWZPAA-CQSZACIVSA-N	1	0	289.375	2.041	1	0		CEAFRO
CCN(CC)C(=O)[C@@]1(c2ccccc2)C[C@H]1C[NH2+]C	ZINC000001846945	169759706	/nfs/dbraw/zinc/75/97/06/169759706.db2.gz	OCYYUEJRVUGFGH-GOEBONIOSA-N	1	0	260.381	2.032	1	0		CEAFRO
O=CN1CCCC[C@H]1[C@@H]1CC[C@H]2CCCC[N@@H+]2C1	ZINC000005224366	170077605	/nfs/dbraw/zinc/07/76/05/170077605.db2.gz	LUGPGVVCVOWJLT-KFWWJZLASA-N	1	0	250.386	2.262	1	0		CEAFRO
C[C@@H]1Nc2cc(N)[nH+]c(N)c2N=C1c1ccccc1	ZINC000006494496	170206767	/nfs/dbraw/zinc/20/67/67/170206767.db2.gz	UMTLVJKJSQGHJX-QMMMGPOBSA-N	1	0	253.309	2.181	1	0		CEAFRO
CCC(=O)c1ccc2c(c1)sc(=O)n2CC[NH+](C)C	ZINC000039154257	174164021	/nfs/dbraw/zinc/16/40/21/174164021.db2.gz	JOPYAIURWJLUOY-UHFFFAOYSA-N	1	0	278.377	2.217	1	0		CEAFRO
Cc1ccc(OC[C@@H](O)C[NH2+]C(C)(C)C)c(/C=C/CO)c1	ZINC000040465695	174274489	/nfs/dbraw/zinc/27/44/89/174274489.db2.gz	RYLROWMVCUSYIK-NFAHFFEMSA-N	1	0	293.407	2.128	1	0		CEAFRO
Cc1ccc(C(=O)CC[N@H+](CCO)C(C)(C)C)o1	ZINC000045357627	175362169	/nfs/dbraw/zinc/36/21/69/175362169.db2.gz	LWZBVBBEWLVWMC-UHFFFAOYSA-N	1	0	253.342	2.254	1	0		CEAFRO
C[NH2+][C@H]1Cc2c[nH]c3cccc(c23)[C@@H]1/C=C(\C)CO	ZINC000012153579	560211504	/nfs/dbraw/zinc/21/15/04/560211504.db2.gz	SAHHMCVYMGARBT-SSWZSUJXSA-N	1	0	256.349	2.334	1	0	in-vitro	CEAFRO
CC(C)[NH2+]Cc1ccc2c(c1)[nH]c(=O)c1cccn12	ZINC000043015039	581097539	/nfs/dbraw/zinc/09/75/39/581097539.db2.gz	DQNADOPSFIWVNE-UHFFFAOYSA-N	1	0	255.321	2.279	1	0		CEAFRO
COc1ccccc1C(=O)O[C@@H]1C[C@H]2CCC[C@@H]1[NH2+]2	ZINC000026573591	171492691	/nfs/dbraw/zinc/49/26/91/171492691.db2.gz	JMIQDCYPPMQGKE-SCDSUCTJSA-N	1	0	261.321	2.135	1	0		CEAFRO
Cc1nn(C)c2c1C(c1cccc(F)c1)=[NH+]CCN2	ZINC000028021688	171545459	/nfs/dbraw/zinc/54/54/59/171545459.db2.gz	KREPKDGXLOZLQK-UHFFFAOYSA-N	1	0	258.300	2.131	1	0		CEAFRO
CCN(CC)C(=O)[C@]1(c2ccccc2)[C@@H](C[NH3+])C1(C)C	ZINC000029047082	171584316	/nfs/dbraw/zinc/58/43/16/171584316.db2.gz	NGJYHUYANNRTCI-YOEHRIQHSA-N	1	0	274.408	2.408	1	0		CEAFRO
c1nc2ccccn2c1-c1cccc(N[C@@H]2CC[NH2+]C2)n1	ZINC000029046126	171584323	/nfs/dbraw/zinc/58/43/23/171584323.db2.gz	LSPAZTAZPMMNBM-GFCCVEGCSA-N	1	0	279.347	2.170	1	0		CEAFRO
C[NH2+]C[C@]1(O)Cc2ccccc2[C@@H]1Oc1cccc(O)c1C	ZINC000040899923	174429233	/nfs/dbraw/zinc/42/92/33/174429233.db2.gz	RPJFGKOZZHLXFS-ZWKOTPCHSA-N	1	0	299.370	2.327	1	0		CEAFRO
COC(=O)[C@H]1[NH2+]C(C)(C)[C@@H]2Cc3cccc4[nH]cc(c43)[C@@H]21	ZINC000072108784	176317069	/nfs/dbraw/zinc/31/70/69/176317069.db2.gz	XZNAJCKOSVWTHY-UGFHNGPFSA-N	1	0	284.359	2.347	1	0		CEAFRO
CC(C)c1[nH]nc2c1ncnc2N[C@@H]1CCCC[C@@H]1[NH3+]	ZINC000072108875	176317321	/nfs/dbraw/zinc/31/73/21/176317321.db2.gz	BWBUYVQHCZMJLO-VHSXEESVSA-N	1	0	274.372	2.158	1	0		CEAFRO
c1csc(C[N@@H+]2CC[C@H]3[C@@H]2CCN3c2ncccn2)c1	ZINC000096092100	185095053	/nfs/dbraw/zinc/09/50/53/185095053.db2.gz	ZKVLEMFNCKCHIK-KBPBESRZSA-N	1	0	286.404	2.391	1	0		CEAFRO
CC1=C[C@H]2Cc3[nH]c(=O)ccc3[C@@]3(C1)[C@@H]2[C@H](C)C[N@@H+]3C	ZINC000096921444	185130755	/nfs/dbraw/zinc/13/07/55/185130755.db2.gz	SPLMGOUKRILOLN-AWBCAMRRSA-N	1	0	270.376	2.290	1	0		CEAFRO
Cc1nc(COC[C@H]2CCC[C@]23C[NH2+]CCO3)cs1	ZINC000096160002	256813061	/nfs/dbraw/zinc/81/30/61/256813061.db2.gz	NTPRQGJZDGNRAN-OCCSQVGLSA-N	1	0	282.409	2.127	1	0		CEAFRO
COc1ccc(C(=O)O[C@@H]2CC[N@@H+]3CC[C@H](C)[C@H]23)cc1	ZINC000005495998	170104401	/nfs/dbraw/zinc/10/44/01/170104401.db2.gz	PIRUMYPCEYRZQG-NILFDRSVSA-N	1	0	275.348	2.335	1	0		CEAFRO
COc1ccc(O)c(-c2nc3cc(C(N)=[NH2+])ccc3[nH]2)c1	ZINC000008657209	170344312	/nfs/dbraw/zinc/34/43/12/170344312.db2.gz	ZFCKHJJALHETHG-UHFFFAOYSA-N	1	0	282.303	2.228	1	0	in-vivo	CEAFRO
CCC[NH+](CCC)[C@@H]1CCn2c(CO)ccc2C1	ZINC000013642109	170571841	/nfs/dbraw/zinc/57/18/41/170571841.db2.gz	FFZALGRQJRVCKO-CYBMUJFWSA-N	1	0	250.386	2.417	1	0		CEAFRO
CCOC(=O)[C@@]1(c2ccc(F)cc2)C[C@@H]1C[NH+](C)C	ZINC000026961971	171503999	/nfs/dbraw/zinc/50/39/99/171503999.db2.gz	QFVUCTGVTNQNJX-IUODEOHRSA-N	1	0	265.328	2.208	1	0		CEAFRO
C[C@H]([NH2+]C(C)(C)CO)[C@H](O)c1cccc(Cl)c1	ZINC000027656805	171527966	/nfs/dbraw/zinc/52/79/66/171527966.db2.gz	ODIFXHXFQRJRRL-CABZTGNLSA-N	1	0	257.761	2.122	1	0		CEAFRO
CCN(CC)C(=O)[C@]1(c2ccccc2)C[C@]1(C)C[NH3+]	ZINC000029047102	171584131	/nfs/dbraw/zinc/58/41/31/171584131.db2.gz	CQJCAOGPWRQORA-HZPDHXFCSA-N	1	0	260.381	2.162	1	0		CEAFRO
CCCn1c2ccccc2nc1N1CC[NH+](C)CC1	ZINC000038142562	174134546	/nfs/dbraw/zinc/13/45/46/174134546.db2.gz	SSLVFOMMZVZOHG-UHFFFAOYSA-N	1	0	258.369	2.198	1	0		CEAFRO
NC(=[NH2+])c1ccc2oc(-c3cc(C(N)=[NH2+])ccc3[O-])cc2c1	ZINC000040413591	174255226	/nfs/dbraw/zinc/25/52/26/174255226.db2.gz	AXAPJSDSBCEOND-UHFFFAOYSA-N	1	0	294.314	2.374	1	0		CEAFRO
C[C@@H]1[NH2+]C(C)(C)CO[C@@]1(O)c1ccc(Cl)cc1	ZINC000070672980	176000646	/nfs/dbraw/zinc/00/06/46/176000646.db2.gz	MFHSHFDIBPWOJA-TVQRCGJNSA-N	1	0	255.745	2.272	1	0		CEAFRO
Cc1cc(C)nc(N=NC2=CC([NH+]3CCCC3)CCC2)n1	ZINC000095351617	280465460	/nfs/dbraw/zinc/46/54/60/280465460.db2.gz	LVSJFZIPBFHNJG-UHFFFAOYSA-O	1	0	286.403	2.325	3	0		CEAFRO
C[N@@H+]1C[C@H]2C[C@@H]1CN2c1ccc(-c2ccccc2)nn1	ZINC000049116604	524027163	/nfs/dbraw/zinc/02/71/63/524027163.db2.gz	GJYSEBOVCLZXAI-ZIAGYGMSSA-N	1	0	266.348	2.036	1	0		CEAFRO
C=C1[NH2+]C(=C)C(C(=O)OCC)CC1C(=O)OCC	ZINC000101627685	185750334	/nfs/dbraw/zinc/75/03/34/185750334.db2.gz	YFXJUIWJFZNYHD-ZRDIBKRKSA-N	1	0	253.298	2.494	1	0		CEAFRO
O=C(/C=C/c1cccc(Cl)c1)N1C[C@H]2C[NH2+]C[C@H](C2)C1	ZINC000103257393	185821755	/nfs/dbraw/zinc/82/17/55/185821755.db2.gz	AXGPPHSPPGWIMO-TWRSITDPSA-N	1	0	290.794	2.421	1	0		CEAFRO
CC/C=C\C/C=C\[C@H]1CC(=O)NCCC[NH2+]CCCC[NH2+]1	ZINC000005813136	170142484	/nfs/dbraw/zinc/14/24/84/170142484.db2.gz	LUOMCXKCIGOCHI-JHGAFDPBSA-N	1	0	293.455	2.137	1	0		CEAFRO
Oc1cccc(-c2noc([C@@H]3C[NH+]4CCC3CC4)n2)c1	ZINC000013860861	170605238	/nfs/dbraw/zinc/60/52/38/170605238.db2.gz	VBPRZVPNKNRXFP-CYBMUJFWSA-N	1	0	271.320	2.251	1	0		CEAFRO
C[C@@H](CN1CCc2c3ccccc3oc(=O)c2C1)[NH+](C)C	ZINC000027757083	171531664	/nfs/dbraw/zinc/53/16/64/171531664.db2.gz	NMWHCTHSUBOKAC-LBPRGKRZSA-N	1	0	286.375	2.101	1	0		CEAFRO
CC(=O)Nc1ccc(OC[C@@H](O)[C@H](C)[NH2+]C(C)(C)C)cc1	ZINC000028769763	171574294	/nfs/dbraw/zinc/57/42/94/171574294.db2.gz	YXABSTVHPRQVFH-XHDPSFHLSA-N	1	0	294.395	2.161	1	0		CEAFRO
C[N@@H+]1CCC=C([C@H]2SCC(=O)N2Cc2ccccc2)C1	ZINC000045301074	175354984	/nfs/dbraw/zinc/35/49/84/175354984.db2.gz	GDUOJLYDLHEXOD-MRXNPFEDSA-N	1	0	288.416	2.350	1	0		CEAFRO
C[NH+](C)CCNc1ccc2ncc(-c3ccsc3)n2n1	ZINC000045335082	175360766	/nfs/dbraw/zinc/36/07/66/175360766.db2.gz	ZJGPNMODLAEECK-UHFFFAOYSA-N	1	0	287.392	2.431	1	0		CEAFRO
C[C@@H]1CCC[N@@H+]1CCc1ccc(-c2ccc(=O)n(C)n2)cc1	ZINC000072316411	176368695	/nfs/dbraw/zinc/36/86/95/176368695.db2.gz	OLADFXRHWWGOMN-CQSZACIVSA-N	1	0	297.402	2.474	1	0		CEAFRO
O=C1[C@H]2C[N@H+](CC3CC3)C[C@@H]2CN1c1ccsc1	ZINC000299842344	333187690	/nfs/dbraw/zinc/18/76/90/333187690.db2.gz	MMKJKQIPWGEDDE-YPMHNXCESA-N	1	0	262.378	2.053	1	0		CEAFRO
CO[C@@H]1C=CC2=CC[N@@H+]3CCc4cc5c(cc4[C@@]23C1)OCO5	ZINC000085730714	571788006	/nfs/dbraw/zinc/78/80/06/571788006.db2.gz	TVOFUERNMZTYRM-RDTXWAMCSA-N	1	0	297.354	2.384	1	0	endogenous,in-man	CEAFRO
COc1cc2ccc(=O)oc2cc1OCC[NH+]1CCCC1	ZINC000095591589	185013684	/nfs/dbraw/zinc/01/36/84/185013684.db2.gz	SPFQDKKXCDLCFP-UHFFFAOYSA-N	1	0	289.331	2.276	1	0		CEAFRO
NC(=[NH2+])NCc1nc(-c2c[nH]c3ccccc32)cs1	ZINC000000011160	169506210	/nfs/dbraw/zinc/50/62/10/169506210.db2.gz	ATBPRFXCCZLQCU-UHFFFAOYSA-N	1	0	271.349	2.274	1	0		CEAFRO
[NH3+][C@@H]1CCCN(c2cccc(-c3cnc4ccccn43)n2)C1	ZINC000029045853	134754143	/nfs/dbraw/zinc/75/41/43/134754143.db2.gz	HPHFLWOBCIXIGR-CYBMUJFWSA-N	1	0	293.374	2.324	1	0		CEAFRO
NC(=O)CSC[C@@H]1C[NH2+]CC[C@@H]1c1ccc(Cl)cc1	ZINC000028463031	171559330	/nfs/dbraw/zinc/55/93/30/171559330.db2.gz	ZAVZXAPSKRLFJQ-WCQYABFASA-N	1	0	298.839	2.252	1	0		CEAFRO
Cc1cccc(C)c1-c1cnnc(CC[NH+](C)C)n1	ZINC000045366266	175362513	/nfs/dbraw/zinc/36/25/13/175362513.db2.gz	ASRQKQRIVCTYNQ-UHFFFAOYSA-N	1	0	256.353	2.260	1	0		CEAFRO
Clc1ccc(Cc2ncc3c(n2)CC[NH2+]CC3)cc1	ZINC000071331664	176125077	/nfs/dbraw/zinc/12/50/77/176125077.db2.gz	VPLOPEPZQDRJCE-UHFFFAOYSA-N	1	0	273.767	2.409	1	0		CEAFRO
Cn1ncc2c1CCOC21CC[NH+](Cc2ccccc2)CC1	ZINC000072114477	176318227	/nfs/dbraw/zinc/31/82/27/176318227.db2.gz	RIJKMUIRCGMPIS-UHFFFAOYSA-N	1	0	297.402	2.484	1	0		CEAFRO
CC(C)c1n[nH]cc1-c1ccnc(NC2CC[NH2+]CC2)n1	ZINC000064539047	519857820	/nfs/dbraw/zinc/85/78/20/519857820.db2.gz	JKOBDZOYRWHJIV-UHFFFAOYSA-N	1	0	286.383	2.154	1	0		CEAFRO
Cc1ccc(OC[C@H](O)C[NH2+]C(C)C)c2c1CCC2	ZINC000028765392	581091595	/nfs/dbraw/zinc/09/15/95/581091595.db2.gz	JLECPPBHIADANW-CYBMUJFWSA-N	1	0	263.381	2.221	1	0		CEAFRO
c1c(COc2ccccc2)onc1OC[C@@H]1CCC[NH2+]1	ZINC000095559873	185009383	/nfs/dbraw/zinc/00/93/83/185009383.db2.gz	JUWUZLUBIRHYMM-LBPRGKRZSA-N	1	0	274.320	2.384	1	0		CEAFRO
C[NH2+]C1CN(c2nc(N)nc3cc(C4CCCC4)ccc32)C1	ZINC000096906167	185128049	/nfs/dbraw/zinc/12/80/49/185128049.db2.gz	MJRWQKDJTQKTMJ-UHFFFAOYSA-N	1	0	297.406	2.278	1	0		CEAFRO
CC[NH2+]C[C@@H]1[C@H]2[C@H]3C=C[C@@H]1[C@H]([C@H](C)c1ccc(C=O)cc1)N32	ZINC000085547896	290840789	/nfs/dbraw/zinc/84/07/89/290840789.db2.gz	MAWRNOVAKMSKSA-RNZSJQFESA-N	1	0	296.414	2.449	1	0	biogenic,in-vitro	CEAFRO
CN(C)c1cc(-c2ccccc2C[NH+](C)C)ncn1	ZINC000004268439	169951116	/nfs/dbraw/zinc/95/11/16/169951116.db2.gz	BAAOAYSLEQEIFX-UHFFFAOYSA-N	1	0	256.353	2.271	1	0		CEAFRO
Cc1cnsc1-c1ccccc1OCC1=[NH+]CCN1	ZINC000013437866	170550068	/nfs/dbraw/zinc/55/00/68/170550068.db2.gz	NBTBSFIAXGORAY-UHFFFAOYSA-N	1	0	273.361	2.499	1	0		CEAFRO
CC(C)c1[nH]nc2c1ncnc2N[C@@H]1CCCC[C@H]1[NH3+]	ZINC000072108877	176317073	/nfs/dbraw/zinc/31/70/73/176317073.db2.gz	BWBUYVQHCZMJLO-NXEZZACHSA-N	1	0	274.372	2.158	1	0		CEAFRO
[NH3+]CCCNc1nc(-c2ccncc2)cc2cnccc21	ZINC000095561154	185009783	/nfs/dbraw/zinc/00/97/83/185009783.db2.gz	QYTBMLLWBZLPMF-UHFFFAOYSA-N	1	0	279.347	2.453	1	0		CEAFRO
c1ccc(CN2C[C@H](C3=[NH+]CCN3)Oc3ccccc32)cc1	ZINC000013518826	134687318	/nfs/dbraw/zinc/68/73/18/134687318.db2.gz	ZUSUAMQUCDPBNO-QGZVFWFLSA-N	1	0	293.370	2.456	1	0		CEAFRO
COc1cc(-c2nn(C(C)C)c3ncnc(N)c23)ccc1N	ZINC000008581988	170341814	/nfs/dbraw/zinc/34/18/14/170341814.db2.gz	JDOVRLNHIYWZKZ-UHFFFAOYSA-N	1	0	298.350	2.247	1	0		CEAFRO
OCC[C@@H]1CN(C2CCSCC2)CC[N@@H+]1C1CCCC1	ZINC000020905468	171278861	/nfs/dbraw/zinc/27/88/61/171278861.db2.gz	IZQOHXHIIDOEJF-MRXNPFEDSA-N	1	0	298.496	2.193	3	0		CEAFRO
CCN(CC)C(=O)[C@@]1(c2ccccc2)C[C@@H]1C[NH+](C)C	ZINC000029127898	171587292	/nfs/dbraw/zinc/58/72/92/171587292.db2.gz	NMRSWXVEITZBIQ-NVXWUHKLSA-N	1	0	274.408	2.374	1	0	in-vivo	CEAFRO
CCCc1cc(Cl)c2c(c1)[C@H]1C[NH2+]C[C@@H]1NC2=O	ZINC000038219644	174137514	/nfs/dbraw/zinc/13/75/14/174137514.db2.gz	QTWUTKDZRHYLST-PWSUYJOCSA-N	1	0	264.756	2.091	1	0		CEAFRO
COC(=O)[C@H](C)Oc1cccc2sc(C(N)=[NH2+])cc21	ZINC000045337084	175360966	/nfs/dbraw/zinc/36/09/66/175360966.db2.gz	XQRCKSBCQMSIKE-ZETCQYMHSA-N	1	0	278.333	2.126	1	0		CEAFRO
O=C1NCCC[C@@]1(c1ccccc1)[NH+]1CCCCC1	ZINC000071315979	176122122	/nfs/dbraw/zinc/12/21/22/176122122.db2.gz	YCKNLLPKOYSTDK-INIZCTEOSA-N	1	0	258.365	2.278	1	0		CEAFRO
c1cc2c(cc1-c1cnc3c(c1)CCN3)CC[NH2+]C2	ZINC000071333735	176126484	/nfs/dbraw/zinc/12/64/84/176126484.db2.gz	RZYZZQBKJJEYGC-UHFFFAOYSA-N	1	0	251.333	2.362	1	0		CEAFRO
CC(C)n1cnc2c1ncnc2N[C@@H]1CCCC[C@@H]1[NH3+]	ZINC000072108230	176316814	/nfs/dbraw/zinc/31/68/14/176316814.db2.gz	SWLBUASPUHFXAX-WDEREUQCSA-N	1	0	274.372	2.089	1	0		CEAFRO
Cc1ccc(C2=CN(O)[C@@H]3CCCC[C@H]3[N+]2=O)cc1	ZINC000013468898	280802008	/nfs/dbraw/zinc/80/20/08/280802008.db2.gz	PQVNHRORXCBZCV-ZIAGYGMSSA-N	1	0	258.321	2.200	1	0		CEAFRO
CCCCCc1ccc(CCC([NH3+])(CO)CO)c(F)c1	ZINC000049088542	520323737	/nfs/dbraw/zinc/32/37/37/520323737.db2.gz	WPYHCYKUOXTFQI-UHFFFAOYSA-N	1	0	283.387	2.173	1	0		CEAFRO
C[NH+](C)CCCOc1ccc(-c2cccc3nncn32)cn1	ZINC000061926737	524058211	/nfs/dbraw/zinc/05/82/11/524058211.db2.gz	YLBQOTVQXHOOQA-UHFFFAOYSA-N	1	0	297.362	2.122	3	0		CEAFRO
Cc1ccc(OC[C@@H](O)C[NH2+]C(C)C)c2c1CCC2	ZINC000028765394	581091686	/nfs/dbraw/zinc/09/16/86/581091686.db2.gz	JLECPPBHIADANW-ZDUSSCGKSA-N	1	0	263.381	2.221	1	0		CEAFRO
[NH3+]CCOc1nc(-c2ccncc2)cc2cnccc21	ZINC000095560873	185009344	/nfs/dbraw/zinc/00/93/44/185009344.db2.gz	DAGKXAWMGQZKFD-UHFFFAOYSA-N	1	0	266.304	2.029	1	0		CEAFRO
CC[NH+](CC)CCCC(=O)Nc1nc(C)c(OC)c(C)n1	ZINC000095572878	185010750	/nfs/dbraw/zinc/01/07/50/185010750.db2.gz	ZANIMROBSBWYAK-UHFFFAOYSA-N	1	0	294.399	2.163	1	0		CEAFRO
C[C@@H](O)C[NH+](CC1=CC[C@H]2C[C@@H]1C2(C)C)C[C@@H](C)O	ZINC000000219564	169579206	/nfs/dbraw/zinc/57/92/06/169579206.db2.gz	HBDPVKUAUOZBLQ-UXOAXIEHSA-N	1	0	267.413	2.042	1	0		CEAFRO
Cc1cc2nc3c(N)nn(CCC[NH+](C)C)c3nc2cc1C	ZINC000001861230	169760941	/nfs/dbraw/zinc/76/09/41/169760941.db2.gz	VBLQZMJDNYEZPR-UHFFFAOYSA-N	1	0	298.394	2.130	1	0		CEAFRO
COc1ccc(C(=O)[C@H]2C[NH+]=C3C=CC=CN3C2)cc1OC	ZINC000043120582	174975864	/nfs/dbraw/zinc/97/58/64/174975864.db2.gz	DIYUZAYWAKMYKO-ZDUSSCGKSA-N	1	0	298.342	2.300	1	0		CEAFRO
C[N@@H+]1CCC=C([C@@H]2SCC(=O)N2c2ccccc2)C1	ZINC000045286477	175353351	/nfs/dbraw/zinc/35/33/51/175353351.db2.gz	BSRXRTYLTBWZAC-HNNXBMFYSA-N	1	0	274.389	2.354	1	0		CEAFRO
C[N@@H+]1CCC=C([C@@H]2SCC(=O)N2Cc2ccccc2)C1	ZINC000045301076	175355143	/nfs/dbraw/zinc/35/51/43/175355143.db2.gz	GDUOJLYDLHEXOD-INIZCTEOSA-N	1	0	288.416	2.350	1	0		CEAFRO
C[NH+](C)[C@@H]1CCN(c2ccc(-c3ccccc3)nn2)C1	ZINC000045338049	175360607	/nfs/dbraw/zinc/36/06/07/175360607.db2.gz	HTERZDRXYCFQHS-CQSZACIVSA-N	1	0	268.364	2.284	1	0		CEAFRO
CN1CC[C@@](c2ccccc2)([NH+]2CCCCC2)C1=O	ZINC000071318895	176122584	/nfs/dbraw/zinc/12/25/84/176122584.db2.gz	LBPAWUSEFJACHD-INIZCTEOSA-N	1	0	258.365	2.230	1	0		CEAFRO
c1csc(C[N@@H+]2CC[C@H]3[C@H]2CCN3c2ncccn2)c1	ZINC000107819379	186192941	/nfs/dbraw/zinc/19/29/41/186192941.db2.gz	ZKVLEMFNCKCHIK-KGLIPLIRSA-N	1	0	286.404	2.391	1	0		CEAFRO
Nc1nc(N)c2c([nH+]1)CC[C@@H](Cc1cccs1)C2	ZINC000005974243	170164941	/nfs/dbraw/zinc/16/49/41/170164941.db2.gz	KFAABLSTVOTSAU-QMMMGPOBSA-N	1	0	260.366	2.050	1	0		CEAFRO
CNC(=O)[C@H]1C[N@H+](C)CC[C@@H]1c1ccc(Cl)cc1	ZINC000013862754	170605720	/nfs/dbraw/zinc/60/57/20/170605720.db2.gz	ABJWYMYTLWBPQC-OLZOCXBDSA-N	1	0	266.772	2.121	1	0		CEAFRO
CC/C(=C/c1ccccc1OC[C@H](O)C[NH2+]C(C)C)CO	ZINC000040466421	174274857	/nfs/dbraw/zinc/27/48/57/174274857.db2.gz	NSELJLYSHRXTMA-IHWMJMDHSA-N	1	0	293.407	2.210	1	0		CEAFRO
COc1ccc2c(c1)[C@@](C)(CCC[NH+](C)C)C(=O)N2C	ZINC000045202669	175327247	/nfs/dbraw/zinc/32/72/47/175327247.db2.gz	OZGRNKLIRVSEIF-MRXNPFEDSA-N	1	0	276.380	2.271	1	0		CEAFRO
Cc1csc2cc(C(=O)NCCC[NH+](C)C)cnc12	ZINC000072322986	176369317	/nfs/dbraw/zinc/36/93/17/176369317.db2.gz	WGOQBTDWUBJIBS-UHFFFAOYSA-N	1	0	277.393	2.286	2	0		CEAFRO
c1ccc(-c2ccc(N3C[C@@H]4C[NH2+]C[C@H]4C3)cn2)cc1	ZINC000095576550	185011278	/nfs/dbraw/zinc/01/12/78/185011278.db2.gz	OREHKCAJBKZGSF-GJZGRUSLSA-N	1	0	265.360	2.404	1	0		CEAFRO
C[N@@H+]1CCC[C@@H]1C(=O)NC1C2CC3CC(C2)CC1C3	ZINC000049112478	362340417	/nfs/dbraw/zinc/34/04/17/362340417.db2.gz	BSDCVOMOZRWDIN-DUTNFGBUSA-N	1	0	262.397	2.022	1	0		CEAFRO
c1c(-c2ccc(C3=[NH+]CCN3)cc2)nc2ccccn12	ZINC000006494063	170206730	/nfs/dbraw/zinc/20/67/30/170206730.db2.gz	PMXYWXSYSNAGQO-UHFFFAOYSA-N	1	0	262.316	2.351	1	0		CEAFRO
CCN1C[C@@H](CC[NH+](C)C)N(C)c2ccccc2C1=S	ZINC000026287717	171478784	/nfs/dbraw/zinc/47/87/84/171478784.db2.gz	DXSXZHKDYBZNDX-CYBMUJFWSA-N	1	0	291.464	2.454	1	0		CEAFRO
C[NH+]1CCN(COc2ccc3ccccc3c2)CC1	ZINC000026668428	171495430	/nfs/dbraw/zinc/49/54/30/171495430.db2.gz	FBRXSFCLUJJCJU-UHFFFAOYSA-N	1	0	256.349	2.424	1	0		CEAFRO
CC/C(=C\c1ccccc1OC[C@H](O)C[NH2+]C(C)C)CO	ZINC000040466419	174274704	/nfs/dbraw/zinc/27/47/04/174274704.db2.gz	NSELJLYSHRXTMA-SCZPIIQISA-N	1	0	293.407	2.210	1	0		CEAFRO
C(=C/c1cncc(OC[C@H]2CC[NH2+]2)c1)\c1ccncc1	ZINC000045300924	175354902	/nfs/dbraw/zinc/35/49/02/175354902.db2.gz	ZZFNJIRAGPTYIN-BGTMTDRBSA-N	1	0	267.332	2.388	1	0		CEAFRO
NC1=[NH+]CC[C@H](c2c[nH]c3cc(Br)ccc32)N1	ZINC000045300189	175355116	/nfs/dbraw/zinc/35/51/16/175355116.db2.gz	XUHUKWLCFVXPBL-SNVBAGLBSA-N	1	0	293.168	2.280	1	0		CEAFRO
C[NH2+]CC(=O)Nc1ccc(Cl)cc1C(=O)c1ccc[nH]1	ZINC000072138266	176322628	/nfs/dbraw/zinc/32/26/28/176322628.db2.gz	TXLSLLWVOIBVGD-UHFFFAOYSA-N	1	0	291.738	2.057	1	0		CEAFRO
COC[C@H](C)[NH2+]Cc1coc(-c2ccc(OC)cc2)n1	ZINC000072185606	176335758	/nfs/dbraw/zinc/33/57/58/176335758.db2.gz	FLBYTWHKDSKMQM-NSHDSACASA-N	1	0	276.336	2.475	1	0		CEAFRO
OC1([C@H](CN2CC[NH2+]CC2)c2cccs2)CCCCC1	ZINC000049113265	527511904	/nfs/dbraw/zinc/51/19/04/527511904.db2.gz	IWXNUOQJTVYMHH-CQSZACIVSA-N	1	0	294.464	2.432	1	0		CEAFRO
NC(=O)c1cccc2[nH]c(C3C[NH+](C4CCCC4)C3)nc21	ZINC000040829607	581100487	/nfs/dbraw/zinc/10/04/87/581100487.db2.gz	PTDSTHHQYSGBJK-UHFFFAOYSA-N	1	0	284.363	2.004	1	0		CEAFRO
COc1cc2ccc(=O)oc2cc1OCC[NH2+]C(C)C	ZINC000095587831	185012444	/nfs/dbraw/zinc/01/24/44/185012444.db2.gz	HKBORSVIFNGRFY-UHFFFAOYSA-N	1	0	277.320	2.178	1	0		CEAFRO
Cc1cccc2c1nc(-c1ccc(C[NH3+])cc1)[nH]c2=O	ZINC000103233842	185818409	/nfs/dbraw/zinc/81/84/09/185818409.db2.gz	NXRCVVIFMJBFPF-UHFFFAOYSA-N	1	0	265.316	2.357	1	0		CEAFRO
NC1=[NH+]CC[C@@H](c2c[nH]c3ccc(Br)cc32)N1	ZINC000045256608	175336952	/nfs/dbraw/zinc/33/69/52/175336952.db2.gz	VVONRGQMZKFFRP-NSHDSACASA-N	1	0	293.168	2.280	1	0		CEAFRO
CN1OC[C@@H]2C[NH2+][C@H](c3ccccc3Br)C[C@@H]21	ZINC000061943027	524030815	/nfs/dbraw/zinc/03/08/15/524030815.db2.gz	CESKGZPTTIYFTC-XDTLVQLUSA-N	1	0	297.196	2.345	3	0		CEAFRO
CCC(=O)c1c(O)cccc1OCC[NH+]1CCCC1	ZINC000095560893	185009637	/nfs/dbraw/zinc/00/96/37/185009637.db2.gz	BVMVHFGLBNWHCN-UHFFFAOYSA-N	1	0	263.337	2.460	1	0		CEAFRO
S=C(C[NH2+]Cc1ccc2c(c1)OCO2)N1CCCCC1	ZINC000013611641	170569518	/nfs/dbraw/zinc/56/95/18/170569518.db2.gz	KWEYTVIWCZQYKF-UHFFFAOYSA-N	1	0	292.404	2.318	1	0		CEAFRO
C[C@H]1CC[C@H](C)N1C(=O)[C@@]1(c2ccccc2)C[C@@H]1C[NH3+]	ZINC000026964190	171504312	/nfs/dbraw/zinc/50/43/12/171504312.db2.gz	CIUDGXXHIKDWQV-YOKBYHGQSA-N	1	0	272.392	2.302	1	0		CEAFRO
COC(=O)[C@H](C[NH3+])c1c[nH]c2cccc(Cl)c21	ZINC000027855635	171534028	/nfs/dbraw/zinc/53/40/28/171534028.db2.gz	PTWHFDQVNOCJDD-SSDOTTSWSA-N	1	0	252.701	2.037	1	0		CEAFRO
C[NH2+]C[C@]1(O)Cc2ccccc2[C@@H]1Oc1ccccc1OC	ZINC000040380784	174250606	/nfs/dbraw/zinc/25/06/06/174250606.db2.gz	QKJSLGBMXQASRH-ZWKOTPCHSA-N	1	0	299.370	2.322	1	0		CEAFRO
O=C1c2cc3c(cc2[N+](=O)C1c1ccccc1)OCO3	ZINC000045257701	175336750	/nfs/dbraw/zinc/33/67/50/175336750.db2.gz	YXKZMCNSRULCJN-UHFFFAOYSA-N	1	0	267.240	2.243	1	0		CEAFRO
CCc1cnc2nc(N3CC[NH+]4CCC3CC4)oc2c1	ZINC000045365545	175362492	/nfs/dbraw/zinc/36/24/92/175362492.db2.gz	PSCRTYZAAGWMLR-UHFFFAOYSA-N	1	0	272.352	2.070	1	0		CEAFRO
CC(C)n1cnc2c1ncnc2N[C@H]1CCCC[C@H]1[NH3+]	ZINC000072108233	176317129	/nfs/dbraw/zinc/31/71/29/176317129.db2.gz	SWLBUASPUHFXAX-MNOVXSKESA-N	1	0	274.372	2.089	1	0		CEAFRO
C[N@H+](Cc1cccs1)[C@@H]1CCC[C@H]2CN(C(N)=O)C[C@H]21	ZINC000299842587	333187693	/nfs/dbraw/zinc/18/76/93/333187693.db2.gz	UERJJLIMCJTDDG-IACUBPJLSA-N	1	0	293.436	2.359	1	0		CEAFRO
C[NH2+]CC[C@@H](c1ccc2cc(F)ccc2c1)n1ncnn1	ZINC000058591074	522016326	/nfs/dbraw/zinc/01/63/26/522016326.db2.gz	NSQVIEVBUSYQLK-HNNXBMFYSA-N	1	0	285.326	2.164	1	0		CEAFRO
COc1ccc(CN(c2ccccn2)[C@@H](C)[NH3+])cc1	ZINC000205414298	395472980	/nfs/dbraw/zinc/47/29/80/395472980.db2.gz	QNYPBZYGWFUJRK-LBPRGKRZSA-N	1	0	257.337	2.402	2	0		CEAFRO
O=C(c1ccccc1)N1C[C@H]2C[C@@H](C1)C[N@@H+](CC1CC1)C2	ZINC000019865829	170899767	/nfs/dbraw/zinc/89/97/67/170899767.db2.gz	PYABOKZLLAAEOX-IYBDPMFKSA-N	1	0	284.403	2.491	1	0		CEAFRO
CN1C[C@H](CC[NH+](C)C)Oc2nc3ccccc3cc2C1=O	ZINC000026290392	171479380	/nfs/dbraw/zinc/47/93/80/171479380.db2.gz	NHSIJNFKRXLXHL-ZDUSSCGKSA-N	1	0	299.374	2.020	1	0		CEAFRO
c1ccc(-c2cncc(N3C[C@H]4C[NH2+]C[C@H]4C3)c2)cc1	ZINC000040430040	174259282	/nfs/dbraw/zinc/25/92/82/174259282.db2.gz	QREWVZHLWCAGOU-IYBDPMFKSA-N	1	0	265.360	2.404	1	0		CEAFRO
c1cn2c(n1)c1c(nc2Cc2ccccc2)CC[NH2+]CC1	ZINC000045259907	175337336	/nfs/dbraw/zinc/33/73/36/175337336.db2.gz	KMADAAWEOMWIDE-UHFFFAOYSA-N	1	0	278.359	2.008	1	0		CEAFRO
C[N@@H+]1CCC=C([C@@H]2SCC(=O)N2c2cccc(O)c2)C1	ZINC000045289898	175353970	/nfs/dbraw/zinc/35/39/70/175353970.db2.gz	BZKBULDEHOKLFO-HNNXBMFYSA-N	1	0	290.388	2.060	1	0		CEAFRO
C[N@@H+]1CCC=C([C@H]2SCC(=O)N2c2cccc(O)c2)C1	ZINC000045289895	175354080	/nfs/dbraw/zinc/35/40/80/175354080.db2.gz	BZKBULDEHOKLFO-OAHLLOKOSA-N	1	0	290.388	2.060	1	0		CEAFRO
CC(C)c1[nH]nc2c1ncnc2N[C@H]1CCCC[C@@H]1[NH3+]	ZINC000072108876	176316794	/nfs/dbraw/zinc/31/67/94/176316794.db2.gz	BWBUYVQHCZMJLO-UWVGGRQHSA-N	1	0	274.372	2.158	1	0		CEAFRO
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	ZINC000085493088	560075012	/nfs/dbraw/zinc/07/50/12/560075012.db2.gz	RYAHJFGVOCZDEI-WQLUIHPRSA-N	1	0	263.381	2.160	1	0	biogenic,in-vitro	CEAFRO
CC(C)(C)[NH2+]C[C@@H](O)c1ccc(O)c(C(C)(C)O)c1	ZINC000169346275	188660564	/nfs/dbraw/zinc/66/05/64/188660564.db2.gz	QTPFOSNRVACNIT-CYBMUJFWSA-N	1	0	267.369	2.041	1	0		CEAFRO
Nc1nc(N)c2c([nH+]1)CC[C@H](Cc1cccs1)C2	ZINC000005974244	170164880	/nfs/dbraw/zinc/16/48/80/170164880.db2.gz	KFAABLSTVOTSAU-MRVPVSSYSA-N	1	0	260.366	2.050	1	0		CEAFRO
[NH3+]C[C@@H]1C[C@@]1(C(=O)N1C=CCCC1)c1ccsc1	ZINC000029042658	171584028	/nfs/dbraw/zinc/58/40/28/171584028.db2.gz	KLAPRIKTPASOCO-GXTWGEPZSA-N	1	0	262.378	2.101	1	0		CEAFRO
Nc1nc(N)c2c([nH+]1)CCc1cc(Br)ccc1-2	ZINC000045201681	175327282	/nfs/dbraw/zinc/32/72/82/175327282.db2.gz	WAIHJRHXIDWTNK-UHFFFAOYSA-N	1	0	291.152	2.169	1	0		CEAFRO
CCOC(=O)c1cc(C2=CCC[C@@H]3CC[C@H]2[NH2+]3)on1	ZINC000072179453	176334464	/nfs/dbraw/zinc/33/44/64/176334464.db2.gz	VGOGILKUALKOOP-MWLCHTKSSA-N	1	0	262.309	2.149	1	0		CEAFRO
COc1ccccc1C[N@H+]1CC[C@@]2(C[C@@H](OC)CO2)C1	ZINC000299842236	333187741	/nfs/dbraw/zinc/18/77/41/333187741.db2.gz	DQMDGMOIYJJWNS-GDBMZVCRSA-N	1	0	277.364	2.075	1	0		CEAFRO
C(O[C@H]1CC[C@H]2[C@@H]1OCC[N@@H+]2CC1CCOCC1)C1CC1	ZINC000299842486	333187956	/nfs/dbraw/zinc/18/79/56/333187956.db2.gz	HANHVUDOZONGRF-ULQDDVLXSA-N	1	0	295.423	2.071	1	0		CEAFRO
O=c1[nH]nc(NCC[NH+]2CCCCC2)cc1-c1ccccc1	ZINC000095604953	185015087	/nfs/dbraw/zinc/01/50/87/185015087.db2.gz	ZOXMRNGTWNLXOH-UHFFFAOYSA-N	1	0	298.390	2.335	1	0		CEAFRO
Cc1cc2c(c(=O)o1)C=C1CC[C@H]([C@H](C)C[NH3+])C[C@@H]1O2	ZINC000084617578	178904810	/nfs/dbraw/zinc/90/48/10/178904810.db2.gz	NEUZQTKGOHALOL-PUYPPJJSSA-N	1	0	275.348	2.488	1	0		CEAFRO
O=S(=O)(c1c[nH]c2ccc(Cl)cc21)C1CC[NH2+]CC1	ZINC000027886598	171536936	/nfs/dbraw/zinc/53/69/36/171536936.db2.gz	KIAGZZHHUYZXMC-UHFFFAOYSA-N	1	0	298.795	2.347	1	0		CEAFRO
c1nc2ccccn2c1-c1cccc(N[C@H]2CC[NH2+]C2)n1	ZINC000029046128	171584170	/nfs/dbraw/zinc/58/41/70/171584170.db2.gz	LSPAZTAZPMMNBM-LBPRGKRZSA-N	1	0	279.347	2.170	1	0		CEAFRO
C[C@@H](OCC1CC1)c1ccc2c(n1)N1[C@H](C2)C[NH2+]C[C@H]1C	ZINC000038458390	174141842	/nfs/dbraw/zinc/14/18/42/174141842.db2.gz	HBPFKRQLQBROKQ-LALPHHSUSA-N	1	0	287.407	2.292	1	0		CEAFRO
COc1ccc(C(=O)[C@@H]2C[NH+]=C3C=CC=CN3C2)cc1	ZINC000043020167	174944824	/nfs/dbraw/zinc/94/48/24/174944824.db2.gz	RALBRSKRWZPGIX-CYBMUJFWSA-N	1	0	268.316	2.292	1	0		CEAFRO
CCOC(=O)COc1cccc2sc(C(N)=[NH2+])cc21	ZINC000045369109	175363635	/nfs/dbraw/zinc/36/36/35/175363635.db2.gz	SWZWOPSAPAUDNP-UHFFFAOYSA-N	1	0	278.333	2.127	1	0		CEAFRO
c1ccc(CCCc2ncc3c(n2)CC[NH2+]C3)cc1	ZINC000071410470	176156912	/nfs/dbraw/zinc/15/69/12/176156912.db2.gz	MLHSEOZSKRLTAV-UHFFFAOYSA-N	1	0	253.349	2.298	1	0		CEAFRO
c1cncc(N2CC[C@@H]3C[N@@H+](CC4CC4)C[C@H]3C2)c1	ZINC000299843752	333187684	/nfs/dbraw/zinc/18/76/84/333187684.db2.gz	XNJLQENLVMHYPQ-CABCVRRESA-N	1	0	257.381	2.250	1	0		CEAFRO
CC1=C[C@@H]2[C@@H]3Cc4ccc(=O)[nH]c4[C@@]2(C1)[N@H+](C)CCC3	ZINC000085530430	560073424	/nfs/dbraw/zinc/07/34/24/560073424.db2.gz	IQQMMSOXSDUNNH-QEORTHHSSA-N	1	0	270.376	2.434	1	0	biogenic,in-vitro	CEAFRO
CO[C@H]1C=CC2=CC[N@@H+]3CCc4cc5c(cc4[C@@]23C1)OCO5	ZINC000070454459	571780485	/nfs/dbraw/zinc/78/04/85/571780485.db2.gz	TVOFUERNMZTYRM-KBXCAEBGSA-N	1	0	297.354	2.384	1	0	endogenous,in-man	CEAFRO
CN(CC[NH3+])c1nc(-c2ccncc2)cc2cnccc21	ZINC000095563941	185010503	/nfs/dbraw/zinc/01/05/03/185010503.db2.gz	AJFLRCLZEMUXCH-UHFFFAOYSA-N	1	0	279.347	2.087	1	0		CEAFRO
CCC[NH+](CCC)[C@H]1Cc2cccc3c2N(C1)C(=O)CN3	ZINC000013452279	535326754	/nfs/dbraw/zinc/32/67/54/535326754.db2.gz	AGDDFINMHZZBNF-AWEZNQCLSA-N	1	0	287.407	2.492	1	0		CEAFRO
Cc1ccc(C2=CN(O)[C@H]3CCCC[C@H]3[N+]2=O)cc1	ZINC000101180817	292090433	/nfs/dbraw/zinc/09/04/33/292090433.db2.gz	PQVNHRORXCBZCV-UONOGXRCSA-N	1	0	258.321	2.200	1	0		CEAFRO
C[C@@H](NC(=S)Nc1ccc(NN)[nH+]c1)C(C)(C)C	ZINC000013600662	170568035	/nfs/dbraw/zinc/56/80/35/170568035.db2.gz	SMEYXUAGAIGLQH-MRVPVSSYSA-N	1	0	267.402	2.088	1	0		CEAFRO
O=C(NCC1=[NH+]CCN1)[C@H](c1ccccc1)C1CCCCC1	ZINC000026377096	171480640	/nfs/dbraw/zinc/48/06/40/171480640.db2.gz	TYOYJHUMVXBIKM-QGZVFWFLSA-N	1	0	299.418	2.468	1	0		CEAFRO
O=C(c1ccc(F)cc1)[C@H]1C[NH+]=C2C=CC=CN2C1	ZINC000043080445	174962233	/nfs/dbraw/zinc/96/22/33/174962233.db2.gz	MYSLBAFASLRSGF-LBPRGKRZSA-N	1	0	256.280	2.422	1	0		CEAFRO
Clc1ccccc1Cc1ncc2c(n1)CC[NH2+]CC2	ZINC000071335238	176126838	/nfs/dbraw/zinc/12/68/38/176126838.db2.gz	MZFWITNMUUIKAS-UHFFFAOYSA-N	1	0	273.767	2.409	1	0		CEAFRO
C[NH2+][C@@H]1CCN(c2ncnc3c4cc(C)ccc4oc32)C1	ZINC000049111937	522395923	/nfs/dbraw/zinc/39/59/23/522395923.db2.gz	IXOKQQLKEWVWIO-LLVKDONJSA-N	1	0	282.347	2.483	1	0		CEAFRO