smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[N@H+](CCCCC#N)Cc1ccc(Cl)c(Cl)c1	ZINC000096971844	185144869	/nfs/dbraw/zinc/14/48/69/185144869.db2.gz	OTUACXACTZMFGT-UHFFFAOYSA-N	1	0	271.191	4.119	20	30		CIEDRO
C=CCCC[NH2+][C@H](C)c1ccc(Br)c(F)c1	ZINC000309469618	260169867	/nfs/dbraw/zinc/16/98/67/260169867.db2.gz	QUGOILNXMXBSBJ-SNVBAGLBSA-N	1	0	286.188	4.205	20	30		CIEDRO
C[C@H]([NH2+]C1C[C@H](C)C[C@@H](C)C1)c1ccc(C#N)cc1	ZINC000084464901	260191775	/nfs/dbraw/zinc/19/17/75/260191775.db2.gz	LRECBTPXKDSLHZ-MCIONIFRSA-N	1	0	256.393	4.034	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(CC#N)cc1)c1cc2c(s1)CCC2	ZINC000573488561	334941758	/nfs/dbraw/zinc/94/17/58/334941758.db2.gz	MXCQVRAGGZFFDJ-ZDUSSCGKSA-N	1	0	296.439	4.154	20	30		CIEDRO
CC[C@@H]1CCCC[C@H]1[NH2+][C@H]1CCc2ccc(C#N)cc21	ZINC000573648983	334954697	/nfs/dbraw/zinc/95/46/97/334954697.db2.gz	ZOJKNKWYEJHTRA-OLMNPRSZSA-N	1	0	268.404	4.104	20	30		CIEDRO
C[N@H+](Cc1ccc(C#N)cc1)Cc1cccc(C(F)F)c1	ZINC000347966344	529983631	/nfs/dbraw/zinc/98/36/31/529983631.db2.gz	MMHRITLNSHBJAS-UHFFFAOYSA-N	1	0	286.325	4.128	20	30		CIEDRO
CC(C)[C@H](C)[N@H+](C)Cc1ccc(C#N)cc1C(F)(F)F	ZINC000574334290	335011305	/nfs/dbraw/zinc/01/13/05/335011305.db2.gz	CCYPNQKZTWIDNX-NSHDSACASA-N	1	0	284.325	4.053	20	30		CIEDRO
CC[C@H](c1cccc(OC)c1)[N@H+](C)Cc1ccccc1C#N	ZINC000574361204	335013517	/nfs/dbraw/zinc/01/35/17/335013517.db2.gz	AURVIZNUPJGDHT-LJQANCHMSA-N	1	0	294.398	4.150	20	30		CIEDRO
CC#CCC[N@H+](Cc1ccco1)Cc1ccc(C)s1	ZINC000462328262	261170108	/nfs/dbraw/zinc/17/01/08/261170108.db2.gz	RZYAFGYZJSWQGD-UHFFFAOYSA-N	1	0	273.401	4.065	20	30		CIEDRO
Cc1cc(C[NH2+]Cc2cc3c(s2)CCCC3)ccc1C#N	ZINC000574391086	335015284	/nfs/dbraw/zinc/01/52/84/335015284.db2.gz	WTLRIHQPICKLDJ-UHFFFAOYSA-N	1	0	296.439	4.097	20	30		CIEDRO
CCC(C)(C)[C@@H]1CCC[N@@H+]1CC(C)(C)CCC#N	ZINC000093809504	327200262	/nfs/dbraw/zinc/20/02/62/327200262.db2.gz	OGRFVDRHAPVBHO-AWEZNQCLSA-N	1	0	250.430	4.217	20	30		CIEDRO
C=CCCCC[NH2+][C@H](c1nccs1)c1ccccc1	ZINC000574520026	335026150	/nfs/dbraw/zinc/02/61/50/335026150.db2.gz	ZGXDPTYUIVLLGE-HNNXBMFYSA-N	1	0	272.417	4.178	20	30		CIEDRO
CC(C)CC[C@@H](C)[NH2+][C@H](C)c1ccc(C#N)cc1F	ZINC000512621242	260023153	/nfs/dbraw/zinc/02/31/53/260023153.db2.gz	VSUHJZMIPYHMNW-CHWSQXEVSA-N	1	0	262.372	4.173	20	30		CIEDRO
Cc1ccccc1[C@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)C1CC1	ZINC000447528254	260036407	/nfs/dbraw/zinc/03/64/07/260036407.db2.gz	IKUFFOONUXGEJV-YXJHDRRASA-N	1	0	268.404	4.118	20	30		CIEDRO
C=CCSCC[NH2+][C@@H](C)c1oc2ccccc2c1C	ZINC000221941666	262333051	/nfs/dbraw/zinc/33/30/51/262333051.db2.gz	OWJKWYXCTDEABG-ZDUSSCGKSA-N	1	0	275.417	4.311	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCCc2cc(C#N)ccc21)c1ccc(F)cc1	ZINC000341705991	129986709	/nfs/dbraw/zinc/98/67/09/129986709.db2.gz	PPRKETUNRRZVDY-ORAYPTAESA-N	1	0	294.373	4.426	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCCc2cc(C#N)ccc21)c1ccccc1	ZINC000341749993	130019662	/nfs/dbraw/zinc/01/96/62/130019662.db2.gz	DTGXIVSUGJMGFP-KUHUBIRLSA-N	1	0	276.383	4.286	20	30		CIEDRO
N#Cc1ccc2c(c1)CCC[C@@H]2[NH2+][C@H]1CCc2ccccc21	ZINC000341756578	130024694	/nfs/dbraw/zinc/02/46/94/130024694.db2.gz	FRWUWNLCOPKQOB-PMACEKPBSA-N	1	0	288.394	4.213	20	30		CIEDRO
Cc1ccc([C@H](C)[NH2+][C@H]2CCCc3cc(C#N)ccc32)o1	ZINC000341757062	130024757	/nfs/dbraw/zinc/02/47/57/130024757.db2.gz	HOCFGALTTXUTBQ-GUYCJALGSA-N	1	0	280.371	4.188	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCCc2cc(C#N)ccc21)c1ccccc1F	ZINC000341756198	130024812	/nfs/dbraw/zinc/02/48/12/130024812.db2.gz	DCUWKCITAWIKSW-DJJJIMSYSA-N	1	0	294.373	4.426	20	30		CIEDRO
N#Cc1ccc2c(c1)CCC[C@H]2[NH2+][C@@H]1CCCc2occc21	ZINC000341759952	130026746	/nfs/dbraw/zinc/02/67/46/130026746.db2.gz	JJARLTMNMKEUFJ-QZTJIDSGSA-N	1	0	292.382	4.196	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCCc2cc(C#N)ccc21)c1cccs1	ZINC000341763458	130028765	/nfs/dbraw/zinc/02/87/65/130028765.db2.gz	YVKIKRQELPPGNC-LRDDRELGSA-N	1	0	282.412	4.348	20	30		CIEDRO
C[C@H]([NH2+][C@@H](C)c1cccc(F)c1)c1ccc(C#N)cc1	ZINC000020147841	171035481	/nfs/dbraw/zinc/03/54/81/171035481.db2.gz	ZVWSNNKEEDGEJV-STQMWFEESA-N	1	0	268.335	4.109	20	30		CIEDRO
CCCCCC[C@@H](C)[NH2+]Cc1ccc(OCC#N)cc1	ZINC000034991527	171918028	/nfs/dbraw/zinc/91/80/28/171918028.db2.gz	NIUKSZCSIFBOND-OAHLLOKOSA-N	1	0	274.408	4.037	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H](C)Cc2cccs2)cc1	ZINC000035253941	172083388	/nfs/dbraw/zinc/08/33/88/172083388.db2.gz	KPBMDRCPLZETKL-AWEZNQCLSA-N	1	0	287.428	4.034	20	30		CIEDRO
CSc1ccc(C[NH2+][C@@H](C)c2ccc(C#N)cc2)cc1	ZINC000035256349	172085901	/nfs/dbraw/zinc/08/59/01/172085901.db2.gz	NLYNKKIMSHZLME-ZDUSSCGKSA-N	1	0	282.412	4.131	20	30		CIEDRO
C[C@@H]1[C@H]([NH2+]CC2CCC(C#N)CC2)C[C@@H]1c1ccccc1	ZINC000367034399	226464146	/nfs/dbraw/zinc/46/41/46/226464146.db2.gz	BPZPNPSTMMUHRD-NHMXRCTMSA-N	1	0	282.431	4.098	20	30		CIEDRO
Cc1ccc(C2(C[NH2+][C@H]3CC[C@H](C#N)C3)CCC2)cc1C	ZINC000442858411	226571512	/nfs/dbraw/zinc/57/15/12/226571512.db2.gz	HRVNALBJRCEOQV-WMZOPIPTSA-N	1	0	282.431	4.007	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+]C2CC(c3ccc(F)c(Cl)c3)C2)C1	ZINC000442865444	226671191	/nfs/dbraw/zinc/67/11/91/226671191.db2.gz	IISQZXGXCHAZMR-LZHSZURSSA-N	1	0	292.785	4.007	20	30		CIEDRO
N#CCCC[C@H]([NH2+]Cc1cccc(C#N)c1)c1ccccc1	ZINC000353911382	226813897	/nfs/dbraw/zinc/81/38/97/226813897.db2.gz	BRZIDHKQYCXOCJ-IBGZPJMESA-N	1	0	289.382	4.083	20	30		CIEDRO
N#CCCC[N@H+]1CCC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000352544072	227050419	/nfs/dbraw/zinc/05/04/19/227050419.db2.gz	NJNQXSZXDXLUNV-AWEZNQCLSA-N	1	0	296.336	4.189	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]C1CC(c2cc(F)cc(F)c2)C1	ZINC000575218079	335083101	/nfs/dbraw/zinc/08/31/01/335083101.db2.gz	QKBMARMZGFJZPC-NRAUKZCXSA-N	1	0	265.347	4.155	20	30		CIEDRO
N#Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C3CC3)cc1)CC2	ZINC000353597992	228128073	/nfs/dbraw/zinc/12/80/73/228128073.db2.gz	RJZQZDQRFJLXAL-HXUWFJFHSA-N	1	0	288.394	4.213	20	30		CIEDRO
N#CC1(CN2CCCC[C@@H]2c2nc3ccccc3o2)CCC1	ZINC000333659335	228209270	/nfs/dbraw/zinc/20/92/70/228209270.db2.gz	GPEWAKNJMJIUHS-OAHLLOKOSA-N	1	0	295.386	4.049	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([N@@H+]2CC=C(c3ccccc3Cl)CC2)C1	ZINC000335928743	228166623	/nfs/dbraw/zinc/16/66/23/228166623.db2.gz	VGLGYMBROGIYQK-DZGCQCFKSA-N	1	0	286.806	4.121	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([N@@H+]2CC=C(c3ccccc3Cl)CC2)C1	ZINC000335928744	228166756	/nfs/dbraw/zinc/16/67/56/228166756.db2.gz	VGLGYMBROGIYQK-HIFRSBDPSA-N	1	0	286.806	4.121	20	30		CIEDRO
CC[C@H]([NH2+]Cc1cccc(C#N)c1)c1cccc(Cl)c1	ZINC000036921336	260051765	/nfs/dbraw/zinc/05/17/65/260051765.db2.gz	WXNQWASANGMNIS-KRWDZBQOSA-N	1	0	284.790	4.453	20	30		CIEDRO
CCc1oc2ccccc2c1C[N@H+](C)Cc1ccc(C#N)o1	ZINC000179764593	260068273	/nfs/dbraw/zinc/06/82/73/260068273.db2.gz	ZFUAKWAYRSZHQB-UHFFFAOYSA-N	1	0	294.354	4.092	20	30		CIEDRO
Cc1cc(C[NH2+][C@H](C)c2ccc(C#N)cc2)ccc1Cl	ZINC000180786734	260111306	/nfs/dbraw/zinc/11/13/06/260111306.db2.gz	IDLOQHDDTZOFQQ-CYBMUJFWSA-N	1	0	284.790	4.371	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1ccc(Br)c(F)c1	ZINC000309481194	260170857	/nfs/dbraw/zinc/17/08/57/260170857.db2.gz	TVHCBWBXEIKDLN-LLVKDONJSA-N	1	0	286.188	4.033	20	30		CIEDRO
CC(C)C[N@H+](CCCC(C)(C)C#N)C1CCCC1	ZINC000093097751	260183712	/nfs/dbraw/zinc/18/37/12/260183712.db2.gz	HXQAEWDVUKPXMS-UHFFFAOYSA-N	1	0	250.430	4.217	20	30		CIEDRO
C[C@@H]([NH2+]Cc1sccc1Cl)c1ccc(C#N)cc1	ZINC000310693430	260224311	/nfs/dbraw/zinc/22/43/11/260224311.db2.gz	SMMLGSGQYPDITH-SNVBAGLBSA-N	1	0	276.792	4.124	20	30		CIEDRO
CC1(C#N)CCC([NH2+]CCc2ccc(F)cc2Cl)CC1	ZINC000449140508	260249396	/nfs/dbraw/zinc/24/93/96/260249396.db2.gz	CHXLKMYMZKNKSD-UHFFFAOYSA-N	1	0	294.801	4.084	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]C1CC(c2ccccc2F)C1	ZINC000311802868	260258707	/nfs/dbraw/zinc/25/87/07/260258707.db2.gz	BVBLJSSUZVOZLU-UHFFFAOYSA-N	1	0	261.384	4.264	20	30		CIEDRO
N#CCCCC[N@@H+]1CCC[C@@H]1c1nc2ccccc2s1	ZINC000071016263	260271733	/nfs/dbraw/zinc/27/17/33/260271733.db2.gz	MKFJWQNILCZQOK-CQSZACIVSA-N	1	0	285.416	4.127	20	30		CIEDRO
C[C@H]1CC(C)(C)CC[C@@H]1[NH2+]C1CCC(C)(C#N)CC1	ZINC000449187378	260285156	/nfs/dbraw/zinc/28/51/56/260285156.db2.gz	QOFHHHNQYAOLLP-BOLLXYOYSA-N	1	0	262.441	4.263	20	30		CIEDRO
CN(Cc1ccc(Cl)s1)Cc1cccc(C#N)c1F	ZINC000223516766	260304623	/nfs/dbraw/zinc/30/46/23/260304623.db2.gz	OYQYFASULHXDHX-UHFFFAOYSA-N	1	0	294.782	4.044	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCc2ccc(C#N)cc21)C1CCCCC1	ZINC000517786903	260306888	/nfs/dbraw/zinc/30/68/88/260306888.db2.gz	HAMUBUIKHZLTKP-UGSOOPFHSA-N	1	0	268.404	4.104	20	30		CIEDRO
CC[C@@H](C)[C@@H](C)[N@H+](Cc1cc(C#N)ccc1F)C1CC1	ZINC000517908935	260316601	/nfs/dbraw/zinc/31/66/01/260316601.db2.gz	RPMUCVWPCKNZAW-CHWSQXEVSA-N	1	0	274.383	4.096	20	30		CIEDRO
Cc1ccc([C@H]2C[C@H](C)CC[N@@H+]2CCCSCC#N)o1	ZINC000080629680	260317450	/nfs/dbraw/zinc/31/74/50/260317450.db2.gz	MQHRNKINWXAKLM-UKRRQHHQSA-N	1	0	292.448	4.008	20	30		CIEDRO
N#CCCCC[N@@H+](Cc1cc(F)ccc1F)C1CCCC1	ZINC000083446699	260350847	/nfs/dbraw/zinc/35/08/47/260350847.db2.gz	COOMRYLIEZNUEB-UHFFFAOYSA-N	1	0	292.373	4.403	20	30		CIEDRO
C[C@H](C[NH2+]CC(C)(C)CCC#N)c1cccc(Cl)c1	ZINC000518247572	260360880	/nfs/dbraw/zinc/36/08/80/260360880.db2.gz	GENWVKISSCCHLB-CYBMUJFWSA-N	1	0	278.827	4.363	20	30		CIEDRO
CCc1nc(C)c([C@@H](C)[N@H+](C)CC(C)(C)CCC#N)s1	ZINC000093612680	260522526	/nfs/dbraw/zinc/52/25/26/260522526.db2.gz	LHDMRTJJQHJPNR-CYBMUJFWSA-N	1	0	293.480	4.337	20	30		CIEDRO
C=C[C@H](C)[NH2+][C@@H](CC)c1cccc(Br)c1	ZINC000157283765	260834766	/nfs/dbraw/zinc/83/47/66/260834766.db2.gz	YTGLWOCLCKOWFR-GWCFXTLKSA-N	1	0	268.198	4.064	20	30		CIEDRO
Cc1cccc(C[NH2+][C@@H](CCC#N)c2ccccc2)c1C	ZINC000130540059	260858111	/nfs/dbraw/zinc/85/81/11/260858111.db2.gz	RJIPJNHFJMCYRX-IBGZPJMESA-N	1	0	278.399	4.438	20	30		CIEDRO
CSc1cc(C)ccc1C[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000151727629	261054838	/nfs/dbraw/zinc/05/48/38/261054838.db2.gz	BAIRBSUKCHTEHF-CQSZACIVSA-N	1	0	296.439	4.439	20	30		CIEDRO
C=C(C)COCC[NH2+][C@@H](C)c1ccc2cc(OC)ccc2c1	ZINC000318432044	261080851	/nfs/dbraw/zinc/08/08/51/261080851.db2.gz	MIKOUMFQTHHRDV-HNNXBMFYSA-N	1	0	299.414	4.092	20	30		CIEDRO
COc1ccc([C@H]2CCC[N@@H+]2CC(C)(C)CCC#N)cc1	ZINC000155150636	261098768	/nfs/dbraw/zinc/09/87/68/261098768.db2.gz	MTOBJURYULFPBM-QGZVFWFLSA-N	1	0	286.419	4.162	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](C)c1ccc(Br)s1	ZINC000161638701	261103517	/nfs/dbraw/zinc/10/35/17/261103517.db2.gz	DVPAETQVYDNJSV-RKDXNWHRSA-N	1	0	274.227	4.126	20	30		CIEDRO
CCC1(CC)[C@H]([NH2+]CCCCC(C)(C)C#N)[C@H](C)[C@H]1OC	ZINC000444699161	261108306	/nfs/dbraw/zinc/10/83/06/261108306.db2.gz	MRZXDIFHPPVOOL-ARFHVFGLSA-N	1	0	294.483	4.136	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)c1ccc(F)c(Br)c1	ZINC000161670882	261114549	/nfs/dbraw/zinc/11/45/49/261114549.db2.gz	YDHJKNDBEHHBKZ-VHSXEESVSA-N	1	0	286.188	4.203	20	30		CIEDRO
CC[C@H]([NH2+]CCCCC#N)c1cc(Cl)ccc1OC	ZINC000361112615	261162729	/nfs/dbraw/zinc/16/27/29/261162729.db2.gz	ISWMLDDJARZTGA-AWEZNQCLSA-N	1	0	280.799	4.083	20	30		CIEDRO
CC[C@@H](Cc1ccc(C)cc1)[N@H+](CC)CCCCC#N	ZINC000173992119	261174259	/nfs/dbraw/zinc/17/42/59/261174259.db2.gz	LTJIICPHJSNARG-SFHVURJKSA-N	1	0	272.436	4.332	20	30		CIEDRO
CC(C)(CCC#N)C[NH+](Cc1ccco1)Cc1ccco1	ZINC000162579093	261287389	/nfs/dbraw/zinc/28/73/89/261287389.db2.gz	XUIZFWNLRCAVJQ-UHFFFAOYSA-N	1	0	286.375	4.205	20	30		CIEDRO
C[C@H]1CCCc2ccccc2[C@H]1[NH2+]Cc1ccc(C#N)cc1	ZINC000462547509	261347910	/nfs/dbraw/zinc/34/79/10/261347910.db2.gz	HFYPEGGDEDTEBW-YWZLYKJASA-N	1	0	290.410	4.362	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCC[C@@H](C)CC1)c1ccc(C#N)cc1	ZINC000086883119	261685202	/nfs/dbraw/zinc/68/52/02/261685202.db2.gz	QMIQSCSGIZRPFF-KEYYUXOJSA-N	1	0	256.393	4.178	20	30		CIEDRO
CC(C)(C#N)CCC[NH2+]C(C)(C)c1ccc(F)c(F)c1	ZINC000180860682	261876260	/nfs/dbraw/zinc/87/62/60/261876260.db2.gz	INXRVZLPDNPRNQ-UHFFFAOYSA-N	1	0	280.362	4.119	20	30		CIEDRO
CCc1c2ccccc2oc1[C@@H](C)[NH2+]CCCCC#N	ZINC000181683513	261907069	/nfs/dbraw/zinc/90/70/69/261907069.db2.gz	CGOSUVYLYYVWMQ-CYBMUJFWSA-N	1	0	270.376	4.340	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1ccc(OC(F)F)cc1	ZINC000185768021	262069992	/nfs/dbraw/zinc/06/99/92/262069992.db2.gz	AYZMJYJISRCKKB-DYEKYZERSA-N	1	0	294.345	4.021	20	30		CIEDRO
Cc1ccc(O)c([C@H](C)[NH2+][C@H](CCC#N)c2ccccc2)c1	ZINC000186150636	262082039	/nfs/dbraw/zinc/08/20/39/262082039.db2.gz	KAUQQMCTCDCRLL-MAUKXSAKSA-N	1	0	294.398	4.396	20	30		CIEDRO
C[C@@H](c1cccc(-c2ccncc2)c1)[N@H+](C)CCCCC#N	ZINC000364037015	262111860	/nfs/dbraw/zinc/11/18/60/262111860.db2.gz	UQQKGHREYOBUMM-INIZCTEOSA-N	1	0	293.414	4.435	20	30		CIEDRO
N#CCC[C@@H]([NH2+][C@@H]1CCC12CCCC2)c1ccccc1	ZINC000189179680	262168429	/nfs/dbraw/zinc/16/84/29/262168429.db2.gz	ICEKWPOOLJFDGA-IAGOWNOFSA-N	1	0	268.404	4.344	20	30		CIEDRO
N#CCCCC[NH2+][C@H](Cc1ccccc1F)c1ccccc1	ZINC000191718639	262194540	/nfs/dbraw/zinc/19/45/40/262194540.db2.gz	YCLFUKHKTZGGEI-LJQANCHMSA-N	1	0	296.389	4.393	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H](C)c2cccc(F)c2)cc1	ZINC000020148053	262194875	/nfs/dbraw/zinc/19/48/75/262194875.db2.gz	DQJYVQCAQUJZNA-CQSZACIVSA-N	1	0	285.362	4.241	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CCSC[C@H]1c1cccs1	ZINC000364332641	262204482	/nfs/dbraw/zinc/20/44/82/262204482.db2.gz	BBASRUXNXHVLLL-ZDUSSCGKSA-N	1	0	294.489	4.168	20	30		CIEDRO
C=CCC[C@H](NCCC[N@H+]1CCCC[C@H]1C)c1ccco1	ZINC000514089650	262214843	/nfs/dbraw/zinc/21/48/43/262214843.db2.gz	QKSBXDABSGZGSU-SJORKVTESA-N	1	0	290.451	4.141	20	30		CIEDRO
CCCCCCCC[NH+]1CCC(OC2CCOCC2)CC1	ZINC000364623451	262255562	/nfs/dbraw/zinc/25/55/62/262255562.db2.gz	GMNPBDFEIDIVTP-UHFFFAOYSA-N	1	0	297.483	4.007	20	30		CIEDRO
C[C@H](CCC1CCCCC1)[NH2+][C@@H]1CCC[C@H](C#N)C1	ZINC000463297558	262310713	/nfs/dbraw/zinc/31/07/13/262310713.db2.gz	NGKWHNSFXAIXIT-HYVNUMGLSA-N	1	0	262.441	4.407	20	30		CIEDRO
C=CCSCC[NH2+][C@@H](C)c1ccccc1C(F)(F)F	ZINC000221939507	262333004	/nfs/dbraw/zinc/33/30/04/262333004.db2.gz	CALJDADQRUTWKG-NSHDSACASA-N	1	0	289.366	4.275	20	30		CIEDRO
C=CCCOCC[NH2+][C@H](C)c1ccc2cc(OC)ccc2c1	ZINC000319928713	262378557	/nfs/dbraw/zinc/37/85/57/262378557.db2.gz	HNEREHJYMHYJKG-OAHLLOKOSA-N	1	0	299.414	4.092	20	30		CIEDRO
CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2cccc(C#N)c2)cc1	ZINC000061078991	262392165	/nfs/dbraw/zinc/39/21/65/262392165.db2.gz	JEHQGOCDUPOCRY-OAHLLOKOSA-N	1	0	294.398	4.196	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@@H](C)c1ccsc1	ZINC000061361431	262394631	/nfs/dbraw/zinc/39/46/31/262394631.db2.gz	BJDQBXXEBXFZJE-ZDUSSCGKSA-N	1	0	273.401	4.164	20	30		CIEDRO
CC(C)[N@H+](CCCCC(C)(C)C#N)Cc1cccnc1	ZINC000336827643	262398552	/nfs/dbraw/zinc/39/85/52/262398552.db2.gz	DBUFQZQEGKTLEU-UHFFFAOYSA-N	1	0	273.424	4.012	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]Cc1cc(F)cc2cccnc21	ZINC000339416067	262639742	/nfs/dbraw/zinc/63/97/42/262639742.db2.gz	KNTINPIXGMQTFB-UHFFFAOYSA-N	1	0	272.367	4.066	20	30		CIEDRO
Cc1csc(C(C)(C)[NH2+]CCC2(C#N)CCCCC2)n1	ZINC000411375080	262690905	/nfs/dbraw/zinc/69/09/05/262690905.db2.gz	OLXSKCDSADJSCV-UHFFFAOYSA-N	1	0	291.464	4.140	20	30		CIEDRO
Cc1cccc2nc(C3CC[NH+]([C@H](C)CCC#N)CC3)oc21	ZINC000411610655	262700135	/nfs/dbraw/zinc/70/01/35/262700135.db2.gz	NAYMAAJBPDOLFX-CQSZACIVSA-N	1	0	297.402	4.008	20	30		CIEDRO
CCS[C@H]1CCC[C@H]1[NH2+]CCC1(C#N)CCCCC1	ZINC000411723039	262705286	/nfs/dbraw/zinc/70/52/86/262705286.db2.gz	RVUPBXIDCDJMOA-CABCVRRESA-N	1	0	280.481	4.114	20	30		CIEDRO
N#CC1(CC[N@@H+]2CCC[C@@]3(CCSC3)C2)CCCCC1	ZINC000411811522	262707623	/nfs/dbraw/zinc/70/76/23/262707623.db2.gz	UTCFZHRABJGQRM-QGZVFWFLSA-N	1	0	292.492	4.070	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+]Cc1ccc(C(C)(C)C)s1	ZINC000435749118	262748301	/nfs/dbraw/zinc/74/83/01/262748301.db2.gz	RITKAQGTFKDGMP-CJNGLKHVSA-N	1	0	293.476	4.116	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1csc(-c2ccccc2)n1	ZINC000414136705	262809243	/nfs/dbraw/zinc/80/92/43/262809243.db2.gz	DNINVPPHYCKMHI-ZDUSSCGKSA-N	1	0	272.417	4.427	20	30		CIEDRO
CC[C@H]([NH2+][C@H](CCCC#N)c1ccccc1)[C@H]1C[C@H]1C	ZINC000414146617	262810207	/nfs/dbraw/zinc/81/02/07/262810207.db2.gz	QMQKYIYJWGRSOU-LAVFITLUSA-N	1	0	270.420	4.446	20	30		CIEDRO
CC[C@H]([NH2+]CCC(C)(C)C#N)c1ccccc1OC(F)F	ZINC000272000175	263001163	/nfs/dbraw/zinc/00/11/63/263001163.db2.gz	HLXJACWHTCIJPR-ZDUSSCGKSA-N	1	0	296.361	4.269	20	30		CIEDRO
N#CCCCC[NH2+]CC(c1ccccc1)c1ccccc1	ZINC000272416453	263004031	/nfs/dbraw/zinc/00/40/31/263004031.db2.gz	MKACKJHVOVYCHY-UHFFFAOYSA-N	1	0	278.399	4.102	20	30		CIEDRO
C[C@@H](c1ccc(C(F)(F)F)cc1)[NH+]1CCC(C)(C#N)CC1	ZINC000272618585	263007562	/nfs/dbraw/zinc/00/75/62/263007562.db2.gz	UKLZIJNGXNHCAM-LBPRGKRZSA-N	1	0	296.336	4.392	20	30		CIEDRO
C[C@H](c1ccc(C(F)(F)F)cc1)[NH+]1CCC(C)(C#N)CC1	ZINC000272618583	263007571	/nfs/dbraw/zinc/00/75/71/263007571.db2.gz	UKLZIJNGXNHCAM-GFCCVEGCSA-N	1	0	296.336	4.392	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CC[C@@H](C#N)C1)c1ccc(Cl)s1	ZINC000274659179	263029118	/nfs/dbraw/zinc/02/91/18/263029118.db2.gz	VHUCGTFIUAEXPD-MXWKQRLJSA-N	1	0	268.813	4.134	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](C#N)C1)c1cccc2ccccc21	ZINC000274547586	263025912	/nfs/dbraw/zinc/02/59/12/263025912.db2.gz	VPAPCMGAELGHHS-LZWOXQAQSA-N	1	0	264.372	4.183	20	30		CIEDRO
N#C[C@H]1CC[C@H]([NH2+]C(c2ccccc2)c2ccccc2)C1	ZINC000274617284	263027902	/nfs/dbraw/zinc/02/79/02/263027902.db2.gz	LNTYJGCDCONUFY-YJBOKZPZSA-N	1	0	276.383	4.058	20	30		CIEDRO
C[C@@]1(c2ccccc2)CC[C@@H]([NH+]2CCC(C)(C#N)CC2)C1	ZINC000276225111	263035417	/nfs/dbraw/zinc/03/54/17/263035417.db2.gz	MNTHXGVKOUCMDR-IEBWSBKVSA-N	1	0	282.431	4.122	20	30		CIEDRO
C[C@H]([NH2+]CCC(C)(C)C#N)c1ccc(C(F)(F)F)cc1	ZINC000276341083	263036458	/nfs/dbraw/zinc/03/64/58/263036458.db2.gz	HARMSOYPHWNSFX-NSHDSACASA-N	1	0	284.325	4.296	20	30		CIEDRO
Cc1nc(C)c([C@@H](C)[N@H+](C)CCCCC(C)(C)C#N)s1	ZINC000277861272	263043932	/nfs/dbraw/zinc/04/39/32/263043932.db2.gz	YBPFDCYUXYLFKV-CYBMUJFWSA-N	1	0	293.480	4.473	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+]Cc2cc3ccccc3s2)C1	ZINC000278326079	263046878	/nfs/dbraw/zinc/04/68/78/263046878.db2.gz	VQFUOHUKHMXIEO-GXTWGEPZSA-N	1	0	270.401	4.073	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+]Cc2cc3ccccc3s2)C1	ZINC000278326101	263047139	/nfs/dbraw/zinc/04/71/39/263047139.db2.gz	VQFUOHUKHMXIEO-TZMCWYRMSA-N	1	0	270.401	4.073	20	30		CIEDRO
CC(C)[C@H]1C[C@@H]([NH2+]CCCCC#N)c2ccccc21	ZINC000278875561	263051597	/nfs/dbraw/zinc/05/15/97/263051597.db2.gz	XJYZLJXZCZIVHC-IAGOWNOFSA-N	1	0	256.393	4.154	20	30		CIEDRO
Cc1nc([C@H]2CCC[N@@H+]2CCCCC(C)(C)C#N)cs1	ZINC000278906407	263051809	/nfs/dbraw/zinc/05/18/09/263051809.db2.gz	VORGVIFYWBLLBS-OAHLLOKOSA-N	1	0	291.464	4.309	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H]1CC[C@H](c2cccc(F)c2)C1	ZINC000280367023	263060789	/nfs/dbraw/zinc/06/07/89/263060789.db2.gz	UYQYUQVUIGMUIY-RDJZCZTQSA-N	1	0	288.410	4.381	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1CC[C@@H](c2cccc(F)c2)C1	ZINC000280367017	263060851	/nfs/dbraw/zinc/06/08/51/263060851.db2.gz	UYQYUQVUIGMUIY-NVXWUHKLSA-N	1	0	288.410	4.381	20	30		CIEDRO
C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+]CCCCC#N	ZINC000280960964	263065495	/nfs/dbraw/zinc/06/54/95/263065495.db2.gz	SJIZDGNGKYNHIA-STQMWFEESA-N	1	0	264.800	4.115	20	30		CIEDRO
CC[C@H]([NH2+]C[C@H]1CCC(F)(F)C1)c1ccc(C#N)cc1	ZINC000281044253	263066068	/nfs/dbraw/zinc/06/60/68/263066068.db2.gz	HDHIAVNMDNSUJI-ZFWWWQNUSA-N	1	0	278.346	4.034	20	30		CIEDRO
CC[C@@H]([NH2+]C[C@@H]1CCC(F)(F)C1)c1ccc(C#N)cc1	ZINC000281044249	263066097	/nfs/dbraw/zinc/06/60/97/263066097.db2.gz	HDHIAVNMDNSUJI-UKRRQHHQSA-N	1	0	278.346	4.034	20	30		CIEDRO
CSc1ccc([C@@H](C)[NH2+][C@@H]2CCC[C@H](C#N)C2)cc1	ZINC000281825536	263072101	/nfs/dbraw/zinc/07/21/01/263072101.db2.gz	ZVMUYWLAAFEKCO-VNHYZAJKSA-N	1	0	274.433	4.141	20	30		CIEDRO
CSc1ccc([C@H](C)[NH2+][C@H]2CCC[C@H](C#N)C2)cc1	ZINC000281825540	263072191	/nfs/dbraw/zinc/07/21/91/263072191.db2.gz	ZVMUYWLAAFEKCO-YDHLFZDLSA-N	1	0	274.433	4.141	20	30		CIEDRO
CSc1ccccc1[C@@H](C)[NH2+]CCCC(C)(C)C#N	ZINC000282100347	263074230	/nfs/dbraw/zinc/07/42/30/263074230.db2.gz	PEYSXSJPVILNFX-CYBMUJFWSA-N	1	0	276.449	4.389	20	30		CIEDRO
Cc1ccsc1[C@H](C)[NH2+]CC1CCC(C#N)CC1	ZINC000282158010	263074791	/nfs/dbraw/zinc/07/47/91/263074791.db2.gz	DEIWZYKOEHNOQY-HSBZDZAISA-N	1	0	262.422	4.037	20	30		CIEDRO
CC(C)C[C@H]([NH2+]CC1CCC(C#N)CC1)c1ccccn1	ZINC000282214273	263075184	/nfs/dbraw/zinc/07/51/84/263075184.db2.gz	HOJUOSIGFZHHAR-HTWSVDAQSA-N	1	0	285.435	4.088	20	30		CIEDRO
C[NH+](C)Cc1cc(NCC(C)(C)CCC#N)ccc1Cl	ZINC000282393678	263076456	/nfs/dbraw/zinc/07/64/56/263076456.db2.gz	YBPORPZCVXWVKC-UHFFFAOYSA-N	1	0	293.842	4.143	20	30		CIEDRO
CC[C@@H]([NH2+]CC1CCC(C#N)CC1)c1ccc(F)cc1	ZINC000282415317	263076617	/nfs/dbraw/zinc/07/66/17/263076617.db2.gz	LEJPMOJBBJOLMV-MQBCKMQZSA-N	1	0	274.383	4.196	20	30		CIEDRO
CC[C@H]([NH2+]CC1CCC(C#N)CC1)c1ccc(F)cc1	ZINC000282415309	263076618	/nfs/dbraw/zinc/07/66/18/263076618.db2.gz	LEJPMOJBBJOLMV-KVULBXGLSA-N	1	0	274.383	4.196	20	30		CIEDRO
CCN(C)c1ccc([C@@H](C)[NH2+]CC2CCC(C#N)CC2)cc1	ZINC000282456054	263076840	/nfs/dbraw/zinc/07/68/40/263076840.db2.gz	VIPSJLLXDJNNMU-KLAILNCOSA-N	1	0	299.462	4.123	20	30		CIEDRO
CCCCOc1ccc([C@@H](C)[NH2+]CCCCC#N)cc1	ZINC000284303855	263086544	/nfs/dbraw/zinc/08/65/44/263086544.db2.gz	KXVKNNNYCCXKMA-OAHLLOKOSA-N	1	0	274.408	4.210	20	30		CIEDRO
C[C@@H](C[NH2+]CCCCC#N)c1ccc(C(F)(F)F)cc1	ZINC000290425103	263116571	/nfs/dbraw/zinc/11/65/71/263116571.db2.gz	RHOLQTVBLHHIRM-LBPRGKRZSA-N	1	0	284.325	4.092	20	30		CIEDRO
CC(F)(F)c1ccc(C[NH2+]Cc2ccc(C#N)s2)cc1	ZINC000293054415	263137447	/nfs/dbraw/zinc/13/74/47/263137447.db2.gz	UDAOPSMCTXFVPW-UHFFFAOYSA-N	1	0	292.354	4.021	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H]1CCCOc2ccc(OC)cc21	ZINC000340425542	263139596	/nfs/dbraw/zinc/13/95/96/263139596.db2.gz	XDIQASAWNNBRAT-INIZCTEOSA-N	1	0	289.419	4.101	20	30		CIEDRO
C[C@H]([NH2+][C@H](CCCC#N)c1ccccc1)c1nccs1	ZINC000340431839	263144990	/nfs/dbraw/zinc/14/49/90/263144990.db2.gz	JNMOKTAFXIPSTN-DZGCQCFKSA-N	1	0	285.416	4.229	20	30		CIEDRO
Cc1cc(C)cc(C2=CC[N@@H+]([C@H]3CC[C@@H](C#N)C3)CC2)c1	ZINC000293714043	263147630	/nfs/dbraw/zinc/14/76/30/263147630.db2.gz	FAAWRAMFVATEKB-APWZRJJASA-N	1	0	280.415	4.085	20	30		CIEDRO
C[C@H]([NH2+][C@H](CCCC#N)c1ccccc1)[C@H]1CC1(C)C	ZINC000340439020	263148057	/nfs/dbraw/zinc/14/80/57/263148057.db2.gz	BGCQBSZIUNOBIZ-USXIJHARSA-N	1	0	270.420	4.446	20	30		CIEDRO
C[C@H]([NH2+][C@@H](CCCC#N)c1ccccc1)c1cncs1	ZINC000340445910	263152471	/nfs/dbraw/zinc/15/24/71/263152471.db2.gz	MDFQIMSZMLYUIS-ZFWWWQNUSA-N	1	0	285.416	4.229	20	30		CIEDRO
C[C@H]([NH2+][C@@H](CCCC#N)c1ccccc1)c1cccnc1	ZINC000340451048	263155632	/nfs/dbraw/zinc/15/56/32/263155632.db2.gz	ZJNGBFLFDPGVEK-YJBOKZPZSA-N	1	0	279.387	4.167	20	30		CIEDRO
C[C@@H]([NH2+][C@H](CCCC#N)c1ccccc1)c1ccco1	ZINC000340449745	263155727	/nfs/dbraw/zinc/15/57/27/263155727.db2.gz	WQBBGEMGOAXZSA-GDBMZVCRSA-N	1	0	268.360	4.365	20	30		CIEDRO
CC[C@H](C)[C@H](C)[NH2+][C@@H](CCCC#N)c1ccccc1	ZINC000340461474	263161351	/nfs/dbraw/zinc/16/13/51/263161351.db2.gz	ZIZLGVDWGZVAFN-ZOBUZTSGSA-N	1	0	258.409	4.446	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH+]2CCC(c3ccc(Cl)cc3)CC2)C1	ZINC000294485457	263162713	/nfs/dbraw/zinc/16/27/13/263162713.db2.gz	HLXVPCUZANKQRC-CXAGYDPISA-N	1	0	288.822	4.212	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+]Cc2cc(Cl)cc(Cl)c2)C1	ZINC000294953588	263169734	/nfs/dbraw/zinc/16/97/34/263169734.db2.gz	DGLMSZNTVJIKLD-HZMBPMFUSA-N	1	0	283.202	4.165	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@H]2CCC[C@@H]2Cc2ccccc2)C1	ZINC000295005591	263170795	/nfs/dbraw/zinc/17/07/95/263170795.db2.gz	IZCJTPLYJVJSTD-RDGPPVDQSA-N	1	0	282.431	4.070	20	30		CIEDRO
C[C@]1(c2ccccc2)CC[C@@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)C1	ZINC000295059393	263171415	/nfs/dbraw/zinc/17/14/15/263171415.db2.gz	OCXGZGGVWINQBS-KANFNMMFSA-N	1	0	282.431	4.169	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1cc2ccccc2o1	ZINC000296331470	263189928	/nfs/dbraw/zinc/18/99/28/263189928.db2.gz	HIHPAVYUFDLZOO-YDHLFZDLSA-N	1	0	268.360	4.166	20	30		CIEDRO
Cc1cc([C@H](C)[NH2+]CC2CCC(C#N)CC2)cs1	ZINC000296427086	263191389	/nfs/dbraw/zinc/19/13/89/263191389.db2.gz	LTLUBUVCMLVWNC-HSBZDZAISA-N	1	0	262.422	4.037	20	30		CIEDRO
C[C@@H]1CC[C@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)c2ccccc21	ZINC000296425214	263191529	/nfs/dbraw/zinc/19/15/29/263191529.db2.gz	LPCVTNUMXMBQBL-LLDVTBCESA-N	1	0	268.404	4.297	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccc(C)cc1	ZINC000296514603	263192416	/nfs/dbraw/zinc/19/24/16/263192416.db2.gz	PQKCBOIDTJWBIK-XIRDDKMYSA-N	1	0	256.393	4.118	20	30		CIEDRO
CCC[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccccc1	ZINC000296599775	263194178	/nfs/dbraw/zinc/19/41/78/263194178.db2.gz	VNOSPHWZZDEFPV-BHYGNILZSA-N	1	0	256.393	4.200	20	30		CIEDRO
C[C@@H](CCC#N)[NH2+][C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000298459584	263219865	/nfs/dbraw/zinc/21/98/65/263219865.db2.gz	IBPWIXUEEQZSKP-QWRGUYRKSA-N	1	0	270.298	4.048	20	30		CIEDRO
CC[C@H]([NH2+][C@@H](C)CCC#N)c1ccccc1OC(F)F	ZINC000299733116	263253920	/nfs/dbraw/zinc/25/39/20/263253920.db2.gz	YGPVXPBOYKAPSW-AAEUAGOBSA-N	1	0	282.334	4.021	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)CCC#N)c1cccc(C(F)(F)F)c1	ZINC000299733977	263254417	/nfs/dbraw/zinc/25/44/17/263254417.db2.gz	ZEJXPOCOPQTJOX-WDEREUQCSA-N	1	0	270.298	4.048	20	30		CIEDRO
CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H](CCC#N)c1ccccc1	ZINC000353632931	263282379	/nfs/dbraw/zinc/28/23/79/263282379.db2.gz	QTGCNLKXQWPMPG-ULQDDVLXSA-N	1	0	256.393	4.056	20	30		CIEDRO
CC(C)[C@@H]([NH2+]CCCC#N)c1cc2ccccc2o1	ZINC000341865573	263357026	/nfs/dbraw/zinc/35/70/26/263357026.db2.gz	HEPZKKMBUIJJRD-MRXNPFEDSA-N	1	0	256.349	4.023	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCOC(C)(C)C)c1ccccc1	ZINC000341934217	263367133	/nfs/dbraw/zinc/36/71/33/263367133.db2.gz	WWDMTPRRJLSKML-INIZCTEOSA-N	1	0	261.409	4.099	20	30		CIEDRO
CCc1ccc([C@H](C)[NH2+][C@@H]2CCCc3cc(C#N)ccc32)o1	ZINC000417372869	263892518	/nfs/dbraw/zinc/89/25/18/263892518.db2.gz	WRVVIRFDDVMKII-SCLBCKFNSA-N	1	0	294.398	4.442	20	30		CIEDRO
Cc1sccc1C[N@@H+](C)[C@H](C)c1cccc(C#N)c1	ZINC000425368892	264212918	/nfs/dbraw/zinc/21/29/18/264212918.db2.gz	YEEJLUNYABADET-GFCCVEGCSA-N	1	0	270.401	4.121	20	30		CIEDRO
N#CCC[NH2+]C(CCc1ccccc1)CCc1ccccc1	ZINC000425985456	264264181	/nfs/dbraw/zinc/26/41/81/264264181.db2.gz	QSQRSARGKKQNLR-UHFFFAOYSA-N	1	0	292.426	4.124	20	30		CIEDRO
C=C[C@H](C)[NH2+][C@H](CC)c1cccc(Br)c1	ZINC000157283916	264285271	/nfs/dbraw/zinc/28/52/71/264285271.db2.gz	YTGLWOCLCKOWFR-GXFFZTMASA-N	1	0	268.198	4.064	20	30		CIEDRO
C=CC[C@@H]1[N@@H+](C/C=C\c2ccncc2)CCCC1(C)C	ZINC000425996661	264303479	/nfs/dbraw/zinc/30/34/79/264303479.db2.gz	RUMXYCOIZZIDKI-AFCDSYGPSA-N	1	0	270.420	4.162	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H](C)c2ccc(C)cc2O)cc1	ZINC000287401255	264630001	/nfs/dbraw/zinc/63/00/01/264630001.db2.gz	JDKZJSSTJWWFDB-OAHLLOKOSA-N	1	0	297.398	4.116	20	30		CIEDRO
CC[N@H+](Cc1cc(C#N)cs1)Cc1c[nH]c2ccccc12	ZINC000191189010	265167528	/nfs/dbraw/zinc/16/75/28/265167528.db2.gz	POWFMHVUZAZUQX-UHFFFAOYSA-N	1	0	295.411	4.123	20	30		CIEDRO
CC(C)[C@@H]([NH2+]Cc1cc(C#N)cs1)c1ccccc1	ZINC000093492198	265181175	/nfs/dbraw/zinc/18/11/75/265181175.db2.gz	BIEUJBCNKFSAMR-MRXNPFEDSA-N	1	0	270.401	4.107	20	30		CIEDRO
CC(C)[C@H]([NH2+]Cc1cc(C#N)cs1)c1ccccc1	ZINC000093492197	265182002	/nfs/dbraw/zinc/18/20/02/265182002.db2.gz	BIEUJBCNKFSAMR-INIZCTEOSA-N	1	0	270.401	4.107	20	30		CIEDRO
C[C@H]([NH2+]Cc1cc(C#N)cs1)c1ccc(Cl)cc1	ZINC000093492060	265182479	/nfs/dbraw/zinc/18/24/79/265182479.db2.gz	LGZWTYJLRMQSHR-JTQLQIEISA-N	1	0	276.792	4.124	20	30		CIEDRO
Cc1ccc(C)c([C@@H](C)[NH2+]Cc2cccc(C#N)c2)c1	ZINC000011039498	265230731	/nfs/dbraw/zinc/23/07/31/265230731.db2.gz	IGNNUBWGLIDFHT-OAHLLOKOSA-N	1	0	264.372	4.026	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCCCC1(C)C)c1cccc(C#N)c1	ZINC000094323288	265236725	/nfs/dbraw/zinc/23/67/25/265236725.db2.gz	VPPPZJUZRDVAOK-CJNGLKHVSA-N	1	0	256.393	4.178	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1cc(F)cc(F)c1)c1ccc(C#N)cc1	ZINC000094826632	265259869	/nfs/dbraw/zinc/25/98/69/265259869.db2.gz	UWPSVYJJPKRBSJ-NEPJUHHUSA-N	1	0	286.325	4.248	20	30		CIEDRO
N#Cc1ccc(C[N@@H+]2CCC[C@@H](Cc3ccccc3)C2)cc1	ZINC000520697044	265896735	/nfs/dbraw/zinc/89/67/35/265896735.db2.gz	ZFLGTUUYXSHLLY-FQEVSTJZSA-N	1	0	290.410	4.013	20	30		CIEDRO
C=CC[NH+](CC=C)Cc1ccc(-c2ccccc2C#N)cc1	ZINC000514129122	265994462	/nfs/dbraw/zinc/99/44/62/265994462.db2.gz	SDLGFWSJMCYMMG-UHFFFAOYSA-N	1	0	288.394	4.399	20	30		CIEDRO
C=CCSCC[NH2+][C@H]1CCCOc2c(Cl)cccc21	ZINC000358022218	266399731	/nfs/dbraw/zinc/39/97/31/266399731.db2.gz	ILUHFCVEYBAIOY-AWEZNQCLSA-N	1	0	297.851	4.063	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H]1CCCOc2ccc(Cl)cc21	ZINC000358046690	266405146	/nfs/dbraw/zinc/40/51/46/266405146.db2.gz	ZXVOEJIZCBYQEM-SMDDNHRTSA-N	1	0	265.784	4.108	20	30		CIEDRO
Cc1cc(C(F)(F)F)ccc1C[NH2+][C@@H]1CCC[C@@H](C#N)C1	ZINC000193335123	266667830	/nfs/dbraw/zinc/66/78/30/266667830.db2.gz	WPMWZZGYSIXZTO-IUODEOHRSA-N	1	0	296.336	4.186	20	30		CIEDRO
CC(C)(CCC#N)C[N@@H+]1CCC[C@H]1c1ccc(F)c(F)c1	ZINC000367460724	267091240	/nfs/dbraw/zinc/09/12/40/267091240.db2.gz	IAEHZSLGADXQST-INIZCTEOSA-N	1	0	292.373	4.432	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H]1CCC[C@H]1c1ccccc1	ZINC000367898257	267125661	/nfs/dbraw/zinc/12/56/61/267125661.db2.gz	FDNBNIJCMRDFLQ-IRXDYDNUSA-N	1	0	270.420	4.242	20	30		CIEDRO
C[C@H]([NH2+]CCCCC#N)c1ccc(-c2ccncc2)cc1	ZINC000118965809	267281797	/nfs/dbraw/zinc/28/17/97/267281797.db2.gz	RJHPDIBLLWAECB-HNNXBMFYSA-N	1	0	279.387	4.093	20	30		CIEDRO
COc1ccc(C2=CC[N@H+](CCCC(C)(C)C#N)CC2)cc1	ZINC000370002609	267283081	/nfs/dbraw/zinc/28/30/81/267283081.db2.gz	QUVUCMNBAQJTSN-UHFFFAOYSA-N	1	0	298.430	4.114	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CCS[C@@H](c2ccccc2)C1	ZINC000370002538	267283276	/nfs/dbraw/zinc/28/32/76/267283276.db2.gz	QBKIAKJCFKSQJA-MRXNPFEDSA-N	1	0	288.460	4.106	20	30		CIEDRO
N#CCCC[N@@H+]1CCc2ccccc2[C@@H]1Cc1ccccc1	ZINC000119137585	267303305	/nfs/dbraw/zinc/30/33/05/267303305.db2.gz	NNWZREFOOIWDEJ-FQEVSTJZSA-N	1	0	290.410	4.132	20	30		CIEDRO
C=C[C@H](C)[NH2+][C@H]1CCSc2ccc(Cl)cc21	ZINC000119333973	267322696	/nfs/dbraw/zinc/32/26/96/267322696.db2.gz	QTCZZFQRGFIHQS-CABZTGNLSA-N	1	0	253.798	4.041	20	30		CIEDRO
N#CCCCC[NH2+][C@H]1CCC[C@@H]1c1ccc(Cl)cc1	ZINC000370644959	267333743	/nfs/dbraw/zinc/33/37/43/267333743.db2.gz	SDCILAHAAPESKD-CVEARBPZSA-N	1	0	276.811	4.260	20	30		CIEDRO
N#CCCCC[NH2+][C@@H]1CCC[C@@H]1c1ccc(Cl)cc1	ZINC000370644961	267334069	/nfs/dbraw/zinc/33/40/69/267334069.db2.gz	SDCILAHAAPESKD-HZPDHXFCSA-N	1	0	276.811	4.260	20	30		CIEDRO
N#CCC1(C[NH2+][C@@H]2CC3(CCCC3)Oc3ccccc32)CC1	ZINC000370666805	267336063	/nfs/dbraw/zinc/33/60/63/267336063.db2.gz	IWQZABBYVCEBHQ-MRXNPFEDSA-N	1	0	296.414	4.106	20	30		CIEDRO
Cc1ccccc1-c1ccccc1C[NH2+]CC1(C#N)CCC1	ZINC000418144881	267366652	/nfs/dbraw/zinc/36/66/52/267366652.db2.gz	VKPRXLXRVRPRIK-UHFFFAOYSA-N	1	0	290.410	4.446	20	30		CIEDRO
Cc1cc(F)ccc1C[NH2+][C@@H]1CCCc2cc(C#N)ccc21	ZINC000418149503	267375185	/nfs/dbraw/zinc/37/51/85/267375185.db2.gz	VGYCMCKQGPTSSA-LJQANCHMSA-N	1	0	294.373	4.173	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccc(C#N)cc1F)c1ccc(C)cc1	ZINC000120126752	267384912	/nfs/dbraw/zinc/38/49/12/267384912.db2.gz	CENKZWQJYREAGM-GOSISDBHSA-N	1	0	282.362	4.247	20	30		CIEDRO
CC[C@H]([NH2+]Cc1cc(C#N)ccc1F)c1ccc(C)cc1	ZINC000120126905	267384982	/nfs/dbraw/zinc/38/49/82/267384982.db2.gz	RORLWPDGDWEYJI-SFHVURJKSA-N	1	0	282.362	4.247	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1cc(-c2ccncc2)ccc1OC	ZINC000466399447	327736993	/nfs/dbraw/zinc/73/69/93/327736993.db2.gz	NYSKYMLCVVXXDY-SFHVURJKSA-N	1	0	296.414	4.202	20	30		CIEDRO
COc1ccc2oc([C@@H](C)[NH2+]CCCCC#N)c(C)c2c1	ZINC000178646366	327795126	/nfs/dbraw/zinc/79/51/26/327795126.db2.gz	UYQMWVMJCXMXIV-CYBMUJFWSA-N	1	0	286.375	4.094	20	30		CIEDRO
C[C@H]([NH2+]CCCCC#N)c1ccc(SC(F)F)cc1	ZINC000178649056	327795479	/nfs/dbraw/zinc/79/54/79/327795479.db2.gz	SRKPAWOBPFOGPX-NSHDSACASA-N	1	0	284.375	4.346	20	30		CIEDRO
N#CCCCC[NH2+]Cc1cc(C(F)(F)F)ccc1Cl	ZINC000179009747	327797887	/nfs/dbraw/zinc/79/78/87/327797887.db2.gz	JHQGRCDUYOTUSX-UHFFFAOYSA-N	1	0	290.716	4.142	20	30		CIEDRO
C[C@H]([NH2+]CC1(c2ccc(F)cc2)CC1)c1cccc(C#N)c1	ZINC000181522080	327809679	/nfs/dbraw/zinc/80/96/79/327809679.db2.gz	KWJWWYOGARLHTK-AWEZNQCLSA-N	1	0	294.373	4.080	20	30		CIEDRO
C[C@H]([NH2+]CCCC(C)(C)C#N)c1cc2ccccc2o1	ZINC000182622222	327814286	/nfs/dbraw/zinc/81/42/86/327814286.db2.gz	XTTBHMPSVSMAAM-ZDUSSCGKSA-N	1	0	270.376	4.413	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1ccccc1Cl	ZINC000185755798	327844511	/nfs/dbraw/zinc/84/45/11/327844511.db2.gz	BWWIKVDEWFEDBC-AVGNSLFASA-N	1	0	262.784	4.073	20	30		CIEDRO
CC[NH+](CC)Cc1ccc(NCC(C)(C)CCC#N)cc1	ZINC000190381516	327870114	/nfs/dbraw/zinc/87/01/14/327870114.db2.gz	VBBPVQKOAZYHNG-UHFFFAOYSA-N	1	0	287.451	4.270	20	30		CIEDRO
C[C@H]([NH2+][C@@H](c1cccs1)C1CC1)c1cccc(C#N)c1	ZINC000540596953	327893790	/nfs/dbraw/zinc/89/37/90/327893790.db2.gz	IFLQBUXZNAYJHL-YVEFUNNKSA-N	1	0	282.412	4.422	20	30		CIEDRO
C=C(CC)C[NH2+][C@H](C)c1ccc(OC)c(Br)c1	ZINC000313532864	327924848	/nfs/dbraw/zinc/92/48/48/327924848.db2.gz	HTQPSZUZSIUZGA-LLVKDONJSA-N	1	0	298.224	4.075	20	30		CIEDRO
CC(C)Oc1ccc(C[NH2+][C@H](C)c2ccc(C#N)cc2)cc1	ZINC000124609616	327988205	/nfs/dbraw/zinc/98/82/05/327988205.db2.gz	NDJOYTKESIRMHC-OAHLLOKOSA-N	1	0	294.398	4.196	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+]CCc1c[nH]c2cccc(C)c12	ZINC000531704797	328026807	/nfs/dbraw/zinc/02/68/07/328026807.db2.gz	LZAGWTSKNSTDKF-DZGCQCFKSA-N	1	0	270.420	4.209	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+]CCc1c[nH]c2cccc(C)c12	ZINC000531704804	328026845	/nfs/dbraw/zinc/02/68/45/328026845.db2.gz	LZAGWTSKNSTDKF-ZFWWWQNUSA-N	1	0	270.420	4.209	20	30		CIEDRO
C=CC[C@@H](C)[C@@H](C)[NH2+]CCc1c[nH]c2cccc(C)c12	ZINC000531704803	328026897	/nfs/dbraw/zinc/02/68/97/328026897.db2.gz	LZAGWTSKNSTDKF-UKRRQHHQSA-N	1	0	270.420	4.209	20	30		CIEDRO
C[C@H](Cc1ccc(Cl)cc1)[N@H+](C)CCC(C)(C)C#N	ZINC000534217758	328039473	/nfs/dbraw/zinc/03/94/73/328039473.db2.gz	BJACTBPLUNUCOA-CYBMUJFWSA-N	1	0	278.827	4.143	20	30		CIEDRO
C/C(=C\c1ccccc1)C[NH2+]CC(C)(C)CCC#N	ZINC000571080953	328084760	/nfs/dbraw/zinc/08/47/60/328084760.db2.gz	DVUFXZYAFCDSRR-NTCAYCPXSA-N	1	0	256.393	4.009	20	30		CIEDRO
CC(C)(C)CC[NH2+]Cc1ccc(C#N)cc1C(F)(F)F	ZINC000571366957	328117100	/nfs/dbraw/zinc/11/71/00/328117100.db2.gz	XOWFKLMBGHXJPD-UHFFFAOYSA-N	1	0	284.325	4.103	20	30		CIEDRO
C=CCCCCC[NH2+][C@H](C)c1ccc(-n2ccnc2)cc1	ZINC000571496795	328127047	/nfs/dbraw/zinc/12/70/47/328127047.db2.gz	MQEOPMDLMBBWGK-MRXNPFEDSA-N	1	0	283.419	4.269	20	30		CIEDRO
C/C(=C/c1cccc(C(F)(F)F)c1)C[NH2+]CC1(C#N)CC1	ZINC000584343571	328128479	/nfs/dbraw/zinc/12/84/79/328128479.db2.gz	BTHGXEPWBQYLOO-GHXNOFRVSA-N	1	0	294.320	4.002	20	30		CIEDRO
C=CCC[C@@H]([NH2+][C@@H]1CCCC[C@H]1F)c1ccco1	ZINC000414309302	328154545	/nfs/dbraw/zinc/15/45/45/328154545.db2.gz	JGDCLECAZLCWKS-MGPQQGTHSA-N	1	0	251.345	4.157	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H]1C[C@H]1c1ccco1)c1ccco1	ZINC000414349721	328155753	/nfs/dbraw/zinc/15/57/53/328155753.db2.gz	PVUCIBHTPGZCTL-HZSPNIEDSA-N	1	0	257.333	4.026	20	30		CIEDRO
Cc1cc(C[NH2+]CC(C)(C)CCC#N)ccc1C(F)(F)F	ZINC000414444207	328171513	/nfs/dbraw/zinc/17/15/13/328171513.db2.gz	PBLYIYKYIGSOBB-UHFFFAOYSA-N	1	0	298.352	4.433	20	30		CIEDRO
Cc1ccccc1[C@@H]([NH2+]Cc1ccc(C#N)s1)C1CC1	ZINC000267142711	328173208	/nfs/dbraw/zinc/17/32/08/328173208.db2.gz	AAZGVTZDZFPCSR-KRWDZBQOSA-N	1	0	282.412	4.169	20	30		CIEDRO
Cc1ccc([C@@H](C)[NH2+]C2(c3cccc(C#N)c3)CC2)cc1	ZINC000272285216	328199737	/nfs/dbraw/zinc/19/97/37/328199737.db2.gz	PFFMTHRMEKOLMO-OAHLLOKOSA-N	1	0	276.383	4.207	20	30		CIEDRO
C[C@H](CCC#N)[NH+]1CCC(c2nc3ccccc3s2)CC1	ZINC000276346347	328217611	/nfs/dbraw/zinc/21/76/11/328217611.db2.gz	VFKMUYKUIUULMC-CYBMUJFWSA-N	1	0	299.443	4.168	20	30		CIEDRO
COc1ccc([C@@H](C)[N@H+](C)CCCCC(C)(C)C#N)cc1	ZINC000278123829	328223613	/nfs/dbraw/zinc/22/36/13/328223613.db2.gz	LYDQDBMJWUFCEA-OAHLLOKOSA-N	1	0	288.435	4.408	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH+]2Cc3ccccc3-c3ccccc3C2)C1	ZINC000278678338	328229345	/nfs/dbraw/zinc/22/93/45/328229345.db2.gz	RLCMOQCYVQBJHB-MAUKXSAKSA-N	1	0	288.394	4.361	20	30		CIEDRO
C=CCSCC[NH2+][C@@H]1C[C@H](C)Sc2sccc21	ZINC000221946962	329215835	/nfs/dbraw/zinc/21/58/35/329215835.db2.gz	RWPOEFSSIABIBQ-CMPLNLGQSA-N	1	0	285.503	4.182	20	30		CIEDRO
CC[C@H]([NH2+]CCCCC(C)(C)C#N)c1nc(C)cs1	ZINC000278856639	328231255	/nfs/dbraw/zinc/23/12/55/328231255.db2.gz	RTSIIVJCAZERAF-ZDUSSCGKSA-N	1	0	279.453	4.212	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](CCCC#N)c1ccccc1)c1ccc(F)cn1	ZINC000340430908	328276684	/nfs/dbraw/zinc/27/66/84/328276684.db2.gz	IGRYFIYAIOWTRL-KDOFPFPSSA-N	1	0	297.377	4.306	20	30		CIEDRO
C[C@@H]1CCC[C@H]1[NH2+][C@H](CCCC#N)c1ccccc1	ZINC000340444347	328278276	/nfs/dbraw/zinc/27/82/76/328278276.db2.gz	DGRBIXXGFGBLTE-DJIMGWMZSA-N	1	0	256.393	4.200	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@H]2c2ccc(F)cc2)C1	ZINC000294910330	328283769	/nfs/dbraw/zinc/28/37/69/328283769.db2.gz	ACEJDDLJLNAUES-XDKFSHSGSA-N	1	0	286.394	4.134	20	30		CIEDRO
CC[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1cccc(Cl)c1	ZINC000295847839	328287320	/nfs/dbraw/zinc/28/73/20/328287320.db2.gz	AUUDIWVZHSVQIP-VBNZEHGJSA-N	1	0	276.811	4.463	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1cccc(OC(F)F)c1	ZINC000296488717	328290820	/nfs/dbraw/zinc/29/08/20/328290820.db2.gz	OPFVVYBFGUFVLP-OBJOEFQTSA-N	1	0	294.345	4.021	20	30		CIEDRO
CC[C@H](C)[N@H+](CCC(C)(C)C#N)Cc1ccccc1	ZINC000395693469	329300125	/nfs/dbraw/zinc/30/01/25/329300125.db2.gz	CKDSGBDZCRSTGO-HNNXBMFYSA-N	1	0	258.409	4.227	20	30		CIEDRO
C[C@@H]([NH2+]CCCCC#N)c1ccc(Oc2ccccc2)cn1	ZINC000297890859	328294918	/nfs/dbraw/zinc/29/49/18/328294918.db2.gz	VPASIRRAWZSEPC-OAHLLOKOSA-N	1	0	295.386	4.218	20	30		CIEDRO
C=C(C)C[N@@H+]1CCCC[C@H]1c1cc2ccccc2[nH]1	ZINC000303303408	328331043	/nfs/dbraw/zinc/33/10/43/328331043.db2.gz	DBPRBUMQTPNNNA-KRWDZBQOSA-N	1	0	254.377	4.271	20	30		CIEDRO
CCCC(C)(C)[NH2+]Cc1cccc(OCCCC#N)c1	ZINC000111387331	328353807	/nfs/dbraw/zinc/35/38/07/328353807.db2.gz	AYRCKFNTUCEKHJ-UHFFFAOYSA-N	1	0	274.408	4.037	20	30		CIEDRO
CC[C@@H](Cc1ccccc1)[N@H+](C)Cc1cc(C#N)ccc1F	ZINC000303847510	328360848	/nfs/dbraw/zinc/36/08/48/328360848.db2.gz	CURVBVQDGGFZKD-SFHVURJKSA-N	1	0	296.389	4.150	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H](C)c1cccc(C#N)c1)c1cccs1	ZINC000049529577	328368106	/nfs/dbraw/zinc/36/81/06/328368106.db2.gz	XOTZOKLOPIZLID-SWLSCSKDSA-N	1	0	270.401	4.422	20	30		CIEDRO
CC[C@H]([NH2+][C@H](C)c1cccc(C#N)c1)c1cccs1	ZINC000049529578	328368171	/nfs/dbraw/zinc/36/81/71/328368171.db2.gz	XOTZOKLOPIZLID-DOMZBBRYSA-N	1	0	270.401	4.422	20	30		CIEDRO
C[N@H+](Cc1cc(C#N)cs1)[C@H]1CCCc2ccccc21	ZINC000535068538	328383707	/nfs/dbraw/zinc/38/37/07/328383707.db2.gz	LPSKTBONXOOVRV-KRWDZBQOSA-N	1	0	282.412	4.129	20	30		CIEDRO
C[N@H+](Cc1cc(C#N)cs1)[C@@H]1CCCc2ccccc21	ZINC000535068548	328383731	/nfs/dbraw/zinc/38/37/31/328383731.db2.gz	LPSKTBONXOOVRV-QGZVFWFLSA-N	1	0	282.412	4.129	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCc1ccccc1)c1ccco1	ZINC000530506037	326820680	/nfs/dbraw/zinc/82/06/80/326820680.db2.gz	ZFEYKPIOWTVUQK-INIZCTEOSA-N	1	0	255.361	4.119	20	30		CIEDRO
Cc1cccc(C2([NH2+]CCC(C)(C)C#N)CCCC2)c1	ZINC000538465987	326887426	/nfs/dbraw/zinc/88/74/26/326887426.db2.gz	ACZNMSCEXIBODF-UHFFFAOYSA-N	1	0	270.420	4.294	20	30		CIEDRO
C=CCCC[C@H](C)[NH+]1CCC(F)(c2cccnc2)CC1	ZINC000556545516	326950240	/nfs/dbraw/zinc/95/02/40/326950240.db2.gz	LUHRFJSLCMURRP-HNNXBMFYSA-N	1	0	276.399	4.087	20	30		CIEDRO
CC(C)c1ccc2c(c1)[C@@H]([NH2+]C[C@@H](C#N)CCC#N)CCC2	ZINC000556579998	326951363	/nfs/dbraw/zinc/95/13/63/326951363.db2.gz	AHGZWPJDKMCBLN-BEFAXECRSA-N	1	0	295.430	4.221	20	30		CIEDRO
C[C@H](CCc1ccccc1)[NH2+]C1(c2cccc(C#N)c2)CC1	ZINC000556605939	326953270	/nfs/dbraw/zinc/95/32/70/326953270.db2.gz	NMDKORLVYGYKQC-MRXNPFEDSA-N	1	0	290.410	4.158	20	30		CIEDRO
CC(C)[C@H](C[NH2+][C@@H]1CC[C@@H](C#N)C1)c1ccc(Cl)cc1	ZINC000556924316	326983573	/nfs/dbraw/zinc/98/35/73/326983573.db2.gz	QUOLXLCOXLMPKJ-XYPHTWIQSA-N	1	0	290.838	4.361	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@@H](C)[C@@H](OC)c1ccccc1F	ZINC000539510330	326992280	/nfs/dbraw/zinc/99/22/80/326992280.db2.gz	WRUMAYZARNLFPE-GRDNDAEWSA-N	1	0	279.399	4.236	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@@H](C)[C@H](OC)c1ccccc1F	ZINC000539510333	326992332	/nfs/dbraw/zinc/99/23/32/326992332.db2.gz	WRUMAYZARNLFPE-ZQIUZPCESA-N	1	0	279.399	4.236	20	30		CIEDRO
CC[C@H](CC#N)[NH2+]Cc1ccc(Cl)c2ccccc12	ZINC000576886567	327047149	/nfs/dbraw/zinc/04/71/49/327047149.db2.gz	YTTUTOAWNZONKB-CYBMUJFWSA-N	1	0	272.779	4.275	20	30		CIEDRO
Cc1cccc(CC[C@H](C)[NH2+]CC(C)(C)CCC#N)c1	ZINC000558238788	327081056	/nfs/dbraw/zinc/08/10/56/327081056.db2.gz	KJPHHENURZVINK-INIZCTEOSA-N	1	0	272.436	4.236	20	30		CIEDRO
C[C@H]([NH2+]CC(C)(C)CCC#N)c1ccc(Cl)c(F)c1	ZINC000558244741	327081164	/nfs/dbraw/zinc/08/11/64/327081164.db2.gz	CATOIFSTKPWUJM-NSHDSACASA-N	1	0	282.790	4.460	20	30		CIEDRO
C=CCCC[N@@H+](C)Cc1cscc1C(F)(F)F	ZINC000558565741	327105694	/nfs/dbraw/zinc/10/56/94/327105694.db2.gz	BTLDYCKKCOMEFE-UHFFFAOYSA-N	1	0	263.328	4.165	20	30		CIEDRO
C[C@H](C#N)C[NH2+][C@@H]1CCC[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000558682884	327113720	/nfs/dbraw/zinc/11/37/20/327113720.db2.gz	QBJBMWGHMLBRJK-IFUGULHKSA-N	1	0	297.229	4.379	20	30		CIEDRO
C[C@H](C#N)C[NH2+][C@H]1CCC[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000558682883	327113767	/nfs/dbraw/zinc/11/37/67/327113767.db2.gz	QBJBMWGHMLBRJK-HCKVZZMMSA-N	1	0	297.229	4.379	20	30		CIEDRO
C=CCCC[N@H+]1CC[C@@H](C(F)(F)F)C2(CCC2)C1	ZINC000558740242	327118639	/nfs/dbraw/zinc/11/86/39/327118639.db2.gz	DJGVAGVLSHLWDH-GFCCVEGCSA-N	1	0	261.331	4.007	20	30		CIEDRO
C[C@@H]([NH2+]CCCc1ccccc1Cl)c1ccc(C#N)cc1	ZINC000558742903	327118740	/nfs/dbraw/zinc/11/87/40/327118740.db2.gz	PAXIFTFSNWQOMB-CQSZACIVSA-N	1	0	298.817	4.495	20	30		CIEDRO
CSc1ccc([C@@H](C)[NH2+]Cc2cc(C#N)cs2)cc1	ZINC000093492267	327123702	/nfs/dbraw/zinc/12/37/02/327123702.db2.gz	NOLYDCBDPNEHSY-LLVKDONJSA-N	1	0	288.441	4.192	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+]CCc1nc(C)c(C)s1	ZINC000449198128	327128914	/nfs/dbraw/zinc/12/89/14/327128914.db2.gz	ZYXAWBGTHAESFG-GFCCVEGCSA-N	1	0	266.454	4.027	20	30		CIEDRO
CN(Cc1cccc(Cl)c1Cl)[C@@H]1CC[C@H](C#N)C1	ZINC000559037361	327138643	/nfs/dbraw/zinc/13/86/43/327138643.db2.gz	QMGMTRMUHUYWAH-CMPLNLGQSA-N	1	0	283.202	4.117	20	30		CIEDRO
CN(Cc1cccc(Cl)c1Cl)[C@H]1CC[C@H](C#N)C1	ZINC000559037362	327138826	/nfs/dbraw/zinc/13/88/26/327138826.db2.gz	QMGMTRMUHUYWAH-JQWIXIFHSA-N	1	0	283.202	4.117	20	30		CIEDRO
Cc1cccc(C)c1[C@H](C)[NH2+]C1CCC(C)(C#N)CC1	ZINC000449244898	327139542	/nfs/dbraw/zinc/13/95/42/327139542.db2.gz	WSATUOVKQCWQRB-HJOIGYKYSA-N	1	0	270.420	4.427	20	30		CIEDRO
CC(C)[C@H](NC[C@@H](C#N)CCC#N)c1ccccc1Cl	ZINC000566115931	327139755	/nfs/dbraw/zinc/13/97/55/327139755.db2.gz	HMVDJXBFQLOTTK-CJNGLKHVSA-N	1	0	289.810	4.070	20	30		CIEDRO
CC(C)[C@H](CC(F)(F)F)[NH2+]C1CCC(C)(C#N)CC1	ZINC000449273770	327145840	/nfs/dbraw/zinc/14/58/40/327145840.db2.gz	ZUOFBGMUMYRCET-CPCZMJQVSA-N	1	0	276.346	4.025	20	30		CIEDRO
CC(C)(C#N)c1ccccc1C[NH+]1CCC(CCC#N)CC1	ZINC000566173959	327155565	/nfs/dbraw/zinc/15/55/65/327155565.db2.gz	RYUBDDRBWSGXMS-UHFFFAOYSA-N	1	0	295.430	4.004	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H]1CCC[C@@H](CCCC(=O)OC)C1	ZINC000559307305	327157770	/nfs/dbraw/zinc/15/77/70/327157770.db2.gz	PJBJTKNXVLOYJW-JKSUJKDBSA-N	1	0	295.467	4.080	20	30		CIEDRO
N#CCC1(C[NH2+][C@H]2CCCc3ccc(Cl)cc32)CC1	ZINC000559324914	327160005	/nfs/dbraw/zinc/16/00/05/327160005.db2.gz	IYAIRJKFQNWMBV-HNNXBMFYSA-N	1	0	274.795	4.001	20	30		CIEDRO
CC1(C)CCC[C@H]([NH2+][C@@H]2CCc3ccc(C#N)cc32)C1	ZINC000569396538	327172252	/nfs/dbraw/zinc/17/22/52/327172252.db2.gz	CLHMVUXRNGXQBN-DOTOQJQBSA-N	1	0	268.404	4.104	20	30		CIEDRO
CC(C)(C)c1ccc(CC[NH2+]CC2CCC(C#N)CC2)cc1	ZINC000518629648	327184482	/nfs/dbraw/zinc/18/44/82/327184482.db2.gz	PPPKDTYQXVBCDH-UHFFFAOYSA-N	1	0	298.474	4.446	20	30		CIEDRO
C=CC[N@@H+](Cc1ccc(OC)cc1)CC(C)(C)CCC#N	ZINC000092217571	327190177	/nfs/dbraw/zinc/19/01/77/327190177.db2.gz	DBWOFOOCHGJKSH-UHFFFAOYSA-N	1	0	286.419	4.013	20	30		CIEDRO
C[N@H+](CC#Cc1ccccc1Cl)C1CCC(F)(F)CC1	ZINC000554308876	327209355	/nfs/dbraw/zinc/20/93/55/327209355.db2.gz	HWNPMQSHKOZKKI-UHFFFAOYSA-N	1	0	297.776	4.201	20	30		CIEDRO
N#CCCCC[N@@H+](Cc1ccccc1C(F)(F)F)C1CC1	ZINC000102397571	327226831	/nfs/dbraw/zinc/22/68/31/327226831.db2.gz	FTUSLUJUDNIZGN-UHFFFAOYSA-N	1	0	296.336	4.364	20	30		CIEDRO
N#CCCCC[N@H+]1CCC[C@H]1c1ccccc1Cl	ZINC000102397638	327227042	/nfs/dbraw/zinc/22/70/42/327227042.db2.gz	GVKXOJIHLURWHH-HNNXBMFYSA-N	1	0	262.784	4.171	20	30		CIEDRO
CCC[C@@H]1CCCC[C@H]1[NH2+]C1CCC(C)(C#N)CC1	ZINC000577458834	327260772	/nfs/dbraw/zinc/26/07/72/327260772.db2.gz	AZHQQEJGAARZGX-KZYLPZIUSA-N	1	0	262.441	4.407	20	30		CIEDRO
C[C@@H]([NH2+]Cc1cccc(C#N)c1)C1CCCCCC1	ZINC000150045622	327264214	/nfs/dbraw/zinc/26/42/14/327264214.db2.gz	IVMGJXFYMMFILF-CQSZACIVSA-N	1	0	256.393	4.007	20	30		CIEDRO
CC(C)C1([NH2+][C@@H](C)c2ccc(C#N)cc2Cl)CC1	ZINC000559890726	327268217	/nfs/dbraw/zinc/26/82/17/327268217.db2.gz	ILLFZWYEIDDDPN-NSHDSACASA-N	1	0	262.784	4.051	20	30		CIEDRO
C=C(C)CN1CCC([NH2+][C@H](C)c2ccc(Cl)s2)CC1	ZINC000152966103	327300925	/nfs/dbraw/zinc/30/09/25/327300925.db2.gz	ITOLHQNLPPPHRZ-GFCCVEGCSA-N	1	0	298.883	4.093	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H](C)c1cncc(Br)c1	ZINC000574291841	327310443	/nfs/dbraw/zinc/31/04/43/327310443.db2.gz	FECWJKDDLWNBME-VXGBXAGGSA-N	1	0	297.240	4.240	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@@H](C)C(F)(F)F)c1ccco1	ZINC000560548674	327323276	/nfs/dbraw/zinc/32/32/76/327323276.db2.gz	RIEODENULZJARC-GHMZBOCLSA-N	1	0	261.287	4.075	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]Cc1ccc(OC)c(OC)c1Cl	ZINC000381833025	327326271	/nfs/dbraw/zinc/32/62/71/327326271.db2.gz	FJASNHZICKFJQZ-UHFFFAOYSA-N	1	0	297.826	4.049	20	30		CIEDRO
CC(C)[C@H]([NH2+]CCC#N)c1ccc(C(C)(C)C)cc1	ZINC000560846420	327348115	/nfs/dbraw/zinc/34/81/15/327348115.db2.gz	CLAMNMNZFDAXCW-INIZCTEOSA-N	1	0	258.409	4.184	20	30		CIEDRO
C=CCCCCC[NH+]1CCC(F)(c2cccnc2)CC1	ZINC000561293538	327382969	/nfs/dbraw/zinc/38/29/69/327382969.db2.gz	CWCMBMXFTNCIQB-UHFFFAOYSA-N	1	0	276.399	4.089	20	30		CIEDRO
C=CCCCCC[N@@H+](C)[C@@H](C)c1nnc(-c2ccccc2)o1	ZINC000150887634	327394737	/nfs/dbraw/zinc/39/47/37/327394737.db2.gz	NCMIKXDEEUMJFQ-HNNXBMFYSA-N	1	0	299.418	4.476	20	30		CIEDRO
C[C@@H]1C[C@@H]([NH2+]CC(C)(C)CCC#N)CC(C)(C)C1	ZINC000561443980	327395805	/nfs/dbraw/zinc/39/58/05/327395805.db2.gz	DHXIZPIIISDKGN-ZIAGYGMSSA-N	1	0	250.430	4.121	20	30		CIEDRO
N#Cc1cccc(CC[NH2+][C@H]2CCCCC23CCCC3)c1	ZINC000561485934	327398069	/nfs/dbraw/zinc/39/80/69/327398069.db2.gz	JJRZDGVCKSCGJH-SFHVURJKSA-N	1	0	282.431	4.193	20	30		CIEDRO
C=CCCCC[NH2+]C1CC(c2cc(F)cc(F)c2)C1	ZINC000561955003	327434127	/nfs/dbraw/zinc/43/41/27/327434127.db2.gz	SUKPRQRLZWGBOL-UHFFFAOYSA-N	1	0	265.347	4.157	20	30		CIEDRO
Cc1ccc2c(c1)[C@@H]([NH2+]CC(C)(C)CCC#N)[C@H](C)C2	ZINC000562044507	327443050	/nfs/dbraw/zinc/44/30/50/327443050.db2.gz	FWZRULVWRIHBJC-PBHICJAKSA-N	1	0	270.420	4.148	20	30		CIEDRO
Cc1ccc2c(c1)[C@@H]([NH2+]CC(C)(C)CCC#N)[C@@H](C)C2	ZINC000562044510	327443051	/nfs/dbraw/zinc/44/30/51/327443051.db2.gz	FWZRULVWRIHBJC-YOEHRIQHSA-N	1	0	270.420	4.148	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC1(C)C)c1ccc(C#N)cc1Cl	ZINC000562056424	327444900	/nfs/dbraw/zinc/44/49/00/327444900.db2.gz	HOAKXVQNMVKJIY-IINYFYTJSA-N	1	0	262.784	4.051	20	30		CIEDRO
CC[C@H]1CC[C@H]1[NH2+]C1CCC(Oc2ccccc2C#N)CC1	ZINC000562059931	327445801	/nfs/dbraw/zinc/44/58/01/327445801.db2.gz	RMUOGUCWAFUAMC-IWCVFHTOSA-N	1	0	298.430	4.026	20	30		CIEDRO
CC(C)(C)[C@@H]1CCC[C@H]([NH2+]CC(C)(C)C#N)CC1	ZINC000168934529	327493548	/nfs/dbraw/zinc/49/35/48/327493548.db2.gz	XNKQOCDQYHJMCV-KGLIPLIRSA-N	1	0	250.430	4.121	20	30		CIEDRO
C[C@@H]([NH2+]CC(C)(C)CC#N)c1ccc(Cl)c(F)c1	ZINC000562738377	327511216	/nfs/dbraw/zinc/51/12/16/327511216.db2.gz	PKQRAFFNQLXJOB-SNVBAGLBSA-N	1	0	268.763	4.070	20	30		CIEDRO
N#CCCC[C@@H]([NH2+]Cc1ccc(Cl)cn1)c1ccccc1	ZINC000569999097	327561278	/nfs/dbraw/zinc/56/12/78/327561278.db2.gz	PLHIQEJUEKCZHJ-QGZVFWFLSA-N	1	0	299.805	4.260	20	30		CIEDRO
C=CCCCCC[NH2+]Cc1conc1Cc1ccccc1	ZINC000583641219	328725057	/nfs/dbraw/zinc/72/50/57/328725057.db2.gz	ILTQUQYFURYGMP-UHFFFAOYSA-N	1	0	284.403	4.101	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+]Cc1ccc(-c2ccncc2)cc1	ZINC000532516893	328785794	/nfs/dbraw/zinc/78/57/94/328785794.db2.gz	JZMHJWMPQNRDKV-HOTGVXAUSA-N	1	0	280.415	4.439	20	30		CIEDRO
C=C(C)C[N@@H+]1CCC[C@H]1c1nc(-c2ccccc2)c(C)[nH]1	ZINC000377282501	329009690	/nfs/dbraw/zinc/00/96/90/329009690.db2.gz	GJHGHFKAMUICFD-INIZCTEOSA-N	1	0	281.403	4.098	20	30		CIEDRO
CCCOc1ccc([C@H](C)[NH2+]Cc2cccc(C#N)c2)cc1	ZINC000193871476	329062303	/nfs/dbraw/zinc/06/23/03/329062303.db2.gz	MJTLNYKKAOPBQM-HNNXBMFYSA-N	1	0	294.398	4.198	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)cc1F)[C@@H]1CC2CCC1CC2	ZINC000394518538	329124802	/nfs/dbraw/zinc/12/48/02/329124802.db2.gz	SFUDAXWOBRZFMO-JDDSVCBVSA-N	1	0	286.394	4.002	20	30		CIEDRO
Cc1cc(Cl)c2c(c1)[C@H]([NH2+]CCCCC#N)CCCO2	ZINC000178275990	329195491	/nfs/dbraw/zinc/19/54/91/329195491.db2.gz	ZQPOHZGWUKOVOU-OAHLLOKOSA-N	1	0	292.810	4.146	20	30		CIEDRO
C[N@H+](Cc1ccc(C#N)cc1)Cc1ccc(C(F)F)cc1	ZINC000183920546	329254475	/nfs/dbraw/zinc/25/44/75/329254475.db2.gz	VFTTTZVIZKUTTN-UHFFFAOYSA-N	1	0	286.325	4.128	20	30		CIEDRO
C[C@@H](C[NH+]1CCC(CCC#N)CC1)c1cc(F)cc(F)c1	ZINC000582905931	329284677	/nfs/dbraw/zinc/28/46/77/329284677.db2.gz	DAARLJJZDBMDLR-ZDUSSCGKSA-N	1	0	292.373	4.084	20	30		CIEDRO
C[C@H](c1ccc(C#N)cc1)[N@@H+]1CC[C@@](F)(c2ccccc2)C1	ZINC000583036811	329306308	/nfs/dbraw/zinc/30/63/08/329306308.db2.gz	UDPALGMERDEGRB-BEFAXECRSA-N	1	0	294.373	4.190	20	30		CIEDRO
C[C@@H](c1ccc(C#N)cc1)[N@@H+]1CC[C@](F)(c2ccccc2)C1	ZINC000583036813	329306328	/nfs/dbraw/zinc/30/63/28/329306328.db2.gz	UDPALGMERDEGRB-HNAYVOBHSA-N	1	0	294.373	4.190	20	30		CIEDRO
Cc1c(C[NH2+][C@H]2CCC[C@@H](C#N)C2)oc2ccc(F)cc12	ZINC000185842493	329330181	/nfs/dbraw/zinc/33/01/81/329330181.db2.gz	VJYGCPZNWIVRNU-OCCSQVGLSA-N	1	0	286.350	4.052	20	30		CIEDRO
N#CCC1CC[NH+](Cc2csc3ccccc23)CC1	ZINC000397384494	329351280	/nfs/dbraw/zinc/35/12/80/329351280.db2.gz	ONMLVECGZAALQW-UHFFFAOYSA-N	1	0	270.401	4.027	20	30		CIEDRO
C[C@@H]([NH2+][C@H](CCC#N)c1ccccc1)C1CCSCC1	ZINC000187387157	329356873	/nfs/dbraw/zinc/35/68/73/329356873.db2.gz	MWAPLPTWGKNABB-RHSMWYFYSA-N	1	0	288.460	4.153	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](CCC#N)c1ccccc1)C1CCSCC1	ZINC000187387121	329356932	/nfs/dbraw/zinc/35/69/32/329356932.db2.gz	MWAPLPTWGKNABB-PBHICJAKSA-N	1	0	288.460	4.153	20	30		CIEDRO
CC[C@H]([NH2+]CC(C)(C)CCC#N)c1cccs1	ZINC000229693385	329356936	/nfs/dbraw/zinc/35/69/36/329356936.db2.gz	ILDOIGIOABUPPA-LBPRGKRZSA-N	1	0	250.411	4.119	20	30		CIEDRO
CC(C)(C)c1ccc(C[NH2+]CC(C)(C)CC#N)s1	ZINC000459727584	329372546	/nfs/dbraw/zinc/37/25/46/329372546.db2.gz	HHRTZXHOPJKZKC-UHFFFAOYSA-N	1	0	264.438	4.075	20	30		CIEDRO
C[C@@H](Cc1ccccc1C(F)(F)F)[NH2+]CC(C)(C)CC#N	ZINC000459728271	329373500	/nfs/dbraw/zinc/37/35/00/329373500.db2.gz	ILAVMMQURBTMOU-LBPRGKRZSA-N	1	0	298.352	4.166	20	30		CIEDRO
C[C@H](C[NH2+]CC(C)(C)CC#N)c1ccc(C(F)(F)F)cc1	ZINC000459737020	329376070	/nfs/dbraw/zinc/37/60/70/329376070.db2.gz	VKIHNUINZSWHOE-GFCCVEGCSA-N	1	0	298.352	4.338	20	30		CIEDRO
N#CCC[C@H]([NH2+][C@@H]1CCC12CCCC2)c1ccccc1	ZINC000189179707	329376608	/nfs/dbraw/zinc/37/66/08/329376608.db2.gz	ICEKWPOOLJFDGA-DLBZAZTESA-N	1	0	268.404	4.344	20	30		CIEDRO
Cc1cccc2c1OCC[C@H]2[NH2+][C@H](C)c1ccc(C#N)s1	ZINC000189364969	329380098	/nfs/dbraw/zinc/38/00/98/329380098.db2.gz	AZEGLNWQCJCEHK-IUODEOHRSA-N	1	0	298.411	4.103	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](CC(F)(F)F)c1ccc(F)cc1	ZINC000509021858	332856206	/nfs/dbraw/zinc/85/62/06/332856206.db2.gz	MRFYFJDEEBBDQR-ZDUSSCGKSA-N	1	0	275.289	4.375	20	30		CIEDRO
N#CCc1ccc(C[N@@H+]2CCCC[C@H]2c2ccccc2)cc1	ZINC000583237090	329387154	/nfs/dbraw/zinc/38/71/54/329387154.db2.gz	XPZSAQIAQBSFLE-FQEVSTJZSA-N	1	0	290.410	4.480	20	30		CIEDRO
Cc1cccc2nc(C3CC[NH+](CCCCC#N)CC3)oc21	ZINC000189810467	329389260	/nfs/dbraw/zinc/38/92/60/329389260.db2.gz	SLDHYRWYSSQNOF-UHFFFAOYSA-N	1	0	297.402	4.010	20	30		CIEDRO
C[C@H](C#N)C[NH2+][C@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1	ZINC000583242202	329393369	/nfs/dbraw/zinc/39/33/69/329393369.db2.gz	LJHOSAOWFQCFOJ-KYOSRNDESA-N	1	0	296.336	4.091	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@H](C)c1cnc2ccsc2c1	ZINC000393771795	329395945	/nfs/dbraw/zinc/39/59/45/329395945.db2.gz	BJUTXKUFLKECTQ-YPMHNXCESA-N	1	0	260.406	4.302	20	30		CIEDRO
C=CCCC[NH2+][C@H](C)c1cccc(C(F)(F)F)c1	ZINC000301727663	332857288	/nfs/dbraw/zinc/85/72/88/332857288.db2.gz	JSZDJZVACOOMNX-LLVKDONJSA-N	1	0	257.299	4.322	20	30		CIEDRO
C[C@@H]1C[C@@]1([NH2+]CCC(C)(C)C#N)c1ccc(Cl)cc1	ZINC000503410440	329422276	/nfs/dbraw/zinc/42/22/76/329422276.db2.gz	AVUDAWHFWJCZCL-WBMJQRKESA-N	1	0	276.811	4.105	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1	ZINC000398077276	329431298	/nfs/dbraw/zinc/43/12/98/329431298.db2.gz	PIMTZFREDQQLBE-KBPBESRZSA-N	1	0	276.380	4.299	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1	ZINC000398077281	329431340	/nfs/dbraw/zinc/43/13/40/329431340.db2.gz	PIMTZFREDQQLBE-ZIAGYGMSSA-N	1	0	276.380	4.299	20	30		CIEDRO
CC[C@H]1CC[C@H]([NH2+][C@H](C)c2ccc(C#N)c(F)c2)CC1	ZINC000572017703	329937997	/nfs/dbraw/zinc/93/79/97/329937997.db2.gz	IJEROXPKVKFZQS-XJKCOSOUSA-N	1	0	274.383	4.317	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccc(COC)o1)c1ccccc1	ZINC000269357217	330068275	/nfs/dbraw/zinc/06/82/75/330068275.db2.gz	NGMGBODTCACDDH-GOSISDBHSA-N	1	0	285.387	4.223	20	30		CIEDRO
CC(C)C[C@@H]([NH2+]Cc1cccc(C#N)c1)c1cccs1	ZINC000079932607	330071849	/nfs/dbraw/zinc/07/18/49/330071849.db2.gz	YSXOMCCIDJMUND-MRXNPFEDSA-N	1	0	284.428	4.497	20	30		CIEDRO
C#CC[C@H]([NH2+][C@H](C)c1ccc(OC)cc1)c1ccccc1	ZINC000271414591	330079779	/nfs/dbraw/zinc/07/97/79/330079779.db2.gz	BAZVWBGAXOTITH-BEFAXECRSA-N	1	0	279.383	4.110	20	30		CIEDRO
C#CC[C@H]([NH2+][C@H]1CCCc2nc(C)sc21)c1ccccc1	ZINC000271454739	330079935	/nfs/dbraw/zinc/07/99/35/330079935.db2.gz	GQDGXFCLJNSSIW-RDJZCZTQSA-N	1	0	296.439	4.183	20	30		CIEDRO
C#CC[C@H]([NH2+][C@@H]1CCc2ccccc21)c1ccccc1	ZINC000271556031	330081415	/nfs/dbraw/zinc/08/14/15/330081415.db2.gz	SSGSQBLCUZGVPK-RBUKOAKNSA-N	1	0	261.368	4.028	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](C)c1ccncc1Cl	ZINC000421832332	330091096	/nfs/dbraw/zinc/09/10/96/330091096.db2.gz	GQUHVWTVYIUFPT-RYUDHWBXSA-N	1	0	252.789	4.130	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@H](C)c1cc(C)ccc1O)c1ccccc1	ZINC000273472115	330093120	/nfs/dbraw/zinc/09/31/20/330093120.db2.gz	JUKQPRUUOBOYGV-CRAIPNDOSA-N	1	0	279.383	4.116	20	30		CIEDRO
CC(C)CC[C@H]([NH2+]Cc1ccc(C#N)s1)c1ccoc1	ZINC000421848872	330095712	/nfs/dbraw/zinc/09/57/12/330095712.db2.gz	ARAKDGICEJWVGB-INIZCTEOSA-N	1	0	288.416	4.480	20	30		CIEDRO
C#CC[C@H]([NH2+][C@H](C)c1ccc(C)cc1O)c1ccccc1	ZINC000273545329	330096984	/nfs/dbraw/zinc/09/69/84/330096984.db2.gz	ZDZKJGGXZOTPKS-QAPCUYQASA-N	1	0	279.383	4.116	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@@H](C)c1sccc1OC)c1ccccc1	ZINC000274568913	330106332	/nfs/dbraw/zinc/10/63/32/330106332.db2.gz	IKWNLXZTWWVIDX-DZGCQCFKSA-N	1	0	285.412	4.172	20	30		CIEDRO
C#CC[C@H]([NH2+][C@@H](CC)c1ccccc1O)c1ccccc1	ZINC000274761908	330107896	/nfs/dbraw/zinc/10/78/96/330107896.db2.gz	KKOCTBXLKKWJGP-ROUUACIJSA-N	1	0	279.383	4.198	20	30		CIEDRO
C=CCCC[NH2+][C@H](C)c1nc2ccccc2n1C(F)F	ZINC000275486556	330110067	/nfs/dbraw/zinc/11/00/67/330110067.db2.gz	RQBVVNKGPLMUTF-LLVKDONJSA-N	1	0	279.334	4.048	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccc(F)cc1)c1ccco1	ZINC000276433676	330113530	/nfs/dbraw/zinc/11/35/30/330113530.db2.gz	JDTJTCOMFBFWMB-OAHLLOKOSA-N	1	0	259.324	4.216	20	30		CIEDRO
C#CC[C@H]([NH2+][C@@H](C)c1cc(C)oc1C)c1ccccc1	ZINC000278712675	330119670	/nfs/dbraw/zinc/11/96/70/330119670.db2.gz	LSRWXLRSLGWIFD-KSSFIOAISA-N	1	0	267.372	4.312	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@@H]1CCCc2occc21)c1ccccc1	ZINC000278762818	330119999	/nfs/dbraw/zinc/11/99/99/330119999.db2.gz	OTUWMMKNMVNFHV-IAGOWNOFSA-N	1	0	265.356	4.011	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@H](C)c1c(C)noc1C)c1ccco1	ZINC000279138510	330121761	/nfs/dbraw/zinc/12/17/61/330121761.db2.gz	YXOQVZQSBPWBTR-SWLSCSKDSA-N	1	0	288.391	4.285	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@@H](C)c1cc(C)oc1C)c1ccccc1	ZINC000278712668	330122498	/nfs/dbraw/zinc/12/24/98/330122498.db2.gz	LSRWXLRSLGWIFD-KBXCAEBGSA-N	1	0	267.372	4.312	20	30		CIEDRO
Cc1nc(CC[NH2+][C@H](CCCC#N)c2ccccc2)cs1	ZINC000433021267	330124474	/nfs/dbraw/zinc/12/44/74/330124474.db2.gz	FRRNSLBCKYYSMS-QGZVFWFLSA-N	1	0	299.443	4.019	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+][C@@H]1CC(C)(C)Oc2ccc(N)cc21	ZINC000423438841	330201583	/nfs/dbraw/zinc/20/15/83/330201583.db2.gz	NNIQXXVUHNEFJE-WOSRLPQWSA-N	1	0	288.435	4.061	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+][C@H]1CC(C)(C)Oc2ccc(N)cc21	ZINC000423449087	330202702	/nfs/dbraw/zinc/20/27/02/330202702.db2.gz	WAAYIGDKBUQDHP-ZBFHGGJFSA-N	1	0	288.435	4.205	20	30		CIEDRO
C[C@@H](CCSc1ccccc1)[N@H+](C)CC(C)(C)C#N	ZINC000433285284	330215925	/nfs/dbraw/zinc/21/59/25/330215925.db2.gz	HLSUAGTXXAPBAM-AWEZNQCLSA-N	1	0	276.449	4.039	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCCC(C)(C)C1)c1ccc(C#N)cc1F	ZINC000527196563	330234626	/nfs/dbraw/zinc/23/46/26/330234626.db2.gz	ITKHRHGBADWXNM-GXTWGEPZSA-N	1	0	274.383	4.317	20	30		CIEDRO
Cc1cc(C)c(C[NH2+][C@H](C)c2ccc(C#N)cc2)cc1C	ZINC000035256392	330244700	/nfs/dbraw/zinc/24/47/00/330244700.db2.gz	BIGUYMFHXUGAIM-MRXNPFEDSA-N	1	0	278.399	4.334	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)c1cccc(OC(F)(F)F)c1	ZINC000536855848	330252025	/nfs/dbraw/zinc/25/20/25/330252025.db2.gz	CGWXNKNIFYBABB-QWRGUYRKSA-N	1	0	273.298	4.200	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)c1ccc(OCCCC)c(OC)c1	ZINC000536858876	330252448	/nfs/dbraw/zinc/25/24/48/330252448.db2.gz	RTHJADCQGBNBAH-GJZGRUSLSA-N	1	0	291.435	4.489	20	30		CIEDRO
C[C@@H]([NH2+]CCSCc1ccccc1C#N)c1ccccc1	ZINC000536864543	330253612	/nfs/dbraw/zinc/25/36/12/330253612.db2.gz	TUFXAXPVUIYFTL-OAHLLOKOSA-N	1	0	296.439	4.142	20	30		CIEDRO
C[C@H]([NH2+]CCSCc1ccccc1C#N)c1ccccc1	ZINC000536864530	330253615	/nfs/dbraw/zinc/25/36/15/330253615.db2.gz	TUFXAXPVUIYFTL-HNNXBMFYSA-N	1	0	296.439	4.142	20	30		CIEDRO
C[C@H]1C[C@@H](c2ccccc2)[N@H+](CC(C)(C)CCC#N)C1	ZINC000580483919	330256617	/nfs/dbraw/zinc/25/66/17/330256617.db2.gz	WJIOLSDVDZEBDH-RDJZCZTQSA-N	1	0	270.420	4.399	20	30		CIEDRO
Cc1ccc2c(c1)[C@H]([NH2+]CC1CCC(C#N)CC1)[C@H](C)C2	ZINC000580483906	330256622	/nfs/dbraw/zinc/25/66/22/330256622.db2.gz	WDMRIVNTEIFHPB-GKSFYBEXSA-N	1	0	282.431	4.148	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc(Cl)cc1	ZINC000424131034	330262224	/nfs/dbraw/zinc/26/22/24/330262224.db2.gz	ULRZYFUIDSGLHV-NILFDRSVSA-N	1	0	262.784	4.073	20	30		CIEDRO
CC1(C)CCC[C@@H]1CC[NH2+]C1CCC(C)(C#N)CC1	ZINC000527725675	330277551	/nfs/dbraw/zinc/27/75/51/330277551.db2.gz	AFCMBXWAFQLWJJ-HPUBIQBYSA-N	1	0	262.441	4.265	20	30		CIEDRO
C=CC(C)(C)CC[NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1	ZINC000527734301	330278708	/nfs/dbraw/zinc/27/87/08/330278708.db2.gz	IAUYIUGMNSNFOF-NWDGAFQWSA-N	1	0	263.347	4.299	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccc(C#N)o1)c1cc(C)ccc1C	ZINC000527817109	330285132	/nfs/dbraw/zinc/28/51/32/330285132.db2.gz	AHAUPMYHQYMJME-QGZVFWFLSA-N	1	0	268.360	4.009	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@@H](C)c1cccc2ccccc21	ZINC000424146303	330292753	/nfs/dbraw/zinc/29/27/53/330292753.db2.gz	WIKSNYJFDILABD-QOKNQOGYSA-N	1	0	281.399	4.082	20	30		CIEDRO
C=CC(C)(C)CC[NH2+]C1CCC(OC2CCCC2)CC1	ZINC000527925290	330296513	/nfs/dbraw/zinc/29/65/13/330296513.db2.gz	MENABUAEJNXZTO-UHFFFAOYSA-N	1	0	279.468	4.449	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](c1ccccn1)C1CCC1)c1ccc(C#N)cc1	ZINC000527962353	330300831	/nfs/dbraw/zinc/30/08/31/330300831.db2.gz	CNRLZWCHXPAYDJ-AUUYWEPGSA-N	1	0	291.398	4.145	20	30		CIEDRO
C=CCCCCC[N@@H+](C)[C@H](C)c1nc(-c2ccccc2)no1	ZINC000532967353	330323478	/nfs/dbraw/zinc/32/34/78/330323478.db2.gz	NGBZFVIQVGFAOU-OAHLLOKOSA-N	1	0	299.418	4.476	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@@H]2CCC[C@H](C3CC3)C2)CC1	ZINC000424204520	330327616	/nfs/dbraw/zinc/32/76/16/330327616.db2.gz	MJTMJJYWRCTFTC-ORBLRFAASA-N	1	0	260.425	4.017	20	30		CIEDRO
C[C@@H]1C[C@@H]([NH2+][C@@H]2CC[C@H](C#N)C2)C[C@@H](c2ccccc2)C1	ZINC000424206373	330327704	/nfs/dbraw/zinc/32/77/04/330327704.db2.gz	WXPIDVLFBXHKNH-WAARBJQMSA-N	1	0	282.431	4.241	20	30		CIEDRO
C[C@@H]1C[C@@H]([NH2+][C@@H]2CC[C@H](C#N)C2)C[C@H](c2ccccc2)C1	ZINC000424206370	330327738	/nfs/dbraw/zinc/32/77/38/330327738.db2.gz	WXPIDVLFBXHKNH-BHEBFOIGSA-N	1	0	282.431	4.241	20	30		CIEDRO
CC[C@@H](CSc1ccccc1)[NH2+]Cc1cccc(C#N)c1	ZINC000533104378	330337283	/nfs/dbraw/zinc/33/72/83/330337283.db2.gz	PAZZQSGZDREHST-KRWDZBQOSA-N	1	0	296.439	4.219	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@H]2CCC[C@H]2c2ccc(Cl)cc2)C1	ZINC000424321195	330340161	/nfs/dbraw/zinc/34/01/61/330340161.db2.gz	HBFBVZVVPAIFJI-IEAZIUSSSA-N	1	0	288.822	4.258	20	30		CIEDRO
CC(C)[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc(Cl)cc1F	ZINC000424324816	330341038	/nfs/dbraw/zinc/34/10/38/330341038.db2.gz	KEWHVXLIZFDWET-GHJWDPDVSA-N	1	0	294.801	4.458	20	30		CIEDRO
C[C@@H](CCc1ccc(Cl)s1)[NH2+][C@@H]1CC[C@H](C#N)C1	ZINC000424324536	330341095	/nfs/dbraw/zinc/34/10/95/330341095.db2.gz	KDBPJEVQIDAHKC-SDDRHHMPSA-N	1	0	282.840	4.004	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)C1	ZINC000424328279	330341664	/nfs/dbraw/zinc/34/16/64/330341664.db2.gz	NUDWGHQCYNSKAT-MORSLUCNSA-N	1	0	284.378	4.043	20	30		CIEDRO
CC(C)[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1cc2ccccc2o1	ZINC000424329097	330341800	/nfs/dbraw/zinc/34/18/00/330341800.db2.gz	OZFFMBRSGIZSGJ-JOQOYGCGSA-N	1	0	282.387	4.412	20	30		CIEDRO
CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)CCCO2	ZINC000424330132	330342117	/nfs/dbraw/zinc/34/21/17/330342117.db2.gz	QHZDZYSJLSJKRC-LESCRADOSA-N	1	0	298.430	4.306	20	30		CIEDRO
CC(C)[C@H](CSc1ccccc1)[NH2+][C@@H]1CC[C@H](C#N)C1	ZINC000424332267	330342617	/nfs/dbraw/zinc/34/26/17/330342617.db2.gz	SRLYNGWXGPXZSD-UXLLHSPISA-N	1	0	288.460	4.085	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@@H]2CCC[C@@H]2c2ccccc2Cl)C1	ZINC000424335022	330343278	/nfs/dbraw/zinc/34/32/78/330343278.db2.gz	WGQMVYDHSKVYMF-TZDHZFECSA-N	1	0	288.822	4.258	20	30		CIEDRO
Cc1cc(C)cc(C[C@H](C)[NH2+]Cc2ccc(C#N)cc2F)c1	ZINC000533309819	330357058	/nfs/dbraw/zinc/35/70/58/330357058.db2.gz	WKKSFQUGTASASC-HNNXBMFYSA-N	1	0	296.389	4.035	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccc2ccccc2n1)C1CC1	ZINC000533362177	330359847	/nfs/dbraw/zinc/35/98/47/330359847.db2.gz	JIWYCUQTXMJMPI-QGZVFWFLSA-N	1	0	266.388	4.069	20	30		CIEDRO
C=CC[C@H](C)[NH2+]Cc1csc(-c2ccc(F)cc2)n1	ZINC000116926695	330361519	/nfs/dbraw/zinc/36/15/19/330361519.db2.gz	DRHRFEHXVZWMRK-NSHDSACASA-N	1	0	276.380	4.003	20	30		CIEDRO
CC[N@H+](Cc1ccccc1OC)[C@H](C)c1ccc(C#N)cc1	ZINC000119874054	330381163	/nfs/dbraw/zinc/38/11/63/330381163.db2.gz	ZAWDMALLZOSIKY-OAHLLOKOSA-N	1	0	294.398	4.150	20	30		CIEDRO
CC[N@H+](CCCC(C)(C)C#N)[C@H]1CCCC[C@@H]1C	ZINC000120156421	330385926	/nfs/dbraw/zinc/38/59/26/330385926.db2.gz	HTFXNEWTECWHMZ-GJZGRUSLSA-N	1	0	250.430	4.217	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@H]1CCCO[C@@H]1c1ccccc1)C1CC1	ZINC000120493789	330388812	/nfs/dbraw/zinc/38/88/12/330388812.db2.gz	HPSVMZUUCIGJGT-HSALFYBXSA-N	1	0	299.458	4.489	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1cccc2cccnc21)C1CC1	ZINC000120677502	330390315	/nfs/dbraw/zinc/39/03/15/330390315.db2.gz	LQYXRFLYWPPCEJ-KRWDZBQOSA-N	1	0	266.388	4.069	20	30		CIEDRO
N#CCC[C@H]([NH2+][C@@H]1CCc2ccccc2C1)c1ccccc1	ZINC000090665354	330394567	/nfs/dbraw/zinc/39/45/67/330394567.db2.gz	TZRRIFBUGOGODD-UXHICEINSA-N	1	0	290.410	4.179	20	30		CIEDRO
N#CCC[C@@H]([NH2+][C@@H]1CCc2ccccc21)c1ccccc1	ZINC000090664823	330394568	/nfs/dbraw/zinc/39/45/68/330394568.db2.gz	FEGDXTXRNNAJAU-RTBURBONSA-N	1	0	276.383	4.309	20	30		CIEDRO
CC1CCC([NH2+][C@@H](CCC#N)c2ccccc2)CC1	ZINC000090665179	330394578	/nfs/dbraw/zinc/39/45/78/330394578.db2.gz	YHXABLBGIKHEFF-PREGVCBESA-N	1	0	256.393	4.200	20	30		CIEDRO
C[C@@H]1CCC[C@H]([NH2+][C@@H](CCC#N)c2ccccc2)C1	ZINC000090665535	330394629	/nfs/dbraw/zinc/39/46/29/330394629.db2.gz	IBJKGIWEPDFMQE-PVAVHDDUSA-N	1	0	256.393	4.200	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+][C@@H](CCC#N)c1ccccc1	ZINC000090665458	330394638	/nfs/dbraw/zinc/39/46/38/330394638.db2.gz	VJVFXKJWZFUVCH-SJORKVTESA-N	1	0	256.393	4.366	20	30		CIEDRO
N#CCC[C@@H]([NH2+][C@H]1CCc2ccccc2C1)c1ccccc1	ZINC000090665355	330394649	/nfs/dbraw/zinc/39/46/49/330394649.db2.gz	TZRRIFBUGOGODD-VQTJNVASSA-N	1	0	290.410	4.179	20	30		CIEDRO
C=C(C)C[NH2+][C@@H](C)c1ccc(OC2CCCC2)c(OC)c1	ZINC000537051085	330395127	/nfs/dbraw/zinc/39/51/27/330395127.db2.gz	JCKQHIZGJROZLP-AWEZNQCLSA-N	1	0	289.419	4.243	20	30		CIEDRO
C=CCCC[N@@H+](C)[C@@H](C)c1nc2ccccc2n1C(F)F	ZINC000121108832	330396181	/nfs/dbraw/zinc/39/61/81/330396181.db2.gz	XSFJIHAPJAKUKC-LBPRGKRZSA-N	1	0	293.361	4.390	20	30		CIEDRO
CC[C@H](C)[C@H]([NH2+]CCCC#N)c1ccc(Cl)cc1	ZINC000537093413	330398613	/nfs/dbraw/zinc/39/86/13/330398613.db2.gz	LVZXLNSOXNIHGH-WFASDCNBSA-N	1	0	264.800	4.321	20	30		CIEDRO
C[C@H]([NH2+]Cc1cc2c(s1)CCCC2)c1cccc(C#N)c1	ZINC000537296449	330431583	/nfs/dbraw/zinc/43/15/83/330431583.db2.gz	BUMWNMUSHHATHT-ZDUSSCGKSA-N	1	0	296.439	4.349	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H](C)c1sc(CC)nc1C	ZINC000537305785	330432076	/nfs/dbraw/zinc/43/20/76/330432076.db2.gz	LBGIHJFDRLIRFG-VXGBXAGGSA-N	1	0	266.454	4.409	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CCCC[C@@H]2c2ccccc2)cc1	ZINC000315565446	330477979	/nfs/dbraw/zinc/47/79/79/330477979.db2.gz	KQZBORYCDCXLIC-WOJBJXKFSA-N	1	0	290.410	4.374	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@H](C)[C@H]1OCCc2sccc21	ZINC000426341691	330504980	/nfs/dbraw/zinc/50/49/80/330504980.db2.gz	FCUDMOYQTFTPJG-JKIFEVAISA-N	1	0	293.476	4.475	20	30		CIEDRO
C[C@@H]([NH2+]Cc1cccc(F)c1C#N)C(C)(C)c1ccccc1	ZINC000428314986	330519995	/nfs/dbraw/zinc/51/99/95/330519995.db2.gz	XSXNHGMPOUWFSZ-CQSZACIVSA-N	1	0	296.389	4.153	20	30		CIEDRO
C[C@@H]([NH2+]CC1(CC#N)CC1)c1cc(Cl)ccc1Cl	ZINC000429796205	330555024	/nfs/dbraw/zinc/55/50/24/330555024.db2.gz	VOXMXGFHWGJZTP-SNVBAGLBSA-N	1	0	283.202	4.338	20	30		CIEDRO
Cc1ccc(-c2ccc(C[NH2+]CC3(CC#N)CC3)o2)cc1	ZINC000430022064	330557294	/nfs/dbraw/zinc/55/72/94/330557294.db2.gz	NOAFQBUWEYQOCH-UHFFFAOYSA-N	1	0	280.371	4.039	20	30		CIEDRO
C[C@@H]1C[C@H]([NH2+]CC2(CC#N)CC2)C[C@@H](c2ccccc2)C1	ZINC000430037684	330557766	/nfs/dbraw/zinc/55/77/66/330557766.db2.gz	SXIICXFTHJEVNT-SZMVWBNQSA-N	1	0	282.431	4.242	20	30		CIEDRO
N#CCC1(C[NH2+][C@H]2CCC[C@H]2c2ccccc2Cl)CC1	ZINC000430722367	330571409	/nfs/dbraw/zinc/57/14/09/330571409.db2.gz	FPWNISBTZZWLHY-HOCLYGCPSA-N	1	0	288.822	4.260	20	30		CIEDRO
N#CCC1(C[NH2+][C@@H]2CCCc3c(Cl)cccc32)CC1	ZINC000430738544	330572033	/nfs/dbraw/zinc/57/20/33/330572033.db2.gz	BBQOCOGCFOXVOA-OAHLLOKOSA-N	1	0	274.795	4.001	20	30		CIEDRO
CC[C@H]([NH2+]CC1(CC#N)CC1)c1ccccc1OC(F)F	ZINC000430744182	330572456	/nfs/dbraw/zinc/57/24/56/330572456.db2.gz	NGDYOVPMGWYIAI-ZDUSSCGKSA-N	1	0	294.345	4.023	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+]C[C@@H]1CCCN(c2ccccc2)C1	ZINC000433081397	330616541	/nfs/dbraw/zinc/61/65/41/330616541.db2.gz	FXHRPLJFFRXHJZ-KSZLIROESA-N	1	0	286.463	4.093	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+]C[C@@H]1CCCN(c2ccccc2)C1	ZINC000433098427	330617220	/nfs/dbraw/zinc/61/72/20/330617220.db2.gz	UVUCSWINOCRPBS-ROUUACIJSA-N	1	0	286.463	4.237	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+]C[C@@H]1CCCN(c2ccccc2)C1	ZINC000433098428	330617249	/nfs/dbraw/zinc/61/72/49/330617249.db2.gz	UVUCSWINOCRPBS-ZWKOTPCHSA-N	1	0	286.463	4.237	20	30		CIEDRO
C=CCCC[C@@H](C)[NH+]1CCC(c2ncc(C)s2)CC1	ZINC000433135511	330617970	/nfs/dbraw/zinc/61/79/70/330617970.db2.gz	JEUNFPAGBXRVPV-CYBMUJFWSA-N	1	0	278.465	4.376	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)Nc1cccc2c1OCC[C@H]2[NH+](C)C	ZINC000435037849	330648481	/nfs/dbraw/zinc/64/84/81/330648481.db2.gz	YGYUTUPPOYAGKD-JJRVBVJISA-N	1	0	288.435	4.084	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)Nc1cccc2c1OCC[C@@H]2[NH+](C)C	ZINC000435037851	330648506	/nfs/dbraw/zinc/64/85/06/330648506.db2.gz	YGYUTUPPOYAGKD-VBQJREDUSA-N	1	0	288.435	4.084	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@@H](CC)c1ccc(Cl)cc1	ZINC000435666337	330659740	/nfs/dbraw/zinc/65/97/40/330659740.db2.gz	WMPXNUCLBZBZED-PVAVHDDUSA-N	1	0	293.838	4.362	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+]C[C@@H](CCC)c1ccccc1	ZINC000435726032	330660949	/nfs/dbraw/zinc/66/09/49/330660949.db2.gz	LBGGRYUWFQBUQM-QYZOEREBSA-N	1	0	287.447	4.141	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+][C@@H](CC)c1ccc(C)cc1	ZINC000436297451	330674429	/nfs/dbraw/zinc/67/44/29/330674429.db2.gz	XTSZVYYFMCRATN-BZSNNMDCSA-N	1	0	273.420	4.017	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+][C@@H](CCC)c1ccsc1	ZINC000436315844	330675656	/nfs/dbraw/zinc/67/56/56/330675656.db2.gz	QNULOWQCKDOMJU-BPUTZDHNSA-N	1	0	279.449	4.160	20	30		CIEDRO
C=CC[NH2+][C@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000437093510	330693222	/nfs/dbraw/zinc/69/32/22/330693222.db2.gz	UOEGYQPGZQOWQM-KBPBESRZSA-N	1	0	269.310	4.117	20	30		CIEDRO
CC(C)(C)c1ccc(C[NH2+]CC2CCC(C#N)CC2)cc1	ZINC000441366761	330766994	/nfs/dbraw/zinc/76/69/94/330766994.db2.gz	FVLDFJHHSROUAZ-UHFFFAOYSA-N	1	0	284.447	4.404	20	30		CIEDRO
CCc1oc2ccccc2c1C[NH2+]CC1CCC(C#N)CC1	ZINC000441377624	330767085	/nfs/dbraw/zinc/76/70/85/330767085.db2.gz	CKLURTCBCPCSRJ-UHFFFAOYSA-N	1	0	296.414	4.415	20	30		CIEDRO
N#CC1CCC(C[NH2+][C@@H]2CCc3ccc(Cl)cc32)CC1	ZINC000442110977	330774106	/nfs/dbraw/zinc/77/41/06/330774106.db2.gz	FGHOCFXMYZAWAK-QWQCLYJRSA-N	1	0	288.822	4.247	20	30		CIEDRO
Cc1cccc([C@H]([NH2+][C@@H]2CC[C@H](C#N)C2)C(C)(C)C)c1	ZINC000442787566	330783400	/nfs/dbraw/zinc/78/34/00/330783400.db2.gz	YUFLKJSQGJZSAC-UAGQMJEPSA-N	1	0	270.420	4.364	20	30		CIEDRO
N#C[C@H]1CC[C@H]([NH2+]Cc2ccc(OC3CCCCC3)cc2)C1	ZINC000442787878	330783472	/nfs/dbraw/zinc/78/34/72/330783472.db2.gz	DWRFTFXNTDHKKS-IRXDYDNUSA-N	1	0	298.430	4.180	20	30		CIEDRO
Cc1cc([C@H](C)[NH2+]CC2CCC(C#N)CC2)cc(C)c1F	ZINC000442856126	330787584	/nfs/dbraw/zinc/78/75/84/330787584.db2.gz	NPVGAZCAIGNTMS-FHERZECASA-N	1	0	288.410	4.423	20	30		CIEDRO
C[C@@H]([NH2+]CC1CCC(C#N)CC1)C1CCCCCC1	ZINC000442875092	330789594	/nfs/dbraw/zinc/78/95/94/330789594.db2.gz	VNIIUBVUJDVYDM-QQFBHYJXSA-N	1	0	262.441	4.265	20	30		CIEDRO
C[C@@H]([NH2+]CC#Cc1ccc(F)cc1)c1cc2ccccc2o1	ZINC000442889888	330790829	/nfs/dbraw/zinc/79/08/29/330790829.db2.gz	GGIBXZILNWBHEY-CQSZACIVSA-N	1	0	293.341	4.274	20	30		CIEDRO
Cc1cc(C[NH2+][C@@H](C)CCCC(F)(F)F)ccc1C#N	ZINC000443981785	330808259	/nfs/dbraw/zinc/80/82/59/330808259.db2.gz	BBDYHMBPMODQJH-LBPRGKRZSA-N	1	0	284.325	4.077	20	30		CIEDRO
C[C@H]1CCC[C@H](C)C1[NH2+]CCCCC(C)(C)C#N	ZINC000444674431	330818518	/nfs/dbraw/zinc/81/85/18/330818518.db2.gz	KOEMDTZVWCZRLL-KBPBESRZSA-N	1	0	250.430	4.121	20	30		CIEDRO
CCc1cnccc1[C@H](C)[NH2+]CCCCC(C)(C)C#N	ZINC000444674082	330818565	/nfs/dbraw/zinc/81/85/65/330818565.db2.gz	JWYUBMKWBLNZDM-AWEZNQCLSA-N	1	0	273.424	4.015	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)c1ccccc1Cl	ZINC000446781565	330854161	/nfs/dbraw/zinc/85/41/61/330854161.db2.gz	BWWIKVDEWFEDBC-UPJWGTAASA-N	1	0	262.784	4.073	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)C1	ZINC000446823155	330855115	/nfs/dbraw/zinc/85/51/15/330855115.db2.gz	JHGNUOUVNJRWCS-NIKGAXFTSA-N	1	0	298.405	4.434	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+]Cc2cc(Cl)sc2Cl)C1	ZINC000446825848	330855334	/nfs/dbraw/zinc/85/53/34/330855334.db2.gz	LCDKDKVQFGGCBI-WCBMZHEXSA-N	1	0	289.231	4.227	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+]C[C@@H](OCC)c1ccccc1	ZINC000446833991	330855616	/nfs/dbraw/zinc/85/56/16/330855616.db2.gz	FTUANALHJNFCCI-IAGOWNOFSA-N	1	0	261.409	4.099	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H]1CCc2ccccc2C1)c1ccc(C#N)cc1	ZINC000447505541	330867207	/nfs/dbraw/zinc/86/72/07/330867207.db2.gz	ABRBCBRGFLBIMN-WOJBJXKFSA-N	1	0	290.410	4.156	20	30		CIEDRO
CC[C@H]([NH2+][C@@H](C)c1ccccc1OC)c1ccc(C#N)cc1	ZINC000447509917	330867271	/nfs/dbraw/zinc/86/72/71/330867271.db2.gz	GZQATSNVXRLQRV-KSSFIOAISA-N	1	0	294.398	4.369	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccccc1Cl)c1ccc(C#N)cc1	ZINC000447510323	330867274	/nfs/dbraw/zinc/86/72/74/330867274.db2.gz	OWZPHEDPIMSTOE-QGZVFWFLSA-N	1	0	284.790	4.453	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccc(Cl)cc1)c1ccc(C#N)cc1	ZINC000447515499	330867427	/nfs/dbraw/zinc/86/74/27/330867427.db2.gz	KRJNRXRQJHXRLC-QGZVFWFLSA-N	1	0	284.790	4.453	20	30		CIEDRO
CC[C@@H]([NH2+]C[C@@H](C)c1ccccc1)c1ccc(C#N)cc1	ZINC000447513587	330867485	/nfs/dbraw/zinc/86/74/85/330867485.db2.gz	XMCJQYFYABIDML-DNVCBOLYSA-N	1	0	278.399	4.403	20	30		CIEDRO
Cc1ccccc1[C@H]([NH2+][C@H]1CCC[C@H](C#N)C1)C(C)C	ZINC000447543942	330869506	/nfs/dbraw/zinc/86/95/06/330869506.db2.gz	UHQSYIXOCGWKFC-XYJFISCASA-N	1	0	270.420	4.364	20	30		CIEDRO
Cc1cc([C@H]([NH2+][C@@H]2CCC[C@@H](C#N)C2)C2CC2)ccc1F	ZINC000447586939	330871711	/nfs/dbraw/zinc/87/17/11/330871711.db2.gz	OETVCZQKHQTQIW-MZMPZRCHSA-N	1	0	286.394	4.257	20	30		CIEDRO
CC(C)[C@@H]([NH2+]C1CCC(C)(C#N)CC1)c1ccccc1	ZINC000449068457	330896901	/nfs/dbraw/zinc/89/69/01/330896901.db2.gz	SGPKCBMBTGHTJY-LXPRWKDFSA-N	1	0	270.420	4.446	20	30		CIEDRO
CC(C)[C@@H](C[NH2+]C1CCC(C)(C#N)CC1)c1ccccc1	ZINC000449075699	330897370	/nfs/dbraw/zinc/89/73/70/330897370.db2.gz	RNDUBWISLDKJJZ-JLAWEPINSA-N	1	0	284.447	4.488	20	30		CIEDRO
CC1(C#N)CCC([NH2+]Cc2ccc3ccccc3c2)CC1	ZINC000449103036	330899129	/nfs/dbraw/zinc/89/91/29/330899129.db2.gz	NXGCVFOHRRLDBK-UHFFFAOYSA-N	1	0	278.399	4.402	20	30		CIEDRO
C[C@@H](CC[NH2+]C1CCC(C)(C#N)CC1)c1ccccc1	ZINC000449118523	330899948	/nfs/dbraw/zinc/89/99/48/330899948.db2.gz	YQNITIZFZRXKLU-ZLPCBKJTSA-N	1	0	270.420	4.242	20	30		CIEDRO
Cc1cc(C)cc([C@@H](C)[NH2+]C2CCC(C)(C#N)CC2)c1	ZINC000449127478	330900636	/nfs/dbraw/zinc/90/06/36/330900636.db2.gz	PGQULAVYNAJIIM-FAEJEUNOSA-N	1	0	270.420	4.427	20	30		CIEDRO
Cc1ccc(C(C)(C)C[NH2+]C2CCC(C)(C#N)CC2)cc1	ZINC000449127624	330900659	/nfs/dbraw/zinc/90/06/59/330900659.db2.gz	WWASARAETLZEFK-UHFFFAOYSA-N	1	0	284.447	4.335	20	30		CIEDRO
N#CCCCC[NH2+][C@H]1CC[C@H](c2ccc(Cl)cc2)C1	ZINC000449131153	330900849	/nfs/dbraw/zinc/90/08/49/330900849.db2.gz	KKAPEIADAMAAMK-HOCLYGCPSA-N	1	0	276.811	4.260	20	30		CIEDRO
CC(C)[C@@H]1CCC[C@@H]([NH2+]C2CCC(C)(C#N)CC2)C1	ZINC000449134945	330901123	/nfs/dbraw/zinc/90/11/23/330901123.db2.gz	MJCWBQSOQJBNGK-KZYLPZIUSA-N	1	0	262.441	4.263	20	30		CIEDRO
C[C@@H](C[NH2+]C1CCC(C)(C#N)CC1)Sc1ccccc1	ZINC000449169194	330903114	/nfs/dbraw/zinc/90/31/14/330903114.db2.gz	CSXMJLNFZZMUQT-UQPPLGOBSA-N	1	0	288.460	4.229	20	30		CIEDRO
C[C@@H]([NH2+]C1CCC(C)(C#N)CC1)[C@H](C)c1ccccc1	ZINC000449178304	330903896	/nfs/dbraw/zinc/90/38/96/330903896.db2.gz	RZHFJQABEDLNQX-WPAPPDIDSA-N	1	0	270.420	4.241	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+]Cc1c(CC)noc1CC	ZINC000449184533	330904456	/nfs/dbraw/zinc/90/44/56/330904456.db2.gz	GKTJGBDJXPTWJO-ZDUSSCGKSA-N	1	0	264.413	4.024	20	30		CIEDRO
Cc1cc([C@@H](C)[NH2+]C2CCC(C)(C#N)CC2)ccc1F	ZINC000449191947	330905149	/nfs/dbraw/zinc/90/51/49/330905149.db2.gz	XNVUIGFWMXREJW-BZOOQXSSSA-N	1	0	274.383	4.257	20	30		CIEDRO
Cc1ccc([C@@H](C)[NH2+]C2CCC(C)(C#N)CC2)cc1F	ZINC000449197817	330905613	/nfs/dbraw/zinc/90/56/13/330905613.db2.gz	XZLMPGCPZVGUGV-BZOOQXSSSA-N	1	0	274.383	4.257	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@]2(C)CCCc3ccccc32)CC1	ZINC000449225038	330907496	/nfs/dbraw/zinc/90/74/96/330907496.db2.gz	JREUVSBYQYNRDV-NKELODKYSA-N	1	0	282.431	4.300	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@H]2CC[C@H](Cc3ccccc3)C2)CC1	ZINC000449266411	330910928	/nfs/dbraw/zinc/91/09/28/330910928.db2.gz	VADNWYRYHOEKSI-SOAISFHBSA-N	1	0	296.458	4.460	20	30		CIEDRO
C[C@H](CCCC(F)(F)F)[NH2+]C1CCC(C)(C#N)CC1	ZINC000449284870	330911867	/nfs/dbraw/zinc/91/18/67/330911867.db2.gz	PKXLZYBRFFJTLD-PNESKVBLSA-N	1	0	276.346	4.170	20	30		CIEDRO
N#CCCC[C@H]([NH2+][C@@H]1CCOC2(CCC2)C1)c1ccccc1	ZINC000449340247	330916150	/nfs/dbraw/zinc/91/61/50/330916150.db2.gz	NMPSEOFWYLTEJZ-MSOLQXFVSA-N	1	0	298.430	4.113	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+][C@@H]2CCCc3c(F)cc(F)cc32)C1	ZINC000449352759	330917635	/nfs/dbraw/zinc/91/76/35/330917635.db2.gz	WGXWTQGMELCFHS-PLQHRBFRSA-N	1	0	290.357	4.014	20	30		CIEDRO
CC1(C#N)CCC([NH2+]Cc2cc(C3CC3)ccc2F)CC1	ZINC000449372085	330919801	/nfs/dbraw/zinc/91/98/01/330919801.db2.gz	CDHXZOCMWBTJLR-UHFFFAOYSA-N	1	0	286.394	4.265	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+]C1CCC(CSC)CC1	ZINC000449419565	330924375	/nfs/dbraw/zinc/92/43/75/330924375.db2.gz	BJIJPXLVHPNFLR-HESLUPGFSA-N	1	0	255.471	4.099	20	30		CIEDRO
CC[C@@H]1CCCC[C@H]1C[NH2+]CC(C)(C)CCC#N	ZINC000449404470	330923082	/nfs/dbraw/zinc/92/30/82/330923082.db2.gz	CBLFUSMKHNIWCI-CABCVRRESA-N	1	0	250.430	4.122	20	30		CIEDRO
CC(C)(C)c1ccc(C[NH2+][C@H]2CC[C@@H](CC#N)C2)cc1	ZINC000449444464	330926005	/nfs/dbraw/zinc/92/60/05/330926005.db2.gz	APBKDCCHMLTZJD-YOEHRIQHSA-N	1	0	270.420	4.156	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@H]1CCC[C@H](c2ncccc2C)C1	ZINC000449485554	330929984	/nfs/dbraw/zinc/92/99/84/330929984.db2.gz	NTKSRACTKQPBEE-HOTGVXAUSA-N	1	0	272.436	4.218	20	30		CIEDRO
C=CC(C)(C)C[NH2+]Cc1csc(-c2ccccc2)n1	ZINC000449487557	330930243	/nfs/dbraw/zinc/93/02/43/330930243.db2.gz	ZDPKTOUBBGERMB-UHFFFAOYSA-N	1	0	272.417	4.112	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@@H]1CCO[C@@H](c2cccnc2)C1	ZINC000449530318	330934214	/nfs/dbraw/zinc/93/42/14/330934214.db2.gz	AMRPCCPYAISASG-CGTJXYLNSA-N	1	0	288.435	4.026	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@@H]1CCO[C@H](c2cccnc2)C1	ZINC000449530320	330934298	/nfs/dbraw/zinc/93/42/98/330934298.db2.gz	AMRPCCPYAISASG-JQHSSLGASA-N	1	0	288.435	4.026	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@@H]1CCO[C@@H](c2ccccn2)C1	ZINC000449615523	330940165	/nfs/dbraw/zinc/94/01/65/330940165.db2.gz	MFWBCIHMJYCVKJ-LZLYRXPVSA-N	1	0	288.435	4.026	20	30		CIEDRO
C=C(CC)C[NH2+]Cc1cnc(-c2ccccc2F)s1	ZINC000449736224	330947201	/nfs/dbraw/zinc/94/72/01/330947201.db2.gz	UJFSHOWHFTZZDY-UHFFFAOYSA-N	1	0	276.380	4.005	20	30		CIEDRO
CC(C)(C)[C@@H]([NH2+]CC1(C#N)CCC1)c1ccccc1	ZINC000450521460	330984818	/nfs/dbraw/zinc/98/48/18/330984818.db2.gz	XNHWQOFNVMKISM-HNNXBMFYSA-N	1	0	256.393	4.057	20	30		CIEDRO
CCCc1ccc2[nH+]ccc(N3CCC(F)(C#N)CC3)c2c1	ZINC000450528498	330985079	/nfs/dbraw/zinc/98/50/79/330985079.db2.gz	KQEYTCBBLUQEMH-UHFFFAOYSA-N	1	0	297.377	4.019	20	30		CIEDRO
CC[C@@H]([NH2+]CC1(C#N)CCC1)c1ccc(Cl)cc1	ZINC000450667537	330992070	/nfs/dbraw/zinc/99/20/70/330992070.db2.gz	KWDOGLMSEKXVCN-CQSZACIVSA-N	1	0	262.784	4.075	20	30		CIEDRO
C[C@@H]([NH2+]CC1(C#N)CCC1)c1ccc(F)c2ccccc21	ZINC000451035256	331012732	/nfs/dbraw/zinc/01/27/32/331012732.db2.gz	FPOVFYBKGCGAET-CYBMUJFWSA-N	1	0	282.362	4.323	20	30		CIEDRO
N#CCCC[C@@H]([NH2+]C[C@@H]1CCC(F)(F)C1)c1ccccc1	ZINC000451060377	331014163	/nfs/dbraw/zinc/01/41/63/331014163.db2.gz	FTIXMOSURGJORX-GDBMZVCRSA-N	1	0	292.373	4.447	20	30		CIEDRO
C[C@H](CCCC(F)(F)F)[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000163285772	331015567	/nfs/dbraw/zinc/01/55/67/331015567.db2.gz	MQOLOQAYPPDBCZ-VXGBXAGGSA-N	1	0	284.325	4.330	20	30		CIEDRO
C[C@@H]1C[C@@H](c2ccccc2)[C@H](C)[N@@H+]1CCC(C)(C)C#N	ZINC000451180405	331019042	/nfs/dbraw/zinc/01/90/42/331019042.db2.gz	GJCBEPSLHMRIKE-HLLBOEOZSA-N	1	0	270.420	4.193	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)c1sc(C(C)(C)C)nc1C	ZINC000163336171	331022672	/nfs/dbraw/zinc/02/26/72/331022672.db2.gz	AKTNFERYKNZVRH-QWRGUYRKSA-N	1	0	266.454	4.364	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CCC[C@@H]1c1ccc(F)cc1F	ZINC000451975654	331049139	/nfs/dbraw/zinc/04/91/39/331049139.db2.gz	WEOKMSGPDJALHE-MRXNPFEDSA-N	1	0	292.373	4.432	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CCC[C@H]1c1ccc(F)cc1F	ZINC000451975653	331049251	/nfs/dbraw/zinc/04/92/51/331049251.db2.gz	WEOKMSGPDJALHE-INIZCTEOSA-N	1	0	292.373	4.432	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)CCCc1cccnc1)c1ccc(C#N)cc1	ZINC000453080210	331087225	/nfs/dbraw/zinc/08/72/25/331087225.db2.gz	ZUFOQZZVRKZZAI-JKSUJKDBSA-N	1	0	293.414	4.015	20	30		CIEDRO
C[C@H](CCCc1cccnc1)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000453080207	331087249	/nfs/dbraw/zinc/08/72/49/331087249.db2.gz	ZUFOQZZVRKZZAI-CVEARBPZSA-N	1	0	293.414	4.015	20	30		CIEDRO
C[C@H](CCCc1cccnc1)[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000453080209	331087301	/nfs/dbraw/zinc/08/73/01/331087301.db2.gz	ZUFOQZZVRKZZAI-HZPDHXFCSA-N	1	0	293.414	4.015	20	30		CIEDRO
C[C@@H]([NH2+]C[C@@H]1CSc2ccccc21)c1cccc(C#N)c1	ZINC000453223798	331103484	/nfs/dbraw/zinc/10/34/84/331103484.db2.gz	SVTODTJBZVGVCT-CZUORRHYSA-N	1	0	294.423	4.098	20	30		CIEDRO
CC[C@@H]([NH2+]C[C@H]1CCCCC1(F)F)c1ccc(C#N)cc1	ZINC000453242735	331106438	/nfs/dbraw/zinc/10/64/38/331106438.db2.gz	FSYLMBITIUVRBV-HZPDHXFCSA-N	1	0	292.373	4.424	20	30		CIEDRO
Cc1cc(C)c([C@@H](C)[NH2+][C@H]2CC[C@@H](CC#N)C2)cc1C	ZINC000453287718	331111365	/nfs/dbraw/zinc/11/13/65/331111365.db2.gz	KOSVXCKLAOKQLM-IKGGRYGDSA-N	1	0	270.420	4.345	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H]1CCCc2ncc(C(F)(F)F)cc21	ZINC000453312515	331114949	/nfs/dbraw/zinc/11/49/49/331114949.db2.gz	HDNHULFSMQOZOM-CYBMUJFWSA-N	1	0	284.325	4.034	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@H]1CCO[C@@H](C(C)C)C1)c1ccco1	ZINC000453318010	331115877	/nfs/dbraw/zinc/11/58/77/331115877.db2.gz	KQJPNQXJQMDAOB-XYJFISCASA-N	1	0	291.435	4.328	20	30		CIEDRO
CC[C@@H]([NH2+]C[C@@H]1CCCC1(F)F)c1ccc(C#N)cc1	ZINC000453323953	331116825	/nfs/dbraw/zinc/11/68/25/331116825.db2.gz	URUDAPXNSUBQDO-LSDHHAIUSA-N	1	0	278.346	4.034	20	30		CIEDRO
C=C(CC)C[NH2+][C@H](C)c1sc(C(C)C)nc1C	ZINC000453341200	331119250	/nfs/dbraw/zinc/11/92/50/331119250.db2.gz	CLYIXSVRLZFPCH-LLVKDONJSA-N	1	0	252.427	4.192	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1[NH2+][C@H](C)c1cc2cc(Cl)ccc2o1	ZINC000453360562	331122341	/nfs/dbraw/zinc/12/23/41/331122341.db2.gz	OSBMTUJJGJFHRM-HONMWMINSA-N	1	0	291.778	4.080	20	30		CIEDRO
C[C@H]([NH2+]C1(Cc2ccc(F)cc2)CC1)c1ccc(C#N)cc1	ZINC000453374174	331124604	/nfs/dbraw/zinc/12/46/04/331124604.db2.gz	XBLKPHLIFPYGCF-AWEZNQCLSA-N	1	0	294.373	4.123	20	30		CIEDRO
C=CCC1(C[NH2+][C@H](C)c2cnn(C(C)C)c2)CCCC1	ZINC000453375931	331124674	/nfs/dbraw/zinc/12/46/74/331124674.db2.gz	PEWOWKAPLKDREE-OAHLLOKOSA-N	1	0	275.440	4.251	20	30		CIEDRO
Cc1ccc([C@H]([NH2+]Cc2ccc(C#N)c(F)c2)C2CCC2)o1	ZINC000453376511	331124955	/nfs/dbraw/zinc/12/49/55/331124955.db2.gz	ILWFUDWHULZIAV-GOSISDBHSA-N	1	0	298.361	4.230	20	30		CIEDRO
CC(C)(C[NH2+]C1CCC(C)(C#N)CC1)C1=CCCC1	ZINC000453395370	331127754	/nfs/dbraw/zinc/12/77/54/331127754.db2.gz	JOGXBADULGBZPI-UHFFFAOYSA-N	1	0	260.425	4.185	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCOC(C)(C)CC)c1ccco1	ZINC000453407194	331129396	/nfs/dbraw/zinc/12/93/96/331129396.db2.gz	LUYGDDUMWFZANA-AWEZNQCLSA-N	1	0	265.397	4.082	20	30		CIEDRO
N#CCCCOc1cccc(C[NH2+][C@H](C2CC2)C2CCC2)c1	ZINC000453620285	331136779	/nfs/dbraw/zinc/13/67/79/331136779.db2.gz	LHLPTDCJYHSTIO-IBGZPJMESA-N	1	0	298.430	4.037	20	30		CIEDRO
C=CCCCC[NH2+][C@H](C)c1sc(CC)nc1C	ZINC000471597284	331280296	/nfs/dbraw/zinc/28/02/96/331280296.db2.gz	ODUVKFDSTJLEPA-LLVKDONJSA-N	1	0	252.427	4.021	20	30		CIEDRO
C[C@H]([NH2+]CCCCC(C)(C)C#N)c1nc2c(s1)CCC2	ZINC000459626808	331291072	/nfs/dbraw/zinc/29/10/72/331291072.db2.gz	ANTGJSIMSQBGOS-LBPRGKRZSA-N	1	0	291.464	4.002	20	30		CIEDRO
COc1ccc(C)cc1[C@H](C)[NH2+]Cc1ccc(C#N)c(C)c1	ZINC000459649676	331292186	/nfs/dbraw/zinc/29/21/86/331292186.db2.gz	KVLMUQSALIFBLI-HNNXBMFYSA-N	1	0	294.398	4.035	20	30		CIEDRO
CC(C)(CC#N)C[NH2+][C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000459684229	331294225	/nfs/dbraw/zinc/29/42/25/331294225.db2.gz	BUGZQLLFTLHCDM-IAGOWNOFSA-N	1	0	270.420	4.242	20	30		CIEDRO
C[N@H+](CCC(C)(C)C#N)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000459699037	331294962	/nfs/dbraw/zinc/29/49/62/331294962.db2.gz	LMZUISNZDMSVFQ-IAGOWNOFSA-N	1	0	270.420	4.194	20	30		CIEDRO
Cc1ccc([C@H]2CCC[C@H]2[NH2+]CC(C)(C)CC#N)cc1	ZINC000459726277	331295937	/nfs/dbraw/zinc/29/59/37/331295937.db2.gz	DRHGRXYRCLFDJV-IAGOWNOFSA-N	1	0	270.420	4.161	20	30		CIEDRO
Cc1ccc([C@H]2CCC[C@@H]2[NH2+]CC(C)(C)CC#N)cc1	ZINC000459726279	331296027	/nfs/dbraw/zinc/29/60/27/331296027.db2.gz	DRHGRXYRCLFDJV-SJORKVTESA-N	1	0	270.420	4.161	20	30		CIEDRO
CC(C)(CC#N)C[NH2+][C@@H]1CC=C(c2ccc(F)cc2)CC1	ZINC000459731213	331296507	/nfs/dbraw/zinc/29/65/07/331296507.db2.gz	MVZUKKNSXZVTBZ-QGZVFWFLSA-N	1	0	286.394	4.291	20	30		CIEDRO
Cc1cc(C(F)(F)F)ccc1C[NH2+]CC(C)(C)CC#N	ZINC000459737777	331297046	/nfs/dbraw/zinc/29/70/46/331297046.db2.gz	WPOITKMPYAKMNL-UHFFFAOYSA-N	1	0	284.325	4.043	20	30		CIEDRO
CC(C)(CC#N)C[NH2+]CC(c1ccccc1)c1ccccc1	ZINC000459738032	331297092	/nfs/dbraw/zinc/29/70/92/331297092.db2.gz	XHBGNNMVBKTDDZ-UHFFFAOYSA-N	1	0	292.426	4.348	20	30		CIEDRO
C[C@H](Cc1cccc(F)c1)[N@H+](C)CCCCC(C)(C)C#N	ZINC000459758643	331298914	/nfs/dbraw/zinc/29/89/14/331298914.db2.gz	IPJKAUBGDBERGS-OAHLLOKOSA-N	1	0	290.426	4.409	20	30		CIEDRO
C[C@@]1([NH2+]Cc2ccc(C#N)cc2C(F)(F)F)CC=CCC1	ZINC000459765640	331299378	/nfs/dbraw/zinc/29/93/78/331299378.db2.gz	OECPUKOKQYLENS-OAHLLOKOSA-N	1	0	294.320	4.165	20	30		CIEDRO
C=CC[N@@H+](CCc1ccco1)Cc1ccc(C(F)F)cc1	ZINC000461387953	331312829	/nfs/dbraw/zinc/31/28/29/331312829.db2.gz	YTVDSYULRXFVSV-UHFFFAOYSA-N	1	0	291.341	4.448	20	30		CIEDRO
CCC[C@H](CCc1ccccc1)[NH2+][C@@H]1CCC[C@@H]1C#N	ZINC000462066456	331317112	/nfs/dbraw/zinc/31/71/12/331317112.db2.gz	HOWPAWBABVNOEW-KZNAEPCWSA-N	1	0	270.420	4.070	20	30		CIEDRO
CC#CCC[N@H+](C1CC1)C1CC(c2ccccc2C)C1	ZINC000462314673	331319159	/nfs/dbraw/zinc/31/91/59/331319159.db2.gz	OTFIPSVSVGSPCE-UHFFFAOYSA-N	1	0	267.416	4.119	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1cccc(C#N)c1)C(C)(C)c1ccccc1	ZINC000462723506	331325640	/nfs/dbraw/zinc/32/56/40/331325640.db2.gz	DTADQUBJZZOEFP-LJQANCHMSA-N	1	0	292.426	4.404	20	30		CIEDRO
CCC[C@H](CCc1ccccc1)[NH2+]Cc1cccc(C#N)c1	ZINC000462731082	331325931	/nfs/dbraw/zinc/32/59/31/331325931.db2.gz	LWYIHQXNPBRSNM-HXUWFJFHSA-N	1	0	292.426	4.449	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H](C)C[C@H](C)CC)cc1OC	ZINC000462734781	331326196	/nfs/dbraw/zinc/32/61/96/331326196.db2.gz	OUOROBIRWZKJIX-HUUCEWRRSA-N	1	0	291.435	4.174	20	30		CIEDRO
C=CCc1cc(C[NH2+]C(CC)(CC)CC)cc(OC)c1O	ZINC000462753132	331327648	/nfs/dbraw/zinc/32/76/48/331327648.db2.gz	GSSNIMNRVVIRBO-UHFFFAOYSA-N	1	0	291.435	4.188	20	30		CIEDRO
C[C@H](CCc1ccsc1)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000462795375	331329523	/nfs/dbraw/zinc/32/95/23/331329523.db2.gz	AWPFCJBQXJYPSB-KGLIPLIRSA-N	1	0	284.428	4.292	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+]Cc1ccc(C(F)F)cc1	ZINC000462835178	331332190	/nfs/dbraw/zinc/33/21/90/331332190.db2.gz	QXJIYPRWWKZXTB-CQSZACIVSA-N	1	0	253.336	4.459	20	30		CIEDRO
C=CC[NH+](CC=C)CCCCCn1c(C)nc2ccccc21	ZINC000463073425	331339413	/nfs/dbraw/zinc/33/94/13/331339413.db2.gz	VKJUMHIRNVIYLF-UHFFFAOYSA-N	1	0	297.446	4.189	20	30		CIEDRO
CCc1ccc(C(C)(C)C[NH2+][C@@H]2CCC[C@@H](C#N)C2)cc1	ZINC000463241147	331343728	/nfs/dbraw/zinc/34/37/28/331343728.db2.gz	CWVZAZXZXIPSJL-SJLPKXTDSA-N	1	0	284.447	4.199	20	30		CIEDRO
CC1(C)CCc2ccccc2[C@@H]1[NH2+][C@H]1CCC[C@H](C#N)C1	ZINC000463242888	331343889	/nfs/dbraw/zinc/34/38/89/331343889.db2.gz	LTRLMDFLDFDOSO-ZVZYQTTQSA-N	1	0	282.431	4.372	20	30		CIEDRO
CC(C)(C[NH2+][C@@H]1CCC[C@H](C#N)C1)C1CCCCC1	ZINC000463247255	331344229	/nfs/dbraw/zinc/34/42/29/331344229.db2.gz	VLWNWYYMRXXXPZ-GOEBONIOSA-N	1	0	262.441	4.265	20	30		CIEDRO
CC(C)[C@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)c1ccccc1	ZINC000463278483	331344947	/nfs/dbraw/zinc/34/49/47/331344947.db2.gz	CKALYZMKLRCTCY-PVAVHDDUSA-N	1	0	256.393	4.056	20	30		CIEDRO
C[C@H](CC(C)(C)c1ccccc1)[NH2+][C@@H]1CCC[C@H](C#N)C1	ZINC000463289387	331345227	/nfs/dbraw/zinc/34/52/27/331345227.db2.gz	OVPPFHJJRRFSTQ-SOLBZPMBSA-N	1	0	284.447	4.415	20	30		CIEDRO
CC[N@H+](Cc1ccc(C#N)cc1OC(F)F)CC(C)(C)C	ZINC000463358997	331346219	/nfs/dbraw/zinc/34/62/19/331346219.db2.gz	GOQAYMFBMNULHC-UHFFFAOYSA-N	1	0	296.361	4.028	20	30		CIEDRO
N#Cc1ccc(C[NH2+]CCC2=CCCCCC2)c(F)c1	ZINC000463700501	331350691	/nfs/dbraw/zinc/35/06/91/331350691.db2.gz	WVVBLBBKRGZGCH-UHFFFAOYSA-N	1	0	272.367	4.068	20	30		CIEDRO
C=C(C)C[N@@H+]1Cc2ccccc2C[C@@H]1c1ccccc1	ZINC000464726921	331365405	/nfs/dbraw/zinc/36/54/05/331365405.db2.gz	AVWKZUUINBOPKP-LJQANCHMSA-N	1	0	263.384	4.362	20	30		CIEDRO
CC[C@]1(C)CCC[N@@H+]([C@@H](C)c2ccc(C#N)cc2)C1	ZINC000464778348	331367643	/nfs/dbraw/zinc/36/76/43/331367643.db2.gz	NRDIBKPXOMNIQC-WMLDXEAASA-N	1	0	256.393	4.131	20	30		CIEDRO
CC(C)[C@H](Cc1ccc(F)cc1)[N@H+](C)CCCCC#N	ZINC000464788330	331368277	/nfs/dbraw/zinc/36/82/77/331368277.db2.gz	JMGIHCOCJKPEAN-KRWDZBQOSA-N	1	0	276.399	4.018	20	30		CIEDRO
Cc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2ccc(C#N)cc2)o1	ZINC000464841003	331370786	/nfs/dbraw/zinc/37/07/86/331370786.db2.gz	VTJLFJBQICCUJD-KSSFIOAISA-N	1	0	294.398	4.433	20	30		CIEDRO
C=CCCCCC[N@@H+](C)Cc1nc2cc(F)ccc2o1	ZINC000464898500	331372758	/nfs/dbraw/zinc/37/27/58/331372758.db2.gz	RCXBKGIEZFFATC-UHFFFAOYSA-N	1	0	276.355	4.145	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1ccc(N(C)c2ccccc2)nc1	ZINC000466382391	331394106	/nfs/dbraw/zinc/39/41/06/331394106.db2.gz	GHTZNZCMAFMMNQ-QGZVFWFLSA-N	1	0	295.430	4.294	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1csc(-c2ccsc2)n1	ZINC000466383997	331394220	/nfs/dbraw/zinc/39/42/20/331394220.db2.gz	QFRAIFXYRBXVDF-LBPRGKRZSA-N	1	0	278.446	4.316	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1cc2c(cc(C)cc2C)[nH]1	ZINC000466385450	331394343	/nfs/dbraw/zinc/39/43/43/331394343.db2.gz	FTESGRJCGDMYOK-AWEZNQCLSA-N	1	0	256.393	4.229	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1csc(-c2ccccc2)n1	ZINC000466401586	331395098	/nfs/dbraw/zinc/39/50/98/331395098.db2.gz	KCDISKWURUSYOV-CQSZACIVSA-N	1	0	272.417	4.254	20	30		CIEDRO
N#Cc1cccc(CC[NH2+]Cc2ccc3ccccc3c2)c1	ZINC000466421599	331396299	/nfs/dbraw/zinc/39/62/99/331396299.db2.gz	MMAKOFICHNJROL-UHFFFAOYSA-N	1	0	286.378	4.044	20	30		CIEDRO
C[C@H](C[NH2+]CCc1cccc(C#N)c1)c1cccc(Cl)c1	ZINC000466425217	331396599	/nfs/dbraw/zinc/39/65/99/331396599.db2.gz	LGYOQROPQBPYPK-CQSZACIVSA-N	1	0	298.817	4.147	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH2+]C2CCC3(CCCCC3)CC2)C1	ZINC000466742154	331403777	/nfs/dbraw/zinc/40/37/77/331403777.db2.gz	FENMAXYUBFOXGV-GDBMZVCRSA-N	1	0	260.425	4.161	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@H](C)c1sc(CC)nc1C	ZINC000467416073	331418269	/nfs/dbraw/zinc/41/82/69/331418269.db2.gz	GKGRXKIDYREUKR-PWSUYJOCSA-N	1	0	252.427	4.019	20	30		CIEDRO
C[C@@H]([NH2+]CCc1cccc(C#N)c1)c1cc2ccccc2o1	ZINC000467437398	331419246	/nfs/dbraw/zinc/41/92/46/331419246.db2.gz	HQEKWIUNKQHONT-CQSZACIVSA-N	1	0	290.366	4.198	20	30		CIEDRO
C=CCC[C@@H](C)Nc1ccc(Cl)c(C[NH+](C)C)c1	ZINC000467449223	331419909	/nfs/dbraw/zinc/41/99/09/331419909.db2.gz	IRMFHCRIOOQKKX-GFCCVEGCSA-N	1	0	266.816	4.168	20	30		CIEDRO
C=CC[C@@H](C)[C@H](C)[NH2+]Cc1cccc(-c2cccnc2)c1	ZINC000467632229	331422894	/nfs/dbraw/zinc/42/28/94/331422894.db2.gz	CZZWVXOGOGXGNW-CVEARBPZSA-N	1	0	280.415	4.439	20	30		CIEDRO
C=CCOCCC[NH2+][C@H](c1ccccc1)c1ccc(C)cc1	ZINC000470762970	331489472	/nfs/dbraw/zinc/48/94/72/331489472.db2.gz	BFHKSSVZPXIBKL-HXUWFJFHSA-N	1	0	295.426	4.267	20	30		CIEDRO
C=CC1CC[NH+](Cc2cccc(C(F)F)c2)CC1	ZINC000470775040	331490564	/nfs/dbraw/zinc/49/05/64/331490564.db2.gz	VZDYIOPLURSZHB-UHFFFAOYSA-N	1	0	251.320	4.022	20	30		CIEDRO
C=CCOCCC[NH2+][C@H](CC(C)C)c1cccs1	ZINC000470781733	331491080	/nfs/dbraw/zinc/49/10/80/331491080.db2.gz	ZKUKHEXFLRDTGB-CQSZACIVSA-N	1	0	267.438	4.018	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@@H](C)[C@H](c1ccccc1)N(C)C	ZINC000471583655	331511079	/nfs/dbraw/zinc/51/10/79/331511079.db2.gz	AVXNUVFWXAKBAR-RYQLBKOJSA-N	1	0	274.452	4.012	20	30		CIEDRO
N#C[C@H]1CC[C@H]([NH2+]C2CCC(c3ccc(F)cc3)CC2)C1	ZINC000471587432	331511493	/nfs/dbraw/zinc/51/14/93/331511493.db2.gz	ULBZHRKWCUEMHD-HKFAYQRXSA-N	1	0	286.394	4.134	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+]C[C@@H](OC(C)C)c1ccccc1OC	ZINC000471595176	331511921	/nfs/dbraw/zinc/51/19/21/331511921.db2.gz	SFRZNMVVGLTHND-CRAIPNDOSA-N	1	0	291.435	4.106	20	30		CIEDRO
C=CCCCC[NH2+][C@H]1CCCc2nc(CC)sc21	ZINC000471596217	331511956	/nfs/dbraw/zinc/51/19/56/331511956.db2.gz	AHPNQDMAGDDDSM-LBPRGKRZSA-N	1	0	264.438	4.029	20	30		CIEDRO
C=CCCCC[NH2+][C@@H](C)c1nc2ccc(Cl)cc2n1C	ZINC000471616496	331513560	/nfs/dbraw/zinc/51/35/60/331513560.db2.gz	CZAPRBRQZBOUKW-LBPRGKRZSA-N	1	0	291.826	4.234	20	30		CIEDRO
C=CCCCC[NH2+][C@H](c1ccc2[nH]c(=O)oc2c1)C(C)C	ZINC000471618650	331513605	/nfs/dbraw/zinc/51/36/05/331513605.db2.gz	KYSBGTGIPAXEKZ-INIZCTEOSA-N	1	0	288.391	4.176	20	30		CIEDRO
C=CCCCC[NH2+]Cc1cccc(-c2cccnc2)c1	ZINC000472043425	331526902	/nfs/dbraw/zinc/52/69/02/331526902.db2.gz	QAZQQWCQDDHLGP-UHFFFAOYSA-N	1	0	266.388	4.195	20	30		CIEDRO
C=CCCCC[NH2+]Cc1ccc(-c2ccncc2)cc1F	ZINC000472076437	331528772	/nfs/dbraw/zinc/52/87/72/331528772.db2.gz	ZSZXLXBPGLBELS-UHFFFAOYSA-N	1	0	284.378	4.334	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+]Cc2cccc(Oc3ccccc3)c2)C1	ZINC000472145070	331530213	/nfs/dbraw/zinc/53/02/13/331530213.db2.gz	AONZVAWWOSPBEK-DOTOQJQBSA-N	1	0	292.382	4.261	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+][C@@H]1CCOc2c(C)cccc21	ZINC000474093750	331569970	/nfs/dbraw/zinc/56/99/70/331569970.db2.gz	FQBCUOOIDDIMLB-GDBMZVCRSA-N	1	0	259.393	4.153	20	30		CIEDRO
CC[C@H](CC#N)[NH2+][C@@H](C)[C@H](C)c1ccc(Cl)cc1	ZINC000474930877	331604851	/nfs/dbraw/zinc/60/48/51/331604851.db2.gz	SPQCBAJAJXGGRB-SLEUVZQESA-N	1	0	264.800	4.114	20	30		CIEDRO
CC(C)[NH+](CCSCc1ccc(C#N)c(F)c1)C(C)C	ZINC000478725053	331712364	/nfs/dbraw/zinc/71/23/64/331712364.db2.gz	QFSGKSOGKHRPQY-UHFFFAOYSA-N	1	0	294.439	4.049	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCCc1ccccc1F)C1CC1	ZINC000479520845	331734694	/nfs/dbraw/zinc/73/46/94/331734694.db2.gz	YOYISLGLUWVWBC-KRWDZBQOSA-N	1	0	261.384	4.093	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@@H](C)c1ccncc1F	ZINC000511051070	332925719	/nfs/dbraw/zinc/92/57/19/332925719.db2.gz	QIDSYSDXANKVHT-STQMWFEESA-N	1	0	250.361	4.006	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+]Cc1ccc(C2CC2)cc1	ZINC000480482022	331774005	/nfs/dbraw/zinc/77/40/05/331774005.db2.gz	XYXKTRZOAVYSIF-UHFFFAOYSA-N	1	0	293.410	4.419	20	30		CIEDRO
C=CCC[NH+]1CCC(C)(c2nc3ccccc3s2)CC1	ZINC000511076466	332926450	/nfs/dbraw/zinc/92/64/50/332926450.db2.gz	XBXCDWUIHKDOIO-UHFFFAOYSA-N	1	0	286.444	4.226	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+]CC1(CCOC)CCCCC1	ZINC000480743623	331785927	/nfs/dbraw/zinc/78/59/27/331785927.db2.gz	IDZKOCWOPJYFMY-JKSUJKDBSA-N	1	0	267.457	4.164	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)Cc1ccccc1C(F)(F)F	ZINC000481638788	331810760	/nfs/dbraw/zinc/81/07/60/331810760.db2.gz	AJNCQTUVBDNQQN-NWDGAFQWSA-N	1	0	271.326	4.191	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H]2CC[C@H](c3ccccc3F)C2)cc1	ZINC000481808369	331816259	/nfs/dbraw/zinc/81/62/59/331816259.db2.gz	AFYLCMGJFLNLLC-IRXDYDNUSA-N	1	0	294.373	4.123	20	30		CIEDRO
CC#CCC[NH2+][C@H](C)CCc1cccc(C(F)(F)F)c1	ZINC000482165636	331825471	/nfs/dbraw/zinc/82/54/71/331825471.db2.gz	RPXYGSAROCJXBK-CYBMUJFWSA-N	1	0	283.337	4.030	20	30		CIEDRO
C[C@@]1([NH2+]Cc2ccc(F)c(C#N)c2)CCCc2ccccc21	ZINC000483828496	331885476	/nfs/dbraw/zinc/88/54/76/331885476.db2.gz	GSJKEWHPHHRVER-LJQANCHMSA-N	1	0	294.373	4.039	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H]2CCC[C@H](c3ccccc3)C2)cc1	ZINC000486898276	331948628	/nfs/dbraw/zinc/94/86/28/331948628.db2.gz	BPPAIAVIRHMDFE-PMACEKPBSA-N	1	0	290.410	4.374	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@H]2CCC[C@H](c3ccccc3)C2)c1	ZINC000486898483	331948652	/nfs/dbraw/zinc/94/86/52/331948652.db2.gz	CRQUAADHUXDJBA-PMACEKPBSA-N	1	0	290.410	4.374	20	30		CIEDRO
Cc1cc(C[NH2+][C@H](c2cccs2)C2CC2)ccc1C#N	ZINC000488116793	331990750	/nfs/dbraw/zinc/99/07/50/331990750.db2.gz	OLVFAIODPREYRC-KRWDZBQOSA-N	1	0	282.412	4.169	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(C#N)c(C)c1)c1ccc(OC)cc1	ZINC000488131394	331991310	/nfs/dbraw/zinc/99/13/10/331991310.db2.gz	RPCONZVDDJGYPC-IBGZPJMESA-N	1	0	294.398	4.116	20	30		CIEDRO
Cc1cc(C[NH2+][C@H](C)c2ccccc2Cl)ccc1C#N	ZINC000488191231	331993401	/nfs/dbraw/zinc/99/34/01/331993401.db2.gz	DTXBDDLLASASOB-CYBMUJFWSA-N	1	0	284.790	4.371	20	30		CIEDRO
C=CCCCCC[NH+]1CCC(OC(C)(C)C)CC1	ZINC000488229436	331994899	/nfs/dbraw/zinc/99/48/99/331994899.db2.gz	JEMQTLASCWLAFY-UHFFFAOYSA-N	1	0	253.430	4.012	20	30		CIEDRO
C[C@H](c1ccc2c(c1)CCC2)[N@H+](C)Cc1ccc(C#N)cc1	ZINC000488440629	332008830	/nfs/dbraw/zinc/00/88/30/332008830.db2.gz	BODALNKLVJPKER-OAHLLOKOSA-N	1	0	290.410	4.240	20	30		CIEDRO
C[C@@H](c1ccc2c(c1)CCC2)[N@H+](C)Cc1cccc(C#N)c1	ZINC000488441296	332008927	/nfs/dbraw/zinc/00/89/27/332008927.db2.gz	CRDNMOLJYHDDKC-HNNXBMFYSA-N	1	0	290.410	4.240	20	30		CIEDRO
C[C@@H]([NH2+]C1CCC2(CC2)CC1)c1ccc(C#N)cc1F	ZINC000488484324	332013265	/nfs/dbraw/zinc/01/32/65/332013265.db2.gz	ULENUOCKLHDDGG-GFCCVEGCSA-N	1	0	272.367	4.071	20	30		CIEDRO
CC[N@H+](C[C@H](C)C#N)[C@H](C)CCSc1ccccc1	ZINC000488723004	332022615	/nfs/dbraw/zinc/02/26/15/332022615.db2.gz	HBMZMSZRQVSILQ-HUUCEWRRSA-N	1	0	276.449	4.039	20	30		CIEDRO
C=CCCCCC[NH2+][C@H](CC(F)(F)F)C(C)C	ZINC000489020646	332037945	/nfs/dbraw/zinc/03/79/45/332037945.db2.gz	UTVBBTOBJDRLIT-GFCCVEGCSA-N	1	0	251.336	4.299	20	30		CIEDRO
C[C@@H](c1cccc(C#N)c1)[NH+]1CCC(c2ccccc2)CC1	ZINC000489123521	332041959	/nfs/dbraw/zinc/04/19/59/332041959.db2.gz	OBXWVRGUVOPZGP-INIZCTEOSA-N	1	0	290.410	4.499	20	30		CIEDRO
CC(C)C[N@H+](Cc1ccc(F)cc1C#N)C1CCCC1	ZINC000489602626	332061169	/nfs/dbraw/zinc/06/11/69/332061169.db2.gz	FMEKTFUJMSEXTG-UHFFFAOYSA-N	1	0	274.383	4.098	20	30		CIEDRO
N#Cc1cc(F)ccc1CN1CCC[C@@H]1c1ccccc1	ZINC000489626583	332061973	/nfs/dbraw/zinc/06/19/73/332061973.db2.gz	XAFXYKDPCIDWTK-GOSISDBHSA-N	1	0	280.346	4.034	20	30		CIEDRO
C#C[C@H]([NH2+]C1CCC(C)(C#N)CC1)c1ccc(Cl)cc1	ZINC000491702096	332296346	/nfs/dbraw/zinc/29/63/46/332296346.db2.gz	XONOGJMSGDEAPE-CGZBRXJRSA-N	1	0	286.806	4.076	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+]Cc1ccc2nc(C)sc2c1	ZINC000494192259	332466026	/nfs/dbraw/zinc/46/60/26/332466026.db2.gz	POOJGBHVTRUBCU-GFCCVEGCSA-N	1	0	274.433	4.439	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H](C)[C@H](C)C1)c1ccc(C#N)cc1	ZINC000251993005	334372775	/nfs/dbraw/zinc/37/27/75/334372775.db2.gz	ZLGLRVLIMDSHJX-QDEZUTFSSA-N	1	0	256.393	4.034	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H]1CC=C(c2ccc(F)cc2)CC1	ZINC000498793858	332572931	/nfs/dbraw/zinc/57/29/31/332572931.db2.gz	GCRSQQLMIJGKIX-DYVFJYSZSA-N	1	0	259.368	4.316	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)c1ccccc1Cl	ZINC000248716379	334314489	/nfs/dbraw/zinc/31/44/89/334314489.db2.gz	BWWIKVDEWFEDBC-XQQFMLRXSA-N	1	0	262.784	4.073	20	30		CIEDRO
C=C(C[NH2+][C@H]1CCC[C@@H](c2cccnc2)C1)c1ccccc1	ZINC000501377701	332631461	/nfs/dbraw/zinc/63/14/61/332631461.db2.gz	MVIGCGZWCBPPHU-QUCCMNQESA-N	1	0	292.426	4.411	20	30		CIEDRO
C=CCCC[C@H](C)[NH+]1CCC(c2ccnn2CCC)CC1	ZINC000501564137	332635784	/nfs/dbraw/zinc/63/57/84/332635784.db2.gz	ZCUKVJGUMFHLOM-INIZCTEOSA-N	1	0	289.467	4.217	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+][C@@H]1CCCC[C@H]1OC(F)F	ZINC000503901653	332698259	/nfs/dbraw/zinc/69/82/59/332698259.db2.gz	JRTXBJZPWAWKHS-MGPQQGTHSA-N	1	0	275.383	4.261	20	30		CIEDRO
CC(C)(CCC#N)C[NH+]1CCC(Cc2ccccc2)CC1	ZINC000505321123	332736815	/nfs/dbraw/zinc/73/68/15/332736815.db2.gz	QQXQLLPMNQNZHH-UHFFFAOYSA-N	1	0	284.447	4.271	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)c1ccc(Br)s1	ZINC000308714560	332747754	/nfs/dbraw/zinc/74/77/54/332747754.db2.gz	ANNRWDBARIKNOV-VIFPVBQESA-N	1	0	274.227	4.127	20	30		CIEDRO
C=C(C[NH2+]C/C=C\c1ccc(F)c(F)c1)c1ccccc1	ZINC000512116719	332954480	/nfs/dbraw/zinc/95/44/80/332954480.db2.gz	WMZVJJHRLQIDBU-WAYWQWQTSA-N	1	0	285.337	4.281	20	30		CIEDRO
C=C(C[NH2+][C@H](C)c1ccc(C#N)cc1F)c1ccccc1	ZINC000512284389	332961553	/nfs/dbraw/zinc/96/15/53/332961553.db2.gz	XUBVCVVYOJCQEX-CQSZACIVSA-N	1	0	280.346	4.061	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1[C@H](C)CCC[C@@H]1C)c1ccc(C#N)cc1F	ZINC000512287397	332961624	/nfs/dbraw/zinc/96/16/24/332961624.db2.gz	HUCROXHEALFMFL-ZHRONYKTSA-N	1	0	274.383	4.173	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](C)C[C@@H]1C)c1ccc(C#N)cc1F	ZINC000512611612	332975781	/nfs/dbraw/zinc/97/57/81/332975781.db2.gz	LNJVVFZRCIINCY-XREXNNHRSA-N	1	0	274.383	4.173	20	30		CIEDRO
CS[C@@H]1CCC[C@@H]([NH2+][C@H](C)c2ccc(C#N)cc2F)C1	ZINC000512618843	332976047	/nfs/dbraw/zinc/97/60/47/332976047.db2.gz	JZYURNOKVMQTOT-MRVWCRGKSA-N	1	0	292.423	4.022	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H](C)c1ccc(C#N)cc1F)C(C)(C)C	ZINC000512622857	332976457	/nfs/dbraw/zinc/97/64/57/332976457.db2.gz	CHJQWGGKBXYVOW-XHDPSFHLSA-N	1	0	262.372	4.173	20	30		CIEDRO
C[C@@H]([NH2+][C@H](C)C1CCCCC1)c1ccc(C#N)cc1F	ZINC000512625744	332976499	/nfs/dbraw/zinc/97/64/99/332976499.db2.gz	QDSTZJGEPVLRDP-CHWSQXEVSA-N	1	0	274.383	4.317	20	30		CIEDRO
C[C@H](C[NH2+][C@@H](C)c1ccc(C#N)cc1F)c1ccccc1	ZINC000512644016	332977596	/nfs/dbraw/zinc/97/75/96/332977596.db2.gz	ZFQMICSDTPDOGX-KGLIPLIRSA-N	1	0	282.362	4.152	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H]2CCC[C@H]2C1)c1ccc(C#N)cc1F	ZINC000512655432	332978054	/nfs/dbraw/zinc/97/80/54/332978054.db2.gz	ULLZYCIKKRJEOH-DRPJVOAASA-N	1	0	286.394	4.317	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1c2ccccc2C[C@H]1C)c1ccc(C#N)cc1F	ZINC000512662432	332978587	/nfs/dbraw/zinc/97/85/87/332978587.db2.gz	XFIAKGSAADWFAN-NQCMUKECSA-N	1	0	294.373	4.281	20	30		CIEDRO
N#Cc1ccc(C[NH+]2CCC3(CCCCC3)CC2)s1	ZINC000513118088	333005210	/nfs/dbraw/zinc/00/52/10/333005210.db2.gz	XVGIKTFNLXRIBM-UHFFFAOYSA-N	1	0	274.433	4.166	20	30		CIEDRO
Cc1cccc([C@H]2CCC[N@@H+]2CCCC(C)(C)C#N)c1	ZINC000174831413	333008203	/nfs/dbraw/zinc/00/82/03/333008203.db2.gz	AWQAZNXFNPMCSQ-QGZVFWFLSA-N	1	0	270.420	4.462	20	30		CIEDRO
CC(C)(C#N)CCC[N@H+](C1CC1)[C@H]1CCc2ccccc21	ZINC000174832249	333008285	/nfs/dbraw/zinc/00/82/85/333008285.db2.gz	CRTCNEOJPUBLNW-SFHVURJKSA-N	1	0	282.431	4.468	20	30		CIEDRO
CCC[C@@]1(C)CCC[N@H+](CCCC(C)(C)C#N)C1	ZINC000174882134	333009979	/nfs/dbraw/zinc/00/99/79/333009979.db2.gz	QHWOICWHUVAJHU-INIZCTEOSA-N	1	0	250.430	4.219	20	30		CIEDRO
C[C@H]1C[C@@H](c2ccccc2)[N@H+](Cc2ccccc2C#N)C1	ZINC000513236228	333010201	/nfs/dbraw/zinc/01/02/01/333010201.db2.gz	JZINZMYPBSJKHN-KXBFYZLASA-N	1	0	276.383	4.141	20	30		CIEDRO
C[C@@H]1C[C@@H](c2ccccc2)[N@H+](Cc2ccccc2C#N)C1	ZINC000513236225	333010229	/nfs/dbraw/zinc/01/02/29/333010229.db2.gz	JZINZMYPBSJKHN-BEFAXECRSA-N	1	0	276.383	4.141	20	30		CIEDRO
C[C@H]1C[C@H](c2ccccc2)[N@H+](Cc2ccccc2C#N)C1	ZINC000513236227	333010251	/nfs/dbraw/zinc/01/02/51/333010251.db2.gz	JZINZMYPBSJKHN-HNAYVOBHSA-N	1	0	276.383	4.141	20	30		CIEDRO
C[C@@H]1C[C@H](c2ccccc2)[N@H+](CCC(C)(C)C#N)C1	ZINC000513272020	333011931	/nfs/dbraw/zinc/01/19/31/333011931.db2.gz	PHGLIJIKGVLTCL-GDBMZVCRSA-N	1	0	256.393	4.009	20	30		CIEDRO
CCc1ccc([C@H]2CCC[N@H+](CCC(C)(C)C#N)C2)cc1	ZINC000513392463	333017226	/nfs/dbraw/zinc/01/72/26/333017226.db2.gz	QYXDYHUNLZOZIL-SFHVURJKSA-N	1	0	284.447	4.368	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]C/C(C)=C\c1ccccc1COC	ZINC000513461395	333020946	/nfs/dbraw/zinc/02/09/46/333020946.db2.gz	LYQKEZQPHBJGAS-NZHZHZHDSA-N	1	0	273.420	4.181	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]C/C(C)=C/c1ccccc1COC	ZINC000513461397	333021020	/nfs/dbraw/zinc/02/10/20/333021020.db2.gz	LYQKEZQPHBJGAS-XOVFHRFOSA-N	1	0	273.420	4.181	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]C/C(C)=C\c1ccccc1COC	ZINC000513461396	333021043	/nfs/dbraw/zinc/02/10/43/333021043.db2.gz	LYQKEZQPHBJGAS-WTQUMQLASA-N	1	0	273.420	4.181	20	30		CIEDRO
C=C1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1	ZINC000513492334	333022699	/nfs/dbraw/zinc/02/26/99/333022699.db2.gz	ZWYCJFLDAADESF-UHFFFAOYSA-N	1	0	298.342	4.007	20	30		CIEDRO
Cc1cccc(C[N@H+](CCC#N)CC(C)(C)C)c1C	ZINC000513713403	333034548	/nfs/dbraw/zinc/03/45/48/333034548.db2.gz	OGTLKVTWSJREGQ-UHFFFAOYSA-N	1	0	258.409	4.065	20	30		CIEDRO
Cc1ccccc1C[C@@H]1CCC[N@@H+]1CC(C)(C)CCC#N	ZINC000513754334	333037503	/nfs/dbraw/zinc/03/75/03/333037503.db2.gz	KEDVMXVOKAJSKS-SFHVURJKSA-N	1	0	284.447	4.332	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@H]1CCc2sc(Cl)cc21	ZINC000309538758	333045150	/nfs/dbraw/zinc/04/51/50/333045150.db2.gz	FOCAIKZKGQCGAK-ONGXEEELSA-N	1	0	255.814	4.333	20	30		CIEDRO
C=CCCCC[NH2+][C@@H](c1ccc(OC)cc1)C1CC1	ZINC000311636391	333070696	/nfs/dbraw/zinc/07/06/96/333070696.db2.gz	QDXZDJRKAGGWLI-QGZVFWFLSA-N	1	0	259.393	4.092	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]C1CC(c2cccc(F)c2)C1	ZINC000311938505	333074866	/nfs/dbraw/zinc/07/48/66/333074866.db2.gz	VVDVOKIOHBMTAT-UHFFFAOYSA-N	1	0	261.384	4.264	20	30		CIEDRO
Cc1[nH+]ccc(N[C@H](C)c2ccc(C#N)cc2)c1Cl	ZINC000312124515	333077034	/nfs/dbraw/zinc/07/70/34/333077034.db2.gz	YHPURGURICINCT-SNVBAGLBSA-N	1	0	271.751	4.088	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](C#N)C1)c1cc2ccccc2s1	ZINC000517398303	333098793	/nfs/dbraw/zinc/09/87/93/333098793.db2.gz	IFFJVVQONFQCQX-SCRDCRAPSA-N	1	0	270.401	4.244	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H](CC)C(C)(C)C)cc1	ZINC000517546117	333101769	/nfs/dbraw/zinc/10/17/69/333101769.db2.gz	SRQLSKUWAAEVGM-MRXNPFEDSA-N	1	0	261.409	4.166	20	30		CIEDRO
N#Cc1ccc(C[NH2+]Cc2ccc3sccc3c2)c(F)c1	ZINC000517631844	333104613	/nfs/dbraw/zinc/10/46/13/333104613.db2.gz	YIWYYGBXGINCPX-UHFFFAOYSA-N	1	0	296.370	4.202	20	30		CIEDRO
C=C(C[NH2+][C@@H](C)c1ccc(C)s1)c1ccccc1	ZINC000211851819	333107801	/nfs/dbraw/zinc/10/78/01/333107801.db2.gz	SJOCHOYSNFFMAR-AWEZNQCLSA-N	1	0	257.402	4.421	20	30		CIEDRO
Cc1c2ccccc2oc1[C@@H](C)[NH2+]CCCSCC#N	ZINC000183536613	333121011	/nfs/dbraw/zinc/12/10/11/333121011.db2.gz	SGFPPLFLLVAPEA-CYBMUJFWSA-N	1	0	288.416	4.039	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]Cc2ccc(CC)s2)cc1	ZINC000218217683	333129580	/nfs/dbraw/zinc/12/95/80/333129580.db2.gz	UUZGOSWKGFTNCD-UHFFFAOYSA-N	1	0	287.428	4.165	20	30		CIEDRO
C[C@H]1CCCc2ccccc2[C@@H]1[NH2+]Cc1cc(C#N)cs1	ZINC000185085697	333135392	/nfs/dbraw/zinc/13/53/92/333135392.db2.gz	YFDWFXVLHNYQNP-SCLBCKFNSA-N	1	0	296.439	4.423	20	30		CIEDRO
CC[NH+](CC)Cc1cccc(N[C@@H]2CCC[C@H](C#N)C2)c1	ZINC000185726756	333147469	/nfs/dbraw/zinc/14/74/69/333147469.db2.gz	MLORMHOTUORSHY-DOTOQJQBSA-N	1	0	285.435	4.023	20	30		CIEDRO
CCCCOc1cccc(C[NH2+][C@H]2CCC[C@H](C#N)C2)c1	ZINC000185783172	333148707	/nfs/dbraw/zinc/14/87/07/333148707.db2.gz	ONFAGGDCNBKBFW-RDJZCZTQSA-N	1	0	286.419	4.037	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+]CCc2csc3ccccc23)C1	ZINC000185822150	333149635	/nfs/dbraw/zinc/14/96/35/333149635.db2.gz	MIXBTRYLOVTZAA-HIFRSBDPSA-N	1	0	284.428	4.116	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+]CCc2ccc3ccccc3c2)C1	ZINC000185816560	333149668	/nfs/dbraw/zinc/14/96/68/333149668.db2.gz	PJVLWYUKCZBQEA-APWZRJJASA-N	1	0	278.399	4.054	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H](C)c1sccc1OC	ZINC000186239807	333157125	/nfs/dbraw/zinc/15/71/25/333157125.db2.gz	IBRFFLUXRSEPOF-VXGBXAGGSA-N	1	0	253.411	4.152	20	30		CIEDRO
C=C(C)[C@@H]([NH2+]Cc1ccccc1)c1ccc(F)c(F)c1	ZINC000187370436	333169736	/nfs/dbraw/zinc/16/97/36/333169736.db2.gz	NSTRFLPNXYOFLD-QGZVFWFLSA-N	1	0	273.326	4.372	20	30		CIEDRO
C=C(C)[C@H]([NH2+]Cc1cccs1)c1ccc(F)c(F)c1	ZINC000187368927	333169867	/nfs/dbraw/zinc/16/98/67/333169867.db2.gz	JWFOELYWFXSDBI-HNNXBMFYSA-N	1	0	279.355	4.433	20	30		CIEDRO
C=C(C)[C@H]([NH2+]Cc1cccc(C#N)c1)c1ccc(F)c(F)c1	ZINC000187374205	333169939	/nfs/dbraw/zinc/16/99/39/333169939.db2.gz	DCOFCJNEMSBKKX-SFHVURJKSA-N	1	0	298.336	4.243	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)o1)c1ccc(F)c2ccccc21	ZINC000521551244	333178409	/nfs/dbraw/zinc/17/84/09/333178409.db2.gz	JDZSWKXDUKBXQD-LBPRGKRZSA-N	1	0	294.329	4.294	20	30		CIEDRO
CC(C)(C[NH2+]Cc1ccc(C#N)cc1)c1ccccc1Cl	ZINC000521830221	333192087	/nfs/dbraw/zinc/19/20/87/333192087.db2.gz	HNVAPTJJTSIZCN-UHFFFAOYSA-N	1	0	298.817	4.279	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CC[C@H](C(F)(F)F)C(C)(C)C1	ZINC000190181159	333203875	/nfs/dbraw/zinc/20/38/75/333203875.db2.gz	XPGCJWKPEGISSR-LBPRGKRZSA-N	1	0	290.373	4.227	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]Cc2ccc(CC)cc2)cc1	ZINC000223991742	333215022	/nfs/dbraw/zinc/21/50/22/333215022.db2.gz	VHZAXZVLNFMOIO-UHFFFAOYSA-N	1	0	281.399	4.104	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)c1ccc(OC)cc1Br	ZINC000522035177	333231073	/nfs/dbraw/zinc/23/10/73/333231073.db2.gz	NSPGKLFOZRGROY-NSHDSACASA-N	1	0	298.224	4.075	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+]Cc1cc(Cl)cs1	ZINC000193098438	333242603	/nfs/dbraw/zinc/24/26/03/333242603.db2.gz	NJHNGLWMHWBMAD-UHFFFAOYSA-N	1	0	293.819	4.256	20	30		CIEDRO
CCCC[C@@H](CCC)[NH2+]Cc1cc(C#N)cs1	ZINC000226269453	333255603	/nfs/dbraw/zinc/25/56/03/333255603.db2.gz	ZGTSMIQPHGXJKK-CYBMUJFWSA-N	1	0	250.411	4.068	20	30		CIEDRO
CCCC[C@@H](CCC)[NH2+]Cc1ccc(C#N)s1	ZINC000226269204	333255639	/nfs/dbraw/zinc/25/56/39/333255639.db2.gz	CLIBBRGNTRLUDA-GFCCVEGCSA-N	1	0	250.411	4.068	20	30		CIEDRO
C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]CCCCC#N	ZINC000193981165	333262612	/nfs/dbraw/zinc/26/26/12/333262612.db2.gz	NVKLLGCLDKSMJL-CYBMUJFWSA-N	1	0	298.352	4.310	20	30		CIEDRO
C=C(C)C[N@@H+](C)[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000195732510	333262843	/nfs/dbraw/zinc/26/28/43/333262843.db2.gz	ABSVDMUGFNMUKS-NSHDSACASA-N	1	0	257.299	4.274	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCC[C@@H](C)CC1)c1ccc(C#N)cc1	ZINC000226496965	333263206	/nfs/dbraw/zinc/26/32/06/333263206.db2.gz	QMIQSCSGIZRPFF-CPUCHLNUSA-N	1	0	256.393	4.178	20	30		CIEDRO
C[C@H]1C[C@@H](c2ccccc2)C[N@@H+]1Cc1ccc(F)cc1C#N	ZINC000522469815	333287604	/nfs/dbraw/zinc/28/76/04/333287604.db2.gz	QNQGKGXCUBODBI-KBXCAEBGSA-N	1	0	294.373	4.075	20	30		CIEDRO
C[C@@H]1C[C@H](c2ccccc2)C[N@@H+]1Cc1ccc(F)cc1C#N	ZINC000522469816	333287660	/nfs/dbraw/zinc/28/76/60/333287660.db2.gz	QNQGKGXCUBODBI-KDOFPFPSSA-N	1	0	294.373	4.075	20	30		CIEDRO
CCc1ccc([C@@H](C)[NH2+]CC(C)(C)CCC#N)cc1	ZINC000229677415	333307639	/nfs/dbraw/zinc/30/76/39/333307639.db2.gz	DIMJAEWZYUDHTD-CQSZACIVSA-N	1	0	258.409	4.230	20	30		CIEDRO
C[C@H]([NH2+]CC(C)(C)CCC#N)c1ccc(Cl)s1	ZINC000229679377	333307700	/nfs/dbraw/zinc/30/77/00/333307700.db2.gz	SUHOVTAOZONVGM-JTQLQIEISA-N	1	0	270.829	4.382	20	30		CIEDRO
CC[C@H]([NH2+]CC(C)(C)CCC#N)c1ccc(C)cc1	ZINC000229681471	333307809	/nfs/dbraw/zinc/30/78/09/333307809.db2.gz	HMNZZGXJYDBYPW-INIZCTEOSA-N	1	0	258.409	4.366	20	30		CIEDRO
CC[C@H]([NH2+]CC(C)(C)CCC#N)C1CCCCC1	ZINC000229694770	333307926	/nfs/dbraw/zinc/30/79/26/333307926.db2.gz	MPOOQTRIUCPBQL-HNNXBMFYSA-N	1	0	250.430	4.265	20	30		CIEDRO
C=CCCCCC[N@@H+](C)Cc1cn2cc(Cl)ccc2n1	ZINC000523552190	333332854	/nfs/dbraw/zinc/33/28/54/333332854.db2.gz	QSHJAOHLVIRQLH-UHFFFAOYSA-N	1	0	291.826	4.166	20	30		CIEDRO
C=CCCCCC[N@@H+](C)Cc1nc(-c2ccc(C)cc2)no1	ZINC000523565387	333333066	/nfs/dbraw/zinc/33/30/66/333333066.db2.gz	YMJDNBYXCGTEQK-UHFFFAOYSA-N	1	0	299.418	4.223	20	30		CIEDRO
CC(C)(C#N)CCCC[N@@H+]1CC[C@@H](c2ccccc2)C1	ZINC000232531589	333338127	/nfs/dbraw/zinc/33/81/27/333338127.db2.gz	ASOXNOIAGSASEO-QGZVFWFLSA-N	1	0	270.420	4.196	20	30		CIEDRO
C[C@H]1C[C@H](c2ccc(F)cc2)C[N@@H+]1Cc1ccc(C#N)cc1	ZINC000524072055	333352993	/nfs/dbraw/zinc/35/29/93/333352993.db2.gz	STISWJNIAAWTJG-KSSFIOAISA-N	1	0	294.373	4.075	20	30		CIEDRO
CC[C@@H]1CCCC[C@H]1[NH2+]CCCCC(C)(C)C#N	ZINC000233921822	333356301	/nfs/dbraw/zinc/35/63/01/333356301.db2.gz	MHZLDLXWMPNPJT-HUUCEWRRSA-N	1	0	250.430	4.265	20	30		CIEDRO
CC[C@H]1CCC[N@H+](CCCCC(C)(C)C#N)CC1	ZINC000234078232	333357742	/nfs/dbraw/zinc/35/77/42/333357742.db2.gz	XHCAGSYAOUDGKF-HNNXBMFYSA-N	1	0	250.430	4.219	20	30		CIEDRO
C[C@H]1CCCC[C@H]1[N@H+](C)CCCCC(C)(C)C#N	ZINC000235549038	333370585	/nfs/dbraw/zinc/37/05/85/333370585.db2.gz	UPWPHXKLEXGAFK-LSDHHAIUSA-N	1	0	250.430	4.217	20	30		CIEDRO
CC(C)(C)[NH2+]Cc1cccc(OCc2ccccc2C#N)c1	ZINC000236662558	333374724	/nfs/dbraw/zinc/37/47/24/333374724.db2.gz	HILHEUOHYVKNHZ-UHFFFAOYSA-N	1	0	294.398	4.025	20	30		CIEDRO
CC1(C)CC[C@H]([NH2+]Cc2ccc(C#N)cc2)c2ccccc21	ZINC000236749497	333375245	/nfs/dbraw/zinc/37/52/45/333375245.db2.gz	NJGXZKJRPFIRTM-IBGZPJMESA-N	1	0	290.410	4.461	20	30		CIEDRO
N#Cc1cccc(C[NH2+]C2CCC(c3ccccc3)CC2)c1	ZINC000237845785	333381865	/nfs/dbraw/zinc/38/18/65/333381865.db2.gz	FCXJNKQUFSICJH-UHFFFAOYSA-N	1	0	290.410	4.374	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1cccc(C(F)(F)F)c1	ZINC000393800979	333385758	/nfs/dbraw/zinc/38/57/58/333385758.db2.gz	SJQGTSWXNSXZTP-ZDUSSCGKSA-N	1	0	257.299	4.150	20	30		CIEDRO
C=CCC[N@H+]1CCC[C@@H]1Cc1c(F)cccc1Cl	ZINC000524811704	333388962	/nfs/dbraw/zinc/38/89/62/333388962.db2.gz	HABOMHVLGAUUQA-GFCCVEGCSA-N	1	0	267.775	4.062	20	30		CIEDRO
C=CCC[N@H+](CC=C)Cc1cc(Br)ccc1F	ZINC000524811856	333389261	/nfs/dbraw/zinc/38/92/61/333389261.db2.gz	RSXLDAFUKLJGIL-UHFFFAOYSA-N	1	0	298.199	4.152	20	30		CIEDRO
CC[C@@H]([NH2+]CCc1ccc(C)cc1)c1ccc(C#N)cc1	ZINC000576025213	335142974	/nfs/dbraw/zinc/14/29/74/335142974.db2.gz	BOAGDKGGXDWVCL-LJQANCHMSA-N	1	0	278.399	4.150	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1ccc(F)c(F)c1)c1cccc(C#N)c1	ZINC000037277475	333529778	/nfs/dbraw/zinc/52/97/78/333529778.db2.gz	BBPMIHSQCJRHMQ-NEPJUHHUSA-N	1	0	286.325	4.248	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)C1CCCCC1	ZINC000037284469	333531147	/nfs/dbraw/zinc/53/11/47/333531147.db2.gz	OOPSHGVFMMJHMK-KGLIPLIRSA-N	1	0	256.393	4.178	20	30		CIEDRO
N#Cc1ccc(C[NH2+]Cc2cccc(Cl)c2Cl)cc1	ZINC000037505738	333534256	/nfs/dbraw/zinc/53/42/56/333534256.db2.gz	YXQLSDNMDKUCMN-UHFFFAOYSA-N	1	0	291.181	4.155	20	30		CIEDRO
CC(C)(C)[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(C#N)cc1	ZINC000037507774	333534266	/nfs/dbraw/zinc/53/42/66/333534266.db2.gz	JJGAGEYHSLHUMF-DLBZAZTESA-N	1	0	270.420	4.253	20	30		CIEDRO
C[C@@H]([NH2+]CC(C)(C)c1ccccc1)c1cccc(C#N)c1	ZINC000037934961	333543093	/nfs/dbraw/zinc/54/30/93/333543093.db2.gz	SCPGYQVZNRGTLB-OAHLLOKOSA-N	1	0	278.399	4.187	20	30		CIEDRO
C[C@H]([NH2+]CC(C)(C)c1ccccc1)c1ccc(C#N)cc1	ZINC000037934762	333543115	/nfs/dbraw/zinc/54/31/15/333543115.db2.gz	SWMMZAIUYAGAHE-HNNXBMFYSA-N	1	0	278.399	4.187	20	30		CIEDRO
C[C@@H]([NH2+]CC#Cc1ccc(C(F)(F)F)cc1)C(C)(C)C	ZINC000537984928	333553821	/nfs/dbraw/zinc/55/38/21/333553821.db2.gz	NRELROCIWXEFAW-GFCCVEGCSA-N	1	0	283.337	4.081	20	30		CIEDRO
CC(C)C1CCC([NH2+]CC(C)(C)CCC#N)CC1	ZINC000124018589	333555165	/nfs/dbraw/zinc/55/51/65/333555165.db2.gz	WNRMIJNYQFTSHW-UHFFFAOYSA-N	1	0	250.430	4.121	20	30		CIEDRO
C[C@H]([NH2+]Cc1cccc(C#N)c1F)C(C)(C)c1ccccc1	ZINC000538150575	333576685	/nfs/dbraw/zinc/57/66/85/333576685.db2.gz	QFJUOWHISOWHTK-AWEZNQCLSA-N	1	0	296.389	4.153	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H](C)c1nc2c(s1)CCCC2	ZINC000538408968	333589563	/nfs/dbraw/zinc/58/95/63/333589563.db2.gz	AKHNBYPKVVKYOU-CHWSQXEVSA-N	1	0	278.465	4.417	20	30		CIEDRO
C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(C#N)cc2)c2ccccc21	ZINC000126559245	333599706	/nfs/dbraw/zinc/59/97/06/333599706.db2.gz	XVHKJWZVDWJPFP-AUUYWEPGSA-N	1	0	276.383	4.286	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCc2cc(F)ccc21)c1ccc(C#N)c(F)c1	ZINC000538508674	333601193	/nfs/dbraw/zinc/60/11/93/333601193.db2.gz	XPGNXUWIOLKHTP-ZMZPIMSZSA-N	1	0	298.336	4.175	20	30		CIEDRO
Cc1cc([C@H]([NH2+]CCC(C)(C)C#N)C2CC2)ccc1F	ZINC000538512629	333602155	/nfs/dbraw/zinc/60/21/55/333602155.db2.gz	XDUNRQOKNZJZJQ-MRXNPFEDSA-N	1	0	274.383	4.115	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+][C@@H]1CCOC2(CCCCC2)C1	ZINC000127371317	333627448	/nfs/dbraw/zinc/62/74/48/333627448.db2.gz	VZTHOPHXKQSNHP-HZPDHXFCSA-N	1	0	265.441	4.203	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]CCCC1CCCCC1	ZINC000174266600	335151587	/nfs/dbraw/zinc/15/15/87/335151587.db2.gz	WXJFMNZQRMTVNY-UHFFFAOYSA-N	1	0	250.430	4.266	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+][C@H](C)c1ccncc1CC	ZINC000539214642	333660617	/nfs/dbraw/zinc/66/06/17/333660617.db2.gz	RZYCYZSCFCDAOS-GDBMZVCRSA-N	1	0	260.425	4.430	20	30		CIEDRO
Fc1cccc(C2([NH2+]CC#Cc3ccccc3Cl)CC2)c1	ZINC000539311790	333665397	/nfs/dbraw/zinc/66/53/97/333665397.db2.gz	ISTKWVQLBIOJPC-UHFFFAOYSA-N	1	0	299.776	4.110	20	30		CIEDRO
C[C@@H]([NH2+]CCc1ccccc1Cl)c1cccc(C#N)c1	ZINC000539498990	333674311	/nfs/dbraw/zinc/67/43/11/333674311.db2.gz	ZRKQUOQNXGFHLW-CYBMUJFWSA-N	1	0	284.790	4.105	20	30		CIEDRO
Cc1ccc2c(c1)CC[C@H]2[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000539500016	333674365	/nfs/dbraw/zinc/67/43/65/333674365.db2.gz	ODDJHTHIYFRDSB-IFXJQAMLSA-N	1	0	276.383	4.205	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCCCC1(C)C)c1ccc(C#N)c(F)c1	ZINC000539610273	333681007	/nfs/dbraw/zinc/68/10/07/333681007.db2.gz	SZGOUHUQFAPOGZ-MLGOLLRUSA-N	1	0	274.383	4.317	20	30		CIEDRO
C[C@H](C[N@H+](C)CC(C)(C)C#N)c1ccc(C(F)(F)F)cc1	ZINC000576129493	335158670	/nfs/dbraw/zinc/15/86/70/335158670.db2.gz	ABUPNMVGQZLJNZ-GFCCVEGCSA-N	1	0	298.352	4.290	20	30		CIEDRO
C[C@@H](Cc1ccc(C(C)(C)C)cc1)C[NH+]1CCC(C#N)CC1	ZINC000540465898	333730920	/nfs/dbraw/zinc/73/09/20/333730920.db2.gz	BKRQNYOYNFHPGS-INIZCTEOSA-N	1	0	298.474	4.398	20	30		CIEDRO
C[C@H]([NH2+]CC(C)(C)c1ccccc1F)c1cccc(C#N)c1	ZINC000540594155	333736904	/nfs/dbraw/zinc/73/69/04/333736904.db2.gz	ZETVAKRRWZKJFN-AWEZNQCLSA-N	1	0	296.389	4.326	20	30		CIEDRO
C[C@H]([NH2+]CC1(Cc2ccccc2)CC1)c1cccc(C#N)c1	ZINC000540607921	333737862	/nfs/dbraw/zinc/73/78/62/333737862.db2.gz	OKTZBBVBMWGSHV-INIZCTEOSA-N	1	0	290.410	4.232	20	30		CIEDRO
CC(C)(C#N)CC[NH2+][C@H](c1ccccc1)c1ccc(F)cc1	ZINC000540665759	333741023	/nfs/dbraw/zinc/74/10/23/333741023.db2.gz	SMYIOTKSSRXECT-GOSISDBHSA-N	1	0	296.389	4.445	20	30		CIEDRO
C[C@H]([NH2+]C1[C@H](C)CCC[C@H]1C)c1cccc(C#N)c1	ZINC000540766855	333746453	/nfs/dbraw/zinc/74/64/53/333746453.db2.gz	XTVMBBUOERYGQI-MCIONIFRSA-N	1	0	256.393	4.034	20	30		CIEDRO
C[C@]1([NH2+]Cc2ccc(F)cc2C#N)CCCc2ccccc21	ZINC000540907129	333752621	/nfs/dbraw/zinc/75/26/21/333752621.db2.gz	ICQBHVLZACYMMK-IBGZPJMESA-N	1	0	294.373	4.039	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H]1CCCc2ccc(O)cc21	ZINC000340535689	335157763	/nfs/dbraw/zinc/15/77/63/335157763.db2.gz	NXOZSCNQJJDZNH-GUYCJALGSA-N	1	0	259.393	4.104	20	30		CIEDRO
CCCCCOc1ccc([C@H](C)[NH2+]CCCC#N)cc1	ZINC000541569458	333781331	/nfs/dbraw/zinc/78/13/31/333781331.db2.gz	BZLXEFAKCLDALW-HNNXBMFYSA-N	1	0	274.408	4.210	20	30		CIEDRO
C[C@H](c1ccccc1)[C@H](C)[NH2+]Cc1ccc(CC#N)cc1	ZINC000541613397	333784286	/nfs/dbraw/zinc/78/42/86/333784286.db2.gz	DJQGQHGAQWAIKZ-HOTGVXAUSA-N	1	0	278.399	4.034	20	30		CIEDRO
C[C@@H](CC1CCCCC1)C[NH+]1CCC(CC#N)CC1	ZINC000541762538	333790613	/nfs/dbraw/zinc/79/06/13/333790613.db2.gz	ADNZPNRJDNCADU-HNNXBMFYSA-N	1	0	262.441	4.219	20	30		CIEDRO
C[C@H]([NH2+]CCCC#N)c1ccc(-c2ccccc2)s1	ZINC000541777204	333792274	/nfs/dbraw/zinc/79/22/74/333792274.db2.gz	ZQMRJWZSVKDGAL-ZDUSSCGKSA-N	1	0	270.401	4.369	20	30		CIEDRO
C[C@@H]([NH2+]C/C=C\c1ccccc1)c1ccc(C#N)c(F)c1	ZINC000541846798	333794243	/nfs/dbraw/zinc/79/42/43/333794243.db2.gz	VNPTZCDGEFNYDD-BMWLXYDHSA-N	1	0	280.346	4.061	20	30		CIEDRO
N#CCC1CC[NH+](Cc2ccc(Oc3ccccc3)o2)CC1	ZINC000541921834	333801165	/nfs/dbraw/zinc/80/11/65/333801165.db2.gz	UQQPEDBDLVCQGM-UHFFFAOYSA-N	1	0	296.370	4.198	20	30		CIEDRO
N#CCC1CC[NH+](Cc2c(Cl)oc3ccccc32)CC1	ZINC000541921742	333801179	/nfs/dbraw/zinc/80/11/79/333801179.db2.gz	FJTROSQCOIPUOB-UHFFFAOYSA-N	1	0	288.778	4.212	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@@H](C)c1csc(CC)n1	ZINC000542573790	333832628	/nfs/dbraw/zinc/83/26/28/333832628.db2.gz	KYUHBJGXCFBWHP-NEPJUHHUSA-N	1	0	252.427	4.101	20	30		CIEDRO
CC(C)[NH2+][C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000542105957	333810159	/nfs/dbraw/zinc/81/01/59/333810159.db2.gz	PFSSYWAMBWTUQK-CQSZACIVSA-N	1	0	264.372	4.284	20	30		CIEDRO
CC(C)c1ccc([C@@H](C)[NH+]2CCC(C)(C#N)CC2)cc1	ZINC000542256706	333818818	/nfs/dbraw/zinc/81/88/18/333818818.db2.gz	YSDGBIQOMRHSKJ-OAHLLOKOSA-N	1	0	270.420	4.497	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](c1cccnc1)c1ccc(F)cc1F	ZINC000542495626	333827941	/nfs/dbraw/zinc/82/79/41/333827941.db2.gz	ZJZAZDCEZWIDDO-YVEFUNNKSA-N	1	0	288.341	4.003	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@@H](SC)C(C)(C)C)C1CC1	ZINC000542501155	333828742	/nfs/dbraw/zinc/82/87/42/333828742.db2.gz	PWHJEHYIZOZIHL-ZIAGYGMSSA-N	1	0	255.471	4.099	20	30		CIEDRO
CC(C)C[C@@H]([NH2+]CCC(C)(C)C#N)c1cccs1	ZINC000542557030	333831912	/nfs/dbraw/zinc/83/19/12/333831912.db2.gz	QOEZMPVTCCTSIK-CYBMUJFWSA-N	1	0	264.438	4.365	20	30		CIEDRO
C=CCC[C@H](C)[NH2+]Cc1cccc(COCc2ccco2)c1	ZINC000542671257	333835638	/nfs/dbraw/zinc/83/56/38/333835638.db2.gz	QANKYUQGKFSISU-INIZCTEOSA-N	1	0	299.414	4.441	20	30		CIEDRO
CC#CC[NH2+][C@H](C)c1sc(-c2ccc(C)cc2)nc1C	ZINC000543516494	333878889	/nfs/dbraw/zinc/87/88/89/333878889.db2.gz	WLYAAEGFSVMBIX-CYBMUJFWSA-N	1	0	284.428	4.101	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](c1ccc(F)c(F)c1)C(C)C	ZINC000543777419	333898189	/nfs/dbraw/zinc/89/81/89/333898189.db2.gz	VONLRDQTQRWBGY-NHYWBVRUSA-N	1	0	253.336	4.216	20	30		CIEDRO
C[C@H](CCSc1ccccc1)[NH+]1CCC(CC#N)CC1	ZINC000543808025	333901014	/nfs/dbraw/zinc/90/10/14/333901014.db2.gz	WDWSNJHYGVKDLD-OAHLLOKOSA-N	1	0	288.460	4.183	20	30		CIEDRO
C[C@H](C[NH2+][C@@H](C)c1ccc(C#N)c(F)c1)c1ccccc1	ZINC000544573722	333936941	/nfs/dbraw/zinc/93/69/41/333936941.db2.gz	ULFXPSOOWSVTSU-KGLIPLIRSA-N	1	0	282.362	4.152	20	30		CIEDRO
Cc1cccc(C)c1[C@H](C)[NH2+]Cc1cccc(C#N)c1F	ZINC000545518406	333985900	/nfs/dbraw/zinc/98/59/00/333985900.db2.gz	UKTNRNXJAWTTBS-AWEZNQCLSA-N	1	0	282.362	4.165	20	30		CIEDRO
N#CCSCCC[N@@H+]1CCCCC[C@@H]1c1ccccc1	ZINC000074981933	334021684	/nfs/dbraw/zinc/02/16/84/334021684.db2.gz	TUKFPMDGOAZPCL-QGZVFWFLSA-N	1	0	288.460	4.251	20	30		CIEDRO
CC(C)CC[C@@H]([NH2+]Cc1ccc(C#N)o1)C(C)(C)C	ZINC000236609226	334058948	/nfs/dbraw/zinc/05/89/48/334058948.db2.gz	PKQUNBSMKWVTBS-OAHLLOKOSA-N	1	0	262.397	4.092	20	30		CIEDRO
C[C@@H](CCC1CCCC1)[NH2+]Cc1cccc(C#N)c1	ZINC000237545502	334090655	/nfs/dbraw/zinc/09/06/55/334090655.db2.gz	GJNLQCWOROZCAI-AWEZNQCLSA-N	1	0	256.393	4.007	20	30		CIEDRO
CCC(CC)[C@@H]([NH2+]Cc1ccc(C#N)o1)c1ccccc1	ZINC000135159699	334118400	/nfs/dbraw/zinc/11/84/00/334118400.db2.gz	VSVGDFMNWNONFL-GOSISDBHSA-N	1	0	282.387	4.418	20	30		CIEDRO
C[C@@H]([NH2+]Cc1cccc(Cl)c1F)c1ccc(C#N)cc1	ZINC000135376075	334128148	/nfs/dbraw/zinc/12/81/48/334128148.db2.gz	WIDYVDRRJHVGTM-LLVKDONJSA-N	1	0	288.753	4.202	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(F)c(C#N)c1)c1cc2ccccc2o1	ZINC000136239420	334150479	/nfs/dbraw/zinc/15/04/79/334150479.db2.gz	OOQOJLAKRKRUIC-GFCCVEGCSA-N	1	0	294.329	4.294	20	30		CIEDRO
N#Cc1cc(Cl)ccc1C[N@H+](C1CC1)C1CCCC1	ZINC000548487121	334160044	/nfs/dbraw/zinc/16/00/44/334160044.db2.gz	FWNJYDSGJSXZSX-UHFFFAOYSA-N	1	0	274.795	4.119	20	30		CIEDRO
C[C@@H]1CCc2c(F)cccc2[C@H]1[NH2+]Cc1ccc(C#N)cc1	ZINC000080339924	334170624	/nfs/dbraw/zinc/17/06/24/334170624.db2.gz	VXDIPKMKOKTQKI-YJYMSZOUSA-N	1	0	294.373	4.111	20	30		CIEDRO
CC[C@@H]1C[N@H+](CCCCC#N)CC[C@H]1c1ccccc1	ZINC000245409287	334190596	/nfs/dbraw/zinc/19/05/96/334190596.db2.gz	LJLOTFALLCKUPC-SJLPKXTDSA-N	1	0	270.420	4.196	20	30		CIEDRO
C=C(C)C[NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CC1	ZINC000549408355	334192952	/nfs/dbraw/zinc/19/29/52/334192952.db2.gz	KHLTWIDSVWADEU-CQSZACIVSA-N	1	0	269.310	4.322	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CC[C@@H](C#N)C1)c1ccc(Cl)cc1Cl	ZINC000549613833	334199718	/nfs/dbraw/zinc/19/97/18/334199718.db2.gz	RGSRQZPINOHQSR-CKYFFXLPSA-N	1	0	283.202	4.336	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([N@@H+]2CCCC3(CCCCC3)CC2)C1	ZINC000549612629	334199746	/nfs/dbraw/zinc/19/97/46/334199746.db2.gz	ULQGFTIHDGLWLD-HZPDHXFCSA-N	1	0	260.425	4.115	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@H](C2CC2)C1)c1ccc(C#N)cc1	ZINC000081632278	334201150	/nfs/dbraw/zinc/20/11/50/334201150.db2.gz	XKIMBVJRJRAPEY-DOPJRALCSA-N	1	0	268.404	4.178	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([N@@H+]2CCC[C@H](CCCc3ccccc3)C2)C1	ZINC000549915246	334208336	/nfs/dbraw/zinc/20/83/36/334208336.db2.gz	CCQVVPRXYZIHQS-XUVXKRRUSA-N	1	0	296.458	4.414	20	30		CIEDRO
Cc1c2ccccc2oc1[C@H](C)[NH2+][C@H]1CC[C@H](C#N)C1	ZINC000549931333	334209483	/nfs/dbraw/zinc/20/94/83/334209483.db2.gz	JADUSGRRLBRLDU-IHRRRGAJSA-N	1	0	268.360	4.084	20	30		CIEDRO
CCS[C@@H]1CCCC[C@@H]1[NH2+][C@H](C)c1cccc(C#N)c1	ZINC000245877238	334222563	/nfs/dbraw/zinc/22/25/63/334222563.db2.gz	KHZJKRNAIBNXMZ-XOKHGSTOSA-N	1	0	288.460	4.273	20	30		CIEDRO
CC[C@H]1CC[C@H]([NH2+][C@H](C)c2ccc(C#N)cc2F)CC1	ZINC000550830780	334229668	/nfs/dbraw/zinc/22/96/68/334229668.db2.gz	HJBUVCFKVFKQJI-UMVBOHGHSA-N	1	0	274.383	4.317	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@@H]1CCCc2c(O)cccc21	ZINC000550933358	334234198	/nfs/dbraw/zinc/23/41/98/334234198.db2.gz	RBEMGPQSGZDNHI-CZUORRHYSA-N	1	0	259.393	4.104	20	30		CIEDRO
CC[N@H+](C[C@@H]1CCC(F)(F)C1)[C@H](C)c1ccc(C#N)cc1	ZINC000551096978	334238690	/nfs/dbraw/zinc/23/86/90/334238690.db2.gz	YUUBLTDGSURFJZ-UKRRQHHQSA-N	1	0	292.373	4.377	20	30		CIEDRO
CC[C@H]1CCC[C@@H]([NH2+]C2(c3cccc(C#N)c3)CC2)C1	ZINC000551565107	334254593	/nfs/dbraw/zinc/25/45/93/334254593.db2.gz	BPCIIGFRKAXWQG-WMLDXEAASA-N	1	0	268.404	4.106	20	30		CIEDRO
Cc1ccc(C[NH2+]C2(c3cccc(C#N)c3)CC2)cc1Cl	ZINC000551581725	334255188	/nfs/dbraw/zinc/25/51/88/334255188.db2.gz	PZMRRSWTKSLLEF-UHFFFAOYSA-N	1	0	296.801	4.299	20	30		CIEDRO
CC1=CCC[C@H](C)[C@H]1C[NH2+]C1(c2cccc(C#N)c2)CC1	ZINC000551602721	334255721	/nfs/dbraw/zinc/25/57/21/334255721.db2.gz	LYJBEZGBIOBKFL-YJBOKZPZSA-N	1	0	280.415	4.129	20	30		CIEDRO
CC[N@H+](Cc1ccccc1C(C)(C)C#N)C1CCCC1	ZINC000551707732	334258646	/nfs/dbraw/zinc/25/86/46/334258646.db2.gz	QEACTNAQBPKXSB-UHFFFAOYSA-N	1	0	270.420	4.252	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@H](CO)CC1CCCC1)c1ccco1	ZINC000552055955	334282644	/nfs/dbraw/zinc/28/26/44/334282644.db2.gz	KUNMLWQYKRLZLR-IAGOWNOFSA-N	1	0	291.435	4.065	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@]1(C)CCO[C@H]1C1CC1)c1ccco1	ZINC000552067818	334284938	/nfs/dbraw/zinc/28/49/38/334284938.db2.gz	YXZHGIZRSCZSKU-RYQLBKOJSA-N	1	0	289.419	4.082	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@@](C)(O)C1CCCCC1)c1ccco1	ZINC000552068184	334285282	/nfs/dbraw/zinc/28/52/82/334285282.db2.gz	MIMDSGLNMKLKLD-SJLPKXTDSA-N	1	0	291.435	4.208	20	30		CIEDRO
N#Cc1cccc(C[N@H+]2CC[C@@H](c3cccc(Cl)c3)C2)c1	ZINC000552084846	334287163	/nfs/dbraw/zinc/28/71/63/334287163.db2.gz	BMYAVIAAFOUSSA-QGZVFWFLSA-N	1	0	296.801	4.201	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@H]1CCOc2ccccc21)c1ccco1	ZINC000552244925	334307510	/nfs/dbraw/zinc/30/75/10/334307510.db2.gz	NNIIYGHEKJUULR-NVXWUHKLSA-N	1	0	297.398	4.443	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@H]2CCC[C@@H]2Cc2ccccc2)C1	ZINC000248752217	334315930	/nfs/dbraw/zinc/31/59/30/334315930.db2.gz	FXNFEYLOLGOTNT-YRXWBPOGSA-N	1	0	282.431	4.070	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+][C@H](C)c1nc(C2CCCCC2)no1	ZINC000248840196	334319246	/nfs/dbraw/zinc/31/92/46/334319246.db2.gz	LDPOXMWFXMNVOF-BFHYXJOUSA-N	1	0	291.439	4.369	20	30		CIEDRO
CC[C@@H]1CCC[C@@H]([NH2+][C@H](C)c2ccc(C#N)cc2)C1	ZINC000251636394	334365964	/nfs/dbraw/zinc/36/59/64/334365964.db2.gz	FSIKGNYIANQGCM-CKEIUWERSA-N	1	0	256.393	4.178	20	30		CIEDRO
C[C@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1cccc(C#N)c1	ZINC000252139649	334374589	/nfs/dbraw/zinc/37/45/89/334374589.db2.gz	GFJBSHQFTJTDFY-GFCCVEGCSA-N	1	0	286.325	4.029	20	30		CIEDRO
C=C(C)CN1CCC([NH2+][C@@H](c2ccc(C)cc2)C2CC2)CC1	ZINC000091334270	334376506	/nfs/dbraw/zinc/37/65/06/334376506.db2.gz	GSCLYQZSSVTNFQ-FQEVSTJZSA-N	1	0	298.474	4.076	20	30		CIEDRO
C[C@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1ccc(C#N)cc1	ZINC000252257137	334377891	/nfs/dbraw/zinc/37/78/91/334377891.db2.gz	MZZPLURNNDSUBU-GFCCVEGCSA-N	1	0	286.325	4.029	20	30		CIEDRO
C[C@H]([NH2+][C@H]1[C@H](C)CCC[C@@H]1C)c1ccc(C#N)cc1	ZINC000252389971	334378986	/nfs/dbraw/zinc/37/89/86/334378986.db2.gz	LLCFSWDSRKJQLI-QDEZUTFSSA-N	1	0	256.393	4.034	20	30		CIEDRO
COc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(C#N)c(F)c2)cc1	ZINC000553790898	334399084	/nfs/dbraw/zinc/39/90/84/334399084.db2.gz	GIKRDHXTYZLBMO-QWHCGFSZSA-N	1	0	298.361	4.118	20	30		CIEDRO
CC(C)[C@H]1CC[C@@H](C)C[C@H]1[NH2+]CC(C)(C)CCC#N	ZINC000253028392	334408411	/nfs/dbraw/zinc/40/84/11/334408411.db2.gz	PFHGIITXNOQEEI-BZUAXINKSA-N	1	0	264.457	4.367	20	30		CIEDRO
C[C@@H](CCc1ccccc1F)[NH2+]CC(C)(C)CCC#N	ZINC000554067340	334408613	/nfs/dbraw/zinc/40/86/13/334408613.db2.gz	LDWRRKLWDIPRPQ-AWEZNQCLSA-N	1	0	276.399	4.066	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1	ZINC000554075053	334409581	/nfs/dbraw/zinc/40/95/81/334409581.db2.gz	OWLGWHLLXPPAMQ-QZTJIDSGSA-N	1	0	284.447	4.317	20	30		CIEDRO
C[C@@H](CCc1cccc(F)c1)[NH2+]CC(C)(C)CCC#N	ZINC000554359947	334424081	/nfs/dbraw/zinc/42/40/81/334424081.db2.gz	YFBALVXBGIFPGR-AWEZNQCLSA-N	1	0	276.399	4.066	20	30		CIEDRO
C[C@H](CC[NH2+][C@H]1CCc2ccc(C#N)cc21)c1ccccc1	ZINC000554997997	334464312	/nfs/dbraw/zinc/46/43/12/334464312.db2.gz	UYWHZDSRACTUNJ-QRWLVFNGSA-N	1	0	290.410	4.329	20	30		CIEDRO
CC[C@H]1CC[C@H]([NH2+][C@H](C)c2ccc(C#N)cc2)CC1	ZINC000556202246	334499692	/nfs/dbraw/zinc/49/96/92/334499692.db2.gz	OFGCJNGUDAVIOP-CKEIUWERSA-N	1	0	256.393	4.178	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H](CCCOC)c1ccc(F)cc1	ZINC000556218487	334500498	/nfs/dbraw/zinc/50/04/98/334500498.db2.gz	VBIHYMVQMDQSAU-QGZVFWFLSA-N	1	0	293.426	4.485	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C	ZINC000556218700	334500666	/nfs/dbraw/zinc/50/06/66/334500666.db2.gz	ZZQBAROIFUXXHH-CYBMUJFWSA-N	1	0	276.380	4.156	20	30		CIEDRO
C=C(C)CN1CCC([NH2+][C@@H](CC)c2ccc(C)cc2)CC1	ZINC000152950775	334529344	/nfs/dbraw/zinc/52/93/44/334529344.db2.gz	ZNTXNUZIPMTNTJ-IBGZPJMESA-N	1	0	286.463	4.076	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(CC#N)cc1)c1cccc(OC)c1	ZINC000566221937	334636908	/nfs/dbraw/zinc/63/69/08/334636908.db2.gz	XGTQVMCUAALZPW-IBGZPJMESA-N	1	0	294.398	4.002	20	30		CIEDRO
CCC[C@@H]([NH2+]Cc1ccc(CC#N)cc1)c1ccsc1	ZINC000566737812	334662503	/nfs/dbraw/zinc/66/25/03/334662503.db2.gz	OTKASUHVMBOXFT-QGZVFWFLSA-N	1	0	284.428	4.445	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccc(C#N)cc1	ZINC000268786768	334716060	/nfs/dbraw/zinc/71/60/60/334716060.db2.gz	CUWSLAKXEIAJDG-CABCVRRESA-N	1	0	293.414	4.036	20	30		CIEDRO
CSc1ccc2c(c1)[C@H]([NH2+]CCCCC#N)CCC2	ZINC000567588795	334737585	/nfs/dbraw/zinc/73/75/85/334737585.db2.gz	JVOPEIJCZACRHZ-MRXNPFEDSA-N	1	0	274.433	4.069	20	30		CIEDRO
C=CCC[NH2+][C@H](Cc1ccccc1)c1ccc(OC)cc1	ZINC000567653115	334746473	/nfs/dbraw/zinc/74/64/73/334746473.db2.gz	IRRDBWAKMOHJNN-LJQANCHMSA-N	1	0	281.399	4.145	20	30		CIEDRO
N#CCCC[NH2+][C@H]1CCC[C@H]1c1ccccc1C(F)(F)F	ZINC000156835635	334751182	/nfs/dbraw/zinc/75/11/82/334751182.db2.gz	NXCKTYVGMONGRZ-ZFWWWQNUSA-N	1	0	296.336	4.235	20	30		CIEDRO
N#Cc1ccc2c(c1)CCC[C@H]2[NH2+]C1CCC2(CC2)CC1	ZINC000568589778	334831773	/nfs/dbraw/zinc/83/17/73/334831773.db2.gz	JPXUCSYNZAXBDK-GOSISDBHSA-N	1	0	280.415	4.248	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]C/C=C\c1ccc(F)c(F)c1	ZINC000568667728	334835715	/nfs/dbraw/zinc/83/57/15/334835715.db2.gz	SBQOJUGOLLARKZ-WAYWQWQTSA-N	1	0	265.347	4.170	20	30		CIEDRO
C[C@@H](Cc1ccsc1)[N@H+](C)[C@@H](C)c1cccc(C#N)c1	ZINC000576631258	335227906	/nfs/dbraw/zinc/22/79/06/335227906.db2.gz	VQLCYVMQFNSHDJ-KBPBESRZSA-N	1	0	284.428	4.244	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@H](C)c1c(F)cncc1F	ZINC000577306758	335337642	/nfs/dbraw/zinc/33/76/42/335337642.db2.gz	VHVRKKLKLBKYET-NEPJUHHUSA-N	1	0	268.351	4.145	20	30		CIEDRO
C[C@H]([NH2+]C1CCC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000577534008	335366001	/nfs/dbraw/zinc/36/60/01/335366001.db2.gz	PVANOPZTXKKUDG-AWEZNQCLSA-N	1	0	276.383	4.428	20	30		CIEDRO
Cc1cc(C)cc([C@H](C)[NH2+]Cc2cc(C#N)cs2)c1	ZINC000177698109	335379768	/nfs/dbraw/zinc/37/97/68/335379768.db2.gz	DREVWYUYGHLJSR-ZDUSSCGKSA-N	1	0	270.401	4.087	20	30		CIEDRO
CC1(C)C[C@@H]([NH2+]Cc2ccc(C#N)cc2F)c2ccccc21	ZINC000177860013	335404168	/nfs/dbraw/zinc/40/41/68/335404168.db2.gz	IVCNNZNBFVNRTJ-GOSISDBHSA-N	1	0	294.373	4.210	20	30		CIEDRO
CC1(C)C[C@H]([NH2+]Cc2cccc(C#N)c2)c2ccccc21	ZINC000177898085	335405329	/nfs/dbraw/zinc/40/53/29/335405329.db2.gz	PQCVNXMOGWNHAF-SFHVURJKSA-N	1	0	276.383	4.070	20	30		CIEDRO
CC(C)Cc1ccc([C@@H](C)[NH2+]CCCCC#N)cc1	ZINC000178531557	335436305	/nfs/dbraw/zinc/43/63/05/335436305.db2.gz	XUEJJMGSQFOEDA-OAHLLOKOSA-N	1	0	258.409	4.230	20	30		CIEDRO
CC(C)CC[C@H]([NH2+]CCCSCC#N)C(C)(C)C	ZINC000179907927	335531179	/nfs/dbraw/zinc/53/11/79/335531179.db2.gz	KGBUMIBXQZFKQZ-AWEZNQCLSA-N	1	0	270.486	4.074	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)c1nc(-c2ccccc2)cs1	ZINC000180949572	335630709	/nfs/dbraw/zinc/63/07/09/335630709.db2.gz	YGKMNOGTCHEWKB-STQMWFEESA-N	1	0	272.417	4.425	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@H](CC2CC2)c2ccccc2)C1	ZINC000578414036	335631056	/nfs/dbraw/zinc/63/10/56/335631056.db2.gz	AHFTUEANACBYQM-RYQLBKOJSA-N	1	0	268.404	4.200	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(F)cc1C#N)c1ccc(C)cc1	ZINC000181704290	335779590	/nfs/dbraw/zinc/77/95/90/335779590.db2.gz	GNKKATUGWWZOHN-SFHVURJKSA-N	1	0	282.362	4.247	20	30		CIEDRO
Cc1csc([C@@H]([NH2+][C@@H](C)c2cccc(C#N)c2)C2CC2)n1	ZINC000181818043	335786794	/nfs/dbraw/zinc/78/67/94/335786794.db2.gz	DQRYJYMLGFIYGQ-LRDDRELGSA-N	1	0	297.427	4.125	20	30		CIEDRO
C[C@H]([NH2+]CCc1cc2ccccc2o1)c1cccc(C#N)c1	ZINC000181984794	335793506	/nfs/dbraw/zinc/79/35/06/335793506.db2.gz	DSMJIHHUQDFCLS-AWEZNQCLSA-N	1	0	290.366	4.198	20	30		CIEDRO
Cc1cc(C)c([C@H](C)[N@H+](C)CC(C)(C)C#N)c(C)c1	ZINC000581049372	336000801	/nfs/dbraw/zinc/00/08/01/336000801.db2.gz	QSFMKAWSNFXOGY-HNNXBMFYSA-N	1	0	258.409	4.154	20	30		CIEDRO
CC[C@@H](C)C[N@H+](C)Cc1ccc(C#N)cc1C(F)(F)F	ZINC000581223491	336026547	/nfs/dbraw/zinc/02/65/47/336026547.db2.gz	RKRZNUBEONFJRE-LLVKDONJSA-N	1	0	284.325	4.055	20	30		CIEDRO
C[C@H]1C[C@H](C(C)(C)C)CC[N@@H+]1CCCC(C)(C)C#N	ZINC000581241679	336029747	/nfs/dbraw/zinc/02/97/47/336029747.db2.gz	MOFXRAXWZHYPDH-LSDHHAIUSA-N	1	0	264.457	4.463	20	30		CIEDRO
CC[C@H](CC#N)[NH2+][C@@H]1C[C@H](C)C[C@H](c2ccccc2)C1	ZINC000383530496	336112394	/nfs/dbraw/zinc/11/23/94/336112394.db2.gz	AUOWQBLGNMVVIF-BZZMCLGOSA-N	1	0	270.420	4.241	20	30		CIEDRO
C[C@@H](c1ccccc1)[N@H+](C)CCCOc1cccc(C#N)c1	ZINC000383902745	336119169	/nfs/dbraw/zinc/11/91/69/336119169.db2.gz	CUGXOVXPKGYHCY-INIZCTEOSA-N	1	0	294.398	4.020	20	30		CIEDRO
C[C@@H]1c2c(F)cccc2CC[N@H+]1CCCCC(C)(C)C#N	ZINC000581705471	336131627	/nfs/dbraw/zinc/13/16/27/336131627.db2.gz	HVNGLLFAVYFNSO-CQSZACIVSA-N	1	0	288.410	4.465	20	30		CIEDRO
C=CCCC[N@@H+](Cc1ccc(OCC)cc1)C(C)C	ZINC000581847851	336151201	/nfs/dbraw/zinc/15/12/01/336151201.db2.gz	BRYSSWUBFQOFEH-UHFFFAOYSA-N	1	0	261.409	4.262	20	30		CIEDRO
C[C@H](C1CC1)[N@H+](CCC(C)(C)C#N)Cc1ccccc1	ZINC000385927396	336161907	/nfs/dbraw/zinc/16/19/07/336161907.db2.gz	MPRRFEYPRSYQKB-OAHLLOKOSA-N	1	0	270.420	4.227	20	30		CIEDRO
C=CCCCCC[N@H+]1CCCC[C@H]1c1nccn1CC	ZINC000581896857	336162713	/nfs/dbraw/zinc/16/27/13/336162713.db2.gz	BMPFVNGVHABKFA-INIZCTEOSA-N	1	0	275.440	4.176	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)c1ccccc1C(F)(F)F	ZINC000386782998	336179389	/nfs/dbraw/zinc/17/93/89/336179389.db2.gz	MRNYWQALMQZKHI-LLVKDONJSA-N	1	0	257.299	4.322	20	30		CIEDRO
CC(C)c1ccc(CC[NH2+]C2CCC(C)(C#N)CC2)cc1	ZINC000581983626	336184427	/nfs/dbraw/zinc/18/44/27/336184427.db2.gz	KNEQZVDPBNTPRP-UHFFFAOYSA-N	1	0	284.447	4.415	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)c1ccc2cc(OC)ccc2c1	ZINC000387334761	336192557	/nfs/dbraw/zinc/19/25/57/336192557.db2.gz	DNQMPMTXVQXLPH-CQSZACIVSA-N	1	0	269.388	4.465	20	30		CIEDRO
C[C@H]([NH2+]C[C@H](C#N)CCC#N)c1ccc(F)c2ccccc21	ZINC000352270373	533892888	/nfs/dbraw/zinc/89/28/88/533892888.db2.gz	FVIFHFQHYHMZHF-KBPBESRZSA-N	1	0	295.361	4.073	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccnn1C(C)C)c1ccccc1	ZINC000279777994	518721302	/nfs/dbraw/zinc/72/13/02/518721302.db2.gz	AQKAGXAXKYVWHJ-SFHVURJKSA-N	1	0	283.419	4.261	20	30		CIEDRO
CCCOc1ccc([C@H](C)[NH2+]Cc2ccc(C#N)cc2)cc1	ZINC000299430602	520428425	/nfs/dbraw/zinc/42/84/25/520428425.db2.gz	UWGWIUORKDRPSP-HNNXBMFYSA-N	1	0	294.398	4.198	20	30		CIEDRO
CCOc1ccc(C[NH2+][C@H](CC)c2ccc(C#N)cc2)cc1	ZINC000278238209	521009680	/nfs/dbraw/zinc/00/96/80/521009680.db2.gz	KZSXKVZCODSEDB-LJQANCHMSA-N	1	0	294.398	4.198	20	30		CIEDRO
N#CCCC[NH2+][C@@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1	ZINC000442852127	534613192	/nfs/dbraw/zinc/61/31/92/534613192.db2.gz	KUPMIRDHAHZYPP-DZGCQCFKSA-N	1	0	296.336	4.235	20	30		CIEDRO
N#CCCC[NH2+]CCCCc1ccc(Cl)c(Cl)c1	ZINC000354636916	534613587	/nfs/dbraw/zinc/61/35/87/534613587.db2.gz	OFIDXILCFBJMKK-UHFFFAOYSA-N	1	0	285.218	4.209	20	30		CIEDRO
CC[C@H]([NH2+]C1(c2cccc(C#N)c2)CC1)c1ccccc1F	ZINC000272652270	522560933	/nfs/dbraw/zinc/56/09/33/522560933.db2.gz	QBUGGONYVSPSPH-SFHVURJKSA-N	1	0	294.373	4.427	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CCc2ccccc21)c1ccc(C#N)cc1	ZINC000278163485	522722220	/nfs/dbraw/zinc/72/22/20/522722220.db2.gz	BVAMAWXFRLUSCK-RBUKOAKNSA-N	1	0	276.383	4.286	20	30		CIEDRO
CC[C@@H]([NH2+]C[C@H](C)c1ncc(C)s1)c1ccc(C#N)cc1	ZINC000278776433	522858034	/nfs/dbraw/zinc/85/80/34/522858034.db2.gz	PNMJFENHZXPXHA-BLLLJJGKSA-N	1	0	299.443	4.168	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H](CC)c1ccncc1)c1ccc(C#N)cc1	ZINC000278747702	522918984	/nfs/dbraw/zinc/91/89/84/522918984.db2.gz	NROGKRHJRBAUAR-MSOLQXFVSA-N	1	0	279.387	4.145	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc([C@@H]2C[C@H]2C)o1)c1ccc(C#N)cc1	ZINC000035256423	525449630	/nfs/dbraw/zinc/44/96/30/525449630.db2.gz	GVTUZJOBGUOVIL-IIYDPXPESA-N	1	0	280.371	4.125	20	30		CIEDRO
C[C@H]([NH2+][C@@H](C)c1ccc(Cl)cn1)c1ccc(C#N)cc1	ZINC000274972901	525530347	/nfs/dbraw/zinc/53/03/47/525530347.db2.gz	YHXMWBCDFOILHL-RYUDHWBXSA-N	1	0	285.778	4.018	20	30		CIEDRO
Cc1cc2c(o1)CC(C)(C)C[C@H]2[NH2+]Cc1cccc(C#N)c1	ZINC000042797765	525628629	/nfs/dbraw/zinc/62/86/29/525628629.db2.gz	VFWJQBKNPCUVQY-QGZVFWFLSA-N	1	0	294.398	4.263	20	30		CIEDRO
Cc1c([C@@H](C)[NH2+][C@@H](C)c2ccc(C#N)cc2)cnn1C(C)C	ZINC000276369598	525900846	/nfs/dbraw/zinc/90/08/46/525900846.db2.gz	OFUZVXWNZIAOIM-UONOGXRCSA-N	1	0	296.418	4.056	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H](c2ccccc2)C2CCC2)cc1	ZINC000104701826	526624182	/nfs/dbraw/zinc/62/41/82/526624182.db2.gz	YBBMWQVJIYNLAT-IBGZPJMESA-N	1	0	276.383	4.189	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]Cc1cnc(-c2ccccc2)s1	ZINC000344717600	526999397	/nfs/dbraw/zinc/99/93/97/526999397.db2.gz	BMNPAWKKPOXNQY-UHFFFAOYSA-N	1	0	299.443	4.230	20	30		CIEDRO
C=CCCCC[NH2+][C@H]1CCSc2ccc(OC)cc21	ZINC000343501321	527171007	/nfs/dbraw/zinc/17/10/07/527171007.db2.gz	JGFTWIOOLTUZJB-HNNXBMFYSA-N	1	0	277.433	4.178	20	30		CIEDRO
C=CCCC[NH+]1CCC(OC2CCC(C)CC2)CC1	ZINC000344584186	527197101	/nfs/dbraw/zinc/19/71/01/527197101.db2.gz	OMSOUWBPXDEIEC-UHFFFAOYSA-N	1	0	265.441	4.012	20	30		CIEDRO
CCC[C@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1ccccc1	ZINC000192607765	528240357	/nfs/dbraw/zinc/24/03/57/528240357.db2.gz	ZDMSMGWCQZYRNE-XIRDDKMYSA-N	1	0	256.393	4.200	20	30		CIEDRO
CC(C)[C@H]([NH2+]C[C@H](C#N)CCC#N)c1ccc(Cl)cc1	ZINC000356114113	529122375	/nfs/dbraw/zinc/12/23/75/529122375.db2.gz	QBMBJGUOAVNLQJ-BBRMVZONSA-N	1	0	289.810	4.070	20	30		CIEDRO
C[C@@H]([NH2+]CCC(C)(C)C1CC1)c1ccc(C#N)cc1F	ZINC000573462999	334940069	/nfs/dbraw/zinc/94/00/69/334940069.db2.gz	CDKDKWKHWKVMSQ-GFCCVEGCSA-N	1	0	274.383	4.174	20	30		CIEDRO
C=CCCC[NH2+]Cc1cc(Cl)c(OC)cc1Cl	ZINC000573532710	334944865	/nfs/dbraw/zinc/94/48/65/334944865.db2.gz	APDHQBAUAKXOII-UHFFFAOYSA-N	1	0	274.191	4.058	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+]C[C@H](OC)c1ccc(Cl)cc1	ZINC000532234337	328709579	/nfs/dbraw/zinc/70/95/79/328709579.db2.gz	RGFDSVBGHDBURT-ZENOOKHLSA-N	1	0	281.827	4.218	20	30		CIEDRO
C=C(C)C[N@H+](Cc1ccco1)Cc1ccc(C)s1	ZINC000519987902	260039892	/nfs/dbraw/zinc/03/98/92/260039892.db2.gz	VQOLGBMJNXMRCM-UHFFFAOYSA-N	1	0	261.390	4.228	20	30		CIEDRO
C[C@@H]([NH2+]C1CCC(C)(C#N)CC1)c1ccc(F)cc1F	ZINC000336208654	533338219	/nfs/dbraw/zinc/33/82/19/533338219.db2.gz	XLIVYDSUOILQDI-FFKNIBCLSA-N	1	0	278.346	4.088	20	30		CIEDRO
C[C@@H](CCc1ccc(Cl)s1)[NH2+]CCCCC#N	ZINC000344477387	533655247	/nfs/dbraw/zinc/65/52/47/533655247.db2.gz	AAJVOUQKSGGSMK-NSHDSACASA-N	1	0	270.829	4.006	20	30		CIEDRO
N#Cc1ccc2c(c1)CCC[C@H]2[NH2+][C@H]1CCc2ccccc21	ZINC000341756579	130024408	/nfs/dbraw/zinc/02/44/08/130024408.db2.gz	FRWUWNLCOPKQOB-UXHICEINSA-N	1	0	288.394	4.213	20	30		CIEDRO
Cc1ccc(C[NH2+][C@@H]2CCCc3cc(C#N)ccc32)s1	ZINC000341758183	130026114	/nfs/dbraw/zinc/02/61/14/130026114.db2.gz	OAUMUZYCGKKWMI-QGZVFWFLSA-N	1	0	282.412	4.095	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](Cc1ccccc1Cl)C1CC1	ZINC000576722256	335240072	/nfs/dbraw/zinc/24/00/72/335240072.db2.gz	JXWZVZVRPHVXIS-MLGOLLRUSA-N	1	0	263.812	4.215	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H]2CCc3ccccc32)cc1	ZINC000020130103	171018660	/nfs/dbraw/zinc/01/86/60/171018660.db2.gz	SHAKCJIBKXKZQW-LJQANCHMSA-N	1	0	279.383	4.029	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(Cl)cc1)c1ccc(C#N)cc1	ZINC000020209661	171073272	/nfs/dbraw/zinc/07/32/72/171073272.db2.gz	SFIKGTVQJHJMFX-GFCCVEGCSA-N	1	0	270.763	4.062	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H](C)Cc2cccs2)cc1	ZINC000035253943	172083184	/nfs/dbraw/zinc/08/31/84/172083184.db2.gz	KPBMDRCPLZETKL-CQSZACIVSA-N	1	0	287.428	4.034	20	30		CIEDRO
Cc1cc(C)c(C[NH2+][C@H](C)c2ccc(C#N)cc2)c(C)c1	ZINC000035256344	172086443	/nfs/dbraw/zinc/08/64/43/172086443.db2.gz	VZZKEUGLTCFZTH-MRXNPFEDSA-N	1	0	278.399	4.334	20	30		CIEDRO
C[C@@H]([NH2+]Cc1cc2ccccc2o1)c1ccc(C#N)cc1	ZINC000035256402	172087013	/nfs/dbraw/zinc/08/70/13/172087013.db2.gz	YKRVQLJANWBPPB-CYBMUJFWSA-N	1	0	276.339	4.155	20	30		CIEDRO
C=CCC[C@@H]([NH2+][C@@H](C)c1nccnc1C)c1ccccc1	ZINC000188252015	260075799	/nfs/dbraw/zinc/07/57/99/260075799.db2.gz	ZROXVAYTRJOMJA-DOTOQJQBSA-N	1	0	281.403	4.143	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H]1CCCc2c3cc(C)ccc3[nH]c21	ZINC000575166095	335074378	/nfs/dbraw/zinc/07/43/78/335074378.db2.gz	XISVBNLYCNPBDV-GUYCJALGSA-N	1	0	268.404	4.408	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H]1CCCc2c3cc(C)ccc3[nH]c21	ZINC000575166094	335074393	/nfs/dbraw/zinc/07/43/93/335074393.db2.gz	XISVBNLYCNPBDV-DYVFJYSZSA-N	1	0	268.404	4.408	20	30		CIEDRO
Cc1ccnc([C@H]2CC[N@H+](CCC3(C#N)CCCCC3)C2)c1	ZINC000575192980	335078635	/nfs/dbraw/zinc/07/86/35/335078635.db2.gz	UAHGZDRGADCNEB-KRWDZBQOSA-N	1	0	297.446	4.044	20	30		CIEDRO
Cc1ccc(C[NH2+][C@H](CCCC#N)c2ccccc2)o1	ZINC000353913773	226815063	/nfs/dbraw/zinc/81/50/63/226815063.db2.gz	JPDSQFDGVKWHRW-QGZVFWFLSA-N	1	0	268.360	4.113	20	30		CIEDRO
COc1ccccc1C[NH2+][C@@H](CCCC#N)c1ccccc1	ZINC000353915856	226817625	/nfs/dbraw/zinc/81/76/25/226817625.db2.gz	NLTNMENVNUMMRM-SFHVURJKSA-N	1	0	294.398	4.220	20	30		CIEDRO
C[C@@H]([NH2+]CCCCC#N)C1CCC(C(F)(F)F)CC1	ZINC000354346295	226964338	/nfs/dbraw/zinc/96/43/38/226964338.db2.gz	HCHLCEUAAYFQQZ-PNESKVBLSA-N	1	0	276.346	4.027	20	30		CIEDRO
C[C@H](c1cccc(C#N)c1)[N@@H+]1CCC=C(c2ccco2)C1	ZINC000352544174	227050071	/nfs/dbraw/zinc/05/00/71/227050071.db2.gz	OOEGYWNBIVCFMH-CQSZACIVSA-N	1	0	278.355	4.002	20	30		CIEDRO
C[C@H](c1ccc(C#N)cc1)[N@@H+]1CCC=C(c2ccco2)C1	ZINC000352562322	227067566	/nfs/dbraw/zinc/06/75/66/227067566.db2.gz	JMECNWRNGKEMHU-CQSZACIVSA-N	1	0	278.355	4.002	20	30		CIEDRO
N#CCCCC[NH+]1CCC([C@H](F)c2ccccc2F)CC1	ZINC000367152296	228092738	/nfs/dbraw/zinc/09/27/38/228092738.db2.gz	TUQPWHHRTJMTCL-KRWDZBQOSA-N	1	0	292.373	4.242	20	30		CIEDRO
Cc1ccc([C@@H]2CCCCN2Cc2nc(C#N)cs2)cc1	ZINC000356108007	228124135	/nfs/dbraw/zinc/12/41/35/228124135.db2.gz	ICMNUDQBJDRUNS-INIZCTEOSA-N	1	0	297.427	4.050	20	30		CIEDRO
COc1ccccc1[C@@H]1CC[C@@H](C)C[N@@H+]1CCCCC#N	ZINC000352246285	228206252	/nfs/dbraw/zinc/20/62/52/228206252.db2.gz	OTJIUIUEOADTMC-WBVHZDCISA-N	1	0	286.419	4.162	20	30		CIEDRO
COc1ccccc1[C@@H]1CC[C@H](C)C[N@@H+]1CCCCC#N	ZINC000352246284	228206275	/nfs/dbraw/zinc/20/62/75/228206275.db2.gz	OTJIUIUEOADTMC-RDJZCZTQSA-N	1	0	286.419	4.162	20	30		CIEDRO
Cc1cc([C@@H](C)[NH2+]C2CCC(C)(C#N)CC2)c(C)o1	ZINC000336222329	228217402	/nfs/dbraw/zinc/21/74/02/228217402.db2.gz	WRMZMUOSPOZVDF-XEBKBJJBSA-N	1	0	260.381	4.020	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@H](OCC)c1ccccc1)C1CC1	ZINC000447558885	260052942	/nfs/dbraw/zinc/05/29/42/260052942.db2.gz	QQDDBGGZVKFXEH-ROUUACIJSA-N	1	0	273.420	4.099	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1CCC[C@@H](c2cccnc2)C1	ZINC000367896481	260075405	/nfs/dbraw/zinc/07/54/05/260075405.db2.gz	AZAYTPONEWLQJM-NVXWUHKLSA-N	1	0	285.435	4.027	20	30		CIEDRO
Cc1ccc2c(c1)[C@H]([NH2+][C@@H](C)c1cccc(C#N)c1)[C@@H](C)C2	ZINC000180230069	260096120	/nfs/dbraw/zinc/09/61/20/260096120.db2.gz	BOUWKWIYXYHVRZ-AUSJPIAWSA-N	1	0	290.410	4.451	20	30		CIEDRO
Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C#N)cc1F)[C@@H](C)C2	ZINC000180479666	260103698	/nfs/dbraw/zinc/10/36/98/260103698.db2.gz	XPOIDUXLDFMVOR-ORAYPTAESA-N	1	0	294.373	4.029	20	30		CIEDRO
Cc1ccc([C@@H]([NH2+]Cc2cccc(C#N)c2)C2CC2)cc1	ZINC000037490523	260112023	/nfs/dbraw/zinc/11/20/23/260112023.db2.gz	AUAKNICSKNCEMT-LJQANCHMSA-N	1	0	276.383	4.108	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H](C)c1cccc(F)c1F	ZINC000394128006	260112107	/nfs/dbraw/zinc/11/21/07/260112107.db2.gz	BXVQHPFEPXMHCM-NSHDSACASA-N	1	0	253.336	4.218	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@@H]2CCCCc3ccccc32)c1	ZINC000037748577	260116042	/nfs/dbraw/zinc/11/60/42/260116042.db2.gz	KVEGLLSPMCVIMB-LJQANCHMSA-N	1	0	276.383	4.116	20	30		CIEDRO
C[C@@H]([NH2+]Cc1cccc(C#N)c1)c1cnc2ccsc2c1	ZINC000068691330	260146165	/nfs/dbraw/zinc/14/61/65/260146165.db2.gz	DWIXPNKZNAXTJK-GFCCVEGCSA-N	1	0	293.395	4.019	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1ccc(F)cc1Br	ZINC000309456129	260169987	/nfs/dbraw/zinc/16/99/87/260169987.db2.gz	MLQJDGRAMILSQR-GFCCVEGCSA-N	1	0	286.188	4.033	20	30		CIEDRO
CC(C)(C)C1CC[NH+](CCCC(C)(C)C#N)CC1	ZINC000087608678	260192318	/nfs/dbraw/zinc/19/23/18/260192318.db2.gz	OGRCDWXYJHBTNH-UHFFFAOYSA-N	1	0	250.430	4.074	20	30		CIEDRO
Cc1cccc(C(C)(C)C[NH2+]C2CCC(C)(C#N)CC2)c1	ZINC000449108771	260221759	/nfs/dbraw/zinc/22/17/59/260221759.db2.gz	VMSGUBLWHNLSNF-UHFFFAOYSA-N	1	0	284.447	4.335	20	30		CIEDRO
C[N@H+](CC(C)(C)CCC#N)C1CC(c2ccccc2)C1	ZINC000374258226	260252927	/nfs/dbraw/zinc/25/29/27/260252927.db2.gz	IXIUDIOCZUMZAI-UHFFFAOYSA-N	1	0	270.420	4.194	20	30		CIEDRO
C=CC[C@H](C)[NH2+]Cc1cnc(-c2c(F)cccc2F)s1	ZINC000449150095	260258336	/nfs/dbraw/zinc/25/83/36/260258336.db2.gz	QAJWAPVALDLYDT-JTQLQIEISA-N	1	0	294.370	4.143	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@H]1CC[C@H](c2ccccc2)O1)C1CC1	ZINC000517778007	260305124	/nfs/dbraw/zinc/30/51/24/260305124.db2.gz	PSBFSQYKTSFMML-GUDVDZBRSA-N	1	0	285.431	4.241	20	30		CIEDRO
C[N@H+](CCCC(C)(C)C#N)[C@H]1CC[C@@H](C(F)(F)F)CC1	ZINC000517778372	260306142	/nfs/dbraw/zinc/30/61/42/260306142.db2.gz	WDLCTCUCEYMYCC-BETUJISGSA-N	1	0	290.373	4.369	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCc2ccc(C#N)cc21)C1CCCCC1	ZINC000517786900	260306921	/nfs/dbraw/zinc/30/69/21/260306921.db2.gz	HAMUBUIKHZLTKP-ACJLOTCBSA-N	1	0	268.404	4.104	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCc2ccc(C#N)cc21)C1CCCCC1	ZINC000517786902	260307096	/nfs/dbraw/zinc/30/70/96/260307096.db2.gz	HAMUBUIKHZLTKP-SCLBCKFNSA-N	1	0	268.404	4.104	20	30		CIEDRO
C=C(C[NH2+][C@H](C)c1ccc(C)s1)c1ccccc1	ZINC000211851720	260381394	/nfs/dbraw/zinc/38/13/94/260381394.db2.gz	SJOCHOYSNFFMAR-CQSZACIVSA-N	1	0	257.402	4.421	20	30		CIEDRO
CC(C)Oc1cccc(C[NH2+][C@H](C)c2ccc(C#N)cc2)c1	ZINC000129318953	260385267	/nfs/dbraw/zinc/38/52/67/260385267.db2.gz	SNVKJXSLGNCQIW-OAHLLOKOSA-N	1	0	294.398	4.196	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(-c3ccco3)cc2F)C1	ZINC000448020808	260566286	/nfs/dbraw/zinc/56/62/86/260566286.db2.gz	FAQJDRVYHDOARQ-CZUORRHYSA-N	1	0	298.361	4.258	20	30		CIEDRO
C[C@H]1CCCC[C@@H]1[NH2+]Cc1cccc(OCCCC#N)c1	ZINC000237542311	260695404	/nfs/dbraw/zinc/69/54/04/260695404.db2.gz	MUVHMBUKIYJHIU-YJBOKZPZSA-N	1	0	286.419	4.037	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@@H]1CCO[C@H](c2cccs2)C1	ZINC000449633046	260773690	/nfs/dbraw/zinc/77/36/90/260773690.db2.gz	YITKFYDERRYOFO-ZNMIVQPWSA-N	1	0	279.449	4.303	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@H]1CC[C@H]1SC)c1ccccc1	ZINC000448125171	260851947	/nfs/dbraw/zinc/85/19/47/260851947.db2.gz	KJAVFVVUHZIXQE-HRCADAONSA-N	1	0	261.434	4.178	20	30		CIEDRO
CSc1cc(C)ccc1C[NH2+]CC(C)(C)CCC#N	ZINC000153578096	261080328	/nfs/dbraw/zinc/08/03/28/261080328.db2.gz	AKNPTJMRRZLWCW-UHFFFAOYSA-N	1	0	276.449	4.137	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](C)c1ccc(F)c(Br)c1	ZINC000161671031	261114525	/nfs/dbraw/zinc/11/45/25/261114525.db2.gz	YDHJKNDBEHHBKZ-NXEZZACHSA-N	1	0	286.188	4.203	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](C)c1ccc(F)c(Br)c1	ZINC000161670751	261114545	/nfs/dbraw/zinc/11/45/45/261114545.db2.gz	YDHJKNDBEHHBKZ-ZJUUUORDSA-N	1	0	286.188	4.203	20	30		CIEDRO
C=CCC[C@H](O)C[N@@H+]1CCCC[C@H]1c1cccc(Cl)c1	ZINC000444807441	261182472	/nfs/dbraw/zinc/18/24/72/261182472.db2.gz	WQXWOGTVTMJSHZ-IRXDYDNUSA-N	1	0	293.838	4.194	20	30		CIEDRO
CC#CCC[N@@H+]1CCC[C@@H]1c1nc2ccccc2n1C(C)C	ZINC000462358795	261191768	/nfs/dbraw/zinc/19/17/68/261191768.db2.gz	MFORPUNEFXZPTA-GOSISDBHSA-N	1	0	295.430	4.168	20	30		CIEDRO
N#CCCCC[N@H+](C1CC1)[C@H]1CCCc2ccccc21	ZINC000102397861	261232442	/nfs/dbraw/zinc/23/24/42/261232442.db2.gz	NKQCNNNDMSWODI-SFHVURJKSA-N	1	0	268.404	4.222	20	30		CIEDRO
C[C@@H]([NH2+][C@H](C)c1cccc(F)c1F)c1ccc(C#N)cc1	ZINC000179478443	261417138	/nfs/dbraw/zinc/41/71/38/261417138.db2.gz	CCVUZVSAHVPXEG-VXGBXAGGSA-N	1	0	286.325	4.248	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@H]2CCCC[C@H]2c2ccccc2)c1	ZINC000314533733	261745118	/nfs/dbraw/zinc/74/51/18/261745118.db2.gz	BUPLMGPWDMXMAY-PMACEKPBSA-N	1	0	290.410	4.374	20	30		CIEDRO
C[C@@H]1CCc2ccccc2[C@@H]1[NH2+]Cc1ccc(C#N)s1	ZINC000179394806	261783401	/nfs/dbraw/zinc/78/34/01/261783401.db2.gz	IWYJWMWLGVTSQV-SJKOYZFVSA-N	1	0	282.412	4.033	20	30		CIEDRO
N#CCCCC[NH2+][C@H](Cc1ccccc1)c1ccccc1F	ZINC000179810434	261816867	/nfs/dbraw/zinc/81/68/67/261816867.db2.gz	POYITFSOSKWVDZ-LJQANCHMSA-N	1	0	296.389	4.393	20	30		CIEDRO
C=CCC[NH2+][C@@H](CC)c1cc(F)cc(Br)c1	ZINC000309726323	262006578	/nfs/dbraw/zinc/00/65/78/262006578.db2.gz	YAZABVPZYRTSKO-ZDUSSCGKSA-N	1	0	286.188	4.205	20	30		CIEDRO
CC(C)Oc1cccc([C@@H](C)[NH2+][C@H]2CCC[C@H](C#N)C2)c1	ZINC000185780414	262070822	/nfs/dbraw/zinc/07/08/22/262070822.db2.gz	WXIOKJFLQSYHQI-VYDXJSESSA-N	1	0	286.419	4.207	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@H](C)c1cc2cccc(OC)c2o1	ZINC000393805907	262190611	/nfs/dbraw/zinc/19/06/11/262190611.db2.gz	WOUSRBZBHXAXJT-TZMCWYRMSA-N	1	0	273.376	4.447	20	30		CIEDRO
C[N@H+](Cc1cccc(C#N)c1)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000497760100	262202209	/nfs/dbraw/zinc/20/22/09/262202209.db2.gz	WYKWYIXPNIWBNL-VQTJNVASSA-N	1	0	290.410	4.326	20	30		CIEDRO
Cc1ccc(C[NH+]2CCCC2)cc1N[C@@H]1CCC[C@@H](C#N)C1	ZINC000193268942	262219751	/nfs/dbraw/zinc/21/97/51/262219751.db2.gz	NMKQUSICQOLLBV-SJLPKXTDSA-N	1	0	297.446	4.085	20	30		CIEDRO
C=CCCCCC[NH2+][C@H](C)c1cn(C(C)(C)C)nc1C	ZINC000488336220	262313655	/nfs/dbraw/zinc/31/36/55/262313655.db2.gz	UDTFBMHHIOSSLA-CQSZACIVSA-N	1	0	277.456	4.344	20	30		CIEDRO
C=CCCC[N@@H+](C)Cc1ccc(Cl)c(Cl)c1	ZINC000522775320	262340737	/nfs/dbraw/zinc/34/07/37/262340737.db2.gz	MTRDYCMZFXLPFJ-UHFFFAOYSA-N	1	0	258.192	4.391	20	30		CIEDRO
CC(C)(C#N)CCCC[N@@H+]1CCC[C@@H](c2nccs2)C1	ZINC000365440248	262365527	/nfs/dbraw/zinc/36/55/27/262365527.db2.gz	AUQATOGIYVDDAR-CQSZACIVSA-N	1	0	291.464	4.043	20	30		CIEDRO
C[C@H](CCc1ccccc1)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000021013436	262373941	/nfs/dbraw/zinc/37/39/41/262373941.db2.gz	RSOOXBHDWNHRAE-CVEARBPZSA-N	1	0	278.399	4.230	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@H]1CCCc2sccc21	ZINC000061360068	262394991	/nfs/dbraw/zinc/39/49/91/262394991.db2.gz	XRHCGSDGYOMVBC-INIZCTEOSA-N	1	0	299.439	4.480	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H]1CCSc2ccc(Cl)cc21	ZINC000163334371	262396742	/nfs/dbraw/zinc/39/67/42/262396742.db2.gz	ZCKGIDWBHNOAIN-GXFFZTMASA-N	1	0	267.825	4.431	20	30		CIEDRO
CCc1cnccc1[C@H](C)[NH2+]CCC1(C#N)CCCCC1	ZINC000411507697	262696641	/nfs/dbraw/zinc/69/66/41/262696641.db2.gz	SJPMGUJWHWUFIN-HNNXBMFYSA-N	1	0	285.435	4.159	20	30		CIEDRO
C[C@@H](CCC#N)[NH2+][C@H](c1ccc(F)c(Cl)c1)C1CC1	ZINC000411797225	262706872	/nfs/dbraw/zinc/70/68/72/262706872.db2.gz	UCCLHMLJTSYBMF-BONVTDFDSA-N	1	0	280.774	4.212	20	30		CIEDRO
CC[C@H]([NH2+][C@H](CCCC#N)c1ccccc1)[C@@H]1C[C@@H]1C	ZINC000414146625	262810362	/nfs/dbraw/zinc/81/03/62/262810362.db2.gz	QMQKYIYJWGRSOU-XOYOTBSWSA-N	1	0	270.420	4.446	20	30		CIEDRO
C[C@@H]([NH2+]C1(C2CCC2)CCC1)c1ccc(C#N)c(F)c1	ZINC000414175852	262814609	/nfs/dbraw/zinc/81/46/09/262814609.db2.gz	INGAFSJCQFSNHE-GFCCVEGCSA-N	1	0	272.367	4.071	20	30		CIEDRO
N#CCC1(C[NH2+][C@@H]2CC[C@@H](c3cccc(Cl)c3)C2)CC1	ZINC000414156872	262818593	/nfs/dbraw/zinc/81/85/93/262818593.db2.gz	VKHBWVRPQWOCNA-GDBMZVCRSA-N	1	0	288.822	4.260	20	30		CIEDRO
CCC[C@H]([NH2+]CC(C)(C)CC#N)c1ccsc1	ZINC000414158945	262818812	/nfs/dbraw/zinc/81/88/12/262818812.db2.gz	AUESMXDGJMYCQH-ZDUSSCGKSA-N	1	0	250.411	4.119	20	30		CIEDRO
CC(C)C[C@@H]([NH2+]CC(C)(C)CC#N)c1cccs1	ZINC000414165751	262819979	/nfs/dbraw/zinc/81/99/79/262819979.db2.gz	MRNBGUKCTLBBGD-CYBMUJFWSA-N	1	0	264.438	4.365	20	30		CIEDRO
Cc1cc(C[NH2+][C@H]2CC[C@@H](CC#N)C2)ccc1C(F)(F)F	ZINC000414476242	262954424	/nfs/dbraw/zinc/95/44/24/262954424.db2.gz	ZUSKMNRXBBXHRO-JSGCOSHPSA-N	1	0	296.336	4.186	20	30		CIEDRO
C[C@@H]([NH2+]CCC(C)(C)C#N)c1ccc(F)cc1Cl	ZINC000272034262	263001537	/nfs/dbraw/zinc/00/15/37/263001537.db2.gz	PUWUEUNEOQFPFA-SNVBAGLBSA-N	1	0	268.763	4.070	20	30		CIEDRO
C[C@@H](CCSc1ccccc1)[NH+]1CCC(C)(C#N)CC1	ZINC000272587339	263007374	/nfs/dbraw/zinc/00/73/74/263007374.db2.gz	PAEAASBMUAWGMJ-HNNXBMFYSA-N	1	0	288.460	4.183	20	30		CIEDRO
Cc1cccc([C@H]2CC[N@H+](CC(C)(C)CCC#N)C2)c1	ZINC000273230551	263014203	/nfs/dbraw/zinc/01/42/03/263014203.db2.gz	WVMGJCRLTLMVKF-KRWDZBQOSA-N	1	0	270.420	4.114	20	30		CIEDRO
N#CCCC[NH2+][C@H]1CCCc2nc(-c3ccccc3)sc21	ZINC000273275852	263014532	/nfs/dbraw/zinc/01/45/32/263014532.db2.gz	PLWZFJFLHKPPKV-AWEZNQCLSA-N	1	0	297.427	4.081	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1nc(-c2ccccc2)cs1	ZINC000274603162	263027514	/nfs/dbraw/zinc/02/75/14/263027514.db2.gz	IIQYMKPKTYLEIZ-KCQAQPDRSA-N	1	0	297.427	4.153	20	30		CIEDRO
COc1ccc2oc([C@H](C)[NH2+][C@@H]3CC[C@H](C#N)C3)c(C)c2c1	ZINC000274603126	263027524	/nfs/dbraw/zinc/02/75/24/263027524.db2.gz	IHLFRACDXXCYNJ-MELADBBJSA-N	1	0	298.386	4.093	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+]C(c2ccccc2)c2ccccc2)C1	ZINC000274617282	263027907	/nfs/dbraw/zinc/02/79/07/263027907.db2.gz	LNTYJGCDCONUFY-QAPCUYQASA-N	1	0	276.383	4.058	20	30		CIEDRO
C[C@@H](CCC#N)[NH+]1CCC(c2c[nH]c3ccccc32)CC1	ZINC000276319166	263035942	/nfs/dbraw/zinc/03/59/42/263035942.db2.gz	ODVFWIFNUBTDJJ-AWEZNQCLSA-N	1	0	281.403	4.040	20	30		CIEDRO
C[C@H](CCC#N)[NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CC1	ZINC000276339148	263036291	/nfs/dbraw/zinc/03/62/91/263036291.db2.gz	SVJOZVFAXUNYDY-IAQYHMDHSA-N	1	0	296.336	4.438	20	30		CIEDRO
CC(C)[C@@H]1C[C@H]([NH2+]CCCCC#N)c2ccccc21	ZINC000278875563	263051644	/nfs/dbraw/zinc/05/16/44/263051644.db2.gz	XJYZLJXZCZIVHC-IRXDYDNUSA-N	1	0	256.393	4.154	20	30		CIEDRO
Cc1oc2ccccc2c1C[NH2+]CC1CCC(C#N)CC1	ZINC000281591161	263070597	/nfs/dbraw/zinc/07/05/97/263070597.db2.gz	FBDZIUAXGDINFI-UHFFFAOYSA-N	1	0	282.387	4.161	20	30		CIEDRO
CC1(C)CCc2ccccc2[C@H]([NH2+]C[C@H](C#N)CCC#N)C1	ZINC000281701003	263071280	/nfs/dbraw/zinc/07/12/80/263071280.db2.gz	NVJDWUAZLMHLDP-MAUKXSAKSA-N	1	0	295.430	4.123	20	30		CIEDRO
CC1(C)CCc2ccccc2[C@@H]([NH2+]C[C@@H](C#N)CCC#N)C1	ZINC000281701006	263071289	/nfs/dbraw/zinc/07/12/89/263071289.db2.gz	NVJDWUAZLMHLDP-QAPCUYQASA-N	1	0	295.430	4.123	20	30		CIEDRO
CC[C@H]([NH2+]CC1CCC(C#N)CC1)c1ccccc1F	ZINC000282207311	263075024	/nfs/dbraw/zinc/07/50/24/263075024.db2.gz	HGHAGTRQVVNVNA-KVULBXGLSA-N	1	0	274.383	4.196	20	30		CIEDRO
C[C@@H]([NH2+]CC1CCC(C#N)CC1)[C@H](C)c1ccccc1	ZINC000282328098	263075846	/nfs/dbraw/zinc/07/58/46/263075846.db2.gz	NYMABBQPRXGPGT-NJINODPHSA-N	1	0	270.420	4.098	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccc(OCC#N)cc1)c1cccc(C)c1	ZINC000286176494	263097455	/nfs/dbraw/zinc/09/74/55/263097455.db2.gz	QQLCOKVBEUWNMJ-LJQANCHMSA-N	1	0	294.398	4.138	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CC(C)(C)[C@@H]1c1cccs1	ZINC000287105447	263101059	/nfs/dbraw/zinc/10/10/59/263101059.db2.gz	YAEQHFUTYROATG-AWEZNQCLSA-N	1	0	276.449	4.461	20	30		CIEDRO
C[C@H]([NH2+]CC1CCC(C#N)CC1)c1nccc2ccccc21	ZINC000290022658	263114044	/nfs/dbraw/zinc/11/40/44/263114044.db2.gz	AMAWDDIKORDTIF-FHERZECASA-N	1	0	293.414	4.215	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]Cc1ccc(C(C)(F)F)cc1	ZINC000292965113	263136802	/nfs/dbraw/zinc/13/68/02/263136802.db2.gz	LVDZOMLNJDMVQE-UHFFFAOYSA-N	1	0	280.362	4.218	20	30		CIEDRO
C[C@]1(c2ccccc2)CCC[N@@H+]([C@H]2CC[C@@H](C#N)C2)CC1	ZINC000293724230	263147850	/nfs/dbraw/zinc/14/78/50/263147850.db2.gz	YSBNXUZEJOSZLC-NEWSRXKRSA-N	1	0	282.431	4.122	20	30		CIEDRO
C[C@@H]([NH2+][C@H](CCCC#N)c1ccccc1)c1cncs1	ZINC000340445909	263152500	/nfs/dbraw/zinc/15/25/00/263152500.db2.gz	MDFQIMSZMLYUIS-UKRRQHHQSA-N	1	0	285.416	4.229	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](CCCC#N)c1ccccc1)c1ccncc1F	ZINC000340449716	263155663	/nfs/dbraw/zinc/15/56/63/263155663.db2.gz	WBRUCBMCUPGSCF-KDOFPFPSSA-N	1	0	297.377	4.306	20	30		CIEDRO
Cc1cccnc1[C@@H]1CCC[C@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)C1	ZINC000294929527	263169328	/nfs/dbraw/zinc/16/93/28/263169328.db2.gz	BNPJSGRPRAXHLJ-MHORFTMASA-N	1	0	297.446	4.088	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@@H]2CC[C@H](Cc3ccccc3)C2)C1	ZINC000295017026	263170765	/nfs/dbraw/zinc/17/07/65/263170765.db2.gz	KEBLHHUOUYOKGK-ZSYWTGECSA-N	1	0	282.431	4.070	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+]Cc2ccc3ccccc3c2)C1	ZINC000295010040	263170874	/nfs/dbraw/zinc/17/08/74/263170874.db2.gz	JKYXTLOBJFDZBS-KSSFIOAISA-N	1	0	264.372	4.012	20	30		CIEDRO
C[C@]1(c2ccccc2)CC[C@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)C1	ZINC000295059395	263171436	/nfs/dbraw/zinc/17/14/36/263171436.db2.gz	OCXGZGGVWINQBS-WNHJNPCNSA-N	1	0	282.431	4.169	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+]C2CCC(c3ccccc3)CC2)C1	ZINC000295112398	263172786	/nfs/dbraw/zinc/17/27/86/263172786.db2.gz	VFNJPMAPBSNYAG-RXQRSOPUSA-N	1	0	282.431	4.385	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccc(F)c(Cl)c1	ZINC000295835120	263182885	/nfs/dbraw/zinc/18/28/85/263182885.db2.gz	AFBYFNBTXFLNLU-GVXVVHGQSA-N	1	0	280.774	4.212	20	30		CIEDRO
CC1(C)[C@@H](c2ccccc2)C[C@@H]1[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000296272279	263188922	/nfs/dbraw/zinc/18/89/22/263188922.db2.gz	DPYMHQNCKGZOBQ-OWLYRPNTSA-N	1	0	282.431	4.241	20	30		CIEDRO
CC1(C)[C@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)C[C@@H]1c1ccccc1	ZINC000296270054	263188975	/nfs/dbraw/zinc/18/89/75/263188975.db2.gz	DPYMHQNCKGZOBQ-DZJNRPSUSA-N	1	0	282.431	4.241	20	30		CIEDRO
Cc1cc(C)cc([C@@H](C)[NH2+][C@H]2CC[C@@H](CC#N)C2)c1	ZINC000296345109	263190501	/nfs/dbraw/zinc/19/05/01/263190501.db2.gz	HZXUMQQKAOFFPW-VYDXJSESSA-N	1	0	256.393	4.036	20	30		CIEDRO
CC[C@H]([NH2+]CC1CCC(C#N)CC1)c1ccsc1	ZINC000296603057	263194023	/nfs/dbraw/zinc/19/40/23/263194023.db2.gz	XVMSWWPVXKSRDW-PIMMBPRGSA-N	1	0	262.422	4.119	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)C1	ZINC000296647567	263194809	/nfs/dbraw/zinc/19/48/09/263194809.db2.gz	YPWBTPIQNJCGRK-AFAVFJNCSA-N	1	0	288.822	4.463	20	30		CIEDRO
C[C@H](CCC#N)[N@H+]1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2	ZINC000298602511	263222792	/nfs/dbraw/zinc/22/27/92/263222792.db2.gz	SKXGMCZFNXCQCM-NRSFXHEJSA-N	1	0	268.404	4.089	20	30		CIEDRO
C[C@@H](CCC#N)[NH2+][C@@H](C)c1ccc(Oc2cccnc2)cc1	ZINC000298650824	263223424	/nfs/dbraw/zinc/22/34/24/263223424.db2.gz	XLBYCFIGZMTECR-GJZGRUSLSA-N	1	0	295.386	4.217	20	30		CIEDRO
CSc1ccccc1[C@@H](C)[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000453297905	263223945	/nfs/dbraw/zinc/22/39/45/263223945.db2.gz	WOXPHKXFDYMZMH-RDBSUJKOSA-N	1	0	274.433	4.141	20	30		CIEDRO
COc1ccc2oc([C@H](C)[NH2+][C@@H](C)CCC#N)c(C)c2c1	ZINC000299154983	263232920	/nfs/dbraw/zinc/23/29/20/263232920.db2.gz	XCWJMBRZRNCAKL-AAEUAGOBSA-N	1	0	286.375	4.093	20	30		CIEDRO
CC[C@H]([NH2+][C@H](C)CCC#N)c1ccc(Cl)cc1	ZINC000299691274	263252331	/nfs/dbraw/zinc/25/23/31/263252331.db2.gz	NUFOYGWNCJXOOK-RISCZKNCSA-N	1	0	250.773	4.073	20	30		CIEDRO
C[C@H](CCC#N)[NH2+][C@@H](C)c1ccc2ccccc2c1	ZINC000299733678	263254376	/nfs/dbraw/zinc/25/43/76/263254376.db2.gz	YWRYHQNZGWHFPU-KGLIPLIRSA-N	1	0	252.361	4.183	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(Cl)cc1F)c1cccc(C#N)c1	ZINC000187577153	263262122	/nfs/dbraw/zinc/26/21/22/263262122.db2.gz	BBPNMKZKFPSOEV-LLVKDONJSA-N	1	0	288.753	4.202	20	30		CIEDRO
CC(C)[C@@H]1CC[C@H]1[NH2+][C@H](CCC#N)c1ccccc1	ZINC000353632929	263282322	/nfs/dbraw/zinc/28/23/22/263282322.db2.gz	QTGCNLKXQWPMPG-GVDBMIGSSA-N	1	0	256.393	4.056	20	30		CIEDRO
CCOc1ccc(C[NH2+]CC(C)(C)CCC#N)cc1Cl	ZINC000341353352	263332199	/nfs/dbraw/zinc/33/21/99/263332199.db2.gz	LECZBRLLIMBBSQ-UHFFFAOYSA-N	1	0	294.826	4.158	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCc1csc(C)n1)c1ccccc1	ZINC000341933333	263367292	/nfs/dbraw/zinc/36/72/92/263367292.db2.gz	SUNRHTSDOQFKDR-KRWDZBQOSA-N	1	0	286.444	4.291	20	30		CIEDRO
C=C1CC[NH+](Cc2c(Cl)ccc3cccnc32)CC1	ZINC000342008053	263377238	/nfs/dbraw/zinc/37/72/38/263377238.db2.gz	QBAHMMABJVDNGG-UHFFFAOYSA-N	1	0	272.779	4.040	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]Cc1ncc(-c2ccccc2)s1	ZINC000342321968	263421470	/nfs/dbraw/zinc/42/14/70/263421470.db2.gz	SUVZGCZVKNNMQB-UHFFFAOYSA-N	1	0	299.443	4.230	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCc2ccccc21)c1ccc(C#N)cc1F	ZINC000334277416	263544601	/nfs/dbraw/zinc/54/46/01/263544601.db2.gz	DIZKRMLXGCFVHM-SGTLLEGYSA-N	1	0	280.346	4.035	20	30		CIEDRO
C[C@H]1[C@@H](c2ccccc2)CC[N@@H+]1Cc1ccc(F)c(C#N)c1	ZINC000468269336	264293533	/nfs/dbraw/zinc/29/35/33/264293533.db2.gz	XURGICHCHBBBAR-KSSFIOAISA-N	1	0	294.373	4.075	20	30		CIEDRO
CC[N@H+](Cc1c[nH]c2ccccc12)Cc1ccc(C#N)cc1	ZINC000190487627	264364132	/nfs/dbraw/zinc/36/41/32/264364132.db2.gz	YCDGVHRXWXRAHZ-UHFFFAOYSA-N	1	0	289.382	4.062	20	30		CIEDRO
C=C(C)[C@H]([NH2+]C1CC(OC(C)C)C1)c1ccc(F)c(F)c1	ZINC000428095358	264365920	/nfs/dbraw/zinc/36/59/20/264365920.db2.gz	XUHIZOWJODVHFT-KVULBXGLSA-N	1	0	295.373	4.128	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CC1(CC)CCOCC1)c1ccco1	ZINC000286023432	264573930	/nfs/dbraw/zinc/57/39/30/264573930.db2.gz	JWSKPVORNOISSP-OAHLLOKOSA-N	1	0	277.408	4.083	20	30		CIEDRO
C=CCC[C@H]([NH2+]CC[C@H]1CCO[C@H](C)C1)c1ccco1	ZINC000286035515	264573969	/nfs/dbraw/zinc/57/39/69/264573969.db2.gz	JNEMVKCIQRTYFR-PMPSAXMXSA-N	1	0	277.408	4.082	20	30		CIEDRO
C=CCCCCCC[NH2+][C@H](C)c1ccc([S@@](C)=O)cc1	ZINC000286875560	264592678	/nfs/dbraw/zinc/59/26/78/264592678.db2.gz	CCEWDITUXHPVKY-FOIQADDNSA-N	1	0	293.476	4.211	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+][C@H](C)CCCC(F)(F)F	ZINC000426044585	264804631	/nfs/dbraw/zinc/80/46/31/264804631.db2.gz	SXNUENJHWLURQY-VXGBXAGGSA-N	1	0	251.336	4.442	20	30		CIEDRO
CC(C)c1ccc(CCC[NH2+][C@@H]2CC[C@H](C#N)C2)cc1	ZINC000442786016	264981075	/nfs/dbraw/zinc/98/10/75/264981075.db2.gz	SODLJGJXVSELLY-FUHWJXTLSA-N	1	0	270.420	4.024	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCC1(COC)CCC1)c1ccco1	ZINC000293806201	264997559	/nfs/dbraw/zinc/99/75/59/264997559.db2.gz	VIKOBKZMBQOFQR-OAHLLOKOSA-N	1	0	277.408	4.083	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H]1CC2(CCC2)Oc2ccccc21	ZINC000344882351	265068963	/nfs/dbraw/zinc/06/89/63/265068963.db2.gz	KHUZAYSVQHYGCX-INIZCTEOSA-N	1	0	298.430	4.352	20	30		CIEDRO
C=C(CC)C[NH2+][C@H](CCCCOC)c1ccccc1	ZINC000348317607	265150156	/nfs/dbraw/zinc/15/01/56/265150156.db2.gz	KPPZGSCCUIZOFW-QGZVFWFLSA-N	1	0	261.409	4.100	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C2CC2)cc1)c1ccc(C#N)cc1	ZINC000094518597	265247089	/nfs/dbraw/zinc/24/70/89/265247089.db2.gz	PQZISZPOGRZNOZ-AWEZNQCLSA-N	1	0	276.383	4.286	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](C)C[C@@H]1C)c1cccc(C#N)c1	ZINC000226162053	266001609	/nfs/dbraw/zinc/00/16/09/266001609.db2.gz	OSTNQTRMHFQZGQ-FHIRATQRSA-N	1	0	256.393	4.034	20	30		CIEDRO
CC[C@@H](CSC)[NH2+][C@H]1CCCCc2cc(C#N)ccc21	ZINC000360649755	266730913	/nfs/dbraw/zinc/73/09/13/266730913.db2.gz	WAHRMSRMNPOCJL-RDJZCZTQSA-N	1	0	288.460	4.057	20	30		CIEDRO
C[C@H](CC1CC1)[NH2+][C@H]1CCCCc2cc(C#N)ccc21	ZINC000360650523	266731934	/nfs/dbraw/zinc/73/19/34/266731934.db2.gz	YEBRXINGBMAQHP-ACJLOTCBSA-N	1	0	268.404	4.104	20	30		CIEDRO
C=CCN1CCC([NH2+][C@H](CC(C)C)c2ccccc2)CC1	ZINC000361218065	266803427	/nfs/dbraw/zinc/80/34/27/266803427.db2.gz	VTUAZWRXLFDGMD-LJQANCHMSA-N	1	0	286.463	4.014	20	30		CIEDRO
CC(C)(CCC#N)C[N@@H+]1CCC[C@@H]1[C@H](C#N)c1ccccc1	ZINC000367472567	267092115	/nfs/dbraw/zinc/09/21/15/267092115.db2.gz	PBRJRRLSKHJOTJ-QZTJIDSGSA-N	1	0	295.430	4.088	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1CCC[C@H](c2cccnc2)C1	ZINC000367896478	267125002	/nfs/dbraw/zinc/12/50/02/267125002.db2.gz	AZAYTPONEWLQJM-DOTOQJQBSA-N	1	0	285.435	4.027	20	30		CIEDRO
Cc1cccnc1[C@@H]1CCC[C@@H]([NH2+]CC(C)(C)CCC#N)C1	ZINC000367904856	267125788	/nfs/dbraw/zinc/12/57/88/267125788.db2.gz	RJVHKQHZUKHHLN-IAGOWNOFSA-N	1	0	299.462	4.336	20	30		CIEDRO
Cc1cccc(C2CC([NH2+]CC(C)(C)CCC#N)C2)c1	ZINC000367906906	267126452	/nfs/dbraw/zinc/12/64/52/267126452.db2.gz	ZVDCRFLSJSGRIV-UHFFFAOYSA-N	1	0	270.420	4.161	20	30		CIEDRO
Cc1ccccc1[C@H]1C[C@H]([NH2+]CC(C)(C)CCC#N)C1	ZINC000368534874	267180895	/nfs/dbraw/zinc/18/08/95/267180895.db2.gz	QRXYQCQGOPBRSM-WKILWMFISA-N	1	0	270.420	4.161	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccccc1C#N)c1ccc(C2CC2)cc1	ZINC000418117846	267250690	/nfs/dbraw/zinc/25/06/90/267250690.db2.gz	UNAVDGOCARUVJT-CQSZACIVSA-N	1	0	276.383	4.286	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)cc1F)c1ccc(C2CC2)cc1	ZINC000418118985	267262058	/nfs/dbraw/zinc/26/20/58/267262058.db2.gz	WUSZHUAFBKGDJL-ZDUSSCGKSA-N	1	0	294.373	4.426	20	30		CIEDRO
C[C@@H]([NH2+]CCCCC#N)c1nc(-c2ccccc2)cs1	ZINC000118979160	267283154	/nfs/dbraw/zinc/28/31/54/267283154.db2.gz	NABZLCCZLQPDDZ-CYBMUJFWSA-N	1	0	285.416	4.155	20	30		CIEDRO
C=C[C@@H](C)[NH2+][C@H]1CCSc2c(Cl)cccc21	ZINC000119361122	267325616	/nfs/dbraw/zinc/32/56/16/267325616.db2.gz	RILQVBMMCJGOLZ-SKDRFNHKSA-N	1	0	253.798	4.041	20	30		CIEDRO
N#CCCCC[NH2+][C@@H]1CCC[C@H]1c1ccc(Cl)cc1	ZINC000370644962	267333966	/nfs/dbraw/zinc/33/39/66/267333966.db2.gz	SDCILAHAAPESKD-JKSUJKDBSA-N	1	0	276.811	4.260	20	30		CIEDRO
N#CCC1(C[NH2+][C@H]2CC3(CCCC3)Oc3ccccc32)CC1	ZINC000370666804	267336009	/nfs/dbraw/zinc/33/60/09/267336009.db2.gz	IWQZABBYVCEBHQ-INIZCTEOSA-N	1	0	296.414	4.106	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)C1CC1)c1nc(-c2ccc(C#N)cc2)cs1	ZINC000370662767	267336699	/nfs/dbraw/zinc/33/66/99/267336699.db2.gz	OEVKOTJCUCEAEV-NWDGAFQWSA-N	1	0	297.427	4.131	20	30		CIEDRO
N#CCCCC[NH2+][C@@H]1CCCOc2cc3c(cc21)CCCC3	ZINC000370733150	267342280	/nfs/dbraw/zinc/34/22/80/267342280.db2.gz	XYURLIJWTUDPMW-GOSISDBHSA-N	1	0	298.430	4.063	20	30		CIEDRO
C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+]CC1(C#N)CCC1	ZINC000418143553	267364918	/nfs/dbraw/zinc/36/49/18/267364918.db2.gz	QGAGSTNJBIWAKD-STQMWFEESA-N	1	0	276.811	4.115	20	30		CIEDRO
CC(C)(C#N)CC[N@@H+]1CCCC[C@H]1c1nc2ccccc2o1	ZINC000371206084	267370146	/nfs/dbraw/zinc/37/01/46/267370146.db2.gz	DAJDQNVNQOCWBQ-HNNXBMFYSA-N	1	0	297.402	4.295	20	30		CIEDRO
C[C@@H](CCc1ccc(Cl)s1)[NH2+]CC1(C#N)CCC1	ZINC000418138100	267372436	/nfs/dbraw/zinc/37/24/36/267372436.db2.gz	FZBFLKUXFTYZDR-NSHDSACASA-N	1	0	282.840	4.006	20	30		CIEDRO
C[C@@H]1CCC[C@H]([NH2+]CCCCC(C)(C)C#N)[C@H]1C	ZINC000300121769	267900025	/nfs/dbraw/zinc/90/00/25/267900025.db2.gz	XDCDOKQNIFALFU-ILXRZTDVSA-N	1	0	250.430	4.121	20	30		CIEDRO
N#Cc1csc(C[NH2+][C@@H]2CCCCC23CCCC3)c1	ZINC000389024041	328604019	/nfs/dbraw/zinc/60/40/19/328604019.db2.gz	BUDHUFLJECXCMX-OAHLLOKOSA-N	1	0	274.433	4.212	20	30		CIEDRO
C=C[C@H](C)[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1	ZINC000378800445	327758459	/nfs/dbraw/zinc/75/84/59/327758459.db2.gz	TVWMKHZMRSRPQQ-XWLWVQCSSA-N	1	0	255.814	4.058	20	30		CIEDRO
COc1ccc2cc([C@@H](C)[NH2+]CCCCC#N)ccc2c1	ZINC000174057009	327774641	/nfs/dbraw/zinc/77/46/41/327774641.db2.gz	BWOQROXOBSDVMT-CQSZACIVSA-N	1	0	282.387	4.193	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H]1CC[C@@H](Cc2ccccc2)C1	ZINC000189516131	327781046	/nfs/dbraw/zinc/78/10/46/327781046.db2.gz	CYHHPOPJPUGELG-ROUUACIJSA-N	1	0	284.447	4.317	20	30		CIEDRO
C[C@@H]([NH2+]CCCC(C)(C)C#N)c1cccc(N2CCCC2)c1	ZINC000181861221	327810463	/nfs/dbraw/zinc/81/04/63/327810463.db2.gz	HPAZSVLKKPPEND-MRXNPFEDSA-N	1	0	299.462	4.267	20	30		CIEDRO
CC(C)[C@H](C[NH2+][C@H](C)c1cccc(C#N)c1)c1cccnc1	ZINC000181868547	327810755	/nfs/dbraw/zinc/81/07/55/327810755.db2.gz	UCQAXBOLTDZHML-BEFAXECRSA-N	1	0	293.414	4.044	20	30		CIEDRO
CCc1cc(N2CCC(CCC#N)CC2)c2ccccc2[nH+]1	ZINC000563046628	327812268	/nfs/dbraw/zinc/81/22/68/327812268.db2.gz	CBSYQHHCGGYODR-UHFFFAOYSA-N	1	0	293.414	4.317	20	30		CIEDRO
CC(C)CC[C@H]([NH2+]Cc1ccc(C#N)o1)C(C)(C)C	ZINC000236623896	328001923	/nfs/dbraw/zinc/00/19/23/328001923.db2.gz	PKQUNBSMKWVTBS-HNNXBMFYSA-N	1	0	262.397	4.092	20	30		CIEDRO
C=CC[NH2+][C@H](c1ccccc1)c1cccc(Cl)c1	ZINC000531537675	328015595	/nfs/dbraw/zinc/01/55/95/328015595.db2.gz	ZUFKLEMZTIJBTR-MRXNPFEDSA-N	1	0	257.764	4.205	20	30		CIEDRO
C[C@@H]([NH2+]CC1CCC(C)CC1)c1cccc(C#N)c1	ZINC000063144836	328034466	/nfs/dbraw/zinc/03/44/66/328034466.db2.gz	OOUXQGLPXYCKNC-SHARSMKWSA-N	1	0	256.393	4.035	20	30		CIEDRO
C[N@H+](CCC(C)(C)C#N)Cc1ccc2ccccc2c1	ZINC000534215594	328039478	/nfs/dbraw/zinc/03/94/78/328039478.db2.gz	CLAGOIWJIJRCKV-UHFFFAOYSA-N	1	0	266.388	4.211	20	30		CIEDRO
Cc1ccc([C@H]2CCCCC[N@@H+]2CCC(C)(C)C#N)o1	ZINC000534217784	328039484	/nfs/dbraw/zinc/03/94/84/328039484.db2.gz	GHRBLMQPZMBTSY-OAHLLOKOSA-N	1	0	274.408	4.445	20	30		CIEDRO
CCc1ccc(C[N@H+](CCC(C)(C)C#N)C2CC2)cc1	ZINC000534215609	328039578	/nfs/dbraw/zinc/03/95/78/328039578.db2.gz	DUSYDFJETIOOJN-UHFFFAOYSA-N	1	0	270.420	4.153	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]Cc2cccc(Cl)c2)cc1	ZINC000048241828	328045791	/nfs/dbraw/zinc/04/57/91/328045791.db2.gz	DMLKHHWNOQUBQL-UHFFFAOYSA-N	1	0	287.790	4.195	20	30		CIEDRO
C=CCCCCC[NH2+][C@H](C)c1ccc2c(c1)COC2	ZINC000563416323	328063055	/nfs/dbraw/zinc/06/30/55/328063055.db2.gz	IAJHACTVFKDUBU-CQSZACIVSA-N	1	0	259.393	4.114	20	30		CIEDRO
C/C(=C/c1ccccc1)C[NH2+]CC(C)(C)CCC#N	ZINC000571080961	328084743	/nfs/dbraw/zinc/08/47/43/328084743.db2.gz	DVUFXZYAFCDSRR-QINSGFPZSA-N	1	0	256.393	4.009	20	30		CIEDRO
N#Cc1ccc2c(c1)[C@H]([NH2+][C@H](c1cccs1)C1CC1)CC2	ZINC000571092120	328085036	/nfs/dbraw/zinc/08/50/36/328085036.db2.gz	ITNARYXSZQOKRM-AEFFLSMTSA-N	1	0	294.423	4.348	20	30		CIEDRO
C[C@@H](CCC#N)[N@@H+]1CC[C@H](Sc2cccc(Cl)c2)C1	ZINC000411757369	328098838	/nfs/dbraw/zinc/09/88/38/328098838.db2.gz	LXDOMWHBEVBCDP-WFASDCNBSA-N	1	0	294.851	4.199	20	30		CIEDRO
C=CCOc1ccc(C[N@@H+](C)[C@H](CC)c2ccncc2)cc1	ZINC000571366327	328116991	/nfs/dbraw/zinc/11/69/91/328116991.db2.gz	XSSKYROFMYZWSV-LJQANCHMSA-N	1	0	296.414	4.230	20	30		CIEDRO
C/C(=C\c1cccc(C(F)(F)F)c1)C[NH2+]CC1(C#N)CC1	ZINC000584343572	328128467	/nfs/dbraw/zinc/12/84/67/328128467.db2.gz	BTHGXEPWBQYLOO-KPKJPENVSA-N	1	0	294.320	4.002	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@@H](CC)CC(F)(F)F)C1CC1	ZINC000414267298	328153969	/nfs/dbraw/zinc/15/39/69/328153969.db2.gz	RYOOAIGNVOZTEW-WCQYABFASA-N	1	0	263.347	4.299	20	30		CIEDRO
Cc1ccc(C[C@H]([NH2+]CC(C)(C)CCC#N)C2CC2)cc1	ZINC000582140398	328186566	/nfs/dbraw/zinc/18/65/66/328186566.db2.gz	JKHAGEQDCJOBFO-SFHVURJKSA-N	1	0	284.447	4.236	20	30		CIEDRO
N#CC1(c2ccccc2)CCC([NH2+][C@H]2CC=CCC2)CC1	ZINC000271527403	328196690	/nfs/dbraw/zinc/19/66/90/328196690.db2.gz	RHMQWNFCIGBGII-VIQWUECVSA-N	1	0	280.415	4.089	20	30		CIEDRO
C[C@H](CCC#N)[NH2+]C(c1ccccc1)c1ccccc1	ZINC000276350287	328217762	/nfs/dbraw/zinc/21/77/62/328217762.db2.gz	WCOFIGWKQCFQEB-OAHLLOKOSA-N	1	0	264.372	4.058	20	30		CIEDRO
COc1ccc([C@H](C)[N@H+](C)CCCCC(C)(C)C#N)cc1	ZINC000278123828	328223649	/nfs/dbraw/zinc/22/36/49/328223649.db2.gz	LYDQDBMJWUFCEA-HNNXBMFYSA-N	1	0	288.435	4.408	20	30		CIEDRO
C#CC[C@H]([NH2+]CCCCC(C)(C)C#N)c1ccccc1	ZINC000278596278	328227889	/nfs/dbraw/zinc/22/78/89/328227889.db2.gz	DRFCWEAKTOKGLC-KRWDZBQOSA-N	1	0	268.404	4.061	20	30		CIEDRO
N#CCCCC[NH+]1CCC(c2c[nH]c3ccc(F)cc32)CC1	ZINC000286738153	328250025	/nfs/dbraw/zinc/25/00/25/328250025.db2.gz	HSXJRVMPDYIUHY-UHFFFAOYSA-N	1	0	299.393	4.180	20	30		CIEDRO
CC[C@@H]1CC[C@H]1[NH2+][C@H](CCCC#N)c1ccccc1	ZINC000340429735	328276447	/nfs/dbraw/zinc/27/64/47/328276447.db2.gz	DILSTCBHSWTFQM-DJIMGWMZSA-N	1	0	256.393	4.200	20	30		CIEDRO
CC1=CC[C@@H]([NH2+][C@@H](CCC#N)c2ccccc2)CC1	ZINC000293565772	328276789	/nfs/dbraw/zinc/27/67/89/328276789.db2.gz	IMBIHCLPEMULOZ-SJORKVTESA-N	1	0	254.377	4.120	20	30		CIEDRO
C[C@@H]1C[C@H]([NH2+][C@@H](CCCC#N)c2ccccc2)[C@H]1C	ZINC000340440011	328277688	/nfs/dbraw/zinc/27/76/88/328277688.db2.gz	CCHOWIPHERZDMG-OHFALNGGSA-N	1	0	256.393	4.056	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+]Cc2ccc(-c3ccccc3)o2)C1	ZINC000294912407	328283793	/nfs/dbraw/zinc/28/37/93/328283793.db2.gz	AFXASJHZNAENPR-HOCLYGCPSA-N	1	0	280.371	4.119	20	30		CIEDRO
Cc1cc(N[C@H]2CC[C@@H](CC#N)C2)c2ccccc2[nH+]1	ZINC000294991514	328284000	/nfs/dbraw/zinc/28/40/00/328284000.db2.gz	NEGUHGXRXUHZFX-KBPBESRZSA-N	1	0	265.360	4.038	20	30		CIEDRO
COc1ccc(C[NH2+][C@H]2CC[C@@H](CC#N)C2)c2ccccc12	ZINC000295083648	328284999	/nfs/dbraw/zinc/28/49/99/328284999.db2.gz	QPYKGKOXLPBIGO-HOCLYGCPSA-N	1	0	294.398	4.020	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccc2ccccc2c1O	ZINC000296265041	328289798	/nfs/dbraw/zinc/28/97/98/328289798.db2.gz	DJSSPSJNTVBZET-DZKIICNBSA-N	1	0	294.398	4.278	20	30		CIEDRO
CC1(C)C[C@@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)c2ccccc21	ZINC000296456329	328290664	/nfs/dbraw/zinc/29/06/64/328290664.db2.gz	MZXRAVKDEVSGOD-GRDNDAEWSA-N	1	0	268.404	4.081	20	30		CIEDRO
CC1(c2ccccc2)CC([NH2+]CC2CCC(C#N)CC2)C1	ZINC000298180451	328295342	/nfs/dbraw/zinc/29/53/42/328295342.db2.gz	VNKZGMYHSFEMRT-UHFFFAOYSA-N	1	0	282.431	4.026	20	30		CIEDRO
CCC[N@H+](Cc1cc(C#N)cs1)Cc1ccc(C)cc1	ZINC000535070068	328383820	/nfs/dbraw/zinc/38/38/20/328383820.db2.gz	NOLJXWMDPIKYMI-UHFFFAOYSA-N	1	0	284.428	4.340	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H]1CCCOc2cc(Cl)ccc21	ZINC000341679671	328413924	/nfs/dbraw/zinc/41/39/24/328413924.db2.gz	BHGJUECXJGBMOW-RISCZKNCSA-N	1	0	265.784	4.108	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H]1CCCOc2cc(Cl)ccc21	ZINC000341679668	328414017	/nfs/dbraw/zinc/41/40/17/328414017.db2.gz	BHGJUECXJGBMOW-FZMZJTMJSA-N	1	0	265.784	4.108	20	30		CIEDRO
CC1(C)CCCC[C@@H]1[NH2+][C@@H]1CCc2ccc(C#N)cc21	ZINC000564419290	328462399	/nfs/dbraw/zinc/46/23/99/328462399.db2.gz	NTTZXZDPEGFKBV-SJORKVTESA-N	1	0	268.404	4.104	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1cncc(C)c1)c1ccccc1	ZINC000181841584	328501941	/nfs/dbraw/zinc/50/19/41/328501941.db2.gz	QHRAFBUXBFYRMU-SFHVURJKSA-N	1	0	266.388	4.187	20	30		CIEDRO
C=CCC[NH2+][C@H](C)c1nc(-c2ccccc2)cs1	ZINC000184528824	328532507	/nfs/dbraw/zinc/53/25/07/328532507.db2.gz	JTGKQGVQUUFRGO-GFCCVEGCSA-N	1	0	258.390	4.037	20	30		CIEDRO
C[C@H]([NH2+]CCC(C)(C)C#N)c1cc2cccc(F)c2o1	ZINC000530446902	326807692	/nfs/dbraw/zinc/80/76/92/326807692.db2.gz	PQLUWZRBDHGORF-NSHDSACASA-N	1	0	274.339	4.162	20	30		CIEDRO
COc1ccc([C@H](C)C[NH2+][C@H](C)c2ccc(C#N)cc2)cc1	ZINC000538396172	326826594	/nfs/dbraw/zinc/82/65/94/326826594.db2.gz	KFLZOOXYSVWJRK-HUUCEWRRSA-N	1	0	294.398	4.021	20	30		CIEDRO
CC[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1cccc(C#N)c1	ZINC000037294796	326843805	/nfs/dbraw/zinc/84/38/05/326843805.db2.gz	BCLJUCMFAYYXDD-YSVLISHTSA-N	1	0	256.393	4.178	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](CC)c1ccc(OC)c(OC)c1	ZINC000398081654	326871145	/nfs/dbraw/zinc/87/11/45/326871145.db2.gz	DNFVPTLAXXKTDQ-HOCLYGCPSA-N	1	0	291.435	4.489	20	30		CIEDRO
N#Cc1ccc(C[NH2+]C[C@H]2CCC[C@H](C(F)(F)F)C2)cc1	ZINC000530736573	326888934	/nfs/dbraw/zinc/88/89/34/326888934.db2.gz	STGFNUPAGASNGH-GJZGRUSLSA-N	1	0	296.336	4.017	20	30		CIEDRO
C=CCCC[C@H](C)[NH+]1CCC(CC(F)(F)F)CC1	ZINC000556507381	326945906	/nfs/dbraw/zinc/94/59/06/326945906.db2.gz	AAWOICDYHPWJLE-LBPRGKRZSA-N	1	0	263.347	4.396	20	30		CIEDRO
CCC[C@H](CC)[NH2+][C@H]1CCCc2cc(C#N)ccc21	ZINC000557523869	327011332	/nfs/dbraw/zinc/01/13/32/327011332.db2.gz	SKDQQXCMATYATH-RDJZCZTQSA-N	1	0	256.393	4.104	20	30		CIEDRO
Cc1ccc2oc(C[NH2+][C@H](C)c3cccc(C#N)c3)cc2c1	ZINC000557818133	327029007	/nfs/dbraw/zinc/02/90/07/327029007.db2.gz	DZFRAELLOPMZGH-CQSZACIVSA-N	1	0	290.366	4.464	20	30		CIEDRO
CC[N@H+](CCCC#N)[C@@H](C)c1cc2ccccc2o1	ZINC000064348929	327038400	/nfs/dbraw/zinc/03/84/00/327038400.db2.gz	BTEIPHWYGBMSRP-ZDUSSCGKSA-N	1	0	256.349	4.119	20	30		CIEDRO
CC(C)SCC[NH2+][C@H](C)c1ccc(C#N)cc1Cl	ZINC000558259668	327082981	/nfs/dbraw/zinc/08/29/81/327082981.db2.gz	VXDVFIKUSNMRBB-LLVKDONJSA-N	1	0	282.840	4.004	20	30		CIEDRO
C=CCOc1ccccc1C[N@@H+]1CC2(CCC2)[C@@H]1C1CC1	ZINC000558570687	327106005	/nfs/dbraw/zinc/10/60/05/327106005.db2.gz	XSJLMTAYJNOVAB-SFHVURJKSA-N	1	0	283.415	4.016	20	30		CIEDRO
CC[C@@H]1[C@H](C)CC[N@@H+]1Cc1ccc(C#N)cc1C(F)(F)F	ZINC000558575873	327106579	/nfs/dbraw/zinc/10/65/79/327106579.db2.gz	ZSDRHIXTIWCNCD-IAQYHMDHSA-N	1	0	296.336	4.197	20	30		CIEDRO
C[C@@H](CCC1CC1)[NH2+]Cc1ccc(C#N)cc1C(F)(F)F	ZINC000558575456	327106685	/nfs/dbraw/zinc/10/66/85/327106685.db2.gz	LPNFSEBPFLBXSK-NSHDSACASA-N	1	0	296.336	4.245	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+]CC(C)(C)C(F)(F)F	ZINC000558697784	327114844	/nfs/dbraw/zinc/11/48/44/327114844.db2.gz	BEVPQENBQHMLKZ-LLVKDONJSA-N	1	0	251.336	4.299	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H]1CCC12CCOCC2)c1ccccc1	ZINC000374374173	327115754	/nfs/dbraw/zinc/11/57/54/327115754.db2.gz	LIVSBOLAPIPAPC-ZWKOTPCHSA-N	1	0	285.431	4.243	20	30		CIEDRO
CC[C@H](CC#N)[NH2+][C@H](C)CCc1ccc(C(F)(F)F)cc1	ZINC000559055014	327139224	/nfs/dbraw/zinc/13/92/24/327139224.db2.gz	VZEOWDIYZQAHKG-IUODEOHRSA-N	1	0	298.352	4.308	20	30		CIEDRO
C=C(C[NH2+][C@@H](C)c1ccccc1F)c1ccccc1	ZINC000211842179	327150996	/nfs/dbraw/zinc/15/09/96/327150996.db2.gz	XKLCCATXQMYKKT-AWEZNQCLSA-N	1	0	255.336	4.190	20	30		CIEDRO
C[C@@H](c1cccc(C#N)c1)[N@@H+]1CC[C@@H](c2ccccc2F)C1	ZINC000559299587	327156173	/nfs/dbraw/zinc/15/61/73/327156173.db2.gz	FJVGZRNLBPUOGX-WMLDXEAASA-N	1	0	294.373	4.248	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]Cc1c[nH]nc1-c1cccc(C)c1	ZINC000559307124	327157715	/nfs/dbraw/zinc/15/77/15/327157715.db2.gz	OLFKCDVZBCVOLH-UHFFFAOYSA-N	1	0	283.419	4.077	20	30		CIEDRO
CCC[C@@H](C)[C@@H]1CCC[N@@H+]1CC(C)(C)CCC#N	ZINC000093845278	327200470	/nfs/dbraw/zinc/20/04/70/327200470.db2.gz	SYRXKXUETPYXSH-CABCVRRESA-N	1	0	250.430	4.217	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](CC)c1ccccc1OC(F)F	ZINC000358051359	327213090	/nfs/dbraw/zinc/21/30/90/327213090.db2.gz	VNUXRYHDIBLASI-DGCLKSJQSA-N	1	0	269.335	4.293	20	30		CIEDRO
CC(C)(C)[C@H]([NH2+]CCCCC#N)c1ccc(F)cc1	ZINC000102397885	327227011	/nfs/dbraw/zinc/22/70/11/327227011.db2.gz	JFYAONCXAGERMO-OAHLLOKOSA-N	1	0	262.372	4.196	20	30		CIEDRO
C=CCC[C@@H]([NH2+][C@@H](C)c1cncnc1C)c1ccccc1	ZINC000564472043	327239212	/nfs/dbraw/zinc/23/92/12/327239212.db2.gz	XYNDBTLBRRQOEV-MAUKXSAKSA-N	1	0	281.403	4.143	20	30		CIEDRO
C=CCSCC[NH2+][C@@H](C)c1cccc(C2CC2)c1	ZINC000559789336	327261276	/nfs/dbraw/zinc/26/12/76/327261276.db2.gz	ZQBNELMRFCWESX-ZDUSSCGKSA-N	1	0	261.434	4.134	20	30		CIEDRO
CC[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCc3ccc(C#N)cc32)C1	ZINC000573848401	327263536	/nfs/dbraw/zinc/26/35/36/327263536.db2.gz	QLSGCWGEDKKXGN-MZMPZRCHSA-N	1	0	268.404	4.104	20	30		CIEDRO
CC[C@@H]([NH2+]C1(c2cccc(C#N)c2)CC1)c1cccs1	ZINC000560259148	327294296	/nfs/dbraw/zinc/29/42/96/327294296.db2.gz	PCSARLGFZSEUHY-OAHLLOKOSA-N	1	0	282.412	4.350	20	30		CIEDRO
C[C@@H]1CC[N@H+](Cc2ccc(F)cc2C#N)[C@@H]2CCCC[C@@H]12	ZINC000560342741	327301001	/nfs/dbraw/zinc/30/10/01/327301001.db2.gz	JSXXAAPHXYTZFS-JEBQAFNWSA-N	1	0	286.394	4.098	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCc1ccc(C)o1)c1ccco1	ZINC000560528768	327319342	/nfs/dbraw/zinc/31/93/42/327319342.db2.gz	NQSVSLFURVZETC-OAHLLOKOSA-N	1	0	259.349	4.021	20	30		CIEDRO
CCc1ccc([C@H]2CC[N@H+](CC(C)(C)CCC#N)C2)cc1	ZINC000560544006	327321990	/nfs/dbraw/zinc/32/19/90/327321990.db2.gz	YAKRRXCYCLLAMT-SFHVURJKSA-N	1	0	284.447	4.368	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@@H](C)Oc1ccccc1)c1ccco1	ZINC000560546695	327322698	/nfs/dbraw/zinc/32/26/98/327322698.db2.gz	WAYKJEJLTWWAJX-NVXWUHKLSA-N	1	0	285.387	4.344	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@H]1[C@@H]2c3ccccc3C[C@H]12)c1ccco1	ZINC000560545948	327322739	/nfs/dbraw/zinc/32/27/39/327322739.db2.gz	OKVYRGPYRXZWIQ-FTEYMNFISA-N	1	0	293.410	4.462	20	30		CIEDRO
C=CCC[C@@H](NCC[C@H](C)[NH+]1CCCCC1)c1ccco1	ZINC000560549734	327323499	/nfs/dbraw/zinc/32/34/99/327323499.db2.gz	HBXZURVVBOLKON-DLBZAZTESA-N	1	0	290.451	4.141	20	30		CIEDRO
C=CC[C@@H](C)[C@@H](C)[NH2+]Cc1c(F)cccc1N1CCCC1	ZINC000560569667	327325608	/nfs/dbraw/zinc/32/56/08/327325608.db2.gz	IDPCAHNDFABYMI-HUUCEWRRSA-N	1	0	290.426	4.116	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H](C)CCC(F)(F)F)cc1	ZINC000560575165	327326849	/nfs/dbraw/zinc/32/68/49/327326849.db2.gz	VLRDBHQWMQGNQO-LBPRGKRZSA-N	1	0	287.325	4.072	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@H](C)c1ccc2n[nH]cc2c1	ZINC000560580945	327327560	/nfs/dbraw/zinc/32/75/60/327327560.db2.gz	ALJFRCIBEQKKHH-CJNGLKHVSA-N	1	0	271.408	4.348	20	30		CIEDRO
CC1=C[C@H](C)C[C@H](C[NH2+]C2(c3cccc(C#N)c3)CC2)C1	ZINC000564409895	327351598	/nfs/dbraw/zinc/35/15/98/327351598.db2.gz	FBHGZTFOSVZUES-YOEHRIQHSA-N	1	0	280.415	4.129	20	30		CIEDRO
CCCc1ccc([C@H](C)[NH2+]Cc2ccc(C#N)s2)cc1	ZINC000561437578	327394957	/nfs/dbraw/zinc/39/49/57/327394957.db2.gz	LVLKPOAEYDWWDF-ZDUSSCGKSA-N	1	0	284.428	4.423	20	30		CIEDRO
CCC[C@H](Cc1ccccc1)[NH2+]CC(C)(C)CCC#N	ZINC000562037484	327441637	/nfs/dbraw/zinc/44/16/37/327441637.db2.gz	AAVNBPHCENSGPQ-QGZVFWFLSA-N	1	0	272.436	4.317	20	30		CIEDRO
CC[C@@H]1CC[C@H](C)C[C@@H]1[NH2+]CC(C)(C)CCC#N	ZINC000562046227	327442230	/nfs/dbraw/zinc/44/22/30/327442230.db2.gz	CJRVVLYUDUICKO-ZNMIVQPWSA-N	1	0	250.430	4.121	20	30		CIEDRO
C[C@H]1C[C@H](C)[NH+]1Cc1ccc(-c2ccccc2C#N)cc1	ZINC000562302846	327466085	/nfs/dbraw/zinc/46/60/85/327466085.db2.gz	YZRYCKCSOLTQAC-GJZGRUSLSA-N	1	0	276.383	4.208	20	30		CIEDRO
C=CCCCC[NH2+][C@@H](CC(F)F)c1ccccc1	ZINC000562933802	327526581	/nfs/dbraw/zinc/52/65/81/327526581.db2.gz	HNYSOWPIRMGGLK-AWEZNQCLSA-N	1	0	253.336	4.329	20	30		CIEDRO
C=CCCC[NH+]1CCC(Cc2ccc(F)cc2)CC1	ZINC000569736140	327543879	/nfs/dbraw/zinc/54/38/79/327543879.db2.gz	LJGKFFXXCOTWSW-UHFFFAOYSA-N	1	0	261.384	4.046	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1cccc(C#N)c1)C1CCCCC1	ZINC000052335191	328641482	/nfs/dbraw/zinc/64/14/82/328641482.db2.gz	YOTQXVVIUVVPMV-QGZVFWFLSA-N	1	0	256.393	4.007	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(F)c(Cl)c1)c1ccc(C#N)cc1	ZINC000053150128	328663475	/nfs/dbraw/zinc/66/34/75/328663475.db2.gz	PUZOQXDCHNXYEC-NSHDSACASA-N	1	0	288.753	4.202	20	30		CIEDRO
CC[C@H](Cc1ccccc1)[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000116384147	328694115	/nfs/dbraw/zinc/69/41/15/328694115.db2.gz	BOPYYTVOROEEEU-DNVCBOLYSA-N	1	0	278.399	4.230	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000532207559	328707198	/nfs/dbraw/zinc/70/71/98/328707198.db2.gz	OSGAZYONVAZUGB-RHSMWYFYSA-N	1	0	256.393	4.344	20	30		CIEDRO
C[C@H](CCc1cccc(F)c1)[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000532207438	328707205	/nfs/dbraw/zinc/70/72/05/328707205.db2.gz	MFMDEQYRRNYYRL-HUUCEWRRSA-N	1	0	296.389	4.369	20	30		CIEDRO
CC[C@@H]([NH2+][C@H](C)c1ccc(C#N)cc1F)c1ccccc1	ZINC000358556562	328886947	/nfs/dbraw/zinc/88/69/47/328886947.db2.gz	BKYMKWVXNDREQT-FZKQIMNGSA-N	1	0	282.362	4.499	20	30		CIEDRO
C[C@H]1C[C@H](c2ccsc2)C[N@@H+]1CCCC(C)(C)C#N	ZINC000377941931	329035526	/nfs/dbraw/zinc/03/55/26/329035526.db2.gz	NBJSZLBOTJDOCT-ZFWWWQNUSA-N	1	0	276.449	4.256	20	30		CIEDRO
C[C@H]([NH2+]CCCCC#N)[C@@H]1C[C@H]1c1ccc(Cl)s1	ZINC000378059039	329038298	/nfs/dbraw/zinc/03/82/98/329038298.db2.gz	PMESUXIYFOHTBR-SDDRHHMPSA-N	1	0	282.840	4.177	20	30		CIEDRO
C=CC[C@@H](C)[C@@H](C)[NH2+]Cc1ncoc1-c1ccccc1	ZINC000378184817	329042629	/nfs/dbraw/zinc/04/26/29/329042629.db2.gz	OBTBSHPRJSQILU-ZIAGYGMSSA-N	1	0	270.376	4.032	20	30		CIEDRO
CC(C)(CCC#N)C[N@@H+]1CCS[C@@H](c2ccccc2)C1	ZINC000360080505	329071382	/nfs/dbraw/zinc/07/13/82/329071382.db2.gz	XYKATVSFFKLEOS-MRXNPFEDSA-N	1	0	288.460	4.106	20	30		CIEDRO
CCCC[N@H+](CC)Cc1ccc(C#N)cc1C(F)(F)F	ZINC000582697388	329125722	/nfs/dbraw/zinc/12/57/22/329125722.db2.gz	BGSYKEBBBAEVDB-UHFFFAOYSA-N	1	0	284.325	4.199	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H](c1nccs1)c1ccccc1	ZINC000174324208	329157428	/nfs/dbraw/zinc/15/74/28/329157428.db2.gz	JSGBWAQKJZCCCU-HNNXBMFYSA-N	1	0	299.443	4.152	20	30		CIEDRO
CC(C)(C#N)CCC[NH+]1CCC(c2ccccc2)CC1	ZINC000174815490	329161770	/nfs/dbraw/zinc/16/17/70/329161770.db2.gz	BSZFAWIAWUDYMY-UHFFFAOYSA-N	1	0	270.420	4.196	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCCC(C)(C)C1)c1cccc(C#N)c1	ZINC000149498655	329185717	/nfs/dbraw/zinc/18/57/17/329185717.db2.gz	GKQZXXRHMYFLFO-CZUORRHYSA-N	1	0	256.393	4.178	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCCC(C)(C)C1)c1cccc(C#N)c1	ZINC000149498976	329186019	/nfs/dbraw/zinc/18/60/19/329186019.db2.gz	GKQZXXRHMYFLFO-CJNGLKHVSA-N	1	0	256.393	4.178	20	30		CIEDRO
C=CCN1CCC([NH2+][C@H](CC)c2ccc(Cl)s2)CC1	ZINC000177913010	329189928	/nfs/dbraw/zinc/18/99/28/329189928.db2.gz	BEHARSCJGBSQSO-CYBMUJFWSA-N	1	0	298.883	4.093	20	30		CIEDRO
N#CCCCC[NH2+][C@H]1CCSc2ccc(Cl)cc21	ZINC000178644448	329201674	/nfs/dbraw/zinc/20/16/74/329201674.db2.gz	VFHAJTAZPKRGTE-ZDUSSCGKSA-N	1	0	280.824	4.160	20	30		CIEDRO
Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C#N)cc1F)CCC2	ZINC000178958080	329203350	/nfs/dbraw/zinc/20/33/50/329203350.db2.gz	SBOPRIINUVFGMT-IBGZPJMESA-N	1	0	294.373	4.173	20	30		CIEDRO
CC[N@H+](Cc1ccc(C)o1)[C@H](C)c1ccc(C#N)cc1	ZINC000179463354	329208827	/nfs/dbraw/zinc/20/88/27/329208827.db2.gz	FPBGZABMTBMEPO-CQSZACIVSA-N	1	0	268.360	4.043	20	30		CIEDRO
CC(C)[C@H](CSc1ccccc1)[NH2+]CCCCC#N	ZINC000180429672	329216788	/nfs/dbraw/zinc/21/67/88/329216788.db2.gz	HRQWZEZUENFABV-INIZCTEOSA-N	1	0	276.449	4.087	20	30		CIEDRO
CC[C@H](c1ccccc1)[N@H+](CC)CCC(C)(C)C#N	ZINC000582837075	329276148	/nfs/dbraw/zinc/27/61/48/329276148.db2.gz	FRUBEASGUIRORQ-MRXNPFEDSA-N	1	0	258.409	4.399	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)c1ccc(F)cc1F	ZINC000185838767	329330262	/nfs/dbraw/zinc/33/02/62/329330262.db2.gz	UMDVDOGZBFFZRD-GHJWDPDVSA-N	1	0	278.346	4.088	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)c1cc2cccc(OCC)c2o1	ZINC000508990783	332854018	/nfs/dbraw/zinc/85/40/18/332854018.db2.gz	JHTAFECYZVXPTH-CYBMUJFWSA-N	1	0	273.376	4.448	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccc(C)nc1C)c1ccccc1	ZINC000187435515	329357804	/nfs/dbraw/zinc/35/78/04/329357804.db2.gz	NTFXYSDNAGXWPJ-LJQANCHMSA-N	1	0	280.415	4.496	20	30		CIEDRO
CCC[C@@H](C[NH2+]CC(C)(C)CC#N)c1ccccc1	ZINC000459737159	329374499	/nfs/dbraw/zinc/37/44/99/329374499.db2.gz	VVFYMFUXQLXYPY-INIZCTEOSA-N	1	0	258.409	4.100	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](c1cccc(Cl)c1)c1ccccn1	ZINC000509022431	332856075	/nfs/dbraw/zinc/85/60/75/332856075.db2.gz	LHJBSJHDUGMESP-QGZVFWFLSA-N	1	0	286.806	4.380	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)c1ccc(OC(C)C)c(OC)c1	ZINC000509027103	332856432	/nfs/dbraw/zinc/85/64/32/332856432.db2.gz	CGVIQUYDPOLGJH-CQSZACIVSA-N	1	0	277.408	4.099	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H](C)c1cc(OC)ccc1OC	ZINC000398093480	329432925	/nfs/dbraw/zinc/43/29/25/329432925.db2.gz	ZHJNACXUXOULSX-ZIAGYGMSSA-N	1	0	277.408	4.099	20	30		CIEDRO
C=CCCC[NH2+][C@H](C)c1ccc(Br)s1	ZINC000379481816	329559340	/nfs/dbraw/zinc/55/93/40/329559340.db2.gz	ANNRWDBARIKNOV-SECBINFHSA-N	1	0	274.227	4.127	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@@H]1CCSc2ccc(F)cc21	ZINC000130567300	329625926	/nfs/dbraw/zinc/62/59/26/329625926.db2.gz	NNPPYOWLZDVCOQ-SMDDNHRTSA-N	1	0	265.397	4.307	20	30		CIEDRO
COc1ccc(C[NH2+]CC(C)(C)CCC#N)c2ccccc12	ZINC000564116786	329675553	/nfs/dbraw/zinc/67/55/53/329675553.db2.gz	ICZATHUIRBEFGC-UHFFFAOYSA-N	1	0	296.414	4.268	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H]2CCc3ccc(Cl)cc32)s1	ZINC000421203910	329805762	/nfs/dbraw/zinc/80/57/62/329805762.db2.gz	QRUDYBMVZWCDAU-HNNXBMFYSA-N	1	0	288.803	4.050	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@H](CC(F)F)c2ccccc2)CC1	ZINC000421374061	329816057	/nfs/dbraw/zinc/81/60/57/329816057.db2.gz	ORFBUKYQUROTRG-ISXOHVOVSA-N	1	0	292.373	4.445	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@H](CCC#N)c1ccccc1	ZINC000246356657	329839698	/nfs/dbraw/zinc/83/96/98/329839698.db2.gz	IDDTUCRPHOQNQN-YQQAZPJKSA-N	1	0	256.393	4.222	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]Cc1cnc(CC(C)C)s1	ZINC000571969539	329933950	/nfs/dbraw/zinc/93/39/50/329933950.db2.gz	YBCQRWRMNUZHMQ-UHFFFAOYSA-N	1	0	266.454	4.034	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1ccc(F)c(C(F)(F)F)c1	ZINC000393787803	329963256	/nfs/dbraw/zinc/96/32/56/329963256.db2.gz	ZIVPFCIJXBJPQH-LLVKDONJSA-N	1	0	275.289	4.289	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+]Cc1csc([C@H](C)OC)n1	ZINC000269089125	330067396	/nfs/dbraw/zinc/06/73/96/330067396.db2.gz	QAKZZFUTVNOYKM-STQMWFEESA-N	1	0	282.453	4.075	20	30		CIEDRO
C=CCCCCC[N@@H+](C)Cc1cnc([C@@H]2CCCO2)s1	ZINC000271203431	330078192	/nfs/dbraw/zinc/07/81/92/330078192.db2.gz	VMOKOBKQRRJNQE-HNNXBMFYSA-N	1	0	294.464	4.173	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)COC2)c1ccccc1	ZINC000271413085	330079586	/nfs/dbraw/zinc/07/95/86/330079586.db2.gz	AYJXBQTYSAEYJD-MGPUTAFESA-N	1	0	291.394	4.132	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@@H](C)c1sccc1C)c1ccccc1	ZINC000271487931	330079733	/nfs/dbraw/zinc/07/97/33/330079733.db2.gz	KMLREWCIRAHASD-GOEBONIOSA-N	1	0	269.413	4.472	20	30		CIEDRO
C#CC[C@H]([NH2+][C@@H](C)c1sc(CC)nc1C)c1ccccc1	ZINC000271426800	330080104	/nfs/dbraw/zinc/08/01/04/330080104.db2.gz	CQLMEPCJBYTQFY-BBRMVZONSA-N	1	0	298.455	4.429	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@H](C)c1ccsc1)c1ccccc1	ZINC000271599101	330080765	/nfs/dbraw/zinc/08/07/65/330080765.db2.gz	ZIEJBJVWZCRQNN-CZUORRHYSA-N	1	0	255.386	4.163	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@@H](C)c1nc(C(F)(F)F)cs1	ZINC000279044734	330121566	/nfs/dbraw/zinc/12/15/66/330121566.db2.gz	XWTJXHMWEFZZAH-IUCAKERBSA-N	1	0	278.343	4.167	20	30		CIEDRO
C[C@@H](Cc1ccc(F)cc1Cl)[NH2+]CC(C)(C)CCC#N	ZINC000421858215	330089763	/nfs/dbraw/zinc/08/97/63/330089763.db2.gz	QYOHUKGESHIZGO-LBPRGKRZSA-N	1	0	296.817	4.330	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@H]1CC12CCSCC2)c1ccco1	ZINC000421886036	330096261	/nfs/dbraw/zinc/09/62/61/330096261.db2.gz	RTYNEILCDMEOOE-HUUCEWRRSA-N	1	0	291.460	4.410	20	30		CIEDRO
C#CC[C@H]([NH2+][C@H](CC)c1ccccc1O)c1ccccc1	ZINC000274761904	330107442	/nfs/dbraw/zinc/10/74/42/330107442.db2.gz	KKOCTBXLKKWJGP-MSOLQXFVSA-N	1	0	279.383	4.198	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@H](CCCO)c1ccccc1)c1ccco1	ZINC000276443848	330113540	/nfs/dbraw/zinc/11/35/40/330113540.db2.gz	KSMAUJPXXMNHOA-MSOLQXFVSA-N	1	0	299.414	4.390	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccc(C)s1)c1ccco1	ZINC000279070129	330121486	/nfs/dbraw/zinc/12/14/86/330121486.db2.gz	ROWIHDUMMGVYEF-CQSZACIVSA-N	1	0	261.390	4.447	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@@H](C)c1c(C)noc1C)c1ccco1	ZINC000279138506	330121766	/nfs/dbraw/zinc/12/17/66/330121766.db2.gz	YXOQVZQSBPWBTR-IUODEOHRSA-N	1	0	288.391	4.285	20	30		CIEDRO
Cc1ccc(CCC2CC[NH+]([C@H]3CC[C@H](C#N)C3)CC2)cc1	ZINC000429725746	330125347	/nfs/dbraw/zinc/12/53/47/330125347.db2.gz	ZRJYWBJKFCHNFO-PMACEKPBSA-N	1	0	296.458	4.332	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CCC[C@H](c2ccccc2)C1	ZINC000433059120	330141894	/nfs/dbraw/zinc/14/18/94/330141894.db2.gz	MGALHUGVZWLBJZ-KRWDZBQOSA-N	1	0	270.420	4.196	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@H]1CC(C)(C)Oc2ccc(N)cc21	ZINC000423438842	330201562	/nfs/dbraw/zinc/20/15/62/330201562.db2.gz	NNIQXXVUHNEFJE-XEZPLFJOSA-N	1	0	288.435	4.061	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccc2c(c1)CCCN2)c1ccco1	ZINC000423454138	330203335	/nfs/dbraw/zinc/20/33/35/330203335.db2.gz	YQHGIZGALYOUEK-SFHVURJKSA-N	1	0	296.414	4.435	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2)c1ccco1	ZINC000423454137	330203388	/nfs/dbraw/zinc/20/33/88/330203388.db2.gz	YQHGIZGALYOUEK-GOSISDBHSA-N	1	0	296.414	4.435	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](CC)CSc1ccccc1[N+](=O)[O-]	ZINC000536858302	330252594	/nfs/dbraw/zinc/25/25/94/330252594.db2.gz	OABOGCMZQWRKOG-STQMWFEESA-N	1	0	294.420	4.020	20	30		CIEDRO
Cc1ccc2c(c1)[C@@H]([NH2+]CC1CCC(C#N)CC1)[C@H](C)C2	ZINC000580483908	330256704	/nfs/dbraw/zinc/25/67/04/330256704.db2.gz	WDMRIVNTEIFHPB-XTUQQUOLSA-N	1	0	282.431	4.148	20	30		CIEDRO
C=CC(C)(C)CC[NH2+][C@H]1CCC[C@H](C(F)(F)F)C1	ZINC000527734302	330278713	/nfs/dbraw/zinc/27/87/13/330278713.db2.gz	IAUYIUGMNSNFOF-RYUDHWBXSA-N	1	0	263.347	4.299	20	30		CIEDRO
C=CC(C)(C)CC[NH2+][C@H]1CCC[C@H](c2cccnc2)C1	ZINC000527736630	330278777	/nfs/dbraw/zinc/27/87/77/330278777.db2.gz	NWJRRIIHTIYUQZ-RDJZCZTQSA-N	1	0	272.436	4.300	20	30		CIEDRO
C=CC(C)(C)CC[NH2+][C@@H]1CCC[C@@H](c2cccnc2)C1	ZINC000527736629	330278834	/nfs/dbraw/zinc/27/88/34/330278834.db2.gz	NWJRRIIHTIYUQZ-NVXWUHKLSA-N	1	0	272.436	4.300	20	30		CIEDRO
N#CCCCOc1cccc(C[NH2+]CC[C@H]2CC=CCC2)c1	ZINC000527787967	330283427	/nfs/dbraw/zinc/28/34/27/330283427.db2.gz	JRFSQHNOZNLGTK-KRWDZBQOSA-N	1	0	298.430	4.205	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@@H](C)c1cc(-c2ccccc2)n(C)n1	ZINC000527894998	330292679	/nfs/dbraw/zinc/29/26/79/330292679.db2.gz	OUDBWQFJTMHGTD-HOCLYGCPSA-N	1	0	283.419	4.092	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@@H](C)c1cc(-c2ccccc2)n(C)n1	ZINC000527894996	330292723	/nfs/dbraw/zinc/29/27/23/330292723.db2.gz	OUDBWQFJTMHGTD-GOEBONIOSA-N	1	0	283.419	4.092	20	30		CIEDRO
CCC(F)(F)C(C)(C)C[NH2+][C@H]1CCc2ccc(C#N)cc21	ZINC000527985959	330298720	/nfs/dbraw/zinc/29/87/20/330298720.db2.gz	OALIGWBUIDBKCO-HNNXBMFYSA-N	1	0	292.373	4.207	20	30		CIEDRO
CC[C@H](CCc1ccccc1)[NH2+][C@@H]1CCC[C@@H](C#N)C1	ZINC000527959483	330300515	/nfs/dbraw/zinc/30/05/15/330300515.db2.gz	YYQVMFIJJNDGQM-KZNAEPCWSA-N	1	0	270.420	4.070	20	30		CIEDRO
CC[C@H](CCc1ccccc1)[NH2+][C@@H]1CCC[C@H](C#N)C1	ZINC000527959484	330300528	/nfs/dbraw/zinc/30/05/28/330300528.db2.gz	YYQVMFIJJNDGQM-RCCFBDPRSA-N	1	0	270.420	4.070	20	30		CIEDRO
C[C@H]([NH2+][C@@H](c1ccccn1)C1CCC1)c1ccc(C#N)cc1	ZINC000527962354	330300794	/nfs/dbraw/zinc/30/07/94/330300794.db2.gz	CNRLZWCHXPAYDJ-IFXJQAMLSA-N	1	0	291.398	4.145	20	30		CIEDRO
C[C@@H](Cc1ccc(Cl)cc1)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000036937843	330315176	/nfs/dbraw/zinc/31/51/76/330315176.db2.gz	OYPYQDHHNBXHPC-KBPBESRZSA-N	1	0	298.817	4.493	20	30		CIEDRO
CCCCCOc1ccc(C[NH2+][C@@H]2CC[C@H](C#N)C2)cc1	ZINC000424192460	330323920	/nfs/dbraw/zinc/32/39/20/330323920.db2.gz	IXQJGIVUSRXLPH-DLBZAZTESA-N	1	0	286.419	4.037	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+]Cc2ccc(-c3ccccc3)cc2F)C1	ZINC000424202041	330327012	/nfs/dbraw/zinc/32/70/12/330327012.db2.gz	SDCCRDVTGOBRTK-KBXCAEBGSA-N	1	0	294.373	4.275	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@H]1C[C@H](C(C)C)c2ccccc21	ZINC000424297379	330336345	/nfs/dbraw/zinc/33/63/45/330336345.db2.gz	QPUDDJXBZHTRBS-VLQPXKRTSA-N	1	0	285.431	4.052	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@@H]2CC[C@@H](c3ccc(Cl)cc3)C2)C1	ZINC000424317349	330339546	/nfs/dbraw/zinc/33/95/46/330339546.db2.gz	BZBJWQHGLCNEAU-LBRJOISOSA-N	1	0	288.822	4.258	20	30		CIEDRO
CC(C)C[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1cccs1	ZINC000424318062	330339730	/nfs/dbraw/zinc/33/97/30/330339730.db2.gz	CLDPQFQFXRXWMS-MJBXVCDLSA-N	1	0	262.422	4.117	20	30		CIEDRO
Cc1ccc([C@H]([NH2+][C@@H]2CC[C@H](C#N)C2)c2ccccc2)cc1	ZINC000424318283	330339856	/nfs/dbraw/zinc/33/98/56/330339856.db2.gz	CXMWROLGFDNVMR-PWIZWCRZSA-N	1	0	290.410	4.366	20	30		CIEDRO
COc1ccc([C@@H](C)[NH2+][C@@H]2CC[C@H](C#N)C2)c2ccccc12	ZINC000424321208	330340112	/nfs/dbraw/zinc/34/01/12/330340112.db2.gz	HDJWQXOYRDXBOM-QLFBSQMISA-N	1	0	294.398	4.191	20	30		CIEDRO
Cc1c2ccccc2oc1[C@H](C)[NH2+][C@@H]1CC[C@H](C#N)C1	ZINC000424323381	330340650	/nfs/dbraw/zinc/34/06/50/330340650.db2.gz	JADUSGRRLBRLDU-MELADBBJSA-N	1	0	268.360	4.084	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccccc1C(C)(C)C	ZINC000424328038	330341693	/nfs/dbraw/zinc/34/16/93/330341693.db2.gz	NTCHQBOYBODGEN-QLFBSQMISA-N	1	0	270.420	4.327	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc(Cl)s1	ZINC000424334054	330342884	/nfs/dbraw/zinc/34/28/84/330342884.db2.gz	VHUCGTFIUAEXPD-HBNTYKKESA-N	1	0	268.813	4.134	20	30		CIEDRO
CC1(c2ccccc2)CCC([NH2+][C@@H]2CC[C@H](C#N)C2)CC1	ZINC000424333899	330342938	/nfs/dbraw/zinc/34/29/38/330342938.db2.gz	USDIPOSHBAXSQW-WEOZKBJRSA-N	1	0	282.431	4.169	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@H]2CCC[C@H]2c2ccccc2Cl)C1	ZINC000424335024	330343301	/nfs/dbraw/zinc/34/33/01/330343301.db2.gz	WGQMVYDHSKVYMF-YXPYIKCWSA-N	1	0	288.822	4.258	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H]2CCC[C@@H]2c2ccccc2)c(F)c1	ZINC000533309310	330356956	/nfs/dbraw/zinc/35/69/56/330356956.db2.gz	GINSIIXQJKJQQI-MJGOQNOKSA-N	1	0	294.373	4.123	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCc1ccc(OC(F)F)cc1)C1CC1	ZINC000533362050	330359865	/nfs/dbraw/zinc/35/98/65/330359865.db2.gz	DTTMFEXRQSDTBD-MRXNPFEDSA-N	1	0	295.373	4.165	20	30		CIEDRO
C=C(CC)C[N@H+](CCc1ccccn1)Cc1ccc(F)cc1	ZINC000536902437	330363581	/nfs/dbraw/zinc/36/35/81/330363581.db2.gz	WCIKCNMREMSRKV-UHFFFAOYSA-N	1	0	298.405	4.232	20	30		CIEDRO
C=C(CC)C[N@@H+]1CCCC[C@@H]1c1nc2ccccc2n1C	ZINC000536906937	330363771	/nfs/dbraw/zinc/36/37/71/330363771.db2.gz	YEXQAFSYPXSLQI-QGZVFWFLSA-N	1	0	283.419	4.067	20	30		CIEDRO
C=CCCC[C@@H](C)[N@H+](C)Cc1nc2ccccc2s1	ZINC000536994500	330375398	/nfs/dbraw/zinc/37/53/98/330375398.db2.gz	CFYZEUCHNRIZSR-CYBMUJFWSA-N	1	0	274.433	4.473	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@H](C)c1cccc(OC)c1	ZINC000119640719	330378033	/nfs/dbraw/zinc/37/80/33/330378033.db2.gz	BDORELINUBCPKH-OAHLLOKOSA-N	1	0	297.398	4.111	20	30		CIEDRO
C[C@@H](c1ccc2ccccc2c1)[NH+]1CCC(C#N)CC1	ZINC000057872732	330379151	/nfs/dbraw/zinc/37/91/51/330379151.db2.gz	KWKRBRAJEQYFCX-AWEZNQCLSA-N	1	0	264.372	4.136	20	30		CIEDRO
CCCc1ccc([C@@H]([NH2+]C[C@H](C#N)CCC#N)C(C)C)cc1	ZINC000119838871	330379323	/nfs/dbraw/zinc/37/93/23/330379323.db2.gz	QHFDCAZLIYJLHK-HKUYNNGSSA-N	1	0	297.446	4.369	20	30		CIEDRO
CCCc1ccc([C@H]([NH2+]C[C@H](C#N)CCC#N)C(C)C)cc1	ZINC000119838747	330379341	/nfs/dbraw/zinc/37/93/41/330379341.db2.gz	QHFDCAZLIYJLHK-PKOBYXMFSA-N	1	0	297.446	4.369	20	30		CIEDRO
CCCc1ccc([C@H]([NH2+]C[C@@H](C#N)CCC#N)C(C)C)cc1	ZINC000119839062	330379392	/nfs/dbraw/zinc/37/93/92/330379392.db2.gz	QHFDCAZLIYJLHK-IEBWSBKVSA-N	1	0	297.446	4.369	20	30		CIEDRO
C=CC[N@H+](Cc1cccs1)Cc1ccc(COC)cc1	ZINC000119933722	330380358	/nfs/dbraw/zinc/38/03/58/330380358.db2.gz	MANOCMTTYLICBU-UHFFFAOYSA-N	1	0	287.428	4.083	20	30		CIEDRO
C=C(C)C(C)(C)C(=O)Nc1cccc(C[NH+](CC)CC)c1	ZINC000424580316	330386982	/nfs/dbraw/zinc/38/69/82/330386982.db2.gz	DYNGPRBRWWFZRT-UHFFFAOYSA-N	1	0	288.435	4.069	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCc1csc(C(C)C)n1)C1CC1	ZINC000120855960	330393136	/nfs/dbraw/zinc/39/31/36/330393136.db2.gz	UEPTUTAQIUKWSR-HNNXBMFYSA-N	1	0	278.465	4.143	20	30		CIEDRO
C=CCC[C@@H]([NH2+][C@@H](C)c1cccnc1)c1ccccc1	ZINC000090580748	330393750	/nfs/dbraw/zinc/39/37/50/330393750.db2.gz	XOAOBWMPPPHELF-MAUKXSAKSA-N	1	0	266.388	4.440	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@H](C)c1cccnc1)c1ccccc1	ZINC000090580747	330393767	/nfs/dbraw/zinc/39/37/67/330393767.db2.gz	XOAOBWMPPPHELF-QAPCUYQASA-N	1	0	266.388	4.440	20	30		CIEDRO
CC[C@H]1CCCC[C@@H]1[N@H+](C)CCCC(C)(C)C#N	ZINC000120901509	330393974	/nfs/dbraw/zinc/39/39/74/330393974.db2.gz	WHFLGPZHMOCYRN-GJZGRUSLSA-N	1	0	250.430	4.217	20	30		CIEDRO
C[C@H]1[C@@H](c2ccccc2)CC[N@@H+]1Cc1cccc(C#N)c1F	ZINC000537047873	330394506	/nfs/dbraw/zinc/39/45/06/330394506.db2.gz	UIYRHIOMQVQIME-KSSFIOAISA-N	1	0	294.373	4.075	20	30		CIEDRO
C[C@@H]1CCC[C@@H]([NH2+][C@@H](CCC#N)c2ccccc2)C1	ZINC000090665537	330394553	/nfs/dbraw/zinc/39/45/53/330394553.db2.gz	IBJKGIWEPDFMQE-OIISXLGYSA-N	1	0	256.393	4.200	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@@H](CCC#N)c1ccccc1	ZINC000090665795	330394612	/nfs/dbraw/zinc/39/46/12/330394612.db2.gz	IDDTUCRPHOQNQN-ZOBUZTSGSA-N	1	0	256.393	4.222	20	30		CIEDRO
C=C(C)C[NH2+][C@H](C)c1ccc(OC2CCCC2)c(OC)c1	ZINC000537051086	330395157	/nfs/dbraw/zinc/39/51/57/330395157.db2.gz	JCKQHIZGJROZLP-CQSZACIVSA-N	1	0	289.419	4.243	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(F)cc1C#N)C(C)(C)c1ccccc1	ZINC000537054701	330395176	/nfs/dbraw/zinc/39/51/76/330395176.db2.gz	SBEWSSJVVOGSPA-AWEZNQCLSA-N	1	0	296.389	4.153	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccccc1C#N)C(C)(C)c1ccccc1	ZINC000537054602	330395285	/nfs/dbraw/zinc/39/52/85/330395285.db2.gz	OPGRHKPDXFQCQE-OAHLLOKOSA-N	1	0	278.399	4.014	20	30		CIEDRO
CCC(CC)[C@H]([NH2+]CCCSCC#N)c1ccccc1	ZINC000537078822	330398135	/nfs/dbraw/zinc/39/81/35/330398135.db2.gz	UDDBXQFDEOGGFV-KRWDZBQOSA-N	1	0	290.476	4.400	20	30		CIEDRO
CC[C@@H](C)[C@@H]([NH2+]CC1(C#N)CC1)c1ccc(Cl)cc1	ZINC000537288750	330431113	/nfs/dbraw/zinc/43/11/13/330431113.db2.gz	AFTCDHDSBDYFBN-IUODEOHRSA-N	1	0	276.811	4.321	20	30		CIEDRO
Cc1ccccc1[C@@H]([NH2+]Cc1cccc(C#N)c1F)C1CC1	ZINC000537291918	330431210	/nfs/dbraw/zinc/43/12/10/330431210.db2.gz	ZTIBTPPDHAMWNU-IBGZPJMESA-N	1	0	294.373	4.247	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@@H](C)c1sc(CC)nc1C	ZINC000537305782	330432036	/nfs/dbraw/zinc/43/20/36/330432036.db2.gz	LBGIHJFDRLIRFG-NEPJUHHUSA-N	1	0	266.454	4.409	20	30		CIEDRO
COc1cccc([C@H](C)[NH2+][C@H](C)c2ccc(C#N)c(F)c2)c1	ZINC000537406027	330434740	/nfs/dbraw/zinc/43/47/40/330434740.db2.gz	CCVDSKBGGMISKP-QWHCGFSZSA-N	1	0	298.361	4.118	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+]C1(c2nc(C)cs2)CCC1	ZINC000537431404	330436818	/nfs/dbraw/zinc/43/68/18/330436818.db2.gz	YUWAIDALXMKNTK-ZDUSSCGKSA-N	1	0	264.438	4.165	20	30		CIEDRO
C[C@@H](C#N)C[NH2+][C@@H]1CC=C(c2ccc(Cl)cc2)CC1	ZINC000514839804	330466358	/nfs/dbraw/zinc/46/63/58/330466358.db2.gz	XUYAUPMCCRURLE-BLLLJJGKSA-N	1	0	274.795	4.025	20	30		CIEDRO
CC(C)c1ccc(CC[NH2+]Cc2ccc(C#N)cc2)cc1	ZINC000515077733	330470160	/nfs/dbraw/zinc/47/01/60/330470160.db2.gz	AHKACLCJRKPRDE-UHFFFAOYSA-N	1	0	278.399	4.014	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@](C)(O)CCC(C)C)c1ccco1	ZINC000428212177	330515908	/nfs/dbraw/zinc/51/59/08/330515908.db2.gz	ZIBRYULQZAYXGB-RDJZCZTQSA-N	1	0	279.424	4.064	20	30		CIEDRO
C=C(C[NH2+]Cc1nc2ccc(F)cc2s1)c1ccccc1	ZINC000428867712	330533383	/nfs/dbraw/zinc/53/33/83/330533383.db2.gz	MXYWJDDAKCOSPG-UHFFFAOYSA-N	1	0	298.386	4.238	20	30		CIEDRO
CC(C)(C#N)CCCC[NH2+]C(C)(C)c1ccccc1F	ZINC000429261423	330541262	/nfs/dbraw/zinc/54/12/62/330541262.db2.gz	PYQGWAMHCBFXBD-UHFFFAOYSA-N	1	0	276.399	4.370	20	30		CIEDRO
CC[C@H]1CCC[C@@H]1[NH2+]Cc1ccccc1C(C)(C)C#N	ZINC000429768528	330554476	/nfs/dbraw/zinc/55/44/76/330554476.db2.gz	AZKFLCPAAGCZKK-YOEHRIQHSA-N	1	0	270.420	4.156	20	30		CIEDRO
CC[C@@H]1CCC[C@H]1[NH2+]Cc1ccccc1C(C)(C)C#N	ZINC000429768521	330554525	/nfs/dbraw/zinc/55/45/25/330554525.db2.gz	AZKFLCPAAGCZKK-RHSMWYFYSA-N	1	0	270.420	4.156	20	30		CIEDRO
CC[C@H]1CCC[C@H]1[NH2+]Cc1ccccc1C(C)(C)C#N	ZINC000429768524	330554538	/nfs/dbraw/zinc/55/45/38/330554538.db2.gz	AZKFLCPAAGCZKK-WMLDXEAASA-N	1	0	270.420	4.156	20	30		CIEDRO
N#CCC1(C[NH2+][C@@H](c2cccs2)C2CCCC2)CC1	ZINC000430725994	330571451	/nfs/dbraw/zinc/57/14/51/330571451.db2.gz	SRCNYFZRVXPNCI-OAHLLOKOSA-N	1	0	274.433	4.263	20	30		CIEDRO
C[C@H]([NH2+]CC1(CC#N)CC1)c1cc2cc(Cl)ccc2o1	ZINC000430738775	330572081	/nfs/dbraw/zinc/57/20/81/330572081.db2.gz	LOLJGPADZRXFPW-NSHDSACASA-N	1	0	288.778	4.431	20	30		CIEDRO
N#CCC1(C[NH2+][C@@H]2CCC[C@@H]2c2ccc(Cl)cc2)CC1	ZINC000430753052	330573089	/nfs/dbraw/zinc/57/30/89/330573089.db2.gz	JBBLQUGIEUODKQ-HZPDHXFCSA-N	1	0	288.822	4.260	20	30		CIEDRO
N#CCCC[C@@H]([NH2+]CCCCCF)c1ccccc1	ZINC000433016713	330612320	/nfs/dbraw/zinc/61/23/20/330612320.db2.gz	TXYHCWXUCDGNIB-MRXNPFEDSA-N	1	0	262.372	4.151	20	30		CIEDRO
Cc1ncsc1CC[NH2+][C@@H](CCCC#N)c1ccccc1	ZINC000433016997	330612321	/nfs/dbraw/zinc/61/23/21/330612321.db2.gz	WKDUCURCWMJPMC-INIZCTEOSA-N	1	0	299.443	4.019	20	30		CIEDRO
CC/C=C/CC[NH2+][C@@H](CCCC#N)c1ccccc1	ZINC000433027738	330613057	/nfs/dbraw/zinc/61/30/57/330613057.db2.gz	WREALPBOKLVMQH-IDOMTICXSA-N	1	0	256.393	4.367	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@H](C)c1ccc(C(C)C)cc1	ZINC000435665024	330659738	/nfs/dbraw/zinc/65/97/38/330659738.db2.gz	OPADLOKUSFAICX-LZQZEXGQSA-N	1	0	287.447	4.442	20	30		CIEDRO
C=C(C[NH2+]Cc1cc2c(cccc2F)[nH]1)c1ccccc1	ZINC000436232224	330671319	/nfs/dbraw/zinc/67/13/19/330671319.db2.gz	NJVOQQZOJNRMJO-UHFFFAOYSA-N	1	0	280.346	4.110	20	30		CIEDRO
C=C1CC[NH+](Cc2ccc(N(C)c3ccccc3)nc2)CC1	ZINC000437132218	330694496	/nfs/dbraw/zinc/69/44/96/330694496.db2.gz	GVXBPMXRRNMJGB-UHFFFAOYSA-N	1	0	293.414	4.002	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1nc(C(C)(C)C)cs1)C1CC1	ZINC000438982928	330731746	/nfs/dbraw/zinc/73/17/46/330731746.db2.gz	YNIHTLZNOVGQHK-ZDUSSCGKSA-N	1	0	278.465	4.275	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCCOC1CCCCC1)C1CC1	ZINC000439077328	330733494	/nfs/dbraw/zinc/73/34/94/330733494.db2.gz	IQNKDERSVSACHU-QGZVFWFLSA-N	1	0	265.441	4.060	20	30		CIEDRO
CSc1ccccc1[C@H](C)[NH2+]Cc1ccc(CC#N)cc1	ZINC000440626565	330752861	/nfs/dbraw/zinc/75/28/61/330752861.db2.gz	OFEVBNQZIRJSPD-AWEZNQCLSA-N	1	0	296.439	4.325	20	30		CIEDRO
N#CC1CCC(CNc2cc[nH+]c3cc(F)ccc23)CC1	ZINC000440638844	330753239	/nfs/dbraw/zinc/75/32/39/330753239.db2.gz	MYYNXSFQCLQKGG-UHFFFAOYSA-N	1	0	283.350	4.116	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CC[C@@H](C#N)C1)C(C)(C)c1ccccc1	ZINC000442786749	330783237	/nfs/dbraw/zinc/78/32/37/330783237.db2.gz	XMZULCPAHGPQOJ-OIISXLGYSA-N	1	0	270.420	4.025	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH2+][C@H](c2cccc(F)c2)C2CCCC2)C1	ZINC000442793059	330783983	/nfs/dbraw/zinc/78/39/83/330783983.db2.gz	PHRPFIQUABWNBH-XWIAVFTESA-N	1	0	286.394	4.339	20	30		CIEDRO
CCC(CC)(C[NH2+][C@H]1CC[C@@H](C#N)C1)c1ccccc1	ZINC000442798182	330784373	/nfs/dbraw/zinc/78/43/73/330784373.db2.gz	YDMIJIRYYBEBQK-WBVHZDCISA-N	1	0	270.420	4.026	20	30		CIEDRO
CC(C)c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)CCC2	ZINC000442823076	330785681	/nfs/dbraw/zinc/78/56/81/330785681.db2.gz	YUOLZJVGJWCVCN-POZUXBRTSA-N	1	0	282.431	4.469	20	30		CIEDRO
Cc1cccc(-c2ccc(C[NH2+][C@@H]3CC[C@H](C#N)C3)cc2)c1	ZINC000442838725	330786284	/nfs/dbraw/zinc/78/62/84/330786284.db2.gz	QPIUYNAOFKWAJO-FXAWDEMLSA-N	1	0	290.410	4.444	20	30		CIEDRO
CC(C)CCC[C@@H](C)[NH2+]CC1CCC(C#N)CC1	ZINC000442868171	330788652	/nfs/dbraw/zinc/78/86/52/330788652.db2.gz	NAWCTYSIDJJADQ-QQFBHYJXSA-N	1	0	250.430	4.121	20	30		CIEDRO
CC(C)C[C@H](C)C[C@@H](C)[NH2+]CC1CCC(C#N)CC1	ZINC000442875697	330789624	/nfs/dbraw/zinc/78/96/24/330789624.db2.gz	WNWGOAPDCMSGCF-NJINODPHSA-N	1	0	264.457	4.367	20	30		CIEDRO
CC(C)(C[NH2+][C@H]1CC[C@H](C#N)C1)c1c(F)cccc1Cl	ZINC000442880272	330790071	/nfs/dbraw/zinc/79/00/71/330790071.db2.gz	YCFBMZKBBGCAHO-RYUDHWBXSA-N	1	0	294.801	4.039	20	30		CIEDRO
Cc1cc(C[NH2+][C@@H]2CCSc3ccccc32)ccc1C#N	ZINC000443981337	330808298	/nfs/dbraw/zinc/80/82/98/330808298.db2.gz	RQAPTPFEQLQMGH-QGZVFWFLSA-N	1	0	294.423	4.193	20	30		CIEDRO
Fc1ccc(C#CC[NH2+][C@H]2CCC[C@@H]2c2ccccc2)cc1	ZINC000445997914	330842430	/nfs/dbraw/zinc/84/24/30/330842430.db2.gz	CXTOCZUFHWFLJV-UXHICEINSA-N	1	0	293.385	4.103	20	30		CIEDRO
C[C@@H]1CCCc2ccccc2[C@@H]1[NH2+][C@H]1CCC[C@H](C#N)C1	ZINC000446752257	330853635	/nfs/dbraw/zinc/85/36/35/330853635.db2.gz	GOLSELPZKAKEGN-WXSAJPJJSA-N	1	0	282.431	4.372	20	30		CIEDRO
CC(C)(C[NH2+][C@H]1CCC[C@@H](C#N)C1)C1=CCCCC1	ZINC000446793689	330854235	/nfs/dbraw/zinc/85/42/35/330854235.db2.gz	GUQHQGFEFJMOFQ-ZBFHGGJFSA-N	1	0	260.425	4.185	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CCCC[C@@H]1C)c1ccc(C#N)cc1	ZINC000447522177	330867669	/nfs/dbraw/zinc/86/76/69/330867669.db2.gz	YARXVMICZSSUDC-RRQGHBQHSA-N	1	0	256.393	4.178	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CCC[C@H](SC)C1)c1ccc(C#N)cc1	ZINC000447538155	330868737	/nfs/dbraw/zinc/86/87/37/330868737.db2.gz	APTJTCPJJCBCOD-ULQDDVLXSA-N	1	0	288.460	4.273	20	30		CIEDRO
Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH2+][C@H]1CCC[C@@H](C#N)C1	ZINC000447545592	330869435	/nfs/dbraw/zinc/86/94/35/330869435.db2.gz	ROMQPTJLFJZFPO-YCPHGPKFSA-N	1	0	286.419	4.274	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@@H]2CCc3c2cccc3Cl)CC1	ZINC000449098696	330898973	/nfs/dbraw/zinc/89/89/73/330898973.db2.gz	QPCIUJUWMULGQM-PTXATLKXSA-N	1	0	288.822	4.389	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@H](C)c1nc(C)cs1	ZINC000449115558	330899906	/nfs/dbraw/zinc/89/99/06/330899906.db2.gz	HYJSTCNOYAUJEX-WCQYABFASA-N	1	0	252.427	4.237	20	30		CIEDRO
N#CCCCC[NH2+][C@H]1CC[C@@H](c2ccc(Cl)cc2)C1	ZINC000449131154	330900905	/nfs/dbraw/zinc/90/09/05/330900905.db2.gz	KKAPEIADAMAAMK-ZBFHGGJFSA-N	1	0	276.811	4.260	20	30		CIEDRO
CC[C@H]([NH2+]C1CCC(C)(C#N)CC1)c1ccc(F)cc1F	ZINC000449154977	330902154	/nfs/dbraw/zinc/90/21/54/330902154.db2.gz	AGVGTNFWYBEDJR-PWZRNIHTSA-N	1	0	292.373	4.478	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+]Cc1csc([C@@H](C)OC)n1	ZINC000449179044	330904124	/nfs/dbraw/zinc/90/41/24/330904124.db2.gz	UZUGIJDEZFYHGR-CHWSQXEVSA-N	1	0	282.453	4.075	20	30		CIEDRO
CCS[C@@H]1CCC[C@@H]([NH2+]C2CCC(C)(C#N)CC2)C1	ZINC000449181339	330904219	/nfs/dbraw/zinc/90/42/19/330904219.db2.gz	GRWCEQNPLMPYAX-LVDPKSTMSA-N	1	0	280.481	4.113	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+]Cc1c(CC)noc1CC	ZINC000449184532	330904532	/nfs/dbraw/zinc/90/45/32/330904532.db2.gz	GKTJGBDJXPTWJO-CYBMUJFWSA-N	1	0	264.413	4.024	20	30		CIEDRO
CCC(CC)[C@@H]1C[C@H]([NH2+]C2CCC(C)(C#N)CC2)CCO1	ZINC000449225297	330907447	/nfs/dbraw/zinc/90/74/47/330907447.db2.gz	JYVQKZJYCAZUKR-UMQBVGHOSA-N	1	0	292.467	4.032	20	30		CIEDRO
Cc1oc2ccccc2c1CC[NH2+]C1CCC(C)(C#N)CC1	ZINC000449252890	330909965	/nfs/dbraw/zinc/90/99/65/330909965.db2.gz	UFUMHRRKQDHUNT-UHFFFAOYSA-N	1	0	296.414	4.346	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+][C@H](C)c1nc(C(C)(C)C)no1	ZINC000449280561	330911564	/nfs/dbraw/zinc/91/15/64/330911564.db2.gz	XWMKGNKTZFGSMC-CHWSQXEVSA-N	1	0	279.428	4.153	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+][C@H](C)c1c(F)cncc1F	ZINC000449320773	330914444	/nfs/dbraw/zinc/91/44/44/330914444.db2.gz	PJGITWJQMYNKPV-VXGBXAGGSA-N	1	0	268.351	4.145	20	30		CIEDRO
COc1cccc2c(C[NH2+]CC(C)(C)CCC#N)cccc12	ZINC000449331341	330915317	/nfs/dbraw/zinc/91/53/17/330915317.db2.gz	NZKUWGBAQKLAPH-UHFFFAOYSA-N	1	0	296.414	4.268	20	30		CIEDRO
CCCC[C@@H]([NH2+]C1CCC(C)(C#N)CC1)C1CCC1	ZINC000449333731	330915486	/nfs/dbraw/zinc/91/54/86/330915486.db2.gz	VRJINXZFCGXCFE-AQFXKWCLSA-N	1	0	262.441	4.407	20	30		CIEDRO
C[C@H](Cc1ccoc1)[NH2+][C@@H](CCCC#N)c1ccccc1	ZINC000449339615	330916145	/nfs/dbraw/zinc/91/61/45/330916145.db2.gz	KZEKZZQQQQUJSE-QAPCUYQASA-N	1	0	282.387	4.235	20	30		CIEDRO
Cc1cc(CC[NH2+]C2CCC(C)(C#N)CC2)ccc1Cl	ZINC000449340686	330916364	/nfs/dbraw/zinc/91/63/64/330916364.db2.gz	WWQXXDSEZKYWFT-UHFFFAOYSA-N	1	0	290.838	4.253	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+]CC(C)(C)c1ccccn1	ZINC000449396181	330922078	/nfs/dbraw/zinc/92/20/78/330922078.db2.gz	XTLUUTWEFMFPAE-HNNXBMFYSA-N	1	0	260.425	4.084	20	30		CIEDRO
N#Cc1ccccc1C[NH2+][C@H]1CCCC[C@H]1CC(F)(F)F	ZINC000449437037	330925474	/nfs/dbraw/zinc/92/54/74/330925474.db2.gz	YMLZKHXBQXQZQA-WFASDCNBSA-N	1	0	296.336	4.159	20	30		CIEDRO
CC(C)C[C@H]1CCC[C@@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)C1	ZINC000449446324	330926360	/nfs/dbraw/zinc/92/63/60/330926360.db2.gz	QTUIPHKXLVZCDR-HZMVEIRTSA-N	1	0	262.441	4.263	20	30		CIEDRO
CCc1cccc(Cl)c1C[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000449446935	330926416	/nfs/dbraw/zinc/92/64/16/330926416.db2.gz	URAZHPZHIGPGDP-JSGCOSHPSA-N	1	0	276.811	4.074	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)CC(=O)Nc1ccccc1C(C)C	ZINC000449470498	330928350	/nfs/dbraw/zinc/92/83/50/330928350.db2.gz	ASUMTLXQGUHWIS-OAHLLOKOSA-N	1	0	288.435	4.083	20	30		CIEDRO
C=C(C)CC[NH2+]Cc1csc(-c2ccc(C)cc2)n1	ZINC000449478674	330929092	/nfs/dbraw/zinc/92/90/92/330929092.db2.gz	SHHKISDXCDWIPV-UHFFFAOYSA-N	1	0	272.417	4.174	20	30		CIEDRO
C=CCC1(C[NH2+][C@H](C)Cc2ccn(C(C)C)n2)CCCC1	ZINC000449606016	330938975	/nfs/dbraw/zinc/93/89/75/330938975.db2.gz	OYJKZOYKUUFEKJ-MRXNPFEDSA-N	1	0	289.467	4.121	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H]1CCCc2c3ccccc3[nH]c21	ZINC000162624862	330943695	/nfs/dbraw/zinc/94/36/95/330943695.db2.gz	TXJVVGZUARAVII-WBMJQRKESA-N	1	0	254.377	4.100	20	30		CIEDRO
N#Cc1cccc(C2([NH2+]CCC3=CCCCC3)CC2)c1	ZINC000450670608	330992334	/nfs/dbraw/zinc/99/23/34/330992334.db2.gz	FQNLNHOGNTUBDG-UHFFFAOYSA-N	1	0	266.388	4.027	20	30		CIEDRO
C=CCCC[C@@H](C)[N@@H+]1CCC[C@@H](c2ccncc2)C1	ZINC000451008197	331011601	/nfs/dbraw/zinc/01/16/01/331011601.db2.gz	WLXFZCFQGGGZFN-NVXWUHKLSA-N	1	0	258.409	4.006	20	30		CIEDRO
Cc1cc(F)ccc1C1CC[NH+](CC2(C#N)CCC2)CC1	ZINC000451065163	331014404	/nfs/dbraw/zinc/01/44/04/331014404.db2.gz	YCXVXTSSCDHPSE-UHFFFAOYSA-N	1	0	286.394	4.007	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(CC#N)cc1)c1cccc(C2CC2)c1	ZINC000451114641	331016001	/nfs/dbraw/zinc/01/60/01/331016001.db2.gz	LTRUFWXRBXATFW-HNNXBMFYSA-N	1	0	290.410	4.481	20	30		CIEDRO
C[C@H]([NH2+]CCC(C)(C)C#N)c1cccc(C2CC2)c1	ZINC000451113830	331016016	/nfs/dbraw/zinc/01/60/16/331016016.db2.gz	JRSXKMATZFQRJJ-ZDUSSCGKSA-N	1	0	256.393	4.154	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)c(F)c1)c1cccc(C2CC2)c1	ZINC000451116739	331016282	/nfs/dbraw/zinc/01/62/82/331016282.db2.gz	ROXWJRBTDBAISK-ZDUSSCGKSA-N	1	0	294.373	4.426	20	30		CIEDRO
CCCNc1ccc(C[NH2+]C2CCC(C)(C#N)CC2)cc1	ZINC000451164590	331018335	/nfs/dbraw/zinc/01/83/35/331018335.db2.gz	SCFJNHYGIRZRBR-UHFFFAOYSA-N	1	0	285.435	4.071	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)c1ccc(OC)c(Br)c1	ZINC000163314820	331020029	/nfs/dbraw/zinc/02/00/29/331020029.db2.gz	QGHDQIVAPNKATO-QWRGUYRKSA-N	1	0	298.224	4.073	20	30		CIEDRO
C=CCC1(C[NH2+][C@H](C)c2cncc(F)c2)CCCC1	ZINC000451247406	331021833	/nfs/dbraw/zinc/02/18/33/331021833.db2.gz	XMXNEVNOEIPBOS-CYBMUJFWSA-N	1	0	262.372	4.008	20	30		CIEDRO
CC(C)(C#N)CCC[NH2+][C@H]1CCCC[C@H]1CC(F)(F)F	ZINC000451297435	331023730	/nfs/dbraw/zinc/02/37/30/331023730.db2.gz	OKNVFVZDBITWFT-STQMWFEESA-N	1	0	290.373	4.417	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CC2(CCC2)[C@@H]1c1ccco1	ZINC000451855976	331044952	/nfs/dbraw/zinc/04/49/52/331044952.db2.gz	PFZJJYJYLGVXTG-HNNXBMFYSA-N	1	0	272.392	4.137	20	30		CIEDRO
N#Cc1ccc(CN2CC3(CCC3)[C@@H]2c2ccco2)cc1F	ZINC000451862492	331045291	/nfs/dbraw/zinc/04/52/91/331045291.db2.gz	VMNUSRASACEALV-KRWDZBQOSA-N	1	0	296.345	4.018	20	30		CIEDRO
CC1(C#N)CCC([NH2+]C2(c3ccccc3)CCC2)CC1	ZINC000453162332	331095875	/nfs/dbraw/zinc/09/58/75/331095875.db2.gz	LMPUEDZWMRLGOZ-UHFFFAOYSA-N	1	0	268.404	4.128	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@H]1CC[C@H](C)c2ccsc21	ZINC000453207077	331101466	/nfs/dbraw/zinc/10/14/66/331101466.db2.gz	FYCYMELSPUYSAL-XRGAULLZSA-N	1	0	291.460	4.257	20	30		CIEDRO
CCC[C@@H]([NH2+]CC1CCC(C#N)CC1)C(C)(C)C	ZINC000453228503	331103979	/nfs/dbraw/zinc/10/39/79/331103979.db2.gz	WFHOOFAVARAHJY-YMAMQOFZSA-N	1	0	250.430	4.121	20	30		CIEDRO
CCc1ccc([C@H](CC)[NH2+][C@H]2CC[C@@H](CC#N)C2)cc1	ZINC000453286616	331111226	/nfs/dbraw/zinc/11/12/26/331111226.db2.gz	DLSPRVYPCOXEAQ-SZMVWBNQSA-N	1	0	270.420	4.372	20	30		CIEDRO
CCc1ccc([C@@H](CC)[NH2+][C@H]2CC[C@@H](CC#N)C2)cc1	ZINC000453286615	331111304	/nfs/dbraw/zinc/11/13/04/331111304.db2.gz	DLSPRVYPCOXEAQ-RYQLBKOJSA-N	1	0	270.420	4.372	20	30		CIEDRO
Cc1cc([C@@H](C)[NH2+][C@H]2CC[C@@H](CC#N)C2)cc(C)c1F	ZINC000453289810	331111663	/nfs/dbraw/zinc/11/16/63/331111663.db2.gz	JDSSRWUPCMTJOV-YCPHGPKFSA-N	1	0	274.383	4.176	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1cccc(C2CC2)c1	ZINC000453292735	331111985	/nfs/dbraw/zinc/11/19/85/331111985.db2.gz	OSFWTAGVNALGMO-GLJUWKHASA-N	1	0	268.404	4.297	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@H](C)c1sc(C(C)C)nc1C	ZINC000453306955	331114058	/nfs/dbraw/zinc/11/40/58/331114058.db2.gz	KSYOPNNAVRHUNH-LLVKDONJSA-N	1	0	266.454	4.438	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@H](c1ccc(F)cc1)c1ccccn1	ZINC000453309124	331114332	/nfs/dbraw/zinc/11/43/32/331114332.db2.gz	OYAMKCUDSLENSU-QGZVFWFLSA-N	1	0	284.378	4.112	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1ccc(SC)c(OC)c1	ZINC000453308556	331114382	/nfs/dbraw/zinc/11/43/82/331114382.db2.gz	CVSPJQMXLMMFJT-LBPRGKRZSA-N	1	0	265.422	4.034	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](c1cccnc1)c1ccc(F)c(C)c1	ZINC000453329783	331117562	/nfs/dbraw/zinc/11/75/62/331117562.db2.gz	XZRYVVYMKAFSIM-SFHVURJKSA-N	1	0	284.378	4.174	20	30		CIEDRO
C=C(CC)C[NH2+][C@@H]1CCCc2ncc(C(F)(F)F)cc21	ZINC000453338028	331118634	/nfs/dbraw/zinc/11/86/34/331118634.db2.gz	AXEIDTJJUQVJSL-CYBMUJFWSA-N	1	0	284.325	4.034	20	30		CIEDRO
C=CCC1(C[NH2+][C@@H](C)c2ccc(F)cn2)CCCC1	ZINC000453340172	331119019	/nfs/dbraw/zinc/11/90/19/331119019.db2.gz	BLFRSMYMKYVPKS-ZDUSSCGKSA-N	1	0	262.372	4.008	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H]2CCCc3cc(F)ccc32)cc1F	ZINC000453364963	331122961	/nfs/dbraw/zinc/12/29/61/331122961.db2.gz	CFSALFKQQOTPFQ-SFHVURJKSA-N	1	0	298.336	4.004	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+]C2(Cc3cccc(Cl)c3)CC2)C1	ZINC000453376139	331124686	/nfs/dbraw/zinc/12/46/86/331124686.db2.gz	PEBUSSXQSOALPY-GOEBONIOSA-N	1	0	288.822	4.087	20	30		CIEDRO
C=CCC1(C[NH2+][C@H](C)c2csc(C)n2)CCCC1	ZINC000453390497	331127270	/nfs/dbraw/zinc/12/72/70/331127270.db2.gz	YADCDUKCIZIHBL-GFCCVEGCSA-N	1	0	264.438	4.239	20	30		CIEDRO
C=CCSCC[NH2+]Cc1ccc(Cl)c(Cl)c1	ZINC000163897381	331138228	/nfs/dbraw/zinc/13/82/28/331138228.db2.gz	WBOIYTCBXBKVQL-UHFFFAOYSA-N	1	0	276.232	4.002	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1cnc(C2CC2)nc1)c1ccccc1	ZINC000459452724	331282022	/nfs/dbraw/zinc/28/20/22/331282022.db2.gz	RZIGQHPQQUNBGT-SFHVURJKSA-N	1	0	293.414	4.151	20	30		CIEDRO
COc1ccc(-c2ccccc2C)cc1C[NH2+]CCCC#N	ZINC000459492151	331284774	/nfs/dbraw/zinc/28/47/74/331284774.db2.gz	YBWVXPLDHFXONS-UHFFFAOYSA-N	1	0	294.398	4.064	20	30		CIEDRO
Cc1cc(F)c(C[NH2+]CC2CCC(C#N)CC2)c(Cl)c1	ZINC000459527785	331286117	/nfs/dbraw/zinc/28/61/17/331286117.db2.gz	KQLAGJHPCIDZIQ-UHFFFAOYSA-N	1	0	294.801	4.207	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+][C@@H](C)c1nc2c(s1)CCC2	ZINC000459645387	331291885	/nfs/dbraw/zinc/29/18/85/331291885.db2.gz	GKIBUELTGWQYFT-NWDGAFQWSA-N	1	0	264.438	4.027	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1C[C@H]1c1c(F)cccc1Cl	ZINC000459666393	331293038	/nfs/dbraw/zinc/29/30/38/331293038.db2.gz	MNUANVQBMGJLHJ-BXUZGUMPSA-N	1	0	294.801	4.255	20	30		CIEDRO
CC(C)(CC#N)C[NH2+]Cc1ccc(-c2ccccc2F)o1	ZINC000459688916	331294605	/nfs/dbraw/zinc/29/46/05/331294605.db2.gz	ICPFAUFKKVHPKF-UHFFFAOYSA-N	1	0	286.350	4.115	20	30		CIEDRO
C[C@@H]([NH2+]CC(C)(C)CC#N)[C@@H]1C[C@H]1c1ccc(Cl)s1	ZINC000459732756	331296710	/nfs/dbraw/zinc/29/67/10/331296710.db2.gz	PGMJGYLNKLALLV-GRYCIOLGSA-N	1	0	296.867	4.423	20	30		CIEDRO
C[C@]1([NH2+]Cc2ccc(C#N)cc2C(F)(F)F)CC=CCC1	ZINC000459765639	331299324	/nfs/dbraw/zinc/29/93/24/331299324.db2.gz	OECPUKOKQYLENS-HNNXBMFYSA-N	1	0	294.320	4.165	20	30		CIEDRO
C[C@H](Cc1cccc(F)c1)[N@H+](C)CCCC(C)(C)C#N	ZINC000459769730	331299837	/nfs/dbraw/zinc/29/98/37/331299837.db2.gz	RWFVEMHINFMMLI-CQSZACIVSA-N	1	0	276.399	4.018	20	30		CIEDRO
C=Cc1ccc(CC[NH2+][C@H](C)c2cccc(C#N)c2)cc1	ZINC000461058024	331311011	/nfs/dbraw/zinc/31/10/11/331311011.db2.gz	LFCPRLYTHBRTNY-OAHLLOKOSA-N	1	0	276.383	4.095	20	30		CIEDRO
C=C(C)COCC[NH2+][C@H](CC)c1cccc(Cl)c1F	ZINC000461105005	331311461	/nfs/dbraw/zinc/31/14/61/331311461.db2.gz	YTLFUQNNUQUUEZ-CQSZACIVSA-N	1	0	285.790	4.113	20	30		CIEDRO
C=C(C)COCC[NH2+][C@@H](CC)c1cccc(Cl)c1F	ZINC000461105004	331311550	/nfs/dbraw/zinc/31/15/50/331311550.db2.gz	YTLFUQNNUQUUEZ-AWEZNQCLSA-N	1	0	285.790	4.113	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+]C[C@H](c1ccc(C)o1)N1CCCC1	ZINC000461886437	331315174	/nfs/dbraw/zinc/31/51/74/331315174.db2.gz	UKHPGXAYWOHERA-DLBZAZTESA-N	1	0	290.451	4.059	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+]CCc1c[nH]c2cc(F)ccc12	ZINC000462040195	331316917	/nfs/dbraw/zinc/31/69/17/331316917.db2.gz	LRZGNSKCYYUUHY-HNNXBMFYSA-N	1	0	274.383	4.184	20	30		CIEDRO
CCC[C@@H](CCc1ccccc1)[NH2+][C@H](CC)CC#N	ZINC000462065607	331317165	/nfs/dbraw/zinc/31/71/65/331317165.db2.gz	NKXGVHPRPJJEBT-SJORKVTESA-N	1	0	258.409	4.070	20	30		CIEDRO
C=CCc1cc(C[NH2+][C@@H](C)C[C@@H](C)CC)cc(OC)c1O	ZINC000462738386	331326536	/nfs/dbraw/zinc/32/65/36/331326536.db2.gz	RVCDDWVBKPEFLO-KBPBESRZSA-N	1	0	291.435	4.044	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)CCc1ccsc1)c1ccc(C#N)cc1	ZINC000462795376	331329472	/nfs/dbraw/zinc/32/94/72/331329472.db2.gz	AWPFCJBQXJYPSB-UONOGXRCSA-N	1	0	284.428	4.292	20	30		CIEDRO
C=C[C@H](C)[NH2+][C@@H](C)CC(C)(C)c1c[nH]c2ccccc21	ZINC000462808349	331330124	/nfs/dbraw/zinc/33/01/24/331330124.db2.gz	DHZCGJIQDNSFEY-KBPBESRZSA-N	1	0	270.420	4.388	20	30		CIEDRO
C[C@H](Nc1cc2c(c[nH+]1)CCCC2)c1ccc(C#N)cc1F	ZINC000462953465	331335945	/nfs/dbraw/zinc/33/59/45/331335945.db2.gz	XMJXPTNSMLGEHH-LBPRGKRZSA-N	1	0	295.361	4.144	20	30		CIEDRO
C[C@@H](Nc1cc2c(c[nH+]1)CCCC2)c1cccc(C#N)c1	ZINC000462965852	331336073	/nfs/dbraw/zinc/33/60/73/331336073.db2.gz	PDIVWLCBVIDDIO-CYBMUJFWSA-N	1	0	277.371	4.005	20	30		CIEDRO
CCC[C@H](CCc1ccccc1)[NH2+][C@@H]1CCC[C@H](C#N)C1	ZINC000463236184	331343468	/nfs/dbraw/zinc/34/34/68/331343468.db2.gz	KFZZSXZVZUHTJS-IPMKNSEASA-N	1	0	284.447	4.460	20	30		CIEDRO
CCc1ccc(C(C)(C)C[NH2+][C@H]2CCC[C@H](C#N)C2)cc1	ZINC000463241148	331343756	/nfs/dbraw/zinc/34/37/56/331343756.db2.gz	CWVZAZXZXIPSJL-WMZOPIPTSA-N	1	0	284.447	4.199	20	30		CIEDRO
CCC[C@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)c1ccc(F)cc1F	ZINC000463244270	331343976	/nfs/dbraw/zinc/34/39/76/331343976.db2.gz	WOBPOCDSFBAXBX-IFIJOSMWSA-N	1	0	292.373	4.478	20	30		CIEDRO
CC(C)(C[NH2+][C@@H]1CCC[C@@H](C#N)C1)C1CCCCC1	ZINC000463247250	331344179	/nfs/dbraw/zinc/34/41/79/331344179.db2.gz	VLWNWYYMRXXXPZ-GDBMZVCRSA-N	1	0	262.441	4.265	20	30		CIEDRO
CC(C)CC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCC[C@H](C#N)C1	ZINC000463291442	331345369	/nfs/dbraw/zinc/34/53/69/331345369.db2.gz	ZXSIBOWTQUWYEU-NXOAAHMSSA-N	1	0	262.441	4.263	20	30		CIEDRO
CC1(C)CC[C@H]([NH2+][C@H]2CCC[C@H](C#N)C2)c2ccccc21	ZINC000463292985	331345578	/nfs/dbraw/zinc/34/55/78/331345578.db2.gz	BLWRCWMBSNIXLS-MPGHIAIKSA-N	1	0	282.431	4.471	20	30		CIEDRO
CC(C)CC(CC(C)C)[NH2+][C@@H]1CCC[C@@H](C#N)C1	ZINC000463294689	331345645	/nfs/dbraw/zinc/34/56/45/331345645.db2.gz	FQAVIOFIBDHHHF-HUUCEWRRSA-N	1	0	250.430	4.119	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(Cl)cc2Cl)C1	ZINC000463304690	331345954	/nfs/dbraw/zinc/34/59/54/331345954.db2.gz	SCEKDQARNYATMO-ZWNOBZJWSA-N	1	0	283.202	4.165	20	30		CIEDRO
CC1(C)[C@H]([NH2+]Cc2cccc(C#N)c2)C[C@H]1c1ccccc1	ZINC000463542620	331349287	/nfs/dbraw/zinc/34/92/87/331349287.db2.gz	MBAISQOPNJKHSM-RBUKOAKNSA-N	1	0	290.410	4.230	20	30		CIEDRO
CCC[C@]1(C)CCC[N@H+](Cc2cc(C#N)ccc2F)C1	ZINC000464839692	331370576	/nfs/dbraw/zinc/37/05/76/331370576.db2.gz	QTEQQYNSXVJIMH-QGZVFWFLSA-N	1	0	274.383	4.100	20	30		CIEDRO
Cc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2ccc(C#N)cc2)o1	ZINC000464841004	331370642	/nfs/dbraw/zinc/37/06/42/331370642.db2.gz	VTJLFJBQICCUJD-RDTXWAMCSA-N	1	0	294.398	4.433	20	30		CIEDRO
C=C(C[NH2+][C@H]1CCC[C@H]1CCCF)c1ccccc1	ZINC000510675157	332910941	/nfs/dbraw/zinc/91/09/41/332910941.db2.gz	MPDJYUGSBVGAIX-IRXDYDNUSA-N	1	0	261.384	4.208	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1ccc(OC(F)F)c(Cl)c1	ZINC000466382987	331394247	/nfs/dbraw/zinc/39/42/47/331394247.db2.gz	JENYZQKAIOUTEA-NSHDSACASA-N	1	0	289.753	4.386	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1csc(-c2ccsc2)n1	ZINC000466383996	331394297	/nfs/dbraw/zinc/39/42/97/331394297.db2.gz	QFRAIFXYRBXVDF-GFCCVEGCSA-N	1	0	278.446	4.316	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1ccc(C(F)(F)F)s1	ZINC000466398763	331394847	/nfs/dbraw/zinc/39/48/47/331394847.db2.gz	JUEVCCSKPXLYCQ-VIFPVBQESA-N	1	0	263.328	4.211	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1cccc(-c2ccncc2)c1	ZINC000466398891	331394896	/nfs/dbraw/zinc/39/48/96/331394896.db2.gz	KLFQVZJTECNIBQ-GOSISDBHSA-N	1	0	266.388	4.193	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1ccc(OCC(F)(F)F)cc1	ZINC000466405655	331395328	/nfs/dbraw/zinc/39/53/28/331395328.db2.gz	PUHKQWCNWANPEZ-CYBMUJFWSA-N	1	0	287.325	4.072	20	30		CIEDRO
N#Cc1ccc(C[NH2+]C2(Cc3ccccc3)CCCCC2)o1	ZINC000466453695	331397481	/nfs/dbraw/zinc/39/74/81/331397481.db2.gz	UNZSOIVHHYRJBA-UHFFFAOYSA-N	1	0	294.398	4.186	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@H](C)c1ccc(OC(F)F)c(OC)c1	ZINC000467414933	331418372	/nfs/dbraw/zinc/41/83/72/331418372.db2.gz	XERXNDMDNGXBSP-DGCLKSJQSA-N	1	0	299.361	4.302	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@@H](C)c1ccc(OC(F)F)c(OC)c1	ZINC000467414932	331418378	/nfs/dbraw/zinc/41/83/78/331418378.db2.gz	XERXNDMDNGXBSP-AAEUAGOBSA-N	1	0	299.361	4.302	20	30		CIEDRO
CCC[C@H](Cc1ccccc1)[NH2+]CCc1cccc(C#N)c1	ZINC000467432333	331418993	/nfs/dbraw/zinc/41/89/93/331418993.db2.gz	KDLNPULNFQZLIQ-HXUWFJFHSA-N	1	0	292.426	4.102	20	30		CIEDRO
CC[C@H](CC#N)[NH2+][C@H]1CCC[C@@H]1c1ccccc1Cl	ZINC000468474114	331435301	/nfs/dbraw/zinc/43/53/01/331435301.db2.gz	CNIZBNOINUBCQN-XPKDYRNWSA-N	1	0	276.811	4.258	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H](C)c1cccc(-n2ccnc2)c1	ZINC000469778339	331457924	/nfs/dbraw/zinc/45/79/24/331457924.db2.gz	ZQFNSVGQJLUDPW-HZPDHXFCSA-N	1	0	283.419	4.268	20	30		CIEDRO
C=CCOCCC[NH2+][C@H](C)c1ccc(C(C)C)cc1	ZINC000470764270	331489858	/nfs/dbraw/zinc/48/98/58/331489858.db2.gz	GIIODKIHYNKPEY-OAHLLOKOSA-N	1	0	261.409	4.053	20	30		CIEDRO
CCC[C@H](CCc1ccccc1)[NH2+][C@@H]1CC[C@@H](C#N)C1	ZINC000471609894	331513056	/nfs/dbraw/zinc/51/30/56/331513056.db2.gz	DLHDLFTVHBYBFP-KZNAEPCWSA-N	1	0	270.420	4.070	20	30		CIEDRO
CC(C)[C@@H]([NH2+][C@H](C)CCC#N)c1ccc(Cl)cc1F	ZINC000472466785	331537582	/nfs/dbraw/zinc/53/75/82/331537582.db2.gz	ZMYYWCRTXSJJJF-IAQYHMDHSA-N	1	0	282.790	4.458	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)[C@@H](C)c1ccc(Cl)cc1	ZINC000474729753	331596514	/nfs/dbraw/zinc/59/65/14/331596514.db2.gz	QAKJUHYZLCLRIZ-YNEHKIRRSA-N	1	0	251.801	4.386	20	30		CIEDRO
C=C(C)COCC[NH2+][C@H](C)[C@@H](C)c1ccc(Cl)cc1	ZINC000474802143	331599290	/nfs/dbraw/zinc/59/92/90/331599290.db2.gz	VDILTBFWZIKOMD-ZIAGYGMSSA-N	1	0	281.827	4.014	20	30		CIEDRO
C=C(C)COCC[NH2+][C@H](C)[C@H](C)c1ccc(Cl)cc1	ZINC000474802142	331599308	/nfs/dbraw/zinc/59/93/08/331599308.db2.gz	VDILTBFWZIKOMD-UONOGXRCSA-N	1	0	281.827	4.014	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@H]1CC[C@@H](c2ccc(F)cc2)C1	ZINC000475336969	331627215	/nfs/dbraw/zinc/62/72/15/331627215.db2.gz	PCQDANNEIYLKNG-LXZKKBNFSA-N	1	0	261.384	4.406	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@@H](c1ccc(C)cc1)c1ccccn1	ZINC000475338883	331627648	/nfs/dbraw/zinc/62/76/48/331627648.db2.gz	SXHVCPBXRNVZFF-LPHOPBHVSA-N	1	0	280.415	4.424	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@H]2C[C@H](c3ccc(Cl)cc3)C2)c1	ZINC000475672340	331641309	/nfs/dbraw/zinc/64/13/09/331641309.db2.gz	SDYIYOFOVOPJSR-SAABIXHNSA-N	1	0	296.801	4.247	20	30		CIEDRO
C[C@H](c1ccc2ccccc2c1)[NH+]1CCC(F)(C#N)CC1	ZINC000510947525	332921628	/nfs/dbraw/zinc/92/16/28/332921628.db2.gz	FDAFVJVHKBHDJR-CQSZACIVSA-N	1	0	282.362	4.228	20	30		CIEDRO
CC(C)(C[NH2+]Cc1cccc(C#N)c1)C1=CCCCC1	ZINC000479396950	331726904	/nfs/dbraw/zinc/72/69/04/331726904.db2.gz	WFPMPZOZNPQIMB-UHFFFAOYSA-N	1	0	268.404	4.174	20	30		CIEDRO
C[C@H](CCCC(F)(F)F)[NH2+][C@H](C)c1cccc(C#N)c1	ZINC000480142925	331759424	/nfs/dbraw/zinc/75/94/24/331759424.db2.gz	BMCVILZNUFLVCI-VXGBXAGGSA-N	1	0	284.325	4.330	20	30		CIEDRO
C=C(C[NH2+][C@H](C)CCCC(F)(F)F)c1ccccc1	ZINC000480202912	331762994	/nfs/dbraw/zinc/76/29/94/331762994.db2.gz	XYMXLMQIXAZDQM-CYBMUJFWSA-N	1	0	271.326	4.411	20	30		CIEDRO
CC(C)=CCC[C@H](C)CC[NH+]1CCC(C)(C#N)CC1	ZINC000482253887	331829331	/nfs/dbraw/zinc/82/93/31/331829331.db2.gz	SFCABJXHXIHSBE-INIZCTEOSA-N	1	0	262.441	4.385	20	30		CIEDRO
CC(C)=CCC[C@@H](C)CC[NH+]1CCC(C)(C#N)CC1	ZINC000482253888	331829347	/nfs/dbraw/zinc/82/93/47/331829347.db2.gz	SFCABJXHXIHSBE-MRXNPFEDSA-N	1	0	262.441	4.385	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+][C@@H](C)c1ccc2ncsc2c1	ZINC000485706889	331920058	/nfs/dbraw/zinc/92/00/58/331920058.db2.gz	BRZOMMJSVLLBRP-NEPJUHHUSA-N	1	0	260.406	4.302	20	30		CIEDRO
C=CCC[C@H](C)[NH2+]C[C@H](c1ccccc1)C(F)(F)F	ZINC000485721888	331922208	/nfs/dbraw/zinc/92/22/08/331922208.db2.gz	WBCVYWLDZPRLNL-GXTWGEPZSA-N	1	0	271.326	4.277	20	30		CIEDRO
C=CCCCCC[NH+]1CCC(OCCC(C)C)CC1	ZINC000486683290	331941733	/nfs/dbraw/zinc/94/17/33/331941733.db2.gz	PBVZFPZKDDNFCX-UHFFFAOYSA-N	1	0	267.457	4.260	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@@H]1CCSC1)c1ccccc1	ZINC000487554902	331974232	/nfs/dbraw/zinc/97/42/32/331974232.db2.gz	UDECDVSSAJVADO-GOEBONIOSA-N	1	0	261.434	4.037	20	30		CIEDRO
C=CCCCCC[NH2+][C@@H](C[C@H]1CCOC1)c1ccccc1	ZINC000488134024	331991626	/nfs/dbraw/zinc/99/16/26/331991626.db2.gz	ZOJRROPXSXAYHO-MJGOQNOKSA-N	1	0	287.447	4.490	20	30		CIEDRO
Cc1cccnc1[C@H]([NH2+]Cc1ccc(C#N)c(C)c1)C(C)C	ZINC000488238541	331995647	/nfs/dbraw/zinc/99/56/47/331995647.db2.gz	XEORYRNZZGANRG-GOSISDBHSA-N	1	0	293.414	4.057	20	30		CIEDRO
C[C@H](c1ccc2c(c1)CCC2)[N@H+](C)Cc1cccc(C#N)c1	ZINC000488441298	332008973	/nfs/dbraw/zinc/00/89/73/332008973.db2.gz	CRDNMOLJYHDDKC-OAHLLOKOSA-N	1	0	290.410	4.240	20	30		CIEDRO
C[N@H+](Cc1ccc(C#N)cc1)[C@H]1CCc2c1cccc2Cl	ZINC000488448010	332009965	/nfs/dbraw/zinc/00/99/65/332009965.db2.gz	YKMGKRAKGQOIJJ-SFHVURJKSA-N	1	0	296.801	4.331	20	30		CIEDRO
CC[N@H+](Cc1cccc(F)c1)[C@H](C)c1ccc(C#N)cc1	ZINC000488586752	332019207	/nfs/dbraw/zinc/01/92/07/332019207.db2.gz	MCUFPLSDLGMXOX-CQSZACIVSA-N	1	0	282.362	4.280	20	30		CIEDRO
CC[C@H](c1ccc(Cl)cc1)[N@H+](CC)C[C@@H](C)C#N	ZINC000488614570	332020210	/nfs/dbraw/zinc/02/02/10/332020210.db2.gz	BCSPGZODMDNBCB-SWLSCSKDSA-N	1	0	264.800	4.273	20	30		CIEDRO
C[C@H](c1cccc(C#N)c1)[N@@H+]1CC[C@H](Cc2ccccc2)C1	ZINC000489265460	332044426	/nfs/dbraw/zinc/04/44/26/332044426.db2.gz	CUQGUMYZFQXPNS-VQIMIIECSA-N	1	0	290.410	4.184	20	30		CIEDRO
C=C[C@@H]1CCCCN1Cc1csc(Br)c1	ZINC000489465823	332054167	/nfs/dbraw/zinc/05/41/67/332054167.db2.gz	VNUOPDULKJABEA-LLVKDONJSA-N	1	0	286.238	4.051	20	30		CIEDRO
N#Cc1cc(F)ccc1CN1CCC[C@H]1c1ccccc1	ZINC000489626585	332062024	/nfs/dbraw/zinc/06/20/24/332062024.db2.gz	XAFXYKDPCIDWTK-SFHVURJKSA-N	1	0	280.346	4.034	20	30		CIEDRO
Cc1cc(C[NH2+]Cc2ccc(C3CC3)cc2F)ccc1C#N	ZINC000491586521	332241477	/nfs/dbraw/zinc/24/14/77/332241477.db2.gz	OGNQBPHUXLQZAY-UHFFFAOYSA-N	1	0	294.373	4.173	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000494038507	332461777	/nfs/dbraw/zinc/46/17/77/332461777.db2.gz	LNUGULLUEXCNHB-KBXCAEBGSA-N	1	0	296.370	4.238	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+]C[C@H]1CCCCC(F)(F)C1	ZINC000494993003	332498544	/nfs/dbraw/zinc/49/85/44/332498544.db2.gz	AVBMUMSQDVXUBK-MJBXVCDLSA-N	1	0	259.384	4.392	20	30		CIEDRO
C[C@H]([NH2+]C[C@@H]1CCCCC(F)(F)C1)c1cccc(C#N)c1	ZINC000495017927	332500010	/nfs/dbraw/zinc/50/00/10/332500010.db2.gz	LWMDYMJAAJAIBT-DZGCQCFKSA-N	1	0	292.373	4.424	20	30		CIEDRO
CCCC[C@@H]1CCC[C@@H]1[NH2+]CCCC1(C#N)CCOCC1	ZINC000499623887	332589259	/nfs/dbraw/zinc/58/92/59/332589259.db2.gz	GBESJIGFKVPTOE-SJORKVTESA-N	1	0	292.467	4.035	20	30		CIEDRO
CCCCc1ccc([C@@H]([NH2+]CCC#N)C(C)C)cc1	ZINC000501730787	332639599	/nfs/dbraw/zinc/63/95/99/332639599.db2.gz	QWHLLZDXJGKWPH-KRWDZBQOSA-N	1	0	258.409	4.230	20	30		CIEDRO
C[C@@H]1CCC[C@H]1[NH2+]C1CCC(C#N)(c2ccccc2)CC1	ZINC000502347827	332654402	/nfs/dbraw/zinc/65/44/02/332654402.db2.gz	WYYOFFZQPJIKAO-ZTRSQXPZSA-N	1	0	282.431	4.169	20	30		CIEDRO
CC[C@@H]1CCC[C@H]1[NH2+]Cc1cccc(OCCCC#N)c1	ZINC000154131539	334688981	/nfs/dbraw/zinc/68/89/81/334688981.db2.gz	LJFIXQSGAHPYDC-SJLPKXTDSA-N	1	0	286.419	4.037	20	30		CIEDRO
C=CC[C@H](C)[NH2+]Cc1ccc(Oc2ccccc2)o1	ZINC000503590979	332693782	/nfs/dbraw/zinc/69/37/82/332693782.db2.gz	DJWBHCNKAGLFDZ-ZDUSSCGKSA-N	1	0	257.333	4.126	20	30		CIEDRO
C[C@@H]([NH2+]C/C=C\c1ccccc1)c1ccc(C#N)cc1F	ZINC000512282462	332960919	/nfs/dbraw/zinc/96/09/19/332960919.db2.gz	VIAVGIDDMSEALM-BMWLXYDHSA-N	1	0	280.346	4.061	20	30		CIEDRO
C=C(C)C[NH2+]Cc1cc(Cl)cc(C(F)(F)F)c1	ZINC000512375459	332965376	/nfs/dbraw/zinc/96/53/76/332965376.db2.gz	SCNMIZLOIIYTJU-UHFFFAOYSA-N	1	0	263.690	4.025	20	30		CIEDRO
CC[C@H]([NH2+][C@H](C)c1ccc(C#N)cc1F)C(C)(C)C	ZINC000512622852	332976310	/nfs/dbraw/zinc/97/63/10/332976310.db2.gz	CHJQWGGKBXYVOW-ABAIWWIYSA-N	1	0	262.372	4.173	20	30		CIEDRO
CCc1ccc(C[NH2+][C@@H](C)c2ccc(C#N)cc2F)s1	ZINC000512636170	332977001	/nfs/dbraw/zinc/97/70/01/332977001.db2.gz	KACICXBBXPZHLQ-NSHDSACASA-N	1	0	288.391	4.172	20	30		CIEDRO
C[C@@H]1C[C@@H](c2ccccc2)[N@H+](Cc2cccc(C#N)c2F)C1	ZINC000513272933	333011947	/nfs/dbraw/zinc/01/19/47/333011947.db2.gz	UJZRIPBHXNOIFB-KDOFPFPSSA-N	1	0	294.373	4.280	20	30		CIEDRO
C[C@@H]1C[C@H](c2ccccc2)[N@H+](Cc2cc(C#N)ccc2F)C1	ZINC000513275870	333012073	/nfs/dbraw/zinc/01/20/73/333012073.db2.gz	LGMRXBYJBFFDKW-AUUYWEPGSA-N	1	0	294.373	4.280	20	30		CIEDRO
CC[C@@H](C)[C@@H](C)[N@H+](Cc1cc(C#N)cs1)C1CC1	ZINC000513461705	333021002	/nfs/dbraw/zinc/02/10/02/333021002.db2.gz	OHOFJMBJVZJYBE-VXGBXAGGSA-N	1	0	262.422	4.019	20	30		CIEDRO
C[C@H]1CC[C@@H]([NH2+]Cc2ccc(C#N)c(F)c2)c2ccccc21	ZINC000404860665	333030816	/nfs/dbraw/zinc/03/08/16/333030816.db2.gz	WEVYCPHRAABFEC-ORAYPTAESA-N	1	0	294.373	4.426	20	30		CIEDRO
CC(C)(C)C[N@H+](CCC#N)C[C@H]1C[C@@H]1c1ccccc1	ZINC000513717698	333035139	/nfs/dbraw/zinc/03/51/39/333035139.db2.gz	QTNWXPXLRFVCTG-IAGOWNOFSA-N	1	0	270.420	4.052	20	30		CIEDRO
CCC(CC)C[N@H+](CCC#N)Cc1cccc2cc[nH]c21	ZINC000513729103	333036005	/nfs/dbraw/zinc/03/60/05/333036005.db2.gz	MUBHDLYEVXBCBD-UHFFFAOYSA-N	1	0	283.419	4.320	20	30		CIEDRO
CC(C)CC[N@H+](CCC#N)C[C@@H]1C[C@@H]1c1ccccc1	ZINC000513732313	333036193	/nfs/dbraw/zinc/03/61/93/333036193.db2.gz	DGGJFULIOBEEDW-ZWKOTPCHSA-N	1	0	270.420	4.052	20	30		CIEDRO
Cc1cc(Cl)cc(C)c1CN(CCC#N)CC1CC1	ZINC000513742204	333036965	/nfs/dbraw/zinc/03/69/65/333036965.db2.gz	UTLSQDGLTIOHNV-UHFFFAOYSA-N	1	0	276.811	4.083	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@@H](c1ccccc1)N(C)C)c1ccco1	ZINC000513763291	333037936	/nfs/dbraw/zinc/03/79/36/333037936.db2.gz	WUSSDJGYTKHQIX-MSOLQXFVSA-N	1	0	298.430	4.179	20	30		CIEDRO
CC(C)(C#N)CCCC[N@H+](Cc1ccccc1)C1CC1	ZINC000309693111	333047470	/nfs/dbraw/zinc/04/74/70/333047470.db2.gz	MCHXOLNFUHMDNA-UHFFFAOYSA-N	1	0	270.420	4.371	20	30		CIEDRO
CC[C@@H]1CC[C@H](C)[N@H+](CCCCC(C)(C)C#N)C1	ZINC000311029839	333063569	/nfs/dbraw/zinc/06/35/69/333063569.db2.gz	XBVCNFURGBUYLT-LSDHHAIUSA-N	1	0	250.430	4.217	20	30		CIEDRO
C[C@@H](CCC(C)(C)C)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000311446014	333068645	/nfs/dbraw/zinc/06/86/45/333068645.db2.gz	KECWJQOSURYDFH-KBPBESRZSA-N	1	0	258.409	4.424	20	30		CIEDRO
C[C@H](CCC(C)(C)C)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000311446015	333068714	/nfs/dbraw/zinc/06/87/14/333068714.db2.gz	KECWJQOSURYDFH-KGLIPLIRSA-N	1	0	258.409	4.424	20	30		CIEDRO
C=CCCCC[NH2+][C@H](C)c1ccccc1OC(F)F	ZINC000311631035	333070400	/nfs/dbraw/zinc/07/04/00/333070400.db2.gz	OSCAWUHFAJGKTL-GFCCVEGCSA-N	1	0	269.335	4.295	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H](C)c1ccc(F)c(OC)c1	ZINC000311877424	333073783	/nfs/dbraw/zinc/07/37/83/333073783.db2.gz	MOXSPFITLDOVTP-LBPRGKRZSA-N	1	0	265.372	4.087	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H](C)c1ccc(OC)cc1F	ZINC000311920332	333074402	/nfs/dbraw/zinc/07/44/02/333074402.db2.gz	SICGNUODNVRKSX-GFCCVEGCSA-N	1	0	265.372	4.087	20	30		CIEDRO
CCCCc1ccc([C@@H](C)[NH2+]CCCCC#N)cc1	ZINC000178641335	333076261	/nfs/dbraw/zinc/07/62/61/333076261.db2.gz	QOVBZGRVVDOKOK-OAHLLOKOSA-N	1	0	258.409	4.374	20	30		CIEDRO
C=CCCC[NH2+]Cc1cnc(-c2ccc(C)cc2)s1	ZINC000516906988	333086014	/nfs/dbraw/zinc/08/60/14/333086014.db2.gz	TXEMEKMWWBQWTO-UHFFFAOYSA-N	1	0	272.417	4.174	20	30		CIEDRO
C=CCCCC[N@@H+]1CC2(CCOCC2)[C@H]1c1ccccc1	ZINC000516913211	333086233	/nfs/dbraw/zinc/08/62/33/333086233.db2.gz	DCMXTSKDSVGYPN-GOSISDBHSA-N	1	0	285.431	4.196	20	30		CIEDRO
N#CCCC1CC[NH+](C/C=C/c2ccc(Cl)cc2)CC1	ZINC000517027520	333090147	/nfs/dbraw/zinc/09/01/47/333090147.db2.gz	KZQMYICRRZOPLQ-DUXPYHPUSA-N	1	0	288.822	4.369	20	30		CIEDRO
N#Cc1ccc(C[NH2+]Cc2ccc(C3CCCCC3)cc2)o1	ZINC000517251806	333095835	/nfs/dbraw/zinc/09/58/35/333095835.db2.gz	OZMZIQROVPIOKI-UHFFFAOYSA-N	1	0	294.398	4.489	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]Cc1cc(Cl)ccc1Cl	ZINC000517259544	333096120	/nfs/dbraw/zinc/09/61/20/333096120.db2.gz	DBFHMIUEIPQDII-UHFFFAOYSA-N	1	0	285.218	4.413	20	30		CIEDRO
CC(C)CC[C@@H]1CCC[C@H]1[NH2+]Cc1cccc(C#N)c1	ZINC000517551764	333102213	/nfs/dbraw/zinc/10/22/13/333102213.db2.gz	VIRWSEQFQQQIAH-ZWKOTPCHSA-N	1	0	270.420	4.253	20	30		CIEDRO
Cc1c2ccccc2oc1[C@H](C)[NH2+]CCCSCC#N	ZINC000183536627	333120974	/nfs/dbraw/zinc/12/09/74/333120974.db2.gz	SGFPPLFLLVAPEA-ZDUSSCGKSA-N	1	0	288.416	4.039	20	30		CIEDRO
CC(C)[C@@H]1CCc2ccccc2[C@H]1[NH2+]Cc1ccc(C#N)o1	ZINC000185082227	333135282	/nfs/dbraw/zinc/13/52/82/333135282.db2.gz	MUGWWUCZJBCMHJ-HKUYNNGSSA-N	1	0	294.398	4.201	20	30		CIEDRO
C[C@H]1CCCc2ccccc2[C@@H]1[NH2+]Cc1ccc(C#N)s1	ZINC000185086279	333135372	/nfs/dbraw/zinc/13/53/72/333135372.db2.gz	ZLHPWFZJQWVDML-SCLBCKFNSA-N	1	0	296.439	4.423	20	30		CIEDRO
COc1ccc([C@H]([NH2+][C@@H]2CCC[C@H](C#N)C2)C(C)C)cc1	ZINC000185761450	333148277	/nfs/dbraw/zinc/14/82/77/333148277.db2.gz	JRQJSRSSZGACGE-YXJHDRRASA-N	1	0	286.419	4.064	20	30		CIEDRO
CCCCOc1cccc(C[NH2+][C@@H]2CCC[C@H](C#N)C2)c1	ZINC000185783153	333148675	/nfs/dbraw/zinc/14/86/75/333148675.db2.gz	ONFAGGDCNBKBFW-DOTOQJQBSA-N	1	0	286.419	4.037	20	30		CIEDRO
CC[C@H]1Cc2ccccc2C[N@@H+]1CCCC(C)(C)C#N	ZINC000185786361	333148786	/nfs/dbraw/zinc/14/87/86/333148786.db2.gz	XVUKWUDOADGXPM-KRWDZBQOSA-N	1	0	270.420	4.153	20	30		CIEDRO
CC(C)C[C@@H]([NH2+]Cc1ccccc1C#N)c1ccccc1	ZINC000219434729	333149360	/nfs/dbraw/zinc/14/93/60/333149360.db2.gz	FDBSBJKTSVUKKM-LJQANCHMSA-N	1	0	278.399	4.435	20	30		CIEDRO
CC(C)C[C@H]([NH2+]Cc1ccccc1C#N)c1ccccc1	ZINC000219434806	333149488	/nfs/dbraw/zinc/14/94/88/333149488.db2.gz	FDBSBJKTSVUKKM-IBGZPJMESA-N	1	0	278.399	4.435	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+]CC2(c3cccc(Cl)c3)CC2)C1	ZINC000185837904	333150144	/nfs/dbraw/zinc/15/01/44/333150144.db2.gz	PDZVDNMKKXFABY-CZUORRHYSA-N	1	0	288.822	4.044	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@@H](C)c1sccc1OC	ZINC000186239776	333157194	/nfs/dbraw/zinc/15/71/94/333157194.db2.gz	IBRFFLUXRSEPOF-NEPJUHHUSA-N	1	0	253.411	4.152	20	30		CIEDRO
C=C(C)COCC[NH2+][C@H](C)c1cc(Cl)sc1Cl	ZINC000222308566	333180872	/nfs/dbraw/zinc/18/08/72/333180872.db2.gz	NECAZLVQBXPEOE-SECBINFHSA-N	1	0	294.247	4.298	20	30		CIEDRO
CCc1ccc([C@H](C)[NH2+]Cc2ccc(C#N)c(F)c2)cc1	ZINC000190401623	333206310	/nfs/dbraw/zinc/20/63/10/333206310.db2.gz	UTSJXDOYGSNIFV-ZDUSSCGKSA-N	1	0	282.362	4.111	20	30		CIEDRO
CC(C)(CCc1ccccc1)[NH2+]Cc1ccccc1C#N	ZINC000223875033	333212904	/nfs/dbraw/zinc/21/29/04/333212904.db2.gz	WJIRZQITOVRQDZ-UHFFFAOYSA-N	1	0	278.399	4.059	20	30		CIEDRO
CC(C)(C#N)CCC[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1	ZINC000191365991	333218859	/nfs/dbraw/zinc/21/88/59/333218859.db2.gz	AMLPORNBOOYUNG-QZTJIDSGSA-N	1	0	284.447	4.317	20	30		CIEDRO
CC(C)(CCC#N)C[N@@H+]1CC[C@H](C(F)(F)F)C(C)(C)C1	ZINC000191663676	333223325	/nfs/dbraw/zinc/22/33/25/333223325.db2.gz	MWJMQORYHNUFSJ-LBPRGKRZSA-N	1	0	290.373	4.227	20	30		CIEDRO
C[C@@H]([NH2+]CC1(C)CCCCC1)c1cccc(C#N)c1	ZINC000224745814	333225191	/nfs/dbraw/zinc/22/51/91/333225191.db2.gz	VGGQOVKGTCYXEV-CQSZACIVSA-N	1	0	256.393	4.179	20	30		CIEDRO
CCCC[C@H]1CCC[C@H]1[NH2+]CCCC(C)(C)C#N	ZINC000191831730	333226155	/nfs/dbraw/zinc/22/61/55/333226155.db2.gz	QREHGYMVBPZRDY-LSDHHAIUSA-N	1	0	250.430	4.265	20	30		CIEDRO
C[C@H](c1ccccc1F)N(C)Cc1ccc(C#N)c(F)c1	ZINC000191949322	333227511	/nfs/dbraw/zinc/22/75/11/333227511.db2.gz	HQSJXFRXQWNQMT-GFCCVEGCSA-N	1	0	286.325	4.029	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)c(F)c1)c1ccccc1Cl	ZINC000192079993	333229273	/nfs/dbraw/zinc/22/92/73/333229273.db2.gz	NBZZCSKLHGAWPS-NSHDSACASA-N	1	0	288.753	4.202	20	30		CIEDRO
N#Cc1ccccc1C[N@@H+]1CCCC2(CCCCC2)C1	ZINC000522074217	333238618	/nfs/dbraw/zinc/23/86/18/333238618.db2.gz	YKTBSZVVEXCUOP-UHFFFAOYSA-N	1	0	268.404	4.105	20	30		CIEDRO
C=CCCCCC[N@@H+]1CCC[C@@H](c2nccs2)C1	ZINC000193324828	333247909	/nfs/dbraw/zinc/24/79/09/333247909.db2.gz	MMVBPAGQNKQMNK-CQSZACIVSA-N	1	0	264.438	4.069	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](C)C[C@@H]1C)c1ccc(C#N)cc1	ZINC000226160543	333252178	/nfs/dbraw/zinc/25/21/78/333252178.db2.gz	MDFUZKDPSUNCOT-FHIRATQRSA-N	1	0	256.393	4.034	20	30		CIEDRO
C=CCCCCC[NH2+][C@@H](CC)c1c(C)noc1C	ZINC000193550542	333252901	/nfs/dbraw/zinc/25/29/01/333252901.db2.gz	CZFVSFVSJXLICF-AWEZNQCLSA-N	1	0	250.386	4.079	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CC[C@H]3CCCC[C@H]3C2)cc1	ZINC000250008423	333301117	/nfs/dbraw/zinc/30/11/17/333301117.db2.gz	UQJQOMBWAJTLKK-FGTMMUONSA-N	1	0	268.404	4.007	20	30		CIEDRO
N#Cc1ccc(C[N@@H+]2CCCCC[C@H]2c2ccco2)cc1	ZINC000523006438	333304384	/nfs/dbraw/zinc/30/43/84/333304384.db2.gz	CNIIAYJQSFUZMJ-KRWDZBQOSA-N	1	0	280.371	4.269	20	30		CIEDRO
CC(C)Oc1ccc([C@H](C)[NH2+]CC(C)(C)CCC#N)cc1	ZINC000229674827	333307641	/nfs/dbraw/zinc/30/76/41/333307641.db2.gz	CDCZHMJWKSYGGF-HNNXBMFYSA-N	1	0	288.435	4.454	20	30		CIEDRO
C=CCCOCC[NH2+]Cc1cc(-c2ccccc2)cs1	ZINC000229879414	333310549	/nfs/dbraw/zinc/31/05/49/333310549.db2.gz	OGEYSGXNBRFCEQ-UHFFFAOYSA-N	1	0	287.428	4.097	20	30		CIEDRO
CCC1(C[NH2+][C@@H](C)c2ccc(C#N)cc2)CCCC1	ZINC000230186305	333315739	/nfs/dbraw/zinc/31/57/39/333315739.db2.gz	NRJZQLHRSNSEGI-AWEZNQCLSA-N	1	0	256.393	4.179	20	30		CIEDRO
CC(C)CC[N@H+](CCCCC(C)(C)C#N)C1CC1	ZINC000232553680	333338696	/nfs/dbraw/zinc/33/86/96/333338696.db2.gz	GUDUZEJUGFREIQ-UHFFFAOYSA-N	1	0	250.430	4.217	20	30		CIEDRO
C=CC[C@H](C)[NH2+]Cc1ccc(OC)c(OCCC(C)C)c1	ZINC000523975702	333350590	/nfs/dbraw/zinc/35/05/90/333350590.db2.gz	MKONIZMJHOGCGF-HNNXBMFYSA-N	1	0	291.435	4.174	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]CCCC2CC2)cc1Cl	ZINC000524066361	333352776	/nfs/dbraw/zinc/35/27/76/333352776.db2.gz	MBRDMQYUKJHKBK-UHFFFAOYSA-N	1	0	279.811	4.185	20	30		CIEDRO
C=CCCC[N@@H+](C)CCc1ccc2ccccc2c1	ZINC000524248045	333357729	/nfs/dbraw/zinc/35/77/29/333357729.db2.gz	LLCKNGAUZZPUGD-UHFFFAOYSA-N	1	0	253.389	4.280	20	30		CIEDRO
C[N@H+](CCCCC(C)(C)C#N)Cc1ccccc1Cl	ZINC000234272683	333359244	/nfs/dbraw/zinc/35/92/44/333359244.db2.gz	GUNDYQJOKJFVOI-UHFFFAOYSA-N	1	0	278.827	4.492	20	30		CIEDRO
C[C@@H]1CCC[C@@H]([NH2+]CCCCC(C)(C)C#N)[C@@H]1C	ZINC000235287511	333367319	/nfs/dbraw/zinc/36/73/19/333367319.db2.gz	XDCDOKQNIFALFU-RBSFLKMASA-N	1	0	250.430	4.121	20	30		CIEDRO
CC1(C)CC[C@H]([NH2+]Cc2cccc(C#N)c2)c2ccccc21	ZINC000236749560	333375091	/nfs/dbraw/zinc/37/50/91/333375091.db2.gz	KEPGDLUYTKICBI-IBGZPJMESA-N	1	0	290.410	4.461	20	30		CIEDRO
C[C@@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2cccc(C#N)c2)C1	ZINC000524755139	333386646	/nfs/dbraw/zinc/38/66/46/333386646.db2.gz	QEGPYDJTHCAHGU-AUUYWEPGSA-N	1	0	294.373	4.280	20	30		CIEDRO
Cc1ccc(C)c(C[N@H+](CCC#N)CC(C)(C)C)c1	ZINC000524811607	333389180	/nfs/dbraw/zinc/38/91/80/333389180.db2.gz	PTQLRPLKLCXXQN-UHFFFAOYSA-N	1	0	258.409	4.065	20	30		CIEDRO
CCc1ccc(-c2ccc(C[NH2+]CCCCC#N)o2)cc1	ZINC000525290028	333407669	/nfs/dbraw/zinc/40/76/69/333407669.db2.gz	GYABTBSSRWPUOH-UHFFFAOYSA-N	1	0	282.387	4.292	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@@H](C)c1cccc(OC(F)F)c1	ZINC000393822918	333414964	/nfs/dbraw/zinc/41/49/64/333414964.db2.gz	MTIXAVWXZKSAQE-WCQYABFASA-N	1	0	269.335	4.293	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1F)c1cccc(C#N)c1	ZINC000037277334	333529888	/nfs/dbraw/zinc/52/98/88/333529888.db2.gz	PUSMVJYJSLBEAT-NEPJUHHUSA-N	1	0	286.325	4.248	20	30		CIEDRO
CC(C)(C)[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(C#N)cc1	ZINC000037507772	333534275	/nfs/dbraw/zinc/53/42/75/333534275.db2.gz	JJGAGEYHSLHUMF-IRXDYDNUSA-N	1	0	270.420	4.253	20	30		CIEDRO
N#Cc1ccc(C[NH2+]Cc2ccc3ccccc3c2)cc1	ZINC000037505852	333534394	/nfs/dbraw/zinc/53/43/94/333534394.db2.gz	FOVIKAGTXLJYOI-UHFFFAOYSA-N	1	0	272.351	4.001	20	30		CIEDRO
C[C@@H]([NH2+]CCC(C)(C)C1CC1)c1ccc(C#N)cc1	ZINC000328570325	333535169	/nfs/dbraw/zinc/53/51/69/333535169.db2.gz	RMQDSGDSAZWLPM-CYBMUJFWSA-N	1	0	256.393	4.035	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)c1ccccc1OC(F)(F)F	ZINC000537968494	333552049	/nfs/dbraw/zinc/55/20/49/333552049.db2.gz	JJXPENNUXNNLPY-WDEREUQCSA-N	1	0	273.298	4.200	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](C)c1ccccc1Br	ZINC000124111383	333556004	/nfs/dbraw/zinc/55/60/04/333556004.db2.gz	MQUHRVJBLJUDJJ-GHMZBOCLSA-N	1	0	268.198	4.064	20	30		CIEDRO
C=C(CC)C[NH2+][C@@H](C)c1ccc(OCC2CC2)c(F)c1	ZINC000538224377	333579976	/nfs/dbraw/zinc/57/99/76/333579976.db2.gz	YLSJJYDOTRSYFW-ZDUSSCGKSA-N	1	0	277.383	4.231	20	30		CIEDRO
C=C(C)C[NH2+][C@@H](COCc1ccccc1)c1ccccc1	ZINC000538243171	333581045	/nfs/dbraw/zinc/58/10/45/333581045.db2.gz	PGRANZSMNGIHQH-IBGZPJMESA-N	1	0	281.399	4.110	20	30		CIEDRO
COc1ccc([C@@H](C)C[NH2+][C@@H](C)c2ccc(C#N)cc2)cc1	ZINC000538396171	333588448	/nfs/dbraw/zinc/58/84/48/333588448.db2.gz	KFLZOOXYSVWJRK-GJZGRUSLSA-N	1	0	294.398	4.021	20	30		CIEDRO
CCC(CC)[C@H](CC[NH2+][C@H](C)c1ccc(C#N)cc1)OC	ZINC000538407988	333589307	/nfs/dbraw/zinc/58/93/07/333589307.db2.gz	PTVCYXZELXDSTE-KDOFPFPSSA-N	1	0	288.435	4.050	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](C)c1nc2c(s1)CCCC2	ZINC000538408970	333589473	/nfs/dbraw/zinc/58/94/73/333589473.db2.gz	AKHNBYPKVVKYOU-QWHCGFSZSA-N	1	0	278.465	4.417	20	30		CIEDRO
C=C(C[NH2+][C@H](C)Cc1ccc(F)cc1)c1ccccc1	ZINC000126658315	333601894	/nfs/dbraw/zinc/60/18/94/333601894.db2.gz	KNZQWCMEROSKDT-OAHLLOKOSA-N	1	0	269.363	4.060	20	30		CIEDRO
CCC(C)(C)C[NH2+]Cc1ccc(C#N)cc1C(F)(F)F	ZINC000576077677	335150158	/nfs/dbraw/zinc/15/01/58/335150158.db2.gz	ZBVPNWUNODWWEB-UHFFFAOYSA-N	1	0	284.325	4.103	20	30		CIEDRO
C[C@H]([NH2+]CC(C)(C)c1cccs1)c1cccc(C#N)c1	ZINC000127051943	333617159	/nfs/dbraw/zinc/61/71/59/333617159.db2.gz	LAAKKBUXFAUKKS-ZDUSSCGKSA-N	1	0	284.428	4.248	20	30		CIEDRO
C=CC[C@@H](C)[NH2+]Cc1cc(Cl)ccc1Br	ZINC000127407486	333628190	/nfs/dbraw/zinc/62/81/90/333628190.db2.gz	LACGMGSAUNGCFP-SECBINFHSA-N	1	0	288.616	4.157	20	30		CIEDRO
COc1ccc(C#N)cc1C[NH2+][C@@H](c1ccccc1)C(C)C	ZINC000127429751	333628992	/nfs/dbraw/zinc/62/89/92/333628992.db2.gz	ZLCQAVMYEFAMDP-LJQANCHMSA-N	1	0	294.398	4.054	20	30		CIEDRO
C[C@@H]([NH2+]C[C@H](C)Sc1ccccc1)c1ccc(C#N)cc1	ZINC000174272602	335151642	/nfs/dbraw/zinc/15/16/42/335151642.db2.gz	RDOBUBQLEASSFG-LSDHHAIUSA-N	1	0	296.439	4.390	20	30		CIEDRO
C=CC[C@@H](C)[C@@H](C)[NH2+][C@H](C)c1ccc(F)cc1F	ZINC000539121088	333659325	/nfs/dbraw/zinc/65/93/25/333659325.db2.gz	XCTRFDZGHIYZTG-IJLUTSLNSA-N	1	0	253.336	4.216	20	30		CIEDRO
Cc1ccccc1[C@@H]([NH2+]Cc1ccc(F)cc1C#N)C(C)C	ZINC000539259115	333663607	/nfs/dbraw/zinc/66/36/07/333663607.db2.gz	NMVPDQBECNRYOM-IBGZPJMESA-N	1	0	296.389	4.493	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@@H](C)c1ccc(OCC)c(OC)c1	ZINC000539269257	333663693	/nfs/dbraw/zinc/66/36/93/333663693.db2.gz	DRHYNBCWZJAXMJ-CABCVRRESA-N	1	0	291.435	4.489	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H](C)c1ccc(OCC)c(OC)c1	ZINC000539269259	333663769	/nfs/dbraw/zinc/66/37/69/333663769.db2.gz	DRHYNBCWZJAXMJ-HUUCEWRRSA-N	1	0	291.435	4.489	20	30		CIEDRO
N#CC1(C[NH2+][C@@H](c2ccc(Cl)cc2)C2CCC2)CC1	ZINC000539491996	333673615	/nfs/dbraw/zinc/67/36/15/333673615.db2.gz	WSOMIRALKHMGFF-OAHLLOKOSA-N	1	0	274.795	4.075	20	30		CIEDRO
CCC[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(C#N)s1	ZINC000539494369	333673783	/nfs/dbraw/zinc/67/37/83/333673783.db2.gz	HUFFZYRJVFTADZ-IUODEOHRSA-N	1	0	262.422	4.068	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@@H](C)c1cnn(Cc2ccccc2)c1	ZINC000539509630	333675298	/nfs/dbraw/zinc/67/52/98/333675298.db2.gz	IPEWTGJBXKCVPX-SJORKVTESA-N	1	0	297.446	4.327	20	30		CIEDRO
C[C@@H]([NH2+]CCCc1ccc(Cl)cc1)c1ccc(C#N)cc1	ZINC000539508783	333675355	/nfs/dbraw/zinc/67/53/55/333675355.db2.gz	ZKNXLOMYWJJGAH-CQSZACIVSA-N	1	0	298.817	4.495	20	30		CIEDRO
CC(C)(C#N)CC[NH2+]C(C)(c1ccccc1)c1ccccc1	ZINC000539613751	333681355	/nfs/dbraw/zinc/68/13/55/333681355.db2.gz	RUZNYXUICXMGCF-UHFFFAOYSA-N	1	0	292.426	4.480	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](C)c1ccc(-c2ccncc2)cc1	ZINC000540169550	333717182	/nfs/dbraw/zinc/71/71/82/333717182.db2.gz	LJYCPZBATNHQSE-CABCVRRESA-N	1	0	266.388	4.364	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H]1CCc2c1c(Br)ccc2F	ZINC000540172127	333717534	/nfs/dbraw/zinc/71/75/34/333717534.db2.gz	PFXKANNTSVYAMI-TVQRCGJNSA-N	1	0	298.199	4.130	20	30		CIEDRO
C=C(CC)C[NH2+][C@@H](CC(F)(F)F)c1ccc(F)cc1	ZINC000540378680	333727522	/nfs/dbraw/zinc/72/75/22/333727522.db2.gz	BLAVQAXGNAXXBX-ZDUSSCGKSA-N	1	0	275.289	4.375	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)c1ccc(SCCOC)cc1	ZINC000540402926	333728660	/nfs/dbraw/zinc/72/86/60/333728660.db2.gz	BIJYZDNYYHPTCB-AWEZNQCLSA-N	1	0	279.449	4.042	20	30		CIEDRO
Cc1cc(C)cc([C@@H](C)[NH2+]Cc2cccc(C#N)c2F)c1	ZINC000540407553	333728925	/nfs/dbraw/zinc/72/89/25/333728925.db2.gz	QUITUEICBSLHFU-CQSZACIVSA-N	1	0	282.362	4.165	20	30		CIEDRO
C=CC[NH2+][C@H](C)c1ccccc1OCc1ccccc1	ZINC000540429604	333730023	/nfs/dbraw/zinc/73/00/23/333730023.db2.gz	GFTSOTPQGKYSLI-OAHLLOKOSA-N	1	0	267.372	4.102	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)c1ccc(OC)cc1Br	ZINC000540609311	333735965	/nfs/dbraw/zinc/73/59/65/333735965.db2.gz	QMMBMUSBKFYCFB-QWRGUYRKSA-N	1	0	298.224	4.073	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H](C)c1ccc(C#N)c(F)c1	ZINC000540706773	333742531	/nfs/dbraw/zinc/74/25/31/333742531.db2.gz	HOFTXHHTYUMSCT-CHWSQXEVSA-N	1	0	260.356	4.093	20	30		CIEDRO
C[C@H](c1ccc(F)c(Cl)c1)[NH+]1CCC(CC#N)CC1	ZINC000541024894	333759658	/nfs/dbraw/zinc/75/96/58/333759658.db2.gz	SSOFMOHOBNRVQO-LLVKDONJSA-N	1	0	280.774	4.166	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+]CCCC(=O)Nc1ccc(Cl)cc1	ZINC000541743174	333789287	/nfs/dbraw/zinc/78/92/87/333789287.db2.gz	HUWAUNXTAJDGDP-CYBMUJFWSA-N	1	0	294.826	4.003	20	30		CIEDRO
N#Cc1cccc(C[NH2+]Cc2ccc(-c3ccccc3)o2)c1	ZINC000069783656	333789461	/nfs/dbraw/zinc/78/94/61/333789461.db2.gz	WDGBNQKOKKBQMW-UHFFFAOYSA-N	1	0	288.350	4.108	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+]Cc1ccc(-c2ccncc2)cc1	ZINC000541774237	333791901	/nfs/dbraw/zinc/79/19/01/333791901.db2.gz	CCXOWEYOQYCKDH-OAHLLOKOSA-N	1	0	266.388	4.193	20	30		CIEDRO
C[C@H]1C[C@H](CC[NH+]2CCC(CC#N)CC2)C[C@@H](C)C1	ZINC000541951523	333803815	/nfs/dbraw/zinc/80/38/15/333803815.db2.gz	GUPLRDFQUWPQEE-QLPKVWCKSA-N	1	0	262.441	4.074	20	30		CIEDRO
C[C@@H]1CC(CC[NH+]2CCC(CC#N)CC2)C[C@@H](C)C1	ZINC000541951521	333803878	/nfs/dbraw/zinc/80/38/78/333803878.db2.gz	GUPLRDFQUWPQEE-GJZGRUSLSA-N	1	0	262.441	4.074	20	30		CIEDRO
N#CCc1ccc(C[NH2+]C2(c3ccccc3)CCCC2)cc1	ZINC000542256748	333818821	/nfs/dbraw/zinc/81/88/21/333818821.db2.gz	AQRHLMMABRYZKC-UHFFFAOYSA-N	1	0	290.410	4.312	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+][C@H](c1ccco1)c1ccccc1OC	ZINC000542706354	333837963	/nfs/dbraw/zinc/83/79/63/333837963.db2.gz	XLUHLBPOUVDOKO-KDOFPFPSSA-N	1	0	285.387	4.322	20	30		CIEDRO
C[C@H](c1ncc(-c2ccccc2)o1)[NH+]1CCC(CC#N)CC1	ZINC000542880256	333847668	/nfs/dbraw/zinc/84/76/68/333847668.db2.gz	VCGZZUNTVDRNSX-CQSZACIVSA-N	1	0	295.386	4.028	20	30		CIEDRO
Cc1ccc(C[NH2+][C@@H](CCC#N)c2ccccc2)cc1C	ZINC000130541022	333851047	/nfs/dbraw/zinc/85/10/47/333851047.db2.gz	FRCAPGFFJSUMCJ-IBGZPJMESA-N	1	0	278.399	4.438	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(Cl)s1)c1cccc(C#N)c1	ZINC000071306965	333853106	/nfs/dbraw/zinc/85/31/06/333853106.db2.gz	VJYKSBBRWDTLKY-JTQLQIEISA-N	1	0	276.792	4.124	20	30		CIEDRO
CS[C@@H](C[NH2+][C@H](C)c1ccc(C#N)cc1F)C(C)(C)C	ZINC000543426346	333873798	/nfs/dbraw/zinc/87/37/98/333873798.db2.gz	PRUHRHZVNVZRFG-ABAIWWIYSA-N	1	0	294.439	4.126	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](c1ccc(F)c(F)c1)C(C)C	ZINC000543777418	333898200	/nfs/dbraw/zinc/89/82/00/333898200.db2.gz	VONLRDQTQRWBGY-IAQYHMDHSA-N	1	0	253.336	4.216	20	30		CIEDRO
CC(C)([NH2+]CC#Cc1cccc(Cl)c1)c1cccs1	ZINC000544469704	333933111	/nfs/dbraw/zinc/93/31/11/333933111.db2.gz	YBMIWYFCUUOQBU-UHFFFAOYSA-N	1	0	289.831	4.278	20	30		CIEDRO
Cc1cccc(C)c1[C@@H](C)[NH2+]Cc1cc(C#N)ccc1F	ZINC000544893986	333950635	/nfs/dbraw/zinc/95/06/35/333950635.db2.gz	KCDDBRVMGBEHND-CQSZACIVSA-N	1	0	282.362	4.165	20	30		CIEDRO
Cc1cccc(C)c1[C@H](C)[NH2+]Cc1ccccc1C#N	ZINC000544895374	333951049	/nfs/dbraw/zinc/95/10/49/333951049.db2.gz	WFNQMCILQHLKQD-HNNXBMFYSA-N	1	0	264.372	4.026	20	30		CIEDRO
COc1ccc(C#N)cc1C[NH2+][C@H](C)c1c(C)cccc1C	ZINC000545519964	333986098	/nfs/dbraw/zinc/98/60/98/333986098.db2.gz	WRJZXCSLLPYXOB-OAHLLOKOSA-N	1	0	294.398	4.035	20	30		CIEDRO
CC[C@H](CC#N)[NH2+]C1CCC(C)(c2ccccc2)CC1	ZINC000545873235	334003465	/nfs/dbraw/zinc/00/34/65/334003465.db2.gz	ZUCDYZHMBYWAAT-WWDZGPRUSA-N	1	0	270.420	4.169	20	30		CIEDRO
CC[C@@H](Cc1ccc(Cl)cc1Cl)[NH2+]C[C@@H](C)C#N	ZINC000133034854	334013747	/nfs/dbraw/zinc/01/37/47/334013747.db2.gz	AHXDIAUPTHOWBE-GWCFXTLKSA-N	1	0	285.218	4.064	20	30		CIEDRO
Cc1ccc([C@H]2CCCCC[N@@H+]2CCCSCC#N)o1	ZINC000074991303	334022280	/nfs/dbraw/zinc/02/22/80/334022280.db2.gz	YWVRZKJOKQKURD-OAHLLOKOSA-N	1	0	292.448	4.152	20	30		CIEDRO
C=C(C)C[NH2+][C@H](C)c1sc(-c2ccc(F)cc2)nc1C	ZINC000564302675	334031849	/nfs/dbraw/zinc/03/18/49/334031849.db2.gz	PXAYPRVKDUZURX-LLVKDONJSA-N	1	0	290.407	4.484	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+]CCCc1nc2ccccc2n1C	ZINC000546606705	334039896	/nfs/dbraw/zinc/03/98/96/334039896.db2.gz	OWUZESOGSYUMHI-MRXNPFEDSA-N	1	0	299.462	4.230	20	30		CIEDRO
CCC1(C[NH2+]Cc2cc(C#N)cs2)CCCCC1	ZINC000547272355	334075655	/nfs/dbraw/zinc/07/56/55/334075655.db2.gz	HZPUZCQMCHEQOT-UHFFFAOYSA-N	1	0	262.422	4.070	20	30		CIEDRO
C=CCC[N@H+]1CCSC[C@@H]1c1ccc(Cl)cc1	ZINC000547450535	334089733	/nfs/dbraw/zinc/08/97/33/334089733.db2.gz	XETOQLHTNQPIOH-CQSZACIVSA-N	1	0	267.825	4.006	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000134732216	334102140	/nfs/dbraw/zinc/10/21/40/334102140.db2.gz	ROZHCURAOPDBRV-MNOVXSKESA-N	1	0	257.299	4.321	20	30		CIEDRO
C=CC[C@@H](C)[NH2+]Cc1ccc(-c2ccc(F)cc2)o1	ZINC000134748663	334102976	/nfs/dbraw/zinc/10/29/76/334102976.db2.gz	WJZLGRRHAGEWSY-GFCCVEGCSA-N	1	0	259.324	4.140	20	30		CIEDRO
C=CCC[NH2+][C@@H](c1ccccc1)c1ccc(F)cc1	ZINC000134911491	334108070	/nfs/dbraw/zinc/10/80/70/334108070.db2.gz	BHQXSSMTFLYWBT-KRWDZBQOSA-N	1	0	255.336	4.081	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(C#N)o1)c1cccc(Cl)c1	ZINC000135148117	334117751	/nfs/dbraw/zinc/11/77/51/334117751.db2.gz	WTEJKSKEUZAOKC-HNNXBMFYSA-N	1	0	274.751	4.046	20	30		CIEDRO
C[C@H]([N@H+](C)Cc1ccc(Cl)cc1C#N)C(C)(C)C	ZINC000547832092	334125011	/nfs/dbraw/zinc/12/50/11/334125011.db2.gz	TUCDBAVXRXSRMN-NSHDSACASA-N	1	0	264.800	4.078	20	30		CIEDRO
CC(C)(C#N)CC[NH2+][C@@H]1CCCC[C@H]1c1ccccc1	ZINC000547883345	334128687	/nfs/dbraw/zinc/12/86/87/334128687.db2.gz	XCKGHPDKTPDTKR-DLBZAZTESA-N	1	0	270.420	4.242	20	30		CIEDRO
CC(C)(C#N)CC[NH+]1CCC(c2c(F)cccc2F)CC1	ZINC000547947605	334130534	/nfs/dbraw/zinc/13/05/34/334130534.db2.gz	OXFDCDYAWGLRIN-UHFFFAOYSA-N	1	0	292.373	4.084	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+][C@@H](C)c1cccc(OC(F)F)c1	ZINC000135717197	334136805	/nfs/dbraw/zinc/13/68/05/334136805.db2.gz	VTZYFZIFNNWPLN-NEPJUHHUSA-N	1	0	269.335	4.293	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+][C@H](C)c1cccc(OC(F)F)c1	ZINC000135717254	334136825	/nfs/dbraw/zinc/13/68/25/334136825.db2.gz	VTZYFZIFNNWPLN-VXGBXAGGSA-N	1	0	269.335	4.293	20	30		CIEDRO
CCC[C@H]1CCCC[C@@H]1[NH2+]CCCC(C)(C)C#N	ZINC000548487946	334160047	/nfs/dbraw/zinc/16/00/47/334160047.db2.gz	FSTXVXPDHBGRJK-GJZGRUSLSA-N	1	0	250.430	4.265	20	30		CIEDRO
C=C(C)C[N@H+](Cc1ccccc1)Cc1cccc(C#N)c1	ZINC000548753055	334169853	/nfs/dbraw/zinc/16/98/53/334169853.db2.gz	KGSUBCKYLQCSDP-UHFFFAOYSA-N	1	0	276.383	4.137	20	30		CIEDRO
CC[C@H](C[N@H+](CC)[C@H]1CC[C@H](C#N)C1)c1ccccc1	ZINC000549556468	334197984	/nfs/dbraw/zinc/19/79/84/334197984.db2.gz	YMPOYTCIKAJCBM-JZXOWHBKSA-N	1	0	270.420	4.194	20	30		CIEDRO
CC(C)c1ccc(C[C@@H]2CC[N@@H+]([C@H]3CC[C@H](C#N)C3)C2)cc1	ZINC000549938628	334209945	/nfs/dbraw/zinc/20/99/45/334209945.db2.gz	BCGNNRJESKGSHW-BJLQDIEVSA-N	1	0	296.458	4.367	20	30		CIEDRO
CCC1(Cc2ccccc2)CC[NH+]([C@H]2CC[C@H](C#N)C2)CC1	ZINC000549999683	334210914	/nfs/dbraw/zinc/21/09/14/334210914.db2.gz	IRWCKYVXSNYQAH-OALUTQOASA-N	1	0	296.458	4.414	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@H](C#N)C1)c1ccc(F)c2ccccc21	ZINC000550105495	334213306	/nfs/dbraw/zinc/21/33/06/334213306.db2.gz	JVBBARQRRJALNN-IHRRRGAJSA-N	1	0	282.362	4.322	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]Cc1cnc(-c2ccco2)s1	ZINC000550225460	334216667	/nfs/dbraw/zinc/21/66/67/334216667.db2.gz	GXJPVBCXVZLXGL-UHFFFAOYSA-N	1	0	276.405	4.095	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]Cc1ccc(OCC(F)F)cc1	ZINC000550229273	334217012	/nfs/dbraw/zinc/21/70/12/334217012.db2.gz	FHPRZZNGXDRSBG-UHFFFAOYSA-N	1	0	283.362	4.022	20	30		CIEDRO
C[C@@H]1C[C@H]1[C@@H]([NH2+]CCCCC#N)c1ccc(Cl)cc1	ZINC000245854959	334221693	/nfs/dbraw/zinc/22/16/93/334221693.db2.gz	GYIUHFAHGGXMTF-WQVCFCJDSA-N	1	0	276.811	4.321	20	30		CIEDRO
CCS[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000245861587	334222038	/nfs/dbraw/zinc/22/20/38/334222038.db2.gz	HXMBNCIESAZSBH-KBRIMQKVSA-N	1	0	288.460	4.273	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H](C)c1nc2c(s1)CCCC2	ZINC000550856442	334230393	/nfs/dbraw/zinc/23/03/93/334230393.db2.gz	VKBXRMVPPMWPRX-GFCCVEGCSA-N	1	0	278.465	4.275	20	30		CIEDRO
C[C@H]([NH2+][C@H](CCCC#N)c1ccccc1)c1ccoc1	ZINC000551205268	334240740	/nfs/dbraw/zinc/24/07/40/334240740.db2.gz	ISXKNMDQABBOFQ-WMLDXEAASA-N	1	0	268.360	4.365	20	30		CIEDRO
CC(C)C1([NH2+]C2CCC(C#N)(c3ccccc3)CC2)CC1	ZINC000551264719	334243893	/nfs/dbraw/zinc/24/38/93/334243893.db2.gz	MMWSNCDTNGFWOO-UHFFFAOYSA-N	1	0	282.431	4.169	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@H](CO)C1CCCCC1)c1ccco1	ZINC000551273161	334244470	/nfs/dbraw/zinc/24/44/70/334244470.db2.gz	TZSKKYBCEXABOJ-SJORKVTESA-N	1	0	291.435	4.065	20	30		CIEDRO
C[C@H]([NH2+]CCC(C)(C)C1CC1)c1ccc(C#N)c(F)c1	ZINC000551297995	334245561	/nfs/dbraw/zinc/24/55/61/334245561.db2.gz	GRKGGQRKFOFWNC-LBPRGKRZSA-N	1	0	274.383	4.174	20	30		CIEDRO
CC[C@@H]1CCC[C@H]([NH2+]C2(c3cccc(C#N)c3)CC2)C1	ZINC000551565104	334254519	/nfs/dbraw/zinc/25/45/19/334254519.db2.gz	BPCIIGFRKAXWQG-PBHICJAKSA-N	1	0	268.404	4.106	20	30		CIEDRO
Cc1cc(C)c(C[NH2+]C2(c3cccc(C#N)c3)CC2)c(C)c1	ZINC000551712262	334258947	/nfs/dbraw/zinc/25/89/47/334258947.db2.gz	AOTHXFOIYLIXTA-UHFFFAOYSA-N	1	0	290.410	4.262	20	30		CIEDRO
C=CCN(CC=C)Cc1csc(Nc2ccccc2C)n1	ZINC000551825843	334263525	/nfs/dbraw/zinc/26/35/25/334263525.db2.gz	WCIQMQMRULYCAQ-UHFFFAOYSA-N	1	0	299.443	4.369	20	30		CIEDRO
CC(C)Cc1cccc([C@H](C)[NH2+]CCCCC#N)c1	ZINC000552047113	334281104	/nfs/dbraw/zinc/28/11/04/334281104.db2.gz	AFCJVRGRFWDFPY-HNNXBMFYSA-N	1	0	258.409	4.230	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H](C)c2sccc2C)cc1	ZINC000552091582	334288281	/nfs/dbraw/zinc/28/82/81/334288281.db2.gz	RXZITKQIVDZJQU-CQSZACIVSA-N	1	0	287.428	4.472	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H]1CCOc2ccccc21)c1ccco1	ZINC000552244926	334307507	/nfs/dbraw/zinc/30/75/07/334307507.db2.gz	NNIIYGHEKJUULR-RDJZCZTQSA-N	1	0	297.398	4.443	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@H]1CCOc2ccccc21)c1ccco1	ZINC000552244927	334307698	/nfs/dbraw/zinc/30/76/98/334307698.db2.gz	NNIIYGHEKJUULR-WBVHZDCISA-N	1	0	297.398	4.443	20	30		CIEDRO
CCc1ccc([C@H]2CC[N@H+](Cc3cc(C#N)cs3)C2)cc1	ZINC000552273408	334310827	/nfs/dbraw/zinc/31/08/27/334310827.db2.gz	ITRBJBBWXILPSH-KRWDZBQOSA-N	1	0	296.439	4.172	20	30		CIEDRO
CC(C)(CCC#N)C[N@@H+]1CCC[C@@H](c2ccccc2)C1	ZINC000552274361	334311173	/nfs/dbraw/zinc/31/11/73/334311173.db2.gz	PLNPWSZFZPQAFF-QGZVFWFLSA-N	1	0	270.420	4.196	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H]1CCCCS1)c1ccco1	ZINC000552281780	334312460	/nfs/dbraw/zinc/31/24/60/334312460.db2.gz	JQNJYXBJKJROCK-KBPBESRZSA-N	1	0	265.422	4.162	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H]1CCO[C@@H](c2ccccc2)C1)C1CC1	ZINC000248940360	334322390	/nfs/dbraw/zinc/32/23/90/334322390.db2.gz	YSNGYUZJWZRJJF-CEXWTWQISA-N	1	0	285.431	4.241	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+][C@@H](c2ccc(F)cc2)C2CCC2)C1	ZINC000249050832	334325779	/nfs/dbraw/zinc/32/57/79/334325779.db2.gz	XKHNKPYDKUWYRA-FSPWUOQZSA-N	1	0	286.394	4.339	20	30		CIEDRO
CCC[C@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)c1ccccc1	ZINC000249057472	334326006	/nfs/dbraw/zinc/32/60/06/334326006.db2.gz	ZDMSMGWCQZYRNE-OIISXLGYSA-N	1	0	256.393	4.200	20	30		CIEDRO
N#Cc1ccc2c(c1)CCC[C@@H]2[NH2+]C/C=C\c1ccccc1	ZINC000552956875	334352877	/nfs/dbraw/zinc/35/28/77/334352877.db2.gz	VTSXJILSPUBHOG-VORVDVFJSA-N	1	0	288.394	4.239	20	30		CIEDRO
CC[N@H+](CCCC#N)C(c1ccccc1)c1ccccc1	ZINC000553086902	334360620	/nfs/dbraw/zinc/36/06/20/334360620.db2.gz	RPVZVCOWGFZLJR-UHFFFAOYSA-N	1	0	278.399	4.402	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H](C)[C@H](C)C1)c1cccc(C#N)c1	ZINC000251954976	334372499	/nfs/dbraw/zinc/37/24/99/334372499.db2.gz	XDBKYHJOTPRGCH-QDEZUTFSSA-N	1	0	256.393	4.034	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@@H](C)C[C@H]1C)c1cccc(C#N)c1	ZINC000252152318	334374949	/nfs/dbraw/zinc/37/49/49/334374949.db2.gz	OSTNQTRMHFQZGQ-WBOJAVRRSA-N	1	0	256.393	4.034	20	30		CIEDRO
Cc1ccccc1[C@H]([NH2+]Cc1cc(C#N)ccc1F)C(C)C	ZINC000091376551	334377494	/nfs/dbraw/zinc/37/74/94/334377494.db2.gz	YPSSUBJAZMRWGE-LJQANCHMSA-N	1	0	296.389	4.493	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1[C@H](C)CCC[C@@H]1C)c1ccc(C#N)cc1	ZINC000252389969	334378934	/nfs/dbraw/zinc/37/89/34/334378934.db2.gz	LLCFSWDSRKJQLI-OEUWWYETSA-N	1	0	256.393	4.034	20	30		CIEDRO
CC[C@@H]1CCC[C@@H]([NH2+][C@@H](C)c2ccc(C#N)c(F)c2)C1	ZINC000553791663	334398985	/nfs/dbraw/zinc/39/89/85/334398985.db2.gz	XXXLGQGJCJKRGV-WOSRLPQWSA-N	1	0	274.383	4.317	20	30		CIEDRO
COc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(C#N)c(F)c2)cc1	ZINC000553790900	334399002	/nfs/dbraw/zinc/39/90/02/334399002.db2.gz	GIKRDHXTYZLBMO-STQMWFEESA-N	1	0	298.361	4.118	20	30		CIEDRO
C=CCC[C@H](C)[NH2+]C[C@H]1CCCC[C@H]1C(F)(F)F	ZINC000554073809	334409430	/nfs/dbraw/zinc/40/94/30/334409430.db2.gz	QUJKLGWUHSCTGS-YNEHKIRRSA-N	1	0	263.347	4.299	20	30		CIEDRO
CC(C)[C@@H]1CC[C@H]([NH2+]CC(C)(C)CCC#N)C[C@@H]1C	ZINC000554077132	334409656	/nfs/dbraw/zinc/40/96/56/334409656.db2.gz	NODINUABRPOECZ-JYJNAYRXSA-N	1	0	264.457	4.367	20	30		CIEDRO
C=C(C)[C@H]([NH2+][C@@H]1CC[C@H]1C1CC1)c1ccc(F)c(F)c1	ZINC000554095807	334412147	/nfs/dbraw/zinc/41/21/47/334412147.db2.gz	HDNPTUKDBNLLKN-XKQJLSEDSA-N	1	0	277.358	4.360	20	30		CIEDRO
CC(C)(C#N)CC[NH+]1CCC(c2cccc(F)c2F)CC1	ZINC000554262436	334419069	/nfs/dbraw/zinc/41/90/69/334419069.db2.gz	BXFYFCJXQLNZON-UHFFFAOYSA-N	1	0	292.373	4.084	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H]1CCc2c1ccc(OC)c2F	ZINC000554739494	334450313	/nfs/dbraw/zinc/45/03/13/334450313.db2.gz	YIRILSMVTADWHN-WFASDCNBSA-N	1	0	277.383	4.156	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH2+][C@@H](Cc2ccccc2)c2cccs2)C1	ZINC000555422871	334478371	/nfs/dbraw/zinc/47/83/71/334478371.db2.gz	LEPQANAGIRGRHP-ZACQAIPSSA-N	1	0	296.439	4.314	20	30		CIEDRO
C=CC[C@H](C)[NH2+]C[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000556242642	334503089	/nfs/dbraw/zinc/50/30/89/334503089.db2.gz	RFNRTFWUWSUZJW-RYUDHWBXSA-N	1	0	271.326	4.363	20	30		CIEDRO
C=CC[C@@H](C)[NH2+]C[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000556242641	334503093	/nfs/dbraw/zinc/50/30/93/334503093.db2.gz	RFNRTFWUWSUZJW-NWDGAFQWSA-N	1	0	271.326	4.363	20	30		CIEDRO
CC1(C)CCC([NH2+][C@@H]2CCc3ccc(C#N)cc32)CC1	ZINC000564423606	334508068	/nfs/dbraw/zinc/50/80/68/334508068.db2.gz	JAEZOPUBGWOVTF-QGZVFWFLSA-N	1	0	268.404	4.104	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+][C@H](c1ccc(C)cc1)C1CC1	ZINC000565724443	334591854	/nfs/dbraw/zinc/59/18/54/334591854.db2.gz	VLYSJPFBJXHORV-OTWHNJEPSA-N	1	0	285.431	4.017	20	30		CIEDRO
Cc1ccccc1C[C@@H](C)[NH2+][C@H]1CCc2ccc(C#N)cc21	ZINC000565979119	334613629	/nfs/dbraw/zinc/61/36/29/334613629.db2.gz	SSOKHFZBLKHGJW-QRWLVFNGSA-N	1	0	290.410	4.075	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(CC#N)cc1)c1ccsc1	ZINC000566219808	334636672	/nfs/dbraw/zinc/63/66/72/334636672.db2.gz	FPBCULGEFHZJCS-INIZCTEOSA-N	1	0	270.401	4.055	20	30		CIEDRO
CC(C)CC[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)C(C)(C)C	ZINC000566878659	334667970	/nfs/dbraw/zinc/66/79/70/334667970.db2.gz	NUYAPMFVMKXOHB-ZNMIVQPWSA-N	1	0	250.430	4.119	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)c1ccc(N(C)C)cc1	ZINC000268786774	334716112	/nfs/dbraw/zinc/71/61/12/334716112.db2.gz	CUWSLAKXEIAJDG-LSDHHAIUSA-N	1	0	293.414	4.036	20	30		CIEDRO
C[C@@H](C[NH2+][C@H](C)c1ccc(OCC#N)cc1)c1ccccc1	ZINC000271830311	334747076	/nfs/dbraw/zinc/74/70/76/334747076.db2.gz	PNKKUVFWIXNZDS-JKSUJKDBSA-N	1	0	294.398	4.043	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H](C)c1ccc(OC)c(OC)c1C	ZINC000567877570	334770908	/nfs/dbraw/zinc/77/09/08/334770908.db2.gz	LCDICJUNVYCICX-UKRRQHHQSA-N	1	0	291.435	4.408	20	30		CIEDRO
C=CCCCCC[NH2+][C@@H](C)c1cncc(Br)c1	ZINC000568276413	334811725	/nfs/dbraw/zinc/81/17/25/334811725.db2.gz	KMLCUSGJRDWXSB-LBPRGKRZSA-N	1	0	297.240	4.241	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@@H](CCC)c1ccccn1	ZINC000159099252	334819488	/nfs/dbraw/zinc/81/94/88/334819488.db2.gz	UZLVDNPAOSSAEF-KRWDZBQOSA-N	1	0	296.414	4.277	20	30		CIEDRO
C[C@@H](C[NH2+][C@H]1CCc2ccc(C#N)cc21)Cc1cccs1	ZINC000569055999	334853155	/nfs/dbraw/zinc/85/31/55/334853155.db2.gz	YOXFONHYLUJKOS-ACJLOTCBSA-N	1	0	296.439	4.075	20	30		CIEDRO
N#Cc1ccc2c(c1)[C@@H]([NH2+]C1(c3ccccc3)CCC1)CC2	ZINC000569159761	334858565	/nfs/dbraw/zinc/85/85/65/334858565.db2.gz	YCOXEYFOZCYWCT-IBGZPJMESA-N	1	0	288.394	4.215	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H](C)c1ccc(-n2ccnc2C)cc1	ZINC000572862292	334885664	/nfs/dbraw/zinc/88/56/64/334885664.db2.gz	XVQUZCJXFKTQPU-HNNXBMFYSA-N	1	0	297.446	4.434	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@@H]1CCCc2ccc(OC)cc21	ZINC000343508071	335205826	/nfs/dbraw/zinc/20/58/26/335205826.db2.gz	PKFORGPHNAYNBS-WMLDXEAASA-N	1	0	259.393	4.017	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]CC1(CCOC)CCCCC1	ZINC000576461495	335206683	/nfs/dbraw/zinc/20/66/83/335206683.db2.gz	RUNQBTWIIWXNRH-UHFFFAOYSA-N	1	0	267.457	4.165	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+]Cc1noc2ccccc21	ZINC000576478826	335210001	/nfs/dbraw/zinc/21/00/01/335210001.db2.gz	DUAJDEQTLWSIJG-CYBMUJFWSA-N	1	0	258.365	4.052	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](Cc1ccccc1Cl)C1CC1	ZINC000576722255	335240192	/nfs/dbraw/zinc/24/01/92/335240192.db2.gz	JXWZVZVRPHVXIS-LRDDRELGSA-N	1	0	263.812	4.215	20	30		CIEDRO
C[C@@H](CCC#N)[NH+]1CCC(c2ccnc3ccccc32)CC1	ZINC000580567100	335283474	/nfs/dbraw/zinc/28/34/74/335283474.db2.gz	OUKBBKKNAANPJA-HNNXBMFYSA-N	1	0	293.414	4.106	20	30		CIEDRO
C=CCC[C@H](C)[NH2+]C[C@H](Cc1ccccc1)C(F)(F)F	ZINC000577028291	335284613	/nfs/dbraw/zinc/28/46/13/335284613.db2.gz	BPJUVQMQTBOKTI-ZFWWWQNUSA-N	1	0	285.353	4.352	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H](C)CCCC(F)(F)F	ZINC000380027960	335298820	/nfs/dbraw/zinc/29/88/20/335298820.db2.gz	OFZLAEWRUWKRBD-NSHDSACASA-N	1	0	251.336	4.299	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+][C@H](C)c1c(F)cncc1F	ZINC000577306761	335337354	/nfs/dbraw/zinc/33/73/54/335337354.db2.gz	VHVRKKLKLBKYET-VXGBXAGGSA-N	1	0	268.351	4.145	20	30		CIEDRO
N#Cc1ccc(C[NH2+]CCc2cccc3ccccc32)s1	ZINC000176947041	335342750	/nfs/dbraw/zinc/34/27/50/335342750.db2.gz	MGSXTXIZQUFBGF-UHFFFAOYSA-N	1	0	292.407	4.105	20	30		CIEDRO
C=CC[C@@H](C)[NH2+]C/C(C)=C\c1ccccc1OC(F)F	ZINC000577428523	335351451	/nfs/dbraw/zinc/35/14/51/335351451.db2.gz	MNIAIPKGIXNWJL-KXXVWKPMSA-N	1	0	281.346	4.246	20	30		CIEDRO
CC[C@H](c1ccccc1)[NH+]1CCC(CCC#N)CC1	ZINC000577509457	335362419	/nfs/dbraw/zinc/36/24/19/335362419.db2.gz	GOBZYHVIZSNLTD-QGZVFWFLSA-N	1	0	256.393	4.153	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CCCCc3ccccc32)c(F)c1	ZINC000177447224	335372364	/nfs/dbraw/zinc/37/23/64/335372364.db2.gz	HKDOQEFNELQCMH-LJQANCHMSA-N	1	0	294.373	4.255	20	30		CIEDRO
N#Cc1csc(C[NH2+][C@H]2CCc3c2cccc3Cl)c1	ZINC000177692116	335379133	/nfs/dbraw/zinc/37/91/33/335379133.db2.gz	GZJOOXKIHSFACI-HNNXBMFYSA-N	1	0	288.803	4.050	20	30		CIEDRO
C[C@H]([NH2+]Cc1cc(C#N)cs1)C(C)(C)c1ccccc1	ZINC000177695708	335379479	/nfs/dbraw/zinc/37/94/79/335379479.db2.gz	MDGRNRFGZCPCOU-ZDUSSCGKSA-N	1	0	284.428	4.076	20	30		CIEDRO
Cc1ccccc1[C@H]([NH2+]Cc1cc(C#N)cs1)C(C)C	ZINC000177699722	335379800	/nfs/dbraw/zinc/37/98/00/335379800.db2.gz	PTAYCQGHIIBLNU-QGZVFWFLSA-N	1	0	284.428	4.415	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1cc(C#N)cs1)c1cc(F)ccc1F	ZINC000177705006	335380265	/nfs/dbraw/zinc/38/02/65/335380265.db2.gz	UKNVDFXLOMKSEV-OAHLLOKOSA-N	1	0	292.354	4.139	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H]2CCSc3ccccc32)c(F)c1	ZINC000177857184	335404309	/nfs/dbraw/zinc/40/43/09/335404309.db2.gz	XTYZEDWCTLMXKI-INIZCTEOSA-N	1	0	298.386	4.024	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccccc1C#N)c1ccccc1	ZINC000179096775	335473294	/nfs/dbraw/zinc/47/32/94/335473294.db2.gz	QAPYNRFDXCBWJF-IBGZPJMESA-N	1	0	276.383	4.355	20	30		CIEDRO
CCc1[nH+]c2ccccc2c(N2CCC(C)(C#N)CC2)c1C	ZINC000578155302	335534474	/nfs/dbraw/zinc/53/44/74/335534474.db2.gz	KXYYGHPYHKQMPL-UHFFFAOYSA-N	1	0	293.414	4.236	20	30		CIEDRO
Cc1cc(N2CCC(CCC#N)CC2)c2cc(F)ccc2[nH+]1	ZINC000579118908	335711709	/nfs/dbraw/zinc/71/17/09/335711709.db2.gz	YJWQAFQWVVHHSX-UHFFFAOYSA-N	1	0	297.377	4.203	20	30		CIEDRO
N#CCCCC[NH2+][C@@H](c1cccc(F)c1)C1CCCC1	ZINC000181012266	335747604	/nfs/dbraw/zinc/74/76/04/335747604.db2.gz	CBVZMMGNDNQCFD-QGZVFWFLSA-N	1	0	274.383	4.340	20	30		CIEDRO
C=CCCC[NH2+]Cc1cc(Cl)c(OCCC)c(OC)c1	ZINC000579441420	335756468	/nfs/dbraw/zinc/75/64/68/335756468.db2.gz	OHEIBLSPXVRKOL-UHFFFAOYSA-N	1	0	297.826	4.193	20	30		CIEDRO
CC1=CC[C@@H]([NH2+][C@H]2CCCc3cc(C#N)ccc32)CC1	ZINC000579453091	335759736	/nfs/dbraw/zinc/75/97/36/335759736.db2.gz	AVNSPHRBAHLODH-AEFFLSMTSA-N	1	0	266.388	4.024	20	30		CIEDRO
CC1=CC[C@H]([NH2+][C@H]2CCCc3cc(C#N)ccc32)CC1	ZINC000579453094	335759737	/nfs/dbraw/zinc/75/97/37/335759737.db2.gz	AVNSPHRBAHLODH-WMZOPIPTSA-N	1	0	266.388	4.024	20	30		CIEDRO
CC1=CC[C@@H]([NH2+][C@@H]2CCCc3cc(C#N)ccc32)CC1	ZINC000579453093	335759748	/nfs/dbraw/zinc/75/97/48/335759748.db2.gz	AVNSPHRBAHLODH-SJLPKXTDSA-N	1	0	266.388	4.024	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+]Cc1cnc2ccccc2c1	ZINC000579507070	335777346	/nfs/dbraw/zinc/77/73/46/335777346.db2.gz	ZFPSHPXISCJDNI-OAHLLOKOSA-N	1	0	268.404	4.459	20	30		CIEDRO
CCS[C@@H]1CCC[C@H]([NH2+][C@@H](C)c2ccc(C#N)cc2)C1	ZINC000181855427	335788637	/nfs/dbraw/zinc/78/86/37/335788637.db2.gz	LFAOXWCLQMMEGO-RRQGHBQHSA-N	1	0	288.460	4.273	20	30		CIEDRO
CCOc1cc(C)ccc1C[NH2+][C@H](C)c1cccc(C#N)c1	ZINC000181889361	335789903	/nfs/dbraw/zinc/78/99/03/335789903.db2.gz	CEBBIRDTLOQERT-OAHLLOKOSA-N	1	0	294.398	4.116	20	30		CIEDRO
Cc1ccccc1[C@@H](CC(C)C)[NH2+]CCCSCC#N	ZINC000183254563	335883144	/nfs/dbraw/zinc/88/31/44/335883144.db2.gz	ZAKBUOHQPPWNRF-QGZVFWFLSA-N	1	0	290.476	4.319	20	30		CIEDRO
C=CCC[NH2+][C@H](C)c1sc(-c2ccc(F)cc2)nc1C	ZINC000184347951	335924088	/nfs/dbraw/zinc/92/40/88/335924088.db2.gz	SKGALXKJMGPFJT-LLVKDONJSA-N	1	0	290.407	4.484	20	30		CIEDRO
C=CCCC[NH2+]C1(c2cccc(C(F)(F)F)c2)CC1	ZINC000581421393	336074370	/nfs/dbraw/zinc/07/43/70/336074370.db2.gz	JVWUNQJPRHVDFY-UHFFFAOYSA-N	1	0	269.310	4.250	20	30		CIEDRO
C=CCOc1ccccc1C[N@@H+](C)C1CCC(F)(F)CC1	ZINC000581694579	336128902	/nfs/dbraw/zinc/12/89/02/336128902.db2.gz	YBLONXOMMYQRDR-UHFFFAOYSA-N	1	0	295.373	4.261	20	30		CIEDRO
C=CCCC[NH2+][C@@H](c1ccccc1)c1ccc(OC)cc1	ZINC000385886865	336159434	/nfs/dbraw/zinc/15/94/34/336159434.db2.gz	SNKPCGHAKZZXAW-IBGZPJMESA-N	1	0	281.399	4.340	20	30		CIEDRO
C=CCCC[NH2+][C@H](c1ccccc1)c1ccc(OC)cc1	ZINC000385886868	336159537	/nfs/dbraw/zinc/15/95/37/336159537.db2.gz	SNKPCGHAKZZXAW-LJQANCHMSA-N	1	0	281.399	4.340	20	30		CIEDRO
C[C@H](CCC(C)(C)C)[NH2+][C@H](C)c1cccc(C#N)c1	ZINC000386016805	336164525	/nfs/dbraw/zinc/16/45/25/336164525.db2.gz	NUECQNYZBALLBD-ZIAGYGMSSA-N	1	0	258.409	4.424	20	30		CIEDRO
C[C@@H](CCC(C)(C)C)[NH2+][C@@H](C)c1cccc(C#N)c1	ZINC000386016802	336164587	/nfs/dbraw/zinc/16/45/87/336164587.db2.gz	NUECQNYZBALLBD-KBPBESRZSA-N	1	0	258.409	4.424	20	30		CIEDRO
C[C@@H](CCC(C)(C)C)[NH2+]Cc1ccc(C#N)cc1F	ZINC000386359460	336171477	/nfs/dbraw/zinc/17/14/77/336171477.db2.gz	NXVKRQCSFHXWHC-LBPRGKRZSA-N	1	0	262.372	4.002	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)c1sccc1Br	ZINC000386938614	336182660	/nfs/dbraw/zinc/18/26/60/336182660.db2.gz	VGTWURQEYROMIQ-SECBINFHSA-N	1	0	274.227	4.127	20	30		CIEDRO
C[C@@H]([NH2+]C1CC(c2ccc(F)cc2)C1)c1ccc(C#N)cc1	ZINC000387280128	336190963	/nfs/dbraw/zinc/19/09/63/336190963.db2.gz	IUEULAYFODDCIW-UYCDIGJJSA-N	1	0	294.373	4.294	20	30		CIEDRO
Cc1ccc(-c2ccc(C[NH2+]CCCC#N)s2)cc1	ZINC000344320129	534187054	/nfs/dbraw/zinc/18/70/54/534187054.db2.gz	COOGJBCMTDPLGI-UHFFFAOYSA-N	1	0	270.401	4.117	20	30		CIEDRO
Cc1nc(C(C)C)ccc1C[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000293881272	518192405	/nfs/dbraw/zinc/19/24/05/518192405.db2.gz	UCTAMVKLAZTYLR-AWEZNQCLSA-N	1	0	293.414	4.236	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(C#N)o1)c1ccc(Cl)s1	ZINC000266168057	522641646	/nfs/dbraw/zinc/64/16/46/522641646.db2.gz	BIEZNALZDLXXIJ-NSHDSACASA-N	1	0	280.780	4.107	20	30		CIEDRO
CC[C@H]([NH2+]Cc1sccc1C)c1ccc(C#N)cc1	ZINC000278332451	522674874	/nfs/dbraw/zinc/67/48/74/522674874.db2.gz	WKIPMWXKVQAQHQ-HNNXBMFYSA-N	1	0	270.401	4.169	20	30		CIEDRO
CCc1ccc(C[NH2+][C@H](C)c2ccc(C#N)cc2)s1	ZINC000037749604	523945627	/nfs/dbraw/zinc/94/56/27/523945627.db2.gz	GOOJATHHTPNUAE-GFCCVEGCSA-N	1	0	270.401	4.033	20	30		CIEDRO
C[C@H]1C[C@H]([NH2+]C2(c3cccc(C#N)c3)CC2)c2ccccc21	ZINC000290275755	524921859	/nfs/dbraw/zinc/92/18/59/524921859.db2.gz	LVCWFHLXSMHXSY-LIRRHRJNSA-N	1	0	288.394	4.385	20	30		CIEDRO
C[C@H]([NH2+]C[C@H]1CCCC(F)(F)C1)c1ccc(C#N)c(F)c1	ZINC000282650177	525412848	/nfs/dbraw/zinc/41/28/48/525412848.db2.gz	HZAFSTSUIMAQAT-RYUDHWBXSA-N	1	0	296.336	4.173	20	30		CIEDRO
Cc1ccccc1[C@H](C)[NH2+][C@H](C)c1cccc(C#N)c1	ZINC000037228515	525417646	/nfs/dbraw/zinc/41/76/46/525417646.db2.gz	PWAIDDZCTMHIBN-CABCVRRESA-N	1	0	264.372	4.279	20	30		CIEDRO
Cc1ccccc1[C@H]([NH2+]Cc1ccc(F)c(C#N)c1)C1CC1	ZINC000272009432	525429388	/nfs/dbraw/zinc/42/93/88/525429388.db2.gz	JQRBMDNLMIMUJH-LJQANCHMSA-N	1	0	294.373	4.247	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CSc2ccccc21)c1ccc(C#N)cc1	ZINC000155887087	525585248	/nfs/dbraw/zinc/58/52/48/525585248.db2.gz	MYRBDXPWTGWSKA-BLLLJJGKSA-N	1	0	280.396	4.056	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCCc2cc(C#N)ccc21)c1ccsc1	ZINC000338020331	525614260	/nfs/dbraw/zinc/61/42/60/525614260.db2.gz	YHNYPERWSUVQOX-SJCJKPOMSA-N	1	0	282.412	4.348	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCc2c1cccc2F)c1ccc(C#N)cc1	ZINC000097988272	525630994	/nfs/dbraw/zinc/63/09/94/525630994.db2.gz	ALQPZPKHNCXTAY-SGTLLEGYSA-N	1	0	280.346	4.035	20	30		CIEDRO
Cc1c([C@@H](C)[NH2+][C@H](C)c2ccc(C#N)cc2)cnn1C(C)C	ZINC000276369602	525904224	/nfs/dbraw/zinc/90/42/24/525904224.db2.gz	OFUZVXWNZIAOIM-ZIAGYGMSSA-N	1	0	296.418	4.056	20	30		CIEDRO
Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(C#N)cc2)s1	ZINC000036991883	525940104	/nfs/dbraw/zinc/94/01/04/525940104.db2.gz	WTKFQIBQSLRJRU-OLZOCXBDSA-N	1	0	270.401	4.340	20	30		CIEDRO
C=C1CC[NH+](Cc2ccc(-c3ccncc3)cc2F)CC1	ZINC000353332928	526904956	/nfs/dbraw/zinc/90/49/56/526904956.db2.gz	RDGIRRPRIYPEIM-UHFFFAOYSA-N	1	0	282.362	4.040	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@@H](C)c1ncc(C)s1)c1ccco1	ZINC000353671892	527446943	/nfs/dbraw/zinc/44/69/43/527446943.db2.gz	PADZVOAFGJBEJN-TZMCWYRMSA-N	1	0	290.432	4.445	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCCC(C)(F)F)c1ccco1	ZINC000296637736	527446996	/nfs/dbraw/zinc/44/69/96/527446996.db2.gz	BVIKJWBNSIOMGL-GFCCVEGCSA-N	1	0	257.324	4.312	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCc1sc(C)nc1C)c1ccco1	ZINC000356099211	527448021	/nfs/dbraw/zinc/44/80/21/527448021.db2.gz	XCLRDGYZGINDSJ-CQSZACIVSA-N	1	0	290.432	4.193	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@@H](CCO)c1ccc(Cl)cc1	ZINC000348209784	527466644	/nfs/dbraw/zinc/46/66/44/527466644.db2.gz	ZYWKLOAFHARDNB-HOTGVXAUSA-N	1	0	281.827	4.098	20	30		CIEDRO
C=CCC[C@H]([NH2+]CC1([C@@H](C)CCO)CCC1)c1ccco1	ZINC000353618912	527483607	/nfs/dbraw/zinc/48/36/07/527483607.db2.gz	HAEGMQCDXGEJAF-HOTGVXAUSA-N	1	0	291.435	4.065	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1nc2ccccc2[nH]1)c1ccccc1	ZINC000344854226	527486964	/nfs/dbraw/zinc/48/69/64/527486964.db2.gz	LZEAKMGZTOUMNL-INIZCTEOSA-N	1	0	291.398	4.360	20	30		CIEDRO
CC(C)[C@@H]([NH2+]C[C@H](C#N)CCC#N)c1ccc(Cl)cc1	ZINC000356114121	528588719	/nfs/dbraw/zinc/58/87/19/528588719.db2.gz	QBMBJGUOAVNLQJ-XJKSGUPXSA-N	1	0	289.810	4.070	20	30		CIEDRO
CC(C)Cc1cccc([C@@H](C)[NH2+]CC2(CC#N)CC2)c1	ZINC000353585741	528659509	/nfs/dbraw/zinc/65/95/09/528659509.db2.gz	VLLOKBINWBPUBG-OAHLLOKOSA-N	1	0	270.420	4.230	20	30		CIEDRO
CC[N@H+](Cc1cccc(OCCCC#N)c1)[C@H](C)C(C)C	ZINC000352817601	528815804	/nfs/dbraw/zinc/81/58/04/528815804.db2.gz	RCWJDCAONRZTEP-MRXNPFEDSA-N	1	0	288.435	4.236	20	30		CIEDRO
CC1(C#N)CCC([NH2+]C2CCC(C(F)(F)F)CC2)CC1	ZINC000336226482	528832219	/nfs/dbraw/zinc/83/22/19/528832219.db2.gz	SVODIGXOPKDBGQ-UHFFFAOYSA-N	1	0	288.357	4.170	20	30		CIEDRO
Cc1ccccc1C[C@@H]([NH2+]CC1CCC(C#N)CC1)C1CC1	ZINC000573393304	334934821	/nfs/dbraw/zinc/93/48/21/334934821.db2.gz	XZNXRWKCGIVOJZ-LBXVMSDZSA-N	1	0	296.458	4.236	20	30		CIEDRO
C=CCCOCC[NH2+][C@H](C)c1ccc(C(C)C)cc1	ZINC000222447880	260220278	/nfs/dbraw/zinc/22/02/78/260220278.db2.gz	ROYUHPJSJCLYFM-OAHLLOKOSA-N	1	0	261.409	4.053	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)c1cc(C)ccc1OC(F)F	ZINC000448028552	260592720	/nfs/dbraw/zinc/59/27/20/260592720.db2.gz	ORQGPFQMCFVCKE-LBPRGKRZSA-N	1	0	269.335	4.213	20	30		CIEDRO
C=CCCCCC[NH2+]C1(c2noc(C)n2)CCCCCC1	ZINC000488220600	541310241	/nfs/dbraw/zinc/31/02/41/541310241.db2.gz	OIVJKZWNXVBQKX-UHFFFAOYSA-N	1	0	291.439	4.264	20	30		CIEDRO
C[C@H](C[NH2+][C@@H]1CCCc2cc(C#N)ccc21)c1ccccc1	ZINC000574182288	334999011	/nfs/dbraw/zinc/99/90/11/334999011.db2.gz	IIFUZGZIYBDHDO-FOIQADDNSA-N	1	0	290.410	4.329	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@@H](C)c1cncc(Br)c1	ZINC000574291838	335008021	/nfs/dbraw/zinc/00/80/21/335008021.db2.gz	FECWJKDDLWNBME-NEPJUHHUSA-N	1	0	297.240	4.240	20	30		CIEDRO
CCC(CC)[C@H]([NH2+]C[C@H](C#N)CCC#N)c1cccs1	ZINC000574631156	335034901	/nfs/dbraw/zinc/03/49/01/335034901.db2.gz	COSPZRYTDUJBRG-BBRMVZONSA-N	1	0	289.448	4.259	20	30		CIEDRO
CC[N@H+](Cc1ccc(C#N)s1)[C@@H](C)c1ccc(C#N)cc1	ZINC000179464041	260049946	/nfs/dbraw/zinc/04/99/46/260049946.db2.gz	QWMTUOYXRPWASG-ZDUSSCGKSA-N	1	0	295.411	4.075	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCCc2cc(C#N)ccc21)c1ccccc1	ZINC000341749991	130019511	/nfs/dbraw/zinc/01/95/11/130019511.db2.gz	DTGXIVSUGJMGFP-AUUYWEPGSA-N	1	0	276.383	4.286	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCCc2cc(C#N)ccc21)c1ccccc1F	ZINC000341756197	130024180	/nfs/dbraw/zinc/02/41/80/130024180.db2.gz	DCUWKCITAWIKSW-BFUOFWGJSA-N	1	0	294.373	4.426	20	30		CIEDRO
N#Cc1ccc2c(c1)CCC[C@@H]2[NH2+][C@@H]1CCc2ccccc21	ZINC000341756580	130024952	/nfs/dbraw/zinc/02/49/52/130024952.db2.gz	FRWUWNLCOPKQOB-VQTJNVASSA-N	1	0	288.394	4.213	20	30		CIEDRO
N#Cc1ccc2c(c1)CCC[C@@H]2[NH2+]Cc1cc(F)cc(F)c1	ZINC000341757825	130025871	/nfs/dbraw/zinc/02/58/71/130025871.db2.gz	MAMSJMVCFSNLJH-SFHVURJKSA-N	1	0	298.336	4.004	20	30		CIEDRO
N#CC1(C[NH2+][C@@H]2CCC[C@@H](c3ccc(Cl)cc3)C2)CC1	ZINC000575105836	335065893	/nfs/dbraw/zinc/06/58/93/335065893.db2.gz	UFMIRWGKVIDITA-GDBMZVCRSA-N	1	0	288.822	4.260	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2)cc1	ZINC000020095925	170995417	/nfs/dbraw/zinc/99/54/17/170995417.db2.gz	WHDVILMLNQLIJV-AWEZNQCLSA-N	1	0	285.362	4.241	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)c1cccs1	ZINC000020148258	171036329	/nfs/dbraw/zinc/03/63/29/171036329.db2.gz	LGCNLTREJSCQLD-NWDGAFQWSA-N	1	0	256.374	4.032	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H]2CCCc3occc32)cc1	ZINC000020205027	171070108	/nfs/dbraw/zinc/07/01/08/171070108.db2.gz	BOWVLTNJDSTPTR-KRWDZBQOSA-N	1	0	283.371	4.012	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@@H](C)c1cccs1	ZINC000034992345	171918484	/nfs/dbraw/zinc/91/84/84/171918484.db2.gz	QTGNKERBHZDTRM-ZDUSSCGKSA-N	1	0	273.401	4.164	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CCSc3ccc(F)cc32)cc1	ZINC000035230434	172070803	/nfs/dbraw/zinc/07/08/03/172070803.db2.gz	UAJUMHXBLGRYPK-MRXNPFEDSA-N	1	0	298.386	4.024	20	30		CIEDRO
CSc1ccc(C[NH2+][C@H](C)c2ccc(C#N)cc2)cc1	ZINC000035256350	172085903	/nfs/dbraw/zinc/08/59/03/172085903.db2.gz	NLYNKKIMSHZLME-CYBMUJFWSA-N	1	0	282.412	4.131	20	30		CIEDRO
Cc1ccc([C@H]([NH2+]CC(C)(C)CCC#N)C2CCC2)o1	ZINC000348220884	226426345	/nfs/dbraw/zinc/42/63/45/226426345.db2.gz	FLSZBEKNFLNXLE-MRXNPFEDSA-N	1	0	274.408	4.349	20	30		CIEDRO
N#Cc1ccc2c(c1)CCCC[C@@H]2[NH2+]CCC1(F)CCC1	ZINC000348314825	226443861	/nfs/dbraw/zinc/44/38/61/226443861.db2.gz	HNQYQLGUTJIDSE-KRWDZBQOSA-N	1	0	286.394	4.198	20	30		CIEDRO
N#CCCC[C@H]([NH2+]C/C=C\c1ccncc1)c1ccccc1	ZINC000353918660	226821199	/nfs/dbraw/zinc/82/11/99/226821199.db2.gz	ZZFMMPBDXJYJRO-RURPWVQCSA-N	1	0	291.398	4.120	20	30		CIEDRO
N#Cc1ccc2c(c1)[C@H]([NH2+][C@@H]1CCCc3sccc31)CC2	ZINC000353640351	228136650	/nfs/dbraw/zinc/13/66/50/228136650.db2.gz	ULLBALBECFLWGY-IAGOWNOFSA-N	1	0	294.423	4.274	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+]C2CCC(c3ccccc3)CC2)C1	ZINC000192634127	228200685	/nfs/dbraw/zinc/20/06/85/228200685.db2.gz	XLHSOFGTIAQOQE-RXQRSOPUSA-N	1	0	282.431	4.385	20	30		CIEDRO
C[C@@]1(c2ccccc2)CCC[N@H+](CCCCC#N)CC1	ZINC000352219675	228200850	/nfs/dbraw/zinc/20/08/50/228200850.db2.gz	FCCYHIYYVYNQPF-GOSISDBHSA-N	1	0	270.420	4.124	20	30		CIEDRO
C=C(C)C[N@@H+](CC)Cc1cccc(OCc2ccccn2)c1	ZINC000179528276	260053507	/nfs/dbraw/zinc/05/35/07/260053507.db2.gz	ZKPZEFLASVSOFX-UHFFFAOYSA-N	1	0	296.414	4.059	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+]C[C@H]2CCCC[C@@H]2C(F)(F)F)C1	ZINC000447583194	260063507	/nfs/dbraw/zinc/06/35/07/260063507.db2.gz	AWQVZXFZQAYPIS-MQYQWHSLSA-N	1	0	288.357	4.027	20	30		CIEDRO
CC[C@@H]([NH2+]CC1(CC)CCC1)c1ccc(C#N)cc1	ZINC000447588611	260066864	/nfs/dbraw/zinc/06/68/64/260066864.db2.gz	VBGKWDSVSODIIL-MRXNPFEDSA-N	1	0	256.393	4.179	20	30		CIEDRO
N#Cc1csc(C[N@H+]2CCC[C@H]2c2cccc(F)c2)c1	ZINC000180155699	260094928	/nfs/dbraw/zinc/09/49/28/260094928.db2.gz	PVXKFLMJUMZKHO-INIZCTEOSA-N	1	0	286.375	4.096	20	30		CIEDRO
Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C#N)cc1F)[C@H](C)C2	ZINC000180479626	260103672	/nfs/dbraw/zinc/10/36/72/260103672.db2.gz	XPOIDUXLDFMVOR-BFUOFWGJSA-N	1	0	294.373	4.029	20	30		CIEDRO
COc1cc([C@H](C)[NH2+][C@@H](C)c2ccc(C#N)cc2)ccc1F	ZINC000317219306	260133159	/nfs/dbraw/zinc/13/31/59/260133159.db2.gz	HINWMLCSRUUOKA-STQMWFEESA-N	1	0	298.361	4.118	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1ccc(Br)c(F)c1	ZINC000309481196	260170641	/nfs/dbraw/zinc/17/06/41/260170641.db2.gz	TVHCBWBXEIKDLN-NSHDSACASA-N	1	0	286.188	4.033	20	30		CIEDRO
C[C@H]([NH2+]Cc1sccc1Cl)c1ccc(C#N)cc1	ZINC000310693429	260224089	/nfs/dbraw/zinc/22/40/89/260224089.db2.gz	SMMLGSGQYPDITH-JTQLQIEISA-N	1	0	276.792	4.124	20	30		CIEDRO
N#CCC1(C[NH2+]C(c2ccccc2)c2ccccc2)CC1	ZINC000088249581	260229661	/nfs/dbraw/zinc/22/96/61/260229661.db2.gz	DAMZCKVOQIJLPL-UHFFFAOYSA-N	1	0	276.383	4.059	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1CCCC12CCCCC2	ZINC000313012001	260234075	/nfs/dbraw/zinc/23/40/75/260234075.db2.gz	HGOLFPLBVKLQHL-OAHLLOKOSA-N	1	0	262.441	4.409	20	30		CIEDRO
N#CCCCC[N@@H+]1CCC[C@H]1c1nc2ccccc2s1	ZINC000071016262	260271491	/nfs/dbraw/zinc/27/14/91/260271491.db2.gz	MKFJWQNILCZQOK-AWEZNQCLSA-N	1	0	285.416	4.127	20	30		CIEDRO
CCS[C@@H]1CCCC[C@@H]1[NH2+]C1CCC(C)(C#N)CC1	ZINC000449174416	260272483	/nfs/dbraw/zinc/27/24/83/260272483.db2.gz	HLKLONNRHNIJPH-PWUWZPNHSA-N	1	0	280.481	4.113	20	30		CIEDRO
C[C@@H]1CC(C)(C)CC[C@H]1[NH2+]C1CCC(C)(C#N)CC1	ZINC000449187413	260285443	/nfs/dbraw/zinc/28/54/43/260285443.db2.gz	QOFHHHNQYAOLLP-HCEZTOJASA-N	1	0	262.441	4.263	20	30		CIEDRO
Cc1nc(C)c([C@H](C)[NH2+][C@H](C)c2ccc(C#N)cc2)s1	ZINC000040517593	260289166	/nfs/dbraw/zinc/28/91/66/260289166.db2.gz	UEVUNMGRYKMNDD-MNOVXSKESA-N	1	0	285.416	4.043	20	30		CIEDRO
Cc1nc(C)c([C@@H](C)[NH2+][C@@H](C)c2ccc(C#N)cc2)s1	ZINC000040517590	260289650	/nfs/dbraw/zinc/28/96/50/260289650.db2.gz	UEVUNMGRYKMNDD-WDEREUQCSA-N	1	0	285.416	4.043	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@H](c1cccnc1)C1CC1	ZINC000449208020	260294707	/nfs/dbraw/zinc/29/47/07/260294707.db2.gz	OWHLXJXKBCDXDH-YOEHRIQHSA-N	1	0	258.409	4.257	20	30		CIEDRO
C=C(CC)C[NH2+][C@@H](CC(F)(F)F)c1ccccc1	ZINC000313482134	260297970	/nfs/dbraw/zinc/29/79/70/260297970.db2.gz	LVVQFTMDSZGUTP-ZDUSSCGKSA-N	1	0	257.299	4.236	20	30		CIEDRO
C=C(C)COCC[NH2+][C@H]1CCSc2ccc(Cl)cc21	ZINC000090451301	260359829	/nfs/dbraw/zinc/35/98/29/260359829.db2.gz	SMWAUCNINAYVDE-AWEZNQCLSA-N	1	0	297.851	4.059	20	30		CIEDRO
C[C@H](C[N@H+](C)CCCCC(C)(C)C#N)c1ccccc1	ZINC000409446492	260406232	/nfs/dbraw/zinc/40/62/32/260406232.db2.gz	FSQOELWYBFJVER-MRXNPFEDSA-N	1	0	272.436	4.442	20	30		CIEDRO
C[C@@H](Cc1coc2ccccc12)[NH2+]CC(C)(C)CCC#N	ZINC000449330629	260420916	/nfs/dbraw/zinc/42/09/16/260420916.db2.gz	LTPFSFFEAGMIAG-AWEZNQCLSA-N	1	0	284.403	4.283	20	30		CIEDRO
C[C@@H](CCc1ccco1)[NH2+][C@H](CCC#N)c1ccccc1	ZINC000090664566	260464870	/nfs/dbraw/zinc/46/48/70/260464870.db2.gz	UWADNPSCGUDFKY-MAUKXSAKSA-N	1	0	282.387	4.235	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@H]2CCCC[C@H]2CC(F)(F)F)c1	ZINC000449430221	260557436	/nfs/dbraw/zinc/55/74/36/260557436.db2.gz	BUUJCWLIYLOQRT-GJZGRUSLSA-N	1	0	296.336	4.159	20	30		CIEDRO
CC[C@@H]([NH2+]CCCCC#N)c1ccc(Br)cc1	ZINC000131043474	260868332	/nfs/dbraw/zinc/86/83/32/260868332.db2.gz	ZILGAROLMBYXNC-CQSZACIVSA-N	1	0	295.224	4.184	20	30		CIEDRO
C[C@H](C[NH2+]CC(C)(C)CCC#N)C1CCCCC1	ZINC000525703199	260931036	/nfs/dbraw/zinc/93/10/36/260931036.db2.gz	CETJUOYYMMVYKM-CQSZACIVSA-N	1	0	250.430	4.122	20	30		CIEDRO
C[N@H+](CCCCC(C)(C)C#N)[C@H]1CCc2ccccc2C1	ZINC000444649701	261057350	/nfs/dbraw/zinc/05/73/50/261057350.db2.gz	BCCRYRZJOHYTRJ-SFHVURJKSA-N	1	0	284.447	4.196	20	30		CIEDRO
CC(C)(CCC#N)C[N@H+](Cc1ccc(F)cc1)C1CC1	ZINC000155232293	261099384	/nfs/dbraw/zinc/09/93/84/261099384.db2.gz	AIYVPIKHUTZIEM-UHFFFAOYSA-N	1	0	274.383	4.120	20	30		CIEDRO
CC[C@@H]([NH2+]CCCCC#N)c1cc(Cl)ccc1OC	ZINC000361112618	261162546	/nfs/dbraw/zinc/16/25/46/261162546.db2.gz	ISWMLDDJARZTGA-CQSZACIVSA-N	1	0	280.799	4.083	20	30		CIEDRO
CC[C@H]([NH2+]CCCSCC#N)c1ccc(Cl)cc1	ZINC000174113650	261558467	/nfs/dbraw/zinc/55/84/67/261558467.db2.gz	XOZGGLDOLZOJTP-AWEZNQCLSA-N	1	0	282.840	4.028	20	30		CIEDRO
C=CCOc1cccc(C[NH2+]C2(c3ccccc3)CCC2)c1	ZINC000518776040	261702576	/nfs/dbraw/zinc/70/25/76/261702576.db2.gz	UUBPSMZLCFUVLL-UHFFFAOYSA-N	1	0	293.410	4.420	20	30		CIEDRO
N#CCCCC[NH2+]C1(c2cccc(C(F)(F)F)c2)CCC1	ZINC000179999164	261830571	/nfs/dbraw/zinc/83/05/71/261830571.db2.gz	STIZUDCWKHQMGS-UHFFFAOYSA-N	1	0	296.336	4.368	20	30		CIEDRO
C[C@H]([NH2+]CCCC#N)C(c1ccccc1)c1ccccc1	ZINC000184087428	262008213	/nfs/dbraw/zinc/00/82/13/262008213.db2.gz	CBLYLQMWTLIUHL-INIZCTEOSA-N	1	0	278.399	4.100	20	30		CIEDRO
Cc1cncc([C@@H](C)[NH2+][C@H](CCC#N)c2ccccc2)c1	ZINC000184419422	262019905	/nfs/dbraw/zinc/01/99/05/262019905.db2.gz	GDJAETUZTFKHCF-CRAIPNDOSA-N	1	0	279.387	4.086	20	30		CIEDRO
Cc1ccc([C@H](C)[NH2+][C@H](CCC#N)c2ccccc2)c(O)c1	ZINC000186151105	262081987	/nfs/dbraw/zinc/08/19/87/262081987.db2.gz	LBFDLNCNJHDHAI-MAUKXSAKSA-N	1	0	294.398	4.396	20	30		CIEDRO
Cc1ccc(O)c([C@@H](C)[NH2+][C@H](CCC#N)c2ccccc2)c1	ZINC000186150615	262082018	/nfs/dbraw/zinc/08/20/18/262082018.db2.gz	KAUQQMCTCDCRLL-CRAIPNDOSA-N	1	0	294.398	4.396	20	30		CIEDRO
C[C@H](c1cccc(-c2ccncc2)c1)[N@H+](C)CCCCC#N	ZINC000364037016	262111929	/nfs/dbraw/zinc/11/19/29/262111929.db2.gz	UQQKGHREYOBUMM-MRXNPFEDSA-N	1	0	293.414	4.435	20	30		CIEDRO
CC[C@H](CC#N)[NH2+]C1CC(c2ccc(C(F)(F)F)cc2)C1	ZINC000364109675	262146375	/nfs/dbraw/zinc/14/63/75/262146375.db2.gz	OERJWHRYWGZFLW-HNFVBEJKSA-N	1	0	296.336	4.233	20	30		CIEDRO
C=CCCC[NH2+][C@H](C)CCc1ccc(Cl)s1	ZINC000390175866	262146623	/nfs/dbraw/zinc/14/66/23/262146623.db2.gz	IGKPFZKUNCEBRP-LLVKDONJSA-N	1	0	257.830	4.278	20	30		CIEDRO
CC(C)[C@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)c1ccc(F)cc1	ZINC000503928438	262186791	/nfs/dbraw/zinc/18/67/91/262186791.db2.gz	SUIDJSYPUGFGFD-XYPHTWIQSA-N	1	0	274.383	4.195	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@H](C)c1cc2cccc(OC)c2o1	ZINC000393805904	262190694	/nfs/dbraw/zinc/19/06/94/262190694.db2.gz	WOUSRBZBHXAXJT-OCCSQVGLSA-N	1	0	273.376	4.447	20	30		CIEDRO
C[C@@H]([NH2+]C[C@@H]1CCC2(CCCCC2)O1)c1ccc(C#N)cc1	ZINC000319264206	262191349	/nfs/dbraw/zinc/19/13/49/262191349.db2.gz	WLBRPISCKQAJIW-QAPCUYQASA-N	1	0	298.430	4.091	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+][C@@H]2CCSc3ccc(F)cc32)C1	ZINC000192750329	262210270	/nfs/dbraw/zinc/21/02/70/262210270.db2.gz	YBXFQYCPZGEAJS-CORIIIEPSA-N	1	0	290.407	4.035	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+]C[C@H](c2ccccc2)C(F)(F)F)C1	ZINC000193310492	262220537	/nfs/dbraw/zinc/22/05/37/262220537.db2.gz	PNTGWJNGEOUXJS-AEGPPILISA-N	1	0	296.336	4.004	20	30		CIEDRO
CC[NH+](CC)Cc1ccc(N[C@H]2CCC[C@H](C#N)C2)cc1	ZINC000193339368	262220989	/nfs/dbraw/zinc/22/09/89/262220989.db2.gz	MQMSOTQJQORVAJ-WMZOPIPTSA-N	1	0	285.435	4.023	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)c1cc2ccccc2o1	ZINC000193333325	262220998	/nfs/dbraw/zinc/22/09/98/262220998.db2.gz	FURKBIWPTRZGTA-UMVBOHGHSA-N	1	0	268.360	4.166	20	30		CIEDRO
C[C@@H](C[NH2+][C@@H](C)c1ccc(C#N)cc1)c1ccccc1	ZINC000020137088	262230894	/nfs/dbraw/zinc/23/08/94/262230894.db2.gz	LHYRNDLXEGMJON-GJZGRUSLSA-N	1	0	264.372	4.013	20	30		CIEDRO
C=CCSCC[NH2+][C@H](C)c1ccc(OC(C)C)cc1	ZINC000221940227	262332799	/nfs/dbraw/zinc/33/27/99/262332799.db2.gz	CICLUMXGHXSOCH-CQSZACIVSA-N	1	0	279.449	4.044	20	30		CIEDRO
Cc1ccc([C@@H]([NH2+]Cc2cccc(C#N)c2)C2CCC2)cc1	ZINC000186987783	262332976	/nfs/dbraw/zinc/33/29/76/262332976.db2.gz	ATUBKVMUPLSHFJ-FQEVSTJZSA-N	1	0	290.410	4.498	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@H](C)c1ccsc1	ZINC000061361432	262394574	/nfs/dbraw/zinc/39/45/74/262394574.db2.gz	BJDQBXXEBXFZJE-CYBMUJFWSA-N	1	0	273.401	4.164	20	30		CIEDRO
C[C@@H](CCC#N)[NH2+][C@@H](C)c1cc(F)c(Cl)cc1Cl	ZINC000411443043	262694133	/nfs/dbraw/zinc/69/41/33/262694133.db2.gz	XHHRNDPZGALMJU-IUCAKERBSA-N	1	0	289.181	4.475	20	30		CIEDRO
N#CC1(CC[NH2+][C@H]2CCC23CCCC3)CCCCC1	ZINC000411807155	262706916	/nfs/dbraw/zinc/70/69/16/262706916.db2.gz	RIJUYQIXJSEGTL-HNNXBMFYSA-N	1	0	260.425	4.163	20	30		CIEDRO
C[C@@H]1CC[C@@H]([NH2+]CC(C)(C)CC#N)c2ccccc21	ZINC000414170942	262813436	/nfs/dbraw/zinc/81/34/36/262813436.db2.gz	UCJXERIYJQOLMW-CZUORRHYSA-N	1	0	256.393	4.154	20	30		CIEDRO
C[C@@H]([NH2+]CC(C)(C)CC#N)c1cc2c(s1)CCCC2	ZINC000414172217	262813796	/nfs/dbraw/zinc/81/37/96/262813796.db2.gz	VTKBMUBFKBLBCD-GFCCVEGCSA-N	1	0	276.449	4.217	20	30		CIEDRO
Cc1occc1C[NH2+][C@H](CCCC#N)c1ccccc1	ZINC000414451846	262928058	/nfs/dbraw/zinc/92/80/58/262928058.db2.gz	KWKZUHFGMRZHDQ-QGZVFWFLSA-N	1	0	268.360	4.113	20	30		CIEDRO
COc1ccc(C[N@H+](C)CC(C)(C)CCC#N)cc1Cl	ZINC000414544026	262989387	/nfs/dbraw/zinc/98/93/87/262989387.db2.gz	CHGDQJFMYCUDBP-UHFFFAOYSA-N	1	0	294.826	4.110	20	30		CIEDRO
C[C@H]([NH2+]CCC(C)(C)C#N)c1ccc(F)cc1Cl	ZINC000272034257	263001325	/nfs/dbraw/zinc/00/13/25/263001325.db2.gz	PUWUEUNEOQFPFA-JTQLQIEISA-N	1	0	268.763	4.070	20	30		CIEDRO
C[C@H]([NH2+]CCC(C)(C)C#N)c1ccc(-c2cccnc2)cc1	ZINC000272061410	263002082	/nfs/dbraw/zinc/00/20/82/263002082.db2.gz	WORHBEYFOTZMOY-HNNXBMFYSA-N	1	0	293.414	4.339	20	30		CIEDRO
C[C@H](c1ccc(Cl)cc1)[NH+]1CCC(C)(C#N)CC1	ZINC000272608433	263007569	/nfs/dbraw/zinc/00/75/69/263007569.db2.gz	RYYKBFIYIVZVTL-GFCCVEGCSA-N	1	0	262.784	4.027	20	30		CIEDRO
C[C@H](c1ccccc1Cl)[NH+]1CCC(C)(C#N)CC1	ZINC000272638954	263007828	/nfs/dbraw/zinc/00/78/28/263007828.db2.gz	XHPBVIIJIGABGO-GFCCVEGCSA-N	1	0	262.784	4.027	20	30		CIEDRO
Cc1cc2cc([C@H](C)[NH2+]CCCC#N)oc2cc1C	ZINC000273265416	263014695	/nfs/dbraw/zinc/01/46/95/263014695.db2.gz	NOXDFPIKNWUNEA-ZDUSSCGKSA-N	1	0	256.349	4.004	20	30		CIEDRO
C[C@@H]([NH2+]CCC(C)(C)C#N)c1nc(-c2ccccc2)cs1	ZINC000273293782	263014949	/nfs/dbraw/zinc/01/49/49/263014949.db2.gz	LOUOKBVEMZVCNZ-CYBMUJFWSA-N	1	0	299.443	4.401	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc(Cl)cc1	ZINC000274542458	263025759	/nfs/dbraw/zinc/02/57/59/263025759.db2.gz	ULRZYFUIDSGLHV-GLQYFDAESA-N	1	0	262.784	4.073	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1cccc(Cl)c1Cl	ZINC000274648437	263028442	/nfs/dbraw/zinc/02/84/42/263028442.db2.gz	SJHBKRWXHRKIIT-GARJFASQSA-N	1	0	283.202	4.336	20	30		CIEDRO
C[C@H]([NH2+]CCCC(C)(C)C#N)[C@@H]1CCC[C@@H](C)C1	ZINC000452068472	263033977	/nfs/dbraw/zinc/03/39/77/263033977.db2.gz	NCHAXEPXDVFKNQ-QLFBSQMISA-N	1	0	250.430	4.121	20	30		CIEDRO
C[C@H](C[NH+]1CCC(C)(C#N)CC1)c1cccc(Cl)c1	ZINC000276329591	263036286	/nfs/dbraw/zinc/03/62/86/263036286.db2.gz	XUHKJKZPEQUWJL-CYBMUJFWSA-N	1	0	276.811	4.069	20	30		CIEDRO
CC(C)[C@@H]1C[C@H]([NH2+][C@@H](CCC#N)c2ccccc2)CS1	ZINC000277262174	263040386	/nfs/dbraw/zinc/04/03/86/263040386.db2.gz	PBDBGWVXYPUFPI-ULQDDVLXSA-N	1	0	288.460	4.151	20	30		CIEDRO
Cc1ccc([C@H]2CCC[N@@H+]2CCCCC(C)(C)C#N)o1	ZINC000277589509	263042100	/nfs/dbraw/zinc/04/21/00/263042100.db2.gz	DEOIGFUJKUXSDH-OAHLLOKOSA-N	1	0	274.408	4.445	20	30		CIEDRO
Cc1cccnc1[C@H]([NH2+]CCCCC(C)(C)C#N)C(C)C	ZINC000277613411	263042436	/nfs/dbraw/zinc/04/24/36/263042436.db2.gz	FWRWHWFWPZFXMO-MRXNPFEDSA-N	1	0	287.451	4.397	20	30		CIEDRO
CC[C@](C)([NH2+]CCCCC(C)(C)C#N)c1nc(C)cs1	ZINC000277732911	263043075	/nfs/dbraw/zinc/04/30/75/263043075.db2.gz	OGVHQXVDURHBPN-INIZCTEOSA-N	1	0	293.480	4.386	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1ccccc1OC(F)F	ZINC000278279088	263046331	/nfs/dbraw/zinc/04/63/31/263046331.db2.gz	PUXIEYOMOUMCTL-AVGNSLFASA-N	1	0	294.345	4.021	20	30		CIEDRO
CSc1ccc([C@H](C)[NH2+]CCCC(C)(C)C#N)cc1	ZINC000281403383	263068576	/nfs/dbraw/zinc/06/85/76/263068576.db2.gz	QPQCLYISQHDGLO-ZDUSSCGKSA-N	1	0	276.449	4.389	20	30		CIEDRO
C[C@H](CCc1ccc(F)cc1)[NH2+]CC1CCC(C#N)CC1	ZINC000282237690	263075355	/nfs/dbraw/zinc/07/53/55/263075355.db2.gz	IWBFQAFFCNURGP-ODIFPOPNSA-N	1	0	288.410	4.066	20	30		CIEDRO
CC[C@@H]([NH2+]CC1CCC(C#N)CC1)c1ccc(OC)cc1	ZINC000282365142	263076057	/nfs/dbraw/zinc/07/60/57/263076057.db2.gz	PXUGLHDSTJSZED-JTTJXQCZSA-N	1	0	286.419	4.066	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc(-c2cccnc2)cc1	ZINC000282399530	263076421	/nfs/dbraw/zinc/07/64/21/263076421.db2.gz	RPWKVKXSRRZEMP-YZVOILCLSA-N	1	0	291.398	4.091	20	30		CIEDRO
N#CC1CCC(C[NH2+][C@H](c2ccc(F)cc2)C2CC2)CC1	ZINC000282460332	263076854	/nfs/dbraw/zinc/07/68/54/263076854.db2.gz	VNVPMPXRIMKJBH-JRSKDTKFSA-N	1	0	286.394	4.196	20	30		CIEDRO
C[C@H]([NH2+]CC1CCC(C#N)CC1)[C@@H]1C[C@H]1c1ccccc1	ZINC000283509180	263083097	/nfs/dbraw/zinc/08/30/97/263083097.db2.gz	ZIAIVJDIGQZOIM-XBSBRVCNSA-N	1	0	282.431	4.098	20	30		CIEDRO
CC(C)(C#N)CCCC[N@@H+]1CCC=C(c2ccco2)C1	ZINC000285292438	263091836	/nfs/dbraw/zinc/09/18/36/263091836.db2.gz	KKLBKUWIQPJNBQ-UHFFFAOYSA-N	1	0	272.392	4.089	20	30		CIEDRO
C[C@H]([NH2+]CCc1cccc(C#N)c1)c1csc(Cl)c1	ZINC000467436908	263104583	/nfs/dbraw/zinc/10/45/83/263104583.db2.gz	RLCMAGNGGDWEDQ-NSHDSACASA-N	1	0	290.819	4.166	20	30		CIEDRO
CC[C@H](c1cccc(OC)c1)[N@H+](C)CCCC(C)(C)C#N	ZINC000289451124	263110240	/nfs/dbraw/zinc/11/02/40/263110240.db2.gz	PDKVRIQVTIXKER-QGZVFWFLSA-N	1	0	288.435	4.408	20	30		CIEDRO
C[C@@H]([NH2+]CCCCC#N)c1ccc(Oc2cccnc2)cc1	ZINC000289577975	263110845	/nfs/dbraw/zinc/11/08/45/263110845.db2.gz	YWFRXOALTVSGIG-OAHLLOKOSA-N	1	0	295.386	4.218	20	30		CIEDRO
CCCCCCC[C@H](C)[NH2+]Cc1nccc(C(F)F)n1	ZINC000290286780	263116010	/nfs/dbraw/zinc/11/60/10/263116010.db2.gz	ZRGCFOFJORHSSY-LBPRGKRZSA-N	1	0	285.382	4.253	20	30		CIEDRO
C[C@@H]1c2ccc(Cl)n2CC[N@H+]1CCCCC(C)(C)C#N	ZINC000293146968	263138350	/nfs/dbraw/zinc/13/83/50/263138350.db2.gz	MFOVYXPBLQYJMK-CYBMUJFWSA-N	1	0	293.842	4.238	20	30		CIEDRO
N#CCCC[C@H]([NH2+][C@H]1CC[C@@H]1C1CC1)c1ccccc1	ZINC000340428871	263141941	/nfs/dbraw/zinc/14/19/41/263141941.db2.gz	BFYAEFWWSHRLEF-SQNIBIBYSA-N	1	0	268.404	4.200	20	30		CIEDRO
C[C@H]([NH2+][C@@H](CCCC#N)c1ccccc1)[C@H]1CC1(C)C	ZINC000340439017	263148218	/nfs/dbraw/zinc/14/82/18/263148218.db2.gz	BGCQBSZIUNOBIZ-UAGQMJEPSA-N	1	0	270.420	4.446	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@@H](CCCC#N)c1ccccc1	ZINC000340447917	263154136	/nfs/dbraw/zinc/15/41/36/263154136.db2.gz	HQLVCMFNHHIILX-RDJZCZTQSA-N	1	0	256.393	4.366	20	30		CIEDRO
N#CCCC[C@H]([NH2+]C1CCCCC1)c1ccccc1	ZINC000340447910	263154179	/nfs/dbraw/zinc/15/41/79/263154179.db2.gz	HOZAINNCRSFUHW-KRWDZBQOSA-N	1	0	256.393	4.344	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+][C@H](CCCC#N)c1ccccc1	ZINC000340447916	263154268	/nfs/dbraw/zinc/15/42/68/263154268.db2.gz	HQLVCMFNHHIILX-NVXWUHKLSA-N	1	0	256.393	4.366	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@H](CCCC#N)c1ccccc1	ZINC000340447915	263154395	/nfs/dbraw/zinc/15/43/95/263154395.db2.gz	HQLVCMFNHHIILX-DOTOQJQBSA-N	1	0	256.393	4.366	20	30		CIEDRO
C[C@H]([NH2+][C@@H](CCCC#N)c1ccccc1)c1cccc(O)c1	ZINC000340450406	263155133	/nfs/dbraw/zinc/15/51/33/263155133.db2.gz	YGIZFUCNYGBTHP-KXBFYZLASA-N	1	0	294.398	4.478	20	30		CIEDRO
C[C@H]([NH2+][C@H](CCCC#N)c1ccccc1)c1cccc(O)c1	ZINC000340450405	263155136	/nfs/dbraw/zinc/15/51/36/263155136.db2.gz	YGIZFUCNYGBTHP-HNAYVOBHSA-N	1	0	294.398	4.478	20	30		CIEDRO
C[C@H]([NH2+][C@H](CCCC#N)c1ccccc1)c1ccncc1F	ZINC000340449715	263155675	/nfs/dbraw/zinc/15/56/75/263155675.db2.gz	WBRUCBMCUPGSCF-KBXCAEBGSA-N	1	0	297.377	4.306	20	30		CIEDRO
C[C@H]([NH2+][C@H](CCCC#N)c1ccccc1)c1ccncc1	ZINC000340451647	263155849	/nfs/dbraw/zinc/15/58/49/263155849.db2.gz	OPZWSMDKUIFMQW-MAUKXSAKSA-N	1	0	279.387	4.167	20	30		CIEDRO
C[C@@H]([NH2+][C@H](CCCC#N)c1ccccc1)c1ccncc1	ZINC000340451636	263156058	/nfs/dbraw/zinc/15/60/58/263156058.db2.gz	OPZWSMDKUIFMQW-CRAIPNDOSA-N	1	0	279.387	4.167	20	30		CIEDRO
CSc1ccc([C@@H](C)[NH2+][C@H]2CC[C@@H](CC#N)C2)cc1F	ZINC000294929520	263169451	/nfs/dbraw/zinc/16/94/51/263169451.db2.gz	BNPJOXJVUIITLC-DYEKYZERSA-N	1	0	292.423	4.281	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+]Cc2ccc(Oc3ccccc3)o2)C1	ZINC000294964909	263170317	/nfs/dbraw/zinc/17/03/17/263170317.db2.gz	FGLVRAFZPKEXPC-GJZGRUSLSA-N	1	0	296.370	4.244	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@H]2CC[C@@H](Cc3ccccc3)C2)C1	ZINC000295017021	263170732	/nfs/dbraw/zinc/17/07/32/263170732.db2.gz	KEBLHHUOUYOKGK-VJANTYMQSA-N	1	0	282.431	4.070	20	30		CIEDRO
C[C@H](CC(C)(C)c1ccccc1)[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000295116645	263172703	/nfs/dbraw/zinc/17/27/03/263172703.db2.gz	VYUJDXMGCOZNRF-RYRKJORJSA-N	1	0	284.447	4.415	20	30		CIEDRO
Cc1ccc2c(c1)[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)CCC2	ZINC000296325794	263190180	/nfs/dbraw/zinc/19/01/80/263190180.db2.gz	HBJBVWCQZQBZMF-ZVZYQTTQSA-N	1	0	268.404	4.044	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@H]2CCCc3c4ccccc4[nH]c32)C1	ZINC000296355380	263190377	/nfs/dbraw/zinc/19/03/77/263190377.db2.gz	IMCMOGXQPGSQNO-DEYYWGMASA-N	1	0	293.414	4.217	20	30		CIEDRO
CSc1ccc([C@@H](C)[NH2+][C@H]2CC[C@@H](CC#N)C2)cc1	ZINC000296411681	263191117	/nfs/dbraw/zinc/19/11/17/263191117.db2.gz	KXCSFOWYNDKILO-IPYPFGDCSA-N	1	0	274.433	4.141	20	30		CIEDRO
Cc1cccc2c1[C@@H](C)C[C@H]2[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000296530951	263192301	/nfs/dbraw/zinc/19/23/01/263192301.db2.gz	QKTGXQHPXVCXIP-QBYUYEEZSA-N	1	0	268.404	4.215	20	30		CIEDRO
C[C@@H](c1ccc(C[NH+]2CCC(C#N)CC2)cc1)C(F)(F)F	ZINC000297058410	263200461	/nfs/dbraw/zinc/20/04/61/263200461.db2.gz	IVANHLHLEKPVPK-LBPRGKRZSA-N	1	0	296.336	4.088	20	30		CIEDRO
C[C@@H](CCC#N)[NH2+][C@@H](C)c1cc2ccccc2s1	ZINC000298945806	263227667	/nfs/dbraw/zinc/22/76/67/263227667.db2.gz	OKAUDGTVVZOWAR-RYUDHWBXSA-N	1	0	258.390	4.244	20	30		CIEDRO
CC[C@H]([NH2+][C@@H](C)CCC#N)c1ccc(Cl)cc1	ZINC000299690039	263252299	/nfs/dbraw/zinc/25/22/99/263252299.db2.gz	NUFOYGWNCJXOOK-FZMZJTMJSA-N	1	0	250.773	4.073	20	30		CIEDRO
C[C@@H]([NH2+]CCCC#N)c1ccccc1Oc1ccccc1	ZINC000341642781	263345772	/nfs/dbraw/zinc/34/57/72/263345772.db2.gz	PJGYPYMCXSHBLS-OAHLLOKOSA-N	1	0	280.371	4.433	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCOC(C)(C)C)c1ccccc1	ZINC000341934218	263367410	/nfs/dbraw/zinc/36/74/10/263367410.db2.gz	WWDMTPRRJLSKML-MRXNPFEDSA-N	1	0	261.409	4.099	20	30		CIEDRO
C[C@@H](CCC(F)(F)F)[NH2+][C@@H]1CCCc2cc(C#N)ccc21	ZINC000417372122	263892439	/nfs/dbraw/zinc/89/24/39/263892439.db2.gz	VQSZRANSBRNBKP-XHDPSFHLSA-N	1	0	296.336	4.256	20	30		CIEDRO
Cc1sccc1C[N@@H+](C)[C@@H](C)c1cccc(C#N)c1	ZINC000425368893	264213216	/nfs/dbraw/zinc/21/32/16/264213216.db2.gz	YEEJLUNYABADET-LBPRGKRZSA-N	1	0	270.401	4.121	20	30		CIEDRO
CC[N@H+](Cc1ccc(OC)cc1)[C@@H](C)c1cccc(C#N)c1	ZINC000189792363	264326322	/nfs/dbraw/zinc/32/63/22/264326322.db2.gz	KMRLHINHIABTPB-HNNXBMFYSA-N	1	0	294.398	4.150	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1nccn1C(C)C)c1ccccc1	ZINC000180042335	264394634	/nfs/dbraw/zinc/39/46/34/264394634.db2.gz	PHQOHPXACGWYGV-QGZVFWFLSA-N	1	0	283.419	4.261	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](C)c1ccc(SC)c(OC)c1	ZINC000180953227	264430684	/nfs/dbraw/zinc/43/06/84/264430684.db2.gz	MADOLFAAJGTLNE-VXGBXAGGSA-N	1	0	265.422	4.032	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+]C[C@@H]1CCO[C@H]1c1ccccc1	ZINC000191858601	264530430	/nfs/dbraw/zinc/53/04/30/264530430.db2.gz	KWIRBSOFXFPZNK-KSZLIROESA-N	1	0	273.420	4.099	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCC[C@H]1CCCCO1)c1ccco1	ZINC000286137705	264576208	/nfs/dbraw/zinc/57/62/08/264576208.db2.gz	OHBXCRDPDUHRIE-HZPDHXFCSA-N	1	0	277.408	4.226	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+]CCCc2ccc(Cl)cc2Cl)C1	ZINC000442790530	264983934	/nfs/dbraw/zinc/98/39/34/264983934.db2.gz	LRDSKRXUMMJSBK-RISCZKNCSA-N	1	0	297.229	4.208	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1CC2(CCC2)Oc2ccccc21	ZINC000344882352	265068912	/nfs/dbraw/zinc/06/89/12/265068912.db2.gz	KHUZAYSVQHYGCX-MRXNPFEDSA-N	1	0	298.430	4.352	20	30		CIEDRO
CCC[C@@H]([NH2+]Cc1cc(C#N)cs1)c1ccccc1	ZINC000093492147	265181792	/nfs/dbraw/zinc/18/17/92/265181792.db2.gz	VGOLXXIISCDWDF-MRXNPFEDSA-N	1	0	270.401	4.251	20	30		CIEDRO
CC[C@H]([NH2+]Cc1cc(C#N)cs1)c1ccc(C)cc1	ZINC000093492101	265182315	/nfs/dbraw/zinc/18/23/15/265182315.db2.gz	XTFGIGXYHBIGGH-INIZCTEOSA-N	1	0	270.401	4.169	20	30		CIEDRO
C[C@H]([NH2+]Cc1cc(C#N)cs1)c1ccccc1Cl	ZINC000093492054	265182342	/nfs/dbraw/zinc/18/23/42/265182342.db2.gz	DQMOHPFWKYUODG-JTQLQIEISA-N	1	0	276.792	4.124	20	30		CIEDRO
CCCC1CCC([NH2+]Cc2cc(C#N)cs2)CC1	ZINC000093492529	265184035	/nfs/dbraw/zinc/18/40/35/265184035.db2.gz	YRARYOBWTXVCHM-UHFFFAOYSA-N	1	0	262.422	4.068	20	30		CIEDRO
C[C@H]([NH2+][C@@H](C)c1cc(F)cc(F)c1)c1ccc(C#N)cc1	ZINC000094826631	265260392	/nfs/dbraw/zinc/26/03/92/265260392.db2.gz	UWPSVYJJPKRBSJ-RYUDHWBXSA-N	1	0	286.325	4.248	20	30		CIEDRO
C[N@H+](CCCC(C)(C)C#N)C1CCC(C)(C)CC1	ZINC000094859597	265266401	/nfs/dbraw/zinc/26/64/01/265266401.db2.gz	ZEDDLYIQDLYHLI-UHFFFAOYSA-N	1	0	250.430	4.217	20	30		CIEDRO
C[C@H](CC(C)(C)c1ccccc1)[NH2+]Cc1cccc(C#N)c1	ZINC000314768708	266014131	/nfs/dbraw/zinc/01/41/31/266014131.db2.gz	WOAGQNFQFUGFRZ-MRXNPFEDSA-N	1	0	292.426	4.404	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H](C)[C@H]1CCCOC1)c1ccccc1	ZINC000356854189	266190970	/nfs/dbraw/zinc/19/09/70/266190970.db2.gz	TYHNGCFAEZCOTK-SZMVWBNQSA-N	1	0	273.420	4.099	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@H](C)[C@H]1CCCOC1)c1ccccc1	ZINC000356854185	266191567	/nfs/dbraw/zinc/19/15/67/266191567.db2.gz	TYHNGCFAEZCOTK-NJAFHUGGSA-N	1	0	273.420	4.099	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](CC)c1ccc(OCC)c(OCC)c1	ZINC000358042565	266404672	/nfs/dbraw/zinc/40/46/72/266404672.db2.gz	VJGJUUJZGNPDGF-GOEBONIOSA-N	1	0	291.435	4.489	20	30		CIEDRO
C[C@H]1C[C@H]([NH2+][C@H](CCC#N)c2ccccc2)C[C@@H](C)C1	ZINC000358338235	266454426	/nfs/dbraw/zinc/45/44/26/266454426.db2.gz	GQTWBOVARUZDCO-MXSMSXNCSA-N	1	0	270.420	4.446	20	30		CIEDRO
CSCCCC[NH2+][C@@H]1CCCCc2cc(C#N)ccc21	ZINC000360648773	266730642	/nfs/dbraw/zinc/73/06/42/266730642.db2.gz	SKGIGJOBSXWZST-QGZVFWFLSA-N	1	0	288.460	4.059	20	30		CIEDRO
CC1(C)CC[C@H]([NH2+][C@H]2CC[C@H](C#N)C2)c2ccccc21	ZINC000360883435	266751559	/nfs/dbraw/zinc/75/15/59/266751559.db2.gz	KAUYAACJDUXGDA-ZQIUZPCESA-N	1	0	268.404	4.081	20	30		CIEDRO
N#CCCC[N@H+]1CCC[C@H]1c1ccccc1C(F)(F)F	ZINC000362940564	267064341	/nfs/dbraw/zinc/06/43/41/267064341.db2.gz	GIZHRDBWRPUGRR-AWEZNQCLSA-N	1	0	282.309	4.146	20	30		CIEDRO
C=CCCC[N@@H+](C)[C@@H](C)c1nnc(-c2cccc(C)c2)o1	ZINC000369478746	267245493	/nfs/dbraw/zinc/24/54/93/267245493.db2.gz	LYCJTSRSXZUPSZ-AWEZNQCLSA-N	1	0	285.391	4.004	20	30		CIEDRO
N#CCC[C@@H]([NH2+]C1CCC2(CCCO2)CC1)c1ccccc1	ZINC000370014862	267284360	/nfs/dbraw/zinc/28/43/60/267284360.db2.gz	ZZJBEECQFRHIGG-JLAWEPINSA-N	1	0	298.430	4.113	20	30		CIEDRO
Cc1ccc(C2CC[NH+](CCCCC(C)(C)C#N)CC2)cn1	ZINC000370497140	267323621	/nfs/dbraw/zinc/32/36/21/267323621.db2.gz	ASBSQJNCGPBEFV-UHFFFAOYSA-N	1	0	299.462	4.290	20	30		CIEDRO
C[C@H]([NH2+]CC1(C#N)CCC1)[C@H](C)c1nc2ccccc2s1	ZINC000418141390	267363568	/nfs/dbraw/zinc/36/35/68/267363568.db2.gz	KZFYWQSIZHMHKD-STQMWFEESA-N	1	0	299.443	4.072	20	30		CIEDRO
C[C@@H]([NH2+]CC1(C#N)CCC1)[C@@H](C)c1ccc(Cl)cc1	ZINC000418143550	267365124	/nfs/dbraw/zinc/36/51/24/267365124.db2.gz	QGAGSTNJBIWAKD-CHWSQXEVSA-N	1	0	276.811	4.115	20	30		CIEDRO
C[C@@H]([NH2+]CC1(C#N)CCC1)[C@H](C)c1ccc(Cl)cc1	ZINC000418143552	267365766	/nfs/dbraw/zinc/36/57/66/267365766.db2.gz	QGAGSTNJBIWAKD-QWHCGFSZSA-N	1	0	276.811	4.115	20	30		CIEDRO
N#CCCCC[NH2+][C@H]1CCCC[C@H](c2ccccc2)C1	ZINC000371367695	267396375	/nfs/dbraw/zinc/39/63/75/267396375.db2.gz	BIFGBLDPAKYBTP-ROUUACIJSA-N	1	0	270.420	4.386	20	30		CIEDRO
CC[N@H+](CCCC#N)[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000123296573	268022189	/nfs/dbraw/zinc/02/21/89/268022189.db2.gz	HORSGXUUMQSENP-LBPRGKRZSA-N	1	0	284.325	4.392	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCc2ccc(C#N)cc21)c1ccc(F)cc1F	ZINC000570862377	327628398	/nfs/dbraw/zinc/62/83/98/327628398.db2.gz	NFODLCGNSLSAMI-VOJFVSQTSA-N	1	0	298.336	4.175	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+]CC#Cc1ccc(C(F)(F)F)cc1	ZINC000537985311	327810873	/nfs/dbraw/zinc/81/08/73/327810873.db2.gz	ZCMQUUFTBZWVHP-KBPBESRZSA-N	1	0	295.348	4.247	20	30		CIEDRO
C[C@@H]([NH2+]C[C@@H]1CCCC1(C)C)c1ccc(C#N)cc1	ZINC000389071724	328610504	/nfs/dbraw/zinc/61/05/04/328610504.db2.gz	WPEGGPKUTPMNES-CJNGLKHVSA-N	1	0	256.393	4.035	20	30		CIEDRO
N#Cc1cccc(C2([NH2+]Cc3cccc(C(F)F)c3)CC2)c1	ZINC000582077462	327834432	/nfs/dbraw/zinc/83/44/32/327834432.db2.gz	JEWUKZPJJSKJJQ-UHFFFAOYSA-N	1	0	298.336	4.275	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@H]1C[C@H](c2ccc(OC)c(F)c2)C1	ZINC000503885638	327869870	/nfs/dbraw/zinc/86/98/70/327869870.db2.gz	LVFPMSSMPWBSEA-QEJZJMRPSA-N	1	0	277.383	4.025	20	30		CIEDRO
C=CCC[NH2+][C@@H](CC(F)(F)F)c1ccccc1C	ZINC000338543776	327983771	/nfs/dbraw/zinc/98/37/71/327983771.db2.gz	SAJYMCBMCCAILQ-ZDUSSCGKSA-N	1	0	257.299	4.154	20	30		CIEDRO
C=C(C[NH2+]Cc1cccc(Cl)c1)c1ccccc1	ZINC000110057676	328031259	/nfs/dbraw/zinc/03/12/59/328031259.db2.gz	SCMVJEKYQJNJNZ-UHFFFAOYSA-N	1	0	257.764	4.143	20	30		CIEDRO
CC(C)(C#N)c1ccccc1C[N@H+](C1CC1)C1CCCC1	ZINC000531757287	328032072	/nfs/dbraw/zinc/03/20/72/328032072.db2.gz	TYPBEJKXGKNAJW-UHFFFAOYSA-N	1	0	282.431	4.395	20	30		CIEDRO
C[C@@H]([N@H+](C)Cc1cccc(OCCCC#N)c1)C(C)(C)C	ZINC000534349886	328047536	/nfs/dbraw/zinc/04/75/36/328047536.db2.gz	OLWQZCWTWYYWKA-OAHLLOKOSA-N	1	0	288.435	4.236	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccc(OC(F)F)c(F)c1)C1CC1	ZINC000563461519	328068047	/nfs/dbraw/zinc/06/80/47/328068047.db2.gz	BUFPAEATVWBBHD-AWEZNQCLSA-N	1	0	299.336	4.262	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccc(OC(F)F)c(F)c1)C1CC1	ZINC000563461520	328068131	/nfs/dbraw/zinc/06/81/31/328068131.db2.gz	BUFPAEATVWBBHD-CQSZACIVSA-N	1	0	299.336	4.262	20	30		CIEDRO
CC(C)(C#N)CCC[NH2+]C1(c2ccc(Cl)cc2)CC1	ZINC000563524832	328071426	/nfs/dbraw/zinc/07/14/26/328071426.db2.gz	ISBZZCNBKGYPRC-UHFFFAOYSA-N	1	0	276.811	4.249	20	30		CIEDRO
N#Cc1ccc2c(c1)[C@@H]([NH2+][C@H](c1cccs1)C1CC1)CC2	ZINC000571092123	328084892	/nfs/dbraw/zinc/08/48/92/328084892.db2.gz	ITNARYXSZQOKRM-WMZOPIPTSA-N	1	0	294.423	4.348	20	30		CIEDRO
N#Cc1csc(C[NH2+]Cc2cc3ccccc3s2)c1	ZINC000571183609	328091165	/nfs/dbraw/zinc/09/11/65/328091165.db2.gz	UBCSWKQGAJUZJN-UHFFFAOYSA-N	1	0	284.409	4.124	20	30		CIEDRO
C[C@H](CCC#N)[N@@H+]1CC[C@@H](Sc2cccc(Cl)c2)C1	ZINC000411757365	328098656	/nfs/dbraw/zinc/09/86/56/328098656.db2.gz	LXDOMWHBEVBCDP-IUODEOHRSA-N	1	0	294.851	4.199	20	30		CIEDRO
C=CCOc1ccc(C[N@@H+](C)[C@@H](CC)c2ccncc2)cc1	ZINC000571366326	328116800	/nfs/dbraw/zinc/11/68/00/328116800.db2.gz	XSSKYROFMYZWSV-IBGZPJMESA-N	1	0	296.414	4.230	20	30		CIEDRO
Cc1ccc(C)n1C1CC[NH+](CCCC(C)(C)C#N)CC1	ZINC000266900395	328170202	/nfs/dbraw/zinc/17/02/02/328170202.db2.gz	IDFHFTDTZQKEQY-UHFFFAOYSA-N	1	0	287.451	4.072	20	30		CIEDRO
Cc1ccccc1[C@H]([NH2+]Cc1ccccc1C#N)C1CC1	ZINC000270130934	328192178	/nfs/dbraw/zinc/19/21/78/328192178.db2.gz	PONSJKIVZGTDQW-LJQANCHMSA-N	1	0	276.383	4.108	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCOC2(CCCCC2)C1)c1cccc(C#N)c1	ZINC000271862159	328198407	/nfs/dbraw/zinc/19/84/07/328198407.db2.gz	KPKVWGTUPHYBGM-MAUKXSAKSA-N	1	0	298.430	4.091	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCOC2(CCCCC2)C1)c1cccc(C#N)c1	ZINC000271862157	328198415	/nfs/dbraw/zinc/19/84/15/328198415.db2.gz	KPKVWGTUPHYBGM-CRAIPNDOSA-N	1	0	298.430	4.091	20	30		CIEDRO
CCC(CC)C[N@H+](CCC#N)Cc1cccc2cccnc21	ZINC000353420906	328212910	/nfs/dbraw/zinc/21/29/10/328212910.db2.gz	ICRDNXDRQFKRGX-UHFFFAOYSA-N	1	0	295.430	4.387	20	30		CIEDRO
C[C@@H](CCC#N)[NH2+]C(c1ccccc1)c1ccccc1	ZINC000276350283	328217964	/nfs/dbraw/zinc/21/79/64/328217964.db2.gz	WCOFIGWKQCFQEB-HNNXBMFYSA-N	1	0	264.372	4.058	20	30		CIEDRO
N#CC1CCC(C[NH2+]Cc2cccc(C(F)(F)F)c2)CC1	ZINC000281619627	328240749	/nfs/dbraw/zinc/24/07/49/328240749.db2.gz	HJQOWCLFZLMJQI-UHFFFAOYSA-N	1	0	296.336	4.125	20	30		CIEDRO
CC[C@H]([NH2+]CC1CCC(C#N)CC1)c1cccc(F)c1	ZINC000282507626	328242483	/nfs/dbraw/zinc/24/24/83/328242483.db2.gz	YPAOPRJVHYVAEJ-KVULBXGLSA-N	1	0	274.383	4.196	20	30		CIEDRO
C[C@@H]1C[C@H]([NH2+][C@H](CCCC#N)c2ccccc2)[C@H]1C	ZINC000340440029	328277734	/nfs/dbraw/zinc/27/77/34/328277734.db2.gz	CCHOWIPHERZDMG-WTTBNOFXSA-N	1	0	256.393	4.056	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+]Cc2ccc(Cl)cc2Cl)C1	ZINC000295053422	328284479	/nfs/dbraw/zinc/28/44/79/328284479.db2.gz	NOTUDUIROJLXBH-GWCFXTLKSA-N	1	0	283.202	4.165	20	30		CIEDRO
CCC[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccsc1	ZINC000296450599	328290584	/nfs/dbraw/zinc/29/05/84/328290584.db2.gz	MSNSXADLRJOFBN-AEGPPILISA-N	1	0	262.422	4.261	20	30		CIEDRO
CCS[C@H]1CCCC[N@@H+]([C@H](C)c2ccc(C#N)cc2)C1	ZINC000303694615	328357680	/nfs/dbraw/zinc/35/76/80/328357680.db2.gz	MYFJXTYNBZWUKU-PBHICJAKSA-N	1	0	288.460	4.227	20	30		CIEDRO
C[C@@H]1CC[N@H+](Cc2ccc(C#N)s2)[C@H]2CCCC[C@H]12	ZINC000535072814	328384427	/nfs/dbraw/zinc/38/44/27/328384427.db2.gz	WIJQSGMEVSMVOS-WQVCFCJDSA-N	1	0	274.433	4.020	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@H](CC)c1ccccc1	ZINC000050198469	328391601	/nfs/dbraw/zinc/39/16/01/328391601.db2.gz	FXXMBWHPPHVGEM-GOSISDBHSA-N	1	0	281.399	4.492	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+]Cc1ccc(Cl)s1	ZINC000070211811	328456791	/nfs/dbraw/zinc/45/67/91/328456791.db2.gz	LBCCLDZEIHQOOI-UHFFFAOYSA-N	1	0	293.819	4.256	20	30		CIEDRO
COc1ccc([C@@H](CCC#N)[NH2+]CCCC(C)(C)C)cc1	ZINC000582158977	328579942	/nfs/dbraw/zinc/57/99/42/328579942.db2.gz	VELHNUDGCGKIPI-QGZVFWFLSA-N	1	0	288.435	4.456	20	30		CIEDRO
C[C@@H]1CC(C)(C)CC[C@H]1[NH2+]CC(C)(C)CCC#N	ZINC000582199143	328629686	/nfs/dbraw/zinc/62/96/86/328629686.db2.gz	LBDSABSYDMKKLM-ZIAGYGMSSA-N	1	0	250.430	4.121	20	30		CIEDRO
CC[C@H]1CCCC[C@H]1C[NH2+]CC(C)(C)CCC#N	ZINC000449404471	330922927	/nfs/dbraw/zinc/92/29/27/330922927.db2.gz	CBLFUSMKHNIWCI-GJZGRUSLSA-N	1	0	250.430	4.122	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCc1ccccc1)c1ccco1	ZINC000530506038	326820745	/nfs/dbraw/zinc/82/07/45/326820745.db2.gz	ZFEYKPIOWTVUQK-MRXNPFEDSA-N	1	0	255.361	4.119	20	30		CIEDRO
CCCC[N@H+](Cc1nc(C#N)cs1)[C@H]1CCC[C@H](C)C1	ZINC000557395631	327004452	/nfs/dbraw/zinc/00/44/52/327004452.db2.gz	PBDJHNRSDYUYFK-ZFWWWQNUSA-N	1	0	291.464	4.196	20	30		CIEDRO
Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(CC#N)cc1)CCC2	ZINC000565832883	327031035	/nfs/dbraw/zinc/03/10/35/327031035.db2.gz	DODVCZKODISRQN-FQEVSTJZSA-N	1	0	290.410	4.228	20	30		CIEDRO
C[C@@H]1C[C@@H](c2ccccc2)CC[N@@H+]1CCC(C)(C)C#N	ZINC000558108421	327074084	/nfs/dbraw/zinc/07/40/84/327074084.db2.gz	XSQGLRLMBFVLOY-WBVHZDCISA-N	1	0	270.420	4.194	20	30		CIEDRO
C[C@H]([NH2+]CCC1(F)CCC1)c1ccc(C#N)cc1Cl	ZINC000558259206	327082952	/nfs/dbraw/zinc/08/29/52/327082952.db2.gz	QAQYHWIQCGINMU-NSHDSACASA-N	1	0	280.774	4.145	20	30		CIEDRO
N#CCc1ccc(C[NH2+][C@H]2CCCc3cc(F)ccc32)cc1	ZINC000569339339	327097148	/nfs/dbraw/zinc/09/71/48/327097148.db2.gz	DBUOBUMYWOOJNQ-IBGZPJMESA-N	1	0	294.373	4.059	20	30		CIEDRO
CC[C@@H]1[C@@H](C)CC[N@@H+]1Cc1ccc(C#N)cc1C(F)(F)F	ZINC000558575875	327106599	/nfs/dbraw/zinc/10/65/99/327106599.db2.gz	ZSDRHIXTIWCNCD-XHDPSFHLSA-N	1	0	296.336	4.197	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@@H](C#N)C1)c1cc(Cl)ccc1Cl	ZINC000559154887	327143737	/nfs/dbraw/zinc/14/37/37/327143737.db2.gz	IJUWYGBFBJITCX-FOGDFJRCSA-N	1	0	283.202	4.336	20	30		CIEDRO
CC(C)(C)c1ccc(C[NH2+]Cc2ccc(CC#N)cc2)s1	ZINC000518374031	327156121	/nfs/dbraw/zinc/15/61/21/327156121.db2.gz	ODPVFLRVCSZETB-UHFFFAOYSA-N	1	0	298.455	4.401	20	30		CIEDRO
C[C@H](c1cccc(C#N)c1)[N@@H+]1CC[C@@H](c2ccccc2F)C1	ZINC000559299584	327156319	/nfs/dbraw/zinc/15/63/19/327156319.db2.gz	FJVGZRNLBPUOGX-RHSMWYFYSA-N	1	0	294.373	4.248	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]Cc1ccc(C)cc1-c1cnn(C)c1	ZINC000559306023	327157197	/nfs/dbraw/zinc/15/71/97/327157197.db2.gz	DEGGVQRHRAJARQ-UHFFFAOYSA-N	1	0	297.446	4.087	20	30		CIEDRO
CC[C@@H]([NH2+]CCCCC#N)c1ccc(Cl)cc1	ZINC000102396810	327226830	/nfs/dbraw/zinc/22/68/30/327226830.db2.gz	HSPUIJQUBBVZPS-CQSZACIVSA-N	1	0	250.773	4.075	20	30		CIEDRO
C[C@H]1c2c(F)cccc2CC[N@H+]1CCCC(C)(C)C#N	ZINC000531101215	327246713	/nfs/dbraw/zinc/24/67/13/327246713.db2.gz	XDSXIKQDRPCFTI-ZDUSSCGKSA-N	1	0	274.383	4.075	20	30		CIEDRO
CCC[C@@H]1CCCC[C@@H]1[NH2+]C1CCC(C)(C#N)CC1	ZINC000577458833	327260836	/nfs/dbraw/zinc/26/08/36/327260836.db2.gz	AZHQQEJGAARZGX-GYXIZQIFSA-N	1	0	262.441	4.407	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+]Cc1ccc(OC(F)F)c(F)c1	ZINC000573821757	327261608	/nfs/dbraw/zinc/26/16/08/327261608.db2.gz	APLUSVWDXGLTCO-WDEREUQCSA-N	1	0	287.325	4.117	20	30		CIEDRO
CC[C@@H]1CCC[C@H]([NH2+][C@H]2CCc3ccc(C#N)cc32)C1	ZINC000573848404	327263619	/nfs/dbraw/zinc/26/36/19/327263619.db2.gz	QLSGCWGEDKKXGN-SKDZVZGDSA-N	1	0	268.404	4.104	20	30		CIEDRO
C[C@H]([NH2+]Cc1coc2ccccc12)c1ccc(C#N)c(F)c1	ZINC000559859679	327265589	/nfs/dbraw/zinc/26/55/89/327265589.db2.gz	CUAJNCPEFFGXAS-LBPRGKRZSA-N	1	0	294.329	4.294	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH2+]CC[C@@H](c2ccccc2)C(F)(F)F)C1	ZINC000559877387	327267056	/nfs/dbraw/zinc/26/70/56/327267056.db2.gz	LBSMWPOFICUYTG-YUELXQCFSA-N	1	0	296.336	4.004	20	30		CIEDRO
C=CCCC[N@@H+](C)[C@H](C)c1ncc(-c2ccccc2)o1	ZINC000152579070	327277948	/nfs/dbraw/zinc/27/79/48/327277948.db2.gz	NLUIRVWVMCPGCS-CQSZACIVSA-N	1	0	270.376	4.301	20	30		CIEDRO
C[C@H](c1ccc(C#N)cc1)[N@@H+]1CCC=C(c2ccccc2)C1	ZINC000560170889	327288429	/nfs/dbraw/zinc/28/84/29/327288429.db2.gz	BSIRGKMJCLLZCC-MRXNPFEDSA-N	1	0	288.394	4.409	20	30		CIEDRO
CC(C)([NH2+]Cc1ccc(CC#N)cc1)c1ccc(Cl)cc1	ZINC000560181803	327288780	/nfs/dbraw/zinc/28/87/80/327288780.db2.gz	JYVIBRVBINDLNH-UHFFFAOYSA-N	1	0	298.817	4.431	20	30		CIEDRO
CC[C@H]([NH2+]C1(c2cccc(C#N)c2)CC1)c1cccs1	ZINC000560259147	327294276	/nfs/dbraw/zinc/29/42/76/327294276.db2.gz	PCSARLGFZSEUHY-HNNXBMFYSA-N	1	0	282.412	4.350	20	30		CIEDRO
C=C(C)CN1CCC([NH2+][C@@H](C)c2cc(C)sc2C)CC1	ZINC000152950410	327301236	/nfs/dbraw/zinc/30/12/36/327301236.db2.gz	KZSUGZFCPGMGGM-AWEZNQCLSA-N	1	0	292.492	4.056	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@H](C)Oc1ccccc1)c1ccco1	ZINC000560546694	327322852	/nfs/dbraw/zinc/32/28/52/327322852.db2.gz	WAYKJEJLTWWAJX-DOTOQJQBSA-N	1	0	285.387	4.344	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H](C)CCC(F)(F)F)cc1	ZINC000560575161	327326928	/nfs/dbraw/zinc/32/69/28/327326928.db2.gz	VLRDBHQWMQGNQO-GFCCVEGCSA-N	1	0	287.325	4.072	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+]Cc1cccc2cc[nH]c21	ZINC000560924359	327352481	/nfs/dbraw/zinc/35/24/81/327352481.db2.gz	JFJWKHVCYJHAED-CQSZACIVSA-N	1	0	256.393	4.392	20	30		CIEDRO
C=CCCCC[N@@H+]1CCCC[C@H]1c1nnc(C2CCC2)o1	ZINC000583422354	327356573	/nfs/dbraw/zinc/35/65/73/327356573.db2.gz	WUGDIVYGWBWJGM-HNNXBMFYSA-N	1	0	289.423	4.220	20	30		CIEDRO
CCCc1ccc([C@@H](C)[NH2+]Cc2ccc(C#N)s2)cc1	ZINC000561437575	327395014	/nfs/dbraw/zinc/39/50/14/327395014.db2.gz	LVLKPOAEYDWWDF-CYBMUJFWSA-N	1	0	284.428	4.423	20	30		CIEDRO
C[C@H]([NH2+]CCCc1cccc(Cl)c1)c1ccc(C#N)cc1	ZINC000561480911	327398516	/nfs/dbraw/zinc/39/85/16/327398516.db2.gz	RRQVFVJZCRGXLN-AWEZNQCLSA-N	1	0	298.817	4.495	20	30		CIEDRO
C[C@@H](CCc1ccc(F)cc1)[NH2+]CC(C)(C)CCC#N	ZINC000562047719	327442426	/nfs/dbraw/zinc/44/24/26/327442426.db2.gz	NFURTIVFSVPEET-AWEZNQCLSA-N	1	0	276.399	4.066	20	30		CIEDRO
Cc1cccc2c1CC[C@H]2[NH2+]C1CCC(C)(C#N)CC1	ZINC000562656666	327502809	/nfs/dbraw/zinc/50/28/09/327502809.db2.gz	DATCADLTHCEXDT-ZCDVPAHGSA-N	1	0	268.404	4.044	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C#N)s1)c1cccc(Cl)c1	ZINC000135667245	327513318	/nfs/dbraw/zinc/51/33/18/327513318.db2.gz	OLRZAXWRJNWUKU-SNVBAGLBSA-N	1	0	276.792	4.124	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H](C)CCc1n[nH]c2ccccc21	ZINC000562839104	327519203	/nfs/dbraw/zinc/51/92/03/327519203.db2.gz	ZPUDVJRCBILQCJ-AWEZNQCLSA-N	1	0	285.435	4.076	20	30		CIEDRO
C[C@@H](c1cc(F)ccc1F)[NH+]1CCC(CCC#N)CC1	ZINC000569719311	327542838	/nfs/dbraw/zinc/54/28/38/327542838.db2.gz	CDSNQKXYEHYSLF-LBPRGKRZSA-N	1	0	278.346	4.042	20	30		CIEDRO
CCc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(C#N)cc2)o1	ZINC000154350646	327583870	/nfs/dbraw/zinc/58/38/70/327583870.db2.gz	WGSWUEGLESSSCN-QWHCGFSZSA-N	1	0	268.360	4.125	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCCCn1ccnc1C)c1ccccc1	ZINC000160021545	327586844	/nfs/dbraw/zinc/58/68/44/327586844.db2.gz	OHATVWWYNUFASU-IBGZPJMESA-N	1	0	297.446	4.269	20	30		CIEDRO
C=C(C)C[NH2+][C@H](C)c1ccc(Oc2cccnc2)cc1	ZINC000570430120	327590663	/nfs/dbraw/zinc/59/06/63/327590663.db2.gz	HMQPHPISYCSSPV-CQSZACIVSA-N	1	0	268.360	4.101	20	30		CIEDRO
C[C@@H]([NH2+]CC(C)(C)C(C)(C)C)c1ccc(C#N)cc1	ZINC000389120623	328622683	/nfs/dbraw/zinc/62/26/83/328622683.db2.gz	NGGFCVOGGDXHMQ-CYBMUJFWSA-N	1	0	258.409	4.281	20	30		CIEDRO
N#Cc1cccc(C[NH2+]CCCC2CCCCC2)c1	ZINC000395180208	328626734	/nfs/dbraw/zinc/62/67/34/328626734.db2.gz	QQJNHQRJYQJJNS-UHFFFAOYSA-N	1	0	256.393	4.008	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)c1ccc(Br)cc1	ZINC000070592001	328685170	/nfs/dbraw/zinc/68/51/70/328685170.db2.gz	ZHHDXSUHVXZWCV-NSHDSACASA-N	1	0	268.198	4.066	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)CCc1cccc(F)c1)c1ccc(C#N)cc1	ZINC000532207439	328707173	/nfs/dbraw/zinc/70/71/73/328707173.db2.gz	MFMDEQYRRNYYRL-LSDHHAIUSA-N	1	0	296.389	4.369	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+]CCc1c[nH]c2c1cccc2C	ZINC000532235279	328709697	/nfs/dbraw/zinc/70/96/97/328709697.db2.gz	RFENFXCCKWCQDP-DZGCQCFKSA-N	1	0	270.420	4.209	20	30		CIEDRO
Cc1cc(C[NH2+][C@@H](CCC#N)c2ccccc2)c(C)s1	ZINC000532669860	328805143	/nfs/dbraw/zinc/80/51/43/328805143.db2.gz	DHDWJMXRYIEQPP-KRWDZBQOSA-N	1	0	284.428	4.500	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H]1CCc2sc(Br)cc21	ZINC000389745201	328951075	/nfs/dbraw/zinc/95/10/75/328951075.db2.gz	XECLALBXYBWRFF-PSASIEDQSA-N	1	0	286.238	4.052	20	30		CIEDRO
N#CCCCC[N@@H+]1CCCCC[C@@H]1c1ccccc1	ZINC000171033205	329074225	/nfs/dbraw/zinc/07/42/25/329074225.db2.gz	RGNIQVSZRNILNA-QGZVFWFLSA-N	1	0	256.393	4.298	20	30		CIEDRO
C=CCCCCCN(C)Cc1csc([C@H](C)OC)n1	ZINC000175256460	329166484	/nfs/dbraw/zinc/16/64/84/329166484.db2.gz	DEFKDCMGKIJSLQ-ZDUSSCGKSA-N	1	0	282.453	4.029	20	30		CIEDRO
C[C@@H]1CC[C@H]([NH2+]Cc2ccc(C#N)cc2F)c2ccccc21	ZINC000177859816	329193367	/nfs/dbraw/zinc/19/33/67/329193367.db2.gz	SIHZABUPRBMXIW-YJYMSZOUSA-N	1	0	294.373	4.426	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccn(C(C)C)n1)c1ccccc1	ZINC000178760798	329202249	/nfs/dbraw/zinc/20/22/49/329202249.db2.gz	QSFWBFBLIWFHBD-SFHVURJKSA-N	1	0	283.419	4.261	20	30		CIEDRO
Cc1ccc2c(c1)[C@H]([NH2+]CC(C)(C)CCC#N)CCC2	ZINC000179361139	329204618	/nfs/dbraw/zinc/20/46/18/329204618.db2.gz	ZXEYKRUJDOBZGX-QGZVFWFLSA-N	1	0	270.420	4.292	20	30		CIEDRO
C=CCSCC[NH2+][C@H]1C[C@H](C)Sc2sccc21	ZINC000221947022	329215872	/nfs/dbraw/zinc/21/58/72/329215872.db2.gz	RWPOEFSSIABIBQ-JQWIXIFHSA-N	1	0	285.503	4.182	20	30		CIEDRO
C=CCSCC[NH2+][C@H](C)c1sc(C(C)C)nc1C	ZINC000180456740	329217284	/nfs/dbraw/zinc/21/72/84/329217284.db2.gz	NUHZTLTVSJSAHD-LLVKDONJSA-N	1	0	284.494	4.145	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H](C)CCCOC)c1ccccc1	ZINC000181508010	329233834	/nfs/dbraw/zinc/23/38/34/329233834.db2.gz	LLAXAKWRYHQNAJ-RDJZCZTQSA-N	1	0	261.409	4.099	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCCOc2ccccc21)c1ccc(C#N)s1	ZINC000181643169	329235476	/nfs/dbraw/zinc/23/54/76/329235476.db2.gz	WJORWFZRFMVHHD-IUODEOHRSA-N	1	0	298.411	4.184	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCCOc2ccccc21)c1ccc(C#N)s1	ZINC000181643183	329235507	/nfs/dbraw/zinc/23/55/07/329235507.db2.gz	WJORWFZRFMVHHD-WFASDCNBSA-N	1	0	298.411	4.184	20	30		CIEDRO
C[C@H](C[NH+]1CCC(CCC#N)CC1)c1cc(F)cc(F)c1	ZINC000582905930	329284684	/nfs/dbraw/zinc/28/46/84/329284684.db2.gz	DAARLJJZDBMDLR-CYBMUJFWSA-N	1	0	292.373	4.084	20	30		CIEDRO
CC[C@@H]([NH2+][C@H](C)c1cnn(C(C)C)c1)c1ccc(C#N)cc1	ZINC000582944214	329292102	/nfs/dbraw/zinc/29/21/02/329292102.db2.gz	QNJMRNDCGSTBLE-RDTXWAMCSA-N	1	0	296.418	4.138	20	30		CIEDRO
N#CCCC1CC[NH+]([C@H]2CCc3ccc(Cl)cc32)CC1	ZINC000583022007	329298781	/nfs/dbraw/zinc/29/87/81/329298781.db2.gz	RKBXBIPLKYUUMP-KRWDZBQOSA-N	1	0	288.822	4.343	20	30		CIEDRO
CC[C@@H](C)[N@H+](CCC(C)(C)C#N)Cc1ccccc1	ZINC000395693481	329300186	/nfs/dbraw/zinc/30/01/86/329300186.db2.gz	CKDSGBDZCRSTGO-OAHLLOKOSA-N	1	0	258.409	4.227	20	30		CIEDRO
C=CC[C@@H](C)[C@H](C)[NH2+]CCc1nc2ccccc2s1	ZINC000583111009	329313060	/nfs/dbraw/zinc/31/30/60/329313060.db2.gz	DHRSDDHXTLUTJP-OLZOCXBDSA-N	1	0	274.433	4.029	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)c1ccc(-c2ccncc2)cc1	ZINC000508961787	332852917	/nfs/dbraw/zinc/85/29/17/332852917.db2.gz	FZSMVWKWQATEHO-OAHLLOKOSA-N	1	0	266.388	4.365	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1ccc(-c2ccncc2)cc1	ZINC000508961786	332852961	/nfs/dbraw/zinc/85/29/61/332852961.db2.gz	FZSMVWKWQATEHO-HNNXBMFYSA-N	1	0	266.388	4.365	20	30		CIEDRO
CCOc1ccccc1[C@@H](CC)[NH2+][C@@H]1CCC[C@H](C#N)C1	ZINC000185805983	329329620	/nfs/dbraw/zinc/32/96/20/329329620.db2.gz	BECDEPJTRVJXJY-ZMSDIMECSA-N	1	0	286.419	4.208	20	30		CIEDRO
CC[C@@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1ccc(F)cc1F	ZINC000185838820	329330037	/nfs/dbraw/zinc/33/00/37/329330037.db2.gz	UMDVDOGZBFFZRD-DETPVDSQSA-N	1	0	278.346	4.088	20	30		CIEDRO
CC[N@H+](Cc1ccc(C)nc1C)[C@H](C)c1ccc(C#N)cc1	ZINC000186741989	329348069	/nfs/dbraw/zinc/34/80/69/329348069.db2.gz	GDGGGHMRVBQKTB-MRXNPFEDSA-N	1	0	293.414	4.153	20	30		CIEDRO
C=CCC[C@H](CO)[NH2+][C@@H](C)c1cc(Cl)sc1Cl	ZINC000321423702	329354593	/nfs/dbraw/zinc/35/45/93/329354593.db2.gz	KUCIYXRVTYMACY-DTWKUNHWSA-N	1	0	294.247	4.033	20	30		CIEDRO
Cc1cc([C@@H](C)[NH2+]CC(C)(C)CCC#N)c(C)s1	ZINC000229687202	329356910	/nfs/dbraw/zinc/35/69/10/329356910.db2.gz	ARMHOHMATJQFBV-GFCCVEGCSA-N	1	0	264.438	4.346	20	30		CIEDRO
C[C@@H]([NH2+]CC(C)(C)CC#N)[C@H](C)c1ccc(Cl)cc1	ZINC000459737152	329374636	/nfs/dbraw/zinc/37/46/36/329374636.db2.gz	VUWGRLDZZKEZTD-QWHCGFSZSA-N	1	0	278.827	4.361	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)c1nc(C(C)(C)C)cs1	ZINC000509021872	332856228	/nfs/dbraw/zinc/85/62/28/332856228.db2.gz	NBASZZQZMVQUFG-LLVKDONJSA-N	1	0	252.427	4.057	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@@H](C)c1cnc2ccsc2c1	ZINC000393771783	329395603	/nfs/dbraw/zinc/39/56/03/329395603.db2.gz	BJUTXKUFLKECTQ-AAEUAGOBSA-N	1	0	260.406	4.302	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](C)c1c(F)cccc1OC	ZINC000398184490	329438722	/nfs/dbraw/zinc/43/87/22/329438722.db2.gz	PKSDRMVCVGLQRE-STQMWFEESA-N	1	0	265.372	4.230	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+][C@H](CC1CC1)c1ccccc1	ZINC000584507867	329506125	/nfs/dbraw/zinc/50/61/25/329506125.db2.gz	IEKIPFPZEKJGHU-OTWHNJEPSA-N	1	0	285.431	4.099	20	30		CIEDRO
C[C@H](C#N)C[NH2+][C@@H]1CCC[C@H](c2ccc(Cl)cc2)C1	ZINC000520761562	329541488	/nfs/dbraw/zinc/54/14/88/329541488.db2.gz	SRVSEIZBSKXMKI-IVMMDQJWSA-N	1	0	276.811	4.115	20	30		CIEDRO
N#Cc1ccc(C[NH2+]Cc2cc(C3CC3)ccc2F)cc1F	ZINC000421381663	329818099	/nfs/dbraw/zinc/81/80/99/329818099.db2.gz	LTAGVYAHHLVLKG-UHFFFAOYSA-N	1	0	298.336	4.004	20	30		CIEDRO
Cc1cc([C@H](C)[NH2+][C@@H]2CCC[C@@H](C#N)C2)c(C)s1	ZINC000248716433	329897685	/nfs/dbraw/zinc/89/76/85/329897685.db2.gz	BXGNBTKOSQNECK-IACUBPJLSA-N	1	0	262.422	4.098	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)c1cc(F)ccc1F	ZINC000248816637	329899705	/nfs/dbraw/zinc/89/97/05/329899705.db2.gz	KZSAGCDSWOPMBR-KFNAQCHYSA-N	1	0	278.346	4.088	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+]Cc1csc([C@@H](C)OC)n1	ZINC000269089110	330067418	/nfs/dbraw/zinc/06/74/18/330067418.db2.gz	QAKZZFUTVNOYKM-OLZOCXBDSA-N	1	0	282.453	4.075	20	30		CIEDRO
CC(C)C[C@H]([NH2+]Cc1cccc(C#N)c1)c1cccs1	ZINC000079932601	330071915	/nfs/dbraw/zinc/07/19/15/330071915.db2.gz	YSXOMCCIDJMUND-INIZCTEOSA-N	1	0	284.428	4.497	20	30		CIEDRO
C#CC[C@H]([NH2+][C@H](C)c1sc(C)nc1C)c1ccccc1	ZINC000271496127	330079695	/nfs/dbraw/zinc/07/96/95/330079695.db2.gz	LMHABJWNPIOMSP-CJNGLKHVSA-N	1	0	284.428	4.175	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@@H](C)c1ccc([S@](C)=O)cc1	ZINC000271529661	330081179	/nfs/dbraw/zinc/08/11/79/330081179.db2.gz	PIYVUMDEMVEEEJ-UVFQYZLESA-N	1	0	293.476	4.210	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@H](C)c1ccc2c(c1)CCO2)c1ccccc1	ZINC000271573561	330081330	/nfs/dbraw/zinc/08/13/30/330081330.db2.gz	VZKAZWBRPIXFRN-DNVCBOLYSA-N	1	0	291.394	4.037	20	30		CIEDRO
C#CC[C@H]([NH2+][C@H](C)c1ccc2c(c1)CCO2)c1ccccc1	ZINC000271573559	330081626	/nfs/dbraw/zinc/08/16/26/330081626.db2.gz	VZKAZWBRPIXFRN-BEFAXECRSA-N	1	0	291.394	4.037	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1cc(C)nc(C)c1)c1ccco1	ZINC000421850242	330096104	/nfs/dbraw/zinc/09/61/04/330096104.db2.gz	CYSWXDBTLAOSGY-INIZCTEOSA-N	1	0	270.376	4.089	20	30		CIEDRO
C=C(C)[C@@H]([NH2+]CCC(F)(F)F)c1ccc(F)c(F)c1	ZINC000274852560	330108077	/nfs/dbraw/zinc/10/80/77/330108077.db2.gz	GGSKCPLSJMKDPX-GFCCVEGCSA-N	1	0	279.252	4.124	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H](CCO)c1ccccc1)c1ccco1	ZINC000276479312	330113883	/nfs/dbraw/zinc/11/38/83/330113883.db2.gz	RIKXHRSBUNQKLA-MSOLQXFVSA-N	1	0	299.414	4.043	20	30		CIEDRO
C#CC[C@H]([NH2+][C@@H](C)c1cnn(C(C)C)c1C)c1ccccc1	ZINC000276556297	330114049	/nfs/dbraw/zinc/11/40/49/330114049.db2.gz	RDGCEBOAKZUOJE-KXBFYZLASA-N	1	0	295.430	4.188	20	30		CIEDRO
C[C@@H](CC[NH+]1CCC(CCC#N)CC1)c1ccccc1	ZINC000574990268	330123469	/nfs/dbraw/zinc/12/34/69/330123469.db2.gz	QCTQIXJAFDUGPX-INIZCTEOSA-N	1	0	270.420	4.196	20	30		CIEDRO
C=CCC[C@H](N[C@H]1C[C@H]([NH3+])c2ccccc21)c1ccccc1	ZINC000423002447	330163735	/nfs/dbraw/zinc/16/37/35/330163735.db2.gz	YYXPQYLYPTXIBJ-UFYCRDLUSA-N	1	0	292.426	4.428	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1cccc2c1CCCN2)c1ccco1	ZINC000423414662	330197575	/nfs/dbraw/zinc/19/75/75/330197575.db2.gz	NHWJVKCHPQUDOA-GOSISDBHSA-N	1	0	296.414	4.435	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@@H]1CC(C)(C)Oc2ccc(N)cc21	ZINC000423438840	330201579	/nfs/dbraw/zinc/20/15/79/330201579.db2.gz	NNIQXXVUHNEFJE-HEHGZKQESA-N	1	0	288.435	4.061	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](C)c1cccc(OC(F)(F)F)c1	ZINC000536855792	330252091	/nfs/dbraw/zinc/25/20/91/330252091.db2.gz	CGWXNKNIFYBABB-GHMZBOCLSA-N	1	0	273.298	4.200	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)c1oc2ccc(OC)cc2c1C	ZINC000536857375	330252318	/nfs/dbraw/zinc/25/23/18/330252318.db2.gz	KNKREGJSYXKTST-WCQYABFASA-N	1	0	273.376	4.365	20	30		CIEDRO
N#Cc1ccccc1CSCC[NH2+]C1CCCCCC1	ZINC000536859082	330252464	/nfs/dbraw/zinc/25/24/64/330252464.db2.gz	UMYZHBOJJDOCCS-UHFFFAOYSA-N	1	0	288.460	4.104	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@@H]2CCc3c2cc(Cl)cc3Cl)C1	ZINC000424124122	330256555	/nfs/dbraw/zinc/25/65/55/330256555.db2.gz	LXEXNQBYFPTPMK-ZVWUFJHRSA-N	1	0	295.213	4.263	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@H]2CCC[C@@H](c3ccccc3)CC2)C1	ZINC000527721428	330277366	/nfs/dbraw/zinc/27/73/66/330277366.db2.gz	NVVAAAWEOSQVIC-YSHGAJCASA-N	1	0	282.431	4.385	20	30		CIEDRO
CC1(C#N)CCC([NH2+]CC2CCc3ccccc3CC2)CC1	ZINC000527733383	330278422	/nfs/dbraw/zinc/27/84/22/330278422.db2.gz	GJEQIAYZXZIJFH-UHFFFAOYSA-N	1	0	296.458	4.244	20	30		CIEDRO
CC[C@@H](CCc1ccccc1)[NH2+]Cc1cc(C#N)cs1	ZINC000527759940	330281318	/nfs/dbraw/zinc/28/13/18/330281318.db2.gz	DACQEYIRHZJMFA-INIZCTEOSA-N	1	0	284.428	4.121	20	30		CIEDRO
CC[C@H]([NH2+]Cc1cc(C#N)cs1)c1cc(C)ccc1C	ZINC000527819504	330286211	/nfs/dbraw/zinc/28/62/11/330286211.db2.gz	JDHOIOMAYKDIHC-KRWDZBQOSA-N	1	0	284.428	4.478	20	30		CIEDRO
Cc1cccc([C@H]([NH2+]Cc2cccc(C#N)c2F)C(C)C)c1	ZINC000527891331	330292310	/nfs/dbraw/zinc/29/23/10/330292310.db2.gz	ARXAKDQWQOVJQB-LJQANCHMSA-N	1	0	296.389	4.493	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CC[C@@H](C#N)C1)c1cc(C)ccc1C	ZINC000527890478	330292326	/nfs/dbraw/zinc/29/23/26/330292326.db2.gz	ILHXGZQMCMZCCV-INMHGKMJSA-N	1	0	256.393	4.036	20	30		CIEDRO
CC[C@@H](CCc1ccccc1)[NH2+]C1CCC(C)(C#N)CC1	ZINC000527953714	330294616	/nfs/dbraw/zinc/29/46/16/330294616.db2.gz	APKDLZKDZGDQRP-VIQWUECVSA-N	1	0	284.447	4.460	20	30		CIEDRO
CC[N@H+](C/C=C(/C)Cl)[C@@H](C)c1ccc(C#N)cc1	ZINC000528355521	330321893	/nfs/dbraw/zinc/32/18/93/330321893.db2.gz	CDJIUQNQFCSRLD-SUIFULHWSA-N	1	0	262.784	4.084	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+]C2CCC3(CCCCC3)CC2)C1	ZINC000424189890	330323042	/nfs/dbraw/zinc/32/30/42/330323042.db2.gz	FENMAXYUBFOXGV-ZBFHGGJFSA-N	1	0	260.425	4.161	20	30		CIEDRO
C=CCCC[N@H+]1CCCC[C@H]1c1nc2ccccc2n1C	ZINC000533065326	330325665	/nfs/dbraw/zinc/32/56/65/330325665.db2.gz	IYEAPKVPFIQHOP-KRWDZBQOSA-N	1	0	283.419	4.067	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H](C)c2cc(C)oc2C)cc1	ZINC000044729537	330331180	/nfs/dbraw/zinc/33/11/80/330331180.db2.gz	BEWMVHIRPJZIRE-AWEZNQCLSA-N	1	0	285.387	4.312	20	30		CIEDRO
C[C@@H](CC1CCCC1)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000533090923	330333988	/nfs/dbraw/zinc/33/39/88/330333988.db2.gz	KAPPOKDIWOBDLK-KBPBESRZSA-N	1	0	256.393	4.178	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@@H](CCCC)c1ccccc1	ZINC000424294575	330335744	/nfs/dbraw/zinc/33/57/44/330335744.db2.gz	KYHRXVICNRXBKS-BZSNNMDCSA-N	1	0	273.420	4.099	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@H](C)c1ccc(F)c2ccccc21	ZINC000424295737	330336002	/nfs/dbraw/zinc/33/60/02/330336002.db2.gz	NEQCEBVYEUGNCG-TYILLQQXSA-N	1	0	299.389	4.221	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@H](c1ccc(C)o1)C1CCCC1	ZINC000424299663	330336885	/nfs/dbraw/zinc/33/68/85/330336885.db2.gz	VWGZRRRLASYDKT-BQFCYCMXSA-N	1	0	289.419	4.000	20	30		CIEDRO
C=CCC[C@@H]([NH2+][C@@H]1C[C@@H]2C[C@H](OC)C[C@@H]2C1)c1ccccc1	ZINC000424303993	330338178	/nfs/dbraw/zinc/33/81/78/330338178.db2.gz	QEHCTDFZOIBHHX-UJMXGEILSA-N	1	0	299.458	4.487	20	30		CIEDRO
CC(C)c1cccc2c1OCCC[C@H]2[NH2+][C@@H]1CC[C@H](C#N)C1	ZINC000424320028	330340099	/nfs/dbraw/zinc/34/00/99/330340099.db2.gz	FLEPZKUACVNQBT-HDMKZQKVSA-N	1	0	298.430	4.306	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@@H]2CCC[C@H]2c2ccc(Cl)cc2)C1	ZINC000424321196	330340237	/nfs/dbraw/zinc/34/02/37/330340237.db2.gz	HBFBVZVVPAIFJI-NKKGCODLSA-N	1	0	288.822	4.258	20	30		CIEDRO
Cc1ccc2cc([C@H](C)[NH2+][C@@H]3CC[C@H](C#N)C3)oc2c1	ZINC000424322659	330340409	/nfs/dbraw/zinc/34/04/09/330340409.db2.gz	IJUWNMDREDUPMY-KCQAQPDRSA-N	1	0	268.360	4.084	20	30		CIEDRO
Cc1c2ccccc2oc1[C@@H](C)[NH2+][C@@H]1CC[C@H](C#N)C1	ZINC000424323379	330340657	/nfs/dbraw/zinc/34/06/57/330340657.db2.gz	JADUSGRRLBRLDU-HZSPNIEDSA-N	1	0	268.360	4.084	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1csc(-c2ccccc2)n1	ZINC000424324931	330341205	/nfs/dbraw/zinc/34/12/05/330341205.db2.gz	KKYGSYSBCMPYQL-KCQAQPDRSA-N	1	0	297.427	4.153	20	30		CIEDRO
Cc1ccc([C@@H]([NH2+][C@@H]2CC[C@H](C#N)C2)C2CCCC2)o1	ZINC000424325998	330341378	/nfs/dbraw/zinc/34/13/78/330341378.db2.gz	LPSVSJIHQJCPSF-LXZKKBNFSA-N	1	0	272.392	4.101	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1cccc(Cl)c1	ZINC000424329549	330341935	/nfs/dbraw/zinc/34/19/35/330341935.db2.gz	PMBSZWSCXSJNIW-NILFDRSVSA-N	1	0	262.784	4.073	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1cccc(-c2ccncc2)c1	ZINC000424337583	330343575	/nfs/dbraw/zinc/34/35/75/330343575.db2.gz	ZOYJEMPPSIQPEO-YZVOILCLSA-N	1	0	291.398	4.091	20	30		CIEDRO
N#Cc1ccccc1-c1ccc(C[NH+]2C3CCC2CC3)cc1	ZINC000533237232	330354480	/nfs/dbraw/zinc/35/44/80/330354480.db2.gz	GNWIQFXSMMAANL-UHFFFAOYSA-N	1	0	288.394	4.352	20	30		CIEDRO
C=CCCC[N@@H+](C)[C@H](C)C(=O)Nc1cccc2ccccc21	ZINC000533301457	330356764	/nfs/dbraw/zinc/35/67/64/330356764.db2.gz	SSDOLMQZOQPVHO-OAHLLOKOSA-N	1	0	296.414	4.065	20	30		CIEDRO
CCc1ccc(C[NH2+][C@H](CCC#N)c2ccccc2)s1	ZINC000533360607	330359778	/nfs/dbraw/zinc/35/97/78/330359778.db2.gz	GWFNAKYKSHOXIS-QGZVFWFLSA-N	1	0	284.428	4.445	20	30		CIEDRO
C=C(CC)C[N@@H+]1CCCC[C@@H]1c1nc(-c2ccccc2)no1	ZINC000536888964	330363410	/nfs/dbraw/zinc/36/34/10/330363410.db2.gz	GEZCPUGEUTZIDD-MRXNPFEDSA-N	1	0	297.402	4.230	20	30		CIEDRO
Cc1cc(C)cc(C2=CC[N@H+](CCC(C)(C)C#N)CC2)c1	ZINC000538514571	330366695	/nfs/dbraw/zinc/36/66/95/330366695.db2.gz	KOYRCVOPWWSBHD-UHFFFAOYSA-N	1	0	282.431	4.332	20	30		CIEDRO
CC(C)C[C@@H]1CCC[N@H+](CCCC(C)(C)C#N)C1	ZINC000119320139	330372810	/nfs/dbraw/zinc/37/28/10/330372810.db2.gz	LUUDUAZTESTMDB-HNNXBMFYSA-N	1	0	250.430	4.074	20	30		CIEDRO
C[C@H]([NH2+]CC1(CC#N)CC1)c1ccc(Cl)cc1Cl	ZINC000088249510	330375083	/nfs/dbraw/zinc/37/50/83/330375083.db2.gz	MRHTXCBIHKQHHE-JTQLQIEISA-N	1	0	283.202	4.338	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCc1c[nH]c2ccccc12)C1CC1	ZINC000119803302	330379908	/nfs/dbraw/zinc/37/99/08/330379908.db2.gz	KDNVAFIPBGCANQ-KRWDZBQOSA-N	1	0	268.404	4.045	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1cccc2cccnc21)C1CC1	ZINC000120677662	330390270	/nfs/dbraw/zinc/39/02/70/330390270.db2.gz	LQYXRFLYWPPCEJ-QGZVFWFLSA-N	1	0	266.388	4.069	20	30		CIEDRO
N#CCC[C@H]([NH2+]C1CCCCCC1)c1ccccc1	ZINC000090665534	330394670	/nfs/dbraw/zinc/39/46/70/330394670.db2.gz	BVWQMGHUYTYOJP-KRWDZBQOSA-N	1	0	256.393	4.344	20	30		CIEDRO
C[C@H]1CCC[C@H]([NH2+][C@@H](CCC#N)c2ccccc2)C1	ZINC000090665536	330394689	/nfs/dbraw/zinc/39/46/89/330394689.db2.gz	IBJKGIWEPDFMQE-XIRDDKMYSA-N	1	0	256.393	4.200	20	30		CIEDRO
CCC(CC)[C@H]([NH2+]CCCSCC#N)c1cccs1	ZINC000537076840	330395476	/nfs/dbraw/zinc/39/54/76/330395476.db2.gz	RLMRZFJWSIFNBG-HNNXBMFYSA-N	1	0	296.505	4.462	20	30		CIEDRO
CCC(CC)[C@@H]([NH2+]CCCSCC#N)c1ccccc1	ZINC000537078823	330398234	/nfs/dbraw/zinc/39/82/34/330398234.db2.gz	UDDBXQFDEOGGFV-QGZVFWFLSA-N	1	0	290.476	4.400	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](C)c1sc(CC)nc1C	ZINC000537305783	330432041	/nfs/dbraw/zinc/43/20/41/330432041.db2.gz	LBGIHJFDRLIRFG-NWDGAFQWSA-N	1	0	266.454	4.409	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H]1CCc2c1cccc2OC	ZINC000537304091	330432066	/nfs/dbraw/zinc/43/20/66/330432066.db2.gz	MNOQKJFRJVWLEJ-BBRMVZONSA-N	1	0	259.393	4.017	20	30		CIEDRO
C=C[C@@H](C)[NH2+][C@@H](C)c1cc(Cl)sc1Cl	ZINC000122966755	330435821	/nfs/dbraw/zinc/43/58/21/330435821.db2.gz	MINVUIWSHFZJAD-RQJHMYQMSA-N	1	0	250.194	4.280	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@@H](C)[C@H]1OCCc2sccc21	ZINC000426345247	330504969	/nfs/dbraw/zinc/50/49/69/330504969.db2.gz	WNWNJULFLYQVQX-HEHGZKQESA-N	1	0	279.449	4.085	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@]1(C)CCCS1)c1ccco1	ZINC000428442289	330523677	/nfs/dbraw/zinc/52/36/77/330523677.db2.gz	ZZGJMLTYJFGLTL-DZGCQCFKSA-N	1	0	265.422	4.162	20	30		CIEDRO
CCO[C@H]1C[C@H]([NH2+]CCCC(C)(C)C#N)C12CCCCC2	ZINC000429764729	330554527	/nfs/dbraw/zinc/55/45/27/330554527.db2.gz	VGFXWNTVXMFJMS-HOTGVXAUSA-N	1	0	292.467	4.034	20	30		CIEDRO
C[C@H]([NH2+]CC1(CC#N)CC1)c1cc(Cl)ccc1Cl	ZINC000429796203	330555019	/nfs/dbraw/zinc/55/50/19/330555019.db2.gz	VOXMXGFHWGJZTP-JTQLQIEISA-N	1	0	283.202	4.338	20	30		CIEDRO
CC[C@@H]([NH2+]CC1(CC#N)CC1)c1ccc(Cl)cc1	ZINC000429797533	330555039	/nfs/dbraw/zinc/55/50/39/330555039.db2.gz	BSHKYDBBIFCBIN-CQSZACIVSA-N	1	0	262.784	4.075	20	30		CIEDRO
N#CCC1(C[NH2+][C@@H]2CCC[C@H]2CCc2ccccc2)CC1	ZINC000430745236	330572512	/nfs/dbraw/zinc/57/25/12/330572512.db2.gz	WJZJWCMGSWMUKU-ZWKOTPCHSA-N	1	0	282.431	4.071	20	30		CIEDRO
CC(C)(C)C[C@H]([NH2+]CC1(CC#N)CC1)c1ccccc1	ZINC000430745457	330572539	/nfs/dbraw/zinc/57/25/39/330572539.db2.gz	XROQPWMLSIRDCI-INIZCTEOSA-N	1	0	270.420	4.447	20	30		CIEDRO
C[C@@H](CC(C)(C)c1ccccc1)[NH2+]CC1(CC#N)CC1	ZINC000430747870	330572700	/nfs/dbraw/zinc/57/27/00/330572700.db2.gz	NOKQLROEFGMJPE-HNNXBMFYSA-N	1	0	270.420	4.026	20	30		CIEDRO
CCSc1ccccc1[C@@H](C)[NH2+]CC1(CC#N)CC1	ZINC000430756062	330573379	/nfs/dbraw/zinc/57/33/79/330573379.db2.gz	RXYRZFMRNNWDAB-CYBMUJFWSA-N	1	0	274.433	4.143	20	30		CIEDRO
CCc1noc(C)c1C[NH2+][C@H](CCCC#N)c1ccccc1	ZINC000433027137	330613062	/nfs/dbraw/zinc/61/30/62/330613062.db2.gz	JNRPBCJJXBODKB-GOSISDBHSA-N	1	0	297.402	4.070	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+][C@H](CC)c1ccc(Cl)cc1	ZINC000435666338	330659798	/nfs/dbraw/zinc/65/97/98/330659798.db2.gz	WMPXNUCLBZBZED-UAGQMJEPSA-N	1	0	293.838	4.362	20	30		CIEDRO
Cc1cc(C[NH2+][C@H]2C[C@H](c3cccc(F)c3)C2)ccc1C#N	ZINC000435748455	330662040	/nfs/dbraw/zinc/66/20/40/330662040.db2.gz	ODQDIVFSOYCEDW-UAPYVXQJSA-N	1	0	294.373	4.042	20	30		CIEDRO
Cc1cc(C[NH2+][C@H]2C[C@H](c3ccccc3F)C2)ccc1C#N	ZINC000435777265	330662776	/nfs/dbraw/zinc/66/27/76/330662776.db2.gz	HVHIJAMUAWPAAN-QAQDUYKDSA-N	1	0	294.373	4.042	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@H]2CC[C@H](Cc3ccccc3)C2)c1	ZINC000436249086	330671659	/nfs/dbraw/zinc/67/16/59/330671659.db2.gz	CRBFZDVTULUPDT-XLIONFOSSA-N	1	0	290.410	4.059	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@H](CCCC)c1ccccc1	ZINC000436295427	330674182	/nfs/dbraw/zinc/67/41/82/330674182.db2.gz	PPPZGZQNRYXHJI-QRVBRYPASA-N	1	0	287.447	4.489	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccc(OCC)c(F)c1)C1CC1	ZINC000438987861	330731947	/nfs/dbraw/zinc/73/19/47/330731947.db2.gz	BMKLIWIHHUZMSP-INIZCTEOSA-N	1	0	277.383	4.059	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCc1c[nH]c2cccc(C)c12)C1CC1	ZINC000438993446	330732085	/nfs/dbraw/zinc/73/20/85/330732085.db2.gz	BQCHIQIZXZEIQE-QGZVFWFLSA-N	1	0	282.431	4.353	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccc(C#N)cc1Cl)C(C)(C)C	ZINC000439451181	330738353	/nfs/dbraw/zinc/73/83/53/330738353.db2.gz	LARTYRDDHIUIEN-CQSZACIVSA-N	1	0	264.800	4.126	20	30		CIEDRO
C[C@@H]([NH2+]CC1CCC(C#N)CC1)c1ccc(F)c(Cl)c1	ZINC000442098932	330773984	/nfs/dbraw/zinc/77/39/84/330773984.db2.gz	MXVKXBDJSYMNGL-PNESKVBLSA-N	1	0	294.801	4.460	20	30		CIEDRO
COc1ccccc1[C@H](CC(C)C)[NH2+][C@H]1CC[C@@H](C#N)C1	ZINC000442763507	330781510	/nfs/dbraw/zinc/78/15/10/330781510.db2.gz	GTONPGMUSQKDAK-VYDXJSESSA-N	1	0	286.419	4.064	20	30		CIEDRO
CC(C)(C[NH2+][C@H]1CC[C@H](C#N)C1)c1ccc(F)cc1Cl	ZINC000442784913	330783065	/nfs/dbraw/zinc/78/30/65/330783065.db2.gz	UQAPRKMAGJUMJT-AAEUAGOBSA-N	1	0	294.801	4.039	20	30		CIEDRO
Cc1cccc(C2([NH2+][C@H]3CC[C@@H](C#N)C3)CCCC2)c1	ZINC000442823444	330785625	/nfs/dbraw/zinc/78/56/25/330785625.db2.gz	DCXAYHMBXQIXAJ-WBVHZDCISA-N	1	0	268.404	4.046	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+]CC2(Cc3ccccc3)CCCC2)C1	ZINC000442832838	330785928	/nfs/dbraw/zinc/78/59/28/330785928.db2.gz	ZEKAHHIHVUGOBI-MSOLQXFVSA-N	1	0	282.431	4.071	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH2+]C2(c3ccc(Cl)c(Cl)c3)CC2)C1	ZINC000442854375	330787209	/nfs/dbraw/zinc/78/72/09/330787209.db2.gz	AKHJAGDMDSGPBD-ZYHUDNBSSA-N	1	0	295.213	4.264	20	30		CIEDRO
C[C@@H](CCCC(F)(F)F)[NH2+]CC1CCC(C#N)CC1	ZINC000442867130	330788522	/nfs/dbraw/zinc/78/85/22/330788522.db2.gz	KHUOHSNFIMNAPE-HIFPTAJRSA-N	1	0	276.346	4.027	20	30		CIEDRO
Cc1cc(C[NH2+][C@H]2CCSc3ccccc32)ccc1C#N	ZINC000443981333	330808294	/nfs/dbraw/zinc/80/82/94/330808294.db2.gz	RQAPTPFEQLQMGH-KRWDZBQOSA-N	1	0	294.423	4.193	20	30		CIEDRO
Cc1cc(C[NH2+][C@H]2c3ccccc3CC[C@H]2C)ccc1C#N	ZINC000444000357	330808965	/nfs/dbraw/zinc/80/89/65/330808965.db2.gz	WBLWZRAXLOUUHS-JLTOFOAXSA-N	1	0	290.410	4.280	20	30		CIEDRO
CCOc1cccc([C@H](C)[NH2+]CCCCC(C)(C)C#N)c1	ZINC000444673641	330818421	/nfs/dbraw/zinc/81/84/21/330818421.db2.gz	IHAQOMRAGVNMOG-HNNXBMFYSA-N	1	0	288.435	4.456	20	30		CIEDRO
C[C@@H]([NH2+]CCCCC(C)(C)C#N)[C@@H](C)c1ccccc1	ZINC000444691189	330819940	/nfs/dbraw/zinc/81/99/40/330819940.db2.gz	XLFHOPUHLQLUGY-HZPDHXFCSA-N	1	0	272.436	4.488	20	30		CIEDRO
CC[C@@H]([NH2+]C[C@H](C)c1ccccc1)c1ccc(C#N)cc1	ZINC000447513588	330867506	/nfs/dbraw/zinc/86/75/06/330867506.db2.gz	XMCJQYFYABIDML-HNAYVOBHSA-N	1	0	278.399	4.403	20	30		CIEDRO
CC[C@H]([NH2+]CCCc1ccccc1)c1ccc(C#N)cc1	ZINC000447516836	330867588	/nfs/dbraw/zinc/86/75/88/330867588.db2.gz	IHOTWHHSMSKHSK-IBGZPJMESA-N	1	0	278.399	4.232	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CCCC[C@H]1C)c1ccc(C#N)cc1	ZINC000447522179	330867766	/nfs/dbraw/zinc/86/77/66/330867766.db2.gz	YARXVMICZSSUDC-XOKHGSTOSA-N	1	0	256.393	4.178	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@H]3CCCC[C@H]3C2)C1	ZINC000447528319	330867954	/nfs/dbraw/zinc/86/79/54/330867954.db2.gz	IVCDDTJJCZMUOA-UHDSXZAQSA-N	1	0	260.425	4.017	20	30		CIEDRO
CC[C@@H]([NH2+][C@H]1CSc2ccccc21)c1ccc(C#N)cc1	ZINC000447543874	330869440	/nfs/dbraw/zinc/86/94/40/330869440.db2.gz	SUKVEYGZMKZXJT-SJORKVTESA-N	1	0	294.423	4.446	20	30		CIEDRO
CC[C@@H]([NH2+]C[C@@H](C)Oc1ccccc1)c1ccc(C#N)cc1	ZINC000447582019	330871260	/nfs/dbraw/zinc/87/12/60/330871260.db2.gz	XCZAJLAYDFIMMR-DNVCBOLYSA-N	1	0	294.398	4.066	20	30		CIEDRO
CC[C@H]([NH2+]C[C@@H](C)Oc1ccccc1)c1ccc(C#N)cc1	ZINC000447582018	330871322	/nfs/dbraw/zinc/87/13/22/330871322.db2.gz	XCZAJLAYDFIMMR-BEFAXECRSA-N	1	0	294.398	4.066	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@@H](c2cccs2)C2CC2)CC1	ZINC000449076719	330897451	/nfs/dbraw/zinc/89/74/51/330897451.db2.gz	XRJVLMPDFUZWBM-OGVSOVDVSA-N	1	0	274.433	4.261	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+]Cc1ccccc1Cn1ccnc1	ZINC000449079096	330897811	/nfs/dbraw/zinc/89/78/11/330897811.db2.gz	ZRYIDENUFBPNEF-KRWDZBQOSA-N	1	0	297.446	4.156	20	30		CIEDRO
C[C@@H]([NH2+]C1CCC(C)(C#N)CC1)C(C)(C)c1ccccc1	ZINC000449116610	330899959	/nfs/dbraw/zinc/89/99/59/330899959.db2.gz	MAVKQDMWQALASY-LSJNQWAISA-N	1	0	284.447	4.415	20	30		CIEDRO
CC1(c2ccccc2)CC([NH2+]C2CCC(C)(C#N)CC2)C1	ZINC000449120487	330900107	/nfs/dbraw/zinc/90/01/07/330900107.db2.gz	DDJLYZMKIIOQLM-UHFFFAOYSA-N	1	0	282.431	4.169	20	30		CIEDRO
Cc1ccc([C@@H](C)C[NH2+]C2CCC(C)(C#N)CC2)cc1	ZINC000449159554	330902500	/nfs/dbraw/zinc/90/25/00/330902500.db2.gz	HHGRWBKHKKBGJC-ZLPCBKJTSA-N	1	0	270.420	4.161	20	30		CIEDRO
CCCCO[C@H]1C[C@@H]([NH2+]C2CCC(C)(C#N)CC2)C1(C)C	ZINC000449181140	330904217	/nfs/dbraw/zinc/90/42/17/330904217.db2.gz	FDWWEUBXWSIEPV-NDUQDZPOSA-N	1	0	292.467	4.032	20	30		CIEDRO
Cc1ccc2c(c1)[C@@H]([NH2+]C1CCC(C)(C#N)CC1)[C@H](C)C2	ZINC000449229756	330907942	/nfs/dbraw/zinc/90/79/42/330907942.db2.gz	DQKQATIEYQKQPX-SEBYTVMXSA-N	1	0	282.431	4.290	20	30		CIEDRO
Cc1ccccc1-c1ccccc1C[NH2+]CC(C)(C)C#N	ZINC000449237564	330908484	/nfs/dbraw/zinc/90/84/84/330908484.db2.gz	CANDZNHKIOQXBF-UHFFFAOYSA-N	1	0	278.399	4.301	20	30		CIEDRO
CC(C)(C#N)C[NH2+][C@@H]1CC[C@H](c2ccc(Cl)cc2)C1	ZINC000449241066	330908983	/nfs/dbraw/zinc/90/89/83/330908983.db2.gz	QVIHRFPZQKGQNL-DZGCQCFKSA-N	1	0	276.811	4.115	20	30		CIEDRO
C[C@@H](CCCC(F)(F)F)[NH2+]C1CCC(C)(C#N)CC1	ZINC000449284869	330911869	/nfs/dbraw/zinc/91/18/69/330911869.db2.gz	PKXLZYBRFFJTLD-HIFPTAJRSA-N	1	0	276.346	4.170	20	30		CIEDRO
Cc1ccccc1-c1ccccc1C[NH2+]CC1(CC#N)CC1	ZINC000449296827	330912658	/nfs/dbraw/zinc/91/26/58/330912658.db2.gz	AIYPQSGNSZNJGD-UHFFFAOYSA-N	1	0	290.410	4.446	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@@H]2CCc3sc(Cl)cc32)CC1	ZINC000449326953	330914649	/nfs/dbraw/zinc/91/46/49/330914649.db2.gz	ANGYGSBLTORNDD-WBFHCKIUSA-N	1	0	294.851	4.451	20	30		CIEDRO
N#CCCC[C@@H]([NH2+][C@H]1CCOC2(CCC2)C1)c1ccccc1	ZINC000449340251	330916139	/nfs/dbraw/zinc/91/61/39/330916139.db2.gz	NMPSEOFWYLTEJZ-ZWKOTPCHSA-N	1	0	298.430	4.113	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+][C@H]2CCCc3c(F)cc(F)cc32)C1	ZINC000449352758	330917650	/nfs/dbraw/zinc/91/76/50/330917650.db2.gz	WGXWTQGMELCFHS-NDGTYSDOSA-N	1	0	290.357	4.014	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H]1CCCc2c(F)cccc21	ZINC000449352411	330917769	/nfs/dbraw/zinc/91/77/69/330917769.db2.gz	UWPYHZJJWZUFMG-INIZCTEOSA-N	1	0	274.383	4.123	20	30		CIEDRO
C[C@H]([NH2+]Cc1cc(C#N)cs1)c1cccc(C2CC2)c1	ZINC000449353214	330917852	/nfs/dbraw/zinc/91/78/52/330917852.db2.gz	YYYMVYYUHWFHRD-LBPRGKRZSA-N	1	0	282.412	4.348	20	30		CIEDRO
CC(C)C[C@@H](C)C[C@H](C)[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000449446341	330926384	/nfs/dbraw/zinc/92/63/84/330926384.db2.gz	PJBVEAMTQTYKLG-UGUYLWEFSA-N	1	0	250.430	4.119	20	30		CIEDRO
CC(C)C[C@H](C[NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccccc1	ZINC000449446477	330926372	/nfs/dbraw/zinc/92/63/72/330926372.db2.gz	RKNLQJXCRWFFCM-UHOSZYNNSA-N	1	0	284.447	4.488	20	30		CIEDRO
Cc1ccc(-c2ccc(C[NH2+][C@H]3CC[C@@H](CC#N)C3)o2)cc1	ZINC000449447175	330926420	/nfs/dbraw/zinc/92/64/20/330926420.db2.gz	WOPBYLFGYPHMOP-RDJZCZTQSA-N	1	0	294.398	4.427	20	30		CIEDRO
C=CC(C)(C)C[NH2+]Cc1ncc(-c2ccccc2)s1	ZINC000449486150	330929965	/nfs/dbraw/zinc/92/99/65/330929965.db2.gz	QNJTZMFPACAKJD-UHFFFAOYSA-N	1	0	272.417	4.112	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@H]1CCC[C@@H](c2ncccc2C)C1	ZINC000449485553	330929976	/nfs/dbraw/zinc/92/99/76/330929976.db2.gz	NTKSRACTKQPBEE-CVEARBPZSA-N	1	0	272.436	4.218	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@H]1CCO[C@H](c2cccs2)C1	ZINC000449633036	330941241	/nfs/dbraw/zinc/94/12/41/330941241.db2.gz	YITKFYDERRYOFO-KKUMJFAQSA-N	1	0	279.449	4.303	20	30		CIEDRO
CN1CCC[C@@H]([NH2+]C2CCC(C)(C#N)CC2)c2ccccc21	ZINC000449653647	330942133	/nfs/dbraw/zinc/94/21/33/330942133.db2.gz	CNUJREGZNWLOIY-URSIVYNOSA-N	1	0	297.446	4.020	20	30		CIEDRO
C=CC[C@H](C)[NH2+]Cc1ccc(Cl)c(Br)c1	ZINC000162637623	330945671	/nfs/dbraw/zinc/94/56/71/330945671.db2.gz	JTRIRTLYVRJRNI-VIFPVBQESA-N	1	0	288.616	4.157	20	30		CIEDRO
N#CC1(C[NH2+][C@@H](Cc2ccccc2)c2ccccc2)CCC1	ZINC000450505267	330984231	/nfs/dbraw/zinc/98/42/31/330984231.db2.gz	CCBNOGBAIFWRJR-IBGZPJMESA-N	1	0	290.410	4.254	20	30		CIEDRO
CC[C@@H]([NH2+]CC1(C#N)CCC1)c1cccc(Cl)c1	ZINC000450668572	330992203	/nfs/dbraw/zinc/99/22/03/330992203.db2.gz	NQHHBQPIHUUAFC-CQSZACIVSA-N	1	0	262.784	4.075	20	30		CIEDRO
C=C(C)[C@H]([NH2+]CC1CC(F)(F)C1)c1ccc(F)c(F)c1	ZINC000450767069	330999039	/nfs/dbraw/zinc/99/90/39/330999039.db2.gz	BZGAIFGKULHOJL-AWEZNQCLSA-N	1	0	287.300	4.217	20	30		CIEDRO
N#CCCC[C@H]([NH2+]C[C@H]1CCC(F)(F)C1)c1ccccc1	ZINC000451060383	331014162	/nfs/dbraw/zinc/01/41/62/331014162.db2.gz	FTIXMOSURGJORX-HOCLYGCPSA-N	1	0	292.373	4.447	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000163329175	331021466	/nfs/dbraw/zinc/02/14/66/331021466.db2.gz	ULMLIOBVSYDEBA-MNOVXSKESA-N	1	0	257.299	4.321	20	30		CIEDRO
C=C(C)COCC[NH2+][C@H](c1cccs1)C1CCCC1	ZINC000163510173	331048273	/nfs/dbraw/zinc/04/82/73/331048273.db2.gz	FXSWAGHRTKNHQS-INIZCTEOSA-N	1	0	279.449	4.162	20	30		CIEDRO
CC(C)(C#N)CC[N@@H+]1CCC[C@@H]1c1ccc(F)cc1F	ZINC000451976745	331049248	/nfs/dbraw/zinc/04/92/48/331049248.db2.gz	YQGZRKJMLRSOSZ-OAHLLOKOSA-N	1	0	278.346	4.042	20	30		CIEDRO
C[C@@H]1CC[C@@H]([NH2+]Cc2cccc(C#N)c2)c2sccc21	ZINC000453101907	331089336	/nfs/dbraw/zinc/08/93/36/331089336.db2.gz	ZPJCVCHPRRONMJ-MLGOLLRUSA-N	1	0	282.412	4.348	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@@H](C)c1csc(C)c1	ZINC000453104778	331089574	/nfs/dbraw/zinc/08/95/74/331089574.db2.gz	DMPHCBJGVQVQET-AWEZNQCLSA-N	1	0	287.428	4.472	20	30		CIEDRO
C[C@H](CCCc1cccnc1)[NH2+][C@H](C)c1cccc(C#N)c1	ZINC000453124635	331091621	/nfs/dbraw/zinc/09/16/21/331091621.db2.gz	SBRVUFMLTMGHKG-HZPDHXFCSA-N	1	0	293.414	4.015	20	30		CIEDRO
C=CCC[C@@H]([NH2+][C@@H](C)c1nccn1CC)c1ccccc1	ZINC000453178191	331097565	/nfs/dbraw/zinc/09/75/65/331097565.db2.gz	SDMUWZRNHABEOV-DOTOQJQBSA-N	1	0	283.419	4.261	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCCc2c(F)cccc21)c1cccc(C#N)c1	ZINC000453225022	331103676	/nfs/dbraw/zinc/10/36/76/331103676.db2.gz	CUVFSJLZKHCAEK-DJJJIMSYSA-N	1	0	294.373	4.426	20	30		CIEDRO
CC[C@@H]([NH2+]C[C@@H]1CCCCC1(F)F)c1ccc(C#N)cc1	ZINC000453242736	331106434	/nfs/dbraw/zinc/10/64/34/331106434.db2.gz	FSYLMBITIUVRBV-JKSUJKDBSA-N	1	0	292.373	4.424	20	30		CIEDRO
C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000453287333	331111290	/nfs/dbraw/zinc/11/12/90/331111290.db2.gz	FEUJPZHNOAXMMC-KHSSZTOVSA-N	1	0	286.394	4.121	20	30		CIEDRO
C[C@H]1CCc2c(F)cccc2[C@@H]1[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000453287336	331111400	/nfs/dbraw/zinc/11/14/00/331111400.db2.gz	FEUJPZHNOAXMMC-WZTLGTBRSA-N	1	0	286.394	4.121	20	30		CIEDRO
CC(C)[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1cc(F)ccc1F	ZINC000453296212	331112525	/nfs/dbraw/zinc/11/25/25/331112525.db2.gz	UNJMTKTUCZXZMC-JDFRZJQESA-N	1	0	292.373	4.334	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@H](C)c1ccc(OC(F)F)c(OC)c1	ZINC000453312176	331114987	/nfs/dbraw/zinc/11/49/87/331114987.db2.gz	UWUNZTLRTUJTEU-LLVKDONJSA-N	1	0	299.361	4.159	20	30		CIEDRO
CC[C@H]([NH2+]C[C@H]1CCCC1(F)F)c1ccc(C#N)cc1	ZINC000453323949	331116810	/nfs/dbraw/zinc/11/68/10/331116810.db2.gz	URUDAPXNSUBQDO-CABCVRRESA-N	1	0	278.346	4.034	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H]1CCOC2(CCC2)C1)c1ccco1	ZINC000453331700	331117871	/nfs/dbraw/zinc/11/78/71/331117871.db2.gz	ZYPRRXOOAYNMDT-CVEARBPZSA-N	1	0	289.419	4.226	20	30		CIEDRO
C=C[C@@H]1OCCC[C@H]1[NH2+][C@@H](CC)c1ccc(Cl)s1	ZINC000453335068	331118232	/nfs/dbraw/zinc/11/82/32/331118232.db2.gz	FMBHGONWWULMJQ-TUAOUCFPSA-N	1	0	285.840	4.176	20	30		CIEDRO
C=CCC1(C[NH2+][C@@H](C)c2cnccc2C)CCCC1	ZINC000453341665	331119267	/nfs/dbraw/zinc/11/92/67/331119267.db2.gz	CHTSUAKQGZPYQX-HNNXBMFYSA-N	1	0	258.409	4.177	20	30		CIEDRO
C=CCC1(C[NH2+][C@H](C)c2cnccc2C)CCCC1	ZINC000453341666	331119300	/nfs/dbraw/zinc/11/93/00/331119300.db2.gz	CHTSUAKQGZPYQX-OAHLLOKOSA-N	1	0	258.409	4.177	20	30		CIEDRO
C=C[C@@H]1OCCC[C@H]1[NH2+][C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000453365197	331123176	/nfs/dbraw/zinc/12/31/76/331123176.db2.gz	SEWGZQGOGIZTSX-DFBGVHRSSA-N	1	0	299.336	4.090	20	30		CIEDRO
C=C[C@@H]1OCCC[C@H]1[NH2+][C@H]1CC[C@@H](C)c2ccsc21	ZINC000453374851	331124526	/nfs/dbraw/zinc/12/45/26/331124526.db2.gz	WXRGOTFMVXLENL-RZFFKMDDSA-N	1	0	277.433	4.010	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1[NH2+][C@H](C)c1ccc(SC(C)C)cc1	ZINC000453376560	331124992	/nfs/dbraw/zinc/12/49/92/331124992.db2.gz	XMLWFCRIOIQUFY-XYPHTWIQSA-N	1	0	291.460	4.181	20	30		CIEDRO
C=CCC[C@H](CO)[NH2+][C@@H](C)c1cc2cc(Cl)ccc2o1	ZINC000453380915	331125778	/nfs/dbraw/zinc/12/57/78/331125778.db2.gz	ZQNYHEXEUHRLOG-SMDDNHRTSA-N	1	0	293.794	4.064	20	30		CIEDRO
CCC[C@H]([NH2+]Cc1ccc(C#N)c(F)c1)c1ccsc1	ZINC000453391175	331127299	/nfs/dbraw/zinc/12/72/99/331127299.db2.gz	SNEIFIMTRVVWIG-INIZCTEOSA-N	1	0	288.391	4.390	20	30		CIEDRO
C[C@H](CC(C)(C)C)[NH2+]Cc1cccc(OCCCC#N)c1	ZINC000453601268	331135930	/nfs/dbraw/zinc/13/59/30/331135930.db2.gz	NEAFPSHWZHBZIK-OAHLLOKOSA-N	1	0	288.435	4.283	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](C)c1cc2cccc(OC)c2o1	ZINC000164629851	331269231	/nfs/dbraw/zinc/26/92/31/331269231.db2.gz	CZVHQKIVGNEDKG-NEPJUHHUSA-N	1	0	259.349	4.057	20	30		CIEDRO
CC(C)(CC#N)C[NH2+]Cc1cccc(Cl)c1Cl	ZINC000459688877	331294580	/nfs/dbraw/zinc/29/45/80/331294580.db2.gz	HSRLTUUWYAXOAZ-UHFFFAOYSA-N	1	0	271.191	4.023	20	30		CIEDRO
C[C@@H](CC(C)(C)c1ccccc1)[NH2+]CC(C)(C)CC#N	ZINC000459659965	331292633	/nfs/dbraw/zinc/29/26/33/331292633.db2.gz	AKXXPUXTRHBBPG-HNNXBMFYSA-N	1	0	272.436	4.272	20	30		CIEDRO
CC(C)(CC#N)C[NH2+]Cc1cc(-c2ccccc2)cs1	ZINC000459687556	331294540	/nfs/dbraw/zinc/29/45/40/331294540.db2.gz	GVJGHUKVYNFTPU-UHFFFAOYSA-N	1	0	284.428	4.445	20	30		CIEDRO
CC(C)(CC#N)C[NH2+]Cc1ccc(-c2ccc(F)cc2)o1	ZINC000459692558	331294707	/nfs/dbraw/zinc/29/47/07/331294707.db2.gz	MCBYWEDMDPGJLV-UHFFFAOYSA-N	1	0	286.350	4.115	20	30		CIEDRO
C[N@H+](CCC(C)(C)C#N)[C@H]1CCC[C@H]1c1ccccc1	ZINC000459699053	331294952	/nfs/dbraw/zinc/29/49/52/331294952.db2.gz	LMZUISNZDMSVFQ-IRXDYDNUSA-N	1	0	270.420	4.194	20	30		CIEDRO
C=CCOc1cccc(C[NH2+]C2CCC(C(F)F)CC2)c1	ZINC000459722183	331295913	/nfs/dbraw/zinc/29/59/13/331295913.db2.gz	ZVBOFGZMJQKTFU-UHFFFAOYSA-N	1	0	295.373	4.165	20	30		CIEDRO
C[C@H]([NH2+]CC(C)(C)CC#N)[C@@H]1C[C@H]1c1ccc(Cl)s1	ZINC000459732765	331296625	/nfs/dbraw/zinc/29/66/25/331296625.db2.gz	PGMJGYLNKLALLV-SDDRHHMPSA-N	1	0	296.867	4.423	20	30		CIEDRO
CC(C)(CC#N)C[NH2+]Cc1c(Cl)oc2ccccc21	ZINC000459735462	331296912	/nfs/dbraw/zinc/29/69/12/331296912.db2.gz	SXNDGKXCAVWDON-UHFFFAOYSA-N	1	0	276.767	4.116	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](c1ccccc1)c1ccc(OC)cc1	ZINC000166147040	331306731	/nfs/dbraw/zinc/30/67/31/331306731.db2.gz	MODIARSQVHPFEA-HNAYVOBHSA-N	1	0	281.399	4.339	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1ccc(Br)cc1	ZINC000168054355	331308596	/nfs/dbraw/zinc/30/85/96/331308596.db2.gz	JYEDUGSIJRFJBZ-NSHDSACASA-N	1	0	268.198	4.066	20	30		CIEDRO
C=CCC[N@@H+](CCc1ccc(C)cc1)Cc1ccco1	ZINC000461750598	331314493	/nfs/dbraw/zinc/31/44/93/331314493.db2.gz	PZFFIUTWGYJURG-UHFFFAOYSA-N	1	0	269.388	4.209	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+]C[C@H](c1ccco1)N1CCCC1	ZINC000461817570	331314892	/nfs/dbraw/zinc/31/48/92/331314892.db2.gz	AOIJIBWKKREHMS-IAGOWNOFSA-N	1	0	290.451	4.141	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+]C[C@H](c1ccco1)N1CCCC1	ZINC000461817569	331314896	/nfs/dbraw/zinc/31/48/96/331314896.db2.gz	AOIJIBWKKREHMS-DLBZAZTESA-N	1	0	290.451	4.141	20	30		CIEDRO
CCC[C@@H](CCc1ccccc1)[NH2+]Cc1cccc(C#N)c1	ZINC000462731081	331325906	/nfs/dbraw/zinc/32/59/06/331325906.db2.gz	LWYIHQXNPBRSNM-FQEVSTJZSA-N	1	0	292.426	4.449	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H](C)C[C@@H](C)CC)cc1OC	ZINC000462734780	331326133	/nfs/dbraw/zinc/32/61/33/331326133.db2.gz	OUOROBIRWZKJIX-GJZGRUSLSA-N	1	0	291.435	4.174	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]C(CC)(CC)CC)cc1OC	ZINC000462762468	331327796	/nfs/dbraw/zinc/32/77/96/331327796.db2.gz	KDMMAQFZBHUCAI-UHFFFAOYSA-N	1	0	291.435	4.318	20	30		CIEDRO
CC(C)(C)C[N@H+](CCC#N)C[C@@H]1C[C@H]1c1ccccc1	ZINC000463099561	331340254	/nfs/dbraw/zinc/34/02/54/331340254.db2.gz	QTNWXPXLRFVCTG-IRXDYDNUSA-N	1	0	270.420	4.052	20	30		CIEDRO
CCC[C@H](CCc1ccccc1)[NH2+][C@@H]1CCC[C@@H](C#N)C1	ZINC000463236183	331343408	/nfs/dbraw/zinc/34/34/08/331343408.db2.gz	KFZZSXZVZUHTJS-GUDVDZBRSA-N	1	0	284.447	4.460	20	30		CIEDRO
CCC(CC)(C[NH2+][C@@H]1CCC[C@@H](C#N)C1)c1ccccc1	ZINC000463238534	331343617	/nfs/dbraw/zinc/34/36/17/331343617.db2.gz	RFBYPVRJZSCMCN-SJLPKXTDSA-N	1	0	284.447	4.416	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CCC[C@H](C#N)C1)C(C)(C)c1ccccc1	ZINC000463240479	331343718	/nfs/dbraw/zinc/34/37/18/331343718.db2.gz	QXNXOYKQUFQZLG-SZMVWBNQSA-N	1	0	284.447	4.415	20	30		CIEDRO
C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+][C@@H]1CCC[C@H](C#N)C1	ZINC000463241734	331343866	/nfs/dbraw/zinc/34/38/66/331343866.db2.gz	HOKXXXBPVQFZEB-KYZVSKTDSA-N	1	0	286.394	4.121	20	30		CIEDRO
C[C@@H]([C@H](C)[NH2+][C@@H]1CCC[C@H](C#N)C1)C1CCCCC1	ZINC000463243925	331343956	/nfs/dbraw/zinc/34/39/56/331343956.db2.gz	FHQMUZHRQQHUGK-QBYUYEEZSA-N	1	0	262.441	4.263	20	30		CIEDRO
CCC[C@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)C1CCCCC1	ZINC000463293244	331345548	/nfs/dbraw/zinc/34/55/48/331345548.db2.gz	GCUMZGHGUVDIRR-PVAVHDDUSA-N	1	0	262.441	4.407	20	30		CIEDRO
CC(C)(C[NH2+][C@H]1CCC[C@@H](C#N)C1)c1ccc(Cl)cc1	ZINC000463296678	331345665	/nfs/dbraw/zinc/34/56/65/331345665.db2.gz	WGQZAFXVKSGWQE-CJNGLKHVSA-N	1	0	290.838	4.290	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+]CC2(c3ccccc3)CCCC2)C1	ZINC000463301474	331345743	/nfs/dbraw/zinc/34/57/43/331345743.db2.gz	MNWASBAWIHKZAM-WMZOPIPTSA-N	1	0	282.431	4.170	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+]CC2(c3ccccc3)CCCC2)C1	ZINC000463301071	331345764	/nfs/dbraw/zinc/34/57/64/331345764.db2.gz	MNWASBAWIHKZAM-AEFFLSMTSA-N	1	0	282.431	4.170	20	30		CIEDRO
CC(C)c1ccc(CCC[NH2+][C@H]2CCC[C@H](C#N)C2)cc1	ZINC000463305574	331345862	/nfs/dbraw/zinc/34/58/62/331345862.db2.gz	UFQNUMOQOSWEIR-HKUYNNGSSA-N	1	0	284.447	4.415	20	30		CIEDRO
C[N@H+](CCCC(C)(C)C#N)[C@H]1CCCC[C@H]1C(F)(F)F	ZINC000463449783	331347935	/nfs/dbraw/zinc/34/79/35/331347935.db2.gz	QXVYEXOEAOJBFA-OLZOCXBDSA-N	1	0	290.373	4.369	20	30		CIEDRO
Cc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2cccc(C#N)c2)o1	ZINC000464832567	331370270	/nfs/dbraw/zinc/37/02/70/331370270.db2.gz	MJNOIJQXUCPXLZ-KDOFPFPSSA-N	1	0	294.398	4.433	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1ccc(OCc2ccncc2)cc1	ZINC000466382993	331394274	/nfs/dbraw/zinc/39/42/74/331394274.db2.gz	JGWFHLFLCNPLLX-GOSISDBHSA-N	1	0	296.414	4.105	20	30		CIEDRO
Cc1cc(C[NH2+]CC[C@H](C)c2ccccc2)ccc1C#N	ZINC000466398525	331394855	/nfs/dbraw/zinc/39/48/55/331394855.db2.gz	ZPVJUUCTDSLVJB-HNNXBMFYSA-N	1	0	278.399	4.150	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1ccc(OC)c(OCC(=C)C)c1	ZINC000466400890	331395082	/nfs/dbraw/zinc/39/50/82/331395082.db2.gz	GAORFLZPLGICFG-INIZCTEOSA-N	1	0	289.419	4.094	20	30		CIEDRO
CCC[C@@H]1CCC[N@@H+]([C@@H](C)c2ccc(C#N)cc2)C1	ZINC000466482520	331398244	/nfs/dbraw/zinc/39/82/44/331398244.db2.gz	RPVJQYNWWPOFEF-GOEBONIOSA-N	1	0	256.393	4.131	20	30		CIEDRO
C[C@H]([NH2+]CC#Cc1ccc(F)cc1)c1cc2ccccc2o1	ZINC000467265251	331413192	/nfs/dbraw/zinc/41/31/92/331413192.db2.gz	GGIBXZILNWBHEY-AWEZNQCLSA-N	1	0	293.341	4.274	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@@H](C)[C@@H](C)c1ccc(OC)cc1	ZINC000467405781	331417850	/nfs/dbraw/zinc/41/78/50/331417850.db2.gz	HHZFXNFMZBPHNA-YCPHGPKFSA-N	1	0	261.409	4.132	20	30		CIEDRO
Cc1cc([C@H](C)[NH2+]CCc2cccc(C#N)c2)cc(C)c1F	ZINC000467427842	331418658	/nfs/dbraw/zinc/41/86/58/331418658.db2.gz	FDLCIFXFMWCEAW-HNNXBMFYSA-N	1	0	296.389	4.208	20	30		CIEDRO
CSc1ccc([C@@H](C)[NH2+]CCc2cccc(C#N)c2)cc1	ZINC000467435388	331419038	/nfs/dbraw/zinc/41/90/38/331419038.db2.gz	YBAFTEVOZUFYGP-CQSZACIVSA-N	1	0	296.439	4.173	20	30		CIEDRO
Cc1ccc(CC[C@H](C)[NH2+]CCc2cccc(C#N)c2)cc1	ZINC000467444108	331419731	/nfs/dbraw/zinc/41/97/31/331419731.db2.gz	NKNGBTXQUBHZPE-KRWDZBQOSA-N	1	0	292.426	4.020	20	30		CIEDRO
CC[C@H](CC#N)[NH2+][C@@H]1CCC[C@@H]1c1ccccc1Cl	ZINC000468474113	331435323	/nfs/dbraw/zinc/43/53/23/331435323.db2.gz	CNIZBNOINUBCQN-XNRPHZJLSA-N	1	0	276.811	4.258	20	30		CIEDRO
N#Cc1ccc(C[NH2+]C2CCC3(CCCCC3)CC2)o1	ZINC000468830087	331440078	/nfs/dbraw/zinc/44/00/78/331440078.db2.gz	DUPMMACJNQLSBL-UHFFFAOYSA-N	1	0	272.392	4.134	20	30		CIEDRO
CC[NH+](CC)CCCSc1ccc(C#N)cc1Cl	ZINC000470455525	331483005	/nfs/dbraw/zinc/48/30/05/331483005.db2.gz	LKPINAZDFSMNJB-UHFFFAOYSA-N	1	0	282.840	4.036	20	30		CIEDRO
C=CCOCCC[NH2+][C@H](C)c1ccc(Cl)c(Cl)c1	ZINC000470767843	331489859	/nfs/dbraw/zinc/48/98/59/331489859.db2.gz	XKUFYRAFBLLGEQ-LLVKDONJSA-N	1	0	288.218	4.237	20	30		CIEDRO
C=CCOCCC[NH2+][C@@H](C)c1ccc(SC(C)C)cc1	ZINC000470779927	331490863	/nfs/dbraw/zinc/49/08/63/331490863.db2.gz	OPKWIBCEEOXSTE-HNNXBMFYSA-N	1	0	293.476	4.430	20	30		CIEDRO
C=C[C@H](C)[NH2+][C@H](C)CCc1ccc(C(F)(F)F)cc1	ZINC000510714263	332913002	/nfs/dbraw/zinc/91/30/02/332913002.db2.gz	LKAZZRAXNFQSQA-NWDGAFQWSA-N	1	0	271.326	4.191	20	30		CIEDRO
CC(C)[NH+](CCCNc1cc(Cl)ccc1C#N)C(C)C	ZINC000470872870	331493460	/nfs/dbraw/zinc/49/34/60/331493460.db2.gz	LKMGXQKBICYEEV-UHFFFAOYSA-N	1	0	293.842	4.132	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@H](c2ccc(F)cc2)C2CCCC2)C1	ZINC000471584845	331511250	/nfs/dbraw/zinc/51/12/50/331511250.db2.gz	IGSKPPYZVMEFPB-BVGQSLNGSA-N	1	0	286.394	4.339	20	30		CIEDRO
N#C[C@H]1CC[C@H]([NH2+]Cc2cccc(Oc3ccccc3)c2)C1	ZINC000472145072	331530324	/nfs/dbraw/zinc/53/03/24/331530324.db2.gz	AONZVAWWOSPBEK-RDJZCZTQSA-N	1	0	292.382	4.261	20	30		CIEDRO
CC[C@H](CC#N)[NH2+][C@H](C)[C@@H](C)c1ccc(Cl)cc1	ZINC000474930858	331604846	/nfs/dbraw/zinc/60/48/46/331604846.db2.gz	SPQCBAJAJXGGRB-LALPHHSUSA-N	1	0	264.800	4.114	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@H](c1ccc(C)cc1)c1ccccn1	ZINC000475338885	331627705	/nfs/dbraw/zinc/62/77/05/331627705.db2.gz	SXHVCPBXRNVZFF-QFBILLFUSA-N	1	0	280.415	4.424	20	30		CIEDRO
CC(C)c1ccc([C@H](C)[NH+]2CCC(F)(C#N)CC2)cc1	ZINC000510948196	332921634	/nfs/dbraw/zinc/92/16/34/332921634.db2.gz	GHFUQRADRQDZKT-AWEZNQCLSA-N	1	0	274.383	4.199	20	30		CIEDRO
Cc1cccc([C@@H]([NH2+]CCCC#N)c2cccc(F)c2)c1	ZINC000510983151	332922818	/nfs/dbraw/zinc/92/28/18/332922818.db2.gz	GYWVLIORTUJDON-GOSISDBHSA-N	1	0	282.362	4.117	20	30		CIEDRO
CC#CCC[NH+]1CCC(C)(c2nc3ccccc3s2)CC1	ZINC000511073853	332926395	/nfs/dbraw/zinc/92/63/95/332926395.db2.gz	NIDHVRHLBNEHGZ-UHFFFAOYSA-N	1	0	298.455	4.063	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CC[C@H](c3ccccc3F)C2)cc1	ZINC000481808360	331816321	/nfs/dbraw/zinc/81/63/21/331816321.db2.gz	AFYLCMGJFLNLLC-DLBZAZTESA-N	1	0	294.373	4.123	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@H]1CC[C@@H](c2ccccc2F)C1	ZINC000482078529	331822849	/nfs/dbraw/zinc/82/28/49/331822849.db2.gz	HEBJGYDXVHEWBJ-ZNMIVQPWSA-N	1	0	261.384	4.406	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@H](c3ccccc3F)C2)C1	ZINC000482077973	331823345	/nfs/dbraw/zinc/82/33/45/331823345.db2.gz	QJKFULXSAZVXSV-FXUDXRNXSA-N	1	0	286.394	4.134	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+][C@@H](C)Cc1cccc(O)c1	ZINC000482514008	331836131	/nfs/dbraw/zinc/83/61/31/331836131.db2.gz	XTGKRZXZEFPHED-GOEBONIOSA-N	1	0	261.409	4.048	20	30		CIEDRO
CCC1(Cc2ccccc2)CC[NH+](CC2(C#N)CC2)CC1	ZINC000483117375	331858482	/nfs/dbraw/zinc/85/84/82/331858482.db2.gz	GYFYDSSFLHUAAY-UHFFFAOYSA-N	1	0	282.431	4.025	20	30		CIEDRO
C[C@H](CC1CCCCC1)[NH2+]Cc1ccc(C#N)s1	ZINC000487159544	331957511	/nfs/dbraw/zinc/95/75/11/331957511.db2.gz	RLFBJORCEZZRDM-GFCCVEGCSA-N	1	0	262.422	4.068	20	30		CIEDRO
C=CCCCCC[NH+]1CCC(c2noc(C(C)C)n2)CC1	ZINC000487871527	331982858	/nfs/dbraw/zinc/98/28/58/331982858.db2.gz	MJQLDOZNJXQQAW-UHFFFAOYSA-N	1	0	291.439	4.119	20	30		CIEDRO
C=CCCCCC[NH2+][C@H](C[C@H]1CCOC1)c1ccccc1	ZINC000488134023	331991611	/nfs/dbraw/zinc/99/16/11/331991611.db2.gz	ZOJRROPXSXAYHO-IEBWSBKVSA-N	1	0	287.447	4.490	20	30		CIEDRO
Cc1cc(C[NH2+][C@H](C)c2ccc(Cl)cc2)ccc1C#N	ZINC000488200081	331993528	/nfs/dbraw/zinc/99/35/28/331993528.db2.gz	RDXMRNVHCYCXMC-CYBMUJFWSA-N	1	0	284.790	4.371	20	30		CIEDRO
CC(C)(C)C[C@@H]1CCC[N@@H+]1Cc1ccc(C#N)cc1F	ZINC000488410257	332005025	/nfs/dbraw/zinc/00/50/25/332005025.db2.gz	JRPOELWMMSKKJH-HNNXBMFYSA-N	1	0	274.383	4.098	20	30		CIEDRO
N#Cc1cc(F)ccc1C[N@H+](CC1CC1)C1CCCCC1	ZINC000488419952	332006018	/nfs/dbraw/zinc/00/60/18/332006018.db2.gz	MSXFDMLEDOKESZ-UHFFFAOYSA-N	1	0	286.394	4.242	20	30		CIEDRO
Cc1cc(C[N@H+]2C[C@@H](C)[C@@H]2c2ccccc2)ccc1C#N	ZINC000488470735	332012348	/nfs/dbraw/zinc/01/23/48/332012348.db2.gz	VMJBWTHRSZRSGA-DNVCBOLYSA-N	1	0	276.383	4.060	20	30		CIEDRO
C=CC1CC[NH+]([C@H](C)c2ccc(Br)cc2)CC1	ZINC000488597150	332020030	/nfs/dbraw/zinc/02/00/30/332020030.db2.gz	OKQUAGGPNFLNOS-GFCCVEGCSA-N	1	0	294.236	4.408	20	30		CIEDRO
C[C@@H](c1cccc(C#N)c1)[N@@H+]1CC[C@H](Cc2ccccc2)C1	ZINC000489265459	332044576	/nfs/dbraw/zinc/04/45/76/332044576.db2.gz	CUQGUMYZFQXPNS-QFBILLFUSA-N	1	0	290.410	4.184	20	30		CIEDRO
CC[C@H](C)[N@H+](Cc1ccccc1)Cc1ccc(F)cc1C#N	ZINC000489617277	332061795	/nfs/dbraw/zinc/06/17/95/332061795.db2.gz	BAUWYMXBCDOLNJ-HNNXBMFYSA-N	1	0	296.389	4.498	20	30		CIEDRO
Cc1ccccc1CN(Cc1ccc(F)cc1C#N)C1CC1	ZINC000489625916	332061988	/nfs/dbraw/zinc/06/19/88/332061988.db2.gz	VRECUYIOYGCNNK-UHFFFAOYSA-N	1	0	294.373	4.170	20	30		CIEDRO
N#Cc1cc(F)ccc1C[NH+]1CCC2(CCCCC2)CC1	ZINC000489652451	332063256	/nfs/dbraw/zinc/06/32/56/332063256.db2.gz	WDKGGCNKVMNEBH-UHFFFAOYSA-N	1	0	286.394	4.244	20	30		CIEDRO
C=CC[N@H+](Cc1ccc(Cl)s1)C[C@H]1CCO[C@H](C)C1	ZINC000491939736	332376103	/nfs/dbraw/zinc/37/61/03/332376103.db2.gz	MMHNZJIUOMYIFU-OLZOCXBDSA-N	1	0	299.867	4.205	20	30		CIEDRO
C=CC[N@H+](Cc1ccc(Cl)s1)C[C@H]1CCO[C@@H](C)C1	ZINC000491939739	332376136	/nfs/dbraw/zinc/37/61/36/332376136.db2.gz	MMHNZJIUOMYIFU-STQMWFEESA-N	1	0	299.867	4.205	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](C)c1ccc(Br)c(F)c1	ZINC000129637921	333784600	/nfs/dbraw/zinc/78/46/00/333784600.db2.gz	BZEBJIFXXGVNOH-ZJUUUORDSA-N	1	0	286.188	4.203	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+]C[C@@H]1CCCCC(F)(F)C1	ZINC000494993002	332498398	/nfs/dbraw/zinc/49/83/98/332498398.db2.gz	AVBMUMSQDVXUBK-MELADBBJSA-N	1	0	259.384	4.392	20	30		CIEDRO
CCC(CC)[NH2+]C1CCC(C#N)(c2ccccc2)CC1	ZINC000500017235	332597643	/nfs/dbraw/zinc/59/76/43/332597643.db2.gz	QNKKXQQHEKYJSM-UHFFFAOYSA-N	1	0	270.420	4.169	20	30		CIEDRO
C=CCCCC[NH2+][C@@H]1CCC[C@@H](c2cccnc2)C1	ZINC000500367840	332605347	/nfs/dbraw/zinc/60/53/47/332605347.db2.gz	CMGOFYNWWQVBCJ-NVXWUHKLSA-N	1	0	258.409	4.054	20	30		CIEDRO
C=C[C@H](C)[NH2+]C/C(C)=C\c1ccccc1C(F)(F)F	ZINC000500381181	332605819	/nfs/dbraw/zinc/60/58/19/332605819.db2.gz	FFCIIUJUGOHOME-MMRAYRKESA-N	1	0	269.310	4.273	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)c1ccccc1Cl	ZINC000248716382	334314356	/nfs/dbraw/zinc/31/43/56/334314356.db2.gz	BWWIKVDEWFEDBC-YNEHKIRRSA-N	1	0	262.784	4.073	20	30		CIEDRO
CC[C@@H]1C[C@@]1([NH2+]Cc1cccc(C#N)c1)c1cccc(C)c1	ZINC000500494131	332611187	/nfs/dbraw/zinc/61/11/87/332611187.db2.gz	CNQARWVDYWTJNC-QUCCMNQESA-N	1	0	290.410	4.282	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@@H]1CCCC(F)(F)C1)C1CC1	ZINC000502597501	332667041	/nfs/dbraw/zinc/66/70/41/332667041.db2.gz	VCGACLZAXZDPGC-TZMCWYRMSA-N	1	0	257.368	4.146	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+][C@H]1C[C@H](c2ccc(OC)c(F)c2)C1	ZINC000503853805	332696618	/nfs/dbraw/zinc/69/66/18/332696618.db2.gz	GAOTVCJSBATGNI-BZUAXINKSA-N	1	0	291.410	4.415	20	30		CIEDRO
C[C@@H]([NH2+]CC1CCC(F)(F)CC1)c1ccc(C#N)cc1F	ZINC000503941552	332700200	/nfs/dbraw/zinc/70/02/00/332700200.db2.gz	JXMKKRRQJQBLBL-LLVKDONJSA-N	1	0	296.336	4.173	20	30		CIEDRO
C=C(C)CN1CCC([NH2+][C@H]2C[C@@H](C)c3c2cccc3C)CC1	ZINC000504925967	332725355	/nfs/dbraw/zinc/72/53/55/332725355.db2.gz	GCLGNHAPDZFYNQ-APWZRJJASA-N	1	0	298.474	4.173	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@@H]1COc2ccccc21)c1ccco1	ZINC000516598642	332744706	/nfs/dbraw/zinc/74/47/06/332744706.db2.gz	CCWUTLWNVQVKKP-GDBMZVCRSA-N	1	0	283.371	4.053	20	30		CIEDRO
C=C(C[NH2+][C@@H](C)c1ccc(C#N)cc1F)c1ccccc1	ZINC000512284388	332961533	/nfs/dbraw/zinc/96/15/33/332961533.db2.gz	XUBVCVVYOJCQEX-AWEZNQCLSA-N	1	0	280.346	4.061	20	30		CIEDRO
C=C(C)C[NH2+]Cc1cc(-c2ccccc2)ccc1OC	ZINC000512374785	332965387	/nfs/dbraw/zinc/96/53/87/332965387.db2.gz	IQFAJQMYMBQPQU-UHFFFAOYSA-N	1	0	267.372	4.028	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]Cc2sccc2Cl)cc1	ZINC000512512163	332971402	/nfs/dbraw/zinc/97/14/02/332971402.db2.gz	QXRVFLXNNIXFPD-UHFFFAOYSA-N	1	0	293.819	4.256	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1C[C@H](C)C[C@H](C)C1)c1ccc(C#N)cc1F	ZINC000512660915	332978540	/nfs/dbraw/zinc/97/85/40/332978540.db2.gz	PIYJBVHVOHLZCY-COMQUAJESA-N	1	0	274.383	4.173	20	30		CIEDRO
C[C@H](CCc1ccccc1)[NH2+][C@H](C)c1ccc(C#N)cc1F	ZINC000512661762	332978580	/nfs/dbraw/zinc/97/85/80/332978580.db2.gz	UCGAYYGXCISZGT-HUUCEWRRSA-N	1	0	296.389	4.369	20	30		CIEDRO
COc1cccc([C@@H](C)[NH2+][C@H](C)c2ccc(C#N)cc2F)c1	ZINC000512668299	332979006	/nfs/dbraw/zinc/97/90/06/332979006.db2.gz	ULAWYHADKUFLHM-CHWSQXEVSA-N	1	0	298.361	4.118	20	30		CIEDRO
CC[C@@H]1CCC[C@@H]([NH2+][C@H](C)c2ccc(C#N)cc2F)C1	ZINC000512666748	332979185	/nfs/dbraw/zinc/97/91/85/332979185.db2.gz	LXPQFOYZDLXXGP-UMVBOHGHSA-N	1	0	274.383	4.317	20	30		CIEDRO
Cc1ccccc1OCCC[N@@H+](C)CCCC(C)(C)C#N	ZINC000174830531	333007959	/nfs/dbraw/zinc/00/79/59/333007959.db2.gz	RYGVBIPVLVEPFO-UHFFFAOYSA-N	1	0	288.435	4.026	20	30		CIEDRO
C[N@H+](CCCC(C)(C)C#N)Cc1ccccc1C(F)(F)F	ZINC000174815532	333008056	/nfs/dbraw/zinc/00/80/56/333008056.db2.gz	MGJXPPHNEMKLJK-UHFFFAOYSA-N	1	0	298.352	4.467	20	30		CIEDRO
CC(C)(C#N)CCC[N@H+](CC1CC1)C1CCCCC1	ZINC000174844314	333008931	/nfs/dbraw/zinc/00/89/31/333008931.db2.gz	ZYCJMGMPDBQMJL-UHFFFAOYSA-N	1	0	262.441	4.361	20	30		CIEDRO
CC(C)(C#N)CCC[N@H+](CCc1cccc(F)c1)C1CC1	ZINC000174862749	333009449	/nfs/dbraw/zinc/00/94/49/333009449.db2.gz	BNJKJXMPLCMPNZ-UHFFFAOYSA-N	1	0	288.410	4.163	20	30		CIEDRO
C[C@@H]1C[C@H](c2ccccc2)[N@H+](Cc2ccc(F)c(C#N)c2)C1	ZINC000513254814	333011055	/nfs/dbraw/zinc/01/10/55/333011055.db2.gz	BZAJGMNIEDRQFL-AUUYWEPGSA-N	1	0	294.373	4.280	20	30		CIEDRO
C[C@@H]1C[C@@H](c2ccccc2)[N@H+](Cc2cccc(C#N)c2)C1	ZINC000513256312	333011177	/nfs/dbraw/zinc/01/11/77/333011177.db2.gz	LNQDQRIMFXINJT-BEFAXECRSA-N	1	0	276.383	4.141	20	30		CIEDRO
C=C1CC[NH+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1	ZINC000513444589	333019676	/nfs/dbraw/zinc/01/96/76/333019676.db2.gz	VRQSCCMEAOHSPU-UHFFFAOYSA-N	1	0	298.342	4.007	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCOc1cccc(F)c1)c1ccco1	ZINC000513665905	333030715	/nfs/dbraw/zinc/03/07/15/333030715.db2.gz	IEORMPJUFKCEAR-MRXNPFEDSA-N	1	0	289.350	4.095	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccc(C)c(OC)c1)c1ccco1	ZINC000513666071	333030837	/nfs/dbraw/zinc/03/08/37/333030837.db2.gz	JHQJMBVGHPLBJM-INIZCTEOSA-N	1	0	285.387	4.394	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCOC1CCCCC1)c1ccco1	ZINC000513683185	333032024	/nfs/dbraw/zinc/03/20/24/333032024.db2.gz	HNVKDTSTTGPKKU-INIZCTEOSA-N	1	0	277.408	4.226	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1cccc(C)c1)c1ccco1	ZINC000513762693	333037922	/nfs/dbraw/zinc/03/79/22/333037922.db2.gz	SJNWLEVGIMTFFN-MRXNPFEDSA-N	1	0	255.361	4.385	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]C1CC(c2ccc(F)cc2)C1	ZINC000311712347	333071495	/nfs/dbraw/zinc/07/14/95/333071495.db2.gz	OBGBFIMKYRYFLY-UHFFFAOYSA-N	1	0	261.384	4.264	20	30		CIEDRO
C=CCCC[NH2+][C@@H]1CCCc2c3ccccc3[nH]c21	ZINC000311991617	333075293	/nfs/dbraw/zinc/07/52/93/333075293.db2.gz	VTALXYIQLCJTBQ-MRXNPFEDSA-N	1	0	254.377	4.101	20	30		CIEDRO
C=CCCC[NH2+][C@H]1CCCc2c3ccccc3[nH]c21	ZINC000311991616	333075358	/nfs/dbraw/zinc/07/53/58/333075358.db2.gz	VTALXYIQLCJTBQ-INIZCTEOSA-N	1	0	254.377	4.101	20	30		CIEDRO
C=CCCCC[N@@H+]1CC2(CCOCC2)[C@@H]1c1ccccc1	ZINC000516913212	333086307	/nfs/dbraw/zinc/08/63/07/333086307.db2.gz	DCMXTSKDSVGYPN-SFHVURJKSA-N	1	0	285.431	4.196	20	30		CIEDRO
N#CCCC1CC[NH+](C/C=C\c2ccc(Cl)cc2)CC1	ZINC000517027521	333090240	/nfs/dbraw/zinc/09/02/40/333090240.db2.gz	KZQMYICRRZOPLQ-RQOWECAXSA-N	1	0	288.822	4.369	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H]2CCC[C@@H]2C)cc1Cl	ZINC000517545146	333101740	/nfs/dbraw/zinc/10/17/40/333101740.db2.gz	FNAGOWJSJASNAQ-SWLSCSKDSA-N	1	0	279.811	4.183	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]C[C@H](C)c2ccc(F)cc2)cc1	ZINC000517545180	333101746	/nfs/dbraw/zinc/10/17/46/333101746.db2.gz	GNQOMVOBMCNNAQ-HNNXBMFYSA-N	1	0	299.389	4.284	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H]2CCC[C@H]2C)cc1Cl	ZINC000517545144	333101752	/nfs/dbraw/zinc/10/17/52/333101752.db2.gz	FNAGOWJSJASNAQ-DOMZBBRYSA-N	1	0	279.811	4.183	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]C[C@@H](C)c2ccc(F)cc2)cc1	ZINC000517545182	333101777	/nfs/dbraw/zinc/10/17/77/333101777.db2.gz	GNQOMVOBMCNNAQ-OAHLLOKOSA-N	1	0	299.389	4.284	20	30		CIEDRO
CCC[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(C#N)cc1	ZINC000517549672	333101984	/nfs/dbraw/zinc/10/19/84/333101984.db2.gz	BZEHPZVUWKKITN-IAGOWNOFSA-N	1	0	256.393	4.007	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]C[C@H]2CCc3ccccc32)cc1	ZINC000517712149	333106570	/nfs/dbraw/zinc/10/65/70/333106570.db2.gz	UHTRKBSJTUMPEA-GOSISDBHSA-N	1	0	293.410	4.071	20	30		CIEDRO
N#Cc1ccc(CNc2ccc(-c3ccccc3)cn2)s1	ZINC000184288142	333126595	/nfs/dbraw/zinc/12/65/95/333126595.db2.gz	NNNQQCPWJAHZAZ-UHFFFAOYSA-N	1	0	291.379	4.294	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)c1cccc(Cl)c1	ZINC000185777394	333148435	/nfs/dbraw/zinc/14/84/35/333148435.db2.gz	WTVRZPKMRYMKDG-MAZHCROVSA-N	1	0	276.811	4.463	20	30		CIEDRO
CCC[C@H](Cc1ccccc1)[NH2+][C@@H]1CCC[C@H](C#N)C1	ZINC000185811849	333149375	/nfs/dbraw/zinc/14/93/75/333149375.db2.gz	OSGLQAMONNNPHS-RCCFBDPRSA-N	1	0	270.420	4.070	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+]CC2(c3ccc(Cl)cc3)CC2)C1	ZINC000185811095	333149441	/nfs/dbraw/zinc/14/94/41/333149441.db2.gz	BSNGSJCRLSFRIF-BBRMVZONSA-N	1	0	288.822	4.044	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+]CC2(c3cccc(Cl)c3)CC2)C1	ZINC000185837865	333149836	/nfs/dbraw/zinc/14/98/36/333149836.db2.gz	PDZVDNMKKXFABY-XJKSGUPXSA-N	1	0	288.822	4.044	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+]CC2(c3cccc(Cl)c3)CC2)C1	ZINC000185837924	333149883	/nfs/dbraw/zinc/14/98/83/333149883.db2.gz	PDZVDNMKKXFABY-CJNGLKHVSA-N	1	0	288.822	4.044	20	30		CIEDRO
CC1(C)C[C@H]([NH2+][C@H]2CCC[C@H](C#N)C2)c2ccccc21	ZINC000185861719	333150549	/nfs/dbraw/zinc/15/05/49/333150549.db2.gz	NOWFOKCSZOVIMW-ZQIUZPCESA-N	1	0	268.404	4.081	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](C)c1sccc1OC	ZINC000186239755	333157084	/nfs/dbraw/zinc/15/70/84/333157084.db2.gz	IBRFFLUXRSEPOF-RYUDHWBXSA-N	1	0	253.411	4.152	20	30		CIEDRO
CC(C)C[N@H+](Cc1cccc(C#N)c1F)C1CCCC1	ZINC000223527281	333209075	/nfs/dbraw/zinc/20/90/75/333209075.db2.gz	ZAYYJTOYAMZGKO-UHFFFAOYSA-N	1	0	274.383	4.098	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+]Cc1ccc(CC)cc1	ZINC000223991570	333214977	/nfs/dbraw/zinc/21/49/77/333214977.db2.gz	ZMITZPYHBPXGEU-UHFFFAOYSA-N	1	0	281.399	4.104	20	30		CIEDRO
C=C(C)C[N@H+](CCC(F)(F)F)Cc1ccccc1	ZINC000191238171	333217136	/nfs/dbraw/zinc/21/71/36/333217136.db2.gz	VGDGGNBKHICYIF-UHFFFAOYSA-N	1	0	257.299	4.017	20	30		CIEDRO
CC(C)(C#N)CCC[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1	ZINC000191366007	333218717	/nfs/dbraw/zinc/21/87/17/333218717.db2.gz	AMLPORNBOOYUNG-MSOLQXFVSA-N	1	0	284.447	4.317	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](C)c1cnn(C(C)(C)C)c1C	ZINC000191414082	333219366	/nfs/dbraw/zinc/21/93/66/333219366.db2.gz	VOZKDZWIWYFYBV-KBPBESRZSA-N	1	0	277.456	4.342	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C#N)c(F)c1)c1cccc(Cl)c1	ZINC000192146837	333230779	/nfs/dbraw/zinc/23/07/79/333230779.db2.gz	WKDBQYVYJOCSHN-LLVKDONJSA-N	1	0	288.753	4.202	20	30		CIEDRO
N#Cc1ccc(C[NH2+]C2(c3ccccc3)CCCC2)cc1F	ZINC000192157339	333231152	/nfs/dbraw/zinc/23/11/52/333231152.db2.gz	DGUJGBIUAVYKEE-UHFFFAOYSA-N	1	0	294.373	4.256	20	30		CIEDRO
C=CCCCCC[NH2+][C@@H](C)c1nc(Cc2ccccc2)no1	ZINC000193554202	333253057	/nfs/dbraw/zinc/25/30/57/333253057.db2.gz	JBCSUZPRBVJFIR-HNNXBMFYSA-N	1	0	299.418	4.057	20	30		CIEDRO
C[C@@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]CCCCC#N	ZINC000193981151	333262562	/nfs/dbraw/zinc/26/25/62/333262562.db2.gz	NVKLLGCLDKSMJL-ZDUSSCGKSA-N	1	0	298.352	4.310	20	30		CIEDRO
C[C@@H]([NH2+]C[C@@H]1CCC[C@@H](C)C1)c1ccc(C#N)cc1	ZINC000227576877	333286119	/nfs/dbraw/zinc/28/61/19/333286119.db2.gz	RWRGFYZFEDCDFF-IIAWOOMASA-N	1	0	256.393	4.035	20	30		CIEDRO
C[C@@H]([NH2+]C[C@H]1CCC[C@@H](C)C1)c1ccc(C#N)cc1	ZINC000227576886	333286171	/nfs/dbraw/zinc/28/61/71/333286171.db2.gz	RWRGFYZFEDCDFF-FMKPAKJESA-N	1	0	256.393	4.035	20	30		CIEDRO
C=CCOc1cccc(C[NH2+]C(C)(C)c2cccs2)c1	ZINC000522630563	333293422	/nfs/dbraw/zinc/29/34/22/333293422.db2.gz	SGUVVFLHOGSOJR-UHFFFAOYSA-N	1	0	287.428	4.338	20	30		CIEDRO
C=CC[C@H](C)[NH2+]Cc1cccc(OCc2ccccc2F)c1	ZINC000522649701	333294976	/nfs/dbraw/zinc/29/49/76/333294976.db2.gz	YPUCOPNJJPQFSH-HNNXBMFYSA-N	1	0	299.389	4.459	20	30		CIEDRO
CCc1ccc([C@H](C)[NH2+]CC(C)(C)CCC#N)cc1	ZINC000229677423	333307630	/nfs/dbraw/zinc/30/76/30/333307630.db2.gz	DIMJAEWZYUDHTD-AWEZNQCLSA-N	1	0	258.409	4.230	20	30		CIEDRO
CCC[C@@H]([NH2+]CC(C)(C)CCC#N)c1ccccc1	ZINC000229683037	333307786	/nfs/dbraw/zinc/30/77/86/333307786.db2.gz	KVMBPAUVCYTZMK-MRXNPFEDSA-N	1	0	258.409	4.447	20	30		CIEDRO
C=CCCOCC[NH2+][C@H](C)c1ccc(Cl)cc1Cl	ZINC000229860263	333310265	/nfs/dbraw/zinc/31/02/65/333310265.db2.gz	WKPUKTGGZJYOII-LLVKDONJSA-N	1	0	288.218	4.237	20	30		CIEDRO
C[C@@H]([NH2+]CCCC1CCCC1)c1ccc(C#N)cc1	ZINC000231664749	333326962	/nfs/dbraw/zinc/32/69/62/333326962.db2.gz	CKXAGEWLFNPJAI-CQSZACIVSA-N	1	0	256.393	4.179	20	30		CIEDRO
C=CC1CC[NH+](Cc2cccc3ccccc32)CC1	ZINC000523605703	333333903	/nfs/dbraw/zinc/33/39/03/333333903.db2.gz	LZRFVUKZQWRNCC-UHFFFAOYSA-N	1	0	251.373	4.238	20	30		CIEDRO
CC(C)(C)[C@H]1CC[N@H+](CCCCC(C)(C)C#N)C1	ZINC000232518681	333337834	/nfs/dbraw/zinc/33/78/34/333337834.db2.gz	PQBXOZQAEWICDJ-AWEZNQCLSA-N	1	0	250.430	4.074	20	30		CIEDRO
C[C@H]1C[C@@H](c2ccc(F)cc2)C[N@@H+]1Cc1ccc(C#N)cc1	ZINC000524072053	333353103	/nfs/dbraw/zinc/35/31/03/333353103.db2.gz	STISWJNIAAWTJG-KBXCAEBGSA-N	1	0	294.373	4.075	20	30		CIEDRO
CC[C@@H]([NH2+]CCCCC(C)(C)C#N)c1ccccc1	ZINC000233887434	333355638	/nfs/dbraw/zinc/35/56/38/333355638.db2.gz	SLXULMNOELTPAP-MRXNPFEDSA-N	1	0	258.409	4.447	20	30		CIEDRO
CC(C)c1ccc(CCC[NH2+]Cc2cccc(C#N)c2)cc1	ZINC000524197689	333356270	/nfs/dbraw/zinc/35/62/70/333356270.db2.gz	VHEWVDHFRBAGPE-UHFFFAOYSA-N	1	0	292.426	4.404	20	30		CIEDRO
C[N@H+](CCCCC(C)(C)C#N)Cc1ccc(Cl)cc1	ZINC000234272380	333359273	/nfs/dbraw/zinc/35/92/73/333359273.db2.gz	RWORYUZNPGVBKO-UHFFFAOYSA-N	1	0	278.827	4.492	20	30		CIEDRO
COc1ccccc1[C@@H](C)[NH2+]CCCCC(C)(C)C#N	ZINC000234882942	333362679	/nfs/dbraw/zinc/36/26/79/333362679.db2.gz	GVKMNAQPQNTPMN-CQSZACIVSA-N	1	0	274.408	4.066	20	30		CIEDRO
C[C@@H]1CCCC[C@H]1[N@H+](C)CCCCC(C)(C)C#N	ZINC000235249430	333367107	/nfs/dbraw/zinc/36/71/07/333367107.db2.gz	UPWPHXKLEXGAFK-HUUCEWRRSA-N	1	0	250.430	4.217	20	30		CIEDRO
CC[C@H](C)[NH2+]Cc1cccc(OCc2ccccc2C#N)c1	ZINC000237002002	333376997	/nfs/dbraw/zinc/37/69/97/333376997.db2.gz	ZRFGPYYEYALJAH-HNNXBMFYSA-N	1	0	294.398	4.025	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]Cc2ccc(C)cc2C)cc1	ZINC000237748559	333381090	/nfs/dbraw/zinc/38/10/90/333381090.db2.gz	OCQBHZXFGSBDJU-UHFFFAOYSA-N	1	0	281.399	4.158	20	30		CIEDRO
N#Cc1ccc(C[NH2+]CCc2ccc3ccccc3c2)cc1	ZINC000237842496	333381977	/nfs/dbraw/zinc/38/19/77/333381977.db2.gz	AHZWZYISRDUTMU-UHFFFAOYSA-N	1	0	286.378	4.044	20	30		CIEDRO
C=CCC[N@@H+](C)[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000524811954	333389394	/nfs/dbraw/zinc/38/93/94/333389394.db2.gz	UDJCTLCHASGDCG-LLVKDONJSA-N	1	0	257.299	4.274	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@@H](C)[C@H]1C)c1cccc(C#N)c1	ZINC000037215059	333515581	/nfs/dbraw/zinc/51/55/81/333515581.db2.gz	ZXBFAYZRRWDOFZ-VWPFQQQWSA-N	1	0	256.393	4.034	20	30		CIEDRO
CCCC1CCC([NH2+]Cc2cccc(C#N)c2)CC1	ZINC000037748768	333537470	/nfs/dbraw/zinc/53/74/70/333537470.db2.gz	CTNLTPIVTLZMJQ-UHFFFAOYSA-N	1	0	256.393	4.007	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@@H](C)c1ccc(C)cc1	ZINC000037770272	333538088	/nfs/dbraw/zinc/53/80/88/333538088.db2.gz	FBYGTQCJYOYDHY-INIZCTEOSA-N	1	0	281.399	4.411	20	30		CIEDRO
C[C@H]([NH2+]CCSc1ccccc1)c1cccc(C#N)c1	ZINC000037904241	333542507	/nfs/dbraw/zinc/54/25/07/333542507.db2.gz	BBCOMDZTUFHSFO-AWEZNQCLSA-N	1	0	282.412	4.001	20	30		CIEDRO
N#Cc1ccccc1C[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1	ZINC000530359590	333544389	/nfs/dbraw/zinc/54/43/89/333544389.db2.gz	YAXJBIYOHLRDDL-XLIONFOSSA-N	1	0	290.410	4.059	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H](C)c2ccncc2CC)cc1	ZINC000538002294	333570373	/nfs/dbraw/zinc/57/03/73/333570373.db2.gz	LHQKZWMWPFWQFS-HNNXBMFYSA-N	1	0	296.414	4.060	20	30		CIEDRO
CCC1(C[NH2+]C2CCC(C#N)(c3ccccc3)CC2)CC1	ZINC000538017967	333571350	/nfs/dbraw/zinc/57/13/50/333571350.db2.gz	MIJODNPKUOQVEW-UHFFFAOYSA-N	1	0	282.431	4.170	20	30		CIEDRO
N#Cc1cccc(C[NH2+]C2(c3ccccc3)CCCC2)c1F	ZINC000538197610	333578697	/nfs/dbraw/zinc/57/86/97/333578697.db2.gz	PPCKDDULUKZPMW-UHFFFAOYSA-N	1	0	294.373	4.256	20	30		CIEDRO
C=CC1CC[NH+](Cc2ncc(-c3ccccc3)s2)CC1	ZINC000538283463	333582888	/nfs/dbraw/zinc/58/28/88/333582888.db2.gz	XJGVANSZQYJAOS-UHFFFAOYSA-N	1	0	284.428	4.208	20	30		CIEDRO
C[C@H]([NH2+]CC(C)(C)c1cccc(F)c1)c1cccc(C#N)c1	ZINC000538394146	333588263	/nfs/dbraw/zinc/58/82/63/333588263.db2.gz	PFMHVUUZLJLNOI-AWEZNQCLSA-N	1	0	296.389	4.326	20	30		CIEDRO
Cc1cccc([C@H](C)C[NH2+][C@@H](C)c2cccc(C#N)c2)c1	ZINC000538394743	333588276	/nfs/dbraw/zinc/58/82/76/333588276.db2.gz	NSOFOMIRNQNACZ-CVEARBPZSA-N	1	0	278.399	4.321	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@@H]2CCC[C@@H]2C1)c1ccc(C#N)cc1	ZINC000538396155	333588404	/nfs/dbraw/zinc/58/84/04/333588404.db2.gz	JZJLOUSWVDFLHU-VIBAHUMZSA-N	1	0	268.404	4.178	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCc2ccc(F)cc21)c1cccc(C#N)c1	ZINC000538405411	333589009	/nfs/dbraw/zinc/58/90/09/333589009.db2.gz	MYNWNGHRWKMMKF-SGTLLEGYSA-N	1	0	280.346	4.035	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCc2ccc(F)cc21)c1cccc(C#N)c1	ZINC000538405409	333589118	/nfs/dbraw/zinc/58/91/18/333589118.db2.gz	MYNWNGHRWKMMKF-KPZWWZAWSA-N	1	0	280.346	4.035	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(C#N)s1)C(C)(C)c1ccccc1	ZINC000538416745	333590937	/nfs/dbraw/zinc/59/09/37/333590937.db2.gz	DZQZDZZNOVJTGT-KRWDZBQOSA-N	1	0	298.455	4.466	20	30		CIEDRO
CC(C)(C)c1ccc(C[NH2+]Cc2cccc(C#N)c2)s1	ZINC000126427657	333597251	/nfs/dbraw/zinc/59/72/51/333597251.db2.gz	PGDBLSXBBVIAQW-UHFFFAOYSA-N	1	0	284.428	4.207	20	30		CIEDRO
C[C@H]([NH2+][C@H]1Cc2ccc(Cl)cc2C1)c1ccc(C#N)cc1	ZINC000126643368	333601520	/nfs/dbraw/zinc/60/15/20/333601520.db2.gz	XILZFYMAIMGKGJ-SGTLLEGYSA-N	1	0	296.801	4.030	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)o1	ZINC000174243720	335151193	/nfs/dbraw/zinc/15/11/93/335151193.db2.gz	CRYSMLBUORXWAG-MRXNPFEDSA-N	1	0	286.762	4.046	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]CCc1cccc2ccccc21	ZINC000174266709	335151654	/nfs/dbraw/zinc/15/16/54/335151654.db2.gz	NCVMUQZDXYBJCR-UHFFFAOYSA-N	1	0	280.415	4.302	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](C)c1cc(OC)c(OC)cc1C	ZINC000539288781	333664095	/nfs/dbraw/zinc/66/40/95/333664095.db2.gz	FEICXRHTQXOSAB-LSDHHAIUSA-N	1	0	291.435	4.408	20	30		CIEDRO
CCc1ccc(C(C)(C)[NH2+]Cc2cccc(C#N)c2F)cc1	ZINC000539361182	333667324	/nfs/dbraw/zinc/66/73/24/333667324.db2.gz	LWFPMDVUVWEBOW-UHFFFAOYSA-N	1	0	296.389	4.285	20	30		CIEDRO
CCc1ccc(CC[NH2+][C@H](C)c2ccc(C#N)cc2)cc1	ZINC000539495285	333674180	/nfs/dbraw/zinc/67/41/80/333674180.db2.gz	KRDURRLTYQFZFQ-OAHLLOKOSA-N	1	0	278.399	4.014	20	30		CIEDRO
C[C@H]([NH2+]CCCc1ccc(Cl)cc1)c1ccc(C#N)cc1	ZINC000539508782	333675062	/nfs/dbraw/zinc/67/50/62/333675062.db2.gz	ZKNXLOMYWJJGAH-AWEZNQCLSA-N	1	0	298.817	4.495	20	30		CIEDRO
C[C@@H](C[NH2+]CCCCC#N)Cc1ccc(C(C)(C)C)cc1	ZINC000539532180	333676779	/nfs/dbraw/zinc/67/67/79/333676779.db2.gz	BPDXQBFQOUOMOJ-MRXNPFEDSA-N	1	0	286.463	4.446	20	30		CIEDRO
CC[C@H]([NH2+]CCC(C)(C)C#N)C(C)(C)c1ccccc1	ZINC000539613884	333681279	/nfs/dbraw/zinc/68/12/79/333681279.db2.gz	STIVFJMDQWKHGB-INIZCTEOSA-N	1	0	272.436	4.272	20	30		CIEDRO
CC(C)(C#N)CC[NH2+]C(C)(C)c1cccc(Cl)c1	ZINC000539612618	333681343	/nfs/dbraw/zinc/68/13/43/333681343.db2.gz	BDTMMCVFOUJZJL-UHFFFAOYSA-N	1	0	264.800	4.105	20	30		CIEDRO
CCc1ccc(C(C)(C)[NH2+]CCC(C)(C)C#N)cc1	ZINC000539613331	333681358	/nfs/dbraw/zinc/68/13/58/333681358.db2.gz	MKCPNWHAIAMTPN-UHFFFAOYSA-N	1	0	258.409	4.014	20	30		CIEDRO
CSc1ccc(C[NH2+][C@H](C)c2cccc(C#N)c2)cc1	ZINC000174430810	335154378	/nfs/dbraw/zinc/15/43/78/335154378.db2.gz	QOSQHEYCGIBCKF-CYBMUJFWSA-N	1	0	282.412	4.131	20	30		CIEDRO
C=CC[C@@H](C)[C@H](C)[NH2+]Cc1cn(CCCCC)nc1C	ZINC000540141228	333712002	/nfs/dbraw/zinc/71/20/02/333712002.db2.gz	GIDQMWZZUDTPBZ-CABCVRRESA-N	1	0	277.456	4.072	20	30		CIEDRO
C=CCCOCC[NH2+][C@@H](C)c1cc(Cl)cc(Cl)c1	ZINC000540153231	333714240	/nfs/dbraw/zinc/71/42/40/333714240.db2.gz	BBRNCPZVHNOVNR-NSHDSACASA-N	1	0	288.218	4.237	20	30		CIEDRO
CCC[C@H](CCc1ccccc1)[NH2+]Cc1ccc(C#N)o1	ZINC000174462232	335156056	/nfs/dbraw/zinc/15/60/56/335156056.db2.gz	QCHMEPJBGIPYLT-MRXNPFEDSA-N	1	0	282.387	4.042	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)c1ccc(OCC)c(OCC)c1	ZINC000540366739	333727467	/nfs/dbraw/zinc/72/74/67/333727467.db2.gz	RHXZDLNCZYZKSB-AWEZNQCLSA-N	1	0	277.408	4.101	20	30		CIEDRO
C[C@@H](C[NH2+][C@@H](C)c1cccc(C#N)c1)c1ccc(F)cc1	ZINC000540591405	333736431	/nfs/dbraw/zinc/73/64/31/333736431.db2.gz	IXGLXOXDAJKPNR-KBPBESRZSA-N	1	0	282.362	4.152	20	30		CIEDRO
Cc1cccc(C)c1CC[NH2+][C@@H](C)c1ccc(C#N)c(F)c1	ZINC000540705877	333742645	/nfs/dbraw/zinc/74/26/45/333742645.db2.gz	PCZJXGKGHYVVHG-HNNXBMFYSA-N	1	0	296.389	4.208	20	30		CIEDRO
C[C@H]([NH2+]Cc1cccc(C#N)c1)c1cc2c(s1)CCCC2	ZINC000130017271	333806881	/nfs/dbraw/zinc/80/68/81/333806881.db2.gz	NFJYYRWYYBTKRQ-ZDUSSCGKSA-N	1	0	296.439	4.349	20	30		CIEDRO
Cc1ccc(C[C@H]([NH2+]CCCC#N)c2ccc(C)cc2)cc1	ZINC000542497688	333828263	/nfs/dbraw/zinc/82/82/63/333828263.db2.gz	BNNSTDRJXYGIAJ-FQEVSTJZSA-N	1	0	292.426	4.481	20	30		CIEDRO
C=C(CC)C[NH2+][C@H](CC)c1nc(C(F)(F)F)cs1	ZINC000542564955	333832420	/nfs/dbraw/zinc/83/24/20/333832420.db2.gz	GBUNTALMLQKKTF-SECBINFHSA-N	1	0	278.343	4.169	20	30		CIEDRO
C[C@@H](c1ccc(C(F)(F)F)cc1)[NH+]1CCC(CC#N)CC1	ZINC000543807173	333900936	/nfs/dbraw/zinc/90/09/36/333900936.db2.gz	GKQGRTPWDAWGNV-LBPRGKRZSA-N	1	0	296.336	4.392	20	30		CIEDRO
Cc1cc(C)cc([C@H](C)[NH2+]Cc2ccc(CC#N)cc2)c1	ZINC000544117907	333917265	/nfs/dbraw/zinc/91/72/65/333917265.db2.gz	VEFQNJBVJIGJPB-INIZCTEOSA-N	1	0	278.399	4.220	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@@H](C)[C@H](C)C1)c1ccc(C#N)cc1F	ZINC000544615134	333940746	/nfs/dbraw/zinc/94/07/46/333940746.db2.gz	LJKKWHIDNJSJAJ-GUIRCDHDSA-N	1	0	274.383	4.173	20	30		CIEDRO
N#Cc1ccc(C[NH2+]C2(c3ccccc3)CCCC2)cc1	ZINC000073007802	333967340	/nfs/dbraw/zinc/96/73/40/333967340.db2.gz	HZFUKINPZLPBAH-UHFFFAOYSA-N	1	0	276.383	4.117	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]CC1(c2ccccc2Cl)CC1	ZINC000132209356	333974988	/nfs/dbraw/zinc/97/49/88/333974988.db2.gz	HNPKBRKADPMTOV-UHFFFAOYSA-N	1	0	290.838	4.291	20	30		CIEDRO
C=CCC[N@H+]1CCC[C@H](c2nc3ccccc3n2C(C)C)C1	ZINC000133096339	334015946	/nfs/dbraw/zinc/01/59/46/334015946.db2.gz	NWOIVOWRGUUBDG-INIZCTEOSA-N	1	0	297.446	4.373	20	30		CIEDRO
C=CCC[NH+]1CCC(=Cc2ccc(F)c(F)c2)CC1	ZINC000546690532	334046134	/nfs/dbraw/zinc/04/61/34/334046134.db2.gz	OBIGXCRWCGICBB-UHFFFAOYSA-N	1	0	263.331	4.020	20	30		CIEDRO
Cc1cccc(C)c1[C@@H](C)[NH2+]Cc1ccc(C#N)cc1F	ZINC000546884268	334053675	/nfs/dbraw/zinc/05/36/75/334053675.db2.gz	UBDUUNRKUDZVAD-CQSZACIVSA-N	1	0	282.362	4.165	20	30		CIEDRO
C=CCCC[NH2+][C@@H](c1cccc(Cl)c1)c1ccccn1	ZINC000133769596	334055053	/nfs/dbraw/zinc/05/50/53/334055053.db2.gz	UTIDYAIYJKCHDH-KRWDZBQOSA-N	1	0	286.806	4.380	20	30		CIEDRO
C=CC[C@H](CO)[NH2+][C@@H](C)c1ccc(Oc2ccccc2)cc1	ZINC000547393498	334085362	/nfs/dbraw/zinc/08/53/62/334085362.db2.gz	IJBCKPQUSWREMS-DOTOQJQBSA-N	1	0	297.398	4.067	20	30		CIEDRO
CC(C)(C#N)CC[NH2+][C@@H]1CCCC[C@@H]1Cc1ccccc1	ZINC000547509488	334096210	/nfs/dbraw/zinc/09/62/10/334096210.db2.gz	CUNNDGIRKGNWAR-QZTJIDSGSA-N	1	0	284.447	4.317	20	30		CIEDRO
CC(C)(C#N)CC[NH2+][C@@H]1CCCC[C@H]1Cc1ccccc1	ZINC000547509490	334096328	/nfs/dbraw/zinc/09/63/28/334096328.db2.gz	CUNNDGIRKGNWAR-ZWKOTPCHSA-N	1	0	284.447	4.317	20	30		CIEDRO
CC[C@H](C[N@H+](CC)CCC(C)(C)C#N)c1ccccc1	ZINC000547518196	334097472	/nfs/dbraw/zinc/09/74/72/334097472.db2.gz	GJYHTEPQDJRHLU-MRXNPFEDSA-N	1	0	272.436	4.442	20	30		CIEDRO
C=CCC[NH2+][C@H](Cc1ccccc1)c1ccccc1	ZINC000134911365	334108066	/nfs/dbraw/zinc/10/80/66/334108066.db2.gz	IMBJUVXCVSYPPI-GOSISDBHSA-N	1	0	251.373	4.136	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccc(C#N)o1)c1ccc(Cl)cc1	ZINC000135142803	334117548	/nfs/dbraw/zinc/11/75/48/334117548.db2.gz	UDDZDVVOKPWOPU-OAHLLOKOSA-N	1	0	274.751	4.046	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]Cc1cccc2ccccc21	ZINC000135167646	334118534	/nfs/dbraw/zinc/11/85/34/334118534.db2.gz	STPRAVNVGLSYNT-UHFFFAOYSA-N	1	0	266.388	4.259	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(C#N)s1)c1ccc(C)cc1	ZINC000135668992	334135563	/nfs/dbraw/zinc/13/55/63/334135563.db2.gz	AUIMZOJBHMJHNG-INIZCTEOSA-N	1	0	270.401	4.169	20	30		CIEDRO
CC(C)C[C@H]([NH2+]Cc1ccc(C#N)s1)c1ccccc1	ZINC000135670612	334135857	/nfs/dbraw/zinc/13/58/57/334135857.db2.gz	GDJAPXFFOJIKPL-KRWDZBQOSA-N	1	0	284.428	4.497	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](c1ccccc1)c1ccc(F)cc1	ZINC000135749907	334137927	/nfs/dbraw/zinc/13/79/27/334137927.db2.gz	IMRUNZRZYFJTAH-KDOFPFPSSA-N	1	0	269.363	4.469	20	30		CIEDRO
C[C@@H]([NH2+]CCC(C)(C)C#N)C1(c2ccccc2)CCCC1	ZINC000548168674	334144613	/nfs/dbraw/zinc/14/46/13/334144613.db2.gz	LNORMUKGXMQGNI-MRXNPFEDSA-N	1	0	284.447	4.416	20	30		CIEDRO
C[C@H]([NH2+]C1CCC(C)(C)CC1)c1ccc(C#N)cc1	ZINC000079624304	334158410	/nfs/dbraw/zinc/15/84/10/334158410.db2.gz	IWTAVBJXQFDLEF-ZDUSSCGKSA-N	1	0	256.393	4.178	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCCC(C)(C)C1)c1ccc(C#N)cc1	ZINC000079974569	334164694	/nfs/dbraw/zinc/16/46/94/334164694.db2.gz	NZSZOTSONDHLTG-CJNGLKHVSA-N	1	0	256.393	4.178	20	30		CIEDRO
C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+]Cc1ccc(C#N)cc1	ZINC000080339920	334170673	/nfs/dbraw/zinc/17/06/73/334170673.db2.gz	VXDIPKMKOKTQKI-BFUOFWGJSA-N	1	0	294.373	4.111	20	30		CIEDRO
C[C@H]1CCc2c(F)cccc2[C@@H]1[NH2+]Cc1cccc(C#N)c1	ZINC000080339832	334170747	/nfs/dbraw/zinc/17/07/47/334170747.db2.gz	IUOQPIPJLTYDEW-ORAYPTAESA-N	1	0	294.373	4.111	20	30		CIEDRO
CCc1ccccc1CC[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000548935948	334181001	/nfs/dbraw/zinc/18/10/01/334181001.db2.gz	CZYODEIWRMIQAX-OAHLLOKOSA-N	1	0	278.399	4.014	20	30		CIEDRO
CC1=C(c2ccco2)C[N@H+](CCCCC(C)(C)C#N)CC1	ZINC000549158935	334186805	/nfs/dbraw/zinc/18/68/05/334186805.db2.gz	GNRLFFQIFSTZHR-UHFFFAOYSA-N	1	0	286.419	4.479	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([N@@H+]2CCC[C@@H](c3ccc(F)cc3)CC2)C1	ZINC000549537855	334196723	/nfs/dbraw/zinc/19/67/23/334196723.db2.gz	MILUNVIOGKRQEH-IIDMSEBBSA-N	1	0	286.394	4.087	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@H](C#N)C1)c1ccccc1C(F)(F)F	ZINC000549535662	334196777	/nfs/dbraw/zinc/19/67/77/334196777.db2.gz	IZPNLHVGILRPNU-SRVKXCTJSA-N	1	0	282.309	4.048	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([N@@H+]2CCCC3(CCCCC3)CC2)C1	ZINC000549612627	334199782	/nfs/dbraw/zinc/19/97/82/334199782.db2.gz	ULQGFTIHDGLWLD-CVEARBPZSA-N	1	0	260.425	4.115	20	30		CIEDRO
CC[N@H+](Cc1ccc2ccccc2c1)[C@H]1CC[C@@H](C#N)C1	ZINC000549772092	334204503	/nfs/dbraw/zinc/20/45/03/334204503.db2.gz	FBNFQKSWKMFJMO-BEFAXECRSA-N	1	0	278.399	4.354	20	30		CIEDRO
N#Cc1ccc(C[NH2+]CCc2cc3ccccc3s2)s1	ZINC000549876426	334207642	/nfs/dbraw/zinc/20/76/42/334207642.db2.gz	KKDYXTOLSLTLBN-UHFFFAOYSA-N	1	0	298.436	4.167	20	30		CIEDRO
CC(C)c1ccc([C@@H]([NH2+]CCOCCC#N)C(C)C)cc1	ZINC000549925282	334209141	/nfs/dbraw/zinc/20/91/41/334209141.db2.gz	OCRUEOCBKDKNBU-SFHVURJKSA-N	1	0	288.435	4.027	20	30		CIEDRO
CC(C)c1ccc(C[C@@H]2CC[N@@H+]([C@@H]3CC[C@H](C#N)C3)C2)cc1	ZINC000549938629	334209893	/nfs/dbraw/zinc/20/98/93/334209893.db2.gz	BCGNNRJESKGSHW-CMKODMSKSA-N	1	0	296.458	4.367	20	30		CIEDRO
C[C@@H]1C[C@@H]1[C@@H]([NH2+]CCCCC#N)c1ccc(Cl)cc1	ZINC000245854955	334221726	/nfs/dbraw/zinc/22/17/26/334221726.db2.gz	GYIUHFAHGGXMTF-KCXAZCMYSA-N	1	0	276.811	4.321	20	30		CIEDRO
CCS[C@@H]1CCC[C@@H]([NH2+][C@H](C)c2cccc(C#N)c2)C1	ZINC000245920897	334224225	/nfs/dbraw/zinc/22/42/25/334224225.db2.gz	QROBSXKXKLVSNM-KBRIMQKVSA-N	1	0	288.460	4.273	20	30		CIEDRO
CC[C@H]1CC[C@H]([NH2+][C@H](C)c2cccc(C#N)c2)CC1	ZINC000551211991	334240999	/nfs/dbraw/zinc/24/09/99/334240999.db2.gz	OYHDFRSBTZMYMJ-CKEIUWERSA-N	1	0	256.393	4.178	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H](C)c1cnn(C2CCCC2)c1	ZINC000551242201	334242683	/nfs/dbraw/zinc/24/26/83/334242683.db2.gz	YBGDQZPRULGIKX-AWEZNQCLSA-N	1	0	275.440	4.251	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+]Cc1ccc(OC(F)F)c(F)c1	ZINC000551274103	334244616	/nfs/dbraw/zinc/24/46/16/334244616.db2.gz	KUJZRYGWFSPBEE-LBPRGKRZSA-N	1	0	287.325	4.262	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@H](C)[C@H]1C[C@@H]1c1ccc(OC)cc1	ZINC000551521118	334252333	/nfs/dbraw/zinc/25/23/33/334252333.db2.gz	YNIBMFNOPLBHGB-MOIQIXESSA-N	1	0	273.420	4.132	20	30		CIEDRO
Cc1ccccc1C[C@@H](C)[NH2+]C1(c2cccc(C#N)c2)CC1	ZINC000551577149	334254985	/nfs/dbraw/zinc/25/49/85/334254985.db2.gz	UOMCNSIENPUDKE-MRXNPFEDSA-N	1	0	290.410	4.077	20	30		CIEDRO
CC(C)c1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C#N)o1)CCC2	ZINC000551582924	334255116	/nfs/dbraw/zinc/25/51/16/334255116.db2.gz	GLXIBSIGWINYGR-IBGZPJMESA-N	1	0	294.398	4.442	20	30		CIEDRO
C[C@@H]1CC[N@H+](Cc2cc(C#N)cs2)[C@H]2CCCC[C@@H]12	ZINC000551974507	334268539	/nfs/dbraw/zinc/26/85/39/334268539.db2.gz	BTXBUDWPGWHJKJ-KCXAZCMYSA-N	1	0	274.433	4.020	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCc1ccccc1OC)c1ccco1	ZINC000552040122	334279851	/nfs/dbraw/zinc/27/98/51/334279851.db2.gz	AHGYAQGJSXHXEQ-INIZCTEOSA-N	1	0	285.387	4.128	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCc1c(F)cccc1F)c1ccco1	ZINC000552049616	334281573	/nfs/dbraw/zinc/28/15/73/334281573.db2.gz	ZNDTYZZHGYYLRC-MRXNPFEDSA-N	1	0	291.341	4.397	20	30		CIEDRO
C=CCC[C@H]([NH2+]CC1(C)CCC(OC)CC1)c1ccco1	ZINC000552057497	334282478	/nfs/dbraw/zinc/28/24/78/334282478.db2.gz	XGURNXSMUXUXJZ-PQUAAJSLSA-N	1	0	291.435	4.472	20	30		CIEDRO
N#Cc1cccc(C[N@H+]2CC[C@H](c3cccc(Cl)c3)C2)c1	ZINC000552084845	334287047	/nfs/dbraw/zinc/28/70/47/334287047.db2.gz	BMYAVIAAFOUSSA-KRWDZBQOSA-N	1	0	296.801	4.201	20	30		CIEDRO
C=CCC[C@H]([NH2+]C1CCC(F)(F)CC1)c1ccco1	ZINC000552275243	334311389	/nfs/dbraw/zinc/31/13/89/334311389.db2.gz	OWFMLKUWEGEVSN-ZDUSSCGKSA-N	1	0	269.335	4.454	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@@H]1CCCCS1)c1ccco1	ZINC000552281782	334312441	/nfs/dbraw/zinc/31/24/41/334312441.db2.gz	JQNJYXBJKJROCK-UONOGXRCSA-N	1	0	265.422	4.162	20	30		CIEDRO
CCC[C@@]1(C)CCC[N@H+](Cc2cc(C#N)cs2)C1	ZINC000552300012	334314718	/nfs/dbraw/zinc/31/47/18/334314718.db2.gz	UJBKDVMUCZIKCQ-HNNXBMFYSA-N	1	0	262.422	4.022	20	30		CIEDRO
Cc1cc(C)cc([C@H](C)[NH2+][C@@H]2CCC[C@@H](C#N)C2)c1	ZINC000248735538	334315466	/nfs/dbraw/zinc/31/54/66/334315466.db2.gz	DOBKSHOPCPTMPU-ZMSDIMECSA-N	1	0	256.393	4.036	20	30		CIEDRO
N#CC1CC[NH+](Cc2ccccc2Oc2ccccc2)CC1	ZINC000142074607	334318776	/nfs/dbraw/zinc/31/87/76/334318776.db2.gz	MQAAMYFVMWTNMN-UHFFFAOYSA-N	1	0	292.382	4.214	20	30		CIEDRO
CC(C)[C@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)c1ccc(F)cc1F	ZINC000248867093	334320222	/nfs/dbraw/zinc/32/02/22/334320222.db2.gz	QFNRALHRJFBUTL-IFIJOSMWSA-N	1	0	292.373	4.334	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)c1cccc(N2CCCC2)c1	ZINC000248892338	334321194	/nfs/dbraw/zinc/32/11/94/334321194.db2.gz	SUBCYLLMSHJYER-JZXOWHBKSA-N	1	0	297.446	4.020	20	30		CIEDRO
C=C(C)C[N@H+]1Cc2ccccc2[C@@H](c2ccccc2)C1	ZINC000552500320	334332208	/nfs/dbraw/zinc/33/22/08/334332208.db2.gz	HXTOFMQFQASOSR-LJQANCHMSA-N	1	0	263.384	4.210	20	30		CIEDRO
CC[C@@H](C)[C@@H](C)[N@H+](Cc1ccc(F)cc1C#N)C1CC1	ZINC000552594287	334338480	/nfs/dbraw/zinc/33/84/80/334338480.db2.gz	LPRUQBIZLQWZFL-CHWSQXEVSA-N	1	0	274.383	4.096	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+]C[C@@H](CO)c1ccccc1Cl	ZINC000554073007	334409117	/nfs/dbraw/zinc/40/91/17/334409117.db2.gz	KRASOJAGXKWBBD-GJZGRUSLSA-N	1	0	295.854	4.140	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@@H](C)c1nccn1-c1ccccc1	ZINC000554085255	334410030	/nfs/dbraw/zinc/41/00/30/334410030.db2.gz	DXOUOONALKZWRJ-HOTGVXAUSA-N	1	0	283.419	4.268	20	30		CIEDRO
CC(C)[C@H](Cc1ccc(F)cc1)[NH2+]CC(C)(C)CCC#N	ZINC000554363741	334424691	/nfs/dbraw/zinc/42/46/91/334424691.db2.gz	PXQXLWOIRLKWNB-KRWDZBQOSA-N	1	0	290.426	4.312	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+]CC(C)(C)c1ncccc1C	ZINC000554995157	334463997	/nfs/dbraw/zinc/46/39/97/334463997.db2.gz	WTQUKOTZLIKQGX-HNNXBMFYSA-N	1	0	260.425	4.002	20	30		CIEDRO
CC(C)CC[C@@H]([NH2+]CC1CCC(C#N)CC1)C1CC1	ZINC000555224883	334471789	/nfs/dbraw/zinc/47/17/89/334471789.db2.gz	DHCQWJBJMMJMST-VMBOVVBDSA-N	1	0	262.441	4.121	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH2+][C@H](c2ccc(Cl)cc2)C2CC2)C1	ZINC000555421768	334478156	/nfs/dbraw/zinc/47/81/56/334478156.db2.gz	LKIDIBYTBKKBJK-LYRGGWFBSA-N	1	0	274.795	4.073	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]Cc1nc2ccc(F)cc2s1	ZINC000555592032	334483411	/nfs/dbraw/zinc/48/34/11/334483411.db2.gz	IVYHSVFFBONAOH-UHFFFAOYSA-N	1	0	278.396	4.127	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H](C)c1ccc(-n2cccn2)cc1	ZINC000556218515	334500630	/nfs/dbraw/zinc/50/06/30/334500630.db2.gz	VHWQOCPSCIIMBZ-OAHLLOKOSA-N	1	0	283.419	4.125	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H](C)c1cnn(C(C)(C)C)c1C	ZINC000556215710	334500635	/nfs/dbraw/zinc/50/06/35/334500635.db2.gz	FNEVZUWJFPCWRH-CYBMUJFWSA-N	1	0	277.456	4.199	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C	ZINC000556218701	334500898	/nfs/dbraw/zinc/50/08/98/334500898.db2.gz	ZZQBAROIFUXXHH-ZDUSSCGKSA-N	1	0	276.380	4.156	20	30		CIEDRO
C=C(C)CN1CCC([NH2+][C@H](CC)c2ccc(C)cc2)CC1	ZINC000152950865	334529348	/nfs/dbraw/zinc/52/93/48/334529348.db2.gz	ZNTXNUZIPMTNTJ-LJQANCHMSA-N	1	0	286.463	4.076	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@H](c1ccc(C)cc1)C1CC1	ZINC000565724444	334591907	/nfs/dbraw/zinc/59/19/07/334591907.db2.gz	VLYSJPFBJXHORV-QRVBRYPASA-N	1	0	285.431	4.017	20	30		CIEDRO
CC(C)CC[C@H]([NH2+][C@H]1CC[C@@H](C#N)C1)C(C)(C)C	ZINC000566878656	334668007	/nfs/dbraw/zinc/66/80/07/334668007.db2.gz	NUYAPMFVMKXOHB-ILXRZTDVSA-N	1	0	250.430	4.119	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]Cc1ccc(F)c2cccnc12	ZINC000567411976	334714026	/nfs/dbraw/zinc/71/40/26/334714026.db2.gz	QGTGVZDCUKIMDA-UHFFFAOYSA-N	1	0	272.367	4.066	20	30		CIEDRO
N#CCC[C@H](C#N)C[NH2+][C@@H](c1cccc(F)c1)C1CCCC1	ZINC000567685083	334752065	/nfs/dbraw/zinc/75/20/65/334752065.db2.gz	VGUJJDOEPHLIAO-RDTXWAMCSA-N	1	0	299.393	4.090	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H](C)c2cccc(C)c2)cc1	ZINC000157252747	334765127	/nfs/dbraw/zinc/76/51/27/334765127.db2.gz	CGEOZFNKGPFRPT-INIZCTEOSA-N	1	0	281.399	4.411	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H](C)c1sc(CC)nc1C	ZINC000572588954	334779723	/nfs/dbraw/zinc/77/97/23/334779723.db2.gz	WVQZILSUSWYEBV-NSHDSACASA-N	1	0	266.454	4.267	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1C[C@H](c2ccc(F)cc2)C1)c1cccc(C#N)c1	ZINC000568669341	334835667	/nfs/dbraw/zinc/83/56/67/334835667.db2.gz	ACXNUYBCANBHKG-OMWUSAIZSA-N	1	0	294.373	4.294	20	30		CIEDRO
CC1(C)CCC[C@H]1[NH2+]Cc1cccc(OCCCC#N)c1	ZINC000175868406	335211863	/nfs/dbraw/zinc/21/18/63/335211863.db2.gz	WVQJYHKUFFNEAK-QGZVFWFLSA-N	1	0	286.419	4.037	20	30		CIEDRO
N#CCC[C@H](C#N)C[NH2+][C@H](c1ccc(F)cc1)C1CCCC1	ZINC000576979580	335272709	/nfs/dbraw/zinc/27/27/09/335272709.db2.gz	GUKIRKMIZXQDCZ-KDOFPFPSSA-N	1	0	299.393	4.090	20	30		CIEDRO
C[C@@H](C#N)C[NH2+]CCCCc1ccc(Cl)c(Cl)c1	ZINC000192719778	335297229	/nfs/dbraw/zinc/29/72/29/335297229.db2.gz	ZDZZZAYLPCQALN-NSHDSACASA-N	1	0	285.218	4.065	20	30		CIEDRO
C=CCSCC[NH2+]Cc1csc(Cl)c1Cl	ZINC000380073959	335313563	/nfs/dbraw/zinc/31/35/63/335313563.db2.gz	FFRFTQLPEOXQEL-UHFFFAOYSA-N	1	0	282.261	4.064	20	30		CIEDRO
C=CCCCC[NH+]1CC(c2nc3ccccc3s2)C1	ZINC000577186572	335318761	/nfs/dbraw/zinc/31/87/61/335318761.db2.gz	HHAANNGFVXRBEW-UHFFFAOYSA-N	1	0	272.417	4.052	20	30		CIEDRO
C[C@@H]([N@H+](C)Cc1ccc(C#N)cc1C(F)(F)F)C(C)(C)C	ZINC000577313561	335338105	/nfs/dbraw/zinc/33/81/05/335338105.db2.gz	SOWCJEREPHZXJR-LLVKDONJSA-N	1	0	298.352	4.443	20	30		CIEDRO
CSc1ccc(C[NH2+][C@@H]2CCc3ccc(C#N)cc32)cc1	ZINC000577493944	335359020	/nfs/dbraw/zinc/35/90/20/335359020.db2.gz	RYRISGOAJWXVFX-GOSISDBHSA-N	1	0	294.423	4.057	20	30		CIEDRO
N#Cc1csc(C[NH2+]C2(c3cccc(Cl)c3)CC2)c1	ZINC000177705110	335380157	/nfs/dbraw/zinc/38/01/57/335380157.db2.gz	LDQRPVUXVFANOL-UHFFFAOYSA-N	1	0	288.803	4.052	20	30		CIEDRO
N#CCCCC[NH2+][C@@H](Cc1ccc(F)cc1)c1ccccc1	ZINC000577640385	335384637	/nfs/dbraw/zinc/38/46/37/335384637.db2.gz	DDAGMHHXJIGJFK-IBGZPJMESA-N	1	0	296.389	4.393	20	30		CIEDRO
C[C@H]1CCc2ccccc2[C@@H]1[NH2+]Cc1cc(C#N)cs1	ZINC000179394529	335491502	/nfs/dbraw/zinc/49/15/02/335491502.db2.gz	UNZXEWXIRCTPJA-YVEFUNNKSA-N	1	0	282.412	4.033	20	30		CIEDRO
N#CCCC[NH2+][C@H](Cc1ccccc1)c1ccccc1F	ZINC000179813187	335521625	/nfs/dbraw/zinc/52/16/25/335521625.db2.gz	DNZZJSVMCPMCJE-GOSISDBHSA-N	1	0	282.362	4.003	20	30		CIEDRO
Cc1cccc([C@@H]([NH2+]CCCCC#N)C(C)(C)C)c1	ZINC000180795309	335624668	/nfs/dbraw/zinc/62/46/68/335624668.db2.gz	XEWCTAXMQIYFNB-MRXNPFEDSA-N	1	0	258.409	4.366	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](C)c1ccc(OCC)c(OCC)c1	ZINC000180950839	335630949	/nfs/dbraw/zinc/63/09/49/335630949.db2.gz	BFKCMKHGVVZCSB-ZIAGYGMSSA-N	1	0	277.408	4.099	20	30		CIEDRO
Cc1ccc([C@@H](C)[NH2+]Cc2ccc(CC#N)cc2)c(C)c1	ZINC000578574640	335650422	/nfs/dbraw/zinc/65/04/22/335650422.db2.gz	UQLDMCONCABPMJ-MRXNPFEDSA-N	1	0	278.399	4.220	20	30		CIEDRO
Cc1c2ccccc2oc1C[NH2+][C@H](C)c1cccc(C#N)c1	ZINC000181754235	335783363	/nfs/dbraw/zinc/78/33/63/335783363.db2.gz	QWKZUANPFWWZKV-CQSZACIVSA-N	1	0	290.366	4.464	20	30		CIEDRO
CC[C@@H](C)[C@H](C)[NH2+]Cc1ccccc1C(C)(C)C#N	ZINC000183045158	335858124	/nfs/dbraw/zinc/85/81/24/335858124.db2.gz	VMDILYOMTISUSY-KGLIPLIRSA-N	1	0	258.409	4.012	20	30		CIEDRO
Cc1ccsc1[C@@H](Cc1ccccc1)[NH2+]CCCC#N	ZINC000184088390	335917673	/nfs/dbraw/zinc/91/76/73/335917673.db2.gz	UQVHUHJDWNFQJR-MRXNPFEDSA-N	1	0	284.428	4.234	20	30		CIEDRO
C=CCCCC[NH2+]Cc1cccc(F)c1Br	ZINC000380546434	335997454	/nfs/dbraw/zinc/99/74/54/335997454.db2.gz	IPPYNTFFZZNHDE-UHFFFAOYSA-N	1	0	286.188	4.034	20	30		CIEDRO
CC[C@@H](C)[N@H+](Cc1ccccc1)Cc1ccc(C#N)cc1F	ZINC000387331686	336192625	/nfs/dbraw/zinc/19/26/25/336192625.db2.gz	FFICZSPLRAFAQV-OAHLLOKOSA-N	1	0	296.389	4.498	20	30		CIEDRO
C[C@H]([NH2+]C1CCC(C)(C#N)CC1)c1c(F)cccc1F	ZINC000336229156	533803451	/nfs/dbraw/zinc/80/34/51/533803451.db2.gz	ZEYZQRYITDESGX-FZWSLVFFSA-N	1	0	278.346	4.088	20	30		CIEDRO
C[C@H]([NH2+]C1CCC(C)(C#N)CC1)c1ccc(F)cc1F	ZINC000336208655	533805117	/nfs/dbraw/zinc/80/51/17/533805117.db2.gz	XLIVYDSUOILQDI-XOMBGVMMSA-N	1	0	278.346	4.088	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@@H](C)c1cc(OC)c(OC)cc1F	ZINC000540397896	517325588	/nfs/dbraw/zinc/32/55/88/517325588.db2.gz	XTWBVDXMMIANJX-OLZOCXBDSA-N	1	0	295.398	4.238	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccnn1C(C)C)c1ccccc1	ZINC000279777991	518713751	/nfs/dbraw/zinc/71/37/51/518713751.db2.gz	AQKAGXAXKYVWHJ-GOSISDBHSA-N	1	0	283.419	4.261	20	30		CIEDRO
CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2ccc(C#N)cc2)cc1	ZINC000078968464	519781449	/nfs/dbraw/zinc/78/14/49/519781449.db2.gz	UMNOHZGNFOSUQZ-OAHLLOKOSA-N	1	0	294.398	4.196	20	30		CIEDRO
CCCCOc1cccc(C[NH2+]Cc2ccc(C#N)cc2)c1	ZINC000069709095	520903375	/nfs/dbraw/zinc/90/33/75/520903375.db2.gz	ZPBVGGQXXVHYOU-UHFFFAOYSA-N	1	0	294.398	4.027	20	30		CIEDRO
CCOc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(C#N)cc2)cc1	ZINC000078973596	521260570	/nfs/dbraw/zinc/26/05/70/521260570.db2.gz	DDVFAWJCULXXJF-CABCVRRESA-N	1	0	294.398	4.369	20	30		CIEDRO
CCOc1ccccc1C[NH2+][C@@H](CC)c1ccc(C#N)cc1	ZINC000278292775	521504892	/nfs/dbraw/zinc/50/48/92/521504892.db2.gz	RCSZHCZJSXWFHO-SFHVURJKSA-N	1	0	294.398	4.198	20	30		CIEDRO
CCOc1ccccc1[C@@H](CC)[NH2+]Cc1ccc(C#N)cc1	ZINC000101599380	521577650	/nfs/dbraw/zinc/57/76/50/521577650.db2.gz	CSIRNRXERSEJFX-GOSISDBHSA-N	1	0	294.398	4.198	20	30		CIEDRO
CCOc1ccccc1[C@H](C)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000121840899	521584511	/nfs/dbraw/zinc/58/45/11/521584511.db2.gz	NFFNNVJIDQBUSB-GJZGRUSLSA-N	1	0	294.398	4.369	20	30		CIEDRO
N#CC1(c2ccccc2)CCC([NH2+]Cc2ccsc2)CC1	ZINC000350519401	534576344	/nfs/dbraw/zinc/57/63/44/534576344.db2.gz	ZCEVXINXDUEPHO-UHFFFAOYSA-N	1	0	296.439	4.242	20	30		CIEDRO
N#CCCC[NH2+][C@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1	ZINC000442852130	534614710	/nfs/dbraw/zinc/61/47/10/534614710.db2.gz	KUPMIRDHAHZYPP-HIFRSBDPSA-N	1	0	296.336	4.235	20	30		CIEDRO
CC[C@H]([NH2+]C[C@H](C)c1nc(C)cs1)c1ccc(C#N)cc1	ZINC000278371480	522626781	/nfs/dbraw/zinc/62/67/81/522626781.db2.gz	CFTKXGWAJUTNNT-LRDDRELGSA-N	1	0	299.443	4.168	20	30		CIEDRO
CC[C@@H]([NH2+]C1(c2ccccc2F)CC1)c1ccc(C#N)cc1	ZINC000278795700	522809662	/nfs/dbraw/zinc/80/96/62/522809662.db2.gz	QUGLAVPTMOOELK-GOSISDBHSA-N	1	0	294.373	4.427	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000036991920	522910644	/nfs/dbraw/zinc/91/06/44/522910644.db2.gz	MEWWPBKVAVUHQE-SCLBCKFNSA-N	1	0	282.362	4.499	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)c1ccc(C#N)cc1	ZINC000278238287	522912124	/nfs/dbraw/zinc/91/21/24/522912124.db2.gz	LCPYDBRSDNXZRY-IFXJQAMLSA-N	1	0	289.382	4.232	20	30		CIEDRO
CC[C@@H]([NH2+][C@H](C)c1ccc(C#N)cc1)c1ccccc1	ZINC000036991918	522935443	/nfs/dbraw/zinc/93/54/43/522935443.db2.gz	ONIHEVMWCFKMER-RDTXWAMCSA-N	1	0	264.372	4.360	20	30		CIEDRO
CC[C@@H]([NH2+][C@H]1CCOC2(CCCC2)C1)c1ccc(C#N)cc1	ZINC000278618457	522950736	/nfs/dbraw/zinc/95/07/36/522950736.db2.gz	GBPIAILKZRJTEA-ZWKOTPCHSA-N	1	0	298.430	4.091	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1)c1ccc(C#N)cc1	ZINC000037141902	525560907	/nfs/dbraw/zinc/56/09/07/525560907.db2.gz	CTZDYXMTGBEZHT-TUKIKUTGSA-N	1	0	296.336	4.330	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1cccs1)c1cccc(C#N)c1	ZINC000037235459	525617710	/nfs/dbraw/zinc/61/77/10/525617710.db2.gz	JFEZTCKYIMJQJW-NEPJUHHUSA-N	1	0	256.374	4.032	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1ccsc1)c1ccc(C#N)cc1	ZINC000050341523	525619596	/nfs/dbraw/zinc/61/95/96/525619596.db2.gz	VHLKNJZTPBSYTK-NEPJUHHUSA-N	1	0	256.374	4.032	20	30		CIEDRO
C[C@@H]([NH2+][C@H](C)c1ccc(Cl)cn1)c1ccc(C#N)cc1	ZINC000274972902	525659373	/nfs/dbraw/zinc/65/93/73/525659373.db2.gz	YHXMWBCDFOILHL-VXGBXAGGSA-N	1	0	285.778	4.018	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCCc2ccccc21)c1cccc(C#N)c1	ZINC000037230740	525682272	/nfs/dbraw/zinc/68/22/72/525682272.db2.gz	MMHLGGFTDPMPQT-KUHUBIRLSA-N	1	0	276.383	4.286	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCc2c1cccc2F)c1ccc(C#N)cc1	ZINC000097988273	525690947	/nfs/dbraw/zinc/69/09/47/525690947.db2.gz	ALQPZPKHNCXTAY-XIKOKIGWSA-N	1	0	280.346	4.035	20	30		CIEDRO
Cc1ccc([C@H](C)[NH2+]Cc2cccc(C#N)c2)c(C)c1	ZINC000037748723	525928927	/nfs/dbraw/zinc/92/89/27/525928927.db2.gz	GXZKMOFIOQDXKJ-HNNXBMFYSA-N	1	0	264.372	4.026	20	30		CIEDRO
C=CC[N@H+](CCc1ccco1)Cc1cccc2cccnc21	ZINC000352702410	526326656	/nfs/dbraw/zinc/32/66/56/526326656.db2.gz	WBUGSZCBQPQVCH-UHFFFAOYSA-N	1	0	292.382	4.059	20	30		CIEDRO
CC#CCC[NH2+][C@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1	ZINC000442827797	526340301	/nfs/dbraw/zinc/34/03/01/526340301.db2.gz	LZUATTNYROEGOO-HOCLYGCPSA-N	1	0	295.348	4.345	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@@H](CCC)c1cccnc1	ZINC000185420902	526950333	/nfs/dbraw/zinc/95/03/33/526950333.db2.gz	OQODSQHMDWDBAN-SFHVURJKSA-N	1	0	296.414	4.277	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]C[C@@H]1CCC[C@H](C(F)(F)F)C1	ZINC000344601861	526999327	/nfs/dbraw/zinc/99/93/27/526999327.db2.gz	KKRIYSLHWQKOBZ-OLZOCXBDSA-N	1	0	290.373	4.275	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@@H]1CCOc2c(C)cccc21	ZINC000353311391	527141641	/nfs/dbraw/zinc/14/16/41/527141641.db2.gz	ZRRGSGYXPMBLOD-DUVNUKRYSA-N	1	0	259.393	4.009	20	30		CIEDRO
C=CCCCC[NH2+][C@@H](C)c1ccc(-n2ccnc2C)cc1	ZINC000348189987	527169655	/nfs/dbraw/zinc/16/96/55/527169655.db2.gz	ZOCLGWSSTOGEFQ-HNNXBMFYSA-N	1	0	283.419	4.188	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+][C@@H](CC)c1ccc(OC)c(OC)c1	ZINC000352250106	527425654	/nfs/dbraw/zinc/42/56/54/527425654.db2.gz	CAGIKOGWFAYCFI-HIFRSBDPSA-N	1	0	277.408	4.099	20	30		CIEDRO
C=C[C@@H](CO)[NH2+][C@@H](CC)c1ccc(Oc2ccccc2)cc1	ZINC000353568214	527444876	/nfs/dbraw/zinc/44/48/76/527444876.db2.gz	PGQLAGCXEOIXEI-LPHOPBHVSA-N	1	0	297.398	4.067	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCCc1cccc(C)n1)c1ccco1	ZINC000353885193	527447086	/nfs/dbraw/zinc/44/70/86/527447086.db2.gz	ZOCMLVWRNPRMFP-QGZVFWFLSA-N	1	0	284.403	4.213	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccc2c(c1)COC2)c1ccco1	ZINC000353628872	527484934	/nfs/dbraw/zinc/48/49/34/527484934.db2.gz	CQEYSSWJACPTAM-KRWDZBQOSA-N	1	0	283.371	4.107	20	30		CIEDRO
C=C[C@H](CO)[NH2+][C@H](CC)c1ccc(Oc2ccccc2)cc1	ZINC000353568217	527595483	/nfs/dbraw/zinc/59/54/83/527595483.db2.gz	PGQLAGCXEOIXEI-VQIMIIECSA-N	1	0	297.398	4.067	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@@H](CC)c1ccc(OC)c(OC)c1	ZINC000343509550	335205820	/nfs/dbraw/zinc/20/58/20/335205820.db2.gz	RKYUCRHHHTYJJP-GJZGRUSLSA-N	1	0	277.408	4.099	20	30		CIEDRO
CCS[C@@H]1CCCC[C@H]1[NH2+]C1CCC(C)(C#N)CC1	ZINC000449174415	260272564	/nfs/dbraw/zinc/27/25/64/260272564.db2.gz	HLKLONNRHNIJPH-LVDPKSTMSA-N	1	0	280.481	4.113	20	30		CIEDRO
CC(C)C1CCC(C[NH+]2CCC(CC#N)CC2)CC1	ZINC000573962040	334980897	/nfs/dbraw/zinc/98/08/97/334980897.db2.gz	ZOOYROXRGSBOQF-UHFFFAOYSA-N	1	0	262.441	4.074	20	30		CIEDRO
CC(C)C[C@H]([NH2+]Cc1ccc(CC#N)cc1)c1ccccn1	ZINC000574074474	334990053	/nfs/dbraw/zinc/99/00/53/334990053.db2.gz	RWVALVPTZMAKAC-IBGZPJMESA-N	1	0	293.414	4.025	20	30		CIEDRO
CC[C@@H](c1cccc(OC)c1)[N@H+](C)Cc1ccccc1C#N	ZINC000574361203	335013455	/nfs/dbraw/zinc/01/34/55/335013455.db2.gz	AURVIZNUPJGDHT-IBGZPJMESA-N	1	0	294.398	4.150	20	30		CIEDRO
CC(C)(C)[C@H](CC1CCCCC1)[NH2+]C[C@H](C#N)CCC#N	ZINC000574392688	335015495	/nfs/dbraw/zinc/01/54/95/335015495.db2.gz	ASGQNEHMUKPDKG-IRXDYDNUSA-N	1	0	289.467	4.405	20	30		CIEDRO
CCC(CC)[C@@H]([NH2+]C[C@H](C#N)CCC#N)c1cccs1	ZINC000574631159	335034895	/nfs/dbraw/zinc/03/48/95/335034895.db2.gz	COSPZRYTDUJBRG-XJKSGUPXSA-N	1	0	289.448	4.259	20	30		CIEDRO
C=CCSCC[NH2+][C@H](C)c1ccc(OCCC)cc1	ZINC000221942570	262333048	/nfs/dbraw/zinc/33/30/48/262333048.db2.gz	HASQTMHIWFUAGV-CQSZACIVSA-N	1	0	279.449	4.045	20	30		CIEDRO
N#Cc1ccc2c(c1)CCC[C@H]2[NH2+]Cc1ccc(Cl)cc1	ZINC000341752752	130021637	/nfs/dbraw/zinc/02/16/37/130021637.db2.gz	XBAXFCHQCOFRGQ-GOSISDBHSA-N	1	0	296.801	4.379	20	30		CIEDRO
N#Cc1ccc2c(c1)CCC[C@H]2[NH2+][C@@H]1CCc2ccccc21	ZINC000341756581	130024384	/nfs/dbraw/zinc/02/43/84/130024384.db2.gz	FRWUWNLCOPKQOB-WOJBJXKFSA-N	1	0	288.394	4.213	20	30		CIEDRO
Cc1cccc(C[NH2+][C@H]2CCCc3cc(C#N)ccc32)c1	ZINC000341759510	130025858	/nfs/dbraw/zinc/02/58/58/130025858.db2.gz	VYFDNXSSLYHPLN-IBGZPJMESA-N	1	0	276.383	4.034	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCCc2cc(C#N)ccc21)c1cccc(F)c1	ZINC000341762413	130028492	/nfs/dbraw/zinc/02/84/92/130028492.db2.gz	VLXHYYMQPICYCG-ORAYPTAESA-N	1	0	294.373	4.426	20	30		CIEDRO
N#CC1(C[NH2+][C@@H]2CCC[C@H](c3ccc(Cl)cc3)C2)CC1	ZINC000575105837	335065891	/nfs/dbraw/zinc/06/58/91/335065891.db2.gz	UFMIRWGKVIDITA-GOEBONIOSA-N	1	0	288.822	4.260	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCCc2ccccc21)c1ccc(C#N)cc1	ZINC000020133544	171021054	/nfs/dbraw/zinc/02/10/54/171021054.db2.gz	CHFYLKUWFUXQIH-AUUYWEPGSA-N	1	0	276.383	4.286	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(Cl)cc1)c1ccc(C#N)cc1	ZINC000020209663	171073173	/nfs/dbraw/zinc/07/31/73/171073173.db2.gz	SFIKGTVQJHJMFX-LBPRGKRZSA-N	1	0	270.763	4.062	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]Cc2ccc(Cl)cc2)cc1	ZINC000021810303	171329041	/nfs/dbraw/zinc/32/90/41/171329041.db2.gz	GDPRCOBSRPEAOX-UHFFFAOYSA-N	1	0	287.790	4.195	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+]C1CCCCCC1	ZINC000034991309	171917174	/nfs/dbraw/zinc/91/71/74/171917174.db2.gz	RICOYFFAXWWXJC-UHFFFAOYSA-N	1	0	259.393	4.064	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H]1CCC[C@H](c2cccnc2)C1	ZINC000367896483	260075244	/nfs/dbraw/zinc/07/52/44/260075244.db2.gz	AZAYTPONEWLQJM-RDJZCZTQSA-N	1	0	285.435	4.027	20	30		CIEDRO
N#CCCC[C@@H]([NH2+]Cc1ccccc1)c1ccccc1	ZINC000353912184	226382348	/nfs/dbraw/zinc/38/23/48/226382348.db2.gz	DVEGRZZIWGNDBO-GOSISDBHSA-N	1	0	264.372	4.211	20	30		CIEDRO
C[C@@H](c1ncc(-c2ccccc2)o1)N1CCC(C)(C#N)CC1	ZINC000335974112	228172402	/nfs/dbraw/zinc/17/24/02/228172402.db2.gz	KBLVQBVRIIAUCC-AWEZNQCLSA-N	1	0	295.386	4.028	20	30		CIEDRO
Cc1cc([C@H](C)[NH2+]C2CCC(C)(C#N)CC2)c(C)o1	ZINC000336222330	228217403	/nfs/dbraw/zinc/21/74/03/228217403.db2.gz	WRMZMUOSPOZVDF-YGONEPDPSA-N	1	0	260.381	4.020	20	30		CIEDRO
CC(C)CC[C@H](C)[NH2+][C@@H](C)c1ccc(C#N)cc1F	ZINC000512621245	260023253	/nfs/dbraw/zinc/02/32/53/260023253.db2.gz	VSUHJZMIPYHMNW-STQMWFEESA-N	1	0	262.372	4.173	20	30		CIEDRO
C=CC[NH+](CC=C)CCc1ccc2ccccc2c1	ZINC000512772620	260037510	/nfs/dbraw/zinc/03/75/10/260037510.db2.gz	CNCYOXRDXFVESD-UHFFFAOYSA-N	1	0	251.373	4.056	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)c1ccccc1C(F)(F)F	ZINC000394118927	260076542	/nfs/dbraw/zinc/07/65/42/260076542.db2.gz	MLSVCZQKCYEHON-NSHDSACASA-N	1	0	257.299	4.322	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCSc2ccccc21)c1cccc(C#N)c1	ZINC000037316088	260085352	/nfs/dbraw/zinc/08/53/52/260085352.db2.gz	JNSGJPCVKLXRJH-DYVFJYSZSA-N	1	0	294.423	4.446	20	30		CIEDRO
N#Cc1csc(C[N@H+]2CCC[C@@H]2c2cccc(F)c2)c1	ZINC000180155714	260094521	/nfs/dbraw/zinc/09/45/21/260094521.db2.gz	PVXKFLMJUMZKHO-MRXNPFEDSA-N	1	0	286.375	4.096	20	30		CIEDRO
Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C#N)cc1F)[C@H](C)C2	ZINC000180479643	260104010	/nfs/dbraw/zinc/10/40/10/260104010.db2.gz	XPOIDUXLDFMVOR-YJYMSZOUSA-N	1	0	294.373	4.029	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H](C)c2cccc(OC)c2)cc1	ZINC000317288508	260168746	/nfs/dbraw/zinc/16/87/46/260168746.db2.gz	UYAJYRCMBAHQAJ-OAHLLOKOSA-N	1	0	297.398	4.111	20	30		CIEDRO
CC[C@H]([NH2+]CCCC(C)(C)C#N)c1cccs1	ZINC000087597763	260191785	/nfs/dbraw/zinc/19/17/85/260191785.db2.gz	HKYFKNDOQNMOMF-LBPRGKRZSA-N	1	0	250.411	4.119	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H]1CCCC12CCCCC2	ZINC000313011999	260233902	/nfs/dbraw/zinc/23/39/02/260233902.db2.gz	HGOLFPLBVKLQHL-HNNXBMFYSA-N	1	0	262.441	4.409	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]Cc1ccc(-c2ccncc2)cc1	ZINC000363413691	260254657	/nfs/dbraw/zinc/25/46/57/260254657.db2.gz	GEQLEGUPJUOYJP-UHFFFAOYSA-N	1	0	293.414	4.168	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@H](Cc2ccccc2)C2CC2)CC1	ZINC000449152020	260259445	/nfs/dbraw/zinc/25/94/45/260259445.db2.gz	CJXHXYCSXUMLCG-JLAWEPINSA-N	1	0	282.431	4.070	20	30		CIEDRO
CCCC[C@H](CCC)[NH2+]C1CCC(C)(C#N)CC1	ZINC000449187415	260284862	/nfs/dbraw/zinc/28/48/62/260284862.db2.gz	QOIAGJJJNOGKKZ-FHERZECASA-N	1	0	250.430	4.407	20	30		CIEDRO
Cc1nc(C)c([C@@H](C)[NH2+][C@H](C)c2ccc(C#N)cc2)s1	ZINC000040517592	260289125	/nfs/dbraw/zinc/28/91/25/260289125.db2.gz	UEVUNMGRYKMNDD-GHMZBOCLSA-N	1	0	285.416	4.043	20	30		CIEDRO
C[C@@H]([NH2+]CCCC(C)(C)C#N)c1ccccc1Cl	ZINC000087597725	260412310	/nfs/dbraw/zinc/41/23/10/260412310.db2.gz	CMZVTRLQXXUCNY-GFCCVEGCSA-N	1	0	264.800	4.321	20	30		CIEDRO
COc1cccc([C@@H](C)[NH2+][C@@H](CCC#N)c2ccccc2)c1	ZINC000090665186	260465065	/nfs/dbraw/zinc/46/50/65/260465065.db2.gz	LVELTXOTCJXXMQ-BEFAXECRSA-N	1	0	294.398	4.391	20	30		CIEDRO
C[C@H]1CCC[C@H]([NH2+]Cc2cccc(OCCCC#N)c2)C1	ZINC000237541462	260695822	/nfs/dbraw/zinc/69/58/22/260695822.db2.gz	KGENEEQLCZOOTA-RDJZCZTQSA-N	1	0	286.419	4.037	20	30		CIEDRO
C[N@H+](Cc1ccccc1N1CCCC1)CC(C)(C)CCC#N	ZINC000121246431	260708883	/nfs/dbraw/zinc/70/88/83/260708883.db2.gz	LORCEIAUFIZJSN-UHFFFAOYSA-N	1	0	299.462	4.049	20	30		CIEDRO
CCS[C@@H]1CCCC[C@H]1[NH2+]CCCCC(C)(C)C#N	ZINC000444685686	261065004	/nfs/dbraw/zinc/06/50/04/261065004.db2.gz	PEPVYLXKSCXITR-HUUCEWRRSA-N	1	0	282.497	4.360	20	30		CIEDRO
N#Cc1ccc(C[N@@H+]2CCC[C@@H]2c2ccsc2)s1	ZINC000153555708	261080277	/nfs/dbraw/zinc/08/02/77/261080277.db2.gz	WWEDDNZVOZTHSR-CQSZACIVSA-N	1	0	274.414	4.018	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)c1ccc(Br)s1	ZINC000161638315	261103411	/nfs/dbraw/zinc/10/34/11/261103411.db2.gz	DVPAETQVYDNJSV-IUCAKERBSA-N	1	0	274.227	4.126	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C#N)cc1)c1ccc2c(c1)CCCC2	ZINC000052662095	261111642	/nfs/dbraw/zinc/11/16/42/261111642.db2.gz	BXGYBOCFZXPBJI-OAHLLOKOSA-N	1	0	290.410	4.288	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@H](C)c1ccc(OC)cc1	ZINC000172831737	261155434	/nfs/dbraw/zinc/15/54/34/261155434.db2.gz	GMAGSDVCDZGUOI-OAHLLOKOSA-N	1	0	297.398	4.111	20	30		CIEDRO
CCc1noc(C)c1C[N@@H+](CC)[C@@H](C)c1ccc(C#N)cc1	ZINC000162906393	261298130	/nfs/dbraw/zinc/29/81/30/261298130.db2.gz	RIRVHGTXTAFEKZ-ZDUSSCGKSA-N	1	0	297.402	4.000	20	30		CIEDRO
CC[C@H](C[NH2+]CC(C)(C)CCC#N)c1ccccc1	ZINC000174244434	261563524	/nfs/dbraw/zinc/56/35/24/261563524.db2.gz	HPWBQSOPRWLRJM-OAHLLOKOSA-N	1	0	258.409	4.100	20	30		CIEDRO
CCCC[C@H]1CCC[C@H]1[NH2+]Cc1cccc(C#N)c1	ZINC000520964431	261722959	/nfs/dbraw/zinc/72/29/59/261722959.db2.gz	YNQRWKAXWLMPKX-DLBZAZTESA-N	1	0	256.393	4.007	20	30		CIEDRO
C[C@H](CCc1cccc(C(F)(F)F)c1)[NH2+]CCCCC#N	ZINC000178646069	261754081	/nfs/dbraw/zinc/75/40/81/261754081.db2.gz	IFXNETUUNWCTQV-CYBMUJFWSA-N	1	0	298.352	4.310	20	30		CIEDRO
C[C@@H]([NH2+]CCCC#N)C(c1ccccc1)c1ccccc1	ZINC000184087453	262007913	/nfs/dbraw/zinc/00/79/13/262007913.db2.gz	CBLYLQMWTLIUHL-MRXNPFEDSA-N	1	0	278.399	4.100	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]Cc1ccc(C(F)F)cc1	ZINC000185171681	262044345	/nfs/dbraw/zinc/04/43/45/262044345.db2.gz	TWUYZXMOQNKGLL-UHFFFAOYSA-N	1	0	266.335	4.044	20	30		CIEDRO
C[C@@H]([NH2+]CCCCC#N)c1ccc(OC(C)(C)C)cc1	ZINC000185218145	262045821	/nfs/dbraw/zinc/04/58/21/262045821.db2.gz	FKMCAVPHKOLJCW-CQSZACIVSA-N	1	0	274.408	4.208	20	30		CIEDRO
N#C[C@@H]1CCC[C@H](Nc2cccc(C[NH+]3CCCCC3)c2)C1	ZINC000185726896	262068782	/nfs/dbraw/zinc/06/87/82/262068782.db2.gz	WUEQGWYVONVUQP-AEFFLSMTSA-N	1	0	297.446	4.167	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)c1cccc(OC(F)F)c1	ZINC000185779918	262070662	/nfs/dbraw/zinc/07/06/62/262070662.db2.gz	KSUHZNNOGJYHOQ-MBNYWOFBSA-N	1	0	294.345	4.021	20	30		CIEDRO
Cc1ccc([C@@H](C)[NH2+][C@@H](CCC#N)c2ccccc2)c(O)c1	ZINC000186151051	262081718	/nfs/dbraw/zinc/08/17/18/262081718.db2.gz	LBFDLNCNJHDHAI-QAPCUYQASA-N	1	0	294.398	4.396	20	30		CIEDRO
CC(C)(CCC#N)C[NH+]1CCC(c2ccsc2)CC1	ZINC000188694751	262160003	/nfs/dbraw/zinc/16/00/03/262160003.db2.gz	UWNDNSXZCWERPV-UHFFFAOYSA-N	1	0	276.449	4.257	20	30		CIEDRO
CC(C)(CCc1ccccc1)[NH2+]Cc1cccc(C#N)c1F	ZINC000319087787	262168056	/nfs/dbraw/zinc/16/80/56/262168056.db2.gz	QJIBSALVZVGEOQ-UHFFFAOYSA-N	1	0	296.389	4.198	20	30		CIEDRO
C=CCC[C@H](NCCC[N@H+]1CCCC[C@@H]1C)c1ccco1	ZINC000514089649	262214710	/nfs/dbraw/zinc/21/47/10/262214710.db2.gz	QKSBXDABSGZGSU-IRXDYDNUSA-N	1	0	290.451	4.141	20	30		CIEDRO
CC(C)(C#N)CCCC[NH+]1CCC(OC2CCCC2)CC1	ZINC000364357982	262215486	/nfs/dbraw/zinc/21/54/86/262215486.db2.gz	WSZRXFUKABMMPH-UHFFFAOYSA-N	1	0	292.467	4.130	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@@H](C)c1ccccc1OC(F)F	ZINC000393820951	262215782	/nfs/dbraw/zinc/21/57/82/262215782.db2.gz	KQZIJJMWPSLAES-RYUDHWBXSA-N	1	0	269.335	4.293	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H](C)c2ccccc2C)cc1	ZINC000020023088	262226137	/nfs/dbraw/zinc/22/61/37/262226137.db2.gz	IKWKHFHVVPKLET-INIZCTEOSA-N	1	0	281.399	4.411	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1cc(Br)ccc1F	ZINC000390618597	262228907	/nfs/dbraw/zinc/22/89/07/262228907.db2.gz	HQFLCSDLLPRZKP-GFCCVEGCSA-N	1	0	286.188	4.033	20	30		CIEDRO
CCCC[NH+](CCCC)Cc1ccc(C#N)cc1F	ZINC000020369486	262247096	/nfs/dbraw/zinc/24/70/96/262247096.db2.gz	WRTSBANVVWHVGB-UHFFFAOYSA-N	1	0	262.372	4.100	20	30		CIEDRO
C[C@@H](c1cccc(C#N)c1)[N@@H+]1CC[C@H](c2ccccc2)C1	ZINC000188472791	262299133	/nfs/dbraw/zinc/29/91/33/262299133.db2.gz	OEAWMZAZHXKVDS-KXBFYZLASA-N	1	0	276.383	4.109	20	30		CIEDRO
CC(C)C1(C)CC[NH+](CCCC(C)(C)C#N)CC1	ZINC000186194023	262312737	/nfs/dbraw/zinc/31/27/37/262312737.db2.gz	JVGQSFGEIPPSHQ-UHFFFAOYSA-N	1	0	250.430	4.074	20	30		CIEDRO
C=CCSCC[NH2+][C@H](C)c1ccc(F)c(Cl)c1	ZINC000221938471	262332134	/nfs/dbraw/zinc/33/21/34/262332134.db2.gz	UFEPOKRVWIWGJZ-SNVBAGLBSA-N	1	0	273.804	4.049	20	30		CIEDRO
C=CCCC[NH+]1CCC(C(=O)c2ccc(C)cc2C)CC1	ZINC000522775330	262340587	/nfs/dbraw/zinc/34/05/87/262340587.db2.gz	NJJIAIWYFPHADA-UHFFFAOYSA-N	1	0	285.431	4.164	20	30		CIEDRO
C=C(C)COCC[NH2+]CC(c1ccccc1)c1ccccc1	ZINC000320107237	262391868	/nfs/dbraw/zinc/39/18/68/262391868.db2.gz	YWYUADBAAZSHKQ-UHFFFAOYSA-N	1	0	295.426	4.001	20	30		CIEDRO
CC(C)[N@H+](CCCCC(C)(C)C#N)CCc1nccs1	ZINC000336828138	262398416	/nfs/dbraw/zinc/39/84/16/262398416.db2.gz	UICCYNONVNYBTD-UHFFFAOYSA-N	1	0	293.480	4.116	20	30		CIEDRO
C[C@@H](c1ccco1)[N@H+](C)CCC1(C#N)CCCCC1	ZINC000411193059	262683010	/nfs/dbraw/zinc/68/30/10/262683010.db2.gz	NILJJHDJSXMQJQ-AWEZNQCLSA-N	1	0	260.381	4.137	20	30		CIEDRO
C[C@H](CCC#N)[NH+]1CCC(c2cccc(Cl)c2)CC1	ZINC000411672716	262703898	/nfs/dbraw/zinc/70/38/98/262703898.db2.gz	VQRZFZOVDLRTMV-CYBMUJFWSA-N	1	0	276.811	4.212	20	30		CIEDRO
CC[C@H]([NH2+][C@H](CCCC#N)c1ccccc1)[C@H]1C[C@@H]1C	ZINC000414146621	262810286	/nfs/dbraw/zinc/81/02/86/262810286.db2.gz	QMQKYIYJWGRSOU-LEUOFYLZSA-N	1	0	270.420	4.446	20	30		CIEDRO
Cc1nc(C(C)C)sc1[C@H](C)[NH2+]CC(C)(C)CC#N	ZINC000414160099	262818892	/nfs/dbraw/zinc/81/88/92/262818892.db2.gz	CLKGXUOSPSRFKS-NSHDSACASA-N	1	0	279.453	4.165	20	30		CIEDRO
CC(C)(CC#N)C[NH2+][C@@H]1C[C@H](c2ccccc2)C1(C)C	ZINC000414167221	262820216	/nfs/dbraw/zinc/82/02/16/262820216.db2.gz	OWTKGGVCEJEWBX-HZPDHXFCSA-N	1	0	270.420	4.098	20	30		CIEDRO
CC(C)(CC#N)C[NH2+][C@H]1C[C@@H](c2ccccc2)C1(C)C	ZINC000414167219	262820485	/nfs/dbraw/zinc/82/04/85/262820485.db2.gz	OWTKGGVCEJEWBX-HOTGVXAUSA-N	1	0	270.420	4.098	20	30		CIEDRO
C[C@@H]([NH2+]Cc1cnccc1C(C)(C)C)c1cccc(C#N)c1	ZINC000414233965	262830032	/nfs/dbraw/zinc/83/00/32/262830032.db2.gz	RRXROAUHCNJBNP-CQSZACIVSA-N	1	0	293.414	4.102	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+]C[C@H](CC)CC(F)(F)F	ZINC000414278090	262834748	/nfs/dbraw/zinc/83/47/48/262834748.db2.gz	XYKBEUCJIIFVSE-NEPJUHHUSA-N	1	0	251.336	4.299	20	30		CIEDRO
CCCCCCC[NH2+][C@H](C)c1ccc([S@](C)=O)cc1	ZINC000271934333	263000306	/nfs/dbraw/zinc/00/03/06/263000306.db2.gz	JNVYCFGWGXHFEN-KUHUBIRLSA-N	1	0	281.465	4.045	20	30		CIEDRO
CCCCCCC[NH2+][C@H](C)c1ccc([S@@](C)=O)cc1	ZINC000271934331	263000342	/nfs/dbraw/zinc/00/03/42/263000342.db2.gz	JNVYCFGWGXHFEN-AUUYWEPGSA-N	1	0	281.465	4.045	20	30		CIEDRO
N#CCCC[NH2+][C@H]1CC2(CCCCC2)Oc2ccccc21	ZINC000273265428	263014539	/nfs/dbraw/zinc/01/45/39/263014539.db2.gz	NPIFEAPHMLUSIQ-INIZCTEOSA-N	1	0	284.403	4.106	20	30		CIEDRO
N#CCCCC[NH2+][C@H]1CCCc2c(Cl)cccc21	ZINC000273607337	263018435	/nfs/dbraw/zinc/01/84/35/263018435.db2.gz	UOSJJDIWXONBBZ-HNNXBMFYSA-N	1	0	262.784	4.001	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CC[C@@H](C#N)C1)c1ccc(Cl)cc1	ZINC000274542459	263025712	/nfs/dbraw/zinc/02/57/12/263025712.db2.gz	ULRZYFUIDSGLHV-UGFHNGPFSA-N	1	0	262.784	4.073	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CC[C@@H](C#N)C1)c1cccc(Cl)c1	ZINC000274633978	263028303	/nfs/dbraw/zinc/02/83/03/263028303.db2.gz	PMBSZWSCXSJNIW-DFBGVHRSSA-N	1	0	262.784	4.073	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CC[C@@H](C#N)C1)c1cccc(Cl)c1	ZINC000274634004	263028343	/nfs/dbraw/zinc/02/83/43/263028343.db2.gz	PMBSZWSCXSJNIW-UGFHNGPFSA-N	1	0	262.784	4.073	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@@H](C#N)C1)c1cccc(Cl)c1Cl	ZINC000274648439	263028604	/nfs/dbraw/zinc/02/86/04/263028604.db2.gz	SJHBKRWXHRKIIT-HBNTYKKESA-N	1	0	283.202	4.336	20	30		CIEDRO
C=C(C)[C@@H]([NH2+]CCC(C)(C)C#N)c1ccc(F)c(F)c1	ZINC000274923286	263031559	/nfs/dbraw/zinc/03/15/59/263031559.db2.gz	ZJTNPBUBHLBZLZ-OAHLLOKOSA-N	1	0	278.346	4.111	20	30		CIEDRO
Cc1[nH]c2ccccc2c1C1CC[NH+]([C@H](C)CCC#N)CC1	ZINC000276305927	263036203	/nfs/dbraw/zinc/03/62/03/263036203.db2.gz	KYZIYNAKKORBGU-CQSZACIVSA-N	1	0	295.430	4.348	20	30		CIEDRO
C[C@@H](CCC#N)[N@@H+]1CCC[C@@H]1c1nc2ccccc2s1	ZINC000276335174	263036323	/nfs/dbraw/zinc/03/63/23/263036323.db2.gz	RUKZIGAOYRYRHS-GXTWGEPZSA-N	1	0	285.416	4.125	20	30		CIEDRO
CC[C@@](C)([NH2+]CCCCC(C)(C)C#N)c1nc(C)cs1	ZINC000277732918	263043124	/nfs/dbraw/zinc/04/31/24/263043124.db2.gz	OGVHQXVDURHBPN-MRXNPFEDSA-N	1	0	293.480	4.386	20	30		CIEDRO
C[C@H](c1cccc(O)c1)[N@H+](C)CCCCC(C)(C)C#N	ZINC000277842980	263044020	/nfs/dbraw/zinc/04/40/20/263044020.db2.gz	WZKOKNCGMAUFDS-CQSZACIVSA-N	1	0	274.408	4.105	20	30		CIEDRO
C[N@H+](Cc1csc2ccccc12)[C@@H]1CC[C@H](C#N)C1	ZINC000278569832	263049211	/nfs/dbraw/zinc/04/92/11/263049211.db2.gz	JEFAOESQPYMKKN-GXTWGEPZSA-N	1	0	270.401	4.025	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@H](C)c1csc(Cl)c1	ZINC000280956995	263065444	/nfs/dbraw/zinc/06/54/44/263065444.db2.gz	YJMUYQMMILVVMZ-GYSYKLTISA-N	1	0	285.840	4.033	20	30		CIEDRO
C/C(=C\c1ccccc1)C[NH2+]CC1CCC(C#N)CC1	ZINC000281465329	263069197	/nfs/dbraw/zinc/06/91/97/263069197.db2.gz	BDXWDZJNXSMJHR-RVDMUPIBSA-N	1	0	268.404	4.009	20	30		CIEDRO
CSc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@H](C#N)C2)cc1	ZINC000281824131	263072207	/nfs/dbraw/zinc/07/22/07/263072207.db2.gz	ZVMUYWLAAFEKCO-KCQAQPDRSA-N	1	0	274.433	4.141	20	30		CIEDRO
CCOc1ccc([C@H](C)[NH2+]CC2CCC(C#N)CC2)cc1	ZINC000282139658	263074744	/nfs/dbraw/zinc/07/47/44/263074744.db2.gz	BZUUDFBBHCWSHG-FHERZECASA-N	1	0	286.419	4.066	20	30		CIEDRO
C[C@@H]([NH2+]CC1CCC(C#N)CC1)c1cc2ccccc2o1	ZINC000282137796	263074795	/nfs/dbraw/zinc/07/47/95/263074795.db2.gz	BTZSDYCXRXSDAQ-WLYUNCDWSA-N	1	0	282.387	4.413	20	30		CIEDRO
C[C@@H]([NH2+]CC1CCC(C#N)CC1)c1cnc2ccsc2c1	ZINC000282177120	263074835	/nfs/dbraw/zinc/07/48/35/263074835.db2.gz	FJBZNNWDOPQAPC-IYXRBSQSSA-N	1	0	299.443	4.277	20	30		CIEDRO
CC[C@H]([NH2+]CC1CCC(C#N)CC1)c1ccccc1	ZINC000282420127	263076578	/nfs/dbraw/zinc/07/65/78/263076578.db2.gz	LRQIZEIRWTVEOW-DQPZFDDXSA-N	1	0	256.393	4.057	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@H](C#N)C1)c1ccc(C(F)(F)F)cc1	ZINC000282520462	263077265	/nfs/dbraw/zinc/07/72/65/263077265.db2.gz	ZOSCHZOWZFFRCC-MJVIPROJSA-N	1	0	282.309	4.048	20	30		CIEDRO
CC(C)Oc1ccc([C@H](C)[NH2+]CCCCC#N)cc1Cl	ZINC000284303749	263086424	/nfs/dbraw/zinc/08/64/24/263086424.db2.gz	KWLXJQHWVGNXAH-ZDUSSCGKSA-N	1	0	294.826	4.472	20	30		CIEDRO
C[C@H]([NH2+]CCCCC#N)c1ccc(Oc2cccnc2)cc1	ZINC000289577970	263110882	/nfs/dbraw/zinc/11/08/82/263110882.db2.gz	YWFRXOALTVSGIG-HNNXBMFYSA-N	1	0	295.386	4.218	20	30		CIEDRO
C[C@@H]([NH2+]CC1CCC(C#N)CC1)c1nccc2ccccc21	ZINC000290022663	263114079	/nfs/dbraw/zinc/11/40/79/263114079.db2.gz	AMAWDDIKORDTIF-QQFBHYJXSA-N	1	0	293.414	4.215	20	30		CIEDRO
C[C@H]1C[C@H]([NH2+]CC2CCC(C#N)CC2)c2ccccc21	ZINC000290341096	263116116	/nfs/dbraw/zinc/11/61/16/263116116.db2.gz	PKNPDSFPMMVSON-HKLFFYFNSA-N	1	0	268.404	4.154	20	30		CIEDRO
C[C@]1(c2ccccc2)CCC[N@@H+]([C@H]2CC[C@H](C#N)C2)CC1	ZINC000293724268	263147641	/nfs/dbraw/zinc/14/76/41/263147641.db2.gz	YSBNXUZEJOSZLC-WDSOQIARSA-N	1	0	282.431	4.122	20	30		CIEDRO
Cc1cc(C)cc(C2=CC[N@@H+]([C@@H]3CC[C@@H](C#N)C3)CC2)c1	ZINC000293714058	263147876	/nfs/dbraw/zinc/14/78/76/263147876.db2.gz	FAAWRAMFVATEKB-VQIMIIECSA-N	1	0	280.415	4.085	20	30		CIEDRO
CCc1ccc([C@@H]2CCC[N@@H+]([C@@H]3CC[C@H](C#N)C3)C2)cc1	ZINC000293735466	263148053	/nfs/dbraw/zinc/14/80/53/263148053.db2.gz	ZQWBDOVUTGCEMN-QXAKKESOSA-N	1	0	282.431	4.121	20	30		CIEDRO
CCc1ccc(C2=CC[N@@H+]([C@H]3CC[C@@H](C#N)C3)CC2)cc1	ZINC000293908232	263152055	/nfs/dbraw/zinc/15/20/55/263152055.db2.gz	WRVKCWHUYHIIBW-APWZRJJASA-N	1	0	280.415	4.030	20	30		CIEDRO
CCc1ccc(C2=CC[N@@H+]([C@H]3CC[C@H](C#N)C3)CC2)cc1	ZINC000293908234	263152211	/nfs/dbraw/zinc/15/22/11/263152211.db2.gz	WRVKCWHUYHIIBW-LPHOPBHVSA-N	1	0	280.415	4.030	20	30		CIEDRO
Cc1ccncc1[C@H](C)[NH2+][C@H](CCCC#N)c1ccccc1	ZINC000340447937	263154197	/nfs/dbraw/zinc/15/41/97/263154197.db2.gz	HVDNTLGMYQVIPO-QFBILLFUSA-N	1	0	293.414	4.476	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](CCCC#N)c1ccccc1)c1cccc(O)c1	ZINC000340450402	263155083	/nfs/dbraw/zinc/15/50/83/263155083.db2.gz	YGIZFUCNYGBTHP-BEFAXECRSA-N	1	0	294.398	4.478	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH+]2CCC(c3cccc(Cl)c3)CC2)C1	ZINC000294203299	263157494	/nfs/dbraw/zinc/15/74/94/263157494.db2.gz	RNGHZDKPHCGUPO-SUMWQHHRSA-N	1	0	288.822	4.212	20	30		CIEDRO
CC(C)(C)c1ccc(C[NH2+][C@H]2CC[C@@H](CC#N)C2)s1	ZINC000295109064	263172273	/nfs/dbraw/zinc/17/22/73/263172273.db2.gz	USTUHDFDZSVAKT-STQMWFEESA-N	1	0	276.449	4.218	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]Cc1cc(C2CC2)ccc1F	ZINC000295145667	263173512	/nfs/dbraw/zinc/17/35/12/263173512.db2.gz	QMEYNSDQZXCCLP-UHFFFAOYSA-N	1	0	274.383	4.123	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)C(C)(C)c1ccccc1	ZINC000295865160	263183178	/nfs/dbraw/zinc/18/31/78/263183178.db2.gz	BSGDUOFUEUIGOJ-ZOBUZTSGSA-N	1	0	270.420	4.025	20	30		CIEDRO
CC(F)(F)CC[NH2+]C1CCC(C#N)(c2ccccc2)CC1	ZINC000296091486	263185722	/nfs/dbraw/zinc/18/57/22/263185722.db2.gz	RGOHVRJTOIBJPV-UHFFFAOYSA-N	1	0	292.373	4.025	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccc(C(F)(F)F)cc1	ZINC000296375906	263190787	/nfs/dbraw/zinc/19/07/87/263190787.db2.gz	JIXDVZJUOZYVJS-XUJVJEKNSA-N	1	0	296.336	4.438	20	30		CIEDRO
CCC[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccc(OC)cc1	ZINC000296510603	263192394	/nfs/dbraw/zinc/19/23/94/263192394.db2.gz	PMIFOMCHPKWYJU-QILLFSRXSA-N	1	0	286.419	4.208	20	30		CIEDRO
CC(C)[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccc(F)c(F)c1	ZINC000296512357	263192414	/nfs/dbraw/zinc/19/24/14/263192414.db2.gz	PMTYISDYVHSDKP-JDFRZJQESA-N	1	0	292.373	4.334	20	30		CIEDRO
CC[C@@H]([NH2+]CC1CCC(C#N)CC1)c1ccsc1	ZINC000296603059	263193925	/nfs/dbraw/zinc/19/39/25/263193925.db2.gz	XVMSWWPVXKSRDW-SSDMNJCBSA-N	1	0	262.422	4.119	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccc(OC(F)F)cc1	ZINC000296621359	263194344	/nfs/dbraw/zinc/19/43/44/263194344.db2.gz	WXRQCAVHWDKZNP-OBJOEFQTSA-N	1	0	294.345	4.021	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccc(OC(F)F)cc1	ZINC000296621356	263194367	/nfs/dbraw/zinc/19/43/67/263194367.db2.gz	WXRQCAVHWDKZNP-DYEKYZERSA-N	1	0	294.345	4.021	20	30		CIEDRO
N#CCCCC[NH2+][C@@H]1CCc2cc(Cl)cc(Cl)c21	ZINC000340584536	263211327	/nfs/dbraw/zinc/21/13/27/263211327.db2.gz	QKSIIPJFVMYXEC-CYBMUJFWSA-N	1	0	283.202	4.264	20	30		CIEDRO
C=C(C)CC[NH2+][C@H]1CCCc2ncc(C(F)(F)F)cc21	ZINC000453312516	263228032	/nfs/dbraw/zinc/22/80/32/263228032.db2.gz	HDNHULFSMQOZOM-ZDUSSCGKSA-N	1	0	284.325	4.034	20	30		CIEDRO
C[C@H](c1ccc(C(F)(F)F)cc1)[N@H+](C)CCCC#N	ZINC000299361015	263240162	/nfs/dbraw/zinc/24/01/62/263240162.db2.gz	IRUAJCHXJDFXBR-LLVKDONJSA-N	1	0	270.298	4.002	20	30		CIEDRO
CC[C@@H]([NH2+][C@H](C)CCC#N)c1cccc(Cl)c1	ZINC000299701511	263253006	/nfs/dbraw/zinc/25/30/06/263253006.db2.gz	PAQDFXMRKOFOJC-BXUZGUMPSA-N	1	0	250.773	4.073	20	30		CIEDRO
C[C@@H](CCC#N)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000299733976	263254385	/nfs/dbraw/zinc/25/43/85/263254385.db2.gz	ZEJXPOCOPQTJOX-QWRGUYRKSA-N	1	0	270.298	4.048	20	30		CIEDRO
C[C@@H](CCC#N)[NH2+][C@@H](C)c1ccc2ccccc2c1	ZINC000299733677	263254507	/nfs/dbraw/zinc/25/45/07/263254507.db2.gz	YWRYHQNZGWHFPU-KBPBESRZSA-N	1	0	252.361	4.183	20	30		CIEDRO
C=CCSCC[NH2+][C@@H]1CCCOc2cc(Cl)ccc21	ZINC000341828393	263352972	/nfs/dbraw/zinc/35/29/72/263352972.db2.gz	SWFHFPBPSGZXDZ-CQSZACIVSA-N	1	0	297.851	4.063	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1nc(C)cs1)c1ccccc1	ZINC000341922978	263366182	/nfs/dbraw/zinc/36/61/82/263366182.db2.gz	BYWLJUMREPDRSB-OAHLLOKOSA-N	1	0	272.417	4.249	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1cccc(C#N)c1F)c1ccccc1	ZINC000341938585	263367295	/nfs/dbraw/zinc/36/72/95/263367295.db2.gz	DCIVOIMZNBORPD-GOSISDBHSA-N	1	0	294.373	4.494	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCF)c1ccc(C(F)(F)F)cc1	ZINC000342196870	263398343	/nfs/dbraw/zinc/39/83/43/263398343.db2.gz	DWPYJEULTYEGAK-CYBMUJFWSA-N	1	0	275.289	4.272	20	30		CIEDRO
C=CC[C@H]1[N@@H+](C/C=C/c2ccncc2)CCCC1(C)C	ZINC000425996664	264303297	/nfs/dbraw/zinc/30/32/97/264303297.db2.gz	RUMXYCOIZZIDKI-ZGRWHYIRSA-N	1	0	270.420	4.162	20	30		CIEDRO
C=CC[C@H]1[N@@H+](C/C=C\c2ccncc2)CCCC1(C)C	ZINC000425996662	264303349	/nfs/dbraw/zinc/30/33/49/264303349.db2.gz	RUMXYCOIZZIDKI-CTEOGUNLSA-N	1	0	270.420	4.162	20	30		CIEDRO
CCC(CC)[C@@H]([NH2+]Cc1cc(C#N)n(C)c1)c1ccccc1	ZINC000189586170	264310746	/nfs/dbraw/zinc/31/07/46/264310746.db2.gz	HMADTOKBBYNTEO-LJQANCHMSA-N	1	0	295.430	4.164	20	30		CIEDRO
CCC(CC)[C@H]([NH2+]Cc1cc(C#N)n(C)c1)c1ccccc1	ZINC000189586145	264311259	/nfs/dbraw/zinc/31/12/59/264311259.db2.gz	HMADTOKBBYNTEO-IBGZPJMESA-N	1	0	295.430	4.164	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@H](C)c1ccc(SC)cc1	ZINC000280774566	264461449	/nfs/dbraw/zinc/46/14/49/264461449.db2.gz	HOGCJVDMHMFVHU-UNEWFSDZSA-N	1	0	291.460	4.040	20	30		CIEDRO
C=C(CC)C[NH2+][C@@H](CCCCOC)c1ccccc1	ZINC000348317606	265150245	/nfs/dbraw/zinc/15/02/45/265150245.db2.gz	KPPZGSCCUIZOFW-KRWDZBQOSA-N	1	0	261.409	4.100	20	30		CIEDRO
C[C@@H]([NH2+]Cc1cc(C#N)cs1)c1cccc(Cl)c1	ZINC000093492057	265182498	/nfs/dbraw/zinc/18/24/98/265182498.db2.gz	WOWGJKTXAYBZIK-SNVBAGLBSA-N	1	0	276.792	4.124	20	30		CIEDRO
C=CC[N@H+](Cc1ccccc1Oc1cccnc1)C1CC1	ZINC000357556405	266323315	/nfs/dbraw/zinc/32/33/15/266323315.db2.gz	WNEWLWJGZVSHHC-UHFFFAOYSA-N	1	0	280.371	4.024	20	30		CIEDRO
C=CC[N@@H+](Cc1c(Cl)ccc2cccnc21)C1CC1	ZINC000357555410	266323775	/nfs/dbraw/zinc/32/37/75/266323775.db2.gz	TYWKJYZECBWBAN-UHFFFAOYSA-N	1	0	272.779	4.039	20	30		CIEDRO
C=CCSCC[NH2+][C@@H]1CCCOc2cc(C)c(C)cc21	ZINC000358022164	266399892	/nfs/dbraw/zinc/39/98/92/266399892.db2.gz	IDNQRNMWNMDQEP-MRXNPFEDSA-N	1	0	291.460	4.026	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCCc2ccccc21)c1ccc(C#N)cc1F	ZINC000358559095	266476665	/nfs/dbraw/zinc/47/66/65/266476665.db2.gz	OMCUKAGHCKQGFV-YJYMSZOUSA-N	1	0	294.373	4.426	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@@H](CC)c1c(C)nn(C)c1C	ZINC000359315519	266564108	/nfs/dbraw/zinc/56/41/08/266564108.db2.gz	FEFALXJLYOSNAQ-BBRMVZONSA-N	1	0	277.456	4.213	20	30		CIEDRO
Cc1ccc(C[NH2+][C@@H]2CCCCc3cc(C#N)ccc32)s1	ZINC000360836668	266746889	/nfs/dbraw/zinc/74/68/89/266746889.db2.gz	NBZKFORRGBYCLA-GOSISDBHSA-N	1	0	296.439	4.486	20	30		CIEDRO
N#Cc1ccc2c(c1)CCCC[C@@H]2[NH2+][C@@H]1CC12CCCC2	ZINC000360872250	266749958	/nfs/dbraw/zinc/74/99/58/266749958.db2.gz	LXCCECYVDHOASG-ZWKOTPCHSA-N	1	0	280.415	4.248	20	30		CIEDRO
C=CCCC[C@@H](C)[NH+]1CCC(c2ccc(C)nc2)CC1	ZINC000361061426	266776316	/nfs/dbraw/zinc/77/63/16/266776316.db2.gz	ZLIQWUZJRFFMKP-MRXNPFEDSA-N	1	0	272.436	4.314	20	30		CIEDRO
C=CCCC[N@@H+](C)[C@H](c1ccccc1)c1ccccn1	ZINC000117881536	267223804	/nfs/dbraw/zinc/22/38/04/267223804.db2.gz	HBYZXNLIANBNOE-GOSISDBHSA-N	1	0	266.388	4.069	20	30		CIEDRO
CC(C)(C#N)CCCC[NH+]1CCC(Cc2cccnc2)CC1	ZINC000369320984	267235384	/nfs/dbraw/zinc/23/53/84/267235384.db2.gz	DBHNIRUREHHPEE-UHFFFAOYSA-N	1	0	299.462	4.056	20	30		CIEDRO
Cc1ccncc1C1=CC[N@H+](CCCCC(C)(C)C#N)CC1	ZINC000369335908	267236824	/nfs/dbraw/zinc/23/68/24/267236824.db2.gz	TUPYGDZSYILDHM-UHFFFAOYSA-N	1	0	297.446	4.199	20	30		CIEDRO
C=C[C@H](C)[NH2+][C@@H](C)c1csc(-c2csc(C)n2)c1	ZINC000119337082	267322464	/nfs/dbraw/zinc/32/24/64/267322464.db2.gz	UYSPNIOWYKRTGE-UWVGGRQHSA-N	1	0	278.446	4.405	20	30		CIEDRO
C=C[C@@H](C)[NH2+][C@@H](C)c1csc(-c2csc(C)n2)c1	ZINC000119337302	267322524	/nfs/dbraw/zinc/32/25/24/267322524.db2.gz	UYSPNIOWYKRTGE-ZJUUUORDSA-N	1	0	278.446	4.405	20	30		CIEDRO
C[C@@H]([NH2+]CC1(C#N)CCC1)C1CCC(C(F)(F)F)CC1	ZINC000418138475	267361031	/nfs/dbraw/zinc/36/10/31/267361031.db2.gz	GDNBHGMVYXEISW-PNESKVBLSA-N	1	0	288.357	4.027	20	30		CIEDRO
N#CC1(C[NH2+][C@@H]2CCC[C@H]2c2ccccc2Cl)CCC1	ZINC000418142249	267363203	/nfs/dbraw/zinc/36/32/03/267363203.db2.gz	MKQAVOPLFXWXKX-GOEBONIOSA-N	1	0	288.822	4.260	20	30		CIEDRO
C[C@H](CCc1ccc(Cl)s1)[NH2+]CC1(C#N)CCC1	ZINC000418138094	267371565	/nfs/dbraw/zinc/37/15/65/267371565.db2.gz	FZBFLKUXFTYZDR-LLVKDONJSA-N	1	0	282.840	4.006	20	30		CIEDRO
CCC[C@@H]([NH2+]Cc1ccc(C#N)cc1F)c1ccccc1	ZINC000120132529	267385607	/nfs/dbraw/zinc/38/56/07/267385607.db2.gz	LAIBTJFJDFFGPO-GOSISDBHSA-N	1	0	282.362	4.328	20	30		CIEDRO
C[C@@H]1C[C@H](c2cccs2)C[N@@H+]1CC(C)(C)CCC#N	ZINC000371397688	267399198	/nfs/dbraw/zinc/39/91/98/267399198.db2.gz	BWRMHXSHOHMPFG-KGLIPLIRSA-N	1	0	276.449	4.256	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H]1COc2ccc(C)cc21)c1ccc(C#N)cc1	ZINC000377083572	268046151	/nfs/dbraw/zinc/04/61/51/268046151.db2.gz	OHVTXOIUAPVPHO-QZTJIDSGSA-N	1	0	292.382	4.041	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1COc2ccc(C)cc21)c1ccc(C#N)cc1	ZINC000377083573	268046461	/nfs/dbraw/zinc/04/64/61/268046461.db2.gz	OHVTXOIUAPVPHO-ROUUACIJSA-N	1	0	292.382	4.041	20	30		CIEDRO
CC[NH+](CC)CCC[C@@H](C)Nc1ccc(Cl)cc1C#N	ZINC000052856807	327617911	/nfs/dbraw/zinc/61/79/11/327617911.db2.gz	QOFBLQVHOSLWLI-CYBMUJFWSA-N	1	0	293.842	4.134	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+][C@H](C)c1nc2ccccc2n1CC	ZINC000186058087	327680798	/nfs/dbraw/zinc/68/07/98/327680798.db2.gz	BTOKCRYXDDPOHS-ZIAGYGMSSA-N	1	0	271.408	4.062	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]C/C(C)=C\c1cccc([N+](=O)[O-])c1	ZINC000580220926	327738172	/nfs/dbraw/zinc/73/81/72/327738172.db2.gz	FHTIYRDRETWZNI-UVTDQMKNSA-N	1	0	288.391	4.190	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+][C@@H]1CCOC2(CCSCC2)C1	ZINC000540159352	327780775	/nfs/dbraw/zinc/78/07/75/327780775.db2.gz	CUSUCNKCSDHEMO-HZPDHXFCSA-N	1	0	297.508	4.156	20	30		CIEDRO
C[C@@H]([NH2+]CCCCC#N)c1cc(Cl)ccc1Cl	ZINC000178649340	327795257	/nfs/dbraw/zinc/79/52/57/327795257.db2.gz	OMNVFSDDAZYAHV-SNVBAGLBSA-N	1	0	271.191	4.338	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)c1cccc(Cl)c1	ZINC000185755863	327844338	/nfs/dbraw/zinc/84/43/38/327844338.db2.gz	YSQCBNOIYCPJJZ-TYNCELHUSA-N	1	0	262.784	4.073	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1ccccc1Cl	ZINC000185755816	327844533	/nfs/dbraw/zinc/84/45/33/327844533.db2.gz	BWWIKVDEWFEDBC-AGIUHOORSA-N	1	0	262.784	4.073	20	30		CIEDRO
N#Cc1ccc(C[NH2+]Cc2ccc(-c3ccccc3)o2)s1	ZINC000540523930	327889351	/nfs/dbraw/zinc/88/93/51/327889351.db2.gz	AGBLJEZVOQJALB-UHFFFAOYSA-N	1	0	294.379	4.170	20	30		CIEDRO
N#Cc1csc(C[NH2+][C@@H]2CC[C@H]3CCCC[C@H]3C2)c1	ZINC000531356324	327901174	/nfs/dbraw/zinc/90/11/74/327901174.db2.gz	OMXIDPNPGMVIMZ-QLFBSQMISA-N	1	0	274.433	4.068	20	30		CIEDRO
C[C@@H]1CC[N@H+](CC(C)(C)CCC#N)[C@@H]2CCCC[C@@H]12	ZINC000534337779	328049487	/nfs/dbraw/zinc/04/94/87/328049487.db2.gz	FYACIWQBKLDBPS-OWCLPIDISA-N	1	0	262.441	4.217	20	30		CIEDRO
C=CC[N@H+](CCc1ccccc1)Cc1cnc(C2CC2)s1	ZINC000534348780	328047737	/nfs/dbraw/zinc/04/77/37/328047737.db2.gz	MLXZPQABZVXTFP-UHFFFAOYSA-N	1	0	298.455	4.251	20	30		CIEDRO
CC(C)CC[N@H+](Cc1ccc(C#N)cc1)C1CCCC1	ZINC000110364375	328048905	/nfs/dbraw/zinc/04/89/05/328048905.db2.gz	DCQVWUWYKVRNCQ-UHFFFAOYSA-N	1	0	270.420	4.349	20	30		CIEDRO
C[C@@H]1CC[N@H+](CC(C)(C)CCC#N)[C@H]2CCCC[C@@H]12	ZINC000534337780	328049628	/nfs/dbraw/zinc/04/96/28/328049628.db2.gz	FYACIWQBKLDBPS-PMPSAXMXSA-N	1	0	262.441	4.217	20	30		CIEDRO
N#Cc1ccc(C[N@@H+]2CCCCC[C@@H]2c2ccccc2)nc1	ZINC000565167213	328070057	/nfs/dbraw/zinc/07/00/57/328070057.db2.gz	XNJSWULBMNVKFD-LJQANCHMSA-N	1	0	291.398	4.071	20	30		CIEDRO
C=CCCCC[NH2+]Cc1ccc(C#N)cc1C(F)(F)F	ZINC000563574517	328074267	/nfs/dbraw/zinc/07/42/67/328074267.db2.gz	OOFPWOFQVIFQTI-UHFFFAOYSA-N	1	0	282.309	4.023	20	30		CIEDRO
CC1(C)CCc2ccccc2[C@H]([NH2+][C@H]2CC[C@H](C#N)C2)C1	ZINC000571302177	328100773	/nfs/dbraw/zinc/10/07/73/328100773.db2.gz	GCAZCHZVXBIBLG-QILLFSRXSA-N	1	0	282.431	4.372	20	30		CIEDRO
C[C@@H]([NH2+]CCc1ccc(Cl)cc1)c1ccc(C#N)cc1	ZINC000022148879	328129653	/nfs/dbraw/zinc/12/96/53/328129653.db2.gz	MXJFUAUHIUBLOG-CYBMUJFWSA-N	1	0	284.790	4.105	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@H](CC)CC(F)(F)F)C1CC1	ZINC000414267294	328153970	/nfs/dbraw/zinc/15/39/70/328153970.db2.gz	RYOOAIGNVOZTEW-DGCLKSJQSA-N	1	0	263.347	4.299	20	30		CIEDRO
C=CC[C@@H](Cc1ccccc1)[NH2+][C@H](C)c1cncc(C)c1	ZINC000414306851	328154333	/nfs/dbraw/zinc/15/43/33/328154333.db2.gz	RMBVTSQIGAVBSR-APWZRJJASA-N	1	0	280.415	4.228	20	30		CIEDRO
C=CCC[C@@H]([NH2+][C@@H]1C[C@H]1c1ccco1)c1ccco1	ZINC000414349722	328155662	/nfs/dbraw/zinc/15/56/62/328155662.db2.gz	PVUCIBHTPGZCTL-MGPQQGTHSA-N	1	0	257.333	4.026	20	30		CIEDRO
C[C@@H]1C[C@H]([NH2+]Cc2ccc(CC#N)cc2)c2ccccc21	ZINC000571641843	328167258	/nfs/dbraw/zinc/16/72/58/328167258.db2.gz	RZSXDMCVXDLUEC-KUHUBIRLSA-N	1	0	276.383	4.091	20	30		CIEDRO
N#CCC[C@@H]([NH2+][C@H]1CCc2c1cccc2F)c1ccccc1	ZINC000271532174	328196810	/nfs/dbraw/zinc/19/68/10/328196810.db2.gz	RGVAEFAXBNIWLN-MOPGFXCFSA-N	1	0	294.373	4.448	20	30		CIEDRO
CC1(C)CC[C@H]([NH2+]CCCCC#N)c2ccccc21	ZINC000280910664	328237053	/nfs/dbraw/zinc/23/70/53/328237053.db2.gz	QLTNQLICZVWNFD-INIZCTEOSA-N	1	0	256.393	4.083	20	30		CIEDRO
N#CC1CCC(C[NH2+][C@H]2CC[C@H](c3ccccc3)C2)CC1	ZINC000281636027	328240926	/nfs/dbraw/zinc/24/09/26/328240926.db2.gz	IPGCLKRKCIZSCR-VHZYLWGESA-N	1	0	282.431	4.242	20	30		CIEDRO
N#CC1CCC(C[NH2+][C@@H]2CC[C@H](c3ccccc3)C2)CC1	ZINC000281636029	328240970	/nfs/dbraw/zinc/24/09/70/328240970.db2.gz	IPGCLKRKCIZSCR-YVZJPGBNSA-N	1	0	282.431	4.242	20	30		CIEDRO
CC[C@@H]([NH2+]CC1CCC(C#N)CC1)c1cccc(F)c1	ZINC000282507629	328242560	/nfs/dbraw/zinc/24/25/60/328242560.db2.gz	YPAOPRJVHYVAEJ-MQBCKMQZSA-N	1	0	274.383	4.196	20	30		CIEDRO
N#Cc1ccc2c(c1)[C@H]([NH2+]Cc1coc3ccccc13)CC2	ZINC000340426113	328275903	/nfs/dbraw/zinc/27/59/03/328275903.db2.gz	LKZHPBHIDINUML-GOSISDBHSA-N	1	0	288.350	4.082	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H]1CCCc2nc(C)sc21	ZINC000340426676	328275982	/nfs/dbraw/zinc/27/59/82/328275982.db2.gz	HHUDKBRBAHINNN-LBPRGKRZSA-N	1	0	264.438	4.021	20	30		CIEDRO
CC[C@@H]1CC[C@@H]1[NH2+][C@@H](CCCC#N)c1ccccc1	ZINC000340429741	328276408	/nfs/dbraw/zinc/27/64/08/328276408.db2.gz	DILSTCBHSWTFQM-PVAVHDDUSA-N	1	0	256.393	4.200	20	30		CIEDRO
C[C@H]([NH2+][C@@H](CCCC#N)c1ccccc1)c1ccc(F)cn1	ZINC000340430909	328276604	/nfs/dbraw/zinc/27/66/04/328276604.db2.gz	IGRYFIYAIOWTRL-KSSFIOAISA-N	1	0	297.377	4.306	20	30		CIEDRO
C[C@@H]1C[C@H]([NH2+][C@H](CCCC#N)c2ccccc2)[C@@H]1C	ZINC000340440018	328277746	/nfs/dbraw/zinc/27/77/46/328277746.db2.gz	CCHOWIPHERZDMG-SRABZTEZSA-N	1	0	256.393	4.056	20	30		CIEDRO
C[C@H]([NH2+][C@@H](CCCC#N)c1ccccc1)c1ccccn1	ZINC000340444212	328278190	/nfs/dbraw/zinc/27/81/90/328278190.db2.gz	GYGCSCINHUOWMZ-YJBOKZPZSA-N	1	0	279.387	4.167	20	30		CIEDRO
C[C@@H]([NH2+][C@H](CCCC#N)c1ccccc1)c1ccccn1	ZINC000340444207	328278321	/nfs/dbraw/zinc/27/83/21/328278321.db2.gz	GYGCSCINHUOWMZ-CRAIPNDOSA-N	1	0	279.387	4.167	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1cccc(Cl)c1	ZINC000295847832	328287342	/nfs/dbraw/zinc/28/73/42/328287342.db2.gz	AUUDIWVZHSVQIP-RCBQFDQVSA-N	1	0	276.811	4.463	20	30		CIEDRO
Cc1c2ccccc2oc1[C@H](C)[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000296554443	328291141	/nfs/dbraw/zinc/29/11/41/328291141.db2.gz	RTCXRLMTLVTGDQ-KKUMJFAQSA-N	1	0	282.387	4.474	20	30		CIEDRO
C=C(C)COCC[NH2+][C@@H](C)c1ccc(SC(C)C)cc1	ZINC000537962224	328321907	/nfs/dbraw/zinc/32/19/07/328321907.db2.gz	QCABXDPNSWXXDE-HNNXBMFYSA-N	1	0	293.476	4.430	20	30		CIEDRO
C=C(C)COCC[NH2+][C@@H](C)c1ccccc1SCC	ZINC000537962354	328324580	/nfs/dbraw/zinc/32/45/80/328324580.db2.gz	WCDGTVZZDQPXQQ-AWEZNQCLSA-N	1	0	279.449	4.042	20	30		CIEDRO
N#Cc1ccccc1C[N@@H+]1CCC[C@H](c2ccccc2)CC1	ZINC000303196442	328327245	/nfs/dbraw/zinc/32/72/45/328327245.db2.gz	NPVUWFYKPOGRPT-SFHVURJKSA-N	1	0	290.410	4.328	20	30		CIEDRO
CC(C)[N@H+](Cc1cccs1)Cc1ccc(C#N)cc1F	ZINC000049028792	328334135	/nfs/dbraw/zinc/33/41/35/328334135.db2.gz	YKTGPADRPFIZBQ-UHFFFAOYSA-N	1	0	288.391	4.169	20	30		CIEDRO
CCS[C@H]1CCCC[N@@H+]([C@@H](C)c2ccc(C#N)cc2)C1	ZINC000303694618	328357573	/nfs/dbraw/zinc/35/75/73/328357573.db2.gz	MYFJXTYNBZWUKU-YOEHRIQHSA-N	1	0	288.460	4.227	20	30		CIEDRO
CC[C@H](Cc1ccccc1)[N@H+](C)Cc1ccc(C#N)cc1	ZINC000303892693	328364152	/nfs/dbraw/zinc/36/41/52/328364152.db2.gz	KKEHIGLEBFJUJU-LJQANCHMSA-N	1	0	278.399	4.011	20	30		CIEDRO
CC[C@@H]([NH2+][C@H](C)c1cccc(C#N)c1)c1cccs1	ZINC000049529579	328367928	/nfs/dbraw/zinc/36/79/28/328367928.db2.gz	XOTZOKLOPIZLID-IUODEOHRSA-N	1	0	270.401	4.422	20	30		CIEDRO
C[C@H](Cc1ccsc1)[NH2+][C@H](C)c1ccc(C#N)cc1F	ZINC000541904725	328375928	/nfs/dbraw/zinc/37/59/28/328375928.db2.gz	ZJVLSKGMVQMHLM-VXGBXAGGSA-N	1	0	288.391	4.041	20	30		CIEDRO
C[C@@H](Cc1ccsc1)[NH2+][C@@H](C)c1ccc(C#N)cc1F	ZINC000541904724	328376023	/nfs/dbraw/zinc/37/60/23/328376023.db2.gz	ZJVLSKGMVQMHLM-RYUDHWBXSA-N	1	0	288.391	4.041	20	30		CIEDRO
C[N@H+](Cc1ccc(C#N)s1)[C@H]1CCCc2ccccc21	ZINC000535068768	328383517	/nfs/dbraw/zinc/38/35/17/328383517.db2.gz	ZOCAWLLDSKQPDA-KRWDZBQOSA-N	1	0	282.412	4.129	20	30		CIEDRO
C[N@H+](Cc1ccc(C#N)s1)[C@@H]1CCCc2ccccc21	ZINC000535068769	328383665	/nfs/dbraw/zinc/38/36/65/328383665.db2.gz	ZOCAWLLDSKQPDA-QGZVFWFLSA-N	1	0	282.412	4.129	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H](CC1CC1)c1ccccc1	ZINC000563741565	328499115	/nfs/dbraw/zinc/49/91/15/328499115.db2.gz	YVACHXXTBQOTRF-KRWDZBQOSA-N	1	0	270.420	4.447	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H](CC1CC1)c1ccccc1	ZINC000563741571	328499175	/nfs/dbraw/zinc/49/91/75/328499175.db2.gz	YVACHXXTBQOTRF-QGZVFWFLSA-N	1	0	270.420	4.447	20	30		CIEDRO
C=CCC[NH2+][C@@H](C)c1nc(-c2ccccc2)cs1	ZINC000184528805	328532648	/nfs/dbraw/zinc/53/26/48/328532648.db2.gz	JTGKQGVQUUFRGO-LBPRGKRZSA-N	1	0	258.390	4.037	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+]Cc1ccc2nc(C)ccc2c1	ZINC000398184451	326873444	/nfs/dbraw/zinc/87/34/44/326873444.db2.gz	PHTXNOYCMGAEBQ-AWEZNQCLSA-N	1	0	268.404	4.378	20	30		CIEDRO
C=CCc1cc(C[NH2+]C(C)(C)C(C)(C)C)cc(OC)c1O	ZINC000552071986	326874700	/nfs/dbraw/zinc/87/47/00/326874700.db2.gz	NKXJWNRXOIJXDW-UHFFFAOYSA-N	1	0	291.435	4.044	20	30		CIEDRO
C=C(C)COCC[NH2+][C@@H](CC)c1ccc(Cl)s1	ZINC000090450978	326922428	/nfs/dbraw/zinc/92/24/28/326922428.db2.gz	IMFKKPITZNDBCY-NSHDSACASA-N	1	0	273.829	4.035	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H]2CCc3c2cccc3F)cc1	ZINC000506631830	332775906	/nfs/dbraw/zinc/77/59/06/332775906.db2.gz	KOVWWAPNOCKYDF-LJQANCHMSA-N	1	0	297.373	4.168	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@@H](C)CCc1ccc(F)cc1F	ZINC000556876989	326977159	/nfs/dbraw/zinc/97/71/59/326977159.db2.gz	KHZMCPYQKPTNLI-SWLSCSKDSA-N	1	0	267.363	4.230	20	30		CIEDRO
C=CCOc1cccc(C[NH2+]C[C@H](C)c2ccc(F)cc2)c1	ZINC000557178501	326995524	/nfs/dbraw/zinc/99/55/24/326995524.db2.gz	JACLCZWPCADMIR-HNNXBMFYSA-N	1	0	299.389	4.284	20	30		CIEDRO
CCCC[N@H+](Cc1nc(C#N)cs1)[C@@H]1CCC[C@@H](C)C1	ZINC000557395628	327004360	/nfs/dbraw/zinc/00/43/60/327004360.db2.gz	PBDJHNRSDYUYFK-UKRRQHHQSA-N	1	0	291.464	4.196	20	30		CIEDRO
C=C(C)C[N@@H+](C)[C@H](C)Cc1ccccc1C(F)(F)F	ZINC000557445909	327005617	/nfs/dbraw/zinc/00/56/17/327005617.db2.gz	SDQPCIGZJAOSHB-GFCCVEGCSA-N	1	0	271.326	4.144	20	30		CIEDRO
CC(C)(C)c1ccc(C[NH2+]Cc2ccc(CC#N)cc2)cc1	ZINC000565774420	327009284	/nfs/dbraw/zinc/00/92/84/327009284.db2.gz	YILNBFQFLLXPBX-UHFFFAOYSA-N	1	0	292.426	4.340	20	30		CIEDRO
CCC[C@@H](CC)[NH2+][C@@H]1CCCc2cc(C#N)ccc21	ZINC000557523866	327011322	/nfs/dbraw/zinc/01/13/22/327011322.db2.gz	SKDQQXCMATYATH-NVXWUHKLSA-N	1	0	256.393	4.104	20	30		CIEDRO
N#CCC[C@H]([NH2+]CC1Cc2ccccc2C1)c1ccccc1	ZINC000557542388	327012774	/nfs/dbraw/zinc/01/27/74/327012774.db2.gz	FUBVWMCOGYJRIH-FQEVSTJZSA-N	1	0	290.410	4.036	20	30		CIEDRO
N#CCCC[NH2+][C@@H](c1ccccc1)C1CCCCC1	ZINC000557725329	327023048	/nfs/dbraw/zinc/02/30/48/327023048.db2.gz	NNPFIOPUWZKPDB-KRWDZBQOSA-N	1	0	256.393	4.201	20	30		CIEDRO
N#CCC[C@H]([NH2+]C/C=C\c1ccc(F)cc1)c1ccccc1	ZINC000255909945	327029123	/nfs/dbraw/zinc/02/91/23/327029123.db2.gz	VKRRTZRLEQQSKF-VOFKWLDRSA-N	1	0	294.373	4.474	20	30		CIEDRO
N#CCC[C@@H]([NH2+]C/C=C\c1ccc(F)cc1)c1ccccc1	ZINC000255909944	327029140	/nfs/dbraw/zinc/02/91/40/327029140.db2.gz	VKRRTZRLEQQSKF-SFFCAUCYSA-N	1	0	294.373	4.474	20	30		CIEDRO
C=CC[N@@H+](CCOC)[C@H](C)c1cccc2ccccc21	ZINC000557923854	327035339	/nfs/dbraw/zinc/03/53/39/327035339.db2.gz	XSOIADMJFUYKLW-OAHLLOKOSA-N	1	0	269.388	4.035	20	30		CIEDRO
C[C@H]1C[C@H](c2ccccc2)CC[N@@H+]1CCC(C)(C)C#N	ZINC000558108414	327074111	/nfs/dbraw/zinc/07/41/11/327074111.db2.gz	XSQGLRLMBFVLOY-DOTOQJQBSA-N	1	0	270.420	4.194	20	30		CIEDRO
CC(C)(C#N)CCCC[N@@H+]1CCC2(C1)CCCCC2	ZINC000311404700	327080166	/nfs/dbraw/zinc/08/01/66/327080166.db2.gz	WKGJBUAMPMESKR-UHFFFAOYSA-N	1	0	262.441	4.363	20	30		CIEDRO
C[C@@H]([NH2+]CCC1(F)CCC1)c1ccc(C#N)cc1Cl	ZINC000558259186	327083044	/nfs/dbraw/zinc/08/30/44/327083044.db2.gz	QAQYHWIQCGINMU-LLVKDONJSA-N	1	0	280.774	4.145	20	30		CIEDRO
CC(C)SCC[NH2+][C@@H](C)c1ccc(C#N)cc1Cl	ZINC000558259672	327083221	/nfs/dbraw/zinc/08/32/21/327083221.db2.gz	VXDVFIKUSNMRBB-NSHDSACASA-N	1	0	282.840	4.004	20	30		CIEDRO
C=CC[N@@H+](C)C/C(C)=C/c1cccc(C(F)(F)F)c1	ZINC000558404585	327091507	/nfs/dbraw/zinc/09/15/07/327091507.db2.gz	FSVAVKBRRKBMLP-FMIVXFBMSA-N	1	0	269.310	4.227	20	30		CIEDRO
CCC1(C[NH2+][C@H]2CCc3ccc(C#N)cc32)CCCC1	ZINC000558498699	327098870	/nfs/dbraw/zinc/09/88/70/327098870.db2.gz	GCTNFALNYONQCN-KRWDZBQOSA-N	1	0	268.404	4.106	20	30		CIEDRO
C[C@H]1C[C@@H]([NH2+]Cc2ccc(C#N)c(F)c2)c2ccccc21	ZINC000404577437	332781709	/nfs/dbraw/zinc/78/17/09/332781709.db2.gz	SFLGEMLFFQNQEG-KPZWWZAWSA-N	1	0	280.346	4.035	20	30		CIEDRO
C=CCOc1ccccc1C[N@@H+]1CC2(CCC2)[C@H]1C1CC1	ZINC000558570685	327105922	/nfs/dbraw/zinc/10/59/22/327105922.db2.gz	XSJLMTAYJNOVAB-GOSISDBHSA-N	1	0	283.415	4.016	20	30		CIEDRO
C[C@H](C#N)C[NH2+][C@@H]1CCC[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000558682885	327113823	/nfs/dbraw/zinc/11/38/23/327113823.db2.gz	QBJBMWGHMLBRJK-IXPVHAAZSA-N	1	0	297.229	4.379	20	30		CIEDRO
C=CC[N@@H+](Cc1cccs1)C[C@@H]1CCC2(CCCC2)O1	ZINC000558721720	327116873	/nfs/dbraw/zinc/11/68/73/327116873.db2.gz	DQAOLOMIXIYQCO-HNNXBMFYSA-N	1	0	291.460	4.228	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCc1cccc(C)n1)c1ccccc1	ZINC000558741146	327118885	/nfs/dbraw/zinc/11/88/85/327118885.db2.gz	ZZGXQEKMOGACMQ-LJQANCHMSA-N	1	0	280.415	4.230	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCc1cccc(C)n1)c1ccccc1	ZINC000558741145	327118892	/nfs/dbraw/zinc/11/88/92/327118892.db2.gz	ZZGXQEKMOGACMQ-IBGZPJMESA-N	1	0	280.415	4.230	20	30		CIEDRO
CCc1oc2ccccc2c1C[N@H+](C)[C@H]1CC[C@@H](C#N)C1	ZINC000559035303	327138493	/nfs/dbraw/zinc/13/84/93/327138493.db2.gz	YVPBNLBGMASJCW-KGLIPLIRSA-N	1	0	282.387	4.119	20	30		CIEDRO
C[C@@H]1C[C@@H]1[C@H]([NH2+][C@H]1CC[C@@H](C#N)C1)c1ccc(Cl)cc1	ZINC000559150201	327143745	/nfs/dbraw/zinc/14/37/45/327143745.db2.gz	TYLBQMMEZVATGC-LQPBRMSDSA-N	1	0	288.822	4.319	20	30		CIEDRO
CC(C)[C@@H](CC(F)(F)F)[NH2+]C1CCC(C)(C#N)CC1	ZINC000449273771	327145824	/nfs/dbraw/zinc/14/58/24/327145824.db2.gz	ZUOFBGMUMYRCET-OTTFEQOBSA-N	1	0	276.346	4.025	20	30		CIEDRO
C=C(C)C[N@H+](Cc1ccc(CO)o1)[C@@H]1C=CCCCCC1	ZINC000559244810	327149621	/nfs/dbraw/zinc/14/96/21/327149621.db2.gz	YFJSQLHJRBRATQ-MRXNPFEDSA-N	1	0	289.419	4.039	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)c1cccc(C2CC2)c1	ZINC000449349193	327166638	/nfs/dbraw/zinc/16/66/38/327166638.db2.gz	JBOIUWAJRKBAJX-PMUMKWKESA-N	1	0	268.404	4.297	20	30		CIEDRO
C=CC[N@@H+](CCc1ccco1)[C@@H](C)Cc1ccsc1	ZINC000569404524	327172661	/nfs/dbraw/zinc/17/26/61/327172661.db2.gz	XJIFAGFNJRRMJH-AWEZNQCLSA-N	1	0	275.417	4.003	20	30		CIEDRO
CCC[C@H](C)[C@H]1CCC[N@@H+]1CC(C)(C)CCC#N	ZINC000093845281	327200551	/nfs/dbraw/zinc/20/05/51/327200551.db2.gz	SYRXKXUETPYXSH-LSDHHAIUSA-N	1	0	250.430	4.217	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](CC)c1ccccc1OC(F)F	ZINC000358051361	327213078	/nfs/dbraw/zinc/21/30/78/327213078.db2.gz	VNUXRYHDIBLASI-YPMHNXCESA-N	1	0	269.335	4.293	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](CC)c1ccccc1OC(F)F	ZINC000358051360	327213096	/nfs/dbraw/zinc/21/30/96/327213096.db2.gz	VNUXRYHDIBLASI-WCQYABFASA-N	1	0	269.335	4.293	20	30		CIEDRO
CC(C)(C)[C@@H]([NH2+]CCCCC#N)c1ccc(F)cc1	ZINC000102397887	327226959	/nfs/dbraw/zinc/22/69/59/327226959.db2.gz	JFYAONCXAGERMO-HNNXBMFYSA-N	1	0	262.372	4.196	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H]1CCc2ccc(OC(F)(F)F)cc21	ZINC000537969913	327239232	/nfs/dbraw/zinc/23/92/32/327239232.db2.gz	XPSLJVAGIHJEIT-QMTHXVAHSA-N	1	0	285.309	4.127	20	30		CIEDRO
C[C@H]([NH2+]CCCCC#N)c1ccc(F)c2ccccc21	ZINC000559752841	327259662	/nfs/dbraw/zinc/25/96/62/327259662.db2.gz	VCKVZQUZTYIEFA-ZDUSSCGKSA-N	1	0	270.351	4.323	20	30		CIEDRO
CC[C@@H]1CCC[C@@H]([NH2+][C@H]2CCc3ccc(C#N)cc32)C1	ZINC000573848402	327263764	/nfs/dbraw/zinc/26/37/64/327263764.db2.gz	QLSGCWGEDKKXGN-QBIMZIAESA-N	1	0	268.404	4.104	20	30		CIEDRO
C[C@@H]([NH2+]Cc1coc2ccccc12)c1ccc(C#N)c(F)c1	ZINC000559859673	327265619	/nfs/dbraw/zinc/26/56/19/327265619.db2.gz	CUAJNCPEFFGXAS-GFCCVEGCSA-N	1	0	294.329	4.294	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+]Cc1ccc(NCCC)cc1	ZINC000560002501	327276699	/nfs/dbraw/zinc/27/66/99/327276699.db2.gz	LLQOYBGMFHZSLP-LSDHHAIUSA-N	1	0	260.425	4.199	20	30		CIEDRO
N#C[C@H]1CC[C@H]([NH2+]CCCCc2ccc(Cl)s2)C1	ZINC000560239031	327292214	/nfs/dbraw/zinc/29/22/14/327292214.db2.gz	VCSHYHTXRMYPMR-RYUDHWBXSA-N	1	0	282.840	4.006	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+]CCCCc2ccc(Cl)s2)C1	ZINC000560239030	327292328	/nfs/dbraw/zinc/29/23/28/327292328.db2.gz	VCSHYHTXRMYPMR-NWDGAFQWSA-N	1	0	282.840	4.006	20	30		CIEDRO
C[C@H](CCc1ccccc1)[NH2+][C@H]1CCc2ccc(C#N)cc21	ZINC000583351731	327315488	/nfs/dbraw/zinc/31/54/88/327315488.db2.gz	NAZGWVUBOAKRPX-QRWLVFNGSA-N	1	0	290.410	4.156	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCc1ncc(CC)s1)c1ccco1	ZINC000560530830	327319900	/nfs/dbraw/zinc/31/99/00/327319900.db2.gz	SSXAYWQJZRUAEO-CQSZACIVSA-N	1	0	290.432	4.138	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H]1[C@@H]2Cc3ccccc3[C@H]12)c1ccco1	ZINC000560545941	327322616	/nfs/dbraw/zinc/32/26/16/327322616.db2.gz	OKVYRGPYRXZWIQ-DMUMMCEESA-N	1	0	293.410	4.462	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@H](C)C(F)(F)F)c1ccco1	ZINC000560548676	327323327	/nfs/dbraw/zinc/32/33/27/327323327.db2.gz	RIEODENULZJARC-QWRGUYRKSA-N	1	0	261.287	4.075	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+]Cc1c(F)cccc1N1CCCC1	ZINC000560569666	327325528	/nfs/dbraw/zinc/32/55/28/327325528.db2.gz	IDPCAHNDFABYMI-GJZGRUSLSA-N	1	0	290.426	4.116	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+][C@H](C)c1ccc2n[nH]cc2c1	ZINC000560580946	327327554	/nfs/dbraw/zinc/32/75/54/327327554.db2.gz	ALJFRCIBEQKKHH-CZUORRHYSA-N	1	0	271.408	4.348	20	30		CIEDRO
CC(C)Oc1cccc(C[N@H+](C)CCCC(C)(C)C#N)c1	ZINC000120662259	327345245	/nfs/dbraw/zinc/34/52/45/327345245.db2.gz	AIERMHJHKCIGBU-UHFFFAOYSA-N	1	0	288.435	4.236	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)c1cc(C)ccc1OC(F)F	ZINC000560897135	327350597	/nfs/dbraw/zinc/35/05/97/327350597.db2.gz	AGDUNEGSBUJQIQ-RYUDHWBXSA-N	1	0	269.335	4.212	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@H](C)c1cn(-c2ccccc2)nn1	ZINC000561017127	327358951	/nfs/dbraw/zinc/35/89/51/327358951.db2.gz	LZFRFALXSAAHQJ-JKSUJKDBSA-N	1	0	298.434	4.053	20	30		CIEDRO
C=CCCC[NH2+][C@H](CC)c1ccc(OC(F)F)cc1	ZINC000561199122	327374664	/nfs/dbraw/zinc/37/46/64/327374664.db2.gz	HOHGPHNIPWQPGE-CQSZACIVSA-N	1	0	269.335	4.295	20	30		CIEDRO
C=CC[C@@H](C)[C@@H](C)[NH2+]Cc1cc(-c2ccccc2)on1	ZINC000154773649	327386300	/nfs/dbraw/zinc/38/63/00/327386300.db2.gz	JOHXTYDCTXQWIK-ZIAGYGMSSA-N	1	0	270.376	4.032	20	30		CIEDRO
Cc1cc(C)cc([C@H](C)[NH2+]CC(C)(C)CCC#N)c1	ZINC000561347464	327387966	/nfs/dbraw/zinc/38/79/66/327387966.db2.gz	HUBMJHVKIWIZFJ-HNNXBMFYSA-N	1	0	258.409	4.284	20	30		CIEDRO
C=CCC[C@H](C)[NH2+]Cc1nc(-c2ccccc2F)cs1	ZINC000561412136	327393326	/nfs/dbraw/zinc/39/33/26/327393326.db2.gz	YSBMSHQTRFVJCF-LBPRGKRZSA-N	1	0	290.407	4.394	20	30		CIEDRO
C=CCC[NH2+][C@H](C)C(c1ccccc1)c1ccccc1	ZINC000168673781	327477828	/nfs/dbraw/zinc/47/78/28/327477828.db2.gz	LRGAIESMSUVBHF-MRXNPFEDSA-N	1	0	265.400	4.373	20	30		CIEDRO
CC[C@H]([NH2+][C@@H](C)c1ccc(C#N)cc1F)C(C)(C)C	ZINC000512622856	332976411	/nfs/dbraw/zinc/97/64/11/332976411.db2.gz	CHJQWGGKBXYVOW-NHYWBVRUSA-N	1	0	262.372	4.173	20	30		CIEDRO
C[C@H](c1ccc(C#N)cc1)[NH+]1CCC2(CCCC2)CC1	ZINC000569821238	327550080	/nfs/dbraw/zinc/55/00/80/327550080.db2.gz	DITLDKLJSNWITD-OAHLLOKOSA-N	1	0	268.404	4.275	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]Cc1cccc(OC)c1OC(C)C	ZINC000569861922	327552986	/nfs/dbraw/zinc/55/29/86/327552986.db2.gz	UQBQVEQNHWJUSN-UHFFFAOYSA-N	1	0	291.435	4.174	20	30		CIEDRO
CC(C)(C)[C@@H]1CCCC[C@@H]1[NH2+]CCC(C)(C)C#N	ZINC000535664205	328607075	/nfs/dbraw/zinc/60/70/75/328607075.db2.gz	ZPTFRKGNCPCSBV-KGLIPLIRSA-N	1	0	250.430	4.121	20	30		CIEDRO
N#CC1(c2ccccc2)CCC([NH2+]C[C@@H]2CC=CCC2)CC1	ZINC000507581973	332815350	/nfs/dbraw/zinc/81/53/50/332815350.db2.gz	VIDYFBQYOHOUNJ-QHGAOEGBSA-N	1	0	294.442	4.336	20	30		CIEDRO
C=CC[NH+](CC=C)Cc1cc(Cl)cc2cccnc21	ZINC000054316841	328691884	/nfs/dbraw/zinc/69/18/84/328691884.db2.gz	NDQUPYNSVAUCIS-UHFFFAOYSA-N	1	0	272.779	4.062	20	30		CIEDRO
CC[C@@H](Cc1ccccc1)[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000116384144	328694092	/nfs/dbraw/zinc/69/40/92/328694092.db2.gz	BOPYYTVOROEEEU-BEFAXECRSA-N	1	0	278.399	4.230	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+]C[C@@H]1SCCc2ccccc21	ZINC000532248774	328711335	/nfs/dbraw/zinc/71/13/35/328711335.db2.gz	KNDHYBVSNCSSNZ-ZQIUZPCESA-N	1	0	275.461	4.207	20	30		CIEDRO
C[C@H]([NH2+]C[C@H]1CCCC[C@H]1C)c1ccc(C#N)cc1	ZINC000042857127	328771264	/nfs/dbraw/zinc/77/12/64/328771264.db2.gz	LCURCGRDCQUBKW-JKIFEVAISA-N	1	0	256.393	4.035	20	30		CIEDRO
N#CCCCC[NH2+][C@@H]1CCCC[C@@H]1C1CCCCC1	ZINC000532485609	328783601	/nfs/dbraw/zinc/78/36/01/328783601.db2.gz	DEHQROWLVZRROP-IAGOWNOFSA-N	1	0	262.441	4.409	20	30		CIEDRO
C=CC[C@@H](C)[C@@H](C)[NH2+]Cc1ccc(-c2ccncc2)cc1	ZINC000532516894	328785740	/nfs/dbraw/zinc/78/57/40/328785740.db2.gz	JZMHJWMPQNRDKV-HZPDHXFCSA-N	1	0	280.415	4.439	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@@H](c1ncccc1C)C(C)C	ZINC000563948623	328840705	/nfs/dbraw/zinc/84/07/05/328840705.db2.gz	YBIACGUJYWNEJS-HZPDHXFCSA-N	1	0	260.425	4.422	20	30		CIEDRO
CCCOc1ccc([C@@H](C)[NH2+]CC(C)(C)CCC#N)cc1	ZINC000583685187	328901588	/nfs/dbraw/zinc/90/15/88/328901588.db2.gz	HEBMTRPPVUSGBX-OAHLLOKOSA-N	1	0	288.435	4.456	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@H](c1nccn1C)c1ccccc1	ZINC000582281780	328948696	/nfs/dbraw/zinc/94/86/96/328948696.db2.gz	KFNLSPKZPSEGGN-WMZOPIPTSA-N	1	0	297.446	4.234	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@@H](c1nccn1C)c1ccccc1	ZINC000582281778	328948711	/nfs/dbraw/zinc/94/87/11/328948711.db2.gz	KFNLSPKZPSEGGN-FUHWJXTLSA-N	1	0	297.446	4.234	20	30		CIEDRO
CCCC1(C[NH2+][C@@H](C)c2cccc(C#N)c2)CCC1	ZINC000391769250	328980612	/nfs/dbraw/zinc/98/06/12/328980612.db2.gz	CELFLKGQBIWHGD-AWEZNQCLSA-N	1	0	256.393	4.179	20	30		CIEDRO
C[C@H]([NH2+]CCCC#N)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000376270969	329006770	/nfs/dbraw/zinc/00/67/70/329006770.db2.gz	SSNVAWRFESKUFA-HNNXBMFYSA-N	1	0	289.382	4.180	20	30		CIEDRO
C[C@@H]([NH2+]CCCC#N)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000376270970	329006777	/nfs/dbraw/zinc/00/67/77/329006777.db2.gz	SSNVAWRFESKUFA-OAHLLOKOSA-N	1	0	289.382	4.180	20	30		CIEDRO
C=C(C)C[N@@H+]1CCC[C@@H]1c1nc(-c2ccccc2)c(C)[nH]1	ZINC000377282502	329009663	/nfs/dbraw/zinc/00/96/63/329009663.db2.gz	GJHGHFKAMUICFD-MRXNPFEDSA-N	1	0	281.403	4.098	20	30		CIEDRO
Cc1ccc([C@H]2CSCC[N@@H+]2CCCC(C)(C)C#N)o1	ZINC000377939612	329035287	/nfs/dbraw/zinc/03/52/87/329035287.db2.gz	JWCRFZKADMKZIZ-CQSZACIVSA-N	1	0	292.448	4.008	20	30		CIEDRO
C[C@@H](c1cccc(-c2ccncc2)c1)[N@H+](C)CCCC#N	ZINC000378438349	329050076	/nfs/dbraw/zinc/05/00/76/329050076.db2.gz	ZDZZVCJVBWINMB-HNNXBMFYSA-N	1	0	279.387	4.045	20	30		CIEDRO
N#CCCCC[N@H+]1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000378492308	329052631	/nfs/dbraw/zinc/05/26/31/329052631.db2.gz	IQFLQNFGNYFMPC-OAHLLOKOSA-N	1	0	274.383	4.089	20	30		CIEDRO
N#CCCCC[N@H+]1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000378640112	329057591	/nfs/dbraw/zinc/05/75/91/329057591.db2.gz	AGXBPOISPBJGGM-AWEZNQCLSA-N	1	0	296.336	4.189	20	30		CIEDRO
Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(OCC#N)cc2)cc1	ZINC000193899006	329062596	/nfs/dbraw/zinc/06/25/96/329062596.db2.gz	AOKWIGGTYCKRAA-HOTGVXAUSA-N	1	0	294.398	4.309	20	30		CIEDRO
Cc1ccc([C@@H](C)[NH2+]Cc2ccc(OCC#N)cc2)c(C)c1	ZINC000193900521	329062612	/nfs/dbraw/zinc/06/26/12/329062612.db2.gz	QBMYQDSTDHWLAE-MRXNPFEDSA-N	1	0	294.398	4.057	20	30		CIEDRO
C[C@@H]([NH2+]C[C@@H]1CCc2ccccc21)c1ccc(C#N)c(F)c1	ZINC000538507884	329150075	/nfs/dbraw/zinc/15/00/75/329150075.db2.gz	JTJHSOPKKLCDLO-DYVFJYSZSA-N	1	0	294.373	4.078	20	30		CIEDRO
CC(C)(C#N)CCC[N@H+]1CC=C(c2cccs2)CC1	ZINC000174867797	329164287	/nfs/dbraw/zinc/16/42/87/329164287.db2.gz	MHBIZWSWEYTFDR-UHFFFAOYSA-N	1	0	274.433	4.167	20	30		CIEDRO
C[C@H]1CC[C@H]([NH2+]Cc2ccc(C#N)cc2F)c2ccccc21	ZINC000177859832	329193483	/nfs/dbraw/zinc/19/34/83/329193483.db2.gz	SIHZABUPRBMXIW-DJJJIMSYSA-N	1	0	294.373	4.426	20	30		CIEDRO
N#CCCCC[NH2+][C@@H]1CCc2c1ccc(Cl)c2Cl	ZINC000178649977	329201616	/nfs/dbraw/zinc/20/16/16/329201616.db2.gz	GZJQXKPZNJCCTP-CYBMUJFWSA-N	1	0	283.202	4.264	20	30		CIEDRO
CC[N@H+](Cc1ccsc1)[C@H](C)c1ccc(C#N)cc1	ZINC000179464473	329208797	/nfs/dbraw/zinc/20/87/97/329208797.db2.gz	CLSSESBDCIYSNY-CYBMUJFWSA-N	1	0	270.401	4.203	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1cccc(OC(F)(F)F)c1	ZINC000393745078	329221205	/nfs/dbraw/zinc/22/12/05/329221205.db2.gz	KUVHXDLZRVKNGC-GFCCVEGCSA-N	1	0	273.298	4.030	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CC[C@@H](c2c(F)cccc2F)C1	ZINC000185309938	329272659	/nfs/dbraw/zinc/27/26/59/329272659.db2.gz	GFXGFTNUNMXSEK-CYBMUJFWSA-N	1	0	292.373	4.084	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H](CC2CC2)c2ccccc2)cc1F	ZINC000582880505	329284649	/nfs/dbraw/zinc/28/46/49/329284649.db2.gz	JVRVXNGOWREAGX-IBGZPJMESA-N	1	0	294.373	4.328	20	30		CIEDRO
CC[C@@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1ccc(C)cc1	ZINC000185812847	329329552	/nfs/dbraw/zinc/32/95/52/329329552.db2.gz	DKQZHGRZHJAYRQ-BHYGNILZSA-N	1	0	256.393	4.118	20	30		CIEDRO
CC[C@@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1cc(F)ccc1F	ZINC000185840891	329330242	/nfs/dbraw/zinc/33/02/42/329330242.db2.gz	KZSAGCDSWOPMBR-DETPVDSQSA-N	1	0	278.346	4.088	20	30		CIEDRO
Cc1c(C[NH2+][C@@H]2CCC[C@@H](C#N)C2)oc2ccc(F)cc12	ZINC000185842474	329330248	/nfs/dbraw/zinc/33/02/48/329330248.db2.gz	VJYGCPZNWIVRNU-TZMCWYRMSA-N	1	0	286.350	4.052	20	30		CIEDRO
C=CCC[C@@H](CO)[NH2+][C@H](C)c1cc(Cl)sc1Cl	ZINC000321423701	329354675	/nfs/dbraw/zinc/35/46/75/329354675.db2.gz	KUCIYXRVTYMACY-BDAKNGLRSA-N	1	0	294.247	4.033	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](C)c1ccc(OC)c(F)c1	ZINC000398183539	329438619	/nfs/dbraw/zinc/43/86/19/329438619.db2.gz	PAOXADYEAZODIG-QWHCGFSZSA-N	1	0	265.372	4.230	20	30		CIEDRO
CC(C)c1ccc(C[NH2+]Cc2ccc(CC#N)cc2)cc1	ZINC000399167872	329448825	/nfs/dbraw/zinc/44/88/25/329448825.db2.gz	HLSIXGXMDIKPKG-UHFFFAOYSA-N	1	0	278.399	4.166	20	30		CIEDRO
C=C(C)CC[NH+]1CCC(c2c[nH]c3ccc(OC)cc32)CC1	ZINC000509280976	332863634	/nfs/dbraw/zinc/86/36/34/332863634.db2.gz	ZNBFDGNHSNMLAF-UHFFFAOYSA-N	1	0	298.430	4.322	20	30		CIEDRO
N#CCCCC[NH2+][C@H]1CCC[C@@H]1c1ccccc1Cl	ZINC000359971884	329644287	/nfs/dbraw/zinc/64/42/87/329644287.db2.gz	DINCDMGUQYHJHQ-ZBFHGGJFSA-N	1	0	276.811	4.260	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ncoc1-c1ccccc1)C1CC1	ZINC000359979992	329644616	/nfs/dbraw/zinc/64/46/16/329644616.db2.gz	WFNFUOWEUWJSLD-INIZCTEOSA-N	1	0	282.387	4.176	20	30		CIEDRO
CC1CCC([NH2+]Cc2cccc(OCCCC#N)c2)CC1	ZINC000236690073	329689650	/nfs/dbraw/zinc/68/96/50/329689650.db2.gz	FJTPINRVGLAACF-UHFFFAOYSA-N	1	0	286.419	4.037	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CCc3ccc(Cl)cc32)s1	ZINC000421203916	329805770	/nfs/dbraw/zinc/80/57/70/329805770.db2.gz	QRUDYBMVZWCDAU-OAHLLOKOSA-N	1	0	288.803	4.050	20	30		CIEDRO
CC[C@@H](C)C[NH2+]C1CCC(C#N)(c2ccccc2)CC1	ZINC000421377400	329817095	/nfs/dbraw/zinc/81/70/95/329817095.db2.gz	JPSOZXPUBUWMCF-FAEJEUNOSA-N	1	0	270.420	4.026	20	30		CIEDRO
Cc1ccccc1[C@H]1C[C@H]([NH2+]Cc2ccc(C#N)c(F)c2)C1	ZINC000421383974	329818484	/nfs/dbraw/zinc/81/84/84/329818484.db2.gz	KDLDASHTOAJORQ-QAQDUYKDSA-N	1	0	294.373	4.042	20	30		CIEDRO
Cc1ccc2c(c1)[C@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)CCC2	ZINC000249035558	329903874	/nfs/dbraw/zinc/90/38/74/329903874.db2.gz	SLQPIERHLMZDDU-UWWQBHOKSA-N	1	0	268.404	4.044	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@H](C)c1sc(C)nc1C)c1ccccc1	ZINC000271496129	330079882	/nfs/dbraw/zinc/07/98/82/330079882.db2.gz	LMHABJWNPIOMSP-CZUORRHYSA-N	1	0	284.428	4.175	20	30		CIEDRO
C[C@H]([NH2+][C@@H](C)c1ccncc1Cl)c1ccc(C#N)cc1	ZINC000421824995	330083530	/nfs/dbraw/zinc/08/35/30/330083530.db2.gz	LGVKKGRBSGLMJE-RYUDHWBXSA-N	1	0	285.778	4.018	20	30		CIEDRO
C[C@H](Cc1ccc(F)cc1Cl)[NH2+]CC(C)(C)CCC#N	ZINC000421858214	330089843	/nfs/dbraw/zinc/08/98/43/330089843.db2.gz	QYOHUKGESHIZGO-GFCCVEGCSA-N	1	0	296.817	4.330	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@H]1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000273468825	330093028	/nfs/dbraw/zinc/09/30/28/330093028.db2.gz	RPZFEIGYXBAGQC-DFEHZGFQSA-N	1	0	291.410	4.236	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@H](C)c1ccc(C)cc1O)c1ccccc1	ZINC000273545322	330096877	/nfs/dbraw/zinc/09/68/77/330096877.db2.gz	ZDZKJGGXZOTPKS-CRAIPNDOSA-N	1	0	279.383	4.116	20	30		CIEDRO
CC1(C)Cc2occc2[C@@H]([NH2+]Cc2ccc(C#N)s2)C1	ZINC000421880480	330102242	/nfs/dbraw/zinc/10/22/42/330102242.db2.gz	OKQVAJZDSGGXPB-AWEZNQCLSA-N	1	0	286.400	4.016	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](CC)c1nc(C(F)(F)F)cs1	ZINC000274856943	330108067	/nfs/dbraw/zinc/10/80/67/330108067.db2.gz	SMRMYHFZLYSAPT-SECBINFHSA-N	1	0	278.343	4.169	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccc(OC)cc1)c1ccco1	ZINC000276446315	330113521	/nfs/dbraw/zinc/11/35/21/330113521.db2.gz	LGDBJNQQGSFOOB-MRXNPFEDSA-N	1	0	271.360	4.085	20	30		CIEDRO
C[N@H+](Cc1ccc(Cl)s1)CC(C)(C)CCC#N	ZINC000162783351	330117069	/nfs/dbraw/zinc/11/70/69/330117069.db2.gz	AMQATZYKYOVXJF-UHFFFAOYSA-N	1	0	270.829	4.163	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H](C)c1c(C)noc1C)c1ccco1	ZINC000279138503	330121874	/nfs/dbraw/zinc/12/18/74/330121874.db2.gz	YXOQVZQSBPWBTR-DOMZBBRYSA-N	1	0	288.391	4.285	20	30		CIEDRO
C#CC[C@H]([NH2+][C@H]1CCCc2occc21)c1ccccc1	ZINC000278762821	330122619	/nfs/dbraw/zinc/12/26/19/330122619.db2.gz	OTUWMMKNMVNFHV-IRXDYDNUSA-N	1	0	265.356	4.011	20	30		CIEDRO
C=CCC[N@@H+](CCC(F)(F)F)Cc1ccccc1	ZINC000191243461	330133980	/nfs/dbraw/zinc/13/39/80/330133980.db2.gz	YMMQXJBEBMJWSA-UHFFFAOYSA-N	1	0	257.299	4.017	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@@H]1CCO[C@@H](C(C)(C)C)C1	ZINC000536829929	330228718	/nfs/dbraw/zinc/22/87/18/330228718.db2.gz	AZGWWWUEZVRECQ-ARFHVFGLSA-N	1	0	267.457	4.305	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)c1oc2ccc(OC)cc2c1C	ZINC000536857369	330252253	/nfs/dbraw/zinc/25/22/53/330252253.db2.gz	KNKREGJSYXKTST-AAEUAGOBSA-N	1	0	273.376	4.365	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc(Cl)c(Cl)c1	ZINC000424122291	330254218	/nfs/dbraw/zinc/25/42/18/330254218.db2.gz	JBJAZXLXNMSAPO-JFGNBEQYSA-N	1	0	283.202	4.336	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc(Cl)cc1Cl	ZINC000424128491	330259762	/nfs/dbraw/zinc/25/97/62/330259762.db2.gz	RGSRQZPINOHQSR-JBLDHEPKSA-N	1	0	283.202	4.336	20	30		CIEDRO
C=CC(C)(C)CC[NH2+][C@@H]1CCC[C@H](c2cccnc2)C1	ZINC000527736628	330278813	/nfs/dbraw/zinc/27/88/13/330278813.db2.gz	NWJRRIIHTIYUQZ-DOTOQJQBSA-N	1	0	272.436	4.300	20	30		CIEDRO
CC1(C#N)CCC([NH2+]CC(C2CCC2)C2CCC2)CC1	ZINC000527738321	330282444	/nfs/dbraw/zinc/28/24/44/330282444.db2.gz	YEVABXHLOJLUHS-UHFFFAOYSA-N	1	0	274.452	4.265	20	30		CIEDRO
Cc1cccc([C@H]([NH2+]Cc2cc(C#N)cs2)C(C)C)c1	ZINC000527814318	330284988	/nfs/dbraw/zinc/28/49/88/330284988.db2.gz	QPPHBRQXGBBGIQ-QGZVFWFLSA-N	1	0	284.428	4.415	20	30		CIEDRO
Cc1cccc([C@@H]([NH2+]Cc2ccccc2C#N)C(C)C)c1	ZINC000527814142	330285032	/nfs/dbraw/zinc/28/50/32/330285032.db2.gz	PFQYVOHSGZIACT-IBGZPJMESA-N	1	0	278.399	4.354	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CC[C@@H](C#N)C1)c1cc(C)ccc1C	ZINC000527890482	330292238	/nfs/dbraw/zinc/29/22/38/330292238.db2.gz	ILHXGZQMCMZCCV-VYDXJSESSA-N	1	0	256.393	4.036	20	30		CIEDRO
CC[C@H](CCc1ccccc1)[NH2+][C@H]1CCC[C@@H](C#N)C1	ZINC000527959481	330300447	/nfs/dbraw/zinc/30/04/47/330300447.db2.gz	YYQVMFIJJNDGQM-KURKYZTESA-N	1	0	270.420	4.070	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@@H]1C[C@H](C(C)C)c2ccccc21	ZINC000424297372	330336377	/nfs/dbraw/zinc/33/63/77/330336377.db2.gz	QPUDDJXBZHTRBS-PIKADFDJSA-N	1	0	285.431	4.052	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@H](C)c1oc2ccccc2c1CC	ZINC000424297454	330336389	/nfs/dbraw/zinc/33/63/89/330336389.db2.gz	QRWWEKWAOQZHQZ-KEYYUXOJSA-N	1	0	299.414	4.237	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]C2(C)CCCCC2)cc1	ZINC000045042565	330337352	/nfs/dbraw/zinc/33/73/52/330337352.db2.gz	MULSQHFMACLIAQ-UHFFFAOYSA-N	1	0	259.393	4.064	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@H]1C[C@@H]2C[C@H](OC)C[C@@H]2C1)c1ccccc1	ZINC000424303994	330338174	/nfs/dbraw/zinc/33/81/74/330338174.db2.gz	QEHCTDFZOIBHHX-UTBUEMAESA-N	1	0	299.458	4.487	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1	ZINC000424316762	330339545	/nfs/dbraw/zinc/33/95/45/330339545.db2.gz	BINRHJOXXXLDEX-RXGFPQBGSA-N	1	0	294.851	4.175	20	30		CIEDRO
Cc1ccc([C@@H]([NH2+][C@@H]2CC[C@H](C#N)C2)c2ccccc2)cc1	ZINC000424318281	330339879	/nfs/dbraw/zinc/33/98/79/330339879.db2.gz	CXMWROLGFDNVMR-DBVUQKKJSA-N	1	0	290.410	4.366	20	30		CIEDRO
CCCC[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccccc1	ZINC000424327623	330341598	/nfs/dbraw/zinc/34/15/98/330341598.db2.gz	NBSIQLSETPVGHH-USXIJHARSA-N	1	0	256.393	4.200	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)C1	ZINC000424328277	330341626	/nfs/dbraw/zinc/34/16/26/330341626.db2.gz	NUDWGHQCYNSKAT-DOPJRALCSA-N	1	0	284.378	4.043	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1cc(Cl)sc1Cl	ZINC000424327630	330341707	/nfs/dbraw/zinc/34/17/07/330341707.db2.gz	NDAHZCHZCJUGIO-HRDYMLBCSA-N	1	0	289.231	4.398	20	30		CIEDRO
CC(C)[C@@H](CSc1ccccc1)[NH2+][C@@H]1CC[C@H](C#N)C1	ZINC000424332268	330342700	/nfs/dbraw/zinc/34/27/00/330342700.db2.gz	SRLYNGWXGPXZSD-ZMSDIMECSA-N	1	0	288.460	4.085	20	30		CIEDRO
C[C@@H](CC(C)(C)c1ccccc1)[NH2+][C@@H]1CC[C@H](C#N)C1	ZINC000424335964	330343363	/nfs/dbraw/zinc/34/33/63/330343363.db2.gz	XEVOVJAXODBGFW-YQQAZPJKSA-N	1	0	270.420	4.025	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@@H](Cc1ccncc1)c1cccs1	ZINC000424344341	330344547	/nfs/dbraw/zinc/34/45/47/330344547.db2.gz	GRXTUGVTUZVARG-HNNXBMFYSA-N	1	0	286.444	4.229	20	30		CIEDRO
Cc1[nH]c2ccccc2c1C1=CC[N@H+](CCCCC#N)CC1	ZINC000083202158	330356674	/nfs/dbraw/zinc/35/66/74/330356674.db2.gz	ALCXNVQMWGFZPW-UHFFFAOYSA-N	1	0	293.414	4.259	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccccc1COC(C)C)C1CC1	ZINC000533361922	330359715	/nfs/dbraw/zinc/35/97/15/330359715.db2.gz	VWCZAXZEWNEHPF-IBGZPJMESA-N	1	0	287.447	4.446	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccc2ccccc2n1)C1CC1	ZINC000533362176	330359868	/nfs/dbraw/zinc/35/98/68/330359868.db2.gz	JIWYCUQTXMJMPI-KRWDZBQOSA-N	1	0	266.388	4.069	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCc1cccc2cccnc21)C1CC1	ZINC000533362351	330359882	/nfs/dbraw/zinc/35/98/82/330359882.db2.gz	SYJHRVUAKQHKCB-GOSISDBHSA-N	1	0	280.415	4.112	20	30		CIEDRO
C=CC[C@@H](C)[NH2+]Cc1csc(-c2ccc(F)cc2)n1	ZINC000116926697	330361560	/nfs/dbraw/zinc/36/15/60/330361560.db2.gz	DRHRFEHXVZWMRK-LLVKDONJSA-N	1	0	276.380	4.003	20	30		CIEDRO
C=CCCC[N@@H+]1CCC[C@H]1c1nc2ccccc2s1	ZINC000117870777	330366229	/nfs/dbraw/zinc/36/62/29/330366229.db2.gz	OODDNQGCSJMNKR-AWEZNQCLSA-N	1	0	272.417	4.399	20	30		CIEDRO
C=CC[N@@H+](C)[C@H](C)c1sc(-c2ccccc2)nc1C	ZINC000119414918	330374589	/nfs/dbraw/zinc/37/45/89/330374589.db2.gz	NFBIEQFFSUZWIX-CYBMUJFWSA-N	1	0	272.417	4.297	20	30		CIEDRO
C[C@@H]([NH2+]CC1(CC#N)CC1)c1ccc(Cl)cc1Cl	ZINC000088249511	330375135	/nfs/dbraw/zinc/37/51/35/330375135.db2.gz	MRHTXCBIHKQHHE-SNVBAGLBSA-N	1	0	283.202	4.338	20	30		CIEDRO
COc1ccc([C@@H](C)[NH2+]CC#Cc2ccccc2Cl)cc1	ZINC000537029652	330388479	/nfs/dbraw/zinc/38/84/79/330388479.db2.gz	GSRVOYMAYZMMMF-CQSZACIVSA-N	1	0	299.801	4.051	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1cc(-c2ccccc2)on1)C1CC1	ZINC000120826739	330392633	/nfs/dbraw/zinc/39/26/33/330392633.db2.gz	XINBWHKCBHLAQA-KRWDZBQOSA-N	1	0	282.387	4.176	20	30		CIEDRO
C=CCCC[C@@H](C)[N@@H+]1CC[C@H](COCc2ccccc2)C1	ZINC000537047466	330394384	/nfs/dbraw/zinc/39/43/84/330394384.db2.gz	NPNLCIZGDIYDFN-MJGOQNOKSA-N	1	0	287.447	4.270	20	30		CIEDRO
N#CCC[C@@H]([NH2+]C1CCCCCC1)c1ccccc1	ZINC000090665533	330394545	/nfs/dbraw/zinc/39/45/45/330394545.db2.gz	BVWQMGHUYTYOJP-QGZVFWFLSA-N	1	0	256.393	4.344	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+][C@H](CCC#N)c1ccccc1	ZINC000090665460	330394617	/nfs/dbraw/zinc/39/46/17/330394617.db2.gz	VJVFXKJWZFUVCH-IAGOWNOFSA-N	1	0	256.393	4.366	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+][C@@H](CCC#N)c1ccccc1	ZINC000090665793	330394661	/nfs/dbraw/zinc/39/46/61/330394661.db2.gz	IDDTUCRPHOQNQN-UXLLHSPISA-N	1	0	256.393	4.222	20	30		CIEDRO
C=CC[C@@H](C)[C@@H](C)[NH2+][C@@H](CCC#N)c1ccccc1	ZINC000090665794	330394671	/nfs/dbraw/zinc/39/46/71/330394671.db2.gz	IDDTUCRPHOQNQN-INMHGKMJSA-N	1	0	256.393	4.222	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(F)cc1C#N)C(C)(C)c1ccccc1	ZINC000537054702	330395194	/nfs/dbraw/zinc/39/51/94/330395194.db2.gz	SBEWSSJVVOGSPA-CQSZACIVSA-N	1	0	296.389	4.153	20	30		CIEDRO
C[C@@H](C[NH2+][C@H](C)c1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000537288712	330431115	/nfs/dbraw/zinc/43/11/15/330431115.db2.gz	PXOSFNMYYNUUQJ-UONOGXRCSA-N	1	0	282.362	4.152	20	30		CIEDRO
Cc1ccccc1[C@H]([NH2+]Cc1cccc(C#N)c1F)C1CC1	ZINC000537291919	330431176	/nfs/dbraw/zinc/43/11/76/330431176.db2.gz	ZTIBTPPDHAMWNU-LJQANCHMSA-N	1	0	294.373	4.247	20	30		CIEDRO
Cc1cc(C)cc(CC[NH2+][C@@H](C)c2ccc(C#N)cc2)c1	ZINC000537292905	330431184	/nfs/dbraw/zinc/43/11/84/330431184.db2.gz	CZGSDKMQMQGIGF-INIZCTEOSA-N	1	0	278.399	4.068	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCc2ccc(F)cc21)c1ccc(C#N)c(F)c1	ZINC000537406259	330434719	/nfs/dbraw/zinc/43/47/19/330434719.db2.gz	CITPZEVJJIXCFH-ADLMAVQZSA-N	1	0	298.336	4.175	20	30		CIEDRO
COc1cccc([C@H](C)[NH2+][C@@H](C)c2ccc(C#N)c(F)c2)c1	ZINC000537406030	330434782	/nfs/dbraw/zinc/43/47/82/330434782.db2.gz	CCVDSKBGGMISKP-STQMWFEESA-N	1	0	298.361	4.118	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H]2CCC[C@H]2C1)c1ccc(C#N)c(F)c1	ZINC000537408515	330435023	/nfs/dbraw/zinc/43/50/23/330435023.db2.gz	ZJXQIDUXESSBOK-UICACZKSSA-N	1	0	286.394	4.317	20	30		CIEDRO
Cc1ccccc1[C@@H]([NH2+]CCC(C)(C)C#N)C(C)C	ZINC000537412806	330435104	/nfs/dbraw/zinc/43/51/04/330435104.db2.gz	YCPBRGOCNDRJOR-INIZCTEOSA-N	1	0	258.409	4.222	20	30		CIEDRO
C=C(C)[C@@H]([NH2+][C@H]1CCC[C@H]2C[C@H]21)c1ccc(F)c(F)c1	ZINC000514800134	330465533	/nfs/dbraw/zinc/46/55/33/330465533.db2.gz	FUEHXBQKAJWSCM-YCCRMZCTSA-N	1	0	277.358	4.360	20	30		CIEDRO
Cc1ccoc1C[NH2+][C@@H]1CCCCc2cc(C#N)ccc21	ZINC000426316573	330503906	/nfs/dbraw/zinc/50/39/06/330503906.db2.gz	HDUILHMDMJYKCY-QGZVFWFLSA-N	1	0	280.371	4.017	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@@H]2CCCc3sc(Cl)cc32)C1	ZINC000426329538	330504438	/nfs/dbraw/zinc/50/44/38/330504438.db2.gz	GXBYUBKBXHTJAD-NTZNESFSSA-N	1	0	294.851	4.451	20	30		CIEDRO
CC(C)(C)CC(C)(C)[NH2+]Cc1cccc(F)c1C#N	ZINC000428226708	330516739	/nfs/dbraw/zinc/51/67/39/330516739.db2.gz	VPADMZMCSUIHJH-UHFFFAOYSA-N	1	0	262.372	4.002	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCc1cc(F)ccc1F)c1ccco1	ZINC000428250255	330518010	/nfs/dbraw/zinc/51/80/10/330518010.db2.gz	PXLLFHYWHQYHRR-MRXNPFEDSA-N	1	0	291.341	4.397	20	30		CIEDRO
N#Cc1c(F)cccc1C[NH2+][C@H](c1ccccc1)C1CCC1	ZINC000428391089	330522143	/nfs/dbraw/zinc/52/21/43/330522143.db2.gz	PZESRJQNKLLQAB-LJQANCHMSA-N	1	0	294.373	4.328	20	30		CIEDRO
N#Cc1ccc2c(c1)CCC[C@@H]2[NH2+][C@@H]1CCC12CCCC2	ZINC000429434335	330546431	/nfs/dbraw/zinc/54/64/31/330546431.db2.gz	ZVPWDRWMPUKDLR-ZWKOTPCHSA-N	1	0	280.415	4.248	20	30		CIEDRO
CCc1ccc(-c2ccc(C[NH2+]CC3(CC#N)CC3)o2)cc1	ZINC000430066173	330558410	/nfs/dbraw/zinc/55/84/10/330558410.db2.gz	OSBOXIAXNQPTJI-UHFFFAOYSA-N	1	0	294.398	4.292	20	30		CIEDRO
C[C@@H]([NH2+]CC1(CC#N)CC1)[C@@H](C)c1ccc(Cl)cc1	ZINC000430738329	330571932	/nfs/dbraw/zinc/57/19/32/330571932.db2.gz	ASXDZAJIDDKICL-CHWSQXEVSA-N	1	0	276.811	4.115	20	30		CIEDRO
N#CCC1(C[NH2+][C@H]2CCCc3c(Cl)cccc32)CC1	ZINC000430738542	330572040	/nfs/dbraw/zinc/57/20/40/330572040.db2.gz	BBQOCOGCFOXVOA-HNNXBMFYSA-N	1	0	274.795	4.001	20	30		CIEDRO
Cc1cc2cc([C@H](C)[NH2+]CC3(CC#N)CC3)oc2cc1C	ZINC000430749837	330572813	/nfs/dbraw/zinc/57/28/13/330572813.db2.gz	LSHGHECXLPFMOP-AWEZNQCLSA-N	1	0	282.387	4.394	20	30		CIEDRO
N#CCC1(C[NH2+][C@H]2CCC[C@H]2c2ccc(Cl)cc2)CC1	ZINC000430753051	330573211	/nfs/dbraw/zinc/57/32/11/330573211.db2.gz	JBBLQUGIEUODKQ-HOTGVXAUSA-N	1	0	288.822	4.260	20	30		CIEDRO
COc1ccccc1[C@@H]([NH2+]CC1(CC#N)CC1)C1CCCC1	ZINC000430761254	330573579	/nfs/dbraw/zinc/57/35/79/330573579.db2.gz	LNAQMSYKSWXTLR-SFHVURJKSA-N	1	0	298.430	4.210	20	30		CIEDRO
C[C@H]([NH2+][C@H]1C[C@H](c2ccccc2F)C1)c1cccc(C#N)c1	ZINC000435668492	330659734	/nfs/dbraw/zinc/65/97/34/330659734.db2.gz	ZLHAJEMIACSEMN-JQFCIGGWSA-N	1	0	294.373	4.294	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@H]1CC[C@H](C)c2ccccc21	ZINC000436289541	330673704	/nfs/dbraw/zinc/67/37/04/330673704.db2.gz	XREHPSFOIIKGLD-QXGSTGNESA-N	1	0	285.431	4.196	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@H](C)[C@@H](C)C1CCCCC1	ZINC000436291322	330673768	/nfs/dbraw/zinc/67/37/68/330673768.db2.gz	PZBGXMCHQUAGIN-AHCXZYCDSA-N	1	0	279.468	4.162	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@@H](C)[C@H](C)C1CCCCC1	ZINC000436291328	330673821	/nfs/dbraw/zinc/67/38/21/330673821.db2.gz	PZBGXMCHQUAGIN-ONIAQPFYSA-N	1	0	279.468	4.162	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+][C@@H](C)c1cc(C)c(C)cc1C	ZINC000436292318	330673908	/nfs/dbraw/zinc/67/39/08/330673908.db2.gz	MYQZKDWHCOHQAQ-LNLFQRSKSA-N	1	0	287.447	4.244	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1C[C@H](c2ccccc2)C1)c1ccc(C#N)cc1F	ZINC000436308930	330675209	/nfs/dbraw/zinc/67/52/09/330675209.db2.gz	RDUQUECBWYDUPT-KBRIMQKVSA-N	1	0	294.373	4.294	20	30		CIEDRO
C[C@]1(c2ccccc2)CC[C@@H]([NH2+]Cc2cccc(C#N)c2)C1	ZINC000438073160	330714998	/nfs/dbraw/zinc/71/49/98/330714998.db2.gz	KGQRZJMEXVHYDD-UXHICEINSA-N	1	0	290.410	4.158	20	30		CIEDRO
C=CCC[C@H]([NH2+]CC(C)(C)c1cccs1)C1CC1	ZINC000438991711	330732063	/nfs/dbraw/zinc/73/20/63/330732063.db2.gz	AAZJHPVWNYQZRO-AWEZNQCLSA-N	1	0	263.450	4.360	20	30		CIEDRO
CSc1ccccc1[C@H](C)[NH2+]CC#Cc1ccc(F)cc1	ZINC000440634555	330753119	/nfs/dbraw/zinc/75/31/19/330753119.db2.gz	ITTJMKAVIPJQQT-AWEZNQCLSA-N	1	0	299.414	4.250	20	30		CIEDRO
CC1(C)CCC(C[NH2+]CC2CCC(C#N)CC2)CC1	ZINC000441327472	330765589	/nfs/dbraw/zinc/76/55/89/330765589.db2.gz	HGUIEUWNRQEJFZ-UHFFFAOYSA-N	1	0	262.441	4.122	20	30		CIEDRO
Cc1cc(C)c(C[NH2+]CC2CCC(C#N)CC2)cc1C	ZINC000441349294	330766578	/nfs/dbraw/zinc/76/65/78/330766578.db2.gz	PCSBCXDMBHPZOG-UHFFFAOYSA-N	1	0	270.420	4.031	20	30		CIEDRO
N#CC1CCC(C[NH2+]Cc2cc3ccccc3s2)CC1	ZINC000441371573	330767179	/nfs/dbraw/zinc/76/71/79/330767179.db2.gz	MCOXPKVZCADTLM-UHFFFAOYSA-N	1	0	284.428	4.321	20	30		CIEDRO
C[C@H]([NH2+]CC1CCC(C#N)CC1)c1ccc(Cl)s1	ZINC000442141759	330774433	/nfs/dbraw/zinc/77/44/33/330774433.db2.gz	UYRGZVIQJPWDDL-UNXYVOJBSA-N	1	0	282.840	4.382	20	30		CIEDRO
N#C[C@H]1CC[C@H]([NH2+]Cc2ccccc2Oc2ccccc2)C1	ZINC000442763692	330781395	/nfs/dbraw/zinc/78/13/95/330781395.db2.gz	BIJBNFHLDIEISZ-RDJZCZTQSA-N	1	0	292.382	4.261	20	30		CIEDRO
C[C@H](C[NH2+][C@H]1CC[C@H](C#N)C1)c1c(Cl)cccc1Cl	ZINC000442783104	330782816	/nfs/dbraw/zinc/78/28/16/330782816.db2.gz	SFXFPUVTOVWTCO-WOPDTQHZSA-N	1	0	297.229	4.379	20	30		CIEDRO
CC(C)c1ccc2c(c1)[C@@H]([NH2+][C@@H]1CC[C@@H](C#N)C1)CCC2	ZINC000442852958	330787143	/nfs/dbraw/zinc/78/71/43/330787143.db2.gz	YUOLZJVGJWCVCN-BJZITVGISA-N	1	0	282.431	4.469	20	30		CIEDRO
CC1(C)C[C@H]([NH2+]CC2CCC(C#N)CC2)c2ccccc21	ZINC000442857502	330787609	/nfs/dbraw/zinc/78/76/09/330787609.db2.gz	PSICDBPRLOTLDW-JMLCCBQJSA-N	1	0	282.431	4.329	20	30		CIEDRO
CC(C)[C@H]([NH2+]CC1CCC(C#N)CC1)c1ccccc1	ZINC000442871728	330789166	/nfs/dbraw/zinc/78/91/66/330789166.db2.gz	XKXMVRSUHKWHJB-HTWSVDAQSA-N	1	0	270.420	4.303	20	30		CIEDRO
CCC[C@@H]([NH2+]CC1CCC(C#N)CC1)c1ccccc1	ZINC000442873217	330789337	/nfs/dbraw/zinc/78/93/37/330789337.db2.gz	QYFBQNMMVFMKHQ-LEOMRAHMSA-N	1	0	270.420	4.447	20	30		CIEDRO
CC(C)[NH+](CCS[C@@H](C)c1cccc(C#N)c1)C(C)C	ZINC000442916289	330791502	/nfs/dbraw/zinc/79/15/02/330791502.db2.gz	AUCXLZUQGGKNAV-HNNXBMFYSA-N	1	0	290.476	4.471	20	30		CIEDRO
C[C@@H]1CCCc2ccccc2[C@@H]1[NH2+][C@@H]1CCC[C@@H](C#N)C1	ZINC000446752254	330853552	/nfs/dbraw/zinc/85/35/52/330853552.db2.gz	GOLSELPZKAKEGN-FXRXJOCMSA-N	1	0	282.431	4.372	20	30		CIEDRO
C[C@H](CC[NH2+][C@@H]1CCC[C@H](C#N)C1)CC(C)(C)C	ZINC000446800783	330854529	/nfs/dbraw/zinc/85/45/29/330854529.db2.gz	FHQQSEYHBGOTNS-QLFBSQMISA-N	1	0	250.430	4.121	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)C1	ZINC000446823154	330855184	/nfs/dbraw/zinc/85/51/84/330855184.db2.gz	JHGNUOUVNJRWCS-MDASCCDHSA-N	1	0	298.405	4.434	20	30		CIEDRO
Cc1[nH]c2c(cc(C)cc2C[NH2+][C@@H]2CCC[C@H](C#N)C2)c1C	ZINC000447539654	330868959	/nfs/dbraw/zinc/86/89/59/330868959.db2.gz	HMVSDFFTWXMLMO-DOTOQJQBSA-N	1	0	295.430	4.265	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CCC(C)(C)C1)c1ccc(C#N)cc1	ZINC000447588986	330872052	/nfs/dbraw/zinc/87/20/52/330872052.db2.gz	WQGWAMHSSRAJOT-HOTGVXAUSA-N	1	0	256.393	4.178	20	30		CIEDRO
CC[C@H]([NH2+]C1(Cc2ccccc2)CC1)c1ccc(C#N)cc1	ZINC000447600478	330873211	/nfs/dbraw/zinc/87/32/11/330873211.db2.gz	MGJICRPDHCBCKG-IBGZPJMESA-N	1	0	290.410	4.374	20	30		CIEDRO
CC[C@H](CC(F)(F)F)[NH2+][C@@H](CC)c1ccc(C#N)cc1	ZINC000447607203	330873484	/nfs/dbraw/zinc/87/34/84/330873484.db2.gz	QONJPZBBXCKPJY-KGLIPLIRSA-N	1	0	284.325	4.330	20	30		CIEDRO
CC(C)CCC[C@H](C)[NH2+]C1CCC(C)(C#N)CC1	ZINC000449059128	330896064	/nfs/dbraw/zinc/89/60/64/330896064.db2.gz	ALOJGOUBDYDSPL-FHERZECASA-N	1	0	250.430	4.263	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@@H]2CC[C@H]3CCCC[C@@H]3C2)CC1	ZINC000449067944	330896797	/nfs/dbraw/zinc/89/67/97/330896797.db2.gz	PGPBZJXGJXEMJE-TWGIBVSRSA-N	1	0	274.452	4.407	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@H](c2ccccc2)C2CC2)CC1	ZINC000449068735	330896953	/nfs/dbraw/zinc/89/69/53/330896953.db2.gz	URYWYTPSPPRTKK-LXPRWKDFSA-N	1	0	268.404	4.200	20	30		CIEDRO
CC1(C#N)CCC([NH2+]CCCCCc2ccccc2)CC1	ZINC000449117976	330899971	/nfs/dbraw/zinc/89/99/71/330899971.db2.gz	QUWDGEJGNQPWCU-UHFFFAOYSA-N	1	0	284.447	4.461	20	30		CIEDRO
CC1(C#N)CCC([NH2+]CCCCC2CCCC2)CC1	ZINC000449166507	330903011	/nfs/dbraw/zinc/90/30/11/330903011.db2.gz	DHDLQGYBJBRKIL-UHFFFAOYSA-N	1	0	262.441	4.409	20	30		CIEDRO
C[C@@H](C[NH2+]C1CCC(C)(C#N)CC1)c1ccc(F)cc1F	ZINC000449169759	330903189	/nfs/dbraw/zinc/90/31/89/330903189.db2.gz	DRVQTNVYEOKNSO-MKQDKFQKSA-N	1	0	292.373	4.130	20	30		CIEDRO
CSc1ccc(F)cc1C[NH2+]C1CCC(C)(C#N)CC1	ZINC000449179604	330904015	/nfs/dbraw/zinc/90/40/15/330904015.db2.gz	WSNRFAGZDMIQDY-UHFFFAOYSA-N	1	0	292.423	4.110	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+]Cc1csc([C@H](C)OC)n1	ZINC000449179045	330904041	/nfs/dbraw/zinc/90/40/41/330904041.db2.gz	UZUGIJDEZFYHGR-OLZOCXBDSA-N	1	0	282.453	4.075	20	30		CIEDRO
CC1(C#N)CCC([NH2+]CC2(Cc3ccccc3)CC2)CC1	ZINC000449198759	330905611	/nfs/dbraw/zinc/90/56/11/330905611.db2.gz	DDHOOFBLEAOZJO-UHFFFAOYSA-N	1	0	282.431	4.071	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+][C@H](c1cccnc1)C1CC1	ZINC000449208017	330906337	/nfs/dbraw/zinc/90/63/37/330906337.db2.gz	OWHLXJXKBCDXDH-PBHICJAKSA-N	1	0	258.409	4.257	20	30		CIEDRO
N#CCCC[NH2+][C@H]1CC=C(c2ccc(Cl)cc2)CC1	ZINC000449231874	330907997	/nfs/dbraw/zinc/90/79/97/330907997.db2.gz	GAEVNYSYKSVANV-INIZCTEOSA-N	1	0	274.795	4.169	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+]C[C@H]1CCO[C@@H]1c1ccccc1	ZINC000449262890	330910764	/nfs/dbraw/zinc/91/07/64/330910764.db2.gz	JENMBRDSTLKHSZ-QXAKKESOSA-N	1	0	287.447	4.489	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1CCc2cc(F)c(F)c(F)c21	ZINC000449333740	330915400	/nfs/dbraw/zinc/91/54/00/330915400.db2.gz	VTDDMJBLCCIUBC-GFCCVEGCSA-N	1	0	296.336	4.011	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@H]2CCCc3c(F)cccc32)CC1	ZINC000449351450	330917513	/nfs/dbraw/zinc/91/75/13/330917513.db2.gz	PMPMKAZPJWUMKW-VXVMZULRSA-N	1	0	286.394	4.265	20	30		CIEDRO
Cc1ccc([C@@H]2CCC[C@@H]2[NH2+][C@H]2CC[C@@H](CC#N)C2)cc1	ZINC000449444772	330925927	/nfs/dbraw/zinc/92/59/27/330925927.db2.gz	DEICWQVUSHMNTP-WNHJNPCNSA-N	1	0	282.431	4.303	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@H]2CCC[C@H]2CCc2ccccc2)C1	ZINC000449444703	330925953	/nfs/dbraw/zinc/92/59/53/330925953.db2.gz	CPLBNWKWBVVLCB-MUGJNUQGSA-N	1	0	296.458	4.460	20	30		CIEDRO
CC(C)(C)c1ccc(CC[NH2+][C@H]2CC[C@@H](CC#N)C2)cc1	ZINC000449445866	330926193	/nfs/dbraw/zinc/92/61/93/330926193.db2.gz	MHBWFNAJSPTTRE-WMZOPIPTSA-N	1	0	284.447	4.199	20	30		CIEDRO
Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C#N)c(F)c1)[C@H](C)C2	ZINC000449736160	330947250	/nfs/dbraw/zinc/94/72/50/330947250.db2.gz	LIBSOSICHAXQIX-YJYMSZOUSA-N	1	0	294.373	4.029	20	30		CIEDRO
CC(C)c1ccc([C@@H](C)[NH2+]CC2(C#N)CCC2)cc1	ZINC000450507973	330984429	/nfs/dbraw/zinc/98/44/29/330984429.db2.gz	WPHZLFOWSQZTDS-CQSZACIVSA-N	1	0	256.393	4.154	20	30		CIEDRO
CC[C@H]([NH2+]CC1(C#N)CCC1)c1ccc(Cl)cc1	ZINC000450667535	330992139	/nfs/dbraw/zinc/99/21/39/330992139.db2.gz	KWDOGLMSEKXVCN-AWEZNQCLSA-N	1	0	262.784	4.075	20	30		CIEDRO
CC[C@H]([NH2+]CC1(C#N)CCC1)c1cccc(Cl)c1	ZINC000450668571	330992210	/nfs/dbraw/zinc/99/22/10/330992210.db2.gz	NQHHBQPIHUUAFC-AWEZNQCLSA-N	1	0	262.784	4.075	20	30		CIEDRO
C[C@@H]1[C@H](CC(F)(F)F)C[C@H](C)[N@H+]1CC#Cc1ccccc1	ZINC000451150473	331017710	/nfs/dbraw/zinc/01/77/10/331017710.db2.gz	WOTBUVSELPTTPA-LZWOXQAQSA-N	1	0	295.348	4.089	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](C)c1sc(C(C)(C)C)nc1C	ZINC000163336296	331022662	/nfs/dbraw/zinc/02/26/62/331022662.db2.gz	AKTNFERYKNZVRH-GHMZBOCLSA-N	1	0	266.454	4.364	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](C)c1sc(C(C)(C)C)nc1C	ZINC000163336417	331022686	/nfs/dbraw/zinc/02/26/86/331022686.db2.gz	AKTNFERYKNZVRH-MNOVXSKESA-N	1	0	266.454	4.364	20	30		CIEDRO
N#CCc1ccc(C[N@@H+]2CC3(CCC3)[C@@H]2c2ccco2)cc1	ZINC000451836549	331044157	/nfs/dbraw/zinc/04/41/57/331044157.db2.gz	AWIJELNPQHFDNO-SFHVURJKSA-N	1	0	292.382	4.073	20	30		CIEDRO
C=C(C)COCC[NH2+][C@@H](c1cccs1)C1CCCC1	ZINC000163510091	331048293	/nfs/dbraw/zinc/04/82/93/331048293.db2.gz	FXSWAGHRTKNHQS-MRXNPFEDSA-N	1	0	279.449	4.162	20	30		CIEDRO
C[C@H]([NH2+]CCCC(C)(C)C#N)[C@H]1CCC[C@@H](C)C1	ZINC000452068461	331052739	/nfs/dbraw/zinc/05/27/39/331052739.db2.gz	NCHAXEPXDVFKNQ-ILXRZTDVSA-N	1	0	250.430	4.121	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](C)c1ccc(Oc2ccccc2)cn1	ZINC000453145904	331094046	/nfs/dbraw/zinc/09/40/46/331094046.db2.gz	NWWQKYYDXOURKX-CABCVRRESA-N	1	0	282.387	4.489	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H](CCC#N)c1ccccc1)c1ccncc1	ZINC000453183512	331098268	/nfs/dbraw/zinc/09/82/68/331098268.db2.gz	YVAKNYJWULEPKL-MSOLQXFVSA-N	1	0	279.387	4.167	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@@H](C)CCCc1cccnc1	ZINC000453185669	331098562	/nfs/dbraw/zinc/09/85/62/331098562.db2.gz	XSKXZDYZGURUMS-CVEARBPZSA-N	1	0	260.425	4.127	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](C)CCCc1cccnc1	ZINC000453185671	331098605	/nfs/dbraw/zinc/09/86/05/331098605.db2.gz	XSKXZDYZGURUMS-HOTGVXAUSA-N	1	0	260.425	4.127	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@@H]1CC[C@@H](C)c2ccsc21	ZINC000453207075	331101490	/nfs/dbraw/zinc/10/14/90/331101490.db2.gz	FYCYMELSPUYSAL-XOUADPBQSA-N	1	0	291.460	4.257	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@@H](C)c1ncc(-c2ccccc2)n1C	ZINC000453232353	331104679	/nfs/dbraw/zinc/10/46/79/331104679.db2.gz	YRFRBIITKFKSEN-HOCLYGCPSA-N	1	0	283.419	4.092	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@H](C)c1ncc(-c2ccccc2)n1C	ZINC000453232347	331104683	/nfs/dbraw/zinc/10/46/83/331104683.db2.gz	YRFRBIITKFKSEN-GDBMZVCRSA-N	1	0	283.419	4.092	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@@H](C)c1ncc(-c2ccccc2)n1C	ZINC000453232350	331104793	/nfs/dbraw/zinc/10/47/93/331104793.db2.gz	YRFRBIITKFKSEN-GOEBONIOSA-N	1	0	283.419	4.092	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCCc2c(F)cccc21)c1ccc(C#N)cc1	ZINC000453238025	331105480	/nfs/dbraw/zinc/10/54/80/331105480.db2.gz	QBXBFIVQVRMOHE-YJYMSZOUSA-N	1	0	294.373	4.426	20	30		CIEDRO
CC[C@H]([NH2+]C[C@@H]1CCCCC1(F)F)c1ccc(C#N)cc1	ZINC000453242733	331106473	/nfs/dbraw/zinc/10/64/73/331106473.db2.gz	FSYLMBITIUVRBV-HOTGVXAUSA-N	1	0	292.373	4.424	20	30		CIEDRO
CC(C)(C)[C@H]1CCCC[C@H]1[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000453286487	331111300	/nfs/dbraw/zinc/11/13/00/331111300.db2.gz	DBEVASHTZILYJZ-YHUYYLMFSA-N	1	0	262.441	4.263	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccccc1Cl	ZINC000453287712	331111350	/nfs/dbraw/zinc/11/13/50/331111350.db2.gz	KLUASLDBDKCIRE-AVGNSLFASA-N	1	0	262.784	4.073	20	30		CIEDRO
CC1(C)CC[C@@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)c2ccccc21	ZINC000453289790	331111667	/nfs/dbraw/zinc/11/16/67/331111667.db2.gz	JAPWRQICGUAWNX-RLFYNMQTSA-N	1	0	282.431	4.471	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCCc1ncccc1C)c1ccco1	ZINC000453315374	331115435	/nfs/dbraw/zinc/11/54/35/331115435.db2.gz	ZFDIAGVUHDEVQM-QGZVFWFLSA-N	1	0	284.403	4.213	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCCc1ncccc1C)c1ccco1	ZINC000453315373	331115513	/nfs/dbraw/zinc/11/55/13/331115513.db2.gz	ZFDIAGVUHDEVQM-KRWDZBQOSA-N	1	0	284.403	4.213	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@H]1CCO[C@H](C(C)C)C1)c1ccco1	ZINC000453317622	331115836	/nfs/dbraw/zinc/11/58/36/331115836.db2.gz	KQJPNQXJQMDAOB-BQFCYCMXSA-N	1	0	291.435	4.328	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@H]1CCOC2(CCC2)C1)c1ccco1	ZINC000453331703	331117890	/nfs/dbraw/zinc/11/78/90/331117890.db2.gz	ZYPRRXOOAYNMDT-JKSUJKDBSA-N	1	0	289.419	4.226	20	30		CIEDRO
C[C@H]([NH2+]C1(Cc2ccc(F)cc2)CC1)c1cccc(C#N)c1	ZINC000453335140	331118342	/nfs/dbraw/zinc/11/83/42/331118342.db2.gz	CXVAJJKHDKODQK-AWEZNQCLSA-N	1	0	294.373	4.123	20	30		CIEDRO
C=C(CC)C[NH2+][C@@H](C)c1sc(-c2cccnc2)nc1C	ZINC000453358477	331122109	/nfs/dbraw/zinc/12/21/09/331122109.db2.gz	LUXUVEOAESXWRC-LBPRGKRZSA-N	1	0	287.432	4.130	20	30		CIEDRO
C=C(CC)C[NH2+][C@@H](C)c1ccc(SC)c(OC)c1	ZINC000453367150	331123527	/nfs/dbraw/zinc/12/35/27/331123527.db2.gz	PRAISYFZYLTYLM-LBPRGKRZSA-N	1	0	265.422	4.034	20	30		CIEDRO
C=C[C@@H]1OCCC[C@H]1[NH2+][C@@H]1CC[C@H](C)c2ccsc21	ZINC000453374849	331124513	/nfs/dbraw/zinc/12/45/13/331124513.db2.gz	WXRGOTFMVXLENL-MYPMTAMASA-N	1	0	277.433	4.010	20	30		CIEDRO
C[C@@H]([NH2+]C1(Cc2ccc(F)cc2)CC1)c1ccc(C#N)cc1	ZINC000453374176	331124568	/nfs/dbraw/zinc/12/45/68/331124568.db2.gz	XBLKPHLIFPYGCF-CQSZACIVSA-N	1	0	294.373	4.123	20	30		CIEDRO
Cc1ccc([C@@H]([NH2+]Cc2ccc(C#N)c(F)c2)C2CCC2)o1	ZINC000453376513	331124860	/nfs/dbraw/zinc/12/48/60/331124860.db2.gz	ILWFUDWHULZIAV-SFHVURJKSA-N	1	0	298.361	4.230	20	30		CIEDRO
CC1(C)Cc2occc2[C@@H]([NH2+]Cc2ccc(C#N)c(F)c2)C1	ZINC000453379963	331125496	/nfs/dbraw/zinc/12/54/96/331125496.db2.gz	KEZOFPLDPMWJPX-INIZCTEOSA-N	1	0	298.361	4.094	20	30		CIEDRO
C=CCC1(C[NH2+][C@H](c2ncc[nH]2)c2ccccc2)CCCC1	ZINC000453384339	331126438	/nfs/dbraw/zinc/12/64/38/331126438.db2.gz	UAFILFIINXAIFO-KRWDZBQOSA-N	1	0	295.430	4.225	20	30		CIEDRO
Cc1cccc([C@H](C)[NH2+][C@@H]2CCc3ccc(C#N)cc32)c1	ZINC000453398609	331128371	/nfs/dbraw/zinc/12/83/71/331128371.db2.gz	MYTYTFUAJALQQB-IFXJQAMLSA-N	1	0	276.383	4.205	20	30		CIEDRO
C=CCC[C@@H]([NH2+][C@@H]1CCO[C@@H](c2cccs2)C1)C1CC1	ZINC000453403450	331129085	/nfs/dbraw/zinc/12/90/85/331129085.db2.gz	AZLCHPUSZXUHRJ-BZUAXINKSA-N	1	0	291.460	4.303	20	30		CIEDRO
C=CC[C@@H](C)[C@H](C)[NH2+][C@@H]1CCO[C@@H](c2cccs2)C1	ZINC000453428181	331131119	/nfs/dbraw/zinc/13/11/19/331131119.db2.gz	PCFJDTIRFZNAFE-LXTVHRRPSA-N	1	0	279.449	4.159	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H]1CCOC(C)(C)C1)c1ccco1	ZINC000453434953	331131583	/nfs/dbraw/zinc/13/15/83/331131583.db2.gz	TXTPPGZVERTVTK-CABCVRRESA-N	1	0	277.408	4.082	20	30		CIEDRO
C[C@@H](CC(C)(C)C)[NH2+]Cc1cccc(OCCCC#N)c1	ZINC000453601267	331135852	/nfs/dbraw/zinc/13/58/52/331135852.db2.gz	NEAFPSHWZHBZIK-HNNXBMFYSA-N	1	0	288.435	4.283	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([N@@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)C1	ZINC000459581104	331289185	/nfs/dbraw/zinc/28/91/85/331289185.db2.gz	PSIVEBPKUYYHLD-NJAFHUGGSA-N	1	0	280.415	4.296	20	30		CIEDRO
CC(C)(CC#N)C[NH2+]C1CCC(c2ccccc2)CC1	ZINC000459726383	331296001	/nfs/dbraw/zinc/29/60/01/331296001.db2.gz	FJYCQFXJHAQXNN-UHFFFAOYSA-N	1	0	270.420	4.242	20	30		CIEDRO
C=CCCCC[NH2+][C@@H](C)c1ccc(OCC)c([N+](=O)[O-])c1	ZINC000471616166	331303183	/nfs/dbraw/zinc/30/31/83/331303183.db2.gz	AIEJJGDQZDRQAV-ZDUSSCGKSA-N	1	0	292.379	4.000	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](c1ccccc1)c1ccc(OC)cc1	ZINC000166146830	331306724	/nfs/dbraw/zinc/30/67/24/331306724.db2.gz	MODIARSQVHPFEA-KXBFYZLASA-N	1	0	281.399	4.339	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+]C[C@@H](c1ccco1)N1CCCCC1	ZINC000461796485	331314829	/nfs/dbraw/zinc/31/48/29/331314829.db2.gz	ONHQANFMIDCCOE-IRXDYDNUSA-N	1	0	290.451	4.141	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+]CCc1c(C)[nH]c2ccccc21	ZINC000462038876	331316903	/nfs/dbraw/zinc/31/69/03/331316903.db2.gz	MWLCBFJPNGTZFA-HNNXBMFYSA-N	1	0	270.420	4.353	20	30		CIEDRO
C[C@@H]([NH2+]CC1(C#N)CC1)c1ccc(Cl)c2ccccc21	ZINC000462446531	331322253	/nfs/dbraw/zinc/32/22/53/331322253.db2.gz	KRMYDVSMIVQYFL-GFCCVEGCSA-N	1	0	284.790	4.448	20	30		CIEDRO
CCC[C@H](CCc1ccccc1)[NH2+]Cc1ccc(C#N)cc1	ZINC000462728822	331325880	/nfs/dbraw/zinc/32/58/80/331325880.db2.gz	LVYULVFGUNKQGC-HXUWFJFHSA-N	1	0	292.426	4.449	20	30		CIEDRO
N#CCCCC[NH2+]Cc1ccc(C2CCCC2)cc1	ZINC000462791320	331329159	/nfs/dbraw/zinc/32/91/59/331329159.db2.gz	OIRLSAIJBCMZAN-UHFFFAOYSA-N	1	0	256.393	4.128	20	30		CIEDRO
C=CC[C@@H](C)[C@H](C)[NH2+]Cc1ccc(C(F)F)cc1	ZINC000462836823	331332126	/nfs/dbraw/zinc/33/21/26/331332126.db2.gz	UHRRTZQJJXNVPS-NEPJUHHUSA-N	1	0	253.336	4.315	20	30		CIEDRO
C[C@H](Nc1cc2c(c[nH+]1)CCCC2)c1cccc(C#N)c1	ZINC000462965853	331336118	/nfs/dbraw/zinc/33/61/18/331336118.db2.gz	PDIVWLCBVIDDIO-ZDUSSCGKSA-N	1	0	277.371	4.005	20	30		CIEDRO
C=CC[N@@H+](CCCCCn1c(C)nc2ccccc21)C1CC1	ZINC000463148259	331341076	/nfs/dbraw/zinc/34/10/76/331341076.db2.gz	IVNWBEUGKVJDRO-UHFFFAOYSA-N	1	0	297.446	4.165	20	30		CIEDRO
CCC[C@H](CCc1ccccc1)[NH2+][C@H]1CCC[C@@H](C#N)C1	ZINC000463236186	331343395	/nfs/dbraw/zinc/34/33/95/331343395.db2.gz	KFZZSXZVZUHTJS-QRVBRYPASA-N	1	0	284.447	4.460	20	30		CIEDRO
CCC(CC)(C[NH2+][C@H]1CCC[C@H](C#N)C1)c1ccccc1	ZINC000463238535	331343647	/nfs/dbraw/zinc/34/36/47/331343647.db2.gz	RFBYPVRJZSCMCN-WMZOPIPTSA-N	1	0	284.447	4.416	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)C(C)(C)c1ccccc1	ZINC000463240476	331343712	/nfs/dbraw/zinc/34/37/12/331343712.db2.gz	QXNXOYKQUFQZLG-JQHSSLGASA-N	1	0	284.447	4.415	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@H]2CCCC[C@@H]2Cc2ccccc2)C1	ZINC000463286472	331345138	/nfs/dbraw/zinc/34/51/38/331345138.db2.gz	VYXZBCRKGHWMMV-ZRNYENFQSA-N	1	0	296.458	4.460	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+]CCCCCc2ccccc2)C1	ZINC000463285293	331345185	/nfs/dbraw/zinc/34/51/85/331345185.db2.gz	SPSVYODLNIGNGJ-MSOLQXFVSA-N	1	0	270.420	4.071	20	30		CIEDRO
CC(C)CC(CC(C)C)[NH2+][C@@H]1CCC[C@H](C#N)C1	ZINC000463294690	331345617	/nfs/dbraw/zinc/34/56/17/331345617.db2.gz	FQAVIOFIBDHHHF-LSDHHAIUSA-N	1	0	250.430	4.119	20	30		CIEDRO
Cc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2Cc2cccc(C#N)c2)o1	ZINC000464832568	331370351	/nfs/dbraw/zinc/37/03/51/331370351.db2.gz	MJNOIJQXUCPXLZ-KSSFIOAISA-N	1	0	294.398	4.433	20	30		CIEDRO
Cc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2ccc(C#N)cc2)o1	ZINC000464841001	331370789	/nfs/dbraw/zinc/37/07/89/331370789.db2.gz	VTJLFJBQICCUJD-KBXCAEBGSA-N	1	0	294.398	4.433	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1cc2c(cc(C)cc2C)[nH]1	ZINC000466385451	331394370	/nfs/dbraw/zinc/39/43/70/331394370.db2.gz	FTESGRJCGDMYOK-CQSZACIVSA-N	1	0	256.393	4.229	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1cc(-c2ccncc2)ccc1OC	ZINC000466399445	331394987	/nfs/dbraw/zinc/39/49/87/331394987.db2.gz	NYSKYMLCVVXXDY-GOSISDBHSA-N	1	0	296.414	4.202	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1cnc(-c2cccs2)s1	ZINC000466400918	331395064	/nfs/dbraw/zinc/39/50/64/331395064.db2.gz	XIWCPXVZAPIJOD-LLVKDONJSA-N	1	0	278.446	4.316	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@@H](C)c1cc(OC)c(OC)cc1C	ZINC000467404967	331417861	/nfs/dbraw/zinc/41/78/61/331417861.db2.gz	LSLQWGVNEXOOCJ-KBPBESRZSA-N	1	0	277.408	4.018	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@@H](C)c1ccc(OC(F)F)c(OC)c1	ZINC000467414934	331418319	/nfs/dbraw/zinc/41/83/19/331418319.db2.gz	XERXNDMDNGXBSP-WCQYABFASA-N	1	0	299.361	4.302	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@@H](C)c1nc2ccc(Cl)cc2n1C	ZINC000467420003	331418615	/nfs/dbraw/zinc/41/86/15/331418615.db2.gz	SXRUGLVZGGBPDR-AAEUAGOBSA-N	1	0	291.826	4.232	20	30		CIEDRO
C[C@H]1CCC[C@@H]1C[NH2+]C1CCC(C#N)(c2ccccc2)CC1	ZINC000467436833	331419164	/nfs/dbraw/zinc/41/91/64/331419164.db2.gz	DQCXLQMQRHCDIW-QREPNTDJSA-N	1	0	296.458	4.416	20	30		CIEDRO
C[C@@H](CCC1CCCC1)[NH2+]CCc1cccc(C#N)c1	ZINC000467459228	331420537	/nfs/dbraw/zinc/42/05/37/331420537.db2.gz	RTMYMSYSUZZSGV-HNNXBMFYSA-N	1	0	270.420	4.049	20	30		CIEDRO
N#Cc1cc(C[NH+]2CCC(c3ccccc3)CC2)ccc1F	ZINC000468268858	331431566	/nfs/dbraw/zinc/43/15/66/331431566.db2.gz	BQQPUTVHPDPJPH-UHFFFAOYSA-N	1	0	294.373	4.077	20	30		CIEDRO
C=CCCCC[NH2+][C@@H](C)c1cc(F)c(F)c(F)c1	ZINC000471586863	331511213	/nfs/dbraw/zinc/51/12/13/331511213.db2.gz	SBLWOMMLQXCRHQ-JTQLQIEISA-N	1	0	257.299	4.111	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)C1	ZINC000471597249	331512164	/nfs/dbraw/zinc/51/21/64/331512164.db2.gz	NUDWGHQCYNSKAT-JEBQAFNWSA-N	1	0	284.378	4.043	20	30		CIEDRO
C=CCCCC[NH2+][C@H](C)c1ccc2ccccc2n1	ZINC000471597605	331512227	/nfs/dbraw/zinc/51/22/27/331512227.db2.gz	GNENRSNHGAMZKZ-CQSZACIVSA-N	1	0	254.377	4.242	20	30		CIEDRO
C=CCCCC[NH2+][C@@H](C)c1nc(C(F)(F)F)cs1	ZINC000471598677	331512354	/nfs/dbraw/zinc/51/23/54/331512354.db2.gz	LQKNAYTUSKNDCA-VIFPVBQESA-N	1	0	278.343	4.169	20	30		CIEDRO
C=CC[NH+]1CCC(c2ccccc2C(F)(F)F)CC1	ZINC000474212149	331575529	/nfs/dbraw/zinc/57/55/29/331575529.db2.gz	WUFASTAJOSNKAJ-UHFFFAOYSA-N	1	0	269.310	4.071	20	30		CIEDRO
CC[C@H](CC#N)[NH2+]C[C@H](CC(C)C)c1ccccc1	ZINC000474921102	331604026	/nfs/dbraw/zinc/60/40/26/331604026.db2.gz	AGPWPTISDGQBOZ-DLBZAZTESA-N	1	0	258.409	4.098	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)[C@@H](C)c1nc2ccccc2s1	ZINC000475208695	331618502	/nfs/dbraw/zinc/61/85/02/331618502.db2.gz	FCSURFXZVBIICM-OLZOCXBDSA-N	1	0	274.433	4.344	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@H]1CC[C@H](c2ccc(F)cc2)C1	ZINC000475336970	331627230	/nfs/dbraw/zinc/62/72/30/331627230.db2.gz	PCQDANNEIYLKNG-QRTARXTBSA-N	1	0	261.384	4.406	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+][C@H](C)c1ccc(Br)cn1	ZINC000475507895	331634411	/nfs/dbraw/zinc/63/44/11/331634411.db2.gz	BKIFHQUKIAAMNK-DGCLKSJQSA-N	1	0	297.240	4.240	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCc1ccccc1F)c1ccco1	ZINC000476008470	331651300	/nfs/dbraw/zinc/65/13/00/331651300.db2.gz	XNCCNGJGTUEFOV-MRXNPFEDSA-N	1	0	273.351	4.258	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](c1cc(F)ccc1F)C(C)C	ZINC000479396526	331726895	/nfs/dbraw/zinc/72/68/95/331726895.db2.gz	QKLMCCNMRPQVCX-NHYWBVRUSA-N	1	0	253.336	4.216	20	30		CIEDRO
C=CC[C@@H](C)[NH2+]Cc1ccc(-c2cccc(F)c2F)o1	ZINC000480383622	331770902	/nfs/dbraw/zinc/77/09/02/331770902.db2.gz	MGZVBQZIZWBFOF-LLVKDONJSA-N	1	0	277.314	4.279	20	30		CIEDRO
C=C(C)[C@@H]([NH2+][C@H](CC)C1CC1)c1ccc(F)c(F)c1	ZINC000480696633	331784969	/nfs/dbraw/zinc/78/49/69/331784969.db2.gz	WWASPWPYAZJMCL-HZPDHXFCSA-N	1	0	265.347	4.360	20	30		CIEDRO
C=C(C)[C@H]([NH2+][C@@H]1C=CCCC1)c1ccc(F)c(F)c1	ZINC000481607447	331810215	/nfs/dbraw/zinc/81/02/15/331810215.db2.gz	JKVOALKTRADMGG-CJNGLKHVSA-N	1	0	263.331	4.280	20	30		CIEDRO
C=C(C)[C@H]([NH2+][C@H]1C=CCCC1)c1ccc(F)c(F)c1	ZINC000481607434	331810305	/nfs/dbraw/zinc/81/03/05/331810305.db2.gz	JKVOALKTRADMGG-BBRMVZONSA-N	1	0	263.331	4.280	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+][C@@H]1CCc2c1cccc2O	ZINC000482539531	331837693	/nfs/dbraw/zinc/83/76/93/331837693.db2.gz	ANHVFVFSLQDOLO-CZUORRHYSA-N	1	0	259.393	4.104	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CCC[C@H](c3ccccc3)C2)cc1	ZINC000486898282	331948622	/nfs/dbraw/zinc/94/86/22/331948622.db2.gz	BPPAIAVIRHMDFE-VQTJNVASSA-N	1	0	290.410	4.374	20	30		CIEDRO
Cc1cc(C[NH2+][C@H](c2ccccc2)C2CC2)ccc1C#N	ZINC000488134337	331991601	/nfs/dbraw/zinc/99/16/01/331991601.db2.gz	DJHCZGLYTLBFSD-LJQANCHMSA-N	1	0	276.383	4.108	20	30		CIEDRO
N#CCC[C@H]([NH2+]C1CCC2(CC2)CC1)c1ccccc1	ZINC000488439636	332008728	/nfs/dbraw/zinc/00/87/28/332008728.db2.gz	OYGMAJQEMBMTHK-KRWDZBQOSA-N	1	0	268.404	4.344	20	30		CIEDRO
C[C@H]([NH2+]C1CCC2(CC2)CC1)c1ccc(C#N)cc1F	ZINC000488484325	332013155	/nfs/dbraw/zinc/01/31/55/332013155.db2.gz	ULENUOCKLHDDGG-LBPRGKRZSA-N	1	0	272.367	4.071	20	30		CIEDRO
CC[N@H+](C[C@@H](C)C#N)[C@@H](C)CCSc1ccccc1	ZINC000488723003	332022499	/nfs/dbraw/zinc/02/24/99/332022499.db2.gz	HBMZMSZRQVSILQ-GJZGRUSLSA-N	1	0	276.449	4.039	20	30		CIEDRO
C[C@@H](c1cccc(C#N)c1)[N@@H+]1CC[C@@H](Cc2ccccc2)C1	ZINC000489265455	332044530	/nfs/dbraw/zinc/04/45/30/332044530.db2.gz	CUQGUMYZFQXPNS-LPHOPBHVSA-N	1	0	290.410	4.184	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+]C[C@H]1CCO[C@@H](C(C)C)C1	ZINC000493707337	332450298	/nfs/dbraw/zinc/45/02/98/332450298.db2.gz	OMSDWOMXGLDLNT-YESZJQIVSA-N	1	0	267.457	4.162	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H]1CCO[C@H](C(CC)CC)C1)C1CC1	ZINC000495434229	332518753	/nfs/dbraw/zinc/51/87/53/332518753.db2.gz	QZNWDGQPAJJSGC-SQNIBIBYSA-N	1	0	279.468	4.305	20	30		CIEDRO
C[C@H]([NH2+][C@H]1C[C@H](C)C[C@H](C)C1)c1ccc(C#N)cc1	ZINC000252128099	334374180	/nfs/dbraw/zinc/37/41/80/334374180.db2.gz	LRECBTPXKDSLHZ-QDEZUTFSSA-N	1	0	256.393	4.034	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]C[C@H]2CCCC(F)(F)C2)cc1	ZINC000500374349	332605630	/nfs/dbraw/zinc/60/56/30/332605630.db2.gz	UFIFZIIGZHCMJD-HNNXBMFYSA-N	1	0	295.373	4.167	20	30		CIEDRO
C=CCOc1cccc(C[NH2+]C[C@H]2CCCC(F)(F)C2)c1	ZINC000500372367	332605693	/nfs/dbraw/zinc/60/56/93/332605693.db2.gz	OPSIWNGNKDGLES-HNNXBMFYSA-N	1	0	295.373	4.167	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+]CC1CCC(F)(F)CC1	ZINC000500425118	332608332	/nfs/dbraw/zinc/60/83/32/332608332.db2.gz	GIPTVJJZZZCCNB-UHFFFAOYSA-N	1	0	295.373	4.167	20	30		CIEDRO
C=C(C[NH2+][C@H]1CCC[C@H](c2cccnc2)C1)c1ccccc1	ZINC000501377700	332631340	/nfs/dbraw/zinc/63/13/40/332631340.db2.gz	MVIGCGZWCBPPHU-ICSRJNTNSA-N	1	0	292.426	4.411	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+][C@@H]1CCCC12CCOCC2	ZINC000502352138	332654621	/nfs/dbraw/zinc/65/46/21/332654621.db2.gz	HJZRBHVWSIQGPW-HZPDHXFCSA-N	1	0	265.441	4.060	20	30		CIEDRO
CC[C@H]([NH2+]C[C@H]1CCCC(F)(F)C1)c1ccc(C#N)cc1	ZINC000502578432	332666380	/nfs/dbraw/zinc/66/63/80/332666380.db2.gz	JHYYTFVPVXCRST-HOCLYGCPSA-N	1	0	292.373	4.424	20	30		CIEDRO
C=CCCC[NH2+][C@H](C)c1ccc(F)c(Br)c1	ZINC000303987145	332964063	/nfs/dbraw/zinc/96/40/63/332964063.db2.gz	KQMFXDJJKPZHGE-SNVBAGLBSA-N	1	0	286.188	4.205	20	30		CIEDRO
COc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(C#N)cc2F)cc1	ZINC000512623185	332976398	/nfs/dbraw/zinc/97/63/98/332976398.db2.gz	DOJUBCITYJUDEZ-STQMWFEESA-N	1	0	298.361	4.118	20	30		CIEDRO
Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@H](C)c1ccc(C#N)cc1F	ZINC000512628373	332976801	/nfs/dbraw/zinc/97/68/01/332976801.db2.gz	DUBJZXNTVSHKHM-YJYMSZOUSA-N	1	0	294.373	4.344	20	30		CIEDRO
C[C@@H]1CCC[C@H]([NH+]2CCC(Nc3cccc(C#N)c3)CC2)C1	ZINC000512783988	332985772	/nfs/dbraw/zinc/98/57/72/332985772.db2.gz	QBTWYXXOOXKDOF-BEFAXECRSA-N	1	0	297.446	4.013	20	30		CIEDRO
C[C@H]1CC[N@H+](CCCC(C)(C)C#N)[C@H](c2ccco2)C1	ZINC000174882873	333009835	/nfs/dbraw/zinc/00/98/35/333009835.db2.gz	LWKMKFXYWTYCBA-GJZGRUSLSA-N	1	0	274.408	4.383	20	30		CIEDRO
C[C@@H]1C[C@H](c2ccccc2)[N@H+](Cc2ccc(CC#N)cc2)C1	ZINC000513247341	333010806	/nfs/dbraw/zinc/01/08/06/333010806.db2.gz	NJUXCHIDYRSKLQ-OXQOHEQNSA-N	1	0	290.410	4.336	20	30		CIEDRO
C[C@H]1C[C@@H](c2ccccc2)[N@H+](Cc2cc(C#N)ccc2F)C1	ZINC000513275873	333012098	/nfs/dbraw/zinc/01/20/98/333012098.db2.gz	LGMRXBYJBFFDKW-LIRRHRJNSA-N	1	0	294.373	4.280	20	30		CIEDRO
CC1(c2ccccc2)CC[NH+](Cc2ccc(C#N)s2)CC1	ZINC000513652670	333029282	/nfs/dbraw/zinc/02/92/82/333029282.db2.gz	BAPUCOFSZYKKTR-UHFFFAOYSA-N	1	0	296.439	4.173	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccc(C)c(OC)c1)c1ccco1	ZINC000513666072	333030697	/nfs/dbraw/zinc/03/06/97/333030697.db2.gz	JHQJMBVGHPLBJM-MRXNPFEDSA-N	1	0	285.387	4.394	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCOC1CCCCC1)c1ccco1	ZINC000513683186	333032030	/nfs/dbraw/zinc/03/20/30/333032030.db2.gz	HNVKDTSTTGPKKU-MRXNPFEDSA-N	1	0	277.408	4.226	20	30		CIEDRO
C=C[C@H](C)[NH2+][C@@H](CC)c1ccc(OC(F)(F)F)cc1	ZINC000513703283	333033954	/nfs/dbraw/zinc/03/39/54/333033954.db2.gz	SRWIJZYVDRAOEC-GWCFXTLKSA-N	1	0	273.298	4.200	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H](c1ccccc1)N(C)C)c1ccco1	ZINC000513763293	333038040	/nfs/dbraw/zinc/03/80/40/333038040.db2.gz	WUSSDJGYTKHQIX-ROUUACIJSA-N	1	0	298.430	4.179	20	30		CIEDRO
N#CCCC[N@@H+](Cc1ccc(F)cc1)C1CCCCC1	ZINC000513787410	333039133	/nfs/dbraw/zinc/03/91/33/333039133.db2.gz	YKJUQOGKWQCXJK-UHFFFAOYSA-N	1	0	274.383	4.264	20	30		CIEDRO
C=CCCC[NH2+]C1CC(c2cccc(Br)c2)C1	ZINC000310258468	333055926	/nfs/dbraw/zinc/05/59/26/333055926.db2.gz	BMXQYQRAQIBQGO-UHFFFAOYSA-N	1	0	294.236	4.251	20	30		CIEDRO
C=CCCC[NH2+]C1CC(c2ccc(Br)cc2)C1	ZINC000310314779	333057169	/nfs/dbraw/zinc/05/71/69/333057169.db2.gz	WHKFFXPZZRTTSQ-UHFFFAOYSA-N	1	0	294.236	4.251	20	30		CIEDRO
C=C(C)C[NH+]1CCC(N[C@@H](C)c2ccccc2Cl)CC1	ZINC000177313804	333057512	/nfs/dbraw/zinc/05/75/12/333057512.db2.gz	KLQXQENDQKXYGM-AWEZNQCLSA-N	1	0	292.854	4.031	20	30		CIEDRO
N#CC1CC[NH+](Cc2cccc(Oc3ccccc3)c2)CC1	ZINC000177665402	333061650	/nfs/dbraw/zinc/06/16/50/333061650.db2.gz	PHBNMYJYSSRZIC-UHFFFAOYSA-N	1	0	292.382	4.214	20	30		CIEDRO
C=CCCC[NH2+][C@H](C)c1cc2cccc(OC)c2o1	ZINC000311633304	333070750	/nfs/dbraw/zinc/07/07/50/333070750.db2.gz	MWFWSZOFGMZVSP-GFCCVEGCSA-N	1	0	259.349	4.058	20	30		CIEDRO
C[C@@H]([NH2+]CC(C)(C)C(C)(C)C)c1cccc(C#N)c1	ZINC000311910186	333074222	/nfs/dbraw/zinc/07/42/22/333074222.db2.gz	RAADMNGRKFCYHV-CYBMUJFWSA-N	1	0	258.409	4.281	20	30		CIEDRO
C=CCCCC[NH2+][C@@H](C)c1ccc(OC(F)F)cc1	ZINC000311903795	333074239	/nfs/dbraw/zinc/07/42/39/333074239.db2.gz	AYJYAYMABFGLEZ-LBPRGKRZSA-N	1	0	269.335	4.295	20	30		CIEDRO
N#CCCCC[NH2+][C@@H](Cc1ccccc1)C1CCCCC1	ZINC000178645563	333076357	/nfs/dbraw/zinc/07/63/57/333076357.db2.gz	GONDXEWRORXTEP-IBGZPJMESA-N	1	0	284.447	4.461	20	30		CIEDRO
N#CCCCC[NH2+]C1(Cc2ccccc2)CCCCC1	ZINC000185460176	333141103	/nfs/dbraw/zinc/14/11/03/333141103.db2.gz	WCFCSRJZZNIZFO-UHFFFAOYSA-N	1	0	270.420	4.215	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1cc(O)cc(F)c1)c1ccccc1	ZINC000185601214	333144542	/nfs/dbraw/zinc/14/45/42/333144542.db2.gz	NLSIJWWJQJEQPQ-SFHVURJKSA-N	1	0	285.362	4.328	20	30		CIEDRO
CCCCOc1cccc(C[NH2+][C@H]2CCC[C@@H](C#N)C2)c1	ZINC000185783208	333148804	/nfs/dbraw/zinc/14/88/04/333148804.db2.gz	ONFAGGDCNBKBFW-WBVHZDCISA-N	1	0	286.419	4.037	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+]CCc2cccc3ccccc32)C1	ZINC000185819647	333149641	/nfs/dbraw/zinc/14/96/41/333149641.db2.gz	QMIOFWCZSCZOAG-CRAIPNDOSA-N	1	0	278.399	4.054	20	30		CIEDRO
CCOc1ccccc1C[N@H+](C)[C@H](C)c1cccc(C#N)c1	ZINC000186352993	333159048	/nfs/dbraw/zinc/15/90/48/333159048.db2.gz	BWZZFOYRELCEGG-OAHLLOKOSA-N	1	0	294.398	4.150	20	30		CIEDRO
C=C(C)[C@@H]([NH2+][C@H](C)c1ccncc1)c1ccc(F)c(F)c1	ZINC000186451431	333161071	/nfs/dbraw/zinc/16/10/71/333161071.db2.gz	UVMJPQDIHVXTKC-SJKOYZFVSA-N	1	0	288.341	4.328	20	30		CIEDRO
CC[C@@H](C[N@H+](CC)CCCCC#N)c1ccccc1	ZINC000186606805	333163472	/nfs/dbraw/zinc/16/34/72/333163472.db2.gz	UDIFHCXSWIUUCZ-INIZCTEOSA-N	1	0	258.409	4.196	20	30		CIEDRO
C[C@@H]([NH2+]C1C[C@H](C)C[C@@H](C)C1)c1cccc(C#N)c1	ZINC000220498284	333167035	/nfs/dbraw/zinc/16/70/35/333167035.db2.gz	WQECWQJCEZDLEH-MGPQQGTHSA-N	1	0	256.393	4.034	20	30		CIEDRO
N#Cc1cc(Cl)ccc1CNC1(c2ccccc2)CCC1	ZINC000187196301	333168409	/nfs/dbraw/zinc/16/84/09/333168409.db2.gz	VLEXVZNCVIVVET-UHFFFAOYSA-N	1	0	296.801	4.381	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C#N)o1)c1ccc(F)c2ccccc21	ZINC000521551238	333178451	/nfs/dbraw/zinc/17/84/51/333178451.db2.gz	JDZSWKXDUKBXQD-GFCCVEGCSA-N	1	0	294.329	4.294	20	30		CIEDRO
C=CC[N@H+](C/C=C\c1ccccc1)Cc1cccc(C#N)c1	ZINC000521710873	333184430	/nfs/dbraw/zinc/18/44/30/333184430.db2.gz	GSVGKLMPQMIZLG-GHXNOFRVSA-N	1	0	288.394	4.260	20	30		CIEDRO
C=CCN(CCOC(C)(C)C)Cc1ccc(Cl)s1	ZINC000521820979	333190007	/nfs/dbraw/zinc/19/00/07/333190007.db2.gz	MHFWWYZRAACDNW-UHFFFAOYSA-N	1	0	287.856	4.205	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]CCCc2cccc(F)c2)cc1	ZINC000521860430	333193982	/nfs/dbraw/zinc/19/39/82/333193982.db2.gz	PBDSYUFKYOCTLC-UHFFFAOYSA-N	1	0	299.389	4.113	20	30		CIEDRO
CC[NH+](CC)Cc1ccc(NCc2cc(C#N)cs2)cc1	ZINC000190383524	333206234	/nfs/dbraw/zinc/20/62/34/333206234.db2.gz	VHYXVFNUFQTHOL-UHFFFAOYSA-N	1	0	299.443	4.074	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@@H](C)c1cnn(C(C)(C)C)c1C	ZINC000191414114	333219345	/nfs/dbraw/zinc/21/93/45/333219345.db2.gz	VOZKDZWIWYFYBV-KGLIPLIRSA-N	1	0	277.456	4.342	20	30		CIEDRO
N#Cc1ccc(C[N@@H+]2CCC[C@H]2c2ccccc2)cc1F	ZINC000191862923	333226510	/nfs/dbraw/zinc/22/65/10/333226510.db2.gz	DOYLWDYLRVXGJK-SFHVURJKSA-N	1	0	280.346	4.034	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)c(F)c1)c1ccc(Cl)cc1	ZINC000192080046	333229105	/nfs/dbraw/zinc/22/91/05/333229105.db2.gz	PKFKHZSZRXNVSU-NSHDSACASA-N	1	0	288.753	4.202	20	30		CIEDRO
CC[N@@H+](Cc1ccc(C#N)cc1C(F)(F)F)CC(C)C	ZINC000522010440	333229888	/nfs/dbraw/zinc/22/98/88/333229888.db2.gz	PSEVFJRMYYADFK-UHFFFAOYSA-N	1	0	284.325	4.055	20	30		CIEDRO
CC[N@H+](Cc1ccc(OC)cc1)[C@H](C)c1ccc(C#N)cc1	ZINC000193759479	333256767	/nfs/dbraw/zinc/25/67/67/333256767.db2.gz	JDRHWGUSBPBMKB-OAHLLOKOSA-N	1	0	294.398	4.150	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@@H](C)CC1)c1cccc(C#N)c1	ZINC000227311857	333280254	/nfs/dbraw/zinc/28/02/54/333280254.db2.gz	NWMCLKPPORLTCD-JKIFEVAISA-N	1	0	256.393	4.178	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@@H]1CCC[C@H](SC)C1	ZINC000227377129	333282164	/nfs/dbraw/zinc/28/21/64/333282164.db2.gz	GUFOMZZEYDDTIH-CVEARBPZSA-N	1	0	291.460	4.015	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@H]1CCC[C@@H](SC)C1	ZINC000227377126	333282187	/nfs/dbraw/zinc/28/21/87/333282187.db2.gz	GUFOMZZEYDDTIH-JKSUJKDBSA-N	1	0	291.460	4.015	20	30		CIEDRO
C[C@H]1C[C@@H](c2ccccc2)C[N@@H+]1Cc1cc(C#N)ccc1F	ZINC000522471009	333287738	/nfs/dbraw/zinc/28/77/38/333287738.db2.gz	YXQFCVNCIGTKLO-WMLDXEAASA-N	1	0	294.373	4.075	20	30		CIEDRO
C[C@H]([NH2+]CC(C)(C)CCC#N)c1ccccc1Cl	ZINC000229670948	333307418	/nfs/dbraw/zinc/30/74/18/333307418.db2.gz	GWMQSZBXNWMBGR-LBPRGKRZSA-N	1	0	264.800	4.321	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1CCSc2ccc(F)cc21	ZINC000229677986	333307528	/nfs/dbraw/zinc/30/75/28/333307528.db2.gz	FRKMYBSLHMJYMB-CQSZACIVSA-N	1	0	292.423	4.282	20	30		CIEDRO
CC(C)Oc1ccc([C@@H](C)[NH2+]CC(C)(C)CCC#N)cc1	ZINC000229674819	333307545	/nfs/dbraw/zinc/30/75/45/333307545.db2.gz	CDCZHMJWKSYGGF-OAHLLOKOSA-N	1	0	288.435	4.454	20	30		CIEDRO
C[C@@H]([NH2+]CC(C)(C)CCC#N)c1ccc(Cl)s1	ZINC000229679369	333307791	/nfs/dbraw/zinc/30/77/91/333307791.db2.gz	SUHOVTAOZONVGM-SNVBAGLBSA-N	1	0	270.829	4.382	20	30		CIEDRO
Cc1ccc([C@@H](C)[NH2+]CC(C)(C)CCC#N)c(C)c1	ZINC000229690238	333307954	/nfs/dbraw/zinc/30/79/54/333307954.db2.gz	OLCDGLYUKQLNOA-OAHLLOKOSA-N	1	0	258.409	4.284	20	30		CIEDRO
C=CCCOCC[NH2+][C@H](C)c1cccc2ccccc21	ZINC000229860004	333310276	/nfs/dbraw/zinc/31/02/76/333310276.db2.gz	UWWPRTTXPQDJNS-OAHLLOKOSA-N	1	0	269.388	4.083	20	30		CIEDRO
C=CCCOCC[NH2+]Cc1ccc(-c2ccccc2)s1	ZINC000229880122	333310701	/nfs/dbraw/zinc/31/07/01/333310701.db2.gz	SLTIHHWCQCXCFF-UHFFFAOYSA-N	1	0	287.428	4.097	20	30		CIEDRO
Cc1cc([C@H](C)[NH2+]Cc2cccc(C#N)c2F)c(C)s1	ZINC000230615139	333319287	/nfs/dbraw/zinc/31/92/87/333319287.db2.gz	VRFSSMYZWKCBIR-NSHDSACASA-N	1	0	288.391	4.227	20	30		CIEDRO
C=C(C)COc1cc(C[NH2+]C[C@H](C)C(C)C)ccc1OC	ZINC000523525328	333332128	/nfs/dbraw/zinc/33/21/28/333332128.db2.gz	YSVMRPZKJSSJJB-HNNXBMFYSA-N	1	0	291.435	4.032	20	30		CIEDRO
C=C(C)C[N@H+](Cc1cccs1)Cc1ccccc1OC	ZINC000302753859	333335109	/nfs/dbraw/zinc/33/51/09/333335109.db2.gz	NWYOYWJKMHPIIK-UHFFFAOYSA-N	1	0	287.428	4.335	20	30		CIEDRO
CC(C)(C#N)CCCC[N@H+](Cc1cccs1)C1CC1	ZINC000232527125	333337928	/nfs/dbraw/zinc/33/79/28/333337928.db2.gz	WOTODUDSAOXLCP-UHFFFAOYSA-N	1	0	276.449	4.433	20	30		CIEDRO
CC[N@H+](CCCCC(C)(C)C#N)C1CCCCC1	ZINC000233442967	333352341	/nfs/dbraw/zinc/35/23/41/333352341.db2.gz	PWAJHXBBHRFIEG-UHFFFAOYSA-N	1	0	250.430	4.361	20	30		CIEDRO
CCC[C@@H](Cc1ccccc1)[N@H+](CCC)CCC#N	ZINC000524070139	333352858	/nfs/dbraw/zinc/35/28/58/333352858.db2.gz	MOLWXVIONLPVEU-KRWDZBQOSA-N	1	0	258.409	4.023	20	30		CIEDRO
CC[N@H+](CCCCC#N)Cc1ccc2ccccc2c1	ZINC000524111837	333353680	/nfs/dbraw/zinc/35/36/80/333353680.db2.gz	KPQHYWBBPCIAQC-UHFFFAOYSA-N	1	0	266.388	4.356	20	30		CIEDRO
Cc1ccccc1[C@@H]1C[C@H](C)[N@@H+](Cc2cccc(C#N)c2)C1	ZINC000524592358	333367646	/nfs/dbraw/zinc/36/76/46/333367646.db2.gz	HKWLMKHHXHYGRO-QFBILLFUSA-N	1	0	290.410	4.245	20	30		CIEDRO
C=CC1CC[NH+]([C@H](CC)c2ccc(F)cc2F)CC1	ZINC000524598976	333368298	/nfs/dbraw/zinc/36/82/98/333368298.db2.gz	UXCOXCFHBKRJTJ-MRXNPFEDSA-N	1	0	265.347	4.314	20	30		CIEDRO
CC1=C[C@H](C)C[C@H](C[NH2+][C@@H](C)c2ccc(C#N)cc2)C1	ZINC000235387086	333368896	/nfs/dbraw/zinc/36/88/96/333368896.db2.gz	GGDPMUBVTMZYPF-QRTARXTBSA-N	1	0	268.404	4.201	20	30		CIEDRO
C=CCCCCC[N@H+]1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O	ZINC000236541471	333373630	/nfs/dbraw/zinc/37/36/30/333373630.db2.gz	IUKPIRLOTFQDFM-KSZLIROESA-N	1	0	279.468	4.138	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)c1ccccc1OC	ZINC000315731273	333383523	/nfs/dbraw/zinc/38/35/23/333383523.db2.gz	LZFYVXRZROGVGY-KBXCAEBGSA-N	1	0	294.398	4.369	20	30		CIEDRO
C[C@@H]([NH2+]C[C@@H]1CCCc2ccccc21)c1ccc(C#N)cc1	ZINC000315874114	333384250	/nfs/dbraw/zinc/38/42/50/333384250.db2.gz	PYLJFIIQQVUNNH-BEFAXECRSA-N	1	0	290.410	4.329	20	30		CIEDRO
C=CCCC[NH2+][C@@H](c1ccc(F)cc1)c1ccc(OC)cc1	ZINC000524842721	333389922	/nfs/dbraw/zinc/38/99/22/333389922.db2.gz	SAXQVKWWLDWZST-IBGZPJMESA-N	1	0	299.389	4.480	20	30		CIEDRO
N#CCCC1CC[NH+](CCc2ccc3ccccc3c2)CC1	ZINC000576035828	335144015	/nfs/dbraw/zinc/14/40/15/335144015.db2.gz	XTNAZWLGRKCCQT-UHFFFAOYSA-N	1	0	292.426	4.398	20	30		CIEDRO
C[C@H]([NH2+][C@@H](C)c1ccccc1F)c1ccc(C#N)cc1	ZINC000037508452	333534585	/nfs/dbraw/zinc/53/45/85/333534585.db2.gz	QZPCLXBPQOYMAV-STQMWFEESA-N	1	0	268.335	4.109	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](C)c1ccccc1OC(F)(F)F	ZINC000537968492	333552058	/nfs/dbraw/zinc/55/20/58/333552058.db2.gz	JJXPENNUXNNLPY-MNOVXSKESA-N	1	0	273.298	4.200	20	30		CIEDRO
Cc1c2ccccc2oc1C[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000174100466	335148077	/nfs/dbraw/zinc/14/80/77/335148077.db2.gz	LPDYTUHBUNIOJC-CQSZACIVSA-N	1	0	290.366	4.464	20	30		CIEDRO
C=C(C)COCC[NH2+]Cc1ccc(-c2ccccc2)s1	ZINC000125801392	333573836	/nfs/dbraw/zinc/57/38/36/333573836.db2.gz	UPMNUEIXWSQQTF-UHFFFAOYSA-N	1	0	287.428	4.097	20	30		CIEDRO
C[C@H]([NH2+]Cc1cc(C#N)ccc1F)C(C)(C)c1ccccc1	ZINC000538151454	333577027	/nfs/dbraw/zinc/57/70/27/333577027.db2.gz	LDMPTKNOYQEJAI-AWEZNQCLSA-N	1	0	296.389	4.153	20	30		CIEDRO
C=C(CC)C[NH2+][C@H](C)c1ccc(SCCOC)cc1	ZINC000538205739	333579075	/nfs/dbraw/zinc/57/90/75/333579075.db2.gz	NTCCGGFOWSWZGG-CQSZACIVSA-N	1	0	279.449	4.042	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H]2CCC[C@H]2C1)c1ccc(C#N)cc1	ZINC000538396153	333588518	/nfs/dbraw/zinc/58/85/18/333588518.db2.gz	JZJLOUSWVDFLHU-HNONPPJISA-N	1	0	268.404	4.178	20	30		CIEDRO
N#CC1(c2ccccc2)CCC([NH2+][C@@H]2C=CCCC2)CC1	ZINC000538423396	333591458	/nfs/dbraw/zinc/59/14/58/333591458.db2.gz	NUUCIMMQUUHHPN-LMDPOFIKSA-N	1	0	280.415	4.089	20	30		CIEDRO
C=CC[N@@H+](CCCc1cnccc1C)Cc1ccccc1	ZINC000576073680	335149428	/nfs/dbraw/zinc/14/94/28/335149428.db2.gz	IMGSOJDQZVRRAU-UHFFFAOYSA-N	1	0	280.415	4.011	20	30		CIEDRO
C[C@@H]([NH2+]CCCC(C)(C)C)c1ccc(C#N)c(F)c1	ZINC000538508961	333601245	/nfs/dbraw/zinc/60/12/45/333601245.db2.gz	QCCLGSPCFWUAAB-GFCCVEGCSA-N	1	0	262.372	4.174	20	30		CIEDRO
CCC[C@@H]([NH2+]CCC(C)(C)C#N)C1CCCCC1	ZINC000538512255	333602094	/nfs/dbraw/zinc/60/20/94/333602094.db2.gz	ILXLHILRZXPLAQ-OAHLLOKOSA-N	1	0	250.430	4.265	20	30		CIEDRO
Cc1cc([C@@H]([NH2+]CCC(C)(C)C#N)C2CC2)ccc1F	ZINC000538512628	333602164	/nfs/dbraw/zinc/60/21/64/333602164.db2.gz	XDUNRQOKNZJZJQ-INIZCTEOSA-N	1	0	274.383	4.115	20	30		CIEDRO
C[C@@H]([NH2+]C1(c2ccccc2)CC1)c1ccc(C#N)c(F)c1	ZINC000538524470	333603576	/nfs/dbraw/zinc/60/35/76/333603576.db2.gz	VYMMAZGRZHTMIC-CYBMUJFWSA-N	1	0	280.346	4.037	20	30		CIEDRO
CC(C)COc1ccc(C[NH2+]CC(C)(C)CCC#N)cc1	ZINC000174284558	335152188	/nfs/dbraw/zinc/15/21/88/335152188.db2.gz	XGWBLRKELJGJII-UHFFFAOYSA-N	1	0	288.435	4.141	20	30		CIEDRO
C[C@H]([NH2+]C1CCC(Oc2ccccc2C#N)CC1)C1(C)CC1	ZINC000539081670	333656196	/nfs/dbraw/zinc/65/61/96/333656196.db2.gz	ONGKLMOQRRJFOA-OOHWJJMZSA-N	1	0	298.430	4.026	20	30		CIEDRO
C=CCCC[C@H](C)[NH+]1CCN(C/C=C\c2ccccc2)CC1	ZINC000539197466	333660386	/nfs/dbraw/zinc/66/03/86/333660386.db2.gz	IPDDTIVHQNAZLI-PMTSLALWSA-N	1	0	298.474	4.062	20	30		CIEDRO
C=CCC[NH2+][C@@H](COc1ccccc1F)c1ccccc1	ZINC000539265677	333663569	/nfs/dbraw/zinc/66/35/69/333663569.db2.gz	JUCHFTVFNIKEHD-KRWDZBQOSA-N	1	0	285.362	4.112	20	30		CIEDRO
Cc1ccccc1[C@H]([NH2+]Cc1ccc(F)cc1C#N)C(C)C	ZINC000539259116	333663611	/nfs/dbraw/zinc/66/36/11/333663611.db2.gz	NMVPDQBECNRYOM-LJQANCHMSA-N	1	0	296.389	4.493	20	30		CIEDRO
C=CCC[C@@H](O)C[NH2+][C@H](c1cccs1)C(CC)CC	ZINC000539281803	333663832	/nfs/dbraw/zinc/66/38/32/333663832.db2.gz	VVRRRLRLZAHHJP-ZBFHGGJFSA-N	1	0	281.465	4.142	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](C)c1cnn(Cc2ccccc2)c1	ZINC000539509627	333675417	/nfs/dbraw/zinc/67/54/17/333675417.db2.gz	IPEWTGJBXKCVPX-DLBZAZTESA-N	1	0	297.446	4.327	20	30		CIEDRO
C[C@]1([NH2+]Cc2cc(C#N)ccc2F)CCCc2ccccc21	ZINC000539807132	333691414	/nfs/dbraw/zinc/69/14/14/333691414.db2.gz	UHSPJEWDMXUIDX-IBGZPJMESA-N	1	0	294.373	4.039	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H](C)c1ccccc1-n1cccn1	ZINC000540360799	333727088	/nfs/dbraw/zinc/72/70/88/333727088.db2.gz	CAMXZOKDRBHRBH-HZPDHXFCSA-N	1	0	283.419	4.268	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H]2CCCC[C@H]2c2ccccc2)s1	ZINC000540575306	333735870	/nfs/dbraw/zinc/73/58/70/333735870.db2.gz	PPOVBPMOKGPYNP-ROUUACIJSA-N	1	0	296.439	4.436	20	30		CIEDRO
C[C@H]([NH2+]CCc1cccc(Cl)c1)c1ccc(C#N)cc1	ZINC000540596413	333736837	/nfs/dbraw/zinc/73/68/37/333736837.db2.gz	CZGOSRXEUXXXNX-ZDUSSCGKSA-N	1	0	284.790	4.105	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@H](C)[C@@H]1C)c1ccc(C#N)c(F)c1	ZINC000540701830	333742270	/nfs/dbraw/zinc/74/22/70/333742270.db2.gz	LBYDHIKEYZMZHC-NEULZYRMSA-N	1	0	274.383	4.173	20	30		CIEDRO
N#CCC1CC[NH+](Cc2ccc(-c3ccccc3)o2)CC1	ZINC000540994206	333757229	/nfs/dbraw/zinc/75/72/29/333757229.db2.gz	WZXDHILDMWTTKF-UHFFFAOYSA-N	1	0	280.371	4.072	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@@H]1CCCc2ccc(O)cc21	ZINC000340535685	335157729	/nfs/dbraw/zinc/15/77/29/335157729.db2.gz	NXOZSCNQJJDZNH-CXAGYDPISA-N	1	0	259.393	4.104	20	30		CIEDRO
N#CCc1ccc(C[NH2+][C@H](c2ccccc2)C2CCC2)cc1	ZINC000541282981	333769878	/nfs/dbraw/zinc/76/98/78/333769878.db2.gz	RTJOKGYTDBHKSM-HXUWFJFHSA-N	1	0	290.410	4.384	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](c1ncc(C)s1)C1CC1	ZINC000541599846	333783508	/nfs/dbraw/zinc/78/35/08/333783508.db2.gz	OAAMGPOCHCPCAE-FZMZJTMJSA-N	1	0	264.438	4.237	20	30		CIEDRO
C=CCC[C@H](C)[NH2+]Cc1ccc(-c2ccncc2)cc1	ZINC000541774236	333791990	/nfs/dbraw/zinc/79/19/90/333791990.db2.gz	CCXOWEYOQYCKDH-HNNXBMFYSA-N	1	0	266.388	4.193	20	30		CIEDRO
CCc1ccc(C(C)(C)[NH2+]Cc2ccc(CC#N)cc2)cc1	ZINC000542253292	333818744	/nfs/dbraw/zinc/81/87/44/333818744.db2.gz	LVJHDAIHKPWZPP-UHFFFAOYSA-N	1	0	292.426	4.340	20	30		CIEDRO
CS[C@H](C[NH2+][C@H](C)c1ccc(C#N)c(F)c1)C(C)(C)C	ZINC000542497041	333828385	/nfs/dbraw/zinc/82/83/85/333828385.db2.gz	ULTGJKXQEOVIMS-IAQYHMDHSA-N	1	0	294.439	4.126	20	30		CIEDRO
N#CCc1ccc(C[NH2+][C@H](c2cccs2)C2CC2)cc1	ZINC000542512531	333829546	/nfs/dbraw/zinc/82/95/46/333829546.db2.gz	RQOVBSUPZHIZDT-KRWDZBQOSA-N	1	0	282.412	4.055	20	30		CIEDRO
C=CC[NH2+][C@H](Cc1ccccc1)c1sccc1C	ZINC000542522972	333830630	/nfs/dbraw/zinc/83/06/30/333830630.db2.gz	WSMWQXXYMLOMJI-OAHLLOKOSA-N	1	0	257.402	4.116	20	30		CIEDRO
N#CCSCCC[NH2+]C1(c2ccccc2)CCCCC1	ZINC000130308826	333833905	/nfs/dbraw/zinc/83/39/05/333833905.db2.gz	JZVBZHRUYRRHKZ-UHFFFAOYSA-N	1	0	288.460	4.082	20	30		CIEDRO
C=CCC[C@@H](O)C[NH2+][C@H](c1ccc(Cl)cc1F)C(C)C	ZINC000542920311	333849794	/nfs/dbraw/zinc/84/97/94/333849794.db2.gz	QHSXRRAUZCHHCQ-CJNGLKHVSA-N	1	0	299.817	4.093	20	30		CIEDRO
C=CCC[C@H](O)C[NH2+][C@@H](c1ccc(Cl)cc1F)C(C)C	ZINC000542920313	333849802	/nfs/dbraw/zinc/84/98/02/333849802.db2.gz	QHSXRRAUZCHHCQ-XJKSGUPXSA-N	1	0	299.817	4.093	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+][C@@H](c1ccco1)c1ccccc1	ZINC000130529558	333850423	/nfs/dbraw/zinc/85/04/23/333850423.db2.gz	UAFQIYKPPJYABH-RHSMWYFYSA-N	1	0	255.361	4.313	20	30		CIEDRO
CC(C)([NH2+]CC#Cc1ccccc1Cl)c1cccs1	ZINC000543502471	333877696	/nfs/dbraw/zinc/87/76/96/333877696.db2.gz	YAYBBYKFWQJKPB-UHFFFAOYSA-N	1	0	289.831	4.278	20	30		CIEDRO
Cc1cc(C)cc([C@@H](C)[NH2+]Cc2ccc(CC#N)cc2)c1	ZINC000544117908	333917267	/nfs/dbraw/zinc/91/72/67/333917267.db2.gz	VEFQNJBVJIGJPB-MRXNPFEDSA-N	1	0	278.399	4.220	20	30		CIEDRO
C=C(C)C[NH2+][C@@H](C)[C@@H](C)c1ccccc1C(F)(F)F	ZINC000544461454	333932511	/nfs/dbraw/zinc/93/25/11/333932511.db2.gz	FRHSYJFIJSDNSC-NEPJUHHUSA-N	1	0	271.326	4.363	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+]CCC1CCC(OC)CC1	ZINC000544614648	333940762	/nfs/dbraw/zinc/94/07/62/333940762.db2.gz	GSDKJACYTDLFPO-AQFXKWCLSA-N	1	0	267.457	4.306	20	30		CIEDRO
C=CCC[C@H](C)[NH2+]CC1(c2ccccc2OC)CCC1	ZINC000544897192	333951194	/nfs/dbraw/zinc/95/11/94/333951194.db2.gz	BCBXBPXZHVXGRV-HNNXBMFYSA-N	1	0	273.420	4.061	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+][C@H](c1cccnc1)C1CC1	ZINC000545191692	333967675	/nfs/dbraw/zinc/96/76/75/333967675.db2.gz	MSVHVWNYUQCVLA-SJORKVTESA-N	1	0	258.409	4.257	20	30		CIEDRO
Cc1cccc(C)c1[C@H](C)[NH2+]CCCC(C)(C)C#N	ZINC000545517885	333985834	/nfs/dbraw/zinc/98/58/34/333985834.db2.gz	FHZQAOPBEZCZCN-HNNXBMFYSA-N	1	0	258.409	4.284	20	30		CIEDRO
CC(C)C[C@@H](Cc1cccc(Cl)c1)[NH2+]C[C@@H](C)C#N	ZINC000545899584	334004854	/nfs/dbraw/zinc/00/48/54/334004854.db2.gz	HBSBBONUAHTBSO-BBRMVZONSA-N	1	0	278.827	4.046	20	30		CIEDRO
N#CCSCCC[N@@H+]1CCCCC[C@H]1c1ccccc1	ZINC000074981932	334021627	/nfs/dbraw/zinc/02/16/27/334021627.db2.gz	TUKFPMDGOAZPCL-KRWDZBQOSA-N	1	0	288.460	4.251	20	30		CIEDRO
CCC1(C[NH2+]Cc2ccc(C#N)s2)CCCCC1	ZINC000546581258	334038844	/nfs/dbraw/zinc/03/88/44/334038844.db2.gz	LYKIERYCFOOEBQ-UHFFFAOYSA-N	1	0	262.422	4.070	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1C[C@@H](c2ccccc2)[C@@H]1C)c1ccc(C#N)cc1	ZINC000546621106	334040889	/nfs/dbraw/zinc/04/08/89/334040889.db2.gz	YTZRWAYHTMGVKC-IQGAEYHTSA-N	1	0	290.410	4.401	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@@H]2CCC[C@@H]2c2ccc(F)cc2)c1	ZINC000546658638	334044333	/nfs/dbraw/zinc/04/43/33/334044333.db2.gz	DQWGANNGIXRAMR-RTBURBONSA-N	1	0	294.373	4.123	20	30		CIEDRO
CC[C@@H](CC(F)(F)F)[NH2+][C@H](C)c1ccc(C#N)c(F)c1	ZINC000546870549	334052682	/nfs/dbraw/zinc/05/26/82/334052682.db2.gz	JFUOHIGEXIYXFQ-SKDRFNHKSA-N	1	0	288.288	4.079	20	30		CIEDRO
Cc1cccc(C)c1[C@@H](C)[NH2+]Cc1ccc(F)c(C#N)c1	ZINC000546931211	334055819	/nfs/dbraw/zinc/05/58/19/334055819.db2.gz	LFKVJFSCTSQGTK-CQSZACIVSA-N	1	0	282.362	4.165	20	30		CIEDRO
Cc1cccc(C)c1[C@H](C)[NH2+]Cc1ccc(F)c(C#N)c1	ZINC000546931210	334055923	/nfs/dbraw/zinc/05/59/23/334055923.db2.gz	LFKVJFSCTSQGTK-AWEZNQCLSA-N	1	0	282.362	4.165	20	30		CIEDRO
CCCC[C@H]1CCC[C@@H]1[NH2+]Cc1cc(C#N)cs1	ZINC000236884187	334076607	/nfs/dbraw/zinc/07/66/07/334076607.db2.gz	LYWFANZOVQAFJK-ZFWWWQNUSA-N	1	0	262.422	4.068	20	30		CIEDRO
CCC(CC)[NH2+]C1CCC(Oc2ccccc2C#N)CC1	ZINC000547318994	334078632	/nfs/dbraw/zinc/07/86/32/334078632.db2.gz	QBZKKMFOYYBRAU-UHFFFAOYSA-N	1	0	286.419	4.026	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C1CC(c2ccccc2)C1)C1CC1	ZINC000547396005	334085487	/nfs/dbraw/zinc/08/54/87/334085487.db2.gz	OBBMMWBTYZSASV-DAWZGUTISA-N	1	0	255.405	4.267	20	30		CIEDRO
CC(C)(CCc1ccccc1)[NH2+]Cc1cccc(C#N)c1	ZINC000134521130	334093466	/nfs/dbraw/zinc/09/34/66/334093466.db2.gz	UBYMWWVJYQZELF-UHFFFAOYSA-N	1	0	278.399	4.059	20	30		CIEDRO
CC(C)(C#N)CC[NH2+][C@H]1CCCC[C@@H]1Cc1ccccc1	ZINC000547509486	334096165	/nfs/dbraw/zinc/09/61/65/334096165.db2.gz	CUNNDGIRKGNWAR-MSOLQXFVSA-N	1	0	284.447	4.317	20	30		CIEDRO
C=CC[C@@H](C)[NH2+]Cc1ccc(OCCCCC)cc1	ZINC000134749026	334102878	/nfs/dbraw/zinc/10/28/78/334102878.db2.gz	AHHXECORDSOFMM-OAHLLOKOSA-N	1	0	261.409	4.310	20	30		CIEDRO
C=CC[C@H](C)[NH2+]Cc1ccc(OCCC(C)C)cc1	ZINC000134749206	334102989	/nfs/dbraw/zinc/10/29/89/334102989.db2.gz	OYIXCBQLXPKDKZ-HNNXBMFYSA-N	1	0	261.409	4.166	20	30		CIEDRO
C[N@H+](Cc1ccccc1)Cc1ccccc1C(C)(C)C#N	ZINC000135093324	334115306	/nfs/dbraw/zinc/11/53/06/334115306.db2.gz	MGJGFSZMAMLFLM-UHFFFAOYSA-N	1	0	278.399	4.120	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)o1)c1cccc2ccccc21	ZINC000135126807	334116856	/nfs/dbraw/zinc/11/68/56/334116856.db2.gz	NSKUIKOLCJLTTE-ZDUSSCGKSA-N	1	0	276.339	4.155	20	30		CIEDRO
CC(C)(C#N)c1ccccc1C[NH+]1Cc2ccccc2C1	ZINC000135202930	334119633	/nfs/dbraw/zinc/11/96/33/334119633.db2.gz	GDYWEEGOBMKRPO-UHFFFAOYSA-N	1	0	276.383	4.004	20	30		CIEDRO
C=C(C)[C@H]([NH2+]CC=C(C)C)c1ccc(F)c(F)c1	ZINC000547836226	334125545	/nfs/dbraw/zinc/12/55/45/334125545.db2.gz	RQLADQCNXCQOOS-HNNXBMFYSA-N	1	0	251.320	4.138	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)s1)c1ccc(Cl)s1	ZINC000135675408	334136099	/nfs/dbraw/zinc/13/60/99/334136099.db2.gz	KGFAKXCILYIOSJ-QMMMGPOBSA-N	1	0	282.821	4.185	20	30		CIEDRO
C[C@H]([NH2+]CCC(C)(C)C#N)C1(c2ccccc2)CCCC1	ZINC000548168673	334144562	/nfs/dbraw/zinc/14/45/62/334144562.db2.gz	LNORMUKGXMQGNI-INIZCTEOSA-N	1	0	284.447	4.416	20	30		CIEDRO
C[C@@H]([NH2+]C1CCC(C)(C)CC1)c1ccc(C#N)cc1	ZINC000079624306	334158429	/nfs/dbraw/zinc/15/84/29/334158429.db2.gz	IWTAVBJXQFDLEF-CYBMUJFWSA-N	1	0	256.393	4.178	20	30		CIEDRO
Cc1ccc(C[C@H](C)[NH2+][C@H](C)c2cccc(C#N)c2)s1	ZINC000080240700	334168143	/nfs/dbraw/zinc/16/81/43/334168143.db2.gz	BLIYPVXYHMKVDE-GXTWGEPZSA-N	1	0	284.428	4.210	20	30		CIEDRO
Cc1ccc(C[C@@H](C)[NH2+][C@@H](C)c2ccc(C#N)cc2)s1	ZINC000080242135	334168307	/nfs/dbraw/zinc/16/83/07/334168307.db2.gz	NXSYZGWEJHFBSL-OCCSQVGLSA-N	1	0	284.428	4.210	20	30		CIEDRO
C=CC[N@H+](Cc1cccs1)C[C@H](OC)c1ccccc1	ZINC000549350523	334191058	/nfs/dbraw/zinc/19/10/58/334191058.db2.gz	ZRIDZPLIINCDSU-KRWDZBQOSA-N	1	0	287.428	4.124	20	30		CIEDRO
C=CCOCC[N@@H+]([C@H](C)c1ccccc1Cl)C1CC1	ZINC000549405262	334192380	/nfs/dbraw/zinc/19/23/80/334192380.db2.gz	FCHNMAWNPFFSKW-CYBMUJFWSA-N	1	0	279.811	4.068	20	30		CIEDRO
CC[C@H](C[N@H+](CC)[C@@H]1CC[C@@H](C#N)C1)c1ccccc1	ZINC000549556455	334197865	/nfs/dbraw/zinc/19/78/65/334197865.db2.gz	YMPOYTCIKAJCBM-JFIYKMOQSA-N	1	0	270.420	4.194	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@@H](C#N)C1)c1ccc(Cl)cc1Cl	ZINC000549613834	334199610	/nfs/dbraw/zinc/19/96/10/334199610.db2.gz	RGSRQZPINOHQSR-FOGDFJRCSA-N	1	0	283.202	4.336	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCC[C@H](C2CC2)C1)c1ccc(C#N)cc1	ZINC000081632285	334201222	/nfs/dbraw/zinc/20/12/22/334201222.db2.gz	XKIMBVJRJRAPEY-KKXDTOCCSA-N	1	0	268.404	4.178	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([N@@H+]2CCC[C@H](CCCc3ccccc3)C2)C1	ZINC000549915247	334208374	/nfs/dbraw/zinc/20/83/74/334208374.db2.gz	CCQVVPRXYZIHQS-ZCNNSNEGSA-N	1	0	296.458	4.414	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](C#N)C1)c1cc(Cl)ccc1Cl	ZINC000549938740	334209890	/nfs/dbraw/zinc/20/98/90/334209890.db2.gz	IJUWYGBFBJITCX-UMNHJUIQSA-N	1	0	283.202	4.336	20	30		CIEDRO
CC(C)(C#N)c1ccccc1C[N@@H+]1CC[C@H](CC2CC2)C1	ZINC000550049186	334211911	/nfs/dbraw/zinc/21/19/11/334211911.db2.gz	LSPODJYEDCQKGA-MRXNPFEDSA-N	1	0	282.431	4.110	20	30		CIEDRO
CC(C)(C#N)CCCC[N@@H+]1CC[C@H](c2ccccc2F)C1	ZINC000550211459	334216179	/nfs/dbraw/zinc/21/61/79/334216179.db2.gz	LGGKFADETQHESV-HNNXBMFYSA-N	1	0	288.410	4.335	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+][C@@H](C)c1ccc(-n2cccn2)c(F)c1	ZINC000550286090	334219000	/nfs/dbraw/zinc/21/90/00/334219000.db2.gz	DSSYYJJWHDQDAB-KGLIPLIRSA-N	1	0	287.382	4.017	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@@H](C)c1ccc(-n2cccn2)c(F)c1	ZINC000550286089	334219073	/nfs/dbraw/zinc/21/90/73/334219073.db2.gz	DSSYYJJWHDQDAB-KBPBESRZSA-N	1	0	287.382	4.017	20	30		CIEDRO
CCS[C@@H]1CCC[C@H]([NH2+][C@H](C)c2ccc(C#N)cc2)C1	ZINC000245883151	334222788	/nfs/dbraw/zinc/22/27/88/334222788.db2.gz	LFAOXWCLQMMEGO-XOKHGSTOSA-N	1	0	288.460	4.273	20	30		CIEDRO
C[C@H]([NH2+]C[C@@H](c1ccccc1)C1CC1)c1cccc(C#N)c1	ZINC000550847938	334230173	/nfs/dbraw/zinc/23/01/73/334230173.db2.gz	QMUJAUSGELHSHB-YWZLYKJASA-N	1	0	290.410	4.403	20	30		CIEDRO
N#Cc1cccc(C2([NH2+]Cc3cc4ccccc4o3)CC2)c1	ZINC000551226661	334241634	/nfs/dbraw/zinc/24/16/34/334241634.db2.gz	UZZIARFJGFPBDI-UHFFFAOYSA-N	1	0	288.350	4.083	20	30		CIEDRO
C=CC[C@@H](C)[C@@H](C)[NH2+]CCc1ccc(Cl)c(OC)c1	ZINC000551305038	334244928	/nfs/dbraw/zinc/24/49/28/334244928.db2.gz	SCSXPKHNCOJKQT-CHWSQXEVSA-N	1	0	281.827	4.081	20	30		CIEDRO
C=CCC[C@@H]([NH2+][C@@H](C)c1ccnc(OC)c1)c1ccccc1	ZINC000551314902	334246785	/nfs/dbraw/zinc/24/67/85/334246785.db2.gz	IGCNYRWQUBKCJC-MAUKXSAKSA-N	1	0	296.414	4.448	20	30		CIEDRO
Cc1cc(C[NH+]2CCC(CC(F)(F)F)CC2)ccc1C#N	ZINC000551408012	334249483	/nfs/dbraw/zinc/24/94/83/334249483.db2.gz	WQHLDMCRBIWAMP-UHFFFAOYSA-N	1	0	296.336	4.031	20	30		CIEDRO
CC(C)=CCC[C@H](C)[NH2+]C1(c2cccc(C#N)c2)CC1	ZINC000551572592	334254813	/nfs/dbraw/zinc/25/48/13/334254813.db2.gz	SBNWVSUBGGESQK-HNNXBMFYSA-N	1	0	268.404	4.272	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+]C2(c3ccc(Cl)cc3)CCC2)C1	ZINC000551816181	334263145	/nfs/dbraw/zinc/26/31/45/334263145.db2.gz	HAYWSSAKDZJEBX-DOMZBBRYSA-N	1	0	274.795	4.001	20	30		CIEDRO
N#C[C@H]1CC[C@H]([NH2+]C2(c3ccc(Cl)cc3)CCC2)C1	ZINC000551816194	334263194	/nfs/dbraw/zinc/26/31/94/334263194.db2.gz	HAYWSSAKDZJEBX-WFASDCNBSA-N	1	0	274.795	4.001	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@](C)(O)C1CCCCC1)c1ccco1	ZINC000552068182	334285258	/nfs/dbraw/zinc/28/52/58/334285258.db2.gz	MIMDSGLNMKLKLD-AEFFLSMTSA-N	1	0	291.435	4.208	20	30		CIEDRO
C=C(C)CC[N@H+]1CCCC[C@@H]1c1nc2ccccc2n1C	ZINC000552070665	334285692	/nfs/dbraw/zinc/28/56/92/334285692.db2.gz	MUPBYLDSEIVZPJ-QGZVFWFLSA-N	1	0	283.419	4.067	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H](c2cccnc2)C(C)C)cc1	ZINC000552088646	334287962	/nfs/dbraw/zinc/28/79/62/334287962.db2.gz	OLLXXBVPVXKCLH-LJQANCHMSA-N	1	0	296.414	4.133	20	30		CIEDRO
C=C(C)CN1CCC([NH2+][C@H](CC)c2cccc(C)c2)CC1	ZINC000552251384	334308873	/nfs/dbraw/zinc/30/88/73/334308873.db2.gz	UWJRNJAFRCVWBG-LJQANCHMSA-N	1	0	286.463	4.076	20	30		CIEDRO
CC[C@@H]([NH2+]CC1CCC(C#N)CC1)c1cccc(C)c1	ZINC000552277554	334311852	/nfs/dbraw/zinc/31/18/52/334311852.db2.gz	YBPJETKEKIOKSM-LEOMRAHMSA-N	1	0	270.420	4.366	20	30		CIEDRO
CC(C)Oc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H](C#N)C2)cc1	ZINC000248700450	334313956	/nfs/dbraw/zinc/31/39/56/334313956.db2.gz	AEAQAUZHJQHKCW-ZMSDIMECSA-N	1	0	286.419	4.207	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)c1ccc(OC(F)F)cc1	ZINC000248707580	334314271	/nfs/dbraw/zinc/31/42/71/334314271.db2.gz	AYZMJYJISRCKKB-OUCADQQQSA-N	1	0	294.345	4.021	20	30		CIEDRO
CCC[C@]1(C)CCC[N@H+](Cc2cc(C#N)cs2)C1	ZINC000552300014	334314597	/nfs/dbraw/zinc/31/45/97/334314597.db2.gz	UJBKDVMUCZIKCQ-OAHLLOKOSA-N	1	0	262.422	4.022	20	30		CIEDRO
CCC[C@H]1[C@@H](C)CCC[N@@H+]1CC(C)(C)CCC#N	ZINC000552301444	334314984	/nfs/dbraw/zinc/31/49/84/334314984.db2.gz	BZNHVAOOQBCQKT-GJZGRUSLSA-N	1	0	250.430	4.217	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+][C@H](c2ccccc2)C2CCC2)C1	ZINC000248811333	334318018	/nfs/dbraw/zinc/31/80/18/334318018.db2.gz	KOJXVNIRAWZCOK-ZTFGCOKTSA-N	1	0	268.404	4.200	20	30		CIEDRO
CC(C)[C@H](Cc1ccc(F)cc1)[NH2+][C@H]1CCC[C@@H](C#N)C1	ZINC000248851722	334319709	/nfs/dbraw/zinc/31/97/09/334319709.db2.gz	OURNWESXJINHCQ-NJAFHUGGSA-N	1	0	288.410	4.065	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)c1ccccc1	ZINC000248907153	334321618	/nfs/dbraw/zinc/32/16/18/334321618.db2.gz	UYIKUEXGJGQVBI-NXHRZFHOSA-N	1	0	268.404	4.366	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)c1cccc(Cl)c1	ZINC000248922029	334321852	/nfs/dbraw/zinc/32/18/52/334321852.db2.gz	WTVRZPKMRYMKDG-WQVCFCJDSA-N	1	0	276.811	4.463	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)C1	ZINC000248940265	334322263	/nfs/dbraw/zinc/32/22/63/334322263.db2.gz	YRZJKHYYAAPUNQ-CSMYWGQOSA-N	1	0	288.822	4.463	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@H]2CCSc3ccc(F)cc32)C1	ZINC000249053727	334325926	/nfs/dbraw/zinc/32/59/26/334325926.db2.gz	YBXFQYCPZGEAJS-ZLDLUXBVSA-N	1	0	290.407	4.035	20	30		CIEDRO
CC[C@H](C)[C@@H](C)[N@H+](Cc1ccc(F)cc1C#N)C1CC1	ZINC000552594289	334338493	/nfs/dbraw/zinc/33/84/93/334338493.db2.gz	LPRUQBIZLQWZFL-QWHCGFSZSA-N	1	0	274.383	4.096	20	30		CIEDRO
C[C@@H]1CCC[C@H]1[NH2+]C1CCC(Oc2ccccc2C#N)CC1	ZINC000088720170	334340816	/nfs/dbraw/zinc/34/08/16/334340816.db2.gz	SAODOFANKSPPST-AGERRDQYSA-N	1	0	298.430	4.026	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@@H](C)c1cnn(C(C)C)c1	ZINC000552756807	334344115	/nfs/dbraw/zinc/34/41/15/334344115.db2.gz	QENMENAJJGCEOT-GJZGRUSLSA-N	1	0	263.429	4.250	20	30		CIEDRO
N#Cc1ccc2c(c1)CCC[C@@H]2[NH2+]C/C=C/c1ccccc1	ZINC000552956873	334352912	/nfs/dbraw/zinc/35/29/12/334352912.db2.gz	VTSXJILSPUBHOG-FKIZTMCRSA-N	1	0	288.394	4.239	20	30		CIEDRO
C[C@@H](CCc1ccco1)[NH2+][C@@H]1CCCc2cc(C#N)ccc21	ZINC000553305606	334375775	/nfs/dbraw/zinc/37/57/75/334375775.db2.gz	WIMCQXRFPUOBRN-IFXJQAMLSA-N	1	0	294.398	4.140	20	30		CIEDRO
CC[C@@H]1CCC[C@H]([NH2+][C@@H](C)c2ccc(C#N)c(F)c2)C1	ZINC000553791665	334399104	/nfs/dbraw/zinc/39/91/04/334399104.db2.gz	XXXLGQGJCJKRGV-ZENOOKHLSA-N	1	0	274.383	4.317	20	30		CIEDRO
CC(C)CC(CC(C)C)[NH2+]CC(C)(C)CCC#N	ZINC000554077547	334409842	/nfs/dbraw/zinc/40/98/42/334409842.db2.gz	OXIQESHIIZPQMP-UHFFFAOYSA-N	1	0	252.446	4.367	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@@H]1CCc2c1ccc(OC)c2F	ZINC000554739490	334450186	/nfs/dbraw/zinc/45/01/86/334450186.db2.gz	YIRILSMVTADWHN-IUODEOHRSA-N	1	0	277.383	4.156	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)C1	ZINC000555421770	334478082	/nfs/dbraw/zinc/47/80/82/334478082.db2.gz	LKIDIBYTBKKBJK-XFBWCDHKSA-N	1	0	274.795	4.073	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]Cc2coc3ccccc23)cc1	ZINC000555590611	334483331	/nfs/dbraw/zinc/48/33/31/334483331.db2.gz	KHEZQWVWJBTYCC-UHFFFAOYSA-N	1	0	293.366	4.287	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@@H](C)c1cccc(C2CC2)c1	ZINC000556179174	334498611	/nfs/dbraw/zinc/49/86/11/334498611.db2.gz	SXOSYGCZOJCPKO-KYNGSXCRSA-N	1	0	285.431	4.196	20	30		CIEDRO
C[C@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)c1ccc(C#N)cc1F	ZINC000556242089	334503169	/nfs/dbraw/zinc/50/31/69/334503169.db2.gz	QWSJMIFAWRNMRV-OWQGQXMQSA-N	1	0	294.373	4.152	20	30		CIEDRO
CC(C)C1(C[NH2+]Cc2ccc(C#N)cc2C(F)(F)F)CC1	ZINC000565627109	334581163	/nfs/dbraw/zinc/58/11/63/334581163.db2.gz	POFDTIWYPZUIHS-UHFFFAOYSA-N	1	0	296.336	4.103	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+][C@@H](c1ccc(C)cc1)C1CC1	ZINC000565724433	334591796	/nfs/dbraw/zinc/59/17/96/334591796.db2.gz	VLYSJPFBJXHORV-FHWLQOOXSA-N	1	0	285.431	4.017	20	30		CIEDRO
C[C@H]([NH2+]CC1CCC(C#N)CC1)c1ccc(Cl)c(F)c1	ZINC000565989492	334614075	/nfs/dbraw/zinc/61/40/75/334614075.db2.gz	VKBNVBBAZJIVJU-HIFPTAJRSA-N	1	0	294.801	4.460	20	30		CIEDRO
CC(C)(C)[C@H]1CCC[C@@H]([NH2+]Cc2nc(C#N)cs2)CC1	ZINC000566038916	334617848	/nfs/dbraw/zinc/61/78/48/334617848.db2.gz	RBTHTPHPBGIYNY-QWHCGFSZSA-N	1	0	291.464	4.099	20	30		CIEDRO
CC(C)(C[NH2+][C@H]1CCc2ccc(C#N)cc21)c1cccs1	ZINC000566532815	334654308	/nfs/dbraw/zinc/65/43/08/334654308.db2.gz	ZHULCKRSDNIIJJ-INIZCTEOSA-N	1	0	296.439	4.174	20	30		CIEDRO
CC(C)CC[C@H]([NH2+]CC1(CC#N)CC1)C(C)(C)C	ZINC000566643085	334658833	/nfs/dbraw/zinc/65/88/33/334658833.db2.gz	ZQODVWVUJBKIHV-AWEZNQCLSA-N	1	0	250.430	4.121	20	30		CIEDRO
CC(C)(C#N)CCC[NH+]1CCC(C)(c2ccccc2)CC1	ZINC000153867223	334681104	/nfs/dbraw/zinc/68/11/04/334681104.db2.gz	QVLWMVYRJNOJEC-UHFFFAOYSA-N	1	0	284.447	4.370	20	30		CIEDRO
C[C@@H](C[NH2+][C@@H](C)c1ccc(OCC#N)cc1)c1ccccc1	ZINC000271830307	334747214	/nfs/dbraw/zinc/74/72/14/334747214.db2.gz	PNKKUVFWIXNZDS-HOTGVXAUSA-N	1	0	294.398	4.043	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccc(C)o1)c1ccccc1	ZINC000158837183	334814834	/nfs/dbraw/zinc/81/48/34/334814834.db2.gz	CJKUOTFJNWHSMO-KRWDZBQOSA-N	1	0	255.361	4.385	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCc1cc(F)cc(F)c1)c1ccco1	ZINC000568671773	334835622	/nfs/dbraw/zinc/83/56/22/334835622.db2.gz	ZKGWSRHSHMOTKJ-INIZCTEOSA-N	1	0	291.341	4.397	20	30		CIEDRO
CC[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(C#N)cc1C(F)(F)F	ZINC000569177317	334859470	/nfs/dbraw/zinc/85/94/70/334859470.db2.gz	DHTIWRIZFQDUOB-IUODEOHRSA-N	1	0	296.336	4.245	20	30		CIEDRO
CC[C@H]1CCC[C@@H]1[NH2+]Cc1ccc(C#N)cc1C(F)(F)F	ZINC000569177319	334859486	/nfs/dbraw/zinc/85/94/86/334859486.db2.gz	DHTIWRIZFQDUOB-WFASDCNBSA-N	1	0	296.336	4.245	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCc1ccc(F)cc1F)c1ccco1	ZINC000573116007	334909681	/nfs/dbraw/zinc/90/96/81/334909681.db2.gz	ADBABYNFBRMOCI-INIZCTEOSA-N	1	0	291.341	4.397	20	30		CIEDRO
C[C@@H]([NH2+]C1CCC2(CC2)CC1)c1ccc(C#N)c(F)c1	ZINC000576305625	335187572	/nfs/dbraw/zinc/18/75/72/335187572.db2.gz	JDDZOOJNZLDJRX-GFCCVEGCSA-N	1	0	272.367	4.071	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@H]1CCCc2ccc(OC)cc21	ZINC000343508073	335205852	/nfs/dbraw/zinc/20/58/52/335205852.db2.gz	PKFORGPHNAYNBS-YOEHRIQHSA-N	1	0	259.393	4.017	20	30		CIEDRO
CCc1ccc([C@H]2CCC[N@H+](Cc3ccc(C#N)o3)C2)cc1	ZINC000576502977	335212158	/nfs/dbraw/zinc/21/21/58/335212158.db2.gz	BIZRZUBRJUYSOZ-KRWDZBQOSA-N	1	0	294.398	4.093	20	30		CIEDRO
CC(C)C1CCC(CN(CCC#N)Cc2ccccn2)CC1	ZINC000576503807	335212210	/nfs/dbraw/zinc/21/22/10/335212210.db2.gz	KOMPMHWFRMGNCM-UHFFFAOYSA-N	1	0	299.462	4.260	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+]C[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000577028290	335284533	/nfs/dbraw/zinc/28/45/33/335284533.db2.gz	BPJUVQMQTBOKTI-UKRRQHHQSA-N	1	0	285.353	4.352	20	30		CIEDRO
Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@H]1CCc2ccc(C#N)cc21	ZINC000577108558	335301316	/nfs/dbraw/zinc/30/13/16/335301316.db2.gz	XXEOISPDSDNLKC-PMACEKPBSA-N	1	0	288.394	4.131	20	30		CIEDRO
C=CCC[NH2+][C@H](C)c1ccc(Oc2cccnc2)cc1	ZINC000577538278	335366246	/nfs/dbraw/zinc/36/62/46/335366246.db2.gz	JIKUBGUJXOSLAG-CQSZACIVSA-N	1	0	268.360	4.101	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H](C)c1ccccc1N(C)C	ZINC000577536572	335366251	/nfs/dbraw/zinc/36/62/51/335366251.db2.gz	GUJDRRVLFPNPKI-AWEZNQCLSA-N	1	0	260.425	4.006	20	30		CIEDRO
Cc1cccc(C2([NH2+]Cc3cc(C#N)cs3)CCCC2)c1	ZINC000177695419	335379465	/nfs/dbraw/zinc/37/94/65/335379465.db2.gz	HIWRJTDBZMYQCQ-UHFFFAOYSA-N	1	0	296.439	4.487	20	30		CIEDRO
N#Cc1ccc(C[NH2+]CC2CCCCC2)c(C(F)(F)F)c1	ZINC000578054374	335472639	/nfs/dbraw/zinc/47/26/39/335472639.db2.gz	VKHLTQXVPZFVTE-UHFFFAOYSA-N	1	0	296.336	4.247	20	30		CIEDRO
N#CCCC[NH2+][C@H](CCc1ccccc1)c1ccccc1	ZINC000180389694	335579339	/nfs/dbraw/zinc/57/93/39/335579339.db2.gz	ZEKDCMQDZHKANT-LJQANCHMSA-N	1	0	278.399	4.254	20	30		CIEDRO
C=C(CC)C[NH2+]C1(c2cccc(C(F)(F)F)c2)CC1	ZINC000578388103	335625170	/nfs/dbraw/zinc/62/51/70/335625170.db2.gz	NRMAIENOMMORPT-UHFFFAOYSA-N	1	0	269.310	4.250	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](C)c1ccc(OC)c(OC)c1	ZINC000180878166	335627802	/nfs/dbraw/zinc/62/78/02/335627802.db2.gz	GAEDKIQYVJLHLP-UONOGXRCSA-N	1	0	277.408	4.099	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)c1nc(-c2ccccc2)cs1	ZINC000180949606	335630684	/nfs/dbraw/zinc/63/06/84/335630684.db2.gz	YGKMNOGTCHEWKB-QWHCGFSZSA-N	1	0	272.417	4.425	20	30		CIEDRO
Cc1ccc([C@H](C)[NH2+]Cc2ccc(CC#N)cc2)c(C)c1	ZINC000578574639	335650370	/nfs/dbraw/zinc/65/03/70/335650370.db2.gz	UQLDMCONCABPMJ-INIZCTEOSA-N	1	0	278.399	4.220	20	30		CIEDRO
CC(C)CCOc1ccc([C@H](C)[NH2+]CCCC#N)cc1	ZINC000181740982	335781768	/nfs/dbraw/zinc/78/17/68/335781768.db2.gz	MNPNHNKPXLKQSL-HNNXBMFYSA-N	1	0	274.408	4.066	20	30		CIEDRO
C[C@@H](C[NH2+][C@H](C)c1ccc(C#N)cc1)Cc1cccs1	ZINC000181817275	335786622	/nfs/dbraw/zinc/78/66/22/335786622.db2.gz	CUOSKHCGXGPHJT-ZIAGYGMSSA-N	1	0	284.428	4.149	20	30		CIEDRO
C[C@@H](C[NH2+][C@@H](C)c1ccc(C#N)cc1)Cc1cccs1	ZINC000181817237	335786698	/nfs/dbraw/zinc/78/66/98/335786698.db2.gz	CUOSKHCGXGPHJT-KGLIPLIRSA-N	1	0	284.428	4.149	20	30		CIEDRO
Cc1cc(C)c(C[NH2+][C@H](C)c2cccc(C#N)c2)c(C)c1	ZINC000181985594	335793502	/nfs/dbraw/zinc/79/35/02/335793502.db2.gz	UXSDSIRERUUHGW-MRXNPFEDSA-N	1	0	278.399	4.334	20	30		CIEDRO
CC(C)C1CCC(C[NH+]2CCC(C)(C#N)CC2)CC1	ZINC000579646135	335832438	/nfs/dbraw/zinc/83/24/38/335832438.db2.gz	OERAJMPZNNWEQO-UHFFFAOYSA-N	1	0	262.441	4.074	20	30		CIEDRO
COc1ccc(C#N)cc1C[NH2+][C@H](C)c1cc(C)cc(C)c1	ZINC000182889808	335848947	/nfs/dbraw/zinc/84/89/47/335848947.db2.gz	QYYIZHITMLFVTG-OAHLLOKOSA-N	1	0	294.398	4.035	20	30		CIEDRO
CC[C@H](CC#N)[NH2+]Cc1ccc(-c2cccc(F)c2)s1	ZINC000184085062	335917583	/nfs/dbraw/zinc/91/75/83/335917583.db2.gz	RPGFDUVJDOAMBF-CQSZACIVSA-N	1	0	288.391	4.336	20	30		CIEDRO
Cc1cc(C)c([C@@H](C)[N@H+](C)CC(C)(C)C#N)c(C)c1	ZINC000581049373	336000841	/nfs/dbraw/zinc/00/08/41/336000841.db2.gz	QSFMKAWSNFXOGY-OAHLLOKOSA-N	1	0	258.409	4.154	20	30		CIEDRO
Cc1ccc([C@H](C)[NH2+][C@@H]2CCc3ccc(C#N)cc32)cc1	ZINC000581160751	336017129	/nfs/dbraw/zinc/01/71/29/336017129.db2.gz	JMEFOHPNRYQPAR-IFXJQAMLSA-N	1	0	276.383	4.205	20	30		CIEDRO
C=CCCC[NH2+][C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000381124976	336050987	/nfs/dbraw/zinc/05/09/87/336050987.db2.gz	ZGFUDYILWTTXQE-LLVKDONJSA-N	1	0	257.299	4.322	20	30		CIEDRO
C=CCC[NH2+]C1(c2c(Cl)cccc2Cl)CC1	ZINC000381496755	336066661	/nfs/dbraw/zinc/06/66/61/336066661.db2.gz	BIKZGRMWKNGBCX-UHFFFAOYSA-N	1	0	256.176	4.148	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]C2(CC)CCCC2)cc1	ZINC000382563196	336093827	/nfs/dbraw/zinc/09/38/27/336093827.db2.gz	MJLZMXCFQYTREX-UHFFFAOYSA-N	1	0	259.393	4.064	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccc(Cl)c(F)c1	ZINC000581530656	336095773	/nfs/dbraw/zinc/09/57/73/336095773.db2.gz	LEICWWFHFFBSST-MDZLAQPJSA-N	1	0	280.774	4.212	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([N@@H+]2CCCC3(C2)CCCCCC3)C1	ZINC000581595878	336109054	/nfs/dbraw/zinc/10/90/54/336109054.db2.gz	ACCGXJLUAUCNQU-CVEARBPZSA-N	1	0	260.425	4.115	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1ccccc1C(F)(F)F	ZINC000386782999	336179260	/nfs/dbraw/zinc/17/92/60/336179260.db2.gz	MRNYWQALMQZKHI-NSHDSACASA-N	1	0	257.299	4.322	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)CCC2)c1ccc(C#N)cc1	ZINC000387245213	336190447	/nfs/dbraw/zinc/19/04/47/336190447.db2.gz	BVAUYUZVPOFLBK-CABCVRRESA-N	1	0	290.410	4.459	20	30		CIEDRO
C[C@H]([NH2+]C1CC(c2cccc(F)c2)C1)c1ccc(C#N)cc1	ZINC000387266209	336190853	/nfs/dbraw/zinc/19/08/53/336190853.db2.gz	GKDXGYXZIBQIJU-LJSZUPLFSA-N	1	0	294.373	4.294	20	30		CIEDRO
CCCC[C@H]([NH2+]CC1(CC#N)CC1)c1ccccc1	ZINC000430764918	517573510	/nfs/dbraw/zinc/57/35/10/517573510.db2.gz	UOFRNRMIKRJWPK-INIZCTEOSA-N	1	0	256.393	4.201	20	30		CIEDRO
CC[C@H](C)C[C@@H](C)[NH2+][C@H](C)c1ccc(C#N)c(F)c1	ZINC000539608469	517799210	/nfs/dbraw/zinc/79/92/10/517799210.db2.gz	MMIRGAKQHGBURD-YNEHKIRRSA-N	1	0	262.372	4.173	20	30		CIEDRO
CC(C)Oc1cccc([C@@H](C)[NH2+]Cc2ccc(C#N)cc2)c1	ZINC000078974678	519783440	/nfs/dbraw/zinc/78/34/40/519783440.db2.gz	JMCUSFJGHFDFKT-OAHLLOKOSA-N	1	0	294.398	4.196	20	30		CIEDRO
CC(F)(F)c1ccc(C[NH2+]Cc2cc(C#N)cs2)cc1	ZINC000339419187	520169622	/nfs/dbraw/zinc/16/96/22/520169622.db2.gz	UYYMBJAEDAZSNV-UHFFFAOYSA-N	1	0	292.354	4.021	20	30		CIEDRO
CC[C@H]([NH2+]C[C@@H](C)c1nc(C)cs1)c1ccc(C#N)cc1	ZINC000278371487	522611569	/nfs/dbraw/zinc/61/15/69/522611569.db2.gz	CFTKXGWAJUTNNT-WBMJQRKESA-N	1	0	299.443	4.168	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(C)c(OC)c1)c1ccc(C#N)cc1	ZINC000278879675	522645258	/nfs/dbraw/zinc/64/52/58/522645258.db2.gz	XRLFFHMRXXGXPR-SFHVURJKSA-N	1	0	294.398	4.116	20	30		CIEDRO
CC[C@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000036991919	522695331	/nfs/dbraw/zinc/69/53/31/522695331.db2.gz	MEWWPBKVAVUHQE-UGSOOPFHSA-N	1	0	282.362	4.499	20	30		CIEDRO
CC[C@@H]([NH2+]C1(c2cccc(F)c2)CC1)c1ccc(C#N)cc1	ZINC000278633876	522808809	/nfs/dbraw/zinc/80/88/09/522808809.db2.gz	HETXQVNSHDMYOW-GOSISDBHSA-N	1	0	294.373	4.427	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccc(C#N)cc1)C1CCCCC1	ZINC000052335211	522871093	/nfs/dbraw/zinc/87/10/93/522871093.db2.gz	MWQVAKWASXPVMU-QGZVFWFLSA-N	1	0	256.393	4.007	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccc(C#N)o1)c1ccc(Cl)s1	ZINC000266168055	522871332	/nfs/dbraw/zinc/87/13/32/522871332.db2.gz	BIEZNALZDLXXIJ-LLVKDONJSA-N	1	0	280.780	4.107	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccc(C)c(OC)c1)c1ccc(C#N)cc1	ZINC000278877774	522875456	/nfs/dbraw/zinc/87/54/56/522875456.db2.gz	XRLFFHMRXXGXPR-GOSISDBHSA-N	1	0	294.398	4.116	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccc(C)cc1)c1ccc(C#N)cc1	ZINC000278168245	522875888	/nfs/dbraw/zinc/87/58/88/522875888.db2.gz	CDGAQSDEEOACBP-GOSISDBHSA-N	1	0	264.372	4.108	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)c1ccc(OC)cc1	ZINC000121842759	522911496	/nfs/dbraw/zinc/91/14/96/522911496.db2.gz	TUGRDTRMWZIMMU-IFXJQAMLSA-N	1	0	294.398	4.369	20	30		CIEDRO
COc1ccc([C@@H]([NH2+]Cc2ccc(C#N)cc2)C(C)C)cc1	ZINC000052661572	525203045	/nfs/dbraw/zinc/20/30/45/525203045.db2.gz	SCMZHMRUDYBFBG-IBGZPJMESA-N	1	0	294.398	4.054	20	30		CIEDRO
C[C@H]([NH2+]Cc1cc(C#N)ccc1F)c1cccc(C2CC2)c1	ZINC000294851728	525430642	/nfs/dbraw/zinc/43/06/42/525430642.db2.gz	SMMXPGAIAVVZFG-ZDUSSCGKSA-N	1	0	294.373	4.426	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1)c1ccc(C#N)cc1	ZINC000035256424	525449662	/nfs/dbraw/zinc/44/96/62/525449662.db2.gz	GVTUZJOBGUOVIL-GDZNZVCISA-N	1	0	280.371	4.125	20	30		CIEDRO
C[C@@H]([NH2+]C[C@@H]1CCCCC1(F)F)c1ccc(C#N)cc1	ZINC000294341922	525480485	/nfs/dbraw/zinc/48/04/85/525480485.db2.gz	YMDHBTRTRIBPCF-DOMZBBRYSA-N	1	0	278.346	4.034	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCCc2cc(C#N)ccc21)c1ccsc1	ZINC000338020327	525681473	/nfs/dbraw/zinc/68/14/73/525681473.db2.gz	YHNYPERWSUVQOX-PXAZEXFGSA-N	1	0	282.412	4.348	20	30		CIEDRO
Cc1ccc([C@H](C)[NH2+]Cc2ccc(C#N)cc2)cc1C	ZINC000037748310	525928540	/nfs/dbraw/zinc/92/85/40/525928540.db2.gz	RVDTVZJIPLSAKT-HNNXBMFYSA-N	1	0	264.372	4.026	20	30		CIEDRO
CSc1ccccc1[C@H](C)[NH2+]Cc1ccc(C#N)s1	ZINC000282289290	526193392	/nfs/dbraw/zinc/19/33/92/526193392.db2.gz	IUPMCSJVPYPCDA-NSHDSACASA-N	1	0	288.441	4.192	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](CCCCOC)c1ccccc1	ZINC000352403971	526455900	/nfs/dbraw/zinc/45/59/00/526455900.db2.gz	ZXAWZRWVSFNEEL-KRWDZBQOSA-N	1	0	261.409	4.100	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@H](CCC(C)C)c1ccoc1	ZINC000353589429	526783396	/nfs/dbraw/zinc/78/33/96/526783396.db2.gz	GISLZIFSAVROFQ-NXHRZFHOSA-N	1	0	291.435	4.328	20	30		CIEDRO
C=C(C[NH2+]C1CCC2(CCOCC2)CC1)c1ccccc1	ZINC000343759154	526882103	/nfs/dbraw/zinc/88/21/03/526882103.db2.gz	HKSHAHJZYOOYHI-UHFFFAOYSA-N	1	0	285.431	4.029	20	30		CIEDRO
C=C(C[NH2+][C@H]1CCCNc2ccccc21)c1ccccc1	ZINC000347836455	526882596	/nfs/dbraw/zinc/88/25/96/526882596.db2.gz	YYTUQLCZYCGJGK-IBGZPJMESA-N	1	0	278.399	4.236	20	30		CIEDRO
C=CCCC[N@@H+](C)Cc1ccccc1OCc1ccncc1	ZINC000353739807	527191906	/nfs/dbraw/zinc/19/19/06/527191906.db2.gz	OFXYJMDHGYZANG-UHFFFAOYSA-N	1	0	296.414	4.059	20	30		CIEDRO
C=CCCOCC[NH2+][C@@H](CC1CCC1)c1ccccc1	ZINC000344340763	527367516	/nfs/dbraw/zinc/36/75/16/527367516.db2.gz	YYYKHNKARVQEAX-SFHVURJKSA-N	1	0	273.420	4.100	20	30		CIEDRO
CC(C)[C@H](c1ccccc1Cl)[N@H+](C)CCCC#N	ZINC000354553948	527752433	/nfs/dbraw/zinc/75/24/33/527752433.db2.gz	ODFJNZZFIREXNS-OAHLLOKOSA-N	1	0	264.800	4.273	20	30		CIEDRO
CCO[C@@H]1C[C@H]([NH2+]CC(C)(C)CCC#N)C12CCCCC2	ZINC000348227006	527936232	/nfs/dbraw/zinc/93/62/32/527936232.db2.gz	MYARLASOUULLPY-JKSUJKDBSA-N	1	0	292.467	4.034	20	30		CIEDRO
CC[NH+](CC)Cc1cccc(CNc2ccc(C#N)cc2)c1	ZINC000301109833	528195811	/nfs/dbraw/zinc/19/58/11/528195811.db2.gz	URGGZLHTPKEEBW-UHFFFAOYSA-N	1	0	293.414	4.012	20	30		CIEDRO
CC[NH+](CC)Cc1ccccc1CNc1ccc(C#N)cc1	ZINC000301073040	528200055	/nfs/dbraw/zinc/20/00/55/528200055.db2.gz	GLKRNNBQRUMZHM-UHFFFAOYSA-N	1	0	293.414	4.012	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@@H]2CCSc3ccccc32)CC1	ZINC000336224036	528832905	/nfs/dbraw/zinc/83/29/05/528832905.db2.gz	CFESZOQAKRUIDA-GNHJJJEISA-N	1	0	286.444	4.286	20	30		CIEDRO
CC[C@@H]([NH2+]CCCC#N)c1ccc2cc(OC)ccc2c1	ZINC000346811697	529160250	/nfs/dbraw/zinc/16/02/50/529160250.db2.gz	VBOCWGDWYMGSLU-GOSISDBHSA-N	1	0	282.387	4.193	20	30		CIEDRO
CC[C@H](CC#N)[NH2+][C@@H](C)C1CCC(C(F)(F)F)CC1	ZINC000354649728	529301234	/nfs/dbraw/zinc/30/12/34/529301234.db2.gz	OCEXWBXUYXMHQU-YWPUVAFDSA-N	1	0	276.346	4.025	20	30		CIEDRO
CC[C@@H](CC#N)[NH2+][C@H](C)C1CCC(C(F)(F)F)CC1	ZINC000354649727	529448500	/nfs/dbraw/zinc/44/85/00/529448500.db2.gz	OCEXWBXUYXMHQU-XVSSEFHLSA-N	1	0	276.346	4.025	20	30		CIEDRO
CC(C)(C)[C@@H]1CCC[N@H+](CCCC(C)(C)C#N)CC1	ZINC000087608785	260192620	/nfs/dbraw/zinc/19/26/20/260192620.db2.gz	BDKULMZPBCGMMN-OAHLLOKOSA-N	1	0	264.457	4.465	20	30		CIEDRO
C[C@@H](c1ccc(C#N)cc1)[N@H+](C)Cc1ccc(F)c(F)c1	ZINC000122875120	187057217	/nfs/dbraw/zinc/05/72/17/187057217.db2.gz	JBQUGUHZLUPZSU-LBPRGKRZSA-N	1	0	286.325	4.029	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H]1C[C@H](C)Sc2sccc21	ZINC000161680721	261119176	/nfs/dbraw/zinc/11/91/76/261119176.db2.gz	LLLUPSMTBVFYNS-JBLDHEPKSA-N	1	0	253.436	4.228	20	30		CIEDRO
N#CCc1ccc(C[NH2+]Cc2ccc(C3CCC3)cc2)cc1	ZINC000574453449	335020972	/nfs/dbraw/zinc/02/09/72/335020972.db2.gz	ZUPAUBILERQOTE-UHFFFAOYSA-N	1	0	290.410	4.310	20	30		CIEDRO
C=CCCCC[NH2+][C@@H](C)c1cnc2ccsc2c1	ZINC000310997050	262186611	/nfs/dbraw/zinc/18/66/11/262186611.db2.gz	IWNNJAODRBGOFH-LBPRGKRZSA-N	1	0	260.406	4.303	20	30		CIEDRO
CC(C)(C#N)CCCC[N@@H+]1CCC[C@H]1c1ccco1	ZINC000365441334	262365554	/nfs/dbraw/zinc/36/55/54/262365554.db2.gz	GDDJOCVDEOJONK-AWEZNQCLSA-N	1	0	260.381	4.137	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCCC[C@@H]2C(F)(F)F)C1	ZINC000447583196	260063732	/nfs/dbraw/zinc/06/37/32/260063732.db2.gz	AWQVZXFZQAYPIS-RFGFWPKPSA-N	1	0	288.357	4.027	20	30		CIEDRO
C[C@@H]([NH2+]C1CCC(C)(C#N)CC1)c1c(F)cccc1F	ZINC000336229157	533338006	/nfs/dbraw/zinc/33/80/06/533338006.db2.gz	ZEYZQRYITDESGX-OPGSHWCFSA-N	1	0	278.346	4.088	20	30		CIEDRO
C[C@@H]([NH2+]C[C@H](C#N)CCC#N)c1ccc(F)c2ccccc21	ZINC000352270374	533426981	/nfs/dbraw/zinc/42/69/81/533426981.db2.gz	FVIFHFQHYHMZHF-KGLIPLIRSA-N	1	0	295.361	4.073	20	30		CIEDRO
Cc1cc(C[NH2+][C@H]2CCCc3cc(C#N)ccc32)ccc1F	ZINC000341758484	130025600	/nfs/dbraw/zinc/02/56/00/130025600.db2.gz	PTRRQSXRIUQTFK-IBGZPJMESA-N	1	0	294.373	4.173	20	30		CIEDRO
N#Cc1ccc2c(c1)CCC[C@@H]2[NH2+][C@H]1CCCc2occc21	ZINC000341759953	130026785	/nfs/dbraw/zinc/02/67/85/130026785.db2.gz	JJARLTMNMKEUFJ-ROUUACIJSA-N	1	0	292.382	4.196	20	30		CIEDRO
Cc1ccccc1C[NH2+][C@H]1CCCc2cc(C#N)ccc21	ZINC000341760813	130027011	/nfs/dbraw/zinc/02/70/11/130027011.db2.gz	MIEBWTDYAVXGAB-IBGZPJMESA-N	1	0	276.383	4.034	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCCc2cc(C#N)ccc21)c1cccs1	ZINC000341763460	130029256	/nfs/dbraw/zinc/02/92/56/130029256.db2.gz	YVKIKRQELPPGNC-WBMJQRKESA-N	1	0	282.412	4.348	20	30		CIEDRO
C[C@@H]([NH2+]CCC1=CCCCC1)c1ccc(C#N)cc1	ZINC000020093655	170992562	/nfs/dbraw/zinc/99/25/62/170992562.db2.gz	JLWJNOLKLAGTOT-CQSZACIVSA-N	1	0	254.377	4.099	20	30		CIEDRO
C[C@@H]([NH2+][C@H](C)c1cccc(F)c1)c1ccc(C#N)cc1	ZINC000020147842	171035115	/nfs/dbraw/zinc/03/51/15/171035115.db2.gz	ZVWSNNKEEDGEJV-CHWSQXEVSA-N	1	0	268.335	4.109	20	30		CIEDRO
C[C@@H]([NH2+][C@H](C)c1ccc(C#N)cc1)c1cccs1	ZINC000020148257	171036056	/nfs/dbraw/zinc/03/60/56/171036056.db2.gz	LGCNLTREJSCQLD-VXGBXAGGSA-N	1	0	256.374	4.032	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@H](C)c1ccc(F)cc1	ZINC000034992041	171918978	/nfs/dbraw/zinc/91/89/78/171918978.db2.gz	DYDXSTLEDLRZEQ-CQSZACIVSA-N	1	0	285.362	4.241	20	30		CIEDRO
CC(C)(C)[C@@H]([NH2+]Cc1cccc(C#N)c1)c1ccccc1	ZINC000035255434	172085723	/nfs/dbraw/zinc/08/57/23/172085723.db2.gz	QNZKEQYACPMERD-SFHVURJKSA-N	1	0	278.399	4.435	20	30		CIEDRO
CCc1ccc([C@@H](C)[NH2+]Cc2ccc(C#N)cc2F)cc1	ZINC000037980177	173938535	/nfs/dbraw/zinc/93/85/35/173938535.db2.gz	RURUWUDDGROQHP-CYBMUJFWSA-N	1	0	282.362	4.111	20	30		CIEDRO
N#CC1(C[NH2+][C@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000343576108	224802033	/nfs/dbraw/zinc/80/20/33/224802033.db2.gz	BFYVYTJXDACPBS-LJQANCHMSA-N	1	0	290.410	4.254	20	30		CIEDRO
N#Cc1cc(C[N@@H+](Cc2cccc(F)c2)C2CC2)ccc1F	ZINC000344357058	225041525	/nfs/dbraw/zinc/04/15/25/225041525.db2.gz	SSVWXCQHIWWZOO-UHFFFAOYSA-N	1	0	298.336	4.001	20	30		CIEDRO
N#Cc1cc(C[N@@H+]2CCC[C@]3(CC=CCC3)C2)ccc1F	ZINC000344414998	225051538	/nfs/dbraw/zinc/05/15/38/225051538.db2.gz	UDWHHGNQDVHPRX-GOSISDBHSA-N	1	0	284.378	4.020	20	30		CIEDRO
Cc1cccc([C@@H]2CCCCC[N@@H+]2CCCC#N)c1	ZINC000344506167	225086421	/nfs/dbraw/zinc/08/64/21/225086421.db2.gz	WEUROMDOWBWJJW-KRWDZBQOSA-N	1	0	256.393	4.216	20	30		CIEDRO
N#Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(Cl)s1)CC2	ZINC000334842024	225333895	/nfs/dbraw/zinc/33/38/95/225333895.db2.gz	NDELPLOTZYQUTG-AWEZNQCLSA-N	1	0	288.803	4.050	20	30		CIEDRO
COCCCC[C@H]([NH2+]CCC(C)(C)C#N)c1ccccc1	ZINC000347075220	226016123	/nfs/dbraw/zinc/01/61/23/226016123.db2.gz	GTMTVZWFKDYYSG-KRWDZBQOSA-N	1	0	288.435	4.074	20	30		CIEDRO
N#CCCC[C@H]([NH2+]Cc1ccccc1F)c1ccccc1	ZINC000353910885	226241270	/nfs/dbraw/zinc/24/12/70/226241270.db2.gz	AQEIZXJLTLYEGA-SFHVURJKSA-N	1	0	282.362	4.350	20	30		CIEDRO
Cc1ccc([C@@H]([NH2+]CC(C)(C)CCC#N)C2CCC2)o1	ZINC000348220811	226425844	/nfs/dbraw/zinc/42/58/44/226425844.db2.gz	FLSZBEKNFLNXLE-INIZCTEOSA-N	1	0	274.408	4.349	20	30		CIEDRO
C[C@H]([NH2+]CC(C)(C)CCC#N)c1ccc2c(c1)CCC2	ZINC000348207274	226432240	/nfs/dbraw/zinc/43/22/40/226432240.db2.gz	OQNCQORBCJVNIR-AWEZNQCLSA-N	1	0	270.420	4.156	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CC1(CCO)CCCCC1)c1ccco1	ZINC000575163304	335074131	/nfs/dbraw/zinc/07/41/31/335074131.db2.gz	JVJCMRHHFQMJMQ-MRXNPFEDSA-N	1	0	291.435	4.209	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H]1CCCc2c3cc(C)ccc3[nH]c21	ZINC000575166096	335074364	/nfs/dbraw/zinc/07/43/64/335074364.db2.gz	XISVBNLYCNPBDV-SUMWQHHRSA-N	1	0	268.404	4.408	20	30		CIEDRO
CC[C@H](Cc1ccccc1)[NH2+][C@H]1CCc2ccc(C#N)cc21	ZINC000575167891	335074388	/nfs/dbraw/zinc/07/43/88/335074388.db2.gz	XKEHMDCIXMPDAD-QUCCMNQESA-N	1	0	290.410	4.156	20	30		CIEDRO
C[C@H]1CCCCC[N@@H+]1Cc1cccc(OCCCC#N)c1	ZINC000353494008	228110163	/nfs/dbraw/zinc/11/01/63/228110163.db2.gz	XLWSJJMCGLAEAS-INIZCTEOSA-N	1	0	286.419	4.134	20	30		CIEDRO
C[C@@H]([NH2+]CC(C)(C)CCC#N)c1nccc2ccccc21	ZINC000353643566	228137669	/nfs/dbraw/zinc/13/76/69/228137669.db2.gz	WXOHDNLRAGQJBN-CQSZACIVSA-N	1	0	281.403	4.215	20	30		CIEDRO
C[C@H]([NH2+]CC(C)(C)CCC#N)c1nccc2ccccc21	ZINC000353643565	228137866	/nfs/dbraw/zinc/13/78/66/228137866.db2.gz	WXOHDNLRAGQJBN-AWEZNQCLSA-N	1	0	281.403	4.215	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+]C(c2ccccc2)c2ccccc2)C1	ZINC000192588640	228153297	/nfs/dbraw/zinc/15/32/97/228153297.db2.gz	DSSNWSLCAFSWKJ-APWZRJJASA-N	1	0	290.410	4.448	20	30		CIEDRO
CC[C@@H]1CCC[C@H]1[NH2+][C@@H]1CCCc2cc(C#N)ccc21	ZINC000520858343	260031607	/nfs/dbraw/zinc/03/16/07/260031607.db2.gz	AEZPZMZVWZQHSA-ZTFGCOKTSA-N	1	0	268.404	4.104	20	30		CIEDRO
CCO[C@H](CC[NH2+][C@@H](CC)c1ccc(C#N)cc1)C(C)C	ZINC000447531758	260037030	/nfs/dbraw/zinc/03/70/30/260037030.db2.gz	QVRKEQZBSYTOGJ-ZWKOTPCHSA-N	1	0	288.435	4.050	20	30		CIEDRO
CCC[C@H](CC)[NH2+]Cc1ccc(C#N)cc1C(F)(F)F	ZINC000521321879	260043731	/nfs/dbraw/zinc/04/37/31/260043731.db2.gz	MODMVORGKWUPKB-ZDUSSCGKSA-N	1	0	284.325	4.245	20	30		CIEDRO
CCC[C@@H](CC)[NH2+]Cc1ccc(C#N)cc1C(F)(F)F	ZINC000521321878	260044145	/nfs/dbraw/zinc/04/41/45/260044145.db2.gz	MODMVORGKWUPKB-CYBMUJFWSA-N	1	0	284.325	4.245	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCSc2ccccc21)c1cccc(C#N)c1	ZINC000037316087	260085165	/nfs/dbraw/zinc/08/51/65/260085165.db2.gz	JNSGJPCVKLXRJH-GUYCJALGSA-N	1	0	294.423	4.446	20	30		CIEDRO
Cc1cccc(C2=CC[N@H+](CC(C)(C)CCC#N)CC2)c1	ZINC000180780482	260110171	/nfs/dbraw/zinc/11/01/71/260110171.db2.gz	NIXRLKNDVQTULR-UHFFFAOYSA-N	1	0	282.431	4.414	20	30		CIEDRO
CC(C)Oc1ccc([C@H](C)[NH2+]Cc2cccc(C#N)c2)cc1	ZINC000078486376	260167925	/nfs/dbraw/zinc/16/79/25/260167925.db2.gz	JEHQGOCDUPOCRY-HNNXBMFYSA-N	1	0	294.398	4.196	20	30		CIEDRO
CC[NH+](CC)Cc1cccc(NCc2ccc(C#N)cc2)c1	ZINC000078993909	260173555	/nfs/dbraw/zinc/17/35/55/260173555.db2.gz	VDWRXCJOHINASY-UHFFFAOYSA-N	1	0	293.414	4.012	20	30		CIEDRO
CCCC[C@H]1CCC[C@@H]1[NH2+]C1CCC(C)(C#N)CC1	ZINC000449119095	260230188	/nfs/dbraw/zinc/23/01/88/260230188.db2.gz	WIIZJXFACVPSEL-SOEBMCCKSA-N	1	0	262.441	4.407	20	30		CIEDRO
C=CC[N@@H+](Cc1cc(Cl)cc2cccnc21)C1CC1	ZINC000357557707	260230658	/nfs/dbraw/zinc/23/06/58/260230658.db2.gz	ZITDVXIVLZINEU-UHFFFAOYSA-N	1	0	272.779	4.039	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H](C)c1ccc(OC)cc1F	ZINC000311920333	260259359	/nfs/dbraw/zinc/25/93/59/260259359.db2.gz	SICGNUODNVRKSX-LBPRGKRZSA-N	1	0	265.372	4.087	20	30		CIEDRO
CC[C@@H]([NH2+]C1CCC(C)(C#N)CC1)c1cc(F)ccc1F	ZINC000449156513	260260232	/nfs/dbraw/zinc/26/02/32/260260232.db2.gz	DSPRRXJWSJGVLP-BLDCVEFLSA-N	1	0	292.373	4.478	20	30		CIEDRO
Cc1ccc(C[C@@H](C)[NH2+]C2CCC(C)(C#N)CC2)s1	ZINC000449161296	260263680	/nfs/dbraw/zinc/26/36/80/260263680.db2.gz	OHOAJZSTWWZABH-XEBKBJJBSA-N	1	0	276.449	4.050	20	30		CIEDRO
N#CCSCCC[NH2+]C(c1ccccc1)c1ccccc1	ZINC000072513282	260276546	/nfs/dbraw/zinc/27/65/46/260276546.db2.gz	UKBLAXZWLLWQFR-UHFFFAOYSA-N	1	0	296.439	4.012	20	30		CIEDRO
C[C@@H](c1cccs1)[N@H+](C)CCCCC(C)(C)C#N	ZINC000235467228	260281072	/nfs/dbraw/zinc/28/10/72/260281072.db2.gz	BQCRJIRFJQVUHH-ZDUSSCGKSA-N	1	0	264.438	4.461	20	30		CIEDRO
Cc1oc2ccccc2c1C[NH2+]C1CCC(C)(C#N)CC1	ZINC000449254321	260318623	/nfs/dbraw/zinc/31/86/23/260318623.db2.gz	XQHNPFUTBVFWIO-UHFFFAOYSA-N	1	0	282.387	4.303	20	30		CIEDRO
COc1c2ccccc2oc1C[NH2+]C1CCC(C)(C#N)CC1	ZINC000449280613	260349459	/nfs/dbraw/zinc/34/94/59/260349459.db2.gz	XZVLYWIVQUVSFC-UHFFFAOYSA-N	1	0	298.386	4.003	20	30		CIEDRO
C[C@H]([NH2+]CCCC1CCCC1)c1cccc(C#N)c1	ZINC000223730788	260357670	/nfs/dbraw/zinc/35/76/70/260357670.db2.gz	BULGHFYPXJDGCS-AWEZNQCLSA-N	1	0	256.393	4.179	20	30		CIEDRO
N#CCCCC[NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CC1	ZINC000091319645	260474030	/nfs/dbraw/zinc/47/40/30/260474030.db2.gz	YNGSZYKVWUUZRT-OAHLLOKOSA-N	1	0	296.336	4.440	20	30		CIEDRO
C=C[C@H](C)[NH2+][C@@H](CC)c1ccc(OCC)c(OCC)c1	ZINC000358316987	260636203	/nfs/dbraw/zinc/63/62/03/260636203.db2.gz	JKLGXBYKLLUPGR-ZFWWWQNUSA-N	1	0	277.408	4.099	20	30		CIEDRO
N#CCCCC[NH2+][C@@H](c1ccccc1)c1ccc(F)cc1	ZINC000109790431	260643761	/nfs/dbraw/zinc/64/37/61/260643761.db2.gz	CDDPBIYXHNMRJW-SFHVURJKSA-N	1	0	282.362	4.199	20	30		CIEDRO
C[C@H]1C[N@H+](Cc2ccc(C#N)cc2)CC[C@@H]1c1ccccc1	ZINC000525636618	260725222	/nfs/dbraw/zinc/72/52/22/260725222.db2.gz	FHNPPQWDLZXVDX-JXFKEZNVSA-N	1	0	290.410	4.184	20	30		CIEDRO
CCc1nc(C)c(C[N@@H+](CC)[C@H](C)c2ccc(C#N)cc2)o1	ZINC000428448192	260731574	/nfs/dbraw/zinc/73/15/74/260731574.db2.gz	QQUGHRXRUQCJFL-CQSZACIVSA-N	1	0	297.402	4.000	20	30		CIEDRO
CC(C)(C#N)CCCC[N@@H+]1CC[C@](C)(c2ccccc2)C1	ZINC000444640157	261056025	/nfs/dbraw/zinc/05/60/25/261056025.db2.gz	BINQIWUIUGGRGK-IBGZPJMESA-N	1	0	284.447	4.370	20	30		CIEDRO
COc1ccc([C@H](C)[NH2+]CCCCC(C)(C)C#N)cc1F	ZINC000444670324	261061305	/nfs/dbraw/zinc/06/13/05/261061305.db2.gz	AUNUJKBHROWSJK-ZDUSSCGKSA-N	1	0	292.398	4.205	20	30		CIEDRO
C[C@@H]1C[N@H+](CCCCC(C)(C)C#N)[C@H]2CCCC[C@@H]12	ZINC000444687132	261066591	/nfs/dbraw/zinc/06/65/91/261066591.db2.gz	ZVQYAEGBZLRPHZ-PMPSAXMXSA-N	1	0	262.441	4.217	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H]1C[C@H](C)Sc2sccc21	ZINC000161680855	261119091	/nfs/dbraw/zinc/11/90/91/261119091.db2.gz	LLLUPSMTBVFYNS-SCVCMEIPSA-N	1	0	253.436	4.228	20	30		CIEDRO
C[C@@H]([NH2+]Cc1cccc(OCCCC#N)c1)C1CCCC1	ZINC000172173747	261151973	/nfs/dbraw/zinc/15/19/73/261151973.db2.gz	PIWFSLRSNCYSHN-OAHLLOKOSA-N	1	0	286.419	4.037	20	30		CIEDRO
C=CCC[C@@H](O)C[N@@H+]1CCCC[C@H]1c1cccc(Cl)c1	ZINC000444807444	261182485	/nfs/dbraw/zinc/18/24/85/261182485.db2.gz	WQXWOGTVTMJSHZ-SJORKVTESA-N	1	0	293.838	4.194	20	30		CIEDRO
N#CCCCC[N@H+](C1CC1)[C@@H]1CCCc2ccccc21	ZINC000102397863	261232412	/nfs/dbraw/zinc/23/24/12/261232412.db2.gz	NKQCNNNDMSWODI-GOSISDBHSA-N	1	0	268.404	4.222	20	30		CIEDRO
CCC[C@@H]([NH2+]Cc1ccccc1C#N)c1ccccc1	ZINC000182333356	261440220	/nfs/dbraw/zinc/44/02/20/261440220.db2.gz	PPKCXNKBIZGJOA-GOSISDBHSA-N	1	0	264.372	4.189	20	30		CIEDRO
Cc1nc2c(s1)[C@H]([N@H+](C)CCCC(C)(C)C#N)CCC2	ZINC000174858046	261586872	/nfs/dbraw/zinc/58/68/72/261586872.db2.gz	LIKNHTXJCIRGHG-CQSZACIVSA-N	1	0	291.464	4.091	20	30		CIEDRO
COc1ccc([C@@H]([NH2+]CCCCC#N)c2ccccc2)cc1	ZINC000182382335	261936242	/nfs/dbraw/zinc/93/62/42/261936242.db2.gz	ZXCIQHIZRWTGHB-IBGZPJMESA-N	1	0	294.398	4.068	20	30		CIEDRO
CCC[N@H+](CCCC(C)(C)C#N)CCc1cccs1	ZINC000184507388	262021085	/nfs/dbraw/zinc/02/10/85/262021085.db2.gz	LPLMWSHQQFINLA-UHFFFAOYSA-N	1	0	278.465	4.333	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+][C@H]2CCSc3c(F)cccc32)C1	ZINC000185771822	262069970	/nfs/dbraw/zinc/06/99/70/262069970.db2.gz	NUEPCBPISCEVFQ-ZOWXZIJZSA-N	1	0	290.407	4.035	20	30		CIEDRO
Cc1ccc(O)c([C@H](C)[NH2+][C@@H](CCC#N)c2ccccc2)c1	ZINC000186150598	262082121	/nfs/dbraw/zinc/08/21/21/262082121.db2.gz	KAUQQMCTCDCRLL-YJBOKZPZSA-N	1	0	294.398	4.396	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCc1ccc(F)cc1)c1ccco1	ZINC000514085101	262152151	/nfs/dbraw/zinc/15/21/51/262152151.db2.gz	SZEVZJHZJLEQFV-MRXNPFEDSA-N	1	0	273.351	4.258	20	30		CIEDRO
CC[N@H+](Cc1ccc(F)cc1)[C@@H](C)c1ccc(C#N)cc1	ZINC000497594454	262178712	/nfs/dbraw/zinc/17/87/12/262178712.db2.gz	YWEBVTCTJQZYMZ-AWEZNQCLSA-N	1	0	282.362	4.280	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1ccc(F)c(Br)c1	ZINC000390430108	262191970	/nfs/dbraw/zinc/19/19/70/262191970.db2.gz	OWOQZDXQAKTJNJ-NSHDSACASA-N	1	0	286.188	4.033	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1ccc(F)c(Br)c1	ZINC000390430107	262192103	/nfs/dbraw/zinc/19/21/03/262192103.db2.gz	OWOQZDXQAKTJNJ-LLVKDONJSA-N	1	0	286.188	4.033	20	30		CIEDRO
C[C@H]([NH2+]CC1CCC(F)(F)CC1)c1ccc(C#N)cc1F	ZINC000503941553	262193929	/nfs/dbraw/zinc/19/39/29/262193929.db2.gz	JXMKKRRQJQBLBL-NSHDSACASA-N	1	0	296.336	4.173	20	30		CIEDRO
N#CCCCC[NH2+][C@@H](Cc1ccccc1F)c1ccccc1	ZINC000191718655	262194530	/nfs/dbraw/zinc/19/45/30/262194530.db2.gz	YCLFUKHKTZGGEI-IBGZPJMESA-N	1	0	296.389	4.393	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H](C)c2cccc(F)c2)cc1	ZINC000020148054	262194752	/nfs/dbraw/zinc/19/47/52/262194752.db2.gz	DQJYVQCAQUJZNA-AWEZNQCLSA-N	1	0	285.362	4.241	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H]1CCSc2ccccc21	ZINC000311138369	262196632	/nfs/dbraw/zinc/19/66/32/262196632.db2.gz	FNQVWNYHMWQUPX-AWEZNQCLSA-N	1	0	261.434	4.415	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+]C[C@H](c2ccccc2)C(F)(F)F)C1	ZINC000193310466	262220656	/nfs/dbraw/zinc/22/06/56/262220656.db2.gz	PNTGWJNGEOUXJS-NWANDNLSSA-N	1	0	296.336	4.004	20	30		CIEDRO
CC(C)[NH+](CC#Cc1ccc(OC(F)(F)F)cc1)C(C)C	ZINC000492914677	262247533	/nfs/dbraw/zinc/24/75/33/262247533.db2.gz	ZFUQWJQBLBGKMF-UHFFFAOYSA-N	1	0	299.336	4.056	20	30		CIEDRO
C[C@H](c1cccc(C#N)c1)[N@@H+]1CC[C@H](c2ccccc2)C1	ZINC000188472813	262299027	/nfs/dbraw/zinc/29/90/27/262299027.db2.gz	OEAWMZAZHXKVDS-BEFAXECRSA-N	1	0	276.383	4.109	20	30		CIEDRO
CC(C)(C)c1ccc(C[NH2+][C@H]2CCC[C@H](C#N)C2)cc1	ZINC000463282502	262304012	/nfs/dbraw/zinc/30/40/12/262304012.db2.gz	MYXVBTHGJXXOOT-RDJZCZTQSA-N	1	0	270.420	4.156	20	30		CIEDRO
C=CCCC[NH+]1CCC(Oc2cc(C)ccc2C)CC1	ZINC000522775219	262340596	/nfs/dbraw/zinc/34/05/96/262340596.db2.gz	FKDROYONPAQEPO-UHFFFAOYSA-N	1	0	273.420	4.113	20	30		CIEDRO
C=CCSCC[NH2+][C@@H]1C[C@@H](C)Sc2sccc21	ZINC000336701655	262381344	/nfs/dbraw/zinc/38/13/44/262381344.db2.gz	RWPOEFSSIABIBQ-ZYHUDNBSSA-N	1	0	285.503	4.182	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H]1CCSc2ccc(Cl)cc21	ZINC000163334502	262397191	/nfs/dbraw/zinc/39/71/91/262397191.db2.gz	ZCKGIDWBHNOAIN-ZWNOBZJWSA-N	1	0	267.825	4.431	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@@H]1CCC[C@@H](c2cccnc2)C1	ZINC000337463995	262453081	/nfs/dbraw/zinc/45/30/81/262453081.db2.gz	LGTJIMRHYIQSKB-HYVNUMGLSA-N	1	0	258.409	4.052	20	30		CIEDRO
CC(C)(C)[C@@H](Cc1ccccc1C(F)(F)F)[NH2+]CCC#N	ZINC000411749546	262706233	/nfs/dbraw/zinc/70/62/33/262706233.db2.gz	OVWAEZHWVSNWBO-CQSZACIVSA-N	1	0	298.352	4.166	20	30		CIEDRO
C[C@H]([NH2+]C1(C2CCC2)CCC1)c1ccc(C#N)cc1F	ZINC000414170903	262813350	/nfs/dbraw/zinc/81/33/50/262813350.db2.gz	CQSBWVAZMDHTCA-LBPRGKRZSA-N	1	0	272.367	4.071	20	30		CIEDRO
Cc1cccc2c1[C@@H](C)C[C@@H]2[NH2+]CC(C)(C)CC#N	ZINC000414173700	262814077	/nfs/dbraw/zinc/81/40/77/262814077.db2.gz	XFKUCDORFVZIII-ZFWWWQNUSA-N	1	0	256.393	4.073	20	30		CIEDRO
CC(C)(C)O[C@@H]1C[C@H]([NH2+]C2CCC(C)(C#N)CC2)C1(C)C	ZINC000414327124	262844324	/nfs/dbraw/zinc/84/43/24/262844324.db2.gz	BHVWUJIHBNSRCE-QRHJNKNDSA-N	1	0	292.467	4.031	20	30		CIEDRO
C[C@@H]([NH2+]CCC(C)(C)C#N)c1c(F)cccc1Cl	ZINC000271999101	263001175	/nfs/dbraw/zinc/00/11/75/263001175.db2.gz	GZTFMVVEZNQARM-SNVBAGLBSA-N	1	0	268.763	4.070	20	30		CIEDRO
N#CCCC[NH2+][C@@H]1CCCOc2c(Cl)c(Cl)ccc21	ZINC000273184745	263013645	/nfs/dbraw/zinc/01/36/45/263013645.db2.gz	FQUJFZVVYVOOSB-GFCCVEGCSA-N	1	0	299.201	4.100	20	30		CIEDRO
N#CCCC[NH2+][C@@H]1CCCSc2ccc(Cl)cc21	ZINC000273287561	263014936	/nfs/dbraw/zinc/01/49/36/263014936.db2.gz	RMMRXDPQEWTIAB-CYBMUJFWSA-N	1	0	280.824	4.160	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CC[C@@H](C#N)C1)c1ccc(Cl)cc1	ZINC000274542457	263025774	/nfs/dbraw/zinc/02/57/74/263025774.db2.gz	ULRZYFUIDSGLHV-DFBGVHRSSA-N	1	0	262.784	4.073	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@H](C#N)C1)c1cccc2ccccc21	ZINC000274547584	263025930	/nfs/dbraw/zinc/02/59/30/263025930.db2.gz	VPAPCMGAELGHHS-DZKIICNBSA-N	1	0	264.372	4.183	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1cccc2ccccc21	ZINC000274547588	263026015	/nfs/dbraw/zinc/02/60/15/263026015.db2.gz	VPAPCMGAELGHHS-OFQRWUPVSA-N	1	0	264.372	4.183	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH2+]C(c2ccccc2)c2ccccc2)C1	ZINC000274617278	263027813	/nfs/dbraw/zinc/02/78/13/263027813.db2.gz	LNTYJGCDCONUFY-CRAIPNDOSA-N	1	0	276.383	4.058	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1cccc(Cl)c1	ZINC000274633988	263028382	/nfs/dbraw/zinc/02/83/82/263028382.db2.gz	PMBSZWSCXSJNIW-GLQYFDAESA-N	1	0	262.784	4.073	20	30		CIEDRO
C[C@H](CCC#N)[N@@H+]1CCC[C@H]1c1nc2ccccc2s1	ZINC000276335188	263036350	/nfs/dbraw/zinc/03/63/50/263036350.db2.gz	RUKZIGAOYRYRHS-OCCSQVGLSA-N	1	0	285.416	4.125	20	30		CIEDRO
CC(C)[C@@H]1C[C@@H]([NH2+][C@@H](CCC#N)c2ccccc2)CS1	ZINC000277262169	263040340	/nfs/dbraw/zinc/04/03/40/263040340.db2.gz	PBDBGWVXYPUFPI-IKGGRYGDSA-N	1	0	288.460	4.151	20	30		CIEDRO
CC(C)(C#N)CCCC[NH2+]C1(c2nccs2)CCCC1	ZINC000277879042	263044220	/nfs/dbraw/zinc/04/42/20/263044220.db2.gz	YZLSOCZPSIDBIB-UHFFFAOYSA-N	1	0	291.464	4.222	20	30		CIEDRO
CC1(C)CCc2ccccc2[C@H]([NH2+]C[C@@H](C#N)CCC#N)C1	ZINC000281700999	263071329	/nfs/dbraw/zinc/07/13/29/263071329.db2.gz	NVJDWUAZLMHLDP-CRAIPNDOSA-N	1	0	295.430	4.123	20	30		CIEDRO
CSc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H](C#N)C2)cc1	ZINC000281824120	263072092	/nfs/dbraw/zinc/07/20/92/263072092.db2.gz	ZVMUYWLAAFEKCO-GZBFAFLISA-N	1	0	274.433	4.141	20	30		CIEDRO
CSc1ccc([C@H](C)[NH2+]CC2CCC(C#N)CC2)cc1	ZINC000282193984	263075179	/nfs/dbraw/zinc/07/51/79/263075179.db2.gz	GJTTXSDHTOWTNF-NFOMZHRRSA-N	1	0	288.460	4.389	20	30		CIEDRO
Cc1ccc([C@H](C)[NH2+]CC2CCC(C#N)CC2)s1	ZINC000282311450	263075681	/nfs/dbraw/zinc/07/56/81/263075681.db2.gz	NAVYATPINPDQPS-HSBZDZAISA-N	1	0	262.422	4.037	20	30		CIEDRO
CCSc1cccc(C[NH2+]CC(C)(C)CCC#N)c1	ZINC000288371789	263104010	/nfs/dbraw/zinc/10/40/10/263104010.db2.gz	FGGDKFVOBCJAQC-UHFFFAOYSA-N	1	0	276.449	4.218	20	30		CIEDRO
C[C@H]([NH2+]CC1(CC#N)CC1)c1ccc(F)c2ccccc21	ZINC000340376846	263121271	/nfs/dbraw/zinc/12/12/71/263121271.db2.gz	PXNZRFZZYZESGB-ZDUSSCGKSA-N	1	0	282.362	4.323	20	30		CIEDRO
CC(C)[N@H+](CCCSCC#N)[C@@H](C)c1ccccc1	ZINC000292117073	263128719	/nfs/dbraw/zinc/12/87/19/263128719.db2.gz	HSWHFMUSIKUASB-HNNXBMFYSA-N	1	0	276.449	4.105	20	30		CIEDRO
Cc1ccccc1C(C)(C)[NH2+]CCCC(C)(C)C#N	ZINC000293095372	263137801	/nfs/dbraw/zinc/13/78/01/263137801.db2.gz	XHMPOQRISHBBHE-UHFFFAOYSA-N	1	0	258.409	4.150	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H](CC)c1ccc(C#N)cc1	ZINC000340425008	263139496	/nfs/dbraw/zinc/13/94/96/263139496.db2.gz	BWABGBNHWRURDH-INIZCTEOSA-N	1	0	256.393	4.201	20	30		CIEDRO
Cc1cc(F)ccc1C1CC[NH+]([C@@H]2CC[C@H](C#N)C2)CC1	ZINC000293455647	263140828	/nfs/dbraw/zinc/14/08/28/263140828.db2.gz	CVZNHCMBGWVCMP-WMLDXEAASA-N	1	0	286.394	4.006	20	30		CIEDRO
Cc1cc(F)ccc1C1CC[NH+]([C@H]2CC[C@H](C#N)C2)CC1	ZINC000293455660	263141082	/nfs/dbraw/zinc/14/10/82/263141082.db2.gz	CVZNHCMBGWVCMP-YOEHRIQHSA-N	1	0	286.394	4.006	20	30		CIEDRO
N#CCCC[C@H]([NH2+][C@H]1CC[C@H]1C1CC1)c1ccccc1	ZINC000340428864	263141815	/nfs/dbraw/zinc/14/18/15/263141815.db2.gz	BFYAEFWWSHRLEF-BZSNNMDCSA-N	1	0	268.404	4.200	20	30		CIEDRO
N#CCCC[C@H]([NH2+][C@@H]1CC[C@H]1C1CC1)c1ccccc1	ZINC000340428870	263141926	/nfs/dbraw/zinc/14/19/26/263141926.db2.gz	BFYAEFWWSHRLEF-OKZBNKHCSA-N	1	0	268.404	4.200	20	30		CIEDRO
CC1(C)CC[C@@H]1[NH2+][C@@H](CCCC#N)c1ccccc1	ZINC000340430950	263141942	/nfs/dbraw/zinc/14/19/42/263141942.db2.gz	IKZYGFBHVVVUQK-HOTGVXAUSA-N	1	0	256.393	4.200	20	30		CIEDRO
C[C@@H]([NH2+][C@H](CCCC#N)c1ccccc1)c1nccs1	ZINC000340431841	263145140	/nfs/dbraw/zinc/14/51/40/263145140.db2.gz	JNMOKTAFXIPSTN-UKRRQHHQSA-N	1	0	285.416	4.229	20	30		CIEDRO
Cc1cc(C)cc(C2=CC[N@@H+]([C@H]3CC[C@H](C#N)C3)CC2)c1	ZINC000293714048	263147618	/nfs/dbraw/zinc/14/76/18/263147618.db2.gz	FAAWRAMFVATEKB-LPHOPBHVSA-N	1	0	280.415	4.085	20	30		CIEDRO
Cc1cncc([C@H](C)[NH2+][C@@H](CCCC#N)c2ccccc2)c1	ZINC000340438014	263147756	/nfs/dbraw/zinc/14/77/56/263147756.db2.gz	XYRXXEGMIZJWJO-LPHOPBHVSA-N	1	0	293.414	4.476	20	30		CIEDRO
C[C@]1(c2ccccc2)CCC[N@@H+]([C@@H]2CC[C@@H](C#N)C2)CC1	ZINC000293724243	263147780	/nfs/dbraw/zinc/14/77/80/263147780.db2.gz	YSBNXUZEJOSZLC-QRQLOZEOSA-N	1	0	282.431	4.122	20	30		CIEDRO
Cc1cc(C)cc(C2=CC[N@@H+]([C@@H]3CC[C@H](C#N)C3)CC2)c1	ZINC000293714053	263147854	/nfs/dbraw/zinc/14/78/54/263147854.db2.gz	FAAWRAMFVATEKB-QFBILLFUSA-N	1	0	280.415	4.085	20	30		CIEDRO
C[C@H]([NH2+][C@H](CCCC#N)c1ccccc1)[C@@H]1CC1(C)C	ZINC000340439013	263148129	/nfs/dbraw/zinc/14/81/29/263148129.db2.gz	BGCQBSZIUNOBIZ-BHYGNILZSA-N	1	0	270.420	4.446	20	30		CIEDRO
CCc1ccc([C@@H]2CCC[N@@H+]([C@H]3CC[C@@H](C#N)C3)C2)cc1	ZINC000293735464	263148175	/nfs/dbraw/zinc/14/81/75/263148175.db2.gz	ZQWBDOVUTGCEMN-QRQLOZEOSA-N	1	0	282.431	4.121	20	30		CIEDRO
CCc1ccc(C2=CC[N@@H+]([C@@H]3CC[C@@H](C#N)C3)CC2)cc1	ZINC000293908237	263152050	/nfs/dbraw/zinc/15/20/50/263152050.db2.gz	WRVKCWHUYHIIBW-VQIMIIECSA-N	1	0	280.415	4.030	20	30		CIEDRO
N#CCCC[C@@H]([NH2+][C@@H]1CCC12CCC2)c1ccccc1	ZINC000340448756	263153613	/nfs/dbraw/zinc/15/36/13/263153613.db2.gz	KCMMRMOOZZBDDY-IAGOWNOFSA-N	1	0	268.404	4.344	20	30		CIEDRO
C[C@H](CC1CC1)[NH2+][C@H](CCCC#N)c1ccccc1	ZINC000340447920	263154219	/nfs/dbraw/zinc/15/42/19/263154219.db2.gz	HQYVTCYGKLTFIV-RHSMWYFYSA-N	1	0	256.393	4.200	20	30		CIEDRO
N#CCCC[C@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1ccccc1	ZINC000340448013	263154317	/nfs/dbraw/zinc/15/43/17/263154317.db2.gz	IMXYSTVNJCJJNR-SZMVWBNQSA-N	1	0	281.403	4.094	20	30		CIEDRO
N#CCCC[C@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)c1ccccc1	ZINC000340448011	263154389	/nfs/dbraw/zinc/15/43/89/263154389.db2.gz	IMXYSTVNJCJJNR-NJAFHUGGSA-N	1	0	281.403	4.094	20	30		CIEDRO
CC[C@H]([NH2+][C@@H](CCCC#N)c1ccccc1)C1CC1	ZINC000340451027	263155363	/nfs/dbraw/zinc/15/53/63/263155363.db2.gz	ZDMRFWKYQCRZGY-IRXDYDNUSA-N	1	0	256.393	4.200	20	30		CIEDRO
CC(C)C[C@@H](C)[NH2+][C@H](CCCC#N)c1ccccc1	ZINC000340454943	263158066	/nfs/dbraw/zinc/15/80/66/263158066.db2.gz	UDYVNRZKBDIDPJ-NVXWUHKLSA-N	1	0	258.409	4.446	20	30		CIEDRO
Cc1cccnc1[C@H]1CCC[C@@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)C1	ZINC000294929525	263169325	/nfs/dbraw/zinc/16/93/25/263169325.db2.gz	BNPJSGRPRAXHLJ-FJIDUMEYSA-N	1	0	297.446	4.088	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000295008394	263170893	/nfs/dbraw/zinc/17/08/93/263170893.db2.gz	JEWPDUTYYKAVHO-GDAAHCPNSA-N	1	0	282.431	4.385	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1cc2c(cc1O)CCCC2	ZINC000296256830	263188188	/nfs/dbraw/zinc/18/81/88/263188188.db2.gz	DCISZLGYMVVVRI-ZQIUZPCESA-N	1	0	298.430	4.004	20	30		CIEDRO
CCCOc1ccc([C@@H](C)[NH2+][C@H]2CC[C@@H](CC#N)C2)cc1	ZINC000296252003	263188206	/nfs/dbraw/zinc/18/82/06/263188206.db2.gz	CXRSJICITAKDPF-VYDXJSESSA-N	1	0	286.419	4.208	20	30		CIEDRO
CCCOc1ccc([C@H](C)[NH2+][C@H]2CC[C@@H](CC#N)C2)cc1	ZINC000296252008	263188225	/nfs/dbraw/zinc/18/82/25/263188225.db2.gz	CXRSJICITAKDPF-ZOBUZTSGSA-N	1	0	286.419	4.208	20	30		CIEDRO
Cc1cc([C@H](C)[NH2+][C@H]2CC[C@@H](CC#N)C2)c(C)s1	ZINC000296304447	263189562	/nfs/dbraw/zinc/18/95/62/263189562.db2.gz	GAQIIRDUOARHBG-UBHSHLNASA-N	1	0	262.422	4.098	20	30		CIEDRO
C[C@H]1CC[C@@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)c2ccccc21	ZINC000296425222	263191439	/nfs/dbraw/zinc/19/14/39/263191439.db2.gz	LPCVTNUMXMBQBL-YRBFXIGRSA-N	1	0	268.404	4.297	20	30		CIEDRO
C[C@H]1C[C@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)c2ccsc2S1	ZINC000296591852	263193984	/nfs/dbraw/zinc/19/39/84/263193984.db2.gz	UZSUELGFQIYYEG-MNXVOIDGSA-N	1	0	292.473	4.345	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+]C2c3ccccc3-c3ccccc32)C1	ZINC000296605396	263194171	/nfs/dbraw/zinc/19/41/71/263194171.db2.gz	VWMFAAWXZVHZJK-GJZGRUSLSA-N	1	0	288.394	4.428	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccccc1OC(F)F	ZINC000296653684	263194798	/nfs/dbraw/zinc/19/47/98/263194798.db2.gz	ZBQHAIQJYLAIKJ-AVGNSLFASA-N	1	0	294.345	4.021	20	30		CIEDRO
N#CCC[C@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1ccccc1	ZINC000296926536	263198279	/nfs/dbraw/zinc/19/82/79/263198279.db2.gz	PXHNJCGGYQMMBW-DLBZAZTESA-N	1	0	292.382	4.014	20	30		CIEDRO
C[C@@H](CCC#N)[NH+]1CCC(c2c[nH]c3ccc(F)cc32)CC1	ZINC000298574553	263222802	/nfs/dbraw/zinc/22/28/02/263222802.db2.gz	QPCJCQXVDRAAHH-ZDUSSCGKSA-N	1	0	299.393	4.179	20	30		CIEDRO
C[C@H](CCC#N)[NH2+][C@@H](C)c1cccc2ccccc21	ZINC000299566198	263247640	/nfs/dbraw/zinc/24/76/40/263247640.db2.gz	HBMZZTRTGPNLMH-KGLIPLIRSA-N	1	0	252.361	4.183	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H](C)CCC#N)c1ccc(Cl)cc1	ZINC000299691279	263251988	/nfs/dbraw/zinc/25/19/88/263251988.db2.gz	NUFOYGWNCJXOOK-SMDDNHRTSA-N	1	0	250.773	4.073	20	30		CIEDRO
CC[C@@H]([NH2+]CCC1CC(F)(F)C1)c1ccc(C#N)cc1	ZINC000453419200	263272712	/nfs/dbraw/zinc/27/27/12/263272712.db2.gz	KZZUENHRAMCSJR-OAHLLOKOSA-N	1	0	278.346	4.034	20	30		CIEDRO
COc1ccc(Cl)cc1[C@H](CC(C)C)[NH2+]CCCC#N	ZINC000341846828	263358508	/nfs/dbraw/zinc/35/85/08/263358508.db2.gz	NBNUPMIHCAZIPR-HNNXBMFYSA-N	1	0	294.826	4.329	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CSc2ccccc21)c1cccc(C#N)c1	ZINC000334204268	263506414	/nfs/dbraw/zinc/50/64/14/263506414.db2.gz	VRVZFRPBIINPNB-BLLLJJGKSA-N	1	0	280.396	4.056	20	30		CIEDRO
CCC[C@H]([NH2+]CC(C)(C)CCC#N)[C@H]1CC1(C)C	ZINC000417349395	263797873	/nfs/dbraw/zinc/79/78/73/263797873.db2.gz	LATWJEYJGZFZKH-KGLIPLIRSA-N	1	0	250.430	4.121	20	30		CIEDRO
CCc1ccc([C@@H](C)[NH2+][C@H]2CCCc3cc(C#N)ccc32)o1	ZINC000417372864	263892495	/nfs/dbraw/zinc/89/24/95/263892495.db2.gz	WRVVIRFDDVMKII-ACJLOTCBSA-N	1	0	294.398	4.442	20	30		CIEDRO
C=C(C)CN(Cc1cncn1C(C)C)Cc1ccccc1	ZINC000425345107	264016662	/nfs/dbraw/zinc/01/66/62/264016662.db2.gz	UXQQQWRVDOGGOF-UHFFFAOYSA-N	1	0	283.419	4.042	20	30		CIEDRO
CCC[C@]1(C)CCC[N@@H+]([C@@H](C(N)=O)c2ccc(C#N)cc2)C1	ZINC000330926981	264095339	/nfs/dbraw/zinc/09/53/39/264095339.db2.gz	JQECKKCFEQSLRS-SJLPKXTDSA-N	1	0	299.418	4.037	20	30		CIEDRO
Cc1cc(C[N@@H+](C)[C@@H](C)c2cccc(C#N)c2)cs1	ZINC000425363611	264136662	/nfs/dbraw/zinc/13/66/62/264136662.db2.gz	CEXSCPYEBCTAJZ-ZDUSSCGKSA-N	1	0	270.401	4.121	20	30		CIEDRO
C=C(C)[C@@H]([NH2+]C1CC(OC(C)C)C1)c1ccc(F)c(F)c1	ZINC000428095360	264365822	/nfs/dbraw/zinc/36/58/22/264365822.db2.gz	XUHIZOWJODVHFT-MQBCKMQZSA-N	1	0	295.373	4.128	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CC1(CCOCC)CC1)c1ccco1	ZINC000286094404	264574994	/nfs/dbraw/zinc/57/49/94/264574994.db2.gz	MGLLFQHJXMYVAP-OAHLLOKOSA-N	1	0	277.408	4.083	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCCCC1(C)C)c1ccc(C#N)cc1	ZINC000094276597	265232425	/nfs/dbraw/zinc/23/24/25/265232425.db2.gz	QAQUJZWKDKETRN-CJNGLKHVSA-N	1	0	256.393	4.178	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)c1cc(F)cc(F)c1	ZINC000094826633	265259779	/nfs/dbraw/zinc/25/97/79/265259779.db2.gz	UWPSVYJJPKRBSJ-NWDGAFQWSA-N	1	0	286.325	4.248	20	30		CIEDRO
Cc1ccccc1C1CC([N@H+](CCCCC#N)C2CC2)C1	ZINC000357808928	266369131	/nfs/dbraw/zinc/36/91/31/266369131.db2.gz	RFICFRDOTPBOQJ-UHFFFAOYSA-N	1	0	282.431	4.399	20	30		CIEDRO
C=CCSCC[NH2+][C@@H]1CCCOc2c(Cl)cccc21	ZINC000358022228	266399409	/nfs/dbraw/zinc/39/94/09/266399409.db2.gz	ILUHFCVEYBAIOY-CQSZACIVSA-N	1	0	297.851	4.063	20	30		CIEDRO
C=C(CC)C[NH+]1CCC(OC2CCC(C)CC2)CC1	ZINC000358503157	266469998	/nfs/dbraw/zinc/46/99/98/266469998.db2.gz	WXQMYWAHZRAQSS-UHFFFAOYSA-N	1	0	265.441	4.012	20	30		CIEDRO
C[C@@H]1CC[C@@H]([NH2+][C@@H]2CCCCc3cc(C#N)ccc32)C1	ZINC000360869527	266749961	/nfs/dbraw/zinc/74/99/61/266749961.db2.gz	CTIWLHFQECSVHJ-MZMPZRCHSA-N	1	0	268.404	4.104	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CCC[C@H]1c1ccc(F)c(F)c1	ZINC000363170251	267078733	/nfs/dbraw/zinc/07/87/33/267078733.db2.gz	FGFYYHISHAGVGK-INIZCTEOSA-N	1	0	292.373	4.432	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1CCC[C@@H]1c1ccc(F)cc1	ZINC000367899078	267125586	/nfs/dbraw/zinc/12/55/86/267125586.db2.gz	GIIVRWGJCAYQLO-IAGOWNOFSA-N	1	0	288.410	4.381	20	30		CIEDRO
Cc1cccnc1[C@H]1CCC[C@H]([NH2+]CC(C)(C)CCC#N)C1	ZINC000367904857	267125658	/nfs/dbraw/zinc/12/56/58/267125658.db2.gz	RJVHKQHZUKHHLN-IRXDYDNUSA-N	1	0	299.462	4.336	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]C1CC(C)(c2ccc(F)cc2)C1	ZINC000367903949	267125964	/nfs/dbraw/zinc/12/59/64/267125964.db2.gz	OJPSBKZQVOXLTO-UHFFFAOYSA-N	1	0	288.410	4.165	20	30		CIEDRO
Cc1cccnc1[C@H]1CCC[C@@H]([NH2+]CC(C)(C)CCC#N)C1	ZINC000367904855	267125983	/nfs/dbraw/zinc/12/59/83/267125983.db2.gz	RJVHKQHZUKHHLN-DLBZAZTESA-N	1	0	299.462	4.336	20	30		CIEDRO
Cc1ccc2c(c1)OCCC[C@H]2[NH2+]CC(C)(C)CCC#N	ZINC000367906080	267126624	/nfs/dbraw/zinc/12/66/24/267126624.db2.gz	XMMTUKPAQINQCM-MRXNPFEDSA-N	1	0	286.419	4.128	20	30		CIEDRO
C=CC[C@H](C)[NH2+]C1CCC(O)(c2cccc(Cl)c2)CC1	ZINC000368363638	267166368	/nfs/dbraw/zinc/16/63/68/267166368.db2.gz	VRVADQISLXCANJ-IGEOTXOUSA-N	1	0	293.838	4.024	20	30		CIEDRO
C[C@H]([NH2+]Cc1cc(C#N)cs1)c1ccc(C2CC2)cc1	ZINC000418117807	267250623	/nfs/dbraw/zinc/25/06/23/267250623.db2.gz	UKOMUJUFNIFKJL-LBPRGKRZSA-N	1	0	282.412	4.348	20	30		CIEDRO
C[C@@H]([NH2+]Cc1cc(C#N)cs1)c1ccc(C2CC2)cc1	ZINC000418117805	267250915	/nfs/dbraw/zinc/25/09/15/267250915.db2.gz	UKOMUJUFNIFKJL-GFCCVEGCSA-N	1	0	282.412	4.348	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]Cc1ccccc1-c1ccncc1	ZINC000369671526	267258591	/nfs/dbraw/zinc/25/85/91/267258591.db2.gz	HEMQJXVSZJUDMK-UHFFFAOYSA-N	1	0	293.414	4.168	20	30		CIEDRO
C[C@H]([NH2+]Cc1cccc(C#N)c1)c1ccc(C2CC2)cc1	ZINC000418120665	267274093	/nfs/dbraw/zinc/27/40/93/267274093.db2.gz	WFNXJRPBCHOSBN-AWEZNQCLSA-N	1	0	276.383	4.286	20	30		CIEDRO
C[C@@H]([NH2+]Cc1cccc(C#N)c1)c1ccc(C2CC2)cc1	ZINC000418120672	267274141	/nfs/dbraw/zinc/27/41/41/267274141.db2.gz	WFNXJRPBCHOSBN-CQSZACIVSA-N	1	0	276.383	4.286	20	30		CIEDRO
C=C[C@H](C)[NH2+][C@H]1CCSc2c(Cl)cccc21	ZINC000119360972	267325540	/nfs/dbraw/zinc/32/55/40/267325540.db2.gz	RILQVBMMCJGOLZ-CABZTGNLSA-N	1	0	253.798	4.041	20	30		CIEDRO
C[C@H]([NH2+][C@@H](C)C1CC1)c1nc(-c2ccc(C#N)cc2)cs1	ZINC000370662768	267335971	/nfs/dbraw/zinc/33/59/71/267335971.db2.gz	OEVKOTJCUCEAEV-RYUDHWBXSA-N	1	0	297.427	4.131	20	30		CIEDRO
C[C@H](CC(C)(C)c1ccccc1)[NH2+]CC1(C#N)CCC1	ZINC000418140651	267361979	/nfs/dbraw/zinc/36/19/79/267361979.db2.gz	JWJWTMYRIOXHAF-OAHLLOKOSA-N	1	0	270.420	4.026	20	30		CIEDRO
N#CC1(C[NH2+][C@H]2CCC[C@@H]2c2ccccc2Cl)CCC1	ZINC000418142253	267363155	/nfs/dbraw/zinc/36/31/55/267363155.db2.gz	MKQAVOPLFXWXKX-ZBFHGGJFSA-N	1	0	288.822	4.260	20	30		CIEDRO
Cc1ccc(F)cc1C[NH2+][C@@H]1CCCc2cc(C#N)ccc21	ZINC000418144243	267365098	/nfs/dbraw/zinc/36/50/98/267365098.db2.gz	KFSJFQDCSSNNEC-LJQANCHMSA-N	1	0	294.373	4.173	20	30		CIEDRO
Cc1ccc(F)cc1C[NH2+][C@H]1CCCc2cc(C#N)ccc21	ZINC000418144242	267365785	/nfs/dbraw/zinc/36/57/85/267365785.db2.gz	KFSJFQDCSSNNEC-IBGZPJMESA-N	1	0	294.373	4.173	20	30		CIEDRO
Cc1sccc1C[NH2+][C@@H]1CCCc2cc(C#N)ccc21	ZINC000418149514	267375986	/nfs/dbraw/zinc/37/59/86/267375986.db2.gz	VITMEVWXZNAFBK-QGZVFWFLSA-N	1	0	282.412	4.095	20	30		CIEDRO
N#Cc1ccc(C[N@@H+]2CCCCC[C@H]2c2ccncc2)cc1	ZINC000120167782	267388189	/nfs/dbraw/zinc/38/81/89/267388189.db2.gz	CRKAQMOCPOVQDU-IBGZPJMESA-N	1	0	291.398	4.071	20	30		CIEDRO
N#CCCCC[NH2+][C@H]1CCCC[C@@H](c2ccccc2)C1	ZINC000371367693	267395616	/nfs/dbraw/zinc/39/56/16/267395616.db2.gz	BIFGBLDPAKYBTP-MSOLQXFVSA-N	1	0	270.420	4.386	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H]1CN(C)Cc2ccccc21)c1ccco1	ZINC000375842820	267911716	/nfs/dbraw/zinc/91/17/16/267911716.db2.gz	WVSHSCIXEDOKQK-ZWKOTPCHSA-N	1	0	296.414	4.063	20	30		CIEDRO
Cc1cc([C@@H](C)[NH2+]CC(C)(C)CCC#N)cc(C)c1F	ZINC000580110957	327701759	/nfs/dbraw/zinc/70/17/59/327701759.db2.gz	IVVGBYXDPYNAEO-CQSZACIVSA-N	1	0	276.399	4.423	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+][C@H](C)c1ccc(Cl)c(F)c1	ZINC000580180669	327722692	/nfs/dbraw/zinc/72/26/92/327722692.db2.gz	PGGVWLRNFCEBNP-FFSVYQOJSA-N	1	0	297.801	4.111	20	30		CIEDRO
CC(C)(C)[C@H]([NH2+]Cc1ccc(C#N)o1)c1cccc(F)c1	ZINC000178614440	327795065	/nfs/dbraw/zinc/79/50/65/327795065.db2.gz	OUCYOXLDKGJSRC-MRXNPFEDSA-N	1	0	286.350	4.167	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)c1cccc(N2CCCC2)c1	ZINC000185863493	327848368	/nfs/dbraw/zinc/84/83/68/327848368.db2.gz	SUBCYLLMSHJYER-SOLBZPMBSA-N	1	0	297.446	4.020	20	30		CIEDRO
C=CCCCC[NH2+]C1(c2nc(C)cs2)CCCC1	ZINC000582103280	327855939	/nfs/dbraw/zinc/85/59/39/327855939.db2.gz	GZBLPPOOJCJCEX-UHFFFAOYSA-N	1	0	264.438	4.167	20	30		CIEDRO
CCC[C@H]1CCCC[C@@H]1[NH2+]Cc1cc(C#N)cs1	ZINC000531355976	327901210	/nfs/dbraw/zinc/90/12/10/327901210.db2.gz	CDMJHIPHLSMKTD-ZFWWWQNUSA-N	1	0	262.422	4.068	20	30		CIEDRO
CCC[C@H]1CCCC[C@@H]1[NH2+]CCCC1(C#N)CCOCC1	ZINC000531444706	327908045	/nfs/dbraw/zinc/90/80/45/327908045.db2.gz	OHGDHELXVCPYBO-IRXDYDNUSA-N	1	0	292.467	4.035	20	30		CIEDRO
C=C(C)CN1CCC([NH2+][C@H]2CCCCC23CCCC3)CC1	ZINC000563294867	328010222	/nfs/dbraw/zinc/01/02/22/328010222.db2.gz	GYKLFDNXYBNTCZ-SFHVURJKSA-N	1	0	290.495	4.120	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+]CCc1c[nH]c2ccccc12	ZINC000531677541	328023346	/nfs/dbraw/zinc/02/33/46/328023346.db2.gz	DUUAZTYQRIGLJT-HNNXBMFYSA-N	1	0	256.393	4.045	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)[C@@H](C)c1ccccc1	ZINC000531695430	328025139	/nfs/dbraw/zinc/02/51/39/328025139.db2.gz	UEIHVHGJHOCDFJ-OAGGEKHMSA-N	1	0	278.399	4.401	20	30		CIEDRO
C[C@@H](Cc1ccc(Cl)cc1)[N@H+](C)CCC(C)(C)C#N	ZINC000534217759	328039632	/nfs/dbraw/zinc/03/96/32/328039632.db2.gz	BJACTBPLUNUCOA-ZDUSSCGKSA-N	1	0	278.827	4.143	20	30		CIEDRO
CC(C)C[N@H+](Cc1cc(C#N)ccc1F)C1CCCC1	ZINC000110364105	328048449	/nfs/dbraw/zinc/04/84/49/328048449.db2.gz	ISDSBDAIWWMRPP-UHFFFAOYSA-N	1	0	274.383	4.098	20	30		CIEDRO
CCc1ccc(C[NH2+][C@@H](CCCC#N)c2ccccc2)nc1	ZINC000411758005	328098587	/nfs/dbraw/zinc/09/85/87/328098587.db2.gz	NCVKFDOFQSBOPO-IBGZPJMESA-N	1	0	293.414	4.169	20	30		CIEDRO
C=CCOc1cccc(C[NH2+][C@@H]2CCCc3sccc32)c1	ZINC000160990269	328113771	/nfs/dbraw/zinc/11/37/71/328113771.db2.gz	CVJXEYGDESKRKX-QGZVFWFLSA-N	1	0	299.439	4.480	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H](C)c2ncccc2CC)cc1	ZINC000571391035	328118703	/nfs/dbraw/zinc/11/87/03/328118703.db2.gz	WBPCSIWBQZQJQH-HNNXBMFYSA-N	1	0	296.414	4.060	20	30		CIEDRO
C=CC[C@H](Cc1ccccc1)[NH2+][C@@H](C)c1ccco1	ZINC000414306801	328154249	/nfs/dbraw/zinc/15/42/49/328154249.db2.gz	RERRBCVQKOHIKK-GOEBONIOSA-N	1	0	255.361	4.118	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@H]1C[C@H](c2cc(F)cc(F)c2)C1	ZINC000436306359	328156204	/nfs/dbraw/zinc/15/62/04/328156204.db2.gz	HXSAZTLUROEDCZ-GWIFVGGISA-N	1	0	279.374	4.401	20	30		CIEDRO
Cc1ccccc1[C@@H]1CC[N@H+](CCCC(C)(C)C#N)C1	ZINC000266907838	328170419	/nfs/dbraw/zinc/17/04/19/328170419.db2.gz	KGLNESOSTDXWMW-MRXNPFEDSA-N	1	0	270.420	4.114	20	30		CIEDRO
C[C@@H]([NH2+]CCCCC#N)c1cc(Cl)cc(Cl)c1	ZINC000268897886	328186829	/nfs/dbraw/zinc/18/68/29/328186829.db2.gz	LPNOMQMUNBJLOD-SNVBAGLBSA-N	1	0	271.191	4.338	20	30		CIEDRO
N#CCC[C@H]([NH2+][C@@H]1CCc2c1cccc2F)c1ccccc1	ZINC000271532184	328196787	/nfs/dbraw/zinc/19/67/87/328196787.db2.gz	RGVAEFAXBNIWLN-RBUKOAKNSA-N	1	0	294.373	4.448	20	30		CIEDRO
CC(C)(C)CN(CCC#N)Cc1ccc(C(F)F)cc1	ZINC000183949839	329255089	/nfs/dbraw/zinc/25/50/89/329255089.db2.gz	VJXCFDANHGRFLD-UHFFFAOYSA-N	1	0	280.362	4.386	20	30		CIEDRO
CC1=CC[C@H]([NH2+][C@@H](CCC#N)c2ccccc2)CC1	ZINC000293565769	328276848	/nfs/dbraw/zinc/27/68/48/328276848.db2.gz	IMBIHCLPEMULOZ-IRXDYDNUSA-N	1	0	254.377	4.120	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([N@H+]2[C@@H]3CC[C@H]2C[C@@H](c2ccccc2)C3)C1	ZINC000294345387	328280147	/nfs/dbraw/zinc/28/01/47/328280147.db2.gz	ZCTBVVRBZOGYTE-GYFISPQKSA-N	1	0	280.415	4.089	20	30		CIEDRO
CCSc1cccc(C[NH2+]Cc2ccc(CC#N)cc2)c1	ZINC000567166299	328289231	/nfs/dbraw/zinc/28/92/31/328289231.db2.gz	XOOFKYSZEHNNED-UHFFFAOYSA-N	1	0	296.439	4.154	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H](C)Cc2ccsc2)cc1	ZINC000048557458	328314817	/nfs/dbraw/zinc/31/48/17/328314817.db2.gz	HTCIUIDBPQWZRV-AWEZNQCLSA-N	1	0	287.428	4.034	20	30		CIEDRO
C=C(C)COCC[NH2+][C@H](C)c1ccc(SC(C)C)cc1	ZINC000537962225	328321883	/nfs/dbraw/zinc/32/18/83/328321883.db2.gz	QCABXDPNSWXXDE-OAHLLOKOSA-N	1	0	293.476	4.430	20	30		CIEDRO
CC[NH+](CC)CCC[C@H](C)Nc1cccc(Cl)c1C#N	ZINC000048935534	328326157	/nfs/dbraw/zinc/32/61/57/328326157.db2.gz	WFLNDOYGTXSTQI-ZDUSSCGKSA-N	1	0	293.842	4.134	20	30		CIEDRO
C=C(C)C[N@@H+]1CCCC[C@@H]1c1cc2ccccc2[nH]1	ZINC000303303409	328331077	/nfs/dbraw/zinc/33/10/77/328331077.db2.gz	DBPRBUMQTPNNNA-QGZVFWFLSA-N	1	0	254.377	4.271	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)Cc1ccsc1)c1ccc(C#N)cc1F	ZINC000541904723	328376040	/nfs/dbraw/zinc/37/60/40/328376040.db2.gz	ZJVLSKGMVQMHLM-NWDGAFQWSA-N	1	0	288.391	4.041	20	30		CIEDRO
C=CC[N@@H+](Cc1nc(C)cs1)CC1CCCCC1	ZINC000532036380	328398163	/nfs/dbraw/zinc/39/81/63/328398163.db2.gz	HNBZJTUFZDMNJE-UHFFFAOYSA-N	1	0	264.438	4.020	20	30		CIEDRO
CC[C@@H](C)[NH2+]Cc1cccc(OCc2cccc(C#N)c2)c1	ZINC000060958429	328515033	/nfs/dbraw/zinc/51/50/33/328515033.db2.gz	RXTVQCPUGGSIDQ-OAHLLOKOSA-N	1	0	294.398	4.025	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H](C)c2cc(C)c(C)o2)cc1	ZINC000556915228	326982686	/nfs/dbraw/zinc/98/26/86/326982686.db2.gz	ORIVSXLGESUDHN-CQSZACIVSA-N	1	0	285.387	4.312	20	30		CIEDRO
N#CCC[C@@H]([NH2+]CC1Cc2ccccc2C1)c1ccccc1	ZINC000557542389	327012813	/nfs/dbraw/zinc/01/28/13/327012813.db2.gz	FUBVWMCOGYJRIH-HXUWFJFHSA-N	1	0	290.410	4.036	20	30		CIEDRO
C=C(CC)C[NH2+][C@H](CC)c1ccc(OC(F)F)cc1	ZINC000557575438	327014066	/nfs/dbraw/zinc/01/40/66/327014066.db2.gz	FWORTLTZSHMONJ-CQSZACIVSA-N	1	0	269.335	4.295	20	30		CIEDRO
CC(C)(C#N)CC[NH+]1CCC(c2cccc(Cl)c2)CC1	ZINC000558106421	327074198	/nfs/dbraw/zinc/07/41/98/327074198.db2.gz	XYRNJLRRPOWIBX-UHFFFAOYSA-N	1	0	290.838	4.459	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)c1ccc(Oc2cccnc2)cc1	ZINC000558167388	327077410	/nfs/dbraw/zinc/07/74/10/327077410.db2.gz	RKGIYDQHHNRCLQ-OAHLLOKOSA-N	1	0	282.387	4.491	20	30		CIEDRO
CC[C@H](c1ccccc1OC)[N@H+](C)CC#Cc1ccccc1	ZINC000558177869	327077833	/nfs/dbraw/zinc/07/78/33/327077833.db2.gz	PFZCFOGJGBENRB-LJQANCHMSA-N	1	0	293.410	4.130	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+]C[C@@H]1C[C@H]1c1ccccc1	ZINC000558271020	327084371	/nfs/dbraw/zinc/08/43/71/327084371.db2.gz	DETAXZJCOBJPHH-OALUTQOASA-N	1	0	293.410	4.145	20	30		CIEDRO
CC(C)(C#N)CCCC[N@@H+]1CC[C@@](F)(c2ccccc2)C1	ZINC000565903152	327086323	/nfs/dbraw/zinc/08/63/23/327086323.db2.gz	PPNILGPCKCNKRA-SFHVURJKSA-N	1	0	288.410	4.277	20	30		CIEDRO
N#CCCCCS[C@@H]1CCC[N@H+](Cc2ccccc2)C1	ZINC000569339496	327097215	/nfs/dbraw/zinc/09/72/15/327097215.db2.gz	IJPLHQUWPJJFQR-QGZVFWFLSA-N	1	0	288.460	4.078	20	30		CIEDRO
N#Cc1ccc2c(c1)[C@@H]([NH2+]CCC1=CCCCC1)CC2	ZINC000558504228	327099387	/nfs/dbraw/zinc/09/93/87/327099387.db2.gz	PAHHMTRZIKAILJ-SFHVURJKSA-N	1	0	266.388	4.026	20	30		CIEDRO
CCCC[C@H](CC)C[NH+]1CCC(C#N)(c2ccccn2)CC1	ZINC000558627653	327111144	/nfs/dbraw/zinc/11/11/44/327111144.db2.gz	MYRCFRGICPXNHP-KRWDZBQOSA-N	1	0	299.462	4.155	20	30		CIEDRO
C=CCC[C@@H]([NH2+][C@@H]1CCC12CCOCC2)c1ccccc1	ZINC000374374171	327115777	/nfs/dbraw/zinc/11/57/77/327115777.db2.gz	LIVSBOLAPIPAPC-QZTJIDSGSA-N	1	0	285.431	4.243	20	30		CIEDRO
CC1=C(c2ccco2)C[N@H+]([C@@H](C)c2cccc(C#N)c2)CC1	ZINC000558734555	327118165	/nfs/dbraw/zinc/11/81/65/327118165.db2.gz	PVPVCWPBOVABHQ-HNNXBMFYSA-N	1	0	292.382	4.392	20	30		CIEDRO
C[C@H]([NH2+]CCCc1ccccc1Cl)c1ccc(C#N)cc1	ZINC000558742901	327118842	/nfs/dbraw/zinc/11/88/42/327118842.db2.gz	PAXIFTFSNWQOMB-AWEZNQCLSA-N	1	0	298.817	4.495	20	30		CIEDRO
C=CCN(Cc1ccccc1)Cc1cc(F)ccc1F	ZINC000558742067	327118871	/nfs/dbraw/zinc/11/88/71/327118871.db2.gz	HPHNZUIXMMYAPP-UHFFFAOYSA-N	1	0	273.326	4.153	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@@H]1CCOC2(CCCC2)C1	ZINC000449189658	327119672	/nfs/dbraw/zinc/11/96/72/327119672.db2.gz	MMDKHGCOBUUFAZ-JKSUJKDBSA-N	1	0	265.441	4.203	20	30		CIEDRO
N#CCSCCC[N@H+]1CCC[C@@H]1c1ccc(Cl)cc1	ZINC000074980970	327122826	/nfs/dbraw/zinc/12/28/26/327122826.db2.gz	CIGVRMDGWMWCND-OAHLLOKOSA-N	1	0	294.851	4.124	20	30		CIEDRO
CCc1oc2ccccc2c1C[N@H+](C)[C@@H]1CC[C@H](C#N)C1	ZINC000559035305	327138782	/nfs/dbraw/zinc/13/87/82/327138782.db2.gz	YVPBNLBGMASJCW-UONOGXRCSA-N	1	0	282.387	4.119	20	30		CIEDRO
CC(C)[C@@H](NC[C@@H](C#N)CCC#N)c1ccccc1Cl	ZINC000566115932	327139710	/nfs/dbraw/zinc/13/97/10/327139710.db2.gz	HMVDJXBFQLOTTK-CZUORRHYSA-N	1	0	289.810	4.070	20	30		CIEDRO
C=CCOCC[N@@H+](C)[C@H](C)c1ccc(Cl)c(Cl)c1	ZINC000559067037	327139717	/nfs/dbraw/zinc/13/97/17/327139717.db2.gz	VRFOQFFLYLEDEP-LLVKDONJSA-N	1	0	288.218	4.189	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@@H]1CCO[C@H](CC(C)C)C1	ZINC000539682291	327146355	/nfs/dbraw/zinc/14/63/55/327146355.db2.gz	KLLBJAMAWWPYDH-GVDBMIGSSA-N	1	0	267.457	4.305	20	30		CIEDRO
C[C@@H](c1ccco1)[N@H+](CCCC(C)(C)C#N)C1CC1	ZINC000086233772	327156191	/nfs/dbraw/zinc/15/61/91/327156191.db2.gz	MZTDAEZFLOSEER-ZDUSSCGKSA-N	1	0	260.381	4.135	20	30		CIEDRO
C[C@H]([NH2+]CC1CCC(F)(F)CC1)c1ccc(C#N)cc1	ZINC000409856366	327166750	/nfs/dbraw/zinc/16/67/50/327166750.db2.gz	KXQOMAKNNYNNFN-LBPRGKRZSA-N	1	0	278.346	4.034	20	30		CIEDRO
C=CCC1(C[NH2+]Cc2cnc(C3CC3)s2)CCCC1	ZINC000569425331	327175825	/nfs/dbraw/zinc/17/58/25/327175825.db2.gz	AVDVZIHYJMPCJG-UHFFFAOYSA-N	1	0	276.449	4.247	20	30		CIEDRO
CC(C)C[N@H+](CCCC1(C#N)CCOCC1)CC(C)(C)C	ZINC000410414173	327192558	/nfs/dbraw/zinc/19/25/58/327192558.db2.gz	OOIQDMNCOYDWCW-UHFFFAOYSA-N	1	0	294.483	4.091	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H]2C[C@H](c3ccccc3Cl)C2)cc1	ZINC000559358127	327194246	/nfs/dbraw/zinc/19/42/46/327194246.db2.gz	IIBWORXISXMKDX-WKILWMFISA-N	1	0	296.801	4.247	20	30		CIEDRO
CC(C)[C@@](C)(Cc1ccc(Cl)cc1)[NH2+]CCCC#N	ZINC000559387909	327200618	/nfs/dbraw/zinc/20/06/18/327200618.db2.gz	SLCFUGABJQMACD-MRXNPFEDSA-N	1	0	278.827	4.191	20	30		CIEDRO
C[C@H]([NH2+]C1CC(C(C)(C)C)C1)c1cccc(C#N)c1	ZINC000569596919	327208385	/nfs/dbraw/zinc/20/83/85/327208385.db2.gz	QLWNMNKZZDOTKW-JQRITLKVSA-N	1	0	256.393	4.034	20	30		CIEDRO
C[C@H]([NH2+]C[C@@H]1CCCC[C@H]1C)c1ccc(C#N)cc1	ZINC000042857132	327241516	/nfs/dbraw/zinc/24/15/16/327241516.db2.gz	LCURCGRDCQUBKW-KEYYUXOJSA-N	1	0	256.393	4.035	20	30		CIEDRO
C[C@@H]1c2c(F)cccc2CC[N@H+]1CCCC(C)(C)C#N	ZINC000531101214	327246684	/nfs/dbraw/zinc/24/66/84/327246684.db2.gz	XDSXIKQDRPCFTI-CYBMUJFWSA-N	1	0	274.383	4.075	20	30		CIEDRO
C[C@@H]([NH2+]CCCCC#N)c1ccc(F)c2ccccc21	ZINC000559752835	327259726	/nfs/dbraw/zinc/25/97/26/327259726.db2.gz	VCKVZQUZTYIEFA-CYBMUJFWSA-N	1	0	270.351	4.323	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+]CC[C@@H](c2ccccc2)C(F)(F)F)C1	ZINC000559877385	327267015	/nfs/dbraw/zinc/26/70/15/327267015.db2.gz	LBSMWPOFICUYTG-SNPRPXQTSA-N	1	0	296.336	4.004	20	30		CIEDRO
C[C@@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)c1ccc(C#N)c(F)c1	ZINC000559900106	327270076	/nfs/dbraw/zinc/27/00/76/327270076.db2.gz	STLYEHYOGWPRRL-BVGQSLNGSA-N	1	0	294.373	4.152	20	30		CIEDRO
C=CC[C@@H](C)[C@@H](C)[NH2+]C[C@H]1CC[C@H](c2ccccc2)O1	ZINC000573997425	327280013	/nfs/dbraw/zinc/28/00/13/327280013.db2.gz	IKTWMDUFTGEECD-JOCBIADPSA-N	1	0	273.420	4.097	20	30		CIEDRO
C[C@@H](c1ccc(C#N)cc1)[N@@H+]1CCC=C(c2ccccc2)C1	ZINC000560170880	327288362	/nfs/dbraw/zinc/28/83/62/327288362.db2.gz	BSIRGKMJCLLZCC-INIZCTEOSA-N	1	0	288.394	4.409	20	30		CIEDRO
C=CCCCC[N@@H+](C)[C@@H](C)c1sc(C)nc1C	ZINC000560193588	327289333	/nfs/dbraw/zinc/28/93/33/327289333.db2.gz	SFADVIYREFYJOC-LBPRGKRZSA-N	1	0	252.427	4.109	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]Cc2cc(C)sc2C)cc1	ZINC000560496712	327315248	/nfs/dbraw/zinc/31/52/48/327315248.db2.gz	NAUKBWSEDTZOOP-UHFFFAOYSA-N	1	0	287.428	4.220	20	30		CIEDRO
C[C@@H](CCc1ccccc1)[NH2+][C@H]1CCc2ccc(C#N)cc21	ZINC000583351732	327315419	/nfs/dbraw/zinc/31/54/19/327315419.db2.gz	NAZGWVUBOAKRPX-YWZLYKJASA-N	1	0	290.410	4.156	20	30		CIEDRO
C=CCC[C@H]([NH2+]CC1(OC)CCCCC1)c1ccco1	ZINC000560548420	327323330	/nfs/dbraw/zinc/32/33/30/327323330.db2.gz	HQYAITRXZGTEQI-HNNXBMFYSA-N	1	0	277.408	4.226	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@@H](C)c1ccc([S@](C)=O)cc1	ZINC000561017251	327358915	/nfs/dbraw/zinc/35/89/15/327358915.db2.gz	XMHDNZJGQWBQJU-AVYPCKFXSA-N	1	0	293.476	4.210	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@@H](C)c1cn(-c2ccccc2)nn1	ZINC000561017125	327358945	/nfs/dbraw/zinc/35/89/45/327358945.db2.gz	LZFRFALXSAAHQJ-HOTGVXAUSA-N	1	0	298.434	4.053	20	30		CIEDRO
C=CCCC[C@H](C)[NH+]1CCC(Oc2ccc(C#N)cc2)CC1	ZINC000561061155	327362022	/nfs/dbraw/zinc/36/20/22/327362022.db2.gz	VQRRDWJEHWYWJJ-INIZCTEOSA-N	1	0	298.430	4.146	20	30		CIEDRO
C=CCCCCC[N@@H+](C)[C@H](C)c1nnc(-c2ccccc2)o1	ZINC000150887664	327394674	/nfs/dbraw/zinc/39/46/74/327394674.db2.gz	NCMIKXDEEUMJFQ-OAHLLOKOSA-N	1	0	299.418	4.476	20	30		CIEDRO
CCC[C@@H](Cc1ccccc1)[NH2+]CC(C)(C)CCC#N	ZINC000562037483	327441525	/nfs/dbraw/zinc/44/15/25/327441525.db2.gz	AAVNBPHCENSGPQ-KRWDZBQOSA-N	1	0	272.436	4.317	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1C[C@H](c2ccccc2)C1(C)C	ZINC000562046825	327442492	/nfs/dbraw/zinc/44/24/92/327442492.db2.gz	YOZIIINUSCGTDL-IAGOWNOFSA-N	1	0	284.447	4.488	20	30		CIEDRO
Cc1ccc2c(c1)[C@H]([NH2+]CC(C)(C)CCC#N)[C@@H](C)C2	ZINC000562044509	327443025	/nfs/dbraw/zinc/44/30/25/327443025.db2.gz	FWZRULVWRIHBJC-WMLDXEAASA-N	1	0	270.420	4.148	20	30		CIEDRO
CC[C@@H]1CC[C@H]1[NH2+]C1CCC(Oc2ccccc2C#N)CC1	ZINC000562059930	327445803	/nfs/dbraw/zinc/44/58/03/327445803.db2.gz	RMUOGUCWAFUAMC-AGERRDQYSA-N	1	0	298.430	4.026	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1ccc(Br)cc1F	ZINC000381308665	327449100	/nfs/dbraw/zinc/44/91/00/327449100.db2.gz	KSMRDGZNDUFQFR-LBPRGKRZSA-N	1	0	286.188	4.033	20	30		CIEDRO
C[C@H]([NH2+]CCCC1CC1)c1ccc(C#N)cc1Cl	ZINC000562415637	327480354	/nfs/dbraw/zinc/48/03/54/327480354.db2.gz	DBZFOIBMQRWPSP-NSHDSACASA-N	1	0	262.784	4.052	20	30		CIEDRO
C[C@H]([NH2+]CC(C)(C)CC#N)c1ccc(Cl)c(F)c1	ZINC000562738372	327511100	/nfs/dbraw/zinc/51/11/00/327511100.db2.gz	PKQRAFFNQLXJOB-JTQLQIEISA-N	1	0	268.763	4.070	20	30		CIEDRO
N#Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc3ccccc3c1)CC2	ZINC000562908015	327523719	/nfs/dbraw/zinc/52/37/19/327523719.db2.gz	PQMPDUUNBBPPHX-OAQYLSRUSA-N	1	0	298.389	4.489	20	30		CIEDRO
C=CCCCCC[NH2+]Cc1cnc(-c2ccccn2)s1	ZINC000565214352	327525607	/nfs/dbraw/zinc/52/56/07/327525607.db2.gz	FRBBRDPTJLLVMK-UHFFFAOYSA-N	1	0	287.432	4.041	20	30		CIEDRO
C=C(C[NH2+][C@H](C)c1ncccc1CC)c1ccccc1	ZINC000507511925	332811157	/nfs/dbraw/zinc/81/11/57/332811157.db2.gz	OXVHXVAMFFTOAG-OAHLLOKOSA-N	1	0	266.388	4.008	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+][C@@H](C)c1ccc(OC)c(OC)c1C	ZINC000582198962	328629674	/nfs/dbraw/zinc/62/96/74/328629674.db2.gz	APUWHUQTYMIDHQ-OCCSQVGLSA-N	1	0	277.408	4.018	20	30		CIEDRO
C=CCC[C@H]([NH2+]CC(C)(C)c1ncccc1C)C1CC1	ZINC000519038156	328641071	/nfs/dbraw/zinc/64/10/71/328641071.db2.gz	YAESWKOFQJRIKB-INIZCTEOSA-N	1	0	272.436	4.002	20	30		CIEDRO
C[C@H]([NH2+][C@@H](C)C1CCCCC1)c1cccc(C#N)c1	ZINC000052333981	328641389	/nfs/dbraw/zinc/64/13/89/328641389.db2.gz	FTNRIPCMDYYESI-KBPBESRZSA-N	1	0	256.393	4.178	20	30		CIEDRO
C=CC[C@@H](C)[C@@H](C)[NH2+]CCc1c[nH]c2c1cccc2C	ZINC000532235281	328709598	/nfs/dbraw/zinc/70/95/98/328709598.db2.gz	RFENFXCCKWCQDP-UKRRQHHQSA-N	1	0	270.420	4.209	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+]C[C@@H](OC)c1ccc(Cl)cc1	ZINC000532234334	328709699	/nfs/dbraw/zinc/70/96/99/328709699.db2.gz	RGFDSVBGHDBURT-HEHGZKQESA-N	1	0	281.827	4.218	20	30		CIEDRO
C=CCC[NH2+][C@@H](c1ccccc1)c1cccc(F)c1	ZINC000532286561	328712830	/nfs/dbraw/zinc/71/28/30/328712830.db2.gz	LWXQTUZBQIMJFG-KRWDZBQOSA-N	1	0	255.336	4.081	20	30		CIEDRO
C=C(C)CC[NH2+][C@H]1CCc2sc(Br)cc21	ZINC000395370666	328736772	/nfs/dbraw/zinc/73/67/72/328736772.db2.gz	UNFQSQGALMXHAR-JTQLQIEISA-N	1	0	286.238	4.054	20	30		CIEDRO
CC(C)CCC[C@@H](C)[NH2+]Cc1ccc(C#N)cc1F	ZINC000042336083	328763278	/nfs/dbraw/zinc/76/32/78/328763278.db2.gz	QJJLGOOLJUDMOO-CYBMUJFWSA-N	1	0	262.372	4.002	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)cc1F)C(C)(C)c1ccccc1	ZINC000532570658	328790666	/nfs/dbraw/zinc/79/06/66/328790666.db2.gz	ZJEGBMSXLYCSMY-AWEZNQCLSA-N	1	0	296.389	4.153	20	30		CIEDRO
C[C@H]([NH2+]C(C)(C)c1cccs1)c1cccc(C#N)c1	ZINC000526949743	328816247	/nfs/dbraw/zinc/81/62/47/328816247.db2.gz	ILZDSRXEDRGSTE-LBPRGKRZSA-N	1	0	270.401	4.206	20	30		CIEDRO
CCC1(C[NH2+]Cc2ccc(C#N)cc2C(F)(F)F)CCC1	ZINC000563919845	328836666	/nfs/dbraw/zinc/83/66/66/328836666.db2.gz	JMTURAJIXFQQAG-UHFFFAOYSA-N	1	0	296.336	4.247	20	30		CIEDRO
CC[C@H]([NH2+][C@@H](C)c1ccc(C#N)cc1F)c1ccccc1	ZINC000358556566	328886910	/nfs/dbraw/zinc/88/69/10/328886910.db2.gz	BKYMKWVXNDREQT-UGSOOPFHSA-N	1	0	282.362	4.499	20	30		CIEDRO
N#CC1CC[NH+](CC(c2ccccc2)c2ccccc2)CC1	ZINC000507923869	332829594	/nfs/dbraw/zinc/82/95/94/332829594.db2.gz	YXQNRQZMKKKVGM-UHFFFAOYSA-N	1	0	290.410	4.054	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+][C@H](c1nccn1C)c1ccccc1	ZINC000582281777	328948686	/nfs/dbraw/zinc/94/86/86/328948686.db2.gz	KFNLSPKZPSEGGN-AEFFLSMTSA-N	1	0	297.446	4.234	20	30		CIEDRO
C#Cc1ccc(C[NH2+]Cc2cccc(-c3cccnc3)c2)cc1	ZINC000377660772	329023294	/nfs/dbraw/zinc/02/32/94/329023294.db2.gz	ZTHDGOPCECLJSZ-UHFFFAOYSA-N	1	0	298.389	4.020	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+]Cc1ncoc1-c1ccccc1	ZINC000378184816	329042617	/nfs/dbraw/zinc/04/26/17/329042617.db2.gz	OBTBSHPRJSQILU-UONOGXRCSA-N	1	0	270.376	4.032	20	30		CIEDRO
N#CCCCC[N@H+]1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000378640113	329057573	/nfs/dbraw/zinc/05/75/73/329057573.db2.gz	AGXBPOISPBJGGM-CQSZACIVSA-N	1	0	296.336	4.189	20	30		CIEDRO
Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(OCC#N)cc2)cc1	ZINC000193899024	329062620	/nfs/dbraw/zinc/06/26/20/329062620.db2.gz	AOKWIGGTYCKRAA-HZPDHXFCSA-N	1	0	294.398	4.309	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](C)c1cc(Br)cs1	ZINC000194102403	329065486	/nfs/dbraw/zinc/06/54/86/329065486.db2.gz	JNMWHDCNQVEFKR-BDAKNGLRSA-N	1	0	274.227	4.126	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H](C)c1sccc1OC	ZINC000583707613	329087055	/nfs/dbraw/zinc/08/70/55/329087055.db2.gz	IWTCURPYLMFLQK-NSHDSACASA-N	1	0	253.411	4.010	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1csc(Cl)c1Cl	ZINC000308900320	332840657	/nfs/dbraw/zinc/84/06/57/332840657.db2.gz	BEWPXQOPHPOAKF-SECBINFHSA-N	1	0	264.221	4.499	20	30		CIEDRO
C[C@@H]([NH2+]C[C@H]1CCc2ccccc21)c1ccc(C#N)c(F)c1	ZINC000538507883	329149731	/nfs/dbraw/zinc/14/97/31/329149731.db2.gz	JTJHSOPKKLCDLO-CXAGYDPISA-N	1	0	294.373	4.078	20	30		CIEDRO
C=CCN1CCC([NH2+][C@@H](CC)c2ccc(Cl)s2)CC1	ZINC000177912999	329189795	/nfs/dbraw/zinc/18/97/95/329189795.db2.gz	BEHARSCJGBSQSO-ZDUSSCGKSA-N	1	0	298.883	4.093	20	30		CIEDRO
CC(C)c1ccc2c(c1)[C@@H]([NH2+]CCCCC#N)CCCO2	ZINC000178275961	329195398	/nfs/dbraw/zinc/19/53/98/329195398.db2.gz	FHXVCLFOODZCHZ-KRWDZBQOSA-N	1	0	286.419	4.307	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1cn2ccsc2n1)c1ccccc1	ZINC000178757966	329200323	/nfs/dbraw/zinc/20/03/23/329200323.db2.gz	FUUZNTJCYFCCBA-MRXNPFEDSA-N	1	0	297.427	4.193	20	30		CIEDRO
COc1ccc([C@H](CCC(C)C)[NH2+]CCCCC#N)cc1	ZINC000178640931	329201704	/nfs/dbraw/zinc/20/17/04/329201704.db2.gz	CXAHBMKLUAGZCZ-SFHVURJKSA-N	1	0	288.435	4.456	20	30		CIEDRO
Cc1cc(Cl)cc2c1OCCC[C@@H]2[NH2+]CCCCC#N	ZINC000179108881	329205465	/nfs/dbraw/zinc/20/54/65/329205465.db2.gz	JQXCRLZQVBIPRC-HNNXBMFYSA-N	1	0	292.810	4.146	20	30		CIEDRO
CC(C)c1cccc2c1OCCC[C@@H]2[NH2+]CCCCC#N	ZINC000179108849	329205513	/nfs/dbraw/zinc/20/55/13/329205513.db2.gz	ANJLFMHEMYOCFZ-KRWDZBQOSA-N	1	0	286.419	4.307	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](CC)c1ccccc1OC(F)F	ZINC000508960872	332852987	/nfs/dbraw/zinc/85/29/87/332852987.db2.gz	CKCBYCIPQXTTPL-ZDUSSCGKSA-N	1	0	269.335	4.295	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1ccc(SCCOC)cc1	ZINC000508974675	332853388	/nfs/dbraw/zinc/85/33/88/332853388.db2.gz	BFDFQPKQJZQKHJ-AWEZNQCLSA-N	1	0	279.449	4.042	20	30		CIEDRO
N#CCC1CCN(Cc2cccc(Cl)c2Cl)CC1	ZINC000397206906	329344284	/nfs/dbraw/zinc/34/42/84/329344284.db2.gz	BBSOMRWELWUXNO-UHFFFAOYSA-N	1	0	283.202	4.119	20	30		CIEDRO
Cc1ccc(C)c(C[N@H+](C)Cc2ccc(CC#N)cc2)c1	ZINC000429293392	329350471	/nfs/dbraw/zinc/35/04/71/329350471.db2.gz	NBUIPKSSLUOZRV-UHFFFAOYSA-N	1	0	278.399	4.002	20	30		CIEDRO
Cc1cccc2c1OCC[C@H]2[NH2+][C@@H](C)c1ccc(C#N)s1	ZINC000189364941	329380096	/nfs/dbraw/zinc/38/00/96/329380096.db2.gz	AZEGLNWQCJCEHK-SWLSCSKDSA-N	1	0	298.411	4.103	20	30		CIEDRO
C[C@H](C#N)C[NH2+][C@@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1	ZINC000583242204	329393537	/nfs/dbraw/zinc/39/35/37/329393537.db2.gz	LJHOSAOWFQCFOJ-UXIGCNINSA-N	1	0	296.336	4.091	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1	ZINC000398077279	329431229	/nfs/dbraw/zinc/43/12/29/329431229.db2.gz	PIMTZFREDQQLBE-UONOGXRCSA-N	1	0	276.380	4.299	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](C)c1ccc(OC)cc1OC	ZINC000398090670	329432897	/nfs/dbraw/zinc/43/28/97/329432897.db2.gz	XRPLFEZLAYOEER-UONOGXRCSA-N	1	0	277.408	4.099	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](C)c1ccc(OC)cc1F	ZINC000398208155	329438366	/nfs/dbraw/zinc/43/83/66/329438366.db2.gz	ZFCVEMRWKXBUFL-STQMWFEESA-N	1	0	265.372	4.230	20	30		CIEDRO
N#Cc1ccc(C[NH2+]CCC2CCCC2)c(C(F)(F)F)c1	ZINC000583781902	329477458	/nfs/dbraw/zinc/47/74/58/329477458.db2.gz	IUZCXDLOHXJCLA-UHFFFAOYSA-N	1	0	296.336	4.247	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+][C@@H]1CCOC2(CCCCC2)C1	ZINC000127497572	329599925	/nfs/dbraw/zinc/59/99/25/329599925.db2.gz	CXDIWBCDYUALQT-ARFHVFGLSA-N	1	0	265.441	4.059	20	30		CIEDRO
CC(C)Oc1ccc([C@H]2CCC[C@H]2[NH2+]CC2(C#N)CC2)cc1	ZINC000564071227	329663300	/nfs/dbraw/zinc/66/33/00/329663300.db2.gz	RYHJIMXULNWOQG-QZTJIDSGSA-N	1	0	298.430	4.003	20	30		CIEDRO
C[C@@]1(c2ccccc2)CC[C@H]([NH+]2CCC(CC#N)CC2)C1	ZINC000527105473	329695759	/nfs/dbraw/zinc/69/57/59/329695759.db2.gz	SADSOJLUYHRBOY-RBUKOAKNSA-N	1	0	282.431	4.122	20	30		CIEDRO
C[C@]1(c2ccccc2)CC[C@@H]([NH+]2CCC(CC#N)CC2)C1	ZINC000527105471	329695812	/nfs/dbraw/zinc/69/58/12/329695812.db2.gz	SADSOJLUYHRBOY-MOPGFXCFSA-N	1	0	282.431	4.122	20	30		CIEDRO
CO[C@@H](C[NH2+][C@H](CCCC#N)c1ccccc1)CC(C)C	ZINC000419280431	329717209	/nfs/dbraw/zinc/71/72/09/329717209.db2.gz	JBMBDJYFUHVZOZ-QZTJIDSGSA-N	1	0	288.435	4.072	20	30		CIEDRO
C[C@H](C[NH2+]Cc1ccc(C#N)s1)c1cccc(Cl)c1	ZINC000421355175	329815583	/nfs/dbraw/zinc/81/55/83/329815583.db2.gz	YREVULHOYVTORH-LLVKDONJSA-N	1	0	290.819	4.166	20	30		CIEDRO
C[C@@H]1CCCC[C@H]1[NH2+][C@H](CCC#N)c1ccccc1	ZINC000246306865	329825916	/nfs/dbraw/zinc/82/59/16/329825916.db2.gz	DMBXGNYQGBLAPT-DJIMGWMZSA-N	1	0	256.393	4.200	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@H]1c2ccccc2CC12CCOCC2	ZINC000571929187	329930032	/nfs/dbraw/zinc/93/00/32/329930032.db2.gz	BZKMPUCCQGLYLT-BXWFABGCSA-N	1	0	299.458	4.271	20	30		CIEDRO
C=CCCCCC[N@@H+](C)Cc1cnc([C@H]2CCCO2)s1	ZINC000271203432	330078174	/nfs/dbraw/zinc/07/81/74/330078174.db2.gz	VMOKOBKQRRJNQE-OAHLLOKOSA-N	1	0	294.464	4.173	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@H](C)c1sccc1C)c1ccccc1	ZINC000271487929	330079908	/nfs/dbraw/zinc/07/99/08/330079908.db2.gz	KMLREWCIRAHASD-GDBMZVCRSA-N	1	0	269.413	4.472	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@@H](C)c1sc(C)nc1C)c1ccccc1	ZINC000271496131	330079991	/nfs/dbraw/zinc/07/99/91/330079991.db2.gz	LMHABJWNPIOMSP-XJKSGUPXSA-N	1	0	284.428	4.175	20	30		CIEDRO
C#CC[C@H]([NH2+][C@H](C)c1ccc(C)o1)c1ccccc1	ZINC000271453298	330080195	/nfs/dbraw/zinc/08/01/95/330080195.db2.gz	GMPDXNNPXXDNDH-ZBFHGGJFSA-N	1	0	253.345	4.003	20	30		CIEDRO
C#CC[C@H]([NH2+][C@@H](C)c1ccccc1OC)c1ccccc1	ZINC000271531376	330081195	/nfs/dbraw/zinc/08/11/95/330081195.db2.gz	PRWHJCGWPGYZQU-YJBOKZPZSA-N	1	0	279.383	4.110	20	30		CIEDRO
C#CC[C@H]([NH2+][C@H](C)c1cccs1)c1ccccc1	ZINC000271521836	330081328	/nfs/dbraw/zinc/08/13/28/330081328.db2.gz	ONZYIAZMFMWXLT-HIFRSBDPSA-N	1	0	255.386	4.163	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@@H](C)c1cccs1)c1ccccc1	ZINC000271521835	330081387	/nfs/dbraw/zinc/08/13/87/330081387.db2.gz	ONZYIAZMFMWXLT-DZGCQCFKSA-N	1	0	255.386	4.163	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H](C)c1ccncc1Cl	ZINC000421832333	330091262	/nfs/dbraw/zinc/09/12/62/330091262.db2.gz	GQUHVWTVYIUFPT-VXGBXAGGSA-N	1	0	252.789	4.130	20	30		CIEDRO
C#CC[C@H]([NH2+][C@@H](C)c1ccc(C)cc1O)c1ccccc1	ZINC000273545332	330096895	/nfs/dbraw/zinc/09/68/95/330096895.db2.gz	ZDZKJGGXZOTPKS-YJBOKZPZSA-N	1	0	279.383	4.116	20	30		CIEDRO
CCC[C@@H]([NH2+]Cc1ccc(C#N)s1)c1ccsc1	ZINC000421867519	330099478	/nfs/dbraw/zinc/09/94/78/330099478.db2.gz	CDJFQXLIAJTSHO-CQSZACIVSA-N	1	0	276.430	4.312	20	30		CIEDRO
C=CCC[N@@H+](C)[C@@H](C)c1nc2ccccc2n1C(F)F	ZINC000276402952	330113643	/nfs/dbraw/zinc/11/36/43/330113643.db2.gz	KUBFPMWJMNTDLX-NSHDSACASA-N	1	0	279.334	4.000	20	30		CIEDRO
Cc1ccc(CCC2CC[NH+]([C@@H]3CC[C@@H](C#N)C3)CC2)cc1	ZINC000429725755	330125414	/nfs/dbraw/zinc/12/54/14/330125414.db2.gz	ZRJYWBJKFCHNFO-WOJBJXKFSA-N	1	0	296.458	4.332	20	30		CIEDRO
C=CCC[C@H](N[C@@H]1C[C@H]([NH3+])c2ccccc21)c1ccccc1	ZINC000423002445	330163836	/nfs/dbraw/zinc/16/38/36/330163836.db2.gz	YYXPQYLYPTXIBJ-SLFFLAALSA-N	1	0	292.426	4.428	20	30		CIEDRO
CSc1ccc([C@@H](C)[NH2+]Cc2cccc(C#N)c2)cc1	ZINC000035256458	330244567	/nfs/dbraw/zinc/24/45/67/330244567.db2.gz	UTGZPOAJHIJMQZ-CYBMUJFWSA-N	1	0	282.412	4.131	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)c1ccc(OCCCC)c(OC)c1	ZINC000536858887	330252487	/nfs/dbraw/zinc/25/24/87/330252487.db2.gz	RTHJADCQGBNBAH-LSDHHAIUSA-N	1	0	291.435	4.489	20	30		CIEDRO
C[C@H]1C[C@H](c2ccccc2)[N@H+](CC(C)(C)CCC#N)C1	ZINC000580483917	330256565	/nfs/dbraw/zinc/25/65/65/330256565.db2.gz	WJIOLSDVDZEBDH-DOTOQJQBSA-N	1	0	270.420	4.399	20	30		CIEDRO
C[C@@H]1C[C@H](c2ccccc2)[N@H+](CC(C)(C)CCC#N)C1	ZINC000580483918	330256707	/nfs/dbraw/zinc/25/67/07/330256707.db2.gz	WJIOLSDVDZEBDH-NVXWUHKLSA-N	1	0	270.420	4.399	20	30		CIEDRO
C[C@H]([NH2+]C1CCC(Oc2ccccc2C#N)CC1)C1CCC1	ZINC000527528956	330258180	/nfs/dbraw/zinc/25/81/80/330258180.db2.gz	LRJMCLBRUBFHSD-NNGSBXSVSA-N	1	0	298.430	4.026	20	30		CIEDRO
CC(C)c1ccc([C@H](C)[NH2+][C@@H]2CC[C@H](C#N)C2)cc1	ZINC000424129933	330260154	/nfs/dbraw/zinc/26/01/54/330260154.db2.gz	SKWXIJCVBNMKPL-GRDNDAEWSA-N	1	0	256.393	4.153	20	30		CIEDRO
CC(C)c1ccc([C@@H](C)[NH2+][C@@H]2CC[C@H](C#N)C2)cc1	ZINC000424129938	330260280	/nfs/dbraw/zinc/26/02/80/330260280.db2.gz	SKWXIJCVBNMKPL-JKIFEVAISA-N	1	0	256.393	4.153	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@@H](c3ccccc3)CC2)C1	ZINC000527721426	330277284	/nfs/dbraw/zinc/27/72/84/330277284.db2.gz	NVVAAAWEOSQVIC-OWYHZJEWSA-N	1	0	282.431	4.385	20	30		CIEDRO
CCC(F)(F)C(C)(C)C[NH2+]C1CCC(C)(C#N)CC1	ZINC000527790827	330283571	/nfs/dbraw/zinc/28/35/71/330283571.db2.gz	OUXPYHSEXNZEQO-UHFFFAOYSA-N	1	0	272.383	4.120	20	30		CIEDRO
C[C@H]([NH2+][C@@H](c1ccccn1)C1CCC1)c1cccc(C#N)c1	ZINC000527971282	330301521	/nfs/dbraw/zinc/30/15/21/330301521.db2.gz	ZNNSRIARKIPFID-IFXJQAMLSA-N	1	0	291.398	4.145	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)c1cc(F)ccc1F	ZINC000036921945	330313810	/nfs/dbraw/zinc/31/38/10/330313810.db2.gz	CJYHVYUMRZSTJO-NWDGAFQWSA-N	1	0	286.325	4.248	20	30		CIEDRO
Fc1ccc(C#CC[N@@H+]2CCC[C@H]2c2cccc(F)c2)cc1	ZINC000533001803	330324954	/nfs/dbraw/zinc/32/49/54/330324954.db2.gz	JQJQULFQEWVZBS-IBGZPJMESA-N	1	0	297.348	4.153	20	30		CIEDRO
Cc1ccc(-c2ccc(C[NH2+][C@@H]3CC[C@H](C#N)C3)o2)cc1	ZINC000424202837	330327031	/nfs/dbraw/zinc/32/70/31/330327031.db2.gz	TVQNISVKMMHKSA-GOEBONIOSA-N	1	0	280.371	4.037	20	30		CIEDRO
C=CCCCC[NH2+][C@H](Cc1ccncc1)c1cccs1	ZINC000424279581	330333650	/nfs/dbraw/zinc/33/36/50/330333650.db2.gz	KIZHNLKVTCMFTE-MRXNPFEDSA-N	1	0	286.444	4.373	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@@H](c1ccc(C)cc1)C1CCC1	ZINC000424290878	330334803	/nfs/dbraw/zinc/33/48/03/330334803.db2.gz	CIEQIMVJUWZDOG-GBESFXJTSA-N	1	0	285.431	4.017	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@@H](C)[C@H](C)c1ccc(Cl)cc1	ZINC000424293767	330335513	/nfs/dbraw/zinc/33/55/13/330335513.db2.gz	JFOFPZCNAPHEBF-HPZZRFSDSA-N	1	0	293.838	4.013	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@H](C)c1ccc(-c2ccccc2)o1	ZINC000424297686	330336421	/nfs/dbraw/zinc/33/64/21/330336421.db2.gz	RAYCZBOATLCXMR-PVAVHDDUSA-N	1	0	297.398	4.188	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@@H]2CCc3c2ccc(Cl)c3Cl)C1	ZINC000424316184	330339461	/nfs/dbraw/zinc/33/94/61/330339461.db2.gz	ASWFERCVRYKCJT-IMSIIYSGSA-N	1	0	295.213	4.263	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@H]2CC[C@H](c3ccc(Cl)cc3)C2)C1	ZINC000424317350	330339547	/nfs/dbraw/zinc/33/95/47/330339547.db2.gz	BZBJWQHGLCNEAU-SDNTUTLCSA-N	1	0	288.822	4.258	20	30		CIEDRO
CC(C)[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccccc1Cl	ZINC000424317767	330339681	/nfs/dbraw/zinc/33/96/81/330339681.db2.gz	CFSVVQUWFHCEJM-ZENOOKHLSA-N	1	0	276.811	4.319	20	30		CIEDRO
COc1ccc([C@H](C)[NH2+][C@@H]2CC[C@H](C#N)C2)c2ccccc12	ZINC000424321209	330340164	/nfs/dbraw/zinc/34/01/64/330340164.db2.gz	HDJWQXOYRDXBOM-SOUVJXGZSA-N	1	0	294.398	4.191	20	30		CIEDRO
CCc1c2ccccc2oc1[C@@H](C)[NH2+][C@@H]1CC[C@H](C#N)C1	ZINC000424321674	330340299	/nfs/dbraw/zinc/34/02/99/330340299.db2.gz	HOVBXGXBBHXOOW-HZSPNIEDSA-N	1	0	282.387	4.338	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)[C@H](C)c1nc2ccccc2s1	ZINC000424322710	330340533	/nfs/dbraw/zinc/34/05/33/330340533.db2.gz	ILSXDDVNSRSKQK-RFQIPJPRSA-N	1	0	299.443	4.070	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccccc1C(F)(F)F	ZINC000424323347	330340625	/nfs/dbraw/zinc/34/06/25/330340625.db2.gz	IZPNLHVGILRPNU-GRYCIOLGSA-N	1	0	282.309	4.048	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)[C@@H](C)c1ccc(Cl)cc1	ZINC000424324401	330341029	/nfs/dbraw/zinc/34/10/29/330341029.db2.gz	JVIGKCLGYUBGQY-NFFDBFGFSA-N	1	0	276.811	4.114	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc(OC(F)F)cc1	ZINC000424324885	330341126	/nfs/dbraw/zinc/34/11/26/330341126.db2.gz	KJDPMQIOUNMAAM-NJZAAPMLSA-N	1	0	294.345	4.021	20	30		CIEDRO
C[C@H](CC(C)(C)c1ccccc1)[NH2+][C@@H]1CC[C@H](C#N)C1	ZINC000424335960	330343483	/nfs/dbraw/zinc/34/34/83/330343483.db2.gz	XEVOVJAXODBGFW-HLLBOEOZSA-N	1	0	270.420	4.025	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccccc1OC(F)F	ZINC000424337593	330343497	/nfs/dbraw/zinc/34/34/97/330343497.db2.gz	ZPKYWEFGEUIGPP-OUCADQQQSA-N	1	0	294.345	4.021	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@H](Cc1ccncc1)c1cccs1	ZINC000424344343	330344629	/nfs/dbraw/zinc/34/46/29/330344629.db2.gz	GRXTUGVTUZVARG-OAHLLOKOSA-N	1	0	286.444	4.229	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@H](C2CCC2)C2CCCCC2)C1	ZINC000424354675	330346109	/nfs/dbraw/zinc/34/61/09/330346109.db2.gz	SNBRHIPZJZFOQA-WBAXXEDZSA-N	1	0	274.452	4.407	20	30		CIEDRO
COc1ccc([C@@H](C)[NH2+][C@H]2CC[C@@H](CC#N)C2)c(Cl)c1	ZINC000424359990	330346845	/nfs/dbraw/zinc/34/68/45/330346845.db2.gz	ZCQWCHMAVWLUBF-AGIUHOORSA-N	1	0	292.810	4.082	20	30		CIEDRO
CC(C)[C@H]([NH2+]Cc1ccc(C#N)cc1F)c1ccccc1	ZINC000533223687	330353679	/nfs/dbraw/zinc/35/36/79/330353679.db2.gz	ZZVHFOGCOGYQHC-SFHVURJKSA-N	1	0	282.362	4.184	20	30		CIEDRO
C=C(CC)C[NH+]1CCC(c2c[nH]c3ccccc32)CC1	ZINC000536881436	330360789	/nfs/dbraw/zinc/36/07/89/330360789.db2.gz	LPYNNUKGXHRQOX-UHFFFAOYSA-N	1	0	268.404	4.314	20	30		CIEDRO
COc1ccc(C[N@H+](C)[C@@H](C)c2ccc(C#N)cc2)cc1C	ZINC000118397498	330367026	/nfs/dbraw/zinc/36/70/26/330367026.db2.gz	QKUIWKFVGHROEA-HNNXBMFYSA-N	1	0	294.398	4.068	20	30		CIEDRO
Cc1ccc(C[N@@H+](C)[C@@H](C)c2ccc(C#N)cc2)s1	ZINC000118397278	330367174	/nfs/dbraw/zinc/36/71/74/330367174.db2.gz	MCCLLJAEBKUGPL-ZDUSSCGKSA-N	1	0	270.401	4.121	20	30		CIEDRO
CC[N@H+](CC(C)(C)CCC#N)[C@H](C)c1cccc(OC)c1	ZINC000120167153	330385848	/nfs/dbraw/zinc/38/58/48/330385848.db2.gz	CNTWGFUCHOCASA-OAHLLOKOSA-N	1	0	288.435	4.408	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCCCc1nc(C)cs1)C1CC1	ZINC000120890210	330391972	/nfs/dbraw/zinc/39/19/72/330391972.db2.gz	GXHCGUFGBZWMET-HNNXBMFYSA-N	1	0	278.465	4.109	20	30		CIEDRO
C[C@@H]1CC(C)(C)CC[C@@H]1[NH2+]CCCC(C)(C)C#N	ZINC000120936188	330393355	/nfs/dbraw/zinc/39/33/55/330393355.db2.gz	SQPUGNSJVUOFJD-KGLIPLIRSA-N	1	0	250.430	4.121	20	30		CIEDRO
C[C@H]1CCCC[C@@H]1[NH2+][C@@H](CCC#N)c1ccccc1	ZINC000090665912	330394641	/nfs/dbraw/zinc/39/46/41/330394641.db2.gz	DMBXGNYQGBLAPT-XIRDDKMYSA-N	1	0	256.393	4.200	20	30		CIEDRO
C=CC[C@@H](C)[C@H](C)[NH2+][C@@H](CCC#N)c1ccccc1	ZINC000090665796	330394654	/nfs/dbraw/zinc/39/46/54/330394654.db2.gz	IDDTUCRPHOQNQN-VYDXJSESSA-N	1	0	256.393	4.222	20	30		CIEDRO
C[C@H]1CCCC[C@H]1[NH2+][C@@H](CCC#N)c1ccccc1	ZINC000090665914	330394756	/nfs/dbraw/zinc/39/47/56/330394756.db2.gz	DMBXGNYQGBLAPT-UAGQMJEPSA-N	1	0	256.393	4.200	20	30		CIEDRO
C=CC[C@H](CO)C[NH2+][C@H](C)c1ccc(-c2ccccc2)cc1	ZINC000537092732	330398447	/nfs/dbraw/zinc/39/84/47/330398447.db2.gz	GQCHRPANVQDFDT-SJORKVTESA-N	1	0	295.426	4.189	20	30		CIEDRO
CC[C@H](C)[C@@H]([NH2+]CCCC#N)c1ccc(Cl)cc1	ZINC000537093412	330398647	/nfs/dbraw/zinc/39/86/47/330398647.db2.gz	LVZXLNSOXNIHGH-SWLSCSKDSA-N	1	0	264.800	4.321	20	30		CIEDRO
CC(C)c1ccc(CC[NH2+]Cc2cc(C#N)cs2)cc1	ZINC000537213427	330420012	/nfs/dbraw/zinc/42/00/12/330420012.db2.gz	WAGKNMXUNSGMOK-UHFFFAOYSA-N	1	0	284.428	4.075	20	30		CIEDRO
C[C@H]([NH2+]CCCSc1ccccc1)c1ccc(C#N)cc1	ZINC000537289445	330431072	/nfs/dbraw/zinc/43/10/72/330431072.db2.gz	WPHCHHRZEMVGEL-HNNXBMFYSA-N	1	0	296.439	4.391	20	30		CIEDRO
CC(C)CC1(C[NH2+][C@H](C)c2ccc(C#N)c(F)c2)CC1	ZINC000537407314	330434906	/nfs/dbraw/zinc/43/49/06/330434906.db2.gz	OBFNXLQUQSEZPB-CYBMUJFWSA-N	1	0	274.383	4.174	20	30		CIEDRO
C=CC[NH+]1CCC(c2c[nH]c3c2cccc3CC)CC1	ZINC000515743428	330482153	/nfs/dbraw/zinc/48/21/53/330482153.db2.gz	OUCDOLNJDSTZFR-UHFFFAOYSA-N	1	0	268.404	4.096	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@@H](C)[C@@H]1C)c1cccc(C#N)c1	ZINC000217897339	330487735	/nfs/dbraw/zinc/48/77/35/330487735.db2.gz	ZXBFAYZRRWDOFZ-XJIUQZFPSA-N	1	0	256.393	4.034	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H](C)[C@@H](C)C1)c1cccc(C#N)c1	ZINC000085041164	330488067	/nfs/dbraw/zinc/48/80/67/330488067.db2.gz	XDBKYHJOTPRGCH-AYMQEEERSA-N	1	0	256.393	4.034	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@@H](C)[C@@H]1OCCc2sccc21	ZINC000426341693	330505023	/nfs/dbraw/zinc/50/50/23/330505023.db2.gz	FCUDMOYQTFTPJG-ZQIUZPCESA-N	1	0	293.476	4.475	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@@H](C)CCc1ccc(OC)c(O)c1	ZINC000426364607	330505629	/nfs/dbraw/zinc/50/56/29/330505629.db2.gz	IBUIFGGFJPYHPS-CABCVRRESA-N	1	0	291.435	4.056	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1cccc(F)c1C#N)c1ccccc1	ZINC000428357351	330521144	/nfs/dbraw/zinc/52/11/44/330521144.db2.gz	YFVPGDTVEZFUPG-IBGZPJMESA-N	1	0	294.373	4.494	20	30		CIEDRO
CC(C)[C@@H]([NH2+]Cc1cccc(F)c1C#N)c1ccccc1	ZINC000428468998	330526058	/nfs/dbraw/zinc/52/60/58/330526058.db2.gz	RBUOWLYVPGRLFB-GOSISDBHSA-N	1	0	282.362	4.184	20	30		CIEDRO
CC(C)(C)[C@H]1CCC[C@@H]([NH2+]CC2(CC#N)CC2)CC1	ZINC000430063796	330558377	/nfs/dbraw/zinc/55/83/77/330558377.db2.gz	BBGIDPDUYYXZSK-LSDHHAIUSA-N	1	0	262.441	4.265	20	30		CIEDRO
C[C@@H]([NH2+]CC1(CC#N)CC1)c1cc2cc(Cl)ccc2o1	ZINC000430738774	330572076	/nfs/dbraw/zinc/57/20/76/330572076.db2.gz	LOLJGPADZRXFPW-LLVKDONJSA-N	1	0	288.778	4.431	20	30		CIEDRO
CC[C@H]([NH2+]CC1(CC#N)CC1)c1cccc(Cl)c1	ZINC000430744898	330572546	/nfs/dbraw/zinc/57/25/46/330572546.db2.gz	UWSXRLPKVNWWSG-AWEZNQCLSA-N	1	0	262.784	4.075	20	30		CIEDRO
Cc1nc(C[NH2+][C@@H](CCCC#N)c2ccccc2)c(C)s1	ZINC000433023538	330612769	/nfs/dbraw/zinc/61/27/69/330612769.db2.gz	QWCKDWZHJSDQGC-INIZCTEOSA-N	1	0	299.443	4.285	20	30		CIEDRO
C=CCC[C@@H](CC)Nc1cccc2c1OCC[C@@H]2[NH+](C)C	ZINC000435038538	330648584	/nfs/dbraw/zinc/64/85/84/330648584.db2.gz	SZRHNVZWKVXUCN-PBHICJAKSA-N	1	0	288.435	4.229	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+][C@@H](C)c1ccc(C(C)C)cc1	ZINC000435665028	330659796	/nfs/dbraw/zinc/65/97/96/330659796.db2.gz	OPADLOKUSFAICX-SNRMKQJTSA-N	1	0	287.447	4.442	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+][C@@H](CCC)c1ccccc1	ZINC000436291999	330673910	/nfs/dbraw/zinc/67/39/10/330673910.db2.gz	RNRNCNHKODUHRC-BZSNNMDCSA-N	1	0	273.420	4.099	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+][C@H](C)c1ccc(CCC)cc1	ZINC000436306181	330675051	/nfs/dbraw/zinc/67/50/51/330675051.db2.gz	JVTNDDCHDSLPKX-MNEFBYGVSA-N	1	0	287.447	4.271	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@@H]1CCC[C@H]1CCC(C)C	ZINC000436318495	330675679	/nfs/dbraw/zinc/67/56/79/330675679.db2.gz	YNHMSNRPIDAITQ-MLHJIOFPSA-N	1	0	279.468	4.162	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCc1nc(C(C)(C)C)cs1)C1CC1	ZINC000438977158	330731681	/nfs/dbraw/zinc/73/16/81/330731681.db2.gz	JOCYUKKIAXMISL-CQSZACIVSA-N	1	0	292.492	4.318	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@H]1SCCc2ccccc21)C1CC1	ZINC000438984321	330731923	/nfs/dbraw/zinc/73/19/23/330731923.db2.gz	JYXBDSXRHXNHEV-QZTJIDSGSA-N	1	0	287.472	4.351	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(C#N)cc1Cl)C(C)(C)C	ZINC000439451180	330738343	/nfs/dbraw/zinc/73/83/43/330738343.db2.gz	LARTYRDDHIUIEN-AWEZNQCLSA-N	1	0	264.800	4.126	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H](c2ccccc2)C2CC2)c(Cl)c1	ZINC000439457051	330738561	/nfs/dbraw/zinc/73/85/61/330738561.db2.gz	PPCVAOQHKMVUIT-SFHVURJKSA-N	1	0	296.801	4.453	20	30		CIEDRO
CC[C@@H](C[NH2+]CC1CCC(C#N)CC1)c1ccccc1	ZINC000441332900	330765884	/nfs/dbraw/zinc/76/58/84/330765884.db2.gz	LCWGGBCGQNTMMJ-JCYILVPMSA-N	1	0	270.420	4.100	20	30		CIEDRO
CCCc1cccc(C[NH2+]CC2CCC(C#N)CC2)c1	ZINC000441360941	330766680	/nfs/dbraw/zinc/76/66/80/330766680.db2.gz	SRLUINDRCCRGLT-UHFFFAOYSA-N	1	0	270.420	4.059	20	30		CIEDRO
CC(C)[C@@H](C[NH2+]CC1CCC(C#N)CC1)c1ccccc1	ZINC000441381726	330767381	/nfs/dbraw/zinc/76/73/81/330767381.db2.gz	JBTKQGORKZQDQB-FAFZWHIHSA-N	1	0	284.447	4.346	20	30		CIEDRO
C=C[C@@H](C)[NH2+][C@@H](CC)c1ccc(Br)cc1	ZINC000157297440	330772787	/nfs/dbraw/zinc/77/27/87/330772787.db2.gz	XIHLTQGEUVEETE-MFKMUULPSA-N	1	0	268.198	4.064	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@H](c2ccc(Cl)cc2)C2CCC2)C1	ZINC000442779236	330782355	/nfs/dbraw/zinc/78/23/55/330782355.db2.gz	CRUYWRYIHQJIPC-DQYPLSBCSA-N	1	0	288.822	4.463	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH2+][C@@H](c2cccc(F)c2)C2CCCC2)C1	ZINC000442793054	330784037	/nfs/dbraw/zinc/78/40/37/330784037.db2.gz	PHRPFIQUABWNBH-FSPWUOQZSA-N	1	0	286.394	4.339	20	30		CIEDRO
CCC(CC)(C[NH2+][C@H]1CC[C@H](C#N)C1)c1ccccc1	ZINC000442798179	330784407	/nfs/dbraw/zinc/78/44/07/330784407.db2.gz	YDMIJIRYYBEBQK-RDJZCZTQSA-N	1	0	270.420	4.026	20	30		CIEDRO
CC[C@@H]1CC[C@H](C)C[C@H]1[NH2+]CC1CCC(C#N)CC1	ZINC000442875947	330789743	/nfs/dbraw/zinc/78/97/43/330789743.db2.gz	XGIDYBVKKKVFLN-LMCYLSQRSA-N	1	0	262.441	4.121	20	30		CIEDRO
CCC[C@H](C)[C@@H](CC)[NH2+]CC1CCC(C#N)CC1	ZINC000442876913	330789783	/nfs/dbraw/zinc/78/97/83/330789783.db2.gz	SKHHYIVQYIYBEB-SLTXQBBLSA-N	1	0	250.430	4.121	20	30		CIEDRO
Cc1cc(C[NH2+][C@H]2CCc3c2cccc3Cl)ccc1C#N	ZINC000443978451	330808287	/nfs/dbraw/zinc/80/82/87/330808287.db2.gz	KJOUFOORMIBEBC-SFHVURJKSA-N	1	0	296.801	4.297	20	30		CIEDRO
C=C[C@H](C)[NH2+]Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1	ZINC000157900950	330809633	/nfs/dbraw/zinc/80/96/33/330809633.db2.gz	CIWVMIGJIMJDHB-QMMMGPOBSA-N	1	0	297.242	4.388	20	30		CIEDRO
Cc1ccccc1[C@@H](CC(F)(F)F)[NH2+]CCCCC#N	ZINC000444790741	330825866	/nfs/dbraw/zinc/82/58/66/330825866.db2.gz	KIBDXAJORKQSGX-CQSZACIVSA-N	1	0	284.325	4.272	20	30		CIEDRO
C=CCCCCC[NH2+][C@@H](C)c1cccc(NC(C)=O)c1	ZINC000194358941	330842057	/nfs/dbraw/zinc/84/20/57/330842057.db2.gz	PSSRXULBFYYQAX-AWEZNQCLSA-N	1	0	274.408	4.042	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CCCC[C@@H]1C)c1ccc(C#N)cc1	ZINC000447522175	330867718	/nfs/dbraw/zinc/86/77/18/330867718.db2.gz	YARXVMICZSSUDC-JQFCIGGWSA-N	1	0	256.393	4.178	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CCC[C@H](SC)C1)c1ccc(C#N)cc1	ZINC000447538154	330868836	/nfs/dbraw/zinc/86/88/36/330868836.db2.gz	APTJTCPJJCBCOD-IKGGRYGDSA-N	1	0	288.460	4.273	20	30		CIEDRO
Cc1ccccc1[C@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)C(C)C	ZINC000447543940	330869414	/nfs/dbraw/zinc/86/94/14/330869414.db2.gz	UHQSYIXOCGWKFC-LZLYRXPVSA-N	1	0	270.420	4.364	20	30		CIEDRO
Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH2+][C@@H]1CCC[C@H](C#N)C1	ZINC000447545591	330869487	/nfs/dbraw/zinc/86/94/87/330869487.db2.gz	ROMQPTJLFJZFPO-LZWOXQAQSA-N	1	0	286.419	4.274	20	30		CIEDRO
CC1(C#N)CCC([NH2+]CCc2ccc3ccccc3c2)CC1	ZINC000449100541	330899100	/nfs/dbraw/zinc/89/91/00/330899100.db2.gz	BSBGFUPPCMEINZ-UHFFFAOYSA-N	1	0	292.426	4.444	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000449127562	330900522	/nfs/dbraw/zinc/90/05/22/330900522.db2.gz	WKMSJHMBPLCEIY-YBXZHIRMSA-N	1	0	282.431	4.385	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000449127359	330900637	/nfs/dbraw/zinc/90/06/37/330900637.db2.gz	WKMSJHMBPLCEIY-CXUOOODFSA-N	1	0	282.431	4.385	20	30		CIEDRO
Cc1ccc(C[C@@H](C)[NH2+]C2CCC(C)(C#N)CC2)c(C)c1	ZINC000449140852	330901437	/nfs/dbraw/zinc/90/14/37/330901437.db2.gz	OJGCODNRTPHFIP-IPJUCJBFSA-N	1	0	284.447	4.297	20	30		CIEDRO
CCS[C@H]1CCC[C@@H]([NH2+]C2CCC(C)(C#N)CC2)C1	ZINC000449181338	330904188	/nfs/dbraw/zinc/90/41/88/330904188.db2.gz	GRWCEQNPLMPYAX-FYRZTWFESA-N	1	0	280.481	4.113	20	30		CIEDRO
CC(C)C1CCC([NH2+]C2CCC(C)(C#N)CC2)CC1	ZINC000449196154	330905538	/nfs/dbraw/zinc/90/55/38/330905538.db2.gz	RVBZOGMWVNLHDE-UHFFFAOYSA-N	1	0	262.441	4.263	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+]C[C@H](C)c1nc(C)cs1	ZINC000449238882	330908631	/nfs/dbraw/zinc/90/86/31/330908631.db2.gz	TYPSZPAVOVNDEP-QWHCGFSZSA-N	1	0	266.454	4.280	20	30		CIEDRO
CC(C)(C#N)C[NH2+][C@H]1CC[C@@H](c2ccc(Cl)cc2)C1	ZINC000449241067	330908961	/nfs/dbraw/zinc/90/89/61/330908961.db2.gz	QVIHRFPZQKGQNL-HIFRSBDPSA-N	1	0	276.811	4.115	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+]Cc1ncc(-c2ccccc2)cn1	ZINC000449247125	330909426	/nfs/dbraw/zinc/90/94/26/330909426.db2.gz	FHLIXJNXPAREQT-MRXNPFEDSA-N	1	0	295.430	4.368	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[C@@H](c3ccc(Cl)cc3)C2)C1	ZINC000449246535	330909430	/nfs/dbraw/zinc/90/94/30/330909430.db2.gz	BZBJWQHGLCNEAU-QIJZBDPFSA-N	1	0	288.822	4.258	20	30		CIEDRO
Cc1ccc(C2(C[NH2+][C@H]3CCC[C@@H](C#N)C3)CC2)c(C)c1	ZINC000449380294	330921045	/nfs/dbraw/zinc/92/10/45/330921045.db2.gz	VXRIIUXIGPOENR-SJORKVTESA-N	1	0	282.431	4.007	20	30		CIEDRO
C=CC[C@@H](C)[C@@H](C)[NH2+]C1CCC(CSC)CC1	ZINC000449419566	330924380	/nfs/dbraw/zinc/92/43/80/330924380.db2.gz	BJIJPXLVHPNFLR-LMRVLLHPSA-N	1	0	255.471	4.099	20	30		CIEDRO
CC(C)Cc1ccc(C[NH2+][C@H]2CC[C@@H](CC#N)C2)cc1	ZINC000449446220	330926370	/nfs/dbraw/zinc/92/63/70/330926370.db2.gz	PAFZALLHXQFVMN-WMZOPIPTSA-N	1	0	270.420	4.057	20	30		CIEDRO
CC(C)C1CCC(C[NH2+][C@H]2CC[C@@H](CC#N)C2)CC1	ZINC000449447255	330926432	/nfs/dbraw/zinc/92/64/32/330926432.db2.gz	YDPXUJOYTAWPNP-OTBWCIGPSA-N	1	0	262.441	4.121	20	30		CIEDRO
C[C@H]([NH2+]C1CCC(C)(C#N)CC1)[C@@H]1CCC[C@H](C)C1	ZINC000449765775	330948654	/nfs/dbraw/zinc/94/86/54/330948654.db2.gz	KMGHTDJVLBOERG-CGLCSIQHSA-N	1	0	262.441	4.263	20	30		CIEDRO
N#CC1(C[NH2+][C@H](c2ccccc2)C2CCCC2)CCC1	ZINC000450550524	330985920	/nfs/dbraw/zinc/98/59/20/330985920.db2.gz	BWMUYABHEXUPKL-QGZVFWFLSA-N	1	0	268.404	4.201	20	30		CIEDRO
N#CC1(C[NH2+][C@H](Cc2ccccc2)c2cccs2)CCC1	ZINC000450730368	330996651	/nfs/dbraw/zinc/99/66/51/330996651.db2.gz	WDGLAIFHRJMOLF-MRXNPFEDSA-N	1	0	296.439	4.315	20	30		CIEDRO
C=CCCC[C@H](C)[NH+]1CCC(F)(c2ccccn2)CC1	ZINC000450932399	331007864	/nfs/dbraw/zinc/00/78/64/331007864.db2.gz	RMUJRAJCZBWSEN-HNNXBMFYSA-N	1	0	276.399	4.087	20	30		CIEDRO
N#CC1(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H](c2ccccc2)C3)CCC1	ZINC000450941365	331008147	/nfs/dbraw/zinc/00/81/47/331008147.db2.gz	SJVOJTYRRLBVGD-BCDXTJNWSA-N	1	0	280.415	4.091	20	30		CIEDRO
CCO[C@@H]1C[C@@H]([NH2+]CCCCC(C)(C)C#N)C12CCCC2	ZINC000450968166	331009216	/nfs/dbraw/zinc/00/92/16/331009216.db2.gz	JZYUIIINAYPZNG-HZPDHXFCSA-N	1	0	292.467	4.034	20	30		CIEDRO
N#CCCC[C@@H]([NH2+]C[C@H]1CCC(F)(F)C1)c1ccccc1	ZINC000451060382	331014146	/nfs/dbraw/zinc/01/41/46/331014146.db2.gz	FTIXMOSURGJORX-GOEBONIOSA-N	1	0	292.373	4.447	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)CCCC(F)(F)F)c1ccc(C#N)cc1	ZINC000163285659	331015504	/nfs/dbraw/zinc/01/55/04/331015504.db2.gz	MQOLOQAYPPDBCZ-NWDGAFQWSA-N	1	0	284.325	4.330	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)c1ccccc1C(F)(F)F	ZINC000163315442	331020025	/nfs/dbraw/zinc/02/00/25/331020025.db2.gz	CNLWHTWXRWMRLK-WDEREUQCSA-N	1	0	257.299	4.321	20	30		CIEDRO
C[C@H]1C[C@@H](C(F)(F)F)CC[N@@H+]1CCCCC(C)(C)C#N	ZINC000451408223	331027983	/nfs/dbraw/zinc/02/79/83/331027983.db2.gz	NEXCKQDRLLCOSB-STQMWFEESA-N	1	0	290.373	4.369	20	30		CIEDRO
C=C(C)COCC[NH2+][C@@H](C)c1ccc(C(C)C)cc1	ZINC000163520522	331050095	/nfs/dbraw/zinc/05/00/95/331050095.db2.gz	TZJFALVIGPIHGO-HNNXBMFYSA-N	1	0	261.409	4.053	20	30		CIEDRO
C[C@@H](CCCc1cccnc1)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000453080208	331087242	/nfs/dbraw/zinc/08/72/42/331087242.db2.gz	ZUFOQZZVRKZZAI-HOTGVXAUSA-N	1	0	293.414	4.015	20	30		CIEDRO
C=CCC[C@@H]([NH2+][C@H](C)c1nccn1CC)c1ccccc1	ZINC000453178193	331097569	/nfs/dbraw/zinc/09/75/69/331097569.db2.gz	SDMUWZRNHABEOV-NVXWUHKLSA-N	1	0	283.419	4.261	20	30		CIEDRO
C=CCCCC[NH2+][C@H](C)c1ncc(-c2ccccc2)n1C	ZINC000453200440	331100692	/nfs/dbraw/zinc/10/06/92/331100692.db2.gz	RDCREBRIVJXFAH-OAHLLOKOSA-N	1	0	283.419	4.094	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@H]1CC[C@@H](C)c2ccsc21	ZINC000453207071	331101499	/nfs/dbraw/zinc/10/14/99/331101499.db2.gz	FYCYMELSPUYSAL-VDERGJSUSA-N	1	0	291.460	4.257	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@H](C)c1cc(-c2ccccc2)nn1C	ZINC000453210433	331101715	/nfs/dbraw/zinc/10/17/15/331101715.db2.gz	JTKXILLALLMURB-GDBMZVCRSA-N	1	0	283.419	4.092	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@@H](C)c1cc(-c2ccccc2)nn1C	ZINC000453210434	331101800	/nfs/dbraw/zinc/10/18/00/331101800.db2.gz	JTKXILLALLMURB-GOEBONIOSA-N	1	0	283.419	4.092	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@@H]1CCCCC1(F)F)C1CC1	ZINC000453260953	331108775	/nfs/dbraw/zinc/10/87/75/331108775.db2.gz	YHTZAUIDZWSQQC-UONOGXRCSA-N	1	0	257.368	4.146	20	30		CIEDRO
Cc1ccc(C)c([C@H](C)[NH2+][C@H]2CC[C@@H](CC#N)C2)c1	ZINC000453282958	331110748	/nfs/dbraw/zinc/11/07/48/331110748.db2.gz	DHKLCXKSFCYHNR-JYJNAYRXSA-N	1	0	256.393	4.036	20	30		CIEDRO
CCC[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)C1CCCCC1	ZINC000453287551	331111436	/nfs/dbraw/zinc/11/14/36/331111436.db2.gz	GOANDUNLQAWRRA-XIRDDKMYSA-N	1	0	262.441	4.407	20	30		CIEDRO
CC(C)[C@H]1CC[C@@H](C)C[C@@H]1[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000453294093	331112258	/nfs/dbraw/zinc/11/22/58/331112258.db2.gz	QSSZNFCKSYDXJP-HMDCTGQHSA-N	1	0	262.441	4.119	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@H](C)c1ccc(SC)c(OC)c1	ZINC000453305411	331113794	/nfs/dbraw/zinc/11/37/94/331113794.db2.gz	ICSAOAUBEHEBPJ-GFCCVEGCSA-N	1	0	279.449	4.280	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@@H](C)c1sc(C(C)C)nc1C	ZINC000453306956	331114120	/nfs/dbraw/zinc/11/41/20/331114120.db2.gz	KSYOPNNAVRHUNH-NSHDSACASA-N	1	0	266.454	4.438	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@@H](C)c1csc(C(C)C)n1	ZINC000453309598	331114500	/nfs/dbraw/zinc/11/45/00/331114500.db2.gz	PZSMSRQOCLZRKI-NSHDSACASA-N	1	0	252.427	4.129	20	30		CIEDRO
C=C[C@@H]1OCCC[C@H]1[NH2+][C@H](CC)c1ccc(Cl)s1	ZINC000453335069	331118243	/nfs/dbraw/zinc/11/82/43/331118243.db2.gz	FMBHGONWWULMJQ-UTUOFQBUSA-N	1	0	285.840	4.176	20	30		CIEDRO
C[C@@H]1CCc2ccccc2[C@@H]1[NH2+]Cc1ccc(C#N)c(F)c1	ZINC000453369123	331123772	/nfs/dbraw/zinc/12/37/72/331123772.db2.gz	FHFFIUJELHMOKX-BFUOFWGJSA-N	1	0	294.373	4.111	20	30		CIEDRO
C=C[C@@H]1OCCC[C@H]1[NH2+][C@@H]1CC[C@@H](C)c2ccsc21	ZINC000453374850	331124443	/nfs/dbraw/zinc/12/44/43/331124443.db2.gz	WXRGOTFMVXLENL-NGFQHRJXSA-N	1	0	277.433	4.010	20	30		CIEDRO
CCC[C@@H]([NH2+]Cc1ccc(C#N)c(F)c1)c1ccsc1	ZINC000453391176	331127306	/nfs/dbraw/zinc/12/73/06/331127306.db2.gz	SNEIFIMTRVVWIG-MRXNPFEDSA-N	1	0	288.391	4.390	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCOC(C)(C)CC)c1ccco1	ZINC000453407195	331129423	/nfs/dbraw/zinc/12/94/23/331129423.db2.gz	LUYGDDUMWFZANA-CQSZACIVSA-N	1	0	265.397	4.082	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+][C@@H]1CCO[C@@H](c2cccs2)C1	ZINC000453443130	331131986	/nfs/dbraw/zinc/13/19/86/331131986.db2.gz	YITKFYDERRYOFO-RBSFLKMASA-N	1	0	279.449	4.303	20	30		CIEDRO
CC(C)(CC#N)C[NH2+]Cc1ccc(Cl)cc1Cl	ZINC000459683615	331294221	/nfs/dbraw/zinc/29/42/21/331294221.db2.gz	CKQXRTHTZSMGRW-UHFFFAOYSA-N	1	0	271.191	4.023	20	30		CIEDRO
CC(C)(CC#N)C[NH2+][C@H]1CCCC[C@@H]1c1ccccc1	ZINC000459684234	331294296	/nfs/dbraw/zinc/29/42/96/331294296.db2.gz	BUGZQLLFTLHCDM-SJORKVTESA-N	1	0	270.420	4.242	20	30		CIEDRO
CC(C)(CC#N)C[NH2+]Cc1cc(Cl)cc(Cl)c1	ZINC000459694931	331294810	/nfs/dbraw/zinc/29/48/10/331294810.db2.gz	OGCKTRIKLAAFCR-UHFFFAOYSA-N	1	0	271.191	4.023	20	30		CIEDRO
C[N@H+](CCC(C)(C)C#N)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000459699067	331294981	/nfs/dbraw/zinc/29/49/81/331294981.db2.gz	LMZUISNZDMSVFQ-SJORKVTESA-N	1	0	270.420	4.194	20	30		CIEDRO
CC(C)(CC#N)C[NH2+][C@H]1CC=C(c2ccc(F)cc2)CC1	ZINC000459731210	331296561	/nfs/dbraw/zinc/29/65/61/331296561.db2.gz	MVZUKKNSXZVTBZ-KRWDZBQOSA-N	1	0	286.394	4.291	20	30		CIEDRO
CC(C)C[C@@H](Cc1cccc(Cl)c1)[NH2+]C[C@H](C)C#N	ZINC000545899585	331313946	/nfs/dbraw/zinc/31/39/46/331313946.db2.gz	HBSBBONUAHTBSO-CJNGLKHVSA-N	1	0	278.827	4.046	20	30		CIEDRO
CC(C)C[C@H](Cc1cccc(Cl)c1)[NH2+]C[C@@H](C)C#N	ZINC000545899587	331314907	/nfs/dbraw/zinc/31/49/07/331314907.db2.gz	HBSBBONUAHTBSO-XJKSGUPXSA-N	1	0	278.827	4.046	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+]C[C@H](c1ccc(C)o1)N1CCCC1	ZINC000461886438	331315127	/nfs/dbraw/zinc/31/51/27/331315127.db2.gz	UKHPGXAYWOHERA-IAGOWNOFSA-N	1	0	290.451	4.059	20	30		CIEDRO
CCC[C@@H](CCc1ccccc1)[NH2+][C@@H](CC)CC#N	ZINC000462065606	331316990	/nfs/dbraw/zinc/31/69/90/331316990.db2.gz	NKXGVHPRPJJEBT-IRXDYDNUSA-N	1	0	258.409	4.070	20	30		CIEDRO
CC#CCC[N@@H+]1CCCC[C@H]1c1cc2ccccc2[nH]1	ZINC000462347726	331320211	/nfs/dbraw/zinc/32/02/11/331320211.db2.gz	RVVWIHGYAXCIHL-SFHVURJKSA-N	1	0	266.388	4.108	20	30		CIEDRO
C[C@H]([NH2+]CC1(C#N)CC1)c1ccc(Cl)c2ccccc21	ZINC000462446532	331322273	/nfs/dbraw/zinc/32/22/73/331322273.db2.gz	KRMYDVSMIVQYFL-LBPRGKRZSA-N	1	0	284.790	4.448	20	30		CIEDRO
CC#CCC[N@@H+]1CCC[C@@H]1c1ccc(Br)s1	ZINC000462477003	331322614	/nfs/dbraw/zinc/32/26/14/331322614.db2.gz	XAMNXHVCWJWIGJ-LLVKDONJSA-N	1	0	298.249	4.061	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(C#N)cc1)C(C)(C)c1ccccc1	ZINC000462731277	331325943	/nfs/dbraw/zinc/32/59/43/331325943.db2.gz	WNRWNWPIEPRXLJ-IBGZPJMESA-N	1	0	292.426	4.404	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccc(C#N)cc1)C(C)(C)c1ccccc1	ZINC000462731386	331326001	/nfs/dbraw/zinc/32/60/01/331326001.db2.gz	WNRWNWPIEPRXLJ-LJQANCHMSA-N	1	0	292.426	4.404	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H](C)C[C@@H](C)CC)cc1OC	ZINC000462734783	331326184	/nfs/dbraw/zinc/32/61/84/331326184.db2.gz	OUOROBIRWZKJIX-LSDHHAIUSA-N	1	0	291.435	4.174	20	30		CIEDRO
CC[N@H+](Cc1cccc(OCCCC#N)c1)CC(C)(C)C	ZINC000462829875	331331936	/nfs/dbraw/zinc/33/19/36/331331936.db2.gz	ONTQMGOTRRWXBH-UHFFFAOYSA-N	1	0	288.435	4.237	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccc(C(F)F)cc1)C1CC1	ZINC000462840549	331332261	/nfs/dbraw/zinc/33/22/61/331332261.db2.gz	RUFZVMVCGSKIIT-HNNXBMFYSA-N	1	0	265.347	4.459	20	30		CIEDRO
C[C@@H](Nc1cc2c(c[nH+]1)CCCC2)c1ccc(C#N)cc1	ZINC000462946295	331335681	/nfs/dbraw/zinc/33/56/81/331335681.db2.gz	OSRBUZLDSQCQLW-CYBMUJFWSA-N	1	0	277.371	4.005	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)c1ccc(OC(C)(C)C)cc1	ZINC000463031535	331337785	/nfs/dbraw/zinc/33/77/85/331337785.db2.gz	XXSWITFXAJLITH-UONOGXRCSA-N	1	0	261.409	4.479	20	30		CIEDRO
CC(C)c1ccc(C[C@@H](C)[NH2+][C@@H]2CCC[C@H](C#N)C2)cc1	ZINC000463238203	331343597	/nfs/dbraw/zinc/34/35/97/331343597.db2.gz	PCGNVQJFJDLGAJ-HHXXYDBFSA-N	1	0	284.447	4.413	20	30		CIEDRO
Cc1ccc([C@H]([NH2+][C@@H]2CCC[C@H](C#N)C2)C2CC2)cc1	ZINC000463277968	331344777	/nfs/dbraw/zinc/34/47/77/331344777.db2.gz	AVOYQPAFXRTURC-QGTPRVQTSA-N	1	0	268.404	4.118	20	30		CIEDRO
CC(C)[C@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1ccccc1	ZINC000463278485	331344897	/nfs/dbraw/zinc/34/48/97/331344897.db2.gz	CKALYZMKLRCTCY-XIRDDKMYSA-N	1	0	256.393	4.056	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@H]2CCCC[C@H]2c2ccccc2)C1	ZINC000463279646	331344920	/nfs/dbraw/zinc/34/49/20/331344920.db2.gz	KIDNYCFDVJJVHA-BVBHFADKSA-N	1	0	282.431	4.385	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@@H]2CCCC[C@H]2Cc2ccccc2)C1	ZINC000463286467	331345124	/nfs/dbraw/zinc/34/51/24/331345124.db2.gz	VYXZBCRKGHWMMV-FUMNGEBKSA-N	1	0	296.458	4.460	20	30		CIEDRO
CC(C)(C[NH2+][C@H]1CCC[C@H](C#N)C1)c1cccc(Cl)c1	ZINC000463284749	331345144	/nfs/dbraw/zinc/34/51/44/331345144.db2.gz	WDPRAZFLQFYQMD-BBRMVZONSA-N	1	0	290.838	4.290	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+]CCc2cc(Cl)cc(Cl)c2)C1	ZINC000463287218	331345353	/nfs/dbraw/zinc/34/53/53/331345353.db2.gz	JHLDKFOADFWLAI-WFASDCNBSA-N	1	0	297.229	4.208	20	30		CIEDRO
CC(C)CC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCC[C@H](C#N)C1	ZINC000463291443	331345390	/nfs/dbraw/zinc/34/53/90/331345390.db2.gz	ZXSIBOWTQUWYEU-QAETUUGQSA-N	1	0	262.441	4.263	20	30		CIEDRO
CC1(C)CC[C@H]([NH2+][C@@H]2CCC[C@@H](C#N)C2)c2ccccc21	ZINC000463292986	331345609	/nfs/dbraw/zinc/34/56/09/331345609.db2.gz	BLWRCWMBSNIXLS-RKVPGOIHSA-N	1	0	282.431	4.471	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+]CCCCCOC2CCCCC2)C1	ZINC000463295997	331345704	/nfs/dbraw/zinc/34/57/04/331345704.db2.gz	BEYARNVOZWIJFE-SJORKVTESA-N	1	0	292.467	4.178	20	30		CIEDRO
CC1(C)[C@@H]([NH2+]Cc2cccc(C#N)c2)C[C@H]1c1ccccc1	ZINC000463542619	331349298	/nfs/dbraw/zinc/34/92/98/331349298.db2.gz	MBAISQOPNJKHSM-OALUTQOASA-N	1	0	290.410	4.230	20	30		CIEDRO
C=C(C[NH2+][C@@H]1CCC[C@H]1CCCF)c1ccccc1	ZINC000510675155	332910775	/nfs/dbraw/zinc/91/07/75/332910775.db2.gz	MPDJYUGSBVGAIX-DLBZAZTESA-N	1	0	261.384	4.208	20	30		CIEDRO
CC[N@H+](CCCCC#N)[C@@H](Cc1ccc(F)cc1)C(C)C	ZINC000464777243	331367728	/nfs/dbraw/zinc/36/77/28/331367728.db2.gz	UUORIAIWAOJWMI-SFHVURJKSA-N	1	0	290.426	4.409	20	30		CIEDRO
CC[N@H+](CCCC#N)[C@@H](Cc1ccc(F)cc1)C(C)C	ZINC000464782066	331367836	/nfs/dbraw/zinc/36/78/36/331367836.db2.gz	XPENELTYBBGTGM-KRWDZBQOSA-N	1	0	276.399	4.018	20	30		CIEDRO
N#C[C@H](c1ccccc1)[C@H]1CCC[N@@H+]1CCc1ccccc1	ZINC000464814129	331369273	/nfs/dbraw/zinc/36/92/73/331369273.db2.gz	KXCZFGUUOMDIAC-WOJBJXKFSA-N	1	0	290.410	4.001	20	30		CIEDRO
CCC[C@]1(C)CCC[N@H+](Cc2ccc(F)cc2C#N)C1	ZINC000464850432	331371121	/nfs/dbraw/zinc/37/11/21/331371121.db2.gz	PIERKVYTFHSGBO-QGZVFWFLSA-N	1	0	274.383	4.100	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1ccc(N(C)c2ccccc2)nc1	ZINC000466382383	331394114	/nfs/dbraw/zinc/39/41/14/331394114.db2.gz	GHTZNZCMAFMMNQ-KRWDZBQOSA-N	1	0	295.430	4.294	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1ccc(OC(F)F)c(Cl)c1	ZINC000466382986	331394172	/nfs/dbraw/zinc/39/41/72/331394172.db2.gz	JENYZQKAIOUTEA-LLVKDONJSA-N	1	0	289.753	4.386	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1cc(C(F)(F)F)ccc1F	ZINC000466385310	331394238	/nfs/dbraw/zinc/39/42/38/331394238.db2.gz	CUERODSDOCWWER-LBPRGKRZSA-N	1	0	275.289	4.289	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1cccc(-c2ccccn2)c1	ZINC000466386422	331394380	/nfs/dbraw/zinc/39/43/80/331394380.db2.gz	CRGGLTCJXNNLHL-KRWDZBQOSA-N	1	0	266.388	4.193	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]CC1CCC(C(F)(F)F)CC1	ZINC000466403799	331395171	/nfs/dbraw/zinc/39/51/71/331395171.db2.gz	JLXCUIDSXFMUCV-WXRRBKDZSA-N	1	0	263.347	4.299	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)Cc1cccc(C(F)(F)F)c1	ZINC000467361892	331416255	/nfs/dbraw/zinc/41/62/55/331416255.db2.gz	KLNIIAMNWVHZKH-LBPRGKRZSA-N	1	0	271.326	4.192	20	30		CIEDRO
C=CCCC[NH2+][C@H](C)Cc1cccc(C(F)(F)F)c1	ZINC000467361891	331416271	/nfs/dbraw/zinc/41/62/71/331416271.db2.gz	KLNIIAMNWVHZKH-GFCCVEGCSA-N	1	0	271.326	4.192	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)Cc1cccc(C(F)(F)F)c1	ZINC000467373431	331416800	/nfs/dbraw/zinc/41/68/00/331416800.db2.gz	MGKRHFAAOAPIKM-RYUDHWBXSA-N	1	0	271.326	4.191	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@@H](C)c1cc(OC)c(OC)cc1C	ZINC000467404977	331417611	/nfs/dbraw/zinc/41/76/11/331417611.db2.gz	LSLQWGVNEXOOCJ-UONOGXRCSA-N	1	0	277.408	4.018	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@@H](C)[C@@H](C)c1ccc(OC)c(OC)c1	ZINC000467406961	331417836	/nfs/dbraw/zinc/41/78/36/331417836.db2.gz	RHMQTBCBYIXRQR-YCPHGPKFSA-N	1	0	291.435	4.140	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000468053183	331427785	/nfs/dbraw/zinc/42/77/85/331427785.db2.gz	XEJNMJKSLZYFNT-GFCCVEGCSA-N	1	0	282.771	4.083	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCC[C@@H]1CCc1ccccc1	ZINC000468488316	331435676	/nfs/dbraw/zinc/43/56/76/331435676.db2.gz	PLXRQCKIIIGMBJ-HCXYKTFWSA-N	1	0	282.431	4.070	20	30		CIEDRO
C=C(C[NH2+][C@@H](C)c1cnn(C(C)(C)C)c1C)c1ccccc1	ZINC000468876087	331441615	/nfs/dbraw/zinc/44/16/15/331441615.db2.gz	IVAMEIXBKYHOJL-HNNXBMFYSA-N	1	0	297.446	4.311	20	30		CIEDRO
CC(C)[C@H](C[NH2+]CC(C)(C)CCC#N)Cc1ccccc1	ZINC000469124695	331446209	/nfs/dbraw/zinc/44/62/09/331446209.db2.gz	ZBOZVEISDZKZCQ-SFHVURJKSA-N	1	0	286.463	4.421	20	30		CIEDRO
C=C(C)C[NH+]1CCC(=Cc2ccc(F)c(F)c2)CC1	ZINC000469446671	331451823	/nfs/dbraw/zinc/45/18/23/331451823.db2.gz	RGSGYZVGUGLBLR-UHFFFAOYSA-N	1	0	263.331	4.020	20	30		CIEDRO
C=CCOCCC[NH2+][C@H](CC)c1ccc(Cl)s1	ZINC000470780312	331491107	/nfs/dbraw/zinc/49/11/07/331491107.db2.gz	RMSPPMKURPNSRG-LLVKDONJSA-N	1	0	273.829	4.035	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH2+][C@H](c2ccccc2F)C2CCCC2)C1	ZINC000471589345	331511543	/nfs/dbraw/zinc/51/15/43/331511543.db2.gz	OOBXXOCHCGRDMV-SIIHOXLZSA-N	1	0	286.394	4.339	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH2+][C@H](Cc2ccccc2)c2ccccc2)C1	ZINC000471594228	331511958	/nfs/dbraw/zinc/51/19/58/331511958.db2.gz	CDQZILQWLLURFZ-MISYRCLQSA-N	1	0	290.410	4.252	20	30		CIEDRO
C=CCCCC[NH2+][C@H]1CC2(CCC2)Oc2ccccc21	ZINC000471598669	331512267	/nfs/dbraw/zinc/51/22/67/331512267.db2.gz	LQCCHDRKIZKUAN-INIZCTEOSA-N	1	0	271.404	4.379	20	30		CIEDRO
CC(C)(C)C[C@H]([NH2+][C@H]1CC[C@H](C#N)C1)c1ccccc1	ZINC000471605925	331512726	/nfs/dbraw/zinc/51/27/26/331512726.db2.gz	OOGVDSZSILCWDU-XIRDDKMYSA-N	1	0	270.420	4.446	20	30		CIEDRO
C=CCCCC[NH2+]C1CCC(C#N)(c2ccccc2)CC1	ZINC000471603998	331512742	/nfs/dbraw/zinc/51/27/42/331512742.db2.gz	ANDFYQRTIPVEDM-UHFFFAOYSA-N	1	0	282.431	4.336	20	30		CIEDRO
C[C@H](Cc1c(Cl)cccc1Cl)[NH2+][C@H]1CC[C@@H](C#N)C1	ZINC000471614644	331513325	/nfs/dbraw/zinc/51/33/25/331513325.db2.gz	NCAJICUCRGJCMP-UTUOFQBUSA-N	1	0	297.229	4.206	20	30		CIEDRO
C=CCCCC[NH2+]Cc1ccccc1OCc1cccnc1	ZINC000472059929	331527919	/nfs/dbraw/zinc/52/79/19/331527919.db2.gz	YASMTDNVZBPKDS-UHFFFAOYSA-N	1	0	296.414	4.107	20	30		CIEDRO
C=C(C)CN1CCC([NH2+][C@@H](C)[C@@H](C)C2CCCCC2)CC1	ZINC000474710845	331595468	/nfs/dbraw/zinc/59/54/68/331595468.db2.gz	JSABAHPWNJGQOM-SJORKVTESA-N	1	0	292.511	4.221	20	30		CIEDRO
C=C[C@H](C)[NH2+]CCCCc1cccc(C(F)(F)F)c1	ZINC000474812960	331600419	/nfs/dbraw/zinc/60/04/19/331600419.db2.gz	RESABJJXAMFEQF-LBPRGKRZSA-N	1	0	271.326	4.192	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+][C@@H](C)c1ccc(Br)cn1	ZINC000475484165	331632836	/nfs/dbraw/zinc/63/28/36/331632836.db2.gz	CVHNNFAELIQQRS-TUAOUCFPSA-N	1	0	297.240	4.095	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C2CC2)cc1)c1ccc(C#N)c(F)c1	ZINC000477856988	331692228	/nfs/dbraw/zinc/69/22/28/331692228.db2.gz	JBTCRNLLWCXEDF-ZDUSSCGKSA-N	1	0	294.373	4.426	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](C)c1ccc(Cl)cn1	ZINC000480150345	331759907	/nfs/dbraw/zinc/75/99/07/331759907.db2.gz	QYHLVRJKNKCUDB-RYUDHWBXSA-N	1	0	252.789	4.130	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](C)Cc1ccccc1C(F)(F)F	ZINC000481638787	331810741	/nfs/dbraw/zinc/81/07/41/331810741.db2.gz	AJNCQTUVBDNQQN-NEPJUHHUSA-N	1	0	271.326	4.191	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](C)Cc1ccccc1C(F)(F)F	ZINC000481638790	331810762	/nfs/dbraw/zinc/81/07/62/331810762.db2.gz	AJNCQTUVBDNQQN-VXGBXAGGSA-N	1	0	271.326	4.191	20	30		CIEDRO
C=C(C)C[NH2+][C@@H](c1cc(F)cc(Br)c1)C1CC1	ZINC000481746840	331814843	/nfs/dbraw/zinc/81/48/43/331814843.db2.gz	RFHQRGPVPKVHJB-CQSZACIVSA-N	1	0	298.199	4.205	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)Cc1ccccc1C(F)(F)F	ZINC000481997838	331821053	/nfs/dbraw/zinc/82/10/53/331821053.db2.gz	AQLLJZLJNXNCCZ-LBPRGKRZSA-N	1	0	271.326	4.192	20	30		CIEDRO
N#Cc1ccc(C[NH2+]CC2(Cc3ccccc3)CCCC2)o1	ZINC000486355924	331935683	/nfs/dbraw/zinc/93/56/83/331935683.db2.gz	BYXIQIZEYXPZRP-UHFFFAOYSA-N	1	0	294.398	4.044	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H]1CCSC1)c1ccccc1	ZINC000487554903	331974221	/nfs/dbraw/zinc/97/42/21/331974221.db2.gz	UDECDVSSAJVADO-HOCLYGCPSA-N	1	0	261.434	4.037	20	30		CIEDRO
CC[C@@](C)([NH2+]Cc1ccc(C#N)c(C)c1)c1nc(C)cs1	ZINC000488105555	331990147	/nfs/dbraw/zinc/99/01/47/331990147.db2.gz	CTBWQNSNZALXMV-QGZVFWFLSA-N	1	0	299.443	4.047	20	30		CIEDRO
Cc1cc(C[NH2+][C@@H](C)[C@H](C)c2ccccc2)ccc1C#N	ZINC000488140454	331991665	/nfs/dbraw/zinc/99/16/65/331991665.db2.gz	AQTXPDGFKZYLSC-HOTGVXAUSA-N	1	0	278.399	4.149	20	30		CIEDRO
Cc1cc(C)cc([C@@H](C)[NH2+]Cc2ccc(C#N)c(C)c2)c1	ZINC000488141300	331991899	/nfs/dbraw/zinc/99/18/99/331991899.db2.gz	PTAUZAHHZNKGQQ-MRXNPFEDSA-N	1	0	278.399	4.334	20	30		CIEDRO
CC[N@H+](Cc1ccc(C#N)c(C)c1)[C@H](C)c1cccc(O)c1	ZINC000488402252	332004269	/nfs/dbraw/zinc/00/42/69/332004269.db2.gz	BVFLGPLRMPHURP-OAHLLOKOSA-N	1	0	294.398	4.155	20	30		CIEDRO
CC[N@H+](Cc1ccc(C#N)c(C)c1)[C@@H](C)c1cccc(O)c1	ZINC000488402250	332004291	/nfs/dbraw/zinc/00/42/91/332004291.db2.gz	BVFLGPLRMPHURP-HNNXBMFYSA-N	1	0	294.398	4.155	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CS[C@H](C(C)(C)C)C1)c1ccc(C#N)cc1	ZINC000488416426	332005723	/nfs/dbraw/zinc/00/57/23/332005723.db2.gz	IOVNVSFTZCDCKS-RCBQFDQVSA-N	1	0	288.460	4.129	20	30		CIEDRO
C=CCCC[N@@H+](C)Cc1cncc(OCc2ccccc2)c1	ZINC000488442787	332009034	/nfs/dbraw/zinc/00/90/34/332009034.db2.gz	FWLLIVRGCQSUII-UHFFFAOYSA-N	1	0	296.414	4.059	20	30		CIEDRO
CC(C)C1CC([NH2+][C@H](CCC#N)c2ccccc2)C1	ZINC000488442569	332009235	/nfs/dbraw/zinc/00/92/35/332009235.db2.gz	UBWAUOKTYVTINT-OFLPRAFFSA-N	1	0	256.393	4.056	20	30		CIEDRO
C=CC1CC[NH+]([C@@H](C)c2ccc(Br)cc2)CC1	ZINC000488597151	332019981	/nfs/dbraw/zinc/01/99/81/332019981.db2.gz	OKQUAGGPNFLNOS-LBPRGKRZSA-N	1	0	294.236	4.408	20	30		CIEDRO
C=CCCCCC[NH2+][C@@H]1CCO[C@@H]1c1ccc(F)c(F)c1	ZINC000488996937	332037158	/nfs/dbraw/zinc/03/71/58/332037158.db2.gz	OWZOTNRFGFGVBY-IAGOWNOFSA-N	1	0	295.373	4.131	20	30		CIEDRO
Cc1ccccc1[C@H]1CCC[N@@H+]1Cc1ccc(F)cc1C#N	ZINC000489576268	332059911	/nfs/dbraw/zinc/05/99/11/332059911.db2.gz	DJWPCROLQWNTAN-LJQANCHMSA-N	1	0	294.373	4.343	20	30		CIEDRO
CC(C)(C#N)CCCC[N@@H+]1CC[C@@H](c2cccc(F)c2)C1	ZINC000489883257	332071664	/nfs/dbraw/zinc/07/16/64/332071664.db2.gz	KFOKELHQNOHURN-MRXNPFEDSA-N	1	0	288.410	4.335	20	30		CIEDRO
C=C(CC)C[N@@H+](CCC)[C@H](C)C(=O)Nc1ccccc1C	ZINC000490043855	332078445	/nfs/dbraw/zinc/07/84/45/332078445.db2.gz	LEAHHSLQTXLOSD-MRXNPFEDSA-N	1	0	288.435	4.000	20	30		CIEDRO
C=CC[N@H+](CCc1ccco1)Cc1ccc2ccccc2n1	ZINC000491327784	332191389	/nfs/dbraw/zinc/19/13/89/332191389.db2.gz	CJWQPVZEWIHMEG-UHFFFAOYSA-N	1	0	292.382	4.059	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]C[C@H]1CCCCC(F)(F)C1	ZINC000491595996	332242090	/nfs/dbraw/zinc/24/20/90/332242090.db2.gz	GKIBWLACQXYAHJ-ZDUSSCGKSA-N	1	0	272.383	4.122	20	30		CIEDRO
C#C[C@@H]([NH2+]C1CCC(C)(C#N)CC1)c1ccc(Cl)cc1	ZINC000491702087	332296389	/nfs/dbraw/zinc/29/63/89/332296389.db2.gz	XONOGJMSGDEAPE-AQFXKWCLSA-N	1	0	286.806	4.076	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](c1ccc(F)cc1)c1ccc(OC)cc1	ZINC000494027161	332461341	/nfs/dbraw/zinc/46/13/41/332461341.db2.gz	GKACOLURKRFQDJ-AUUYWEPGSA-N	1	0	299.389	4.478	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](C)[C@@H](OC)c1ccccc1	ZINC000494596362	332479362	/nfs/dbraw/zinc/47/93/62/332479362.db2.gz	RXTPPHMXXAYOCN-ZMSDIMECSA-N	1	0	261.409	4.097	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@@H](C)[C@H](C)C1)c1ccc(C#N)cc1	ZINC000251993008	334372761	/nfs/dbraw/zinc/37/27/61/334372761.db2.gz	ZLGLRVLIMDSHJX-VWPFQQQWSA-N	1	0	256.393	4.034	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1C[C@H](C)C[C@H](C)C1)c1cccc(C#N)c1	ZINC000252203065	334376798	/nfs/dbraw/zinc/37/67/98/334376798.db2.gz	WQECWQJCEZDLEH-OEUWWYETSA-N	1	0	256.393	4.034	20	30		CIEDRO
CC(C)[C@@H](C)[NH2+]C1CCC(C#N)(c2ccccc2)CC1	ZINC000500022865	332597561	/nfs/dbraw/zinc/59/75/61/332597561.db2.gz	BKIVHOKUDWTORC-FAEJEUNOSA-N	1	0	270.420	4.025	20	30		CIEDRO
C/C(=C\c1ccccc1C(F)(F)F)C[NH2+]CCCCC#N	ZINC000501461852	332633911	/nfs/dbraw/zinc/63/39/11/332633911.db2.gz	MEHMGMHWMJEXPD-ACCUITESSA-N	1	0	296.336	4.392	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+][C@H](C)c1nc2c(s1)CCC2	ZINC000502016700	332645428	/nfs/dbraw/zinc/64/54/28/332645428.db2.gz	KMZMPCBWJMNMGW-CHWSQXEVSA-N	1	0	278.465	4.417	20	30		CIEDRO
C=CCCc1ccccc1NC1CC[NH+](C(C)C)CC1	ZINC000502301977	332653116	/nfs/dbraw/zinc/65/31/16/332653116.db2.gz	QALVXSOPRVCUFI-UHFFFAOYSA-N	1	0	272.436	4.090	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H]1CCC[C@@H](c2cccnc2)C1	ZINC000502391307	332656130	/nfs/dbraw/zinc/65/61/30/332656130.db2.gz	PUWHQVABOOCKIW-LZLYRXPVSA-N	1	0	272.436	4.442	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@H]1CCC[C@@H]1CCOC)c1ccccc1	ZINC000502404694	332657004	/nfs/dbraw/zinc/65/70/04/332657004.db2.gz	KAMYNMIFKUPPCE-QYZOEREBSA-N	1	0	287.447	4.489	20	30		CIEDRO
C=C(C[NH2+][C@H](C)c1cc(C)c(C)o1)c1ccccc1	ZINC000502414694	332658099	/nfs/dbraw/zinc/65/80/99/332658099.db2.gz	MSKDLRWYVXBSJG-CQSZACIVSA-N	1	0	255.361	4.260	20	30		CIEDRO
C[C@@H]([NH2+]C[C@@H]1CCCC(F)(F)C1)c1ccc(C#N)cc1F	ZINC000502579937	332666345	/nfs/dbraw/zinc/66/63/45/332666345.db2.gz	RJBQDHSORHAZGF-DGCLKSJQSA-N	1	0	296.336	4.173	20	30		CIEDRO
CC[C@H]1C[C@]1([NH2+]CCC(C)(C)C#N)c1cccc(C)c1	ZINC000502590823	332666755	/nfs/dbraw/zinc/66/67/55/332666755.db2.gz	HPADSZYXGDNOIO-MAUKXSAKSA-N	1	0	270.420	4.150	20	30		CIEDRO
CC[C@@H](CC#N)[NH2+]C/C(C)=C\c1ccccc1C(F)(F)F	ZINC000503564631	332692288	/nfs/dbraw/zinc/69/22/88/332692288.db2.gz	CEKFJFHZXRLHJT-HCYCVZQXSA-N	1	0	296.336	4.391	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)c1cc(Br)ccc1F	ZINC000303987633	332963948	/nfs/dbraw/zinc/96/39/48/332963948.db2.gz	LONXKEKBSKTXET-JTQLQIEISA-N	1	0	286.188	4.205	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]Cc2cc(C)ccc2C)cc1	ZINC000512532826	332972408	/nfs/dbraw/zinc/97/24/08/332972408.db2.gz	VQVFREBLQVMCRU-UHFFFAOYSA-N	1	0	281.399	4.158	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]Cc2ccc3occc3c2)cc1	ZINC000512551098	332973305	/nfs/dbraw/zinc/97/33/05/332973305.db2.gz	BLNUAKRBPOJBFB-UHFFFAOYSA-N	1	0	293.366	4.287	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]Cc2cccc(C)c2C)cc1	ZINC000512582507	332974167	/nfs/dbraw/zinc/97/41/67/332974167.db2.gz	NGXFEYLPHCGMKI-UHFFFAOYSA-N	1	0	281.399	4.158	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]CC2(C(F)(F)F)CCC2)cc1	ZINC000513033350	333000080	/nfs/dbraw/zinc/00/00/80/333000080.db2.gz	UFCBZYPCKGYPFB-UHFFFAOYSA-N	1	0	299.336	4.074	20	30		CIEDRO
CC[N@H+](CCCC(C)(C)C#N)Cc1ccccc1Cl	ZINC000174820317	333007890	/nfs/dbraw/zinc/00/78/90/333007890.db2.gz	NDBSJGPMDBCDJV-UHFFFAOYSA-N	1	0	278.827	4.492	20	30		CIEDRO
C=CC[N@@H+](CCCC(C)(C)C#N)Cc1ccccc1F	ZINC000174831721	333008333	/nfs/dbraw/zinc/00/83/33/333008333.db2.gz	RPZLGSGQUNYSRL-UHFFFAOYSA-N	1	0	274.383	4.144	20	30		CIEDRO
CC[C@@H](C)[C@@H](C)[N@H+](CCCC(C)(C)C#N)C1CC1	ZINC000174848411	333008892	/nfs/dbraw/zinc/00/88/92/333008892.db2.gz	PIUFLKPGJLWTMJ-ZIAGYGMSSA-N	1	0	250.430	4.215	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1ccc(Sc2ccccn2)o1	ZINC000513460385	333020908	/nfs/dbraw/zinc/02/09/08/333020908.db2.gz	DWWWFQHNLUHMFZ-CYBMUJFWSA-N	1	0	288.416	4.270	20	30		CIEDRO
C=C1CC[NH+](Cc2ccc(-c3ccccc3)o2)CC1	ZINC000513461414	333021195	/nfs/dbraw/zinc/02/11/95/333021195.db2.gz	MDLYWDOPCUXTFO-UHFFFAOYSA-N	1	0	253.345	4.099	20	30		CIEDRO
Cc1ccccc1C1CC[NH+](Cc2ccc(C#N)s2)CC1	ZINC000513502985	333023292	/nfs/dbraw/zinc/02/32/92/333023292.db2.gz	JRAYNXULSHNYTR-UHFFFAOYSA-N	1	0	296.439	4.308	20	30		CIEDRO
C[C@H]([C@@H](C)c1ccc(Cl)cc1)[N@H+](C)CCCCC#N	ZINC000175433042	333024722	/nfs/dbraw/zinc/02/47/22/333024722.db2.gz	CBPZJTLYKRPXOA-ZIAGYGMSSA-N	1	0	278.827	4.458	20	30		CIEDRO
C[C@H]1CC[C@H]([NH2+]Cc2ccc(C#N)c(F)c2)c2ccccc21	ZINC000404860664	333030619	/nfs/dbraw/zinc/03/06/19/333030619.db2.gz	WEVYCPHRAABFEC-DJJJIMSYSA-N	1	0	294.373	4.426	20	30		CIEDRO
C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(C#N)c(F)c2)c2ccccc21	ZINC000404860663	333030639	/nfs/dbraw/zinc/03/06/39/333030639.db2.gz	WEVYCPHRAABFEC-BFUOFWGJSA-N	1	0	294.373	4.426	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCCOc1ccccc1)c1ccco1	ZINC000513677939	333031674	/nfs/dbraw/zinc/03/16/74/333031674.db2.gz	FFDRYTUUUHUTRJ-QGZVFWFLSA-N	1	0	285.387	4.346	20	30		CIEDRO
C=C[C@@H](C)[NH2+][C@@H](CC)c1ccc(OC(F)(F)F)cc1	ZINC000513703285	333034094	/nfs/dbraw/zinc/03/40/94/333034094.db2.gz	SRWIJZYVDRAOEC-MFKMUULPSA-N	1	0	273.298	4.200	20	30		CIEDRO
CC(C)CC[N@H+](CCC#N)C[C@H]1C[C@H]1c1ccccc1	ZINC000513732310	333036303	/nfs/dbraw/zinc/03/63/03/333036303.db2.gz	DGGJFULIOBEEDW-MSOLQXFVSA-N	1	0	270.420	4.052	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccccc1C)c1ccco1	ZINC000513762687	333038036	/nfs/dbraw/zinc/03/80/36/333038036.db2.gz	SFBHOYMYLCSYMR-MRXNPFEDSA-N	1	0	255.361	4.385	20	30		CIEDRO
C[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1ccc(F)c(C#N)c1	ZINC000177508592	333059934	/nfs/dbraw/zinc/05/99/34/333059934.db2.gz	RYFBMAAYLDUGEJ-LBPRGKRZSA-N	1	0	286.325	4.029	20	30		CIEDRO
CC(C)(C#N)c1ccccc1C[N@@H+]1CCc2sccc2C1	ZINC000178512157	333074462	/nfs/dbraw/zinc/07/44/62/333074462.db2.gz	BXGOZSYEFUPBPZ-UHFFFAOYSA-N	1	0	296.439	4.108	20	30		CIEDRO
C[C@H]([NH2+]C[C@@H]1CCC[C@@H](C)C1)c1ccc(C#N)cc1	ZINC000089606514	333100866	/nfs/dbraw/zinc/10/08/66/333100866.db2.gz	RWRGFYZFEDCDFF-IJEWVQPXSA-N	1	0	256.393	4.035	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H]2CCC[C@@H]2C)cc1Cl	ZINC000517545147	333101836	/nfs/dbraw/zinc/10/18/36/333101836.db2.gz	FNAGOWJSJASNAQ-WFASDCNBSA-N	1	0	279.811	4.183	20	30		CIEDRO
C=C(C)C[N@H+](C)CCCCCc1cc(-c2ccccc2)n[nH]1	ZINC000517618529	333104170	/nfs/dbraw/zinc/10/41/70/333104170.db2.gz	NGNVRIQGJUSBDB-UHFFFAOYSA-N	1	0	297.446	4.297	20	30		CIEDRO
C[C@@H]1CCCc2ccccc2[C@H]1[NH2+]Cc1cc(C#N)cs1	ZINC000185085713	333135471	/nfs/dbraw/zinc/13/54/71/333135471.db2.gz	YFDWFXVLHNYQNP-ACJLOTCBSA-N	1	0	296.439	4.423	20	30		CIEDRO
C[C@H]([NH2+]C[C@H]1CCC[C@@H](C)C1)c1cccc(C#N)c1	ZINC000218941935	333138606	/nfs/dbraw/zinc/13/86/06/333138606.db2.gz	AXSRODDEIXCOCL-YCPHGPKFSA-N	1	0	256.393	4.035	20	30		CIEDRO
CC[C@@H]1Cc2ccccc2C[N@@H+]1CCCC(C)(C)C#N	ZINC000185786339	333148664	/nfs/dbraw/zinc/14/86/64/333148664.db2.gz	XVUKWUDOADGXPM-QGZVFWFLSA-N	1	0	270.420	4.153	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+]Cc2ccccc2OC2CCCC2)C1	ZINC000185786433	333148744	/nfs/dbraw/zinc/14/87/44/333148744.db2.gz	IDUKSHWOJKIUHH-DOTOQJQBSA-N	1	0	298.430	4.180	20	30		CIEDRO
CCC[C@H](Cc1ccccc1)[NH2+][C@H]1CCC[C@H](C#N)C1	ZINC000185811889	333149408	/nfs/dbraw/zinc/14/94/08/333149408.db2.gz	OSGLQAMONNNPHS-KSZLIROESA-N	1	0	270.420	4.070	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+]CC2(Cc3ccccc3)CCC2)C1	ZINC000185860393	333150346	/nfs/dbraw/zinc/15/03/46/333150346.db2.gz	FPIAMMLPFPRFEE-ZWKOTPCHSA-N	1	0	282.431	4.071	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+]Cc1ncc(-c2ccccc2)cn1	ZINC000186054945	333154340	/nfs/dbraw/zinc/15/43/40/333154340.db2.gz	QXKZOQHIKLLDBW-GOSISDBHSA-N	1	0	295.430	4.368	20	30		CIEDRO
C=C(C)[C@@H]([NH2+][C@H]1CCCSC1)c1ccc(F)c(F)c1	ZINC000186453594	333161368	/nfs/dbraw/zinc/16/13/68/333161368.db2.gz	OYEQYSNKVSTZMH-SWLSCSKDSA-N	1	0	283.387	4.067	20	30		CIEDRO
C=C(C)[C@@H]([NH2+]Cc1ccc(C#N)cc1)c1ccc(F)c(F)c1	ZINC000187374007	333170063	/nfs/dbraw/zinc/17/00/63/333170063.db2.gz	ZZFLSNVWHUJNFX-GOSISDBHSA-N	1	0	298.336	4.243	20	30		CIEDRO
N#Cc1cc(Cl)ccc1C[NH2+][C@@H](c1ccccc1)C1CC1	ZINC000187448569	333171013	/nfs/dbraw/zinc/17/10/13/333171013.db2.gz	WPZSCQBEDZZSQU-SFHVURJKSA-N	1	0	296.801	4.453	20	30		CIEDRO
C=CCOc1cccc(C[NH2+]C(C)(C)c2ccccc2)c1	ZINC000521831306	333191951	/nfs/dbraw/zinc/19/19/51/333191951.db2.gz	IBODTTWHCHZHQZ-UHFFFAOYSA-N	1	0	281.399	4.276	20	30		CIEDRO
C=C(C[NH2+]Cc1ccc(CC)cc1)c1ccccc1	ZINC000223251549	333206094	/nfs/dbraw/zinc/20/60/94/333206094.db2.gz	KOABTKMUVLAKNJ-UHFFFAOYSA-N	1	0	251.373	4.052	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+][C@@H](C)c1nc(C(C)(C)C)no1	ZINC000191569320	333221654	/nfs/dbraw/zinc/22/16/54/333221654.db2.gz	UTSVICXIMOFSTM-QWHCGFSZSA-N	1	0	279.428	4.153	20	30		CIEDRO
Cc1cc(C)cc([C@H](C)[NH2+]Cc2ccc(C#N)c(F)c2)c1	ZINC000192156944	333231102	/nfs/dbraw/zinc/23/11/02/333231102.db2.gz	SKPUCBSJTAHCTA-AWEZNQCLSA-N	1	0	282.362	4.165	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)c(F)c1)c1ccc(Cl)s1	ZINC000192180598	333231849	/nfs/dbraw/zinc/23/18/49/333231849.db2.gz	YXVPWNHYGGPGME-VIFPVBQESA-N	1	0	294.782	4.263	20	30		CIEDRO
C=CCCCCC[NH2+][C@H](C)c1nc(Cc2ccccc2)no1	ZINC000193554213	333252993	/nfs/dbraw/zinc/25/29/93/333252993.db2.gz	JBCSUZPRBVJFIR-OAHLLOKOSA-N	1	0	299.418	4.057	20	30		CIEDRO
C=CCCCCC[NH2+][C@H](C)c1csc(CC)n1	ZINC000193552168	333253165	/nfs/dbraw/zinc/25/31/65/333253165.db2.gz	IFXUOYLGASFVDO-GFCCVEGCSA-N	1	0	252.427	4.103	20	30		CIEDRO
CCOc1ccccc1C[N@H+](C)[C@@H](C)c1ccc(C#N)cc1	ZINC000194973346	333280554	/nfs/dbraw/zinc/28/05/54/333280554.db2.gz	YKQHVFVBBVMCGU-HNNXBMFYSA-N	1	0	294.398	4.150	20	30		CIEDRO
C=CC[C@H](C)[NH2+]Cc1ccccc1OCc1ccccc1	ZINC000522627773	333292912	/nfs/dbraw/zinc/29/29/12/333292912.db2.gz	XYFGKQRCDRKELF-INIZCTEOSA-N	1	0	281.399	4.320	20	30		CIEDRO
C=CCSCC[NH2+]C1CC(c2cccc(Cl)c2)C1	ZINC000228820819	333297300	/nfs/dbraw/zinc/29/73/00/333297300.db2.gz	RHAAATCDAASSCD-UHFFFAOYSA-N	1	0	281.852	4.095	20	30		CIEDRO
CC[C@@H]([NH2+]CC(C)(C)CCC#N)c1ccc(OC)cc1	ZINC000229683100	333307692	/nfs/dbraw/zinc/30/76/92/333307692.db2.gz	MHBYXICFNAUIEK-MRXNPFEDSA-N	1	0	274.408	4.066	20	30		CIEDRO
C[C@@H]([NH2+]CC(C)(C)CCC#N)c1cc2ccccc2o1	ZINC000229683332	333307837	/nfs/dbraw/zinc/30/78/37/333307837.db2.gz	KWUJEIZDTVNPMV-CYBMUJFWSA-N	1	0	270.376	4.413	20	30		CIEDRO
C=CCCOCC[NH2+][C@H](C)c1ccc2ccccc2c1	ZINC000229860562	333310253	/nfs/dbraw/zinc/31/02/53/333310253.db2.gz	IVVOVPRCBCTIRM-OAHLLOKOSA-N	1	0	269.388	4.083	20	30		CIEDRO
C=CCSCC[NH2+][C@@H]1CCCc2c3ccccc3[nH]c21	ZINC000231930066	333332134	/nfs/dbraw/zinc/33/21/34/333332134.db2.gz	LFCQOAKNOQLOPZ-MRXNPFEDSA-N	1	0	286.444	4.054	20	30		CIEDRO
C=CC1CC[NH+](Cc2c(Cl)ccc3cccnc32)CC1	ZINC000523607454	333333878	/nfs/dbraw/zinc/33/38/78/333333878.db2.gz	AKYRACXGHGSQDV-UHFFFAOYSA-N	1	0	286.806	4.286	20	30		CIEDRO
CC(C)(C#N)CCCC[N@@H+]1CC[C@H](c2ccccc2)C1	ZINC000232531779	333338222	/nfs/dbraw/zinc/33/82/22/333338222.db2.gz	ASOXNOIAGSASEO-KRWDZBQOSA-N	1	0	270.420	4.196	20	30		CIEDRO
CC[N@H+](CCCCC(C)(C)C#N)Cc1cccs1	ZINC000233443822	333352421	/nfs/dbraw/zinc/35/24/21/333352421.db2.gz	MNXJEBJLNQLBCE-UHFFFAOYSA-N	1	0	264.438	4.290	20	30		CIEDRO
N#Cc1ccc(C[NH+]2CCC(c3ccccc3F)CC2)cc1	ZINC000524081180	333353138	/nfs/dbraw/zinc/35/31/38/333353138.db2.gz	NCKDULXDWIXDCL-UHFFFAOYSA-N	1	0	294.373	4.077	20	30		CIEDRO
CC[C@H]1CCCC[C@@H]1[NH2+]CCCCC(C)(C)C#N	ZINC000234055433	333357488	/nfs/dbraw/zinc/35/74/88/333357488.db2.gz	MHZLDLXWMPNPJT-GJZGRUSLSA-N	1	0	250.430	4.265	20	30		CIEDRO
COc1cccc([C@H](C)[NH2+]CCCCC(C)(C)C#N)c1	ZINC000234883579	333362756	/nfs/dbraw/zinc/36/27/56/333362756.db2.gz	LOVYIPKQHQWTQM-AWEZNQCLSA-N	1	0	274.408	4.066	20	30		CIEDRO
Cc1ccccc1[C@H]1C[C@H](C)[N@@H+](Cc2cccc(C#N)c2)C1	ZINC000524592357	333367635	/nfs/dbraw/zinc/36/76/35/333367635.db2.gz	HKWLMKHHXHYGRO-LPHOPBHVSA-N	1	0	290.410	4.245	20	30		CIEDRO
Cc1ccccc1[C@H]1C[C@@H](C)[N@@H+](Cc2cccc(C#N)c2)C1	ZINC000524592356	333367757	/nfs/dbraw/zinc/36/77/57/333367757.db2.gz	HKWLMKHHXHYGRO-APWZRJJASA-N	1	0	290.410	4.245	20	30		CIEDRO
C=CC1CC[NH+]([C@@H](CC)c2ccc(F)cc2F)CC1	ZINC000524598975	333368166	/nfs/dbraw/zinc/36/81/66/333368166.db2.gz	UXCOXCFHBKRJTJ-INIZCTEOSA-N	1	0	265.347	4.314	20	30		CIEDRO
C[C@H]([NH2+]CCCCC(C)(C)C#N)C1CCCCC1	ZINC000235506438	333370308	/nfs/dbraw/zinc/37/03/08/333370308.db2.gz	DCZXCCUKWOBPPT-AWEZNQCLSA-N	1	0	250.430	4.265	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+]CCCc1cccc(F)c1	ZINC000524686814	333371339	/nfs/dbraw/zinc/37/13/39/333371339.db2.gz	MDELKSXGPZJRBI-UHFFFAOYSA-N	1	0	299.389	4.113	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+]Cc1cccc2cc[nH]c21	ZINC000236676005	333374568	/nfs/dbraw/zinc/37/45/68/333374568.db2.gz	SAESMQNVQVQECR-UHFFFAOYSA-N	1	0	292.382	4.023	20	30		CIEDRO
CC1(C)CC[C@@H]([NH2+]Cc2ccc(C#N)cc2)c2ccccc21	ZINC000236747530	333375250	/nfs/dbraw/zinc/37/52/50/333375250.db2.gz	NJGXZKJRPFIRTM-LJQANCHMSA-N	1	0	290.410	4.461	20	30		CIEDRO
N#CCCCC[NH2+]Cc1cccc(OCc2ccccc2)c1	ZINC000237817615	333381778	/nfs/dbraw/zinc/38/17/78/333381778.db2.gz	SWCVXCMMOPAFTB-UHFFFAOYSA-N	1	0	294.398	4.049	20	30		CIEDRO
C[C@@H]([NH2+]C1CC(c2ccccc2F)C1)c1ccc(C#N)cc1	ZINC000315642022	333383035	/nfs/dbraw/zinc/38/30/35/333383035.db2.gz	ZFUAEMPAEMUNGL-NVPAJSRCSA-N	1	0	294.373	4.294	20	30		CIEDRO
CC[C@@H]([NH2+][C@H](C)c1ccc(C#N)cc1)c1ccccc1OC	ZINC000315731279	333383513	/nfs/dbraw/zinc/38/35/13/333383513.db2.gz	LZFYVXRZROGVGY-RDTXWAMCSA-N	1	0	294.398	4.369	20	30		CIEDRO
C=CCC[NH+](Cc1cccs1)Cc1cccs1	ZINC000524811600	333389167	/nfs/dbraw/zinc/38/91/67/333389167.db2.gz	PJIAFPMDNOFEHJ-UHFFFAOYSA-N	1	0	263.431	4.388	20	30		CIEDRO
C=CCC[N@@H+](C)Cc1ccccc1-c1ccccc1	ZINC000524811177	333389183	/nfs/dbraw/zinc/38/91/83/333389183.db2.gz	AJADRGVIGSZXIY-UHFFFAOYSA-N	1	0	251.373	4.362	20	30		CIEDRO
C=CCC[N@H+]1CCC[C@H]1Cc1c(F)cccc1Cl	ZINC000524811708	333389185	/nfs/dbraw/zinc/38/91/85/333389185.db2.gz	HABOMHVLGAUUQA-LBPRGKRZSA-N	1	0	267.775	4.062	20	30		CIEDRO
CC[C@H](Cc1ccccc1)[N@H+](C)Cc1cccc(C#N)c1	ZINC000525122617	333399836	/nfs/dbraw/zinc/39/98/36/333399836.db2.gz	IWCLOAWOBVMESU-LJQANCHMSA-N	1	0	278.399	4.011	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccccc1Cl)c1cccc(C#N)c1	ZINC000037199004	333512724	/nfs/dbraw/zinc/51/27/24/333512724.db2.gz	OFZOZBYRQRBCMS-GFCCVEGCSA-N	1	0	270.763	4.062	20	30		CIEDRO
C[C@@H]([NH2+]CCC1=CCCCC1)c1cccc(C#N)c1	ZINC000037216877	333515818	/nfs/dbraw/zinc/51/58/18/333515818.db2.gz	LBCJKCVKELXPCM-CQSZACIVSA-N	1	0	254.377	4.099	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@H](C)c1ccc(C)cc1	ZINC000037770271	333538098	/nfs/dbraw/zinc/53/80/98/333538098.db2.gz	FBYGTQCJYOYDHY-MRXNPFEDSA-N	1	0	281.399	4.411	20	30		CIEDRO
Cc1ccccc1C[C@H](C)[NH2+][C@@H](C)c1cccc(C#N)c1	ZINC000037777164	333539260	/nfs/dbraw/zinc/53/92/60/333539260.db2.gz	VAVPCXMBMBMZHR-HOTGVXAUSA-N	1	0	278.399	4.149	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+]CCSc1ccccc1	ZINC000037854673	333541193	/nfs/dbraw/zinc/54/11/93/333541193.db2.gz	CQTHXVQYBUMIGB-UHFFFAOYSA-N	1	0	299.439	4.133	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@H](CC)[C@H]1CCOC1)c1ccccc1	ZINC000537946013	333549089	/nfs/dbraw/zinc/54/90/89/333549089.db2.gz	IYBRDAMWMKCLCF-KSZLIROESA-N	1	0	273.420	4.099	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](C)c1ccc(OC)c2ccccc21	ZINC000537968615	333552035	/nfs/dbraw/zinc/55/20/35/333552035.db2.gz	OKMCCBLECYYHOV-KGLIPLIRSA-N	1	0	269.388	4.464	20	30		CIEDRO
C[C@H]([NH2+]CCCCC#N)c1ccc(C(C)(C)C)cc1	ZINC000174056875	335147418	/nfs/dbraw/zinc/14/74/18/335147418.db2.gz	QCZFCNOJKAYCET-AWEZNQCLSA-N	1	0	258.409	4.329	20	30		CIEDRO
C=CCCC[NH2+][C@H](CC(F)(F)F)c1ccc(F)cc1	ZINC000538175932	333577708	/nfs/dbraw/zinc/57/77/08/333577708.db2.gz	GZUXCSSQEYFIRX-CYBMUJFWSA-N	1	0	275.289	4.375	20	30		CIEDRO
Cc1cccc([C@@H](C)C[NH2+][C@H](C)c2cccc(C#N)c2)c1	ZINC000538394746	333588209	/nfs/dbraw/zinc/58/82/09/333588209.db2.gz	NSOFOMIRNQNACZ-JKSUJKDBSA-N	1	0	278.399	4.321	20	30		CIEDRO
Cc1cccc([C@H](C)C[NH2+][C@H](C)c2cccc(C#N)c2)c1	ZINC000538394745	333588210	/nfs/dbraw/zinc/58/82/10/333588210.db2.gz	NSOFOMIRNQNACZ-HZPDHXFCSA-N	1	0	278.399	4.321	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1C[C@H]1C1CCCCC1)c1ccc(C#N)cc1	ZINC000538406241	333588995	/nfs/dbraw/zinc/58/89/95/333588995.db2.gz	UNTVSJVDUDAFKY-DOPJRALCSA-N	1	0	268.404	4.178	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H]2CCC[C@H]2c2ccccc2)s1	ZINC000538403600	333589030	/nfs/dbraw/zinc/58/90/30/333589030.db2.gz	MYXHFLUMQAXHLV-IRXDYDNUSA-N	1	0	282.412	4.046	20	30		CIEDRO
CC(C)(C#N)CC[NH2+]C1(c2ccc(F)cc2F)CCCC1	ZINC000538512281	333602020	/nfs/dbraw/zinc/60/20/20/333602020.db2.gz	JJDLPRBGEFYAJN-UHFFFAOYSA-N	1	0	292.373	4.264	20	30		CIEDRO
CC(C)Oc1ccccc1[C@@H](C)[NH2+]CCC(C)(C)C#N	ZINC000538512076	333602157	/nfs/dbraw/zinc/60/21/57/333602157.db2.gz	AOZOSDOHOWZZGB-CQSZACIVSA-N	1	0	274.408	4.064	20	30		CIEDRO
C[C@H]([NH2+]C1[C@H](C)CCC[C@H]1C)c1ccc(C#N)c(F)c1	ZINC000538565967	333606608	/nfs/dbraw/zinc/60/66/08/333606608.db2.gz	IAZFHTFBPLVNDO-UPJWGTAASA-N	1	0	274.383	4.173	20	30		CIEDRO
CC(C)C[C@H](C)[NH2+]C1CCC(C#N)(c2ccccc2)CC1	ZINC000539046033	333651134	/nfs/dbraw/zinc/65/11/34/333651134.db2.gz	GFOHYWZRGWBGHQ-IVMQYODDSA-N	1	0	284.447	4.415	20	30		CIEDRO
CCSc1ccc([C@H](C)[NH2+]Cc2ccc(C#N)o2)cc1	ZINC000174346750	335152968	/nfs/dbraw/zinc/15/29/68/335152968.db2.gz	ZGGFKCFBJYMLJB-LBPRGKRZSA-N	1	0	286.400	4.114	20	30		CIEDRO
C=CCC[C@@H](O)C[NH2+][C@@H](c1cccs1)C(CC)CC	ZINC000539281797	333663767	/nfs/dbraw/zinc/66/37/67/333663767.db2.gz	VVRRRLRLZAHHJP-GDBMZVCRSA-N	1	0	281.465	4.142	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](C)c1cc(OC)c(OC)cc1C	ZINC000539288779	333664032	/nfs/dbraw/zinc/66/40/32/333664032.db2.gz	FEICXRHTQXOSAB-GJZGRUSLSA-N	1	0	291.435	4.408	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H](C)c1cc(OC)c(OC)cc1C	ZINC000539288780	333664113	/nfs/dbraw/zinc/66/41/13/333664113.db2.gz	FEICXRHTQXOSAB-HUUCEWRRSA-N	1	0	291.435	4.408	20	30		CIEDRO
C[C@H](c1ccccc1)[C@H](C)[NH2+][C@@H](C)c1cccc(C#N)c1	ZINC000539495081	333673990	/nfs/dbraw/zinc/67/39/90/333673990.db2.gz	CUTIYDHGMBGTBL-JYJNAYRXSA-N	1	0	278.399	4.401	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H](C)c1cnn(Cc2ccccc2)c1	ZINC000539509628	333675458	/nfs/dbraw/zinc/67/54/58/333675458.db2.gz	IPEWTGJBXKCVPX-IAGOWNOFSA-N	1	0	297.446	4.327	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@@H](C)C[C@@H]1C)c1ccc(C#N)c(F)c1	ZINC000539607458	333680513	/nfs/dbraw/zinc/68/05/13/333680513.db2.gz	IOBWPDYHZOSUST-ZHRONYKTSA-N	1	0	274.383	4.173	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H]1CC2(CCCC2)Oc2ccccc21	ZINC000540170453	333717172	/nfs/dbraw/zinc/71/71/72/333717172.db2.gz	LZZHJCBZMWSOKW-HOCLYGCPSA-N	1	0	271.404	4.377	20	30		CIEDRO
C=CCOc1cccc(C[NH2+][C@H](C)c2ccncc2CC)c1	ZINC000540203346	333720805	/nfs/dbraw/zinc/72/08/05/333720805.db2.gz	VAWIYZWREVAJJZ-OAHLLOKOSA-N	1	0	296.414	4.060	20	30		CIEDRO
CCCCOc1ccccc1C[NH2+]Cc1cccc(C#N)c1	ZINC000128888863	333723569	/nfs/dbraw/zinc/72/35/69/333723569.db2.gz	SUIJZNSSEHXUAJ-UHFFFAOYSA-N	1	0	294.398	4.027	20	30		CIEDRO
C=CC[NH2+][C@H](c1cccc(C(F)(F)F)c1)C(C)C	ZINC000540359574	333726811	/nfs/dbraw/zinc/72/68/11/333726811.db2.gz	KMQHDARJJWNFJT-ZDUSSCGKSA-N	1	0	257.299	4.178	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@@H](C)c1cccc(-n2cccn2)c1	ZINC000540387105	333727730	/nfs/dbraw/zinc/72/77/30/333727730.db2.gz	MIGJXWCWGWZNGE-CVEARBPZSA-N	1	0	283.419	4.268	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@H](C)C(F)(F)F)c1ccccc1	ZINC000540459306	333730741	/nfs/dbraw/zinc/73/07/41/333730741.db2.gz	WDESWZKMFWVQBC-GXTWGEPZSA-N	1	0	271.326	4.482	20	30		CIEDRO
Cc1ccc(CC[C@H](C)[NH2+][C@@H](C)c2ccc(C#N)cc2)o1	ZINC000540593566	333736588	/nfs/dbraw/zinc/73/65/88/333736588.db2.gz	KPKRWICNMWKGIN-ZFWWWQNUSA-N	1	0	282.387	4.132	20	30		CIEDRO
C[C@H]([NH2+]CCc1ccccc1Cl)c1ccc(C#N)cc1	ZINC000540595792	333736719	/nfs/dbraw/zinc/73/67/19/333736719.db2.gz	ARTRZYNHTRVLJB-ZDUSSCGKSA-N	1	0	284.790	4.105	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C	ZINC000540606812	333737503	/nfs/dbraw/zinc/73/75/03/333737503.db2.gz	QERJUSNJQLNQFF-GXTWGEPZSA-N	1	0	276.380	4.299	20	30		CIEDRO
C[C@@H]([NH2+]CCCc1ccc(Cl)cc1)c1cccc(C#N)c1	ZINC000540606344	333737610	/nfs/dbraw/zinc/73/76/10/333737610.db2.gz	JYMXIELAVRUUGX-CQSZACIVSA-N	1	0	298.817	4.495	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2)s1	ZINC000540616076	333738461	/nfs/dbraw/zinc/73/84/61/333738461.db2.gz	ZEWKBNWTUILJTF-YJBOKZPZSA-N	1	0	296.439	4.121	20	30		CIEDRO
N#CCCC[NH2+]Cc1cccc(OCC2CCCCC2)c1	ZINC000541380499	333774442	/nfs/dbraw/zinc/77/44/42/333774442.db2.gz	NPBMPUNAIISATE-UHFFFAOYSA-N	1	0	286.419	4.039	20	30		CIEDRO
CCc1c2cc(C)ccc2oc1[C@@H](C)[NH2+]CCCC#N	ZINC000541569187	333781304	/nfs/dbraw/zinc/78/13/04/333781304.db2.gz	QHTCLAMDADJWRP-CYBMUJFWSA-N	1	0	270.376	4.258	20	30		CIEDRO
C=CCC[C@H](C)[NH2+]C[C@@H]1CCC[C@@H](C(F)(F)F)C1	ZINC000541737645	333788883	/nfs/dbraw/zinc/78/88/83/333788883.db2.gz	YPEWXUZZTAYMNI-YNEHKIRRSA-N	1	0	263.347	4.299	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](C)c1csc(CC)n1	ZINC000542573808	333832636	/nfs/dbraw/zinc/83/26/36/333832636.db2.gz	KYUHBJGXCFBWHP-RYUDHWBXSA-N	1	0	252.427	4.101	20	30		CIEDRO
C=CCSCC[NH2+][C@@H](C)c1ccc(-c2ccncc2)cc1	ZINC000542826905	333843217	/nfs/dbraw/zinc/84/32/17/333843217.db2.gz	CNTDFSSNWTVEDV-HNNXBMFYSA-N	1	0	298.455	4.318	20	30		CIEDRO
CC#CC[NH2+][C@@H](C)c1sc(-c2ccc(C)cc2)nc1C	ZINC000543516500	333878764	/nfs/dbraw/zinc/87/87/64/333878764.db2.gz	WLYAAEGFSVMBIX-ZDUSSCGKSA-N	1	0	284.428	4.101	20	30		CIEDRO
C=CCC[NH2+][C@H](C)[C@H](C)c1ccccc1C(F)(F)F	ZINC000544453999	333932130	/nfs/dbraw/zinc/93/21/30/333932130.db2.gz	BTFONSBLTCLLKW-NWDGAFQWSA-N	1	0	271.326	4.363	20	30		CIEDRO
C=CCC[NH2+][C@@H](C)[C@H](C)c1ccccc1C(F)(F)F	ZINC000544454000	333932215	/nfs/dbraw/zinc/93/22/15/333932215.db2.gz	BTFONSBLTCLLKW-RYUDHWBXSA-N	1	0	271.326	4.363	20	30		CIEDRO
C[C@@H]([NH2+]C1CC(c2ccccc2)C1)c1ccc(C#N)c(F)c1	ZINC000545274808	333975126	/nfs/dbraw/zinc/97/51/26/333975126.db2.gz	UZSIXNDJXBBEJD-NLNFPOJYSA-N	1	0	294.373	4.294	20	30		CIEDRO
C[C@H]([NH2+]C1CC(c2ccccc2)C1)c1cccc(C#N)c1	ZINC000545981964	334010211	/nfs/dbraw/zinc/01/02/11/334010211.db2.gz	AWQKDZSZMMXNCI-YCMKEVRSSA-N	1	0	276.383	4.155	20	30		CIEDRO
CC(C)(C)c1ccc(CC[NH2+]CC(C)(C)CCC#N)cc1	ZINC000236818191	334074445	/nfs/dbraw/zinc/07/44/45/334074445.db2.gz	DQJWFFVCPPWZES-UHFFFAOYSA-N	1	0	286.463	4.446	20	30		CIEDRO
C=CC[C@@H](CO)[NH2+][C@H](C)c1ccc(-c2ccccc2)s1	ZINC000547393069	334085279	/nfs/dbraw/zinc/08/52/79/334085279.db2.gz	BTEFCYANEKHNDN-HIFRSBDPSA-N	1	0	287.428	4.003	20	30		CIEDRO
N#Cc1cccc(C[N@@H+]2CCCC[C@@H]2c2ccccc2)c1	ZINC000547398524	334085556	/nfs/dbraw/zinc/08/55/56/334085556.db2.gz	PJOBLYKAZYKLJU-LJQANCHMSA-N	1	0	276.383	4.285	20	30		CIEDRO
CC(C)(CCc1ccccc1)[NH2+]Cc1ccc(C#N)cc1	ZINC000134521158	334093487	/nfs/dbraw/zinc/09/34/87/334093487.db2.gz	PKVZFJBEXZWADQ-UHFFFAOYSA-N	1	0	278.399	4.059	20	30		CIEDRO
N#Cc1ccc(C[NH2+]Cc2csc3ccccc23)c(F)c1	ZINC000237710287	334095688	/nfs/dbraw/zinc/09/56/88/334095688.db2.gz	ATOUVCPVPRIHLR-UHFFFAOYSA-N	1	0	296.370	4.202	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000134732196	334101998	/nfs/dbraw/zinc/10/19/98/334101998.db2.gz	ROZHCURAOPDBRV-QWRGUYRKSA-N	1	0	257.299	4.321	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1	ZINC000135143303	334117542	/nfs/dbraw/zinc/11/75/42/334117542.db2.gz	OEVIEQZWOYZQHH-NWDGAFQWSA-N	1	0	276.346	4.027	20	30		CIEDRO
C=C(C)[C@@H]([NH2+]CC=C(C)C)c1ccc(F)c(F)c1	ZINC000547836227	334125606	/nfs/dbraw/zinc/12/56/06/334125606.db2.gz	RQLADQCNXCQOOS-OAHLLOKOSA-N	1	0	251.320	4.138	20	30		CIEDRO
C[C@H]1CCN(CCC#N)[C@@H]1c1ccc(C(F)(F)F)cc1	ZINC000135395118	334128450	/nfs/dbraw/zinc/12/84/50/334128450.db2.gz	RVGCMNHKTJJCOO-FZMZJTMJSA-N	1	0	282.309	4.002	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@@H](C)c1ccccc1OC(F)F	ZINC000135714794	334136875	/nfs/dbraw/zinc/13/68/75/334136875.db2.gz	PGOQKYOQKURVLG-RYUDHWBXSA-N	1	0	269.335	4.293	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+][C@H](C)c1ccccc1OC(F)F	ZINC000135714875	334136983	/nfs/dbraw/zinc/13/69/83/334136983.db2.gz	PGOQKYOQKURVLG-VXGBXAGGSA-N	1	0	269.335	4.293	20	30		CIEDRO
N#Cc1ccc(C[NH2+]C2(c3ccc(F)cc3F)CCC2)cc1	ZINC000136135415	334147813	/nfs/dbraw/zinc/14/78/13/334147813.db2.gz	ZBQFESKWDGINEX-UHFFFAOYSA-N	1	0	298.336	4.005	20	30		CIEDRO
C=CCC[NH2+][C@H](c1cc(F)cc(Br)c1)C1CC1	ZINC000548492907	334160460	/nfs/dbraw/zinc/16/04/60/334160460.db2.gz	BRXKGXZVQMBIBL-AWEZNQCLSA-N	1	0	298.199	4.205	20	30		CIEDRO
Cc1ccc(C[C@@H](C)[NH2+][C@H](C)c2ccc(C#N)cc2)s1	ZINC000080242141	334168288	/nfs/dbraw/zinc/16/82/88/334168288.db2.gz	NXSYZGWEJHFBSL-TZMCWYRMSA-N	1	0	284.428	4.210	20	30		CIEDRO
CC[N@H+](Cc1ccc2ccccc2c1)[C@@H]1CC[C@H](C#N)C1	ZINC000549772094	334204472	/nfs/dbraw/zinc/20/44/72/334204472.db2.gz	FBNFQKSWKMFJMO-HNAYVOBHSA-N	1	0	278.399	4.354	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]Cc1cc2cc(OC)ccc2o1	ZINC000549827534	334206056	/nfs/dbraw/zinc/20/60/56/334206056.db2.gz	ALYVIDVXXVBWJD-UHFFFAOYSA-N	1	0	273.376	4.133	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H]1CCN([C@@H](C)c2ccccc2)C1	ZINC000549833069	334206417	/nfs/dbraw/zinc/20/64/17/334206417.db2.gz	LWLFHGOHBFBYQC-WMZOPIPTSA-N	1	0	286.463	4.014	20	30		CIEDRO
Cc1c2ccccc2oc1[C@H](C)[NH2+][C@@H]1CC[C@@H](C#N)C1	ZINC000549931314	334209328	/nfs/dbraw/zinc/20/93/28/334209328.db2.gz	JADUSGRRLBRLDU-BFHYXJOUSA-N	1	0	268.360	4.084	20	30		CIEDRO
Cc1ccc2c(c1)C[N@@H+](CCC(C)(C)C#N)C(C)(C)C2	ZINC000550001479	334211195	/nfs/dbraw/zinc/21/11/95/334211195.db2.gz	UGTOSVHBHODXFT-UHFFFAOYSA-N	1	0	270.420	4.072	20	30		CIEDRO
C[C@@H]([NH2+]C[C@H](c1ccccc1)C1CC1)c1ccc(C#N)cc1	ZINC000550846850	334230142	/nfs/dbraw/zinc/23/01/42/334230142.db2.gz	ISNVTFTXZIHXRH-FOIQADDNSA-N	1	0	290.410	4.403	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H](C)c1ccnn1-c1ccccc1	ZINC000550857052	334230403	/nfs/dbraw/zinc/23/04/03/334230403.db2.gz	MTBUOKSLCWKLSJ-HNNXBMFYSA-N	1	0	283.419	4.125	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H]1CCCc2c(O)cccc21	ZINC000550933357	334234194	/nfs/dbraw/zinc/23/41/94/334234194.db2.gz	RBEMGPQSGZDNHI-CJNGLKHVSA-N	1	0	259.393	4.104	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H](C)c1cc(OC)c(OC)cc1F	ZINC000551240292	334242329	/nfs/dbraw/zinc/24/23/29/334242329.db2.gz	INJWMEFXYODIJA-LBPRGKRZSA-N	1	0	295.398	4.096	20	30		CIEDRO
C=CCCCCC[NH+]1CCC(CC(F)(F)F)CC1	ZINC000551402272	334249318	/nfs/dbraw/zinc/24/93/18/334249318.db2.gz	XILOGICDBCBFPD-UHFFFAOYSA-N	1	0	263.347	4.397	20	30		CIEDRO
Cc1cccc(CCC[NH2+]C2(c3cccc(C#N)c3)CC2)c1	ZINC000551410863	334249746	/nfs/dbraw/zinc/24/97/46/334249746.db2.gz	GYXQWHVGURBNBQ-UHFFFAOYSA-N	1	0	290.410	4.078	20	30		CIEDRO
CC[C@H]1CCC[C@H]([NH2+]C2(c3cccc(C#N)c3)CC2)C1	ZINC000551565108	334254458	/nfs/dbraw/zinc/25/44/58/334254458.db2.gz	BPCIIGFRKAXWQG-YOEHRIQHSA-N	1	0	268.404	4.106	20	30		CIEDRO
CC1=CCC[C@@H](C)[C@H]1C[NH2+]C1(c2cccc(C#N)c2)CC1	ZINC000551602720	334255758	/nfs/dbraw/zinc/25/57/58/334255758.db2.gz	LYJBEZGBIOBKFL-QAPCUYQASA-N	1	0	280.415	4.129	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H](CO)CC1CCCC1)c1ccco1	ZINC000552055956	334282479	/nfs/dbraw/zinc/28/24/79/334282479.db2.gz	KUNMLWQYKRLZLR-IRXDYDNUSA-N	1	0	291.435	4.065	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H]1CCC(F)(F)C1)c1ccco1	ZINC000552056174	334282528	/nfs/dbraw/zinc/28/25/28/334282528.db2.gz	VQBZAKVVJWMMGJ-OLZOCXBDSA-N	1	0	269.335	4.312	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@@H]1CCC(F)(F)C1)c1ccco1	ZINC000552056173	334282615	/nfs/dbraw/zinc/28/26/15/334282615.db2.gz	VQBZAKVVJWMMGJ-CHWSQXEVSA-N	1	0	269.335	4.312	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCc1cccc(OC)c1)c1ccco1	ZINC000552226158	334305590	/nfs/dbraw/zinc/30/55/90/334305590.db2.gz	WUPYRFSTBCAMCU-KRWDZBQOSA-N	1	0	285.387	4.128	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCOCc1ccccc1)c1ccco1	ZINC000552249862	334308355	/nfs/dbraw/zinc/30/83/55/334308355.db2.gz	NCCYMDLLCRGYHI-QGZVFWFLSA-N	1	0	285.387	4.093	20	30		CIEDRO
CC(C)(CCC#N)C[N@@H+]1CCC[C@H](c2ccccc2)C1	ZINC000552274360	334311152	/nfs/dbraw/zinc/31/11/52/334311152.db2.gz	PLNPWSZFZPQAFF-KRWDZBQOSA-N	1	0	270.420	4.196	20	30		CIEDRO
CC(C)(C)C(C)(C)[NH2+]Cc1cccc(OCCCC#N)c1	ZINC000552292034	334313842	/nfs/dbraw/zinc/31/38/42/334313842.db2.gz	BVWTVXRRJDJSHH-UHFFFAOYSA-N	1	0	288.435	4.283	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)c1c(F)cccc1Cl	ZINC000248727830	334314774	/nfs/dbraw/zinc/31/47/74/334314774.db2.gz	CYHVFGOYLCYKRJ-TUAOUCFPSA-N	1	0	280.774	4.212	20	30		CIEDRO
Cc1cc(C)cc([C@H](C)[NH2+][C@H]2CCC[C@@H](C#N)C2)c1	ZINC000248735530	334315346	/nfs/dbraw/zinc/31/53/46/334315346.db2.gz	DOBKSHOPCPTMPU-UXLLHSPISA-N	1	0	256.393	4.036	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[C@H]2Cc2ccccc2)C1	ZINC000248752214	334315973	/nfs/dbraw/zinc/31/59/73/334315973.db2.gz	FXNFEYLOLGOTNT-YDZRNGNQSA-N	1	0	282.431	4.070	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)c1cccc(OC(F)F)c1	ZINC000248813914	334317901	/nfs/dbraw/zinc/31/79/01/334317901.db2.gz	KSUHZNNOGJYHOQ-OUCADQQQSA-N	1	0	294.345	4.021	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)c1cccc(N2CCCC2)c1	ZINC000248892344	334321069	/nfs/dbraw/zinc/32/10/69/334321069.db2.gz	SUBCYLLMSHJYER-LZLYRXPVSA-N	1	0	297.446	4.020	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)c1cccc(Cl)c1	ZINC000248922026	334321830	/nfs/dbraw/zinc/32/18/30/334321830.db2.gz	WTVRZPKMRYMKDG-KCXAZCMYSA-N	1	0	276.811	4.463	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@@H](c2ccc(F)cc2)C2CCC2)C1	ZINC000249050838	334325775	/nfs/dbraw/zinc/32/57/75/334325775.db2.gz	XKHNKPYDKUWYRA-JEBQAFNWSA-N	1	0	286.394	4.339	20	30		CIEDRO
C[C@H]1CCC[C@@H]1[NH2+]C1CCC(Oc2ccccc2C#N)CC1	ZINC000088720169	334340817	/nfs/dbraw/zinc/34/08/17/334340817.db2.gz	SAODOFANKSPPST-KUQKPQIMSA-N	1	0	298.430	4.026	20	30		CIEDRO
C=CCCOCC[NH2+][C@@H](CC)c1ccc(Cl)s1	ZINC000090883636	334368977	/nfs/dbraw/zinc/36/89/77/334368977.db2.gz	LQVVMCQWMYMWGD-NSHDSACASA-N	1	0	273.829	4.035	20	30		CIEDRO
C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1cccc(C#N)c1	ZINC000252139652	334374707	/nfs/dbraw/zinc/37/47/07/334374707.db2.gz	GFJBSHQFTJTDFY-LBPRGKRZSA-N	1	0	286.325	4.029	20	30		CIEDRO
CC[C@@H]1CCCC[C@@H]1[NH2+][C@H](C)c1cccc(C#N)c1	ZINC000252423726	334379317	/nfs/dbraw/zinc/37/93/17/334379317.db2.gz	BCLJUCMFAYYXDD-UNEWFSDZSA-N	1	0	256.393	4.178	20	30		CIEDRO
C=C1CC[NH+](Cc2ccc(-c3ccccc3C#N)cc2)CC1	ZINC000553352378	334379602	/nfs/dbraw/zinc/37/96/02/334379602.db2.gz	GWAMTUBMXCJVRG-UHFFFAOYSA-N	1	0	288.394	4.377	20	30		CIEDRO
N#Cc1csc(C[NH2+]C2(c3ccc(Cl)cc3)CC2)c1	ZINC000553435159	334384956	/nfs/dbraw/zinc/38/49/56/334384956.db2.gz	JTVZDYFDYBXUEB-UHFFFAOYSA-N	1	0	288.803	4.052	20	30		CIEDRO
C[C@H]([NH2+]CCCc1cccc(Cl)c1)c1cccc(C#N)c1	ZINC000553439340	334385389	/nfs/dbraw/zinc/38/53/89/334385389.db2.gz	WZPRQLXQQXRUGM-AWEZNQCLSA-N	1	0	298.817	4.495	20	30		CIEDRO
Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+]CC(C)(C)CCC#N	ZINC000554076490	334409668	/nfs/dbraw/zinc/40/96/68/334409668.db2.gz	FBCJSCMLFYOIMG-ZBFHGGJFSA-N	1	0	270.420	4.463	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+][C@H](C)c1nccn1-c1ccccc1	ZINC000554085256	334410136	/nfs/dbraw/zinc/41/01/36/334410136.db2.gz	DXOUOONALKZWRJ-HZPDHXFCSA-N	1	0	283.419	4.268	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]C[C@H]2C[C@@H]2c2ccccc2)cc1	ZINC000554112042	334412989	/nfs/dbraw/zinc/41/29/89/334412989.db2.gz	GEECSONGYFSOJD-UYAOXDASSA-N	1	0	293.410	4.145	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@@H](C)c1ccc(OC)c(OC)c1C	ZINC000554141032	334414175	/nfs/dbraw/zinc/41/41/75/334414175.db2.gz	UGHYBOOBYQDKFE-QEJZJMRPSA-N	1	0	291.435	4.264	20	30		CIEDRO
C[C@H]([NH2+]CC(C)(C)CCC#N)[C@@H]1C[C@H]1c1ccccc1	ZINC000554365585	334424737	/nfs/dbraw/zinc/42/47/37/334424737.db2.gz	OMGHVUHGPZWDCI-XIRDDKMYSA-N	1	0	270.420	4.098	20	30		CIEDRO
C[C@@H](CC[NH2+][C@H]1CCc2ccc(C#N)cc21)c1ccccc1	ZINC000554997998	334464275	/nfs/dbraw/zinc/46/42/75/334464275.db2.gz	UYWHZDSRACTUNJ-YWZLYKJASA-N	1	0	290.410	4.329	20	30		CIEDRO
CC(C)=CCC[C@@H](C)CC[NH+]1CCC(CC#N)CC1	ZINC000555419799	334478062	/nfs/dbraw/zinc/47/80/62/334478062.db2.gz	BZPWWPLQDIHDGR-MRXNPFEDSA-N	1	0	262.441	4.385	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H](c1ncc[nH]1)C1CCCCC1	ZINC000556218492	334500530	/nfs/dbraw/zinc/50/05/30/334500530.db2.gz	VFCWWXOWYFSRAX-HNNXBMFYSA-N	1	0	275.440	4.223	20	30		CIEDRO
C[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(C#N)cc2C(F)(F)F)C1	ZINC000564416044	334507681	/nfs/dbraw/zinc/50/76/81/334507681.db2.gz	WIJQFLIKXSTSOA-BXUZGUMPSA-N	1	0	296.336	4.245	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]CCC1CCCCCC1	ZINC000565089837	334538070	/nfs/dbraw/zinc/53/80/70/334538070.db2.gz	UIZBZYCWUCOIKQ-UHFFFAOYSA-N	1	0	250.430	4.266	20	30		CIEDRO
C=CCCCC[NH2+][C@@H](C)c1nccc2ccccc21	ZINC000567404667	334713386	/nfs/dbraw/zinc/71/33/86/334713386.db2.gz	IGJVVTWWXCNALH-AWEZNQCLSA-N	1	0	254.377	4.242	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](C)c1ccc(OC)c(OC)c1C	ZINC000567877568	334770970	/nfs/dbraw/zinc/77/09/70/334770970.db2.gz	LCDICJUNVYCICX-DZGCQCFKSA-N	1	0	291.435	4.408	20	30		CIEDRO
C[C@H](CCc1cccc(F)c1)[NH+]1CCC(CCC#N)CC1	ZINC000573207831	334918008	/nfs/dbraw/zinc/91/80/08/334918008.db2.gz	NVOKELJABVIHKD-OAHLLOKOSA-N	1	0	288.410	4.163	20	30		CIEDRO
CC(C)[N@@H+](CCC#N)CCCc1c(F)cccc1Cl	ZINC000580694358	335333513	/nfs/dbraw/zinc/33/35/13/335333513.db2.gz	GPONOVRURVLDLI-UHFFFAOYSA-N	1	0	282.790	4.036	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CCc2sc(Cl)cc2C1	ZINC000577277506	335334019	/nfs/dbraw/zinc/33/40/19/335334019.db2.gz	SHWQMCFYHZJGNQ-UHFFFAOYSA-N	1	0	282.840	4.090	20	30		CIEDRO
Cc1ccc([C@H](C)[NH2+]Cc2ccc(CC#N)cc2)cc1C	ZINC000577438330	335352238	/nfs/dbraw/zinc/35/22/38/335352238.db2.gz	JPFHYRRETJHKKL-INIZCTEOSA-N	1	0	278.399	4.220	20	30		CIEDRO
N#Cc1csc(C[NH2+]CCc2cccc3ccccc32)c1	ZINC000177684744	335378871	/nfs/dbraw/zinc/37/88/71/335378871.db2.gz	PWRVWGOBSLHSBM-UHFFFAOYSA-N	1	0	292.407	4.105	20	30		CIEDRO
N#Cc1csc(C[NH2+]Cc2ccc3ccccc3c2)c1	ZINC000177691177	335379260	/nfs/dbraw/zinc/37/92/60/335379260.db2.gz	JVCFBGIBZLLPBN-UHFFFAOYSA-N	1	0	278.380	4.063	20	30		CIEDRO
Cc1cccc([C@@H](C)[NH2+]Cc2cc(C#N)cs2)c1C	ZINC000177702388	335379999	/nfs/dbraw/zinc/37/99/99/335379999.db2.gz	RTQHLNGKUSTVAN-CYBMUJFWSA-N	1	0	270.401	4.087	20	30		CIEDRO
Cc1cc([C@H](C)[NH2+]Cc2ccc(CC#N)cc2)c(C)s1	ZINC000347521056	335382845	/nfs/dbraw/zinc/38/28/45/335382845.db2.gz	ASWIMPXXQVEWDI-ZDUSSCGKSA-N	1	0	284.428	4.282	20	30		CIEDRO
C=CC[N@H+](Cc1cccs1)CC1(SC)CCC1	ZINC000577687243	335388790	/nfs/dbraw/zinc/38/87/90/335388790.db2.gz	NUTCPDNEUOCTPO-UHFFFAOYSA-N	1	0	267.463	4.022	20	30		CIEDRO
CC1(C)C[C@H]([NH2+]Cc2ccc(C#N)cc2F)c2ccccc21	ZINC000177860000	335404212	/nfs/dbraw/zinc/40/42/12/335404212.db2.gz	IVCNNZNBFVNRTJ-SFHVURJKSA-N	1	0	294.373	4.210	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@@H]1CCCc2cc(OC)ccc21	ZINC000348288624	335421885	/nfs/dbraw/zinc/42/18/85/335421885.db2.gz	FLJLAMAURPJLAS-WMLDXEAASA-N	1	0	259.393	4.017	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](C)c1cccc(-c2ccncc2)c1	ZINC000180951605	335630866	/nfs/dbraw/zinc/63/08/66/335630866.db2.gz	FBJBMSZKUSBISH-CABCVRRESA-N	1	0	266.388	4.364	20	30		CIEDRO
CC[C@@H]([NH2+]CCCC(C)(C)C#N)c1ccc(C)cc1	ZINC000181680926	335778080	/nfs/dbraw/zinc/77/80/80/335778080.db2.gz	KJAGXLSBJCPASH-MRXNPFEDSA-N	1	0	258.409	4.366	20	30		CIEDRO
Cc1cnc([C@H]([NH2+][C@@H](C)c2ccc(C#N)cc2)C2CC2)s1	ZINC000181820450	335786620	/nfs/dbraw/zinc/78/66/20/335786620.db2.gz	HSTZAOKGYUWDEV-BLLLJJGKSA-N	1	0	297.427	4.125	20	30		CIEDRO
C[C@H](C[NH2+][C@@H](C)c1ccc(C#N)cc1)Cc1cccs1	ZINC000181817220	335786807	/nfs/dbraw/zinc/78/68/07/335786807.db2.gz	CUOSKHCGXGPHJT-KBPBESRZSA-N	1	0	284.428	4.149	20	30		CIEDRO
C[C@@H]([NH2+]C[C@H](C)Sc1ccccc1)c1cccc(C#N)c1	ZINC000181832031	335787293	/nfs/dbraw/zinc/78/72/93/335787293.db2.gz	RMWYMAQGXFCXEU-LSDHHAIUSA-N	1	0	296.439	4.390	20	30		CIEDRO
CCc1ccc([C@H](C)[NH2+]C2(c3cccc(C#N)c3)CC2)cc1	ZINC000579604950	335820018	/nfs/dbraw/zinc/82/00/18/335820018.db2.gz	SAMPNCLZAJTYPS-HNNXBMFYSA-N	1	0	290.410	4.461	20	30		CIEDRO
COc1cc(C[NH2+][C@H](CCC#N)c2ccccc2)ccc1C	ZINC000194392377	336019527	/nfs/dbraw/zinc/01/95/27/336019527.db2.gz	BTKDGIXJFIDJBV-GOSISDBHSA-N	1	0	294.398	4.138	20	30		CIEDRO
C[C@@H]1C[C@H](C(C)(C)C)CC[N@@H+]1CCCC(C)(C)C#N	ZINC000581241676	336029795	/nfs/dbraw/zinc/02/97/95/336029795.db2.gz	MOFXRAXWZHYPDH-HUUCEWRRSA-N	1	0	264.457	4.463	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]Cc1ccc(Br)s1	ZINC000381841896	336074158	/nfs/dbraw/zinc/07/41/58/336074158.db2.gz	ULOHMHBYUVGVST-UHFFFAOYSA-N	1	0	288.254	4.203	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000581732299	336139595	/nfs/dbraw/zinc/13/95/95/336139595.db2.gz	NRJQUVUKGNMYOY-GJZGRUSLSA-N	1	0	256.393	4.344	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]Cc1cnc(C(C)(C)C)s1	ZINC000386811756	336179893	/nfs/dbraw/zinc/17/98/93/336179893.db2.gz	NYYZPQHFVIQWAJ-UHFFFAOYSA-N	1	0	266.454	4.133	20	30		CIEDRO
CC[C@H]1CCCC[C@H]1[N@H+](C)Cc1ccc(C#N)s1	ZINC000581971206	336181051	/nfs/dbraw/zinc/18/10/51/336181051.db2.gz	MJLLKHLHBLARBF-SWLSCSKDSA-N	1	0	262.422	4.020	20	30		CIEDRO
C[C@@H]([NH2+]C1CC(c2cccc(F)c2)C1)c1ccc(C#N)cc1	ZINC000387266230	336191001	/nfs/dbraw/zinc/19/10/01/336191001.db2.gz	GKDXGYXZIBQIJU-UYCDIGJJSA-N	1	0	294.373	4.294	20	30		CIEDRO
COc1cc(C)ccc1[C@H](C)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000387417496	336193553	/nfs/dbraw/zinc/19/35/53/336193553.db2.gz	FJTJFJGVZYIGLF-GJZGRUSLSA-N	1	0	294.398	4.287	20	30		CIEDRO
C[C@H]([NH2+]C[C@@H](C#N)CCC#N)c1ccc(F)c2ccccc21	ZINC000352270375	533876466	/nfs/dbraw/zinc/87/64/66/533876466.db2.gz	FVIFHFQHYHMZHF-UONOGXRCSA-N	1	0	295.361	4.073	20	30		CIEDRO
Cc1ccc(C[N@H+](Cc2ccc(C#N)cc2)CC(C)C)o1	ZINC000350659268	533902405	/nfs/dbraw/zinc/90/24/05/533902405.db2.gz	LSOIEOYVSKITHT-UHFFFAOYSA-N	1	0	282.387	4.118	20	30		CIEDRO
Cc1ccc(-c2nc(C[NH2+]CC(C)(C)CCC#N)co2)cc1	ZINC000344739675	534215417	/nfs/dbraw/zinc/21/54/17/534215417.db2.gz	JKNORDWNEVISLA-UHFFFAOYSA-N	1	0	297.402	4.070	20	30		CIEDRO
CC(C)[C@H]([NH2+]Cc1ccccc1C#N)c1ccccc1	ZINC000057627855	519821094	/nfs/dbraw/zinc/82/10/94/519821094.db2.gz	NODMOQPEDUDASV-SFHVURJKSA-N	1	0	264.372	4.045	20	30		CIEDRO
Cc1ccc2c(c1)[C@H]([NH2+]CC1CCC(C#N)CC1)CCCO2	ZINC000367036510	534450900	/nfs/dbraw/zinc/45/09/00/534450900.db2.gz	OIJRAVQZZNLBRH-LEOMRAHMSA-N	1	0	298.430	4.128	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(C)cc1OC)c1ccc(C#N)cc1	ZINC000278797559	522645678	/nfs/dbraw/zinc/64/56/78/522645678.db2.gz	QYNRMXPGXAODDN-SFHVURJKSA-N	1	0	294.398	4.116	20	30		CIEDRO
CC[C@H]([NH2+][C@@H](C)c1cccc(C#N)c1)c1ccccc1	ZINC000051627094	522699333	/nfs/dbraw/zinc/69/93/33/522699333.db2.gz	NOTMDEAVFLIMNR-KSSFIOAISA-N	1	0	264.372	4.360	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CCc2c1cccc2F)c1ccc(C#N)cc1	ZINC000278701816	522759684	/nfs/dbraw/zinc/75/96/84/522759684.db2.gz	LCSDSUUBOMQOLM-OALUTQOASA-N	1	0	294.373	4.426	20	30		CIEDRO
CC[C@@H]([NH2+]C[C@@H](C)c1nc(C)cs1)c1ccc(C#N)cc1	ZINC000278371483	522846866	/nfs/dbraw/zinc/84/68/66/522846866.db2.gz	CFTKXGWAJUTNNT-MLGOLLRUSA-N	1	0	299.443	4.168	20	30		CIEDRO
CC[C@@H]([NH2+]C[C@H](C)c1c(C)noc1C)c1ccc(C#N)cc1	ZINC000278832985	522858860	/nfs/dbraw/zinc/85/88/60/522858860.db2.gz	UEIQKRYSXQMFBE-YVEFUNNKSA-N	1	0	297.402	4.008	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccccc1C#N)c1cccc(Cl)c1	ZINC000125273222	522885066	/nfs/dbraw/zinc/88/50/66/522885066.db2.gz	UOCCFCGKHJWCHM-QGZVFWFLSA-N	1	0	284.790	4.453	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)c1ccccc1O	ZINC000036991849	522912214	/nfs/dbraw/zinc/91/22/14/522912214.db2.gz	KSVRQXHOQMKFCY-SUMWQHHRSA-N	1	0	280.371	4.066	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)c1ccccc1	ZINC000036991916	522912237	/nfs/dbraw/zinc/91/22/37/522912237.db2.gz	ONIHEVMWCFKMER-KBXCAEBGSA-N	1	0	264.372	4.360	20	30		CIEDRO
CC[C@@H]([NH2+][C@H]1CCc2c1cccc2F)c1ccc(C#N)cc1	ZINC000278701810	522950916	/nfs/dbraw/zinc/95/09/16/522950916.db2.gz	LCSDSUUBOMQOLM-MOPGFXCFSA-N	1	0	294.373	4.426	20	30		CIEDRO
C[C@H]1C[C@@H]([NH2+]C2(c3cccc(C#N)c3)CC2)c2ccccc21	ZINC000290275753	524804097	/nfs/dbraw/zinc/80/40/97/524804097.db2.gz	LVCWFHLXSMHXSY-IFXJQAMLSA-N	1	0	288.394	4.385	20	30		CIEDRO
Cc1cc([C@H](C)[NH2+]C2(c3cccc(C#N)c3)CC2)c(C)o1	ZINC000278888355	525516181	/nfs/dbraw/zinc/51/61/81/525516181.db2.gz	YKXCBPIASRGARV-ZDUSSCGKSA-N	1	0	280.371	4.108	20	30		CIEDRO
C[C@H]([NH2+][C@@H](C)c1cccc(C#N)c1)c1cccs1	ZINC000037235457	525533302	/nfs/dbraw/zinc/53/33/02/525533302.db2.gz	JFEZTCKYIMJQJW-RYUDHWBXSA-N	1	0	256.374	4.032	20	30		CIEDRO
C[C@@H]([NH2+]Cc1coc2ccccc12)c1cccc(C#N)c1	ZINC000340426810	525554799	/nfs/dbraw/zinc/55/47/99/525554799.db2.gz	NZGGQQKHEOSRBF-CYBMUJFWSA-N	1	0	276.339	4.155	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCCc2ccccc21)c1cccc(C#N)c1	ZINC000037230739	525615239	/nfs/dbraw/zinc/61/52/39/525615239.db2.gz	MMHLGGFTDPMPQT-LIRRHRJNSA-N	1	0	276.383	4.286	20	30		CIEDRO
Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH2+]Cc1cccc(C#N)c1	ZINC000042797761	525626278	/nfs/dbraw/zinc/62/62/78/525626278.db2.gz	VFWJQBKNPCUVQY-KRWDZBQOSA-N	1	0	294.398	4.263	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](c1ccccc1)C1CC1)c1ccc(C#N)cc1	ZINC000037075244	525629214	/nfs/dbraw/zinc/62/92/14/525629214.db2.gz	MASXFZLJOIMMKB-KUHUBIRLSA-N	1	0	276.383	4.360	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCCc2sccc21)c1cccc(C#N)c1	ZINC000061360182	525639817	/nfs/dbraw/zinc/63/98/17/525639817.db2.gz	PXPMVNJVRGIKBH-MLGOLLRUSA-N	1	0	282.412	4.348	20	30		CIEDRO
C[C@@H]([NH2+][C@H](C)c1ccc(C#N)cc1)c1ccsc1	ZINC000050341527	525656721	/nfs/dbraw/zinc/65/67/21/525656721.db2.gz	VHLKNJZTPBSYTK-VXGBXAGGSA-N	1	0	256.374	4.032	20	30		CIEDRO
Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(C#N)cc2)s1	ZINC000036991880	525738760	/nfs/dbraw/zinc/73/87/60/525738760.db2.gz	WTKFQIBQSLRJRU-QWHCGFSZSA-N	1	0	270.401	4.340	20	30		CIEDRO
Cc1ccsc1[C@@H](C)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000070090728	525871126	/nfs/dbraw/zinc/87/11/26/525871126.db2.gz	LMMJQPDYMOOTFD-QWHCGFSZSA-N	1	0	270.401	4.340	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]C[C@H]1CCC[C@H](C(F)(F)F)C1	ZINC000344601865	526999622	/nfs/dbraw/zinc/99/96/22/526999622.db2.gz	KKRIYSLHWQKOBZ-STQMWFEESA-N	1	0	290.373	4.275	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@@H](CC)c1ccc(OC)c(OC)c1	ZINC000352250108	527465017	/nfs/dbraw/zinc/46/50/17/527465017.db2.gz	CAGIKOGWFAYCFI-ZFWWWQNUSA-N	1	0	277.408	4.099	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H](C)c1ncc(C)s1)c1ccco1	ZINC000353671890	527483782	/nfs/dbraw/zinc/48/37/82/527483782.db2.gz	PADZVOAFGJBEJN-OCCSQVGLSA-N	1	0	290.432	4.445	20	30		CIEDRO
CC1(C#N)CCC([NH2+]C[C@@H]2CCCCC(F)(F)C2)CC1	ZINC000336208326	528832267	/nfs/dbraw/zinc/83/22/67/528832267.db2.gz	BTNLQGFOGDOZFB-WLYUNCDWSA-N	1	0	284.394	4.264	20	30		CIEDRO
CC[C@@H]([NH2+]CC1CCC(C#N)CC1)c1cc(F)ccc1F	ZINC000442865481	529158069	/nfs/dbraw/zinc/15/80/69/529158069.db2.gz	IJQHYKLXZJWIKE-QWQCLYJRSA-N	1	0	292.373	4.335	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@H]1CCCc2ccc(OC)cc21	ZINC000343508067	335206012	/nfs/dbraw/zinc/20/60/12/335206012.db2.gz	PKFORGPHNAYNBS-PBHICJAKSA-N	1	0	259.393	4.017	20	30		CIEDRO
CC(C)=CCC[C@@H](C)[NH2+][C@H](C)c1cccc(C#N)c1	ZINC000573996388	334983673	/nfs/dbraw/zinc/98/36/73/334983673.db2.gz	OQAJDZWLKOMGBS-HUUCEWRRSA-N	1	0	256.393	4.344	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+]C[C@H]1CC[C@H](c2ccccc2)O1	ZINC000573997421	334983807	/nfs/dbraw/zinc/98/38/07/334983807.db2.gz	IKTWMDUFTGEECD-CWLKWCNXSA-N	1	0	273.420	4.097	20	30		CIEDRO
C=CC(C)(C)C[NH2+]Cc1cnc(-c2ccc(C)o2)s1	ZINC000449486422	260646222	/nfs/dbraw/zinc/64/62/22/260646222.db2.gz	SEOOOUFMSNBEMO-UHFFFAOYSA-N	1	0	276.405	4.013	20	30		CIEDRO
CCCC1(C[NH2+][C@@H]2CCc3ccc(C#N)cc32)CCC1	ZINC000574489306	335023409	/nfs/dbraw/zinc/02/34/09/335023409.db2.gz	GXGZJLPROHRQAJ-QGZVFWFLSA-N	1	0	268.404	4.106	20	30		CIEDRO
C[C@H](C[NH2+]CC(C)(C)CCC#N)Sc1ccccc1	ZINC000174608287	261577890	/nfs/dbraw/zinc/57/78/90/261577890.db2.gz	MCWUEODEUQRKKM-CQSZACIVSA-N	1	0	276.449	4.087	20	30		CIEDRO
COc1ccccc1[C@H]1CC[C@H](C)C[N@@H+]1CCCCC#N	ZINC000352246282	533025652	/nfs/dbraw/zinc/02/56/52/533025652.db2.gz	OTJIUIUEOADTMC-DOTOQJQBSA-N	1	0	286.419	4.162	20	30		CIEDRO
CC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCCc2cc(C#N)ccc21	ZINC000520858341	260031531	/nfs/dbraw/zinc/03/15/31/260031531.db2.gz	AEZPZMZVWZQHSA-JLSDUUJJSA-N	1	0	268.404	4.104	20	30		CIEDRO
C[C@@H]([NH2+]C1CCC(C)(C#N)CC1)c1cccc(F)c1F	ZINC000336209787	533337577	/nfs/dbraw/zinc/33/75/77/533337577.db2.gz	BGTJTYRNGVPNAE-OPGSHWCFSA-N	1	0	278.346	4.088	20	30		CIEDRO
Cc1ccsc1C[NH2+][C@H]1CCCc2cc(C#N)ccc21	ZINC000341760376	130027098	/nfs/dbraw/zinc/02/70/98/130027098.db2.gz	KPHGRMJETQJJSQ-INIZCTEOSA-N	1	0	282.412	4.095	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCCc2cc(C#N)ccc21)c1cccc(F)c1	ZINC000341762414	130028393	/nfs/dbraw/zinc/02/83/93/130028393.db2.gz	VLXHYYMQPICYCG-YJYMSZOUSA-N	1	0	294.373	4.426	20	30		CIEDRO
CC1(C)CC[C@H]([NH2+][C@@H]2CCCc3cc(C#N)ccc32)C1	ZINC000341894718	130135815	/nfs/dbraw/zinc/13/58/15/130135815.db2.gz	FIBYJUXFEPWLKK-DOTOQJQBSA-N	1	0	268.404	4.104	20	30		CIEDRO
Cc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000020126167	171009540	/nfs/dbraw/zinc/00/95/40/171009540.db2.gz	AFJNXLVVQQYSLQ-LSDHHAIUSA-N	1	0	264.372	4.279	20	30		CIEDRO
CC[C@@H](Cc1ccccc1)[NH2+][C@@H]1CCc2ccc(C#N)cc21	ZINC000575167889	335074746	/nfs/dbraw/zinc/07/47/46/335074746.db2.gz	XKEHMDCIXMPDAD-AZUAARDMSA-N	1	0	290.410	4.156	20	30		CIEDRO
N#CCCC[C@H]([NH2+]CCc1ccccc1F)c1ccccc1	ZINC000353913752	226817036	/nfs/dbraw/zinc/81/70/36/226817036.db2.gz	JFZKYEUINWYKEP-IBGZPJMESA-N	1	0	296.389	4.393	20	30		CIEDRO
N#CCCC[N@H+]1CCC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000352544073	227050262	/nfs/dbraw/zinc/05/02/62/227050262.db2.gz	NJNQXSZXDXLUNV-CQSZACIVSA-N	1	0	296.336	4.189	20	30		CIEDRO
Cc1ccnc([C@@H]2CC[N@H+](CCC3(C#N)CCCCC3)C2)c1	ZINC000575192981	335078774	/nfs/dbraw/zinc/07/87/74/335078774.db2.gz	UAHGZDRGADCNEB-QGZVFWFLSA-N	1	0	297.446	4.044	20	30		CIEDRO
C[C@@H]1CCCCC[N@@H+]1Cc1cccc(OCCCC#N)c1	ZINC000353494009	228110108	/nfs/dbraw/zinc/11/01/08/228110108.db2.gz	XLWSJJMCGLAEAS-MRXNPFEDSA-N	1	0	286.419	4.134	20	30		CIEDRO
Cc1ccc([C@H]2CCCCN2Cc2nc(C#N)cs2)cc1	ZINC000356108009	228123960	/nfs/dbraw/zinc/12/39/60/228123960.db2.gz	ICMNUDQBJDRUNS-MRXNPFEDSA-N	1	0	297.427	4.050	20	30		CIEDRO
C=C1CC[NH+](CCCOc2cccc3ccccc32)CC1	ZINC000520848125	260022553	/nfs/dbraw/zinc/02/25/53/260022553.db2.gz	IFWFEIJJMUNDHN-UHFFFAOYSA-N	1	0	281.399	4.261	20	30		CIEDRO
CC[C@@H]1CCC[C@H]1[NH2+][C@H]1CCCc2cc(C#N)ccc21	ZINC000520858342	260031346	/nfs/dbraw/zinc/03/13/46/260031346.db2.gz	AEZPZMZVWZQHSA-OLMNPRSZSA-N	1	0	268.404	4.104	20	30		CIEDRO
C=CCCCCC[N@@H+](C)[C@@H](C)c1ccc([S@](C)=O)cc1	ZINC000187694751	260051663	/nfs/dbraw/zinc/05/16/63/260051663.db2.gz	VULRGNSKOZLWAF-YWZLYKJASA-N	1	0	293.476	4.163	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)CCc1ccc(OC(F)F)cc1	ZINC000312468824	260073398	/nfs/dbraw/zinc/07/33/98/260073398.db2.gz	UPWHVDNIVDFVJO-ZDUSSCGKSA-N	1	0	283.362	4.165	20	30		CIEDRO
C=CCC[C@@H]([NH2+][C@H](C)c1nccnc1C)c1ccccc1	ZINC000188251993	260075949	/nfs/dbraw/zinc/07/59/49/260075949.db2.gz	ZROXVAYTRJOMJA-NVXWUHKLSA-N	1	0	281.403	4.143	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1)c1cccc(C#N)c1	ZINC000037318804	260086619	/nfs/dbraw/zinc/08/66/19/260086619.db2.gz	HVOWIRSONZAHIQ-TUKIKUTGSA-N	1	0	296.336	4.330	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]Cc1cccc(C(F)(F)F)c1	ZINC000078052208	260167751	/nfs/dbraw/zinc/16/77/51/260167751.db2.gz	LGCIXNRLIDJHGF-UHFFFAOYSA-N	1	0	284.325	4.125	20	30		CIEDRO
C[C@H](c1ccccc1F)[N@H+](C)CCCC(C)(C)C#N	ZINC000087608711	260215569	/nfs/dbraw/zinc/21/55/69/260215569.db2.gz	JCBIBYCRVGSVHF-CYBMUJFWSA-N	1	0	262.372	4.148	20	30		CIEDRO
CC1(C#N)CCC([NH2+]Cc2ccc(F)c(Cl)c2)CC1	ZINC000449111062	260225569	/nfs/dbraw/zinc/22/55/69/260225569.db2.gz	IPDXQEBSDRFXIC-UHFFFAOYSA-N	1	0	280.774	4.041	20	30		CIEDRO
C=CCCC[NH2+][C@H](C)c1ccccc1Br	ZINC000088162658	260278671	/nfs/dbraw/zinc/27/86/71/260278671.db2.gz	PBNQZDNOEBLFKA-LLVKDONJSA-N	1	0	268.198	4.066	20	30		CIEDRO
CC[N@H+](CCCC#N)[C@H](C)c1cc2ccccc2o1	ZINC000066434229	260245972	/nfs/dbraw/zinc/24/59/72/260245972.db2.gz	BTEIPHWYGBMSRP-CYBMUJFWSA-N	1	0	256.349	4.119	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@@H](Cc2ccccc2)C2CC2)CC1	ZINC000449152021	260259286	/nfs/dbraw/zinc/25/92/86/260259286.db2.gz	CJXHXYCSXUMLCG-XBMUEBEBSA-N	1	0	282.431	4.070	20	30		CIEDRO
N#CCCCC[N@H+](Cc1ccco1)Cc1cccs1	ZINC000072957377	260279571	/nfs/dbraw/zinc/27/95/71/260279571.db2.gz	YXVNJQQRINWMLK-UHFFFAOYSA-N	1	0	274.389	4.037	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@H]1CC[C@H](c2ccccc2)O1)C1CC1	ZINC000517778006	260305134	/nfs/dbraw/zinc/30/51/34/260305134.db2.gz	PSBFSQYKTSFMML-CEXWTWQISA-N	1	0	285.431	4.241	20	30		CIEDRO
C[C@H]1C[C@H](c2ccccc2)[N@H+](Cc2ccc(C#N)s2)C1	ZINC000517782293	260306516	/nfs/dbraw/zinc/30/65/16/260306516.db2.gz	CWVCLFWXWWFRSX-SUMWQHHRSA-N	1	0	282.412	4.203	20	30		CIEDRO
C[C@@H]1C[C@@H](c2ccccc2)[N@H+](Cc2ccc(C#N)s2)C1	ZINC000517782291	260306597	/nfs/dbraw/zinc/30/65/97/260306597.db2.gz	CWVCLFWXWWFRSX-DYVFJYSZSA-N	1	0	282.412	4.203	20	30		CIEDRO
CC[C@H](C)[C@H](C)[N@H+](Cc1cc(C#N)ccc1F)C1CC1	ZINC000517908937	260317391	/nfs/dbraw/zinc/31/73/91/260317391.db2.gz	RPMUCVWPCKNZAW-STQMWFEESA-N	1	0	274.383	4.096	20	30		CIEDRO
C[C@@H]1C[N@H+](CCCCC(C)(C)C#N)[C@@H]1c1ccccc1	ZINC000409446510	260406225	/nfs/dbraw/zinc/40/62/25/260406225.db2.gz	TZOVOCFAEKMFSR-WBVHZDCISA-N	1	0	270.420	4.399	20	30		CIEDRO
CC(C)(C#N)CCCC[N@@H+]1CCc2c(F)cc(F)cc2C1	ZINC000409446885	260409838	/nfs/dbraw/zinc/40/98/38/260409838.db2.gz	BSADZZXDRPQBTB-UHFFFAOYSA-N	1	0	292.373	4.043	20	30		CIEDRO
C[C@H]([NH2+]CC1CCC(F)(F)CC1)c1cccc(C#N)c1	ZINC000409877013	260434775	/nfs/dbraw/zinc/43/47/75/260434775.db2.gz	QULRSFBPTODMKZ-LBPRGKRZSA-N	1	0	278.346	4.034	20	30		CIEDRO
C[C@@H]1CCC[C@H]([NH2+]Cc2cccc(OCCCC#N)c2)C1	ZINC000237356347	260683399	/nfs/dbraw/zinc/68/33/99/260683399.db2.gz	KGENEEQLCZOOTA-WBVHZDCISA-N	1	0	286.419	4.037	20	30		CIEDRO
C=CCC1(C[NH2+]Cc2ncc(Cl)s2)CCCC1	ZINC000449607019	260761387	/nfs/dbraw/zinc/76/13/87/260761387.db2.gz	UYQYZCPSYHXPLB-UHFFFAOYSA-N	1	0	270.829	4.023	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H]1CCCc2sccc21	ZINC000157909923	260868929	/nfs/dbraw/zinc/86/89/29/260868929.db2.gz	HXSUOUUNDHQAAN-ZDUSSCGKSA-N	1	0	262.422	4.045	20	30		CIEDRO
C=CC1CC[NH+](C[C@@H](OC(C)C)c2ccccc2)CC1	ZINC000428213719	260869734	/nfs/dbraw/zinc/86/97/34/260869734.db2.gz	VNTSXSVZIADONG-GOSISDBHSA-N	1	0	273.420	4.051	20	30		CIEDRO
C=CC1CC[NH+](C[C@H](OC(C)C)c2ccccc2)CC1	ZINC000428213720	260869885	/nfs/dbraw/zinc/86/98/85/260869885.db2.gz	VNTSXSVZIADONG-SFHVURJKSA-N	1	0	273.420	4.051	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)c1ccccc1F	ZINC000168767007	260910177	/nfs/dbraw/zinc/91/01/77/260910177.db2.gz	DGCSALJUMPNWBU-SCLBCKFNSA-N	1	0	282.362	4.499	20	30		CIEDRO
C[C@H]([NH2+]CCc1ccc(Cl)s1)c1ccc(C#N)cc1	ZINC000173934885	261174312	/nfs/dbraw/zinc/17/43/12/261174312.db2.gz	IGHRRUKSFZOAMD-NSHDSACASA-N	1	0	290.819	4.166	20	30		CIEDRO
C[N@H+](Cc1cccc(Cl)c1)CC(C)(C)CCC#N	ZINC000161137295	261238465	/nfs/dbraw/zinc/23/84/65/261238465.db2.gz	HVBLSAZVOJKJPD-UHFFFAOYSA-N	1	0	264.800	4.102	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1cnc(-c2ccsc2)s1	ZINC000466387433	261399238	/nfs/dbraw/zinc/39/92/38/261399238.db2.gz	JVVSBBXESHJYDG-LBPRGKRZSA-N	1	0	278.446	4.316	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccccc1C#N)c1ccc(C)cc1	ZINC000182272186	261439385	/nfs/dbraw/zinc/43/93/85/261439385.db2.gz	RIDXYZFLITUYQC-GOSISDBHSA-N	1	0	264.372	4.108	20	30		CIEDRO
CCc1nc(C)c([C@@H](C)[N@H+](C)CCCC(C)(C)C#N)s1	ZINC000174873229	261587336	/nfs/dbraw/zinc/58/73/36/261587336.db2.gz	JSNMJFCMCFCMMP-CYBMUJFWSA-N	1	0	293.480	4.337	20	30		CIEDRO
COc1ccc([C@H]([NH2+]Cc2ccccc2C#N)C(C)C)cc1	ZINC000180808041	261874845	/nfs/dbraw/zinc/87/48/45/261874845.db2.gz	YBWOFWKDWRBLQL-LJQANCHMSA-N	1	0	294.398	4.054	20	30		CIEDRO
N#Cc1ccc(C[N@H+]2CCC[C@@H](c3ccc(F)cc3)CC2)o1	ZINC000497160467	261973483	/nfs/dbraw/zinc/97/34/83/261973483.db2.gz	JRESFELPXIHQLU-CQSZACIVSA-N	1	0	298.361	4.060	20	30		CIEDRO
C[C@H](c1ccccc1C(F)(F)F)[C@H](C)[NH2+]CCCC#N	ZINC000184088477	262008075	/nfs/dbraw/zinc/00/80/75/262008075.db2.gz	CYXXZFLEBVMJGL-RYUDHWBXSA-N	1	0	284.325	4.091	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+][C@H]2CCSc3c(F)cccc32)C1	ZINC000185771861	262069505	/nfs/dbraw/zinc/06/95/05/262069505.db2.gz	NUEPCBPISCEVFQ-HUBLWGQQSA-N	1	0	290.407	4.035	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]C[C@H](c1ccccc1)C(F)(F)F	ZINC000186438646	262093605	/nfs/dbraw/zinc/09/36/05/262093605.db2.gz	KKDZIHZOXCRWPU-CQSZACIVSA-N	1	0	298.352	4.252	20	30		CIEDRO
CC(C)(CC1CCCCCC1)[NH2+]CCCCC#N	ZINC000190027009	262178731	/nfs/dbraw/zinc/17/87/31/262178731.db2.gz	GYXGBIKGNKFGLV-UHFFFAOYSA-N	1	0	250.430	4.409	20	30		CIEDRO
C=CCCC[NH2+]C[C@H](C)c1cccc(Br)c1	ZINC000390352200	262183389	/nfs/dbraw/zinc/18/33/89/262183389.db2.gz	PQAUQLCDYDLHNC-LBPRGKRZSA-N	1	0	282.225	4.108	20	30		CIEDRO
CC(C)[C@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1ccc(F)cc1	ZINC000503928436	262186881	/nfs/dbraw/zinc/18/68/81/262186881.db2.gz	SUIDJSYPUGFGFD-JQFCIGGWSA-N	1	0	274.383	4.195	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@@H](C)c1cc2cccc(OC)c2o1	ZINC000393805902	262190906	/nfs/dbraw/zinc/19/09/06/262190906.db2.gz	WOUSRBZBHXAXJT-JSGCOSHPSA-N	1	0	273.376	4.447	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+][C@H]2CCSc3ccc(F)cc32)C1	ZINC000192750313	262210317	/nfs/dbraw/zinc/21/03/17/262210317.db2.gz	YBXFQYCPZGEAJS-LNSITVRQSA-N	1	0	290.407	4.035	20	30		CIEDRO
Cc1ccc(C[NH+]2CCCC2)cc1N[C@H]1CCC[C@H](C#N)C1	ZINC000193268930	262219372	/nfs/dbraw/zinc/21/93/72/262219372.db2.gz	NMKQUSICQOLLBV-WMZOPIPTSA-N	1	0	297.446	4.085	20	30		CIEDRO
Cc1ccc(C[NH+]2CCCC2)cc1N[C@@H]1CCC[C@H](C#N)C1	ZINC000193268914	262219676	/nfs/dbraw/zinc/21/96/76/262219676.db2.gz	NMKQUSICQOLLBV-FUHWJXTLSA-N	1	0	297.446	4.085	20	30		CIEDRO
Cc1cc2c(cc1C)[C@H]([N@H+](CCCCC#N)C1CC1)CCO2	ZINC000364827700	262261711	/nfs/dbraw/zinc/26/17/11/262261711.db2.gz	WYQGSIGYYXBFBP-GOSISDBHSA-N	1	0	298.430	4.285	20	30		CIEDRO
Cc1c2ccccc2oc1[C@@H](C)[NH2+][C@H]1CCC[C@H](C#N)C1	ZINC000185796734	262308584	/nfs/dbraw/zinc/30/85/84/262308584.db2.gz	AXCBWUMFDAFDIR-ILXRZTDVSA-N	1	0	282.387	4.474	20	30		CIEDRO
CC(C)(C#N)CCCC[N@@H+]1CCC[C@@H]1c1ccco1	ZINC000365441335	262365668	/nfs/dbraw/zinc/36/56/68/262365668.db2.gz	GDDJOCVDEOJONK-CQSZACIVSA-N	1	0	260.381	4.137	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)CCc1ccccc1)c1ccc(C#N)cc1	ZINC000021013437	262373764	/nfs/dbraw/zinc/37/37/64/262373764.db2.gz	RSOOXBHDWNHRAE-JKSUJKDBSA-N	1	0	278.399	4.230	20	30		CIEDRO
Cc1ccc(C(C)(C)[NH2+]CCC2(C#N)CCCCC2)cn1	ZINC000411532031	262697708	/nfs/dbraw/zinc/69/77/08/262697708.db2.gz	XFNKSCWFONPHJS-UHFFFAOYSA-N	1	0	285.435	4.079	20	30		CIEDRO
C=CCC[C@@H]([NH2+][C@H](C)c1cc2n(n1)CCC2)c1ccccc1	ZINC000414084098	262802615	/nfs/dbraw/zinc/80/26/15/262802615.db2.gz	DYYIHGHNUOTNLJ-CRAIPNDOSA-N	1	0	295.430	4.187	20	30		CIEDRO
CC[C@H]([NH2+][C@H](CCC#N)c1ccccc1)[C@H]1C[C@@H]1C	ZINC000414099028	262804444	/nfs/dbraw/zinc/80/44/44/262804444.db2.gz	KIQODIAPJWKAMS-QSPRXWTASA-N	1	0	256.393	4.056	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@H]1C[C@H](c2cccc(F)c2)C1)C1CC1	ZINC000436303042	262847017	/nfs/dbraw/zinc/84/70/17/262847017.db2.gz	CCYXMKFJOFPAJF-SZMVWBNQSA-N	1	0	273.395	4.406	20	30		CIEDRO
CC(C)Oc1ccc([C@@H](C)[NH2+]CCC(C)(C)C#N)cc1	ZINC000271993000	263001279	/nfs/dbraw/zinc/00/12/79/263001279.db2.gz	FHKIHUQECJKRQS-CQSZACIVSA-N	1	0	274.408	4.064	20	30		CIEDRO
CCC(CC)CN(CCC#N)Cc1cnc(C(C)C)s1	ZINC000353407176	263002776	/nfs/dbraw/zinc/00/27/76/263002776.db2.gz	WIXLNHDKIRCEDJ-UHFFFAOYSA-N	1	0	293.480	4.418	20	30		CIEDRO
CC1(C#N)CC[NH+](Cc2ccc(Cl)c3cccnc23)CC1	ZINC000272536034	263005899	/nfs/dbraw/zinc/00/58/99/263005899.db2.gz	JCVQRHBXZIPFPB-UHFFFAOYSA-N	1	0	299.805	4.014	20	30		CIEDRO
CC[C@H]([NH2+]CCC(C)(C)C#N)c1ccc(Cl)s1	ZINC000273478956	263017093	/nfs/dbraw/zinc/01/70/93/263017093.db2.gz	HRHIYJYJNJEUTM-JTQLQIEISA-N	1	0	270.829	4.382	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@H](C#N)C1)c1nc(-c2ccccc2)cs1	ZINC000274603164	263027400	/nfs/dbraw/zinc/02/74/00/263027400.db2.gz	IIQYMKPKTYLEIZ-YDHLFZDLSA-N	1	0	297.427	4.153	20	30		CIEDRO
Cc1[nH]c2ccccc2c1C1CC[NH+]([C@@H](C)CCC#N)CC1	ZINC000276305924	263036093	/nfs/dbraw/zinc/03/60/93/263036093.db2.gz	KYZIYNAKKORBGU-AWEZNQCLSA-N	1	0	295.430	4.348	20	30		CIEDRO
CC(C)(C#N)CCCC[N@@H+]1CCCC[C@@H]1c1nccs1	ZINC000277838054	263043743	/nfs/dbraw/zinc/04/37/43/263043743.db2.gz	WQIFZBGUUBUKNE-CQSZACIVSA-N	1	0	291.464	4.390	20	30		CIEDRO
C[C@@H](c1cccc(O)c1)[N@H+](C)CCCCC(C)(C)C#N	ZINC000277842978	263044103	/nfs/dbraw/zinc/04/41/03/263044103.db2.gz	WZKOKNCGMAUFDS-AWEZNQCLSA-N	1	0	274.408	4.105	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+]Cc2cc3ccccc3s2)C1	ZINC000278326089	263047137	/nfs/dbraw/zinc/04/71/37/263047137.db2.gz	VQFUOHUKHMXIEO-JSGCOSHPSA-N	1	0	270.401	4.073	20	30		CIEDRO
CC[C@@H]1C[N@@H+]([C@@H]2CC[C@@H](C#N)C2)CC[C@@H]1c1ccccc1	ZINC000278737093	263050384	/nfs/dbraw/zinc/05/03/84/263050384.db2.gz	WGCZFGVOBAFBCA-RWQQGDIJSA-N	1	0	282.431	4.194	20	30		CIEDRO
CC[C@@H]1C[N@@H+]([C@@H]2CC[C@@H](C#N)C2)CC[C@H]1c1ccccc1	ZINC000278737083	263050459	/nfs/dbraw/zinc/05/04/59/263050459.db2.gz	WGCZFGVOBAFBCA-PSBWJHGTSA-N	1	0	282.431	4.194	20	30		CIEDRO
CC(C)[C@H]1C[C@H]([NH2+]CCCCC#N)c2ccccc21	ZINC000278875564	263051502	/nfs/dbraw/zinc/05/15/02/263051502.db2.gz	XJYZLJXZCZIVHC-SJORKVTESA-N	1	0	256.393	4.154	20	30		CIEDRO
CC(C)[C@@H]1C[C@@H]([NH2+]CCCCC#N)c2ccccc21	ZINC000278875558	263051637	/nfs/dbraw/zinc/05/16/37/263051637.db2.gz	XJYZLJXZCZIVHC-DLBZAZTESA-N	1	0	256.393	4.154	20	30		CIEDRO
CSc1ccccc1C[N@H+](C)CCCC(C)(C)C#N	ZINC000280516042	263062480	/nfs/dbraw/zinc/06/24/80/263062480.db2.gz	ROYLYMVTOHXPSY-UHFFFAOYSA-N	1	0	276.449	4.170	20	30		CIEDRO
C[C@@H]([NH2+]CCCCC#N)[C@H](C)c1ccc(Cl)cc1	ZINC000280960960	263065306	/nfs/dbraw/zinc/06/53/06/263065306.db2.gz	SJIZDGNGKYNHIA-QWHCGFSZSA-N	1	0	264.800	4.115	20	30		CIEDRO
CSc1ccc([C@H](C)[NH2+][C@H]2CCC[C@@H](C#N)C2)cc1	ZINC000281824116	263072236	/nfs/dbraw/zinc/07/22/36/263072236.db2.gz	ZVMUYWLAAFEKCO-GUTXKFCHSA-N	1	0	274.433	4.141	20	30		CIEDRO
N#CCC[C@H]([NH2+]C1CCC(C(F)F)CC1)c1ccccc1	ZINC000282267405	263075613	/nfs/dbraw/zinc/07/56/13/263075613.db2.gz	KIFUJRHHDDSTKP-GPANFISMSA-N	1	0	292.373	4.445	20	30		CIEDRO
Cc1ccc2c(c1)OCCC[C@@H]2[NH2+]CC1CCC(C#N)CC1	ZINC000282290652	263075715	/nfs/dbraw/zinc/07/57/15/263075715.db2.gz	LQAGWWNNSYDLRJ-HTWSVDAQSA-N	1	0	298.430	4.128	20	30		CIEDRO
CC[C@@H]([NH2+]CC1CCC(C#N)CC1)c1ccc(C)cc1O	ZINC000282325174	263075902	/nfs/dbraw/zinc/07/59/02/263075902.db2.gz	NTWXFPDEHMIMIC-VMBOVVBDSA-N	1	0	286.419	4.071	20	30		CIEDRO
C[C@@H]([NH2+]CC1CCC(C#N)CC1)c1ccccc1Cl	ZINC000282478519	263077085	/nfs/dbraw/zinc/07/70/85/263077085.db2.gz	SKWQOCSIJFUNAV-IYXRBSQSSA-N	1	0	276.811	4.321	20	30		CIEDRO
C[C@@H]([NH2+]CC1CCC(C#N)CC1)[C@@H]1C[C@H]1c1ccccc1	ZINC000283509174	263083151	/nfs/dbraw/zinc/08/31/51/263083151.db2.gz	ZIAIVJDIGQZOIM-JSWOOFFYSA-N	1	0	282.431	4.098	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CC1CCC(C#N)CC1)c1ccco1	ZINC000287447739	263102006	/nfs/dbraw/zinc/10/20/06/263102006.db2.gz	LFZNPEYKRMVMFZ-UYSNPLJNSA-N	1	0	272.392	4.206	20	30		CIEDRO
CCCCCCC[C@@H](C)[NH2+]Cc1nccc(C(F)F)n1	ZINC000290286773	263115982	/nfs/dbraw/zinc/11/59/82/263115982.db2.gz	ZRGCFOFJORHSSY-GFCCVEGCSA-N	1	0	285.382	4.253	20	30		CIEDRO
C[C@@H]1C[C@H]([NH2+]CC2CCC(C#N)CC2)c2ccccc21	ZINC000290341107	263116092	/nfs/dbraw/zinc/11/60/92/263116092.db2.gz	PKNPDSFPMMVSON-RMYJWEKJSA-N	1	0	268.404	4.154	20	30		CIEDRO
C[C@@H]([NH2+]CC1(CC#N)CC1)c1ccc(F)c2ccccc21	ZINC000340376845	263121268	/nfs/dbraw/zinc/12/12/68/263121268.db2.gz	PXNZRFZZYZESGB-CYBMUJFWSA-N	1	0	282.362	4.323	20	30		CIEDRO
C[C@]1(CCc2ccccc2)CC[N@@H+]([C@@H]2CC[C@H](C#N)C2)C1	ZINC000292914700	263136331	/nfs/dbraw/zinc/13/63/31/263136331.db2.gz	XKZAKKHPEKCESI-OTWHNJEPSA-N	1	0	282.431	4.023	20	30		CIEDRO
C[C@]1(CCc2ccccc2)CC[N@@H+]([C@H]2CC[C@@H](C#N)C2)C1	ZINC000292914713	263136403	/nfs/dbraw/zinc/13/64/03/263136403.db2.gz	XKZAKKHPEKCESI-QYZOEREBSA-N	1	0	282.431	4.023	20	30		CIEDRO
C[C@H]([NH2+][C@@H](CCCC#N)c1ccccc1)[C@@H]1CC1(C)C	ZINC000340439022	263148047	/nfs/dbraw/zinc/14/80/47/263148047.db2.gz	BGCQBSZIUNOBIZ-XIRDDKMYSA-N	1	0	270.420	4.446	20	30		CIEDRO
CCc1ccc([C@@H]2CCC[N@@H+]([C@@H]3CC[C@@H](C#N)C3)C2)cc1	ZINC000293735461	263148091	/nfs/dbraw/zinc/14/80/91/263148091.db2.gz	ZQWBDOVUTGCEMN-BHIYHBOVSA-N	1	0	282.431	4.121	20	30		CIEDRO
CCc1ccc(C2=CC[N@@H+]([C@@H]3CC[C@H](C#N)C3)CC2)cc1	ZINC000293908235	263152114	/nfs/dbraw/zinc/15/21/14/263152114.db2.gz	WRVKCWHUYHIIBW-QFBILLFUSA-N	1	0	280.415	4.030	20	30		CIEDRO
N#CCCC[C@H]([NH2+][C@@H]1CCC12CCC2)c1ccccc1	ZINC000340448755	263153603	/nfs/dbraw/zinc/15/36/03/263153603.db2.gz	KCMMRMOOZZBDDY-DLBZAZTESA-N	1	0	268.404	4.344	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+][C@@H](CCCC#N)c1ccccc1	ZINC000340447918	263154199	/nfs/dbraw/zinc/15/41/99/263154199.db2.gz	HQLVCMFNHHIILX-WBVHZDCISA-N	1	0	256.393	4.366	20	30		CIEDRO
CC1(C)CC([NH2+][C@@H](CCCC#N)c2ccccc2)C1	ZINC000340448003	263154235	/nfs/dbraw/zinc/15/42/35/263154235.db2.gz	QOKXQOSQPKQSSC-INIZCTEOSA-N	1	0	256.393	4.200	20	30		CIEDRO
C[C@@H](CC1CC1)[NH2+][C@H](CCCC#N)c1ccccc1	ZINC000340447921	263154280	/nfs/dbraw/zinc/15/42/80/263154280.db2.gz	HQYVTCYGKLTFIV-WMLDXEAASA-N	1	0	256.393	4.200	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](CCCC#N)c1ccccc1)c1ccncc1	ZINC000340451659	263156012	/nfs/dbraw/zinc/15/60/12/263156012.db2.gz	OPZWSMDKUIFMQW-QAPCUYQASA-N	1	0	279.387	4.167	20	30		CIEDRO
N#C[C@H]1CC[C@H]([N@@H+]2CC=C(c3cccc(Cl)c3)CC2)C1	ZINC000294257612	263158463	/nfs/dbraw/zinc/15/84/63/263158463.db2.gz	UUMMEJPRDSBLSC-GUYCJALGSA-N	1	0	286.806	4.121	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+]Cc2cccc(OC3CCCC3)c2)C1	ZINC000294957295	263169816	/nfs/dbraw/zinc/16/98/16/263169816.db2.gz	DMJWSIMIUZWOOC-RDJZCZTQSA-N	1	0	298.430	4.180	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2)C1	ZINC000295005597	263170817	/nfs/dbraw/zinc/17/08/17/263170817.db2.gz	IZCJTPLYJVJSTD-ZSYWTGECSA-N	1	0	282.431	4.070	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+]C2CC(c3ccc(Cl)cc3)C2)C1	ZINC000295015506	263170870	/nfs/dbraw/zinc/17/08/70/263170870.db2.gz	JYNRDFRWUWHCAE-OKKATSDQSA-N	1	0	288.822	4.258	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@@H]2CCCC[C@H]2c2ccccc2)C1	ZINC000295008392	263170886	/nfs/dbraw/zinc/17/08/86/263170886.db2.gz	JEWPDUTYYKAVHO-DSLXNQLJSA-N	1	0	282.431	4.385	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+]Cc2ccccc2OC2CCCC2)C1	ZINC000295080890	263172053	/nfs/dbraw/zinc/17/20/53/263172053.db2.gz	QIJQLITYVKPDMM-RDJZCZTQSA-N	1	0	298.430	4.180	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+]Cc2ccc(-c3ccc(F)cc3)o2)C1	ZINC000295094340	263172381	/nfs/dbraw/zinc/17/23/81/263172381.db2.gz	RWKGFAISHRLIBZ-BBRMVZONSA-N	1	0	298.361	4.258	20	30		CIEDRO
C[C@@H]1CC[C@@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)c2ccccc21	ZINC000296425208	263191422	/nfs/dbraw/zinc/19/14/22/263191422.db2.gz	LPCVTNUMXMBQBL-LDDOYCOJSA-N	1	0	268.404	4.297	20	30		CIEDRO
N#CCCCC[NH2+][C@H]1CCc2cc(Cl)cc(Cl)c21	ZINC000340584538	263211427	/nfs/dbraw/zinc/21/14/27/263211427.db2.gz	QKSIIPJFVMYXEC-ZDUSSCGKSA-N	1	0	283.202	4.264	20	30		CIEDRO
C[C@H](CCC#N)[NH+]1CCC(c2c[nH]c3ccc(F)cc32)CC1	ZINC000298574549	263222635	/nfs/dbraw/zinc/22/26/35/263222635.db2.gz	QPCJCQXVDRAAHH-CYBMUJFWSA-N	1	0	299.393	4.179	20	30		CIEDRO
COc1ccc2oc([C@@H](C)[NH2+][C@@H](C)CCC#N)c(C)c2c1	ZINC000299154986	263232876	/nfs/dbraw/zinc/23/28/76/263232876.db2.gz	XCWJMBRZRNCAKL-WCQYABFASA-N	1	0	286.375	4.093	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H](C)CCC#N)c1cccc(Cl)c1	ZINC000299701519	263252961	/nfs/dbraw/zinc/25/29/61/263252961.db2.gz	PAQDFXMRKOFOJC-SMDDNHRTSA-N	1	0	250.773	4.073	20	30		CIEDRO
C[C@H](CCC#N)[NH2+][C@H](C)c1cccc(C(F)(F)F)c1	ZINC000299733974	263254468	/nfs/dbraw/zinc/25/44/68/263254468.db2.gz	ZEJXPOCOPQTJOX-GHMZBOCLSA-N	1	0	270.298	4.048	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCc1ccccc1OC(F)F)C1CC1	ZINC000471764431	263262709	/nfs/dbraw/zinc/26/27/09/263262709.db2.gz	XPNZUGVGEVQHCI-OAHLLOKOSA-N	1	0	295.373	4.165	20	30		CIEDRO
CC(C)[C@H]([NH2+]CCCC#N)c1cc2ccccc2o1	ZINC000341865562	263356978	/nfs/dbraw/zinc/35/69/78/263356978.db2.gz	HEPZKKMBUIJJRD-INIZCTEOSA-N	1	0	256.349	4.023	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCc1csc(C)n1)c1ccccc1	ZINC000341933340	263367513	/nfs/dbraw/zinc/36/75/13/263367513.db2.gz	SUNRHTSDOQFKDR-QGZVFWFLSA-N	1	0	286.444	4.291	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCF)c1ccc(C(F)(F)F)cc1	ZINC000342196872	263398928	/nfs/dbraw/zinc/39/89/28/263398928.db2.gz	DWPYJEULTYEGAK-ZDUSSCGKSA-N	1	0	275.289	4.272	20	30		CIEDRO
C[C@H]([NH2+][C@@H](C)[C@@H]1C[C@H]1c1cccs1)c1ccc(C#N)cc1	ZINC000417348852	263798178	/nfs/dbraw/zinc/79/81/78/263798178.db2.gz	ZJGFCNDRBBRROO-MGBSGCIJSA-N	1	0	296.439	4.463	20	30		CIEDRO
CCC[C@@]1(C)CCC[N@@H+]([C@@H](C(N)=O)c2ccc(C#N)cc2)C1	ZINC000330926980	264095370	/nfs/dbraw/zinc/09/53/70/264095370.db2.gz	JQECKKCFEQSLRS-AEFFLSMTSA-N	1	0	299.418	4.037	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+]CC2CCC(c3ccccc3)CC2)C1	ZINC000425353101	264124928	/nfs/dbraw/zinc/12/49/28/264124928.db2.gz	LDHGDNWSRAKRHI-KXWSQRDISA-N	1	0	282.431	4.242	20	30		CIEDRO
C=CCOc1ccccc1C[N@H+]1CC[C@H](C(F)(F)F)[C@H]1C	ZINC000475286765	264294453	/nfs/dbraw/zinc/29/44/53/264294453.db2.gz	LVCUNNLPACHFND-OCCSQVGLSA-N	1	0	299.336	4.024	20	30		CIEDRO
N#Cc1csc(C[NH+]2CCC(c3ccsc3)CC2)c1	ZINC000188694020	264331961	/nfs/dbraw/zinc/33/19/61/264331961.db2.gz	XOOSRPDHUPVVOE-UHFFFAOYSA-N	1	0	288.441	4.061	20	30		CIEDRO
C[C@H](c1ccccc1)[N@H+](CC1(C#N)CC1)C1CCCC1	ZINC000425460603	264332827	/nfs/dbraw/zinc/33/28/27/264332827.db2.gz	SEZFXSQZYXBRPA-OAHLLOKOSA-N	1	0	268.404	4.296	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@H]2C[C@H](c3ccc(Cl)cc3)C2)C1	ZINC000475672884	264335405	/nfs/dbraw/zinc/33/54/05/264335405.db2.gz	PENWCTZVERFIMV-QIJZBDPFSA-N	1	0	288.822	4.258	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+][C@@H](C)c1nc(Cc2ccccc2)no1	ZINC000191593886	264517137	/nfs/dbraw/zinc/51/71/37/264517137.db2.gz	MAHFHSYGZIGDDU-GOEBONIOSA-N	1	0	299.418	4.056	20	30		CIEDRO
C#CC[C@H]([NH2+][C@@H]1CCCc2c(O)cccc21)c1ccccc1	ZINC000285081742	264547689	/nfs/dbraw/zinc/54/76/89/264547689.db2.gz	JNMXHZRKPKIFOL-RBUKOAKNSA-N	1	0	291.394	4.124	20	30		CIEDRO
C[C@H](c1ccccc1)[N@H+](CCCC#N)C1CCCC1	ZINC000347708102	265136551	/nfs/dbraw/zinc/13/65/51/265136551.db2.gz	QXLHYLFWLZZVKG-OAHLLOKOSA-N	1	0	256.393	4.296	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1cc(C#N)cs1)c1ccc(C)cc1	ZINC000093492102	265181601	/nfs/dbraw/zinc/18/16/01/265181601.db2.gz	XTFGIGXYHBIGGH-MRXNPFEDSA-N	1	0	270.401	4.169	20	30		CIEDRO
C[C@@H]([NH2+]Cc1cc(C#N)cs1)c1cc2ccccc2o1	ZINC000093492161	265181665	/nfs/dbraw/zinc/18/16/65/265181665.db2.gz	MFYBUMBOMHIYJS-LLVKDONJSA-N	1	0	282.368	4.217	20	30		CIEDRO
Cc1cc([C@@H](C)[NH2+]Cc2cc(C#N)cs2)c(C)s1	ZINC000093492249	265181955	/nfs/dbraw/zinc/18/19/55/265181955.db2.gz	GGSMJASXQFSCJB-SNVBAGLBSA-N	1	0	276.430	4.149	20	30		CIEDRO
CCC[C@H]([NH2+]Cc1cc(C#N)cs1)c1ccccc1	ZINC000093492146	265182043	/nfs/dbraw/zinc/18/20/43/265182043.db2.gz	VGOLXXIISCDWDF-INIZCTEOSA-N	1	0	270.401	4.251	20	30		CIEDRO
CC(C)[C@H]([NH2+]Cc1cc(C#N)cs1)c1ccc(F)cc1	ZINC000093492199	265182134	/nfs/dbraw/zinc/18/21/34/265182134.db2.gz	PMTAXZCIBTTXIP-INIZCTEOSA-N	1	0	288.391	4.246	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCCCC1(C)C)c1cccc(C#N)c1	ZINC000094323285	265236535	/nfs/dbraw/zinc/23/65/35/265236535.db2.gz	VPPPZJUZRDVAOK-XJKSGUPXSA-N	1	0	256.393	4.178	20	30		CIEDRO
C[C@@H]([NH2+]Cc1cccc(C2CC2)c1)c1ccc(C#N)cc1	ZINC000094518596	265247162	/nfs/dbraw/zinc/24/71/62/265247162.db2.gz	CYGKZLDJTKQGSQ-CQSZACIVSA-N	1	0	276.383	4.286	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@H](C)[C@@H]1CCCOC1)c1ccccc1	ZINC000356854187	266190783	/nfs/dbraw/zinc/19/07/83/266190783.db2.gz	TYHNGCFAEZCOTK-NXHRZFHOSA-N	1	0	273.420	4.099	20	30		CIEDRO
C=CCC[C@H]([NH2+]CC[C@H]1CCCCO1)c1ccccc1	ZINC000356931506	266212992	/nfs/dbraw/zinc/21/29/92/266212992.db2.gz	WWXLJBWRUYIHDC-MSOLQXFVSA-N	1	0	273.420	4.243	20	30		CIEDRO
CC(C)[C@@H](C)[N@@H+]1Cc2cccc(NCCC(C)(C)C#N)c2C1	ZINC000367293833	266404222	/nfs/dbraw/zinc/40/42/22/266404222.db2.gz	FWBZDDFOULOLOQ-OAHLLOKOSA-N	1	0	299.462	4.398	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCCc2ccccc21)c1ccc(C#N)cc1F	ZINC000358559091	266476752	/nfs/dbraw/zinc/47/67/52/266476752.db2.gz	OMCUKAGHCKQGFV-ORAYPTAESA-N	1	0	294.373	4.426	20	30		CIEDRO
N#Cc1ccc2c(c1)CCCC[C@@H]2[NH2+]Cc1ccccc1	ZINC000360840924	266746993	/nfs/dbraw/zinc/74/69/93/266746993.db2.gz	PQYXIUNDVALWOG-IBGZPJMESA-N	1	0	276.383	4.116	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1CCC[C@H]1c1ccccc1	ZINC000367898255	267125811	/nfs/dbraw/zinc/12/58/11/267125811.db2.gz	FDNBNIJCMRDFLQ-DLBZAZTESA-N	1	0	270.420	4.242	20	30		CIEDRO
N#CCC[C@H]([NH2+]C1CCC2(CCCO2)CC1)c1ccccc1	ZINC000370014863	267284225	/nfs/dbraw/zinc/28/42/25/267284225.db2.gz	ZZJBEECQFRHIGG-XBMUEBEBSA-N	1	0	298.430	4.113	20	30		CIEDRO
N#CCCCC[NH2+][C@H]1CCC[C@H]1c1ccc(Cl)cc1	ZINC000370644960	267333770	/nfs/dbraw/zinc/33/37/70/267333770.db2.gz	SDCILAHAAPESKD-HOTGVXAUSA-N	1	0	276.811	4.260	20	30		CIEDRO
CC(C)(C#N)CC[N@@H+]1CCCC[C@@H]1c1nc2ccccc2o1	ZINC000371206085	267370291	/nfs/dbraw/zinc/37/02/91/267370291.db2.gz	DAJDQNVNQOCWBQ-OAHLLOKOSA-N	1	0	297.402	4.295	20	30		CIEDRO
CCC[C@H]([NH2+]Cc1ccc(C#N)cc1F)c1ccccc1	ZINC000120132380	267384638	/nfs/dbraw/zinc/38/46/38/267384638.db2.gz	LAIBTJFJDFFGPO-SFHVURJKSA-N	1	0	282.362	4.328	20	30		CIEDRO
N#Cc1cccc(C[N@@H+]2CCCCC[C@@H]2c2ccncc2)c1	ZINC000120168294	267388331	/nfs/dbraw/zinc/38/83/31/267388331.db2.gz	MCJMHMQRNILEHM-LJQANCHMSA-N	1	0	291.398	4.071	20	30		CIEDRO
C[C@@H]1C[C@H](c2ccsc2)C[N@@H+]1CC(C)(C)CCC#N	ZINC000371399068	267399123	/nfs/dbraw/zinc/39/91/23/267399123.db2.gz	WGTBRELNEZVXQS-HIFRSBDPSA-N	1	0	276.449	4.256	20	30		CIEDRO
C[C@@H]1C[C@@H](c2ccsc2)C[N@@H+]1CC(C)(C)CCC#N	ZINC000371399069	267399183	/nfs/dbraw/zinc/39/91/83/267399183.db2.gz	WGTBRELNEZVXQS-UKRRQHHQSA-N	1	0	276.449	4.256	20	30		CIEDRO
N#Cc1ccccc1C[NH2+][C@H](c1ccccc1)C1CCC1	ZINC000170919847	327675703	/nfs/dbraw/zinc/67/57/03/327675703.db2.gz	SNTDPXTUJWSETI-LJQANCHMSA-N	1	0	276.383	4.189	20	30		CIEDRO
N#Cc1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[C@H]3CCC[C@@H]3C1)CC2	ZINC000580261967	327750848	/nfs/dbraw/zinc/75/08/48/327750848.db2.gz	BQDQFRIVUXPRMV-KLICCBINSA-N	1	0	280.415	4.104	20	30		CIEDRO
C[C@@H]([NH2+]CCCCC#N)c1ccc(SC(F)F)cc1	ZINC000178649071	327795302	/nfs/dbraw/zinc/79/53/02/327795302.db2.gz	SRKPAWOBPFOGPX-LLVKDONJSA-N	1	0	284.375	4.346	20	30		CIEDRO
C[C@H]1C[C@@H]([NH2+]CCCCC#N)C[C@H](c2ccccc2)C1	ZINC000178650128	327795574	/nfs/dbraw/zinc/79/55/74/327795574.db2.gz	OBYNVGFHOGKIQC-KBAYOESNSA-N	1	0	270.420	4.242	20	30		CIEDRO
N#Cc1cccc(C[NH2+]C[C@H]2CCC[C@H](C(F)(F)F)C2)c1	ZINC000531212899	327893570	/nfs/dbraw/zinc/89/35/70/327893570.db2.gz	BGVAWRRICHXGTE-GJZGRUSLSA-N	1	0	296.336	4.017	20	30		CIEDRO
CCC[C@@H]1CCCC[C@H]1[NH2+]CCCC1(C#N)CCOCC1	ZINC000531444705	327908150	/nfs/dbraw/zinc/90/81/50/327908150.db2.gz	OHGDHELXVCPYBO-IAGOWNOFSA-N	1	0	292.467	4.035	20	30		CIEDRO
C=C(CC)C[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000313488131	327921783	/nfs/dbraw/zinc/92/17/83/327921783.db2.gz	PQINJIPXMGQPFT-NSHDSACASA-N	1	0	257.299	4.322	20	30		CIEDRO
C=CC[NH2+][C@H](c1c(Cl)cccc1Cl)C1CC1	ZINC000390782147	327926810	/nfs/dbraw/zinc/92/68/10/327926810.db2.gz	KXPHNTBVHCFIFV-ZDUSSCGKSA-N	1	0	256.176	4.220	20	30		CIEDRO
CC[C@@H](C[NH+]1CCC(CCC#N)CC1)c1ccccc1	ZINC000563158200	327933464	/nfs/dbraw/zinc/93/34/64/327933464.db2.gz	NTIHIGASCOKREA-KRWDZBQOSA-N	1	0	270.420	4.196	20	30		CIEDRO
C=CC[C@@H](C)[NH2+]Cc1cc(Br)ccc1Cl	ZINC000124289441	327981963	/nfs/dbraw/zinc/98/19/63/327981963.db2.gz	OITCLRZUXVODIY-SECBINFHSA-N	1	0	288.616	4.157	20	30		CIEDRO
CC(C)Oc1ccc(C[NH2+][C@@H](C)c2ccc(C#N)cc2)cc1	ZINC000124609434	327988171	/nfs/dbraw/zinc/98/81/71/327988171.db2.gz	NDJOYTKESIRMHC-HNNXBMFYSA-N	1	0	294.398	4.196	20	30		CIEDRO
CC(C)CC1(C)CC[NH+](CC(C)(C)CCC#N)CC1	ZINC000563275130	328006291	/nfs/dbraw/zinc/00/62/91/328006291.db2.gz	GYBCTEHMKZYLIL-UHFFFAOYSA-N	1	0	264.457	4.465	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@@H]1CCCO[C@H]1c1ccc(C)cc1	ZINC000531723965	328023270	/nfs/dbraw/zinc/02/32/70/328023270.db2.gz	AYDIDBSTRPJNOJ-DKKFBQAASA-N	1	0	287.447	4.405	20	30		CIEDRO
C[N@H+](CCSCCCC(C)(C)C#N)Cc1ccccc1	ZINC000193624495	329060141	/nfs/dbraw/zinc/06/01/41/329060141.db2.gz	FFBFWLSLZQSZPK-UHFFFAOYSA-N	1	0	290.476	4.182	20	30		CIEDRO
C[C@@H](CCC#N)[N@@H+]1CC[C@@H](Sc2cccc(Cl)c2)C1	ZINC000411757367	328098616	/nfs/dbraw/zinc/09/86/16/328098616.db2.gz	LXDOMWHBEVBCDP-SWLSCSKDSA-N	1	0	294.851	4.199	20	30		CIEDRO
CC[N@H+](CCC1(C#N)CCCCC1)[C@@H]1CCOC(C)(C)C1	ZINC000411761100	328098950	/nfs/dbraw/zinc/09/89/50/328098950.db2.gz	XQHLUVIEACKNMF-MRXNPFEDSA-N	1	0	292.467	4.130	20	30		CIEDRO
COc1ccc(C[N@H+](C)CCCC(C)(C)C#N)cc1Cl	ZINC000412043210	328102764	/nfs/dbraw/zinc/10/27/64/328102764.db2.gz	PBBFWHMTOYFLLO-UHFFFAOYSA-N	1	0	294.826	4.110	20	30		CIEDRO
C=CC[C@H](Cc1ccccc1)[NH2+][C@H](C)c1cncc(C)c1	ZINC000414306855	328154305	/nfs/dbraw/zinc/15/43/05/328154305.db2.gz	RMBVTSQIGAVBSR-VQIMIIECSA-N	1	0	280.415	4.228	20	30		CIEDRO
CN(C)c1ccc(C[N@H+](CCCC(C)(C)C#N)C2CC2)cc1	ZINC000267032813	328171916	/nfs/dbraw/zinc/17/19/16/328171916.db2.gz	NDBYAHVADLYQRD-UHFFFAOYSA-N	1	0	299.462	4.047	20	30		CIEDRO
N#CC1(c2ccccc2)CCC([NH2+][C@@H]2CC=CCC2)CC1	ZINC000271527397	328196890	/nfs/dbraw/zinc/19/68/90/328196890.db2.gz	RHMQWNFCIGBGII-LMDPOFIKSA-N	1	0	280.415	4.089	20	30		CIEDRO
C[C@H](CCC#N)[N@H+](C)Cc1csc2ccccc12	ZINC000276349323	328217853	/nfs/dbraw/zinc/21/78/53/328217853.db2.gz	WBRBFWLAWBDKPH-GFCCVEGCSA-N	1	0	258.390	4.025	20	30		CIEDRO
CSCc1ccc(C[NH2+][C@H](C)c2ccc(C#N)cc2)cc1	ZINC000285134682	328247370	/nfs/dbraw/zinc/24/73/70/328247370.db2.gz	OFWGQNBYSNZFHZ-CQSZACIVSA-N	1	0	296.439	4.272	20	30		CIEDRO
C=CCC[C@H]([NH2+]CC1CCSCC1)c1ccco1	ZINC000285960819	328248455	/nfs/dbraw/zinc/24/84/55/328248455.db2.gz	GQNSKEOQQLKBJS-AWEZNQCLSA-N	1	0	265.422	4.020	20	30		CIEDRO
Cc1sccc1C[NH2+][C@H](CCC#N)c1ccccc1	ZINC000293278075	328275162	/nfs/dbraw/zinc/27/51/62/328275162.db2.gz	NYSWCBYINKPMMP-MRXNPFEDSA-N	1	0	270.401	4.191	20	30		CIEDRO
CC[C@@H]1CC[C@@H]1[NH2+][C@H](CCCC#N)c1ccccc1	ZINC000340429739	328276430	/nfs/dbraw/zinc/27/64/30/328276430.db2.gz	DILSTCBHSWTFQM-OIISXLGYSA-N	1	0	256.393	4.200	20	30		CIEDRO
C[C@@H]([NH2+][C@H](CCCC#N)c1ccccc1)c1ccc(F)cn1	ZINC000340430910	328276652	/nfs/dbraw/zinc/27/66/52/328276652.db2.gz	IGRYFIYAIOWTRL-RDTXWAMCSA-N	1	0	297.377	4.306	20	30		CIEDRO
CCC[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccsc1	ZINC000296450601	328290611	/nfs/dbraw/zinc/29/06/11/328290611.db2.gz	MSNSXADLRJOFBN-QEJZJMRPSA-N	1	0	262.422	4.261	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@H]2CC3(CCC3)Oc3ccccc32)C1	ZINC000296481791	328290711	/nfs/dbraw/zinc/29/07/11/328290711.db2.gz	OHGQAPMFMDIEAA-ZOBUZTSGSA-N	1	0	296.414	4.105	20	30		CIEDRO
C[C@H]([NH2+]CCCCC#N)c1ccc(Oc2ccccc2)cn1	ZINC000297890853	328294912	/nfs/dbraw/zinc/29/49/12/328294912.db2.gz	VPASIRRAWZSEPC-HNNXBMFYSA-N	1	0	295.386	4.218	20	30		CIEDRO
Cc1cc(F)ccc1C1CC[NH+](CCCCC#N)CC1	ZINC000298192508	328295446	/nfs/dbraw/zinc/29/54/46/328295446.db2.gz	BMGKVEMEVKUKJN-UHFFFAOYSA-N	1	0	274.383	4.007	20	30		CIEDRO
C=CC1CC[NH+](Cc2ncc(-c3ccccc3C)o2)CC1	ZINC000534528287	328305453	/nfs/dbraw/zinc/30/54/53/328305453.db2.gz	SBDFXJFJWRWJJY-UHFFFAOYSA-N	1	0	282.387	4.048	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C#N)cc1F)c1ccc(Cl)s1	ZINC000049129518	328341587	/nfs/dbraw/zinc/34/15/87/328341587.db2.gz	KMQGYTMFJCKLEJ-SECBINFHSA-N	1	0	294.782	4.263	20	30		CIEDRO
C=CC1CC[NH+](Cc2nc(-c3ccccc3)oc2C)CC1	ZINC000111257639	328340767	/nfs/dbraw/zinc/34/07/67/328340767.db2.gz	MMJLQLLKAYXVNB-UHFFFAOYSA-N	1	0	282.387	4.048	20	30		CIEDRO
CC(C)([NH2+]CCCC#N)c1ccc(Cl)c(Cl)c1	ZINC000101549865	328357122	/nfs/dbraw/zinc/35/71/22/328357122.db2.gz	GAWQFVUPNYBEON-UHFFFAOYSA-N	1	0	271.191	4.122	20	30		CIEDRO
Cc1ccccc1C[N@H+](Cc1ccc(C#N)s1)C1CC1	ZINC000535069726	328383702	/nfs/dbraw/zinc/38/37/02/328383702.db2.gz	WOHSNTCCMCLUEW-UHFFFAOYSA-N	1	0	282.412	4.093	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1ccc2nc(C)sc2c1	ZINC000341441447	328408411	/nfs/dbraw/zinc/40/84/11/328408411.db2.gz	SOJSQTVLUOPRJL-CYBMUJFWSA-N	1	0	260.406	4.049	20	30		CIEDRO
CC1(C)CCCC[C@@H]1[NH2+][C@H]1CCc2ccc(C#N)cc21	ZINC000564419285	328462413	/nfs/dbraw/zinc/46/24/13/328462413.db2.gz	NTTZXZDPEGFKBV-IRXDYDNUSA-N	1	0	268.404	4.104	20	30		CIEDRO
C=CCCCC[NH+]1CCC(c2c[nH]c3ncccc23)CC1	ZINC000582162645	328587767	/nfs/dbraw/zinc/58/77/67/328587767.db2.gz	FJRKCYFBKKNRJK-UHFFFAOYSA-N	1	0	283.419	4.099	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@H](C)[C@@H](OC)c1ccccc1F	ZINC000538406778	326830230	/nfs/dbraw/zinc/83/02/30/326830230.db2.gz	UEKDWRZVQVFFQW-SZOQZIPDSA-N	1	0	279.399	4.092	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@@H](C)[C@@H](OC)c1ccccc1F	ZINC000538406777	326830236	/nfs/dbraw/zinc/83/02/36/326830236.db2.gz	UEKDWRZVQVFFQW-AYMQEEERSA-N	1	0	279.399	4.092	20	30		CIEDRO
C[C@H]([NH2+]C1CCC(C(F)(F)F)CC1)c1cccc(C#N)c1	ZINC000037305924	326844486	/nfs/dbraw/zinc/84/44/86/326844486.db2.gz	OREWCSHQPABQDU-QGLTVNCISA-N	1	0	296.336	4.330	20	30		CIEDRO
C[C@@H]([NH2+]C1CCC(C(F)(F)F)CC1)c1cccc(C#N)c1	ZINC000037305925	326844647	/nfs/dbraw/zinc/84/46/47/326844647.db2.gz	OREWCSHQPABQDU-VCANKDNSSA-N	1	0	296.336	4.330	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@@H]2CC[C@@H]3CCCC[C@@H]3C2)c1	ZINC000037489534	326853739	/nfs/dbraw/zinc/85/37/39/326853739.db2.gz	HFKNJFFPSBYIGN-RCCFBDPRSA-N	1	0	268.404	4.007	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+]C1CCC(C(=O)OC(C)(C)C)CC1	ZINC000537952724	326879775	/nfs/dbraw/zinc/87/97/75/326879775.db2.gz	QMZPDHNLXCWKTI-HWOWSKLDSA-N	1	0	295.467	4.221	20	30		CIEDRO
C=CCC[C@@H]([NH2+][C@H](C)Cc1ccc(O)cc1)c1ccco1	ZINC000556870392	326975732	/nfs/dbraw/zinc/97/57/32/326975732.db2.gz	DRFXZHRZYDUPHW-RHSMWYFYSA-N	1	0	285.387	4.213	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCSCC(F)(F)F)c1ccco1	ZINC000556885088	326978700	/nfs/dbraw/zinc/97/87/00/326978700.db2.gz	GLIBAPVBYPBJRR-LLVKDONJSA-N	1	0	293.354	4.172	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCCSCC)c1ccco1	ZINC000557394761	327004143	/nfs/dbraw/zinc/00/41/43/327004143.db2.gz	OXVQHJXRLRQDTC-CYBMUJFWSA-N	1	0	253.411	4.020	20	30		CIEDRO
CC[N@H+](Cc1ccc(Cl)cn1)[C@@H](C)c1ccc(C#N)cc1	ZINC000557454910	327006531	/nfs/dbraw/zinc/00/65/31/327006531.db2.gz	URSOXVMDWBIZEV-ZDUSSCGKSA-N	1	0	299.805	4.190	20	30		CIEDRO
N#CCC[C@@H]([NH2+]C/C=C\c1ccccc1)c1ccccc1	ZINC000255713922	327007029	/nfs/dbraw/zinc/00/70/29/327007029.db2.gz	JYXREWJAGJKIGX-SCEWNMGZSA-N	1	0	276.383	4.334	20	30		CIEDRO
CCC[C@H](CC)[NH2+][C@@H]1CCCc2cc(C#N)ccc21	ZINC000557523849	327011365	/nfs/dbraw/zinc/01/13/65/327011365.db2.gz	SKDQQXCMATYATH-DOTOQJQBSA-N	1	0	256.393	4.104	20	30		CIEDRO
CC[C@@H](c1ccccc1OC)[N@H+](C)CC#Cc1ccccc1	ZINC000558177803	327077848	/nfs/dbraw/zinc/07/78/48/327077848.db2.gz	PFZCFOGJGBENRB-IBGZPJMESA-N	1	0	293.410	4.130	20	30		CIEDRO
C[C@H](CCc1ccc(F)cc1F)[NH2+]CC(C)(C)CCC#N	ZINC000558237641	327080401	/nfs/dbraw/zinc/08/04/01/327080401.db2.gz	LKEDYFOXDYLWSP-CYBMUJFWSA-N	1	0	294.389	4.205	20	30		CIEDRO
C[C@@H]([NH2+]CC(C)(C)CCC#N)c1ccc(F)cc1Cl	ZINC000558245560	327081167	/nfs/dbraw/zinc/08/11/67/327081167.db2.gz	GDXYKLAWMURWNL-LLVKDONJSA-N	1	0	282.790	4.460	20	30		CIEDRO
C[C@]1(c2ccccc2)CCC[N@H+](Cc2ccc(C#N)o2)CC1	ZINC000558412576	327092098	/nfs/dbraw/zinc/09/20/98/327092098.db2.gz	FBPAQWKGKMPDPV-IBGZPJMESA-N	1	0	294.398	4.095	20	30		CIEDRO
N#Cc1ccc2c(c1)[C@H]([NH2+]CCC1=CCCCC1)CC2	ZINC000558504226	327099435	/nfs/dbraw/zinc/09/94/35/327099435.db2.gz	PAHHMTRZIKAILJ-GOSISDBHSA-N	1	0	266.388	4.026	20	30		CIEDRO
Cc1ccc(C(C)(C)C[NH2+][C@H]2CCC[C@@H](C#N)C2)c(C)c1	ZINC000426324309	327164084	/nfs/dbraw/zinc/16/40/84/327164084.db2.gz	FESWHBSGLQWHDZ-SJORKVTESA-N	1	0	284.447	4.253	20	30		CIEDRO
CC1(C)CCC[C@@H]([NH2+][C@@H]2CCc3ccc(C#N)cc32)C1	ZINC000569396539	327172223	/nfs/dbraw/zinc/17/22/23/327172223.db2.gz	CLHMVUXRNGXQBN-NVXWUHKLSA-N	1	0	268.404	4.104	20	30		CIEDRO
C=CC[N@@H+](CCc1ccco1)[C@H](C)Cc1ccsc1	ZINC000569404525	327172693	/nfs/dbraw/zinc/17/26/93/327172693.db2.gz	XJIFAGFNJRRMJH-CQSZACIVSA-N	1	0	275.417	4.003	20	30		CIEDRO
C=C1CC[NH+](CCCOc2ccc3ccccc3c2)CC1	ZINC000518677617	327192219	/nfs/dbraw/zinc/19/22/19/327192219.db2.gz	ZZBQDKKPGDMNCE-UHFFFAOYSA-N	1	0	281.399	4.261	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+]CC2(c3ccccc3)CCCCC2)C1	ZINC000569541367	327195291	/nfs/dbraw/zinc/19/52/91/327195291.db2.gz	JZKPVXZRDRLMDH-FUHWJXTLSA-N	1	0	282.431	4.170	20	30		CIEDRO
CCc1ccc([C@@H](C)[NH2+]CC(C)(C)CCC#N)s1	ZINC000554076458	327196504	/nfs/dbraw/zinc/19/65/04/327196504.db2.gz	FAYXCQMIPZNUCO-GFCCVEGCSA-N	1	0	264.438	4.291	20	30		CIEDRO
CC(C)[C@](C)(Cc1ccc(Cl)cc1)[NH2+]CCCC#N	ZINC000559387908	327200606	/nfs/dbraw/zinc/20/06/06/327200606.db2.gz	SLCFUGABJQMACD-INIZCTEOSA-N	1	0	278.827	4.191	20	30		CIEDRO
C=CCC[C@@H]([NH2+][C@H](C)c1cncnc1C)c1ccccc1	ZINC000564472039	327210401	/nfs/dbraw/zinc/21/04/01/327210401.db2.gz	XYNDBTLBRRQOEV-CRAIPNDOSA-N	1	0	281.403	4.143	20	30		CIEDRO
N#CCCCC[N@@H+](Cc1ccc(C(F)(F)F)cc1)C1CC1	ZINC000102396944	327226811	/nfs/dbraw/zinc/22/68/11/327226811.db2.gz	SSYBZMFEXAXBDM-UHFFFAOYSA-N	1	0	296.336	4.364	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+]CC[C@H](c2ccccc2)C(F)(F)F)C1	ZINC000559877386	327267135	/nfs/dbraw/zinc/26/71/35/327267135.db2.gz	LBSMWPOFICUYTG-VHDGCEQUSA-N	1	0	296.336	4.004	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H]1CCc2c1ccc(OC)c2F	ZINC000559879057	327268002	/nfs/dbraw/zinc/26/80/02/327268002.db2.gz	TWDGSOQFDWNUDE-CQSZACIVSA-N	1	0	277.383	4.014	20	30		CIEDRO
N#CCc1ccc(C[NH2+][C@@H]2CCSc3ccccc32)cc1	ZINC000564965321	327282166	/nfs/dbraw/zinc/28/21/66/327282166.db2.gz	QTDSMFZQXFNDFG-QGZVFWFLSA-N	1	0	294.423	4.079	20	30		CIEDRO
CC(C)C[N@H+](CCCCCF)Cc1ccc(C#N)cc1	ZINC000560159014	327287438	/nfs/dbraw/zinc/28/74/38/327287438.db2.gz	GTRASELMOJNPKQ-UHFFFAOYSA-N	1	0	276.399	4.156	20	30		CIEDRO
C=CCCCC[N@@H+](C)[C@H](C)c1sc(C)nc1C	ZINC000560193587	327289373	/nfs/dbraw/zinc/28/93/73/327289373.db2.gz	SFADVIYREFYJOC-GFCCVEGCSA-N	1	0	252.427	4.109	20	30		CIEDRO
C=CCCCC[NH2+][C@H](C)c1ccc(NC(=O)C2CC2)cc1	ZINC000560239290	327292269	/nfs/dbraw/zinc/29/22/69/327292269.db2.gz	IEYALPJHDDMMMD-CQSZACIVSA-N	1	0	286.419	4.042	20	30		CIEDRO
C[C@H]([NH2+]C1(c2cccc(C#N)c2)CC1)[C@@H](C)c1ccccc1	ZINC000560269294	327295123	/nfs/dbraw/zinc/29/51/23/327295123.db2.gz	UKGVCZRXKCUMGE-CVEARBPZSA-N	1	0	290.410	4.329	20	30		CIEDRO
C[C@@H]1CC[N@H+](Cc2ccc(F)cc2C#N)[C@H]2CCCC[C@@H]12	ZINC000560342739	327300886	/nfs/dbraw/zinc/30/08/86/327300886.db2.gz	JSXXAAPHXYTZFS-BVGQSLNGSA-N	1	0	286.394	4.098	20	30		CIEDRO
C[C@H](CCc1ccccc1)[NH2+][C@@H]1CCc2ccc(C#N)cc21	ZINC000583351729	327315429	/nfs/dbraw/zinc/31/54/29/327315429.db2.gz	NAZGWVUBOAKRPX-FOIQADDNSA-N	1	0	290.410	4.156	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@H](C)N1CCCC[C@H]1C)c1ccco1	ZINC000560514476	327317359	/nfs/dbraw/zinc/31/73/59/327317359.db2.gz	NNRITQMRNUXZNO-IKGGRYGDSA-N	1	0	290.451	4.139	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccc(OCC)cc1)c1ccco1	ZINC000560525990	327318607	/nfs/dbraw/zinc/31/86/07/327318607.db2.gz	CTXYHZILZGDPJD-QGZVFWFLSA-N	1	0	285.387	4.475	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCc1ccc(C)o1)c1ccco1	ZINC000560528766	327319309	/nfs/dbraw/zinc/31/93/09/327319309.db2.gz	NQSVSLFURVZETC-HNNXBMFYSA-N	1	0	259.349	4.021	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CC1(SC)CCC1)c1ccco1	ZINC000560536517	327321056	/nfs/dbraw/zinc/32/10/56/327321056.db2.gz	HWIUTONAPPSRFG-CYBMUJFWSA-N	1	0	265.422	4.162	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCc1sccc1C)c1ccco1	ZINC000560543893	327321604	/nfs/dbraw/zinc/32/16/04/327321604.db2.gz	DAOAZFQQYUOBBX-CQSZACIVSA-N	1	0	275.417	4.489	20	30		CIEDRO
Cc1ccc([C@H]([NH2+]Cc2cc(C#N)cs2)C2CC2)cc1	ZINC000531117666	327378771	/nfs/dbraw/zinc/37/87/71/327378771.db2.gz	VUYOAIYRPZEIAC-KRWDZBQOSA-N	1	0	282.412	4.169	20	30		CIEDRO
Cc1cc(C)cc([C@@H](C)[NH2+]CC(C)(C)CCC#N)c1	ZINC000561347467	327387840	/nfs/dbraw/zinc/38/78/40/327387840.db2.gz	HUBMJHVKIWIZFJ-OAHLLOKOSA-N	1	0	258.409	4.284	20	30		CIEDRO
Cc1cc2cc(C[NH2+][C@H](C)c3cccc(C#N)c3)ccc2[nH]1	ZINC000507250960	332800473	/nfs/dbraw/zinc/80/04/73/332800473.db2.gz	DRXXOZVCKOKXRR-CQSZACIVSA-N	1	0	289.382	4.199	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCCc2cc(F)ccc21)c1ccc(C#N)cc1	ZINC000159549060	327533444	/nfs/dbraw/zinc/53/34/44/327533444.db2.gz	QMDPPEIOQDDIKT-DJJJIMSYSA-N	1	0	294.373	4.426	20	30		CIEDRO
CCC[C@@H]([NH2+]Cc1cccc(C#N)c1)c1ccc(OC)cc1	ZINC000151371540	327549195	/nfs/dbraw/zinc/54/91/95/327549195.db2.gz	KNZNYYUPYWSNPZ-LJQANCHMSA-N	1	0	294.398	4.198	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(F)c(Cl)c1)c1cccc(C#N)c1	ZINC000053148973	328663648	/nfs/dbraw/zinc/66/36/48/328663648.db2.gz	OWQRCWKGNRWRLZ-LLVKDONJSA-N	1	0	288.753	4.202	20	30		CIEDRO
N#CC1(c2ccccc2)CCC([NH2+]C[C@H]2CC=CCC2)CC1	ZINC000507581972	332815253	/nfs/dbraw/zinc/81/52/53/332815253.db2.gz	VIDYFBQYOHOUNJ-KKXNLOMOSA-N	1	0	294.442	4.336	20	30		CIEDRO
CC(C)=CCC[C@@H](C)[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000532207634	328707083	/nfs/dbraw/zinc/70/70/83/328707083.db2.gz	YWKGCSXCHJLPFD-HUUCEWRRSA-N	1	0	256.393	4.344	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+]C[C@H]1SCCc2ccccc21	ZINC000532248769	328711142	/nfs/dbraw/zinc/71/11/42/328711142.db2.gz	KNDHYBVSNCSSNZ-JJRVBVJISA-N	1	0	275.461	4.207	20	30		CIEDRO
C[C@@H](Nc1cc[nH+]c2ccccc12)c1ccc(C#N)cc1	ZINC000041720821	328714786	/nfs/dbraw/zinc/71/47/86/328714786.db2.gz	NJGITTVOZCVDLX-CYBMUJFWSA-N	1	0	273.339	4.280	20	30		CIEDRO
Cc1cccc([C@@H](C)C[NH2+][C@H](C)c2ccc(C#N)c(F)c2)c1	ZINC000538506929	328811465	/nfs/dbraw/zinc/81/14/65/328811465.db2.gz	MTDCGWMEDCMSCY-LSDHHAIUSA-N	1	0	296.389	4.460	20	30		CIEDRO
CC(C)[C@@H](C[NH+]1CCC(CC#N)CC1)c1ccccc1	ZINC000526986107	328818259	/nfs/dbraw/zinc/81/82/59/328818259.db2.gz	OJZYKXMFBBVHNX-GOSISDBHSA-N	1	0	270.420	4.052	20	30		CIEDRO
N#Cc1ccc2c(c1)CCCC[C@@H]2[NH2+][C@@H]1CC=CCC1	ZINC000360658417	328909707	/nfs/dbraw/zinc/90/97/07/328909707.db2.gz	SKBFPHMCADIUTJ-AEFFLSMTSA-N	1	0	266.388	4.024	20	30		CIEDRO
N#CCCC[N@@H+]1Cc2ccccc2C[C@@H]1c1ccccc1	ZINC000174036732	329153658	/nfs/dbraw/zinc/15/36/58/329153658.db2.gz	COOSYSBNENSFFT-LJQANCHMSA-N	1	0	276.383	4.090	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+]CCCc1c[nH]c2ccccc12	ZINC000462024047	329193061	/nfs/dbraw/zinc/19/30/61/329193061.db2.gz	BGYFEIWLVCCUHU-INIZCTEOSA-N	1	0	270.420	4.435	20	30		CIEDRO
CC(C)c1ccc2c(c1)[C@H]([NH2+]CCCCC#N)CCCO2	ZINC000178275949	329195434	/nfs/dbraw/zinc/19/54/34/329195434.db2.gz	FHXVCLFOODZCHZ-QGZVFWFLSA-N	1	0	286.419	4.307	20	30		CIEDRO
C=C(Cl)COc1ccc([C@H](C)[NH2+]Cc2ccoc2)cc1	ZINC000178476909	329199420	/nfs/dbraw/zinc/19/94/20/329199420.db2.gz	NIVNGSTYCWCFJL-ZDUSSCGKSA-N	1	0	291.778	4.262	20	30		CIEDRO
COc1ccc([C@@H](CCC(C)C)[NH2+]CCCCC#N)cc1	ZINC000178640941	329201663	/nfs/dbraw/zinc/20/16/63/329201663.db2.gz	CXAHBMKLUAGZCZ-GOSISDBHSA-N	1	0	288.435	4.456	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ncc(C)s1)c1ccccc1	ZINC000178761071	329202273	/nfs/dbraw/zinc/20/22/73/329202273.db2.gz	STPMMEXYVPBRQW-OAHLLOKOSA-N	1	0	272.417	4.249	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1cn2ccccc2n1)c1ccccc1	ZINC000178956898	329203219	/nfs/dbraw/zinc/20/32/19/329203219.db2.gz	SOXBSEMJVQICAN-SFHVURJKSA-N	1	0	291.398	4.131	20	30		CIEDRO
CCCCCCC[N@@H+]1CCC[C@@H](c2nncn2C(C)C)C1	ZINC000180623725	329221391	/nfs/dbraw/zinc/22/13/91/329221391.db2.gz	NWKIIDWMLORCOQ-MRXNPFEDSA-N	1	0	292.471	4.009	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1ccc(OCC(F)(F)F)cc1	ZINC000508968421	332853456	/nfs/dbraw/zinc/85/34/56/332853456.db2.gz	QDOUQDURIABSPA-LBPRGKRZSA-N	1	0	287.325	4.245	20	30		CIEDRO
Cc1ccc([C@@H](C)[NH2+]CC(C)(C)CCC#N)s1	ZINC000229693186	329356869	/nfs/dbraw/zinc/35/68/69/329356869.db2.gz	ZSFQMEFRDLVACG-GFCCVEGCSA-N	1	0	250.411	4.037	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1cccc(OC(F)(F)F)c1	ZINC000508992959	332854502	/nfs/dbraw/zinc/85/45/02/332854502.db2.gz	XITLGJSAZMTBSY-NSHDSACASA-N	1	0	273.298	4.202	20	30		CIEDRO
C[C@@H](C[NH2+]CC(C)(C)CC#N)c1ccc(C(F)(F)F)cc1	ZINC000459737021	329376017	/nfs/dbraw/zinc/37/60/17/329376017.db2.gz	VKIHNUINZSWHOE-LBPRGKRZSA-N	1	0	298.352	4.338	20	30		CIEDRO
N#CCC[C@@H]([NH2+][C@H]1CCC12CCCC2)c1ccccc1	ZINC000189179725	329376513	/nfs/dbraw/zinc/37/65/13/329376513.db2.gz	ICEKWPOOLJFDGA-SJORKVTESA-N	1	0	268.404	4.344	20	30		CIEDRO
Cc1cccc2c1OCC[C@@H]2[NH2+][C@@H](C)c1ccc(C#N)s1	ZINC000189458731	329382704	/nfs/dbraw/zinc/38/27/04/329382704.db2.gz	AZEGLNWQCJCEHK-WFASDCNBSA-N	1	0	298.411	4.103	20	30		CIEDRO
C[C@H](C#N)C[NH2+][C@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1	ZINC000583242205	329393416	/nfs/dbraw/zinc/39/34/16/329393416.db2.gz	LJHOSAOWFQCFOJ-ZLDLUXBVSA-N	1	0	296.336	4.091	20	30		CIEDRO
C[C@@H]1C[C@]1([NH2+]CCC(C)(C)C#N)c1ccc(Cl)cc1	ZINC000503410438	329422384	/nfs/dbraw/zinc/42/23/84/329422384.db2.gz	AVUDAWHFWJCZCL-MLGOLLRUSA-N	1	0	276.811	4.105	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](C)c1cc(OC)ccc1OC	ZINC000398093475	329432827	/nfs/dbraw/zinc/43/28/27/329432827.db2.gz	ZHJNACXUXOULSX-KBPBESRZSA-N	1	0	277.408	4.099	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H](C)c1c(F)cccc1OC	ZINC000398184483	329438636	/nfs/dbraw/zinc/43/86/36/329438636.db2.gz	PKSDRMVCVGLQRE-CHWSQXEVSA-N	1	0	265.372	4.230	20	30		CIEDRO
CC(C)(C)CC(C)(C)[NH2+]Cc1ccc(CC#N)cc1	ZINC000398978588	329447224	/nfs/dbraw/zinc/44/72/24/329447224.db2.gz	DYVNNAOELOJXTB-UHFFFAOYSA-N	1	0	258.409	4.057	20	30		CIEDRO
N#CCCC1CC[NH+](Cc2cccc3ccccc32)CC1	ZINC000399292997	329450013	/nfs/dbraw/zinc/45/00/13/329450013.db2.gz	BRDQAPVBVGVIIG-UHFFFAOYSA-N	1	0	278.399	4.356	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+]Cc1ccc(COC)cc1	ZINC000584402365	329456392	/nfs/dbraw/zinc/45/63/92/329456392.db2.gz	MFALURXJCADEED-HNNXBMFYSA-N	1	0	261.409	4.058	20	30		CIEDRO
C[C@H](CC#N)[NH2+][C@H](C)[C@H](C)c1ccccc1C(F)(F)F	ZINC000245855061	329756099	/nfs/dbraw/zinc/75/60/99/329756099.db2.gz	DLTSOMPQRVDFJV-GRYCIOLGSA-N	1	0	284.325	4.089	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CCCc3c(F)cccc32)cc1F	ZINC000421389426	329819754	/nfs/dbraw/zinc/81/97/54/329819754.db2.gz	XTNNZNFWVWMYSR-GOSISDBHSA-N	1	0	298.336	4.004	20	30		CIEDRO
N#Cc1ccc(C[NH2+]Cc2ccc(C3CC3)cc2F)cc1F	ZINC000421359545	329822704	/nfs/dbraw/zinc/82/27/04/329822704.db2.gz	XFRKBKPJRXGRGT-UHFFFAOYSA-N	1	0	298.336	4.004	20	30		CIEDRO
CC[C@H]1CC[C@H]([NH2+][C@@H](C)c2ccc(C#N)c(F)c2)CC1	ZINC000572017702	329938028	/nfs/dbraw/zinc/93/80/28/329938028.db2.gz	IJEROXPKVKFZQS-XEZPLFJOSA-N	1	0	274.383	4.317	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1scnc1C)c1ccccc1	ZINC000269354679	330068248	/nfs/dbraw/zinc/06/82/48/330068248.db2.gz	MAZQPYWVTVIVMN-OAHLLOKOSA-N	1	0	272.417	4.249	20	30		CIEDRO
C#CC[C@H]([NH2+][C@H](C)c1ccc(C)s1)c1ccccc1	ZINC000271440097	330079927	/nfs/dbraw/zinc/07/99/27/330079927.db2.gz	FCPBUAGQCRQDJS-ZBFHGGJFSA-N	1	0	269.413	4.472	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@@H](C)c1sc(CC)nc1C)c1ccccc1	ZINC000271426812	330079965	/nfs/dbraw/zinc/07/99/65/330079965.db2.gz	CQLMEPCJBYTQFY-XJKSGUPXSA-N	1	0	298.455	4.429	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1c(C)onc1CC)c1ccccc1	ZINC000271744426	330082584	/nfs/dbraw/zinc/08/25/84/330082584.db2.gz	QQSUFXNIZBORHB-SFHVURJKSA-N	1	0	284.403	4.343	20	30		CIEDRO
Cc1ccc([C@H]([NH2+]Cc2ccc(C#N)s2)C2CCC2)o1	ZINC000421879538	330102021	/nfs/dbraw/zinc/10/20/21/330102021.db2.gz	NHSDWGGQZADZOU-MRXNPFEDSA-N	1	0	286.400	4.152	20	30		CIEDRO
N#Cc1csc(C[N@@H+]2CCC[C@@H]2c2cccs2)c1	ZINC000162714345	330108827	/nfs/dbraw/zinc/10/88/27/330108827.db2.gz	XNAYIKHARYQTFD-CYBMUJFWSA-N	1	0	274.414	4.018	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccc(F)cc1)c1ccco1	ZINC000276433674	330113296	/nfs/dbraw/zinc/11/32/96/330113296.db2.gz	JDTJTCOMFBFWMB-HNNXBMFYSA-N	1	0	259.324	4.216	20	30		CIEDRO
C=CCC[C@@H](NCc1nc(C2CC2)cs1)c1ccco1	ZINC000276498848	330113425	/nfs/dbraw/zinc/11/34/25/330113425.db2.gz	WQUUBSCFZRIBCL-CYBMUJFWSA-N	1	0	288.416	4.411	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1sc(C)nc1C)c1ccco1	ZINC000278903077	330121169	/nfs/dbraw/zinc/12/11/69/330121169.db2.gz	IXWTVUDGIFZPAY-CYBMUJFWSA-N	1	0	276.405	4.150	20	30		CIEDRO
C=CCC[C@H](N[C@H]1C[C@@H]([NH3+])c2ccccc21)c1ccccc1	ZINC000423002439	330163781	/nfs/dbraw/zinc/16/37/81/330163781.db2.gz	YYXPQYLYPTXIBJ-AABGKKOBSA-N	1	0	292.426	4.428	20	30		CIEDRO
C[C@H](CCSc1ccccc1)[N@H+](C)CC(C)(C)C#N	ZINC000433285285	330216118	/nfs/dbraw/zinc/21/61/18/330216118.db2.gz	HLSUAGTXXAPBAM-CQSZACIVSA-N	1	0	276.449	4.039	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](C)c1cccc(OC(F)(F)F)c1	ZINC000536855847	330252033	/nfs/dbraw/zinc/25/20/33/330252033.db2.gz	CGWXNKNIFYBABB-MNOVXSKESA-N	1	0	273.298	4.200	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@@H](C)c1ccc(C(C)C)cc1	ZINC000424137655	330274845	/nfs/dbraw/zinc/27/48/45/330274845.db2.gz	MDFVNDFZGJRPDG-WBAXXEDZSA-N	1	0	273.420	4.052	20	30		CIEDRO
N#CC1CCC(C[NH2+]Cc2c(F)ccc(F)c2Cl)CC1	ZINC000527703620	330275159	/nfs/dbraw/zinc/27/51/59/330275159.db2.gz	RGRXHAHEBMALQN-UHFFFAOYSA-N	1	0	298.764	4.038	20	30		CIEDRO
CC(C)Cc1ccccc1C[NH2+]Cc1ccc(C#N)s1	ZINC000527732705	330278435	/nfs/dbraw/zinc/27/84/35/330278435.db2.gz	LIUDHRTYDXQKDP-UHFFFAOYSA-N	1	0	284.428	4.108	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@H](C)c1cc(-c2ccccc2)n(C)n1	ZINC000527895000	330292810	/nfs/dbraw/zinc/29/28/10/330292810.db2.gz	OUDBWQFJTMHGTD-ZBFHGGJFSA-N	1	0	283.419	4.092	20	30		CIEDRO
C/C(=C/c1ccc(Cl)cc1)C[NH2+][C@@H]1CC[C@H](C#N)C1	ZINC000424187308	330320921	/nfs/dbraw/zinc/32/09/21/330320921.db2.gz	ASKKVYFZXLQYOP-MEJTZIMASA-N	1	0	274.795	4.025	20	30		CIEDRO
CC(C)[N@@H+](Cc1ccccc1C(C)(C)C#N)CC1CC1	ZINC000533030803	330324901	/nfs/dbraw/zinc/32/49/01/330324901.db2.gz	ADNGXYKOJYHICQ-UHFFFAOYSA-N	1	0	270.420	4.108	20	30		CIEDRO
Cc1c(F)cccc1-c1ccc(C[NH2+][C@@H]2CC[C@H](C#N)C2)o1	ZINC000424207221	330327873	/nfs/dbraw/zinc/32/78/73/330327873.db2.gz	XMXXPSJKABJMNO-UONOGXRCSA-N	1	0	298.361	4.176	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H](C)c2cc(C)oc2C)cc1	ZINC000044729536	330331186	/nfs/dbraw/zinc/33/11/86/330331186.db2.gz	BEWMVHIRPJZIRE-CQSZACIVSA-N	1	0	285.387	4.312	20	30		CIEDRO
C[C@H](CC1CCCC1)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000533090924	330333939	/nfs/dbraw/zinc/33/39/39/330333939.db2.gz	KAPPOKDIWOBDLK-KGLIPLIRSA-N	1	0	256.393	4.178	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@H](c1cc2ccccc2o1)C(C)C	ZINC000424291749	330334954	/nfs/dbraw/zinc/33/49/54/330334954.db2.gz	FJOAEJAAJQANLZ-BXWFABGCSA-N	1	0	299.414	4.311	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@H](C)[C@@H](C)c1ccc(Cl)cc1	ZINC000424293768	330335413	/nfs/dbraw/zinc/33/54/13/330335413.db2.gz	JFOFPZCNAPHEBF-LGWLGOQQSA-N	1	0	293.838	4.013	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@H](CC)c1cccc(Cl)c1F	ZINC000424300279	330336964	/nfs/dbraw/zinc/33/69/64/330336964.db2.gz	XIEJFRIDDYROGC-GLQYFDAESA-N	1	0	297.801	4.111	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H]2CCc3ccc(F)cc32)cc1	ZINC000106477628	330338611	/nfs/dbraw/zinc/33/86/11/330338611.db2.gz	ZVXHNQZQCVEETC-LJQANCHMSA-N	1	0	297.373	4.168	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)C1(c2ccccc2)CCCC1	ZINC000424317646	330339689	/nfs/dbraw/zinc/33/96/89/330339689.db2.gz	CCTSGQZHSSTANA-SOLBZPMBSA-N	1	0	282.431	4.169	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@@H]2CCc3cc(Cl)cc(Cl)c32)C1	ZINC000424317632	330339770	/nfs/dbraw/zinc/33/97/70/330339770.db2.gz	CCMSDJQCNQCGIU-MRCXROJRSA-N	1	0	295.213	4.263	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@H]2CCc3cc(Cl)cc(Cl)c32)C1	ZINC000424317627	330339807	/nfs/dbraw/zinc/33/98/07/330339807.db2.gz	CCMSDJQCNQCGIU-BHYNMZESSA-N	1	0	295.213	4.263	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@@H]2CC[C@@H](c3cccc(Cl)c3)C2)C1	ZINC000424318693	330339958	/nfs/dbraw/zinc/33/99/58/330339958.db2.gz	DGDINUOTAUQAEN-LBRJOISOSA-N	1	0	288.822	4.258	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1cc(Cl)ccc1OC	ZINC000424321167	330340131	/nfs/dbraw/zinc/34/01/31/330340131.db2.gz	GUZBARZVBFRJKD-NJZAAPMLSA-N	1	0	292.810	4.082	20	30		CIEDRO
CCSc1ccc([C@@H](C)[NH2+][C@@H]2CC[C@H](C#N)C2)cc1	ZINC000424320799	330340145	/nfs/dbraw/zinc/34/01/45/330340145.db2.gz	GMHYCOXYYABPQA-VNHYZAJKSA-N	1	0	274.433	4.141	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@@H](c2ccc(F)cc2)C2CCCC2)C1	ZINC000424322255	330340460	/nfs/dbraw/zinc/34/04/60/330340460.db2.gz	IGSKPPYZVMEFPB-MORSLUCNSA-N	1	0	286.394	4.339	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)C1CCC(C(F)(F)F)CC1	ZINC000424322606	330340526	/nfs/dbraw/zinc/34/05/26/330340526.db2.gz	IIQKPEYBJKVUCM-XPXVYLNCSA-N	1	0	288.357	4.025	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1cc(Cl)sc1Cl	ZINC000424327631	330341619	/nfs/dbraw/zinc/34/16/19/330341619.db2.gz	NDAHZCHZCJUGIO-XHNCKOQMSA-N	1	0	289.231	4.398	20	30		CIEDRO
C[C@H](Cc1c(Cl)cccc1Cl)[NH2+][C@@H]1CC[C@H](C#N)C1	ZINC000424327624	330341699	/nfs/dbraw/zinc/34/16/99/330341699.db2.gz	NCAJICUCRGJCMP-GRYCIOLGSA-N	1	0	297.229	4.206	20	30		CIEDRO
CC(C)[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1cc2ccccc2o1	ZINC000424329096	330341777	/nfs/dbraw/zinc/34/17/77/330341777.db2.gz	OZFFMBRSGIZSGJ-JCKWVBRZSA-N	1	0	282.387	4.412	20	30		CIEDRO
CC(C)[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc(Cl)cc1	ZINC000424329133	330341782	/nfs/dbraw/zinc/34/17/82/330341782.db2.gz	PDFHJVSRUXCEDO-MAZHCROVSA-N	1	0	276.811	4.319	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@@H](c2cccs2)C2CCCC2)C1	ZINC000424330752	330342069	/nfs/dbraw/zinc/34/20/69/330342069.db2.gz	RAOKWTKOYMZZAF-IVMMDQJWSA-N	1	0	274.433	4.261	20	30		CIEDRO
N#CC1(c2ccccc2)CCC([NH2+][C@@H]2C[C@H]2C2CCC2)CC1	ZINC000424330074	330342108	/nfs/dbraw/zinc/34/21/08/330342108.db2.gz	QDJPLQWJUUNOED-FUFFSDJGSA-N	1	0	294.442	4.169	20	30		CIEDRO
Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+][C@@H]1CC[C@H](C#N)C1	ZINC000424337130	330343648	/nfs/dbraw/zinc/34/36/48/330343648.db2.gz	YXSOOBSFYCVPQD-WCFLWFBJSA-N	1	0	291.464	4.092	20	30		CIEDRO
Cc1cc(C)cc(C[C@@H](C)[NH2+]Cc2ccc(C#N)cc2F)c1	ZINC000533309820	330357042	/nfs/dbraw/zinc/35/70/42/330357042.db2.gz	WKKSFQUGTASASC-OAHLLOKOSA-N	1	0	296.389	4.035	20	30		CIEDRO
C[C@@H](c1cccs1)[N@H+](C)CC#Cc1cccc(Cl)c1	ZINC000533323353	330357528	/nfs/dbraw/zinc/35/75/28/330357528.db2.gz	FWOMIYILFRGQAO-ZDUSSCGKSA-N	1	0	289.831	4.446	20	30		CIEDRO
C[C@H](c1cccs1)[N@H+](C)CC#Cc1cccc(Cl)c1	ZINC000533323352	330357564	/nfs/dbraw/zinc/35/75/64/330357564.db2.gz	FWOMIYILFRGQAO-CYBMUJFWSA-N	1	0	289.831	4.446	20	30		CIEDRO
C=CCCC[N@@H+](C)[C@@H](C)c1nc2ccccc2s1	ZINC000117871293	330366110	/nfs/dbraw/zinc/36/61/10/330366110.db2.gz	SXLLTXSOVPFVQX-LBPRGKRZSA-N	1	0	260.406	4.255	20	30		CIEDRO
COc1ccc(C[N@H+](C)[C@H](C)c2ccc(C#N)cc2)cc1C	ZINC000118397500	330367184	/nfs/dbraw/zinc/36/71/84/330367184.db2.gz	QKUIWKFVGHROEA-OAHLLOKOSA-N	1	0	294.398	4.068	20	30		CIEDRO
CC(C)[C@@H]([NH2+]Cc1ccccc1C#N)c1ccc(F)cc1	ZINC000057627926	330377204	/nfs/dbraw/zinc/37/72/04/330377204.db2.gz	ZHQGYBRIAKCBJW-GOSISDBHSA-N	1	0	282.362	4.184	20	30		CIEDRO
COc1ccc([C@H](C)[NH2+]CC#Cc2ccccc2Cl)cc1	ZINC000537029651	330388530	/nfs/dbraw/zinc/38/85/30/330388530.db2.gz	GSRVOYMAYZMMMF-AWEZNQCLSA-N	1	0	299.801	4.051	20	30		CIEDRO
C[C@H]([NH2+][C@H](CCC#N)c1ccccc1)C1CCCC1	ZINC000090665087	330394666	/nfs/dbraw/zinc/39/46/66/330394666.db2.gz	AAKSCFIQSXJTEZ-WMLDXEAASA-N	1	0	256.393	4.200	20	30		CIEDRO
C[C@H](Cc1ccc(F)cc1)[NH2+][C@@H](CCC#N)c1ccccc1	ZINC000090665156	330394703	/nfs/dbraw/zinc/39/47/03/330394703.db2.gz	FMWSLTZAYRRUIR-BEFAXECRSA-N	1	0	296.389	4.391	20	30		CIEDRO
C=CC[C@@H](CO)C[NH2+][C@@H](C)c1cccc(-c2ccccc2)c1	ZINC000537094391	330398568	/nfs/dbraw/zinc/39/85/68/330398568.db2.gz	CDAHWYUVRWJZCG-DLBZAZTESA-N	1	0	295.426	4.189	20	30		CIEDRO
N#CCCC[NH+]1CCC(c2ccc(C(F)(F)F)cc2)CC1	ZINC000091100106	330398864	/nfs/dbraw/zinc/39/88/64/330398864.db2.gz	CTVVSVVZZVRGCO-UHFFFAOYSA-N	1	0	296.336	4.189	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1csc(-c2ccco2)n1)C1CC1	ZINC000121704056	330405963	/nfs/dbraw/zinc/40/59/63/330405963.db2.gz	QRBVJEVMYYRKCE-AWEZNQCLSA-N	1	0	288.416	4.238	20	30		CIEDRO
CC(C)[C@H](C[NH2+]Cc1ccc(C#N)s1)c1ccccc1	ZINC000537211573	330415765	/nfs/dbraw/zinc/41/57/65/330415765.db2.gz	LTLUOYQIRHJTLG-KRWDZBQOSA-N	1	0	284.428	4.149	20	30		CIEDRO
N#CC1(C[NH2+]C2(c3ccc(Cl)cc3)CCCCC2)CC1	ZINC000537248792	330430482	/nfs/dbraw/zinc/43/04/82/330430482.db2.gz	MJQFZKYWNFLTNW-UHFFFAOYSA-N	1	0	288.822	4.393	20	30		CIEDRO
C[C@@H]([NH2+]CC1(c2ccccc2)CCC1)c1ccc(C#N)cc1	ZINC000537295543	330431490	/nfs/dbraw/zinc/43/14/90/330431490.db2.gz	JDHUVDRJTWCMKD-MRXNPFEDSA-N	1	0	290.410	4.331	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH2+][C@@H]2CCCc3sc(Cl)cc32)C1	ZINC000426302319	330503368	/nfs/dbraw/zinc/50/33/68/330503368.db2.gz	RJQDZGWDANVNSW-CKYFFXLPSA-N	1	0	280.824	4.061	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](C)[C@H]1OCCc2sccc21	ZINC000429121491	330538777	/nfs/dbraw/zinc/53/87/77/330538777.db2.gz	GOFSFRXYQHPQGN-HEHGZKQESA-N	1	0	279.449	4.085	20	30		CIEDRO
C=CCCC[C@@H](C)[NH+]1CCC(c2ccncc2)CC1	ZINC000429548881	330548851	/nfs/dbraw/zinc/54/88/51/330548851.db2.gz	OPHJYNMKEAWRJM-OAHLLOKOSA-N	1	0	258.409	4.006	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH+]2CCC(CCc3ccccc3)CC2)C1	ZINC000429702361	330552823	/nfs/dbraw/zinc/55/28/23/330552823.db2.gz	NRWLUPZDMPXWDT-MOPGFXCFSA-N	1	0	282.431	4.023	20	30		CIEDRO
CC(C)(C)[C@H]1CCC[C@H]([NH2+]CC2(CC#N)CC2)CC1	ZINC000430063794	330558387	/nfs/dbraw/zinc/55/83/87/330558387.db2.gz	BBGIDPDUYYXZSK-GJZGRUSLSA-N	1	0	262.441	4.265	20	30		CIEDRO
C=CCOc1ccc(C[NH+](C2CCC2)C2CCC2)cc1	ZINC000430116610	330561485	/nfs/dbraw/zinc/56/14/85/330561485.db2.gz	XSGSSVJARPSBPR-UHFFFAOYSA-N	1	0	271.404	4.158	20	30		CIEDRO
N#CCCCOc1cccc(C[NH+](C2CCC2)C2CCC2)c1	ZINC000430168556	330562848	/nfs/dbraw/zinc/56/28/48/330562848.db2.gz	RUZHAVDAUNBMHS-UHFFFAOYSA-N	1	0	298.430	4.276	20	30		CIEDRO
C[C@@H](Cc1c(Cl)cccc1Cl)[NH2+]CC1(CC#N)CC1	ZINC000430742799	330572462	/nfs/dbraw/zinc/57/24/62/330572462.db2.gz	NJGVPRWHUCBZIL-NSHDSACASA-N	1	0	297.229	4.208	20	30		CIEDRO
Cc1ccccc1[C@H](CC(C)C)[NH2+]CC1(CC#N)CC1	ZINC000430748114	330572798	/nfs/dbraw/zinc/57/27/98/330572798.db2.gz	BURWLBJAPBDENC-KRWDZBQOSA-N	1	0	270.420	4.366	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+]CCC1CC(OC(C)(C)C)C1	ZINC000432425273	330599157	/nfs/dbraw/zinc/59/91/57/330599157.db2.gz	LQBNLTACFDACQP-HWOWSKLDSA-N	1	0	267.457	4.305	20	30		CIEDRO
N#CCCC[C@@H]([NH2+][C@@H]1C=CCCC1)c1ccccc1	ZINC000433016077	330612203	/nfs/dbraw/zinc/61/22/03/330612203.db2.gz	NJFRLEAZVNMWQZ-IAGOWNOFSA-N	1	0	254.377	4.120	20	30		CIEDRO
C=CCC[C@H](CC)Nc1cccc2c1OCC[C@@H]2[NH+](C)C	ZINC000435038541	330648476	/nfs/dbraw/zinc/64/84/76/330648476.db2.gz	SZRHNVZWKVXUCN-YOEHRIQHSA-N	1	0	288.435	4.229	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@@H]1CC[C@@H](C)c2ccccc21	ZINC000436289542	330673611	/nfs/dbraw/zinc/67/36/11/330673611.db2.gz	XREHPSFOIIKGLD-RGCFKVTRSA-N	1	0	285.431	4.196	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@H](C)CCC1CCCCC1	ZINC000436294963	330674119	/nfs/dbraw/zinc/67/41/19/330674119.db2.gz	XWTSXDYHKDBXQA-NXHRZFHOSA-N	1	0	279.468	4.306	20	30		CIEDRO
CC(C)(C)c1ccc(C[NH2+]CC2CCC(C#N)CC2)s1	ZINC000441383574	330767287	/nfs/dbraw/zinc/76/72/87/330767287.db2.gz	PVDVGJUTVQODML-UHFFFAOYSA-N	1	0	290.476	4.465	20	30		CIEDRO
CC1(C)CCc2ccccc2[C@H]([NH2+]Cc2ccc(C#N)o2)C1	ZINC000441379643	330767355	/nfs/dbraw/zinc/76/73/55/330767355.db2.gz	JSAXDJGQLAQFGD-GOSISDBHSA-N	1	0	294.398	4.345	20	30		CIEDRO
CC[C@H]([NH2+]CC1CCC(C#N)CC1)c1ccc(F)cc1F	ZINC000442088843	330773885	/nfs/dbraw/zinc/77/38/85/330773885.db2.gz	AVCXRGQSNDRHIW-FVKWTLKZSA-N	1	0	292.373	4.335	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+]CCc2cccc(-c3ccccc3)c2)C1	ZINC000442768154	330781675	/nfs/dbraw/zinc/78/16/75/330781675.db2.gz	OCCUROIZJSOVFQ-FXAWDEMLSA-N	1	0	290.410	4.178	20	30		CIEDRO
CC([NH2+][C@@H]1CC[C@@H](C#N)C1)(c1ccccc1)c1ccccc1	ZINC000442853588	330787132	/nfs/dbraw/zinc/78/71/32/330787132.db2.gz	UUDLRUSVDJRXPQ-VQIMIIECSA-N	1	0	290.410	4.232	20	30		CIEDRO
CC1(C)[C@@H]([NH2+]CC2CCC(C#N)CC2)C[C@H]1c1ccccc1	ZINC000442857543	330787618	/nfs/dbraw/zinc/78/76/18/330787618.db2.gz	PTVNKXPSTJVSSX-VHZYLWGESA-N	1	0	296.458	4.488	20	30		CIEDRO
CSc1ccccc1[C@H](C)[NH2+]CC1CCC(C#N)CC1	ZINC000442858878	330787742	/nfs/dbraw/zinc/78/77/42/330787742.db2.gz	TUBPLMGTCYSYKC-NFOMZHRRSA-N	1	0	288.460	4.389	20	30		CIEDRO
CC[C@H]([NH2+]CC1CCC(C#N)CC1)C1CCCCC1	ZINC000442864034	330788351	/nfs/dbraw/zinc/78/83/51/330788351.db2.gz	FJRRMRGBYGTJKI-DQPZFDDXSA-N	1	0	262.441	4.265	20	30		CIEDRO
Cc1cccc2c1[C@H](C)C[C@H]2[NH2+]CC1CCC(C#N)CC1	ZINC000442866938	330788538	/nfs/dbraw/zinc/78/85/38/330788538.db2.gz	JQALERWXODGHQJ-YHOLWWCESA-N	1	0	282.431	4.463	20	30		CIEDRO
CC1CC[NH+](Cc2ccc(N[C@H]3CC[C@H](C#N)C3)cc2)CC1	ZINC000442869640	330788984	/nfs/dbraw/zinc/78/89/84/330788984.db2.gz	JCEVPLSRBCDSEJ-HKUYNNGSSA-N	1	0	297.446	4.023	20	30		CIEDRO
C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]CCCCC(C)(C)C#N	ZINC000444674430	330818406	/nfs/dbraw/zinc/81/84/06/330818406.db2.gz	KOEMDTZVWCZRLL-FICVDOATSA-N	1	0	250.430	4.121	20	30		CIEDRO
CCS[C@H]1CCCC[C@@H]1[NH2+]CCCCC(C)(C)C#N	ZINC000444685685	330819236	/nfs/dbraw/zinc/81/92/36/330819236.db2.gz	PEPVYLXKSCXITR-GJZGRUSLSA-N	1	0	282.497	4.360	20	30		CIEDRO
CC(C)(C[NH2+][C@@H]1CCC[C@H](C#N)C1)C1=CCCCC1	ZINC000446793687	330854305	/nfs/dbraw/zinc/85/43/05/330854305.db2.gz	GUQHQGFEFJMOFQ-GOEBONIOSA-N	1	0	260.425	4.185	20	30		CIEDRO
CC(C)c1ccc2c(c1)[C@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)CC2	ZINC000446805106	330854604	/nfs/dbraw/zinc/85/46/04/330854604.db2.gz	AAWJLAQANOULHD-DKSSEZFCSA-N	1	0	282.431	4.469	20	30		CIEDRO
Cc1ccc([C@@H]([NH2+]CCCC#N)C2CCCC2)cc1	ZINC000446883298	330856984	/nfs/dbraw/zinc/85/69/84/330856984.db2.gz	JXJKBTFNLYQLCE-KRWDZBQOSA-N	1	0	256.393	4.120	20	30		CIEDRO
CC[C@@H]([NH2+][C@H](C)CCc1ccco1)c1ccc(C#N)cc1	ZINC000447519467	330867640	/nfs/dbraw/zinc/86/76/40/330867640.db2.gz	GTZJOUDJSRINGY-RDTXWAMCSA-N	1	0	282.387	4.213	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+][C@H](CC(F)(F)F)c2ccccc2)C1	ZINC000447530143	330868101	/nfs/dbraw/zinc/86/81/01/330868101.db2.gz	MBQPBBDNCDWLOB-BPLDGKMQSA-N	1	0	296.336	4.352	20	30		CIEDRO
Cc1ccccc1[C@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)C(C)C	ZINC000447543941	330869505	/nfs/dbraw/zinc/86/95/05/330869505.db2.gz	UHQSYIXOCGWKFC-SOLBZPMBSA-N	1	0	270.420	4.364	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](CC)c1ccc(C#N)cc1	ZINC000447580314	330871039	/nfs/dbraw/zinc/87/10/39/330871039.db2.gz	NTIUPVYCMUZHHZ-WMLDXEAASA-N	1	0	256.393	4.344	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CCC(C)(C)C1)c1ccc(C#N)cc1	ZINC000447588984	330872042	/nfs/dbraw/zinc/87/20/42/330872042.db2.gz	WQGWAMHSSRAJOT-CVEARBPZSA-N	1	0	256.393	4.178	20	30		CIEDRO
C=C(C[NH2+]Cc1ncc(C(C)(C)C)s1)c1ccccc1	ZINC000447933068	330880412	/nfs/dbraw/zinc/88/04/12/330880412.db2.gz	VCFGGCPYROHSRT-UHFFFAOYSA-N	1	0	286.444	4.244	20	30		CIEDRO
CC(C)[C@H]([NH2+]C1CCC(C)(C#N)CC1)c1ccccc1	ZINC000449068456	330896913	/nfs/dbraw/zinc/89/69/13/330896913.db2.gz	SGPKCBMBTGHTJY-ADKAHSJRSA-N	1	0	270.420	4.446	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@H](c2cccs2)C2CC2)CC1	ZINC000449076720	330897507	/nfs/dbraw/zinc/89/75/07/330897507.db2.gz	XRJVLMPDFUZWBM-SIWZUTFBSA-N	1	0	274.433	4.261	20	30		CIEDRO
CCc1cccc2c1OCC[C@H]2[NH2+]C1CCC(C)(C#N)CC1	ZINC000449136265	330901125	/nfs/dbraw/zinc/90/11/25/330901125.db2.gz	UPXLKOCUKYUBSA-URSIVYNOSA-N	1	0	298.430	4.135	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@@H]1CCO[C@@H](C(C)(C)C)C1	ZINC000449200273	330905804	/nfs/dbraw/zinc/90/58/04/330905804.db2.gz	BMSVNKSJDUCBLO-ARFHVFGLSA-N	1	0	267.457	4.305	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+]C[C@@H](C)c1ncc(C)s1	ZINC000449237408	330908453	/nfs/dbraw/zinc/90/84/53/330908453.db2.gz	NYGGLGQAHLLMDC-OLZOCXBDSA-N	1	0	266.454	4.280	20	30		CIEDRO
CC[C@@H](CC#N)[NH2+]Cc1ccccc1-c1ccccc1C	ZINC000449244722	330909333	/nfs/dbraw/zinc/90/93/33/330909333.db2.gz	VHHSCPIZZUOTOH-KRWDZBQOSA-N	1	0	278.399	4.444	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@H]2CC[C@H](c3ccc(Cl)cc3)C2)C1	ZINC000449246534	330909433	/nfs/dbraw/zinc/90/94/33/330909433.db2.gz	BZBJWQHGLCNEAU-QCPWZWHMSA-N	1	0	288.822	4.258	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[C@H](c3ccc(Cl)cc3)C2)C1	ZINC000449246533	330909482	/nfs/dbraw/zinc/90/94/82/330909482.db2.gz	BZBJWQHGLCNEAU-NQZOLGFYSA-N	1	0	288.822	4.258	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@@H](C)c1nc(C(C)(C)C)no1	ZINC000449280564	330911511	/nfs/dbraw/zinc/91/15/11/330911511.db2.gz	XWMKGNKTZFGSMC-STQMWFEESA-N	1	0	279.428	4.153	20	30		CIEDRO
CCC[C@H]([NH2+]CC(C)(C)CCC#N)C1CCCC1	ZINC000449332068	330915311	/nfs/dbraw/zinc/91/53/11/330915311.db2.gz	PWEPABWYGBRMEG-HNNXBMFYSA-N	1	0	250.430	4.265	20	30		CIEDRO
CC[C@@H]([NH2+]C1CCC(C#N)(c2ccccc2)CC1)C(F)F	ZINC000449357398	330918357	/nfs/dbraw/zinc/91/83/57/330918357.db2.gz	CWCOMEYSOWTESM-ISXOHVOVSA-N	1	0	292.373	4.024	20	30		CIEDRO
C[C@@H]([NH2+]C1CCC(C#N)(c2ccccc2)CC1)C(C)(F)F	ZINC000449415684	330923922	/nfs/dbraw/zinc/92/39/22/330923922.db2.gz	QBZSMZSMUXTJJW-BZOOQXSSSA-N	1	0	292.373	4.024	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@H]2CCC[C@@H]2CCc2ccccc2)C1	ZINC000449444704	330925964	/nfs/dbraw/zinc/92/59/64/330925964.db2.gz	CPLBNWKWBVVLCB-YRPNKDGESA-N	1	0	296.458	4.460	20	30		CIEDRO
C/C(=C/c1ccc(Cl)cc1)C[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000449444727	330925995	/nfs/dbraw/zinc/92/59/95/330925995.db2.gz	CXRVCADDIGFZPT-FCDYRPLESA-N	1	0	288.822	4.415	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@@H]2CCCCC23CCCC3)C1	ZINC000449445842	330926263	/nfs/dbraw/zinc/92/62/63/330926263.db2.gz	LXJLRLSCQKVMLP-HRCADAONSA-N	1	0	260.425	4.161	20	30		CIEDRO
CC(C)C[C@@H](C)C[C@@H](C)[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000449446343	330926375	/nfs/dbraw/zinc/92/63/75/330926375.db2.gz	PJBVEAMTQTYKLG-WCVJEAGWSA-N	1	0	250.430	4.119	20	30		CIEDRO
CCC[C@H]([NH2+]C1CCC(C)(C#N)CC1)C(C)(C)C	ZINC000449475797	330928848	/nfs/dbraw/zinc/92/88/48/330928848.db2.gz	UWQIVRSQRGKSAA-BBBYJDLNSA-N	1	0	250.430	4.263	20	30		CIEDRO
C=C(C)CC[NH2+]Cc1cnc(-c2ccccc2F)s1	ZINC000449480743	330929323	/nfs/dbraw/zinc/92/93/23/330929323.db2.gz	ZLDXRXASRANAIE-UHFFFAOYSA-N	1	0	276.380	4.005	20	30		CIEDRO
C[C@H]([NH2+]C1CCC(C)(C#N)CC1)[C@H]1CCC[C@H](C)C1	ZINC000449765777	330948713	/nfs/dbraw/zinc/94/87/13/330948713.db2.gz	KMGHTDJVLBOERG-OLGJIQAVSA-N	1	0	262.441	4.263	20	30		CIEDRO
CC(C)(C)[C@H]([NH2+]CC1(C#N)CCC1)c1ccccc1	ZINC000450521461	330984854	/nfs/dbraw/zinc/98/48/54/330984854.db2.gz	XNHWQOFNVMKISM-OAHLLOKOSA-N	1	0	256.393	4.057	20	30		CIEDRO
N#Cc1cccc(C2([NH2+]CC/C=C/c3ccccc3)CC2)c1	ZINC000450671395	330992447	/nfs/dbraw/zinc/99/24/47/330992447.db2.gz	HMTREXRFGSMWRH-RUDMXATFSA-N	1	0	288.394	4.240	20	30		CIEDRO
C[C@@H]1C[C@H](c2ccccc2)[C@H](C)[N@@H+]1CCC(C)(C)C#N	ZINC000451180407	331019027	/nfs/dbraw/zinc/01/90/27/331019027.db2.gz	GJCBEPSLHMRIKE-VYDXJSESSA-N	1	0	270.420	4.193	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)c1cccc(C(F)(F)F)c1	ZINC000163329273	331021469	/nfs/dbraw/zinc/02/14/69/331021469.db2.gz	ULMLIOBVSYDEBA-WDEREUQCSA-N	1	0	257.299	4.321	20	30		CIEDRO
N#CCc1ccc(C[N@@H+]2CC3(CCC3)[C@H]2c2ccco2)cc1	ZINC000451836540	331044272	/nfs/dbraw/zinc/04/42/72/331044272.db2.gz	AWIJELNPQHFDNO-GOSISDBHSA-N	1	0	292.382	4.073	20	30		CIEDRO
C=CCCCCC[NH2+]C1(Cc2ccccc2)CCOCC1	ZINC000451943982	331047867	/nfs/dbraw/zinc/04/78/67/331047867.db2.gz	MMMMUNDOHMEENM-UHFFFAOYSA-N	1	0	287.447	4.114	20	30		CIEDRO
CC(C)(C#N)CC[N@@H+]1CCC[C@H]1c1ccc(F)cc1F	ZINC000451976742	331049148	/nfs/dbraw/zinc/04/91/48/331049148.db2.gz	YQGZRKJMLRSOSZ-HNNXBMFYSA-N	1	0	278.346	4.042	20	30		CIEDRO
C[C@H]1CC[C@H]([NH2+]Cc2cccc(C#N)c2)c2sccc21	ZINC000453101905	331089365	/nfs/dbraw/zinc/08/93/65/331089365.db2.gz	ZPJCVCHPRRONMJ-LRDDRELGSA-N	1	0	282.412	4.348	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](C)c1ccc(Oc2ccccc2)cn1	ZINC000453145907	331093983	/nfs/dbraw/zinc/09/39/83/331093983.db2.gz	NWWQKYYDXOURKX-HUUCEWRRSA-N	1	0	282.387	4.489	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](C)CCCc1cccnc1	ZINC000453185674	331098666	/nfs/dbraw/zinc/09/86/66/331098666.db2.gz	XSKXZDYZGURUMS-JKSUJKDBSA-N	1	0	260.425	4.127	20	30		CIEDRO
C[C@H]([NH2+]C[C@H]1CSc2ccccc21)c1cccc(C#N)c1	ZINC000453223791	331103557	/nfs/dbraw/zinc/10/35/57/331103557.db2.gz	SVTODTJBZVGVCT-BBRMVZONSA-N	1	0	294.423	4.098	20	30		CIEDRO
CC(F)(F)CCC[NH2+][C@H]1CCCCc2cc(C#N)ccc21	ZINC000453241108	331105999	/nfs/dbraw/zinc/10/59/99/331105999.db2.gz	VGTUVHDDVKZQEC-INIZCTEOSA-N	1	0	292.373	4.351	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H]1CCCCC1(F)F)C1CC1	ZINC000453260948	331108711	/nfs/dbraw/zinc/10/87/11/331108711.db2.gz	YHTZAUIDZWSQQC-KBPBESRZSA-N	1	0	257.368	4.146	20	30		CIEDRO
CC(C)(C)[C@H]1CCCC[C@@H]1[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000453286485	331111311	/nfs/dbraw/zinc/11/13/11/331111311.db2.gz	DBEVASHTZILYJZ-VGWMRTNUSA-N	1	0	262.441	4.263	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@@H]2CCCc3c(Cl)cccc32)C1	ZINC000453290829	331111809	/nfs/dbraw/zinc/11/18/09/331111809.db2.gz	LZKHDLGPQHNUBS-GDZNZVCISA-N	1	0	288.822	4.389	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccc(F)cc1F	ZINC000453291675	331111891	/nfs/dbraw/zinc/11/18/91/331111891.db2.gz	MZIGJGNDWICUAB-RBOXIYTFSA-N	1	0	278.346	4.088	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccc2c(c1)CCCC2	ZINC000453293614	331112008	/nfs/dbraw/zinc/11/20/08/331112008.db2.gz	PIEVLGBMNDLHOR-DOXZYTNZSA-N	1	0	282.431	4.298	20	30		CIEDRO
CC(C)[C@@H](CCc1ccccc1)[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000453294982	331112286	/nfs/dbraw/zinc/11/22/86/331112286.db2.gz	RDBVONGEBLGDTP-GBESFXJTSA-N	1	0	284.447	4.316	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@H]2CCSc3c(F)cccc32)C1	ZINC000453295140	331112447	/nfs/dbraw/zinc/11/24/47/331112447.db2.gz	RUFVDQQQGLKEGI-HUBLWGQQSA-N	1	0	290.407	4.035	20	30		CIEDRO
C[C@@H]1CC[C@@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)c2sccc21	ZINC000453296172	331112552	/nfs/dbraw/zinc/11/25/52/331112552.db2.gz	UGYGWEKOLGLVCS-UKTARXLSSA-N	1	0	274.433	4.358	20	30		CIEDRO
Cc1cc([C@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)C2CC2)ccc1F	ZINC000453299241	331112923	/nfs/dbraw/zinc/11/29/23/331112923.db2.gz	ZZVCQNQPDWJGNI-QANKJYHBSA-N	1	0	286.394	4.257	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@H](C)c1nc2ccc(Cl)cc2n1C	ZINC000453303760	331113580	/nfs/dbraw/zinc/11/35/80/331113580.db2.gz	DASUVVFZSIFLBE-LLVKDONJSA-N	1	0	291.826	4.090	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@@H](c1ccc2[nH]c(=O)oc2c1)C(C)C	ZINC000453303240	331113584	/nfs/dbraw/zinc/11/35/84/331113584.db2.gz	BVDIKRMEMLWNCJ-OAHLLOKOSA-N	1	0	288.391	4.032	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H]1CCCC1(F)F)c1ccco1	ZINC000453319314	331116047	/nfs/dbraw/zinc/11/60/47/331116047.db2.gz	NGQFGOAPRNCHOY-STQMWFEESA-N	1	0	269.335	4.312	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)c1ccc(F)cc1OC(F)F	ZINC000453327462	331117229	/nfs/dbraw/zinc/11/72/29/331117229.db2.gz	VWQDJIQWYAPPEI-SNVBAGLBSA-N	1	0	273.298	4.044	20	30		CIEDRO
C[C@@H]1CCc2ccccc2[C@H]1[NH2+]Cc1ccc(C#N)c(F)c1	ZINC000453369137	331123784	/nfs/dbraw/zinc/12/37/84/331123784.db2.gz	FHFFIUJELHMOKX-YJYMSZOUSA-N	1	0	294.373	4.111	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1[NH2+][C@@H](C)c1ccc(SC(C)C)cc1	ZINC000453376559	331124935	/nfs/dbraw/zinc/12/49/35/331124935.db2.gz	XMLWFCRIOIQUFY-XKQJLSEDSA-N	1	0	291.460	4.181	20	30		CIEDRO
C=C(CC)C[NH2+][C@H](c1cccnc1)c1ccc(F)c(C)c1	ZINC000453381861	331125933	/nfs/dbraw/zinc/12/59/33/331125933.db2.gz	XWFNLXMOPUNYPO-SFHVURJKSA-N	1	0	284.378	4.174	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1cnc(C)cc1C)c1ccco1	ZINC000453381336	331125939	/nfs/dbraw/zinc/12/59/39/331125939.db2.gz	XNCAOPJWUMOVGT-MRXNPFEDSA-N	1	0	270.376	4.089	20	30		CIEDRO
Cc1cccc([C@H](C)[NH2+][C@H](C)c2ccc(C#N)c(F)c2)c1	ZINC000453383210	331126190	/nfs/dbraw/zinc/12/61/90/331126190.db2.gz	CCBNOVACFSNPML-UONOGXRCSA-N	1	0	282.362	4.418	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@H]1CCOC(C)(C)C1)c1ccco1	ZINC000453434954	331131509	/nfs/dbraw/zinc/13/15/09/331131509.db2.gz	TXTPPGZVERTVTK-GJZGRUSLSA-N	1	0	277.408	4.082	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+]Cc1cccc2cc[nH]c21	ZINC000467372261	331182628	/nfs/dbraw/zinc/18/26/28/331182628.db2.gz	ZEBSMMWXGGTQEO-MRXNPFEDSA-N	1	0	256.393	4.392	20	30		CIEDRO
C[C@@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)c1ccc(C#N)cc1	ZINC000459392303	331279831	/nfs/dbraw/zinc/27/98/31/331279831.db2.gz	QNZIVAMNLQPIFA-CCKFTAQKSA-N	1	0	276.383	4.013	20	30		CIEDRO
N#CCCCC[N@@H+]1CC2(CCCC2)[C@@H]1c1ccccc1	ZINC000459564409	331288132	/nfs/dbraw/zinc/28/81/32/331288132.db2.gz	FEZJJULLHHAWDI-KRWDZBQOSA-N	1	0	268.404	4.298	20	30		CIEDRO
CC(C)(CC#N)C[NH2+]Cc1ccccc1OC1CCCC1	ZINC000459706986	331295275	/nfs/dbraw/zinc/29/52/75/331295275.db2.gz	ZLEOHLVXSLBWLM-UHFFFAOYSA-N	1	0	286.419	4.037	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]C[C@@H]1[C@@H](c2ccccc2)C1(C)C	ZINC000459723695	331295856	/nfs/dbraw/zinc/29/58/56/331295856.db2.gz	YGHZSJKQJWUMGD-IAGOWNOFSA-N	1	0	284.447	4.346	20	30		CIEDRO
Cc1ccc([C@@H]2CCC[C@H]2[NH2+]CC(C)(C)CC#N)cc1	ZINC000459726276	331295963	/nfs/dbraw/zinc/29/59/63/331295963.db2.gz	DRHGRXYRCLFDJV-DLBZAZTESA-N	1	0	270.420	4.161	20	30		CIEDRO
CSc1ccc([C@@H](C)[NH2+]CC(C)(C)CC#N)cc1F	ZINC000459728795	331296286	/nfs/dbraw/zinc/29/62/86/331296286.db2.gz	IUIGEOFOQLZQMT-LLVKDONJSA-N	1	0	280.412	4.138	20	30		CIEDRO
CSc1ccc([C@H](C)[NH2+]CC(C)(C)CC#N)cc1F	ZINC000459728797	331296302	/nfs/dbraw/zinc/29/63/02/331296302.db2.gz	IUIGEOFOQLZQMT-NSHDSACASA-N	1	0	280.412	4.138	20	30		CIEDRO
C[C@@H]([NH2+]CC(C)(C)CC#N)c1ccccc1C(F)(F)F	ZINC000459730451	331296419	/nfs/dbraw/zinc/29/64/19/331296419.db2.gz	MJQMZQQGVKSWDD-LLVKDONJSA-N	1	0	284.325	4.296	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1cccc(Br)c1	ZINC000168053298	331308518	/nfs/dbraw/zinc/30/85/18/331308518.db2.gz	XGTIVJPZPLYKQA-NSHDSACASA-N	1	0	268.198	4.066	20	30		CIEDRO
C=Cc1ccc(CC[NH2+][C@@H](C)c2cccc(C#N)c2)cc1	ZINC000461058023	331311028	/nfs/dbraw/zinc/31/10/28/331311028.db2.gz	LFCPRLYTHBRTNY-HNNXBMFYSA-N	1	0	276.383	4.095	20	30		CIEDRO
CC#CCC[NH+](Cc1cccs1)Cc1cccs1	ZINC000462316441	331319276	/nfs/dbraw/zinc/31/92/76/331319276.db2.gz	OIGAOBAAQZHBBP-UHFFFAOYSA-N	1	0	275.442	4.225	20	30		CIEDRO
CC#CCC[N@H+](C)[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000462321148	331319567	/nfs/dbraw/zinc/31/95/67/331319567.db2.gz	LXZZONIBVUWEQU-GFCCVEGCSA-N	1	0	269.310	4.112	20	30		CIEDRO
CC#CCC[N@@H+]1CCCC[C@@H]1c1cc2ccccc2[nH]1	ZINC000462347724	331320099	/nfs/dbraw/zinc/32/00/99/331320099.db2.gz	RVVWIHGYAXCIHL-GOSISDBHSA-N	1	0	266.388	4.108	20	30		CIEDRO
C[C@@H]1CCCc2ccccc2[C@H]1[NH2+]Cc1ccc(C#N)cc1	ZINC000462547508	331323293	/nfs/dbraw/zinc/32/32/93/331323293.db2.gz	HFYPEGGDEDTEBW-QRWLVFNGSA-N	1	0	290.410	4.362	20	30		CIEDRO
C=CCc1cc(C[NH2+][C@H](C)C[C@H](C)CC)cc(OC)c1O	ZINC000462738389	331326625	/nfs/dbraw/zinc/32/66/25/331326625.db2.gz	RVCDDWVBKPEFLO-ZIAGYGMSSA-N	1	0	291.435	4.044	20	30		CIEDRO
CCC(CC)(C[NH2+]Cc1cccc(C#N)c1)c1ccccc1	ZINC000462748332	331327347	/nfs/dbraw/zinc/32/73/47/331327347.db2.gz	ZVXROKSJZLMVML-UHFFFAOYSA-N	1	0	292.426	4.406	20	30		CIEDRO
C=CCN1CCC([NH2+]Cc2ccc(C3CCCC3)cc2)CC1	ZINC000462787045	331328949	/nfs/dbraw/zinc/32/89/49/331328949.db2.gz	HRJLCJINQCVJKN-UHFFFAOYSA-N	1	0	298.474	4.084	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@@H]2CCCCC23CCCC3)C1	ZINC000462948905	331335736	/nfs/dbraw/zinc/33/57/36/331335736.db2.gz	XCFVOWVQFBDWHZ-OWCLPIDISA-N	1	0	260.425	4.161	20	30		CIEDRO
C=C(C)COCC[NH2+][C@H](C)c1ccc(OC(C)(C)C)cc1	ZINC000463010682	331336937	/nfs/dbraw/zinc/33/69/37/331336937.db2.gz	MSWXTVHGLVHJPO-OAHLLOKOSA-N	1	0	291.435	4.107	20	30		CIEDRO
C[N@H+](Cc1ccc(C#N)cc1)[C@H]1CCCC[C@H]1C(F)(F)F	ZINC000463043312	331338336	/nfs/dbraw/zinc/33/83/36/331338336.db2.gz	MUASAGWZEIFVOW-CABCVRRESA-N	1	0	296.336	4.111	20	30		CIEDRO
CC(C)CC[N@H+](CCC#N)C[C@@H]1C[C@H]1c1ccccc1	ZINC000463090855	331340166	/nfs/dbraw/zinc/34/01/66/331340166.db2.gz	DGGJFULIOBEEDW-ROUUACIJSA-N	1	0	270.420	4.052	20	30		CIEDRO
C=CCCC[N@H+](C)CCCCCn1c(C)nc2ccccc21	ZINC000463109904	331340569	/nfs/dbraw/zinc/34/05/69/331340569.db2.gz	ZZGGUUCMRQNXAJ-UHFFFAOYSA-N	1	0	299.462	4.413	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000463279648	331344889	/nfs/dbraw/zinc/34/48/89/331344889.db2.gz	KIDNYCFDVJJVHA-QXCFHYIPSA-N	1	0	282.431	4.385	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@H]2CCCC[C@H]2Cc2ccccc2)C1	ZINC000463286469	331345171	/nfs/dbraw/zinc/34/51/71/331345171.db2.gz	VYXZBCRKGHWMMV-FYQPLNBISA-N	1	0	296.458	4.460	20	30		CIEDRO
CC(C)CC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCC[C@@H](C#N)C1	ZINC000463291444	331345376	/nfs/dbraw/zinc/34/53/76/331345376.db2.gz	ZXSIBOWTQUWYEU-QZWWFDLISA-N	1	0	262.441	4.263	20	30		CIEDRO
C=CC[N@@H+](CCCC1CCOCC1)Cc1ccccc1F	ZINC000463290495	331345377	/nfs/dbraw/zinc/34/53/77/331345377.db2.gz	JXFAFRXVIDGDJD-UHFFFAOYSA-N	1	0	291.410	4.021	20	30		CIEDRO
CC(C)(C)c1ccc(CC[NH2+][C@H]2CCC[C@H](C#N)C2)cc1	ZINC000463295579	331345632	/nfs/dbraw/zinc/34/56/32/331345632.db2.gz	MIZBUOMBNZXCJA-WMZOPIPTSA-N	1	0	284.447	4.199	20	30		CIEDRO
N#C[C@@H](c1ccccc1)[C@H]1CCC[N@@H+]1CCc1ccccc1	ZINC000464814128	331369418	/nfs/dbraw/zinc/36/94/18/331369418.db2.gz	KXCZFGUUOMDIAC-VQTJNVASSA-N	1	0	290.410	4.001	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1cc2c(ccc(C)c2C)[nH]1	ZINC000466381269	331394189	/nfs/dbraw/zinc/39/41/89/331394189.db2.gz	SBVZCQZTHVKWOO-AWEZNQCLSA-N	1	0	256.393	4.229	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1ccc(C(F)(F)F)s1	ZINC000466398757	331394885	/nfs/dbraw/zinc/39/48/85/331394885.db2.gz	JUEVCCSKPXLYCQ-SECBINFHSA-N	1	0	263.328	4.211	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1cccc(-c2cccnc2)c1	ZINC000466402252	331395136	/nfs/dbraw/zinc/39/51/36/331395136.db2.gz	TVMTVFPBPYPBRC-GOSISDBHSA-N	1	0	266.388	4.193	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1ccc(OCC(F)(F)F)cc1	ZINC000466405656	331395346	/nfs/dbraw/zinc/39/53/46/331395346.db2.gz	PUHKQWCNWANPEZ-ZDUSSCGKSA-N	1	0	287.325	4.072	20	30		CIEDRO
CSc1ccc([C@@H](C)[NH2+]Cc2ccc(C#N)c(C)c2)cc1	ZINC000466420245	331396193	/nfs/dbraw/zinc/39/61/93/331396193.db2.gz	YCHFDMZMPHEVMJ-CQSZACIVSA-N	1	0	296.439	4.439	20	30		CIEDRO
C[C@@H](C[NH2+]CCc1cccc(C#N)c1)c1cccc(Cl)c1	ZINC000466425216	331396553	/nfs/dbraw/zinc/39/65/53/331396553.db2.gz	LGYOQROPQBPYPK-AWEZNQCLSA-N	1	0	298.817	4.147	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@H](C)c1cc(OC)c(OC)cc1C	ZINC000467404980	331417707	/nfs/dbraw/zinc/41/77/07/331417707.db2.gz	LSLQWGVNEXOOCJ-ZIAGYGMSSA-N	1	0	277.408	4.018	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@H](C)[C@@H](C)c1ccc(OC)c(OC)c1	ZINC000467406959	331417848	/nfs/dbraw/zinc/41/78/48/331417848.db2.gz	RHMQTBCBYIXRQR-FMKPAKJESA-N	1	0	291.435	4.140	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@H](C)c1ccc(F)cc1OC(F)F	ZINC000467410910	331418013	/nfs/dbraw/zinc/41/80/13/331418013.db2.gz	LQXBMNSJPKXGQE-PWSUYJOCSA-N	1	0	287.325	4.432	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@H](C)c1ccc2ccccc2n1	ZINC000467419516	331418428	/nfs/dbraw/zinc/41/84/28/331418428.db2.gz	QOLPYCPULMBAAX-UKRRQHHQSA-N	1	0	254.377	4.240	20	30		CIEDRO
Cc1cc([C@@H](C)[NH2+]CCc2cccc(C#N)c2)cc(C)c1F	ZINC000467427843	331418656	/nfs/dbraw/zinc/41/86/56/331418656.db2.gz	FDLCIFXFMWCEAW-OAHLLOKOSA-N	1	0	296.389	4.208	20	30		CIEDRO
N#Cc1cccc(CC[NH2+][C@H]2CCC[C@H]2c2ccccc2)c1	ZINC000467453344	331420184	/nfs/dbraw/zinc/42/01/84/331420184.db2.gz	LJCUBUYFSWCDDO-PMACEKPBSA-N	1	0	290.410	4.027	20	30		CIEDRO
C[C@H](CCC1CCCC1)[NH2+]CCc1cccc(C#N)c1	ZINC000467459229	331420489	/nfs/dbraw/zinc/42/04/89/331420489.db2.gz	RTMYMSYSUZZSGV-OAHLLOKOSA-N	1	0	270.420	4.049	20	30		CIEDRO
CC[C@H](CC#N)[NH2+][C@H]1CCC[C@@H]1c1ccc(Cl)cc1	ZINC000468474056	331435390	/nfs/dbraw/zinc/43/53/90/331435390.db2.gz	BONLYQXCFPDQMB-OAGGEKHMSA-N	1	0	276.811	4.258	20	30		CIEDRO
CC[C@H](CC#N)[NH2+][C@H]1CCC[C@H]1c1ccccc1Cl	ZINC000468474111	331435405	/nfs/dbraw/zinc/43/54/05/331435405.db2.gz	CNIZBNOINUBCQN-INWMFGNUSA-N	1	0	276.811	4.258	20	30		CIEDRO
C=CCOCCC[NH2+][C@@H](C)c1cccc2ccccc21	ZINC000470764358	331489713	/nfs/dbraw/zinc/48/97/13/331489713.db2.gz	GPEHOAKZKRDXPC-HNNXBMFYSA-N	1	0	269.388	4.083	20	30		CIEDRO
CC(C)[NH+](CCCNc1ccc(Cl)cc1C#N)C(C)C	ZINC000470862169	331492831	/nfs/dbraw/zinc/49/28/31/331492831.db2.gz	FLCAQYLJNSPVEC-UHFFFAOYSA-N	1	0	293.842	4.132	20	30		CIEDRO
CC1(c2ccccc2)CCC([NH2+][C@H]2CC[C@@H](C#N)C2)CC1	ZINC000471583116	331511037	/nfs/dbraw/zinc/51/10/37/331511037.db2.gz	USDIPOSHBAXSQW-IZIZEDOESA-N	1	0	282.431	4.169	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@@H](c2ccc(F)cc2)C2CCCC2)C1	ZINC000471584847	331511301	/nfs/dbraw/zinc/51/13/01/331511301.db2.gz	IGSKPPYZVMEFPB-JEBQAFNWSA-N	1	0	286.394	4.339	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+]C2CCC(c3ccc(F)cc3)CC2)C1	ZINC000471587433	331511532	/nfs/dbraw/zinc/51/15/32/331511532.db2.gz	ULBZHRKWCUEMHD-SMRZUVACSA-N	1	0	286.394	4.134	20	30		CIEDRO
CCC[C@H](CCc1ccccc1)[NH2+][C@H]1CC[C@@H](C#N)C1	ZINC000471609892	331512944	/nfs/dbraw/zinc/51/29/44/331512944.db2.gz	DLHDLFTVHBYBFP-KURKYZTESA-N	1	0	270.420	4.070	20	30		CIEDRO
C=CCCCC[NH2+]Cc1csc(-c2ccccc2)n1	ZINC000472073795	331528629	/nfs/dbraw/zinc/52/86/29/331528629.db2.gz	LAWSHANNOYGQOE-UHFFFAOYSA-N	1	0	272.417	4.256	20	30		CIEDRO
CC(C)(C)C1CCC(C[NH2+][C@@H]2CC[C@H](C#N)C2)CC1	ZINC000472135241	331529602	/nfs/dbraw/zinc/52/96/02/331529602.db2.gz	WJCHOTWWMFLZBE-BHDPWAOGSA-N	1	0	262.441	4.121	20	30		CIEDRO
CC(C)[C@H]([NH2+][C@@H](C)CCC#N)c1ccc(Cl)cc1F	ZINC000472466786	331537513	/nfs/dbraw/zinc/53/75/13/331537513.db2.gz	ZMYYWCRTXSJJJF-NHYWBVRUSA-N	1	0	282.790	4.458	20	30		CIEDRO
C=CC[C@@H](C)[C@@H](C)[NH2+]Cc1oc2ccccc2c1OC	ZINC000474061620	331566742	/nfs/dbraw/zinc/56/67/42/331566742.db2.gz	ULXPTUMRIZWHDI-CHWSQXEVSA-N	1	0	273.376	4.132	20	30		CIEDRO
C=CCCOCC[NH2+][C@H](C)[C@@H](C)c1ccc(Cl)cc1	ZINC000474884656	331602808	/nfs/dbraw/zinc/60/28/08/331602808.db2.gz	BXHYOIGIEOWEIE-ZIAGYGMSSA-N	1	0	281.827	4.014	20	30		CIEDRO
CC(C)[C@H](C[NH+]1CCC(C)(C#N)CC1)c1ccccc1	ZINC000474920991	331603933	/nfs/dbraw/zinc/60/39/33/331603933.db2.gz	ANKLEHAZPVWTCZ-KRWDZBQOSA-N	1	0	270.420	4.052	20	30		CIEDRO
Cc1c(C)c(C)c(C[NH+]2CCC(F)(C#N)CC2)c(C)c1C	ZINC000510888207	332919751	/nfs/dbraw/zinc/91/97/51/332919751.db2.gz	UXHDEOAPKKLGAV-UHFFFAOYSA-N	1	0	288.410	4.056	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@H]2CC[C@@H](c3ccc(F)cc3)C2)C1	ZINC000475335981	331627111	/nfs/dbraw/zinc/62/71/11/331627111.db2.gz	ROVZQKLNDSPYEC-WCZJQEMASA-N	1	0	286.394	4.134	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@H](c3ccc(F)cc3)C2)C1	ZINC000475335976	331627219	/nfs/dbraw/zinc/62/72/19/331627219.db2.gz	ROVZQKLNDSPYEC-HUHSQHJXSA-N	1	0	286.394	4.134	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccc(C)cc1OC)c1ccco1	ZINC000476025791	331651471	/nfs/dbraw/zinc/65/14/71/331651471.db2.gz	SXLPSSRKOKKNQH-MRXNPFEDSA-N	1	0	285.387	4.394	20	30		CIEDRO
C=C(C)[C@@H]([NH2+][C@H]1C=CCCC1)c1ccc(F)c(F)c1	ZINC000481607452	331810248	/nfs/dbraw/zinc/81/02/48/331810248.db2.gz	JKVOALKTRADMGG-XJKSGUPXSA-N	1	0	263.331	4.280	20	30		CIEDRO
CC#CCC[NH2+][C@H]1CCC[C@H]1c1ccc(OC(C)C)cc1	ZINC000482157455	331825774	/nfs/dbraw/zinc/82/57/74/331825774.db2.gz	LSMBWVGRBPIOLX-OALUTQOASA-N	1	0	285.431	4.113	20	30		CIEDRO
Cc1cccc(C)c1[C@H](C)[NH2+]CC#Cc1ccccc1	ZINC000483696335	331882018	/nfs/dbraw/zinc/88/20/18/331882018.db2.gz	CLYHWZFTXCXSDN-KRWDZBQOSA-N	1	0	263.384	4.006	20	30		CIEDRO
Cc1cccc(C)c1[C@@H](C)[NH2+]Cc1ccc(C#N)c(F)c1	ZINC000483712478	331882736	/nfs/dbraw/zinc/88/27/36/331882736.db2.gz	RKLWQPRBCGXCRN-CQSZACIVSA-N	1	0	282.362	4.165	20	30		CIEDRO
CC(C)Oc1cccc([C@H](C)[NH2+]CC#Cc2ccccc2)c1	ZINC000484071434	331891997	/nfs/dbraw/zinc/89/19/97/331891997.db2.gz	NIAMIRXVJPGBPF-KRWDZBQOSA-N	1	0	293.410	4.176	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+]C[C@@H](c1ccccc1)C(F)(F)F	ZINC000485721891	331922377	/nfs/dbraw/zinc/92/23/77/331922377.db2.gz	WBCVYWLDZPRLNL-OCCSQVGLSA-N	1	0	271.326	4.277	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H]2CCC[C@@H](c3ccccc3)C2)cc1	ZINC000486898281	331948712	/nfs/dbraw/zinc/94/87/12/331948712.db2.gz	BPPAIAVIRHMDFE-UXHICEINSA-N	1	0	290.410	4.374	20	30		CIEDRO
C=CCCCCC[NH2+][C@@H](c1ccccc1)[C@@H]1CCOC1	ZINC000488129828	331991291	/nfs/dbraw/zinc/99/12/91/331991291.db2.gz	OKOAUZJHYXYLCW-MSOLQXFVSA-N	1	0	273.420	4.100	20	30		CIEDRO
Cc1cc(C[NH2+][C@@]2(C)CCCc3ccccc32)ccc1C#N	ZINC000488231561	331995170	/nfs/dbraw/zinc/99/51/70/331995170.db2.gz	MJUHAODRNARATK-FQEVSTJZSA-N	1	0	290.410	4.208	20	30		CIEDRO
Cc1cccc(C)c1[C@H](C)[NH2+]Cc1ccc(C#N)c(C)c1	ZINC000488263736	331996570	/nfs/dbraw/zinc/99/65/70/331996570.db2.gz	MRYKORXBDHUTTQ-INIZCTEOSA-N	1	0	278.399	4.334	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CS[C@H](C(C)(C)C)C1)c1ccc(C#N)cc1	ZINC000488416423	332005780	/nfs/dbraw/zinc/00/57/80/332005780.db2.gz	IOVNVSFTZCDCKS-MAZHCROVSA-N	1	0	288.460	4.129	20	30		CIEDRO
C=CCCCCC[NH+]1CCC(OCCCC)CC1	ZINC000488446611	332009692	/nfs/dbraw/zinc/00/96/92/332009692.db2.gz	UMBFFWNUYDGBEI-UHFFFAOYSA-N	1	0	253.430	4.014	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@@H](C)c1nnc([C@H](C)CC)[nH]1	ZINC000488499716	332013864	/nfs/dbraw/zinc/01/38/64/332013864.db2.gz	CJCYYGFYLWSXDM-RDBSUJKOSA-N	1	0	278.444	4.104	20	30		CIEDRO
C=CCCCCC[NH2+][C@H]1CCO[C@H]1c1ccc(F)c(F)c1	ZINC000488996938	332037144	/nfs/dbraw/zinc/03/71/44/332037144.db2.gz	OWZOTNRFGFGVBY-IRXDYDNUSA-N	1	0	295.373	4.131	20	30		CIEDRO
CC[C@@H](C)[N@H+](Cc1ccccc1)Cc1ccc(F)cc1C#N	ZINC000489617286	332061770	/nfs/dbraw/zinc/06/17/70/332061770.db2.gz	BAUWYMXBCDOLNJ-OAHLLOKOSA-N	1	0	296.389	4.498	20	30		CIEDRO
C[C@@H](c1cccc(C#N)c1)[N@@H+]1CC[C@H](c2cccc(F)c2)C1	ZINC000489879851	332071299	/nfs/dbraw/zinc/07/12/99/332071299.db2.gz	FOAPPVANGLPVMF-KSSFIOAISA-N	1	0	294.373	4.248	20	30		CIEDRO
C[C@@H](c1cccc(C#N)c1)[N@@H+]1CC[C@@H](c2cccc(F)c2)C1	ZINC000489879825	332071369	/nfs/dbraw/zinc/07/13/69/332071369.db2.gz	FOAPPVANGLPVMF-KBXCAEBGSA-N	1	0	294.373	4.248	20	30		CIEDRO
Cc1ccc(F)cc1C[N@H+](Cc1ccc(C#N)cc1)C1CC1	ZINC000491251310	332173789	/nfs/dbraw/zinc/17/37/89/332173789.db2.gz	XFGJRIMXKLUWRU-UHFFFAOYSA-N	1	0	294.373	4.170	20	30		CIEDRO
C=CCN(CC#Cc1cccc(Cl)c1)CCc1ccco1	ZINC000491421562	332208675	/nfs/dbraw/zinc/20/86/75/332208675.db2.gz	FPAUCVMVVFXVPG-UHFFFAOYSA-N	1	0	299.801	4.015	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](C)[C@@H](OC)c1ccccc1	ZINC000494596361	332479405	/nfs/dbraw/zinc/47/94/05/332479405.db2.gz	RXTPPHMXXAYOCN-YQQAZPJKSA-N	1	0	261.409	4.097	20	30		CIEDRO
C[C@@H]([NH2+]C[C@H]1CCCCC(F)(F)C1)c1ccc(C#N)cc1	ZINC000494994337	332498784	/nfs/dbraw/zinc/49/87/84/332498784.db2.gz	DKXHIPVUQHBQSK-HIFRSBDPSA-N	1	0	292.373	4.424	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+]C1CCC(c2nc(C)no2)CC1	ZINC000495074165	332503761	/nfs/dbraw/zinc/50/37/61/332503761.db2.gz	ZQFSURIPBBZMIB-IUDNXUCKSA-N	1	0	291.439	4.129	20	30		CIEDRO
CCCCC[NH2+]C1CCC(C#N)(c2ccccc2)CC1	ZINC000499965314	332596626	/nfs/dbraw/zinc/59/66/26/332596626.db2.gz	UHFMYPLLUPZIHR-UHFFFAOYSA-N	1	0	270.420	4.170	20	30		CIEDRO
Cc1ccc(C)c([C@@H](C)[NH2+]Cc2ccc(C#N)c(F)c2)c1	ZINC000404766650	332612603	/nfs/dbraw/zinc/61/26/03/332612603.db2.gz	SGBGTXBFPAAJFF-CQSZACIVSA-N	1	0	282.362	4.165	20	30		CIEDRO
Cc1ccccc1[C@H]1C[C@H]([NH2+][C@H](C)c2ccc(C#N)cc2)C1	ZINC000500829940	332619750	/nfs/dbraw/zinc/61/97/50/332619750.db2.gz	TXDHITWLTWXBQA-ATZDWAIDSA-N	1	0	290.410	4.464	20	30		CIEDRO
CC[C@@H]1C[C@@]1([NH2+]CCC(C)(C)C#N)c1cccc(C)c1	ZINC000502590824	332666859	/nfs/dbraw/zinc/66/68/59/332666859.db2.gz	HPADSZYXGDNOIO-QAPCUYQASA-N	1	0	270.420	4.150	20	30		CIEDRO
CC[C@H]1CCC[C@H]1[NH2+]Cc1cccc(OCCCC#N)c1	ZINC000154131644	334688992	/nfs/dbraw/zinc/68/89/92/334688992.db2.gz	LJFIXQSGAHPYDC-FUHWJXTLSA-N	1	0	286.419	4.037	20	30		CIEDRO
CCc1c(C)[nH+]c2ccccc2c1N1CCC(C)(C#N)CC1	ZINC000503304640	332685864	/nfs/dbraw/zinc/68/58/64/332685864.db2.gz	WMCGRNSEGBGMRY-UHFFFAOYSA-N	1	0	293.414	4.236	20	30		CIEDRO
C[C@@H]([NH2+]CCc1cccc(C#N)c1)c1ccccc1Cl	ZINC000503558173	332691950	/nfs/dbraw/zinc/69/19/50/332691950.db2.gz	ONUHLQUCCDAVHK-CYBMUJFWSA-N	1	0	284.790	4.105	20	30		CIEDRO
C[C@@H]([NH2+]CCc1cccc(C#N)c1)c1cccc(Cl)c1	ZINC000503574762	332692957	/nfs/dbraw/zinc/69/29/57/332692957.db2.gz	UVOVZTSVTADCPC-CYBMUJFWSA-N	1	0	284.790	4.105	20	30		CIEDRO
C[C@H]([NH2+]C1CC(c2ccccc2)C1)c1ccc(C#N)cc1F	ZINC000512613228	332975969	/nfs/dbraw/zinc/97/59/69/332975969.db2.gz	RDUQUECBWYDUPT-IGEOTXOUSA-N	1	0	294.373	4.294	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1ccc(C#N)cc1F)C1CCCCC1	ZINC000512625745	332976459	/nfs/dbraw/zinc/97/64/59/332976459.db2.gz	QDSTZJGEPVLRDP-OLZOCXBDSA-N	1	0	274.383	4.317	20	30		CIEDRO
C=CCCCC[NH2+]Cc1ccc(Sc2ccccn2)o1	ZINC000512630533	332976701	/nfs/dbraw/zinc/97/67/01/332976701.db2.gz	ZBBXXXKCGWRTPG-UHFFFAOYSA-N	1	0	288.416	4.272	20	30		CIEDRO
Cc1cc(C)cc(CC[NH2+][C@@H](C)c2ccc(C#N)cc2F)c1	ZINC000512667916	332979119	/nfs/dbraw/zinc/97/91/19/332979119.db2.gz	RYUIGBIWPDTORK-HNNXBMFYSA-N	1	0	296.389	4.208	20	30		CIEDRO
COc1cccc([C@H](C)[NH2+][C@@H](C)c2ccc(C#N)cc2F)c1	ZINC000512668302	332979183	/nfs/dbraw/zinc/97/91/83/332979183.db2.gz	ULAWYHADKUFLHM-STQMWFEESA-N	1	0	298.361	4.118	20	30		CIEDRO
CC[C@@H](Cc1ccccc1)[NH2+][C@H](C)c1ccc(C#N)cc1F	ZINC000512669132	332979300	/nfs/dbraw/zinc/97/93/00/332979300.db2.gz	YRWSKYVDCMBENQ-PBHICJAKSA-N	1	0	296.389	4.369	20	30		CIEDRO
CC[C@H](Cc1ccccc1)[NH2+][C@@H](C)c1ccc(C#N)cc1F	ZINC000512669134	332979347	/nfs/dbraw/zinc/97/93/47/332979347.db2.gz	YRWSKYVDCMBENQ-WMLDXEAASA-N	1	0	296.389	4.369	20	30		CIEDRO
N#Cc1ccc(C[NH2+]CC2(c3ccccc3)CCCC2)cc1	ZINC000512833095	332988491	/nfs/dbraw/zinc/98/84/91/332988491.db2.gz	KEOQYOLKWIGRDD-UHFFFAOYSA-N	1	0	290.410	4.160	20	30		CIEDRO
C[C@H]([NH2+]C[C@@H]1C[C@@H]1c1ccccc1)c1ccc(C#N)cc1	ZINC000174077218	332990418	/nfs/dbraw/zinc/99/04/18/332990418.db2.gz	QNZIVAMNLQPIFA-ZOCIIQOWSA-N	1	0	276.383	4.013	20	30		CIEDRO
C[C@H]1C[C@H](c2ccccc2)[N@H+](CCC(C)(C)C#N)C1	ZINC000513272021	333011718	/nfs/dbraw/zinc/01/17/18/333011718.db2.gz	PHGLIJIKGVLTCL-GOEBONIOSA-N	1	0	256.393	4.009	20	30		CIEDRO
C[C@H]1C[C@@H](c2ccccc2)[N@H+](CCC(C)(C)C#N)C1	ZINC000513272022	333011899	/nfs/dbraw/zinc/01/18/99/333011899.db2.gz	PHGLIJIKGVLTCL-HOCLYGCPSA-N	1	0	256.393	4.009	20	30		CIEDRO
C[C@H]1C[C@H]([NH2+]Cc2ccc(C#N)c(F)c2)c2ccccc21	ZINC000404577441	333015383	/nfs/dbraw/zinc/01/53/83/333015383.db2.gz	SFLGEMLFFQNQEG-SGTLLEGYSA-N	1	0	280.346	4.035	20	30		CIEDRO
C=C1CC[NH+](Cc2ccc(Oc3cccnc3)c(C)c2)CC1	ZINC000513448075	333019913	/nfs/dbraw/zinc/01/99/13/333019913.db2.gz	QVCZUJYCJSQBCU-UHFFFAOYSA-N	1	0	294.398	4.334	20	30		CIEDRO
C=C1CC[NH+](Cc2ccc(OC)c3ccccc23)CC1	ZINC000513466483	333021603	/nfs/dbraw/zinc/02/16/03/333021603.db2.gz	GIULRRLDSYCVGD-UHFFFAOYSA-N	1	0	267.372	4.000	20	30		CIEDRO
C=C1CCN(Cc2c(Cl)oc3ccccc32)CC1	ZINC000513489078	333022447	/nfs/dbraw/zinc/02/24/47/333022447.db2.gz	FIDTZNZNAJLPFW-UHFFFAOYSA-N	1	0	261.752	4.238	20	30		CIEDRO
C/C(=C/c1ccc(Cl)cc1)C[NH2+]CCCCC#N	ZINC000513519367	333023726	/nfs/dbraw/zinc/02/37/26/333023726.db2.gz	QBYCUXFTHSXOIF-QBFSEMIESA-N	1	0	262.784	4.027	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(C#N)c(F)c1)c1cccc(C)c1	ZINC000404759124	333025466	/nfs/dbraw/zinc/02/54/66/333025466.db2.gz	MRRPTAVTESQGLI-SFHVURJKSA-N	1	0	282.362	4.247	20	30		CIEDRO
CC(C)(CCC#N)C[N@@H+]1CCC[C@@H](Cc2ccccc2)C1	ZINC000513655926	333029636	/nfs/dbraw/zinc/02/96/36/333029636.db2.gz	PASHWFHTJXTWQN-SFHVURJKSA-N	1	0	284.447	4.271	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@@H](OC)c1ccccc1)c1ccco1	ZINC000513661463	333030344	/nfs/dbraw/zinc/03/03/44/333030344.db2.gz	OUUYGCIIOBVKDW-SJLPKXTDSA-N	1	0	285.387	4.264	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H](c2ccc(F)cc2)C2CC2)cc1F	ZINC000404862575	333030759	/nfs/dbraw/zinc/03/07/59/333030759.db2.gz	XICUWEBPGUZAGD-GOSISDBHSA-N	1	0	298.336	4.077	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccccc1OCC)c1ccco1	ZINC000513691123	333032674	/nfs/dbraw/zinc/03/26/74/333032674.db2.gz	RJEBJVMNNPHLCR-INIZCTEOSA-N	1	0	285.387	4.475	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccccc1OCC)c1ccco1	ZINC000513691124	333032741	/nfs/dbraw/zinc/03/27/41/333032741.db2.gz	RJEBJVMNNPHLCR-MRXNPFEDSA-N	1	0	285.387	4.475	20	30		CIEDRO
CC(C)(C)C[N@H+](CCC#N)C[C@H]1C[C@H]1c1ccccc1	ZINC000513717699	333035258	/nfs/dbraw/zinc/03/52/58/333035258.db2.gz	QTNWXPXLRFVCTG-SJORKVTESA-N	1	0	270.420	4.052	20	30		CIEDRO
CCC(CC)C[N@H+](CCC#N)Cc1cccc2[nH]ccc21	ZINC000513737199	333036790	/nfs/dbraw/zinc/03/67/90/333036790.db2.gz	WTPOYEAXBRMZPC-UHFFFAOYSA-N	1	0	283.419	4.320	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1cccc(F)c1)c1ccco1	ZINC000513762672	333037859	/nfs/dbraw/zinc/03/78/59/333037859.db2.gz	SBGXMRXTFKCOIS-HNNXBMFYSA-N	1	0	259.324	4.216	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CCCCC23CCCC3)s1	ZINC000311946292	333074924	/nfs/dbraw/zinc/07/49/24/333074924.db2.gz	KLOUWULQSQGOBF-OAHLLOKOSA-N	1	0	274.433	4.212	20	30		CIEDRO
CC[C@@H](CSc1ccc(Cl)cc1)[NH2+]CCCCC#N	ZINC000178648986	333076329	/nfs/dbraw/zinc/07/63/29/333076329.db2.gz	XNFYQCWQZYJHQO-AWEZNQCLSA-N	1	0	296.867	4.494	20	30		CIEDRO
CCC[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(C#N)cc1	ZINC000517549673	333102173	/nfs/dbraw/zinc/10/21/73/333102173.db2.gz	BZEHPZVUWKKITN-IRXDYDNUSA-N	1	0	256.393	4.007	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H](CC)c1ccc(OC)c(OC)c1	ZINC000336849018	335121117	/nfs/dbraw/zinc/12/11/17/335121117.db2.gz	OWNGTSYMFMWCAE-HNNXBMFYSA-N	1	0	291.435	4.347	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H](CC)c1ccc(OC)c(OC)c1	ZINC000336849019	335121132	/nfs/dbraw/zinc/12/11/32/335121132.db2.gz	OWNGTSYMFMWCAE-OAHLLOKOSA-N	1	0	291.435	4.347	20	30		CIEDRO
C=CC[N@H+](Cc1ccc(F)cc1)Cc1ccc(OC)cc1	ZINC000520845204	333105953	/nfs/dbraw/zinc/10/59/53/333105953.db2.gz	QDAQSJXVASDCSI-UHFFFAOYSA-N	1	0	285.362	4.023	20	30		CIEDRO
C=CCOc1cccc(C[NH2+]C[C@@H]2CCc3ccccc32)c1	ZINC000517713001	333106454	/nfs/dbraw/zinc/10/64/54/333106454.db2.gz	DIAJPNLIRNUNFN-SFHVURJKSA-N	1	0	293.410	4.071	20	30		CIEDRO
C[C@@H]1CCCc2ccccc2[C@H]1[NH2+]Cc1ccc(C#N)s1	ZINC000185086298	333135356	/nfs/dbraw/zinc/13/53/56/333135356.db2.gz	ZLHPWFZJQWVDML-ACJLOTCBSA-N	1	0	296.439	4.423	20	30		CIEDRO
C=C(C)C[C@H](C)C(=O)Nc1cccc(Oc2ccncc2)c1	ZINC000185536784	333143115	/nfs/dbraw/zinc/14/31/15/333143115.db2.gz	FHLAWHCNTNVTGU-AWEZNQCLSA-N	1	0	296.370	4.415	20	30		CIEDRO
CC#CCCCC(=O)Nc1cccc(Oc2ccncc2)c1	ZINC000185536855	333143125	/nfs/dbraw/zinc/14/31/25/333143125.db2.gz	CUOPZDJCDVOKFO-UHFFFAOYSA-N	1	0	294.354	4.006	20	30		CIEDRO
COc1ccc2cc(C[NH2+][C@H]3CCC[C@H](C#N)C3)ccc2c1	ZINC000185765908	333148340	/nfs/dbraw/zinc/14/83/40/333148340.db2.gz	WNGTYTOBRPICMQ-KSSFIOAISA-N	1	0	294.398	4.020	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)c1ccc(Cl)cc1	ZINC000185772068	333148450	/nfs/dbraw/zinc/14/84/50/333148450.db2.gz	VFIIFPBNKWBCEB-MAZHCROVSA-N	1	0	276.811	4.463	20	30		CIEDRO
CC(C)[C@H](C[NH2+][C@@H]1CCC[C@H](C#N)C1)c1ccccc1	ZINC000185771326	333148480	/nfs/dbraw/zinc/14/84/80/333148480.db2.gz	UZAJRQHENOKDBR-JQHSSLGASA-N	1	0	270.420	4.098	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+]Cc1ncc(-c2ccccc2)cn1	ZINC000186054921	333154328	/nfs/dbraw/zinc/15/43/28/333154328.db2.gz	QXKZOQHIKLLDBW-SFHVURJKSA-N	1	0	295.430	4.368	20	30		CIEDRO
C[C@H](CCC1CC1)[NH2+][C@@H](CCC#N)c1ccccc1	ZINC000186427888	333160641	/nfs/dbraw/zinc/16/06/41/333160641.db2.gz	RHGICBAOJPHWDR-PBHICJAKSA-N	1	0	256.393	4.200	20	30		CIEDRO
C=C(C)[C@@H]([NH2+][C@@H]1CCCSC1)c1ccc(F)c(F)c1	ZINC000186453562	333161312	/nfs/dbraw/zinc/16/13/12/333161312.db2.gz	OYEQYSNKVSTZMH-IUODEOHRSA-N	1	0	283.387	4.067	20	30		CIEDRO
C=C1CC[NH+]([C@@H](C)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000521741591	333186469	/nfs/dbraw/zinc/18/64/69/333186469.db2.gz	FFXRWDOWFDTYJL-LBPRGKRZSA-N	1	0	285.309	4.298	20	30		CIEDRO
C=CC[N@H+](Cc1cccc(C(F)(F)F)c1)C(C)C	ZINC000521820611	333190090	/nfs/dbraw/zinc/19/00/90/333190090.db2.gz	MWMMVSCTUMFZGU-UHFFFAOYSA-N	1	0	257.299	4.102	20	30		CIEDRO
C=C(C)C[C@@H](C)C(=O)Nc1ccc(C[NH+](CC)CC)cc1	ZINC000190582295	333208451	/nfs/dbraw/zinc/20/84/51/333208451.db2.gz	CGJQBSFCUWNWJX-OAHLLOKOSA-N	1	0	288.435	4.069	20	30		CIEDRO
C[C@@H]1C[C@H](C)[N@H+](Cc2ccc(-c3ccccc3C#N)cc2)C1	ZINC000521945076	333224935	/nfs/dbraw/zinc/22/49/35/333224935.db2.gz	CCKJXYUQDRZSPL-CVEARBPZSA-N	1	0	290.410	4.456	20	30		CIEDRO
C[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1ccc(C#N)c(F)c1	ZINC000191856074	333226484	/nfs/dbraw/zinc/22/64/84/333226484.db2.gz	NMNXSMKQUGNQNJ-LBPRGKRZSA-N	1	0	286.325	4.029	20	30		CIEDRO
Cc1cc(C)cc([C@@H](C)[NH2+]Cc2ccc(C#N)c(F)c2)c1	ZINC000192156937	333231114	/nfs/dbraw/zinc/23/11/14/333231114.db2.gz	SKPUCBSJTAHCTA-CQSZACIVSA-N	1	0	282.362	4.165	20	30		CIEDRO
C=CCCCCC[N@H+](CCc1nccs1)C(C)C	ZINC000193448583	333250084	/nfs/dbraw/zinc/25/00/84/333250084.db2.gz	YPAXXORQOZKBMR-UHFFFAOYSA-N	1	0	266.454	4.142	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@@H]1CCC[C@@H](SC)C1	ZINC000227377120	333282174	/nfs/dbraw/zinc/28/21/74/333282174.db2.gz	GUFOMZZEYDDTIH-HZPDHXFCSA-N	1	0	291.460	4.015	20	30		CIEDRO
CC[N@H+](C[C@@H](C)C#N)[C@@H](C)c1cccc2ccccc21	ZINC000522943786	333300757	/nfs/dbraw/zinc/30/07/57/333300757.db2.gz	AYVZHVVEJXZCLB-GJZGRUSLSA-N	1	0	266.388	4.382	20	30		CIEDRO
C=CCCC[N@@H+](C)Cc1ccccc1Oc1cccnc1	ZINC000523009740	333304310	/nfs/dbraw/zinc/30/43/10/333304310.db2.gz	IQNYHOVZODBWHT-UHFFFAOYSA-N	1	0	282.387	4.272	20	30		CIEDRO
C[C@@H]([NH2+]CC(C)(C)CCC#N)c1cccc(OC(F)F)c1	ZINC000229675430	333307524	/nfs/dbraw/zinc/30/75/24/333307524.db2.gz	ISDXZMORAHUTKA-GFCCVEGCSA-N	1	0	296.361	4.269	20	30		CIEDRO
CC(C)[C@@H]([NH2+]CC(C)(C)CCC#N)c1ccccc1	ZINC000229677836	333307659	/nfs/dbraw/zinc/30/76/59/333307659.db2.gz	AIKXDCXTLUKSQV-MRXNPFEDSA-N	1	0	258.409	4.303	20	30		CIEDRO
Cc1ccc(C)c([C@@H](C)[NH2+]CC(C)(C)CCC#N)c1	ZINC000229686024	333307708	/nfs/dbraw/zinc/30/77/08/333307708.db2.gz	JXRJFLVZVMGSED-OAHLLOKOSA-N	1	0	258.409	4.284	20	30		CIEDRO
CC[C@H]([NH2+]CC(C)(C)CCC#N)c1ccccc1OC	ZINC000229679618	333307731	/nfs/dbraw/zinc/30/77/31/333307731.db2.gz	UIYXUUFYFYLBHP-HNNXBMFYSA-N	1	0	274.408	4.066	20	30		CIEDRO
CC[C@@H]([NH2+]CC(C)(C)CCC#N)C1CCCCC1	ZINC000229694763	333307925	/nfs/dbraw/zinc/30/79/25/333307925.db2.gz	MPOOQTRIUCPBQL-OAHLLOKOSA-N	1	0	250.430	4.265	20	30		CIEDRO
CC[C@H]([NH2+]CC(C)(C)CCC#N)c1ccc(OC)cc1	ZINC000229683108	333307825	/nfs/dbraw/zinc/30/78/25/333307825.db2.gz	MHBYXICFNAUIEK-INIZCTEOSA-N	1	0	274.408	4.066	20	30		CIEDRO
CC(C)C[N@H+](Cc1ccc(F)c(C#N)c1)C1CCCC1	ZINC000229749523	333309121	/nfs/dbraw/zinc/30/91/21/333309121.db2.gz	AVKOTMFLXAXRSL-UHFFFAOYSA-N	1	0	274.383	4.098	20	30		CIEDRO
C=CCCOCC[NH2+][C@@H](C)c1ccc(Cl)cc1Cl	ZINC000229860257	333310334	/nfs/dbraw/zinc/31/03/34/333310334.db2.gz	WKPUKTGGZJYOII-NSHDSACASA-N	1	0	288.218	4.237	20	30		CIEDRO
C[C@@H](CCC1CCCCC1)[NH2+]Cc1cccc(C#N)c1	ZINC000523734861	333342838	/nfs/dbraw/zinc/34/28/38/333342838.db2.gz	MQFZYWYLPFDSIM-HNNXBMFYSA-N	1	0	270.420	4.397	20	30		CIEDRO
C=CC[C@H](C)[NH2+]Cc1ccc(-c2c(F)cccc2F)o1	ZINC000523975538	333350577	/nfs/dbraw/zinc/35/05/77/333350577.db2.gz	BAHJNUJUQRCWKW-NSHDSACASA-N	1	0	277.314	4.279	20	30		CIEDRO
C[C@@H]1CC[C@H]([NH2+]CCCCC(C)(C)C#N)[C@@H](C)C1	ZINC000235277993	333367039	/nfs/dbraw/zinc/36/70/39/333367039.db2.gz	FWOJUAKYWYYMPH-ILXRZTDVSA-N	1	0	250.430	4.121	20	30		CIEDRO
C=CC[C@@H](C)[NH2+]Cc1ccc(Br)c(Cl)c1	ZINC000235421854	333369436	/nfs/dbraw/zinc/36/94/36/333369436.db2.gz	JJDFTSWTTZGZLU-SECBINFHSA-N	1	0	288.616	4.157	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC(C)(C)C[C@@H]1C)c1ccc(C#N)cc1	ZINC000235580752	333370861	/nfs/dbraw/zinc/37/08/61/333370861.db2.gz	ZJXSONUVZUQYEF-HEHGZKQESA-N	1	0	256.393	4.034	20	30		CIEDRO
CC[C@@H](C)[NH2+]Cc1cccc(OCc2ccccc2C#N)c1	ZINC000236900574	333376179	/nfs/dbraw/zinc/37/61/79/333376179.db2.gz	ZRFGPYYEYALJAH-OAHLLOKOSA-N	1	0	294.398	4.025	20	30		CIEDRO
CCC[C@H](Cc1ccccc1)[NH2+]Cc1ccc(C#N)cc1	ZINC000237032924	333377386	/nfs/dbraw/zinc/37/73/86/333377386.db2.gz	RJDRZGZOZVQJQJ-LJQANCHMSA-N	1	0	278.399	4.059	20	30		CIEDRO
C[C@H]([NH2+]C[C@H]1CCCc2ccccc21)c1ccc(C#N)cc1	ZINC000315874116	333384208	/nfs/dbraw/zinc/38/42/08/333384208.db2.gz	PYLJFIIQQVUNNH-HNAYVOBHSA-N	1	0	290.410	4.329	20	30		CIEDRO
CCc1ccc(CC[N@H+](CCC#N)CC(C)(C)C)cc1	ZINC000524811143	333389040	/nfs/dbraw/zinc/38/90/40/333389040.db2.gz	AUEBMVWHGZBPDC-UHFFFAOYSA-N	1	0	272.436	4.053	20	30		CIEDRO
C=C(C[NH2+][C@H](C)c1ccc(OC)c(OC)c1)c1ccccc1	ZINC000316417860	333392351	/nfs/dbraw/zinc/39/23/51/333392351.db2.gz	BSUHBXYFBUBDPB-OAHLLOKOSA-N	1	0	297.398	4.068	20	30		CIEDRO
C=CCC1([NH2+]Cc2ncccc2Cl)CCCCC1	ZINC000528701228	333452929	/nfs/dbraw/zinc/45/29/29/333452929.db2.gz	CXKNOMPWULBKJJ-UHFFFAOYSA-N	1	0	264.800	4.104	20	30		CIEDRO
C[C@H](CC[NH2+][C@H](C)c1cccc(C#N)c1)c1ccccc1	ZINC000061910089	333477476	/nfs/dbraw/zinc/47/74/76/333477476.db2.gz	IHMPOGNJSSKAOG-HZPDHXFCSA-N	1	0	278.399	4.403	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1cccc(C#N)c1)c1ccc(F)cc1F	ZINC000037277335	333529783	/nfs/dbraw/zinc/52/97/83/333529783.db2.gz	PUSMVJYJSLBEAT-NWDGAFQWSA-N	1	0	286.325	4.248	20	30		CIEDRO
CC[C@@H]1CCCC[C@@H]1[NH2+][C@@H](C)c1cccc(C#N)c1	ZINC000037294794	333531325	/nfs/dbraw/zinc/53/13/25/333531325.db2.gz	BCLJUCMFAYYXDD-LXZKKBNFSA-N	1	0	256.393	4.178	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)c1ccccc1Br	ZINC000124110726	333556072	/nfs/dbraw/zinc/55/60/72/333556072.db2.gz	MQUHRVJBLJUDJJ-QWRGUYRKSA-N	1	0	268.198	4.064	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H]2CCC[C@@H]2c2ccccc2)s1	ZINC000538403601	333589002	/nfs/dbraw/zinc/58/90/02/333589002.db2.gz	MYXHFLUMQAXHLV-SJORKVTESA-N	1	0	282.412	4.046	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccccc1Cl)c1ccc(C#N)c(F)c1	ZINC000538502187	333600509	/nfs/dbraw/zinc/60/05/09/333600509.db2.gz	BMPJHTKZTXQXOW-NSHDSACASA-N	1	0	288.753	4.202	20	30		CIEDRO
C[C@@H]([NH2+]CCC1=CCCCC1)c1ccc(C#N)c(F)c1	ZINC000538502709	333600762	/nfs/dbraw/zinc/60/07/62/333600762.db2.gz	HNEFIQLICGRXPT-CYBMUJFWSA-N	1	0	272.367	4.238	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+]Cc1cc(Br)ccc1F	ZINC000126744255	333604196	/nfs/dbraw/zinc/60/41/96/333604196.db2.gz	ZXXCGOKGLJAGCM-SNVBAGLBSA-N	1	0	286.188	4.033	20	30		CIEDRO
C=CCCOCC[NH2+][C@@H](CC(C)C)c1cccs1	ZINC000539052740	333652056	/nfs/dbraw/zinc/65/20/56/333652056.db2.gz	LMKALTLMJXPDDL-AWEZNQCLSA-N	1	0	267.438	4.018	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)c1ccc(OCC(F)(F)F)cc1	ZINC000539072526	333655128	/nfs/dbraw/zinc/65/51/28/333655128.db2.gz	CKRKFPPQLQNFIN-NWDGAFQWSA-N	1	0	287.325	4.243	20	30		CIEDRO
C=CCC[NH2+][C@H](COc1ccccc1F)c1ccccc1	ZINC000539265678	333663562	/nfs/dbraw/zinc/66/35/62/333663562.db2.gz	JUCHFTVFNIKEHD-QGZVFWFLSA-N	1	0	285.362	4.112	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@@H](C)c1cc(OC)c(OC)cc1C	ZINC000539288775	333664093	/nfs/dbraw/zinc/66/40/93/333664093.db2.gz	FEICXRHTQXOSAB-CABCVRRESA-N	1	0	291.435	4.408	20	30		CIEDRO
CC(C)[C@H]1CCC[C@@H]([NH2+]CC(C)(C)CCC#N)C1	ZINC000174347943	335153274	/nfs/dbraw/zinc/15/32/74/335153274.db2.gz	UTPJCXICQGFFGT-LSDHHAIUSA-N	1	0	250.430	4.121	20	30		CIEDRO
CC(C)[C@@H]1CCC[C@@H]([NH2+]CC(C)(C)CCC#N)C1	ZINC000174347927	335153319	/nfs/dbraw/zinc/15/33/19/335153319.db2.gz	UTPJCXICQGFFGT-HUUCEWRRSA-N	1	0	250.430	4.121	20	30		CIEDRO
CC(C)(C)[C@@H](CC1CCCCC1)[NH2+]CCCC#N	ZINC000539493209	333673426	/nfs/dbraw/zinc/67/34/26/333673426.db2.gz	ISTOXBFMJQMRKH-OAHLLOKOSA-N	1	0	250.430	4.265	20	30		CIEDRO
CC(C)CC(CC(C)C)[NH2+]Cc1ccc(C#N)s1	ZINC000539494918	333673958	/nfs/dbraw/zinc/67/39/58/333673958.db2.gz	VHLQDQUUZGMTSA-UHFFFAOYSA-N	1	0	264.438	4.170	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1cccc(C#N)c1)[C@@H](C)c1ccccc1	ZINC000539495082	333674200	/nfs/dbraw/zinc/67/42/00/333674200.db2.gz	CUTIYDHGMBGTBL-OAGGEKHMSA-N	1	0	278.399	4.401	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCCCC1(C)C)c1ccc(C#N)c(F)c1	ZINC000539610271	333681026	/nfs/dbraw/zinc/68/10/26/333681026.db2.gz	SZGOUHUQFAPOGZ-BLLLJJGKSA-N	1	0	274.383	4.317	20	30		CIEDRO
C[C@@]1([NH2+]Cc2cccc(C#N)c2F)CCCc2ccccc21	ZINC000539807699	333691541	/nfs/dbraw/zinc/69/15/41/333691541.db2.gz	AIWSUSAEBLKGOS-LJQANCHMSA-N	1	0	294.373	4.039	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)c1cccc(Br)c1	ZINC000128680563	333698220	/nfs/dbraw/zinc/69/82/20/333698220.db2.gz	GKXQALNXLJTMCX-WDEREUQCSA-N	1	0	268.198	4.064	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+]Cc1ccnc(SC)c1	ZINC000540137567	333711444	/nfs/dbraw/zinc/71/14/44/333711444.db2.gz	GTOSHWNVOQKBKX-AWEZNQCLSA-N	1	0	264.438	4.028	20	30		CIEDRO
CCC[C@@H](CCc1ccccc1)[NH2+]Cc1ccc(C#N)o1	ZINC000174462218	335156000	/nfs/dbraw/zinc/15/60/00/335156000.db2.gz	QCHMEPJBGIPYLT-INIZCTEOSA-N	1	0	282.387	4.042	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](C)c1cc(OC)c(OC)cc1F	ZINC000540397903	333728447	/nfs/dbraw/zinc/72/84/47/333728447.db2.gz	XTWBVDXMMIANJX-STQMWFEESA-N	1	0	295.398	4.238	20	30		CIEDRO
CCCC[C@H]1CCC[C@@H]1[NH2+]Cc1ccc(C#N)s1	ZINC000540601681	333737417	/nfs/dbraw/zinc/73/74/17/333737417.db2.gz	ALAOYZDIEIMYKZ-WFASDCNBSA-N	1	0	262.422	4.068	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2)s1	ZINC000540616073	333738364	/nfs/dbraw/zinc/73/83/64/333738364.db2.gz	ZEWKBNWTUILJTF-CRAIPNDOSA-N	1	0	296.439	4.121	20	30		CIEDRO
Cc1ccccc1C[C@@H](C)[NH2+][C@@H](C)c1ccc(C#N)c(F)c1	ZINC000540707791	333742720	/nfs/dbraw/zinc/74/27/20/333742720.db2.gz	OBTYECGMXNNQQJ-CABCVRRESA-N	1	0	296.389	4.288	20	30		CIEDRO
C[C@H]([NH2+]C1[C@@H](C)CCC[C@@H]1C)c1cccc(C#N)c1	ZINC000540766842	333746369	/nfs/dbraw/zinc/74/63/69/333746369.db2.gz	XTVMBBUOERYGQI-IHRRRGAJSA-N	1	0	256.393	4.034	20	30		CIEDRO
Cc1c(C)c(C)c(C[NH+]2CCC(CC#N)CC2)c(C)c1C	ZINC000541021859	333759486	/nfs/dbraw/zinc/75/94/86/333759486.db2.gz	SPJCYRQIGAIPLQ-UHFFFAOYSA-N	1	0	284.447	4.354	20	30		CIEDRO
CC1(C)C[C@H]([NH2+]Cc2ccc(C#N)s2)c2ccccc21	ZINC000129458036	333765777	/nfs/dbraw/zinc/76/57/77/333765777.db2.gz	PQWVAQPYLQHXPF-INIZCTEOSA-N	1	0	282.412	4.132	20	30		CIEDRO
Cc1ccc(C)c([C@H]([NH2+]CCCC#N)c2ccccc2)c1	ZINC000541570834	333781244	/nfs/dbraw/zinc/78/12/44/333781244.db2.gz	ZIDUEHMKNUEMMA-LJQANCHMSA-N	1	0	278.399	4.286	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)c1ccc(F)cc1Br	ZINC000129634118	333784180	/nfs/dbraw/zinc/78/41/80/333784180.db2.gz	JGTWAFJGWZNNGG-UWVGGRQHSA-N	1	0	286.188	4.203	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](C)c1ccc(F)cc1Br	ZINC000129634784	333784404	/nfs/dbraw/zinc/78/44/04/333784404.db2.gz	JGTWAFJGWZNNGG-NXEZZACHSA-N	1	0	286.188	4.203	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](CC)c1nc(C)cs1	ZINC000541626477	333784790	/nfs/dbraw/zinc/78/47/90/333784790.db2.gz	YZRGHTMAUWSPNN-AAEUAGOBSA-N	1	0	252.427	4.237	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+]C(C)(C)c1ncc(C)s1	ZINC000542580239	333832978	/nfs/dbraw/zinc/83/29/78/333832978.db2.gz	KLMURIKKWBVMPX-LLVKDONJSA-N	1	0	252.427	4.021	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+][C@H]1CCc2[nH]c3ccc(C)cc3c2C1	ZINC000542679092	333836212	/nfs/dbraw/zinc/83/62/12/333836212.db2.gz	HYOWODULCPWPLG-CABCVRRESA-N	1	0	282.431	4.278	20	30		CIEDRO
C[C@@H]([NH2+]CCCc1cccs1)c1ccc(C#N)cc1F	ZINC000542834417	333844324	/nfs/dbraw/zinc/84/43/24/333844324.db2.gz	FWKQGFFTEIABGP-GFCCVEGCSA-N	1	0	288.391	4.042	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]CCCCC1CCCC1	ZINC000174644835	335161954	/nfs/dbraw/zinc/16/19/54/335161954.db2.gz	HDEVEIBYNLAVEY-UHFFFAOYSA-N	1	0	250.430	4.266	20	30		CIEDRO
C=CCOc1cccc(C[NH2+]C2(c3ccccc3F)CC2)c1	ZINC000130549198	333851860	/nfs/dbraw/zinc/85/18/60/333851860.db2.gz	NNPNKBHOJBANEP-UHFFFAOYSA-N	1	0	297.373	4.169	20	30		CIEDRO
C=CCCC[C@H](C)[NH+]1CCC(CCCn2ccnc2)CC1	ZINC000543060624	333854645	/nfs/dbraw/zinc/85/46/45/333854645.db2.gz	LSLMSOXKHSODMU-KRWDZBQOSA-N	1	0	289.467	4.120	20	30		CIEDRO
CS[C@@H](C[NH2+][C@@H](C)c1ccc(C#N)cc1F)C(C)(C)C	ZINC000543426348	333873964	/nfs/dbraw/zinc/87/39/64/333873964.db2.gz	PRUHRHZVNVZRFG-NHYWBVRUSA-N	1	0	294.439	4.126	20	30		CIEDRO
CC(C)(C#N)CCC[NH2+][C@H](c1cccs1)C1CC1	ZINC000543439637	333874868	/nfs/dbraw/zinc/87/48/68/333874868.db2.gz	PVYPHXLMXCZHCX-AWEZNQCLSA-N	1	0	262.422	4.119	20	30		CIEDRO
N#CCC1CC[NH+](Cc2ccccc2OC2CCCC2)CC1	ZINC000543782491	333898358	/nfs/dbraw/zinc/89/83/58/333898358.db2.gz	ZJIFEBISGXHVRV-UHFFFAOYSA-N	1	0	298.430	4.134	20	30		CIEDRO
C[C@H](c1ccccc1Cl)[NH+]1CCC(CC#N)CC1	ZINC000543809518	333901348	/nfs/dbraw/zinc/90/13/48/333901348.db2.gz	QYCAAWVPQKCULJ-GFCCVEGCSA-N	1	0	262.784	4.027	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+]CC1(c2ccccc2OC)CCC1	ZINC000544897194	333951337	/nfs/dbraw/zinc/95/13/37/333951337.db2.gz	BCBXBPXZHVXGRV-OAHLLOKOSA-N	1	0	273.420	4.061	20	30		CIEDRO
CC[C@H](CC(F)(F)F)[NH2+][C@@H](C)c1ccc(C#N)cc1F	ZINC000545460710	333983157	/nfs/dbraw/zinc/98/31/57/333983157.db2.gz	RTHBWSGLHGLRPJ-GXSJLCMTSA-N	1	0	288.288	4.079	20	30		CIEDRO
CC[C@H](CC(F)(F)F)[NH2+][C@H](C)c1ccc(C#N)cc1F	ZINC000545460715	333983292	/nfs/dbraw/zinc/98/32/92/333983292.db2.gz	RTHBWSGLHGLRPJ-MWLCHTKSSA-N	1	0	288.288	4.079	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+][C@@H](c1cnn(C)c1)C(C)(C)C	ZINC000545905570	334005627	/nfs/dbraw/zinc/00/56/27/334005627.db2.gz	SQJPWYAQZPSEOQ-CVEARBPZSA-N	1	0	277.456	4.232	20	30		CIEDRO
Cc1cccc(C)c1[C@@H](C)[NH2+]Cc1cc(C#N)cs1	ZINC000546879417	334053490	/nfs/dbraw/zinc/05/34/90/334053490.db2.gz	RACHKCJHHKEMIR-CYBMUJFWSA-N	1	0	270.401	4.087	20	30		CIEDRO
CC[C@H](CC#N)[NH2+]Cc1cccc(-c2ccc(C)cc2)c1	ZINC000547284936	334076110	/nfs/dbraw/zinc/07/61/10/334076110.db2.gz	CYLDKCFTQTXLTD-LJQANCHMSA-N	1	0	278.399	4.444	20	30		CIEDRO
CC[C@H]([NH2+]Cc1cc(C#N)cs1)C(C)(C)c1ccccc1	ZINC000236924715	334077423	/nfs/dbraw/zinc/07/74/23/334077423.db2.gz	XFEMHBLRZFOPMF-KRWDZBQOSA-N	1	0	298.455	4.466	20	30		CIEDRO
N#Cc1cccc(C[N@@H+]2CCCC[C@H]2c2ccccc2)c1	ZINC000547398523	334085583	/nfs/dbraw/zinc/08/55/83/334085583.db2.gz	PJOBLYKAZYKLJU-IBGZPJMESA-N	1	0	276.383	4.285	20	30		CIEDRO
C=CCC[N@H+]1CCSC[C@H]1c1ccc(Cl)cc1	ZINC000547450534	334089645	/nfs/dbraw/zinc/08/96/45/334089645.db2.gz	XETOQLHTNQPIOH-AWEZNQCLSA-N	1	0	267.825	4.006	20	30		CIEDRO
N#Cc1csc(C[NH2+]CCCCCc2ccccc2)c1	ZINC000237841440	334100317	/nfs/dbraw/zinc/10/03/17/334100317.db2.gz	LLONRTRKCAGYMR-UHFFFAOYSA-N	1	0	284.428	4.122	20	30		CIEDRO
N#Cc1csc(C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2)c1	ZINC000237850131	334100535	/nfs/dbraw/zinc/10/05/35/334100535.db2.gz	OCPVBUVFTFTAIM-SJLPKXTDSA-N	1	0	296.439	4.121	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](C)c1ccc(OC(F)(F)F)cc1	ZINC000134732007	334102130	/nfs/dbraw/zinc/10/21/30/334102130.db2.gz	NKCKWWUZLILHMF-GHMZBOCLSA-N	1	0	273.298	4.200	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(CC#N)cc1)[C@@H]1C[C@H]1c1cccs1	ZINC000564329049	334111915	/nfs/dbraw/zinc/11/19/15/334111915.db2.gz	XOVSQPJJXOPZSK-XOKHGSTOSA-N	1	0	296.439	4.096	20	30		CIEDRO
CCc1ccc([C@H]([NH2+]Cc2ccc(C#N)o2)C(C)C)cc1	ZINC000135132888	334117015	/nfs/dbraw/zinc/11/70/15/334117015.db2.gz	RHPUUWWWWOMGPU-GOSISDBHSA-N	1	0	282.387	4.201	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H]1CCC[C@H](C(F)(F)F)C1	ZINC000135143319	334117575	/nfs/dbraw/zinc/11/75/75/334117575.db2.gz	OEVIEQZWOYZQHH-RYUDHWBXSA-N	1	0	276.346	4.027	20	30		CIEDRO
CCC(CC)[C@H]([NH2+]Cc1ccc(C#N)o1)c1ccccc1	ZINC000135159678	334118593	/nfs/dbraw/zinc/11/85/93/334118593.db2.gz	VSVGDFMNWNONFL-SFHVURJKSA-N	1	0	282.387	4.418	20	30		CIEDRO
Cc1ccc(C[N@@H+](C)Cc2ccccc2C(C)(C)C#N)s1	ZINC000135182475	334119233	/nfs/dbraw/zinc/11/92/33/334119233.db2.gz	ZSQLMYHXWNGDPB-UHFFFAOYSA-N	1	0	298.455	4.490	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)c1ccc2cc(OC)ccc2c1	ZINC000135365800	334127748	/nfs/dbraw/zinc/12/77/48/334127748.db2.gz	VXTYIMOTGUAPKM-KBPBESRZSA-N	1	0	269.388	4.464	20	30		CIEDRO
CC(C)(C#N)CC[NH2+][C@H]1CCCC[C@H]1c1ccccc1	ZINC000547883347	334128836	/nfs/dbraw/zinc/12/88/36/334128836.db2.gz	XCKGHPDKTPDTKR-IRXDYDNUSA-N	1	0	270.420	4.242	20	30		CIEDRO
Cc1ccc(C)c([C@H](C)[NH2+]Cc2ccc(C#N)s2)c1	ZINC000135668187	334135681	/nfs/dbraw/zinc/13/56/81/334135681.db2.gz	WHALVEVUEWSHCX-ZDUSSCGKSA-N	1	0	270.401	4.087	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C#N)s1)c1cc2ccccc2o1	ZINC000135671467	334135784	/nfs/dbraw/zinc/13/57/84/334135784.db2.gz	BLQILNRRSZSXQW-LLVKDONJSA-N	1	0	282.368	4.217	20	30		CIEDRO
C=C(C)C[N@H+](CCC(C)(C)C#N)Cc1ccccc1	ZINC000548098016	334139914	/nfs/dbraw/zinc/13/99/14/334139914.db2.gz	CCNMTXBYAZFMLF-UHFFFAOYSA-N	1	0	256.393	4.005	20	30		CIEDRO
CC[C@H](CC#N)[NH2+][C@@H](C)CCc1cccc(C(F)(F)F)c1	ZINC000136958808	334166050	/nfs/dbraw/zinc/16/60/50/334166050.db2.gz	BLNBRVJCRSOAMV-SWLSCSKDSA-N	1	0	298.352	4.308	20	30		CIEDRO
C[C@H](C1CCCCC1)[N@H+](C)CCCC(C)(C)C#N	ZINC000548930540	334180672	/nfs/dbraw/zinc/18/06/72/334180672.db2.gz	NRVDFGOHFZUBMH-CQSZACIVSA-N	1	0	250.430	4.217	20	30		CIEDRO
Cc1cccc(CCC[NH2+][C@H](C)c2ccc(C#N)cc2)c1	ZINC000548933406	334180765	/nfs/dbraw/zinc/18/07/65/334180765.db2.gz	STYAQXRBZVEVEZ-MRXNPFEDSA-N	1	0	278.399	4.150	20	30		CIEDRO
C[C@@H]1C[N@H+](CCCC(C)(C)C#N)CC[C@H]1c1ccccc1	ZINC000245408884	334190300	/nfs/dbraw/zinc/19/03/00/334190300.db2.gz	JNHJKEOTNSIVAH-SJLPKXTDSA-N	1	0	284.447	4.442	20	30		CIEDRO
C[C@H]([NH2+]CC1CC(c2ccccc2)C1)c1cccc(C#N)c1	ZINC000549625586	334200181	/nfs/dbraw/zinc/20/01/81/334200181.db2.gz	PQXBPJUNKBCRIJ-FVWXCPNNSA-N	1	0	290.410	4.403	20	30		CIEDRO
Cc1ccc2c(c1)[C@H]([NH2+][C@H](C)c1ccc(C#N)cc1)[C@@H](C)C2	ZINC000245722964	334215252	/nfs/dbraw/zinc/21/52/52/334215252.db2.gz	OZFFGGBSLIQMRT-BXTJHSDWSA-N	1	0	290.410	4.451	20	30		CIEDRO
Cc1ccccc1C(C)(C)[NH2+]Cc1ccc(F)c(C#N)c1	ZINC000550262698	334218083	/nfs/dbraw/zinc/21/80/83/334218083.db2.gz	OGQZFENXSLLFJO-UHFFFAOYSA-N	1	0	282.362	4.031	20	30		CIEDRO
CCS[C@@H]1CCC[C@@H]([NH2+][C@H](C)c2ccc(C#N)cc2)C1	ZINC000245883146	334222786	/nfs/dbraw/zinc/22/27/86/334222786.db2.gz	LFAOXWCLQMMEGO-KBRIMQKVSA-N	1	0	288.460	4.273	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@H]1CCCO[C@H]1c1ccccc1)C1CC1	ZINC000245925281	334224159	/nfs/dbraw/zinc/22/41/59/334224159.db2.gz	HPSVMZUUCIGJGT-AABGKKOBSA-N	1	0	299.458	4.489	20	30		CIEDRO
C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+]CCCCC#N)C1	ZINC000247040576	334274491	/nfs/dbraw/zinc/27/44/91/334274491.db2.gz	OBYNVGFHOGKIQC-JQHSSLGASA-N	1	0	270.420	4.242	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H](C)c1cnn(C2CCCC2)c1	ZINC000551242203	334242680	/nfs/dbraw/zinc/24/26/80/334242680.db2.gz	YBGDQZPRULGIKX-CQSZACIVSA-N	1	0	275.440	4.251	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@@H](C)[C@H]1C[C@@H]1c1ccc(OC)cc1	ZINC000551521119	334252330	/nfs/dbraw/zinc/25/23/30/334252330.db2.gz	YNIBMFNOPLBHGB-OXXUSNJHSA-N	1	0	273.420	4.132	20	30		CIEDRO
CC1(C)CC[C@@H]1[NH2+]C1CCC(Oc2ccccc2C#N)CC1	ZINC000551535551	334253385	/nfs/dbraw/zinc/25/33/85/334253385.db2.gz	ZAMADMMJAOHBEI-HTWSVDAQSA-N	1	0	298.430	4.026	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+]C1(c2cccc(C#N)c2)CC1	ZINC000551559818	334254296	/nfs/dbraw/zinc/25/42/96/334254296.db2.gz	VQYUECIZQBTBGP-QGZVFWFLSA-N	1	0	268.404	4.272	20	30		CIEDRO
C=CCC[C@H](O)C[N@@H+]1CCCC[C@H]1c1cc2ccccc2[nH]1	ZINC000246559978	334264348	/nfs/dbraw/zinc/26/43/48/334264348.db2.gz	AFUBFHRLYCZOJT-LPHOPBHVSA-N	1	0	298.430	4.022	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@H](CC)c1cccc(C)c1	ZINC000552057115	334282433	/nfs/dbraw/zinc/28/24/33/334282433.db2.gz	GEBAQIMZMNAFNH-KURKYZTESA-N	1	0	273.420	4.017	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+][C@@H](CC)c1cccc(C)c1	ZINC000552057113	334282456	/nfs/dbraw/zinc/28/24/56/334282456.db2.gz	GEBAQIMZMNAFNH-BZSNNMDCSA-N	1	0	273.420	4.017	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@@H](C)c1ccc(OC)c(OC)c1C	ZINC000552055921	334282639	/nfs/dbraw/zinc/28/26/39/334282639.db2.gz	ILXJHIBKHZGELE-UONOGXRCSA-N	1	0	277.408	4.018	20	30		CIEDRO
C=CCC[C@H]([NH2+]CC(C)(C)N1CCCCC1)c1ccco1	ZINC000552225138	334305241	/nfs/dbraw/zinc/30/52/41/334305241.db2.gz	BQPZESCUTQIDHS-INIZCTEOSA-N	1	0	290.451	4.141	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCN(C)Cc1ccccc1)c1ccco1	ZINC000552251477	334308864	/nfs/dbraw/zinc/30/88/64/334308864.db2.gz	YUVYBBSEIFJYTD-GOSISDBHSA-N	1	0	298.430	4.009	20	30		CIEDRO
N#Cc1ccc(C[N@@H+]2CCC[C@H](c3ccccc3)C2)c(F)c1	ZINC000552274505	334311260	/nfs/dbraw/zinc/31/12/60/334311260.db2.gz	XRHFMZRLENLPOY-KRWDZBQOSA-N	1	0	294.373	4.077	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCC[C@H]1CCCC[C@H]1O)c1ccco1	ZINC000552276113	334311731	/nfs/dbraw/zinc/31/17/31/334311731.db2.gz	LCRYOKRXNVINDY-IXDOHACOSA-N	1	0	291.435	4.208	20	30		CIEDRO
CC[C@H]([NH2+]CC1CCC(C#N)CC1)c1cccc(C)c1	ZINC000552277553	334312033	/nfs/dbraw/zinc/31/20/33/334312033.db2.gz	YBPJETKEKIOKSM-HTWSVDAQSA-N	1	0	270.420	4.366	20	30		CIEDRO
CC(C)Oc1ccc([C@H](C)[NH2+][C@H]2CCC[C@@H](C#N)C2)cc1	ZINC000248700448	334314006	/nfs/dbraw/zinc/31/40/06/334314006.db2.gz	AEAQAUZHJQHKCW-UXLLHSPISA-N	1	0	286.419	4.207	20	30		CIEDRO
C[N@H+](CC(c1ccccc1)c1ccccc1)CC(C)(C)C#N	ZINC000552316995	334316324	/nfs/dbraw/zinc/31/63/24/334316324.db2.gz	XPMBXINAUQTCQS-UHFFFAOYSA-N	1	0	292.426	4.300	20	30		CIEDRO
COc1ccc([C@H]([NH2+][C@H]2CCC[C@@H](C#N)C2)C(C)C)cc1	ZINC000248801250	334317815	/nfs/dbraw/zinc/31/78/15/334317815.db2.gz	JRQJSRSSZGACGE-UWWQBHOKSA-N	1	0	286.419	4.064	20	30		CIEDRO
CC(C)Oc1cccc([C@H](C)[NH2+][C@@H]2CCC[C@@H](C#N)C2)c1	ZINC000248923805	334322177	/nfs/dbraw/zinc/32/21/77/334322177.db2.gz	WXIOKJFLQSYHQI-ZMSDIMECSA-N	1	0	286.419	4.207	20	30		CIEDRO
C=C(C)[C@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)c1ccc(F)c(F)c1	ZINC000249048930	334325754	/nfs/dbraw/zinc/32/57/54/334325754.db2.gz	WZFIFZTVUUYEGR-IFIJOSMWSA-N	1	0	290.357	4.254	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1	ZINC000249179775	334329422	/nfs/dbraw/zinc/32/94/22/334329422.db2.gz	HIHXFDASRBKVIO-XQQFMLRXSA-N	1	0	263.347	4.442	20	30		CIEDRO
CC[N@H+](CCCC(C)(C)C#N)[C@H]1CCCC[C@H]1C	ZINC000249332942	334332177	/nfs/dbraw/zinc/33/21/77/334332177.db2.gz	HTFXNEWTECWHMZ-CABCVRRESA-N	1	0	250.430	4.217	20	30		CIEDRO
C[C@H]1CCC[C@H]1[NH2+]C1CCC(Oc2ccccc2C#N)CC1	ZINC000088720171	334340852	/nfs/dbraw/zinc/34/08/52/334340852.db2.gz	SAODOFANKSPPST-IWCVFHTOSA-N	1	0	298.430	4.026	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CCc2ccc(Cl)cc2C1	ZINC000090614878	334364979	/nfs/dbraw/zinc/36/49/79/334364979.db2.gz	NWPLBJQXCXRJII-UHFFFAOYSA-N	1	0	276.811	4.028	20	30		CIEDRO
CC[C@H](CSC)[N@H+](C)Cc1ccccc1C(C)(C)C#N	ZINC000091097437	334371971	/nfs/dbraw/zinc/37/19/71/334371971.db2.gz	CMGVEOMAUDSGLP-OAHLLOKOSA-N	1	0	290.476	4.061	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@@H](C)[C@H](C)C1)c1cccc(C#N)c1	ZINC000251954977	334372417	/nfs/dbraw/zinc/37/24/17/334372417.db2.gz	XDBKYHJOTPRGCH-VWPFQQQWSA-N	1	0	256.393	4.034	20	30		CIEDRO
CC(C)[C@@H]1CC[C@@H]([NH2+]CC(C)(C)CCC#N)C[C@H]1C	ZINC000554077134	334409548	/nfs/dbraw/zinc/40/95/48/334409548.db2.gz	NODINUABRPOECZ-OAGGEKHMSA-N	1	0	264.457	4.367	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]C[C@H]2C[C@H]2c2ccccc2)cc1	ZINC000554112041	334413144	/nfs/dbraw/zinc/41/31/44/334413144.db2.gz	GEECSONGYFSOJD-QUCCMNQESA-N	1	0	293.410	4.145	20	30		CIEDRO
CCCC[C@H]1CCC[C@@H]1[NH2+]CC(C)(C)CCC#N	ZINC000554360158	334424036	/nfs/dbraw/zinc/42/40/36/334424036.db2.gz	BGQWEMNHWBBUSF-GJZGRUSLSA-N	1	0	250.430	4.265	20	30		CIEDRO
COc1ccc([C@@H](C)[C@@H](C)[NH2+]CC(C)(C)CCC#N)cc1	ZINC000554363532	334424810	/nfs/dbraw/zinc/42/48/10/334424810.db2.gz	NLSWKUPUXGECSW-LSDHHAIUSA-N	1	0	288.435	4.107	20	30		CIEDRO
CC1(C)CCC([NH2+][C@H]2CCc3ccc(C#N)cc32)CC1	ZINC000564423413	334507968	/nfs/dbraw/zinc/50/79/68/334507968.db2.gz	JAEZOPUBGWOVTF-KRWDZBQOSA-N	1	0	268.404	4.104	20	30		CIEDRO
CSc1ccc2c(c1)[C@@H]([NH2+]CC(C)(C)CC#N)CCC2	ZINC000564728420	334518175	/nfs/dbraw/zinc/51/81/75/334518175.db2.gz	IAQRPGUECMPNMS-INIZCTEOSA-N	1	0	288.460	4.315	20	30		CIEDRO
C[C@H](C[NH2+][C@H]1CC[C@@H](C#N)C1)c1ccc(C(F)(F)F)cc1	ZINC000565682797	334587274	/nfs/dbraw/zinc/58/72/74/334587274.db2.gz	IDHJHURZECRALS-JMSVASOKSA-N	1	0	296.336	4.091	20	30		CIEDRO
N#CCCC1CC[NH+]([C@H]2CCc3c2cccc3Cl)CC1	ZINC000566677072	334659903	/nfs/dbraw/zinc/65/99/03/334659903.db2.gz	YGFYBHARLYJZGK-KRWDZBQOSA-N	1	0	288.822	4.343	20	30		CIEDRO
N#CCC[C@@H](C#N)C[NH2+][C@@H](c1cccc(F)c1)C1CCCC1	ZINC000567685080	334751844	/nfs/dbraw/zinc/75/18/44/334751844.db2.gz	VGUJJDOEPHLIAO-KBXCAEBGSA-N	1	0	299.393	4.090	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCc2ccc(C#N)cc21)c1cccc(F)c1F	ZINC000568451887	334825496	/nfs/dbraw/zinc/82/54/96/334825496.db2.gz	XJQMXWILSLIMLS-GTNSWQLSSA-N	1	0	298.336	4.175	20	30		CIEDRO
COc1ccc2ccccc2c1C[NH2+]CC(C)(C)CCC#N	ZINC000568808283	334841888	/nfs/dbraw/zinc/84/18/88/334841888.db2.gz	OLFWBIQVTDDSKX-UHFFFAOYSA-N	1	0	296.414	4.268	20	30		CIEDRO
C[C@H]([NH2+]C(C1CCC1)C1CCC1)c1cccc(C#N)c1	ZINC000325044820	334893124	/nfs/dbraw/zinc/89/31/24/334893124.db2.gz	NPTBXGITKVOERE-ZDUSSCGKSA-N	1	0	268.404	4.178	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@@H](CC)c1ccc(OC)c(OC)c1	ZINC000343509544	335205952	/nfs/dbraw/zinc/20/59/52/335205952.db2.gz	RKYUCRHHHTYJJP-CABCVRRESA-N	1	0	277.408	4.099	20	30		CIEDRO
C=CCCCC[NH2+][C@H]1c2ccccc2CC12CCOCC2	ZINC000577054166	335291493	/nfs/dbraw/zinc/29/14/93/335291493.db2.gz	IHJRZUNTIDXOQA-SFHVURJKSA-N	1	0	285.431	4.027	20	30		CIEDRO
CC(C)(CC1CCCCCC1)[NH2+]Cc1nc(C#N)cs1	ZINC000577183318	335318318	/nfs/dbraw/zinc/31/83/18/335318318.db2.gz	UBCHWCMOJRPROC-UHFFFAOYSA-N	1	0	291.464	4.243	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)s1)c1ccc(F)c(Cl)c1	ZINC000176954742	335344583	/nfs/dbraw/zinc/34/45/83/335344583.db2.gz	WKBOQKWDMDMQEN-VIFPVBQESA-N	1	0	294.782	4.263	20	30		CIEDRO
N#Cc1ccc(C[NH2+]CCc2ccc3ccccc3c2)s1	ZINC000176957260	335344874	/nfs/dbraw/zinc/34/48/74/335344874.db2.gz	CYLFNYFROHFAAD-UHFFFAOYSA-N	1	0	292.407	4.105	20	30		CIEDRO
C=CC[C@@H](C)[NH2+]C/C(C)=C/c1ccccc1OC(F)F	ZINC000577428525	335351557	/nfs/dbraw/zinc/35/15/57/335351557.db2.gz	MNIAIPKGIXNWJL-RSKUSDAESA-N	1	0	281.346	4.246	20	30		CIEDRO
N#Cc1csc(C[NH2+][C@@H](c2ccccc2)C2CCC2)c1	ZINC000177696197	335379628	/nfs/dbraw/zinc/37/96/28/335379628.db2.gz	XQAVIFTWCRCHBZ-KRWDZBQOSA-N	1	0	282.412	4.251	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@@H](CC2CCC2)c2ccccc2)C1	ZINC000349432704	335467833	/nfs/dbraw/zinc/46/78/33/335467833.db2.gz	ZNMXLGPQHXFLGU-NJAFHUGGSA-N	1	0	268.404	4.200	20	30		CIEDRO
C[C@H](c1ccc(Cl)cc1)[NH+]1CCC(CCC#N)CC1	ZINC000579003233	335698691	/nfs/dbraw/zinc/69/86/91/335698691.db2.gz	ABKXJNIANXIAHM-CYBMUJFWSA-N	1	0	276.811	4.417	20	30		CIEDRO
Cc1csc([C@H]([NH2+][C@H](C)c2cccc(C#N)c2)C2CC2)n1	ZINC000181818062	335786669	/nfs/dbraw/zinc/78/66/69/335786669.db2.gz	DQRYJYMLGFIYGQ-MLGOLLRUSA-N	1	0	297.427	4.125	20	30		CIEDRO
CSc1ccccc1C[C@H](C)[NH2+]Cc1cccc(C#N)c1	ZINC000183409567	335892678	/nfs/dbraw/zinc/89/26/78/335892678.db2.gz	ZTDNTSPKDUFSOR-AWEZNQCLSA-N	1	0	296.439	4.001	20	30		CIEDRO
Cc1ccc([C@H](C)[NH2+][C@H]2CCc3ccc(C#N)cc32)cc1	ZINC000581160754	336016965	/nfs/dbraw/zinc/01/69/65/336016965.db2.gz	JMEFOHPNRYQPAR-LIRRHRJNSA-N	1	0	276.383	4.205	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+]Cc1ccc2c(c1)nc(CC)n2C1CC1	ZINC000581322996	336049348	/nfs/dbraw/zinc/04/93/48/336049348.db2.gz	MDZPUOGFZJHLGY-CQSZACIVSA-N	1	0	297.446	4.378	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1C=CCCCCC1)c1ccc(C#N)cc1	ZINC000381649569	336069917	/nfs/dbraw/zinc/06/99/17/336069917.db2.gz	IXSBBUHGVLMTPD-PBHICJAKSA-N	1	0	254.377	4.098	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]Cc1ccc(SC)s1	ZINC000382006726	336079768	/nfs/dbraw/zinc/07/97/68/336079768.db2.gz	LDZPDQNHLFHXRJ-UHFFFAOYSA-N	1	0	255.452	4.162	20	30		CIEDRO
CC1(C)CC(C[NH2+]Cc2ccc(C#N)cc2C(F)(F)F)C1	ZINC000581518272	336092936	/nfs/dbraw/zinc/09/29/36/336092936.db2.gz	UGZQQDBHJAZZRM-UHFFFAOYSA-N	1	0	296.336	4.103	20	30		CIEDRO
C[C@H](c1ccccc1)[N@H+](C)CCCOc1cccc(C#N)c1	ZINC000383902760	336119229	/nfs/dbraw/zinc/11/92/29/336119229.db2.gz	CUGXOVXPKGYHCY-MRXNPFEDSA-N	1	0	294.398	4.020	20	30		CIEDRO
CCC[N@H+](Cc1ccccc1)Cc1cccc(C#N)c1F	ZINC000384395896	336124247	/nfs/dbraw/zinc/12/42/47/336124247.db2.gz	FPTRITGHZBKHIV-UHFFFAOYSA-N	1	0	282.362	4.110	20	30		CIEDRO
CC[C@H](c1cccc(OC)c1)[N@H+](C)Cc1cccc(C#N)c1	ZINC000581848270	336151241	/nfs/dbraw/zinc/15/12/41/336151241.db2.gz	SHEKWTSNCMADEF-LJQANCHMSA-N	1	0	294.398	4.150	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1ccc(OC)c(Br)c1	ZINC000386897421	336182026	/nfs/dbraw/zinc/18/20/26/336182026.db2.gz	OGQCRKRKDZAQJH-NSHDSACASA-N	1	0	298.224	4.075	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H]1CCCc2c3ccccc3[nH]c21	ZINC000386955771	336183044	/nfs/dbraw/zinc/18/30/44/336183044.db2.gz	YGKJFLFVRGJDIT-MRXNPFEDSA-N	1	0	254.377	4.101	20	30		CIEDRO
C[C@H]([NH2+][C@@H](C)c1ccc2c(c1)CCC2)c1ccc(C#N)cc1	ZINC000387245215	336190338	/nfs/dbraw/zinc/19/03/38/336190338.db2.gz	BVAUYUZVPOFLBK-GJZGRUSLSA-N	1	0	290.410	4.459	20	30		CIEDRO
COc1cc(C)ccc1[C@@H](C)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000387417498	336193642	/nfs/dbraw/zinc/19/36/42/336193642.db2.gz	FJTJFJGVZYIGLF-LSDHHAIUSA-N	1	0	294.398	4.287	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)c1ccc(OCC(F)(F)F)cc1	ZINC000539072528	517339660	/nfs/dbraw/zinc/33/96/60/517339660.db2.gz	CKRKFPPQLQNFIN-RYUDHWBXSA-N	1	0	287.325	4.243	20	30		CIEDRO
CC(C)[C@@H]([NH2+]Cc1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000035019012	517463429	/nfs/dbraw/zinc/46/34/29/517463429.db2.gz	NAURTYLBLVBBSD-GOSISDBHSA-N	1	0	282.362	4.184	20	30		CIEDRO
CCOc1ccccc1[C@H](CC)[NH2+]Cc1ccc(C#N)cc1	ZINC000101599379	521588877	/nfs/dbraw/zinc/58/88/77/521588877.db2.gz	CSIRNRXERSEJFX-SFHVURJKSA-N	1	0	294.398	4.198	20	30		CIEDRO
N#CCCC[NH2+][C@@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1	ZINC000442852134	534613327	/nfs/dbraw/zinc/61/33/27/534613327.db2.gz	KUPMIRDHAHZYPP-UKRRQHHQSA-N	1	0	296.336	4.235	20	30		CIEDRO
CC[C@H]([NH2+]C[C@@H](C)c1c(C)noc1C)c1ccc(C#N)cc1	ZINC000278832981	522607020	/nfs/dbraw/zinc/60/70/20/522607020.db2.gz	UEIQKRYSXQMFBE-PXAZEXFGSA-N	1	0	297.402	4.008	20	30		CIEDRO
CC[C@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)c1ccc(C#N)cc1	ZINC000278238291	522694770	/nfs/dbraw/zinc/69/47/70/522694770.db2.gz	LCPYDBRSDNXZRY-LIRRHRJNSA-N	1	0	289.382	4.232	20	30		CIEDRO
CC[C@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)c1ccc(OC)cc1	ZINC000121842589	522696809	/nfs/dbraw/zinc/69/68/09/522696809.db2.gz	TUGRDTRMWZIMMU-LIRRHRJNSA-N	1	0	294.398	4.369	20	30		CIEDRO
CC[C@H]([NH2+][C@@H](C)c1cccc(OC)c1)c1ccc(C#N)cc1	ZINC000278289905	522699362	/nfs/dbraw/zinc/69/93/62/522699362.db2.gz	QYAGLDHBMKQUQJ-LIRRHRJNSA-N	1	0	294.398	4.369	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H](C)c1cccc(C#N)c1)c1ccccc1	ZINC000051627096	522914272	/nfs/dbraw/zinc/91/42/72/522914272.db2.gz	NOTMDEAVFLIMNR-KBXCAEBGSA-N	1	0	264.372	4.360	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H]1CCc2c1cccc2F)c1ccc(C#N)cc1	ZINC000278701827	522928768	/nfs/dbraw/zinc/92/87/68/522928768.db2.gz	LCSDSUUBOMQOLM-RTBURBONSA-N	1	0	294.373	4.426	20	30		CIEDRO
CC[C@@H]([NH2+][C@H](C)c1ccccc1)c1ccc(C#N)cc1	ZINC000278206871	522938865	/nfs/dbraw/zinc/93/88/65/522938865.db2.gz	HHXTYRJJSDSKKP-RDTXWAMCSA-N	1	0	264.372	4.360	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+]C2CCC(c3ccccc3)CC2)C1	ZINC000192634112	534749022	/nfs/dbraw/zinc/74/90/22/534749022.db2.gz	XLHSOFGTIAQOQE-GWFLUQINSA-N	1	0	282.431	4.385	20	30		CIEDRO
Cc1cccc([C@H](C)[NH2+][C@H](C)c2ccc(C#N)cc2)c1	ZINC000037284478	524875794	/nfs/dbraw/zinc/87/57/94/524875794.db2.gz	QBHRVXGLARYDSB-CABCVRRESA-N	1	0	264.372	4.279	20	30		CIEDRO
C[C@H]([NH2+]C1CCC(C(F)(F)F)CC1)c1ccc(C#N)cc1	ZINC000037092580	525289497	/nfs/dbraw/zinc/28/94/97/525289497.db2.gz	NEDDFVMQYVBLON-QGLTVNCISA-N	1	0	296.336	4.330	20	30		CIEDRO
C[C@@H]([NH2+]C1CCC(C(F)(F)F)CC1)c1ccc(C#N)cc1	ZINC000037092581	525397143	/nfs/dbraw/zinc/39/71/43/525397143.db2.gz	NEDDFVMQYVBLON-VCANKDNSSA-N	1	0	296.336	4.330	20	30		CIEDRO
Cc1cc([C@@H](C)[NH2+]C2(c3cccc(C#N)c3)CC2)cs1	ZINC000297040977	525458789	/nfs/dbraw/zinc/45/87/89/525458789.db2.gz	VGGUCSODTBAWIU-CYBMUJFWSA-N	1	0	282.412	4.268	20	30		CIEDRO
Cc1cc([C@H](C)[NH2+][C@@H](C)c2ccc(C#N)cc2)c(C)o1	ZINC000036991952	525524938	/nfs/dbraw/zinc/52/49/38/525524938.db2.gz	MKFOUTPQEZXKKB-STQMWFEESA-N	1	0	268.360	4.180	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCc2c1cccc2F)c1cccc(C#N)c1	ZINC000267090663	525581665	/nfs/dbraw/zinc/58/16/65/525581665.db2.gz	WZQCAIIKJFCCTA-KPZWWZAWSA-N	1	0	280.346	4.035	20	30		CIEDRO
C[C@@H]([NH2+][C@H](C)c1cccc(C#N)c1)c1cccs1	ZINC000037235462	525663444	/nfs/dbraw/zinc/66/34/44/525663444.db2.gz	JFEZTCKYIMJQJW-VXGBXAGGSA-N	1	0	256.374	4.032	20	30		CIEDRO
Cc1ccc2c(c1)[C@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)CC2	ZINC000097988416	526212335	/nfs/dbraw/zinc/21/23/35/526212335.db2.gz	PALZNZOUGJZRKP-IFXJQAMLSA-N	1	0	276.383	4.205	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H](c2ccccc2)C2CCC2)cc1	ZINC000104701830	526627079	/nfs/dbraw/zinc/62/70/79/526627079.db2.gz	YBBMWQVJIYNLAT-LJQANCHMSA-N	1	0	276.383	4.189	20	30		CIEDRO
N#Cc1cccc(C[N@@H+]2CCC[C@@H]2c2cccs2)c1F	ZINC000340764883	526703205	/nfs/dbraw/zinc/70/32/05/526703205.db2.gz	WHZPNXWTOCOYEK-CQSZACIVSA-N	1	0	286.375	4.096	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@@H](C)c1ccccc1SC	ZINC000442850409	526783525	/nfs/dbraw/zinc/78/35/25/526783525.db2.gz	CWMIMGZCVLKRQZ-VBQJREDUSA-N	1	0	291.460	4.040	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H]1CCc2ccc(Cl)cc21	ZINC000348219657	527001427	/nfs/dbraw/zinc/00/14/27/527001427.db2.gz	CVIJVMGBOQGOFB-HNNXBMFYSA-N	1	0	276.811	4.247	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+][C@H]1CCOc2c(C)cccc21	ZINC000353311390	527140072	/nfs/dbraw/zinc/14/00/72/527140072.db2.gz	ZRRGSGYXPMBLOD-BJJXKVORSA-N	1	0	259.393	4.009	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCCCSC)c1ccco1	ZINC000353531100	527447850	/nfs/dbraw/zinc/44/78/50/527447850.db2.gz	UHAUEEHZVOPGMA-CYBMUJFWSA-N	1	0	253.411	4.020	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@H](C)c1ncc(C)s1)c1ccco1	ZINC000353671886	527450019	/nfs/dbraw/zinc/45/00/19/527450019.db2.gz	PADZVOAFGJBEJN-GXTWGEPZSA-N	1	0	290.432	4.445	20	30		CIEDRO
CCC[C@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)c1ccccc1	ZINC000192607731	528236374	/nfs/dbraw/zinc/23/63/74/528236374.db2.gz	ZDMSMGWCQZYRNE-UAGQMJEPSA-N	1	0	256.393	4.200	20	30		CIEDRO
CCCC[C@@H]1CCC[C@@H]1[NH2+]CC1CCC(C#N)CC1	ZINC000442864737	528868655	/nfs/dbraw/zinc/86/86/55/528868655.db2.gz	DKNXINWQQZIBDT-BACDZXNISA-N	1	0	262.441	4.265	20	30		CIEDRO
CCC[C@@H]([NH2+]Cc1ccc(C#N)c(F)c1)c1ccccc1	ZINC000192147810	529012029	/nfs/dbraw/zinc/01/20/29/529012029.db2.gz	BBVBTNWYPLAULO-GOSISDBHSA-N	1	0	282.362	4.328	20	30		CIEDRO
CC[C@@H]([NH2+]CC(C)(C)CCC#N)c1cccc(OC)c1	ZINC000348217571	529155696	/nfs/dbraw/zinc/15/56/96/529155696.db2.gz	AWSQEOFMCKSWOW-MRXNPFEDSA-N	1	0	274.408	4.066	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]Cc1cc(Cl)c(OC)c(OC)c1	ZINC000312496627	260130920	/nfs/dbraw/zinc/13/09/20/260130920.db2.gz	UXISJZWHVKLOFS-UHFFFAOYSA-N	1	0	297.826	4.049	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)c1ccc(Br)c(F)c1	ZINC000309469617	260169728	/nfs/dbraw/zinc/16/97/28/260169728.db2.gz	QUGOILNXMXBSBJ-JTQLQIEISA-N	1	0	286.188	4.205	20	30		CIEDRO
Cc1cc(C[NH2+][C@@H]2CCc3ccc(C#N)cc32)ccc1Cl	ZINC000573371292	334932253	/nfs/dbraw/zinc/93/22/53/334932253.db2.gz	UBSZMOOASMAYLZ-GOSISDBHSA-N	1	0	296.801	4.297	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H]1CCCc2nc(CC)sc21	ZINC000573583556	334949543	/nfs/dbraw/zinc/94/95/43/334949543.db2.gz	APTRTQAPCIDPPT-GFCCVEGCSA-N	1	0	278.465	4.275	20	30		CIEDRO
CC[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CCc2ccc(C#N)cc21	ZINC000573648981	334954570	/nfs/dbraw/zinc/95/45/70/334954570.db2.gz	ZOJKNKWYEJHTRA-JLSDUUJJSA-N	1	0	268.404	4.104	20	30		CIEDRO
C[N@H+](Cc1cccc(C#N)c1)Cc1cccc(C(F)F)c1	ZINC000347967649	529993228	/nfs/dbraw/zinc/99/32/28/529993228.db2.gz	PYMCFDFTOSLKOX-UHFFFAOYSA-N	1	0	286.325	4.128	20	30		CIEDRO
C=C(CC)C[NH2+][C@@H](C)c1ccccc1Br	ZINC000088162685	260278605	/nfs/dbraw/zinc/27/86/05/260278605.db2.gz	OJCOPJWJUJTUNZ-NSHDSACASA-N	1	0	268.198	4.066	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](C)c1cncc(Br)c1	ZINC000574291839	335007883	/nfs/dbraw/zinc/00/78/83/335007883.db2.gz	FECWJKDDLWNBME-NWDGAFQWSA-N	1	0	297.240	4.240	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCN(C)c1ccccc1)c1ccco1	ZINC000574471282	335022536	/nfs/dbraw/zinc/02/25/36/335022536.db2.gz	DTGKVTLQEKMWKE-KRWDZBQOSA-N	1	0	284.403	4.013	20	30		CIEDRO
N#Cc1cccc(C[N@@H+]2CCC[C@]3(CC=CCC3)C2)c1F	ZINC000352866347	227366364	/nfs/dbraw/zinc/36/63/64/227366364.db2.gz	HKMYDXPTUPTOPA-GOSISDBHSA-N	1	0	284.378	4.020	20	30		CIEDRO
N#CCCCC[NH2+]CCCc1c(Cl)cccc1Cl	ZINC000193292085	262219699	/nfs/dbraw/zinc/21/96/99/262219699.db2.gz	VGPOQLHIURFCNY-UHFFFAOYSA-N	1	0	285.218	4.209	20	30		CIEDRO
CC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCCc2cc(C#N)ccc21	ZINC000520858340	260031595	/nfs/dbraw/zinc/03/15/95/260031595.db2.gz	AEZPZMZVWZQHSA-FHLIZLRMSA-N	1	0	268.404	4.104	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCCc2occc21)c1ccc(C#N)c(F)c1	ZINC000335962109	533543246	/nfs/dbraw/zinc/54/32/46/533543246.db2.gz	TUHIBBMWKYNJJB-BZNIZROVSA-N	1	0	284.334	4.019	20	30		CIEDRO
C[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CCCc2cc(C#N)ccc21	ZINC000341756597	130024852	/nfs/dbraw/zinc/02/48/52/130024852.db2.gz	FVBGKLAEKDHSLG-FSPWUOQZSA-N	1	0	268.404	4.104	20	30		CIEDRO
N#Cc1ccc2c(c1)CCC[C@@H]2[NH2+]Cc1ccccc1Cl	ZINC000341759507	130025487	/nfs/dbraw/zinc/02/54/87/130025487.db2.gz	VXQKNPJXPLKTLN-SFHVURJKSA-N	1	0	296.801	4.379	20	30		CIEDRO
CC1CCC([NH2+][C@H]2CCCc3cc(C#N)ccc32)CC1	ZINC000341758541	130025922	/nfs/dbraw/zinc/02/59/22/130025922.db2.gz	RFTAKIHHGAFYID-AUCFXJAVSA-N	1	0	268.404	4.104	20	30		CIEDRO
Cc1ccc(C[NH2+][C@H]2CCCc3cc(C#N)ccc32)s1	ZINC000341758181	130026088	/nfs/dbraw/zinc/02/60/88/130026088.db2.gz	OAUMUZYCGKKWMI-KRWDZBQOSA-N	1	0	282.412	4.095	20	30		CIEDRO
Cc1ccsc1C[NH2+][C@@H]1CCCc2cc(C#N)ccc21	ZINC000341760377	130026720	/nfs/dbraw/zinc/02/67/20/130026720.db2.gz	KPHGRMJETQJJSQ-MRXNPFEDSA-N	1	0	282.412	4.095	20	30		CIEDRO
N#Cc1ccc2c(c1)CCC[C@H]2[NH2+]Cc1cccc(Cl)c1	ZINC000341760463	130026900	/nfs/dbraw/zinc/02/69/00/130026900.db2.gz	ZBOUJNQLMWHTRZ-GOSISDBHSA-N	1	0	296.801	4.379	20	30		CIEDRO
N#Cc1ccc2c(c1)CCC[C@@H]2[NH2+][C@@H]1CCCc2occc21	ZINC000341759954	130027385	/nfs/dbraw/zinc/02/73/85/130027385.db2.gz	JJARLTMNMKEUFJ-ZWKOTPCHSA-N	1	0	292.382	4.196	20	30		CIEDRO
N#CC1(C[NH2+][C@H]2CCC[C@@H](c3ccc(Cl)cc3)C2)CC1	ZINC000575105839	335065951	/nfs/dbraw/zinc/06/59/51/335065951.db2.gz	UFMIRWGKVIDITA-ZBFHGGJFSA-N	1	0	288.822	4.260	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H]2CCc3ccccc32)cc1	ZINC000020130105	171018951	/nfs/dbraw/zinc/01/89/51/171018951.db2.gz	SHAKCJIBKXKZQW-IBGZPJMESA-N	1	0	279.383	4.029	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1cccc(F)c1)c1ccc(C#N)cc1	ZINC000020147840	171035281	/nfs/dbraw/zinc/03/52/81/171035281.db2.gz	ZVWSNNKEEDGEJV-OLZOCXBDSA-N	1	0	268.335	4.109	20	30		CIEDRO
C[C@@H]([NH2+][C@H](C)c1ccc(OCC#N)cc1)c1ccccc1	ZINC000037185702	260072774	/nfs/dbraw/zinc/07/27/74/260072774.db2.gz	ACHVSVWQRRUJOD-HUUCEWRRSA-N	1	0	280.371	4.001	20	30		CIEDRO
C[C@@H]([NH2+]CC(C)(C)CCC#N)c1ccc2ccccc2n1	ZINC000348204291	226431393	/nfs/dbraw/zinc/43/13/93/226431393.db2.gz	GIGJDIPUEGSDSE-CQSZACIVSA-N	1	0	281.403	4.215	20	30		CIEDRO
N#CC1CCC(C[NH2+][C@@H]2CCC[C@H](c3cccnc3)C2)CC1	ZINC000367050097	226505039	/nfs/dbraw/zinc/50/50/39/226505039.db2.gz	MAKKBLSRDSVROU-BXNZUYAZSA-N	1	0	297.446	4.027	20	30		CIEDRO
N#CC1CCC(C[NH2+][C@H]2CCC[C@H](c3cccnc3)C2)CC1	ZINC000367050096	226505171	/nfs/dbraw/zinc/50/51/71/226505171.db2.gz	MAKKBLSRDSVROU-AKSNENBUSA-N	1	0	297.446	4.027	20	30		CIEDRO
C[C@@H](CCC#N)[N@H+]1CC=C(c2cccc(Cl)c2)CC1	ZINC000411660569	262702525	/nfs/dbraw/zinc/70/25/25/262702525.db2.gz	SNSMXHNPMYODLL-ZDUSSCGKSA-N	1	0	274.795	4.121	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+]Cc2cccc3ccccc32)C1	ZINC000192779059	227288380	/nfs/dbraw/zinc/28/83/80/227288380.db2.gz	PXYMMJUHQHGSKE-YOEHRIQHSA-N	1	0	264.372	4.012	20	30		CIEDRO
N#CCC1(C[NH2+]CC(c2ccccc2)c2ccccc2)CC1	ZINC000353286672	228079686	/nfs/dbraw/zinc/07/96/86/228079686.db2.gz	NJBDXDIEWULUEI-UHFFFAOYSA-N	1	0	290.410	4.102	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([N@@H+]2CC=C(c3ccccc3Cl)CC2)C1	ZINC000335928745	228166697	/nfs/dbraw/zinc/16/66/97/228166697.db2.gz	VGLGYMBROGIYQK-UKRRQHHQSA-N	1	0	286.806	4.121	20	30		CIEDRO
N#CCCCC[N@@H+](Cc1ccccc1Cl)CC1CC1	ZINC000352257606	228207306	/nfs/dbraw/zinc/20/73/06/228207306.db2.gz	WEOQOUSDTXZWPM-UHFFFAOYSA-N	1	0	276.811	4.246	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](C)c1ccc(C#N)cc1F	ZINC000512633644	260024612	/nfs/dbraw/zinc/02/46/12/260024612.db2.gz	AJRLOXXVCKXTBA-STQMWFEESA-N	1	0	260.356	4.093	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(C#N)cc1)c1cccc(Cl)c1	ZINC000036921348	260051969	/nfs/dbraw/zinc/05/19/69/260051969.db2.gz	KTARMKGPBBOLQC-KRWDZBQOSA-N	1	0	284.790	4.453	20	30		CIEDRO
C=CCCC[NH2+][C@H](C)CCc1ccc(OC(F)F)cc1	ZINC000312468821	260073373	/nfs/dbraw/zinc/07/33/73/260073373.db2.gz	UPWHVDNIVDFVJO-CYBMUJFWSA-N	1	0	283.362	4.165	20	30		CIEDRO
C[C@H]([NH2+]Cc1cccc(C#N)c1)c1cnc2ccsc2c1	ZINC000068691328	260146154	/nfs/dbraw/zinc/14/61/54/260146154.db2.gz	DWIXPNKZNAXTJK-LBPRGKRZSA-N	1	0	293.395	4.019	20	30		CIEDRO
CC(C)Oc1cccc([C@H](C)[NH2+]Cc2ccc(C#N)cc2)c1	ZINC000078974686	260172372	/nfs/dbraw/zinc/17/23/72/260172372.db2.gz	JMCUSFJGHFDFKT-HNNXBMFYSA-N	1	0	294.398	4.196	20	30		CIEDRO
CC(C)(C#N)CCCC[N@@H+]1CC[C@H](C(F)(F)F)C1(C)C	ZINC000312829151	260209517	/nfs/dbraw/zinc/20/95/17/260209517.db2.gz	JPROIXNHGVBXTI-LBPRGKRZSA-N	1	0	290.373	4.369	20	30		CIEDRO
C[C@@H](c1ccc(Cl)cc1)[N@H+](C)CCCCC#N	ZINC000061559608	260233534	/nfs/dbraw/zinc/23/35/34/260233534.db2.gz	ZBKRLRDEKUFJRK-LBPRGKRZSA-N	1	0	250.773	4.027	20	30		CIEDRO
CC(C)(C)[C@@H]1CC[N@H+](CCCCC(C)(C)C#N)C1	ZINC000232509741	260264243	/nfs/dbraw/zinc/26/42/43/260264243.db2.gz	PQBXOZQAEWICDJ-CQSZACIVSA-N	1	0	250.430	4.074	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@H]2C[C@H]2C2CCCCC2)CC1	ZINC000449222888	260299125	/nfs/dbraw/zinc/29/91/25/260299125.db2.gz	IVRAQIJPPINKEL-YZUHTNEWSA-N	1	0	260.425	4.017	20	30		CIEDRO
C=C(CC)C[NH2+][C@H]1C[C@H](C)Sc2sccc21	ZINC000313537473	260300848	/nfs/dbraw/zinc/30/08/48/260300848.db2.gz	NLILDVJJMFRJAF-JQWIXIFHSA-N	1	0	253.436	4.229	20	30		CIEDRO
C[C@H]1C[C@@H](c2ccccc2)[N@H+](Cc2ccc(C#N)s2)C1	ZINC000517782292	260306240	/nfs/dbraw/zinc/30/62/40/260306240.db2.gz	CWVCLFWXWWFRSX-GUYCJALGSA-N	1	0	282.412	4.203	20	30		CIEDRO
N#Cc1ccc2c(c1)[C@H]([NH2+]C1CC(c3ccccc3)C1)CC2	ZINC000518387412	260395733	/nfs/dbraw/zinc/39/57/33/260395733.db2.gz	UPDNWKVVASHDHR-AFMYVXGZSA-N	1	0	288.394	4.081	20	30		CIEDRO
C=CCOc1cccc(C[NH2+]C2CCCCCC2)c1	ZINC000409594261	260419497	/nfs/dbraw/zinc/41/94/97/260419497.db2.gz	LPZKNVUTGORPPS-UHFFFAOYSA-N	1	0	259.393	4.064	20	30		CIEDRO
C[C@H](Cc1coc2ccccc12)[NH2+]CC(C)(C)CCC#N	ZINC000449330630	260420715	/nfs/dbraw/zinc/42/07/15/260420715.db2.gz	LTPFSFFEAGMIAG-CQSZACIVSA-N	1	0	284.403	4.283	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+]CCc1nc2c(cccc2C)o1	ZINC000410363780	260491142	/nfs/dbraw/zinc/49/11/42/260491142.db2.gz	XARWLTWOVFQRLU-OAHLLOKOSA-N	1	0	286.419	4.403	20	30		CIEDRO
Cc1cc(C[NH2+][C@@H](C)c2cccc(C#N)c2)ccc1Cl	ZINC000180987389	260559893	/nfs/dbraw/zinc/55/98/93/260559893.db2.gz	QVCQIBAPZYIIRB-ZDUSSCGKSA-N	1	0	284.790	4.371	20	30		CIEDRO
C=CCCC[NH2+][C@H]1CCCOc2ccc(Cl)cc21	ZINC000448026393	260582974	/nfs/dbraw/zinc/58/29/74/260582974.db2.gz	IECABIWOWRWJCS-AWEZNQCLSA-N	1	0	265.784	4.110	20	30		CIEDRO
N#CCCCC[NH2+][C@@H](c1ccccc1)C1CCCC1	ZINC000109801120	260644689	/nfs/dbraw/zinc/64/46/89/260644689.db2.gz	PFDPBZNXNXEDAX-KRWDZBQOSA-N	1	0	256.393	4.201	20	30		CIEDRO
C[C@H]([NH2+]CCCCC#N)C(c1ccccc1)c1ccccc1	ZINC000118974732	260691038	/nfs/dbraw/zinc/69/10/38/260691038.db2.gz	DNEHVCOYABLJGX-KRWDZBQOSA-N	1	0	292.426	4.490	20	30		CIEDRO
C=C[C@H](C)[NH2+][C@@H](CC)c1ccc(Br)cc1	ZINC000157297154	260834655	/nfs/dbraw/zinc/83/46/55/260834655.db2.gz	XIHLTQGEUVEETE-GWCFXTLKSA-N	1	0	268.198	4.064	20	30		CIEDRO
CSc1cc(C)ccc1C[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000151727566	261054996	/nfs/dbraw/zinc/05/49/96/261054996.db2.gz	BAIRBSUKCHTEHF-AWEZNQCLSA-N	1	0	296.439	4.439	20	30		CIEDRO
COc1ccc([C@@H](C)[NH2+]CCCCC(C)(C)C#N)cc1F	ZINC000444670321	261061281	/nfs/dbraw/zinc/06/12/81/261061281.db2.gz	AUNUJKBHROWSJK-CYBMUJFWSA-N	1	0	292.398	4.205	20	30		CIEDRO
CCS[C@@H]1CCCC[C@@H]1[NH2+]CCCCC(C)(C)C#N	ZINC000444685687	261064856	/nfs/dbraw/zinc/06/48/56/261064856.db2.gz	PEPVYLXKSCXITR-LSDHHAIUSA-N	1	0	282.497	4.360	20	30		CIEDRO
COc1ccc([C@@H]2CCC[N@@H+]2CC(C)(C)CCC#N)cc1	ZINC000155150744	261098928	/nfs/dbraw/zinc/09/89/28/261098928.db2.gz	MTOBJURYULFPBM-KRWDZBQOSA-N	1	0	286.419	4.162	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](C)c1cc(Br)ccc1F	ZINC000161656858	261109949	/nfs/dbraw/zinc/10/99/49/261109949.db2.gz	OSBSOQRQRNJHAH-ZJUUUORDSA-N	1	0	286.188	4.203	20	30		CIEDRO
N#Cc1csc(C[N@H+](CC2CC2)C2CCCCC2)c1	ZINC000514081627	261185243	/nfs/dbraw/zinc/18/52/43/261185243.db2.gz	CSRGKHAHIACFMD-UHFFFAOYSA-N	1	0	274.433	4.164	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@H]2CCCC[C@@H]2c2ccccc2)c1	ZINC000314533735	261745359	/nfs/dbraw/zinc/74/53/59/261745359.db2.gz	BUPLMGPWDMXMAY-UXHICEINSA-N	1	0	290.410	4.374	20	30		CIEDRO
C[C@H]([NH2+][C@@H](CCC#N)c1ccccc1)[C@H]1CC1(C)C	ZINC000487578422	261831567	/nfs/dbraw/zinc/83/15/67/261831567.db2.gz	XRFBAEZHMMWQCX-IMJJTQAJSA-N	1	0	256.393	4.056	20	30		CIEDRO
C[C@H]([NH2+]CCCCC#N)c1ccc(-c2cccnc2)cc1	ZINC000181302560	261893577	/nfs/dbraw/zinc/89/35/77/261893577.db2.gz	XMGCMVZXRXOCOV-HNNXBMFYSA-N	1	0	279.387	4.093	20	30		CIEDRO
CCCC[C@H]([NH2+]CCCCC#N)c1ccc(OC)cc1	ZINC000182149598	261926386	/nfs/dbraw/zinc/92/63/86/261926386.db2.gz	QYMYSWYSOQAMLT-KRWDZBQOSA-N	1	0	274.408	4.210	20	30		CIEDRO
C=CCC[NH2+][C@H](CC)c1cc(F)cc(Br)c1	ZINC000309726321	262006222	/nfs/dbraw/zinc/00/62/22/262006222.db2.gz	YAZABVPZYRTSKO-CYBMUJFWSA-N	1	0	286.188	4.205	20	30		CIEDRO
N#C[C@H]1CCC[C@@H](Nc2cccc(C[NH+]3CCCCC3)c2)C1	ZINC000185726839	262068488	/nfs/dbraw/zinc/06/84/88/262068488.db2.gz	WUEQGWYVONVUQP-FUHWJXTLSA-N	1	0	297.446	4.167	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCc1ccsc1)c1ccco1	ZINC000514086568	262165198	/nfs/dbraw/zinc/16/51/98/262165198.db2.gz	BKTYBBHDZGFIEQ-CQSZACIVSA-N	1	0	261.390	4.181	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCc1ccsc1)c1ccco1	ZINC000514086563	262165209	/nfs/dbraw/zinc/16/52/09/262165209.db2.gz	BKTYBBHDZGFIEQ-AWEZNQCLSA-N	1	0	261.390	4.181	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CCc2cc(Cl)ccc2C1	ZINC000192243196	262200332	/nfs/dbraw/zinc/20/03/32/262200332.db2.gz	YOTIAJRTUVEVEQ-UHFFFAOYSA-N	1	0	276.811	4.028	20	30		CIEDRO
C[N@H+](Cc1cccc(C#N)c1)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000497760101	262202172	/nfs/dbraw/zinc/20/21/72/262202172.db2.gz	WYKWYIXPNIWBNL-WOJBJXKFSA-N	1	0	290.410	4.326	20	30		CIEDRO
N#CCC[C@@H]([NH2+][C@H]1CCCc2occc21)c1ccccc1	ZINC000193039568	262214732	/nfs/dbraw/zinc/21/47/32/262214732.db2.gz	XYWWPPOLGROJRN-SJORKVTESA-N	1	0	280.371	4.292	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@H](C)c1ccccc1OC(F)F	ZINC000393820949	262215661	/nfs/dbraw/zinc/21/56/61/262215661.db2.gz	KQZIJJMWPSLAES-NEPJUHHUSA-N	1	0	269.335	4.293	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+]C[C@@H](c2ccccc2)C(F)(F)F)C1	ZINC000193310507	262220550	/nfs/dbraw/zinc/22/05/50/262220550.db2.gz	PNTGWJNGEOUXJS-QEJZJMRPSA-N	1	0	296.336	4.004	20	30		CIEDRO
CCCC[NH+](CCCC)Cc1cc(C#N)ccc1F	ZINC000020369489	262227911	/nfs/dbraw/zinc/22/79/11/262227911.db2.gz	FAXMOJTWPZWSNX-UHFFFAOYSA-N	1	0	262.372	4.100	20	30		CIEDRO
C[C@H]([NH2+][C@@H](CCC#N)c1ccccc1)c1cccc(O)c1	ZINC000194935123	262243751	/nfs/dbraw/zinc/24/37/51/262243751.db2.gz	ROYMTZSBLJNNEC-KSSFIOAISA-N	1	0	280.371	4.088	20	30		CIEDRO
CC[C@H](C[NH2+][C@H](C)c1cccc(C#N)c1)CC(F)(F)F	ZINC000402607419	262251809	/nfs/dbraw/zinc/25/18/09/262251809.db2.gz	QDBKTXZAQDZZKP-NEPJUHHUSA-N	1	0	284.325	4.187	20	30		CIEDRO
C=CC1CC[NH+](Cc2nc(-c3ccsc3)oc2C)CC1	ZINC000111257919	262258087	/nfs/dbraw/zinc/25/80/87/262258087.db2.gz	GHBFTBQIBYNQLM-UHFFFAOYSA-N	1	0	288.416	4.110	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccccc1C(C)(C)C#N)C1CCCC1	ZINC000184669345	262291543	/nfs/dbraw/zinc/29/15/43/262291543.db2.gz	MJNFALHMLFILDY-CQSZACIVSA-N	1	0	270.420	4.156	20	30		CIEDRO
CC(C)(C)c1ccc(C[NH2+][C@@H]2CCC[C@@H](C#N)C2)cc1	ZINC000463282501	262304021	/nfs/dbraw/zinc/30/40/21/262304021.db2.gz	MYXVBTHGJXXOOT-NVXWUHKLSA-N	1	0	270.420	4.156	20	30		CIEDRO
C[C@H](CCC1CCCCC1)[NH2+][C@H]1CCC[C@H](C#N)C1	ZINC000463297560	262310891	/nfs/dbraw/zinc/31/08/91/262310891.db2.gz	NGKWHNSFXAIXIT-PVAVHDDUSA-N	1	0	262.441	4.407	20	30		CIEDRO
C=CCSCC[NH2+][C@@H](C)c1ccc(OCCC)cc1	ZINC000221942514	262332688	/nfs/dbraw/zinc/33/26/88/262332688.db2.gz	HASQTMHIWFUAGV-AWEZNQCLSA-N	1	0	279.449	4.045	20	30		CIEDRO
C=CCSCC[NH2+][C@@H](C)c1ccc(OC(C)C)cc1	ZINC000221940174	262332800	/nfs/dbraw/zinc/33/28/00/262332800.db2.gz	CICLUMXGHXSOCH-AWEZNQCLSA-N	1	0	279.449	4.044	20	30		CIEDRO
C=CCN1CCC([NH2+][C@@H](c2ccc(C)cc2)C2CCC2)CC1	ZINC000187178240	262390703	/nfs/dbraw/zinc/39/07/03/262390703.db2.gz	QLHCIOYRCAUGOY-HXUWFJFHSA-N	1	0	298.474	4.076	20	30		CIEDRO
CC(C)(C#N)CCC[NH+]1CCC(OC2CCCCC2)CC1	ZINC000336835301	262399728	/nfs/dbraw/zinc/39/97/28/262399728.db2.gz	ACNRNHDOLYVUBJ-UHFFFAOYSA-N	1	0	292.467	4.130	20	30		CIEDRO
C[C@@H](CCC#N)[NH2+][C@@H](C)c1ccccc1C(F)(F)F	ZINC000411470203	262695207	/nfs/dbraw/zinc/69/52/07/262695207.db2.gz	IJDPROYQLBKPMC-QWRGUYRKSA-N	1	0	270.298	4.048	20	30		CIEDRO
C=CC[C@H](Cc1ccccc1)[NH2+][C@@H](CC)c1ccncc1	ZINC000414297411	262838708	/nfs/dbraw/zinc/83/87/08/262838708.db2.gz	HUZXCFXIDIWAMO-MOPGFXCFSA-N	1	0	280.415	4.310	20	30		CIEDRO
C=CC[C@@H](Cc1ccccc1)[NH2+][C@H](C)c1cnn(C(C)C)c1	ZINC000414305042	262848590	/nfs/dbraw/zinc/84/85/90/262848590.db2.gz	PGIXTXXSRGCXGR-APWZRJJASA-N	1	0	297.446	4.302	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+][C@H](C)c1ccc(F)cc1Cl	ZINC000436306624	262848965	/nfs/dbraw/zinc/84/89/65/262848965.db2.gz	LEPLREIQBHCBEO-WQGACYEGSA-N	1	0	297.801	4.111	20	30		CIEDRO
C=CC[C@@H](Cc1ccccc1)[NH2+]Cc1sc(C)nc1C	ZINC000414528607	262982836	/nfs/dbraw/zinc/98/28/36/262982836.db2.gz	BEGFBFLUPQEEOR-INIZCTEOSA-N	1	0	286.444	4.037	20	30		CIEDRO
CC(C)C1(c2ccccc2)C[NH+](CC(C)(C)CCC#N)C1	ZINC000414538003	262987437	/nfs/dbraw/zinc/98/74/37/262987437.db2.gz	PVLDDOBLQKCITK-UHFFFAOYSA-N	1	0	284.447	4.226	20	30		CIEDRO
C[C@@H](c1ccccc1Cl)[NH+]1CCC(C)(C#N)CC1	ZINC000272638957	263007789	/nfs/dbraw/zinc/00/77/89/263007789.db2.gz	XHPBVIIJIGABGO-LBPRGKRZSA-N	1	0	262.784	4.027	20	30		CIEDRO
N#CCCC[NH2+][C@H]1CCCSc2ccc(Cl)cc21	ZINC000273287562	263014836	/nfs/dbraw/zinc/01/48/36/263014836.db2.gz	RMMRXDPQEWTIAB-ZDUSSCGKSA-N	1	0	280.824	4.160	20	30		CIEDRO
C[C@H]([NH2+]CCC(C)(C)C#N)c1nc(-c2ccccc2)cs1	ZINC000273293785	263014968	/nfs/dbraw/zinc/01/49/68/263014968.db2.gz	LOUOKBVEMZVCNZ-ZDUSSCGKSA-N	1	0	299.443	4.401	20	30		CIEDRO
CC[C@H](CC#N)[NH2+][C@@H]1CC=C(c2ccc(F)cc2)CC1	ZINC000273834533	263019837	/nfs/dbraw/zinc/01/98/37/263019837.db2.gz	GQBWTMNTUKLBBK-IAGOWNOFSA-N	1	0	272.367	4.043	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+]C(c2ccccc2)c2ccccc2)C1	ZINC000274617280	263027815	/nfs/dbraw/zinc/02/78/15/263027815.db2.gz	LNTYJGCDCONUFY-MAUKXSAKSA-N	1	0	276.383	4.058	20	30		CIEDRO
C[C@@H](CCC#N)[NH2+][C@@H](C)c1cccc(Cl)c1Cl	ZINC000276319176	263036024	/nfs/dbraw/zinc/03/60/24/263036024.db2.gz	OEDDKAJFOOLRLS-UWVGGRQHSA-N	1	0	271.191	4.336	20	30		CIEDRO
C[C@@H](CCC#N)[N@@H+]1CCC[C@H]1c1nc2ccccc2s1	ZINC000276335182	263036375	/nfs/dbraw/zinc/03/63/75/263036375.db2.gz	RUKZIGAOYRYRHS-JSGCOSHPSA-N	1	0	285.416	4.125	20	30		CIEDRO
C[C@H](CCC#N)[N@@H+]1CCC[C@@H]1c1nc2ccccc2s1	ZINC000276335195	263036413	/nfs/dbraw/zinc/03/64/13/263036413.db2.gz	RUKZIGAOYRYRHS-TZMCWYRMSA-N	1	0	285.416	4.125	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)c1ccccc1OC(F)F	ZINC000278279099	263046452	/nfs/dbraw/zinc/04/64/52/263046452.db2.gz	PUXIEYOMOUMCTL-YNEHKIRRSA-N	1	0	294.345	4.021	20	30		CIEDRO
CC[C@@H]1C[N@@H+]([C@@H]2CC[C@H](C#N)C2)CC[C@@H]1c1ccccc1	ZINC000278737075	263050347	/nfs/dbraw/zinc/05/03/47/263050347.db2.gz	WGCZFGVOBAFBCA-ISARSNTHSA-N	1	0	282.431	4.194	20	30		CIEDRO
Cc1ccc([C@H]([NH2+]CCC(C)(C)C#N)c2ccccn2)cc1	ZINC000280082547	263058998	/nfs/dbraw/zinc/05/89/98/263058998.db2.gz	NYKWLDSVFORQSC-SFHVURJKSA-N	1	0	293.414	4.009	20	30		CIEDRO
N#CCCCC[NH+]1CCC(c2cccc(Cl)c2)CC1	ZINC000280635146	263063434	/nfs/dbraw/zinc/06/34/34/263063434.db2.gz	XSANDYZHZLTNSR-UHFFFAOYSA-N	1	0	276.811	4.213	20	30		CIEDRO
C[C@H]([NH2+]CCCCC#N)[C@@H](C)c1ccc(Cl)cc1	ZINC000280960957	263065363	/nfs/dbraw/zinc/06/53/63/263065363.db2.gz	SJIZDGNGKYNHIA-OLZOCXBDSA-N	1	0	264.800	4.115	20	30		CIEDRO
CSc1ccc([C@@H](C)[NH2+]CCCC(C)(C)C#N)cc1	ZINC000281453224	263069351	/nfs/dbraw/zinc/06/93/51/263069351.db2.gz	QPQCLYISQHDGLO-CYBMUJFWSA-N	1	0	276.449	4.389	20	30		CIEDRO
C[C@@H]([NH2+]CC1CCC(C#N)CC1)c1csc(Cl)c1	ZINC000282117689	263074433	/nfs/dbraw/zinc/07/44/33/263074433.db2.gz	AOVZKTQOCWQEAG-VOMCLLRMSA-N	1	0	282.840	4.382	20	30		CIEDRO
CCc1ccc([C@@H](C)[NH2+]CC2CCC(C#N)CC2)s1	ZINC000282154482	263074693	/nfs/dbraw/zinc/07/46/93/263074693.db2.gz	CZLYYQYHTHJSIY-IYXRBSQSSA-N	1	0	276.449	4.291	20	30		CIEDRO
CC(C)c1nc([C@H](C)[NH2+]CC2CCC(C#N)CC2)cs1	ZINC000282191916	263074903	/nfs/dbraw/zinc/07/49/03/263074903.db2.gz	GGSKDVAAVIPOON-HSBZDZAISA-N	1	0	291.464	4.247	20	30		CIEDRO
C[C@H](CCc1ccccc1F)[NH2+]CC1CCC(C#N)CC1	ZINC000282180213	263074956	/nfs/dbraw/zinc/07/49/56/263074956.db2.gz	FOPRBPAGTSHDRR-QQFBHYJXSA-N	1	0	288.410	4.066	20	30		CIEDRO
N#CC1CCC(C[NH2+]Cc2ccccc2C(F)(F)F)CC1	ZINC000282206840	263075020	/nfs/dbraw/zinc/07/50/20/263075020.db2.gz	CZTVUPBFVSLOKQ-UHFFFAOYSA-N	1	0	296.336	4.125	20	30		CIEDRO
Cc1ccc([C@@H](C)[NH2+]CC2CCC(C#N)CC2)s1	ZINC000282311452	263075754	/nfs/dbraw/zinc/07/57/54/263075754.db2.gz	NAVYATPINPDQPS-IYXRBSQSSA-N	1	0	262.422	4.037	20	30		CIEDRO
CC[C@H]([NH2+]CC1CCC(C#N)CC1)c1ccc(C)cc1O	ZINC000282325152	263075867	/nfs/dbraw/zinc/07/58/67/263075867.db2.gz	NTWXFPDEHMIMIC-DQPZFDDXSA-N	1	0	286.419	4.071	20	30		CIEDRO
C[C@@H]([NH2+]CC1CCC(C#N)CC1)c1ccc2ccccc2n1	ZINC000282345127	263076008	/nfs/dbraw/zinc/07/60/08/263076008.db2.gz	OZBHGPLTJRSOAZ-QQFBHYJXSA-N	1	0	293.414	4.215	20	30		CIEDRO
C[C@H]1CC[C@H](c2ccccc2)[N@H+](CCCCC#N)C1	ZINC000285609993	263094555	/nfs/dbraw/zinc/09/45/55/263094555.db2.gz	QBEYYQPGMXUPON-DOTOQJQBSA-N	1	0	256.393	4.153	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CCCn2c(cc3ccccc32)C1	ZINC000287562797	263102159	/nfs/dbraw/zinc/10/21/59/263102159.db2.gz	ZCUSPJIRNRMGNJ-UHFFFAOYSA-N	1	0	295.430	4.177	20	30		CIEDRO
C[C@]1(CCc2ccccc2)CC[N@@H+]([C@H]2CC[C@H](C#N)C2)C1	ZINC000292914695	263136267	/nfs/dbraw/zinc/13/62/67/263136267.db2.gz	XKZAKKHPEKCESI-FHWLQOOXSA-N	1	0	282.431	4.023	20	30		CIEDRO
C[C@H]1c2ccc(Cl)n2CC[N@H+]1CCCCC(C)(C)C#N	ZINC000293146973	263138325	/nfs/dbraw/zinc/13/83/25/263138325.db2.gz	MFOVYXPBLQYJMK-ZDUSSCGKSA-N	1	0	293.842	4.238	20	30		CIEDRO
C[C@@H](CC1CC1)[NH2+][C@@H](CCCC#N)c1ccccc1	ZINC000340447922	263154254	/nfs/dbraw/zinc/15/42/54/263154254.db2.gz	HQYVTCYGKLTFIV-YOEHRIQHSA-N	1	0	256.393	4.200	20	30		CIEDRO
C[C@H](CC1CC1)[NH2+][C@@H](CCCC#N)c1ccccc1	ZINC000340447919	263154431	/nfs/dbraw/zinc/15/44/31/263154431.db2.gz	HQYVTCYGKLTFIV-PBHICJAKSA-N	1	0	256.393	4.200	20	30		CIEDRO
COC[C@H](CC(C)C)[NH2+][C@@H](CCCC#N)c1ccccc1	ZINC000340451105	263155983	/nfs/dbraw/zinc/15/59/83/263155983.db2.gz	ZXTXHAZAANXTEK-ROUUACIJSA-N	1	0	288.435	4.072	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@H]2Cc2ccccc2)C1	ZINC000295005589	263170796	/nfs/dbraw/zinc/17/07/96/263170796.db2.gz	IZCJTPLYJVJSTD-CADBVGFASA-N	1	0	282.431	4.070	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccccc1C(F)(F)F	ZINC000295106792	263172375	/nfs/dbraw/zinc/17/23/75/263172375.db2.gz	UIXINKUKJRWZCE-AGIUHOORSA-N	1	0	296.336	4.438	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+]Cc2cccc3ccccc32)C1	ZINC000295126113	263172525	/nfs/dbraw/zinc/17/25/25/263172525.db2.gz	XIOKKPCIUDTEJR-YOEHRIQHSA-N	1	0	264.372	4.012	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+]Cc2ccc(Cl)c(Cl)c2)C1	ZINC000295115521	263172809	/nfs/dbraw/zinc/17/28/09/263172809.db2.gz	VRNUFLADVGOANJ-JQWIXIFHSA-N	1	0	283.202	4.165	20	30		CIEDRO
CSc1ccc([C@H](C)[NH2+][C@H]2CC[C@@H](CC#N)C2)cc1	ZINC000296411685	263191158	/nfs/dbraw/zinc/19/11/58/263191158.db2.gz	KXCSFOWYNDKILO-YDHLFZDLSA-N	1	0	274.433	4.141	20	30		CIEDRO
C[C@H]1C[C@@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)c2ccsc2S1	ZINC000296591856	263194160	/nfs/dbraw/zinc/19/41/60/263194160.db2.gz	UZSUELGFQIYYEG-ZJQBRPOHSA-N	1	0	292.473	4.345	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccccc1OC(F)F	ZINC000296652881	263194732	/nfs/dbraw/zinc/19/47/32/263194732.db2.gz	ZBQHAIQJYLAIKJ-AGIUHOORSA-N	1	0	294.345	4.021	20	30		CIEDRO
C/C(=C\c1cccc(C(F)(F)F)c1)C[NH2+]CCCC#N	ZINC000342191694	263397556	/nfs/dbraw/zinc/39/75/56/263397556.db2.gz	RBDCCNMKADRPOE-FMIVXFBMSA-N	1	0	282.309	4.002	20	30		CIEDRO
COc1cc(C[N@H+](C)[C@H](C)c2cccc(C#N)c2)ccc1C	ZINC000425365085	264210889	/nfs/dbraw/zinc/21/08/89/264210889.db2.gz	IREDJDMGBYWDNS-OAHLLOKOSA-N	1	0	294.398	4.068	20	30		CIEDRO
C[C@H](c1cccc(C#N)c1)[N@H+](C)Cc1cc(Cl)cs1	ZINC000425367554	264211998	/nfs/dbraw/zinc/21/19/98/264211998.db2.gz	UCENORMJPYFEMU-LLVKDONJSA-N	1	0	290.819	4.466	20	30		CIEDRO
C=CCCC[NH+]1CCC(c2nc3cccc(C)c3o2)CC1	ZINC000189815504	264327455	/nfs/dbraw/zinc/32/74/55/264327455.db2.gz	QOXGVNULZDMZOI-UHFFFAOYSA-N	1	0	284.403	4.282	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+][C@H]2C[C@H](c3ccc(Cl)cc3)C2)C1	ZINC000475672888	264335515	/nfs/dbraw/zinc/33/55/15/264335515.db2.gz	PENWCTZVERFIMV-SDNTUTLCSA-N	1	0	288.822	4.258	20	30		CIEDRO
CC(C)C1(C)CC[NH+](CC(C)(C)CCC#N)CC1	ZINC000189949363	264338114	/nfs/dbraw/zinc/33/81/14/264338114.db2.gz	BTPWEKOSGUWPIS-UHFFFAOYSA-N	1	0	250.430	4.074	20	30		CIEDRO
C#CCCCC[NH2+][C@@H](C)c1sc(C(C)C)nc1C	ZINC000090398506	264399731	/nfs/dbraw/zinc/39/97/31/264399731.db2.gz	NBSSKVGQCDJQNY-LBPRGKRZSA-N	1	0	264.438	4.029	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+][C@H](C)c1cc2ccccc2o1	ZINC000280896244	264451099	/nfs/dbraw/zinc/45/10/99/264451099.db2.gz	QMROYLZIVPCRFX-XUWXXGDYSA-N	1	0	285.387	4.065	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccco1	ZINC000285830130	264568970	/nfs/dbraw/zinc/56/89/70/264568970.db2.gz	WXAQPTYHHGLOIG-KRWDZBQOSA-N	1	0	284.403	4.143	20	30		CIEDRO
C[C@@H]1CCCC[C@H]1C[NH2+][C@@H](CCC#N)c1ccccc1	ZINC000344300054	265057103	/nfs/dbraw/zinc/05/71/03/265057103.db2.gz	HZQWFERGDLEGFI-NJAFHUGGSA-N	1	0	270.420	4.447	20	30		CIEDRO
C=CCCCCC[NH2+]C1(c2ccccc2)CCOCC1	ZINC000519855337	265626951	/nfs/dbraw/zinc/62/69/51/265626951.db2.gz	KAWDIMXCOVGUKB-UHFFFAOYSA-N	1	0	273.420	4.028	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C#N)cc1)c1ccc(C2CC2)cc1	ZINC000418107925	266110678	/nfs/dbraw/zinc/11/06/78/266110678.db2.gz	FJTSJAGOGLITCB-CQSZACIVSA-N	1	0	276.383	4.286	20	30		CIEDRO
C=CCSCC[NH2+][C@@H]1CCSc2c(Cl)cccc21	ZINC000358023951	266399761	/nfs/dbraw/zinc/39/97/61/266399761.db2.gz	LYABPMHXLYDHQZ-CYBMUJFWSA-N	1	0	299.892	4.386	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H]1CCCOc2ccc(Cl)cc21	ZINC000358046681	266406079	/nfs/dbraw/zinc/40/60/79/266406079.db2.gz	ZXVOEJIZCBYQEM-FZMZJTMJSA-N	1	0	265.784	4.108	20	30		CIEDRO
C=CCCCC[NH2+][C@H]1CCCc2nn(-c3ccccc3)cc21	ZINC000358987572	266518344	/nfs/dbraw/zinc/51/83/44/266518344.db2.gz	MZRVEARPTPAFGF-SFHVURJKSA-N	1	0	295.430	4.196	20	30		CIEDRO
CCC1(C[NH2+][C@H]2CCCCc3cc(C#N)ccc32)CC1	ZINC000360648184	266731250	/nfs/dbraw/zinc/73/12/50/266731250.db2.gz	PSNLDKOBATXZKN-KRWDZBQOSA-N	1	0	268.404	4.106	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H]1CCC[C@H]1c1ccc(F)cc1	ZINC000367899079	267125570	/nfs/dbraw/zinc/12/55/70/267125570.db2.gz	GIIVRWGJCAYQLO-IRXDYDNUSA-N	1	0	288.410	4.381	20	30		CIEDRO
Cc1ccc2c(c1)[C@H]([NH2+]CC(C)(C)CCC#N)CCCO2	ZINC000367904913	267126709	/nfs/dbraw/zinc/12/67/09/267126709.db2.gz	RYWMPPMUQDAIGZ-MRXNPFEDSA-N	1	0	286.419	4.128	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1CC[C@@H](c2ccccc2)C1	ZINC000368595016	267190140	/nfs/dbraw/zinc/19/01/40/267190140.db2.gz	XVUJIRCQRVVTIT-IAGOWNOFSA-N	1	0	270.420	4.242	20	30		CIEDRO
C=CC1CC[NH+]([C@H](C)c2nnc(-c3cccc(C)c3)o2)CC1	ZINC000369191576	267225308	/nfs/dbraw/zinc/22/53/08/267225308.db2.gz	KPJCIQPQFXKKPS-CQSZACIVSA-N	1	0	297.402	4.004	20	30		CIEDRO
N#CCCCC[NH+]1CCC(=Cc2ccc(F)c(F)c2)CC1	ZINC000369569647	267252412	/nfs/dbraw/zinc/25/24/12/267252412.db2.gz	ZTLCMZSOGOHJDL-UHFFFAOYSA-N	1	0	290.357	4.138	20	30		CIEDRO
CCC[C@H]([NH2+]CCCCC#N)c1ccc(Cl)cc1	ZINC000118967548	267281546	/nfs/dbraw/zinc/28/15/46/267281546.db2.gz	KFGDQKKNLGGGLB-HNNXBMFYSA-N	1	0	264.800	4.465	20	30		CIEDRO
N#CCCCC[NH2+][C@H]1CCCOc2cc3c(cc21)CCCC3	ZINC000370733151	267341967	/nfs/dbraw/zinc/34/19/67/267341967.db2.gz	XYURLIJWTUDPMW-SFHVURJKSA-N	1	0	298.430	4.063	20	30		CIEDRO
C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+]CC1(C#N)CCC1	ZINC000418141384	267363312	/nfs/dbraw/zinc/36/33/12/267363312.db2.gz	KZFYWQSIZHMHKD-OLZOCXBDSA-N	1	0	299.443	4.072	20	30		CIEDRO
N#CC1(C[NH2+][C@@H]2CCC[C@@H]2c2ccccc2Cl)CCC1	ZINC000418142246	267363823	/nfs/dbraw/zinc/36/38/23/267363823.db2.gz	MKQAVOPLFXWXKX-GDBMZVCRSA-N	1	0	288.822	4.260	20	30		CIEDRO
N#CC1(C[NH2+][C@H]2CCC[C@H]2c2ccccc2Cl)CCC1	ZINC000418142251	267363951	/nfs/dbraw/zinc/36/39/51/267363951.db2.gz	MKQAVOPLFXWXKX-HOCLYGCPSA-N	1	0	288.822	4.260	20	30		CIEDRO
N#CC1(C[NH2+][C@H]2CC[C@H](c3ccc(Cl)cc3)C2)CCC1	ZINC000418144409	267364689	/nfs/dbraw/zinc/36/46/89/267364689.db2.gz	TXJTZNAFNKWXNU-HOCLYGCPSA-N	1	0	288.822	4.260	20	30		CIEDRO
C[C@H]([NH2+]CC1(C#N)CCC1)[C@@H](C)c1ccc(Cl)cc1	ZINC000418143551	267365511	/nfs/dbraw/zinc/36/55/11/267365511.db2.gz	QGAGSTNJBIWAKD-OLZOCXBDSA-N	1	0	276.811	4.115	20	30		CIEDRO
Cc1cc(C[NH2+][C@H]2CCCc3cc(C#N)ccc32)cs1	ZINC000418153036	267372542	/nfs/dbraw/zinc/37/25/42/267372542.db2.gz	YKGOHYJTWMWVAA-KRWDZBQOSA-N	1	0	282.412	4.095	20	30		CIEDRO
C[C@H]1C[C@@H](c2ccsc2)C[N@@H+]1CC(C)(C)CCC#N	ZINC000371399067	267399460	/nfs/dbraw/zinc/39/94/60/267399460.db2.gz	WGTBRELNEZVXQS-DZGCQCFKSA-N	1	0	276.449	4.256	20	30		CIEDRO
CC(C)(CCC#N)C[N@@H+]1CCSC[C@@H]1c1cccs1	ZINC000374255582	267767834	/nfs/dbraw/zinc/76/78/34/267767834.db2.gz	KIAIEIMQCGRAJK-CYBMUJFWSA-N	1	0	294.489	4.168	20	30		CIEDRO
C=CCCC[NH2+][C@@H]1CCc2sc(Br)cc21	ZINC000379826013	335091629	/nfs/dbraw/zinc/09/16/29/335091629.db2.gz	WOYSWLAKMMNRCI-SNVBAGLBSA-N	1	0	286.238	4.054	20	30		CIEDRO
C=C[C@H](C)[NH2+][C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1	ZINC000378800447	327758412	/nfs/dbraw/zinc/75/84/12/327758412.db2.gz	TVWMKHZMRSRPQQ-ZRUFSTJUSA-N	1	0	255.814	4.058	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H](C)c2cccc(OC)c2)cc1	ZINC000378913794	327766019	/nfs/dbraw/zinc/76/60/19/327766019.db2.gz	UYAJYRCMBAHQAJ-HNNXBMFYSA-N	1	0	297.398	4.111	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@H]1CCOC2(CCSCC2)C1	ZINC000540159351	327780841	/nfs/dbraw/zinc/78/08/41/327780841.db2.gz	CUSUCNKCSDHEMO-HOTGVXAUSA-N	1	0	297.508	4.156	20	30		CIEDRO
COc1ccc2oc([C@H](C)[NH2+]CCCCC#N)c(C)c2c1	ZINC000178646379	327795030	/nfs/dbraw/zinc/79/50/30/327795030.db2.gz	UYQMWVMJCXMXIV-ZDUSSCGKSA-N	1	0	286.375	4.094	20	30		CIEDRO
Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]CCCCC#N	ZINC000178647402	327795348	/nfs/dbraw/zinc/79/53/48/327795348.db2.gz	PGRZXWFMJZYGSF-LLVKDONJSA-N	1	0	279.453	4.094	20	30		CIEDRO
C[C@H]([NH2+]CCCC(C)(C)C#N)c1cccc(N2CCCC2)c1	ZINC000181861203	327810399	/nfs/dbraw/zinc/81/03/99/327810399.db2.gz	HPAZSVLKKPPEND-INIZCTEOSA-N	1	0	299.462	4.267	20	30		CIEDRO
C[C@H]([NH2+][C@H](c1cccs1)C1CC1)c1cccc(C#N)c1	ZINC000540596946	327893798	/nfs/dbraw/zinc/89/37/98/327893798.db2.gz	IFLQBUXZNAYJHL-SJCJKPOMSA-N	1	0	282.412	4.422	20	30		CIEDRO
CCC[C@@H]1CCCC[C@@H]1[NH2+]CCCC1(C#N)CCOCC1	ZINC000531444708	327908006	/nfs/dbraw/zinc/90/80/06/327908006.db2.gz	OHGDHELXVCPYBO-SJORKVTESA-N	1	0	292.467	4.035	20	30		CIEDRO
CC(C)(C[NH2+][C@@H]1CCC[C@H](C#N)C1)c1cccc(Cl)c1	ZINC000463284759	327915736	/nfs/dbraw/zinc/91/57/36/327915736.db2.gz	WDPRAZFLQFYQMD-XJKSGUPXSA-N	1	0	290.838	4.290	20	30		CIEDRO
C[C@H]([NH2+]CC1CCC(C)CC1)c1ccc(C#N)cc1	ZINC000063144417	328034493	/nfs/dbraw/zinc/03/44/93/328034493.db2.gz	BERGSIJGBSMSRA-BBBYJDLNSA-N	1	0	256.393	4.035	20	30		CIEDRO
CC(C)(C#N)CC[N@H+](Cc1ccc(Cl)cc1)C1CC1	ZINC000534215874	328039494	/nfs/dbraw/zinc/03/94/94/328039494.db2.gz	WQVZTMOIWIOETD-UHFFFAOYSA-N	1	0	276.811	4.244	20	30		CIEDRO
C[C@H]([NH2+]CCCCC#N)c1ccccc1C(C)(C)C	ZINC000534352440	328048192	/nfs/dbraw/zinc/04/81/92/328048192.db2.gz	METWFFZSTMDPTL-AWEZNQCLSA-N	1	0	258.409	4.329	20	30		CIEDRO
CC(C)CC[N@H+](Cc1cccc(C#N)c1)C1CCCC1	ZINC000110364310	328048888	/nfs/dbraw/zinc/04/88/88/328048888.db2.gz	XTQZGSHNFURSOU-UHFFFAOYSA-N	1	0	270.420	4.349	20	30		CIEDRO
C=CCCCCC[NH2+][C@@H](C)c1ccc2c(c1)COC2	ZINC000563416319	328063149	/nfs/dbraw/zinc/06/31/49/328063149.db2.gz	IAJHACTVFKDUBU-AWEZNQCLSA-N	1	0	259.393	4.114	20	30		CIEDRO
COc1cc(C[NH2+][C@@H](C)c2cccc(C)c2C)ccc1C#N	ZINC000571096572	328085186	/nfs/dbraw/zinc/08/51/86/328085186.db2.gz	NRNAFXAQACUZKM-HNNXBMFYSA-N	1	0	294.398	4.035	20	30		CIEDRO
CC(C)[N@H+](CCC#N)C[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000571271839	328097242	/nfs/dbraw/zinc/09/72/42/328097242.db2.gz	JJAFFNWRKWAJNK-CYBMUJFWSA-N	1	0	298.352	4.433	20	30		CIEDRO
C[C@H](CCC#N)[N@@H+]1CC[C@H](Sc2cccc(Cl)c2)C1	ZINC000411757363	328098675	/nfs/dbraw/zinc/09/86/75/328098675.db2.gz	LXDOMWHBEVBCDP-DOMZBBRYSA-N	1	0	294.851	4.199	20	30		CIEDRO
C=CCCCCC[NH2+][C@@H](C)c1ccc(-n2ccnc2)cc1	ZINC000571496794	328127078	/nfs/dbraw/zinc/12/70/78/328127078.db2.gz	MQEOPMDLMBBWGK-INIZCTEOSA-N	1	0	283.419	4.269	20	30		CIEDRO
C[C@H]1C[C@H]([NH2+]Cc2ccc(CC#N)cc2)c2ccccc21	ZINC000571641844	328167250	/nfs/dbraw/zinc/16/72/50/328167250.db2.gz	RZSXDMCVXDLUEC-LIRRHRJNSA-N	1	0	276.383	4.091	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]C1CC(C)(c2ccccc2)C1	ZINC000266236569	328168541	/nfs/dbraw/zinc/16/85/41/328168541.db2.gz	WAQKLGRFRRGWJF-UHFFFAOYSA-N	1	0	270.420	4.026	20	30		CIEDRO
CCCCCCCC(=O)Nc1ccccc1CC[NH+](C)C	ZINC000275668701	328215883	/nfs/dbraw/zinc/21/58/83/328215883.db2.gz	ORZMUNSQQDPGKY-UHFFFAOYSA-N	1	0	290.451	4.090	20	30		CIEDRO
N#C[C@H]1CC[C@H](N2CCc3cc(Cl)cc(Cl)c3C2)C1	ZINC000278627769	328228757	/nfs/dbraw/zinc/22/87/57/328228757.db2.gz	NWJCKKPXQFMKSX-GWCFXTLKSA-N	1	0	295.213	4.044	20	30		CIEDRO
CC(C)[C@@H]([NH2+]CCCC#N)c1ccc(Cl)cc1F	ZINC000180262704	329218987	/nfs/dbraw/zinc/21/89/87/329218987.db2.gz	HWXNIUJFMUNFSU-CQSZACIVSA-N	1	0	268.763	4.070	20	30		CIEDRO
C[C@@H]1CCC[C@@H]1[NH2+][C@H](CCCC#N)c1ccccc1	ZINC000340444348	328278256	/nfs/dbraw/zinc/27/82/56/328278256.db2.gz	DGRBIXXGFGBLTE-HYVNUMGLSA-N	1	0	256.393	4.200	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccc(Cl)cc1	ZINC000295053632	328284462	/nfs/dbraw/zinc/28/44/62/328284462.db2.gz	NSSJHWSKVAPYFL-XUJVJEKNSA-N	1	0	262.784	4.073	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)C1	ZINC000295064347	328284834	/nfs/dbraw/zinc/28/48/34/328284834.db2.gz	ORHBBJOOOSIWSR-JVPBZIDWSA-N	1	0	298.405	4.434	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+]Cc2csc3ccccc23)C1	ZINC000295091298	328285153	/nfs/dbraw/zinc/28/51/53/328285153.db2.gz	RQZKLZGJLKAUHN-JSGCOSHPSA-N	1	0	270.401	4.073	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+]Cc1ccc2ccccc2n1	ZINC000531955740	328331134	/nfs/dbraw/zinc/33/11/34/328331134.db2.gz	BQUSIDVOOAPXAB-MRXNPFEDSA-N	1	0	268.404	4.459	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@H](COCC(C)C)c1ccco1	ZINC000531961424	328337170	/nfs/dbraw/zinc/33/71/70/328337170.db2.gz	KRUBRRPSMRAURT-HRCADAONSA-N	1	0	279.424	4.184	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H](C)c2ccc(C)s2)cc1	ZINC000049158943	328351113	/nfs/dbraw/zinc/35/11/13/328351113.db2.gz	HPFUJFFVAGZKMS-AWEZNQCLSA-N	1	0	287.428	4.472	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+]Cc1ccc2[nH]c(C)cc2c1	ZINC000563690482	328478451	/nfs/dbraw/zinc/47/84/51/328478451.db2.gz	AOEBIXRGVBGHTC-JSGCOSHPSA-N	1	0	256.393	4.167	20	30		CIEDRO
C=CCCOCC[NH2+][C@@H](c1ccccc1)c1ccc(F)cc1	ZINC000389045847	328606475	/nfs/dbraw/zinc/60/64/75/328606475.db2.gz	FWCPMTBSZHBWDE-IBGZPJMESA-N	1	0	299.389	4.097	20	30		CIEDRO
N#CCCC1CC[NH+](CC/C=C/c2ccccc2)CC1	ZINC000399463689	326789962	/nfs/dbraw/zinc/78/99/62/326789962.db2.gz	QNKRLNKQKJIODG-RUDMXATFSA-N	1	0	268.404	4.106	20	30		CIEDRO
C[C@H]([NH2+][C@H]1c2ccccc2C[C@@H]1C)c1ccc(C#N)cc1	ZINC000538407162	326830340	/nfs/dbraw/zinc/83/03/40/326830340.db2.gz	MPUZCQRPSRZOBY-CKFHNAJUSA-N	1	0	276.383	4.142	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@H](c2ccc(Cl)cc2)C2CC2)c1	ZINC000037488998	326853733	/nfs/dbraw/zinc/85/37/33/326853733.db2.gz	GEJAYTZCTFOUNE-SFHVURJKSA-N	1	0	296.801	4.453	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](C)c1ccc(-n2cccn2)cc1	ZINC000539341847	326936207	/nfs/dbraw/zinc/93/62/07/326936207.db2.gz	HHPBEZPUSKWNQN-JKSUJKDBSA-N	1	0	283.419	4.268	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H]2CCc3c2cccc3F)cc1	ZINC000506631829	332775798	/nfs/dbraw/zinc/77/57/98/332775798.db2.gz	KOVWWAPNOCKYDF-IBGZPJMESA-N	1	0	297.373	4.168	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCSCC(F)(F)F)c1ccco1	ZINC000556885089	326978747	/nfs/dbraw/zinc/97/87/47/326978747.db2.gz	GLIBAPVBYPBJRR-NSHDSACASA-N	1	0	293.354	4.172	20	30		CIEDRO
CCCC[N@H+](Cc1nc(C#N)cs1)[C@H]1CCC[C@@H](C)C1	ZINC000557395624	327004353	/nfs/dbraw/zinc/00/43/53/327004353.db2.gz	PBDJHNRSDYUYFK-HIFRSBDPSA-N	1	0	291.464	4.196	20	30		CIEDRO
CC[N@H+](Cc1ccc(Cl)cn1)[C@H](C)c1ccc(C#N)cc1	ZINC000557454901	327006575	/nfs/dbraw/zinc/00/65/75/327006575.db2.gz	URSOXVMDWBIZEV-CYBMUJFWSA-N	1	0	299.805	4.190	20	30		CIEDRO
C[C@@H](Cc1ccsc1)[NH2+][C@H]1CCCc2cc(C#N)ccc21	ZINC000557515793	327011364	/nfs/dbraw/zinc/01/13/64/327011364.db2.gz	GKWKDDOYXJGJFZ-UGSOOPFHSA-N	1	0	296.439	4.218	20	30		CIEDRO
CC[C@@H](CC#N)[NH2+]Cc1ccc(Cl)c2ccccc12	ZINC000576886569	327047192	/nfs/dbraw/zinc/04/71/92/327047192.db2.gz	YTTUTOAWNZONKB-ZDUSSCGKSA-N	1	0	272.779	4.275	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H](CCc1ccccc1)C(F)F	ZINC000558248941	327081214	/nfs/dbraw/zinc/08/12/14/327081214.db2.gz	WDCZIKABHXGMFS-HNNXBMFYSA-N	1	0	294.389	4.172	20	30		CIEDRO
Cc1cc(CNc2cccc(C(F)F)c2C#N)cc(C)n1	ZINC000565902782	327086020	/nfs/dbraw/zinc/08/60/20/327086020.db2.gz	BOAQSTONYOLYRI-UHFFFAOYSA-N	1	0	287.313	4.120	20	30		CIEDRO
CC[N@H+](CCC1CC1)Cc1ccc(C#N)cc1C(F)(F)F	ZINC000558575551	327106738	/nfs/dbraw/zinc/10/67/38/327106738.db2.gz	POPIBSHWLSJKRU-UHFFFAOYSA-N	1	0	296.336	4.199	20	30		CIEDRO
C=CCCc1ccccc1NC1CC[NH+](CC2CC2)CC1	ZINC000558621257	327109126	/nfs/dbraw/zinc/10/91/26/327109126.db2.gz	CRNAPZRCJQOVNW-UHFFFAOYSA-N	1	0	284.447	4.092	20	30		CIEDRO
N#CCSCCC[N@H+]1CCC[C@H]1c1ccc(Cl)cc1	ZINC000074980969	327122784	/nfs/dbraw/zinc/12/27/84/327122784.db2.gz	CIGVRMDGWMWCND-HNNXBMFYSA-N	1	0	294.851	4.124	20	30		CIEDRO
CCc1oc2ccccc2c1C[N@H+](C)[C@@H]1CC[C@@H](C#N)C1	ZINC000559035306	327138584	/nfs/dbraw/zinc/13/85/84/327138584.db2.gz	YVPBNLBGMASJCW-ZIAGYGMSSA-N	1	0	282.387	4.119	20	30		CIEDRO
CN(Cc1cccc(Cl)c1Cl)[C@H]1CC[C@@H](C#N)C1	ZINC000559037363	327138602	/nfs/dbraw/zinc/13/86/02/327138602.db2.gz	QMGMTRMUHUYWAH-PWSUYJOCSA-N	1	0	283.202	4.117	20	30		CIEDRO
C=CCOCC[N@@H+](C)[C@@H](C)c1ccc(Cl)c(Cl)c1	ZINC000559067038	327139729	/nfs/dbraw/zinc/13/97/29/327139729.db2.gz	VRFOQFFLYLEDEP-NSHDSACASA-N	1	0	288.218	4.189	20	30		CIEDRO
C[C@@H]1C[C@@H]1[C@H]([NH2+][C@H]1CC[C@H](C#N)C1)c1ccc(Cl)cc1	ZINC000559150200	327143854	/nfs/dbraw/zinc/14/38/54/327143854.db2.gz	TYLBQMMEZVATGC-JAXWNDFKSA-N	1	0	288.822	4.319	20	30		CIEDRO
C[C@H](c1ccco1)[N@H+](CCCC(C)(C)C#N)C1CC1	ZINC000086233775	327156262	/nfs/dbraw/zinc/15/62/62/327156262.db2.gz	MZTDAEZFLOSEER-CYBMUJFWSA-N	1	0	260.381	4.135	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H]2CCc3sc(Cl)cc32)cc1	ZINC000129578286	327156729	/nfs/dbraw/zinc/15/67/29/327156729.db2.gz	ASVXJMDPRIDBRG-ZDUSSCGKSA-N	1	0	288.803	4.050	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+]Cc1coc2ccccc12	ZINC000559306180	327157053	/nfs/dbraw/zinc/15/70/53/327157053.db2.gz	ABHDCDYAYVRKSX-UHFFFAOYSA-N	1	0	293.366	4.287	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H](C)CCC(C)C)cc1OC	ZINC000409851913	327166464	/nfs/dbraw/zinc/16/64/64/327166464.db2.gz	XCYNSDRPPOJIRO-OAHLLOKOSA-N	1	0	291.435	4.174	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H](C)CCC(C)C)cc1OC	ZINC000409851912	327166517	/nfs/dbraw/zinc/16/65/17/327166517.db2.gz	XCYNSDRPPOJIRO-HNNXBMFYSA-N	1	0	291.435	4.174	20	30		CIEDRO
C[C@@H]([NH2+]CC(C)(C)c1cccs1)c1ccc(C#N)cc1	ZINC000091437214	327170079	/nfs/dbraw/zinc/17/00/79/327170079.db2.gz	JYKQBEYYCOZBSN-CYBMUJFWSA-N	1	0	284.428	4.248	20	30		CIEDRO
C=CCCC[NH2+][C@H](C)c1ccc(SC)c(F)c1	ZINC000569509117	327186656	/nfs/dbraw/zinc/18/66/56/327186656.db2.gz	WINRRROPJJJQGK-LLVKDONJSA-N	1	0	253.386	4.164	20	30		CIEDRO
C[C@H]([NH2+]C[C@@H]1CSc2ccccc21)c1ccc(C#N)cc1	ZINC000092274930	327191186	/nfs/dbraw/zinc/19/11/86/327191186.db2.gz	JJMCJLUPODACTI-XJKSGUPXSA-N	1	0	294.423	4.098	20	30		CIEDRO
CCCCC[C@@H]1CCC[N@@H+]1CCCC1(C#N)CCOCC1	ZINC000410413290	327192515	/nfs/dbraw/zinc/19/25/15/327192515.db2.gz	KCYZMKPALMWGSU-QGZVFWFLSA-N	1	0	292.467	4.132	20	30		CIEDRO
CC(C)CC[C@H]1CCC[N@@H+]1CC(C)(C)CCC#N	ZINC000093845106	327200532	/nfs/dbraw/zinc/20/05/32/327200532.db2.gz	GFPXOAYGBNQWJY-OAHLLOKOSA-N	1	0	250.430	4.217	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@H](C)c1cncnc1C)c1ccccc1	ZINC000564472048	327239650	/nfs/dbraw/zinc/23/96/50/327239650.db2.gz	XYNDBTLBRRQOEV-QAPCUYQASA-N	1	0	281.403	4.143	20	30		CIEDRO
C[C@@H]([NH2+]CC[C@H](C)c1ccccc1)c1ccc(C#N)cc1	ZINC000043533625	327260188	/nfs/dbraw/zinc/26/01/88/327260188.db2.gz	IECCMWRMJJHROO-JKSUJKDBSA-N	1	0	278.399	4.403	20	30		CIEDRO
C=CCSCC[NH2+][C@H](C)c1cccc(C2CC2)c1	ZINC000559789320	327261311	/nfs/dbraw/zinc/26/13/11/327261311.db2.gz	ZQBNELMRFCWESX-CYBMUJFWSA-N	1	0	261.434	4.134	20	30		CIEDRO
C[C@H]([NH2+][C@@H](C)C1CCCCC1)c1ccc(C#N)c(F)c1	ZINC000573872037	327265999	/nfs/dbraw/zinc/26/59/99/327265999.db2.gz	WDXBNMSHDDFZRA-STQMWFEESA-N	1	0	274.383	4.317	20	30		CIEDRO
C=C(C)C[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1	ZINC000560259173	327294281	/nfs/dbraw/zinc/29/42/81/327294281.db2.gz	QFUZBFSOHMMLER-UHFFFAOYSA-N	1	0	278.808	4.129	20	30		CIEDRO
C[C@@H]1CC[C@@H]([NH2+]CCCCC(C)(C)C#N)[C@H](C)C1	ZINC000300119479	332792986	/nfs/dbraw/zinc/79/29/86/332792986.db2.gz	FWOJUAKYWYYMPH-RBSFLKMASA-N	1	0	250.430	4.121	20	30		CIEDRO
C[C@@H]([NH2+]C1(c2cccc(C#N)c2)CC1)[C@H](C)c1ccccc1	ZINC000560269297	327295059	/nfs/dbraw/zinc/29/50/59/327295059.db2.gz	UKGVCZRXKCUMGE-JKSUJKDBSA-N	1	0	290.410	4.329	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1ccc(OCc2cccnc2)cc1	ZINC000560462081	327310620	/nfs/dbraw/zinc/31/06/20/327310620.db2.gz	ZCSDNSSWWYYKTN-INIZCTEOSA-N	1	0	296.414	4.277	20	30		CIEDRO
CCCC[C@@H]([NH2+]Cc1ccc(C#N)s1)C1CCC1	ZINC000574365377	327318635	/nfs/dbraw/zinc/31/86/35/327318635.db2.gz	AEAVRWBWFUKLHN-OAHLLOKOSA-N	1	0	262.422	4.068	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+]C1(c2cccc(OC)c2)CC1	ZINC000560573164	327326718	/nfs/dbraw/zinc/32/67/18/327326718.db2.gz	FXSGLYIDMBKCLP-HNNXBMFYSA-N	1	0	259.393	4.019	20	30		CIEDRO
CC(C)(CCc1ccccc1)[NH2+]Cc1cc(C#N)ccc1F	ZINC000387566797	327344046	/nfs/dbraw/zinc/34/40/46/327344046.db2.gz	IQXGUYXJOCUHOP-UHFFFAOYSA-N	1	0	296.389	4.198	20	30		CIEDRO
CC1=C[C@@H](C)C[C@@H](C[NH2+]C2(c3cccc(C#N)c3)CC2)C1	ZINC000564409893	327351589	/nfs/dbraw/zinc/35/15/89/327351589.db2.gz	FBHGZTFOSVZUES-RHSMWYFYSA-N	1	0	280.415	4.129	20	30		CIEDRO
N#Cc1ccc2c(c1)CCC[C@@H]2[NH2+]Cc1cccc(F)c1F	ZINC000561199086	327374659	/nfs/dbraw/zinc/37/46/59/327374659.db2.gz	LTCQVLMWCXBQRD-KRWDZBQOSA-N	1	0	298.336	4.004	20	30		CIEDRO
C[C@@H](c1ccccc1)[N@H+](CC1CCC1)CC1(C#N)CC1	ZINC000561367052	327389502	/nfs/dbraw/zinc/38/95/02/327389502.db2.gz	BYXJWKTWZCTIOT-HNNXBMFYSA-N	1	0	268.404	4.153	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+]CC(C)(C)C(F)(F)F	ZINC000562522436	327488386	/nfs/dbraw/zinc/48/83/86/327488386.db2.gz	BWRZIYQJTCXNQL-LLVKDONJSA-N	1	0	251.336	4.299	20	30		CIEDRO
C=C[C@H]1CCCCN1Cc1csc(Br)c1	ZINC000489465824	332054071	/nfs/dbraw/zinc/05/40/71/332054071.db2.gz	VNUOPDULKJABEA-NSHDSACASA-N	1	0	286.238	4.051	20	30		CIEDRO
N#Cc1ccc(C[NH2+]CCCC2CCCCC2)cc1	ZINC000395190192	328629324	/nfs/dbraw/zinc/62/93/24/328629324.db2.gz	YLEIMOFOURWSSN-UHFFFAOYSA-N	1	0	256.393	4.008	20	30		CIEDRO
CC(C)[C@@H](C)C[NH2+]C1CCC(C#N)(c2ccccc2)CC1	ZINC000507596947	332816150	/nfs/dbraw/zinc/81/61/50/332816150.db2.gz	CISUVJHWZQOYJI-IVMQYODDSA-N	1	0	284.447	4.272	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000532207558	328707207	/nfs/dbraw/zinc/70/72/07/328707207.db2.gz	OSGAZYONVAZUGB-PBHICJAKSA-N	1	0	256.393	4.344	20	30		CIEDRO
C=CCC(CC=C)c1nc(-c2ccc(C[NH+](C)C)cc2)no1	ZINC000532333856	328770377	/nfs/dbraw/zinc/77/03/77/328770377.db2.gz	MOXOUYNUFNZCSK-UHFFFAOYSA-N	1	0	297.402	4.034	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(Cl)c(F)c1)c1ccc(C#N)cc1	ZINC000043389324	328789107	/nfs/dbraw/zinc/78/91/07/328789107.db2.gz	ZVYOBWIQODXKBB-LLVKDONJSA-N	1	0	288.753	4.202	20	30		CIEDRO
C[C@H]([NH2+]CCC1Cc2ccccc2C1)c1cccc(C#N)c1	ZINC000584358314	328853941	/nfs/dbraw/zinc/85/39/41/328853941.db2.gz	YICUFILPNJDDQI-HNNXBMFYSA-N	1	0	290.410	4.014	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccoc1C)c1ccccc1	ZINC000358024605	328880694	/nfs/dbraw/zinc/88/06/94/328880694.db2.gz	RLOVJCGQBHUQJV-QGZVFWFLSA-N	1	0	255.361	4.385	20	30		CIEDRO
C[C@@H]([NH2+]CCCCC#N)[C@@H]1C[C@H]1c1ccc(Cl)s1	ZINC000378059038	329038377	/nfs/dbraw/zinc/03/83/77/329038377.db2.gz	PMESUXIYFOHTBR-GRYCIOLGSA-N	1	0	282.840	4.177	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+]Cc1ncoc1-c1ccccc1	ZINC000378184810	329042546	/nfs/dbraw/zinc/04/25/46/329042546.db2.gz	OBTBSHPRJSQILU-KBPBESRZSA-N	1	0	270.376	4.032	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)cc1F)[C@H]1CC2CCC1CC2	ZINC000394518534	329124848	/nfs/dbraw/zinc/12/48/48/329124848.db2.gz	SFUDAXWOBRZFMO-HEAFNYJSSA-N	1	0	286.394	4.002	20	30		CIEDRO
CC[C@H]([NH2+]Cc1cc(C#N)ccc1F)c1ccc(F)cc1	ZINC000174265696	329156013	/nfs/dbraw/zinc/15/60/13/329156013.db2.gz	AENYEGOPTLLMCX-KRWDZBQOSA-N	1	0	286.325	4.077	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1c(C)noc1C)c1ccccc1	ZINC000178757642	329202279	/nfs/dbraw/zinc/20/22/79/329202279.db2.gz	OAOCFOHHPUPXAF-KRWDZBQOSA-N	1	0	270.376	4.089	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1c(C)noc1C)c1ccccc1	ZINC000178757651	329202514	/nfs/dbraw/zinc/20/25/14/329202514.db2.gz	OAOCFOHHPUPXAF-QGZVFWFLSA-N	1	0	270.376	4.089	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1cccc(OC(F)(F)F)c1	ZINC000393745083	329221306	/nfs/dbraw/zinc/22/13/06/329221306.db2.gz	KUVHXDLZRVKNGC-LBPRGKRZSA-N	1	0	273.298	4.030	20	30		CIEDRO
CCCCCCC[N@@H+]1CCC[C@H](c2nncn2C(C)C)C1	ZINC000180623705	329221357	/nfs/dbraw/zinc/22/13/57/329221357.db2.gz	NWKIIDWMLORCOQ-INIZCTEOSA-N	1	0	292.471	4.009	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H](CC2CC2)c2ccccc2)cc1F	ZINC000582880506	329284663	/nfs/dbraw/zinc/28/46/63/329284663.db2.gz	JVRVXNGOWREAGX-LJQANCHMSA-N	1	0	294.373	4.328	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1ccc(F)cc1F	ZINC000185838801	329330255	/nfs/dbraw/zinc/33/02/55/329330255.db2.gz	UMDVDOGZBFFZRD-RBOXIYTFSA-N	1	0	278.346	4.088	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)c1ccc(OCC(F)(F)F)cc1	ZINC000508968420	332853326	/nfs/dbraw/zinc/85/33/26/332853326.db2.gz	QDOUQDURIABSPA-GFCCVEGCSA-N	1	0	287.325	4.245	20	30		CIEDRO
CCC[C@@H]([NH2+]C1CCC(C)(C#N)CC1)C1CCCC1	ZINC000459754236	329381903	/nfs/dbraw/zinc/38/19/03/329381903.db2.gz	CSFSWAREFNYBFV-AQFXKWCLSA-N	1	0	262.441	4.407	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)c1cccc(OCc2ccccn2)c1	ZINC000509034624	332856904	/nfs/dbraw/zinc/85/69/04/332856904.db2.gz	UNFQNJVUGWYXSB-MRXNPFEDSA-N	1	0	296.414	4.277	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1cc(F)cc(C(F)(F)F)c1	ZINC000393776662	329428091	/nfs/dbraw/zinc/42/80/91/329428091.db2.gz	NNEOQQLSVULMDD-ZDUSSCGKSA-N	1	0	275.289	4.289	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(C#N)cc1)c1cc(F)ccc1F	ZINC000123930541	329564856	/nfs/dbraw/zinc/56/48/56/329564856.db2.gz	VLSTVEWJKKNENO-KRWDZBQOSA-N	1	0	286.325	4.077	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@@H]1CCOC2(CCCCC2)C1	ZINC000127497993	329599931	/nfs/dbraw/zinc/59/99/31/329599931.db2.gz	CXDIWBCDYUALQT-HRCADAONSA-N	1	0	265.441	4.059	20	30		CIEDRO
CC[C@@H](C)C[C@H](C)[NH2+]Cc1cccc(OCCCC#N)c1	ZINC000237020510	329692487	/nfs/dbraw/zinc/69/24/87/329692487.db2.gz	QNXSWCRHCSSAKB-CVEARBPZSA-N	1	0	288.435	4.283	20	30		CIEDRO
CC[C@@H](C)C[C@@H](C)[NH2+]Cc1cccc(OCCCC#N)c1	ZINC000237018802	329692522	/nfs/dbraw/zinc/69/25/22/329692522.db2.gz	QNXSWCRHCSSAKB-HZPDHXFCSA-N	1	0	288.435	4.283	20	30		CIEDRO
Cc1c(C[NH2+]Cc2ccc(C#N)cc2)oc2ccc(F)cc12	ZINC000237602981	329694687	/nfs/dbraw/zinc/69/46/87/329694687.db2.gz	OOKLYPFOEOLUHG-UHFFFAOYSA-N	1	0	294.329	4.042	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(CC#N)cc1)c1ccc(C2CC2)cc1	ZINC000419341656	329718519	/nfs/dbraw/zinc/71/85/19/329718519.db2.gz	OMVSGEPPIUYMRT-OAHLLOKOSA-N	1	0	290.410	4.481	20	30		CIEDRO
N#Cc1csc(C[NH2+][C@@H](CC(F)F)c2ccccc2)c1	ZINC000421370538	329824560	/nfs/dbraw/zinc/82/45/60/329824560.db2.gz	JRTXWQDCDWDKEB-AWEZNQCLSA-N	1	0	292.354	4.106	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCSc3c(F)cccc32)C1	ZINC000248841464	329900423	/nfs/dbraw/zinc/90/04/23/329900423.db2.gz	NUEPCBPISCEVFQ-LALPHHSUSA-N	1	0	290.407	4.035	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@H]2CCSc3c(F)cccc32)C1	ZINC000248841466	329900426	/nfs/dbraw/zinc/90/04/26/329900426.db2.gz	NUEPCBPISCEVFQ-XUJVJEKNSA-N	1	0	290.407	4.035	20	30		CIEDRO
CC(C)=CCC[C@H](C)[NH2+][C@H](C)c1ccc(C#N)cc1F	ZINC000571750361	329919741	/nfs/dbraw/zinc/91/97/41/329919741.db2.gz	OYPKDIXGZMYPLL-UONOGXRCSA-N	1	0	274.383	4.483	20	30		CIEDRO
CCCCOc1ccc(C[NH2+]CC(C)(C)CCC#N)cc1	ZINC000571903874	329929149	/nfs/dbraw/zinc/92/91/49/329929149.db2.gz	FBAUAUFYYXPSHX-UHFFFAOYSA-N	1	0	288.435	4.285	20	30		CIEDRO
CC(C)=CCC[NH2+]Cc1ccc(C#N)cc1C(F)(F)F	ZINC000571928561	329930166	/nfs/dbraw/zinc/93/01/66/329930166.db2.gz	AIALJPDHAONYEI-UHFFFAOYSA-N	1	0	282.309	4.023	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@@H](c1ccccc1)[C@H]1CCOC1	ZINC000536827251	329968935	/nfs/dbraw/zinc/96/89/35/329968935.db2.gz	PYVUEVUZWGSBTC-BZSNNMDCSA-N	1	0	273.420	4.099	20	30		CIEDRO
C=CCCC[C@@H](C)[NH+]1CCC(C(C)(C)C(=O)OCC)CC1	ZINC000510079519	332891268	/nfs/dbraw/zinc/89/12/68/332891268.db2.gz	NZZOQJXVZCNMJV-OAHLLOKOSA-N	1	0	295.467	4.033	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+]Cc1csc([C@H](C)OC)n1	ZINC000269089121	330067324	/nfs/dbraw/zinc/06/73/24/330067324.db2.gz	QAKZZFUTVNOYKM-QWHCGFSZSA-N	1	0	282.453	4.075	20	30		CIEDRO
C#CC[C@H]([NH2+][C@@H](C)c1sccc1C)c1ccccc1	ZINC000271487932	330079559	/nfs/dbraw/zinc/07/95/59/330079559.db2.gz	KMLREWCIRAHASD-HOCLYGCPSA-N	1	0	269.413	4.472	20	30		CIEDRO
C#CC[C@H]([NH2+][C@H](C)c1ccc2c(c1)COC2)c1ccccc1	ZINC000271413086	330079711	/nfs/dbraw/zinc/07/97/11/330079711.db2.gz	AYJXBQTYSAEYJD-QRWLVFNGSA-N	1	0	291.394	4.132	20	30		CIEDRO
C#CC[C@H]([NH2+][C@@H](C)c1ccc(C)o1)c1ccccc1	ZINC000271453297	330079715	/nfs/dbraw/zinc/07/97/15/330079715.db2.gz	GMPDXNNPXXDNDH-HOCLYGCPSA-N	1	0	253.345	4.003	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@H](C)c1ccc(C)s1)c1ccccc1	ZINC000271440090	330079756	/nfs/dbraw/zinc/07/97/56/330079756.db2.gz	FCPBUAGQCRQDJS-GDBMZVCRSA-N	1	0	269.413	4.472	20	30		CIEDRO
C#CC[C@H]([NH2+][C@H](C)c1sccc1C)c1ccccc1	ZINC000271487934	330079831	/nfs/dbraw/zinc/07/98/31/330079831.db2.gz	KMLREWCIRAHASD-ZBFHGGJFSA-N	1	0	269.413	4.472	20	30		CIEDRO
C#CC[C@H]([NH2+][C@@H](C)c1ccsc1)c1ccccc1	ZINC000271599099	330081150	/nfs/dbraw/zinc/08/11/50/330081150.db2.gz	ZIEJBJVWZCRQNN-BBRMVZONSA-N	1	0	255.386	4.163	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@@H]1CCc2ccccc21)c1ccccc1	ZINC000271556033	330081405	/nfs/dbraw/zinc/08/14/05/330081405.db2.gz	SSGSQBLCUZGVPK-RTBURBONSA-N	1	0	261.368	4.028	20	30		CIEDRO
C#CC[C@H]([NH2+][C@@H](C)c1cccc(OC)c1)c1ccccc1	ZINC000271534114	330081440	/nfs/dbraw/zinc/08/14/40/330081440.db2.gz	PZEKUTVTXVDTJH-KXBFYZLASA-N	1	0	279.383	4.110	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1cnccc1C)c1ccccc1	ZINC000271673013	330081656	/nfs/dbraw/zinc/08/16/56/330081656.db2.gz	AEFGXGTVKMMGFD-SFHVURJKSA-N	1	0	266.388	4.187	20	30		CIEDRO
Cc1cccc([C@H](C)[NH2+]Cc2ccccc2C#N)c1C	ZINC000162616421	330087211	/nfs/dbraw/zinc/08/72/11/330087211.db2.gz	GYXCEJCOXHZQIV-HNNXBMFYSA-N	1	0	264.372	4.026	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@@H]1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000273491518	330093033	/nfs/dbraw/zinc/09/30/33/330093033.db2.gz	WVTTYUQLMOTAQF-RCCFBDPRSA-N	1	0	291.410	4.380	20	30		CIEDRO
CCc1ccc([C@@H](CC)[NH2+]Cc2ccc(C#N)s2)cc1	ZINC000421868708	330099669	/nfs/dbraw/zinc/09/96/69/330099669.db2.gz	DCXHYDXICINRDC-QGZVFWFLSA-N	1	0	284.428	4.423	20	30		CIEDRO
CCc1ccc([C@H](C)[NH2+]Cc2ccc(C#N)s2)s1	ZINC000421879579	330102033	/nfs/dbraw/zinc/10/20/33/330102033.db2.gz	NJPFNJNBOUKOKG-JTQLQIEISA-N	1	0	276.430	4.094	20	30		CIEDRO
C=C(C)[C@H](NCc1occc1C)c1ccc(F)c(F)c1	ZINC000274855020	330108201	/nfs/dbraw/zinc/10/82/01/330108201.db2.gz	YPGQRFSRGAOPGC-INIZCTEOSA-N	1	0	277.314	4.273	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+]Cc1cc(COC(C)(C)C)on1	ZINC000274959762	330108553	/nfs/dbraw/zinc/10/85/53/330108553.db2.gz	GJAJDNKZKGQDTN-AWEZNQCLSA-N	1	0	294.439	4.214	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@H](C)c1cc(C)oc1C)c1ccccc1	ZINC000278712678	330119841	/nfs/dbraw/zinc/11/98/41/330119841.db2.gz	LSRWXLRSLGWIFD-RDTXWAMCSA-N	1	0	267.372	4.312	20	30		CIEDRO
C#CC[C@H]([NH2+][C@H](C)c1cc(C)oc1C)c1ccccc1	ZINC000278712671	330122660	/nfs/dbraw/zinc/12/26/60/330122660.db2.gz	LSRWXLRSLGWIFD-KDOFPFPSSA-N	1	0	267.372	4.312	20	30		CIEDRO
C=CC[C@H](C)[NH2+]Cc1csc(Cl)c1Cl	ZINC000379666490	330146532	/nfs/dbraw/zinc/14/65/32/330146532.db2.gz	XMGPZRPEKHSSJR-ZETCQYMHSA-N	1	0	250.194	4.109	20	30		CIEDRO
C=CCC[C@H](N[C@@H]1C[C@@H]([NH3+])c2ccccc21)c1ccccc1	ZINC000423002443	330163689	/nfs/dbraw/zinc/16/36/89/330163689.db2.gz	YYXPQYLYPTXIBJ-HSALFYBXSA-N	1	0	292.426	4.428	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@H]1CCO[C@H](C(C)(C)C)C1	ZINC000536829967	330228793	/nfs/dbraw/zinc/22/87/93/330228793.db2.gz	AZGWWWUEZVRECQ-JYJNAYRXSA-N	1	0	267.457	4.305	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](CC)CSc1ccccc1[N+](=O)[O-]	ZINC000536858284	330252454	/nfs/dbraw/zinc/25/24/54/330252454.db2.gz	OABOGCMZQWRKOG-CHWSQXEVSA-N	1	0	294.420	4.020	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](CC)c1ccc(OC(F)F)cc1	ZINC000536857911	330252455	/nfs/dbraw/zinc/25/24/55/330252455.db2.gz	MRQUWBZGKZEOEU-RISCZKNCSA-N	1	0	269.335	4.293	20	30		CIEDRO
C=C(C)C[N@H+](Cc1scnc1C)Cc1ccccc1	ZINC000527529572	330258083	/nfs/dbraw/zinc/25/80/83/330258083.db2.gz	CWXKJAPUFGUBOF-UHFFFAOYSA-N	1	0	272.417	4.030	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1cccc2ccccc21	ZINC000424131853	330263992	/nfs/dbraw/zinc/26/39/92/330263992.db2.gz	VPAPCMGAELGHHS-IJEWVQPXSA-N	1	0	264.372	4.183	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(C#N)cc1)c1cc(C)ccc1C	ZINC000527817935	330282861	/nfs/dbraw/zinc/28/28/61/330282861.db2.gz	FFSAHTJKHYRLTP-IBGZPJMESA-N	1	0	278.399	4.416	20	30		CIEDRO
Cc1cccc([C@@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)C(C)C)c1	ZINC000527904655	330289778	/nfs/dbraw/zinc/28/97/78/330289778.db2.gz	PFZDPMMFIILNLB-SZMVWBNQSA-N	1	0	270.420	4.364	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@H](C)c1cc(-c2ccccc2)n(C)n1	ZINC000527894994	330292618	/nfs/dbraw/zinc/29/26/18/330292618.db2.gz	OUDBWQFJTMHGTD-GDBMZVCRSA-N	1	0	283.419	4.092	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@@H]2CCc3cc(F)c(Cl)cc32)C1	ZINC000527899558	330293245	/nfs/dbraw/zinc/29/32/45/330293245.db2.gz	AFKVCLVKHSEVBC-KNHMANMVSA-N	1	0	292.785	4.138	20	30		CIEDRO
C[C@@H]([NH2+][C@H](c1ccccn1)C1CCC1)c1cccc(C#N)c1	ZINC000527971283	330301596	/nfs/dbraw/zinc/30/15/96/330301596.db2.gz	ZNNSRIARKIPFID-KUHUBIRLSA-N	1	0	291.398	4.145	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+]CC(c2ccccc2)c2ccccc2)C1	ZINC000424187140	330320944	/nfs/dbraw/zinc/32/09/44/330320944.db2.gz	AAGZYJCZBVBFMB-APWZRJJASA-N	1	0	290.410	4.100	20	30		CIEDRO
C=CCCCCC[N@@H+](C)Cc1cnc(-c2ccccc2)nc1	ZINC000532968391	330323541	/nfs/dbraw/zinc/32/35/41/330323541.db2.gz	GWAVGECAQVVEHA-UHFFFAOYSA-N	1	0	295.430	4.322	20	30		CIEDRO
Cc1cc(F)ccc1-c1ccc(C[NH2+][C@@H]2CC[C@H](C#N)C2)o1	ZINC000424191783	330323806	/nfs/dbraw/zinc/32/38/06/330323806.db2.gz	IAUOZFDHLQDEMJ-DZGCQCFKSA-N	1	0	298.361	4.176	20	30		CIEDRO
C=CCCCC[NH2+][C@@H](Cc1ccncc1)c1cccs1	ZINC000424279578	330333646	/nfs/dbraw/zinc/33/36/46/330333646.db2.gz	KIZHNLKVTCMFTE-INIZCTEOSA-N	1	0	286.444	4.373	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@@H](C)c1cc2cc(C)c(C)cc2o1	ZINC000424290782	330334726	/nfs/dbraw/zinc/33/47/26/330334726.db2.gz	CHLHNHAHSUFACE-ZOBUZTSGSA-N	1	0	299.414	4.291	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@@H](C)[C@@H](C)c1ccc(Cl)cc1	ZINC000424293769	330335499	/nfs/dbraw/zinc/33/54/99/330335499.db2.gz	JFOFPZCNAPHEBF-RMRKRWHISA-N	1	0	293.838	4.013	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@@H](C)c1ccc(F)c2ccccc21	ZINC000424295730	330335978	/nfs/dbraw/zinc/33/59/78/330335978.db2.gz	NEQCEBVYEUGNCG-NJSLBKSFSA-N	1	0	299.389	4.221	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@@H](CC)c1ccc(Cl)s1	ZINC000424297485	330336518	/nfs/dbraw/zinc/33/65/18/330336518.db2.gz	QSIGMGQDXRPYOH-SRVKXCTJSA-N	1	0	285.840	4.033	20	30		CIEDRO
CC(C)c1ccc(C[NH2+]Cc2ccc(C#N)cc2F)cc1	ZINC000045045102	330337454	/nfs/dbraw/zinc/33/74/54/330337454.db2.gz	JYRSZASVSKJPIH-UHFFFAOYSA-N	1	0	282.362	4.111	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@H]2CCc3c2ccc(Cl)c3Cl)C1	ZINC000424316186	330339489	/nfs/dbraw/zinc/33/94/89/330339489.db2.gz	ASWFERCVRYKCJT-RBZYPMLTSA-N	1	0	295.213	4.263	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1cccc(Cl)c1F	ZINC000424317265	330339566	/nfs/dbraw/zinc/33/95/66/330339566.db2.gz	BPUJPZHYIFHPHQ-WDMOLILDSA-N	1	0	280.774	4.212	20	30		CIEDRO
CCCCOc1ccc([C@H](C)[NH2+][C@@H]2CC[C@H](C#N)C2)cc1	ZINC000424317328	330339576	/nfs/dbraw/zinc/33/95/76/330339576.db2.gz	BWRMQBXOQBBUQF-YQQAZPJKSA-N	1	0	286.419	4.208	20	30		CIEDRO
CC(C)CC[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccoc1	ZINC000424320259	330339994	/nfs/dbraw/zinc/33/99/94/330339994.db2.gz	FYHLIFUWJBKHCM-IMJJTQAJSA-N	1	0	260.381	4.039	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@H]2CCSc3ccc(Cl)cc32)C1	ZINC000424321689	330340257	/nfs/dbraw/zinc/34/02/57/330340257.db2.gz	HRCCGAHYTVVGME-SUHUHFCYSA-N	1	0	292.835	4.159	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@@H]2CCSc3ccc(Cl)cc32)C1	ZINC000424321690	330340374	/nfs/dbraw/zinc/34/03/74/330340374.db2.gz	HRCCGAHYTVVGME-ZKYQVNSYSA-N	1	0	292.835	4.159	20	30		CIEDRO
Cc1ccc([C@H]([NH2+][C@@H]2CC[C@H](C#N)C2)C2CCCC2)o1	ZINC000424325999	330341361	/nfs/dbraw/zinc/34/13/61/330341361.db2.gz	LPSVSJIHQJCPSF-YSVLISHTSA-N	1	0	272.392	4.101	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1cc2cc(Cl)ccc2o1	ZINC000424327582	330341688	/nfs/dbraw/zinc/34/16/88/330341688.db2.gz	MXQAIPGTVFSZLH-COPLHBTASA-N	1	0	288.778	4.429	20	30		CIEDRO
Cc1cc2c(cc1C)[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)CCS2	ZINC000424328754	330341831	/nfs/dbraw/zinc/34/18/31/330341831.db2.gz	OJUJZHAWCHCPND-SQWLQELKSA-N	1	0	286.444	4.122	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@H]2CCc2ccccc2)C1	ZINC000424330755	330342091	/nfs/dbraw/zinc/34/20/91/330342091.db2.gz	RAQHEVYYAIYJPK-YDZRNGNQSA-N	1	0	282.431	4.070	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@@H]2CCSc3c(Cl)cccc32)C1	ZINC000424330053	330342177	/nfs/dbraw/zinc/34/21/77/330342177.db2.gz	QCTIVOAITMRBRU-MISXGVKJSA-N	1	0	292.835	4.159	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc(OC(C)(C)C)cc1	ZINC000424330806	330342251	/nfs/dbraw/zinc/34/22/51/330342251.db2.gz	REIKIJGDAASYSZ-IJEWVQPXSA-N	1	0	286.419	4.207	20	30		CIEDRO
CC(C)[C@H]1C[C@@H]([NH2+][C@@H]2CC[C@H](C#N)C2)c2ccccc21	ZINC000424331182	330342365	/nfs/dbraw/zinc/34/23/65/330342365.db2.gz	RTPMLBOLUSCGJX-MJSCVDMRSA-N	1	0	268.404	4.153	20	30		CIEDRO
CCC[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc(Cl)cc1	ZINC000424334476	330343106	/nfs/dbraw/zinc/34/31/06/330343106.db2.gz	VPUROTBITHEAGR-APHBMKBZSA-N	1	0	276.811	4.463	20	30		CIEDRO
CCC[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc(Cl)cc1	ZINC000424334477	330343138	/nfs/dbraw/zinc/34/31/38/330343138.db2.gz	VPUROTBITHEAGR-MAZHCROVSA-N	1	0	276.811	4.463	20	30		CIEDRO
CCOc1cccc2cc([C@@H](C)[NH2+][C@@H]3CC[C@H](C#N)C3)oc21	ZINC000424336814	330343570	/nfs/dbraw/zinc/34/35/70/330343570.db2.gz	YRFSBNUJQSFFRX-VNHYZAJKSA-N	1	0	298.386	4.174	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@@H](C2CCC2)C2CCCCC2)C1	ZINC000424354673	330346105	/nfs/dbraw/zinc/34/61/05/330346105.db2.gz	SNBRHIPZJZFOQA-JCGIZDLHSA-N	1	0	274.452	4.407	20	30		CIEDRO
C=C(CC)C[N@H+](Cc1ccco1)Cc1cccs1	ZINC000536880517	330358296	/nfs/dbraw/zinc/35/82/96/330358296.db2.gz	CMEBBLFJXYLZAN-UHFFFAOYSA-N	1	0	261.390	4.310	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccccc1COC(C)C)C1CC1	ZINC000533361923	330359792	/nfs/dbraw/zinc/35/97/92/330359792.db2.gz	VWCZAXZEWNEHPF-LJQANCHMSA-N	1	0	287.447	4.446	20	30		CIEDRO
CC(C)C[C@H]1CCC[N@H+](CCCC(C)(C)C#N)C1	ZINC000119320250	330372836	/nfs/dbraw/zinc/37/28/36/330372836.db2.gz	LUUDUAZTESTMDB-OAHLLOKOSA-N	1	0	250.430	4.074	20	30		CIEDRO
CSCc1cc(F)ccc1C[NH2+]CC(C)(C)CCC#N	ZINC000088751465	330378662	/nfs/dbraw/zinc/37/86/62/330378662.db2.gz	GYJPQARZSCJZBO-UHFFFAOYSA-N	1	0	294.439	4.108	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCc1c[nH]c2ccccc12)C1CC1	ZINC000119803442	330379986	/nfs/dbraw/zinc/37/99/86/330379986.db2.gz	KDNVAFIPBGCANQ-QGZVFWFLSA-N	1	0	268.404	4.045	20	30		CIEDRO
CC[N@H+](CC(C)(C)CCC#N)[C@@H](C)c1cccc(OC)c1	ZINC000120166996	330385893	/nfs/dbraw/zinc/38/58/93/330385893.db2.gz	CNTWGFUCHOCASA-HNNXBMFYSA-N	1	0	288.435	4.408	20	30		CIEDRO
CC[C@@H]1CCCC[C@@H]1[N@H+](C)CCCC(C)(C)C#N	ZINC000120901363	330394047	/nfs/dbraw/zinc/39/40/47/330394047.db2.gz	WHFLGPZHMOCYRN-CABCVRRESA-N	1	0	250.430	4.217	20	30		CIEDRO
N#CCC[C@@H]([NH2+][C@@H]1CCc2ccccc2C1)c1ccccc1	ZINC000090665353	330394564	/nfs/dbraw/zinc/39/45/64/330394564.db2.gz	TZRRIFBUGOGODD-WOJBJXKFSA-N	1	0	290.410	4.179	20	30		CIEDRO
N#CCC[C@@H]([NH2+][C@H]1CCc2ccccc21)c1ccccc1	ZINC000090664826	330394636	/nfs/dbraw/zinc/39/46/36/330394636.db2.gz	FEGDXTXRNNAJAU-MOPGFXCFSA-N	1	0	276.383	4.309	20	30		CIEDRO
CC1CCC([NH2+][C@H](CCC#N)c2ccccc2)CC1	ZINC000090665180	330394688	/nfs/dbraw/zinc/39/46/88/330394688.db2.gz	YHXABLBGIKHEFF-BDVYOWHSSA-N	1	0	256.393	4.200	20	30		CIEDRO
C=CCCC[N@@H+](C)[C@H](C)C(=O)Nc1ccccc1C(C)C	ZINC000121142190	330395578	/nfs/dbraw/zinc/39/55/78/330395578.db2.gz	AMEGTLJLNCAFAG-OAHLLOKOSA-N	1	0	288.435	4.035	20	30		CIEDRO
C=CC[C@H](CO)C[NH2+][C@@H](C)c1cccc(-c2ccccc2)c1	ZINC000537094393	330398554	/nfs/dbraw/zinc/39/85/54/330398554.db2.gz	CDAHWYUVRWJZCG-IRXDYDNUSA-N	1	0	295.426	4.189	20	30		CIEDRO
C[C@@H]([NH2+]CCc1cccc(Cl)c1)c1cccc(C#N)c1	ZINC000537295612	330431550	/nfs/dbraw/zinc/43/15/50/330431550.db2.gz	PAPFIPIRRSDLFK-CYBMUJFWSA-N	1	0	284.790	4.105	20	30		CIEDRO
C[C@H]([NH2+][C@H](Cc1ccccc1)C1CC1)c1ccc(C#N)cc1	ZINC000537308428	330432263	/nfs/dbraw/zinc/43/22/63/330432263.db2.gz	WGCJPECWVQKKEG-MGPUTAFESA-N	1	0	290.410	4.230	20	30		CIEDRO
CCSc1ccc([C@@H](C)[NH2+]CCC(C)(C)C#N)cc1	ZINC000537410909	330435144	/nfs/dbraw/zinc/43/51/44/330435144.db2.gz	JWELPQIIRZPYTI-CYBMUJFWSA-N	1	0	276.449	4.389	20	30		CIEDRO
C[C@H]([NH2+]C1C[C@H](C)C[C@@H](C)C1)c1ccc(C#N)c(F)c1	ZINC000537409631	330435151	/nfs/dbraw/zinc/43/51/51/330435151.db2.gz	ZDPQATAYYBCLPM-UPJWGTAASA-N	1	0	274.383	4.173	20	30		CIEDRO
Cc1ccccc1[C@H]([NH2+]CCC(C)(C)C#N)C(C)C	ZINC000537412807	330435165	/nfs/dbraw/zinc/43/51/65/330435165.db2.gz	YCPBRGOCNDRJOR-MRXNPFEDSA-N	1	0	258.409	4.222	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H](C)c1ccc(-n2ccnc2)cc1	ZINC000314918222	330467698	/nfs/dbraw/zinc/46/76/98/330467698.db2.gz	MAAWKFQOBUJZHW-HNNXBMFYSA-N	1	0	283.419	4.125	20	30		CIEDRO
Cc1ccccc1C1CC([NH2+][C@@H](C)c2ccc(C#N)cc2)C1	ZINC000315513578	330476886	/nfs/dbraw/zinc/47/68/86/330476886.db2.gz	TXDHITWLTWXBQA-MNNVXMFVSA-N	1	0	290.410	4.464	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]C/C(C)=C/c1ccccc1COC	ZINC000515519445	330478016	/nfs/dbraw/zinc/47/80/16/330478016.db2.gz	JVRBXFIQUOSGBD-FOWTUZBSSA-N	1	0	287.447	4.428	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@H](C)[C@@H]1OCCc2sccc21	ZINC000426341692	330505015	/nfs/dbraw/zinc/50/50/15/330505015.db2.gz	FCUDMOYQTFTPJG-KEYYUXOJSA-N	1	0	293.476	4.475	20	30		CIEDRO
N#CCCC[NH+]1CCC(c2ccc(Cl)cc2Cl)CC1	ZINC000428735864	330530740	/nfs/dbraw/zinc/53/07/40/330530740.db2.gz	XLMRBAZBOOHSBP-UHFFFAOYSA-N	1	0	297.229	4.477	20	30		CIEDRO
C[C@@H]1C[C@@H]([NH2+]CC2(CC#N)CC2)C[C@H](c2ccccc2)C1	ZINC000430037678	330557765	/nfs/dbraw/zinc/55/77/65/330557765.db2.gz	SXIICXFTHJEVNT-CGTJXYLNSA-N	1	0	282.431	4.242	20	30		CIEDRO
CC(C)c1cccc2c1OCCC[C@H]2[NH2+]CC1(CC#N)CC1	ZINC000430741923	330572229	/nfs/dbraw/zinc/57/22/29/330572229.db2.gz	KGGUOYVWPUXDDT-QGZVFWFLSA-N	1	0	298.430	4.307	20	30		CIEDRO
CC1(c2ccccc2)CCC([NH2+]CC2(CC#N)CC2)CC1	ZINC000430743682	330572452	/nfs/dbraw/zinc/57/24/52/330572452.db2.gz	PDNCUASPKRSCKJ-UHFFFAOYSA-N	1	0	282.431	4.170	20	30		CIEDRO
CCSc1ccc([C@@H](C)[NH2+]CC2(CC#N)CC2)cc1	ZINC000430752173	330573180	/nfs/dbraw/zinc/57/31/80/330573180.db2.gz	FGBLVMWHXIQCGT-CYBMUJFWSA-N	1	0	274.433	4.143	20	30		CIEDRO
N#CCCC[C@H]([NH2+][C@@H]1C=CCCC1)c1ccccc1	ZINC000433016079	330612209	/nfs/dbraw/zinc/61/22/09/330612209.db2.gz	NJFRLEAZVNMWQZ-SJORKVTESA-N	1	0	254.377	4.120	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@@H]1CC[C@H](C(C)C)[C@@H](C)C1	ZINC000435726038	330660983	/nfs/dbraw/zinc/66/09/83/330660983.db2.gz	LBSQVHKCNDQAJJ-TZNCUMHOSA-N	1	0	279.468	4.018	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+]Cc1ccc(C(C)(C)C)s1	ZINC000435749117	330662157	/nfs/dbraw/zinc/66/21/57/330662157.db2.gz	RITKAQGTFKDGMP-BBRMVZONSA-N	1	0	293.476	4.116	20	30		CIEDRO
C=CC[C@@H](C)[C@H](C)[NH2+][C@H]1C[C@H](c2ccccc2F)C1	ZINC000436287643	330673513	/nfs/dbraw/zinc/67/35/13/330673513.db2.gz	JFBSMGOYFNDCOW-LXTVHRRPSA-N	1	0	261.384	4.262	20	30		CIEDRO
C=C(C)[C@H]1OCC[C@H]1C[NH2+]C(CC(C)C)CC(C)C	ZINC000436294360	330674081	/nfs/dbraw/zinc/67/40/81/330674081.db2.gz	OKLXBHYZBJLGPR-DOTOQJQBSA-N	1	0	267.457	4.018	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+]CCc1ccc(SC)cc1	ZINC000436295685	330674294	/nfs/dbraw/zinc/67/42/94/330674294.db2.gz	QBFZKNAMYGEJMY-UONOGXRCSA-N	1	0	263.450	4.141	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CC[C@@H](Cc3ccccc3)C2)s1	ZINC000438355347	330722655	/nfs/dbraw/zinc/72/26/55/330722655.db2.gz	MQOKOVDWDWXSOO-JKSUJKDBSA-N	1	0	296.439	4.121	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccccc1OC(F)F)C1CC1	ZINC000439078434	330733505	/nfs/dbraw/zinc/73/35/05/330733505.db2.gz	QHTZIWQNNMERLL-AWEZNQCLSA-N	1	0	281.346	4.122	20	30		CIEDRO
CCC[C@H](C[NH2+]CC1CCC(C#N)CC1)c1ccccc1	ZINC000441363695	330766772	/nfs/dbraw/zinc/76/67/72/330766772.db2.gz	XZFKVJWQNNHXOX-FAFZWHIHSA-N	1	0	284.447	4.490	20	30		CIEDRO
CCC1(C)CC[NH+]([C@H](C)c2cccc(C#N)c2)CC1	ZINC000442680971	330779136	/nfs/dbraw/zinc/77/91/36/330779136.db2.gz	RETIJWWEPFFQJY-CQSZACIVSA-N	1	0	256.393	4.131	20	30		CIEDRO
C[C@H](Cc1ccc(Cl)cc1Cl)[NH2+][C@H]1CC[C@H](C#N)C1	ZINC000442785036	330783098	/nfs/dbraw/zinc/78/30/98/330783098.db2.gz	SWXQUYMCOPRDHK-SUNKGSAMSA-N	1	0	297.229	4.206	20	30		CIEDRO
Cc1cccc(-c2ccc(C[NH2+][C@H]3CC[C@H](C#N)C3)cc2)c1	ZINC000442838727	330786257	/nfs/dbraw/zinc/78/62/57/330786257.db2.gz	QPIUYNAOFKWAJO-PXNSSMCTSA-N	1	0	290.410	4.444	20	30		CIEDRO
Cc1cccc(-c2ccc(C[NH2+][C@@H]3CC[C@@H](C#N)C3)cc2)c1	ZINC000442838730	330786298	/nfs/dbraw/zinc/78/62/98/330786298.db2.gz	QPIUYNAOFKWAJO-YLJYHZDGSA-N	1	0	290.410	4.444	20	30		CIEDRO
CCC(C)(C)c1ccc(C[NH2+][C@@H]2CC[C@H](C#N)C2)cc1	ZINC000442840463	330786305	/nfs/dbraw/zinc/78/63/05/330786305.db2.gz	WXFBXCOHPVCCSF-DOTOQJQBSA-N	1	0	270.420	4.156	20	30		CIEDRO
Cc1ccc([C@H](C)[NH2+]CC2CCC(C#N)CC2)c(C)c1	ZINC000442848661	330786659	/nfs/dbraw/zinc/78/66/59/330786659.db2.gz	AVEZHZPKSQUFEQ-GTPINHCMSA-N	1	0	270.420	4.284	20	30		CIEDRO
CC(C)[C@@H]1CCc2ccccc2[C@@H]1[NH2+][C@@H]1CC[C@H](C#N)C1	ZINC000442849080	330786783	/nfs/dbraw/zinc/78/67/83/330786783.db2.gz	GNUZCOGIBXBLCA-LKCYJCQHSA-N	1	0	282.431	4.228	20	30		CIEDRO
Cc1ccc2c(c1)[C@H]([NH2+]CC1CCC(C#N)CC1)CCC2	ZINC000442866960	330788555	/nfs/dbraw/zinc/78/85/55/330788555.db2.gz	JVOQRWWWVSLQNI-LADRWXRNSA-N	1	0	282.431	4.292	20	30		CIEDRO
CC(C)CCC[C@H](C)[NH2+]CC1CCC(C#N)CC1	ZINC000442868170	330788765	/nfs/dbraw/zinc/78/87/65/330788765.db2.gz	NAWCTYSIDJJADQ-FHERZECASA-N	1	0	250.430	4.121	20	30		CIEDRO
CC[C@H]([NH2+]CC1CCC(C#N)CC1)c1ccc(C)cc1	ZINC000442874731	330789497	/nfs/dbraw/zinc/78/94/97/330789497.db2.gz	UWOUWKKXVUAEGO-HTWSVDAQSA-N	1	0	270.420	4.366	20	30		CIEDRO
N#Cc1cc(C[NH2+][C@H]2CCC[C@@H]2c2ccccc2)ccc1F	ZINC000446001864	330842571	/nfs/dbraw/zinc/84/25/71/330842571.db2.gz	BYGSLVFNRLZKGP-MJGOQNOKSA-N	1	0	294.373	4.123	20	30		CIEDRO
Cc1cccc(C)c1[C@H](C)[NH2+][C@@H]1CCC[C@@H](C#N)C1	ZINC000446756348	330853643	/nfs/dbraw/zinc/85/36/43/330853643.db2.gz	HDXCCGKAYJPHBR-ARFHVFGLSA-N	1	0	256.393	4.036	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)C1	ZINC000446823156	330855124	/nfs/dbraw/zinc/85/51/24/330855124.db2.gz	JHGNUOUVNJRWCS-ZMYBRWDISA-N	1	0	298.405	4.434	20	30		CIEDRO
CC[C@@H]([NH2+][C@H](C)Cc1ccccc1F)c1ccc(C#N)cc1	ZINC000447531548	330868098	/nfs/dbraw/zinc/86/80/98/330868098.db2.gz	QACYGBYAVDUYOU-AUUYWEPGSA-N	1	0	296.389	4.369	20	30		CIEDRO
CCc1ccccc1C[NH2+][C@@H](CC)c1ccc(C#N)cc1	ZINC000447539938	330869000	/nfs/dbraw/zinc/86/90/00/330869000.db2.gz	IKRAGAYQQHUUHX-IBGZPJMESA-N	1	0	278.399	4.362	20	30		CIEDRO
C=C(C[NH2+][C@@H](CC)c1ccc(C#N)cc1)c1ccccc1	ZINC000447543442	330869327	/nfs/dbraw/zinc/86/93/27/330869327.db2.gz	LRMSUQCOIGBXEZ-IBGZPJMESA-N	1	0	276.383	4.312	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CCC[C@@H](C)C1)c1ccc(C#N)cc1	ZINC000447545393	330869399	/nfs/dbraw/zinc/86/93/99/330869399.db2.gz	XXVHXFAAUDYBFI-COXVUDFISA-N	1	0	256.393	4.178	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+]Cc2csc3ccccc23)C1	ZINC000447547316	330869573	/nfs/dbraw/zinc/86/95/73/330869573.db2.gz	BMJWDLWPUSLPDM-GXTWGEPZSA-N	1	0	270.401	4.073	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+]Cc2csc3ccccc23)C1	ZINC000447547320	330869613	/nfs/dbraw/zinc/86/96/13/330869613.db2.gz	BMJWDLWPUSLPDM-OCCSQVGLSA-N	1	0	270.401	4.073	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H]1CCC(C)(C)C1)c1ccc(C#N)cc1	ZINC000447588988	330871984	/nfs/dbraw/zinc/87/19/84/330871984.db2.gz	WQGWAMHSSRAJOT-HZPDHXFCSA-N	1	0	256.393	4.178	20	30		CIEDRO
CC(C)CCC[C@@H](C)[NH2+]C1CCC(C)(C#N)CC1	ZINC000449059129	330896022	/nfs/dbraw/zinc/89/60/22/330896022.db2.gz	ALOJGOUBDYDSPL-QQFBHYJXSA-N	1	0	250.430	4.263	20	30		CIEDRO
CC1(C#N)CCC([NH2+]Cc2cccc(C(F)(F)F)c2)CC1	ZINC000449065621	330896692	/nfs/dbraw/zinc/89/66/92/330896692.db2.gz	UYQZHBOXKQIEEX-UHFFFAOYSA-N	1	0	296.336	4.267	20	30		CIEDRO
CC1(C#N)CCC([NH2+]CC2(c3ccccc3)CCC2)CC1	ZINC000449076905	330897553	/nfs/dbraw/zinc/89/75/53/330897553.db2.gz	UUMIZKADOBIVID-UHFFFAOYSA-N	1	0	282.431	4.170	20	30		CIEDRO
CC1(C#N)CCC([NH2+]CCc2cccc3ccccc32)CC1	ZINC000449078271	330897666	/nfs/dbraw/zinc/89/76/66/330897666.db2.gz	LOLIEXORYKAMGX-UHFFFAOYSA-N	1	0	292.426	4.444	20	30		CIEDRO
CC1(C#N)CCC([NH2+]CCc2ccc(Cl)s2)CC1	ZINC000449093436	330898539	/nfs/dbraw/zinc/89/85/39/330898539.db2.gz	XAIZREMTKDORHV-UHFFFAOYSA-N	1	0	282.840	4.006	20	30		CIEDRO
CC(C)[C@@H]1CCCC[C@@H]1[NH2+]C1CCC(C)(C#N)CC1	ZINC000449120966	330900100	/nfs/dbraw/zinc/90/01/00/330900100.db2.gz	GFLLKNSVWWOLSD-YZUHTNEWSA-N	1	0	262.441	4.263	20	30		CIEDRO
N#CCCCC[NH2+][C@@H]1CCC[C@@H]1Cc1ccc(Cl)cc1	ZINC000449130910	330900850	/nfs/dbraw/zinc/90/08/50/330900850.db2.gz	IVVKVJPADFISAS-NVXWUHKLSA-N	1	0	290.838	4.335	20	30		CIEDRO
N#CCCCC[NH2+][C@@H]1CCC[C@H]1Cc1ccc(Cl)cc1	ZINC000449130909	330900878	/nfs/dbraw/zinc/90/08/78/330900878.db2.gz	IVVKVJPADFISAS-DOTOQJQBSA-N	1	0	290.838	4.335	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@@H]2CC[C@H]3CCC[C@@H]3C2)CC1	ZINC000449148265	330901749	/nfs/dbraw/zinc/90/17/49/330901749.db2.gz	JLHOUMDEDKTUGS-UWEUSHKOSA-N	1	0	260.425	4.017	20	30		CIEDRO
CCO[C@H]1C[C@@H]([NH2+]C2CCC(C)(C#N)CC2)C1(CC)CC	ZINC000449178888	330903907	/nfs/dbraw/zinc/90/39/07/330903907.db2.gz	YLCAYOUINQEABH-GMRIPVOYSA-N	1	0	292.467	4.032	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+]Cc1nnc(C(C)(C)C)s1	ZINC000449196607	330905539	/nfs/dbraw/zinc/90/55/39/330905539.db2.gz	YJHJJMAQJOIKJD-LBPRGKRZSA-N	1	0	281.469	4.060	20	30		CIEDRO
CC1(C#N)CCC([NH2+]CC2(Cc3ccccc3)CCC2)CC1	ZINC000449197443	330905596	/nfs/dbraw/zinc/90/55/96/330905596.db2.gz	WCGBYPCXHHCAQV-UHFFFAOYSA-N	1	0	296.458	4.461	20	30		CIEDRO
CC(C)(C[NH2+]C1CCC(C)(C#N)CC1)C1CCCC1	ZINC000449217241	330906914	/nfs/dbraw/zinc/90/69/14/330906914.db2.gz	XUOVRAWPESSCRX-UHFFFAOYSA-N	1	0	262.441	4.265	20	30		CIEDRO
CC1(C#N)CCC([NH2+]Cc2cc3ccccc3s2)CC1	ZINC000449222936	330907253	/nfs/dbraw/zinc/90/72/53/330907253.db2.gz	XCCRWDQCQZWMNY-UHFFFAOYSA-N	1	0	284.428	4.463	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+]C[C@@H](C)c1ncc(C)s1	ZINC000449237407	330908462	/nfs/dbraw/zinc/90/84/62/330908462.db2.gz	NYGGLGQAHLLMDC-CHWSQXEVSA-N	1	0	266.454	4.280	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@@H]2CCCc3c(F)cccc32)CC1	ZINC000449351449	330917521	/nfs/dbraw/zinc/91/75/21/330917521.db2.gz	PMPMKAZPJWUMKW-LKGZKJKYSA-N	1	0	286.394	4.265	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+]C2CCC3(CCCC3)CC2)C1	ZINC000449444754	330925923	/nfs/dbraw/zinc/92/59/23/330925923.db2.gz	DDXMDBFVMJCARZ-HOCLYGCPSA-N	1	0	260.425	4.161	20	30		CIEDRO
Cc1ccc([C@@H]2CCC[C@H]2[NH2+][C@H]2CC[C@@H](CC#N)C2)cc1	ZINC000449444769	330925948	/nfs/dbraw/zinc/92/59/48/330925948.db2.gz	DEICWQVUSHMNTP-DSLXNQLJSA-N	1	0	282.431	4.303	20	30		CIEDRO
C[C@@H](Cc1coc2ccccc12)[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000449444588	330925955	/nfs/dbraw/zinc/92/59/55/330925955.db2.gz	CHMMFXJWKCHABW-DZKIICNBSA-N	1	0	282.387	4.036	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@H]2CCCCC23CCCC3)C1	ZINC000449445843	330926210	/nfs/dbraw/zinc/92/62/10/330926210.db2.gz	LXJLRLSCQKVMLP-JYJNAYRXSA-N	1	0	260.425	4.161	20	30		CIEDRO
CC(C)C[C@H](C)C[C@H](C)[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000449446342	330926371	/nfs/dbraw/zinc/92/63/71/330926371.db2.gz	PJBVEAMTQTYKLG-VGWMRTNUSA-N	1	0	250.430	4.119	20	30		CIEDRO
CC(C)C[C@@H]1CCC[C@@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)C1	ZINC000449446325	330926373	/nfs/dbraw/zinc/92/63/73/330926373.db2.gz	QTUIPHKXLVZCDR-NXOAAHMSSA-N	1	0	262.441	4.263	20	30		CIEDRO
CC(C)C[C@H]1CCC[C@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)C1	ZINC000449446327	330926374	/nfs/dbraw/zinc/92/63/74/330926374.db2.gz	QTUIPHKXLVZCDR-YVSFHVDLSA-N	1	0	262.441	4.263	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)cc1F	ZINC000449737298	330947411	/nfs/dbraw/zinc/94/74/11/330947411.db2.gz	RGEAJAABDXJLMA-SJLPKXTDSA-N	1	0	294.373	4.123	20	30		CIEDRO
N#CCCC[C@@H]([NH2+]CC1CC(F)(F)C1)c1ccccc1	ZINC000451066722	331014579	/nfs/dbraw/zinc/01/45/79/331014579.db2.gz	VBOOFKYJNQEYDZ-OAHLLOKOSA-N	1	0	278.346	4.056	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](C)c1ccc(OC)c(Br)c1	ZINC000163315105	331020048	/nfs/dbraw/zinc/02/00/48/331020048.db2.gz	QGHDQIVAPNKATO-GHMZBOCLSA-N	1	0	298.224	4.073	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](C)c1ccc(OC)c(Br)c1	ZINC000163314916	331020106	/nfs/dbraw/zinc/02/01/06/331020106.db2.gz	QGHDQIVAPNKATO-MNOVXSKESA-N	1	0	298.224	4.073	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)CCc1ccc(OC(F)F)cc1	ZINC000163318109	331020273	/nfs/dbraw/zinc/02/02/73/331020273.db2.gz	WMVRNFDLNXDPBE-STQMWFEESA-N	1	0	283.362	4.163	20	30		CIEDRO
C[C@H]1C[C@H](C(F)(F)F)CC[N@@H+]1CCCCC(C)(C)C#N	ZINC000451408222	331028044	/nfs/dbraw/zinc/02/80/44/331028044.db2.gz	NEXCKQDRLLCOSB-QWHCGFSZSA-N	1	0	290.373	4.369	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CC2(CCC2)[C@H]1c1ccco1	ZINC000451855977	331044887	/nfs/dbraw/zinc/04/48/87/331044887.db2.gz	PFZJJYJYLGVXTG-OAHLLOKOSA-N	1	0	272.392	4.137	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@H](C)c1csc(C)c1	ZINC000453104779	331089596	/nfs/dbraw/zinc/08/95/96/331089596.db2.gz	DMPHCBJGVQVQET-CQSZACIVSA-N	1	0	287.428	4.472	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)c1ccc(Oc2ccccc2)cn1	ZINC000453145909	331094024	/nfs/dbraw/zinc/09/40/24/331094024.db2.gz	NWWQKYYDXOURKX-LSDHHAIUSA-N	1	0	282.387	4.489	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H](C)CCCc1cccnc1	ZINC000453185673	331098590	/nfs/dbraw/zinc/09/85/90/331098590.db2.gz	XSKXZDYZGURUMS-HZPDHXFCSA-N	1	0	260.425	4.127	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@@H](C)c1cc(-c2ccccc2)nn1C	ZINC000453210435	331101676	/nfs/dbraw/zinc/10/16/76/331101676.db2.gz	JTKXILLALLMURB-HOCLYGCPSA-N	1	0	283.419	4.092	20	30		CIEDRO
C[C@H]1CCc2c(F)cccc2[C@H]1[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000453287335	331111348	/nfs/dbraw/zinc/11/13/48/331111348.db2.gz	FEUJPZHNOAXMMC-NUXNZHGMSA-N	1	0	286.394	4.121	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1cc2c(s1)CCCC2	ZINC000453289000	331111458	/nfs/dbraw/zinc/11/14/58/331111458.db2.gz	HKJUASQVQNMBEJ-IPYPFGDCSA-N	1	0	288.460	4.360	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1cccc(Cl)c1	ZINC000453291380	331111924	/nfs/dbraw/zinc/11/19/24/331111924.db2.gz	PTXLQQZLWKWYPU-HUBLWGQQSA-N	1	0	262.784	4.073	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@@H]2CCCCc3ccccc32)C1	ZINC000453298800	331112806	/nfs/dbraw/zinc/11/28/06/331112806.db2.gz	YEJWWTHBGZZRBM-QILLFSRXSA-N	1	0	268.404	4.126	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@H]2CCCCc3ccccc32)C1	ZINC000453298803	331112807	/nfs/dbraw/zinc/11/28/07/331112807.db2.gz	YEJWWTHBGZZRBM-ZVZYQTTQSA-N	1	0	268.404	4.126	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@H](C)c1csc(C(C)C)n1	ZINC000453309596	331114493	/nfs/dbraw/zinc/11/44/93/331114493.db2.gz	PZSMSRQOCLZRKI-LLVKDONJSA-N	1	0	252.427	4.129	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@@H](c1ccc(F)cc1)c1cccnc1	ZINC000453312610	331115036	/nfs/dbraw/zinc/11/50/36/331115036.db2.gz	VLZSFNHVNSJDBR-KRWDZBQOSA-N	1	0	284.378	4.112	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1sc(C(C)C)nc1C	ZINC000453313965	331115123	/nfs/dbraw/zinc/11/51/23/331115123.db2.gz	HYKHGPMGRWMNAH-NSHDSACASA-N	1	0	252.427	4.192	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@H](c1cccnc1)c1ccc(F)c(C)c1	ZINC000453314988	331115459	/nfs/dbraw/zinc/11/54/59/331115459.db2.gz	ZCTUFSDUHLZVNF-SFHVURJKSA-N	1	0	298.405	4.420	20	30		CIEDRO
Cc1csc(C[NH2+][C@@H]2CCCCc3cc(C#N)ccc32)c1	ZINC000453317962	331115908	/nfs/dbraw/zinc/11/59/08/331115908.db2.gz	LQSLVKJTJFXAQS-GOSISDBHSA-N	1	0	296.439	4.486	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1cccc(-c2ccncc2)c1	ZINC000453321323	331116413	/nfs/dbraw/zinc/11/64/13/331116413.db2.gz	PSPVZZRFSVMBIT-HNNXBMFYSA-N	1	0	266.388	4.365	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](c1cccnc1)c1ccc(F)c(C)c1	ZINC000453329782	331117570	/nfs/dbraw/zinc/11/75/70/331117570.db2.gz	XZRYVVYMKAFSIM-GOSISDBHSA-N	1	0	284.378	4.174	20	30		CIEDRO
C[C@@H]([NH2+]C1(Cc2ccc(F)cc2)CC1)c1cccc(C#N)c1	ZINC000453335143	331118327	/nfs/dbraw/zinc/11/83/27/331118327.db2.gz	CXVAJJKHDKODQK-CQSZACIVSA-N	1	0	294.373	4.123	20	30		CIEDRO
C=CCC1(C[NH2+][C@@H](C)c2ccncc2F)CCCC1	ZINC000453346060	331119914	/nfs/dbraw/zinc/11/99/14/331119914.db2.gz	DWNPEIYMFQJKIY-ZDUSSCGKSA-N	1	0	262.372	4.008	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@H]1CCO[C@H](c2cccs2)C1)C1CC1	ZINC000453349129	331120327	/nfs/dbraw/zinc/12/03/27/331120327.db2.gz	AZLCHPUSZXUHRJ-JYJNAYRXSA-N	1	0	291.460	4.303	20	30		CIEDRO
C=C(CC)C[NH2+][C@H](C)c1cccc(-c2ccncc2)c1	ZINC000453352519	331120975	/nfs/dbraw/zinc/12/09/75/331120975.db2.gz	JAZVFFOKLRIHLR-OAHLLOKOSA-N	1	0	266.388	4.365	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1[NH2+][C@@H](C)c1cc2cc(Cl)ccc2o1	ZINC000453360561	331122282	/nfs/dbraw/zinc/12/22/82/331122282.db2.gz	OSBMTUJJGJFHRM-GDLCADMTSA-N	1	0	291.778	4.080	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1[NH2+][C@@H](C)c1cc(Cl)sc1Cl	ZINC000453369740	331124007	/nfs/dbraw/zinc/12/40/07/331124007.db2.gz	SQUXVQDSOYBYAD-SFGNSQDASA-N	1	0	292.231	4.049	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+]C2(Cc3cccc(Cl)c3)CC2)C1	ZINC000453376022	331124759	/nfs/dbraw/zinc/12/47/59/331124759.db2.gz	PEBUSSXQSOALPY-GDBMZVCRSA-N	1	0	288.822	4.087	20	30		CIEDRO
C=C(CC)C[NH2+][C@@H](c1cccnc1)c1ccc(F)c(C)c1	ZINC000453381859	331125816	/nfs/dbraw/zinc/12/58/16/331125816.db2.gz	XWFNLXMOPUNYPO-GOSISDBHSA-N	1	0	284.378	4.174	20	30		CIEDRO
Cc1cccc([C@@H](C)[NH2+][C@@H]2CCc3ccc(C#N)cc32)c1	ZINC000453398607	331128271	/nfs/dbraw/zinc/12/82/71/331128271.db2.gz	MYTYTFUAJALQQB-AUUYWEPGSA-N	1	0	276.383	4.205	20	30		CIEDRO
CC1(C#N)CCC([NH2+]CC2(C3CCC3)CCC2)CC1	ZINC000453407724	331129488	/nfs/dbraw/zinc/12/94/88/331129488.db2.gz	UZSWRRJRHROLNR-UHFFFAOYSA-N	1	0	260.425	4.019	20	30		CIEDRO
CC[C@H]([NH2+]CCC1CC(F)(F)C1)c1ccc(C#N)cc1	ZINC000453419199	331130452	/nfs/dbraw/zinc/13/04/52/331130452.db2.gz	KZZUENHRAMCSJR-HNNXBMFYSA-N	1	0	278.346	4.034	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+]Cc1cccc2cc[nH]c21	ZINC000467372260	331182544	/nfs/dbraw/zinc/18/25/44/331182544.db2.gz	ZEBSMMWXGGTQEO-INIZCTEOSA-N	1	0	256.393	4.392	20	30		CIEDRO
C=C[C@H](C)[NH2+][C@H](C)c1cc2cc(Br)ccc2o1	ZINC000164610610	331263021	/nfs/dbraw/zinc/26/30/21/331263021.db2.gz	XIOCZMUMOARXRH-VHSXEESVSA-N	1	0	294.192	4.420	20	30		CIEDRO
N#Cc1cccc(C2([NH2+]Cc3ccc(C4CC4)cc3)CC2)c1	ZINC000459443682	331281538	/nfs/dbraw/zinc/28/15/38/331281538.db2.gz	FAWZHGJWMXYMOE-UHFFFAOYSA-N	1	0	288.394	4.215	20	30		CIEDRO
N#CCC[C@@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)c1ccccc1	ZINC000459442573	331281540	/nfs/dbraw/zinc/28/15/40/331281540.db2.gz	CJYFMYMAKRPMDB-SLFFLAALSA-N	1	0	290.410	4.425	20	30		CIEDRO
C[C@H](CCCc1cccnc1)[NH2+]CCCCC(C)(C)C#N	ZINC000459632851	331291438	/nfs/dbraw/zinc/29/14/38/331291438.db2.gz	GBQPZJLUNDBDNA-MRXNPFEDSA-N	1	0	287.451	4.102	20	30		CIEDRO
C[C@H](CC(C)(C)c1ccccc1)[NH2+]CC(C)(C)CC#N	ZINC000459659971	331292717	/nfs/dbraw/zinc/29/27/17/331292717.db2.gz	AKXXPUXTRHBBPG-OAHLLOKOSA-N	1	0	272.436	4.272	20	30		CIEDRO
CC(C)(CC#N)C[NH2+]Cc1ccc(Cl)c(Cl)c1	ZINC000459685398	331294356	/nfs/dbraw/zinc/29/43/56/331294356.db2.gz	FFCLLEKQVZFNAL-UHFFFAOYSA-N	1	0	271.191	4.023	20	30		CIEDRO
CC(C)(C#N)CCCC[N@@H+]1CCc2cccc(Cl)c2C1	ZINC000459698507	331294978	/nfs/dbraw/zinc/29/49/78/331294978.db2.gz	ZFBSQHNIGZMKFD-UHFFFAOYSA-N	1	0	290.838	4.418	20	30		CIEDRO
C[C@H](Cc1cccc(C(F)(F)F)c1)[NH2+]CC(C)(C)CC#N	ZINC000459729660	331296371	/nfs/dbraw/zinc/29/63/71/331296371.db2.gz	KPQPIWHSLVTUIV-GFCCVEGCSA-N	1	0	298.352	4.166	20	30		CIEDRO
CC(C)(CC#N)C[NH2+]Cc1cc(Cl)sc1Cl	ZINC000459735473	331296800	/nfs/dbraw/zinc/29/68/00/331296800.db2.gz	SYPLHEMKUQGCQX-UHFFFAOYSA-N	1	0	277.220	4.084	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](C)c1ccc(OC(C)(C)C)cc1	ZINC000463031533	331337761	/nfs/dbraw/zinc/33/77/61/331337761.db2.gz	XXSWITFXAJLITH-KGLIPLIRSA-N	1	0	261.409	4.479	20	30		CIEDRO
CC(C)c1ccc(C[C@@H](C)[NH2+][C@H]2CCC[C@H](C#N)C2)cc1	ZINC000463237892	331343674	/nfs/dbraw/zinc/34/36/74/331343674.db2.gz	PCGNVQJFJDLGAJ-AYBZRNKSSA-N	1	0	284.447	4.413	20	30		CIEDRO
Cc1cccc(C2([NH2+][C@@H]3CCC[C@H](C#N)C3)CCCC2)c1	ZINC000463247450	331344154	/nfs/dbraw/zinc/34/41/54/331344154.db2.gz	NSZJIHSPPFGBFH-FUHWJXTLSA-N	1	0	282.431	4.436	20	30		CIEDRO
CC(C)(C)[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CCC[C@@H](C#N)C1	ZINC000463279614	331344893	/nfs/dbraw/zinc/34/48/93/331344893.db2.gz	KARLRISMFZKIIU-QXSJWSMHSA-N	1	0	262.441	4.263	20	30		CIEDRO
CC(C)(C)[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CCC[C@@H](C#N)C1	ZINC000463279611	331344917	/nfs/dbraw/zinc/34/49/17/331344917.db2.gz	KARLRISMFZKIIU-FPCVCCKLSA-N	1	0	262.441	4.263	20	30		CIEDRO
CC(C)[C@H]1CC[C@@H](C)C[C@H]1[NH2+][C@H]1CCC[C@@H](C#N)C1	ZINC000463292152	331345418	/nfs/dbraw/zinc/34/54/18/331345418.db2.gz	ZXTCERSXUBTSGB-NQNKBUKLSA-N	1	0	262.441	4.119	20	30		CIEDRO
CC(C)(C)c1ccc(CC[NH2+][C@@H]2CCC[C@H](C#N)C2)cc1	ZINC000463295577	331345658	/nfs/dbraw/zinc/34/56/58/331345658.db2.gz	MIZBUOMBNZXCJA-FUHWJXTLSA-N	1	0	284.447	4.199	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+]Cc2ccc(Cl)cc2Cl)C1	ZINC000463304688	331345912	/nfs/dbraw/zinc/34/59/12/331345912.db2.gz	SCEKDQARNYATMO-GXFFZTMASA-N	1	0	283.202	4.165	20	30		CIEDRO
N#C[C@@H](c1ccccc1)[C@@H]1CCC[N@@H+]1CCc1ccccc1	ZINC000464814126	331369381	/nfs/dbraw/zinc/36/93/81/331369381.db2.gz	KXCZFGUUOMDIAC-PMACEKPBSA-N	1	0	290.410	4.001	20	30		CIEDRO
CC/C=C/CC[N@H+]1CC=C(c2ccc(C#N)cc2)CC1	ZINC000466225171	331391114	/nfs/dbraw/zinc/39/11/14/331391114.db2.gz	HRXHVZWRYZMIRH-ONEGZZNKSA-N	1	0	266.388	4.004	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1cc2c(ccc(C)c2C)[nH]1	ZINC000466381280	331394134	/nfs/dbraw/zinc/39/41/34/331394134.db2.gz	SBVZCQZTHVKWOO-CQSZACIVSA-N	1	0	256.393	4.229	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1ccc(-c2ccncc2)cc1F	ZINC000466403987	331395211	/nfs/dbraw/zinc/39/52/11/331395211.db2.gz	KSFGJKSNNXLALQ-QGZVFWFLSA-N	1	0	284.378	4.332	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1ncc(-c2ccccc2)s1	ZINC000466405003	331395287	/nfs/dbraw/zinc/39/52/87/331395287.db2.gz	PUWJHPFJBCCBDS-AWEZNQCLSA-N	1	0	272.417	4.254	20	30		CIEDRO
Cc1cc(C[NH2+][C@H]2C[C@H](c3ccccc3C)C2)ccc1C#N	ZINC000466404197	331395297	/nfs/dbraw/zinc/39/52/97/331395297.db2.gz	BBODSTRMIWBSOD-WGSAOQKQSA-N	1	0	290.410	4.211	20	30		CIEDRO
N#Cc1cccc(CC[NH2+]Cc2cc3ccccc3s2)c1	ZINC000466425429	331396621	/nfs/dbraw/zinc/39/66/21/331396621.db2.gz	MYYVBMYFSVTGCT-UHFFFAOYSA-N	1	0	292.407	4.105	20	30		CIEDRO
CCC[C@H]1CCC[N@@H+]([C@@H](C)c2ccc(C#N)cc2)C1	ZINC000466482521	331398246	/nfs/dbraw/zinc/39/82/46/331398246.db2.gz	RPVJQYNWWPOFEF-HOCLYGCPSA-N	1	0	256.393	4.131	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@@H]1CCC[C@@H](c2ncccc2C)C1	ZINC000467406944	331417821	/nfs/dbraw/zinc/41/78/21/331417821.db2.gz	RFLMVWLWHRFWPG-IXDOHACOSA-N	1	0	272.436	4.361	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@H](C)c1cc(Cl)c(OC)cc1OC	ZINC000467411728	331418010	/nfs/dbraw/zinc/41/80/10/331418010.db2.gz	DZTGPQQFFMKOGC-VXGBXAGGSA-N	1	0	297.826	4.363	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@H](C)c1ccc(F)cc1OC(F)F	ZINC000467410911	331418025	/nfs/dbraw/zinc/41/80/25/331418025.db2.gz	LQXBMNSJPKXGQE-ZYHUDNBSSA-N	1	0	287.325	4.432	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@H](C)c1ccc(OCC)c(OCC)c1	ZINC000467412506	331418256	/nfs/dbraw/zinc/41/82/56/331418256.db2.gz	IPUFRCIWTVGGLD-GDBMZVCRSA-N	1	0	291.435	4.489	20	30		CIEDRO
Cc1cccc(CC[C@@H](C)[NH2+]CCc2cccc(C#N)c2)c1	ZINC000467430039	331418781	/nfs/dbraw/zinc/41/87/81/331418781.db2.gz	OHDVDRVABGNWJT-QGZVFWFLSA-N	1	0	292.426	4.020	20	30		CIEDRO
C=CCOCCC[NH+]1Cc2ccccc2-c2ccccc2C1	ZINC000470761272	331489319	/nfs/dbraw/zinc/48/93/19/331489319.db2.gz	IJMYLSMYTNAGQQ-UHFFFAOYSA-N	1	0	293.410	4.262	20	30		CIEDRO
CC(C)[NH+](CCCNc1ccc(C#N)c(Cl)c1)C(C)C	ZINC000470863629	331492835	/nfs/dbraw/zinc/49/28/35/331492835.db2.gz	VPAZGJMZDRYQII-UHFFFAOYSA-N	1	0	293.842	4.132	20	30		CIEDRO
C=CCCCC[NH2+][C@H](C)c1ccc(OC(F)F)c(OC)c1	ZINC000471600171	331512412	/nfs/dbraw/zinc/51/24/12/331512412.db2.gz	AKAWCMCWBZSWQZ-GFCCVEGCSA-N	1	0	299.361	4.304	20	30		CIEDRO
C=CCCCC[NH2+][C@@H](C)CC(=O)Nc1cccc(Cl)c1	ZINC000471618253	331513511	/nfs/dbraw/zinc/51/35/11/331513511.db2.gz	JWXRVGHWZACJEU-ZDUSSCGKSA-N	1	0	294.826	4.003	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+]Cc2ccc(Oc3ccccc3)cc2)C1	ZINC000472133934	331529605	/nfs/dbraw/zinc/52/96/05/331529605.db2.gz	DIIQUOWMJPASLY-SJORKVTESA-N	1	0	292.382	4.261	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(Oc3ccccc3)cc2)C1	ZINC000472133932	331529759	/nfs/dbraw/zinc/52/97/59/331529759.db2.gz	DIIQUOWMJPASLY-IAGOWNOFSA-N	1	0	292.382	4.261	20	30		CIEDRO
C[C@H](CCC#N)[NH+]1CCC(CCc2ccccc2)CC1	ZINC000472757753	331542613	/nfs/dbraw/zinc/54/26/13/331542613.db2.gz	VRLULKPVHDTPRF-MRXNPFEDSA-N	1	0	270.420	4.023	20	30		CIEDRO
C[C@@H](CCC#N)[NH+]1CCC(CCc2ccccc2)CC1	ZINC000472757738	331542639	/nfs/dbraw/zinc/54/26/39/331542639.db2.gz	VRLULKPVHDTPRF-INIZCTEOSA-N	1	0	270.420	4.023	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)cc1)c1cc2cccc(F)c2o1	ZINC000474021513	331562785	/nfs/dbraw/zinc/56/27/85/331562785.db2.gz	ULFSAIYTWFUUOZ-LBPRGKRZSA-N	1	0	294.329	4.294	20	30		CIEDRO
CC[C@H](CC#N)[NH2+]C[C@@H](CC(C)C)c1ccccc1	ZINC000474921103	331603998	/nfs/dbraw/zinc/60/39/98/331603998.db2.gz	AGPWPTISDGQBOZ-IAGOWNOFSA-N	1	0	258.409	4.098	20	30		CIEDRO
C=CCCCC[NH2+][C@H](C)[C@H](C)c1ccc(OC)c(OC)c1	ZINC000474924529	331604215	/nfs/dbraw/zinc/60/42/15/331604215.db2.gz	SZUUSZMBTTYWEW-LSDHHAIUSA-N	1	0	291.435	4.142	20	30		CIEDRO
CC1(CC[NH2+]C2CCC(C#N)(c3ccccc3)CC2)CC1	ZINC000475198566	331617623	/nfs/dbraw/zinc/61/76/23/331617623.db2.gz	QYLQNLBQKFNMJY-UHFFFAOYSA-N	1	0	282.431	4.170	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)[C@H](C)c1nc2ccccc2s1	ZINC000475208697	331618498	/nfs/dbraw/zinc/61/84/98/331618498.db2.gz	FCSURFXZVBIICM-STQMWFEESA-N	1	0	274.433	4.344	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)CCCC(F)(F)F)c1cccc(C#N)c1	ZINC000480142921	331759480	/nfs/dbraw/zinc/75/94/80/331759480.db2.gz	BMCVILZNUFLVCI-NWDGAFQWSA-N	1	0	284.325	4.330	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@H](C)c1ccncc1F	ZINC000511051068	332925648	/nfs/dbraw/zinc/92/56/48/332925648.db2.gz	QIDSYSDXANKVHT-OLZOCXBDSA-N	1	0	250.361	4.006	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CC1(CCOC)CCCCC1)C1CC1	ZINC000480755783	331787058	/nfs/dbraw/zinc/78/70/58/331787058.db2.gz	IGQFSZGQIODMKM-QGZVFWFLSA-N	1	0	279.468	4.308	20	30		CIEDRO
C=CCC[C@H]([NH2+]CC1(CCOC)CCCCC1)C1CC1	ZINC000480755782	331787061	/nfs/dbraw/zinc/78/70/61/331787061.db2.gz	IGQFSZGQIODMKM-KRWDZBQOSA-N	1	0	279.468	4.308	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H]2CC[C@@H](c3ccccc3F)C2)cc1	ZINC000481808370	331816257	/nfs/dbraw/zinc/81/62/57/331816257.db2.gz	AFYLCMGJFLNLLC-SJORKVTESA-N	1	0	294.373	4.123	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@@H]2CC[C@H](c3ccccc3F)C2)c1	ZINC000481819725	331816418	/nfs/dbraw/zinc/81/64/18/331816418.db2.gz	ZXPWPCPDNDSKLG-DLBZAZTESA-N	1	0	294.373	4.123	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@H]2CC[C@@H](c3ccccc3F)C2)C1	ZINC000482077978	331823222	/nfs/dbraw/zinc/82/32/22/331823222.db2.gz	QJKFULXSAZVXSV-WCVJEAGWSA-N	1	0	286.394	4.134	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@H]1CCc2c1cccc2C	ZINC000482885022	331850476	/nfs/dbraw/zinc/85/04/76/331850476.db2.gz	DBIXTIXTEXEGQR-IBGZPJMESA-N	1	0	293.410	4.337	20	30		CIEDRO
CC(C)(C#N)CCC[NH2+][C@]1(C)CCCc2ccccc21	ZINC000483769915	331884552	/nfs/dbraw/zinc/88/45/52/331884552.db2.gz	AWDZWGKFVFWDFC-GOSISDBHSA-N	1	0	270.420	4.158	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H]2CCC[C@H]2c2ccccc2)cc1F	ZINC000483973868	331890311	/nfs/dbraw/zinc/89/03/11/331890311.db2.gz	CIAVBBXCMICGFJ-HKUYNNGSSA-N	1	0	294.373	4.123	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+][C@H](C)c1ccc2ncsc2c1	ZINC000485706892	331920223	/nfs/dbraw/zinc/92/02/23/331920223.db2.gz	BRZOMMJSVLLBRP-VXGBXAGGSA-N	1	0	260.406	4.302	20	30		CIEDRO
C=CCC[C@H](C)[NH2+]C[C@@H](c1ccccc1)C(F)(F)F	ZINC000485721889	331922221	/nfs/dbraw/zinc/92/22/21/331922221.db2.gz	WBCVYWLDZPRLNL-JSGCOSHPSA-N	1	0	271.326	4.277	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CCC[C@H](c3ccccc3)C2)s1	ZINC000486861391	331947664	/nfs/dbraw/zinc/94/76/64/331947664.db2.gz	YGZMHKBJRUTUBJ-JKSUJKDBSA-N	1	0	296.439	4.436	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CCC[C@@H](c3ccccc3)C2)cc1	ZINC000486898284	331948689	/nfs/dbraw/zinc/94/86/89/331948689.db2.gz	BPPAIAVIRHMDFE-WOJBJXKFSA-N	1	0	290.410	4.374	20	30		CIEDRO
Cc1cc(C[NH2+]C2(c3cccc(Cl)c3)CC2)ccc1C#N	ZINC000488142832	331991939	/nfs/dbraw/zinc/99/19/39/331991939.db2.gz	DDIGVDIANMRXIF-UHFFFAOYSA-N	1	0	296.801	4.299	20	30		CIEDRO
Cc1cc(C[NH2+][C@H](c2ccccc2)C2CCC2)ccc1C#N	ZINC000488230670	331995033	/nfs/dbraw/zinc/99/50/33/331995033.db2.gz	IUDLBSYJMUQSFO-HXUWFJFHSA-N	1	0	290.410	4.498	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccc(C#N)c(C)c1)c1cccs1	ZINC000488287575	331997619	/nfs/dbraw/zinc/99/76/19/331997619.db2.gz	CQKRGGSXHSPALV-OAHLLOKOSA-N	1	0	270.401	4.169	20	30		CIEDRO
Cc1cc(C[NH2+][C@@H](C)c2cc3ccccc3o2)ccc1C#N	ZINC000488308990	331998793	/nfs/dbraw/zinc/99/87/93/331998793.db2.gz	CTYRQFNRZIPCOF-AWEZNQCLSA-N	1	0	290.366	4.464	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CS[C@@H](C(C)(C)C)C1)c1ccc(C#N)cc1	ZINC000488416417	332005849	/nfs/dbraw/zinc/00/58/49/332005849.db2.gz	IOVNVSFTZCDCKS-APHBMKBZSA-N	1	0	288.460	4.129	20	30		CIEDRO
C=C(C[NH2+][C@H]1CS[C@H](C(C)(C)C)C1)c1ccccc1	ZINC000488432074	332007821	/nfs/dbraw/zinc/00/78/21/332007821.db2.gz	LILVFGRVDUUIIC-CVEARBPZSA-N	1	0	275.461	4.210	20	30		CIEDRO
C=C[C@H]1CCCCN1Cc1csc(-c2ccccc2)n1	ZINC000489428767	332051465	/nfs/dbraw/zinc/05/14/65/332051465.db2.gz	FDTYQWCSLAHZJJ-INIZCTEOSA-N	1	0	284.428	4.351	20	30		CIEDRO
Cc1ccccc1[C@@H]1CCC[N@@H+]1Cc1ccc(F)cc1C#N	ZINC000489576267	332059942	/nfs/dbraw/zinc/05/99/42/332059942.db2.gz	DJWPCROLQWNTAN-IBGZPJMESA-N	1	0	294.373	4.343	20	30		CIEDRO
CCCN(CC#N)CCCSc1ccccc1Cl	ZINC000489580152	332060157	/nfs/dbraw/zinc/06/01/57/332060157.db2.gz	VDUBZGPIHQVARD-UHFFFAOYSA-N	1	0	282.840	4.058	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]C(C)(C)c2ccccc2F)cc1	ZINC000491997801	332378569	/nfs/dbraw/zinc/37/85/69/332378569.db2.gz	IRSNKHOIFLFUMV-UHFFFAOYSA-N	1	0	299.389	4.415	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+]C[C@@H]1CCO[C@@H](C(C)C)C1	ZINC000493707334	332450570	/nfs/dbraw/zinc/45/05/70/332450570.db2.gz	OMSDWOMXGLDLNT-GVDBMIGSSA-N	1	0	267.457	4.162	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+][C@@H](C)c1nc(C(F)(F)F)cs1	ZINC000494387035	332471859	/nfs/dbraw/zinc/47/18/59/332471859.db2.gz	QXAYHBNUCOPTDV-AEJSXWLSSA-N	1	0	292.370	4.413	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+]C[C@H]1CCCCC(F)(F)C1	ZINC000494993001	332498483	/nfs/dbraw/zinc/49/84/83/332498483.db2.gz	AVBMUMSQDVXUBK-IHRRRGAJSA-N	1	0	259.384	4.392	20	30		CIEDRO
C=CCCOCC[NH2+][C@@H](c1ccccc1)c1ccc(C)cc1	ZINC000494973354	332496289	/nfs/dbraw/zinc/49/62/89/332496289.db2.gz	TUUQXDCSUXOYGO-FQEVSTJZSA-N	1	0	295.426	4.267	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+][C@@H](CCOC)c1ccc(C)o1	ZINC000495421202	332518447	/nfs/dbraw/zinc/51/84/47/332518447.db2.gz	ONOXLMIRBQIOLJ-CABCVRRESA-N	1	0	265.397	4.000	20	30		CIEDRO
CCCC[C@H]([NH2+]CCCC1(C#N)CCOCC1)C1CCC1	ZINC000499629350	332590713	/nfs/dbraw/zinc/59/07/13/332590713.db2.gz	ZGINBULYUBZHKT-KRWDZBQOSA-N	1	0	292.467	4.035	20	30		CIEDRO
C=CCC[NH+]1CCC(F)(c2ccc(Cl)cc2)CC1	ZINC000500140609	332600480	/nfs/dbraw/zinc/60/04/80/332600480.db2.gz	QXMRLINLACVJAG-UHFFFAOYSA-N	1	0	267.775	4.177	20	30		CIEDRO
Cc1ccc([C@H](C)[NH2+]Cc2ccc(C#N)c(F)c2)c(C)c1	ZINC000404746850	332604268	/nfs/dbraw/zinc/60/42/68/332604268.db2.gz	FVCHERXJNKHFTO-AWEZNQCLSA-N	1	0	282.362	4.165	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]C[C@@H]2CCCC(F)(F)C2)cc1	ZINC000500374350	332605648	/nfs/dbraw/zinc/60/56/48/332605648.db2.gz	UFIFZIIGZHCMJD-OAHLLOKOSA-N	1	0	295.373	4.167	20	30		CIEDRO
C=CCCCC[NH2+][C@H](C)c1cnn(C2CCCC2)c1	ZINC000502438146	332659696	/nfs/dbraw/zinc/65/96/96/332659696.db2.gz	UPEJNDYPSOVUHK-CQSZACIVSA-N	1	0	261.413	4.005	20	30		CIEDRO
CC(C)[C@H]([NH2+]CCC(C)(C)C#N)c1ccc(F)cc1	ZINC000502483783	332663098	/nfs/dbraw/zinc/66/30/98/332663098.db2.gz	KNCZCQIRLWEOJC-HNNXBMFYSA-N	1	0	262.372	4.052	20	30		CIEDRO
C[C@@H]([NH2+]C[C@H]1CCCC(F)(F)C1)c1ccc(C#N)cc1F	ZINC000502579939	332666266	/nfs/dbraw/zinc/66/62/66/332666266.db2.gz	RJBQDHSORHAZGF-YPMHNXCESA-N	1	0	296.336	4.173	20	30		CIEDRO
C/C(=C\c1ccccc1C(F)(F)F)C[NH2+]CC(C)(C)C#N	ZINC000503566311	332692408	/nfs/dbraw/zinc/69/24/08/332692408.db2.gz	XCEBGZZAWYQBAC-XYOKQWHBSA-N	1	0	296.336	4.248	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCc1cccc2[nH]ccc21)C1CC1	ZINC000503931868	332699737	/nfs/dbraw/zinc/69/97/37/332699737.db2.gz	XGDHPFHXRLMWFS-KRWDZBQOSA-N	1	0	268.404	4.045	20	30		CIEDRO
N#CCCC[NH2+]C1(c2ccc(C(F)(F)F)cc2)CCCC1	ZINC000505494918	332742216	/nfs/dbraw/zinc/74/22/16/332742216.db2.gz	LCJZNCORXBGDBU-UHFFFAOYSA-N	1	0	296.336	4.368	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H]1COc2ccccc21)c1ccco1	ZINC000516598645	332744643	/nfs/dbraw/zinc/74/46/43/332744643.db2.gz	CCWUTLWNVQVKKP-ZBFHGGJFSA-N	1	0	283.371	4.053	20	30		CIEDRO
Cc1cccc([C@@H](C)C[NH2+][C@H](C)c2ccc(C#N)cc2F)c1	ZINC000512620050	332976027	/nfs/dbraw/zinc/97/60/27/332976027.db2.gz	OIUOWINPUKMJIL-LSDHHAIUSA-N	1	0	296.389	4.460	20	30		CIEDRO
Cc1cccc([C@H](C)C[NH2+][C@H](C)c2ccc(C#N)cc2F)c1	ZINC000512620049	332976036	/nfs/dbraw/zinc/97/60/36/332976036.db2.gz	OIUOWINPUKMJIL-HUUCEWRRSA-N	1	0	296.389	4.460	20	30		CIEDRO
C=CCCCC[NH2+]C/C(C)=C\c1ccccc1COC	ZINC000512627710	332976625	/nfs/dbraw/zinc/97/66/25/332976625.db2.gz	HWCGXXQYRHPHMQ-SSZFMOIBSA-N	1	0	273.420	4.182	20	30		CIEDRO
C[C@@H]([NH2+]CCC1=CCCCC1)c1ccc(C#N)cc1F	ZINC000512654716	332978091	/nfs/dbraw/zinc/97/80/91/332978091.db2.gz	ODSKEVCRTUQBEO-CYBMUJFWSA-N	1	0	272.367	4.238	20	30		CIEDRO
C[C@H]([NH2+]C1C[C@H](C)C[C@@H](C)C1)c1ccc(C#N)cc1F	ZINC000512660918	332978607	/nfs/dbraw/zinc/97/86/07/332978607.db2.gz	PIYJBVHVOHLZCY-UPJWGTAASA-N	1	0	274.383	4.173	20	30		CIEDRO
CCc1ccccc1C[NH2+][C@H](C)c1ccc(C#N)cc1F	ZINC000512666238	332979136	/nfs/dbraw/zinc/97/91/36/332979136.db2.gz	JLYWIBKONXIMJV-CYBMUJFWSA-N	1	0	282.362	4.111	20	30		CIEDRO
CCc1ccccc1C[NH2+][C@@H](C)c1ccc(C#N)cc1F	ZINC000512666239	332979186	/nfs/dbraw/zinc/97/91/86/332979186.db2.gz	JLYWIBKONXIMJV-ZDUSSCGKSA-N	1	0	282.362	4.111	20	30		CIEDRO
N#Cc1csc(C[NH2+][C@@H]2CCC[C@H]2c2ccccc2)c1	ZINC000513078270	333003036	/nfs/dbraw/zinc/00/30/36/333003036.db2.gz	XHLBOSALWHZGKZ-DLBZAZTESA-N	1	0	282.412	4.046	20	30		CIEDRO
C=CC[N@@H+](CCCC(C)(C)C#N)Cc1cccs1	ZINC000174811012	333007666	/nfs/dbraw/zinc/00/76/66/333007666.db2.gz	NDOUDEFZKWYTFN-UHFFFAOYSA-N	1	0	262.422	4.066	20	30		CIEDRO
C[C@H]1C[C@@H](c2ccc(F)cc2)C[N@@H+]1CCCC(C)(C)C#N	ZINC000174869197	333009610	/nfs/dbraw/zinc/00/96/10/333009610.db2.gz	BIZDBKQYNGTWLZ-GOEBONIOSA-N	1	0	288.410	4.333	20	30		CIEDRO
C[C@H]1C[C@H](c2ccc(F)cc2)C[N@@H+]1CCCC(C)(C)C#N	ZINC000174869172	333009716	/nfs/dbraw/zinc/00/97/16/333009716.db2.gz	BIZDBKQYNGTWLZ-HOCLYGCPSA-N	1	0	288.410	4.333	20	30		CIEDRO
CC[C@H]1C[N@H+](CCCCC#N)CC[C@@H]1c1ccccc1	ZINC000174886522	333009818	/nfs/dbraw/zinc/00/98/18/333009818.db2.gz	LJLOTFALLCKUPC-WMZOPIPTSA-N	1	0	270.420	4.196	20	30		CIEDRO
CC(C)(C)C[N@H+](Cc1ccc(C#N)o1)Cc1ccccc1	ZINC000513401762	333017647	/nfs/dbraw/zinc/01/76/47/333017647.db2.gz	PGRUUMFIZWKWIP-UHFFFAOYSA-N	1	0	282.387	4.200	20	30		CIEDRO
CC[C@H](C)[C@H](C)[N@H+](Cc1ccc(C#N)s1)C1CC1	ZINC000513455420	333020770	/nfs/dbraw/zinc/02/07/70/333020770.db2.gz	MFCBLHDTERMUKO-RYUDHWBXSA-N	1	0	262.422	4.019	20	30		CIEDRO
C=C1CC[NH+](Cc2cn(-c3ccccc3)nc2C(C)C)CC1	ZINC000513461270	333021005	/nfs/dbraw/zinc/02/10/05/333021005.db2.gz	LRYDXXQNGQNEDB-UHFFFAOYSA-N	1	0	295.430	4.148	20	30		CIEDRO
CC[C@H](C)[C@@H](C)[N@H+](Cc1ccc(C#N)cc1F)C1CC1	ZINC000513466472	333021361	/nfs/dbraw/zinc/02/13/61/333021361.db2.gz	GHXSUIVPAQMXEY-QWHCGFSZSA-N	1	0	274.383	4.096	20	30		CIEDRO
C=C1CC[NH+](Cc2c(OC)ccc3ccccc32)CC1	ZINC000513473187	333021770	/nfs/dbraw/zinc/02/17/70/333021770.db2.gz	UBEJZSIROUZMEC-UHFFFAOYSA-N	1	0	267.372	4.000	20	30		CIEDRO
C[C@@H](c1ccc(Cl)cc1)[C@H](C)[N@H+](C)CCCC#N	ZINC000175434916	333024901	/nfs/dbraw/zinc/02/49/01/333024901.db2.gz	DBQXHTHSXGICAX-OLZOCXBDSA-N	1	0	264.800	4.068	20	30		CIEDRO
N#Cc1csc(C[N@@H+]2CCC[C@@H](Cc3ccccc3)C2)c1	ZINC000513648649	333028990	/nfs/dbraw/zinc/02/89/90/333028990.db2.gz	UCNXXXSVFXQGJC-INIZCTEOSA-N	1	0	296.439	4.074	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H]2CCCCc3ccccc32)cc1F	ZINC000404846265	333028996	/nfs/dbraw/zinc/02/89/96/333028996.db2.gz	OPRXKKINPXDQBQ-IBGZPJMESA-N	1	0	294.373	4.255	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@H](OC)c1ccccc1)c1ccco1	ZINC000513661461	333029995	/nfs/dbraw/zinc/02/99/95/333029995.db2.gz	OUUYGCIIOBVKDW-AEFFLSMTSA-N	1	0	285.387	4.264	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCCOc1ccccc1)c1ccco1	ZINC000513677938	333031717	/nfs/dbraw/zinc/03/17/17/333031717.db2.gz	FFDRYTUUUHUTRJ-KRWDZBQOSA-N	1	0	285.387	4.346	20	30		CIEDRO
C=CCC[NH2+]C1(c2ccc(Cl)c(Cl)c2)CC1	ZINC000309528710	333045036	/nfs/dbraw/zinc/04/50/36/333045036.db2.gz	CSGZZZOCGPGESI-UHFFFAOYSA-N	1	0	256.176	4.148	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+][C@H]1CCc2sc(Cl)cc21	ZINC000309538754	333045283	/nfs/dbraw/zinc/04/52/83/333045283.db2.gz	FOCAIKZKGQCGAK-KOLCDFICSA-N	1	0	255.814	4.333	20	30		CIEDRO
C=CCN1CCC([NH2+][C@H](C)c2cccc3ccccc32)CC1	ZINC000177313355	333057429	/nfs/dbraw/zinc/05/74/29/333057429.db2.gz	YJEUHTIUAYIKMF-MRXNPFEDSA-N	1	0	294.442	4.141	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]Cc1csc(Br)c1	ZINC000310589699	333060187	/nfs/dbraw/zinc/06/01/87/333060187.db2.gz	YMAIEMPPGTUGML-UHFFFAOYSA-N	1	0	288.254	4.203	20	30		CIEDRO
C[C@@H](C1CC1)[N@H+](Cc1ccccc1C(C)(C)C#N)C1CC1	ZINC000178514517	333074774	/nfs/dbraw/zinc/07/47/74/333074774.db2.gz	COWYTEFVDOOYLX-AWEZNQCLSA-N	1	0	282.431	4.251	20	30		CIEDRO
C=CCCCC[NH2+]Cc1nc(-c2ccccc2)cs1	ZINC000312002521	333075402	/nfs/dbraw/zinc/07/54/02/333075402.db2.gz	RTIUGOZMLQVGJR-UHFFFAOYSA-N	1	0	272.417	4.256	20	30		CIEDRO
N#CCCCC[N@@H+]1CCc2ccccc2[C@@H]1c1ccccc1	ZINC000517095247	333092705	/nfs/dbraw/zinc/09/27/05/333092705.db2.gz	JTEIYKBBTRHHAY-FQEVSTJZSA-N	1	0	290.410	4.328	20	30		CIEDRO
CCC[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(C#N)cc1	ZINC000517549674	333102077	/nfs/dbraw/zinc/10/20/77/333102077.db2.gz	BZEHPZVUWKKITN-SJORKVTESA-N	1	0	256.393	4.007	20	30		CIEDRO
CC(C)(C[NH2+]Cc1cccc(C#N)c1)c1ccccc1Cl	ZINC000520961425	333108821	/nfs/dbraw/zinc/10/88/21/333108821.db2.gz	QRAMJTRKLWHWTE-UHFFFAOYSA-N	1	0	298.817	4.279	20	30		CIEDRO
CCC[N@H+](Cc1ccc(C#N)cc1)[C@@H]1CCc2ccccc21	ZINC000521192585	333114220	/nfs/dbraw/zinc/11/42/20/333114220.db2.gz	FMXNRXTYRPIYRT-HXUWFJFHSA-N	1	0	290.410	4.458	20	30		CIEDRO
C[C@@H]([NH2+]CCCC#N)c1ccc(Cl)c2ccccc21	ZINC000185394101	333139878	/nfs/dbraw/zinc/13/98/78/333139878.db2.gz	PSIXHKIIVFDJSA-GFCCVEGCSA-N	1	0	272.779	4.448	20	30		CIEDRO
CCC[N@H+](CCc1cccs1)Cc1cc(C#N)cs1	ZINC000185586335	333144230	/nfs/dbraw/zinc/14/42/30/333144230.db2.gz	XBRWRHSJVFXYQL-UHFFFAOYSA-N	1	0	290.457	4.136	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+]CCSc2ccc(Cl)cc2)C1	ZINC000185759670	333148253	/nfs/dbraw/zinc/14/82/53/333148253.db2.gz	JBHHZPLLKHDSGC-JSGCOSHPSA-N	1	0	294.851	4.104	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+]CCc2ccc3ccccc3c2)C1	ZINC000185816499	333149705	/nfs/dbraw/zinc/14/97/05/333149705.db2.gz	PJVLWYUKCZBQEA-QFBILLFUSA-N	1	0	278.399	4.054	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+]CC2(Cc3ccccc3)CCC2)C1	ZINC000185860454	333150279	/nfs/dbraw/zinc/15/02/79/333150279.db2.gz	FPIAMMLPFPRFEE-MSOLQXFVSA-N	1	0	282.431	4.071	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+]CC2(c3ccccc3Cl)CC2)C1	ZINC000185873437	333150712	/nfs/dbraw/zinc/15/07/12/333150712.db2.gz	GEFCNKWOKMXXET-UONOGXRCSA-N	1	0	288.822	4.044	20	30		CIEDRO
C=C(C)[C@H]([NH2+]Cc1ccccc1)c1ccc(F)c(F)c1	ZINC000187370417	333169745	/nfs/dbraw/zinc/16/97/45/333169745.db2.gz	NSTRFLPNXYOFLD-KRWDZBQOSA-N	1	0	273.326	4.372	20	30		CIEDRO
C=C(C)[C@@H]([NH2+]Cc1cccs1)c1ccc(F)c(F)c1	ZINC000187368946	333169778	/nfs/dbraw/zinc/16/97/78/333169778.db2.gz	JWFOELYWFXSDBI-OAHLLOKOSA-N	1	0	279.355	4.433	20	30		CIEDRO
CC[C@@H](Cc1ccccc1)[N@H+](C)Cc1ccc(CC#N)cc1	ZINC000521600591	333179673	/nfs/dbraw/zinc/17/96/73/333179673.db2.gz	MVYVPSINXGHJPV-FQEVSTJZSA-N	1	0	292.426	4.206	20	30		CIEDRO
C=CC[N@H+](Cc1ccccc1)[C@H](C)c1cccs1	ZINC000521815683	333189299	/nfs/dbraw/zinc/18/92/99/333189299.db2.gz	USNNHAKYMTVNOB-CQSZACIVSA-N	1	0	257.402	4.497	20	30		CIEDRO
CC(C)c1ccc2c(c1)[C@H]([NH2+]Cc1cccc(C#N)c1)CC2	ZINC000189619815	333196786	/nfs/dbraw/zinc/19/67/86/333196786.db2.gz	AJTKWECSIPYOPR-HXUWFJFHSA-N	1	0	290.410	4.459	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@@H](C)c1nc(C2CCCCC2)no1	ZINC000191578728	333221887	/nfs/dbraw/zinc/22/18/87/333221887.db2.gz	LDPOXMWFXMNVOF-IHRRRGAJSA-N	1	0	291.439	4.369	20	30		CIEDRO
C[C@H]1C[C@H](C)[N@H+](Cc2ccc(-c3ccccc3C#N)cc2)C1	ZINC000521945077	333224802	/nfs/dbraw/zinc/22/48/02/333224802.db2.gz	CCKJXYUQDRZSPL-HOTGVXAUSA-N	1	0	290.410	4.456	20	30		CIEDRO
CCCC[C@@H]1CCC[C@H]1[NH2+]CCCC(C)(C)C#N	ZINC000191831715	333226022	/nfs/dbraw/zinc/22/60/22/333226022.db2.gz	QREHGYMVBPZRDY-HUUCEWRRSA-N	1	0	250.430	4.265	20	30		CIEDRO
N#Cc1ccc(C[N@@H+]2CCC[C@@H]2c2ccccc2)cc1F	ZINC000191862939	333226476	/nfs/dbraw/zinc/22/64/76/333226476.db2.gz	DOYLWDYLRVXGJK-GOSISDBHSA-N	1	0	280.346	4.034	20	30		CIEDRO
C[C@H](c1ccc(F)cc1)[N@H+](C)Cc1ccc(C#N)c(F)c1	ZINC000191856092	333226500	/nfs/dbraw/zinc/22/65/00/333226500.db2.gz	NMNXSMKQUGNQNJ-GFCCVEGCSA-N	1	0	286.325	4.029	20	30		CIEDRO
C[C@@H](c1ccccc1F)N(C)Cc1ccc(C#N)c(F)c1	ZINC000191949313	333227545	/nfs/dbraw/zinc/22/75/45/333227545.db2.gz	HQSJXFRXQWNQMT-LBPRGKRZSA-N	1	0	286.325	4.029	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H](c2ccccc2)C2CCC2)cc1F	ZINC000192100899	333229649	/nfs/dbraw/zinc/22/96/49/333229649.db2.gz	PUVORDDPZXWFPG-IBGZPJMESA-N	1	0	294.373	4.328	20	30		CIEDRO
C=CCCC[NH2+][C@H](C)c1ccc(OC)cc1Br	ZINC000522035176	333231006	/nfs/dbraw/zinc/23/10/06/333231006.db2.gz	NSPGKLFOZRGROY-LLVKDONJSA-N	1	0	298.224	4.075	20	30		CIEDRO
N#Cc1cccc(C[N@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)c1	ZINC000522068959	333238131	/nfs/dbraw/zinc/23/81/31/333238131.db2.gz	SHYHISCRKYWGNA-QGZVFWFLSA-N	1	0	296.801	4.201	20	30		CIEDRO
C=CC[N@@H+](Cc1cc(C)sc1C)Cc1cccc(C#N)c1	ZINC000195729216	333262278	/nfs/dbraw/zinc/26/22/78/333262278.db2.gz	IGKBFNPLJGDMFP-UHFFFAOYSA-N	1	0	296.439	4.425	20	30		CIEDRO
CC1(C#N)CC[NH+](Cc2csc3ccccc23)CC1	ZINC000227354131	333281633	/nfs/dbraw/zinc/28/16/33/333281633.db2.gz	RJUKKJNLCQAADV-UHFFFAOYSA-N	1	0	270.401	4.027	20	30		CIEDRO
C=CC[C@@H](C)[NH2+]Cc1ccccc1OCc1ccccc1	ZINC000522627774	333292829	/nfs/dbraw/zinc/29/28/29/333292829.db2.gz	XYFGKQRCDRKELF-MRXNPFEDSA-N	1	0	281.399	4.320	20	30		CIEDRO
CC(C)[C@@H]1CCCC[C@H]1[NH2+]CC(C)(C)CCC#N	ZINC000229700937	333307969	/nfs/dbraw/zinc/30/79/69/333307969.db2.gz	HISDNAPRWIXAKL-LSDHHAIUSA-N	1	0	250.430	4.121	20	30		CIEDRO
CCOc1ccc([C@@H](C)[NH2+]CC(C)(C)CCC#N)cc1	ZINC000229686470	333307988	/nfs/dbraw/zinc/30/79/88/333307988.db2.gz	QEBGZHUMQGJNQX-CQSZACIVSA-N	1	0	274.408	4.066	20	30		CIEDRO
C=CCCOCC[NH2+][C@H](C)c1cc(Cl)ccc1Cl	ZINC000229859975	333310300	/nfs/dbraw/zinc/31/03/00/333310300.db2.gz	BMCGXDSMPUBUAW-LLVKDONJSA-N	1	0	288.218	4.237	20	30		CIEDRO
C=CC[N@@H+](CCCCCn1cc(C)cn1)Cc1ccccc1	ZINC000523636893	333334630	/nfs/dbraw/zinc/33/46/30/333334630.db2.gz	XVRDLNQBSHMZRN-UHFFFAOYSA-N	1	0	297.446	4.050	20	30		CIEDRO
CC[N@H+](CCCCC(C)(C)C#N)Cc1ccccc1	ZINC000233443720	333352363	/nfs/dbraw/zinc/35/23/63/333352363.db2.gz	LKYGYGDWLLMCLO-UHFFFAOYSA-N	1	0	258.409	4.229	20	30		CIEDRO
Cc1cccc(C[N@H+](C)CCCCC(C)(C)C#N)c1	ZINC000234272495	333359213	/nfs/dbraw/zinc/35/92/13/333359213.db2.gz	NXXPOLSVRGPCJG-UHFFFAOYSA-N	1	0	258.409	4.147	20	30		CIEDRO
CC(C)CC[C@H](C)[NH2+]Cc1cccc(OCCCC#N)c1	ZINC000236620974	333374006	/nfs/dbraw/zinc/37/40/06/333374006.db2.gz	ZCZTUBSDIWTFQG-INIZCTEOSA-N	1	0	288.435	4.283	20	30		CIEDRO
C=CCC[N@H+]1CCCCC[C@H]1c1ccc(OC)cc1	ZINC000524811705	333389115	/nfs/dbraw/zinc/38/91/15/333389115.db2.gz	LKVAUIUKGLYDMP-KRWDZBQOSA-N	1	0	259.393	4.188	20	30		CIEDRO
C=CCC[N@@H+](CCc1ccccc1F)C1CCCC1	ZINC000524811896	333389126	/nfs/dbraw/zinc/38/91/26/333389126.db2.gz	SIHORRXXCVVTEX-UHFFFAOYSA-N	1	0	261.384	4.189	20	30		CIEDRO
C=CCC[NH+]1CCC(C(=O)c2ccc(CC(C)C)cc2)CC1	ZINC000524811652	333389204	/nfs/dbraw/zinc/38/92/04/333389204.db2.gz	PSDCTLUMJVLOCI-UHFFFAOYSA-N	1	0	299.458	4.356	20	30		CIEDRO
C=CCCC[NH2+][C@H](c1ccc(F)cc1)c1ccc(OC)cc1	ZINC000524842723	333390067	/nfs/dbraw/zinc/39/00/67/333390067.db2.gz	SAXQVKWWLDWZST-LJQANCHMSA-N	1	0	299.389	4.480	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@H](C)c1ccc(OC(F)F)cc1	ZINC000393829516	333414981	/nfs/dbraw/zinc/41/49/81/333414981.db2.gz	UJNFVHCZMZQNBU-YPMHNXCESA-N	1	0	269.335	4.293	20	30		CIEDRO
CSc1ccc([C@@H](C)[NH2+]Cc2ccc(C#N)cc2)cc1	ZINC000036994332	333454478	/nfs/dbraw/zinc/45/44/78/333454478.db2.gz	NNKIUNSWSGCMDE-CYBMUJFWSA-N	1	0	282.412	4.131	20	30		CIEDRO
N#C[C@H]1CCC[C@H]1[NH2+]Cc1ccc(-c2ccccc2)s1	ZINC000061892230	333475099	/nfs/dbraw/zinc/47/50/99/333475099.db2.gz	JKIIPZGQDXCMAQ-GDBMZVCRSA-N	1	0	282.412	4.197	20	30		CIEDRO
C[C@H]([NH2+]Cc1cc(Cl)ccc1F)c1ccc(C#N)cc1	ZINC000125163565	333564546	/nfs/dbraw/zinc/56/45/46/333564546.db2.gz	SQVLAFGBWRXTFF-NSHDSACASA-N	1	0	288.753	4.202	20	30		CIEDRO
C[C@@H]([NH2+]CC1(c2cccc(F)c2)CC1)c1ccc(C#N)cc1	ZINC000174119638	335148227	/nfs/dbraw/zinc/14/82/27/335148227.db2.gz	DJVLEKQRYDBMCZ-CQSZACIVSA-N	1	0	294.373	4.080	20	30		CIEDRO
N#CCSCCC[NH2+][C@H](c1ccc(Cl)cc1)C1CC1	ZINC000174114065	335148304	/nfs/dbraw/zinc/14/83/04/335148304.db2.gz	QMQXJUPPSRZSJU-HNNXBMFYSA-N	1	0	294.851	4.028	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@@H](C)c1ccc2c(c1)COC2	ZINC000538406458	333589073	/nfs/dbraw/zinc/58/90/73/333589073.db2.gz	GEKNUCHLKRKIGN-KGLIPLIRSA-N	1	0	259.393	4.112	20	30		CIEDRO
C[C@@H]([NH2+]CCC(C)(C)C#N)c1ccccc1C(F)(F)F	ZINC000538512612	333602145	/nfs/dbraw/zinc/60/21/45/333602145.db2.gz	WTRYVRIBSBYKDL-LLVKDONJSA-N	1	0	284.325	4.296	20	30		CIEDRO
C[C@H]([NH2+]C1(c2ccccc2)CC1)c1ccc(C#N)c(F)c1	ZINC000538524471	333603632	/nfs/dbraw/zinc/60/36/32/333603632.db2.gz	VYMMAZGRZHTMIC-ZDUSSCGKSA-N	1	0	280.346	4.037	20	30		CIEDRO
C[C@@H](C[NH2+][C@@H](C)c1ccc(C#N)cc1)Sc1ccccc1	ZINC000174272578	335151595	/nfs/dbraw/zinc/15/15/95/335151595.db2.gz	RDOBUBQLEASSFG-GJZGRUSLSA-N	1	0	296.439	4.390	20	30		CIEDRO
C=C(C)COCC[NH2+][C@H](CC(C)C)c1cccs1	ZINC000539063378	333653953	/nfs/dbraw/zinc/65/39/53/333653953.db2.gz	BWEVYSPCCNDSIO-CQSZACIVSA-N	1	0	267.438	4.018	20	30		CIEDRO
Cc1cc(C)c(C[NH2+]CC(C)(C)CCC#N)c(C)c1	ZINC000174323308	335152762	/nfs/dbraw/zinc/15/27/62/335152762.db2.gz	GARFAEBGIRXNKF-UHFFFAOYSA-N	1	0	258.409	4.031	20	30		CIEDRO
COc1cccc([C@H](C)[NH2+]CC#Cc2ccc(Cl)cc2)c1	ZINC000539229957	333662285	/nfs/dbraw/zinc/66/22/85/333662285.db2.gz	QIHZVRGOCAQNDG-AWEZNQCLSA-N	1	0	299.801	4.051	20	30		CIEDRO
C=C(CC)C[NH2+][C@@H](CC)c1ccccc1OC(F)F	ZINC000539252552	333663246	/nfs/dbraw/zinc/66/32/46/333663246.db2.gz	MINZOGYIBUIFBX-ZDUSSCGKSA-N	1	0	269.335	4.295	20	30		CIEDRO
C=CC[NH2+][C@@H](Cc1cccc(F)c1)c1cccc(F)c1	ZINC000539308749	333665421	/nfs/dbraw/zinc/66/54/21/333665421.db2.gz	KDYKJZAYTVRUFP-KRWDZBQOSA-N	1	0	273.326	4.024	20	30		CIEDRO
CC(C)[C@H]1CCC[C@H]([NH2+]CC(C)(C)CCC#N)C1	ZINC000174347912	335153372	/nfs/dbraw/zinc/15/33/72/335153372.db2.gz	UTPJCXICQGFFGT-GJZGRUSLSA-N	1	0	250.430	4.121	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]CC1(Sc2ccccc2)CC1	ZINC000174374700	335153530	/nfs/dbraw/zinc/15/35/30/335153530.db2.gz	ARTCNMGIZMLZHB-UHFFFAOYSA-N	1	0	288.460	4.231	20	30		CIEDRO
CC(C)[C@@H]([NH2+]CC1(C#N)CC1)c1ccc(C(F)(F)F)cc1	ZINC000539490028	333673155	/nfs/dbraw/zinc/67/31/55/333673155.db2.gz	DVAKQONYJHNFKM-CQSZACIVSA-N	1	0	296.336	4.296	20	30		CIEDRO
CC(C)c1ccc([C@@H]([NH2+]CC2(C#N)CC2)C(C)C)cc1	ZINC000539494117	333673775	/nfs/dbraw/zinc/67/37/75/333673775.db2.gz	XISKFAXRNOHTSY-KRWDZBQOSA-N	1	0	270.420	4.400	20	30		CIEDRO
C[C@H]([NH2+]CC(C)(C)Oc1ccccc1)c1cccc(C#N)c1	ZINC000539495868	333673971	/nfs/dbraw/zinc/67/39/71/333673971.db2.gz	GVWFYKHTUHHXJF-HNNXBMFYSA-N	1	0	294.398	4.066	20	30		CIEDRO
CC[C@H](C)C[C@H](C)[NH2+][C@H](C)c1ccc(C#N)c(F)c1	ZINC000539608467	333680573	/nfs/dbraw/zinc/68/05/73/333680573.db2.gz	MMIRGAKQHGBURD-RWMBFGLXSA-N	1	0	262.372	4.173	20	30		CIEDRO
CC[C@H]([NH2+]CCC(C)(C)C#N)c1cccc(Cl)c1	ZINC000539615662	333681604	/nfs/dbraw/zinc/68/16/04/333681604.db2.gz	OOLQRFPBUURCMY-AWEZNQCLSA-N	1	0	264.800	4.321	20	30		CIEDRO
Cc1cccc([C@H](C)C[NH2+]CC(C)(C)CCC#N)c1	ZINC000174425046	335154475	/nfs/dbraw/zinc/15/44/75/335154475.db2.gz	GSMHMNHICBUBKY-OAHLLOKOSA-N	1	0	258.409	4.018	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCc1csc(C(C)(C)C)n1)C1CC1	ZINC000540143584	333712487	/nfs/dbraw/zinc/71/24/87/333712487.db2.gz	SQXHDVNMCYMMFU-OAHLLOKOSA-N	1	0	292.492	4.318	20	30		CIEDRO
C=CCCC[C@@H](C)[NH+]1CCC(c2nc3ccccc3[nH]2)CC1	ZINC000540297492	333723611	/nfs/dbraw/zinc/72/36/11/333723611.db2.gz	ONSJWPGLDHFWQY-OAHLLOKOSA-N	1	0	297.446	4.487	20	30		CIEDRO
Fc1cccc(C2([NH2+]CC#Cc3cccc(Cl)c3)CC2)c1	ZINC000540386155	333727705	/nfs/dbraw/zinc/72/77/05/333727705.db2.gz	NJJKBFKUTZIFBN-UHFFFAOYSA-N	1	0	299.776	4.110	20	30		CIEDRO
N#CC1(C[NH2+][C@H](c2cccc(Cl)c2)C2CCCC2)CC1	ZINC000540592292	333736239	/nfs/dbraw/zinc/73/62/39/333736239.db2.gz	KOXLEADUWFCEMJ-INIZCTEOSA-N	1	0	288.822	4.465	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1C[C@@H]1C1CCCCC1)c1cccc(C#N)c1	ZINC000540607403	333737763	/nfs/dbraw/zinc/73/77/63/333737763.db2.gz	QIXPZEOTTUPAMY-MORSLUCNSA-N	1	0	268.404	4.178	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)c1cc2cccc(OCC)c2o1	ZINC000540607066	333737835	/nfs/dbraw/zinc/73/78/35/333737835.db2.gz	AEKCGOZMNXTKNX-STQMWFEESA-N	1	0	273.376	4.447	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](Cc1ccccc1)C1CC1)c1cccc(C#N)c1	ZINC000540608495	333737838	/nfs/dbraw/zinc/73/78/38/333737838.db2.gz	SVSBKAORVRKSGU-QRWLVFNGSA-N	1	0	290.410	4.230	20	30		CIEDRO
C[C@@H]([NH2+]CC1(Cc2ccccc2)CC1)c1cccc(C#N)c1	ZINC000540607923	333737894	/nfs/dbraw/zinc/73/78/94/333737894.db2.gz	OKTZBBVBMWGSHV-MRXNPFEDSA-N	1	0	290.410	4.232	20	30		CIEDRO
C[C@@H]([NH2+]CCC(C)(C)C#N)c1cccc2ccccc21	ZINC000540714689	333743533	/nfs/dbraw/zinc/74/35/33/333743533.db2.gz	RLTOYGKAUWLQKW-CQSZACIVSA-N	1	0	266.388	4.430	20	30		CIEDRO
C[C@@H]1CCc2ccccc2[C@H]1[NH2+]Cc1ccc(C#N)cc1F	ZINC000540870086	333750688	/nfs/dbraw/zinc/75/06/88/333750688.db2.gz	LILLJDNDLUCOCJ-YJYMSZOUSA-N	1	0	294.373	4.111	20	30		CIEDRO
C[C@]1([NH2+]Cc2ccc(C#N)cc2F)CCCc2ccccc21	ZINC000540906496	333752627	/nfs/dbraw/zinc/75/26/27/333752627.db2.gz	ANBZYOAKCIEHHD-IBGZPJMESA-N	1	0	294.373	4.039	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H]1CCCc2ccc(O)cc21	ZINC000340535687	335157606	/nfs/dbraw/zinc/15/76/06/335157606.db2.gz	NXOZSCNQJJDZNH-DYVFJYSZSA-N	1	0	259.393	4.104	20	30		CIEDRO
C[C@@H]([NH2+]CC1CC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000541085806	333761919	/nfs/dbraw/zinc/76/19/19/333761919.db2.gz	UDEQYGMKXCMDSO-CQSZACIVSA-N	1	0	276.383	4.286	20	30		CIEDRO
CC1(C)C[C@H]([NH2+]Cc2cc(C#N)cs2)c2ccccc21	ZINC000129460701	333765912	/nfs/dbraw/zinc/76/59/12/333765912.db2.gz	MDCQVCSUQIALKG-INIZCTEOSA-N	1	0	282.412	4.132	20	30		CIEDRO
C[C@@H](C[NH2+]CCCC#N)Cc1ccc(C(C)(C)C)cc1	ZINC000541554079	333779402	/nfs/dbraw/zinc/77/94/02/333779402.db2.gz	ZBRITHLYZRYZFR-OAHLLOKOSA-N	1	0	272.436	4.056	20	30		CIEDRO
C=CCC[C@H](C)[NH2+]Cc1ccc2[nH]c(C)c(C)c2c1	ZINC000541742263	333789110	/nfs/dbraw/zinc/78/91/10/333789110.db2.gz	RWJQOVZSYPNQAS-LBPRGKRZSA-N	1	0	256.393	4.229	20	30		CIEDRO
C[C@H](Cc1ccsc1)[NH2+][C@@H](C)c1ccc(C#N)cc1F	ZINC000541904722	333798200	/nfs/dbraw/zinc/79/82/00/333798200.db2.gz	ZJVLSKGMVQMHLM-NEPJUHHUSA-N	1	0	288.391	4.041	20	30		CIEDRO
N#CCC1CC[NH+](Cc2ccc(-c3ccc(F)cc3)o2)CC1	ZINC000541922519	333801067	/nfs/dbraw/zinc/80/10/67/333801067.db2.gz	FAZYGLRXCZSJDR-UHFFFAOYSA-N	1	0	298.361	4.211	20	30		CIEDRO
C=CCC[NH2+][C@@H](Cc1ccc(Cl)cc1)c1ccccn1	ZINC000542124013	333810815	/nfs/dbraw/zinc/81/08/15/333810815.db2.gz	UTNZMQPRXMFRKJ-KRWDZBQOSA-N	1	0	286.806	4.185	20	30		CIEDRO
C=CCC[C@H](C)[NH2+]CC#Cc1ccc(C(F)(F)F)cc1	ZINC000542667794	333835160	/nfs/dbraw/zinc/83/51/60/333835160.db2.gz	YXGXPRYEDPIOIT-ZDUSSCGKSA-N	1	0	281.321	4.001	20	30		CIEDRO
CCC[C@H](C[NH+]1CCC(CC#N)CC1)c1ccccc1	ZINC000542853767	333845570	/nfs/dbraw/zinc/84/55/70/333845570.db2.gz	KBQCWERKDGKZPU-GOSISDBHSA-N	1	0	270.420	4.196	20	30		CIEDRO
C=CCCC[C@@H](C)[NH+]1CCC(CCCn2ccnc2)CC1	ZINC000543060629	333854783	/nfs/dbraw/zinc/85/47/83/333854783.db2.gz	LSLMSOXKHSODMU-QGZVFWFLSA-N	1	0	289.467	4.120	20	30		CIEDRO
Cc1cc(C)cc(-c2ccc(C[NH2+]CCCC#N)cc2)c1	ZINC000543237629	333865620	/nfs/dbraw/zinc/86/56/20/333865620.db2.gz	BOHOCXQUWRNZDP-UHFFFAOYSA-N	1	0	278.399	4.364	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H](C)[C@@H](C)C1)c1ccc(C#N)c(F)c1	ZINC000543638306	333886952	/nfs/dbraw/zinc/88/69/52/333886952.db2.gz	WOAPNZDATJDNFS-WFGGJUAMSA-N	1	0	274.383	4.173	20	30		CIEDRO
C=CC[C@@H](C)[C@H](C)[NH2+]CCc1c(C)[nH]c2ccccc21	ZINC000544033099	333911541	/nfs/dbraw/zinc/91/15/41/333911541.db2.gz	CMKKHIMHAQSCOC-KGLIPLIRSA-N	1	0	270.420	4.209	20	30		CIEDRO
Cc1cc([C@@H](C)[NH2+]CC#Cc2ccc(F)cc2)c(C)s1	ZINC000544399855	333929178	/nfs/dbraw/zinc/92/91/78/333929178.db2.gz	QYGOCZGFCXOXTE-CYBMUJFWSA-N	1	0	287.403	4.206	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+][C@H](CC)CC(F)(F)F	ZINC000544829601	333947785	/nfs/dbraw/zinc/94/77/85/333947785.db2.gz	KHBNYMZPQNTZSC-VXGBXAGGSA-N	1	0	251.336	4.442	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@@H](c1cnn(C)c1)C(C)(C)C	ZINC000545905574	334005626	/nfs/dbraw/zinc/00/56/26/334005626.db2.gz	SQJPWYAQZPSEOQ-HOTGVXAUSA-N	1	0	277.456	4.232	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+][C@H](c1cnn(C)c1)C(C)(C)C	ZINC000545905575	334005631	/nfs/dbraw/zinc/00/56/31/334005631.db2.gz	SQJPWYAQZPSEOQ-HZPDHXFCSA-N	1	0	277.456	4.232	20	30		CIEDRO
N#Cc1ccc(C[N@@H+]2CCCC[C@H]2c2ccccc2)cc1	ZINC000545985074	334010464	/nfs/dbraw/zinc/01/04/64/334010464.db2.gz	UCLYHTJTZUDFCJ-IBGZPJMESA-N	1	0	276.383	4.285	20	30		CIEDRO
CC[C@H](Cc1ccc(Cl)cc1Cl)[NH2+]C[C@@H](C)C#N	ZINC000133035060	334013730	/nfs/dbraw/zinc/01/37/30/334013730.db2.gz	AHXDIAUPTHOWBE-GXFFZTMASA-N	1	0	285.218	4.064	20	30		CIEDRO
C=C(C)C[NH2+][C@@H](C)c1sc(-c2ccc(F)cc2)nc1C	ZINC000564302676	334031856	/nfs/dbraw/zinc/03/18/56/334031856.db2.gz	PXAYPRVKDUZURX-NSHDSACASA-N	1	0	290.407	4.484	20	30		CIEDRO
C[C@H]1CC[C@@H]([NH2+]Cc2ccc(CC#N)cc2)c2ccccc21	ZINC000576226716	335173733	/nfs/dbraw/zinc/17/37/33/335173733.db2.gz	SNOVUWFBNAFRGJ-MGPUTAFESA-N	1	0	290.410	4.481	20	30		CIEDRO
Cc1cccc(C)c1[C@H](C)[NH2+]Cc1cc(C#N)cs1	ZINC000546879418	334053336	/nfs/dbraw/zinc/05/33/36/334053336.db2.gz	RACHKCJHHKEMIR-ZDUSSCGKSA-N	1	0	270.401	4.087	20	30		CIEDRO
CC(C)[C@@H](Cc1ccc(F)cc1)[NH2+]Cc1ccc(C#N)cc1	ZINC000236713113	334067110	/nfs/dbraw/zinc/06/71/10/334067110.db2.gz	FEOQIRWBHZKNDO-LJQANCHMSA-N	1	0	296.389	4.054	20	30		CIEDRO
CC[C@@H](CC#N)[NH2+]Cc1cccc(-c2ccc(C)cc2)c1	ZINC000547284934	334076004	/nfs/dbraw/zinc/07/60/04/334076004.db2.gz	CYLDKCFTQTXLTD-IBGZPJMESA-N	1	0	278.399	4.444	20	30		CIEDRO
CCC[C@@H](Cc1ccccc1)[NH2+]Cc1cc(C#N)cs1	ZINC000236887423	334076770	/nfs/dbraw/zinc/07/67/70/334076770.db2.gz	NUUKLOSRJJKIDM-INIZCTEOSA-N	1	0	284.428	4.121	20	30		CIEDRO
C=C(C[NH2+][C@H](C)c1ccc(F)cc1)c1ccccc1	ZINC000134369751	334089241	/nfs/dbraw/zinc/08/92/41/334089241.db2.gz	HZMYRZJACJHTJH-CQSZACIVSA-N	1	0	255.336	4.190	20	30		CIEDRO
C[C@H](CC(C)(C)c1ccccc1)[NH2+]Cc1cc(C#N)cs1	ZINC000237603601	334092377	/nfs/dbraw/zinc/09/23/77/334092377.db2.gz	KCRSJUJPJQLVOM-CQSZACIVSA-N	1	0	298.455	4.466	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H]2CCCC[C@@H]2Cc2ccccc2)o1	ZINC000237843920	334100282	/nfs/dbraw/zinc/10/02/82/334100282.db2.gz	BMAYAGBTFREHCL-APWZRJJASA-N	1	0	294.398	4.042	20	30		CIEDRO
N#Cc1csc(C[NH2+]CCCC2CCCCC2)c1	ZINC000237841359	334100364	/nfs/dbraw/zinc/10/03/64/334100364.db2.gz	VAJHRHQFYSLYEK-UHFFFAOYSA-N	1	0	262.422	4.070	20	30		CIEDRO
N#Cc1csc(C[NH2+]CC2(Cc3ccccc3)CCC2)c1	ZINC000237849616	334100524	/nfs/dbraw/zinc/10/05/24/334100524.db2.gz	LZEFEMXIGBTNSU-UHFFFAOYSA-N	1	0	296.439	4.122	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](C)c1ccc(OC(F)(F)F)cc1	ZINC000134731967	334102090	/nfs/dbraw/zinc/10/20/90/334102090.db2.gz	NKCKWWUZLILHMF-MNOVXSKESA-N	1	0	273.298	4.200	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)c1ccc(OC(F)(F)F)cc1	ZINC000134731986	334102138	/nfs/dbraw/zinc/10/21/38/334102138.db2.gz	NKCKWWUZLILHMF-WDEREUQCSA-N	1	0	273.298	4.200	20	30		CIEDRO
C=CCC[NH2+][C@@H](Cc1ccccc1)c1ccccc1	ZINC000134911346	334108191	/nfs/dbraw/zinc/10/81/91/334108191.db2.gz	IMBJUVXCVSYPPI-SFHVURJKSA-N	1	0	251.373	4.136	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1	ZINC000135143339	334117518	/nfs/dbraw/zinc/11/75/18/334117518.db2.gz	OEVIEQZWOYZQHH-VXGBXAGGSA-N	1	0	276.346	4.027	20	30		CIEDRO
CC(C)(C)[C@H]([NH2+]Cc1ccc(C#N)o1)c1ccccc1	ZINC000135146614	334117712	/nfs/dbraw/zinc/11/77/12/334117712.db2.gz	IQDNHUQHUDDMIS-MRXNPFEDSA-N	1	0	268.360	4.028	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]Cc1ccccc1C(F)(F)F	ZINC000135167160	334118536	/nfs/dbraw/zinc/11/85/36/334118536.db2.gz	UDYKBMKERRMKJT-UHFFFAOYSA-N	1	0	284.325	4.125	20	30		CIEDRO
CSCC[C@@H](C)[N@H+](C)Cc1ccccc1C(C)(C)C#N	ZINC000135240539	334121480	/nfs/dbraw/zinc/12/14/80/334121480.db2.gz	CLEORTIINNPQPF-CQSZACIVSA-N	1	0	290.476	4.061	20	30		CIEDRO
C[C@@H]([N@H+](C)Cc1ccc(Cl)cc1C#N)C(C)(C)C	ZINC000547832091	334124832	/nfs/dbraw/zinc/12/48/32/334124832.db2.gz	TUCDBAVXRXSRMN-LLVKDONJSA-N	1	0	264.800	4.078	20	30		CIEDRO
N#CCCN(Cc1ccco1)Cc1cccc2ccccc21	ZINC000078666241	334138551	/nfs/dbraw/zinc/13/85/51/334138551.db2.gz	YGIHBTAMNQQTKN-UHFFFAOYSA-N	1	0	290.366	4.349	20	30		CIEDRO
CCC[C@@H]1CCCC[C@@H]1[NH2+]CCCC(C)(C)C#N	ZINC000548487944	334160009	/nfs/dbraw/zinc/16/00/09/334160009.db2.gz	FSTXVXPDHBGRJK-CABCVRRESA-N	1	0	250.430	4.265	20	30		CIEDRO
C[C@H]1CCc2c(F)cccc2[C@H]1[NH2+]Cc1cccc(C#N)c1	ZINC000080339836	334170622	/nfs/dbraw/zinc/17/06/22/334170622.db2.gz	IUOQPIPJLTYDEW-DJJJIMSYSA-N	1	0	294.373	4.111	20	30		CIEDRO
C=CCOCC[N@@H+]([C@@H](C)c1ccccc1Cl)C1CC1	ZINC000549405263	334192476	/nfs/dbraw/zinc/19/24/76/334192476.db2.gz	FCHNMAWNPFFSKW-ZDUSSCGKSA-N	1	0	279.811	4.068	20	30		CIEDRO
C=C(C)[C@H]([NH2+]CCC1(OC)CCC1)c1ccc(F)c(F)c1	ZINC000549552589	334197778	/nfs/dbraw/zinc/19/77/78/334197778.db2.gz	DVBOQPLJAFVSDE-INIZCTEOSA-N	1	0	295.373	4.131	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]Cc1ccc(SC)c(OC)c1	ZINC000549831035	334206070	/nfs/dbraw/zinc/20/60/70/334206070.db2.gz	YAZHXDNKAGYHLG-UHFFFAOYSA-N	1	0	279.449	4.109	20	30		CIEDRO
Cc1ccccc1C(C)(C)[NH2+]Cc1cccc(C#N)c1F	ZINC000549869510	334207752	/nfs/dbraw/zinc/20/77/52/334207752.db2.gz	PRXORZATJZXZHI-UHFFFAOYSA-N	1	0	282.362	4.031	20	30		CIEDRO
CC(C)C[C@H]([NH2+][C@@H]1CC[C@@H](C#N)C1)c1cccs1	ZINC000549929984	334209441	/nfs/dbraw/zinc/20/94/41/334209441.db2.gz	CLDPQFQFXRXWMS-MCIONIFRSA-N	1	0	262.422	4.117	20	30		CIEDRO
CC(C)C[C@H]([NH2+][C@H]1CC[C@H](C#N)C1)c1cccs1	ZINC000549929983	334209453	/nfs/dbraw/zinc/20/94/53/334209453.db2.gz	CLDPQFQFXRXWMS-IHRRRGAJSA-N	1	0	262.422	4.117	20	30		CIEDRO
CCC[N@@H+](Cc1ccc(C#N)cc1)C[C@H]1CCC(F)(F)C1	ZINC000550680393	334226722	/nfs/dbraw/zinc/22/67/22/334226722.db2.gz	MGDOQITWPVQKGF-INIZCTEOSA-N	1	0	292.373	4.206	20	30		CIEDRO
C[C@@H]([NH2+]C[C@H](c1ccccc1)C1CC1)c1cccc(C#N)c1	ZINC000550847935	334230158	/nfs/dbraw/zinc/23/01/58/334230158.db2.gz	QMUJAUSGELHSHB-FOIQADDNSA-N	1	0	290.410	4.403	20	30		CIEDRO
C[C@@H]([NH2+]Cc1coc2ccccc12)c1ccc(C#N)cc1F	ZINC000551205930	334240723	/nfs/dbraw/zinc/24/07/23/334240723.db2.gz	OIBCZEUHFVISIJ-GFCCVEGCSA-N	1	0	294.329	4.294	20	30		CIEDRO
C[C@@H]([NH2+][C@H](CCCC#N)c1ccccc1)c1ccoc1	ZINC000551205267	334240756	/nfs/dbraw/zinc/24/07/56/334240756.db2.gz	ISXKNMDQABBOFQ-RHSMWYFYSA-N	1	0	268.360	4.365	20	30		CIEDRO
N#Cc1cccc(C2([NH2+][C@H]3CCC[C@H](C4CC4)C3)CC2)c1	ZINC000551551487	334253959	/nfs/dbraw/zinc/25/39/59/334253959.db2.gz	BAPFNYRTLAFQPJ-WMZOPIPTSA-N	1	0	280.415	4.106	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+]C2(c3ccc(Cl)cc3)CCC2)C1	ZINC000551816193	334263179	/nfs/dbraw/zinc/26/31/79/334263179.db2.gz	HAYWSSAKDZJEBX-SWLSCSKDSA-N	1	0	274.795	4.001	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)s1)c1ccc(Cl)c(F)c1	ZINC000551956717	334267730	/nfs/dbraw/zinc/26/77/30/334267730.db2.gz	OKODULYUZLHCNK-VIFPVBQESA-N	1	0	294.782	4.263	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCc1ccccc1OC)c1ccco1	ZINC000552040123	334279792	/nfs/dbraw/zinc/27/97/92/334279792.db2.gz	AHGYAQGJSXHXEQ-MRXNPFEDSA-N	1	0	285.387	4.128	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@H](CO)CC1CCCC1)c1ccco1	ZINC000552055957	334282435	/nfs/dbraw/zinc/28/24/35/334282435.db2.gz	KUNMLWQYKRLZLR-SJORKVTESA-N	1	0	291.435	4.065	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@H]1CCC(F)(F)C1)c1ccco1	ZINC000552056176	334282504	/nfs/dbraw/zinc/28/25/04/334282504.db2.gz	VQBZAKVVJWMMGJ-STQMWFEESA-N	1	0	269.335	4.312	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@](C)(O)C1CCCCC1)c1ccco1	ZINC000552068183	334285300	/nfs/dbraw/zinc/28/53/00/334285300.db2.gz	MIMDSGLNMKLKLD-FUHWJXTLSA-N	1	0	291.435	4.208	20	30		CIEDRO
C=C(C)CC[N@H+]1CCCC[C@H]1c1nc2ccccc2n1C	ZINC000552070664	334285439	/nfs/dbraw/zinc/28/54/39/334285439.db2.gz	MUPBYLDSEIVZPJ-KRWDZBQOSA-N	1	0	283.419	4.067	20	30		CIEDRO
Cc1ccc2c(c1)[C@H]([NH2+][C@H](C)c1cccc(C#N)c1)[C@@H](C)C2	ZINC000248406091	334300373	/nfs/dbraw/zinc/30/03/73/334300373.db2.gz	BOUWKWIYXYHVRZ-BXTJHSDWSA-N	1	0	290.410	4.451	20	30		CIEDRO
Cc1cc(C[NH2+][C@H]2C[C@H](c3ccc(F)cc3)C2)ccc1C#N	ZINC000552292686	334314255	/nfs/dbraw/zinc/31/42/55/334314255.db2.gz	AUQZAANVKDGEGE-UAPYVXQJSA-N	1	0	294.373	4.042	20	30		CIEDRO
C=CCC[C@H]([NH2+]CC1(C(F)(F)F)CC1)c1ccco1	ZINC000552337424	334318193	/nfs/dbraw/zinc/31/81/93/334318193.db2.gz	UBKFRRBPLIRJRV-NSHDSACASA-N	1	0	273.298	4.219	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@H]2CC[C@@H](Cc3ccccc3)C2)C1	ZINC000248887202	334320832	/nfs/dbraw/zinc/32/08/32/334320832.db2.gz	MMKOHBBEDFXHOD-RDGPPVDQSA-N	1	0	282.431	4.070	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)c1ccc(Cl)cc1	ZINC000248910106	334321555	/nfs/dbraw/zinc/32/15/55/334321555.db2.gz	VFIIFPBNKWBCEB-WQVCFCJDSA-N	1	0	276.811	4.463	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)c1ccc(F)cc1Cl	ZINC000248938232	334322485	/nfs/dbraw/zinc/32/24/85/334322485.db2.gz	YOFSOOZKAJAKFT-DMDPSCGWSA-N	1	0	280.774	4.212	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@H](c2ccc(F)cc2)C2CCC2)C1	ZINC000249050826	334325781	/nfs/dbraw/zinc/32/57/81/334325781.db2.gz	XKHNKPYDKUWYRA-BVGQSLNGSA-N	1	0	286.394	4.339	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1	ZINC000249179779	334329466	/nfs/dbraw/zinc/32/94/66/334329466.db2.gz	HIHXFDASRBKVIO-YNEHKIRRSA-N	1	0	263.347	4.442	20	30		CIEDRO
C[C@@H](c1cccc(C#N)c1)[N@@H+]1CC[C@@H](c2ccccc2)C1	ZINC000249278670	334331135	/nfs/dbraw/zinc/33/11/35/334331135.db2.gz	OEAWMZAZHXKVDS-HNAYVOBHSA-N	1	0	276.383	4.109	20	30		CIEDRO
Cc1cc(C)cc(C[N@H+](Cc2ccc(C#N)cc2)C2CC2)c1	ZINC000552530754	334334015	/nfs/dbraw/zinc/33/40/15/334334015.db2.gz	TVNZLZGBDRJRAH-UHFFFAOYSA-N	1	0	290.410	4.340	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CC[C@H](c3ccccc3)C2)s1	ZINC000552696498	334342808	/nfs/dbraw/zinc/34/28/08/334342808.db2.gz	YLSCTYNMTSLRGL-LSDHHAIUSA-N	1	0	282.412	4.046	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1	ZINC000089512505	334346082	/nfs/dbraw/zinc/34/60/82/334346082.db2.gz	SFPZPSZOIXTSSX-KRWDZBQOSA-N	1	0	296.370	4.392	20	30		CIEDRO
N#Cc1ccc2c(c1)CCC[C@H]2[NH2+]Cc1ccc(F)cc1F	ZINC000552956531	334352798	/nfs/dbraw/zinc/35/27/98/334352798.db2.gz	CVWNAQZCTJKIHW-GOSISDBHSA-N	1	0	298.336	4.004	20	30		CIEDRO
Cc1cc(C)cc([C@@H](C)[NH2+]Cc2cc(C#N)ccc2F)c1	ZINC000090117255	334357658	/nfs/dbraw/zinc/35/76/58/334357658.db2.gz	QNXBJSNQNBYHGG-CQSZACIVSA-N	1	0	282.362	4.165	20	30		CIEDRO
CC[C@@H]1CCC[C@H]([NH2+][C@H](C)c2ccc(C#N)cc2)C1	ZINC000251636397	334365917	/nfs/dbraw/zinc/36/59/17/334365917.db2.gz	FSIKGNYIANQGCM-CPUCHLNUSA-N	1	0	256.393	4.178	20	30		CIEDRO
CC[C@@H]1CCC[C@H]([NH2+][C@H](C)c2ccc(C#N)c(F)c2)C1	ZINC000553791660	334399010	/nfs/dbraw/zinc/39/90/10/334399010.db2.gz	XXXLGQGJCJKRGV-IOASZLSFSA-N	1	0	274.383	4.317	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+]Cc1cnc(-c2ccncc2)s1	ZINC000554009873	334405985	/nfs/dbraw/zinc/40/59/85/334405985.db2.gz	NADVJSXPSKOSLS-CYBMUJFWSA-N	1	0	287.432	4.040	20	30		CIEDRO
C[C@H]([NH2+]CC(C)(C)CCC#N)C(C)(C)c1ccccc1	ZINC000554067947	334408529	/nfs/dbraw/zinc/40/85/29/334408529.db2.gz	VSZIRMKARMNODY-HNNXBMFYSA-N	1	0	272.436	4.272	20	30		CIEDRO
CC(C)[C@@H]1CC[C@H]([NH2+]CC(C)(C)CCC#N)C[C@H]1C	ZINC000554077460	334409571	/nfs/dbraw/zinc/40/95/71/334409571.db2.gz	NODINUABRPOECZ-PMPSAXMXSA-N	1	0	264.457	4.367	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1	ZINC000554075055	334409660	/nfs/dbraw/zinc/40/96/60/334409660.db2.gz	OWLGWHLLXPPAMQ-ZWKOTPCHSA-N	1	0	284.447	4.317	20	30		CIEDRO
C[C@@H](CCC1CCCC1)[NH2+]CC(C)(C)CCC#N	ZINC000554364472	334424670	/nfs/dbraw/zinc/42/46/70/334424670.db2.gz	DTCKLDPZCGSNQH-AWEZNQCLSA-N	1	0	250.430	4.265	20	30		CIEDRO
CCc1ccc([C@@H]([NH2+]Cc2ccc(C#N)cn2)C(C)C)cc1	ZINC000554363497	334424731	/nfs/dbraw/zinc/42/47/31/334424731.db2.gz	MXXWNRNYLANWNB-IBGZPJMESA-N	1	0	293.414	4.003	20	30		CIEDRO
Cc1cc([C@H](C)[NH2+]Cc2ccc(CC#N)cc2)cc(C)c1F	ZINC000554739219	334450231	/nfs/dbraw/zinc/45/02/31/334450231.db2.gz	WGLOTQLIWHUXCE-HNNXBMFYSA-N	1	0	296.389	4.359	20	30		CIEDRO
CC[C@H]1CC[C@H]([NH2+][C@@H]2CCc3ccc(C#N)cc32)CC1	ZINC000556201195	334499595	/nfs/dbraw/zinc/49/95/95/334499595.db2.gz	CEHQSEVOAKSKQC-MZMPZRCHSA-N	1	0	268.404	4.104	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H](CCCOC)c1ccc(F)cc1	ZINC000556218481	334500583	/nfs/dbraw/zinc/50/05/83/334500583.db2.gz	VBIHYMVQMDQSAU-KRWDZBQOSA-N	1	0	293.426	4.485	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H](c1cccnc1)C1CCC1	ZINC000556218501	334500633	/nfs/dbraw/zinc/50/06/33/334500633.db2.gz	WRMYCGBXXTWXRA-INIZCTEOSA-N	1	0	258.409	4.115	20	30		CIEDRO
C[C@@H](CC1CCCC1)[NH2+]C1(c2cccc(C#N)c2)CC1	ZINC000564744100	334519045	/nfs/dbraw/zinc/51/90/45/334519045.db2.gz	FSKRVINKUDDOSU-AWEZNQCLSA-N	1	0	268.404	4.106	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](C)c1cnc(OC)c(Cl)c1	ZINC000565520581	334570479	/nfs/dbraw/zinc/57/04/79/334570479.db2.gz	CEIXGRINGYMCQL-RYUDHWBXSA-N	1	0	282.815	4.139	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(CC#N)cc1)c1cccc(C)c1	ZINC000566619861	334657820	/nfs/dbraw/zinc/65/78/20/334657820.db2.gz	UIBARTKLFKBKBF-IBGZPJMESA-N	1	0	278.399	4.302	20	30		CIEDRO
N#CCC1CC[NH+](CCc2cc(Cl)ccc2Cl)CC1	ZINC000566950093	334670535	/nfs/dbraw/zinc/67/05/35/334670535.db2.gz	SHXXRBBOPTYRNI-UHFFFAOYSA-N	1	0	297.229	4.162	20	30		CIEDRO
CCCOc1cc(C)ccc1C[NH2+]CC(C)(C)CCC#N	ZINC000153582035	334674441	/nfs/dbraw/zinc/67/44/41/334674441.db2.gz	ZFFATPPDKRLBRO-UHFFFAOYSA-N	1	0	288.435	4.203	20	30		CIEDRO
N#CCCC1CC[NH+](CCc2ccc(F)cc2Cl)CC1	ZINC000567387961	334711677	/nfs/dbraw/zinc/71/16/77/334711677.db2.gz	PHNKWVDUHXIKFM-UHFFFAOYSA-N	1	0	294.801	4.037	20	30		CIEDRO
C=CCC[NH2+][C@@H](Cc1ccccc1)c1ccc(OC)cc1	ZINC000567653114	334746508	/nfs/dbraw/zinc/74/65/08/334746508.db2.gz	IRRDBWAKMOHJNN-IBGZPJMESA-N	1	0	281.399	4.145	20	30		CIEDRO
N#CCC[C@H](C#N)C[NH2+][C@H](c1cccc(F)c1)C1CCCC1	ZINC000567685081	334752022	/nfs/dbraw/zinc/75/20/22/334752022.db2.gz	VGUJJDOEPHLIAO-KDOFPFPSSA-N	1	0	299.393	4.090	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@H](C)c1cccc(C)c1	ZINC000157206607	334763394	/nfs/dbraw/zinc/76/33/94/334763394.db2.gz	BJWCFCRRPMBAHU-MRXNPFEDSA-N	1	0	281.399	4.411	20	30		CIEDRO
N#CCc1ccc(C[NH2+][C@H]2CCc3ccc(Cl)cc32)cc1	ZINC000567858197	334769131	/nfs/dbraw/zinc/76/91/31/334769131.db2.gz	XKCYTZINCOEYCQ-SFHVURJKSA-N	1	0	296.801	4.183	20	30		CIEDRO
CC(C)(C#N)CC[NH2+]C(C)(C)c1ccc(Cl)cc1	ZINC000157943705	334788033	/nfs/dbraw/zinc/78/80/33/334788033.db2.gz	DSMUVKDHZKOUCG-UHFFFAOYSA-N	1	0	264.800	4.105	20	30		CIEDRO
CSc1ccccc1C[C@H](C)[NH2+]CC(C)(C)CCC#N	ZINC000572862572	334885489	/nfs/dbraw/zinc/88/54/89/334885489.db2.gz	NGPUGESFJIXNRG-AWEZNQCLSA-N	1	0	290.476	4.259	20	30		CIEDRO
Cc1ccc2oc(C[NH2+]C3CCC(C)(C#N)CC3)cc2c1	ZINC000576599770	335225303	/nfs/dbraw/zinc/22/53/03/335225303.db2.gz	OAEPNXGNEKYUQY-UHFFFAOYSA-N	1	0	282.387	4.303	20	30		CIEDRO
C=CC[N@@H+](CCc1ccccc1)C[C@H]1CCC(F)(F)C1	ZINC000576689525	335234726	/nfs/dbraw/zinc/23/47/26/335234726.db2.gz	NURKACKJFMMULL-INIZCTEOSA-N	1	0	279.374	4.153	20	30		CIEDRO
C=CCCCC[NH2+][C@@H]1c2ccccc2CC12CCOCC2	ZINC000577054165	335291515	/nfs/dbraw/zinc/29/15/15/335291515.db2.gz	IHJRZUNTIDXOQA-GOSISDBHSA-N	1	0	285.431	4.027	20	30		CIEDRO
N#Cc1ccc(C[NH2+]C2(c3ccccc3)CCCC2)s1	ZINC000176969757	335348922	/nfs/dbraw/zinc/34/89/22/335348922.db2.gz	XUVWYVUOTUBCIQ-UHFFFAOYSA-N	1	0	282.412	4.179	20	30		CIEDRO
C=CC[C@H](C)[NH2+]C/C(C)=C/c1ccccc1OC(F)F	ZINC000577428691	335351503	/nfs/dbraw/zinc/35/15/03/335351503.db2.gz	MNIAIPKGIXNWJL-XSNHNAGMSA-N	1	0	281.346	4.246	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H](C)c1ccccc1N(C)C	ZINC000577536573	335366202	/nfs/dbraw/zinc/36/62/02/335366202.db2.gz	GUJDRRVLFPNPKI-CQSZACIVSA-N	1	0	260.425	4.006	20	30		CIEDRO
CC(C)(C)c1ccc(C[NH2+]Cc2cc(C#N)cs2)cc1	ZINC000177692824	335379496	/nfs/dbraw/zinc/37/94/96/335379496.db2.gz	SDAKNDSZWDOOTL-UHFFFAOYSA-N	1	0	284.428	4.207	20	30		CIEDRO
N#Cc1csc(C[NH2+][C@H](c2ccccc2)C2CCC2)c1	ZINC000177696210	335379802	/nfs/dbraw/zinc/37/98/02/335379802.db2.gz	XQAVIFTWCRCHBZ-QGZVFWFLSA-N	1	0	282.412	4.251	20	30		CIEDRO
Cc1cccc([C@H]([NH2+]CCCCC#N)C(C)(C)C)c1	ZINC000180795294	335624659	/nfs/dbraw/zinc/62/46/59/335624659.db2.gz	XEWCTAXMQIYFNB-INIZCTEOSA-N	1	0	258.409	4.366	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@@H](C)c1ccc(OC)c(OC)c1	ZINC000180878151	335627825	/nfs/dbraw/zinc/62/78/25/335627825.db2.gz	GAEDKIQYVJLHLP-KGLIPLIRSA-N	1	0	277.408	4.099	20	30		CIEDRO
CCc1cccc(Cl)c1C[NH2+]CC(C)(C)CCC#N	ZINC000578975438	335694260	/nfs/dbraw/zinc/69/42/60/335694260.db2.gz	VIRBCJCFVKULRL-UHFFFAOYSA-N	1	0	278.827	4.322	20	30		CIEDRO
C[C@@H](c1ccc(Cl)cc1)[NH+]1CCC(CCC#N)CC1	ZINC000579003234	335698813	/nfs/dbraw/zinc/69/88/13/335698813.db2.gz	ABKXJNIANXIAHM-ZDUSSCGKSA-N	1	0	276.811	4.417	20	30		CIEDRO
N#CCCCC[NH2+][C@H](c1cccc(F)c1)C1CCCC1	ZINC000181012285	335747581	/nfs/dbraw/zinc/74/75/81/335747581.db2.gz	CBVZMMGNDNQCFD-KRWDZBQOSA-N	1	0	274.383	4.340	20	30		CIEDRO
CCOc1ccccc1[C@@H](CC(C)C)[NH2+]CCCCC#N	ZINC000181263034	335756317	/nfs/dbraw/zinc/75/63/17/335756317.db2.gz	COUKWHXGAOQIIC-QGZVFWFLSA-N	1	0	288.435	4.456	20	30		CIEDRO
C=CCCC[NH2+][C@H](C)c1ccc(-c2cccnc2)cc1	ZINC000181303427	335757512	/nfs/dbraw/zinc/75/75/12/335757512.db2.gz	GFPGJVZVNJJVCF-OAHLLOKOSA-N	1	0	266.388	4.365	20	30		CIEDRO
CC1=CC[C@H]([NH2+][C@@H]2CCCc3cc(C#N)ccc32)CC1	ZINC000579453092	335759692	/nfs/dbraw/zinc/75/96/92/335759692.db2.gz	AVNSPHRBAHLODH-FUHWJXTLSA-N	1	0	266.388	4.024	20	30		CIEDRO
N#CCCC[NH2+][C@@H](c1ccc(Cl)cc1)C1CCC1	ZINC000182599383	335829364	/nfs/dbraw/zinc/82/93/64/335829364.db2.gz	JAWGLFPRZFDZLW-OAHLLOKOSA-N	1	0	262.784	4.075	20	30		CIEDRO
CC[C@H](C)[C@H](C)[NH2+]Cc1ccccc1C(C)(C)C#N	ZINC000183045179	335858116	/nfs/dbraw/zinc/85/81/16/335858116.db2.gz	VMDILYOMTISUSY-KBPBESRZSA-N	1	0	258.409	4.012	20	30		CIEDRO
COc1ccc(C#N)cc1C[NH2+][C@@H](C)c1cccc(C)c1C	ZINC000183713284	335903111	/nfs/dbraw/zinc/90/31/11/335903111.db2.gz	KYXHODWBPPPZKB-HNNXBMFYSA-N	1	0	294.398	4.035	20	30		CIEDRO
C=CC[NH+](CC=C)CCSc1ccc(Cl)cc1	ZINC000580726871	335960356	/nfs/dbraw/zinc/96/03/56/335960356.db2.gz	AXGWLTYNSPOZIG-UHFFFAOYSA-N	1	0	267.825	4.106	20	30		CIEDRO
C[C@@H]1C[C@H]1c1ccc(C[NH2+][C@H]2CCc3ccc(C#N)cc32)o1	ZINC000580863554	335976283	/nfs/dbraw/zinc/97/62/83/335976283.db2.gz	XGYIALMDMCMLJA-NJAPINKUSA-N	1	0	292.382	4.052	20	30		CIEDRO
C[C@H](c1ccc(F)c(F)c1)[NH+]1CCC(CCC#N)CC1	ZINC000581009208	335995624	/nfs/dbraw/zinc/99/56/24/335995624.db2.gz	CSWJRFSMSHZBPP-GFCCVEGCSA-N	1	0	278.346	4.042	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H]2CCCCC23CCCC3)cc1	ZINC000380610195	336006860	/nfs/dbraw/zinc/00/68/60/336006860.db2.gz	DYXAHMKGUWNLAM-KRWDZBQOSA-N	1	0	268.404	4.151	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1C=CCCCCC1)c1ccc(C#N)cc1	ZINC000381649571	336069801	/nfs/dbraw/zinc/06/98/01/336069801.db2.gz	IXSBBUHGVLMTPD-WMLDXEAASA-N	1	0	254.377	4.098	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1C=CCCCCC1)c1ccc(C#N)cc1	ZINC000381649570	336070014	/nfs/dbraw/zinc/07/00/14/336070014.db2.gz	IXSBBUHGVLMTPD-RHSMWYFYSA-N	1	0	254.377	4.098	20	30		CIEDRO
C=CCCCC[NH2+][C@H](C)c1cccc(OC(F)F)c1	ZINC000381720525	336071586	/nfs/dbraw/zinc/07/15/86/336071586.db2.gz	LCXWSCIBUZTOAJ-GFCCVEGCSA-N	1	0	269.335	4.295	20	30		CIEDRO
C=CCN(Cc1cc(C(C)(C)C)on1)Cc1cccs1	ZINC000581517014	336092801	/nfs/dbraw/zinc/09/28/01/336092801.db2.gz	JYRRNKFDHBNGGK-UHFFFAOYSA-N	1	0	290.432	4.222	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H](C)c1ccc(OC)c(OC)c1C	ZINC000581889497	336160783	/nfs/dbraw/zinc/16/07/83/336160783.db2.gz	YILMKNXXGLMPOS-AWEZNQCLSA-N	1	0	291.435	4.265	20	30		CIEDRO
C[C@@H](c1ccc(C#N)cc1)[N@@H+]1CCC=C(c2ccco2)C1	ZINC000352562321	534047719	/nfs/dbraw/zinc/04/77/19/534047719.db2.gz	JMECNWRNGKEMHU-AWEZNQCLSA-N	1	0	278.355	4.002	20	30		CIEDRO
Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+][C@@H]1CC[C@H](C#N)C1	ZINC000333560742	534367510	/nfs/dbraw/zinc/36/75/10/534367510.db2.gz	KXBBSOKIVDJWNX-PMUMKWKESA-N	1	0	293.414	4.136	20	30		CIEDRO
Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@@H]1CC[C@H](C#N)C1	ZINC000333560739	534367715	/nfs/dbraw/zinc/36/77/15/534367715.db2.gz	KXBBSOKIVDJWNX-IYOUNJFTSA-N	1	0	293.414	4.136	20	30		CIEDRO
CC(C)[C@@H]([NH2+]Cc1ccccc1C#N)c1ccccc1	ZINC000057627857	519799162	/nfs/dbraw/zinc/79/91/62/519799162.db2.gz	NODMOQPEDUDASV-GOSISDBHSA-N	1	0	264.372	4.045	20	30		CIEDRO
CCOc1ccccc1[C@@H](C)[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000121841053	521572798	/nfs/dbraw/zinc/57/27/98/521572798.db2.gz	NFFNNVJIDQBUSB-HUUCEWRRSA-N	1	0	294.398	4.369	20	30		CIEDRO
CCOc1ccccc1[C@H](C)[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000121841194	521584240	/nfs/dbraw/zinc/58/42/40/521584240.db2.gz	NFFNNVJIDQBUSB-CABCVRRESA-N	1	0	294.398	4.369	20	30		CIEDRO
N#CCCC[NH2+]Cc1cc(Cl)ccc1OC1CCCC1	ZINC000344347743	534613642	/nfs/dbraw/zinc/61/36/42/534613642.db2.gz	GUNRXKKULFXOEM-UHFFFAOYSA-N	1	0	292.810	4.055	20	30		CIEDRO
CC[C@H]([NH2+]Cc1cc(C)cc(OC)c1)c1ccc(C#N)cc1	ZINC000278829013	522639588	/nfs/dbraw/zinc/63/95/88/522639588.db2.gz	TXFPVCZPIKETQK-IBGZPJMESA-N	1	0	294.398	4.116	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(C#N)cc1)C1CCCCC1	ZINC000052335209	522642583	/nfs/dbraw/zinc/64/25/83/522642583.db2.gz	MWQVAKWASXPVMU-KRWDZBQOSA-N	1	0	256.393	4.007	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(C)cc1)c1ccc(C#N)cc1	ZINC000278168247	522644671	/nfs/dbraw/zinc/64/46/71/522644671.db2.gz	CDGAQSDEEOACBP-SFHVURJKSA-N	1	0	264.372	4.108	20	30		CIEDRO
CC[C@H]([NH2+][C@H](C)c1ccccc1)c1ccc(C#N)cc1	ZINC000278206869	522741166	/nfs/dbraw/zinc/74/11/66/522741166.db2.gz	HHXTYRJJSDSKKP-KDOFPFPSSA-N	1	0	264.372	4.360	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccc(C#N)c(OC)c1)c1ccc(C)cc1	ZINC000353605476	522872406	/nfs/dbraw/zinc/87/24/06/522872406.db2.gz	BRJDDIDTINKHTP-GOSISDBHSA-N	1	0	294.398	4.116	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H](C)c1ccc(OC)cc1)c1ccc(C#N)cc1	ZINC000278675466	522914849	/nfs/dbraw/zinc/91/48/49/522914849.db2.gz	JMAFTKQWSCEHRM-IFXJQAMLSA-N	1	0	294.398	4.369	20	30		CIEDRO
CCc1ccc(C[NH2+][C@@H](C)c2ccc(C#N)cc2)s1	ZINC000037749603	523943985	/nfs/dbraw/zinc/94/39/85/523943985.db2.gz	GOOJATHHTPNUAE-LBPRGKRZSA-N	1	0	270.401	4.033	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+]C2(c3ccc(F)cc3F)CCC2)C1	ZINC000193105313	534748068	/nfs/dbraw/zinc/74/80/68/534748068.db2.gz	PIAFIFKBOKLIRI-GXTWGEPZSA-N	1	0	290.357	4.016	20	30		CIEDRO
Cc1cccc(C)c1C[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000130235888	524261697	/nfs/dbraw/zinc/26/16/97/524261697.db2.gz	QOLDEVYQRUCDAJ-HNNXBMFYSA-N	1	0	264.372	4.026	20	30		CIEDRO
Cc1ccccc1C(C)(C)[NH2+]Cc1cc(C#N)ccc1F	ZINC000293232237	525071784	/nfs/dbraw/zinc/07/17/84/525071784.db2.gz	ZICWEORPAFTVHA-UHFFFAOYSA-N	1	0	282.362	4.031	20	30		CIEDRO
CSCC1CCC([NH2+][C@H](C)c2cccc(C#N)c2)CC1	ZINC000295876279	525367126	/nfs/dbraw/zinc/36/71/26/525367126.db2.gz	XSKUDPUIXUACNV-TUBUQKNSSA-N	1	0	288.460	4.131	20	30		CIEDRO
Cc1ccccc1[C@@H]([NH2+]Cc1ccc(C#N)o1)C(C)(C)C	ZINC000080347479	525373127	/nfs/dbraw/zinc/37/31/27/525373127.db2.gz	LGLTXBYEUWWCQM-QGZVFWFLSA-N	1	0	282.387	4.337	20	30		CIEDRO
C[C@@H]([NH2+]C[C@@H]1CCCC(F)(F)C1)c1ccc(C#N)c(F)c1	ZINC000282650186	525480043	/nfs/dbraw/zinc/48/00/43/525480043.db2.gz	HZAFSTSUIMAQAT-VXGBXAGGSA-N	1	0	296.336	4.173	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCCc2sccc21)c1ccc(C#N)cc1	ZINC000061326711	525615154	/nfs/dbraw/zinc/61/51/54/525615154.db2.gz	QXURSYUGUYTXGF-LRDDRELGSA-N	1	0	282.412	4.348	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CSc2ccccc21)c1ccc(C#N)cc1	ZINC000155887331	525637460	/nfs/dbraw/zinc/63/74/60/525637460.db2.gz	MYRBDXPWTGWSKA-LRDDRELGSA-N	1	0	280.396	4.056	20	30		CIEDRO
C[C@@H]([NH2+][C@H](c1ccccc1)C1CC1)c1ccc(C#N)cc1	ZINC000037075246	525669110	/nfs/dbraw/zinc/66/91/10/525669110.db2.gz	MASXFZLJOIMMKB-AUUYWEPGSA-N	1	0	276.383	4.360	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CSc2ccccc21)c1ccc(C#N)cc1	ZINC000155887415	525692526	/nfs/dbraw/zinc/69/25/26/525692526.db2.gz	MYRBDXPWTGWSKA-WBMJQRKESA-N	1	0	280.396	4.056	20	30		CIEDRO
CS[C@@H]1CCC[C@@H]([NH2+][C@H](C)c2ccc(C#N)c(F)c2)C1	ZINC000271969373	525832853	/nfs/dbraw/zinc/83/28/53/525832853.db2.gz	UDGQYCICYIYPKF-KCPJHIHWSA-N	1	0	292.423	4.022	20	30		CIEDRO
Cc1ccsc1[C@H](C)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000070090729	525887668	/nfs/dbraw/zinc/88/76/68/525887668.db2.gz	LMMJQPDYMOOTFD-STQMWFEESA-N	1	0	270.401	4.340	20	30		CIEDRO
N#Cc1cccc(C[NH2+]CC2CCC(C(F)(F)F)CC2)c1	ZINC000072928478	526708114	/nfs/dbraw/zinc/70/81/14/526708114.db2.gz	YGKHBKQWQIIENA-UHFFFAOYSA-N	1	0	296.336	4.017	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1CCCCc2cc(C#N)ccc21	ZINC000348222217	527000145	/nfs/dbraw/zinc/00/01/45/527000145.db2.gz	IDVNTKPPXBINLA-GOSISDBHSA-N	1	0	295.430	4.245	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H]1CCCCc2ccccc21	ZINC000348219178	527001049	/nfs/dbraw/zinc/00/10/49/527001049.db2.gz	SMKLXUUYYFEWFA-KRWDZBQOSA-N	1	0	270.420	4.374	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+][C@H](CC)c1ccc(OC)c(OC)c1	ZINC000353846753	527140677	/nfs/dbraw/zinc/14/06/77/527140677.db2.gz	RDWLZRZPMNMLBH-SQWLQELKSA-N	1	0	291.435	4.345	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@H]1CC2(CCC2)Oc2ccccc21	ZINC000343513430	527164638	/nfs/dbraw/zinc/16/46/38/527164638.db2.gz	VNZQBOLQKDKHDN-HOCLYGCPSA-N	1	0	271.404	4.377	20	30		CIEDRO
C=CCC[NH+]1CCC(c2c[nH]c3ccc(F)cc32)CC1	ZINC000347539070	527325530	/nfs/dbraw/zinc/32/55/30/527325530.db2.gz	LPSOSMFCLHNJJF-UHFFFAOYSA-N	1	0	272.367	4.063	20	30		CIEDRO
CC(C)CC[C@@H]([NH2+]Cc1cccc(C#N)c1)c1ccoc1	ZINC000353436718	527809661	/nfs/dbraw/zinc/80/96/61/527809661.db2.gz	PZVTYAXFENJSBD-GOSISDBHSA-N	1	0	282.387	4.418	20	30		CIEDRO
CCO[C@H]1C[C@H]([NH2+]CC(C)(C)CCC#N)C12CCCCC2	ZINC000348227002	528139949	/nfs/dbraw/zinc/13/99/49/528139949.db2.gz	MYARLASOUULLPY-HOTGVXAUSA-N	1	0	292.467	4.034	20	30		CIEDRO
CCC1(C)CCC([NH2+]CC(C)(C)CCC#N)CC1	ZINC000344772038	529015357	/nfs/dbraw/zinc/01/53/57/529015357.db2.gz	MFWMAJKIQMHQLK-UHFFFAOYSA-N	1	0	250.430	4.265	20	30		CIEDRO
CC1(C)CC[C@@H]([NH2+][C@@H](CCC#N)c2ccccc2)C1	ZINC000346623101	529028727	/nfs/dbraw/zinc/02/87/27/529028727.db2.gz	BXGGECZHXYSIGF-CVEARBPZSA-N	1	0	256.393	4.200	20	30		CIEDRO
CC[C@@H](CC#N)[NH2+][C@@H](C)C1CCC(C(F)(F)F)CC1	ZINC000354649725	529448731	/nfs/dbraw/zinc/44/87/31/529448731.db2.gz	OCEXWBXUYXMHQU-WTIISPKJSA-N	1	0	276.346	4.025	20	30		CIEDRO
CC[C@H]([NH2+]C[C@@H]1CCC[C@@H]1C)c1ccc(C#N)cc1	ZINC000343584130	529614037	/nfs/dbraw/zinc/61/40/37/529614037.db2.gz	BDXNRAACWRSKJB-JQFCIGGWSA-N	1	0	256.393	4.035	20	30		CIEDRO
C[C@H]([NH2+]CCC(C)(C)C1CC1)c1ccc(C#N)cc1F	ZINC000573463003	334940136	/nfs/dbraw/zinc/94/01/36/334940136.db2.gz	CDKDKWKHWKVMSQ-LBPRGKRZSA-N	1	0	274.383	4.174	20	30		CIEDRO
CCC(CC)[C@@H]([NH2+]C[C@@H](C#N)CCC#N)c1cccs1	ZINC000574631158	335035052	/nfs/dbraw/zinc/03/50/52/335035052.db2.gz	COSPZRYTDUJBRG-CZUORRHYSA-N	1	0	289.448	4.259	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+]Cc1ccc(SC)s1	ZINC000390402599	262189402	/nfs/dbraw/zinc/18/94/02/262189402.db2.gz	AIUQBUMXRDNTAA-NSHDSACASA-N	1	0	255.452	4.304	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCCc2occc21)c1ccc(C#N)c(F)c1	ZINC000335962108	533523053	/nfs/dbraw/zinc/52/30/53/533523053.db2.gz	TUHIBBMWKYNJJB-BDJLRTHQSA-N	1	0	284.334	4.019	20	30		CIEDRO
N#Cc1ccc2c(c1)CCC[C@@H]2[NH2+]Cc1ccc(Cl)cc1	ZINC000341752761	130022164	/nfs/dbraw/zinc/02/21/64/130022164.db2.gz	XBAXFCHQCOFRGQ-SFHVURJKSA-N	1	0	296.801	4.379	20	30		CIEDRO
N#Cc1ccc2c(c1)CCC[C@H]2[NH2+][C@H]1CCCc2occc21	ZINC000341759914	130027401	/nfs/dbraw/zinc/02/74/01/130027401.db2.gz	JJARLTMNMKEUFJ-MSOLQXFVSA-N	1	0	292.382	4.196	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCCc2cc(C#N)ccc21)c1cccc(F)c1	ZINC000341762412	130027848	/nfs/dbraw/zinc/02/78/48/130027848.db2.gz	VLXHYYMQPICYCG-DJJJIMSYSA-N	1	0	294.373	4.426	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCCc2cc(C#N)ccc21)c1cccs1	ZINC000341763459	130028839	/nfs/dbraw/zinc/02/88/39/130028839.db2.gz	YVKIKRQELPPGNC-MLGOLLRUSA-N	1	0	282.412	4.348	20	30		CIEDRO
N#CC1(C[NH2+][C@H]2CCC[C@H](c3ccc(Cl)cc3)C2)CC1	ZINC000575105838	335065922	/nfs/dbraw/zinc/06/59/22/335065922.db2.gz	UFMIRWGKVIDITA-HOCLYGCPSA-N	1	0	288.822	4.260	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@@H](C)c1ccccc1	ZINC000006586031	170216300	/nfs/dbraw/zinc/21/63/00/170216300.db2.gz	KGXAWXKBVOQQBC-HNNXBMFYSA-N	1	0	267.372	4.102	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1ccc(OCC#N)cc1)c1ccccc1	ZINC000037185700	260072766	/nfs/dbraw/zinc/07/27/66/260072766.db2.gz	ACHVSVWQRRUJOD-CABCVRRESA-N	1	0	280.371	4.001	20	30		CIEDRO
Cc1c(F)cccc1-c1ccc(C[NH2+]CCCCC#N)o1	ZINC000344284619	225016098	/nfs/dbraw/zinc/01/60/98/225016098.db2.gz	QSNLVXAODZHBTA-UHFFFAOYSA-N	1	0	286.350	4.178	20	30		CIEDRO
CC1([NH2+]Cc2ccc(C#N)cc2C(F)(F)F)CCCCC1	ZINC000575224883	335083819	/nfs/dbraw/zinc/08/38/19/335083819.db2.gz	VUWCSZBILIOQAY-UHFFFAOYSA-N	1	0	296.336	4.389	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+]Cc2cccc3ccccc32)C1	ZINC000192779077	227287260	/nfs/dbraw/zinc/28/72/60/227287260.db2.gz	PXYMMJUHQHGSKE-RHSMWYFYSA-N	1	0	264.372	4.012	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+]C(c2ccccc2)c2ccccc2)C1	ZINC000192588610	228153236	/nfs/dbraw/zinc/15/32/36/228153236.db2.gz	DSSNWSLCAFSWKJ-LPHOPBHVSA-N	1	0	290.410	4.448	20	30		CIEDRO
N#CCCCOc1cccc(C[NH2+][C@H]2CC3CCC2CC3)c1	ZINC000353814307	228155673	/nfs/dbraw/zinc/15/56/73/228155673.db2.gz	ZHOZCZDVKFDZBN-KVWWFHCMSA-N	1	0	298.430	4.037	20	30		CIEDRO
N#CC1(CN2CCCC[C@H]2c2nc3ccccc3o2)CCC1	ZINC000333659334	228209257	/nfs/dbraw/zinc/20/92/57/228209257.db2.gz	GPEWAKNJMJIUHS-HNNXBMFYSA-N	1	0	295.386	4.049	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCCc2occc21)c1ccc(C#N)c(F)c1	ZINC000335962110	228171734	/nfs/dbraw/zinc/17/17/34/228171734.db2.gz	TUHIBBMWKYNJJB-MEDUHNTESA-N	1	0	284.334	4.019	20	30		CIEDRO
CC[N@@H+](Cc1ccc(C#N)cc1C(F)(F)F)CC1CCC1	ZINC000521322281	260044621	/nfs/dbraw/zinc/04/46/21/260044621.db2.gz	GQUPDKABEMEOCG-UHFFFAOYSA-N	1	0	296.336	4.199	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCCC[C@H]2C(F)(F)F)C1	ZINC000447583201	260063612	/nfs/dbraw/zinc/06/36/12/260063612.db2.gz	AWQVZXFZQAYPIS-ZOBORPQBSA-N	1	0	288.357	4.027	20	30		CIEDRO
C=CCOc1cccc(C[NH+]2CCC(C(F)(F)F)CC2)c1	ZINC000179963496	260084012	/nfs/dbraw/zinc/08/40/12/260084012.db2.gz	ZNUCLZAYVRYFCX-UHFFFAOYSA-N	1	0	299.336	4.026	20	30		CIEDRO
Cc1ccc([C@H]([NH2+]Cc2cccc(C#N)c2)C2CC2)cc1	ZINC000037490522	260111901	/nfs/dbraw/zinc/11/19/01/260111901.db2.gz	AUAKNICSKNCEMT-IBGZPJMESA-N	1	0	276.383	4.108	20	30		CIEDRO
C=C(C)C[N@@H+](C)Cc1cc(Cl)cc(Cl)c1OC	ZINC000497134256	260127605	/nfs/dbraw/zinc/12/76/05/260127605.db2.gz	VQLVSZCOFCIRJP-UHFFFAOYSA-N	1	0	274.191	4.010	20	30		CIEDRO
CC(C)(C)CC(C)(C)[NH2+]Cc1ccc(C#N)c(F)c1	ZINC000404156622	260149371	/nfs/dbraw/zinc/14/93/71/260149371.db2.gz	WFDWHCATCBNEFE-UHFFFAOYSA-N	1	0	262.372	4.002	20	30		CIEDRO
CC(C)Oc1cccc([C@H](C)[NH2+]Cc2cccc(C#N)c2)c1	ZINC000078974673	260172350	/nfs/dbraw/zinc/17/23/50/260172350.db2.gz	HNVNRKCPZMCIMF-HNNXBMFYSA-N	1	0	294.398	4.196	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]Cc1ccc2nc(C)ccc2c1	ZINC000312629885	260185518	/nfs/dbraw/zinc/18/55/18/260185518.db2.gz	LXUBJQHZHVTJNH-UHFFFAOYSA-N	1	0	268.404	4.235	20	30		CIEDRO
C[C@@H]([NH2+]CC1CCCCCC1)c1ccc(C#N)cc1	ZINC000089557948	260187694	/nfs/dbraw/zinc/18/76/94/260187694.db2.gz	NQPWFUNJORWPCR-CQSZACIVSA-N	1	0	256.393	4.179	20	30		CIEDRO
C=CCCCC[NH2+][C@H](C)c1cnc2ccsc2c1	ZINC000310997049	260235185	/nfs/dbraw/zinc/23/51/85/260235185.db2.gz	IWNNJAODRBGOFH-GFCCVEGCSA-N	1	0	260.406	4.303	20	30		CIEDRO
CCS[C@H]1CCCC[C@H]1[NH2+]C1CCC(C)(C#N)CC1	ZINC000449174414	260272579	/nfs/dbraw/zinc/27/25/79/260272579.db2.gz	HLKLONNRHNIJPH-FYRZTWFESA-N	1	0	280.481	4.113	20	30		CIEDRO
C=C(CC)C[NH2+][C@@H]1C[C@H](C)Sc2sccc21	ZINC000313537468	260300910	/nfs/dbraw/zinc/30/09/10/260300910.db2.gz	NLILDVJJMFRJAF-CMPLNLGQSA-N	1	0	253.436	4.229	20	30		CIEDRO
Cc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2CCCSCC#N)o1	ZINC000080629676	260317345	/nfs/dbraw/zinc/31/73/45/260317345.db2.gz	MQHRNKINWXAKLM-HIFRSBDPSA-N	1	0	292.448	4.008	20	30		CIEDRO
C=C1CC[NH+]([C@H](C)c2ccc(C(F)(F)F)cc2)CC1	ZINC000520850845	260365511	/nfs/dbraw/zinc/36/55/11/260365511.db2.gz	YFDNBDITKFKMEM-GFCCVEGCSA-N	1	0	269.310	4.418	20	30		CIEDRO
CC(C)Oc1cccc(C[NH2+][C@@H](C)c2ccc(C#N)cc2)c1	ZINC000129318763	260385426	/nfs/dbraw/zinc/38/54/26/260385426.db2.gz	SNVKJXSLGNCQIW-HNNXBMFYSA-N	1	0	294.398	4.196	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+]CCc1nc2c(cccc2C)o1	ZINC000410359567	260490713	/nfs/dbraw/zinc/49/07/13/260490713.db2.gz	NUSAHMNNIHSWIL-AWEZNQCLSA-N	1	0	272.392	4.013	20	30		CIEDRO
N#CCCCOc1cccc(C[NH2+]C2CCCCCC2)c1	ZINC000237818738	260707390	/nfs/dbraw/zinc/70/73/90/260707390.db2.gz	ZTFNLAGMPMHZAZ-UHFFFAOYSA-N	1	0	286.419	4.182	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)c1nc(-c2ccc(C#N)cc2)cs1	ZINC000363796388	260904080	/nfs/dbraw/zinc/90/40/80/260904080.db2.gz	BYWPODUDECBRAN-ZDUSSCGKSA-N	1	0	297.427	4.299	20	30		CIEDRO
C=C[C@H]1CCCC[N@H+]1Cc1ccccc1C(C)(C)C#N	ZINC000489493614	260905975	/nfs/dbraw/zinc/90/59/75/260905975.db2.gz	ICYJKMCSSDZELL-INIZCTEOSA-N	1	0	268.404	4.028	20	30		CIEDRO
Fc1ccc(C#CC[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)cc1	ZINC000448257850	261068421	/nfs/dbraw/zinc/06/84/21/261068421.db2.gz	SFKKPFZCHRTKBH-LJQANCHMSA-N	1	0	297.348	4.153	20	30		CIEDRO
CCC1(CC)[C@H]([NH2+]CCCCC(C)(C)C#N)[C@@H](C)[C@@H]1OC	ZINC000444699167	261108103	/nfs/dbraw/zinc/10/81/03/261108103.db2.gz	MRZXDIFHPPVOOL-OAGGEKHMSA-N	1	0	294.483	4.136	20	30		CIEDRO
C=CCC[C@@H](O)C[N@@H+]1CCCC[C@@H]1c1cccc(Cl)c1	ZINC000444807436	261182788	/nfs/dbraw/zinc/18/27/88/261182788.db2.gz	WQXWOGTVTMJSHZ-IAGOWNOFSA-N	1	0	293.838	4.194	20	30		CIEDRO
C[N@H+](Cc1ccc(OC(F)F)cc1)CC(C)(C)CCC#N	ZINC000160633639	261220744	/nfs/dbraw/zinc/22/07/44/261220744.db2.gz	LUWSBCYJHHTVKU-UHFFFAOYSA-N	1	0	296.361	4.050	20	30		CIEDRO
CC(C)Cc1ncc(C[NH2+][C@H](C)c2ccc(C#N)cc2)s1	ZINC000161988120	261264664	/nfs/dbraw/zinc/26/46/64/261264664.db2.gz	YETVVUVNTFGFPP-CYBMUJFWSA-N	1	0	299.443	4.064	20	30		CIEDRO
CC(C)(CCC#N)C[N@@H+]1CCC[C@H]1c1cccs1	ZINC000162721666	261292212	/nfs/dbraw/zinc/29/22/12/261292212.db2.gz	BEWWQQIVMALUNJ-ZDUSSCGKSA-N	1	0	262.422	4.215	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1cnc(-c2ccsc2)s1	ZINC000466387432	261399209	/nfs/dbraw/zinc/39/92/09/261399209.db2.gz	JVVSBBXESHJYDG-GFCCVEGCSA-N	1	0	278.446	4.316	20	30		CIEDRO
CC[NH+](CC)[C@@H](CNc1ccc(C#N)cc1)c1ccccc1	ZINC000314136306	261579567	/nfs/dbraw/zinc/57/95/67/261579567.db2.gz	OOXKAQITZDPCHT-IBGZPJMESA-N	1	0	293.414	4.053	20	30		CIEDRO
COc1ccc([C@@H]([NH2+]CCCC(C)(C)C#N)C2CC2)cc1	ZINC000174813595	261583765	/nfs/dbraw/zinc/58/37/65/261583765.db2.gz	NYQZPCPVEVNTHB-KRWDZBQOSA-N	1	0	286.419	4.066	20	30		CIEDRO
CC(C)[C@H](C[NH2+][C@H](C)c1ccc(C#N)cc1)c1cccnc1	ZINC000176814715	261670757	/nfs/dbraw/zinc/67/07/57/261670757.db2.gz	MNAZEJDIPDNXML-BEFAXECRSA-N	1	0	293.414	4.044	20	30		CIEDRO
Cc1ccc2cc(C[NH+]3CCC(CCC#N)CC3)ccc2n1	ZINC000516651929	261683379	/nfs/dbraw/zinc/68/33/79/261683379.db2.gz	ZZLQKWVVVCQCAO-UHFFFAOYSA-N	1	0	293.414	4.059	20	30		CIEDRO
C[C@H](c1ccccc1C(F)(F)F)[C@H](C)[NH2+]CCCCC#N	ZINC000179418747	261785838	/nfs/dbraw/zinc/78/58/38/261785838.db2.gz	OZPFDWJLSPWGSM-STQMWFEESA-N	1	0	298.352	4.481	20	30		CIEDRO
C[C@@H]([NH2+]CCCCC#N)c1cc2cc(Cl)ccc2o1	ZINC000181684062	261907450	/nfs/dbraw/zinc/90/74/50/261907450.db2.gz	FFSLHNYBLIXACN-LLVKDONJSA-N	1	0	276.767	4.431	20	30		CIEDRO
Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]CCCC#N	ZINC000184088526	262008142	/nfs/dbraw/zinc/00/81/42/262008142.db2.gz	YLUPZOXRGOCILO-LBPRGKRZSA-N	1	0	285.416	4.073	20	30		CIEDRO
C[C@H]([NH2+]CCCSCC#N)c1cc2ccccc2s1	ZINC000184354316	262017469	/nfs/dbraw/zinc/01/74/69/262017469.db2.gz	QVMSYPDHDARWNG-LBPRGKRZSA-N	1	0	290.457	4.199	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1ccc(OC(F)F)cc1	ZINC000185768000	262069753	/nfs/dbraw/zinc/06/97/53/262069753.db2.gz	AYZMJYJISRCKKB-OBJOEFQTSA-N	1	0	294.345	4.021	20	30		CIEDRO
C[C@@H]([NH2+]CCCCC#N)C1(c2ccccc2)CCCC1	ZINC000185952693	262072413	/nfs/dbraw/zinc/07/24/13/262072413.db2.gz	HPHTVOCZGSOTGL-MRXNPFEDSA-N	1	0	270.420	4.170	20	30		CIEDRO
CC[C@H]([NH2+]CCCCC#N)c1cccc(Cl)c1F	ZINC000185980090	262074030	/nfs/dbraw/zinc/07/40/30/262074030.db2.gz	PVADJYIIISFCKA-ZDUSSCGKSA-N	1	0	268.763	4.214	20	30		CIEDRO
CC[C@@H](CC#N)[NH2+]C1CC(c2ccc(C(F)(F)F)cc2)C1	ZINC000364109674	262146391	/nfs/dbraw/zinc/14/63/91/262146391.db2.gz	OERJWHRYWGZFLW-BLZCZZARSA-N	1	0	296.336	4.233	20	30		CIEDRO
N#CCC[C@H]([NH2+][C@H]1CCC12CCCC2)c1ccccc1	ZINC000189179749	262168467	/nfs/dbraw/zinc/16/84/67/262168467.db2.gz	ICEKWPOOLJFDGA-IRXDYDNUSA-N	1	0	268.404	4.344	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+]C[C@@H](c2ccccc2)C(F)(F)F)C1	ZINC000193310481	262220504	/nfs/dbraw/zinc/22/05/04/262220504.db2.gz	PNTGWJNGEOUXJS-CFVMTHIKSA-N	1	0	296.336	4.004	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)c1cc2ccccc2o1	ZINC000193336985	262220994	/nfs/dbraw/zinc/22/09/94/262220994.db2.gz	FURKBIWPTRZGTA-GUTXKFCHSA-N	1	0	268.360	4.166	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccccc1C(C)(C)C#N)C1CCCC1	ZINC000184669322	262291223	/nfs/dbraw/zinc/29/12/23/262291223.db2.gz	MJNFALHMLFILDY-AWEZNQCLSA-N	1	0	270.420	4.156	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)c1ccc(Cl)cc1	ZINC000185755924	262308135	/nfs/dbraw/zinc/30/81/35/262308135.db2.gz	NRHOXFCUPBXHGG-SLEUVZQESA-N	1	0	262.784	4.073	20	30		CIEDRO
C[C@H](CCC1CCCCC1)[NH2+][C@H]1CCC[C@@H](C#N)C1	ZINC000463297559	262310784	/nfs/dbraw/zinc/31/07/84/262310784.db2.gz	NGKWHNSFXAIXIT-OIISXLGYSA-N	1	0	262.441	4.407	20	30		CIEDRO
C=CCSCC[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000221943530	262332894	/nfs/dbraw/zinc/33/28/94/262332894.db2.gz	HLSYRAUEUNRZMQ-NSHDSACASA-N	1	0	289.366	4.275	20	30		CIEDRO
C=CCSCC[NH2+][C@H](C)c1cccc(C(F)(F)F)c1	ZINC000221943579	262333024	/nfs/dbraw/zinc/33/30/24/262333024.db2.gz	HLSYRAUEUNRZMQ-LLVKDONJSA-N	1	0	289.366	4.275	20	30		CIEDRO
C=CCSCC[NH2+][C@@H](C)c1sc(C(C)(C)C)nc1C	ZINC000221946807	262335298	/nfs/dbraw/zinc/33/52/98/262335298.db2.gz	JLRCYRQBPLCLCB-NSHDSACASA-N	1	0	298.521	4.319	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H]1CCSc2ccc(Cl)cc21	ZINC000163334725	262396838	/nfs/dbraw/zinc/39/68/38/262396838.db2.gz	ZCKGIDWBHNOAIN-MFKMUULPSA-N	1	0	267.825	4.431	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]Cc1ccc(C2CCC2)cc1	ZINC000339400331	262637937	/nfs/dbraw/zinc/63/79/37/262637937.db2.gz	OFLLORGSNKPVAU-UHFFFAOYSA-N	1	0	270.420	4.374	20	30		CIEDRO
CC[C@H]([NH2+]CCC1(C#N)CCCCC1)c1c(C)noc1C	ZINC000411519081	262697219	/nfs/dbraw/zinc/69/72/19/262697219.db2.gz	RDBALRUHMCADQN-HNNXBMFYSA-N	1	0	289.423	4.196	20	30		CIEDRO
Cc1ccc2c(c1)C[N@@H+](CCC1(C#N)CCCCC1)C2	ZINC000411658587	262702220	/nfs/dbraw/zinc/70/22/20/262702220.db2.gz	CPKZEBKVZHGUDY-UHFFFAOYSA-N	1	0	268.404	4.175	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@@H]1CCC[C@@H](CC(C)C)C1	ZINC000435744143	262748040	/nfs/dbraw/zinc/74/80/40/262748040.db2.gz	VVBMYUOHWIMZMB-MLHJIOFPSA-N	1	0	279.468	4.162	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CC(C)(C)OCC1CC1)c1ccco1	ZINC000414277173	262834515	/nfs/dbraw/zinc/83/45/15/262834515.db2.gz	WKHLGPZFPQYZOT-OAHLLOKOSA-N	1	0	277.408	4.082	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+]C[C@@H](CC)CC(F)(F)F	ZINC000414278092	262834630	/nfs/dbraw/zinc/83/46/30/262834630.db2.gz	XYKBEUCJIIFVSE-NWDGAFQWSA-N	1	0	251.336	4.299	20	30		CIEDRO
Cc1ccc([C@H](C)[N@H+](C)Cc2ccc(OCC#N)cc2)cc1	ZINC000264065906	262862736	/nfs/dbraw/zinc/86/27/36/262862736.db2.gz	ANJDSIJQKZQYDQ-INIZCTEOSA-N	1	0	294.398	4.090	20	30		CIEDRO
CC1(C#N)CC[NH+](Cc2cc3ccccc3s2)CC1	ZINC000272501344	263005514	/nfs/dbraw/zinc/00/55/14/263005514.db2.gz	HAQIUAXLIYKCNT-UHFFFAOYSA-N	1	0	270.401	4.027	20	30		CIEDRO
CC1(C#N)CC[NH+](Cc2ccc(-c3ccc(F)cc3)o2)CC1	ZINC000272541972	263006227	/nfs/dbraw/zinc/00/62/27/263006227.db2.gz	PFLCAMICCKCEKV-UHFFFAOYSA-N	1	0	298.361	4.211	20	30		CIEDRO
C[C@@H](c1ccc(Cl)cc1)[NH+]1CCC(C)(C#N)CC1	ZINC000272608436	263007618	/nfs/dbraw/zinc/00/76/18/263007618.db2.gz	RYYKBFIYIVZVTL-LBPRGKRZSA-N	1	0	262.784	4.027	20	30		CIEDRO
Cc1cccc([C@@H]2CC[N@H+](CCCC(C)(C)C#N)C2)c1	ZINC000273142257	263013269	/nfs/dbraw/zinc/01/32/69/263013269.db2.gz	VTJPJQJVINXXBP-QGZVFWFLSA-N	1	0	270.420	4.114	20	30		CIEDRO
CC[C@@H]([NH2+]CCCSCC#N)c1ccc(Cl)s1	ZINC000273226238	263014135	/nfs/dbraw/zinc/01/41/35/263014135.db2.gz	BTNKPLCGCXSKIT-SNVBAGLBSA-N	1	0	288.869	4.089	20	30		CIEDRO
Cc1cccc([C@@H]2CC[N@H+](CC(C)(C)CCC#N)C2)c1	ZINC000273230554	263014142	/nfs/dbraw/zinc/01/41/42/263014142.db2.gz	WVMGJCRLTLMVKF-QGZVFWFLSA-N	1	0	270.420	4.114	20	30		CIEDRO
Cc1cc2cc([C@@H](C)[NH2+]CCCC#N)oc2cc1C	ZINC000273265413	263014683	/nfs/dbraw/zinc/01/46/83/263014683.db2.gz	NOXDFPIKNWUNEA-CYBMUJFWSA-N	1	0	256.349	4.004	20	30		CIEDRO
N#CCCCC[NH2+][C@@H]1CCCc2c(Cl)cccc21	ZINC000273607340	263018317	/nfs/dbraw/zinc/01/83/17/263018317.db2.gz	UOSJJDIWXONBBZ-OAHLLOKOSA-N	1	0	262.784	4.001	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc2ccccc2c1	ZINC000274505182	263025121	/nfs/dbraw/zinc/02/51/21/263025121.db2.gz	LNAUTPAYARVLPS-SUNYJGFJSA-N	1	0	264.372	4.183	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CC[C@H](C#N)C1)c1ccc(Cl)cc1	ZINC000274542456	263025638	/nfs/dbraw/zinc/02/56/38/263025638.db2.gz	ULRZYFUIDSGLHV-CQDKDKBSSA-N	1	0	262.784	4.073	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@H](C#N)C1)c1cccc(C(F)(F)F)c1	ZINC000274657583	263028883	/nfs/dbraw/zinc/02/88/83/263028883.db2.gz	UVIMQOBFBDNYFL-MJVIPROJSA-N	1	0	282.309	4.048	20	30		CIEDRO
C[C@]1(c2ccccc2)CC[C@@H]([NH+]2CCC(C)(C#N)CC2)C1	ZINC000276225117	263035415	/nfs/dbraw/zinc/03/54/15/263035415.db2.gz	MNTHXGVKOUCMDR-MJGOQNOKSA-N	1	0	282.431	4.122	20	30		CIEDRO
C[C@H]([NH2+]CCCCC(C)(C)C#N)c1cccc(F)c1F	ZINC000278656298	263049464	/nfs/dbraw/zinc/04/94/64/263049464.db2.gz	HOQHWUAOPOBBIB-LBPRGKRZSA-N	1	0	280.362	4.335	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H]1CC[C@@H](c2cccc(F)c2)C1	ZINC000280367030	263060793	/nfs/dbraw/zinc/06/07/93/263060793.db2.gz	UYQYUQVUIGMUIY-WBVHZDCISA-N	1	0	288.410	4.381	20	30		CIEDRO
Cc1ccsc1[C@@H](C)[NH2+]CC1CCC(C#N)CC1	ZINC000282158013	263074679	/nfs/dbraw/zinc/07/46/79/263074679.db2.gz	DEIWZYKOEHNOQY-IYXRBSQSSA-N	1	0	262.422	4.037	20	30		CIEDRO
CC(C)C[C@@H]([NH2+]CC1CCC(C#N)CC1)c1ccccn1	ZINC000282214275	263075166	/nfs/dbraw/zinc/07/51/66/263075166.db2.gz	HOJUOSIGFZHHAR-LEOMRAHMSA-N	1	0	285.435	4.088	20	30		CIEDRO
C[C@@H]([NH2+]CC1CCC(C#N)CC1)c1cc(Cl)ccc1O	ZINC000282256110	263075391	/nfs/dbraw/zinc/07/53/91/263075391.db2.gz	JTIMRUFHEMUGSR-PNESKVBLSA-N	1	0	292.810	4.026	20	30		CIEDRO
N#CCC[C@@H]([NH2+]C1CCC(C(F)F)CC1)c1ccccc1	ZINC000282267407	263075587	/nfs/dbraw/zinc/07/55/87/263075587.db2.gz	KIFUJRHHDDSTKP-UYSNPLJNSA-N	1	0	292.373	4.445	20	30		CIEDRO
C[C@H]([NH2+]CC1CCC(C#N)CC1)[C@@H](C)c1ccccc1	ZINC000282328104	263075845	/nfs/dbraw/zinc/07/58/45/263075845.db2.gz	NYMABBQPRXGPGT-XNIRIUNOSA-N	1	0	270.420	4.098	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc(C(F)(F)F)cc1	ZINC000282520456	263077297	/nfs/dbraw/zinc/07/72/97/263077297.db2.gz	ZOSCHZOWZFFRCC-COPLHBTASA-N	1	0	282.309	4.048	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CC(C)(C)[C@H]1c1cccs1	ZINC000287105449	263100950	/nfs/dbraw/zinc/10/09/50/263100950.db2.gz	YAEQHFUTYROATG-CQSZACIVSA-N	1	0	276.449	4.461	20	30		CIEDRO
C[C@@H](Cc1ccccc1C(F)(F)F)[N@H+](C)CCCCC#N	ZINC000287490237	263102043	/nfs/dbraw/zinc/10/20/43/263102043.db2.gz	SSIUAPHZJVTCFJ-ZDUSSCGKSA-N	1	0	298.352	4.262	20	30		CIEDRO
CC(C)(CCC#N)C[N@@H+]1CC(C)(C)[C@H]1c1cccs1	ZINC000290078586	263114592	/nfs/dbraw/zinc/11/45/92/263114592.db2.gz	GIKKQPSEKWKPJW-CQSZACIVSA-N	1	0	276.449	4.461	20	30		CIEDRO
CC(C)Oc1ccc([C@@H]2CCC[C@@H]2[NH2+]CCCC#N)cc1	ZINC000366677255	263115553	/nfs/dbraw/zinc/11/55/53/263115553.db2.gz	KFFJXEHSHZMBDR-ROUUACIJSA-N	1	0	286.419	4.003	20	30		CIEDRO
C[C@H](C[NH2+]CCCCC#N)c1ccc(C(F)(F)F)cc1	ZINC000290425099	263116592	/nfs/dbraw/zinc/11/65/92/263116592.db2.gz	RHOLQTVBLHHIRM-GFCCVEGCSA-N	1	0	284.325	4.092	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H]1CCCOc2ccc(OC)cc21	ZINC000340425543	263139584	/nfs/dbraw/zinc/13/95/84/263139584.db2.gz	XDIQASAWNNBRAT-MRXNPFEDSA-N	1	0	289.419	4.101	20	30		CIEDRO
N#CCCC[C@H]([NH2+][C@@H]1CC[C@@H]1C1CC1)c1ccccc1	ZINC000340428868	263141997	/nfs/dbraw/zinc/14/19/97/263141997.db2.gz	BFYAEFWWSHRLEF-FGTMMUONSA-N	1	0	268.404	4.200	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](CCCC#N)c1ccccc1)c1cncs1	ZINC000340445907	263152422	/nfs/dbraw/zinc/15/24/22/263152422.db2.gz	MDFQIMSZMLYUIS-HIFRSBDPSA-N	1	0	285.416	4.229	20	30		CIEDRO
CCC1CC([NH2+][C@H](CCCC#N)c2ccccc2)C1	ZINC000340446384	263152781	/nfs/dbraw/zinc/15/27/81/263152781.db2.gz	NUEHCROVFGUCTM-BDVYOWHSSA-N	1	0	256.393	4.200	20	30		CIEDRO
Cc1ccncc1[C@@H](C)[NH2+][C@H](CCCC#N)c1ccccc1	ZINC000340447938	263154232	/nfs/dbraw/zinc/15/42/32/263154232.db2.gz	HVDNTLGMYQVIPO-VQIMIIECSA-N	1	0	293.414	4.476	20	30		CIEDRO
Cc1ccncc1[C@H](C)[NH2+][C@@H](CCCC#N)c1ccccc1	ZINC000340447936	263154339	/nfs/dbraw/zinc/15/43/39/263154339.db2.gz	HVDNTLGMYQVIPO-LPHOPBHVSA-N	1	0	293.414	4.476	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH+]2CCC(c3cccc(Cl)c3)CC2)C1	ZINC000294203215	263157584	/nfs/dbraw/zinc/15/75/84/263157584.db2.gz	RNGHZDKPHCGUPO-CXAGYDPISA-N	1	0	288.822	4.212	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+]Cc2ccc(SC(F)F)cc2)C1	ZINC000294968374	263170199	/nfs/dbraw/zinc/17/01/99/263170199.db2.gz	FKRCUXLWSCMPMN-AAEUAGOBSA-N	1	0	296.386	4.173	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+]Cc2cc(Cl)cc3cccnc32)C1	ZINC000295078622	263172128	/nfs/dbraw/zinc/17/21/28/263172128.db2.gz	QDAUDSRBRBZTAV-LRDDRELGSA-N	1	0	299.805	4.060	20	30		CIEDRO
CCC[C@H](C[NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccccc1	ZINC000295109156	263172344	/nfs/dbraw/zinc/17/23/44/263172344.db2.gz	UTKXZMKDZZWNJV-JQHSSLGASA-N	1	0	270.420	4.242	20	30		CIEDRO
CCCCOc1ccccc1C[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000295116609	263172568	/nfs/dbraw/zinc/17/25/68/263172568.db2.gz	VXXDNLUJLVADQE-RDJZCZTQSA-N	1	0	286.419	4.037	20	30		CIEDRO
Cc1cc(C[NH2+][C@@H](CCC#N)c2ccccc2)cs1	ZINC000295712893	263181463	/nfs/dbraw/zinc/18/14/63/263181463.db2.gz	NBVZGXJNGSNERS-INIZCTEOSA-N	1	0	270.401	4.191	20	30		CIEDRO
CC(C)Oc1ccc([C@@H](C)[NH2+][C@H]2CC[C@@H](CC#N)C2)cc1	ZINC000296279079	263189275	/nfs/dbraw/zinc/18/92/75/263189275.db2.gz	DYPLGMDFCWQOSI-VYDXJSESSA-N	1	0	286.419	4.207	20	30		CIEDRO
Cc1cc(C)cc([C@H](C)[NH2+][C@H]2CC[C@@H](CC#N)C2)c1	ZINC000296345114	263190505	/nfs/dbraw/zinc/19/05/05/263190505.db2.gz	HZXUMQQKAOFFPW-ZOBUZTSGSA-N	1	0	256.393	4.036	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1cc(F)ccc1F	ZINC000296361632	263190643	/nfs/dbraw/zinc/19/06/43/263190643.db2.gz	ISTVUXBSFNWHBC-RBOXIYTFSA-N	1	0	278.346	4.088	20	30		CIEDRO
CC[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccc(C)cc1	ZINC000296514601	263192370	/nfs/dbraw/zinc/19/23/70/263192370.db2.gz	PQKCBOIDTJWBIK-BHYGNILZSA-N	1	0	256.393	4.118	20	30		CIEDRO
Cc1cccc2c1[C@H](C)C[C@H]2[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000296530956	263192373	/nfs/dbraw/zinc/19/23/73/263192373.db2.gz	QKTGXQHPXVCXIP-WBTNSWJXSA-N	1	0	268.404	4.215	20	30		CIEDRO
Cc1ccc([C@H](C)[NH2+][C@H]2CC[C@@H](CC#N)C2)c(C)c1	ZINC000296621367	263194393	/nfs/dbraw/zinc/19/43/93/263194393.db2.gz	WXTKCEVMJNQSJJ-JYJNAYRXSA-N	1	0	256.393	4.036	20	30		CIEDRO
N#CCC[C@@H]([NH2+][C@H]1CCc2cccc(O)c21)c1ccccc1	ZINC000296926545	263198293	/nfs/dbraw/zinc/19/82/93/263198293.db2.gz	PXHNJCGGYQMMBW-SJORKVTESA-N	1	0	292.382	4.014	20	30		CIEDRO
CSc1ccccc1[C@H](C)[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000453297897	263224077	/nfs/dbraw/zinc/22/40/77/263224077.db2.gz	WOXPHKXFDYMZMH-IHRRRGAJSA-N	1	0	274.433	4.141	20	30		CIEDRO
Cc1cccc2c1[C@@H](C)C[C@@H]2[NH2+]CCc1cccc(C#N)c1	ZINC000467449876	263231318	/nfs/dbraw/zinc/23/13/18/263231318.db2.gz	RTULFLVMYOBIRV-KXBFYZLASA-N	1	0	290.410	4.247	20	30		CIEDRO
CC[C@H]([NH2+][C@@H](C)CCC#N)c1cccc(Cl)c1	ZINC000299701514	263253170	/nfs/dbraw/zinc/25/31/70/263253170.db2.gz	PAQDFXMRKOFOJC-FZMZJTMJSA-N	1	0	250.773	4.073	20	30		CIEDRO
C[C@H](CCC#N)[NH2+][C@H](C)c1ccc2ccccc2c1	ZINC000299733680	263254485	/nfs/dbraw/zinc/25/44/85/263254485.db2.gz	YWRYHQNZGWHFPU-ZIAGYGMSSA-N	1	0	252.361	4.183	20	30		CIEDRO
CC(C)C[C@H]([NH2+]CCCC#N)c1ccc(Cl)cc1	ZINC000341887010	263363273	/nfs/dbraw/zinc/36/32/73/263363273.db2.gz	YQISVUIUZXSIPY-HNNXBMFYSA-N	1	0	264.800	4.321	20	30		CIEDRO
C=C1CC[NH+](Cc2ccccc2Oc2cccnc2)CC1	ZINC000341993890	263373039	/nfs/dbraw/zinc/37/30/39/263373039.db2.gz	MXFDZWTXWVIDRI-UHFFFAOYSA-N	1	0	280.371	4.026	20	30		CIEDRO
C=CCC[NH2+][C@H](CCOC)c1ccc(Cl)c(Cl)c1	ZINC000342010240	263376907	/nfs/dbraw/zinc/37/69/07/263376907.db2.gz	CMYKRUITRPBXNA-CQSZACIVSA-N	1	0	288.218	4.237	20	30		CIEDRO
C/C(=C/c1cccc(C(F)(F)F)c1)C[NH2+]CCCC#N	ZINC000342191703	263397613	/nfs/dbraw/zinc/39/76/13/263397613.db2.gz	RBDCCNMKADRPOE-XFXZXTDPSA-N	1	0	282.309	4.002	20	30		CIEDRO
C=CCCOCC[NH2+][C@H](C)c1cc2ccccc2s1	ZINC000188277942	263741081	/nfs/dbraw/zinc/74/10/81/263741081.db2.gz	HJEQIKHMSLCPNP-CYBMUJFWSA-N	1	0	275.417	4.145	20	30		CIEDRO
Cc1cc([C@@H](C)[NH2+][C@@H]2CCCc3cc(C#N)ccc32)oc1C	ZINC000417365347	263821194	/nfs/dbraw/zinc/82/11/94/263821194.db2.gz	MHEBAGTWKRDFGT-FZKQIMNGSA-N	1	0	294.398	4.496	20	30		CIEDRO
C[C@@H](C[NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc(C(F)(F)F)cc1	ZINC000425350992	264026564	/nfs/dbraw/zinc/02/65/64/264026564.db2.gz	IDHJHURZECRALS-SLEUVZQESA-N	1	0	296.336	4.091	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+]CCCc2c(Cl)cccc2Cl)C1	ZINC000425351566	264122865	/nfs/dbraw/zinc/12/28/65/264122865.db2.gz	JDPCJQMZECSNAG-NWDGAFQWSA-N	1	0	297.229	4.208	20	30		CIEDRO
COc1cc(C)ccc1C[N@H+](C)[C@@H](C)c1cccc(C#N)c1	ZINC000425364410	264137705	/nfs/dbraw/zinc/13/77/05/264137705.db2.gz	GGQAMGKFKHLANQ-HNNXBMFYSA-N	1	0	294.398	4.068	20	30		CIEDRO
C[C@@H](c1cccc(C#N)c1)[N@H+](C)Cc1cc(Cl)cs1	ZINC000425367556	264211897	/nfs/dbraw/zinc/21/18/97/264211897.db2.gz	UCENORMJPYFEMU-NSHDSACASA-N	1	0	290.819	4.466	20	30		CIEDRO
C=CC[C@@H]1[N@@H+](C/C=C/c2ccncc2)CCCC1(C)C	ZINC000425996663	264303509	/nfs/dbraw/zinc/30/35/09/264303509.db2.gz	RUMXYCOIZZIDKI-JZLODUJNSA-N	1	0	270.420	4.162	20	30		CIEDRO
Cc1ccc2cc([C@@H](C)[NH2+]CCCCC#N)oc2c1	ZINC000426012357	264308218	/nfs/dbraw/zinc/30/82/18/264308218.db2.gz	DGZFVXITHWNUDF-CYBMUJFWSA-N	1	0	256.349	4.086	20	30		CIEDRO
CC[N@H+](Cc1cccs1)[C@@H](C)c1cccc(C#N)c1	ZINC000189755474	264321778	/nfs/dbraw/zinc/32/17/78/264321778.db2.gz	KMIGFRGTHIHBQE-ZDUSSCGKSA-N	1	0	270.401	4.203	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H]1CCO[C@H]1c1ccccc1)C1CC1	ZINC000191859512	264530404	/nfs/dbraw/zinc/53/04/04/264530404.db2.gz	NSJCACHLWGLNOO-FHWLQOOXSA-N	1	0	285.431	4.099	20	30		CIEDRO
C[C@@H]1CCCC[C@@H]1C[NH2+][C@H](CCC#N)c1ccccc1	ZINC000344300053	265057063	/nfs/dbraw/zinc/05/70/63/265057063.db2.gz	HZQWFERGDLEGFI-KBAYOESNSA-N	1	0	270.420	4.447	20	30		CIEDRO
Cc1ccsc1[C@H](C)[NH2+]CC(C)(C)CCC#N	ZINC000348242378	265146709	/nfs/dbraw/zinc/14/67/09/265146709.db2.gz	JFCGJNJFECRJNN-LBPRGKRZSA-N	1	0	250.411	4.037	20	30		CIEDRO
C[C@H]([NH2+]Cc1cc(C#N)cs1)c1cc2ccccc2o1	ZINC000093492160	265181814	/nfs/dbraw/zinc/18/18/14/265181814.db2.gz	MFYBUMBOMHIYJS-NSHDSACASA-N	1	0	282.368	4.217	20	30		CIEDRO
CC[NH+](CC)Cc1cccc(NCc2cc(C#N)cs2)c1	ZINC000093492487	265183790	/nfs/dbraw/zinc/18/37/90/265183790.db2.gz	NNHSBYCCLOGMPE-UHFFFAOYSA-N	1	0	299.443	4.074	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCCCC1(C)C)c1ccc(C#N)cc1	ZINC000094276595	265232440	/nfs/dbraw/zinc/23/24/40/265232440.db2.gz	QAQUJZWKDKETRN-CZUORRHYSA-N	1	0	256.393	4.178	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCCCC1(C)C)c1ccc(C#N)cc1	ZINC000094276594	265232507	/nfs/dbraw/zinc/23/25/07/265232507.db2.gz	QAQUJZWKDKETRN-XJKSGUPXSA-N	1	0	256.393	4.178	20	30		CIEDRO
N#Cc1cccc(C[NH2+]C[C@H]2CCCC[C@H]2C(F)(F)F)c1	ZINC000519025330	265298248	/nfs/dbraw/zinc/29/82/48/265298248.db2.gz	PPKFRFADRRLZJJ-HUUCEWRRSA-N	1	0	296.336	4.017	20	30		CIEDRO
CC(C)C[N@H+](CCc1ccccc1)Cc1cccc(C#N)c1	ZINC000519055143	265308040	/nfs/dbraw/zinc/30/80/40/265308040.db2.gz	SYAAIUHHGDWOMT-UHFFFAOYSA-N	1	0	292.426	4.259	20	30		CIEDRO
CC(C)CC[N@@H+](Cc1ccc(C#N)cc1)CC(C)C	ZINC000519908549	265653825	/nfs/dbraw/zinc/65/38/25/265653825.db2.gz	CWNLROUWBFLGBE-UHFFFAOYSA-N	1	0	258.409	4.062	20	30		CIEDRO
N#Cc1ccc(C[N@@H+]2CCC[C@H](Cc3ccccc3)C2)cc1	ZINC000520697045	265897449	/nfs/dbraw/zinc/89/74/49/265897449.db2.gz	ZFLGTUUYXSHLLY-HXUWFJFHSA-N	1	0	290.410	4.013	20	30		CIEDRO
Cc1cc(N(C)Cc2ccc(C#N)cc2)c2ccccc2[nH+]1	ZINC000301080646	265977196	/nfs/dbraw/zinc/97/71/96/265977196.db2.gz	IVGVDQQMEVZELS-UHFFFAOYSA-N	1	0	287.366	4.051	20	30		CIEDRO
CCC[N@H+](CCCC#N)[C@H]1C[C@@H](OCC)C12CCCCC2	ZINC000357776102	266358162	/nfs/dbraw/zinc/35/81/62/266358162.db2.gz	SJZUDFRAVVACHY-DLBZAZTESA-N	1	0	292.467	4.130	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H]1CCCOc2c(C)cc(C)cc21	ZINC000358059758	266409724	/nfs/dbraw/zinc/40/97/24/266409724.db2.gz	JCRNJKHIQOGHTO-ZBFHGGJFSA-N	1	0	259.393	4.071	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCOCC1CCC1)c1ccccc1	ZINC000361025962	266770950	/nfs/dbraw/zinc/77/09/50/266770950.db2.gz	QIZZNYSCZKWCMJ-GOSISDBHSA-N	1	0	273.420	4.100	20	30		CIEDRO
CCC1(Cc2ccccc2)CC[NH+](CCCC#N)CC1	ZINC000361479979	266830070	/nfs/dbraw/zinc/83/00/70/266830070.db2.gz	AXQRJGTUCFEDTH-UHFFFAOYSA-N	1	0	270.420	4.025	20	30		CIEDRO
Cc1oc2ccccc2c1CC[NH2+]Cc1cc(C#N)cs1	ZINC000361741265	266877470	/nfs/dbraw/zinc/87/74/70/266877470.db2.gz	SUHFIRNHNVXGIZ-UHFFFAOYSA-N	1	0	296.395	4.007	20	30		CIEDRO
CC(C)(CCC#N)C[N@@H+]1CCC[C@@H]1c1ccc(F)c(F)c1	ZINC000367460725	267090988	/nfs/dbraw/zinc/09/09/88/267090988.db2.gz	IAEHZSLGADXQST-MRXNPFEDSA-N	1	0	292.373	4.432	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1CCC[C@@H]1c1ccccc1	ZINC000367898256	267125557	/nfs/dbraw/zinc/12/55/57/267125557.db2.gz	FDNBNIJCMRDFLQ-IAGOWNOFSA-N	1	0	270.420	4.242	20	30		CIEDRO
Cc1ccc(C2CC([NH2+]CC(C)(C)CCC#N)C2)cc1	ZINC000367897856	267125603	/nfs/dbraw/zinc/12/56/03/267125603.db2.gz	CTTGUAGPDQGGRB-UHFFFAOYSA-N	1	0	270.420	4.161	20	30		CIEDRO
Cc1ccc2c(c1)[C@@H]([NH2+]CC(C)(C)CCC#N)CCCO2	ZINC000367904912	267126917	/nfs/dbraw/zinc/12/69/17/267126917.db2.gz	RYWMPPMUQDAIGZ-INIZCTEOSA-N	1	0	286.419	4.128	20	30		CIEDRO
C=C[C@@H](C)[NH2+][C@@H]1CCSc2ccc(Cl)cc21	ZINC000119333848	267322949	/nfs/dbraw/zinc/32/29/49/267322949.db2.gz	QTCZZFQRGFIHQS-BXKDBHETSA-N	1	0	253.798	4.041	20	30		CIEDRO
N#CC1(C[NH2+][C@@H]2CC[C@@H](c3ccc(Cl)cc3)C2)CCC1	ZINC000418144406	267365479	/nfs/dbraw/zinc/36/54/79/267365479.db2.gz	TXJTZNAFNKWXNU-GDBMZVCRSA-N	1	0	288.822	4.260	20	30		CIEDRO
Cc1cc(C[NH2+][C@@H]2CCCc3cc(C#N)ccc32)cs1	ZINC000418153040	267372494	/nfs/dbraw/zinc/37/24/94/267372494.db2.gz	YKGOHYJTWMWVAA-QGZVFWFLSA-N	1	0	282.412	4.095	20	30		CIEDRO
N#Cc1ccc(C[N@@H+]2CCCCC[C@@H]2c2ccncc2)cc1	ZINC000120167626	267388993	/nfs/dbraw/zinc/38/89/93/267388993.db2.gz	CRKAQMOCPOVQDU-LJQANCHMSA-N	1	0	291.398	4.071	20	30		CIEDRO
CC(C)(C#N)CCC[NH2+][C@@H]1CCC[C@H]1c1ccc(F)cc1	ZINC000372899205	267614635	/nfs/dbraw/zinc/61/46/35/267614635.db2.gz	YUOWLQJFMBBJAB-DLBZAZTESA-N	1	0	288.410	4.381	20	30		CIEDRO
C=CCCC[NH2+][C@H]1CCc2sc(Br)cc21	ZINC000379826012	335091586	/nfs/dbraw/zinc/09/15/86/335091586.db2.gz	WOYSWLAKMMNRCI-JTQLQIEISA-N	1	0	286.238	4.054	20	30		CIEDRO
CC[C@H](C[NH2+]Cc1ccc(CC#N)cc1)c1ccccc1	ZINC000570841861	327625796	/nfs/dbraw/zinc/62/57/96/327625796.db2.gz	KSTMXKCGPJMWDF-GOSISDBHSA-N	1	0	278.399	4.036	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]C/C(C)=C/c1cccc([N+](=O)[O-])c1	ZINC000580220925	327738240	/nfs/dbraw/zinc/73/82/40/327738240.db2.gz	FHTIYRDRETWZNI-GXDHUFHOSA-N	1	0	288.391	4.190	20	30		CIEDRO
N#CCCCC[NH2+]C(Cc1ccccc1)Cc1ccccc1	ZINC000178647916	327795341	/nfs/dbraw/zinc/79/53/41/327795341.db2.gz	GEHPELBIVJOLRW-UHFFFAOYSA-N	1	0	292.426	4.124	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1cccc(N2CCCC2)c1	ZINC000185863533	327848466	/nfs/dbraw/zinc/84/84/66/327848466.db2.gz	SUBCYLLMSHJYER-RYRKJORJSA-N	1	0	297.446	4.020	20	30		CIEDRO
CC(C)(CCCc1ccccc1)C[NH2+]Cc1ccc(C#N)o1	ZINC000236589868	328001557	/nfs/dbraw/zinc/00/15/57/328001557.db2.gz	JEKZSPMGHGSGMJ-UHFFFAOYSA-N	1	0	296.414	4.290	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]CCCc1cccc(Cl)c1	ZINC000236817928	328003003	/nfs/dbraw/zinc/00/30/03/328003003.db2.gz	XQYUVNRFDXBZFI-UHFFFAOYSA-N	1	0	278.827	4.192	20	30		CIEDRO
C=C(C)CN1CCC([NH2+][C@@H]2CCCCC23CCCC3)CC1	ZINC000563294863	328010205	/nfs/dbraw/zinc/01/02/05/328010205.db2.gz	GYKLFDNXYBNTCZ-GOSISDBHSA-N	1	0	290.495	4.120	20	30		CIEDRO
C=C(C[NH2+]Cc1ccc(Cl)s1)c1ccccc1	ZINC000110057574	328031286	/nfs/dbraw/zinc/03/12/86/328031286.db2.gz	SNJAVSZPFIBMRC-UHFFFAOYSA-N	1	0	263.793	4.205	20	30		CIEDRO
C[C@@H]1CC[N@H+](CC(C)(C)CCC#N)[C@@H]2CCCC[C@H]12	ZINC000534337777	328049605	/nfs/dbraw/zinc/04/96/05/328049605.db2.gz	FYACIWQBKLDBPS-BZUAXINKSA-N	1	0	262.441	4.217	20	30		CIEDRO
N#CC1(CC[N@H+]2CC=C(C(F)(F)F)CC2)CCCCC1	ZINC000411405369	328087667	/nfs/dbraw/zinc/08/76/67/328087667.db2.gz	GZQLPXMAZZEENI-UHFFFAOYSA-N	1	0	286.341	4.045	20	30		CIEDRO
CCC(CC)C[N@H+](CCC#N)C[C@H]1CCC2(CCCC2)O1	ZINC000571146996	328088045	/nfs/dbraw/zinc/08/80/45/328088045.db2.gz	XIDZARKVRZYGLV-QGZVFWFLSA-N	1	0	292.467	4.130	20	30		CIEDRO
CC(C)[N@H+](CCC#N)C[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000571271842	328097171	/nfs/dbraw/zinc/09/71/71/328097171.db2.gz	JJAFFNWRKWAJNK-ZDUSSCGKSA-N	1	0	298.352	4.433	20	30		CIEDRO
CC[C@@H]([NH2+]C1CCC(C)(C#N)CC1)c1ccccc1	ZINC000414219549	328153423	/nfs/dbraw/zinc/15/34/23/328153423.db2.gz	HTGBKGURUVLYTE-AQFXKWCLSA-N	1	0	256.393	4.200	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H](CC)CC(F)(F)F)C1CC1	ZINC000414267291	328153937	/nfs/dbraw/zinc/15/39/37/328153937.db2.gz	RYOOAIGNVOZTEW-AAEUAGOBSA-N	1	0	263.347	4.299	20	30		CIEDRO
C=CC[C@@H](C)[C@@H](C)[NH2+][C@H]1C[C@H](c2cc(F)cc(F)c2)C1	ZINC000436306341	328155712	/nfs/dbraw/zinc/15/57/12/328155712.db2.gz	HXSAZTLUROEDCZ-CTWCOEIASA-N	1	0	279.374	4.401	20	30		CIEDRO
CCc1nc(C)c([C@H](C)[NH2+][C@@H](C)c2ccc(C#N)cc2)s1	ZINC000268815214	328186272	/nfs/dbraw/zinc/18/62/72/328186272.db2.gz	PPPRJCFZUSAXSX-RYUDHWBXSA-N	1	0	299.443	4.297	20	30		CIEDRO
C=CC[N@@H+](CCCc1ccc(C)nc1)Cc1cccs1	ZINC000353387620	328189422	/nfs/dbraw/zinc/18/94/22/328189422.db2.gz	ZAHXYJSTUBYWGB-UHFFFAOYSA-N	1	0	286.444	4.072	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CC[C@@H](C#N)C1)c1ccccc1OC(F)F	ZINC000274678534	328212713	/nfs/dbraw/zinc/21/27/13/328212713.db2.gz	ZPKYWEFGEUIGPP-BZPMIXESSA-N	1	0	294.345	4.021	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH+]2CCC(c3c[nH]c4ccccc43)CC2)C1	ZINC000278527815	328226196	/nfs/dbraw/zinc/22/61/96/328226196.db2.gz	DMEUTTBCMCGDNK-GDBMZVCRSA-N	1	0	293.414	4.040	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]C[C@H](c1ccccc1)C1CC1	ZINC000292803867	328273718	/nfs/dbraw/zinc/27/37/18/328273718.db2.gz	VTBJZILJXDHEDR-QGZVFWFLSA-N	1	0	270.420	4.100	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]C[C@@H](c1ccccc1)C1CC1	ZINC000292803864	328273773	/nfs/dbraw/zinc/27/37/73/328273773.db2.gz	VTBJZILJXDHEDR-KRWDZBQOSA-N	1	0	270.420	4.100	20	30		CIEDRO
CC1(C)CC[C@@H]1[NH2+][C@H](CCCC#N)c1ccccc1	ZINC000340430940	328276707	/nfs/dbraw/zinc/27/67/07/328276707.db2.gz	IKZYGFBHVVVUQK-CVEARBPZSA-N	1	0	256.393	4.200	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([N@H+]2[C@@H]3CC[C@H]2C[C@@H](c2ccccc2)C3)C1	ZINC000294345397	328280170	/nfs/dbraw/zinc/28/01/70/328280170.db2.gz	ZCTBVVRBZOGYTE-NLNMYJFZSA-N	1	0	280.415	4.089	20	30		CIEDRO
COc1ccc(Cl)cc1[C@@H](C)[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000296497989	328291020	/nfs/dbraw/zinc/29/10/20/328291020.db2.gz	OYBKRDQJRHFFSH-DYEKYZERSA-N	1	0	292.810	4.082	20	30		CIEDRO
N#CCCC[NH2+]Cc1ccc(-c2ccc(Cl)cc2)cc1	ZINC000563676991	328307537	/nfs/dbraw/zinc/30/75/37/328307537.db2.gz	YCEDEDXMFIASJZ-UHFFFAOYSA-N	1	0	284.790	4.400	20	30		CIEDRO
Cc1c2ccccc2oc1[C@H](C)[NH2+]Cc1cccc(C#N)c1	ZINC000048367628	328305640	/nfs/dbraw/zinc/30/56/40/328305640.db2.gz	WFPPSCJCQHDEFI-AWEZNQCLSA-N	1	0	290.366	4.464	20	30		CIEDRO
C[C@@H](CCc1ccccc1F)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000531950382	328328032	/nfs/dbraw/zinc/32/80/32/328328032.db2.gz	GAUHWJMZXBXZOW-GJZGRUSLSA-N	1	0	296.389	4.369	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@@H](C)Cc1ccsc1	ZINC000049156420	328350861	/nfs/dbraw/zinc/35/08/61/328350861.db2.gz	DTDRFFVFMYYOBZ-AWEZNQCLSA-N	1	0	287.428	4.034	20	30		CIEDRO
C=CCCNc1ccccc1C[N@@H+](C)C1CCCCC1	ZINC000303811252	328357355	/nfs/dbraw/zinc/35/73/55/328357355.db2.gz	IJTKEVWUKJWAHX-UHFFFAOYSA-N	1	0	272.436	4.439	20	30		CIEDRO
N#CCN(CCCSCc1ccccc1)C1CCCC1	ZINC000534870007	328366158	/nfs/dbraw/zinc/36/61/58/328366158.db2.gz	ZGQNKQJYWLZOKS-UHFFFAOYSA-N	1	0	288.460	4.078	20	30		CIEDRO
C[C@H](C#N)CN(C)Cc1ccc(-c2ccc(Cl)cc2)o1	ZINC000535074498	328384381	/nfs/dbraw/zinc/38/43/81/328384381.db2.gz	IQJAGJYSKKIVON-GFCCVEGCSA-N	1	0	288.778	4.191	20	30		CIEDRO
CCC[N@H+](Cc1ccc(Cl)o1)Cc1ccc(C#N)cc1	ZINC000535075730	328384610	/nfs/dbraw/zinc/38/46/10/328384610.db2.gz	ISEKWSUMWPUZHP-UHFFFAOYSA-N	1	0	288.778	4.217	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@H](C)c1cc(C)c(C)o1)c1ccccc1	ZINC000282162653	328507351	/nfs/dbraw/zinc/50/73/51/328507351.db2.gz	LTNYNVAPVKQLKH-RHSMWYFYSA-N	1	0	267.372	4.312	20	30		CIEDRO
C=C(CC)C[NH+]1CCC(OCC2CCCCC2)CC1	ZINC000538002551	326830066	/nfs/dbraw/zinc/83/00/66/326830066.db2.gz	ONEDIESIMHGCTI-UHFFFAOYSA-N	1	0	265.441	4.014	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@H](C)[C@H](OC)c1ccccc1F	ZINC000538406780	326830219	/nfs/dbraw/zinc/83/02/19/326830219.db2.gz	UEKDWRZVQVFFQW-ZJOBFFGXSA-N	1	0	279.399	4.092	20	30		CIEDRO
C[C@H]([NH2+][C@H](c1ccccc1)C1CC1)c1cccc(C#N)c1	ZINC000037303873	326844405	/nfs/dbraw/zinc/84/44/05/326844405.db2.gz	HEXMYCZLTLVQSR-IFXJQAMLSA-N	1	0	276.383	4.360	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](c1ccccc1)C1CC1)c1cccc(C#N)c1	ZINC000037303871	326844431	/nfs/dbraw/zinc/84/44/31/326844431.db2.gz	HEXMYCZLTLVQSR-KUHUBIRLSA-N	1	0	276.383	4.360	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H](CC)c1ccc(OC)c(OC)c1	ZINC000398081650	326871114	/nfs/dbraw/zinc/87/11/14/326871114.db2.gz	DNFVPTLAXXKTDQ-GDBMZVCRSA-N	1	0	291.435	4.489	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H](C)c1cnc(OC)c(Cl)c1	ZINC000565520582	326944257	/nfs/dbraw/zinc/94/42/57/326944257.db2.gz	CEIXGRINGYMCQL-VXGBXAGGSA-N	1	0	282.815	4.139	20	30		CIEDRO
C=CCCC[C@@H](C)[NH+]1CCC(F)(c2cccnc2)CC1	ZINC000556545524	326950251	/nfs/dbraw/zinc/95/02/51/326950251.db2.gz	LUHRFJSLCMURRP-OAHLLOKOSA-N	1	0	276.399	4.087	20	30		CIEDRO
C=CCCCCC[NH2+]Cc1cnc(-c2ccncc2)s1	ZINC000568237712	326975138	/nfs/dbraw/zinc/97/51/38/326975138.db2.gz	DRMDJONRYGAKRY-UHFFFAOYSA-N	1	0	287.432	4.041	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H]1CCCC(F)(F)C1)c1ccco1	ZINC000556886722	326977840	/nfs/dbraw/zinc/97/78/40/326977840.db2.gz	OBYNTAIKRMPZRV-OLZOCXBDSA-N	1	0	269.335	4.454	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@H](c1ccccc1)[C@@H]1CCOC1	ZINC000557239137	326998214	/nfs/dbraw/zinc/99/82/14/326998214.db2.gz	KTBQMVNNDSRLAR-CEXWTWQISA-N	1	0	287.447	4.489	20	30		CIEDRO
N#CCCC[NH2+][C@H](c1ccccc1)C1CCCCC1	ZINC000557725330	327023136	/nfs/dbraw/zinc/02/31/36/327023136.db2.gz	NNPFIOPUWZKPDB-QGZVFWFLSA-N	1	0	256.393	4.201	20	30		CIEDRO
Cc1cccc(C[C@H]([NH2+]Cc2ccc(C#N)s2)C2CC2)c1	ZINC000584189653	327059560	/nfs/dbraw/zinc/05/95/60/327059560.db2.gz	NPLITMNVVHXZRA-SFHVURJKSA-N	1	0	296.439	4.039	20	30		CIEDRO
C=CC[N@@H+](Cc1ccc(OC)cc1)[C@@H](C)c1ccccc1	ZINC000584190041	327059604	/nfs/dbraw/zinc/05/96/04/327059604.db2.gz	GZDJZASRSHKKCM-INIZCTEOSA-N	1	0	281.399	4.444	20	30		CIEDRO
CC(C)[C@@H](c1ccc(F)cc1)[N@H+](C)CCC(C)(C)C#N	ZINC000558107446	327074033	/nfs/dbraw/zinc/07/40/33/327074033.db2.gz	PCBKLXJJNIMQKN-INIZCTEOSA-N	1	0	276.399	4.394	20	30		CIEDRO
CC(C)CC[C@H]([NH2+]CC(C)(C)CCC#N)C1CC1	ZINC000558235819	327080433	/nfs/dbraw/zinc/08/04/33/327080433.db2.gz	PIFUBNTVAJYJOB-HNNXBMFYSA-N	1	0	250.430	4.121	20	30		CIEDRO
Cc1cccc(C[C@@H]([NH2+]CC(C)(C)CCC#N)C2CC2)c1	ZINC000558246400	327081135	/nfs/dbraw/zinc/08/11/35/327081135.db2.gz	QWVINXMXVLMPBE-GOSISDBHSA-N	1	0	284.447	4.236	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+]C[C@H]1C[C@H]1c1ccccc1	ZINC000558271019	327084355	/nfs/dbraw/zinc/08/43/55/327084355.db2.gz	DETAXZJCOBJPHH-MOPGFXCFSA-N	1	0	293.410	4.145	20	30		CIEDRO
C[C@@]1(c2ccccc2)CCC[N@H+](Cc2ccc(C#N)o2)CC1	ZINC000558412577	327092054	/nfs/dbraw/zinc/09/20/54/327092054.db2.gz	FBPAQWKGKMPDPV-LJQANCHMSA-N	1	0	294.398	4.095	20	30		CIEDRO
N#CCCCCS[C@H]1CCC[N@H+](Cc2ccccc2)C1	ZINC000569339494	327097188	/nfs/dbraw/zinc/09/71/88/327097188.db2.gz	IJPLHQUWPJJFQR-KRWDZBQOSA-N	1	0	288.460	4.078	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+][C@@H]1CCOC2(CCCC2)C1	ZINC000449189657	327119466	/nfs/dbraw/zinc/11/94/66/327119466.db2.gz	MMDKHGCOBUUFAZ-HZPDHXFCSA-N	1	0	265.441	4.203	20	30		CIEDRO
C=CCOCC[N@@H+](CC)[C@H](C)c1cc2ccccc2o1	ZINC000559049826	327139039	/nfs/dbraw/zinc/13/90/39/327139039.db2.gz	YWBUZCVFEZHXIZ-CQSZACIVSA-N	1	0	273.376	4.018	20	30		CIEDRO
CCOc1ccc([C@@H](C)[NH2+]Cc2ccc(CC#N)cc2)cc1	ZINC000517999194	327144716	/nfs/dbraw/zinc/14/47/16/327144716.db2.gz	JUTYBSCQSRGGQX-OAHLLOKOSA-N	1	0	294.398	4.002	20	30		CIEDRO
CC[N@H+](Cc1c(C)nsc1C)[C@@H](C)c1ccc(C#N)cc1	ZINC000518109001	327146887	/nfs/dbraw/zinc/14/68/87/327146887.db2.gz	GCWXDGGWBIUGGT-ZDUSSCGKSA-N	1	0	299.443	4.215	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@H]1CCCC12CCOCC2	ZINC000449307914	327156481	/nfs/dbraw/zinc/15/64/81/327156481.db2.gz	SLDAWNZYOJABTG-HOTGVXAUSA-N	1	0	265.441	4.060	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]Cc1cccc(-c2ccncc2)c1	ZINC000559308738	327157294	/nfs/dbraw/zinc/15/72/94/327157294.db2.gz	WLYDZRCXLBMZBP-UHFFFAOYSA-N	1	0	280.415	4.441	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]Cc1ccc(C)cc1-c1ccnn1C	ZINC000559307824	327157351	/nfs/dbraw/zinc/15/73/51/327157351.db2.gz	GJYHWYAHVFDSBE-UHFFFAOYSA-N	1	0	297.446	4.087	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H]1CCC[C@H](CCCC(=O)OC)C1	ZINC000559307303	327157652	/nfs/dbraw/zinc/15/76/52/327157652.db2.gz	PJBJTKNXVLOYJW-HZPDHXFCSA-N	1	0	295.467	4.080	20	30		CIEDRO
N#Cc1ccc(C[NH2+]CCc2cc3ccccc3s2)cc1	ZINC000559332219	327160529	/nfs/dbraw/zinc/16/05/29/327160529.db2.gz	HWGPVJPYDYAIFJ-UHFFFAOYSA-N	1	0	292.407	4.105	20	30		CIEDRO
C[C@@H](c1cccc(Cl)c1)[NH+]1CCC(CCC#N)CC1	ZINC000569358382	327162726	/nfs/dbraw/zinc/16/27/26/327162726.db2.gz	YWVUXACQDHZLTL-ZDUSSCGKSA-N	1	0	276.811	4.417	20	30		CIEDRO
CC(C)[N@H+](Cc1ccc(C#N)cc1C(F)(F)F)C1CCC1	ZINC000569399388	327171982	/nfs/dbraw/zinc/17/19/82/327171982.db2.gz	RYJYXYGYXCQTOP-UHFFFAOYSA-N	1	0	296.336	4.340	20	30		CIEDRO
C[C@@H]1CCC[C@H]([NH2+][C@@H]2CCc3ccc(C#N)cc32)CC1	ZINC000569413814	327173055	/nfs/dbraw/zinc/17/30/55/327173055.db2.gz	XWWWVSDCIGOVBU-RPVQJOFSSA-N	1	0	268.404	4.104	20	30		CIEDRO
C[C@H]([NH2+]C[C@H]1CSc2ccccc21)c1ccc(C#N)cc1	ZINC000092274932	327190971	/nfs/dbraw/zinc/19/09/71/327190971.db2.gz	JJMCJLUPODACTI-BBRMVZONSA-N	1	0	294.423	4.098	20	30		CIEDRO
CCc1ccc([C@H](C)[NH2+]CC(C)(C)CCC#N)s1	ZINC000554076459	327196421	/nfs/dbraw/zinc/19/64/21/327196421.db2.gz	FAYXCQMIPZNUCO-LBPRGKRZSA-N	1	0	264.438	4.291	20	30		CIEDRO
Cc1nc2c(s1)[C@@H]([N@H+](C)CC(C)(C)CCC#N)CCC2	ZINC000093365271	327197776	/nfs/dbraw/zinc/19/77/76/327197776.db2.gz	PTAVIYRHWGJEAY-AWEZNQCLSA-N	1	0	291.464	4.091	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)c1ccc(F)cc1OC(F)F	ZINC000448030457	327211537	/nfs/dbraw/zinc/21/15/37/327211537.db2.gz	SDYJNHSUBHMQDX-JTQLQIEISA-N	1	0	273.298	4.044	20	30		CIEDRO
N#CCCCC[NH+]1CCC(c2c[nH]c3ccccc23)CC1	ZINC000102396753	327226767	/nfs/dbraw/zinc/22/67/67/327226767.db2.gz	ASNVRCVVTCCZSI-UHFFFAOYSA-N	1	0	281.403	4.041	20	30		CIEDRO
CC(C)[N@H+](CCCCC#N)Cc1cccc(Cl)c1	ZINC000102397416	327226791	/nfs/dbraw/zinc/22/67/91/327226791.db2.gz	AHZAXDDGJUQFHE-UHFFFAOYSA-N	1	0	264.800	4.244	20	30		CIEDRO
N#CCCCC[N@H+]1CCC[C@@H]1c1ccccc1Cl	ZINC000102397640	327227022	/nfs/dbraw/zinc/22/70/22/327227022.db2.gz	GVKXOJIHLURWHH-OAHLLOKOSA-N	1	0	262.784	4.171	20	30		CIEDRO
CCC(C)(C)[C@H]1CCC[N@@H+]1CC(C)(C)CCC#N	ZINC000093809505	327245217	/nfs/dbraw/zinc/24/52/17/327245217.db2.gz	OGRFVDRHAPVBHO-CQSZACIVSA-N	1	0	250.430	4.217	20	30		CIEDRO
N#CC1CCC(C[NH2+]Cc2ccc(C(F)F)cc2)CC1	ZINC000559745902	327259792	/nfs/dbraw/zinc/25/97/92/327259792.db2.gz	UOTKTHZSDBHJFU-UHFFFAOYSA-N	1	0	278.346	4.044	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1ccc(OC(F)(F)F)cc1	ZINC000387513405	327261134	/nfs/dbraw/zinc/26/11/34/327261134.db2.gz	YZNFTNIJXDHUKB-NSHDSACASA-N	1	0	273.298	4.202	20	30		CIEDRO
C[C@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)c1ccc(C#N)c(F)c1	ZINC000559900107	327270134	/nfs/dbraw/zinc/27/01/34/327270134.db2.gz	STLYEHYOGWPRRL-KKXDTOCCSA-N	1	0	294.373	4.152	20	30		CIEDRO
N#CCCCC[N@@H+]1C[C@@H]2CCCC[C@]21c1ccccc1	ZINC000152499999	327276676	/nfs/dbraw/zinc/27/66/76/327276676.db2.gz	OGNNOVRROBCKON-ROUUACIJSA-N	1	0	268.404	4.082	20	30		CIEDRO
C=CCCC[NH2+]Cc1ccc(-c2ccccc2OC)cc1	ZINC000560024318	327278153	/nfs/dbraw/zinc/27/81/53/327278153.db2.gz	CYXNCLSSJISVNL-UHFFFAOYSA-N	1	0	281.399	4.418	20	30		CIEDRO
Cc1ccc2[nH]c(C[NH2+]CC(C)(C)CCC#N)cc2c1C	ZINC000569616220	327291564	/nfs/dbraw/zinc/29/15/64/327291564.db2.gz	KMWSLJNAOBYARU-UHFFFAOYSA-N	1	0	283.419	4.204	20	30		CIEDRO
C[C@@H]([NH2+]C1(c2cccc(C#N)c2)CC1)[C@@H](C)c1ccccc1	ZINC000560269296	327295083	/nfs/dbraw/zinc/29/50/83/327295083.db2.gz	UKGVCZRXKCUMGE-HZPDHXFCSA-N	1	0	290.410	4.329	20	30		CIEDRO
C=C(C)CN1CCC([NH2+][C@H](C)c2cc3ccccc3o2)CC1	ZINC000153045617	327308623	/nfs/dbraw/zinc/30/86/23/327308623.db2.gz	DUVADZMPRBZYQG-OAHLLOKOSA-N	1	0	298.430	4.124	20	30		CIEDRO
N#CCC1CC[NH+](Cc2ccc(C3CCC3)cc2)CC1	ZINC000560493402	327314934	/nfs/dbraw/zinc/31/49/34/327314934.db2.gz	PSXUGTFDMKZKEA-UHFFFAOYSA-N	1	0	268.404	4.080	20	30		CIEDRO
Cc1c(C[NH2+]CC2(C#N)CC2)sc2c1cccc2Cl	ZINC000560509347	327316910	/nfs/dbraw/zinc/31/69/10/327316910.db2.gz	CQCCEDIWAMPFKW-UHFFFAOYSA-N	1	0	290.819	4.257	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H](C)C(F)(F)F)c1ccco1	ZINC000560548675	327323204	/nfs/dbraw/zinc/32/32/04/327323204.db2.gz	RIEODENULZJARC-MNOVXSKESA-N	1	0	261.287	4.075	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@@H](C)c1ccc2n[nH]cc2c1	ZINC000560580944	327327320	/nfs/dbraw/zinc/32/73/20/327327320.db2.gz	ALJFRCIBEQKKHH-BBRMVZONSA-N	1	0	271.408	4.348	20	30		CIEDRO
Cc1ccc([C@H](C)[NH2+]CC(C)(C)CCC#N)cc1C	ZINC000561349171	327388144	/nfs/dbraw/zinc/38/81/44/327388144.db2.gz	RMMWYJMNLZQSJN-HNNXBMFYSA-N	1	0	258.409	4.284	20	30		CIEDRO
C[C@@H]1C[C@H]([NH2+]CC(C)(C)CCC#N)CC(C)(C)C1	ZINC000561443978	327395624	/nfs/dbraw/zinc/39/56/24/327395624.db2.gz	DHXIZPIIISDKGN-KGLIPLIRSA-N	1	0	250.430	4.121	20	30		CIEDRO
C[C@H]1C[C@@H]([NH2+]CC(C)(C)CCC#N)CC(C)(C)C1	ZINC000561443979	327395925	/nfs/dbraw/zinc/39/59/25/327395925.db2.gz	DHXIZPIIISDKGN-UONOGXRCSA-N	1	0	250.430	4.121	20	30		CIEDRO
N#Cc1cccc(CC[NH2+][C@@H]2CCCCC23CCCC3)c1	ZINC000561485930	327398301	/nfs/dbraw/zinc/39/83/01/327398301.db2.gz	JJRZDGVCKSCGJH-GOSISDBHSA-N	1	0	282.431	4.193	20	30		CIEDRO
CC(C)C[C@H](C)C[C@H](C)[NH2+]CC(C)(C)CCC#N	ZINC000562046049	327442123	/nfs/dbraw/zinc/44/21/23/327442123.db2.gz	ADXCXGFMTQCTKY-GJZGRUSLSA-N	1	0	252.446	4.367	20	30		CIEDRO
Cc1ccc(C[C@H](C)[NH2+][C@H]2CCc3ccc(C#N)cc32)s1	ZINC000562089770	327448436	/nfs/dbraw/zinc/44/84/36/327448436.db2.gz	YORGJCFTKZWMDG-SGTLLEGYSA-N	1	0	296.439	4.136	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](C[C@@H]1CCOC1)c1ccccc1	ZINC000562505708	327486969	/nfs/dbraw/zinc/48/69/69/327486969.db2.gz	GSXFZUGTTSEFFB-JENIJYKNSA-N	1	0	287.447	4.489	20	30		CIEDRO
C=CCCCC[NH2+][C@@H](CCCC#N)c1ccccc1	ZINC000562704119	327506788	/nfs/dbraw/zinc/50/67/88/327506788.db2.gz	PPPVZSKCTGWMNT-KRWDZBQOSA-N	1	0	256.393	4.367	20	30		CIEDRO
C=CC[NH2+][C@H](c1ccc(Br)cc1)C1CCC1	ZINC000381366069	327520778	/nfs/dbraw/zinc/52/07/78/327520778.db2.gz	GGWONYZJQLFZRO-AWEZNQCLSA-N	1	0	280.209	4.066	20	30		CIEDRO
CC(C)CC1(C)CC[NH+](CCC(C)(C)C#N)CC1	ZINC000569764764	327545494	/nfs/dbraw/zinc/54/54/94/327545494.db2.gz	VJQCQKRYQDHUJY-UHFFFAOYSA-N	1	0	250.430	4.074	20	30		CIEDRO
C=C(C)C[NH2+][C@@H](C)c1ccc(Oc2cccnc2)cc1	ZINC000570430119	327590651	/nfs/dbraw/zinc/59/06/51/327590651.db2.gz	HMQPHPISYCSSPV-AWEZNQCLSA-N	1	0	268.360	4.101	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)c1cccs1	ZINC000036991792	328631536	/nfs/dbraw/zinc/63/15/36/328631536.db2.gz	YSDNOXPSYCXCNJ-SWLSCSKDSA-N	1	0	270.401	4.422	20	30		CIEDRO
CC(C)CCC1CC[NH+](CC(C)(C)CCC#N)CC1	ZINC000535850428	328644840	/nfs/dbraw/zinc/64/48/40/328644840.db2.gz	YJOAWELEXTVFBU-UHFFFAOYSA-N	1	0	264.457	4.465	20	30		CIEDRO
CC(C)[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(CC#N)cc1	ZINC000399138945	328667695	/nfs/dbraw/zinc/66/76/95/328667695.db2.gz	TWVCVMCBVDLCIL-MSOLQXFVSA-N	1	0	270.420	4.057	20	30		CIEDRO
C=C1CC[NH+](CCCOc2cccc(C(F)(F)F)c2)CC1	ZINC000519444269	328673624	/nfs/dbraw/zinc/67/36/24/328673624.db2.gz	VLWWXMNJRQPELQ-UHFFFAOYSA-N	1	0	299.336	4.126	20	30		CIEDRO
C[C@H](CCc1ccc(F)cc1)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000532207642	328707004	/nfs/dbraw/zinc/70/70/04/328707004.db2.gz	ZCZVLCTYHYQHLS-CABCVRRESA-N	1	0	296.389	4.369	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000395295359	328735606	/nfs/dbraw/zinc/73/56/06/328735606.db2.gz	DJGBLYJFRVWTHT-LLVKDONJSA-N	1	0	257.299	4.322	20	30		CIEDRO
C=CC[NH2+][C@H](c1cccc(F)c1)c1cccc(Cl)c1	ZINC000532333792	328770380	/nfs/dbraw/zinc/77/03/80/328770380.db2.gz	FSWCBBLYWCBPOS-INIZCTEOSA-N	1	0	275.754	4.344	20	30		CIEDRO
C=CCCCCC[NH2+][C@@H](C)c1ccc(C#N)cc1F	ZINC000580390962	328802711	/nfs/dbraw/zinc/80/27/11/328802711.db2.gz	GTPGDTODWPYRKP-ZDUSSCGKSA-N	1	0	260.356	4.094	20	30		CIEDRO
CC(C)(C)[C@@H]1CCC[C@H]([NH2+]CCCCC#N)CC1	ZINC000532670089	328805551	/nfs/dbraw/zinc/80/55/51/328805551.db2.gz	GKLUDTQTACNMMX-CABCVRRESA-N	1	0	250.430	4.265	20	30		CIEDRO
C[C@@H]1C[C@@H](c2ccsc2)C[N@@H+]1CCCC(C)(C)C#N	ZINC000377941929	329035363	/nfs/dbraw/zinc/03/53/63/329035363.db2.gz	NBJSZLBOTJDOCT-UKRRQHHQSA-N	1	0	276.449	4.256	20	30		CIEDRO
N#CCCCC[N@H+]1CCCC[C@@H]1c1ccc(F)cc1F	ZINC000378192973	329042744	/nfs/dbraw/zinc/04/27/44/329042744.db2.gz	QHOLSGUPPLIGKW-MRXNPFEDSA-N	1	0	278.346	4.186	20	30		CIEDRO
N#CCCCC[N@H+]1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000378492306	329052489	/nfs/dbraw/zinc/05/24/89/329052489.db2.gz	IQFLQNFGNYFMPC-HNNXBMFYSA-N	1	0	274.383	4.089	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@H](C)c1nccn1-c1ccccc1)C1CC1	ZINC000582505155	329098441	/nfs/dbraw/zinc/09/84/41/329098441.db2.gz	QXKZHJITZXJUMJ-QAPCUYQASA-N	1	0	295.430	4.268	20	30		CIEDRO
CN(C)c1cccc([C@@H]2CCC[N@@H+]2CCCC(C)(C)C#N)c1	ZINC000174867655	329164271	/nfs/dbraw/zinc/16/42/71/329164271.db2.gz	BDFMYGWBBAWBBE-SFHVURJKSA-N	1	0	299.462	4.219	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+]CCCc1c[nH]c2ccccc12	ZINC000462024051	329193208	/nfs/dbraw/zinc/19/32/08/329193208.db2.gz	BGYFEIWLVCCUHU-MRXNPFEDSA-N	1	0	270.420	4.435	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1cn2ccccc2n1)c1ccccc1	ZINC000178956912	329203338	/nfs/dbraw/zinc/20/33/38/329203338.db2.gz	SOXBSEMJVQICAN-GOSISDBHSA-N	1	0	291.398	4.131	20	30		CIEDRO
CC[C@H]([NH2+][C@H](C)c1cnn(C(C)C)c1)c1ccc(C#N)cc1	ZINC000582944212	329292005	/nfs/dbraw/zinc/29/20/05/329292005.db2.gz	QNJMRNDCGSTBLE-KDOFPFPSSA-N	1	0	296.418	4.138	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+]CCc1nc2ccccc2s1	ZINC000583111011	329313049	/nfs/dbraw/zinc/31/30/49/329313049.db2.gz	DHRSDDHXTLUTJP-STQMWFEESA-N	1	0	274.433	4.029	20	30		CIEDRO
CCOc1ccccc1[C@H](CC)[NH2+][C@H]1CCC[C@H](C#N)C1	ZINC000185806001	329329652	/nfs/dbraw/zinc/32/96/52/329329652.db2.gz	BECDEPJTRVJXJY-ZOBUZTSGSA-N	1	0	286.419	4.208	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)c1cc(F)ccc1F	ZINC000185840832	329330282	/nfs/dbraw/zinc/33/02/82/329330282.db2.gz	KZSAGCDSWOPMBR-GHJWDPDVSA-N	1	0	278.346	4.088	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1ccc(OCCC)c(OC)c1	ZINC000508966636	332853206	/nfs/dbraw/zinc/85/32/06/332853206.db2.gz	PZPNBJLNNBLUCF-AWEZNQCLSA-N	1	0	277.408	4.101	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1ccccc1C(F)(F)F	ZINC000393771071	329391440	/nfs/dbraw/zinc/39/14/40/329391440.db2.gz	ATKGZXJHTFOABD-GFCCVEGCSA-N	1	0	257.299	4.150	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@H](C)c1cnc2ccsc2c1	ZINC000393771787	329395642	/nfs/dbraw/zinc/39/56/42/329395642.db2.gz	BJUTXKUFLKECTQ-DGCLKSJQSA-N	1	0	260.406	4.302	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](C)c1ccc(OC)cc1OC	ZINC000398090668	329432825	/nfs/dbraw/zinc/43/28/25/329432825.db2.gz	XRPLFEZLAYOEER-KBPBESRZSA-N	1	0	277.408	4.099	20	30		CIEDRO
CCc1ccc([C@H](C)[NH2+]Cc2ccc(CC#N)cc2)cc1	ZINC000399166823	329448767	/nfs/dbraw/zinc/44/87/67/329448767.db2.gz	HDSZQYKEQBMFMA-HNNXBMFYSA-N	1	0	278.399	4.166	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+][C@@H](CC1CC1)c1ccccc1	ZINC000584507866	329506128	/nfs/dbraw/zinc/50/61/28/329506128.db2.gz	IEKIPFPZEKJGHU-FHWLQOOXSA-N	1	0	285.431	4.099	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@H]2CCCc3c(Cl)cccc32)c1	ZINC000584557158	329521454	/nfs/dbraw/zinc/52/14/54/329521454.db2.gz	LWWJRNZACZNKOH-SFHVURJKSA-N	1	0	296.801	4.379	20	30		CIEDRO
N#CCCCC[NH2+][C@H]1CCC[C@H]1c1ccccc1Cl	ZINC000359971883	329644131	/nfs/dbraw/zinc/64/41/31/329644131.db2.gz	DINCDMGUQYHJHQ-HOCLYGCPSA-N	1	0	276.811	4.260	20	30		CIEDRO
N#CCCCC[NH2+][C@@H]1CCC[C@@H]1c1ccccc1Cl	ZINC000359971874	329644310	/nfs/dbraw/zinc/64/43/10/329644310.db2.gz	DINCDMGUQYHJHQ-GDBMZVCRSA-N	1	0	276.811	4.260	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@@H](CC(F)F)c1ccccc1	ZINC000421367991	329823915	/nfs/dbraw/zinc/82/39/15/329823915.db2.gz	FLBZMTZBCYEKTP-JSGCOSHPSA-N	1	0	253.336	4.327	20	30		CIEDRO
CC[C@H](C)[NH2+]Cc1cccc(OCc2cccc(C#N)c2)c1	ZINC000078435962	329960242	/nfs/dbraw/zinc/96/02/42/329960242.db2.gz	RXTVQCPUGGSIDQ-HNNXBMFYSA-N	1	0	294.398	4.025	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@H](C)c1ccc(C)o1)c1ccccc1	ZINC000271453295	330079783	/nfs/dbraw/zinc/07/97/83/330079783.db2.gz	GMPDXNNPXXDNDH-GDBMZVCRSA-N	1	0	253.345	4.003	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@@H](C)c1ccc(C)s1)c1ccccc1	ZINC000271440092	330080002	/nfs/dbraw/zinc/08/00/02/330080002.db2.gz	FCPBUAGQCRQDJS-GOEBONIOSA-N	1	0	269.413	4.472	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@@H]1CCc2ccc(OC)cc21)c1ccccc1	ZINC000271422299	330080086	/nfs/dbraw/zinc/08/00/86/330080086.db2.gz	CALUALJTROQRMV-WOJBJXKFSA-N	1	0	291.394	4.037	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@@H](C)c1ccccc1OC)c1ccccc1	ZINC000271531372	330081337	/nfs/dbraw/zinc/08/13/37/330081337.db2.gz	PRWHJCGWPGYZQU-MAUKXSAKSA-N	1	0	279.383	4.110	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@H](C)c1cccc(OC)c1)c1ccccc1	ZINC000271534108	330081481	/nfs/dbraw/zinc/08/14/81/330081481.db2.gz	PZEKUTVTXVDTJH-DNVCBOLYSA-N	1	0	279.383	4.110	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@H](C)c1ccccc1OC)c1ccccc1	ZINC000271531369	330081502	/nfs/dbraw/zinc/08/15/02/330081502.db2.gz	PRWHJCGWPGYZQU-CRAIPNDOSA-N	1	0	279.383	4.110	20	30		CIEDRO
C#CC[C@H]([NH2+]CCCCC(F)(F)F)c1ccccc1	ZINC000271656342	330081631	/nfs/dbraw/zinc/08/16/31/330081631.db2.gz	CLYHJTRHPOXMFR-AWEZNQCLSA-N	1	0	269.310	4.073	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1cc(C)nc(C)c1)c1ccco1	ZINC000421850249	330096110	/nfs/dbraw/zinc/09/61/10/330096110.db2.gz	CYSWXDBTLAOSGY-MRXNPFEDSA-N	1	0	270.376	4.089	20	30		CIEDRO
CCC[C@H]([NH2+]Cc1ccc(C#N)s1)c1ccsc1	ZINC000421867516	330099448	/nfs/dbraw/zinc/09/94/48/330099448.db2.gz	CDJFQXLIAJTSHO-AWEZNQCLSA-N	1	0	276.430	4.312	20	30		CIEDRO
CCc1ccc([C@@H](C)[NH2+]Cc2ccc(C#N)s2)s1	ZINC000421879580	330101999	/nfs/dbraw/zinc/10/19/99/330101999.db2.gz	NJPFNJNBOUKOKG-SNVBAGLBSA-N	1	0	276.430	4.094	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C#N)s1)c1csc(Cl)c1	ZINC000421881671	330102533	/nfs/dbraw/zinc/10/25/33/330102533.db2.gz	PDLXVYSLTIFLHI-MRVPVSSYSA-N	1	0	282.821	4.185	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@H](CC)c1ccc(C#N)cc1)c1ccccc1	ZINC000278615901	330117983	/nfs/dbraw/zinc/11/79/83/330117983.db2.gz	GAKAJTQDMJLTLY-WOJBJXKFSA-N	1	0	288.394	4.364	20	30		CIEDRO
C=CC[C@@H](C)[NH2+]Cc1csc(Cl)c1Cl	ZINC000379666479	330146545	/nfs/dbraw/zinc/14/65/45/330146545.db2.gz	XMGPZRPEKHSSJR-SSDOTTSWSA-N	1	0	250.194	4.109	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@@H]1CC(C)(C)Oc2ccc(N)cc21	ZINC000423449085	330202644	/nfs/dbraw/zinc/20/26/44/330202644.db2.gz	WAAYIGDKBUQDHP-GOEBONIOSA-N	1	0	288.435	4.205	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCCC(C)(C)C1)c1ccc(C#N)cc1F	ZINC000527196565	330234539	/nfs/dbraw/zinc/23/45/39/330234539.db2.gz	ITKHRHGBADWXNM-OCCSQVGLSA-N	1	0	274.383	4.317	20	30		CIEDRO
C=CCCOCC[NH2+][C@@H](C)c1ccc(OC)c2ccccc21	ZINC000536839582	330234904	/nfs/dbraw/zinc/23/49/04/330234904.db2.gz	NYDWLNLDEXMZIG-HNNXBMFYSA-N	1	0	299.414	4.092	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@@H](Cc2ccccc2)c2ccccc2)C1	ZINC000424116969	330243741	/nfs/dbraw/zinc/24/37/41/330243741.db2.gz	CDQZILQWLLURFZ-HOJAQTOUSA-N	1	0	290.410	4.252	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+][C@@H](C)c1nc2ccccc2n1CC	ZINC000536856146	330251937	/nfs/dbraw/zinc/25/19/37/330251937.db2.gz	FLQYXESGUUQBBE-LSDHHAIUSA-N	1	0	285.435	4.452	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](CC)c1ccc(OC(F)F)cc1	ZINC000536857908	330252621	/nfs/dbraw/zinc/25/26/21/330252621.db2.gz	MRQUWBZGKZEOEU-FZMZJTMJSA-N	1	0	269.335	4.293	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@H](C)c1ccc(C(C)C)cc1	ZINC000424137648	330275004	/nfs/dbraw/zinc/27/50/04/330275004.db2.gz	MDFVNDFZGJRPDG-JLSDUUJJSA-N	1	0	273.420	4.052	20	30		CIEDRO
C=CC(C)(C)CC[NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1	ZINC000527734303	330278598	/nfs/dbraw/zinc/27/85/98/330278598.db2.gz	IAUYIUGMNSNFOF-VXGBXAGGSA-N	1	0	263.347	4.299	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(C#N)o1)c1cc(C)ccc1C	ZINC000527817101	330285105	/nfs/dbraw/zinc/28/51/05/330285105.db2.gz	AHAUPMYHQYMJME-KRWDZBQOSA-N	1	0	268.360	4.009	20	30		CIEDRO
Cc1cccc([C@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)C(C)C)c1	ZINC000527904651	330289701	/nfs/dbraw/zinc/28/97/01/330289701.db2.gz	PFZDPMMFIILNLB-RYQLBKOJSA-N	1	0	270.420	4.364	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1cc(C)ccc1C	ZINC000527890480	330292291	/nfs/dbraw/zinc/29/22/91/330292291.db2.gz	ILHXGZQMCMZCCV-UXLLHSPISA-N	1	0	256.393	4.036	20	30		CIEDRO
CC[C@H](CCc1ccccc1)[NH2+]CC1CCC(C#N)CC1	ZINC000527891476	330292395	/nfs/dbraw/zinc/29/23/95/330292395.db2.gz	AQCPFBLINILFRN-CTWPCTMYSA-N	1	0	284.447	4.317	20	30		CIEDRO
CC[C@H](C)[C@@H](C)[NH2+]CC#Cc1ccc(C(F)(F)F)cc1	ZINC000536875908	330309752	/nfs/dbraw/zinc/30/97/52/330309752.db2.gz	JZSFRJFNMCFMHF-QWHCGFSZSA-N	1	0	283.337	4.081	20	30		CIEDRO
C[C@@H]([NH2+][C@H](C)c1cc(F)ccc1F)c1ccc(C#N)cc1	ZINC000036921946	330314034	/nfs/dbraw/zinc/31/40/34/330314034.db2.gz	CJYHVYUMRZSTJO-VXGBXAGGSA-N	1	0	286.325	4.248	20	30		CIEDRO
Cc1ccccc1-c1cccc(C[NH2+][C@@H]2CC[C@H](C#N)C2)c1	ZINC000424187192	330320900	/nfs/dbraw/zinc/32/09/00/330320900.db2.gz	ALQVMFXSZBNBNI-QFBILLFUSA-N	1	0	290.410	4.444	20	30		CIEDRO
CC[N@H+](C/C=C(\C)Cl)[C@H](C)c1ccc(C#N)cc1	ZINC000528355518	330321845	/nfs/dbraw/zinc/32/18/45/330321845.db2.gz	CDJIUQNQFCSRLD-CNELAYHGSA-N	1	0	262.784	4.084	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1ccc(F)c(F)c1)c1ccc(C#N)cc1	ZINC000036953161	330322725	/nfs/dbraw/zinc/32/27/25/330322725.db2.gz	IFAPCHCZPFMSRE-NEPJUHHUSA-N	1	0	286.325	4.248	20	30		CIEDRO
Cc1ccccc1-c1ccccc1C[NH2+][C@@H]1CC[C@H](C#N)C1	ZINC000424195057	330324482	/nfs/dbraw/zinc/32/44/82/330324482.db2.gz	CADCVXKLCSZFRX-FUHWJXTLSA-N	1	0	290.410	4.444	20	30		CIEDRO
C=CCC[N@@H+](CCCO)C(c1ccccc1)c1ccccc1	ZINC000533049017	330326269	/nfs/dbraw/zinc/32/62/69/330326269.db2.gz	SLRXRFXJTRJGHT-UHFFFAOYSA-N	1	0	295.426	4.037	20	30		CIEDRO
C[C@@H](c1ccc(Cl)cc1)[N@H+](C)Cc1ccc(C#N)cc1	ZINC000044894207	330333746	/nfs/dbraw/zinc/33/37/46/330333746.db2.gz	WVRUVMVQMOPMOJ-ZDUSSCGKSA-N	1	0	284.790	4.405	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@H](CCCC)c1ccccc1	ZINC000424294578	330335727	/nfs/dbraw/zinc/33/57/27/330335727.db2.gz	KYHRXVICNRXBKS-KSZLIROESA-N	1	0	273.420	4.099	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@H](CC)c1ccc(Cl)s1	ZINC000424297488	330336490	/nfs/dbraw/zinc/33/64/90/330336490.db2.gz	QSIGMGQDXRPYOH-TUAOUCFPSA-N	1	0	285.840	4.033	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@@H]2CC[C@H](c3ccc(Cl)cc3)C2)C1	ZINC000424317347	330339637	/nfs/dbraw/zinc/33/96/37/330339637.db2.gz	BZBJWQHGLCNEAU-GUDXXQAFSA-N	1	0	288.822	4.258	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@@H]2CC[C@H](c3cccc(Cl)c3)C2)C1	ZINC000424318690	330339878	/nfs/dbraw/zinc/33/98/78/330339878.db2.gz	DGDINUOTAUQAEN-GUDXXQAFSA-N	1	0	288.822	4.258	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@H]2CC[C@@H](c3cccc(Cl)c3)C2)C1	ZINC000424318691	330339898	/nfs/dbraw/zinc/33/98/98/330339898.db2.gz	DGDINUOTAUQAEN-JFOHDYCDSA-N	1	0	288.822	4.258	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)C1CCC(C(F)(F)F)CC1	ZINC000424322601	330340466	/nfs/dbraw/zinc/34/04/66/330340466.db2.gz	IIQKPEYBJKVUCM-HRDMENRUSA-N	1	0	288.357	4.025	20	30		CIEDRO
C[C@H](CCc1ccc(Cl)s1)[NH2+][C@@H]1CC[C@H](C#N)C1	ZINC000424324529	330341000	/nfs/dbraw/zinc/34/10/00/330341000.db2.gz	KDBPJEVQIDAHKC-GRYCIOLGSA-N	1	0	282.840	4.004	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1cc(Cl)cc(Cl)c1	ZINC000424330866	330342257	/nfs/dbraw/zinc/34/22/57/330342257.db2.gz	RHZOBMQIWIDNJM-PKFCDNJMSA-N	1	0	283.202	4.336	20	30		CIEDRO
C=C(CC)C[NH+]1CCC(C(=O)c2ccc(C)cc2C)CC1	ZINC000536906541	330363879	/nfs/dbraw/zinc/36/38/79/330363879.db2.gz	UAJYUNLFXCALHS-UHFFFAOYSA-N	1	0	285.431	4.164	20	30		CIEDRO
CC(C)[N@H+](CCCSCC#N)Cc1cccc(Cl)c1	ZINC000080627209	330366979	/nfs/dbraw/zinc/36/69/79/330366979.db2.gz	OTIZCIPZLOZZON-UHFFFAOYSA-N	1	0	296.867	4.197	20	30		CIEDRO
C=CCCC[C@H](C)[N@H+](C)Cc1nc2ccccc2s1	ZINC000536994501	330375444	/nfs/dbraw/zinc/37/54/44/330375444.db2.gz	CFYZEUCHNRIZSR-ZDUSSCGKSA-N	1	0	274.433	4.473	20	30		CIEDRO
CC[C@H](C)[NH2+]Cc1ccc(-c2ccccc2C#N)cc1	ZINC000537012467	330378976	/nfs/dbraw/zinc/37/89/76/330378976.db2.gz	SFZIBKRAFOQAIZ-AWEZNQCLSA-N	1	0	264.372	4.113	20	30		CIEDRO
CCCc1ccc([C@@H]([NH2+]C[C@@H](C#N)CCC#N)C(C)C)cc1	ZINC000119839197	330379338	/nfs/dbraw/zinc/37/93/38/330379338.db2.gz	QHFDCAZLIYJLHK-MJGOQNOKSA-N	1	0	297.446	4.369	20	30		CIEDRO
CC[N@H+](Cc1ccccc1OC)[C@@H](C)c1ccc(C#N)cc1	ZINC000119873896	330381202	/nfs/dbraw/zinc/38/12/02/330381202.db2.gz	ZAWDMALLZOSIKY-HNNXBMFYSA-N	1	0	294.398	4.150	20	30		CIEDRO
C[C@H]1CC(C)(C)CC[C@@H]1[NH2+]CCCC(C)(C)C#N	ZINC000120936343	330393369	/nfs/dbraw/zinc/39/33/69/330393369.db2.gz	SQPUGNSJVUOFJD-KBPBESRZSA-N	1	0	250.430	4.121	20	30		CIEDRO
C=CCC[C@@H]([NH2+][C@H](C)c1cccnc1)c1ccccc1	ZINC000090580749	330393821	/nfs/dbraw/zinc/39/38/21/330393821.db2.gz	XOAOBWMPPPHELF-CRAIPNDOSA-N	1	0	266.388	4.440	20	30		CIEDRO
C[C@@H]1[C@@H](c2ccccc2)CC[N@@H+]1Cc1cccc(C#N)c1F	ZINC000537047872	330394410	/nfs/dbraw/zinc/39/44/10/330394410.db2.gz	UIYRHIOMQVQIME-KDOFPFPSSA-N	1	0	294.373	4.075	20	30		CIEDRO
C=CCCC[C@H](C)[N@@H+]1CC[C@@H](COCc2ccccc2)C1	ZINC000537047467	330394434	/nfs/dbraw/zinc/39/44/34/330394434.db2.gz	NPNLCIZGDIYDFN-PKOBYXMFSA-N	1	0	287.447	4.270	20	30		CIEDRO
C[C@H]([NH2+][C@@H](CCC#N)c1ccccc1)C1CCCC1	ZINC000090665085	330394618	/nfs/dbraw/zinc/39/46/18/330394618.db2.gz	AAKSCFIQSXJTEZ-YOEHRIQHSA-N	1	0	256.393	4.200	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H](c1cccnc1)C(C)C)C1CC1	ZINC000121585836	330403414	/nfs/dbraw/zinc/40/34/14/330403414.db2.gz	AXNDPCRMVCXNIE-MSOLQXFVSA-N	1	0	272.436	4.156	20	30		CIEDRO
N#Cc1ccc(C[NH2+]CC2(c3ccccc3)CCCC2)s1	ZINC000537211193	330415747	/nfs/dbraw/zinc/41/57/47/330415747.db2.gz	ONALWJJSRHQZDW-UHFFFAOYSA-N	1	0	296.439	4.221	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]Cc2cc3ccccc3o2)cc1	ZINC000060977392	330427493	/nfs/dbraw/zinc/42/74/93/330427493.db2.gz	VZXBVWJJDJIJRM-UHFFFAOYSA-N	1	0	293.366	4.287	20	30		CIEDRO
N#Cc1ccc(C[NH2+]CCCC2CCCCC2)s1	ZINC000537238760	330430241	/nfs/dbraw/zinc/43/02/41/330430241.db2.gz	ZNQYKXADFORREQ-UHFFFAOYSA-N	1	0	262.422	4.070	20	30		CIEDRO
CC(C)(C)[C@H]([NH2+]CCC(C)(C)C#N)c1cccc(F)c1	ZINC000537412691	330435096	/nfs/dbraw/zinc/43/50/96/330435096.db2.gz	ZFMKFBJNAVILOF-OAHLLOKOSA-N	1	0	276.399	4.442	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@@]1(C)CCCS1)c1ccco1	ZINC000428442291	330523701	/nfs/dbraw/zinc/52/37/01/330523701.db2.gz	ZZGJMLTYJFGLTL-UKRRQHHQSA-N	1	0	265.422	4.162	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](C)[C@H]1OCCc2sccc21	ZINC000429121492	330538740	/nfs/dbraw/zinc/53/87/40/330538740.db2.gz	GOFSFRXYQHPQGN-WOSRLPQWSA-N	1	0	279.449	4.085	20	30		CIEDRO
CC(C)Cc1ccc([C@@H](C)[NH2+]CC2(CC#N)CC2)cc1	ZINC000430739156	330572167	/nfs/dbraw/zinc/57/21/67/330572167.db2.gz	HCRNODANLHBQLZ-OAHLLOKOSA-N	1	0	270.420	4.230	20	30		CIEDRO
CC(C)[C@@H]([NH2+]CC1(CC#N)CC1)c1cc2ccccc2o1	ZINC000430751938	330573136	/nfs/dbraw/zinc/57/31/36/330573136.db2.gz	DFJMFNSERUBULX-QGZVFWFLSA-N	1	0	282.387	4.413	20	30		CIEDRO
CC(C)[C@H]([NH2+]CC1(CC#N)CC1)c1cc2ccccc2o1	ZINC000430751937	330573171	/nfs/dbraw/zinc/57/31/71/330573171.db2.gz	DFJMFNSERUBULX-KRWDZBQOSA-N	1	0	282.387	4.413	20	30		CIEDRO
N#CCCC[C@@H]([NH2+]CCOc1ccccc1)c1ccccc1	ZINC000433012789	330612111	/nfs/dbraw/zinc/61/21/11/330612111.db2.gz	MBXBZWLAFLSQMK-LJQANCHMSA-N	1	0	294.398	4.090	20	30		CIEDRO
N#CCCC[C@H]([NH2+]CCOc1ccccc1)c1ccccc1	ZINC000433012788	330612180	/nfs/dbraw/zinc/61/21/80/330612180.db2.gz	MBXBZWLAFLSQMK-IBGZPJMESA-N	1	0	294.398	4.090	20	30		CIEDRO
C=CCC[C@H](C)[NH2+]Cc1cc(F)c(Cl)cc1F	ZINC000433095815	330617167	/nfs/dbraw/zinc/61/71/67/330617167.db2.gz	ZPDNEQACGUJDDW-VIFPVBQESA-N	1	0	259.727	4.063	20	30		CIEDRO
C[C@H]([NH2+][C@H]1C[C@H](c2cccc(F)c2)C1)c1ccc(C#N)cc1	ZINC000435661743	330659597	/nfs/dbraw/zinc/65/95/97/330659597.db2.gz	GKDXGYXZIBQIJU-IXDGSTSKSA-N	1	0	294.373	4.294	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+]C[C@H](CCC)c1ccccc1	ZINC000435726029	330660932	/nfs/dbraw/zinc/66/09/32/330660932.db2.gz	LBGGRYUWFQBUQM-FHWLQOOXSA-N	1	0	287.447	4.141	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@@H]1CC[C@H](C)c2ccccc21	ZINC000436289543	330673624	/nfs/dbraw/zinc/67/36/24/330673624.db2.gz	XREHPSFOIIKGLD-SFUIVIKGSA-N	1	0	285.431	4.196	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@H]1C[C@@H](C(C)C)c2ccccc21	ZINC000436292812	330674080	/nfs/dbraw/zinc/67/40/80/330674080.db2.gz	CLRRBJRAZUEGEQ-TTYHFUOFSA-N	1	0	299.458	4.442	20	30		CIEDRO
C=CC[C@@H](C)[C@@H](C)[NH2+]CCc1ccc(SC)cc1	ZINC000436295686	330674291	/nfs/dbraw/zinc/67/42/91/330674291.db2.gz	QBFZKNAMYGEJMY-ZIAGYGMSSA-N	1	0	263.450	4.141	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@H](CCC)C1CCCCC1	ZINC000436301612	330674689	/nfs/dbraw/zinc/67/46/89/330674689.db2.gz	MQHRUMWDYRLHEH-KURKYZTESA-N	1	0	279.468	4.306	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+][C@@H](CC(C)C)c1cccs1	ZINC000436311461	330675398	/nfs/dbraw/zinc/67/53/98/330675398.db2.gz	XTTPXRORQIVEDW-ZOBUZTSGSA-N	1	0	293.476	4.406	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCc1c[nH]c2cccc(C)c12)C1CC1	ZINC000438993445	330732088	/nfs/dbraw/zinc/73/20/88/330732088.db2.gz	BQCHIQIZXZEIQE-KRWDZBQOSA-N	1	0	282.431	4.353	20	30		CIEDRO
C[C@@H](Cc1ccc(Cl)cc1)[NH2+]CC1CCC(C#N)CC1	ZINC000441338551	330766067	/nfs/dbraw/zinc/76/60/67/330766067.db2.gz	FZHCAAUFYNPQTC-JEYLPNPQSA-N	1	0	290.838	4.191	20	30		CIEDRO
CC(C)[C@H]1CCC[C@@H]([NH2+]CC2CCC(C#N)CC2)C1	ZINC000441362483	330766639	/nfs/dbraw/zinc/76/66/39/330766639.db2.gz	WQUGEUJYVKXCRJ-SJJHQCBESA-N	1	0	262.441	4.121	20	30		CIEDRO
N#CC1CCC(C[NH2+]Cc2c(Cl)cccc2Cl)CC1	ZINC000441379709	330767313	/nfs/dbraw/zinc/76/73/13/330767313.db2.gz	DTDMESXVFWVQND-UHFFFAOYSA-N	1	0	297.229	4.413	20	30		CIEDRO
CC(C)(C[NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc(F)cc1Cl	ZINC000442784915	330783085	/nfs/dbraw/zinc/78/30/85/330783085.db2.gz	UQAPRKMAGJUMJT-WCQYABFASA-N	1	0	294.801	4.039	20	30		CIEDRO
C[C@H](Cc1ccc(Cl)cc1Cl)[NH2+][C@@H]1CC[C@H](C#N)C1	ZINC000442785038	330783184	/nfs/dbraw/zinc/78/31/84/330783184.db2.gz	SWXQUYMCOPRDHK-UHIISALHSA-N	1	0	297.229	4.206	20	30		CIEDRO
Cc1cccc([C@H]([NH2+][C@H]2CC[C@H](C#N)C2)C(C)(C)C)c1	ZINC000442787567	330783393	/nfs/dbraw/zinc/78/33/93/330783393.db2.gz	YUFLKJSQGJZSAC-XIRDDKMYSA-N	1	0	270.420	4.364	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH2+][C@H](c2ccccc2)c2cccc(F)c2)C1	ZINC000442796775	330784495	/nfs/dbraw/zinc/78/44/95/330784495.db2.gz	WATDNWKSZWQUSI-NIKGAXFTSA-N	1	0	294.373	4.197	20	30		CIEDRO
Cc1cc(C[NH2+][C@H]2CC[C@@H](C#N)C2)ccc1-c1ccccc1	ZINC000442831756	330785931	/nfs/dbraw/zinc/78/59/31/330785931.db2.gz	BJHICMRTXAJOSL-APWZRJJASA-N	1	0	290.410	4.444	20	30		CIEDRO
CC(C)[C@@H]1CCCC[C@H]1[NH2+]CC1CCC(C#N)CC1	ZINC000442862354	330788107	/nfs/dbraw/zinc/78/81/07/330788107.db2.gz	ZSJVNMOBSIEMHM-SJJHQCBESA-N	1	0	262.441	4.121	20	30		CIEDRO
C[C@@]1(c2ccccc2)CC[C@@H]([NH2+]CC2CCC(C#N)CC2)C1	ZINC000442864951	330788354	/nfs/dbraw/zinc/78/83/54/330788354.db2.gz	HEMKYZRVLZEULN-OTGCGEFBSA-N	1	0	296.458	4.416	20	30		CIEDRO
C[C@@H](CCC1CCCC1)[NH2+]CC1CCC(C#N)CC1	ZINC000442873669	330789466	/nfs/dbraw/zinc/78/94/66/330789466.db2.gz	KYFPJCZCBKRBFX-OOHWJJMZSA-N	1	0	262.441	4.265	20	30		CIEDRO
CC[C@@H]([NH2+]CC1CCC(C#N)CC1)c1ccc(C)cc1	ZINC000442874732	330789471	/nfs/dbraw/zinc/78/94/71/330789471.db2.gz	UWOUWKKXVUAEGO-LEOMRAHMSA-N	1	0	270.420	4.366	20	30		CIEDRO
Cc1ccc(C[C@H]([NH2+]CC2CCC(C#N)CC2)C2CC2)cc1	ZINC000442878807	330789966	/nfs/dbraw/zinc/78/99/66/330789966.db2.gz	UUMUBMIQGSZOHL-QLOJAFMTSA-N	1	0	296.458	4.236	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCCC(C)(C)C1)c1ccc(C#N)c(F)c1	ZINC000443075428	330793968	/nfs/dbraw/zinc/79/39/68/330793968.db2.gz	GOUUCPWBXDFDGP-SWLSCSKDSA-N	1	0	274.383	4.317	20	30		CIEDRO
CC1=CCC[C@H](C)[C@@H]1C[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000443641544	330804570	/nfs/dbraw/zinc/80/45/70/330804570.db2.gz	LYMZLHLDJJOSGJ-HDMKZQKVSA-N	1	0	268.404	4.201	20	30		CIEDRO
CCO[C@H]1C[C@@H]([NH2+]CCCCC(C)(C)C#N)C1(CC)CC	ZINC000444690769	330819881	/nfs/dbraw/zinc/81/98/81/330819881.db2.gz	VHHZYDLPEOTBLE-CVEARBPZSA-N	1	0	294.483	4.280	20	30		CIEDRO
C[C@H](c1ccccc1)[C@H](C)[NH2+]CCCCC(C)(C)C#N	ZINC000444691188	330819919	/nfs/dbraw/zinc/81/99/19/330819919.db2.gz	XLFHOPUHLQLUGY-HOTGVXAUSA-N	1	0	272.436	4.488	20	30		CIEDRO
C[C@@H]([NH2+]Cc1cc(F)cc(Cl)c1)c1ccc(C#N)cc1	ZINC000159151657	330843410	/nfs/dbraw/zinc/84/34/10/330843410.db2.gz	AGJBELNHNMKUBW-LLVKDONJSA-N	1	0	288.753	4.202	20	30		CIEDRO
C[NH+](C)CCSCc1ccc(-c2ccccc2C#N)cc1	ZINC000446567786	330850335	/nfs/dbraw/zinc/85/03/35/330850335.db2.gz	ZBBRKVVABYPPBL-UHFFFAOYSA-N	1	0	296.439	4.020	20	30		CIEDRO
Cc1cccc(C)c1[C@H](C)[NH2+][C@H]1CCC[C@H](C#N)C1	ZINC000446756350	330853642	/nfs/dbraw/zinc/85/36/42/330853642.db2.gz	HDXCCGKAYJPHBR-JYJNAYRXSA-N	1	0	256.393	4.036	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1ccc2c(c1)CCCC2	ZINC000446761790	330853772	/nfs/dbraw/zinc/85/37/72/330853772.db2.gz	ZZBQTFHVZHBYDU-VCBZYWHSSA-N	1	0	282.431	4.298	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+]Cc2cc(Cl)sc2Cl)C1	ZINC000446825850	330855332	/nfs/dbraw/zinc/85/53/32/330855332.db2.gz	LCDKDKVQFGGCBI-WPRPVWTQSA-N	1	0	289.231	4.227	20	30		CIEDRO
CC[C@H]([NH2+]C1CCCCCC1)c1ccc(C#N)cc1	ZINC000447517956	330867590	/nfs/dbraw/zinc/86/75/90/330867590.db2.gz	MHMVPEWDCRRISP-KRWDZBQOSA-N	1	0	256.393	4.322	20	30		CIEDRO
CC[C@H]([NH2+]CCc1ccccc1C)c1ccc(C#N)cc1	ZINC000447516681	330867641	/nfs/dbraw/zinc/86/76/41/330867641.db2.gz	PNEFWFMBHLJLNR-IBGZPJMESA-N	1	0	278.399	4.150	20	30		CIEDRO
CCO[C@@H](CC[NH2+][C@H](CC)c1ccc(C#N)cc1)C(C)C	ZINC000447531755	330868314	/nfs/dbraw/zinc/86/83/14/330868314.db2.gz	QVRKEQZBSYTOGJ-MSOLQXFVSA-N	1	0	288.435	4.050	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+]CCc2cccc(Cl)c2Cl)C1	ZINC000447539781	330868943	/nfs/dbraw/zinc/86/89/43/330868943.db2.gz	HKPFGFGZTYZXAM-WCQYABFASA-N	1	0	297.229	4.208	20	30		CIEDRO
Cc1ccccc1[C@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)C(C)C	ZINC000447543939	330869388	/nfs/dbraw/zinc/86/93/88/330869388.db2.gz	UHQSYIXOCGWKFC-JFIYKMOQSA-N	1	0	270.420	4.364	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(F)c(C)c1)c1ccc(C#N)cc1	ZINC000447546082	330869427	/nfs/dbraw/zinc/86/94/27/330869427.db2.gz	YTPQEIQHYUOWOM-SFHVURJKSA-N	1	0	282.362	4.247	20	30		CIEDRO
C=C(C)C[NH2+][C@@H](c1ccccc1)c1ccc(F)cc1	ZINC000162209801	330890310	/nfs/dbraw/zinc/89/03/10/330890310.db2.gz	LSOWBOHQOXJACH-KRWDZBQOSA-N	1	0	255.336	4.081	20	30		CIEDRO
CC(C)[C@H](C[NH2+]C1CCC(C)(C#N)CC1)c1ccccc1	ZINC000449075700	330897298	/nfs/dbraw/zinc/89/72/98/330897298.db2.gz	RNDUBWISLDKJJZ-XBMUEBEBSA-N	1	0	284.447	4.488	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+]Cc1ccc(Cn2ccnc2)cc1	ZINC000449077081	330897449	/nfs/dbraw/zinc/89/74/49/330897449.db2.gz	RDWJXMVRICZWNJ-KRWDZBQOSA-N	1	0	297.446	4.156	20	30		CIEDRO
CCCC1CCC([NH2+]C2CCC(C)(C#N)CC2)CC1	ZINC000449089373	330898341	/nfs/dbraw/zinc/89/83/41/330898341.db2.gz	DDQGDNMLRBMKFM-UHFFFAOYSA-N	1	0	262.441	4.407	20	30		CIEDRO
CCC[C@H](Cc1ccccc1)[NH2+]C1CCC(C)(C#N)CC1	ZINC000449118928	330899962	/nfs/dbraw/zinc/89/99/62/330899962.db2.gz	VANIFLLOGIOJDB-JLAWEPINSA-N	1	0	284.447	4.460	20	30		CIEDRO
Cc1sc(C[NH2+]C2CCC(C)(C#N)CC2)nc1C(C)C	ZINC000449120949	330900072	/nfs/dbraw/zinc/90/00/72/330900072.db2.gz	GBYNIPOVSCNJKV-UHFFFAOYSA-N	1	0	291.464	4.137	20	30		CIEDRO
CC(C)[C@@H]1CCCC[C@H]1[NH2+]C1CCC(C)(C#N)CC1	ZINC000449120965	330900103	/nfs/dbraw/zinc/90/01/03/330900103.db2.gz	GFLLKNSVWWOLSD-VUROTCPHSA-N	1	0	262.441	4.263	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2)CC1	ZINC000449165204	330902915	/nfs/dbraw/zinc/90/29/15/330902915.db2.gz	UNNKJAGVLYCFSH-ADEKHHIBSA-N	1	0	296.458	4.460	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+][C@@H](CC)c1c(C)noc1C	ZINC000449217410	330906877	/nfs/dbraw/zinc/90/68/77/330906877.db2.gz	ZAQHCDIHZOLRGM-DOMZBBRYSA-N	1	0	264.413	4.467	20	30		CIEDRO
CCC(CC)[C@H]1C[C@@H]([NH2+]C2CCC(C)(C#N)CC2)CCO1	ZINC000449225294	330907450	/nfs/dbraw/zinc/90/74/50/330907450.db2.gz	JYVQKZJYCAZUKR-JDEYZFBPSA-N	1	0	292.467	4.032	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]C1CCC(OC2CCCC2)CC1	ZINC000449300212	330913049	/nfs/dbraw/zinc/91/30/49/330913049.db2.gz	DGVLGTCEEODJLW-UQPPLGOBSA-N	1	0	265.441	4.201	20	30		CIEDRO
CC1(C#N)CCC([NH2+]CC2CC(c3ccccc3)C2)CC1	ZINC000449316059	330914116	/nfs/dbraw/zinc/91/41/16/330914116.db2.gz	XALOCPOLOXQYRQ-UHFFFAOYSA-N	1	0	282.431	4.242	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@@H](C)c1c(F)cncc1F	ZINC000449320772	330914439	/nfs/dbraw/zinc/91/44/39/330914439.db2.gz	PJGITWJQMYNKPV-RYUDHWBXSA-N	1	0	268.351	4.145	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@H](C)c1c(F)cncc1F	ZINC000449320771	330914477	/nfs/dbraw/zinc/91/44/77/330914477.db2.gz	PJGITWJQMYNKPV-NWDGAFQWSA-N	1	0	268.351	4.145	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]C1CCC(OC2CCCC2)CC1	ZINC000449334782	330915662	/nfs/dbraw/zinc/91/56/62/330915662.db2.gz	YBIOXZQVXJTCNY-UHFFFAOYSA-N	1	0	292.467	4.176	20	30		CIEDRO
C[C@H](Cc1ccoc1)[NH2+][C@H](CCCC#N)c1ccccc1	ZINC000449339613	330916193	/nfs/dbraw/zinc/91/61/93/330916193.db2.gz	KZEKZZQQQQUJSE-CRAIPNDOSA-N	1	0	282.387	4.235	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@@H]2CCCc3c(F)cc(F)cc32)c1	ZINC000449347034	330916878	/nfs/dbraw/zinc/91/68/78/330916878.db2.gz	AYRJLLQJAJPHIL-GOSISDBHSA-N	1	0	298.336	4.004	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+]C[C@H]1CSc2ccccc21	ZINC000449367333	330919177	/nfs/dbraw/zinc/91/91/77/330919177.db2.gz	VIPSNGBDCOHSIE-IHRRRGAJSA-N	1	0	261.434	4.066	20	30		CIEDRO
C[C@@H](C[NH2+][C@H]1CC[C@@H](CC#N)C1)CC1CCCCC1	ZINC000449445198	330926163	/nfs/dbraw/zinc/92/61/63/330926163.db2.gz	HMAYQFFBHSQWCJ-PVAVHDDUSA-N	1	0	262.441	4.265	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+]CCCc1ncccc1C	ZINC000449486276	330929921	/nfs/dbraw/zinc/92/99/21/330929921.db2.gz	RQJMSMBHEBJPCT-INIZCTEOSA-N	1	0	260.425	4.047	20	30		CIEDRO
C=CC(C)(C)C[NH2+]Cc1cccc(-c2ccncc2)c1	ZINC000449486518	330930113	/nfs/dbraw/zinc/93/01/13/330930113.db2.gz	SRUWBNMSSIQVRZ-UHFFFAOYSA-N	1	0	266.388	4.050	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@@H]1CCO[C@H](c2ccncc2)C1	ZINC000449542143	330934839	/nfs/dbraw/zinc/93/48/39/330934839.db2.gz	PQLDFQVBTZFKEI-KSZLIROESA-N	1	0	288.435	4.026	20	30		CIEDRO
CN1CCC[C@H]([NH2+]C2CCC(C)(C#N)CC2)c2ccccc21	ZINC000449653644	330942169	/nfs/dbraw/zinc/94/21/69/330942169.db2.gz	CNUJREGZNWLOIY-RMXPPQQLSA-N	1	0	297.446	4.020	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H]1CCCc2c3ccccc3[nH]c21	ZINC000162624652	330943710	/nfs/dbraw/zinc/94/37/10/330943710.db2.gz	TXJVVGZUARAVII-MLGOLLRUSA-N	1	0	254.377	4.100	20	30		CIEDRO
N#CCCC[C@H]([NH2+]C[C@@H]1CCC(F)(F)C1)c1ccccc1	ZINC000451060385	331014157	/nfs/dbraw/zinc/01/41/57/331014157.db2.gz	FTIXMOSURGJORX-ZBFHGGJFSA-N	1	0	292.373	4.447	20	30		CIEDRO
C[C@@H](CCCC(F)(F)F)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000163285418	331015484	/nfs/dbraw/zinc/01/54/84/331015484.db2.gz	MQOLOQAYPPDBCZ-RYUDHWBXSA-N	1	0	284.325	4.330	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C#N)c(F)c1)c1cccc(C2CC2)c1	ZINC000451116738	331016312	/nfs/dbraw/zinc/01/63/12/331016312.db2.gz	ROXWJRBTDBAISK-CYBMUJFWSA-N	1	0	294.373	4.426	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](C)CCc1ccc(OC(F)F)cc1	ZINC000163318315	331020200	/nfs/dbraw/zinc/02/02/00/331020200.db2.gz	WMVRNFDLNXDPBE-OLZOCXBDSA-N	1	0	283.362	4.163	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](C)c1cccc(C(F)(F)F)c1	ZINC000163329391	331021367	/nfs/dbraw/zinc/02/13/67/331021367.db2.gz	ULMLIOBVSYDEBA-GHMZBOCLSA-N	1	0	257.299	4.321	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000163329061	331021402	/nfs/dbraw/zinc/02/14/02/331021402.db2.gz	ULMLIOBVSYDEBA-QWRGUYRKSA-N	1	0	257.299	4.321	20	30		CIEDRO
N#CCCCC[NH2+][C@@H](c1ccc(F)c(Cl)c1)C1CC1	ZINC000451352813	331025305	/nfs/dbraw/zinc/02/53/05/331025305.db2.gz	IIKIHBNMRPRJIA-OAHLLOKOSA-N	1	0	280.774	4.214	20	30		CIEDRO
C[C@@H]1C[C@H](C(F)(F)F)CC[N@@H+]1CCCCC(C)(C)C#N	ZINC000451408220	331028134	/nfs/dbraw/zinc/02/81/34/331028134.db2.gz	NEXCKQDRLLCOSB-CHWSQXEVSA-N	1	0	290.373	4.369	20	30		CIEDRO
CC(C)(C#N)c1ccccc1C[NH2+][C@H]1CCC12CCCC2	ZINC000451464609	331030480	/nfs/dbraw/zinc/03/04/80/331030480.db2.gz	ZBIWNNIZBYRSFX-KRWDZBQOSA-N	1	0	282.431	4.300	20	30		CIEDRO
C=C(C)CC[N@@H+]1CCCC[C@H]1c1nc2ccccc2[nH]1	ZINC000451876907	331045728	/nfs/dbraw/zinc/04/57/28/331045728.db2.gz	GWEDCUSNRTYJSO-INIZCTEOSA-N	1	0	269.392	4.056	20	30		CIEDRO
C=C(C)CC[N@@H+]1CCCC[C@@H]1c1nc2ccccc2[nH]1	ZINC000451876908	331045772	/nfs/dbraw/zinc/04/57/72/331045772.db2.gz	GWEDCUSNRTYJSO-MRXNPFEDSA-N	1	0	269.392	4.056	20	30		CIEDRO
CSc1ccccc1[C@@H](C)[NH2+]Cc1cccc(C#N)c1	ZINC000194845868	331064555	/nfs/dbraw/zinc/06/45/55/331064555.db2.gz	IWMSGHWYPORTPH-CYBMUJFWSA-N	1	0	282.412	4.131	20	30		CIEDRO
C[C@@H](CCCc1cccnc1)[NH2+][C@@H](C)c1cccc(C#N)c1	ZINC000453124631	331091641	/nfs/dbraw/zinc/09/16/41/331091641.db2.gz	SBRVUFMLTMGHKG-HOTGVXAUSA-N	1	0	293.414	4.015	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)CCCc1cccnc1)c1cccc(C#N)c1	ZINC000453124639	331091713	/nfs/dbraw/zinc/09/17/13/331091713.db2.gz	SBRVUFMLTMGHKG-JKSUJKDBSA-N	1	0	293.414	4.015	20	30		CIEDRO
Cc1cc([C@@H](C)[NH2+]CC(C)(C)CCC#N)cs1	ZINC000453219201	331102859	/nfs/dbraw/zinc/10/28/59/331102859.db2.gz	IYTPKYGKEJEDSP-GFCCVEGCSA-N	1	0	250.411	4.037	20	30		CIEDRO
CCC[C@H]([NH2+]CC1CCC(C#N)CC1)C(C)(C)C	ZINC000453228501	331104190	/nfs/dbraw/zinc/10/41/90/331104190.db2.gz	WFHOOFAVARAHJY-NRXISQOPSA-N	1	0	250.430	4.121	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCCC1CCOCC1)c1ccco1	ZINC000453236275	331105057	/nfs/dbraw/zinc/10/50/57/331105057.db2.gz	NEBKGMJFHKCPOK-INIZCTEOSA-N	1	0	277.408	4.083	20	30		CIEDRO
Cc1ccc([C@@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)C2CCCC2)o1	ZINC000453288360	331111520	/nfs/dbraw/zinc/11/15/20/331111520.db2.gz	GVXCTBAGUDBHLI-ZVZYQTTQSA-N	1	0	286.419	4.491	20	30		CIEDRO
Cc1ccc([C@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)C2CCCC2)o1	ZINC000453288357	331111538	/nfs/dbraw/zinc/11/15/38/331111538.db2.gz	GVXCTBAGUDBHLI-QILLFSRXSA-N	1	0	286.419	4.491	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@H](CCCOC)c1ccc(F)cc1	ZINC000453305333	331113814	/nfs/dbraw/zinc/11/38/14/331113814.db2.gz	HKJSFBNOBWVBDR-MRXNPFEDSA-N	1	0	279.399	4.095	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@@H](c1ccc(F)cc1)c1ccccn1	ZINC000453309122	331114307	/nfs/dbraw/zinc/11/43/07/331114307.db2.gz	OYAMKCUDSLENSU-KRWDZBQOSA-N	1	0	284.378	4.112	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@H](C)c1nccc2ccccc21	ZINC000453309648	331114436	/nfs/dbraw/zinc/11/44/36/331114436.db2.gz	QDCUWUXSIPPOKQ-CYBMUJFWSA-N	1	0	254.377	4.098	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@@H]1CCCC1(F)F)c1ccco1	ZINC000453319313	331116099	/nfs/dbraw/zinc/11/60/99/331116099.db2.gz	NGQFGOAPRNCHOY-QWHCGFSZSA-N	1	0	269.335	4.312	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1ccc(Oc2ccccc2)cn1	ZINC000453330381	331117657	/nfs/dbraw/zinc/11/76/57/331117657.db2.gz	YNLDMWRSWDCFIU-HNNXBMFYSA-N	1	0	282.387	4.491	20	30		CIEDRO
C=CCC1(C[NH2+][C@H](C)c2ccncc2F)CCCC1	ZINC000453346058	331119898	/nfs/dbraw/zinc/11/98/98/331119898.db2.gz	DWNPEIYMFQJKIY-CYBMUJFWSA-N	1	0	262.372	4.008	20	30		CIEDRO
C[C@H]1CCc2ccccc2[C@H]1[NH2+]Cc1ccc(C#N)c(F)c1	ZINC000453369132	331123726	/nfs/dbraw/zinc/12/37/26/331123726.db2.gz	FHFFIUJELHMOKX-DJJJIMSYSA-N	1	0	294.373	4.111	20	30		CIEDRO
C=C[C@@H]1OCCC[C@H]1[NH2+][C@H](C)c1cccc(C(F)(F)F)c1	ZINC000453374937	331124586	/nfs/dbraw/zinc/12/45/86/331124586.db2.gz	XDGJJIUCXAQWCZ-DFBGVHRSSA-N	1	0	299.336	4.090	20	30		CIEDRO
Cc1cccc([C@@H](C)[NH2+][C@H]2CCc3ccc(C#N)cc32)c1	ZINC000453398613	331128245	/nfs/dbraw/zinc/12/82/45/331128245.db2.gz	MYTYTFUAJALQQB-KUHUBIRLSA-N	1	0	276.383	4.205	20	30		CIEDRO
Cc1ccccc1[C@H](CC(C)C)[NH2+][C@H]1CC[C@@H](C#N)C1	ZINC000471582957	331268507	/nfs/dbraw/zinc/26/85/07/331268507.db2.gz	RXPLZTCAUURMFG-RYRKJORJSA-N	1	0	270.420	4.364	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@@H](C)c1nc2c(s1)CCC2	ZINC000459645388	331291833	/nfs/dbraw/zinc/29/18/33/331291833.db2.gz	GKIBUELTGWQYFT-RYUDHWBXSA-N	1	0	264.438	4.027	20	30		CIEDRO
CC(C)(CCC#N)C[N@@H+]1CCc2cccc(Cl)c2C1	ZINC000459662393	331292922	/nfs/dbraw/zinc/29/29/22/331292922.db2.gz	ACMXAFOIUSFWNR-UHFFFAOYSA-N	1	0	276.811	4.028	20	30		CIEDRO
N#CCCCOc1cccc(C[NH2+]C2(C3CCC3)CCC2)c1	ZINC000459731043	331296596	/nfs/dbraw/zinc/29/65/96/331296596.db2.gz	CMEIQPAJBWHEOY-UHFFFAOYSA-N	1	0	298.430	4.182	20	30		CIEDRO
N#CCCC[N@@H+]1CC2(CCCCC2)[C@H]1c1ccccc1	ZINC000459763296	331299270	/nfs/dbraw/zinc/29/92/70/331299270.db2.gz	YOPNHTCPMQIRJU-QGZVFWFLSA-N	1	0	268.404	4.298	20	30		CIEDRO
CC[C@@H]([NH2+][C@H](C)c1ccc(C#N)cc1)c1cccc(F)c1	ZINC000166476551	331307294	/nfs/dbraw/zinc/30/72/94/331307294.db2.gz	MUXRVDZACDOCLG-FZKQIMNGSA-N	1	0	282.362	4.499	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)c1cccc(Br)c1	ZINC000168053400	331308592	/nfs/dbraw/zinc/30/85/92/331308592.db2.gz	XGTIVJPZPLYKQA-LLVKDONJSA-N	1	0	268.198	4.066	20	30		CIEDRO
CC(C)c1ccc(C[C@@H]2CC[N@H+](CCCCC#N)C2)cc1	ZINC000460977819	331309941	/nfs/dbraw/zinc/30/99/41/331309941.db2.gz	HIOPPQLTLAOSDR-SFHVURJKSA-N	1	0	284.447	4.368	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+]C[C@@H](c1ccco1)N1CCCC1	ZINC000461817571	331314873	/nfs/dbraw/zinc/31/48/73/331314873.db2.gz	AOIJIBWKKREHMS-IRXDYDNUSA-N	1	0	290.451	4.141	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+]Cc1nc(C(C)C)c(C)s1	ZINC000462048376	331316954	/nfs/dbraw/zinc/31/69/54/331316954.db2.gz	KXUBSEFYSRBGTC-CYBMUJFWSA-N	1	0	266.454	4.409	20	30		CIEDRO
CCC[C@H](CCc1ccccc1)[NH2+][C@H]1CCC[C@H]1C#N	ZINC000462066454	331317177	/nfs/dbraw/zinc/31/71/77/331317177.db2.gz	HOWPAWBABVNOEW-KSZLIROESA-N	1	0	270.420	4.070	20	30		CIEDRO
CCC[C@@H](CCc1ccccc1)[NH2+]CCCCC#N	ZINC000462112020	331317427	/nfs/dbraw/zinc/31/74/27/331317427.db2.gz	LXADGKDQUMTHIW-KRWDZBQOSA-N	1	0	258.409	4.071	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+]CCc1c[nH]c2ccc(F)cc12	ZINC000462121858	331317833	/nfs/dbraw/zinc/31/78/33/331317833.db2.gz	HTBDXXPLHGHQTK-OAHLLOKOSA-N	1	0	274.383	4.184	20	30		CIEDRO
CC#CCC[N@H+](Cc1cccc(-c2cccnc2)c1)C1CC1	ZINC000462347984	331320234	/nfs/dbraw/zinc/32/02/34/331320234.db2.gz	MADDKPQOSPCXRZ-UHFFFAOYSA-N	1	0	290.410	4.126	20	30		CIEDRO
CC#CCC[N@@H+]1CCC[C@H]1c1ccc(Br)s1	ZINC000462477004	331322681	/nfs/dbraw/zinc/32/26/81/331322681.db2.gz	XAMNXHVCWJWIGJ-NSHDSACASA-N	1	0	298.249	4.061	20	30		CIEDRO
C[C@@H]1CCCc2ccccc2[C@@H]1[NH2+]Cc1ccc(C#N)cc1	ZINC000462547506	331323323	/nfs/dbraw/zinc/32/33/23/331323323.db2.gz	HFYPEGGDEDTEBW-FOIQADDNSA-N	1	0	290.410	4.362	20	30		CIEDRO
C[C@H]1CCCc2ccccc2[C@@H]1[NH2+]Cc1cccc(C#N)c1	ZINC000462544884	331323334	/nfs/dbraw/zinc/32/33/34/331323334.db2.gz	OJAIDWOOCJXSFR-MGPUTAFESA-N	1	0	290.410	4.362	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H](C)C[C@H](C)CC)cc1OC	ZINC000462734778	331326202	/nfs/dbraw/zinc/32/62/02/331326202.db2.gz	OUOROBIRWZKJIX-CABCVRRESA-N	1	0	291.435	4.174	20	30		CIEDRO
C=C(C)CN1CCC([NH2+]C2CCC(C(C)(C)C)CC2)CC1	ZINC000462743270	331326912	/nfs/dbraw/zinc/32/69/12/331326912.db2.gz	JUWVCPYZJFMTIR-UHFFFAOYSA-N	1	0	292.511	4.221	20	30		CIEDRO
C=CCN1CCC([NH2+]C2CCC(C(C)(C)CC)CC2)CC1	ZINC000462751659	331327422	/nfs/dbraw/zinc/32/74/22/331327422.db2.gz	ZYZBQQYKGIMJIV-UHFFFAOYSA-N	1	0	292.511	4.221	20	30		CIEDRO
N#Cc1cccc(C[NH2+]CCCCC2CCCC2)c1	ZINC000462753816	331327549	/nfs/dbraw/zinc/32/75/49/331327549.db2.gz	FBNKTTACLWPUSH-UHFFFAOYSA-N	1	0	256.393	4.008	20	30		CIEDRO
C=Cc1ccc(CC[NH2+][C@@H]2CCc3ccc(C#N)cc32)cc1	ZINC000462816521	331330769	/nfs/dbraw/zinc/33/07/69/331330769.db2.gz	GVJOMSPLZBHGPE-HXUWFJFHSA-N	1	0	288.394	4.021	20	30		CIEDRO
C=Cc1ccc(CC[NH2+][C@H]2CCc3ccc(C#N)cc32)cc1	ZINC000462816520	331330815	/nfs/dbraw/zinc/33/08/15/331330815.db2.gz	GVJOMSPLZBHGPE-FQEVSTJZSA-N	1	0	288.394	4.021	20	30		CIEDRO
C=C[C@@H](C)[NH2+][C@@H](C)c1csc(-c2ccccc2F)n1	ZINC000462817562	331330871	/nfs/dbraw/zinc/33/08/71/331330871.db2.gz	OHDMOUIEEUPURL-MNOVXSKESA-N	1	0	276.380	4.174	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+]Cc1ccc(C(F)F)cc1	ZINC000462835177	331332180	/nfs/dbraw/zinc/33/21/80/331332180.db2.gz	QXJIYPRWWKZXTB-AWEZNQCLSA-N	1	0	253.336	4.459	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCCCC23CCCC3)C1	ZINC000462948903	331335824	/nfs/dbraw/zinc/33/58/24/331335824.db2.gz	XCFVOWVQFBDWHZ-BZUAXINKSA-N	1	0	260.425	4.161	20	30		CIEDRO
CC[C@H](Nc1cc2c(c[nH+]1)CCCC2)c1ccc(C#N)cc1	ZINC000462966385	331336174	/nfs/dbraw/zinc/33/61/74/331336174.db2.gz	OCWWFFGCRHNHKG-SFHVURJKSA-N	1	0	291.398	4.395	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)c1ccc(OC(C)(C)C)cc1	ZINC000463031532	331337885	/nfs/dbraw/zinc/33/78/85/331337885.db2.gz	XXSWITFXAJLITH-KBPBESRZSA-N	1	0	261.409	4.479	20	30		CIEDRO
CCC(CC)(C[NH2+][C@@H]1CCC[C@H](C#N)C1)c1ccccc1	ZINC000463238533	331343611	/nfs/dbraw/zinc/34/36/11/331343611.db2.gz	RFBYPVRJZSCMCN-FUHWJXTLSA-N	1	0	284.447	4.416	20	30		CIEDRO
CC(C)c1ccc(C[C@@H](C)[NH2+][C@H]2CCC[C@@H](C#N)C2)cc1	ZINC000463238204	331343680	/nfs/dbraw/zinc/34/36/80/331343680.db2.gz	PCGNVQJFJDLGAJ-SUMDDJOVSA-N	1	0	284.447	4.413	20	30		CIEDRO
CCC[C@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1ccc(F)cc1F	ZINC000463244273	331344010	/nfs/dbraw/zinc/34/40/10/331344010.db2.gz	WOBPOCDSFBAXBX-JDFRZJQESA-N	1	0	292.373	4.478	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000463279647	331344911	/nfs/dbraw/zinc/34/49/11/331344911.db2.gz	KIDNYCFDVJJVHA-LULLPPNCSA-N	1	0	282.431	4.385	20	30		CIEDRO
C=CCCC[N@@H+]1CC[C@H](CSc2ccccc2)C1	ZINC000464765018	331366819	/nfs/dbraw/zinc/36/68/19/331366819.db2.gz	JUWCXVNKJSWOHB-HNNXBMFYSA-N	1	0	261.434	4.067	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1cccc(OCC(F)(F)F)c1	ZINC000466400782	331394921	/nfs/dbraw/zinc/39/49/21/331394921.db2.gz	WRRXXTLEMQFNIK-ZDUSSCGKSA-N	1	0	287.325	4.072	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1ccc(-c2ccncc2)cc1F	ZINC000466403986	331395160	/nfs/dbraw/zinc/39/51/60/331395160.db2.gz	KSFGJKSNNXLALQ-KRWDZBQOSA-N	1	0	284.378	4.332	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1ncc(-c2ccccc2)s1	ZINC000466405004	331395292	/nfs/dbraw/zinc/39/52/92/331395292.db2.gz	PUWJHPFJBCCBDS-CQSZACIVSA-N	1	0	272.417	4.254	20	30		CIEDRO
CC(C)[C@@H](C[NH2+]CCc1cccc(C#N)c1)c1ccccc1	ZINC000466408017	331395565	/nfs/dbraw/zinc/39/55/65/331395565.db2.gz	DQWIZHWMNKQIPT-HXUWFJFHSA-N	1	0	292.426	4.130	20	30		CIEDRO
N#Cc1c(Cl)cccc1SCCC[NH+]1CCCCC1	ZINC000466476671	331398123	/nfs/dbraw/zinc/39/81/23/331398123.db2.gz	YKYDEXXSTCVIAI-UHFFFAOYSA-N	1	0	294.851	4.180	20	30		CIEDRO
C=CCCCC[NH2+][C@@H]1CCC[C@H](c2ncccc2C)C1	ZINC000467356510	331416000	/nfs/dbraw/zinc/41/60/00/331416000.db2.gz	WPCUUYJQKKDEMF-DLBZAZTESA-N	1	0	272.436	4.362	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@H](C)c1cc(OC)c(OC)cc1C	ZINC000467404975	331417657	/nfs/dbraw/zinc/41/76/57/331417657.db2.gz	LSLQWGVNEXOOCJ-KGLIPLIRSA-N	1	0	277.408	4.018	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@H]1CCCc2nc(CC)sc21	ZINC000467406328	331417827	/nfs/dbraw/zinc/41/78/27/331417827.db2.gz	SLYAFELNCMSVNC-NEPJUHHUSA-N	1	0	264.438	4.027	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@H](C)Cc1ccccc1SC	ZINC000467409445	331417881	/nfs/dbraw/zinc/41/78/81/331417881.db2.gz	XHHSIFBKMYLIAC-UKRRQHHQSA-N	1	0	263.450	4.284	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@H](C)Cc1ccccc1SC	ZINC000467409444	331417956	/nfs/dbraw/zinc/41/79/56/331417956.db2.gz	XHHSIFBKMYLIAC-HIFRSBDPSA-N	1	0	263.450	4.284	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@@H](C)c1ccc(F)cc1OC(F)F	ZINC000467410908	331418067	/nfs/dbraw/zinc/41/80/67/331418067.db2.gz	LQXBMNSJPKXGQE-CMPLNLGQSA-N	1	0	287.325	4.432	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@H](C)c1sc(CC)nc1C	ZINC000467416074	331418307	/nfs/dbraw/zinc/41/83/07/331418307.db2.gz	GKGRXKIDYREUKR-ZYHUDNBSSA-N	1	0	252.427	4.019	20	30		CIEDRO
CC[C@@H]([NH2+]CCc1cccc(C#N)c1)c1ccc(C)cc1	ZINC000467436373	331419205	/nfs/dbraw/zinc/41/92/05/331419205.db2.gz	BLTBSWWWBXMRQQ-LJQANCHMSA-N	1	0	278.399	4.150	20	30		CIEDRO
CC(C)[C@@H]([NH2+]CCc1cccc(C#N)c1)c1ccccc1	ZINC000467444981	331419712	/nfs/dbraw/zinc/41/97/12/331419712.db2.gz	YAXKHJYLNGVUOB-LJQANCHMSA-N	1	0	278.399	4.088	20	30		CIEDRO
C[C@H]([NH2+]CCc1cccc(C#N)c1)C(C)(C)c1ccccc1	ZINC000467449274	331419934	/nfs/dbraw/zinc/41/99/34/331419934.db2.gz	JEAXLVNTIQTYFX-INIZCTEOSA-N	1	0	292.426	4.057	20	30		CIEDRO
C=C1CC[NH+](CC2CCC(C(F)(F)F)CC2)CC1	ZINC000468394724	331433867	/nfs/dbraw/zinc/43/38/67/331433867.db2.gz	VRPFWXHXMNPWRA-UHFFFAOYSA-N	1	0	261.331	4.007	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+]Cc1nc2cc(C)ccc2n1C	ZINC000470537252	331485011	/nfs/dbraw/zinc/48/50/11/331485011.db2.gz	HKSOYEIIHZPLTF-OAHLLOKOSA-N	1	0	285.435	4.106	20	30		CIEDRO
C=CCOCCC[NH2+][C@@H](CC)c1ccc(Cl)s1	ZINC000470780313	331491197	/nfs/dbraw/zinc/49/11/97/331491197.db2.gz	RMSPPMKURPNSRG-NSHDSACASA-N	1	0	273.829	4.035	20	30		CIEDRO
C=CCOCCC[NH2+][C@H](C)c1cccc(Cl)c1Cl	ZINC000470789690	331491582	/nfs/dbraw/zinc/49/15/82/331491582.db2.gz	MXBKJWAFXSLRDG-LLVKDONJSA-N	1	0	288.218	4.237	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@@H](C#N)C1)c1ccc(Cl)cc1Cl	ZINC000471613607	331513263	/nfs/dbraw/zinc/51/32/63/331513263.db2.gz	RGSRQZPINOHQSR-HOSYDEDBSA-N	1	0	283.202	4.336	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](C#N)C1)c1ccc(Cl)cc1Cl	ZINC000471613614	331513311	/nfs/dbraw/zinc/51/33/11/331513311.db2.gz	RGSRQZPINOHQSR-UMNHJUIQSA-N	1	0	283.202	4.336	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+]CCc1ccccc1OC(F)F	ZINC000471784103	331519902	/nfs/dbraw/zinc/51/99/02/331519902.db2.gz	ZHNDWFNZTSHGSG-CQSZACIVSA-N	1	0	283.362	4.165	20	30		CIEDRO
C=CCCCC[NH2+]Cc1ccccc1OCc1ccccn1	ZINC000472037370	331526456	/nfs/dbraw/zinc/52/64/56/331526456.db2.gz	JDUJAYWDIATEKB-UHFFFAOYSA-N	1	0	296.414	4.107	20	30		CIEDRO
C=CCCCC[NH2+]Cc1cnc(C2CCCC2)s1	ZINC000472038633	331526776	/nfs/dbraw/zinc/52/67/76/331526776.db2.gz	QYHDDPXFDPTDTL-UHFFFAOYSA-N	1	0	264.438	4.247	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+]Cc1nc2ccc(OC)cc2s1	ZINC000474006858	331562137	/nfs/dbraw/zinc/56/21/37/331562137.db2.gz	DWWWOMFQAUQCIV-LBPRGKRZSA-N	1	0	290.432	4.139	20	30		CIEDRO
C=CCSCC[NH2+][C@H](C)C1CCC(C(F)(F)F)CC1	ZINC000474723191	331596283	/nfs/dbraw/zinc/59/62/83/331596283.db2.gz	OHNYKOKBRXTMIF-PNESKVBLSA-N	1	0	295.414	4.252	20	30		CIEDRO
CC[C@@H](CC#N)[NH2+]C[C@H](CC(C)C)c1ccccc1	ZINC000474921104	331603965	/nfs/dbraw/zinc/60/39/65/331603965.db2.gz	AGPWPTISDGQBOZ-IRXDYDNUSA-N	1	0	258.409	4.098	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+]CC1CCN(c2ccccc2)CC1	ZINC000475289585	331622595	/nfs/dbraw/zinc/62/25/95/331622595.db2.gz	ZPDNJCILMSQWSI-IRXDYDNUSA-N	1	0	286.463	4.093	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCc1ccccc1F)c1ccco1	ZINC000476008466	331651287	/nfs/dbraw/zinc/65/12/87/331651287.db2.gz	XNCCNGJGTUEFOV-INIZCTEOSA-N	1	0	273.351	4.258	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCc1cccs1)c1ccco1	ZINC000476002727	331651373	/nfs/dbraw/zinc/65/13/73/331651373.db2.gz	LZIBRGBZGSNYIL-AWEZNQCLSA-N	1	0	261.390	4.181	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@H]1C[C@@H](OCC)C12CCC2)c1ccco1	ZINC000476016774	331651603	/nfs/dbraw/zinc/65/16/03/331651603.db2.gz	BLAVVNMKNRJMPU-BHYGNILZSA-N	1	0	289.419	4.224	20	30		CIEDRO
CC(C)c1ccc([C@@H](C)[NH+]2CCC(F)(C#N)CC2)cc1	ZINC000510948197	332921600	/nfs/dbraw/zinc/92/16/00/332921600.db2.gz	GHFUQRADRQDZKT-CQSZACIVSA-N	1	0	274.383	4.199	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C2CC2)cc1)c1ccc(C#N)cc1F	ZINC000477869202	331692765	/nfs/dbraw/zinc/69/27/65/331692765.db2.gz	WOCKBQKYGHTUGL-ZDUSSCGKSA-N	1	0	294.373	4.426	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)o1)C1(c2ccccc2)CCCC1	ZINC000479588056	331739343	/nfs/dbraw/zinc/73/93/43/331739343.db2.gz	GEGNALHDVZUWBK-HNNXBMFYSA-N	1	0	294.398	4.141	20	30		CIEDRO
C=C(C[NH2+][C@@H](C)c1ccc(Cl)cn1)c1ccccc1	ZINC000480184098	331762145	/nfs/dbraw/zinc/76/21/45/331762145.db2.gz	QXZPGKBWBADNQX-ZDUSSCGKSA-N	1	0	272.779	4.099	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@@H]1CC[C@@H](c2ccccc2F)C1	ZINC000482078527	331822885	/nfs/dbraw/zinc/82/28/85/331822885.db2.gz	HEBJGYDXVHEWBJ-RRFJBIMHSA-N	1	0	261.384	4.406	20	30		CIEDRO
C[C@@H]([NH2+]CC#Cc1ccccc1)c1cc2ccccc2o1	ZINC000483734471	331883664	/nfs/dbraw/zinc/88/36/64/331883664.db2.gz	UQRDOKKSBSLPJR-OAHLLOKOSA-N	1	0	275.351	4.135	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+][C@@H]1CCc2sc(Cl)cc21	ZINC000309538756	333045124	/nfs/dbraw/zinc/04/51/24/333045124.db2.gz	FOCAIKZKGQCGAK-MWLCHTKSSA-N	1	0	255.814	4.333	20	30		CIEDRO
C=CCCCCC[NH+]1CCN(C/C=C\c2ccccc2)CC1	ZINC000486804751	331946021	/nfs/dbraw/zinc/94/60/21/331946021.db2.gz	WBAVJSOZFGLDEL-RAXLEYEMSA-N	1	0	298.474	4.064	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C/C=C/c1ccncc1)c1ccccc1	ZINC000487551210	331973678	/nfs/dbraw/zinc/97/36/78/331973678.db2.gz	NVWOQXOCEGYDHV-IHHMQQGQSA-N	1	0	278.399	4.392	20	30		CIEDRO
C=CCCCCC[NH2+]C(C)(C)c1nc2ccccc2n1C	ZINC000488046274	331988216	/nfs/dbraw/zinc/98/82/16/331988216.db2.gz	UWVNXYUGGVZKBD-UHFFFAOYSA-N	1	0	285.435	4.144	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(C#N)c(C)c1)c1cccs1	ZINC000488287573	331997513	/nfs/dbraw/zinc/99/75/13/331997513.db2.gz	CQKRGGSXHSPALV-HNNXBMFYSA-N	1	0	270.401	4.169	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CS[C@@H](C(C)(C)C)C1)c1ccc(C#N)cc1	ZINC000488416429	332005840	/nfs/dbraw/zinc/00/58/40/332005840.db2.gz	IOVNVSFTZCDCKS-VBNZEHGJSA-N	1	0	288.460	4.129	20	30		CIEDRO
C=C(C[NH2+][C@@H]1CS[C@H](C(C)(C)C)C1)c1ccccc1	ZINC000488432076	332007822	/nfs/dbraw/zinc/00/78/22/332007822.db2.gz	LILVFGRVDUUIIC-HOTGVXAUSA-N	1	0	275.461	4.210	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@H](C)c1nnc([C@H](C)CC)[nH]1	ZINC000488499714	332013928	/nfs/dbraw/zinc/01/39/28/332013928.db2.gz	CJCYYGFYLWSXDM-MCIONIFRSA-N	1	0	278.444	4.104	20	30		CIEDRO
CC[N@H+](Cc1cccc(F)c1)[C@@H](C)c1ccc(C#N)cc1	ZINC000488586751	332019238	/nfs/dbraw/zinc/01/92/38/332019238.db2.gz	MCUFPLSDLGMXOX-AWEZNQCLSA-N	1	0	282.362	4.280	20	30		CIEDRO
CC[C@@H](c1ccc(Cl)cc1)[N@H+](CC)C[C@H](C)C#N	ZINC000488614568	332020233	/nfs/dbraw/zinc/02/02/33/332020233.db2.gz	BCSPGZODMDNBCB-DOMZBBRYSA-N	1	0	264.800	4.273	20	30		CIEDRO
CC[NH+](CC)CCSCc1ccccc1C(C)(C)C#N	ZINC000488847701	332029157	/nfs/dbraw/zinc/02/91/57/332029157.db2.gz	BOAMZKAPWFRMOD-UHFFFAOYSA-N	1	0	290.476	4.063	20	30		CIEDRO
C[C@H](c1cccc(C#N)c1)[N@@H+]1CC[C@@H](Cc2ccccc2)C1	ZINC000489265453	332044430	/nfs/dbraw/zinc/04/44/30/332044430.db2.gz	CUQGUMYZFQXPNS-APWZRJJASA-N	1	0	290.410	4.184	20	30		CIEDRO
C=C[C@@H]1CCCCN1Cc1csc(-c2ccccc2)n1	ZINC000489428769	332051534	/nfs/dbraw/zinc/05/15/34/332051534.db2.gz	FDTYQWCSLAHZJJ-MRXNPFEDSA-N	1	0	284.428	4.351	20	30		CIEDRO
C[C@H](c1cccc(C#N)c1)[N@@H+]1CC[C@H](c2cccc(F)c2)C1	ZINC000489879839	332071374	/nfs/dbraw/zinc/07/13/74/332071374.db2.gz	FOAPPVANGLPVMF-KDOFPFPSSA-N	1	0	294.373	4.248	20	30		CIEDRO
CC(C)(C#N)CCCC[N@@H+]1CC[C@H](c2cccc(F)c2)C1	ZINC000489883254	332071572	/nfs/dbraw/zinc/07/15/72/332071572.db2.gz	KFOKELHQNOHURN-INIZCTEOSA-N	1	0	288.410	4.335	20	30		CIEDRO
C=CCCC[N@@H+]1CCC[C@H](c2nc3c(s2)CCCC3)C1	ZINC000490060523	332079350	/nfs/dbraw/zinc/07/93/50/332079350.db2.gz	MXRJTHZYDQFRSR-AWEZNQCLSA-N	1	0	290.476	4.168	20	30		CIEDRO
Cc1ccc2c(c1)[C@@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)CCC2	ZINC000490263278	332085846	/nfs/dbraw/zinc/08/58/46/332085846.db2.gz	SLQPIERHLMZDDU-KYJSFNMBSA-N	1	0	268.404	4.044	20	30		CIEDRO
CC(C)[N@H+](Cc1ccc(F)c(C#N)c1)C1CCCCC1	ZINC000491288572	332182343	/nfs/dbraw/zinc/18/23/43/332182343.db2.gz	GFBRECMPJZJVKK-UHFFFAOYSA-N	1	0	274.383	4.240	20	30		CIEDRO
C=CC[N@@H+](C/C=C/c1ccccc1)CCc1ccco1	ZINC000491395699	332204308	/nfs/dbraw/zinc/20/43/08/332204308.db2.gz	KDFMCBAXEJPWJZ-UXBLZVDNSA-N	1	0	267.372	4.024	20	30		CIEDRO
Cc1cc(C[NH2+]C[C@H]2CCCCC(F)(F)C2)ccc1C#N	ZINC000491572583	332240730	/nfs/dbraw/zinc/24/07/30/332240730.db2.gz	NTBSGUMRYUSDTB-HNNXBMFYSA-N	1	0	292.373	4.172	20	30		CIEDRO
N#Cc1ccc(C[NH2+]C[C@@H]2CCCCC(F)(F)C2)c(F)c1	ZINC000491582179	332241316	/nfs/dbraw/zinc/24/13/16/332241316.db2.gz	VAOBPMDWWBFWQY-CYBMUJFWSA-N	1	0	296.336	4.003	20	30		CIEDRO
C=CC[N@H+](Cc1ccc(Cl)s1)C[C@@H]1CCO[C@H](C)C1	ZINC000491939734	332376173	/nfs/dbraw/zinc/37/61/73/332376173.db2.gz	MMHNZJIUOMYIFU-CHWSQXEVSA-N	1	0	299.867	4.205	20	30		CIEDRO
Cc1cc(C[NH2+]C(C)(C)c2ccccc2F)ccc1C#N	ZINC000492315695	332392147	/nfs/dbraw/zinc/39/21/47/332392147.db2.gz	YHNAPUXESMSRKC-UHFFFAOYSA-N	1	0	282.362	4.031	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](c1ccc(F)cc1)c1ccc(OC)cc1	ZINC000494027164	332461374	/nfs/dbraw/zinc/46/13/74/332461374.db2.gz	GKACOLURKRFQDJ-LIRRHRJNSA-N	1	0	299.389	4.478	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@H](C)c1nc(C(F)(F)F)cs1	ZINC000494387038	332471997	/nfs/dbraw/zinc/47/19/97/332471997.db2.gz	QXAYHBNUCOPTDV-LPEHRKFASA-N	1	0	292.370	4.413	20	30		CIEDRO
C[C@@H]([NH2+]C[C@H]1CCCCC(F)(F)C1)c1cccc(C#N)c1	ZINC000495017928	332500005	/nfs/dbraw/zinc/50/00/05/332500005.db2.gz	LWMDYMJAAJAIBT-HIFRSBDPSA-N	1	0	292.373	4.424	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(C#N)cc1)c1ccc(F)cc1F	ZINC000172619279	335112093	/nfs/dbraw/zinc/11/20/93/335112093.db2.gz	HHCJZARHTSOGJC-KRWDZBQOSA-N	1	0	286.325	4.077	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1C[C@H](C)C[C@H](C)C1)c1ccc(C#N)cc1	ZINC000252128098	334374178	/nfs/dbraw/zinc/37/41/78/334374178.db2.gz	LRECBTPXKDSLHZ-OEUWWYETSA-N	1	0	256.393	4.034	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H]1CC=C(c2ccc(F)cc2)CC1	ZINC000498793859	332572921	/nfs/dbraw/zinc/57/29/21/332572921.db2.gz	GCRSQQLMIJGKIX-GUYCJALGSA-N	1	0	259.368	4.316	20	30		CIEDRO
Cc1cc(C)c(C[NH2+]CC(C)(C)CCC#N)cc1C	ZINC000554719628	334448333	/nfs/dbraw/zinc/44/83/33/334448333.db2.gz	DIPVTLVSXSFUKE-UHFFFAOYSA-N	1	0	258.409	4.031	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCc1ccc2c(c1)CCO2)c1ccco1	ZINC000552042744	334280290	/nfs/dbraw/zinc/28/02/90/334280290.db2.gz	ZYHFPJLBJDFVNW-QGZVFWFLSA-N	1	0	297.398	4.054	20	30		CIEDRO
C[C@@H]1C[C@]1([NH2+]Cc1ccc(C#N)cc1)c1ccc(Cl)cc1	ZINC000500396039	332606221	/nfs/dbraw/zinc/60/62/21/332606221.db2.gz	IXHMOKABJLKQQL-FZKQIMNGSA-N	1	0	296.801	4.237	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](C)c1nc2c(s1)CCC2	ZINC000502021675	332645682	/nfs/dbraw/zinc/64/56/82/332645682.db2.gz	ZIJBREPBKJPLGJ-RYUDHWBXSA-N	1	0	264.438	4.027	20	30		CIEDRO
C[C@H]1CCC[C@H]1[NH2+]C1CCC(C#N)(c2ccccc2)CC1	ZINC000502347825	332654378	/nfs/dbraw/zinc/65/43/78/332654378.db2.gz	WYYOFFZQPJIKAO-WEOZKBJRSA-N	1	0	282.431	4.169	20	30		CIEDRO
C[C@@H]1CCC[C@@H]1[NH2+]C1CCC(C#N)(c2ccccc2)CC1	ZINC000502347823	332654474	/nfs/dbraw/zinc/65/44/74/332654474.db2.gz	WYYOFFZQPJIKAO-IZIZEDOESA-N	1	0	282.431	4.169	20	30		CIEDRO
CC(C)[C@H]([NH2+]Cc1ccc(CC#N)cc1)c1ccc(F)cc1	ZINC000502563873	332665651	/nfs/dbraw/zinc/66/56/51/332665651.db2.gz	SGUSWTSUZUMJOZ-IBGZPJMESA-N	1	0	296.389	4.379	20	30		CIEDRO
CC[C@H]1C[C@@]1([NH2+]CCC(C)(C)C#N)c1cccc(C)c1	ZINC000502590825	332666722	/nfs/dbraw/zinc/66/67/22/332666722.db2.gz	HPADSZYXGDNOIO-YJBOKZPZSA-N	1	0	270.420	4.150	20	30		CIEDRO
CCCc1cc(N2CCC(C)(C#N)CC2)c2ccccc2[nH+]1	ZINC000503305302	332685859	/nfs/dbraw/zinc/68/58/59/332685859.db2.gz	STRPOXSUGGRAIM-UHFFFAOYSA-N	1	0	293.414	4.317	20	30		CIEDRO
C[C@H]([NH2+][C@H]1C[C@@H](C)c2ccccc21)c1ccc(C#N)cc1	ZINC000266430257	334691898	/nfs/dbraw/zinc/69/18/98/334691898.db2.gz	DBFRWAHEVHEDLF-TYILLQQXSA-N	1	0	276.383	4.457	20	30		CIEDRO
C=CC[C@@H](C)[C@H](C)[NH2+][C@H]1C[C@H](c2ccc(OC)c(F)c2)C1	ZINC000503856078	332696721	/nfs/dbraw/zinc/69/67/21/332696721.db2.gz	NAHGYYSPVRDWGP-OCVGTWLNSA-N	1	0	291.410	4.271	20	30		CIEDRO
C=CCCC[NH2+][C@@H](c1ccccc1)c1ccc(F)cc1	ZINC000303741562	332949906	/nfs/dbraw/zinc/94/99/06/332949906.db2.gz	ZHNXPWCVRSNEDX-SFHVURJKSA-N	1	0	269.363	4.471	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@@H](C)C[C@@H]1C)c1ccc(C#N)cc1F	ZINC000512611615	332975983	/nfs/dbraw/zinc/97/59/83/332975983.db2.gz	LNJVVFZRCIINCY-ZHRONYKTSA-N	1	0	274.383	4.173	20	30		CIEDRO
C[C@H]([NH2+][C@@H](C)c1ccc(C#N)cc1F)c1ccccc1	ZINC000512628289	332976809	/nfs/dbraw/zinc/97/68/09/332976809.db2.gz	DHEVRSMOBXIYRG-STQMWFEESA-N	1	0	268.335	4.109	20	30		CIEDRO
C[C@@H]([NH2+]Cc1cccc(Cl)c1)c1ccc(C#N)cc1F	ZINC000512633988	332977056	/nfs/dbraw/zinc/97/70/56/332977056.db2.gz	BQBXVYBZRKSFHB-LLVKDONJSA-N	1	0	288.753	4.202	20	30		CIEDRO
C[C@@H]([NH2+][C@H](C)c1ccc(C#N)cc1F)c1cccs1	ZINC000512641921	332977239	/nfs/dbraw/zinc/97/72/39/332977239.db2.gz	LEWMYCXTKFKPMQ-GHMZBOCLSA-N	1	0	274.364	4.171	20	30		CIEDRO
CCC1CCC([NH2+][C@H](C)c2ccc(C#N)cc2F)CC1	ZINC000512653849	332978046	/nfs/dbraw/zinc/97/80/46/332978046.db2.gz	HJBUVCFKVFKQJI-DNOWBOINSA-N	1	0	274.383	4.317	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@@H]2CCC[C@H]2C1)c1ccc(C#N)cc1F	ZINC000512655434	332978090	/nfs/dbraw/zinc/97/80/90/332978090.db2.gz	ULLZYCIKKRJEOH-QCEMKRCNSA-N	1	0	286.394	4.317	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@H](C)[C@H]1C)c1ccc(C#N)cc1F	ZINC000512661831	332978611	/nfs/dbraw/zinc/97/86/11/332978611.db2.gz	UPHZFGWHWWVCRJ-PFHKOEEOSA-N	1	0	274.383	4.173	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CCC[C@H]2c2ccccc2)c(F)c1	ZINC000513062473	333002130	/nfs/dbraw/zinc/00/21/30/333002130.db2.gz	GINSIIXQJKJQQI-PKOBYXMFSA-N	1	0	294.373	4.123	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CCC[C@H]2c2ccccc2)s1	ZINC000513116915	333005199	/nfs/dbraw/zinc/00/51/99/333005199.db2.gz	MYXHFLUMQAXHLV-DLBZAZTESA-N	1	0	282.412	4.046	20	30		CIEDRO
CC(C)(C#N)CCC[N@H+](C1CC1)[C@@H]1CCc2ccccc21	ZINC000174832235	333008272	/nfs/dbraw/zinc/00/82/72/333008272.db2.gz	CRTCNEOJPUBLNW-GOSISDBHSA-N	1	0	282.431	4.468	20	30		CIEDRO
Cc1ccc(C[C@@H](C)[N@H+](C)CCCC(C)(C)C#N)cc1	ZINC000174870351	333009678	/nfs/dbraw/zinc/00/96/78/333009678.db2.gz	NKQFFVVOEDSUEE-MRXNPFEDSA-N	1	0	272.436	4.188	20	30		CIEDRO
C[C@@H]1C[C@@H](c2ccccc2)[N@H+](Cc2cc(C#N)ccc2F)C1	ZINC000513275872	333012119	/nfs/dbraw/zinc/01/21/19/333012119.db2.gz	LGMRXBYJBFFDKW-KUHUBIRLSA-N	1	0	294.373	4.280	20	30		CIEDRO
CC[C@@H](C)[C@H](C)[N@H+](Cc1ccc(C#N)s1)C1CC1	ZINC000513455417	333020801	/nfs/dbraw/zinc/02/08/01/333020801.db2.gz	MFCBLHDTERMUKO-NEPJUHHUSA-N	1	0	262.422	4.019	20	30		CIEDRO
CC[C@@H](C)[C@@H](C)[N@H+](Cc1ccc(C#N)cc1F)C1CC1	ZINC000513466471	333021422	/nfs/dbraw/zinc/02/14/22/333021422.db2.gz	GHXSUIVPAQMXEY-CHWSQXEVSA-N	1	0	274.383	4.096	20	30		CIEDRO
C=C1CC[NH+](Cc2ccc(OC)c(OCCCC)c2)CC1	ZINC000513497611	333023025	/nfs/dbraw/zinc/02/30/25/333023025.db2.gz	ZJAFAROSXZDOAI-UHFFFAOYSA-N	1	0	289.419	4.026	20	30		CIEDRO
CC(C)[C@@H]([NH2+]Cc1ccc(C#N)c(F)c1)c1ccccc1	ZINC000404766359	333025850	/nfs/dbraw/zinc/02/58/50/333025850.db2.gz	SBGUBPITHZHLQP-GOSISDBHSA-N	1	0	282.362	4.184	20	30		CIEDRO
N#Cc1csc(C[N@@H+]2CCC[C@H](Cc3ccccc3)C2)c1	ZINC000513648650	333028929	/nfs/dbraw/zinc/02/89/29/333028929.db2.gz	UCNXXXSVFXQGJC-MRXNPFEDSA-N	1	0	296.439	4.074	20	30		CIEDRO
C=C[C@@H](C)[NH2+][C@H](CC)c1ccc(OC(F)(F)F)cc1	ZINC000513703286	333034068	/nfs/dbraw/zinc/03/40/68/333034068.db2.gz	SRWIJZYVDRAOEC-ZWNOBZJWSA-N	1	0	273.298	4.200	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1cccc(F)c1)c1ccco1	ZINC000513762673	333037940	/nfs/dbraw/zinc/03/79/40/333037940.db2.gz	SBGXMRXTFKCOIS-OAHLLOKOSA-N	1	0	259.324	4.216	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@H](c1ccccc1)N(C)C)c1ccco1	ZINC000513763294	333037972	/nfs/dbraw/zinc/03/79/72/333037972.db2.gz	WUSSDJGYTKHQIX-ZWKOTPCHSA-N	1	0	298.430	4.179	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H](C)c1ccc(F)c(F)c1	ZINC000310857039	333061964	/nfs/dbraw/zinc/06/19/64/333061964.db2.gz	NCXVCKYISFMEMO-NSHDSACASA-N	1	0	253.336	4.218	20	30		CIEDRO
CCCCc1ccc([C@H](C)[NH2+]CCCCC#N)cc1	ZINC000178641347	333076278	/nfs/dbraw/zinc/07/62/78/333076278.db2.gz	QOVBZGRVVDOKOK-HNNXBMFYSA-N	1	0	258.409	4.374	20	30		CIEDRO
N#Cc1ccccc1C[N@@H+](Cc1ccccc1)CC1CCC1	ZINC000516745987	333081503	/nfs/dbraw/zinc/08/15/03/333081503.db2.gz	ZXYASBMCJGOBKZ-UHFFFAOYSA-N	1	0	290.410	4.361	20	30		CIEDRO
C[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(C#N)cc1C(F)(F)F	ZINC000516941486	333087021	/nfs/dbraw/zinc/08/70/21/333087021.db2.gz	NHYDEXHKTQDSLP-NHYWBVRUSA-N	1	0	296.336	4.245	20	30		CIEDRO
C=CCOc1cccc(C[NH2+]C[C@H]2CCc3ccccc32)c1	ZINC000517713000	333106528	/nfs/dbraw/zinc/10/65/28/333106528.db2.gz	DIAJPNLIRNUNFN-GOSISDBHSA-N	1	0	293.410	4.071	20	30		CIEDRO
CCC[N@H+](Cc1ccc(F)cc1)Cc1cccc(C#N)c1	ZINC000521195541	333114783	/nfs/dbraw/zinc/11/47/83/333114783.db2.gz	FVFBQBGFCFDOCS-UHFFFAOYSA-N	1	0	282.362	4.110	20	30		CIEDRO
C=C(C[NH2+][C@@H](C)c1cccc(NC(C)=O)c1)c1ccccc1	ZINC000336853068	335121664	/nfs/dbraw/zinc/12/16/64/335121664.db2.gz	CPDKMBIVTGZNTL-HNNXBMFYSA-N	1	0	294.398	4.009	20	30		CIEDRO
C=CC1CC[NH+](Cc2ccc(C(F)F)cc2)CC1	ZINC000183944121	333123922	/nfs/dbraw/zinc/12/39/22/333123922.db2.gz	BOBIPVXKHMHOKG-UHFFFAOYSA-N	1	0	251.320	4.022	20	30		CIEDRO
CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1[NH2+]Cc1cccc(C#N)c1	ZINC000217868918	333124833	/nfs/dbraw/zinc/12/48/33/333124833.db2.gz	VSPPKZLFTIOPIS-JLSDUUJJSA-N	1	0	270.420	4.109	20	30		CIEDRO
CC(C)[C@H]1CCc2ccccc2[C@@H]1[NH2+]Cc1ccc(C#N)o1	ZINC000185082209	333135310	/nfs/dbraw/zinc/13/53/10/333135310.db2.gz	MUGWWUCZJBCMHJ-IEBWSBKVSA-N	1	0	294.398	4.201	20	30		CIEDRO
C=CCSCC[NH2+][C@H](C)c1cc2ccccc2s1	ZINC000219184386	333143905	/nfs/dbraw/zinc/14/39/05/333143905.db2.gz	CUGUTEBJBPHLGP-GFCCVEGCSA-N	1	0	277.458	4.471	20	30		CIEDRO
CCC[N@H+](CCc1cccs1)CC(C)(C)CCC#N	ZINC000185586962	333144398	/nfs/dbraw/zinc/14/43/98/333144398.db2.gz	HABXXFIOHUBCQD-UHFFFAOYSA-N	1	0	278.465	4.333	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)c1cccc(C(F)(F)F)c1	ZINC000185763504	333148211	/nfs/dbraw/zinc/14/82/11/333148211.db2.gz	MUZOHDMLIVFTPS-SLEUVZQESA-N	1	0	296.336	4.438	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+]CCc2cccc3ccccc32)C1	ZINC000185819607	333149666	/nfs/dbraw/zinc/14/96/66/333149666.db2.gz	QMIOFWCZSCZOAG-MAUKXSAKSA-N	1	0	278.399	4.054	20	30		CIEDRO
CC(C)[C@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1ccc(F)cc1F	ZINC000185856285	333150349	/nfs/dbraw/zinc/15/03/49/333150349.db2.gz	QFNRALHRJFBUTL-JDFRZJQESA-N	1	0	292.373	4.334	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+]CC2(Cc3ccccc3)CCC2)C1	ZINC000185860434	333150367	/nfs/dbraw/zinc/15/03/67/333150367.db2.gz	FPIAMMLPFPRFEE-QZTJIDSGSA-N	1	0	282.431	4.071	20	30		CIEDRO
C[C@@H](CCC1CC1)[NH2+][C@H](CCC#N)c1ccccc1	ZINC000186427902	333160645	/nfs/dbraw/zinc/16/06/45/333160645.db2.gz	RHGICBAOJPHWDR-WMLDXEAASA-N	1	0	256.393	4.200	20	30		CIEDRO
N#Cc1cc(Cl)ccc1C[NH2+][C@H](c1ccccc1)C1CC1	ZINC000187448588	333171199	/nfs/dbraw/zinc/17/11/99/333171199.db2.gz	WPZSCQBEDZZSQU-GOSISDBHSA-N	1	0	296.801	4.453	20	30		CIEDRO
C=C(C)COCC[NH2+][C@H](C)c1cccc(Cl)c1Cl	ZINC000222309279	333180938	/nfs/dbraw/zinc/18/09/38/333180938.db2.gz	GZUFQMHEWHVGGZ-LLVKDONJSA-N	1	0	288.218	4.237	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]CC(C)(C)C)cc1Cl	ZINC000521814739	333189433	/nfs/dbraw/zinc/18/94/33/333189433.db2.gz	WLJUHEDVJHMCET-UHFFFAOYSA-N	1	0	267.800	4.041	20	30		CIEDRO
CC(C)C[N@@H+](Cc1ccc(C#N)cc1)CC1CCCC1	ZINC000521822352	333190357	/nfs/dbraw/zinc/19/03/57/333190357.db2.gz	KRCBZJJOKFBDJM-UHFFFAOYSA-N	1	0	270.420	4.206	20	30		CIEDRO
C=CCOc1cccc(C[NH2+]C2(c3ccccc3)CC2)c1	ZINC000521861591	333194225	/nfs/dbraw/zinc/19/42/25/333194225.db2.gz	ZAAVFGUECRUOIV-UHFFFAOYSA-N	1	0	279.383	4.030	20	30		CIEDRO
CC(C)c1ccc2c(c1)[C@@H]([NH2+]Cc1cccc(C#N)c1)CC2	ZINC000189619833	333196900	/nfs/dbraw/zinc/19/69/00/333196900.db2.gz	AJTKWECSIPYOPR-FQEVSTJZSA-N	1	0	290.410	4.459	20	30		CIEDRO
CCC1(C[NH2+][C@H](C)c2cccc(C#N)c2)CCCC1	ZINC000224719721	333224750	/nfs/dbraw/zinc/22/47/50/333224750.db2.gz	FIQMWEHWIWDSAH-CQSZACIVSA-N	1	0	256.393	4.179	20	30		CIEDRO
C[C@@H]1C[C@@H](C)[N@H+](Cc2ccc(-c3ccccc3C#N)cc2)C1	ZINC000521945078	333224861	/nfs/dbraw/zinc/22/48/61/333224861.db2.gz	CCKJXYUQDRZSPL-HZPDHXFCSA-N	1	0	290.410	4.456	20	30		CIEDRO
C=CCCOCC[NH2+][C@@H](C)c1oc2ccccc2c1CC	ZINC000224760324	333225172	/nfs/dbraw/zinc/22/51/72/333225172.db2.gz	XTSTXDYRJKZFIB-AWEZNQCLSA-N	1	0	287.403	4.239	20	30		CIEDRO
CCCC[C@H]1CCC[C@@H]1[NH2+]CCCC(C)(C)C#N	ZINC000191831701	333226132	/nfs/dbraw/zinc/22/61/32/333226132.db2.gz	QREHGYMVBPZRDY-GJZGRUSLSA-N	1	0	250.430	4.265	20	30		CIEDRO
N#Cc1ccc(C[N@H+](Cc2ccco2)C2CCCC2)cc1F	ZINC000191949506	333227481	/nfs/dbraw/zinc/22/74/81/333227481.db2.gz	RJNWOLAYNGSUHC-UHFFFAOYSA-N	1	0	298.361	4.235	20	30		CIEDRO
CCc1ccc(C(C)(C)[NH2+]Cc2ccc(C#N)c(F)c2)cc1	ZINC000192160120	333231166	/nfs/dbraw/zinc/23/11/66/333231166.db2.gz	HSYMFDGMIXPSPZ-UHFFFAOYSA-N	1	0	296.389	4.285	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C#N)c(F)c1)c1cc2ccccc2o1	ZINC000192180087	333231879	/nfs/dbraw/zinc/23/18/79/333231879.db2.gz	VMTUXOZJURGQIO-GFCCVEGCSA-N	1	0	294.329	4.294	20	30		CIEDRO
C=CCOc1cccc(C[NH2+][C@@H]2CCCc3occc32)c1	ZINC000192947093	333240729	/nfs/dbraw/zinc/24/07/29/333240729.db2.gz	IPHKCXPMUDJSCV-QGZVFWFLSA-N	1	0	283.371	4.012	20	30		CIEDRO
Cc1ccc2c(c1)[C@@H]([NH2+][C@H]1CCC[C@H](C#N)C1)CCC2	ZINC000193060745	333242222	/nfs/dbraw/zinc/24/22/22/333242222.db2.gz	SLQPIERHLMZDDU-ZVZYQTTQSA-N	1	0	268.404	4.044	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+]Cc1cnc(-c2ccco2)s1	ZINC000193204127	333245188	/nfs/dbraw/zinc/24/51/88/333245188.db2.gz	YHQJKHUORJCXQT-LBPRGKRZSA-N	1	0	276.405	4.238	20	30		CIEDRO
C=CCCCCC[NH2+]C(C)(C)c1ncc(C)s1	ZINC000193551545	333253196	/nfs/dbraw/zinc/25/31/96/333253196.db2.gz	IODCISJXCBJUCE-UHFFFAOYSA-N	1	0	252.427	4.023	20	30		CIEDRO
CC(C)(C)[C@@H]([NH2+]Cc1ccccc1C#N)c1ccccc1	ZINC000226190939	333253636	/nfs/dbraw/zinc/25/36/36/333253636.db2.gz	HOCNAUQUTWXUCM-SFHVURJKSA-N	1	0	278.399	4.435	20	30		CIEDRO
N#Cc1ccc(C[N@H+](Cc2cccc(F)c2)CC2CC2)cc1	ZINC000195600409	333257045	/nfs/dbraw/zinc/25/70/45/333257045.db2.gz	XMJFXFAOAQCELE-UHFFFAOYSA-N	1	0	294.373	4.110	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCC[C@@H](C)CC1)c1ccc(C#N)cc1	ZINC000226496959	333263117	/nfs/dbraw/zinc/26/31/17/333263117.db2.gz	QMIQSCSGIZRPFF-CKEIUWERSA-N	1	0	256.393	4.178	20	30		CIEDRO
CC(C)(C)CN(CCC#N)Cc1cc(Cl)cs1	ZINC000194380162	333270337	/nfs/dbraw/zinc/27/03/37/333270337.db2.gz	XPURJKJGPOISNQ-UHFFFAOYSA-N	1	0	270.829	4.163	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H]2CCC[C@H](SC)C2)cc1	ZINC000227378292	333282223	/nfs/dbraw/zinc/28/22/23/333282223.db2.gz	SPENKLIPZZWLFR-RDJZCZTQSA-N	1	0	291.460	4.015	20	30		CIEDRO
C=CC[N@H+](Cc1cccc(C#N)c1)C[C@@H](C)c1ccccc1	ZINC000522662927	333295545	/nfs/dbraw/zinc/29/55/45/333295545.db2.gz	MBDLURXZXLGCKX-QGZVFWFLSA-N	1	0	290.410	4.350	20	30		CIEDRO
C=CCCC[N@@H+](C)CCOc1cccc2ccccc21	ZINC000523007464	333304301	/nfs/dbraw/zinc/30/43/01/333304301.db2.gz	NEJCEPYGVFBRKC-UHFFFAOYSA-N	1	0	269.388	4.117	20	30		CIEDRO
C=CCCC[N@@H+](C)Cc1cccc(OCC(F)(F)F)c1	ZINC000523007327	333304305	/nfs/dbraw/zinc/30/43/05/333304305.db2.gz	HJPMIAUIBJOVPX-UHFFFAOYSA-N	1	0	287.325	4.026	20	30		CIEDRO
C[C@H]([NH2+]CC1(C)CCCCC1)c1ccc(C#N)cc1	ZINC000229572953	333306381	/nfs/dbraw/zinc/30/63/81/333306381.db2.gz	UXUAFQILRSMANE-AWEZNQCLSA-N	1	0	256.393	4.179	20	30		CIEDRO
C[C@H]([NH2+]CC(C)(C)CCC#N)c1cccc(OC(F)F)c1	ZINC000229675439	333307623	/nfs/dbraw/zinc/30/76/23/333307623.db2.gz	ISDXZMORAHUTKA-LBPRGKRZSA-N	1	0	296.361	4.269	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H](c1ccccc1)C1CC1	ZINC000229683950	333307689	/nfs/dbraw/zinc/30/76/89/333307689.db2.gz	COZFAOKFHCEBEL-MRXNPFEDSA-N	1	0	256.393	4.057	20	30		CIEDRO
CCC[C@H]([NH2+]CC(C)(C)CCC#N)c1ccccc1	ZINC000229683046	333307745	/nfs/dbraw/zinc/30/77/45/333307745.db2.gz	KVMBPAUVCYTZMK-INIZCTEOSA-N	1	0	258.409	4.447	20	30		CIEDRO
CSc1ccc([C@H](C)[NH2+]CC(C)(C)CCC#N)cc1	ZINC000229679466	333307755	/nfs/dbraw/zinc/30/77/55/333307755.db2.gz	KWFGXTPBDOEIII-ZDUSSCGKSA-N	1	0	276.449	4.389	20	30		CIEDRO
CC[C@@H]([NH2+]CC(C)(C)CCC#N)c1ccc(C)cc1	ZINC000229681465	333307780	/nfs/dbraw/zinc/30/77/80/333307780.db2.gz	HMNZZGXJYDBYPW-MRXNPFEDSA-N	1	0	258.409	4.366	20	30		CIEDRO
CC(C)[N@H+](Cc1ccccc1)Cc1ccc(F)c(C#N)c1	ZINC000229747991	333309085	/nfs/dbraw/zinc/30/90/85/333309085.db2.gz	KZAKYRUYYBOEBT-UHFFFAOYSA-N	1	0	282.362	4.108	20	30		CIEDRO
CC(C)(C)CCC[NH2+]Cc1cccc(OCCCC#N)c1	ZINC000523518242	333331960	/nfs/dbraw/zinc/33/19/60/333331960.db2.gz	SDQIXUBRMUFKNK-UHFFFAOYSA-N	1	0	288.435	4.285	20	30		CIEDRO
CC(C)(C)C1CC[NH+](CCCCC(C)(C)C#N)CC1	ZINC000232571295	333338850	/nfs/dbraw/zinc/33/88/50/333338850.db2.gz	AALWVCFJMMPTLI-UHFFFAOYSA-N	1	0	264.457	4.465	20	30		CIEDRO
CC(C)C1CC[NH+](CCCCC(C)(C)C#N)CC1	ZINC000232593732	333339071	/nfs/dbraw/zinc/33/90/71/333339071.db2.gz	KEXXFBOOKXGHOC-UHFFFAOYSA-N	1	0	250.430	4.074	20	30		CIEDRO
CC(C)[C@@H]1CCC[N@H+](CCCCC(C)(C)C#N)CC1	ZINC000232697054	333340733	/nfs/dbraw/zinc/34/07/33/333340733.db2.gz	YPPBXYDREBGBKJ-MRXNPFEDSA-N	1	0	264.457	4.465	20	30		CIEDRO
C=CC[C@@H](C)[NH2+]Cc1ccc(-c2cccc(F)c2C)o1	ZINC000523935678	333349634	/nfs/dbraw/zinc/34/96/34/333349634.db2.gz	CHEQQZRPHYVNJO-GFCCVEGCSA-N	1	0	273.351	4.448	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]C(C)(C)c2cccs2)cc1	ZINC000523940035	333349756	/nfs/dbraw/zinc/34/97/56/333349756.db2.gz	QTGIAPNESYDEJT-UHFFFAOYSA-N	1	0	287.428	4.338	20	30		CIEDRO
CCC[C@H]1CCCC[N@@H+]1CCCCC(C)(C)C#N	ZINC000233359941	333351766	/nfs/dbraw/zinc/35/17/66/333351766.db2.gz	CWYPMPZBJGOYBE-HNNXBMFYSA-N	1	0	250.430	4.361	20	30		CIEDRO
N#Cc1cccc(C[NH+]2CCC(c3ccccc3F)CC2)c1	ZINC000524081862	333353162	/nfs/dbraw/zinc/35/31/62/333353162.db2.gz	BRVLYWXUKRXKHX-UHFFFAOYSA-N	1	0	294.373	4.077	20	30		CIEDRO
CC[C@@H]1CCCCC[N@@H+]1CCCCC(C)(C)C#N	ZINC000233910751	333356070	/nfs/dbraw/zinc/35/60/70/333356070.db2.gz	MSHIANSZSCATPZ-OAHLLOKOSA-N	1	0	250.430	4.361	20	30		CIEDRO
C[N@H+](CCCCC(C)(C)C#N)CC1CCCCC1	ZINC000234271668	333359185	/nfs/dbraw/zinc/35/91/85/333359185.db2.gz	BNVYPCBCZMRLJH-UHFFFAOYSA-N	1	0	250.430	4.219	20	30		CIEDRO
C=CCCCCC[NH2+][C@H](C)c1ccc(OC)c(OC)c1	ZINC000234880279	333362786	/nfs/dbraw/zinc/36/27/86/333362786.db2.gz	LFALNLNJUXQSPH-CQSZACIVSA-N	1	0	277.408	4.101	20	30		CIEDRO
C[C@@H]1C[C@@H](C)[C@@H](C)[N@H+](CCCCC(C)(C)C#N)C1	ZINC000235379122	333368738	/nfs/dbraw/zinc/36/87/38/333368738.db2.gz	HQEFMCMWMAXNOA-RBSFLKMASA-N	1	0	250.430	4.073	20	30		CIEDRO
C[C@@H]1c2ccsc2CC[N@H+]1CCCCC(C)(C)C#N	ZINC000235601109	333371053	/nfs/dbraw/zinc/37/10/53/333371053.db2.gz	DJPRKROLIWGQBS-CYBMUJFWSA-N	1	0	276.449	4.387	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H](c2ccccc2)C2CC2)cc1	ZINC000236683942	333374688	/nfs/dbraw/zinc/37/46/88/333374688.db2.gz	JIRJFUYLVUQCTC-HXUWFJFHSA-N	1	0	293.410	4.492	20	30		CIEDRO
N#Cc1cccc(C[NH2+]CCc2csc3ccccc23)c1	ZINC000237846209	333381946	/nfs/dbraw/zinc/38/19/46/333381946.db2.gz	RZAICDBSMBBEHR-UHFFFAOYSA-N	1	0	292.407	4.105	20	30		CIEDRO
Cc1ccc(C2CC([NH2+][C@@H](C)c3ccc(C#N)cc3)C2)cc1	ZINC000315627375	333382717	/nfs/dbraw/zinc/38/27/17/333382717.db2.gz	XFSTYGPACTVAQS-VMEOHVCESA-N	1	0	290.410	4.464	20	30		CIEDRO
C[C@@H](CC(C)(C)c1ccccc1)[NH2+]Cc1ccc(C#N)cc1	ZINC000315623436	333382808	/nfs/dbraw/zinc/38/28/08/333382808.db2.gz	SVXSIKWWZLXHOI-INIZCTEOSA-N	1	0	292.426	4.404	20	30		CIEDRO
C[C@@H]([NH2+]C[C@H]1CCCc2ccccc21)c1ccc(C#N)cc1	ZINC000315874115	333384076	/nfs/dbraw/zinc/38/40/76/333384076.db2.gz	PYLJFIIQQVUNNH-DNVCBOLYSA-N	1	0	290.410	4.329	20	30		CIEDRO
CC[C@@H](C)[C@H]1CCCC[N@@H+]1Cc1cc(C#N)ccc1F	ZINC000524811269	333389016	/nfs/dbraw/zinc/38/90/16/333389016.db2.gz	GDQPAHIROSORCE-CXAGYDPISA-N	1	0	274.383	4.098	20	30		CIEDRO
CC[C@H](C)[C@H]1CCCC[N@@H+]1Cc1cc(C#N)ccc1F	ZINC000524811277	333389242	/nfs/dbraw/zinc/38/92/42/333389242.db2.gz	GDQPAHIROSORCE-SUMWQHHRSA-N	1	0	274.383	4.098	20	30		CIEDRO
C=C(C)C[NH2+]C1(c2ccc(Cl)c(Cl)c2)CC1	ZINC000393802514	333395099	/nfs/dbraw/zinc/39/50/99/333395099.db2.gz	MYPHHVROHVKUSE-UHFFFAOYSA-N	1	0	256.176	4.148	20	30		CIEDRO
CC#CC[N@H+](C)[C@H](C)c1sc(-c2ccc(C)cc2)nc1C	ZINC000525123320	333399872	/nfs/dbraw/zinc/39/98/72/333399872.db2.gz	XUXCRJGNTFBLIM-OAHLLOKOSA-N	1	0	298.455	4.443	20	30		CIEDRO
CSc1ccc([C@H](C)[NH2+]Cc2ccc(C#N)cc2)cc1	ZINC000036994331	333454344	/nfs/dbraw/zinc/45/43/44/333454344.db2.gz	NNKIUNSWSGCMDE-ZDUSSCGKSA-N	1	0	282.412	4.131	20	30		CIEDRO
C[C@H]([NH2+][C@@H](C)c1ccc(F)c(F)c1)c1cccc(C#N)c1	ZINC000037277473	333529838	/nfs/dbraw/zinc/52/98/38/333529838.db2.gz	BBPMIHSQCJRHMQ-RYUDHWBXSA-N	1	0	286.325	4.248	20	30		CIEDRO
CC(C)(C)[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(C#N)cc1	ZINC000037507771	333534471	/nfs/dbraw/zinc/53/44/71/333534471.db2.gz	JJGAGEYHSLHUMF-SJORKVTESA-N	1	0	270.420	4.253	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H](C)c2ccc(C)cc2)cc1	ZINC000037770977	333538521	/nfs/dbraw/zinc/53/85/21/333538521.db2.gz	HYVSWPPWMCXKSN-MRXNPFEDSA-N	1	0	281.399	4.411	20	30		CIEDRO
Cc1ccccc1C[C@@H](C)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000037776959	333539289	/nfs/dbraw/zinc/53/92/89/333539289.db2.gz	SJAKFTUCEZZQMO-CVEARBPZSA-N	1	0	278.399	4.149	20	30		CIEDRO
CCC[NH2+][C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000038070537	333544671	/nfs/dbraw/zinc/54/46/71/333544671.db2.gz	UHEQCABKHPKUDP-CQSZACIVSA-N	1	0	264.372	4.286	20	30		CIEDRO
C=C(C)COCC[NH2+][C@@H](C)c1cccc2ccccc21	ZINC000125630933	333568614	/nfs/dbraw/zinc/56/86/14/333568614.db2.gz	KBULAKKUTAAPFH-HNNXBMFYSA-N	1	0	269.388	4.083	20	30		CIEDRO
Cc1c2ccccc2oc1C[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000174100452	335148157	/nfs/dbraw/zinc/14/81/57/335148157.db2.gz	LPDYTUHBUNIOJC-AWEZNQCLSA-N	1	0	290.366	4.464	20	30		CIEDRO
N#CCC[C@@H]([NH2+]CC1CCCCC1)c1ccccc1	ZINC000125778266	333572942	/nfs/dbraw/zinc/57/29/42/333572942.db2.gz	BXGMHRSBXDKFDD-QGZVFWFLSA-N	1	0	256.393	4.201	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccccc1C(C)(C)C#N)C(C)(C)C	ZINC000538390891	333587922	/nfs/dbraw/zinc/58/79/22/333587922.db2.gz	FBGTZQFBIAVZRR-MRXNPFEDSA-N	1	0	272.436	4.402	20	30		CIEDRO
Cc1ccccc1[C@H]([NH2+]Cc1ccc(F)cc1C#N)C1CC1	ZINC000538392055	333588083	/nfs/dbraw/zinc/58/80/83/333588083.db2.gz	IRRAQQFBZLVURQ-LJQANCHMSA-N	1	0	294.373	4.247	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H]2CCC[C@@H]2C1)c1ccc(C#N)cc1	ZINC000538396154	333588383	/nfs/dbraw/zinc/58/83/83/333588383.db2.gz	JZJLOUSWVDFLHU-OKDNKWQNSA-N	1	0	268.404	4.178	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)CCc1ccccc1)c1ccc(C#N)c(F)c1	ZINC000538502840	333600666	/nfs/dbraw/zinc/60/06/66/333600666.db2.gz	ODBTWSUTCCZTHU-LSDHHAIUSA-N	1	0	296.389	4.369	20	30		CIEDRO
CC[C@@H](Cc1ccccc1)[NH2+][C@H](C)c1ccc(C#N)c(F)c1	ZINC000538508161	333601154	/nfs/dbraw/zinc/60/11/54/333601154.db2.gz	ZNIIBDDVMMUJEV-KDOFPFPSSA-N	1	0	296.389	4.369	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1ccccc1)c1ccc(C#N)c(F)c1	ZINC000538508237	333601317	/nfs/dbraw/zinc/60/13/17/333601317.db2.gz	DFXINYDOMLCVIR-QWHCGFSZSA-N	1	0	268.335	4.109	20	30		CIEDRO
CCC[C@H]([NH2+]CCC(C)(C)C#N)c1ccc(F)cc1F	ZINC000538513654	333602446	/nfs/dbraw/zinc/60/24/46/333602446.db2.gz	SRQUKLJHTDMMRM-HNNXBMFYSA-N	1	0	280.362	4.335	20	30		CIEDRO
C[C@H]([NH2+][C@H]1[C@H](C)CCC[C@@H]1C)c1ccc(C#N)c(F)c1	ZINC000538565966	333606709	/nfs/dbraw/zinc/60/67/09/333606709.db2.gz	IAZFHTFBPLVNDO-PFHKOEEOSA-N	1	0	274.383	4.173	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@@H](C)[C@H](OC)c1ccc(F)cc1	ZINC000539067522	333654665	/nfs/dbraw/zinc/65/46/65/333654665.db2.gz	VTXOHVCSSOVFHH-JQFCIGGWSA-N	1	0	279.399	4.236	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1	ZINC000128357033	333662370	/nfs/dbraw/zinc/66/23/70/333662370.db2.gz	HIHXFDASRBKVIO-RWMBFGLXSA-N	1	0	263.347	4.442	20	30		CIEDRO
CC(C)[C@@H]1CCC[C@H]([NH2+]CC(C)(C)CCC#N)C1	ZINC000174347898	335153238	/nfs/dbraw/zinc/15/32/38/335153238.db2.gz	UTPJCXICQGFFGT-CABCVRRESA-N	1	0	250.430	4.121	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CC[C@H]3CCCC[C@@H]3C2)s1	ZINC000539416700	333670611	/nfs/dbraw/zinc/67/06/11/333670611.db2.gz	XDERYAGSMTUINY-MGPQQGTHSA-N	1	0	274.433	4.068	20	30		CIEDRO
CC(C)Cc1ccc([C@@H]([NH2+]CCCC#N)C2CC2)cc1	ZINC000539492976	333673563	/nfs/dbraw/zinc/67/35/63/333673563.db2.gz	DVVFPXVUJPHEIR-GOSISDBHSA-N	1	0	270.420	4.230	20	30		CIEDRO
Cc1cccc(C)c1CC[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000539509381	333675468	/nfs/dbraw/zinc/67/54/68/333675468.db2.gz	ZCFFCTIISADBFE-INIZCTEOSA-N	1	0	278.399	4.068	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]CC(C)(C)Cc1ccccc1	ZINC000174406317	335153860	/nfs/dbraw/zinc/15/38/60/335153860.db2.gz	RVFHPBUTWALIRY-UHFFFAOYSA-N	1	0	272.436	4.175	20	30		CIEDRO
CSc1ccc(C[NH2+][C@@H](C)c2cccc(C#N)c2)cc1	ZINC000174430796	335154371	/nfs/dbraw/zinc/15/43/71/335154371.db2.gz	QOSQHEYCGIBCKF-ZDUSSCGKSA-N	1	0	282.412	4.131	20	30		CIEDRO
C=C(C)COCC[NH2+][C@@H](C)c1ccc(OC)c2ccccc21	ZINC000540156211	333714696	/nfs/dbraw/zinc/71/46/96/333714696.db2.gz	GMBAXTAYULFDHN-HNNXBMFYSA-N	1	0	299.414	4.092	20	30		CIEDRO
CC(C)C[C@@H](C)[NH2+]CC#Cc1ccc(C(F)(F)F)cc1	ZINC000540186796	333719198	/nfs/dbraw/zinc/71/91/98/333719198.db2.gz	LXKXDACOJBMORB-CYBMUJFWSA-N	1	0	283.337	4.081	20	30		CIEDRO
C=CCCC[C@H](C)[NH+]1CCC(C(=O)c2ccccc2)CC1	ZINC000540296176	333723535	/nfs/dbraw/zinc/72/35/35/333723535.db2.gz	KXMSZHXCWSMJSS-INIZCTEOSA-N	1	0	285.431	4.326	20	30		CIEDRO
C=CCCC[C@@H](C)[NH+]1CCC(c2c[nH]c3ncccc23)CC1	ZINC000540296591	333723776	/nfs/dbraw/zinc/72/37/76/333723776.db2.gz	FRVDBCGOEVVGRX-OAHLLOKOSA-N	1	0	297.446	4.487	20	30		CIEDRO
C=CCC[NH2+]C(C)(c1ccccc1)c1ccccc1	ZINC000540405753	333728716	/nfs/dbraw/zinc/72/87/16/333728716.db2.gz	AUZYOITTXWHQJF-UHFFFAOYSA-N	1	0	251.373	4.116	20	30		CIEDRO
C=CCCC[NH2+][C@H](C)c1ccc(SCCOC)cc1	ZINC000540402930	333728727	/nfs/dbraw/zinc/72/87/27/333728727.db2.gz	BIJYZDNYYHPTCB-CQSZACIVSA-N	1	0	279.449	4.042	20	30		CIEDRO
Cc1ccc(CC[C@H](C)[NH2+][C@H](C)c2ccc(C#N)cc2)o1	ZINC000540593563	333736672	/nfs/dbraw/zinc/73/66/72/333736672.db2.gz	KPKRWICNMWKGIN-DZGCQCFKSA-N	1	0	282.387	4.132	20	30		CIEDRO
C[C@@H]([NH2+]CCc1cccc(Cl)c1)c1ccc(C#N)cc1	ZINC000540596412	333736812	/nfs/dbraw/zinc/73/68/12/333736812.db2.gz	CZGOSRXEUXXXNX-CYBMUJFWSA-N	1	0	284.790	4.105	20	30		CIEDRO
C[C@@H]([NH2+][C@H](Cc1ccccc1)C1CC1)c1cccc(C#N)c1	ZINC000540608485	333737881	/nfs/dbraw/zinc/73/78/81/333737881.db2.gz	SVSBKAORVRKSGU-FOIQADDNSA-N	1	0	290.410	4.230	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2)s1	ZINC000540616075	333738459	/nfs/dbraw/zinc/73/84/59/333738459.db2.gz	ZEWKBNWTUILJTF-QAPCUYQASA-N	1	0	296.439	4.121	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2)s1	ZINC000540616074	333738522	/nfs/dbraw/zinc/73/85/22/333738522.db2.gz	ZEWKBNWTUILJTF-MAUKXSAKSA-N	1	0	296.439	4.121	20	30		CIEDRO
CC(C)(C#N)CC[NH2+][C@@H](c1ccccc1)C1CCC1	ZINC000540686553	333741592	/nfs/dbraw/zinc/74/15/92/333741592.db2.gz	PSJQURAVYKBBFY-INIZCTEOSA-N	1	0	256.393	4.057	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@@H](C)c1ccc(C#N)c(F)c1	ZINC000540706776	333742558	/nfs/dbraw/zinc/74/25/58/333742558.db2.gz	HOFTXHHTYUMSCT-OLZOCXBDSA-N	1	0	260.356	4.093	20	30		CIEDRO
C=C(C)C[NH2+][C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000541088940	333762058	/nfs/dbraw/zinc/76/20/58/333762058.db2.gz	GPPSCNAFUVQMPJ-OAHLLOKOSA-N	1	0	276.383	4.452	20	30		CIEDRO
CC(C)c1ccc([C@H](C)[NH+]2CCC(C)(C#N)CC2)cc1	ZINC000542256705	333818812	/nfs/dbraw/zinc/81/88/12/333818812.db2.gz	YSDGBIQOMRHSKJ-HNNXBMFYSA-N	1	0	270.420	4.497	20	30		CIEDRO
C=CCC[NH2+][C@H](Cc1ccccc1)c1cccs1	ZINC000542525898	333830999	/nfs/dbraw/zinc/83/09/99/333830999.db2.gz	NDJOCYCMCQSKRW-OAHLLOKOSA-N	1	0	257.402	4.198	20	30		CIEDRO
N#CCC[C@H]([NH2+]Cc1cccc2[nH]ccc21)c1ccccc1	ZINC000130410862	333841426	/nfs/dbraw/zinc/84/14/26/333841426.db2.gz	BVRAEKLRMRDJLM-SFHVURJKSA-N	1	0	289.382	4.303	20	30		CIEDRO
C[C@H](CC1CCCCC1)C[NH+]1CCC(C)(C#N)CC1	ZINC000543620429	333885111	/nfs/dbraw/zinc/88/51/11/333885111.db2.gz	MWROXAMZIAGKPY-OAHLLOKOSA-N	1	0	262.441	4.219	20	30		CIEDRO
C=CCSCC[NH2+][C@@H](C)c1ccc(SCC)cc1	ZINC000543754920	333895876	/nfs/dbraw/zinc/89/58/76/333895876.db2.gz	OHGBYZTWSYITKQ-ZDUSSCGKSA-N	1	0	281.490	4.368	20	30		CIEDRO
Cc1cc([C@H](C)[NH2+]CC#Cc2ccc(F)cc2)c(C)s1	ZINC000544399856	333929285	/nfs/dbraw/zinc/92/92/85/333929285.db2.gz	QYGOCZGFCXOXTE-ZDUSSCGKSA-N	1	0	287.403	4.206	20	30		CIEDRO
C[C@@H]([NH2+]CCC(C)(C)C#N)[C@@H](C)C1CCCCC1	ZINC000544421658	333930800	/nfs/dbraw/zinc/93/08/00/333930800.db2.gz	NLHRPHPGQBXIDN-ZIAGYGMSSA-N	1	0	250.430	4.121	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)c1cc2cccc(OCC)c2o1	ZINC000544483984	333933566	/nfs/dbraw/zinc/93/35/66/333933566.db2.gz	IIYSGMGPXLUARS-ZDUSSCGKSA-N	1	0	273.376	4.448	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@@H]1CCCO[C@H]1c1ccc(C)cc1	ZINC000544565160	333935637	/nfs/dbraw/zinc/93/56/37/333935637.db2.gz	JOGBEDKHPIMIRE-JQHSSLGASA-N	1	0	273.420	4.159	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@H]1CCCO[C@H]1c1ccc(C)cc1	ZINC000544565162	333935869	/nfs/dbraw/zinc/93/58/69/333935869.db2.gz	JOGBEDKHPIMIRE-SZMVWBNQSA-N	1	0	273.420	4.159	20	30		CIEDRO
CC(C)(C#N)CC[NH2+]C(C)(C)c1cccc(Cl)c1F	ZINC000545325715	333978901	/nfs/dbraw/zinc/97/89/01/333978901.db2.gz	SUCLPTAECIVQIF-UHFFFAOYSA-N	1	0	282.790	4.244	20	30		CIEDRO
C=C(C)C[N@H+]1CCC[C@H](c2nc3ccccc3n2C(C)C)C1	ZINC000074315792	334003041	/nfs/dbraw/zinc/00/30/41/334003041.db2.gz	LBAVNMQVXKUIKP-INIZCTEOSA-N	1	0	297.446	4.373	20	30		CIEDRO
CC[C@H](Cc1ccc(Cl)cc1Cl)[NH2+]C[C@H](C)C#N	ZINC000133035444	334013842	/nfs/dbraw/zinc/01/38/42/334013842.db2.gz	AHXDIAUPTHOWBE-ZWNOBZJWSA-N	1	0	285.218	4.064	20	30		CIEDRO
Cc1cccc(C)c1[C@@H](C)[NH2+]Cc1cccc(C#N)c1	ZINC000546171307	334018220	/nfs/dbraw/zinc/01/82/20/334018220.db2.gz	BYDPASDUDSCQBJ-OAHLLOKOSA-N	1	0	264.372	4.026	20	30		CIEDRO
Cc1cccc([C@H]2CCC[N@@H+]2CCCSCC#N)c1C	ZINC000074991422	334022355	/nfs/dbraw/zinc/02/23/55/334022355.db2.gz	RNTLHJMBMMVGEO-QGZVFWFLSA-N	1	0	288.460	4.087	20	30		CIEDRO
CCC1(C[NH2+]CC(C)(C)CCC#N)CCCCC1	ZINC000546564158	334038238	/nfs/dbraw/zinc/03/82/38/334038238.db2.gz	BQMMDYZUTYRKJT-UHFFFAOYSA-N	1	0	250.430	4.266	20	30		CIEDRO
N#Cc1ccc(C[N@@H+]2CCCC[C@H]2c2ccccc2)s1	ZINC000546693017	334046303	/nfs/dbraw/zinc/04/63/03/334046303.db2.gz	ZXTBIVBYUQEDRF-KRWDZBQOSA-N	1	0	282.412	4.347	20	30		CIEDRO
CC(C)(C#N)CC[NH2+]C1(Cc2ccccc2)CCCCC1	ZINC000547347109	334081973	/nfs/dbraw/zinc/08/19/73/334081973.db2.gz	CAYYHPUSNVKBDU-UHFFFAOYSA-N	1	0	284.447	4.461	20	30		CIEDRO
C=CC[C@@H](CO)[NH2+][C@H](C)c1ccc(Oc2ccccc2)cc1	ZINC000547393501	334085393	/nfs/dbraw/zinc/08/53/93/334085393.db2.gz	IJBCKPQUSWREMS-WBVHZDCISA-N	1	0	297.398	4.067	20	30		CIEDRO
Cc1ccccc1-c1cccc(C[NH2+]CCCCC#N)c1	ZINC000237687551	334095205	/nfs/dbraw/zinc/09/52/05/334095205.db2.gz	JPXKWXCEQWULIM-UHFFFAOYSA-N	1	0	278.399	4.446	20	30		CIEDRO
C=CC[C@@H](C)[NH2+]Cc1ccc(-c2ccccc2)s1	ZINC000134746884	334102856	/nfs/dbraw/zinc/10/28/56/334102856.db2.gz	SVDUWXSGPRFDRA-CYBMUJFWSA-N	1	0	257.402	4.469	20	30		CIEDRO
C=CC[C@@H](C)[NH2+]Cc1ccc(OCCC(C)C)cc1	ZINC000134749225	334102914	/nfs/dbraw/zinc/10/29/14/334102914.db2.gz	OYIXCBQLXPKDKZ-OAHLLOKOSA-N	1	0	261.409	4.166	20	30		CIEDRO
C[C@@H](C[NH2+][C@@H](C)c1ccc(C#N)cc1)Cc1ccccc1	ZINC000547846394	334126735	/nfs/dbraw/zinc/12/67/35/334126735.db2.gz	ZSFHSUOLWGUMJW-CVEARBPZSA-N	1	0	278.399	4.088	20	30		CIEDRO
C[C@@H]([NH2+]CCCCc1ccccc1)c1ccc(C#N)cc1	ZINC000135362815	334127730	/nfs/dbraw/zinc/12/77/30/334127730.db2.gz	OOBNNXKYGOIVKG-MRXNPFEDSA-N	1	0	278.399	4.232	20	30		CIEDRO
CC(C)[C@H]([NH2+]Cc1ccc(C#N)s1)c1ccc(F)cc1	ZINC000135673082	334135777	/nfs/dbraw/zinc/13/57/77/334135777.db2.gz	WDNXUIWYONCRBM-INIZCTEOSA-N	1	0	288.391	4.246	20	30		CIEDRO
N#Cc1ccc(C[NH2+]C2CCC(c3ccccc3)CC2)s1	ZINC000135675181	334136019	/nfs/dbraw/zinc/13/60/19/334136019.db2.gz	SSOILUMAVVWFBH-UHFFFAOYSA-N	1	0	296.439	4.436	20	30		CIEDRO
CC(C)(CCc1ccccc1)[NH2+]Cc1ccc(C#N)s1	ZINC000135691582	334136434	/nfs/dbraw/zinc/13/64/34/334136434.db2.gz	KJFFWINIDZOFOV-UHFFFAOYSA-N	1	0	284.428	4.121	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](c1ccccc1)c1ccc(F)cc1	ZINC000135749984	334138053	/nfs/dbraw/zinc/13/80/53/334138053.db2.gz	IMRUNZRZYFJTAH-RDTXWAMCSA-N	1	0	269.363	4.469	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(F)c(C#N)c1)c1cc2ccccc2o1	ZINC000136239387	334150574	/nfs/dbraw/zinc/15/05/74/334150574.db2.gz	OOQOJLAKRKRUIC-LBPRGKRZSA-N	1	0	294.329	4.294	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CCSC2(CCCCC2)C1	ZINC000079504010	334155838	/nfs/dbraw/zinc/15/58/38/334155838.db2.gz	HXBAEKGVZKMLEY-UHFFFAOYSA-N	1	0	280.481	4.068	20	30		CIEDRO
Cc1ccc([C@@H]2CC[N@H+](CCC(C)(C)C#N)C2)c(C)c1	ZINC000548755496	334170096	/nfs/dbraw/zinc/17/00/96/334170096.db2.gz	ZVROSJQLQGTNJZ-MRXNPFEDSA-N	1	0	270.420	4.033	20	30		CIEDRO
C[C@@H]1CCc2c(F)cccc2[C@H]1[NH2+]Cc1cccc(C#N)c1	ZINC000080339834	334170764	/nfs/dbraw/zinc/17/07/64/334170764.db2.gz	IUOQPIPJLTYDEW-YJYMSZOUSA-N	1	0	294.373	4.111	20	30		CIEDRO
Cc1cccc(CCC[NH2+][C@@H](C)c2ccc(C#N)cc2)c1	ZINC000548933405	334180628	/nfs/dbraw/zinc/18/06/28/334180628.db2.gz	STYAQXRBZVEVEZ-INIZCTEOSA-N	1	0	278.399	4.150	20	30		CIEDRO
Cc1ccc(CCC[NH2+][C@H](C)c2ccc(C#N)cc2)cc1	ZINC000548932870	334180710	/nfs/dbraw/zinc/18/07/10/334180710.db2.gz	GIFANGFRRBNMAF-MRXNPFEDSA-N	1	0	278.399	4.150	20	30		CIEDRO
CCc1ccccc1CC[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000548935947	334180944	/nfs/dbraw/zinc/18/09/44/334180944.db2.gz	CZYODEIWRMIQAX-HNNXBMFYSA-N	1	0	278.399	4.014	20	30		CIEDRO
C[C@H]1C[N@H+](CCCC(C)(C)C#N)CC[C@H]1c1ccccc1	ZINC000245408883	334190256	/nfs/dbraw/zinc/19/02/56/334190256.db2.gz	JNHJKEOTNSIVAH-FUHWJXTLSA-N	1	0	284.447	4.442	20	30		CIEDRO
CC[C@H]1C[N@H+](CCCCC#N)CC[C@H]1c1ccccc1	ZINC000245409286	334190439	/nfs/dbraw/zinc/19/04/39/334190439.db2.gz	LJLOTFALLCKUPC-FUHWJXTLSA-N	1	0	270.420	4.196	20	30		CIEDRO
C=CC[N@H+](Cc1cccs1)C[C@@H](OC)c1ccccc1	ZINC000549350524	334191068	/nfs/dbraw/zinc/19/10/68/334191068.db2.gz	ZRIDZPLIINCDSU-QGZVFWFLSA-N	1	0	287.428	4.124	20	30		CIEDRO
CC[C@H](C[N@H+](CC)[C@@H]1CC[C@H](C#N)C1)c1ccccc1	ZINC000549556470	334197725	/nfs/dbraw/zinc/19/77/25/334197725.db2.gz	YMPOYTCIKAJCBM-LZLYRXPVSA-N	1	0	270.420	4.194	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([N@@H+]2CCCC3(CCCCC3)CC2)C1	ZINC000549612630	334199709	/nfs/dbraw/zinc/19/97/09/334199709.db2.gz	ULQGFTIHDGLWLD-JKSUJKDBSA-N	1	0	260.425	4.115	20	30		CIEDRO
CC[N@H+](Cc1ccc2ccccc2c1)[C@@H]1CC[C@@H](C#N)C1	ZINC000549772093	334204457	/nfs/dbraw/zinc/20/44/57/334204457.db2.gz	FBNFQKSWKMFJMO-DNVCBOLYSA-N	1	0	278.399	4.354	20	30		CIEDRO
CC[N@H+](CC1(C)CCC1)[C@@H](C)c1ccc(C#N)cc1	ZINC000550711513	334227571	/nfs/dbraw/zinc/22/75/71/334227571.db2.gz	XWGZWCBCWQVMPC-AWEZNQCLSA-N	1	0	256.393	4.131	20	30		CIEDRO
CC[N@H+](C[C@H]1CCC(F)(F)C1)[C@@H](C)c1ccc(C#N)cc1	ZINC000551096979	334238670	/nfs/dbraw/zinc/23/86/70/334238670.db2.gz	YUUBLTDGSURFJZ-ZFWWWQNUSA-N	1	0	292.373	4.377	20	30		CIEDRO
C[C@H]([NH2+][C@@H](CCCC#N)c1ccccc1)c1ccoc1	ZINC000551205269	334240754	/nfs/dbraw/zinc/24/07/54/334240754.db2.gz	ISXKNMDQABBOFQ-YOEHRIQHSA-N	1	0	268.360	4.365	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](CCCC#N)c1ccccc1)c1ccoc1	ZINC000551205266	334240808	/nfs/dbraw/zinc/24/08/08/334240808.db2.gz	ISXKNMDQABBOFQ-PBHICJAKSA-N	1	0	268.360	4.365	20	30		CIEDRO
Cc1cc(Cl)ccc1C[NH2+]C1(c2cccc(C#N)c2)CC1	ZINC000551226995	334241466	/nfs/dbraw/zinc/24/14/66/334241466.db2.gz	YEGLPJCPJULUDP-UHFFFAOYSA-N	1	0	296.801	4.299	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@H](CO)C1CCCCC1)c1ccco1	ZINC000551273159	334244432	/nfs/dbraw/zinc/24/44/32/334244432.db2.gz	TZSKKYBCEXABOJ-IAGOWNOFSA-N	1	0	291.435	4.065	20	30		CIEDRO
C=CC[C@@H](C)[C@H](C)[NH2+]CCc1ccc(Cl)c(OC)c1	ZINC000551305039	334244949	/nfs/dbraw/zinc/24/49/49/334244949.db2.gz	SCSXPKHNCOJKQT-OLZOCXBDSA-N	1	0	281.827	4.081	20	30		CIEDRO
C[N@H+](CCc1cccc2ccccc21)CCC(C)(C)C#N	ZINC000551500549	334251679	/nfs/dbraw/zinc/25/16/79/334251679.db2.gz	KBAALKXETHORJT-UHFFFAOYSA-N	1	0	280.415	4.254	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+]C1(c2cccc(C#N)c2)CC1	ZINC000551559804	334254398	/nfs/dbraw/zinc/25/43/98/334254398.db2.gz	VQYUECIZQBTBGP-KRWDZBQOSA-N	1	0	268.404	4.272	20	30		CIEDRO
CC1(C)CCC([NH2+]C2(c3cccc(C#N)c3)CC2)CC1	ZINC000551813473	334262834	/nfs/dbraw/zinc/26/28/34/334262834.db2.gz	UJIKBGASQDEERX-UHFFFAOYSA-N	1	0	268.404	4.106	20	30		CIEDRO
C[C@@H](C[NH2+]C1(c2cccc(C#N)c2)CC1)Cc1ccccc1	ZINC000551832763	334263754	/nfs/dbraw/zinc/26/37/54/334263754.db2.gz	DQMPXLNQFIWSGO-MRXNPFEDSA-N	1	0	290.410	4.016	20	30		CIEDRO
C[C@@H]1CC[N@H+](Cc2cc(C#N)cs2)[C@@H]2CCCC[C@@H]12	ZINC000551974508	334268491	/nfs/dbraw/zinc/26/84/91/334268491.db2.gz	BTXBUDWPGWHJKJ-UHOFOFEASA-N	1	0	274.433	4.020	20	30		CIEDRO
CCC1(C[NH2+]Cc2cccc(OCCCC#N)c2)CCC1	ZINC000084056737	334269629	/nfs/dbraw/zinc/26/96/29/334269629.db2.gz	HJISURHURAIGDW-UHFFFAOYSA-N	1	0	286.419	4.039	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCc1csc(CC)n1)c1ccco1	ZINC000552045109	334280853	/nfs/dbraw/zinc/28/08/53/334280853.db2.gz	YICNRKTVBDCGNJ-CQSZACIVSA-N	1	0	290.432	4.138	20	30		CIEDRO
C[C@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)c1ccc(C#N)cc1	ZINC000247460990	334282068	/nfs/dbraw/zinc/28/20/68/334282068.db2.gz	QNZIVAMNLQPIFA-JVPBZIDWSA-N	1	0	276.383	4.013	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@H](C)c1ccc(OC)c(OC)c1C	ZINC000552055922	334282503	/nfs/dbraw/zinc/28/25/03/334282503.db2.gz	ILXJHIBKHZGELE-ZIAGYGMSSA-N	1	0	277.408	4.018	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H](C)c2sccc2C)cc1	ZINC000552091581	334288284	/nfs/dbraw/zinc/28/82/84/334288284.db2.gz	RXZITKQIVDZJQU-AWEZNQCLSA-N	1	0	287.428	4.472	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCc1cccc(OC)c1)c1ccco1	ZINC000552226163	334305416	/nfs/dbraw/zinc/30/54/16/334305416.db2.gz	WUPYRFSTBCAMCU-QGZVFWFLSA-N	1	0	285.387	4.128	20	30		CIEDRO
CCc1ccc([C@@H]2CC[N@H+](Cc3cc(C#N)cs3)C2)cc1	ZINC000552273409	334310933	/nfs/dbraw/zinc/31/09/33/334310933.db2.gz	ITRBJBBWXILPSH-QGZVFWFLSA-N	1	0	296.439	4.172	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@H]1CCCCS1)c1ccco1	ZINC000552281781	334312530	/nfs/dbraw/zinc/31/25/30/334312530.db2.gz	JQNJYXBJKJROCK-KGLIPLIRSA-N	1	0	265.422	4.162	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H]1CCO[C@H](CC(C)C)C1)c1ccco1	ZINC000552289607	334313616	/nfs/dbraw/zinc/31/36/16/334313616.db2.gz	CXGJEKGASHDKGR-ZACQAIPSSA-N	1	0	291.435	4.470	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@H]2CCC[C@H]2Cc2ccccc2)C1	ZINC000248752211	334315840	/nfs/dbraw/zinc/31/58/40/334315840.db2.gz	FXNFEYLOLGOTNT-XWSJACJDSA-N	1	0	282.431	4.070	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)c1cccc(OC(F)F)c1	ZINC000248813919	334317862	/nfs/dbraw/zinc/31/78/62/334317862.db2.gz	KSUHZNNOGJYHOQ-SCRDCRAPSA-N	1	0	294.345	4.021	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+][C@@H](c2ccccc2)C2CCC2)C1	ZINC000248811331	334317964	/nfs/dbraw/zinc/31/79/64/334317964.db2.gz	KOJXVNIRAWZCOK-OLMNPRSZSA-N	1	0	268.404	4.200	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)c1cccc(C(F)(F)F)c1	ZINC000248833717	334318985	/nfs/dbraw/zinc/31/89/85/334318985.db2.gz	MUZOHDMLIVFTPS-YWPYICTPSA-N	1	0	296.336	4.438	20	30		CIEDRO
CC1(C)C[C@H]([NH2+][C@@H]2CCC[C@@H](C#N)C2)c2ccccc21	ZINC000248839801	334319286	/nfs/dbraw/zinc/31/92/86/334319286.db2.gz	NOWFOKCSZOVIMW-CPUCHLNUSA-N	1	0	268.404	4.081	20	30		CIEDRO
CC1(C)C[C@H]([NH2+][C@H]2CCC[C@@H](C#N)C2)c2ccccc21	ZINC000248839803	334319381	/nfs/dbraw/zinc/31/93/81/334319381.db2.gz	NOWFOKCSZOVIMW-KEYYUXOJSA-N	1	0	268.404	4.081	20	30		CIEDRO
CC(C)[C@H](Cc1ccc(F)cc1)[NH2+][C@@H]1CCC[C@@H](C#N)C1	ZINC000248851725	334319721	/nfs/dbraw/zinc/31/97/21/334319721.db2.gz	OURNWESXJINHCQ-NXHRZFHOSA-N	1	0	288.410	4.065	20	30		CIEDRO
CC(C)[C@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)c1ccc(F)cc1F	ZINC000248867098	334320179	/nfs/dbraw/zinc/32/01/79/334320179.db2.gz	QFNRALHRJFBUTL-MRRJBJDNSA-N	1	0	292.373	4.334	20	30		CIEDRO
CC(C)[C@H](C[NH2+][C@H]1CCC[C@@H](C#N)C1)c1ccccc1	ZINC000248907244	334321615	/nfs/dbraw/zinc/32/16/15/334321615.db2.gz	UZAJRQHENOKDBR-NJAFHUGGSA-N	1	0	270.420	4.098	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+][C@@H](C)c1cnn(C(C)C)c1	ZINC000552756806	334344092	/nfs/dbraw/zinc/34/40/92/334344092.db2.gz	QENMENAJJGCEOT-CABCVRRESA-N	1	0	263.429	4.250	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+]Cc1ccc2ccccc2n1	ZINC000552944636	334352340	/nfs/dbraw/zinc/35/23/40/334352340.db2.gz	KOABLGRRPQSZEV-OAHLLOKOSA-N	1	0	268.404	4.459	20	30		CIEDRO
N#CCCCC[N@@H+]1CCCC[C@@H]1CCc1ccccc1	ZINC000090010559	334355485	/nfs/dbraw/zinc/35/54/85/334355485.db2.gz	LWPPIMNITQBJGU-GOSISDBHSA-N	1	0	270.420	4.168	20	30		CIEDRO
C=CCCOCC[NH2+][C@H](CC)c1ccc(Cl)s1	ZINC000090883637	334369003	/nfs/dbraw/zinc/36/90/03/334369003.db2.gz	LQVVMCQWMYMWGD-LLVKDONJSA-N	1	0	273.829	4.035	20	30		CIEDRO
N#CCCCC[NH2+][C@@H](c1ccccc1F)C1CCCC1	ZINC000091319637	334376328	/nfs/dbraw/zinc/37/63/28/334376328.db2.gz	SOXLEGKXBKMSAB-QGZVFWFLSA-N	1	0	274.383	4.340	20	30		CIEDRO
CC(C)[C@H]([NH2+]CCCCC#N)c1ccccc1Cl	ZINC000091319665	334376354	/nfs/dbraw/zinc/37/63/54/334376354.db2.gz	AKYDJZVAOBWSPR-HNNXBMFYSA-N	1	0	264.800	4.321	20	30		CIEDRO
Cc1ccccc1[C@@H]([NH2+]Cc1cc(C#N)ccc1F)C(C)C	ZINC000091376552	334377498	/nfs/dbraw/zinc/37/74/98/334377498.db2.gz	YPSSUBJAZMRWGE-IBGZPJMESA-N	1	0	296.389	4.493	20	30		CIEDRO
C[C@@H]([NH2+]CCCc1cccc(Cl)c1)c1cccc(C#N)c1	ZINC000553439342	334385388	/nfs/dbraw/zinc/38/53/88/334385388.db2.gz	WZPRQLXQQXRUGM-CQSZACIVSA-N	1	0	298.817	4.495	20	30		CIEDRO
CC[C@H](c1ccncc1)[N@H+](C)CC#Cc1ccc(Cl)cc1	ZINC000091993051	334390077	/nfs/dbraw/zinc/39/00/77/334390077.db2.gz	HXDRONMHYHLFTF-GOSISDBHSA-N	1	0	298.817	4.170	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+]C[C@H]1CCCC[C@H]1C(F)(F)F	ZINC000554073808	334409390	/nfs/dbraw/zinc/40/93/90/334409390.db2.gz	QUJKLGWUHSCTGS-JHJVBQTASA-N	1	0	263.347	4.299	20	30		CIEDRO
C=C(C)[C@H]([NH2+][C@@H]1CC[C@@H]1C1CC1)c1ccc(F)c(F)c1	ZINC000554095808	334412112	/nfs/dbraw/zinc/41/21/12/334412112.db2.gz	HDNPTUKDBNLLKN-XYPHTWIQSA-N	1	0	277.358	4.360	20	30		CIEDRO
C[C@@H]([NH2+]CC(C)(C)CCC#N)[C@H](C)c1ccccc1	ZINC000554358621	334424097	/nfs/dbraw/zinc/42/40/97/334424097.db2.gz	HQBCLHRMEDFRRH-LSDHHAIUSA-N	1	0	258.409	4.098	20	30		CIEDRO
CC[C@@H](CC#N)[NH2+]CC1CCC(c2ccccc2)CC1	ZINC000554862327	334457083	/nfs/dbraw/zinc/45/70/83/334457083.db2.gz	GKXIXMIGWJGCOY-VJFUWPCTSA-N	1	0	270.420	4.242	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@H]2C[C@H](c3ccccc3Cl)C2)c1	ZINC000555645619	334486005	/nfs/dbraw/zinc/48/60/05/334486005.db2.gz	MPRXWWNMBQAASS-WKILWMFISA-N	1	0	296.801	4.247	20	30		CIEDRO
C=CCCOCC[NH2+][C@@H](C)c1ccc(F)c2ccccc21	ZINC000556120228	334496399	/nfs/dbraw/zinc/49/63/99/334496399.db2.gz	MFVUBIDVJSXCHR-AWEZNQCLSA-N	1	0	287.378	4.222	20	30		CIEDRO
N#CCCC[C@@H]([NH2+][C@H]1CCC[C@H]2C[C@H]21)c1ccccc1	ZINC000556202159	334499634	/nfs/dbraw/zinc/49/96/34/334499634.db2.gz	IVCRMBRTUDVFRF-MLHJIOFPSA-N	1	0	268.404	4.200	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1C[C@H](c2ccc(F)cc2)C1)c1ccc(C#N)cc1	ZINC000556201765	334499720	/nfs/dbraw/zinc/49/97/20/334499720.db2.gz	IUEULAYFODDCIW-OMWUSAIZSA-N	1	0	294.373	4.294	20	30		CIEDRO
C[C@H]([NH2+]C1CC(C(C)(C)C)C1)c1ccc(C#N)cc1	ZINC000556222498	334501037	/nfs/dbraw/zinc/50/10/37/334501037.db2.gz	GWLXYOTZZVNMNE-JQRITLKVSA-N	1	0	256.393	4.034	20	30		CIEDRO
N#CCCCC[NH+]1CCC(c2ccnc3ccccc32)CC1	ZINC000565163429	334541850	/nfs/dbraw/zinc/54/18/50/334541850.db2.gz	LMAZZWVBNHMKDN-UHFFFAOYSA-N	1	0	293.414	4.108	20	30		CIEDRO
C[C@H](C[NH2+][C@@H]1CC[C@@H](C#N)C1)c1ccc(C(F)(F)F)cc1	ZINC000565682810	334587234	/nfs/dbraw/zinc/58/72/34/334587234.db2.gz	IDHJHURZECRALS-LALPHHSUSA-N	1	0	296.336	4.091	20	30		CIEDRO
Cc1ccccc1C[C@H](C)[NH2+][C@H]1CCc2ccc(C#N)cc21	ZINC000565979120	334613709	/nfs/dbraw/zinc/61/37/09/334613709.db2.gz	SSOKHFZBLKHGJW-YWZLYKJASA-N	1	0	290.410	4.075	20	30		CIEDRO
CCC[C@H]([NH2+]Cc1ccc(CC#N)cc1)c1ccsc1	ZINC000566737806	334662435	/nfs/dbraw/zinc/66/24/35/334662435.db2.gz	OTKASUHVMBOXFT-KRWDZBQOSA-N	1	0	284.428	4.445	20	30		CIEDRO
Cc1cc(Cl)cc(C)c1C[NH2+]Cc1ccc(CC#N)cc1	ZINC000566973419	334671611	/nfs/dbraw/zinc/67/16/11/334671611.db2.gz	VYPGFNWTWGJXBJ-UHFFFAOYSA-N	1	0	298.817	4.313	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCOC2(CCCCC2)C1)c1ccc(C#N)cc1	ZINC000268994146	334719265	/nfs/dbraw/zinc/71/92/65/334719265.db2.gz	VTSJSLUPHKLDRC-QAPCUYQASA-N	1	0	298.430	4.091	20	30		CIEDRO
N#CCC[C@@H](C#N)C[NH2+][C@H](c1cccc(F)c1)C1CCCC1	ZINC000567685082	334751848	/nfs/dbraw/zinc/75/18/48/334751848.db2.gz	VGUJJDOEPHLIAO-KSSFIOAISA-N	1	0	299.393	4.090	20	30		CIEDRO
N#CCc1ccc(C[NH2+][C@@H]2CCc3ccc(Cl)cc32)cc1	ZINC000567858196	334769250	/nfs/dbraw/zinc/76/92/50/334769250.db2.gz	XKCYTZINCOEYCQ-GOSISDBHSA-N	1	0	296.801	4.183	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@H](CC)c1ccc(OC)c(OC)c1	ZINC000343509551	335205832	/nfs/dbraw/zinc/20/58/32/335205832.db2.gz	RKYUCRHHHTYJJP-HUUCEWRRSA-N	1	0	277.408	4.099	20	30		CIEDRO
CC1(C)CCC[C@@H]1[NH2+]Cc1cccc(OCCCC#N)c1	ZINC000175868391	335211925	/nfs/dbraw/zinc/21/19/25/335211925.db2.gz	WVQJYHKUFFNEAK-KRWDZBQOSA-N	1	0	286.419	4.037	20	30		CIEDRO
C[C@H](c1cccc(C#N)c1)[N@@H+](C)[C@@H](C)Cc1ccsc1	ZINC000576631260	335227894	/nfs/dbraw/zinc/22/78/94/335227894.db2.gz	VQLCYVMQFNSHDJ-UONOGXRCSA-N	1	0	284.428	4.244	20	30		CIEDRO
C[C@H](Cc1ccsc1)[N@H+](C)[C@@H](C)c1cccc(C#N)c1	ZINC000576631259	335228012	/nfs/dbraw/zinc/22/80/12/335228012.db2.gz	VQLCYVMQFNSHDJ-KGLIPLIRSA-N	1	0	284.428	4.244	20	30		CIEDRO
C=CC[N@@H+](CCc1ccccc1)C[C@@H]1CCC(F)(F)C1	ZINC000576689526	335234718	/nfs/dbraw/zinc/23/47/18/335234718.db2.gz	NURKACKJFMMULL-MRXNPFEDSA-N	1	0	279.374	4.153	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](Cc1ccccc1Cl)C1CC1	ZINC000576722253	335240249	/nfs/dbraw/zinc/24/02/49/335240249.db2.gz	JXWZVZVRPHVXIS-BLLLJJGKSA-N	1	0	263.812	4.215	20	30		CIEDRO
Cc1ccc2c(c1)CC[C@H]2[NH2+][C@@H]1CCc2ccc(C#N)cc21	ZINC000577108561	335301428	/nfs/dbraw/zinc/30/14/28/335301428.db2.gz	XXEOISPDSDNLKC-WOJBJXKFSA-N	1	0	288.394	4.131	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C#N)s1)c1ccc(F)c(Cl)c1	ZINC000176954755	335344691	/nfs/dbraw/zinc/34/46/91/335344691.db2.gz	WKBOQKWDMDMQEN-SECBINFHSA-N	1	0	294.782	4.263	20	30		CIEDRO
C=CCC[NH2+][C@@H](C)c1ccc(Oc2cccnc2)cc1	ZINC000577538273	335366337	/nfs/dbraw/zinc/36/63/37/335366337.db2.gz	JIKUBGUJXOSLAG-AWEZNQCLSA-N	1	0	268.360	4.101	20	30		CIEDRO
Cc1cccc([C@H](C)[NH2+]Cc2cc(C#N)cs2)c1C	ZINC000177702400	335379938	/nfs/dbraw/zinc/37/99/38/335379938.db2.gz	RTQHLNGKUSTVAN-ZDUSSCGKSA-N	1	0	270.401	4.087	20	30		CIEDRO
N#CCCCC[NH2+][C@H](Cc1ccc(F)cc1)c1ccccc1	ZINC000577640390	335384736	/nfs/dbraw/zinc/38/47/36/335384736.db2.gz	DDAGMHHXJIGJFK-LJQANCHMSA-N	1	0	296.389	4.393	20	30		CIEDRO
C=CCSCC[NH2+][C@@H](C)c1cccc(-c2ccncc2)c1	ZINC000180457510	335585467	/nfs/dbraw/zinc/58/54/67/335585467.db2.gz	MJVGSULEHBUUDT-HNNXBMFYSA-N	1	0	298.455	4.318	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H](C)c1ccc(OC)c(OC)c1	ZINC000180878183	335627646	/nfs/dbraw/zinc/62/76/46/335627646.db2.gz	GAEDKIQYVJLHLP-ZIAGYGMSSA-N	1	0	277.408	4.099	20	30		CIEDRO
C[C@H](CC(C)(C)c1ccccc1)[NH2+]CCCCC#N	ZINC000181683406	335778311	/nfs/dbraw/zinc/77/83/11/335778311.db2.gz	SOSJXFNQIWQJAN-OAHLLOKOSA-N	1	0	258.409	4.026	20	30		CIEDRO
C[C@@H]([NH2+]C[C@@H](C)Cc1cccs1)c1ccc(C#N)cc1	ZINC000181817256	335786687	/nfs/dbraw/zinc/78/66/87/335786687.db2.gz	CUOSKHCGXGPHJT-UONOGXRCSA-N	1	0	284.428	4.149	20	30		CIEDRO
C=CCC[NH2+][C@H](C)c1cc2cccc(OCC)c2o1	ZINC000182657928	335834492	/nfs/dbraw/zinc/83/44/92/335834492.db2.gz	JPGXHBTZFRNTOK-GFCCVEGCSA-N	1	0	259.349	4.058	20	30		CIEDRO
N#Cc1cc(F)ccc1C[NH2+]C1(c2ccccc2)CCCC1	ZINC000183547659	335896973	/nfs/dbraw/zinc/89/69/73/335896973.db2.gz	RZTOFKQMCVHFFQ-UHFFFAOYSA-N	1	0	294.373	4.256	20	30		CIEDRO
N#CCCCC[NH2+][C@H](Cc1ccccc1)c1cccs1	ZINC000184975681	335943278	/nfs/dbraw/zinc/94/32/78/335943278.db2.gz	ORHXKWGCNFPOQD-MRXNPFEDSA-N	1	0	284.428	4.315	20	30		CIEDRO
Cc1ccsc1C[N@H+](C)CCCCC(C)(C)C#N	ZINC000380745975	336024606	/nfs/dbraw/zinc/02/46/06/336024606.db2.gz	RYZAJVGIQBGWPV-UHFFFAOYSA-N	1	0	264.438	4.208	20	30		CIEDRO
CC[C@H](C)C[N@H+](C)Cc1ccc(C#N)cc1C(F)(F)F	ZINC000581223493	336026448	/nfs/dbraw/zinc/02/64/48/336026448.db2.gz	RKRZNUBEONFJRE-NSHDSACASA-N	1	0	284.325	4.055	20	30		CIEDRO
C[C@@H]1C[C@@H](C(C)(C)C)CC[N@@H+]1CCCC(C)(C)C#N	ZINC000581241664	336029774	/nfs/dbraw/zinc/02/97/74/336029774.db2.gz	MOFXRAXWZHYPDH-CABCVRRESA-N	1	0	264.457	4.463	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]Cc1ccc(OC)c(Cl)c1	ZINC000380950283	336040725	/nfs/dbraw/zinc/04/07/25/336040725.db2.gz	PMSQKMORSHHPBW-UHFFFAOYSA-N	1	0	267.800	4.041	20	30		CIEDRO
C[C@@H](c1ccc(C(C)(C)C)cc1)[NH+]1CCC(C#N)CC1	ZINC000195411841	336053282	/nfs/dbraw/zinc/05/32/82/336053282.db2.gz	IBXFCSXAZLFBAB-AWEZNQCLSA-N	1	0	270.420	4.281	20	30		CIEDRO
C=CC[N@@H+](Cc1ccc(OC)c(OC)c1)C1CCCCC1	ZINC000195732986	336059249	/nfs/dbraw/zinc/05/92/49/336059249.db2.gz	HFTAIBFKQBPKNE-UHFFFAOYSA-N	1	0	289.419	4.025	20	30		CIEDRO
N#C[C@H]1CC[C@H]([N@@H+]2CCCC3(C2)CCCCCC3)C1	ZINC000581595879	336108988	/nfs/dbraw/zinc/10/89/88/336108988.db2.gz	ACCGXJLUAUCNQU-HOTGVXAUSA-N	1	0	260.425	4.115	20	30		CIEDRO
CC[C@H](CC#N)[NH2+][C@H]1C[C@H](c2ccccc2)C[C@H](C)C1	ZINC000383530511	336112478	/nfs/dbraw/zinc/11/24/78/336112478.db2.gz	AUOWQBLGNMVVIF-DZOHQFGASA-N	1	0	270.420	4.241	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@@H]2CCCCC23CCCC3)c1	ZINC000384057722	336121587	/nfs/dbraw/zinc/12/15/87/336121587.db2.gz	YCTPILGCZSZZCQ-QGZVFWFLSA-N	1	0	268.404	4.151	20	30		CIEDRO
CCC[N@H+](Cc1ccccc1)Cc1ccc(C#N)cc1F	ZINC000384395895	336124176	/nfs/dbraw/zinc/12/41/76/336124176.db2.gz	FPIVKTNQSQMFDT-UHFFFAOYSA-N	1	0	282.362	4.110	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H](C)c1ccc(OC)c(OC)c1C	ZINC000581889498	336160684	/nfs/dbraw/zinc/16/06/84/336160684.db2.gz	YILMKNXXGLMPOS-CQSZACIVSA-N	1	0	291.435	4.265	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000386792522	336179586	/nfs/dbraw/zinc/17/95/86/336179586.db2.gz	OOIMYYCCSRQLPP-NSHDSACASA-N	1	0	257.299	4.322	20	30		CIEDRO
C=C(C)CC[NH2+]Cc1csc(-c2ccc(F)cc2)n1	ZINC000387302781	336191092	/nfs/dbraw/zinc/19/10/92/336191092.db2.gz	ARDJRLJHSUOONC-UHFFFAOYSA-N	1	0	276.380	4.005	20	30		CIEDRO
CC[C@@H](C)[N@H+](Cc1ccccc1)Cc1cc(C#N)ccc1F	ZINC000387373157	336193217	/nfs/dbraw/zinc/19/32/17/336193217.db2.gz	MCOIQGZYMXOGIH-OAHLLOKOSA-N	1	0	296.389	4.498	20	30		CIEDRO
C[C@@H]1CC[C@H]([NH2+]Cc2ccc(C#N)s2)c2sccc21	ZINC000335022828	534257164	/nfs/dbraw/zinc/25/71/64/534257164.db2.gz	ZAJCJMWHPZAMCP-YGRLFVJLSA-N	1	0	288.441	4.409	20	30		CIEDRO
CC[C@H]([NH2+][C@@H](CC)c1ccc(C#N)cc1)c1c(C)noc1C	ZINC000447581252	517829940	/nfs/dbraw/zinc/82/99/40/517829940.db2.gz	SNWSELQTBHOTJU-IRXDYDNUSA-N	1	0	297.402	4.355	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H](C)c2ccsc2)cc1	ZINC000061361006	519035438	/nfs/dbraw/zinc/03/54/38/519035438.db2.gz	OKCUZYWETHPUAE-CYBMUJFWSA-N	1	0	273.401	4.164	20	30		CIEDRO
CCOc1cccc(C[NH2+][C@@H](CC)c2ccc(C#N)cc2)c1	ZINC000278328222	521370929	/nfs/dbraw/zinc/37/09/29/521370929.db2.gz	VXWIUENEHLPDOY-IBGZPJMESA-N	1	0	294.398	4.198	20	30		CIEDRO
CCOc1ccccc1[C@H](CC)[NH2+]Cc1cccc(C#N)c1	ZINC000101599402	521588709	/nfs/dbraw/zinc/58/87/09/521588709.db2.gz	KTHXYADZOBOVSG-SFHVURJKSA-N	1	0	294.398	4.198	20	30		CIEDRO
CCSCCC[NH2+][C@@H]1CCCCc2cc(C#N)ccc21	ZINC000337422353	521704929	/nfs/dbraw/zinc/70/49/29/521704929.db2.gz	RJIOLLDGWAHIRQ-QGZVFWFLSA-N	1	0	288.460	4.059	20	30		CIEDRO
CC[C@H]([NH2+]C1(c2ccccc2F)CC1)c1ccc(C#N)cc1	ZINC000278795703	522560233	/nfs/dbraw/zinc/56/02/33/522560233.db2.gz	QUGLAVPTMOOELK-SFHVURJKSA-N	1	0	294.373	4.427	20	30		CIEDRO
CC[C@H]([NH2+]C[C@H](C)c1ncc(C)s1)c1ccc(C#N)cc1	ZINC000278776437	522626644	/nfs/dbraw/zinc/62/66/44/522626644.db2.gz	PNMJFENHZXPXHA-LRDDRELGSA-N	1	0	299.443	4.168	20	30		CIEDRO
CC[C@H]([NH2+]C[C@H](C)c1c(C)noc1C)c1ccc(C#N)cc1	ZINC000278832982	522627104	/nfs/dbraw/zinc/62/71/04/522627104.db2.gz	UEIQKRYSXQMFBE-SJCJKPOMSA-N	1	0	297.402	4.008	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccccc1C)c1ccc(C#N)cc1	ZINC000278185939	522655977	/nfs/dbraw/zinc/65/59/77/522655977.db2.gz	DUASYZWYWQULHE-SFHVURJKSA-N	1	0	264.372	4.108	20	30		CIEDRO
CC[C@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)c1ccccc1O	ZINC000036991848	522695939	/nfs/dbraw/zinc/69/59/39/522695939.db2.gz	KSVRQXHOQMKFCY-GUYCJALGSA-N	1	0	280.371	4.066	20	30		CIEDRO
CC[C@H]([NH2+][C@H](C)c1cccc(C#N)c1)c1ccccc1	ZINC000051627098	522739063	/nfs/dbraw/zinc/73/90/63/522739063.db2.gz	NOTMDEAVFLIMNR-KDOFPFPSSA-N	1	0	264.372	4.360	20	30		CIEDRO
CC[C@H]([NH2+][C@H](C)c1cccc(C#N)c1)c1ccc(OC)cc1	ZINC000192999524	522739932	/nfs/dbraw/zinc/73/99/32/522739932.db2.gz	SXLWSHXGJBVLGI-KUHUBIRLSA-N	1	0	294.398	4.369	20	30		CIEDRO
CC[C@H]([NH2+][C@H](C)c1ccc(C#N)cc1)c1ccc(OC)cc1	ZINC000121842897	522740098	/nfs/dbraw/zinc/74/00/98/522740098.db2.gz	TUGRDTRMWZIMMU-KUHUBIRLSA-N	1	0	294.398	4.369	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccccc1C)c1ccc(C#N)cc1	ZINC000278185935	522883424	/nfs/dbraw/zinc/88/34/24/522883424.db2.gz	DUASYZWYWQULHE-GOSISDBHSA-N	1	0	264.372	4.108	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H]1CCCc2occc21)c1ccc(C#N)cc1	ZINC000278183441	522924745	/nfs/dbraw/zinc/92/47/45/522924745.db2.gz	DQQJZCQKLRFCEM-IAGOWNOFSA-N	1	0	280.371	4.270	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H]1CCOC2(CCCC2)C1)c1ccc(C#N)cc1	ZINC000278618448	522928121	/nfs/dbraw/zinc/92/81/21/522928121.db2.gz	GBPIAILKZRJTEA-QZTJIDSGSA-N	1	0	298.430	4.091	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H]1CCc2ccccc21)c1ccc(C#N)cc1	ZINC000278163486	522928527	/nfs/dbraw/zinc/92/85/27/522928527.db2.gz	BVAMAWXFRLUSCK-RTBURBONSA-N	1	0	276.383	4.286	20	30		CIEDRO
CC[C@@H]([NH2+][C@H](C)c1ccc(C#N)cc1)c1ccc(C#N)cc1	ZINC000278238284	522935627	/nfs/dbraw/zinc/93/56/27/522935627.db2.gz	LCPYDBRSDNXZRY-AUUYWEPGSA-N	1	0	289.382	4.232	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+]C(c2ccccc2)c2ccccc2)C1	ZINC000192588592	534748159	/nfs/dbraw/zinc/74/81/59/534748159.db2.gz	DSSNWSLCAFSWKJ-QFBILLFUSA-N	1	0	290.410	4.448	20	30		CIEDRO
Cc1cc(C[NH+](C)C)cc(N[C@H](C)c2cccc(C#N)c2)c1	ZINC000272064525	524657958	/nfs/dbraw/zinc/65/79/58/524657958.db2.gz	UMTQJTOESSYTJN-OAHLLOKOSA-N	1	0	293.414	4.101	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1)c1ccc(C#N)cc1	ZINC000035256422	525451135	/nfs/dbraw/zinc/45/11/35/525451135.db2.gz	GVTUZJOBGUOVIL-DCGLDWPTSA-N	1	0	280.371	4.125	20	30		CIEDRO
C[C@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)c1ccsc1	ZINC000050341520	525528325	/nfs/dbraw/zinc/52/83/25/525528325.db2.gz	VHLKNJZTPBSYTK-RYUDHWBXSA-N	1	0	256.374	4.032	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCCc2ccccc21)c1cccc(C#N)c1	ZINC000037230737	525564207	/nfs/dbraw/zinc/56/42/07/525564207.db2.gz	MMHLGGFTDPMPQT-IFXJQAMLSA-N	1	0	276.383	4.286	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCCc2ccccc21)c1ccc(C#N)cc1	ZINC000020133547	525564871	/nfs/dbraw/zinc/56/48/71/525564871.db2.gz	CHFYLKUWFUXQIH-IFXJQAMLSA-N	1	0	276.383	4.286	20	30		CIEDRO
C[C@@H](c1cccc(Cl)c1)[N@H+](C)CCCCC#N	ZINC000061559621	526071489	/nfs/dbraw/zinc/07/14/89/526071489.db2.gz	MTXBCNXOOIEOCQ-LBPRGKRZSA-N	1	0	250.773	4.027	20	30		CIEDRO
Cc1ccc2c(c1)[C@@H]([NH2+][C@H](C)c1ccc(C#N)cc1)CC2	ZINC000097988419	526193822	/nfs/dbraw/zinc/19/38/22/526193822.db2.gz	PALZNZOUGJZRKP-KUHUBIRLSA-N	1	0	276.383	4.205	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)c1ccccc1Br	ZINC000168055375	526455754	/nfs/dbraw/zinc/45/57/54/526455754.db2.gz	KCBWMVPFANNPSA-LLVKDONJSA-N	1	0	268.198	4.066	20	30		CIEDRO
C=CCOCCC[N@H+](Cc1ccoc1)C1CCCCC1	ZINC000348050255	526749304	/nfs/dbraw/zinc/74/93/04/526749304.db2.gz	LXUYBVDNPHDAFG-UHFFFAOYSA-N	1	0	277.408	4.007	20	30		CIEDRO
C=C(C)[C@@H](Nc1cc[nH+]c(C)c1)c1ccc(F)c(F)c1	ZINC000302346693	526757745	/nfs/dbraw/zinc/75/77/45/526757745.db2.gz	AMIGYUWYBQLSKS-MRXNPFEDSA-N	1	0	274.314	4.398	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+][C@H](C)c1ccccc1SC	ZINC000442850405	526803011	/nfs/dbraw/zinc/80/30/11/526803011.db2.gz	CWMIMGZCVLKRQZ-KEYYUXOJSA-N	1	0	291.460	4.040	20	30		CIEDRO
C=CCOc1ccc(C[N@H+](C(C)C)C2CCC2)cc1OC	ZINC000353778293	526861965	/nfs/dbraw/zinc/86/19/65/526861965.db2.gz	CRVFTAYPCCYDAR-UHFFFAOYSA-N	1	0	289.419	4.023	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H]1C[C@H](c2cc(F)cc(F)c2)C1	ZINC000367198762	527001916	/nfs/dbraw/zinc/00/19/16/527001916.db2.gz	FTQYIUIZRZYANT-SAZUREKKSA-N	1	0	292.373	4.130	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+]C[C@@H]1CCO[C@H]1c1ccccc1	ZINC000191854290	527467745	/nfs/dbraw/zinc/46/77/45/527467745.db2.gz	KZGKDKZHRPOYII-FHWLQOOXSA-N	1	0	287.447	4.489	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCCCSC)c1ccco1	ZINC000353531101	527484101	/nfs/dbraw/zinc/48/41/01/527484101.db2.gz	UHAUEEHZVOPGMA-ZDUSSCGKSA-N	1	0	253.411	4.020	20	30		CIEDRO
CC(C)CC[C@H]([NH2+]Cc1cccc(C#N)c1)c1ccoc1	ZINC000353436720	527848707	/nfs/dbraw/zinc/84/87/07/527848707.db2.gz	PZVTYAXFENJSBD-SFHVURJKSA-N	1	0	282.387	4.418	20	30		CIEDRO
CC[N@H+](Cc1cccc(OCCCC#N)c1)[C@@H](C)C(C)C	ZINC000352817598	528816292	/nfs/dbraw/zinc/81/62/92/528816292.db2.gz	RCWJDCAONRZTEP-INIZCTEOSA-N	1	0	288.435	4.236	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H]1CCCc2cc(C#N)ccc21)c1ccncc1	ZINC000341703281	535808267	/nfs/dbraw/zinc/80/82/67/535808267.db2.gz	YAKUJZPQJXXVBJ-RTBURBONSA-N	1	0	291.398	4.072	20	30		CIEDRO
CC[C@H]([NH2+]CCCC#N)c1ccc(Cl)c(Cl)c1	ZINC000346839418	529595380	/nfs/dbraw/zinc/59/53/80/529595380.db2.gz	SRUWKWBWBNUVRD-ZDUSSCGKSA-N	1	0	271.191	4.338	20	30		CIEDRO
C=C[C@@H](C)[NH2+][C@@H]1CCSc2c(Cl)cccc21	ZINC000119360841	267324811	/nfs/dbraw/zinc/32/48/11/267324811.db2.gz	RILQVBMMCJGOLZ-BXKDBHETSA-N	1	0	253.798	4.041	20	30		CIEDRO
C[C@H](CCC(C)(C)C)[NH2+]C1CCC(C)(C#N)CC1	ZINC000449155318	260260425	/nfs/dbraw/zinc/26/04/25/260260425.db2.gz	BCOFBXPDAMIDAB-VQCLRJIVSA-N	1	0	250.430	4.263	20	30		CIEDRO
N#Cc1ccc(C[NH2+]C2CCCCCC2)c(C(F)(F)F)c1	ZINC000574563383	335029549	/nfs/dbraw/zinc/02/95/49/335029549.db2.gz	LGJKOZPGHVSLGM-UHFFFAOYSA-N	1	0	296.336	4.389	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H](C)c2ccc(C)o2)cc1	ZINC000034993647	260003374	/nfs/dbraw/zinc/00/33/74/260003374.db2.gz	MZYLJBSOYBFTES-AWEZNQCLSA-N	1	0	271.360	4.004	20	30		CIEDRO
C=CCSCC[NH2+][C@H]1C[C@@H](C)Sc2sccc21	ZINC000336701654	262381568	/nfs/dbraw/zinc/38/15/68/262381568.db2.gz	RWPOEFSSIABIBQ-PWSUYJOCSA-N	1	0	285.503	4.182	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+]C[C@H]2CCCC[C@H]2C(F)(F)F)C1	ZINC000447583199	260064068	/nfs/dbraw/zinc/06/40/68/260064068.db2.gz	AWQVZXFZQAYPIS-YIYPIFLZSA-N	1	0	288.357	4.027	20	30		CIEDRO
COCCCC[C@@H]([NH2+]CCC(C)(C)C#N)c1ccccc1	ZINC000347075227	533272234	/nfs/dbraw/zinc/27/22/34/533272234.db2.gz	GTMTVZWFKDYYSG-QGZVFWFLSA-N	1	0	288.435	4.074	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CSc2ccccc21)c1ccc(C#N)c(F)c1	ZINC000335960478	533529921	/nfs/dbraw/zinc/52/99/21/533529921.db2.gz	DZVSPIYAPPLLFH-BDJLRTHQSA-N	1	0	298.386	4.195	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CSc2ccccc21)c1ccc(C#N)c(F)c1	ZINC000335960479	533549088	/nfs/dbraw/zinc/54/90/88/533549088.db2.gz	DZVSPIYAPPLLFH-BZNIZROVSA-N	1	0	298.386	4.195	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCCc2cc(C#N)ccc21)c1ccccc1	ZINC000341749994	130019584	/nfs/dbraw/zinc/01/95/84/130019584.db2.gz	DTGXIVSUGJMGFP-LIRRHRJNSA-N	1	0	276.383	4.286	20	30		CIEDRO
C[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CCCc2cc(C#N)ccc21	ZINC000341756598	130024739	/nfs/dbraw/zinc/02/47/39/130024739.db2.gz	FVBGKLAEKDHSLG-JEBQAFNWSA-N	1	0	268.404	4.104	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCCc2cc(C#N)ccc21)c1ccccc1F	ZINC000341756199	130024942	/nfs/dbraw/zinc/02/49/42/130024942.db2.gz	DCUWKCITAWIKSW-ORAYPTAESA-N	1	0	294.373	4.426	20	30		CIEDRO
N#Cc1ccc2c(c1)CCC[C@H]2[NH2+]Cc1ccccc1Cl	ZINC000341759503	130025673	/nfs/dbraw/zinc/02/56/73/130025673.db2.gz	VXQKNPJXPLKTLN-GOSISDBHSA-N	1	0	296.801	4.379	20	30		CIEDRO
N#Cc1ccc2c(c1)CCC[C@@H]2[NH2+]Cc1ccc(F)c(F)c1	ZINC000341758639	130025689	/nfs/dbraw/zinc/02/56/89/130025689.db2.gz	CFCDAUMSMUUSPN-SFHVURJKSA-N	1	0	298.336	4.004	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCCc2cc(C#N)ccc21)c1cccc(F)c1	ZINC000341762411	130027869	/nfs/dbraw/zinc/02/78/69/130027869.db2.gz	VLXHYYMQPICYCG-BFUOFWGJSA-N	1	0	294.373	4.426	20	30		CIEDRO
C[C@@H]([NH2+][C@H](C)c1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000020095475	170994895	/nfs/dbraw/zinc/99/48/95/170994895.db2.gz	XEEIVVWRIKNLIC-CHWSQXEVSA-N	1	0	268.335	4.109	20	30		CIEDRO
N#Cc1cccc(C[N@@H+]2CCCCC[C@@H]2c2ccco2)c1	ZINC000078831116	177395294	/nfs/dbraw/zinc/39/52/94/177395294.db2.gz	XRUJJSYRYXSNDI-QGZVFWFLSA-N	1	0	280.371	4.269	20	30		CIEDRO
C[C@H]1CCCC[C@H]1CC[NH2+]CC(C)(C)CCC#N	ZINC000344373717	225054031	/nfs/dbraw/zinc/05/40/31/225054031.db2.gz	IJUUXXMSGQZCGX-GJZGRUSLSA-N	1	0	250.430	4.122	20	30		CIEDRO
N#Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(Cl)s1)CC2	ZINC000334842032	225334029	/nfs/dbraw/zinc/33/40/29/225334029.db2.gz	NDELPLOTZYQUTG-CQSZACIVSA-N	1	0	288.803	4.050	20	30		CIEDRO
C[C@@H]1CC[C@H]([NH2+][C@@H](CCC#N)c2ccccc2)[C@@H](C)C1	ZINC000346638990	225864932	/nfs/dbraw/zinc/86/49/32/225864932.db2.gz	QEXZCVAWLWIRMI-FZCLSBEQSA-N	1	0	270.420	4.446	20	30		CIEDRO
N#Cc1ccc2c(c1)CCCC[C@H]2[NH2+]CCC1(F)CCC1	ZINC000348314832	226443886	/nfs/dbraw/zinc/44/38/86/226443886.db2.gz	HNQYQLGUTJIDSE-QGZVFWFLSA-N	1	0	286.394	4.198	20	30		CIEDRO
N#Cc1ccccc1C[NH2+]C1(c2ccc(F)cc2)CCCC1	ZINC000171694001	335074986	/nfs/dbraw/zinc/07/49/86/335074986.db2.gz	IUXJCHRCYXPYAV-UHFFFAOYSA-N	1	0	294.373	4.256	20	30		CIEDRO
N#CCCC[N@@H+](Cc1ccccc1C(F)(F)F)CC1CC1	ZINC000352562339	227068289	/nfs/dbraw/zinc/06/82/89/227068289.db2.gz	JQDOOWOFDZXVQL-UHFFFAOYSA-N	1	0	296.336	4.221	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]C1CC(c2cc(F)cc(F)c2)C1	ZINC000575218078	335083066	/nfs/dbraw/zinc/08/30/66/335083066.db2.gz	QKBMARMZGFJZPC-DSSZZKGTSA-N	1	0	265.347	4.155	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+]Cc2cccc3ccccc32)C1	ZINC000192779086	227287872	/nfs/dbraw/zinc/28/78/72/227287872.db2.gz	PXYMMJUHQHGSKE-PBHICJAKSA-N	1	0	264.372	4.012	20	30		CIEDRO
N#Cc1ccc2c(c1)[C@@H]([NH2+][C@@H]1CCCc3ccccc31)CC2	ZINC000353320554	228085159	/nfs/dbraw/zinc/08/51/59/228085159.db2.gz	BGZUFVCVZKBIHY-UXHICEINSA-N	1	0	288.394	4.213	20	30		CIEDRO
N#CCCCC[NH+]1CCC([C@@H](F)c2ccccc2F)CC1	ZINC000367152297	228092385	/nfs/dbraw/zinc/09/23/85/228092385.db2.gz	TUQPWHHRTJMTCL-QGZVFWFLSA-N	1	0	292.373	4.242	20	30		CIEDRO
N#Cc1ccc2c(c1)[C@H]([NH2+][C@H]1CCCc3sccc31)CC2	ZINC000353640346	228136933	/nfs/dbraw/zinc/13/69/33/228136933.db2.gz	ULLBALBECFLWGY-DLBZAZTESA-N	1	0	294.423	4.274	20	30		CIEDRO
C[C@]1(c2ccccc2)CCC[N@H+](CCCCC#N)CC1	ZINC000352219678	228200712	/nfs/dbraw/zinc/20/07/12/228200712.db2.gz	FCCYHIYYVYNQPF-SFHVURJKSA-N	1	0	270.420	4.124	20	30		CIEDRO
CC(C)CC[C@@H](C)[NH2+][C@@H](C)c1ccc(C#N)cc1F	ZINC000512621243	260023419	/nfs/dbraw/zinc/02/34/19/260023419.db2.gz	VSUHJZMIPYHMNW-OLZOCXBDSA-N	1	0	262.372	4.173	20	30		CIEDRO
Cc1cc(C)cc([C@H]2CCC[C@H]2[NH2+]CCCCC#N)c1	ZINC000367480797	260066432	/nfs/dbraw/zinc/06/64/32/260066432.db2.gz	NNWOPPQIDFHUMD-QZTJIDSGSA-N	1	0	270.420	4.223	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCSc2ccccc21)c1cccc(C#N)c1	ZINC000037316086	260085526	/nfs/dbraw/zinc/08/55/26/260085526.db2.gz	JNSGJPCVKLXRJH-CXAGYDPISA-N	1	0	294.423	4.446	20	30		CIEDRO
CC(C)(C#N)CCC[NH+]1CCC(Cc2ccccc2)CC1	ZINC000087608457	260192261	/nfs/dbraw/zinc/19/22/61/260192261.db2.gz	BTJVOUHYQYESRM-UHFFFAOYSA-N	1	0	284.447	4.271	20	30		CIEDRO
N#CCCCC[NH+]1CCC(c2nc3ccccc3s2)CC1	ZINC000057590736	260225523	/nfs/dbraw/zinc/22/55/23/260225523.db2.gz	QIVVPSFJIVBSMT-UHFFFAOYSA-N	1	0	299.443	4.170	20	30		CIEDRO
C[C@H](c1ccc(Cl)cc1)[N@H+](C)CCCCC#N	ZINC000061559612	260233383	/nfs/dbraw/zinc/23/33/83/260233383.db2.gz	ZBKRLRDEKUFJRK-GFCCVEGCSA-N	1	0	250.773	4.027	20	30		CIEDRO
C=C(CC)C[NH2+][C@H](C)c1ccccc1Br	ZINC000088162636	260278759	/nfs/dbraw/zinc/27/87/59/260278759.db2.gz	OJCOPJWJUJTUNZ-LLVKDONJSA-N	1	0	268.198	4.066	20	30		CIEDRO
C=C(CC)C[NH2+][C@H](CC(F)(F)F)c1ccccc1	ZINC000313482132	260297953	/nfs/dbraw/zinc/29/79/53/260297953.db2.gz	LVVQFTMDSZGUTP-CYBMUJFWSA-N	1	0	257.299	4.236	20	30		CIEDRO
C[C@@H]([NH2+]Cc1cccc(C#N)c1F)c1cccc(Cl)c1	ZINC000223594107	260333262	/nfs/dbraw/zinc/33/32/62/260333262.db2.gz	HPJKTXNKMOYSKM-LLVKDONJSA-N	1	0	288.753	4.202	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H](C)Cc2ccccc2F)cc1	ZINC000518263398	260362995	/nfs/dbraw/zinc/36/29/95/260362995.db2.gz	MMFWAWNSWZUKPA-OAHLLOKOSA-N	1	0	299.389	4.111	20	30		CIEDRO
C=C(C)C[NH2+][C@@H](C)C(c1ccccc1)c1ccccc1	ZINC000131672960	260409398	/nfs/dbraw/zinc/40/93/98/260409398.db2.gz	UTLXBJHWWWRPCH-INIZCTEOSA-N	1	0	265.400	4.373	20	30		CIEDRO
COc1ccccc1[C@@H]([NH2+]CCCCC#N)C1CCCC1	ZINC000091319599	260474102	/nfs/dbraw/zinc/47/41/02/260474102.db2.gz	DYFQZGPNDKCTRE-SFHVURJKSA-N	1	0	286.419	4.210	20	30		CIEDRO
N#CCCCC[NH2+]Cc1ccc(-c2ccccc2)s1	ZINC000237817204	260707304	/nfs/dbraw/zinc/70/73/04/260707304.db2.gz	VOJCFFLPLZDGAP-UHFFFAOYSA-N	1	0	270.401	4.199	20	30		CIEDRO
CCC1(CC)[C@H]([NH2+]CCCCC(C)(C)C#N)[C@H](C)[C@@H]1OC	ZINC000444699170	261107891	/nfs/dbraw/zinc/10/78/91/261107891.db2.gz	MRZXDIFHPPVOOL-XHSDSOJGSA-N	1	0	294.483	4.136	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](C)c1cc(Br)ccc1F	ZINC000161657091	261109377	/nfs/dbraw/zinc/10/93/77/261109377.db2.gz	OSBSOQRQRNJHAH-NXEZZACHSA-N	1	0	286.188	4.203	20	30		CIEDRO
C[C@H]([NH2+]Cc1cccc(OCCCC#N)c1)C1CCCC1	ZINC000172173743	261152619	/nfs/dbraw/zinc/15/26/19/261152619.db2.gz	PIWFSLRSNCYSHN-HNNXBMFYSA-N	1	0	286.419	4.037	20	30		CIEDRO
C=CCCOCC[NH2+]CC(c1ccccc1)c1ccccc1	ZINC000318460117	261205207	/nfs/dbraw/zinc/20/52/07/261205207.db2.gz	HTVKAKNZBKWQCR-UHFFFAOYSA-N	1	0	295.426	4.001	20	30		CIEDRO
Cc1ccc([C@H]2CCC[N@@H+]2CCCCC#N)cc1C	ZINC000102398116	261232417	/nfs/dbraw/zinc/23/24/17/261232417.db2.gz	WYCQLSDBYCPAND-QGZVFWFLSA-N	1	0	256.393	4.134	20	30		CIEDRO
CC(C)(CCC#N)C[N@@H+]1CCC[C@@H]1c1cccs1	ZINC000162721547	261292156	/nfs/dbraw/zinc/29/21/56/261292156.db2.gz	BEWWQQIVMALUNJ-CYBMUJFWSA-N	1	0	262.422	4.215	20	30		CIEDRO
CCc1noc(C)c1C[N@@H+](CC)[C@H](C)c1ccc(C#N)cc1	ZINC000162906521	261298329	/nfs/dbraw/zinc/29/83/29/261298329.db2.gz	RIRVHGTXTAFEKZ-CYBMUJFWSA-N	1	0	297.402	4.000	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1cccc(-c2ccccn2)c1	ZINC000466386423	261399029	/nfs/dbraw/zinc/39/90/29/261399029.db2.gz	CRGGLTCJXNNLHL-QGZVFWFLSA-N	1	0	266.388	4.193	20	30		CIEDRO
C[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccccc1C(C)(C)C#N	ZINC000460350409	261521412	/nfs/dbraw/zinc/52/14/12/261521412.db2.gz	UMTOTNPPTRSHDF-PBHICJAKSA-N	1	0	270.420	4.156	20	30		CIEDRO
C[C@H]([NH2+]CCCC(C)(C)C#N)c1cccc(OC(F)F)c1	ZINC000179578124	261799175	/nfs/dbraw/zinc/79/91/75/261799175.db2.gz	RKEXMHSMKFPVHE-LBPRGKRZSA-N	1	0	296.361	4.269	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)c1sc(C(C)C)nc1C	ZINC000180950098	261879810	/nfs/dbraw/zinc/87/98/10/261879810.db2.gz	VWRKGDXPAANYSM-QWRGUYRKSA-N	1	0	252.427	4.190	20	30		CIEDRO
CC(C)C[C@H]([NH2+]CCCSCC#N)c1ccccc1	ZINC000181802163	261911549	/nfs/dbraw/zinc/91/15/49/261911549.db2.gz	JAKCAQZDVZPVQD-INIZCTEOSA-N	1	0	276.449	4.010	20	30		CIEDRO
Cc1cncc([C@H](C)[NH2+][C@H](CCC#N)c2ccccc2)c1	ZINC000184419437	262019958	/nfs/dbraw/zinc/01/99/58/262019958.db2.gz	GDJAETUZTFKHCF-MAUKXSAKSA-N	1	0	279.387	4.086	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H](Nc2cccc(C[NH+]3CCCCC3)c2)C1	ZINC000185726877	262068544	/nfs/dbraw/zinc/06/85/44/262068544.db2.gz	WUEQGWYVONVUQP-SJLPKXTDSA-N	1	0	297.446	4.167	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+][C@@H]2CCSc3c(F)cccc32)C1	ZINC000185771842	262069693	/nfs/dbraw/zinc/06/96/93/262069693.db2.gz	NUEPCBPISCEVFQ-YWPYICTPSA-N	1	0	290.407	4.035	20	30		CIEDRO
Cc1cc([C@H](C)[NH2+][C@H]2CCC[C@H](C#N)C2)c(C)s1	ZINC000185770132	262069899	/nfs/dbraw/zinc/06/98/99/262069899.db2.gz	BXGNBTKOSQNECK-UBHSHLNASA-N	1	0	262.422	4.098	20	30		CIEDRO
Cc1ccc([C@H](C)[NH2+][C@@H](CCC#N)c2ccccc2)c(O)c1	ZINC000186151068	262081834	/nfs/dbraw/zinc/08/18/34/262081834.db2.gz	LBFDLNCNJHDHAI-YJBOKZPZSA-N	1	0	294.398	4.396	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCc1ccc(F)cc1)c1ccco1	ZINC000514085100	262152079	/nfs/dbraw/zinc/15/20/79/262152079.db2.gz	SZEVZJHZJLEQFV-INIZCTEOSA-N	1	0	273.351	4.258	20	30		CIEDRO
CC[N@H+](CCOc1ccccc1)[C@@H](C)c1ccc(C#N)cc1	ZINC000497593589	262179249	/nfs/dbraw/zinc/17/92/49/262179249.db2.gz	FNDYBTUETVEVNE-INIZCTEOSA-N	1	0	294.398	4.020	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@@H](C)c1cc2cccc(OC)c2o1	ZINC000393805900	262190812	/nfs/dbraw/zinc/19/08/12/262190812.db2.gz	WOUSRBZBHXAXJT-GXTWGEPZSA-N	1	0	273.376	4.447	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+][C@@H]2CCSc3ccc(F)cc32)C1	ZINC000192750298	262210090	/nfs/dbraw/zinc/21/00/90/262210090.db2.gz	YBXFQYCPZGEAJS-NJZAAPMLSA-N	1	0	290.407	4.035	20	30		CIEDRO
C=CCC[C@@H](NCCC[N@H+]1CCCC[C@@H]1C)c1ccco1	ZINC000514089647	262215073	/nfs/dbraw/zinc/21/50/73/262215073.db2.gz	QKSBXDABSGZGSU-DLBZAZTESA-N	1	0	290.451	4.141	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@H](C)c1ccccc1OC(F)F	ZINC000393820952	262215767	/nfs/dbraw/zinc/21/57/67/262215767.db2.gz	KQZIJJMWPSLAES-VXGBXAGGSA-N	1	0	269.335	4.293	20	30		CIEDRO
Cc1ccc(C[NH+]2CCCC2)cc1N[C@H]1CCC[C@@H](C#N)C1	ZINC000193268954	262219728	/nfs/dbraw/zinc/21/97/28/262219728.db2.gz	NMKQUSICQOLLBV-AEFFLSMTSA-N	1	0	297.446	4.085	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@H](C)c1ccc(OC(F)F)cc1	ZINC000393829512	262230854	/nfs/dbraw/zinc/23/08/54/262230854.db2.gz	UJNFVHCZMZQNBU-DGCLKSJQSA-N	1	0	269.335	4.293	20	30		CIEDRO
CC[C@@H](CC#N)[NH2+][C@H](C)CC(C)(C)c1ccccc1	ZINC000054183663	262259724	/nfs/dbraw/zinc/25/97/24/262259724.db2.gz	FJLPNDPEZDPFBJ-ZBFHGGJFSA-N	1	0	258.409	4.025	20	30		CIEDRO
CC(C)[C@@H](C[NH2+]Cc1cccc(C#N)c1)c1ccccc1	ZINC000221792903	262297178	/nfs/dbraw/zinc/29/71/78/262297178.db2.gz	FCYRGUALGPBMJT-LJQANCHMSA-N	1	0	278.399	4.088	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)c1ccc(F)cc1Cl	ZINC000185839926	262310061	/nfs/dbraw/zinc/31/00/61/262310061.db2.gz	YOFSOOZKAJAKFT-GMXVVIOVSA-N	1	0	280.774	4.212	20	30		CIEDRO
C[N@H+](CC#Cc1ccccc1)[C@H]1CCCC[C@H]1C(F)(F)F	ZINC000463445529	262324405	/nfs/dbraw/zinc/32/44/05/262324405.db2.gz	UQCISBHOHHOQSR-CVEARBPZSA-N	1	0	295.348	4.091	20	30		CIEDRO
Cc1ccc([C@H]([NH2+]Cc2cccc(C#N)c2)C2CCC2)cc1	ZINC000186987763	262332933	/nfs/dbraw/zinc/33/29/33/262332933.db2.gz	ATUBKVMUPLSHFJ-HXUWFJFHSA-N	1	0	290.410	4.498	20	30		CIEDRO
C=CCCOCC[NH2+][C@@H](C)c1ccc2cc(OC)ccc2c1	ZINC000319928711	262378606	/nfs/dbraw/zinc/37/86/06/262378606.db2.gz	HNEREHJYMHYJKG-HNNXBMFYSA-N	1	0	299.414	4.092	20	30		CIEDRO
CC[C@H]([NH2+]CCC1(C#N)CCCCC1)c1nccs1	ZINC000411516204	262697213	/nfs/dbraw/zinc/69/72/13/262697213.db2.gz	JJWPSOIACJUBNL-ZDUSSCGKSA-N	1	0	277.437	4.048	20	30		CIEDRO
C[C@H](CCC#N)[NH2+][C@@H](C)[C@H](C)c1ccccc1C(F)(F)F	ZINC000411518996	262697308	/nfs/dbraw/zinc/69/73/08/262697308.db2.gz	QUQATTYCKCMSAC-AGIUHOORSA-N	1	0	298.352	4.479	20	30		CIEDRO
C[C@@H]([NH2+]C1(C2CCC2)CCC1)c1ccc(C#N)cc1F	ZINC000414170902	262813530	/nfs/dbraw/zinc/81/35/30/262813530.db2.gz	CQSBWVAZMDHTCA-GFCCVEGCSA-N	1	0	272.367	4.071	20	30		CIEDRO
N#CCC1(C[NH2+][C@H]2CC[C@H](c3cccc(Cl)c3)C2)CC1	ZINC000414156874	262818390	/nfs/dbraw/zinc/81/83/90/262818390.db2.gz	VKHBWVRPQWOCNA-HOCLYGCPSA-N	1	0	288.822	4.260	20	30		CIEDRO
CC[C@H]([NH2+]CC(C)(C)CC#N)c1ccc(Cl)cc1	ZINC000414159840	262818704	/nfs/dbraw/zinc/81/87/04/262818704.db2.gz	CBSXJMFESCINRQ-AWEZNQCLSA-N	1	0	264.800	4.321	20	30		CIEDRO
C=CC[C@H](Cc1ccccc1)[NH2+][C@H](C)c1cncc(F)c1	ZINC000414310574	262841045	/nfs/dbraw/zinc/84/10/45/262841045.db2.gz	WHYWACVWYFRNND-RDTXWAMCSA-N	1	0	284.378	4.059	20	30		CIEDRO
C=CC[C@H](Cc1ccccc1)[NH2+]Cc1cn(C(C)C)nc1C	ZINC000414534730	262986366	/nfs/dbraw/zinc/98/63/66/262986366.db2.gz	KEMQWAGGDSORBL-LJQANCHMSA-N	1	0	297.446	4.049	20	30		CIEDRO
N#CCCCC[NH2+][C@@H]1CC=C(c2ccc(F)cc2)CC1	ZINC000272396364	263003961	/nfs/dbraw/zinc/00/39/61/263003961.db2.gz	WVFPGTGOHHXCJA-QGZVFWFLSA-N	1	0	272.367	4.045	20	30		CIEDRO
CC1(C#N)CC[NH+](Cc2ccc(-c3ccccc3F)o2)CC1	ZINC000272541990	263006101	/nfs/dbraw/zinc/00/61/01/263006101.db2.gz	PHFUYMUVFUGHHE-UHFFFAOYSA-N	1	0	298.361	4.211	20	30		CIEDRO
CC1(C#N)CC[NH+](Cc2cccc(OC3CCCC3)c2)CC1	ZINC000272541996	263006217	/nfs/dbraw/zinc/00/62/17/263006217.db2.gz	PIDASYWDOBFXNL-UHFFFAOYSA-N	1	0	298.430	4.134	20	30		CIEDRO
C[C@@H]([NH2+]CCC(C)(C)C#N)c1cc2ccccc2o1	ZINC000273259088	263014339	/nfs/dbraw/zinc/01/43/39/263014339.db2.gz	HYSOFUFCEOFLGN-GFCCVEGCSA-N	1	0	256.349	4.023	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc(Cl)s1	ZINC000274659174	263029071	/nfs/dbraw/zinc/02/90/71/263029071.db2.gz	VHUCGTFIUAEXPD-AXFHLTTASA-N	1	0	268.813	4.134	20	30		CIEDRO
C[C@H](CCC#N)[NH2+][C@@H](C)c1cccc(Cl)c1Cl	ZINC000276319179	263036034	/nfs/dbraw/zinc/03/60/34/263036034.db2.gz	OEDDKAJFOOLRLS-ZJUUUORDSA-N	1	0	271.191	4.336	20	30		CIEDRO
C[C@H]([NH2+]CCCCC(C)(C)C#N)c1ccc(F)cc1F	ZINC000277664283	263042886	/nfs/dbraw/zinc/04/28/86/263042886.db2.gz	JFWJKTFCJPLCFQ-LBPRGKRZSA-N	1	0	280.362	4.335	20	30		CIEDRO
CC(C)(C#N)CCCC[N@@H+]1CCCC[C@H]1c1nccs1	ZINC000277838049	263043711	/nfs/dbraw/zinc/04/37/11/263043711.db2.gz	WQIFZBGUUBUKNE-AWEZNQCLSA-N	1	0	291.464	4.390	20	30		CIEDRO
C[N@H+](Cc1csc2ccccc12)[C@H]1CC[C@@H](C#N)C1	ZINC000278569839	263049193	/nfs/dbraw/zinc/04/91/93/263049193.db2.gz	JEFAOESQPYMKKN-OCCSQVGLSA-N	1	0	270.401	4.025	20	30		CIEDRO
C[C@@H]([NH2+]CCCCC(C)(C)C#N)c1c(F)cccc1F	ZINC000278824075	263051183	/nfs/dbraw/zinc/05/11/83/263051183.db2.gz	PWRMZKYOCBQQJR-GFCCVEGCSA-N	1	0	280.362	4.335	20	30		CIEDRO
CSc1ccc([C@@H](C)[NH2+][C@H]2CCC[C@@H](C#N)C2)cc1	ZINC000281824136	263072040	/nfs/dbraw/zinc/07/20/40/263072040.db2.gz	ZVMUYWLAAFEKCO-NFAWXSAZSA-N	1	0	274.433	4.141	20	30		CIEDRO
CSc1ccc([C@@H](C)[NH2+]CC2CCC(C#N)CC2)cc1	ZINC000282193986	263075053	/nfs/dbraw/zinc/07/50/53/263075053.db2.gz	GJTTXSDHTOWTNF-WLYUNCDWSA-N	1	0	288.460	4.389	20	30		CIEDRO
C[C@@H]([NH2+]CC1CCC(C#N)CC1)c1cccc(Cl)c1	ZINC000282250199	263075425	/nfs/dbraw/zinc/07/54/25/263075425.db2.gz	GOXAZRJCHGKLRB-IYXRBSQSSA-N	1	0	276.811	4.321	20	30		CIEDRO
C[C@H](c1ccccc1)[C@H](C)[NH2+]CC1CCC(C#N)CC1	ZINC000282328094	263075946	/nfs/dbraw/zinc/07/59/46/263075946.db2.gz	NYMABBQPRXGPGT-JUVOFCAFSA-N	1	0	270.420	4.098	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@@H](C#N)C1)c1ccc(C(F)(F)F)cc1	ZINC000282520459	263077221	/nfs/dbraw/zinc/07/72/21/263077221.db2.gz	ZOSCHZOWZFFRCC-MISXGVKJSA-N	1	0	282.309	4.048	20	30		CIEDRO
Cc1cc(C[NH2+][C@H](CCC#N)c2ccccc2)cc(C)c1O	ZINC000290425118	263116576	/nfs/dbraw/zinc/11/65/76/263116576.db2.gz	RHQBGWPNHUCPLR-GOSISDBHSA-N	1	0	294.398	4.144	20	30		CIEDRO
Cc1cncc([C@@H](C)[NH2+][C@H](CCCC#N)c2ccccc2)c1	ZINC000340438018	263147656	/nfs/dbraw/zinc/14/76/56/263147656.db2.gz	XYRXXEGMIZJWJO-VQIMIIECSA-N	1	0	293.414	4.476	20	30		CIEDRO
Cc1cncc([C@@H](C)[NH2+][C@@H](CCCC#N)c2ccccc2)c1	ZINC000340438009	263147801	/nfs/dbraw/zinc/14/78/01/263147801.db2.gz	XYRXXEGMIZJWJO-APWZRJJASA-N	1	0	293.414	4.476	20	30		CIEDRO
C[C@H]([NH2+][C@H](CCCC#N)c1ccccc1)c1cncs1	ZINC000340445905	263152466	/nfs/dbraw/zinc/15/24/66/263152466.db2.gz	MDFQIMSZMLYUIS-DZGCQCFKSA-N	1	0	285.416	4.229	20	30		CIEDRO
C[C@@H]([NH2+][C@H](CCCC#N)c1ccccc1)c1cncc(F)c1	ZINC000340446007	263152517	/nfs/dbraw/zinc/15/25/17/263152517.db2.gz	MWBVVLRKNQZOTR-RDTXWAMCSA-N	1	0	297.377	4.306	20	30		CIEDRO
C[C@H]([NH2+][C@@H](CCCC#N)c1ccccc1)c1ccncc1F	ZINC000340449717	263155592	/nfs/dbraw/zinc/15/55/92/263155592.db2.gz	WBRUCBMCUPGSCF-KSSFIOAISA-N	1	0	297.377	4.306	20	30		CIEDRO
COC[C@@H](CC(C)C)[NH2+][C@H](CCCC#N)c1ccccc1	ZINC000340451103	263156052	/nfs/dbraw/zinc/15/60/52/263156052.db2.gz	ZXTXHAZAANXTEK-QZTJIDSGSA-N	1	0	288.435	4.072	20	30		CIEDRO
CC(C)[C@H](C[NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccccc1	ZINC000294925142	263169524	/nfs/dbraw/zinc/16/95/24/263169524.db2.gz	BDAAYNQDHSKYKL-SZMVWBNQSA-N	1	0	270.420	4.098	20	30		CIEDRO
C[C@@]1(c2ccccc2)CC[C@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)C1	ZINC000295059388	263171445	/nfs/dbraw/zinc/17/14/45/263171445.db2.gz	OCXGZGGVWINQBS-DSLXNQLJSA-N	1	0	282.431	4.169	20	30		CIEDRO
C[C@@H](CC(C)(C)c1ccccc1)[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000295116644	263172754	/nfs/dbraw/zinc/17/27/54/263172754.db2.gz	VYUJDXMGCOZNRF-BQFCYCMXSA-N	1	0	284.447	4.415	20	30		CIEDRO
CSc1ccccc1C[C@H](C)[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000295140028	263173012	/nfs/dbraw/zinc/17/30/12/263173012.db2.gz	ZLLDWTRVMYNIGX-DZKIICNBSA-N	1	0	288.460	4.011	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1cnc2ccsc2c1	ZINC000296442738	263191713	/nfs/dbraw/zinc/19/17/13/263191713.db2.gz	MJLQLUKYZFVDQG-DYEKYZERSA-N	1	0	285.416	4.029	20	30		CIEDRO
CC(C)[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccc(F)c(F)c1	ZINC000296512362	263192430	/nfs/dbraw/zinc/19/24/30/263192430.db2.gz	PMTYISDYVHSDKP-RVSPLBMKSA-N	1	0	292.373	4.334	20	30		CIEDRO
COc1cccc2cc([C@H](C)[NH2+][C@H]3CC[C@@H](CC#N)C3)oc21	ZINC000296569948	263192903	/nfs/dbraw/zinc/19/29/03/263192903.db2.gz	SWGPYXMVXBQPQT-YDHLFZDLSA-N	1	0	298.386	4.174	20	30		CIEDRO
Cc1nc(C(C)C)sc1[C@@H](C)[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000296653722	263194730	/nfs/dbraw/zinc/19/47/30/263194730.db2.gz	ZBSKDMFGFCEPJK-XBFCOCLRSA-N	1	0	291.464	4.308	20	30		CIEDRO
CC[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1cccc(C)c1	ZINC000296655977	263194759	/nfs/dbraw/zinc/19/47/59/263194759.db2.gz	ZIEGLRRHBDLYTB-BHYGNILZSA-N	1	0	256.393	4.118	20	30		CIEDRO
C[C@H](c1ccc(C[NH+]2CCC(C#N)CC2)cc1)C(F)(F)F	ZINC000297058401	263200612	/nfs/dbraw/zinc/20/06/12/263200612.db2.gz	IVANHLHLEKPVPK-GFCCVEGCSA-N	1	0	296.336	4.088	20	30		CIEDRO
C[C@H](CCC#N)[NH2+][C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000298459574	263219952	/nfs/dbraw/zinc/21/99/52/263219952.db2.gz	IBPWIXUEEQZSKP-GHMZBOCLSA-N	1	0	270.298	4.048	20	30		CIEDRO
COc1ccc2oc([C@@H](C)[NH2+][C@H](C)CCC#N)c(C)c2c1	ZINC000299154984	263232925	/nfs/dbraw/zinc/23/29/25/263232925.db2.gz	XCWJMBRZRNCAKL-DGCLKSJQSA-N	1	0	286.375	4.093	20	30		CIEDRO
CC[C@@H]([NH2+][C@H](C)CCC#N)c1ccccc1OC(F)F	ZINC000299733117	263254052	/nfs/dbraw/zinc/25/40/52/263254052.db2.gz	YGPVXPBOYKAPSW-DGCLKSJQSA-N	1	0	282.334	4.021	20	30		CIEDRO
C[C@H](CCC#N)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000299733975	263254502	/nfs/dbraw/zinc/25/45/02/263254502.db2.gz	ZEJXPOCOPQTJOX-MNOVXSKESA-N	1	0	270.298	4.048	20	30		CIEDRO
COc1ccc(C[N@H+](C)[C@H](C)c2cccc(C#N)c2)cc1C	ZINC000187669266	263266446	/nfs/dbraw/zinc/26/64/46/263266446.db2.gz	JLXFIERGNBTQKL-OAHLLOKOSA-N	1	0	294.398	4.068	20	30		CIEDRO
C[C@H]([NH2+]CCCC#N)c1ccccc1OCc1ccccc1	ZINC000341596643	263343681	/nfs/dbraw/zinc/34/36/81/263343681.db2.gz	XWDSCLVZHKWEHQ-INIZCTEOSA-N	1	0	294.398	4.220	20	30		CIEDRO
CC(C)(C)C[C@@H]([NH2+]CCCSCC#N)c1ccccc1	ZINC000341596243	263344061	/nfs/dbraw/zinc/34/40/61/263344061.db2.gz	MOPMXGKXXKFZJR-MRXNPFEDSA-N	1	0	290.476	4.400	20	30		CIEDRO
C[C@H]([NH2+]CCCC#N)c1ccccc1Oc1ccccc1	ZINC000341642773	263345474	/nfs/dbraw/zinc/34/54/74/263345474.db2.gz	PJGYPYMCXSHBLS-HNNXBMFYSA-N	1	0	280.371	4.433	20	30		CIEDRO
COc1ccc(Cl)cc1[C@@H](CC(C)C)[NH2+]CCCC#N	ZINC000341846829	263358496	/nfs/dbraw/zinc/35/84/96/263358496.db2.gz	NBNUPMIHCAZIPR-OAHLLOKOSA-N	1	0	294.826	4.329	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1cccc(C#N)c1F)c1ccccc1	ZINC000341938598	263367148	/nfs/dbraw/zinc/36/71/48/263367148.db2.gz	DCIVOIMZNBORPD-SFHVURJKSA-N	1	0	294.373	4.494	20	30		CIEDRO
CC1(C#N)CC[NH+](Cc2c(Cl)ccc3cccnc32)CC1	ZINC000334314742	263574926	/nfs/dbraw/zinc/57/49/26/263574926.db2.gz	MNMCRMBDBJHKRA-UHFFFAOYSA-N	1	0	299.805	4.014	20	30		CIEDRO
C=CC[C@@H]1[N@H+](Cc2cncn2C(C)C)CCCC1(C)C	ZINC000425335997	264011564	/nfs/dbraw/zinc/01/15/64/264011564.db2.gz	JQCOHQBQOQFMLH-INIZCTEOSA-N	1	0	275.440	4.031	20	30		CIEDRO
COc1cc(C[N@H+](C)[C@@H](C)c2cccc(C#N)c2)ccc1C	ZINC000425365084	264211321	/nfs/dbraw/zinc/21/13/21/264211321.db2.gz	IREDJDMGBYWDNS-HNNXBMFYSA-N	1	0	294.398	4.068	20	30		CIEDRO
N#CCCCC[NH2+]Cc1cc(Cl)cc(C(F)(F)F)c1	ZINC000189141909	264272810	/nfs/dbraw/zinc/27/28/10/264272810.db2.gz	SHFSQUKCKPKVEV-UHFFFAOYSA-N	1	0	290.716	4.142	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](C)c1ccc(Br)s1	ZINC000161638446	264293003	/nfs/dbraw/zinc/29/30/03/264293003.db2.gz	DVPAETQVYDNJSV-BDAKNGLRSA-N	1	0	274.227	4.126	20	30		CIEDRO
C=CCC[C@@H]([NH2+][C@@H]1CCCc2c1cnn2C)c1ccccc1	ZINC000090580590	264409969	/nfs/dbraw/zinc/40/99/69/264409969.db2.gz	OXEBOBGIFGFAFR-QZTJIDSGSA-N	1	0	295.430	4.095	20	30		CIEDRO
C=C(C)C[N@H+](CCCCn1ccnc1C)Cc1ccccc1	ZINC000348243111	265147111	/nfs/dbraw/zinc/14/71/11/265147111.db2.gz	RYFBOMJHTQPBFX-UHFFFAOYSA-N	1	0	297.446	4.050	20	30		CIEDRO
C=C(C)C[N@H+](Cc1sc(C)nc1C)Cc1ccccc1	ZINC000348242284	265147565	/nfs/dbraw/zinc/14/75/65/265147565.db2.gz	RBCHSXZSJHWTIP-UHFFFAOYSA-N	1	0	286.444	4.338	20	30		CIEDRO
CC(C)[C@@H]([NH2+]Cc1cc(C#N)cs1)c1ccc(F)cc1	ZINC000093492200	265182022	/nfs/dbraw/zinc/18/20/22/265182022.db2.gz	PMTAXZCIBTTXIP-MRXNPFEDSA-N	1	0	288.391	4.246	20	30		CIEDRO
CC(C)C[C@@H]([NH2+]Cc1cc(C#N)cs1)c1ccccc1	ZINC000093492140	265182412	/nfs/dbraw/zinc/18/24/12/265182412.db2.gz	VFGDHKSSPDFGQM-QGZVFWFLSA-N	1	0	284.428	4.497	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C2CC2)cc1)c1ccc(C#N)cc1	ZINC000094518598	265247265	/nfs/dbraw/zinc/24/72/65/265247265.db2.gz	PQZISZPOGRZNOZ-CQSZACIVSA-N	1	0	276.383	4.286	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]Cc1cscc1C(F)(F)F	ZINC000352888447	265986014	/nfs/dbraw/zinc/98/60/14/265986014.db2.gz	HAERCSXBXGVNRH-UHFFFAOYSA-N	1	0	290.354	4.186	20	30		CIEDRO
C=CCC[C@H]([NH2+]CC[C@@H]1CCCCO1)c1ccccc1	ZINC000356931526	266212376	/nfs/dbraw/zinc/21/23/76/266212376.db2.gz	WWXLJBWRUYIHDC-ROUUACIJSA-N	1	0	273.420	4.243	20	30		CIEDRO
C=CCSCC[NH2+][C@H]1CCSc2c(Cl)cccc21	ZINC000358023961	266399308	/nfs/dbraw/zinc/39/93/08/266399308.db2.gz	LYABPMHXLYDHQZ-ZDUSSCGKSA-N	1	0	299.892	4.386	20	30		CIEDRO
C=CCSCC[NH2+][C@H]1CCCOc2cc(C)c(C)cc21	ZINC000358022162	266399693	/nfs/dbraw/zinc/39/96/93/266399693.db2.gz	IDNQRNMWNMDQEP-INIZCTEOSA-N	1	0	291.460	4.026	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCCc2ccccc21)c1ccc(C#N)cc1F	ZINC000358559087	266476775	/nfs/dbraw/zinc/47/67/75/266476775.db2.gz	OMCUKAGHCKQGFV-DJJJIMSYSA-N	1	0	294.373	4.426	20	30		CIEDRO
CC[C@H](CSC)[NH2+][C@H]1CCCCc2cc(C#N)ccc21	ZINC000360649756	266731052	/nfs/dbraw/zinc/73/10/52/266731052.db2.gz	WAHRMSRMNPOCJL-WBVHZDCISA-N	1	0	288.460	4.057	20	30		CIEDRO
N#Cc1ccc2c(c1)CCCC[C@@H]2[NH2+]Cc1cccs1	ZINC000360819002	266744909	/nfs/dbraw/zinc/74/49/09/266744909.db2.gz	GOYBBRIRLUSMTB-KRWDZBQOSA-N	1	0	282.412	4.177	20	30		CIEDRO
Cc1ccc(NC2CC[NH+](CC(C)(C)CCC#N)CC2)cc1	ZINC000362617554	267024659	/nfs/dbraw/zinc/02/46/59/267024659.db2.gz	QLXMGWBBDZZKRE-UHFFFAOYSA-N	1	0	299.462	4.201	20	30		CIEDRO
Cc1cc(C[N@@H+]2CCC[C@@H]2c2ccsc2)ccc1C#N	ZINC000362965665	267068077	/nfs/dbraw/zinc/06/80/77/267068077.db2.gz	CXBGGEDAJSQFCY-QGZVFWFLSA-N	1	0	282.412	4.265	20	30		CIEDRO
COc1cccc(C2=CC[N@H+](CCCC(C)(C)C#N)CC2)c1	ZINC000370002576	267283385	/nfs/dbraw/zinc/28/33/85/267283385.db2.gz	QNACZVZCOQZNTO-UHFFFAOYSA-N	1	0	298.430	4.114	20	30		CIEDRO
N#CC1(C[NH2+][C@H]2CC[C@@H](c3ccc(Cl)cc3)C2)CCC1	ZINC000418144411	267365487	/nfs/dbraw/zinc/36/54/87/267365487.db2.gz	TXJTZNAFNKWXNU-ZBFHGGJFSA-N	1	0	288.822	4.260	20	30		CIEDRO
N#Cc1cccc(C[N@@H+]2CCCCC[C@H]2c2ccncc2)c1	ZINC000120168459	267388486	/nfs/dbraw/zinc/38/84/86/267388486.db2.gz	MCJMHMQRNILEHM-IBGZPJMESA-N	1	0	291.398	4.071	20	30		CIEDRO
N#CCCCC[NH+]1CCC(F)(c2ccccc2Cl)CC1	ZINC000376674408	268007892	/nfs/dbraw/zinc/00/78/92/268007892.db2.gz	UTZQSOBNLHNWKK-UHFFFAOYSA-N	1	0	294.801	4.294	20	30		CIEDRO
CC[N@H+](CCCC#N)[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000123296786	268022154	/nfs/dbraw/zinc/02/21/54/268022154.db2.gz	HORSGXUUMQSENP-GFCCVEGCSA-N	1	0	284.325	4.392	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H]1CC[C@@H](c2ccccc2F)C1	ZINC000377089191	268046406	/nfs/dbraw/zinc/04/64/06/268046406.db2.gz	GPCSBMILVNPKOR-CABCVRRESA-N	1	0	288.410	4.381	20	30		CIEDRO
COc1cc(C[NH2+][C@@H](C)c2ccc(C)c(C)c2)ccc1C#N	ZINC000570863847	327628634	/nfs/dbraw/zinc/62/86/34/327628634.db2.gz	YYSIZKZCBGBAIR-HNNXBMFYSA-N	1	0	294.398	4.035	20	30		CIEDRO
C=CC[C@@H](CO)[NH2+][C@H](C)c1ccc(-c2cccs2)cc1	ZINC000186683725	327700386	/nfs/dbraw/zinc/70/03/86/327700386.db2.gz	LLBOVSFZMLWISK-CJNGLKHVSA-N	1	0	287.428	4.003	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@@H](C)c1ccc(Cl)c(F)c1	ZINC000580180670	327722638	/nfs/dbraw/zinc/72/26/38/327722638.db2.gz	PGGVWLRNFCEBNP-GHJWDPDVSA-N	1	0	297.801	4.111	20	30		CIEDRO
CC[C@H]([NH2+]CCCCC#N)c1cccc(Br)c1	ZINC000178648543	327795346	/nfs/dbraw/zinc/79/53/46/327795346.db2.gz	GKFBNONJNSAEBH-AWEZNQCLSA-N	1	0	295.224	4.184	20	30		CIEDRO
C=CC[C@@H](C)[C@H](C)[NH2+]CC#Cc1ccc(C(F)(F)F)cc1	ZINC000537985312	327810883	/nfs/dbraw/zinc/81/08/83/327810883.db2.gz	ZCMQUUFTBZWVHP-KGLIPLIRSA-N	1	0	295.348	4.247	20	30		CIEDRO
CC(C)Oc1ccc([C@H](C)[NH2+]CCCC(C)(C)C#N)cc1	ZINC000182628711	327814533	/nfs/dbraw/zinc/81/45/33/327814533.db2.gz	LPWIALSOXCUULW-HNNXBMFYSA-N	1	0	288.435	4.454	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H](C)CC2CC2)cc1Cl	ZINC000497326071	327859358	/nfs/dbraw/zinc/85/93/58/327859358.db2.gz	NYZXESGYAKXWEN-LBPRGKRZSA-N	1	0	279.811	4.183	20	30		CIEDRO
N#Cc1csc(C[NH2+][C@@H]2CC[C@H]3CCCC[C@@H]3C2)c1	ZINC000531356325	327901112	/nfs/dbraw/zinc/90/11/12/327901112.db2.gz	OMXIDPNPGMVIMZ-RBSFLKMASA-N	1	0	274.433	4.068	20	30		CIEDRO
C=C[C@@H](C)[NH2+][C@H]1CCSc2ccc(Cl)cc21	ZINC000119334080	327898908	/nfs/dbraw/zinc/89/89/08/327898908.db2.gz	QTCZZFQRGFIHQS-SKDRFNHKSA-N	1	0	253.798	4.041	20	30		CIEDRO
C=C(CC)C[NH2+][C@@H](C)c1ccc(OC)c(Br)c1	ZINC000313532866	327924811	/nfs/dbraw/zinc/92/48/11/327924811.db2.gz	HTQPSZUZSIUZGA-NSHDSACASA-N	1	0	298.224	4.075	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@H]1CCCO[C@H]1c1ccc(C)cc1	ZINC000531723964	328023272	/nfs/dbraw/zinc/02/32/72/328023272.db2.gz	AYDIDBSTRPJNOJ-CAMMJAKZSA-N	1	0	287.447	4.405	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)[C@H](C)c1ccccc1	ZINC000531695432	328025210	/nfs/dbraw/zinc/02/52/10/328025210.db2.gz	UEIHVHGJHOCDFJ-XHSDSOJGSA-N	1	0	278.399	4.401	20	30		CIEDRO
C[C@H]([NH2+][C@@H](C)[C@@H](C)c1ccccc1)c1ccc(C#N)cc1	ZINC000531695431	328025330	/nfs/dbraw/zinc/02/53/30/328025330.db2.gz	UEIHVHGJHOCDFJ-PMPSAXMXSA-N	1	0	278.399	4.401	20	30		CIEDRO
N#Cc1cccc(C[NH2+]Cc2csc3ccccc23)c1	ZINC000048068588	328040801	/nfs/dbraw/zinc/04/08/01/328040801.db2.gz	FFAMPDDUGLGYKC-UHFFFAOYSA-N	1	0	278.380	4.063	20	30		CIEDRO
N#CCCCC[NH2+][C@H]1CCCc2ccc(Cl)cc21	ZINC000534238706	328041300	/nfs/dbraw/zinc/04/13/00/328041300.db2.gz	RUHARNIFYGVBOD-HNNXBMFYSA-N	1	0	262.784	4.001	20	30		CIEDRO
N#CCCCC[NH2+][C@@H]1CCCc2ccc(Cl)cc21	ZINC000534238710	328041475	/nfs/dbraw/zinc/04/14/75/328041475.db2.gz	RUHARNIFYGVBOD-OAHLLOKOSA-N	1	0	262.784	4.001	20	30		CIEDRO
C=CCOc1ccccc1C[N@@H+](Cc1ccccn1)C(C)C	ZINC000534347065	328047209	/nfs/dbraw/zinc/04/72/09/328047209.db2.gz	LGLPBXSKUDPBDN-UHFFFAOYSA-N	1	0	296.414	4.057	20	30		CIEDRO
C=CCCC[NH2+]C(C)(C)c1cccc(C(F)(F)F)c1	ZINC000563475955	328068620	/nfs/dbraw/zinc/06/86/20/328068620.db2.gz	IYGBKTPNNCQIHA-UHFFFAOYSA-N	1	0	271.326	4.496	20	30		CIEDRO
C=C(C)C[NH+](CC)[C@@H](C)C(=O)Nc1cccc2ccccc21	ZINC000216166787	328115411	/nfs/dbraw/zinc/11/54/11/328115411.db2.gz	LSZIRASJWPQUDK-HNNXBMFYSA-N	1	0	296.414	4.065	20	30		CIEDRO
C=CCC[NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CC1	ZINC000571540015	328133254	/nfs/dbraw/zinc/13/32/54/328133254.db2.gz	MMFNFPSFOLSQKC-CQSZACIVSA-N	1	0	269.310	4.322	20	30		CIEDRO
C=CC[C@@H](Cc1ccccc1)[NH2+][C@H](C)c1ccco1	ZINC000414306803	328154376	/nfs/dbraw/zinc/15/43/76/328154376.db2.gz	RERRBCVQKOHIKK-ZBFHGGJFSA-N	1	0	255.361	4.118	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+][C@H](CC)c1ccc(Cl)s1	ZINC000436305630	328155618	/nfs/dbraw/zinc/15/56/18/328155618.db2.gz	IQBNSTDCEDCODI-ZOWXZIJZSA-N	1	0	299.867	4.423	20	30		CIEDRO
N#CCC[C@@H]([NH2+][C@@H]1CCc2c1cccc2F)c1ccccc1	ZINC000271532189	328196878	/nfs/dbraw/zinc/19/68/78/328196878.db2.gz	RGVAEFAXBNIWLN-RTBURBONSA-N	1	0	294.373	4.448	20	30		CIEDRO
C[C@H]([NH2+]CCCC(C)(C)C#N)c1ccccc1OC(F)F	ZINC000271630288	328197142	/nfs/dbraw/zinc/19/71/42/328197142.db2.gz	BGMUUPOCCIWTDI-LBPRGKRZSA-N	1	0	296.361	4.269	20	30		CIEDRO
C[C@@H](CCC#N)[NH+]1CCC(c2nc3ccccc3s2)CC1	ZINC000276346349	328217552	/nfs/dbraw/zinc/21/75/52/328217552.db2.gz	VFKMUYKUIUULMC-ZDUSSCGKSA-N	1	0	299.443	4.168	20	30		CIEDRO
COc1ccc(C)cc1[C@H](C)[NH2+]CCCCC(C)(C)C#N	ZINC000277744517	328222294	/nfs/dbraw/zinc/22/22/94/328222294.db2.gz	PDGQSKPPKDYARH-HNNXBMFYSA-N	1	0	288.435	4.374	20	30		CIEDRO
N#C[C@@H]1CC[C@@H](N2CCc3cc(Cl)cc(Cl)c3C2)C1	ZINC000278627778	328228671	/nfs/dbraw/zinc/22/86/71/328228671.db2.gz	NWJCKKPXQFMKSX-ZWNOBZJWSA-N	1	0	295.213	4.044	20	30		CIEDRO
CCc1nc([C@H](C)[NH2+]CCCCC(C)(C)C#N)cs1	ZINC000278634560	328228933	/nfs/dbraw/zinc/22/89/33/328228933.db2.gz	GOPXMVOMJQJBCA-LBPRGKRZSA-N	1	0	279.453	4.076	20	30		CIEDRO
COc1ccc(F)cc1[C@H](C)[NH2+]CCCCC(C)(C)C#N	ZINC000278807903	328230615	/nfs/dbraw/zinc/23/06/15/328230615.db2.gz	PAYLWQGZBUNGCX-ZDUSSCGKSA-N	1	0	292.398	4.205	20	30		CIEDRO
CC1=CC[C@@H]([NH2+][C@H](CCC#N)c2ccccc2)CC1	ZINC000293565767	328276810	/nfs/dbraw/zinc/27/68/10/328276810.db2.gz	IMBIHCLPEMULOZ-IAGOWNOFSA-N	1	0	254.377	4.120	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([N@H+]2[C@@H]3CC[C@H]2C[C@@H](c2ccccc2)C3)C1	ZINC000294345401	328280190	/nfs/dbraw/zinc/28/01/90/328280190.db2.gz	ZCTBVVRBZOGYTE-RXABAKJHSA-N	1	0	280.415	4.089	20	30		CIEDRO
C[C@@H](C[NH2+][C@H]1CC[C@@H](CC#N)C1)c1cccc(Cl)c1	ZINC000294996798	328284186	/nfs/dbraw/zinc/28/41/86/328284186.db2.gz	IATQOAOLDSVUGC-XEZPLFJOSA-N	1	0	276.811	4.115	20	30		CIEDRO
COc1ccc([C@@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)C(C)C)cc1	ZINC000295849739	328287440	/nfs/dbraw/zinc/28/74/40/328287440.db2.gz	AXFKGOBZOXFSDD-ZVZYQTTQSA-N	1	0	286.419	4.064	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccc2ccccc2c1O	ZINC000296265049	328289832	/nfs/dbraw/zinc/28/98/32/328289832.db2.gz	DJSSPSJNTVBZET-YCPHGPKFSA-N	1	0	294.398	4.278	20	30		CIEDRO
Cc1c2ccccc2oc1[C@@H](C)[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000296554442	328291124	/nfs/dbraw/zinc/29/11/24/328291124.db2.gz	RTCXRLMTLVTGDQ-ILXRZTDVSA-N	1	0	282.387	4.474	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H](C)Cc2ccsc2)cc1	ZINC000048557463	328314730	/nfs/dbraw/zinc/31/47/30/328314730.db2.gz	HTCIUIDBPQWZRV-CQSZACIVSA-N	1	0	287.428	4.034	20	30		CIEDRO
N#Cc1ccccc1C[N@@H+]1CCC[C@@H](c2ccccc2)CC1	ZINC000303196439	328327265	/nfs/dbraw/zinc/32/72/65/328327265.db2.gz	NPVUWFYKPOGRPT-GOSISDBHSA-N	1	0	290.410	4.328	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)CCc1ccccc1F)c1ccc(C#N)cc1	ZINC000531950386	328328004	/nfs/dbraw/zinc/32/80/04/328328004.db2.gz	GAUHWJMZXBXZOW-LSDHHAIUSA-N	1	0	296.389	4.369	20	30		CIEDRO
C[C@@H]1CC[N@H+](Cc2ccc(C#N)s2)[C@@H]2CCCC[C@H]12	ZINC000535072811	328384252	/nfs/dbraw/zinc/38/42/52/328384252.db2.gz	WIJQSGMEVSMVOS-DAXOMENPSA-N	1	0	274.433	4.020	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H](CC)c2ccccc2)cc1	ZINC000050198481	328391572	/nfs/dbraw/zinc/39/15/72/328391572.db2.gz	HKRLEKVAXZQGTG-LJQANCHMSA-N	1	0	281.399	4.492	20	30		CIEDRO
CCC(CC)[C@@H]([NH2+]CCCC#N)c1cccs1	ZINC000341576858	328413562	/nfs/dbraw/zinc/41/35/62/328413562.db2.gz	UVGYKZDXQVQKJO-CQSZACIVSA-N	1	0	250.411	4.119	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccc2[nH]c(C)cc2c1)C1CC1	ZINC000563691951	328479185	/nfs/dbraw/zinc/47/91/85/328479185.db2.gz	FRKKTQHHGYBYAQ-KRWDZBQOSA-N	1	0	268.404	4.311	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccc2[nH]c(C)cc2c1)C1CC1	ZINC000563691955	328479193	/nfs/dbraw/zinc/47/91/93/328479193.db2.gz	FRKKTQHHGYBYAQ-QGZVFWFLSA-N	1	0	268.404	4.311	20	30		CIEDRO
C=CCC[C@@H]([NH2+][C@H](C)c1cc(C)n(C)n1)c1ccccc1	ZINC000282173241	328507386	/nfs/dbraw/zinc/50/73/86/328507386.db2.gz	MIWCKUZHPVBKDP-NVXWUHKLSA-N	1	0	283.419	4.087	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+][C@@H]1c2ccccc2CC12CCOCC2	ZINC000290054484	328528762	/nfs/dbraw/zinc/52/87/62/328528762.db2.gz	DQOPWJWANBCVQE-CRAIPNDOSA-N	1	0	285.431	4.025	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+][C@H](C)c1ccc(OC)c(OC)c1C	ZINC000582198963	328629685	/nfs/dbraw/zinc/62/96/85/328629685.db2.gz	APUWHUQTYMIDHQ-TZMCWYRMSA-N	1	0	277.408	4.018	20	30		CIEDRO
C[C@H]([NH2+][C@H]1C[C@H]1C1CCCCC1)c1ccc(C#N)cc1	ZINC000538406242	326829816	/nfs/dbraw/zinc/82/98/16/326829816.db2.gz	UNTVSJVDUDAFKY-KKXDTOCCSA-N	1	0	268.404	4.178	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CC[C@H]3CCCC[C@@H]3C2)cc1	ZINC000037488397	326853770	/nfs/dbraw/zinc/85/37/70/326853770.db2.gz	UQJQOMBWAJTLKK-KZNAEPCWSA-N	1	0	268.404	4.007	20	30		CIEDRO
C=C(C)CC[NH2+][C@H]1C[C@H](C)Sc2sccc21	ZINC000386736854	326876979	/nfs/dbraw/zinc/87/69/79/326876979.db2.gz	CLLDEQJNIQSZRK-JQWIXIFHSA-N	1	0	253.436	4.229	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H]1CCC[C@H](C(F)(F)F)C1	ZINC000386787101	326877776	/nfs/dbraw/zinc/87/77/76/326877776.db2.gz	KSKVIUKXQCOUQG-RYUDHWBXSA-N	1	0	263.347	4.299	20	30		CIEDRO
C=CCOc1cccc(C[NH2+]C2(c3ccc(F)cc3)CC2)c1	ZINC000530729174	326887987	/nfs/dbraw/zinc/88/79/87/326887987.db2.gz	ITPDRSAPJXUMSN-UHFFFAOYSA-N	1	0	297.373	4.169	20	30		CIEDRO
C=CCOc1ccc(C[NH+]2CCC(C(F)(F)F)CC2)cc1	ZINC000506369521	332771407	/nfs/dbraw/zinc/77/14/07/332771407.db2.gz	MQPIAQXOSJWABX-UHFFFAOYSA-N	1	0	299.336	4.026	20	30		CIEDRO
Cc1cc(C[NH2+]C2(c3cccc(C#N)c3)CC2)ccc1Cl	ZINC000556409002	326939849	/nfs/dbraw/zinc/93/98/49/326939849.db2.gz	NSHWYFCSLPJYKM-UHFFFAOYSA-N	1	0	296.801	4.299	20	30		CIEDRO
C=CC[NH2+][C@H]1CCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000556575605	326952532	/nfs/dbraw/zinc/95/25/32/326952532.db2.gz	JZWMGLATFIZWEA-KBPBESRZSA-N	1	0	269.310	4.117	20	30		CIEDRO
Cc1cccc([C@H](C)[NH2+]C2(c3cccc(C#N)c3)CC2)c1	ZINC000556600016	326953888	/nfs/dbraw/zinc/95/38/88/326953888.db2.gz	DXTIKHMFWMRVCO-HNNXBMFYSA-N	1	0	276.383	4.207	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]C(C2CC2)C2CC2)cc1Cl	ZINC000521828667	326990697	/nfs/dbraw/zinc/99/06/97/326990697.db2.gz	PRLVCHMGKIECSF-UHFFFAOYSA-N	1	0	291.822	4.183	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@H](C)[C@@H](OC)c1ccccc1F	ZINC000539510331	326992326	/nfs/dbraw/zinc/99/23/26/326992326.db2.gz	WRUMAYZARNLFPE-JKIFEVAISA-N	1	0	279.399	4.236	20	30		CIEDRO
CC(C)Cc1ccc([C@H]([NH2+]CCC#N)C(C)C)cc1	ZINC000557203366	326996859	/nfs/dbraw/zinc/99/68/59/326996859.db2.gz	NFCMZUWXMODIFA-QGZVFWFLSA-N	1	0	258.409	4.085	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@@H](c1ccccc1)[C@H]1CCOC1	ZINC000557239139	326998163	/nfs/dbraw/zinc/99/81/63/326998163.db2.gz	KTBQMVNNDSRLAR-FHWLQOOXSA-N	1	0	287.447	4.489	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCCSCC)c1ccco1	ZINC000557394762	327004236	/nfs/dbraw/zinc/00/42/36/327004236.db2.gz	OXVQHJXRLRQDTC-ZDUSSCGKSA-N	1	0	253.411	4.020	20	30		CIEDRO
CCCC[N@H+](Cc1nc(C#N)cs1)[C@@H]1CCC[C@H](C)C1	ZINC000557395616	327004283	/nfs/dbraw/zinc/00/42/83/327004283.db2.gz	PBDJHNRSDYUYFK-DZGCQCFKSA-N	1	0	291.464	4.196	20	30		CIEDRO
N#Cc1ccc(C[NH2+]C[C@@H]2CC=CCC2)c(C(F)(F)F)c1	ZINC000557538234	327012428	/nfs/dbraw/zinc/01/24/28/327012428.db2.gz	QRWNPJYGIQBVSQ-GFCCVEGCSA-N	1	0	294.320	4.023	20	30		CIEDRO
N#Cc1ccc(C[NH2+]C[C@H]2CC=CCC2)c(C(F)(F)F)c1	ZINC000557538240	327012446	/nfs/dbraw/zinc/01/24/46/327012446.db2.gz	QRWNPJYGIQBVSQ-LBPRGKRZSA-N	1	0	294.320	4.023	20	30		CIEDRO
Cc1ccc2oc(C[NH2+][C@@H](C)c3cccc(C#N)c3)cc2c1	ZINC000557818131	327028941	/nfs/dbraw/zinc/02/89/41/327028941.db2.gz	DZFRAELLOPMZGH-AWEZNQCLSA-N	1	0	290.366	4.464	20	30		CIEDRO
CC(C)(C#N)CCCC[N@@H+]1CC[C@](F)(c2ccccc2)C1	ZINC000565903148	327086342	/nfs/dbraw/zinc/08/63/42/327086342.db2.gz	PPNILGPCKCNKRA-GOSISDBHSA-N	1	0	288.410	4.277	20	30		CIEDRO
C=CC[N@@H+](C)C/C(C)=C\c1cccc(C(F)(F)F)c1	ZINC000558404586	327091487	/nfs/dbraw/zinc/09/14/87/327091487.db2.gz	FSVAVKBRRKBMLP-XFXZXTDPSA-N	1	0	269.310	4.227	20	30		CIEDRO
C=CCOc1cccc(C[N@@H+](C)[C@H](CC)c2ccncc2)c1	ZINC000558424338	327093303	/nfs/dbraw/zinc/09/33/03/327093303.db2.gz	ZUAOAGNNJARUMS-LJQANCHMSA-N	1	0	296.414	4.230	20	30		CIEDRO
C=CCOc1cccc(C[N@@H+](C)[C@@H](CC)c2ccncc2)c1	ZINC000558424335	327093446	/nfs/dbraw/zinc/09/34/46/327093446.db2.gz	ZUAOAGNNJARUMS-IBGZPJMESA-N	1	0	296.414	4.230	20	30		CIEDRO
CSc1ccc(C[NH2+][C@@H](C)c2ccc(C#N)cc2)s1	ZINC000558482609	327097491	/nfs/dbraw/zinc/09/74/91/327097491.db2.gz	FILZINBTMHCEOH-NSHDSACASA-N	1	0	288.441	4.192	20	30		CIEDRO
C[C@H](C#N)C[NH2+][C@H]1CCC[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000558682882	327113754	/nfs/dbraw/zinc/11/37/54/327113754.db2.gz	QBJBMWGHMLBRJK-GMXABZIVSA-N	1	0	297.229	4.379	20	30		CIEDRO
CC1=C(c2ccco2)C[N@H+]([C@H](C)c2cccc(C#N)c2)CC1	ZINC000558734565	327118078	/nfs/dbraw/zinc/11/80/78/327118078.db2.gz	PVPVCWPBOVABHQ-OAHLLOKOSA-N	1	0	292.382	4.392	20	30		CIEDRO
N#CCSCCC[N@H+]1CCC[C@H]1c1ccccc1Cl	ZINC000074981987	327122772	/nfs/dbraw/zinc/12/27/72/327122772.db2.gz	AZDBYXYALOBMRG-HNNXBMFYSA-N	1	0	294.851	4.124	20	30		CIEDRO
CCCC(C)(C)[N@H+](CCCC#N)Cc1cccs1	ZINC000558865511	327128287	/nfs/dbraw/zinc/12/82/87/327128287.db2.gz	MAUBSBQKOGPQAT-UHFFFAOYSA-N	1	0	264.438	4.433	20	30		CIEDRO
CCc1oc2ccccc2c1C[N@H+](C)[C@H]1CC[C@H](C#N)C1	ZINC000559035299	327138483	/nfs/dbraw/zinc/13/84/83/327138483.db2.gz	YVPBNLBGMASJCW-KBPBESRZSA-N	1	0	282.387	4.119	20	30		CIEDRO
CC(C)[C@@H](NC[C@H](C#N)CCC#N)c1ccccc1Cl	ZINC000566115938	327139869	/nfs/dbraw/zinc/13/98/69/327139869.db2.gz	HMVDJXBFQLOTTK-XJKSGUPXSA-N	1	0	289.810	4.070	20	30		CIEDRO
C=C[C@@H]1CCCC[N@H+]1Cc1ccc(C(C)C)nc1C	ZINC000559187693	327145329	/nfs/dbraw/zinc/14/53/29/327145329.db2.gz	UIVSKEOETJEBNI-MRXNPFEDSA-N	1	0	258.409	4.054	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@H]1CCO[C@H](CC(C)C)C1	ZINC000539682293	327146421	/nfs/dbraw/zinc/14/64/21/327146421.db2.gz	KLLBJAMAWWPYDH-YESZJQIVSA-N	1	0	267.457	4.305	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+][C@H]1CCCC12CCOCC2	ZINC000449307913	327156424	/nfs/dbraw/zinc/15/64/24/327156424.db2.gz	SLDAWNZYOJABTG-CVEARBPZSA-N	1	0	265.441	4.060	20	30		CIEDRO
N#CCC1(C[NH2+][C@@H]2CCCc3ccc(Cl)cc32)CC1	ZINC000559324915	327160151	/nfs/dbraw/zinc/16/01/51/327160151.db2.gz	IYAIRJKFQNWMBV-OAHLLOKOSA-N	1	0	274.795	4.001	20	30		CIEDRO
CC1(C)CCC[C@H]([NH2+][C@H]2CCc3ccc(C#N)cc32)C1	ZINC000569396540	327172302	/nfs/dbraw/zinc/17/23/02/327172302.db2.gz	CLHMVUXRNGXQBN-RDJZCZTQSA-N	1	0	268.404	4.104	20	30		CIEDRO
C[C@@H]1CCC[C@@H]([NH2+][C@H]2CCc3ccc(C#N)cc32)CC1	ZINC000569413813	327173071	/nfs/dbraw/zinc/17/30/71/327173071.db2.gz	XWWWVSDCIGOVBU-QBIMZIAESA-N	1	0	268.404	4.104	20	30		CIEDRO
C[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCc3ccc(C#N)cc32)CC1	ZINC000569413812	327173113	/nfs/dbraw/zinc/17/31/13/327173113.db2.gz	XWWWVSDCIGOVBU-MZMPZRCHSA-N	1	0	268.404	4.104	20	30		CIEDRO
C[N@H+](Cc1ccc(C(C)(C)C)cc1)[C@@H]1CC[C@H](C#N)C1	ZINC000569509324	327186972	/nfs/dbraw/zinc/18/69/72/327186972.db2.gz	WGYUMDZGWMQLBA-DOTOQJQBSA-N	1	0	270.420	4.108	20	30		CIEDRO
Cc1ccccc1OCCC[N@@H+](C)CC(C)(C)CCC#N	ZINC000092166576	327188998	/nfs/dbraw/zinc/18/89/98/327188998.db2.gz	UIIJRZJQLDRLIW-UHFFFAOYSA-N	1	0	288.435	4.026	20	30		CIEDRO
N#Cc1csc(C[N@H+](C2CC2)[C@H]2CCc3ccccc32)c1	ZINC000092221736	327190472	/nfs/dbraw/zinc/19/04/72/327190472.db2.gz	FVCLENJKVFTNRT-SFHVURJKSA-N	1	0	294.423	4.272	20	30		CIEDRO
C[C@@H]([NH2+]C[C@H]1CSc2ccccc21)c1ccc(C#N)cc1	ZINC000092274933	327191248	/nfs/dbraw/zinc/19/12/48/327191248.db2.gz	JJMCJLUPODACTI-CJNGLKHVSA-N	1	0	294.423	4.098	20	30		CIEDRO
C[C@H]([NH2+]Cc1cccc(C#N)c1)C1CCCCCC1	ZINC000149845257	327198335	/nfs/dbraw/zinc/19/83/35/327198335.db2.gz	IVMGJXFYMMFILF-AWEZNQCLSA-N	1	0	256.393	4.007	20	30		CIEDRO
Cc1ccc(C[C@@H](C)[N@H+](C)CC(C)(C)CCC#N)cc1	ZINC000093535180	327198449	/nfs/dbraw/zinc/19/84/49/327198449.db2.gz	JHXFGVAPNGTDBD-MRXNPFEDSA-N	1	0	272.436	4.188	20	30		CIEDRO
C[C@@H]1C[N@H+](CC(C)(C)CCC#N)CC[C@@H]1c1ccccc1	ZINC000093668354	327199181	/nfs/dbraw/zinc/19/91/81/327199181.db2.gz	XGGDGXGCDAWBSG-AEFFLSMTSA-N	1	0	284.447	4.442	20	30		CIEDRO
CCC[C@@H](C)[C@H]1CCC[N@@H+]1CC(C)(C)CCC#N	ZINC000093845280	327200419	/nfs/dbraw/zinc/20/04/19/327200419.db2.gz	SYRXKXUETPYXSH-HUUCEWRRSA-N	1	0	250.430	4.217	20	30		CIEDRO
C=CC[N@@H+](CCCc1cnccc1C)Cc1cccs1	ZINC000584258742	327202796	/nfs/dbraw/zinc/20/27/96/327202796.db2.gz	GBRJHCOTWALIMJ-UHFFFAOYSA-N	1	0	286.444	4.072	20	30		CIEDRO
C[N@H+](CCCCC#N)Cc1csc2ccccc12	ZINC000102397369	327226833	/nfs/dbraw/zinc/22/68/33/327226833.db2.gz	NSWYRDMFGLGWDR-UHFFFAOYSA-N	1	0	258.390	4.027	20	30		CIEDRO
CC(C)(C#N)CC[NH2+][C@@H](Cc1ccccc1)c1ccccc1	ZINC000536471572	327240698	/nfs/dbraw/zinc/24/06/98/327240698.db2.gz	KNRFCOPNQWGGNA-IBGZPJMESA-N	1	0	292.426	4.500	20	30		CIEDRO
CC(C)(C#N)CC[N@@H+]1CCC[C@H]1Cc1ccccc1Cl	ZINC000536473098	327240766	/nfs/dbraw/zinc/24/07/66/327240766.db2.gz	XVFQQRMACCDIIV-HNNXBMFYSA-N	1	0	290.838	4.287	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccc(CC#N)cc1)c1cccc(OC)c1	ZINC000566221942	327243492	/nfs/dbraw/zinc/24/34/92/327243492.db2.gz	XGTQVMCUAALZPW-LJQANCHMSA-N	1	0	294.398	4.002	20	30		CIEDRO
CC(C)[C@@H]1CC[C@H]1[NH2+][C@@H](CCCC#N)c1ccccc1	ZINC000559862227	327265885	/nfs/dbraw/zinc/26/58/85/327265885.db2.gz	BXBNMDDANZYKLA-OKZBNKHCSA-N	1	0	270.420	4.446	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H](C)CCc1ccsc1	ZINC000559879930	327266292	/nfs/dbraw/zinc/26/62/92/327266292.db2.gz	ZZKBVWZTBLOHLJ-ZDUSSCGKSA-N	1	0	251.439	4.261	20	30		CIEDRO
CC(C)(C#N)CCCC[NH+]1CCC(CC(F)(F)F)CC1	ZINC000560169015	327288447	/nfs/dbraw/zinc/28/84/47/327288447.db2.gz	ZVDPTHCOOMRFAA-UHFFFAOYSA-N	1	0	290.373	4.371	20	30		CIEDRO
C=CCCCC[NH2+][C@@H](C)[C@H]1C[C@@H]1c1ccc(OC)cc1	ZINC000560236572	327292098	/nfs/dbraw/zinc/29/20/98/327292098.db2.gz	ZFGZMHZFOCKLIU-BMGDILEWSA-N	1	0	273.420	4.133	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH2+]CCCCc2ccc(Cl)s2)C1	ZINC000560239032	327292311	/nfs/dbraw/zinc/29/23/11/327292311.db2.gz	VCSHYHTXRMYPMR-VXGBXAGGSA-N	1	0	282.840	4.006	20	30		CIEDRO
C[C@H](c1ccccc1)[C@H](C)[NH2+]C1(c2cccc(C#N)c2)CC1	ZINC000560269295	327295091	/nfs/dbraw/zinc/29/50/91/327295091.db2.gz	UKGVCZRXKCUMGE-HOTGVXAUSA-N	1	0	290.410	4.329	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@H](C)N1CCCC[C@@H]1C)c1ccco1	ZINC000560514477	327317304	/nfs/dbraw/zinc/31/73/04/327317304.db2.gz	NNRITQMRNUXZNO-ULQDDVLXSA-N	1	0	290.451	4.139	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1cc(C)cc(OC)c1)c1ccco1	ZINC000560543839	327321576	/nfs/dbraw/zinc/32/15/76/327321576.db2.gz	NAZUEOVKSIOOLK-QGZVFWFLSA-N	1	0	285.387	4.394	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1cc(C)cc(OC)c1)c1ccco1	ZINC000560543833	327321600	/nfs/dbraw/zinc/32/16/00/327321600.db2.gz	NAZUEOVKSIOOLK-KRWDZBQOSA-N	1	0	285.387	4.394	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H](C)Oc1ccccc1)c1ccco1	ZINC000560546697	327322776	/nfs/dbraw/zinc/32/27/76/327322776.db2.gz	WAYKJEJLTWWAJX-WBVHZDCISA-N	1	0	285.387	4.344	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCC1CCC(OC)CC1)c1ccco1	ZINC000560548581	327323195	/nfs/dbraw/zinc/32/31/95/327323195.db2.gz	IZNBSMSDLFIWAA-JCYILVPMSA-N	1	0	291.435	4.472	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CC1(OC)CCCCC1)c1ccco1	ZINC000560548421	327323306	/nfs/dbraw/zinc/32/33/06/327323306.db2.gz	HQYAITRXZGTEQI-OAHLLOKOSA-N	1	0	277.408	4.226	20	30		CIEDRO
C[C@H]1CCC[C@@H]([NH2+]Cc2cccc(OCCCC#N)c2)C1	ZINC000237524954	327332169	/nfs/dbraw/zinc/33/21/69/327332169.db2.gz	KGENEEQLCZOOTA-DOTOQJQBSA-N	1	0	286.419	4.037	20	30		CIEDRO
C=CCCCC[N@@H+]1CCCC[C@@H]1c1nnc(C2CCC2)o1	ZINC000583422355	327356608	/nfs/dbraw/zinc/35/66/08/327356608.db2.gz	WUGDIVYGWBWJGM-OAHLLOKOSA-N	1	0	289.423	4.220	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+][C@H](C)c1cn(-c2ccccc2)nn1	ZINC000561017126	327359007	/nfs/dbraw/zinc/35/90/07/327359007.db2.gz	LZFRFALXSAAHQJ-HZPDHXFCSA-N	1	0	298.434	4.053	20	30		CIEDRO
C=CCCC[C@@H](C)[NH+]1CCC(Oc2ccc(C#N)cc2)CC1	ZINC000561061156	327362168	/nfs/dbraw/zinc/36/21/68/327362168.db2.gz	VQRRDWJEHWYWJJ-MRXNPFEDSA-N	1	0	298.430	4.146	20	30		CIEDRO
C=C[C@@H]1OCCC[C@H]1[NH2+][C@@H](C)c1ccccc1C(F)(F)F	ZINC000449548859	327367923	/nfs/dbraw/zinc/36/79/23/327367923.db2.gz	RJOMOTNMWXFPQL-GLQYFDAESA-N	1	0	299.336	4.090	20	30		CIEDRO
Cc1ccc([C@@H](C)[NH2+]CC(C)(C)CCC#N)cc1C	ZINC000561349172	327388036	/nfs/dbraw/zinc/38/80/36/327388036.db2.gz	RMMWYJMNLZQSJN-OAHLLOKOSA-N	1	0	258.409	4.284	20	30		CIEDRO
C[C@@H]1C[C@@H](C)[NH+]1Cc1ccc(-c2ccccc2C#N)cc1	ZINC000562302847	327466044	/nfs/dbraw/zinc/46/60/44/327466044.db2.gz	YZRYCKCSOLTQAC-HUUCEWRRSA-N	1	0	276.383	4.208	20	30		CIEDRO
C=CCCC[NH+]1CCC(OCC2CCCCC2)CC1	ZINC000562515483	327487663	/nfs/dbraw/zinc/48/76/63/327487663.db2.gz	KREOEXJPRDBVSL-UHFFFAOYSA-N	1	0	265.441	4.014	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCCc2cc(F)ccc21)c1ccc(C#N)cc1	ZINC000159549188	327533552	/nfs/dbraw/zinc/53/35/52/327533552.db2.gz	QMDPPEIOQDDIKT-YJYMSZOUSA-N	1	0	294.373	4.426	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCCc2cc(F)ccc21)c1ccc(C#N)cc1	ZINC000159548932	327533557	/nfs/dbraw/zinc/53/35/57/327533557.db2.gz	QMDPPEIOQDDIKT-BFUOFWGJSA-N	1	0	294.373	4.426	20	30		CIEDRO
N#CC1CCC(C[NH2+]C2CCC3(CCCC3)CC2)CC1	ZINC000570090659	327568305	/nfs/dbraw/zinc/56/83/05/327568305.db2.gz	VLTNBDOGBNOKRR-UHFFFAOYSA-N	1	0	274.452	4.409	20	30		CIEDRO
Cc1cc(F)ccc1-c1ccc(C[NH+]2CCC(C#N)CC2)o1	ZINC000123712877	328648845	/nfs/dbraw/zinc/64/88/45/328648845.db2.gz	YSBNEBFAYUKMJM-UHFFFAOYSA-N	1	0	298.361	4.130	20	30		CIEDRO
C=CC[C@@H](Cc1ccccc1)[NH2+][C@@H](C)c1ccoc1	ZINC000519632193	328692346	/nfs/dbraw/zinc/69/23/46/328692346.db2.gz	VDTQEMKHIVDNSF-YOEHRIQHSA-N	1	0	255.361	4.118	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@@H](CC2CC2)c2ccccc2)c1	ZINC000532196100	328704592	/nfs/dbraw/zinc/70/45/92/328704592.db2.gz	PNLUOVQAPSWUNJ-IBGZPJMESA-N	1	0	276.383	4.189	20	30		CIEDRO
C=CC[C@@H](C)[C@H](C)[NH2+]CCc1c[nH]c2c1cccc2C	ZINC000532235280	328709692	/nfs/dbraw/zinc/70/96/92/328709692.db2.gz	RFENFXCCKWCQDP-HIFRSBDPSA-N	1	0	270.420	4.209	20	30		CIEDRO
CCC[C@@H](C[NH+]1CCC(C)(C#N)CC1)c1ccccc1	ZINC000507700282	332819599	/nfs/dbraw/zinc/81/95/99/332819599.db2.gz	WEXVHLKEPMYJOL-KRWDZBQOSA-N	1	0	270.420	4.196	20	30		CIEDRO
CC(C)(C#N)c1ccccc1C[NH+]1CCC(C)(C)CC1	ZINC000532622815	328792199	/nfs/dbraw/zinc/79/21/99/328792199.db2.gz	ZSCCGZLXNSQIEU-UHFFFAOYSA-N	1	0	270.420	4.110	20	30		CIEDRO
C[C@@H](CC[NH2+][C@@H](C)c1ccc(C#N)cc1)c1ccccc1	ZINC000043533622	328802237	/nfs/dbraw/zinc/80/22/37/328802237.db2.gz	IECCMWRMJJHROO-HOTGVXAUSA-N	1	0	278.399	4.403	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCCOC(C)C)c1ccccc1	ZINC000358014795	328880621	/nfs/dbraw/zinc/88/06/21/328880621.db2.gz	DCJCBLWREPZMKH-KRWDZBQOSA-N	1	0	261.409	4.099	20	30		CIEDRO
C=CCCCC[NH2+]Cc1cscc1C(F)(F)F	ZINC000582270502	328944706	/nfs/dbraw/zinc/94/47/06/328944706.db2.gz	DHEVWQOHXMSHBZ-UHFFFAOYSA-N	1	0	263.328	4.213	20	30		CIEDRO
N#CCCCC[NH+]1CCC(F)(c2cccc(Cl)c2)CC1	ZINC000375989976	329005981	/nfs/dbraw/zinc/00/59/81/329005981.db2.gz	WAVJRDRZFKESRL-UHFFFAOYSA-N	1	0	294.801	4.294	20	30		CIEDRO
Cc1ccc([C@@H]2CSCC[N@@H+]2CCCC(C)(C)C#N)o1	ZINC000377939594	329035198	/nfs/dbraw/zinc/03/51/98/329035198.db2.gz	JWCRFZKADMKZIZ-AWEZNQCLSA-N	1	0	292.448	4.008	20	30		CIEDRO
C[C@H]1C[C@@H](c2ccsc2)C[N@@H+]1CCCC(C)(C)C#N	ZINC000377941919	329035600	/nfs/dbraw/zinc/03/56/00/329035600.db2.gz	NBJSZLBOTJDOCT-DZGCQCFKSA-N	1	0	276.449	4.256	20	30		CIEDRO
C[N@H+](CCCC(C)(C)C#N)C1CC(c2ccccc2)C1	ZINC000378158488	329041750	/nfs/dbraw/zinc/04/17/50/329041750.db2.gz	MZVGURGNJXTHNA-UHFFFAOYSA-N	1	0	270.420	4.194	20	30		CIEDRO
C=CC[C@@H](C)[C@H](C)[NH2+]Cc1ncoc1-c1ccccc1	ZINC000378184815	329042592	/nfs/dbraw/zinc/04/25/92/329042592.db2.gz	OBTBSHPRJSQILU-KGLIPLIRSA-N	1	0	270.376	4.032	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)c1cc(Br)cs1	ZINC000194102419	329065512	/nfs/dbraw/zinc/06/55/12/329065512.db2.gz	JNMWHDCNQVEFKR-DTWKUNHWSA-N	1	0	274.227	4.126	20	30		CIEDRO
CC(C)(CCC#N)C[N@@H+]1CCS[C@H](c2ccccc2)C1	ZINC000360080504	329071391	/nfs/dbraw/zinc/07/13/91/329071391.db2.gz	XYKATVSFFKLEOS-INIZCTEOSA-N	1	0	288.460	4.106	20	30		CIEDRO
N#CCCCC[N@@H+]1CCCCC[C@H]1c1ccccc1	ZINC000171033200	329074221	/nfs/dbraw/zinc/07/42/21/329074221.db2.gz	RGNIQVSZRNILNA-KRWDZBQOSA-N	1	0	256.393	4.298	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@@H]1CCCc2c3ccccc3[nH]c21	ZINC000393815400	329089750	/nfs/dbraw/zinc/08/97/50/329089750.db2.gz	WQVRHXQOGQKIDO-CXAGYDPISA-N	1	0	268.404	4.490	20	30		CIEDRO
CC[NH+](CC)CCC(C#N)(c1ccccc1)c1ccccc1	ZINC000033640847	329103550	/nfs/dbraw/zinc/10/35/50/329103550.db2.gz	HONARVMECIZMMD-UHFFFAOYSA-N	1	0	292.426	4.228	20	30		CIEDRO
C=CCCCCC[NH2+]Cc1ccc(Oc2cnccn2)cc1	ZINC000582557509	329111508	/nfs/dbraw/zinc/11/15/08/329111508.db2.gz	ZGXNWOVAFQCECJ-UHFFFAOYSA-N	1	0	297.402	4.105	20	30		CIEDRO
CC(C)(C#N)CCC[N@H+]1CC=C(c2ccccc2)CC1	ZINC000174808318	329161611	/nfs/dbraw/zinc/16/16/11/329161611.db2.gz	CPQGDCMJQOIBON-UHFFFAOYSA-N	1	0	268.404	4.106	20	30		CIEDRO
C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(C#N)cc2F)c2ccccc21	ZINC000177859845	329193408	/nfs/dbraw/zinc/19/34/08/329193408.db2.gz	SIHZABUPRBMXIW-BFUOFWGJSA-N	1	0	294.373	4.426	20	30		CIEDRO
N#CCCCC[NH2+][C@@H]1CCSc2ccc(Cl)cc21	ZINC000178644432	329201702	/nfs/dbraw/zinc/20/17/02/329201702.db2.gz	VFHAJTAZPKRGTE-CYBMUJFWSA-N	1	0	280.824	4.160	20	30		CIEDRO
CC[N@H+](Cc1ccc(C)o1)[C@@H](C)c1ccc(C#N)cc1	ZINC000179463347	329208882	/nfs/dbraw/zinc/20/88/82/329208882.db2.gz	FPBGZABMTBMEPO-AWEZNQCLSA-N	1	0	268.360	4.043	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCc1scnc1C)c1ccccc1	ZINC000180050511	329214864	/nfs/dbraw/zinc/21/48/64/329214864.db2.gz	HKHQMPGGYHNKJB-INIZCTEOSA-N	1	0	286.444	4.291	20	30		CIEDRO
C=CCC[C@@H]([NH2+][C@H](C)CCCOC)c1ccccc1	ZINC000181508066	329233884	/nfs/dbraw/zinc/23/38/84/329233884.db2.gz	LLAXAKWRYHQNAJ-NVXWUHKLSA-N	1	0	261.409	4.099	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1ccc(F)c(Br)c1	ZINC000378863887	329258960	/nfs/dbraw/zinc/25/89/60/329258960.db2.gz	WJQOEXYMYHBQAG-JTQLQIEISA-N	1	0	286.188	4.205	20	30		CIEDRO
CCC[NH+](CCC)Cc1ccc(C#N)cc1C(F)(F)F	ZINC000582877624	329284160	/nfs/dbraw/zinc/28/41/60/329284160.db2.gz	QGRHBPYIPIKSGL-UHFFFAOYSA-N	1	0	284.325	4.199	20	30		CIEDRO
C[N@H+](CCCCC(C)(C)C#N)C1CCC(F)(F)CC1	ZINC000583161036	329324920	/nfs/dbraw/zinc/32/49/20/329324920.db2.gz	CHPZSLCHRQYCHS-UHFFFAOYSA-N	1	0	272.383	4.216	20	30		CIEDRO
CCOc1ccccc1[C@@H](CC)[NH2+][C@H]1CCC[C@H](C#N)C1	ZINC000185806017	329329560	/nfs/dbraw/zinc/32/95/60/329329560.db2.gz	BECDEPJTRVJXJY-YQQAZPJKSA-N	1	0	286.419	4.208	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)c1ccc(F)cc1F	ZINC000185838783	329330029	/nfs/dbraw/zinc/33/00/29/329330029.db2.gz	UMDVDOGZBFFZRD-NORZTCDRSA-N	1	0	278.346	4.088	20	30		CIEDRO
Cc1c(C[NH2+][C@@H]2CCC[C@H](C#N)C2)oc2ccc(F)cc12	ZINC000185842436	329330051	/nfs/dbraw/zinc/33/00/51/329330051.db2.gz	VJYGCPZNWIVRNU-GXTWGEPZSA-N	1	0	286.350	4.052	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)c1cc(F)ccc1F	ZINC000185840856	329330137	/nfs/dbraw/zinc/33/01/37/329330137.db2.gz	KZSAGCDSWOPMBR-NORZTCDRSA-N	1	0	278.346	4.088	20	30		CIEDRO
CC(C)(CC#N)C[NH2+]C1CC(c2ccccc2Cl)C1	ZINC000459727579	329372624	/nfs/dbraw/zinc/37/26/24/329372624.db2.gz	HGOOBAZHLJTOOI-UHFFFAOYSA-N	1	0	276.811	4.115	20	30		CIEDRO
C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]CC(C)(C)CC#N	ZINC000459739883	329377405	/nfs/dbraw/zinc/37/74/05/329377405.db2.gz	ZOZADCAKZVYMLU-GFCCVEGCSA-N	1	0	298.352	4.166	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1nc(C(C)(C)C)cs1	ZINC000509021873	332856210	/nfs/dbraw/zinc/85/62/10/332856210.db2.gz	NBASZZQZMVQUFG-NSHDSACASA-N	1	0	252.427	4.057	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1ccc(OC(C)C)c(OC)c1	ZINC000509027102	332856380	/nfs/dbraw/zinc/85/63/80/332856380.db2.gz	CGVIQUYDPOLGJH-AWEZNQCLSA-N	1	0	277.408	4.099	20	30		CIEDRO
C[N@H+](Cc1cc(Cl)ccc1F)CC(C)(C)CCC#N	ZINC000583242839	329392460	/nfs/dbraw/zinc/39/24/60/329392460.db2.gz	BMFYASXBWIDQBA-UHFFFAOYSA-N	1	0	282.790	4.241	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](C)c1ccc(-n2ccnc2)cc1	ZINC000398074561	329431012	/nfs/dbraw/zinc/43/10/12/329431012.db2.gz	OADYTTFBAGQLIV-JKSUJKDBSA-N	1	0	283.419	4.268	20	30		CIEDRO
C=CCCC[NH2+][C@H](CC(F)(F)F)c1ccccc1	ZINC000310650341	329539263	/nfs/dbraw/zinc/53/92/63/329539263.db2.gz	GHPNKMPXTFYAJW-CYBMUJFWSA-N	1	0	257.299	4.236	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ncoc1-c1ccccc1)C1CC1	ZINC000359979993	329644873	/nfs/dbraw/zinc/64/48/73/329644873.db2.gz	WFNFUOWEUWJSLD-MRXNPFEDSA-N	1	0	282.387	4.176	20	30		CIEDRO
CC[C@H](C)C[C@H](C)[NH2+]Cc1cccc(OCCCC#N)c1	ZINC000237120311	329694141	/nfs/dbraw/zinc/69/41/41/329694141.db2.gz	QNXSWCRHCSSAKB-HOTGVXAUSA-N	1	0	288.435	4.283	20	30		CIEDRO
CO[C@H](C[NH2+][C@H](CCCC#N)c1ccccc1)CC(C)C	ZINC000419280433	329717211	/nfs/dbraw/zinc/71/72/11/329717211.db2.gz	JBMBDJYFUHVZOZ-ZWKOTPCHSA-N	1	0	288.435	4.072	20	30		CIEDRO
C[C@@H]([NH2+]Cc1cccc(C#N)c1F)c1ccc(C2CC2)cc1	ZINC000419330561	329717491	/nfs/dbraw/zinc/71/74/91/329717491.db2.gz	GCKLPURPZUUTAD-CYBMUJFWSA-N	1	0	294.373	4.426	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C#N)c(F)c1)c1ccc(C2CC2)cc1	ZINC000419337800	329718288	/nfs/dbraw/zinc/71/82/88/329718288.db2.gz	LDSZFXKKNGFAKW-CYBMUJFWSA-N	1	0	294.373	4.426	20	30		CIEDRO
C[C@H](CC#N)[NH2+][C@@H](C)[C@H](C)c1ccccc1C(F)(F)F	ZINC000245855063	329756134	/nfs/dbraw/zinc/75/61/34/329756134.db2.gz	DLTSOMPQRVDFJV-WOPDTQHZSA-N	1	0	284.325	4.089	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)c1cc(F)ccc1F	ZINC000248816633	329899636	/nfs/dbraw/zinc/89/96/36/329899636.db2.gz	KZSAGCDSWOPMBR-FFSVYQOJSA-N	1	0	278.346	4.088	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+][C@@H]1c2ccccc2CC12CCOCC2	ZINC000571929190	329930051	/nfs/dbraw/zinc/93/00/51/329930051.db2.gz	BZKMPUCCQGLYLT-FRQCXROJSA-N	1	0	299.458	4.271	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@@H](C)c1sccc1C	ZINC000161511226	329943676	/nfs/dbraw/zinc/94/36/76/329943676.db2.gz	SZDVHCNJNUWNND-AWEZNQCLSA-N	1	0	287.428	4.472	20	30		CIEDRO
C=CCC[NH2+]C(C)(C)c1cccc(C(F)(F)F)c1	ZINC000572127109	329946785	/nfs/dbraw/zinc/94/67/85/329946785.db2.gz	ZBQZOKGBZIBYSE-UHFFFAOYSA-N	1	0	257.299	4.106	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+]Cc1csc([C@@H](C)OC)n1	ZINC000269089101	330067437	/nfs/dbraw/zinc/06/74/37/330067437.db2.gz	QAKZZFUTVNOYKM-CHWSQXEVSA-N	1	0	282.453	4.075	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@@H](C)c1ccc(C)o1)c1ccccc1	ZINC000271453296	330080070	/nfs/dbraw/zinc/08/00/70/330080070.db2.gz	GMPDXNNPXXDNDH-GOEBONIOSA-N	1	0	253.345	4.003	20	30		CIEDRO
C#CC[C@H]([NH2+][C@@H](C)c1cccs1)c1ccccc1	ZINC000271521839	330081095	/nfs/dbraw/zinc/08/10/95/330081095.db2.gz	ONZYIAZMFMWXLT-ZFWWWQNUSA-N	1	0	255.386	4.163	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H]1CCOC2(CCC2)C1)c1ccccc1	ZINC000271548243	330081377	/nfs/dbraw/zinc/08/13/77/330081377.db2.gz	UOEOPCOPHLIHJQ-MSOLQXFVSA-N	1	0	285.431	4.385	20	30		CIEDRO
C#CC[C@H]([NH2+][C@H](C)c1ccccc1OC)c1ccccc1	ZINC000271531374	330081382	/nfs/dbraw/zinc/08/13/82/330081382.db2.gz	PRWHJCGWPGYZQU-QAPCUYQASA-N	1	0	279.383	4.110	20	30		CIEDRO
C[C@@H]([NH2+][C@H](C)c1ccncc1Cl)c1ccc(C#N)cc1	ZINC000421824996	330083347	/nfs/dbraw/zinc/08/33/47/330083347.db2.gz	LGVKKGRBSGLMJE-VXGBXAGGSA-N	1	0	285.778	4.018	20	30		CIEDRO
C[C@H](Cc1ccc(F)cc1Cl)[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000421853258	330088329	/nfs/dbraw/zinc/08/83/29/330088329.db2.gz	IYEMJRSMHYFBPZ-XUJVJEKNSA-N	1	0	294.801	4.082	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@H]1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000273491515	330093031	/nfs/dbraw/zinc/09/30/31/330093031.db2.gz	WVTTYUQLMOTAQF-OKZBNKHCSA-N	1	0	291.410	4.380	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@@H](C)c1cc(C)ccc1O)c1ccccc1	ZINC000273472117	330093118	/nfs/dbraw/zinc/09/31/18/330093118.db2.gz	JUKQPRUUOBOYGV-MAUKXSAKSA-N	1	0	279.383	4.116	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H]1CC12CCSCC2)c1ccco1	ZINC000421886035	330096350	/nfs/dbraw/zinc/09/63/50/330096350.db2.gz	RTYNEILCDMEOOE-GJZGRUSLSA-N	1	0	291.460	4.410	20	30		CIEDRO
Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+]Cc1ccc(C#N)s1	ZINC000421875502	330101386	/nfs/dbraw/zinc/10/13/86/330101386.db2.gz	JDOKBKJLQCCDPF-WBMJQRKESA-N	1	0	282.412	4.266	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccc(C#N)s1)c1cccc(C)c1	ZINC000421885224	330103004	/nfs/dbraw/zinc/10/30/04/330103004.db2.gz	QYXIVYKYMQCGIS-MRXNPFEDSA-N	1	0	270.401	4.169	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)c1nc2ccccc2n1C(F)F	ZINC000275466016	330110078	/nfs/dbraw/zinc/11/00/78/330110078.db2.gz	NMTCOBLTIKCVAQ-LLVKDONJSA-N	1	0	279.334	4.048	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@@H](C)c1cnn(C(C)C)c1C)c1ccccc1	ZINC000276556290	330114130	/nfs/dbraw/zinc/11/41/30/330114130.db2.gz	RDGCEBOAKZUOJE-HNAYVOBHSA-N	1	0	295.430	4.188	20	30		CIEDRO
CC(C)SCC[NH2+][C@H](CCCC#N)c1ccccc1	ZINC000433014853	330120804	/nfs/dbraw/zinc/12/08/04/330120804.db2.gz	HQWYAHOFCKACIN-MRXNPFEDSA-N	1	0	276.449	4.153	20	30		CIEDRO
C#CC[C@H]([NH2+][C@@H]1CCCc2occc21)c1ccccc1	ZINC000278762814	330122574	/nfs/dbraw/zinc/12/25/74/330122574.db2.gz	OTUWMMKNMVNFHV-DLBZAZTESA-N	1	0	265.356	4.011	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+]Cc1nnc(C(C)(C)C)s1	ZINC000536848013	330249372	/nfs/dbraw/zinc/24/93/72/330249372.db2.gz	WQXUSHVWXPZFBZ-GFCCVEGCSA-N	1	0	281.469	4.060	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1cnc2ccccc2c1)C1CC1	ZINC000536857354	330252196	/nfs/dbraw/zinc/25/21/96/330252196.db2.gz	JZRIKDJERQYXCJ-QGZVFWFLSA-N	1	0	266.388	4.069	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1cc(Cl)ccc1Cl	ZINC000424121559	330252308	/nfs/dbraw/zinc/25/23/08/330252308.db2.gz	IJUWYGBFBJITCX-JBLDHEPKSA-N	1	0	283.202	4.336	20	30		CIEDRO
C=CCN1CCC([NH2+][C@H](C)c2cccc(C(C)C)c2)CC1	ZINC000527859997	330289348	/nfs/dbraw/zinc/28/93/48/330289348.db2.gz	SPAVILIJNSYVDQ-MRXNPFEDSA-N	1	0	286.463	4.111	20	30		CIEDRO
CC(C)c1cccc([C@H](C)[NH2+][C@@H]2CC[C@H](C#N)C2)c1	ZINC000527910319	330290622	/nfs/dbraw/zinc/29/06/22/330290622.db2.gz	NSPDCRCCTXNGBX-GRDNDAEWSA-N	1	0	256.393	4.153	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@H](C)c1cccc2ccccc21	ZINC000424146302	330292837	/nfs/dbraw/zinc/29/28/37/330292837.db2.gz	WIKSNYJFDILABD-ALKREAHSSA-N	1	0	281.399	4.082	20	30		CIEDRO
C[C@H]([NH2+][C@H](c1ccccn1)C1CCC1)c1ccc(C#N)cc1	ZINC000527962356	330300839	/nfs/dbraw/zinc/30/08/39/330300839.db2.gz	CNRLZWCHXPAYDJ-LIRRHRJNSA-N	1	0	291.398	4.145	20	30		CIEDRO
C=CCCC[N@H+]1CC=C(c2c[nH]c3cc(F)ccc23)CC1	ZINC000533033341	330324034	/nfs/dbraw/zinc/32/40/34/330324034.db2.gz	ZYJNMKYLHCULDJ-UHFFFAOYSA-N	1	0	284.378	4.362	20	30		CIEDRO
C=CCCC[N@H+]1CCCC[C@@H]1c1nc2ccccc2n1C	ZINC000533065327	330325613	/nfs/dbraw/zinc/32/56/13/330325613.db2.gz	IYEAPKVPFIQHOP-QGZVFWFLSA-N	1	0	283.419	4.067	20	30		CIEDRO
CC(C)[N@H+](Cc1ccc(C#N)cc1F)C1CCCCC1	ZINC000533048557	330326293	/nfs/dbraw/zinc/32/62/93/330326293.db2.gz	KMFNZHJITAEYTF-UHFFFAOYSA-N	1	0	274.383	4.240	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@@H](C)c1cc2ccccc2s1	ZINC000424291332	330334851	/nfs/dbraw/zinc/33/48/51/330334851.db2.gz	DMZLUIGERHDERV-QEJZJMRPSA-N	1	0	287.428	4.143	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@@H](CC)c1cccc(Cl)c1F	ZINC000424300278	330336976	/nfs/dbraw/zinc/33/69/76/330336976.db2.gz	XIEJFRIDDYROGC-CQDKDKBSSA-N	1	0	297.801	4.111	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc(F)c2ccccc21	ZINC000424324363	330341054	/nfs/dbraw/zinc/34/10/54/330341054.db2.gz	JVBBARQRRJALNN-HZSPNIEDSA-N	1	0	282.362	4.322	20	30		CIEDRO
COc1ccc(C2CCC([NH2+][C@@H]3CC[C@H](C#N)C3)CC2)cc1	ZINC000424329570	330341986	/nfs/dbraw/zinc/34/19/86/330341986.db2.gz	PNAWRZUZBGELDZ-HRSCSKTISA-N	1	0	298.430	4.003	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@@H]2CCC[C@H]2c2ccccc2Cl)C1	ZINC000424335023	330343199	/nfs/dbraw/zinc/34/31/99/330343199.db2.gz	WGQMVYDHSKVYMF-UICACZKSSA-N	1	0	288.822	4.258	20	30		CIEDRO
C=CCN(Cc1cc(-c2ccco2)on1)Cc1ccccc1	ZINC000045840885	330349231	/nfs/dbraw/zinc/34/92/31/330349231.db2.gz	MQJMHNZEAXZJRT-UHFFFAOYSA-N	1	0	294.354	4.123	20	30		CIEDRO
CCC[N@H+](C)Cc1ccc(-c2ccccc2C#N)cc1	ZINC000533260406	330355716	/nfs/dbraw/zinc/35/57/16/330355716.db2.gz	RELRZEMELVMPSU-UHFFFAOYSA-N	1	0	264.372	4.067	20	30		CIEDRO
C=C(C)C[N@@H+]1CCC[C@@H](c2nc3ccccc3s2)C1	ZINC000533334059	330358821	/nfs/dbraw/zinc/35/88/21/330358821.db2.gz	RONKXECNSHVSIK-CYBMUJFWSA-N	1	0	272.417	4.052	20	30		CIEDRO
C=C(C)C[N@@H+]1CCC[C@H](c2nc3ccccc3s2)C1	ZINC000533334064	330358853	/nfs/dbraw/zinc/35/88/53/330358853.db2.gz	RONKXECNSHVSIK-ZDUSSCGKSA-N	1	0	272.417	4.052	20	30		CIEDRO
C[C@@H]([NH2+]C/C=C\c1ccc(F)cc1)c1ccc(C#N)cc1	ZINC000533360799	330359686	/nfs/dbraw/zinc/35/96/86/330359686.db2.gz	RTHJGUCZXOWIAV-PYLYLYNFSA-N	1	0	280.346	4.061	20	30		CIEDRO
C=C(CC)C[N@@H+]1CCCC[C@H]1c1nc(-c2ccccc2)no1	ZINC000536888952	330363315	/nfs/dbraw/zinc/36/33/15/330363315.db2.gz	GEZCPUGEUTZIDD-INIZCTEOSA-N	1	0	297.402	4.230	20	30		CIEDRO
C=CCCC[N@@H+]1CCC[C@@H]1c1nc2ccccc2s1	ZINC000117870774	330366155	/nfs/dbraw/zinc/36/61/55/330366155.db2.gz	OODDNQGCSJMNKR-CQSZACIVSA-N	1	0	272.417	4.399	20	30		CIEDRO
C=CC[N@@H+](C)[C@@H](C)c1sc(-c2ccccc2)nc1C	ZINC000119415030	330374659	/nfs/dbraw/zinc/37/46/59/330374659.db2.gz	NFBIEQFFSUZWIX-ZDUSSCGKSA-N	1	0	272.417	4.297	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(-c2ccccc2C#N)cc1)C1CC1	ZINC000537012445	330378911	/nfs/dbraw/zinc/37/89/11/330378911.db2.gz	RIOSALFJXWXUIX-CQSZACIVSA-N	1	0	276.383	4.113	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]CC(C)(C)C1CCCC1	ZINC000120123564	330384685	/nfs/dbraw/zinc/38/46/85/330384685.db2.gz	MDTONHCUWWWVMT-UHFFFAOYSA-N	1	0	250.430	4.122	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1coc(-c2cccs2)n1)C1CC1	ZINC000120526644	330389228	/nfs/dbraw/zinc/38/92/28/330389228.db2.gz	LHSAKOVMYPUZMT-CQSZACIVSA-N	1	0	288.416	4.238	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1cc(C#N)ccc1F)c1ccccc1	ZINC000090117782	330390661	/nfs/dbraw/zinc/39/06/61/330390661.db2.gz	DBDGSHXWLGYNGL-LJQANCHMSA-N	1	0	294.373	4.494	20	30		CIEDRO
C[C@@H]1CC(C)(C)CC[C@H]1[NH2+]CCCC(C)(C)C#N	ZINC000120936478	330393341	/nfs/dbraw/zinc/39/33/41/330393341.db2.gz	SQPUGNSJVUOFJD-ZIAGYGMSSA-N	1	0	250.430	4.121	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H](C)c1cccnc1)c1ccccc1	ZINC000090580745	330393713	/nfs/dbraw/zinc/39/37/13/330393713.db2.gz	XOAOBWMPPPHELF-YJBOKZPZSA-N	1	0	266.388	4.440	20	30		CIEDRO
CC[C@@H]1CCCC[C@H]1[N@H+](C)CCCC(C)(C)C#N	ZINC000120901674	330394020	/nfs/dbraw/zinc/39/40/20/330394020.db2.gz	WHFLGPZHMOCYRN-HUUCEWRRSA-N	1	0	250.430	4.217	20	30		CIEDRO
C[C@@H]1[C@H](c2ccccc2)CC[N@@H+]1Cc1cccc(C#N)c1F	ZINC000537047874	330394416	/nfs/dbraw/zinc/39/44/16/330394416.db2.gz	UIYRHIOMQVQIME-RDTXWAMCSA-N	1	0	294.373	4.075	20	30		CIEDRO
N#CCC[C@H]([NH2+][C@H]1CCc2ccccc21)c1ccccc1	ZINC000090664827	330394584	/nfs/dbraw/zinc/39/45/84/330394584.db2.gz	FEGDXTXRNNAJAU-OALUTQOASA-N	1	0	276.383	4.309	20	30		CIEDRO
C[C@H](Cc1ccc(F)cc1)[NH2+][C@H](CCC#N)c1ccccc1	ZINC000090665158	330394591	/nfs/dbraw/zinc/39/45/91/330394591.db2.gz	FMWSLTZAYRRUIR-DNVCBOLYSA-N	1	0	296.389	4.391	20	30		CIEDRO
C[C@H]1C[C@H](c2ccccc2)C[N@@H+]1Cc1cccc(C#N)c1F	ZINC000537048289	330394658	/nfs/dbraw/zinc/39/46/58/330394658.db2.gz	YEXJQZBVYNRSHQ-KSSFIOAISA-N	1	0	294.373	4.075	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](CCC#N)c1ccccc1)C1CCCC1	ZINC000090665086	330394700	/nfs/dbraw/zinc/39/47/00/330394700.db2.gz	AAKSCFIQSXJTEZ-PBHICJAKSA-N	1	0	256.393	4.200	20	30		CIEDRO
C[C@H]([NH2+]CC1(c2ccccc2)CCC1)c1ccc(C#N)cc1	ZINC000537295533	330431590	/nfs/dbraw/zinc/43/15/90/330431590.db2.gz	JDHUVDRJTWCMKD-INIZCTEOSA-N	1	0	290.410	4.331	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C	ZINC000537307254	330432210	/nfs/dbraw/zinc/43/22/10/330432210.db2.gz	OWGJPETUQHUMQL-KBPBESRZSA-N	1	0	276.380	4.299	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+]C1(c2nc(C)cs2)CCC1	ZINC000537431401	330436810	/nfs/dbraw/zinc/43/68/10/330436810.db2.gz	YUWAIDALXMKNTK-CYBMUJFWSA-N	1	0	264.438	4.165	20	30		CIEDRO
Cc1cccc([C@H]([NH2+]C[C@H](C#N)CCC#N)C(C)(C)C)c1	ZINC000515414346	330476729	/nfs/dbraw/zinc/47/67/29/330476729.db2.gz	IEFNOZGKHUHPST-RDJZCZTQSA-N	1	0	283.419	4.115	20	30		CIEDRO
C=CCCCCC[NH2+][C@@H](C)[C@H]1OCCc2sccc21	ZINC000429130856	330538871	/nfs/dbraw/zinc/53/88/71/330538871.db2.gz	ICPBBWXUUPZXBK-XJKSGUPXSA-N	1	0	279.449	4.086	20	30		CIEDRO
CCC(C)(C)C1CCC([NH2+]CC2(CC#N)CC2)CC1	ZINC000430023270	330557536	/nfs/dbraw/zinc/55/75/36/330557536.db2.gz	QFBKPXOIKXEXST-UHFFFAOYSA-N	1	0	262.441	4.265	20	30		CIEDRO
CC[C@H]([NH2+]CC1(CC#N)CC1)c1ccc(Cl)s1	ZINC000430732550	330571854	/nfs/dbraw/zinc/57/18/54/330571854.db2.gz	GLYIPDDTBPAEPA-JTQLQIEISA-N	1	0	268.813	4.136	20	30		CIEDRO
CC[C@@H]([NH2+]CC1(CC#N)CC1)c1ccc(OC(F)F)cc1	ZINC000430742485	330572268	/nfs/dbraw/zinc/57/22/68/330572268.db2.gz	OSUISUTZKNBVOV-CQSZACIVSA-N	1	0	294.345	4.023	20	30		CIEDRO
CCc1c2ccccc2oc1[C@@H](C)[NH2+]CC1(CC#N)CC1	ZINC000430748971	330572875	/nfs/dbraw/zinc/57/28/75/330572875.db2.gz	SPVJXIGTVJBZFM-CYBMUJFWSA-N	1	0	282.387	4.340	20	30		CIEDRO
CC1(C)CC([NH2+]C2CCC(Oc3ccccc3C#N)CC2)C1	ZINC000433286531	330622415	/nfs/dbraw/zinc/62/24/15/330622415.db2.gz	UWJKKMOSPFXYPH-UHFFFAOYSA-N	1	0	298.430	4.026	20	30		CIEDRO
N#Cc1cccc(C[NH+]2CCC(F)(c3ccccc3)CC2)c1	ZINC000434493286	330640009	/nfs/dbraw/zinc/64/00/09/330640009.db2.gz	LJFLETAIASEDLZ-UHFFFAOYSA-N	1	0	294.373	4.019	20	30		CIEDRO
C=C(C)[C@H]1OCC[C@@H]1C[NH2+]Cc1ccc(-c2ccccc2)o1	ZINC000435735279	330661209	/nfs/dbraw/zinc/66/12/09/330661209.db2.gz	LFSPIOOUYUWQBJ-VQIMIIECSA-N	1	0	297.398	4.017	20	30		CIEDRO
CSc1ccc(CC[NH2+][C@@H](C)c2cccc(C#N)c2)cc1	ZINC000435786028	330663115	/nfs/dbraw/zinc/66/31/15/330663115.db2.gz	RCOWEYLOPDIUCX-AWEZNQCLSA-N	1	0	296.439	4.173	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@@H](C)CCC1CCCCC1	ZINC000436294958	330674116	/nfs/dbraw/zinc/67/41/16/330674116.db2.gz	XWTSXDYHKDBXQA-JQHSSLGASA-N	1	0	279.468	4.306	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@H](CC)c1ccc(C)cc1	ZINC000436297455	330674372	/nfs/dbraw/zinc/67/43/72/330674372.db2.gz	XTSZVYYFMCRATN-KURKYZTESA-N	1	0	273.420	4.017	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@@H](CCC)C1CCCCC1	ZINC000436301614	330674675	/nfs/dbraw/zinc/67/46/75/330674675.db2.gz	MQHRUMWDYRLHEH-SQNIBIBYSA-N	1	0	279.468	4.306	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+][C@H](c1ccc(C)o1)C1CCC1	ZINC000436312420	330675497	/nfs/dbraw/zinc/67/54/97/330675497.db2.gz	JSTJXQYRFUTBEB-SZMVWBNQSA-N	1	0	289.419	4.000	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+]CC[C@H](C)CCC=C(C)C	ZINC000437257131	330696162	/nfs/dbraw/zinc/69/61/62/330696162.db2.gz	JLFNDLWKECIDFP-KURKYZTESA-N	1	0	279.468	4.330	20	30		CIEDRO
CC(C)([NH2+]Cc1ccc(C#N)cc1Cl)c1cccs1	ZINC000439449989	330738371	/nfs/dbraw/zinc/73/83/71/330738371.db2.gz	IYCROFNGIWFFGY-UHFFFAOYSA-N	1	0	290.819	4.298	20	30		CIEDRO
N#CC1CCC(C[NH2+][C@H]2CCC[C@@H](C(F)(F)F)C2)CC1	ZINC000441332249	330765771	/nfs/dbraw/zinc/76/57/71/330765771.db2.gz	JQUWWZMUNXPKHO-PQAZSJQKSA-N	1	0	288.357	4.027	20	30		CIEDRO
CCC[C@@H](C[NH2+]CC1CCC(C#N)CC1)c1ccccc1	ZINC000441363702	330766766	/nfs/dbraw/zinc/76/67/66/330766766.db2.gz	XZFKVJWQNNHXOX-TVPLGVNVSA-N	1	0	284.447	4.490	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+]Cc2ccccc2Oc2ccccc2)C1	ZINC000442763693	330781387	/nfs/dbraw/zinc/78/13/87/330781387.db2.gz	BIJBNFHLDIEISZ-WBVHZDCISA-N	1	0	292.382	4.261	20	30		CIEDRO
C[C@H](C[NH2+][C@@H]1CC[C@H](C#N)C1)c1c(Cl)cccc1Cl	ZINC000442782863	330782753	/nfs/dbraw/zinc/78/27/53/330782753.db2.gz	SFXFPUVTOVWTCO-GRYCIOLGSA-N	1	0	297.229	4.379	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH2+]CCCc2ccc(Cl)cc2Cl)C1	ZINC000442790528	330783841	/nfs/dbraw/zinc/78/38/41/330783841.db2.gz	LRDSKRXUMMJSBK-BXUZGUMPSA-N	1	0	297.229	4.208	20	30		CIEDRO
CCC(CC)(C[NH2+][C@@H]1CC[C@H](C#N)C1)c1ccccc1	ZINC000442798176	330784481	/nfs/dbraw/zinc/78/44/81/330784481.db2.gz	YDMIJIRYYBEBQK-DOTOQJQBSA-N	1	0	270.420	4.026	20	30		CIEDRO
Cc1cc(C[NH2+][C@@H]2CC[C@H](C#N)C2)ccc1-c1ccccc1	ZINC000442831758	330785836	/nfs/dbraw/zinc/78/58/36/330785836.db2.gz	BJHICMRTXAJOSL-QFBILLFUSA-N	1	0	290.410	4.444	20	30		CIEDRO
Cc1c(C)c(C)c(C[NH2+][C@H]2CC[C@@H](C#N)C2)c(C)c1C	ZINC000442833555	330785978	/nfs/dbraw/zinc/78/59/78/330785978.db2.gz	VAWHSLWLFBCFTA-SJORKVTESA-N	1	0	270.420	4.011	20	30		CIEDRO
C[C@H]([NH2+]CC1CCC(C#N)CC1)c1ccc2c(c1)CCC2	ZINC000442865456	330788502	/nfs/dbraw/zinc/78/85/02/330788502.db2.gz	FXGMTWRTRLYLJE-FHERZECASA-N	1	0	282.431	4.156	20	30		CIEDRO
C[C@H](CCCC(F)(F)F)[NH2+]CC1CCC(C#N)CC1	ZINC000442867134	330788602	/nfs/dbraw/zinc/78/86/02/330788602.db2.gz	KHUOHSNFIMNAPE-PNESKVBLSA-N	1	0	276.346	4.027	20	30		CIEDRO
CC(C)(CCCc1ccccc1)C[NH2+][C@H]1CC[C@@H](C#N)C1	ZINC000442870784	330789136	/nfs/dbraw/zinc/78/91/36/330789136.db2.gz	DQSQTIXZALTGLY-MSOLQXFVSA-N	1	0	284.447	4.317	20	30		CIEDRO
N#CC1CCC(C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2)CC1	ZINC000442872880	330789342	/nfs/dbraw/zinc/78/93/42/330789342.db2.gz	JFNXAQFMUYGVNT-GHBBCFCZSA-N	1	0	296.458	4.317	20	30		CIEDRO
CC1=CCC[C@H](C)[C@H]1C[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000443641545	330804565	/nfs/dbraw/zinc/80/45/65/330804565.db2.gz	LYMZLHLDJJOSGJ-MPGHIAIKSA-N	1	0	268.404	4.201	20	30		CIEDRO
Cc1c2ccccc2oc1C[NH2+]Cc1ccc(C#N)c(C)c1	ZINC000444005188	330809071	/nfs/dbraw/zinc/80/90/71/330809071.db2.gz	VQRRBTJRRLXLQC-UHFFFAOYSA-N	1	0	290.366	4.211	20	30		CIEDRO
CC(C)CCOC1CC[NH+](CCCCC(C)(C)C#N)CC1	ZINC000444601495	330814975	/nfs/dbraw/zinc/81/49/75/330814975.db2.gz	WFBYEJJYBRBCCK-UHFFFAOYSA-N	1	0	294.483	4.234	20	30		CIEDRO
CCc1cnccc1[C@@H](C)[NH2+]CCCCC(C)(C)C#N	ZINC000444674084	330818455	/nfs/dbraw/zinc/81/84/55/330818455.db2.gz	JWYUBMKWBLNZDM-CQSZACIVSA-N	1	0	273.424	4.015	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+]CCCCCc2ccc(F)cc2)C1	ZINC000446792894	330854234	/nfs/dbraw/zinc/85/42/34/330854234.db2.gz	AZJJBCWTUZJVOZ-FUHWJXTLSA-N	1	0	288.410	4.210	20	30		CIEDRO
C=C(C)CC[NH2+]C(c1ccccc1)c1ccccc1	ZINC000160208680	330861209	/nfs/dbraw/zinc/86/12/09/330861209.db2.gz	OPOXCRVXIQPKFT-UHFFFAOYSA-N	1	0	251.373	4.332	20	30		CIEDRO
CC[C@@H]([NH2+]CC1CCCCC1)c1ccc(C#N)cc1	ZINC000447511536	330867273	/nfs/dbraw/zinc/86/72/73/330867273.db2.gz	MKNOMGFHGKHYQT-QGZVFWFLSA-N	1	0	256.393	4.179	20	30		CIEDRO
CC[C@H]([NH2+]CCc1ccc(F)cc1C)c1ccc(C#N)cc1	ZINC000447579455	330871067	/nfs/dbraw/zinc/87/10/67/330871067.db2.gz	KSLJLRBSDNSUTL-IBGZPJMESA-N	1	0	296.389	4.289	20	30		CIEDRO
CC[C@@H]([NH2+][C@H]1CCCC(F)(F)C1)c1ccc(C#N)cc1	ZINC000447581351	330871148	/nfs/dbraw/zinc/87/11/48/330871148.db2.gz	UDLDTXPDCCLFJN-LSDHHAIUSA-N	1	0	278.346	4.177	20	30		CIEDRO
CCc1cnccc1[C@@H](C)[NH2+][C@@H](CC)c1ccc(C#N)cc1	ZINC000447581742	330871149	/nfs/dbraw/zinc/87/11/49/330871149.db2.gz	VVDDOPXEMPCADQ-KUHUBIRLSA-N	1	0	293.414	4.318	20	30		CIEDRO
CC[C@H]([NH2+]C1(c2ccc(F)cc2)CC1)c1ccc(C#N)cc1	ZINC000447585405	330871520	/nfs/dbraw/zinc/87/15/20/330871520.db2.gz	KBNBVJIFFZVNJO-SFHVURJKSA-N	1	0	294.373	4.427	20	30		CIEDRO
CC[C@H]([NH2+][C@@H](C)CCC1CC1)c1ccc(C#N)cc1	ZINC000447592419	330872303	/nfs/dbraw/zinc/87/23/03/330872303.db2.gz	LKDBKBNBLAWAHD-GUYCJALGSA-N	1	0	256.393	4.178	20	30		CIEDRO
Cc1ccc2c(c1)CC[C@H]2[NH2+]C1CCC(C)(C#N)CC1	ZINC000449096635	330898788	/nfs/dbraw/zinc/89/87/88/330898788.db2.gz	JEGFGDNDKWJKJU-IIIMJFFVSA-N	1	0	268.404	4.044	20	30		CIEDRO
Cc1cc(C)c(C[NH2+]C2CCC(C)(C#N)CC2)c(C)c1	ZINC000449109256	330899659	/nfs/dbraw/zinc/89/96/59/330899659.db2.gz	XOJXTIOBQIVYCN-UHFFFAOYSA-N	1	0	270.420	4.174	20	30		CIEDRO
CC(C)(C)CCCC[NH2+]C1CCC(C)(C#N)CC1	ZINC000449130449	330900882	/nfs/dbraw/zinc/90/08/82/330900882.db2.gz	ZCFSZCSRMNISDV-UHFFFAOYSA-N	1	0	250.430	4.265	20	30		CIEDRO
CC(C)[C@H]1CCC[C@@H]([NH2+]C2CCC(C)(C#N)CC2)C1	ZINC000449134946	330901128	/nfs/dbraw/zinc/90/11/28/330901128.db2.gz	MJCWBQSOQJBNGK-ORBLRFAASA-N	1	0	262.441	4.263	20	30		CIEDRO
Cc1ccc([C@H](C)C[NH2+]C2CCC(C)(C#N)CC2)cc1	ZINC000449159553	330902542	/nfs/dbraw/zinc/90/25/42/330902542.db2.gz	HHGRWBKHKKBGJC-FAEJEUNOSA-N	1	0	270.420	4.161	20	30		CIEDRO
Cc1cccc([C@@H](C)C[NH2+]C2CCC(C)(C#N)CC2)c1	ZINC000449161218	330902566	/nfs/dbraw/zinc/90/25/66/330902566.db2.gz	DSOOLIPGXNAREM-ZLPCBKJTSA-N	1	0	270.420	4.161	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+]C[C@H](C)c1c(C)noc1C	ZINC000449185378	330904659	/nfs/dbraw/zinc/90/46/59/330904659.db2.gz	HQPXFXSXJIJJRT-QWHCGFSZSA-N	1	0	264.413	4.119	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+]CCC[C@H]1CCCCO1	ZINC000449243575	330909154	/nfs/dbraw/zinc/90/91/54/330909154.db2.gz	LTULTADAGBOSMC-JKSUJKDBSA-N	1	0	253.430	4.060	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+]CCC[C@@H]1CCCCO1	ZINC000449243572	330909161	/nfs/dbraw/zinc/90/91/61/330909161.db2.gz	LTULTADAGBOSMC-CVEARBPZSA-N	1	0	253.430	4.060	20	30		CIEDRO
COCCC1(C[NH2+]C2CCC(C)(C#N)CC2)CCCCC1	ZINC000449256322	330910300	/nfs/dbraw/zinc/91/03/00/330910300.db2.gz	IAEYTKJBMKFAKL-UHFFFAOYSA-N	1	0	292.467	4.035	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+][C@@H](C)c1nc(C(C)(C)C)no1	ZINC000449280562	330911521	/nfs/dbraw/zinc/91/15/21/330911521.db2.gz	XWMKGNKTZFGSMC-OLZOCXBDSA-N	1	0	279.428	4.153	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@H]2CCCc3ccc(F)cc32)CC1	ZINC000449296333	330912473	/nfs/dbraw/zinc/91/24/73/330912473.db2.gz	YUFRTOGGEOBYFW-NXYGQSRBSA-N	1	0	286.394	4.265	20	30		CIEDRO
N#CCC1(C[NH2+][C@@H]2CC[C@H](c3ccc(Cl)cc3)C2)CC1	ZINC000449299439	330912957	/nfs/dbraw/zinc/91/29/57/330912957.db2.gz	MIJJFRLXTDYIMT-GOEBONIOSA-N	1	0	288.822	4.260	20	30		CIEDRO
C[C@H](Cc1coc2ccccc12)[NH2+]CC1CCC(C#N)CC1	ZINC000449302106	330913208	/nfs/dbraw/zinc/91/32/08/330913208.db2.gz	IZGJXADRPANNAR-QQFBHYJXSA-N	1	0	296.414	4.283	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+]CCCc1cccc(C)n1	ZINC000449313976	330913887	/nfs/dbraw/zinc/91/38/87/330913887.db2.gz	BLPLPZGMNNQEJV-OAHLLOKOSA-N	1	0	260.425	4.047	20	30		CIEDRO
Cc1cc(C[NH2+][C@H]2CCCc3c(F)cccc32)ccc1C#N	ZINC000449352125	330917661	/nfs/dbraw/zinc/91/76/61/330917661.db2.gz	SNOUIDKOBGQAJT-IBGZPJMESA-N	1	0	294.373	4.173	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+][C@H]2CCCc3c(F)cc(F)cc32)C1	ZINC000449352760	330917781	/nfs/dbraw/zinc/91/77/81/330917781.db2.gz	WGXWTQGMELCFHS-PPHDSNJXSA-N	1	0	290.357	4.014	20	30		CIEDRO
CC(C)C[C@H](C)C[C@@H](C)[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000449446340	330926368	/nfs/dbraw/zinc/92/63/68/330926368.db2.gz	PJBVEAMTQTYKLG-FZKCQIBNSA-N	1	0	250.430	4.119	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)C1CCC(C(F)(F)F)CC1	ZINC000449471940	330928500	/nfs/dbraw/zinc/92/85/00/330928500.db2.gz	DMZZHSAPOJDUJB-HIFPTAJRSA-N	1	0	263.347	4.299	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)[C@H](C)c1nc2ccccc2s1	ZINC000449479939	330929227	/nfs/dbraw/zinc/92/92/27/330929227.db2.gz	WRRZLHDLDCVKQZ-STQMWFEESA-N	1	0	274.433	4.344	20	30		CIEDRO
C=CC(C)(C)C[NH2+]CC1CCC(C(F)(F)F)CC1	ZINC000449485562	330930008	/nfs/dbraw/zinc/93/00/08/330930008.db2.gz	NUZPFMDRHSJWTF-UHFFFAOYSA-N	1	0	263.347	4.157	20	30		CIEDRO
Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C#N)c(F)c1)[C@@H](C)C2	ZINC000449736158	330947147	/nfs/dbraw/zinc/94/71/47/330947147.db2.gz	LIBSOSICHAXQIX-DJJJIMSYSA-N	1	0	294.373	4.029	20	30		CIEDRO
C[C@@](Cc1ccccc1)([NH2+]Cc1cc(C#N)cs1)C1CC1	ZINC000449777868	330949593	/nfs/dbraw/zinc/94/95/93/330949593.db2.gz	QXDFMQXDEOVBKV-SFHVURJKSA-N	1	0	296.439	4.121	20	30		CIEDRO
CC(C)C[C@@H]([NH2+]CC1(C#N)CCC1)c1ccccc1	ZINC000450665704	330991999	/nfs/dbraw/zinc/99/19/99/330991999.db2.gz	WWMHMJBEAUCQKD-MRXNPFEDSA-N	1	0	256.393	4.057	20	30		CIEDRO
CC[C@@H]([NH2+]CC1(C#N)CCC1)C(C)(C)c1ccccc1	ZINC000450689640	330993859	/nfs/dbraw/zinc/99/38/59/330993859.db2.gz	SWHFZGVVZUZQAQ-MRXNPFEDSA-N	1	0	270.420	4.026	20	30		CIEDRO
CCO[C@@H]1C[C@H]([NH2+]CCCCC(C)(C)C#N)C12CCCC2	ZINC000450968167	331009213	/nfs/dbraw/zinc/00/92/13/331009213.db2.gz	JZYUIIINAYPZNG-JKSUJKDBSA-N	1	0	292.467	4.034	20	30		CIEDRO
CC(C)(C#N)CC[NH2+][C@H]1CCCC[C@H]1CC(F)(F)F	ZINC000451297426	331023668	/nfs/dbraw/zinc/02/36/68/331023668.db2.gz	OEDUWXPPEGVMIO-RYUDHWBXSA-N	1	0	276.346	4.027	20	30		CIEDRO
FC(F)(F)C[C@@H]1CCCC[C@@H]1[NH2+]CC#Cc1ccccc1	ZINC000451300310	331023748	/nfs/dbraw/zinc/02/37/48/331023748.db2.gz	UIKGWOQJCYYULL-HOTGVXAUSA-N	1	0	295.348	4.139	20	30		CIEDRO
CC(C)(C#N)CC[NH2+][C@H](c1ccc(F)c(Cl)c1)C1CC1	ZINC000451354373	331025428	/nfs/dbraw/zinc/02/54/28/331025428.db2.gz	MVPBPJAONAOXLY-HNNXBMFYSA-N	1	0	294.801	4.460	20	30		CIEDRO
C=CCCC[N@@H+]1CCCC[C@H]1c1nc2ccccc2[nH]1	ZINC000451880108	331046023	/nfs/dbraw/zinc/04/60/23/331046023.db2.gz	UQRICWQRNIIXOI-INIZCTEOSA-N	1	0	269.392	4.056	20	30		CIEDRO
CC(C)[N@H+](CCCC(C)(C)C#N)C1CC(C)(C)C1	ZINC000452101826	331054187	/nfs/dbraw/zinc/05/41/87/331054187.db2.gz	GYNXBTRJJBWYQX-UHFFFAOYSA-N	1	0	250.430	4.215	20	30		CIEDRO
CSc1ccccc1[C@H](C)[NH2+]Cc1cccc(C#N)c1	ZINC000194845855	331064563	/nfs/dbraw/zinc/06/45/63/331064563.db2.gz	IWMSGHWYPORTPH-ZDUSSCGKSA-N	1	0	282.412	4.131	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)c1ccc(Oc2ccccc2)cn1	ZINC000453145905	331093996	/nfs/dbraw/zinc/09/39/96/331093996.db2.gz	NWWQKYYDXOURKX-GJZGRUSLSA-N	1	0	282.387	4.489	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@H](C)c1cc(-c2ccccc2)nn1C	ZINC000453210436	331101759	/nfs/dbraw/zinc/10/17/59/331101759.db2.gz	JTKXILLALLMURB-ZBFHGGJFSA-N	1	0	283.419	4.092	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCCc2c(F)cccc21)c1cccc(C#N)c1	ZINC000453225023	331103578	/nfs/dbraw/zinc/10/35/78/331103578.db2.gz	CUVFSJLZKHCAEK-ORAYPTAESA-N	1	0	294.373	4.426	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@H](C)c1ncc(-c2ccccc2)n1C	ZINC000453232356	331104689	/nfs/dbraw/zinc/10/46/89/331104689.db2.gz	YRFRBIITKFKSEN-ZBFHGGJFSA-N	1	0	283.419	4.092	20	30		CIEDRO
CC(F)(F)CCC[NH2+][C@@H]1CCCCc2cc(C#N)ccc21	ZINC000453241112	331106094	/nfs/dbraw/zinc/10/60/94/331106094.db2.gz	VGTUVHDDVKZQEC-MRXNPFEDSA-N	1	0	292.373	4.351	20	30		CIEDRO
CC(C)(C)[C@@H]1CCCC[C@H]1[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000453286477	331111254	/nfs/dbraw/zinc/11/12/54/331111254.db2.gz	DBEVASHTZILYJZ-CAOSSQGBSA-N	1	0	262.441	4.263	20	30		CIEDRO
C[C@@H]1CCc2c(F)cccc2[C@H]1[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000453287331	331111267	/nfs/dbraw/zinc/11/12/67/331111267.db2.gz	FEUJPZHNOAXMMC-COJSNBRMSA-N	1	0	286.394	4.121	20	30		CIEDRO
Cc1cc([C@H](C)[NH2+][C@H]2CC[C@@H](CC#N)C2)cc(C)c1F	ZINC000453289807	331111659	/nfs/dbraw/zinc/11/16/59/331111659.db2.gz	JDSSRWUPCMTJOV-DZKIICNBSA-N	1	0	274.383	4.176	20	30		CIEDRO
CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000453294096	331112328	/nfs/dbraw/zinc/11/23/28/331112328.db2.gz	QSSZNFCKSYDXJP-XAJHFOFHSA-N	1	0	262.441	4.119	20	30		CIEDRO
Cc1cc2c(cc1C)[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)CCCO2	ZINC000453295067	331112435	/nfs/dbraw/zinc/11/24/35/331112435.db2.gz	RMEOFORFGPDLEQ-BQFCYCMXSA-N	1	0	298.430	4.189	20	30		CIEDRO
Cc1ccc([C@@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)C2CCC2)o1	ZINC000453296948	331112547	/nfs/dbraw/zinc/11/25/47/331112547.db2.gz	UZHFBXHVWHSHOE-QRTARXTBSA-N	1	0	272.392	4.101	20	30		CIEDRO
C[C@H]1CC[C@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)c2sccc21	ZINC000453296165	331112562	/nfs/dbraw/zinc/11/25/62/331112562.db2.gz	UGYGWEKOLGLVCS-ABHRYQDASA-N	1	0	274.433	4.358	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@@H](c1ccccc1)c1ccc(F)cn1	ZINC000453303815	331113621	/nfs/dbraw/zinc/11/36/21/331113621.db2.gz	DHEIWMAEACYODJ-KRWDZBQOSA-N	1	0	284.378	4.112	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@@H](C)c1nccc2ccccc21	ZINC000453309651	331114427	/nfs/dbraw/zinc/11/44/27/331114427.db2.gz	QDCUWUXSIPPOKQ-ZDUSSCGKSA-N	1	0	254.377	4.098	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1sc(-c2cccnc2)nc1C	ZINC000453325851	331117043	/nfs/dbraw/zinc/11/70/43/331117043.db2.gz	USGXHJMNZFFMBU-LBPRGKRZSA-N	1	0	287.432	4.130	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@H]1CCO[C@@H](c2cccs2)C1)C1CC1	ZINC000453349126	331120318	/nfs/dbraw/zinc/12/03/18/331120318.db2.gz	AZLCHPUSZXUHRJ-HRCADAONSA-N	1	0	291.460	4.303	20	30		CIEDRO
CC1(C)Cc2occc2[C@H]([NH2+]Cc2ccc(C#N)c(F)c2)C1	ZINC000453379970	331125610	/nfs/dbraw/zinc/12/56/10/331125610.db2.gz	KEZOFPLDPMWJPX-MRXNPFEDSA-N	1	0	298.361	4.094	20	30		CIEDRO
Cc1cccc([C@@H](C)[NH2+][C@@H](C)c2ccc(C#N)c(F)c2)c1	ZINC000453383209	331126151	/nfs/dbraw/zinc/12/61/51/331126151.db2.gz	CCBNOVACFSNPML-KGLIPLIRSA-N	1	0	282.362	4.418	20	30		CIEDRO
CC1(C)C[C@@H]([NH2+]Cc2ccc(C#N)c(F)c2)c2ccccc21	ZINC000453396119	331128020	/nfs/dbraw/zinc/12/80/20/331128020.db2.gz	YEKLYUQESUPXMA-GOSISDBHSA-N	1	0	294.373	4.210	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+][C@@H]1CCO[C@@H](c2cccs2)C1	ZINC000453428161	331131134	/nfs/dbraw/zinc/13/11/34/331131134.db2.gz	PCFJDTIRFZNAFE-GBJTYRQASA-N	1	0	279.449	4.159	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1Cc2sccc2CC1(C)C	ZINC000459578750	331288937	/nfs/dbraw/zinc/28/89/37/331288937.db2.gz	IZEKFRZWOPWKLP-UHFFFAOYSA-N	1	0	276.449	4.215	20	30		CIEDRO
C[C@@H](CCCc1cccnc1)[NH2+]CCCCC(C)(C)C#N	ZINC000459632850	331291354	/nfs/dbraw/zinc/29/13/54/331291354.db2.gz	GBQPZJLUNDBDNA-INIZCTEOSA-N	1	0	287.451	4.102	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@@H](C)c1cncc(F)c1	ZINC000459644588	331291807	/nfs/dbraw/zinc/29/18/07/331291807.db2.gz	FBRMMNVCMCXTML-WFASDCNBSA-N	1	0	250.361	4.006	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@H](C)CCCc1cccnc1	ZINC000459647484	331292052	/nfs/dbraw/zinc/29/20/52/331292052.db2.gz	JZWPTQUGWFNYCK-WBVHZDCISA-N	1	0	260.425	4.127	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+][C@@H](C)CCCc1cccnc1	ZINC000459647480	331292089	/nfs/dbraw/zinc/29/20/89/331292089.db2.gz	JZWPTQUGWFNYCK-DOTOQJQBSA-N	1	0	260.425	4.127	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@@H](C)CCCc1cccnc1	ZINC000459647483	331292103	/nfs/dbraw/zinc/29/21/03/331292103.db2.gz	JZWPTQUGWFNYCK-RDJZCZTQSA-N	1	0	260.425	4.127	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@@H](C)c1cncc(F)c1	ZINC000459653264	331292374	/nfs/dbraw/zinc/29/23/74/331292374.db2.gz	XQIYPMOCNHRYQC-STQMWFEESA-N	1	0	250.361	4.006	20	30		CIEDRO
C[C@@H]([NH2+]CC(C)(C)CC#N)C1CCC(C(F)(F)F)CC1	ZINC000459660103	331292733	/nfs/dbraw/zinc/29/27/33/331292733.db2.gz	AWVSLDFUXLICLO-PNESKVBLSA-N	1	0	290.373	4.273	20	30		CIEDRO
C/C(=C\c1ccc(Cl)cc1)C[NH2+]CC(C)(C)CC#N	ZINC000459727261	331296148	/nfs/dbraw/zinc/29/61/48/331296148.db2.gz	GAPBVMHTEYOJBH-JLHYYAGUSA-N	1	0	276.811	4.273	20	30		CIEDRO
C[C@@H](Cc1cccc(F)c1)[N@H+](C)CC(C)(C)CCC#N	ZINC000459768630	331299743	/nfs/dbraw/zinc/29/97/43/331299743.db2.gz	XSTNQVMERHWOCG-AWEZNQCLSA-N	1	0	276.399	4.018	20	30		CIEDRO
C=CC[C@@H](C)[NH2+]C(c1ccccc1)c1ccccc1	ZINC000166145381	331306730	/nfs/dbraw/zinc/30/67/30/331306730.db2.gz	OSFDGLGXXOSAHQ-OAHLLOKOSA-N	1	0	251.373	4.330	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+]C[C@H](c1ccco1)N1CCCCC1	ZINC000461796484	331314811	/nfs/dbraw/zinc/31/48/11/331314811.db2.gz	ONHQANFMIDCCOE-IAGOWNOFSA-N	1	0	290.451	4.141	20	30		CIEDRO
CCC[C@H](CCc1ccccc1)[NH2+][C@H]1CCC[C@@H]1C#N	ZINC000462066455	331317147	/nfs/dbraw/zinc/31/71/47/331317147.db2.gz	HOWPAWBABVNOEW-KURKYZTESA-N	1	0	270.420	4.070	20	30		CIEDRO
C=C(C[NH2+][C@@H](C)CCc1ccsc1)c1ccccc1	ZINC000462787183	331329045	/nfs/dbraw/zinc/32/90/45/331329045.db2.gz	ADWYNDDWSJNXJV-HNNXBMFYSA-N	1	0	271.429	4.372	20	30		CIEDRO
C=C[C@H](C)[NH2+][C@@H](C)c1csc(-c2ccccc2F)n1	ZINC000462817563	331330084	/nfs/dbraw/zinc/33/00/84/331330084.db2.gz	OHDMOUIEEUPURL-QWRGUYRKSA-N	1	0	276.380	4.174	20	30		CIEDRO
C=CCCOCC[NH2+][C@H](C)c1ccc(OC(C)(C)C)cc1	ZINC000463024207	331337427	/nfs/dbraw/zinc/33/74/27/331337427.db2.gz	ODRNGHVZQHNHIB-OAHLLOKOSA-N	1	0	291.435	4.107	20	30		CIEDRO
C[N@H+](Cc1cccc(C#N)c1)[C@H]1CCCC[C@H]1C(F)(F)F	ZINC000463036539	331338149	/nfs/dbraw/zinc/33/81/49/331338149.db2.gz	ULPPLMXXTARQAY-CABCVRRESA-N	1	0	296.336	4.111	20	30		CIEDRO
C=C1CC[NH+](CCCCCn2c(C)nc3ccccc32)CC1	ZINC000463075625	331339625	/nfs/dbraw/zinc/33/96/25/331339625.db2.gz	BFYZFTYCPLWLGL-UHFFFAOYSA-N	1	0	297.446	4.167	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCCC1CCOCC1)c1ccccc1	ZINC000463236680	331343520	/nfs/dbraw/zinc/34/35/20/331343520.db2.gz	JSQIGDKOTDQSOZ-IBGZPJMESA-N	1	0	287.447	4.490	20	30		CIEDRO
CC(C)c1ccc(C[C@@H](C)[NH2+][C@@H]2CCC[C@@H](C#N)C2)cc1	ZINC000463238205	331343590	/nfs/dbraw/zinc/34/35/90/331343590.db2.gz	PCGNVQJFJDLGAJ-SZVBFZGTSA-N	1	0	284.447	4.413	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)C(C)(C)c1ccccc1	ZINC000463240478	331343742	/nfs/dbraw/zinc/34/37/42/331343742.db2.gz	QXNXOYKQUFQZLG-NXHRZFHOSA-N	1	0	284.447	4.415	20	30		CIEDRO
CCc1ccc(C(C)(C)C[NH2+][C@@H]2CCC[C@H](C#N)C2)cc1	ZINC000463241146	331343794	/nfs/dbraw/zinc/34/37/94/331343794.db2.gz	CWVZAZXZXIPSJL-FUHWJXTLSA-N	1	0	284.447	4.199	20	30		CIEDRO
CC1(C)CCc2ccccc2[C@@H]1[NH2+][C@H]1CCC[C@@H](C#N)C1	ZINC000463242885	331343873	/nfs/dbraw/zinc/34/38/73/331343873.db2.gz	LTRLMDFLDFDOSO-HFTRVMKXSA-N	1	0	282.431	4.372	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)[C@@H](C)C1CCCCC1	ZINC000463243926	331343912	/nfs/dbraw/zinc/34/39/12/331343912.db2.gz	FHQMUZHRQQHUGK-WBTNSWJXSA-N	1	0	262.441	4.263	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)c1ccccc1C(F)(F)F	ZINC000463243323	331344014	/nfs/dbraw/zinc/34/40/14/331344014.db2.gz	OSAGSTHTVRUMMD-YNEHKIRRSA-N	1	0	296.336	4.438	20	30		CIEDRO
CC(C)(C)[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CCC[C@H](C#N)C1	ZINC000463279613	331344883	/nfs/dbraw/zinc/34/48/83/331344883.db2.gz	KARLRISMFZKIIU-JONQDZQNSA-N	1	0	262.441	4.263	20	30		CIEDRO
CC(C)(C[NH2+][C@H]1CCC[C@@H](C#N)C1)c1ccccc1Cl	ZINC000463284814	331345115	/nfs/dbraw/zinc/34/51/15/331345115.db2.gz	QRGCULQZVIABFT-KGLIPLIRSA-N	1	0	290.838	4.290	20	30		CIEDRO
CC(C)(C[NH2+][C@H]1CCC[C@H](C#N)C1)c1ccc(Cl)cc1	ZINC000463296677	331345631	/nfs/dbraw/zinc/34/56/31/331345631.db2.gz	WGQZAFXVKSGWQE-BBRMVZONSA-N	1	0	290.838	4.290	20	30		CIEDRO
CCC[N@H+](CCc1cccs1)Cc1ccc(CC#N)cc1	ZINC000464582732	331363240	/nfs/dbraw/zinc/36/32/40/331363240.db2.gz	PEAZFPCOOHTJJQ-UHFFFAOYSA-N	1	0	298.455	4.269	20	30		CIEDRO
C=C(C)C[N@@H+]1Cc2ccccc2C[C@H]1c1ccccc1	ZINC000464726920	331365489	/nfs/dbraw/zinc/36/54/89/331365489.db2.gz	AVWKZUUINBOPKP-IBGZPJMESA-N	1	0	263.384	4.362	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1cc(Cl)c(OC)c(OCC)c1	ZINC000466385473	331394354	/nfs/dbraw/zinc/39/43/54/331394354.db2.gz	FYLGNGDFBJTDHC-CYBMUJFWSA-N	1	0	297.826	4.192	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1cccc(OCc2ccccn2)c1	ZINC000466400397	331394965	/nfs/dbraw/zinc/39/49/65/331394965.db2.gz	CSQWTUJZXRUKSN-QGZVFWFLSA-N	1	0	296.414	4.105	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1cc(Cl)cc2cccnc21	ZINC000466401244	331395042	/nfs/dbraw/zinc/39/50/42/331395042.db2.gz	YTQGUPIDXGZXIT-OAHLLOKOSA-N	1	0	274.795	4.333	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1ccc(OC)c(OCC(=C)C)c1	ZINC000466400891	331395125	/nfs/dbraw/zinc/39/51/25/331395125.db2.gz	GAORFLZPLGICFG-MRXNPFEDSA-N	1	0	289.419	4.094	20	30		CIEDRO
N#Cc1cccc(CC[NH2+]Cc2csc3ccccc23)c1	ZINC000466426648	331396735	/nfs/dbraw/zinc/39/67/35/331396735.db2.gz	WAZROPUETFMXDJ-UHFFFAOYSA-N	1	0	292.407	4.105	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@@H](C)[C@H](C)c1ccc(OC)cc1	ZINC000467405778	331417793	/nfs/dbraw/zinc/41/77/93/331417793.db2.gz	HHZFXNFMZBPHNA-DZKIICNBSA-N	1	0	261.409	4.132	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@@H](C)[C@H](C)c1ccc(OC)c(OC)c1	ZINC000467406958	331417852	/nfs/dbraw/zinc/41/78/52/331417852.db2.gz	RHMQTBCBYIXRQR-DZKIICNBSA-N	1	0	291.435	4.140	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@@H]1CCC[C@H](c2ncccc2C)C1	ZINC000467406946	331417857	/nfs/dbraw/zinc/41/78/57/331417857.db2.gz	RFLMVWLWHRFWPG-YESZJQIVSA-N	1	0	272.436	4.361	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@H]1CCCCc2cc(C#N)ccc21	ZINC000467411952	331418071	/nfs/dbraw/zinc/41/80/71/331418071.db2.gz	GFUSFPMOFBFKRU-WMZOPIPTSA-N	1	0	268.404	4.270	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]C1CCC(C#N)(c2ccccc2)CC1	ZINC000467415937	331418309	/nfs/dbraw/zinc/41/83/09/331418309.db2.gz	GBEWRZNRNOMQCW-VIQWUECVSA-N	1	0	282.431	4.335	20	30		CIEDRO
C[C@H]1CCC[C@H]1C[NH2+]C1CCC(C#N)(c2ccccc2)CC1	ZINC000467436831	331419206	/nfs/dbraw/zinc/41/92/06/331419206.db2.gz	DQCXLQMQRHCDIW-BEEJXANESA-N	1	0	296.458	4.416	20	30		CIEDRO
C=CCC[C@H](C)[NH2+]Cc1cccc(-c2cccnc2)c1	ZINC000467641937	331422917	/nfs/dbraw/zinc/42/29/17/331422917.db2.gz	VXVWDJDJOGEHBE-HNNXBMFYSA-N	1	0	266.388	4.193	20	30		CIEDRO
CC(C)[C@@H](C[NH2+]Cc1cc(C#N)cs1)Cc1ccccc1	ZINC000468864780	331441382	/nfs/dbraw/zinc/44/13/82/331441382.db2.gz	GKORDQTZVXHGBS-QGZVFWFLSA-N	1	0	298.455	4.224	20	30		CIEDRO
C[C@H](CCC1CC1)[NH2+]CC#Cc1ccc(C(F)(F)F)cc1	ZINC000469778277	331457926	/nfs/dbraw/zinc/45/79/26/331457926.db2.gz	ZLIYLCYJSUMUDC-CYBMUJFWSA-N	1	0	295.348	4.225	20	30		CIEDRO
C=CCCCC[NH2+][C@H](C)c1cc(F)c(F)c(F)c1	ZINC000471586864	331511420	/nfs/dbraw/zinc/51/14/20/331511420.db2.gz	SBLWOMMLQXCRHQ-SNVBAGLBSA-N	1	0	257.299	4.111	20	30		CIEDRO
CC(C)(C)C[C@H]([NH2+][C@H]1CC[C@@H](C#N)C1)c1ccccc1	ZINC000471605923	331512731	/nfs/dbraw/zinc/51/27/31/331512731.db2.gz	OOGVDSZSILCWDU-PVAVHDDUSA-N	1	0	270.420	4.446	20	30		CIEDRO
CC(C)[C@H]([NH2+][C@H]1CC[C@H](C#N)C1)c1ccc(Cl)cc1	ZINC000471620190	331513816	/nfs/dbraw/zinc/51/38/16/331513816.db2.gz	PDFHJVSRUXCEDO-RCBQFDQVSA-N	1	0	276.811	4.319	20	30		CIEDRO
C=CCCCC[NH2+]Cc1cccc(OCC(F)(F)F)c1	ZINC000472056035	331527925	/nfs/dbraw/zinc/52/79/25/331527925.db2.gz	RKEULEKREKSJEA-UHFFFAOYSA-N	1	0	287.325	4.074	20	30		CIEDRO
CC(C)[C@@H]([NH2+][C@@H](C)CCC#N)c1ccc(Cl)cc1F	ZINC000472466787	331537333	/nfs/dbraw/zinc/53/73/33/331537333.db2.gz	ZMYYWCRTXSJJJF-XHDPSFHLSA-N	1	0	282.790	4.458	20	30		CIEDRO
C=CCC[C@H](O)C[NH2+][C@@H](c1ccccc1)c1ccc(C)cc1	ZINC000472771924	331542898	/nfs/dbraw/zinc/54/28/98/331542898.db2.gz	NWQWSSWGLLRXRC-PMACEKPBSA-N	1	0	295.426	4.001	20	30		CIEDRO
C=CCCOCC[NH2+][C@H](C)[C@H](C)c1ccc(Cl)cc1	ZINC000474884655	331602802	/nfs/dbraw/zinc/60/28/02/331602802.db2.gz	BXHYOIGIEOWEIE-UONOGXRCSA-N	1	0	281.827	4.014	20	30		CIEDRO
C=CCCCC[NH2+][C@@H](C)[C@H](C)c1ccc(OC)c(OC)c1	ZINC000474924527	331604164	/nfs/dbraw/zinc/60/41/64/331604164.db2.gz	SZUUSZMBTTYWEW-GJZGRUSLSA-N	1	0	291.435	4.142	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+][C@@H](C)c1ccc(Br)cn1	ZINC000475507896	331634382	/nfs/dbraw/zinc/63/43/82/331634382.db2.gz	BKIFHQUKIAAMNK-WCQYABFASA-N	1	0	297.240	4.240	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@@H]2CC[C@H](c3cccc(F)c3)C2)c1	ZINC000475556381	331636981	/nfs/dbraw/zinc/63/69/81/331636981.db2.gz	QFDLDYXMHMPJQE-PKOBYXMFSA-N	1	0	294.373	4.123	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H]1CCCO[C@H]1C(C)C)c1ccco1	ZINC000475996836	331651053	/nfs/dbraw/zinc/65/10/53/331651053.db2.gz	KNDJYQPOXORYAY-BQFCYCMXSA-N	1	0	291.435	4.328	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H]1C[C@@H](OCC)C12CCC2)c1ccco1	ZINC000476016776	331651615	/nfs/dbraw/zinc/65/16/15/331651615.db2.gz	BLAVVNMKNRJMPU-USXIJHARSA-N	1	0	289.419	4.224	20	30		CIEDRO
CCC[C@@H]([NH2+]Cc1ccc(C#N)cc1)C1CCCCC1	ZINC000477216798	331679171	/nfs/dbraw/zinc/67/91/71/331679171.db2.gz	KNKAEMAFKKFBFW-GOSISDBHSA-N	1	0	270.420	4.397	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@@H](C)CCc1c(F)cccc1F	ZINC000511045322	332925780	/nfs/dbraw/zinc/92/57/80/332925780.db2.gz	ISILGRTUJODYGM-QWHCGFSZSA-N	1	0	267.363	4.230	20	30		CIEDRO
C[C@@H]([NH2+]C1(Cc2ccccc2)CC1)c1ccc(C#N)cc1F	ZINC000480674665	331783609	/nfs/dbraw/zinc/78/36/09/331783609.db2.gz	YGTSRFPRBBHAAY-CQSZACIVSA-N	1	0	294.373	4.123	20	30		CIEDRO
C=CC[C@@H](C)[C@@H](C)[NH2+]CC1(CCOC)CCCCC1	ZINC000480743621	331785943	/nfs/dbraw/zinc/78/59/43/331785943.db2.gz	IDZKOCWOPJYFMY-HZPDHXFCSA-N	1	0	267.457	4.164	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@@H]1CC[C@H](c2ccccc2F)C1	ZINC000482078528	331822852	/nfs/dbraw/zinc/82/28/52/331822852.db2.gz	HEBJGYDXVHEWBJ-SOUVJXGZSA-N	1	0	261.384	4.406	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@@H](c3ccccc3F)C2)C1	ZINC000482077976	331823268	/nfs/dbraw/zinc/82/32/68/331823268.db2.gz	QJKFULXSAZVXSV-LVQVYYBASA-N	1	0	286.394	4.134	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@H]1CCc2ccc(C)cc21	ZINC000482901654	331851856	/nfs/dbraw/zinc/85/18/56/331851856.db2.gz	NLSQJJLIMQPCRY-IBGZPJMESA-N	1	0	293.410	4.337	20	30		CIEDRO
C=CCCCCC[NH2+][C@H](C)c1ccc(Br)cn1	ZINC000482995103	331855252	/nfs/dbraw/zinc/85/52/52/331855252.db2.gz	WRSZJPRDBLMTGY-GFCCVEGCSA-N	1	0	297.240	4.241	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@H]1CCCc2c(O)cccc21	ZINC000483441929	331875909	/nfs/dbraw/zinc/87/59/09/331875909.db2.gz	QPOXVFLOFKJOST-BBRMVZONSA-N	1	0	259.393	4.104	20	30		CIEDRO
Fc1ccc(C#CC[NH+]2CCC(c3ccsc3)CC2)cc1	ZINC000485997477	331928976	/nfs/dbraw/zinc/92/89/76/331928976.db2.gz	WESYRXFIWLKJGO-UHFFFAOYSA-N	1	0	299.414	4.118	20	30		CIEDRO
C=C(C[NH2+]Cc1cnc(-c2ccco2)s1)c1ccccc1	ZINC000486952283	331951559	/nfs/dbraw/zinc/95/15/59/331951559.db2.gz	AWIZZYKREQGDHJ-UHFFFAOYSA-N	1	0	296.395	4.206	20	30		CIEDRO
C=CCC[NH2+][C@H](c1cccc(OC(F)(F)F)c1)C1CC1	ZINC000511589089	332936527	/nfs/dbraw/zinc/93/65/27/332936527.db2.gz	VHWQRDYZVKDFMT-AWEZNQCLSA-N	1	0	285.309	4.202	20	30		CIEDRO
CC(C)(C#N)c1ccccc1C[NH+](CC1CC1)CC1CC1	ZINC000487395566	331968635	/nfs/dbraw/zinc/96/86/35/331968635.db2.gz	PZHDYAZGKCTIEF-UHFFFAOYSA-N	1	0	282.431	4.110	20	30		CIEDRO
C=CCC[C@H]([NH2+]C/C=C/c1ccncc1)c1ccccc1	ZINC000487551212	331973571	/nfs/dbraw/zinc/97/35/71/331973571.db2.gz	NVWOQXOCEGYDHV-UCFODXPJSA-N	1	0	278.399	4.392	20	30		CIEDRO
C=CCCCCC[NH2+][C@H](c1ccccc1)[C@@H]1CCOC1	ZINC000488129829	331991485	/nfs/dbraw/zinc/99/14/85/331991485.db2.gz	OKOAUZJHYXYLCW-QZTJIDSGSA-N	1	0	273.420	4.100	20	30		CIEDRO
Cc1ccccc1[C@@H](C)[NH2+]Cc1ccc(C#N)c(C)c1	ZINC000488167429	331992706	/nfs/dbraw/zinc/99/27/06/331992706.db2.gz	WPLFJJVTFJUYKD-OAHLLOKOSA-N	1	0	264.372	4.026	20	30		CIEDRO
Cc1cc(C[NH2+][C@]2(C)CCCc3ccccc32)ccc1C#N	ZINC000488231562	331995051	/nfs/dbraw/zinc/99/50/51/331995051.db2.gz	MJUHAODRNARATK-HXUWFJFHSA-N	1	0	290.410	4.208	20	30		CIEDRO
C=CCCCCC[NH2+][C@@H](c1ncccc1C)C(C)C	ZINC000488238549	331995560	/nfs/dbraw/zinc/99/55/60/331995560.db2.gz	XFAFIFAXCDMPSU-MRXNPFEDSA-N	1	0	260.425	4.423	20	30		CIEDRO
CC(C)(C)C[C@@H]1CCC[N@@H+]1Cc1cc(C#N)ccc1F	ZINC000488411865	332005248	/nfs/dbraw/zinc/00/52/48/332005248.db2.gz	POKJVUDJNQNNOX-HNNXBMFYSA-N	1	0	274.383	4.098	20	30		CIEDRO
Cc1cc(C[N@H+]2C[C@H](C)[C@@H]2c2ccccc2)ccc1C#N	ZINC000488470736	332012167	/nfs/dbraw/zinc/01/21/67/332012167.db2.gz	VMJBWTHRSZRSGA-HNAYVOBHSA-N	1	0	276.383	4.060	20	30		CIEDRO
N#Cc1cccc(C2([NH2+]CCCC3CCCC3)CC2)c1	ZINC000575337293	335095520	/nfs/dbraw/zinc/09/55/20/335095520.db2.gz	JBWOKNXAUDABQK-UHFFFAOYSA-N	1	0	268.404	4.107	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H]1CCC[C@H](C(F)(F)F)C1	ZINC000128357481	333662224	/nfs/dbraw/zinc/66/22/24/333662224.db2.gz	HIHXFDASRBKVIO-AVGNSLFASA-N	1	0	263.347	4.442	20	30		CIEDRO
C=CC[N@@H+](CCCOC(C)C)Cc1ccc(Cl)s1	ZINC000492169263	332385699	/nfs/dbraw/zinc/38/56/99/332385699.db2.gz	PUOZMNUHWFTQOQ-UHFFFAOYSA-N	1	0	287.856	4.205	20	30		CIEDRO
C=C(C)CN(CC)Cc1coc(-c2ccc(F)c(F)c2)n1	ZINC000492220141	332387920	/nfs/dbraw/zinc/38/79/20/332387920.db2.gz	SWGMRHMNYXVOPQ-UHFFFAOYSA-N	1	0	292.329	4.018	20	30		CIEDRO
C=CCOc1cccc(C[NH2+]C(C)(C)c2ccccc2F)c1	ZINC000492465904	332398861	/nfs/dbraw/zinc/39/88/61/332398861.db2.gz	XGKRRYKWQKHRDG-UHFFFAOYSA-N	1	0	299.389	4.415	20	30		CIEDRO
C=CCCOCC[NH2+][C@H](c1ccccc1)c1ccc(C)cc1	ZINC000494973359	332496269	/nfs/dbraw/zinc/49/62/69/332496269.db2.gz	TUUQXDCSUXOYGO-HXUWFJFHSA-N	1	0	295.426	4.267	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@@H](C)C[C@H]1C)c1ccc(C#N)cc1	ZINC000252132246	334374270	/nfs/dbraw/zinc/37/42/70/334374270.db2.gz	MDFUZKDPSUNCOT-WBOJAVRRSA-N	1	0	256.393	4.034	20	30		CIEDRO
C=CCSCC[NH2+][C@@H]1CC=C(c2ccc(F)cc2)CC1	ZINC000498808859	332573353	/nfs/dbraw/zinc/57/33/53/332573353.db2.gz	WVJGDNWYNZHKJL-QGZVFWFLSA-N	1	0	291.435	4.270	20	30		CIEDRO
C=CCc1cc(C[NH2+][C@H](C)CCC(C)C)cc(OC)c1O	ZINC000500278961	332604187	/nfs/dbraw/zinc/60/41/87/332604187.db2.gz	PUHQZUWJVYOJFE-CQSZACIVSA-N	1	0	291.435	4.044	20	30		CIEDRO
CC[C@H]1C[C@]1([NH2+]Cc1cccc(C#N)c1)c1cccc(C)c1	ZINC000500494128	332611322	/nfs/dbraw/zinc/61/13/22/332611322.db2.gz	CNQARWVDYWTJNC-AZUAARDMSA-N	1	0	290.410	4.282	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](C)c1cnn(C2CCCC2)c1	ZINC000502390761	332655944	/nfs/dbraw/zinc/65/59/44/332655944.db2.gz	OSBVDINBCABYTP-GJZGRUSLSA-N	1	0	275.440	4.394	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)c1cc(Br)cs1	ZINC000308448345	332658302	/nfs/dbraw/zinc/65/83/02/332658302.db2.gz	AIWZDWYUWURFGM-VIFPVBQESA-N	1	0	274.227	4.127	20	30		CIEDRO
C=C(C[NH2+][C@@H](C)c1ccc(F)c(OC)c1)c1ccccc1	ZINC000504905276	332724302	/nfs/dbraw/zinc/72/43/02/332724302.db2.gz	GCVSERUWFCULEZ-AWEZNQCLSA-N	1	0	285.362	4.198	20	30		CIEDRO
COc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(C#N)cc2F)cc1	ZINC000512623180	332976402	/nfs/dbraw/zinc/97/64/02/332976402.db2.gz	DOJUBCITYJUDEZ-CHWSQXEVSA-N	1	0	298.361	4.118	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCc2c1cccc2F)c1ccc(C#N)cc1F	ZINC000512630810	332976646	/nfs/dbraw/zinc/97/66/46/332976646.db2.gz	OGSGPGIRBADBAP-BBATYDOGSA-N	1	0	298.336	4.175	20	30		CIEDRO
C[C@H]([NH2+]C[C@@H]1CCc2ccccc21)c1ccc(C#N)cc1F	ZINC000512635163	332977004	/nfs/dbraw/zinc/97/70/04/332977004.db2.gz	GIDPAKCOHQLLKQ-BBRMVZONSA-N	1	0	294.373	4.078	20	30		CIEDRO
Cc1cc(C)cc(CC[NH2+][C@H](C)c2ccc(C#N)cc2F)c1	ZINC000512667917	332979016	/nfs/dbraw/zinc/97/90/16/332979016.db2.gz	RYUIGBIWPDTORK-OAHLLOKOSA-N	1	0	296.389	4.208	20	30		CIEDRO
CC(C)CSCCC[NH2+][C@@H](C)c1ccc(C#N)cc1F	ZINC000512668458	332979309	/nfs/dbraw/zinc/97/93/09/332979309.db2.gz	VCNJAZIJGFDUGP-ZDUSSCGKSA-N	1	0	294.439	4.127	20	30		CIEDRO
CC(C)CSCCC[NH2+][C@H](C)c1ccc(C#N)cc1F	ZINC000512668455	332979387	/nfs/dbraw/zinc/97/93/87/332979387.db2.gz	VCNJAZIJGFDUGP-CYBMUJFWSA-N	1	0	294.439	4.127	20	30		CIEDRO
CCC[N@H+](CCCC(C)(C)C#N)Cc1ccccc1	ZINC000174808667	333007696	/nfs/dbraw/zinc/00/76/96/333007696.db2.gz	LMZYZPVUXLMXSY-UHFFFAOYSA-N	1	0	258.409	4.229	20	30		CIEDRO
CC(C)(C#N)CCC[N@H+](Cc1ccc(F)cc1F)C1CC1	ZINC000174823043	333008344	/nfs/dbraw/zinc/00/83/44/333008344.db2.gz	ATQPKVBDUYCFAV-UHFFFAOYSA-N	1	0	292.373	4.259	20	30		CIEDRO
C=CC[N@H+](CCCC(C)(C)C#N)CCc1ccccc1	ZINC000174835068	333008677	/nfs/dbraw/zinc/00/86/77/333008677.db2.gz	RIXISAUNAPPDPZ-UHFFFAOYSA-N	1	0	270.420	4.047	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CC[C@H](Cc2ccc(F)cc2)C1	ZINC000174869102	333009554	/nfs/dbraw/zinc/00/95/54/333009554.db2.gz	LCDPLPHJJJJWCE-MRXNPFEDSA-N	1	0	288.410	4.020	20	30		CIEDRO
C[C@@H]1C[C@H](c2ccccc2)[N@H+](Cc2cccc(C#N)c2)C1	ZINC000513256313	333011130	/nfs/dbraw/zinc/01/11/30/333011130.db2.gz	LNQDQRIMFXINJT-DNVCBOLYSA-N	1	0	276.383	4.141	20	30		CIEDRO
C[C@H]1C[C@H](c2ccccc2)[N@H+](Cc2cc(C#N)ccc2F)C1	ZINC000513275871	333012169	/nfs/dbraw/zinc/01/21/69/333012169.db2.gz	LGMRXBYJBFFDKW-IFXJQAMLSA-N	1	0	294.373	4.280	20	30		CIEDRO
CC(C)(C)c1ccc2c(c1)CN(Cc1ccc(C#N)o1)CC2	ZINC000513364069	333015429	/nfs/dbraw/zinc/01/54/29/333015429.db2.gz	MDPCTTMJNIQCDC-UHFFFAOYSA-N	1	0	294.398	4.007	20	30		CIEDRO
CCc1ccc([C@@H]2CCC[N@H+](CCC(C)(C)C#N)C2)cc1	ZINC000513392462	333017207	/nfs/dbraw/zinc/01/72/07/333017207.db2.gz	QYXDYHUNLZOZIL-GOSISDBHSA-N	1	0	284.447	4.368	20	30		CIEDRO
C=C1CC[NH+](Cc2ccc(Cl)c3cccnc23)CC1	ZINC000513446126	333019999	/nfs/dbraw/zinc/01/99/99/333019999.db2.gz	CCZMZZMQKPBOPO-UHFFFAOYSA-N	1	0	272.779	4.040	20	30		CIEDRO
C/C(=C\c1ccc(Cl)cc1)C[NH2+]CCCCC#N	ZINC000513519366	333023687	/nfs/dbraw/zinc/02/36/87/333023687.db2.gz	QBYCUXFTHSXOIF-ACCUITESSA-N	1	0	262.784	4.027	20	30		CIEDRO
C[C@H](c1ccc(Cl)cc1)[C@H](C)[N@H+](C)CCCCC#N	ZINC000175433105	333024815	/nfs/dbraw/zinc/02/48/15/333024815.db2.gz	CBPZJTLYKRPXOA-KBPBESRZSA-N	1	0	278.827	4.458	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCc1cccc(F)c1F)c1ccco1	ZINC000513707717	333034446	/nfs/dbraw/zinc/03/44/46/333034446.db2.gz	HZDMHUHNTKMRPZ-HNNXBMFYSA-N	1	0	291.341	4.397	20	30		CIEDRO
C=C[C@@H](C)[NH2+][C@@H](C)c1cc(C)c(Br)s1	ZINC000308599948	333035916	/nfs/dbraw/zinc/03/59/16/333035916.db2.gz	ALMIMPKITGVGDB-BDAKNGLRSA-N	1	0	274.227	4.044	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1CCCCC12CCCC2	ZINC000311469856	333068997	/nfs/dbraw/zinc/06/89/97/333068997.db2.gz	ANZHNGRSSUGICR-OAHLLOKOSA-N	1	0	262.441	4.409	20	30		CIEDRO
C=CCCCC[NH2+][C@H](C)c1ccc(OC(F)F)cc1	ZINC000311903794	333074156	/nfs/dbraw/zinc/07/41/56/333074156.db2.gz	AYJYAYMABFGLEZ-GFCCVEGCSA-N	1	0	269.335	4.295	20	30		CIEDRO
CC(C)(C)[C@@H]1CCC[C@H]([NH2+]C[C@@H](C#N)CCC#N)CC1	ZINC000516763306	333081981	/nfs/dbraw/zinc/08/19/81/333081981.db2.gz	OQFQXYFQOCRBGW-OAGGEKHMSA-N	1	0	275.440	4.015	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H](CC)C(C)(C)C)cc1	ZINC000517546116	333101724	/nfs/dbraw/zinc/10/17/24/333101724.db2.gz	SRQLSKUWAAEVGM-INIZCTEOSA-N	1	0	261.409	4.166	20	30		CIEDRO
CC(C)CC[C@H]1CCC[C@@H]1[NH2+]Cc1cccc(C#N)c1	ZINC000517551761	333102282	/nfs/dbraw/zinc/10/22/82/333102282.db2.gz	VIRWSEQFQQQIAH-MSOLQXFVSA-N	1	0	270.420	4.253	20	30		CIEDRO
C=C(C)CN(CC)[C@@H](C)c1nc(-c2ccccc2C)no1	ZINC000152535832	333113456	/nfs/dbraw/zinc/11/34/56/333113456.db2.gz	YHJPAHWEXGZZNH-AWEZNQCLSA-N	1	0	285.391	4.004	20	30		CIEDRO
CC(C)[C@H]1CCc2ccccc2[C@H]1[NH2+]Cc1ccc(C#N)o1	ZINC000185082248	333135159	/nfs/dbraw/zinc/13/51/59/333135159.db2.gz	MUGWWUCZJBCMHJ-MJGOQNOKSA-N	1	0	294.398	4.201	20	30		CIEDRO
C[C@H]([NH2+]CCCC#N)c1ccc(Cl)c2ccccc21	ZINC000185394086	333139825	/nfs/dbraw/zinc/13/98/25/333139825.db2.gz	PSIXHKIIVFDJSA-LBPRGKRZSA-N	1	0	272.779	4.448	20	30		CIEDRO
C=CCSCC[NH2+][C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000219174133	333143514	/nfs/dbraw/zinc/14/35/14/333143514.db2.gz	UQEXQABFUYGYNA-NSHDSACASA-N	1	0	289.366	4.275	20	30		CIEDRO
CC[NH+](CC)Cc1cccc(N[C@H]2CCC[C@H](C#N)C2)c1	ZINC000185726776	333147411	/nfs/dbraw/zinc/14/74/11/333147411.db2.gz	MLORMHOTUORSHY-RDJZCZTQSA-N	1	0	285.435	4.023	20	30		CIEDRO
COc1ccc2cc(C[NH2+][C@H]3CCC[C@@H](C#N)C3)ccc2c1	ZINC000185765944	333148233	/nfs/dbraw/zinc/14/82/33/333148233.db2.gz	WNGTYTOBRPICMQ-KDOFPFPSSA-N	1	0	294.398	4.020	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1ccc(C(F)(F)F)cc1	ZINC000185769771	333148256	/nfs/dbraw/zinc/14/82/56/333148256.db2.gz	WCHAFVMQHIVFRV-HUBLWGQQSA-N	1	0	296.336	4.438	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+]CCSc2ccc(Cl)cc2)C1	ZINC000185759707	333148270	/nfs/dbraw/zinc/14/82/70/333148270.db2.gz	JBHHZPLLKHDSGC-OCCSQVGLSA-N	1	0	294.851	4.104	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+]Cc2ccc3ccccc3c2)C1	ZINC000185818506	333149613	/nfs/dbraw/zinc/14/96/13/333149613.db2.gz	YSXLGTGVHYUXRD-KDOFPFPSSA-N	1	0	264.372	4.012	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+]CCc2cccc3ccccc32)C1	ZINC000185819629	333149654	/nfs/dbraw/zinc/14/96/54/333149654.db2.gz	QMIOFWCZSCZOAG-YJBOKZPZSA-N	1	0	278.399	4.054	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+]Cc2ccc3ccccc3c2)C1	ZINC000185818469	333149671	/nfs/dbraw/zinc/14/96/71/333149671.db2.gz	YSXLGTGVHYUXRD-KSSFIOAISA-N	1	0	264.372	4.012	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+]CCc2ccc3ccccc3c2)C1	ZINC000185816543	333149725	/nfs/dbraw/zinc/14/97/25/333149725.db2.gz	PJVLWYUKCZBQEA-VQIMIIECSA-N	1	0	278.399	4.054	20	30		CIEDRO
CC(C)[C@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)c1ccc(F)cc1F	ZINC000185856247	333150288	/nfs/dbraw/zinc/15/02/88/333150288.db2.gz	QFNRALHRJFBUTL-QEORTHHSSA-N	1	0	292.373	4.334	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+]CC2(c3ccccc3Cl)CC2)C1	ZINC000185873475	333150795	/nfs/dbraw/zinc/15/07/95/333150795.db2.gz	GEFCNKWOKMXXET-ZIAGYGMSSA-N	1	0	288.822	4.044	20	30		CIEDRO
CCOc1ccccc1C[N@H+](C)[C@@H](C)c1cccc(C#N)c1	ZINC000186352973	333159053	/nfs/dbraw/zinc/15/90/53/333159053.db2.gz	BWZZFOYRELCEGG-HNNXBMFYSA-N	1	0	294.398	4.150	20	30		CIEDRO
CC[C@@H](C[N@H+](CC)CCCSCC#N)c1ccccc1	ZINC000186607315	333163439	/nfs/dbraw/zinc/16/34/39/333163439.db2.gz	UIYIZZOXTFSATN-INIZCTEOSA-N	1	0	290.476	4.149	20	30		CIEDRO
Cc1ccc(C[N@@H+](C)[C@H](C)c2cccc(C#N)c2)cc1	ZINC000189347162	333190871	/nfs/dbraw/zinc/19/08/71/333190871.db2.gz	RSDSNNQTZGROTL-OAHLLOKOSA-N	1	0	264.372	4.060	20	30		CIEDRO
CC(C)(C)CC(C)(C)[NH2+]Cc1cccc(C#N)c1F	ZINC000223530346	333208976	/nfs/dbraw/zinc/20/89/76/333208976.db2.gz	MBJMILXLSBJQIL-UHFFFAOYSA-N	1	0	262.372	4.002	20	30		CIEDRO
C[N@H+](Cc1cc2ccccc2o1)Cc1ccc(C#N)c(F)c1	ZINC000192052811	333228805	/nfs/dbraw/zinc/22/88/05/333228805.db2.gz	JNZUWYXNDQKRGQ-UHFFFAOYSA-N	1	0	294.329	4.076	20	30		CIEDRO
Cc1ccccc1[C@H](C)[N@H+](C)Cc1cccc(C#N)c1	ZINC000193426285	333249809	/nfs/dbraw/zinc/24/98/09/333249809.db2.gz	GTMVQFOWKLUYEC-HNNXBMFYSA-N	1	0	264.372	4.060	20	30		CIEDRO
C=CCCCCC[NH+]1CCC(c2ccncc2)CC1	ZINC000193583538	333253593	/nfs/dbraw/zinc/25/35/93/333253593.db2.gz	QDUZZYOUGFEYKC-UHFFFAOYSA-N	1	0	258.409	4.007	20	30		CIEDRO
CC[N@H+](C[C@H](C)C#N)[C@@H](C)c1cccc2ccccc21	ZINC000522943785	333300766	/nfs/dbraw/zinc/30/07/66/333300766.db2.gz	AYVZHVVEJXZCLB-CABCVRRESA-N	1	0	266.388	4.382	20	30		CIEDRO
CCOc1ccc([C@H](C)[NH2+]CC(C)(C)CCC#N)cc1	ZINC000229686476	333307986	/nfs/dbraw/zinc/30/79/86/333307986.db2.gz	QEBGZHUMQGJNQX-AWEZNQCLSA-N	1	0	274.408	4.066	20	30		CIEDRO
CC(C)[N@H+](Cc1cccs1)Cc1ccc(F)c(C#N)c1	ZINC000229749307	333309183	/nfs/dbraw/zinc/30/91/83/333309183.db2.gz	ZNSJJDBPRSKBGM-UHFFFAOYSA-N	1	0	288.391	4.169	20	30		CIEDRO
C=CCSCC[NH2+]C1CC(c2ccc(Cl)cc2)C1	ZINC000230389547	333316669	/nfs/dbraw/zinc/31/66/69/333316669.db2.gz	DXBIJFWYCFHYTI-UHFFFAOYSA-N	1	0	281.852	4.095	20	30		CIEDRO
Cc1cc([C@@H](C)[NH2+]Cc2cccc(C#N)c2F)c(C)s1	ZINC000230615128	333319357	/nfs/dbraw/zinc/31/93/57/333319357.db2.gz	VRFSSMYZWKCBIR-LLVKDONJSA-N	1	0	288.391	4.227	20	30		CIEDRO
C=CCSCC[NH2+][C@H]1CCCc2c3ccccc3[nH]c21	ZINC000231930069	333332180	/nfs/dbraw/zinc/33/21/80/333332180.db2.gz	LFCQOAKNOQLOPZ-INIZCTEOSA-N	1	0	286.444	4.054	20	30		CIEDRO
CC(C)(C#N)CCCC[N@@H+]1CCC[C@@H]2CCCC[C@@H]21	ZINC000232530923	333338265	/nfs/dbraw/zinc/33/82/65/333338265.db2.gz	NHGJYRIGSWKOJP-HOTGVXAUSA-N	1	0	262.441	4.361	20	30		CIEDRO
CC(C)(C#N)CCCC[N@@H+]1CCC[C@@H]1C1CCCC1	ZINC000232528535	333338324	/nfs/dbraw/zinc/33/83/24/333338324.db2.gz	ZECRGBISVSBKNB-MRXNPFEDSA-N	1	0	262.441	4.361	20	30		CIEDRO
CC(C)C[NH+](CCCCC(C)(C)C#N)CC(C)C	ZINC000232581573	333339034	/nfs/dbraw/zinc/33/90/34/333339034.db2.gz	PJGHENPJCIAPLY-UHFFFAOYSA-N	1	0	252.446	4.320	20	30		CIEDRO
CCC(CC)C[N@H+](CC)CCCCC(C)(C)C#N	ZINC000232867252	333344640	/nfs/dbraw/zinc/34/46/40/333344640.db2.gz	VRDGQZPIDWABRO-UHFFFAOYSA-N	1	0	252.446	4.465	20	30		CIEDRO
CC[C@@H]1CCC[N@H+](CCCCC(C)(C)C#N)CC1	ZINC000233911502	333356004	/nfs/dbraw/zinc/35/60/04/333356004.db2.gz	XHCAGSYAOUDGKF-OAHLLOKOSA-N	1	0	250.430	4.219	20	30		CIEDRO
CC[C@H]1CCCCC[N@@H+]1CCCCC(C)(C)C#N	ZINC000234071156	333357738	/nfs/dbraw/zinc/35/77/38/333357738.db2.gz	MSHIANSZSCATPZ-HNNXBMFYSA-N	1	0	250.430	4.361	20	30		CIEDRO
Cc1ccccc1C[N@H+](C)CCCCC(C)(C)C#N	ZINC000234272656	333359324	/nfs/dbraw/zinc/35/93/24/333359324.db2.gz	HEBDQFPXQBRSHU-UHFFFAOYSA-N	1	0	258.409	4.147	20	30		CIEDRO
C=CCCCCC[NH2+][C@@H](C)c1ccc(OC)c(OC)c1	ZINC000234904047	333362891	/nfs/dbraw/zinc/36/28/91/333362891.db2.gz	LFALNLNJUXQSPH-AWEZNQCLSA-N	1	0	277.408	4.101	20	30		CIEDRO
C[C@@H]1C[C@H](C)[C@@H](C)[N@H+](CCCCC(C)(C)C#N)C1	ZINC000235380414	333368712	/nfs/dbraw/zinc/36/87/12/333368712.db2.gz	HQEFMCMWMAXNOA-QLFBSQMISA-N	1	0	250.430	4.073	20	30		CIEDRO
C[C@H]([NH2+]C1CC(c2ccccc2F)C1)c1ccc(C#N)cc1	ZINC000315642011	333382893	/nfs/dbraw/zinc/38/28/93/333382893.db2.gz	ZFUAEMPAEMUNGL-IGEOTXOUSA-N	1	0	294.373	4.294	20	30		CIEDRO
C[C@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2cccc(C#N)c2)C1	ZINC000524755142	333386783	/nfs/dbraw/zinc/38/67/83/333386783.db2.gz	QEGPYDJTHCAHGU-LIRRHRJNSA-N	1	0	294.373	4.280	20	30		CIEDRO
C=CCC[N@H+]1CCC[C@H]1c1cccc(Br)c1	ZINC000524811452	333388698	/nfs/dbraw/zinc/38/86/98/333388698.db2.gz	KBTPCHOHQXLWSO-AWEZNQCLSA-N	1	0	280.209	4.162	20	30		CIEDRO
C=CCC[NH+]1CCC(Oc2ccc(C(C)C)cc2)CC1	ZINC000524811839	333388947	/nfs/dbraw/zinc/38/89/47/333388947.db2.gz	REIWVEZVTSIHPJ-UHFFFAOYSA-N	1	0	273.420	4.229	20	30		CIEDRO
C=C(C[NH2+][C@@H](C)c1ccc(OC)c(OC)c1)c1ccccc1	ZINC000316417858	333392390	/nfs/dbraw/zinc/39/23/90/333392390.db2.gz	BSUHBXYFBUBDPB-HNNXBMFYSA-N	1	0	297.398	4.068	20	30		CIEDRO
C[C@@H]([NH2+]CC1(c2ccc(F)cc2)CC1)c1ccc(C#N)cc1	ZINC000173940333	335143989	/nfs/dbraw/zinc/14/39/89/335143989.db2.gz	GWDCMMGCPKRKJZ-CQSZACIVSA-N	1	0	294.373	4.080	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccccc1Cl)c1cccc(C#N)c1	ZINC000037199003	333512654	/nfs/dbraw/zinc/51/26/54/333512654.db2.gz	OFZOZBYRQRBCMS-LBPRGKRZSA-N	1	0	270.763	4.062	20	30		CIEDRO
C[C@H](CCc1ccccc1)[NH2+][C@H](C)c1cccc(C#N)c1	ZINC000037231635	333520073	/nfs/dbraw/zinc/52/00/73/333520073.db2.gz	ORLIAKGIXBNVSN-HZPDHXFCSA-N	1	0	278.399	4.230	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1cccc(C#N)c1)c1ccc(F)c(F)c1	ZINC000037277477	333529899	/nfs/dbraw/zinc/52/98/99/333529899.db2.gz	BBPMIHSQCJRHMQ-NWDGAFQWSA-N	1	0	286.325	4.248	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCc1ccc(Cl)s1)C1CC1	ZINC000537992598	333569402	/nfs/dbraw/zinc/56/94/02/333569402.db2.gz	YLNCMRPERWUEFK-CYBMUJFWSA-N	1	0	269.841	4.278	20	30		CIEDRO
C[C@@H]([NH2+]CCc1cc2ccccc2o1)c1ccc(C#N)cc1	ZINC000174119347	335148292	/nfs/dbraw/zinc/14/82/92/335148292.db2.gz	BGXOMVDDOBYFLF-CQSZACIVSA-N	1	0	290.366	4.198	20	30		CIEDRO
C=C(C)C[NH2+][C@H](C)c1ccc(OCCCC)c(OC)c1	ZINC000538169697	333577714	/nfs/dbraw/zinc/57/77/14/333577714.db2.gz	ASVABIHUXFYKFB-CQSZACIVSA-N	1	0	277.408	4.101	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccccc1C(C)(C)C#N)C(C)(C)C	ZINC000538390890	333587923	/nfs/dbraw/zinc/58/79/23/333587923.db2.gz	FBGTZQFBIAVZRR-INIZCTEOSA-N	1	0	272.436	4.402	20	30		CIEDRO
CCC[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(C#N)s1	ZINC000538403544	333589104	/nfs/dbraw/zinc/58/91/04/333589104.db2.gz	KHVXBVTUEZVOEW-HNNXBMFYSA-N	1	0	284.428	4.121	20	30		CIEDRO
C[C@H]([NH2+][C@@H](C)c1ccc(C#N)c(F)c1)c1ccccc1	ZINC000538508238	333601254	/nfs/dbraw/zinc/60/12/54/333601254.db2.gz	DFXINYDOMLCVIR-STQMWFEESA-N	1	0	268.335	4.109	20	30		CIEDRO
CCc1ccccc1C[NH2+][C@@H](C)c1ccc(C#N)c(F)c1	ZINC000538509278	333601370	/nfs/dbraw/zinc/60/13/70/333601370.db2.gz	LAQGNZUUQXQGFN-ZDUSSCGKSA-N	1	0	282.362	4.111	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](C)c1ccc(OCC(F)(F)F)cc1	ZINC000539072525	333655065	/nfs/dbraw/zinc/65/50/65/333655065.db2.gz	CKRKFPPQLQNFIN-NEPJUHHUSA-N	1	0	287.325	4.243	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H]1CCc2c1cc(Br)cc2F	ZINC000539072520	333655200	/nfs/dbraw/zinc/65/52/00/333655200.db2.gz	BOAIQYPUPFYFSR-LKFCYVNXSA-N	1	0	298.199	4.130	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@H](C)c1ccc(F)cc1F	ZINC000539121090	333658541	/nfs/dbraw/zinc/65/85/41/333658541.db2.gz	XCTRFDZGHIYZTG-SDDRHHMPSA-N	1	0	253.336	4.216	20	30		CIEDRO
C[C@H]([NH2+]CC#Cc1ccc(Cl)cc1)c1ccccc1	ZINC000539302394	333665127	/nfs/dbraw/zinc/66/51/27/333665127.db2.gz	NYHXTGHHQNDGQX-AWEZNQCLSA-N	1	0	269.775	4.042	20	30		CIEDRO
Cc1ccc(CC[C@@H](C)[NH2+][C@@H](C)c2cccc(C#N)c2)o1	ZINC000539494570	333673756	/nfs/dbraw/zinc/67/37/56/333673756.db2.gz	KFQZKDCZZFGNGD-HIFRSBDPSA-N	1	0	282.387	4.132	20	30		CIEDRO
CC[C@@H]([NH2+]CCC(C)(C)C#N)C(C)(C)c1ccccc1	ZINC000539613886	333681212	/nfs/dbraw/zinc/68/12/12/333681212.db2.gz	STIVFJMDQWKHGB-MRXNPFEDSA-N	1	0	272.436	4.272	20	30		CIEDRO
CC[C@@H]([NH2+]CCC(C)(C)C#N)c1ccc(Cl)cc1	ZINC000539612753	333681231	/nfs/dbraw/zinc/68/12/31/333681231.db2.gz	AFTZMHGGTUHMSM-CQSZACIVSA-N	1	0	264.800	4.321	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)c1ccc(-c2ccncc2)cc1	ZINC000540169553	333717177	/nfs/dbraw/zinc/71/71/77/333717177.db2.gz	LJYCPZBATNHQSE-LSDHHAIUSA-N	1	0	266.388	4.364	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)c1ccc(-c2ccncc2)cc1	ZINC000540169551	333717209	/nfs/dbraw/zinc/71/72/09/333717209.db2.gz	LJYCPZBATNHQSE-GJZGRUSLSA-N	1	0	266.388	4.364	20	30		CIEDRO
C=CCCC[C@@H](C)[NH+]1CCC(Oc2cccc(C#N)c2)CC1	ZINC000540338738	333725950	/nfs/dbraw/zinc/72/59/50/333725950.db2.gz	VMPZUPYQOXODEQ-MRXNPFEDSA-N	1	0	298.430	4.146	20	30		CIEDRO
C=CCC[C@@H](O)C[NH2+][C@@H](CC(C)(C)C)c1ccccc1	ZINC000540379165	333727532	/nfs/dbraw/zinc/72/75/32/333727532.db2.gz	FKNVBDRWHXNNCL-SJORKVTESA-N	1	0	275.436	4.081	20	30		CIEDRO
CCC[C@@H](C[NH2+]Cc1cccc(C#N)c1)c1ccccc1	ZINC000540561171	333735375	/nfs/dbraw/zinc/73/53/75/333735375.db2.gz	YJJSRCKLJDCCTF-IBGZPJMESA-N	1	0	278.399	4.232	20	30		CIEDRO
C[C@@H]([NH2+]CCc1ccccc1Cl)c1ccc(C#N)cc1	ZINC000540595788	333736717	/nfs/dbraw/zinc/73/67/17/333736717.db2.gz	ARTRZYNHTRVLJB-CYBMUJFWSA-N	1	0	284.790	4.105	20	30		CIEDRO
C[C@H]([NH2+]CC(C)(C)c1cccc(F)c1)c1ccc(C#N)cc1	ZINC000540594250	333736855	/nfs/dbraw/zinc/73/68/55/333736855.db2.gz	QAYOHODTLULYNS-AWEZNQCLSA-N	1	0	296.389	4.326	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)c1cc2cccc(OCC)c2o1	ZINC000540607064	333737761	/nfs/dbraw/zinc/73/77/61/333737761.db2.gz	AEKCGOZMNXTKNX-QWHCGFSZSA-N	1	0	273.376	4.447	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](C)c1cc2cccc(OCC)c2o1	ZINC000540607063	333737872	/nfs/dbraw/zinc/73/78/72/333737872.db2.gz	AEKCGOZMNXTKNX-OLZOCXBDSA-N	1	0	273.376	4.447	20	30		CIEDRO
COc1ccccc1[C@H](CC(C)C)[NH2+]CCC(C)(C)C#N	ZINC000540715119	333743422	/nfs/dbraw/zinc/74/34/22/333743422.db2.gz	WWWQOPKEIPZZNS-INIZCTEOSA-N	1	0	288.435	4.312	20	30		CIEDRO
C[C@H]([NH2+]CC1CC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000541085801	333761967	/nfs/dbraw/zinc/76/19/67/333761967.db2.gz	UDEQYGMKXCMDSO-AWEZNQCLSA-N	1	0	276.383	4.286	20	30		CIEDRO
N#CCCC[NH2+][C@H](CCc1ccccc1)Cc1ccccc1	ZINC000541570261	333781240	/nfs/dbraw/zinc/78/12/40/333781240.db2.gz	GEBDFCNRIUTMIP-HXUWFJFHSA-N	1	0	292.426	4.124	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](c1ncc(C)s1)C1CC1	ZINC000541599849	333783541	/nfs/dbraw/zinc/78/35/41/333783541.db2.gz	OAAMGPOCHCPCAE-SMDDNHRTSA-N	1	0	264.438	4.237	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+]C(C)(C)c1ncc(C)s1	ZINC000542580240	333833086	/nfs/dbraw/zinc/83/30/86/333833086.db2.gz	KLMURIKKWBVMPX-NSHDSACASA-N	1	0	252.427	4.021	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCc2ccc(F)cc21)c1ccc(C#N)cc1F	ZINC000543762828	333897026	/nfs/dbraw/zinc/89/70/26/333897026.db2.gz	NIFHRIDLOZXFCD-ZMZPIMSZSA-N	1	0	298.336	4.175	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCc2ccc(F)cc21)c1ccc(C#N)cc1F	ZINC000543762826	333897077	/nfs/dbraw/zinc/89/70/77/333897077.db2.gz	NIFHRIDLOZXFCD-BBATYDOGSA-N	1	0	298.336	4.175	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](c1ccc(F)c(F)c1)C(C)C	ZINC000543777408	333897966	/nfs/dbraw/zinc/89/79/66/333897966.db2.gz	VONLRDQTQRWBGY-ABAIWWIYSA-N	1	0	253.336	4.216	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](c1ccc(F)c(F)c1)C(C)C	ZINC000543777421	333898052	/nfs/dbraw/zinc/89/80/52/333898052.db2.gz	VONLRDQTQRWBGY-XHDPSFHLSA-N	1	0	253.336	4.216	20	30		CIEDRO
C[C@H](c1ccc(C(F)(F)F)cc1)[NH+]1CCC(CC#N)CC1	ZINC000543807172	333901018	/nfs/dbraw/zinc/90/10/18/333901018.db2.gz	GKQGRTPWDAWGNV-GFCCVEGCSA-N	1	0	296.336	4.392	20	30		CIEDRO
C[C@@H](c1cccc(Cl)c1)[NH+]1CCC(CC#N)CC1	ZINC000543811026	333901178	/nfs/dbraw/zinc/90/11/78/333901178.db2.gz	MSLMLMWMQGCHTG-LBPRGKRZSA-N	1	0	262.784	4.027	20	30		CIEDRO
C=CCCC[NH2+][C@H](C)c1cc2cccc(OCC)c2o1	ZINC000544483983	333933445	/nfs/dbraw/zinc/93/34/45/333933445.db2.gz	IIYSGMGPXLUARS-CYBMUJFWSA-N	1	0	273.376	4.448	20	30		CIEDRO
C=CCC[N@H+]1CCC[C@@H](c2nc3ccccc3n2C(C)C)C1	ZINC000133096169	334015918	/nfs/dbraw/zinc/01/59/18/334015918.db2.gz	NWOIVOWRGUUBDG-MRXNPFEDSA-N	1	0	297.446	4.373	20	30		CIEDRO
Cc1cccc([C@@H]2CCC[N@@H+]2CCCSCC#N)c1C	ZINC000074991421	334022153	/nfs/dbraw/zinc/02/21/53/334022153.db2.gz	RNTLHJMBMMVGEO-KRWDZBQOSA-N	1	0	288.460	4.087	20	30		CIEDRO
Cc1ccc([C@H]2CCCC[N@@H+]2CCCSCC#N)cc1	ZINC000074991442	334022284	/nfs/dbraw/zinc/02/22/84/334022284.db2.gz	ITZMWRSRAZDOGW-QGZVFWFLSA-N	1	0	288.460	4.169	20	30		CIEDRO
Cc1ccc([C@@H]2CCCCC[N@@H+]2CCCSCC#N)o1	ZINC000074991302	334022366	/nfs/dbraw/zinc/02/23/66/334022366.db2.gz	YWVRZKJOKQKURD-HNNXBMFYSA-N	1	0	292.448	4.152	20	30		CIEDRO
N#Cc1csc(C[N@@H+]2CCCC[C@@H]2c2ccccc2)c1	ZINC000546691620	334046046	/nfs/dbraw/zinc/04/60/46/334046046.db2.gz	MNCFVPMSEGSFLN-QGZVFWFLSA-N	1	0	282.412	4.347	20	30		CIEDRO
CCCOc1ccc(C[NH2+][C@@H](C)c2ccc(C#N)cc2)cc1	ZINC000075755676	334050294	/nfs/dbraw/zinc/05/02/94/334050294.db2.gz	AMGGKTSQJABBNX-HNNXBMFYSA-N	1	0	294.398	4.198	20	30		CIEDRO
CCCOc1ccc(C[NH2+][C@H](C)c2ccc(C#N)cc2)cc1	ZINC000075755678	334050298	/nfs/dbraw/zinc/05/02/98/334050298.db2.gz	AMGGKTSQJABBNX-OAHLLOKOSA-N	1	0	294.398	4.198	20	30		CIEDRO
CCCC[C@H]1CCC[C@H]1[NH2+]Cc1cc(C#N)cs1	ZINC000236886497	334076482	/nfs/dbraw/zinc/07/64/82/334076482.db2.gz	LYWFANZOVQAFJK-DZGCQCFKSA-N	1	0	262.422	4.068	20	30		CIEDRO
C=CC[C@H](CO)[NH2+][C@H](C)c1ccc(-c2ccccc2)s1	ZINC000547393070	334085301	/nfs/dbraw/zinc/08/53/01/334085301.db2.gz	BTEFCYANEKHNDN-UKRRQHHQSA-N	1	0	287.428	4.003	20	30		CIEDRO
C=CC[C@H](CO)[NH2+][C@H](C)c1ccc(Oc2ccccc2)cc1	ZINC000547393499	334085373	/nfs/dbraw/zinc/08/53/73/334085373.db2.gz	IJBCKPQUSWREMS-NVXWUHKLSA-N	1	0	297.398	4.067	20	30		CIEDRO
C=CC[C@@H](CO)[NH2+][C@@H](C)c1ccc(Oc2ccccc2)cc1	ZINC000547393500	334085469	/nfs/dbraw/zinc/08/54/69/334085469.db2.gz	IJBCKPQUSWREMS-RDJZCZTQSA-N	1	0	297.398	4.067	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CCCC[C@@H]2Cc2ccccc2)o1	ZINC000237843505	334100306	/nfs/dbraw/zinc/10/03/06/334100306.db2.gz	BMAYAGBTFREHCL-VQIMIIECSA-N	1	0	294.398	4.042	20	30		CIEDRO
N#Cc1csc(C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2)c1	ZINC000237850268	334100562	/nfs/dbraw/zinc/10/05/62/334100562.db2.gz	OCPVBUVFTFTAIM-WMZOPIPTSA-N	1	0	296.439	4.121	20	30		CIEDRO
N#Cc1csc(C[NH2+]CC2(c3ccccc3)CCCC2)c1	ZINC000237849682	334100644	/nfs/dbraw/zinc/10/06/44/334100644.db2.gz	CXDOAQXPCFVGAK-UHFFFAOYSA-N	1	0	296.439	4.221	20	30		CIEDRO
C=CCC[NH2+][C@H](c1ccccc1)c1ccc(F)cc1	ZINC000134911511	334108124	/nfs/dbraw/zinc/10/81/24/334108124.db2.gz	BHQXSSMTFLYWBT-QGZVFWFLSA-N	1	0	255.336	4.081	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(CC#N)cc1)[C@@H]1C[C@H]1c1cccs1	ZINC000564329048	334111970	/nfs/dbraw/zinc/11/19/70/334111970.db2.gz	XOVSQPJJXOPZSK-RRQGHBQHSA-N	1	0	296.439	4.096	20	30		CIEDRO
C[N@H+](Cc1ccccc1F)Cc1ccccc1C(C)(C)C#N	ZINC000135099555	334115394	/nfs/dbraw/zinc/11/53/94/334115394.db2.gz	QPXIMHUTGOWWDL-UHFFFAOYSA-N	1	0	296.389	4.259	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C#N)o1)c1cccc2ccccc21	ZINC000135126827	334116804	/nfs/dbraw/zinc/11/68/04/334116804.db2.gz	NSKUIKOLCJLTTE-CYBMUJFWSA-N	1	0	276.339	4.155	20	30		CIEDRO
CC(C)c1ccc(C[NH2+]CC(C)(C)CCC#N)cc1	ZINC000135162326	334118560	/nfs/dbraw/zinc/11/85/60/334118560.db2.gz	YKQQDFQYVRPAOX-UHFFFAOYSA-N	1	0	258.409	4.230	20	30		CIEDRO
C[N@H+](CCc1cccs1)Cc1ccccc1C(C)(C)C#N	ZINC000135260037	334122538	/nfs/dbraw/zinc/12/25/38/334122538.db2.gz	WIXNCGBHOFAATL-UHFFFAOYSA-N	1	0	298.455	4.224	20	30		CIEDRO
CCC[C@@H](C)[C@@H]1CCC[N@@H+]1CCCC(C)(C)C#N	ZINC000135340305	334126771	/nfs/dbraw/zinc/12/67/71/334126771.db2.gz	QKYWSPUHNLHYBE-CABCVRRESA-N	1	0	250.430	4.217	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCc2cc(F)ccc21)c1ccc(C#N)cc1	ZINC000135363217	334127676	/nfs/dbraw/zinc/12/76/76/334127676.db2.gz	FBHPRNHYEZSXSC-SGTLLEGYSA-N	1	0	280.346	4.035	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCc2cc(F)ccc21)c1ccc(C#N)cc1	ZINC000135363235	334127756	/nfs/dbraw/zinc/12/77/56/334127756.db2.gz	FBHPRNHYEZSXSC-XIKOKIGWSA-N	1	0	280.346	4.035	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCc2cc(F)ccc21)c1ccc(C#N)cc1	ZINC000135363196	334127781	/nfs/dbraw/zinc/12/77/81/334127781.db2.gz	FBHPRNHYEZSXSC-KZULUSFZSA-N	1	0	280.346	4.035	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccc(C#N)s1)c1ccc(C)cc1	ZINC000135669022	334135589	/nfs/dbraw/zinc/13/55/89/334135589.db2.gz	AUIMZOJBHMJHNG-MRXNPFEDSA-N	1	0	270.401	4.169	20	30		CIEDRO
CC(C)[C@@H]([NH2+]Cc1ccc(C#N)s1)c1ccc(F)cc1	ZINC000135673121	334135800	/nfs/dbraw/zinc/13/58/00/334135800.db2.gz	WDNXUIWYONCRBM-MRXNPFEDSA-N	1	0	288.391	4.246	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+][C@@H](C)c1ccccc1OC(F)F	ZINC000135714821	334136848	/nfs/dbraw/zinc/13/68/48/334136848.db2.gz	PGOQKYOQKURVLG-NEPJUHHUSA-N	1	0	269.335	4.293	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(F)c(C#N)c1)c1cccc(Cl)c1	ZINC000136223534	334149871	/nfs/dbraw/zinc/14/98/71/334149871.db2.gz	ZJFHKPCDPHJVME-LLVKDONJSA-N	1	0	288.753	4.202	20	30		CIEDRO
CC[C@@H](CC#N)[NH2+][C@@H](C)CCc1cccc(C(F)(F)F)c1	ZINC000136958773	334165953	/nfs/dbraw/zinc/16/59/53/334165953.db2.gz	BLNBRVJCRSOAMV-WFASDCNBSA-N	1	0	298.352	4.308	20	30		CIEDRO
Cc1ccc(C[C@H](C)[NH2+][C@H](C)c2ccc(C#N)cc2)s1	ZINC000080242144	334168272	/nfs/dbraw/zinc/16/82/72/334168272.db2.gz	NXSYZGWEJHFBSL-GXTWGEPZSA-N	1	0	284.428	4.210	20	30		CIEDRO
C[C@H]1CC[N@H+](CCCC(C)(C)C#N)[C@@H](c2ccco2)C1	ZINC000245409366	334190423	/nfs/dbraw/zinc/19/04/23/334190423.db2.gz	LWKMKFXYWTYCBA-LSDHHAIUSA-N	1	0	274.408	4.383	20	30		CIEDRO
Cc1cc(Cl)cc(C[NH2+]C2(c3cccc(C#N)c3)CC2)c1	ZINC000549778173	334204830	/nfs/dbraw/zinc/20/48/30/334204830.db2.gz	UUUVAWLYKUAGOM-UHFFFAOYSA-N	1	0	296.801	4.299	20	30		CIEDRO
N#Cc1ccc(C[NH2+]Cc2cc3ccccc3s2)cc1	ZINC000549830088	334206145	/nfs/dbraw/zinc/20/61/45/334206145.db2.gz	NEJCOOGSIDVPQZ-UHFFFAOYSA-N	1	0	278.380	4.063	20	30		CIEDRO
CC(C)c1ccc([C@H]([NH2+]CCOCCC#N)C(C)C)cc1	ZINC000549925281	334209204	/nfs/dbraw/zinc/20/92/04/334209204.db2.gz	OCRUEOCBKDKNBU-GOSISDBHSA-N	1	0	288.435	4.027	20	30		CIEDRO
CCC1(Cc2ccccc2)CC[NH+]([C@@H]2CC[C@H](C#N)C2)CC1	ZINC000549999684	334210991	/nfs/dbraw/zinc/21/09/91/334210991.db2.gz	IRWCKYVXSNYQAH-RBUKOAKNSA-N	1	0	296.458	4.414	20	30		CIEDRO
CCS[C@@H]1CCCC[C@@H]1[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000245861596	334221952	/nfs/dbraw/zinc/22/19/52/334221952.db2.gz	HXMBNCIESAZSBH-XOKHGSTOSA-N	1	0	288.460	4.273	20	30		CIEDRO
CCS[C@@H]1CCC[C@H]([NH2+][C@H](C)c2cccc(C#N)c2)C1	ZINC000245920902	334224208	/nfs/dbraw/zinc/22/42/08/334224208.db2.gz	QROBSXKXKLVSNM-XOKHGSTOSA-N	1	0	288.460	4.273	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H]1CCCO[C@H]1c1ccccc1)C1CC1	ZINC000245925285	334224244	/nfs/dbraw/zinc/22/42/44/334224244.db2.gz	HPSVMZUUCIGJGT-UFYCRDLUSA-N	1	0	299.458	4.489	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H]1CCCc2c(O)cccc21	ZINC000550933356	334234178	/nfs/dbraw/zinc/23/41/78/334234178.db2.gz	RBEMGPQSGZDNHI-BBRMVZONSA-N	1	0	259.393	4.104	20	30		CIEDRO
CC[N@H+](C[C@@H]1CCC(F)(F)C1)[C@@H](C)c1ccc(C#N)cc1	ZINC000551096971	334238696	/nfs/dbraw/zinc/23/86/96/334238696.db2.gz	YUUBLTDGSURFJZ-DZGCQCFKSA-N	1	0	292.373	4.377	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@@H](CO)C1CCCCC1)c1ccco1	ZINC000551273158	334244440	/nfs/dbraw/zinc/24/44/40/334244440.db2.gz	TZSKKYBCEXABOJ-DLBZAZTESA-N	1	0	291.435	4.065	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+]Cc1ccc(OC(F)F)c(F)c1	ZINC000551274102	334244580	/nfs/dbraw/zinc/24/45/80/334244580.db2.gz	KUJZRYGWFSPBEE-GFCCVEGCSA-N	1	0	287.325	4.262	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H](C)c1ccnc(OC)c1)c1ccccc1	ZINC000551314904	334246706	/nfs/dbraw/zinc/24/67/06/334246706.db2.gz	IGCNYRWQUBKCJC-YJBOKZPZSA-N	1	0	296.414	4.448	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@H](C)c1ccnc(OC)c1)c1ccccc1	ZINC000551314903	334246770	/nfs/dbraw/zinc/24/67/70/334246770.db2.gz	IGCNYRWQUBKCJC-QAPCUYQASA-N	1	0	296.414	4.448	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@H](C)[C@H]1C[C@@H]1c1ccc(OC)cc1	ZINC000551521117	334252365	/nfs/dbraw/zinc/25/23/65/334252365.db2.gz	YNIBMFNOPLBHGB-AETAKHFUSA-N	1	0	273.420	4.132	20	30		CIEDRO
N#Cc1cccc(C2([NH2+][C@@H]3CCC[C@H](C4CC4)C3)CC2)c1	ZINC000551551485	334253870	/nfs/dbraw/zinc/25/38/70/334253870.db2.gz	BAPFNYRTLAFQPJ-FUHWJXTLSA-N	1	0	280.415	4.106	20	30		CIEDRO
N#Cc1cccc(C2([NH2+][C@@H]3CCC[C@@H](C4CC4)C3)CC2)c1	ZINC000551551486	334253919	/nfs/dbraw/zinc/25/39/19/334253919.db2.gz	BAPFNYRTLAFQPJ-SJLPKXTDSA-N	1	0	280.415	4.106	20	30		CIEDRO
CC[C@@H]1CCC[C@@H]([NH2+]C2(c3cccc(C#N)c3)CC2)C1	ZINC000551565106	334254481	/nfs/dbraw/zinc/25/44/81/334254481.db2.gz	BPCIIGFRKAXWQG-RHSMWYFYSA-N	1	0	268.404	4.106	20	30		CIEDRO
C[C@H](c1cccc(C#N)c1)[NH+]1CCC(CC(F)(F)F)CC1	ZINC000551710279	334258807	/nfs/dbraw/zinc/25/88/07/334258807.db2.gz	YUYPQUBCKFWVQQ-GFCCVEGCSA-N	1	0	296.336	4.284	20	30		CIEDRO
C[C@H](C[NH2+]C1(c2cccc(C#N)c2)CC1)c1ccc(F)cc1	ZINC000551834224	334263756	/nfs/dbraw/zinc/26/37/56/334263756.db2.gz	OOKWNICKNVESFS-CQSZACIVSA-N	1	0	294.373	4.080	20	30		CIEDRO
C=CCCCC[NH2+][C@H](C)c1ccc(OC)c(OC)c1C	ZINC000552067700	334284952	/nfs/dbraw/zinc/28/49/52/334284952.db2.gz	UWYXJGMUWDJPDL-CQSZACIVSA-N	1	0	277.408	4.019	20	30		CIEDRO
Cc1cc([NH+]2CCCCCC2)ccc1N[C@H]1CC[C@@H](C#N)C1	ZINC000552088523	334287907	/nfs/dbraw/zinc/28/79/07/334287907.db2.gz	LHUMRNBZQDZRRH-SJORKVTESA-N	1	0	297.446	4.480	20	30		CIEDRO
CCC[C@@H]1[C@H](C)CCC[N@@H+]1CC(C)(C)CCC#N	ZINC000552301445	334314806	/nfs/dbraw/zinc/31/48/06/334314806.db2.gz	BZNHVAOOQBCQKT-HUUCEWRRSA-N	1	0	250.430	4.217	20	30		CIEDRO
CCC(CC)[N@H+](CC(C)C)CC(C)(C)CCC#N	ZINC000552326510	334317373	/nfs/dbraw/zinc/31/73/73/334317373.db2.gz	VQDHQRRUXSXLSF-UHFFFAOYSA-N	1	0	252.446	4.463	20	30		CIEDRO
COc1ccc([C@H]([NH2+][C@@H]2CCC[C@@H](C#N)C2)C(C)C)cc1	ZINC000248801244	334317813	/nfs/dbraw/zinc/31/78/13/334317813.db2.gz	JRQJSRSSZGACGE-QGPMSJSTSA-N	1	0	286.419	4.064	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+][C@H]2CCSc3ccc(F)cc32)C1	ZINC000249053717	334326012	/nfs/dbraw/zinc/32/60/12/334326012.db2.gz	YBXFQYCPZGEAJS-KYOSRNDESA-N	1	0	290.407	4.035	20	30		CIEDRO
C=C(C)C[N@H+]1Cc2ccccc2[C@H](c2ccccc2)C1	ZINC000552500319	334332144	/nfs/dbraw/zinc/33/21/44/334332144.db2.gz	HXTOFMQFQASOSR-IBGZPJMESA-N	1	0	263.384	4.210	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H]2CC[C@@H](c3ccccc3)C2)s1	ZINC000552696495	334342775	/nfs/dbraw/zinc/34/27/75/334342775.db2.gz	YLSCTYNMTSLRGL-CABCVRRESA-N	1	0	282.412	4.046	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H]2CC[C@H](c3ccccc3)C2)s1	ZINC000552696496	334342837	/nfs/dbraw/zinc/34/28/37/334342837.db2.gz	YLSCTYNMTSLRGL-GJZGRUSLSA-N	1	0	282.412	4.046	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)s1	ZINC000552696497	334342871	/nfs/dbraw/zinc/34/28/71/334342871.db2.gz	YLSCTYNMTSLRGL-HUUCEWRRSA-N	1	0	282.412	4.046	20	30		CIEDRO
C[C@H](CCc1ccco1)[NH2+][C@@H]1CCCc2cc(C#N)ccc21	ZINC000553305602	334375832	/nfs/dbraw/zinc/37/58/32/334375832.db2.gz	WIMCQXRFPUOBRN-AUUYWEPGSA-N	1	0	294.398	4.140	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+]C[C@H](CO)c1ccccc1Cl	ZINC000554073008	334409120	/nfs/dbraw/zinc/40/91/20/334409120.db2.gz	KRASOJAGXKWBBD-HUUCEWRRSA-N	1	0	295.854	4.140	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+][C@H](C)c1ccc(OC)c(OC)c1C	ZINC000554141031	334414307	/nfs/dbraw/zinc/41/43/07/334414307.db2.gz	UGHYBOOBYQDKFE-NWANDNLSSA-N	1	0	291.435	4.264	20	30		CIEDRO
C[C@H](CCc1cccc(F)c1)[NH2+]CC(C)(C)CCC#N	ZINC000554359948	334424076	/nfs/dbraw/zinc/42/40/76/334424076.db2.gz	YFBALVXBGIFPGR-CQSZACIVSA-N	1	0	276.399	4.066	20	30		CIEDRO
CCc1ccc([C@H]([NH2+]Cc2ccc(C#N)cn2)C(C)C)cc1	ZINC000554363500	334424771	/nfs/dbraw/zinc/42/47/71/334424771.db2.gz	MXXWNRNYLANWNB-LJQANCHMSA-N	1	0	293.414	4.003	20	30		CIEDRO
C[C@H](CCC1CCCC1)[NH2+]CC(C)(C)CCC#N	ZINC000554364473	334424783	/nfs/dbraw/zinc/42/47/83/334424783.db2.gz	DTCKLDPZCGSNQH-CQSZACIVSA-N	1	0	250.430	4.265	20	30		CIEDRO
Cc1cc([C@@H](C)[NH2+]Cc2ccc(CC#N)cc2)cc(C)c1F	ZINC000554739226	334450292	/nfs/dbraw/zinc/45/02/92/334450292.db2.gz	WGLOTQLIWHUXCE-OAHLLOKOSA-N	1	0	296.389	4.359	20	30		CIEDRO
C[C@@H](CC[NH2+][C@@H]1CCc2ccc(C#N)cc21)c1ccccc1	ZINC000554997996	334464246	/nfs/dbraw/zinc/46/42/46/334464246.db2.gz	UYWHZDSRACTUNJ-MGPUTAFESA-N	1	0	290.410	4.329	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H](C)c1ccc(-n2cccn2)cc1	ZINC000556218510	334500603	/nfs/dbraw/zinc/50/06/03/334500603.db2.gz	VHWQOCPSCIIMBZ-HNNXBMFYSA-N	1	0	283.419	4.125	20	30		CIEDRO
Cc1cc(Cl)ccc1C[NH+]1CCC(CCC#N)CC1	ZINC000564917000	334528277	/nfs/dbraw/zinc/52/82/77/334528277.db2.gz	WHUMBBDLJMSIGE-UHFFFAOYSA-N	1	0	276.811	4.164	20	30		CIEDRO
Cc1cc(Cl)cc(C)c1C[NH2+]CC(C)(C)CCC#N	ZINC000565972723	334613394	/nfs/dbraw/zinc/61/33/94/334613394.db2.gz	MSSKDEQSUCZKAC-UHFFFAOYSA-N	1	0	278.827	4.376	20	30		CIEDRO
CC(C)CC[C@@H]([NH2+]CC1(CC#N)CC1)C(C)(C)C	ZINC000566643086	334658906	/nfs/dbraw/zinc/65/89/06/334658906.db2.gz	ZQODVWVUJBKIHV-CQSZACIVSA-N	1	0	250.430	4.121	20	30		CIEDRO
N#CCCC[NH2+][C@H]1CCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000156835781	334751070	/nfs/dbraw/zinc/75/10/70/334751070.db2.gz	NXCKTYVGMONGRZ-HIFRSBDPSA-N	1	0	296.336	4.235	20	30		CIEDRO
C[C@H]([NH2+]CCCC#N)c1cc(Cl)sc1Cl	ZINC000273278590	334763527	/nfs/dbraw/zinc/76/35/27/334763527.db2.gz	PYKYOJRGOCSWAG-ZETCQYMHSA-N	1	0	263.193	4.009	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H](C)c1sc(CC)nc1C	ZINC000572588953	334779701	/nfs/dbraw/zinc/77/97/01/334779701.db2.gz	WVQZILSUSWYEBV-LLVKDONJSA-N	1	0	266.454	4.267	20	30		CIEDRO
COc1ccc([C@H](CCC#N)[NH2+]CC(C)(C)C(C)C)cc1	ZINC000568176529	334800302	/nfs/dbraw/zinc/80/03/02/334800302.db2.gz	OBLAEOKSPSPKRP-KRWDZBQOSA-N	1	0	288.435	4.312	20	30		CIEDRO
CC(C)(C)C[C@H]([NH2+]Cc1ccc(C#N)cn1)c1ccccc1	ZINC000569135752	334857434	/nfs/dbraw/zinc/85/74/34/334857434.db2.gz	ILNBRJYPSLERGT-SFHVURJKSA-N	1	0	293.414	4.220	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]Cc1ccc(Oc2ccccc2)o1	ZINC000576308585	335187778	/nfs/dbraw/zinc/18/77/78/335187778.db2.gz	YUDNUYAYZNQXDP-UHFFFAOYSA-N	1	0	298.386	4.491	20	30		CIEDRO
N#CC1(C[NH2+]CCCCc2ccc(Cl)c(Cl)c2)CC1	ZINC000576652759	335231702	/nfs/dbraw/zinc/23/17/02/335231702.db2.gz	CCXOFKOXGDWPCQ-UHFFFAOYSA-N	1	0	297.229	4.209	20	30		CIEDRO
CC#CC[N@H+](C)CCCCCc1cc(-c2ccccc2)no1	ZINC000577115892	335302948	/nfs/dbraw/zinc/30/29/48/335302948.db2.gz	VDFAQYLYGHMZAX-UHFFFAOYSA-N	1	0	296.414	4.010	20	30		CIEDRO
CC(C)(C)c1ccc(C[NH2+]Cc2ccc(C#N)s2)cc1	ZINC000176958476	335345388	/nfs/dbraw/zinc/34/53/88/335345388.db2.gz	RPKJADUJFPUTFC-UHFFFAOYSA-N	1	0	284.428	4.207	20	30		CIEDRO
Cc1cccc(Cl)c1C[NH+]1CCC(CCC#N)CC1	ZINC000577726279	335392816	/nfs/dbraw/zinc/39/28/16/335392816.db2.gz	SWVHHTFCHRCWGB-UHFFFAOYSA-N	1	0	276.811	4.164	20	30		CIEDRO
CCSc1ccc([C@H](C)[NH2+]CCCCC#N)cc1	ZINC000179224209	335481769	/nfs/dbraw/zinc/48/17/69/335481769.db2.gz	AKNMHFDWBWBWKI-ZDUSSCGKSA-N	1	0	262.422	4.143	20	30		CIEDRO
C=C(C)C[NH2+][C@H](C)c1cc2cccc(OCC)c2o1	ZINC000180357940	335575715	/nfs/dbraw/zinc/57/57/15/335575715.db2.gz	YCYBHDOTAXPDKT-GFCCVEGCSA-N	1	0	259.349	4.058	20	30		CIEDRO
CCC(CC)[C@H]([NH2+]Cc1ccc(C#N)o1)c1cccs1	ZINC000578215320	335580473	/nfs/dbraw/zinc/58/04/73/335580473.db2.gz	WNKLLQNUJOLCJU-INIZCTEOSA-N	1	0	288.416	4.480	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)c1ccc(SC)c(F)c1	ZINC000180949928	335630942	/nfs/dbraw/zinc/63/09/42/335630942.db2.gz	QPMVFWSQESSITR-QWRGUYRKSA-N	1	0	253.386	4.163	20	30		CIEDRO
C[C@H](c1ccc(F)cc1F)[NH+]1CCC(CCC#N)CC1	ZINC000578440413	335634525	/nfs/dbraw/zinc/63/45/25/335634525.db2.gz	XJMISYQMNYLGQP-GFCCVEGCSA-N	1	0	278.346	4.042	20	30		CIEDRO
CC[C@@H]([NH2+]CCCSCC(C)C)c1ccc(C#N)cc1	ZINC000579369029	335740918	/nfs/dbraw/zinc/74/09/18/335740918.db2.gz	ZIZRJNHRHNKCRB-QGZVFWFLSA-N	1	0	290.476	4.378	20	30		CIEDRO
CC(C)(C)[C@@H]([NH2+]CCCSCC#N)c1cccc(F)c1	ZINC000181074108	335749723	/nfs/dbraw/zinc/74/97/23/335749723.db2.gz	UXERZUHDCLDNDH-HNNXBMFYSA-N	1	0	294.439	4.149	20	30		CIEDRO
C[C@H](C[NH2+][C@@H](C)c1cccc(C#N)c1)Cc1cccs1	ZINC000181817300	335786619	/nfs/dbraw/zinc/78/66/19/335786619.db2.gz	VLISLFCYJHDGRN-KBPBESRZSA-N	1	0	284.428	4.149	20	30		CIEDRO
COc1cc(C#N)ccc1C[NH2+][C@H](C)c1cc(C)cc(C)c1	ZINC000182910258	335849840	/nfs/dbraw/zinc/84/98/40/335849840.db2.gz	SYTAFZMMPMHUEZ-OAHLLOKOSA-N	1	0	294.398	4.035	20	30		CIEDRO
Cc1oc2ccccc2c1C[NH+]1CCC(CCC#N)CC1	ZINC000581132430	336013217	/nfs/dbraw/zinc/01/32/17/336013217.db2.gz	RIFUCONPRKJVPG-UHFFFAOYSA-N	1	0	282.387	4.257	20	30		CIEDRO
C=C(C)C[NH2+][C@@H](CCOC)c1ccc(Cl)c(Cl)c1	ZINC000581360961	336060861	/nfs/dbraw/zinc/06/08/61/336060861.db2.gz	RSDCAXVPKANCPU-AWEZNQCLSA-N	1	0	288.218	4.237	20	30		CIEDRO
C[C@H]([NH2+][C@H]1C=CCCCCC1)c1ccc(C#N)cc1	ZINC000381649573	336069896	/nfs/dbraw/zinc/06/98/96/336069896.db2.gz	IXSBBUHGVLMTPD-YOEHRIQHSA-N	1	0	254.377	4.098	20	30		CIEDRO
C[C@H](CCC(C)(C)C)[NH2+][C@@H](C)c1cccc(C#N)c1	ZINC000386016803	336164576	/nfs/dbraw/zinc/16/45/76/336164576.db2.gz	NUECQNYZBALLBD-KGLIPLIRSA-N	1	0	258.409	4.424	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1	ZINC000386787099	336179330	/nfs/dbraw/zinc/17/93/30/336179330.db2.gz	KSKVIUKXQCOUQG-NEPJUHHUSA-N	1	0	263.347	4.299	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]Cc1csc(C(C)(C)C)n1	ZINC000386834679	336180293	/nfs/dbraw/zinc/18/02/93/336180293.db2.gz	QQNBYCSVFOFZLZ-UHFFFAOYSA-N	1	0	266.454	4.133	20	30		CIEDRO
CC[C@@H]1CCCC[C@H]1[N@H+](C)Cc1ccc(C#N)s1	ZINC000581971205	336180994	/nfs/dbraw/zinc/18/09/94/336180994.db2.gz	MJLLKHLHBLARBF-IUODEOHRSA-N	1	0	262.422	4.020	20	30		CIEDRO
C=C(C)CC[NH2+][C@H]1CCCc2c3ccccc3[nH]c21	ZINC000386955767	336183041	/nfs/dbraw/zinc/18/30/41/336183041.db2.gz	YGKJFLFVRGJDIT-INIZCTEOSA-N	1	0	254.377	4.101	20	30		CIEDRO
COc1cc(C)ccc1[C@@H](C)[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000387417497	336193583	/nfs/dbraw/zinc/19/35/83/336193583.db2.gz	FJTJFJGVZYIGLF-HUUCEWRRSA-N	1	0	294.398	4.287	20	30		CIEDRO
C[C@H]([NH2+]C1CCC(C)(C#N)CC1)c1cccc(F)c1F	ZINC000336209786	533804996	/nfs/dbraw/zinc/80/49/96/533804996.db2.gz	BGTJTYRNGVPNAE-FZWSLVFFSA-N	1	0	278.346	4.088	20	30		CIEDRO
C[C@@H](c1cccc(C#N)c1)[N@@H+]1CCC=C(c2ccco2)C1	ZINC000352544173	534082455	/nfs/dbraw/zinc/08/24/55/534082455.db2.gz	OOEGYWNBIVCFMH-AWEZNQCLSA-N	1	0	278.355	4.002	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccc([C@@H](C)O)cc1)c1ccco1	ZINC000285941617	517327422	/nfs/dbraw/zinc/32/74/22/517327422.db2.gz	FRNMASBSQPMQSV-PBHICJAKSA-N	1	0	285.387	4.130	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@@H]1CCO[C@@H](c2cccs2)C1	ZINC000449625956	517339928	/nfs/dbraw/zinc/33/99/28/517339928.db2.gz	PCFJDTIRFZNAFE-BYNSBNAKSA-N	1	0	279.449	4.159	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1CCc2ccc(Cl)cc21	ZINC000348219659	517396274	/nfs/dbraw/zinc/39/62/74/517396274.db2.gz	CVIJVMGBOQGOFB-OAHLLOKOSA-N	1	0	276.811	4.247	20	30		CIEDRO
N#CCCCC[NH2+]Cc1ccc(-c2ccccc2Cl)o1	ZINC000237655700	518196327	/nfs/dbraw/zinc/19/63/27/518196327.db2.gz	YDOBBYVWCISSPH-UHFFFAOYSA-N	1	0	288.778	4.383	20	30		CIEDRO
CC(C)[N@H+](Cc1ccc(C#N)o1)[C@@H](C)c1ccccc1	ZINC000292705948	519654088	/nfs/dbraw/zinc/65/40/88/519654088.db2.gz	CVQRFRSSIPWRIQ-AWEZNQCLSA-N	1	0	268.360	4.123	20	30		CIEDRO
CCCOc1ccc([C@@H](C)[NH2+]Cc2ccc(C#N)cc2)cc1	ZINC000299430606	520415694	/nfs/dbraw/zinc/41/56/94/520415694.db2.gz	UWGWIUORKDRPSP-OAHLLOKOSA-N	1	0	294.398	4.198	20	30		CIEDRO
CC[NH+](CC)Cc1cccc(NCc2cccc(C#N)c2)c1	ZINC000119568760	520757342	/nfs/dbraw/zinc/75/73/42/520757342.db2.gz	IAKXLROABVJSGK-UHFFFAOYSA-N	1	0	293.414	4.012	20	30		CIEDRO
N#CCCC[NH2+]Cc1ccc(Sc2ccccc2)cc1	ZINC000344330034	534614143	/nfs/dbraw/zinc/61/41/43/534614143.db2.gz	UPXCAYOFDDQLGL-UHFFFAOYSA-N	1	0	282.412	4.231	20	30		CIEDRO
CC[C@H]([NH2+]C1(c2cccc(C#N)c2)CC1)c1cccc(F)c1	ZINC000275653009	522558503	/nfs/dbraw/zinc/55/85/03/522558503.db2.gz	AIVZXTXNKYUETO-SFHVURJKSA-N	1	0	294.373	4.427	20	30		CIEDRO
CC[C@H]([NH2+][C@H](C)c1ccc(C#N)cc1)c1ccccc1O	ZINC000036991850	522738315	/nfs/dbraw/zinc/73/83/15/522738315.db2.gz	KSVRQXHOQMKFCY-DYVFJYSZSA-N	1	0	280.371	4.066	20	30		CIEDRO
CC[C@@H]([NH2+]C[C@@H](C)c1ncc(C)s1)c1ccc(C#N)cc1	ZINC000278776440	522847825	/nfs/dbraw/zinc/84/78/25/522847825.db2.gz	PNMJFENHZXPXHA-MLGOLLRUSA-N	1	0	299.443	4.168	20	30		CIEDRO
CC[C@@H]([NH2+]C[C@H](C)c1nc(C)cs1)c1ccc(C#N)cc1	ZINC000278371476	522859734	/nfs/dbraw/zinc/85/97/34/522859734.db2.gz	CFTKXGWAJUTNNT-BLLLJJGKSA-N	1	0	299.443	4.168	20	30		CIEDRO
CC[C@@H]([NH2+][C@H](C)c1cccc(C#N)c1)c1ccccc1	ZINC000051627099	522938071	/nfs/dbraw/zinc/93/80/71/522938071.db2.gz	NOTMDEAVFLIMNR-RDTXWAMCSA-N	1	0	264.372	4.360	20	30		CIEDRO
CC[C@@H]([NH2+][C@H](CCOC)C(C)(C)C)c1ccc(C#N)cc1	ZINC000338017766	522942257	/nfs/dbraw/zinc/94/22/57/522942257.db2.gz	PYMWWJNJUKQYRY-IAGOWNOFSA-N	1	0	288.435	4.050	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH+]2CCC(Cc3ccccc3)CC2)C1	ZINC000193072033	534748195	/nfs/dbraw/zinc/74/81/95/534748195.db2.gz	BILBWVIKZGMHHE-RBUKOAKNSA-N	1	0	282.431	4.023	20	30		CIEDRO
Cc1cccc(C)c1C[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000130236085	524262490	/nfs/dbraw/zinc/26/24/90/524262490.db2.gz	QOLDEVYQRUCDAJ-OAHLLOKOSA-N	1	0	264.372	4.026	20	30		CIEDRO
Cc1ccccc1-c1cccc(C[NH2+]CCCC#N)c1	ZINC000344350319	534791882	/nfs/dbraw/zinc/79/18/82/534791882.db2.gz	HZSJKBNORQRZQF-UHFFFAOYSA-N	1	0	264.372	4.055	20	30		CIEDRO
C[C@H]([NH2+]C[C@@H]1CCCC(F)(F)C1)c1cccc(C#N)c1	ZINC000283615696	525386075	/nfs/dbraw/zinc/38/60/75/525386075.db2.gz	UVTWTVUEIXRWNF-GXTWGEPZSA-N	1	0	278.346	4.034	20	30		CIEDRO
C[C@@H]1C[C@H]([NH2+]C2(c3cccc(C#N)c3)CC2)c2ccccc21	ZINC000290275754	525437249	/nfs/dbraw/zinc/43/72/49/525437249.db2.gz	LVCWFHLXSMHXSY-KUHUBIRLSA-N	1	0	288.394	4.385	20	30		CIEDRO
Cc1cc([C@@H](C)[NH2+][C@H](C)c2ccc(C#N)cc2)c(C)o1	ZINC000036991953	525475139	/nfs/dbraw/zinc/47/51/39/525475139.db2.gz	MKFOUTPQEZXKKB-CHWSQXEVSA-N	1	0	268.360	4.180	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1)c1ccc(C#N)cc1	ZINC000224107982	525559534	/nfs/dbraw/zinc/55/95/34/525559534.db2.gz	CTZDYXMTGBEZHT-NILFDRSVSA-N	1	0	296.336	4.330	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCCc2sccc21)c1ccc(C#N)cc1	ZINC000061326707	525562997	/nfs/dbraw/zinc/56/29/97/525562997.db2.gz	QXURSYUGUYTXGF-BLLLJJGKSA-N	1	0	282.412	4.348	20	30		CIEDRO
Cc1ccc([C@@H](C)[NH2+]Cc2cccc(C#N)c2)cc1C	ZINC000037748751	525734065	/nfs/dbraw/zinc/73/40/65/525734065.db2.gz	VXYWBSOKCZKDDR-OAHLLOKOSA-N	1	0	264.372	4.026	20	30		CIEDRO
Cc1ccc([C@@H](C)[NH2+]Cc2ccc(C#N)cc2)c(C)c1	ZINC000037748285	525734600	/nfs/dbraw/zinc/73/46/00/525734600.db2.gz	POGIBEGAYYCMBC-OAHLLOKOSA-N	1	0	264.372	4.026	20	30		CIEDRO
Cc1ccc([C@@H](C)[NH2+]Cc2ccc(C#N)cc2)cc1C	ZINC000037748309	525734673	/nfs/dbraw/zinc/73/46/73/525734673.db2.gz	RVDTVZJIPLSAKT-OAHLLOKOSA-N	1	0	264.372	4.026	20	30		CIEDRO
Cc1c([C@H](C)[NH2+][C@H](C)c2ccc(C#N)cc2)cnn1C(C)C	ZINC000276369596	525924144	/nfs/dbraw/zinc/92/41/44/525924144.db2.gz	OFUZVXWNZIAOIM-KGLIPLIRSA-N	1	0	296.418	4.056	20	30		CIEDRO
N#Cc1ccc(C[N@@H+]2CCCCC[C@H]2c2ccncc2)s1	ZINC000157026340	526612015	/nfs/dbraw/zinc/61/20/15/526612015.db2.gz	FBYYALWGVHSWJG-KRWDZBQOSA-N	1	0	297.427	4.132	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+][C@@H](C)c1ccccc1SC	ZINC000442850413	526803509	/nfs/dbraw/zinc/80/35/09/526803509.db2.gz	CWMIMGZCVLKRQZ-ZQIUZPCESA-N	1	0	291.460	4.040	20	30		CIEDRO
C=C(C[NH2+][C@@H]1CCCNc2ccccc21)c1ccccc1	ZINC000347836457	526882978	/nfs/dbraw/zinc/88/29/78/526882978.db2.gz	YYTUQLCZYCGJGK-LJQANCHMSA-N	1	0	278.399	4.236	20	30		CIEDRO
C=CC1CC[NH+](Cc2nc(-c3ccccc3)cs2)CC1	ZINC000353608395	526980374	/nfs/dbraw/zinc/98/03/74/526980374.db2.gz	RJAQFWHDECYNDG-UHFFFAOYSA-N	1	0	284.428	4.208	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+][C@@H]1CCOc2c(C)cccc21	ZINC000353311393	527140134	/nfs/dbraw/zinc/14/01/34/527140134.db2.gz	ZRRGSGYXPMBLOD-JGGQBBKZSA-N	1	0	259.393	4.009	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+][C@@H](C)c1nccn1-c1ccccc1	ZINC000348318957	527140597	/nfs/dbraw/zinc/14/05/97/527140597.db2.gz	KYBGHKQYILRTTQ-XHSDSOJGSA-N	1	0	283.419	4.124	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CC1([C@H](C)CCO)CCC1)c1ccco1	ZINC000353618913	527447571	/nfs/dbraw/zinc/44/75/71/527447571.db2.gz	HAEGMQCDXGEJAF-HZPDHXFCSA-N	1	0	291.435	4.065	20	30		CIEDRO
CC(C)[C@@H](c1ccccc1Cl)[N@H+](C)CCCC#N	ZINC000354553947	528644391	/nfs/dbraw/zinc/64/43/91/528644391.db2.gz	ODFJNZZFIREXNS-HNNXBMFYSA-N	1	0	264.800	4.273	20	30		CIEDRO
CC(C)Cc1cccc([C@H](C)[NH2+]CC2(CC#N)CC2)c1	ZINC000353585740	528660592	/nfs/dbraw/zinc/66/05/92/528660592.db2.gz	VLLOKBINWBPUBG-HNNXBMFYSA-N	1	0	270.420	4.230	20	30		CIEDRO
CC1(C#N)CCC([NH2+]C[C@H]2CCCCC(F)(F)C2)CC1	ZINC000336208325	528832065	/nfs/dbraw/zinc/83/20/65/528832065.db2.gz	BTNLQGFOGDOZFB-NFOMZHRRSA-N	1	0	284.394	4.264	20	30		CIEDRO
CCCC[C@H]1CCC[C@@H]1[NH2+]CC1CCC(C#N)CC1	ZINC000442864745	529002275	/nfs/dbraw/zinc/00/22/75/529002275.db2.gz	DKNXINWQQZIBDT-GQGLESIBSA-N	1	0	262.441	4.265	20	30		CIEDRO
CC1(C)CC[C@@H]([NH2+]Cc2cccc(OCCCC#N)c2)C1	ZINC000350661461	529029060	/nfs/dbraw/zinc/02/90/60/529029060.db2.gz	QCBZNHQMGBIZSB-MRXNPFEDSA-N	1	0	286.419	4.037	20	30		CIEDRO
CC1(C)CC[C@H]1[NH2+][C@H]1CCCCc2cc(C#N)ccc21	ZINC000348334706	529051654	/nfs/dbraw/zinc/05/16/54/529051654.db2.gz	PEXLVFIUFFXDRY-DLBZAZTESA-N	1	0	268.404	4.104	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(C#N)c(OC)c1)c1cccc(C)c1	ZINC000353610142	529625419	/nfs/dbraw/zinc/62/54/19/529625419.db2.gz	LRBZVBRHBZWJRU-SFHVURJKSA-N	1	0	294.398	4.116	20	30		CIEDRO
C[C@@H]1C[C@H](c2ccccc2)[N@H+](Cc2cc(C#N)cs2)C1	ZINC000574320824	335010127	/nfs/dbraw/zinc/01/01/27/335010127.db2.gz	ZROTZZVNLDEVDZ-CXAGYDPISA-N	1	0	282.412	4.203	20	30		CIEDRO
CC(C)(C)[C@H](CC1CCCCC1)[NH2+]C[C@@H](C#N)CCC#N	ZINC000574392689	335015591	/nfs/dbraw/zinc/01/55/91/335015591.db2.gz	ASGQNEHMUKPDKG-SJORKVTESA-N	1	0	289.467	4.405	20	30		CIEDRO
C[C@@H]([NH2+]C1CCC(C)(C#N)CC1)c1ccc2ncsc2c1	ZINC000336226086	533337058	/nfs/dbraw/zinc/33/70/58/533337058.db2.gz	JYWIXXQVWQIBGH-RFSCMCKOSA-N	1	0	299.443	4.419	20	30		CIEDRO
Cc1cc(C)cc([C@@H]2CCC[C@H]2[NH2+]CCCCC#N)c1	ZINC000367480799	260066369	/nfs/dbraw/zinc/06/63/69/260066369.db2.gz	NNWOPPQIDFHUMD-ZWKOTPCHSA-N	1	0	270.420	4.223	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCCc2cc(C#N)ccc21)C1CCCC1	ZINC000341702401	129982472	/nfs/dbraw/zinc/98/24/72/129982472.db2.gz	WZLDSWSJQRYQEO-UGSOOPFHSA-N	1	0	268.404	4.104	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCCc2cc(C#N)ccc21)c1ccccc1	ZINC000341749992	130019627	/nfs/dbraw/zinc/01/96/27/130019627.db2.gz	DTGXIVSUGJMGFP-IFXJQAMLSA-N	1	0	276.383	4.286	20	30		CIEDRO
N#Cc1ccc2c(c1)CCC[C@H]2[NH2+]Cc1cc(F)cc(F)c1	ZINC000341757824	130025765	/nfs/dbraw/zinc/02/57/65/130025765.db2.gz	MAMSJMVCFSNLJH-GOSISDBHSA-N	1	0	298.336	4.004	20	30		CIEDRO
CC1CCC([NH2+][C@@H]2CCCc3cc(C#N)ccc32)CC1	ZINC000341758542	130026109	/nfs/dbraw/zinc/02/61/09/130026109.db2.gz	RFTAKIHHGAFYID-PVCYVWKFSA-N	1	0	268.404	4.104	20	30		CIEDRO
CC1(C)CC[C@@H]([NH2+][C@@H]2CCCc3cc(C#N)ccc32)C1	ZINC000341894719	130136602	/nfs/dbraw/zinc/13/66/02/130136602.db2.gz	FIBYJUXFEPWLKK-NVXWUHKLSA-N	1	0	268.404	4.104	20	30		CIEDRO
Cc1ccccc1[C@@H](C)[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000020126166	171009414	/nfs/dbraw/zinc/00/94/14/171009414.db2.gz	AFJNXLVVQQYSLQ-HUUCEWRRSA-N	1	0	264.372	4.279	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(Cl)s1)c1ccc(C#N)cc1	ZINC000035256314	172085975	/nfs/dbraw/zinc/08/59/75/172085975.db2.gz	ZBMOYDPBYKTAKM-SNVBAGLBSA-N	1	0	276.792	4.124	20	30		CIEDRO
C[C@H]([NH2+]Cc1cccc(Cl)c1)c1ccc(C#N)cc1	ZINC000035256319	172086334	/nfs/dbraw/zinc/08/63/34/172086334.db2.gz	LIACJUXMQYVBKX-LBPRGKRZSA-N	1	0	270.763	4.062	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H](C)c1nccnc1C)c1ccccc1	ZINC000188251973	260075528	/nfs/dbraw/zinc/07/55/28/260075528.db2.gz	ZROXVAYTRJOMJA-RDJZCZTQSA-N	1	0	281.403	4.143	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@H](C)c1nccnc1C)c1ccccc1	ZINC000188251948	260075557	/nfs/dbraw/zinc/07/55/57/260075557.db2.gz	ZROXVAYTRJOMJA-WBVHZDCISA-N	1	0	281.403	4.143	20	30		CIEDRO
C=CCCC[NH2+][C@H](C)c1ccccc1C(F)(F)F	ZINC000394118924	260076252	/nfs/dbraw/zinc/07/62/52/260076252.db2.gz	MLSVCZQKCYEHON-LLVKDONJSA-N	1	0	257.299	4.322	20	30		CIEDRO
CCn1c2ccccc2c2cc(C[NH2+]CCCC#N)ccc21	ZINC000344343432	225037303	/nfs/dbraw/zinc/03/73/03/225037303.db2.gz	CMIHSMROEIZUBJ-UHFFFAOYSA-N	1	0	291.398	4.208	20	30		CIEDRO
C[C@@H]([NH2+]CC(C)(C)CCC#N)c1ccc2c(c1)CCC2	ZINC000348207275	226432208	/nfs/dbraw/zinc/43/22/08/226432208.db2.gz	OQNCQORBCJVNIR-CQSZACIVSA-N	1	0	270.420	4.156	20	30		CIEDRO
C[C@H](CCCC(F)(F)F)[NH2+]CC(C)(C)CCC#N	ZINC000348245723	226433026	/nfs/dbraw/zinc/43/30/26/226433026.db2.gz	QLAHRICKTAGVSA-LLVKDONJSA-N	1	0	264.335	4.027	20	30		CIEDRO
CC[C@H](Cc1ccccc1)[NH2+][C@@H]1CCc2ccc(C#N)cc21	ZINC000575167892	335074676	/nfs/dbraw/zinc/07/46/76/335074676.db2.gz	XKEHMDCIXMPDAD-UYAOXDASSA-N	1	0	290.410	4.156	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CSc2ccccc21)c1ccc(C#N)c(F)c1	ZINC000335960480	228171195	/nfs/dbraw/zinc/17/11/95/228171195.db2.gz	DZVSPIYAPPLLFH-MEDUHNTESA-N	1	0	298.386	4.195	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCCc2occc21)c1ccc(C#N)c(F)c1	ZINC000335962111	228171576	/nfs/dbraw/zinc/17/15/76/228171576.db2.gz	TUHIBBMWKYNJJB-ZBEGNZNMSA-N	1	0	284.334	4.019	20	30		CIEDRO
C[C@H](c1ncc(-c2ccccc2)o1)N1CCC(C)(C#N)CC1	ZINC000335974113	228172434	/nfs/dbraw/zinc/17/24/34/228172434.db2.gz	KBLVQBVRIIAUCC-CQSZACIVSA-N	1	0	295.386	4.028	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+]C2CCC(c3ccccc3)CC2)C1	ZINC000192634140	228200605	/nfs/dbraw/zinc/20/06/05/228200605.db2.gz	XLHSOFGTIAQOQE-JYPHPWERSA-N	1	0	282.431	4.385	20	30		CIEDRO
CCO[C@@H](CC[NH2+][C@@H](CC)c1ccc(C#N)cc1)C(C)C	ZINC000447531757	260036699	/nfs/dbraw/zinc/03/66/99/260036699.db2.gz	QVRKEQZBSYTOGJ-ROUUACIJSA-N	1	0	288.435	4.050	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1ccccc1)c1ccc(OCC#N)cc1	ZINC000037185701	260073018	/nfs/dbraw/zinc/07/30/18/260073018.db2.gz	ACHVSVWQRRUJOD-LSDHHAIUSA-N	1	0	280.371	4.001	20	30		CIEDRO
CC(C)(CCC#N)C[NH+]1CCC(c2ccccc2)CC1	ZINC000179925056	260080722	/nfs/dbraw/zinc/08/07/22/260080722.db2.gz	FVJITYFNOJOBCW-UHFFFAOYSA-N	1	0	270.420	4.196	20	30		CIEDRO
CC[NH+](CC)Cc1cccc(NCC(C)(C)CCC#N)c1	ZINC000080193030	260178279	/nfs/dbraw/zinc/17/82/79/260178279.db2.gz	QDOJZULVIMTKGZ-UHFFFAOYSA-N	1	0	287.451	4.270	20	30		CIEDRO
CC[C@@H]([NH2+]CCCC(C)(C)C#N)c1cccs1	ZINC000087597765	260191880	/nfs/dbraw/zinc/19/18/80/260191880.db2.gz	HKYFKNDOQNMOMF-GFCCVEGCSA-N	1	0	250.411	4.119	20	30		CIEDRO
CC(C)[C@@H]1CCC[N@H+](CCCC(C)(C)C#N)CC1	ZINC000087608783	260192159	/nfs/dbraw/zinc/19/21/59/260192159.db2.gz	JTFQHHZNTGOCMW-OAHLLOKOSA-N	1	0	250.430	4.074	20	30		CIEDRO
CC(C)[C@H]1CCC[N@H+](CCCC(C)(C)C#N)CC1	ZINC000087608784	260192594	/nfs/dbraw/zinc/19/25/94/260192594.db2.gz	JTFQHHZNTGOCMW-HNNXBMFYSA-N	1	0	250.430	4.074	20	30		CIEDRO
C[C@@H](c1ccccc1Cl)[N@H+](C)CCCCC#N	ZINC000061559626	260233282	/nfs/dbraw/zinc/23/32/82/260233282.db2.gz	WBQSCMUSIPDBDG-LBPRGKRZSA-N	1	0	250.773	4.027	20	30		CIEDRO
Cc1ccc(C[C@H](C)[NH2+]C2CCC(C)(C#N)CC2)s1	ZINC000449161297	260263211	/nfs/dbraw/zinc/26/32/11/260263211.db2.gz	OHOAJZSTWWZABH-YGONEPDPSA-N	1	0	276.449	4.050	20	30		CIEDRO
Cc1cc(C)cc(C[C@H](C)[NH2+]C2CCC(C)(C#N)CC2)c1	ZINC000449168321	260269933	/nfs/dbraw/zinc/26/99/33/260269933.db2.gz	LZOZMUZJUSNMMK-IVMQYODDSA-N	1	0	284.447	4.297	20	30		CIEDRO
CC1(C)C[C@@H]([NH2+]C2CCC(C)(C#N)CC2)c2ccccc21	ZINC000449186515	260284905	/nfs/dbraw/zinc/28/49/05/260284905.db2.gz	CJQMRBYVAWVCOW-LTCLLZNKSA-N	1	0	282.431	4.471	20	30		CIEDRO
C[C@@H]1CC(C)(C)CC[C@@H]1[NH2+]C1CCC(C)(C#N)CC1	ZINC000449187382	260284990	/nfs/dbraw/zinc/28/49/90/260284990.db2.gz	QOFHHHNQYAOLLP-GJEMEMOUSA-N	1	0	262.441	4.263	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCc2ccc(C#N)cc21)C1CCCCC1	ZINC000517786901	260306872	/nfs/dbraw/zinc/30/68/72/260306872.db2.gz	HAMUBUIKHZLTKP-FZKQIMNGSA-N	1	0	268.404	4.104	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1cscc1C(F)(F)F	ZINC000518020197	260334884	/nfs/dbraw/zinc/33/48/84/260334884.db2.gz	SZIAGFDQEMRINB-SNVBAGLBSA-N	1	0	263.328	4.211	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1cscc1C(F)(F)F	ZINC000518020195	260334985	/nfs/dbraw/zinc/33/49/85/260334985.db2.gz	SZIAGFDQEMRINB-JTQLQIEISA-N	1	0	263.328	4.211	20	30		CIEDRO
C=C(C)COCC[NH2+][C@@H]1CCSc2ccc(Cl)cc21	ZINC000090451300	260359832	/nfs/dbraw/zinc/35/98/32/260359832.db2.gz	SMWAUCNINAYVDE-CQSZACIVSA-N	1	0	297.851	4.059	20	30		CIEDRO
C[C@@H](C[NH2+]CC(C)(C)CCC#N)c1cccc(Cl)c1	ZINC000518247573	260361173	/nfs/dbraw/zinc/36/11/73/260361173.db2.gz	GENWVKISSCCHLB-ZDUSSCGKSA-N	1	0	278.827	4.363	20	30		CIEDRO
COc1cccc([C@H](C)[NH2+][C@@H](CCC#N)c2ccccc2)c1	ZINC000090665185	260465305	/nfs/dbraw/zinc/46/53/05/260465305.db2.gz	LVELTXOTCJXXMQ-KXBFYZLASA-N	1	0	294.398	4.391	20	30		CIEDRO
C=CCCC[NH2+][C@H](C)c1cccc(-c2ccncc2)c1	ZINC000448026100	260582411	/nfs/dbraw/zinc/58/24/11/260582411.db2.gz	GYHIYQDLJHWHSK-OAHLLOKOSA-N	1	0	266.388	4.365	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]Cc1ccc(-c2ccccc2)o1	ZINC000525694756	260918037	/nfs/dbraw/zinc/91/80/37/260918037.db2.gz	ZNDLKTBUSLPFDO-UHFFFAOYSA-N	1	0	282.387	4.366	20	30		CIEDRO
Cc1ccccc1NC1CC[NH+](CC(C)(C)CCC#N)CC1	ZINC000371421209	260958489	/nfs/dbraw/zinc/95/84/89/260958489.db2.gz	OIXFTBKHSSWEOT-UHFFFAOYSA-N	1	0	299.462	4.201	20	30		CIEDRO
C=CCC[NH2+][C@@H](C)c1cc(F)c(Cl)cc1Cl	ZINC000162155022	261133205	/nfs/dbraw/zinc/13/32/05/261133205.db2.gz	VCOJSHTXPPSWOI-QMMMGPOBSA-N	1	0	262.155	4.359	20	30		CIEDRO
Cc1cc([C@H]([NH2+]Cc2cccc(C#N)c2)C2CC2)ccc1F	ZINC000158696659	261169430	/nfs/dbraw/zinc/16/94/30/261169430.db2.gz	LVXZVPHIFRVDPQ-LJQANCHMSA-N	1	0	294.373	4.247	20	30		CIEDRO
N#CCCCC[N@@H+]1Cc2ccccc2C[C@@H]1c1ccccc1	ZINC000174039824	261176133	/nfs/dbraw/zinc/17/61/33/261176133.db2.gz	JHVSAZSKROWYFY-HXUWFJFHSA-N	1	0	290.410	4.480	20	30		CIEDRO
Cc1cc(N(C)Cc2cccc(C#N)c2)c2ccccc2[nH+]1	ZINC000301111726	261330398	/nfs/dbraw/zinc/33/03/98/261330398.db2.gz	VKYDJAVXFPFZFC-UHFFFAOYSA-N	1	0	287.366	4.051	20	30		CIEDRO
N#CC1CC[NH+](CCCSc2ccccc2Cl)CC1	ZINC000171381949	261463365	/nfs/dbraw/zinc/46/33/65/261463365.db2.gz	GFYPJLGECFZCFK-UHFFFAOYSA-N	1	0	294.851	4.058	20	30		CIEDRO
Cc1ccccc1[C@@H]([NH2+]Cc1cccc(C#N)c1)C1CC1	ZINC000171843965	261483377	/nfs/dbraw/zinc/48/33/77/261483377.db2.gz	JFDBWDMSFMAYMK-IBGZPJMESA-N	1	0	276.383	4.108	20	30		CIEDRO
CCCC[C@@H]([NH2+]Cc1ccc(C#N)o1)c1ccc(OC)cc1	ZINC000174345814	261567735	/nfs/dbraw/zinc/56/77/35/261567735.db2.gz	XDVPLQCPQTVHED-GOSISDBHSA-N	1	0	298.386	4.181	20	30		CIEDRO
Cc1nc(C)c([C@@H](C)[N@H+](C)CCCC(C)(C)C#N)s1	ZINC000174852762	261585605	/nfs/dbraw/zinc/58/56/05/261585605.db2.gz	FOYYUCIDEZAXPR-GFCCVEGCSA-N	1	0	279.453	4.083	20	30		CIEDRO
C[C@H]([NH2+][C@H](CCC#N)c1ccccc1)[C@@H]1CC1(C)C	ZINC000487578421	261831334	/nfs/dbraw/zinc/83/13/34/261831334.db2.gz	XRFBAEZHMMWQCX-CWRNSKLLSA-N	1	0	256.393	4.056	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](CCC#N)c1ccccc1)c1ccc(Cl)nc1	ZINC000181575099	261903830	/nfs/dbraw/zinc/90/38/30/261903830.db2.gz	ABQHCIPTNWSYEG-CJNGLKHVSA-N	1	0	299.805	4.431	20	30		CIEDRO
CCCC[C@@H]([NH2+]CCCCC#N)c1ccc(OC)cc1	ZINC000182149616	261926105	/nfs/dbraw/zinc/92/61/05/261926105.db2.gz	QYMYSWYSOQAMLT-QGZVFWFLSA-N	1	0	274.408	4.210	20	30		CIEDRO
C[C@@H]([NH2+]CCCCC#N)c1cc2ccccc2s1	ZINC000184363106	262018166	/nfs/dbraw/zinc/01/81/66/262018166.db2.gz	TVVVAOAWCZVWRY-GFCCVEGCSA-N	1	0	258.390	4.246	20	30		CIEDRO
C[C@H]([NH2+]CCCCC#N)c1cc2ccccc2s1	ZINC000184363090	262018280	/nfs/dbraw/zinc/01/82/80/262018280.db2.gz	TVVVAOAWCZVWRY-LBPRGKRZSA-N	1	0	258.390	4.246	20	30		CIEDRO
Cc1cncc([C@H](C)[NH2+][C@@H](CCC#N)c2ccccc2)c1	ZINC000184419405	262020169	/nfs/dbraw/zinc/02/01/69/262020169.db2.gz	GDJAETUZTFKHCF-YJBOKZPZSA-N	1	0	279.387	4.086	20	30		CIEDRO
N#C[C@H]1CCC[C@H](Nc2cccc(C[NH+]3CCCCC3)c2)C1	ZINC000185726860	262068740	/nfs/dbraw/zinc/06/87/40/262068740.db2.gz	WUEQGWYVONVUQP-WMZOPIPTSA-N	1	0	297.446	4.167	20	30		CIEDRO
Cc1cc([C@@H](C)[NH2+][C@H]2CCC[C@H](C#N)C2)c(C)s1	ZINC000185770112	262069836	/nfs/dbraw/zinc/06/98/36/262069836.db2.gz	BXGNBTKOSQNECK-XBFCOCLRSA-N	1	0	262.422	4.098	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+][C@@H]2CCSc3c(F)cccc32)C1	ZINC000185771879	262070005	/nfs/dbraw/zinc/07/00/05/262070005.db2.gz	NUEPCBPISCEVFQ-SLEUVZQESA-N	1	0	290.407	4.035	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H](C)c2ccc(OC)cc2)cc1	ZINC000318898116	262105661	/nfs/dbraw/zinc/10/56/61/262105661.db2.gz	JHXOQAVVCZGSOV-HNNXBMFYSA-N	1	0	297.398	4.111	20	30		CIEDRO
C=C(C)C[N@@H+](C)Cc1ccc(-c2ccccc2OC)cc1	ZINC000497248416	262124023	/nfs/dbraw/zinc/12/40/23/262124023.db2.gz	PWFQSIBACAJQLE-UHFFFAOYSA-N	1	0	281.399	4.370	20	30		CIEDRO
N#Cc1ccc(C[N@H+](CC2CC2)C2CCCCC2)s1	ZINC000514084898	262140439	/nfs/dbraw/zinc/14/04/39/262140439.db2.gz	SKKONYCIQWWVLT-UHFFFAOYSA-N	1	0	274.433	4.164	20	30		CIEDRO
CC(C)[C@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)c1ccc(F)cc1	ZINC000503928419	262186837	/nfs/dbraw/zinc/18/68/37/262186837.db2.gz	SUIDJSYPUGFGFD-COXVUDFISA-N	1	0	274.383	4.195	20	30		CIEDRO
C[N@H+](Cc1cccc(C#N)c1)[C@H]1CCC[C@H]1c1ccccc1	ZINC000497760098	262202157	/nfs/dbraw/zinc/20/21/57/262202157.db2.gz	WYKWYIXPNIWBNL-PMACEKPBSA-N	1	0	290.410	4.326	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+][C@H]2CCSc3ccc(F)cc32)C1	ZINC000192750342	262210266	/nfs/dbraw/zinc/21/02/66/262210266.db2.gz	YBXFQYCPZGEAJS-WHOFXGATSA-N	1	0	290.407	4.035	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@@H](C)c1ccccc1OC(F)F	ZINC000393820950	262215645	/nfs/dbraw/zinc/21/56/45/262215645.db2.gz	KQZIJJMWPSLAES-NWDGAFQWSA-N	1	0	269.335	4.293	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1cc(Br)ccc1F	ZINC000390618598	262228902	/nfs/dbraw/zinc/22/89/02/262228902.db2.gz	HQFLCSDLLPRZKP-LBPRGKRZSA-N	1	0	286.188	4.033	20	30		CIEDRO
CC(C)(C)c1ccc(C[NH2+][C@@H]2CCC[C@H](C#N)C2)cc1	ZINC000463282500	262303935	/nfs/dbraw/zinc/30/39/35/262303935.db2.gz	MYXVBTHGJXXOOT-DOTOQJQBSA-N	1	0	270.420	4.156	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1ccc(Cl)cc1	ZINC000185755979	262308339	/nfs/dbraw/zinc/30/83/39/262308339.db2.gz	NRHOXFCUPBXHGG-XUJVJEKNSA-N	1	0	262.784	4.073	20	30		CIEDRO
Cc1c2ccccc2oc1[C@@H](C)[NH2+][C@@H]1CCC[C@H](C#N)C1	ZINC000185796697	262308624	/nfs/dbraw/zinc/30/86/24/262308624.db2.gz	AXCBWUMFDAFDIR-QLFBSQMISA-N	1	0	282.387	4.474	20	30		CIEDRO
CC(C)(C#N)CCCC[N@@H+]1CCC[C@H](c2nccs2)C1	ZINC000365440246	262365688	/nfs/dbraw/zinc/36/56/88/262365688.db2.gz	AUQATOGIYVDDAR-AWEZNQCLSA-N	1	0	291.464	4.043	20	30		CIEDRO
C[C@@H](CCc1ccccc1)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000021013435	262373803	/nfs/dbraw/zinc/37/38/03/262373803.db2.gz	RSOOXBHDWNHRAE-HOTGVXAUSA-N	1	0	278.399	4.230	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H](C)COC(C)C)c1ccccc1	ZINC000337238283	262439843	/nfs/dbraw/zinc/43/98/43/262439843.db2.gz	DIZHWEMDXQYJDF-RDJZCZTQSA-N	1	0	261.409	4.097	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCC1(OC)CCC1)c1ccccc1	ZINC000339073119	262592935	/nfs/dbraw/zinc/59/29/35/262592935.db2.gz	UZIRTBURXFRHCG-KRWDZBQOSA-N	1	0	273.420	4.243	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)CCC#N)c1cc(F)c(Cl)cc1Cl	ZINC000411443039	262694013	/nfs/dbraw/zinc/69/40/13/262694013.db2.gz	XHHRNDPZGALMJU-DTWKUNHWSA-N	1	0	289.181	4.475	20	30		CIEDRO
COc1ccc(C2([NH2+]CCC3(C#N)CCCCC3)CC2)cc1	ZINC000411455380	262694950	/nfs/dbraw/zinc/69/49/50/262694950.db2.gz	FGOQVZWQQUVWAF-UHFFFAOYSA-N	1	0	298.430	4.138	20	30		CIEDRO
C[C@H](CCC#N)[NH+]1CCC([C@@H](F)c2ccccc2F)CC1	ZINC000411719107	262705144	/nfs/dbraw/zinc/70/51/44/262705144.db2.gz	KMIHRCMVMFOIMQ-CXAGYDPISA-N	1	0	292.373	4.241	20	30		CIEDRO
C[C@@H](CCC#N)[NH2+][C@@H](C)c1ccc(F)c2ccccc21	ZINC000411737426	262705543	/nfs/dbraw/zinc/70/55/43/262705543.db2.gz	PPWOXWHVXKBDHY-STQMWFEESA-N	1	0	270.351	4.322	20	30		CIEDRO
COc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(C#N)cc2)c(C)c1	ZINC000414074234	262801402	/nfs/dbraw/zinc/80/14/02/262801402.db2.gz	NVCZGPBYRNCBHL-LSDHHAIUSA-N	1	0	294.398	4.287	20	30		CIEDRO
CC(C)(CC#N)C[NH2+][C@@H]1CCCOc2cc(Cl)ccc21	ZINC000414162168	262819096	/nfs/dbraw/zinc/81/90/96/262819096.db2.gz	GORYTBIQTPOQAX-CQSZACIVSA-N	1	0	292.810	4.083	20	30		CIEDRO
CC(C)(C)[C@@H]1CCC[C@H]1[NH2+]C1CCC(C)(C#N)CC1	ZINC000414310665	262841201	/nfs/dbraw/zinc/84/12/01/262841201.db2.gz	WXSFELKAXJWGCL-GYMHETDLSA-N	1	0	262.441	4.263	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]Cc1cc2ccccc2s1	ZINC000266209819	262915371	/nfs/dbraw/zinc/91/53/71/262915371.db2.gz	NVLAKBBQCKSHDE-UHFFFAOYSA-N	1	0	272.417	4.321	20	30		CIEDRO
CC[C@@H]([NH2+]CCC(C)(C)C#N)c1ccccc1OC(F)F	ZINC000272000171	263001036	/nfs/dbraw/zinc/00/10/36/263001036.db2.gz	HLXJACWHTCIJPR-CYBMUJFWSA-N	1	0	296.361	4.269	20	30		CIEDRO
Cc1cccc([C@H]2CC[N@H+](CCCC(C)(C)C#N)C2)c1	ZINC000273142255	263013365	/nfs/dbraw/zinc/01/33/65/263013365.db2.gz	VTJPJQJVINXXBP-KRWDZBQOSA-N	1	0	270.420	4.114	20	30		CIEDRO
N#CCCC[NH2+][C@@H]1CCCc2nc(-c3ccccc3)sc21	ZINC000273275853	263014527	/nfs/dbraw/zinc/01/45/27/263014527.db2.gz	PLWZFJFLHKPPKV-CQSZACIVSA-N	1	0	297.427	4.081	20	30		CIEDRO
CC[C@@H]([NH2+]CCC(C)(C)C#N)c1ccc(Cl)s1	ZINC000273478958	263017244	/nfs/dbraw/zinc/01/72/44/263017244.db2.gz	HRHIYJYJNJEUTM-SNVBAGLBSA-N	1	0	270.829	4.382	20	30		CIEDRO
COc1ccc2oc([C@H](C)[NH2+][C@H]3CC[C@@H](C#N)C3)c(C)c2c1	ZINC000274603128	263027383	/nfs/dbraw/zinc/02/73/83/263027383.db2.gz	IHLFRACDXXCYNJ-MJBXVCDLSA-N	1	0	298.386	4.093	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1cccc(C(F)(F)F)c1	ZINC000274657576	263028885	/nfs/dbraw/zinc/02/88/85/263028885.db2.gz	UVIMQOBFBDNYFL-COPLHBTASA-N	1	0	282.309	4.048	20	30		CIEDRO
C[C@H](CCC#N)[NH+]1CCC(c2c[nH]c3ccccc32)CC1	ZINC000276319167	263036089	/nfs/dbraw/zinc/03/60/89/263036089.db2.gz	ODVFWIFNUBTDJJ-CQSZACIVSA-N	1	0	281.403	4.040	20	30		CIEDRO
C[C@@H](CCC#N)[NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CC1	ZINC000276339167	263036339	/nfs/dbraw/zinc/03/63/39/263036339.db2.gz	SVJOZVFAXUNYDY-XHDPSFHLSA-N	1	0	296.336	4.438	20	30		CIEDRO
N#CC1CC[NH+](Cc2ccc(-c3cccs3)cc2)CC1	ZINC000277594018	263042074	/nfs/dbraw/zinc/04/20/74/263042074.db2.gz	DNMXOMOANYRISX-UHFFFAOYSA-N	1	0	282.412	4.151	20	30		CIEDRO
CC[C@H](c1ccncc1)[N@H+](C)CCCCC(C)(C)C#N	ZINC000277595707	263042392	/nfs/dbraw/zinc/04/23/92/263042392.db2.gz	DQSKIMHXSVJMTG-MRXNPFEDSA-N	1	0	273.424	4.185	20	30		CIEDRO
COc1ccccc1C(C)(C)[NH2+]CCCCC(C)(C)C#N	ZINC000277794007	263043197	/nfs/dbraw/zinc/04/31/97/263043197.db2.gz	SUVHBPRQPKKTCM-UHFFFAOYSA-N	1	0	288.435	4.240	20	30		CIEDRO
CC(C)[N@H+](CCCCC(C)(C)C#N)Cc1ccc(C#N)cc1	ZINC000277835876	263043619	/nfs/dbraw/zinc/04/36/19/263043619.db2.gz	WNWZHDSBSIQZSO-UHFFFAOYSA-N	1	0	297.446	4.489	20	30		CIEDRO
C[N@H+](CCCCC(C)(C)C#N)Cc1ccc(F)c(F)c1	ZINC000278235808	263046075	/nfs/dbraw/zinc/04/60/75/263046075.db2.gz	VVCVOZSSWQWBFY-UHFFFAOYSA-N	1	0	280.362	4.117	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)c1ccccc1OC(F)F	ZINC000278279094	263046357	/nfs/dbraw/zinc/04/63/57/263046357.db2.gz	PUXIEYOMOUMCTL-XQQFMLRXSA-N	1	0	294.345	4.021	20	30		CIEDRO
CC(C)(C#N)CCCC[NH2+][C@H](c1ccccc1)C1CC1	ZINC000278775516	263051048	/nfs/dbraw/zinc/05/10/48/263051048.db2.gz	NJKTUOXIUICIQL-QGZVFWFLSA-N	1	0	270.420	4.447	20	30		CIEDRO
C[C@H]([NH2+]CCCCC(C)(C)C#N)c1c(F)cccc1F	ZINC000278824079	263051100	/nfs/dbraw/zinc/05/11/00/263051100.db2.gz	PWRMZKYOCBQQJR-LBPRGKRZSA-N	1	0	280.362	4.335	20	30		CIEDRO
CSc1ccccc1C[N@H+](C)CC(C)(C)CCC#N	ZINC000279648968	263056634	/nfs/dbraw/zinc/05/66/34/263056634.db2.gz	KGDGLXVYSABQKD-UHFFFAOYSA-N	1	0	276.449	4.170	20	30		CIEDRO
C[NH+](C)Cc1ccc(NCC(C)(C)CCC#N)cc1Cl	ZINC000280286893	263060185	/nfs/dbraw/zinc/06/01/85/263060185.db2.gz	NXAKMZQRLHLGJB-UHFFFAOYSA-N	1	0	293.842	4.143	20	30		CIEDRO
N#CC1CCC(C[NH2+][C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000282260739	263075428	/nfs/dbraw/zinc/07/54/28/263075428.db2.gz	JZICIVNCZUNIOD-HWMSQKFYSA-N	1	0	282.431	4.242	20	30		CIEDRO
C[C@H](CCc1cccc(F)c1)[NH2+]CC1CCC(C#N)CC1	ZINC000282484071	263077133	/nfs/dbraw/zinc/07/71/33/263077133.db2.gz	XBYJNIDGQODXGV-ODIFPOPNSA-N	1	0	288.410	4.066	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]CC1CC(c2ccccc2)C1	ZINC000282736782	263078428	/nfs/dbraw/zinc/07/84/28/263078428.db2.gz	TVHRKUWJLPSFGH-UHFFFAOYSA-N	1	0	270.420	4.100	20	30		CIEDRO
CC(C)Oc1ccc([C@@H](C)[NH2+]CCCCC#N)cc1Cl	ZINC000284303746	263086476	/nfs/dbraw/zinc/08/64/76/263086476.db2.gz	KWLXJQHWVGNXAH-CYBMUJFWSA-N	1	0	294.826	4.472	20	30		CIEDRO
CCCCOc1ccc([C@H](C)[NH2+]CCCCC#N)cc1	ZINC000284303854	263086515	/nfs/dbraw/zinc/08/65/15/263086515.db2.gz	KXVKNNNYCCXKMA-HNNXBMFYSA-N	1	0	274.408	4.210	20	30		CIEDRO
CC1(C)CC[C@H]1[NH2+][C@H](CCCC#N)c1ccccc1	ZINC000340430972	263141851	/nfs/dbraw/zinc/14/18/51/263141851.db2.gz	IKZYGFBHVVVUQK-HZPDHXFCSA-N	1	0	256.393	4.200	20	30		CIEDRO
C[C@H]([NH2+][C@@H](CCCC#N)c1ccccc1)c1nccs1	ZINC000340431842	263144976	/nfs/dbraw/zinc/14/49/76/263144976.db2.gz	JNMOKTAFXIPSTN-ZFWWWQNUSA-N	1	0	285.416	4.229	20	30		CIEDRO
N#CCCC[C@H]([NH2+][C@H]1CCC12CCC2)c1ccccc1	ZINC000340448757	263153564	/nfs/dbraw/zinc/15/35/64/263153564.db2.gz	KCMMRMOOZZBDDY-IRXDYDNUSA-N	1	0	268.404	4.344	20	30		CIEDRO
C[C@H]([NH2+][C@H](CCCC#N)c1ccccc1)c1ccco1	ZINC000340449746	263155563	/nfs/dbraw/zinc/15/55/63/263155563.db2.gz	WQBBGEMGOAXZSA-GOEBONIOSA-N	1	0	268.360	4.365	20	30		CIEDRO
Cc1ccnc([C@H](C)[NH2+][C@@H](CCCC#N)c2ccccc2)c1	ZINC000340449696	263155618	/nfs/dbraw/zinc/15/56/18/263155618.db2.gz	VVHAEABZTFHGDX-WMZOPIPTSA-N	1	0	293.414	4.476	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](CCCC#N)c1ccccc1)c1ccco1	ZINC000340449748	263155693	/nfs/dbraw/zinc/15/56/93/263155693.db2.gz	WQBBGEMGOAXZSA-ZBFHGGJFSA-N	1	0	268.360	4.365	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](CCCC#N)c1ccccc1)c1cccnc1	ZINC000340451047	263155721	/nfs/dbraw/zinc/15/57/21/263155721.db2.gz	ZJNGBFLFDPGVEK-QAPCUYQASA-N	1	0	279.387	4.167	20	30		CIEDRO
N#CCCC[C@H]([NH2+]C1Cc2ccccc2C1)c1ccccc1	ZINC000340453900	263157001	/nfs/dbraw/zinc/15/70/01/263157001.db2.gz	RSFIUADIOXXKTI-FQEVSTJZSA-N	1	0	290.410	4.179	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([N@@H+]2CC=C(c3cccc(Cl)c3)CC2)C1	ZINC000294257607	263158582	/nfs/dbraw/zinc/15/85/82/263158582.db2.gz	UUMMEJPRDSBLSC-DYVFJYSZSA-N	1	0	286.806	4.121	20	30		CIEDRO
N#C[C@H]1CC[C@H]([NH+]2CCC(c3ccc(Cl)cc3)CC2)C1	ZINC000294485465	263162558	/nfs/dbraw/zinc/16/25/58/263162558.db2.gz	HLXVPCUZANKQRC-GUYCJALGSA-N	1	0	288.822	4.212	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+]CCCc2c(F)cccc2Cl)C1	ZINC000294929543	263169520	/nfs/dbraw/zinc/16/95/20/263169520.db2.gz	BNSBKUPLAUSVGS-STQMWFEESA-N	1	0	294.801	4.084	20	30		CIEDRO
CSc1ccc([C@H](C)[NH2+][C@H]2CC[C@@H](CC#N)C2)cc1F	ZINC000294929522	263169565	/nfs/dbraw/zinc/16/95/65/263169565.db2.gz	BNPJOXJVUIITLC-OBJOEFQTSA-N	1	0	292.423	4.281	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccc(F)c(Cl)c1	ZINC000295835125	263182810	/nfs/dbraw/zinc/18/28/10/263182810.db2.gz	AFBYFNBTXFLNLU-MDZLAQPJSA-N	1	0	280.774	4.212	20	30		CIEDRO
Cc1cc([C@@H](C)[NH2+][C@H]2CC[C@@H](CC#N)C2)c(C)s1	ZINC000296304452	263189358	/nfs/dbraw/zinc/18/93/58/263189358.db2.gz	GAQIIRDUOARHBG-XBFCOCLRSA-N	1	0	262.422	4.098	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1cccc(C(F)(F)F)c1	ZINC000296319876	263190156	/nfs/dbraw/zinc/19/01/56/263190156.db2.gz	GUBWARDBFBBGKD-HUBLWGQQSA-N	1	0	296.336	4.438	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccc(F)cc1Cl	ZINC000296413705	263191215	/nfs/dbraw/zinc/19/12/15/263191215.db2.gz	LAMVKKANWZSDIL-MDZLAQPJSA-N	1	0	280.774	4.212	20	30		CIEDRO
Cc1ccc([C@@H](C)[NH2+][C@H]2CC[C@@H](CC#N)C2)c(C)c1	ZINC000296621368	263194369	/nfs/dbraw/zinc/19/43/69/263194369.db2.gz	WXTKCEVMJNQSJJ-PMPSAXMXSA-N	1	0	256.393	4.036	20	30		CIEDRO
COc1cc(C)c([C@H](C)[NH2+][C@H]2CC[C@@H](CC#N)C2)cc1C	ZINC000296621219	263194391	/nfs/dbraw/zinc/19/43/91/263194391.db2.gz	WWVBMUSMIAIUDJ-JYJNAYRXSA-N	1	0	286.419	4.045	20	30		CIEDRO
N#CCC[C@H]([NH2+][C@H]1CCc2cccc(O)c21)c1ccccc1	ZINC000296926541	263198400	/nfs/dbraw/zinc/19/84/00/263198400.db2.gz	PXHNJCGGYQMMBW-IRXDYDNUSA-N	1	0	292.382	4.014	20	30		CIEDRO
C[C@@H](CCC#N)[N@H+]1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2	ZINC000298602515	263222698	/nfs/dbraw/zinc/22/26/98/263222698.db2.gz	SKXGMCZFNXCQCM-OWLYRPNTSA-N	1	0	268.404	4.089	20	30		CIEDRO
COc1ccc2oc([C@H](C)[NH2+][C@H](C)CCC#N)c(C)c2c1	ZINC000299154988	263232450	/nfs/dbraw/zinc/23/24/50/263232450.db2.gz	XCWJMBRZRNCAKL-YPMHNXCESA-N	1	0	286.375	4.093	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)CCC#N)c1cccc2ccccc21	ZINC000299566202	263247590	/nfs/dbraw/zinc/24/75/90/263247590.db2.gz	HBMZZTRTGPNLMH-UONOGXRCSA-N	1	0	252.361	4.183	20	30		CIEDRO
CC[C@H]([NH2+][C@H](C)CCC#N)c1ccccc1OC(F)F	ZINC000299733119	263254498	/nfs/dbraw/zinc/25/44/98/263254498.db2.gz	YGPVXPBOYKAPSW-YPMHNXCESA-N	1	0	282.334	4.021	20	30		CIEDRO
CC(C)[C@@H]1CC[C@@H]1[NH2+][C@H](CCC#N)c1ccccc1	ZINC000353632925	263281712	/nfs/dbraw/zinc/28/17/12/263281712.db2.gz	QTGCNLKXQWPMPG-BBWFWOEESA-N	1	0	256.393	4.056	20	30		CIEDRO
C[C@@H]([NH2+][C@H](C)[C@@H]1C[C@H]1c1cccs1)c1ccc(C#N)cc1	ZINC000417348860	263797867	/nfs/dbraw/zinc/79/78/67/263797867.db2.gz	ZJGFCNDRBBRROO-UTJXIGIESA-N	1	0	296.439	4.463	20	30		CIEDRO
Cc1ccc2cc([C@@H](C)[NH2+]Cc3cccc(C#N)c3)oc2c1	ZINC000425911981	263816839	/nfs/dbraw/zinc/81/68/39/263816839.db2.gz	CTFCUZBBIFVZSY-CQSZACIVSA-N	1	0	290.366	4.464	20	30		CIEDRO
Cc1cc(C[N@@H+](C)[C@H](C)c2cccc(C#N)c2)cs1	ZINC000425363609	264136871	/nfs/dbraw/zinc/13/68/71/264136871.db2.gz	CEXSCPYEBCTAJZ-CYBMUJFWSA-N	1	0	270.401	4.121	20	30		CIEDRO
C[C@@H](c1cccc(C#N)c1)[N@H+](C)Cc1scnc1C1CC1	ZINC000425364944	264211351	/nfs/dbraw/zinc/21/13/51/264211351.db2.gz	HYCNTGAKTIDMFA-LBPRGKRZSA-N	1	0	297.427	4.085	20	30		CIEDRO
C=CCOc1ccccc1C[N@H+]1CC[C@@H](C(F)(F)F)[C@H]1C	ZINC000475286766	264289780	/nfs/dbraw/zinc/28/97/80/264289780.db2.gz	LVCUNNLPACHFND-TZMCWYRMSA-N	1	0	299.336	4.024	20	30		CIEDRO
CCC(CC)[N@H+](CCCC(C)(C)C#N)CC(C)C	ZINC000093309036	264305996	/nfs/dbraw/zinc/30/59/96/264305996.db2.gz	RBBDFUROACKOPS-UHFFFAOYSA-N	1	0	252.446	4.463	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](C)c1sc(C(C)C)nc1C	ZINC000180950136	264430687	/nfs/dbraw/zinc/43/06/87/264430687.db2.gz	VWRKGDXPAANYSM-MNOVXSKESA-N	1	0	252.427	4.190	20	30		CIEDRO
C[C@H](CC[NH2+]CC(C)(C)CCC#N)c1ccccc1	ZINC000135169466	264559050	/nfs/dbraw/zinc/55/90/50/264559050.db2.gz	GHYDBWRUIQSLNV-OAHLLOKOSA-N	1	0	258.409	4.100	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccc([C@H](C)O)cc1)c1ccco1	ZINC000285941633	264565768	/nfs/dbraw/zinc/56/57/68/264565768.db2.gz	FRNMASBSQPMQSV-WMLDXEAASA-N	1	0	285.387	4.130	20	30		CIEDRO
CCC(CC)[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccccc1	ZINC000442708095	264570275	/nfs/dbraw/zinc/57/02/75/264570275.db2.gz	IOLYHTLNWBZXEH-QGTPRVQTSA-N	1	0	270.420	4.446	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H](C)c1nc(C)cs1)c1ccco1	ZINC000286227584	264571582	/nfs/dbraw/zinc/57/15/82/264571582.db2.gz	SPCOJIKMJOXQBY-OCCSQVGLSA-N	1	0	290.432	4.445	20	30		CIEDRO
C[C@@H]1CCCC[C@H]1C[NH2+][C@H](CCC#N)c1ccccc1	ZINC000344300052	265057071	/nfs/dbraw/zinc/05/70/71/265057071.db2.gz	HZQWFERGDLEGFI-BPQIPLTHSA-N	1	0	270.420	4.447	20	30		CIEDRO
C[C@@H](c1ccccc1)[N@H+](CCCC#N)C1CCCC1	ZINC000347708101	265136788	/nfs/dbraw/zinc/13/67/88/265136788.db2.gz	QXLHYLFWLZZVKG-HNNXBMFYSA-N	1	0	256.393	4.296	20	30		CIEDRO
Cc1cc([C@H](C)[NH2+]Cc2cc(C#N)cs2)c(C)s1	ZINC000093492250	265181704	/nfs/dbraw/zinc/18/17/04/265181704.db2.gz	GGSMJASXQFSCJB-JTQLQIEISA-N	1	0	276.430	4.149	20	30		CIEDRO
C[C@H]([NH2+]Cc1cc(C#N)cs1)c1ccc2c(c1)CCCC2	ZINC000093492168	265182525	/nfs/dbraw/zinc/18/25/25/265182525.db2.gz	RYUSFNPAYICKNU-ZDUSSCGKSA-N	1	0	296.439	4.349	20	30		CIEDRO
CC(C)(C)[C@@H]([NH2+]Cc1cc(C#N)cs1)c1ccccc1	ZINC000093492334	265184066	/nfs/dbraw/zinc/18/40/66/265184066.db2.gz	OYOXXXHXOXHRHZ-INIZCTEOSA-N	1	0	284.428	4.497	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCCCC1(C)C)c1ccc(C#N)cc1	ZINC000094276596	265232485	/nfs/dbraw/zinc/23/24/85/265232485.db2.gz	QAQUJZWKDKETRN-BBRMVZONSA-N	1	0	256.393	4.178	20	30		CIEDRO
C[C@H]([NH2+]Cc1cccc(C2CC2)c1)c1ccc(C#N)cc1	ZINC000094518595	265247099	/nfs/dbraw/zinc/24/70/99/265247099.db2.gz	CYGKZLDJTKQGSQ-AWEZNQCLSA-N	1	0	276.383	4.286	20	30		CIEDRO
CC(C)[N@H+](Cc1cccc(F)c1)CC(C)(C)CCC#N	ZINC000507116030	266331416	/nfs/dbraw/zinc/33/14/16/266331416.db2.gz	NRGNAWCHAMDGGI-UHFFFAOYSA-N	1	0	276.399	4.366	20	30		CIEDRO
C=C(C)C[N@@H+]1CCc2sc(-c3csc(C)n3)cc2C1	ZINC000357609225	266335600	/nfs/dbraw/zinc/33/56/00/266335600.db2.gz	DRXCOQPLJUJFPU-UHFFFAOYSA-N	1	0	290.457	4.114	20	30		CIEDRO
C=C[C@@H](C)[NH2+][C@@H](C)c1nc(-c2ccccc2)cs1	ZINC000358301886	266451195	/nfs/dbraw/zinc/45/11/95/266451195.db2.gz	PJSKKUVGAVWGTD-NEPJUHHUSA-N	1	0	258.390	4.035	20	30		CIEDRO
N#Cc1ccc2c(c1)CCCC[C@H]2[NH2+]Cc1ccsc1	ZINC000360646946	266730591	/nfs/dbraw/zinc/73/05/91/266730591.db2.gz	KZSHKLDTPZTFEU-QGZVFWFLSA-N	1	0	282.412	4.177	20	30		CIEDRO
CC[C@H](CSC)[NH2+][C@@H]1CCCCc2cc(C#N)ccc21	ZINC000360649754	266730927	/nfs/dbraw/zinc/73/09/27/266730927.db2.gz	WAHRMSRMNPOCJL-NVXWUHKLSA-N	1	0	288.460	4.057	20	30		CIEDRO
C=C(C)CN1CCC([NH2+][C@H]2CC[C@H](C)c3ccccc32)CC1	ZINC000361210000	266802270	/nfs/dbraw/zinc/80/22/70/266802270.db2.gz	WMMSCAHPCNQBEK-JXFKEZNVSA-N	1	0	298.474	4.255	20	30		CIEDRO
N#Cc1ccc(C[N@@H+](Cc2cccc(F)c2)C2CC2)cc1F	ZINC000361691954	266870928	/nfs/dbraw/zinc/87/09/28/266870928.db2.gz	IDXNXSJAWISKBC-UHFFFAOYSA-N	1	0	298.336	4.001	20	30		CIEDRO
C[C@H]1CC[N@H+](CCCC#N)[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000361868894	266896974	/nfs/dbraw/zinc/89/69/74/266896974.db2.gz	PKXCCAKHMZFTJS-SWLSCSKDSA-N	1	0	296.336	4.392	20	30		CIEDRO
C[C@H]1C[C@@H](c2cccs2)C[N@@H+]1CCCC(C)(C)C#N	ZINC000363307246	267087000	/nfs/dbraw/zinc/08/70/00/267087000.db2.gz	QIHQPVYJRHAPBE-UONOGXRCSA-N	1	0	276.449	4.256	20	30		CIEDRO
C[C@@H]1C[C@@H](c2cccs2)C[N@@H+]1CCCC(C)(C)C#N	ZINC000363307247	267087143	/nfs/dbraw/zinc/08/71/43/267087143.db2.gz	QIHQPVYJRHAPBE-ZIAGYGMSSA-N	1	0	276.449	4.256	20	30		CIEDRO
CC(C)(C#N)CCCC[N@H+]1CC=C(c2ccc(O)cc2)CC1	ZINC000368435087	267171651	/nfs/dbraw/zinc/17/16/51/267171651.db2.gz	QZDOHRJQBPSDHE-UHFFFAOYSA-N	1	0	298.430	4.201	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H]1CC[C@@H](c2ccccc2)C1	ZINC000368595019	267190136	/nfs/dbraw/zinc/19/01/36/267190136.db2.gz	XVUJIRCQRVVTIT-SJORKVTESA-N	1	0	270.420	4.242	20	30		CIEDRO
Cc1cc(C)c2c(c1)[C@@H]([NH2+]CC(C)(C)CCC#N)CCO2	ZINC000369672767	267258587	/nfs/dbraw/zinc/25/85/87/267258587.db2.gz	SZOHQFBRJKRMPB-INIZCTEOSA-N	1	0	286.419	4.047	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C#N)cc1F)c1ccc(C2CC2)cc1	ZINC000418118976	267261972	/nfs/dbraw/zinc/26/19/72/267261972.db2.gz	WUSZHUAFBKGDJL-CYBMUJFWSA-N	1	0	294.373	4.426	20	30		CIEDRO
Cc1ccccc1[C@@H](CC(C)C)[NH2+]CCCCC#N	ZINC000118985948	267282900	/nfs/dbraw/zinc/28/29/00/267282900.db2.gz	NRAMQNRWRCMWMG-QGZVFWFLSA-N	1	0	258.409	4.366	20	30		CIEDRO
N#CCCC[N@@H+]1CCc2ccccc2[C@H]1Cc1ccccc1	ZINC000119137476	267303463	/nfs/dbraw/zinc/30/34/63/267303463.db2.gz	NNWZREFOOIWDEJ-HXUWFJFHSA-N	1	0	290.410	4.132	20	30		CIEDRO
C=C[C@H](C)[NH2+][C@H](C)c1csc(-c2csc(C)n2)c1	ZINC000119336958	267322670	/nfs/dbraw/zinc/32/26/70/267322670.db2.gz	UYSPNIOWYKRTGE-VHSXEESVSA-N	1	0	278.446	4.405	20	30		CIEDRO
C[C@H]([NH2+]CC1(C#N)CCC1)C1CCC(C(F)(F)F)CC1	ZINC000418138472	267360674	/nfs/dbraw/zinc/36/06/74/267360674.db2.gz	GDNBHGMVYXEISW-HIFPTAJRSA-N	1	0	288.357	4.027	20	30		CIEDRO
C[C@H](C[NH2+]CC1(C#N)CCC1)c1ccc(C(F)(F)F)cc1	ZINC000418135545	267367396	/nfs/dbraw/zinc/36/73/96/267367396.db2.gz	AZDHYPMRABLGIE-GFCCVEGCSA-N	1	0	296.336	4.092	20	30		CIEDRO
CCCC[NH2+][C@H](C)c1nc(-c2ccc(C#N)cc2)cs1	ZINC000376840359	268022186	/nfs/dbraw/zinc/02/21/86/268022186.db2.gz	CXLYDOODXRZJJE-GFCCVEGCSA-N	1	0	285.416	4.132	20	30		CIEDRO
CCCC[NH2+][C@@H](C)c1nc(-c2ccc(C#N)cc2)cs1	ZINC000376840360	268022439	/nfs/dbraw/zinc/02/24/39/268022439.db2.gz	CXLYDOODXRZJJE-LBPRGKRZSA-N	1	0	285.416	4.132	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1COc2ccc(C)cc21)c1ccc(C#N)cc1	ZINC000377083575	268046438	/nfs/dbraw/zinc/04/64/38/268046438.db2.gz	OHVTXOIUAPVPHO-ZWKOTPCHSA-N	1	0	292.382	4.041	20	30		CIEDRO
CC[C@@H]([NH2+][C@H]1COc2ccc(C)cc21)c1ccc(C#N)cc1	ZINC000377083571	268046470	/nfs/dbraw/zinc/04/64/70/268046470.db2.gz	OHVTXOIUAPVPHO-MSOLQXFVSA-N	1	0	292.382	4.041	20	30		CIEDRO
CCC[C@H]([NH2+]CCCCC(C)(C)C#N)C1CCC1	ZINC000324811321	328795031	/nfs/dbraw/zinc/79/50/31/328795031.db2.gz	SLUGHMBMAZHRMK-HNNXBMFYSA-N	1	0	250.430	4.265	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](C)c1cccc(NC(C)=O)c1	ZINC000182543203	327749958	/nfs/dbraw/zinc/74/99/58/327749958.db2.gz	QZCGTYMEGJWGAC-KBPBESRZSA-N	1	0	274.408	4.040	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@@H]1CCOC2(CCSCC2)C1	ZINC000540159353	327780812	/nfs/dbraw/zinc/78/08/12/327780812.db2.gz	CUSUCNKCSDHEMO-JKSUJKDBSA-N	1	0	297.508	4.156	20	30		CIEDRO
CC[C@@H]([NH2+]CCCCC#N)c1cccc(Br)c1	ZINC000178648552	327795427	/nfs/dbraw/zinc/79/54/27/327795427.db2.gz	GKFBNONJNSAEBH-CQSZACIVSA-N	1	0	295.224	4.184	20	30		CIEDRO
C[C@@H]([NH2+]CCCCC#N)c1cccc(-c2ccncc2)c1	ZINC000178650168	327795585	/nfs/dbraw/zinc/79/55/85/327795585.db2.gz	QOTBPBUFZAAJFV-OAHLLOKOSA-N	1	0	279.387	4.093	20	30		CIEDRO
C[C@@H]([NH2+]CCCC(C)(C)C#N)[C@H](C)c1ccccc1	ZINC000183336393	327819459	/nfs/dbraw/zinc/81/94/59/327819459.db2.gz	AUVRJTSJSMAZBH-LSDHHAIUSA-N	1	0	258.409	4.098	20	30		CIEDRO
CCC(CC)[C@H](CC[NH2+][C@@H](C)c1cccc(C#N)c1)OC	ZINC000540607110	327894319	/nfs/dbraw/zinc/89/43/19/327894319.db2.gz	LJHZJAVGAIYLEN-KSSFIOAISA-N	1	0	288.435	4.050	20	30		CIEDRO
N#Cc1csc(C[NH2+][C@@H]2CC[C@@H]3CCCC[C@H]3C2)c1	ZINC000531356327	327901121	/nfs/dbraw/zinc/90/11/21/327901121.db2.gz	OMXIDPNPGMVIMZ-SOUVJXGZSA-N	1	0	274.433	4.068	20	30		CIEDRO
CC(C)(C[NH2+][C@@H]1CCC[C@@H](C#N)C1)c1cccc(Cl)c1	ZINC000463284757	327915479	/nfs/dbraw/zinc/91/54/79/327915479.db2.gz	WDPRAZFLQFYQMD-CZUORRHYSA-N	1	0	290.838	4.290	20	30		CIEDRO
C[C@H]([NH2+]CC1CCC(C)CC1)c1cccc(C#N)c1	ZINC000063144834	328034624	/nfs/dbraw/zinc/03/46/24/328034624.db2.gz	OOUXQGLPXYCKNC-SLTAFYQDSA-N	1	0	256.393	4.035	20	30		CIEDRO
N#Cc1ccc(C[NH2+]CC2(Cc3ccccc3)CCC2)cc1	ZINC000531811138	328039053	/nfs/dbraw/zinc/03/90/53/328039053.db2.gz	IPFZPKXRGVCZOS-UHFFFAOYSA-N	1	0	290.410	4.061	20	30		CIEDRO
C=CCOc1cccc(C[NH2+]Cc2coc3ccccc23)c1	ZINC000563552467	328073223	/nfs/dbraw/zinc/07/32/23/328073223.db2.gz	PSXZMTUIEZURPR-UHFFFAOYSA-N	1	0	293.366	4.287	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+]Cc1ccc2[nH]c(C)cc2c1	ZINC000571069742	328083712	/nfs/dbraw/zinc/08/37/12/328083712.db2.gz	YMULVLLJFKYHLZ-INIZCTEOSA-N	1	0	256.393	4.311	20	30		CIEDRO
CCC(CC)C[N@H+](CCC#N)C[C@@H]1CCC2(CCCC2)O1	ZINC000571146989	328088032	/nfs/dbraw/zinc/08/80/32/328088032.db2.gz	XIDZARKVRZYGLV-KRWDZBQOSA-N	1	0	292.467	4.130	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)c1ccc(Oc2cccnc2)cc1	ZINC000571239122	328094676	/nfs/dbraw/zinc/09/46/76/328094676.db2.gz	CHGAOYFVVJTSNA-HNNXBMFYSA-N	1	0	282.387	4.491	20	30		CIEDRO
C=CC[C@@H](Cc1ccccc1)[NH2+][C@@H](C)c1cncc(C)c1	ZINC000414306853	328154310	/nfs/dbraw/zinc/15/43/10/328154310.db2.gz	RMBVTSQIGAVBSR-LPHOPBHVSA-N	1	0	280.415	4.228	20	30		CIEDRO
CCc1nc(C)c([C@H](C)[NH2+][C@H](C)c2ccc(C#N)cc2)s1	ZINC000268815211	328186270	/nfs/dbraw/zinc/18/62/70/328186270.db2.gz	PPPRJCFZUSAXSX-NEPJUHHUSA-N	1	0	299.443	4.297	20	30		CIEDRO
C[C@H]([NH2+]CCCCC#N)c1cc(Cl)cc(Cl)c1	ZINC000268897885	328186899	/nfs/dbraw/zinc/18/68/99/328186899.db2.gz	LPNOMQMUNBJLOD-JTQLQIEISA-N	1	0	271.191	4.338	20	30		CIEDRO
CC(C)[C@H](CC(F)(F)F)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000437097737	328197855	/nfs/dbraw/zinc/19/78/55/328197855.db2.gz	NLEASKQSAIYYLK-FZMZJTMJSA-N	1	0	284.325	4.186	20	30		CIEDRO
CC(C)[C@H](CC(F)(F)F)[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000437097738	328197958	/nfs/dbraw/zinc/19/79/58/328197958.db2.gz	NLEASKQSAIYYLK-RISCZKNCSA-N	1	0	284.325	4.186	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CC[C@@H](C#N)C1)c1ccccc1OC(F)F	ZINC000274678538	328212698	/nfs/dbraw/zinc/21/26/98/328212698.db2.gz	ZPKYWEFGEUIGPP-DYEKYZERSA-N	1	0	294.345	4.021	20	30		CIEDRO
N#C[C@H]1CC[C@@H](N2CCc3cc(Cl)cc(Cl)c3C2)C1	ZINC000278627772	328228706	/nfs/dbraw/zinc/22/87/06/328228706.db2.gz	NWJCKKPXQFMKSX-GXFFZTMASA-N	1	0	295.213	4.044	20	30		CIEDRO
N#C[C@@H]1CC[C@H](N2CCc3cc(Cl)cc(Cl)c3C2)C1	ZINC000278627775	328228723	/nfs/dbraw/zinc/22/87/23/328228723.db2.gz	NWJCKKPXQFMKSX-MFKMUULPSA-N	1	0	295.213	4.044	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH+]2Cc3ccccc3-c3ccccc3C2)C1	ZINC000278678344	328229354	/nfs/dbraw/zinc/22/93/54/328229354.db2.gz	RLCMOQCYVQBJHB-QAPCUYQASA-N	1	0	288.394	4.361	20	30		CIEDRO
CC[C@@H]([NH2+]CCCCC(C)(C)C#N)c1nc(C)cs1	ZINC000278856634	328231214	/nfs/dbraw/zinc/23/12/14/328231214.db2.gz	RTSIIVJCAZERAF-CYBMUJFWSA-N	1	0	279.453	4.212	20	30		CIEDRO
N#CC1CCC(C[NH2+][C@H]2CC[C@@H](c3ccccc3)C2)CC1	ZINC000281636021	328240886	/nfs/dbraw/zinc/24/08/86/328240886.db2.gz	IPGCLKRKCIZSCR-HWMSQKFYSA-N	1	0	282.431	4.242	20	30		CIEDRO
CC[C@@H]1CC[C@H]1[NH2+][C@@H](CCCC#N)c1ccccc1	ZINC000340429737	328276415	/nfs/dbraw/zinc/27/64/15/328276415.db2.gz	DILSTCBHSWTFQM-HYVNUMGLSA-N	1	0	256.393	4.200	20	30		CIEDRO
C[C@@H]1C[C@H]([NH2+][C@@H](CCCC#N)c2ccccc2)[C@@H]1C	ZINC000340440004	328277695	/nfs/dbraw/zinc/27/76/95/328277695.db2.gz	CCHOWIPHERZDMG-JHNDHUHGSA-N	1	0	256.393	4.056	20	30		CIEDRO
C[C@H]([NH2+][C@H](CCCC#N)c1ccccc1)c1ccccn1	ZINC000340444209	328278248	/nfs/dbraw/zinc/27/82/48/328278248.db2.gz	GYGCSCINHUOWMZ-MAUKXSAKSA-N	1	0	279.387	4.167	20	30		CIEDRO
C[C@@H]1CCC[C@H]1[NH2+][C@@H](CCCC#N)c1ccccc1	ZINC000340444349	328278270	/nfs/dbraw/zinc/27/82/70/328278270.db2.gz	DGRBIXXGFGBLTE-OIISXLGYSA-N	1	0	256.393	4.200	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](CCCC#N)c1ccccc1)c1ccccn1	ZINC000340444211	328278309	/nfs/dbraw/zinc/27/83/09/328278309.db2.gz	GYGCSCINHUOWMZ-QAPCUYQASA-N	1	0	279.387	4.167	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@@H]2c2ccc(F)cc2)C1	ZINC000294910317	328283757	/nfs/dbraw/zinc/28/37/57/328283757.db2.gz	ACEJDDLJLNAUES-VIBAHUMZSA-N	1	0	286.394	4.134	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@H]2CCC[C@H]2c2ccc(F)cc2)C1	ZINC000294910291	328283776	/nfs/dbraw/zinc/28/37/76/328283776.db2.gz	ACEJDDLJLNAUES-MGHWNKPDSA-N	1	0	286.394	4.134	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccc(Cl)cc1	ZINC000295053629	328284585	/nfs/dbraw/zinc/28/45/85/328284585.db2.gz	NSSJHWSKVAPYFL-HUBLWGQQSA-N	1	0	262.784	4.073	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1csc(Cl)c1	ZINC000296288633	328290023	/nfs/dbraw/zinc/29/00/23/328290023.db2.gz	FIMNZGOASSSGAZ-SCVCMEIPSA-N	1	0	268.813	4.134	20	30		CIEDRO
CC[NH+](CC)CCC[C@@H](C)Nc1cccc(Cl)c1C#N	ZINC000048935531	328326122	/nfs/dbraw/zinc/32/61/22/328326122.db2.gz	WFLNDOYGTXSTQI-CYBMUJFWSA-N	1	0	293.842	4.134	20	30		CIEDRO
C[C@H](CCc1ccccc1F)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000531950381	328327934	/nfs/dbraw/zinc/32/79/34/328327934.db2.gz	GAUHWJMZXBXZOW-CABCVRRESA-N	1	0	296.389	4.369	20	30		CIEDRO
C=CC[N@@H+](Cc1ccc(C#N)cc1)CC1CCCCC1	ZINC000303207724	328327969	/nfs/dbraw/zinc/32/79/69/328327969.db2.gz	QAXRMKVGHRQLCU-UHFFFAOYSA-N	1	0	268.404	4.127	20	30		CIEDRO
CCC1CCC([NH2+][C@H](C)c2cccc(C#N)c2)CC1	ZINC000049118065	328339910	/nfs/dbraw/zinc/33/99/10/328339910.db2.gz	OYHDFRSBTZMYMJ-TUBUQKNSSA-N	1	0	256.393	4.178	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+]Cc1cccc2[nH]ccc21	ZINC000111395299	328354118	/nfs/dbraw/zinc/35/41/18/328354118.db2.gz	CSGBMEIQKXJQLJ-UHFFFAOYSA-N	1	0	292.382	4.023	20	30		CIEDRO
CC(C)(C#N)CC[N@@H+](Cc1ccccc1)CC1CCC1	ZINC000534951850	328373100	/nfs/dbraw/zinc/37/31/00/328373100.db2.gz	LJMOISMJDWDAEF-UHFFFAOYSA-N	1	0	270.420	4.229	20	30		CIEDRO
CC(C)(C)[N@H+](CCC(C)(C)C#N)Cc1ccccc1	ZINC000534954344	328373439	/nfs/dbraw/zinc/37/34/39/328373439.db2.gz	QGZLABHQNGKPCA-UHFFFAOYSA-N	1	0	258.409	4.227	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H]1CCCOc2cc(Cl)ccc21	ZINC000341679666	328414008	/nfs/dbraw/zinc/41/40/08/328414008.db2.gz	BHGJUECXJGBMOW-BXUZGUMPSA-N	1	0	265.784	4.108	20	30		CIEDRO
CC[C@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)c1ccc(C#N)cc1	ZINC000571662464	328482853	/nfs/dbraw/zinc/48/28/53/328482853.db2.gz	PLVIJXCSACNZTL-UFYCRDLUSA-N	1	0	290.410	4.403	20	30		CIEDRO
Cc1[nH+]c2ccccc2c(NCC(C)(C)CCC#N)c1C	ZINC000563834590	328522869	/nfs/dbraw/zinc/52/28/69/328522869.db2.gz	IZXRQDXGQYVQQM-UHFFFAOYSA-N	1	0	281.403	4.015	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+]CCc1c[nH]c2ccc(F)cc12	ZINC000346041823	328569886	/nfs/dbraw/zinc/56/98/86/328569886.db2.gz	BFMIEGDUHNVJNQ-STQMWFEESA-N	1	0	274.383	4.040	20	30		CIEDRO
Cc1cc([C@H](C)[NH2+]CC#Cc2ccccc2)c(C)s1	ZINC000051814315	328635182	/nfs/dbraw/zinc/63/51/82/328635182.db2.gz	MKPRZZIXGSHCLS-AWEZNQCLSA-N	1	0	269.413	4.067	20	30		CIEDRO
C[C@H]1CC(C)(C)CC[C@@H]1[NH2+]CC(C)(C)CCC#N	ZINC000582199140	328629687	/nfs/dbraw/zinc/62/96/87/328629687.db2.gz	LBDSABSYDMKKLM-KBPBESRZSA-N	1	0	250.430	4.121	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+]Cc1ccc(C(F)F)cc1	ZINC000398104887	326871549	/nfs/dbraw/zinc/87/15/49/326871549.db2.gz	JWUKTHKEUQSTPP-LBPRGKRZSA-N	1	0	253.336	4.459	20	30		CIEDRO
C=CCCCC[NH2+][C@H](C)c1cc2cccc(OC)c2o1	ZINC000312579439	326917771	/nfs/dbraw/zinc/91/77/71/326917771.db2.gz	AESUNNMOLCOCHT-CYBMUJFWSA-N	1	0	273.376	4.448	20	30		CIEDRO
C[C@H]([NH2+]CCCCC#N)c1ccc(Cl)cc1Cl	ZINC000042224173	326932714	/nfs/dbraw/zinc/93/27/14/326932714.db2.gz	DRKVXCBBAXTWMS-JTQLQIEISA-N	1	0	271.191	4.338	20	30		CIEDRO
C=CC[C@@H](CO)C[NH2+][C@@H](C)c1ccc(SC(C)C)cc1	ZINC000539295860	326935435	/nfs/dbraw/zinc/93/54/35/326935435.db2.gz	ZFRXJZROKYMYCS-LSDHHAIUSA-N	1	0	293.476	4.022	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@@H](C)c1cccc(NC(C)=O)c1	ZINC000557384879	327004005	/nfs/dbraw/zinc/00/40/05/327004005.db2.gz	MYFRQNZFTPCKNJ-GJZGRUSLSA-N	1	0	288.435	4.431	20	30		CIEDRO
C[C@@H](Cc1ccsc1)[NH2+][C@@H]1CCCc2cc(C#N)ccc21	ZINC000557515792	327011381	/nfs/dbraw/zinc/01/13/81/327011381.db2.gz	GKWKDDOYXJGJFZ-SCLBCKFNSA-N	1	0	296.439	4.218	20	30		CIEDRO
Cc1cccc(CC[C@@H](C)[NH2+]CC(C)(C)CCC#N)c1	ZINC000558238789	327081095	/nfs/dbraw/zinc/08/10/95/327081095.db2.gz	KJPHHENURZVINK-MRXNPFEDSA-N	1	0	272.436	4.236	20	30		CIEDRO
C[C@@H]([NH2+]CC(C)(C)CCC#N)c1ccc(Cl)c(F)c1	ZINC000558244740	327081266	/nfs/dbraw/zinc/08/12/66/327081266.db2.gz	CATOIFSTKPWUJM-LLVKDONJSA-N	1	0	282.790	4.460	20	30		CIEDRO
C[C@H]([NH2+]CC(C)(C)CCC#N)c1ccc(F)cc1Cl	ZINC000558245561	327081303	/nfs/dbraw/zinc/08/13/03/327081303.db2.gz	GDXYKLAWMURWNL-NSHDSACASA-N	1	0	282.790	4.460	20	30		CIEDRO
Cc1ccccc1C[C@@H]([NH2+]CC(C)(C)CCC#N)C1CC1	ZINC000558246959	327081426	/nfs/dbraw/zinc/08/14/26/327081426.db2.gz	PZCBEGKHRJIOPU-GOSISDBHSA-N	1	0	284.447	4.236	20	30		CIEDRO
C[C@H]1CCc2c(F)cccc2[C@H]1[NH2+]CC(C)(C)CCC#N	ZINC000558248889	327081451	/nfs/dbraw/zinc/08/14/51/327081451.db2.gz	VIFJSACUTRXHBA-GUYCJALGSA-N	1	0	288.410	4.369	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@H]1CCC12CCOCC2)c1ccccc1	ZINC000374374172	327115710	/nfs/dbraw/zinc/11/57/10/327115710.db2.gz	LIVSBOLAPIPAPC-ROUUACIJSA-N	1	0	285.431	4.243	20	30		CIEDRO
C=CCCC[N@H+]1CC[C@H](C(F)(F)F)C2(CCC2)C1	ZINC000558740243	327118647	/nfs/dbraw/zinc/11/86/47/327118647.db2.gz	DJGVAGVLSHLWDH-LBPRGKRZSA-N	1	0	261.331	4.007	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+][C@H]1CCOC2(CCCC2)C1	ZINC000449189655	327119464	/nfs/dbraw/zinc/11/94/64/327119464.db2.gz	MMDKHGCOBUUFAZ-CVEARBPZSA-N	1	0	265.441	4.203	20	30		CIEDRO
C=CCOCC[N@@H+](CC)[C@@H](C)c1cc2ccccc2o1	ZINC000559049825	327139105	/nfs/dbraw/zinc/13/91/05/327139105.db2.gz	YWBUZCVFEZHXIZ-AWEZNQCLSA-N	1	0	273.376	4.018	20	30		CIEDRO
CC[N@H+](Cc1c(C)nsc1C)[C@H](C)c1ccc(C#N)cc1	ZINC000518109000	327146915	/nfs/dbraw/zinc/14/69/15/327146915.db2.gz	GCWXDGGWBIUGGT-CYBMUJFWSA-N	1	0	299.443	4.215	20	30		CIEDRO
C[C@H](c1cccc(Cl)c1)[NH+]1CCC(CCC#N)CC1	ZINC000569358381	327162675	/nfs/dbraw/zinc/16/26/75/327162675.db2.gz	YWVUXACQDHZLTL-CYBMUJFWSA-N	1	0	276.811	4.417	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)c1cccc(C2CC2)c1	ZINC000449349194	327166626	/nfs/dbraw/zinc/16/66/26/327166626.db2.gz	JBOIUWAJRKBAJX-SUNYJGFJSA-N	1	0	268.404	4.297	20	30		CIEDRO
CC1(C)CCC[C@@H]([NH2+][C@H]2CCc3ccc(C#N)cc32)C1	ZINC000569396541	327172355	/nfs/dbraw/zinc/17/23/55/327172355.db2.gz	CLHMVUXRNGXQBN-WBVHZDCISA-N	1	0	268.404	4.104	20	30		CIEDRO
C[N@H+](CCCCc1ccccc1)CC(C)(C)CCC#N	ZINC000091955815	327187898	/nfs/dbraw/zinc/18/78/98/327187898.db2.gz	DANFSUDLYDIONW-UHFFFAOYSA-N	1	0	272.436	4.271	20	30		CIEDRO
Cc1ccc(C[NH+]2CCCC2)cc1NCC(C)(C)CCC#N	ZINC000092173891	327188756	/nfs/dbraw/zinc/18/87/56/327188756.db2.gz	OTQYSZVCCPDNBN-UHFFFAOYSA-N	1	0	299.462	4.333	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH2+]CC2(c3ccccc3)CCCCC2)C1	ZINC000569541368	327195296	/nfs/dbraw/zinc/19/52/96/327195296.db2.gz	JZKPVXZRDRLMDH-SJLPKXTDSA-N	1	0	282.431	4.170	20	30		CIEDRO
CC(C)CC[C@@H]1CCC[N@@H+]1CC(C)(C)CCC#N	ZINC000093845105	327200493	/nfs/dbraw/zinc/20/04/93/327200493.db2.gz	GFPXOAYGBNQWJY-HNNXBMFYSA-N	1	0	250.430	4.217	20	30		CIEDRO
C=CCCC[C@@H](C)[NH+]1CCC(c2noc(C(C)C)n2)CC1	ZINC000569583205	327201286	/nfs/dbraw/zinc/20/12/86/327201286.db2.gz	JVUYTFGMTVGAGG-CQSZACIVSA-N	1	0	291.439	4.117	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+]C2CCC(c3ccc(O)cc3)CC2)C1	ZINC000584272616	327205995	/nfs/dbraw/zinc/20/59/95/327205995.db2.gz	JEIACDVEXGUABC-OBHHBEAMSA-N	1	0	298.430	4.090	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)CC(=O)Nc1ccc(C(C)C)cc1	ZINC000448031404	327238502	/nfs/dbraw/zinc/23/85/02/327238502.db2.gz	URSGBYOFQIVLED-HNNXBMFYSA-N	1	0	288.435	4.083	20	30		CIEDRO
CC[N@H+](CCC(C)(C)C#N)Cc1ccccc1Cl	ZINC000536471142	327240460	/nfs/dbraw/zinc/24/04/60/327240460.db2.gz	HOMFHWQDLZJJKW-UHFFFAOYSA-N	1	0	264.800	4.102	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1cccc(OCC(F)F)c1)C1CC1	ZINC000537974260	327254708	/nfs/dbraw/zinc/25/47/08/327254708.db2.gz	UDFAYDOPSGPXMU-INIZCTEOSA-N	1	0	295.373	4.165	20	30		CIEDRO
N#CC1CCC(C[NH2+][C@H]2CCCCC23CCCC3)CC1	ZINC000559844221	327264744	/nfs/dbraw/zinc/26/47/44/327264744.db2.gz	YAXZCQLWEXVCHD-JCYILVPMSA-N	1	0	274.452	4.409	20	30		CIEDRO
N#CC1CCC(C[NH2+][C@@H]2CCCCC23CCCC3)CC1	ZINC000559844224	327264773	/nfs/dbraw/zinc/26/47/73/327264773.db2.gz	YAXZCQLWEXVCHD-OFLPRAFFSA-N	1	0	274.452	4.409	20	30		CIEDRO
CC(C)C1([NH2+][C@H](C)c2ccc(C#N)cc2Cl)CC1	ZINC000559890725	327268317	/nfs/dbraw/zinc/26/83/17/327268317.db2.gz	ILLFZWYEIDDDPN-LLVKDONJSA-N	1	0	262.784	4.051	20	30		CIEDRO
N#CCCCC[N@@H+]1C[C@H]2CCCC[C@@]21c1ccccc1	ZINC000152499867	327276654	/nfs/dbraw/zinc/27/66/54/327276654.db2.gz	OGNNOVRROBCKON-QZTJIDSGSA-N	1	0	268.404	4.082	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+]Cc1ccc(NCCC)cc1	ZINC000560002496	327276757	/nfs/dbraw/zinc/27/67/57/327276757.db2.gz	LLQOYBGMFHZSLP-GJZGRUSLSA-N	1	0	260.425	4.199	20	30		CIEDRO
C[C@H](CC[NH2+]C1(c2cccc(C#N)c2)CC1)c1ccccc1	ZINC000560285421	327296506	/nfs/dbraw/zinc/29/65/06/327296506.db2.gz	PRIYZTCNNHXFMT-MRXNPFEDSA-N	1	0	290.410	4.331	20	30		CIEDRO
C[C@@H]1CC[N@H+](Cc2ccc(F)cc2C#N)[C@H]2CCCC[C@H]12	ZINC000560342742	327300860	/nfs/dbraw/zinc/30/08/60/327300860.db2.gz	JSXXAAPHXYTZFS-XWIAVFTESA-N	1	0	286.394	4.098	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H]2CCc3ccc(C)cc32)cc1	ZINC000560572234	327326598	/nfs/dbraw/zinc/32/65/98/327326598.db2.gz	BIGQVDFVUNALCY-FQEVSTJZSA-N	1	0	293.410	4.337	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](C)c1cc(C)ccc1OC(F)F	ZINC000560897136	327350672	/nfs/dbraw/zinc/35/06/72/327350672.db2.gz	AGDUNEGSBUJQIQ-VXGBXAGGSA-N	1	0	269.335	4.212	20	30		CIEDRO
CC1=C[C@@H](C)C[C@H](C[NH2+]C2(c3cccc(C#N)c3)CC2)C1	ZINC000564409889	327352031	/nfs/dbraw/zinc/35/20/31/327352031.db2.gz	FBHGZTFOSVZUES-PBHICJAKSA-N	1	0	280.415	4.129	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@@H](C)c1ccc([S@@](C)=O)cc1	ZINC000561017249	327358908	/nfs/dbraw/zinc/35/89/08/327358908.db2.gz	XMHDNZJGQWBQJU-AUSJPIAWSA-N	1	0	293.476	4.210	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@H](C)c1ccc([S@](C)=O)cc1	ZINC000561017254	327358980	/nfs/dbraw/zinc/35/89/80/327358980.db2.gz	XMHDNZJGQWBQJU-MDOVXXIYSA-N	1	0	293.476	4.210	20	30		CIEDRO
Fc1ccc(C#CC[NH2+]C2(c3ccc(Cl)cc3)CC2)cc1	ZINC000561160609	327370540	/nfs/dbraw/zinc/37/05/40/327370540.db2.gz	WGSCCLZEBHDURJ-UHFFFAOYSA-N	1	0	299.776	4.110	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@@H](CC)c1ccccc1O	ZINC000155782742	327396351	/nfs/dbraw/zinc/39/63/51/327396351.db2.gz	KIUMGSWJHRUKRV-KRWDZBQOSA-N	1	0	297.398	4.198	20	30		CIEDRO
C=CCCCCC[N@@H+](C)Cc1nc2ccccc2o1	ZINC000150902403	327396989	/nfs/dbraw/zinc/39/69/89/327396989.db2.gz	UXKXQUQPQPIKIA-UHFFFAOYSA-N	1	0	258.365	4.006	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)[C@H](C)c1nc2ccccc2s1	ZINC000246400058	327431407	/nfs/dbraw/zinc/43/14/07/327431407.db2.gz	LPKCHAPYNAVLRA-AVGNSLFASA-N	1	0	274.433	4.343	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1ccc(Br)cc1F	ZINC000381308664	327449104	/nfs/dbraw/zinc/44/91/04/327449104.db2.gz	KSMRDGZNDUFQFR-GFCCVEGCSA-N	1	0	286.188	4.033	20	30		CIEDRO
C=CC[NH+](Cc1cccc(F)c1)Cc1cccc(F)c1	ZINC000507341657	332803003	/nfs/dbraw/zinc/80/30/03/332803003.db2.gz	WVRGNLLGPQNUJL-UHFFFAOYSA-N	1	0	273.326	4.153	20	30		CIEDRO
C=CC[NH2+][C@@H](C)c1sc(-c2ccc(F)cc2)nc1C	ZINC000159834258	327570258	/nfs/dbraw/zinc/57/02/58/327570258.db2.gz	CARDGERYUAUKEH-JTQLQIEISA-N	1	0	276.380	4.094	20	30		CIEDRO
N#CCc1ccc(C[NH2+][C@@H]2CCc3cc(Cl)ccc32)cc1	ZINC000570450991	327592677	/nfs/dbraw/zinc/59/26/77/327592677.db2.gz	YIZHIHHTXGNBSU-GOSISDBHSA-N	1	0	296.801	4.183	20	30		CIEDRO
CC(C)(C)[C@H]1CCCC[C@H]1[NH2+]CCC(C)(C)C#N	ZINC000535664206	328607149	/nfs/dbraw/zinc/60/71/49/328607149.db2.gz	ZPTFRKGNCPCSBV-UONOGXRCSA-N	1	0	250.430	4.121	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CC(C)(C)c1ncccc1C)C1CC1	ZINC000519038157	328641072	/nfs/dbraw/zinc/64/10/72/328641072.db2.gz	YAESWKOFQJRIKB-MRXNPFEDSA-N	1	0	272.436	4.002	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)C1CCCCC1)c1cccc(C#N)c1	ZINC000052333984	328641466	/nfs/dbraw/zinc/64/14/66/328641466.db2.gz	FTNRIPCMDYYESI-UONOGXRCSA-N	1	0	256.393	4.178	20	30		CIEDRO
N#Cc1ccc(F)c(C[NH2+][C@H]2CCC[C@H]2c2ccccc2)c1	ZINC000527328914	328653473	/nfs/dbraw/zinc/65/34/73/328653473.db2.gz	BPDUHDXTRJMECJ-HKUYNNGSSA-N	1	0	294.373	4.123	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(CC#N)cc1)c1ccccc1Cl	ZINC000399029106	328658551	/nfs/dbraw/zinc/65/85/51/328658551.db2.gz	KVBMYDHYBCWACI-ZDUSSCGKSA-N	1	0	284.790	4.257	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(CC#N)cc1)c1cccc(Cl)c1	ZINC000399036229	328659261	/nfs/dbraw/zinc/65/92/61/328659261.db2.gz	OTIJQERYPUDURN-ZDUSSCGKSA-N	1	0	284.790	4.257	20	30		CIEDRO
C=CC[C@@H](Cc1ccccc1)[NH2+][C@H](C)c1ccoc1	ZINC000519632121	328692316	/nfs/dbraw/zinc/69/23/16/328692316.db2.gz	VDTQEMKHIVDNSF-PBHICJAKSA-N	1	0	255.361	4.118	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@H](CC2CC2)c2ccccc2)c1	ZINC000532196101	328704451	/nfs/dbraw/zinc/70/44/51/328704451.db2.gz	PNLUOVQAPSWUNJ-LJQANCHMSA-N	1	0	276.383	4.189	20	30		CIEDRO
C=CC[C@@H](C)[C@H](C)[NH2+]CCCc1c[nH]c2ccccc12	ZINC000532230896	328709064	/nfs/dbraw/zinc/70/90/64/328709064.db2.gz	GSWRFGMNLPJAOB-CABCVRRESA-N	1	0	270.420	4.291	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)c1ccc(OC(F)(F)F)cc1	ZINC000134731950	328772109	/nfs/dbraw/zinc/77/21/09/328772109.db2.gz	NKCKWWUZLILHMF-QWRGUYRKSA-N	1	0	273.298	4.200	20	30		CIEDRO
C[C@H](CC[NH2+][C@H](C)c1ccc(C#N)cc1)c1ccccc1	ZINC000043533627	328802285	/nfs/dbraw/zinc/80/22/85/328802285.db2.gz	IECCMWRMJJHROO-HZPDHXFCSA-N	1	0	278.399	4.403	20	30		CIEDRO
CCOc1ccccc1[C@H](C)[NH2+]Cc1ccc(CC#N)cc1	ZINC000563998968	328850195	/nfs/dbraw/zinc/85/01/95/328850195.db2.gz	QCQCUQIFJQBOEW-HNNXBMFYSA-N	1	0	294.398	4.002	20	30		CIEDRO
CCc1cnccc1[C@H](C)[NH2+][C@@H](C)c1ccc(C#N)cc1F	ZINC000358556412	328886964	/nfs/dbraw/zinc/88/69/64/328886964.db2.gz	LXVWGXFNCIUJTL-STQMWFEESA-N	1	0	297.377	4.067	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H]1CCc2sc(Br)cc21	ZINC000389745204	328951082	/nfs/dbraw/zinc/95/10/82/328951082.db2.gz	XECLALBXYBWRFF-WCBMZHEXSA-N	1	0	286.238	4.052	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]C1CC(c2cc(F)cc(F)c2)C1	ZINC000377850571	329031755	/nfs/dbraw/zinc/03/17/55/329031755.db2.gz	FTQYIUIZRZYANT-UHFFFAOYSA-N	1	0	292.373	4.130	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](C)c1cc(Br)cs1	ZINC000194102432	329065469	/nfs/dbraw/zinc/06/54/69/329065469.db2.gz	JNMWHDCNQVEFKR-RKDXNWHRSA-N	1	0	274.227	4.126	20	30		CIEDRO
C=CCC[C@@H]([NH2+][C@H](C)c1nccn1-c1ccccc1)C1CC1	ZINC000582505153	329098464	/nfs/dbraw/zinc/09/84/64/329098464.db2.gz	QXKZHJITZXJUMJ-CRAIPNDOSA-N	1	0	295.430	4.268	20	30		CIEDRO
N#Cc1cccc(CC[NH2+][C@@H](CC2CC2)c2ccccc2)c1	ZINC000582699948	329126213	/nfs/dbraw/zinc/12/62/13/329126213.db2.gz	HBVUEWUYXJJYNS-FQEVSTJZSA-N	1	0	290.410	4.232	20	30		CIEDRO
Cc1cc(Cl)cc(C[NH2+]CC2CCC(C#N)CC2)c1	ZINC000582714143	329129348	/nfs/dbraw/zinc/12/93/48/329129348.db2.gz	LQNRTDHNVLZFGG-UHFFFAOYSA-N	1	0	276.811	4.068	20	30		CIEDRO
CC(C)CCN(CCC#N)Cc1cc(F)cc2cccnc21	ZINC000173548517	329148717	/nfs/dbraw/zinc/14/87/17/329148717.db2.gz	NDOZBGPWLWUAAF-UHFFFAOYSA-N	1	0	299.393	4.136	20	30		CIEDRO
C=C(C)CCc1noc(-c2ccc(C[NH+](CC)CC)cc2)n1	ZINC000508633064	332845319	/nfs/dbraw/zinc/84/53/19/332845319.db2.gz	RNUQWSHCHDDYHJ-UHFFFAOYSA-N	1	0	299.418	4.087	20	30		CIEDRO
C[C@@H](c1cccc(Cl)c1F)[NH+]1CCC(CC#N)CC1	ZINC000547831042	329212476	/nfs/dbraw/zinc/21/24/76/329212476.db2.gz	MFXILKDFUSOUHD-NSHDSACASA-N	1	0	280.774	4.166	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCCOc2ccccc21)c1ccc(C#N)s1	ZINC000181643197	329235389	/nfs/dbraw/zinc/23/53/89/329235389.db2.gz	WJORWFZRFMVHHD-DOMZBBRYSA-N	1	0	298.411	4.184	20	30		CIEDRO
C[N@H+](Cc1ccc(C(F)F)cc1)Cc1cccc(C#N)c1	ZINC000183920522	329254545	/nfs/dbraw/zinc/25/45/45/329254545.db2.gz	CYHDEJAKCIYODG-UHFFFAOYSA-N	1	0	286.325	4.128	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CC[C@H](c2c(F)cccc2F)C1	ZINC000185309918	329272817	/nfs/dbraw/zinc/27/28/17/329272817.db2.gz	GFXGFTNUNMXSEK-ZDUSSCGKSA-N	1	0	292.373	4.084	20	30		CIEDRO
C=CCCC[NH2+]Cc1ccc(Oc2ccccc2)o1	ZINC000582825550	329274447	/nfs/dbraw/zinc/27/44/47/329274447.db2.gz	QGCQBWHMKXLQLM-UHFFFAOYSA-N	1	0	257.333	4.128	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+]CCc1nc2ccccc2s1	ZINC000583111010	329312975	/nfs/dbraw/zinc/31/29/75/329312975.db2.gz	DHRSDDHXTLUTJP-QWHCGFSZSA-N	1	0	274.433	4.029	20	30		CIEDRO
C=CCC[C@H](CO)[NH2+][C@H](C)c1cc(Cl)sc1Cl	ZINC000321423706	329354805	/nfs/dbraw/zinc/35/48/05/329354805.db2.gz	KUCIYXRVTYMACY-RKDXNWHRSA-N	1	0	294.247	4.033	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)c1ccc(OCCC)c(OC)c1	ZINC000508966637	332853212	/nfs/dbraw/zinc/85/32/12/332853212.db2.gz	PZPNBJLNNBLUCF-CQSZACIVSA-N	1	0	277.408	4.101	20	30		CIEDRO
CC(C)(CCC#N)C[N@@H+]1CC[C@@H](c2c(F)cccc2F)C1	ZINC000187594972	329359526	/nfs/dbraw/zinc/35/95/26/329359526.db2.gz	BYMYXINJXONRNZ-CYBMUJFWSA-N	1	0	292.373	4.084	20	30		CIEDRO
C[C@H](CCc1ccc(Cl)s1)[NH2+]CC(C)(C)CC#N	ZINC000459727586	329372536	/nfs/dbraw/zinc/37/25/36/329372536.db2.gz	HIEGLSNVHCHYER-LLVKDONJSA-N	1	0	284.856	4.252	20	30		CIEDRO
Cc1cccc2c1OCC[C@@H]2[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000189460135	329380644	/nfs/dbraw/zinc/38/06/44/329380644.db2.gz	QDJPXVKTYPLFKZ-KDOFPFPSSA-N	1	0	292.382	4.041	20	30		CIEDRO
CCC[C@H]([NH2+]C1CCC(C)(C#N)CC1)C1CCCC1	ZINC000459754244	329381796	/nfs/dbraw/zinc/38/17/96/329381796.db2.gz	CSFSWAREFNYBFV-CGZBRXJRSA-N	1	0	262.441	4.407	20	30		CIEDRO
Cc1cccc2c1OCC[C@@H]2[NH2+][C@H](C)c1ccc(C#N)s1	ZINC000189458750	329382606	/nfs/dbraw/zinc/38/26/06/329382606.db2.gz	AZEGLNWQCJCEHK-DOMZBBRYSA-N	1	0	298.411	4.103	20	30		CIEDRO
N#CCc1ccc(C[N@@H+]2CCCC[C@@H]2c2ccccc2)cc1	ZINC000583237091	329387179	/nfs/dbraw/zinc/38/71/79/329387179.db2.gz	XPZSAQIAQBSFLE-HXUWFJFHSA-N	1	0	290.410	4.480	20	30		CIEDRO
C[C@H](Cc1cccc(F)c1)[N@H+](C)CC(C)(C)CCC#N	ZINC000459768631	329387659	/nfs/dbraw/zinc/38/76/59/329387659.db2.gz	XSTNQVMERHWOCG-CQSZACIVSA-N	1	0	276.399	4.018	20	30		CIEDRO
C[C@@H]([NH2+]CCC(C)(C)C1CC1)c1cccc(C#N)c1	ZINC000392891938	329397597	/nfs/dbraw/zinc/39/75/97/329397597.db2.gz	URUUNICDKCMKBD-CYBMUJFWSA-N	1	0	256.393	4.035	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](C)c1c(F)cccc1OC	ZINC000398184487	329438815	/nfs/dbraw/zinc/43/88/15/329438815.db2.gz	PKSDRMVCVGLQRE-QWHCGFSZSA-N	1	0	265.372	4.230	20	30		CIEDRO
C=CCC[NH+]1CCC(c2nc3ccccc3s2)CC1	ZINC000132354965	329645708	/nfs/dbraw/zinc/64/57/08/329645708.db2.gz	QFADJJMKAFYXPX-UHFFFAOYSA-N	1	0	272.417	4.052	20	30		CIEDRO
CO[C@H](C[NH2+][C@@H](CCCC#N)c1ccccc1)CC(C)C	ZINC000419280432	329717157	/nfs/dbraw/zinc/71/71/57/329717157.db2.gz	JBMBDJYFUHVZOZ-ROUUACIJSA-N	1	0	288.435	4.072	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H](CC(F)F)c2ccccc2)s1	ZINC000421369063	329824141	/nfs/dbraw/zinc/82/41/41/329824141.db2.gz	GWMQTNKYFUHPJR-AWEZNQCLSA-N	1	0	292.354	4.106	20	30		CIEDRO
C[C@@H]1CCCC[C@@H]1[NH2+][C@H](CCC#N)c1ccccc1	ZINC000246306889	329825908	/nfs/dbraw/zinc/82/59/08/329825908.db2.gz	DMBXGNYQGBLAPT-HYVNUMGLSA-N	1	0	256.393	4.200	20	30		CIEDRO
C[C@@H]1CCC[C@@H]([NH2+][C@H](CCC#N)c2ccccc2)C1	ZINC000246356162	329839317	/nfs/dbraw/zinc/83/93/17/329839317.db2.gz	IBJKGIWEPDFMQE-DJIMGWMZSA-N	1	0	256.393	4.200	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)c1ccc(C)cc1	ZINC000248733719	329898147	/nfs/dbraw/zinc/89/81/47/329898147.db2.gz	DKQZHGRZHJAYRQ-PVAVHDDUSA-N	1	0	256.393	4.118	20	30		CIEDRO
CC(C)=CCC[C@H](C)[NH2+][C@@H](C)c1ccc(C#N)cc1F	ZINC000571750358	329919823	/nfs/dbraw/zinc/91/98/23/329919823.db2.gz	OYPKDIXGZMYPLL-KBPBESRZSA-N	1	0	274.383	4.483	20	30		CIEDRO
CC[C@H]([NH2+]Cc1cccc(C#N)c1)c1cc(F)ccc1F	ZINC000077454279	329927296	/nfs/dbraw/zinc/92/72/96/329927296.db2.gz	KYZKIVFDAVXJEQ-KRWDZBQOSA-N	1	0	286.325	4.077	20	30		CIEDRO
Cc1nsc(C)c1C[N@H+](Cc1ccc(C#N)cc1)C(C)C	ZINC000565162607	330039151	/nfs/dbraw/zinc/03/91/51/330039151.db2.gz	JRFNAYQOCCRINZ-UHFFFAOYSA-N	1	0	299.443	4.042	20	30		CIEDRO
C#CC[C@H]([NH2+]Cc1cnc(CC(C)C)s1)c1ccccc1	ZINC000270237962	330073975	/nfs/dbraw/zinc/07/39/75/330073975.db2.gz	RQJYPWFNRNAHBA-KRWDZBQOSA-N	1	0	298.455	4.196	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@H]1CCc2c1cccc2OC)c1ccccc1	ZINC000271591911	330080944	/nfs/dbraw/zinc/08/09/44/330080944.db2.gz	YMCYHLFODRCKTP-MOPGFXCFSA-N	1	0	291.394	4.037	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@@H]1CCc2c1cccc2OC)c1ccccc1	ZINC000271591922	330081215	/nfs/dbraw/zinc/08/12/15/330081215.db2.gz	YMCYHLFODRCKTP-RTBURBONSA-N	1	0	291.394	4.037	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@@H](C)c1ccsc1)c1ccccc1	ZINC000271599102	330081496	/nfs/dbraw/zinc/08/14/96/330081496.db2.gz	ZIEJBJVWZCRQNN-XJKSGUPXSA-N	1	0	255.386	4.163	20	30		CIEDRO
COc1cc(Cl)ccc1[C@@H](C)[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000421857723	330089648	/nfs/dbraw/zinc/08/96/48/330089648.db2.gz	PPNOBPDJSNOMMT-DYEKYZERSA-N	1	0	292.810	4.082	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@@H]1CCO[C@H](c2ccc(F)cc2)C1	ZINC000273468831	330093199	/nfs/dbraw/zinc/09/31/99/330093199.db2.gz	RPZFEIGYXBAGQC-ZZCKCESHSA-N	1	0	291.410	4.236	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(C#N)s1)c1cccc(C)c1	ZINC000421885216	330103063	/nfs/dbraw/zinc/10/30/63/330103063.db2.gz	QYXIVYKYMQCGIS-INIZCTEOSA-N	1	0	270.401	4.169	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@H]1CCO[C@H](c2ccc(F)cc2)C1	ZINC000273491512	330103867	/nfs/dbraw/zinc/10/38/67/330103867.db2.gz	WVTTYUQLMOTAQF-BZSNNMDCSA-N	1	0	291.410	4.380	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@H](C)c1sccc1OC)c1ccccc1	ZINC000274568923	330106642	/nfs/dbraw/zinc/10/66/42/330106642.db2.gz	IKWNLXZTWWVIDX-UKRRQHHQSA-N	1	0	285.412	4.172	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+]Cc1cc(COC(C)(C)C)on1	ZINC000274959764	330108387	/nfs/dbraw/zinc/10/83/87/330108387.db2.gz	GJAJDNKZKGQDTN-CQSZACIVSA-N	1	0	294.439	4.214	20	30		CIEDRO
C=CCC[C@@H]([NH2+][C@@H](CCCO)c1ccccc1)c1ccco1	ZINC000276443870	330113808	/nfs/dbraw/zinc/11/38/08/330113808.db2.gz	KSMAUJPXXMNHOA-ZWKOTPCHSA-N	1	0	299.414	4.390	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@H](C)c1cnn(C(C)C)c1C)c1ccccc1	ZINC000276556284	330114062	/nfs/dbraw/zinc/11/40/62/330114062.db2.gz	RDGCEBOAKZUOJE-DNVCBOLYSA-N	1	0	295.430	4.188	20	30		CIEDRO
CCc1ccc([C@H]2CC[N@H+](CCCC(C)(C)C#N)C2)cc1	ZINC000433050163	330140315	/nfs/dbraw/zinc/14/03/15/330140315.db2.gz	ACYPEBGVNIETFC-SFHVURJKSA-N	1	0	284.447	4.368	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CCC[C@@H](c2ccccc2)C1	ZINC000433059121	330141715	/nfs/dbraw/zinc/14/17/15/330141715.db2.gz	MGALHUGVZWLBJZ-QGZVFWFLSA-N	1	0	270.420	4.196	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCCC(C)(C)C1)c1ccc(C#N)cc1F	ZINC000527196564	330234527	/nfs/dbraw/zinc/23/45/27/330234527.db2.gz	ITKHRHGBADWXNM-JSGCOSHPSA-N	1	0	274.383	4.317	20	30		CIEDRO
C=C(C)C[N@H+](Cc1ccccc1)Cc1ccc2[nH]cnc2c1	ZINC000527239379	330240838	/nfs/dbraw/zinc/24/08/38/330240838.db2.gz	WRVIMTMNCQXWPX-UHFFFAOYSA-N	1	0	291.398	4.141	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@@H](C)c1ccc2ccccc2c1	ZINC000424120644	330249379	/nfs/dbraw/zinc/24/93/79/330249379.db2.gz	FFUUUTBUDRYNBK-JVPBZIDWSA-N	1	0	281.399	4.082	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@H](C)c1ccc2ccccc2c1	ZINC000424120642	330249382	/nfs/dbraw/zinc/24/93/82/330249382.db2.gz	FFUUUTBUDRYNBK-CCKFTAQKSA-N	1	0	281.399	4.082	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](C)c1oc2ccc(OC)cc2c1C	ZINC000536857372	330252257	/nfs/dbraw/zinc/25/22/57/330252257.db2.gz	KNKREGJSYXKTST-DGCLKSJQSA-N	1	0	273.376	4.365	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1cc(Cl)ccc1Cl	ZINC000424121565	330252347	/nfs/dbraw/zinc/25/23/47/330252347.db2.gz	IJUWYGBFBJITCX-JFGNBEQYSA-N	1	0	283.202	4.336	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](C)c1ccc(OCCCC)c(OC)c1	ZINC000536858883	330252520	/nfs/dbraw/zinc/25/25/20/330252520.db2.gz	RTHJADCQGBNBAH-HUUCEWRRSA-N	1	0	291.435	4.489	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc(Cl)c(Cl)c1	ZINC000424122284	330254144	/nfs/dbraw/zinc/25/41/44/330254144.db2.gz	JBJAZXLXNMSAPO-JBLDHEPKSA-N	1	0	283.202	4.336	20	30		CIEDRO
C[C@@H]1C[C@@H](c2ccccc2)[N@H+](CC(C)(C)CCC#N)C1	ZINC000580483920	330256638	/nfs/dbraw/zinc/25/66/38/330256638.db2.gz	WJIOLSDVDZEBDH-WBVHZDCISA-N	1	0	270.420	4.399	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc(Cl)cc1Cl	ZINC000424128492	330259755	/nfs/dbraw/zinc/25/97/55/330259755.db2.gz	RGSRQZPINOHQSR-JFGNBEQYSA-N	1	0	283.202	4.336	20	30		CIEDRO
C=CC(C)(C)CC[NH2+][C@H]1CCC[C@@H](c2cccnc2)C1	ZINC000527736631	330278865	/nfs/dbraw/zinc/27/88/65/330278865.db2.gz	NWJRRIIHTIYUQZ-WBVHZDCISA-N	1	0	272.436	4.300	20	30		CIEDRO
N#CCCCOc1cccc(C[NH2+]CC[C@@H]2CC=CCC2)c1	ZINC000527787971	330283374	/nfs/dbraw/zinc/28/33/74/330283374.db2.gz	JRFSQHNOZNLGTK-QGZVFWFLSA-N	1	0	298.430	4.205	20	30		CIEDRO
Cc1cccc([C@H]([NH2+]Cc2ccccc2C#N)C(C)C)c1	ZINC000527814143	330284996	/nfs/dbraw/zinc/28/49/96/330284996.db2.gz	PFQYVOHSGZIACT-LJQANCHMSA-N	1	0	278.399	4.354	20	30		CIEDRO
CC[C@@H](CCc1ccccc1)[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000527905572	330289973	/nfs/dbraw/zinc/28/99/73/330289973.db2.gz	VAKVSSMGTYYGSW-BZSNNMDCSA-N	1	0	270.420	4.070	20	30		CIEDRO
CC(C)c1cccc([C@@H](C)[NH2+][C@@H]2CC[C@H](C#N)C2)c1	ZINC000527910323	330290640	/nfs/dbraw/zinc/29/06/40/330290640.db2.gz	NSPDCRCCTXNGBX-JKIFEVAISA-N	1	0	256.393	4.153	20	30		CIEDRO
CC[C@H](C)[C@H](C)[NH2+]CC#Cc1ccc(C(F)(F)F)cc1	ZINC000536875910	330309820	/nfs/dbraw/zinc/30/98/20/330309820.db2.gz	JZSFRJFNMCFMHF-STQMWFEESA-N	1	0	283.337	4.081	20	30		CIEDRO
C[C@H](Cc1ccc(Cl)cc1)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000036937845	330315126	/nfs/dbraw/zinc/31/51/26/330315126.db2.gz	OYPYQDHHNBXHPC-KGLIPLIRSA-N	1	0	298.817	4.493	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+]Cc2ccc(-c3ccccc3)cc2)C1	ZINC000424191808	330323891	/nfs/dbraw/zinc/32/38/91/330323891.db2.gz	IFADRYLAUOJBBS-APWZRJJASA-N	1	0	276.383	4.135	20	30		CIEDRO
C[C@H](CC1CCCC1)[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000533090926	330333987	/nfs/dbraw/zinc/33/39/87/330333987.db2.gz	KAPPOKDIWOBDLK-ZIAGYGMSSA-N	1	0	256.393	4.178	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@H](C)c1ccc(SCC)cc1	ZINC000424294730	330335738	/nfs/dbraw/zinc/33/57/38/330335738.db2.gz	LJIYSYWSVIYRQD-KMFMINBZSA-N	1	0	291.460	4.040	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@@H](CC(C)C)c1cccs1	ZINC000424296271	330335977	/nfs/dbraw/zinc/33/59/77/330335977.db2.gz	OBTTWJRMWTZGQS-KKUMJFAQSA-N	1	0	279.449	4.016	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@@H](C)c1ccccc1SCC	ZINC000424297925	330336435	/nfs/dbraw/zinc/33/64/35/330336435.db2.gz	RKADJHDCQVJJEF-DZKIICNBSA-N	1	0	291.460	4.040	20	30		CIEDRO
CC[C@H](CSc1ccccc1)[NH2+]Cc1cccc(C#N)c1	ZINC000533104379	330337273	/nfs/dbraw/zinc/33/72/73/330337273.db2.gz	PAZZQSGZDREHST-QGZVFWFLSA-N	1	0	296.439	4.219	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H]1C[C@@H]2C[C@H](OC)C[C@@H]2C1)c1ccccc1	ZINC000424303995	330338160	/nfs/dbraw/zinc/33/81/60/330338160.db2.gz	QEHCTDFZOIBHHX-YHDCXSKOSA-N	1	0	299.458	4.487	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@H](c2ccccc2)c2ccc(F)cc2)C1	ZINC000424316180	330339464	/nfs/dbraw/zinc/33/94/64/330339464.db2.gz	ASHYMLAAUXIPFL-GDIGMMSISA-N	1	0	294.373	4.197	20	30		CIEDRO
CCCCOc1ccc([C@@H](C)[NH2+][C@@H]2CC[C@H](C#N)C2)cc1	ZINC000424317327	330339639	/nfs/dbraw/zinc/33/96/39/330339639.db2.gz	BWRMQBXOQBBUQF-HLLBOEOZSA-N	1	0	286.419	4.208	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc(-c2ccncc2)cc1	ZINC000424317771	330339763	/nfs/dbraw/zinc/33/97/63/330339763.db2.gz	CFYSHRCNTHBRNV-ZRGWGRIASA-N	1	0	291.398	4.091	20	30		CIEDRO
CCC[C@@H](CCc1ccccc1)[NH2+][C@@H]1CC[C@H](C#N)C1	ZINC000424319070	330339873	/nfs/dbraw/zinc/33/98/73/330339873.db2.gz	DLHDLFTVHBYBFP-OKZBNKHCSA-N	1	0	270.420	4.070	20	30		CIEDRO
CCSc1ccccc1[C@@H](C)[NH2+][C@@H]1CC[C@H](C#N)C1	ZINC000424320732	330340142	/nfs/dbraw/zinc/34/01/42/330340142.db2.gz	GGRMQZSHSUPAEN-HZSPNIEDSA-N	1	0	274.433	4.141	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@@H]2CCC[C@@H]2c2ccc(Cl)cc2)C1	ZINC000424321197	330340160	/nfs/dbraw/zinc/34/01/60/330340160.db2.gz	HBFBVZVVPAIFJI-WBQNTZJQSA-N	1	0	288.822	4.258	20	30		CIEDRO
COc1ccc2oc([C@@H](C)[NH2+][C@@H]3CC[C@H](C#N)C3)c(C)c2c1	ZINC000424322586	330340452	/nfs/dbraw/zinc/34/04/52/330340452.db2.gz	IHLFRACDXXCYNJ-HZSPNIEDSA-N	1	0	298.386	4.093	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1cc2ccccc2s1	ZINC000424322236	330340512	/nfs/dbraw/zinc/34/05/12/330340512.db2.gz	IFFJVVQONFQCQX-SGMGOOAPSA-N	1	0	270.401	4.244	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)[C@@H](C)c1ccc(Cl)cc1	ZINC000424324398	330340981	/nfs/dbraw/zinc/34/09/81/330340981.db2.gz	JVIGKCLGYUBGQY-LMOYCYGVSA-N	1	0	276.811	4.114	20	30		CIEDRO
C[C@@H](Cc1c(Cl)cccc1Cl)[NH2+][C@@H]1CC[C@H](C#N)C1	ZINC000424327625	330341729	/nfs/dbraw/zinc/34/17/29/330341729.db2.gz	NCAJICUCRGJCMP-SDDRHHMPSA-N	1	0	297.229	4.206	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+]C2c3ccccc3-c3ccccc32)C1	ZINC000424329207	330341942	/nfs/dbraw/zinc/34/19/42/330341942.db2.gz	PLBIERUDAYMJSE-KGLIPLIRSA-N	1	0	274.367	4.038	20	30		CIEDRO
CC(C)c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)CCCO2	ZINC000424330133	330342119	/nfs/dbraw/zinc/34/21/19/330342119.db2.gz	QHZDZYSJLSJKRC-YXJHDRRASA-N	1	0	298.430	4.306	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@@H]2CCc2ccccc2)C1	ZINC000424330753	330342138	/nfs/dbraw/zinc/34/21/38/330342138.db2.gz	RAQHEVYYAIYJPK-AKHDSKFASA-N	1	0	282.431	4.070	20	30		CIEDRO
COc1ccccc1[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)C1CCCC1	ZINC000424332323	330342685	/nfs/dbraw/zinc/34/26/85/330342685.db2.gz	SUEQRESXOFLDLC-GMBSWORKSA-N	1	0	298.430	4.208	20	30		CIEDRO
COc1ccccc1[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)C1CCCC1	ZINC000424332325	330342687	/nfs/dbraw/zinc/34/26/87/330342687.db2.gz	SUEQRESXOFLDLC-ZSZQSSIHSA-N	1	0	298.430	4.208	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]2c2ccccc2)c(F)c1	ZINC000533309309	330356923	/nfs/dbraw/zinc/35/69/23/330356923.db2.gz	GINSIIXQJKJQQI-IEBWSBKVSA-N	1	0	294.373	4.123	20	30		CIEDRO
N#CCCC[N@@H+](Cc1cc(F)ccc1F)C1CCCC1	ZINC000083446776	330357903	/nfs/dbraw/zinc/35/79/03/330357903.db2.gz	XTUQAJKEWYKIIE-UHFFFAOYSA-N	1	0	278.346	4.013	20	30		CIEDRO
C[C@H]([NH2+]C/C=C\c1ccc(F)cc1)c1ccc(C#N)cc1	ZINC000533360800	330359790	/nfs/dbraw/zinc/35/97/90/330359790.db2.gz	RTHJGUCZXOWIAV-SFAKSCPVSA-N	1	0	280.346	4.061	20	30		CIEDRO
CC[C@@H](C)[NH2+]Cc1ccc(-c2ccccc2C#N)cc1	ZINC000537012468	330378909	/nfs/dbraw/zinc/37/89/09/330378909.db2.gz	SFZIBKRAFOQAIZ-CQSZACIVSA-N	1	0	264.372	4.113	20	30		CIEDRO
C=CCCC[C@@H](C)[NH+]1CCC(OCCC(C)C)CC1	ZINC000537039545	330393574	/nfs/dbraw/zinc/39/35/74/330393574.db2.gz	YXVBGYWFTMKGMR-MRXNPFEDSA-N	1	0	267.457	4.258	20	30		CIEDRO
C=CCCC[C@H](C)[N@@H+]1CC[C@H](COCc2ccccc2)C1	ZINC000537047464	330394394	/nfs/dbraw/zinc/39/43/94/330394394.db2.gz	NPNLCIZGDIYDFN-HKUYNNGSSA-N	1	0	287.447	4.270	20	30		CIEDRO
C[C@H]1C[C@@H](c2ccccc2)C[N@@H+]1Cc1cccc(C#N)c1F	ZINC000537048287	330394556	/nfs/dbraw/zinc/39/45/56/330394556.db2.gz	YEXJQZBVYNRSHQ-KBXCAEBGSA-N	1	0	294.373	4.075	20	30		CIEDRO
C[C@H]([NH2+][C@@H](CCC#N)c1ccccc1)c1ccccc1	ZINC000090665181	330394639	/nfs/dbraw/zinc/39/46/39/330394639.db2.gz	KUQRXSULWZNTBY-YJBOKZPZSA-N	1	0	264.372	4.382	20	30		CIEDRO
N#CCC[C@H]([NH2+][C@H]1CCc2ccccc2C1)c1ccccc1	ZINC000090665356	330394669	/nfs/dbraw/zinc/39/46/69/330394669.db2.gz	TZRRIFBUGOGODD-PMACEKPBSA-N	1	0	290.410	4.179	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccccc1C#N)C(C)(C)c1ccccc1	ZINC000537054601	330395182	/nfs/dbraw/zinc/39/51/82/330395182.db2.gz	OPGRHKPDXFQCQE-HNNXBMFYSA-N	1	0	278.399	4.014	20	30		CIEDRO
C=CCCC[N@@H+](C)[C@@H](C)C(=O)Nc1ccccc1C(C)C	ZINC000121142337	330395471	/nfs/dbraw/zinc/39/54/71/330395471.db2.gz	AMEGTLJLNCAFAG-HNNXBMFYSA-N	1	0	288.435	4.035	20	30		CIEDRO
C=CC[C@@H](CO)C[NH2+][C@H](C)c1ccc(-c2ccccc2)cc1	ZINC000537092730	330398466	/nfs/dbraw/zinc/39/84/66/330398466.db2.gz	GQCHRPANVQDFDT-IAGOWNOFSA-N	1	0	295.426	4.189	20	30		CIEDRO
C=CC[C@@H](CO)C[NH2+][C@H](C)c1cccc(-c2ccccc2)c1	ZINC000537094392	330398556	/nfs/dbraw/zinc/39/85/56/330398556.db2.gz	CDAHWYUVRWJZCG-IAGOWNOFSA-N	1	0	295.426	4.189	20	30		CIEDRO
Cc1oc2ccccc2c1C[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000121259450	330398714	/nfs/dbraw/zinc/39/87/14/330398714.db2.gz	XKQWKGFAKNFCLQ-CYBMUJFWSA-N	1	0	290.366	4.464	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(CC#N)cc1)C(C)(C)c1ccccc1	ZINC000541328491	330404351	/nfs/dbraw/zinc/40/43/51/330404351.db2.gz	PVAOJMMIMRWGEF-MRXNPFEDSA-N	1	0	292.426	4.209	20	30		CIEDRO
C=C(C)C[NH2+]Cc1ccc(-c2nc3ccccc3s2)o1	ZINC000122565215	330425337	/nfs/dbraw/zinc/42/53/37/330425337.db2.gz	BLSXLSGKJGQAEA-UHFFFAOYSA-N	1	0	284.384	4.222	20	30		CIEDRO
Cc1cc(C)cc(CC[NH2+][C@H](C)c2ccc(C#N)cc2)c1	ZINC000537292906	330431273	/nfs/dbraw/zinc/43/12/73/330431273.db2.gz	CZGSDKMQMQGIGF-MRXNPFEDSA-N	1	0	278.399	4.068	20	30		CIEDRO
CC[C@H]([NH2+][C@@H](C)c1ccc(C#N)c(F)c1)C(C)(C)C	ZINC000537407980	330435021	/nfs/dbraw/zinc/43/50/21/330435021.db2.gz	OOOZQMKNDXAGQA-NHYWBVRUSA-N	1	0	262.372	4.173	20	30		CIEDRO
CC(C)(C)[C@@H]([NH2+]CCC(C)(C)C#N)c1cccc(F)c1	ZINC000537412681	330435174	/nfs/dbraw/zinc/43/51/74/330435174.db2.gz	ZFMKFBJNAVILOF-HNNXBMFYSA-N	1	0	276.399	4.442	20	30		CIEDRO
C=C[C@H](C)[NH2+][C@@H]1C[C@@H](C)c2c1cccc2Br	ZINC000122981734	330437778	/nfs/dbraw/zinc/43/77/78/330437778.db2.gz	KXOBNGVFJRWCPM-GBIKHYSHSA-N	1	0	280.209	4.162	20	30		CIEDRO
C=C[C@H](C)[NH2+]Cc1ccc(-c2nc3ccccc3s2)o1	ZINC000123200284	330455314	/nfs/dbraw/zinc/45/53/14/330455314.db2.gz	COCVHISQIGSWAC-NSHDSACASA-N	1	0	284.384	4.220	20	30		CIEDRO
Cc1cccc([C@@H]([NH2+]C[C@@H](C#N)CCC#N)C(C)(C)C)c1	ZINC000515414345	330476737	/nfs/dbraw/zinc/47/67/37/330476737.db2.gz	IEFNOZGKHUHPST-NVXWUHKLSA-N	1	0	283.419	4.115	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]C/C(C)=C\c1ccccc1COC	ZINC000515519462	330477992	/nfs/dbraw/zinc/47/79/92/330477992.db2.gz	JVRBXFIQUOSGBD-VBKFSLOCSA-N	1	0	287.447	4.428	20	30		CIEDRO
CCSc1ccc([C@H](C)[NH2+][C@H](C)CCC#N)cc1	ZINC000428224810	330516561	/nfs/dbraw/zinc/51/65/61/330516561.db2.gz	AUDFMGBWNDJDMI-OLZOCXBDSA-N	1	0	262.422	4.141	20	30		CIEDRO
CCSc1ccc([C@@H](C)[NH2+][C@@H](C)CCC#N)cc1	ZINC000428224811	330516646	/nfs/dbraw/zinc/51/66/46/330516646.db2.gz	AUDFMGBWNDJDMI-QWHCGFSZSA-N	1	0	262.422	4.141	20	30		CIEDRO
N#CCC1(C[NH2+][C@H]2CCc3c2ccc(Cl)c3Cl)CC1	ZINC000430731373	330571752	/nfs/dbraw/zinc/57/17/52/330571752.db2.gz	VVFFCDAWGIYTMR-ZDUSSCGKSA-N	1	0	295.213	4.264	20	30		CIEDRO
C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+]CC1(CC#N)CC1	ZINC000430738335	330571930	/nfs/dbraw/zinc/57/19/30/330571930.db2.gz	ASXDZAJIDDKICL-STQMWFEESA-N	1	0	276.811	4.115	20	30		CIEDRO
Cc1ccc([C@H]([NH2+]CC2(CC#N)CC2)C2CCC2)cc1	ZINC000430740418	330572212	/nfs/dbraw/zinc/57/22/12/330572212.db2.gz	KHZOQSBWIZYMQS-QGZVFWFLSA-N	1	0	268.404	4.120	20	30		CIEDRO
CCC[C@H]([NH2+]CC1(CC#N)CC1)c1ccc(Cl)cc1	ZINC000430742895	330572423	/nfs/dbraw/zinc/57/24/23/330572423.db2.gz	PWKPLWZCEMWQCG-HNNXBMFYSA-N	1	0	276.811	4.465	20	30		CIEDRO
CC(C)C[C@H](C[NH2+]CC1(CC#N)CC1)c1ccccc1	ZINC000430770918	330573760	/nfs/dbraw/zinc/57/37/60/330573760.db2.gz	AJTVTUZSDKWWNG-QGZVFWFLSA-N	1	0	270.420	4.100	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@@H]1CC[C@H](C(C)C)[C@H](C)C1	ZINC000435726039	330660919	/nfs/dbraw/zinc/66/09/19/330660919.db2.gz	LBSQVHKCNDQAJJ-ZKXLYKBJSA-N	1	0	279.468	4.018	20	30		CIEDRO
C=CC[C@@H](C)[C@H](C)[NH2+][C@H]1C[C@H](c2cccc(F)c2)C1	ZINC000436279096	330673062	/nfs/dbraw/zinc/67/30/62/330673062.db2.gz	AGQGMBHFJQODTA-IARIHHJXSA-N	1	0	261.384	4.262	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+][C@H](C)c1ccc2c(c1)CCCC2	ZINC000436302742	330674731	/nfs/dbraw/zinc/67/47/31/330674731.db2.gz	VHZOQJDWSBAPDG-XPGWFJOJSA-N	1	0	299.458	4.197	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+][C@@H](C)c1ccc(CCC)cc1	ZINC000436306182	330674977	/nfs/dbraw/zinc/67/49/77/330674977.db2.gz	JVTNDDCHDSLPKX-SNRMKQJTSA-N	1	0	287.447	4.271	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@H](C)c1ccc(F)cc1Cl	ZINC000436306621	330675043	/nfs/dbraw/zinc/67/50/43/330675043.db2.gz	LEPLREIQBHCBEO-HSMVNMDESA-N	1	0	297.801	4.111	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+][C@H]1C[C@H](c2cc(F)cc(F)c2)C1	ZINC000436309264	330675222	/nfs/dbraw/zinc/67/52/22/330675222.db2.gz	OCQIESJNJLESFX-AXAPSJFSSA-N	1	0	265.347	4.155	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@H](c1ccc(C)o1)C1CCC1	ZINC000436312127	330675507	/nfs/dbraw/zinc/67/55/07/330675507.db2.gz	JSTJXQYRFUTBEB-NJAFHUGGSA-N	1	0	289.419	4.000	20	30		CIEDRO
C=CCC[C@H]([NH2+]CC1(c2ccccc2OC)CC1)C1CC1	ZINC000438986920	330731886	/nfs/dbraw/zinc/73/18/86/330731886.db2.gz	RTLJJWRBIOMWED-KRWDZBQOSA-N	1	0	285.431	4.061	20	30		CIEDRO
CCc1cccc(Cl)c1C[NH2+]CC1CCC(C#N)CC1	ZINC000441369219	330766835	/nfs/dbraw/zinc/76/68/35/330766835.db2.gz	MLJHBLUPWVOZCD-UHFFFAOYSA-N	1	0	290.838	4.322	20	30		CIEDRO
CC[C@H]1CCC[C@@H](C[NH2+]CC2CCC(C#N)CC2)C1	ZINC000441379456	330767090	/nfs/dbraw/zinc/76/70/90/330767090.db2.gz	NZUZPHCKXBIRAA-ZGRYLRDCSA-N	1	0	262.441	4.122	20	30		CIEDRO
Cc1cc(Cl)ccc1C[NH2+]CC1CCC(C#N)CC1	ZINC000441386809	330767447	/nfs/dbraw/zinc/76/74/47/330767447.db2.gz	XARKZGLGMFXELT-UHFFFAOYSA-N	1	0	276.811	4.068	20	30		CIEDRO
C[C@@H]([NH2+]CC1CCC(C#N)CC1)c1ccc(Cl)s1	ZINC000442141772	330774427	/nfs/dbraw/zinc/77/44/27/330774427.db2.gz	UYRGZVIQJPWDDL-VOMCLLRMSA-N	1	0	282.840	4.382	20	30		CIEDRO
CC(C)(C)[C@H]([NH2+][C@@H]1CC[C@@H](C#N)C1)c1ccccc1	ZINC000442709482	330780125	/nfs/dbraw/zinc/78/01/25/330780125.db2.gz	OGTCLRYVSRQUCX-FVQBIDKESA-N	1	0	256.393	4.056	20	30		CIEDRO
CCC[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc(F)cc1F	ZINC000442786819	330783250	/nfs/dbraw/zinc/78/32/50/330783250.db2.gz	XPIZBIYTUICQCG-GHJWDPDVSA-N	1	0	278.346	4.088	20	30		CIEDRO
Cc1c(C)c(C)c(C[NH2+][C@H]2CC[C@H](C#N)C2)c(C)c1C	ZINC000442833553	330786047	/nfs/dbraw/zinc/78/60/47/330786047.db2.gz	VAWHSLWLFBCFTA-IRXDYDNUSA-N	1	0	270.420	4.011	20	30		CIEDRO
CC([NH2+][C@@H]1CC[C@H](C#N)C1)(c1ccccc1)c1ccccc1	ZINC000442853587	330787119	/nfs/dbraw/zinc/78/71/19/330787119.db2.gz	UUDLRUSVDJRXPQ-QFBILLFUSA-N	1	0	290.410	4.232	20	30		CIEDRO
CC[C@H](Cc1ccc(C)cc1)[NH2+]CC1CCC(C#N)CC1	ZINC000442854709	330787201	/nfs/dbraw/zinc/78/72/01/330787201.db2.gz	LGJZKGFBPKXABH-CTWPCTMYSA-N	1	0	284.447	4.236	20	30		CIEDRO
CCOc1ccccc1[C@@H](C)[NH2+]CC1CCC(C#N)CC1	ZINC000442872219	330789263	/nfs/dbraw/zinc/78/92/63/330789263.db2.gz	HVMSJXAMHUZNAZ-QQFBHYJXSA-N	1	0	286.419	4.066	20	30		CIEDRO
Cc1cccc([C@H](C)[NH2+]CC2CCC(C#N)CC2)c1C	ZINC000442879163	330790075	/nfs/dbraw/zinc/79/00/75/330790075.db2.gz	WBQBPGRJFPDLPL-GTPINHCMSA-N	1	0	270.420	4.284	20	30		CIEDRO
Cc1cc(C[NH2+][C@@H]2CC(C)(C)c3ccccc32)ccc1C#N	ZINC000443981421	330808292	/nfs/dbraw/zinc/80/82/92/330808292.db2.gz	APEBMQCLKFZVBO-LJQANCHMSA-N	1	0	290.410	4.379	20	30		CIEDRO
Cc1oc2ccccc2c1C[NH2+]Cc1ccc(C#N)c(C)c1	ZINC000443981352	330808350	/nfs/dbraw/zinc/80/83/50/330808350.db2.gz	ALGZSMDALMPNNZ-UHFFFAOYSA-N	1	0	290.366	4.211	20	30		CIEDRO
Cc1cc(C[NH2+][C@H]2c3ccccc3CC[C@@H]2C)ccc1C#N	ZINC000444000358	330808951	/nfs/dbraw/zinc/80/89/51/330808951.db2.gz	WBLWZRAXLOUUHS-VBKZILBWSA-N	1	0	290.410	4.280	20	30		CIEDRO
CC[C@@H]([NH2+]CCCCC(C)(C)C#N)c1c(C)noc1C	ZINC000444681836	330818783	/nfs/dbraw/zinc/81/87/83/330818783.db2.gz	XEBGFBCYFDXEIB-CQSZACIVSA-N	1	0	277.412	4.052	20	30		CIEDRO
CC(C)[C@H](C[NH2+][C@@H]1CCC[C@H](C#N)C1)Cc1ccccc1	ZINC000446795968	330854346	/nfs/dbraw/zinc/85/43/46/330854346.db2.gz	PPNVFDJXMOKSTG-GBESFXJTSA-N	1	0	284.447	4.173	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CCc2ccccc2C1)c1ccc(C#N)cc1	ZINC000447505539	330867168	/nfs/dbraw/zinc/86/71/68/330867168.db2.gz	ABRBCBRGFLBIMN-UXHICEINSA-N	1	0	290.410	4.156	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccccc1Cl)c1ccc(C#N)cc1	ZINC000447510321	330867294	/nfs/dbraw/zinc/86/72/94/330867294.db2.gz	OWZPHEDPIMSTOE-KRWDZBQOSA-N	1	0	284.790	4.453	20	30		CIEDRO
CC[C@@H]([NH2+]C1CCCCCC1)c1ccc(C#N)cc1	ZINC000447517957	330867578	/nfs/dbraw/zinc/86/75/78/330867578.db2.gz	MHMVPEWDCRRISP-QGZVFWFLSA-N	1	0	256.393	4.322	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CCCC[C@H]1C)c1ccc(C#N)cc1	ZINC000447522169	330867712	/nfs/dbraw/zinc/86/77/12/330867712.db2.gz	YARXVMICZSSUDC-COXVUDFISA-N	1	0	256.393	4.178	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CCC[C@@H](SC)C1)c1ccc(C#N)cc1	ZINC000447538156	330868726	/nfs/dbraw/zinc/86/87/26/330868726.db2.gz	APTJTCPJJCBCOD-ZACQAIPSSA-N	1	0	288.460	4.273	20	30		CIEDRO
C=C(C[NH2+][C@H](CC)c1ccc(C#N)cc1)c1ccccc1	ZINC000447543444	330869312	/nfs/dbraw/zinc/86/93/12/330869312.db2.gz	LRMSUQCOIGBXEZ-LJQANCHMSA-N	1	0	276.383	4.312	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CCC[C@@H](C)C1)c1ccc(C#N)cc1	ZINC000447545396	330869389	/nfs/dbraw/zinc/86/93/89/330869389.db2.gz	XXVHXFAAUDYBFI-XYPHTWIQSA-N	1	0	256.393	4.178	20	30		CIEDRO
CCc1ccc(C[NH2+][C@@H](CC)c2ccc(C#N)cc2)s1	ZINC000447545002	330869408	/nfs/dbraw/zinc/86/94/08/330869408.db2.gz	QCDTVIAAIIRARH-KRWDZBQOSA-N	1	0	284.428	4.423	20	30		CIEDRO
Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH2+][C@H]1CCC[C@H](C#N)C1	ZINC000447545589	330869437	/nfs/dbraw/zinc/86/94/37/330869437.db2.gz	ROMQPTJLFJZFPO-DZKIICNBSA-N	1	0	286.419	4.274	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+]Cc2csc3ccccc23)C1	ZINC000447547318	330869520	/nfs/dbraw/zinc/86/95/20/330869520.db2.gz	BMJWDLWPUSLPDM-JSGCOSHPSA-N	1	0	270.401	4.073	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+]Cc2ccc(-c3ccccc3)o2)C1	ZINC000447562552	330870005	/nfs/dbraw/zinc/87/00/05/330870005.db2.gz	MCCJEZZJALMBHZ-GOEBONIOSA-N	1	0	280.371	4.119	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](CC)c1ccc(C#N)cc1	ZINC000447580315	330870956	/nfs/dbraw/zinc/87/09/56/330870956.db2.gz	NTIUPVYCMUZHHZ-YOEHRIQHSA-N	1	0	256.393	4.344	20	30		CIEDRO
CC[C@H]([NH2+][C@@H](c1cccnc1)C1CC1)c1ccc(C#N)cc1	ZINC000447586483	330871769	/nfs/dbraw/zinc/87/17/69/330871769.db2.gz	MQKXWXBEFFVDBL-RBUKOAKNSA-N	1	0	291.398	4.145	20	30		CIEDRO
CC[C@H]([NH2+][C@H](C)CCC1CC1)c1ccc(C#N)cc1	ZINC000447592418	330872410	/nfs/dbraw/zinc/87/24/10/330872410.db2.gz	LKDBKBNBLAWAHD-DYVFJYSZSA-N	1	0	256.393	4.178	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@@H]2CC[C@@H]3CCCC[C@@H]3C2)CC1	ZINC000449067941	330896811	/nfs/dbraw/zinc/89/68/11/330896811.db2.gz	PGPBZJXGJXEMJE-DNFFFWCMSA-N	1	0	274.452	4.407	20	30		CIEDRO
Cc1ccc([C@@H](C)[NH2+]C2CCC(C)(C#N)CC2)cc1	ZINC000449090931	330898365	/nfs/dbraw/zinc/89/83/65/330898365.db2.gz	OQCOAJOTTJKCEX-ODIFPOPNSA-N	1	0	256.393	4.118	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@@H]2CC[C@H]3CCC[C@H]3C2)CC1	ZINC000449148264	330901733	/nfs/dbraw/zinc/90/17/33/330901733.db2.gz	JLHOUMDEDKTUGS-QSFKDOLUSA-N	1	0	260.425	4.017	20	30		CIEDRO
CC[C@@H]([NH2+]C1CCC(C)(C#N)CC1)c1ccc(F)cc1F	ZINC000449154972	330902055	/nfs/dbraw/zinc/90/20/55/330902055.db2.gz	AGVGTNFWYBEDJR-BLDCVEFLSA-N	1	0	292.373	4.478	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+][C@H](CC)c1nccs1	ZINC000449159985	330902526	/nfs/dbraw/zinc/90/25/26/330902526.db2.gz	KEDTXIPRPMJUQZ-CHWSQXEVSA-N	1	0	252.427	4.319	20	30		CIEDRO
C[C@@H]1CCc2ccccc2[C@H]1[NH2+]C1CCC(C)(C#N)CC1	ZINC000449208779	330906289	/nfs/dbraw/zinc/90/62/89/330906289.db2.gz	TXQHPBBMDHYYMW-SEBYTVMXSA-N	1	0	282.431	4.372	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@@H](c1cccnc1)C1CC1	ZINC000449208019	330906328	/nfs/dbraw/zinc/90/63/28/330906328.db2.gz	OWHLXJXKBCDXDH-WMLDXEAASA-N	1	0	258.409	4.257	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+]C[C@H](C)c1ncc(C)s1	ZINC000449237410	330908468	/nfs/dbraw/zinc/90/84/68/330908468.db2.gz	NYGGLGQAHLLMDC-STQMWFEESA-N	1	0	266.454	4.280	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+]C[C@@H](C)c1nc(C)cs1	ZINC000449238880	330908612	/nfs/dbraw/zinc/90/86/12/330908612.db2.gz	TYPSZPAVOVNDEP-CHWSQXEVSA-N	1	0	266.454	4.280	20	30		CIEDRO
CC1(C#N)CCC([NH2+]CC[C@@H]2CCc3ccccc32)CC1	ZINC000449373450	330920077	/nfs/dbraw/zinc/92/00/77/330920077.db2.gz	BXHJFEZEDYMNMV-MUYFXNHWSA-N	1	0	282.431	4.169	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCC[C@H]2c2ccccc2)C1	ZINC000449399444	330922242	/nfs/dbraw/zinc/92/22/42/330922242.db2.gz	ATFYQITWSVKRDG-BVBHFADKSA-N	1	0	282.431	4.242	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@H]2CCc2ccccc2)C1	ZINC000449444702	330925928	/nfs/dbraw/zinc/92/59/28/330925928.db2.gz	CPLBNWKWBVVLCB-LWYYNNOASA-N	1	0	296.458	4.460	20	30		CIEDRO
Cc1cc(Cl)cc(C)c1C[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000449445419	330926034	/nfs/dbraw/zinc/92/60/34/330926034.db2.gz	JHURSISQGPDLOV-ZFWWWQNUSA-N	1	0	276.811	4.129	20	30		CIEDRO
COc1cc(C[NH2+][C@H]2CC[C@@H](CC#N)C2)cc2ccccc21	ZINC000449445910	330926189	/nfs/dbraw/zinc/92/61/89/330926189.db2.gz	NAWDOWHAEWBVLO-YOEHRIQHSA-N	1	0	294.398	4.020	20	30		CIEDRO
CC(C)CC[C@H]1CCC[C@H]1[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000449446169	330926195	/nfs/dbraw/zinc/92/61/95/330926195.db2.gz	OGBMUMMVNHHSMX-VVLHAWIVSA-N	1	0	262.441	4.263	20	30		CIEDRO
C=CC(C)(C)C[NH2+]C1CCC(OC2CCCC2)CC1	ZINC000449485534	330930007	/nfs/dbraw/zinc/93/00/07/330930007.db2.gz	NOLACOBFFYGHIW-UHFFFAOYSA-N	1	0	265.441	4.059	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@H]1CCO[C@H](c2ccncc2)C1	ZINC000449542142	330934841	/nfs/dbraw/zinc/93/48/41/330934841.db2.gz	PQLDFQVBTZFKEI-BZSNNMDCSA-N	1	0	288.435	4.026	20	30		CIEDRO
C[C@H]([NH2+]CC1(C#N)CCC1)c1ccc2ccccc2c1	ZINC000450661786	330991929	/nfs/dbraw/zinc/99/19/29/330991929.db2.gz	OLGIQCFESPQJDO-AWEZNQCLSA-N	1	0	264.372	4.184	20	30		CIEDRO
N#CC1(C[NH+]2CCC(c3ccc(Cl)cc3)CC2)CCC1	ZINC000450755373	330998105	/nfs/dbraw/zinc/99/81/05/330998105.db2.gz	BDLNFRPFPYZMOF-UHFFFAOYSA-N	1	0	288.822	4.213	20	30		CIEDRO
CCO[C@H]1C[C@@H]([NH2+]CCCCC(C)(C)C#N)C12CCCC2	ZINC000450968153	331009178	/nfs/dbraw/zinc/00/91/78/331009178.db2.gz	JZYUIIINAYPZNG-CVEARBPZSA-N	1	0	292.467	4.034	20	30		CIEDRO
C=C(C)C[N@H+](CCC1=CCCCC1)Cc1ccc(CO)o1	ZINC000450983957	331010134	/nfs/dbraw/zinc/01/01/34/331010134.db2.gz	SPPDAKIBJGUAQJ-UHFFFAOYSA-N	1	0	289.419	4.041	20	30		CIEDRO
C=CCCC[C@H](C)[N@@H+]1CCC[C@H](c2ccncc2)C1	ZINC000451008198	331011560	/nfs/dbraw/zinc/01/15/60/331011560.db2.gz	WLXFZCFQGGGZFN-RDJZCZTQSA-N	1	0	258.409	4.006	20	30		CIEDRO
C=CCCC[C@H](C)[N@@H+]1CCC[C@@H](c2ccncc2)C1	ZINC000451008195	331011588	/nfs/dbraw/zinc/01/15/88/331011588.db2.gz	WLXFZCFQGGGZFN-DOTOQJQBSA-N	1	0	258.409	4.006	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(CC#N)cc1)c1cccc(C2CC2)c1	ZINC000451114642	331015997	/nfs/dbraw/zinc/01/59/97/331015997.db2.gz	LTRUFWXRBXATFW-OAHLLOKOSA-N	1	0	290.410	4.481	20	30		CIEDRO
Cc1ccccc1CC[N@H+](C)CCCCC(C)(C)C#N	ZINC000451166407	331018410	/nfs/dbraw/zinc/01/84/10/331018410.db2.gz	OEBNRAIEDQSFOG-UHFFFAOYSA-N	1	0	272.436	4.189	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)c1ccc(OC)c(Br)c1	ZINC000163315003	331020050	/nfs/dbraw/zinc/02/00/50/331020050.db2.gz	QGHDQIVAPNKATO-WDEREUQCSA-N	1	0	298.224	4.073	20	30		CIEDRO
CC(C)(C#N)c1ccccc1C[NH2+][C@@H]1CCC12CCCC2	ZINC000451464618	331030497	/nfs/dbraw/zinc/03/04/97/331030497.db2.gz	ZBIWNNIZBYRSFX-QGZVFWFLSA-N	1	0	282.431	4.300	20	30		CIEDRO
C[C@H]([NH2+]CCCC(C)(C)C#N)[C@H]1CCC[C@H](C)C1	ZINC000452068467	331052761	/nfs/dbraw/zinc/05/27/61/331052761.db2.gz	NCHAXEPXDVFKNQ-KKUMJFAQSA-N	1	0	250.430	4.121	20	30		CIEDRO
C[C@@H]1CC[C@H]([NH2+]Cc2cccc(C#N)c2)c2sccc21	ZINC000453101910	331089265	/nfs/dbraw/zinc/08/92/65/331089265.db2.gz	ZPJCVCHPRRONMJ-WBMJQRKESA-N	1	0	282.412	4.348	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@H](C)c1nccn1CC)c1ccccc1	ZINC000453178196	331097548	/nfs/dbraw/zinc/09/75/48/331097548.db2.gz	SDMUWZRNHABEOV-WBVHZDCISA-N	1	0	283.419	4.261	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H](C)c2csc(C)c2)cc1	ZINC000453216714	331102502	/nfs/dbraw/zinc/10/25/02/331102502.db2.gz	TVCRMDIBBKDECW-CQSZACIVSA-N	1	0	287.428	4.472	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCCc2c(F)cccc21)c1cccc(C#N)c1	ZINC000453225018	331103613	/nfs/dbraw/zinc/10/36/13/331103613.db2.gz	CUVFSJLZKHCAEK-BFUOFWGJSA-N	1	0	294.373	4.426	20	30		CIEDRO
CC[C@H]([NH2+]CC(C)(C)CCC#N)c1ccsc1	ZINC000453233730	331104852	/nfs/dbraw/zinc/10/48/52/331104852.db2.gz	RTMUKKZHNDFNPC-ZDUSSCGKSA-N	1	0	250.411	4.119	20	30		CIEDRO
CC[C@@H]([NH2+]CC(C)(C)CCC#N)c1ccsc1	ZINC000453233728	331104876	/nfs/dbraw/zinc/10/48/76/331104876.db2.gz	RTMUKKZHNDFNPC-CYBMUJFWSA-N	1	0	250.411	4.119	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1cccc(Cl)c1	ZINC000453291381	331111843	/nfs/dbraw/zinc/11/18/43/331111843.db2.gz	PTXLQQZLWKWYPU-XUJVJEKNSA-N	1	0	262.784	4.073	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccc2c(c1)CCCC2	ZINC000453293615	331112084	/nfs/dbraw/zinc/11/20/84/331112084.db2.gz	PIEVLGBMNDLHOR-VCBZYWHSSA-N	1	0	282.431	4.298	20	30		CIEDRO
CC(C)C[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccccc1	ZINC000453295976	331112452	/nfs/dbraw/zinc/11/24/52/331112452.db2.gz	SSLKYXMDOQGNHC-RYQLBKOJSA-N	1	0	270.420	4.446	20	30		CIEDRO
CC(C)[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1cc(F)ccc1F	ZINC000453296217	331112533	/nfs/dbraw/zinc/11/25/33/331112533.db2.gz	UNJMTKTUCZXZMC-RVSPLBMKSA-N	1	0	292.373	4.334	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@H](c1ccccc1)c1ccc(F)cn1	ZINC000453303819	331113605	/nfs/dbraw/zinc/11/36/05/331113605.db2.gz	DHEIWMAEACYODJ-QGZVFWFLSA-N	1	0	284.378	4.112	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@@H](CCCOC)c1ccc(F)cc1	ZINC000453305332	331113888	/nfs/dbraw/zinc/11/38/88/331113888.db2.gz	HKJSFBNOBWVBDR-INIZCTEOSA-N	1	0	279.399	4.095	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1cc(C)cs1)c1ccco1	ZINC000453307836	331114193	/nfs/dbraw/zinc/11/41/93/331114193.db2.gz	CGPDDLJMYRXEJL-CQSZACIVSA-N	1	0	261.390	4.447	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)c1ccc(SC)c(OC)c1	ZINC000453308555	331114420	/nfs/dbraw/zinc/11/44/20/331114420.db2.gz	CVSPJQMXLMMFJT-GFCCVEGCSA-N	1	0	265.422	4.034	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@H](c1ccc(F)cc1)c1cccnc1	ZINC000453312612	331114970	/nfs/dbraw/zinc/11/49/70/331114970.db2.gz	VLZSFNHVNSJDBR-QGZVFWFLSA-N	1	0	284.378	4.112	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1cc(C)cs1)c1ccc(C#N)cc1	ZINC000453323041	331116621	/nfs/dbraw/zinc/11/66/21/331116621.db2.gz	RODVEKBCHSGWEU-MRXNPFEDSA-N	1	0	270.401	4.169	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1ccc(F)cc1OC(F)F	ZINC000453327461	331117242	/nfs/dbraw/zinc/11/72/42/331117242.db2.gz	VWQDJIQWYAPPEI-JTQLQIEISA-N	1	0	273.298	4.044	20	30		CIEDRO
C=C[C@@H]1OCCC[C@H]1[NH2+][C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000453365198	331123067	/nfs/dbraw/zinc/12/30/67/331123067.db2.gz	SEWGZQGOGIZTSX-GLQYFDAESA-N	1	0	299.336	4.090	20	30		CIEDRO
C=CCC[C@H](CO)[NH2+][C@H](C)c1cc2cc(Cl)ccc2o1	ZINC000453380912	331125758	/nfs/dbraw/zinc/12/57/58/331125758.db2.gz	ZQNYHEXEUHRLOG-BXUZGUMPSA-N	1	0	293.794	4.064	20	30		CIEDRO
C=CCC[C@@H](CO)[NH2+][C@@H](C)c1cc2cc(Cl)ccc2o1	ZINC000453380913	331125803	/nfs/dbraw/zinc/12/58/03/331125803.db2.gz	ZQNYHEXEUHRLOG-FZMZJTMJSA-N	1	0	293.794	4.064	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1cnc(C)cc1C)c1ccco1	ZINC000453381315	331125913	/nfs/dbraw/zinc/12/59/13/331125913.db2.gz	XNCAOPJWUMOVGT-INIZCTEOSA-N	1	0	270.376	4.089	20	30		CIEDRO
C=CC[C@@H](C)[C@@H](C)[NH2+][C@@H]1CCO[C@@H](c2cccs2)C1	ZINC000453428168	331131116	/nfs/dbraw/zinc/13/11/16/331131116.db2.gz	PCFJDTIRFZNAFE-KBUPBQIOSA-N	1	0	279.449	4.159	20	30		CIEDRO
N#CCCCOc1cccc(C[NH2+][C@@H](C2CC2)C2CCC2)c1	ZINC000453620287	331136876	/nfs/dbraw/zinc/13/68/76/331136876.db2.gz	LHLPTDCJYHSTIO-LJQANCHMSA-N	1	0	298.430	4.037	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1c(C)nc2scc(C3CC3)n12	ZINC000459528044	331286065	/nfs/dbraw/zinc/28/60/65/331286065.db2.gz	JYSBRIKOUIMTCK-CYBMUJFWSA-N	1	0	289.448	4.026	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([N@@H+]2CC3(CCCC3)[C@H]2c2ccccc2)C1	ZINC000459581102	331289210	/nfs/dbraw/zinc/28/92/10/331289210.db2.gz	PSIVEBPKUYYHLD-KBAYOESNSA-N	1	0	280.415	4.296	20	30		CIEDRO
N#CCCC[C@@H]([NH2+]C1CC2(CCC2)C1)c1ccccc1	ZINC000459590501	331289778	/nfs/dbraw/zinc/28/97/78/331289778.db2.gz	NABLRTPFAHLRAB-QGZVFWFLSA-N	1	0	268.404	4.344	20	30		CIEDRO
N#CCCCOc1cccc(C[NH+]2CC3(C2)CCCCC3)c1	ZINC000459594700	331289905	/nfs/dbraw/zinc/28/99/05/331289905.db2.gz	LGJJOIHVDFIAGU-UHFFFAOYSA-N	1	0	298.430	4.135	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+][C@@H](C)c1cncc(F)c1	ZINC000459644587	331291812	/nfs/dbraw/zinc/29/18/12/331291812.db2.gz	FBRMMNVCMCXTML-SWLSCSKDSA-N	1	0	250.361	4.006	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@@H]2C[C@H]2c2c(F)cccc2Cl)C1	ZINC000459670059	331293362	/nfs/dbraw/zinc/29/33/62/331293362.db2.gz	TYCDVTRSODJQMX-NWJSVONSSA-N	1	0	292.785	4.007	20	30		CIEDRO
CC(C)(CC#N)C[NH2+][C@H]1CCCC[C@H]1c1ccccc1	ZINC000459684231	331294289	/nfs/dbraw/zinc/29/42/89/331294289.db2.gz	BUGZQLLFTLHCDM-IRXDYDNUSA-N	1	0	270.420	4.242	20	30		CIEDRO
CCc1oc2ccccc2c1C[NH2+]CC(C)(C)CC#N	ZINC000459690057	331294617	/nfs/dbraw/zinc/29/46/17/331294617.db2.gz	JDVMMAFVFLIOEL-UHFFFAOYSA-N	1	0	270.376	4.025	20	30		CIEDRO
C/C(=C/c1ccc(Cl)cc1)C[NH2+]CC(C)(C)CC#N	ZINC000459727263	331296171	/nfs/dbraw/zinc/29/61/71/331296171.db2.gz	GAPBVMHTEYOJBH-RAXLEYEMSA-N	1	0	276.811	4.273	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)c1ccc(Cl)cc1	ZINC000459764796	331299380	/nfs/dbraw/zinc/29/93/80/331299380.db2.gz	NRHOXFCUPBXHGG-JMSVASOKSA-N	1	0	262.784	4.073	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+]Cc1nc2ccccc2n1C1CC1	ZINC000462070907	331317235	/nfs/dbraw/zinc/31/72/35/331317235.db2.gz	XVQSGFOEPUGHRV-AWEZNQCLSA-N	1	0	283.419	4.206	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+][C@@H](COC)c1ccc(C)o1	ZINC000462115990	331317287	/nfs/dbraw/zinc/31/72/87/331317287.db2.gz	FSGDJUBLNSREQN-CABCVRRESA-N	1	0	265.397	4.000	20	30		CIEDRO
C[C@@H](CCc1ccsc1)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000462795374	331329420	/nfs/dbraw/zinc/32/94/20/331329420.db2.gz	AWPFCJBQXJYPSB-KBPBESRZSA-N	1	0	284.428	4.292	20	30		CIEDRO
C=C[C@H](C)[NH2+][C@H](C)CC(C)(C)c1c[nH]c2ccccc21	ZINC000462808551	331330112	/nfs/dbraw/zinc/33/01/12/331330112.db2.gz	DHZCGJIQDNSFEY-UONOGXRCSA-N	1	0	270.420	4.388	20	30		CIEDRO
CC[C@@H](Nc1cc2c(c[nH+]1)CCCC2)c1ccc(C#N)cc1	ZINC000462966383	331336180	/nfs/dbraw/zinc/33/61/80/331336180.db2.gz	OCWWFFGCRHNHKG-GOSISDBHSA-N	1	0	291.398	4.395	20	30		CIEDRO
C=CC[N@H+](CCc1ccco1)C[C@@H]1C[C@H]1c1ccccc1	ZINC000463168273	331341406	/nfs/dbraw/zinc/34/14/06/331341406.db2.gz	YDTXJONFYDVNEX-HKUYNNGSSA-N	1	0	281.399	4.114	20	30		CIEDRO
CCc1ccc(C(C)(C)C[NH2+][C@H]2CCC[C@@H](C#N)C2)cc1	ZINC000463241145	331343733	/nfs/dbraw/zinc/34/37/33/331343733.db2.gz	CWVZAZXZXIPSJL-AEFFLSMTSA-N	1	0	284.447	4.199	20	30		CIEDRO
CC(C)(C[NH2+][C@H]1CCC[C@H](C#N)C1)C1CCCCC1	ZINC000463247257	331344184	/nfs/dbraw/zinc/34/41/84/331344184.db2.gz	VLWNWYYMRXXXPZ-HOCLYGCPSA-N	1	0	262.441	4.265	20	30		CIEDRO
CC(C)[C@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)c1ccccc1	ZINC000463278482	331344909	/nfs/dbraw/zinc/34/49/09/331344909.db2.gz	CKALYZMKLRCTCY-OIISXLGYSA-N	1	0	256.393	4.056	20	30		CIEDRO
CC(C)(C[NH2+][C@H]1CCC[C@H](C#N)C1)c1ccccc1Cl	ZINC000463284813	331345172	/nfs/dbraw/zinc/34/51/72/331345172.db2.gz	QRGCULQZVIABFT-KBPBESRZSA-N	1	0	290.838	4.290	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+]CCc2cc(Cl)cc(Cl)c2)C1	ZINC000463287216	331345262	/nfs/dbraw/zinc/34/52/62/331345262.db2.gz	JHLDKFOADFWLAI-IUODEOHRSA-N	1	0	297.229	4.208	20	30		CIEDRO
CCC[C@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)C1CCCCC1	ZINC000463293243	331345547	/nfs/dbraw/zinc/34/55/47/331345547.db2.gz	GCUMZGHGUVDIRR-OIISXLGYSA-N	1	0	262.441	4.407	20	30		CIEDRO
CC(C)(C[NH2+][C@@H]1CCC[C@H](C#N)C1)c1ccc(Cl)cc1	ZINC000463296680	331345646	/nfs/dbraw/zinc/34/56/46/331345646.db2.gz	WGQZAFXVKSGWQE-XJKSGUPXSA-N	1	0	290.838	4.290	20	30		CIEDRO
CC(C)(C[NH2+][C@@H]1CCC[C@@H](C#N)C1)c1ccc(Cl)cc1	ZINC000463296679	331345654	/nfs/dbraw/zinc/34/56/54/331345654.db2.gz	WGQZAFXVKSGWQE-CZUORRHYSA-N	1	0	290.838	4.290	20	30		CIEDRO
CC(C)(C)c1ccc(CC[NH2+][C@H]2CCC[C@@H](C#N)C2)cc1	ZINC000463295576	331345662	/nfs/dbraw/zinc/34/56/62/331345662.db2.gz	MIZBUOMBNZXCJA-AEFFLSMTSA-N	1	0	284.447	4.199	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+]Cc2ccc(Cl)cc2Cl)C1	ZINC000463304689	331345875	/nfs/dbraw/zinc/34/58/75/331345875.db2.gz	SCEKDQARNYATMO-MFKMUULPSA-N	1	0	283.202	4.165	20	30		CIEDRO
CC1(C)[C@@H](c2ccccc2)C[C@@H]1[NH2+]Cc1cccc(C#N)c1	ZINC000463542618	331349208	/nfs/dbraw/zinc/34/92/08/331349208.db2.gz	MBAISQOPNJKHSM-MOPGFXCFSA-N	1	0	290.410	4.230	20	30		CIEDRO
CC[N@H+](CCCC#N)[C@H](Cc1ccc(F)cc1)C(C)C	ZINC000464782067	331367857	/nfs/dbraw/zinc/36/78/57/331367857.db2.gz	XPENELTYBBGTGM-QGZVFWFLSA-N	1	0	276.399	4.018	20	30		CIEDRO
CC/C=C\CC[N@H+]1CC=C(c2ccc(C#N)cc2)CC1	ZINC000466225170	331391147	/nfs/dbraw/zinc/39/11/47/331391147.db2.gz	HRXHVZWRYZMIRH-ARJAWSKDSA-N	1	0	266.388	4.004	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1cc(Cl)c(OC)c(OCC)c1	ZINC000466385474	331393775	/nfs/dbraw/zinc/39/37/75/331393775.db2.gz	FYLGNGDFBJTDHC-ZDUSSCGKSA-N	1	0	297.826	4.192	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1cccc(-c2ccncc2)c1	ZINC000466398892	331394854	/nfs/dbraw/zinc/39/48/54/331394854.db2.gz	KLFQVZJTECNIBQ-SFHVURJKSA-N	1	0	266.388	4.193	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1cc(Cl)c(OCC)c(OC)c1	ZINC000466397421	331394878	/nfs/dbraw/zinc/39/48/78/331394878.db2.gz	DLWMKSTYKMRNPZ-ZDUSSCGKSA-N	1	0	297.826	4.192	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1csc(-c2ccccc2)n1	ZINC000466401585	331395078	/nfs/dbraw/zinc/39/50/78/331395078.db2.gz	KCDISKWURUSYOV-AWEZNQCLSA-N	1	0	272.417	4.254	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1cnc(-c2cccs2)s1	ZINC000466400919	331395124	/nfs/dbraw/zinc/39/51/24/331395124.db2.gz	XIWCPXVZAPIJOD-NSHDSACASA-N	1	0	278.446	4.316	20	30		CIEDRO
CC(C)c1ccc(C[NH2+]CCc2cccc(C#N)c2)cc1	ZINC000466424085	331396556	/nfs/dbraw/zinc/39/65/56/331396556.db2.gz	FOFNGRLQBLXVHR-UHFFFAOYSA-N	1	0	278.399	4.014	20	30		CIEDRO
CC(C)(C#N)CCC[NH+]1CC(C)(C)CC(C)(C)C1	ZINC000466924478	331408317	/nfs/dbraw/zinc/40/83/17/331408317.db2.gz	AKBQWWVRYSXSBN-UHFFFAOYSA-N	1	0	250.430	4.074	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@@H](C)Cc1ccccc1SC	ZINC000467409443	331417883	/nfs/dbraw/zinc/41/78/83/331417883.db2.gz	XHHSIFBKMYLIAC-DZGCQCFKSA-N	1	0	263.450	4.284	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@@H](C)c1nc2c(s1)CCCC2	ZINC000467413809	331418257	/nfs/dbraw/zinc/41/82/57/331418257.db2.gz	ZFFZHORVXQOTGV-NWDGAFQWSA-N	1	0	264.438	4.027	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@H]1CCc2[nH]c3ccc(C)cc3c2C1	ZINC000467414766	331418336	/nfs/dbraw/zinc/41/83/36/331418336.db2.gz	WTMFLMMXPWVZRV-CABCVRRESA-N	1	0	282.431	4.278	20	30		CIEDRO
N#Cc1cccc(CC[NH2+][C@@H]2CCC[C@H]2c2ccccc2)c1	ZINC000467453349	331420195	/nfs/dbraw/zinc/42/01/95/331420195.db2.gz	LJCUBUYFSWCDDO-VQTJNVASSA-N	1	0	290.410	4.027	20	30		CIEDRO
CC(C)c1nc([C@@H](C)[NH2+]CCc2cccc(C#N)c2)cs1	ZINC000467458590	331420506	/nfs/dbraw/zinc/42/05/06/331420506.db2.gz	YSWFODVUESGDNL-CYBMUJFWSA-N	1	0	299.443	4.031	20	30		CIEDRO
CC(C)[C@H](C[NH2+]Cc1cc(C#N)cs1)Cc1ccccc1	ZINC000468864624	331441434	/nfs/dbraw/zinc/44/14/34/331441434.db2.gz	GKORDQTZVXHGBS-KRWDZBQOSA-N	1	0	298.455	4.224	20	30		CIEDRO
C=C(CC)C[NH2+][C@@H](C)c1ccc(Br)cc1OC	ZINC000469756530	331456946	/nfs/dbraw/zinc/45/69/46/331456946.db2.gz	MKXJEBVEKDCQDQ-NSHDSACASA-N	1	0	298.224	4.075	20	30		CIEDRO
C=CCOCCC[NH2+][C@@H](C)c1cc2ccccc2s1	ZINC000470779556	331490924	/nfs/dbraw/zinc/49/09/24/331490924.db2.gz	NLTCMVDRZIFIKW-ZDUSSCGKSA-N	1	0	275.417	4.145	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH2+][C@@H](c2ccccc2)c2ccc(F)cc2)C1	ZINC000471583545	331511124	/nfs/dbraw/zinc/51/11/24/331511124.db2.gz	ASHYMLAAUXIPFL-ZMYBRWDISA-N	1	0	294.373	4.197	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)C1	ZINC000471597247	331512307	/nfs/dbraw/zinc/51/23/07/331512307.db2.gz	NUDWGHQCYNSKAT-BVGQSLNGSA-N	1	0	284.378	4.043	20	30		CIEDRO
CC(C)(C)C1CCC(C[NH2+][C@H]2CC[C@H](C#N)C2)CC1	ZINC000472135242	331529650	/nfs/dbraw/zinc/52/96/50/331529650.db2.gz	WJCHOTWWMFLZBE-GRAKBVBRSA-N	1	0	262.441	4.121	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)C1CCC(F)(F)CC1)c1ccc(C#N)cc1	ZINC000474059291	331566632	/nfs/dbraw/zinc/56/66/32/331566632.db2.gz	PNUAUVVMDZCQLP-OLZOCXBDSA-N	1	0	292.373	4.423	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+]C[C@H]1CCO[C@@H]1c1ccccc1	ZINC000477926656	331694500	/nfs/dbraw/zinc/69/45/00/331694500.db2.gz	KZGKDKZHRPOYII-CEXWTWQISA-N	1	0	287.447	4.489	20	30		CIEDRO
C=CCCCC[NH2+]Cc1cc(-c2ccncc2)ccc1OC	ZINC000479479456	331732603	/nfs/dbraw/zinc/73/26/03/331732603.db2.gz	KWYOCXYSNXFYKV-UHFFFAOYSA-N	1	0	296.414	4.203	20	30		CIEDRO
C[C@@H]([NH2+]C1(Cc2ccccc2)CC1)c1ccc(C#N)c(F)c1	ZINC000480665745	331782445	/nfs/dbraw/zinc/78/24/45/331782445.db2.gz	GTNDQOGFVXYCPB-CQSZACIVSA-N	1	0	294.373	4.123	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CCC[C@@H](c3ccccc3)C2)s1	ZINC000486861390	331947605	/nfs/dbraw/zinc/94/76/05/331947605.db2.gz	YGZMHKBJRUTUBJ-HZPDHXFCSA-N	1	0	296.439	4.436	20	30		CIEDRO
Cc1cc(C[NH2+][C@H](C)[C@@H](C)c2ccccc2)ccc1C#N	ZINC000488140455	331991572	/nfs/dbraw/zinc/99/15/72/331991572.db2.gz	AQTXPDGFKZYLSC-HZPDHXFCSA-N	1	0	278.399	4.149	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@H](C)c1nnc([C@@H](C)CC)[nH]1	ZINC000488499715	332013897	/nfs/dbraw/zinc/01/38/97/332013897.db2.gz	CJCYYGFYLWSXDM-MJBXVCDLSA-N	1	0	278.444	4.104	20	30		CIEDRO
CC[C@@H](c1ccc(Cl)cc1)[N@H+](CC)C[C@@H](C)C#N	ZINC000488614571	332020179	/nfs/dbraw/zinc/02/01/79/332020179.db2.gz	BCSPGZODMDNBCB-WFASDCNBSA-N	1	0	264.800	4.273	20	30		CIEDRO
CC[N@H+](C[C@H](C)C#N)[C@@H](C)CCSc1ccccc1	ZINC000488723001	332022554	/nfs/dbraw/zinc/02/25/54/332022554.db2.gz	HBMZMSZRQVSILQ-CABCVRRESA-N	1	0	276.449	4.039	20	30		CIEDRO
C[C@H](c1cccc(C#N)c1)[N@H+](C)CCCc1ccccc1	ZINC000489070354	332040264	/nfs/dbraw/zinc/04/02/64/332040264.db2.gz	HWDATQSVMJNCCV-MRXNPFEDSA-N	1	0	278.399	4.184	20	30		CIEDRO
CC(C)(C)C[C@H]1CCC[N@@H+]1Cc1ccc(F)cc1C#N	ZINC000489553210	332058974	/nfs/dbraw/zinc/05/89/74/332058974.db2.gz	ZHZCPMFWRSSGJP-MRXNPFEDSA-N	1	0	274.383	4.098	20	30		CIEDRO
N#Cc1cc(F)ccc1C[N@@H+]1CCC[C@H]1C1CCCCC1	ZINC000489683029	332064714	/nfs/dbraw/zinc/06/47/14/332064714.db2.gz	ZUBALSJPLWXUNP-SFHVURJKSA-N	1	0	286.394	4.242	20	30		CIEDRO
C=CCCC[N@@H+]1CCC[C@@H](c2nc3c(s2)CCCC3)C1	ZINC000490060524	332079219	/nfs/dbraw/zinc/07/92/19/332079219.db2.gz	MXRJTHZYDQFRSR-CQSZACIVSA-N	1	0	290.476	4.168	20	30		CIEDRO
C=CCCC[N@@H+](CCC)[C@@H](C)C(=O)Nc1ccccc1C	ZINC000490080950	332080661	/nfs/dbraw/zinc/08/06/61/332080661.db2.gz	RGYBMYSTSIENMG-INIZCTEOSA-N	1	0	288.435	4.000	20	30		CIEDRO
C=CC[N@H+](CC#Cc1ccc(Cl)cc1)CCc1ccco1	ZINC000491370049	332198307	/nfs/dbraw/zinc/19/83/07/332198307.db2.gz	XZUXSCCGOUGYNT-UHFFFAOYSA-N	1	0	299.801	4.015	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000494038509	332461786	/nfs/dbraw/zinc/46/17/86/332461786.db2.gz	LNUGULLUEXCNHB-KSSFIOAISA-N	1	0	296.370	4.238	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](C)[C@H](OC)c1ccccc1	ZINC000494596364	332479315	/nfs/dbraw/zinc/47/93/15/332479315.db2.gz	RXTPPHMXXAYOCN-ZOBUZTSGSA-N	1	0	261.409	4.097	20	30		CIEDRO
C[C@@H]([NH2+]C[C@@H]1CCCCC(F)(F)C1)c1cccc(C#N)c1	ZINC000495017929	332500024	/nfs/dbraw/zinc/50/00/24/332500024.db2.gz	LWMDYMJAAJAIBT-UKRRQHHQSA-N	1	0	292.373	4.424	20	30		CIEDRO
CSc1ccc([C@H](C)[NH2+]Cc2ccc(C#N)c(C)c2)cc1	ZINC000500235727	332603604	/nfs/dbraw/zinc/60/36/04/332603604.db2.gz	YCHFDMZMPHEVMJ-AWEZNQCLSA-N	1	0	296.439	4.439	20	30		CIEDRO
C[C@H]1C[C@@]1([NH2+]Cc1ccc(C#N)cc1)c1ccc(Cl)cc1	ZINC000500396042	332606293	/nfs/dbraw/zinc/60/62/93/332606293.db2.gz	IXHMOKABJLKQQL-UGSOOPFHSA-N	1	0	296.801	4.237	20	30		CIEDRO
C[C@@H]1C[C@@]1([NH2+]Cc1cccc(C#N)c1)c1ccc(Cl)cc1	ZINC000500417150	332607953	/nfs/dbraw/zinc/60/79/53/332607953.db2.gz	QQQWWMVHKRJFAB-ACJLOTCBSA-N	1	0	296.801	4.237	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H](C)c1cnn(C2CCCC2)c1	ZINC000502390762	332655942	/nfs/dbraw/zinc/65/59/42/332655942.db2.gz	OSBVDINBCABYTP-HUUCEWRRSA-N	1	0	275.440	4.394	20	30		CIEDRO
CC(C)[C@@H]([NH2+]CCC(C)(C)C#N)c1ccc(F)cc1	ZINC000502483791	332663083	/nfs/dbraw/zinc/66/30/83/332663083.db2.gz	KNCZCQIRLWEOJC-OAHLLOKOSA-N	1	0	262.372	4.052	20	30		CIEDRO
C[C@H]([NH2+]C[C@H]1CCCC(F)(F)C1)c1ccc(C#N)cc1F	ZINC000502579936	332666335	/nfs/dbraw/zinc/66/63/35/332666335.db2.gz	RJBQDHSORHAZGF-AAEUAGOBSA-N	1	0	296.336	4.173	20	30		CIEDRO
C[C@H]([NH2+]C1(c2ccccc2)CCC1)c1ccc(C#N)cc1F	ZINC000512280415	332961293	/nfs/dbraw/zinc/96/12/93/332961293.db2.gz	HSMRQIXFBWDMQC-AWEZNQCLSA-N	1	0	294.373	4.427	20	30		CIEDRO
C[C@@H]([NH2+]C1CCC(C)(C)CC1)c1ccc(C#N)cc1F	ZINC000512629652	332976629	/nfs/dbraw/zinc/97/66/29/332976629.db2.gz	JTGULLRTBGIFDP-GFCCVEGCSA-N	1	0	274.383	4.317	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@@H](C)[C@@H]1C)c1ccc(C#N)cc1F	ZINC000512661832	332978543	/nfs/dbraw/zinc/97/85/43/332978543.db2.gz	UPHZFGWHWWVCRJ-ZOPJHEKZSA-N	1	0	274.383	4.173	20	30		CIEDRO
C[C@@H]1CCCC[C@H]1[NH+]1CCC(Nc2cccc(C#N)c2)CC1	ZINC000512783876	332985773	/nfs/dbraw/zinc/98/57/73/332985773.db2.gz	PHFUVAPXIWLOAP-DNVCBOLYSA-N	1	0	297.446	4.013	20	30		CIEDRO
C[N@H+](CCCCc1ccccc1)CCCC(C)(C)C#N	ZINC000174822768	333007998	/nfs/dbraw/zinc/00/79/98/333007998.db2.gz	DWTXBTJFRMFBJO-UHFFFAOYSA-N	1	0	272.436	4.271	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CCC[C@H]1Cc1cccc(F)c1	ZINC000174822727	333008079	/nfs/dbraw/zinc/00/80/79/333008079.db2.gz	NTTJLCJZANCLCI-KRWDZBQOSA-N	1	0	288.410	4.163	20	30		CIEDRO
CC[C@H](C)[C@H](C)[N@H+](CCCC(C)(C)C#N)C1CC1	ZINC000174848437	333008717	/nfs/dbraw/zinc/00/87/17/333008717.db2.gz	PIUFLKPGJLWTMJ-KBPBESRZSA-N	1	0	250.430	4.215	20	30		CIEDRO
C[C@@H]1C[C@@H](c2ccccc2)[N@H+](Cc2ccc(C#N)c(F)c2)C1	ZINC000513237048	333010340	/nfs/dbraw/zinc/01/03/40/333010340.db2.gz	SJWWECVIIMHMFR-KUHUBIRLSA-N	1	0	294.373	4.280	20	30		CIEDRO
C[C@H]1C[C@@H](c2ccccc2)[N@H+](Cc2ccc(CC#N)cc2)C1	ZINC000513247339	333010811	/nfs/dbraw/zinc/01/08/11/333010811.db2.gz	NJUXCHIDYRSKLQ-JXFKEZNVSA-N	1	0	290.410	4.336	20	30		CIEDRO
C[C@H]1C[C@H](c2ccccc2)[N@H+](Cc2cccc(C#N)c2)C1	ZINC000513256314	333011019	/nfs/dbraw/zinc/01/10/19/333011019.db2.gz	LNQDQRIMFXINJT-HNAYVOBHSA-N	1	0	276.383	4.141	20	30		CIEDRO
CC[C@H](C)[C@@H](C)[N@H+](Cc1cc(C#N)cs1)C1CC1	ZINC000513461703	333021198	/nfs/dbraw/zinc/02/11/98/333021198.db2.gz	OHOFJMBJVZJYBE-NWDGAFQWSA-N	1	0	262.422	4.019	20	30		CIEDRO
CC[C@H](C)[C@H](C)[N@H+](Cc1ccc(C#N)cc1F)C1CC1	ZINC000513466473	333021418	/nfs/dbraw/zinc/02/14/18/333021418.db2.gz	GHXSUIVPAQMXEY-STQMWFEESA-N	1	0	274.383	4.096	20	30		CIEDRO
Cc1ccccc1C1CC[NH+](Cc2cccc(C#N)c2)CC1	ZINC000513490511	333022613	/nfs/dbraw/zinc/02/26/13/333022613.db2.gz	NTJKYYVHKHKJQN-UHFFFAOYSA-N	1	0	290.410	4.246	20	30		CIEDRO
C[C@H](c1ccc(Cl)cc1)[C@@H](C)[N@H+](C)CCCC#N	ZINC000175434898	333024759	/nfs/dbraw/zinc/02/47/59/333024759.db2.gz	DBQXHTHSXGICAX-QWHCGFSZSA-N	1	0	264.800	4.068	20	30		CIEDRO
C[C@H]([C@@H](C)c1ccc(Cl)cc1)[N@H+](C)CCCC#N	ZINC000175434878	333024779	/nfs/dbraw/zinc/02/47/79/333024779.db2.gz	DBQXHTHSXGICAX-CHWSQXEVSA-N	1	0	264.800	4.068	20	30		CIEDRO
C[C@H](c1ccc(Cl)cc1)[C@H](C)[N@H+](C)CCCC#N	ZINC000175434935	333024890	/nfs/dbraw/zinc/02/48/90/333024890.db2.gz	DBQXHTHSXGICAX-STQMWFEESA-N	1	0	264.800	4.068	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H](OC)c1ccccc1)c1ccco1	ZINC000513661462	333030243	/nfs/dbraw/zinc/03/02/43/333030243.db2.gz	OUUYGCIIOBVKDW-FUHWJXTLSA-N	1	0	285.387	4.264	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCOc1ccc(F)cc1)c1ccco1	ZINC000513673498	333031475	/nfs/dbraw/zinc/03/14/75/333031475.db2.gz	SLMBTVKCOPFMNR-MRXNPFEDSA-N	1	0	289.350	4.095	20	30		CIEDRO
CC(C)CC[N@H+](CCC#N)C[C@H]1C[C@@H]1c1ccccc1	ZINC000513732312	333036332	/nfs/dbraw/zinc/03/63/32/333036332.db2.gz	DGGJFULIOBEEDW-QZTJIDSGSA-N	1	0	270.420	4.052	20	30		CIEDRO
C=CCC[C@@H](NCC1([NH+](C)C)CCCCC1)c1ccco1	ZINC000513753650	333037498	/nfs/dbraw/zinc/03/74/98/333037498.db2.gz	DVYRHKLBABKOPX-MRXNPFEDSA-N	1	0	290.451	4.141	20	30		CIEDRO
C=CCN1CCC([NH2+][C@@H](C)c2cccc3ccccc32)CC1	ZINC000177313333	333057411	/nfs/dbraw/zinc/05/74/11/333057411.db2.gz	YJEUHTIUAYIKMF-INIZCTEOSA-N	1	0	294.442	4.141	20	30		CIEDRO
C[C@H](CCC(C)(C)C)[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000311446017	333068748	/nfs/dbraw/zinc/06/87/48/333068748.db2.gz	KECWJQOSURYDFH-ZIAGYGMSSA-N	1	0	258.409	4.424	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)c1cc2cccc(OC)c2o1	ZINC000311633305	333070675	/nfs/dbraw/zinc/07/06/75/333070675.db2.gz	MWFWSZOFGMZVSP-LBPRGKRZSA-N	1	0	259.349	4.058	20	30		CIEDRO
N#CCCCC[NH2+][C@H](Cc1ccccc1)C1CCCCC1	ZINC000178645578	333076356	/nfs/dbraw/zinc/07/63/56/333076356.db2.gz	GONDXEWRORXTEP-LJQANCHMSA-N	1	0	284.447	4.461	20	30		CIEDRO
CCC(CC)[N@H+](CC)Cc1ccccc1C(C)(C)C#N	ZINC000516809068	333083077	/nfs/dbraw/zinc/08/30/77/333083077.db2.gz	UQDRKAXCDLFGEE-UHFFFAOYSA-N	1	0	272.436	4.498	20	30		CIEDRO
CC(C)CC[C@@H]1CCC[C@@H]1[NH2+]Cc1cccc(C#N)c1	ZINC000517551763	333102204	/nfs/dbraw/zinc/10/22/04/333102204.db2.gz	VIRWSEQFQQQIAH-ROUUACIJSA-N	1	0	270.420	4.253	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+]Cc1cccc2cccnc21	ZINC000521084961	333111379	/nfs/dbraw/zinc/11/13/79/333111379.db2.gz	UGZCQWXZUHIEFD-HNNXBMFYSA-N	1	0	268.404	4.459	20	30		CIEDRO
C=C(C)C[C@H](C)C(=O)Nc1cccc(C[NH+](CC)CC)c1	ZINC000185086092	333135443	/nfs/dbraw/zinc/13/54/43/333135443.db2.gz	YGSOVFMRIMXYCA-HNNXBMFYSA-N	1	0	288.435	4.069	20	30		CIEDRO
C[C@H]([NH2+]C[C@@H]1CCC[C@@H](C)C1)c1cccc(C#N)c1	ZINC000218941814	333138814	/nfs/dbraw/zinc/13/88/14/333138814.db2.gz	AXSRODDEIXCOCL-IJEWVQPXSA-N	1	0	256.393	4.035	20	30		CIEDRO
C=C(C)C[C@@H](C)C(=O)Nc1cccc(Oc2ccncc2)c1	ZINC000185536803	333143170	/nfs/dbraw/zinc/14/31/70/333143170.db2.gz	FHLAWHCNTNVTGU-CQSZACIVSA-N	1	0	296.370	4.415	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1cc(O)cc(F)c1)c1ccccc1	ZINC000185601228	333144647	/nfs/dbraw/zinc/14/46/47/333144647.db2.gz	NLSIJWWJQJEQPQ-GOSISDBHSA-N	1	0	285.362	4.328	20	30		CIEDRO
COc1ccc2cc(C[NH2+][C@@H]3CCC[C@H](C#N)C3)ccc2c1	ZINC000185765886	333148218	/nfs/dbraw/zinc/14/82/18/333148218.db2.gz	WNGTYTOBRPICMQ-KBXCAEBGSA-N	1	0	294.398	4.020	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+]Cc2ccccc2OC2CCCC2)C1	ZINC000185786452	333148798	/nfs/dbraw/zinc/14/87/98/333148798.db2.gz	IDUKSHWOJKIUHH-RDJZCZTQSA-N	1	0	298.430	4.180	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+]CCc2csc3ccccc23)C1	ZINC000185822109	333149640	/nfs/dbraw/zinc/14/96/40/333149640.db2.gz	MIXBTRYLOVTZAA-ZFWWWQNUSA-N	1	0	284.428	4.116	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+]CCc2csc3ccccc23)C1	ZINC000185822131	333149657	/nfs/dbraw/zinc/14/96/57/333149657.db2.gz	MIXBTRYLOVTZAA-UKRRQHHQSA-N	1	0	284.428	4.116	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+]Cc2ccc3ccccc3c2)C1	ZINC000185818448	333149737	/nfs/dbraw/zinc/14/97/37/333149737.db2.gz	YSXLGTGVHYUXRD-KBXCAEBGSA-N	1	0	264.372	4.012	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+]CCc2ccc3ccccc3c2)C1	ZINC000185816520	333149746	/nfs/dbraw/zinc/14/97/46/333149746.db2.gz	PJVLWYUKCZBQEA-LPHOPBHVSA-N	1	0	278.399	4.054	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1c(F)cccc1Cl	ZINC000185852412	333150355	/nfs/dbraw/zinc/15/03/55/333150355.db2.gz	CYHVFGOYLCYKRJ-SRVKXCTJSA-N	1	0	280.774	4.212	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+]CC2(c3ccccc3Cl)CC2)C1	ZINC000185873457	333150708	/nfs/dbraw/zinc/15/07/08/333150708.db2.gz	GEFCNKWOKMXXET-KBPBESRZSA-N	1	0	288.822	4.044	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1ccccc1	ZINC000185867101	333150786	/nfs/dbraw/zinc/15/07/86/333150786.db2.gz	UYIKUEXGJGQVBI-SZMVWBNQSA-N	1	0	268.404	4.366	20	30		CIEDRO
CC[C@H](C[N@H+](CC)CCCSCC#N)c1ccccc1	ZINC000186607335	333163601	/nfs/dbraw/zinc/16/36/01/333163601.db2.gz	UIYIZZOXTFSATN-MRXNPFEDSA-N	1	0	290.476	4.149	20	30		CIEDRO
C=C(C)COCC[NH2+][C@@H](C)c1cccc(Cl)c1Cl	ZINC000222309234	333180869	/nfs/dbraw/zinc/18/08/69/333180869.db2.gz	GZUFQMHEWHVGGZ-NSHDSACASA-N	1	0	288.218	4.237	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](C)c1cnn(C(C)C)c1C	ZINC000191413998	333219238	/nfs/dbraw/zinc/21/92/38/333219238.db2.gz	XFFHTHBLLSHFLA-UONOGXRCSA-N	1	0	263.429	4.168	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H](C)c1cnn(C(C)C)c1C	ZINC000191414028	333219298	/nfs/dbraw/zinc/21/92/98/333219298.db2.gz	XFFHTHBLLSHFLA-ZIAGYGMSSA-N	1	0	263.429	4.168	20	30		CIEDRO
CCCC[C@@H]1CCC[C@@H]1[NH2+]CCCC(C)(C)C#N	ZINC000191831687	333226150	/nfs/dbraw/zinc/22/61/50/333226150.db2.gz	QREHGYMVBPZRDY-CABCVRRESA-N	1	0	250.430	4.265	20	30		CIEDRO
CC(C)[C@@H](C[NH2+]Cc1ccc(C#N)cc1)c1ccccc1	ZINC000225618044	333237796	/nfs/dbraw/zinc/23/77/96/333237796.db2.gz	XTXSHMSKCZPEOA-LJQANCHMSA-N	1	0	278.399	4.088	20	30		CIEDRO
C=CCOc1cccc(C[NH2+][C@H]2CCCc3occc32)c1	ZINC000192947109	333240726	/nfs/dbraw/zinc/24/07/26/333240726.db2.gz	IPHKCXPMUDJSCV-KRWDZBQOSA-N	1	0	283.371	4.012	20	30		CIEDRO
C=CCCCCC[NH2+][C@@H](c1nc(C)cs1)C1CC1	ZINC000193537944	333252428	/nfs/dbraw/zinc/25/24/28/333252428.db2.gz	GRODCDPMAALGIP-CQSZACIVSA-N	1	0	264.438	4.239	20	30		CIEDRO
C=CCCCCC[NH2+][C@H](CC)c1c(C)noc1C	ZINC000193550557	333252816	/nfs/dbraw/zinc/25/28/16/333252816.db2.gz	CZFVSFVSJXLICF-CQSZACIVSA-N	1	0	250.386	4.079	20	30		CIEDRO
C=CCCCCC[NH2+][C@@H](C)c1csc(CC)n1	ZINC000193552188	333253113	/nfs/dbraw/zinc/25/31/13/333253113.db2.gz	IFXUOYLGASFVDO-LBPRGKRZSA-N	1	0	252.427	4.103	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCC[C@@H](C)CC1)c1cccc(C#N)c1	ZINC000227311870	333280359	/nfs/dbraw/zinc/28/03/59/333280359.db2.gz	NWMCLKPPORLTCD-KEYYUXOJSA-N	1	0	256.393	4.178	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CC[C@@H]3CCCC[C@H]3C2)cc1	ZINC000250008428	333301187	/nfs/dbraw/zinc/30/11/87/333301187.db2.gz	UQJQOMBWAJTLKK-OKZBNKHCSA-N	1	0	268.404	4.007	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@@H]2CC[C@H]3CCCC[C@H]3C2)c1	ZINC000250072405	333302103	/nfs/dbraw/zinc/30/21/03/333302103.db2.gz	HFKNJFFPSBYIGN-FGTMMUONSA-N	1	0	268.404	4.007	20	30		CIEDRO
N#Cc1ccc(C[N@@H+]2CCCCC[C@@H]2c2ccco2)cc1	ZINC000523006439	333304377	/nfs/dbraw/zinc/30/43/77/333304377.db2.gz	CNIIAYJQSFUZMJ-QGZVFWFLSA-N	1	0	280.371	4.269	20	30		CIEDRO
C[C@@H]([NH2+]CC(C)(C)CCC#N)c1cccc(Cl)c1	ZINC000229670998	333307443	/nfs/dbraw/zinc/30/74/43/333307443.db2.gz	VASOLNAEBGIJQR-GFCCVEGCSA-N	1	0	264.800	4.321	20	30		CIEDRO
CC(C)[C@H]1CCCC[C@H]1[NH2+]CC(C)(C)CCC#N	ZINC000229700945	333307997	/nfs/dbraw/zinc/30/79/97/333307997.db2.gz	HISDNAPRWIXAKL-HUUCEWRRSA-N	1	0	250.430	4.121	20	30		CIEDRO
CCC1(C[NH2+][C@H](C)c2ccc(C#N)cc2)CCCC1	ZINC000230186313	333315721	/nfs/dbraw/zinc/31/57/21/333315721.db2.gz	NRJZQLHRSNSEGI-CQSZACIVSA-N	1	0	256.393	4.179	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]C(CC)CC)cc1Cl	ZINC000303192285	333338802	/nfs/dbraw/zinc/33/88/02/333338802.db2.gz	MTLHXYNXHNKYJQ-UHFFFAOYSA-N	1	0	267.800	4.183	20	30		CIEDRO
CC1CCC([N@H+](C)CCCCC(C)(C)C#N)CC1	ZINC000232815943	333343419	/nfs/dbraw/zinc/34/34/19/333343419.db2.gz	YHXIFNUODGCQAU-UHFFFAOYSA-N	1	0	250.430	4.217	20	30		CIEDRO
CCC[C@H](Cc1ccccc1)[N@H+](CCC)CCC#N	ZINC000524070140	333352732	/nfs/dbraw/zinc/35/27/32/333352732.db2.gz	MOLWXVIONLPVEU-QGZVFWFLSA-N	1	0	258.409	4.023	20	30		CIEDRO
COc1ccc([C@@H](C)[NH2+]CCCCC(C)(C)C#N)cc1	ZINC000234879804	333362749	/nfs/dbraw/zinc/36/27/49/333362749.db2.gz	FTSDUUPLXNNOIN-CQSZACIVSA-N	1	0	274.408	4.066	20	30		CIEDRO
COc1ccccc1[C@H](C)[NH2+]CCCCC(C)(C)C#N	ZINC000234898150	333362906	/nfs/dbraw/zinc/36/29/06/333362906.db2.gz	GVKMNAQPQNTPMN-AWEZNQCLSA-N	1	0	274.408	4.066	20	30		CIEDRO
COc1cccc([C@@H](C)[NH2+]CCCCC(C)(C)C#N)c1	ZINC000234917874	333363064	/nfs/dbraw/zinc/36/30/64/333363064.db2.gz	LOVYIPKQHQWTQM-CQSZACIVSA-N	1	0	274.408	4.066	20	30		CIEDRO
C[C@@H]([NH2+]CCCCC(C)(C)C#N)C1CCCCC1	ZINC000235192214	333366359	/nfs/dbraw/zinc/36/63/59/333366359.db2.gz	DCZXCCUKWOBPPT-CQSZACIVSA-N	1	0	250.430	4.265	20	30		CIEDRO
C[C@H]1CCC[C@@H]([N@H+](C)CCCCC(C)(C)C#N)C1	ZINC000235547747	333370719	/nfs/dbraw/zinc/37/07/19/333370719.db2.gz	FWORCNVRZBEVMO-LSDHHAIUSA-N	1	0	250.430	4.217	20	30		CIEDRO
C[C@H]1CCCC[C@@H]1[N@H+](C)CCCCC(C)(C)C#N	ZINC000235544697	333370762	/nfs/dbraw/zinc/37/07/62/333370762.db2.gz	UPWPHXKLEXGAFK-GJZGRUSLSA-N	1	0	250.430	4.217	20	30		CIEDRO
CC1(C)CC[C@@H]([NH2+]Cc2cccc(C#N)c2)c2ccccc21	ZINC000236747620	333375282	/nfs/dbraw/zinc/37/52/82/333375282.db2.gz	KEPGDLUYTKICBI-LJQANCHMSA-N	1	0	290.410	4.461	20	30		CIEDRO
N#CCCCC[NH2+]Cc1ccccc1OCc1ccccc1	ZINC000237816460	333381701	/nfs/dbraw/zinc/38/17/01/333381701.db2.gz	AMOFNRGOONLMIX-UHFFFAOYSA-N	1	0	294.398	4.049	20	30		CIEDRO
N#Cc1cccc(C[NH2+]CC2(c3cccc(Cl)c3)CC2)c1	ZINC000237843976	333381905	/nfs/dbraw/zinc/38/19/05/333381905.db2.gz	XCSXDUWQWXJLNE-UHFFFAOYSA-N	1	0	296.801	4.033	20	30		CIEDRO
Cc1ccc(C2CC([NH2+][C@H](C)c3ccc(C#N)cc3)C2)cc1	ZINC000315627373	333382664	/nfs/dbraw/zinc/38/26/64/333382664.db2.gz	XFSTYGPACTVAQS-APMMTJHUSA-N	1	0	290.410	4.464	20	30		CIEDRO
C[C@@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2cccc(C#N)c2)C1	ZINC000524755141	333386497	/nfs/dbraw/zinc/38/64/97/333386497.db2.gz	QEGPYDJTHCAHGU-KUHUBIRLSA-N	1	0	294.373	4.280	20	30		CIEDRO
CC[C@H](C)[C@@H]1CCCC[N@@H+]1Cc1cc(C#N)ccc1F	ZINC000524811275	333389136	/nfs/dbraw/zinc/38/91/36/333389136.db2.gz	GDQPAHIROSORCE-GUYCJALGSA-N	1	0	274.383	4.098	20	30		CIEDRO
C=CCC1([NH2+]Cc2nnc(C(C)C)s2)CCCCC1	ZINC000528705135	333453048	/nfs/dbraw/zinc/45/30/48/333453048.db2.gz	NEDPNUADUQVORW-UHFFFAOYSA-N	1	0	279.453	4.030	20	30		CIEDRO
CC(C)[C@H]1CC[C@@H](C)C[C@H]1[NH2+]Cc1cccc(C#N)c1	ZINC000037033683	333466160	/nfs/dbraw/zinc/46/61/60/333466160.db2.gz	VSPPKZLFTIOPIS-ZTFGCOKTSA-N	1	0	270.420	4.109	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@H](C)[C@H]1C)c1cccc(C#N)c1	ZINC000037215060	333515699	/nfs/dbraw/zinc/51/56/99/333515699.db2.gz	ZXBFAYZRRWDOFZ-QDEZUTFSSA-N	1	0	256.393	4.034	20	30		CIEDRO
C[C@@H]([NH2+]CC(C)(C)c1ccccc1)c1ccc(C#N)cc1	ZINC000037934763	333543085	/nfs/dbraw/zinc/54/30/85/333543085.db2.gz	SWMMZAIUYAGAHE-OAHLLOKOSA-N	1	0	278.399	4.187	20	30		CIEDRO
C=CCCOCC[NH2+][C@H](C)c1ccc(-c2ccccc2)o1	ZINC000537947803	333549355	/nfs/dbraw/zinc/54/93/55/333549355.db2.gz	LBVRVSHQLIHOGK-OAHLLOKOSA-N	1	0	285.387	4.190	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)c1ccc(OC)c2ccccc21	ZINC000537968614	333552083	/nfs/dbraw/zinc/55/20/83/333552083.db2.gz	OKMCCBLECYYHOV-KBPBESRZSA-N	1	0	269.388	4.464	20	30		CIEDRO
C[C@H]([NH2+]CC1(c2cccc(F)c2)CC1)c1ccc(C#N)cc1	ZINC000174119626	335148289	/nfs/dbraw/zinc/14/82/89/335148289.db2.gz	DJVLEKQRYDBMCZ-AWEZNQCLSA-N	1	0	294.373	4.080	20	30		CIEDRO
N#CCC[C@H]([NH2+]CC1CCCCC1)c1ccccc1	ZINC000125778516	333573002	/nfs/dbraw/zinc/57/30/02/333573002.db2.gz	BXGMHRSBXDKFDD-KRWDZBQOSA-N	1	0	256.393	4.201	20	30		CIEDRO
Cc1cccc([C@H](C)[NH2+]Cc2cccc(C#N)c2F)c1C	ZINC000538186782	333577758	/nfs/dbraw/zinc/57/77/58/333577758.db2.gz	BYSDUCMOWVXHFJ-AWEZNQCLSA-N	1	0	282.362	4.165	20	30		CIEDRO
Cc1ccccc1[C@@H]([NH2+]Cc1ccc(F)cc1C#N)C1CC1	ZINC000538392054	333588076	/nfs/dbraw/zinc/58/80/76/333588076.db2.gz	IRRAQQFBZLVURQ-IBGZPJMESA-N	1	0	294.373	4.247	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](C)c1ccc2c(c1)COC2	ZINC000538406457	333589018	/nfs/dbraw/zinc/58/90/18/333589018.db2.gz	GEKNUCHLKRKIGN-KBPBESRZSA-N	1	0	259.393	4.112	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](C)c1nc2c(s1)CCCC2	ZINC000538408971	333589565	/nfs/dbraw/zinc/58/95/65/333589565.db2.gz	AKHNBYPKVVKYOU-STQMWFEESA-N	1	0	278.465	4.417	20	30		CIEDRO
N#CC1(c2ccccc2)CCC([NH2+][C@H]2C=CCCC2)CC1	ZINC000538423397	333591393	/nfs/dbraw/zinc/59/13/93/333591393.db2.gz	NUUCIMMQUUHHPN-VIQWUECVSA-N	1	0	280.415	4.089	20	30		CIEDRO
C[C@H]1CC[C@@H]([NH2+]Cc2ccc(C#N)cc2)c2ccccc21	ZINC000126559429	333599798	/nfs/dbraw/zinc/59/97/98/333599798.db2.gz	XVHKJWZVDWJPFP-IFXJQAMLSA-N	1	0	276.383	4.286	20	30		CIEDRO
C[C@@H]([NH2+]C1(c2ccc(F)cc2)CC1)c1ccc(C#N)cc1	ZINC000538554004	333605882	/nfs/dbraw/zinc/60/58/82/333605882.db2.gz	OJEZEVLIAVSMNL-CYBMUJFWSA-N	1	0	280.346	4.037	20	30		CIEDRO
C[C@H](C[NH2+][C@@H](C)c1ccc(C#N)cc1)Sc1ccccc1	ZINC000174272589	335151632	/nfs/dbraw/zinc/15/16/32/335151632.db2.gz	RDOBUBQLEASSFG-CABCVRRESA-N	1	0	296.439	4.390	20	30		CIEDRO
C[C@H](C[NH2+][C@H](C)c1ccc(C#N)cc1)Sc1ccccc1	ZINC000174272612	335151633	/nfs/dbraw/zinc/15/16/33/335151633.db2.gz	RDOBUBQLEASSFG-HUUCEWRRSA-N	1	0	296.439	4.390	20	30		CIEDRO
C=CCCOCC[NH2+][C@H](C)c1cc2cc(C)c(C)cc2o1	ZINC000539052345	333652022	/nfs/dbraw/zinc/65/20/22/333652022.db2.gz	WHTIQASVJYICSE-OAHLLOKOSA-N	1	0	287.403	4.293	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+][C@@H](C)c1nc2ccccc2n1CC	ZINC000539070365	333654829	/nfs/dbraw/zinc/65/48/29/333654829.db2.gz	FQXXUULBHPINCK-ZNMIVQPWSA-N	1	0	285.435	4.308	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+][C@H](C)c1nc2ccccc2n1CC	ZINC000539070363	333654994	/nfs/dbraw/zinc/65/49/94/333654994.db2.gz	FQXXUULBHPINCK-RRFJBIMHSA-N	1	0	285.435	4.308	20	30		CIEDRO
C=C(CC)C[NH+]1CCC(Oc2ccccc2Cl)CC1	ZINC000539118705	333659226	/nfs/dbraw/zinc/65/92/26/333659226.db2.gz	XOWFMAAAAZTJDL-UHFFFAOYSA-N	1	0	279.811	4.149	20	30		CIEDRO
CCSc1ccc([C@@H](C)[NH2+]Cc2ccc(C#N)o2)cc1	ZINC000174346735	335153038	/nfs/dbraw/zinc/15/30/38/335153038.db2.gz	ZGGFKCFBJYMLJB-GFCCVEGCSA-N	1	0	286.400	4.114	20	30		CIEDRO
C=CC[NH2+][C@H](Cc1cccc(F)c1)c1cccc(F)c1	ZINC000539308753	333665423	/nfs/dbraw/zinc/66/54/23/333665423.db2.gz	KDYKJZAYTVRUFP-QGZVFWFLSA-N	1	0	273.326	4.024	20	30		CIEDRO
Cc1ccc(CC[C@H](C)[NH2+][C@@H](C)c2cccc(C#N)c2)o1	ZINC000539494572	333673773	/nfs/dbraw/zinc/67/37/73/333673773.db2.gz	KFQZKDCZZFGNGD-ZFWWWQNUSA-N	1	0	282.387	4.132	20	30		CIEDRO
C[C@@H]([NH2+]CC1(c2ccccc2)CCC1)c1cccc(C#N)c1	ZINC000539499067	333674238	/nfs/dbraw/zinc/67/42/38/333674238.db2.gz	CMEXVEZPVOKNSP-MRXNPFEDSA-N	1	0	290.410	4.331	20	30		CIEDRO
C[C@@H]([NH2+]CC1(Cc2ccccc2)CC1)c1ccc(C#N)cc1	ZINC000539509698	333675342	/nfs/dbraw/zinc/67/53/42/333675342.db2.gz	KRRHZFMNKGJEIH-MRXNPFEDSA-N	1	0	290.410	4.232	20	30		CIEDRO
C[C@@H]([NH2+]C1(Cc2ccccc2)CCC1)c1ccc(C#N)cc1	ZINC000539656570	333683924	/nfs/dbraw/zinc/68/39/24/333683924.db2.gz	BZHQUYZEPNGOMH-MRXNPFEDSA-N	1	0	290.410	4.374	20	30		CIEDRO
FC(F)(F)c1ccc(C#CC[NH2+]C[C@@H]2CC=CCC2)cc1	ZINC000539703875	333686307	/nfs/dbraw/zinc/68/63/07/333686307.db2.gz	FRZTXMBQHOGTNK-OAHLLOKOSA-N	1	0	293.332	4.003	20	30		CIEDRO
Cc1cccc([C@@H](C)C[NH2+]CC(C)(C)CCC#N)c1	ZINC000174425038	335154400	/nfs/dbraw/zinc/15/44/00/335154400.db2.gz	GSMHMNHICBUBKY-HNNXBMFYSA-N	1	0	258.409	4.018	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1cccc(OC(F)F)c1)C1CC1	ZINC000540177351	333718158	/nfs/dbraw/zinc/71/81/58/333718158.db2.gz	JVFWEMCTENSZPK-HNNXBMFYSA-N	1	0	281.346	4.122	20	30		CIEDRO
C=CCCC[C@H](C)[NH+]1CCC(c2c[nH]c3ncccc23)CC1	ZINC000540296590	333723609	/nfs/dbraw/zinc/72/36/09/333723609.db2.gz	FRVDBCGOEVVGRX-HNNXBMFYSA-N	1	0	297.446	4.487	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)c1ccc(OCc2cccnc2)cc1	ZINC000540324580	333725722	/nfs/dbraw/zinc/72/57/22/333725722.db2.gz	UCYWLFRHMOEMNY-INIZCTEOSA-N	1	0	296.414	4.277	20	30		CIEDRO
C=CCCC[NH2+][C@H](C)c1ccc(OCc2cccnc2)cc1	ZINC000540324586	333725732	/nfs/dbraw/zinc/72/57/32/333725732.db2.gz	UCYWLFRHMOEMNY-MRXNPFEDSA-N	1	0	296.414	4.277	20	30		CIEDRO
CCCC[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(C#N)s1	ZINC000540601678	333737418	/nfs/dbraw/zinc/73/74/18/333737418.db2.gz	ALAOYZDIEIMYKZ-IUODEOHRSA-N	1	0	262.422	4.068	20	30		CIEDRO
Cc1cccc2c1CC[C@@H]2[NH2+][C@H](C)c1ccc(C#N)c(F)c1	ZINC000540707735	333742768	/nfs/dbraw/zinc/74/27/68/333742768.db2.gz	DGWHSRDKNSEOCM-YJYMSZOUSA-N	1	0	294.373	4.344	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H]1CCCc2ccc(O)cc21	ZINC000340535691	335157853	/nfs/dbraw/zinc/15/78/53/335157853.db2.gz	NXOZSCNQJJDZNH-SUMWQHHRSA-N	1	0	259.393	4.104	20	30		CIEDRO
C=CCSCC[NH2+][C@@H](CC1CC1)c1ccccc1	ZINC000541897527	333797803	/nfs/dbraw/zinc/79/78/03/333797803.db2.gz	VGYFOPKEXXNRIF-INIZCTEOSA-N	1	0	261.434	4.037	20	30		CIEDRO
CC[C@@H](c1ccc(Cl)cc1)[NH+]1CCC(CC#N)CC1	ZINC000541955038	333804274	/nfs/dbraw/zinc/80/42/74/333804274.db2.gz	UAJHRHFLGBGZJG-INIZCTEOSA-N	1	0	276.811	4.417	20	30		CIEDRO
C=C(C)C[NH2+][C@H](Cc1ccccc1)c1cccs1	ZINC000542527219	333830867	/nfs/dbraw/zinc/83/08/67/333830867.db2.gz	VMAUAZPPLBFDLJ-OAHLLOKOSA-N	1	0	257.402	4.198	20	30		CIEDRO
C=C(C)C[NH2+][C@@H](Cc1ccccc1)c1cccs1	ZINC000542527218	333831015	/nfs/dbraw/zinc/83/10/15/333831015.db2.gz	VMAUAZPPLBFDLJ-HNNXBMFYSA-N	1	0	257.402	4.198	20	30		CIEDRO
Cc1ccccc1C1CC[NH+](CCC(C)(C)C#N)CC1	ZINC000542631360	333834023	/nfs/dbraw/zinc/83/40/23/333834023.db2.gz	BNCLMGNQHAQCEN-UHFFFAOYSA-N	1	0	270.420	4.114	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(Cl)cc1)c1ccc(C#N)cc1F	ZINC000542834628	333844375	/nfs/dbraw/zinc/84/43/75/333844375.db2.gz	CTCZWDQLEOTXPT-LLVKDONJSA-N	1	0	288.753	4.202	20	30		CIEDRO
C=CCC[C@H](C)[NH2+]Cc1cccc(C(F)(F)F)c1	ZINC000130513200	333848116	/nfs/dbraw/zinc/84/81/16/333848116.db2.gz	XEWRAXHPCMVTNJ-NSHDSACASA-N	1	0	257.299	4.150	20	30		CIEDRO
CCc1ccc(C[NH2+][C@@H](CCC#N)c2ccccc2)cc1	ZINC000130588614	333854378	/nfs/dbraw/zinc/85/43/78/333854378.db2.gz	KDQVVFREXVNYAR-IBGZPJMESA-N	1	0	278.399	4.384	20	30		CIEDRO
CCOc1cccc([C@@H](C)[NH2+]Cc2ccc(CC#N)cc2)c1	ZINC000543185624	333863041	/nfs/dbraw/zinc/86/30/41/333863041.db2.gz	MDMZQFLRGBJXKH-OAHLLOKOSA-N	1	0	294.398	4.002	20	30		CIEDRO
Cc1cccc([C@H](C)[NH2+]Cc2ccc(CC#N)cc2)c1C	ZINC000543183961	333863219	/nfs/dbraw/zinc/86/32/19/333863219.db2.gz	SUIZOZUBSKZTHB-INIZCTEOSA-N	1	0	278.399	4.220	20	30		CIEDRO
Cc1ccc([C@H](Cc2ccccc2)[NH2+]CCCC#N)cc1C	ZINC000544387943	333928520	/nfs/dbraw/zinc/92/85/20/333928520.db2.gz	PQRJWQHHHYABBQ-FQEVSTJZSA-N	1	0	292.426	4.481	20	30		CIEDRO
C[C@@H]([C@H](C)[NH2+]CCC(C)(C)C#N)C1CCCCC1	ZINC000544421655	333930939	/nfs/dbraw/zinc/93/09/39/333930939.db2.gz	NLHRPHPGQBXIDN-KBPBESRZSA-N	1	0	250.430	4.121	20	30		CIEDRO
C=C(C)C[NH2+][C@@H](C)[C@H](C)c1ccccc1C(F)(F)F	ZINC000544461456	333932554	/nfs/dbraw/zinc/93/25/54/333932554.db2.gz	FRHSYJFIJSDNSC-RYUDHWBXSA-N	1	0	271.326	4.363	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@@H]1CCCO[C@@H]1c1ccc(C)cc1	ZINC000544565159	333935873	/nfs/dbraw/zinc/93/58/73/333935873.db2.gz	JOGBEDKHPIMIRE-CGTJXYLNSA-N	1	0	273.420	4.159	20	30		CIEDRO
CC(C)(C)[C@H]([NH2+]CCCSCC#N)c1ccc(F)cc1	ZINC000072515191	333940199	/nfs/dbraw/zinc/94/01/99/333940199.db2.gz	HUPSTVTYYBAHJN-OAHLLOKOSA-N	1	0	294.439	4.149	20	30		CIEDRO
CC(C)(C#N)CC[N@@H+]1CCC[C@@]1(C)Cc1ccccc1	ZINC000545935070	334007737	/nfs/dbraw/zinc/00/77/37/334007737.db2.gz	HXUFBUQMNJPEAS-SFHVURJKSA-N	1	0	270.420	4.023	20	30		CIEDRO
C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(CC#N)cc2)c2ccccc21	ZINC000576226715	335173687	/nfs/dbraw/zinc/17/36/87/335173687.db2.gz	SNOVUWFBNAFRGJ-FOIQADDNSA-N	1	0	290.410	4.481	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1C[C@@H](c2ccccc2)[C@H]1C)c1ccc(C#N)cc1	ZINC000546621104	334040900	/nfs/dbraw/zinc/04/09/00/334040900.db2.gz	YTZRWAYHTMGVKC-HRYATBACSA-N	1	0	290.410	4.401	20	30		CIEDRO
N#Cc1ccc(C[N@@H+]2CCCC[C@@H]2c2ccccc2)s1	ZINC000546693018	334046332	/nfs/dbraw/zinc/04/63/32/334046332.db2.gz	ZXTBIVBYUQEDRF-QGZVFWFLSA-N	1	0	282.412	4.347	20	30		CIEDRO
CC[C@@H](CC(F)(F)F)[NH2+][C@@H](C)c1ccc(C#N)c(F)c1	ZINC000546870545	334052531	/nfs/dbraw/zinc/05/25/31/334052531.db2.gz	JFUOHIGEXIYXFQ-CABZTGNLSA-N	1	0	288.288	4.079	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H](CC)CC(F)(F)F)cc1	ZINC000546878458	334053339	/nfs/dbraw/zinc/05/33/39/334053339.db2.gz	DRGNUTSGEHLORR-CYBMUJFWSA-N	1	0	287.325	4.072	20	30		CIEDRO
Cc1cccc(C)c1[C@H](C)[NH2+]Cc1ccc(C#N)cc1	ZINC000546883164	334053716	/nfs/dbraw/zinc/05/37/16/334053716.db2.gz	CVOSBEMMEGPAEY-HNNXBMFYSA-N	1	0	264.372	4.026	20	30		CIEDRO
CC[C@H](CC#N)[NH2+]Cc1cccc(-c2ccccc2)c1	ZINC000547286209	334076027	/nfs/dbraw/zinc/07/60/27/334076027.db2.gz	LMGHOWQCBGCXKY-GOSISDBHSA-N	1	0	264.372	4.135	20	30		CIEDRO
C[C@@H]1CC[N@H+](CCC(C)(C)C#N)CC12CCCCC2	ZINC000547315901	334078232	/nfs/dbraw/zinc/07/82/32/334078232.db2.gz	PTNBESJGUIZOOE-OAHLLOKOSA-N	1	0	262.441	4.219	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@H](C)c1ccc(OC)c(Cl)c1	ZINC000547393492	334085423	/nfs/dbraw/zinc/08/54/23/334085423.db2.gz	HSNKHEMGLMDIIO-YPMHNXCESA-N	1	0	267.800	4.354	20	30		CIEDRO
C=C(C[NH2+][C@@H](C)c1cccc(F)c1)c1ccccc1	ZINC000134369918	334089148	/nfs/dbraw/zinc/08/91/48/334089148.db2.gz	RGGCKSJYKUWANP-AWEZNQCLSA-N	1	0	255.336	4.190	20	30		CIEDRO
C=C(C[NH2+][C@H](C)c1ccccc1F)c1ccccc1	ZINC000134369991	334089234	/nfs/dbraw/zinc/08/92/34/334089234.db2.gz	XKLCCATXQMYKKT-CQSZACIVSA-N	1	0	255.336	4.190	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000134732258	334102131	/nfs/dbraw/zinc/10/21/31/334102131.db2.gz	ROZHCURAOPDBRV-GHMZBOCLSA-N	1	0	257.299	4.321	20	30		CIEDRO
Cc1cccc(C2(C[NH2+]Cc3ccc(C#N)o3)CCCC2)c1	ZINC000237931152	334102925	/nfs/dbraw/zinc/10/29/25/334102925.db2.gz	FWUWORRYXOPHRO-UHFFFAOYSA-N	1	0	294.398	4.061	20	30		CIEDRO
C[C@@H](CC#N)[N@H+](C)CC1CCC(c2ccccc2)CC1	ZINC000547749012	334114383	/nfs/dbraw/zinc/11/43/83/334114383.db2.gz	RQZAOVLFJRNRDN-HJOIGYKYSA-N	1	0	270.420	4.194	20	30		CIEDRO
CC(C)CC[C@H]1CCC[N@@H+]1CCCC(C)(C)C#N	ZINC000135312454	334125268	/nfs/dbraw/zinc/12/52/68/334125268.db2.gz	DAHHSHMLBOLXJY-OAHLLOKOSA-N	1	0	250.430	4.217	20	30		CIEDRO
C[C@H]([NH2+]Cc1cccc(C(F)F)c1)c1ccc(C#N)cc1	ZINC000135432701	334129505	/nfs/dbraw/zinc/12/95/05/334129505.db2.gz	HJNKIGDWZUZAMZ-LBPRGKRZSA-N	1	0	286.325	4.347	20	30		CIEDRO
C[C@@H]([NH2+]Cc1cccc(C(F)F)c1)c1ccc(C#N)cc1	ZINC000135432719	334129635	/nfs/dbraw/zinc/12/96/35/334129635.db2.gz	HJNKIGDWZUZAMZ-GFCCVEGCSA-N	1	0	286.325	4.347	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@H](C)c1cccc(OC(F)F)c1	ZINC000135717231	334136901	/nfs/dbraw/zinc/13/69/01/334136901.db2.gz	VTZYFZIFNNWPLN-NWDGAFQWSA-N	1	0	269.335	4.293	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@H](C)c1ccccc1OC(F)F	ZINC000135714852	334136933	/nfs/dbraw/zinc/13/69/33/334136933.db2.gz	PGOQKYOQKURVLG-NWDGAFQWSA-N	1	0	269.335	4.293	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](c1ccccc1)c1ccc(F)cc1	ZINC000135749870	334137960	/nfs/dbraw/zinc/13/79/60/334137960.db2.gz	IMRUNZRZYFJTAH-KSSFIOAISA-N	1	0	269.363	4.469	20	30		CIEDRO
C=C(C)C[N@H+](Cc1ccccc1)Cc1ccc(C#N)cc1	ZINC000548098301	334139936	/nfs/dbraw/zinc/13/99/36/334139936.db2.gz	PLTBGVTWBSTVTD-UHFFFAOYSA-N	1	0	276.383	4.137	20	30		CIEDRO
CC[N@H+](CCC#N)CC1CCC(c2ccccc2)CC1	ZINC000548394679	334154054	/nfs/dbraw/zinc/15/40/54/334154054.db2.gz	BULAFZJBCIWOMM-UHFFFAOYSA-N	1	0	270.420	4.196	20	30		CIEDRO
Cc1ccc(C[C@@H](C)[NH2+][C@H](C)c2cccc(C#N)c2)s1	ZINC000080240697	334168223	/nfs/dbraw/zinc/16/82/23/334168223.db2.gz	BLIYPVXYHMKVDE-TZMCWYRMSA-N	1	0	284.428	4.210	20	30		CIEDRO
Cc1ccc([C@H]2CC[N@H+](CCC(C)(C)C#N)C2)c(C)c1	ZINC000548755495	334170155	/nfs/dbraw/zinc/17/01/55/334170155.db2.gz	ZVROSJQLQGTNJZ-INIZCTEOSA-N	1	0	270.420	4.033	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@@H](C#N)C1)c1ccccc1C(F)(F)F	ZINC000549535661	334196740	/nfs/dbraw/zinc/19/67/40/334196740.db2.gz	IZPNLHVGILRPNU-QJPTWQEYSA-N	1	0	282.309	4.048	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([N@@H+]2CCC[C@H](c3ccc(F)cc3)CC2)C1	ZINC000549537857	334196783	/nfs/dbraw/zinc/19/67/83/334196783.db2.gz	MILUNVIOGKRQEH-RVKKMQEKSA-N	1	0	286.394	4.087	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](C#N)C1)c1ccccc1C(F)(F)F	ZINC000549535663	334196795	/nfs/dbraw/zinc/19/67/95/334196795.db2.gz	IZPNLHVGILRPNU-TUAOUCFPSA-N	1	0	282.309	4.048	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H]1CCN([C@@H](C)c2ccccc2)C1	ZINC000549833067	334206220	/nfs/dbraw/zinc/20/62/20/334206220.db2.gz	LWLFHGOHBFBYQC-FUHWJXTLSA-N	1	0	286.463	4.014	20	30		CIEDRO
CC(C)C[C@H]([NH2+][C@H]1CC[C@@H](C#N)C1)c1cccs1	ZINC000549929985	334209520	/nfs/dbraw/zinc/20/95/20/334209520.db2.gz	CLDPQFQFXRXWMS-RDBSUJKOSA-N	1	0	262.422	4.117	20	30		CIEDRO
CCC1(Cc2ccccc2)CC[NH+]([C@H]2CC[C@@H](C#N)C2)CC1	ZINC000549999682	334210953	/nfs/dbraw/zinc/21/09/53/334210953.db2.gz	IRWCKYVXSNYQAH-MOPGFXCFSA-N	1	0	296.458	4.414	20	30		CIEDRO
CCC1(Cc2ccccc2)CC[NH+]([C@@H]2CC[C@@H](C#N)C2)CC1	ZINC000549999685	334211165	/nfs/dbraw/zinc/21/11/65/334211165.db2.gz	IRWCKYVXSNYQAH-RTBURBONSA-N	1	0	296.458	4.414	20	30		CIEDRO
C[C@H]([NH2+]C[C@@H](c1ccccc1)C1CC1)c1ccc(C#N)cc1	ZINC000550846853	334230128	/nfs/dbraw/zinc/23/01/28/334230128.db2.gz	ISNVTFTXZIHXRH-YWZLYKJASA-N	1	0	290.410	4.403	20	30		CIEDRO
C[C@H]([NH2+]C[C@H](c1ccccc1)C1CC1)c1cccc(C#N)c1	ZINC000550847936	334230149	/nfs/dbraw/zinc/23/01/49/334230149.db2.gz	QMUJAUSGELHSHB-MGPUTAFESA-N	1	0	290.410	4.403	20	30		CIEDRO
N#CC1CCC(C[NH2+][C@H]2CCCC23CCCC3)CC1	ZINC000551176351	334239993	/nfs/dbraw/zinc/23/99/93/334239993.db2.gz	STOFHJCJWXMANE-GPANFISMSA-N	1	0	260.425	4.019	20	30		CIEDRO
C[C@H]([NH2+]Cc1coc2ccccc12)c1ccc(C#N)cc1F	ZINC000551205931	334240762	/nfs/dbraw/zinc/24/07/62/334240762.db2.gz	OIBCZEUHFVISIJ-LBPRGKRZSA-N	1	0	294.329	4.294	20	30		CIEDRO
CC[C@H]1CC[C@H]([NH2+][C@@H](C)c2cccc(C#N)c2)CC1	ZINC000551211992	334241028	/nfs/dbraw/zinc/24/10/28/334241028.db2.gz	OYHDFRSBTZMYMJ-ZQIUZPCESA-N	1	0	256.393	4.178	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H](CC(C)C)c1ccccn1	ZINC000551240601	334242446	/nfs/dbraw/zinc/24/24/46/334242446.db2.gz	OHCHSPKTBKEUAY-INIZCTEOSA-N	1	0	260.425	4.361	20	30		CIEDRO
N#Cc1cccc(C2([NH2+][C@H]3CCC[C@@H](C4CC4)C3)CC2)c1	ZINC000551551484	334253859	/nfs/dbraw/zinc/25/38/59/334253859.db2.gz	BAPFNYRTLAFQPJ-AEFFLSMTSA-N	1	0	280.415	4.106	20	30		CIEDRO
CC(C)Cc1cccc([C@@H](C)[NH2+]CCCCC#N)c1	ZINC000552047114	334281173	/nfs/dbraw/zinc/28/11/73/334281173.db2.gz	AFCJVRGRFWDFPY-OAHLLOKOSA-N	1	0	258.409	4.230	20	30		CIEDRO
C=CCCCC[NH2+][C@@H](C)c1ccc(OC)c(OC)c1C	ZINC000552067699	334285017	/nfs/dbraw/zinc/28/50/17/334285017.db2.gz	UWYXJGMUWDJPDL-AWEZNQCLSA-N	1	0	277.408	4.019	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+]CCCc1cccc(C)n1	ZINC000552088496	334287884	/nfs/dbraw/zinc/28/78/84/334287884.db2.gz	KZJFRCWTPNSXJF-INIZCTEOSA-N	1	0	260.425	4.047	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CC1CCC(OC)CC1)c1ccco1	ZINC000552246153	334307805	/nfs/dbraw/zinc/30/78/05/334307805.db2.gz	KKJKWZFACNQNCJ-UYSNPLJNSA-N	1	0	277.408	4.082	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C1CCC(F)(F)CC1)c1ccco1	ZINC000552275242	334311385	/nfs/dbraw/zinc/31/13/85/334311385.db2.gz	OWFMLKUWEGEVSN-CYBMUJFWSA-N	1	0	269.335	4.454	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCC[C@H]1CCCC[C@@H]1O)c1ccco1	ZINC000552276112	334311774	/nfs/dbraw/zinc/31/17/74/334311774.db2.gz	LCRYOKRXNVINDY-IKGGRYGDSA-N	1	0	291.435	4.208	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2)C1	ZINC000248752208	334316028	/nfs/dbraw/zinc/31/60/28/334316028.db2.gz	FXNFEYLOLGOTNT-AKHDSKFASA-N	1	0	282.431	4.070	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)c1ccc(Cl)cc1	ZINC000248840469	334319273	/nfs/dbraw/zinc/31/92/73/334319273.db2.gz	NRHOXFCUPBXHGG-YWPYICTPSA-N	1	0	262.784	4.073	20	30		CIEDRO
CCC[C@H](Cc1ccccc1)[NH2+][C@@H]1CCC[C@@H](C#N)C1	ZINC000248850903	334319799	/nfs/dbraw/zinc/31/97/99/334319799.db2.gz	OSGLQAMONNNPHS-KZNAEPCWSA-N	1	0	270.420	4.070	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@@H](Cc3ccccc3)C2)C1	ZINC000248887206	334320812	/nfs/dbraw/zinc/32/08/12/334320812.db2.gz	MMKOHBBEDFXHOD-ZSYWTGECSA-N	1	0	282.431	4.070	20	30		CIEDRO
CC(C)[C@H](C[NH2+][C@@H]1CCC[C@@H](C#N)C1)c1ccccc1	ZINC000248907245	334321543	/nfs/dbraw/zinc/32/15/43/334321543.db2.gz	UZAJRQHENOKDBR-NXHRZFHOSA-N	1	0	270.420	4.098	20	30		CIEDRO
CC(C)Oc1cccc([C@H](C)[NH2+][C@H]2CCC[C@@H](C#N)C2)c1	ZINC000248923802	334322035	/nfs/dbraw/zinc/32/20/35/334322035.db2.gz	WXIOKJFLQSYHQI-UXLLHSPISA-N	1	0	286.419	4.207	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@H]1CCO[C@@H](c2ccccc2)C1)C1CC1	ZINC000248940362	334322445	/nfs/dbraw/zinc/32/24/45/334322445.db2.gz	YSNGYUZJWZRJJF-GBESFXJTSA-N	1	0	285.431	4.241	20	30		CIEDRO
CC[C@H](CSc1ccccc1)[NH2+][C@H]1CCC[C@@H](C#N)C1	ZINC000249052848	334326016	/nfs/dbraw/zinc/32/60/16/334326016.db2.gz	XZROQYLKRPABQY-OAGGEKHMSA-N	1	0	288.460	4.229	20	30		CIEDRO
N#Cc1ccccc1-c1ccc(C[NH2+]Cc2ccco2)cc1	ZINC000091068118	334371647	/nfs/dbraw/zinc/37/16/47/334371647.db2.gz	XXHYLWKPVMCKMX-UHFFFAOYSA-N	1	0	288.350	4.108	20	30		CIEDRO
CC(C)CC[C@H]1CCC[C@@H]1[NH2+]CCC(C)(C)C#N	ZINC000554265017	334418904	/nfs/dbraw/zinc/41/89/04/334418904.db2.gz	XXDZOELCDJAFQI-CABCVRRESA-N	1	0	250.430	4.121	20	30		CIEDRO
CC(C)CC[C@@H]1CCC[C@@H]1[NH2+]CCC(C)(C)C#N	ZINC000554265193	334419028	/nfs/dbraw/zinc/41/90/28/334419028.db2.gz	XXDZOELCDJAFQI-GJZGRUSLSA-N	1	0	250.430	4.121	20	30		CIEDRO
CCCC[C@H]1CCC[C@H]1[NH2+]CC(C)(C)CCC#N	ZINC000554360160	334424007	/nfs/dbraw/zinc/42/40/07/334424007.db2.gz	BGQWEMNHWBBUSF-LSDHHAIUSA-N	1	0	250.430	4.265	20	30		CIEDRO
C[C@@H]([NH2+]CC(C)(C)CCC#N)[C@@H](C)c1ccccc1	ZINC000554358619	334424009	/nfs/dbraw/zinc/42/40/09/334424009.db2.gz	HQBCLHRMEDFRRH-HUUCEWRRSA-N	1	0	258.409	4.098	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H]1CCc2c1ccc(OC)c2F	ZINC000554739492	334450237	/nfs/dbraw/zinc/45/02/37/334450237.db2.gz	YIRILSMVTADWHN-SWLSCSKDSA-N	1	0	277.383	4.156	20	30		CIEDRO
C=CC[C@@H](C)[NH2+]C[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000556242645	334502988	/nfs/dbraw/zinc/50/29/88/334502988.db2.gz	RFNRTFWUWSUZJW-VXGBXAGGSA-N	1	0	271.326	4.363	20	30		CIEDRO
CCSc1ccc([C@H](C)[NH2+][C@H]2CC[C@H](C#N)C2)cc1	ZINC000565110845	334539214	/nfs/dbraw/zinc/53/92/14/334539214.db2.gz	GMHYCOXYYABPQA-YDHLFZDLSA-N	1	0	274.433	4.141	20	30		CIEDRO
C=C(C)CN1CCC([NH2+][C@@H](C)c2ccc(Cl)cc2)CC1	ZINC000153027182	334543582	/nfs/dbraw/zinc/54/35/82/334543582.db2.gz	GPJHLXAJDNEOHB-AWEZNQCLSA-N	1	0	292.854	4.031	20	30		CIEDRO
C=CCCCCC[NH2+][C@@H](C)c1ccc(NC(C)=O)cc1	ZINC000565217072	334545637	/nfs/dbraw/zinc/54/56/37/334545637.db2.gz	GQJUAUNOESVLRB-AWEZNQCLSA-N	1	0	274.408	4.042	20	30		CIEDRO
C[C@@H](CCc1ccccc1)C[NH2+]CC(C)(C)CCC#N	ZINC000565913748	334608378	/nfs/dbraw/zinc/60/83/78/334608378.db2.gz	RCYPVSMWPKOKBE-INIZCTEOSA-N	1	0	272.436	4.175	20	30		CIEDRO
Cc1ccccc1[C@H]([NH2+]C[C@H](C#N)CCC#N)C(C)(C)C	ZINC000566112736	334624147	/nfs/dbraw/zinc/62/41/47/334624147.db2.gz	RQPIJJDCLHBVGF-RDJZCZTQSA-N	1	0	283.419	4.115	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccc(CC#N)cc1)c1ccsc1	ZINC000566219809	334636682	/nfs/dbraw/zinc/63/66/82/334636682.db2.gz	FPBCULGEFHZJCS-MRXNPFEDSA-N	1	0	270.401	4.055	20	30		CIEDRO
C[C@H]([NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccccc1)c1ccc(C#N)cc1	ZINC000567371486	334710016	/nfs/dbraw/zinc/71/00/16/334710016.db2.gz	ZVCPESVKNUPCFC-SLUIBLPYSA-N	1	0	290.410	4.401	20	30		CIEDRO
C[C@@H]([NH2+][C@H](C)[C@@H]1C[C@H]1c1ccccc1)c1ccc(C#N)cc1	ZINC000567371484	334710044	/nfs/dbraw/zinc/71/00/44/334710044.db2.gz	ZVCPESVKNUPCFC-IPZZXCBHSA-N	1	0	290.410	4.401	20	30		CIEDRO
C[C@@H]([NH2+]CCCC#N)c1cc(Cl)sc1Cl	ZINC000273278588	334763749	/nfs/dbraw/zinc/76/37/49/334763749.db2.gz	PYKYOJRGOCSWAG-SSDOTTSWSA-N	1	0	263.193	4.009	20	30		CIEDRO
C[C@@H]([NH2+]C1CCC(C#N)(c2ccccc2)CC1)C(C)(C)C	ZINC000568052249	334788073	/nfs/dbraw/zinc/78/80/73/334788073.db2.gz	TYYQTIFGBIXMGK-LSJNQWAISA-N	1	0	284.447	4.415	20	30		CIEDRO
C=CCCCCC[NH2+][C@H](C)c1cncc(Br)c1	ZINC000568276412	334811692	/nfs/dbraw/zinc/81/16/92/334811692.db2.gz	KMLCUSGJRDWXSB-GFCCVEGCSA-N	1	0	297.240	4.241	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccc(C#N)s1)c1ccccc1	ZINC000158828542	334814580	/nfs/dbraw/zinc/81/45/80/334814580.db2.gz	RTTFMMFFDGYVAT-QGZVFWFLSA-N	1	0	282.412	4.417	20	30		CIEDRO
CC1(C[NH2+]Cc2ccc(-c3ccccc3C#N)cc2)CC1	ZINC000568463482	334826012	/nfs/dbraw/zinc/82/60/12/334826012.db2.gz	NDCKREXHFDEAEJ-UHFFFAOYSA-N	1	0	276.383	4.115	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H](C)c1ccc(-n2ccnc2C)cc1	ZINC000572862293	334885576	/nfs/dbraw/zinc/88/55/76/334885576.db2.gz	XVQUZCJXFKTQPU-OAHLLOKOSA-N	1	0	297.446	4.434	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](Cc1ccccc1Cl)C1CC1	ZINC000576722257	335240206	/nfs/dbraw/zinc/24/02/06/335240206.db2.gz	JXWZVZVRPHVXIS-WBMJQRKESA-N	1	0	263.812	4.215	20	30		CIEDRO
N#CCC[C@@H](C#N)C[NH2+][C@@H](c1ccc(F)cc1)C1CCCC1	ZINC000576979575	335272677	/nfs/dbraw/zinc/27/26/77/335272677.db2.gz	GUKIRKMIZXQDCZ-KBXCAEBGSA-N	1	0	299.393	4.090	20	30		CIEDRO
C[C@H](CCC#N)[NH+]1CCC(c2ccnc3ccccc32)CC1	ZINC000580567101	335283467	/nfs/dbraw/zinc/28/34/67/335283467.db2.gz	OUKBBKKNAANPJA-OAHLLOKOSA-N	1	0	293.414	4.106	20	30		CIEDRO
C=CCC[C@H](C)[NH2+]C[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000577028282	335284581	/nfs/dbraw/zinc/28/45/81/335284581.db2.gz	BPJUVQMQTBOKTI-DZGCQCFKSA-N	1	0	285.353	4.352	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H](C)CCCC(F)(F)F	ZINC000380027957	335298859	/nfs/dbraw/zinc/29/88/59/335298859.db2.gz	OFZLAEWRUWKRBD-LLVKDONJSA-N	1	0	251.336	4.299	20	30		CIEDRO
C[N@H+](Cc1ccc(C#N)c(F)c1)[C@@H]1CCCc2ccccc21	ZINC000577255656	335330521	/nfs/dbraw/zinc/33/05/21/335330521.db2.gz	CWCZQVQZDUTGFV-LJQANCHMSA-N	1	0	294.373	4.207	20	30		CIEDRO
Cc1ccccc1[C@H]([NH2+]Cc1ccc(C#N)s1)C(C)C	ZINC000176968537	335349072	/nfs/dbraw/zinc/34/90/72/335349072.db2.gz	GCEAMJZYBCXTGS-QGZVFWFLSA-N	1	0	284.428	4.415	20	30		CIEDRO
CSc1ccc(C[NH2+][C@H]2CCc3ccc(C#N)cc32)cc1	ZINC000577493945	335358920	/nfs/dbraw/zinc/35/89/20/335358920.db2.gz	RYRISGOAJWXVFX-SFHVURJKSA-N	1	0	294.423	4.057	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H]2CCCCc3ccccc32)c(F)c1	ZINC000177447209	335372341	/nfs/dbraw/zinc/37/23/41/335372341.db2.gz	HKDOQEFNELQCMH-IBGZPJMESA-N	1	0	294.373	4.255	20	30		CIEDRO
CCc1ccc(C(C)(C)[NH2+]Cc2ccc(C#N)s2)cc1	ZINC000177597656	335375602	/nfs/dbraw/zinc/37/56/02/335375602.db2.gz	DVSPVWGHXSMSSN-UHFFFAOYSA-N	1	0	284.428	4.207	20	30		CIEDRO
N#Cc1csc(C[NH2+][C@@H]2CCc3cc(Cl)ccc32)c1	ZINC000177692073	335379165	/nfs/dbraw/zinc/37/91/65/335379165.db2.gz	GVSQTMIARKQLNX-OAHLLOKOSA-N	1	0	288.803	4.050	20	30		CIEDRO
C[C@@H]([NH2+]Cc1cc(C#N)cs1)C(C)(C)c1ccccc1	ZINC000177695722	335379783	/nfs/dbraw/zinc/37/97/83/335379783.db2.gz	MDGRNRFGZCPCOU-CYBMUJFWSA-N	1	0	284.428	4.076	20	30		CIEDRO
C=CCCC[NH2+]Cc1cn(-c2ccccc2)nc1C(C)C	ZINC000577695430	335389631	/nfs/dbraw/zinc/38/96/31/335389631.db2.gz	TUGZBMNVCHTOFJ-UHFFFAOYSA-N	1	0	283.419	4.052	20	30		CIEDRO
CC(C)(C#N)CCC[NH2+]C(C)(C)c1cccc(Cl)c1	ZINC000179600237	335503352	/nfs/dbraw/zinc/50/33/52/335503352.db2.gz	NRGRLYGHSZGIQS-UHFFFAOYSA-N	1	0	278.827	4.495	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)[C@@H](C)c1nc2ccccc2s1	ZINC000180948237	335630633	/nfs/dbraw/zinc/63/06/33/335630633.db2.gz	LPKCHAPYNAVLRA-XQQFMLRXSA-N	1	0	274.433	4.343	20	30		CIEDRO
C[C@@H](C[NH2+][C@@H]1CCc2ccc(C#N)cc21)c1ccc(F)cc1	ZINC000579178681	335718377	/nfs/dbraw/zinc/71/83/77/335718377.db2.gz	HBLBKEYGRQYDNH-ORAYPTAESA-N	1	0	294.373	4.078	20	30		CIEDRO
C[C@H]([NH2+]CCCC#N)c1ccc(Oc2ccccc2)cc1	ZINC000181817396	335786800	/nfs/dbraw/zinc/78/68/00/335786800.db2.gz	WQTSETMXVYTSRG-HNNXBMFYSA-N	1	0	280.371	4.433	20	30		CIEDRO
CCC[C@@H]([NH2+]CCCC#N)c1cccc(C(F)(F)F)c1	ZINC000181869767	335789404	/nfs/dbraw/zinc/78/94/04/335789404.db2.gz	FUKVDXXTKFUACT-CQSZACIVSA-N	1	0	284.325	4.440	20	30		CIEDRO
CC[C@@H](C)[C@@H](C)[NH2+]Cc1ccccc1C(C)(C)C#N	ZINC000183045120	335856758	/nfs/dbraw/zinc/85/67/58/335856758.db2.gz	VMDILYOMTISUSY-ZIAGYGMSSA-N	1	0	258.409	4.012	20	30		CIEDRO
N#Cc1ccc(F)c(C[NH2+]C2(c3ccccc3)CCCC2)c1	ZINC000183535184	335896490	/nfs/dbraw/zinc/89/64/90/335896490.db2.gz	LVUCLKSVTXSOQL-UHFFFAOYSA-N	1	0	294.373	4.256	20	30		CIEDRO
C=CCCCCC[NH2+][C@@H](C)c1ccc(Cl)cn1	ZINC000580844405	335974803	/nfs/dbraw/zinc/97/48/03/335974803.db2.gz	PEFXFVADOOQKMT-LBPRGKRZSA-N	1	0	252.789	4.132	20	30		CIEDRO
CC[C@H]([NH2+]C1CCC2(CC2)CC1)c1ccc(C#N)cc1	ZINC000581051589	336001139	/nfs/dbraw/zinc/00/11/39/336001139.db2.gz	PRVCQCUMDNNBKE-KRWDZBQOSA-N	1	0	268.404	4.322	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CCCCC23CCCC3)cc1	ZINC000380610199	336006976	/nfs/dbraw/zinc/00/69/76/336006976.db2.gz	DYXAHMKGUWNLAM-QGZVFWFLSA-N	1	0	268.404	4.151	20	30		CIEDRO
Cc1ccc([C@@H](C)[NH2+][C@H]2CCc3ccc(C#N)cc32)cc1	ZINC000581160753	336017069	/nfs/dbraw/zinc/01/70/69/336017069.db2.gz	JMEFOHPNRYQPAR-KUHUBIRLSA-N	1	0	276.383	4.205	20	30		CIEDRO
C[C@H]1C[C@@H](C(C)(C)C)CC[N@@H+]1CCCC(C)(C)C#N	ZINC000581241673	336029938	/nfs/dbraw/zinc/02/99/38/336029938.db2.gz	MOFXRAXWZHYPDH-GJZGRUSLSA-N	1	0	264.457	4.463	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([N@@H+]2CCCC3(C2)CCCCCC3)C1	ZINC000581595881	336108940	/nfs/dbraw/zinc/10/89/40/336108940.db2.gz	ACCGXJLUAUCNQU-JKSUJKDBSA-N	1	0	260.425	4.115	20	30		CIEDRO
CC[C@H](CC#N)[NH2+][C@@H]1C[C@@H](C)C[C@H](c2ccccc2)C1	ZINC000383530509	336112381	/nfs/dbraw/zinc/11/23/81/336112381.db2.gz	AUOWQBLGNMVVIF-DZJNRPSUSA-N	1	0	270.420	4.241	20	30		CIEDRO
C[C@@H]([NH2+][C@H](C)c1ccc2c(c1)CCC2)c1ccc(C#N)cc1	ZINC000387245218	336190508	/nfs/dbraw/zinc/19/05/08/336190508.db2.gz	BVAUYUZVPOFLBK-HUUCEWRRSA-N	1	0	290.410	4.459	20	30		CIEDRO
C[C@H]([NH2+]CC1CCC(C#N)CC1)c1cc(F)c(F)c(F)c1	ZINC000442870891	533837877	/nfs/dbraw/zinc/83/78/77/533837877.db2.gz	DVXIMEXJUNSVTC-UNXYVOJBSA-N	1	0	296.336	4.084	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccc(CC)cn1)c1ccccc1	ZINC000411468877	517329420	/nfs/dbraw/zinc/32/94/20/517329420.db2.gz	DRWYBKSWZXEWCM-LJQANCHMSA-N	1	0	280.415	4.441	20	30		CIEDRO
C=CCCC[NH2+][C@H](C)c1sc(-c2cccnc2)nc1C	ZINC000279894978	518702851	/nfs/dbraw/zinc/70/28/51/518702851.db2.gz	GTPHVTTYKNVIOY-GFCCVEGCSA-N	1	0	287.432	4.130	20	30		CIEDRO
CC(C)(C)c1ccc(C[NH2+]Cc2ccc(C#N)cc2)cc1	ZINC000037505845	519031639	/nfs/dbraw/zinc/03/16/39/519031639.db2.gz	YCPFDTKBCQIBFU-UHFFFAOYSA-N	1	0	278.399	4.146	20	30		CIEDRO
CC[C@H]([NH2+]C1(c2cccc(F)c2)CC1)c1ccc(C#N)cc1	ZINC000278633878	522560902	/nfs/dbraw/zinc/56/09/02/522560902.db2.gz	HETXQVNSHDMYOW-SFHVURJKSA-N	1	0	294.373	4.427	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(C)s1)c1ccc(C#N)cc1	ZINC000278319397	522645722	/nfs/dbraw/zinc/64/57/22/522645722.db2.gz	UUNPROXZYKJXGF-INIZCTEOSA-N	1	0	270.401	4.169	20	30		CIEDRO
CC[C@H]([NH2+]Cc1cccc(C)c1)c1ccc(C#N)cc1	ZINC000278266405	522651517	/nfs/dbraw/zinc/65/15/17/522651517.db2.gz	OLGOZRTUMDMKFX-SFHVURJKSA-N	1	0	264.372	4.108	20	30		CIEDRO
CC[C@H]([NH2+][C@H](C)c1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000036991921	522738161	/nfs/dbraw/zinc/73/81/61/522738161.db2.gz	MEWWPBKVAVUHQE-ACJLOTCBSA-N	1	0	282.362	4.499	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CCOC2(CCCC2)C1)c1ccc(C#N)cc1	ZINC000278618452	522756442	/nfs/dbraw/zinc/75/64/42/522756442.db2.gz	GBPIAILKZRJTEA-ROUUACIJSA-N	1	0	298.430	4.091	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H](CC)c1ccc(C#N)cc1)c1ccncc1	ZINC000278747713	522920702	/nfs/dbraw/zinc/92/07/02/522920702.db2.gz	NROGKRHJRBAUAR-ZWKOTPCHSA-N	1	0	279.387	4.145	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc([C@H]2C[C@H]2C)o1)c1ccc(C#N)cc1	ZINC000035256421	525450424	/nfs/dbraw/zinc/45/04/24/525450424.db2.gz	GVTUZJOBGUOVIL-IGCXYCKISA-N	1	0	280.371	4.125	20	30		CIEDRO
Cc1cc([C@@H](C)[NH2+]Cc2cc(C#N)ccc2F)c(C)s1	ZINC000047943999	525465345	/nfs/dbraw/zinc/46/53/45/525465345.db2.gz	KNUIKVCCFCZGBP-LLVKDONJSA-N	1	0	288.391	4.227	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C2CC2)cc1F)c1ccc(C#N)cc1	ZINC000293341667	525521778	/nfs/dbraw/zinc/52/17/78/525521778.db2.gz	GPEGESIYBYPIOD-CYBMUJFWSA-N	1	0	294.373	4.426	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cn1)c1ccc(C#N)cc1	ZINC000274972899	525607610	/nfs/dbraw/zinc/60/76/10/525607610.db2.gz	YHXMWBCDFOILHL-NEPJUHHUSA-N	1	0	285.778	4.018	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCC[C@H](C(F)(F)F)C1)c1ccc(C#N)cc1	ZINC000037141905	525611560	/nfs/dbraw/zinc/61/15/60/525611560.db2.gz	CTZDYXMTGBEZHT-CQDKDKBSSA-N	1	0	296.336	4.330	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CSc2ccccc21)c1ccc(C#N)cc1	ZINC000155887202	525651960	/nfs/dbraw/zinc/65/19/60/525651960.db2.gz	MYRBDXPWTGWSKA-MLGOLLRUSA-N	1	0	280.396	4.056	20	30		CIEDRO
Cc1ccc([C@@H](C)[NH2+]Cc2cccc(C#N)c2)c(C)c1	ZINC000037748722	525734627	/nfs/dbraw/zinc/73/46/27/525734627.db2.gz	GXZKMOFIOQDXKJ-OAHLLOKOSA-N	1	0	264.372	4.026	20	30		CIEDRO
Cc1ccsc1[C@H](C)[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000070090731	525888408	/nfs/dbraw/zinc/88/84/08/525888408.db2.gz	LMMJQPDYMOOTFD-OLZOCXBDSA-N	1	0	270.401	4.340	20	30		CIEDRO
Cc1ccc([C@H](C)[NH2+]Cc2ccc(C#N)cc2)c(C)c1	ZINC000037748286	525927670	/nfs/dbraw/zinc/92/76/70/525927670.db2.gz	POGIBEGAYYCMBC-HNNXBMFYSA-N	1	0	264.372	4.026	20	30		CIEDRO
Cc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)CC2	ZINC000097988417	526193105	/nfs/dbraw/zinc/19/31/05/526193105.db2.gz	PALZNZOUGJZRKP-LIRRHRJNSA-N	1	0	276.383	4.205	20	30		CIEDRO
N#Cc1cccc(C2([NH2+]Cc3cc(Cl)cs3)CC2)c1	ZINC000278492676	526701050	/nfs/dbraw/zinc/70/10/50/526701050.db2.gz	MFFWBJIXQGHPCG-UHFFFAOYSA-N	1	0	288.803	4.052	20	30		CIEDRO
C=C(C)[C@@H]([NH2+][C@H]1C[C@@H](C)O[C@@H](C)C1)c1ccc(F)c(F)c1	ZINC000294676677	526758341	/nfs/dbraw/zinc/75/83/41/526758341.db2.gz	SGSNTUWILJWSOB-CXUUEIJPSA-N	1	0	295.373	4.128	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+][C@H](CCC(C)C)c1ccoc1	ZINC000353589427	526803374	/nfs/dbraw/zinc/80/33/74/526803374.db2.gz	GISLZIFSAVROFQ-JQHSSLGASA-N	1	0	291.435	4.328	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1CCCCc2ccccc21	ZINC000348219183	527000779	/nfs/dbraw/zinc/00/07/79/527000779.db2.gz	SMKLXUUYYFEWFA-QGZVFWFLSA-N	1	0	270.420	4.374	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@@H](CC)c1ccc(OC)c(OC)c1	ZINC000353846750	527141912	/nfs/dbraw/zinc/14/19/12/527141912.db2.gz	RDWLZRZPMNMLBH-DZKIICNBSA-N	1	0	291.435	4.345	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@H]1CCOc2c(C)cccc21	ZINC000353311395	527142076	/nfs/dbraw/zinc/14/20/76/527142076.db2.gz	ZRRGSGYXPMBLOD-NOLJZWGESA-N	1	0	259.393	4.009	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CC1([C@@H](C)CCO)CCC1)c1ccco1	ZINC000353618914	527448340	/nfs/dbraw/zinc/44/83/40/527448340.db2.gz	HAEGMQCDXGEJAF-JKSUJKDBSA-N	1	0	291.435	4.065	20	30		CIEDRO
C=CCC[C@H]([NH2+]CC1([C@H](C)CCO)CCC1)c1ccco1	ZINC000353618911	527483604	/nfs/dbraw/zinc/48/36/04/527483604.db2.gz	HAEGMQCDXGEJAF-CVEARBPZSA-N	1	0	291.435	4.065	20	30		CIEDRO
CC(C)(C)C[C@@H]([NH2+]CC1(C#N)CC1)c1ccc(F)cc1	ZINC000343562305	527694030	/nfs/dbraw/zinc/69/40/30/527694030.db2.gz	JQUIXJIAYJMJBA-OAHLLOKOSA-N	1	0	274.383	4.196	20	30		CIEDRO
CC(C)C[C@@H](C)C[C@H](C)[NH2+]CC1CCC(C#N)CC1	ZINC000442875701	528254569	/nfs/dbraw/zinc/25/45/69/528254569.db2.gz	WNWGOAPDCMSGCF-XNIRIUNOSA-N	1	0	264.457	4.367	20	30		CIEDRO
CC1(C)CC[C@H]([NH2+]Cc2cccc(OCCCC#N)c2)C1	ZINC000350661460	529047938	/nfs/dbraw/zinc/04/79/38/529047938.db2.gz	QCBZNHQMGBIZSB-INIZCTEOSA-N	1	0	286.419	4.037	20	30		CIEDRO
CC[C@H]([NH2+]CC1CCC(C#N)CC1)c1cc(F)ccc1F	ZINC000442865479	529593886	/nfs/dbraw/zinc/59/38/86/529593886.db2.gz	IJQHYKLXZJWIKE-FVKWTLKZSA-N	1	0	292.373	4.335	20	30		CIEDRO
Cc1ccccc1C[C@H]([NH2+]CC1CCC(C#N)CC1)C1CC1	ZINC000573393307	334934878	/nfs/dbraw/zinc/93/48/78/334934878.db2.gz	XZNXRWKCGIVOJZ-UHYCVJNDSA-N	1	0	296.458	4.236	20	30		CIEDRO
CCc1nc2c(s1)[C@@H]([NH2+]CC(C)(C)CCC#N)CCC2	ZINC000348210480	529747552	/nfs/dbraw/zinc/74/75/52/529747552.db2.gz	CPADHIULJDCUJN-LBPRGKRZSA-N	1	0	291.464	4.002	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(CC#N)cc1)c1cc2c(s1)CCC2	ZINC000573488554	334941906	/nfs/dbraw/zinc/94/19/06/334941906.db2.gz	MXCQVRAGGZFFDJ-CYBMUJFWSA-N	1	0	296.439	4.154	20	30		CIEDRO
C=CCCCCC[NH2+][C@H](C)CC(=O)Nc1ccccc1C	ZINC000573624776	334953042	/nfs/dbraw/zinc/95/30/42/334953042.db2.gz	RKZWMPXPODCKEW-MRXNPFEDSA-N	1	0	288.435	4.048	20	30		CIEDRO
CC(C)=CCC[C@H](C)[NH2+][C@H](C)c1cccc(C#N)c1	ZINC000573996389	334983750	/nfs/dbraw/zinc/98/37/50/334983750.db2.gz	OQAJDZWLKOMGBS-LSDHHAIUSA-N	1	0	256.393	4.344	20	30		CIEDRO
N#CCCCC[NH2+][C@H](c1cccs1)C1CCCC1	ZINC000093405023	260517102	/nfs/dbraw/zinc/51/71/02/260517102.db2.gz	GYKRVEBSOWHINH-HNNXBMFYSA-N	1	0	262.422	4.263	20	30		CIEDRO
CC(C)C[C@@H]([NH2+]Cc1ccc(CC#N)cc1)c1ccccn1	ZINC000574074475	334989998	/nfs/dbraw/zinc/98/99/98/334989998.db2.gz	RWVALVPTZMAKAC-LJQANCHMSA-N	1	0	293.414	4.025	20	30		CIEDRO
CC(C)(C)[C@@H](CC1CCCCC1)[NH2+]C[C@@H](C#N)CCC#N	ZINC000574392687	335015617	/nfs/dbraw/zinc/01/56/17/335015617.db2.gz	ASGQNEHMUKPDKG-IAGOWNOFSA-N	1	0	289.467	4.405	20	30		CIEDRO
C=CCCCC[NH2+][C@@H](c1nccs1)c1ccccc1	ZINC000574520027	335026096	/nfs/dbraw/zinc/02/60/96/335026096.db2.gz	ZGXDPTYUIVLLGE-OAHLLOKOSA-N	1	0	272.417	4.178	20	30		CIEDRO
C=CCCC[NH2+][C@@H]1C[C@@H](C)Sc2sccc21	ZINC000336665776	262377908	/nfs/dbraw/zinc/37/79/08/262377908.db2.gz	JQWFZJYYDNUESW-ZYHUDNBSSA-N	1	0	253.436	4.229	20	30		CIEDRO
N#Cc1ccc2c(c1)CCC[C@@H]2[NH2+]Cc1cccc(Cl)c1	ZINC000341760464	130026838	/nfs/dbraw/zinc/02/68/38/130026838.db2.gz	ZBOUJNQLMWHTRZ-SFHVURJKSA-N	1	0	296.801	4.379	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@H](C)c1ccccc1	ZINC000006587457	170216861	/nfs/dbraw/zinc/21/68/61/170216861.db2.gz	KGXAWXKBVOQQBC-OAHLLOKOSA-N	1	0	267.372	4.102	20	30		CIEDRO
Cc1ccccc1[C@H](C)[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000020126164	171009653	/nfs/dbraw/zinc/00/96/53/171009653.db2.gz	AFJNXLVVQQYSLQ-CABCVRRESA-N	1	0	264.372	4.279	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1cccs1)c1ccc(C#N)cc1	ZINC000020148255	171036368	/nfs/dbraw/zinc/03/63/68/171036368.db2.gz	LGCNLTREJSCQLD-NEPJUHHUSA-N	1	0	256.374	4.032	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(Cl)s1)c1ccc(C#N)cc1	ZINC000035256313	172086211	/nfs/dbraw/zinc/08/62/11/172086211.db2.gz	ZBMOYDPBYKTAKM-JTQLQIEISA-N	1	0	276.792	4.124	20	30		CIEDRO
C[C@@H]([NH2+]Cc1cccc(Cl)c1)c1ccc(C#N)cc1	ZINC000035256320	172086275	/nfs/dbraw/zinc/08/62/75/172086275.db2.gz	LIACJUXMQYVBKX-GFCCVEGCSA-N	1	0	270.763	4.062	20	30		CIEDRO
C[C@@H]([NH2+]CCC1CCCCC1)c1ccc(C#N)cc1	ZINC000037739882	173660068	/nfs/dbraw/zinc/66/00/68/173660068.db2.gz	RTYMNNOGJRMXRD-CQSZACIVSA-N	1	0	256.393	4.179	20	30		CIEDRO
N#Cc1cccc(C[N@@H+]2CCCCC[C@H]2c2ccco2)c1	ZINC000078831137	177395416	/nfs/dbraw/zinc/39/54/16/177395416.db2.gz	XRUJJSYRYXSNDI-KRWDZBQOSA-N	1	0	280.371	4.269	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1cccs1)c1ccc(OCC#N)cc1	ZINC000037235044	260076577	/nfs/dbraw/zinc/07/65/77/260076577.db2.gz	UCTIZMHRHQAHQC-OLZOCXBDSA-N	1	0	286.400	4.062	20	30		CIEDRO
N#CCCC[C@H]([NH2+]C[C@@H]1CC=CCC1)c1ccccc1	ZINC000353918567	226427731	/nfs/dbraw/zinc/42/77/31/226427731.db2.gz	YOFPDWZDUJJWOH-AEFFLSMTSA-N	1	0	268.404	4.367	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+]C2CCC(c3ccccc3)CC2)C1	ZINC000192634150	228200584	/nfs/dbraw/zinc/20/05/84/228200584.db2.gz	XLHSOFGTIAQOQE-HJZRJOMTSA-N	1	0	282.431	4.385	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1cccc(C#N)c1)c1cccc(Cl)c1	ZINC000036921337	260051691	/nfs/dbraw/zinc/05/16/91/260051691.db2.gz	WXNQWASANGMNIS-QGZVFWFLSA-N	1	0	284.790	4.453	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@@H](OCC)c1ccccc1)C1CC1	ZINC000447558884	260053074	/nfs/dbraw/zinc/05/30/74/260053074.db2.gz	QQDDBGGZVKFXEH-QZTJIDSGSA-N	1	0	273.420	4.099	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@@H]1CCCc2occc21	ZINC000037241809	260077166	/nfs/dbraw/zinc/07/71/66/260077166.db2.gz	HNDHNKKUKYGUKH-MRXNPFEDSA-N	1	0	283.371	4.012	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@H]1CCCc2occc21	ZINC000037241811	260077667	/nfs/dbraw/zinc/07/76/67/260077667.db2.gz	HNDHNKKUKYGUKH-INIZCTEOSA-N	1	0	283.371	4.012	20	30		CIEDRO
CC(C)[N@H+](CCCC(C)(C)C#N)Cc1ccccc1	ZINC000087608409	260192212	/nfs/dbraw/zinc/19/22/12/260192212.db2.gz	QFCVOCYTJXQORA-UHFFFAOYSA-N	1	0	258.409	4.227	20	30		CIEDRO
CC(C)(C#N)CCCC[N@@H+]1CC[C@@H](C(F)(F)F)C1(C)C	ZINC000312829146	260209336	/nfs/dbraw/zinc/20/93/36/260209336.db2.gz	JPROIXNHGVBXTI-GFCCVEGCSA-N	1	0	290.373	4.369	20	30		CIEDRO
CC(C)(C[NH2+]C1CCC(C)(C#N)CC1)c1ccc(F)cc1	ZINC000449123538	260231873	/nfs/dbraw/zinc/23/18/73/260231873.db2.gz	NLDKKKIOATXJHF-UHFFFAOYSA-N	1	0	288.410	4.165	20	30		CIEDRO
CC(C)(C)[C@H]([NH2+]CCCSCC#N)c1ccccc1	ZINC000072515142	260276541	/nfs/dbraw/zinc/27/65/41/260276541.db2.gz	RSXDHXOBUOWFCN-OAHLLOKOSA-N	1	0	276.449	4.010	20	30		CIEDRO
Cc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2CCCSCC#N)o1	ZINC000080629686	260317132	/nfs/dbraw/zinc/31/71/32/260317132.db2.gz	MQHRNKINWXAKLM-DZGCQCFKSA-N	1	0	292.448	4.008	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+][C@H]1CCc2cnn(C(C)C)c2C1	ZINC000449280938	260349304	/nfs/dbraw/zinc/34/93/04/260349304.db2.gz	YKDMSXAHOOHOPN-WBVHZDCISA-N	1	0	289.467	4.046	20	30		CIEDRO
N#Cc1ccc2c(c1)[C@@H]([NH2+]C1CC(c3ccccc3)C1)CC2	ZINC000518387413	260395646	/nfs/dbraw/zinc/39/56/46/260395646.db2.gz	UPDNWKVVASHDHR-QLOJAFMTSA-N	1	0	288.394	4.081	20	30		CIEDRO
C=C[C@H](C)[NH2+][C@@H](C)c1ccc2cc(OC)ccc2c1	ZINC000132688903	260505441	/nfs/dbraw/zinc/50/54/41/260505441.db2.gz	PBACIYSZKMIWMU-STQMWFEESA-N	1	0	255.361	4.074	20	30		CIEDRO
C=CC[C@@H](Cc1ccccc1)[NH2+]Cc1cnc(C2CC2)s1	ZINC000516742126	260553861	/nfs/dbraw/zinc/55/38/61/260553861.db2.gz	CTOAAWAPBNZWMT-INIZCTEOSA-N	1	0	298.455	4.298	20	30		CIEDRO
Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH2+]Cc1ccc(C#N)cc1	ZINC000042797770	260625963	/nfs/dbraw/zinc/62/59/63/260625963.db2.gz	LBKKDBBANBLGNK-KRWDZBQOSA-N	1	0	294.398	4.263	20	30		CIEDRO
C=CCCOCC[NH2+][C@@H](c1ccc(C)cc1)C1CCC1	ZINC000427528693	260760721	/nfs/dbraw/zinc/76/07/21/260760721.db2.gz	AOZDGIZQRZKASI-GOSISDBHSA-N	1	0	273.420	4.019	20	30		CIEDRO
N#Cc1c(F)cccc1C[NH2+][C@@H]1CCC[C@@H]1c1ccccc1	ZINC000428497096	260768345	/nfs/dbraw/zinc/76/83/45/260768345.db2.gz	TVTSORJBGVPQNS-VQIMIIECSA-N	1	0	294.373	4.123	20	30		CIEDRO
C[C@@H]([NH2+]CCCCC#N)c1ccc(Cl)c(Cl)c1	ZINC000131023859	260867563	/nfs/dbraw/zinc/86/75/63/260867563.db2.gz	QUPJFLMAYDSPGG-SNVBAGLBSA-N	1	0	271.191	4.338	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@H]1CCO[C@H](c2ccccc2)C1)C1CC1	ZINC000158141968	260876070	/nfs/dbraw/zinc/87/60/70/260876070.db2.gz	YSNGYUZJWZRJJF-FHWLQOOXSA-N	1	0	285.431	4.241	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H]1C[C@H](C)Sc2sccc21	ZINC000161680586	261119313	/nfs/dbraw/zinc/11/93/13/261119313.db2.gz	LLLUPSMTBVFYNS-NHCYSSNCSA-N	1	0	253.436	4.228	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H]1C[C@H](C)Sc2sccc21	ZINC000161680970	261119392	/nfs/dbraw/zinc/11/93/92/261119392.db2.gz	LLLUPSMTBVFYNS-JFGNBEQYSA-N	1	0	253.436	4.228	20	30		CIEDRO
CC1(C#N)CCC([NH2+]CCCSc2ccccc2)CC1	ZINC000449062247	261142125	/nfs/dbraw/zinc/14/21/25/261142125.db2.gz	YIYUTZHGSXSMIV-UHFFFAOYSA-N	1	0	288.460	4.231	20	30		CIEDRO
C[C@@H]([NH2+]CCc1ccc(Cl)s1)c1ccc(C#N)cc1	ZINC000173934893	261174219	/nfs/dbraw/zinc/17/42/19/261174219.db2.gz	IGHRRUKSFZOAMD-LLVKDONJSA-N	1	0	290.819	4.166	20	30		CIEDRO
C[N@H+](Cc1ccccc1Cl)CC(C)(C)CCC#N	ZINC000160826439	261227833	/nfs/dbraw/zinc/22/78/33/261227833.db2.gz	IGJWWOUYJXIVEF-UHFFFAOYSA-N	1	0	264.800	4.102	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]CC(C)(C)c1cccc(F)c1	ZINC000174408014	261570288	/nfs/dbraw/zinc/57/02/88/261570288.db2.gz	BSANIIUWFZYCTR-UHFFFAOYSA-N	1	0	276.399	4.023	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CCc3c2cccc3Cl)s1	ZINC000176957607	261678751	/nfs/dbraw/zinc/67/87/51/261678751.db2.gz	KXPOUQFQLLBMAN-OAHLLOKOSA-N	1	0	288.803	4.050	20	30		CIEDRO
Cc1cc(C[NH2+]CC(C)(C)CCC#N)ccc1Cl	ZINC000184334788	262016438	/nfs/dbraw/zinc/01/64/38/262016438.db2.gz	SAXTUTAPOUWZEU-UHFFFAOYSA-N	1	0	264.800	4.068	20	30		CIEDRO
C[C@@H]([NH2+]CCCSCC#N)c1cc2ccccc2s1	ZINC000184354333	262017410	/nfs/dbraw/zinc/01/74/10/262017410.db2.gz	QVMSYPDHDARWNG-GFCCVEGCSA-N	1	0	290.457	4.199	20	30		CIEDRO
C[C@H]([NH2+]CCCCC#N)C1(c2ccccc2)CCCC1	ZINC000185952675	262072410	/nfs/dbraw/zinc/07/24/10/262072410.db2.gz	HPHTVOCZGSOTGL-INIZCTEOSA-N	1	0	270.420	4.170	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1ccc(OC(F)F)c(OCC)c1	ZINC000393804209	262188331	/nfs/dbraw/zinc/18/83/31/262188331.db2.gz	OCWOFSSLHPSKLA-ZDUSSCGKSA-N	1	0	299.361	4.131	20	30		CIEDRO
C[C@@H]([NH2+]C[C@H]1CCC2(CCCCC2)O1)c1ccc(C#N)cc1	ZINC000319264204	262191321	/nfs/dbraw/zinc/19/13/21/262191321.db2.gz	WLBRPISCKQAJIW-CRAIPNDOSA-N	1	0	298.430	4.091	20	30		CIEDRO
N#CCCCC[NH2+]CCCCc1cccc(C(F)(F)F)c1	ZINC000192548795	262205109	/nfs/dbraw/zinc/20/51/09/262205109.db2.gz	KRUNHRMITDTWMD-UHFFFAOYSA-N	1	0	298.352	4.312	20	30		CIEDRO
C=CCC[C@@H](NCCC[N@H+]1CCCC[C@H]1C)c1ccco1	ZINC000514089648	262214913	/nfs/dbraw/zinc/21/49/13/262214913.db2.gz	QKSBXDABSGZGSU-IAGOWNOFSA-N	1	0	290.451	4.141	20	30		CIEDRO
N#CCC[C@@H]([NH2+][C@@H]1CCCc2occc21)c1ccccc1	ZINC000193039545	262215182	/nfs/dbraw/zinc/21/51/82/262215182.db2.gz	XYWWPPOLGROJRN-IAGOWNOFSA-N	1	0	280.371	4.292	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)c1cc2ccccc2o1	ZINC000193336967	262220838	/nfs/dbraw/zinc/22/08/38/262220838.db2.gz	FURKBIWPTRZGTA-GZBFAFLISA-N	1	0	268.360	4.166	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H](C)c2ccccc2C)cc1	ZINC000020023085	262225802	/nfs/dbraw/zinc/22/58/02/262225802.db2.gz	IKWKHFHVVPKLET-MRXNPFEDSA-N	1	0	281.399	4.411	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@@H](C)c1ccc(OC(F)F)cc1	ZINC000393829509	262230979	/nfs/dbraw/zinc/23/09/79/262230979.db2.gz	UJNFVHCZMZQNBU-AAEUAGOBSA-N	1	0	269.335	4.293	20	30		CIEDRO
C=CCCCCC[NH+]1CCC(c2ccc(C)nc2)CC1	ZINC000488316893	262310252	/nfs/dbraw/zinc/31/02/52/262310252.db2.gz	TYODNIGRWGMJQJ-UHFFFAOYSA-N	1	0	272.436	4.316	20	30		CIEDRO
C=CCSCC[NH2+][C@H](C)c1sc(C(C)(C)C)nc1C	ZINC000221946860	262335207	/nfs/dbraw/zinc/33/52/07/262335207.db2.gz	JLRCYRQBPLCLCB-LLVKDONJSA-N	1	0	298.521	4.319	20	30		CIEDRO
C=CCN1CCC([NH2+][C@H](c2ccc(C)cc2)C2CCC2)CC1	ZINC000187178265	262390882	/nfs/dbraw/zinc/39/08/82/262390882.db2.gz	QLHCIOYRCAUGOY-FQEVSTJZSA-N	1	0	298.474	4.076	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]Cc1cccc(OCCCC#N)c1	ZINC000339415501	262639376	/nfs/dbraw/zinc/63/93/76/262639376.db2.gz	HTOZECULBVAMKZ-UHFFFAOYSA-N	1	0	286.419	4.061	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1cc(OC)cc(C)n1)c1ccccc1	ZINC000411474598	262695414	/nfs/dbraw/zinc/69/54/14/262695414.db2.gz	QYPFJMVQFILECO-IBGZPJMESA-N	1	0	296.414	4.196	20	30		CIEDRO
C[C@H](CCC#N)[N@@H+]1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000411489888	262695671	/nfs/dbraw/zinc/69/56/71/262695671.db2.gz	RLTNBPPNJQHIAB-CABCVRRESA-N	1	0	274.383	4.087	20	30		CIEDRO
C[C@H](CCCc1cccnc1)[NH2+]CCC1(C#N)CCCCC1	ZINC000411825274	262707472	/nfs/dbraw/zinc/70/74/72/262707472.db2.gz	RKGFKJHCHYEIBM-QGZVFWFLSA-N	1	0	299.462	4.247	20	30		CIEDRO
C[C@@H]1CC[C@@H]([NH2+]CC(C)(C)CC#N)c2sccc21	ZINC000414170245	262813528	/nfs/dbraw/zinc/81/35/28/262813528.db2.gz	SLYCLBVVPQXZSR-DGCLKSJQSA-N	1	0	262.422	4.216	20	30		CIEDRO
C[C@H]1CC[C@@H]([NH2+]CC(C)(C)CC#N)c2ccccc21	ZINC000414170944	262813544	/nfs/dbraw/zinc/81/35/44/262813544.db2.gz	UCJXERIYJQOLMW-XJKSGUPXSA-N	1	0	256.393	4.154	20	30		CIEDRO
COc1ccc([C@@H](C)[NH2+]CC(C)(C)CC#N)c2ccccc12	ZINC000414173680	262814054	/nfs/dbraw/zinc/81/40/54/262814054.db2.gz	XCQLRRLZIPJNSO-CQSZACIVSA-N	1	0	296.414	4.439	20	30		CIEDRO
Cc1ccccc1[C@H]([NH2+]CCCC(C)(C)C#N)C1CC1	ZINC000271974798	263000910	/nfs/dbraw/zinc/00/09/10/263000910.db2.gz	CVBNGEFKZZPYPF-QGZVFWFLSA-N	1	0	270.420	4.366	20	30		CIEDRO
Cc1ccc(C[N@H+](C)CCCCC(C)(C)C#N)s1	ZINC000277793990	263043202	/nfs/dbraw/zinc/04/32/02/263043202.db2.gz	SUBMRWVSGSRNDH-UHFFFAOYSA-N	1	0	264.438	4.208	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CC[C@H](C#N)C1)c1ccc(Cl)s1	ZINC000274659177	263028904	/nfs/dbraw/zinc/02/89/04/263028904.db2.gz	VHUCGTFIUAEXPD-DCAQKATOSA-N	1	0	268.813	4.134	20	30		CIEDRO
CC(C)(C#N)CCCC[N@@H+]1CCc2[nH]c3ccccc3c2C1	ZINC000277578511	263042110	/nfs/dbraw/zinc/04/21/10/263042110.db2.gz	CADHGNVFROAAGB-UHFFFAOYSA-N	1	0	295.430	4.246	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)c1ccccc1OC(F)F	ZINC000278279090	263046518	/nfs/dbraw/zinc/04/65/18/263046518.db2.gz	PUXIEYOMOUMCTL-RWMBFGLXSA-N	1	0	294.345	4.021	20	30		CIEDRO
C[N@H+](Cc1csc2ccccc12)[C@H]1CC[C@H](C#N)C1	ZINC000278569836	263049073	/nfs/dbraw/zinc/04/90/73/263049073.db2.gz	JEFAOESQPYMKKN-JSGCOSHPSA-N	1	0	270.401	4.025	20	30		CIEDRO
C[C@@H]([NH2+]CCCCC(C)(C)C#N)c1cccc(F)c1F	ZINC000278656289	263049423	/nfs/dbraw/zinc/04/94/23/263049423.db2.gz	HOQHWUAOPOBBIB-GFCCVEGCSA-N	1	0	280.362	4.335	20	30		CIEDRO
CC(C)(C#N)CCCC[NH2+][C@@H](c1ccccc1)C1CC1	ZINC000278775505	263051026	/nfs/dbraw/zinc/05/10/26/263051026.db2.gz	NJKTUOXIUICIQL-KRWDZBQOSA-N	1	0	270.420	4.447	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1CC[C@H](c2cccc(F)c2)C1	ZINC000280367012	263060827	/nfs/dbraw/zinc/06/08/27/263060827.db2.gz	UYQYUQVUIGMUIY-DOTOQJQBSA-N	1	0	288.410	4.381	20	30		CIEDRO
CC1(C)CCc2ccccc2[C@@H]([NH2+]C[C@H](C#N)CCC#N)C1	ZINC000281701007	263071259	/nfs/dbraw/zinc/07/12/59/263071259.db2.gz	NVJDWUAZLMHLDP-YJBOKZPZSA-N	1	0	295.430	4.123	20	30		CIEDRO
CSc1ccc([C@@H](C)[NH2+][C@@H]2CCC[C@@H](C#N)C2)cc1	ZINC000281825532	263072055	/nfs/dbraw/zinc/07/20/55/263072055.db2.gz	ZVMUYWLAAFEKCO-UMVBOHGHSA-N	1	0	274.433	4.141	20	30		CIEDRO
C[C@H]([NH2+]CC1CCC(C#N)CC1)c1cc2ccccc2o1	ZINC000282137790	263074750	/nfs/dbraw/zinc/07/47/50/263074750.db2.gz	BTZSDYCXRXSDAQ-NFOMZHRRSA-N	1	0	282.387	4.413	20	30		CIEDRO
CC(C)c1nc([C@@H](C)[NH2+]CC2CCC(C#N)CC2)cs1	ZINC000282191919	263074941	/nfs/dbraw/zinc/07/49/41/263074941.db2.gz	GGSKDVAAVIPOON-IYXRBSQSSA-N	1	0	291.464	4.247	20	30		CIEDRO
C[C@H]([NH2+]CC1CCC(C#N)CC1)c1cccc(Cl)c1	ZINC000282250193	263075373	/nfs/dbraw/zinc/07/53/73/263075373.db2.gz	GOXAZRJCHGKLRB-HSBZDZAISA-N	1	0	276.811	4.321	20	30		CIEDRO
CC[C@H]([NH2+]CC1CCC(C#N)CC1)c1ccc(OC)cc1	ZINC000282365132	263076092	/nfs/dbraw/zinc/07/60/92/263076092.db2.gz	PXUGLHDSTJSZED-JMLCCBQJSA-N	1	0	286.419	4.066	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](C#N)C1)c1ccc(-c2cccnc2)cc1	ZINC000282399521	263076381	/nfs/dbraw/zinc/07/63/81/263076381.db2.gz	RPWKVKXSRRZEMP-KHYOSLBOSA-N	1	0	291.398	4.091	20	30		CIEDRO
CC[C@@H]([NH2+]CC1CCC(C#N)CC1)c1ccccc1	ZINC000282420129	263076553	/nfs/dbraw/zinc/07/65/53/263076553.db2.gz	LRQIZEIRWTVEOW-VMBOVVBDSA-N	1	0	256.393	4.057	20	30		CIEDRO
N#CC1CCC(C[NH2+][C@H](c2ccccc2)C2CC2)CC1	ZINC000282464161	263076795	/nfs/dbraw/zinc/07/67/95/263076795.db2.gz	VWBNLHBALBBAOV-JTTJXQCZSA-N	1	0	268.404	4.057	20	30		CIEDRO
C[C@@H](CCc1cccc(F)c1)[NH2+]CC1CCC(C#N)CC1	ZINC000282484073	263077143	/nfs/dbraw/zinc/07/71/43/263077143.db2.gz	XBYJNIDGQODXGV-OOHWJJMZSA-N	1	0	288.410	4.066	20	30		CIEDRO
CC[C@H](C#N)Nc1ccc([NH+]2CCCCCC2)cc1C	ZINC000285138937	263090619	/nfs/dbraw/zinc/09/06/19/263090619.db2.gz	OBWTTXWGPPUGAG-OAHLLOKOSA-N	1	0	271.408	4.090	20	30		CIEDRO
C[C@H]1CC[C@@H](c2ccccc2)[N@H+](CCCCC#N)C1	ZINC000285610001	263094638	/nfs/dbraw/zinc/09/46/38/263094638.db2.gz	QBEYYQPGMXUPON-RDJZCZTQSA-N	1	0	256.393	4.153	20	30		CIEDRO
C[C@H]1C[C@@H]([NH2+]CC2CCC(C#N)CC2)c2ccccc21	ZINC000290341086	263116149	/nfs/dbraw/zinc/11/61/49/263116149.db2.gz	PKNPDSFPMMVSON-FAYHIZQSSA-N	1	0	268.404	4.154	20	30		CIEDRO
CC[C@H]([NH2+][C@H](CCCC#N)c1ccccc1)C1CC1	ZINC000340451023	263155256	/nfs/dbraw/zinc/15/52/56/263155256.db2.gz	ZDMRFWKYQCRZGY-DLBZAZTESA-N	1	0	256.393	4.200	20	30		CIEDRO
Cc1ccnc([C@H](C)[NH2+][C@H](CCCC#N)c2ccccc2)c1	ZINC000340449694	263155666	/nfs/dbraw/zinc/15/56/66/263155666.db2.gz	VVHAEABZTFHGDX-FUHWJXTLSA-N	1	0	293.414	4.476	20	30		CIEDRO
Cc1ccnc([C@@H](C)[NH2+][C@@H](CCCC#N)c2ccccc2)c1	ZINC000340449693	263155678	/nfs/dbraw/zinc/15/56/78/263155678.db2.gz	VVHAEABZTFHGDX-AEFFLSMTSA-N	1	0	293.414	4.476	20	30		CIEDRO
COC[C@H](CC(C)C)[NH2+][C@H](CCCC#N)c1ccccc1	ZINC000340451107	263156084	/nfs/dbraw/zinc/15/60/84/263156084.db2.gz	ZXTXHAZAANXTEK-ZWKOTPCHSA-N	1	0	288.435	4.072	20	30		CIEDRO
CC[C@H](C)[C@@H](C)[NH2+][C@@H](CCCC#N)c1ccccc1	ZINC000340461465	263161416	/nfs/dbraw/zinc/16/14/16/263161416.db2.gz	ZIZLGVDWGZVAFN-UXLLHSPISA-N	1	0	258.409	4.446	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH+]2CCC(c3ccc(Cl)cc3)CC2)C1	ZINC000294485469	263162544	/nfs/dbraw/zinc/16/25/44/263162544.db2.gz	HLXVPCUZANKQRC-SUMWQHHRSA-N	1	0	288.822	4.212	20	30		CIEDRO
CC(C)[C@@H](C[NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccccc1	ZINC000294925134	263169457	/nfs/dbraw/zinc/16/94/57/263169457.db2.gz	BDAAYNQDHSKYKL-RYQLBKOJSA-N	1	0	270.420	4.098	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@@H]2CC[C@@H](Cc3ccccc3)C2)C1	ZINC000295017009	263170726	/nfs/dbraw/zinc/17/07/26/263170726.db2.gz	KEBLHHUOUYOKGK-CADBVGFASA-N	1	0	282.431	4.070	20	30		CIEDRO
C[C@@]1(c2ccccc2)CC[C@@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)C1	ZINC000295059390	263171443	/nfs/dbraw/zinc/17/14/43/263171443.db2.gz	OCXGZGGVWINQBS-GDAAHCPNSA-N	1	0	282.431	4.169	20	30		CIEDRO
CC(C)[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccccc1	ZINC000296236174	263187919	/nfs/dbraw/zinc/18/79/19/263187919.db2.gz	CHSWJGDJCJILHU-BHYGNILZSA-N	1	0	256.393	4.056	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccc(C(F)(F)F)cc1	ZINC000296375898	263190677	/nfs/dbraw/zinc/19/06/77/263190677.db2.gz	JIXDVZJUOZYVJS-HUBLWGQQSA-N	1	0	296.336	4.438	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccc(Cl)s1	ZINC000296361500	263190717	/nfs/dbraw/zinc/19/07/17/263190717.db2.gz	ISCNAHYQPGNXEC-DCAQKATOSA-N	1	0	268.813	4.134	20	30		CIEDRO
C[C@H]1CC[C@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)c2ccccc21	ZINC000296425217	263191398	/nfs/dbraw/zinc/19/13/98/263191398.db2.gz	LPCVTNUMXMBQBL-XSWJXKHESA-N	1	0	268.404	4.297	20	30		CIEDRO
Cc1ccc([C@H](C)[NH2+][C@H]2CC[C@@H](CC#N)C2)cc1C	ZINC000296462379	263191962	/nfs/dbraw/zinc/19/19/62/263191962.db2.gz	NIOSJBIMHYSXHQ-ZOBUZTSGSA-N	1	0	256.393	4.036	20	30		CIEDRO
Cc1cccc([C@@H](C)[NH2+][C@H]2CC[C@@H](CC#N)C2)c1C	ZINC000296534081	263192538	/nfs/dbraw/zinc/19/25/38/263192538.db2.gz	QQAFFKJUVNECAR-PMPSAXMXSA-N	1	0	256.393	4.036	20	30		CIEDRO
CC(C)CC[C@H]([NH2+]CC1(CC#N)CC1)c1ccoc1	ZINC000353589659	263205024	/nfs/dbraw/zinc/20/50/24/263205024.db2.gz	RWUJZWBNYOJTLR-HNNXBMFYSA-N	1	0	260.381	4.040	20	30		CIEDRO
C[C@H](CCC#N)[NH2+][C@H](C)c1ccc(Oc2cccnc2)cc1	ZINC000298650828	263223508	/nfs/dbraw/zinc/22/35/08/263223508.db2.gz	XLBYCFIGZMTECR-HUUCEWRRSA-N	1	0	295.386	4.217	20	30		CIEDRO
C[C@H](CCC#N)[NH2+][C@H](C)c1cc2ccccc2s1	ZINC000298945812	263227807	/nfs/dbraw/zinc/22/78/07/263227807.db2.gz	OKAUDGTVVZOWAR-VXGBXAGGSA-N	1	0	258.390	4.244	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1nc(C)cs1)c1ccccc1	ZINC000341922977	263365826	/nfs/dbraw/zinc/36/58/26/263365826.db2.gz	BYWLJUMREPDRSB-HNNXBMFYSA-N	1	0	272.417	4.249	20	30		CIEDRO
N#CCCC[N@H+](Cc1cccs1)C1Cc2ccccc2C1	ZINC000342015464	263378983	/nfs/dbraw/zinc/37/89/83/263378983.db2.gz	IBDXSIMLXDOABJ-UHFFFAOYSA-N	1	0	296.439	4.021	20	30		CIEDRO
CCCCOc1ccc([C@@H](C)[NH2+]CC2(CC#N)CC2)cc1	ZINC000342588299	263451540	/nfs/dbraw/zinc/45/15/40/263451540.db2.gz	CYDGHDOLUVYLKP-OAHLLOKOSA-N	1	0	286.419	4.210	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)c1ccc(C2CC2)cc1	ZINC000417350716	263797837	/nfs/dbraw/zinc/79/78/37/263797837.db2.gz	BAAQJDIGPOXKCV-SUNYJGFJSA-N	1	0	268.404	4.297	20	30		CIEDRO
C[C@@H]1[C@H](c2ccccc2)CC[N@@H+]1Cc1ccc(F)c(C#N)c1	ZINC000468269337	264294759	/nfs/dbraw/zinc/29/47/59/264294759.db2.gz	XURGICHCHBBBAR-RDTXWAMCSA-N	1	0	294.373	4.075	20	30		CIEDRO
C=CCOc1ccccc1C[N@H+]1CC[C@H](C(F)(F)F)[C@@H]1C	ZINC000475286764	264294852	/nfs/dbraw/zinc/29/48/52/264294852.db2.gz	LVCUNNLPACHFND-JSGCOSHPSA-N	1	0	299.336	4.024	20	30		CIEDRO
C=CCC[C@@H]([NH2+][C@@H](C)c1ccccn1)c1ccccc1	ZINC000090580733	264409897	/nfs/dbraw/zinc/40/98/97/264409897.db2.gz	BZDBDFWPECWLGT-MAUKXSAKSA-N	1	0	266.388	4.440	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@@H](C)c1ccc(SC)cc1	ZINC000280774554	264461181	/nfs/dbraw/zinc/46/11/81/264461181.db2.gz	HOGCJVDMHMFVHU-LXZKKBNFSA-N	1	0	291.460	4.040	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccc(C(C)(C)O)cc1)c1ccco1	ZINC000286156593	264576881	/nfs/dbraw/zinc/57/68/81/264576881.db2.gz	PCCPSKNTXGBKPQ-KRWDZBQOSA-N	1	0	299.414	4.304	20	30		CIEDRO
C=CCCCCCCCC[NH2+]Cc1cnc([C@@H](C)O)s1	ZINC000290273805	264759496	/nfs/dbraw/zinc/75/94/96/264759496.db2.gz	YGXDQVWRAAMDPF-CQSZACIVSA-N	1	0	296.480	4.203	20	30		CIEDRO
CC(C)(C)[C@H]([NH2+][C@H]1CC[C@@H](C#N)C1)c1cccc(F)c1	ZINC000442780756	264958720	/nfs/dbraw/zinc/95/87/20/264958720.db2.gz	NMEQUEIGPHZBQK-UHOFOFEASA-N	1	0	274.383	4.195	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)C(C)(C)c1ccccc1	ZINC000442786756	264969418	/nfs/dbraw/zinc/96/94/18/264969418.db2.gz	XMZULCPAHGPQOJ-UAGQMJEPSA-N	1	0	270.420	4.025	20	30		CIEDRO
Cc1ccsc1[C@@H](C)[NH2+]CC(C)(C)CCC#N	ZINC000348242375	265146795	/nfs/dbraw/zinc/14/67/95/265146795.db2.gz	JFCGJNJFECRJNN-GFCCVEGCSA-N	1	0	250.411	4.037	20	30		CIEDRO
CCC[N@H+](Cc1ccc(C)cc1)Cc1cc(C#N)ccc1F	ZINC000514530407	265173381	/nfs/dbraw/zinc/17/33/81/265173381.db2.gz	WTOTZTJNHPZSEE-UHFFFAOYSA-N	1	0	296.389	4.418	20	30		CIEDRO
N#Cc1csc(C[NH2+]C2CCC(c3ccccc3)CC2)c1	ZINC000093492251	265182159	/nfs/dbraw/zinc/18/21/59/265182159.db2.gz	OOKIOJRAYVVZNZ-UHFFFAOYSA-N	1	0	296.439	4.436	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](CC)c1ccc(OCC)c(OCC)c1	ZINC000358042566	266404175	/nfs/dbraw/zinc/40/41/75/266404175.db2.gz	VJGJUUJZGNPDGF-HOCLYGCPSA-N	1	0	291.435	4.489	20	30		CIEDRO
CC[C@@H](CSC)[NH2+][C@@H]1CCCCc2cc(C#N)ccc21	ZINC000360649753	266730879	/nfs/dbraw/zinc/73/08/79/266730879.db2.gz	WAHRMSRMNPOCJL-DOTOQJQBSA-N	1	0	288.460	4.057	20	30		CIEDRO
C[C@H](C[NH2+][C@@H](CCC#N)c1ccccc1)Cc1ccccc1	ZINC000360893939	266752679	/nfs/dbraw/zinc/75/26/79/266752679.db2.gz	KGFYXSUXSSDFFN-PXNSSMCTSA-N	1	0	292.426	4.500	20	30		CIEDRO
C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]CCCC#N	ZINC000360994339	266764200	/nfs/dbraw/zinc/76/42/00/266764200.db2.gz	DZVDYPKWBVUBRO-CQSZACIVSA-N	1	0	283.419	4.117	20	30		CIEDRO
N#CCc1ccc(C[NH+]2CCC(c3ccsc3)CC2)cc1	ZINC000362644669	267029074	/nfs/dbraw/zinc/02/90/74/267029074.db2.gz	URPYRSSWZJOMAG-UHFFFAOYSA-N	1	0	296.439	4.194	20	30		CIEDRO
N#CCCCC[N@@H+]1CCCC[C@@H]1c1nc2ccccc2o1	ZINC000362823326	267051080	/nfs/dbraw/zinc/05/10/80/267051080.db2.gz	QJBCMUDJAWAACT-OAHLLOKOSA-N	1	0	283.375	4.049	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)s1)c1ccc(C2CC2)cc1	ZINC000418116984	267198148	/nfs/dbraw/zinc/19/81/48/267198148.db2.gz	SALSYABHFSMMLP-LBPRGKRZSA-N	1	0	282.412	4.348	20	30		CIEDRO
N#CCCCC[N@H+]1CC[C@H](Cc2ccc(C(F)F)cc2)C1	ZINC000368770495	267203099	/nfs/dbraw/zinc/20/30/99/267203099.db2.gz	PWAQWMWJQYPXHV-OAHLLOKOSA-N	1	0	292.373	4.182	20	30		CIEDRO
CCC[C@@H]([NH2+]CCCCC#N)c1ccc(Cl)cc1	ZINC000118967656	267281577	/nfs/dbraw/zinc/28/15/77/267281577.db2.gz	KFGDQKKNLGGGLB-OAHLLOKOSA-N	1	0	264.800	4.465	20	30		CIEDRO
C[C@H]([NH2+]CCCCC#N)c1nc(-c2ccccc2)cs1	ZINC000118979064	267283070	/nfs/dbraw/zinc/28/30/70/267283070.db2.gz	NABZLCCZLQPDDZ-ZDUSSCGKSA-N	1	0	285.416	4.155	20	30		CIEDRO
CC[C@@H](CC#N)[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1	ZINC000370490395	267322339	/nfs/dbraw/zinc/32/23/39/267322339.db2.gz	HGPPBACTEVBMRG-FIQHERPVSA-N	1	0	282.840	4.175	20	30		CIEDRO
C[C@@H]([NH2+][C@H](C)C1CC1)c1nc(-c2ccc(C#N)cc2)cs1	ZINC000370662769	267336576	/nfs/dbraw/zinc/33/65/76/267336576.db2.gz	OEVKOTJCUCEAEV-VXGBXAGGSA-N	1	0	297.427	4.131	20	30		CIEDRO
C[C@@H](CC(C)(C)c1ccccc1)[NH2+]CC1(C#N)CCC1	ZINC000418140645	267361847	/nfs/dbraw/zinc/36/18/47/267361847.db2.gz	JWJWTMYRIOXHAF-HNNXBMFYSA-N	1	0	270.420	4.026	20	30		CIEDRO
C[C@@H]([NH2+]CC1(C#N)CCC1)[C@@H]1C[C@H]1c1ccc(Cl)s1	ZINC000418143024	267363966	/nfs/dbraw/zinc/36/39/66/267363966.db2.gz	OCHQTNBWIJUQJA-GRYCIOLGSA-N	1	0	294.851	4.177	20	30		CIEDRO
N#CC1(C[NH2+]Cc2cc(-c3ccccc3)cs2)CCC1	ZINC000418145938	267366281	/nfs/dbraw/zinc/36/62/81/267366281.db2.gz	ZRIFHPNWSAGZQB-UHFFFAOYSA-N	1	0	282.412	4.199	20	30		CIEDRO
C[C@@H](C[NH2+]CC1(C#N)CCC1)c1ccc(C(F)(F)F)cc1	ZINC000418135549	267367583	/nfs/dbraw/zinc/36/75/83/267367583.db2.gz	AZDHYPMRABLGIE-LBPRGKRZSA-N	1	0	296.336	4.092	20	30		CIEDRO
Cc1cnc([C@H]2CCCC[N@@H+]2CCCC(C)(C)C#N)s1	ZINC000371210264	267371551	/nfs/dbraw/zinc/37/15/51/267371551.db2.gz	YIJHJBXAZWSKPA-CQSZACIVSA-N	1	0	291.464	4.309	20	30		CIEDRO
Cc1cnc([C@@H]2CCCC[N@@H+]2CCCC(C)(C)C#N)s1	ZINC000371210262	267371981	/nfs/dbraw/zinc/37/19/81/267371981.db2.gz	YIJHJBXAZWSKPA-AWEZNQCLSA-N	1	0	291.464	4.309	20	30		CIEDRO
Cc1cc(F)ccc1C[NH2+][C@H]1CCCc2cc(C#N)ccc21	ZINC000418149502	267375531	/nfs/dbraw/zinc/37/55/31/267375531.db2.gz	VGYCMCKQGPTSSA-IBGZPJMESA-N	1	0	294.373	4.173	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(C#N)cc1F)c1ccc(C)cc1	ZINC000120126620	267385404	/nfs/dbraw/zinc/38/54/04/267385404.db2.gz	CENKZWQJYREAGM-SFHVURJKSA-N	1	0	282.362	4.247	20	30		CIEDRO
N#Cc1ccccc1C[NH2+][C@@H](c1ccccc1)C1CCC1	ZINC000170919845	327675525	/nfs/dbraw/zinc/67/55/25/327675525.db2.gz	SNTDPXTUJWSETI-IBGZPJMESA-N	1	0	276.383	4.189	20	30		CIEDRO
C[C@H]1C[C@@H]([NH2+]CCCCC#N)C[C@@H](c2ccccc2)C1	ZINC000178650099	327795580	/nfs/dbraw/zinc/79/55/80/327795580.db2.gz	OBYNVGFHOGKIQC-BPQIPLTHSA-N	1	0	270.420	4.242	20	30		CIEDRO
CCC[C@H]1CCCC[C@H]1[NH2+]Cc1cc(C#N)cs1	ZINC000531355970	327901032	/nfs/dbraw/zinc/90/10/32/327901032.db2.gz	CDMJHIPHLSMKTD-DZGCQCFKSA-N	1	0	262.422	4.068	20	30		CIEDRO
N#Cc1csc(C[NH2+][C@@H]2CC[C@@H]3CCCC[C@@H]3C2)c1	ZINC000531356326	327901110	/nfs/dbraw/zinc/90/11/10/327901110.db2.gz	OMXIDPNPGMVIMZ-RRFJBIMHSA-N	1	0	274.433	4.068	20	30		CIEDRO
CC[C@H](C[NH+]1CCC(CCC#N)CC1)c1ccccc1	ZINC000563158203	327933186	/nfs/dbraw/zinc/93/31/86/327933186.db2.gz	NTIHIGASCOKREA-QGZVFWFLSA-N	1	0	270.420	4.196	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1cccc(C#N)c1)c1ccc(F)cc1F	ZINC000160743319	327979521	/nfs/dbraw/zinc/97/95/21/327979521.db2.gz	HFBWODYWTWOMJH-QGZVFWFLSA-N	1	0	286.325	4.077	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+]CCc1c[nH]c2ccccc12	ZINC000531677544	328023228	/nfs/dbraw/zinc/02/32/28/328023228.db2.gz	DUUAZTYQRIGLJT-OAHLLOKOSA-N	1	0	256.393	4.045	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@@H]1CCCO[C@@H]1c1ccc(C)cc1	ZINC000531723967	328023262	/nfs/dbraw/zinc/02/32/62/328023262.db2.gz	AYDIDBSTRPJNOJ-RNIPGJKVSA-N	1	0	287.447	4.405	20	30		CIEDRO
C[C@H](c1ccccc1)[C@H](C)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000531695429	328025227	/nfs/dbraw/zinc/02/52/27/328025227.db2.gz	UEIHVHGJHOCDFJ-JYJNAYRXSA-N	1	0	278.399	4.401	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+]Cc1cccc(Cl)c1	ZINC000048241858	328045786	/nfs/dbraw/zinc/04/57/86/328045786.db2.gz	SKGLLLSWBHXHGW-UHFFFAOYSA-N	1	0	287.790	4.195	20	30		CIEDRO
C[C@@H]([NH2+]CCCCC#N)c1ccccc1C(C)(C)C	ZINC000534352447	328048354	/nfs/dbraw/zinc/04/83/54/328048354.db2.gz	METWFFZSTMDPTL-CQSZACIVSA-N	1	0	258.409	4.329	20	30		CIEDRO
CSCC[NH2+][C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000541085017	328048647	/nfs/dbraw/zinc/04/86/47/328048647.db2.gz	OINGAWFWKKSOLZ-AWEZNQCLSA-N	1	0	296.439	4.239	20	30		CIEDRO
CC1(C)CCc2ccccc2[C@H]([NH2+][C@H]2CC[C@@H](C#N)C2)C1	ZINC000571302178	328100713	/nfs/dbraw/zinc/10/07/13/328100713.db2.gz	GCAZCHZVXBIBLG-UWWQBHOKSA-N	1	0	282.431	4.372	20	30		CIEDRO
CC1(C)CCc2ccccc2[C@H]([NH2+][C@@H]2CC[C@H](C#N)C2)C1	ZINC000571302179	328100808	/nfs/dbraw/zinc/10/08/08/328100808.db2.gz	GCAZCHZVXBIBLG-YXJHDRRASA-N	1	0	282.431	4.372	20	30		CIEDRO
CC[N@H+](CCC1(C#N)CCCCC1)[C@H]1CCOC(C)(C)C1	ZINC000411761097	328098908	/nfs/dbraw/zinc/09/89/08/328098908.db2.gz	XQHLUVIEACKNMF-INIZCTEOSA-N	1	0	292.467	4.130	20	30		CIEDRO
C=CC[C@H](Cc1ccccc1)[NH2+][C@H](C)c1ccco1	ZINC000414306800	328154365	/nfs/dbraw/zinc/15/43/65/328154365.db2.gz	RERRBCVQKOHIKK-GDBMZVCRSA-N	1	0	255.361	4.118	20	30		CIEDRO
C[N@H+](Cc1cccs1)Cc1ccccc1C(C)(C)C#N	ZINC000268969890	328187805	/nfs/dbraw/zinc/18/78/05/328187805.db2.gz	LORFXKSADNZKCT-UHFFFAOYSA-N	1	0	284.428	4.181	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccccc1OC(F)F	ZINC000274678544	328212647	/nfs/dbraw/zinc/21/26/47/328212647.db2.gz	ZPKYWEFGEUIGPP-SCRDCRAPSA-N	1	0	294.345	4.021	20	30		CIEDRO
COc1ccc(C)cc1[C@@H](C)[NH2+]CCCCC(C)(C)C#N	ZINC000277744520	328222300	/nfs/dbraw/zinc/22/23/00/328222300.db2.gz	PDGQSKPPKDYARH-OAHLLOKOSA-N	1	0	288.435	4.374	20	30		CIEDRO
C=CC[N@H+](CCCCC(C)(C)C#N)CCc1ccco1	ZINC000278799623	328230335	/nfs/dbraw/zinc/23/03/35/328230335.db2.gz	ONIUGPKGMOBKRW-UHFFFAOYSA-N	1	0	274.408	4.030	20	30		CIEDRO
N#C[C@H]1CC[C@H]([NH+]2Cc3ccccc3-c3ccccc3C2)C1	ZINC000278678349	328229372	/nfs/dbraw/zinc/22/93/72/328229372.db2.gz	RLCMOQCYVQBJHB-YJBOKZPZSA-N	1	0	288.394	4.361	20	30		CIEDRO
CC1=CC[C@H]([NH2+][C@H](CCC#N)c2ccccc2)CC1	ZINC000293565764	328276881	/nfs/dbraw/zinc/27/68/81/328276881.db2.gz	IMBIHCLPEMULOZ-DLBZAZTESA-N	1	0	254.377	4.120	20	30		CIEDRO
N#C[C@H]1CC[C@H]([N@H+]2[C@@H]3CC[C@H]2C[C@@H](c2ccccc2)C3)C1	ZINC000294345391	328280200	/nfs/dbraw/zinc/28/02/00/328280200.db2.gz	ZCTBVVRBZOGYTE-HZZCBIDNSA-N	1	0	280.415	4.089	20	30		CIEDRO
COc1ccc2ccccc2c1C[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000294991348	328283978	/nfs/dbraw/zinc/28/39/78/328283978.db2.gz	HQQIFGBMEHTNLU-HOCLYGCPSA-N	1	0	294.398	4.020	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+]Cc2c(Cl)oc3ccccc32)C1	ZINC000294994570	328284005	/nfs/dbraw/zinc/28/40/05/328284005.db2.gz	HXUOEBGNLSPENN-RYUDHWBXSA-N	1	0	288.778	4.258	20	30		CIEDRO
CC1(C)C[C@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)c2ccccc21	ZINC000296456331	328290649	/nfs/dbraw/zinc/29/06/49/328290649.db2.gz	MZXRAVKDEVSGOD-ZQIUZPCESA-N	1	0	268.404	4.081	20	30		CIEDRO
CC(C)[N@H+](Cc1cccs1)Cc1cc(C#N)ccc1F	ZINC000049028795	328334124	/nfs/dbraw/zinc/33/41/24/328334124.db2.gz	MXMDJANRZQPYED-UHFFFAOYSA-N	1	0	288.391	4.169	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+][C@H](COCC(C)C)c1ccco1	ZINC000531961423	328337193	/nfs/dbraw/zinc/33/71/93/328337193.db2.gz	KRUBRRPSMRAURT-ARFHVFGLSA-N	1	0	279.424	4.184	20	30		CIEDRO
C=CC1CC[NH+](Cc2csc(-c3ccsc3)n2)CC1	ZINC000111257415	328340623	/nfs/dbraw/zinc/34/06/23/328340623.db2.gz	IVUYNGRIMJHNEP-UHFFFAOYSA-N	1	0	290.457	4.270	20	30		CIEDRO
CC[C@H](Cc1ccccc1)[N@H+](C)Cc1cc(C#N)ccc1F	ZINC000303847509	328360802	/nfs/dbraw/zinc/36/08/02/328360802.db2.gz	CURVBVQDGGFZKD-GOSISDBHSA-N	1	0	296.389	4.150	20	30		CIEDRO
C[C@@H](C#N)CN(C)Cc1ccc(-c2ccc(Cl)cc2)o1	ZINC000535074499	328384368	/nfs/dbraw/zinc/38/43/68/328384368.db2.gz	IQJAGJYSKKIVON-LBPRGKRZSA-N	1	0	288.778	4.191	20	30		CIEDRO
Cc1cc(Cl)cc(C)c1CN(CCC#N)C(C)C	ZINC000535073427	328384476	/nfs/dbraw/zinc/38/44/76/328384476.db2.gz	QPIUOAAFVQRBFT-UHFFFAOYSA-N	1	0	264.800	4.081	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H]1CCCOc2cc(Cl)ccc21	ZINC000341679673	328414013	/nfs/dbraw/zinc/41/40/13/328414013.db2.gz	BHGJUECXJGBMOW-SMDDNHRTSA-N	1	0	265.784	4.108	20	30		CIEDRO
C=CCOc1cccc(C[NH2+][C@@H](CC)CC(F)(F)F)c1	ZINC000546880748	328449123	/nfs/dbraw/zinc/44/91/23/328449123.db2.gz	KNEGMDIMRNUFRR-ZDUSSCGKSA-N	1	0	287.325	4.072	20	30		CIEDRO
N#CC1(c2ccccc2)CCC([NH2+]CC2(C3CC3)CC2)CC1	ZINC000537943735	326791243	/nfs/dbraw/zinc/79/12/43/326791243.db2.gz	YLIWNBODICKKRW-UHFFFAOYSA-N	1	0	294.442	4.170	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H]1CCCSc2ccc(OC)cc21	ZINC000188204980	326842110	/nfs/dbraw/zinc/84/21/10/326842110.db2.gz	WKWJPFDTRICLPE-WFASDCNBSA-N	1	0	277.433	4.176	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H](c1ccc(F)cn1)C(C)C	ZINC000551239905	326849388	/nfs/dbraw/zinc/84/93/88/326849388.db2.gz	AALUEVPPZYCLNC-HNNXBMFYSA-N	1	0	264.388	4.110	20	30		CIEDRO
N#Cc1ccc(C[NH2+]C[C@@H]2CCC[C@@H](C(F)(F)F)C2)cc1	ZINC000530736574	326889081	/nfs/dbraw/zinc/88/90/81/326889081.db2.gz	STGFNUPAGASNGH-HUUCEWRRSA-N	1	0	296.336	4.017	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+]Cc1cccc(COC)c1	ZINC000557288791	327000637	/nfs/dbraw/zinc/00/06/37/327000637.db2.gz	DCCUOQOUNQVOTB-OAHLLOKOSA-N	1	0	261.409	4.058	20	30		CIEDRO
C=C(CC)C[NH2+][C@@H](CC)c1ccc(OC(F)F)cc1	ZINC000557575437	327013893	/nfs/dbraw/zinc/01/38/93/327013893.db2.gz	FWORTLTZSHMONJ-AWEZNQCLSA-N	1	0	269.335	4.295	20	30		CIEDRO
Cc1ccc([C@H](C)[NH2+]Cc2ccc(C#N)s2)cc1C	ZINC000557754912	327024885	/nfs/dbraw/zinc/02/48/85/327024885.db2.gz	NTIVHLCLDIXDPV-ZDUSSCGKSA-N	1	0	270.401	4.087	20	30		CIEDRO
Cc1cccc(C[C@@H]([NH2+]Cc2ccc(C#N)s2)C2CC2)c1	ZINC000584189652	327059621	/nfs/dbraw/zinc/05/96/21/327059621.db2.gz	NPLITMNVVHXZRA-GOSISDBHSA-N	1	0	296.439	4.039	20	30		CIEDRO
C[C@H]1C[C@@H](c2ccccc2)CC[N@@H+]1CCC(C)(C)C#N	ZINC000558108420	327074211	/nfs/dbraw/zinc/07/42/11/327074211.db2.gz	XSQGLRLMBFVLOY-RDJZCZTQSA-N	1	0	270.420	4.194	20	30		CIEDRO
C[N@H+](CC#Cc1cccc(Cl)c1)C1CCC(F)(F)CC1	ZINC000558176054	327077053	/nfs/dbraw/zinc/07/70/53/327077053.db2.gz	BYMRDCZRJZOYMG-UHFFFAOYSA-N	1	0	297.776	4.201	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H]1CCc2c1cccc2Cl	ZINC000558245128	327081232	/nfs/dbraw/zinc/08/12/32/327081232.db2.gz	FQCOFYKBXAGPBX-HNNXBMFYSA-N	1	0	276.811	4.247	20	30		CIEDRO
C[C@H]1CCc2c(F)cccc2[C@@H]1[NH2+]CC(C)(C)CCC#N	ZINC000558248890	327081494	/nfs/dbraw/zinc/08/14/94/327081494.db2.gz	VIFJSACUTRXHBA-SUMWQHHRSA-N	1	0	288.410	4.369	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+]C[C@@H]1C[C@@H]1c1ccccc1	ZINC000558271021	327084373	/nfs/dbraw/zinc/08/43/73/327084373.db2.gz	DETAXZJCOBJPHH-RBUKOAKNSA-N	1	0	293.410	4.145	20	30		CIEDRO
CC(C)[N@H+](Cc1ccc(C#N)cc1)Cc1ccc(Cl)cn1	ZINC000558408172	327092033	/nfs/dbraw/zinc/09/20/33/327092033.db2.gz	WVOCCMXSTRTPER-UHFFFAOYSA-N	1	0	299.805	4.017	20	30		CIEDRO
CCO[C@H]1C[C@H]([NH2+]C2CCC(C)(C#N)CC2)C1(CC)CC	ZINC000449178892	327110389	/nfs/dbraw/zinc/11/03/89/327110389.db2.gz	YLCAYOUINQEABH-YZUHTNEWSA-N	1	0	292.467	4.032	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+]CC(C)(C)C(F)(F)F	ZINC000558697785	327114791	/nfs/dbraw/zinc/11/47/91/327114791.db2.gz	BEVPQENBQHMLKZ-NSHDSACASA-N	1	0	251.336	4.299	20	30		CIEDRO
CSc1ccc([C@H](C)[NH2+]Cc2cc(C#N)cs2)cc1	ZINC000093492266	327123718	/nfs/dbraw/zinc/12/37/18/327123718.db2.gz	NOLYDCBDPNEHSY-NSHDSACASA-N	1	0	288.441	4.192	20	30		CIEDRO
CC[C@@H](CC#N)[NH2+][C@@H](C)CCc1ccc(C(F)(F)F)cc1	ZINC000559055016	327139155	/nfs/dbraw/zinc/13/91/55/327139155.db2.gz	VZEOWDIYZQAHKG-WFASDCNBSA-N	1	0	298.352	4.308	20	30		CIEDRO
CC#CCC[NH2+]CC(c1ccc(F)cc1)c1ccc(F)cc1	ZINC000559070044	327140195	/nfs/dbraw/zinc/14/01/95/327140195.db2.gz	UCHFIGDEBWUEDK-UHFFFAOYSA-N	1	0	299.364	4.100	20	30		CIEDRO
CC1(C#N)CCC([NH2+]Cc2ccc(C3CC3)cc2)CC1	ZINC000449280365	327148089	/nfs/dbraw/zinc/14/80/89/327148089.db2.gz	XMTLZRWIBQCFHZ-UHFFFAOYSA-N	1	0	268.404	4.126	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+][C@@H]1CCCC12CCOCC2	ZINC000449307915	327156163	/nfs/dbraw/zinc/15/61/63/327156163.db2.gz	SLDAWNZYOJABTG-HZPDHXFCSA-N	1	0	265.441	4.060	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H]1CCC[C@@H](CCCC(=O)OC)C1	ZINC000559307301	327157766	/nfs/dbraw/zinc/15/77/66/327157766.db2.gz	PJBJTKNXVLOYJW-HOTGVXAUSA-N	1	0	295.467	4.080	20	30		CIEDRO
Cc1ccccc1C(C)(C)[NH2+]Cc1ccc(CC#N)cc1	ZINC000569361288	327163595	/nfs/dbraw/zinc/16/35/95/327163595.db2.gz	STKCRZRNFGDANF-UHFFFAOYSA-N	1	0	278.399	4.086	20	30		CIEDRO
C=CCCc1ccccc1NCc1cn2ccccc2n1	ZINC000409845581	327166049	/nfs/dbraw/zinc/16/60/49/327166049.db2.gz	REYHJTKYRPLGIY-UHFFFAOYSA-N	1	0	277.371	4.065	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)c1cccc(C2CC2)c1	ZINC000449349192	327166596	/nfs/dbraw/zinc/16/65/96/327166596.db2.gz	JBOIUWAJRKBAJX-IYOUNJFTSA-N	1	0	268.404	4.297	20	30		CIEDRO
N#Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C(F)F)cc1)CC2	ZINC000569397028	327172351	/nfs/dbraw/zinc/17/23/51/327172351.db2.gz	YJPOUWNHRLUGOR-QGZVFWFLSA-N	1	0	298.336	4.273	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)c1ccc(SC)c(F)c1	ZINC000569509119	327186753	/nfs/dbraw/zinc/18/67/53/327186753.db2.gz	WINRRROPJJJQGK-NSHDSACASA-N	1	0	253.386	4.164	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+]CC2(c3ccccc3)CCCCC2)C1	ZINC000569541366	327195306	/nfs/dbraw/zinc/19/53/06/327195306.db2.gz	JZKPVXZRDRLMDH-AEFFLSMTSA-N	1	0	282.431	4.170	20	30		CIEDRO
Cc1nc2c(s1)[C@H]([N@H+](C)CC(C)(C)CCC#N)CCC2	ZINC000093365270	327197803	/nfs/dbraw/zinc/19/78/03/327197803.db2.gz	PTAVIYRHWGJEAY-CQSZACIVSA-N	1	0	291.464	4.091	20	30		CIEDRO
CC[C@H]([NH2+]CCCCC#N)c1ccc(Cl)cc1	ZINC000102396809	327226816	/nfs/dbraw/zinc/22/68/16/327226816.db2.gz	HSPUIJQUBBVZPS-AWEZNQCLSA-N	1	0	250.773	4.075	20	30		CIEDRO
CCC[C@H]1CCCC[C@@H]1[NH2+]C1CCC(C)(C#N)CC1	ZINC000577458836	327260793	/nfs/dbraw/zinc/26/07/93/327260793.db2.gz	AZHQQEJGAARZGX-SOEBMCCKSA-N	1	0	262.441	4.407	20	30		CIEDRO
CC(C)[C@@H]1CC[C@@H]1[NH2+][C@H](CCCC#N)c1ccccc1	ZINC000559862226	327265741	/nfs/dbraw/zinc/26/57/41/327265741.db2.gz	BXBNMDDANZYKLA-KSZLIROESA-N	1	0	270.420	4.446	20	30		CIEDRO
N#CCCCC[N@@H+]1C[C@H]2CCCC[C@]21c1ccccc1	ZINC000152499739	327276820	/nfs/dbraw/zinc/27/68/20/327276820.db2.gz	OGNNOVRROBCKON-MSOLQXFVSA-N	1	0	268.404	4.082	20	30		CIEDRO
N#CCc1ccc(C[NH2+][C@H]2CCSc3ccccc32)cc1	ZINC000564965309	327282113	/nfs/dbraw/zinc/28/21/13/327282113.db2.gz	QTDSMFZQXFNDFG-KRWDZBQOSA-N	1	0	294.423	4.079	20	30		CIEDRO
N#CC1(C[NH2+][C@@H]2CC=C(c3ccc(Cl)cc3)CC2)CC1	ZINC000560145924	327287037	/nfs/dbraw/zinc/28/70/37/327287037.db2.gz	CIAQRYSNNWPWJJ-MRXNPFEDSA-N	1	0	286.806	4.169	20	30		CIEDRO
Cc1ccccc1[C@H](C)[N@H+](CC(C)C)CC1(C#N)CC1	ZINC000560178738	327288828	/nfs/dbraw/zinc/28/88/28/327288828.db2.gz	UXGVCQNEVXXEAK-INIZCTEOSA-N	1	0	270.420	4.318	20	30		CIEDRO
C=CCCCC[NH2+][C@H](C)[C@H]1C[C@@H]1c1ccc(OC)cc1	ZINC000560236573	327292046	/nfs/dbraw/zinc/29/20/46/327292046.db2.gz	ZFGZMHZFOCKLIU-ZTFGCOKTSA-N	1	0	273.420	4.133	20	30		CIEDRO
C=CCCCC[NH2+][C@@H](C)c1ccc(NC(=O)C2CC2)cc1	ZINC000560239289	327292279	/nfs/dbraw/zinc/29/22/79/327292279.db2.gz	IEYALPJHDDMMMD-AWEZNQCLSA-N	1	0	286.419	4.042	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+]CCCCc2ccc(Cl)s2)C1	ZINC000560239026	327292289	/nfs/dbraw/zinc/29/22/89/327292289.db2.gz	VCSHYHTXRMYPMR-NEPJUHHUSA-N	1	0	282.840	4.006	20	30		CIEDRO
C=CCC[C@H](NCC[C@@H](C)[NH+]1CCCCC1)c1ccco1	ZINC000560549745	327323542	/nfs/dbraw/zinc/32/35/42/327323542.db2.gz	HBXZURVVBOLKON-SJORKVTESA-N	1	0	290.451	4.141	20	30		CIEDRO
N#CCCCC[N@@H+]1CCC[C@@H](c2nc3ccccc3s2)C1	ZINC000560818065	327344803	/nfs/dbraw/zinc/34/48/03/327344803.db2.gz	FEMRSFXIAATGMT-CQSZACIVSA-N	1	0	299.443	4.170	20	30		CIEDRO
C[C@@H]([NH2+]CCCc1cccc(Cl)c1)c1ccc(C#N)cc1	ZINC000561480917	327398406	/nfs/dbraw/zinc/39/84/06/327398406.db2.gz	RRQVFVJZCRGXLN-CQSZACIVSA-N	1	0	298.817	4.495	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+]C1(c2ccc(OC)cc2)CC1	ZINC000561840542	327424838	/nfs/dbraw/zinc/42/48/38/327424838.db2.gz	WJRZULVPYPFPTF-HNNXBMFYSA-N	1	0	259.393	4.019	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](C[C@H]1CCOC1)c1ccccc1	ZINC000562505711	327486960	/nfs/dbraw/zinc/48/69/60/327486960.db2.gz	GSXFZUGTTSEFFB-YQVWRLOYSA-N	1	0	287.447	4.489	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H](CC)C(C)(C)C)c1ccc(C#N)cc1	ZINC000562592745	327497050	/nfs/dbraw/zinc/49/70/50/327497050.db2.gz	VZCCPUFJMANAAZ-CVEARBPZSA-N	1	0	258.409	4.424	20	30		CIEDRO
C=C(C)CN1CCC([NH2+][C@@H](C)C[C@H](C)CC(C)C)CC1	ZINC000507482913	332808436	/nfs/dbraw/zinc/80/84/36/332808436.db2.gz	GDTXEKYDRGTBSI-SJORKVTESA-N	1	0	280.500	4.077	20	30		CIEDRO
C=CC[NH2+][C@H](C)c1sc(-c2ccc(C)cc2)nc1C	ZINC000159840836	327570381	/nfs/dbraw/zinc/57/03/81/327570381.db2.gz	BBINMEXPJGGCEO-GFCCVEGCSA-N	1	0	272.417	4.264	20	30		CIEDRO
C=CC[NH2+][C@@H](C)c1sc(-c2ccc(C)cc2)nc1C	ZINC000159840967	327570384	/nfs/dbraw/zinc/57/03/84/327570384.db2.gz	BBINMEXPJGGCEO-LBPRGKRZSA-N	1	0	272.417	4.264	20	30		CIEDRO
CCc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(C#N)cc2)o1	ZINC000154350944	327584000	/nfs/dbraw/zinc/58/40/00/327584000.db2.gz	WGSWUEGLESSSCN-OLZOCXBDSA-N	1	0	268.360	4.125	20	30		CIEDRO
CCc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(C#N)cc2)o1	ZINC000154350841	327584015	/nfs/dbraw/zinc/58/40/15/327584015.db2.gz	WGSWUEGLESSSCN-CHWSQXEVSA-N	1	0	268.360	4.125	20	30		CIEDRO
CC(C)(C#N)CC[NH2+][C@@H]1CCCC[C@H]1C(C)(C)C	ZINC000535664214	328607117	/nfs/dbraw/zinc/60/71/17/328607117.db2.gz	ZPTFRKGNCPCSBV-ZIAGYGMSSA-N	1	0	250.430	4.121	20	30		CIEDRO
CC[C@H]([NH2+]Cc1cccc(C#N)c1)C1CCCCC1	ZINC000052335188	328641277	/nfs/dbraw/zinc/64/12/77/328641277.db2.gz	YOTQXVVIUVVPMV-KRWDZBQOSA-N	1	0	256.393	4.007	20	30		CIEDRO
C[C@H](Nc1cc[nH+]c2ccccc12)c1ccc(C#N)cc1	ZINC000041720816	328714857	/nfs/dbraw/zinc/71/48/57/328714857.db2.gz	NJGITTVOZCVDLX-ZDUSSCGKSA-N	1	0	273.339	4.280	20	30		CIEDRO
CC(C)CCC[C@H](C)[NH2+]Cc1ccc(C#N)cc1F	ZINC000042336085	328763155	/nfs/dbraw/zinc/76/31/55/328763155.db2.gz	QJJLGOOLJUDMOO-ZDUSSCGKSA-N	1	0	262.372	4.002	20	30		CIEDRO
N#CCCC[NH2+][C@H](Cc1ccccc1)C1CCCCC1	ZINC000542498542	328781046	/nfs/dbraw/zinc/78/10/46/328781046.db2.gz	ILKSUBNFCNFTFT-GOSISDBHSA-N	1	0	270.420	4.071	20	30		CIEDRO
N#CCCCC[NH2+][C@H]1CCCC[C@H]1C1CCCCC1	ZINC000532485610	328783625	/nfs/dbraw/zinc/78/36/25/328783625.db2.gz	DEHQROWLVZRROP-IRXDYDNUSA-N	1	0	262.441	4.409	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+]Cc1ccc(-c2ccncc2)cc1	ZINC000532516895	328785655	/nfs/dbraw/zinc/78/56/55/328785655.db2.gz	JZMHJWMPQNRDKV-JKSUJKDBSA-N	1	0	280.415	4.439	20	30		CIEDRO
Cc1ccc(-c2ccc(C[NH+]3CCC(C)(C#N)CC3)o2)cc1	ZINC000507715761	332820382	/nfs/dbraw/zinc/82/03/82/332820382.db2.gz	CRHOJVSGDLUZMT-UHFFFAOYSA-N	1	0	294.398	4.381	20	30		CIEDRO
CC[C@@H](CSc1ccccc1)[NH2+]Cc1ccc(C#N)cc1	ZINC000532783970	328810431	/nfs/dbraw/zinc/81/04/31/328810431.db2.gz	GYZHLQGUWSOAFJ-KRWDZBQOSA-N	1	0	296.439	4.219	20	30		CIEDRO
CC(C)[C@H](C[NH+]1CCC(CC#N)CC1)c1ccccc1	ZINC000526986108	328818110	/nfs/dbraw/zinc/81/81/10/328818110.db2.gz	OJZYKXMFBBVHNX-SFHVURJKSA-N	1	0	270.420	4.052	20	30		CIEDRO
N#Cc1csc(C[NH2+][C@@H](c2ccccc2)C2CCCC2)n1	ZINC000582329905	328962168	/nfs/dbraw/zinc/96/21/68/328962168.db2.gz	POAQOZOOZOXRPK-KRWDZBQOSA-N	1	0	297.427	4.036	20	30		CIEDRO
C[C@H](c1cccc(-c2ccncc2)c1)[N@H+](C)CCCC#N	ZINC000378438351	329049973	/nfs/dbraw/zinc/04/99/73/329049973.db2.gz	ZDZZVCJVBWINMB-OAHLLOKOSA-N	1	0	279.387	4.045	20	30		CIEDRO
CCCOc1ccc([C@@H](C)[NH2+]Cc2cccc(C#N)c2)cc1	ZINC000193871461	329062296	/nfs/dbraw/zinc/06/22/96/329062296.db2.gz	MJTLNYKKAOPBQM-OAHLLOKOSA-N	1	0	294.398	4.198	20	30		CIEDRO
C=CCC[C@@H]([NH2+][C@@H](C)c1nccn1-c1ccccc1)C1CC1	ZINC000582505154	329098512	/nfs/dbraw/zinc/09/85/12/329098512.db2.gz	QXKZHJITZXJUMJ-MAUKXSAKSA-N	1	0	295.430	4.268	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1cc(C#N)ccc1F)c1ccc(F)cc1	ZINC000174265710	329156025	/nfs/dbraw/zinc/15/60/25/329156025.db2.gz	AENYEGOPTLLMCX-QGZVFWFLSA-N	1	0	286.325	4.077	20	30		CIEDRO
COc1ccccc1[C@H]1CCC[N@@H+]1CCCC(C)(C)C#N	ZINC000174844341	329163766	/nfs/dbraw/zinc/16/37/66/329163766.db2.gz	OVFHAFCVYNKRBN-MRXNPFEDSA-N	1	0	286.419	4.162	20	30		CIEDRO
CN(C)c1cccc([C@H]2CCC[N@@H+]2CCCC(C)(C)C#N)c1	ZINC000174867644	329164359	/nfs/dbraw/zinc/16/43/59/329164359.db2.gz	BDFMYGWBBAWBBE-GOSISDBHSA-N	1	0	299.462	4.219	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1cn2ccsc2n1)c1ccccc1	ZINC000178757956	329200243	/nfs/dbraw/zinc/20/02/43/329200243.db2.gz	FUUZNTJCYFCCBA-INIZCTEOSA-N	1	0	297.427	4.193	20	30		CIEDRO
N#CCCCC[NH2+][C@H]1CCc2c1ccc(Cl)c2Cl	ZINC000178649991	329201635	/nfs/dbraw/zinc/20/16/35/329201635.db2.gz	GZJQXKPZNJCCTP-ZDUSSCGKSA-N	1	0	283.202	4.264	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ncc(C)s1)c1ccccc1	ZINC000178761060	329202520	/nfs/dbraw/zinc/20/25/20/329202520.db2.gz	STPMMEXYVPBRQW-HNNXBMFYSA-N	1	0	272.417	4.249	20	30		CIEDRO
C=CCSCC[NH2+][C@H]1CCSc2ccc(Cl)cc21	ZINC000221946129	329215741	/nfs/dbraw/zinc/21/57/41/329215741.db2.gz	JEVNFVMROOKICS-ZDUSSCGKSA-N	1	0	299.892	4.386	20	30		CIEDRO
C=CCSCC[NH2+][C@@H]1CCSc2ccc(Cl)cc21	ZINC000221946061	329215845	/nfs/dbraw/zinc/21/58/45/329215845.db2.gz	JEVNFVMROOKICS-CYBMUJFWSA-N	1	0	299.892	4.386	20	30		CIEDRO
C=CC[C@@H](C)[C@@H](C)[NH2+]CCc1nc2ccccc2s1	ZINC000583111008	329312983	/nfs/dbraw/zinc/31/29/83/329312983.db2.gz	DHRSDDHXTLUTJP-CHWSQXEVSA-N	1	0	274.433	4.029	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1cc(F)ccc1F	ZINC000185840875	329330142	/nfs/dbraw/zinc/33/01/42/329330142.db2.gz	KZSAGCDSWOPMBR-RBOXIYTFSA-N	1	0	278.346	4.088	20	30		CIEDRO
CC(C)(CCC#N)C[N@@H+]1CC[C@H](c2c(F)cccc2F)C1	ZINC000187594952	329359495	/nfs/dbraw/zinc/35/94/95/329359495.db2.gz	BYMYXINJXONRNZ-ZDUSSCGKSA-N	1	0	292.373	4.084	20	30		CIEDRO
CCC[C@H](C[NH2+]CC(C)(C)CC#N)c1ccccc1	ZINC000459737164	329374668	/nfs/dbraw/zinc/37/46/68/329374668.db2.gz	VVFYMFUXQLXYPY-MRXNPFEDSA-N	1	0	258.409	4.100	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](CC(F)(F)F)c1ccc(F)cc1	ZINC000509021857	332856016	/nfs/dbraw/zinc/85/60/16/332856016.db2.gz	MRFYFJDEEBBDQR-CYBMUJFWSA-N	1	0	275.289	4.375	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](C)c1ccc(OC)cc1F	ZINC000398208152	329438217	/nfs/dbraw/zinc/43/82/17/329438217.db2.gz	ZFCVEMRWKXBUFL-QWHCGFSZSA-N	1	0	265.372	4.230	20	30		CIEDRO
N#CCc1ccc(C[NH2+][C@H](c2ccc(F)cc2)C2CC2)cc1	ZINC000583895214	329530493	/nfs/dbraw/zinc/53/04/93/329530493.db2.gz	CBAMQTHGPIIZEK-IBGZPJMESA-N	1	0	294.373	4.133	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)c1ccc(F)cc1F	ZINC000248901663	329902012	/nfs/dbraw/zinc/90/20/12/329902012.db2.gz	UMDVDOGZBFFZRD-FFSVYQOJSA-N	1	0	278.346	4.088	20	30		CIEDRO
Cc1ccc2c(c1)[C@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)CCC2	ZINC000249035556	329903865	/nfs/dbraw/zinc/90/38/65/329903865.db2.gz	SLQPIERHLMZDDU-QGPMSJSTSA-N	1	0	268.404	4.044	20	30		CIEDRO
C#CC[C@H]([NH2+][C@H](C)c1ccc(OC)c(F)c1)c1ccccc1	ZINC000271414761	330079769	/nfs/dbraw/zinc/07/97/69/330079769.db2.gz	BDUIULINIWLMKU-KDOFPFPSSA-N	1	0	297.373	4.250	20	30		CIEDRO
C#CC[C@H]([NH2+][C@@H]1CCCc2nc(C)sc21)c1ccccc1	ZINC000271454737	330079863	/nfs/dbraw/zinc/07/98/63/330079863.db2.gz	GQDGXFCLJNSSIW-DOTOQJQBSA-N	1	0	296.439	4.183	20	30		CIEDRO
C#CC[C@H]([NH2+][C@@H](C)c1ccc(OC)c(F)c1)c1ccccc1	ZINC000271414764	330079996	/nfs/dbraw/zinc/07/99/96/330079996.db2.gz	BDUIULINIWLMKU-KSSFIOAISA-N	1	0	297.373	4.250	20	30		CIEDRO
C#CC[C@H]([NH2+][C@@H](C)c1ccc(C)s1)c1ccccc1	ZINC000271440094	330080098	/nfs/dbraw/zinc/08/00/98/330080098.db2.gz	FCPBUAGQCRQDJS-HOCLYGCPSA-N	1	0	269.413	4.472	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@H](C)c1ccc(OC)cc1)c1ccccc1	ZINC000271414595	330080296	/nfs/dbraw/zinc/08/02/96/330080296.db2.gz	BAZVWBGAXOTITH-DNVCBOLYSA-N	1	0	279.383	4.110	20	30		CIEDRO
C#CC[C@H]([NH2+][C@H](C)c1cccc(OC)c1)c1ccccc1	ZINC000271534105	330081199	/nfs/dbraw/zinc/08/11/99/330081199.db2.gz	PZEKUTVTXVDTJH-BEFAXECRSA-N	1	0	279.383	4.110	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@H]1CCc2ccccc21)c1ccccc1	ZINC000271556027	330081407	/nfs/dbraw/zinc/08/14/07/330081407.db2.gz	SSGSQBLCUZGVPK-MOPGFXCFSA-N	1	0	261.368	4.028	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@H]1CCO[C@H](c2ccc(F)cc2)C1	ZINC000273468828	330093175	/nfs/dbraw/zinc/09/31/75/330093175.db2.gz	RPZFEIGYXBAGQC-USJZOSNVSA-N	1	0	291.410	4.236	20	30		CIEDRO
CC(C)CC[C@@H]([NH2+]Cc1ccc(C#N)s1)c1ccoc1	ZINC000421848873	330095738	/nfs/dbraw/zinc/09/57/38/330095738.db2.gz	ARAKDGICEJWVGB-MRXNPFEDSA-N	1	0	288.416	4.480	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@@H](C)c1ccc(C)cc1O)c1ccccc1	ZINC000273545326	330097017	/nfs/dbraw/zinc/09/70/17/330097017.db2.gz	ZDZKJGGXZOTPKS-MAUKXSAKSA-N	1	0	279.383	4.116	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)s1)c1cc2c(s1)CCC2	ZINC000421871901	330100546	/nfs/dbraw/zinc/10/05/46/330100546.db2.gz	GIGRIZJLRGUOJT-JTQLQIEISA-N	1	0	288.441	4.021	20	30		CIEDRO
Cc1ccc([C@@H]([NH2+]Cc2ccc(C#N)s2)C2CCC2)o1	ZINC000421879534	330102043	/nfs/dbraw/zinc/10/20/43/330102043.db2.gz	NHSDWGGQZADZOU-INIZCTEOSA-N	1	0	286.400	4.152	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@@H]1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000273468826	330103878	/nfs/dbraw/zinc/10/38/78/330103878.db2.gz	RPZFEIGYXBAGQC-LBTBCDHLSA-N	1	0	291.410	4.236	20	30		CIEDRO
C#CC[C@H]([NH2+][C@@H](C)c1sccc1OC)c1ccccc1	ZINC000274568929	330106470	/nfs/dbraw/zinc/10/64/70/330106470.db2.gz	IKWNLXZTWWVIDX-ZFWWWQNUSA-N	1	0	285.412	4.172	20	30		CIEDRO
C=C(C)[C@H]([NH2+]CCC(F)(F)F)c1ccc(F)c(F)c1	ZINC000274852562	330108187	/nfs/dbraw/zinc/10/81/87/330108187.db2.gz	GGSKCPLSJMKDPX-LBPRGKRZSA-N	1	0	279.252	4.124	20	30		CIEDRO
N#CCC1CC[NH+](CCc2cccc(Cl)c2Cl)CC1	ZINC000572831040	330110061	/nfs/dbraw/zinc/11/00/61/330110061.db2.gz	LVJRBBGCCREOLA-UHFFFAOYSA-N	1	0	297.229	4.162	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1nc2ccccc2n1C(F)F	ZINC000275466020	330110074	/nfs/dbraw/zinc/11/00/74/330110074.db2.gz	NMTCOBLTIKCVAQ-NSHDSACASA-N	1	0	279.334	4.048	20	30		CIEDRO
C=C(C[NH2+][C@H](C)c1cnn(C(C)C)c1C)c1ccccc1	ZINC000276347633	330113150	/nfs/dbraw/zinc/11/31/50/330113150.db2.gz	KPUFXCYFCJYXGZ-OAHLLOKOSA-N	1	0	283.419	4.136	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@H](C)c1c(C)noc1C)c1ccco1	ZINC000279138513	330121814	/nfs/dbraw/zinc/12/18/14/330121814.db2.gz	YXOQVZQSBPWBTR-WFASDCNBSA-N	1	0	288.391	4.285	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1cccc2c1CCCN2)c1ccco1	ZINC000423414663	330197712	/nfs/dbraw/zinc/19/77/12/330197712.db2.gz	NHWJVKCHPQUDOA-SFHVURJKSA-N	1	0	296.414	4.435	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@H]1CC(C)(C)Oc2ccc(N)cc21	ZINC000423449086	330202642	/nfs/dbraw/zinc/20/26/42/330202642.db2.gz	WAAYIGDKBUQDHP-HOCLYGCPSA-N	1	0	288.435	4.205	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@H](Cc2ccccc2)c2ccccc2)C1	ZINC000424116971	330243627	/nfs/dbraw/zinc/24/36/27/330243627.db2.gz	CDQZILQWLLURFZ-YZGWKJHDSA-N	1	0	290.410	4.252	20	30		CIEDRO
C=C(C)COCC[NH2+][C@H](C)c1cc(Cl)cc(Cl)c1	ZINC000536844729	330246524	/nfs/dbraw/zinc/24/65/24/330246524.db2.gz	KEFMHCOVQLUFIP-LLVKDONJSA-N	1	0	288.218	4.237	20	30		CIEDRO
C=C(C)COCC[NH2+][C@@H](C)c1cc(Cl)cc(Cl)c1	ZINC000536844756	330246564	/nfs/dbraw/zinc/24/65/64/330246564.db2.gz	KEFMHCOVQLUFIP-NSHDSACASA-N	1	0	288.218	4.237	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+]Cc1nnc(C(C)(C)C)s1	ZINC000536848035	330249429	/nfs/dbraw/zinc/24/94/29/330249429.db2.gz	WQXUSHVWXPZFBZ-LBPRGKRZSA-N	1	0	281.469	4.060	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc(C(C)(C)C)cc1	ZINC000424120901	330250443	/nfs/dbraw/zinc/25/04/43/330250443.db2.gz	HNLHYHSOYXJLEB-GRDNDAEWSA-N	1	0	270.420	4.327	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](CC)c1ccc(OC(F)F)cc1	ZINC000536857896	330252206	/nfs/dbraw/zinc/25/22/06/330252206.db2.gz	MRQUWBZGKZEOEU-BXUZGUMPSA-N	1	0	269.335	4.293	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](CC)c1ccc(OC(F)F)cc1	ZINC000536857913	330252495	/nfs/dbraw/zinc/25/24/95/330252495.db2.gz	MRQUWBZGKZEOEU-SMDDNHRTSA-N	1	0	269.335	4.293	20	30		CIEDRO
CC[C@@H](CCc1ccccc1)[NH2+]Cc1ccc(C#N)s1	ZINC000527759879	330281269	/nfs/dbraw/zinc/28/12/69/330281269.db2.gz	CCVYGGGXZURULV-HNNXBMFYSA-N	1	0	284.428	4.121	20	30		CIEDRO
Cc1cccc([C@H]([NH2+]Cc2ccc(C#N)cc2)C(C)C)c1	ZINC000527814112	330284978	/nfs/dbraw/zinc/28/49/78/330284978.db2.gz	OPTFWHSGHYSSGG-LJQANCHMSA-N	1	0	278.399	4.354	20	30		CIEDRO
Cc1cccc([C@H]([NH2+]Cc2cccc(C#N)c2)C(C)C)c1	ZINC000527814285	330284990	/nfs/dbraw/zinc/28/49/90/330284990.db2.gz	QFPXISGXXCZXSJ-LJQANCHMSA-N	1	0	278.399	4.354	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccc(C#N)s1)c1cc(C)ccc1C	ZINC000527821403	330286319	/nfs/dbraw/zinc/28/63/19/330286319.db2.gz	NUUKHOHBQASZCE-QGZVFWFLSA-N	1	0	284.428	4.478	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CC[C@H](C#N)C1)c1cc(C)ccc1C	ZINC000527890483	330292251	/nfs/dbraw/zinc/29/22/51/330292251.db2.gz	ILHXGZQMCMZCCV-ZOBUZTSGSA-N	1	0	256.393	4.036	20	30		CIEDRO
CC[C@@H](CCc1ccccc1)[NH2+]CC1CCC(C#N)CC1	ZINC000527891470	330292353	/nfs/dbraw/zinc/29/23/53/330292353.db2.gz	AQCPFBLINILFRN-ACBHZAAOSA-N	1	0	284.447	4.317	20	30		CIEDRO
CCC(F)(F)C(C)(C)C[NH2+][C@@H]1CCc2ccc(C#N)cc21	ZINC000527985961	330298774	/nfs/dbraw/zinc/29/87/74/330298774.db2.gz	OALIGWBUIDBKCO-OAHLLOKOSA-N	1	0	292.373	4.207	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1F)c1ccc(C#N)cc1	ZINC000036921944	330313880	/nfs/dbraw/zinc/31/38/80/330313880.db2.gz	CJYHVYUMRZSTJO-NEPJUHHUSA-N	1	0	286.325	4.248	20	30		CIEDRO
N#CCCCC[N@@H+](Cc1cccc(F)c1)C1CCCC1	ZINC000533026995	330324704	/nfs/dbraw/zinc/32/47/04/330324704.db2.gz	GOFGYCWIIQDQTN-UHFFFAOYSA-N	1	0	274.383	4.264	20	30		CIEDRO
C[C@@H](c1ccc(Cl)cc1)[N@H+](C)Cc1cccc(C#N)c1	ZINC000044894262	330333733	/nfs/dbraw/zinc/33/37/33/330333733.db2.gz	BARSNJPJMKQZLO-ZDUSSCGKSA-N	1	0	284.790	4.405	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@H](C)[C@H](C)c1ccc(Cl)cc1	ZINC000424293770	330335410	/nfs/dbraw/zinc/33/54/10/330335410.db2.gz	JFOFPZCNAPHEBF-YXPYIKCWSA-N	1	0	293.838	4.013	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@@H](C)c1ccc(SCC)cc1	ZINC000424294734	330335697	/nfs/dbraw/zinc/33/56/97/330335697.db2.gz	LJIYSYWSVIYRQD-QRTARXTBSA-N	1	0	291.460	4.040	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)C1(c2ccccc2)CCCC1	ZINC000424317656	330339786	/nfs/dbraw/zinc/33/97/86/330339786.db2.gz	CCTSGQZHSSTANA-XYJFISCASA-N	1	0	282.431	4.169	20	30		CIEDRO
CC(C)CC[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccoc1	ZINC000424320263	330340077	/nfs/dbraw/zinc/34/00/77/330340077.db2.gz	FYHLIFUWJBKHCM-NUEKZKHPSA-N	1	0	260.381	4.039	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@H](c2ccc(F)cc2)C2CCCC2)C1	ZINC000424322259	330340498	/nfs/dbraw/zinc/34/04/98/330340498.db2.gz	IGSKPPYZVMEFPB-VHSSKADRSA-N	1	0	286.394	4.339	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccccc1C(F)(F)F	ZINC000424323350	330340588	/nfs/dbraw/zinc/34/05/88/330340588.db2.gz	IZPNLHVGILRPNU-SDDRHHMPSA-N	1	0	282.309	4.048	20	30		CIEDRO
CCOc1ccc(Cl)cc1[C@H](C)[NH2+][C@@H]1CC[C@H](C#N)C1	ZINC000424329095	330341816	/nfs/dbraw/zinc/34/18/16/330341816.db2.gz	OZEYHEODXNSTJM-SGMGOOAPSA-N	1	0	292.810	4.082	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc(-c2ccccc2)o1	ZINC000424330511	330342115	/nfs/dbraw/zinc/34/21/15/330342115.db2.gz	QWNWWUIKKJQDTB-IJEWVQPXSA-N	1	0	280.371	4.289	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc(-c2ccccc2)o1	ZINC000424330513	330342163	/nfs/dbraw/zinc/34/21/63/330342163.db2.gz	QWNWWUIKKJQDTB-OFQRWUPVSA-N	1	0	280.371	4.289	20	30		CIEDRO
CC(C)[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@H](C#N)C2)c2ccccc21	ZINC000424331175	330342271	/nfs/dbraw/zinc/34/22/71/330342271.db2.gz	RTPMLBOLUSCGJX-DACLVMHWSA-N	1	0	268.404	4.153	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@H](C2CCC2)C2CCCCC2)C1	ZINC000424336673	330343354	/nfs/dbraw/zinc/34/33/54/330343354.db2.gz	YFMIPPOLOQIZRO-COXVUDFISA-N	1	0	260.425	4.017	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@@H](C2CCC2)C2CCCCC2)C1	ZINC000424336674	330343478	/nfs/dbraw/zinc/34/34/78/330343478.db2.gz	YFMIPPOLOQIZRO-XOKHGSTOSA-N	1	0	260.425	4.017	20	30		CIEDRO
C=CCCC[N@@H+](C)[C@@H](C)C(=O)Nc1cccc2ccccc21	ZINC000533301455	330356734	/nfs/dbraw/zinc/35/67/34/330356734.db2.gz	SSDOLMQZOQPVHO-HNNXBMFYSA-N	1	0	296.414	4.065	20	30		CIEDRO
C[C@H]([NH2+]Cc1cccc(C#N)c1)c1ccc(Cl)c(F)c1	ZINC000213687029	330371185	/nfs/dbraw/zinc/37/11/85/330371185.db2.gz	IVDWVJRWSWWUQA-NSHDSACASA-N	1	0	288.753	4.202	20	30		CIEDRO
CC[N@H+](CCCC(C)(C)C#N)[C@@H]1CCCC[C@@H]1C	ZINC000120156278	330385947	/nfs/dbraw/zinc/38/59/47/330385947.db2.gz	HTFXNEWTECWHMZ-LSDHHAIUSA-N	1	0	250.430	4.217	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1coc(-c2cccs2)n1)C1CC1	ZINC000120526458	330389232	/nfs/dbraw/zinc/38/92/32/330389232.db2.gz	LHSAKOVMYPUZMT-AWEZNQCLSA-N	1	0	288.416	4.238	20	30		CIEDRO
C=CCCC[C@@H](C)[N@@H+]1CCc2ccc(C(C)=O)cc2CC1	ZINC000537034742	330391959	/nfs/dbraw/zinc/39/19/59/330391959.db2.gz	WEGIXVICKONSIF-OAHLLOKOSA-N	1	0	285.431	4.035	20	30		CIEDRO
C=CCCC[C@H](C)[N@@H+]1CCc2ccc(C(C)=O)cc2CC1	ZINC000537034741	330392011	/nfs/dbraw/zinc/39/20/11/330392011.db2.gz	WEGIXVICKONSIF-HNNXBMFYSA-N	1	0	285.431	4.035	20	30		CIEDRO
C=CCCC[C@@H](C)[N@H+]1CC=C(c2c[nH]c3ncccc23)CC1	ZINC000537049185	330394719	/nfs/dbraw/zinc/39/47/19/330394719.db2.gz	WWEWXKALUKOJLO-OAHLLOKOSA-N	1	0	295.430	4.397	20	30		CIEDRO
N#CCCC[NH2+][C@H](c1ccc(Cl)cc1)C1CCCC1	ZINC000537105724	330400317	/nfs/dbraw/zinc/40/03/17/330400317.db2.gz	UNWPAAVDLGEXLR-INIZCTEOSA-N	1	0	276.811	4.465	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1nc(C(C)C)cs1)C1CC1	ZINC000121705452	330405957	/nfs/dbraw/zinc/40/59/57/330405957.db2.gz	TUIWQYANIOUYQZ-CYBMUJFWSA-N	1	0	264.438	4.101	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccc(C#N)cc1OC(F)F)C(C)(C)C	ZINC000537290105	330431074	/nfs/dbraw/zinc/43/10/74/330431074.db2.gz	HHQMTNQJLUHQJZ-CQSZACIVSA-N	1	0	296.361	4.074	20	30		CIEDRO
C[C@H]([NH2+][C@H]1C[C@H](C)C[C@H](C)C1)c1ccc(C#N)c(F)c1	ZINC000537409630	330435057	/nfs/dbraw/zinc/43/50/57/330435057.db2.gz	ZDPQATAYYBCLPM-RSUWNVLCSA-N	1	0	274.383	4.173	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+]Cc1ccccc1CC	ZINC000084200399	330485112	/nfs/dbraw/zinc/48/51/12/330485112.db2.gz	DDXCHZXAKWLBDO-UHFFFAOYSA-N	1	0	281.399	4.104	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+]Cc1oc(CCC)nc1C	ZINC000426331627	330504606	/nfs/dbraw/zinc/50/46/06/330504606.db2.gz	SXIDALCAQYVWNF-AWEZNQCLSA-N	1	0	264.413	4.160	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH+]2CCC(CCc3ccccc3)CC2)C1	ZINC000429702367	330552750	/nfs/dbraw/zinc/55/27/50/330552750.db2.gz	NRWLUPZDMPXWDT-RTBURBONSA-N	1	0	282.431	4.023	20	30		CIEDRO
N#CCC1(C[NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)CC1	ZINC000430738551	330572036	/nfs/dbraw/zinc/57/20/36/330572036.db2.gz	BDNAJOBWCDJGKI-OAHLLOKOSA-N	1	0	274.795	4.075	20	30		CIEDRO
N#CCC1(C[NH2+][C@@H]2CCc3cc(Cl)cc(Cl)c32)CC1	ZINC000430747194	330572696	/nfs/dbraw/zinc/57/26/96/330572696.db2.gz	KOZDVQAIGFOSRN-CYBMUJFWSA-N	1	0	295.213	4.264	20	30		CIEDRO
N#CCC1(C[NH2+][C@H](CC2CCC2)c2ccccc2)CC1	ZINC000430747568	330572737	/nfs/dbraw/zinc/57/27/37/330572737.db2.gz	XZVHHZOHTOFQGG-QGZVFWFLSA-N	1	0	268.404	4.201	20	30		CIEDRO
CCc1nc(C)c(C[NH2+][C@@H](CCCC#N)c2ccccc2)o1	ZINC000433020090	330612366	/nfs/dbraw/zinc/61/23/66/330612366.db2.gz	BINJHWNNCFLPEN-INIZCTEOSA-N	1	0	297.402	4.070	20	30		CIEDRO
CC/C=C\CC[NH2+][C@@H](CCCC#N)c1ccccc1	ZINC000433027739	330613125	/nfs/dbraw/zinc/61/31/25/330613125.db2.gz	WREALPBOKLVMQH-LIMHQNJXSA-N	1	0	256.393	4.367	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+]C[C@H](CCC)c1ccccc1	ZINC000435726030	330660942	/nfs/dbraw/zinc/66/09/42/330660942.db2.gz	LBGGRYUWFQBUQM-OTWHNJEPSA-N	1	0	287.447	4.141	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@@H](C)[C@@H](C)C1CCCCC1	ZINC000436291323	330673755	/nfs/dbraw/zinc/67/37/55/330673755.db2.gz	PZBGXMCHQUAGIN-ATLSCFEFSA-N	1	0	279.468	4.162	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@@H](C)c1cc(C)c(C)cc1C	ZINC000436292321	330673906	/nfs/dbraw/zinc/67/39/06/330673906.db2.gz	MYQZKDWHCOHQAQ-SCTDSRPQSA-N	1	0	287.447	4.244	20	30		CIEDRO
C=CC[C@@H](C)[C@H](C)[NH2+]CCc1ccc(SC)cc1	ZINC000436295684	330674280	/nfs/dbraw/zinc/67/42/80/330674280.db2.gz	QBFZKNAMYGEJMY-KGLIPLIRSA-N	1	0	263.450	4.141	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@@H](C)c1oc2ccccc2c1C	ZINC000436303608	330674738	/nfs/dbraw/zinc/67/47/38/330674738.db2.gz	DDTYUBXWAHRBIT-DAYGRLMNSA-N	1	0	299.414	4.373	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@H](CC)c1ccc(CC)cc1	ZINC000436308512	330675125	/nfs/dbraw/zinc/67/51/25/330675125.db2.gz	UKTLXFOSEYUBPM-QRVBRYPASA-N	1	0	287.447	4.271	20	30		CIEDRO
C=CCC[C@@H]([NH2+][C@H]1C[C@H](c2ccccc2)C1)C1CC1	ZINC000436309246	330675287	/nfs/dbraw/zinc/67/52/87/330675287.db2.gz	OBBMMWBTYZSASV-KZNAEPCWSA-N	1	0	255.405	4.267	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@H](C)C[C@@H](C)CC(C)C	ZINC000436309691	330675291	/nfs/dbraw/zinc/67/52/91/330675291.db2.gz	PFPTZIWORQTKQX-HZMVEIRTSA-N	1	0	267.457	4.018	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@@H]1CCC[C@@H]1CCC(C)C	ZINC000436318496	330675760	/nfs/dbraw/zinc/67/57/60/330675760.db2.gz	YNHMSNRPIDAITQ-TVFCKZIOSA-N	1	0	279.468	4.162	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+]Cc1cc2c(cccc2F)[nH]1	ZINC000436414847	330677225	/nfs/dbraw/zinc/67/72/25/330677225.db2.gz	PYYOEHODQRJGQM-LBPRGKRZSA-N	1	0	260.356	4.141	20	30		CIEDRO
C[C@H](C[NH2+]CC1CCC(C#N)CC1)c1cccc(Cl)c1	ZINC000441376493	330767009	/nfs/dbraw/zinc/76/70/09/330767009.db2.gz	APKSBJAVLNEQOI-WLYUNCDWSA-N	1	0	290.838	4.363	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@H](c2ccccc2)c2cccc(F)c2)C1	ZINC000442796772	330784378	/nfs/dbraw/zinc/78/43/78/330784378.db2.gz	WATDNWKSZWQUSI-MDASCCDHSA-N	1	0	294.373	4.197	20	30		CIEDRO
Cc1cccc(-c2cccc(C[NH2+][C@@H]3CC[C@@H](C#N)C3)c2)c1	ZINC000442798506	330784574	/nfs/dbraw/zinc/78/45/74/330784574.db2.gz	YCNCRLFUYUBKBH-OXQOHEQNSA-N	1	0	290.410	4.444	20	30		CIEDRO
CC1(C)CC[C@H](C[NH2+][C@@H]2CC[C@H](C#N)C2)c2ccccc21	ZINC000442842801	330786385	/nfs/dbraw/zinc/78/63/85/330786385.db2.gz	ITYHRRYFTGUQSM-ARFHVFGLSA-N	1	0	282.431	4.123	20	30		CIEDRO
C[C@H]([NH2+]CC1CCC(C#N)CC1)c1cc2c(s1)CCC2	ZINC000442855136	330787393	/nfs/dbraw/zinc/78/73/93/330787393.db2.gz	MFOLNTSHSCXBAD-HSBZDZAISA-N	1	0	288.460	4.217	20	30		CIEDRO
CCC[C@H](C)[C@H](CC)[NH2+]CC1CCC(C#N)CC1	ZINC000442876910	330789744	/nfs/dbraw/zinc/78/97/44/330789744.db2.gz	SKHHYIVQYIYBEB-LBDPXKHJSA-N	1	0	250.430	4.121	20	30		CIEDRO
CC1=CCC[C@H](C)[C@@H]1C[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000443641546	330804559	/nfs/dbraw/zinc/80/45/59/330804559.db2.gz	LYMZLHLDJJOSGJ-RLFYNMQTSA-N	1	0	268.404	4.201	20	30		CIEDRO
Cc1cc(C[NH2+][C@H]2CCCc3sccc32)ccc1C#N	ZINC000443992794	330808682	/nfs/dbraw/zinc/80/86/82/330808682.db2.gz	YDSHCBJJTKLWKN-INIZCTEOSA-N	1	0	282.412	4.095	20	30		CIEDRO
Cc1cnc([C@@H]([NH2+]CCCCC(C)(C)C#N)C2CC2)s1	ZINC000444689174	330819743	/nfs/dbraw/zinc/81/97/43/330819743.db2.gz	MNEUJFWFQGMPBR-AWEZNQCLSA-N	1	0	291.464	4.212	20	30		CIEDRO
Fc1ccc(C#CC[NH2+][C@@H]2CCC[C@@H]2c2ccccc2)cc1	ZINC000445997916	330842373	/nfs/dbraw/zinc/84/23/73/330842373.db2.gz	CXTOCZUFHWFLJV-WOJBJXKFSA-N	1	0	293.385	4.103	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@H]2CCC[C@@H](c3ccccc3)C2)C1	ZINC000446973934	330859076	/nfs/dbraw/zinc/85/90/76/330859076.db2.gz	GKEXGYORWUGYRE-YSHGAJCASA-N	1	0	282.431	4.385	20	30		CIEDRO
CC(C)[C@@H]1CCCC[C@H]1[NH2+]CCCC(C)(C)C#N	ZINC000160364475	330863324	/nfs/dbraw/zinc/86/33/24/330863324.db2.gz	YIVSVGWMYGQIGE-LSDHHAIUSA-N	1	0	250.430	4.121	20	30		CIEDRO
CC[C@H]([NH2+]C[C@@H]1CCc2ccccc21)c1ccc(C#N)cc1	ZINC000447525525	330867848	/nfs/dbraw/zinc/86/78/48/330867848.db2.gz	AIUDWVQIGKSKPJ-ICSRJNTNSA-N	1	0	290.410	4.329	20	30		CIEDRO
CC[C@@H]([NH2+]CCCNc1ccccc1)c1ccc(C#N)cc1	ZINC000447538338	330868839	/nfs/dbraw/zinc/86/88/39/330868839.db2.gz	BEWBWEDRYIEGTF-LJQANCHMSA-N	1	0	293.414	4.101	20	30		CIEDRO
CCc1ccccc1C[NH2+][C@H](CC)c1ccc(C#N)cc1	ZINC000447539941	330868948	/nfs/dbraw/zinc/86/89/48/330868948.db2.gz	IKRAGAYQQHUUHX-LJQANCHMSA-N	1	0	278.399	4.362	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+]CCc2cccc(Cl)c2Cl)C1	ZINC000447539778	330869021	/nfs/dbraw/zinc/86/90/21/330869021.db2.gz	HKPFGFGZTYZXAM-AAEUAGOBSA-N	1	0	297.229	4.208	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CCC[C@H](C)C1)c1ccc(C#N)cc1	ZINC000447545395	330869423	/nfs/dbraw/zinc/86/94/23/330869423.db2.gz	XXVHXFAAUDYBFI-XKQJLSEDSA-N	1	0	256.393	4.178	20	30		CIEDRO
Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH2+][C@@H]1CCC[C@@H](C#N)C1	ZINC000447545590	330869498	/nfs/dbraw/zinc/86/94/98/330869498.db2.gz	ROMQPTJLFJZFPO-FMKPAKJESA-N	1	0	286.419	4.274	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CCC[C@H]1CC)c1ccc(C#N)cc1	ZINC000447585169	330871615	/nfs/dbraw/zinc/87/16/15/330871615.db2.gz	IYONXTHFTIUMTJ-HYVNUMGLSA-N	1	0	256.393	4.178	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CCC[C@@H]1CC)c1ccc(C#N)cc1	ZINC000447585168	330871622	/nfs/dbraw/zinc/87/16/22/330871622.db2.gz	IYONXTHFTIUMTJ-BHYGNILZSA-N	1	0	256.393	4.178	20	30		CIEDRO
C=C(C)C[NH2+][C@@H](C)c1cc(F)c(Cl)cc1Cl	ZINC000160760090	330874358	/nfs/dbraw/zinc/87/43/58/330874358.db2.gz	DKZWAGJTRIDKSC-QMMMGPOBSA-N	1	0	262.155	4.359	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@@H]2CC[C@@H]3CCCC[C@H]3C2)CC1	ZINC000449067943	330896801	/nfs/dbraw/zinc/89/68/01/330896801.db2.gz	PGPBZJXGJXEMJE-RXRGVVTNSA-N	1	0	274.452	4.407	20	30		CIEDRO
CCCOc1ccc(C[NH2+]C2CCC(C)(C#N)CC2)cc1	ZINC000449093442	330898535	/nfs/dbraw/zinc/89/85/35/330898535.db2.gz	XATKHOFXYZIVOC-UHFFFAOYSA-N	1	0	286.419	4.037	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+][C@H](C)c1nc(C)cs1	ZINC000449115557	330899896	/nfs/dbraw/zinc/89/98/96/330899896.db2.gz	HYJSTCNOYAUJEX-DGCLKSJQSA-N	1	0	252.427	4.237	20	30		CIEDRO
Cc1[nH]c2ccccc2c1CC[NH2+]C1CCC(C)(C#N)CC1	ZINC000449117650	330900042	/nfs/dbraw/zinc/90/00/42/330900042.db2.gz	VJJARMMULVQJAP-UHFFFAOYSA-N	1	0	295.430	4.081	20	30		CIEDRO
N#CCCCC[NH2+][C@@H]1CC[C@@H](c2ccc(Cl)cc2)C1	ZINC000449131151	330900888	/nfs/dbraw/zinc/90/08/88/330900888.db2.gz	KKAPEIADAMAAMK-GDBMZVCRSA-N	1	0	276.811	4.260	20	30		CIEDRO
N#CCCCC[NH2+][C@H]1CCC[C@H]1Cc1ccc(Cl)cc1	ZINC000449130911	330900939	/nfs/dbraw/zinc/90/09/39/330900939.db2.gz	IVVKVJPADFISAS-RDJZCZTQSA-N	1	0	290.838	4.335	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@H]2CCC[C@H]2Cc2ccccc2)CC1	ZINC000449165205	330902845	/nfs/dbraw/zinc/90/28/45/330902845.db2.gz	UNNKJAGVLYCFSH-IQNGYNMSSA-N	1	0	296.458	4.460	20	30		CIEDRO
CCC(CC)(CC)C[NH2+]C1CCC(C)(C#N)CC1	ZINC000449192731	330905310	/nfs/dbraw/zinc/90/53/10/330905310.db2.gz	VHCLGJOXYBYKDZ-UHFFFAOYSA-N	1	0	250.430	4.265	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+][C@@H]1CCc2cn(C(C)C)nc2C1	ZINC000449194575	330905381	/nfs/dbraw/zinc/90/53/81/330905381.db2.gz	TUCWCXIDCDARHT-NVXWUHKLSA-N	1	0	289.467	4.046	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+][C@H](CC)c1c(C)noc1C	ZINC000449217411	330906931	/nfs/dbraw/zinc/90/69/31/330906931.db2.gz	ZAQHCDIHZOLRGM-IUODEOHRSA-N	1	0	264.413	4.467	20	30		CIEDRO
CSc1ccc(CC[NH2+]C2CCC(C)(C#N)CC2)cc1	ZINC000449300493	330913135	/nfs/dbraw/zinc/91/31/35/330913135.db2.gz	OSSGFMHITHNNNU-UHFFFAOYSA-N	1	0	288.460	4.013	20	30		CIEDRO
CCCOC1(C[NH2+]C2CCC(C)(C#N)CC2)CCCCC1	ZINC000449324383	330914530	/nfs/dbraw/zinc/91/45/30/330914530.db2.gz	FABDWZPNKGZPML-UHFFFAOYSA-N	1	0	292.467	4.178	20	30		CIEDRO
CCC[C@@H]([NH2+]CC(C)(C)CCC#N)C1CCCC1	ZINC000449332069	330915348	/nfs/dbraw/zinc/91/53/48/330915348.db2.gz	PWEPABWYGBRMEG-OAHLLOKOSA-N	1	0	250.430	4.265	20	30		CIEDRO
CC(C)(C)C(C)(C)C[NH2+]C1CCC(C)(C#N)CC1	ZINC000449337808	330915948	/nfs/dbraw/zinc/91/59/48/330915948.db2.gz	CWNBRKVNHDOOJZ-UHFFFAOYSA-N	1	0	250.430	4.121	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1CCCc2c(F)cc(F)cc21	ZINC000449350790	330917449	/nfs/dbraw/zinc/91/74/49/330917449.db2.gz	NKOOGONGOXAXJX-MRXNPFEDSA-N	1	0	292.373	4.262	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+][C@@H]2CCCc3c(F)cc(F)cc32)C1	ZINC000449352761	330917647	/nfs/dbraw/zinc/91/76/47/330917647.db2.gz	WGXWTQGMELCFHS-XTQGRXLLSA-N	1	0	290.357	4.014	20	30		CIEDRO
CCC[C@@H]([NH2+]C1CCC(C)(C#N)CC1)C(C)(C)C	ZINC000449475798	330928843	/nfs/dbraw/zinc/92/88/43/330928843.db2.gz	UWQIVRSQRGKSAA-NPCAHTBFSA-N	1	0	250.430	4.263	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+]C[C@H]1CCOC2(CCC2)C1	ZINC000449480931	330929384	/nfs/dbraw/zinc/92/93/84/330929384.db2.gz	PYGPWIONQBMCJL-CVEARBPZSA-N	1	0	265.441	4.060	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)cc1Cl)c1ccccc1	ZINC000162569035	330935664	/nfs/dbraw/zinc/93/56/64/330935664.db2.gz	GFSLGIHUEUDEBK-LBPRGKRZSA-N	1	0	270.763	4.062	20	30		CIEDRO
C=CCC1(C[NH2+][C@@H]2CCCC23CCOCC3)CCCC1	ZINC000449606888	330939240	/nfs/dbraw/zinc/93/92/40/330939240.db2.gz	SVVZTPRUPVMLII-MRXNPFEDSA-N	1	0	277.452	4.062	20	30		CIEDRO
N#CC1(C[NH2+][C@@H](c2ccccc2)C2CCCC2)CCC1	ZINC000450550523	330985955	/nfs/dbraw/zinc/98/59/55/330985955.db2.gz	BWMUYABHEXUPKL-KRWDZBQOSA-N	1	0	268.404	4.201	20	30		CIEDRO
N#CC1(C[NH2+][C@H]2CCC[C@@H]2c2ccc(Cl)cc2)CCC1	ZINC000450820091	331000980	/nfs/dbraw/zinc/00/09/80/331000980.db2.gz	MQPVRVDUGBXGPY-CVEARBPZSA-N	1	0	288.822	4.260	20	30		CIEDRO
N#CC1(C[NH2+][C@H]2CCC[C@H]2c2ccc(Cl)cc2)CCC1	ZINC000450820092	331001011	/nfs/dbraw/zinc/00/10/11/331001011.db2.gz	MQPVRVDUGBXGPY-HOTGVXAUSA-N	1	0	288.822	4.260	20	30		CIEDRO
CCO[C@H]1C[C@H]([NH2+]CCCCC(C)(C)C#N)C12CCCC2	ZINC000450968165	331009175	/nfs/dbraw/zinc/00/91/75/331009175.db2.gz	JZYUIIINAYPZNG-HOTGVXAUSA-N	1	0	292.467	4.034	20	30		CIEDRO
C=CCCC[C@@H](C)[N@@H+]1CCC[C@H](c2ccncc2)C1	ZINC000451008199	331011545	/nfs/dbraw/zinc/01/15/45/331011545.db2.gz	WLXFZCFQGGGZFN-WBVHZDCISA-N	1	0	258.409	4.006	20	30		CIEDRO
N#CCCC[C@H]([NH2+]CC1CC(F)(F)C1)c1ccccc1	ZINC000451066721	331014595	/nfs/dbraw/zinc/01/45/95/331014595.db2.gz	VBOOFKYJNQEYDZ-HNNXBMFYSA-N	1	0	278.346	4.056	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(F)c(C#N)c1)c1cccc(C2CC2)c1	ZINC000451109485	331015801	/nfs/dbraw/zinc/01/58/01/331015801.db2.gz	CVYOAMOFEWRFSE-CYBMUJFWSA-N	1	0	294.373	4.426	20	30		CIEDRO
C[C@@H]([NH2+]CCC(C)(C)C#N)c1cccc(C2CC2)c1	ZINC000451113829	331016060	/nfs/dbraw/zinc/01/60/60/331016060.db2.gz	JRSXKMATZFQRJJ-CYBMUJFWSA-N	1	0	256.393	4.154	20	30		CIEDRO
N#CCCCC[N@@H+]1CCc2ccc(-c3ccccc3)cc2C1	ZINC000451160268	331018171	/nfs/dbraw/zinc/01/81/71/331018171.db2.gz	UKWRVBBIBHORKL-UHFFFAOYSA-N	1	0	290.410	4.406	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@@H]1CC[C@H](C)c2ccsc21	ZINC000453207073	331101427	/nfs/dbraw/zinc/10/14/27/331101427.db2.gz	FYCYMELSPUYSAL-XNISGKROSA-N	1	0	291.460	4.257	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@H]1CSc2ccccc21)C1CC1	ZINC000453218514	331102855	/nfs/dbraw/zinc/10/28/55/331102855.db2.gz	JWVPPRFQFXCIHG-GOEBONIOSA-N	1	0	273.445	4.210	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCCC1CCOCC1)c1ccco1	ZINC000453236277	331105148	/nfs/dbraw/zinc/10/51/48/331105148.db2.gz	NEBKGMJFHKCPOK-MRXNPFEDSA-N	1	0	277.408	4.083	20	30		CIEDRO
Cc1cc([C@@H](C)[NH2+][C@@H]2CCc3ccc(C#N)cc32)ccc1F	ZINC000453265145	331109078	/nfs/dbraw/zinc/10/90/78/331109078.db2.gz	XGEPFIIJNFBWID-BFUOFWGJSA-N	1	0	294.373	4.344	20	30		CIEDRO
CCC[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)C1CCCCC1	ZINC000453287548	331111433	/nfs/dbraw/zinc/11/14/33/331111433.db2.gz	GOANDUNLQAWRRA-BHYGNILZSA-N	1	0	262.441	4.407	20	30		CIEDRO
Cc1ccc2cc([C@H](C)[NH2+][C@H]3CC[C@@H](CC#N)C3)oc2c1	ZINC000453291597	331111801	/nfs/dbraw/zinc/11/18/01/331111801.db2.gz	MCTAFIFMFOLOBU-DZKIICNBSA-N	1	0	282.387	4.474	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1cccc(C2CC2)c1	ZINC000453292729	331112054	/nfs/dbraw/zinc/11/20/54/331112054.db2.gz	OSFWTAGVNALGMO-DEYYWGMASA-N	1	0	268.404	4.297	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@H](C)c1nc(C(F)(F)F)cs1	ZINC000453303907	331113656	/nfs/dbraw/zinc/11/36/56/331113656.db2.gz	DROMUOBAVLYERK-MRVPVSSYSA-N	1	0	278.343	4.025	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@@H]1CCCc2ncc(C(F)(F)F)cc21	ZINC000453302736	331113499	/nfs/dbraw/zinc/11/34/99/331113499.db2.gz	AQAOIPAKSNRFQF-CQSZACIVSA-N	1	0	298.352	4.280	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@@H](C)c1ccc(OC(F)F)c(OC)c1	ZINC000453312177	331115018	/nfs/dbraw/zinc/11/50/18/331115018.db2.gz	UWUNZTLRTUJTEU-NSHDSACASA-N	1	0	299.361	4.159	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)c1sc(C(C)C)nc1C	ZINC000453313961	331115139	/nfs/dbraw/zinc/11/51/39/331115139.db2.gz	HYKHGPMGRWMNAH-LLVKDONJSA-N	1	0	252.427	4.192	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@@H](c1cccnc1)c1ccc(F)c(C)c1	ZINC000453314987	331115359	/nfs/dbraw/zinc/11/53/59/331115359.db2.gz	ZCTUFSDUHLZVNF-GOSISDBHSA-N	1	0	298.405	4.420	20	30		CIEDRO
Cc1csc(C[NH2+][C@H]2CCCCc3cc(C#N)ccc32)c1	ZINC000453317963	331115857	/nfs/dbraw/zinc/11/58/57/331115857.db2.gz	LQSLVKJTJFXAQS-SFHVURJKSA-N	1	0	296.439	4.486	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@H]1CCCC1(F)F)c1ccco1	ZINC000453319310	331116145	/nfs/dbraw/zinc/11/61/45/331116145.db2.gz	NGQFGOAPRNCHOY-CHWSQXEVSA-N	1	0	269.335	4.312	20	30		CIEDRO
C=C[C@@H]1OCCC[C@H]1[NH2+][C@H]1CC[C@H](C)c2ccsc21	ZINC000453374848	331124516	/nfs/dbraw/zinc/12/45/16/331124516.db2.gz	WXRGOTFMVXLENL-ATGSNQNLSA-N	1	0	277.433	4.010	20	30		CIEDRO
C=CCC1(C[NH2+][C@@H](C)c2csc(C)n2)CCCC1	ZINC000453390498	331127421	/nfs/dbraw/zinc/12/74/21/331127421.db2.gz	YADCDUKCIZIHBL-LBPRGKRZSA-N	1	0	264.438	4.239	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCC1CC(F)(F)C1)c1ccco1	ZINC000453422586	331130776	/nfs/dbraw/zinc/13/07/76/331130776.db2.gz	MUPMQTJFUHZIGC-ZDUSSCGKSA-N	1	0	269.335	4.312	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@@H]1CCOC(C)(C)C1)c1ccco1	ZINC000453434955	331131540	/nfs/dbraw/zinc/13/15/40/331131540.db2.gz	TXTPPGZVERTVTK-HUUCEWRRSA-N	1	0	277.408	4.082	20	30		CIEDRO
CC1(C)Cc2ccsc2C[N@@H+]1Cc1cc(C#N)cs1	ZINC000453614847	331136582	/nfs/dbraw/zinc/13/65/82/331136582.db2.gz	FASVSAMHUBJQTL-UHFFFAOYSA-N	1	0	288.441	4.018	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@H](C)CC(=O)Nc1cccc(Cl)c1	ZINC000467411188	331280859	/nfs/dbraw/zinc/28/08/59/331280859.db2.gz	BGBMLFOUUHRTMS-OCCSQVGLSA-N	1	0	294.826	4.001	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1cnc(C2CC2)nc1)c1ccccc1	ZINC000459452722	331282064	/nfs/dbraw/zinc/28/20/64/331282064.db2.gz	RZIGQHPQQUNBGT-GOSISDBHSA-N	1	0	293.414	4.151	20	30		CIEDRO
Cc1cc(F)c(C[NH2+]CC(C)(C)CCC#N)c(Cl)c1	ZINC000459555802	331287569	/nfs/dbraw/zinc/28/75/69/331287569.db2.gz	DVVMIMXLBGALAX-UHFFFAOYSA-N	1	0	282.790	4.207	20	30		CIEDRO
COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1ccc(C#N)c(C)c1	ZINC000459649677	331292160	/nfs/dbraw/zinc/29/21/60/331292160.db2.gz	KVLMUQSALIFBLI-OAHLLOKOSA-N	1	0	294.398	4.035	20	30		CIEDRO
C[C@H]([NH2+]CC(C)(C)CC#N)C1CCC(C(F)(F)F)CC1	ZINC000459660102	331292780	/nfs/dbraw/zinc/29/27/80/331292780.db2.gz	AWVSLDFUXLICLO-HIFPTAJRSA-N	1	0	290.373	4.273	20	30		CIEDRO
CC(C)(CC#N)C[NH2+][C@@H]1CC[C@@](C)(c2ccccc2)C1	ZINC000459728839	331296291	/nfs/dbraw/zinc/29/62/91/331296291.db2.gz	JCCLPIHAGGVCDA-SJLPKXTDSA-N	1	0	270.420	4.026	20	30		CIEDRO
N#CCCC[N@@H+]1CC2(CCCCC2)[C@@H]1c1ccccc1	ZINC000459763293	331299217	/nfs/dbraw/zinc/29/92/17/331299217.db2.gz	YOPNHTCPMQIRJU-KRWDZBQOSA-N	1	0	268.404	4.298	20	30		CIEDRO
C[C@@H](Cc1cccc(F)c1)[N@H+](C)CCCC(C)(C)C#N	ZINC000459769725	331299788	/nfs/dbraw/zinc/29/97/88/331299788.db2.gz	RWFVEMHINFMMLI-AWEZNQCLSA-N	1	0	276.399	4.018	20	30		CIEDRO
C=CC[C@H](C)[NH2+]C(c1ccccc1)c1ccccc1	ZINC000166145282	331306639	/nfs/dbraw/zinc/30/66/39/331306639.db2.gz	OSFDGLGXXOSAHQ-HNNXBMFYSA-N	1	0	251.373	4.330	20	30		CIEDRO
C=Cc1ccc(CC[NH2+][C@H](C)c2ccc(C#N)cc2)cc1	ZINC000461077501	331311101	/nfs/dbraw/zinc/31/11/01/331311101.db2.gz	SIUCOWAIYOACLW-OAHLLOKOSA-N	1	0	276.383	4.095	20	30		CIEDRO
CC(C)C[C@H](Cc1cccc(Cl)c1)[NH2+]C[C@H](C)C#N	ZINC000545899586	331314076	/nfs/dbraw/zinc/31/40/76/331314076.db2.gz	HBSBBONUAHTBSO-CZUORRHYSA-N	1	0	278.827	4.046	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+]CCc1ccc2ccccc2n1	ZINC000462034119	331316754	/nfs/dbraw/zinc/31/67/54/331316754.db2.gz	YLOXFLJWDXCBCA-INIZCTEOSA-N	1	0	268.404	4.112	20	30		CIEDRO
CCC[C@H](CCc1ccccc1)[NH2+][C@@H](CC)CC#N	ZINC000462065602	331317012	/nfs/dbraw/zinc/31/70/12/331317012.db2.gz	NKXGVHPRPJJEBT-DLBZAZTESA-N	1	0	258.409	4.070	20	30		CIEDRO
CC#CCC[NH+]1Cc2ccccc2-c2ccccc2C1	ZINC000462310851	331319066	/nfs/dbraw/zinc/31/90/66/331319066.db2.gz	GSTGEEIUQMWJKN-UHFFFAOYSA-N	1	0	261.368	4.083	20	30		CIEDRO
CC#CCC[NH+]1CCC(c2c(C)[nH]c3ccccc32)CC1	ZINC000462319762	331319462	/nfs/dbraw/zinc/31/94/62/331319462.db2.gz	VTZVBIGCJLADEN-UHFFFAOYSA-N	1	0	280.415	4.069	20	30		CIEDRO
C[C@@H]1CCCc2ccccc2[C@@H]1[NH2+]Cc1cccc(C#N)c1	ZINC000462544876	331323347	/nfs/dbraw/zinc/32/33/47/331323347.db2.gz	OJAIDWOOCJXSFR-FOIQADDNSA-N	1	0	290.410	4.362	20	30		CIEDRO
C=C(C[NH2+][C@H](C)CCc1ccsc1)c1ccccc1	ZINC000462787184	331329023	/nfs/dbraw/zinc/32/90/23/331329023.db2.gz	ADWYNDDWSJNXJV-OAHLLOKOSA-N	1	0	271.429	4.372	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+][C@H]2CCCCC23CCCC3)C1	ZINC000462948904	331335756	/nfs/dbraw/zinc/33/57/56/331335756.db2.gz	XCFVOWVQFBDWHZ-OAGGEKHMSA-N	1	0	260.425	4.161	20	30		CIEDRO
C=CCC[N@H+](C)CCCCCn1c(C)nc2ccccc21	ZINC000463205965	331342246	/nfs/dbraw/zinc/34/22/46/331342246.db2.gz	WMEBJQRVEXAEKU-UHFFFAOYSA-N	1	0	285.435	4.023	20	30		CIEDRO
Cc1cccc(C2([NH2+][C@H]3CCC[C@@H](C#N)C3)CCCC2)c1	ZINC000463247448	331344146	/nfs/dbraw/zinc/34/41/46/331344146.db2.gz	NSZJIHSPPFGBFH-AEFFLSMTSA-N	1	0	282.431	4.436	20	30		CIEDRO
CC(C)CC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCC[C@@H](C#N)C1	ZINC000463291445	331345436	/nfs/dbraw/zinc/34/54/36/331345436.db2.gz	ZXSIBOWTQUWYEU-TWMKSMIVSA-N	1	0	262.441	4.263	20	30		CIEDRO
C=C(C[NH2+]C1CCC(C(F)(F)F)CC1)c1ccccc1	ZINC000464058570	331355285	/nfs/dbraw/zinc/35/52/85/331355285.db2.gz	SLFHHTCIQSYJTR-UHFFFAOYSA-N	1	0	283.337	4.411	20	30		CIEDRO
CCC[N@H+](CCc1cccs1)Cc1ccccc1C#N	ZINC000464585090	331363338	/nfs/dbraw/zinc/36/33/38/331363338.db2.gz	LOBHZHVLMZAMNJ-UHFFFAOYSA-N	1	0	284.428	4.074	20	30		CIEDRO
CCC[C@@]1(C)CCC[N@H+](Cc2cc(C#N)ccc2F)C1	ZINC000464839691	331370692	/nfs/dbraw/zinc/37/06/92/331370692.db2.gz	QTEQQYNSXVJIMH-KRWDZBQOSA-N	1	0	274.383	4.100	20	30		CIEDRO
CCC[C@@]1(C)CCC[N@H+](Cc2ccc(F)cc2C#N)C1	ZINC000464850431	331371137	/nfs/dbraw/zinc/37/11/37/331371137.db2.gz	PIERKVYTFHSGBO-KRWDZBQOSA-N	1	0	274.383	4.100	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1cnc(-c2ccccc2)s1	ZINC000466403071	331395218	/nfs/dbraw/zinc/39/52/18/331395218.db2.gz	BVXUKIVALQIHHU-CQSZACIVSA-N	1	0	272.417	4.254	20	30		CIEDRO
N#Cc1cccc(CC[NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)c1	ZINC000466426675	331396680	/nfs/dbraw/zinc/39/66/80/331396680.db2.gz	WKASIABLWWBJEK-WOJBJXKFSA-N	1	0	290.410	4.027	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@@H](C)c1ccc(SC)c(OC)c1	ZINC000467400887	331417643	/nfs/dbraw/zinc/41/76/43/331417643.db2.gz	AMXLRPRBAHECSV-JSGCOSHPSA-N	1	0	279.449	4.422	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@H](C)[C@H](C)c1ccc(OC)cc1	ZINC000467405780	331417849	/nfs/dbraw/zinc/41/78/49/331417849.db2.gz	HHZFXNFMZBPHNA-LZWOXQAQSA-N	1	0	261.409	4.132	20	30		CIEDRO
CCc1ccc([C@@H](C)[NH2+]CCc2cccc(C#N)c2)cc1	ZINC000467427618	331418690	/nfs/dbraw/zinc/41/86/90/331418690.db2.gz	DYHPSSRPPQLUFH-OAHLLOKOSA-N	1	0	278.399	4.014	20	30		CIEDRO
C[C@@H]1CCC[C@H]1C[NH2+]C1CCC(C#N)(c2ccccc2)CC1	ZINC000467436835	331419235	/nfs/dbraw/zinc/41/92/35/331419235.db2.gz	DQCXLQMQRHCDIW-WSCVDHEUSA-N	1	0	296.458	4.416	20	30		CIEDRO
CC[C@H](CC#N)[NH2+][C@@H]1CCC[C@@H]1c1ccc(Cl)cc1	ZINC000468474055	331435411	/nfs/dbraw/zinc/43/54/11/331435411.db2.gz	BONLYQXCFPDQMB-BZUAXINKSA-N	1	0	276.811	4.258	20	30		CIEDRO
CC[C@H](CC#N)[NH2+][C@H]1CCC[C@H]1CCc1ccccc1	ZINC000468474481	331435459	/nfs/dbraw/zinc/43/54/59/331435459.db2.gz	GHAWJWOVHXXGBO-KSZLIROESA-N	1	0	270.420	4.070	20	30		CIEDRO
CC(C)[C@@H](C[NH2+]CC(C)(C)CCC#N)Cc1ccccc1	ZINC000469124640	331446197	/nfs/dbraw/zinc/44/61/97/331446197.db2.gz	ZBOZVEISDZKZCQ-GOSISDBHSA-N	1	0	286.463	4.421	20	30		CIEDRO
C=CCOCCC[NH2+]C(C)(c1ccccc1)c1ccccc1	ZINC000470779988	331490850	/nfs/dbraw/zinc/49/08/50/331490850.db2.gz	PMVKDDDXCCOJCY-UHFFFAOYSA-N	1	0	295.426	4.132	20	30		CIEDRO
C=CCOCCC[NH2+][C@H](C)c1cc2ccccc2s1	ZINC000470779555	331490881	/nfs/dbraw/zinc/49/08/81/331490881.db2.gz	NLTCMVDRZIFIKW-CYBMUJFWSA-N	1	0	275.417	4.145	20	30		CIEDRO
C=CC[C@@H](C)[C@H](C)[NH2+]CCc1ccccc1OC(F)F	ZINC000471793077	331520437	/nfs/dbraw/zinc/52/04/37/331520437.db2.gz	YZVBYUDHNVEDIF-OLZOCXBDSA-N	1	0	283.362	4.021	20	30		CIEDRO
N#C[C@H]1CC[C@H]([NH2+]Cc2ccc(Oc3ccccc3)cc2)C1	ZINC000472133933	331529645	/nfs/dbraw/zinc/52/96/45/331529645.db2.gz	DIIQUOWMJPASLY-IRXDYDNUSA-N	1	0	292.382	4.261	20	30		CIEDRO
C[C@H]([NH2+]Cc1cccc(C#N)c1)c1cc2cccc(F)c2o1	ZINC000474002091	331562272	/nfs/dbraw/zinc/56/22/72/331562272.db2.gz	UPNFFIPXNFCYCP-LBPRGKRZSA-N	1	0	294.329	4.294	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+]Cc1oc2ccccc2c1OC	ZINC000474045754	331565229	/nfs/dbraw/zinc/56/52/29/331565229.db2.gz	QQNFHYNOANJIDY-ZDUSSCGKSA-N	1	0	273.376	4.276	20	30		CIEDRO
C=CCCOCC[NH2+][C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1	ZINC000474888287	331602705	/nfs/dbraw/zinc/60/27/05/331602705.db2.gz	PQASRDSQIONDHD-FRRDWIJNSA-N	1	0	299.867	4.076	20	30		CIEDRO
CC(C)=CCC[NH2+]C1CCC(C#N)(c2ccccc2)CC1	ZINC000479295083	331723834	/nfs/dbraw/zinc/72/38/34/331723834.db2.gz	JTIZQGOQRHKBBS-UHFFFAOYSA-N	1	0	282.431	4.336	20	30		CIEDRO
CC(C)c1cccc(C[NH2+]Cc2ccc(C#N)cc2F)c1	ZINC000479386616	331726293	/nfs/dbraw/zinc/72/62/93/331726293.db2.gz	GGGFIFCVFDAVFD-UHFFFAOYSA-N	1	0	282.362	4.111	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CC1CCN(c2ccccc2)CC1)C1CC1	ZINC000479469471	331732158	/nfs/dbraw/zinc/73/21/58/331732158.db2.gz	WRCDKBSRHHAIJE-HXUWFJFHSA-N	1	0	298.474	4.237	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)Cc1ccccc1C(F)(F)F	ZINC000481638789	331810739	/nfs/dbraw/zinc/81/07/39/331810739.db2.gz	AJNCQTUVBDNQQN-RYUDHWBXSA-N	1	0	271.326	4.191	20	30		CIEDRO
Cc1ccccc1C[NH2+][C@@H]1CCCCc2cc(C#N)ccc21	ZINC000481916865	331818344	/nfs/dbraw/zinc/81/83/44/331818344.db2.gz	YBYNROVOBIYYTL-HXUWFJFHSA-N	1	0	290.410	4.424	20	30		CIEDRO
Cc1cccc(C[NH2+][C@H]2CCCCc3cc(C#N)ccc32)c1	ZINC000481911803	331818424	/nfs/dbraw/zinc/81/84/24/331818424.db2.gz	HDHMPFCEOPSEII-FQEVSTJZSA-N	1	0	290.410	4.424	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@H]2CC[C@H](c3ccccc3F)C2)C1	ZINC000482077977	331823348	/nfs/dbraw/zinc/82/33/48/331823348.db2.gz	QJKFULXSAZVXSV-UGUYLWEFSA-N	1	0	286.394	4.134	20	30		CIEDRO
C=C(C)CN1CCC([NH2+][C@H]2CC(C)(C)c3ccccc32)CC1	ZINC000482620676	331840524	/nfs/dbraw/zinc/84/05/24/331840524.db2.gz	PWFITWGGQGYRQK-IBGZPJMESA-N	1	0	298.474	4.039	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@@H]1c2ccccc2C[C@@H]1C	ZINC000482886279	331850779	/nfs/dbraw/zinc/85/07/79/331850779.db2.gz	ITTAEPFKORCFHH-YWZLYKJASA-N	1	0	293.410	4.275	20	30		CIEDRO
Cc1cccc([C@@H](C)[NH2+]CC#Cc2ccccc2)c1C	ZINC000484066202	331892093	/nfs/dbraw/zinc/89/20/93/331892093.db2.gz	IUYHFQDOWSGSIW-QGZVFWFLSA-N	1	0	263.384	4.006	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@@H](C)c1ccc2ncsc2c1	ZINC000485706891	331920046	/nfs/dbraw/zinc/92/00/46/331920046.db2.gz	BRZOMMJSVLLBRP-RYUDHWBXSA-N	1	0	260.406	4.302	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C#N)cc1)c1ccc2ncsc2c1	ZINC000485714142	331921816	/nfs/dbraw/zinc/92/18/16/331921816.db2.gz	YFWRIGRNVPLPHF-GFCCVEGCSA-N	1	0	293.395	4.019	20	30		CIEDRO
C[C@H](CC1CCCCC1)[NH2+]Cc1cc(C#N)cs1	ZINC000487152749	331957313	/nfs/dbraw/zinc/95/73/13/331957313.db2.gz	JLLYWONBFFTMHW-GFCCVEGCSA-N	1	0	262.422	4.068	20	30		CIEDRO
C=CCCCCC[NH2+][C@@](C)(CC)c1nccs1	ZINC000193430487	333249792	/nfs/dbraw/zinc/24/97/92/333249792.db2.gz	UIHOLBVBDVXFNH-AWEZNQCLSA-N	1	0	252.427	4.104	20	30		CIEDRO
CCC[C@@H]([NH2+]Cc1ccc(C#N)c(C)c1)c1ccccc1	ZINC000488125669	331991096	/nfs/dbraw/zinc/99/10/96/331991096.db2.gz	LWLCPCTUXFOMBY-LJQANCHMSA-N	1	0	278.399	4.498	20	30		CIEDRO
C=CCCCCC[NH2+][C@@H](C)c1cn(C(C)(C)C)nc1C	ZINC000488336218	332000423	/nfs/dbraw/zinc/00/04/23/332000423.db2.gz	UDTFBMHHIOSSLA-AWEZNQCLSA-N	1	0	277.456	4.344	20	30		CIEDRO
C=C(C[NH2+][C@H]1CS[C@@H](C(C)(C)C)C1)c1ccccc1	ZINC000488432077	332007815	/nfs/dbraw/zinc/00/78/15/332007815.db2.gz	LILVFGRVDUUIIC-HZPDHXFCSA-N	1	0	275.461	4.210	20	30		CIEDRO
Cc1cc(C[N@H+]2C[C@@H](C)[C@H]2c2ccccc2)ccc1C#N	ZINC000488470734	332012212	/nfs/dbraw/zinc/01/22/12/332012212.db2.gz	VMJBWTHRSZRSGA-BEFAXECRSA-N	1	0	276.383	4.060	20	30		CIEDRO
C=CC[N@@H+](CCc1ccco1)Cc1cc2ccc(F)cc2[nH]1	ZINC000488557270	332017375	/nfs/dbraw/zinc/01/73/75/332017375.db2.gz	KWMGXNGPXFIDPX-UHFFFAOYSA-N	1	0	298.361	4.131	20	30		CIEDRO
C[C@@H](c1ccccc1)N(Cc1ccc(F)cc1C#N)C1CC1	ZINC000489580628	332060262	/nfs/dbraw/zinc/06/02/62/332060262.db2.gz	VTVOBSXMPZXSLQ-AWEZNQCLSA-N	1	0	294.373	4.423	20	30		CIEDRO
C=CCCC[N@@H+](CCC)[C@H](C)C(=O)Nc1ccccc1C	ZINC000490080952	332080582	/nfs/dbraw/zinc/08/05/82/332080582.db2.gz	RGYBMYSTSIENMG-MRXNPFEDSA-N	1	0	288.435	4.000	20	30		CIEDRO
CCSc1cccc(C[NH2+]Cc2ccc(C#N)c(C)c2)c1	ZINC000491455539	332215285	/nfs/dbraw/zinc/21/52/85/332215285.db2.gz	AVUAQBVNOVDZQJ-UHFFFAOYSA-N	1	0	296.439	4.269	20	30		CIEDRO
C=CC[N@H+](Cc1ccc(Cl)s1)C[C@@H]1CCO[C@@H](C)C1	ZINC000491939738	332376110	/nfs/dbraw/zinc/37/61/10/332376110.db2.gz	MMHNZJIUOMYIFU-QWHCGFSZSA-N	1	0	299.867	4.205	20	30		CIEDRO
C[C@H]([NH2+][C@H]1C[C@H](C)C[C@H](C)C1)c1cccc(C#N)c1	ZINC000252203066	334376843	/nfs/dbraw/zinc/37/68/43/334376843.db2.gz	WQECWQJCEZDLEH-QDEZUTFSSA-N	1	0	256.393	4.034	20	30		CIEDRO
CC(C)(C#N)CC[NH2+]C1(c2ccc(F)cc2)CCCC1	ZINC000553707874	334396152	/nfs/dbraw/zinc/39/61/52/334396152.db2.gz	RFWKDCNZWPUPKF-UHFFFAOYSA-N	1	0	274.383	4.124	20	30		CIEDRO
C=CCOc1cccc(C[NH2+]C[C@@H]2CCCC(F)(F)C2)c1	ZINC000500372368	332605654	/nfs/dbraw/zinc/60/56/54/332605654.db2.gz	OPSIWNGNKDGLES-OAHLLOKOSA-N	1	0	295.373	4.167	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+]C[C@H]1CCCC(F)(F)C1	ZINC000500395357	332606478	/nfs/dbraw/zinc/60/64/78/332606478.db2.gz	GXRHSFNCUKOILJ-AWEZNQCLSA-N	1	0	295.373	4.167	20	30		CIEDRO
CC[C@H]1C[C@@]1([NH2+]Cc1ccc(C#N)s1)c1cccc(C)c1	ZINC000500487352	332610952	/nfs/dbraw/zinc/61/09/52/332610952.db2.gz	WCLLSUDNRIZXDR-KSSFIOAISA-N	1	0	296.439	4.343	20	30		CIEDRO
CC[C@H]1C[C@@]1([NH2+]Cc1cccc(C#N)c1)c1cccc(C)c1	ZINC000500494130	332611269	/nfs/dbraw/zinc/61/12/69/332611269.db2.gz	CNQARWVDYWTJNC-ICSRJNTNSA-N	1	0	290.410	4.282	20	30		CIEDRO
CC[C@@H]1C[C@]1([NH2+]Cc1cc(C#N)cs1)c1cccc(C)c1	ZINC000500506471	332611744	/nfs/dbraw/zinc/61/17/44/332611744.db2.gz	DCQLOSXMLRLVOQ-CRAIPNDOSA-N	1	0	296.439	4.343	20	30		CIEDRO
C[C@H](C[NH+]1CCC(C#N)CC1)c1ccc(C(F)(F)F)cc1	ZINC000501151568	332627482	/nfs/dbraw/zinc/62/74/82/332627482.db2.gz	AYDGLGHPVLVMRN-GFCCVEGCSA-N	1	0	296.336	4.044	20	30		CIEDRO
CCCCc1ccc([C@H]([NH2+]CCC#N)C(C)C)cc1	ZINC000501730795	332639565	/nfs/dbraw/zinc/63/95/65/332639565.db2.gz	QWHLLZDXJGKWPH-QGZVFWFLSA-N	1	0	258.409	4.230	20	30		CIEDRO
CC[C@@H]([NH2+]C[C@H]1CCCC(F)(F)C1)c1ccc(C#N)cc1	ZINC000502578431	332666244	/nfs/dbraw/zinc/66/62/44/332666244.db2.gz	JHYYTFVPVXCRST-GOEBONIOSA-N	1	0	292.373	4.424	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@H]1C[C@H](c2ccc(OC)c(F)c2)C1	ZINC000503856080	332696720	/nfs/dbraw/zinc/69/67/20/332696720.db2.gz	NAHGYYSPVRDWGP-SDADXPQNSA-N	1	0	291.410	4.271	20	30		CIEDRO
Cc1ccc(SCC[NH+]2CCC(C)(C#N)CC2)cc1C	ZINC000506041066	332760447	/nfs/dbraw/zinc/76/04/47/332760447.db2.gz	HBCUNACEGAABKU-UHFFFAOYSA-N	1	0	288.460	4.021	20	30		CIEDRO
C[C@@H]([NH2+]C1(c2ccccc2)CCC1)c1ccc(C#N)cc1F	ZINC000512280423	332961317	/nfs/dbraw/zinc/96/13/17/332961317.db2.gz	HSMRQIXFBWDMQC-CQSZACIVSA-N	1	0	294.373	4.427	20	30		CIEDRO
C[C@@H]([NH2+]C1CC(c2ccccc2)C1)c1ccc(C#N)cc1F	ZINC000512613232	332975794	/nfs/dbraw/zinc/97/57/94/332975794.db2.gz	RDUQUECBWYDUPT-NVPAJSRCSA-N	1	0	294.373	4.294	20	30		CIEDRO
Cc1ccccc1[C@H](C)[NH2+][C@@H](C)c1ccc(C#N)cc1F	ZINC000512629670	332976720	/nfs/dbraw/zinc/97/67/20/332976720.db2.gz	JUXIJRXPVBLJPX-KBPBESRZSA-N	1	0	282.362	4.418	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)Cc1cccs1)c1ccc(C#N)cc1F	ZINC000512631919	332976827	/nfs/dbraw/zinc/97/68/27/332976827.db2.gz	UUCWQWVXJKZNPM-NWDGAFQWSA-N	1	0	288.391	4.041	20	30		CIEDRO
CSCc1ccc(C[NH2+]Cc2ccc(C#N)c(C)c2)cc1	ZINC000513037558	333000654	/nfs/dbraw/zinc/00/06/54/333000654.db2.gz	SVHPWCJJZSOFJR-UHFFFAOYSA-N	1	0	296.439	4.020	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CCC[C@@H]1Cc1ccccc1	ZINC000174815218	333007955	/nfs/dbraw/zinc/00/79/55/333007955.db2.gz	VFGURVYQYWVTJN-QGZVFWFLSA-N	1	0	270.420	4.023	20	30		CIEDRO
CC[N@H+](CCCC(C)(C)C#N)Cc1cccc(Cl)c1	ZINC000174821612	333007969	/nfs/dbraw/zinc/00/79/69/333007969.db2.gz	IAQGNOAXUWKODM-UHFFFAOYSA-N	1	0	278.827	4.492	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CCC[C@H]1Cc1ccccc1	ZINC000174815226	333008139	/nfs/dbraw/zinc/00/81/39/333008139.db2.gz	VFGURVYQYWVTJN-KRWDZBQOSA-N	1	0	270.420	4.023	20	30		CIEDRO
Cc1ccccc1[C@@H]1CCC[N@@H+]1CCCC(C)(C)C#N	ZINC000174830148	333008361	/nfs/dbraw/zinc/00/83/61/333008361.db2.gz	VMPSBXMJXMIMTD-KRWDZBQOSA-N	1	0	270.420	4.462	20	30		CIEDRO
COc1c(C)cc(C[N@H+](C)CCCC(C)(C)C#N)cc1C	ZINC000174840704	333008637	/nfs/dbraw/zinc/00/86/37/333008637.db2.gz	QOGGDOSZDJXNLG-UHFFFAOYSA-N	1	0	288.435	4.074	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CC[C@@H](Cc2ccc(F)cc2)C1	ZINC000174869113	333009595	/nfs/dbraw/zinc/00/95/95/333009595.db2.gz	LCDPLPHJJJJWCE-INIZCTEOSA-N	1	0	288.410	4.020	20	30		CIEDRO
C[C@H]1C[C@@H](c2ccccc2)[N@H+](Cc2ccc(C#N)c(F)c2)C1	ZINC000513237049	333010239	/nfs/dbraw/zinc/01/02/39/333010239.db2.gz	SJWWECVIIMHMFR-LIRRHRJNSA-N	1	0	294.373	4.280	20	30		CIEDRO
C[C@H]1C[C@@H](c2ccccc2)[N@H+](Cc2ccc(F)c(C#N)c2)C1	ZINC000513254819	333011025	/nfs/dbraw/zinc/01/10/25/333011025.db2.gz	BZAJGMNIEDRQFL-LIRRHRJNSA-N	1	0	294.373	4.280	20	30		CIEDRO
C[C@H]1C[C@@H](c2ccccc2)[N@H+](Cc2cccc(C#N)c2)C1	ZINC000513256315	333011096	/nfs/dbraw/zinc/01/10/96/333011096.db2.gz	LNQDQRIMFXINJT-KXBFYZLASA-N	1	0	276.383	4.141	20	30		CIEDRO
C[C@@H]1C[C@@H](c2ccccc2)[N@H+](CCC(C)(C)C#N)C1	ZINC000513272023	333011406	/nfs/dbraw/zinc/01/14/06/333011406.db2.gz	PHGLIJIKGVLTCL-ZBFHGGJFSA-N	1	0	256.393	4.009	20	30		CIEDRO
C[C@H]1C[C@@H](c2ccccc2)[N@H+](Cc2cccc(C#N)c2F)C1	ZINC000513272934	333011849	/nfs/dbraw/zinc/01/18/49/333011849.db2.gz	UJZRIPBHXNOIFB-KSSFIOAISA-N	1	0	294.373	4.280	20	30		CIEDRO
CC[C@H](C)[C@@H](C)[N@H+](Cc1ccc(C#N)s1)C1CC1	ZINC000513455418	333020793	/nfs/dbraw/zinc/02/07/93/333020793.db2.gz	MFCBLHDTERMUKO-NWDGAFQWSA-N	1	0	262.422	4.019	20	30		CIEDRO
C=C1CC[NH+](Cc2ccc3cc(OC)ccc3c2)CC1	ZINC000513473152	333021797	/nfs/dbraw/zinc/02/17/97/333021797.db2.gz	SNPMXEFVYYZQAD-UHFFFAOYSA-N	1	0	267.372	4.000	20	30		CIEDRO
C=C1CC[NH+](Cc2ccc(OCCC)c(OCC)c2)CC1	ZINC000513503541	333023147	/nfs/dbraw/zinc/02/31/47/333023147.db2.gz	SZCYDXARCAMGTE-UHFFFAOYSA-N	1	0	289.419	4.026	20	30		CIEDRO
C=C1CCN(Cc2cccc(OCC)c2OCCC)CC1	ZINC000513503889	333023416	/nfs/dbraw/zinc/02/34/16/333023416.db2.gz	ZXGSSQWZZXCJPF-UHFFFAOYSA-N	1	0	289.419	4.026	20	30		CIEDRO
CC(C)[C@H]([NH2+]Cc1ccc(C#N)c(F)c1)c1ccccc1	ZINC000404766360	333025859	/nfs/dbraw/zinc/02/58/59/333025859.db2.gz	SBGUBPITHZHLQP-SFHVURJKSA-N	1	0	282.362	4.184	20	30		CIEDRO
C=CCC[C@H]([NH2+]CC1(CCOC)CCCC1)c1ccco1	ZINC000513671986	333031197	/nfs/dbraw/zinc/03/11/97/333031197.db2.gz	HIGFCDCRQHPXNG-INIZCTEOSA-N	1	0	291.435	4.473	20	30		CIEDRO
CC(C)(C)C[N@H+](CCC#N)C[C@@H]1C[C@@H]1c1ccccc1	ZINC000513717697	333035239	/nfs/dbraw/zinc/03/52/39/333035239.db2.gz	QTNWXPXLRFVCTG-DLBZAZTESA-N	1	0	270.420	4.052	20	30		CIEDRO
C=C(CC)C[NH2+][C@@H](C)c1ccc(Br)s1	ZINC000308571662	333035410	/nfs/dbraw/zinc/03/54/10/333035410.db2.gz	CCBJONRJMBKYFF-VIFPVBQESA-N	1	0	274.227	4.127	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@H](c1ccccc1)N(C)C)c1ccco1	ZINC000513763292	333037883	/nfs/dbraw/zinc/03/78/83/333037883.db2.gz	WUSSDJGYTKHQIX-QZTJIDSGSA-N	1	0	298.430	4.179	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H]1CCCCC12CCCC2	ZINC000311469855	333068910	/nfs/dbraw/zinc/06/89/10/333068910.db2.gz	ANZHNGRSSUGICR-HNNXBMFYSA-N	1	0	262.441	4.409	20	30		CIEDRO
C[C@H]([NH2+]CC(C)(C)C(C)(C)C)c1cccc(C#N)c1	ZINC000311910188	333074180	/nfs/dbraw/zinc/07/41/80/333074180.db2.gz	RAADMNGRKFCYHV-ZDUSSCGKSA-N	1	0	258.409	4.281	20	30		CIEDRO
C[N@H+](Cc1ccc(F)cc1)Cc1ccccc1C(C)(C)C#N	ZINC000178509474	333074450	/nfs/dbraw/zinc/07/44/50/333074450.db2.gz	VEUAWXUCRRYLLZ-UHFFFAOYSA-N	1	0	296.389	4.259	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H]2CCCCC23CCCC3)s1	ZINC000311946290	333074907	/nfs/dbraw/zinc/07/49/07/333074907.db2.gz	KLOUWULQSQGOBF-HNNXBMFYSA-N	1	0	274.433	4.212	20	30		CIEDRO
C[C@H]1CC[C@H]([NH2+]Cc2ccc(C#N)cc2C(F)(F)F)CC1	ZINC000517204849	333094750	/nfs/dbraw/zinc/09/47/50/333094750.db2.gz	FEQMVWDEIPOSAT-YEORSEQZSA-N	1	0	296.336	4.245	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+]Cc1ccc(CC)s1	ZINC000218216976	333129646	/nfs/dbraw/zinc/12/96/46/333129646.db2.gz	UATDUTUMOVISQE-UHFFFAOYSA-N	1	0	287.428	4.165	20	30		CIEDRO
C[C@H]1CCCc2ccccc2[C@H]1[NH2+]Cc1ccc(C#N)s1	ZINC000185086313	333135437	/nfs/dbraw/zinc/13/54/37/333135437.db2.gz	ZLHPWFZJQWVDML-UGSOOPFHSA-N	1	0	296.439	4.423	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+]CCSc2ccc(Cl)cc2)C1	ZINC000185759686	333148264	/nfs/dbraw/zinc/14/82/64/333148264.db2.gz	JBHHZPLLKHDSGC-TZMCWYRMSA-N	1	0	294.851	4.104	20	30		CIEDRO
COc1ccc2cc(C[NH2+][C@@H]3CCC[C@@H](C#N)C3)ccc2c1	ZINC000185765925	333148367	/nfs/dbraw/zinc/14/83/67/333148367.db2.gz	WNGTYTOBRPICMQ-RDTXWAMCSA-N	1	0	294.398	4.020	20	30		CIEDRO
C[C@@H]([NH2+]C1C[C@H](C)C[C@@H](C)C1)c1ccc(C#N)cc1	ZINC000219394142	333148515	/nfs/dbraw/zinc/14/85/15/333148515.db2.gz	LRECBTPXKDSLHZ-MGPQQGTHSA-N	1	0	256.393	4.034	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+]CCc2csc3ccccc23)C1	ZINC000185822092	333149665	/nfs/dbraw/zinc/14/96/65/333149665.db2.gz	MIXBTRYLOVTZAA-DZGCQCFKSA-N	1	0	284.428	4.116	20	30		CIEDRO
CC1(C)C[C@H]([NH2+][C@@H]2CCC[C@H](C#N)C2)c2ccccc21	ZINC000185861679	333150505	/nfs/dbraw/zinc/15/05/05/333150505.db2.gz	NOWFOKCSZOVIMW-VBQJREDUSA-N	1	0	268.404	4.081	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+]CC2(c3ccccc3Cl)CC2)C1	ZINC000185873496	333150783	/nfs/dbraw/zinc/15/07/83/333150783.db2.gz	GEFCNKWOKMXXET-KGLIPLIRSA-N	1	0	288.822	4.044	20	30		CIEDRO
C=C(C)[C@@H]([NH2+][C@@H](C)c1ccncc1)c1ccc(F)c(F)c1	ZINC000186451416	333161180	/nfs/dbraw/zinc/16/11/80/333161180.db2.gz	UVMJPQDIHVXTKC-YVEFUNNKSA-N	1	0	288.341	4.328	20	30		CIEDRO
C=C(C)[C@H]([NH2+][C@H]1CCCSC1)c1ccc(F)c(F)c1	ZINC000186453580	333161489	/nfs/dbraw/zinc/16/14/89/333161489.db2.gz	OYEQYSNKVSTZMH-WFASDCNBSA-N	1	0	283.387	4.067	20	30		CIEDRO
C=C(C)COCC[NH2+][C@@H](C)c1cc(Cl)sc1Cl	ZINC000222308516	333180794	/nfs/dbraw/zinc/18/07/94/333180794.db2.gz	NECAZLVQBXPEOE-VIFPVBQESA-N	1	0	294.247	4.298	20	30		CIEDRO
C=CCCOCC[NH2+][C@@H](C)c1ccc(C(C)C)cc1	ZINC000222447821	333193735	/nfs/dbraw/zinc/19/37/35/333193735.db2.gz	ROYUHPJSJCLYFM-HNNXBMFYSA-N	1	0	261.409	4.053	20	30		CIEDRO
CC[C@@H](Cc1ccc(Cl)cc1Cl)[NH2+]CC1(C#N)CC1	ZINC000521958830	333228012	/nfs/dbraw/zinc/22/80/12/333228012.db2.gz	PTNXZDIXHXPZJH-ZDUSSCGKSA-N	1	0	297.229	4.208	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)c(F)c1)c1cccc(Cl)c1	ZINC000192146831	333230810	/nfs/dbraw/zinc/23/08/10/333230810.db2.gz	WKDBQYVYJOCSHN-NSHDSACASA-N	1	0	288.753	4.202	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C#N)c(F)c1)c1ccc(Cl)s1	ZINC000192180604	333231909	/nfs/dbraw/zinc/23/19/09/333231909.db2.gz	YXVPWNHYGGPGME-SECBINFHSA-N	1	0	294.782	4.263	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+]Cc1cnc(-c2ccco2)s1	ZINC000193204135	333245179	/nfs/dbraw/zinc/24/51/79/333245179.db2.gz	YHQJKHUORJCXQT-GFCCVEGCSA-N	1	0	276.405	4.238	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccc2ncccc2c1)C1CC1	ZINC000195147699	333246594	/nfs/dbraw/zinc/24/65/94/333246594.db2.gz	CREPHTPWEDJZCF-KRWDZBQOSA-N	1	0	266.388	4.069	20	30		CIEDRO
C=CCCCCC[NH2+][C@](C)(CC)c1nccs1	ZINC000193430501	333249606	/nfs/dbraw/zinc/24/96/06/333249606.db2.gz	UIHOLBVBDVXFNH-CQSZACIVSA-N	1	0	252.427	4.104	20	30		CIEDRO
N#CC1CC[NH+](Cc2ccc(-c3ccccc3)cc2)CC1	ZINC000195315142	333250172	/nfs/dbraw/zinc/25/01/72/333250172.db2.gz	RVHTYWOKJOTGNK-UHFFFAOYSA-N	1	0	276.383	4.089	20	30		CIEDRO
C=CCCCCC[NH2+][C@H](CC)c1nc(C)cs1	ZINC000193547466	333252799	/nfs/dbraw/zinc/25/27/99/333252799.db2.gz	DORXMTATFGFZKR-CYBMUJFWSA-N	1	0	252.427	4.239	20	30		CIEDRO
C[C@@H](c1ccc(C#N)cc1)[N@H+](C)CC1CCCCC1	ZINC000195732364	333262485	/nfs/dbraw/zinc/26/24/85/333262485.db2.gz	BTOFKFZCMVZWPG-AWEZNQCLSA-N	1	0	256.393	4.131	20	30		CIEDRO
C[C@H](c1ccc(C#N)cc1)[N@H+](C)CC1CCCCC1	ZINC000195732365	333262532	/nfs/dbraw/zinc/26/25/32/333262532.db2.gz	BTOFKFZCMVZWPG-CQSZACIVSA-N	1	0	256.393	4.131	20	30		CIEDRO
CCOc1ccccc1C[N@H+](C)[C@H](C)c1ccc(C#N)cc1	ZINC000194973363	333280558	/nfs/dbraw/zinc/28/05/58/333280558.db2.gz	YKQHVFVBBVMCGU-OAHLLOKOSA-N	1	0	294.398	4.150	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@H]1CCC[C@H](SC)C1	ZINC000227377132	333282162	/nfs/dbraw/zinc/28/21/62/333282162.db2.gz	GUFOMZZEYDDTIH-HOTGVXAUSA-N	1	0	291.460	4.015	20	30		CIEDRO
C[C@@H]1C[C@H](c2ccccc2)C[N@@H+]1Cc1cc(C#N)ccc1F	ZINC000522471007	333287745	/nfs/dbraw/zinc/28/77/45/333287745.db2.gz	YXQFCVNCIGTKLO-PBHICJAKSA-N	1	0	294.373	4.075	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@@H](C2CC2)C1)c1ccc(C#N)cc1	ZINC000227869118	333289481	/nfs/dbraw/zinc/28/94/81/333289481.db2.gz	XKIMBVJRJRAPEY-MORSLUCNSA-N	1	0	268.404	4.178	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCC[C@@H](C2CC2)C1)c1ccc(C#N)cc1	ZINC000227869127	333289602	/nfs/dbraw/zinc/28/96/02/333289602.db2.gz	XKIMBVJRJRAPEY-VHSSKADRSA-N	1	0	268.404	4.178	20	30		CIEDRO
C=CC[C@@H](C)[NH2+]Cc1cccc(OCc2ccccc2F)c1	ZINC000522649702	333294762	/nfs/dbraw/zinc/29/47/62/333294762.db2.gz	YPUCOPNJJPQFSH-OAHLLOKOSA-N	1	0	299.389	4.459	20	30		CIEDRO
C=CC[N@H+](Cc1cccc(C#N)c1)C[C@H](C)c1ccccc1	ZINC000522662926	333295518	/nfs/dbraw/zinc/29/55/18/333295518.db2.gz	MBDLURXZXLGCKX-KRWDZBQOSA-N	1	0	290.410	4.350	20	30		CIEDRO
CC[N@H+](C[C@@H](C)C#N)[C@H](C)c1cccc2ccccc21	ZINC000522943788	333300670	/nfs/dbraw/zinc/30/06/70/333300670.db2.gz	AYVZHVVEJXZCLB-LSDHHAIUSA-N	1	0	266.388	4.382	20	30		CIEDRO
C[C@@H]([NH2+]CC1(C)CCCCC1)c1ccc(C#N)cc1	ZINC000229572947	333306493	/nfs/dbraw/zinc/30/64/93/333306493.db2.gz	UXUAFQILRSMANE-CQSZACIVSA-N	1	0	256.393	4.179	20	30		CIEDRO
C=C(C)COc1cc(C[NH2+]C[C@@H](C)C(C)C)ccc1OC	ZINC000523525329	333332159	/nfs/dbraw/zinc/33/21/59/333332159.db2.gz	YSVMRPZKJSSJJB-OAHLLOKOSA-N	1	0	291.435	4.032	20	30		CIEDRO
C=CCSCC[NH2+]C1CC(c2ccccc2Cl)C1	ZINC000231932239	333332169	/nfs/dbraw/zinc/33/21/69/333332169.db2.gz	YCZWKGDBVFWSBM-UHFFFAOYSA-N	1	0	281.852	4.095	20	30		CIEDRO
C=CC1CC[NH+]([C@@H](C)c2ccc(F)c(Cl)c2)CC1	ZINC000523610279	333333965	/nfs/dbraw/zinc/33/39/65/333333965.db2.gz	JZOFGHQCYAADDN-NSHDSACASA-N	1	0	267.775	4.438	20	30		CIEDRO
CC(C)(C#N)CCCC[NH2+][C@H]1CCCCC1(C)C	ZINC000232513595	333337709	/nfs/dbraw/zinc/33/77/09/333337709.db2.gz	QQKQVGPBFLGSJK-AWEZNQCLSA-N	1	0	250.430	4.265	20	30		CIEDRO
CC(C)(C#N)CCCC[N@@H+]1CCC[C@H]2CCCC[C@H]21	ZINC000232531048	333338125	/nfs/dbraw/zinc/33/81/25/333338125.db2.gz	NHGJYRIGSWKOJP-HZPDHXFCSA-N	1	0	262.441	4.361	20	30		CIEDRO
CC(C)(C#N)CCCC[N@@H+]1CCC[C@H]1C1CCCC1	ZINC000232528819	333338246	/nfs/dbraw/zinc/33/82/46/333338246.db2.gz	ZECRGBISVSBKNB-INIZCTEOSA-N	1	0	262.441	4.361	20	30		CIEDRO
C=CC[C@@H](C)[NH2+]Cc1ccc(OC)c(OCCC(C)C)c1	ZINC000523975703	333350586	/nfs/dbraw/zinc/35/05/86/333350586.db2.gz	MKONIZMJHOGCGF-OAHLLOKOSA-N	1	0	291.435	4.174	20	30		CIEDRO
CC[C@H]1CCCC[C@H]1[NH2+]CCCCC(C)(C)C#N	ZINC000234045825	333357404	/nfs/dbraw/zinc/35/74/04/333357404.db2.gz	MHZLDLXWMPNPJT-LSDHHAIUSA-N	1	0	250.430	4.265	20	30		CIEDRO
C[N@H+](CCCCC(C)(C)C#N)Cc1cccc(Cl)c1	ZINC000234272536	333359309	/nfs/dbraw/zinc/35/93/09/333359309.db2.gz	XPDBMAALRKNXGE-UHFFFAOYSA-N	1	0	278.827	4.492	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]Cc1cccc(Cl)c1Cl	ZINC000524689700	333371282	/nfs/dbraw/zinc/37/12/82/333371282.db2.gz	BMONQHHINHXCKJ-UHFFFAOYSA-N	1	0	285.218	4.413	20	30		CIEDRO
CC[C@@H](C)[C@@H]1CCCC[N@@H+]1Cc1cc(C#N)ccc1F	ZINC000524811273	333389002	/nfs/dbraw/zinc/38/90/02/333389002.db2.gz	GDQPAHIROSORCE-DYVFJYSZSA-N	1	0	274.383	4.098	20	30		CIEDRO
C=CCC[NH+]1CCC(c2c[nH]c3c2cccc3CC)CC1	ZINC000524811945	333389419	/nfs/dbraw/zinc/38/94/19/333389419.db2.gz	UCXDIXXGVCRPNR-UHFFFAOYSA-N	1	0	282.431	4.486	20	30		CIEDRO
C[C@@H]([NH2+]CC[C@H](C)c1ccccc1)c1cccc(C#N)c1	ZINC000061910088	333477543	/nfs/dbraw/zinc/47/75/43/333477543.db2.gz	IHMPOGNJSSKAOG-JKSUJKDBSA-N	1	0	278.399	4.403	20	30		CIEDRO
C[C@H]([NH2+]CCC(C)(C)C1CC1)c1ccc(C#N)cc1	ZINC000328570326	333535043	/nfs/dbraw/zinc/53/50/43/333535043.db2.gz	RMQDSGDSAZWLPM-ZDUSSCGKSA-N	1	0	256.393	4.035	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H](CC)[C@H]1CCOC1)c1ccccc1	ZINC000537946012	333548944	/nfs/dbraw/zinc/54/89/44/333548944.db2.gz	IYBRDAMWMKCLCF-BZSNNMDCSA-N	1	0	273.420	4.099	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H]1CCCC[C@H]1c1ccc(OC)c(F)c1	ZINC000537969090	333551896	/nfs/dbraw/zinc/55/18/96/333551896.db2.gz	KWLIUSPQHAEVBH-QRTARXTBSA-N	1	0	291.410	4.415	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)c1ccc(OC)c2ccccc21	ZINC000537968616	333552048	/nfs/dbraw/zinc/55/20/48/333552048.db2.gz	OKMCCBLECYYHOV-UONOGXRCSA-N	1	0	269.388	4.464	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+]CCSCc1ccccc1C#N	ZINC000537968908	333552063	/nfs/dbraw/zinc/55/20/63/333552063.db2.gz	CVUMJSAGMYYYMN-KRWDZBQOSA-N	1	0	288.460	4.126	20	30		CIEDRO
C[C@@H]([NH2+]CCCCC#N)c1ccc(C(C)(C)C)cc1	ZINC000174056890	335147437	/nfs/dbraw/zinc/14/74/37/335147437.db2.gz	QCZFCNOJKAYCET-CQSZACIVSA-N	1	0	258.409	4.329	20	30		CIEDRO
C=C(CC)C[NH+]1CCC(C(=O)c2ccc(Cl)cc2)CC1	ZINC000538002788	333570446	/nfs/dbraw/zinc/57/04/46/333570446.db2.gz	QTYWRPVAWRYHDK-UHFFFAOYSA-N	1	0	291.822	4.201	20	30		CIEDRO
COc1ccc([C@@H](C)[NH2+]CC#Cc2ccc(Cl)cc2)cc1	ZINC000538128968	333576070	/nfs/dbraw/zinc/57/60/70/333576070.db2.gz	WANBYNUWTUHVFD-CQSZACIVSA-N	1	0	299.801	4.051	20	30		CIEDRO
N#CCCC[NH2+][C@@H](c1cccc(Cl)c1)C1CCCC1	ZINC000538234583	333580779	/nfs/dbraw/zinc/58/07/79/333580779.db2.gz	SWFRYGLBEXQQSO-MRXNPFEDSA-N	1	0	276.811	4.465	20	30		CIEDRO
CC#CC[NH2+][C@@H](C)c1ccc(-c2ccccc2OC)cc1	ZINC000538256630	333581487	/nfs/dbraw/zinc/58/14/87/333581487.db2.gz	BDYBMOKFBHIVKK-HNNXBMFYSA-N	1	0	279.383	4.036	20	30		CIEDRO
C[C@H]([NH2+]CC(C)(C)c1ccc(F)cc1)c1ccc(C#N)cc1	ZINC000538396101	333588372	/nfs/dbraw/zinc/58/83/72/333588372.db2.gz	QBKMWJHTVFRUAR-AWEZNQCLSA-N	1	0	296.389	4.326	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@@H]2CCC[C@H]2C1)c1ccc(C#N)cc1	ZINC000538396156	333588376	/nfs/dbraw/zinc/58/83/76/333588376.db2.gz	JZJLOUSWVDFLHU-XDKFSHSGSA-N	1	0	268.404	4.178	20	30		CIEDRO
N#Cc1csc(C[NH2+][C@@H]2CCC[C@@H]2c2ccccc2)c1	ZINC000538403758	333589070	/nfs/dbraw/zinc/58/90/70/333589070.db2.gz	XHLBOSALWHZGKZ-IAGOWNOFSA-N	1	0	282.412	4.046	20	30		CIEDRO
C=CCCOCC[NH2+][C@H](c1cc2ccccc2o1)C(C)C	ZINC000538458747	333593956	/nfs/dbraw/zinc/59/39/56/333593956.db2.gz	PIADEZFGKWDCTI-SFHVURJKSA-N	1	0	287.403	4.312	20	30		CIEDRO
C=CCCOCC[NH2+][C@@H](c1cc2ccccc2o1)C(C)C	ZINC000538458746	333594026	/nfs/dbraw/zinc/59/40/26/333594026.db2.gz	PIADEZFGKWDCTI-GOSISDBHSA-N	1	0	287.403	4.312	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+]Cc1ccc(C)cc1OCC	ZINC000538502549	333600650	/nfs/dbraw/zinc/60/06/50/333600650.db2.gz	ZGTWPDZJSUNZIX-GJZGRUSLSA-N	1	0	261.409	4.084	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCc2cc(F)ccc21)c1ccc(C#N)c(F)c1	ZINC000538508671	333601320	/nfs/dbraw/zinc/60/13/20/333601320.db2.gz	XPGNXUWIOLKHTP-ADLMAVQZSA-N	1	0	298.336	4.175	20	30		CIEDRO
C=C(C[NH2+][C@H](C)c1ccc(OC)cc1)c1ccccc1	ZINC000126658797	333601777	/nfs/dbraw/zinc/60/17/77/333601777.db2.gz	CZWIKTNJJUSVFM-OAHLLOKOSA-N	1	0	267.372	4.059	20	30		CIEDRO
C=CCC[C@@H](Nc1cc(C)cc(C[NH+](C)C)c1)C1CC1	ZINC000538546202	333604977	/nfs/dbraw/zinc/60/49/77/333604977.db2.gz	GLNMMQQAQBCQAR-GOSISDBHSA-N	1	0	272.436	4.213	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H](c2ccc(Cl)cc2)C2CC2)o1	ZINC000174243733	335151373	/nfs/dbraw/zinc/15/13/73/335151373.db2.gz	CRYSMLBUORXWAG-INIZCTEOSA-N	1	0	286.762	4.046	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]CCc1c(Cl)cccc1Cl	ZINC000174298437	335152124	/nfs/dbraw/zinc/15/21/24/335152124.db2.gz	LGZCJCJINRCWDK-UHFFFAOYSA-N	1	0	299.245	4.455	20	30		CIEDRO
C=CCCOCC[NH2+][C@H](C)c1ccc(SCC)cc1	ZINC000539051505	333651781	/nfs/dbraw/zinc/65/17/81/333651781.db2.gz	KWQSYDKHTGBLLR-CQSZACIVSA-N	1	0	279.449	4.042	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccc(OC)c(Cl)c1)C1CC1	ZINC000539062551	333653965	/nfs/dbraw/zinc/65/39/65/333653965.db2.gz	YZHCAVRCBIHVJY-OAHLLOKOSA-N	1	0	279.811	4.183	20	30		CIEDRO
C=C(CC)C[NH2+][C@H](CC)c1ccccc1OC(F)F	ZINC000539252551	333663142	/nfs/dbraw/zinc/66/31/42/333663142.db2.gz	MINZOGYIBUIFBX-CYBMUJFWSA-N	1	0	269.335	4.295	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@@H](C)c1ccc(-n2cccn2)cc1	ZINC000539341843	333666741	/nfs/dbraw/zinc/66/67/41/333666741.db2.gz	HHPBEZPUSKWNQN-CVEARBPZSA-N	1	0	283.419	4.268	20	30		CIEDRO
CCC[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(C#N)s1	ZINC000539494370	333673765	/nfs/dbraw/zinc/67/37/65/333673765.db2.gz	HUFFZYRJVFTADZ-SWLSCSKDSA-N	1	0	262.422	4.068	20	30		CIEDRO
C[C@@H]([NH2+]CC(C)(C)c1ccccc1F)c1ccc(C#N)cc1	ZINC000539495308	333673965	/nfs/dbraw/zinc/67/39/65/333673965.db2.gz	LLLZYSSFKXDDQL-CQSZACIVSA-N	1	0	296.389	4.326	20	30		CIEDRO
CC[C@H](C)C[C@H](C)[NH2+][C@@H](C)c1ccc(C#N)c(F)c1	ZINC000539608466	333680578	/nfs/dbraw/zinc/68/05/78/333680578.db2.gz	MMIRGAKQHGBURD-AVGNSLFASA-N	1	0	262.372	4.173	20	30		CIEDRO
CC1(c2ccccc2)CCC([NH2+]Cc2ccc(C#N)o2)CC1	ZINC000539704615	333686318	/nfs/dbraw/zinc/68/63/18/333686318.db2.gz	VQRWVYMXTXVFHF-UHFFFAOYSA-N	1	0	294.398	4.141	20	30		CIEDRO
C[C@H]([NH2+]Cc1cc2ccccc2o1)c1cccc(C#N)c1	ZINC000174431029	335154396	/nfs/dbraw/zinc/15/43/96/335154396.db2.gz	WMUCMZFUMAACEN-ZDUSSCGKSA-N	1	0	276.339	4.155	20	30		CIEDRO
C[C@@H]([NH2+]Cc1cc2ccccc2o1)c1cccc(C#N)c1	ZINC000174431039	335154485	/nfs/dbraw/zinc/15/44/85/335154485.db2.gz	WMUCMZFUMAACEN-CYBMUJFWSA-N	1	0	276.339	4.155	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](C)c1cc(OC)c(OC)cc1F	ZINC000540397899	333728415	/nfs/dbraw/zinc/72/84/15/333728415.db2.gz	XTWBVDXMMIANJX-QWHCGFSZSA-N	1	0	295.398	4.238	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@@H](C)C(F)(F)F)c1ccccc1	ZINC000540459309	333730755	/nfs/dbraw/zinc/73/07/55/333730755.db2.gz	WDESWZKMFWVQBC-TZMCWYRMSA-N	1	0	271.326	4.482	20	30		CIEDRO
CCCc1ccc([C@H]([NH2+]CC2(C#N)CC2)C(C)C)cc1	ZINC000540550886	333735063	/nfs/dbraw/zinc/73/50/63/333735063.db2.gz	PYQTWTRELJBNEF-QGZVFWFLSA-N	1	0	270.420	4.230	20	30		CIEDRO
CC(C)(C)[C@@H](CC1CCCCC1)[NH2+]CC1(C#N)CC1	ZINC000540592512	333736426	/nfs/dbraw/zinc/73/64/26/333736426.db2.gz	UBVBNHBEWYZLBQ-OAHLLOKOSA-N	1	0	262.441	4.265	20	30		CIEDRO
CC(C)(C#N)CC[NH2+][C@H](c1ccccc1)C1CCC1	ZINC000540686554	333741507	/nfs/dbraw/zinc/74/15/07/333741507.db2.gz	PSJQURAVYKBBFY-MRXNPFEDSA-N	1	0	256.393	4.057	20	30		CIEDRO
C[C@H]([NH2+]CCC(C)(C)C#N)c1cccc2ccccc21	ZINC000540714679	333743520	/nfs/dbraw/zinc/74/35/20/333743520.db2.gz	RLTOYGKAUWLQKW-AWEZNQCLSA-N	1	0	266.388	4.430	20	30		CIEDRO
C[C@@H](C[N@H+](C)CC(C)(C)C#N)c1ccc(C(F)(F)F)cc1	ZINC000576129498	335158723	/nfs/dbraw/zinc/15/87/23/335158723.db2.gz	ABUPNMVGQZLJNZ-LBPRGKRZSA-N	1	0	298.352	4.290	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)c1ccc(F)cc1Br	ZINC000129634564	333784281	/nfs/dbraw/zinc/78/42/81/333784281.db2.gz	JGTWAFJGWZNNGG-VHSXEESVSA-N	1	0	286.188	4.203	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@@H](CC)c1nc(C)cs1	ZINC000541626481	333784767	/nfs/dbraw/zinc/78/47/67/333784767.db2.gz	YZRGHTMAUWSPNN-YPMHNXCESA-N	1	0	252.427	4.237	20	30		CIEDRO
CS[C@@H](C[NH2+][C@H](C)c1ccc(C#N)c(F)c1)C(C)(C)C	ZINC000542497040	333828280	/nfs/dbraw/zinc/82/82/80/333828280.db2.gz	ULTGJKXQEOVIMS-ABAIWWIYSA-N	1	0	294.439	4.126	20	30		CIEDRO
C=CC[NH2+][C@@H](Cc1ccccc1)c1sccc1C	ZINC000542522969	333830768	/nfs/dbraw/zinc/83/07/68/333830768.db2.gz	WSMWQXXYMLOMJI-HNNXBMFYSA-N	1	0	257.402	4.116	20	30		CIEDRO
C=C(CC)C[NH2+][C@@H](C)c1oc2ccc(OC)cc2c1C	ZINC000542582793	333833010	/nfs/dbraw/zinc/83/30/10/333833010.db2.gz	MCKJGLZEXCHCML-ZDUSSCGKSA-N	1	0	273.376	4.367	20	30		CIEDRO
C=CCC[C@H](C)[NH2+]CC1(Cc2ccc(F)cc2)CC1	ZINC000542662407	333834820	/nfs/dbraw/zinc/83/48/20/333834820.db2.gz	IQVYIGHTOJQIGD-AWEZNQCLSA-N	1	0	261.384	4.093	20	30		CIEDRO
N#CCC[C@@H]([NH2+]Cc1cccc2[nH]ccc21)c1ccccc1	ZINC000130410686	333841571	/nfs/dbraw/zinc/84/15/71/333841571.db2.gz	BVRAEKLRMRDJLM-GOSISDBHSA-N	1	0	289.382	4.303	20	30		CIEDRO
Cc1cccc2c1CC[C@@H]2[NH2+][C@H](C)c1ccc(C#N)cc1F	ZINC000542834527	333844396	/nfs/dbraw/zinc/84/43/96/333844396.db2.gz	KPQCVPVHTGRWEX-YJYMSZOUSA-N	1	0	294.373	4.344	20	30		CIEDRO
N#CCC1CC[NH+](CCSc2ccc(Cl)cc2)CC1	ZINC000542880153	333847689	/nfs/dbraw/zinc/84/76/89/333847689.db2.gz	PFCFUAXKLYJNAU-UHFFFAOYSA-N	1	0	294.851	4.058	20	30		CIEDRO
CC[C@H](c1ccc(F)cc1F)[NH+]1CCC(CC#N)CC1	ZINC000542879734	333847698	/nfs/dbraw/zinc/84/76/98/333847698.db2.gz	KZZSUNBNKJGRCU-MRXNPFEDSA-N	1	0	278.346	4.042	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@@H](C)[C@H](C)C1)c1ccc(C#N)c(F)c1	ZINC000543638304	333886790	/nfs/dbraw/zinc/88/67/90/333886790.db2.gz	WOAPNZDATJDNFS-NFFDBFGFSA-N	1	0	274.383	4.173	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCc2ccc(F)cc21)c1ccc(C#N)cc1F	ZINC000543762827	333896873	/nfs/dbraw/zinc/89/68/73/333896873.db2.gz	NIFHRIDLOZXFCD-VOJFVSQTSA-N	1	0	298.336	4.175	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+]CCc1c(C)[nH]c2ccccc21	ZINC000544033098	333911451	/nfs/dbraw/zinc/91/14/51/333911451.db2.gz	CMKKHIMHAQSCOC-KBPBESRZSA-N	1	0	270.420	4.209	20	30		CIEDRO
C[C@H]([NH2+]CCC(C)(C)C#N)[C@@H](C)C1CCCCC1	ZINC000544421656	333930896	/nfs/dbraw/zinc/93/08/96/333930896.db2.gz	NLHRPHPGQBXIDN-KGLIPLIRSA-N	1	0	250.430	4.121	20	30		CIEDRO
C=CCC[C@H](C)[NH2+]C[C@@H](C)CSc1ccccc1OC	ZINC000544576254	333937247	/nfs/dbraw/zinc/93/72/47/333937247.db2.gz	NQKCRNLEIUEAJS-CABCVRRESA-N	1	0	293.476	4.368	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H](C)[C@@H](C)C1)c1ccc(C#N)cc1F	ZINC000544615141	333940708	/nfs/dbraw/zinc/94/07/08/333940708.db2.gz	LJKKWHIDNJSJAJ-PWNZVWSESA-N	1	0	274.383	4.173	20	30		CIEDRO
CC[C@H](CC#N)[NH2+]Cc1cccc(-c2ccccc2C)c1	ZINC000545167795	333965714	/nfs/dbraw/zinc/96/57/14/333965714.db2.gz	MKTSXGFPHXFHOC-GOSISDBHSA-N	1	0	278.399	4.444	20	30		CIEDRO
Cc1cccc(C)c1[C@@H](C)[NH2+]Cc1cccc(C#N)c1F	ZINC000545518407	333985880	/nfs/dbraw/zinc/98/58/80/333985880.db2.gz	UKTNRNXJAWTTBS-CQSZACIVSA-N	1	0	282.362	4.165	20	30		CIEDRO
N#Cc1ccc(C[N@@H+]2CCCC[C@@H]2c2ccccc2)cc1	ZINC000545985075	334010414	/nfs/dbraw/zinc/01/04/14/334010414.db2.gz	UCLYHTJTZUDFCJ-LJQANCHMSA-N	1	0	276.383	4.285	20	30		CIEDRO
C[C@@H]([NH2+]C1CC(C)(c2ccccc2)C1)c1ccc(C#N)cc1	ZINC000546684803	334045490	/nfs/dbraw/zinc/04/54/90/334045490.db2.gz	LOVKPHHIDVAMOS-APMMTJHUSA-N	1	0	290.410	4.329	20	30		CIEDRO
C=CCOc1cccc(C[NH2+][C@H](CC)CC(F)(F)F)c1	ZINC000546880747	334053350	/nfs/dbraw/zinc/05/33/50/334053350.db2.gz	KNEGMDIMRNUFRR-CYBMUJFWSA-N	1	0	287.325	4.072	20	30		CIEDRO
CC[C@@H](CC#N)[NH2+]Cc1cccc(-c2ccccc2)c1	ZINC000547286210	334075970	/nfs/dbraw/zinc/07/59/70/334075970.db2.gz	LMGHOWQCBGCXKY-SFHVURJKSA-N	1	0	264.372	4.135	20	30		CIEDRO
CCc1ccc(C(C)(C)C[NH2+]CC(C)(C)CCC#N)cc1	ZINC000236966764	334078248	/nfs/dbraw/zinc/07/82/48/334078248.db2.gz	SXIJTAGYOQIQTR-UHFFFAOYSA-N	1	0	286.463	4.446	20	30		CIEDRO
C=C(C[NH2+][C@@H](C)c1ccc(F)cc1)c1ccccc1	ZINC000134369777	334089129	/nfs/dbraw/zinc/08/91/29/334089129.db2.gz	HZMYRZJACJHTJH-AWEZNQCLSA-N	1	0	255.336	4.190	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C#N)o1)c1cc2ccccc2s1	ZINC000237477552	334089793	/nfs/dbraw/zinc/08/97/93/334089793.db2.gz	QGPZBQPRFYEWAT-LLVKDONJSA-N	1	0	282.368	4.217	20	30		CIEDRO
CC[C@@H](C[N@H+](CC)CCC(C)(C)C#N)c1ccccc1	ZINC000547518195	334097464	/nfs/dbraw/zinc/09/74/64/334097464.db2.gz	GJYHTEPQDJRHLU-INIZCTEOSA-N	1	0	272.436	4.442	20	30		CIEDRO
N#Cc1cccc(C[NH2+]Cc2cc3ccccc3s2)c1	ZINC000237846797	334100232	/nfs/dbraw/zinc/10/02/32/334100232.db2.gz	LFACSBBBKBGGPT-UHFFFAOYSA-N	1	0	278.380	4.063	20	30		CIEDRO
N#Cc1csc(C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2)c1	ZINC000237850159	334100573	/nfs/dbraw/zinc/10/05/73/334100573.db2.gz	OCPVBUVFTFTAIM-FUHWJXTLSA-N	1	0	296.439	4.121	20	30		CIEDRO
CC(C)C[C@H]([NH2+]Cc1ccc(C#N)o1)c1ccccc1	ZINC000135130693	334117070	/nfs/dbraw/zinc/11/70/70/334117070.db2.gz	DZYDBCSSFKNKMK-KRWDZBQOSA-N	1	0	268.360	4.028	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1	ZINC000135143355	334117514	/nfs/dbraw/zinc/11/75/14/334117514.db2.gz	OEVIEQZWOYZQHH-NEPJUHHUSA-N	1	0	276.346	4.027	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccc(C#N)o1)c1cccc(Cl)c1	ZINC000135148138	334117857	/nfs/dbraw/zinc/11/78/57/334117857.db2.gz	WTEJKSKEUZAOKC-OAHLLOKOSA-N	1	0	274.751	4.046	20	30		CIEDRO
CC(C)[N@H+](Cc1ccccc1C(C)(C)C#N)C1CCC1	ZINC000135246919	334121683	/nfs/dbraw/zinc/12/16/83/334121683.db2.gz	LUYGAAROGSLTBN-UHFFFAOYSA-N	1	0	270.420	4.251	20	30		CIEDRO
CC(C)(C#N)CC[NH+]1CCC(c2ccc(Cl)cc2)CC1	ZINC000547841464	334126178	/nfs/dbraw/zinc/12/61/78/334126178.db2.gz	CILJMXRQRCYEIG-UHFFFAOYSA-N	1	0	290.838	4.459	20	30		CIEDRO
C[C@@H]([NH2+]C[C@@H](C)Cc1ccccc1)c1ccc(C#N)cc1	ZINC000547846397	334126648	/nfs/dbraw/zinc/12/66/48/334126648.db2.gz	ZSFHSUOLWGUMJW-JKSUJKDBSA-N	1	0	278.399	4.088	20	30		CIEDRO
CCC[C@@H](C)[C@H]1CCC[N@@H+]1CCCC(C)(C)C#N	ZINC000135340347	334126661	/nfs/dbraw/zinc/12/66/61/334126661.db2.gz	QKYWSPUHNLHYBE-HUUCEWRRSA-N	1	0	250.430	4.217	20	30		CIEDRO
CC(C)(C#N)CC[NH2+][C@H]1CCCC[C@@H]1c1ccccc1	ZINC000547883348	334128756	/nfs/dbraw/zinc/12/87/56/334128756.db2.gz	XCKGHPDKTPDTKR-SJORKVTESA-N	1	0	270.420	4.242	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)s1)c1ccc(Cl)cc1	ZINC000135667368	334135598	/nfs/dbraw/zinc/13/55/98/334135598.db2.gz	YHXDVBPTGVTTKX-JTQLQIEISA-N	1	0	276.792	4.124	20	30		CIEDRO
Cc1ccc(C)c([C@@H](C)[NH2+]Cc2ccc(C#N)s2)c1	ZINC000135668152	334135638	/nfs/dbraw/zinc/13/56/38/334135638.db2.gz	WHALVEVUEWSHCX-CYBMUJFWSA-N	1	0	270.401	4.087	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C#N)s1)c1ccc2c(c1)CCCC2	ZINC000135671780	334135823	/nfs/dbraw/zinc/13/58/23/334135823.db2.gz	WFFYBZNPHBUYBL-CYBMUJFWSA-N	1	0	296.439	4.349	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@@H](C)c1cccc(OC(F)F)c1	ZINC000135717163	334136954	/nfs/dbraw/zinc/13/69/54/334136954.db2.gz	VTZYFZIFNNWPLN-RYUDHWBXSA-N	1	0	269.335	4.293	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCCC(C)(C)C1)c1ccc(C#N)cc1	ZINC000079974566	334164710	/nfs/dbraw/zinc/16/47/10/334164710.db2.gz	NZSZOTSONDHLTG-BBRMVZONSA-N	1	0	256.393	4.178	20	30		CIEDRO
Cc1ccc(C[C@H](C)[NH2+][C@@H](C)c2cccc(C#N)c2)s1	ZINC000080240692	334168164	/nfs/dbraw/zinc/16/81/64/334168164.db2.gz	BLIYPVXYHMKVDE-JSGCOSHPSA-N	1	0	284.428	4.210	20	30		CIEDRO
C[C@H]1CCc2c(F)cccc2[C@H]1[NH2+]Cc1ccc(C#N)cc1	ZINC000080339927	334170606	/nfs/dbraw/zinc/17/06/06/334170606.db2.gz	VXDIPKMKOKTQKI-DJJJIMSYSA-N	1	0	294.373	4.111	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([N@@H+]2CCC[C@@H](c3ccc(F)cc3)CC2)C1	ZINC000549537856	334196691	/nfs/dbraw/zinc/19/66/91/334196691.db2.gz	MILUNVIOGKRQEH-RKVPGOIHSA-N	1	0	286.394	4.087	20	30		CIEDRO
N#C[C@H]1CC[C@H]([N@@H+]2CCCC3(CCCCC3)CC2)C1	ZINC000549612628	334199606	/nfs/dbraw/zinc/19/96/06/334199606.db2.gz	ULQGFTIHDGLWLD-HOTGVXAUSA-N	1	0	260.425	4.115	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@H](C#N)C1)c1ccc(Cl)cc1Cl	ZINC000549613835	334199807	/nfs/dbraw/zinc/19/98/07/334199807.db2.gz	RGSRQZPINOHQSR-SCVCMEIPSA-N	1	0	283.202	4.336	20	30		CIEDRO
C=CCOCC[N@@H+]([C@@H](C)c1ccc(Cl)cc1)C1CC1	ZINC000549899874	334208136	/nfs/dbraw/zinc/20/81/36/334208136.db2.gz	WVEYJKSKYXPFKP-ZDUSSCGKSA-N	1	0	279.811	4.068	20	30		CIEDRO
C=CCOCC[NH2+][C@@H](c1cccs1)C(CC)CC	ZINC000549927844	334209357	/nfs/dbraw/zinc/20/93/57/334209357.db2.gz	GPGRTJURWDZAPS-OAHLLOKOSA-N	1	0	267.438	4.018	20	30		CIEDRO
C[C@@H]([NH2+]C[C@@H](c1ccccc1)C1CC1)c1cccc(C#N)c1	ZINC000550847937	334230174	/nfs/dbraw/zinc/23/01/74/334230174.db2.gz	QMUJAUSGELHSHB-QRWLVFNGSA-N	1	0	290.410	4.403	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H](C)c1nc2c(s1)CCCC2	ZINC000550856443	334230498	/nfs/dbraw/zinc/23/04/98/334230498.db2.gz	VKBXRMVPPMWPRX-LBPRGKRZSA-N	1	0	278.465	4.275	20	30		CIEDRO
CC[N@H+](C[C@H]1CCC(F)(F)C1)[C@H](C)c1ccc(C#N)cc1	ZINC000551096977	334238613	/nfs/dbraw/zinc/23/86/13/334238613.db2.gz	YUUBLTDGSURFJZ-HIFRSBDPSA-N	1	0	292.373	4.377	20	30		CIEDRO
N#CC1CCC(C[NH2+][C@@H]2CCCC23CCCC3)CC1	ZINC000551176352	334239970	/nfs/dbraw/zinc/23/99/70/334239970.db2.gz	STOFHJCJWXMANE-UYSNPLJNSA-N	1	0	260.425	4.019	20	30		CIEDRO
CC1=CCC[C@@H](C)[C@@H]1C[NH2+]C1(c2cccc(C#N)c2)CC1	ZINC000551602708	334255644	/nfs/dbraw/zinc/25/56/44/334255644.db2.gz	LYJBEZGBIOBKFL-CRAIPNDOSA-N	1	0	280.415	4.129	20	30		CIEDRO
C=C(C)[C@H]([NH2+]CCCCCF)c1ccc(F)c(F)c1	ZINC000551702220	334258335	/nfs/dbraw/zinc/25/83/35/334258335.db2.gz	CHVGNKNQRBFQTM-HNNXBMFYSA-N	1	0	271.326	4.311	20	30		CIEDRO
C=C(C)[C@@H]([NH2+]CCCCCF)c1ccc(F)c(F)c1	ZINC000551702221	334258342	/nfs/dbraw/zinc/25/83/42/334258342.db2.gz	CHVGNKNQRBFQTM-OAHLLOKOSA-N	1	0	271.326	4.311	20	30		CIEDRO
C[C@H](C[NH2+]C1(c2cccc(C#N)c2)CC1)Cc1ccccc1	ZINC000551832762	334263791	/nfs/dbraw/zinc/26/37/91/334263791.db2.gz	DQMPXLNQFIWSGO-INIZCTEOSA-N	1	0	290.410	4.016	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C#N)s1)c1ccc(Cl)c(F)c1	ZINC000551956716	334267677	/nfs/dbraw/zinc/26/76/77/334267677.db2.gz	OKODULYUZLHCNK-SECBINFHSA-N	1	0	294.782	4.263	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCCNc1ccccc1)c1ccco1	ZINC000552049228	334281483	/nfs/dbraw/zinc/28/14/83/334281483.db2.gz	QQKGQQRNHLEGAL-QGZVFWFLSA-N	1	0	284.403	4.379	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@@H](CO)CC1CCCC1)c1ccco1	ZINC000552055954	334282467	/nfs/dbraw/zinc/28/24/67/334282467.db2.gz	KUNMLWQYKRLZLR-DLBZAZTESA-N	1	0	291.435	4.065	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@@H](C)c1ccc(OC)c(OC)c1C	ZINC000552055919	334282574	/nfs/dbraw/zinc/28/25/74/334282574.db2.gz	ILXJHIBKHZGELE-KBPBESRZSA-N	1	0	277.408	4.018	20	30		CIEDRO
Cc1cc([NH+]2CCCCCC2)ccc1N[C@@H]1CC[C@H](C#N)C1	ZINC000552088514	334287977	/nfs/dbraw/zinc/28/79/77/334287977.db2.gz	LHUMRNBZQDZRRH-DLBZAZTESA-N	1	0	297.446	4.480	20	30		CIEDRO
Cc1cc([NH+]2CCCCCC2)ccc1N[C@H]1CC[C@H](C#N)C1	ZINC000552088521	334287991	/nfs/dbraw/zinc/28/79/91/334287991.db2.gz	LHUMRNBZQDZRRH-IRXDYDNUSA-N	1	0	297.446	4.480	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCN(C)Cc1ccccc1)c1ccco1	ZINC000552251478	334308692	/nfs/dbraw/zinc/30/86/92/334308692.db2.gz	YUVYBBSEIFJYTD-SFHVURJKSA-N	1	0	298.430	4.009	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H]1CCO[C@@H](CC(C)C)C1)c1ccco1	ZINC000552289605	334313663	/nfs/dbraw/zinc/31/36/63/334313663.db2.gz	CXGJEKGASHDKGR-IKGGRYGDSA-N	1	0	291.435	4.470	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@H]1CCO[C@H](CC(C)C)C1)c1ccco1	ZINC000552289604	334313678	/nfs/dbraw/zinc/31/36/78/334313678.db2.gz	CXGJEKGASHDKGR-BBWFWOEESA-N	1	0	291.435	4.470	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)c1ccc(Cl)cc1	ZINC000248910102	334321564	/nfs/dbraw/zinc/32/15/64/334321564.db2.gz	VFIIFPBNKWBCEB-KCXAZCMYSA-N	1	0	276.811	4.463	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)c1ccc(C(F)(F)F)cc1	ZINC000248916195	334321890	/nfs/dbraw/zinc/32/18/90/334321890.db2.gz	WCHAFVMQHIVFRV-ZOWXZIJZSA-N	1	0	296.336	4.438	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+][C@H](c2ccc(Cl)cc2)C2CC2)C1	ZINC000248940274	334322260	/nfs/dbraw/zinc/32/22/60/334322260.db2.gz	YRZJKHYYAAPUNQ-JLZZUVOBSA-N	1	0	288.822	4.463	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)C1	ZINC000248940276	334322338	/nfs/dbraw/zinc/32/23/38/334322338.db2.gz	YRZJKHYYAAPUNQ-OAUYIBNBSA-N	1	0	288.822	4.463	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@H](c2ccc(Cl)cc2)C2CC2)C1	ZINC000248940270	334322433	/nfs/dbraw/zinc/32/24/33/334322433.db2.gz	YRZJKHYYAAPUNQ-DQYPLSBCSA-N	1	0	288.822	4.463	20	30		CIEDRO
CCC[C@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)c1ccccc1	ZINC000249057477	334326028	/nfs/dbraw/zinc/32/60/28/334326028.db2.gz	ZDMSMGWCQZYRNE-PVAVHDDUSA-N	1	0	256.393	4.200	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+][C@@H](C)c1ccc(F)cc1F	ZINC000552582788	334337771	/nfs/dbraw/zinc/33/77/71/334337771.db2.gz	XCTRFDZGHIYZTG-TUAOUCFPSA-N	1	0	253.336	4.216	20	30		CIEDRO
C=CC[C@@H](C)[C@@H](C)[NH2+][C@@H](C)c1ccc(F)cc1F	ZINC000552582789	334337799	/nfs/dbraw/zinc/33/77/99/334337799.db2.gz	XCTRFDZGHIYZTG-UTUOFQBUSA-N	1	0	253.336	4.216	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+][C@H](C)c1cnn(C(C)C)c1	ZINC000552756808	334344117	/nfs/dbraw/zinc/34/41/17/334344117.db2.gz	QENMENAJJGCEOT-HUUCEWRRSA-N	1	0	263.429	4.250	20	30		CIEDRO
Cc1cc(C)cc([C@H](C)[NH2+]Cc2cc(C#N)ccc2F)c1	ZINC000090117256	334357570	/nfs/dbraw/zinc/35/75/70/334357570.db2.gz	QNXBJSNQNBYHGG-AWEZNQCLSA-N	1	0	282.362	4.165	20	30		CIEDRO
CC[C@@H](CSC)[N@H+](C)Cc1ccccc1C(C)(C)C#N	ZINC000091097436	334371906	/nfs/dbraw/zinc/37/19/06/334371906.db2.gz	CMGVEOMAUDSGLP-HNNXBMFYSA-N	1	0	290.476	4.061	20	30		CIEDRO
CC[C@@H](c1ccncc1)[N@H+](C)CC#Cc1ccc(Cl)cc1	ZINC000091993049	334390089	/nfs/dbraw/zinc/39/00/89/334390089.db2.gz	HXDRONMHYHLFTF-SFHVURJKSA-N	1	0	298.817	4.170	20	30		CIEDRO
COc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(C#N)c(F)c2)cc1	ZINC000553790897	334398994	/nfs/dbraw/zinc/39/89/94/334398994.db2.gz	GIKRDHXTYZLBMO-OLZOCXBDSA-N	1	0	298.361	4.118	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+]Cc1cnc(-c2ccncc2)s1	ZINC000554009874	334406042	/nfs/dbraw/zinc/40/60/42/334406042.db2.gz	NADVJSXPSKOSLS-ZDUSSCGKSA-N	1	0	287.432	4.040	20	30		CIEDRO
Cc1cccc2c1[C@H](C)C[C@H]2[NH2+]CC(C)(C)CCC#N	ZINC000554076460	334409542	/nfs/dbraw/zinc/40/95/42/334409542.db2.gz	FBCJSCMLFYOIMG-GDBMZVCRSA-N	1	0	270.420	4.463	20	30		CIEDRO
CC(C)CC[C@H]1CCC[C@H]1[NH2+]CCC(C)(C)C#N	ZINC000554265197	334419012	/nfs/dbraw/zinc/41/90/12/334419012.db2.gz	XXDZOELCDJAFQI-HUUCEWRRSA-N	1	0	250.430	4.121	20	30		CIEDRO
C[C@H](c1ccccc1)[C@H](C)[NH2+]CC(C)(C)CCC#N	ZINC000554358618	334423979	/nfs/dbraw/zinc/42/39/79/334423979.db2.gz	HQBCLHRMEDFRRH-GJZGRUSLSA-N	1	0	258.409	4.098	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccc(COC)cc1)c1ccco1	ZINC000572548898	334456316	/nfs/dbraw/zinc/45/63/16/334456316.db2.gz	ZPAZOXSIYMJWRH-KRWDZBQOSA-N	1	0	285.387	4.223	20	30		CIEDRO
C[C@H](c1ccccc1)[C@H](C)[NH2+][C@H]1CCc2ccc(C#N)cc21	ZINC000554987908	334463762	/nfs/dbraw/zinc/46/37/62/334463762.db2.gz	GLTICOWKBSJKIL-AVYPCKFXSA-N	1	0	290.410	4.327	20	30		CIEDRO
C=CCC[NH+]1CCC(c2c[nH]c3cc(F)ccc32)CC1	ZINC000555012541	334465016	/nfs/dbraw/zinc/46/50/16/334465016.db2.gz	HJLCPXDCQFSEHP-UHFFFAOYSA-N	1	0	272.367	4.063	20	30		CIEDRO
Cc1ccccc1C(C)(C)[NH2+]Cc1ccc(C#N)c(F)c1	ZINC000555612062	334484397	/nfs/dbraw/zinc/48/43/97/334484397.db2.gz	HVCSWYQGJUYGNU-UHFFFAOYSA-N	1	0	282.362	4.031	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C	ZINC000556214718	334500355	/nfs/dbraw/zinc/50/03/55/334500355.db2.gz	BWXWDJWCHHXHHL-ZDUSSCGKSA-N	1	0	276.380	4.156	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+]Cc1ccc(C(C)(F)F)cc1	ZINC000556217888	334500485	/nfs/dbraw/zinc/50/04/85/334500485.db2.gz	OKBQIURLUYQFHO-GFCCVEGCSA-N	1	0	253.336	4.243	20	30		CIEDRO
C[C@@H]([NH2+]C1CC(C(C)(C)C)C1)c1ccc(C#N)c(F)c1	ZINC000556221874	334501073	/nfs/dbraw/zinc/50/10/73/334501073.db2.gz	FZTVEXUQGUQUBA-VCANKDNSSA-N	1	0	274.383	4.173	20	30		CIEDRO
C=C(C)CN1CCC([NH2+][C@H](C)c2ccc(CC)s2)CC1	ZINC000153048742	334549596	/nfs/dbraw/zinc/54/95/96/334549596.db2.gz	MCOQDNDXBMPZNI-CQSZACIVSA-N	1	0	292.492	4.002	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+]CCC1C[C@@H](C)O[C@H](C)C1	ZINC000566861290	334667246	/nfs/dbraw/zinc/66/72/46/334667246.db2.gz	JHWJINPJNJVVBC-INMHGKMJSA-N	1	0	267.457	4.305	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccccc1)c1ccc(C#N)cc1	ZINC000567371485	334710000	/nfs/dbraw/zinc/71/00/00/334710000.db2.gz	ZVCPESVKNUPCFC-QBTDHISASA-N	1	0	290.410	4.401	20	30		CIEDRO
C=CCCCC[NH2+][C@H](C)c1nccc2ccccc21	ZINC000567404668	334713361	/nfs/dbraw/zinc/71/33/61/334713361.db2.gz	IGJVVTWWXCNALH-CQSZACIVSA-N	1	0	254.377	4.242	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCC1(F)CCC1)c1ccco1	ZINC000568676793	334835918	/nfs/dbraw/zinc/83/59/18/334835918.db2.gz	OLIXCIXKJMBQGY-ZDUSSCGKSA-N	1	0	251.345	4.159	20	30		CIEDRO
CC(C)(C)C[C@@H]([NH2+]Cc1ccc(C#N)cn1)c1ccccc1	ZINC000569135751	334857459	/nfs/dbraw/zinc/85/74/59/334857459.db2.gz	ILNBRJYPSLERGT-GOSISDBHSA-N	1	0	293.414	4.220	20	30		CIEDRO
CSc1ccccc1C[C@@H](C)[NH2+]CC(C)(C)CCC#N	ZINC000572862573	334885459	/nfs/dbraw/zinc/88/54/59/334885459.db2.gz	NGPUGESFJIXNRG-CQSZACIVSA-N	1	0	290.476	4.259	20	30		CIEDRO
C[C@@H]([NH2+]C(C1CCC1)C1CCC1)c1cccc(C#N)c1	ZINC000325044818	334893096	/nfs/dbraw/zinc/89/30/96/334893096.db2.gz	NPTBXGITKVOERE-CYBMUJFWSA-N	1	0	268.404	4.178	20	30		CIEDRO
C=CCCC[NH2+]C[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000573045387	334903113	/nfs/dbraw/zinc/90/31/13/334903113.db2.gz	MNSDZRUSRXEWKP-LBPRGKRZSA-N	1	0	271.326	4.365	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@@H]1CCCc2ccc(OC)cc21	ZINC000343508069	335205851	/nfs/dbraw/zinc/20/58/51/335205851.db2.gz	PKFORGPHNAYNBS-RHSMWYFYSA-N	1	0	259.393	4.017	20	30		CIEDRO
N#CCC[C@H](C#N)C[NH2+][C@@H](c1ccc(F)cc1)C1CCCC1	ZINC000576979583	335272633	/nfs/dbraw/zinc/27/26/33/335272633.db2.gz	GUKIRKMIZXQDCZ-RDTXWAMCSA-N	1	0	299.393	4.090	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]Cc1cc(Br)cs1	ZINC000380091897	335321711	/nfs/dbraw/zinc/32/17/11/335321711.db2.gz	GYSSNEZXQUKZJO-UHFFFAOYSA-N	1	0	288.254	4.203	20	30		CIEDRO
C=CC[C@@H](Cc1ccccc1)[NH2+]C1CCC2(CCCO2)CC1	ZINC000577267399	335332453	/nfs/dbraw/zinc/33/24/53/335332453.db2.gz	GZRSGYUPTOUNER-GPJFCIFZSA-N	1	0	299.458	4.255	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@@H](C)c1c(F)cncc1F	ZINC000577306760	335337006	/nfs/dbraw/zinc/33/70/06/335337006.db2.gz	VHVRKKLKLBKYET-RYUDHWBXSA-N	1	0	268.351	4.145	20	30		CIEDRO
N#Cc1csc(C[NH2+][C@@H]2CCc3c2cccc3Cl)c1	ZINC000177692130	335379190	/nfs/dbraw/zinc/37/91/90/335379190.db2.gz	GZJOOXKIHSFACI-OAHLLOKOSA-N	1	0	288.803	4.050	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CCSc3ccccc32)c(F)c1	ZINC000177857175	335404227	/nfs/dbraw/zinc/40/42/27/335404227.db2.gz	XTYZEDWCTLMXKI-MRXNPFEDSA-N	1	0	298.386	4.024	20	30		CIEDRO
Cc1cc(C)cc([C@H](C)[NH2+]Cc2ccc(C#N)cc2F)c1	ZINC000177855953	335404254	/nfs/dbraw/zinc/40/42/54/335404254.db2.gz	PGAMOMBDNZDQKP-AWEZNQCLSA-N	1	0	282.362	4.165	20	30		CIEDRO
Cc1ccccc1[C@H]([NH2+]Cc1ccc(C#N)cn1)C(C)(C)C	ZINC000577883908	335416908	/nfs/dbraw/zinc/41/69/08/335416908.db2.gz	WSONOFVNCMNLJP-SFHVURJKSA-N	1	0	293.414	4.139	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@H]1CCCc2cc(OC)ccc21	ZINC000348288625	335421972	/nfs/dbraw/zinc/42/19/72/335421972.db2.gz	FLJLAMAURPJLAS-YOEHRIQHSA-N	1	0	259.393	4.017	20	30		CIEDRO
Cc1cc(C)cc([C@H](C)[NH2+]Cc2ccccc2C#N)c1	ZINC000179085482	335472752	/nfs/dbraw/zinc/47/27/52/335472752.db2.gz	KAXBFZGKVVYNKS-HNNXBMFYSA-N	1	0	264.372	4.026	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](C)c1ccc(OC)c(OC)c1	ZINC000180878131	335627680	/nfs/dbraw/zinc/62/76/80/335627680.db2.gz	GAEDKIQYVJLHLP-KBPBESRZSA-N	1	0	277.408	4.099	20	30		CIEDRO
C=C(C)COCC[NH2+][C@@H]1CCCc2c3cc(C)ccc3[nH]c21	ZINC000578574614	335650511	/nfs/dbraw/zinc/65/05/11/335650511.db2.gz	SXFPWKXOIMEZMS-GOSISDBHSA-N	1	0	298.430	4.036	20	30		CIEDRO
COc1cc(C#N)ccc1C[NH2+][C@H](C)c1c(C)cccc1C	ZINC000578823782	335677919	/nfs/dbraw/zinc/67/79/19/335677919.db2.gz	IZHJAJXQNLZWNX-OAHLLOKOSA-N	1	0	294.398	4.035	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1cc(C#N)ccc1OC)c1ccc(C)cc1	ZINC000181683371	335778307	/nfs/dbraw/zinc/77/83/07/335778307.db2.gz	BIUFQZXQXLDOAB-GOSISDBHSA-N	1	0	294.398	4.116	20	30		CIEDRO
C[C@@H]([NH2+]CCCC#N)c1ccc(Oc2ccccc2)cc1	ZINC000181817418	335786693	/nfs/dbraw/zinc/78/66/93/335786693.db2.gz	WQTSETMXVYTSRG-OAHLLOKOSA-N	1	0	280.371	4.433	20	30		CIEDRO
CC(C)[C@H]([NH2+]CCCC#N)c1cccc(C(F)(F)F)c1	ZINC000181898669	335790323	/nfs/dbraw/zinc/79/03/23/335790323.db2.gz	KANJCXJGYBTWIE-AWEZNQCLSA-N	1	0	284.325	4.296	20	30		CIEDRO
CC(C)(C#N)CCC[NH2+]C1(Cc2ccccc2)CCCC1	ZINC000185828524	335957692	/nfs/dbraw/zinc/95/76/92/335957692.db2.gz	ABLPDBBRKIRESL-UHFFFAOYSA-N	1	0	284.447	4.461	20	30		CIEDRO
N#CCC1CC[NH+](CCc2c(Cl)cccc2Cl)CC1	ZINC000580874313	335977761	/nfs/dbraw/zinc/97/77/61/335977761.db2.gz	WJYMLPIPUOKEOO-UHFFFAOYSA-N	1	0	297.229	4.162	20	30		CIEDRO
C=CC[NH2+][C@@H](c1ccc(Br)cc1)C1CCC1	ZINC000381366081	336060388	/nfs/dbraw/zinc/06/03/88/336060388.db2.gz	GGWONYZJQLFZRO-CQSZACIVSA-N	1	0	280.209	4.066	20	30		CIEDRO
C=C(C)C[NH2+][C@H](CCOC)c1ccc(Cl)c(Cl)c1	ZINC000581360962	336060822	/nfs/dbraw/zinc/06/08/22/336060822.db2.gz	RSDCAXVPKANCPU-CQSZACIVSA-N	1	0	288.218	4.237	20	30		CIEDRO
C=CCCCC[NH2+][C@H](c1ccccc1)c1ccccn1	ZINC000381849980	336074398	/nfs/dbraw/zinc/07/43/98/336074398.db2.gz	PNKJKVMEEHVYTA-GOSISDBHSA-N	1	0	266.388	4.117	20	30		CIEDRO
C=CCCCC[NH2+][C@@H](c1ccccc1)c1ccccn1	ZINC000381849982	336074519	/nfs/dbraw/zinc/07/45/19/336074519.db2.gz	PNKJKVMEEHVYTA-SFHVURJKSA-N	1	0	266.388	4.117	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H]1c2ccccc2CC12CCOCC2	ZINC000581458743	336080477	/nfs/dbraw/zinc/08/04/77/336080477.db2.gz	JQLMWGIESHVAMJ-QFBILLFUSA-N	1	0	299.458	4.415	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@H](C)c1cnc2ccsc2c1	ZINC000385149607	336141073	/nfs/dbraw/zinc/14/10/73/336141073.db2.gz	JVQGEQPTIKTLFE-LLVKDONJSA-N	1	0	260.406	4.159	20	30		CIEDRO
CC[C@@H](c1cccc(OC)c1)[N@H+](C)Cc1cccc(C#N)c1	ZINC000581848269	336151448	/nfs/dbraw/zinc/15/14/48/336151448.db2.gz	SHEKWTSNCMADEF-IBGZPJMESA-N	1	0	294.398	4.150	20	30		CIEDRO
C=CCCCCC[N@H+]1CCCC[C@@H]1c1nccn1CC	ZINC000581896858	336162616	/nfs/dbraw/zinc/16/26/16/336162616.db2.gz	BMPFVNGVHABKFA-MRXNPFEDSA-N	1	0	275.440	4.176	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)CCC(C)(C)C)c1cccc(C#N)c1	ZINC000386016804	336164448	/nfs/dbraw/zinc/16/44/48/336164448.db2.gz	NUECQNYZBALLBD-UONOGXRCSA-N	1	0	258.409	4.424	20	30		CIEDRO
CC[C@@H](C)[N@H+](Cc1ccccc1)Cc1ccccc1C#N	ZINC000387331794	336192590	/nfs/dbraw/zinc/19/25/90/336192590.db2.gz	FHVPMUIIQRGOAD-MRXNPFEDSA-N	1	0	278.399	4.359	20	30		CIEDRO
CC[C@@H](C)[N@H+](Cc1ccccc1)Cc1cccc(C#N)c1	ZINC000387366327	336192979	/nfs/dbraw/zinc/19/29/79/336192979.db2.gz	LARQFGPREADKEV-MRXNPFEDSA-N	1	0	278.399	4.359	20	30		CIEDRO
CC[C@@H](C)[N@H+](Cc1ccccc1)Cc1ccc(C#N)cc1	ZINC000387404011	336193628	/nfs/dbraw/zinc/19/36/28/336193628.db2.gz	RIRDTHFIGKTYGH-MRXNPFEDSA-N	1	0	278.399	4.359	20	30		CIEDRO
Cc1cc2cc(C[NH2+]C3CCC(C)(C#N)CC3)ccc2[nH]1	ZINC000336210244	534089748	/nfs/dbraw/zinc/08/97/48/534089748.db2.gz	QPIHHFDRXDOGTD-UHFFFAOYSA-N	1	0	281.403	4.038	20	30		CIEDRO
C[C@@H]1CC[C@H]([NH2+][C@H](CCC#N)c2ccccc2)C[C@@H]1C	ZINC000343862956	534258104	/nfs/dbraw/zinc/25/81/04/534258104.db2.gz	ONOCXOOXQFLJLC-MXSMSXNCSA-N	1	0	270.420	4.446	20	30		CIEDRO
CCOc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(C#N)cc2)cc1	ZINC000078973589	521226244	/nfs/dbraw/zinc/22/62/44/521226244.db2.gz	DDVFAWJCULXXJF-HUUCEWRRSA-N	1	0	294.398	4.369	20	30		CIEDRO
CCOc1cccc(C[NH2+][C@H](CC)c2ccc(C#N)cc2)c1	ZINC000278328229	521375367	/nfs/dbraw/zinc/37/53/67/521375367.db2.gz	VXWIUENEHLPDOY-LJQANCHMSA-N	1	0	294.398	4.198	20	30		CIEDRO
CCOc1ccccc1C[NH2+][C@H](CC)c1ccc(C#N)cc1	ZINC000278292771	521505467	/nfs/dbraw/zinc/50/54/67/521505467.db2.gz	RCSZHCZJSXWFHO-GOSISDBHSA-N	1	0	294.398	4.198	20	30		CIEDRO
CCOc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000121840740	521573226	/nfs/dbraw/zinc/57/32/26/521573226.db2.gz	NFFNNVJIDQBUSB-LSDHHAIUSA-N	1	0	294.398	4.369	20	30		CIEDRO
CC[C@H]([NH2+][C@@H](CC)c1ccc(C#N)cc1)c1ccncc1	ZINC000278747709	522705509	/nfs/dbraw/zinc/70/55/09/522705509.db2.gz	NROGKRHJRBAUAR-ROUUACIJSA-N	1	0	279.387	4.145	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CCc2c1cccc2F)c1ccc(C#N)cc1	ZINC000278701821	522722601	/nfs/dbraw/zinc/72/26/01/522722601.db2.gz	LCSDSUUBOMQOLM-RBUKOAKNSA-N	1	0	294.373	4.426	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CCc2cc(F)ccc21)c1ccc(C#N)cc1	ZINC000278633873	522723993	/nfs/dbraw/zinc/72/39/93/522723993.db2.gz	HEQBMKPERMWAPX-RBUKOAKNSA-N	1	0	294.373	4.426	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CCCc2occc21)c1ccc(C#N)cc1	ZINC000278183443	522753114	/nfs/dbraw/zinc/75/31/14/522753114.db2.gz	DQQJZCQKLRFCEM-IRXDYDNUSA-N	1	0	280.371	4.270	20	30		CIEDRO
CC[C@@H]([NH2+]C[C@@H](C)c1c(C)noc1C)c1ccc(C#N)cc1	ZINC000278832984	522846794	/nfs/dbraw/zinc/84/67/94/522846794.db2.gz	UEIQKRYSXQMFBE-SJKOYZFVSA-N	1	0	297.402	4.008	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccc(C)cc1OC)c1ccc(C#N)cc1	ZINC000278797557	522874020	/nfs/dbraw/zinc/87/40/20/522874020.db2.gz	QYNRMXPGXAODDN-GOSISDBHSA-N	1	0	294.398	4.116	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccc(C)s1)c1ccc(C#N)cc1	ZINC000278319399	522875864	/nfs/dbraw/zinc/87/58/64/522875864.db2.gz	UUNPROXZYKJXGF-MRXNPFEDSA-N	1	0	270.401	4.169	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H]1CCc2cc(F)ccc21)c1ccc(C#N)cc1	ZINC000278633874	522927186	/nfs/dbraw/zinc/92/71/86/522927186.db2.gz	HEQBMKPERMWAPX-RTBURBONSA-N	1	0	294.373	4.426	20	30		CIEDRO
CC[C@@H]([NH2+][C@H](CC)c1ccc(C#N)cc1)c1ccncc1	ZINC000278747706	522944028	/nfs/dbraw/zinc/94/40/28/522944028.db2.gz	NROGKRHJRBAUAR-QZTJIDSGSA-N	1	0	279.387	4.145	20	30		CIEDRO
Cc1ccccc1[C@H]([NH2+]Cc1ccc(C#N)cc1)C1CC1	ZINC000264839997	525429543	/nfs/dbraw/zinc/42/95/43/525429543.db2.gz	IMXNZWNVTZFEJY-LJQANCHMSA-N	1	0	276.383	4.108	20	30		CIEDRO
C[C@H]([NH2+][C@@H](c1ccccc1)C1CC1)c1ccc(C#N)cc1	ZINC000037075243	525547172	/nfs/dbraw/zinc/54/71/72/525547172.db2.gz	MASXFZLJOIMMKB-LIRRHRJNSA-N	1	0	276.383	4.360	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)c1ccc(Cl)cn1	ZINC000274972900	525607633	/nfs/dbraw/zinc/60/76/33/525607633.db2.gz	YHXMWBCDFOILHL-NWDGAFQWSA-N	1	0	285.778	4.018	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCCc2ccccc21)c1cccc(C#N)c1	ZINC000037230738	525641263	/nfs/dbraw/zinc/64/12/63/525641263.db2.gz	MMHLGGFTDPMPQT-AUUYWEPGSA-N	1	0	276.383	4.286	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCCc2ccccc21)c1ccc(C#N)cc1	ZINC000020133550	525681107	/nfs/dbraw/zinc/68/11/07/525681107.db2.gz	CHFYLKUWFUXQIH-KUHUBIRLSA-N	1	0	276.383	4.286	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCSc2ccccc21)c1ccc(C#N)cc1	ZINC000036991847	525691467	/nfs/dbraw/zinc/69/14/67/525691467.db2.gz	GROWFDUQKVVHLG-DYVFJYSZSA-N	1	0	294.423	4.446	20	30		CIEDRO
CS[C@@H]1CCC[C@@H]([NH2+][C@@H](C)c2ccc(C#N)c(F)c2)C1	ZINC000271969375	525832197	/nfs/dbraw/zinc/83/21/97/525832197.db2.gz	UDGQYCICYIYPKF-NILFDRSVSA-N	1	0	292.423	4.022	20	30		CIEDRO
Cc1c([C@H](C)[NH2+][C@@H](C)c2ccc(C#N)cc2)cnn1C(C)C	ZINC000276369593	525922079	/nfs/dbraw/zinc/92/20/79/525922079.db2.gz	OFUZVXWNZIAOIM-KBPBESRZSA-N	1	0	296.418	4.056	20	30		CIEDRO
C=CC[N@@H+](Cc1ccsc1C)Cc1cccc(C#N)c1	ZINC000350704068	526379538	/nfs/dbraw/zinc/37/95/38/526379538.db2.gz	XAAIFWUMTSGGMT-UHFFFAOYSA-N	1	0	282.412	4.116	20	30		CIEDRO
C=C(C)CC[NH+]1CCC(OC2CCC(C)CC2)CC1	ZINC000352043883	526442557	/nfs/dbraw/zinc/44/25/57/526442557.db2.gz	GYUUSQCBZZQCLZ-UHFFFAOYSA-N	1	0	265.441	4.012	20	30		CIEDRO
N#CCCCC[NH2+][C@H](Cc1ccccc1)c1ccccc1	ZINC000057620332	526444586	/nfs/dbraw/zinc/44/45/86/526444586.db2.gz	SDWCNGQFCZBJRD-LJQANCHMSA-N	1	0	278.399	4.254	20	30		CIEDRO
N#Cc1cccc(C[N@@H+]2CCC[C@H]2c2cccs2)c1F	ZINC000340764868	526704244	/nfs/dbraw/zinc/70/42/44/526704244.db2.gz	WHZPNXWTOCOYEK-AWEZNQCLSA-N	1	0	286.375	4.096	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+][C@@H](CCC(C)C)c1ccoc1	ZINC000353589430	526802767	/nfs/dbraw/zinc/80/27/67/526802767.db2.gz	GISLZIFSAVROFQ-SZMVWBNQSA-N	1	0	291.435	4.328	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+][C@@H](CC)c1ccc(OC)c(OC)c1	ZINC000353846751	527140011	/nfs/dbraw/zinc/14/00/11/527140011.db2.gz	RDWLZRZPMNMLBH-LZWOXQAQSA-N	1	0	291.435	4.345	20	30		CIEDRO
C=CCC[N@H+](Cc1ccco1)Cc1ccc(C)s1	ZINC000352241179	527325499	/nfs/dbraw/zinc/32/54/99/527325499.db2.gz	IFTUERFTNCZBHU-UHFFFAOYSA-N	1	0	261.390	4.228	20	30		CIEDRO
C=CCCOCC[NH2+][C@H](CC1CCC1)c1ccccc1	ZINC000344340762	527368725	/nfs/dbraw/zinc/36/87/25/527368725.db2.gz	YYYKHNKARVQEAX-GOSISDBHSA-N	1	0	273.420	4.100	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+][C@H](CC)c1ccc(OC)c(OC)c1	ZINC000352250107	527424952	/nfs/dbraw/zinc/42/49/52/527424952.db2.gz	CAGIKOGWFAYCFI-UKRRQHHQSA-N	1	0	277.408	4.099	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccc2c(c1)COC2)c1ccco1	ZINC000353628873	527449547	/nfs/dbraw/zinc/44/95/47/527449547.db2.gz	CQEYSSWJACPTAM-QGZVFWFLSA-N	1	0	283.371	4.107	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCc1sc(C)nc1C)c1ccco1	ZINC000356099205	527483434	/nfs/dbraw/zinc/48/34/34/527483434.db2.gz	XCLRDGYZGINDSJ-AWEZNQCLSA-N	1	0	290.432	4.193	20	30		CIEDRO
CC(C)c1ccc2c(c1)[C@H]([NH2+]CCCC#N)CCC2	ZINC000346809251	528154504	/nfs/dbraw/zinc/15/45/04/528154504.db2.gz	OVNZCOJXFZFFNE-QGZVFWFLSA-N	1	0	256.393	4.081	20	30		CIEDRO
CC(C)[C@@H]([NH2+]C[C@@H](C#N)CCC#N)c1ccc(Cl)cc1	ZINC000356114119	528587784	/nfs/dbraw/zinc/58/77/84/528587784.db2.gz	QBMBJGUOAVNLQJ-CZUORRHYSA-N	1	0	289.810	4.070	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@H]2C[C@H](c3ccccc3F)C2)CC1	ZINC000336204610	528833590	/nfs/dbraw/zinc/83/35/90/528833590.db2.gz	JJELYFOCECEISB-CAXWJHAQSA-N	1	0	286.394	4.134	20	30		CIEDRO
C[C@H](c1cccs1)[N@H+](C)CCCCC(C)(C)C#N	ZINC000235168058	260241839	/nfs/dbraw/zinc/24/18/39/260241839.db2.gz	BQCRJIRFJQVUHH-CYBMUJFWSA-N	1	0	264.438	4.461	20	30		CIEDRO
C[C@H](c1ccc(C#N)cc1)[N@H+](C)Cc1ccc(F)c(F)c1	ZINC000122875374	187057071	/nfs/dbraw/zinc/05/70/71/187057071.db2.gz	JBQUGUHZLUPZSU-GFCCVEGCSA-N	1	0	286.325	4.029	20	30		CIEDRO
CC#CC[N@@H+](CC)C(c1ccccc1)c1ccccc1	ZINC000574247279	335003844	/nfs/dbraw/zinc/00/38/44/335003844.db2.gz	NPYGGQQDJVDWRC-UHFFFAOYSA-N	1	0	263.384	4.121	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](C)c1cncc(Br)c1	ZINC000574291840	335007982	/nfs/dbraw/zinc/00/79/82/335007982.db2.gz	FECWJKDDLWNBME-RYUDHWBXSA-N	1	0	297.240	4.240	20	30		CIEDRO
CC(C)[C@@H](C)[N@H+](C)Cc1ccc(C#N)cc1C(F)(F)F	ZINC000574334289	335011330	/nfs/dbraw/zinc/01/13/30/335011330.db2.gz	CCYPNQKZTWIDNX-LLVKDONJSA-N	1	0	284.325	4.053	20	30		CIEDRO
C[C@H]1C[C@H](c2ccccc2)[N@H+](Cc2cc(C#N)cs2)C1	ZINC000574320827	335010280	/nfs/dbraw/zinc/01/02/80/335010280.db2.gz	ZROTZZVNLDEVDZ-SUMWQHHRSA-N	1	0	282.412	4.203	20	30		CIEDRO
CC(C)CCn1cccc1C[NH+]1CCC(CCC#N)CC1	ZINC000574400499	335016593	/nfs/dbraw/zinc/01/65/93/335016593.db2.gz	RYNBXPGWXIOXDE-UHFFFAOYSA-N	1	0	287.451	4.050	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCN(C)c1ccccc1)c1ccco1	ZINC000574471283	335022456	/nfs/dbraw/zinc/02/24/56/335022456.db2.gz	DTGKVTLQEKMWKE-QGZVFWFLSA-N	1	0	284.403	4.013	20	30		CIEDRO
CCCC1(C[NH2+][C@H]2CCc3ccc(C#N)cc32)CCC1	ZINC000574489305	335023493	/nfs/dbraw/zinc/02/34/93/335023493.db2.gz	GXGZJLPROHRQAJ-KRWDZBQOSA-N	1	0	268.404	4.106	20	30		CIEDRO
CCC(CC)[C@H]([NH2+]C[C@@H](C#N)CCC#N)c1cccs1	ZINC000574631157	335035030	/nfs/dbraw/zinc/03/50/30/335035030.db2.gz	COSPZRYTDUJBRG-CJNGLKHVSA-N	1	0	289.448	4.259	20	30		CIEDRO
C[C@@H]([NH2+]C1CCC(C)(C#N)CC1)c1ccc(F)c(F)c1	ZINC000336208087	533338053	/nfs/dbraw/zinc/33/80/53/533338053.db2.gz	WACLXULAJLTCTB-FFKNIBCLSA-N	1	0	278.346	4.088	20	30		CIEDRO
C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CCCc2cc(C#N)ccc21	ZINC000341756596	130024640	/nfs/dbraw/zinc/02/46/40/130024640.db2.gz	FVBGKLAEKDHSLG-BVGQSLNGSA-N	1	0	268.404	4.104	20	30		CIEDRO
C[C@H]([NH2+]CCC1=CCCCC1)c1ccc(C#N)cc1	ZINC000020093657	170992738	/nfs/dbraw/zinc/99/27/38/170992738.db2.gz	JLWJNOLKLAGTOT-AWEZNQCLSA-N	1	0	254.377	4.099	20	30		CIEDRO
Cc1ccccc1[C@H](C)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000020126165	171009645	/nfs/dbraw/zinc/00/96/45/171009645.db2.gz	AFJNXLVVQQYSLQ-GJZGRUSLSA-N	1	0	264.372	4.279	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCCc2ccccc21)c1ccc(C#N)cc1	ZINC000020133553	171021503	/nfs/dbraw/zinc/02/15/03/171021503.db2.gz	CHFYLKUWFUXQIH-LIRRHRJNSA-N	1	0	276.383	4.286	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H]2CCSc3ccc(F)cc32)cc1	ZINC000035230436	172070776	/nfs/dbraw/zinc/07/07/76/172070776.db2.gz	UAJUMHXBLGRYPK-INIZCTEOSA-N	1	0	298.386	4.024	20	30		CIEDRO
N#CCC[C@H]([NH2+]Cc1cccc2cc[nH]c21)c1ccccc1	ZINC000344846879	225179218	/nfs/dbraw/zinc/17/92/18/225179218.db2.gz	FZNYPJCBBWJEGI-SFHVURJKSA-N	1	0	289.382	4.303	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccc(C#N)cc1)c1cccc(Cl)c1	ZINC000036921349	260051938	/nfs/dbraw/zinc/05/19/38/260051938.db2.gz	KTARMKGPBBOLQC-QGZVFWFLSA-N	1	0	284.790	4.453	20	30		CIEDRO
Cc1cc(C)cc([C@@H]2CCC[C@@H]2[NH2+]CCCCC#N)c1	ZINC000367480798	260066620	/nfs/dbraw/zinc/06/66/20/260066620.db2.gz	NNWOPPQIDFHUMD-ROUUACIJSA-N	1	0	270.420	4.223	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1ccc(OCC#N)cc1)c1cccs1	ZINC000037235046	260076485	/nfs/dbraw/zinc/07/64/85/260076485.db2.gz	UCTIZMHRHQAHQC-QWHCGFSZSA-N	1	0	286.400	4.062	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCC[C@H](C(F)(F)F)C1)c1cccc(C#N)c1	ZINC000037318806	260086514	/nfs/dbraw/zinc/08/65/14/260086514.db2.gz	HVOWIRSONZAHIQ-CQDKDKBSSA-N	1	0	296.336	4.330	20	30		CIEDRO
CC1(C#N)CCC([NH2+]Cc2c(F)cccc2Cl)CC1	ZINC000449107168	260220765	/nfs/dbraw/zinc/22/07/65/260220765.db2.gz	OUAOGHSZQBXRLB-UHFFFAOYSA-N	1	0	280.774	4.041	20	30		CIEDRO
C[C@H](c1ccccc1Cl)[N@H+](C)CCCCC#N	ZINC000061559627	260233173	/nfs/dbraw/zinc/23/31/73/260233173.db2.gz	WBQSCMUSIPDBDG-GFCCVEGCSA-N	1	0	250.773	4.027	20	30		CIEDRO
CCS[C@H]1CCCC[C@@H]1[NH2+]C1CCC(C)(C#N)CC1	ZINC000449174417	260272511	/nfs/dbraw/zinc/27/25/11/260272511.db2.gz	HLKLONNRHNIJPH-PYBGIAKNSA-N	1	0	280.481	4.113	20	30		CIEDRO
CC(C)(C)[C@@H]([NH2+]CCCSCC#N)c1ccccc1	ZINC000072515144	260276623	/nfs/dbraw/zinc/27/66/23/260276623.db2.gz	RSXDHXOBUOWFCN-HNNXBMFYSA-N	1	0	276.449	4.010	20	30		CIEDRO
C[C@H]1CC(C)(C)CC[C@H]1[NH2+]C1CCC(C)(C#N)CC1	ZINC000449187414	260284858	/nfs/dbraw/zinc/28/48/58/260284858.db2.gz	QOFHHHNQYAOLLP-UJEKJILKSA-N	1	0	262.441	4.263	20	30		CIEDRO
COc1ccc2cc(C[NH2+]CC(C)(C)CCC#N)ccc2c1	ZINC000078052240	260299028	/nfs/dbraw/zinc/29/90/28/260299028.db2.gz	CUKLHZPTEGBKFY-UHFFFAOYSA-N	1	0	296.414	4.268	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@H]1CCc2cnn(C(C)C)c2C1	ZINC000449280934	260349269	/nfs/dbraw/zinc/34/92/69/260349269.db2.gz	YKDMSXAHOOHOPN-RDJZCZTQSA-N	1	0	289.467	4.046	20	30		CIEDRO
C=C1CC[NH+]([C@@H](C)c2ccc(C(F)(F)F)cc2)CC1	ZINC000520850846	260365493	/nfs/dbraw/zinc/36/54/93/260365493.db2.gz	YFDNBDITKFKMEM-LBPRGKRZSA-N	1	0	269.310	4.418	20	30		CIEDRO
C=C(C)C[NH2+][C@H](C)C(c1ccccc1)c1ccccc1	ZINC000131673154	260409931	/nfs/dbraw/zinc/40/99/31/260409931.db2.gz	UTLXBJHWWWRPCH-MRXNPFEDSA-N	1	0	265.400	4.373	20	30		CIEDRO
C[C@@H]([NH2+]CCC(C)(C)C#N)c1ccc(Br)cc1	ZINC000087591719	260411711	/nfs/dbraw/zinc/41/17/11/260411711.db2.gz	SZLDSBNTQUQDPM-LLVKDONJSA-N	1	0	295.224	4.040	20	30		CIEDRO
C[C@@H](c1cccnc1)[N@H+](C)Cc1ccccc1C(C)(C)C#N	ZINC000093227468	260513098	/nfs/dbraw/zinc/51/30/98/260513098.db2.gz	KRFFGSKNEOBAIN-HNNXBMFYSA-N	1	0	293.414	4.076	20	30		CIEDRO
C=CCOc1cccc(C[NH2+][C@@H](C)CCc2ccccc2)c1	ZINC000518748139	260665370	/nfs/dbraw/zinc/66/53/70/260665370.db2.gz	HGLKZNNVHCYURC-KRWDZBQOSA-N	1	0	295.426	4.362	20	30		CIEDRO
N#CCCCC[NH2+][C@H]1CCCC[C@@H]1Cc1ccccc1	ZINC000119028425	260690703	/nfs/dbraw/zinc/69/07/03/260690703.db2.gz	PHRNXLMOXCCOID-MSOLQXFVSA-N	1	0	270.420	4.071	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@H]1CCO[C@@H](c2cccs2)C1	ZINC000449633041	260773697	/nfs/dbraw/zinc/77/36/97/260773697.db2.gz	YITKFYDERRYOFO-SOUVJXGZSA-N	1	0	279.449	4.303	20	30		CIEDRO
C[C@@H]([NH2+]CCCCC#N)c1cccc2ccccc21	ZINC000131028640	260867615	/nfs/dbraw/zinc/86/76/15/260867615.db2.gz	HHNNOJGGJQDYOD-CQSZACIVSA-N	1	0	252.361	4.184	20	30		CIEDRO
Cc1ccc([C@H]2CCCCC[N@@H+]2CCCCC#N)o1	ZINC000158681417	260898834	/nfs/dbraw/zinc/89/88/34/260898834.db2.gz	ZXDXRDVEVCAHKE-OAHLLOKOSA-N	1	0	260.381	4.199	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)c1cc(Br)ccc1F	ZINC000161656973	261108675	/nfs/dbraw/zinc/10/86/75/261108675.db2.gz	OSBSOQRQRNJHAH-VHSXEESVSA-N	1	0	286.188	4.203	20	30		CIEDRO
Cc1cc([C@@H]([NH2+]Cc2cccc(C#N)c2)C2CC2)ccc1F	ZINC000158696767	261169595	/nfs/dbraw/zinc/16/95/95/261169595.db2.gz	LVXZVPHIFRVDPQ-IBGZPJMESA-N	1	0	294.373	4.247	20	30		CIEDRO
N#CCCCC[N@@H+]1Cc2ccccc2C[C@H]1c1ccccc1	ZINC000174039811	261176116	/nfs/dbraw/zinc/17/61/16/261176116.db2.gz	JHVSAZSKROWYFY-FQEVSTJZSA-N	1	0	290.410	4.480	20	30		CIEDRO
CC#CCC[N@@H+]1CCC[C@H]1c1nc2ccccc2n1C(C)C	ZINC000462358796	261191486	/nfs/dbraw/zinc/19/14/86/261191486.db2.gz	MFORPUNEFXZPTA-SFHVURJKSA-N	1	0	295.430	4.168	20	30		CIEDRO
C=CCSCC[NH2+][C@@H](C)c1cc2ccccc2o1	ZINC000180457283	261423695	/nfs/dbraw/zinc/42/36/95/261423695.db2.gz	ULVTYKBZBAJIAF-LBPRGKRZSA-N	1	0	261.390	4.003	20	30		CIEDRO
CCOc1cccc([C@H](C)[NH2+][C@@H](C)c2ccc(C#N)cc2)c1	ZINC000174012804	261553378	/nfs/dbraw/zinc/55/33/78/261553378.db2.gz	ZNGZGPVGSJQZEZ-GJZGRUSLSA-N	1	0	294.398	4.369	20	30		CIEDRO
CCCOCc1ccccc1C[NH2+]CC(C)(C)CCC#N	ZINC000174278902	261565467	/nfs/dbraw/zinc/56/54/67/261565467.db2.gz	NAQYASREYMNERC-UHFFFAOYSA-N	1	0	288.435	4.033	20	30		CIEDRO
COc1ccc([C@H]([NH2+]CCCC(C)(C)C#N)C2CC2)cc1	ZINC000174813586	261584177	/nfs/dbraw/zinc/58/41/77/261584177.db2.gz	NYQZPCPVEVNTHB-QGZVFWFLSA-N	1	0	286.419	4.066	20	30		CIEDRO
Cc1cccc(NC2CC[NH+](CCCC(C)(C)C#N)CC2)c1	ZINC000174873155	261587260	/nfs/dbraw/zinc/58/72/60/261587260.db2.gz	IPLQTRCVVRPNHD-UHFFFAOYSA-N	1	0	299.462	4.201	20	30		CIEDRO
CC(C)[C@@H](C[NH2+][C@H](C)c1ccc(C#N)cc1)c1cccnc1	ZINC000176814699	261670510	/nfs/dbraw/zinc/67/05/10/261670510.db2.gz	MNAZEJDIPDNXML-DNVCBOLYSA-N	1	0	293.414	4.044	20	30		CIEDRO
C[C@H]([NH2+]CCCC(C)(C)C#N)c1ccc(OC(F)F)cc1	ZINC000179602500	261801803	/nfs/dbraw/zinc/80/18/03/261801803.db2.gz	ZULQMRIBHKMMMV-LBPRGKRZSA-N	1	0	296.361	4.269	20	30		CIEDRO
COc1ccc([C@H]([NH2+]CCCC(C)(C)C#N)C(C)C)cc1	ZINC000182049786	261921064	/nfs/dbraw/zinc/92/10/64/261921064.db2.gz	UAMZOLCJAKTMAI-QGZVFWFLSA-N	1	0	288.435	4.312	20	30		CIEDRO
C[C@H](c1ccc(C#N)cc1)[N@@H+]1CCCC2(CCCC2)C1	ZINC000445870826	262006618	/nfs/dbraw/zinc/00/66/18/262006618.db2.gz	DWQFCZCUILTHDX-OAHLLOKOSA-N	1	0	268.404	4.275	20	30		CIEDRO
C[C@H]([NH2+]CCCC#N)[C@@H](C)c1ccccc1C(F)(F)F	ZINC000184088462	262007750	/nfs/dbraw/zinc/00/77/50/262007750.db2.gz	CYXXZFLEBVMJGL-NEPJUHHUSA-N	1	0	284.325	4.091	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1cccc(OC(F)F)c1	ZINC000185779956	262070554	/nfs/dbraw/zinc/07/05/54/262070554.db2.gz	KSUHZNNOGJYHOQ-DYEKYZERSA-N	1	0	294.345	4.021	20	30		CIEDRO
N#CCCCC[NH+]1CCC(c2ccc(Cl)cc2)CC1	ZINC000185789890	262071580	/nfs/dbraw/zinc/07/15/80/262071580.db2.gz	AJDNWFCZVJEVAY-UHFFFAOYSA-N	1	0	276.811	4.213	20	30		CIEDRO
CC[C@@H]([NH2+]CCCCC#N)c1cccc(Cl)c1F	ZINC000185980109	262074196	/nfs/dbraw/zinc/07/41/96/262074196.db2.gz	PVADJYIIISFCKA-CYBMUJFWSA-N	1	0	268.763	4.214	20	30		CIEDRO
Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](CCC#N)c2ccccc2)c1	ZINC000186150581	262081644	/nfs/dbraw/zinc/08/16/44/262081644.db2.gz	KAUQQMCTCDCRLL-QAPCUYQASA-N	1	0	294.398	4.396	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1ccc(OC(F)F)c(OCC)c1	ZINC000393804206	262188235	/nfs/dbraw/zinc/18/82/35/262188235.db2.gz	OCWOFSSLHPSKLA-CYBMUJFWSA-N	1	0	299.361	4.131	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H]1CCSc2ccccc21	ZINC000311138370	262196645	/nfs/dbraw/zinc/19/66/45/262196645.db2.gz	FNQVWNYHMWQUPX-CQSZACIVSA-N	1	0	261.434	4.415	20	30		CIEDRO
C[N@H+](Cc1cccc(C#N)c1)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000497760099	262202217	/nfs/dbraw/zinc/20/22/17/262202217.db2.gz	WYKWYIXPNIWBNL-UXHICEINSA-N	1	0	290.410	4.326	20	30		CIEDRO
N#CCC[C@H]([NH2+][C@H]1CCCc2occc21)c1ccccc1	ZINC000193039586	262215144	/nfs/dbraw/zinc/21/51/44/262215144.db2.gz	XYWWPPOLGROJRN-IRXDYDNUSA-N	1	0	280.371	4.292	20	30		CIEDRO
N#CCC[C@H]([NH2+][C@@H]1CCCc2occc21)c1ccccc1	ZINC000193039554	262215152	/nfs/dbraw/zinc/21/51/52/262215152.db2.gz	XYWWPPOLGROJRN-DLBZAZTESA-N	1	0	280.371	4.292	20	30		CIEDRO
CC[NH+](CC)Cc1ccc(N[C@H]2CCC[C@@H](C#N)C2)cc1	ZINC000193339390	262221163	/nfs/dbraw/zinc/22/11/63/262221163.db2.gz	MQMSOTQJQORVAJ-AEFFLSMTSA-N	1	0	285.435	4.023	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H](C)c2cccs2)cc1	ZINC000020148581	262232792	/nfs/dbraw/zinc/23/27/92/262232792.db2.gz	WNBKLGQALVQGOT-ZDUSSCGKSA-N	1	0	273.401	4.164	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](CCC#N)c1ccccc1)c1cccc(O)c1	ZINC000194935137	262243632	/nfs/dbraw/zinc/24/36/32/262243632.db2.gz	ROYMTZSBLJNNEC-KDOFPFPSSA-N	1	0	280.371	4.088	20	30		CIEDRO
C[C@@H]([NH2+][C@H](CCC#N)c1ccccc1)c1cccc(O)c1	ZINC000194935163	262243899	/nfs/dbraw/zinc/24/38/99/262243899.db2.gz	ROYMTZSBLJNNEC-RDTXWAMCSA-N	1	0	280.371	4.088	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)c1ccc(Cl)cc1	ZINC000185755942	262308351	/nfs/dbraw/zinc/30/83/51/262308351.db2.gz	NRHOXFCUPBXHGG-TYNCELHUSA-N	1	0	262.784	4.073	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1ccc(F)cc1Cl	ZINC000185839963	262309640	/nfs/dbraw/zinc/30/96/40/262309640.db2.gz	YOFSOOZKAJAKFT-GVXVVHGQSA-N	1	0	280.774	4.212	20	30		CIEDRO
C=CCCC[NH2+][C@H]1C[C@@H](C)Sc2sccc21	ZINC000336665775	262377813	/nfs/dbraw/zinc/37/78/13/262377813.db2.gz	JQWFZJYYDNUESW-PWSUYJOCSA-N	1	0	253.436	4.229	20	30		CIEDRO
C/C(=C/c1ccccc1C(F)(F)F)C[NH2+]CCCC#N	ZINC000337265690	262443723	/nfs/dbraw/zinc/44/37/23/262443723.db2.gz	UMAFZFXBKLRAAJ-BENRWUELSA-N	1	0	282.309	4.002	20	30		CIEDRO
CC(C)[C@@H](CC(F)(F)F)[NH2+]CCC1(C#N)CCCCC1	ZINC000411601395	262700270	/nfs/dbraw/zinc/70/02/70/262700270.db2.gz	AGDZSUYXIIZHIU-CYBMUJFWSA-N	1	0	290.373	4.417	20	30		CIEDRO
CC(C)[C@H](CC(F)(F)F)[NH2+]CCC1(C#N)CCCCC1	ZINC000411601400	262700390	/nfs/dbraw/zinc/70/03/90/262700390.db2.gz	AGDZSUYXIIZHIU-ZDUSSCGKSA-N	1	0	290.373	4.417	20	30		CIEDRO
Cc1cc2c(cc1C)[C@H]([NH2+]CC(C)(C)CC#N)CCCO2	ZINC000414163134	262819398	/nfs/dbraw/zinc/81/93/98/262819398.db2.gz	IDJMVWKDEFGNCR-MRXNPFEDSA-N	1	0	286.419	4.047	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+]C[C@H](C)CC(F)(F)F	ZINC000414264583	262832455	/nfs/dbraw/zinc/83/24/55/262832455.db2.gz	KSCICPWQFCKGPG-VXGBXAGGSA-N	1	0	251.336	4.299	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C1CCC(COC)CC1)c1ccco1	ZINC000414318611	262842785	/nfs/dbraw/zinc/84/27/85/262842785.db2.gz	YAMWKOPQAKTNNJ-UYSNPLJNSA-N	1	0	277.408	4.082	20	30		CIEDRO
Cc1ccccc1[C@@H]([NH2+]CCCC(C)(C)C#N)C1CC1	ZINC000271974796	263000911	/nfs/dbraw/zinc/00/09/11/263000911.db2.gz	CVBNGEFKZZPYPF-KRWDZBQOSA-N	1	0	270.420	4.366	20	30		CIEDRO
CC1(C#N)CC[NH+](CCc2ccc3ccccc3c2)CC1	ZINC000272602215	263007433	/nfs/dbraw/zinc/00/74/33/263007433.db2.gz	RCRSIIQDNFWYGM-UHFFFAOYSA-N	1	0	278.399	4.008	20	30		CIEDRO
C[C@H]([NH2+]CCC(C)(C)C#N)c1cc2ccccc2o1	ZINC000273259091	263014406	/nfs/dbraw/zinc/01/44/06/263014406.db2.gz	HYSOFUFCEOFLGN-LBPRGKRZSA-N	1	0	256.349	4.023	20	30		CIEDRO
CC[C@@H](CC#N)[NH2+][C@H]1CC=C(c2ccc(F)cc2)CC1	ZINC000273834538	263019739	/nfs/dbraw/zinc/01/97/39/263019739.db2.gz	GQBWTMNTUKLBBK-IRXDYDNUSA-N	1	0	272.367	4.043	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](C#N)C1)c1nc(-c2ccccc2)cs1	ZINC000274603158	263027517	/nfs/dbraw/zinc/02/75/17/263027517.db2.gz	IIQYMKPKTYLEIZ-GUTXKFCHSA-N	1	0	297.427	4.153	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](C#N)C1)c1cccc(C(F)(F)F)c1	ZINC000274657586	263028781	/nfs/dbraw/zinc/02/87/81/263028781.db2.gz	UVIMQOBFBDNYFL-WDMOLILDSA-N	1	0	282.309	4.048	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)CCC#N)c1cccc(Cl)c1Cl	ZINC000276319177	263035883	/nfs/dbraw/zinc/03/58/83/263035883.db2.gz	OEDDKAJFOOLRLS-VHSXEESVSA-N	1	0	271.191	4.336	20	30		CIEDRO
C[C@@H](C[NH+]1CCC(C)(C#N)CC1)c1cccc(Cl)c1	ZINC000276329595	263036334	/nfs/dbraw/zinc/03/63/34/263036334.db2.gz	XUHKJKZPEQUWJL-ZDUSSCGKSA-N	1	0	276.811	4.069	20	30		CIEDRO
CC(C)[C@@H]1C[C@@H]([NH2+][C@H](CCC#N)c2ccccc2)CS1	ZINC000277262178	263040436	/nfs/dbraw/zinc/04/04/36/263040436.db2.gz	PBDBGWVXYPUFPI-ZACQAIPSSA-N	1	0	288.460	4.151	20	30		CIEDRO
CC(C)[N@H+](CCCCC(C)(C)C#N)Cc1ccco1	ZINC000277644630	263042595	/nfs/dbraw/zinc/04/25/95/263042595.db2.gz	HVFAAACWRURPDJ-UHFFFAOYSA-N	1	0	262.397	4.210	20	30		CIEDRO
CC[C@@H]1C[N@@H+]([C@@H]2CC[C@H](C#N)C2)CC[C@H]1c1ccccc1	ZINC000278737089	263050488	/nfs/dbraw/zinc/05/04/88/263050488.db2.gz	WGCZFGVOBAFBCA-QFHJOOASSA-N	1	0	282.431	4.194	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H]1CC[C@H](c2ccc(F)cc2)C1	ZINC000279655555	263056490	/nfs/dbraw/zinc/05/64/90/263056490.db2.gz	LCOFCNFGVQDNKB-RDJZCZTQSA-N	1	0	288.410	4.381	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1CC[C@H](c2ccc(F)cc2)C1	ZINC000279655552	263056651	/nfs/dbraw/zinc/05/66/51/263056651.db2.gz	LCOFCNFGVQDNKB-DOTOQJQBSA-N	1	0	288.410	4.381	20	30		CIEDRO
CSc1ccccc1[C@H](C)[NH2+]CCCC(C)(C)C#N	ZINC000281720473	263071528	/nfs/dbraw/zinc/07/15/28/263071528.db2.gz	PEYSXSJPVILNFX-ZDUSSCGKSA-N	1	0	276.449	4.389	20	30		CIEDRO
C[C@H]([NH2+]CC1CCC(C#N)CC1)c1csc(Cl)c1	ZINC000282117674	263074383	/nfs/dbraw/zinc/07/43/83/263074383.db2.gz	AOVZKTQOCWQEAG-UNXYVOJBSA-N	1	0	282.840	4.382	20	30		CIEDRO
CC[C@@H]([NH2+]CC1CCC(C#N)CC1)c1ccc(N(C)C)cc1	ZINC000282188204	263074952	/nfs/dbraw/zinc/07/49/52/263074952.db2.gz	GCVMISBBESYHJS-LADRWXRNSA-N	1	0	299.462	4.123	20	30		CIEDRO
CC[C@@H]([NH2+]CC1CCC(C#N)CC1)c1ccccc1F	ZINC000282207317	263075051	/nfs/dbraw/zinc/07/50/51/263075051.db2.gz	HGHAGTRQVVNVNA-MQBCKMQZSA-N	1	0	274.383	4.196	20	30		CIEDRO
C[C@@H](CC[NH2+]CC1CCC(C#N)CC1)c1ccccc1	ZINC000282260395	263075242	/nfs/dbraw/zinc/07/52/42/263075242.db2.gz	JXFXAQILYGJTNU-GTPINHCMSA-N	1	0	270.420	4.100	20	30		CIEDRO
N#CC1CCC(C[NH2+][C@H]2CCCc3sccc32)CC1	ZINC000282249044	263075406	/nfs/dbraw/zinc/07/54/06/263075406.db2.gz	JKIGENIZAMRHHS-PIMMBPRGSA-N	1	0	274.433	4.045	20	30		CIEDRO
C[C@@H](CCc1ccc(F)cc1)[NH2+]CC1CCC(C#N)CC1	ZINC000282237693	263075443	/nfs/dbraw/zinc/07/54/43/263075443.db2.gz	IWBFQAFFCNURGP-OOHWJJMZSA-N	1	0	288.410	4.066	20	30		CIEDRO
Cc1ccc2c(c1)OCCC[C@H]2[NH2+]CC1CCC(C#N)CC1	ZINC000282290655	263075782	/nfs/dbraw/zinc/07/57/82/263075782.db2.gz	LQAGWWNNSYDLRJ-LEOMRAHMSA-N	1	0	298.430	4.128	20	30		CIEDRO
C[C@@H]([NH2+]CC1CCC(C#N)CC1)[C@@H](C)c1ccccc1	ZINC000282328101	263075931	/nfs/dbraw/zinc/07/59/31/263075931.db2.gz	NYMABBQPRXGPGT-NUWOQIAWSA-N	1	0	270.420	4.098	20	30		CIEDRO
C[C@H]([NH2+]CC1CCC(C#N)CC1)c1ccc2ccccc2n1	ZINC000282345118	263075932	/nfs/dbraw/zinc/07/59/32/263075932.db2.gz	OZBHGPLTJRSOAZ-FHERZECASA-N	1	0	293.414	4.215	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@@H](C#N)C1)c1ccc(-c2cccnc2)cc1	ZINC000282399527	263076370	/nfs/dbraw/zinc/07/63/70/263076370.db2.gz	RPWKVKXSRRZEMP-QMTMVMCOSA-N	1	0	291.398	4.091	20	30		CIEDRO
N#CC1CCC(C[NH2+][C@@H](c2ccc(F)cc2)C2CC2)CC1	ZINC000282460336	263076806	/nfs/dbraw/zinc/07/68/06/263076806.db2.gz	VNVPMPXRIMKJBH-WTNGLUPJSA-N	1	0	286.394	4.196	20	30		CIEDRO
C[C@H]([NH2+]CC1CCC(C#N)CC1)c1ccccc1Cl	ZINC000282478517	263076954	/nfs/dbraw/zinc/07/69/54/263076954.db2.gz	SKWQOCSIJFUNAV-HSBZDZAISA-N	1	0	276.811	4.321	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](C#N)C1)c1ccc(C(F)(F)F)cc1	ZINC000282520464	263077301	/nfs/dbraw/zinc/07/73/01/263077301.db2.gz	ZOSCHZOWZFFRCC-WDMOLILDSA-N	1	0	282.309	4.048	20	30		CIEDRO
CC[C@@H](C#N)Nc1ccc([NH+]2CCCCCC2)cc1C	ZINC000285138936	263090486	/nfs/dbraw/zinc/09/04/86/263090486.db2.gz	OBWTTXWGPPUGAG-HNNXBMFYSA-N	1	0	271.408	4.090	20	30		CIEDRO
C[C@H](Cc1ccccc1C(F)(F)F)[N@H+](C)CCCCC#N	ZINC000287490234	263102038	/nfs/dbraw/zinc/10/20/38/263102038.db2.gz	SSIUAPHZJVTCFJ-CYBMUJFWSA-N	1	0	298.352	4.262	20	30		CIEDRO
CC(C)Oc1ccc([C@H]2CCC[C@H]2[NH2+]CCCC#N)cc1	ZINC000366677252	263115666	/nfs/dbraw/zinc/11/56/66/263115666.db2.gz	KFFJXEHSHZMBDR-QZTJIDSGSA-N	1	0	286.419	4.003	20	30		CIEDRO
C[C@@H]1C[C@@H]([NH2+]CC2CCC(C#N)CC2)c2ccccc21	ZINC000290341115	263116097	/nfs/dbraw/zinc/11/60/97/263116097.db2.gz	PKNPDSFPMMVSON-SEVFCGSRSA-N	1	0	268.404	4.154	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H](CC)c1ccc(C#N)cc1	ZINC000340425016	263139729	/nfs/dbraw/zinc/13/97/29/263139729.db2.gz	BWABGBNHWRURDH-MRXNPFEDSA-N	1	0	256.393	4.201	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H]1CCSc2ccc(OC)cc21	ZINC000340429135	263141229	/nfs/dbraw/zinc/14/12/29/263141229.db2.gz	GXQHONYMQLOABC-HNNXBMFYSA-N	1	0	291.460	4.424	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H]1CCCOc2ccccc21	ZINC000340427197	263141854	/nfs/dbraw/zinc/14/18/54/263141854.db2.gz	MJPWCWJGGJWUKY-OAHLLOKOSA-N	1	0	259.393	4.092	20	30		CIEDRO
CC1(C)CC[C@H]1[NH2+][C@@H](CCCC#N)c1ccccc1	ZINC000340430977	263141884	/nfs/dbraw/zinc/14/18/84/263141884.db2.gz	IKZYGFBHVVVUQK-JKSUJKDBSA-N	1	0	256.393	4.200	20	30		CIEDRO
C[C@H]([NH2+][C@@H](CCCC#N)c1ccccc1)c1cncc(F)c1	ZINC000340446006	263152503	/nfs/dbraw/zinc/15/25/03/263152503.db2.gz	MWBVVLRKNQZOTR-KSSFIOAISA-N	1	0	297.377	4.306	20	30		CIEDRO
CC1(C)CC([NH2+][C@H](CCCC#N)c2ccccc2)C1	ZINC000340448004	263154381	/nfs/dbraw/zinc/15/43/81/263154381.db2.gz	QOKXQOSQPKQSSC-MRXNPFEDSA-N	1	0	256.393	4.200	20	30		CIEDRO
C[C@@H]([NH2+][C@H](CCCC#N)c1ccccc1)c1ccncc1F	ZINC000340449718	263155628	/nfs/dbraw/zinc/15/56/28/263155628.db2.gz	WBRUCBMCUPGSCF-RDTXWAMCSA-N	1	0	297.377	4.306	20	30		CIEDRO
C[C@H]([NH2+][C@@H](CCCC#N)c1ccccc1)c1ccncc1	ZINC000340451669	263155864	/nfs/dbraw/zinc/15/58/64/263155864.db2.gz	OPZWSMDKUIFMQW-YJBOKZPZSA-N	1	0	279.387	4.167	20	30		CIEDRO
N#CCCC[C@@H]([NH2+]C1Cc2ccccc2C1)c1ccccc1	ZINC000340453901	263156983	/nfs/dbraw/zinc/15/69/83/263156983.db2.gz	RSFIUADIOXXKTI-HXUWFJFHSA-N	1	0	290.410	4.179	20	30		CIEDRO
CC(C)C[C@@H](C)[NH2+][C@@H](CCCC#N)c1ccccc1	ZINC000340454945	263158237	/nfs/dbraw/zinc/15/82/37/263158237.db2.gz	UDYVNRZKBDIDPJ-WBVHZDCISA-N	1	0	258.409	4.446	20	30		CIEDRO
CC[C@H](C)[C@H](C)[NH2+][C@H](CCCC#N)c1ccccc1	ZINC000340461468	263161402	/nfs/dbraw/zinc/16/14/02/263161402.db2.gz	ZIZLGVDWGZVAFN-YQQAZPJKSA-N	1	0	258.409	4.446	20	30		CIEDRO
Cc1cccnc1[C@@H]1CCC[C@@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)C1	ZINC000294929529	263169573	/nfs/dbraw/zinc/16/95/73/263169573.db2.gz	BNPJSGRPRAXHLJ-MLHJIOFPSA-N	1	0	297.446	4.088	20	30		CIEDRO
CCC[C@H](Cc1ccccc1)[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000294943829	263169866	/nfs/dbraw/zinc/16/98/66/263169866.db2.gz	CMNYXSJSFVLHHQ-KSZLIROESA-N	1	0	270.420	4.070	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@H]2CC[C@H](Cc3ccccc3)C2)C1	ZINC000295017014	263170758	/nfs/dbraw/zinc/17/07/58/263170758.db2.gz	KEBLHHUOUYOKGK-RDGPPVDQSA-N	1	0	282.431	4.070	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@H]2CCC[C@H]2Cc2ccccc2)C1	ZINC000295005594	263170840	/nfs/dbraw/zinc/17/08/40/263170840.db2.gz	IZCJTPLYJVJSTD-VJANTYMQSA-N	1	0	282.431	4.070	20	30		CIEDRO
CCC[C@@H](C[NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccccc1	ZINC000295109163	263172292	/nfs/dbraw/zinc/17/22/92/263172292.db2.gz	UTKXZMKDZZWNJV-SZMVWBNQSA-N	1	0	270.420	4.242	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+]Cc2c(Cl)cccc2Cl)C1	ZINC000295123188	263172571	/nfs/dbraw/zinc/17/25/71/263172571.db2.gz	WYCAYTCVNYZXQY-QWRGUYRKSA-N	1	0	283.202	4.165	20	30		CIEDRO
COc1ccc2cc(C[NH2+][C@H]3CC[C@@H](CC#N)C3)ccc2c1	ZINC000295139112	263172931	/nfs/dbraw/zinc/17/29/31/263172931.db2.gz	ZIARRJJWLGXUBF-KSSFIOAISA-N	1	0	294.398	4.020	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+]C(c2ccccc2)c2ccccc2)C1	ZINC000295865363	263183197	/nfs/dbraw/zinc/18/31/97/263183197.db2.gz	BTZNOPYIXWJNJN-LPHOPBHVSA-N	1	0	290.410	4.448	20	30		CIEDRO
Cc1ccc2c(c1)[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)CCC2	ZINC000296325792	263190160	/nfs/dbraw/zinc/19/01/60/263190160.db2.gz	HBJBVWCQZQBZMF-QILLFSRXSA-N	1	0	268.404	4.044	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1cc(C)ccc1OC	ZINC000296508115	263192412	/nfs/dbraw/zinc/19/24/12/263192412.db2.gz	PIXQAIMPFWURMH-ZOBUZTSGSA-N	1	0	286.419	4.127	20	30		CIEDRO
CCc1ccc([C@@H](C)[NH2+][C@H]2CC[C@@H](CC#N)C2)s1	ZINC000296643844	263194711	/nfs/dbraw/zinc/19/47/11/263194711.db2.gz	YGRYQTAWEZWCGC-AGIUHOORSA-N	1	0	262.422	4.043	20	30		CIEDRO
CCc1ccc([C@H](C)[NH2+][C@H]2CC[C@@H](CC#N)C2)s1	ZINC000296643846	263194771	/nfs/dbraw/zinc/19/47/71/263194771.db2.gz	YGRYQTAWEZWCGC-AVGNSLFASA-N	1	0	262.422	4.043	20	30		CIEDRO
N#CCC[C@@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1ccccc1	ZINC000296926540	263198276	/nfs/dbraw/zinc/19/82/76/263198276.db2.gz	PXHNJCGGYQMMBW-IAGOWNOFSA-N	1	0	292.382	4.014	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)CCC#N)c1ccc(C(F)(F)F)cc1	ZINC000298459586	263219739	/nfs/dbraw/zinc/21/97/39/263219739.db2.gz	IBPWIXUEEQZSKP-WDEREUQCSA-N	1	0	270.298	4.048	20	30		CIEDRO
C=CCC[C@H]([NH2+]C1CCN(c2cccs2)CC1)C1CC1	ZINC000121633900	263295507	/nfs/dbraw/zinc/29/55/07/263295507.db2.gz	UDODILTYMLVQOV-INIZCTEOSA-N	1	0	290.476	4.051	20	30		CIEDRO
C=CCCC[C@@H](C)[N@@H+]1CCC[C@@H](c2nccs2)C1	ZINC000340959818	263313662	/nfs/dbraw/zinc/31/36/62/263313662.db2.gz	XLMDUGPMIJDEDA-ZIAGYGMSSA-N	1	0	264.438	4.067	20	30		CIEDRO
C=CCC[NH2+][C@@H](CCOC)c1ccc(Cl)c(Cl)c1	ZINC000342010203	263377407	/nfs/dbraw/zinc/37/74/07/263377407.db2.gz	CMYKRUITRPBXNA-AWEZNQCLSA-N	1	0	288.218	4.237	20	30		CIEDRO
C=C(C)[C@H]([NH2+][C@H]1CC[C@H]1SC)c1ccc(F)c(F)c1	ZINC000425333720	264011058	/nfs/dbraw/zinc/01/10/58/264011058.db2.gz	FMOCLLRJUGLMLD-ZNMIVQPWSA-N	1	0	283.387	4.066	20	30		CIEDRO
C[C@H](C[NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc(C(F)(F)F)cc1	ZINC000425350997	264026672	/nfs/dbraw/zinc/02/66/72/264026672.db2.gz	IDHJHURZECRALS-TYNCELHUSA-N	1	0	296.336	4.091	20	30		CIEDRO
C=CCSCC[NH2+][C@@H](C)c1cc2ccc(C)cc2o1	ZINC000426015192	264309011	/nfs/dbraw/zinc/30/90/11/264309011.db2.gz	GPTAZJAUXZBACY-ZDUSSCGKSA-N	1	0	275.417	4.311	20	30		CIEDRO
CC[N@H+](Cc1cccs1)[C@H](C)c1cccc(C#N)c1	ZINC000189755497	264321880	/nfs/dbraw/zinc/32/18/80/264321880.db2.gz	KMIGFRGTHIHBQE-CYBMUJFWSA-N	1	0	270.401	4.203	20	30		CIEDRO
CC[N@H+](Cc1c[nH]c2ccccc12)Cc1cccc(C#N)c1	ZINC000190470086	264363050	/nfs/dbraw/zinc/36/30/50/264363050.db2.gz	YMMZRQBEWAYKJX-UHFFFAOYSA-N	1	0	289.382	4.062	20	30		CIEDRO
C#CCCCC[NH2+][C@@H](C)c1cccc(-c2ccncc2)c1	ZINC000090398721	264399838	/nfs/dbraw/zinc/39/98/38/264399838.db2.gz	RDVFIVUIZSGBND-INIZCTEOSA-N	1	0	278.399	4.203	20	30		CIEDRO
C[C@H](c1cccc(C#N)c1)[N@H+](C)CCCCC(F)(F)F	ZINC000425537189	264441772	/nfs/dbraw/zinc/44/17/72/264441772.db2.gz	PWXUJDMOQYYZIP-GFCCVEGCSA-N	1	0	284.325	4.284	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@@H](C)c1nc(Cc2ccccc2)no1	ZINC000191593873	264517240	/nfs/dbraw/zinc/51/72/40/264517240.db2.gz	MAHFHSYGZIGDDU-HOCLYGCPSA-N	1	0	299.418	4.056	20	30		CIEDRO
C=CCCCCCC[NH2+][C@@H](C)c1ccc([S@](C)=O)cc1	ZINC000286875570	264593279	/nfs/dbraw/zinc/59/32/79/264593279.db2.gz	CCEWDITUXHPVKY-YWZLYKJASA-N	1	0	293.476	4.211	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H](C)c2ccc(C)cc2O)cc1	ZINC000287401245	264629735	/nfs/dbraw/zinc/62/97/35/264629735.db2.gz	JDKZJSSTJWWFDB-HNNXBMFYSA-N	1	0	297.398	4.116	20	30		CIEDRO
CC(C)C[C@H]([NH2+]Cc1cc(C#N)cs1)c1ccccc1	ZINC000093492139	265181211	/nfs/dbraw/zinc/18/12/11/265181211.db2.gz	VFGDHKSSPDFGQM-KRWDZBQOSA-N	1	0	284.428	4.497	20	30		CIEDRO
C[C@@H]([NH2+]Cc1cc(C#N)cs1)c1ccccc1Cl	ZINC000093492055	265182377	/nfs/dbraw/zinc/18/23/77/265182377.db2.gz	DQMOHPFWKYUODG-SNVBAGLBSA-N	1	0	276.792	4.124	20	30		CIEDRO
C[C@@H]([NH2+]Cc1cc(C#N)cs1)c1ccc2c(c1)CCCC2	ZINC000093492169	265182430	/nfs/dbraw/zinc/18/24/30/265182430.db2.gz	RYUSFNPAYICKNU-CYBMUJFWSA-N	1	0	296.439	4.349	20	30		CIEDRO
CC(C)Cc1ccc(C[NH2+]Cc2cccc(C#N)c2)cc1	ZINC000094896172	265270789	/nfs/dbraw/zinc/27/07/89/265270789.db2.gz	AAVRUWFXHXTAED-UHFFFAOYSA-N	1	0	278.399	4.047	20	30		CIEDRO
Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cccc(C#N)c2)cc1F	ZINC000094952262	265277321	/nfs/dbraw/zinc/27/73/21/265277321.db2.gz	SVGNKFHJNWOUJQ-UONOGXRCSA-N	1	0	282.362	4.418	20	30		CIEDRO
C=C(C)C[N@@H+]1CCC[C@H]1Cc1c(F)cccc1Cl	ZINC000519005421	265294393	/nfs/dbraw/zinc/29/43/93/265294393.db2.gz	WZDBUWLYSDHNEP-LBPRGKRZSA-N	1	0	267.775	4.062	20	30		CIEDRO
C[C@H]([NH2+]Cc1cc(F)ccc1Cl)c1ccc(C#N)cc1	ZINC000098060106	265643080	/nfs/dbraw/zinc/64/30/80/265643080.db2.gz	UBSWXVZNGDNILH-NSHDSACASA-N	1	0	288.753	4.202	20	30		CIEDRO
CC(C)C[N@H+](Cc1ccccc1)Cc1cccc(C#N)c1	ZINC000519904546	265651971	/nfs/dbraw/zinc/65/19/71/265651971.db2.gz	QGNCKLUXTIPFIN-UHFFFAOYSA-N	1	0	278.399	4.216	20	30		CIEDRO
N#Cc1cccc(C2([NH2+]CC3CCCCCC3)CC2)c1	ZINC000514619139	266020831	/nfs/dbraw/zinc/02/08/31/266020831.db2.gz	ARFPQFDWGVXYQF-UHFFFAOYSA-N	1	0	268.404	4.107	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CC[C@H]1CCCCO1)c1ccccc1	ZINC000356931522	266212762	/nfs/dbraw/zinc/21/27/62/266212762.db2.gz	WWXLJBWRUYIHDC-QZTJIDSGSA-N	1	0	273.420	4.243	20	30		CIEDRO
CCC[N@H+](CCCC#N)[C@H]1C[C@H](OCC)C12CCCCC2	ZINC000357776104	266358564	/nfs/dbraw/zinc/35/85/64/266358564.db2.gz	SJZUDFRAVVACHY-IRXDYDNUSA-N	1	0	292.467	4.130	20	30		CIEDRO
C=CCSCC[NH2+][C@@H]1CCCOc2c(C)cc(C)cc21	ZINC000358019870	266398311	/nfs/dbraw/zinc/39/83/11/266398311.db2.gz	DTNBLLWAHVJKDY-MRXNPFEDSA-N	1	0	291.460	4.026	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCCc2ccccc21)c1ccc(C#N)cc1F	ZINC000358559077	266476846	/nfs/dbraw/zinc/47/68/46/266476846.db2.gz	OMCUKAGHCKQGFV-BFUOFWGJSA-N	1	0	294.373	4.426	20	30		CIEDRO
N#CCCC[N@H+]1CCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000362940565	267064448	/nfs/dbraw/zinc/06/44/48/267064448.db2.gz	GIZHRDBWRPUGRR-CQSZACIVSA-N	1	0	282.309	4.146	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CCC[C@@H]1c1ccc(F)c(F)c1	ZINC000363170252	267078308	/nfs/dbraw/zinc/07/83/08/267078308.db2.gz	FGFYYHISHAGVGK-MRXNPFEDSA-N	1	0	292.373	4.432	20	30		CIEDRO
C[C@@H]1C[C@H](c2cccs2)C[N@@H+]1CCCC(C)(C)C#N	ZINC000363307245	267086924	/nfs/dbraw/zinc/08/69/24/267086924.db2.gz	QIHQPVYJRHAPBE-KGLIPLIRSA-N	1	0	276.449	4.256	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H]1CCC[C@@H]1c1ccc(F)cc1	ZINC000367899080	267125583	/nfs/dbraw/zinc/12/55/83/267125583.db2.gz	GIIVRWGJCAYQLO-SJORKVTESA-N	1	0	288.410	4.381	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1CCC[C@H]1c1ccc(F)cc1	ZINC000367899077	267125896	/nfs/dbraw/zinc/12/58/96/267125896.db2.gz	GIIVRWGJCAYQLO-DLBZAZTESA-N	1	0	288.410	4.381	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H]1CC[C@H](c2ccccc2)C1	ZINC000368595018	267189744	/nfs/dbraw/zinc/18/97/44/267189744.db2.gz	XVUJIRCQRVVTIT-IRXDYDNUSA-N	1	0	270.420	4.242	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1CC[C@H](c2ccccc2)C1	ZINC000368595015	267190007	/nfs/dbraw/zinc/19/00/07/267190007.db2.gz	XVUJIRCQRVVTIT-DLBZAZTESA-N	1	0	270.420	4.242	20	30		CIEDRO
C[C@@H]([NH2+]CCCCC#N)c1ccc(-c2ccncc2)cc1	ZINC000118965972	267281492	/nfs/dbraw/zinc/28/14/92/267281492.db2.gz	RJHPDIBLLWAECB-OAHLLOKOSA-N	1	0	279.387	4.093	20	30		CIEDRO
C=C[C@H](C)[NH2+][C@@H]1CCSc2ccc(Cl)cc21	ZINC000119333752	267322921	/nfs/dbraw/zinc/32/29/21/267322921.db2.gz	QTCZZFQRGFIHQS-JOYOIKCWSA-N	1	0	253.798	4.041	20	30		CIEDRO
CC[C@@H](CC#N)[NH2+][C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1	ZINC000370490396	267323100	/nfs/dbraw/zinc/32/31/00/267323100.db2.gz	HGPPBACTEVBMRG-NOOOWODRSA-N	1	0	282.840	4.175	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1nc(-c2ccc(C#N)cc2)cs1)C1CC1	ZINC000370662766	267336049	/nfs/dbraw/zinc/33/60/49/267336049.db2.gz	OEVKOTJCUCEAEV-NEPJUHHUSA-N	1	0	297.427	4.131	20	30		CIEDRO
C[C@H]([NH2+]CC1(C#N)CCC1)[C@@H]1C[C@H]1c1ccc(Cl)s1	ZINC000418143025	267363444	/nfs/dbraw/zinc/36/34/44/267363444.db2.gz	OCHQTNBWIJUQJA-SDDRHHMPSA-N	1	0	294.851	4.177	20	30		CIEDRO
N#CC1(C[NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)CCC1	ZINC000418143054	267365091	/nfs/dbraw/zinc/36/50/91/267365091.db2.gz	OLGHCECZVOCJEG-KRWDZBQOSA-N	1	0	284.378	4.045	20	30		CIEDRO
N#CC1(C[NH2+]Cc2cccc(-c3ccccc3)c2)CCC1	ZINC000418144940	267366002	/nfs/dbraw/zinc/36/60/02/267366002.db2.gz	VXTMJGUQJBMQOE-UHFFFAOYSA-N	1	0	276.383	4.137	20	30		CIEDRO
C[C@H]1C[C@@H](c2cccs2)C[N@@H+]1CC(C)(C)CCC#N	ZINC000371397689	267399110	/nfs/dbraw/zinc/39/91/10/267399110.db2.gz	BWRMHXSHOHMPFG-UONOGXRCSA-N	1	0	276.449	4.256	20	30		CIEDRO
CC(C)(CCC#N)C[N@@H+]1CCSC[C@H]1c1cccs1	ZINC000374255590	267768038	/nfs/dbraw/zinc/76/80/38/267768038.db2.gz	KIAIEIMQCGRAJK-ZDUSSCGKSA-N	1	0	294.489	4.168	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@H]1C[C@@H](CO)c2ccccc21)c1ccco1	ZINC000375896999	267919720	/nfs/dbraw/zinc/91/97/20/267919720.db2.gz	CFALTPSWBFGABP-WBAXXEDZSA-N	1	0	297.398	4.097	20	30		CIEDRO
CC[C@@H](C[NH2+]Cc1ccc(CC#N)cc1)c1ccccc1	ZINC000570841865	327625800	/nfs/dbraw/zinc/62/58/00/327625800.db2.gz	KSTMXKCGPJMWDF-SFHVURJKSA-N	1	0	278.399	4.036	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCc2ccc(C#N)cc21)c1ccc(F)cc1F	ZINC000570862374	327628375	/nfs/dbraw/zinc/62/83/75/327628375.db2.gz	NFODLCGNSLSAMI-BBATYDOGSA-N	1	0	298.336	4.175	20	30		CIEDRO
C=CC[C@@H](CO)[NH2+][C@H](C)c1cc2c(ccc3ccccc23)o1	ZINC000186711430	327701024	/nfs/dbraw/zinc/70/10/24/327701024.db2.gz	SVHBHMRKZYOSHQ-HIFRSBDPSA-N	1	0	295.382	4.174	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@@H](C)c1sc(C)nc1C	ZINC000182184461	327745199	/nfs/dbraw/zinc/74/51/99/327745199.db2.gz	OCEZYCVCGKBBRB-MNOVXSKESA-N	1	0	252.427	4.155	20	30		CIEDRO
C[C@@H]1C[C@@H]([NH2+]CCCCC#N)C[C@H](c2ccccc2)C1	ZINC000178650138	327795670	/nfs/dbraw/zinc/79/56/70/327795670.db2.gz	OBYNVGFHOGKIQC-CGTJXYLNSA-N	1	0	270.420	4.242	20	30		CIEDRO
CC(C)[C@@H](C[NH2+][C@H](C)c1cccc(C#N)c1)c1cccnc1	ZINC000181868528	327810669	/nfs/dbraw/zinc/81/06/69/327810669.db2.gz	UCQAXBOLTDZHML-DNVCBOLYSA-N	1	0	293.414	4.044	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+]CC#Cc1ccc(C(F)(F)F)cc1	ZINC000537985313	327810886	/nfs/dbraw/zinc/81/08/86/327810886.db2.gz	ZCMQUUFTBZWVHP-UONOGXRCSA-N	1	0	295.348	4.247	20	30		CIEDRO
CC(C)Oc1ccc([C@@H](C)[NH2+][C@H]2CCC[C@H](C#N)C2)cc1	ZINC000185818108	327846360	/nfs/dbraw/zinc/84/63/60/327846360.db2.gz	AEAQAUZHJQHKCW-VYDXJSESSA-N	1	0	286.419	4.207	20	30		CIEDRO
C=C(C)COCC[NH2+][C@H](c1ccccc1)c1ccc(F)cc1	ZINC000388360410	327874005	/nfs/dbraw/zinc/87/40/05/327874005.db2.gz	RVCKKTREVYHDNW-LJQANCHMSA-N	1	0	299.389	4.097	20	30		CIEDRO
C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+][C@@H]1CCC[C@@H](C#N)C1	ZINC000463241735	327911002	/nfs/dbraw/zinc/91/10/02/327911002.db2.gz	HOKXXXBPVQFZEB-UHQDVWGKSA-N	1	0	286.394	4.121	20	30		CIEDRO
C=CCCCCC[NH2+][C@@H](c1ccccc1)[C@H]1CCOC1	ZINC000488129830	327913224	/nfs/dbraw/zinc/91/32/24/327913224.db2.gz	OKOAUZJHYXYLCW-ROUUACIJSA-N	1	0	273.420	4.100	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@H]1CCCO[C@@H]1c1ccc(C)cc1	ZINC000531723966	328023360	/nfs/dbraw/zinc/02/33/60/328023360.db2.gz	AYDIDBSTRPJNOJ-PBWTXFEYSA-N	1	0	287.447	4.405	20	30		CIEDRO
CCc1ccc(C[NH2+][C@H](CCCC#N)c2ccccc2)nc1	ZINC000411758010	328098756	/nfs/dbraw/zinc/09/87/56/328098756.db2.gz	NCVKFDOFQSBOPO-LJQANCHMSA-N	1	0	293.414	4.169	20	30		CIEDRO
CCc1cccc(C[NH2+][C@H](CCC#N)c2ccccc2)c1	ZINC000571611975	328137547	/nfs/dbraw/zinc/13/75/47/328137547.db2.gz	JHDUIPACPFJIHI-LJQANCHMSA-N	1	0	278.399	4.384	20	30		CIEDRO
C=CC[C@@H](Cc1ccccc1)[NH2+][C@@H](C)c1ccco1	ZINC000414306802	328154263	/nfs/dbraw/zinc/15/42/63/328154263.db2.gz	RERRBCVQKOHIKK-HOCLYGCPSA-N	1	0	255.361	4.118	20	30		CIEDRO
Cc1ccccc1[C@H]1CC[N@H+](CCCC(C)(C)C#N)C1	ZINC000266907835	328170479	/nfs/dbraw/zinc/17/04/79/328170479.db2.gz	KGLNESOSTDXWMW-INIZCTEOSA-N	1	0	270.420	4.114	20	30		CIEDRO
CC(C)(C#N)c1ccccc1C[NH2+]C1(c2ccccc2)CC1	ZINC000269011915	328188359	/nfs/dbraw/zinc/18/83/59/328188359.db2.gz	VKFVGRHCFLQOFL-UHFFFAOYSA-N	1	0	290.410	4.267	20	30		CIEDRO
CC(C)(C#N)CCCC[N@H+](Cc1ccc(C#N)cc1)C1CC1	ZINC000277711219	328222033	/nfs/dbraw/zinc/22/20/33/328222033.db2.gz	MRAXEFUSRBLIPE-UHFFFAOYSA-N	1	0	295.430	4.243	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH+]2Cc3ccccc3-c3ccccc3C2)C1	ZINC000278678331	328229364	/nfs/dbraw/zinc/22/93/64/328229364.db2.gz	RLCMOQCYVQBJHB-CRAIPNDOSA-N	1	0	288.394	4.361	20	30		CIEDRO
C[N@H+](CCCCC(C)(C)C#N)Cc1cc(F)c(F)c(F)c1	ZINC000278863822	328231554	/nfs/dbraw/zinc/23/15/54/328231554.db2.gz	SDPSWWZHTULOMT-UHFFFAOYSA-N	1	0	298.352	4.256	20	30		CIEDRO
N#CC1CCC(C[NH2+][C@H]2CCSc3ccccc32)CC1	ZINC000282224649	328241740	/nfs/dbraw/zinc/24/17/40/328241740.db2.gz	IFISGMAFRVVFJM-XUJLQICISA-N	1	0	286.444	4.143	20	30		CIEDRO
CSCc1ccc(C[NH2+][C@@H](C)c2ccc(C#N)cc2)cc1	ZINC000285134678	328247447	/nfs/dbraw/zinc/24/74/47/328247447.db2.gz	OFWGQNBYSNZFHZ-AWEZNQCLSA-N	1	0	296.439	4.272	20	30		CIEDRO
Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+]CCCCC#N	ZINC000289259570	328254453	/nfs/dbraw/zinc/25/44/53/328254453.db2.gz	ODUOEEONUVRZGB-KRWDZBQOSA-N	1	0	281.403	4.137	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H]1CCCc2nc(C)sc21	ZINC000340426660	328276073	/nfs/dbraw/zinc/27/60/73/328276073.db2.gz	HHUDKBRBAHINNN-GFCCVEGCSA-N	1	0	264.438	4.021	20	30		CIEDRO
CC(C)[C@@H](Cc1ccc(F)cc1)[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000296288731	328289989	/nfs/dbraw/zinc/28/99/89/328289989.db2.gz	FJMYQJMYGBGCDD-RYQLBKOJSA-N	1	0	288.410	4.065	20	30		CIEDRO
C[C@H]([NH2+]C/C=C\c1ccccc1)c1ccc(C#N)c(F)c1	ZINC000541846801	328305336	/nfs/dbraw/zinc/30/53/36/328305336.db2.gz	VNPTZCDGEFNYDD-PODYEWJSSA-N	1	0	280.346	4.061	20	30		CIEDRO
Cc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1cccc(C#N)c1	ZINC000048367626	328305827	/nfs/dbraw/zinc/30/58/27/328305827.db2.gz	WFPPSCJCQHDEFI-CQSZACIVSA-N	1	0	290.366	4.464	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+]Cc1ccc2ccccc2n1	ZINC000531955739	328331071	/nfs/dbraw/zinc/33/10/71/328331071.db2.gz	BQUSIDVOOAPXAB-INIZCTEOSA-N	1	0	268.404	4.459	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)cc1F)c1ccc(Cl)s1	ZINC000049129515	328341659	/nfs/dbraw/zinc/34/16/59/328341659.db2.gz	KMQGYTMFJCKLEJ-VIFPVBQESA-N	1	0	294.782	4.263	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@H](C)c1ccc(C)s1	ZINC000049160345	328351195	/nfs/dbraw/zinc/35/11/95/328351195.db2.gz	LLJWKBFLVYPHEE-CQSZACIVSA-N	1	0	287.428	4.472	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@@H](C)c1ccc(C)s1	ZINC000049160350	328351229	/nfs/dbraw/zinc/35/12/29/328351229.db2.gz	LLJWKBFLVYPHEE-AWEZNQCLSA-N	1	0	287.428	4.472	20	30		CIEDRO
CCS[C@@H]1CCCC[N@@H+]([C@H](C)c2ccc(C#N)cc2)C1	ZINC000303694616	328357647	/nfs/dbraw/zinc/35/76/47/328357647.db2.gz	MYFJXTYNBZWUKU-RHSMWYFYSA-N	1	0	288.460	4.227	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H](CC)c2ccccc2)cc1	ZINC000050198478	328391481	/nfs/dbraw/zinc/39/14/81/328391481.db2.gz	HKRLEKVAXZQGTG-IBGZPJMESA-N	1	0	281.399	4.492	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]Cc2ccc(Cl)s2)cc1	ZINC000070211805	328456998	/nfs/dbraw/zinc/45/69/98/328456998.db2.gz	AWCSRMFSPNZQQS-UHFFFAOYSA-N	1	0	293.819	4.256	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H](C)c1cc(C)n(C)n1)c1ccccc1	ZINC000282173243	328507364	/nfs/dbraw/zinc/50/73/64/328507364.db2.gz	MIWCKUZHPVBKDP-RDJZCZTQSA-N	1	0	283.419	4.087	20	30		CIEDRO
CC(C)(C)C[NH+](Cc1ccc(C#N)o1)CC(C)(C)C	ZINC000583962088	326814723	/nfs/dbraw/zinc/81/47/23/326814723.db2.gz	DBVJRZAPNWMISR-UHFFFAOYSA-N	1	0	262.397	4.045	20	30		CIEDRO
C[C@H]([NH2+][C@@H](c1ccccc1)C1CC1)c1cccc(C#N)c1	ZINC000037303869	326844265	/nfs/dbraw/zinc/84/42/65/326844265.db2.gz	HEXMYCZLTLVQSR-LIRRHRJNSA-N	1	0	276.383	4.360	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+]C1CCC(C(=O)OC(C)(C)C)CC1	ZINC000537952725	326879741	/nfs/dbraw/zinc/87/97/41/326879741.db2.gz	QMZPDHNLXCWKTI-PCKAHOCUSA-N	1	0	295.467	4.221	20	30		CIEDRO
N#Cc1ccc(C[NH2+]C[C@@H]2CCC[C@H](C(F)(F)F)C2)cc1	ZINC000530736572	326889024	/nfs/dbraw/zinc/88/90/24/326889024.db2.gz	STGFNUPAGASNGH-CABCVRRESA-N	1	0	296.336	4.017	20	30		CIEDRO
C=CC[NH2+][C@@H]1CCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000556575611	326952492	/nfs/dbraw/zinc/95/24/92/326952492.db2.gz	JZWMGLATFIZWEA-ZIAGYGMSSA-N	1	0	269.310	4.117	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCc1cccc(F)c1)c1ccco1	ZINC000556865383	326975113	/nfs/dbraw/zinc/97/51/13/326975113.db2.gz	LYYHQNCCIUHSIL-INIZCTEOSA-N	1	0	273.351	4.258	20	30		CIEDRO
C=CCC[C@@H]([NH2+][C@@H]1CCCC(F)(F)C1)c1ccco1	ZINC000556886721	326977834	/nfs/dbraw/zinc/97/78/34/326977834.db2.gz	OBYNTAIKRMPZRV-CHWSQXEVSA-N	1	0	269.335	4.454	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@H]1CCO[C@@H](C(C)(C)C)C1)c1ccco1	ZINC000556886379	326978924	/nfs/dbraw/zinc/97/89/24/326978924.db2.gz	STLTUROFRJMDTI-YQQAZPJKSA-N	1	0	291.435	4.470	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H]1CCO[C@H](C(C)(C)C)C1)c1ccco1	ZINC000556886378	326978958	/nfs/dbraw/zinc/97/89/58/326978958.db2.gz	STLTUROFRJMDTI-VYDXJSESSA-N	1	0	291.435	4.470	20	30		CIEDRO
CC(C)[C@H](C[NH2+][C@H]1CC[C@@H](C#N)C1)c1ccc(Cl)cc1	ZINC000556924311	326983527	/nfs/dbraw/zinc/98/35/27/326983527.db2.gz	QUOLXLCOXLMPKJ-COXVUDFISA-N	1	0	290.838	4.361	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@H](C)[C@H](OC)c1ccccc1F	ZINC000539510332	326992255	/nfs/dbraw/zinc/99/22/55/326992255.db2.gz	WRUMAYZARNLFPE-KEYYUXOJSA-N	1	0	279.399	4.236	20	30		CIEDRO
CCC[C@@H](CC)[NH2+][C@H]1CCCc2cc(C#N)ccc21	ZINC000557523871	327011367	/nfs/dbraw/zinc/01/13/67/327011367.db2.gz	SKDQQXCMATYATH-WBVHZDCISA-N	1	0	256.393	4.104	20	30		CIEDRO
C[C@@H]1C[C@H](c2ccccc2)CC[N@@H+]1CCC(C)(C)C#N	ZINC000558108419	327074050	/nfs/dbraw/zinc/07/40/50/327074050.db2.gz	XSQGLRLMBFVLOY-NVXWUHKLSA-N	1	0	270.420	4.194	20	30		CIEDRO
C[N@H+](Cc1ccc(Cl)cc1C#N)C1CCC(F)(F)CC1	ZINC000558175891	327077199	/nfs/dbraw/zinc/07/71/99/327077199.db2.gz	KRRKEYOIIMNZEM-UHFFFAOYSA-N	1	0	298.764	4.221	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1ccc(Oc2cccnc2)cc1	ZINC000558167386	327077344	/nfs/dbraw/zinc/07/73/44/327077344.db2.gz	RKGIYDQHHNRCLQ-HNNXBMFYSA-N	1	0	282.387	4.491	20	30		CIEDRO
C[C@@H](CCc1ccc(F)cc1F)[NH2+]CC(C)(C)CCC#N	ZINC000558237643	327080393	/nfs/dbraw/zinc/08/03/93/327080393.db2.gz	LKEDYFOXDYLWSP-ZDUSSCGKSA-N	1	0	294.389	4.205	20	30		CIEDRO
CC(C)CC[C@@H]([NH2+]CC(C)(C)CCC#N)C1CC1	ZINC000558235822	327080398	/nfs/dbraw/zinc/08/03/98/327080398.db2.gz	PIFUBNTVAJYJOB-OAHLLOKOSA-N	1	0	250.430	4.121	20	30		CIEDRO
C[N@@H+](Cc1ccc(-c2ccccc2C#N)cc1)CC1CCC1	ZINC000558244607	327081222	/nfs/dbraw/zinc/08/12/22/327081222.db2.gz	AMPOWMKSYXEHGZ-UHFFFAOYSA-N	1	0	290.410	4.457	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+]C[C@H]1C[C@@H]1c1ccccc1	ZINC000558271022	327084439	/nfs/dbraw/zinc/08/44/39/327084439.db2.gz	DETAXZJCOBJPHH-RTBURBONSA-N	1	0	293.410	4.145	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+]CCc1nc(C)c(C)s1	ZINC000449198129	327128975	/nfs/dbraw/zinc/12/89/75/327128975.db2.gz	ZYXAWBGTHAESFG-LBPRGKRZSA-N	1	0	266.454	4.027	20	30		CIEDRO
CN(Cc1cccc(Cl)c1Cl)[C@@H]1CC[C@@H](C#N)C1	ZINC000559037364	327138680	/nfs/dbraw/zinc/13/86/80/327138680.db2.gz	QMGMTRMUHUYWAH-ZYHUDNBSSA-N	1	0	283.202	4.117	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CC[C@@H](C#N)C1)c1cc(Cl)ccc1Cl	ZINC000559154886	327143712	/nfs/dbraw/zinc/14/37/12/327143712.db2.gz	IJUWYGBFBJITCX-CKYFFXLPSA-N	1	0	283.202	4.336	20	30		CIEDRO
C=C(C[NH2+][C@H](C)c1sc(C)nc1C)c1ccccc1	ZINC000211830842	327149013	/nfs/dbraw/zinc/14/90/13/327149013.db2.gz	OODBEXVRHSINEY-GFCCVEGCSA-N	1	0	272.417	4.124	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H]1CCC[C@H](CCCC(=O)OC)C1	ZINC000559307297	327157722	/nfs/dbraw/zinc/15/77/22/327157722.db2.gz	PJBJTKNXVLOYJW-CVEARBPZSA-N	1	0	295.467	4.080	20	30		CIEDRO
CC(C)C[C@@H]1CCC[N@H+](CC(C)(C)CCC#N)C1	ZINC000093716581	327199334	/nfs/dbraw/zinc/19/93/34/327199334.db2.gz	YFGCCCXRTSMTQI-HNNXBMFYSA-N	1	0	250.430	4.074	20	30		CIEDRO
C[C@H](CCc1cccc(F)c1)[NH2+]Cc1ccc(CC#N)cc1	ZINC000566218975	327199417	/nfs/dbraw/zinc/19/94/17/327199417.db2.gz	BLFCRYKDYFSKIT-OAHLLOKOSA-N	1	0	296.389	4.003	20	30		CIEDRO
CCC[C@H](C)[C@@H]1CCC[N@@H+]1CC(C)(C)CCC#N	ZINC000093845279	327200490	/nfs/dbraw/zinc/20/04/90/327200490.db2.gz	SYRXKXUETPYXSH-GJZGRUSLSA-N	1	0	250.430	4.217	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](CC)c1ccccc1OC(F)F	ZINC000358051358	327213095	/nfs/dbraw/zinc/21/30/95/327213095.db2.gz	VNUXRYHDIBLASI-AAEUAGOBSA-N	1	0	269.335	4.293	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1cccc(OCC(F)F)c1)C1CC1	ZINC000537974261	327254532	/nfs/dbraw/zinc/25/45/32/327254532.db2.gz	UDFAYDOPSGPXMU-MRXNPFEDSA-N	1	0	295.373	4.165	20	30		CIEDRO
CCC[C@H]1CCCC[C@H]1[NH2+]C1CCC(C)(C#N)CC1	ZINC000577458835	327260855	/nfs/dbraw/zinc/26/08/55/327260855.db2.gz	AZHQQEJGAARZGX-ORBLRFAASA-N	1	0	262.441	4.407	20	30		CIEDRO
CC(C)[C@@H]1CC[C@H]1[NH2+][C@H](CCCC#N)c1ccccc1	ZINC000559862228	327265762	/nfs/dbraw/zinc/26/57/62/327265762.db2.gz	BXBNMDDANZYKLA-RCCFBDPRSA-N	1	0	270.420	4.446	20	30		CIEDRO
N#CCC1CC[NH+](CCCc2c(F)cccc2Cl)CC1	ZINC000559947932	327273427	/nfs/dbraw/zinc/27/34/27/327273427.db2.gz	CTQNJJGIEXMTBD-UHFFFAOYSA-N	1	0	294.801	4.037	20	30		CIEDRO
C=CC[C@@H](C)[C@@H](C)[NH2+]Cc1ccc(NCCC)cc1	ZINC000560002498	327276870	/nfs/dbraw/zinc/27/68/70/327276870.db2.gz	LLQOYBGMFHZSLP-HUUCEWRRSA-N	1	0	260.425	4.199	20	30		CIEDRO
CC1(C#N)CCC([NH2+]Cc2cc3c(s2)CCCC3)CC1	ZINC000560126902	327285515	/nfs/dbraw/zinc/28/55/15/327285515.db2.gz	RLNMNFGKKWIKQU-UHFFFAOYSA-N	1	0	288.460	4.189	20	30		CIEDRO
N#Cc1cccc(C2([NH2+]CCc3ccccc3Cl)CC2)c1	ZINC000560174744	327288063	/nfs/dbraw/zinc/28/80/63/327288063.db2.gz	NTLMFOQMUXWRRB-UHFFFAOYSA-N	1	0	296.801	4.033	20	30		CIEDRO
Cc1ccccc1[C@@H](C)[N@H+](CC(C)C)CC1(C#N)CC1	ZINC000560178739	327288776	/nfs/dbraw/zinc/28/87/76/327288776.db2.gz	UXGVCQNEVXXEAK-MRXNPFEDSA-N	1	0	270.420	4.318	20	30		CIEDRO
CCCC[C@H](CC)[NH2+]C1(c2cccc(C#N)c2)CC1	ZINC000560265400	327295358	/nfs/dbraw/zinc/29/53/58/327295358.db2.gz	MTYXRPHSQCURFX-INIZCTEOSA-N	1	0	256.393	4.106	20	30		CIEDRO
CCCC[C@@H](CC)[NH2+]C1(c2cccc(C#N)c2)CC1	ZINC000560265402	327295409	/nfs/dbraw/zinc/29/54/09/327295409.db2.gz	MTYXRPHSQCURFX-MRXNPFEDSA-N	1	0	256.393	4.106	20	30		CIEDRO
C[C@@H](CCc1ccccc1)[NH2+][C@@H]1CCc2ccc(C#N)cc21	ZINC000583351730	327315441	/nfs/dbraw/zinc/31/54/41/327315441.db2.gz	NAZGWVUBOAKRPX-MGPUTAFESA-N	1	0	290.410	4.156	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCc1ncc(CC)s1)c1ccco1	ZINC000560530829	327319831	/nfs/dbraw/zinc/31/98/31/327319831.db2.gz	SSXAYWQJZRUAEO-AWEZNQCLSA-N	1	0	290.432	4.138	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCC1CCC(OC)CC1)c1ccco1	ZINC000560548585	327323300	/nfs/dbraw/zinc/32/33/00/327323300.db2.gz	IZNBSMSDLFIWAA-OFLPRAFFSA-N	1	0	291.435	4.472	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+]Cc1cn2cc(Cl)ccc2n1	ZINC000560923961	327352494	/nfs/dbraw/zinc/35/24/94/327352494.db2.gz	DHFRJTPTKZDJAN-CYBMUJFWSA-N	1	0	291.826	4.212	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+]Cc1cccc2cc[nH]c21	ZINC000560924358	327352530	/nfs/dbraw/zinc/35/25/30/327352530.db2.gz	JFJWKHVCYJHAED-AWEZNQCLSA-N	1	0	256.393	4.392	20	30		CIEDRO
N#Cc1ccc2c(c1)CCC[C@H]2[NH2+]Cc1cccc(F)c1F	ZINC000561199087	327374545	/nfs/dbraw/zinc/37/45/45/327374545.db2.gz	LTCQVLMWCXBQRD-QGZVFWFLSA-N	1	0	298.336	4.004	20	30		CIEDRO
CC(C)(C[NH2+][C@@H]1CCc2ccc(C#N)cc21)c1cccs1	ZINC000566532817	327404201	/nfs/dbraw/zinc/40/42/01/327404201.db2.gz	ZHULCKRSDNIIJJ-MRXNPFEDSA-N	1	0	296.439	4.174	20	30		CIEDRO
CC[C@@H]1CC[C@H](C)C[C@H]1[NH2+]CC(C)(C)CCC#N	ZINC000562046226	327442228	/nfs/dbraw/zinc/44/22/28/327442228.db2.gz	CJRVVLYUDUICKO-RRFJBIMHSA-N	1	0	250.430	4.121	20	30		CIEDRO
CC[C@@H]1CC[C@@H](C)C[C@@H]1[NH2+]CC(C)(C)CCC#N	ZINC000562046218	327442241	/nfs/dbraw/zinc/44/22/41/327442241.db2.gz	CJRVVLYUDUICKO-KFWWJZLASA-N	1	0	250.430	4.121	20	30		CIEDRO
CC1(C)CCC[C@@H](C[NH2+]CC2CCC(C#N)CC2)C1	ZINC000562457044	327482717	/nfs/dbraw/zinc/48/27/17/327482717.db2.gz	YVOQMWNJRLGOCL-UYSNPLJNSA-N	1	0	262.441	4.122	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](C[C@@H]1CCOC1)c1ccccc1	ZINC000562505709	327486890	/nfs/dbraw/zinc/48/68/90/327486890.db2.gz	GSXFZUGTTSEFFB-LNLFQRSKSA-N	1	0	287.447	4.489	20	30		CIEDRO
C[C@@H]([NH2+]CC(C1CC1)C1CC1)c1ccc(C#N)cc1Cl	ZINC000570387080	327587852	/nfs/dbraw/zinc/58/78/52/327587852.db2.gz	VZMNNOUILWZTHB-LLVKDONJSA-N	1	0	288.822	4.298	20	30		CIEDRO
N#CCc1ccc(C[NH2+][C@H]2CCc3cc(Cl)ccc32)cc1	ZINC000570450992	327592662	/nfs/dbraw/zinc/59/26/62/327592662.db2.gz	YIZHIHHTXGNBSU-SFHVURJKSA-N	1	0	296.801	4.183	20	30		CIEDRO
CC[C@H]([NH2+][C@H](C)c1ccc(C#N)cc1)c1cccs1	ZINC000036991793	328631670	/nfs/dbraw/zinc/63/16/70/328631670.db2.gz	YSDNOXPSYCXCNJ-DOMZBBRYSA-N	1	0	270.401	4.422	20	30		CIEDRO
N#CCc1ccc(C[NH2+][C@H]2CCCCC23CCCC3)cc1	ZINC000398952901	328653809	/nfs/dbraw/zinc/65/38/09/328653809.db2.gz	ACDHNVPEBSJMIW-SFHVURJKSA-N	1	0	282.431	4.345	20	30		CIEDRO
CC(C)(C)CC[NH2+]C1CCC(C#N)(c2ccccc2)CC1	ZINC000507621978	332817110	/nfs/dbraw/zinc/81/71/10/332817110.db2.gz	QEMVLGCIWNYSIV-UHFFFAOYSA-N	1	0	284.447	4.416	20	30		CIEDRO
CCC[C@H](C[NH+]1CCC(C)(C#N)CC1)c1ccccc1	ZINC000507700287	332819582	/nfs/dbraw/zinc/81/95/82/332819582.db2.gz	WEXVHLKEPMYJOL-QGZVFWFLSA-N	1	0	270.420	4.196	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(Cl)c(F)c1)c1ccc(C#N)cc1	ZINC000043389322	328789134	/nfs/dbraw/zinc/78/91/34/328789134.db2.gz	ZVYOBWIQODXKBB-NSHDSACASA-N	1	0	288.753	4.202	20	30		CIEDRO
N#Cc1ccc2c(c1)CCCC[C@H]2[NH2+][C@@H]1CC=CCC1	ZINC000360658423	328909700	/nfs/dbraw/zinc/90/97/00/328909700.db2.gz	SKBFPHMCADIUTJ-SJLPKXTDSA-N	1	0	266.388	4.024	20	30		CIEDRO
N#CCCCC[N@H+]1CCCC[C@H]1c1ccc(F)cc1F	ZINC000378192972	329042754	/nfs/dbraw/zinc/04/27/54/329042754.db2.gz	QHOLSGUPPLIGKW-INIZCTEOSA-N	1	0	278.346	4.186	20	30		CIEDRO
N#CCCCC[NH2+]C1CC(c2ccc(C(F)(F)F)cc2)C1	ZINC000378628222	329056853	/nfs/dbraw/zinc/05/68/53/329056853.db2.gz	XFOWZOLUDJBIAI-UHFFFAOYSA-N	1	0	296.336	4.235	20	30		CIEDRO
Cc1ccc([C@H](C)[NH2+]Cc2ccc(OCC#N)cc2)c(C)c1	ZINC000193900535	329062574	/nfs/dbraw/zinc/06/25/74/329062574.db2.gz	QBMYQDSTDHWLAE-INIZCTEOSA-N	1	0	294.398	4.057	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@H]1CCCc2c3ccccc3[nH]c21	ZINC000393815401	329089698	/nfs/dbraw/zinc/08/96/98/329089698.db2.gz	WQVRHXQOGQKIDO-DYVFJYSZSA-N	1	0	268.404	4.490	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C#N)cc1F)[C@H]1CC2CCC1CC2	ZINC000394518543	329124875	/nfs/dbraw/zinc/12/48/75/329124875.db2.gz	SFUDAXWOBRZFMO-ZHOLYQSMSA-N	1	0	286.394	4.002	20	30		CIEDRO
C=CCCCCCN(C)Cc1csc([C@@H](C)OC)n1	ZINC000175256482	329166359	/nfs/dbraw/zinc/16/63/59/329166359.db2.gz	DEFKDCMGKIJSLQ-CYBMUJFWSA-N	1	0	282.453	4.029	20	30		CIEDRO
C=C(Cl)COc1ccc([C@@H](C)[NH2+]Cc2ccoc2)cc1	ZINC000178476919	329199508	/nfs/dbraw/zinc/19/95/08/329199508.db2.gz	NIVNGSTYCWCFJL-CYBMUJFWSA-N	1	0	291.778	4.262	20	30		CIEDRO
Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C#N)cc1F)CCC2	ZINC000178958071	329203267	/nfs/dbraw/zinc/20/32/67/329203267.db2.gz	SBOPRIINUVFGMT-LJQANCHMSA-N	1	0	294.373	4.173	20	30		CIEDRO
Cc1ccc2c(c1)[C@H]([NH2+]Cc1cc(C#N)cs1)CCC2	ZINC000179361720	329204767	/nfs/dbraw/zinc/20/47/67/329204767.db2.gz	GZBZRFMPJIAPIS-QGZVFWFLSA-N	1	0	282.412	4.095	20	30		CIEDRO
CC[C@@H](c1ccccc1)[N@H+](CC)CCC(C)(C)C#N	ZINC000582837074	329276207	/nfs/dbraw/zinc/27/62/07/329276207.db2.gz	FRUBEASGUIRORQ-INIZCTEOSA-N	1	0	258.409	4.399	20	30		CIEDRO
Cc1cc(C[N@@H+]2CCc3sccc3[C@@H]2C)ccc1C#N	ZINC000584378274	329307089	/nfs/dbraw/zinc/30/70/89/329307089.db2.gz	DJKNRIXPQQSOCE-ZDUSSCGKSA-N	1	0	282.412	4.048	20	30		CIEDRO
C[C@@H]([NH2+]CC(C)(C)CC#N)[C@@H](C)c1ccc(Cl)cc1	ZINC000459737142	329374581	/nfs/dbraw/zinc/37/45/81/329374581.db2.gz	VUWGRLDZZKEZTD-CHWSQXEVSA-N	1	0	278.827	4.361	20	30		CIEDRO
C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]CC(C)(C)CC#N	ZINC000459739892	329377366	/nfs/dbraw/zinc/37/73/66/329377366.db2.gz	ZOZADCAKZVYMLU-LBPRGKRZSA-N	1	0	298.352	4.166	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H](C)c1ccc2c(c1)OCCCO2	ZINC000398105876	329433140	/nfs/dbraw/zinc/43/31/40/329433140.db2.gz	KGIFDLIGTFRAOR-HUUCEWRRSA-N	1	0	289.419	4.243	20	30		CIEDRO
N#CCCC1CC[NH+](CCCCc2ccccc2)CC1	ZINC000399450360	329445513	/nfs/dbraw/zinc/44/55/13/329445513.db2.gz	HZULXBSNAFVSMP-UHFFFAOYSA-N	1	0	270.420	4.025	20	30		CIEDRO
N#CCCC1CC[NH+](Cc2cccc(C(F)(F)F)c2)CC1	ZINC000399324094	329450996	/nfs/dbraw/zinc/45/09/96/329450996.db2.gz	JIOJETHYHSXQKG-UHFFFAOYSA-N	1	0	296.336	4.221	20	30		CIEDRO
C[C@@]1(c2ccccc2)CC[C@@H]([NH+]2CCC(CC#N)CC2)C1	ZINC000527105474	329695773	/nfs/dbraw/zinc/69/57/73/329695773.db2.gz	SADSOJLUYHRBOY-RTBURBONSA-N	1	0	282.431	4.122	20	30		CIEDRO
CC[C@H]([NH2+]CCCCC(C)(C)C#N)[C@@H]1CC1(C)C	ZINC000419314837	329716172	/nfs/dbraw/zinc/71/61/72/329716172.db2.gz	NMMVWLYBAMPXNF-KBPBESRZSA-N	1	0	250.430	4.121	20	30		CIEDRO
C[C@@H]([NH2+]CCC(C)(C)C#N)c1ccc(C2CC2)cc1	ZINC000419342719	329718500	/nfs/dbraw/zinc/71/85/00/329718500.db2.gz	PZXMPJCCCIDUHM-CYBMUJFWSA-N	1	0	256.393	4.154	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(F)c(C#N)c1)c1ccc(C2CC2)cc1	ZINC000419361157	329720031	/nfs/dbraw/zinc/72/00/31/329720031.db2.gz	STFZONRYDUNYKA-CYBMUJFWSA-N	1	0	294.373	4.426	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+][C@H](CC(F)F)c2ccccc2)C1	ZINC000421372820	329815987	/nfs/dbraw/zinc/81/59/87/329815987.db2.gz	MVSDPNYAGAVSET-BPLDGKMQSA-N	1	0	278.346	4.055	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)c1ccc(C)cc1	ZINC000248733717	329898200	/nfs/dbraw/zinc/89/82/00/329898200.db2.gz	DKQZHGRZHJAYRQ-OIISXLGYSA-N	1	0	256.393	4.118	20	30		CIEDRO
C#CC[C@@H]([NH2+]Cc1cnc(CC(C)C)s1)c1ccccc1	ZINC000270237966	330073952	/nfs/dbraw/zinc/07/39/52/330073952.db2.gz	RQJYPWFNRNAHBA-QGZVFWFLSA-N	1	0	298.455	4.196	20	30		CIEDRO
C#CC[C@H]([NH2+][C@@H](C)c1sc(C)nc1C)c1ccccc1	ZINC000271496125	330079890	/nfs/dbraw/zinc/07/98/90/330079890.db2.gz	LMHABJWNPIOMSP-BBRMVZONSA-N	1	0	284.428	4.175	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@H](C)c1sc(CC)nc1C)c1ccccc1	ZINC000271426808	330079895	/nfs/dbraw/zinc/07/98/95/330079895.db2.gz	CQLMEPCJBYTQFY-CZUORRHYSA-N	1	0	298.455	4.429	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)CCO2)c1ccccc1	ZINC000271573563	330081116	/nfs/dbraw/zinc/08/11/16/330081116.db2.gz	VZKAZWBRPIXFRN-HNAYVOBHSA-N	1	0	291.394	4.037	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1ccncc1Cl)c1ccc(C#N)cc1	ZINC000421824993	330083494	/nfs/dbraw/zinc/08/34/94/330083494.db2.gz	LGVKKGRBSGLMJE-NEPJUHHUSA-N	1	0	285.778	4.018	20	30		CIEDRO
CCc1ccc([C@H](CC)[NH2+]Cc2ccc(C#N)s2)cc1	ZINC000421868704	330099760	/nfs/dbraw/zinc/09/97/60/330099760.db2.gz	DCXHYDXICINRDC-KRWDZBQOSA-N	1	0	284.428	4.423	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccc(F)nc1C)c1ccccc1	ZINC000278535969	330117261	/nfs/dbraw/zinc/11/72/61/330117261.db2.gz	SLZDKZDCUQHZDH-QGZVFWFLSA-N	1	0	284.378	4.326	20	30		CIEDRO
Cc1ccc(-c2ccc(C[NH2+]CC3(C#N)CC3)s2)cc1	ZINC000514704991	330146586	/nfs/dbraw/zinc/14/65/86/330146586.db2.gz	ARMSQMOJRICCJU-UHFFFAOYSA-N	1	0	282.412	4.117	20	30		CIEDRO
CSc1ccc([C@H](C)[NH2+]Cc2cccc(C#N)c2)cc1	ZINC000035256457	330244599	/nfs/dbraw/zinc/24/45/99/330244599.db2.gz	UTGZPOAJHIJMQZ-ZDUSSCGKSA-N	1	0	282.412	4.131	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)c1cccc(OC(F)(F)F)c1	ZINC000536855853	330252109	/nfs/dbraw/zinc/25/21/09/330252109.db2.gz	CGWXNKNIFYBABB-WDEREUQCSA-N	1	0	273.298	4.200	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](C)c1ccc(OCCCC)c(OC)c1	ZINC000536858844	330252607	/nfs/dbraw/zinc/25/26/07/330252607.db2.gz	RTHJADCQGBNBAH-CABCVRRESA-N	1	0	291.435	4.489	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@H](c3ccccc3)CC2)C1	ZINC000527721424	330277286	/nfs/dbraw/zinc/27/72/86/330277286.db2.gz	NVVAAAWEOSQVIC-LULLPPNCSA-N	1	0	282.431	4.385	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1cc(C#N)cs1)c1cc(C)ccc1C	ZINC000527819518	330286272	/nfs/dbraw/zinc/28/62/72/330286272.db2.gz	JDHOIOMAYKDIHC-QGZVFWFLSA-N	1	0	284.428	4.478	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(C#N)s1)c1cc(C)ccc1C	ZINC000527821401	330286328	/nfs/dbraw/zinc/28/63/28/330286328.db2.gz	NUUKHOHBQASZCE-KRWDZBQOSA-N	1	0	284.428	4.478	20	30		CIEDRO
CC[C@H](CCc1ccccc1)[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000527905573	330289862	/nfs/dbraw/zinc/28/98/62/330289862.db2.gz	VAKVSSMGTYYGSW-KSZLIROESA-N	1	0	270.420	4.070	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](c1ccccn1)C1CCC1)c1cccc(C#N)c1	ZINC000527971281	330301570	/nfs/dbraw/zinc/30/15/70/330301570.db2.gz	ZNNSRIARKIPFID-AUUYWEPGSA-N	1	0	291.398	4.145	20	30		CIEDRO
CC[C@@H](C)[C@H](C)[NH2+]CC#Cc1ccc(C(F)(F)F)cc1	ZINC000536875907	330309778	/nfs/dbraw/zinc/30/97/78/330309778.db2.gz	JZSFRJFNMCFMHF-OLZOCXBDSA-N	1	0	283.337	4.081	20	30		CIEDRO
CC[C@@H](C)[C@@H](C)[NH2+]CC#Cc1ccc(C(F)(F)F)cc1	ZINC000536875892	330309806	/nfs/dbraw/zinc/30/98/06/330309806.db2.gz	JZSFRJFNMCFMHF-CHWSQXEVSA-N	1	0	283.337	4.081	20	30		CIEDRO
C[C@H]([NH2+][C@@H](C)c1cc(F)ccc1F)c1ccc(C#N)cc1	ZINC000036921943	330313863	/nfs/dbraw/zinc/31/38/63/330313863.db2.gz	CJYHVYUMRZSTJO-RYUDHWBXSA-N	1	0	286.325	4.248	20	30		CIEDRO
C[C@H](Cc1ccc(Cl)cc1)[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000036937849	330315164	/nfs/dbraw/zinc/31/51/64/330315164.db2.gz	OYPYQDHHNBXHPC-ZIAGYGMSSA-N	1	0	298.817	4.493	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+]Cc2cccc(Oc3ccccc3)c2)C1	ZINC000424187236	330320078	/nfs/dbraw/zinc/32/00/78/330320078.db2.gz	AONZVAWWOSPBEK-WBVHZDCISA-N	1	0	292.382	4.261	20	30		CIEDRO
C/C(=C\c1ccc(Cl)cc1)C[NH2+][C@@H]1CC[C@H](C#N)C1	ZINC000424187304	330320997	/nfs/dbraw/zinc/32/09/97/330320997.db2.gz	ASKKVYFZXLQYOP-IIUKIDADSA-N	1	0	274.795	4.025	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+]Cc2cccc(-c3ccccc3)c2)C1	ZINC000424200044	330326592	/nfs/dbraw/zinc/32/65/92/330326592.db2.gz	QTCFNZSHWHGKLK-BEFAXECRSA-N	1	0	276.383	4.135	20	30		CIEDRO
C[C@H](c1ccc(Cl)cc1)[N@H+](C)Cc1cccc(C#N)c1	ZINC000044894264	330333804	/nfs/dbraw/zinc/33/38/04/330333804.db2.gz	BARSNJPJMKQZLO-CYBMUJFWSA-N	1	0	284.790	4.405	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@H](C)c1cc2ccccc2s1	ZINC000424291495	330334868	/nfs/dbraw/zinc/33/48/68/330334868.db2.gz	DMZLUIGERHDERV-SNPRPXQTSA-N	1	0	287.428	4.143	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@H]1C[C@@H](C(C)C)c2ccccc21	ZINC000424297375	330336340	/nfs/dbraw/zinc/33/63/40/330336340.db2.gz	QPUDDJXBZHTRBS-QZHFEQFPSA-N	1	0	285.431	4.052	20	30		CIEDRO
C=CCC[C@@H]([NH2+][C@H]1C[C@@H]2C[C@H](OC)C[C@@H]2C1)c1ccccc1	ZINC000424303992	330338175	/nfs/dbraw/zinc/33/81/75/330338175.db2.gz	QEHCTDFZOIBHHX-JAZQRGJZSA-N	1	0	299.458	4.487	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1	ZINC000424316758	330339652	/nfs/dbraw/zinc/33/96/52/330339652.db2.gz	BINRHJOXXXLDEX-IEECTRCBSA-N	1	0	294.851	4.175	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@H]2CC[C@H](c3cccc(Cl)c3)C2)C1	ZINC000424318694	330339884	/nfs/dbraw/zinc/33/98/84/330339884.db2.gz	DGDINUOTAUQAEN-SDNTUTLCSA-N	1	0	288.822	4.258	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@H]2CCC[C@@H]2c2ccc(Cl)cc2)C1	ZINC000424321194	330340239	/nfs/dbraw/zinc/34/02/39/330340239.db2.gz	HBFBVZVVPAIFJI-DXEWXGHRSA-N	1	0	288.822	4.258	20	30		CIEDRO
Cc1cc2cc([C@@H](C)[NH2+][C@@H]3CC[C@H](C#N)C3)oc2cc1C	ZINC000424321154	330340241	/nfs/dbraw/zinc/34/02/41/330340241.db2.gz	GTNOYULXMRSKTJ-IJEWVQPXSA-N	1	0	282.387	4.393	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)[C@H](C)c1nc2ccccc2s1	ZINC000424322717	330340434	/nfs/dbraw/zinc/34/04/34/330340434.db2.gz	ILSXDDVNSRSKQK-XDQVBPFNSA-N	1	0	299.443	4.070	20	30		CIEDRO
CC1(C)CC[C@@H]([NH2+][C@@H]2CC[C@H](C#N)C2)c2ccccc21	ZINC000424324470	330341078	/nfs/dbraw/zinc/34/10/78/330341078.db2.gz	KAUYAACJDUXGDA-JJRVBVJISA-N	1	0	268.404	4.081	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1csc(-c2ccccc2)n1	ZINC000424324933	330341170	/nfs/dbraw/zinc/34/11/70/330341170.db2.gz	KKYGSYSBCMPYQL-VNHYZAJKSA-N	1	0	297.427	4.153	20	30		CIEDRO
CC(C)[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc(Cl)cc1	ZINC000424329132	330341856	/nfs/dbraw/zinc/34/18/56/330341856.db2.gz	PDFHJVSRUXCEDO-APHBMKBZSA-N	1	0	276.811	4.319	20	30		CIEDRO
CC(C)COc1ccc([C@H](C)[NH2+][C@@H]2CC[C@H](C#N)C2)cc1	ZINC000424329206	330341944	/nfs/dbraw/zinc/34/19/44/330341944.db2.gz	PKTNSWHHYHERHN-YQQAZPJKSA-N	1	0	286.419	4.064	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc(OC(C)(C)C)cc1	ZINC000424330809	330342312	/nfs/dbraw/zinc/34/23/12/330342312.db2.gz	REIKIJGDAASYSZ-OFQRWUPVSA-N	1	0	286.419	4.207	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1cc(Cl)cc(Cl)c1	ZINC000424330864	330342363	/nfs/dbraw/zinc/34/23/63/330342363.db2.gz	RHZOBMQIWIDNJM-ISTVAULSSA-N	1	0	283.202	4.336	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@H]2CCC[C@@H]2c2ccccc2Cl)C1	ZINC000424335021	330343288	/nfs/dbraw/zinc/34/32/88/330343288.db2.gz	WGQMVYDHSKVYMF-SHFYGJNESA-N	1	0	288.822	4.258	20	30		CIEDRO
Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+][C@@H]1CC[C@H](C#N)C1	ZINC000424337125	330343534	/nfs/dbraw/zinc/34/35/34/330343534.db2.gz	YXSOOBSFYCVPQD-KGYLQXTDSA-N	1	0	291.464	4.092	20	30		CIEDRO
CCOc1cccc2cc([C@H](C)[NH2+][C@@H]3CC[C@H](C#N)C3)oc21	ZINC000424336811	330343592	/nfs/dbraw/zinc/34/35/92/330343592.db2.gz	YRFSBNUJQSFFRX-KCQAQPDRSA-N	1	0	298.386	4.174	20	30		CIEDRO
CC[NH+](CC)Cc1ccc(-c2ccccc2C#N)cc1	ZINC000533233910	330354075	/nfs/dbraw/zinc/35/40/75/330354075.db2.gz	HJEUDQKNXMXGBY-UHFFFAOYSA-N	1	0	264.372	4.067	20	30		CIEDRO
CC(C)C1(C[NH2+]C2CCC(C#N)(c3ccccc3)CC2)CC1	ZINC000536908160	330364710	/nfs/dbraw/zinc/36/47/10/330364710.db2.gz	FUANCSQKKGDTKR-UHFFFAOYSA-N	1	0	296.458	4.416	20	30		CIEDRO
C=CCCC[N@@H+](C)[C@H](C)c1nc2ccccc2s1	ZINC000117871296	330366173	/nfs/dbraw/zinc/36/61/73/330366173.db2.gz	SXLLTXSOVPFVQX-GFCCVEGCSA-N	1	0	260.406	4.255	20	30		CIEDRO
CC(C)c1ccc(CC[NH2+]Cc2cccc(C#N)c2)cc1	ZINC000057597193	330376849	/nfs/dbraw/zinc/37/68/49/330376849.db2.gz	DVIZXPUPIIYRIW-UHFFFAOYSA-N	1	0	278.399	4.014	20	30		CIEDRO
C=C(C)C[NH2+]Cc1ccc(-c2ccccc2OC)cc1	ZINC000119638402	330378084	/nfs/dbraw/zinc/37/80/84/330378084.db2.gz	SEYIXJIDWUAISN-UHFFFAOYSA-N	1	0	267.372	4.028	20	30		CIEDRO
Cc1ccc(C[N@H+](Cc2ccc(C#N)s2)C(C)C)s1	ZINC000119916081	330380213	/nfs/dbraw/zinc/38/02/13/330380213.db2.gz	MGABESJLFALRRK-UHFFFAOYSA-N	1	0	290.457	4.400	20	30		CIEDRO
C=CCC[C@H]([NH2+]CC1(c2ccccc2)CCOCC1)C1CC1	ZINC000120131605	330384647	/nfs/dbraw/zinc/38/46/47/330384647.db2.gz	QMHVTZBQTIZCQP-IBGZPJMESA-N	1	0	299.458	4.069	20	30		CIEDRO
COc1ccc([C@H]2CCCCC[N@@H+]2CCCCC#N)cc1	ZINC000120072204	330385475	/nfs/dbraw/zinc/38/54/75/330385475.db2.gz	OKAXVIOSHFBGOB-GOSISDBHSA-N	1	0	286.419	4.306	20	30		CIEDRO
C[N@H+](Cc1csc2ccccc12)Cc1cccc(C#N)c1	ZINC000058582155	330389536	/nfs/dbraw/zinc/38/95/36/330389536.db2.gz	ZATUIWSHAFAVJQ-UHFFFAOYSA-N	1	0	292.407	4.405	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1cc(C#N)ccc1F)c1ccccc1	ZINC000090117781	330390664	/nfs/dbraw/zinc/39/06/64/330390664.db2.gz	DBDGSHXWLGYNGL-IBGZPJMESA-N	1	0	294.373	4.494	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCc1csc(C(C)C)n1)C1CC1	ZINC000120856111	330393048	/nfs/dbraw/zinc/39/30/48/330393048.db2.gz	UEPTUTAQIUKWSR-OAHLLOKOSA-N	1	0	278.465	4.143	20	30		CIEDRO
C=CCCC[C@H](C)[NH+]1CCC(OCCC(C)C)CC1	ZINC000537039544	330393666	/nfs/dbraw/zinc/39/36/66/330393666.db2.gz	YXVBGYWFTMKGMR-INIZCTEOSA-N	1	0	267.457	4.258	20	30		CIEDRO
CC[N@H+](CCc1cccs1)[C@H](C)c1ccc(C#N)cc1	ZINC000120957113	330393708	/nfs/dbraw/zinc/39/37/08/330393708.db2.gz	JXWGEWASQBRBDY-CQSZACIVSA-N	1	0	284.428	4.245	20	30		CIEDRO
CC[C@H]1CCCC[C@H]1[N@H+](C)CCCC(C)(C)C#N	ZINC000120901842	330393999	/nfs/dbraw/zinc/39/39/99/330393999.db2.gz	WHFLGPZHMOCYRN-LSDHHAIUSA-N	1	0	250.430	4.217	20	30		CIEDRO
C[C@H]1[C@H](c2ccccc2)CC[N@@H+]1Cc1cccc(C#N)c1F	ZINC000537047871	330394538	/nfs/dbraw/zinc/39/45/38/330394538.db2.gz	UIYRHIOMQVQIME-KBXCAEBGSA-N	1	0	294.373	4.075	20	30		CIEDRO
C[C@@H]([NH2+][C@H](CCC#N)c1ccccc1)c1ccccc1	ZINC000090665184	330394587	/nfs/dbraw/zinc/39/45/87/330394587.db2.gz	KUQRXSULWZNTBY-CRAIPNDOSA-N	1	0	264.372	4.382	20	30		CIEDRO
C[C@@H]1C[C@H](c2ccccc2)C[N@@H+]1Cc1cccc(C#N)c1F	ZINC000537048288	330394646	/nfs/dbraw/zinc/39/46/46/330394646.db2.gz	YEXJQZBVYNRSHQ-KDOFPFPSSA-N	1	0	294.373	4.075	20	30		CIEDRO
C[C@@H]1CCCC[C@@H]1[NH2+][C@@H](CCC#N)c1ccccc1	ZINC000090665911	330394711	/nfs/dbraw/zinc/39/47/11/330394711.db2.gz	DMBXGNYQGBLAPT-PVAVHDDUSA-N	1	0	256.393	4.200	20	30		CIEDRO
C=CCCC[N@@H+](C)[C@H](C)c1nnc(-c2ccc(C)cc2)o1	ZINC000121146203	330395582	/nfs/dbraw/zinc/39/55/82/330395582.db2.gz	YHFASALYYGLCIB-CQSZACIVSA-N	1	0	285.391	4.004	20	30		CIEDRO
C=CCCC[N@@H+](C)[C@H](C)c1nc2ccccc2n1C(F)F	ZINC000121108995	330396206	/nfs/dbraw/zinc/39/62/06/330396206.db2.gz	XSFJIHAPJAKUKC-GFCCVEGCSA-N	1	0	293.361	4.390	20	30		CIEDRO
CC[C@@H](C)[C@H]([NH2+]CCCC#N)c1ccc(Cl)cc1	ZINC000537093410	330398627	/nfs/dbraw/zinc/39/86/27/330398627.db2.gz	LVZXLNSOXNIHGH-DOMZBBRYSA-N	1	0	264.800	4.321	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@H](c1cccnc1)C(C)C)C1CC1	ZINC000121586297	330403416	/nfs/dbraw/zinc/40/34/16/330403416.db2.gz	AXNDPCRMVCXNIE-ZWKOTPCHSA-N	1	0	272.436	4.156	20	30		CIEDRO
N#CCC1(C[NH2+]Cc2cccc(-c3ccccc3)c2)CC1	ZINC000430048758	330558125	/nfs/dbraw/zinc/55/81/25/330558125.db2.gz	WWRBKLLWTBWNJZ-UHFFFAOYSA-N	1	0	276.383	4.137	20	30		CIEDRO
C[C@@H]([NH2+]CC1(CC#N)CC1)c1cc2ccccc2s1	ZINC000430718417	330571290	/nfs/dbraw/zinc/57/12/90/330571290.db2.gz	CMJNIBDCDPEBDT-GFCCVEGCSA-N	1	0	270.401	4.246	20	30		CIEDRO
CC(C)[C@H]1C[C@@H]([NH2+]CC2(CC#N)CC2)c2ccccc21	ZINC000430726317	330571534	/nfs/dbraw/zinc/57/15/34/330571534.db2.gz	CYJLDFJQNCCNTC-IAGOWNOFSA-N	1	0	268.404	4.154	20	30		CIEDRO
N#CCC1(C[NH2+]C2c3ccccc3-c3ccccc32)CC1	ZINC000430745779	330572532	/nfs/dbraw/zinc/57/25/32/330572532.db2.gz	ZZVRUNLUKOQMSL-UHFFFAOYSA-N	1	0	274.367	4.040	20	30		CIEDRO
N#CCC1(C[NH2+][C@@H]2CCC[C@@H]2CCc2ccccc2)CC1	ZINC000430745233	330572603	/nfs/dbraw/zinc/57/26/03/330572603.db2.gz	WJZJWCMGSWMUKU-QZTJIDSGSA-N	1	0	282.431	4.071	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCC1CC(OC(C)(C)C)C1)C1CC1	ZINC000432412092	330598781	/nfs/dbraw/zinc/59/87/81/330598781.db2.gz	ADDGPFVNKXRQHB-PREGVCBESA-N	1	0	279.468	4.305	20	30		CIEDRO
C=C(C)[C@H]1OCC[C@H]1C[NH2+]Cc1ccc(-c2ccccc2)o1	ZINC000435735278	330661216	/nfs/dbraw/zinc/66/12/16/330661216.db2.gz	LFSPIOOUYUWQBJ-QFBILLFUSA-N	1	0	297.398	4.017	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+][C@H](CCCC)c1ccccc1	ZINC000436295421	330674107	/nfs/dbraw/zinc/67/41/07/330674107.db2.gz	PPPZGZQNRYXHJI-OTWHNJEPSA-N	1	0	287.447	4.489	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+][C@H](CC)c1ccc(C)cc1	ZINC000436297453	330674411	/nfs/dbraw/zinc/67/44/11/330674411.db2.gz	XTSZVYYFMCRATN-KSZLIROESA-N	1	0	273.420	4.017	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+][C@@H](C)c1oc2ccccc2c1C	ZINC000436303609	330674729	/nfs/dbraw/zinc/67/47/29/330674729.db2.gz	DDTYUBXWAHRBIT-MPGHIAIKSA-N	1	0	299.414	4.373	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@@H](C)C[C@@H](C)CC(C)C	ZINC000436309692	330675220	/nfs/dbraw/zinc/67/52/20/330675220.db2.gz	PFPTZIWORQTKQX-NXOAAHMSSA-N	1	0	267.457	4.018	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@H](CC(C)C)c1cccs1	ZINC000436311458	330675417	/nfs/dbraw/zinc/67/54/17/330675417.db2.gz	XTTPXRORQIVEDW-INMHGKMJSA-N	1	0	293.476	4.406	20	30		CIEDRO
C[C@@]1(c2ccccc2)CC[C@H]([NH2+]Cc2cccc(C#N)c2)C1	ZINC000438073162	330714944	/nfs/dbraw/zinc/71/49/44/330714944.db2.gz	KGQRZJMEXVHYDD-VQTJNVASSA-N	1	0	290.410	4.158	20	30		CIEDRO
C[C@]1(c2ccccc2)CC[C@H]([NH2+]Cc2cccc(C#N)c2)C1	ZINC000438073157	330714993	/nfs/dbraw/zinc/71/49/93/330714993.db2.gz	KGQRZJMEXVHYDD-PMACEKPBSA-N	1	0	290.410	4.158	20	30		CIEDRO
N#Cc1csc(C[NH2+][C@@H]2CC[C@H](Cc3ccccc3)C2)c1	ZINC000438365276	330723073	/nfs/dbraw/zinc/72/30/73/330723073.db2.gz	BCEXMYOCOKRYCB-NVXWUHKLSA-N	1	0	296.439	4.121	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1nc(C(C)(C)C)cs1)C1CC1	ZINC000438982927	330731824	/nfs/dbraw/zinc/73/18/24/330731824.db2.gz	YNIHTLZNOVGQHK-CYBMUJFWSA-N	1	0	278.465	4.275	20	30		CIEDRO
C=CC1CC[NH+](Cc2ncc(-c3ccc(C)cc3)o2)CC1	ZINC000441387776	330767453	/nfs/dbraw/zinc/76/74/53/330767453.db2.gz	RZWAXLHRDGKSMW-UHFFFAOYSA-N	1	0	282.387	4.048	20	30		CIEDRO
C=C[C@H](C)[NH2+][C@H](C)c1cc(F)c(Cl)cc1Cl	ZINC000157266174	330772294	/nfs/dbraw/zinc/77/22/94/330772294.db2.gz	DWTZELZVAPYUSW-JGVFFNPUSA-N	1	0	262.155	4.358	20	30		CIEDRO
Cc1ccc(C)c([C@@H](C)[NH2+]CC2CCC(C#N)CC2)c1	ZINC000442094975	330773994	/nfs/dbraw/zinc/77/39/94/330773994.db2.gz	FZBMLAUBNIYRJO-KLAILNCOSA-N	1	0	270.420	4.284	20	30		CIEDRO
CCC1(C)CC[NH+]([C@@H](C)c2cccc(C#N)c2)CC1	ZINC000442680968	330779071	/nfs/dbraw/zinc/77/90/71/330779071.db2.gz	RETIJWWEPFFQJY-AWEZNQCLSA-N	1	0	256.393	4.131	20	30		CIEDRO
C[C@H](Cc1ccc(Cl)cc1Cl)[NH2+][C@H]1CC[C@@H](C#N)C1	ZINC000442785033	330783198	/nfs/dbraw/zinc/78/31/98/330783198.db2.gz	SWXQUYMCOPRDHK-GYSYKLTISA-N	1	0	297.229	4.206	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+]C1CCC(C(F)F)CC1	ZINC000442791662	330783844	/nfs/dbraw/zinc/78/38/44/330783844.db2.gz	OHLDBKLRFWEFBK-UHFFFAOYSA-N	1	0	295.373	4.165	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@@H](c2ccccc2)c2cccc(F)c2)C1	ZINC000442796767	330784388	/nfs/dbraw/zinc/78/43/88/330784388.db2.gz	WATDNWKSZWQUSI-CCKFTAQKSA-N	1	0	294.373	4.197	20	30		CIEDRO
CC(C)(C[NH2+][C@@H]1CC[C@@H](C#N)C1)c1cccc(Cl)c1F	ZINC000442853358	330787140	/nfs/dbraw/zinc/78/71/40/330787140.db2.gz	ZHYSGOKRBYQCEL-VXGBXAGGSA-N	1	0	294.801	4.039	20	30		CIEDRO
CC1(C)[C@H]([NH2+]CC2CCC(C#N)CC2)C[C@H]1c1ccccc1	ZINC000442857545	330787674	/nfs/dbraw/zinc/78/76/74/330787674.db2.gz	PTVNKXPSTJVSSX-YVZJPGBNSA-N	1	0	296.458	4.488	20	30		CIEDRO
Cc1cc(C)cc([C@H](C)[NH2+]CC2CCC(C#N)CC2)c1	ZINC000442870002	330788985	/nfs/dbraw/zinc/78/89/85/330788985.db2.gz	CKXQFAUFJKMHLZ-GTPINHCMSA-N	1	0	270.420	4.284	20	30		CIEDRO
Cc1cc(C[NH2+]Cc2csc3ccccc23)ccc1C#N	ZINC000443968952	330808123	/nfs/dbraw/zinc/80/81/23/330808123.db2.gz	QKENKSUERGECMI-UHFFFAOYSA-N	1	0	292.407	4.371	20	30		CIEDRO
N#CCCC[NH2+]Cc1ccc(Oc2cccc(F)c2)cc1	ZINC000443983923	330808395	/nfs/dbraw/zinc/80/83/95/330808395.db2.gz	FBPLPRKGNXLMQW-UHFFFAOYSA-N	1	0	284.334	4.011	20	30		CIEDRO
C[C@H]([NH2+]Cc1cccc(F)c1Cl)c1ccc(C#N)cc1	ZINC000157993060	330812379	/nfs/dbraw/zinc/81/23/79/330812379.db2.gz	ZXPTWFRQASFATE-NSHDSACASA-N	1	0	288.753	4.202	20	30		CIEDRO
CC[C@H]([NH2+]CCCCC(C)(C)C#N)c1c(C)noc1C	ZINC000444681835	330818598	/nfs/dbraw/zinc/81/85/98/330818598.db2.gz	XEBGFBCYFDXEIB-AWEZNQCLSA-N	1	0	277.412	4.052	20	30		CIEDRO
CC(C)(C#N)CCCC[NH2+][C@@H]1CCCc2c(O)cccc21	ZINC000444703899	330820604	/nfs/dbraw/zinc/82/06/04/330820604.db2.gz	KJEDDSUHFQDCNX-MRXNPFEDSA-N	1	0	286.419	4.079	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)C1	ZINC000446823153	330855165	/nfs/dbraw/zinc/85/51/65/330855165.db2.gz	JHGNUOUVNJRWCS-CCKFTAQKSA-N	1	0	298.405	4.434	20	30		CIEDRO
CC[C@@H]([NH2+]CCc1ccccc1C)c1ccc(C#N)cc1	ZINC000447516682	330867598	/nfs/dbraw/zinc/86/75/98/330867598.db2.gz	PNEFWFMBHLJLNR-LJQANCHMSA-N	1	0	278.399	4.150	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H](C)Cc1ccccc1F)c1ccc(C#N)cc1	ZINC000447531549	330868097	/nfs/dbraw/zinc/86/80/97/330868097.db2.gz	QACYGBYAVDUYOU-IFXJQAMLSA-N	1	0	296.389	4.369	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CSc2ccccc21)c1ccc(C#N)cc1	ZINC000447543726	330869494	/nfs/dbraw/zinc/86/94/94/330869494.db2.gz	SUKVEYGZMKZXJT-DLBZAZTESA-N	1	0	294.423	4.446	20	30		CIEDRO
CC[C@H](Cc1ccc(Cl)cc1)[NH2+][C@@H]1CCC[C@H](C#N)C1	ZINC000447573369	330870571	/nfs/dbraw/zinc/87/05/71/330870571.db2.gz	HKMPSBAEOONNGP-USXIJHARSA-N	1	0	290.838	4.333	20	30		CIEDRO
CC[C@H](Cc1ccc(Cl)cc1)[NH2+][C@H]1CCC[C@@H](C#N)C1	ZINC000447573367	330870593	/nfs/dbraw/zinc/87/05/93/330870593.db2.gz	HKMPSBAEOONNGP-OIISXLGYSA-N	1	0	290.838	4.333	20	30		CIEDRO
CC[C@H]([NH2+]C1CCC(C)(C#N)CC1)c1ccc(OC)cc1	ZINC000449058556	330896025	/nfs/dbraw/zinc/89/60/25/330896025.db2.gz	KHCHSENTDAEKQN-NXYGQSRBSA-N	1	0	286.419	4.208	20	30		CIEDRO
Cc1c2ccccc2oc1C[NH2+]C1CCC(C)(C#N)CC1	ZINC000449153183	330902047	/nfs/dbraw/zinc/90/20/47/330902047.db2.gz	IRMVFDDPYFXSOX-UHFFFAOYSA-N	1	0	282.387	4.303	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+][C@@H](C)c1ncc(C)s1	ZINC000449179480	330904051	/nfs/dbraw/zinc/90/40/51/330904051.db2.gz	VYVSCWXHZBRMSB-YPMHNXCESA-N	1	0	252.427	4.237	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@@H]1CCO[C@H](C(C)(C)C)C1	ZINC000449200276	330905787	/nfs/dbraw/zinc/90/57/87/330905787.db2.gz	BMSVNKSJDUCBLO-XHSDSOJGSA-N	1	0	267.457	4.305	20	30		CIEDRO
CCC(CC)[C@H]1C[C@H]([NH2+]C2CCC(C)(C#N)CC2)CCO1	ZINC000449225295	330907474	/nfs/dbraw/zinc/90/74/74/330907474.db2.gz	JYVQKZJYCAZUKR-QLOLRVAOSA-N	1	0	292.467	4.032	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+][C@H](c1nc(C2CC2)no1)C(C)C	ZINC000449227238	330907529	/nfs/dbraw/zinc/90/75/29/330907529.db2.gz	TYIROJWEJCZHKS-HIFRSBDPSA-N	1	0	291.439	4.369	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+]C[C@H](C)c1nc(C)cs1	ZINC000449238883	330908626	/nfs/dbraw/zinc/90/86/26/330908626.db2.gz	TYPSZPAVOVNDEP-STQMWFEESA-N	1	0	266.454	4.280	20	30		CIEDRO
CC(C)(C#N)C[NH2+][C@H]1CC[C@H](c2ccc(Cl)cc2)C1	ZINC000449241069	330908994	/nfs/dbraw/zinc/90/89/94/330908994.db2.gz	QVIHRFPZQKGQNL-ZFWWWQNUSA-N	1	0	276.811	4.115	20	30		CIEDRO
CC(C)(C)OC1CC(CC[NH2+]C2CCC(C)(C#N)CC2)C1	ZINC000449286082	330911878	/nfs/dbraw/zinc/91/18/78/330911878.db2.gz	TZOGINWQMYKZMP-UHFFFAOYSA-N	1	0	292.467	4.032	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+]Cc1oc(CCC)nc1C	ZINC000449337445	330915849	/nfs/dbraw/zinc/91/58/49/330915849.db2.gz	BBIYLZWPSKZOIF-CYBMUJFWSA-N	1	0	264.413	4.160	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CCCc3c(F)cccc32)c(F)c1	ZINC000449349828	330917236	/nfs/dbraw/zinc/91/72/36/330917236.db2.gz	KHOAPZQXSRRDND-GOSISDBHSA-N	1	0	298.336	4.004	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)c1ccc(F)cc1Cl	ZINC000449351154	330917603	/nfs/dbraw/zinc/91/76/03/330917603.db2.gz	YOFSOOZKAJAKFT-NQBHXWOUSA-N	1	0	280.774	4.212	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]CCC(C)(F)F)cc1Cl	ZINC000449354447	330918215	/nfs/dbraw/zinc/91/82/15/330918215.db2.gz	NOTMRGMRSQKBGM-UHFFFAOYSA-N	1	0	289.753	4.040	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]C[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000449401834	330922668	/nfs/dbraw/zinc/92/26/68/330922668.db2.gz	OMWZXVVGGPYPBX-ZWKOTPCHSA-N	1	0	284.447	4.490	20	30		CIEDRO
CC[C@@H]1CCCC[C@@H]1C[NH2+]CC(C)(C)CCC#N	ZINC000449404472	330923013	/nfs/dbraw/zinc/92/30/13/330923013.db2.gz	CBLFUSMKHNIWCI-HUUCEWRRSA-N	1	0	250.430	4.122	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+][C@H]2CCCC[C@H]2CC(F)(F)F)C1	ZINC000449435828	330925433	/nfs/dbraw/zinc/92/54/33/330925433.db2.gz	WIPJSPOYIAKESI-RQJABVFESA-N	1	0	288.357	4.170	20	30		CIEDRO
CC(C)CC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000449446168	330926285	/nfs/dbraw/zinc/92/62/85/330926285.db2.gz	OGBMUMMVNHHSMX-QAETUUGQSA-N	1	0	262.441	4.263	20	30		CIEDRO
CC(C)([NH2+]Cc1cccc(OCCCC#N)c1)C1CCC1	ZINC000449523201	330933788	/nfs/dbraw/zinc/93/37/88/330933788.db2.gz	WVABPZVNPJLEJK-UHFFFAOYSA-N	1	0	286.419	4.037	20	30		CIEDRO
C=CCC1([NH2+]C[C@@H]2CCO[C@H](CC)C2)CCCCC1	ZINC000449575876	330938283	/nfs/dbraw/zinc/93/82/83/330938283.db2.gz	ORLKAMQCQAGGAG-HZPDHXFCSA-N	1	0	265.441	4.060	20	30		CIEDRO
C=CCC1(C[NH2+]Cc2scnc2C2CC2)CCCC1	ZINC000449605501	330939080	/nfs/dbraw/zinc/93/90/80/330939080.db2.gz	NNBMXEOWGMSIMF-UHFFFAOYSA-N	1	0	276.449	4.247	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H]1CCCc2c3ccccc3[nH]c21	ZINC000162624752	330943615	/nfs/dbraw/zinc/94/36/15/330943615.db2.gz	TXJVVGZUARAVII-LRDDRELGSA-N	1	0	254.377	4.100	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+]C[C@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000449691123	330943773	/nfs/dbraw/zinc/94/37/73/330943773.db2.gz	UMUMZWCQEIZTDZ-OQIJWPOYSA-N	1	0	282.431	4.242	20	30		CIEDRO
C=CC[C@@H](C)[NH2+]Cc1ccc(Cl)c(Br)c1	ZINC000162637759	330945555	/nfs/dbraw/zinc/94/55/55/330945555.db2.gz	JTRIRTLYVRJRNI-SECBINFHSA-N	1	0	288.616	4.157	20	30		CIEDRO
C=C(CC)C[NH2+][C@H](C)[C@H](C)c1nc2ccccc2s1	ZINC000449735206	330946917	/nfs/dbraw/zinc/94/69/17/330946917.db2.gz	QGHVNFLIRQMGOG-QWHCGFSZSA-N	1	0	274.433	4.344	20	30		CIEDRO
CC(C)(C)[C@@H]([NH2+]CC1(C#N)CCC1)c1ccc(F)cc1	ZINC000450517009	330984588	/nfs/dbraw/zinc/98/45/88/330984588.db2.gz	DMJMTGNQUIGIPN-HNNXBMFYSA-N	1	0	274.383	4.196	20	30		CIEDRO
N#CC1(C[NH2+][C@H](c2ccc(Cl)cc2)C2CC2)CCC1	ZINC000450658924	330991731	/nfs/dbraw/zinc/99/17/31/330991731.db2.gz	FHOVMAXBASDMDX-HNNXBMFYSA-N	1	0	274.795	4.075	20	30		CIEDRO
N#Cc1cccc(C2([NH2+]CC/C=C\c3ccccc3)CC2)c1	ZINC000450671398	330992410	/nfs/dbraw/zinc/99/24/10/330992410.db2.gz	HMTREXRFGSMWRH-WTKPLQERSA-N	1	0	288.394	4.240	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCCc1cc(CC)no1)c1ccccc1	ZINC000450682422	330993346	/nfs/dbraw/zinc/99/33/46/330993346.db2.gz	PRPPDIFKZPCRRT-IBGZPJMESA-N	1	0	298.430	4.467	20	30		CIEDRO
N#CC1(C[NH2+][C@@H]2CCC[C@@H]2c2ccc(Cl)cc2)CCC1	ZINC000450820093	331001016	/nfs/dbraw/zinc/00/10/16/331001016.db2.gz	MQPVRVDUGBXGPY-HZPDHXFCSA-N	1	0	288.822	4.260	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)CCc1ccc(OC(F)F)cc1	ZINC000163318212	331020148	/nfs/dbraw/zinc/02/01/48/331020148.db2.gz	WMVRNFDLNXDPBE-QWHCGFSZSA-N	1	0	283.362	4.163	20	30		CIEDRO
CC1(C#N)CCC([NH2+]C2(c3cccc(Cl)c3)CC2)CC1	ZINC000453160252	331095517	/nfs/dbraw/zinc/09/55/17/331095517.db2.gz	AUADRVPKAPHABK-UHFFFAOYSA-N	1	0	288.822	4.391	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H](C)c1nccn1CC)c1ccccc1	ZINC000453178195	331097647	/nfs/dbraw/zinc/09/76/47/331097647.db2.gz	SDMUWZRNHABEOV-RDJZCZTQSA-N	1	0	283.419	4.261	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H](C)c2csc(C)c2)cc1	ZINC000453216713	331102497	/nfs/dbraw/zinc/10/24/97/331102497.db2.gz	TVCRMDIBBKDECW-AWEZNQCLSA-N	1	0	287.428	4.472	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@@H]1CSc2ccccc21)C1CC1	ZINC000453218511	331102776	/nfs/dbraw/zinc/10/27/76/331102776.db2.gz	JWVPPRFQFXCIHG-GDBMZVCRSA-N	1	0	273.445	4.210	20	30		CIEDRO
Cc1ccc([C@@H](C)[NH2+][C@@H]2CCc3ccc(C#N)cc32)cc1F	ZINC000453264636	331108999	/nfs/dbraw/zinc/10/89/99/331108999.db2.gz	WLUFYOSEHXNTOA-BFUOFWGJSA-N	1	0	294.373	4.344	20	30		CIEDRO
C[C@@H]1CC[C@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)c2sccc21	ZINC000453296168	331112481	/nfs/dbraw/zinc/11/24/81/331112481.db2.gz	UGYGWEKOLGLVCS-OSFYFWSMSA-N	1	0	274.433	4.358	20	30		CIEDRO
Cc1cc([C@@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)C2CC2)ccc1F	ZINC000453299240	331112884	/nfs/dbraw/zinc/11/28/84/331112884.db2.gz	ZZVCQNQPDWJGNI-OWQGQXMQSA-N	1	0	286.394	4.257	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@H]1CCCc2ncc(C(F)(F)F)cc21	ZINC000453302735	331113490	/nfs/dbraw/zinc/11/34/90/331113490.db2.gz	AQAOIPAKSNRFQF-AWEZNQCLSA-N	1	0	298.352	4.280	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@@H](C)c1ccc(SC)c(OC)c1	ZINC000453305412	331113894	/nfs/dbraw/zinc/11/38/94/331113894.db2.gz	ICSAOAUBEHEBPJ-LBPRGKRZSA-N	1	0	279.449	4.280	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@@H](C[C@@H]1CCOC1)c1ccc(F)cc1	ZINC000453312165	331114941	/nfs/dbraw/zinc/11/49/41/331114941.db2.gz	UUSROAAWXIEVAP-YOEHRIQHSA-N	1	0	291.410	4.095	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@@H]1CCSc2ccc(OC)cc21	ZINC000453314387	331115369	/nfs/dbraw/zinc/11/53/69/331115369.db2.gz	YKXTXUVKXXAAGP-CQSZACIVSA-N	1	0	277.433	4.034	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@H]1CCCC1(F)F)c1ccco1	ZINC000453319312	331116055	/nfs/dbraw/zinc/11/60/55/331116055.db2.gz	NGQFGOAPRNCHOY-OLZOCXBDSA-N	1	0	269.335	4.312	20	30		CIEDRO
CC[C@@H]([NH2+]C[C@H]1CCCC1(F)F)c1ccc(C#N)cc1	ZINC000453323951	331116737	/nfs/dbraw/zinc/11/67/37/331116737.db2.gz	URUDAPXNSUBQDO-HUUCEWRRSA-N	1	0	278.346	4.034	20	30		CIEDRO
CC[C@H]([NH2+]C[C@@H]1CCCC1(F)F)c1ccc(C#N)cc1	ZINC000453323950	331116767	/nfs/dbraw/zinc/11/67/67/331116767.db2.gz	URUDAPXNSUBQDO-GJZGRUSLSA-N	1	0	278.346	4.034	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)c1ccc(Oc2ccccc2)cn1	ZINC000453330382	331117722	/nfs/dbraw/zinc/11/77/22/331117722.db2.gz	YNLDMWRSWDCFIU-OAHLLOKOSA-N	1	0	282.387	4.491	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@H]1CCOC2(CCC2)C1)c1ccco1	ZINC000453331701	331117782	/nfs/dbraw/zinc/11/77/82/331117782.db2.gz	ZYPRRXOOAYNMDT-HOTGVXAUSA-N	1	0	289.419	4.226	20	30		CIEDRO
C=C(CC)C[NH2+][C@H](C)c1ccc(SC)c(OC)c1	ZINC000453367147	331123525	/nfs/dbraw/zinc/12/35/25/331123525.db2.gz	PRAISYFZYLTYLM-GFCCVEGCSA-N	1	0	265.422	4.034	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1[NH2+][C@H](C)c1cc(Cl)sc1Cl	ZINC000453369739	331123987	/nfs/dbraw/zinc/12/39/87/331123987.db2.gz	SQUXVQDSOYBYAD-QNSHHTMESA-N	1	0	292.231	4.049	20	30		CIEDRO
Cc1cccc([C@H](C)[NH2+][C@H]2CCc3ccc(C#N)cc32)c1	ZINC000453398617	331128259	/nfs/dbraw/zinc/12/82/59/331128259.db2.gz	MYTYTFUAJALQQB-LIRRHRJNSA-N	1	0	276.383	4.205	20	30		CIEDRO
C=C[C@@H](C)[NH2+][C@@H](C)c1cc2cc(Br)ccc2o1	ZINC000164610480	331263111	/nfs/dbraw/zinc/26/31/11/331263111.db2.gz	XIOCZMUMOARXRH-ZJUUUORDSA-N	1	0	294.192	4.420	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)c1cc2cccc(OC)c2o1	ZINC000164629746	331269195	/nfs/dbraw/zinc/26/91/95/331269195.db2.gz	CZVHQKIVGNEDKG-RYUDHWBXSA-N	1	0	259.349	4.057	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@@H](C)CC(=O)Nc1cccc(Cl)c1	ZINC000467411186	331280820	/nfs/dbraw/zinc/28/08/20/331280820.db2.gz	BGBMLFOUUHRTMS-GXTWGEPZSA-N	1	0	294.826	4.001	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([N@@H+]2CC3(CCCC3)[C@H]2c2ccccc2)C1	ZINC000459581091	331289205	/nfs/dbraw/zinc/28/92/05/331289205.db2.gz	PSIVEBPKUYYHLD-BPQIPLTHSA-N	1	0	280.415	4.296	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+][C@@H](C)c1cncc(F)c1	ZINC000459653263	331292390	/nfs/dbraw/zinc/29/23/90/331292390.db2.gz	XQIYPMOCNHRYQC-OLZOCXBDSA-N	1	0	250.361	4.006	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+][C@@H]2C[C@H]2c2c(F)cccc2Cl)C1	ZINC000459670038	331293356	/nfs/dbraw/zinc/29/33/56/331293356.db2.gz	TYCDVTRSODJQMX-FUTJPDQTSA-N	1	0	292.785	4.007	20	30		CIEDRO
Cc1ccc([C@@H]2CCC[C@@H]2[NH2+]CC(C)(C)CC#N)cc1	ZINC000459726278	331296069	/nfs/dbraw/zinc/29/60/69/331296069.db2.gz	DRHGRXYRCLFDJV-IRXDYDNUSA-N	1	0	270.420	4.161	20	30		CIEDRO
CC(C)(CC#N)C[NH2+]Cc1ccc(Oc2ccccc2)o1	ZINC000459727184	331296157	/nfs/dbraw/zinc/29/61/57/331296157.db2.gz	FWXUXFKCROKABB-UHFFFAOYSA-N	1	0	284.359	4.101	20	30		CIEDRO
CC(C)(CC#N)C[NH2+][C@@H]1CC[C@](C)(c2ccccc2)C1	ZINC000459728837	331296313	/nfs/dbraw/zinc/29/63/13/331296313.db2.gz	JCCLPIHAGGVCDA-AEFFLSMTSA-N	1	0	270.420	4.026	20	30		CIEDRO
C[C@H]([NH2+]CC(C)(C)CC#N)c1ccccc1C(F)(F)F	ZINC000459730452	331296342	/nfs/dbraw/zinc/29/63/42/331296342.db2.gz	MJQMZQQGVKSWDD-NSHDSACASA-N	1	0	284.325	4.296	20	30		CIEDRO
C[C@H]([NH2+]CC(C)(C)CC#N)c1cc2ccccc2o1	ZINC000459730375	331296457	/nfs/dbraw/zinc/29/64/57/331296457.db2.gz	LUDLBEIBGJPCAC-LBPRGKRZSA-N	1	0	256.349	4.023	20	30		CIEDRO
C[C@@H]([NH2+]CC(C)(C)CC#N)c1cc2ccccc2o1	ZINC000459730374	331296465	/nfs/dbraw/zinc/29/64/65/331296465.db2.gz	LUDLBEIBGJPCAC-GFCCVEGCSA-N	1	0	256.349	4.023	20	30		CIEDRO
CC(C)(CC#N)C[NH2+]C1CC(c2ccc(Cl)cc2)C1	ZINC000459733626	331296757	/nfs/dbraw/zinc/29/67/57/331296757.db2.gz	QSGXXADNVVYEID-UHFFFAOYSA-N	1	0	276.811	4.115	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+]Cc1nc(C(C)C)c(C)s1	ZINC000462048377	331316928	/nfs/dbraw/zinc/31/69/28/331316928.db2.gz	KXUBSEFYSRBGTC-ZDUSSCGKSA-N	1	0	266.454	4.409	20	30		CIEDRO
CCC[C@H](CCc1ccccc1)[NH2+][C@H](CC)CC#N	ZINC000462065605	331317038	/nfs/dbraw/zinc/31/70/38/331317038.db2.gz	NKXGVHPRPJJEBT-IAGOWNOFSA-N	1	0	258.409	4.070	20	30		CIEDRO
C=CC[N@H+](CCCc1ccncc1)CC1CCCCC1	ZINC000462319889	331319272	/nfs/dbraw/zinc/31/92/72/331319272.db2.gz	RCLMONXBPHMNKX-UHFFFAOYSA-N	1	0	272.436	4.083	20	30		CIEDRO
CC#CCC[N@H+](C)[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000462323213	331319535	/nfs/dbraw/zinc/31/95/35/331319535.db2.gz	GSOHXJXQEDXHSN-LBPRGKRZSA-N	1	0	269.310	4.112	20	30		CIEDRO
CC#CCC[N@H+](C)C1c2ccccc2-c2ccccc21	ZINC000462331896	331319954	/nfs/dbraw/zinc/31/99/54/331319954.db2.gz	DPGVRXBDAHYAIL-UHFFFAOYSA-N	1	0	261.368	4.102	20	30		CIEDRO
C[C@H]1CCCc2ccccc2[C@H]1[NH2+]Cc1cccc(C#N)c1	ZINC000462544888	331323365	/nfs/dbraw/zinc/32/33/65/331323365.db2.gz	OJAIDWOOCJXSFR-YWZLYKJASA-N	1	0	290.410	4.362	20	30		CIEDRO
CCC(CC)(C[NH2+]Cc1ccc(C#N)cc1)c1ccccc1	ZINC000462745682	331327109	/nfs/dbraw/zinc/32/71/09/331327109.db2.gz	LRMRIJLXZVGRJI-UHFFFAOYSA-N	1	0	292.426	4.406	20	30		CIEDRO
C=Cc1ccc(CC[NH2+][C@H](C)c2ccc(C#N)c(F)c2)cc1	ZINC000462803157	331329692	/nfs/dbraw/zinc/32/96/92/331329692.db2.gz	BESXAITWTOLGDH-CQSZACIVSA-N	1	0	294.373	4.234	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](C)c1ccc(OC(C)(C)C)cc1	ZINC000463031537	331337778	/nfs/dbraw/zinc/33/77/78/331337778.db2.gz	XXSWITFXAJLITH-ZIAGYGMSSA-N	1	0	261.409	4.479	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCCC1CCOCC1)c1ccccc1	ZINC000463236681	331343539	/nfs/dbraw/zinc/34/35/39/331343539.db2.gz	JSQIGDKOTDQSOZ-LJQANCHMSA-N	1	0	287.447	4.490	20	30		CIEDRO
CCC(CC)(C[NH2+][C@H]1CCC[C@@H](C#N)C1)c1ccccc1	ZINC000463238532	331343685	/nfs/dbraw/zinc/34/36/85/331343685.db2.gz	RFBYPVRJZSCMCN-AEFFLSMTSA-N	1	0	284.447	4.416	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)c1ccccc1C(F)(F)F	ZINC000463243321	331343974	/nfs/dbraw/zinc/34/39/74/331343974.db2.gz	OSAGSTHTVRUMMD-RWMBFGLXSA-N	1	0	296.336	4.438	20	30		CIEDRO
C[C@@H]([C@H](C)[NH2+][C@@H]1CCC[C@@H](C#N)C1)C1CCCCC1	ZINC000463243924	331343986	/nfs/dbraw/zinc/34/39/86/331343986.db2.gz	FHQMUZHRQQHUGK-LJIGWXMPSA-N	1	0	262.441	4.263	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)c1ccccc1C(F)(F)F	ZINC000463243322	331343990	/nfs/dbraw/zinc/34/39/90/331343990.db2.gz	OSAGSTHTVRUMMD-XQQFMLRXSA-N	1	0	296.336	4.438	20	30		CIEDRO
Cc1ccc([C@H]([NH2+][C@H]2CCC[C@@H](C#N)C2)C2CC2)cc1	ZINC000463277966	331344799	/nfs/dbraw/zinc/34/47/99/331344799.db2.gz	AVOYQPAFXRTURC-JLSDUUJJSA-N	1	0	268.404	4.118	20	30		CIEDRO
CC(C)(C)[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CCC[C@H](C#N)C1	ZINC000463279612	331344892	/nfs/dbraw/zinc/34/48/92/331344892.db2.gz	KARLRISMFZKIIU-JJXSEGSLSA-N	1	0	262.441	4.263	20	30		CIEDRO
CC(C)[C@H]1CC[C@@H](C)C[C@H]1[NH2+][C@@H]1CCC[C@@H](C#N)C1	ZINC000463292153	331345448	/nfs/dbraw/zinc/34/54/48/331345448.db2.gz	ZXTCERSXUBTSGB-WRQOLXDDSA-N	1	0	262.441	4.119	20	30		CIEDRO
CC(C)CC(CC(C)C)[NH2+][C@H]1CCC[C@@H](C#N)C1	ZINC000463294687	331345624	/nfs/dbraw/zinc/34/56/24/331345624.db2.gz	FQAVIOFIBDHHHF-CABCVRRESA-N	1	0	250.430	4.119	20	30		CIEDRO
CC(C)(C)c1ccc(CC[NH2+][C@@H]2CCC[C@@H](C#N)C2)cc1	ZINC000463295578	331345728	/nfs/dbraw/zinc/34/57/28/331345728.db2.gz	MIZBUOMBNZXCJA-SJLPKXTDSA-N	1	0	284.447	4.199	20	30		CIEDRO
CC[N@H+](Cc1ccccc1C(C)(C)C#N)CC(C)(C)C	ZINC000463366492	331346690	/nfs/dbraw/zinc/34/66/90/331346690.db2.gz	KPDORSJTPKGHME-UHFFFAOYSA-N	1	0	272.436	4.356	20	30		CIEDRO
CC[C@@]1(C)CCC[N@@H+]([C@@H](C)c2ccc(C#N)cc2)C1	ZINC000464778350	331367630	/nfs/dbraw/zinc/36/76/30/331367630.db2.gz	NRDIBKPXOMNIQC-YOEHRIQHSA-N	1	0	256.393	4.131	20	30		CIEDRO
CC(C)[C@@H](Cc1ccc(F)cc1)[N@H+](C)CCCCC#N	ZINC000464788332	331368296	/nfs/dbraw/zinc/36/82/96/331368296.db2.gz	JMGIHCOCJKPEAN-QGZVFWFLSA-N	1	0	276.399	4.018	20	30		CIEDRO
Cc1ccc([C@@H]2C[C@H](C)CC[N@@H+]2Cc2ccc(C#N)cc2)o1	ZINC000464841002	331370732	/nfs/dbraw/zinc/37/07/32/331370732.db2.gz	VTJLFJBQICCUJD-KDOFPFPSSA-N	1	0	294.398	4.433	20	30		CIEDRO
CC(C)(CCc1ccccc1)[NH2+]Cc1ccc(F)cc1C#N	ZINC000464872219	331372192	/nfs/dbraw/zinc/37/21/92/331372192.db2.gz	HQKCLVDETXYCOT-UHFFFAOYSA-N	1	0	296.389	4.198	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1cc(Cl)cc2cccnc21	ZINC000466401243	331395101	/nfs/dbraw/zinc/39/51/01/331395101.db2.gz	YTQGUPIDXGZXIT-HNNXBMFYSA-N	1	0	274.795	4.333	20	30		CIEDRO
CCSc1cccc(C[NH2+]CCc2cccc(C#N)c2)c1	ZINC000466422577	331396383	/nfs/dbraw/zinc/39/63/83/331396383.db2.gz	MYCHINDEYBHURH-UHFFFAOYSA-N	1	0	296.439	4.003	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@H](C)[C@@H](C)c1ccc(OC)cc1	ZINC000467405779	331417853	/nfs/dbraw/zinc/41/78/53/331417853.db2.gz	HHZFXNFMZBPHNA-FMKPAKJESA-N	1	0	261.409	4.132	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@@H](CCc1ccccc1)C(F)F	ZINC000467409954	331418081	/nfs/dbraw/zinc/41/80/81/331418081.db2.gz	BZTOVPREIIKKGQ-GJZGRUSLSA-N	1	0	267.363	4.197	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@H](C)c1nc2ccc(Cl)cc2n1C	ZINC000467420004	331418632	/nfs/dbraw/zinc/41/86/32/331418632.db2.gz	SXRUGLVZGGBPDR-DGCLKSJQSA-N	1	0	291.826	4.232	20	30		CIEDRO
Cc1cc([C@H](C)[NH2+]CCc2cccc(C#N)c2)c(C)s1	ZINC000467445730	331419673	/nfs/dbraw/zinc/41/96/73/331419673.db2.gz	BLMGYHDGIWBCNY-ZDUSSCGKSA-N	1	0	284.428	4.130	20	30		CIEDRO
CC1CC([NH2+]Cc2ccc(-c3ccccc3C#N)cc2)C1	ZINC000467735533	331423409	/nfs/dbraw/zinc/42/34/09/331423409.db2.gz	OKJWRHJULFWRGS-UHFFFAOYSA-N	1	0	276.383	4.113	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+][C@H]1CCOc2ccc(OC)cc21	ZINC000468027696	331426908	/nfs/dbraw/zinc/42/69/08/331426908.db2.gz	FZAAEHZVXNDGTN-PBHICJAKSA-N	1	0	289.419	4.243	20	30		CIEDRO
CC(C)[C@H]([NH2+][C@H]1CC[C@@H](C#N)C1)c1ccc(Cl)cc1F	ZINC000471618316	331513590	/nfs/dbraw/zinc/51/35/90/331513590.db2.gz	KEWHVXLIZFDWET-FFSVYQOJSA-N	1	0	294.801	4.458	20	30		CIEDRO
C=CCCCC[NH2+][C@H](C)c1ccc(OCC)c([N+](=O)[O-])c1	ZINC000471616160	331513598	/nfs/dbraw/zinc/51/35/98/331513598.db2.gz	AIEJJGDQZDRQAV-CYBMUJFWSA-N	1	0	292.379	4.000	20	30		CIEDRO
C=CCC[C@@H](O)C[NH2+][C@@H](c1ccccc1)c1ccc(C)cc1	ZINC000472771925	331542801	/nfs/dbraw/zinc/54/28/01/331542801.db2.gz	NWQWSSWGLLRXRC-UXHICEINSA-N	1	0	295.426	4.001	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCC12CCCC2)c1ccc(C#N)cc1F	ZINC000474046396	331565116	/nfs/dbraw/zinc/56/51/16/331565116.db2.gz	NJKFYWIQDSBNCS-WBMJQRKESA-N	1	0	272.367	4.071	20	30		CIEDRO
CC[C@@H](CC#N)[NH2+]C[C@@H](CC(C)C)c1ccccc1	ZINC000474921105	331604018	/nfs/dbraw/zinc/60/40/18/331604018.db2.gz	AGPWPTISDGQBOZ-SJORKVTESA-N	1	0	258.409	4.098	20	30		CIEDRO
CC(C)C[C@@H](C[NH+]1CCC(C)(C#N)CC1)c1ccccc1	ZINC000474922877	331604202	/nfs/dbraw/zinc/60/42/02/331604202.db2.gz	GYHLKZOYSPLOHZ-SFHVURJKSA-N	1	0	284.447	4.442	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](c1cc(F)ccc1F)C(C)C	ZINC000479396522	331726910	/nfs/dbraw/zinc/72/69/10/331726910.db2.gz	QKLMCCNMRPQVCX-ABAIWWIYSA-N	1	0	253.336	4.216	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@@H](C)c1ccc(Br)cn1	ZINC000479409708	331727836	/nfs/dbraw/zinc/72/78/36/331727836.db2.gz	NDOOWTQSVHKJAL-NEPJUHHUSA-N	1	0	297.240	4.240	20	30		CIEDRO
C=CC[C@H](C)[NH2+]Cc1ccc(-c2cccc(F)c2F)o1	ZINC000480383623	331770963	/nfs/dbraw/zinc/77/09/63/331770963.db2.gz	MGZVBQZIZWBFOF-NSHDSACASA-N	1	0	277.314	4.279	20	30		CIEDRO
C=CC[C@@H](C)[C@H](C)[NH2+]CC1(CCOC)CCCCC1	ZINC000480743618	331786665	/nfs/dbraw/zinc/78/66/65/331786665.db2.gz	IDZKOCWOPJYFMY-CVEARBPZSA-N	1	0	267.457	4.164	20	30		CIEDRO
C=CCCC[NH2+][C@H](C(=C)C)c1ccc(F)c(F)c1	ZINC000481609104	331810211	/nfs/dbraw/zinc/81/02/11/331810211.db2.gz	NETVHTPIXYQFSO-OAHLLOKOSA-N	1	0	251.320	4.138	20	30		CIEDRO
CC[C@@H](CC#N)[NH2+]CCCc1c(Cl)cccc1Cl	ZINC000482243525	331828550	/nfs/dbraw/zinc/82/85/50/331828550.db2.gz	VSQIFMNVSYTAEW-NSHDSACASA-N	1	0	285.218	4.208	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@@H]1CCc2c1cccc2O	ZINC000482539534	331837577	/nfs/dbraw/zinc/83/75/77/331837577.db2.gz	ANHVFVFSLQDOLO-XJKSGUPXSA-N	1	0	259.393	4.104	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+][C@H]1CCc2c1cccc2O	ZINC000482539529	331837726	/nfs/dbraw/zinc/83/77/26/331837726.db2.gz	ANHVFVFSLQDOLO-CJNGLKHVSA-N	1	0	259.393	4.104	20	30		CIEDRO
CC(C)(C#N)CCC[NH2+][C@@]1(C)CCCc2ccccc21	ZINC000483769916	331884545	/nfs/dbraw/zinc/88/45/45/331884545.db2.gz	AWDZWGKFVFWDFC-SFHVURJKSA-N	1	0	270.420	4.158	20	30		CIEDRO
COc1ccc([C@@H]([NH2+]CC#Cc2ccccc2)C(C)C)cc1	ZINC000484074096	331892323	/nfs/dbraw/zinc/89/23/23/331892323.db2.gz	XEAOCUKNTQVJNR-FQEVSTJZSA-N	1	0	293.410	4.034	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@@H]2CCC[C@@H](c3ccccc3)C2)c1	ZINC000486898486	331948586	/nfs/dbraw/zinc/94/85/86/331948586.db2.gz	CRQUAADHUXDJBA-WOJBJXKFSA-N	1	0	290.410	4.374	20	30		CIEDRO
C[C@@H]1CCC[C@@H](C)[NH+]1Cc1ccccc1C(C)(C)C#N	ZINC000487417649	331969435	/nfs/dbraw/zinc/96/94/35/331969435.db2.gz	YVEOEUWDLWKLPA-HUUCEWRRSA-N	1	0	270.420	4.251	20	30		CIEDRO
C=CCC[C@H]([NH2+]C/C=C\c1ccncc1)c1ccccc1	ZINC000487551209	331973744	/nfs/dbraw/zinc/97/37/44/331973744.db2.gz	NVWOQXOCEGYDHV-FQQSSWHASA-N	1	0	278.399	4.392	20	30		CIEDRO
Cc1cc(C[NH2+][C@@H](c2ccccc2)C2CC2)ccc1C#N	ZINC000488134336	331991676	/nfs/dbraw/zinc/99/16/76/331991676.db2.gz	DJHCZGLYTLBFSD-IBGZPJMESA-N	1	0	276.383	4.108	20	30		CIEDRO
C=CCCCCC[NH2+]C1(c2ccc(OC)cc2)CC1	ZINC000488164859	331992588	/nfs/dbraw/zinc/99/25/88/331992588.db2.gz	QUIZXWVJDRTNFI-UHFFFAOYSA-N	1	0	259.393	4.020	20	30		CIEDRO
C=CCCCCC[NH2+][C@H](c1ncccc1C)C(C)C	ZINC000488238545	331995529	/nfs/dbraw/zinc/99/55/29/331995529.db2.gz	XFAFIFAXCDMPSU-INIZCTEOSA-N	1	0	260.425	4.423	20	30		CIEDRO
Cc1cccc(C)c1[C@@H](C)[NH2+]Cc1ccc(C#N)c(C)c1	ZINC000488263737	331996693	/nfs/dbraw/zinc/99/66/93/331996693.db2.gz	MRYKORXBDHUTTQ-MRXNPFEDSA-N	1	0	278.399	4.334	20	30		CIEDRO
N#CCC[C@@H]([NH2+]C1CCC2(CC2)CC1)c1ccccc1	ZINC000488439637	332008732	/nfs/dbraw/zinc/00/87/32/332008732.db2.gz	OYGMAJQEMBMTHK-QGZVFWFLSA-N	1	0	268.404	4.344	20	30		CIEDRO
Cc1cccc(C[N@@H+](C)[C@@H](C)c2cccc(C#N)c2)c1	ZINC000488466107	332011777	/nfs/dbraw/zinc/01/17/77/332011777.db2.gz	PGNZKWFFCNIMCF-HNNXBMFYSA-N	1	0	264.372	4.060	20	30		CIEDRO
CC[N@H+](CCc1ccccc1)[C@@H](C)c1ccc(C#N)cc1	ZINC000488519839	332015345	/nfs/dbraw/zinc/01/53/45/332015345.db2.gz	ZSPSSDPQIMBLPO-INIZCTEOSA-N	1	0	278.399	4.184	20	30		CIEDRO
C[C@@H](c1cccc(C#N)c1)[N@H+](C)CC1CCCCC1	ZINC000489087052	332041076	/nfs/dbraw/zinc/04/10/76/332041076.db2.gz	HCWUITOJEZQZPL-AWEZNQCLSA-N	1	0	256.393	4.131	20	30		CIEDRO
C=C[C@H]1CCCC[N@H+]1Cc1cc(-c2ccc(F)cc2)no1	ZINC000489485835	332055699	/nfs/dbraw/zinc/05/56/99/332055699.db2.gz	STHGNBBJEBTNNG-HNNXBMFYSA-N	1	0	286.350	4.021	20	30		CIEDRO
CC(C)(C)C[C@@H]1CCC[N@@H+]1Cc1ccc(F)cc1C#N	ZINC000489553206	332058909	/nfs/dbraw/zinc/05/89/09/332058909.db2.gz	ZHZCPMFWRSSGJP-INIZCTEOSA-N	1	0	274.383	4.098	20	30		CIEDRO
CC(C)(C)CC(C)(C)[NH2+]Cc1ccc(F)cc1C#N	ZINC000489617965	332061810	/nfs/dbraw/zinc/06/18/10/332061810.db2.gz	CNRZFSYZOUURLH-UHFFFAOYSA-N	1	0	262.372	4.002	20	30		CIEDRO
N#Cc1cc(F)ccc1C[N@@H+]1CCC[C@@H]1C1CCCCC1	ZINC000489683026	332064634	/nfs/dbraw/zinc/06/46/34/332064634.db2.gz	ZUBALSJPLWXUNP-GOSISDBHSA-N	1	0	286.394	4.242	20	30		CIEDRO
C[N@H+](Cc1ccccc1C(C)(C)C#N)C1(C)CCCC1	ZINC000489842395	332069734	/nfs/dbraw/zinc/06/97/34/332069734.db2.gz	IZRUXYOHNHPOIE-UHFFFAOYSA-N	1	0	270.420	4.252	20	30		CIEDRO
C=C(CC)C[N@@H+](CCC)[C@@H](C)C(=O)Nc1ccccc1C	ZINC000490043852	332078544	/nfs/dbraw/zinc/07/85/44/332078544.db2.gz	LEAHHSLQTXLOSD-INIZCTEOSA-N	1	0	288.435	4.000	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc2c(c1)CCCC2)c1ccc(C#N)cc1	ZINC000490572894	332092476	/nfs/dbraw/zinc/09/24/76/332092476.db2.gz	SQUFMVKDNBUUCR-HNNXBMFYSA-N	1	0	290.410	4.288	20	30		CIEDRO
N#CCN(Cc1cc(Cl)cc2cccnc21)C1CCCC1	ZINC000172570685	335109595	/nfs/dbraw/zinc/10/95/95/335109595.db2.gz	XAXBICCGBAATBI-UHFFFAOYSA-N	1	0	299.805	4.156	20	30		CIEDRO
C=C(C[NH2+]Cc1ccc2nc(C)sc2c1)c1ccccc1	ZINC000494316077	332469993	/nfs/dbraw/zinc/46/99/93/332469993.db2.gz	SVTXDAOCMOZCGW-UHFFFAOYSA-N	1	0	294.423	4.408	20	30		CIEDRO
CC[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000252403983	334379110	/nfs/dbraw/zinc/37/91/10/334379110.db2.gz	CAXLUBYVBRSBEU-FRFSOERESA-N	1	0	256.393	4.178	20	30		CIEDRO
CC(C)(C#N)CC[NH2+]C1(c2cccc(C(F)(F)F)c2)CC1	ZINC000553708109	334396173	/nfs/dbraw/zinc/39/61/73/334396173.db2.gz	CBLJBAAVUUUOMX-UHFFFAOYSA-N	1	0	296.336	4.224	20	30		CIEDRO
CC(C)[C@H](C)[NH2+]C1CCC(C#N)(c2ccccc2)CC1	ZINC000500022866	332597622	/nfs/dbraw/zinc/59/76/22/332597622.db2.gz	BKIVHOKUDWTORC-ZLPCBKJTSA-N	1	0	270.420	4.025	20	30		CIEDRO
Cc1ccc([C@@H](C)[NH2+]Cc2ccc(C#N)c(F)c2)c(C)c1	ZINC000404746857	332604166	/nfs/dbraw/zinc/60/41/66/332604166.db2.gz	FVCHERXJNKHFTO-CQSZACIVSA-N	1	0	282.362	4.165	20	30		CIEDRO
C=C[C@@H](C)[NH2+]C/C(C)=C/c1ccccc1C(F)(F)F	ZINC000500381179	332605832	/nfs/dbraw/zinc/60/58/32/332605832.db2.gz	FFCIIUJUGOHOME-LMMOQWNQSA-N	1	0	269.310	4.273	20	30		CIEDRO
C[C@H]1C[C@]1([NH2+]Cc1ccc(C#N)cc1)c1ccc(Cl)cc1	ZINC000500396041	332606291	/nfs/dbraw/zinc/60/62/91/332606291.db2.gz	IXHMOKABJLKQQL-SCLBCKFNSA-N	1	0	296.801	4.237	20	30		CIEDRO
CC[C@@H]1C[C@@]1([NH2+]Cc1ccc(C#N)cc1)c1cccc(C)c1	ZINC000500507731	332611839	/nfs/dbraw/zinc/61/18/39/332611839.db2.gz	KTCABFCQRYNLTC-QUCCMNQESA-N	1	0	290.410	4.282	20	30		CIEDRO
Cc1ccccc1[C@H]1C[C@H]([NH2+][C@@H](C)c2cccc(C#N)c2)C1	ZINC000500867781	332620743	/nfs/dbraw/zinc/62/07/43/332620743.db2.gz	XFFWUZTWLWMRHE-SNRMKQJTSA-N	1	0	290.410	4.464	20	30		CIEDRO
C=CCCCCC[NH+]1CCC(c2ccnn2CCC)CC1	ZINC000501556476	332635679	/nfs/dbraw/zinc/63/56/79/332635679.db2.gz	YJCOEVXAJVYDPE-UHFFFAOYSA-N	1	0	289.467	4.219	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H](C)c1nc2c(s1)CCC2	ZINC000502021677	332645591	/nfs/dbraw/zinc/64/55/91/332645591.db2.gz	ZIJBREPBKJPLGJ-VXGBXAGGSA-N	1	0	264.438	4.027	20	30		CIEDRO
CC(C)[C@H]([NH2+]CCCC(C)(C)C#N)c1ccc(F)cc1	ZINC000502487856	332663085	/nfs/dbraw/zinc/66/30/85/332663085.db2.gz	PWJARNJKSMYRIT-INIZCTEOSA-N	1	0	276.399	4.442	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@H]1CCCC(F)(F)C1)C1CC1	ZINC000502597498	332666921	/nfs/dbraw/zinc/66/69/21/332666921.db2.gz	VCGACLZAXZDPGC-GXTWGEPZSA-N	1	0	257.368	4.146	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+]CCc1cccc2[nH]ccc21	ZINC000503124676	332681966	/nfs/dbraw/zinc/68/19/66/332681966.db2.gz	UUQFNVPJKBNMJX-HNNXBMFYSA-N	1	0	256.393	4.045	20	30		CIEDRO
C[C@H]([NH2+]CCc1cccc(C#N)c1)c1ccc(Cl)cc1	ZINC000503557848	332691899	/nfs/dbraw/zinc/69/18/99/332691899.db2.gz	MFKDQVCBHZYMGQ-ZDUSSCGKSA-N	1	0	284.790	4.105	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+][C@H]1C[C@H](c2ccc(OC)c(F)c2)C1	ZINC000503856081	332696677	/nfs/dbraw/zinc/69/66/77/332696677.db2.gz	NAHGYYSPVRDWGP-XRGAULLZSA-N	1	0	291.410	4.271	20	30		CIEDRO
C=C(C)CN1CCC([NH2+][C@@H]2C[C@H](C)c3c2cccc3C)CC1	ZINC000504925969	332725363	/nfs/dbraw/zinc/72/53/63/332725363.db2.gz	GCLGNHAPDZFYNQ-QFBILLFUSA-N	1	0	298.474	4.173	20	30		CIEDRO
C=C(C)CN1CCC([NH2+][C@H]2C[C@H](C)c3c2cccc3C)CC1	ZINC000504925968	332725369	/nfs/dbraw/zinc/72/53/69/332725369.db2.gz	GCLGNHAPDZFYNQ-LPHOPBHVSA-N	1	0	298.474	4.173	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]Cc1ccc(C#N)cc1C(F)(F)F	ZINC000572621096	334867524	/nfs/dbraw/zinc/86/75/24/334867524.db2.gz	DASKOEUZERLZKQ-UHFFFAOYSA-N	1	0	296.336	4.269	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+][C@H](C)Cc1ccc(O)cc1	ZINC000511946195	332948633	/nfs/dbraw/zinc/94/86/33/332948633.db2.gz	ZOEBTGHKFNKCBG-HUUCEWRRSA-N	1	0	261.409	4.048	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+][C@@H](C)Cc1ccc(O)cc1	ZINC000511946193	332948620	/nfs/dbraw/zinc/94/86/20/332948620.db2.gz	ZOEBTGHKFNKCBG-CABCVRRESA-N	1	0	261.409	4.048	20	30		CIEDRO
C[C@@H]([NH2+]C/C=C/c1ccc(F)c(F)c1)c1ccc(C#N)cc1	ZINC000512103408	332953987	/nfs/dbraw/zinc/95/39/87/332953987.db2.gz	GDNZFHHZUQNMFL-YWVDXFKGSA-N	1	0	298.336	4.200	20	30		CIEDRO
C=CCCC[NH2+][C@H](C)c1cc(Br)ccc1F	ZINC000303987635	332964065	/nfs/dbraw/zinc/96/40/65/332964065.db2.gz	LONXKEKBSKTXET-SNVBAGLBSA-N	1	0	286.188	4.205	20	30		CIEDRO
Cc1cc(C)c(C[NH2+][C@H](C)c2ccc(C#N)cc2F)c(C)c1	ZINC000512627519	332976783	/nfs/dbraw/zinc/97/67/83/332976783.db2.gz	AEDBFKALNGKJPN-OAHLLOKOSA-N	1	0	296.389	4.473	20	30		CIEDRO
C[C@H]([NH2+][C@@H](C)c1ccc(C#N)cc1F)c1cccs1	ZINC000512641923	332977277	/nfs/dbraw/zinc/97/72/77/332977277.db2.gz	LEWMYCXTKFKPMQ-QWRGUYRKSA-N	1	0	274.364	4.171	20	30		CIEDRO
Cc1ccccc1C[C@H](C)[NH2+][C@H](C)c1ccc(C#N)cc1F	ZINC000512654001	332978036	/nfs/dbraw/zinc/97/80/36/332978036.db2.gz	IPFPMXCVDSTLLY-LSDHHAIUSA-N	1	0	296.389	4.288	20	30		CIEDRO
CC(C)(C#N)CCC[N@H+]1CC=C(c2ccc(F)cc2)CC1	ZINC000174812874	333007903	/nfs/dbraw/zinc/00/79/03/333007903.db2.gz	LKHDKCRNACNKHC-UHFFFAOYSA-N	1	0	286.394	4.245	20	30		CIEDRO
C[N@H+](CCCC(C)(C)C#N)Cc1cccc(C(F)(F)F)c1	ZINC000174822887	333008200	/nfs/dbraw/zinc/00/82/00/333008200.db2.gz	PXKKOGKBVFGHIK-UHFFFAOYSA-N	1	0	298.352	4.467	20	30		CIEDRO
CC1CCC([N@H+](CCCC(C)(C)C#N)C2CC2)CC1	ZINC000174823185	333008312	/nfs/dbraw/zinc/00/83/12/333008312.db2.gz	UVCWMPACABTZPR-UHFFFAOYSA-N	1	0	262.441	4.359	20	30		CIEDRO
CC[C@@H](C)[C@H](C)[N@H+](CCCC(C)(C)C#N)C1CC1	ZINC000174848431	333008736	/nfs/dbraw/zinc/00/87/36/333008736.db2.gz	PIUFLKPGJLWTMJ-KGLIPLIRSA-N	1	0	250.430	4.215	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+](Cc1ccc(F)cc1)CC1CC1	ZINC000174865107	333009291	/nfs/dbraw/zinc/00/92/91/333009291.db2.gz	JHCTZFWVEDTSQB-UHFFFAOYSA-N	1	0	288.410	4.368	20	30		CIEDRO
C[C@@H]1CC[N@H+](CCCC(C)(C)C#N)[C@H](c2ccco2)C1	ZINC000174882862	333009891	/nfs/dbraw/zinc/00/98/91/333009891.db2.gz	LWKMKFXYWTYCBA-CABCVRRESA-N	1	0	274.408	4.383	20	30		CIEDRO
C[C@@H]1C[C@H](c2ccccc2)[N@H+](Cc2cccc(C#N)c2F)C1	ZINC000513272935	333011824	/nfs/dbraw/zinc/01/18/24/333011824.db2.gz	UJZRIPBHXNOIFB-RDTXWAMCSA-N	1	0	294.373	4.280	20	30		CIEDRO
CC(C)(C)C[C@H]1CC[N@H+](CCCC(C)(C)C#N)C1	ZINC000307770433	333016248	/nfs/dbraw/zinc/01/62/48/333016248.db2.gz	FLFWILLGOLSSQA-CQSZACIVSA-N	1	0	250.430	4.074	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]C/C(C)=C/c1ccccc1COC	ZINC000513461394	333021045	/nfs/dbraw/zinc/02/10/45/333021045.db2.gz	LYQKEZQPHBJGAS-NKAIQICCSA-N	1	0	273.420	4.181	20	30		CIEDRO
C=C1CC[NH+](Cc2cnc(-c3ccc(C)cc3)s2)CC1	ZINC000513466518	333021374	/nfs/dbraw/zinc/02/13/74/333021374.db2.gz	GZERWKDEIZNRRO-UHFFFAOYSA-N	1	0	284.428	4.271	20	30		CIEDRO
Cc1ccccc1C1CC[NH+](Cc2cc(C#N)cs2)CC1	ZINC000513503104	333023185	/nfs/dbraw/zinc/02/31/85/333023185.db2.gz	LIBBQZDSIAWJKM-UHFFFAOYSA-N	1	0	296.439	4.308	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccc(C#N)c(F)c1)c1cccc(C)c1	ZINC000404759121	333025510	/nfs/dbraw/zinc/02/55/10/333025510.db2.gz	MRRPTAVTESQGLI-GOSISDBHSA-N	1	0	282.362	4.247	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CCCCc3ccccc32)cc1F	ZINC000404846269	333028943	/nfs/dbraw/zinc/02/89/43/333028943.db2.gz	OPRXKKINPXDQBQ-LJQANCHMSA-N	1	0	294.373	4.255	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H](c2ccc(F)cc2)C2CC2)cc1F	ZINC000404862577	333030647	/nfs/dbraw/zinc/03/06/47/333030647.db2.gz	XICUWEBPGUZAGD-SFHVURJKSA-N	1	0	298.336	4.077	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCOc1ccc(F)cc1)c1ccco1	ZINC000513673497	333031431	/nfs/dbraw/zinc/03/14/31/333031431.db2.gz	SLMBTVKCOPFMNR-INIZCTEOSA-N	1	0	289.350	4.095	20	30		CIEDRO
C=C[C@H](C)[NH2+][C@H](CC)c1ccc(OC(F)(F)F)cc1	ZINC000513703284	333033984	/nfs/dbraw/zinc/03/39/84/333033984.db2.gz	SRWIJZYVDRAOEC-GXFFZTMASA-N	1	0	273.298	4.200	20	30		CIEDRO
C=CCOc1ccc(CN(CCC#N)CCC(C)C)cc1	ZINC000513718449	333035193	/nfs/dbraw/zinc/03/51/93/333035193.db2.gz	YQQZXWIFOFPIPX-UHFFFAOYSA-N	1	0	286.419	4.013	20	30		CIEDRO
C=C[C@H](C)[NH2+][C@@H](C)c1cc(C)c(Br)s1	ZINC000308599950	333035923	/nfs/dbraw/zinc/03/59/23/333035923.db2.gz	ALMIMPKITGVGDB-IUCAKERBSA-N	1	0	274.227	4.044	20	30		CIEDRO
C=C[C@H](C)[NH2+][C@H](C)c1cc(C)c(Br)s1	ZINC000308599949	333035951	/nfs/dbraw/zinc/03/59/51/333035951.db2.gz	ALMIMPKITGVGDB-DTWKUNHWSA-N	1	0	274.227	4.044	20	30		CIEDRO
CC(C)CCN(CCC#N)Cc1ccc(OC(C)C)cc1	ZINC000513741845	333036977	/nfs/dbraw/zinc/03/69/77/333036977.db2.gz	QYBLWOISDBTOGW-UHFFFAOYSA-N	1	0	288.435	4.236	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccccc1COC)c1ccco1	ZINC000513755185	333037662	/nfs/dbraw/zinc/03/76/62/333037662.db2.gz	QKTPVTUANVNNKO-KRWDZBQOSA-N	1	0	285.387	4.223	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1cc(F)cc(F)c1)c1ccco1	ZINC000513759841	333038019	/nfs/dbraw/zinc/03/80/19/333038019.db2.gz	HDXLZBJOMSJQIX-OAHLLOKOSA-N	1	0	277.314	4.355	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@@H]1CCc2c1cccc2F	ZINC000513870805	333045185	/nfs/dbraw/zinc/04/51/85/333045185.db2.gz	GIFBOOYXRIAGFZ-GOSISDBHSA-N	1	0	297.373	4.168	20	30		CIEDRO
C=CCN1CCC([NH2+][C@@H](C)c2ccc3ccccc3c2)CC1	ZINC000177313376	333057496	/nfs/dbraw/zinc/05/74/96/333057496.db2.gz	PQFRUVJLYNQUGE-INIZCTEOSA-N	1	0	294.442	4.141	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)CCC(C)(C)C)c1ccc(C#N)cc1	ZINC000311446016	333068719	/nfs/dbraw/zinc/06/87/19/333068719.db2.gz	KECWJQOSURYDFH-UONOGXRCSA-N	1	0	258.409	4.424	20	30		CIEDRO
CC[C@H](CSc1ccc(Cl)cc1)[NH2+]CCCCC#N	ZINC000178648997	333076342	/nfs/dbraw/zinc/07/63/42/333076342.db2.gz	XNFYQCWQZYJHQO-CQSZACIVSA-N	1	0	296.867	4.494	20	30		CIEDRO
C[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(C#N)cc1C(F)(F)F	ZINC000516941484	333087135	/nfs/dbraw/zinc/08/71/35/333087135.db2.gz	NHYDEXHKTQDSLP-ABAIWWIYSA-N	1	0	296.336	4.245	20	30		CIEDRO
N#CCc1ccc(C[NH2+]C2(c3ccc(Cl)cc3)CC2)cc1	ZINC000564147351	333113199	/nfs/dbraw/zinc/11/31/99/333113199.db2.gz	HJYYQIQYGURLOL-UHFFFAOYSA-N	1	0	296.801	4.185	20	30		CIEDRO
C=C(C)CN(CC)[C@H](C)c1nc(-c2ccccc2C)no1	ZINC000152535943	333113447	/nfs/dbraw/zinc/11/34/47/333113447.db2.gz	YHJPAHWEXGZZNH-CQSZACIVSA-N	1	0	285.391	4.004	20	30		CIEDRO
CC[NH+](CC)Cc1cccc(N[C@H]2CCC[C@@H](C#N)C2)c1	ZINC000185726808	333147458	/nfs/dbraw/zinc/14/74/58/333147458.db2.gz	MLORMHOTUORSHY-WBVHZDCISA-N	1	0	285.435	4.023	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1cccc(C(F)(F)F)c1	ZINC000185763541	333148265	/nfs/dbraw/zinc/14/82/65/333148265.db2.gz	MUZOHDMLIVFTPS-HUBLWGQQSA-N	1	0	296.336	4.438	20	30		CIEDRO
COc1ccc([C@H]([NH2+][C@H]2CCC[C@H](C#N)C2)C(C)C)cc1	ZINC000185761487	333148272	/nfs/dbraw/zinc/14/82/72/333148272.db2.gz	JRQJSRSSZGACGE-QILLFSRXSA-N	1	0	286.419	4.064	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+]Cc2ccccc2OC2CCCC2)C1	ZINC000185786470	333148693	/nfs/dbraw/zinc/14/86/93/333148693.db2.gz	IDUKSHWOJKIUHH-NVXWUHKLSA-N	1	0	298.430	4.180	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+]CCc2cccc3ccccc32)C1	ZINC000185819668	333149632	/nfs/dbraw/zinc/14/96/32/333149632.db2.gz	QMIOFWCZSCZOAG-QAPCUYQASA-N	1	0	278.399	4.054	20	30		CIEDRO
CC(C)[C@H](Cc1ccc(F)cc1)[NH2+][C@H]1CCC[C@H](C#N)C1	ZINC000185846739	333150085	/nfs/dbraw/zinc/15/00/85/333150085.db2.gz	OURNWESXJINHCQ-SZMVWBNQSA-N	1	0	288.410	4.065	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+]CC2(Cc3ccccc3)CCC2)C1	ZINC000185860414	333150239	/nfs/dbraw/zinc/15/02/39/333150239.db2.gz	FPIAMMLPFPRFEE-ROUUACIJSA-N	1	0	282.431	4.071	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)c1ccccc1	ZINC000185867065	333150685	/nfs/dbraw/zinc/15/06/85/333150685.db2.gz	UYIKUEXGJGQVBI-JQHSSLGASA-N	1	0	268.404	4.366	20	30		CIEDRO
C=C(C)[C@H]([NH2+][C@H](C)c1ccncc1)c1ccc(F)c(F)c1	ZINC000186451466	333161086	/nfs/dbraw/zinc/16/10/86/333161086.db2.gz	UVMJPQDIHVXTKC-PXAZEXFGSA-N	1	0	288.341	4.328	20	30		CIEDRO
C=C(C)[C@H]([NH2+][C@@H]1CCCSC1)c1ccc(F)c(F)c1	ZINC000186453548	333161390	/nfs/dbraw/zinc/16/13/90/333161390.db2.gz	OYEQYSNKVSTZMH-DOMZBBRYSA-N	1	0	283.387	4.067	20	30		CIEDRO
CC[C@H](Cc1ccccc1)[N@H+](C)Cc1ccc(CC#N)cc1	ZINC000521600601	333179602	/nfs/dbraw/zinc/17/96/02/333179602.db2.gz	MVYVPSINXGHJPV-HXUWFJFHSA-N	1	0	292.426	4.206	20	30		CIEDRO
C=CC[N@H+](Cc1ccccc1)[C@@H](C)c1cccs1	ZINC000521815682	333189414	/nfs/dbraw/zinc/18/94/14/333189414.db2.gz	USNNHAKYMTVNOB-AWEZNQCLSA-N	1	0	257.402	4.497	20	30		CIEDRO
C=CCOc1cccc(C[NH2+]CCSc2ccccc2)c1	ZINC000521821062	333190293	/nfs/dbraw/zinc/19/02/93/333190293.db2.gz	XDFNVMITAVYQBV-UHFFFAOYSA-N	1	0	299.439	4.133	20	30		CIEDRO
CC(C)(C#N)CCC[NH2+][C@H]1CCC[C@H]1Cc1ccccc1	ZINC000191366038	333218843	/nfs/dbraw/zinc/21/88/43/333218843.db2.gz	AMLPORNBOOYUNG-ROUUACIJSA-N	1	0	284.447	4.317	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H](C)c1cnn(C(C)(C)C)c1C	ZINC000191414097	333219193	/nfs/dbraw/zinc/21/91/93/333219193.db2.gz	VOZKDZWIWYFYBV-ZIAGYGMSSA-N	1	0	277.456	4.342	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](C)c1cnn(C(C)(C)C)c1C	ZINC000191414064	333219302	/nfs/dbraw/zinc/21/93/02/333219302.db2.gz	VOZKDZWIWYFYBV-UONOGXRCSA-N	1	0	277.456	4.342	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@@H](C)c1cnn(C(C)C)c1C	ZINC000191414044	333219409	/nfs/dbraw/zinc/21/94/09/333219409.db2.gz	XFFHTHBLLSHFLA-KGLIPLIRSA-N	1	0	263.429	4.168	20	30		CIEDRO
C=CCCCCC[N@@H+]1CCC[C@H](c2nccs2)C1	ZINC000193324814	333248086	/nfs/dbraw/zinc/24/80/86/333248086.db2.gz	MMVBPAGQNKQMNK-AWEZNQCLSA-N	1	0	264.438	4.069	20	30		CIEDRO
CCC1(C)CC[NH+]([C@@H](C)c2ccc(C#N)cc2)CC1	ZINC000522832951	333296326	/nfs/dbraw/zinc/29/63/26/333296326.db2.gz	AYZBNBBLLVWEBC-AWEZNQCLSA-N	1	0	256.393	4.131	20	30		CIEDRO
C=C1CC[NH+](CCCc2cccc3ccccc32)CC1	ZINC000523020137	333305062	/nfs/dbraw/zinc/30/50/62/333305062.db2.gz	XVCJVDKZXOUDJS-UHFFFAOYSA-N	1	0	265.400	4.424	20	30		CIEDRO
C[C@@H]([NH2+]CC(C)(C)CCC#N)c1ccc(Cl)cc1	ZINC000229670767	333307335	/nfs/dbraw/zinc/30/73/35/333307335.db2.gz	RGFCCMCOYSSVHX-GFCCVEGCSA-N	1	0	264.800	4.321	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H]1CCSc2ccc(F)cc21	ZINC000229677993	333307602	/nfs/dbraw/zinc/30/76/02/333307602.db2.gz	FRKMYBSLHMJYMB-AWEZNQCLSA-N	1	0	292.423	4.282	20	30		CIEDRO
CC(C)[C@H]([NH2+]CC(C)(C)CCC#N)c1ccccc1	ZINC000229677843	333307649	/nfs/dbraw/zinc/30/76/49/333307649.db2.gz	AIKXDCXTLUKSQV-INIZCTEOSA-N	1	0	258.409	4.303	20	30		CIEDRO
C[C@H]([NH2+]CC(C)(C)CCC#N)c1ccccc1OC(F)F	ZINC000229684228	333307746	/nfs/dbraw/zinc/30/77/46/333307746.db2.gz	NSQQUZOGJCMVOT-LBPRGKRZSA-N	1	0	296.361	4.269	20	30		CIEDRO
CC(C)[C@H]1CCCC[C@@H]1[NH2+]CC(C)(C)CCC#N	ZINC000229700931	333308005	/nfs/dbraw/zinc/30/80/05/333308005.db2.gz	HISDNAPRWIXAKL-CABCVRRESA-N	1	0	250.430	4.121	20	30		CIEDRO
Cc1ccc([C@H](C)[NH2+]CC(C)(C)CCC#N)c(C)c1	ZINC000229690249	333308060	/nfs/dbraw/zinc/30/80/60/333308060.db2.gz	OLCDGLYUKQLNOA-HNNXBMFYSA-N	1	0	258.409	4.284	20	30		CIEDRO
C=CCCOCC[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1	ZINC000229860375	333310274	/nfs/dbraw/zinc/31/02/74/333310274.db2.gz	DXPGDPYFYQSPRF-NSHDSACASA-N	1	0	288.218	4.237	20	30		CIEDRO
C=CCCOCC[NH2+][C@@H](C)c1ccc2ccccc2c1	ZINC000229860556	333310280	/nfs/dbraw/zinc/31/02/80/333310280.db2.gz	IVVOVPRCBCTIRM-HNNXBMFYSA-N	1	0	269.388	4.083	20	30		CIEDRO
C=CCCOCC[NH2+][C@H](C)c1ccc(Cl)c(Cl)c1	ZINC000229860382	333310312	/nfs/dbraw/zinc/31/03/12/333310312.db2.gz	DXPGDPYFYQSPRF-LLVKDONJSA-N	1	0	288.218	4.237	20	30		CIEDRO
C=CC1CC[NH+]([C@H](C)c2ccc(F)c(Cl)c2)CC1	ZINC000523610278	333334113	/nfs/dbraw/zinc/33/41/13/333334113.db2.gz	JZOFGHQCYAADDN-LLVKDONJSA-N	1	0	267.775	4.438	20	30		CIEDRO
CC(C)[C@H]1CCC[N@H+](CCCCC(C)(C)C#N)CC1	ZINC000232741892	333341982	/nfs/dbraw/zinc/34/19/82/333341982.db2.gz	YPPBXYDREBGBKJ-INIZCTEOSA-N	1	0	264.457	4.465	20	30		CIEDRO
C=CC[C@@H](C)[NH2+]Cc1ccc(-c2c(F)cccc2F)o1	ZINC000523975537	333350516	/nfs/dbraw/zinc/35/05/16/333350516.db2.gz	BAHJNUJUQRCWKW-LLVKDONJSA-N	1	0	277.314	4.279	20	30		CIEDRO
Cc1cc([C@H](C)[NH2+]CCCCC(C)(C)C#N)c(C)o1	ZINC000235506590	333370136	/nfs/dbraw/zinc/37/01/36/333370136.db2.gz	OZZFLRDVVBJBPB-ZDUSSCGKSA-N	1	0	262.397	4.267	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H]2CCCc3ccccc32)cc1	ZINC000236684494	333374668	/nfs/dbraw/zinc/37/46/68/333374668.db2.gz	MMLRTXBFOHKHBM-FQEVSTJZSA-N	1	0	293.410	4.419	20	30		CIEDRO
CCC[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(C#N)cc1	ZINC000236887545	333376163	/nfs/dbraw/zinc/37/61/63/333376163.db2.gz	RJDRZGZOZVQJQJ-IBGZPJMESA-N	1	0	278.399	4.059	20	30		CIEDRO
C[C@H]([NH2+]C[C@@H]1CCCc2ccccc21)c1ccc(C#N)cc1	ZINC000315874117	333384260	/nfs/dbraw/zinc/38/42/60/333384260.db2.gz	PYLJFIIQQVUNNH-KXBFYZLASA-N	1	0	290.410	4.329	20	30		CIEDRO
C=CCC[N@H+]1CCC[C@@H]1c1cccc(Br)c1	ZINC000524811457	333388751	/nfs/dbraw/zinc/38/87/51/333388751.db2.gz	KBTPCHOHQXLWSO-CQSZACIVSA-N	1	0	280.209	4.162	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H](C)c2ccccc2F)cc1	ZINC000037493818	333533847	/nfs/dbraw/zinc/53/38/47/333533847.db2.gz	AFNTYQUJSYETRD-CQSZACIVSA-N	1	0	285.362	4.241	20	30		CIEDRO
N#Cc1cccc(C[NH2+]C2CC(c3cccc(Cl)c3)C2)c1	ZINC000037748852	333537513	/nfs/dbraw/zinc/53/75/13/333537513.db2.gz	SBDXASFTCJSGGZ-UHFFFAOYSA-N	1	0	296.801	4.247	20	30		CIEDRO
CCC[NH2+][C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000038070536	333544674	/nfs/dbraw/zinc/54/46/74/333544674.db2.gz	UHEQCABKHPKUDP-AWEZNQCLSA-N	1	0	264.372	4.286	20	30		CIEDRO
CC1(C)C[C@@H]1C[NH2+]C1CCC(C#N)(c2ccccc2)CC1	ZINC000537974207	333552795	/nfs/dbraw/zinc/55/27/95/333552795.db2.gz	QSWKWEYQTFSKOA-LRYGQEGESA-N	1	0	282.431	4.026	20	30		CIEDRO
C=C(C)COCC[NH2+][C@H](C)c1cccc2ccccc21	ZINC000125631207	333568594	/nfs/dbraw/zinc/56/85/94/333568594.db2.gz	KBULAKKUTAAPFH-OAHLLOKOSA-N	1	0	269.388	4.083	20	30		CIEDRO
C=C(C)COCC[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1	ZINC000125631412	333568604	/nfs/dbraw/zinc/56/86/04/333568604.db2.gz	LLCVBQQRQYLXLP-NSHDSACASA-N	1	0	288.218	4.237	20	30		CIEDRO
C=CCCC[NH2+][C@@H](CC(F)(F)F)c1ccc(F)cc1	ZINC000538175941	333577654	/nfs/dbraw/zinc/57/76/54/333577654.db2.gz	GZUXCSSQEYFIRX-ZDUSSCGKSA-N	1	0	275.289	4.375	20	30		CIEDRO
C[C@@H]([NH2+]CC#Cc1ccccc1Cl)c1ccccc1	ZINC000538199956	333579142	/nfs/dbraw/zinc/57/91/42/333579142.db2.gz	NDWSZXUMHZDMBL-CQSZACIVSA-N	1	0	269.775	4.042	20	30		CIEDRO
CCC(CC)[C@@H](CC[NH2+][C@H](C)c1ccc(C#N)cc1)OC	ZINC000538407990	333589251	/nfs/dbraw/zinc/58/92/51/333589251.db2.gz	PTVCYXZELXDSTE-RDTXWAMCSA-N	1	0	288.435	4.050	20	30		CIEDRO
N#Cc1ccc(C[NH2+]CCCCC2CCCC2)s1	ZINC000538418479	333591318	/nfs/dbraw/zinc/59/13/18/333591318.db2.gz	KQLWEHQBDXMTEO-UHFFFAOYSA-N	1	0	262.422	4.070	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@@H](C)[C@@H](OC)c1ccc(F)cc1	ZINC000539067523	333654670	/nfs/dbraw/zinc/65/46/70/333654670.db2.gz	VTXOHVCSSOVFHH-RRQGHBQHSA-N	1	0	279.399	4.236	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@@H](C)c1ccncc1CC	ZINC000539214644	333660461	/nfs/dbraw/zinc/66/04/61/333660461.db2.gz	RZYCYZSCFCDAOS-HOCLYGCPSA-N	1	0	260.425	4.430	20	30		CIEDRO
Cc1[nH]c2ccc(C[NH2+]Cc3ccc(C#N)s3)cc2c1C	ZINC000539469367	333672802	/nfs/dbraw/zinc/67/28/02/333672802.db2.gz	MIRDAPFERNQQEZ-UHFFFAOYSA-N	1	0	295.411	4.008	20	30		CIEDRO
C[C@H]([NH2+]CC(C)(C)c1ccccc1F)c1ccc(C#N)cc1	ZINC000539495307	333673987	/nfs/dbraw/zinc/67/39/87/333673987.db2.gz	LLLZYSSFKXDDQL-AWEZNQCLSA-N	1	0	296.389	4.326	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H]1CC2(CCCC2)Oc2ccccc21	ZINC000540170454	333717187	/nfs/dbraw/zinc/71/71/87/333717187.db2.gz	LZZHJCBZMWSOKW-ZBFHGGJFSA-N	1	0	271.404	4.377	20	30		CIEDRO
C=CCCC[C@@H](C)[NH+]1CCC(OCCCC)CC1	ZINC000540346287	333726559	/nfs/dbraw/zinc/72/65/59/333726559.db2.gz	KISMDKSPPQQTOG-OAHLLOKOSA-N	1	0	253.430	4.012	20	30		CIEDRO
N#CC1(C[NH+]2CCC(c3cccc4ccccc43)CC2)CC1	ZINC000540552653	333735036	/nfs/dbraw/zinc/73/50/36/333735036.db2.gz	WWVPIQYVRZHEON-UHFFFAOYSA-N	1	0	290.410	4.323	20	30		CIEDRO
CC[C@@H](C[NH2+][C@@H](C)c1cccc(C#N)c1)c1ccccc1	ZINC000540597740	333737076	/nfs/dbraw/zinc/73/70/76/333737076.db2.gz	WMPNLPVRNLIIOV-RDJZCZTQSA-N	1	0	278.399	4.403	20	30		CIEDRO
CCCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(C#N)s1	ZINC000540601672	333737231	/nfs/dbraw/zinc/73/72/31/333737231.db2.gz	ALAOYZDIEIMYKZ-DOMZBBRYSA-N	1	0	262.422	4.068	20	30		CIEDRO
C[C@@]1([NH2+]Cc2ccc(F)cc2C#N)CCCc2ccccc21	ZINC000540907130	333752734	/nfs/dbraw/zinc/75/27/34/333752734.db2.gz	ICQBHVLZACYMMK-LJQANCHMSA-N	1	0	294.373	4.039	20	30		CIEDRO
CC(C)(C#N)CC[NH2+][C@@H](c1ccc(Cl)cc1)C1CC1	ZINC000541206050	333765083	/nfs/dbraw/zinc/76/50/83/333765083.db2.gz	ZRPLLDQFBJAHCK-OAHLLOKOSA-N	1	0	276.811	4.321	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](C)c1ccc(F)cc1Br	ZINC000129634328	333784221	/nfs/dbraw/zinc/78/42/21/333784221.db2.gz	JGTWAFJGWZNNGG-ZJUUUORDSA-N	1	0	286.188	4.203	20	30		CIEDRO
C=CCC[C@@H](C)Nc1cccc(C[NH+](CC)CC)c1	ZINC000130608884	333858279	/nfs/dbraw/zinc/85/82/79/333858279.db2.gz	WSRHTJYEPVHDQX-OAHLLOKOSA-N	1	0	260.425	4.295	20	30		CIEDRO
CCOc1cc(Cl)ccc1C[NH2+]CC(C)(C)CCC#N	ZINC000130616164	333859059	/nfs/dbraw/zinc/85/90/59/333859059.db2.gz	KVTTVZACLZZQAU-UHFFFAOYSA-N	1	0	294.826	4.158	20	30		CIEDRO
CC(C)C[C@@H]([NH2+]CCCSCC#N)c1cccs1	ZINC000543487917	333877644	/nfs/dbraw/zinc/87/76/44/333877644.db2.gz	WLJNKJMLMHOHHZ-CYBMUJFWSA-N	1	0	282.478	4.072	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+]C[C@H](C)CSc1ccccc1OC	ZINC000544576257	333937086	/nfs/dbraw/zinc/93/70/86/333937086.db2.gz	NQKCRNLEIUEAJS-LSDHHAIUSA-N	1	0	293.476	4.368	20	30		CIEDRO
C[C@@H]([NH2+]C1CC(c2ccccc2)C1)c1cccc(C#N)c1	ZINC000545981961	334010304	/nfs/dbraw/zinc/01/03/04/334010304.db2.gz	AWQKDZSZMMXNCI-FTXHTYHOSA-N	1	0	276.383	4.155	20	30		CIEDRO
Cc1ccc2[nH+]ccc(N(C)Cc3ccc(C#N)cc3)c2c1	ZINC000546190944	334019138	/nfs/dbraw/zinc/01/91/38/334019138.db2.gz	OGMGROMOVYXQFS-UHFFFAOYSA-N	1	0	287.366	4.051	20	30		CIEDRO
CC[C@H](CC(F)(F)F)[NH2+][C@@H](C)c1ccc(C#N)c(F)c1	ZINC000546870546	334052561	/nfs/dbraw/zinc/05/25/61/334052561.db2.gz	JFUOHIGEXIYXFQ-JOYOIKCWSA-N	1	0	288.288	4.079	20	30		CIEDRO
CCCC[C@@H]1CCC[C@@H]1[NH2+]Cc1cc(C#N)cs1	ZINC000236865252	334075736	/nfs/dbraw/zinc/07/57/36/334075736.db2.gz	LYWFANZOVQAFJK-HIFRSBDPSA-N	1	0	262.422	4.068	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1cc(C#N)cs1)C(C)(C)c1ccccc1	ZINC000237001205	334079179	/nfs/dbraw/zinc/07/91/79/334079179.db2.gz	XFEMHBLRZFOPMF-QGZVFWFLSA-N	1	0	298.455	4.466	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)o1)c1cc2ccccc2s1	ZINC000237587785	334091982	/nfs/dbraw/zinc/09/19/82/334091982.db2.gz	QGPZBQPRFYEWAT-NSHDSACASA-N	1	0	282.368	4.217	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000134732236	334102116	/nfs/dbraw/zinc/10/21/16/334102116.db2.gz	ROZHCURAOPDBRV-WDEREUQCSA-N	1	0	257.299	4.321	20	30		CIEDRO
C=CC[C@H](C)[NH2+]Cc1cc(-c2ccccc2)cs1	ZINC000134749586	334102896	/nfs/dbraw/zinc/10/28/96/334102896.db2.gz	NCBMUTWNUAPWSB-ZDUSSCGKSA-N	1	0	257.402	4.469	20	30		CIEDRO
C=CC[C@H](C)[NH2+]Cc1ccc(OCCCCC)cc1	ZINC000134749005	334103003	/nfs/dbraw/zinc/10/30/03/334103003.db2.gz	AHHXECORDSOFMM-HNNXBMFYSA-N	1	0	261.409	4.310	20	30		CIEDRO
C[C@H](CC#N)[N@H+](C)CC1CCC(c2ccccc2)CC1	ZINC000547749013	334114411	/nfs/dbraw/zinc/11/44/11/334114411.db2.gz	RQZAOVLFJRNRDN-KLHKWILBSA-N	1	0	270.420	4.194	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(C#N)o1)c1ccc(Cl)cc1	ZINC000135142782	334117534	/nfs/dbraw/zinc/11/75/34/334117534.db2.gz	UDDZDVVOKPWOPU-HNNXBMFYSA-N	1	0	274.751	4.046	20	30		CIEDRO
CSCC[C@H](C)[N@H+](C)Cc1ccccc1C(C)(C)C#N	ZINC000135240519	334121389	/nfs/dbraw/zinc/12/13/89/334121389.db2.gz	CLEORTIINNPQPF-AWEZNQCLSA-N	1	0	290.476	4.061	20	30		CIEDRO
C[C@H]([N@H+](C)Cc1ccccc1C(C)(C)C#N)C1(C)CC1	ZINC000135281077	334123441	/nfs/dbraw/zinc/12/34/41/334123441.db2.gz	BNPZJOJPBUMOIH-AWEZNQCLSA-N	1	0	270.420	4.108	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCc2cc(F)ccc21)c1ccc(C#N)cc1	ZINC000135363181	334127710	/nfs/dbraw/zinc/12/77/10/334127710.db2.gz	FBHPRNHYEZSXSC-KPZWWZAWSA-N	1	0	280.346	4.035	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)c1ccc2cc(OC)ccc2c1	ZINC000135365840	334127728	/nfs/dbraw/zinc/12/77/28/334127728.db2.gz	VXTYIMOTGUAPKM-UONOGXRCSA-N	1	0	269.388	4.464	20	30		CIEDRO
C[C@@H]1CCN(CCC#N)[C@@H]1c1ccc(C(F)(F)F)cc1	ZINC000135395094	334128493	/nfs/dbraw/zinc/12/84/93/334128493.db2.gz	RVGCMNHKTJJCOO-RISCZKNCSA-N	1	0	282.309	4.002	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C#N)s1)c1ccccc1Cl	ZINC000135667171	334135581	/nfs/dbraw/zinc/13/55/81/334135581.db2.gz	OCEWDNLBLMOYLH-SNVBAGLBSA-N	1	0	276.792	4.124	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)s1)c1ccc2c(c1)CCCC2	ZINC000135671747	334135886	/nfs/dbraw/zinc/13/58/86/334135886.db2.gz	WFFYBZNPHBUYBL-ZDUSSCGKSA-N	1	0	296.439	4.349	20	30		CIEDRO
C[C@H](C1CCCCC1)[N@H+](C)Cc1ccc(CC#N)cc1	ZINC000549161328	334186813	/nfs/dbraw/zinc/18/68/13/334186813.db2.gz	BSGYGRDEUVYKFM-OAHLLOKOSA-N	1	0	270.420	4.153	20	30		CIEDRO
Cc1cc(C[NH2+]C[C@]2(C)C[C@H]2c2ccccc2)ccc1C#N	ZINC000549859682	334206880	/nfs/dbraw/zinc/20/68/80/334206880.db2.gz	ZCJAIVBLEMXMCO-PMACEKPBSA-N	1	0	290.410	4.150	20	30		CIEDRO
C=CCOCC[NH2+][C@H](c1cccs1)C(CC)CC	ZINC000549927838	334209449	/nfs/dbraw/zinc/20/94/49/334209449.db2.gz	GPGRTJURWDZAPS-HNNXBMFYSA-N	1	0	267.438	4.018	20	30		CIEDRO
CC(C)c1ccc(C[C@@H]2CC[N@@H+]([C@H]3CC[C@@H](C#N)C3)C2)cc1	ZINC000549938630	334209802	/nfs/dbraw/zinc/20/98/02/334209802.db2.gz	BCGNNRJESKGSHW-HBFSDRIKSA-N	1	0	296.458	4.367	20	30		CIEDRO
CC[N@H+](CC1(C)CCC1)[C@H](C)c1ccc(C#N)cc1	ZINC000550711514	334227624	/nfs/dbraw/zinc/22/76/24/334227624.db2.gz	XWGZWCBCWQVMPC-CQSZACIVSA-N	1	0	256.393	4.131	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H]1CCCc2c(O)cccc21	ZINC000550933359	334234181	/nfs/dbraw/zinc/23/41/81/334234181.db2.gz	RBEMGPQSGZDNHI-XJKSGUPXSA-N	1	0	259.393	4.104	20	30		CIEDRO
C[C@@H]([NH2+]CCC(C)(C)C1CC1)c1ccc(C#N)c(F)c1	ZINC000551297994	334245592	/nfs/dbraw/zinc/24/55/92/334245592.db2.gz	GRKGGQRKFOFWNC-GFCCVEGCSA-N	1	0	274.383	4.174	20	30		CIEDRO
CC(C)c1ccc2c(c1)[C@H]([NH2+]C[C@H](C#N)CCC#N)CCC2	ZINC000551527491	334252556	/nfs/dbraw/zinc/25/25/56/334252556.db2.gz	AHGZWPJDKMCBLN-HNAYVOBHSA-N	1	0	295.430	4.221	20	30		CIEDRO
Cc1ccccc1C[C@H](C)[NH2+]C1(c2cccc(C#N)c2)CC1	ZINC000551577148	334254933	/nfs/dbraw/zinc/25/49/33/334254933.db2.gz	UOMCNSIENPUDKE-INIZCTEOSA-N	1	0	290.410	4.077	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)[C@H](C)c1nc2ccccc2s1	ZINC000246400074	334256270	/nfs/dbraw/zinc/25/62/70/334256270.db2.gz	LPKCHAPYNAVLRA-RWMBFGLXSA-N	1	0	274.433	4.343	20	30		CIEDRO
C[C@@H]1CC[N@H+](Cc2cc(C#N)cs2)[C@H]2CCCC[C@H]12	ZINC000551974509	334268561	/nfs/dbraw/zinc/26/85/61/334268561.db2.gz	BTXBUDWPGWHJKJ-WQVCFCJDSA-N	1	0	274.433	4.020	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CC1(C)CCC(OC)CC1)c1ccco1	ZINC000552057498	334282448	/nfs/dbraw/zinc/28/24/48/334282448.db2.gz	XGURNXSMUXUXJZ-UPTPFMHGSA-N	1	0	291.435	4.472	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@H]1CCC(F)(F)C1)c1ccco1	ZINC000552056175	334282553	/nfs/dbraw/zinc/28/25/53/334282553.db2.gz	VQBZAKVVJWMMGJ-QWHCGFSZSA-N	1	0	269.335	4.312	20	30		CIEDRO
C=CCC[C@H]([NH2+]CC1CCC(OC)CC1)c1ccco1	ZINC000552246152	334307771	/nfs/dbraw/zinc/30/77/71/334307771.db2.gz	KKJKWZFACNQNCJ-GPANFISMSA-N	1	0	277.408	4.082	20	30		CIEDRO
N#Cc1ccc(C[N@@H+]2CCC[C@@H](c3ccccc3)C2)c(F)c1	ZINC000552274506	334311160	/nfs/dbraw/zinc/31/11/60/334311160.db2.gz	XRHFMZRLENLPOY-QGZVFWFLSA-N	1	0	294.373	4.077	20	30		CIEDRO
CCC[C@H]1[C@H](C)CCC[N@@H+]1CC(C)(C)CCC#N	ZINC000552301443	334314981	/nfs/dbraw/zinc/31/49/81/334314981.db2.gz	BZNHVAOOQBCQKT-CABCVRRESA-N	1	0	250.430	4.217	20	30		CIEDRO
N#Cc1ccc(C[N@H+]2CC[C@@H](c3cccc(Cl)c3)C2)cc1	ZINC000552316871	334316188	/nfs/dbraw/zinc/31/61/88/334316188.db2.gz	QDZFFQJEUCMELC-QGZVFWFLSA-N	1	0	296.801	4.201	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)c1ccc(Cl)cc1	ZINC000248840473	334319340	/nfs/dbraw/zinc/31/93/40/334319340.db2.gz	NRHOXFCUPBXHGG-ZOWXZIJZSA-N	1	0	262.784	4.073	20	30		CIEDRO
CCC[C@H](Cc1ccccc1)[NH2+][C@H]1CCC[C@@H](C#N)C1	ZINC000248850901	334319767	/nfs/dbraw/zinc/31/97/67/334319767.db2.gz	OSGLQAMONNNPHS-KURKYZTESA-N	1	0	270.420	4.070	20	30		CIEDRO
C=CC[C@@H](C)[C@H](C)[NH2+][C@@H](C)c1ccc(F)cc1F	ZINC000552582790	334337777	/nfs/dbraw/zinc/33/77/77/334337777.db2.gz	XCTRFDZGHIYZTG-WOPDTQHZSA-N	1	0	253.336	4.216	20	30		CIEDRO
CC[C@@H](C)[C@H](C)[N@H+](Cc1ccc(F)cc1C#N)C1CC1	ZINC000552594288	334338487	/nfs/dbraw/zinc/33/84/87/334338487.db2.gz	LPRUQBIZLQWZFL-OLZOCXBDSA-N	1	0	274.383	4.096	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)c1cccc(OC(F)(F)F)c1	ZINC000553075473	334360102	/nfs/dbraw/zinc/36/01/02/334360102.db2.gz	OOKNDECHIIQQFD-NSHDSACASA-N	1	0	273.298	4.202	20	30		CIEDRO
CC[C@@H]1CCC[C@H]([NH2+][C@H](C)c2cccc(C#N)c2)C1	ZINC000251929357	334372269	/nfs/dbraw/zinc/37/22/69/334372269.db2.gz	ZBPQMCLGISOCJQ-CPUCHLNUSA-N	1	0	256.393	4.178	20	30		CIEDRO
C[C@H](CCc1ccco1)[NH2+][C@H]1CCCc2cc(C#N)ccc21	ZINC000553305607	334375784	/nfs/dbraw/zinc/37/57/84/334375784.db2.gz	WIMCQXRFPUOBRN-KUHUBIRLSA-N	1	0	294.398	4.140	20	30		CIEDRO
C=C(C)CN1CCC([NH2+][C@H](c2ccc(C)cc2)C2CC2)CC1	ZINC000091334271	334376509	/nfs/dbraw/zinc/37/65/09/334376509.db2.gz	GSCLYQZSSVTNFQ-HXUWFJFHSA-N	1	0	298.474	4.076	20	30		CIEDRO
C=C(C)CN1CCC([NH2+][C@@H](c2ccccc2)C(C)C)CC1	ZINC000091334285	334376591	/nfs/dbraw/zinc/37/65/91/334376591.db2.gz	CGZJWOZQLJEDJP-LJQANCHMSA-N	1	0	286.463	4.014	20	30		CIEDRO
C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1ccc(C#N)cc1	ZINC000252257138	334377872	/nfs/dbraw/zinc/37/78/72/334377872.db2.gz	MZZPLURNNDSUBU-LBPRGKRZSA-N	1	0	286.325	4.029	20	30		CIEDRO
CCCC[C@H]([NH2+]CCC(C)(C)C#N)c1ccc(OC)cc1	ZINC000554084347	334410140	/nfs/dbraw/zinc/41/01/40/334410140.db2.gz	FXXWXEXPUUSIGB-KRWDZBQOSA-N	1	0	288.435	4.456	20	30		CIEDRO
C[C@H]([NH2+]CC(C)(C)CCC#N)[C@@H](C)c1ccccc1	ZINC000554358617	334424025	/nfs/dbraw/zinc/42/40/25/334424025.db2.gz	HQBCLHRMEDFRRH-CABCVRRESA-N	1	0	258.409	4.098	20	30		CIEDRO
CCCC[C@@H]1CCC[C@H]1[NH2+]CC(C)(C)CCC#N	ZINC000554360159	334424092	/nfs/dbraw/zinc/42/40/92/334424092.db2.gz	BGQWEMNHWBBUSF-HUUCEWRRSA-N	1	0	250.430	4.265	20	30		CIEDRO
C[C@H](c1ccccc1)[C@H](C)[NH2+][C@@H]1CCc2ccc(C#N)cc21	ZINC000554987898	334463713	/nfs/dbraw/zinc/46/37/13/334463713.db2.gz	GLTICOWKBSJKIL-AUSJPIAWSA-N	1	0	290.410	4.327	20	30		CIEDRO
CC#CCC[NH2+][C@@H](C)CCc1ccc(C(F)(F)F)cc1	ZINC000555336288	334475298	/nfs/dbraw/zinc/47/52/98/334475298.db2.gz	NXWOKCOQCLDGKL-ZDUSSCGKSA-N	1	0	283.337	4.030	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH2+][C@H](Cc2ccccc2)c2cccs2)C1	ZINC000555422868	334477907	/nfs/dbraw/zinc/47/79/07/334477907.db2.gz	LEPQANAGIRGRHP-BRWVUGGUSA-N	1	0	296.439	4.314	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@H](c2ccc(Cl)cc2)C2CC2)C1	ZINC000555421769	334478145	/nfs/dbraw/zinc/47/81/45/334478145.db2.gz	LKIDIBYTBKKBJK-RLCCDNCMSA-N	1	0	274.795	4.073	20	30		CIEDRO
N#CCCC[C@@H]([NH2+][C@@H]1CCC[C@H]2C[C@H]21)c1ccccc1	ZINC000556202157	334499728	/nfs/dbraw/zinc/49/97/28/334499728.db2.gz	IVCRMBRTUDVFRF-BSDSXHPESA-N	1	0	268.404	4.200	20	30		CIEDRO
C[C@@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)c1ccc(C#N)cc1F	ZINC000556242093	334503067	/nfs/dbraw/zinc/50/30/67/334503067.db2.gz	QWSJMIFAWRNMRV-SKDZVZGDSA-N	1	0	294.373	4.152	20	30		CIEDRO
CSc1ccc2c(c1)[C@H]([NH2+]CC(C)(C)CC#N)CCC2	ZINC000564728426	334518271	/nfs/dbraw/zinc/51/82/71/334518271.db2.gz	IAQRPGUECMPNMS-MRXNPFEDSA-N	1	0	288.460	4.315	20	30		CIEDRO
C[C@H](CC1CCCC1)[NH2+]C1(c2cccc(C#N)c2)CC1	ZINC000564744101	334519039	/nfs/dbraw/zinc/51/90/39/334519039.db2.gz	FSKRVINKUDDOSU-CQSZACIVSA-N	1	0	268.404	4.106	20	30		CIEDRO
C=CCC[C@H]([NH2+]C1Cc2ccccc2C1)c1ccco1	ZINC000564788812	334521010	/nfs/dbraw/zinc/52/10/10/334521010.db2.gz	BXTLZJLLDJOZCF-KRWDZBQOSA-N	1	0	267.372	4.044	20	30		CIEDRO
N#Cc1cccc(CC[NH2+]C2CCC3(CCCC3)CC2)c1	ZINC000565626827	334581255	/nfs/dbraw/zinc/58/12/55/334581255.db2.gz	PNNBZCNWJYTCJV-UHFFFAOYSA-N	1	0	282.431	4.193	20	30		CIEDRO
N#CCCC1CC[NH+]([C@@H]2CCc3c2cccc3Cl)CC1	ZINC000566677081	334659899	/nfs/dbraw/zinc/65/98/99/334659899.db2.gz	YGFYBHARLYJZGK-QGZVFWFLSA-N	1	0	288.822	4.343	20	30		CIEDRO
CC1(C)CC[C@@H]([NH2+]Cc2ccc(C#N)cc2C(F)(F)F)C1	ZINC000566943782	334670303	/nfs/dbraw/zinc/67/03/03/334670303.db2.gz	IKBLZULTKGXDQS-CYBMUJFWSA-N	1	0	296.336	4.245	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+]CC1(c2ccccn2)CCC1	ZINC000567367788	334709342	/nfs/dbraw/zinc/70/93/42/334709342.db2.gz	YGDQDWFOSJJCMH-MRXNPFEDSA-N	1	0	272.436	4.228	20	30		CIEDRO
COc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(C#N)cc2)c(F)c1	ZINC000268800738	334716575	/nfs/dbraw/zinc/71/65/75/334716575.db2.gz	KAYDMZQBFCMBDB-QWHCGFSZSA-N	1	0	298.361	4.118	20	30		CIEDRO
N#CCCC[NH2+][C@@H]1CCC[C@H]1c1ccccc1C(F)(F)F	ZINC000156835911	334751089	/nfs/dbraw/zinc/75/10/89/334751089.db2.gz	NXCKTYVGMONGRZ-DZGCQCFKSA-N	1	0	296.336	4.235	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CC1(c2ccccn2)CCC1)c1ccco1	ZINC000568377019	334820508	/nfs/dbraw/zinc/82/05/08/334820508.db2.gz	SBOHHJAJFPWXND-MRXNPFEDSA-N	1	0	296.414	4.393	20	30		CIEDRO
C[C@@H](CCc1ccsc1)[NH2+]C1(c2cccc(C#N)c2)CC1	ZINC000572863213	334885457	/nfs/dbraw/zinc/88/54/57/334885457.db2.gz	SMEKJMUGJPVCSF-AWEZNQCLSA-N	1	0	296.439	4.220	20	30		CIEDRO
C[C@H](c1ccc2c(c1)CCC2)[NH+]1CCC(CCC#N)CC1	ZINC000573202927	334916956	/nfs/dbraw/zinc/91/69/56/334916956.db2.gz	OUTZVTNRCDBQFJ-OAHLLOKOSA-N	1	0	282.431	4.252	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+]C[C@H](Cc1ccccc1)C(F)(F)F	ZINC000577028288	335284543	/nfs/dbraw/zinc/28/45/43/335284543.db2.gz	BPJUVQMQTBOKTI-HIFRSBDPSA-N	1	0	285.353	4.352	20	30		CIEDRO
C[C@H](C#N)C[NH2+]CCCCc1ccc(Cl)c(Cl)c1	ZINC000192719763	335297140	/nfs/dbraw/zinc/29/71/40/335297140.db2.gz	ZDZZZAYLPCQALN-LLVKDONJSA-N	1	0	285.218	4.065	20	30		CIEDRO
Cc1ccc2c(c1)CC[C@H]2[NH2+][C@H]1CCc2ccc(C#N)cc21	ZINC000577108559	335301479	/nfs/dbraw/zinc/30/14/79/335301479.db2.gz	XXEOISPDSDNLKC-UXHICEINSA-N	1	0	288.394	4.131	20	30		CIEDRO
CCc1ccc(C(C)(C)[NH2+]Cc2cccc(C#N)c2)cc1	ZINC000177598013	335375573	/nfs/dbraw/zinc/37/55/73/335375573.db2.gz	RNNHUQUASPVSNS-UHFFFAOYSA-N	1	0	278.399	4.146	20	30		CIEDRO
N#Cc1csc(C[NH2+]CCc2ccc3ccccc3c2)c1	ZINC000177691836	335379151	/nfs/dbraw/zinc/37/91/51/335379151.db2.gz	IJQMQNYRKGYULD-UHFFFAOYSA-N	1	0	292.407	4.105	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@@H]1CCCc2cc(OC)ccc21	ZINC000348288623	335421837	/nfs/dbraw/zinc/42/18/37/335421837.db2.gz	FLJLAMAURPJLAS-RHSMWYFYSA-N	1	0	259.393	4.017	20	30		CIEDRO
CCC(CC)[C@@H]([NH2+]CCCCC#N)c1ccccc1	ZINC000179789807	335518410	/nfs/dbraw/zinc/51/84/10/335518410.db2.gz	FCVPJBBMJZKWIW-QGZVFWFLSA-N	1	0	258.409	4.447	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccc(F)cc1C#N)c1ccccc1	ZINC000180048194	335544898	/nfs/dbraw/zinc/54/48/98/335544898.db2.gz	NLHLNUXTRNZQGZ-IBGZPJMESA-N	1	0	294.373	4.494	20	30		CIEDRO
Cc1cccc([C@@H]([NH2+]CCCSCC#N)C(C)(C)C)c1	ZINC000180801860	335624976	/nfs/dbraw/zinc/62/49/76/335624976.db2.gz	PLPDNXKWYRJZDB-MRXNPFEDSA-N	1	0	290.476	4.319	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](C)c1ccc(F)cc1OC(F)F	ZINC000180954565	335630841	/nfs/dbraw/zinc/63/08/41/335630841.db2.gz	CULJPVDOMLDJJZ-NXEZZACHSA-N	1	0	273.298	4.042	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](C)c1sc(CCOC)nc1C	ZINC000182182095	335802891	/nfs/dbraw/zinc/80/28/91/335802891.db2.gz	PDTJWQKXBRGNEN-QWHCGFSZSA-N	1	0	296.480	4.036	20	30		CIEDRO
C[C@H]([NH2+]CCCC(C)(C)C#N)c1nc(C(C)(C)C)cs1	ZINC000184450303	335926036	/nfs/dbraw/zinc/92/60/36/335926036.db2.gz	SRJHVGVOXFWFMZ-LBPRGKRZSA-N	1	0	293.480	4.421	20	30		CIEDRO
N#CC1CC[NH+](Cc2ccc(C3CCCC3)cc2)CC1	ZINC000580797788	335968035	/nfs/dbraw/zinc/96/80/35/335968035.db2.gz	OOLFMERCXGMRTO-UHFFFAOYSA-N	1	0	268.404	4.080	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccc(Cl)c(F)c1	ZINC000581530655	336095832	/nfs/dbraw/zinc/09/58/32/336095832.db2.gz	LEICWWFHFFBSST-GVXVVHGQSA-N	1	0	280.774	4.212	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([N@@H+]2CCCC3(C2)CCCCCC3)C1	ZINC000581595880	336109085	/nfs/dbraw/zinc/10/90/85/336109085.db2.gz	ACCGXJLUAUCNQU-HZPDHXFCSA-N	1	0	260.425	4.115	20	30		CIEDRO
Cc1ccc([C@@H]([NH2+]CC2CCC(C#N)CC2)C2CC2)cc1	ZINC000581634122	336115016	/nfs/dbraw/zinc/11/50/16/336115016.db2.gz	AIFSRRLLPBTGAR-LADRWXRNSA-N	1	0	282.431	4.366	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000581732300	336139563	/nfs/dbraw/zinc/13/95/63/336139563.db2.gz	NRJQUVUKGNMYOY-HUUCEWRRSA-N	1	0	256.393	4.344	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)c1sc(C(C)(C)C)nc1C	ZINC000386795375	336179435	/nfs/dbraw/zinc/17/94/35/336179435.db2.gz	PCNJGTJUWVZEPR-LLVKDONJSA-N	1	0	266.454	4.366	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)c1cccc(C(F)(F)F)c1	ZINC000386792521	336179453	/nfs/dbraw/zinc/17/94/53/336179453.db2.gz	OOIMYYCCSRQLPP-LLVKDONJSA-N	1	0	257.299	4.322	20	30		CIEDRO
CC[C@H](C)[N@H+](Cc1ccccc1)Cc1ccc(C#N)cc1F	ZINC000387331685	336192683	/nfs/dbraw/zinc/19/26/83/336192683.db2.gz	FFICZSPLRAFAQV-HNNXBMFYSA-N	1	0	296.389	4.498	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]CCCCOc1ccccc1	ZINC000582018919	336192742	/nfs/dbraw/zinc/19/27/42/336192742.db2.gz	LJGCLBUHEBIRQJ-UHFFFAOYSA-N	1	0	261.409	4.038	20	30		CIEDRO
COc1cc(C)ccc1[C@H](C)[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000387417495	336193724	/nfs/dbraw/zinc/19/37/24/336193724.db2.gz	FJTJFJGVZYIGLF-CABCVRRESA-N	1	0	294.398	4.287	20	30		CIEDRO
C[C@H](CCC(F)(F)F)[NH2+][C@H](CCC#N)c1ccccc1	ZINC000346266105	533814080	/nfs/dbraw/zinc/81/40/80/533814080.db2.gz	BOOMLIPERMOLPE-TZMCWYRMSA-N	1	0	284.325	4.352	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)s1)c1ccc2ncsc2c1	ZINC000485714058	518183314	/nfs/dbraw/zinc/18/33/14/518183314.db2.gz	SBYKECNDMDSXAN-JTQLQIEISA-N	1	0	299.424	4.080	20	30		CIEDRO
CC(C)[N@H+](Cc1ccc(C#N)cc1)Cc1ccc(Cl)nc1	ZINC000069221494	519654039	/nfs/dbraw/zinc/65/40/39/519654039.db2.gz	LEEAJJVKXYJWLX-UHFFFAOYSA-N	1	0	299.805	4.017	20	30		CIEDRO
CC[NH+](CC)Cc1ccc(NCc2ccc(C#N)s2)cc1	ZINC000190386756	520752041	/nfs/dbraw/zinc/75/20/41/520752041.db2.gz	VVJOJTQRAGQAGO-UHFFFAOYSA-N	1	0	299.443	4.074	20	30		CIEDRO
CC[N@H+](Cc1ccc(Cl)nc1)[C@@H](C)c1ccc(C#N)cc1	ZINC000069220977	521310643	/nfs/dbraw/zinc/31/06/43/521310643.db2.gz	IAKKGFQZDVYMPL-ZDUSSCGKSA-N	1	0	299.805	4.190	20	30		CIEDRO
CC[C@H]([NH2+][C@H](C)c1ccc(OC)cc1)c1ccc(C#N)cc1	ZINC000278675469	522737752	/nfs/dbraw/zinc/73/77/52/522737752.db2.gz	JMAFTKQWSCEHRM-KUHUBIRLSA-N	1	0	294.398	4.369	20	30		CIEDRO
CC[C@H]([NH2+][C@H](C)c1ccc(C#N)cc1)c1ccccc1	ZINC000036991917	522738531	/nfs/dbraw/zinc/73/85/31/522738531.db2.gz	ONIHEVMWCFKMER-KDOFPFPSSA-N	1	0	264.372	4.360	20	30		CIEDRO
CC[C@@H]([NH2+]C1(c2cccc(C#N)c2)CC1)c1cccc(F)c1	ZINC000275653007	522807548	/nfs/dbraw/zinc/80/75/48/522807548.db2.gz	AIVZXTXNKYUETO-GOSISDBHSA-N	1	0	294.373	4.427	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1cccc(C)c1)c1ccc(C#N)cc1	ZINC000278266401	522880245	/nfs/dbraw/zinc/88/02/45/522880245.db2.gz	OLGOZRTUMDMKFX-GOSISDBHSA-N	1	0	264.372	4.108	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H](C)c1cccc(OC)c1)c1ccc(C#N)cc1	ZINC000278289899	522914251	/nfs/dbraw/zinc/91/42/51/522914251.db2.gz	QYAGLDHBMKQUQJ-IFXJQAMLSA-N	1	0	294.398	4.369	20	30		CIEDRO
CC[C@@H]([NH2+][C@H](C)c1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000036991922	522936219	/nfs/dbraw/zinc/93/62/19/522936219.db2.gz	MEWWPBKVAVUHQE-FZKQIMNGSA-N	1	0	282.362	4.499	20	30		CIEDRO
C[C@H]([NH2+]C1(c2cccc(C#N)c2)CC1)c1ccc(F)c(F)c1	ZINC000272335457	525284450	/nfs/dbraw/zinc/28/44/50/525284450.db2.gz	YTWMBWKPKUUMNT-LBPRGKRZSA-N	1	0	298.336	4.176	20	30		CIEDRO
Cc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1cccc(C#N)c1	ZINC000037228512	525360704	/nfs/dbraw/zinc/36/07/04/525360704.db2.gz	PWAIDDZCTMHIBN-LSDHHAIUSA-N	1	0	264.372	4.279	20	30		CIEDRO
Cc1cc([C@H](C)[NH2+][C@H](C)c2ccc(C#N)cc2)ccc1F	ZINC000267704943	525529974	/nfs/dbraw/zinc/52/99/74/525529974.db2.gz	SBQIKXVWPMIRTQ-KGLIPLIRSA-N	1	0	282.362	4.418	20	30		CIEDRO
C[C@@H]([NH2+]Cc1cnc(C(C)(C)C)s1)c1ccc(C#N)cc1	ZINC000059183814	525547632	/nfs/dbraw/zinc/54/76/32/525547632.db2.gz	NXBFUHIKOKGNGD-GFCCVEGCSA-N	1	0	299.443	4.163	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCCc2sccc21)c1ccc(C#N)cc1	ZINC000061326709	525640520	/nfs/dbraw/zinc/64/05/20/525640520.db2.gz	QXURSYUGUYTXGF-MLGOLLRUSA-N	1	0	282.412	4.348	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCc2c1cccc2F)c1ccc(C#N)cc1	ZINC000097988271	525649536	/nfs/dbraw/zinc/64/95/36/525649536.db2.gz	ALQPZPKHNCXTAY-KZULUSFZSA-N	1	0	280.346	4.035	20	30		CIEDRO
Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(C#N)cc2)s1	ZINC000036991881	525934958	/nfs/dbraw/zinc/93/49/58/525934958.db2.gz	WTKFQIBQSLRJRU-STQMWFEESA-N	1	0	270.401	4.340	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1ccccc1Br	ZINC000168055473	526456004	/nfs/dbraw/zinc/45/60/04/526456004.db2.gz	KCBWMVPFANNPSA-NSHDSACASA-N	1	0	268.198	4.066	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]C[C@H]1CCC[C@@H](C(F)(F)F)C1	ZINC000344601863	526998510	/nfs/dbraw/zinc/99/85/10/526998510.db2.gz	KKRIYSLHWQKOBZ-QWHCGFSZSA-N	1	0	290.373	4.275	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+]C[C@@H]1CCO[C@H]1c1ccccc1	ZINC000191854300	527426948	/nfs/dbraw/zinc/42/69/48/527426948.db2.gz	KZGKDKZHRPOYII-OTWHNJEPSA-N	1	0	287.447	4.489	20	30		CIEDRO
C=C[C@@H](CO)[NH2+][C@H](CC)c1ccc(Oc2ccccc2)cc1	ZINC000353568215	527444636	/nfs/dbraw/zinc/44/46/36/527444636.db2.gz	PGQLAGCXEOIXEI-QFBILLFUSA-N	1	0	297.398	4.067	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccc(CC)nc1)c1ccccc1	ZINC000352761725	527450147	/nfs/dbraw/zinc/45/01/47/527450147.db2.gz	YUCJJUOOLXYKRO-LJQANCHMSA-N	1	0	280.415	4.441	20	30		CIEDRO
CC(C)Sc1cccc(Cl)c1C[NH2+]CCCC#N	ZINC000354628730	528330345	/nfs/dbraw/zinc/33/03/45/528330345.db2.gz	BLJSJBNHFWQKHL-UHFFFAOYSA-N	1	0	282.840	4.234	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@H]2C[C@H](c3cccc(F)c3)C2)CC1	ZINC000336204640	528832811	/nfs/dbraw/zinc/83/28/11/528832811.db2.gz	MOKJIEBLBVVLRA-RSWLEGOBSA-N	1	0	286.394	4.134	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccc(C#N)c(OC)c1)c1cccc(C)c1	ZINC000353610141	529182273	/nfs/dbraw/zinc/18/22/73/529182273.db2.gz	LRBZVBRHBZWJRU-GOSISDBHSA-N	1	0	294.398	4.116	20	30		CIEDRO
CC[C@@H]([NH2+][C@H]1CCc2ccc(C#N)cc21)c1ccccc1	ZINC000353397232	529208013	/nfs/dbraw/zinc/20/80/13/529208013.db2.gz	IOENHGQVCKSCMN-MOPGFXCFSA-N	1	0	276.383	4.286	20	30		CIEDRO
CCCc1ccc([C@@H]([NH2+]CCCC#N)C(C)C)cc1	ZINC000096982038	185145158	/nfs/dbraw/zinc/14/51/58/185145158.db2.gz	BYTGPROPDFYHAI-KRWDZBQOSA-N	1	0	258.409	4.230	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CCc2ccc(C#N)cc21)c1ccccc1	ZINC000353397234	529661040	/nfs/dbraw/zinc/66/10/40/529661040.db2.gz	IOENHGQVCKSCMN-RBUKOAKNSA-N	1	0	276.383	4.286	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1ccc(C#N)c(F)c1)C1CCCCC1	ZINC000573872035	334973486	/nfs/dbraw/zinc/97/34/86/334973486.db2.gz	WDXBNMSHDDFZRA-OLZOCXBDSA-N	1	0	274.383	4.317	20	30		CIEDRO
N#Cc1ccc(C[N@@H+]2CCC[C@H]2c2ccsc2)s1	ZINC000153555814	261080404	/nfs/dbraw/zinc/08/04/04/261080404.db2.gz	WWEDDNZVOZTHSR-AWEZNQCLSA-N	1	0	274.414	4.018	20	30		CIEDRO
C[C@H]1C[C@@H](c2ccccc2)[N@H+](Cc2cc(C#N)cs2)C1	ZINC000574320826	335010063	/nfs/dbraw/zinc/01/00/63/335010063.db2.gz	ZROTZZVNLDEVDZ-GUYCJALGSA-N	1	0	282.412	4.203	20	30		CIEDRO
CC(C)(C)[C@@H](CC1CCCCC1)[NH2+]C[C@H](C#N)CCC#N	ZINC000574392686	335015641	/nfs/dbraw/zinc/01/56/41/335015641.db2.gz	ASGQNEHMUKPDKG-DLBZAZTESA-N	1	0	289.467	4.405	20	30		CIEDRO
C=CCCCCC[N@@H+](C)[C@@H](C)c1ccc([S@@](C)=O)cc1	ZINC000187694788	260051845	/nfs/dbraw/zinc/05/18/45/260051845.db2.gz	VULRGNSKOZLWAF-MGPUTAFESA-N	1	0	293.476	4.163	20	30		CIEDRO
C[C@@H]([NH2+]C[C@@H](C#N)CCC#N)c1ccc(F)c2ccccc21	ZINC000352270376	533408128	/nfs/dbraw/zinc/40/81/28/533408128.db2.gz	FVIFHFQHYHMZHF-ZIAGYGMSSA-N	1	0	295.361	4.073	20	30		CIEDRO
C[C@@H]1CCCC[C@H]1[NH2+][C@H]1CCCc2cc(C#N)ccc21	ZINC000341756599	130023939	/nfs/dbraw/zinc/02/39/39/130023939.db2.gz	FVBGKLAEKDHSLG-XWIAVFTESA-N	1	0	268.404	4.104	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCCc2cc(C#N)ccc21)c1ccccc1F	ZINC000341756200	130024768	/nfs/dbraw/zinc/02/47/68/130024768.db2.gz	DCUWKCITAWIKSW-YJYMSZOUSA-N	1	0	294.373	4.426	20	30		CIEDRO
Cc1cc(C[NH2+][C@@H]2CCCc3cc(C#N)ccc32)ccc1F	ZINC000341758486	130025949	/nfs/dbraw/zinc/02/59/49/130025949.db2.gz	PTRRQSXRIUQTFK-LJQANCHMSA-N	1	0	294.373	4.173	20	30		CIEDRO
C[C@@H]1CCC[C@H]([NH2+][C@@H]2CCCc3cc(C#N)ccc32)C1	ZINC000341763245	130028098	/nfs/dbraw/zinc/02/80/98/130028098.db2.gz	WIGSBXXXXSXXBK-RPVQJOFSSA-N	1	0	268.404	4.104	20	30		CIEDRO
CC1(C)CC[C@@H]([NH2+][C@H]2CCCc3cc(C#N)ccc32)C1	ZINC000341894721	130136115	/nfs/dbraw/zinc/13/61/15/130136115.db2.gz	FIBYJUXFEPWLKK-WBVHZDCISA-N	1	0	268.404	4.104	20	30		CIEDRO
N#Cc1cccc(C[NH+]2CCC(Cc3ccccc3)CC2)c1	ZINC000007788116	170303051	/nfs/dbraw/zinc/30/30/51/170303051.db2.gz	WAHFNRYQBPSZNI-UHFFFAOYSA-N	1	0	290.410	4.013	20	30		CIEDRO
CCCCC[N@H+](Cc1ccc(C#N)cc1F)C(C)C	ZINC000042249884	174666000	/nfs/dbraw/zinc/66/60/00/174666000.db2.gz	KDDQCFGXDZRRSK-UHFFFAOYSA-N	1	0	262.372	4.098	20	30		CIEDRO
N#Cc1cc(C[N@@H+]2CCC[C@@]3(CC=CCC3)C2)ccc1F	ZINC000344414999	225052058	/nfs/dbraw/zinc/05/20/58/225052058.db2.gz	UDWHHGNQDVHPRX-SFHVURJKSA-N	1	0	284.378	4.020	20	30		CIEDRO
C[C@H]1CCCC[C@@H]1CC[NH2+]CC(C)(C)CCC#N	ZINC000344373722	225053902	/nfs/dbraw/zinc/05/39/02/225053902.db2.gz	IJUUXXMSGQZCGX-LSDHHAIUSA-N	1	0	250.430	4.122	20	30		CIEDRO
Cc1cccc([C@H]2CCCCC[N@@H+]2CCCC#N)c1	ZINC000344506170	225086555	/nfs/dbraw/zinc/08/65/55/225086555.db2.gz	WEUROMDOWBWJJW-QGZVFWFLSA-N	1	0	256.393	4.216	20	30		CIEDRO
C=CCC[C@H]([NH2+]CC1(CCO)CCCCC1)c1ccco1	ZINC000575163303	335074204	/nfs/dbraw/zinc/07/42/04/335074204.db2.gz	JVJCMRHHFQMJMQ-INIZCTEOSA-N	1	0	291.435	4.209	20	30		CIEDRO
N#Cc1ccc(C[NH2+]CCC2=CCCC2)c(C(F)(F)F)c1	ZINC000352804959	227242771	/nfs/dbraw/zinc/24/27/71/227242771.db2.gz	XEVTXRYWBCZHFZ-UHFFFAOYSA-N	1	0	294.320	4.167	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+]C2(c3ccc(F)cc3F)CCC2)C1	ZINC000193105344	228001025	/nfs/dbraw/zinc/00/10/25/228001025.db2.gz	PIAFIFKBOKLIRI-TZMCWYRMSA-N	1	0	290.357	4.016	20	30		CIEDRO
C[C@H]([N@H+](C)Cc1ccc(C#N)cc1C(F)(F)F)C1(C)CC1	ZINC000356128514	228133376	/nfs/dbraw/zinc/13/33/76/228133376.db2.gz	PUBOUPAOAABCQU-NSHDSACASA-N	1	0	296.336	4.197	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+]C(c2ccccc2)c2ccccc2)C1	ZINC000192588625	228153255	/nfs/dbraw/zinc/15/32/55/228153255.db2.gz	DSSNWSLCAFSWKJ-VQIMIIECSA-N	1	0	290.410	4.448	20	30		CIEDRO
N#CCCCOc1cccc(C[NH2+][C@@H]2CC3CCC2CC3)c1	ZINC000353814304	228155659	/nfs/dbraw/zinc/15/56/59/228155659.db2.gz	ZHOZCZDVKFDZBN-GXOAENINSA-N	1	0	298.430	4.037	20	30		CIEDRO
C[C@H]([NH2+][C@@H](C)c1ccc(OCC#N)cc1)c1cccs1	ZINC000037235042	260076472	/nfs/dbraw/zinc/07/64/72/260076472.db2.gz	UCTIZMHRHQAHQC-STQMWFEESA-N	1	0	286.400	4.062	20	30		CIEDRO
CC(C)C[N@H+](CCc1ccccc1)Cc1ccc(C#N)cc1	ZINC000521371770	260089242	/nfs/dbraw/zinc/08/92/42/260089242.db2.gz	YXMJSUANWMYWGT-UHFFFAOYSA-N	1	0	292.426	4.259	20	30		CIEDRO
Cc1cc(C[NH2+][C@@H](C)c2ccc(C#N)cc2)ccc1Cl	ZINC000180786712	260111259	/nfs/dbraw/zinc/11/12/59/260111259.db2.gz	IDLOQHDDTZOFQQ-ZDUSSCGKSA-N	1	0	284.790	4.371	20	30		CIEDRO
C[C@@H](c1ccccc1F)[N@H+](C)CCCC(C)(C)C#N	ZINC000087608710	260215615	/nfs/dbraw/zinc/21/56/15/260215615.db2.gz	JCBIBYCRVGSVHF-ZDUSSCGKSA-N	1	0	262.372	4.148	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]CCCCCc1ccc(F)cc1	ZINC000189556385	260223305	/nfs/dbraw/zinc/22/33/05/260223305.db2.gz	QZPDGJUQGVFKFQ-UHFFFAOYSA-N	1	0	290.426	4.458	20	30		CIEDRO
CCCC[C@H]1CCC[C@H]1[NH2+]C1CCC(C)(C#N)CC1	ZINC000449119094	260230240	/nfs/dbraw/zinc/23/02/40/260230240.db2.gz	WIIZJXFACVPSEL-ORBLRFAASA-N	1	0	262.441	4.407	20	30		CIEDRO
Cc1cc(C)cc([C@H](C)[NH2+]C2CCC(C)(C#N)CC2)c1	ZINC000449127479	260233799	/nfs/dbraw/zinc/23/37/99/260233799.db2.gz	PGQULAVYNAJIIM-ZLPCBKJTSA-N	1	0	270.420	4.427	20	30		CIEDRO
CC1(C#N)CCC([NH2+]CCc2cc3ccccc3o2)CC1	ZINC000449153138	260259240	/nfs/dbraw/zinc/25/92/40/260259240.db2.gz	CKMRKBNJGPSHPP-UHFFFAOYSA-N	1	0	282.387	4.037	20	30		CIEDRO
CC[C@H]([NH2+]C1CCC(C)(C#N)CC1)c1cc(F)ccc1F	ZINC000449156514	260260665	/nfs/dbraw/zinc/26/06/65/260260665.db2.gz	DSPRRXJWSJGVLP-PWZRNIHTSA-N	1	0	292.373	4.478	20	30		CIEDRO
CCC(C)(C)c1ccc(C[NH+]2CCC(CC#N)CC2)cc1	ZINC000517907212	260315785	/nfs/dbraw/zinc/31/57/85/260315785.db2.gz	WMRPUCRXCHONOL-UHFFFAOYSA-N	1	0	284.447	4.500	20	30		CIEDRO
CC[C@H](C)[C@@H](C)[N@H+](Cc1cc(C#N)ccc1F)C1CC1	ZINC000517908936	260316520	/nfs/dbraw/zinc/31/65/20/260316520.db2.gz	RPMUCVWPCKNZAW-QWHCGFSZSA-N	1	0	274.383	4.096	20	30		CIEDRO
C[N@H+](CCCCC#N)C1c2ccccc2-c2ccccc21	ZINC000081596745	260335772	/nfs/dbraw/zinc/33/57/72/260335772.db2.gz	CPRUKYCQYUSWEW-UHFFFAOYSA-N	1	0	276.383	4.382	20	30		CIEDRO
CC(C)(C#N)CCCC[N@H+](C[C@H]1CCCO1)C1CCCC1	ZINC000409446910	260409574	/nfs/dbraw/zinc/40/95/74/260409574.db2.gz	ZIZBEXYGRNYBFO-QGZVFWFLSA-N	1	0	292.467	4.130	20	30		CIEDRO
C[N@H+](CCC1CCCCC1)CC(C)(C)CCC#N	ZINC000092784489	260501357	/nfs/dbraw/zinc/50/13/57/260501357.db2.gz	WWBWVFCEVDLNBP-UHFFFAOYSA-N	1	0	250.430	4.219	20	30		CIEDRO
C=CCCC[NH2+][C@@H](CC)CSc1ccccc1[N+](=O)[O-]	ZINC000448027252	260588093	/nfs/dbraw/zinc/58/80/93/260588093.db2.gz	MDVLJJXAWSJMSO-ZDUSSCGKSA-N	1	0	294.420	4.021	20	30		CIEDRO
C=CCCC[NH2+][C@H](C)CC(=O)Nc1ccc(C(C)C)cc1	ZINC000448031405	260621453	/nfs/dbraw/zinc/62/14/53/260621453.db2.gz	URSGBYOFQIVLED-OAHLLOKOSA-N	1	0	288.435	4.083	20	30		CIEDRO
COc1cccc([C@@H]2CCC[N@@H+]2CC(C)(C)CCC#N)c1	ZINC000124265730	260746463	/nfs/dbraw/zinc/74/64/63/260746463.db2.gz	YFMJNDXCEKKSPW-KRWDZBQOSA-N	1	0	286.419	4.162	20	30		CIEDRO
CC(C)(C#N)CCC[NH2+][C@H]1CCC[C@H]1c1ccccc1	ZINC000133467649	260904370	/nfs/dbraw/zinc/90/43/70/260904370.db2.gz	CLCDIKMGYWEDBR-IRXDYDNUSA-N	1	0	270.420	4.242	20	30		CIEDRO
CC[C@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)c1ccccc1F	ZINC000168766902	260910115	/nfs/dbraw/zinc/91/01/15/260910115.db2.gz	DGCSALJUMPNWBU-UGSOOPFHSA-N	1	0	282.362	4.499	20	30		CIEDRO
CC(C)(C#N)CCCC[N@@H+]1CC[C@@](C)(c2ccccc2)C1	ZINC000444640164	261055995	/nfs/dbraw/zinc/05/59/95/261055995.db2.gz	BINQIWUIUGGRGK-LJQANCHMSA-N	1	0	284.447	4.370	20	30		CIEDRO
Fc1ccc(C#CC[N@@H+]2CCC[C@H]2c2ccc(F)cc2)cc1	ZINC000448257848	261068475	/nfs/dbraw/zinc/06/84/75/261068475.db2.gz	SFKKPFZCHRTKBH-IBGZPJMESA-N	1	0	297.348	4.153	20	30		CIEDRO
CCC1(CC)[C@H]([NH2+]CCCCC(C)(C)C#N)[C@@H](C)[C@H]1OC	ZINC000444699166	261108252	/nfs/dbraw/zinc/10/82/52/261108252.db2.gz	MRZXDIFHPPVOOL-BZUAXINKSA-N	1	0	294.483	4.136	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)c1ccc(F)c(Br)c1	ZINC000161670610	261114469	/nfs/dbraw/zinc/11/44/69/261114469.db2.gz	YDHJKNDBEHHBKZ-UWVGGRQHSA-N	1	0	286.188	4.203	20	30		CIEDRO
CC(C)[C@H]1CC[C@@H](C)C[C@@H]1[NH2+]CC(C)(C)CCC#N	ZINC000229680989	261212485	/nfs/dbraw/zinc/21/24/85/261212485.db2.gz	PFHGIITXNOQEEI-OAGGEKHMSA-N	1	0	264.457	4.367	20	30		CIEDRO
Cc1cc([C@H](C)[NH2+]Cc2ccc(F)c(C#N)c2)c(C)s1	ZINC000182761577	261460540	/nfs/dbraw/zinc/46/05/40/261460540.db2.gz	VWVLTVSVSXQKLO-NSHDSACASA-N	1	0	288.391	4.227	20	30		CIEDRO
CCc1cccc2c(CC[NH2+]CC(C)(C)CCC#N)c[nH]c21	ZINC000174378170	261569585	/nfs/dbraw/zinc/56/95/85/261569585.db2.gz	HLDFSUHCIJNDCI-UHFFFAOYSA-N	1	0	297.446	4.192	20	30		CIEDRO
C[C@@H]([NH2+]CCCCC#N)c1ccc(N2CCCCC2)cc1	ZINC000178640174	261754145	/nfs/dbraw/zinc/75/41/45/261754145.db2.gz	MTTMUUURZTWNDR-MRXNPFEDSA-N	1	0	285.435	4.021	20	30		CIEDRO
CCOc1ccccc1[C@H](CC)[NH2+]CCCC(C)(C)C#N	ZINC000179735815	261811939	/nfs/dbraw/zinc/81/19/39/261811939.db2.gz	HAEWYGCRZHKXML-INIZCTEOSA-N	1	0	288.435	4.456	20	30		CIEDRO
Cc1ccc(F)cc1C[NH2+][C@H](CCC#N)c1ccccc1	ZINC000180336793	261855029	/nfs/dbraw/zinc/85/50/29/261855029.db2.gz	QIEYIMKUOZNLOR-GOSISDBHSA-N	1	0	282.362	4.269	20	30		CIEDRO
Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]CCCC#N	ZINC000184087401	262008567	/nfs/dbraw/zinc/00/85/67/262008567.db2.gz	QRQGJKUIUJAPLD-ZDUSSCGKSA-N	1	0	299.443	4.381	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)c1ccc(OC(F)F)cc1	ZINC000185767966	262069443	/nfs/dbraw/zinc/06/94/43/262069443.db2.gz	AYZMJYJISRCKKB-SGMGOOAPSA-N	1	0	294.345	4.021	20	30		CIEDRO
Cc1cc([C@H](C)[NH2+][C@@H]2CCC[C@H](C#N)C2)c(C)s1	ZINC000185770091	262069889	/nfs/dbraw/zinc/06/98/89/262069889.db2.gz	BXGNBTKOSQNECK-FPMFFAJLSA-N	1	0	262.422	4.098	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)c1cccc(OC(F)F)c1	ZINC000185779898	262070312	/nfs/dbraw/zinc/07/03/12/262070312.db2.gz	KSUHZNNOGJYHOQ-SGMGOOAPSA-N	1	0	294.345	4.021	20	30		CIEDRO
CC(C)Oc1cccc([C@@H](C)[NH2+][C@@H]2CCC[C@H](C#N)C2)c1	ZINC000185780374	262070913	/nfs/dbraw/zinc/07/09/13/262070913.db2.gz	WXIOKJFLQSYHQI-HLLBOEOZSA-N	1	0	286.419	4.207	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]C[C@@H](c1ccccc1)C(F)(F)F	ZINC000186438629	262093381	/nfs/dbraw/zinc/09/33/81/262093381.db2.gz	KKDZIHZOXCRWPU-AWEZNQCLSA-N	1	0	298.352	4.252	20	30		CIEDRO
C=C(C)C[N@@H+](C)Cc1cn(-c2ccccc2)nc1C(C)C	ZINC000497245484	262121734	/nfs/dbraw/zinc/12/17/34/262121734.db2.gz	GCAUPCFMEXWKLK-UHFFFAOYSA-N	1	0	283.419	4.004	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)CCc1ccc(Cl)s1	ZINC000390175867	262145900	/nfs/dbraw/zinc/14/59/00/262145900.db2.gz	IGKPFZKUNCEBRP-NSHDSACASA-N	1	0	257.830	4.278	20	30		CIEDRO
CC(C)(Cc1ccc(C(F)(F)F)cc1)[NH2+]CCCCC#N	ZINC000190676801	262184975	/nfs/dbraw/zinc/18/49/75/262184975.db2.gz	NYCIQKWYVYQXTL-UHFFFAOYSA-N	1	0	298.352	4.310	20	30		CIEDRO
CC(C)[C@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)c1ccc(F)cc1	ZINC000503928437	262186725	/nfs/dbraw/zinc/18/67/25/262186725.db2.gz	SUIDJSYPUGFGFD-XKQJLSEDSA-N	1	0	274.383	4.195	20	30		CIEDRO
C[C@H]([NH2+]C[C@H]1CCC2(CCCCC2)O1)c1ccc(C#N)cc1	ZINC000319264205	262191203	/nfs/dbraw/zinc/19/12/03/262191203.db2.gz	WLBRPISCKQAJIW-MAUKXSAKSA-N	1	0	298.430	4.091	20	30		CIEDRO
C[C@H](C[NH2+][C@@H](C)c1ccc(C#N)cc1)c1ccccc1	ZINC000020137091	262230877	/nfs/dbraw/zinc/23/08/77/262230877.db2.gz	LHYRNDLXEGMJON-CABCVRRESA-N	1	0	264.372	4.013	20	30		CIEDRO
CC[C@H](CC#N)[NH2+][C@H](C)CC(C)(C)c1ccccc1	ZINC000054183664	262259773	/nfs/dbraw/zinc/25/97/73/262259773.db2.gz	FJLPNDPEZDPFBJ-GDBMZVCRSA-N	1	0	258.409	4.025	20	30		CIEDRO
CC(C)(C)c1ccc(C[NH2+][C@H]2CCC[C@@H](C#N)C2)cc1	ZINC000463282503	262303706	/nfs/dbraw/zinc/30/37/06/262303706.db2.gz	MYXVBTHGJXXOOT-WBVHZDCISA-N	1	0	270.420	4.156	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1ccc(F)cc1Cl	ZINC000185839983	262309726	/nfs/dbraw/zinc/30/97/26/262309726.db2.gz	YOFSOOZKAJAKFT-MDZLAQPJSA-N	1	0	280.774	4.212	20	30		CIEDRO
C=CCSCC[NH2+][C@H](C)c1oc2ccccc2c1C	ZINC000221941722	262332947	/nfs/dbraw/zinc/33/29/47/262332947.db2.gz	OWJKWYXCTDEABG-CYBMUJFWSA-N	1	0	275.417	4.311	20	30		CIEDRO
Cc1ccc(-c2ccc(C[NH2+]CCCCC#N)o2)cc1	ZINC000237801130	262638193	/nfs/dbraw/zinc/63/81/93/262638193.db2.gz	LMFPWOLXWBHTLS-UHFFFAOYSA-N	1	0	268.360	4.039	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@H]1CCOC2(CCCCC2)C1	ZINC000366370230	262642779	/nfs/dbraw/zinc/64/27/79/262642779.db2.gz	CXDIWBCDYUALQT-JYJNAYRXSA-N	1	0	265.441	4.059	20	30		CIEDRO
C[C@@H]([NH2+]CCC1(C#N)CCCCC1)c1ccccc1	ZINC000411437548	262693635	/nfs/dbraw/zinc/69/36/35/262693635.db2.gz	LFJGEWWYXNXZKG-OAHLLOKOSA-N	1	0	256.393	4.201	20	30		CIEDRO
C[C@@H](CCC#N)[NH2+][C@@H](Cc1ccccc1)c1cccs1	ZINC000411514465	262697289	/nfs/dbraw/zinc/69/72/89/262697289.db2.gz	GGNLOLNPTVJLDK-HOCLYGCPSA-N	1	0	284.428	4.314	20	30		CIEDRO
C[C@@H](CCCc1cccnc1)[NH2+]CCC1(C#N)CCCCC1	ZINC000411825268	262707415	/nfs/dbraw/zinc/70/74/15/262707415.db2.gz	RKGFKJHCHYEIBM-KRWDZBQOSA-N	1	0	299.462	4.247	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+]C[C@@H](CC)CC(F)(F)F	ZINC000414249830	262823552	/nfs/dbraw/zinc/82/35/52/262823552.db2.gz	AOYIWPCHSFEDCM-SRVKXCTJSA-N	1	0	251.336	4.155	20	30		CIEDRO
CC[C@H](C[NH2+]C1CCC(C)(C#N)CC1)CC(F)(F)F	ZINC000414251598	262824246	/nfs/dbraw/zinc/82/42/46/262824246.db2.gz	IHWBFXOKLGIIMT-HIFPTAJRSA-N	1	0	276.346	4.027	20	30		CIEDRO
CCCCCCC[NH2+][C@@H](C)c1ccc([S@](C)=O)cc1	ZINC000271934334	263000292	/nfs/dbraw/zinc/00/02/92/263000292.db2.gz	JNVYCFGWGXHFEN-LIRRHRJNSA-N	1	0	281.465	4.045	20	30		CIEDRO
CCCCCCC[NH2+][C@@H](C)c1ccc([S@@](C)=O)cc1	ZINC000271934332	263000293	/nfs/dbraw/zinc/00/02/93/263000293.db2.gz	JNVYCFGWGXHFEN-IFXJQAMLSA-N	1	0	281.465	4.045	20	30		CIEDRO
C[C@H]([NH2+]C1(c2ccccc2)CCC1)c1ccc(C#N)c(F)c1	ZINC000272060954	263001967	/nfs/dbraw/zinc/00/19/67/263001967.db2.gz	OYZABVSKURMKRA-AWEZNQCLSA-N	1	0	294.373	4.427	20	30		CIEDRO
CC1(C#N)CC[NH+](Cc2cc(Cl)cc3cccnc32)CC1	ZINC000272560236	263006697	/nfs/dbraw/zinc/00/66/97/263006697.db2.gz	LRKUZJKBSDYDQD-UHFFFAOYSA-N	1	0	299.805	4.014	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CC[C@@H](C#N)C1)c1ccc(Cl)s1	ZINC000274659181	263028926	/nfs/dbraw/zinc/02/89/26/263028926.db2.gz	VHUCGTFIUAEXPD-VWYCJHECSA-N	1	0	268.813	4.134	20	30		CIEDRO
C[C@@]1(c2ccccc2)CC[C@H]([NH+]2CCC(C)(C#N)CC2)C1	ZINC000276225126	263035404	/nfs/dbraw/zinc/03/54/04/263035404.db2.gz	MNTHXGVKOUCMDR-PKOBYXMFSA-N	1	0	282.431	4.122	20	30		CIEDRO
C[C@H](CCC#N)[NH2+][C@H](C)c1cccc(Cl)c1Cl	ZINC000276319175	263036124	/nfs/dbraw/zinc/03/61/24/263036124.db2.gz	OEDDKAJFOOLRLS-NXEZZACHSA-N	1	0	271.191	4.336	20	30		CIEDRO
N#Cc1ccc(C[NH2+]Cc2ccc(C3CCC3)cc2)s1	ZINC000276915337	263038494	/nfs/dbraw/zinc/03/84/94/263038494.db2.gz	JYPAUAFYJMCMLE-UHFFFAOYSA-N	1	0	282.412	4.177	20	30		CIEDRO
C[N@H+](CCCCC(C)(C)C#N)Cc1ccc(F)cc1F	ZINC000277542445	263041804	/nfs/dbraw/zinc/04/18/04/263041804.db2.gz	BHWVQCXIXXXRBF-UHFFFAOYSA-N	1	0	280.362	4.117	20	30		CIEDRO
CC[N@H+](CCCCC(C)(C)C#N)[C@@H](C)c1cccc(O)c1	ZINC000277649122	263042510	/nfs/dbraw/zinc/04/25/10/263042510.db2.gz	IEDJWZSUZJJMEJ-HNNXBMFYSA-N	1	0	288.435	4.495	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+]Cc2cc3ccccc3s2)C1	ZINC000278326097	263047030	/nfs/dbraw/zinc/04/70/30/263047030.db2.gz	VQFUOHUKHMXIEO-OCCSQVGLSA-N	1	0	270.401	4.073	20	30		CIEDRO
CC1(C#N)CC[NH+](CCCc2c(F)cccc2Cl)CC1	ZINC000278477701	263048129	/nfs/dbraw/zinc/04/81/29/263048129.db2.gz	ISMNEUOMLIHAFH-UHFFFAOYSA-N	1	0	294.801	4.037	20	30		CIEDRO
CC[C@H]([NH2+]C[C@@H]1CCC(F)(F)C1)c1ccc(C#N)cc1	ZINC000281044246	263066050	/nfs/dbraw/zinc/06/60/50/263066050.db2.gz	HDHIAVNMDNSUJI-HIFRSBDPSA-N	1	0	278.346	4.034	20	30		CIEDRO
CC[C@@H]([NH2+]C[C@H]1CCC(F)(F)C1)c1ccc(C#N)cc1	ZINC000281044241	263066093	/nfs/dbraw/zinc/06/60/93/263066093.db2.gz	HDHIAVNMDNSUJI-DZGCQCFKSA-N	1	0	278.346	4.034	20	30		CIEDRO
C[C@@H]([NH2+]CC1CCC(C#N)CC1)c1ccc(Cl)cc1	ZINC000281717886	263071426	/nfs/dbraw/zinc/07/14/26/263071426.db2.gz	PAMPWYTZLHFFAB-IYXRBSQSSA-N	1	0	276.811	4.321	20	30		CIEDRO
N#CC1CCC(C[NH2+]Cc2csc3ccccc23)CC1	ZINC000281754771	263071648	/nfs/dbraw/zinc/07/16/48/263071648.db2.gz	REYPYRWMOIPFCD-UHFFFAOYSA-N	1	0	284.428	4.321	20	30		CIEDRO
CCOc1ccc([C@@H](C)[NH2+]CC2CCC(C#N)CC2)cc1	ZINC000282139662	263074597	/nfs/dbraw/zinc/07/45/97/263074597.db2.gz	BZUUDFBBHCWSHG-QQFBHYJXSA-N	1	0	286.419	4.066	20	30		CIEDRO
N#CC1CCC(C[NH2+][C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000282260748	263075402	/nfs/dbraw/zinc/07/54/02/263075402.db2.gz	JZICIVNCZUNIOD-VHZYLWGESA-N	1	0	282.431	4.242	20	30		CIEDRO
C[C@H]([NH2+]CC1CCC(C#N)CC1)c1cc(Cl)ccc1O	ZINC000282256085	263075436	/nfs/dbraw/zinc/07/54/36/263075436.db2.gz	JTIMRUFHEMUGSR-HIFPTAJRSA-N	1	0	292.810	4.026	20	30		CIEDRO
CSc1ccccc1[C@H](C)[NH2+][C@@H]1CCC[C@@H](C#N)C1	ZINC000282355254	263076060	/nfs/dbraw/zinc/07/60/60/263076060.db2.gz	PMOPNWLPUBHAPX-BFHYXJOUSA-N	1	0	274.433	4.141	20	30		CIEDRO
CSc1ccccc1[C@H](C)[NH2+][C@H]1CCC[C@H](C#N)C1	ZINC000282355257	263076137	/nfs/dbraw/zinc/07/61/37/263076137.db2.gz	PMOPNWLPUBHAPX-IHRRRGAJSA-N	1	0	274.433	4.141	20	30		CIEDRO
CCN(C)c1ccc([C@H](C)[NH2+]CC2CCC(C#N)CC2)cc1	ZINC000282456045	263076772	/nfs/dbraw/zinc/07/67/72/263076772.db2.gz	VIPSJLLXDJNNMU-GTPINHCMSA-N	1	0	299.462	4.123	20	30		CIEDRO
CSc1ccccc1[C@@H](C)[NH2+][C@H]1CCC[C@@H](C#N)C1	ZINC000282780545	263078826	/nfs/dbraw/zinc/07/88/26/263078826.db2.gz	PMOPNWLPUBHAPX-MCIONIFRSA-N	1	0	274.433	4.141	20	30		CIEDRO
CC[C@@H](c1cccc(OC)c1)[N@H+](C)CCCC(C)(C)C#N	ZINC000289451121	263110197	/nfs/dbraw/zinc/11/01/97/263110197.db2.gz	PDKVRIQVTIXKER-KRWDZBQOSA-N	1	0	288.435	4.408	20	30		CIEDRO
CC[C@@H](CC#N)[NH2+]C[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000289485569	263110542	/nfs/dbraw/zinc/11/05/42/263110542.db2.gz	BEGMPFXZTBKITB-FZMZJTMJSA-N	1	0	284.325	4.091	20	30		CIEDRO
Cc1cc(C[NH2+][C@@H](CCC#N)c2ccccc2)cc(C)c1O	ZINC000290425122	263116552	/nfs/dbraw/zinc/11/65/52/263116552.db2.gz	RHQBGWPNHUCPLR-SFHVURJKSA-N	1	0	294.398	4.144	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]Cc1ccc(C2CC2)cc1F	ZINC000291641776	263124448	/nfs/dbraw/zinc/12/44/48/263124448.db2.gz	BRCXHMVBTPRFKM-UHFFFAOYSA-N	1	0	274.383	4.123	20	30		CIEDRO
C[C@]1(CCc2ccccc2)CC[N@@H+]([C@@H]2CC[C@@H](C#N)C2)C1	ZINC000292914707	263136283	/nfs/dbraw/zinc/13/62/83/263136283.db2.gz	XKZAKKHPEKCESI-QRVBRYPASA-N	1	0	282.431	4.023	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H]1CCCOc2ccccc21	ZINC000340427195	263142034	/nfs/dbraw/zinc/14/20/34/263142034.db2.gz	MJPWCWJGGJWUKY-HNNXBMFYSA-N	1	0	259.393	4.092	20	30		CIEDRO
C=C(C[NH2+]Cc1ccc2ncccc2c1)c1ccccc1	ZINC000340437577	263147300	/nfs/dbraw/zinc/14/73/00/263147300.db2.gz	XJAQJNILJWPZOG-UHFFFAOYSA-N	1	0	274.367	4.038	20	30		CIEDRO
Cc1cncc([C@H](C)[NH2+][C@H](CCCC#N)c2ccccc2)c1	ZINC000340438016	263147828	/nfs/dbraw/zinc/14/78/28/263147828.db2.gz	XYRXXEGMIZJWJO-QFBILLFUSA-N	1	0	293.414	4.476	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](CCCC#N)c1ccccc1)c1cncc(F)c1	ZINC000340446005	263152490	/nfs/dbraw/zinc/15/24/90/263152490.db2.gz	MWBVVLRKNQZOTR-KDOFPFPSSA-N	1	0	297.377	4.306	20	30		CIEDRO
N#CCCC[C@@H]([NH2+]C1CCCCC1)c1ccccc1	ZINC000340447911	263154226	/nfs/dbraw/zinc/15/42/26/263154226.db2.gz	HOZAINNCRSFUHW-QGZVFWFLSA-N	1	0	256.393	4.344	20	30		CIEDRO
CC[C@@H]([NH2+][C@H](CCCC#N)c1ccccc1)C1CC1	ZINC000340451024	263155274	/nfs/dbraw/zinc/15/52/74/263155274.db2.gz	ZDMRFWKYQCRZGY-IAGOWNOFSA-N	1	0	256.393	4.200	20	30		CIEDRO
C[C@H]([NH2+][C@@H](CCCC#N)c1ccccc1)c1ccco1	ZINC000340449747	263155672	/nfs/dbraw/zinc/15/56/72/263155672.db2.gz	WQBBGEMGOAXZSA-HOCLYGCPSA-N	1	0	268.360	4.365	20	30		CIEDRO
COC[C@@H](CC(C)C)[NH2+][C@@H](CCCC#N)c1ccccc1	ZINC000340451101	263155988	/nfs/dbraw/zinc/15/59/88/263155988.db2.gz	ZXTXHAZAANXTEK-MSOLQXFVSA-N	1	0	288.435	4.072	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH+]2CCC(c3cccc(Cl)c3)CC2)C1	ZINC000294203248	263157500	/nfs/dbraw/zinc/15/75/00/263157500.db2.gz	RNGHZDKPHCGUPO-DYVFJYSZSA-N	1	0	288.822	4.212	20	30		CIEDRO
CC(C)C[C@H](C)[NH2+][C@@H](CCCC#N)c1ccccc1	ZINC000340454944	263158134	/nfs/dbraw/zinc/15/81/34/263158134.db2.gz	UDYVNRZKBDIDPJ-RDJZCZTQSA-N	1	0	258.409	4.446	20	30		CIEDRO
CC(C)C[C@H](C)[NH2+][C@H](CCCC#N)c1ccccc1	ZINC000340454942	263158163	/nfs/dbraw/zinc/15/81/63/263158163.db2.gz	UDYVNRZKBDIDPJ-DOTOQJQBSA-N	1	0	258.409	4.446	20	30		CIEDRO
CC[C@H](C)[C@@H](C)[NH2+][C@H](CCCC#N)c1ccccc1	ZINC000340461472	263161432	/nfs/dbraw/zinc/16/14/32/263161432.db2.gz	ZIZLGVDWGZVAFN-ZMSDIMECSA-N	1	0	258.409	4.446	20	30		CIEDRO
CCC[C@@H](Cc1ccccc1)[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000294943826	263169684	/nfs/dbraw/zinc/16/96/84/263169684.db2.gz	CMNYXSJSFVLHHQ-BZSNNMDCSA-N	1	0	270.420	4.070	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+]Cc2cc3ccccc3s2)C1	ZINC000294943690	263169775	/nfs/dbraw/zinc/16/97/75/263169775.db2.gz	CLUSTBDFCQWMNP-JSGCOSHPSA-N	1	0	270.401	4.073	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@H]2CCCC[C@H]2c2ccccc2)C1	ZINC000295008397	263170748	/nfs/dbraw/zinc/17/07/48/263170748.db2.gz	JEWPDUTYYKAVHO-WNHJNPCNSA-N	1	0	282.431	4.385	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+]Cc2cccc(Cl)c2Cl)C1	ZINC000295061099	263171476	/nfs/dbraw/zinc/17/14/76/263171476.db2.gz	OHNLHUBRGRTCFA-JQWIXIFHSA-N	1	0	283.202	4.165	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccccc1C(F)(F)F	ZINC000295106798	263172239	/nfs/dbraw/zinc/17/22/39/263172239.db2.gz	UIXINKUKJRWZCE-AVGNSLFASA-N	1	0	296.336	4.438	20	30		CIEDRO
CSc1ccccc1C[C@@H](C)[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000295140030	263172980	/nfs/dbraw/zinc/17/29/80/263172980.db2.gz	ZLLDWTRVMYNIGX-YCPHGPKFSA-N	1	0	288.460	4.011	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+]Cc2ccc(C3CCC3)cc2)C1	ZINC000295140064	263173042	/nfs/dbraw/zinc/17/30/42/263173042.db2.gz	ZMBGVURNEJUTJE-KSSFIOAISA-N	1	0	268.404	4.126	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)C(C)(C)c1ccccc1	ZINC000295863622	263183022	/nfs/dbraw/zinc/18/30/22/263183022.db2.gz	BSGDUOFUEUIGOJ-VYDXJSESSA-N	1	0	270.420	4.025	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1cc2c(cc1O)CCCC2	ZINC000296256826	263188208	/nfs/dbraw/zinc/18/82/08/263188208.db2.gz	DCISZLGYMVVVRI-KEYYUXOJSA-N	1	0	298.430	4.004	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1cccc(C(F)(F)F)c1	ZINC000296319881	263190110	/nfs/dbraw/zinc/19/01/10/263190110.db2.gz	GUBWARDBFBBGKD-XUJVJEKNSA-N	1	0	296.336	4.438	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1cnc2ccsc2c1	ZINC000296442742	263191636	/nfs/dbraw/zinc/19/16/36/263191636.db2.gz	MJLQLUKYZFVDQG-OBJOEFQTSA-N	1	0	285.416	4.029	20	30		CIEDRO
Cc1ccc([C@@H](C)[NH2+][C@H]2CC[C@@H](CC#N)C2)cc1C	ZINC000296462376	263191929	/nfs/dbraw/zinc/19/19/29/263191929.db2.gz	NIOSJBIMHYSXHQ-VYDXJSESSA-N	1	0	256.393	4.036	20	30		CIEDRO
CC[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1cc(C)ccc1OC	ZINC000296508111	263192292	/nfs/dbraw/zinc/19/22/92/263192292.db2.gz	PIXQAIMPFWURMH-YQQAZPJKSA-N	1	0	286.419	4.127	20	30		CIEDRO
COc1cc(C)c([C@@H](C)[NH2+][C@H]2CC[C@@H](CC#N)C2)cc1C	ZINC000296621223	263194413	/nfs/dbraw/zinc/19/44/13/263194413.db2.gz	WWVBMUSMIAIUDJ-PMPSAXMXSA-N	1	0	286.419	4.045	20	30		CIEDRO
CC(C)CC[C@@H]([NH2+]CC1(CC#N)CC1)c1ccoc1	ZINC000353589660	263205191	/nfs/dbraw/zinc/20/51/91/263205191.db2.gz	RWUJZWBNYOJTLR-OAHLLOKOSA-N	1	0	260.381	4.040	20	30		CIEDRO
C[C@H](CCC#N)[NH2+][C@@H](C)c1ccc(Oc2cccnc2)cc1	ZINC000298650820	263223360	/nfs/dbraw/zinc/22/33/60/263223360.db2.gz	XLBYCFIGZMTECR-CABCVRRESA-N	1	0	295.386	4.217	20	30		CIEDRO
C[C@@H](c1ccc(C(F)(F)F)cc1)[N@H+](C)CCCC#N	ZINC000299361019	263240388	/nfs/dbraw/zinc/24/03/88/263240388.db2.gz	IRUAJCHXJDFXBR-NSHDSACASA-N	1	0	270.298	4.002	20	30		CIEDRO
N#CC1(c2ccccc2)CCC([NH2+]Cc2cccs2)CC1	ZINC000299373015	263241214	/nfs/dbraw/zinc/24/12/14/263241214.db2.gz	TZNROMHDVDVMLJ-UHFFFAOYSA-N	1	0	296.439	4.242	20	30		CIEDRO
C[C@@H](CCC#N)[NH2+][C@@H](C)c1cccc2ccccc21	ZINC000299566195	263247497	/nfs/dbraw/zinc/24/74/97/263247497.db2.gz	HBMZZTRTGPNLMH-KBPBESRZSA-N	1	0	252.361	4.183	20	30		CIEDRO
C[C@H](CCC#N)[NH2+][C@H](C)c1cccc2ccccc21	ZINC000299566205	263247614	/nfs/dbraw/zinc/24/76/14/263247614.db2.gz	HBMZZTRTGPNLMH-ZIAGYGMSSA-N	1	0	252.361	4.183	20	30		CIEDRO
Cc1ccc(C[N@@H+](C)[C@H](C)c2cccc(C#N)c2)s1	ZINC000187675168	263266105	/nfs/dbraw/zinc/26/61/05/263266105.db2.gz	BFYORFVCIJJNPT-CYBMUJFWSA-N	1	0	270.401	4.121	20	30		CIEDRO
CC(C)(C)C[C@H]([NH2+]CCCSCC#N)c1ccccc1	ZINC000341596199	263343801	/nfs/dbraw/zinc/34/38/01/263343801.db2.gz	MOPMXGKXXKFZJR-INIZCTEOSA-N	1	0	290.476	4.400	20	30		CIEDRO
N#CCCC[NH2+][C@@H](Cc1ccc(F)cc1)c1ccccc1	ZINC000341644858	263345629	/nfs/dbraw/zinc/34/56/29/263345629.db2.gz	ZJKLQPHCWZFDIR-SFHVURJKSA-N	1	0	282.362	4.003	20	30		CIEDRO
N#CCCC[NH2+][C@H](Cc1ccc(F)cc1)c1ccccc1	ZINC000341644829	263345715	/nfs/dbraw/zinc/34/57/15/263345715.db2.gz	ZJKLQPHCWZFDIR-GOSISDBHSA-N	1	0	282.362	4.003	20	30		CIEDRO
C=CCSCC[NH2+][C@H]1CCCOc2cc(Cl)ccc21	ZINC000341828392	263353141	/nfs/dbraw/zinc/35/31/41/263353141.db2.gz	SWFHFPBPSGZXDZ-AWEZNQCLSA-N	1	0	297.851	4.063	20	30		CIEDRO
C=C(C)[C@H]([NH2+][C@@H]1CC[C@@H]1SC)c1ccc(F)c(F)c1	ZINC000425333714	264010997	/nfs/dbraw/zinc/01/09/97/264010997.db2.gz	FMOCLLRJUGLMLD-ILXRZTDVSA-N	1	0	283.387	4.066	20	30		CIEDRO
CC(C)C[C@H](C[NH2+][C@@H]1CC[C@H](C#N)C1)c1ccccc1	ZINC000425351645	264122542	/nfs/dbraw/zinc/12/25/42/264122542.db2.gz	JNIXPBNYDYWZOG-CGTJXYLNSA-N	1	0	270.420	4.098	20	30		CIEDRO
CC(C)C[C@@H](C[NH2+][C@@H]1CC[C@H](C#N)C1)c1ccccc1	ZINC000425351648	264122906	/nfs/dbraw/zinc/12/29/06/264122906.db2.gz	JNIXPBNYDYWZOG-RYQLBKOJSA-N	1	0	270.420	4.098	20	30		CIEDRO
C[C@H](c1cccc(C#N)c1)[N@H+](C)Cc1scnc1C1CC1	ZINC000425364940	264210800	/nfs/dbraw/zinc/21/08/00/264210800.db2.gz	HYCNTGAKTIDMFA-GFCCVEGCSA-N	1	0	297.427	4.085	20	30		CIEDRO
CCOc1cccc(C[N@H+](C)[C@@H](C)c2cccc(C#N)c2)c1	ZINC000425365539	264211455	/nfs/dbraw/zinc/21/14/55/264211455.db2.gz	LKYQDKIOWYIUDV-HNNXBMFYSA-N	1	0	294.398	4.150	20	30		CIEDRO
C=C[C@@H](C)[NH2+][C@@H](CC)c1cccc(Br)c1	ZINC000157284052	264289060	/nfs/dbraw/zinc/28/90/60/264289060.db2.gz	YTGLWOCLCKOWFR-MFKMUULPSA-N	1	0	268.198	4.064	20	30		CIEDRO
CC[N@H+](Cc1ccc(OC)cc1)[C@H](C)c1cccc(C#N)c1	ZINC000189792383	264326561	/nfs/dbraw/zinc/32/65/61/264326561.db2.gz	KMRLHINHIABTPB-OAHLLOKOSA-N	1	0	294.398	4.150	20	30		CIEDRO
CC[N@H+](CCCC(C)(C)C#N)Cc1c[nH]c2ccccc12	ZINC000190495164	264360084	/nfs/dbraw/zinc/36/00/84/264360084.db2.gz	LLZYGBURPYZMIR-UHFFFAOYSA-N	1	0	283.419	4.320	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@@H](C)c1cc2ccccc2o1	ZINC000280896234	264451048	/nfs/dbraw/zinc/45/10/48/264451048.db2.gz	QMROYLZIVPCRFX-JOQOYGCGSA-N	1	0	285.387	4.065	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H]1CCO[C@H](C(C)C)C1)c1ccco1	ZINC000286373488	264577839	/nfs/dbraw/zinc/57/78/39/264577839.db2.gz	ZSASDJQQJZYENX-VYDXJSESSA-N	1	0	277.408	4.080	20	30		CIEDRO
C=CCCCCCC[NH2+][C@H](C)c1ccc([S@](C)=O)cc1	ZINC000286875567	264593256	/nfs/dbraw/zinc/59/32/56/264593256.db2.gz	CCEWDITUXHPVKY-QRWLVFNGSA-N	1	0	293.476	4.211	20	30		CIEDRO
N#CCCCN1CCC(c2c(Cl)cccc2Cl)CC1	ZINC000344026950	265052012	/nfs/dbraw/zinc/05/20/12/265052012.db2.gz	KEPXYPHOFFGFDT-UHFFFAOYSA-N	1	0	297.229	4.477	20	30		CIEDRO
C[C@@H]1CCCC[C@@H]1C[NH2+][C@@H](CCC#N)c1ccccc1	ZINC000344300055	265057097	/nfs/dbraw/zinc/05/70/97/265057097.db2.gz	HZQWFERGDLEGFI-NXHRZFHOSA-N	1	0	270.420	4.447	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@@H](C)C[C@@H]1C)c1ccc(C#N)cc1	ZINC000226160531	266001784	/nfs/dbraw/zinc/00/17/84/266001784.db2.gz	MDFUZKDPSUNCOT-OEUWWYETSA-N	1	0	256.393	4.034	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)cc1)c1ccc(C2CC2)cc1	ZINC000418107924	266111055	/nfs/dbraw/zinc/11/10/55/266111055.db2.gz	FJTSJAGOGLITCB-AWEZNQCLSA-N	1	0	276.383	4.286	20	30		CIEDRO
CCC[N@H+](CCCC#N)[C@@H]1C[C@H](OCC)C12CCCCC2	ZINC000357776105	266358324	/nfs/dbraw/zinc/35/83/24/266358324.db2.gz	SJZUDFRAVVACHY-SJORKVTESA-N	1	0	292.467	4.130	20	30		CIEDRO
CC(C)CC[C@@H](C)[NH2+][C@H](CCC#N)c1ccccc1	ZINC000358337972	266454231	/nfs/dbraw/zinc/45/42/31/266454231.db2.gz	GHCGZUFVHYKHLZ-NVXWUHKLSA-N	1	0	258.409	4.446	20	30		CIEDRO
C=CCN1CCC([NH2+][C@@H]2CCC(C)(C)c3ccccc32)CC1	ZINC000360840074	266746678	/nfs/dbraw/zinc/74/66/78/266746678.db2.gz	KZRYCRQFENSIFW-LJQANCHMSA-N	1	0	298.474	4.039	20	30		CIEDRO
N#CCCCC[NH2+][C@@H]1CCCCc2ccc(Cl)cc21	ZINC000361110554	266785738	/nfs/dbraw/zinc/78/57/38/266785738.db2.gz	HDXSMVPCDBFNFQ-MRXNPFEDSA-N	1	0	276.811	4.391	20	30		CIEDRO
Cc1cc(C)c2c(c1)[C@H]([NH2+]CC(C)(C)CCC#N)CCO2	ZINC000369672768	267257926	/nfs/dbraw/zinc/25/79/26/267257926.db2.gz	SZOHQFBRJKRMPB-MRXNPFEDSA-N	1	0	286.419	4.047	20	30		CIEDRO
C=C[C@H](C)[NH2+][C@@H]1CCSc2c(Cl)cccc21	ZINC000119360726	267325411	/nfs/dbraw/zinc/32/54/11/267325411.db2.gz	RILQVBMMCJGOLZ-JOYOIKCWSA-N	1	0	253.798	4.041	20	30		CIEDRO
N#CC1(C[NH2+]Cc2ccc(-c3ccccc3)s2)CCC1	ZINC000418145855	267366638	/nfs/dbraw/zinc/36/66/38/267366638.db2.gz	YYNZDHPDKFOLRB-UHFFFAOYSA-N	1	0	282.412	4.199	20	30		CIEDRO
N#CC1(C[NH2+]CC(c2ccccc2)c2ccccc2)CCC1	ZINC000418135317	267367762	/nfs/dbraw/zinc/36/77/62/267367762.db2.gz	AKDBOVQRDCMJOX-UHFFFAOYSA-N	1	0	290.410	4.102	20	30		CIEDRO
Cc1cccc(C[NH2+][C@@H]2CCCc3cc(C#N)ccc32)c1F	ZINC000418136873	267368726	/nfs/dbraw/zinc/36/87/26/267368726.db2.gz	BDMOTAUKCQDUKF-GOSISDBHSA-N	1	0	294.373	4.173	20	30		CIEDRO
Cc1sccc1C[NH2+][C@H]1CCCc2cc(C#N)ccc21	ZINC000418149513	267375548	/nfs/dbraw/zinc/37/55/48/267375548.db2.gz	VITMEVWXZNAFBK-KRWDZBQOSA-N	1	0	282.412	4.095	20	30		CIEDRO
N#CCCCC[NH2+][C@@H]1CCCC[C@@H](c2ccccc2)C1	ZINC000371367694	267395431	/nfs/dbraw/zinc/39/54/31/267395431.db2.gz	BIFGBLDPAKYBTP-QZTJIDSGSA-N	1	0	270.420	4.386	20	30		CIEDRO
C[C@H]1C[C@H](c2ccsc2)C[N@@H+]1CC(C)(C)CCC#N	ZINC000371399070	267399797	/nfs/dbraw/zinc/39/97/97/267399797.db2.gz	WGTBRELNEZVXQS-ZFWWWQNUSA-N	1	0	276.449	4.256	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1CCCc2cc(F)ccc21	ZINC000122309994	267832891	/nfs/dbraw/zinc/83/28/91/267832891.db2.gz	YCINAQJBHJRMAY-MRXNPFEDSA-N	1	0	274.383	4.123	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1CC[C@H](c2ccccc2F)C1	ZINC000377089199	268046393	/nfs/dbraw/zinc/04/63/93/268046393.db2.gz	GPCSBMILVNPKOR-LSDHHAIUSA-N	1	0	288.410	4.381	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H]1CC[C@H](c2ccccc2F)C1	ZINC000377089196	268046396	/nfs/dbraw/zinc/04/63/96/268046396.db2.gz	GPCSBMILVNPKOR-GJZGRUSLSA-N	1	0	288.410	4.381	20	30		CIEDRO
CCc1ccc(C[NH2+][C@H](C)c2cccc(C#N)c2)s1	ZINC000174432010	327644092	/nfs/dbraw/zinc/64/40/92/327644092.db2.gz	JJKGFPQZXUGSQK-GFCCVEGCSA-N	1	0	270.401	4.033	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@H](C)c1nc2ccccc2n1CC	ZINC000186058046	327680776	/nfs/dbraw/zinc/68/07/76/327680776.db2.gz	BTOKCRYXDDPOHS-UONOGXRCSA-N	1	0	271.408	4.062	20	30		CIEDRO
C=CC[C@H](CO)[NH2+][C@@H](C)c1cc2c(ccc3ccccc23)o1	ZINC000186711445	327701031	/nfs/dbraw/zinc/70/10/31/327701031.db2.gz	SVHBHMRKZYOSHQ-DZGCQCFKSA-N	1	0	295.382	4.174	20	30		CIEDRO
N#Cc1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[C@H]3CCC[C@H]3C1)CC2	ZINC000580261969	327750876	/nfs/dbraw/zinc/75/08/76/327750876.db2.gz	BQDQFRIVUXPRMV-NOCIGQNYSA-N	1	0	280.415	4.104	20	30		CIEDRO
CC(C)C[C@@H]([NH2+]CCCCC#N)c1cccs1	ZINC000178646797	327795296	/nfs/dbraw/zinc/79/52/96/327795296.db2.gz	ZFDNSUDBGTZPMZ-CYBMUJFWSA-N	1	0	250.411	4.119	20	30		CIEDRO
C[C@H]([NH2+]CCCCC#N)c1cc(Cl)ccc1Cl	ZINC000178649330	327795354	/nfs/dbraw/zinc/79/53/54/327795354.db2.gz	OMNVFSDDAZYAHV-JTQLQIEISA-N	1	0	271.191	4.338	20	30		CIEDRO
CC(C)C[C@H]([NH2+]CCCCC#N)c1cccs1	ZINC000178646786	327795431	/nfs/dbraw/zinc/79/54/31/327795431.db2.gz	ZFDNSUDBGTZPMZ-ZDUSSCGKSA-N	1	0	250.411	4.119	20	30		CIEDRO
CC(C)[C@@H](C[NH2+][C@@H](C)c1cccc(C#N)c1)c1cccnc1	ZINC000181868487	327810827	/nfs/dbraw/zinc/81/08/27/327810827.db2.gz	UCQAXBOLTDZHML-HNAYVOBHSA-N	1	0	293.414	4.044	20	30		CIEDRO
C[N@H+](CCC(C)(C)C#N)Cc1ccc(Cl)c(Cl)c1	ZINC000534215876	328039540	/nfs/dbraw/zinc/03/95/40/328039540.db2.gz	WVGWZUOLUDTNMJ-UHFFFAOYSA-N	1	0	285.218	4.365	20	30		CIEDRO
C[C@@H]1CC[N@H+](CC(C)(C)CCC#N)[C@H]2CCCC[C@H]12	ZINC000534337778	328049473	/nfs/dbraw/zinc/04/94/73/328049473.db2.gz	FYACIWQBKLDBPS-OAGGEKHMSA-N	1	0	262.441	4.217	20	30		CIEDRO
Cc1ccc2c(C)cc(N3CCC(CCC#N)CC3)nc2c1	ZINC000563531231	328072210	/nfs/dbraw/zinc/07/22/10/328072210.db2.gz	CSQYLQSNNBGBBZ-UHFFFAOYSA-N	1	0	293.414	4.372	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+]Cc1ccc2[nH]c(C)cc2c1	ZINC000571069743	328083755	/nfs/dbraw/zinc/08/37/55/328083755.db2.gz	YMULVLLJFKYHLZ-MRXNPFEDSA-N	1	0	256.393	4.311	20	30		CIEDRO
N#CC1(CC[N@@H+]2CCC[C@@H]2c2cccnc2)CCCCC1	ZINC000411405760	328087537	/nfs/dbraw/zinc/08/75/37/328087537.db2.gz	AIYVJNYHFBTOGV-QGZVFWFLSA-N	1	0	283.419	4.083	20	30		CIEDRO
N#Cc1ccc2c(c1)[C@@H]([NH2+][C@@H](c1cccs1)C1CC1)CC2	ZINC000571092121	328084962	/nfs/dbraw/zinc/08/49/62/328084962.db2.gz	ITNARYXSZQOKRM-FUHWJXTLSA-N	1	0	294.423	4.348	20	30		CIEDRO
N#CC1(CC[N@@H+]2CCC[C@H]2c2cccnc2)CCCCC1	ZINC000411405759	328087615	/nfs/dbraw/zinc/08/76/15/328087615.db2.gz	AIYVJNYHFBTOGV-KRWDZBQOSA-N	1	0	283.419	4.083	20	30		CIEDRO
N#CC1CCC(C[NH2+][C@@H]2CCc3cc(Cl)ccc32)CC1	ZINC000506207115	332765877	/nfs/dbraw/zinc/76/58/77/332765877.db2.gz	XFWMZHIIFPEZDF-QWQCLYJRSA-N	1	0	288.822	4.247	20	30		CIEDRO
Cc1ccccc1C[C@H](C)[N@H+](C)Cc1cccc(C#N)c1F	ZINC000571251305	328094594	/nfs/dbraw/zinc/09/45/94/328094594.db2.gz	RAOYOSNGJNINAS-HNNXBMFYSA-N	1	0	296.389	4.069	20	30		CIEDRO
C=CCCC[NH2+][C@H](C)c1ccc(Oc2cccnc2)cc1	ZINC000571239131	328094739	/nfs/dbraw/zinc/09/47/39/328094739.db2.gz	CHGAOYFVVJTSNA-OAHLLOKOSA-N	1	0	282.387	4.491	20	30		CIEDRO
CC(C)(C)O[C@@H]1C[C@H]([NH2+]CCCCC(C)(C)C#N)C1(C)C	ZINC000412082891	328103038	/nfs/dbraw/zinc/10/30/38/328103038.db2.gz	STFDGSSXNNXNPQ-LSDHHAIUSA-N	1	0	294.483	4.278	20	30		CIEDRO
C=CCOc1cccc(C[NH2+][C@H]2CCCc3sccc32)c1	ZINC000160990397	328113835	/nfs/dbraw/zinc/11/38/35/328113835.db2.gz	CVJXEYGDESKRKX-KRWDZBQOSA-N	1	0	299.439	4.480	20	30		CIEDRO
C=C(C)C[NH+](CC)[C@H](C)C(=O)Nc1cccc2ccccc21	ZINC000216166837	328115416	/nfs/dbraw/zinc/11/54/16/328115416.db2.gz	LSZIRASJWPQUDK-OAHLLOKOSA-N	1	0	296.414	4.065	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H](C)c2ncccc2CC)cc1	ZINC000571391039	328118765	/nfs/dbraw/zinc/11/87/65/328118765.db2.gz	WBPCSIWBQZQJQH-OAHLLOKOSA-N	1	0	296.414	4.060	20	30		CIEDRO
C=CC[C@@H](C)[C@H](C)[NH2+][C@H]1C[C@H](c2cc(F)cc(F)c2)C1	ZINC000436306352	328155823	/nfs/dbraw/zinc/15/58/23/328155823.db2.gz	HXSAZTLUROEDCZ-DMVWFOPNSA-N	1	0	279.374	4.401	20	30		CIEDRO
COc1ccc(-c2ccccc2)cc1C[NH2+]CCCCC#N	ZINC000268380903	328184645	/nfs/dbraw/zinc/18/46/45/328184645.db2.gz	YDXVWIOYWAOSBT-UHFFFAOYSA-N	1	0	294.398	4.146	20	30		CIEDRO
CCc1nc(C)c([C@@H](C)[NH2+][C@@H](C)c2ccc(C#N)cc2)s1	ZINC000268815212	328186296	/nfs/dbraw/zinc/18/62/96/328186296.db2.gz	PPPRJCFZUSAXSX-NWDGAFQWSA-N	1	0	299.443	4.297	20	30		CIEDRO
C[C@@H]([NH2+]CCCC(C)(C)C#N)c1ccccc1OC(F)F	ZINC000271630284	328197167	/nfs/dbraw/zinc/19/71/67/328197167.db2.gz	BGMUUPOCCIWTDI-GFCCVEGCSA-N	1	0	296.361	4.269	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CC[C@H](C#N)C1)c1ccccc1OC(F)F	ZINC000274678541	328212739	/nfs/dbraw/zinc/21/27/39/328212739.db2.gz	ZPKYWEFGEUIGPP-OBJOEFQTSA-N	1	0	294.345	4.021	20	30		CIEDRO
N#C[C@H]1CC[C@H]([NH+]2CCC(c3c[nH]c4ccccc43)CC2)C1	ZINC000278527817	328226187	/nfs/dbraw/zinc/22/61/87/328226187.db2.gz	DMEUTTBCMCGDNK-HOCLYGCPSA-N	1	0	293.414	4.040	20	30		CIEDRO
Cc1csc(C2([NH2+]CCCCC(C)(C)C#N)CCC2)n1	ZINC000278545959	328226901	/nfs/dbraw/zinc/22/69/01/328226901.db2.gz	ANLZIDCIAHYSJP-UHFFFAOYSA-N	1	0	291.464	4.140	20	30		CIEDRO
CC1(C)CC[C@@H]([NH2+]CCCCC#N)c2ccccc21	ZINC000280910671	328237111	/nfs/dbraw/zinc/23/71/11/328237111.db2.gz	QLTNQLICZVWNFD-MRXNPFEDSA-N	1	0	256.393	4.083	20	30		CIEDRO
Cc1cc([C@H](C)[NH2+]CC2CCC(C#N)CC2)c(C)s1	ZINC000282500422	328242540	/nfs/dbraw/zinc/24/25/40/328242540.db2.gz	YBCVVCDFGSNBHF-GRTSSRMGSA-N	1	0	276.449	4.346	20	30		CIEDRO
COc1ccc([C@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)C(C)C)cc1	ZINC000295849736	328287498	/nfs/dbraw/zinc/28/74/98/328287498.db2.gz	AXFKGOBZOXFSDD-QILLFSRXSA-N	1	0	286.419	4.064	20	30		CIEDRO
CC(C)[C@H](Cc1ccc(F)cc1)[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000296288733	328290169	/nfs/dbraw/zinc/29/01/69/328290169.db2.gz	FJMYQJMYGBGCDD-SZMVWBNQSA-N	1	0	288.410	4.065	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@@H]2CCSc3ccc(F)cc32)C1	ZINC000296493855	328290829	/nfs/dbraw/zinc/29/08/29/328290829.db2.gz	OTOCDLGXSXRDJY-CORIIIEPSA-N	1	0	290.407	4.035	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@@H](COCC(C)C)c1ccco1	ZINC000531961425	328337085	/nfs/dbraw/zinc/33/70/85/328337085.db2.gz	KRUBRRPSMRAURT-JYJNAYRXSA-N	1	0	279.424	4.184	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1Cc2ccccc2C(C)(C)C1	ZINC000534666722	328345454	/nfs/dbraw/zinc/34/54/54/328345454.db2.gz	SPSQRFAFQRZUAE-UHFFFAOYSA-N	1	0	270.420	4.110	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@H](C)Cc1ccsc1	ZINC000049156423	328350924	/nfs/dbraw/zinc/35/09/24/328350924.db2.gz	DTDRFFVFMYYOBZ-CQSZACIVSA-N	1	0	287.428	4.034	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H](C)c2ccc(C)s2)cc1	ZINC000049158938	328351267	/nfs/dbraw/zinc/35/12/67/328351267.db2.gz	HPFUJFFVAGZKMS-CQSZACIVSA-N	1	0	287.428	4.472	20	30		CIEDRO
CC[C@@H](Cc1ccccc1)[N@H+](C)Cc1ccc(C#N)cc1	ZINC000303892691	328364088	/nfs/dbraw/zinc/36/40/88/328364088.db2.gz	KKEHIGLEBFJUJU-IBGZPJMESA-N	1	0	278.399	4.011	20	30		CIEDRO
C=CCOc1ccc(C[NH+]2C3CCC2CC3)cc1Cl	ZINC000535066811	328383026	/nfs/dbraw/zinc/38/30/26/328383026.db2.gz	SSNKGYLQCWVYRY-UHFFFAOYSA-N	1	0	277.795	4.032	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@@H](CC)c1ccccc1	ZINC000050198468	328391539	/nfs/dbraw/zinc/39/15/39/328391539.db2.gz	FXXMBWHPPHVGEM-SFHVURJKSA-N	1	0	281.399	4.492	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]Cc1cccc(-c2ccncc2)c1	ZINC000342302267	328418286	/nfs/dbraw/zinc/41/82/86/328418286.db2.gz	OGEDEVZYZMDXAY-UHFFFAOYSA-N	1	0	293.414	4.168	20	30		CIEDRO
CCc1cccc(Cl)c1C[NH+]1CCC(CC#N)CC1	ZINC000530547724	326867806	/nfs/dbraw/zinc/86/78/06/326867806.db2.gz	GUBXLJVPUBWPEV-UHFFFAOYSA-N	1	0	276.811	4.028	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](CC)c1ccc(OC)c(OC)c1	ZINC000398081651	326871102	/nfs/dbraw/zinc/87/11/02/326871102.db2.gz	DNFVPTLAXXKTDQ-GOEBONIOSA-N	1	0	291.435	4.489	20	30		CIEDRO
C[C@@H]([NH2+]CCCCC#N)c1ccc(Cl)cc1Cl	ZINC000042224175	326932821	/nfs/dbraw/zinc/93/28/21/326932821.db2.gz	DRKVXCBBAXTWMS-SNVBAGLBSA-N	1	0	271.191	4.338	20	30		CIEDRO
C=CC[C@@H](CO)C[NH2+][C@H](C)c1ccc(SC(C)C)cc1	ZINC000539295859	326935594	/nfs/dbraw/zinc/93/55/94/326935594.db2.gz	ZFRXJZROKYMYCS-HUUCEWRRSA-N	1	0	293.476	4.022	20	30		CIEDRO
C[C@@H](CCc1ccccc1)[NH2+]C1(c2cccc(C#N)c2)CC1	ZINC000556605938	326953418	/nfs/dbraw/zinc/95/34/18/326953418.db2.gz	NMDKORLVYGYKQC-INIZCTEOSA-N	1	0	290.410	4.158	20	30		CIEDRO
CC1(C)CCC[C@H]([NH2+]C2(c3cccc(C#N)c3)CC2)C1	ZINC000556602981	326953876	/nfs/dbraw/zinc/95/38/76/326953876.db2.gz	XCCXJLDWAYQLKZ-INIZCTEOSA-N	1	0	268.404	4.106	20	30		CIEDRO
Cc1c(C[NH2+]C[C@H](C)C#N)sc2c1cccc2Cl	ZINC000556839321	326971165	/nfs/dbraw/zinc/97/11/65/326971165.db2.gz	ARJNQIVEIBEUSV-SECBINFHSA-N	1	0	278.808	4.112	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H](C)c2cc(C)c(C)o2)cc1	ZINC000556915224	326982693	/nfs/dbraw/zinc/98/26/93/326982693.db2.gz	ORIVSXLGESUDHN-AWEZNQCLSA-N	1	0	285.387	4.312	20	30		CIEDRO
C=C(C)C[N@@H+](C)[C@@H](C)Cc1ccccc1C(F)(F)F	ZINC000557445910	327005715	/nfs/dbraw/zinc/00/57/15/327005715.db2.gz	SDQPCIGZJAOSHB-LBPRGKRZSA-N	1	0	271.326	4.144	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H](CC2CC2)c2ccccc2)s1	ZINC000557805935	327028400	/nfs/dbraw/zinc/02/84/00/327028400.db2.gz	WFRZXSDPMNFWHL-QGZVFWFLSA-N	1	0	282.412	4.251	20	30		CIEDRO
C=CC[N@@H+](CCOC)[C@@H](C)c1cccc2ccccc21	ZINC000557923853	327035319	/nfs/dbraw/zinc/03/53/19/327035319.db2.gz	XSOIADMJFUYKLW-HNNXBMFYSA-N	1	0	269.388	4.035	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H](CCc1ccccc1)C(F)F	ZINC000558248942	327081283	/nfs/dbraw/zinc/08/12/83/327081283.db2.gz	WDCZIKABHXGMFS-OAHLLOKOSA-N	1	0	294.389	4.172	20	30		CIEDRO
Cc1ccccc1C[C@H]([NH2+]CC(C)(C)CCC#N)C1CC1	ZINC000558246960	327081389	/nfs/dbraw/zinc/08/13/89/327081389.db2.gz	PZCBEGKHRJIOPU-SFHVURJKSA-N	1	0	284.447	4.236	20	30		CIEDRO
C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+]CC(C)(C)CCC#N	ZINC000558248887	327081396	/nfs/dbraw/zinc/08/13/96/327081396.db2.gz	VIFJSACUTRXHBA-CXAGYDPISA-N	1	0	288.410	4.369	20	30		CIEDRO
N#CCc1ccc(C[NH2+][C@@H]2CCCc3cc(F)ccc32)cc1	ZINC000569339340	327097178	/nfs/dbraw/zinc/09/71/78/327097178.db2.gz	DBUOBUMYWOOJNQ-LJQANCHMSA-N	1	0	294.373	4.059	20	30		CIEDRO
CSc1ccc(C[NH2+][C@H](C)c2ccc(C#N)cc2)s1	ZINC000558482603	327097446	/nfs/dbraw/zinc/09/74/46/327097446.db2.gz	FILZINBTMHCEOH-LLVKDONJSA-N	1	0	288.441	4.192	20	30		CIEDRO
CCCC[C@@H](CC)C[NH+]1CCC(C#N)(c2ccccn2)CC1	ZINC000558627654	327111114	/nfs/dbraw/zinc/11/11/14/327111114.db2.gz	MYRCFRGICPXNHP-QGZVFWFLSA-N	1	0	299.462	4.155	20	30		CIEDRO
CC[C@@H](CC#N)[NH2+][C@H](C)CCc1ccc(C(F)(F)F)cc1	ZINC000559055010	327139235	/nfs/dbraw/zinc/13/92/35/327139235.db2.gz	VZEOWDIYZQAHKG-DOMZBBRYSA-N	1	0	298.352	4.308	20	30		CIEDRO
Cc1cccc(C)c1[C@@H](C)[NH2+]C1CCC(C)(C#N)CC1	ZINC000449244899	327139455	/nfs/dbraw/zinc/13/94/55/327139455.db2.gz	WSATUOVKQCWQRB-KLHKWILBSA-N	1	0	270.420	4.427	20	30		CIEDRO
CCOc1ccc([C@H](C)[NH2+]Cc2ccc(CC#N)cc2)cc1	ZINC000517999193	327144592	/nfs/dbraw/zinc/14/45/92/327144592.db2.gz	JUTYBSCQSRGGQX-HNNXBMFYSA-N	1	0	294.398	4.002	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@H]1CCO[C@@H](CC(C)C)C1	ZINC000539682292	327146368	/nfs/dbraw/zinc/14/63/68/327146368.db2.gz	KLLBJAMAWWPYDH-ULQDDVLXSA-N	1	0	267.457	4.305	20	30		CIEDRO
C=C(C[NH2+][C@@H](C)c1sc(C)nc1C)c1ccccc1	ZINC000211830917	327148924	/nfs/dbraw/zinc/14/89/24/327148924.db2.gz	OODBEXVRHSINEY-LBPRGKRZSA-N	1	0	272.417	4.124	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@@H]1CCCC12CCOCC2	ZINC000449307916	327156247	/nfs/dbraw/zinc/15/62/47/327156247.db2.gz	SLDAWNZYOJABTG-JKSUJKDBSA-N	1	0	265.441	4.060	20	30		CIEDRO
C[C@@H]([NH2+]CC1CCC(F)(F)CC1)c1ccc(C#N)cc1	ZINC000409856365	327166669	/nfs/dbraw/zinc/16/66/69/327166669.db2.gz	KXQOMAKNNYNNFN-GFCCVEGCSA-N	1	0	278.346	4.034	20	30		CIEDRO
C[N@H+](Cc1ccc(C(C)(C)C)cc1)[C@H]1CC[C@@H](C#N)C1	ZINC000569509334	327186879	/nfs/dbraw/zinc/18/68/79/327186879.db2.gz	WGYUMDZGWMQLBA-WBVHZDCISA-N	1	0	270.420	4.108	20	30		CIEDRO
C[N@H+](Cc1ccc(C(C)(C)C)cc1)[C@@H]1CC[C@@H](C#N)C1	ZINC000569509328	327187117	/nfs/dbraw/zinc/18/71/17/327187117.db2.gz	WGYUMDZGWMQLBA-NVXWUHKLSA-N	1	0	270.420	4.108	20	30		CIEDRO
CCCCC[C@H]1CCC[N@@H+]1CCCC1(C#N)CCOCC1	ZINC000410413289	327192703	/nfs/dbraw/zinc/19/27/03/327192703.db2.gz	KCYZMKPALMWGSU-KRWDZBQOSA-N	1	0	292.467	4.132	20	30		CIEDRO
C[C@@H](CCc1cccc(F)c1)[NH2+]Cc1ccc(CC#N)cc1	ZINC000566218974	327199389	/nfs/dbraw/zinc/19/93/89/327199389.db2.gz	BLFCRYKDYFSKIT-HNNXBMFYSA-N	1	0	296.389	4.003	20	30		CIEDRO
C=CCCC[NH2+][C@H](C)c1ccc(F)cc1OC(F)F	ZINC000448030458	327211410	/nfs/dbraw/zinc/21/14/10/327211410.db2.gz	SDYJNHSUBHMQDX-SNVBAGLBSA-N	1	0	273.298	4.044	20	30		CIEDRO
CCC(C)(C)C1CCC([NH2+]CCCCC#N)CC1	ZINC000236840639	327211896	/nfs/dbraw/zinc/21/18/96/327211896.db2.gz	FXFHHTXDSYPJKN-UHFFFAOYSA-N	1	0	250.430	4.265	20	30		CIEDRO
C[N@H+](CCCCC#N)Cc1cc(Cl)cc(Cl)c1	ZINC000102397579	327226813	/nfs/dbraw/zinc/22/68/13/327226813.db2.gz	LNMUACCBECQDSA-UHFFFAOYSA-N	1	0	271.191	4.119	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H]1CCc2ccc(OC(F)(F)F)cc21	ZINC000537969914	327239276	/nfs/dbraw/zinc/23/92/76/327239276.db2.gz	XPSLJVAGIHJEIT-YGRLFVJLSA-N	1	0	285.309	4.127	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H](C)c1cncnc1C)c1ccccc1	ZINC000564472050	327241607	/nfs/dbraw/zinc/24/16/07/327241607.db2.gz	XYNDBTLBRRQOEV-YJBOKZPZSA-N	1	0	281.403	4.143	20	30		CIEDRO
CC[C@@H]1CCC[C@H]([NH2+][C@@H]2CCc3ccc(C#N)cc32)C1	ZINC000573848403	327263613	/nfs/dbraw/zinc/26/36/13/327263613.db2.gz	QLSGCWGEDKKXGN-RPVQJOFSSA-N	1	0	268.404	4.104	20	30		CIEDRO
C=CC[C@@H](C)[C@H](C)[NH2+]Cc1ccc(NCCC)cc1	ZINC000560002492	327276687	/nfs/dbraw/zinc/27/66/87/327276687.db2.gz	LLQOYBGMFHZSLP-CABCVRRESA-N	1	0	260.425	4.199	20	30		CIEDRO
Cc1ccc(C2CC([NH2+]Cc3ccc(CC#N)cc3)C2)cc1	ZINC000564963212	327280588	/nfs/dbraw/zinc/28/05/88/327280588.db2.gz	HOWZTMAPEVBUJY-UHFFFAOYSA-N	1	0	290.410	4.097	20	30		CIEDRO
C[C@@H](CC[NH2+]C1(c2cccc(C#N)c2)CC1)c1ccccc1	ZINC000560285418	327296647	/nfs/dbraw/zinc/29/66/47/327296647.db2.gz	PRIYZTCNNHXFMT-INIZCTEOSA-N	1	0	290.410	4.331	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)c1ccc(OCc2cccnc2)cc1	ZINC000560462082	327310845	/nfs/dbraw/zinc/31/08/45/327310845.db2.gz	ZCSDNSSWWYYKTN-MRXNPFEDSA-N	1	0	296.414	4.277	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccc(OCC)cc1)c1ccco1	ZINC000560525988	327318659	/nfs/dbraw/zinc/31/86/59/327318659.db2.gz	CTXYHZILZGDPJD-KRWDZBQOSA-N	1	0	285.387	4.475	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCc1sccc1C)c1ccco1	ZINC000560543887	327321608	/nfs/dbraw/zinc/32/16/08/327321608.db2.gz	DAOAZFQQYUOBBX-AWEZNQCLSA-N	1	0	275.417	4.489	20	30		CIEDRO
CCc1ccc([C@@H]2CC[N@H+](CC(C)(C)CCC#N)C2)cc1	ZINC000560544001	327321650	/nfs/dbraw/zinc/32/16/50/327321650.db2.gz	YAKRRXCYCLLAMT-GOSISDBHSA-N	1	0	284.447	4.368	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@H](C)C(F)(F)F)c1ccco1	ZINC000560548677	327323234	/nfs/dbraw/zinc/32/32/34/327323234.db2.gz	RIEODENULZJARC-WDEREUQCSA-N	1	0	261.287	4.075	20	30		CIEDRO
C=CC[C@@H](C)[C@H](C)[NH2+]Cc1c(F)cccc1N1CCCC1	ZINC000560569663	327325532	/nfs/dbraw/zinc/32/55/32/327325532.db2.gz	IDPCAHNDFABYMI-CABCVRRESA-N	1	0	290.426	4.116	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)c1cc(C)ccc1OC(F)F	ZINC000560897134	327350588	/nfs/dbraw/zinc/35/05/88/327350588.db2.gz	AGDUNEGSBUJQIQ-NWDGAFQWSA-N	1	0	269.335	4.212	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+]Cc1cn2cc(Cl)ccc2n1	ZINC000560923963	327352450	/nfs/dbraw/zinc/35/24/50/327352450.db2.gz	DHFRJTPTKZDJAN-ZDUSSCGKSA-N	1	0	291.826	4.212	20	30		CIEDRO
CC1=C[C@H](C)C[C@H](C[NH2+][C@H](C)c2ccc(C#N)cc2)C1	ZINC000300154453	332798047	/nfs/dbraw/zinc/79/80/47/332798047.db2.gz	GGDPMUBVTMZYPF-LXZKKBNFSA-N	1	0	268.404	4.201	20	30		CIEDRO
CC(C)(C#N)CC[NH+]1CCC(Cc2cccc(F)c2)CC1	ZINC000561343765	327387734	/nfs/dbraw/zinc/38/77/34/327387734.db2.gz	CXNPGOAZCSSTLY-UHFFFAOYSA-N	1	0	288.410	4.020	20	30		CIEDRO
C[C@H](c1ccccc1)[N@H+](CC1CCC1)CC1(C#N)CC1	ZINC000561367053	327389562	/nfs/dbraw/zinc/38/95/62/327389562.db2.gz	BYXJWKTWZCTIOT-OAHLLOKOSA-N	1	0	268.404	4.153	20	30		CIEDRO
CC[C@H](Cc1ccc(C)cc1)[NH2+]Cc1ccc(C#N)s1	ZINC000561534344	327401476	/nfs/dbraw/zinc/40/14/76/327401476.db2.gz	NRUIOFOYARFTQG-OAHLLOKOSA-N	1	0	284.428	4.039	20	30		CIEDRO
C=CCCCCC[NH2+][C@H](CCO)c1ccc(Cl)cc1	ZINC000561926425	327430708	/nfs/dbraw/zinc/43/07/08/327430708.db2.gz	UAFSRERERNZRTA-MRXNPFEDSA-N	1	0	281.827	4.100	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H]1CC(C)(C)c2ccccc21	ZINC000562037686	327441564	/nfs/dbraw/zinc/44/15/64/327441564.db2.gz	KCFATVRZRIJPES-INIZCTEOSA-N	1	0	270.420	4.329	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H]1C[C@H](c2ccccc2)C1(C)C	ZINC000562046827	327442527	/nfs/dbraw/zinc/44/25/27/327442527.db2.gz	YOZIIINUSCGTDL-SJORKVTESA-N	1	0	284.447	4.488	20	30		CIEDRO
C[C@H]([NH2+]C[C@H]1CCCC1(C)C)c1ccc(C#N)cc1	ZINC000389071726	328610613	/nfs/dbraw/zinc/61/06/13/328610613.db2.gz	WPEGGPKUTPMNES-XJKSGUPXSA-N	1	0	256.393	4.035	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)CCc1ccc(F)cc1)c1ccc(C#N)cc1	ZINC000532207645	328707136	/nfs/dbraw/zinc/70/71/36/328707136.db2.gz	ZCZVLCTYHYQHLS-LSDHHAIUSA-N	1	0	296.389	4.369	20	30		CIEDRO
CC(C)=CCC[C@@H](C)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000532207632	328707166	/nfs/dbraw/zinc/70/71/66/328707166.db2.gz	YWKGCSXCHJLPFD-CABCVRRESA-N	1	0	256.393	4.344	20	30		CIEDRO
CC[C@H](C)[C@H](C)[NH2+]C1CCC(C#N)(c2ccccc2)CC1	ZINC000507660618	332818368	/nfs/dbraw/zinc/81/83/68/332818368.db2.gz	OMNUNGLZOCBEDM-XYCLOBBJSA-N	1	0	284.447	4.415	20	30		CIEDRO
C=CCCCCC[NH2+][C@H](C)c1ccc(C#N)cc1F	ZINC000580390961	328802813	/nfs/dbraw/zinc/80/28/13/328802813.db2.gz	GTPGDTODWPYRKP-CYBMUJFWSA-N	1	0	260.356	4.094	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCc1ccc(OC)cc1)c1ccco1	ZINC000514099636	328827460	/nfs/dbraw/zinc/82/74/60/328827460.db2.gz	PJZQUOICIMMLKF-KRWDZBQOSA-N	1	0	285.387	4.128	20	30		CIEDRO
Cc1cccc2c1CC[C@H]2[NH2+][C@H]1CCc2ccc(C#N)cc21	ZINC000564007384	328853731	/nfs/dbraw/zinc/85/37/31/328853731.db2.gz	BYGAMWSZMPOFSA-UXHICEINSA-N	1	0	288.394	4.131	20	30		CIEDRO
CCCOc1ccc([C@H](C)[NH2+]CC(C)(C)CCC#N)cc1	ZINC000583685186	328901590	/nfs/dbraw/zinc/90/15/90/328901590.db2.gz	HEBMTRPPVUSGBX-HNNXBMFYSA-N	1	0	288.435	4.456	20	30		CIEDRO
CC[C@H](C[NH2+][C@H](C)c1ccc(C#N)cc1)CC(F)(F)F	ZINC000402487024	332833623	/nfs/dbraw/zinc/83/36/23/332833623.db2.gz	AULSBXXFVMFQEQ-NEPJUHHUSA-N	1	0	284.325	4.187	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](C)c1ccc(Br)cc1F	ZINC000169120477	329063993	/nfs/dbraw/zinc/06/39/93/329063993.db2.gz	VMLKWXSUZPUIQF-NXEZZACHSA-N	1	0	286.188	4.203	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@H]1CCCc2c3ccccc3[nH]c21	ZINC000393815402	329089670	/nfs/dbraw/zinc/08/96/70/329089670.db2.gz	WQVRHXQOGQKIDO-GUYCJALGSA-N	1	0	268.404	4.490	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C#N)cc1F)[C@@H]1CC2CCC1CC2	ZINC000394518541	329124765	/nfs/dbraw/zinc/12/47/65/329124765.db2.gz	SFUDAXWOBRZFMO-PSQDLTRKSA-N	1	0	286.394	4.002	20	30		CIEDRO
N#CCC[C@@H](C#N)C[NH2+][C@@H](CC1CCCC1)c1ccccc1	ZINC000514668993	329172304	/nfs/dbraw/zinc/17/23/04/329172304.db2.gz	SNZGVHKALBOBBF-HKUYNNGSSA-N	1	0	295.430	4.341	20	30		CIEDRO
N#CCC[C@H](C#N)C[NH2+][C@H](CC1CCCC1)c1ccccc1	ZINC000514668994	329172343	/nfs/dbraw/zinc/17/23/43/329172343.db2.gz	SNZGVHKALBOBBF-IEBWSBKVSA-N	1	0	295.430	4.341	20	30		CIEDRO
C[C@H]1CC[C@@H]([NH2+]Cc2ccc(C#N)cc2F)c2ccccc21	ZINC000177859857	329193351	/nfs/dbraw/zinc/19/33/51/329193351.db2.gz	SIHZABUPRBMXIW-ORAYPTAESA-N	1	0	294.373	4.426	20	30		CIEDRO
Cc1ccc2c(c1)[C@H]([NH2+]Cc1cccc(C#N)c1)CCC2	ZINC000178951191	329203334	/nfs/dbraw/zinc/20/33/34/329203334.db2.gz	LMMRTNOVXOEGMJ-LJQANCHMSA-N	1	0	276.383	4.034	20	30		CIEDRO
Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C#N)cc1)CCC2	ZINC000178952002	329203374	/nfs/dbraw/zinc/20/33/74/329203374.db2.gz	HUVJBJFAMWJVHA-IBGZPJMESA-N	1	0	276.383	4.034	20	30		CIEDRO
CC(C)[C@H]([NH2+]CCCC#N)c1ccc(Cl)cc1F	ZINC000180262684	329219194	/nfs/dbraw/zinc/21/91/94/329219194.db2.gz	HWXNIUJFMUNFSU-AWEZNQCLSA-N	1	0	268.763	4.070	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@H](C)CCCOC)c1ccccc1	ZINC000181508027	329233861	/nfs/dbraw/zinc/23/38/61/329233861.db2.gz	LLAXAKWRYHQNAJ-WBVHZDCISA-N	1	0	261.409	4.099	20	30		CIEDRO
C=CCC[C@@H]([NH2+][C@@H](C)CCCOC)c1ccccc1	ZINC000181508048	329233923	/nfs/dbraw/zinc/23/39/23/329233923.db2.gz	LLAXAKWRYHQNAJ-DOTOQJQBSA-N	1	0	261.409	4.099	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)c1ccc(OCC(C)C)c(OC)c1	ZINC000508961919	332853006	/nfs/dbraw/zinc/85/30/06/332853006.db2.gz	DIILNKZEJKYMDA-OAHLLOKOSA-N	1	0	291.435	4.347	20	30		CIEDRO
CC(C)(C#N)CCC[NH+]1CCC(c2ccsc2)CC1	ZINC000186951308	329350557	/nfs/dbraw/zinc/35/05/57/329350557.db2.gz	GCBNAAZNUHTLHT-UHFFFAOYSA-N	1	0	276.449	4.257	20	30		CIEDRO
C=CCC[C@@H](CO)[NH2+][C@@H](C)c1cc(Cl)sc1Cl	ZINC000321423704	329354643	/nfs/dbraw/zinc/35/46/43/329354643.db2.gz	KUCIYXRVTYMACY-IUCAKERBSA-N	1	0	294.247	4.033	20	30		CIEDRO
C[C@H]([NH2+][C@H](CCC#N)c1ccccc1)C1CCSCC1	ZINC000187387140	329356899	/nfs/dbraw/zinc/35/68/99/329356899.db2.gz	MWAPLPTWGKNABB-WMLDXEAASA-N	1	0	288.460	4.153	20	30		CIEDRO
C[C@@H](CCc1ccc(Cl)s1)[NH2+]CC(C)(C)CC#N	ZINC000459727593	329372553	/nfs/dbraw/zinc/37/25/53/329372553.db2.gz	HIEGLSNVHCHYER-NSHDSACASA-N	1	0	284.856	4.252	20	30		CIEDRO
CC(C)(CC#N)C[NH2+][C@H]1CC[C@](C)(c2ccccc2)C1	ZINC000459728840	329373525	/nfs/dbraw/zinc/37/35/25/329373525.db2.gz	JCCLPIHAGGVCDA-WMZOPIPTSA-N	1	0	270.420	4.026	20	30		CIEDRO
C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+]CC(C)(C)CC#N	ZINC000459737154	329374634	/nfs/dbraw/zinc/37/46/34/329374634.db2.gz	VUWGRLDZZKEZTD-STQMWFEESA-N	1	0	278.827	4.361	20	30		CIEDRO
C[C@H]1C[C@@]1([NH2+]CCC(C)(C)C#N)c1ccc(Cl)cc1	ZINC000503410436	329422302	/nfs/dbraw/zinc/42/23/02/329422302.db2.gz	AVUDAWHFWJCZCL-LRDDRELGSA-N	1	0	276.811	4.105	20	30		CIEDRO
CC(C)(CCc1ccccc1)[NH2+]Cc1ccc(CC#N)cc1	ZINC000398955684	329446762	/nfs/dbraw/zinc/44/67/62/329446762.db2.gz	HWFZEZFBTZZPKW-UHFFFAOYSA-N	1	0	292.426	4.254	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(CC#N)cc1)C1CCCCC1	ZINC000399134940	329448669	/nfs/dbraw/zinc/44/86/69/329448669.db2.gz	QAYOEUDJAOVEBX-SFHVURJKSA-N	1	0	270.420	4.201	20	30		CIEDRO
N#CCCCC[NH2+][C@@H]1CCC[C@H]1c1ccccc1Cl	ZINC000359971882	329644203	/nfs/dbraw/zinc/64/42/03/329644203.db2.gz	DINCDMGUQYHJHQ-GOEBONIOSA-N	1	0	276.811	4.260	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)c(F)c1)c1ccc(C2CC2)cc1	ZINC000419337801	329718242	/nfs/dbraw/zinc/71/82/42/329718242.db2.gz	LDSZFXKKNGFAKW-ZDUSSCGKSA-N	1	0	294.373	4.426	20	30		CIEDRO
CC[C@H](C)C[NH2+]C1CCC(C#N)(c2ccccc2)CC1	ZINC000421377402	329817050	/nfs/dbraw/zinc/81/70/50/329817050.db2.gz	JPSOZXPUBUWMCF-ZLPCBKJTSA-N	1	0	270.420	4.026	20	30		CIEDRO
Cc1cc([C@H](C)[NH2+][C@H]2CCC[C@@H](C#N)C2)c(C)s1	ZINC000248716437	329897695	/nfs/dbraw/zinc/89/76/95/329897695.db2.gz	BXGNBTKOSQNECK-YUTCNCBUSA-N	1	0	262.422	4.098	20	30		CIEDRO
C[C@H](CCCC(F)(F)F)[NH2+]C1(c2cccc(C#N)c2)CC1	ZINC000572065713	329940438	/nfs/dbraw/zinc/94/04/38/329940438.db2.gz	ROTKBMDTXUXAKI-GFCCVEGCSA-N	1	0	296.336	4.258	20	30		CIEDRO
C[C@@H](CCCC(F)(F)F)[NH2+]C1(c2cccc(C#N)c2)CC1	ZINC000572065714	329940444	/nfs/dbraw/zinc/94/04/44/329940444.db2.gz	ROTKBMDTXUXAKI-LBPRGKRZSA-N	1	0	296.336	4.258	20	30		CIEDRO
C#CC[C@H]([NH2+][C@@H]1CCc2ccc(OC)cc21)c1ccccc1	ZINC000271422293	330079870	/nfs/dbraw/zinc/07/98/70/330079870.db2.gz	CALUALJTROQRMV-VQTJNVASSA-N	1	0	291.394	4.037	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@@H]1CCCc2nc(C)sc21)c1ccccc1	ZINC000271454738	330079872	/nfs/dbraw/zinc/07/98/72/330079872.db2.gz	GQDGXFCLJNSSIW-NVXWUHKLSA-N	1	0	296.439	4.183	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@H](C)c1cccs1)c1ccccc1	ZINC000271521837	330081083	/nfs/dbraw/zinc/08/10/83/330081083.db2.gz	ONZYIAZMFMWXLT-UKRRQHHQSA-N	1	0	255.386	4.163	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@H](C)c1ccc([S@@](C)=O)cc1	ZINC000271529658	330081141	/nfs/dbraw/zinc/08/11/41/330081141.db2.gz	PIYVUMDEMVEEEJ-PTSWNOGYSA-N	1	0	293.476	4.210	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@H]1CCOC2(CCC2)C1)c1ccccc1	ZINC000271548250	330081393	/nfs/dbraw/zinc/08/13/93/330081393.db2.gz	UOEOPCOPHLIHJQ-ROUUACIJSA-N	1	0	285.431	4.385	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)c1ccncc1Cl	ZINC000421824994	330083451	/nfs/dbraw/zinc/08/34/51/330083451.db2.gz	LGVKKGRBSGLMJE-NWDGAFQWSA-N	1	0	285.778	4.018	20	30		CIEDRO
COc1cc(Cl)ccc1[C@H](C)[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000421857724	330089531	/nfs/dbraw/zinc/08/95/31/330089531.db2.gz	PPNOBPDJSNOMMT-OBJOEFQTSA-N	1	0	292.810	4.082	20	30		CIEDRO
COc1cc(Cl)ccc1[C@H](C)[NH2+]CC(C)(C)CCC#N	ZINC000421859287	330090350	/nfs/dbraw/zinc/09/03/50/330090350.db2.gz	SIDOCHPTKDRZIX-LBPRGKRZSA-N	1	0	294.826	4.329	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@@H](C)c1ccncc1Cl	ZINC000421832330	330091249	/nfs/dbraw/zinc/09/12/49/330091249.db2.gz	GQUHVWTVYIUFPT-NEPJUHHUSA-N	1	0	252.789	4.130	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@@H]1CCO[C@H](c2ccc(F)cc2)C1	ZINC000273491513	330093058	/nfs/dbraw/zinc/09/30/58/330093058.db2.gz	WVTTYUQLMOTAQF-KSZLIROESA-N	1	0	291.410	4.380	20	30		CIEDRO
C#CC[C@H]([NH2+][C@H](C)c1cc(C)ccc1O)c1ccccc1	ZINC000273472119	330093137	/nfs/dbraw/zinc/09/31/37/330093137.db2.gz	JUKQPRUUOBOYGV-QAPCUYQASA-N	1	0	279.383	4.116	20	30		CIEDRO
COc1ccc([C@H]([NH2+]CC(C)(C)CC#N)C(C)C)c(F)c1	ZINC000421862541	330098328	/nfs/dbraw/zinc/09/83/28/330098328.db2.gz	WLZVKWSGZGXZEG-MRXNPFEDSA-N	1	0	292.398	4.061	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)s1)c1csc(Cl)c1	ZINC000421881693	330102484	/nfs/dbraw/zinc/10/24/84/330102484.db2.gz	PDLXVYSLTIFLHI-QMMMGPOBSA-N	1	0	282.821	4.185	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccc(C#N)s1)c1ccco1	ZINC000421892036	330104356	/nfs/dbraw/zinc/10/43/56/330104356.db2.gz	WEZVEGZMHGIDHH-AWEZNQCLSA-N	1	0	272.373	4.010	20	30		CIEDRO
C=CCC[N@@H+](C)[C@H](C)c1nc2ccccc2n1C(F)F	ZINC000276402948	330113555	/nfs/dbraw/zinc/11/35/55/330113555.db2.gz	KUBFPMWJMNTDLX-LLVKDONJSA-N	1	0	279.334	4.000	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@H]1CCCc2occc21)c1ccccc1	ZINC000278762827	330119946	/nfs/dbraw/zinc/11/99/46/330119946.db2.gz	OTUWMMKNMVNFHV-SJORKVTESA-N	1	0	265.356	4.011	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1sc(C)nc1C)c1ccco1	ZINC000278903079	330121299	/nfs/dbraw/zinc/12/12/99/330121299.db2.gz	IXWTVUDGIFZPAY-ZDUSSCGKSA-N	1	0	276.405	4.150	20	30		CIEDRO
Cc1nc(C[NH2+][C@@H](CCCC#N)c2ccccc2)sc1C	ZINC000433011600	330121801	/nfs/dbraw/zinc/12/18/01/330121801.db2.gz	OZJGIQZKAONNNH-INIZCTEOSA-N	1	0	299.443	4.285	20	30		CIEDRO
Cc1ccc(CCC2CC[NH+]([C@@H]3CC[C@H](C#N)C3)CC2)cc1	ZINC000429725753	330125445	/nfs/dbraw/zinc/12/54/45/330125445.db2.gz	ZRJYWBJKFCHNFO-VQTJNVASSA-N	1	0	296.458	4.332	20	30		CIEDRO
CC(C)C[C@@H]1CCC[N@@H+]1CCCCC(C)(C)C#N	ZINC000396927757	330229671	/nfs/dbraw/zinc/22/96/71/330229671.db2.gz	VWVGCAQHHWBHFY-HNNXBMFYSA-N	1	0	250.430	4.217	20	30		CIEDRO
C=CCCOCC[NH2+][C@@H](C)c1ccc(SC(C)C)cc1	ZINC000536839180	330232426	/nfs/dbraw/zinc/23/24/26/330232426.db2.gz	NJETZLZKYFSXPI-HNNXBMFYSA-N	1	0	293.476	4.430	20	30		CIEDRO
CCC1CCC([NH2+][C@H](C)c2ccc(C#N)cc2)CC1	ZINC000035256448	330244527	/nfs/dbraw/zinc/24/45/27/330244527.db2.gz	OFGCJNGUDAVIOP-TUBUQKNSSA-N	1	0	256.393	4.178	20	30		CIEDRO
CCC1CCC([NH2+][C@@H](C)c2ccc(C#N)cc2)CC1	ZINC000035256447	330244686	/nfs/dbraw/zinc/24/46/86/330244686.db2.gz	OFGCJNGUDAVIOP-CBCUQQMYSA-N	1	0	256.393	4.178	20	30		CIEDRO
C=CC(C)(C)CC[NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1	ZINC000527734300	330278554	/nfs/dbraw/zinc/27/85/54/330278554.db2.gz	IAUYIUGMNSNFOF-NEPJUHHUSA-N	1	0	263.347	4.299	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](C)c1oc2ccc(OC)cc2c1C	ZINC000536857377	330252240	/nfs/dbraw/zinc/25/22/40/330252240.db2.gz	KNKREGJSYXKTST-YPMHNXCESA-N	1	0	273.376	4.365	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](CC)CSc1ccccc1[N+](=O)[O-]	ZINC000536858299	330252476	/nfs/dbraw/zinc/25/24/76/330252476.db2.gz	OABOGCMZQWRKOG-OLZOCXBDSA-N	1	0	294.420	4.020	20	30		CIEDRO
Cc1ccc2c(c1)[C@H]([NH2+]CC1CCC(C#N)CC1)[C@@H](C)C2	ZINC000580483909	330256511	/nfs/dbraw/zinc/25/65/11/330256511.db2.gz	WDMRIVNTEIFHPB-YHRBYZFPSA-N	1	0	282.431	4.148	20	30		CIEDRO
CC(C)Cc1ccccc1C[NH2+]Cc1cc(C#N)cs1	ZINC000527734783	330278639	/nfs/dbraw/zinc/27/86/39/330278639.db2.gz	UMCAMQOCORWHEM-UHFFFAOYSA-N	1	0	284.428	4.108	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@H](C)c1cccc(C(C)C)c1	ZINC000527911921	330290832	/nfs/dbraw/zinc/29/08/32/330290832.db2.gz	UBQAECNQMGNTJB-JLSDUUJJSA-N	1	0	273.420	4.052	20	30		CIEDRO
CC[C@H](CCc1ccccc1)[NH2+]C1CCC(C)(C#N)CC1	ZINC000527953708	330294665	/nfs/dbraw/zinc/29/46/65/330294665.db2.gz	APKDLZKDZGDQRP-LMDPOFIKSA-N	1	0	284.447	4.460	20	30		CIEDRO
C=CC(C)(C)CC[NH2+][C@@H]1CCCNc2ccccc21	ZINC000527928998	330296880	/nfs/dbraw/zinc/29/68/80/330296880.db2.gz	VNXFBXNMICMKTK-MRXNPFEDSA-N	1	0	258.409	4.125	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@@H]2CCCC[C@H](c3ccccc3)C2)C1	ZINC000424188861	330322023	/nfs/dbraw/zinc/32/20/23/330322023.db2.gz	COXZCXMSLAVIOQ-LULLPPNCSA-N	1	0	282.431	4.385	20	30		CIEDRO
C=CCCCCC[N@@H+](C)[C@@H](C)c1nc(-c2ccccc2)no1	ZINC000532967351	330323560	/nfs/dbraw/zinc/32/35/60/330323560.db2.gz	NGBZFVIQVGFAOU-HNNXBMFYSA-N	1	0	299.418	4.476	20	30		CIEDRO
Fc1ccc(C#CC[N@@H+]2CCC[C@@H]2c2cccc(F)c2)cc1	ZINC000533001804	330324945	/nfs/dbraw/zinc/32/49/45/330324945.db2.gz	JQJQULFQEWVZBS-LJQANCHMSA-N	1	0	297.348	4.153	20	30		CIEDRO
C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@H](C#N)C2)C[C@@H](c2ccccc2)C1	ZINC000424206371	330327711	/nfs/dbraw/zinc/32/77/11/330327711.db2.gz	WXPIDVLFBXHKNH-JAQSECSASA-N	1	0	282.431	4.241	20	30		CIEDRO
CCSc1ccc([C@H](C)[NH2+][C@@H]2CC[C@H](C#N)C2)cc1	ZINC000424320797	330340118	/nfs/dbraw/zinc/34/01/18/330340118.db2.gz	GMHYCOXYYABPQA-KCQAQPDRSA-N	1	0	274.433	4.141	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1cc2ccccc2s1	ZINC000424322234	330340438	/nfs/dbraw/zinc/34/04/38/330340438.db2.gz	IFFJVVQONFQCQX-MBNYWOFBSA-N	1	0	270.401	4.244	20	30		CIEDRO
Cc1ccc2cc([C@@H](C)[NH2+][C@@H]3CC[C@H](C#N)C3)oc2c1	ZINC000424322661	330340493	/nfs/dbraw/zinc/34/04/93/330340493.db2.gz	IJUWNMDREDUPMY-VNHYZAJKSA-N	1	0	268.360	4.084	20	30		CIEDRO
CC(C)[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc(Cl)cc1F	ZINC000424324817	330341004	/nfs/dbraw/zinc/34/10/04/330341004.db2.gz	KEWHVXLIZFDWET-NORZTCDRSA-N	1	0	294.801	4.458	20	30		CIEDRO
C[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+][C@@H]1CC[C@H](C#N)C1	ZINC000424324406	330341073	/nfs/dbraw/zinc/34/10/73/330341073.db2.gz	JVIGKCLGYUBGQY-WFGGJUAMSA-N	1	0	276.811	4.114	20	30		CIEDRO
CCCC[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccccc1	ZINC000424327622	330341653	/nfs/dbraw/zinc/34/16/53/330341653.db2.gz	NBSIQLSETPVGHH-UAGQMJEPSA-N	1	0	256.393	4.200	20	30		CIEDRO
CCOc1ccc(Cl)cc1[C@@H](C)[NH2+][C@@H]1CC[C@H](C#N)C1	ZINC000424329094	330341760	/nfs/dbraw/zinc/34/17/60/330341760.db2.gz	OZEYHEODXNSTJM-MBNYWOFBSA-N	1	0	292.810	4.082	20	30		CIEDRO
Cc1cc2c(cc1C)[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)CCS2	ZINC000424328753	330341791	/nfs/dbraw/zinc/34/17/91/330341791.db2.gz	OJUJZHAWCHCPND-LZWOXQAQSA-N	1	0	286.444	4.122	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@H]2CCC[C@@H]2CCc2ccccc2)C1	ZINC000424330756	330342070	/nfs/dbraw/zinc/34/20/70/330342070.db2.gz	RAQHEVYYAIYJPK-YRXWBPOGSA-N	1	0	282.431	4.070	20	30		CIEDRO
CC(C)[C@H]1C[C@H]([NH2+][C@@H]2CC[C@H](C#N)C2)c2ccccc21	ZINC000424331179	330342307	/nfs/dbraw/zinc/34/23/07/330342307.db2.gz	RTPMLBOLUSCGJX-JFTQMJAMSA-N	1	0	268.404	4.153	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1cccc(C(F)(F)F)c1	ZINC000424333916	330342921	/nfs/dbraw/zinc/34/29/21/330342921.db2.gz	UVIMQOBFBDNYFL-UHIISALHSA-N	1	0	282.309	4.048	20	30		CIEDRO
Cc1ccc([C@@H]([NH2+][C@@H]2CC[C@H](C#N)C2)C2CCC2)cc1	ZINC000424334523	330343140	/nfs/dbraw/zinc/34/31/40/330343140.db2.gz	VSAQFBBCDIDWAU-QGTPRVQTSA-N	1	0	268.404	4.118	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@H](CC2CC2)c2ccc(Cl)cc2)C1	ZINC000424337517	330343650	/nfs/dbraw/zinc/34/36/50/330343650.db2.gz	ZHUOENJYZIYABN-IAOVAPTHSA-N	1	0	288.822	4.463	20	30		CIEDRO
C=CCC[N@H+]1CC=C(c2c[nH]c3cc(C)ccc23)CC1	ZINC000533351206	330359321	/nfs/dbraw/zinc/35/93/21/330359321.db2.gz	IOAGSFRFMZYYNF-UHFFFAOYSA-N	1	0	266.388	4.142	20	30		CIEDRO
CCc1ccc(C[NH2+][C@@H](CCC#N)c2ccccc2)s1	ZINC000533360606	330359757	/nfs/dbraw/zinc/35/97/57/330359757.db2.gz	GWFNAKYKSHOXIS-KRWDZBQOSA-N	1	0	284.428	4.445	20	30		CIEDRO
C=C(CC)C[N@@H+]1CCCC[C@H]1c1nc2ccccc2n1C	ZINC000536906926	330363852	/nfs/dbraw/zinc/36/38/52/330363852.db2.gz	YEXQAFSYPXSLQI-KRWDZBQOSA-N	1	0	283.419	4.067	20	30		CIEDRO
C=CCCC[NH2+]C(c1ccccc1)c1ccccc1	ZINC000071275405	330368571	/nfs/dbraw/zinc/36/85/71/330368571.db2.gz	QNLPWSMRFGVMKN-UHFFFAOYSA-N	1	0	251.373	4.332	20	30		CIEDRO
CC1(C)c2ccccc2CC[N@H+]1Cc1ccc(CC#N)cc1	ZINC000564144564	330373446	/nfs/dbraw/zinc/37/34/46/330373446.db2.gz	YRVBJFXQYLWTBZ-UHFFFAOYSA-N	1	0	290.410	4.046	20	30		CIEDRO
C=C(C)C[NH2+]Cc1cc(OC)c(OC)cc1-c1ccccc1	ZINC000119615936	330377409	/nfs/dbraw/zinc/37/74/09/330377409.db2.gz	KKLIRZNYMZGGLA-UHFFFAOYSA-N	1	0	297.398	4.037	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H]1CCCO[C@@H]1c1ccccc1)C1CC1	ZINC000120493462	330388896	/nfs/dbraw/zinc/38/88/96/330388896.db2.gz	HPSVMZUUCIGJGT-SLFFLAALSA-N	1	0	299.458	4.489	20	30		CIEDRO
C[C@H]1CC(C)(C)CC[C@H]1[NH2+]CCCC(C)(C)C#N	ZINC000120936616	330393319	/nfs/dbraw/zinc/39/33/19/330393319.db2.gz	SQPUGNSJVUOFJD-UONOGXRCSA-N	1	0	250.430	4.121	20	30		CIEDRO
C[C@@H](Cc1ccc(F)cc1)[NH2+][C@H](CCC#N)c1ccccc1	ZINC000090665157	330394579	/nfs/dbraw/zinc/39/45/79/330394579.db2.gz	FMWSLTZAYRRUIR-HNAYVOBHSA-N	1	0	296.389	4.391	20	30		CIEDRO
C[C@@H](Cc1ccc(F)cc1)[NH2+][C@@H](CCC#N)c1ccccc1	ZINC000090665155	330394593	/nfs/dbraw/zinc/39/45/93/330394593.db2.gz	FMWSLTZAYRRUIR-KXBFYZLASA-N	1	0	296.389	4.391	20	30		CIEDRO
N#CCC[C@H]([NH2+][C@@H]1CCc2ccccc21)c1ccccc1	ZINC000090664825	330394650	/nfs/dbraw/zinc/39/46/50/330394650.db2.gz	FEGDXTXRNNAJAU-RBUKOAKNSA-N	1	0	276.383	4.309	20	30		CIEDRO
C=CC[C@@H](CO)C[NH2+][C@@H](C)c1ccc(-c2ccccc2)cc1	ZINC000537092729	330398461	/nfs/dbraw/zinc/39/84/61/330398461.db2.gz	GQCHRPANVQDFDT-DLBZAZTESA-N	1	0	295.426	4.189	20	30		CIEDRO
CC[C@H](C)[C@H]([NH2+]CC1(C#N)CC1)c1ccc(Cl)cc1	ZINC000537288752	330431064	/nfs/dbraw/zinc/43/10/64/330431064.db2.gz	AFTCDHDSBDYFBN-WFASDCNBSA-N	1	0	276.811	4.321	20	30		CIEDRO
C[C@@H]([NH2+]CC(C)(C)c1ccc(F)cc1)c1cccc(C#N)c1	ZINC000537295226	330431484	/nfs/dbraw/zinc/43/14/84/330431484.db2.gz	JNGVUTDBVDFTEV-CQSZACIVSA-N	1	0	296.389	4.326	20	30		CIEDRO
C[C@@H](CC(C)(C)c1ccccc1)[NH2+]Cc1ccc(C#N)s1	ZINC000537295359	330431551	/nfs/dbraw/zinc/43/15/51/330431551.db2.gz	XUWIQHXFPLWGJK-AWEZNQCLSA-N	1	0	298.455	4.466	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+]Cc1cc2cc(OC)ccc2o1	ZINC000537386248	330435470	/nfs/dbraw/zinc/43/54/70/330435470.db2.gz	IAKZHPRWOYMNSW-ZDUSSCGKSA-N	1	0	273.376	4.276	20	30		CIEDRO
C[C@H]([NH2+]C1(Cc2ccccc2)CCC1)c1cccc(C#N)c1	ZINC000537451127	330437417	/nfs/dbraw/zinc/43/74/17/330437417.db2.gz	CRDQZKZGIVSZSA-INIZCTEOSA-N	1	0	290.410	4.374	20	30		CIEDRO
C=CCCCCC[NH2+][C@H](c1cccs1)C(C)(C)CO	ZINC000515150114	330471452	/nfs/dbraw/zinc/47/14/52/330471452.db2.gz	ZDLWIDYRZHEFGK-OAHLLOKOSA-N	1	0	281.465	4.144	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCCc3sc(Cl)cc32)C1	ZINC000426329537	330504484	/nfs/dbraw/zinc/50/44/84/330504484.db2.gz	GXBYUBKBXHTJAD-NQBHXWOUSA-N	1	0	294.851	4.451	20	30		CIEDRO
CC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccccc1C(C)(C)C#N	ZINC000429768517	330554479	/nfs/dbraw/zinc/55/44/79/330554479.db2.gz	AZKFLCPAAGCZKK-PBHICJAKSA-N	1	0	270.420	4.156	20	30		CIEDRO
CCO[C@@H]1C[C@H]([NH2+]CCCC(C)(C)C#N)C12CCCCC2	ZINC000429764731	330554541	/nfs/dbraw/zinc/55/45/41/330554541.db2.gz	VGFXWNTVXMFJMS-JKSUJKDBSA-N	1	0	292.467	4.034	20	30		CIEDRO
C[C@@H]([NH2+]CC1(CC#N)CC1)c1ccc(Cl)c(Cl)c1	ZINC000429787801	330554895	/nfs/dbraw/zinc/55/48/95/330554895.db2.gz	XJMULXCMAYZJMM-SNVBAGLBSA-N	1	0	283.202	4.338	20	30		CIEDRO
C=CCC(C)(C)C(=O)Nc1cccc(C[NH+](CC)CC)c1	ZINC000429851232	330555732	/nfs/dbraw/zinc/55/57/32/330555732.db2.gz	YNGUCOADOCRIAE-UHFFFAOYSA-N	1	0	288.435	4.069	20	30		CIEDRO
Cc1cc2c(cc1C)[C@@H]([NH2+]CC1(CC#N)CC1)CCS2	ZINC000430726681	330571536	/nfs/dbraw/zinc/57/15/36/330571536.db2.gz	VUGOIICEMWVNOQ-HNNXBMFYSA-N	1	0	286.444	4.124	20	30		CIEDRO
CC(C)c1cccc2c1OCCC[C@@H]2[NH2+]CC1(CC#N)CC1	ZINC000430741922	330572227	/nfs/dbraw/zinc/57/22/27/330572227.db2.gz	KGGUOYVWPUXDDT-KRWDZBQOSA-N	1	0	298.430	4.307	20	30		CIEDRO
Cc1ccc([C@@H]([NH2+]CC2(CC#N)CC2)C2CCC2)cc1	ZINC000430740416	330572287	/nfs/dbraw/zinc/57/22/87/330572287.db2.gz	KHZOQSBWIZYMQS-KRWDZBQOSA-N	1	0	268.404	4.120	20	30		CIEDRO
C[C@H]([NH2+]CC1(CC#N)CC1)c1cccc(Cl)c1Cl	ZINC000430744127	330572425	/nfs/dbraw/zinc/57/24/25/330572425.db2.gz	MMHRTOGOFPYAHD-JTQLQIEISA-N	1	0	283.202	4.338	20	30		CIEDRO
C[C@@H]([NH2+]CC1(CC#N)CC1)c1cc(Cl)cc(Cl)c1	ZINC000430745371	330572510	/nfs/dbraw/zinc/57/25/10/330572510.db2.gz	YVEZQBZRQQDUNX-SNVBAGLBSA-N	1	0	283.202	4.338	20	30		CIEDRO
CCSc1ccc([C@H](C)[NH2+]CC2(CC#N)CC2)cc1	ZINC000430752174	330573130	/nfs/dbraw/zinc/57/31/30/330573130.db2.gz	FGBLVMWHXIQCGT-ZDUSSCGKSA-N	1	0	274.433	4.143	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@@H]2CC[C@@H](Cc3ccccc3)C2)c1	ZINC000436249083	330671707	/nfs/dbraw/zinc/67/17/07/330671707.db2.gz	CRBFZDVTULUPDT-FXAWDEMLSA-N	1	0	290.410	4.059	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@@H](CC)c1ccc(C)cc1	ZINC000436297457	330674413	/nfs/dbraw/zinc/67/44/13/330674413.db2.gz	XTSZVYYFMCRATN-SQNIBIBYSA-N	1	0	273.420	4.017	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+][C@H](CC(F)(F)F)C(C)C	ZINC000437079389	330692534	/nfs/dbraw/zinc/69/25/34/330692534.db2.gz	SVPZJONVJRENJQ-VXGBXAGGSA-N	1	0	251.336	4.298	20	30		CIEDRO
C[C@@]1(c2ccccc2)CC[C@@H]([NH2+]Cc2cccc(C#N)c2)C1	ZINC000438073163	330714930	/nfs/dbraw/zinc/71/49/30/330714930.db2.gz	KGQRZJMEXVHYDD-WOJBJXKFSA-N	1	0	290.410	4.158	20	30		CIEDRO
C=CCC[C@H]([NH2+]CC1(c2ccccc2)CC1)C1CC1	ZINC000439092639	330733708	/nfs/dbraw/zinc/73/37/08/330733708.db2.gz	POZFIBOTTLJWCB-KRWDZBQOSA-N	1	0	255.405	4.053	20	30		CIEDRO
CC1(C)CCc2ccccc2[C@@H]([NH2+]Cc2ccc(C#N)o2)C1	ZINC000441379648	330767230	/nfs/dbraw/zinc/76/72/30/330767230.db2.gz	JSAXDJGQLAQFGD-SFHVURJKSA-N	1	0	294.398	4.345	20	30		CIEDRO
N#CC1CCC(C[NH2+]Cc2cccc3ccccc32)CC1	ZINC000441387550	330767514	/nfs/dbraw/zinc/76/75/14/330767514.db2.gz	QFLTXZBLUXRUHD-UHFFFAOYSA-N	1	0	278.399	4.259	20	30		CIEDRO
C=C[C@@H](C)[NH2+][C@H](CC)c1cccc(Br)c1	ZINC000157284208	330772625	/nfs/dbraw/zinc/77/26/25/330772625.db2.gz	YTGLWOCLCKOWFR-ZWNOBZJWSA-N	1	0	268.198	4.064	20	30		CIEDRO
N#CC1CCC(C[NH2+][C@H]2CCc3ccc(Cl)cc32)CC1	ZINC000442110976	330774137	/nfs/dbraw/zinc/77/41/37/330774137.db2.gz	FGHOCFXMYZAWAK-FVKWTLKZSA-N	1	0	288.822	4.247	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH2+][C@@H](c2ccccc2)c2cccc(F)c2)C1	ZINC000442796778	330784412	/nfs/dbraw/zinc/78/44/12/330784412.db2.gz	WATDNWKSZWQUSI-ZMYBRWDISA-N	1	0	294.373	4.197	20	30		CIEDRO
Cc1cccc(-c2cccc(C[NH2+][C@H]3CC[C@@H](C#N)C3)c2)c1	ZINC000442798509	330784559	/nfs/dbraw/zinc/78/45/59/330784559.db2.gz	YCNCRLFUYUBKBH-UZLBHIALSA-N	1	0	290.410	4.444	20	30		CIEDRO
CC(C)c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[C@@H](C#N)C1)CCC2	ZINC000442823075	330785666	/nfs/dbraw/zinc/78/56/66/330785666.db2.gz	YUOLZJVGJWCVCN-LSBZLQRGSA-N	1	0	282.431	4.469	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH2+]CC2(Cc3ccccc3)CCCC2)C1	ZINC000442832839	330785938	/nfs/dbraw/zinc/78/59/38/330785938.db2.gz	ZEKAHHIHVUGOBI-QZTJIDSGSA-N	1	0	282.431	4.071	20	30		CIEDRO
CCC(C)(C)c1ccc(C[NH2+][C@H]2CC[C@@H](C#N)C2)cc1	ZINC000442840467	330786269	/nfs/dbraw/zinc/78/62/69/330786269.db2.gz	WXFBXCOHPVCCSF-WBVHZDCISA-N	1	0	270.420	4.156	20	30		CIEDRO
CC1(C)CC[C@H](C[NH2+][C@@H]2CC[C@@H](C#N)C2)c2ccccc21	ZINC000442842802	330786333	/nfs/dbraw/zinc/78/63/33/330786333.db2.gz	ITYHRRYFTGUQSM-BZUAXINKSA-N	1	0	282.431	4.123	20	30		CIEDRO
CC[C@@H]1C[C@@H](C)CC[C@H]1[NH2+]CC1CCC(C#N)CC1	ZINC000442852367	330787008	/nfs/dbraw/zinc/78/70/08/330787008.db2.gz	HRVJQTHFGPFPDX-LMCYLSQRSA-N	1	0	262.441	4.121	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+]C2(c3ccc(Cl)c(Cl)c3)CC2)C1	ZINC000442854370	330787222	/nfs/dbraw/zinc/78/72/22/330787222.db2.gz	AKHJAGDMDSGPBD-CMPLNLGQSA-N	1	0	295.213	4.264	20	30		CIEDRO
CCC[C@H](Cc1ccccc1)[NH2+]CC1CCC(C#N)CC1	ZINC000442855200	330787390	/nfs/dbraw/zinc/78/73/90/330787390.db2.gz	MMJZABQRCZSCKD-CTWPCTMYSA-N	1	0	284.447	4.317	20	30		CIEDRO
C=CCSCC[NH2+]Cc1ccc(C(F)(F)F)cc1C	ZINC000442995560	330792444	/nfs/dbraw/zinc/79/24/44/330792444.db2.gz	FJSMFPJRPAKDMU-UHFFFAOYSA-N	1	0	289.366	4.023	20	30		CIEDRO
N#CCCCC[NH2+]Cc1ccc(Oc2cccc(F)c2)cc1	ZINC000443985982	330808428	/nfs/dbraw/zinc/80/84/28/330808428.db2.gz	YQBUXKPLNUHXDE-UHFFFAOYSA-N	1	0	298.361	4.401	20	30		CIEDRO
C=C(C)C[NH2+][C@@H](CC(F)(F)F)c1ccccc1C	ZINC000444780472	330825054	/nfs/dbraw/zinc/82/50/54/330825054.db2.gz	FJUMIQOBTRDFOL-ZDUSSCGKSA-N	1	0	257.299	4.154	20	30		CIEDRO
CC(C)[C@H](C[NH2+][C@H]1CCC[C@@H](C#N)C1)Cc1ccccc1	ZINC000446795969	330854456	/nfs/dbraw/zinc/85/44/56/330854456.db2.gz	PPNVFDJXMOKSTG-QYZOEREBSA-N	1	0	284.447	4.173	20	30		CIEDRO
C[C@@H](CC1CCCCC1)[NH2+]Cc1ccc(C#N)s1	ZINC000447094387	330861289	/nfs/dbraw/zinc/86/12/89/330861289.db2.gz	RLFBJORCEZZRDM-LBPRGKRZSA-N	1	0	262.422	4.068	20	30		CIEDRO
CC(C)[C@H]1CCCC[C@H]1[NH2+]CCCC(C)(C)C#N	ZINC000160364586	330863287	/nfs/dbraw/zinc/86/32/87/330863287.db2.gz	YIVSVGWMYGQIGE-HUUCEWRRSA-N	1	0	250.430	4.121	20	30		CIEDRO
Cc1[nH]c2c(cc(C)cc2C[NH2+][C@@H]2CCC[C@@H](C#N)C2)c1C	ZINC000447539655	330869016	/nfs/dbraw/zinc/86/90/16/330869016.db2.gz	HMVSDFFTWXMLMO-NVXWUHKLSA-N	1	0	295.430	4.265	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccc(C)cc1C)c1ccc(C#N)cc1	ZINC000447541237	330869159	/nfs/dbraw/zinc/86/91/59/330869159.db2.gz	LTNWXRYPWCZENQ-LJQANCHMSA-N	1	0	278.399	4.416	20	30		CIEDRO
CC[C@H](Cc1ccc(Cl)cc1)[NH2+][C@H]1CCC[C@H](C#N)C1	ZINC000447573368	330870583	/nfs/dbraw/zinc/87/05/83/330870583.db2.gz	HKMPSBAEOONNGP-UAGQMJEPSA-N	1	0	290.838	4.333	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H](CC)c1ccc(C#N)cc1	ZINC000447580313	330871030	/nfs/dbraw/zinc/87/10/30/330871030.db2.gz	NTIUPVYCMUZHHZ-RHSMWYFYSA-N	1	0	256.393	4.344	20	30		CIEDRO
CCc1cnccc1[C@H](C)[NH2+][C@@H](CC)c1ccc(C#N)cc1	ZINC000447581743	330871141	/nfs/dbraw/zinc/87/11/41/330871141.db2.gz	VVDDOPXEMPCADQ-LIRRHRJNSA-N	1	0	293.414	4.318	20	30		CIEDRO
CC[C@@H]([NH2+]CC1(C2CC2)CCC1)c1ccc(C#N)cc1	ZINC000447584285	330871519	/nfs/dbraw/zinc/87/15/19/330871519.db2.gz	FJPHKUXTOSOBKH-QGZVFWFLSA-N	1	0	268.404	4.179	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@H](CC)c1nccs1	ZINC000449159987	330902458	/nfs/dbraw/zinc/90/24/58/330902458.db2.gz	KEDTXIPRPMJUQZ-QWHCGFSZSA-N	1	0	252.427	4.319	20	30		CIEDRO
C[C@H]([NH2+]C1CCC(C)(C#N)CC1)[C@@H]1Oc2ccccc2[C@H]1C	ZINC000449172790	330903375	/nfs/dbraw/zinc/90/33/75/330903375.db2.gz	DNCXFOUVQXWUHJ-SNNOENIYSA-N	1	0	298.430	4.002	20	30		CIEDRO
CCO[C@@H]1C[C@H]([NH2+]C2CCC(C)(C#N)CC2)C1(CC)CC	ZINC000449178890	330903882	/nfs/dbraw/zinc/90/38/82/330903882.db2.gz	YLCAYOUINQEABH-VUROTCPHSA-N	1	0	292.467	4.032	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+]C[C@@H](C)c1c(C)noc1C	ZINC000449185375	330904539	/nfs/dbraw/zinc/90/45/39/330904539.db2.gz	HQPXFXSXJIJJRT-OLZOCXBDSA-N	1	0	264.413	4.119	20	30		CIEDRO
CC1(C#N)CCC([NH2+]C[C@]2(C)CCCc3ccccc32)CC1	ZINC000449212184	330906488	/nfs/dbraw/zinc/90/64/88/330906488.db2.gz	ZJBMDSDWZBTOJE-UUKMXZOPSA-N	1	0	296.458	4.343	20	30		CIEDRO
Cc1ccccc1-c1ccccc1C[NH2+]CCCC#N	ZINC000449230654	330907911	/nfs/dbraw/zinc/90/79/11/330907911.db2.gz	ATNKGLQMISRNQI-UHFFFAOYSA-N	1	0	264.372	4.055	20	30		CIEDRO
CC[C@H](CC#N)[NH2+]Cc1ccccc1-c1ccccc1C	ZINC000449244723	330909242	/nfs/dbraw/zinc/90/92/42/330909242.db2.gz	VHHSCPIZZUOTOH-QGZVFWFLSA-N	1	0	278.399	4.444	20	30		CIEDRO
Cc1ccc2c(c1)[C@H]([NH2+]C1CCC(C)(C#N)CC1)CCC2	ZINC000449337704	330915846	/nfs/dbraw/zinc/91/58/46/330915846.db2.gz	SQMDUUZEHIJKQQ-CUYAVPTFSA-N	1	0	282.431	4.435	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)[C@@H](C)c1nc2ccccc2s1	ZINC000449479937	330929232	/nfs/dbraw/zinc/92/92/32/330929232.db2.gz	WRRZLHDLDCVKQZ-OLZOCXBDSA-N	1	0	274.433	4.344	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)cc1Cl)c1cccs1	ZINC000162618622	330943050	/nfs/dbraw/zinc/94/30/50/330943050.db2.gz	AHGNYPQKGIJPIL-JTQLQIEISA-N	1	0	276.792	4.124	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C#N)c(F)c1)C1CCC(F)(F)CC1	ZINC000449735255	330946845	/nfs/dbraw/zinc/94/68/45/330946845.db2.gz	GUOULERSCVTTGS-LLVKDONJSA-N	1	0	296.336	4.001	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CC[C@H](c3ccccc3)C2)cc1F	ZINC000449737297	330947355	/nfs/dbraw/zinc/94/73/55/330947355.db2.gz	RGEAJAABDXJLMA-FUHWJXTLSA-N	1	0	294.373	4.123	20	30		CIEDRO
C[C@H]([NH2+]CC1(C#N)CCC1)c1cc2ccccc2s1	ZINC000450730652	330996649	/nfs/dbraw/zinc/99/66/49/330996649.db2.gz	VDNAWZGXZIHZQE-LBPRGKRZSA-N	1	0	270.401	4.246	20	30		CIEDRO
C=CCCC[C@@H](C)[NH+]1CCC(F)(c2ccccn2)CC1	ZINC000450932400	331008005	/nfs/dbraw/zinc/00/80/05/331008005.db2.gz	RMUJRAJCZBWSEN-OAHLLOKOSA-N	1	0	276.399	4.087	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(F)c(C#N)c1)c1cccc(C2CC2)c1	ZINC000451109486	331015823	/nfs/dbraw/zinc/01/58/23/331015823.db2.gz	CVYOAMOFEWRFSE-ZDUSSCGKSA-N	1	0	294.373	4.426	20	30		CIEDRO
C[C@@H]1[C@@H](CC(F)(F)F)C[C@H](C)[N@H+]1CCCC(C)(C)C#N	ZINC000451145710	331017541	/nfs/dbraw/zinc/01/75/41/331017541.db2.gz	LDDLYOCCYCUDPU-YNEHKIRRSA-N	1	0	290.373	4.368	20	30		CIEDRO
C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)[N@@H+]1CCC(C)(C)C#N	ZINC000451180406	331019086	/nfs/dbraw/zinc/01/90/86/331019086.db2.gz	GJCBEPSLHMRIKE-INMHGKMJSA-N	1	0	270.420	4.193	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](C)CCc1ccc(OC(F)F)cc1	ZINC000163318435	331020233	/nfs/dbraw/zinc/02/02/33/331020233.db2.gz	WMVRNFDLNXDPBE-CHWSQXEVSA-N	1	0	283.362	4.163	20	30		CIEDRO
C=CCC1(C[NH2+][C@@H](C)c2cncc(F)c2)CCCC1	ZINC000451247407	331021819	/nfs/dbraw/zinc/02/18/19/331021819.db2.gz	XMXNEVNOEIPBOS-ZDUSSCGKSA-N	1	0	262.372	4.008	20	30		CIEDRO
CC(C)C[C@@]1(C)CCC[N@@H+]1CCCC(C)(C)C#N	ZINC000451287948	331023145	/nfs/dbraw/zinc/02/31/45/331023145.db2.gz	HDRMIZRMNOWPSW-MRXNPFEDSA-N	1	0	250.430	4.217	20	30		CIEDRO
C=C(C[NH2+][C@H](C)CCCc1cccnc1)c1ccccc1	ZINC000453095134	331088653	/nfs/dbraw/zinc/08/86/53/331088653.db2.gz	XZZWFGPSDQKTAK-QGZVFWFLSA-N	1	0	280.415	4.096	20	30		CIEDRO
C[C@H]1CC[C@@H]([NH2+]Cc2cccc(C#N)c2)c2sccc21	ZINC000453101902	331089263	/nfs/dbraw/zinc/08/92/63/331089263.db2.gz	ZPJCVCHPRRONMJ-BLLLJJGKSA-N	1	0	282.412	4.348	20	30		CIEDRO
CC[C@H]([NH2+][C@H](CCC#N)c1ccccc1)c1ccncc1	ZINC000453183522	331098223	/nfs/dbraw/zinc/09/82/23/331098223.db2.gz	YVAKNYJWULEPKL-ZWKOTPCHSA-N	1	0	279.387	4.167	20	30		CIEDRO
C[C@H]([NH2+]C[C@@H]1CSc2ccccc21)c1cccc(C#N)c1	ZINC000453223799	331103563	/nfs/dbraw/zinc/10/35/63/331103563.db2.gz	SVTODTJBZVGVCT-XJKSGUPXSA-N	1	0	294.423	4.098	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCCc2c(F)cccc21)c1ccc(C#N)cc1	ZINC000453238023	331105498	/nfs/dbraw/zinc/10/54/98/331105498.db2.gz	QBXBFIVQVRMOHE-ORAYPTAESA-N	1	0	294.373	4.426	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@H]1CCCCC1(F)F)C1CC1	ZINC000453260951	331108741	/nfs/dbraw/zinc/10/87/41/331108741.db2.gz	YHTZAUIDZWSQQC-KGLIPLIRSA-N	1	0	257.368	4.146	20	30		CIEDRO
Cc1ccc([C@@H](C)[NH2+][C@H]2CCc3ccc(C#N)cc32)cc1F	ZINC000453264638	331108971	/nfs/dbraw/zinc/10/89/71/331108971.db2.gz	WLUFYOSEHXNTOA-YJYMSZOUSA-N	1	0	294.373	4.344	20	30		CIEDRO
CCCc1ccc([C@H](C)[NH2+][C@H]2CC[C@@H](CC#N)C2)cc1	ZINC000453285620	331111086	/nfs/dbraw/zinc/11/10/86/331111086.db2.gz	CCXYZROSBPYQSZ-ZVZYQTTQSA-N	1	0	270.420	4.372	20	30		CIEDRO
CC(C)(C)[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000453286483	331111233	/nfs/dbraw/zinc/11/12/33/331111233.db2.gz	DBEVASHTZILYJZ-JONQDZQNSA-N	1	0	262.441	4.263	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1cc2c(s1)CCCC2	ZINC000453289003	331111544	/nfs/dbraw/zinc/11/15/44/331111544.db2.gz	HKJUASQVQNMBEJ-YDHLFZDLSA-N	1	0	288.460	4.360	20	30		CIEDRO
CC(C)[C@H]1CC[C@@H](C)C[C@H]1[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000453294091	331112283	/nfs/dbraw/zinc/11/22/83/331112283.db2.gz	QSSZNFCKSYDXJP-DRRXZNNHSA-N	1	0	262.441	4.119	20	30		CIEDRO
CC(C)[C@@H]1CC[C@@H](C)C[C@H]1[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000453294094	331112299	/nfs/dbraw/zinc/11/22/99/331112299.db2.gz	QSSZNFCKSYDXJP-JSRQGNBESA-N	1	0	262.441	4.119	20	30		CIEDRO
Cc1cc2c(cc1C)[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)CCCO2	ZINC000453295069	331112373	/nfs/dbraw/zinc/11/23/73/331112373.db2.gz	RMEOFORFGPDLEQ-XYJFISCASA-N	1	0	298.430	4.189	20	30		CIEDRO
CC(C)C[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccccc1	ZINC000453295982	331112451	/nfs/dbraw/zinc/11/24/51/331112451.db2.gz	SSLKYXMDOQGNHC-SZMVWBNQSA-N	1	0	270.420	4.446	20	30		CIEDRO
C[C@H]1CC[C@@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)c2sccc21	ZINC000453296170	331112543	/nfs/dbraw/zinc/11/25/43/331112543.db2.gz	UGYGWEKOLGLVCS-PWNZVWSESA-N	1	0	274.433	4.358	20	30		CIEDRO
COc1ccc2c(c1)C(C)(C)C[C@H]2[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000453297914	331112723	/nfs/dbraw/zinc/11/27/23/331112723.db2.gz	WQJXMPFIAKXVFT-SUNYJGFJSA-N	1	0	298.430	4.090	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1cc(C)cs1)c1ccco1	ZINC000453307834	331114230	/nfs/dbraw/zinc/11/42/30/331114230.db2.gz	CGPDDLJMYRXEJL-AWEZNQCLSA-N	1	0	261.390	4.447	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@H](C[C@@H]1CCOC1)c1ccc(F)cc1	ZINC000453312163	331114974	/nfs/dbraw/zinc/11/49/74/331114974.db2.gz	UUSROAAWXIEVAP-WMLDXEAASA-N	1	0	291.410	4.095	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@@H](C)c1ccc2ccccc2n1	ZINC000453313772	331115192	/nfs/dbraw/zinc/11/51/92/331115192.db2.gz	WXSMLTBEHKDFRR-ZDUSSCGKSA-N	1	0	254.377	4.098	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H]1CCO[C@H](C(C)C)C1)c1ccco1	ZINC000453317623	331115888	/nfs/dbraw/zinc/11/58/88/331115888.db2.gz	KQJPNQXJQMDAOB-RYRKJORJSA-N	1	0	291.435	4.328	20	30		CIEDRO
C=CCC1(C[NH2+][C@H](C)c2ccc(F)cn2)CCCC1	ZINC000453340167	331119113	/nfs/dbraw/zinc/11/91/13/331119113.db2.gz	BLFRSMYMKYVPKS-CYBMUJFWSA-N	1	0	262.372	4.008	20	30		CIEDRO
C=C(CC)C[NH2+][C@@H](C)c1cccc(-c2ccncc2)c1	ZINC000453352518	331120830	/nfs/dbraw/zinc/12/08/30/331120830.db2.gz	JAZVFFOKLRIHLR-HNNXBMFYSA-N	1	0	266.388	4.365	20	30		CIEDRO
CC1(C)C[C@H]([NH2+]Cc2ccc(C#N)c(F)c2)c2ccccc21	ZINC000453396120	331127937	/nfs/dbraw/zinc/12/79/37/331127937.db2.gz	YEKLYUQESUPXMA-SFHVURJKSA-N	1	0	294.373	4.210	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@H]1CCOC(C)(C)C1)c1ccco1	ZINC000453434956	331131609	/nfs/dbraw/zinc/13/16/09/331131609.db2.gz	TXTPPGZVERTVTK-LSDHHAIUSA-N	1	0	277.408	4.082	20	30		CIEDRO
CC(C)(C)C[N@H+](CCC#N)CC1CCC(F)(F)CC1	ZINC000459349493	331277566	/nfs/dbraw/zinc/27/75/66/331277566.db2.gz	XNRQPFIBBWGDBZ-UHFFFAOYSA-N	1	0	272.383	4.074	20	30		CIEDRO
CC(C)CC[N@H+](CCC#N)CC1CCC(F)(F)CC1	ZINC000459370170	331278775	/nfs/dbraw/zinc/27/87/75/331278775.db2.gz	XEGQOMVTDBBJHA-UHFFFAOYSA-N	1	0	272.383	4.074	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@H](C)c1nc2c(s1)CCC2	ZINC000459645386	331291849	/nfs/dbraw/zinc/29/18/49/331291849.db2.gz	GKIBUELTGWQYFT-NEPJUHHUSA-N	1	0	264.438	4.027	20	30		CIEDRO
CC(C)(CC#N)C[NH2+][C@@H]1CCCC[C@H]1c1ccccc1	ZINC000459684218	331294252	/nfs/dbraw/zinc/29/42/52/331294252.db2.gz	BUGZQLLFTLHCDM-DLBZAZTESA-N	1	0	270.420	4.242	20	30		CIEDRO
C[C@@H](Cc1cccc(C(F)(F)F)c1)[NH2+]CC(C)(C)CC#N	ZINC000459729661	331296442	/nfs/dbraw/zinc/29/64/42/331296442.db2.gz	KPQPIWHSLVTUIV-LBPRGKRZSA-N	1	0	298.352	4.166	20	30		CIEDRO
C[C@@H]([NH2+]CC(C)(C)CC#N)c1ccc(Br)cc1	ZINC000459731475	331296579	/nfs/dbraw/zinc/29/65/79/331296579.db2.gz	NQWSHEANGPEAFY-LLVKDONJSA-N	1	0	295.224	4.040	20	30		CIEDRO
C[C@@H](Cc1cccc(F)c1)[N@H+](C)CCCCC(C)(C)C#N	ZINC000459758642	331298880	/nfs/dbraw/zinc/29/88/80/331298880.db2.gz	IPJKAUBGDBERGS-HNNXBMFYSA-N	1	0	290.426	4.409	20	30		CIEDRO
CC[C@H]([NH2+][C@H](C)c1ccc(C#N)cc1)c1cccc(F)c1	ZINC000166476445	331307271	/nfs/dbraw/zinc/30/72/71/331307271.db2.gz	MUXRVDZACDOCLG-ACJLOTCBSA-N	1	0	282.362	4.499	20	30		CIEDRO
CC[C@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)c1cccc(F)c1	ZINC000166476223	331307296	/nfs/dbraw/zinc/30/72/96/331307296.db2.gz	MUXRVDZACDOCLG-UGSOOPFHSA-N	1	0	282.362	4.499	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)c1cccc(F)c1	ZINC000166476334	331307302	/nfs/dbraw/zinc/30/73/02/331307302.db2.gz	MUXRVDZACDOCLG-SCLBCKFNSA-N	1	0	282.362	4.499	20	30		CIEDRO
C=Cc1ccc(CC[NH2+][C@@H](C)c2ccc(C#N)cc2)cc1	ZINC000461077500	331311193	/nfs/dbraw/zinc/31/11/93/331311193.db2.gz	SIUCOWAIYOACLW-HNNXBMFYSA-N	1	0	276.383	4.095	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+]C[C@@H](c1ccc(C)o1)N1CCCC1	ZINC000461886439	331315177	/nfs/dbraw/zinc/31/51/77/331315177.db2.gz	UKHPGXAYWOHERA-IRXDYDNUSA-N	1	0	290.451	4.059	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@H](COC)c1ccc(C)o1	ZINC000462115993	331317355	/nfs/dbraw/zinc/31/73/55/331317355.db2.gz	FSGDJUBLNSREQN-LSDHHAIUSA-N	1	0	265.397	4.000	20	30		CIEDRO
CCC[C@H](CCc1ccccc1)[NH2+]CCCCC#N	ZINC000462112021	331317406	/nfs/dbraw/zinc/31/74/06/331317406.db2.gz	LXADGKDQUMTHIW-QGZVFWFLSA-N	1	0	258.409	4.071	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+]CCc1c[nH]c2ccc(F)cc12	ZINC000462121857	331317768	/nfs/dbraw/zinc/31/77/68/331317768.db2.gz	HTBDXXPLHGHQTK-HNNXBMFYSA-N	1	0	274.383	4.184	20	30		CIEDRO
C=CCc1cc(C[NH2+][C@@H](C)C[C@H](C)CC)cc(OC)c1O	ZINC000462738387	331326583	/nfs/dbraw/zinc/32/65/83/331326583.db2.gz	RVCDDWVBKPEFLO-KGLIPLIRSA-N	1	0	291.435	4.044	20	30		CIEDRO
N#Cc1ccc(C[NH2+]CCCCC2CCCC2)cc1	ZINC000462747410	331327192	/nfs/dbraw/zinc/32/71/92/331327192.db2.gz	VELOYNXYXXZRJD-UHFFFAOYSA-N	1	0	256.393	4.008	20	30		CIEDRO
C=CC[C@@H](C)[C@@H](C)[NH2+]Cc1ccc(C(F)F)cc1	ZINC000462836826	331332208	/nfs/dbraw/zinc/33/22/08/331332208.db2.gz	UHRRTZQJJXNVPS-VXGBXAGGSA-N	1	0	253.336	4.315	20	30		CIEDRO
C[C@@H](Nc1cc2c(c[nH+]1)CCCC2)c1ccc(C#N)cc1F	ZINC000462953464	331336025	/nfs/dbraw/zinc/33/60/25/331336025.db2.gz	XMJXPTNSMLGEHH-GFCCVEGCSA-N	1	0	295.361	4.144	20	30		CIEDRO
C=C(C)C[N@H+](C)CCCCCn1c(C)nc2ccccc21	ZINC000463159719	331341262	/nfs/dbraw/zinc/34/12/62/331341262.db2.gz	HLMWZWYTZHQXIJ-UHFFFAOYSA-N	1	0	285.435	4.023	20	30		CIEDRO
CC1(C)CCc2ccccc2[C@@H]1[NH2+][C@@H]1CCC[C@H](C#N)C1	ZINC000463242887	331343838	/nfs/dbraw/zinc/34/38/38/331343838.db2.gz	LTRLMDFLDFDOSO-LESCRADOSA-N	1	0	282.431	4.372	20	30		CIEDRO
CCC[C@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)c1ccc(F)cc1F	ZINC000463244275	331343913	/nfs/dbraw/zinc/34/39/13/331343913.db2.gz	WOBPOCDSFBAXBX-QEORTHHSSA-N	1	0	292.373	4.478	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)[C@@H](C)C1CCCCC1	ZINC000463243923	331343931	/nfs/dbraw/zinc/34/39/31/331343931.db2.gz	FHQMUZHRQQHUGK-JYYAWHABSA-N	1	0	262.441	4.263	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@@H]2CCCC[C@@H]2Cc2ccccc2)C1	ZINC000463286471	331345121	/nfs/dbraw/zinc/34/51/21/331345121.db2.gz	VYXZBCRKGHWMMV-YSTOQKLRSA-N	1	0	296.458	4.460	20	30		CIEDRO
CC(C)(C[NH2+][C@H]1CCC[C@@H](C#N)C1)c1cccc(Cl)c1	ZINC000463284754	331345129	/nfs/dbraw/zinc/34/51/29/331345129.db2.gz	WDPRAZFLQFYQMD-CJNGLKHVSA-N	1	0	290.838	4.290	20	30		CIEDRO
CC(C)[C@H]1CC[C@@H](C)C[C@H]1[NH2+][C@@H]1CCC[C@H](C#N)C1	ZINC000463292154	331345384	/nfs/dbraw/zinc/34/53/84/331345384.db2.gz	ZXTCERSXUBTSGB-ZHCJQAHYSA-N	1	0	262.441	4.119	20	30		CIEDRO
CC(C)CC(CC(C)C)[NH2+][C@H]1CCC[C@H](C#N)C1	ZINC000463294688	331345707	/nfs/dbraw/zinc/34/57/07/331345707.db2.gz	FQAVIOFIBDHHHF-GJZGRUSLSA-N	1	0	250.430	4.119	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+]Cc2ccc(Cl)cc2Cl)C1	ZINC000463304683	331345852	/nfs/dbraw/zinc/34/58/52/331345852.db2.gz	SCEKDQARNYATMO-GWCFXTLKSA-N	1	0	283.202	4.165	20	30		CIEDRO
Cc1ccc([C@H]2C[C@@H](C)CC[N@@H+]2Cc2cccc(C#N)c2)o1	ZINC000464832566	331370191	/nfs/dbraw/zinc/37/01/91/331370191.db2.gz	MJNOIJQXUCPXLZ-KBXCAEBGSA-N	1	0	294.398	4.433	20	30		CIEDRO
CCC[C@]1(C)CCC[N@H+](Cc2ccc(C#N)cc2F)C1	ZINC000464834132	331370342	/nfs/dbraw/zinc/37/03/42/331370342.db2.gz	GBYQAMFLPVLZEW-QGZVFWFLSA-N	1	0	274.383	4.100	20	30		CIEDRO
C[C@H]1CCC[N@@H+]1Cc1ccc(-c2ccccc2C#N)cc1	ZINC000464846737	331370848	/nfs/dbraw/zinc/37/08/48/331370848.db2.gz	TVNWNASJRKJLEV-HNNXBMFYSA-N	1	0	276.383	4.210	20	30		CIEDRO
C[C@@H]1CCC[N@@H+]1Cc1ccc(-c2ccccc2C#N)cc1	ZINC000464847038	331370934	/nfs/dbraw/zinc/37/09/34/331370934.db2.gz	TVNWNASJRKJLEV-OAHLLOKOSA-N	1	0	276.383	4.210	20	30		CIEDRO
Cc1cc(C[NH2+]CC[C@@H](C)c2ccccc2)ccc1C#N	ZINC000466398526	331394844	/nfs/dbraw/zinc/39/48/44/331394844.db2.gz	ZPVJUUCTDSLVJB-OAHLLOKOSA-N	1	0	278.399	4.150	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1cnc(C2CCCC2)s1	ZINC000466404352	331395266	/nfs/dbraw/zinc/39/52/66/331395266.db2.gz	KMNXPPFVKMJPMM-CYBMUJFWSA-N	1	0	264.438	4.245	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1cnc(C2CCCC2)s1	ZINC000466404353	331395341	/nfs/dbraw/zinc/39/53/41/331395341.db2.gz	KMNXPPFVKMJPMM-ZDUSSCGKSA-N	1	0	264.438	4.245	20	30		CIEDRO
N#Cc1cccc(CC[NH2+]Cc2cccc3ccccc32)c1	ZINC000466425065	331396457	/nfs/dbraw/zinc/39/64/57/331396457.db2.gz	IGSVZVWXDNJZSD-UHFFFAOYSA-N	1	0	286.378	4.044	20	30		CIEDRO
N#Cc1cccc(CC[NH2+][C@@H]2CC[C@H](c3ccccc3)C2)c1	ZINC000466426674	331396700	/nfs/dbraw/zinc/39/67/00/331396700.db2.gz	WKASIABLWWBJEK-VQTJNVASSA-N	1	0	290.410	4.027	20	30		CIEDRO
CCC[C@H]1CCC[N@@H+]([C@H](C)c2ccc(C#N)cc2)C1	ZINC000466482522	331398161	/nfs/dbraw/zinc/39/81/61/331398161.db2.gz	RPVJQYNWWPOFEF-ZBFHGGJFSA-N	1	0	256.393	4.131	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@H]1CCCCc2cc(C#N)ccc21	ZINC000467411943	331418024	/nfs/dbraw/zinc/41/80/24/331418024.db2.gz	GFUSFPMOFBFKRU-AEFFLSMTSA-N	1	0	268.404	4.270	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@@H](C)c1csc(C(C)C)n1	ZINC000467416528	331418485	/nfs/dbraw/zinc/41/84/85/331418485.db2.gz	GUVQFZCOVWPJNY-NWDGAFQWSA-N	1	0	252.427	4.272	20	30		CIEDRO
CCc1ccc([C@H](C)[NH2+]CCc2cccc(C#N)c2)cc1	ZINC000467427617	331418745	/nfs/dbraw/zinc/41/87/45/331418745.db2.gz	DYHPSSRPPQLUFH-HNNXBMFYSA-N	1	0	278.399	4.014	20	30		CIEDRO
CC[C@H](Cc1ccc(C)cc1)[NH2+]CCc1cccc(C#N)c1	ZINC000467440573	331419427	/nfs/dbraw/zinc/41/94/27/331419427.db2.gz	VJNMIRBKHDNSGF-HXUWFJFHSA-N	1	0	292.426	4.020	20	30		CIEDRO
Cc1ccc(CC[C@@H](C)[NH2+]CCc2cccc(C#N)c2)cc1	ZINC000467444109	331419739	/nfs/dbraw/zinc/41/97/39/331419739.db2.gz	NKNGBTXQUBHZPE-QGZVFWFLSA-N	1	0	292.426	4.020	20	30		CIEDRO
CC1(C)C[C@@H]([NH2+]CCc2cccc(C#N)c2)c2ccccc21	ZINC000467453315	331420193	/nfs/dbraw/zinc/42/01/93/331420193.db2.gz	LGGRBCYIYPBWDO-LJQANCHMSA-N	1	0	290.410	4.113	20	30		CIEDRO
C=C[C@](C)(CC)C(=O)Nc1cccc(C[NH+](CC)CC)c1	ZINC000467520604	331421147	/nfs/dbraw/zinc/42/11/47/331421147.db2.gz	VPSMWIKIRROVGY-GOSISDBHSA-N	1	0	288.435	4.069	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+]Cc1cccc(-c2cccnc2)c1	ZINC000467632232	331422879	/nfs/dbraw/zinc/42/28/79/331422879.db2.gz	CZZWVXOGOGXGNW-JKSUJKDBSA-N	1	0	280.415	4.439	20	30		CIEDRO
CC[C@H](CC#N)[NH2+][C@@H]1CCC[C@H]1c1ccc(Cl)cc1	ZINC000468474057	331435312	/nfs/dbraw/zinc/43/53/12/331435312.db2.gz	BONLYQXCFPDQMB-OWCLPIDISA-N	1	0	276.811	4.258	20	30		CIEDRO
C=C[C@](C)(CC)C(=O)Nc1ccc(C[NH+](CC)CC)cc1	ZINC000470131153	331472301	/nfs/dbraw/zinc/47/23/01/331472301.db2.gz	GZZDEFPAVLPXFZ-GOSISDBHSA-N	1	0	288.435	4.069	20	30		CIEDRO
C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+][C@@H]2CC[C@@H](C#N)C2)C1	ZINC000470368084	331480866	/nfs/dbraw/zinc/48/08/66/331480866.db2.gz	WXPIDVLFBXHKNH-KFXXHRTLSA-N	1	0	282.431	4.241	20	30		CIEDRO
C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@@H](C#N)C2)C[C@@H](c2ccccc2)C1	ZINC000470368083	331480952	/nfs/dbraw/zinc/48/09/52/331480952.db2.gz	WXPIDVLFBXHKNH-BVRUVYRISA-N	1	0	282.431	4.241	20	30		CIEDRO
CC(C)[C@H]([NH2+][C@@H]1CC[C@@H](C#N)C1)c1ccccc1Cl	ZINC000471586230	331511429	/nfs/dbraw/zinc/51/14/29/331511429.db2.gz	CFSVVQUWFHCEJM-IOASZLSFSA-N	1	0	276.811	4.319	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@@H](c2ccccc2F)C2CCCC2)C1	ZINC000471589344	331511503	/nfs/dbraw/zinc/51/15/03/331511503.db2.gz	OOBXXOCHCGRDMV-QIIPPGSGSA-N	1	0	286.394	4.339	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH2+]C2CCC(c3ccc(F)cc3)CC2)C1	ZINC000471587434	331511631	/nfs/dbraw/zinc/51/16/31/331511631.db2.gz	ULBZHRKWCUEMHD-WGDNJCCTSA-N	1	0	286.394	4.134	20	30		CIEDRO
C=CCCCC[NH2+][C@H](C)c1nc2c(s1)CCCC2	ZINC000471595830	331511968	/nfs/dbraw/zinc/51/19/68/331511968.db2.gz	WEQOHIAGMZTMSH-GFCCVEGCSA-N	1	0	264.438	4.029	20	30		CIEDRO
CCC(C)(C)C1CCC([NH2+][C@H]2CC[C@@H](C#N)C2)CC1	ZINC000471596394	331511971	/nfs/dbraw/zinc/51/19/71/331511971.db2.gz	LGGALTPRLNEGNH-LMPOIIKSSA-N	1	0	262.441	4.263	20	30		CIEDRO
CCC(C)(C)C1CCC([NH2+][C@H]2CC[C@H](C#N)C2)CC1	ZINC000471596393	331512025	/nfs/dbraw/zinc/51/20/25/331512025.db2.gz	LGGALTPRLNEGNH-LBDPXKHJSA-N	1	0	262.441	4.263	20	30		CIEDRO
CC(C)[C@@H](C[NH+]1CCC(C)(C#N)CC1)c1ccccc1	ZINC000474920992	331603943	/nfs/dbraw/zinc/60/39/43/331603943.db2.gz	ANKLEHAZPVWTCZ-QGZVFWFLSA-N	1	0	270.420	4.052	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1	ZINC000475211421	331618662	/nfs/dbraw/zinc/61/86/62/331618662.db2.gz	LQRKRCDHKOUHPI-SDDRHHMPSA-N	1	0	269.841	4.449	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+]CC1CCN(c2ccccc2)CC1	ZINC000475287122	331622420	/nfs/dbraw/zinc/62/24/20/331622420.db2.gz	SYSAVCAOVMPTEJ-SFHVURJKSA-N	1	0	286.463	4.237	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+][C@H](C)c1ccc(Br)cn1	ZINC000475484155	331632933	/nfs/dbraw/zinc/63/29/33/331632933.db2.gz	CVHNNFAELIQQRS-QJPTWQEYSA-N	1	0	297.240	4.095	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@H]1CC[C@H](c2cccc(F)c2)C1	ZINC000475566421	331637460	/nfs/dbraw/zinc/63/74/60/331637460.db2.gz	ZYGJWHMPKNEHJN-QRTARXTBSA-N	1	0	261.384	4.406	20	30		CIEDRO
Cc1cccc([C@H]([NH2+]CCCC#N)c2cccc(F)c2)c1	ZINC000510983152	332922999	/nfs/dbraw/zinc/92/29/99/332922999.db2.gz	GYWVLIORTUJDON-SFHVURJKSA-N	1	0	282.362	4.117	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@H]1CCc2cnn(C(C)C)c2C1	ZINC000477709980	331688986	/nfs/dbraw/zinc/68/89/86/331688986.db2.gz	APGMYQGMHVJKMC-IRXDYDNUSA-N	1	0	289.467	4.046	20	30		CIEDRO
CC(C)(C[NH2+]Cc1ccc(C#N)cc1)C1=CCCCC1	ZINC000479393270	331726898	/nfs/dbraw/zinc/72/68/98/331726898.db2.gz	PEXHQQZCKGIKSB-UHFFFAOYSA-N	1	0	268.404	4.174	20	30		CIEDRO
C[C@@H](CCCC(F)(F)F)[NH2+][C@@H](C)c1cccc(C#N)c1	ZINC000480142924	331759432	/nfs/dbraw/zinc/75/94/32/331759432.db2.gz	BMCVILZNUFLVCI-RYUDHWBXSA-N	1	0	284.325	4.330	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@@H](C)c1ccc(Cl)cn1	ZINC000480150340	331759830	/nfs/dbraw/zinc/75/98/30/331759830.db2.gz	QYHLVRJKNKCUDB-NEPJUHHUSA-N	1	0	252.789	4.130	20	30		CIEDRO
C=C(C)C[NH2+][C@H](c1cc(F)cc(Br)c1)C1CC1	ZINC000481746839	331814850	/nfs/dbraw/zinc/81/48/50/331814850.db2.gz	RFHQRGPVPKVHJB-AWEZNQCLSA-N	1	0	298.199	4.205	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+]Cc1cc(-c2ccccc2)on1	ZINC000482033906	331822226	/nfs/dbraw/zinc/82/22/26/331822226.db2.gz	PYUBMVUCXBXOGQ-OAHLLOKOSA-N	1	0	270.376	4.176	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](C)c1sccc1OC	ZINC000186239793	333157051	/nfs/dbraw/zinc/15/70/51/333157051.db2.gz	IBRFFLUXRSEPOF-NWDGAFQWSA-N	1	0	253.411	4.152	20	30		CIEDRO
C=CC[NH2+]C1(c2cc(C(F)(F)F)ccc2Cl)CC1	ZINC000484991681	331908168	/nfs/dbraw/zinc/90/81/68/331908168.db2.gz	BYXRBCCCPDGPSH-UHFFFAOYSA-N	1	0	275.701	4.124	20	30		CIEDRO
CCOc1cccc([C@H](C)[NH2+]Cc2ccc(C#N)c(C)c2)c1	ZINC000488143098	331991950	/nfs/dbraw/zinc/99/19/50/331991950.db2.gz	RSNKEWBKIPNIOX-HNNXBMFYSA-N	1	0	294.398	4.116	20	30		CIEDRO
Cc1cc(C[NH2+][C@H](C)c2cccc(Cl)c2)ccc1C#N	ZINC000488147180	331991959	/nfs/dbraw/zinc/99/19/59/331991959.db2.gz	IFYFJFHJQIOIOJ-CYBMUJFWSA-N	1	0	284.790	4.371	20	30		CIEDRO
C[C@@H]([NH2+]CC1(CC#N)CC1)c1ccc(C(C)(C)C)cc1	ZINC000488297444	331998155	/nfs/dbraw/zinc/99/81/55/331998155.db2.gz	VTEYJQYMGYPGLC-CQSZACIVSA-N	1	0	270.420	4.329	20	30		CIEDRO
CC(C)C1CC([NH2+][C@@H](CCC#N)c2ccccc2)C1	ZINC000488442568	332009153	/nfs/dbraw/zinc/00/91/53/332009153.db2.gz	UBWAUOKTYVTINT-JCYILVPMSA-N	1	0	256.393	4.056	20	30		CIEDRO
CC[N@H+](C[C@@H](C)C#N)[C@H](C)CCSc1ccccc1	ZINC000488723007	332022644	/nfs/dbraw/zinc/02/26/44/332022644.db2.gz	HBMZMSZRQVSILQ-LSDHHAIUSA-N	1	0	276.449	4.039	20	30		CIEDRO
C[C@H](c1cccc(C#N)c1)[N@H+](C)CCCOc1ccccc1	ZINC000490091716	332081118	/nfs/dbraw/zinc/08/11/18/332081118.db2.gz	NCEYBEQHLGIRSH-MRXNPFEDSA-N	1	0	294.398	4.020	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc2c(c1)CCCC2)c1ccc(C#N)cc1	ZINC000490572895	332092416	/nfs/dbraw/zinc/09/24/16/332092416.db2.gz	SQUFMVKDNBUUCR-OAHLLOKOSA-N	1	0	290.410	4.288	20	30		CIEDRO
C=CC[N@H+](CCCCC(F)(F)F)CCc1ccco1	ZINC000491368104	332198161	/nfs/dbraw/zinc/19/81/61/332198161.db2.gz	OSEHABWYWULSLF-UHFFFAOYSA-N	1	0	275.314	4.043	20	30		CIEDRO
C=CC[N@@H+](C/C=C\c1ccccc1)CCc1ccco1	ZINC000491395698	332204250	/nfs/dbraw/zinc/20/42/50/332204250.db2.gz	KDFMCBAXEJPWJZ-POHAHGRESA-N	1	0	267.372	4.024	20	30		CIEDRO
C[C@@H]([NH2+]C[C@@H]1CCCCC(F)(F)C1)c1ccc(C#N)cc1	ZINC000494994338	332498803	/nfs/dbraw/zinc/49/88/03/332498803.db2.gz	DKXHIPVUQHBQSK-UKRRQHHQSA-N	1	0	292.373	4.424	20	30		CIEDRO
CCCC[C@@H]1CCC[C@H]1[NH2+]CCCC1(C#N)CCOCC1	ZINC000499623884	332589354	/nfs/dbraw/zinc/58/93/54/332589354.db2.gz	GBESJIGFKVPTOE-IAGOWNOFSA-N	1	0	292.467	4.035	20	30		CIEDRO
C[C@@H](C[NH+]1CCC(C#N)CC1)c1ccc(C(F)(F)F)cc1	ZINC000501151570	332627615	/nfs/dbraw/zinc/62/76/15/332627615.db2.gz	AYDGLGHPVLVMRN-LBPRGKRZSA-N	1	0	296.336	4.044	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](C)c1cnn(C2CCCC2)c1	ZINC000502390763	332655950	/nfs/dbraw/zinc/65/59/50/332655950.db2.gz	OSBVDINBCABYTP-LSDHHAIUSA-N	1	0	275.440	4.394	20	30		CIEDRO
Cc1cc([C@H](C)[NH2+][C@@H](C)c2ccc(C#N)cc2)oc1C	ZINC000502425115	332658714	/nfs/dbraw/zinc/65/87/14/332658714.db2.gz	BTDSDZKIOHOEAX-STQMWFEESA-N	1	0	268.360	4.180	20	30		CIEDRO
CC[C@H]1CCC[C@@H]1[NH2+]Cc1cccc(OCCCC#N)c1	ZINC000154131425	334688997	/nfs/dbraw/zinc/68/89/97/334688997.db2.gz	LJFIXQSGAHPYDC-WMZOPIPTSA-N	1	0	286.419	4.037	20	30		CIEDRO
N#CCCCC[NH2+]Cc1ccc(-c2ccccc2)cc1F	ZINC000503552322	332691801	/nfs/dbraw/zinc/69/18/01/332691801.db2.gz	RJYIECRIACSUFN-UHFFFAOYSA-N	1	0	282.362	4.276	20	30		CIEDRO
N#CCCC1CC[NH+](Cc2ccc(C(F)F)cc2)CC1	ZINC000572874580	334886731	/nfs/dbraw/zinc/88/67/31/334886731.db2.gz	HURNTDTZWOIHKH-UHFFFAOYSA-N	1	0	278.346	4.140	20	30		CIEDRO
CC1(C#N)CC[NH+](Cc2ccc(-c3ccccc3)cc2)CC1	ZINC000506041611	332760444	/nfs/dbraw/zinc/76/04/44/332760444.db2.gz	KNTNJJATKOEDTN-UHFFFAOYSA-N	1	0	290.410	4.479	20	30		CIEDRO
C[C@H]([NH2+]C1[C@H](C)CCC[C@H]1C)c1ccc(C#N)cc1F	ZINC000512287395	332961778	/nfs/dbraw/zinc/96/17/78/332961778.db2.gz	HUCROXHEALFMFL-UPJWGTAASA-N	1	0	274.383	4.173	20	30		CIEDRO
CC(C)[C@H]([NH2+]Cc1cccc(C#N)c1F)c1ccccc1	ZINC000512410105	332967301	/nfs/dbraw/zinc/96/73/01/332967301.db2.gz	QRBOAQPEBRRUKI-SFHVURJKSA-N	1	0	282.362	4.184	20	30		CIEDRO
C=C(C)C[NH2+]Cc1c(OC(F)F)ccc2ccccc21	ZINC000512410106	332967343	/nfs/dbraw/zinc/96/73/43/332967343.db2.gz	QRIIWENCGVXINE-UHFFFAOYSA-N	1	0	277.314	4.107	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]Cc2c(C)cccc2C)cc1	ZINC000512557410	332973219	/nfs/dbraw/zinc/97/32/19/332973219.db2.gz	QSCKVCLECRKEKV-UHFFFAOYSA-N	1	0	281.399	4.158	20	30		CIEDRO
CS[C@@H]1CCC[C@H]([NH2+][C@@H](C)c2ccc(C#N)cc2F)C1	ZINC000512618839	332976057	/nfs/dbraw/zinc/97/60/57/332976057.db2.gz	JZYURNOKVMQTOT-FPMFFAJLSA-N	1	0	292.423	4.022	20	30		CIEDRO
Cc1cccc([C@@H](C)C[NH2+][C@@H](C)c2ccc(C#N)cc2F)c1	ZINC000512620048	332976216	/nfs/dbraw/zinc/97/62/16/332976216.db2.gz	OIUOWINPUKMJIL-GJZGRUSLSA-N	1	0	296.389	4.460	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1ccc(C#N)cc1F)c1ccccc1	ZINC000512628286	332976691	/nfs/dbraw/zinc/97/66/91/332976691.db2.gz	DHEVRSMOBXIYRG-OLZOCXBDSA-N	1	0	268.335	4.109	20	30		CIEDRO
Cc1ccc2c(c1)CC[C@H]2[NH2+][C@@H](C)c1ccc(C#N)cc1F	ZINC000512628372	332976694	/nfs/dbraw/zinc/97/66/94/332976694.db2.gz	DUBJZXNTVSHKHM-ORAYPTAESA-N	1	0	294.373	4.344	20	30		CIEDRO
C[C@H]([NH2+][C@H]1c2ccccc2C[C@@H]1C)c1ccc(C#N)cc1F	ZINC000512662434	332978594	/nfs/dbraw/zinc/97/85/94/332978594.db2.gz	XFIAKGSAADWFAN-WTOJCKNJSA-N	1	0	294.373	4.281	20	30		CIEDRO
CC[C@H](Cc1ccccc1)[NH2+][C@H](C)c1ccc(C#N)cc1F	ZINC000512669133	332979366	/nfs/dbraw/zinc/97/93/66/332979366.db2.gz	YRWSKYVDCMBENQ-RHSMWYFYSA-N	1	0	296.389	4.369	20	30		CIEDRO
C[C@@H]1CCCC[C@@H]1[NH+]1CCC(Nc2cccc(C#N)c2)CC1	ZINC000512783875	332985759	/nfs/dbraw/zinc/98/57/59/332985759.db2.gz	PHFUVAPXIWLOAP-BEFAXECRSA-N	1	0	297.446	4.013	20	30		CIEDRO
CC(C)(C)c1ccc(C[NH2+]Cc2ccc(C#N)c(F)c2)cc1	ZINC000404260754	332998253	/nfs/dbraw/zinc/99/82/53/332998253.db2.gz	RMGAIZKLVUDDPE-UHFFFAOYSA-N	1	0	296.389	4.285	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CCC[C@@H]1Cc1cccc(F)c1	ZINC000174822717	333008044	/nfs/dbraw/zinc/00/80/44/333008044.db2.gz	NTTJLCJZANCLCI-QGZVFWFLSA-N	1	0	288.410	4.163	20	30		CIEDRO
Cc1ccccc1[C@H]1CCC[N@@H+]1CCCC(C)(C)C#N	ZINC000174830159	333008195	/nfs/dbraw/zinc/00/81/95/333008195.db2.gz	VMPSBXMJXMIMTD-QGZVFWFLSA-N	1	0	270.420	4.462	20	30		CIEDRO
C[C@@H]1C[C@H](c2ccc(F)cc2)C[N@@H+]1CCCC(C)(C)C#N	ZINC000174869161	333009682	/nfs/dbraw/zinc/00/96/82/333009682.db2.gz	BIZDBKQYNGTWLZ-ZBFHGGJFSA-N	1	0	288.410	4.333	20	30		CIEDRO
C[C@@H]1C[C@@H](c2ccc(F)cc2)C[N@@H+]1CCCC(C)(C)C#N	ZINC000174869184	333009691	/nfs/dbraw/zinc/00/96/91/333009691.db2.gz	BIZDBKQYNGTWLZ-GDBMZVCRSA-N	1	0	288.410	4.333	20	30		CIEDRO
C[C@@H]1C[C@H](c2ccccc2)[N@H+](Cc2ccc(C#N)c(F)c2)C1	ZINC000513237046	333010197	/nfs/dbraw/zinc/01/01/97/333010197.db2.gz	SJWWECVIIMHMFR-AUUYWEPGSA-N	1	0	294.373	4.280	20	30		CIEDRO
C[C@@H]1C[C@@H]([NH2+]Cc2ccc(C#N)c(F)c2)c2ccccc21	ZINC000404577439	333015279	/nfs/dbraw/zinc/01/52/79/333015279.db2.gz	SFLGEMLFFQNQEG-KZULUSFZSA-N	1	0	280.346	4.035	20	30		CIEDRO
C=C1CC[NH+](Cc2ccc(OCCCC)c(OC)c2)CC1	ZINC000513447501	333020018	/nfs/dbraw/zinc/02/00/18/333020018.db2.gz	NISGYVLTSBOVBC-UHFFFAOYSA-N	1	0	289.419	4.026	20	30		CIEDRO
Cc1ccc([C@H]2CCC[N@@H+]2Cc2cccc(C#N)c2)s1	ZINC000513479976	333021900	/nfs/dbraw/zinc/02/19/00/333021900.db2.gz	UPKUUJFPGNSXDM-MRXNPFEDSA-N	1	0	282.412	4.265	20	30		CIEDRO
C[C@@H](c1ccc(Cl)cc1)[C@H](C)[N@H+](C)CCCCC#N	ZINC000175433079	333024907	/nfs/dbraw/zinc/02/49/07/333024907.db2.gz	CBPZJTLYKRPXOA-KGLIPLIRSA-N	1	0	278.827	4.458	20	30		CIEDRO
Cc1ccc([C@@H](C)[NH2+]Cc2ccc(C#N)c(F)c2)cc1C	ZINC000404743447	333025281	/nfs/dbraw/zinc/02/52/81/333025281.db2.gz	CRDNEHJSSQFHDN-CQSZACIVSA-N	1	0	282.362	4.165	20	30		CIEDRO
Cc1ccccc1C1CC([NH2+]Cc2ccc(C#N)c(F)c2)C1	ZINC000404834512	333028472	/nfs/dbraw/zinc/02/84/72/333028472.db2.gz	KDLDASHTOAJORQ-UHFFFAOYSA-N	1	0	294.373	4.042	20	30		CIEDRO
N#Cc1ccc(C[N@@H+]2CCC[C@@H](Cc3ccccc3)C2)s1	ZINC000513643764	333028651	/nfs/dbraw/zinc/02/86/51/333028651.db2.gz	WYDBZFMACUKWCD-INIZCTEOSA-N	1	0	296.439	4.074	20	30		CIEDRO
CC1(c2ccccc2)CC[NH+](Cc2cc(C#N)cs2)CC1	ZINC000513656135	333029551	/nfs/dbraw/zinc/02/95/51/333029551.db2.gz	QDUFWVSCQZWKLF-UHFFFAOYSA-N	1	0	296.439	4.173	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@H](OC)c1ccccc1)c1ccco1	ZINC000513661464	333030325	/nfs/dbraw/zinc/03/03/25/333030325.db2.gz	OUUYGCIIOBVKDW-WMZOPIPTSA-N	1	0	285.387	4.264	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C#N)c(F)c1)c1ccc2c(c1)CCC2	ZINC000404861197	333030711	/nfs/dbraw/zinc/03/07/11/333030711.db2.gz	WMXVHQBZPWQDST-CYBMUJFWSA-N	1	0	294.373	4.037	20	30		CIEDRO
C=C[C@@H](C)[NH2+][C@H](C)c1cc(C)c(Br)s1	ZINC000308599951	333035955	/nfs/dbraw/zinc/03/59/55/333035955.db2.gz	ALMIMPKITGVGDB-RKDXNWHRSA-N	1	0	274.227	4.044	20	30		CIEDRO
C=CCC[C@H](NCC1([NH+](C)C)CCCCC1)c1ccco1	ZINC000513753649	333037651	/nfs/dbraw/zinc/03/76/51/333037651.db2.gz	DVYRHKLBABKOPX-INIZCTEOSA-N	1	0	290.451	4.141	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@@H]1CCc2sc(Cl)cc21	ZINC000309538753	333045162	/nfs/dbraw/zinc/04/51/62/333045162.db2.gz	FOCAIKZKGQCGAK-GXSJLCMTSA-N	1	0	255.814	4.333	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1ccc(Br)cc1F	ZINC000309837082	333050074	/nfs/dbraw/zinc/05/00/74/333050074.db2.gz	BPCRQRXVUDVMCU-JTQLQIEISA-N	1	0	286.188	4.205	20	30		CIEDRO
C=C(C)C[NH+]1CCC(N[C@H](C)c2ccccc2Cl)CC1	ZINC000177313822	333057440	/nfs/dbraw/zinc/05/74/40/333057440.db2.gz	KLQXQENDQKXYGM-CQSZACIVSA-N	1	0	292.854	4.031	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H](C)c1ccc(F)c(F)c1	ZINC000310857037	333062021	/nfs/dbraw/zinc/06/20/21/333062021.db2.gz	NCXVCKYISFMEMO-LLVKDONJSA-N	1	0	253.336	4.218	20	30		CIEDRO
C[C@H](NCc1ccc(C#N)cc1F)c1cc2ccccc2o1	ZINC000177861337	333064227	/nfs/dbraw/zinc/06/42/27/333064227.db2.gz	RYTWJIVKSUQYMI-LBPRGKRZSA-N	1	0	294.329	4.294	20	30		CIEDRO
C=CCCCC[NH2+][C@H](c1ccc(OC)cc1)C1CC1	ZINC000311636389	333070608	/nfs/dbraw/zinc/07/06/08/333070608.db2.gz	QDXZDJRKAGGWLI-KRWDZBQOSA-N	1	0	259.393	4.092	20	30		CIEDRO
CC(C)(C)[C@@H]1CCC[C@@H]([NH2+]C[C@@H](C#N)CCC#N)CC1	ZINC000516763305	333082005	/nfs/dbraw/zinc/08/20/05/333082005.db2.gz	OQFQXYFQOCRBGW-BZUAXINKSA-N	1	0	275.440	4.015	20	30		CIEDRO
C[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(C#N)cc1C(F)(F)F	ZINC000516941487	333086995	/nfs/dbraw/zinc/08/69/95/333086995.db2.gz	NHYDEXHKTQDSLP-XHDPSFHLSA-N	1	0	296.336	4.245	20	30		CIEDRO
CCCC[N@H+](CCCSCC#N)C1CCCCC1	ZINC000517240509	333095655	/nfs/dbraw/zinc/09/56/55/333095655.db2.gz	GZNBHFCDKZLWRL-UHFFFAOYSA-N	1	0	268.470	4.068	20	30		CIEDRO
C[C@H]([NH2+]C[C@H]1CCC[C@@H](C)C1)c1ccc(C#N)cc1	ZINC000089606512	333100803	/nfs/dbraw/zinc/10/08/03/333100803.db2.gz	RWRGFYZFEDCDFF-YCPHGPKFSA-N	1	0	256.393	4.035	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+]CC1(c2ccccc2)CC1	ZINC000520954808	333108414	/nfs/dbraw/zinc/10/84/14/333108414.db2.gz	OKXXHFKDXLLRCL-UHFFFAOYSA-N	1	0	293.410	4.073	20	30		CIEDRO
N#CCCCC[N@@H+](CCc1cccc(F)c1)C1CCCC1	ZINC000152547680	333123780	/nfs/dbraw/zinc/12/37/80/333123780.db2.gz	UIBZCLJDJRCPLP-UHFFFAOYSA-N	1	0	288.410	4.307	20	30		CIEDRO
C[C@@H]1CCCc2ccccc2[C@@H]1[NH2+]Cc1cc(C#N)cs1	ZINC000185085675	333135388	/nfs/dbraw/zinc/13/53/88/333135388.db2.gz	YFDWFXVLHNYQNP-FZKQIMNGSA-N	1	0	296.439	4.423	20	30		CIEDRO
C[C@@H]1CCCc2ccccc2[C@@H]1[NH2+]Cc1ccc(C#N)s1	ZINC000185086259	333135397	/nfs/dbraw/zinc/13/53/97/333135397.db2.gz	ZLHPWFZJQWVDML-FZKQIMNGSA-N	1	0	296.439	4.423	20	30		CIEDRO
C=C(C)C[C@@H](C)C(=O)Nc1cccc(C[NH+](CC)CC)c1	ZINC000185086109	333135494	/nfs/dbraw/zinc/13/54/94/333135494.db2.gz	YGSOVFMRIMXYCA-OAHLLOKOSA-N	1	0	288.435	4.069	20	30		CIEDRO
C[C@H]1CCCc2ccccc2[C@H]1[NH2+]Cc1cc(C#N)cs1	ZINC000185085736	333135507	/nfs/dbraw/zinc/13/55/07/333135507.db2.gz	YFDWFXVLHNYQNP-UGSOOPFHSA-N	1	0	296.439	4.423	20	30		CIEDRO
C=CCSCC[NH2+][C@@H](C)c1cc2ccccc2s1	ZINC000219184317	333143930	/nfs/dbraw/zinc/14/39/30/333143930.db2.gz	CUGUTEBJBPHLGP-LBPRGKRZSA-N	1	0	277.458	4.471	20	30		CIEDRO
CCC[N@H+](CCc1cccs1)Cc1ccc(C#N)s1	ZINC000185586363	333144183	/nfs/dbraw/zinc/14/41/83/333144183.db2.gz	FORWDWIRRJHZAX-UHFFFAOYSA-N	1	0	290.457	4.136	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)c1ccc(C(F)(F)F)cc1	ZINC000185769732	333148324	/nfs/dbraw/zinc/14/83/24/333148324.db2.gz	WCHAFVMQHIVFRV-SLEUVZQESA-N	1	0	296.336	4.438	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+]CC2(c3ccc(Cl)cc3)CC2)C1	ZINC000185811133	333149463	/nfs/dbraw/zinc/14/94/63/333149463.db2.gz	BSNGSJCRLSFRIF-CJNGLKHVSA-N	1	0	288.822	4.044	20	30		CIEDRO
Cc1cc(C)cc([C@H](C)[NH2+][C@@H]2CCC[C@H](C#N)C2)c1	ZINC000185817054	333149618	/nfs/dbraw/zinc/14/96/18/333149618.db2.gz	DOBKSHOPCPTMPU-YQQAZPJKSA-N	1	0	256.393	4.036	20	30		CIEDRO
C=C(C)[C@@H]([NH2+]Cc1cccc(C#N)c1)c1ccc(F)c(F)c1	ZINC000187374222	333169978	/nfs/dbraw/zinc/16/99/78/333169978.db2.gz	DCOFCJNEMSBKKX-GOSISDBHSA-N	1	0	298.336	4.243	20	30		CIEDRO
C=CCCC[N@@H+](C)[C@@H](C)c1ncc(-c2ccccc2)o1	ZINC000152578965	333183529	/nfs/dbraw/zinc/18/35/29/333183529.db2.gz	NLUIRVWVMCPGCS-AWEZNQCLSA-N	1	0	270.376	4.301	20	30		CIEDRO
C=C1CC[NH+]([C@H](C)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000521741589	333186456	/nfs/dbraw/zinc/18/64/56/333186456.db2.gz	FFXRWDOWFDTYJL-GFCCVEGCSA-N	1	0	285.309	4.298	20	30		CIEDRO
CCC[N@H+](Cc1ccccc1C#N)[C@H]1CCc2ccccc21	ZINC000521819321	333190093	/nfs/dbraw/zinc/19/00/93/333190093.db2.gz	YIYBNJIVXKUPSN-FQEVSTJZSA-N	1	0	290.410	4.458	20	30		CIEDRO
C=CCCOCC[NH2+][C@@H](C)c1cccc(Cl)c1Cl	ZINC000222447583	333193772	/nfs/dbraw/zinc/19/37/72/333193772.db2.gz	IFIULTVHHUUVIO-NSHDSACASA-N	1	0	288.218	4.237	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CC[C@@H](C(F)(F)F)C(C)(C)C1	ZINC000190181183	333203897	/nfs/dbraw/zinc/20/38/97/333203897.db2.gz	XPGCJWKPEGISSR-GFCCVEGCSA-N	1	0	290.373	4.227	20	30		CIEDRO
CCc1ccc([C@@H](C)[NH2+]Cc2ccc(C#N)c(F)c2)cc1	ZINC000190401603	333206182	/nfs/dbraw/zinc/20/61/82/333206182.db2.gz	UTSJXDOYGSNIFV-CYBMUJFWSA-N	1	0	282.362	4.111	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C2CC2)cc1)c1cccc(C#N)c1	ZINC000190804029	333210809	/nfs/dbraw/zinc/21/08/09/333210809.db2.gz	SNUGPBBFEQRFBJ-CQSZACIVSA-N	1	0	276.383	4.286	20	30		CIEDRO
C[C@@H]([NH2+]CCCC1CCCC1)c1cccc(C#N)c1	ZINC000223730729	333211631	/nfs/dbraw/zinc/21/16/31/333211631.db2.gz	BULGHFYPXJDGCS-CQSZACIVSA-N	1	0	256.393	4.179	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](C)c1cnn(C(C)C)c1C	ZINC000191414013	333219354	/nfs/dbraw/zinc/21/93/54/333219354.db2.gz	XFFHTHBLLSHFLA-KBPBESRZSA-N	1	0	263.429	4.168	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+][C@H](C)c1nc(C(C)(C)C)no1	ZINC000191569348	333221583	/nfs/dbraw/zinc/22/15/83/333221583.db2.gz	UTSVICXIMOFSTM-CHWSQXEVSA-N	1	0	279.428	4.153	20	30		CIEDRO
CCC1(C[NH2+][C@@H](C)c2cccc(C#N)c2)CCCC1	ZINC000224719676	333224733	/nfs/dbraw/zinc/22/47/33/333224733.db2.gz	FIQMWEHWIWDSAH-AWEZNQCLSA-N	1	0	256.393	4.179	20	30		CIEDRO
C[C@@H]1C[C@H](C)C[N@H+]1Cc1ccc(-c2ccccc2C#N)cc1	ZINC000521945079	333224960	/nfs/dbraw/zinc/22/49/60/333224960.db2.gz	CCKJXYUQDRZSPL-JKSUJKDBSA-N	1	0	290.410	4.456	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H](c2ccccc2)C2CCC2)cc1F	ZINC000192100906	333229467	/nfs/dbraw/zinc/22/94/67/333229467.db2.gz	PUVORDDPZXWFPG-LJQANCHMSA-N	1	0	294.373	4.328	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+]Cc1ccc2ncccc2c1	ZINC000192982895	333240965	/nfs/dbraw/zinc/24/09/65/333240965.db2.gz	RQYVKWXKOKDJDR-MRXNPFEDSA-N	1	0	254.377	4.069	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccc2ncccc2c1)C1CC1	ZINC000195147707	333246674	/nfs/dbraw/zinc/24/66/74/333246674.db2.gz	CREPHTPWEDJZCF-QGZVFWFLSA-N	1	0	266.388	4.069	20	30		CIEDRO
C=CCCCCC[NH2+][C@@H](c1ncc(C)s1)C1CC1	ZINC000193548648	333252808	/nfs/dbraw/zinc/25/28/08/333252808.db2.gz	AWHVGWRYJUOXRB-CQSZACIVSA-N	1	0	264.438	4.239	20	30		CIEDRO
CCCC[C@H](CCC)[NH2+]Cc1cc(C#N)cs1	ZINC000226269460	333255720	/nfs/dbraw/zinc/25/57/20/333255720.db2.gz	ZGTSMIQPHGXJKK-ZDUSSCGKSA-N	1	0	250.411	4.068	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCC[C@@H](C)CC1)c1cccc(C#N)c1	ZINC000227311849	333280236	/nfs/dbraw/zinc/28/02/36/333280236.db2.gz	NWMCLKPPORLTCD-CKEIUWERSA-N	1	0	256.393	4.178	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCC[C@@H](C)CC1)c1cccc(C#N)c1	ZINC000227311863	333280267	/nfs/dbraw/zinc/28/02/67/333280267.db2.gz	NWMCLKPPORLTCD-CPUCHLNUSA-N	1	0	256.393	4.178	20	30		CIEDRO
C=CC[C@H](C)[NH2+]Cc1cc(Br)c(Cl)s1	ZINC000227852641	333289286	/nfs/dbraw/zinc/28/92/86/333289286.db2.gz	CZPCPIDIBCSKSO-ZETCQYMHSA-N	1	0	294.645	4.218	20	30		CIEDRO
C=CC[C@@H](C)[NH2+]Cc1cc(Br)c(Cl)s1	ZINC000227852636	333289335	/nfs/dbraw/zinc/28/93/35/333289335.db2.gz	CZPCPIDIBCSKSO-SSDOTTSWSA-N	1	0	294.645	4.218	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@@H]2CC[C@@H]3CCCC[C@H]3C2)c1	ZINC000250072414	333302098	/nfs/dbraw/zinc/30/20/98/333302098.db2.gz	HFKNJFFPSBYIGN-OKZBNKHCSA-N	1	0	268.404	4.007	20	30		CIEDRO
C[C@H]([NH2+]CC(C)(C)CCC#N)c1cc2ccccc2o1	ZINC000229683339	333307739	/nfs/dbraw/zinc/30/77/39/333307739.db2.gz	KWUJEIZDTVNPMV-ZDUSSCGKSA-N	1	0	270.376	4.413	20	30		CIEDRO
C=CCCOCC[NH2+][C@@H](C)c1cc(Cl)ccc1Cl	ZINC000229859970	333310269	/nfs/dbraw/zinc/31/02/69/333310269.db2.gz	BMCGXDSMPUBUAW-NSHDSACASA-N	1	0	288.218	4.237	20	30		CIEDRO
CC(C)(C#N)CCCC[N@@H+]1CCC[C@H]2CCCC[C@@H]21	ZINC000232531030	333338256	/nfs/dbraw/zinc/33/82/56/333338256.db2.gz	NHGJYRIGSWKOJP-CVEARBPZSA-N	1	0	262.441	4.361	20	30		CIEDRO
CC(C)[C@H](c1ccccc1)[N@H+](C)Cc1ccc(C#N)cc1	ZINC000303507577	333343109	/nfs/dbraw/zinc/34/31/09/333343109.db2.gz	NKBWWYAMYXNCTQ-LJQANCHMSA-N	1	0	278.399	4.387	20	30		CIEDRO
C=CC[C@H](C)[NH2+]Cc1ccc(-c2cccc(F)c2C)o1	ZINC000523935679	333349515	/nfs/dbraw/zinc/34/95/15/333349515.db2.gz	CHEQQZRPHYVNJO-LBPRGKRZSA-N	1	0	273.351	4.448	20	30		CIEDRO
CCC[C@@H]1CCCC[N@@H+]1CCCCC(C)(C)C#N	ZINC000233297019	333351143	/nfs/dbraw/zinc/35/11/43/333351143.db2.gz	CWYPMPZBJGOYBE-OAHLLOKOSA-N	1	0	250.430	4.361	20	30		CIEDRO
N#Cc1ccc(F)c(C[N@H+](CC2CC2)C2CCCCC2)c1	ZINC000524111271	333353676	/nfs/dbraw/zinc/35/36/76/333353676.db2.gz	WBHLEZFEXBDDDT-UHFFFAOYSA-N	1	0	286.394	4.242	20	30		CIEDRO
C[C@@H]1CCC[C@H]([N@H+](C)CCCCC(C)(C)C#N)C1	ZINC000235299197	333367465	/nfs/dbraw/zinc/36/74/65/333367465.db2.gz	FWORCNVRZBEVMO-CABCVRRESA-N	1	0	250.430	4.217	20	30		CIEDRO
N#Cc1cccc(C[NH2+]CCCCCc2ccccc2)c1	ZINC000237841018	333381742	/nfs/dbraw/zinc/38/17/42/333381742.db2.gz	MXADXUMBAIAKDT-UHFFFAOYSA-N	1	0	278.399	4.061	20	30		CIEDRO
Cc1cccc(C2([NH2+]Cc3ccc(C#N)cc3)CCCC2)c1	ZINC000237933057	333382259	/nfs/dbraw/zinc/38/22/59/333382259.db2.gz	GFILVFZJPOYZIN-UHFFFAOYSA-N	1	0	290.410	4.426	20	30		CIEDRO
CC[C@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)c1ccccc1OC	ZINC000315731277	333383407	/nfs/dbraw/zinc/38/34/07/333383407.db2.gz	LZFYVXRZROGVGY-KSSFIOAISA-N	1	0	294.398	4.369	20	30		CIEDRO
C=CC[N@@H+](CCCSC)Cc1ccc(Cl)s1	ZINC000524754751	333386258	/nfs/dbraw/zinc/38/62/58/333386258.db2.gz	HMXNXGRXKZSMBX-UHFFFAOYSA-N	1	0	275.870	4.143	20	30		CIEDRO
C=CCCC[N@@H+](C)Cc1ccccc1OCC(F)(F)F	ZINC000524756434	333386801	/nfs/dbraw/zinc/38/68/01/333386801.db2.gz	KQEZVUYBVRYHRR-UHFFFAOYSA-N	1	0	287.325	4.026	20	30		CIEDRO
C=CCC[N@H+](C)CCCCCc1cc(-c2ccccc2)n[nH]1	ZINC000524811385	333389071	/nfs/dbraw/zinc/38/90/71/333389071.db2.gz	HGNBKEDZGDPALB-UHFFFAOYSA-N	1	0	297.446	4.297	20	30		CIEDRO
C=CC[N@@H+](CCSCC)Cc1ccc(Cl)s1	ZINC000525120621	333399547	/nfs/dbraw/zinc/39/95/47/333399547.db2.gz	JSXDJQASADBJQP-UHFFFAOYSA-N	1	0	275.870	4.143	20	30		CIEDRO
CC[C@@H](Cc1ccccc1)[N@H+](C)Cc1cccc(C#N)c1	ZINC000525122516	333399780	/nfs/dbraw/zinc/39/97/80/333399780.db2.gz	IWCLOAWOBVMESU-IBGZPJMESA-N	1	0	278.399	4.011	20	30		CIEDRO
C[C@H](CC[NH2+][C@@H](C)c1cccc(C#N)c1)c1ccccc1	ZINC000061910087	333477549	/nfs/dbraw/zinc/47/75/49/333477549.db2.gz	IHMPOGNJSSKAOG-CVEARBPZSA-N	1	0	278.399	4.403	20	30		CIEDRO
CC[C@H]([NH2+]CCc1ccc(C)cc1)c1ccc(C#N)cc1	ZINC000576025212	335142972	/nfs/dbraw/zinc/14/29/72/335142972.db2.gz	BOAGDKGGXDWVCL-IBGZPJMESA-N	1	0	278.399	4.150	20	30		CIEDRO
C[C@H]([NH2+]CC1(c2ccc(F)cc2)CC1)c1ccc(C#N)cc1	ZINC000173940325	335144006	/nfs/dbraw/zinc/14/40/06/335144006.db2.gz	GWDCMMGCPKRKJZ-AWEZNQCLSA-N	1	0	294.373	4.080	20	30		CIEDRO
C[C@H]([NH2+]CCc1ccc(Cl)cc1)c1cccc(C#N)c1	ZINC000037218282	333516088	/nfs/dbraw/zinc/51/60/88/333516088.db2.gz	WPHLSARXUDOBLL-ZDUSSCGKSA-N	1	0	284.790	4.105	20	30		CIEDRO
C[C@@H]([NH2+][C@H](C)c1ccc(F)c(F)c1)c1cccc(C#N)c1	ZINC000037277479	333529862	/nfs/dbraw/zinc/52/98/62/333529862.db2.gz	BBPMIHSQCJRHMQ-VXGBXAGGSA-N	1	0	286.325	4.248	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)C1CCCCC1)c1ccc(C#N)cc1	ZINC000037284468	333531237	/nfs/dbraw/zinc/53/12/37/333531237.db2.gz	OOPSHGVFMMJHMK-UONOGXRCSA-N	1	0	256.393	4.178	20	30		CIEDRO
N#Cc1cccc(C[NH2+]C2CC(c3ccc(Cl)cc3)C2)c1	ZINC000037748848	333537478	/nfs/dbraw/zinc/53/74/78/333537478.db2.gz	SDYIYOFOVOPJSR-UHFFFAOYSA-N	1	0	296.801	4.247	20	30		CIEDRO
C[C@@H]([NH2+]Cc1cc(Cl)ccc1F)c1ccc(C#N)cc1	ZINC000125163779	333564647	/nfs/dbraw/zinc/56/46/47/333564647.db2.gz	SQVLAFGBWRXTFF-LLVKDONJSA-N	1	0	288.753	4.202	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H](C)c2ccncc2CC)cc1	ZINC000538002298	333570347	/nfs/dbraw/zinc/57/03/47/333570347.db2.gz	LHQKZWMWPFWQFS-OAHLLOKOSA-N	1	0	296.414	4.060	20	30		CIEDRO
N#CCSCCC[NH2+][C@@H](c1ccc(Cl)cc1)C1CC1	ZINC000174114053	335148244	/nfs/dbraw/zinc/14/82/44/335148244.db2.gz	QMQXJUPPSRZSJU-OAHLLOKOSA-N	1	0	294.851	4.028	20	30		CIEDRO
C[C@@]1(C[NH2+]Cc2cc(C#N)cs2)CCCc2ccccc21	ZINC000538122716	333575504	/nfs/dbraw/zinc/57/55/04/333575504.db2.gz	NMQQQLWGRBRNII-SFHVURJKSA-N	1	0	296.439	4.004	20	30		CIEDRO
CC(C)(C)C[NH+](CCCSCC#N)CC(C)(C)C	ZINC000538219363	333579869	/nfs/dbraw/zinc/57/98/69/333579869.db2.gz	BGMPBZATVQLXRF-UHFFFAOYSA-N	1	0	270.486	4.027	20	30		CIEDRO
CC#CC[NH2+][C@H](C)c1ccc(-c2ccccc2OC)cc1	ZINC000538256631	333581647	/nfs/dbraw/zinc/58/16/47/333581647.db2.gz	BDYBMOKFBHIVKK-OAHLLOKOSA-N	1	0	279.383	4.036	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]C2(c3ccccc3)CCC2)cc1	ZINC000065275708	333590644	/nfs/dbraw/zinc/59/06/44/333590644.db2.gz	MPTRYFCUQCPTMT-UHFFFAOYSA-N	1	0	293.410	4.420	20	30		CIEDRO
C[C@@H]([NH2+]C/C=C/c1ccc(F)cc1)c1ccc(C#N)cc1	ZINC000126538439	333599462	/nfs/dbraw/zinc/59/94/62/333599462.db2.gz	RTHJGUCZXOWIAV-BAABZTOOSA-N	1	0	280.346	4.061	20	30		CIEDRO
N#CCCCOc1cccc(C[NH2+]CC2(C3CC3)CCC2)c1	ZINC000127519581	333630564	/nfs/dbraw/zinc/63/05/64/333630564.db2.gz	JJPHJDAFAKHVRN-UHFFFAOYSA-N	1	0	298.430	4.039	20	30		CIEDRO
C=CCCOCC[NH2+][C@@H](C)c1cc2cc(C)c(C)cc2o1	ZINC000539052344	333652046	/nfs/dbraw/zinc/65/20/46/333652046.db2.gz	WHTIQASVJYICSE-HNNXBMFYSA-N	1	0	287.403	4.293	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@@H](C)c1nc2ccccc2n1CC	ZINC000539070360	333654847	/nfs/dbraw/zinc/65/48/47/333654847.db2.gz	FQXXUULBHPINCK-KKUMJFAQSA-N	1	0	285.435	4.308	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)c1ccc(OCC2CC2)c(F)c1	ZINC000539325508	333666038	/nfs/dbraw/zinc/66/60/38/333666038.db2.gz	JKZBJOUJXHEPEZ-ZDUSSCGKSA-N	1	0	277.383	4.231	20	30		CIEDRO
CCc1ccc(CC[NH2+][C@@H](C)c2ccc(C#N)cc2)cc1	ZINC000539495284	333674091	/nfs/dbraw/zinc/67/40/91/333674091.db2.gz	KRDURRLTYQFZFQ-HNNXBMFYSA-N	1	0	278.399	4.014	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCc1csc(C(C)(C)C)n1)C1CC1	ZINC000540143583	333712463	/nfs/dbraw/zinc/71/24/63/333712463.db2.gz	SQXHDVNMCYMMFU-HNNXBMFYSA-N	1	0	292.492	4.318	20	30		CIEDRO
C=CCCC[C@H](C)[NH+]1CCC(OCCCC)CC1	ZINC000540346286	333726610	/nfs/dbraw/zinc/72/66/10/333726610.db2.gz	KISMDKSPPQQTOG-HNNXBMFYSA-N	1	0	253.430	4.012	20	30		CIEDRO
C=CCC[C@H](O)C[NH2+][C@@H](CC(C)(C)C)c1ccccc1	ZINC000540379163	333727389	/nfs/dbraw/zinc/72/73/89/333727389.db2.gz	FKNVBDRWHXNNCL-IRXDYDNUSA-N	1	0	275.436	4.081	20	30		CIEDRO
C[C@H](Cc1ccc(C(C)(C)C)cc1)C[NH+]1CCC(C#N)CC1	ZINC000540465899	333730868	/nfs/dbraw/zinc/73/08/68/333730868.db2.gz	BKRQNYOYNFHPGS-MRXNPFEDSA-N	1	0	298.474	4.398	20	30		CIEDRO
C[C@@H](C[NH2+][C@H](C)c1cccc(C#N)c1)c1ccc(F)cc1	ZINC000540591421	333736244	/nfs/dbraw/zinc/73/62/44/333736244.db2.gz	IXGLXOXDAJKPNR-UONOGXRCSA-N	1	0	282.362	4.152	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@@H](C)[C@H]1C)c1ccc(C#N)c(F)c1	ZINC000540701827	333742257	/nfs/dbraw/zinc/74/22/57/333742257.db2.gz	LBYDHIKEYZMZHC-KOFHJDLBSA-N	1	0	274.383	4.173	20	30		CIEDRO
Cc1cccc2c1CC[C@@H]2[NH2+][C@@H](C)c1ccc(C#N)c(F)c1	ZINC000540707732	333742790	/nfs/dbraw/zinc/74/27/90/333742790.db2.gz	DGWHSRDKNSEOCM-DJJJIMSYSA-N	1	0	294.373	4.344	20	30		CIEDRO
COc1ccccc1[C@@H](CC(C)C)[NH2+]CCC(C)(C)C#N	ZINC000540715121	333743386	/nfs/dbraw/zinc/74/33/86/333743386.db2.gz	WWWQOPKEIPZZNS-MRXNPFEDSA-N	1	0	288.435	4.312	20	30		CIEDRO
C[C@H]1CCc2ccccc2[C@@H]1[NH2+]Cc1ccc(C#N)cc1F	ZINC000540870085	333750725	/nfs/dbraw/zinc/75/07/25/333750725.db2.gz	LILLJDNDLUCOCJ-ORAYPTAESA-N	1	0	294.373	4.111	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](CC)c1nc(C)cs1	ZINC000541626480	333784862	/nfs/dbraw/zinc/78/48/62/333784862.db2.gz	YZRGHTMAUWSPNN-WCQYABFASA-N	1	0	252.427	4.237	20	30		CIEDRO
C[C@@H]([NH2+]CC1(C#N)CC1)[C@@H](C)c1ccccc1C(F)(F)F	ZINC000541633842	333784942	/nfs/dbraw/zinc/78/49/42/333784942.db2.gz	XJYFBJDUPZBTKE-VXGBXAGGSA-N	1	0	296.336	4.091	20	30		CIEDRO
C=C(CC)C[NH2+][C@@H](C)c1nc(-c2ccccc2)cs1	ZINC000541660296	333786400	/nfs/dbraw/zinc/78/64/00/333786400.db2.gz	IAQFLPRLZVZFNW-ZDUSSCGKSA-N	1	0	272.417	4.427	20	30		CIEDRO
C=CCC[C@H](C)[NH2+]CCCC(=O)Nc1ccc(Cl)cc1	ZINC000541743175	333789277	/nfs/dbraw/zinc/78/92/77/333789277.db2.gz	HUWAUNXTAJDGDP-ZDUSSCGKSA-N	1	0	294.826	4.003	20	30		CIEDRO
CC(C)(C)c1ccc(C[NH+]2CCC(CC#N)CC2)s1	ZINC000541921822	333801050	/nfs/dbraw/zinc/80/10/50/333801050.db2.gz	UHGSCRFHBPRBIE-UHFFFAOYSA-N	1	0	276.449	4.171	20	30		CIEDRO
N#CC1CCC(C[NH2+]CCCC2CCCCC2)CC1	ZINC000576147637	335160418	/nfs/dbraw/zinc/16/04/18/335160418.db2.gz	GJYWYXJGRXDYSY-UHFFFAOYSA-N	1	0	262.441	4.266	20	30		CIEDRO
C[C@@]1([NH2+]Cc2ccc(CC#N)cc2)CCCc2ccccc21	ZINC000543186651	333863206	/nfs/dbraw/zinc/86/32/06/333863206.db2.gz	ZJBXETTYFGHLLY-HXUWFJFHSA-N	1	0	290.410	4.094	20	30		CIEDRO
N#CCCC[NH2+][C@@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000543412562	333872440	/nfs/dbraw/zinc/87/24/40/333872440.db2.gz	LITLSFYMKUCTLE-LSDHHAIUSA-N	1	0	296.336	4.235	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+]CCc1nc2cc(Cl)ccc2s1	ZINC000543603717	333883698	/nfs/dbraw/zinc/88/36/98/333883698.db2.gz	VWHHHNSAIXKJNR-LLVKDONJSA-N	1	0	294.851	4.437	20	30		CIEDRO
C[C@H](C#N)C[NH2+][C@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000543620966	333885097	/nfs/dbraw/zinc/88/50/97/333885097.db2.gz	YTKFECRESVTNRZ-UGFHNGPFSA-N	1	0	296.336	4.091	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCc2ccc(F)cc21)c1ccc(C#N)cc1F	ZINC000543762816	333897051	/nfs/dbraw/zinc/89/70/51/333897051.db2.gz	NIFHRIDLOZXFCD-ADLMAVQZSA-N	1	0	298.336	4.175	20	30		CIEDRO
CCc1oc2ccccc2c1C[NH+]1CCC(CC#N)CC1	ZINC000543780029	333898427	/nfs/dbraw/zinc/89/84/27/333898427.db2.gz	LRCLXNSLULYWAN-UHFFFAOYSA-N	1	0	282.387	4.121	20	30		CIEDRO
C[C@@H]([NH2+]CCC(C)(C)C#N)[C@H](C)C1CCCCC1	ZINC000544421657	333930942	/nfs/dbraw/zinc/93/09/42/333930942.db2.gz	NLHRPHPGQBXIDN-UONOGXRCSA-N	1	0	250.430	4.121	20	30		CIEDRO
C[C@H]([NH2+]C1CC(C)(c2ccccc2)C1)c1cccc(C#N)c1	ZINC000545271914	333975020	/nfs/dbraw/zinc/97/50/20/333975020.db2.gz	CKZYXDLOPPHWSF-VMEOHVCESA-N	1	0	290.410	4.329	20	30		CIEDRO
CC[C@@H](CC(F)(F)F)[NH2+][C@@H](C)c1ccc(C#N)cc1F	ZINC000545460717	333983238	/nfs/dbraw/zinc/98/32/38/333983238.db2.gz	RTHBWSGLHGLRPJ-ONGXEEELSA-N	1	0	288.288	4.079	20	30		CIEDRO
C=C(C)C[N@H+]1CCC[C@@H](c2nc3ccccc3n2C(C)C)C1	ZINC000074315789	334003121	/nfs/dbraw/zinc/00/31/21/334003121.db2.gz	LBAVNMQVXKUIKP-MRXNPFEDSA-N	1	0	297.446	4.373	20	30		CIEDRO
Cc1cc2cc(C[NH2+]Cc3cccc(C#N)c3)oc2cc1C	ZINC000174968858	335170283	/nfs/dbraw/zinc/17/02/83/335170283.db2.gz	HJNFUNXSFCNDHW-UHFFFAOYSA-N	1	0	290.366	4.211	20	30		CIEDRO
CC(C)(C#N)CC[N@@H+]1CCC[C@]1(C)Cc1ccccc1	ZINC000545935067	334007629	/nfs/dbraw/zinc/00/76/29/334007629.db2.gz	HXUFBUQMNJPEAS-GOSISDBHSA-N	1	0	270.420	4.023	20	30		CIEDRO
Cc1ccc([C@@H]2CCCC[N@@H+]2CCCSCC#N)cc1	ZINC000074991441	334022378	/nfs/dbraw/zinc/02/23/78/334022378.db2.gz	ITZMWRSRAZDOGW-KRWDZBQOSA-N	1	0	288.460	4.169	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+]CCCc1nc2ccccc2n1C	ZINC000546606704	334039819	/nfs/dbraw/zinc/03/98/19/334039819.db2.gz	OWUZESOGSYUMHI-INIZCTEOSA-N	1	0	299.462	4.230	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1C[C@H](c2ccccc2)[C@H]1C)c1ccc(C#N)cc1	ZINC000546621107	334040945	/nfs/dbraw/zinc/04/09/45/334040945.db2.gz	YTZRWAYHTMGVKC-VVVONTASSA-N	1	0	290.410	4.401	20	30		CIEDRO
C[C@H]([NH2+]C1CC(C)(c2ccccc2)C1)c1ccc(C#N)cc1	ZINC000546684804	334045498	/nfs/dbraw/zinc/04/54/98/334045498.db2.gz	LOVKPHHIDVAMOS-VMEOHVCESA-N	1	0	290.410	4.329	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H](CC)CC(F)(F)F)cc1	ZINC000546878459	334053398	/nfs/dbraw/zinc/05/33/98/334053398.db2.gz	DRGNUTSGEHLORR-ZDUSSCGKSA-N	1	0	287.325	4.072	20	30		CIEDRO
CC(C)(C)c1ccc(C[NH2+]Cc2ccc(C#N)cc2F)cc1	ZINC000236589653	334057234	/nfs/dbraw/zinc/05/72/34/334057234.db2.gz	FVTSBQORPPOZAZ-UHFFFAOYSA-N	1	0	296.389	4.285	20	30		CIEDRO
C=C(C)COc1cc(C[NH2+]C2(CC)CCC2)ccc1OC	ZINC000236640248	334061575	/nfs/dbraw/zinc/06/15/75/334061575.db2.gz	UCPXWTNDHHRTCO-UHFFFAOYSA-N	1	0	289.419	4.072	20	30		CIEDRO
C=C(C[NH2+][C@H](C)c1cc(C)oc1C)c1ccccc1	ZINC000134362969	334088977	/nfs/dbraw/zinc/08/89/77/334088977.db2.gz	HATSGOPBKLQCTM-CQSZACIVSA-N	1	0	255.361	4.260	20	30		CIEDRO
C=C(C[NH2+][C@@H](C)c1cc(C)oc1C)c1ccccc1	ZINC000134362990	334089011	/nfs/dbraw/zinc/08/90/11/334089011.db2.gz	HATSGOPBKLQCTM-AWEZNQCLSA-N	1	0	255.361	4.260	20	30		CIEDRO
C[C@H](CCC1CCCC1)[NH2+]Cc1cccc(C#N)c1	ZINC000237439216	334089243	/nfs/dbraw/zinc/08/92/43/334089243.db2.gz	GJNLQCWOROZCAI-CQSZACIVSA-N	1	0	256.393	4.007	20	30		CIEDRO
N#Cc1csc(C[NH2+]CCCCC2CCCC2)c1	ZINC000237841399	334100251	/nfs/dbraw/zinc/10/02/51/334100251.db2.gz	BUXDTNQYNKAMLO-UHFFFAOYSA-N	1	0	262.422	4.070	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CCCC[C@H]2Cc2ccccc2)o1	ZINC000237843534	334100265	/nfs/dbraw/zinc/10/02/65/334100265.db2.gz	BMAYAGBTFREHCL-QFBILLFUSA-N	1	0	294.398	4.042	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H]2CCCC[C@H]2Cc2ccccc2)o1	ZINC000237843949	334100386	/nfs/dbraw/zinc/10/03/86/334100386.db2.gz	BMAYAGBTFREHCL-LPHOPBHVSA-N	1	0	294.398	4.042	20	30		CIEDRO
C=CC[C@H](C)[NH2+]Cc1ccc(-c2ccccc2)cc1	ZINC000134749874	334102838	/nfs/dbraw/zinc/10/28/38/334102838.db2.gz	OZUBFLRRDSTFCB-HNNXBMFYSA-N	1	0	251.373	4.408	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]CCc1ccc(Cl)cc1Cl	ZINC000135121775	334116585	/nfs/dbraw/zinc/11/65/85/334116585.db2.gz	JXCYOZRDSICZFM-UHFFFAOYSA-N	1	0	299.245	4.455	20	30		CIEDRO
CCC1CCC(C[NH2+]CC(C)(C)CCC#N)CC1	ZINC000135174445	334119040	/nfs/dbraw/zinc/11/90/40/334119040.db2.gz	IUVOBDACKSDYOG-UHFFFAOYSA-N	1	0	250.430	4.122	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](C)c1ccc2cc(OC)ccc2c1	ZINC000135365821	334127744	/nfs/dbraw/zinc/12/77/44/334127744.db2.gz	VXTYIMOTGUAPKM-KGLIPLIRSA-N	1	0	269.388	4.464	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)s1)c1cc2ccccc2o1	ZINC000135671424	334135759	/nfs/dbraw/zinc/13/57/59/334135759.db2.gz	BLQILNRRSZSXQW-NSHDSACASA-N	1	0	282.368	4.217	20	30		CIEDRO
C[C@H]([NH2+]C1CCC(C)(C)CC1)c1cccc(C#N)c1	ZINC000079676036	334159653	/nfs/dbraw/zinc/15/96/53/334159653.db2.gz	HVMOCBLASJYXPY-ZDUSSCGKSA-N	1	0	256.393	4.178	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCCC(C)(C)C1)c1ccc(C#N)cc1	ZINC000079974558	334164705	/nfs/dbraw/zinc/16/47/05/334164705.db2.gz	NZSZOTSONDHLTG-XJKSGUPXSA-N	1	0	256.393	4.178	20	30		CIEDRO
C[C@H]1CCc2c(F)cccc2[C@@H]1[NH2+]Cc1ccc(C#N)cc1	ZINC000080339922	334170685	/nfs/dbraw/zinc/17/06/85/334170685.db2.gz	VXDIPKMKOKTQKI-ORAYPTAESA-N	1	0	294.373	4.111	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]Cc1ccc2nc(C)sc2c1	ZINC000549829962	334206005	/nfs/dbraw/zinc/20/60/05/334206005.db2.gz	CZTLHROMNLIUAX-UHFFFAOYSA-N	1	0	274.433	4.297	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([N@@H+]2CCC[C@@H](CCCc3ccccc3)C2)C1	ZINC000549915245	334208428	/nfs/dbraw/zinc/20/84/28/334208428.db2.gz	CCQVVPRXYZIHQS-VAMGGRTRSA-N	1	0	296.458	4.414	20	30		CIEDRO
Cc1c2ccccc2oc1[C@H](C)[NH2+][C@H]1CC[C@@H](C#N)C1	ZINC000549931334	334209402	/nfs/dbraw/zinc/20/94/02/334209402.db2.gz	JADUSGRRLBRLDU-MJBXVCDLSA-N	1	0	268.360	4.084	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@@H](C#N)C1)c1ccc(F)c2ccccc21	ZINC000550105494	334213326	/nfs/dbraw/zinc/21/33/26/334213326.db2.gz	JVBBARQRRJALNN-BFHYXJOUSA-N	1	0	282.362	4.322	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](C#N)C1)c1ccc(F)c2ccccc21	ZINC000550105496	334213365	/nfs/dbraw/zinc/21/33/65/334213365.db2.gz	JVBBARQRRJALNN-MJBXVCDLSA-N	1	0	282.362	4.322	20	30		CIEDRO
C[C@@H]1C[N@H+](CC(C)(C)CCC#N)CC[C@H]1c1ccccc1	ZINC000245797173	334220138	/nfs/dbraw/zinc/22/01/38/334220138.db2.gz	XGGDGXGCDAWBSG-SJLPKXTDSA-N	1	0	284.447	4.442	20	30		CIEDRO
CCS[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1cccc(C#N)c1	ZINC000245877235	334222565	/nfs/dbraw/zinc/22/25/65/334222565.db2.gz	KHZJKRNAIBNXMZ-KBRIMQKVSA-N	1	0	288.460	4.273	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-]	ZINC000550856847	334230501	/nfs/dbraw/zinc/23/05/01/334230501.db2.gz	YWNKVOBQVKEDTQ-AWEZNQCLSA-N	1	0	290.407	4.108	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)C1CC1	ZINC000550896029	334232662	/nfs/dbraw/zinc/23/26/62/334232662.db2.gz	UTQDUBWYYBGKAM-BZSNNMDCSA-N	1	0	255.405	4.125	20	30		CIEDRO
C=CCC[C@@H]([NH2+][C@H]1C[C@H](c2ccc(F)cc2)C1)C1CC1	ZINC000551210833	334240895	/nfs/dbraw/zinc/24/08/95/334240895.db2.gz	AABQZSPMOYDCFE-KBAYOESNSA-N	1	0	273.395	4.406	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@H]1C[C@H](c2ccc(F)cc2)C1)C1CC1	ZINC000551210834	334241051	/nfs/dbraw/zinc/24/10/51/334241051.db2.gz	AABQZSPMOYDCFE-SZMVWBNQSA-N	1	0	273.395	4.406	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H](CO)C1CCCCC1)c1ccco1	ZINC000551273160	334244323	/nfs/dbraw/zinc/24/43/23/334244323.db2.gz	TZSKKYBCEXABOJ-IRXDYDNUSA-N	1	0	291.435	4.065	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@@H](C)[C@H]1C[C@@H]1c1ccc(OC)cc1	ZINC000551521120	334252317	/nfs/dbraw/zinc/25/23/17/334252317.db2.gz	YNIBMFNOPLBHGB-PAYONLEZSA-N	1	0	273.420	4.132	20	30		CIEDRO
CCc1ccc(C(C)(C)[NH2+]Cc2ccc(C#N)cc2)cc1	ZINC000083477824	334262541	/nfs/dbraw/zinc/26/25/41/334262541.db2.gz	QELRZRPDPOMLPB-UHFFFAOYSA-N	1	0	278.399	4.146	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH2+]C2(c3ccc(Cl)cc3)CCC2)C1	ZINC000551816190	334263104	/nfs/dbraw/zinc/26/31/04/334263104.db2.gz	HAYWSSAKDZJEBX-IUODEOHRSA-N	1	0	274.795	4.001	20	30		CIEDRO
C=C(C)CC[NH+]1CCC(OCC2CCCCC2)CC1	ZINC000551974982	334268460	/nfs/dbraw/zinc/26/84/60/334268460.db2.gz	IKMAUOWXHYTCGM-UHFFFAOYSA-N	1	0	265.441	4.014	20	30		CIEDRO
C[C@H]([NH2+]C[C@H]1C[C@H]1c1ccccc1)c1ccc(C#N)cc1	ZINC000247460994	334282023	/nfs/dbraw/zinc/28/20/23/334282023.db2.gz	QNZIVAMNLQPIFA-KYNGSXCRSA-N	1	0	276.383	4.013	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@]1(C)CCO[C@@H]1C1CC1)c1ccco1	ZINC000552067817	334284914	/nfs/dbraw/zinc/28/49/14/334284914.db2.gz	YXZHGIZRSCZSKU-JQHSSLGASA-N	1	0	289.419	4.082	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CC(C)(C)N1CCCCC1)c1ccco1	ZINC000552225146	334305183	/nfs/dbraw/zinc/30/51/83/334305183.db2.gz	BQPZESCUTQIDHS-MRXNPFEDSA-N	1	0	290.451	4.141	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)c1cccc(C(F)(F)F)c1	ZINC000248833719	334319113	/nfs/dbraw/zinc/31/91/13/334319113.db2.gz	MUZOHDMLIVFTPS-ZOWXZIJZSA-N	1	0	296.336	4.438	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@H](C)c1nc(C2CCCCC2)no1	ZINC000248840198	334319287	/nfs/dbraw/zinc/31/92/87/334319287.db2.gz	LDPOXMWFXMNVOF-MELADBBJSA-N	1	0	291.439	4.369	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@@H](C)c1ccc(F)cc1F	ZINC000552582787	334337774	/nfs/dbraw/zinc/33/77/74/334337774.db2.gz	XCTRFDZGHIYZTG-SRVKXCTJSA-N	1	0	253.336	4.216	20	30		CIEDRO
CC[C@H](C)[C@H](C)[N@H+](Cc1ccc(F)cc1C#N)C1CC1	ZINC000552594290	334338506	/nfs/dbraw/zinc/33/85/06/334338506.db2.gz	LPRUQBIZLQWZFL-STQMWFEESA-N	1	0	274.383	4.096	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+]Cc1ccc2ccccc2n1	ZINC000552944635	334352372	/nfs/dbraw/zinc/35/23/72/334352372.db2.gz	KOABLGRRPQSZEV-HNNXBMFYSA-N	1	0	268.404	4.459	20	30		CIEDRO
N#Cc1ccc2c(c1)CCC[C@H]2[NH2+]C/C=C\c1ccccc1	ZINC000552956872	334352923	/nfs/dbraw/zinc/35/29/23/334352923.db2.gz	VTSXJILSPUBHOG-DASIIQCKSA-N	1	0	288.394	4.239	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CCc2ccccc2C1(C)C	ZINC000553025533	334357289	/nfs/dbraw/zinc/35/72/89/334357289.db2.gz	CUKZBXIWEIEFJS-UHFFFAOYSA-N	1	0	270.420	4.110	20	30		CIEDRO
CC[C@@H]1CCC[C@@H]([NH2+][C@H](C)c2cccc(C#N)c2)C1	ZINC000251928950	334372148	/nfs/dbraw/zinc/37/21/48/334372148.db2.gz	ZBPQMCLGISOCJQ-CKEIUWERSA-N	1	0	256.393	4.178	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@H](C)[C@@H]1C)c1cccc(C#N)c1	ZINC000252000244	334372907	/nfs/dbraw/zinc/37/29/07/334372907.db2.gz	ZXBFAYZRRWDOFZ-AYMQEEERSA-N	1	0	256.393	4.034	20	30		CIEDRO
C=CC[N@H+](Cc1cccs1)Cc1cc(C)c(O)c(C)c1	ZINC000553273415	334373040	/nfs/dbraw/zinc/37/30/40/334373040.db2.gz	LLBSSIXOLCUOKL-UHFFFAOYSA-N	1	0	287.428	4.259	20	30		CIEDRO
CC(C)[C@@H]([NH2+]CCCCC#N)c1ccccc1Cl	ZINC000091319668	334376393	/nfs/dbraw/zinc/37/63/93/334376393.db2.gz	AKYDJZVAOBWSPR-OAHLLOKOSA-N	1	0	264.800	4.321	20	30		CIEDRO
COc1ccc([C@@H](C)C[N@H+](CCC#N)CC(C)(C)C)cc1	ZINC000553484560	334387698	/nfs/dbraw/zinc/38/76/98/334387698.db2.gz	SWEIILHQQGTJRI-HNNXBMFYSA-N	1	0	288.435	4.060	20	30		CIEDRO
Cc1ccccc1[C@H](CC(C)C)[NH2+]Cc1ccc(C#N)cn1	ZINC000554073511	334409327	/nfs/dbraw/zinc/40/93/27/334409327.db2.gz	OPRKNKOYPFQZLA-IBGZPJMESA-N	1	0	293.414	4.139	20	30		CIEDRO
COc1ccc([C@@H](C)[C@H](C)[NH2+]CC(C)(C)CCC#N)cc1	ZINC000554363528	334424720	/nfs/dbraw/zinc/42/47/20/334424720.db2.gz	NLSWKUPUXGECSW-GJZGRUSLSA-N	1	0	288.435	4.107	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCc2ccc(C#N)cc21)[C@@H](C)c1ccccc1	ZINC000554987912	334463792	/nfs/dbraw/zinc/46/37/92/334463792.db2.gz	GLTICOWKBSJKIL-SIFCLUCFSA-N	1	0	290.410	4.327	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+][C@@H](C)c1cccc(C2CC2)c1	ZINC000556179173	334498560	/nfs/dbraw/zinc/49/85/60/334498560.db2.gz	SXOSYGCZOJCPKO-JVPBZIDWSA-N	1	0	285.431	4.196	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@H]1C[C@H](c2ccc(F)cc2)C1	ZINC000556202609	334499721	/nfs/dbraw/zinc/49/97/21/334499721.db2.gz	UOBLTPSMROILQA-XIRDDKMYSA-N	1	0	261.384	4.406	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H](c1cccnc1)C1CCC1	ZINC000556218503	334500628	/nfs/dbraw/zinc/50/06/28/334500628.db2.gz	WRMYCGBXXTWXRA-MRXNPFEDSA-N	1	0	258.409	4.115	20	30		CIEDRO
C[C@@H]([NH2+]C[C@]1(C)C[C@H]1c1ccccc1)c1ccc(C#N)cc1	ZINC000556223532	334501015	/nfs/dbraw/zinc/50/10/15/334501015.db2.gz	HTRAAZIXUOHPHU-XPGWFJOJSA-N	1	0	290.410	4.403	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](C#N)C1)C1(c2ccccc2)CCCC1	ZINC000572558474	334506080	/nfs/dbraw/zinc/50/60/80/334506080.db2.gz	CCTSGQZHSSTANA-JZXOWHBKSA-N	1	0	282.431	4.169	20	30		CIEDRO
Cc1cccc2c1[C@@H](C)C[C@H]2[NH2+]Cc1cccc(C#N)c1	ZINC000152843600	334518905	/nfs/dbraw/zinc/51/89/05/334518905.db2.gz	KGXTVUIWKQADLC-KBXCAEBGSA-N	1	0	276.383	4.205	20	30		CIEDRO
C=C(C)CN1CCC([NH2+][C@H](CCC)c2ccccc2)CC1	ZINC000152930864	334525875	/nfs/dbraw/zinc/52/58/75/334525875.db2.gz	QUVCOPSELHUYEN-LJQANCHMSA-N	1	0	286.463	4.158	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](C)c1cnc(OC)c(Cl)c1	ZINC000565520580	334570486	/nfs/dbraw/zinc/57/04/86/334570486.db2.gz	CEIXGRINGYMCQL-NWDGAFQWSA-N	1	0	282.815	4.139	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+]Cc1noc2ccccc21	ZINC000565547730	334573699	/nfs/dbraw/zinc/57/36/99/334573699.db2.gz	BYLUGMCAQBRLHH-CYBMUJFWSA-N	1	0	258.365	4.052	20	30		CIEDRO
Cc1ccccc1C[C@H](C)[NH2+][C@@H]1CCc2ccc(C#N)cc21	ZINC000565979118	334613744	/nfs/dbraw/zinc/61/37/44/334613744.db2.gz	SSOKHFZBLKHGJW-MGPUTAFESA-N	1	0	290.410	4.075	20	30		CIEDRO
Cc1ccc(C[NH2+]CC(C)(C)CCC#N)c(OC(C)C)c1	ZINC000153657883	334675852	/nfs/dbraw/zinc/67/58/52/334675852.db2.gz	ZMILSYWNSSJSCB-UHFFFAOYSA-N	1	0	288.435	4.202	20	30		CIEDRO
C[C@@H]([NH2+][C@H](C)c1ccc(N(C)C)cc1)c1ccc(C#N)cc1	ZINC000268786772	334716035	/nfs/dbraw/zinc/71/60/35/334716035.db2.gz	CUWSLAKXEIAJDG-HUUCEWRRSA-N	1	0	293.414	4.036	20	30		CIEDRO
C[C@@H]([NH2+]C[C@@H](C)c1ccccc1)c1ccc(OCC#N)cc1	ZINC000271830309	334747006	/nfs/dbraw/zinc/74/70/06/334747006.db2.gz	PNKKUVFWIXNZDS-HZPDHXFCSA-N	1	0	294.398	4.043	20	30		CIEDRO
CC(C)(C)c1ccc(C[NH2+]CC(C)(C)CCC#N)s1	ZINC000569148253	334857970	/nfs/dbraw/zinc/85/79/70/334857970.db2.gz	MDEUCKHIRGCFSU-UHFFFAOYSA-N	1	0	278.465	4.465	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCSC(C)C)c1ccco1	ZINC000572909908	334890271	/nfs/dbraw/zinc/89/02/71/334890271.db2.gz	XQUJAGQAPHZGAX-CYBMUJFWSA-N	1	0	253.411	4.018	20	30		CIEDRO
CCCc1cccc(C[NH2+]CC(C)(C)CCC#N)c1	ZINC000576902435	335262322	/nfs/dbraw/zinc/26/23/22/335262322.db2.gz	AGRVEVUOHSXLEM-UHFFFAOYSA-N	1	0	258.409	4.059	20	30		CIEDRO
N#Cc1cccc(C2([NH2+]CCCCc3ccccc3)CC2)c1	ZINC000577209784	335323229	/nfs/dbraw/zinc/32/32/29/335323229.db2.gz	MULWWDRJAIFSRG-UHFFFAOYSA-N	1	0	290.410	4.160	20	30		CIEDRO
C=CC[C@H](Cc1ccccc1)[NH2+]C1CCC2(CCCO2)CC1	ZINC000577267400	335332250	/nfs/dbraw/zinc/33/22/50/335332250.db2.gz	GZRSGYUPTOUNER-IOJLRTSASA-N	1	0	299.458	4.255	20	30		CIEDRO
N#Cc1ccc(C[NH2+]Cc2ccc3ccccc3c2)s1	ZINC000176956440	335344943	/nfs/dbraw/zinc/34/49/43/335344943.db2.gz	MCTZJCYLTFOINU-UHFFFAOYSA-N	1	0	278.380	4.063	20	30		CIEDRO
C=CC[C@H](C)[NH2+]C/C(C)=C\c1ccccc1OC(F)F	ZINC000577428690	335351573	/nfs/dbraw/zinc/35/15/73/335351573.db2.gz	MNIAIPKGIXNWJL-UKVQZPPCSA-N	1	0	281.346	4.246	20	30		CIEDRO
N#Cc1csc(C[NH2+]CCc2csc3ccccc23)c1	ZINC000177691992	335379024	/nfs/dbraw/zinc/37/90/24/335379024.db2.gz	YGBTUUPXPKBGOS-UHFFFAOYSA-N	1	0	298.436	4.167	20	30		CIEDRO
N#Cc1csc(C[NH2+]C2(c3ccccc3)CCCC2)c1	ZINC000177701576	335379951	/nfs/dbraw/zinc/37/99/51/335379951.db2.gz	PFXBYYGPOBBDEH-UHFFFAOYSA-N	1	0	282.412	4.179	20	30		CIEDRO
CC1(C)C[C@@H]([NH2+]Cc2cccc(C#N)c2)c2ccccc21	ZINC000177898093	335405146	/nfs/dbraw/zinc/40/51/46/335405146.db2.gz	PQCVNXMOGWNHAF-GOSISDBHSA-N	1	0	276.383	4.070	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1coc(-c2ccccc2)n1)C1CC1	ZINC000178693716	335445746	/nfs/dbraw/zinc/44/57/46/335445746.db2.gz	MJMJHBLXMWIVSR-KRWDZBQOSA-N	1	0	282.387	4.176	20	30		CIEDRO
CCC(CC)[C@H]([NH2+]CCCCC#N)c1ccccc1	ZINC000179789793	335518380	/nfs/dbraw/zinc/51/83/80/335518380.db2.gz	FCVPJBBMJZKWIW-KRWDZBQOSA-N	1	0	258.409	4.447	20	30		CIEDRO
CCC(CC)C[NH2+][C@H](CCC#N)c1ccc(OC)cc1	ZINC000578592022	335651996	/nfs/dbraw/zinc/65/19/96/335651996.db2.gz	SDNUMYKHKCAACJ-QGZVFWFLSA-N	1	0	274.408	4.066	20	30		CIEDRO
N#Cc1ccc2c(c1)[C@H]([NH2+][C@H]1C[C@H](c3ccccc3)C1)CC2	ZINC000579179439	335718225	/nfs/dbraw/zinc/71/82/25/335718225.db2.gz	UPDNWKVVASHDHR-QWFCFKBJSA-N	1	0	288.394	4.081	20	30		CIEDRO
N#CCCC[NH2+]C1(c2cccc(Cl)c2)CCCC1	ZINC000181464486	335762887	/nfs/dbraw/zinc/76/28/87/335762887.db2.gz	LZMVBOURQNBFAV-UHFFFAOYSA-N	1	0	262.784	4.003	20	30		CIEDRO
CC[C@H]([NH2+]Cc1cc(C#N)ccc1OC)c1ccc(C)cc1	ZINC000181683353	335778302	/nfs/dbraw/zinc/77/83/02/335778302.db2.gz	BIUFQZXQXLDOAB-SFHVURJKSA-N	1	0	294.398	4.116	20	30		CIEDRO
Cc1cnc([C@@H]([NH2+][C@@H](C)c2ccc(C#N)cc2)C2CC2)s1	ZINC000181820471	335786752	/nfs/dbraw/zinc/78/67/52/335786752.db2.gz	HSTZAOKGYUWDEV-LRDDRELGSA-N	1	0	297.427	4.125	20	30		CIEDRO
CC[C@@H](CC#N)[NH2+]Cc1ccc(-c2cccc(F)c2)s1	ZINC000184085047	335917494	/nfs/dbraw/zinc/91/74/94/335917494.db2.gz	RPGFDUVJDOAMBF-AWEZNQCLSA-N	1	0	288.391	4.336	20	30		CIEDRO
CCCC[C@@H]([NH2+]CCCC(C)(C)C#N)C1CCC1	ZINC000184869621	335937687	/nfs/dbraw/zinc/93/76/87/335937687.db2.gz	FLRBPPRNELHHOL-OAHLLOKOSA-N	1	0	250.430	4.265	20	30		CIEDRO
C=CCC[C@H](C)[NH2+]CCCc1cn(-c2ccccc2)nc1C	ZINC000185175745	335948244	/nfs/dbraw/zinc/94/82/44/335948244.db2.gz	IURWEMBESZDOAR-INIZCTEOSA-N	1	0	297.446	4.058	20	30		CIEDRO
C[C@@H]1C[C@@H]1c1ccc(C[NH2+][C@H]2CCc3ccc(C#N)cc32)o1	ZINC000580863555	335976310	/nfs/dbraw/zinc/97/63/10/335976310.db2.gz	XGYIALMDMCMLJA-PUECVXPYSA-N	1	0	292.382	4.052	20	30		CIEDRO
C[C@@H]1C[C@@H]1c1ccc(C[NH2+][C@@H]2CCc3ccc(C#N)cc32)o1	ZINC000580863556	335976386	/nfs/dbraw/zinc/97/63/86/335976386.db2.gz	XGYIALMDMCMLJA-PZPSRYQVSA-N	1	0	292.382	4.052	20	30		CIEDRO
CC[C@@H]([NH2+]C1CCC2(CC2)CC1)c1ccc(C#N)cc1	ZINC000581051591	336001133	/nfs/dbraw/zinc/00/11/33/336001133.db2.gz	PRVCQCUMDNNBKE-QGZVFWFLSA-N	1	0	268.404	4.322	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]Cc1sccc1Br	ZINC000381866937	336074740	/nfs/dbraw/zinc/07/47/40/336074740.db2.gz	JQCZSQJPMBJMSR-UHFFFAOYSA-N	1	0	288.254	4.203	20	30		CIEDRO
CC(C)(C#N)CCC[NH2+][C@@H]1CCCCC12CCCC2	ZINC000382485026	336091376	/nfs/dbraw/zinc/09/13/76/336091376.db2.gz	GMYYANAAQMBNEC-OAHLLOKOSA-N	1	0	262.441	4.409	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@@H](C)c1cnc2ccsc2c1	ZINC000385149628	336141091	/nfs/dbraw/zinc/14/10/91/336141091.db2.gz	JVQGEQPTIKTLFE-NSHDSACASA-N	1	0	260.406	4.159	20	30		CIEDRO
C[C@@H](C1CC1)[N@H+](CCC(C)(C)C#N)Cc1ccccc1	ZINC000385927391	336161773	/nfs/dbraw/zinc/16/17/73/336161773.db2.gz	MPRRFEYPRSYQKB-HNNXBMFYSA-N	1	0	270.420	4.227	20	30		CIEDRO
CC(C)Oc1ccccc1[C@H](C)[NH2+]Cc1ccc(C#N)cc1	ZINC000386013977	336164610	/nfs/dbraw/zinc/16/46/10/336164610.db2.gz	OJCWQFJQSGTWBZ-HNNXBMFYSA-N	1	0	294.398	4.196	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1cc(Br)cs1	ZINC000386945221	336182814	/nfs/dbraw/zinc/18/28/14/336182814.db2.gz	WMADARBLXRBTMF-VIFPVBQESA-N	1	0	274.227	4.127	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1sccc1Br	ZINC000386938616	336182864	/nfs/dbraw/zinc/18/28/64/336182864.db2.gz	VGTWURQEYROMIQ-VIFPVBQESA-N	1	0	274.227	4.127	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1ccc2cc(OC)ccc2c1	ZINC000387334260	336192527	/nfs/dbraw/zinc/19/25/27/336192527.db2.gz	DNQMPMTXVQXLPH-AWEZNQCLSA-N	1	0	269.388	4.465	20	30		CIEDRO
C[C@H]([NH2+]C1CCC(C)(C#N)CC1)c1ccc2ncsc2c1	ZINC000336226084	533803890	/nfs/dbraw/zinc/80/38/90/533803890.db2.gz	JYWIXXQVWQIBGH-MKQDKFQKSA-N	1	0	299.443	4.419	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CCC[C@@H]1c1ccccc1	ZINC000174814397	517370114	/nfs/dbraw/zinc/37/01/14/517370114.db2.gz	JHUQUUDMQPRUMD-MRXNPFEDSA-N	1	0	256.393	4.153	20	30		CIEDRO
C[C@@H]([N@H+](C)Cc1ccc(C#N)cc1C(F)(F)F)C1(C)CC1	ZINC000356128506	534285607	/nfs/dbraw/zinc/28/56/07/534285607.db2.gz	PUBOUPAOAABCQU-LLVKDONJSA-N	1	0	296.336	4.197	20	30		CIEDRO
Cc1nc2ccc(C[NH2+]CC3CCC(C#N)CC3)cc2s1	ZINC000441348789	518193132	/nfs/dbraw/zinc/19/31/32/518193132.db2.gz	DCZPMVUTSXDUCF-UHFFFAOYSA-N	1	0	299.443	4.024	20	30		CIEDRO
CC(C)[C@H]1C[C@@H]([NH2+]Cc2ccc(C#N)o2)c2ccccc21	ZINC000280152118	519827369	/nfs/dbraw/zinc/82/73/69/519827369.db2.gz	RSRDHPMLARCDCO-QZTJIDSGSA-N	1	0	280.371	4.125	20	30		CIEDRO
CCCc1nc(C)c(C[NH2+][C@H](CC)c2ccc(C#N)cc2)o1	ZINC000293644253	521500474	/nfs/dbraw/zinc/50/04/74/521500474.db2.gz	KXMDUZCSQIBEOY-MRXNPFEDSA-N	1	0	297.402	4.048	20	30		CIEDRO
CC[C@H]([NH2+][C@@H](C)c1ccccc1)c1ccc(C#N)cc1	ZINC000278206870	522699301	/nfs/dbraw/zinc/69/93/01/522699301.db2.gz	HHXTYRJJSDSKKP-KSSFIOAISA-N	1	0	264.372	4.360	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CCOC2(CCCC2)C1)c1ccc(C#N)cc1	ZINC000278618444	522721052	/nfs/dbraw/zinc/72/10/52/522721052.db2.gz	GBPIAILKZRJTEA-MSOLQXFVSA-N	1	0	298.430	4.091	20	30		CIEDRO
CC[C@H]([NH2+][C@H](C)c1ccc(C#N)cc1)c1ccc(C#N)cc1	ZINC000278238288	522740164	/nfs/dbraw/zinc/74/01/64/522740164.db2.gz	LCPYDBRSDNXZRY-KUHUBIRLSA-N	1	0	289.382	4.232	20	30		CIEDRO
CC[C@H]([NH2+][C@H](C)c1cccc(OC)c1)c1ccc(C#N)cc1	ZINC000278289902	522743114	/nfs/dbraw/zinc/74/31/14/522743114.db2.gz	QYAGLDHBMKQUQJ-KUHUBIRLSA-N	1	0	294.398	4.369	20	30		CIEDRO
CC[C@@H]([NH2+][C@H](C)c1ccc(C#N)cc1)c1ccccc1O	ZINC000036991851	522935690	/nfs/dbraw/zinc/93/56/90/522935690.db2.gz	KSVRQXHOQMKFCY-CXAGYDPISA-N	1	0	280.371	4.066	20	30		CIEDRO
CC[C@@H]([NH2+][C@H](C)c1ccc(C#N)cc1)c1ccc(OC)cc1	ZINC000121843058	522936100	/nfs/dbraw/zinc/93/61/00/522936100.db2.gz	TUGRDTRMWZIMMU-AUUYWEPGSA-N	1	0	294.398	4.369	20	30		CIEDRO
Cc1cccc([C@@H](C)[NH2+][C@@H](C)c2ccc(C#N)cc2)c1	ZINC000037284475	524827873	/nfs/dbraw/zinc/82/78/73/524827873.db2.gz	QBHRVXGLARYDSB-LSDHHAIUSA-N	1	0	264.372	4.279	20	30		CIEDRO
Cc1ccccc1C(C)(C)[NH2+]Cc1ccc(C#N)cc1F	ZINC000293050903	525072364	/nfs/dbraw/zinc/07/23/64/525072364.db2.gz	TVWNTMHRQXEIAC-UHFFFAOYSA-N	1	0	282.362	4.031	20	30		CIEDRO
C[C@@H]1C[C@@H]([NH2+]C2(c3cccc(C#N)c3)CC2)c2ccccc21	ZINC000290275752	525263116	/nfs/dbraw/zinc/26/31/16/525263116.db2.gz	LVCWFHLXSMHXSY-AUUYWEPGSA-N	1	0	288.394	4.385	20	30		CIEDRO
Cc1ccccc1[C@H](C)[NH2+][C@@H](C)c1cccc(C#N)c1	ZINC000037228513	525417443	/nfs/dbraw/zinc/41/74/43/525417443.db2.gz	PWAIDDZCTMHIBN-GJZGRUSLSA-N	1	0	264.372	4.279	20	30		CIEDRO
C[C@H]([NH2+]Cc1cnc(C(C)(C)C)s1)c1ccc(C#N)cc1	ZINC000059183813	525478712	/nfs/dbraw/zinc/47/87/12/525478712.db2.gz	NXBFUHIKOKGNGD-LBPRGKRZSA-N	1	0	299.443	4.163	20	30		CIEDRO
C[C@H]([NH2+]Cc1coc2ccccc12)c1cccc(C#N)c1	ZINC000340426823	525483234	/nfs/dbraw/zinc/48/32/34/525483234.db2.gz	NZGGQQKHEOSRBF-ZDUSSCGKSA-N	1	0	276.339	4.155	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)c1ccc2c(c1)COC2	ZINC000268819173	525605876	/nfs/dbraw/zinc/60/58/76/525605876.db2.gz	REBLNLZUJFKSJP-UONOGXRCSA-N	1	0	292.382	4.000	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)c1ccsc1	ZINC000050341525	525607417	/nfs/dbraw/zinc/60/74/17/525607417.db2.gz	VHLKNJZTPBSYTK-NWDGAFQWSA-N	1	0	256.374	4.032	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1cccc(C#N)c1)c1cccs1	ZINC000037235460	525612830	/nfs/dbraw/zinc/61/28/30/525612830.db2.gz	JFEZTCKYIMJQJW-NWDGAFQWSA-N	1	0	256.374	4.032	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCCc2sccc21)c1cccc(C#N)c1	ZINC000061360184	525680998	/nfs/dbraw/zinc/68/09/98/525680998.db2.gz	PXPMVNJVRGIKBH-WBMJQRKESA-N	1	0	282.412	4.348	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]C[C@@H]1CCC[C@@H](C(F)(F)F)C1	ZINC000344601856	526998472	/nfs/dbraw/zinc/99/84/72/526998472.db2.gz	KKRIYSLHWQKOBZ-CHWSQXEVSA-N	1	0	290.373	4.275	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@H](CC)c1ccc(OC)c(OC)c1	ZINC000352250105	527465724	/nfs/dbraw/zinc/46/57/24/527465724.db2.gz	CAGIKOGWFAYCFI-DZGCQCFKSA-N	1	0	277.408	4.099	20	30		CIEDRO
C=CCC[C@H]([NH2+]CC(C)(C)CCC#N)c1ccco1	ZINC000348208614	527482513	/nfs/dbraw/zinc/48/25/13/527482513.db2.gz	UODUAYUORCYIAK-AWEZNQCLSA-N	1	0	260.381	4.206	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@H](C)c1ncc(C)s1)c1ccco1	ZINC000353671888	527485298	/nfs/dbraw/zinc/48/52/98/527485298.db2.gz	PADZVOAFGJBEJN-JSGCOSHPSA-N	1	0	290.432	4.445	20	30		CIEDRO
CC(C)[C@@H]1C[C@@H](C[NH2+][C@H]2CC[C@H](C#N)C2)c2ccccc21	ZINC000442858574	528762407	/nfs/dbraw/zinc/76/24/07/528762407.db2.gz	PDOWAHMTXLPRPQ-FPXQBCRKSA-N	1	0	282.431	4.195	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@H]2CCCc3sccc32)CC1	ZINC000336219562	528833554	/nfs/dbraw/zinc/83/35/54/528833554.db2.gz	LTFOACCOVXBCSR-UGWHAMFMSA-N	1	0	274.433	4.188	20	30		CIEDRO
CCC[C@@H]([NH2+]Cc1ccc(C#N)c(OC)c1)c1ccccc1	ZINC000353622208	529012209	/nfs/dbraw/zinc/01/22/09/529012209.db2.gz	MCJKFOHEHOOVMJ-GOSISDBHSA-N	1	0	294.398	4.198	20	30		CIEDRO
CC1(C)CC[C@H]([NH2+][C@H](CCC#N)c2ccccc2)C1	ZINC000346623107	529049374	/nfs/dbraw/zinc/04/93/74/529049374.db2.gz	BXGGECZHXYSIGF-JKSUJKDBSA-N	1	0	256.393	4.200	20	30		CIEDRO
CC(C)[C@H]([NH2+]C[C@@H](C#N)CCC#N)c1ccc(Cl)cc1	ZINC000356114118	529121972	/nfs/dbraw/zinc/12/19/72/529121972.db2.gz	QBMBJGUOAVNLQJ-CJNGLKHVSA-N	1	0	289.810	4.070	20	30		CIEDRO
CCCc1ccc([C@H]([NH2+]CCCC#N)C(C)C)cc1	ZINC000096982037	185145706	/nfs/dbraw/zinc/14/57/06/185145706.db2.gz	BYTGPROPDFYHAI-QGZVFWFLSA-N	1	0	258.409	4.230	20	30		CIEDRO
CC[C@@H](CSc1ccc(Cl)cc1)[NH2+]CCCC#N	ZINC000346845489	529532602	/nfs/dbraw/zinc/53/26/02/529532602.db2.gz	ZZABJWXAGSYKQB-ZDUSSCGKSA-N	1	0	282.840	4.104	20	30		CIEDRO
C=CCCCC[NH2+][C@H](C)c1ncc(-c2ccccc2)o1	ZINC000573504949	334943212	/nfs/dbraw/zinc/94/32/12/334943212.db2.gz	KYUFJWYPWLOIOH-CQSZACIVSA-N	1	0	270.376	4.349	20	30		CIEDRO
CC[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CCc2ccc(C#N)cc21	ZINC000573648980	334954623	/nfs/dbraw/zinc/95/46/23/334954623.db2.gz	ZOJKNKWYEJHTRA-FHLIZLRMSA-N	1	0	268.404	4.104	20	30		CIEDRO
Cc1cc([C@H](C)[NH2+]CC(C)(C)CCC#N)ccc1F	ZINC000358507585	260651097	/nfs/dbraw/zinc/65/10/97/260651097.db2.gz	KWNVWACQJHGHKX-ZDUSSCGKSA-N	1	0	262.372	4.115	20	30		CIEDRO
C=CCOc1cccc(C[N@@H+]2CCC=C(c3ccco3)C2)c1	ZINC000574240738	335003423	/nfs/dbraw/zinc/00/34/23/335003423.db2.gz	PFNNACLIRZAQMC-UHFFFAOYSA-N	1	0	295.382	4.134	20	30		CIEDRO
N#Cc1cccc(C[N@@H+]2CCC[C@@]3(CC=CCC3)C2)c1F	ZINC000352866851	227366875	/nfs/dbraw/zinc/36/68/75/227366875.db2.gz	HKMYDXPTUPTOPA-SFHVURJKSA-N	1	0	284.378	4.020	20	30		CIEDRO
C[C@H]([NH2+]CCCCC#N)c1ccc(OC(C)(C)C)cc1	ZINC000185218128	262046252	/nfs/dbraw/zinc/04/62/52/262046252.db2.gz	FKMCAVPHKOLJCW-AWEZNQCLSA-N	1	0	274.408	4.208	20	30		CIEDRO
COc1ccccc1[C@H]1CC[C@@H](C)C[N@@H+]1CCCCC#N	ZINC000352246283	533025933	/nfs/dbraw/zinc/02/59/33/533025933.db2.gz	OTJIUIUEOADTMC-NVXWUHKLSA-N	1	0	286.419	4.162	20	30		CIEDRO
Cc1ccccc1[C@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)C1CC1	ZINC000447528250	260036402	/nfs/dbraw/zinc/03/64/02/260036402.db2.gz	IKUFFOONUXGEJV-UWWQBHOKSA-N	1	0	268.404	4.118	20	30		CIEDRO
C=CCCCCC[N@@H+](C)[C@H](C)c1ccc([S@@](C)=O)cc1	ZINC000187694805	260051730	/nfs/dbraw/zinc/05/17/30/260051730.db2.gz	VULRGNSKOZLWAF-FOIQADDNSA-N	1	0	293.476	4.163	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H](OCC)c1ccccc1)C1CC1	ZINC000447558886	260053141	/nfs/dbraw/zinc/05/31/41/260053141.db2.gz	QQDDBGGZVKFXEH-ZWKOTPCHSA-N	1	0	273.420	4.099	20	30		CIEDRO
Cc1ccc([C@@H](C)[NH2+][C@H]2CCCc3cc(C#N)ccc32)o1	ZINC000341757061	130024220	/nfs/dbraw/zinc/02/42/20/130024220.db2.gz	HOCFGALTTXUTBQ-DYVFJYSZSA-N	1	0	280.371	4.188	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCCc2cc(C#N)ccc21)c1cccs1	ZINC000341763457	130029316	/nfs/dbraw/zinc/02/93/16/130029316.db2.gz	YVKIKRQELPPGNC-BLLLJJGKSA-N	1	0	282.412	4.348	20	30		CIEDRO
Cc1cccc(C)c1C[NH2+][C@@H]1CCCc2cc(C#N)ccc21	ZINC000341915134	130126834	/nfs/dbraw/zinc/12/68/34/130126834.db2.gz	XPUSJVMMQRXOMU-HXUWFJFHSA-N	1	0	290.410	4.342	20	30		CIEDRO
Cc1cccc(C)c1C[NH2+][C@H]1CCCc2cc(C#N)ccc21	ZINC000341915133	130127214	/nfs/dbraw/zinc/12/72/14/130127214.db2.gz	XPUSJVMMQRXOMU-FQEVSTJZSA-N	1	0	290.410	4.342	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H]2CCCc3occc32)cc1	ZINC000020205024	171070401	/nfs/dbraw/zinc/07/04/01/171070401.db2.gz	BOWVLTNJDSTPTR-QGZVFWFLSA-N	1	0	283.371	4.012	20	30		CIEDRO
CC(C)(C)[C@H]([NH2+]Cc1cccc(C#N)c1)c1ccccc1	ZINC000035255433	172085253	/nfs/dbraw/zinc/08/52/53/172085253.db2.gz	QNZKEQYACPMERD-GOSISDBHSA-N	1	0	278.399	4.435	20	30		CIEDRO
C[C@@H]1CCCC[C@H]1CC[NH2+]CC(C)(C)CCC#N	ZINC000344373707	225054272	/nfs/dbraw/zinc/05/42/72/225054272.db2.gz	IJUUXXMSGQZCGX-CABCVRRESA-N	1	0	250.430	4.122	20	30		CIEDRO
N#CCCN(Cc1c(Cl)oc2ccccc21)CC1CC1	ZINC000353405923	228097277	/nfs/dbraw/zinc/09/72/77/228097277.db2.gz	SKGDVLCEHCVAKA-UHFFFAOYSA-N	1	0	288.778	4.212	20	30		CIEDRO
N#CCCC[N@H+](Cc1ccc2ccccc2c1)C1CC1	ZINC000353455385	228105526	/nfs/dbraw/zinc/10/55/26/228105526.db2.gz	PQZCRRZPZPFNRT-UHFFFAOYSA-N	1	0	264.372	4.108	20	30		CIEDRO
N#Cc1ccc2c(c1)[C@@H]([NH2+][C@@H]1CCCc3sccc31)CC2	ZINC000353640353	228136974	/nfs/dbraw/zinc/13/69/74/228136974.db2.gz	ULLBALBECFLWGY-SJORKVTESA-N	1	0	294.423	4.274	20	30		CIEDRO
N#C[C@H]1CC[C@H]([N@@H+]2CC=C(c3ccccc3Cl)CC2)C1	ZINC000335928746	228166628	/nfs/dbraw/zinc/16/66/28/228166628.db2.gz	VGLGYMBROGIYQK-ZFWWWQNUSA-N	1	0	286.806	4.121	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CSc2ccccc21)c1ccc(C#N)c(F)c1	ZINC000335960481	228171166	/nfs/dbraw/zinc/17/11/66/228171166.db2.gz	DZVSPIYAPPLLFH-ZBEGNZNMSA-N	1	0	298.386	4.195	20	30		CIEDRO
C=CCCCCC[N@@H+](C)[C@H](C)c1ccc([S@](C)=O)cc1	ZINC000187694768	260051932	/nfs/dbraw/zinc/05/19/32/260051932.db2.gz	VULRGNSKOZLWAF-QRWLVFNGSA-N	1	0	293.476	4.163	20	30		CIEDRO
C[C@@H]([NH2+][C@H](C)c1ccc(OCC#N)cc1)c1cccs1	ZINC000037235048	260076300	/nfs/dbraw/zinc/07/63/00/260076300.db2.gz	UCTIZMHRHQAHQC-CHWSQXEVSA-N	1	0	286.400	4.062	20	30		CIEDRO
C[N@H+](Cc1cc(C#N)cs1)Cc1csc2ccccc12	ZINC000179989880	260085955	/nfs/dbraw/zinc/08/59/55/260085955.db2.gz	SKEOAYGBPOAPCY-UHFFFAOYSA-N	1	0	298.436	4.466	20	30		CIEDRO
Cc1ccccc1[C@H]1CCC[N@@H+]1Cc1cc(C#N)cs1	ZINC000180153801	260094744	/nfs/dbraw/zinc/09/47/44/260094744.db2.gz	AUWFSFBDQAPNDJ-QGZVFWFLSA-N	1	0	282.412	4.265	20	30		CIEDRO
COc1cc([C@@H](C)[NH2+][C@@H](C)c2ccc(C#N)cc2)ccc1F	ZINC000317219304	260133187	/nfs/dbraw/zinc/13/31/87/260133187.db2.gz	HINWMLCSRUUOKA-QWHCGFSZSA-N	1	0	298.361	4.118	20	30		CIEDRO
COc1cc([C@@H](C)[NH2+][C@H](C)c2ccc(C#N)cc2)ccc1F	ZINC000317219298	260133263	/nfs/dbraw/zinc/13/32/63/260133263.db2.gz	HINWMLCSRUUOKA-CHWSQXEVSA-N	1	0	298.361	4.118	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1ccc(F)cc1Br	ZINC000309456130	260169852	/nfs/dbraw/zinc/16/98/52/260169852.db2.gz	MLQJDGRAMILSQR-LBPRGKRZSA-N	1	0	286.188	4.033	20	30		CIEDRO
C[C@H]([NH2+]CC1CCCCCC1)c1ccc(C#N)cc1	ZINC000089557945	260188034	/nfs/dbraw/zinc/18/80/34/260188034.db2.gz	NQPWFUNJORWPCR-AWEZNQCLSA-N	1	0	256.393	4.179	20	30		CIEDRO
C=CC[C@@H](C)[NH2+]Cc1cnc(-c2c(F)cccc2F)s1	ZINC000449150096	260257992	/nfs/dbraw/zinc/25/79/92/260257992.db2.gz	QAJWAPVALDLYDT-SNVBAGLBSA-N	1	0	294.370	4.143	20	30		CIEDRO
CCC(CC)c1cc(C[NH2+]C2CCC(C)(C#N)CC2)on1	ZINC000449168322	260269952	/nfs/dbraw/zinc/26/99/52/260269952.db2.gz	LZTLXDMROKSWMW-UHFFFAOYSA-N	1	0	289.423	4.140	20	30		CIEDRO
C[C@@H]1C[C@H](c2ccccc2)[N@H+](Cc2ccc(C#N)s2)C1	ZINC000517782290	260306127	/nfs/dbraw/zinc/30/61/27/260306127.db2.gz	CWVCLFWXWWFRSX-CXAGYDPISA-N	1	0	282.412	4.203	20	30		CIEDRO
Cc1ccc([C@@H]2C[C@@H](C)CC[N@@H+]2CCCSCC#N)o1	ZINC000080629682	260317052	/nfs/dbraw/zinc/31/70/52/260317052.db2.gz	MQHRNKINWXAKLM-ZFWWWQNUSA-N	1	0	292.448	4.008	20	30		CIEDRO
N#CCCCC[NH2+][C@H](c1ccc(F)cc1)C1CCCC1	ZINC000091319607	260474054	/nfs/dbraw/zinc/47/40/54/260474054.db2.gz	UXRBZFKRYFQIRP-KRWDZBQOSA-N	1	0	274.383	4.340	20	30		CIEDRO
CC(C)(C)c1ccc(CC[NH2+]Cc2cccc(C#N)c2)cc1	ZINC000520952505	260505589	/nfs/dbraw/zinc/50/55/89/260505589.db2.gz	XOMQNALWMNSIKX-UHFFFAOYSA-N	1	0	292.426	4.188	20	30		CIEDRO
Cc1cccc(NC2CC[NH+](CC(C)(C)CCC#N)CC2)c1	ZINC000093607847	260521144	/nfs/dbraw/zinc/52/11/44/260521144.db2.gz	FTPZCRQAYWFTDF-UHFFFAOYSA-N	1	0	299.462	4.201	20	30		CIEDRO
C=CCCC[NH2+][C@H]1CCCOc2c(Cl)cccc21	ZINC000448022014	260574244	/nfs/dbraw/zinc/57/42/44/260574244.db2.gz	LZTQWORPFJUFKT-AWEZNQCLSA-N	1	0	265.784	4.110	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)c1sc(C(C)C)nc1C	ZINC000448026124	260582765	/nfs/dbraw/zinc/58/27/65/260582765.db2.gz	HBVMEOTUKGSIFA-NSHDSACASA-N	1	0	252.427	4.192	20	30		CIEDRO
C=CCCC[NH2+][C@H](CC)CSc1ccccc1[N+](=O)[O-]	ZINC000448027251	260587929	/nfs/dbraw/zinc/58/79/29/260587929.db2.gz	MDVLJJXAWSJMSO-CYBMUJFWSA-N	1	0	294.420	4.021	20	30		CIEDRO
C=CCCOCC[NH2+][C@H](c1ccc(C)cc1)C1CCC1	ZINC000427528694	260761023	/nfs/dbraw/zinc/76/10/23/260761023.db2.gz	AOZDGIZQRZKASI-SFHVURJKSA-N	1	0	273.420	4.019	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+]Cc1nc2cc(Cl)ccc2n1C	ZINC000427888708	260873828	/nfs/dbraw/zinc/87/38/28/260873828.db2.gz	UJKRFXDNDNKSRE-CYBMUJFWSA-N	1	0	291.826	4.061	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)cc1)c1ccc2c(c1)CCCC2	ZINC000052662093	261111327	/nfs/dbraw/zinc/11/13/27/261111327.db2.gz	BXGYBOCFZXPBJI-HNNXBMFYSA-N	1	0	290.410	4.288	20	30		CIEDRO
CCCC[C@H](CC)C[NH2+]C1CCC(C)(C#N)CC1	ZINC000449065628	261144553	/nfs/dbraw/zinc/14/45/53/261144553.db2.gz	VAHDKYTZLOWWHB-FHERZECASA-N	1	0	250.430	4.265	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@@H](C)c1ccc(OC)cc1	ZINC000172831729	261155356	/nfs/dbraw/zinc/15/53/56/261155356.db2.gz	GMAGSDVCDZGUOI-HNNXBMFYSA-N	1	0	297.398	4.111	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H](C)CCc2ccc(C)o2)cc1	ZINC000462737881	261615202	/nfs/dbraw/zinc/61/52/02/261615202.db2.gz	QSVZHYCPZNRIRQ-HNNXBMFYSA-N	1	0	299.414	4.264	20	30		CIEDRO
N#CCCCC[NH2+][C@H]1CC2(CCCCC2)Oc2ccccc21	ZINC000179139709	261767172	/nfs/dbraw/zinc/76/71/72/261767172.db2.gz	LESHGOVGWGKUGA-KRWDZBQOSA-N	1	0	298.430	4.497	20	30		CIEDRO
Cc1nc(C)c([C@@H](C)[NH2+][C@H](CCC#N)c2ccccc2)s1	ZINC000181572080	261903161	/nfs/dbraw/zinc/90/31/61/261903161.db2.gz	WDMHOUVSROYDOW-CZUORRHYSA-N	1	0	299.443	4.456	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCCOc2ccccc21)c1cccc(C#N)c1	ZINC000181643091	261905349	/nfs/dbraw/zinc/90/53/49/261905349.db2.gz	LZGPCNSAPCNLFO-RDTXWAMCSA-N	1	0	292.382	4.123	20	30		CIEDRO
C[C@H]([NH2+]CCCC(C)(C)C#N)C(C)(C)c1ccccc1	ZINC000181775199	261910194	/nfs/dbraw/zinc/91/01/94/261910194.db2.gz	UWAHPJOCJBGPDT-HNNXBMFYSA-N	1	0	272.436	4.272	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)c1ccc(OC(F)F)cc1	ZINC000185767983	262069734	/nfs/dbraw/zinc/06/97/34/262069734.db2.gz	AYZMJYJISRCKKB-MBNYWOFBSA-N	1	0	294.345	4.021	20	30		CIEDRO
CC(C)Oc1cccc([C@H](C)[NH2+][C@@H]2CCC[C@H](C#N)C2)c1	ZINC000185780394	262070680	/nfs/dbraw/zinc/07/06/80/262070680.db2.gz	WXIOKJFLQSYHQI-YQQAZPJKSA-N	1	0	286.419	4.207	20	30		CIEDRO
Cc1ccc([C@@H](C)[NH2+][C@H](CCC#N)c2ccccc2)c(O)c1	ZINC000186151083	262081970	/nfs/dbraw/zinc/08/19/70/262081970.db2.gz	LBFDLNCNJHDHAI-CRAIPNDOSA-N	1	0	294.398	4.396	20	30		CIEDRO
C[C@H]([NH2+]C[C@@H]1CCC2(CCCCC2)O1)c1ccc(C#N)cc1	ZINC000319264207	262191200	/nfs/dbraw/zinc/19/12/00/262191200.db2.gz	WLBRPISCKQAJIW-YJBOKZPZSA-N	1	0	298.430	4.091	20	30		CIEDRO
C[C@@H]([NH2+]C[C@@H](C)c1ccccc1)c1ccc(C#N)cc1	ZINC000020137097	262194022	/nfs/dbraw/zinc/19/40/22/262194022.db2.gz	LHYRNDLXEGMJON-HUUCEWRRSA-N	1	0	264.372	4.013	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CCSC[C@@H]1c1cccs1	ZINC000364332640	262204446	/nfs/dbraw/zinc/20/44/46/262204446.db2.gz	BBASRUXNXHVLLL-CYBMUJFWSA-N	1	0	294.489	4.168	20	30		CIEDRO
CC[NH+](CC)Cc1ccc(N[C@@H]2CCC[C@@H](C#N)C2)cc1	ZINC000193339380	262220996	/nfs/dbraw/zinc/22/09/96/262220996.db2.gz	MQMSOTQJQORVAJ-SJLPKXTDSA-N	1	0	285.435	4.023	20	30		CIEDRO
CC[NH+](CC)Cc1ccc(N[C@@H]2CCC[C@H](C#N)C2)cc1	ZINC000193339355	262221109	/nfs/dbraw/zinc/22/11/09/262221109.db2.gz	MQMSOTQJQORVAJ-FUHWJXTLSA-N	1	0	285.435	4.023	20	30		CIEDRO
CC[C@@H](CC#N)[NH2+][C@@H](C)CC(C)(C)c1ccccc1	ZINC000054183661	262259784	/nfs/dbraw/zinc/25/97/84/262259784.db2.gz	FJLPNDPEZDPFBJ-HOCLYGCPSA-N	1	0	258.409	4.025	20	30		CIEDRO
CC(C)[C@H](C[NH2+]Cc1cccc(C#N)c1)c1ccccc1	ZINC000221792973	262297158	/nfs/dbraw/zinc/29/71/58/262297158.db2.gz	FCYRGUALGPBMJT-IBGZPJMESA-N	1	0	278.399	4.088	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1ccc(Cl)cc1	ZINC000185755959	262308112	/nfs/dbraw/zinc/30/81/12/262308112.db2.gz	NRHOXFCUPBXHGG-HUBLWGQQSA-N	1	0	262.784	4.073	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)c1ccc(F)cc1Cl	ZINC000185839941	262309757	/nfs/dbraw/zinc/30/97/57/262309757.db2.gz	YOFSOOZKAJAKFT-NTZNESFSSA-N	1	0	280.774	4.212	20	30		CIEDRO
C=CCSCC[NH2+][C@@H](C)c1ccc(F)cc1Cl	ZINC000221942662	262332783	/nfs/dbraw/zinc/33/27/83/262332783.db2.gz	QJMOXOHMQSLCBV-JTQLQIEISA-N	1	0	273.804	4.049	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@@H]1CCCc2sccc21	ZINC000061360067	262394967	/nfs/dbraw/zinc/39/49/67/262394967.db2.gz	XRHCGSDGYOMVBC-MRXNPFEDSA-N	1	0	299.439	4.480	20	30		CIEDRO
CC(C)(C#N)CCC[NH+]1CC(c2nc3ccccc3s2)C1	ZINC000336840485	262399389	/nfs/dbraw/zinc/39/93/89/262399389.db2.gz	MHFJTTYFCLXMSR-UHFFFAOYSA-N	1	0	299.443	4.025	20	30		CIEDRO
C=CCC[NH2+][C@@H](C)c1ccc(-c2csc(C)n2)cc1	ZINC000338572613	262547703	/nfs/dbraw/zinc/54/77/03/262547703.db2.gz	WOKXKPLCAMGEIV-LBPRGKRZSA-N	1	0	272.417	4.345	20	30		CIEDRO
N#CCCCC[NH2+][C@@H]1CCCOc2c3ccccc3ccc21	ZINC000366514562	262676853	/nfs/dbraw/zinc/67/68/53/262676853.db2.gz	WWAMVIDKLKJLCK-GOSISDBHSA-N	1	0	294.398	4.337	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](C)c1csc(-c2ccccc2)n1	ZINC000414092971	262803733	/nfs/dbraw/zinc/80/37/33/262803733.db2.gz	LUQQZZVWMZYFDT-OLZOCXBDSA-N	1	0	272.417	4.425	20	30		CIEDRO
CC[C@H]([NH2+][C@H](CCC#N)c1ccccc1)[C@@H]1C[C@@H]1C	ZINC000414099027	262804178	/nfs/dbraw/zinc/80/41/78/262804178.db2.gz	KIQODIAPJWKAMS-PQEBFOHHSA-N	1	0	256.393	4.056	20	30		CIEDRO
N#CCCC[NH2+][C@@H]1CCC[C@H](c2ccc(Cl)cc2)C1	ZINC000414107503	262805983	/nfs/dbraw/zinc/80/59/83/262805983.db2.gz	KHPHOYBSHJLNIW-GOEBONIOSA-N	1	0	276.811	4.260	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+]C[C@@H](C)CC(F)(F)F	ZINC000414264580	262832459	/nfs/dbraw/zinc/83/24/59/262832459.db2.gz	KSCICPWQFCKGPG-NWDGAFQWSA-N	1	0	251.336	4.299	20	30		CIEDRO
N#CCCCC[NH2+][C@H]1CC=C(c2ccc(F)cc2)CC1	ZINC000272396360	263003964	/nfs/dbraw/zinc/00/39/64/263003964.db2.gz	WVFPGTGOHHXCJA-KRWDZBQOSA-N	1	0	272.367	4.045	20	30		CIEDRO
N#CCCC[NH2+][C@@H]1CC2(CCCCC2)Oc2ccccc21	ZINC000273265431	263014711	/nfs/dbraw/zinc/01/47/11/263014711.db2.gz	NPIFEAPHMLUSIQ-MRXNPFEDSA-N	1	0	284.403	4.106	20	30		CIEDRO
CC[C@@H](CC#N)[NH2+][C@@H]1CC=C(c2ccc(F)cc2)CC1	ZINC000273834529	263019772	/nfs/dbraw/zinc/01/97/72/263019772.db2.gz	GQBWTMNTUKLBBK-DLBZAZTESA-N	1	0	272.367	4.043	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@@H](C#N)C1)c1cccc2ccccc21	ZINC000274547590	263025850	/nfs/dbraw/zinc/02/58/50/263025850.db2.gz	VPAPCMGAELGHHS-SQWLQELKSA-N	1	0	264.372	4.183	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@@H](C#N)C1)c1nc(-c2ccccc2)cs1	ZINC000274603160	263027502	/nfs/dbraw/zinc/02/75/02/263027502.db2.gz	IIQYMKPKTYLEIZ-GZBFAFLISA-N	1	0	297.427	4.153	20	30		CIEDRO
CC[C@](C)([NH2+]CCCCC(C)(C)C#N)c1nccs1	ZINC000277585457	263041996	/nfs/dbraw/zinc/04/19/96/263041996.db2.gz	CQTQIHICIJNMSG-HNNXBMFYSA-N	1	0	279.453	4.078	20	30		CIEDRO
CC[C@@](C)([NH2+]CCCCC(C)(C)C#N)c1nccs1	ZINC000277585466	263042056	/nfs/dbraw/zinc/04/20/56/263042056.db2.gz	CQTQIHICIJNMSG-OAHLLOKOSA-N	1	0	279.453	4.078	20	30		CIEDRO
Cc1ccc([C@@H]2CCC[N@@H+]2CCCCC(C)(C)C#N)o1	ZINC000277589503	263042203	/nfs/dbraw/zinc/04/22/03/263042203.db2.gz	DEOIGFUJKUXSDH-HNNXBMFYSA-N	1	0	274.408	4.445	20	30		CIEDRO
Cc1cccnc1[C@@H]([NH2+]CCCCC(C)(C)C#N)C(C)C	ZINC000277613408	263042312	/nfs/dbraw/zinc/04/23/12/263042312.db2.gz	FWRWHWFWPZFXMO-INIZCTEOSA-N	1	0	287.451	4.397	20	30		CIEDRO
CC[C@@H](c1ccncc1)[N@H+](C)CCCCC(C)(C)C#N	ZINC000277595705	263042463	/nfs/dbraw/zinc/04/24/63/263042463.db2.gz	DQSKIMHXSVJMTG-INIZCTEOSA-N	1	0	273.424	4.185	20	30		CIEDRO
Cc1nc(C)c([C@H](C)[N@H+](C)CCCCC(C)(C)C#N)s1	ZINC000277861275	263044040	/nfs/dbraw/zinc/04/40/40/263044040.db2.gz	YBPFDCYUXYLFKV-ZDUSSCGKSA-N	1	0	293.480	4.473	20	30		CIEDRO
N#CC1CC[NH+](Cc2ccc(-c3ccsc3)cc2)CC1	ZINC000277879242	263044299	/nfs/dbraw/zinc/04/42/99/263044299.db2.gz	ZAEGZUKUPHBYCX-UHFFFAOYSA-N	1	0	282.412	4.151	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1CC[C@@H](c2ccc(F)cc2)C1	ZINC000279655553	263056566	/nfs/dbraw/zinc/05/65/66/263056566.db2.gz	LCOFCNFGVQDNKB-NVXWUHKLSA-N	1	0	288.410	4.381	20	30		CIEDRO
Cc1ccc([C@@H]([NH2+]CCC(C)(C)C#N)c2ccccn2)cc1	ZINC000280082540	263058905	/nfs/dbraw/zinc/05/89/05/263058905.db2.gz	NYKWLDSVFORQSC-GOSISDBHSA-N	1	0	293.414	4.009	20	30		CIEDRO
C[C@@H]([NH2+]CCCCC#N)[C@@H](C)c1ccc(Cl)cc1	ZINC000280960954	263065482	/nfs/dbraw/zinc/06/54/82/263065482.db2.gz	SJIZDGNGKYNHIA-CHWSQXEVSA-N	1	0	264.800	4.115	20	30		CIEDRO
N#CC1CCC(C[NH2+]Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000281589519	263070502	/nfs/dbraw/zinc/07/05/02/263070502.db2.gz	DWUQAPIHJAKUCE-UHFFFAOYSA-N	1	0	296.336	4.125	20	30		CIEDRO
CSc1ccc([C@@H](C)[NH2+][C@H]2CCC[C@H](C#N)C2)cc1	ZINC000281824125	263072186	/nfs/dbraw/zinc/07/21/86/263072186.db2.gz	ZVMUYWLAAFEKCO-IPYPFGDCSA-N	1	0	274.433	4.141	20	30		CIEDRO
C[C@H]([NH2+]CC1CCC(C#N)CC1)c1cnc2ccsc2c1	ZINC000282177114	263074894	/nfs/dbraw/zinc/07/48/94/263074894.db2.gz	FJBZNNWDOPQAPC-HSBZDZAISA-N	1	0	299.443	4.277	20	30		CIEDRO
CC[C@H]([NH2+]CC1CCC(C#N)CC1)c1ccc(N(C)C)cc1	ZINC000282189875	263074943	/nfs/dbraw/zinc/07/49/43/263074943.db2.gz	GCVMISBBESYHJS-RJYAGPCLSA-N	1	0	299.462	4.123	20	30		CIEDRO
C[C@@H](CCc1ccccc1F)[NH2+]CC1CCC(C#N)CC1	ZINC000282180210	263074971	/nfs/dbraw/zinc/07/49/71/263074971.db2.gz	FOPRBPAGTSHDRR-FHERZECASA-N	1	0	288.410	4.066	20	30		CIEDRO
N#CC1CCC(C[NH2+][C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000282260743	263075277	/nfs/dbraw/zinc/07/52/77/263075277.db2.gz	JZICIVNCZUNIOD-LRMJVLKBSA-N	1	0	282.431	4.242	20	30		CIEDRO
N#CC1CCC(C[NH2+][C@@H]2CCCc3sccc32)CC1	ZINC000282249048	263075298	/nfs/dbraw/zinc/07/52/98/263075298.db2.gz	JKIGENIZAMRHHS-SSDMNJCBSA-N	1	0	274.433	4.045	20	30		CIEDRO
C[C@H](CC[NH2+]CC1CCC(C#N)CC1)c1ccccc1	ZINC000282260401	263075379	/nfs/dbraw/zinc/07/53/79/263075379.db2.gz	JXFXAQILYGJTNU-KLAILNCOSA-N	1	0	270.420	4.100	20	30		CIEDRO
CSc1ccccc1[C@H](C)[NH2+][C@@H]1CCC[C@H](C#N)C1	ZINC000282355261	263076177	/nfs/dbraw/zinc/07/61/77/263076177.db2.gz	PMOPNWLPUBHAPX-MELADBBJSA-N	1	0	274.433	4.141	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@H](C#N)C1)c1ccc(-c2cccnc2)cc1	ZINC000282399516	263076463	/nfs/dbraw/zinc/07/64/63/263076463.db2.gz	RPWKVKXSRRZEMP-DOXZYTNZSA-N	1	0	291.398	4.091	20	30		CIEDRO
CC(C)Oc1ccc([C@H](C)[NH2+]CCCC#N)cc1Cl	ZINC000284274590	263086256	/nfs/dbraw/zinc/08/62/56/263086256.db2.gz	JNXITBZNVMHRLN-LBPRGKRZSA-N	1	0	280.799	4.082	20	30		CIEDRO
C[C@@H]1CC[C@H](c2ccccc2)[N@H+](CCCCC#N)C1	ZINC000285609998	263094564	/nfs/dbraw/zinc/09/45/64/263094564.db2.gz	QBEYYQPGMXUPON-NVXWUHKLSA-N	1	0	256.393	4.153	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(OCC#N)cc1)c1cccc(C)c1	ZINC000286176493	263097482	/nfs/dbraw/zinc/09/74/82/263097482.db2.gz	QQLCOKVBEUWNMJ-IBGZPJMESA-N	1	0	294.398	4.138	20	30		CIEDRO
C=CCC[C@H]([NH2+]CC1CCC(C#N)CC1)c1ccco1	ZINC000287447736	263101999	/nfs/dbraw/zinc/10/19/99/263101999.db2.gz	LFZNPEYKRMVMFZ-GPANFISMSA-N	1	0	272.392	4.206	20	30		CIEDRO
C[C@@H]([NH2+]CCc1cccc(C#N)c1)c1csc(Cl)c1	ZINC000467436902	263104685	/nfs/dbraw/zinc/10/46/85/263104685.db2.gz	RLCMAGNGGDWEDQ-LLVKDONJSA-N	1	0	290.819	4.166	20	30		CIEDRO
CC[C@H](CC#N)[NH2+]C[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000289485563	263110442	/nfs/dbraw/zinc/11/04/42/263110442.db2.gz	BEGMPFXZTBKITB-BXUZGUMPSA-N	1	0	284.325	4.091	20	30		CIEDRO
CC[C@@H](CC#N)[NH2+]C[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000289485573	263110469	/nfs/dbraw/zinc/11/04/69/263110469.db2.gz	BEGMPFXZTBKITB-RISCZKNCSA-N	1	0	284.325	4.091	20	30		CIEDRO
CC(C)(CCC#N)C[N@@H+]1CC(C)(C)[C@@H]1c1cccs1	ZINC000290078585	263114638	/nfs/dbraw/zinc/11/46/38/263114638.db2.gz	GIKKQPSEKWKPJW-AWEZNQCLSA-N	1	0	276.449	4.461	20	30		CIEDRO
CC(C)Oc1ccc([C@@H]2CCC[C@H]2[NH2+]CCCC#N)cc1	ZINC000366677262	263115563	/nfs/dbraw/zinc/11/55/63/263115563.db2.gz	KFFJXEHSHZMBDR-ZWKOTPCHSA-N	1	0	286.419	4.003	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H]1CCSc2ccc(OC)cc21	ZINC000340429136	263141601	/nfs/dbraw/zinc/14/16/01/263141601.db2.gz	GXQHONYMQLOABC-OAHLLOKOSA-N	1	0	291.460	4.424	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](CCCC#N)c1ccccc1)c1nccs1	ZINC000340431840	263145138	/nfs/dbraw/zinc/14/51/38/263145138.db2.gz	JNMOKTAFXIPSTN-HIFRSBDPSA-N	1	0	285.416	4.229	20	30		CIEDRO
CCc1ccc([C@@H]2CCC[N@@H+]([C@H]3CC[C@H](C#N)C3)C2)cc1	ZINC000293735469	263148080	/nfs/dbraw/zinc/14/80/80/263148080.db2.gz	ZQWBDOVUTGCEMN-UHOSZYNNSA-N	1	0	282.431	4.121	20	30		CIEDRO
C[C@H]([NH2+][C@H](CCCC#N)c1ccccc1)c1cncc(F)c1	ZINC000340446004	263152484	/nfs/dbraw/zinc/15/24/84/263152484.db2.gz	MWBVVLRKNQZOTR-KBXCAEBGSA-N	1	0	297.377	4.306	20	30		CIEDRO
CCC1CC([NH2+][C@@H](CCCC#N)c2ccccc2)C1	ZINC000340446385	263152697	/nfs/dbraw/zinc/15/26/97/263152697.db2.gz	NUEHCROVFGUCTM-PREGVCBESA-N	1	0	256.393	4.200	20	30		CIEDRO
Cc1ccncc1[C@@H](C)[NH2+][C@@H](CCCC#N)c1ccccc1	ZINC000340447935	263154161	/nfs/dbraw/zinc/15/41/61/263154161.db2.gz	HVDNTLGMYQVIPO-APWZRJJASA-N	1	0	293.414	4.476	20	30		CIEDRO
C[C@@H]([NH2+][C@H](CCCC#N)c1ccccc1)c1cccc(O)c1	ZINC000340450404	263155118	/nfs/dbraw/zinc/15/51/18/263155118.db2.gz	YGIZFUCNYGBTHP-DNVCBOLYSA-N	1	0	294.398	4.478	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H](CCCC#N)c1ccccc1)C1CC1	ZINC000340451028	263155221	/nfs/dbraw/zinc/15/52/21/263155221.db2.gz	ZDMRFWKYQCRZGY-SJORKVTESA-N	1	0	256.393	4.200	20	30		CIEDRO
C[C@@H]([NH2+][C@H](CCCC#N)c1ccccc1)c1cccnc1	ZINC000340451045	263155625	/nfs/dbraw/zinc/15/56/25/263155625.db2.gz	ZJNGBFLFDPGVEK-CRAIPNDOSA-N	1	0	279.387	4.167	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([N@@H+]2CC=C(c3cccc(Cl)c3)CC2)C1	ZINC000294257616	263158610	/nfs/dbraw/zinc/15/86/10/263158610.db2.gz	UUMMEJPRDSBLSC-SUMWQHHRSA-N	1	0	286.806	4.121	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000295008395	263170763	/nfs/dbraw/zinc/17/07/63/263170763.db2.gz	JEWPDUTYYKAVHO-KANFNMMFSA-N	1	0	282.431	4.385	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+]Cc2ccc(-c3ccccc3F)o2)C1	ZINC000295112406	263172586	/nfs/dbraw/zinc/17/25/86/263172586.db2.gz	VFVQCUYTCXLASW-KBPBESRZSA-N	1	0	298.361	4.258	20	30		CIEDRO
Cc1cc(C[NH2+][C@H](CCC#N)c2ccccc2)cs1	ZINC000295712895	263181376	/nfs/dbraw/zinc/18/13/76/263181376.db2.gz	NBVZGXJNGSNERS-MRXNPFEDSA-N	1	0	270.401	4.191	20	30		CIEDRO
CC(C)[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccccc1	ZINC000296236178	263188001	/nfs/dbraw/zinc/18/80/01/263188001.db2.gz	CHSWJGDJCJILHU-XIRDDKMYSA-N	1	0	256.393	4.056	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1cc2ccccc2o1	ZINC000296331466	263190133	/nfs/dbraw/zinc/19/01/33/263190133.db2.gz	HIHPAVYUFDLZOO-IPYPFGDCSA-N	1	0	268.360	4.166	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccc(Cl)s1	ZINC000296361503	263190625	/nfs/dbraw/zinc/19/06/25/263190625.db2.gz	ISCNAHYQPGNXEC-VWYCJHECSA-N	1	0	268.813	4.134	20	30		CIEDRO
Cc1cc([C@@H](C)[NH2+]CC2CCC(C#N)CC2)cs1	ZINC000296427091	263191417	/nfs/dbraw/zinc/19/14/17/263191417.db2.gz	LTLUBUVCMLVWNC-IYXRBSQSSA-N	1	0	262.422	4.037	20	30		CIEDRO
CCC[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccc(OC)cc1	ZINC000296510606	263192289	/nfs/dbraw/zinc/19/22/89/263192289.db2.gz	PMIFOMCHPKWYJU-ZVZYQTTQSA-N	1	0	286.419	4.208	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccc(Cl)cc1	ZINC000296508378	263192317	/nfs/dbraw/zinc/19/23/17/263192317.db2.gz	PKMWFDGVMBOYAO-RCBQFDQVSA-N	1	0	276.811	4.463	20	30		CIEDRO
Cc1nc(C(C)C)sc1[C@H](C)[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000296653716	263194893	/nfs/dbraw/zinc/19/48/93/263194893.db2.gz	ZBSKDMFGFCEPJK-UBHSHLNASA-N	1	0	291.464	4.308	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)CCC#N)c1cc2ccccc2s1	ZINC000298945800	263227796	/nfs/dbraw/zinc/22/77/96/263227796.db2.gz	OKAUDGTVVZOWAR-NWDGAFQWSA-N	1	0	258.390	4.244	20	30		CIEDRO
CC[C@H]([NH2+][C@H](C)CCC#N)c1cccc(Cl)c1	ZINC000299701516	263252856	/nfs/dbraw/zinc/25/28/56/263252856.db2.gz	PAQDFXMRKOFOJC-RISCZKNCSA-N	1	0	250.773	4.073	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)CCC#N)c1ccc2ccccc2c1	ZINC000299733679	263254441	/nfs/dbraw/zinc/25/44/41/263254441.db2.gz	YWRYHQNZGWHFPU-UONOGXRCSA-N	1	0	252.361	4.183	20	30		CIEDRO
Cc1ccc(C[N@@H+](C)[C@@H](C)c2cccc(C#N)c2)s1	ZINC000187675150	263265901	/nfs/dbraw/zinc/26/59/01/263265901.db2.gz	BFYORFVCIJJNPT-ZDUSSCGKSA-N	1	0	270.401	4.121	20	30		CIEDRO
COc1ccc(C[N@H+](C)[C@@H](C)c2cccc(C#N)c2)cc1C	ZINC000187669240	263266493	/nfs/dbraw/zinc/26/64/93/263266493.db2.gz	JLXFIERGNBTQKL-HNNXBMFYSA-N	1	0	294.398	4.068	20	30		CIEDRO
C=C(C)[C@H]([NH2+][C@H]1CC[C@@H]1SC)c1ccc(F)c(F)c1	ZINC000425333718	264010178	/nfs/dbraw/zinc/01/01/78/264010178.db2.gz	FMOCLLRJUGLMLD-KKUMJFAQSA-N	1	0	283.387	4.066	20	30		CIEDRO
C=C(C)[C@H]([NH2+][C@@H]1CC[C@H]1SC)c1ccc(F)c(F)c1	ZINC000425333716	264010380	/nfs/dbraw/zinc/01/03/80/264010380.db2.gz	FMOCLLRJUGLMLD-KFWWJZLASA-N	1	0	283.387	4.066	20	30		CIEDRO
COc1cc(C)ccc1C[N@H+](C)[C@H](C)c1cccc(C#N)c1	ZINC000425364411	264137596	/nfs/dbraw/zinc/13/75/96/264137596.db2.gz	GGQAMGKFKHLANQ-OAHLLOKOSA-N	1	0	294.398	4.068	20	30		CIEDRO
CCOc1cccc(C[N@H+](C)[C@H](C)c2cccc(C#N)c2)c1	ZINC000425365540	264211167	/nfs/dbraw/zinc/21/11/67/264211167.db2.gz	LKYQDKIOWYIUDV-OAHLLOKOSA-N	1	0	294.398	4.150	20	30		CIEDRO
C=CCSCC[NH2+][C@H](C)c1cc2ccc(C)cc2o1	ZINC000426015187	264309412	/nfs/dbraw/zinc/30/94/12/264309412.db2.gz	GPTAZJAUXZBACY-CYBMUJFWSA-N	1	0	275.417	4.311	20	30		CIEDRO
Cc1ccc([C@@H]2CCC[C@H]2[NH2+]Cc2cccc(C#N)c2)cc1	ZINC000468363843	264331823	/nfs/dbraw/zinc/33/18/23/264331823.db2.gz	WUFJYXTTXAKVIX-VQTJNVASSA-N	1	0	290.410	4.293	20	30		CIEDRO
Cc1ccc([C@H]2CCC[C@H]2[NH2+]Cc2cccc(C#N)c2)cc1	ZINC000468363844	264332609	/nfs/dbraw/zinc/33/26/09/264332609.db2.gz	WUFJYXTTXAKVIX-WOJBJXKFSA-N	1	0	290.410	4.293	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+][C@H]2C[C@H](c3ccc(Cl)cc3)C2)C1	ZINC000475672877	264335738	/nfs/dbraw/zinc/33/57/38/264335738.db2.gz	PENWCTZVERFIMV-CSFVBSKPSA-N	1	0	288.822	4.258	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1nccn1C(C)C)c1ccccc1	ZINC000180042320	264394764	/nfs/dbraw/zinc/39/47/64/264394764.db2.gz	PHQOHPXACGWYGV-KRWDZBQOSA-N	1	0	283.419	4.261	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](C)c1sc(C(C)C)nc1C	ZINC000180950116	264430578	/nfs/dbraw/zinc/43/05/78/264430578.db2.gz	VWRKGDXPAANYSM-GHMZBOCLSA-N	1	0	252.427	4.190	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1cccc(N(C)C)c1)c1ccco1	ZINC000285531075	264562822	/nfs/dbraw/zinc/56/28/22/264562822.db2.gz	BRLHNQIAQQFGMS-KRWDZBQOSA-N	1	0	284.403	4.143	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccccc1N(C)C)c1ccco1	ZINC000285996992	264572826	/nfs/dbraw/zinc/57/28/26/264572826.db2.gz	HJJJUIWGJOENSM-MRXNPFEDSA-N	1	0	284.403	4.143	20	30		CIEDRO
CC(C)(C[NH2+][C@H]1CC[C@@H](C#N)C1)Cc1cccc(Cl)c1	ZINC000442777475	264927769	/nfs/dbraw/zinc/92/77/69/264927769.db2.gz	GABJNMJSIGRXJC-ZBFHGGJFSA-N	1	0	290.838	4.191	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCC1(COC)CCC1)c1ccco1	ZINC000293806191	264996609	/nfs/dbraw/zinc/99/66/09/264996609.db2.gz	VIKOBKZMBQOFQR-HNNXBMFYSA-N	1	0	277.408	4.083	20	30		CIEDRO
C[C@@H]([NH2+]Cc1cc(C#N)cs1)c1ccc(Cl)cc1	ZINC000093492061	265181351	/nfs/dbraw/zinc/18/13/51/265181351.db2.gz	LGZWTYJLRMQSHR-SNVBAGLBSA-N	1	0	276.792	4.124	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@@H](C)[C@H](OC)c1ccccc1Cl	ZINC000519735695	265571520	/nfs/dbraw/zinc/57/15/20/265571520.db2.gz	RGCVXLHZMBHWST-XEZPLFJOSA-N	1	0	281.827	4.360	20	30		CIEDRO
C[C@@H](CC(C)(C)c1ccccc1)[NH2+]Cc1cccc(C#N)c1	ZINC000314768707	266014000	/nfs/dbraw/zinc/01/40/00/266014000.db2.gz	WOAGQNFQFUGFRZ-INIZCTEOSA-N	1	0	292.426	4.404	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H](C)[C@@H]1CCCOC1)c1ccccc1	ZINC000356854178	266191120	/nfs/dbraw/zinc/19/11/20/266191120.db2.gz	TYHNGCFAEZCOTK-JQHSSLGASA-N	1	0	273.420	4.099	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CC[C@@H]1CCCCO1)c1ccccc1	ZINC000356931530	266212511	/nfs/dbraw/zinc/21/25/11/266212511.db2.gz	WWXLJBWRUYIHDC-ZWKOTPCHSA-N	1	0	273.420	4.243	20	30		CIEDRO
Cc1ccccc1C1CC([N@H+](CCCC#N)C2CC2)C1	ZINC000357799735	266366561	/nfs/dbraw/zinc/36/65/61/266366561.db2.gz	HUFZIFKNHWJIGV-UHFFFAOYSA-N	1	0	268.404	4.009	20	30		CIEDRO
C=CCSCC[NH2+][C@H]1CCCOc2c(C)cc(C)cc21	ZINC000358019866	266398331	/nfs/dbraw/zinc/39/83/31/266398331.db2.gz	DTNBLLWAHVJKDY-INIZCTEOSA-N	1	0	291.460	4.026	20	30		CIEDRO
C[C@H]1[C@H](c2ccccc2)C[C@@H]1[NH2+]CC(C)(C)CCC#N	ZINC000361302705	266820018	/nfs/dbraw/zinc/82/00/18/266820018.db2.gz	BYGKFOHIUFWRBU-UAGQMJEPSA-N	1	0	270.420	4.098	20	30		CIEDRO
Cc1ccc2c(c1)OCCC[C@@H]2[NH2+]CC(C)(C)CCC#N	ZINC000367906079	267126829	/nfs/dbraw/zinc/12/68/29/267126829.db2.gz	XMMTUKPAQINQCM-INIZCTEOSA-N	1	0	286.419	4.128	20	30		CIEDRO
CC(C)(C#N)CCCC[NH+]1CCC(Cc2ccccn2)CC1	ZINC000368438411	267172693	/nfs/dbraw/zinc/17/26/93/267172693.db2.gz	LIFRXWAZFZKTBG-UHFFFAOYSA-N	1	0	299.462	4.056	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C#N)s1)c1ccc(C2CC2)cc1	ZINC000418116982	267197866	/nfs/dbraw/zinc/19/78/66/267197866.db2.gz	SALSYABHFSMMLP-GFCCVEGCSA-N	1	0	282.412	4.348	20	30		CIEDRO
C=CCCC[N@@H+](C)[C@@H](c1ccccc1)c1ccccn1	ZINC000117881534	267223906	/nfs/dbraw/zinc/22/39/06/267223906.db2.gz	HBYZXNLIANBNOE-SFHVURJKSA-N	1	0	266.388	4.069	20	30		CIEDRO
C=CC1CC[NH+]([C@@H](C)c2nnc(-c3cccc(C)c3)o2)CC1	ZINC000369191575	267225395	/nfs/dbraw/zinc/22/53/95/267225395.db2.gz	KPJCIQPQFXKKPS-AWEZNQCLSA-N	1	0	297.402	4.004	20	30		CIEDRO
Cc1ccccc1[C@H](CC(C)C)[NH2+]CCCCC#N	ZINC000118986054	267283268	/nfs/dbraw/zinc/28/32/68/267283268.db2.gz	NRAMQNRWRCMWMG-KRWDZBQOSA-N	1	0	258.409	4.366	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CCS[C@H](c2ccccc2)C1	ZINC000370002537	267283367	/nfs/dbraw/zinc/28/33/67/267283367.db2.gz	QBKIAKJCFKSQJA-INIZCTEOSA-N	1	0	288.460	4.106	20	30		CIEDRO
CC[C@H](CC#N)[NH2+][C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1	ZINC000370490398	267323011	/nfs/dbraw/zinc/32/30/11/267323011.db2.gz	HGPPBACTEVBMRG-WISYIIOYSA-N	1	0	282.840	4.175	20	30		CIEDRO
COc1ccc(C2CCC([NH2+]CC3(C#N)CCC3)CC2)cc1	ZINC000418135274	267359628	/nfs/dbraw/zinc/35/96/28/267359628.db2.gz	AFRCGPVVLLGDBI-UHFFFAOYSA-N	1	0	298.430	4.005	20	30		CIEDRO
N#CC1(C[NH2+][C@@H]2CC[C@H](c3ccc(Cl)cc3)C2)CCC1	ZINC000418144407	267365604	/nfs/dbraw/zinc/36/56/04/267365604.db2.gz	TXJTZNAFNKWXNU-GOEBONIOSA-N	1	0	288.822	4.260	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+]Cc1ncoc1-c1ccccc1	ZINC000371279484	267380749	/nfs/dbraw/zinc/38/07/49/267380749.db2.gz	IUVPQUQKOAVORD-OAHLLOKOSA-N	1	0	270.376	4.176	20	30		CIEDRO
C[C@@H]1C[C@@H](c2cccs2)C[N@@H+]1CC(C)(C)CCC#N	ZINC000371397690	267399273	/nfs/dbraw/zinc/39/92/73/267399273.db2.gz	BWRMHXSHOHMPFG-ZIAGYGMSSA-N	1	0	276.449	4.256	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1CC[C@@H](c2ccccc2F)C1	ZINC000377089198	268046492	/nfs/dbraw/zinc/04/64/92/268046492.db2.gz	GPCSBMILVNPKOR-HUUCEWRRSA-N	1	0	288.410	4.381	20	30		CIEDRO
Cc1cc([C@H](C)[NH2+]CC(C)(C)CCC#N)cc(C)c1F	ZINC000580110956	327701717	/nfs/dbraw/zinc/70/17/17/327701717.db2.gz	IVVGBYXDPYNAEO-AWEZNQCLSA-N	1	0	276.399	4.423	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H]1CC[C@H](Cc2ccccc2)C1	ZINC000189516087	327780982	/nfs/dbraw/zinc/78/09/82/327780982.db2.gz	CYHHPOPJPUGELG-MSOLQXFVSA-N	1	0	284.447	4.317	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H](CC2CCC2)c2ccccc2)o1	ZINC000180370707	327805227	/nfs/dbraw/zinc/80/52/27/327805227.db2.gz	SPEBWKDCJSSSKA-GOSISDBHSA-N	1	0	280.371	4.172	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]C[C@]1(C)CCCc2ccccc21	ZINC000182005523	327811769	/nfs/dbraw/zinc/81/17/69/327811769.db2.gz	HGAKBOGLNUFFRL-IBGZPJMESA-N	1	0	284.447	4.200	20	30		CIEDRO
N#Cc1cccc(C[NH2+]C[C@@H]2CCC[C@@H](C(F)(F)F)C2)c1	ZINC000531212900	327893538	/nfs/dbraw/zinc/89/35/38/327893538.db2.gz	BGVAWRRICHXGTE-HUUCEWRRSA-N	1	0	296.336	4.017	20	30		CIEDRO
CCC[C@@H]1CCCC[C@@H]1[NH2+]Cc1cc(C#N)cs1	ZINC000531355973	327901201	/nfs/dbraw/zinc/90/12/01/327901201.db2.gz	CDMJHIPHLSMKTD-HIFRSBDPSA-N	1	0	262.422	4.068	20	30		CIEDRO
CC(C)(C[NH2+][C@@H]1CCC[C@H](C#N)C1)c1ccccc1Cl	ZINC000463284815	327915650	/nfs/dbraw/zinc/91/56/50/327915650.db2.gz	QRGCULQZVIABFT-UONOGXRCSA-N	1	0	290.838	4.290	20	30		CIEDRO
CC(C)c1ccc(CCC[NH2+][C@@H]2CCC[C@@H](C#N)C2)cc1	ZINC000463305578	327916251	/nfs/dbraw/zinc/91/62/51/327916251.db2.gz	UFQNUMOQOSWEIR-IEBWSBKVSA-N	1	0	284.447	4.415	20	30		CIEDRO
C=CC[NH2+][C@@H](c1c(Cl)cccc1Cl)C1CC1	ZINC000390782146	327926802	/nfs/dbraw/zinc/92/68/02/327926802.db2.gz	KXPHNTBVHCFIFV-CYBMUJFWSA-N	1	0	256.176	4.220	20	30		CIEDRO
C=CC[NH2+][C@@H](c1ccccc1)c1cccc(Cl)c1	ZINC000531537674	328015570	/nfs/dbraw/zinc/01/55/70/328015570.db2.gz	ZUFKLEMZTIJBTR-INIZCTEOSA-N	1	0	257.764	4.205	20	30		CIEDRO
C[C@@H]([NH2+]CC1CCC(C)CC1)c1ccc(C#N)cc1	ZINC000063144419	328034506	/nfs/dbraw/zinc/03/45/06/328034506.db2.gz	BERGSIJGBSMSRA-NPCAHTBFSA-N	1	0	256.393	4.035	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](C)c1ccccc1Br	ZINC000124110962	328035842	/nfs/dbraw/zinc/03/58/42/328035842.db2.gz	MQUHRVJBLJUDJJ-MNOVXSKESA-N	1	0	268.198	4.064	20	30		CIEDRO
Cc1ccc([C@@H]2CCCCC[N@@H+]2CCC(C)(C)C#N)o1	ZINC000534217783	328039516	/nfs/dbraw/zinc/03/95/16/328039516.db2.gz	GHRBLMQPZMBTSY-HNNXBMFYSA-N	1	0	274.408	4.445	20	30		CIEDRO
N#Cc1ccc(C[NH2+]Cc2csc3ccccc23)cc1	ZINC000048068627	328040793	/nfs/dbraw/zinc/04/07/93/328040793.db2.gz	VVEHTSPBXAWLEA-UHFFFAOYSA-N	1	0	278.380	4.063	20	30		CIEDRO
CSCC[NH2+][C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000541085018	328048556	/nfs/dbraw/zinc/04/85/56/328048556.db2.gz	OINGAWFWKKSOLZ-CQSZACIVSA-N	1	0	296.439	4.239	20	30		CIEDRO
N#Cc1ccc(C[N@@H+]2CCCCC[C@H]2c2ccccc2)nc1	ZINC000565167212	328070042	/nfs/dbraw/zinc/07/00/42/328070042.db2.gz	XNJSWULBMNVKFD-IBGZPJMESA-N	1	0	291.398	4.071	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]Cc1cnc(C2CCCC2)s1	ZINC000563552212	328073138	/nfs/dbraw/zinc/07/31/38/328073138.db2.gz	KNVLHYGXXADSCX-UHFFFAOYSA-N	1	0	278.465	4.493	20	30		CIEDRO
Cc1cc(C)c(C[NH2+][C@@H]2CCc3ccc(C#N)cc32)c(C)c1	ZINC000564419917	328083633	/nfs/dbraw/zinc/08/36/33/328083633.db2.gz	KTVQENKTFHWXQR-HXUWFJFHSA-N	1	0	290.410	4.261	20	30		CIEDRO
COc1cc(C[NH2+][C@H](C)c2cccc(C)c2C)ccc1C#N	ZINC000571096573	328085181	/nfs/dbraw/zinc/08/51/81/328085181.db2.gz	NRNAFXAQACUZKM-OAHLLOKOSA-N	1	0	294.398	4.035	20	30		CIEDRO
N#Cc1cc(C[N@H+](Cc2ccco2)C2CCCC2)ccc1F	ZINC000160904412	328093731	/nfs/dbraw/zinc/09/37/31/328093731.db2.gz	YXKLGTCHLPPIJC-UHFFFAOYSA-N	1	0	298.361	4.235	20	30		CIEDRO
C=CC[C@H](Cc1ccccc1)[NH2+][C@@H](C)c1cncc(C)c1	ZINC000414306854	328154396	/nfs/dbraw/zinc/15/43/96/328154396.db2.gz	RMBVTSQIGAVBSR-QFBILLFUSA-N	1	0	280.415	4.228	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCOC2(CCCCC2)C1)c1cccc(C#N)c1	ZINC000271862161	328198486	/nfs/dbraw/zinc/19/84/86/328198486.db2.gz	KPKVWGTUPHYBGM-QAPCUYQASA-N	1	0	298.430	4.091	20	30		CIEDRO
COc1ccc(F)cc1[C@@H](C)[NH2+]CCCCC(C)(C)C#N	ZINC000278807897	328230645	/nfs/dbraw/zinc/23/06/45/328230645.db2.gz	PAYLWQGZBUNGCX-CYBMUJFWSA-N	1	0	292.398	4.205	20	30		CIEDRO
Cc1cc([C@@H](C)[NH2+]CC2CCC(C#N)CC2)c(C)s1	ZINC000282500423	328242522	/nfs/dbraw/zinc/24/25/22/328242522.db2.gz	YBCVVCDFGSNBHF-LRVUVFPRSA-N	1	0	276.449	4.346	20	30		CIEDRO
C[C@H]([NH2+][C@H](CCCC#N)c1ccccc1)c1ccc(F)cn1	ZINC000340430907	328276693	/nfs/dbraw/zinc/27/66/93/328276693.db2.gz	IGRYFIYAIOWTRL-KBXCAEBGSA-N	1	0	297.377	4.306	20	30		CIEDRO
C[C@@H]1CCC[C@@H]1[NH2+][C@@H](CCCC#N)c1ccccc1	ZINC000340444350	328278206	/nfs/dbraw/zinc/27/82/06/328278206.db2.gz	DGRBIXXGFGBLTE-PVAVHDDUSA-N	1	0	256.393	4.200	20	30		CIEDRO
C[C@H](C[NH2+][C@H]1CC[C@@H](CC#N)C1)c1cccc(Cl)c1	ZINC000294996796	328284188	/nfs/dbraw/zinc/28/41/88/328284188.db2.gz	IATQOAOLDSVUGC-WWGRRREGSA-N	1	0	276.811	4.115	20	30		CIEDRO
Cc1c2ccccc2oc1[C@@H](C)[NH2+]Cc1ccc(C#N)cc1	ZINC000048367622	328305747	/nfs/dbraw/zinc/30/57/47/328305747.db2.gz	VECUUJNCLYXYPO-CQSZACIVSA-N	1	0	290.366	4.464	20	30		CIEDRO
C[C@H](CCc1ccccc1F)[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000531950384	328328050	/nfs/dbraw/zinc/32/80/50/328328050.db2.gz	GAUHWJMZXBXZOW-HUUCEWRRSA-N	1	0	296.389	4.369	20	30		CIEDRO
CC[C@H]([NH2+][C@@H](C)c1cccc(C#N)c1)c1cccs1	ZINC000049529576	328367938	/nfs/dbraw/zinc/36/79/38/328367938.db2.gz	XOTZOKLOPIZLID-WFASDCNBSA-N	1	0	270.401	4.422	20	30		CIEDRO
C[C@@H]1CC[N@H+](Cc2ccc(C#N)s2)[C@H]2CCCC[C@@H]12	ZINC000535072812	328384398	/nfs/dbraw/zinc/38/43/98/328384398.db2.gz	WIJQSGMEVSMVOS-KCXAZCMYSA-N	1	0	274.433	4.020	20	30		CIEDRO
C[C@@H]([NH2+]C[C@H]1CCCC1(C)C)c1cccc(C#N)c1	ZINC000389023532	328603225	/nfs/dbraw/zinc/60/32/25/328603225.db2.gz	MWWAGCLJSPIYHR-CZUORRHYSA-N	1	0	256.393	4.035	20	30		CIEDRO
CC1(C)CCCC[C@H]1[NH2+][C@H]1CCc2ccc(C#N)cc21	ZINC000564419275	328462411	/nfs/dbraw/zinc/46/24/11/328462411.db2.gz	NTTZXZDPEGFKBV-DLBZAZTESA-N	1	0	268.404	4.104	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@H]1CCSc2ccc(F)cc21	ZINC000343498039	328553492	/nfs/dbraw/zinc/55/34/92/328553492.db2.gz	GYQPJGILCAPKLN-OCCSQVGLSA-N	1	0	265.397	4.307	20	30		CIEDRO
CC(C)(C)[C@H]1CCCC[C@@H]1[NH2+]CCC(C)(C)C#N	ZINC000535664198	328607108	/nfs/dbraw/zinc/60/71/08/328607108.db2.gz	ZPTFRKGNCPCSBV-KBPBESRZSA-N	1	0	250.430	4.121	20	30		CIEDRO
C=C(C)C[NH2+][C@H](c1ccc(F)cc1)c1ccc(OC)cc1	ZINC000533377312	326824815	/nfs/dbraw/zinc/82/48/15/326824815.db2.gz	VGNRIRZAMHEOKO-GOSISDBHSA-N	1	0	285.362	4.089	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H]1CCCSc2ccc(OC)cc21	ZINC000188204968	326842072	/nfs/dbraw/zinc/84/20/72/326842072.db2.gz	WKWJPFDTRICLPE-IUODEOHRSA-N	1	0	277.433	4.176	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H]1CCO[C@@H](C(C)(C)C)C1)c1ccco1	ZINC000556886374	326978930	/nfs/dbraw/zinc/97/89/30/326978930.db2.gz	STLTUROFRJMDTI-HLLBOEOZSA-N	1	0	291.435	4.470	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@H]1CCO[C@H](C(C)(C)C)C1)c1ccco1	ZINC000556886380	326979035	/nfs/dbraw/zinc/97/90/35/326979035.db2.gz	STLTUROFRJMDTI-ZOBUZTSGSA-N	1	0	291.435	4.470	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]C1CCC(C(=O)OC(C)(C)C)CC1	ZINC000557040714	326990373	/nfs/dbraw/zinc/99/03/73/326990373.db2.gz	KQNVPAJLQWHRPE-UHFFFAOYSA-N	1	0	295.467	4.079	20	30		CIEDRO
N#CCC[C@H]([NH2+]C/C=C\c1ccccc1)c1ccccc1	ZINC000255713921	327006968	/nfs/dbraw/zinc/00/69/68/327006968.db2.gz	JYXREWJAGJKIGX-POGDKVGISA-N	1	0	276.383	4.334	20	30		CIEDRO
C[C@H](Cc1ccsc1)[NH2+][C@@H]1CCCc2cc(C#N)ccc21	ZINC000557515791	327011360	/nfs/dbraw/zinc/01/13/60/327011360.db2.gz	GKWKDDOYXJGJFZ-FZKQIMNGSA-N	1	0	296.439	4.218	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H](CC2CC2)c2ccccc2)s1	ZINC000557805934	327028321	/nfs/dbraw/zinc/02/83/21/327028321.db2.gz	WFRZXSDPMNFWHL-KRWDZBQOSA-N	1	0	282.412	4.251	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1CCc2c1cccc2Cl	ZINC000558245140	327081173	/nfs/dbraw/zinc/08/11/73/327081173.db2.gz	FQCOFYKBXAGPBX-OAHLLOKOSA-N	1	0	276.811	4.247	20	30		CIEDRO
CC(C)(C[NH2+]C1CCC(C)(C#N)CC1)Cc1ccccc1	ZINC000449147208	327094175	/nfs/dbraw/zinc/09/41/75/327094175.db2.gz	GASIABVRSCCUOI-UHFFFAOYSA-N	1	0	284.447	4.317	20	30		CIEDRO
C[C@H](CCC1CC1)[NH2+]Cc1ccc(C#N)cc1C(F)(F)F	ZINC000558575453	327106612	/nfs/dbraw/zinc/10/66/12/327106612.db2.gz	LPNFSEBPFLBXSK-LLVKDONJSA-N	1	0	296.336	4.245	20	30		CIEDRO
C=CCOCC[NH2+]C(C)(C)c1ccc(Cl)c(Cl)c1	ZINC000559144012	327143047	/nfs/dbraw/zinc/14/30/47/327143047.db2.gz	DVLPUHADISKZGQ-UHFFFAOYSA-N	1	0	288.218	4.021	20	30		CIEDRO
C[C@@H]1C[C@@H]1[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc(Cl)cc1	ZINC000559150190	327143830	/nfs/dbraw/zinc/14/38/30/327143830.db2.gz	TYLBQMMEZVATGC-CJQITXGSSA-N	1	0	288.822	4.319	20	30		CIEDRO
C[C@@H](c1cccc(C#N)c1)[N@@H+]1CC[C@H](c2ccccc2F)C1	ZINC000559299590	327156350	/nfs/dbraw/zinc/15/63/50/327156350.db2.gz	FJVGZRNLBPUOGX-YOEHRIQHSA-N	1	0	294.373	4.248	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CCc3sc(Cl)cc32)cc1	ZINC000129578060	327156764	/nfs/dbraw/zinc/15/67/64/327156764.db2.gz	ASVXJMDPRIDBRG-CYBMUJFWSA-N	1	0	288.803	4.050	20	30		CIEDRO
CCC(CC)[N@H+](CCCC1(C#N)CCOCC1)CC(C)C	ZINC000410393880	327190047	/nfs/dbraw/zinc/19/00/47/327190047.db2.gz	YVFORQKYSPPVHK-UHFFFAOYSA-N	1	0	294.483	4.234	20	30		CIEDRO
C[C@@H]([NH2+]C[C@@H]1CSc2ccccc21)c1ccc(C#N)cc1	ZINC000092274931	327191235	/nfs/dbraw/zinc/19/12/35/327191235.db2.gz	JJMCJLUPODACTI-CZUORRHYSA-N	1	0	294.423	4.098	20	30		CIEDRO
CCCCC1CCC(C[NH2+]Cc2nc(C#N)cs2)CC1	ZINC000569533249	327194497	/nfs/dbraw/zinc/19/44/97/327194497.db2.gz	CCAQOSDQZRQYLZ-UHFFFAOYSA-N	1	0	291.464	4.101	20	30		CIEDRO
C=CCCC[C@H](C)[NH+]1CCC(c2noc(C(C)C)n2)CC1	ZINC000569583203	327201310	/nfs/dbraw/zinc/20/13/10/327201310.db2.gz	JVUYTFGMTVGAGG-AWEZNQCLSA-N	1	0	291.439	4.117	20	30		CIEDRO
C=CCC1(C[NH2+]C2CCC3(CCCO3)CC2)CCCC1	ZINC000584272587	327206022	/nfs/dbraw/zinc/20/60/22/327206022.db2.gz	CVDUIRCUZBJDJA-UHFFFAOYSA-N	1	0	277.452	4.204	20	30		CIEDRO
Cc1cccc(C[NH2+][C@H](C)c2ccc(C#N)cc2)c1C	ZINC000047888099	327225007	/nfs/dbraw/zinc/22/50/07/327225007.db2.gz	FLOWSSHVQHRZKZ-OAHLLOKOSA-N	1	0	264.372	4.026	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H]1CCc2ccc(OC(F)(F)F)cc21	ZINC000537969911	327239230	/nfs/dbraw/zinc/23/92/30/327239230.db2.gz	XPSLJVAGIHJEIT-HZMBPMFUSA-N	1	0	285.309	4.127	20	30		CIEDRO
CC(C)(C#N)CC[NH2+][C@H](Cc1ccccc1)c1ccccc1	ZINC000536471582	327240679	/nfs/dbraw/zinc/24/06/79/327240679.db2.gz	KNRFCOPNQWGGNA-LJQANCHMSA-N	1	0	292.426	4.500	20	30		CIEDRO
C[C@H]([NH2+]C1(c2ccc(F)cc2)CC1)c1ccc(C#N)cc1	ZINC000538554005	327245050	/nfs/dbraw/zinc/24/50/50/327245050.db2.gz	OJEZEVLIAVSMNL-ZDUSSCGKSA-N	1	0	280.346	4.037	20	30		CIEDRO
CC(C)[C@@H]1CC[C@@H]1[NH2+][C@@H](CCCC#N)c1ccccc1	ZINC000559862225	327265817	/nfs/dbraw/zinc/26/58/17/327265817.db2.gz	BXBNMDDANZYKLA-BZSNNMDCSA-N	1	0	270.420	4.446	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H](C)CCc1ccsc1	ZINC000559879928	327266212	/nfs/dbraw/zinc/26/62/12/327266212.db2.gz	ZZKBVWZTBLOHLJ-CYBMUJFWSA-N	1	0	251.439	4.261	20	30		CIEDRO
N#CCCCC[NH2+]Cc1ccc(Oc2ccc(F)cc2)cc1	ZINC000560112560	327284523	/nfs/dbraw/zinc/28/45/23/327284523.db2.gz	YFAOWMBPZNSVCO-UHFFFAOYSA-N	1	0	298.361	4.401	20	30		CIEDRO
C[C@@H]1CC[N@H+](Cc2ccc(F)cc2C#N)[C@@H]2CCCC[C@H]12	ZINC000560342740	327300786	/nfs/dbraw/zinc/30/07/86/327300786.db2.gz	JSXXAAPHXYTZFS-FSPWUOQZSA-N	1	0	286.394	4.098	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H](C)N1CCCC[C@@H]1C)c1ccco1	ZINC000560514474	327317173	/nfs/dbraw/zinc/31/71/73/327317173.db2.gz	NNRITQMRNUXZNO-BBWFWOEESA-N	1	0	290.451	4.139	20	30		CIEDRO
C=CCC[C@@H](NCC[C@@H](C)[NH+]1CCCCC1)c1ccco1	ZINC000560549740	327323523	/nfs/dbraw/zinc/32/35/23/327323523.db2.gz	HBXZURVVBOLKON-IAGOWNOFSA-N	1	0	290.451	4.141	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H]2CCc3ccc(C)cc32)cc1	ZINC000560572235	327326627	/nfs/dbraw/zinc/32/66/27/327326627.db2.gz	BIGQVDFVUNALCY-HXUWFJFHSA-N	1	0	293.410	4.337	20	30		CIEDRO
C[C@H]1C[C@H]([NH2+]CC(C)(C)CCC#N)CC(C)(C)C1	ZINC000561443973	327395546	/nfs/dbraw/zinc/39/55/46/327395546.db2.gz	DHXIZPIIISDKGN-KBPBESRZSA-N	1	0	250.430	4.121	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)cn1)c1cc2ccccc2s1	ZINC000562043467	327442832	/nfs/dbraw/zinc/44/28/32/327442832.db2.gz	XIXRQWRWLYORIC-LBPRGKRZSA-N	1	0	293.395	4.019	20	30		CIEDRO
C=CCCCC[NH2+][C@H](C)c1ccc2ncsc2c1	ZINC000570015936	327562236	/nfs/dbraw/zinc/56/22/36/327562236.db2.gz	HDDWZAUCHGOSLB-GFCCVEGCSA-N	1	0	260.406	4.303	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000532207561	328707075	/nfs/dbraw/zinc/70/70/75/328707075.db2.gz	OSGAZYONVAZUGB-YOEHRIQHSA-N	1	0	256.393	4.344	20	30		CIEDRO
C[C@H](CCc1ccc(F)cc1)[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000532207644	328707076	/nfs/dbraw/zinc/70/70/76/328707076.db2.gz	ZCZVLCTYHYQHLS-HUUCEWRRSA-N	1	0	296.389	4.369	20	30		CIEDRO
N#Cc1ccc2c(c1)CCCC[C@H]2[NH2+]Cc1ccccc1F	ZINC000360822301	328912016	/nfs/dbraw/zinc/91/20/16/328912016.db2.gz	PVGNSKXLHAIQBA-LJQANCHMSA-N	1	0	294.373	4.255	20	30		CIEDRO
C[C@H]([NH2+]CC1CCCCCC1)c1cccc(C#N)c1	ZINC000389621719	328947621	/nfs/dbraw/zinc/94/76/21/328947621.db2.gz	ICKPFCOCTUFMQB-AWEZNQCLSA-N	1	0	256.393	4.179	20	30		CIEDRO
C[C@@H]1C[C@H](c2ccsc2)C[N@@H+]1CCCC(C)(C)C#N	ZINC000377941923	329035514	/nfs/dbraw/zinc/03/55/14/329035514.db2.gz	NBJSZLBOTJDOCT-HIFRSBDPSA-N	1	0	276.449	4.256	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H](c2ccccn2)C2CCCC2)s1	ZINC000378015596	329037249	/nfs/dbraw/zinc/03/72/49/329037249.db2.gz	ZHCLCLMOYSIPQT-KRWDZBQOSA-N	1	0	297.427	4.036	20	30		CIEDRO
C[C@@H](CCN(CCC#N)Cc1ccco1)c1ccccc1	ZINC000193602864	329059965	/nfs/dbraw/zinc/05/99/65/329059965.db2.gz	FJPVIBNDOAQLJY-INIZCTEOSA-N	1	0	282.387	4.189	20	30		CIEDRO
Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(OCC#N)cc2)cc1	ZINC000193899036	329062765	/nfs/dbraw/zinc/06/27/65/329062765.db2.gz	AOKWIGGTYCKRAA-JKSUJKDBSA-N	1	0	294.398	4.309	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H](C)c1sccc1OC	ZINC000583707612	329087143	/nfs/dbraw/zinc/08/71/43/329087143.db2.gz	IWTCURPYLMFLQK-LLVKDONJSA-N	1	0	253.411	4.010	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H](C)c1nccn1-c1ccccc1)C1CC1	ZINC000582505156	329098379	/nfs/dbraw/zinc/09/83/79/329098379.db2.gz	QXKZHJITZXJUMJ-YJBOKZPZSA-N	1	0	295.430	4.268	20	30		CIEDRO
C=CCCCCC[N@@H+](C)Cc1cc(-c2ccco2)on1	ZINC000582635828	329120033	/nfs/dbraw/zinc/12/00/33/329120033.db2.gz	ZYZOUAWPHRUZIE-UHFFFAOYSA-N	1	0	274.364	4.113	20	30		CIEDRO
N#CCC[C@@H](C#N)C[NH2+][C@H](CC1CCCC1)c1ccccc1	ZINC000514668996	329172336	/nfs/dbraw/zinc/17/23/36/329172336.db2.gz	SNZGVHKALBOBBF-PKOBYXMFSA-N	1	0	295.430	4.341	20	30		CIEDRO
C=CCN1CCC([NH2+][C@H](CC)c2ccc(Cl)cc2)CC1	ZINC000177913494	329190562	/nfs/dbraw/zinc/19/05/62/329190562.db2.gz	NKINDXADNVMHJU-QGZVFWFLSA-N	1	0	292.854	4.031	20	30		CIEDRO
Cc1cc(Cl)c2c(c1)[C@@H]([NH2+]CCCCC#N)CCCO2	ZINC000178275977	329195503	/nfs/dbraw/zinc/19/55/03/329195503.db2.gz	ZQPOHZGWUKOVOU-HNNXBMFYSA-N	1	0	292.810	4.146	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccc(C#N)cc1F)c1ccccc1	ZINC000178759737	329200153	/nfs/dbraw/zinc/20/01/53/329200153.db2.gz	ZTLIYVOLHSPRCH-IBGZPJMESA-N	1	0	294.373	4.494	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccn(C(C)C)n1)c1ccccc1	ZINC000178760813	329202525	/nfs/dbraw/zinc/20/25/25/329202525.db2.gz	QSFWBFBLIWFHBD-GOSISDBHSA-N	1	0	283.419	4.261	20	30		CIEDRO
Cc1cc(Cl)cc2c1OCCC[C@H]2[NH2+]CCCCC#N	ZINC000179108891	329205608	/nfs/dbraw/zinc/20/56/08/329205608.db2.gz	JQXCRLZQVBIPRC-OAHLLOKOSA-N	1	0	292.810	4.146	20	30		CIEDRO
CC[N@H+](Cc1ccsc1)[C@@H](C)c1ccc(C#N)cc1	ZINC000179464464	329208873	/nfs/dbraw/zinc/20/88/73/329208873.db2.gz	CLSSESBDCIYSNY-ZDUSSCGKSA-N	1	0	270.401	4.203	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCc1scnc1C)c1ccccc1	ZINC000180050528	329214928	/nfs/dbraw/zinc/21/49/28/329214928.db2.gz	HKHQMPGGYHNKJB-MRXNPFEDSA-N	1	0	286.444	4.291	20	30		CIEDRO
N#CCSCCC[NH2+][C@@H](CC1CCC1)c1ccccc1	ZINC000181360045	329232211	/nfs/dbraw/zinc/23/22/11/329232211.db2.gz	UREVENLPQWHNCP-KRWDZBQOSA-N	1	0	288.460	4.154	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCCOc2ccccc21)c1ccc(C#N)s1	ZINC000181643153	329235368	/nfs/dbraw/zinc/23/53/68/329235368.db2.gz	WJORWFZRFMVHHD-SWLSCSKDSA-N	1	0	298.411	4.184	20	30		CIEDRO
CCc1nc(C(C)C)ccc1C[NH+]1CCC(CCC#N)CC1	ZINC000582842570	329276942	/nfs/dbraw/zinc/27/69/42/329276942.db2.gz	GMOOLVSHVNCYTR-UHFFFAOYSA-N	1	0	299.462	4.283	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H](C)c1cnn(C(C)C)c1)c1ccc(C#N)cc1	ZINC000582944211	329292165	/nfs/dbraw/zinc/29/21/65/329292165.db2.gz	QNJMRNDCGSTBLE-KBXCAEBGSA-N	1	0	296.418	4.138	20	30		CIEDRO
N#CCCC1CC[NH+]([C@@H]2CCc3ccc(Cl)cc32)CC1	ZINC000583022010	329298714	/nfs/dbraw/zinc/29/87/14/329298714.db2.gz	RKBXBIPLKYUUMP-QGZVFWFLSA-N	1	0	288.822	4.343	20	30		CIEDRO
Cc1cc(C[N@@H+]2CCc3sccc3[C@H]2C)ccc1C#N	ZINC000584378273	329307141	/nfs/dbraw/zinc/30/71/41/329307141.db2.gz	DJKNRIXPQQSOCE-CYBMUJFWSA-N	1	0	282.412	4.048	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)c1ccc(C)cc1	ZINC000185812789	329329624	/nfs/dbraw/zinc/32/96/24/329329624.db2.gz	DKQZHGRZHJAYRQ-UAGQMJEPSA-N	1	0	256.393	4.118	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)c1ccc(C)cc1	ZINC000185812808	329329646	/nfs/dbraw/zinc/32/96/46/329329646.db2.gz	DKQZHGRZHJAYRQ-USXIJHARSA-N	1	0	256.393	4.118	20	30		CIEDRO
CC[N@H+](Cc1ccc(C)nc1C)[C@@H](C)c1ccc(C#N)cc1	ZINC000186741968	329348118	/nfs/dbraw/zinc/34/81/18/329348118.db2.gz	GDGGGHMRVBQKTB-INIZCTEOSA-N	1	0	293.414	4.153	20	30		CIEDRO
C[C@H]([NH2+][C@@H](CCC#N)c1ccccc1)C1CCSCC1	ZINC000187387100	329356918	/nfs/dbraw/zinc/35/69/18/329356918.db2.gz	MWAPLPTWGKNABB-YOEHRIQHSA-N	1	0	288.460	4.153	20	30		CIEDRO
C[C@H]([NH2+]CC(C)(C)CC#N)[C@@H](C)c1ccc(Cl)cc1	ZINC000459737149	329374472	/nfs/dbraw/zinc/37/44/72/329374472.db2.gz	VUWGRLDZZKEZTD-OLZOCXBDSA-N	1	0	278.827	4.361	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@@H](C)c1cnc2ccsc2c1	ZINC000393771791	329395826	/nfs/dbraw/zinc/39/58/26/329395826.db2.gz	BJUTXKUFLKECTQ-WCQYABFASA-N	1	0	260.406	4.302	20	30		CIEDRO
Cc1cc(Cl)cc(C[NH+]2CCC(CCC#N)CC2)c1	ZINC000583264040	329405383	/nfs/dbraw/zinc/40/53/83/329405383.db2.gz	CAOYMTLATBJASO-UHFFFAOYSA-N	1	0	276.811	4.164	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(CC#N)cc1)c1cccs1	ZINC000399039276	329447839	/nfs/dbraw/zinc/44/78/39/329447839.db2.gz	POICNHAHYGQCBK-HNNXBMFYSA-N	1	0	270.401	4.055	20	30		CIEDRO
Cc1[nH+]c2ccccc2c(N2CCC(CCC#N)CC2)c1C	ZINC000583319626	329450239	/nfs/dbraw/zinc/45/02/39/329450239.db2.gz	ZDQWHNUWDNHQFE-UHFFFAOYSA-N	1	0	293.414	4.372	20	30		CIEDRO
C=C(C)CC[NH+]1CCC(c2nc3ccccc3s2)CC1	ZINC000509264566	332862947	/nfs/dbraw/zinc/86/29/47/332862947.db2.gz	RGQROTRNPWRAQI-UHFFFAOYSA-N	1	0	286.444	4.442	20	30		CIEDRO
CC[C@H](C)C[C@@H](C)[NH2+]Cc1cccc(OCCCC#N)c1	ZINC000237118953	329694099	/nfs/dbraw/zinc/69/40/99/329694099.db2.gz	QNXSWCRHCSSAKB-JKSUJKDBSA-N	1	0	288.435	4.283	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(CC#N)cc1)c1ccc(C2CC2)cc1	ZINC000419341653	329718598	/nfs/dbraw/zinc/71/85/98/329718598.db2.gz	OMVSGEPPIUYMRT-HNNXBMFYSA-N	1	0	290.410	4.481	20	30		CIEDRO
CC(C)=CCC[C@@H](C)[NH2+][C@H](C)c1ccc(C#N)cc1F	ZINC000571750363	329919744	/nfs/dbraw/zinc/91/97/44/329919744.db2.gz	OYPKDIXGZMYPLL-ZIAGYGMSSA-N	1	0	274.383	4.483	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@H](C)c1ccc(OC)c(F)c1)c1ccccc1	ZINC000271414767	330080062	/nfs/dbraw/zinc/08/00/62/330080062.db2.gz	BDUIULINIWLMKU-RDTXWAMCSA-N	1	0	297.373	4.250	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@@H](C)c1cccc(OC)c1)c1ccccc1	ZINC000271534111	330081112	/nfs/dbraw/zinc/08/11/12/330081112.db2.gz	PZEKUTVTXVDTJH-HNAYVOBHSA-N	1	0	279.383	4.110	20	30		CIEDRO
C#CC[C@H]([NH2+][C@H]1CCc2c1cccc2OC)c1ccccc1	ZINC000271591914	330081164	/nfs/dbraw/zinc/08/11/64/330081164.db2.gz	YMCYHLFODRCKTP-OALUTQOASA-N	1	0	291.394	4.037	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+][C@H](C)c1nc(C(F)(F)F)cs1	ZINC000279044735	330121461	/nfs/dbraw/zinc/12/14/61/330121461.db2.gz	XWTJXHMWEFZZAH-RKDXNWHRSA-N	1	0	278.343	4.167	20	30		CIEDRO
Cc1cccc([C@@H](C)[NH2+]Cc2ccccc2C#N)c1C	ZINC000162616304	330087172	/nfs/dbraw/zinc/08/71/72/330087172.db2.gz	GYXCEJCOXHZQIV-OAHLLOKOSA-N	1	0	264.372	4.026	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C#N)s1)c1cc2c(s1)CCC2	ZINC000421871916	330100557	/nfs/dbraw/zinc/10/05/57/330100557.db2.gz	GIGRIZJLRGUOJT-SNVBAGLBSA-N	1	0	288.441	4.021	20	30		CIEDRO
CC1(C)Cc2occc2[C@H]([NH2+]Cc2ccc(C#N)s2)C1	ZINC000421880487	330102229	/nfs/dbraw/zinc/10/22/29/330102229.db2.gz	OKQVAJZDSGGXPB-CQSZACIVSA-N	1	0	286.400	4.016	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@H](CC)c1ccccc1O)c1ccccc1	ZINC000274761906	330107474	/nfs/dbraw/zinc/10/74/74/330107474.db2.gz	KKOCTBXLKKWJGP-QZTJIDSGSA-N	1	0	279.383	4.198	20	30		CIEDRO
C=CCN(Cc1ccc(C#N)o1)Cc1ccc(Cl)s1	ZINC000162788371	330114995	/nfs/dbraw/zinc/11/49/95/330114995.db2.gz	XKXDCFWXWJOHTO-UHFFFAOYSA-N	1	0	292.791	4.054	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccc(C)s1)c1ccco1	ZINC000279070118	330121528	/nfs/dbraw/zinc/12/15/28/330121528.db2.gz	ROWIHDUMMGVYEF-AWEZNQCLSA-N	1	0	261.390	4.447	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+][C@@H]1CC(C)(C)Oc2ccc(N)cc21	ZINC000423449084	330202714	/nfs/dbraw/zinc/20/27/14/330202714.db2.gz	WAAYIGDKBUQDHP-GDBMZVCRSA-N	1	0	288.435	4.205	20	30		CIEDRO
COc1ccc2cc([C@H](C)[NH2+][C@@H]3CC[C@H](C#N)C3)ccc2c1	ZINC000424119243	330245929	/nfs/dbraw/zinc/24/59/29/330245929.db2.gz	FNADGIJKDODFLX-SUNYJGFJSA-N	1	0	294.398	4.191	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@H](C)c1nc2ccccc2n1CC	ZINC000536856133	330251940	/nfs/dbraw/zinc/25/19/40/330251940.db2.gz	FLQYXESGUUQBBE-CABCVRRESA-N	1	0	285.435	4.452	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+][C@H](C)c1nc2ccccc2n1CC	ZINC000536856144	330252027	/nfs/dbraw/zinc/25/20/27/330252027.db2.gz	FLQYXESGUUQBBE-HUUCEWRRSA-N	1	0	285.435	4.452	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@@H](C)c1nc2ccccc2n1CC	ZINC000536856143	330252119	/nfs/dbraw/zinc/25/21/19/330252119.db2.gz	FLQYXESGUUQBBE-GJZGRUSLSA-N	1	0	285.435	4.452	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1cnc2ccccc2c1)C1CC1	ZINC000536857353	330252313	/nfs/dbraw/zinc/25/23/13/330252313.db2.gz	JZRIKDJERQYXCJ-KRWDZBQOSA-N	1	0	266.388	4.069	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@H]2CCc3c2cc(Cl)cc3Cl)C1	ZINC000424124120	330256512	/nfs/dbraw/zinc/25/65/12/330256512.db2.gz	LXEXNQBYFPTPMK-ISOBSLSZSA-N	1	0	295.213	4.263	20	30		CIEDRO
C=CCC1([NH2+]Cc2ccncc2Cl)CCCCC1	ZINC000527717623	330276881	/nfs/dbraw/zinc/27/68/81/330276881.db2.gz	PRQPNBXWJVXXOQ-UHFFFAOYSA-N	1	0	264.800	4.104	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@H]2CCC[C@H](c3ccccc3)CC2)C1	ZINC000527721410	330277317	/nfs/dbraw/zinc/27/73/17/330277317.db2.gz	NVVAAAWEOSQVIC-BVBHFADKSA-N	1	0	282.431	4.385	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccc(C#N)cc1)c1cc(C)ccc1C	ZINC000527817936	330282791	/nfs/dbraw/zinc/28/27/91/330282791.db2.gz	FFSAHTJKHYRLTP-LJQANCHMSA-N	1	0	278.399	4.416	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@H]2CCc3cc(F)c(Cl)cc32)C1	ZINC000527899571	330293161	/nfs/dbraw/zinc/29/31/61/330293161.db2.gz	AFKVCLVKHSEVBC-PKWAYOAASA-N	1	0	292.785	4.138	20	30		CIEDRO
C[C@@H]([NH2+][C@H](c1ccccn1)C1CCC1)c1ccc(C#N)cc1	ZINC000527962355	330300825	/nfs/dbraw/zinc/30/08/25/330300825.db2.gz	CNRLZWCHXPAYDJ-KUHUBIRLSA-N	1	0	291.398	4.145	20	30		CIEDRO
C[C@H]([NH2+][C@H](c1ccccn1)C1CCC1)c1cccc(C#N)c1	ZINC000527971284	330301507	/nfs/dbraw/zinc/30/15/07/330301507.db2.gz	ZNNSRIARKIPFID-LIRRHRJNSA-N	1	0	291.398	4.145	20	30		CIEDRO
CC[N@H+](C/C=C(/C)Cl)[C@H](C)c1ccc(C#N)cc1	ZINC000528355519	330321801	/nfs/dbraw/zinc/32/18/01/330321801.db2.gz	CDJIUQNQFCSRLD-KIWPFMIBSA-N	1	0	262.784	4.084	20	30		CIEDRO
CC[N@H+](C/C=C(\C)Cl)[C@@H](C)c1ccc(C#N)cc1	ZINC000528355520	330321905	/nfs/dbraw/zinc/32/19/05/330321905.db2.gz	CDJIUQNQFCSRLD-SRXBQZRASA-N	1	0	262.784	4.084	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@H]2CCCC[C@@H](c3ccccc3)C2)C1	ZINC000424188865	330322010	/nfs/dbraw/zinc/32/20/10/330322010.db2.gz	COXZCXMSLAVIOQ-YSHGAJCASA-N	1	0	282.431	4.385	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@@H]2CCCC[C@@H](c3ccccc3)C2)C1	ZINC000424188863	330322047	/nfs/dbraw/zinc/32/20/47/330322047.db2.gz	COXZCXMSLAVIOQ-OWYHZJEWSA-N	1	0	282.431	4.385	20	30		CIEDRO
C[C@H]([NH2+][C@@H](C)c1ccc(F)c(F)c1)c1ccc(C#N)cc1	ZINC000036953160	330322609	/nfs/dbraw/zinc/32/26/09/330322609.db2.gz	IFAPCHCZPFMSRE-RYUDHWBXSA-N	1	0	286.325	4.248	20	30		CIEDRO
C=CCCCCC[N@@H+](C)Cc1nc(C)c2ccccc2n1	ZINC000532967725	330323435	/nfs/dbraw/zinc/32/34/35/330323435.db2.gz	UASRLEWOMPBKLK-UHFFFAOYSA-N	1	0	283.419	4.116	20	30		CIEDRO
C[C@H]1C[C@@H](c2ccccc2)C[C@@H]([NH2+][C@@H]2CC[C@H](C#N)C2)C1	ZINC000424206372	330327736	/nfs/dbraw/zinc/32/77/36/330327736.db2.gz	WXPIDVLFBXHKNH-OBQKDBCYSA-N	1	0	282.431	4.241	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)CC1CCCC1)c1ccc(C#N)cc1	ZINC000533090925	330333978	/nfs/dbraw/zinc/33/39/78/330333978.db2.gz	KAPPOKDIWOBDLK-UONOGXRCSA-N	1	0	256.393	4.178	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H]2CCc3ccc(F)cc32)cc1	ZINC000106477632	330338613	/nfs/dbraw/zinc/33/86/13/330338613.db2.gz	ZVXHNQZQCVEETC-IBGZPJMESA-N	1	0	297.373	4.168	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@H]2CC[C@@H](c3ccc(Cl)cc3)C2)C1	ZINC000424317348	330339608	/nfs/dbraw/zinc/33/96/08/330339608.db2.gz	BZBJWQHGLCNEAU-JFOHDYCDSA-N	1	0	288.822	4.258	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1cc(Cl)ccc1OC	ZINC000424321166	330340165	/nfs/dbraw/zinc/34/01/65/330340165.db2.gz	GUZBARZVBFRJKD-LNSITVRQSA-N	1	0	292.810	4.082	20	30		CIEDRO
CC(C)C[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccccc1	ZINC000424325003	330341172	/nfs/dbraw/zinc/34/11/72/330341172.db2.gz	KPAHOLFYTVLDHQ-USXIJHARSA-N	1	0	256.393	4.056	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc(OC(F)F)cc1	ZINC000424324882	330341202	/nfs/dbraw/zinc/34/12/02/330341202.db2.gz	KJDPMQIOUNMAAM-LNSITVRQSA-N	1	0	294.345	4.021	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@H](c2ccccc2)C2CCCC2)C1	ZINC000424326564	330341301	/nfs/dbraw/zinc/34/13/01/330341301.db2.gz	MDKYSCMHMHQAAF-FHLIZLRMSA-N	1	0	268.404	4.200	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)C1	ZINC000424325958	330341333	/nfs/dbraw/zinc/34/13/33/330341333.db2.gz	LKIDIBYTBKKBJK-IUIKQTSFSA-N	1	0	274.795	4.073	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1cc2cc(Cl)ccc2o1	ZINC000424327586	330341581	/nfs/dbraw/zinc/34/15/81/330341581.db2.gz	MXQAIPGTVFSZLH-UHIISALHSA-N	1	0	288.778	4.429	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@@H](c2ccccc2F)C2CCCC2)C1	ZINC000424328782	330341757	/nfs/dbraw/zinc/34/17/57/330341757.db2.gz	OOBXXOCHCGRDMV-JCKWVBRZSA-N	1	0	286.394	4.339	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@H](c2cccs2)C2CCCC2)C1	ZINC000424330751	330342150	/nfs/dbraw/zinc/34/21/50/330342150.db2.gz	RAOKWTKOYMZZAF-INWMFGNUSA-N	1	0	274.433	4.261	20	30		CIEDRO
Cc1ccc([C@H]([NH2+][C@@H]2CC[C@H](C#N)C2)C2CCC2)cc1	ZINC000424334520	330343026	/nfs/dbraw/zinc/34/30/26/330343026.db2.gz	VSAQFBBCDIDWAU-BMGDILEWSA-N	1	0	268.404	4.118	20	30		CIEDRO
COc1ccc([C@H](C)[NH2+]CC(C)(C)CCC#N)c(Cl)c1	ZINC000424342024	330344145	/nfs/dbraw/zinc/34/41/45/330344145.db2.gz	CBGJYCGPLVBMTM-LBPRGKRZSA-N	1	0	294.826	4.329	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCc1cccc2cccnc21)C1CC1	ZINC000533362352	330359825	/nfs/dbraw/zinc/35/98/25/330359825.db2.gz	SYJHRVUAKQHKCB-SFHVURJKSA-N	1	0	280.415	4.112	20	30		CIEDRO
Cc1ccc(C[N@@H+](C)[C@H](C)c2ccc(C#N)cc2)s1	ZINC000118397281	330367124	/nfs/dbraw/zinc/36/71/24/330367124.db2.gz	MCCLLJAEBKUGPL-CYBMUJFWSA-N	1	0	270.401	4.121	20	30		CIEDRO
C[C@@H]([NH2+]Cc1cccc(C#N)c1)c1ccc(Cl)c(F)c1	ZINC000213687082	330371221	/nfs/dbraw/zinc/37/12/21/330371221.db2.gz	IVDWVJRWSWWUQA-LLVKDONJSA-N	1	0	288.753	4.202	20	30		CIEDRO
CC(C)c1ccc(C[N@H+](C)Cc2cccc(C#N)c2)cc1	ZINC000057382001	330374600	/nfs/dbraw/zinc/37/46/00/330374600.db2.gz	IZAAASNTLYVRFP-UHFFFAOYSA-N	1	0	278.399	4.314	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(-c2ccccc2C#N)cc1)C1CC1	ZINC000537012444	330378905	/nfs/dbraw/zinc/37/89/05/330378905.db2.gz	RIOSALFJXWXUIX-AWEZNQCLSA-N	1	0	276.383	4.113	20	30		CIEDRO
CC(C)Oc1ccccc1[C@H](C)[NH2+]CCCC(C)(C)C#N	ZINC000537023128	330384646	/nfs/dbraw/zinc/38/46/46/330384646.db2.gz	MMHDWGLRECMMMU-HNNXBMFYSA-N	1	0	288.435	4.454	20	30		CIEDRO
COc1ccc([C@@H]2CCCCC[N@@H+]2CCCCC#N)cc1	ZINC000120072021	330385468	/nfs/dbraw/zinc/38/54/68/330385468.db2.gz	OKAXVIOSHFBGOB-SFHVURJKSA-N	1	0	286.419	4.306	20	30		CIEDRO
COc1cc(C#N)ccc1C[NH2+][C@H](c1ccccc1)C(C)C	ZINC000120547143	330389467	/nfs/dbraw/zinc/38/94/67/330389467.db2.gz	DJEBRURDSMDMOC-IBGZPJMESA-N	1	0	294.398	4.054	20	30		CIEDRO
CC[N@H+](CCc1cccs1)[C@@H](C)c1ccc(C#N)cc1	ZINC000120956975	330393743	/nfs/dbraw/zinc/39/37/43/330393743.db2.gz	JXWGEWASQBRBDY-AWEZNQCLSA-N	1	0	284.428	4.245	20	30		CIEDRO
C=C(C)C[N@@H+](C)[C@@H](C)c1sc(C(C)C)nc1C	ZINC000120976395	330393871	/nfs/dbraw/zinc/39/38/71/330393871.db2.gz	VFRSSRKJDGHCAB-LBPRGKRZSA-N	1	0	252.427	4.144	20	30		CIEDRO
C=C(C)C[N@@H+](C)[C@H](C)c1sc(C(C)C)nc1C	ZINC000120976219	330393954	/nfs/dbraw/zinc/39/39/54/330393954.db2.gz	VFRSSRKJDGHCAB-GFCCVEGCSA-N	1	0	252.427	4.144	20	30		CIEDRO
C[C@@H]1C[C@@H](c2ccccc2)C[N@@H+]1Cc1cccc(C#N)c1F	ZINC000537048290	330394600	/nfs/dbraw/zinc/39/46/00/330394600.db2.gz	YEXJQZBVYNRSHQ-RDTXWAMCSA-N	1	0	294.373	4.075	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](CCC#N)c1ccccc1)c1ccccc1	ZINC000090665182	330394623	/nfs/dbraw/zinc/39/46/23/330394623.db2.gz	KUQRXSULWZNTBY-QAPCUYQASA-N	1	0	264.372	4.382	20	30		CIEDRO
C[C@@H]([NH2+][C@H](CCC#N)c1ccccc1)C1CCCC1	ZINC000090665088	330394657	/nfs/dbraw/zinc/39/46/57/330394657.db2.gz	AAKSCFIQSXJTEZ-RHSMWYFYSA-N	1	0	256.393	4.200	20	30		CIEDRO
C=CCCC[N@@H+](C)[C@@H](C)c1nnc(-c2ccc(C)cc2)o1	ZINC000121146354	330395490	/nfs/dbraw/zinc/39/54/90/330395490.db2.gz	YHFASALYYGLCIB-AWEZNQCLSA-N	1	0	285.391	4.004	20	30		CIEDRO
C=CC[C@H](CO)C[NH2+][C@@H](C)c1ccc(-c2ccccc2)cc1	ZINC000537092731	330398510	/nfs/dbraw/zinc/39/85/10/330398510.db2.gz	GQCHRPANVQDFDT-IRXDYDNUSA-N	1	0	295.426	4.189	20	30		CIEDRO
C=CC[C@H](CO)C[NH2+][C@H](C)c1cccc(-c2ccccc2)c1	ZINC000537094394	330398549	/nfs/dbraw/zinc/39/85/49/330398549.db2.gz	CDAHWYUVRWJZCG-SJORKVTESA-N	1	0	295.426	4.189	20	30		CIEDRO
CC[C@@H](C)[C@@H]([NH2+]CCCC#N)c1ccc(Cl)cc1	ZINC000537093411	330398578	/nfs/dbraw/zinc/39/85/78/330398578.db2.gz	LVZXLNSOXNIHGH-IUODEOHRSA-N	1	0	264.800	4.321	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1c2ccccc2C[C@H]1C)c1cccc(C#N)c1	ZINC000537305568	330432073	/nfs/dbraw/zinc/43/20/73/330432073.db2.gz	YKTDALXZHXCEPS-TYILLQQXSA-N	1	0	276.383	4.142	20	30		CIEDRO
C=C[C@@H](C)[NH2+]Cc1ccc(F)c(-c2cccs2)c1	ZINC000123194858	330455037	/nfs/dbraw/zinc/45/50/37/330455037.db2.gz	GZHQMEFUZXVJSY-LLVKDONJSA-N	1	0	261.365	4.218	20	30		CIEDRO
C[C@@H]([NH2+]C(C1CCC1)C1CCC1)c1ccc(C#N)cc1	ZINC000312383487	330462922	/nfs/dbraw/zinc/46/29/22/330462922.db2.gz	NNYJGXAAEQGCSU-CYBMUJFWSA-N	1	0	268.404	4.178	20	30		CIEDRO
C=CCCCCC[NH2+]Cc1ncc(C(C)C)s1	ZINC000514739734	330464082	/nfs/dbraw/zinc/46/40/82/330464082.db2.gz	WGCLSZNDCMTOMN-UHFFFAOYSA-N	1	0	252.427	4.103	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+][C@H]2CCCc3sc(Cl)cc32)C1	ZINC000426329539	330504432	/nfs/dbraw/zinc/50/44/32/330504432.db2.gz	GXBYUBKBXHTJAD-WZRBSPASSA-N	1	0	294.851	4.451	20	30		CIEDRO
C/C(=C\c1ccc(Cl)cc1)C[NH2+]CC1(CC#N)CC1	ZINC000430016441	330557441	/nfs/dbraw/zinc/55/74/41/330557441.db2.gz	FSJFBEWEEQBOIO-JLHYYAGUSA-N	1	0	274.795	4.027	20	30		CIEDRO
CC(C)[C@@H]([NH2+]CC1(CC#N)CC1)c1ccc(Cl)cc1F	ZINC000430731551	330571806	/nfs/dbraw/zinc/57/18/06/330571806.db2.gz	WMURUKPWUPDFCG-OAHLLOKOSA-N	1	0	294.801	4.460	20	30		CIEDRO
Cc1ccccc1[C@@H](CC(C)C)[NH2+]CC1(CC#N)CC1	ZINC000430748115	330572786	/nfs/dbraw/zinc/57/27/86/330572786.db2.gz	BURWLBJAPBDENC-QGZVFWFLSA-N	1	0	270.420	4.366	20	30		CIEDRO
C[C@H]([NH2+]CC1(CC#N)CC1)c1cc(Cl)sc1Cl	ZINC000430752348	330573173	/nfs/dbraw/zinc/57/31/73/330573173.db2.gz	CBQRRGFNFTXXBC-QMMMGPOBSA-N	1	0	289.231	4.399	20	30		CIEDRO
Cc1ncsc1CC[NH2+][C@H](CCCC#N)c1ccccc1	ZINC000433016998	330612202	/nfs/dbraw/zinc/61/22/02/330612202.db2.gz	WKDUCURCWMJPMC-MRXNPFEDSA-N	1	0	299.443	4.019	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+][C@H](CCC)c1ccccc1	ZINC000436292000	330673894	/nfs/dbraw/zinc/67/38/94/330673894.db2.gz	RNRNCNHKODUHRC-KSZLIROESA-N	1	0	273.420	4.099	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+]C1CCC(c2ccccc2)CC1	ZINC000436291604	330673904	/nfs/dbraw/zinc/67/39/04/330673904.db2.gz	LUJNEYXBOXOUCN-NBDWZHNGSA-N	1	0	299.458	4.284	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CC1(c2ccccc2OC)CC1)C1CC1	ZINC000438986922	330731927	/nfs/dbraw/zinc/73/19/27/330731927.db2.gz	RTLJJWRBIOMWED-QGZVFWFLSA-N	1	0	285.431	4.061	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccccc1OC(F)F)C1CC1	ZINC000439078435	330733497	/nfs/dbraw/zinc/73/34/97/330733497.db2.gz	QHTZIWQNNMERLL-CQSZACIVSA-N	1	0	281.346	4.122	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCSc1ccccc1)C1CC1	ZINC000439088132	330733609	/nfs/dbraw/zinc/73/36/09/330733609.db2.gz	PXVSYFXPZBGYBL-MRXNPFEDSA-N	1	0	261.434	4.113	20	30		CIEDRO
N#CC1CCC(C[NH2+][C@@H]2CCC[C@@H](C(F)(F)F)C2)CC1	ZINC000441332248	330765859	/nfs/dbraw/zinc/76/58/59/330765859.db2.gz	JQUWWZMUNXPKHO-NWINJMCUSA-N	1	0	288.357	4.027	20	30		CIEDRO
N#CC1CCC(C[NH2+]Cc2cccc(Cl)c2Cl)CC1	ZINC000441350531	330766333	/nfs/dbraw/zinc/76/63/33/330766333.db2.gz	BKWSMBMGVLDPMG-UHFFFAOYSA-N	1	0	297.229	4.413	20	30		CIEDRO
Cc1ccc2[nH]c(C[NH2+]CC3CCC(C#N)CC3)cc2c1C	ZINC000441373790	330767018	/nfs/dbraw/zinc/76/70/18/330767018.db2.gz	FKOVLEVIZOFRJB-UHFFFAOYSA-N	1	0	295.430	4.204	20	30		CIEDRO
C=C(C[NH2+]C1CCC(C(F)F)CC1)c1ccccc1	ZINC000442761000	330781371	/nfs/dbraw/zinc/78/13/71/330781371.db2.gz	BBSQKKYNLYYQMO-UHFFFAOYSA-N	1	0	265.347	4.113	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@H]2CCCC[C@@H]2Cc2ccccc2)C1	ZINC000442774234	330781879	/nfs/dbraw/zinc/78/18/79/330781879.db2.gz	DOYVEKBFFCMGIX-YRXWBPOGSA-N	1	0	282.431	4.070	20	30		CIEDRO
CC(C)(C)[C@H]([NH2+][C@@H]1CC[C@@H](C#N)C1)c1ccc(F)cc1F	ZINC000442784490	330782983	/nfs/dbraw/zinc/78/29/83/330782983.db2.gz	SZDFIBGTVBSVCY-AXAPSJFSSA-N	1	0	292.373	4.334	20	30		CIEDRO
CC(C)(C)[C@H]([NH2+][C@H]1CC[C@H](C#N)C1)c1ccc(F)cc1F	ZINC000442784493	330783091	/nfs/dbraw/zinc/78/30/91/330783091.db2.gz	SZDFIBGTVBSVCY-DETPVDSQSA-N	1	0	292.373	4.334	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+]Cc2ccc(OC3CCCCC3)cc2)C1	ZINC000442787873	330783509	/nfs/dbraw/zinc/78/35/09/330783509.db2.gz	DWRFTFXNTDHKKS-DLBZAZTESA-N	1	0	298.430	4.180	20	30		CIEDRO
CC(C)c1ccc2c(c1)[C@H]([NH2+][C@H]1CC[C@@H](C#N)C1)CCC2	ZINC000442823074	330785642	/nfs/dbraw/zinc/78/56/42/330785642.db2.gz	YUOLZJVGJWCVCN-DKSSEZFCSA-N	1	0	282.431	4.469	20	30		CIEDRO
Cc1cccc(C2([NH2+][C@@H]3CC[C@@H](C#N)C3)CCCC2)c1	ZINC000442823438	330785661	/nfs/dbraw/zinc/78/56/61/330785661.db2.gz	DCXAYHMBXQIXAJ-NVXWUHKLSA-N	1	0	268.404	4.046	20	30		CIEDRO
CC(C)(C[NH2+][C@H]1CC[C@@H](C#N)C1)c1cccc(Cl)c1F	ZINC000442853355	330787121	/nfs/dbraw/zinc/78/71/21/330787121.db2.gz	ZHYSGOKRBYQCEL-NEPJUHHUSA-N	1	0	294.801	4.039	20	30		CIEDRO
CSc1ccccc1[C@@H](C)[NH2+]CC1CCC(C#N)CC1	ZINC000442858879	330787730	/nfs/dbraw/zinc/78/77/30/330787730.db2.gz	TUBPLMGTCYSYKC-WLYUNCDWSA-N	1	0	288.460	4.389	20	30		CIEDRO
Cc1ccccc1[C@H](CC(F)(F)F)[NH2+][C@@H]1CC[C@@H](C#N)C1	ZINC000442861360	330787867	/nfs/dbraw/zinc/78/78/67/330787867.db2.gz	XUAMVZQNXMRUHL-NFAWXSAZSA-N	1	0	296.336	4.270	20	30		CIEDRO
CC[C@@H]([NH2+]CC1CCC(C#N)CC1)c1cccc(OC)c1	ZINC000442872718	330789172	/nfs/dbraw/zinc/78/91/72/330789172.db2.gz	ZBXUWSSWVQSMGW-JTTJXQCZSA-N	1	0	286.419	4.066	20	30		CIEDRO
CC[C@@H]1CC[C@@H](C)C[C@H]1[NH2+]CC1CCC(C#N)CC1	ZINC000442875949	330789738	/nfs/dbraw/zinc/78/97/38/330789738.db2.gz	XGIDYBVKKKVFLN-PYVGIJRLSA-N	1	0	262.441	4.121	20	30		CIEDRO
N#CC1CCC(C[NH2+][C@@H]2CCCc3ccc(F)cc32)CC1	ZINC000442877447	330789862	/nfs/dbraw/zinc/78/98/62/330789862.db2.gz	ZJVNLTVDEWPXCM-WTNGLUPJSA-N	1	0	286.394	4.123	20	30		CIEDRO
C[C@H](CC[NH2+]CC(C)(C)CCC#N)CC(C)(C)C	ZINC000443009031	330792812	/nfs/dbraw/zinc/79/28/12/330792812.db2.gz	IWWYEYDCAMNXJH-CQSZACIVSA-N	1	0	252.446	4.368	20	30		CIEDRO
CC[C@H]([NH2+]CCCCC(C)(C)C#N)c1ccc(OC)cc1	ZINC000444686881	330819400	/nfs/dbraw/zinc/81/94/00/330819400.db2.gz	YCQIXQQJQBFTRK-KRWDZBQOSA-N	1	0	288.435	4.456	20	30		CIEDRO
C=CCCCCC[NH2+][C@H](C)c1cccc(NC(C)=O)c1	ZINC000194358957	330842042	/nfs/dbraw/zinc/84/20/42/330842042.db2.gz	PSSRXULBFYYQAX-CQSZACIVSA-N	1	0	274.408	4.042	20	30		CIEDRO
N#Cc1cc(C[NH2+][C@@H]2CCC[C@@H]2c2ccccc2)ccc1F	ZINC000446001862	330842470	/nfs/dbraw/zinc/84/24/70/330842470.db2.gz	BYGSLVFNRLZKGP-IEBWSBKVSA-N	1	0	294.373	4.123	20	30		CIEDRO
C=C(C)COCC[NH2+][C@@H](C)c1cc(Cl)ccc1Cl	ZINC000159479365	330848240	/nfs/dbraw/zinc/84/82/40/330848240.db2.gz	WENOIZGYPQAUAW-NSHDSACASA-N	1	0	288.218	4.237	20	30		CIEDRO
CC[C@@H]([NH2+]CCC1=CCCCC1)c1ccc(C#N)cc1	ZINC000447522133	330867778	/nfs/dbraw/zinc/86/77/78/330867778.db2.gz	XYEFLHOOEMTUMQ-GOSISDBHSA-N	1	0	268.404	4.489	20	30		CIEDRO
CC[C@H]([NH2+]C[C@H]1CCc2ccccc21)c1ccc(C#N)cc1	ZINC000447525526	330867836	/nfs/dbraw/zinc/86/78/36/330867836.db2.gz	AIUDWVQIGKSKPJ-QUCCMNQESA-N	1	0	290.410	4.329	20	30		CIEDRO
CCSCC[C@H](C)[NH2+][C@H](CC)c1ccc(C#N)cc1	ZINC000447525937	330867861	/nfs/dbraw/zinc/86/78/61/330867861.db2.gz	BLQYUGWBFPUHOB-XJKSGUPXSA-N	1	0	276.449	4.131	20	30		CIEDRO
CC[C@@H]([NH2+]C/C=C\c1ccccc1)c1ccc(C#N)cc1	ZINC000447529196	330867966	/nfs/dbraw/zinc/86/79/66/330867966.db2.gz	JNNRFYZPKNZULB-WMHRWZGDSA-N	1	0	276.383	4.312	20	30		CIEDRO
CC(C)(C)[C@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1ccccc1	ZINC000447531512	330868109	/nfs/dbraw/zinc/86/81/09/330868109.db2.gz	PWMDEEUWJZQKLG-BHYGNILZSA-N	1	0	270.420	4.446	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(-c3ccccc3)o2)C1	ZINC000447562551	330869994	/nfs/dbraw/zinc/86/99/94/330869994.db2.gz	MCCJEZZJALMBHZ-GDBMZVCRSA-N	1	0	280.371	4.119	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CC[C@H](C)CC1)c1ccc(C#N)cc1	ZINC000447584116	330871504	/nfs/dbraw/zinc/87/15/04/330871504.db2.gz	DWTYTACTVBWLNE-JQFCIGGWSA-N	1	0	256.393	4.178	20	30		CIEDRO
Cc1cc([C@H]([NH2+][C@H]2CCC[C@H](C#N)C2)C2CC2)ccc1F	ZINC000447586940	330871686	/nfs/dbraw/zinc/87/16/86/330871686.db2.gz	OETVCZQKHQTQIW-QANKJYHBSA-N	1	0	286.394	4.257	20	30		CIEDRO
COc1ccc(C)cc1[C@H](C)[NH2+]C1CCC(C)(C#N)CC1	ZINC000449066858	330896738	/nfs/dbraw/zinc/89/67/38/330896738.db2.gz	GICCCNVTJAZTGM-SYJJWHGVSA-N	1	0	286.419	4.127	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@H]2CCc3c2cccc3Cl)CC1	ZINC000449098695	330898927	/nfs/dbraw/zinc/89/89/27/330898927.db2.gz	QPCIUJUWMULGQM-PDOTXMHQSA-N	1	0	288.822	4.389	20	30		CIEDRO
CC1(C#N)CCC([NH2+]Cc2ccccc2C(F)(F)F)CC1	ZINC000449107340	330899485	/nfs/dbraw/zinc/89/94/85/330899485.db2.gz	PKVNKIISGMDNET-UHFFFAOYSA-N	1	0	296.336	4.267	20	30		CIEDRO
N#CCCCC[NH2+][C@@H]1CC[C@H](c2ccc(Cl)cc2)C1	ZINC000449131152	330900881	/nfs/dbraw/zinc/90/08/81/330900881.db2.gz	KKAPEIADAMAAMK-GOEBONIOSA-N	1	0	276.811	4.260	20	30		CIEDRO
CC1(C#N)CCC([NH2+]Cc2ccccc2OC2CCC2)CC1	ZINC000449139773	330901393	/nfs/dbraw/zinc/90/13/93/330901393.db2.gz	HHHFUAMPJKRNMG-UHFFFAOYSA-N	1	0	298.430	4.180	20	30		CIEDRO
CC1(C#N)CCC([NH2+]Cc2ccccc2OCC2CC2)CC1	ZINC000449155518	330902260	/nfs/dbraw/zinc/90/22/60/330902260.db2.gz	LTHVNIBIMUQLJS-UHFFFAOYSA-N	1	0	298.430	4.037	20	30		CIEDRO
C[C@H](C[NH2+]C1CCC(C)(C#N)CC1)Sc1ccccc1	ZINC000449169193	330903173	/nfs/dbraw/zinc/90/31/73/330903173.db2.gz	CSXMJLNFZZMUQT-HPUBIQBYSA-N	1	0	288.460	4.229	20	30		CIEDRO
C[C@@H]([NH2+]C1CCC(C)(C#N)CC1)[C@@H](C)c1ccccc1	ZINC000449178303	330903886	/nfs/dbraw/zinc/90/38/86/330903886.db2.gz	RZHFJQABEDLNQX-RCDYEMGKSA-N	1	0	270.420	4.241	20	30		CIEDRO
CC(C)(C#N)C[NH2+][C@@H]1CC[C@@H](c2ccc(Cl)cc2)C1	ZINC000449241068	330908998	/nfs/dbraw/zinc/90/89/98/330908998.db2.gz	QVIHRFPZQKGQNL-UKRRQHHQSA-N	1	0	276.811	4.115	20	30		CIEDRO
CC[C@H](CC#N)[NH2+][C@H]1CC[C@H](c2ccc(Cl)cc2)C1	ZINC000449245240	330909254	/nfs/dbraw/zinc/90/92/54/330909254.db2.gz	ZMUPRJWWTCPBEB-IMJJTQAJSA-N	1	0	276.811	4.258	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@H]2CC[C@@H](Cc3ccccc3)C2)CC1	ZINC000449266309	330910828	/nfs/dbraw/zinc/91/08/28/330910828.db2.gz	VADNWYRYHOEKSI-IQNGYNMSSA-N	1	0	296.458	4.460	20	30		CIEDRO
CC(C)N(C)c1ccccc1C[NH2+]C1CCC(C)(C#N)CC1	ZINC000449265809	330910927	/nfs/dbraw/zinc/91/09/27/330910927.db2.gz	RQADJPNULPLUJX-UHFFFAOYSA-N	1	0	299.462	4.093	20	30		CIEDRO
CSCc1ccc(C[NH2+]C2CCC(C)(C#N)CC2)cc1	ZINC000449323355	330914621	/nfs/dbraw/zinc/91/46/21/330914621.db2.gz	UOTSWBOWHMCLMU-UHFFFAOYSA-N	1	0	288.460	4.112	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCCc3c(F)cc(F)cc32)C1	ZINC000449352757	330917785	/nfs/dbraw/zinc/91/77/85/330917785.db2.gz	WGXWTQGMELCFHS-CJBNDPTMSA-N	1	0	290.357	4.014	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+]C[C@@H]1CSc2ccccc21	ZINC000449367332	330919224	/nfs/dbraw/zinc/91/92/24/330919224.db2.gz	VIPSNGBDCOHSIE-BFHYXJOUSA-N	1	0	261.434	4.066	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+]CC(C)(C)c1ccccn1	ZINC000449395822	330922195	/nfs/dbraw/zinc/92/21/95/330922195.db2.gz	WEEWCVUMQBBJLT-OAHLLOKOSA-N	1	0	260.425	4.084	20	30		CIEDRO
CC(C)(C)C1CCC([NH2+][C@H]2CC[C@@H](CC#N)C2)CC1	ZINC000449445202	330926157	/nfs/dbraw/zinc/92/61/57/330926157.db2.gz	HPWUPQGXEOBIPD-LBDPXKHJSA-N	1	0	262.441	4.263	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+]C2CC(c3cccc(Cl)c3)C2)C1	ZINC000449446136	330926194	/nfs/dbraw/zinc/92/61/94/330926194.db2.gz	NXZOFXNTPYYRAL-OKKATSDQSA-N	1	0	288.822	4.258	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+]Cc2cc(Cl)sc2Cl)C1	ZINC000449445709	330926283	/nfs/dbraw/zinc/92/62/83/330926283.db2.gz	LGUNITUQLODOEF-WPRPVWTQSA-N	1	0	289.231	4.227	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@@H](c2ccc(F)c(Cl)c2)C2CC2)C1	ZINC000449448792	330926566	/nfs/dbraw/zinc/92/65/66/330926566.db2.gz	JFJFXONVQPSCLU-AKWBHNSASA-N	1	0	292.785	4.212	20	30		CIEDRO
C=CC(C)(C)C[NH2+]C/C(C)=C/c1ccccc1COC	ZINC000449486087	330929985	/nfs/dbraw/zinc/92/99/85/330929985.db2.gz	QDHRWPIKXGQODG-RVDMUPIBSA-N	1	0	273.420	4.038	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+]Cc1noc(-c2cccs2)n1	ZINC000449557991	330936544	/nfs/dbraw/zinc/93/65/44/330936544.db2.gz	VNMBFAJSBCEHCI-LBPRGKRZSA-N	1	0	291.420	4.023	20	30		CIEDRO
C=CCC1([NH2+]Cc2scnc2C2CC2)CCCCC1	ZINC000449577263	330938471	/nfs/dbraw/zinc/93/84/71/330938471.db2.gz	WBDSHGVQQKYOIX-UHFFFAOYSA-N	1	0	276.449	4.389	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+]C[C@@H]2CCCC[C@H]2c2ccccc2)C1	ZINC000449691122	330943789	/nfs/dbraw/zinc/94/37/89/330943789.db2.gz	UMUMZWCQEIZTDZ-BVBHFADKSA-N	1	0	282.431	4.242	20	30		CIEDRO
CC[C@H]([NH2+]CC1(C#N)CCC1)C(C)(C)c1ccccc1	ZINC000450689639	330993851	/nfs/dbraw/zinc/99/38/51/330993851.db2.gz	SWHFZGVVZUZQAQ-INIZCTEOSA-N	1	0	270.420	4.026	20	30		CIEDRO
N#CC1(C[NH+]2CCC(c3cccc(Cl)c3)CC2)CCC1	ZINC000450891296	331005205	/nfs/dbraw/zinc/00/52/05/331005205.db2.gz	JPKGDYBXBBZOCA-UHFFFAOYSA-N	1	0	288.822	4.213	20	30		CIEDRO
C[C@H]([NH2+]CC1(C#N)CCC1)c1ccc(F)c2ccccc21	ZINC000451035257	331012743	/nfs/dbraw/zinc/01/27/43/331012743.db2.gz	FPOVFYBKGCGAET-ZDUSSCGKSA-N	1	0	282.362	4.323	20	30		CIEDRO
C[C@H](CCCC(F)(F)F)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000163285549	331015529	/nfs/dbraw/zinc/01/55/29/331015529.db2.gz	MQOLOQAYPPDBCZ-NEPJUHHUSA-N	1	0	284.325	4.330	20	30		CIEDRO
CC(C)C[C@]1(C)CCC[N@@H+]1CCCC(C)(C)C#N	ZINC000451287947	331023322	/nfs/dbraw/zinc/02/33/22/331023322.db2.gz	HDRMIZRMNOWPSW-INIZCTEOSA-N	1	0	250.430	4.217	20	30		CIEDRO
C=C(C)COCC[NH2+][C@H](C)c1ccc(C(C)C)cc1	ZINC000163520397	331049944	/nfs/dbraw/zinc/04/99/44/331049944.db2.gz	TZJFALVIGPIHGO-OAHLLOKOSA-N	1	0	261.409	4.053	20	30		CIEDRO
C=C(C[NH2+][C@@H](C)CCCc1cccnc1)c1ccccc1	ZINC000453095132	331088588	/nfs/dbraw/zinc/08/85/88/331088588.db2.gz	XZZWFGPSDQKTAK-KRWDZBQOSA-N	1	0	280.415	4.096	20	30		CIEDRO
C[C@H](CCCc1cccnc1)[NH2+][C@@H](C)c1cccc(C#N)c1	ZINC000453124629	331091659	/nfs/dbraw/zinc/09/16/59/331091659.db2.gz	SBRVUFMLTMGHKG-CVEARBPZSA-N	1	0	293.414	4.015	20	30		CIEDRO
CC[C@H]([NH2+][C@@H](CCC#N)c1ccccc1)c1ccncc1	ZINC000453183520	331098214	/nfs/dbraw/zinc/09/82/14/331098214.db2.gz	YVAKNYJWULEPKL-ROUUACIJSA-N	1	0	279.387	4.167	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@H]1CSc2ccccc21)C1CC1	ZINC000453218516	331102830	/nfs/dbraw/zinc/10/28/30/331102830.db2.gz	JWVPPRFQFXCIHG-HOCLYGCPSA-N	1	0	273.445	4.210	20	30		CIEDRO
Cc1cc([C@H](C)[NH2+]CC(C)(C)CCC#N)cs1	ZINC000453219205	331102889	/nfs/dbraw/zinc/10/28/89/331102889.db2.gz	IYTPKYGKEJEDSP-LBPRGKRZSA-N	1	0	250.411	4.037	20	30		CIEDRO
C[C@@H]([NH2+]C[C@H]1CSc2ccccc21)c1cccc(C#N)c1	ZINC000453223797	331103538	/nfs/dbraw/zinc/10/35/38/331103538.db2.gz	SVTODTJBZVGVCT-CJNGLKHVSA-N	1	0	294.423	4.098	20	30		CIEDRO
Cc1cc([C@@H](C)[NH2+][C@H]2CCc3ccc(C#N)cc32)ccc1F	ZINC000453265146	331109187	/nfs/dbraw/zinc/10/91/87/331109187.db2.gz	XGEPFIIJNFBWID-YJYMSZOUSA-N	1	0	294.373	4.344	20	30		CIEDRO
CCCc1ccc([C@@H](C)[NH2+][C@H]2CC[C@@H](CC#N)C2)cc1	ZINC000453285618	331111171	/nfs/dbraw/zinc/11/11/71/331111171.db2.gz	CCXYZROSBPYQSZ-HFTRVMKXSA-N	1	0	270.420	4.372	20	30		CIEDRO
CC1(C)CC[C@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)c2ccccc21	ZINC000453289788	331111606	/nfs/dbraw/zinc/11/16/06/331111606.db2.gz	JAPWRQICGUAWNX-MPGHIAIKSA-N	1	0	282.431	4.471	20	30		CIEDRO
Cc1ccc([C@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)C2CCC2)o1	ZINC000453296946	331112473	/nfs/dbraw/zinc/11/24/73/331112473.db2.gz	UZHFBXHVWHSHOE-JLJPHGGASA-N	1	0	272.392	4.101	20	30		CIEDRO
COc1ccc2c(c1)C(C)(C)C[C@@H]2[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000453297911	331112605	/nfs/dbraw/zinc/11/26/05/331112605.db2.gz	WQJXMPFIAKXVFT-DEYYWGMASA-N	1	0	298.430	4.090	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@H](c1ccc2[nH]c(=O)oc2c1)C(C)C	ZINC000453303239	331113632	/nfs/dbraw/zinc/11/36/32/331113632.db2.gz	BVDIKRMEMLWNCJ-HNNXBMFYSA-N	1	0	288.391	4.032	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@H](C[C@H]1CCOC1)c1ccc(F)cc1	ZINC000453312162	331114965	/nfs/dbraw/zinc/11/49/65/331114965.db2.gz	UUSROAAWXIEVAP-RHSMWYFYSA-N	1	0	291.410	4.095	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H]1CCO[C@@H](C(C)C)C1)c1ccco1	ZINC000453318008	331115862	/nfs/dbraw/zinc/11/58/62/331115862.db2.gz	KQJPNQXJQMDAOB-SOLBZPMBSA-N	1	0	291.435	4.328	20	30		CIEDRO
CC1(C)Cc2ccsc2C[N@@H+]1Cc1ccc(C#N)s1	ZINC000453613895	331136527	/nfs/dbraw/zinc/13/65/27/331136527.db2.gz	CIEIUJWBLGNCPW-UHFFFAOYSA-N	1	0	288.441	4.018	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](C)c1cc2cccc(OC)c2o1	ZINC000164630075	331269220	/nfs/dbraw/zinc/26/92/20/331269220.db2.gz	CZVHQKIVGNEDKG-VXGBXAGGSA-N	1	0	259.349	4.057	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)c1cc2cccc(OC)c2o1	ZINC000164629959	331269271	/nfs/dbraw/zinc/26/92/71/331269271.db2.gz	CZVHQKIVGNEDKG-NWDGAFQWSA-N	1	0	259.349	4.057	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@H](C)CC(=O)Nc1cccc(Cl)c1	ZINC000467411189	331280948	/nfs/dbraw/zinc/28/09/48/331280948.db2.gz	BGBMLFOUUHRTMS-TZMCWYRMSA-N	1	0	294.826	4.001	20	30		CIEDRO
N#CCCC[C@H]([NH2+]C1CC2(CCC2)C1)c1ccccc1	ZINC000459590497	331289762	/nfs/dbraw/zinc/28/97/62/331289762.db2.gz	NABLRTPFAHLRAB-KRWDZBQOSA-N	1	0	268.404	4.344	20	30		CIEDRO
C=CCCCCC[NH2+][C@@H](C)c1nc2c(s1)CCC2	ZINC000459632878	331291378	/nfs/dbraw/zinc/29/13/78/331291378.db2.gz	OCMMFDJEMWCJPB-LBPRGKRZSA-N	1	0	264.438	4.029	20	30		CIEDRO
CC(C)(CC#N)C[NH2+]Cc1c(Cl)cccc1Cl	ZINC000459698682	331294947	/nfs/dbraw/zinc/29/49/47/331294947.db2.gz	QXZVBPHZQMYCNF-UHFFFAOYSA-N	1	0	271.191	4.023	20	30		CIEDRO
C[N@H+](CCC(C)(C)C#N)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000459699020	331294983	/nfs/dbraw/zinc/29/49/83/331294983.db2.gz	LMZUISNZDMSVFQ-DLBZAZTESA-N	1	0	270.420	4.194	20	30		CIEDRO
C[C@H]([NH2+]CC(C)(C)CC#N)c1ccc(Br)cc1	ZINC000459731479	331296524	/nfs/dbraw/zinc/29/65/24/331296524.db2.gz	NQWSHEANGPEAFY-NSHDSACASA-N	1	0	295.224	4.040	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+]C[C@@H](c1ccc(C)o1)N1CCCC1	ZINC000461886440	331315078	/nfs/dbraw/zinc/31/50/78/331315078.db2.gz	UKHPGXAYWOHERA-SJORKVTESA-N	1	0	290.451	4.059	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1	ZINC000461887825	331315146	/nfs/dbraw/zinc/31/51/46/331315146.db2.gz	ZZNMPJRKGPRACX-AWEZNQCLSA-N	1	0	266.473	4.020	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+]CCc1c[nH]c2cc(F)ccc12	ZINC000462040196	331316863	/nfs/dbraw/zinc/31/68/63/331316863.db2.gz	LRZGNSKCYYUUHY-OAHLLOKOSA-N	1	0	274.383	4.184	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@@H](COC)c1ccc(C)o1	ZINC000462115991	331317274	/nfs/dbraw/zinc/31/72/74/331317274.db2.gz	FSGDJUBLNSREQN-GJZGRUSLSA-N	1	0	265.397	4.000	20	30		CIEDRO
CC#CCC[N@H+](C)[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000462323212	331319500	/nfs/dbraw/zinc/31/95/00/331319500.db2.gz	GSOHXJXQEDXHSN-GFCCVEGCSA-N	1	0	269.310	4.112	20	30		CIEDRO
C[C@@H]1CCCc2ccccc2[C@H]1[NH2+]Cc1cccc(C#N)c1	ZINC000462544886	331323379	/nfs/dbraw/zinc/32/33/79/331323379.db2.gz	OJAIDWOOCJXSFR-QRWLVFNGSA-N	1	0	290.410	4.362	20	30		CIEDRO
C[C@H](CCc1ccsc1)[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000462795377	331329476	/nfs/dbraw/zinc/32/94/76/331329476.db2.gz	AWPFCJBQXJYPSB-ZIAGYGMSSA-N	1	0	284.428	4.292	20	30		CIEDRO
C=Cc1ccc(CC[NH2+][C@@H](C)c2ccc(C#N)c(F)c2)cc1	ZINC000462803145	331329697	/nfs/dbraw/zinc/32/96/97/331329697.db2.gz	BESXAITWTOLGDH-AWEZNQCLSA-N	1	0	294.373	4.234	20	30		CIEDRO
C=C[C@@H](C)[NH2+][C@H](C)CC(C)(C)c1c[nH]c2ccccc21	ZINC000462808552	331330088	/nfs/dbraw/zinc/33/00/88/331330088.db2.gz	DHZCGJIQDNSFEY-ZIAGYGMSSA-N	1	0	270.420	4.388	20	30		CIEDRO
C=C[C@@H](C)[NH2+][C@@H](C)CC(C)(C)c1c[nH]c2ccccc21	ZINC000462808550	331330162	/nfs/dbraw/zinc/33/01/62/331330162.db2.gz	DHZCGJIQDNSFEY-KGLIPLIRSA-N	1	0	270.420	4.388	20	30		CIEDRO
C=C[C@@H](C)[NH2+][C@H](C)c1csc(-c2ccccc2F)n1	ZINC000462817561	331330905	/nfs/dbraw/zinc/33/09/05/331330905.db2.gz	OHDMOUIEEUPURL-GHMZBOCLSA-N	1	0	276.380	4.174	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+]Cc1ccc(C(F)F)cc1	ZINC000462836825	331332192	/nfs/dbraw/zinc/33/21/92/331332192.db2.gz	UHRRTZQJJXNVPS-RYUDHWBXSA-N	1	0	253.336	4.315	20	30		CIEDRO
CCC[C@H](CCc1ccccc1)[NH2+][C@H]1CCC[C@H](C#N)C1	ZINC000463236185	331343373	/nfs/dbraw/zinc/34/33/73/331343373.db2.gz	KFZZSXZVZUHTJS-OTWHNJEPSA-N	1	0	284.447	4.460	20	30		CIEDRO
CCC[C@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)c1ccc(F)cc1F	ZINC000463244274	331343963	/nfs/dbraw/zinc/34/39/63/331343963.db2.gz	WOBPOCDSFBAXBX-MRRJBJDNSA-N	1	0	292.373	4.478	20	30		CIEDRO
Cc1ccc([C@H]([NH2+][C@@H]2CCC[C@@H](C#N)C2)C2CC2)cc1	ZINC000463277967	331344845	/nfs/dbraw/zinc/34/48/45/331344845.db2.gz	AVOYQPAFXRTURC-OLMNPRSZSA-N	1	0	268.404	4.118	20	30		CIEDRO
Cc1ccc([C@H]([NH2+][C@H]2CCC[C@H](C#N)C2)C2CC2)cc1	ZINC000463277969	331344866	/nfs/dbraw/zinc/34/48/66/331344866.db2.gz	AVOYQPAFXRTURC-WBAXXEDZSA-N	1	0	268.404	4.118	20	30		CIEDRO
CC(C)[C@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)c1ccccc1	ZINC000463278484	331344898	/nfs/dbraw/zinc/34/48/98/331344898.db2.gz	CKALYZMKLRCTCY-UAGQMJEPSA-N	1	0	256.393	4.056	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+]CCCCCc2ccccc2)C1	ZINC000463285295	331345103	/nfs/dbraw/zinc/34/51/03/331345103.db2.gz	SPSVYODLNIGNGJ-ROUUACIJSA-N	1	0	270.420	4.071	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+]CCCCCc2ccccc2)C1	ZINC000463285294	331345187	/nfs/dbraw/zinc/34/51/87/331345187.db2.gz	SPSVYODLNIGNGJ-QZTJIDSGSA-N	1	0	270.420	4.071	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+]CCc2cc(Cl)cc(Cl)c2)C1	ZINC000463287214	331345231	/nfs/dbraw/zinc/34/52/31/331345231.db2.gz	JHLDKFOADFWLAI-DOMZBBRYSA-N	1	0	297.229	4.208	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+]CCc2cc(Cl)cc(Cl)c2)C1	ZINC000463287217	331345250	/nfs/dbraw/zinc/34/52/50/331345250.db2.gz	JHLDKFOADFWLAI-SWLSCSKDSA-N	1	0	297.229	4.208	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+]CC2(c3ccccc3)CCCC2)C1	ZINC000463301472	331345813	/nfs/dbraw/zinc/34/58/13/331345813.db2.gz	MNWASBAWIHKZAM-FUHWJXTLSA-N	1	0	282.431	4.170	20	30		CIEDRO
Cc1oc2ccccc2c1CC[NH2+]Cc1ccc(C#N)s1	ZINC000463709577	331350837	/nfs/dbraw/zinc/35/08/37/331350837.db2.gz	FJRQTVBXHBBJLC-UHFFFAOYSA-N	1	0	296.395	4.007	20	30		CIEDRO
CCC1(CC)C[N@@H+]([C@@H](C)c2ccc(C#N)cc2)CCS1	ZINC000464570122	331362802	/nfs/dbraw/zinc/36/28/02/331362802.db2.gz	AKVIMYLAOSGIAV-AWEZNQCLSA-N	1	0	288.460	4.227	20	30		CIEDRO
CC[C@]1(C)CCC[N@@H+]([C@H](C)c2ccc(C#N)cc2)C1	ZINC000464778345	331367525	/nfs/dbraw/zinc/36/75/25/331367525.db2.gz	NRDIBKPXOMNIQC-RHSMWYFYSA-N	1	0	256.393	4.131	20	30		CIEDRO
CC[N@H+](CCCCC#N)[C@H](Cc1ccc(F)cc1)C(C)C	ZINC000464777242	331367721	/nfs/dbraw/zinc/36/77/21/331367721.db2.gz	UUORIAIWAOJWMI-GOSISDBHSA-N	1	0	290.426	4.409	20	30		CIEDRO
N#C[C@H](c1ccccc1)[C@@H]1CCC[N@@H+]1CCc1ccccc1	ZINC000464814127	331369423	/nfs/dbraw/zinc/36/94/23/331369423.db2.gz	KXCZFGUUOMDIAC-UXHICEINSA-N	1	0	290.410	4.001	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1cc(Cl)c(OCC)c(OC)c1	ZINC000466397419	331394908	/nfs/dbraw/zinc/39/49/08/331394908.db2.gz	DLWMKSTYKMRNPZ-CYBMUJFWSA-N	1	0	297.826	4.192	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1cccc(OCC(F)(F)F)c1	ZINC000466400781	331394932	/nfs/dbraw/zinc/39/49/32/331394932.db2.gz	WRRXXTLEMQFNIK-CYBMUJFWSA-N	1	0	287.325	4.072	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]CC1CCC(C(F)(F)F)CC1	ZINC000466403798	331395182	/nfs/dbraw/zinc/39/51/82/331395182.db2.gz	JLXCUIDSXFMUCV-BPCQOVAHSA-N	1	0	263.347	4.299	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1cnc(-c2ccccc2)s1	ZINC000466403070	331395243	/nfs/dbraw/zinc/39/52/43/331395243.db2.gz	BVXUKIVALQIHHU-AWEZNQCLSA-N	1	0	272.417	4.254	20	30		CIEDRO
Cc1ccccc1[C@H]1C[C@H]([NH2+]Cc2ccc(C#N)cc2F)C1	ZINC000466404643	331395325	/nfs/dbraw/zinc/39/53/25/331395325.db2.gz	LAPOOMLPDLJVDE-QAQDUYKDSA-N	1	0	294.373	4.042	20	30		CIEDRO
N#Cc1cccc(CC[NH2+][C@H]2CC[C@H](c3ccccc3)C2)c1	ZINC000466426672	331396767	/nfs/dbraw/zinc/39/67/67/331396767.db2.gz	WKASIABLWWBJEK-PMACEKPBSA-N	1	0	290.410	4.027	20	30		CIEDRO
N#Cc1cccc(CC[NH2+][C@H]2CC[C@@H](c3ccccc3)C2)c1	ZINC000466426673	331396777	/nfs/dbraw/zinc/39/67/77/331396777.db2.gz	WKASIABLWWBJEK-UXHICEINSA-N	1	0	290.410	4.027	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@@H](C)c1nc2c(s1)CCCC2	ZINC000467413810	331418217	/nfs/dbraw/zinc/41/82/17/331418217.db2.gz	ZFFZHORVXQOTGV-RYUDHWBXSA-N	1	0	264.438	4.027	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@@H](C)c1sc(CC)nc1C	ZINC000467416071	331418301	/nfs/dbraw/zinc/41/83/01/331418301.db2.gz	GKGRXKIDYREUKR-CMPLNLGQSA-N	1	0	252.427	4.019	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]C1CCC(C#N)(c2ccccc2)CC1	ZINC000467415936	331418302	/nfs/dbraw/zinc/41/83/02/331418302.db2.gz	GBEWRZNRNOMQCW-LMDPOFIKSA-N	1	0	282.431	4.335	20	30		CIEDRO
CC[C@H]([NH2+]CCc1cccc(C#N)c1)C1CCCCC1	ZINC000467431776	331418821	/nfs/dbraw/zinc/41/88/21/331418821.db2.gz	DTFLCEJMGPYQEU-SFHVURJKSA-N	1	0	270.420	4.049	20	30		CIEDRO
Cc1ccc([C@@H]([NH2+]CCc2cccc(C#N)c2)C2CCC2)o1	ZINC000467448747	331419977	/nfs/dbraw/zinc/41/99/77/331419977.db2.gz	MXGSVWBFFHVBSM-IBGZPJMESA-N	1	0	294.398	4.133	20	30		CIEDRO
Cc1cccc([C@@H](C)[NH2+]CCc2cccc(C#N)c2)c1C	ZINC000467461963	331420487	/nfs/dbraw/zinc/42/04/87/331420487.db2.gz	ZRCDFTSKIXMCBW-MRXNPFEDSA-N	1	0	278.399	4.068	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+]Cc1cccc(-c2cccnc2)c1	ZINC000467641939	331422962	/nfs/dbraw/zinc/42/29/62/331422962.db2.gz	VXVWDJDJOGEHBE-OAHLLOKOSA-N	1	0	266.388	4.193	20	30		CIEDRO
Cc1ccc([C@@H]2CCC[C@@H]2[NH2+]Cc2cccc(C#N)c2)cc1	ZINC000468363841	331432911	/nfs/dbraw/zinc/43/29/11/331432911.db2.gz	WUFJYXTTXAKVIX-PMACEKPBSA-N	1	0	290.410	4.293	20	30		CIEDRO
CC(C)[C@@H](C[NH2+]Cc1ccc(C#N)s1)Cc1ccccc1	ZINC000469199815	331447577	/nfs/dbraw/zinc/44/75/77/331447577.db2.gz	OGASMVVGUAYIDA-MRXNPFEDSA-N	1	0	298.455	4.224	20	30		CIEDRO
C=CCOCCC[NH2+][C@@H](C)c1cc(Cl)ccc1Cl	ZINC000470774783	331490702	/nfs/dbraw/zinc/49/07/02/331490702.db2.gz	UOXUOLCBHDZKDU-NSHDSACASA-N	1	0	288.218	4.237	20	30		CIEDRO
CC(C)[C@H]([NH2+][C@H]1CC[C@H](C#N)C1)c1ccccc1Cl	ZINC000471586232	331510987	/nfs/dbraw/zinc/51/09/87/331510987.db2.gz	CFSVVQUWFHCEJM-XEZPLFJOSA-N	1	0	276.811	4.319	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@H](C)[C@H](c1ccccc1)N(C)C	ZINC000471583653	331511017	/nfs/dbraw/zinc/51/10/17/331511017.db2.gz	AVXNUVFWXAKBAR-BPQIPLTHSA-N	1	0	274.452	4.012	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000471583654	331511030	/nfs/dbraw/zinc/51/10/30/331511030.db2.gz	AVXNUVFWXAKBAR-NJAFHUGGSA-N	1	0	274.452	4.012	20	30		CIEDRO
C[C@H](CC(C)(C)c1ccccc1)[NH2+][C@@H]1CC[C@@H](C#N)C1	ZINC000471582577	331511035	/nfs/dbraw/zinc/51/10/35/331511035.db2.gz	XEVOVJAXODBGFW-BFYDXBDKSA-N	1	0	270.420	4.025	20	30		CIEDRO
C=CCCCC[NH2+][C@H](C)c1ccc(SC)c(OC)c1	ZINC000471596732	331511928	/nfs/dbraw/zinc/51/19/28/331511928.db2.gz	MBHGVUPYYQNPBF-CYBMUJFWSA-N	1	0	279.449	4.424	20	30		CIEDRO
CCC(C)(C)C1CCC([NH2+][C@@H]2CC[C@H](C#N)C2)CC1	ZINC000471596396	331512076	/nfs/dbraw/zinc/51/20/76/331512076.db2.gz	LGGALTPRLNEGNH-SLTXQBBLSA-N	1	0	262.441	4.263	20	30		CIEDRO
C=CCCCC[NH2+][C@@H]1CC2(CCC2)Oc2ccccc21	ZINC000471598670	331512260	/nfs/dbraw/zinc/51/22/60/331512260.db2.gz	LQCCHDRKIZKUAN-MRXNPFEDSA-N	1	0	271.404	4.379	20	30		CIEDRO
C[C@H](Cc1c(Cl)cccc1Cl)[NH2+][C@H]1CC[C@H](C#N)C1	ZINC000471614645	331513333	/nfs/dbraw/zinc/51/33/33/331513333.db2.gz	NCAJICUCRGJCMP-WOPDTQHZSA-N	1	0	297.229	4.206	20	30		CIEDRO
C=CCCCC[NH2+][C@@H](c1ccccc1)c1ccc(F)cn1	ZINC000471619443	331513709	/nfs/dbraw/zinc/51/37/09/331513709.db2.gz	MYWGFUBQUIZZQX-SFHVURJKSA-N	1	0	284.378	4.256	20	30		CIEDRO
C=CCCCC[NH2+]Cc1ccc(OCc2ccncc2)cc1	ZINC000472056276	331527837	/nfs/dbraw/zinc/52/78/37/331527837.db2.gz	SVLCHYKOIKWZKI-UHFFFAOYSA-N	1	0	296.414	4.107	20	30		CIEDRO
C=CCCCC[NH2+]Cc1cccc(-c2ccccn2)c1	ZINC000472070553	331528640	/nfs/dbraw/zinc/52/86/40/331528640.db2.gz	SIJFHIONDLPCSS-UHFFFAOYSA-N	1	0	266.388	4.195	20	30		CIEDRO
CC[C@H](CC#N)[NH2+][C@@H](C)[C@@H](C)c1ccc(Cl)cc1	ZINC000474930878	331604906	/nfs/dbraw/zinc/60/49/06/331604906.db2.gz	SPQCBAJAJXGGRB-TYNCELHUSA-N	1	0	264.800	4.114	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@@H]2CCC[C@@H]2c2ccccc2)c1F	ZINC000475204832	331618260	/nfs/dbraw/zinc/61/82/60/331618260.db2.gz	JSMLZHMAFMSWMV-QZTJIDSGSA-N	1	0	294.373	4.123	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@H]1CCO[C@@H]1c1ccccc1)C1CC1	ZINC000477930261	331694728	/nfs/dbraw/zinc/69/47/28/331694728.db2.gz	NSJCACHLWGLNOO-CEXWTWQISA-N	1	0	285.431	4.099	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C#N)o1)C1(c2ccccc2)CCCC1	ZINC000479588060	331739216	/nfs/dbraw/zinc/73/92/16/331739216.db2.gz	GEGNALHDVZUWBK-OAHLLOKOSA-N	1	0	294.398	4.141	20	30		CIEDRO
C=C(C[NH2+][C@H](C)c1ccc(Cl)cn1)c1ccccc1	ZINC000480184097	331762006	/nfs/dbraw/zinc/76/20/06/331762006.db2.gz	QXZPGKBWBADNQX-CYBMUJFWSA-N	1	0	272.779	4.099	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@@H](C)Cc1cccc(O)c1	ZINC000482514009	331836123	/nfs/dbraw/zinc/83/61/23/331836123.db2.gz	XTGKRZXZEFPHED-HOCLYGCPSA-N	1	0	261.409	4.048	20	30		CIEDRO
C[C@]1([NH2+]Cc2ccc(F)c(C#N)c2)CCCc2ccccc21	ZINC000483828495	331885464	/nfs/dbraw/zinc/88/54/64/331885464.db2.gz	GSJKEWHPHHRVER-IBGZPJMESA-N	1	0	294.373	4.039	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CCC[C@H]2c2ccccc2)cc1F	ZINC000483973873	331890297	/nfs/dbraw/zinc/89/02/97/331890297.db2.gz	CIAVBBXCMICGFJ-PKOBYXMFSA-N	1	0	294.373	4.123	20	30		CIEDRO
N#Cc1csc(C[NH2+][C@H]2CCC[C@H](c3ccccc3)C2)c1	ZINC000486896138	331948644	/nfs/dbraw/zinc/94/86/44/331948644.db2.gz	DWEJAGWDZICQSI-IRXDYDNUSA-N	1	0	296.439	4.436	20	30		CIEDRO
C=C(C[NH2+]Cc1cc(Cl)cs1)c1ccccc1	ZINC000486953740	331951868	/nfs/dbraw/zinc/95/18/68/331951868.db2.gz	GJVBLFQTGUSCQE-UHFFFAOYSA-N	1	0	263.793	4.205	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@H]1CCSC1)c1ccccc1	ZINC000487554901	331974195	/nfs/dbraw/zinc/97/41/95/331974195.db2.gz	UDECDVSSAJVADO-GDBMZVCRSA-N	1	0	261.434	4.037	20	30		CIEDRO
Cc1cccc([C@@H](C)[NH2+]Cc2ccc(C#N)c(C)c2)c1C	ZINC000488099152	331989923	/nfs/dbraw/zinc/98/99/23/331989923.db2.gz	CQKTVJLPZHHRTH-MRXNPFEDSA-N	1	0	278.399	4.334	20	30		CIEDRO
C=CCCCCC[NH2+][C@H](C[C@@H]1CCOC1)c1ccccc1	ZINC000488134025	331991654	/nfs/dbraw/zinc/99/16/54/331991654.db2.gz	ZOJRROPXSXAYHO-PKOBYXMFSA-N	1	0	287.447	4.490	20	30		CIEDRO
C=C(C[NH2+][C@@H]1CS[C@@H](C(C)(C)C)C1)c1ccccc1	ZINC000488432079	332007639	/nfs/dbraw/zinc/00/76/39/332007639.db2.gz	LILVFGRVDUUIIC-JKSUJKDBSA-N	1	0	275.461	4.210	20	30		CIEDRO
C[C@@H](c1ccc2c(c1)CCC2)[N@H+](C)Cc1ccc(C#N)cc1	ZINC000488440622	332008936	/nfs/dbraw/zinc/00/89/36/332008936.db2.gz	BODALNKLVJPKER-HNNXBMFYSA-N	1	0	290.410	4.240	20	30		CIEDRO
Cc1cc(C[N@H+](C)Cc2cc3ccccc3o2)ccc1C#N	ZINC000488447720	332009908	/nfs/dbraw/zinc/00/99/08/332009908.db2.gz	XGEXCHGSSMGYNC-UHFFFAOYSA-N	1	0	290.366	4.245	20	30		CIEDRO
CC[C@H](c1ccc(Cl)cc1)[N@H+](CC)C[C@H](C)C#N	ZINC000488614569	332020203	/nfs/dbraw/zinc/02/02/03/332020203.db2.gz	BCSPGZODMDNBCB-IUODEOHRSA-N	1	0	264.800	4.273	20	30		CIEDRO
Cc1cc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2(C)C)ccc1C#N	ZINC000489016661	332037443	/nfs/dbraw/zinc/03/74/43/332037443.db2.gz	UTLNMZXDQPZWHN-CQSZACIVSA-N	1	0	296.336	4.030	20	30		CIEDRO
Cc1cc(C[N@@H+]2CC[C@H](C(F)(F)F)C2(C)C)ccc1C#N	ZINC000489016660	332037766	/nfs/dbraw/zinc/03/77/66/332037766.db2.gz	UTLNMZXDQPZWHN-AWEZNQCLSA-N	1	0	296.336	4.030	20	30		CIEDRO
C=CCCCCC[NH+]1CCC(c2ncc(C)s2)CC1	ZINC000489017826	332037947	/nfs/dbraw/zinc/03/79/47/332037947.db2.gz	URHAELTXXPWEST-UHFFFAOYSA-N	1	0	278.465	4.377	20	30		CIEDRO
C[C@H](c1cccc(C#N)c1)[NH+]1CCC(c2ccccc2)CC1	ZINC000489123522	332041889	/nfs/dbraw/zinc/04/18/89/332041889.db2.gz	OBXWVRGUVOPZGP-MRXNPFEDSA-N	1	0	290.410	4.499	20	30		CIEDRO
C=C[C@@H]1CCCC[N@H+]1Cc1cc(-c2ccc(F)cc2)no1	ZINC000489485836	332055658	/nfs/dbraw/zinc/05/56/58/332055658.db2.gz	STHGNBBJEBTNNG-OAHLLOKOSA-N	1	0	286.350	4.021	20	30		CIEDRO
C[N@H+](CCC1CCCCC1)Cc1ccc(F)cc1C#N	ZINC000489566764	332059718	/nfs/dbraw/zinc/05/97/18/332059718.db2.gz	NIUHOJPUHLXJJB-UHFFFAOYSA-N	1	0	274.383	4.100	20	30		CIEDRO
C[C@H](c1ccccc1)N(Cc1ccc(F)cc1C#N)C1CC1	ZINC000489580633	332060273	/nfs/dbraw/zinc/06/02/73/332060273.db2.gz	VTVOBSXMPZXSLQ-CQSZACIVSA-N	1	0	294.373	4.423	20	30		CIEDRO
C[C@H](c1cccc(C#N)c1)[N@@H+]1CC[C@@H](c2cccc(F)c2)C1	ZINC000489879863	332071477	/nfs/dbraw/zinc/07/14/77/332071477.db2.gz	FOAPPVANGLPVMF-RDTXWAMCSA-N	1	0	294.373	4.248	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]C[C@@H]1CCCCC(F)(F)C1	ZINC000491595995	332242097	/nfs/dbraw/zinc/24/20/97/332242097.db2.gz	GKIBWLACQXYAHJ-CYBMUJFWSA-N	1	0	272.383	4.122	20	30		CIEDRO
C=CCCC[N@@H+](C)Cc1ccc(OCc2ccncc2)cc1	ZINC000172323740	335101042	/nfs/dbraw/zinc/10/10/42/335101042.db2.gz	CRNNRUFHFLOXDT-UHFFFAOYSA-N	1	0	296.414	4.059	20	30		CIEDRO
Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C#N)c(C)c1)CCC2	ZINC000492356857	332393963	/nfs/dbraw/zinc/39/39/63/332393963.db2.gz	LOURLNCEXAMBDL-HXUWFJFHSA-N	1	0	290.410	4.342	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H]1CCO[C@H]1c1ccc(F)c(F)c1	ZINC000493928537	332458548	/nfs/dbraw/zinc/45/85/48/332458548.db2.gz	UOZAZNNHDIDISH-ZLIFDBKOSA-N	1	0	295.373	4.129	20	30		CIEDRO
C=CCCCC[NH2+][C@@H](C[C@H]1CCOC1)c1ccc(F)cc1	ZINC000494975898	332496468	/nfs/dbraw/zinc/49/64/68/332496468.db2.gz	FIHIXXJILNQHGQ-QAPCUYQASA-N	1	0	291.410	4.239	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@@H](C)c1nc2c(s1)CCC2	ZINC000502016712	332644757	/nfs/dbraw/zinc/64/47/57/332644757.db2.gz	KMZMPCBWJMNMGW-STQMWFEESA-N	1	0	278.465	4.417	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](C)c1nc2c(s1)CCC2	ZINC000502021674	332645678	/nfs/dbraw/zinc/64/56/78/332645678.db2.gz	ZIJBREPBKJPLGJ-NWDGAFQWSA-N	1	0	264.438	4.027	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@H]1CCCC12CCOCC2	ZINC000502352135	332654638	/nfs/dbraw/zinc/65/46/38/332654638.db2.gz	HJZRBHVWSIQGPW-HOTGVXAUSA-N	1	0	265.441	4.060	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@@H]1CCCC[C@H]1OC(F)F	ZINC000503901652	332698263	/nfs/dbraw/zinc/69/82/63/332698263.db2.gz	JRTXBJZPWAWKHS-BFHYXJOUSA-N	1	0	275.383	4.261	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1ccc(Br)s1	ZINC000308665381	332698655	/nfs/dbraw/zinc/69/86/55/332698655.db2.gz	SENFJKWSCWDESA-VIFPVBQESA-N	1	0	274.227	4.127	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc2occc2c1)c1ccc(C#N)cc1	ZINC000512106113	332953961	/nfs/dbraw/zinc/95/39/61/332953961.db2.gz	NQJWUQLTERXKOI-ZDUSSCGKSA-N	1	0	276.339	4.155	20	30		CIEDRO
C=C(C)C[NH2+]Cc1ccc(-c2ccccc2)cc1OC	ZINC000512370254	332965120	/nfs/dbraw/zinc/96/51/20/332965120.db2.gz	NSSDAHHNBLLQRQ-UHFFFAOYSA-N	1	0	267.372	4.028	20	30		CIEDRO
C=C[C@@H](C)[NH2+]Cc1ccc(-c2ccccc2)cc1OC	ZINC000512395835	332966848	/nfs/dbraw/zinc/96/68/48/332966848.db2.gz	BWAAGADKICBZMA-CQSZACIVSA-N	1	0	267.372	4.026	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]Cc2cccc3cc[nH]c32)cc1	ZINC000512577006	332973830	/nfs/dbraw/zinc/97/38/30/332973830.db2.gz	GKXDQGPZVKHOIU-UHFFFAOYSA-N	1	0	292.382	4.023	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(Cl)s1)c1ccc(C#N)cc1F	ZINC000512622459	332976489	/nfs/dbraw/zinc/97/64/89/332976489.db2.gz	AYRXUMFVBHZPMR-SECBINFHSA-N	1	0	294.782	4.263	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCc2c1cccc2F)c1ccc(C#N)cc1F	ZINC000512630811	332976682	/nfs/dbraw/zinc/97/66/82/332976682.db2.gz	OGSGPGIRBADBAP-VOJFVSQTSA-N	1	0	298.336	4.175	20	30		CIEDRO
C[C@H]([NH2+]CC(C)(C)c1ccccc1)c1ccc(C#N)cc1F	ZINC000512654457	332978064	/nfs/dbraw/zinc/97/80/64/332978064.db2.gz	MJNQCDAGMQMNBH-AWEZNQCLSA-N	1	0	296.389	4.326	20	30		CIEDRO
CC[C@@H]1CCC[C@H]([NH2+][C@@H](C)c2ccc(C#N)cc2F)C1	ZINC000512666745	332979082	/nfs/dbraw/zinc/97/90/82/332979082.db2.gz	LXPQFOYZDLXXGP-GUTXKFCHSA-N	1	0	274.383	4.317	20	30		CIEDRO
COc1cccc([C@@H](C)[NH2+][C@@H](C)c2ccc(C#N)cc2F)c1	ZINC000512668300	332979188	/nfs/dbraw/zinc/97/91/88/332979188.db2.gz	ULAWYHADKUFLHM-OLZOCXBDSA-N	1	0	298.361	4.118	20	30		CIEDRO
C=CCOc1cccc(C[NH2+]CC2(C(F)(F)F)CCC2)c1	ZINC000512982942	332996942	/nfs/dbraw/zinc/99/69/42/332996942.db2.gz	JMBXVZJOCXFZHW-UHFFFAOYSA-N	1	0	299.336	4.074	20	30		CIEDRO
CC(C)(CCC#N)C[NH+]1CCC2(CCCCC2)CC1	ZINC000513122061	333005422	/nfs/dbraw/zinc/00/54/22/333005422.db2.gz	LDVRBZWNQHCYEJ-UHFFFAOYSA-N	1	0	262.441	4.363	20	30		CIEDRO
CC[N@H+](CCCC(C)(C)C#N)Cc1ccccc1C	ZINC000174819495	333008048	/nfs/dbraw/zinc/00/80/48/333008048.db2.gz	IRPYNAVKAIVACQ-UHFFFAOYSA-N	1	0	258.409	4.147	20	30		CIEDRO
CC(C)(C#N)CCC[N@H+](CC1CCCCC1)C1CC1	ZINC000174830270	333008370	/nfs/dbraw/zinc/00/83/70/333008370.db2.gz	GOZTZTKACAHFOZ-UHFFFAOYSA-N	1	0	262.441	4.361	20	30		CIEDRO
C[N@H+](CCCC(C)(C)C#N)CCc1ccc(Cl)cc1	ZINC000174862124	333009204	/nfs/dbraw/zinc/00/92/04/333009204.db2.gz	KSDHADNQXLBIOS-UHFFFAOYSA-N	1	0	278.827	4.144	20	30		CIEDRO
CCC[N@H+](CCCC(C)(C)C#N)CCc1cccc(F)c1	ZINC000174862155	333009236	/nfs/dbraw/zinc/00/92/36/333009236.db2.gz	PRJLYRCKEVWYPI-UHFFFAOYSA-N	1	0	290.426	4.410	20	30		CIEDRO
Cc1ccc(C[C@H]2CCC[N@@H+]2CCCC(C)(C)C#N)cc1	ZINC000174862053	333009461	/nfs/dbraw/zinc/00/94/61/333009461.db2.gz	KRZLNLJNVXSAPW-GOSISDBHSA-N	1	0	284.447	4.332	20	30		CIEDRO
C[C@@H]1C[C@@H](c2ccccc2)[N@H+](Cc2ccc(CC#N)cc2)C1	ZINC000513247342	333010895	/nfs/dbraw/zinc/01/08/95/333010895.db2.gz	NJUXCHIDYRSKLQ-UZLBHIALSA-N	1	0	290.410	4.336	20	30		CIEDRO
C[C@H]1C[C@H](c2ccccc2)[N@H+](Cc2cccc(C#N)c2F)C1	ZINC000513272932	333011707	/nfs/dbraw/zinc/01/17/07/333011707.db2.gz	UJZRIPBHXNOIFB-KBXCAEBGSA-N	1	0	294.373	4.280	20	30		CIEDRO
C[C@@H]1C[C@H]([NH2+]Cc2ccc(C#N)c(F)c2)c2ccccc21	ZINC000404577443	333015201	/nfs/dbraw/zinc/01/52/01/333015201.db2.gz	SFLGEMLFFQNQEG-XIKOKIGWSA-N	1	0	280.346	4.035	20	30		CIEDRO
CN(Cc1cc2ccccc2o1)Cc1cc(C#N)ccc1F	ZINC000175197273	333016776	/nfs/dbraw/zinc/01/67/76/333016776.db2.gz	IYAONUZFOFHLEP-UHFFFAOYSA-N	1	0	294.329	4.076	20	30		CIEDRO
Cc1ccc([C@@H]2CCC[N@@H+]2Cc2cccc(C#N)c2)s1	ZINC000513479975	333021970	/nfs/dbraw/zinc/02/19/70/333021970.db2.gz	UPKUUJFPGNSXDM-INIZCTEOSA-N	1	0	282.412	4.265	20	30		CIEDRO
Cc1ccc([C@H](C)[NH2+]Cc2ccc(C#N)c(F)c2)cc1C	ZINC000404743445	333025279	/nfs/dbraw/zinc/02/52/79/333025279.db2.gz	CRDNEHJSSQFHDN-AWEZNQCLSA-N	1	0	282.362	4.165	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCc1cccc(F)c1F)c1ccco1	ZINC000513707718	333034475	/nfs/dbraw/zinc/03/44/75/333034475.db2.gz	HZDMHUHNTKMRPZ-OAHLLOKOSA-N	1	0	291.341	4.397	20	30		CIEDRO
Cc1cc(CN(CCC#N)CCC(C)C)c2ccccc2n1	ZINC000513732325	333036177	/nfs/dbraw/zinc/03/61/77/333036177.db2.gz	DKVVMMWGMQESEE-UHFFFAOYSA-N	1	0	295.430	4.305	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@H]1CCc2c1cccc2F	ZINC000513870806	333045224	/nfs/dbraw/zinc/04/52/24/333045224.db2.gz	GIFBOOYXRIAGFZ-SFHVURJKSA-N	1	0	297.373	4.168	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H](C)c1ccc(F)c(OC)c1	ZINC000311877420	333073727	/nfs/dbraw/zinc/07/37/27/333073727.db2.gz	MOXSPFITLDOVTP-GFCCVEGCSA-N	1	0	265.372	4.087	20	30		CIEDRO
C[C@H](C1CC1)[N@H+](Cc1ccccc1C(C)(C)C#N)C1CC1	ZINC000178514525	333074615	/nfs/dbraw/zinc/07/46/15/333074615.db2.gz	COWYTEFVDOOYLX-CQSZACIVSA-N	1	0	282.431	4.251	20	30		CIEDRO
CC(C)(C)[C@@H]1CCC[C@@H]([NH2+]C[C@H](C#N)CCC#N)CC1	ZINC000516763304	333081966	/nfs/dbraw/zinc/08/19/66/333081966.db2.gz	OQFQXYFQOCRBGW-ARFHVFGLSA-N	1	0	275.440	4.015	20	30		CIEDRO
CC(C)(C)[C@@H]1CCC[C@H]([NH2+]C[C@H](C#N)CCC#N)CC1	ZINC000516763307	333082045	/nfs/dbraw/zinc/08/20/45/333082045.db2.gz	OQFQXYFQOCRBGW-XHSDSOJGSA-N	1	0	275.440	4.015	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@@H](C#N)C1)c1cc2ccccc2s1	ZINC000517398302	333098830	/nfs/dbraw/zinc/09/88/30/333098830.db2.gz	IFFJVVQONFQCQX-OUCADQQQSA-N	1	0	270.401	4.244	20	30		CIEDRO
CCC[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(C#N)cc1	ZINC000517549671	333101976	/nfs/dbraw/zinc/10/19/76/333101976.db2.gz	BZEHPZVUWKKITN-DLBZAZTESA-N	1	0	256.393	4.007	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+]Cc1cccc2cccnc21	ZINC000521084962	333111230	/nfs/dbraw/zinc/11/12/30/333111230.db2.gz	UGZCQWXZUHIEFD-OAHLLOKOSA-N	1	0	268.404	4.459	20	30		CIEDRO
CC(C)[N@H+](C/C=C\c1ccccc1)Cc1ccc(C#N)cc1	ZINC000521195539	333114650	/nfs/dbraw/zinc/11/46/50/333114650.db2.gz	FUABNWJZOGLHIK-TWGQIWQCSA-N	1	0	290.410	4.482	20	30		CIEDRO
CC(C)[C@H]1CC[C@@H](C)C[C@@H]1[NH2+]Cc1cccc(C#N)c1	ZINC000217869001	333124924	/nfs/dbraw/zinc/12/49/24/333124924.db2.gz	VSPPKZLFTIOPIS-OLMNPRSZSA-N	1	0	270.420	4.109	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+]Cc2ccccc2OC2CCCC2)C1	ZINC000185786490	333148704	/nfs/dbraw/zinc/14/87/04/333148704.db2.gz	IDUKSHWOJKIUHH-WBVHZDCISA-N	1	0	298.430	4.180	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+]CC2(c3ccc(Cl)cc3)CC2)C1	ZINC000185811115	333149424	/nfs/dbraw/zinc/14/94/24/333149424.db2.gz	BSNGSJCRLSFRIF-CZUORRHYSA-N	1	0	288.822	4.044	20	30		CIEDRO
C[C@H](CCC1CC1)[NH2+][C@H](CCC#N)c1ccccc1	ZINC000186427915	333160612	/nfs/dbraw/zinc/16/06/12/333160612.db2.gz	RHGICBAOJPHWDR-RHSMWYFYSA-N	1	0	256.393	4.200	20	30		CIEDRO
CC[C@H](C[N@H+](CC)CCCCC#N)c1ccccc1	ZINC000186606824	333163617	/nfs/dbraw/zinc/16/36/17/333163617.db2.gz	UDIFHCXSWIUUCZ-MRXNPFEDSA-N	1	0	258.409	4.196	20	30		CIEDRO
CC(C)C[N@H+](Cc1ccccc1)Cc1cc(C#N)ccc1F	ZINC000521816437	333189276	/nfs/dbraw/zinc/18/92/76/333189276.db2.gz	QRIMCYUYCNENNE-UHFFFAOYSA-N	1	0	296.389	4.356	20	30		CIEDRO
C=CCCOCC[NH2+][C@H](C)c1cccc(Cl)c1Cl	ZINC000222447635	333193686	/nfs/dbraw/zinc/19/36/86/333193686.db2.gz	IFIULTVHHUUVIO-LLVKDONJSA-N	1	0	288.218	4.237	20	30		CIEDRO
CC(C)(C#N)CCC[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1	ZINC000191366019	333218820	/nfs/dbraw/zinc/21/88/20/333218820.db2.gz	AMLPORNBOOYUNG-ZWKOTPCHSA-N	1	0	284.447	4.317	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@@H](C)c1nc(C(C)(C)C)no1	ZINC000191569305	333221628	/nfs/dbraw/zinc/22/16/28/333221628.db2.gz	UTSVICXIMOFSTM-STQMWFEESA-N	1	0	279.428	4.153	20	30		CIEDRO
CC(C)(CCC#N)C[N@@H+]1CC[C@@H](C(F)(F)F)C(C)(C)C1	ZINC000191663694	333223378	/nfs/dbraw/zinc/22/33/78/333223378.db2.gz	MWJMQORYHNUFSJ-GFCCVEGCSA-N	1	0	290.373	4.227	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C#N)c(F)c1)c1ccc(Cl)cc1	ZINC000192080052	333229142	/nfs/dbraw/zinc/22/91/42/333229142.db2.gz	PKFKHZSZRXNVSU-LLVKDONJSA-N	1	0	288.753	4.202	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)c(F)c1)c1cc2ccccc2o1	ZINC000192180082	333231942	/nfs/dbraw/zinc/23/19/42/333231942.db2.gz	VMTUXOZJURGQIO-LBPRGKRZSA-N	1	0	294.329	4.294	20	30		CIEDRO
CC(C)[C@H](C[NH2+]Cc1ccc(C#N)cc1)c1ccccc1	ZINC000225618076	333237815	/nfs/dbraw/zinc/23/78/15/333237815.db2.gz	XTXSHMSKCZPEOA-IBGZPJMESA-N	1	0	278.399	4.088	20	30		CIEDRO
N#Cc1cccc(C[N@H+]2CC[C@H](c3ccc(Cl)cc3)C2)c1	ZINC000522068958	333238019	/nfs/dbraw/zinc/23/80/19/333238019.db2.gz	SHYHISCRKYWGNA-KRWDZBQOSA-N	1	0	296.801	4.201	20	30		CIEDRO
N#Cc1cc(F)ccc1C[N@@H+]1CCCC2(CCCCC2)C1	ZINC000522071793	333238386	/nfs/dbraw/zinc/23/83/86/333238386.db2.gz	GMQDKBNWNVRCJJ-UHFFFAOYSA-N	1	0	286.394	4.244	20	30		CIEDRO
C=CCCCCC[NH2+][C@H](c1nc(C)cs1)C1CC1	ZINC000193537956	333252381	/nfs/dbraw/zinc/25/23/81/333252381.db2.gz	GRODCDPMAALGIP-AWEZNQCLSA-N	1	0	264.438	4.239	20	30		CIEDRO
CC(C)(C)c1ccc(C[NH+]2CCC(C)(C#N)CC2)cc1	ZINC000227354004	333281567	/nfs/dbraw/zinc/28/15/67/333281567.db2.gz	ZYACDSIIEYCTFN-UHFFFAOYSA-N	1	0	270.420	4.110	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H]2CCC[C@@H](SC)C2)cc1	ZINC000227378267	333282143	/nfs/dbraw/zinc/28/21/43/333282143.db2.gz	SPENKLIPZZWLFR-NVXWUHKLSA-N	1	0	291.460	4.015	20	30		CIEDRO
C[C@H]1C[C@H](c2ccccc2)C[N@@H+]1Cc1ccc(F)cc1C#N	ZINC000522469817	333287674	/nfs/dbraw/zinc/28/76/74/333287674.db2.gz	QNQGKGXCUBODBI-KSSFIOAISA-N	1	0	294.373	4.075	20	30		CIEDRO
CC[N@H+](C[C@H](C)C#N)[C@H](C)c1cccc2ccccc21	ZINC000522943787	333300643	/nfs/dbraw/zinc/30/06/43/333300643.db2.gz	AYVZHVVEJXZCLB-HUUCEWRRSA-N	1	0	266.388	4.382	20	30		CIEDRO
CC[C@@H]([NH2+]CC(C)(C)CCC#N)c1ccccc1OC	ZINC000229679609	333307723	/nfs/dbraw/zinc/30/77/23/333307723.db2.gz	UIYXUUFYFYLBHP-OAHLLOKOSA-N	1	0	274.408	4.066	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H](c1ccccc1)C1CC1	ZINC000229683958	333307774	/nfs/dbraw/zinc/30/77/74/333307774.db2.gz	COZFAOKFHCEBEL-INIZCTEOSA-N	1	0	256.393	4.057	20	30		CIEDRO
C[C@@H]1CCCC[C@@H]1[N@H+](C)CCCCC(C)(C)C#N	ZINC000235249438	333366987	/nfs/dbraw/zinc/36/69/87/333366987.db2.gz	UPWPHXKLEXGAFK-CABCVRRESA-N	1	0	250.430	4.217	20	30		CIEDRO
C[C@@H]1CCC[C@H]([NH2+]CCCCC(C)(C)C#N)[C@@H]1C	ZINC000235268136	333367115	/nfs/dbraw/zinc/36/71/15/333367115.db2.gz	XDCDOKQNIFALFU-KFWWJZLASA-N	1	0	250.430	4.121	20	30		CIEDRO
C[C@@H]1CCC[C@@H]([N@H+](C)CCCCC(C)(C)C#N)C1	ZINC000235275690	333367162	/nfs/dbraw/zinc/36/71/62/333367162.db2.gz	FWORCNVRZBEVMO-HUUCEWRRSA-N	1	0	250.430	4.217	20	30		CIEDRO
C[C@H]1c2ccsc2CC[N@H+]1CCCCC(C)(C)C#N	ZINC000235288137	333367261	/nfs/dbraw/zinc/36/72/61/333367261.db2.gz	DJPRKROLIWGQBS-ZDUSSCGKSA-N	1	0	276.449	4.387	20	30		CIEDRO
CC1=C[C@H](C)C[C@@H](C[NH2+][C@@H](C)c2ccc(C#N)cc2)C1	ZINC000235394990	333368960	/nfs/dbraw/zinc/36/89/60/333368960.db2.gz	GGDPMUBVTMZYPF-JLJPHGGASA-N	1	0	268.404	4.201	20	30		CIEDRO
C=CCOc1cccc(C[NH2+]CCCc2cccc(F)c2)c1	ZINC000524687870	333371415	/nfs/dbraw/zinc/37/14/15/333371415.db2.gz	JITDSLWKRNIQTI-UHFFFAOYSA-N	1	0	299.389	4.113	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H](c2ccccc2)C2CC2)cc1	ZINC000236684376	333374731	/nfs/dbraw/zinc/37/47/31/333374731.db2.gz	JIRJFUYLVUQCTC-FQEVSTJZSA-N	1	0	293.410	4.492	20	30		CIEDRO
CCC[C@H](Cc1ccccc1)[NH2+]Cc1cccc(C#N)c1	ZINC000237033122	333377438	/nfs/dbraw/zinc/37/74/38/333377438.db2.gz	AGQMFJYOBMPONT-LJQANCHMSA-N	1	0	278.399	4.059	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1cccc(C(F)(F)F)c1	ZINC000393800978	333385717	/nfs/dbraw/zinc/38/57/17/333385717.db2.gz	SJQGTSWXNSXZTP-CYBMUJFWSA-N	1	0	257.299	4.150	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H](C)c2ccccc2F)cc1	ZINC000037493817	333533844	/nfs/dbraw/zinc/53/38/44/333533844.db2.gz	AFNTYQUJSYETRD-AWEZNQCLSA-N	1	0	285.362	4.241	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)c1ccccc1Br	ZINC000124111130	333556046	/nfs/dbraw/zinc/55/60/46/333556046.db2.gz	MQUHRVJBLJUDJJ-WDEREUQCSA-N	1	0	268.198	4.064	20	30		CIEDRO
N#Cc1ccccc1C[NH2+][C@H]1CCC[C@H]1Cc1ccccc1	ZINC000530359589	333544325	/nfs/dbraw/zinc/54/43/25/333544325.db2.gz	YAXJBIYOHLRDDL-PXNSSMCTSA-N	1	0	290.410	4.059	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](C)c1ccc(OC)c2ccccc21	ZINC000537968617	333552060	/nfs/dbraw/zinc/55/20/60/333552060.db2.gz	OKMCCBLECYYHOV-ZIAGYGMSSA-N	1	0	269.388	4.464	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+]CCSCc1ccccc1C#N	ZINC000537968909	333552072	/nfs/dbraw/zinc/55/20/72/333552072.db2.gz	CVUMJSAGMYYYMN-QGZVFWFLSA-N	1	0	288.460	4.126	20	30		CIEDRO
C[C@H](CC1CC1)[NH2+]C1CCC(Oc2ccccc2C#N)CC1	ZINC000537978716	333553267	/nfs/dbraw/zinc/55/32/67/333553267.db2.gz	DTFLVYYDHQIJMV-RWBZWWBESA-N	1	0	298.430	4.026	20	30		CIEDRO
C[C@H]([NH2+]CCc1cc2ccccc2o1)c1ccc(C#N)cc1	ZINC000174119336	335148320	/nfs/dbraw/zinc/14/83/20/335148320.db2.gz	BGXOMVDDOBYFLF-AWEZNQCLSA-N	1	0	290.366	4.198	20	30		CIEDRO
C=CCCC[C@@H](C)[NH+]1CCC(OCC2CCCC2)CC1	ZINC000538146647	333576401	/nfs/dbraw/zinc/57/64/01/333576401.db2.gz	LNTQOOXTGKXQGF-MRXNPFEDSA-N	1	0	279.468	4.402	20	30		CIEDRO
C[C@@H]([NH2+]C[C@@H]1CCCc2ccccc21)c1cccc(C#N)c1	ZINC000538397825	333588579	/nfs/dbraw/zinc/58/85/79/333588579.db2.gz	CGHYTKUTVJHWAH-BEFAXECRSA-N	1	0	290.410	4.329	20	30		CIEDRO
C[C@H]([NH2+]C/C=C/c1ccc(F)cc1)c1ccc(C#N)cc1	ZINC000126538178	333599510	/nfs/dbraw/zinc/59/95/10/333599510.db2.gz	RTHJGUCZXOWIAV-HSWBROFVSA-N	1	0	280.346	4.061	20	30		CIEDRO
C=CC[C@@H](C)[C@@H](C)[NH2+]Cc1ccc(C)cc1OCC	ZINC000538502550	333600401	/nfs/dbraw/zinc/60/04/01/333600401.db2.gz	ZGTWPDZJSUNZIX-HUUCEWRRSA-N	1	0	261.409	4.084	20	30		CIEDRO
CC(C)Oc1ccccc1[C@H](C)[NH2+]CCC(C)(C)C#N	ZINC000538512075	333602106	/nfs/dbraw/zinc/60/21/06/333602106.db2.gz	AOZOSDOHOWZZGB-AWEZNQCLSA-N	1	0	274.408	4.064	20	30		CIEDRO
C=CCC[C@H](C)[NH2+]Cc1cc(Br)ccc1F	ZINC000126744018	333604069	/nfs/dbraw/zinc/60/40/69/333604069.db2.gz	ZXXCGOKGLJAGCM-JTQLQIEISA-N	1	0	286.188	4.033	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)c1ccc(OCC(F)(F)F)cc1	ZINC000539262358	333663447	/nfs/dbraw/zinc/66/34/47/333663447.db2.gz	FUAWXNNDFGHJBK-LBPRGKRZSA-N	1	0	287.325	4.245	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](C)c1ccc(-n2cccn2)cc1	ZINC000539341845	333666673	/nfs/dbraw/zinc/66/66/73/333666673.db2.gz	HHPBEZPUSKWNQN-HOTGVXAUSA-N	1	0	283.419	4.268	20	30		CIEDRO
CC(C)c1ccc([C@H]([NH2+]CC2(C#N)CC2)C(C)C)cc1	ZINC000539494118	333673712	/nfs/dbraw/zinc/67/37/12/333673712.db2.gz	XISKFAXRNOHTSY-QGZVFWFLSA-N	1	0	270.420	4.400	20	30		CIEDRO
C[C@H](C[NH2+]CCCCC#N)Cc1ccc(C(C)(C)C)cc1	ZINC000539532178	333676732	/nfs/dbraw/zinc/67/67/32/333676732.db2.gz	BPDXQBFQOUOMOJ-INIZCTEOSA-N	1	0	286.463	4.446	20	30		CIEDRO
C=CC1CC[NH+](Cc2cnc(-c3ccccc3)s2)CC1	ZINC000539828807	333695680	/nfs/dbraw/zinc/69/56/80/333695680.db2.gz	RIAOUZKHXGVHQA-UHFFFAOYSA-N	1	0	284.428	4.208	20	30		CIEDRO
CC(C)CCC1CC[NH+](CCC(C)(C)C#N)CC1	ZINC000540688201	333741627	/nfs/dbraw/zinc/74/16/27/333741627.db2.gz	SZQJWECEXCZARY-UHFFFAOYSA-N	1	0	250.430	4.074	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@H](C)[C@H](OC)c1ccc(OC)cc1	ZINC000540148205	333713140	/nfs/dbraw/zinc/71/31/40/333713140.db2.gz	IMGYGHSMCBXUNP-HFTRVMKXSA-N	1	0	291.435	4.106	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H]1CC2(CCCC2)Oc2ccccc21	ZINC000540170452	333717190	/nfs/dbraw/zinc/71/71/90/333717190.db2.gz	LZZHJCBZMWSOKW-GOEBONIOSA-N	1	0	271.404	4.377	20	30		CIEDRO
C=C(CC)C[NH2+][C@H](CC(F)(F)F)c1ccc(F)cc1	ZINC000540378676	333727377	/nfs/dbraw/zinc/72/73/77/333727377.db2.gz	BLAVQAXGNAXXBX-CYBMUJFWSA-N	1	0	275.289	4.375	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H](C)c1cccc(-n2cccn2)c1	ZINC000540387107	333727805	/nfs/dbraw/zinc/72/78/05/333727805.db2.gz	MIGJXWCWGWZNGE-HZPDHXFCSA-N	1	0	283.419	4.268	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CCCC[C@H]2c2ccccc2)s1	ZINC000540575307	333735765	/nfs/dbraw/zinc/73/57/65/333735765.db2.gz	PPOVBPMOKGPYNP-ZWKOTPCHSA-N	1	0	296.439	4.436	20	30		CIEDRO
Cc1cc(C)cc(CC[NH2+][C@H](C)c2cccc(C#N)c2)c1	ZINC000540593162	333736548	/nfs/dbraw/zinc/73/65/48/333736548.db2.gz	BGHAEFGJLHWXNX-MRXNPFEDSA-N	1	0	278.399	4.068	20	30		CIEDRO
Cc1ccc(CC[C@@H](C)[NH2+][C@H](C)c2ccc(C#N)cc2)o1	ZINC000540593565	333736677	/nfs/dbraw/zinc/73/66/77/333736677.db2.gz	KPKRWICNMWKGIN-UKRRQHHQSA-N	1	0	282.387	4.132	20	30		CIEDRO
C[C@H]([NH2+]C1CCCCCC1)c1ccc(C#N)c(F)c1	ZINC000540700710	333742304	/nfs/dbraw/zinc/74/23/04/333742304.db2.gz	WCYZPLPLZWBXEI-LBPRGKRZSA-N	1	0	260.356	4.071	20	30		CIEDRO
CCCCCOc1ccc([C@@H](C)[NH2+]CCCC#N)cc1	ZINC000541569459	333781385	/nfs/dbraw/zinc/78/13/85/333781385.db2.gz	BZLXEFAKCLDALW-OAHLLOKOSA-N	1	0	274.408	4.210	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H](c1ncc(C)s1)C1CC1	ZINC000541599848	333783599	/nfs/dbraw/zinc/78/35/99/333783599.db2.gz	OAAMGPOCHCPCAE-RISCZKNCSA-N	1	0	264.438	4.237	20	30		CIEDRO
C=CCC[C@H](C)[NH2+]C[C@@H]1CCC[C@H](C(F)(F)F)C1	ZINC000541737644	333788861	/nfs/dbraw/zinc/78/88/61/333788861.db2.gz	YPEWXUZZTAYMNI-XQQFMLRXSA-N	1	0	263.347	4.299	20	30		CIEDRO
C[C@H](CC1CCCCC1)C[NH+]1CCC(CC#N)CC1	ZINC000541762539	333790619	/nfs/dbraw/zinc/79/06/19/333790619.db2.gz	ADNZPNRJDNCADU-OAHLLOKOSA-N	1	0	262.441	4.219	20	30		CIEDRO
C[C@@H]([NH2+]C/C=C\c1ccc(F)cc1F)c1ccc(C#N)cc1	ZINC000541791772	333792863	/nfs/dbraw/zinc/79/28/63/333792863.db2.gz	IEPMAORSINUQEV-XQJDBVBESA-N	1	0	298.336	4.200	20	30		CIEDRO
CCCC[C@H]([NH2+]Cc1ccc(CC#N)cc1)C1CCC1	ZINC000542522977	333830634	/nfs/dbraw/zinc/83/06/34/333830634.db2.gz	WTMINEUMEXHXOZ-SFHVURJKSA-N	1	0	270.420	4.201	20	30		CIEDRO
C=CCC[NH2+][C@@H](Cc1ccccc1)c1cccs1	ZINC000542525893	333830906	/nfs/dbraw/zinc/83/09/06/333830906.db2.gz	NDJOCYCMCQSKRW-HNNXBMFYSA-N	1	0	257.402	4.198	20	30		CIEDRO
C[C@@H](c1ccccc1Cl)[NH+]1CCC(CC#N)CC1	ZINC000543809910	333901272	/nfs/dbraw/zinc/90/12/72/333901272.db2.gz	QYCAAWVPQKCULJ-LBPRGKRZSA-N	1	0	262.784	4.027	20	30		CIEDRO
C=CCC[C@H](C)[NH2+]CCc1c[nH]c2ccc(Cl)cc12	ZINC000544594401	333939007	/nfs/dbraw/zinc/93/90/07/333939007.db2.gz	SEDBYHKHRGCZLO-LBPRGKRZSA-N	1	0	276.811	4.308	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+][C@@H](CC)CC(F)(F)F	ZINC000544829599	333947877	/nfs/dbraw/zinc/94/78/77/333947877.db2.gz	KHBNYMZPQNTZSC-NWDGAFQWSA-N	1	0	251.336	4.442	20	30		CIEDRO
CC[C@@H](CC#N)[NH2+]C1CCC(C)(c2ccccc2)CC1	ZINC000545873234	334003540	/nfs/dbraw/zinc/00/35/40/334003540.db2.gz	ZUCDYZHMBYWAAT-AOCRQIFASA-N	1	0	270.420	4.169	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@H](c1cnn(C)c1)C(C)(C)C	ZINC000545905576	334005459	/nfs/dbraw/zinc/00/54/59/334005459.db2.gz	SQJPWYAQZPSEOQ-JKSUJKDBSA-N	1	0	277.456	4.232	20	30		CIEDRO
C[C@@H]([NH2+]CCC(C)(C)C#N)c1ccc2c(c1)CCCC2	ZINC000546211576	334019697	/nfs/dbraw/zinc/01/96/97/334019697.db2.gz	SDWTWCBESSDCJJ-CQSZACIVSA-N	1	0	270.420	4.156	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@@H]2CCC[C@H]2c2ccc(F)cc2)c1	ZINC000546658637	334044189	/nfs/dbraw/zinc/04/41/89/334044189.db2.gz	DQWGANNGIXRAMR-RBUKOAKNSA-N	1	0	294.373	4.123	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@H]2CCC[C@@H]2c2ccc(F)cc2)c1	ZINC000546658635	334044300	/nfs/dbraw/zinc/04/43/00/334044300.db2.gz	DQWGANNGIXRAMR-MOPGFXCFSA-N	1	0	294.373	4.123	20	30		CIEDRO
Cc1cccc(C)c1[C@H](C)[NH2+]Cc1ccc(C#N)cc1F	ZINC000546884267	334053702	/nfs/dbraw/zinc/05/37/02/334053702.db2.gz	UBDUUNRKUDZVAD-AWEZNQCLSA-N	1	0	282.362	4.165	20	30		CIEDRO
CCCC[C@@H]1CCC[C@H]1[NH2+]Cc1cc(C#N)cs1	ZINC000236868103	334076387	/nfs/dbraw/zinc/07/63/87/334076387.db2.gz	LYWFANZOVQAFJK-UKRRQHHQSA-N	1	0	262.422	4.068	20	30		CIEDRO
C[C@H]1CC[N@H+](CCC(C)(C)C#N)CC12CCCCC2	ZINC000547315900	334078040	/nfs/dbraw/zinc/07/80/40/334078040.db2.gz	PTNBESJGUIZOOE-HNNXBMFYSA-N	1	0	262.441	4.219	20	30		CIEDRO
C=CCC[C@H]([NH2+]C1CC(c2ccccc2)C1)C1CC1	ZINC000547396004	334085414	/nfs/dbraw/zinc/08/54/14/334085414.db2.gz	OBBMMWBTYZSASV-ABHNRTSZSA-N	1	0	255.405	4.267	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@H](C)c1ccc(OC)c(Cl)c1	ZINC000547393490	334085479	/nfs/dbraw/zinc/08/54/79/334085479.db2.gz	HSNKHEMGLMDIIO-DGCLKSJQSA-N	1	0	267.800	4.354	20	30		CIEDRO
N#Cc1csc(C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2)c1	ZINC000237850238	334100559	/nfs/dbraw/zinc/10/05/59/334100559.db2.gz	OCPVBUVFTFTAIM-AEFFLSMTSA-N	1	0	296.439	4.121	20	30		CIEDRO
C=CC[C@H](C)[NH2+]Cc1ccc(-c2ccc(F)cc2)o1	ZINC000134748644	334102867	/nfs/dbraw/zinc/10/28/67/334102867.db2.gz	WJZLGRRHAGEWSY-LBPRGKRZSA-N	1	0	259.324	4.140	20	30		CIEDRO
CC(C)C[C@@H]([NH2+]Cc1ccc(C#N)o1)c1ccccc1	ZINC000135130714	334117039	/nfs/dbraw/zinc/11/70/39/334117039.db2.gz	DZYDBCSSFKNKMK-QGZVFWFLSA-N	1	0	268.360	4.028	20	30		CIEDRO
CC(C)CC[C@@H]1CCC[N@@H+]1CCCC(C)(C)C#N	ZINC000135312432	334125315	/nfs/dbraw/zinc/12/53/15/334125315.db2.gz	DAHHSHMLBOLXJY-HNNXBMFYSA-N	1	0	250.430	4.217	20	30		CIEDRO
CCC[C@H](C)[C@H]1CCC[N@@H+]1CCCC(C)(C)C#N	ZINC000135340364	334126652	/nfs/dbraw/zinc/12/66/52/334126652.db2.gz	QKYWSPUHNLHYBE-LSDHHAIUSA-N	1	0	250.430	4.217	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](C)c1ccc2cc(OC)ccc2c1	ZINC000135365860	334128010	/nfs/dbraw/zinc/12/80/10/334128010.db2.gz	VXTYIMOTGUAPKM-ZIAGYGMSSA-N	1	0	269.388	4.464	20	30		CIEDRO
CC(C)(C#N)CC[NH2+][C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000547883346	334128801	/nfs/dbraw/zinc/12/88/01/334128801.db2.gz	XCKGHPDKTPDTKR-IAGOWNOFSA-N	1	0	270.420	4.242	20	30		CIEDRO
CC(C)(CCc1ccccc1)[NH2+]Cc1cc(C#N)cs1	ZINC000135620582	334134714	/nfs/dbraw/zinc/13/47/14/334134714.db2.gz	XHMYYYOKONNTBB-UHFFFAOYSA-N	1	0	284.428	4.121	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](c1ccccc1)c1ccc(F)cc1	ZINC000135749951	334137954	/nfs/dbraw/zinc/13/79/54/334137954.db2.gz	IMRUNZRZYFJTAH-KBXCAEBGSA-N	1	0	269.363	4.469	20	30		CIEDRO
N#Cc1cccc(C[NH2+]C2(c3ccc(F)cc3F)CCC2)c1	ZINC000136132022	334147846	/nfs/dbraw/zinc/14/78/46/334147846.db2.gz	GLTJXPKHMAFBIB-UHFFFAOYSA-N	1	0	298.336	4.005	20	30		CIEDRO
C[C@@H]([NH2+]C1CCC(C)(C)CC1)c1cccc(C#N)c1	ZINC000079676039	334159685	/nfs/dbraw/zinc/15/96/85/334159685.db2.gz	HVMOCBLASJYXPY-CYBMUJFWSA-N	1	0	256.393	4.178	20	30		CIEDRO
CC[C@H](CC#N)[NH2+][C@H](C)CCc1cccc(C(F)(F)F)c1	ZINC000136958886	334165919	/nfs/dbraw/zinc/16/59/19/334165919.db2.gz	BLNBRVJCRSOAMV-IUODEOHRSA-N	1	0	298.352	4.308	20	30		CIEDRO
Cc1ccc(C[C@@H](C)[NH2+][C@@H](C)c2cccc(C#N)c2)s1	ZINC000080240688	334168217	/nfs/dbraw/zinc/16/82/17/334168217.db2.gz	BLIYPVXYHMKVDE-OCCSQVGLSA-N	1	0	284.428	4.210	20	30		CIEDRO
Cc1ccc(C[C@H](C)[NH2+][C@@H](C)c2ccc(C#N)cc2)s1	ZINC000080242138	334168290	/nfs/dbraw/zinc/16/82/90/334168290.db2.gz	NXSYZGWEJHFBSL-JSGCOSHPSA-N	1	0	284.428	4.210	20	30		CIEDRO
C=CCOCC[N@@H+]([C@H](C)c1ccc(Cl)cc1)C1CC1	ZINC000549899873	334208208	/nfs/dbraw/zinc/20/82/08/334208208.db2.gz	WVEYJKSKYXPFKP-CYBMUJFWSA-N	1	0	279.811	4.068	20	30		CIEDRO
CC(C)(C#N)CCCC[N@@H+]1CC[C@@H](c2ccccc2F)C1	ZINC000550211460	334216151	/nfs/dbraw/zinc/21/61/51/334216151.db2.gz	LGGKFADETQHESV-OAHLLOKOSA-N	1	0	288.410	4.335	20	30		CIEDRO
C[C@@H]([NH2+]CCC1Cc2ccccc2C1)c1ccc(C#N)cc1	ZINC000550218988	334216421	/nfs/dbraw/zinc/21/64/21/334216421.db2.gz	CLRNJDLACVSRRF-OAHLLOKOSA-N	1	0	290.410	4.014	20	30		CIEDRO
C[C@H]1C[N@H+](CC(C)(C)CCC#N)CC[C@H]1c1ccccc1	ZINC000245797162	334220146	/nfs/dbraw/zinc/22/01/46/334220146.db2.gz	XGGDGXGCDAWBSG-FUHWJXTLSA-N	1	0	284.447	4.442	20	30		CIEDRO
CCC[N@@H+](Cc1ccc(C#N)cc1)C[C@@H]1CCC(F)(F)C1	ZINC000550680394	334226748	/nfs/dbraw/zinc/22/67/48/334226748.db2.gz	MGDOQITWPVQKGF-MRXNPFEDSA-N	1	0	292.373	4.206	20	30		CIEDRO
C[C@H]([NH2+]C[C@H](c1ccccc1)C1CC1)c1ccc(C#N)cc1	ZINC000550846851	334230221	/nfs/dbraw/zinc/23/02/21/334230221.db2.gz	ISNVTFTXZIHXRH-MGPUTAFESA-N	1	0	290.410	4.403	20	30		CIEDRO
C=C(C)C[NH2+]Cc1csc(-c2ccc(Cl)cc2)n1	ZINC000552014225	334274920	/nfs/dbraw/zinc/27/49/20/334274920.db2.gz	GNMWRSQDAJACPT-UHFFFAOYSA-N	1	0	278.808	4.129	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H](CC(C)C)c1ccccn1	ZINC000551240602	334242341	/nfs/dbraw/zinc/24/23/41/334242341.db2.gz	OHCHSPKTBKEUAY-MRXNPFEDSA-N	1	0	260.425	4.361	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H](C)c1cc(OC)c(OC)cc1F	ZINC000551240291	334242402	/nfs/dbraw/zinc/24/24/02/334242402.db2.gz	INJWMEFXYODIJA-GFCCVEGCSA-N	1	0	295.398	4.096	20	30		CIEDRO
CC1=CCC[C@H](C)[C@@H]1C[NH2+]C1(c2cccc(C#N)c2)CC1	ZINC000551602719	334255725	/nfs/dbraw/zinc/25/57/25/334255725.db2.gz	LYJBEZGBIOBKFL-MAUKXSAKSA-N	1	0	280.415	4.129	20	30		CIEDRO
C[C@@H](c1cccc(C#N)c1)[NH+]1CCC(CC(F)(F)F)CC1	ZINC000551710281	334258843	/nfs/dbraw/zinc/25/88/43/334258843.db2.gz	YUYPQUBCKFWVQQ-LBPRGKRZSA-N	1	0	296.336	4.284	20	30		CIEDRO
CC(C)(C#N)CC[NH2+]C1(c2ccc(Cl)cc2)CCC1	ZINC000551748544	334259802	/nfs/dbraw/zinc/25/98/02/334259802.db2.gz	URCLPGUCWBHMBI-UHFFFAOYSA-N	1	0	276.811	4.249	20	30		CIEDRO
CCc1ccc(C(C)(C)[NH2+]Cc2cc(C#N)cs2)cc1	ZINC000083477837	334262557	/nfs/dbraw/zinc/26/25/57/334262557.db2.gz	NUTIBNCMOVFARX-UHFFFAOYSA-N	1	0	284.428	4.207	20	30		CIEDRO
C=C(C)CC[NH+]1CCC(C(=O)c2ccc(C)cc2C)CC1	ZINC000551976105	334268662	/nfs/dbraw/zinc/26/86/62/334268662.db2.gz	GTDQFAYRAWCTNW-UHFFFAOYSA-N	1	0	285.431	4.164	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@]1(C)CCO[C@@H]1C1CC1)c1ccco1	ZINC000552067816	334285053	/nfs/dbraw/zinc/28/50/53/334285053.db2.gz	YXZHGIZRSCZSKU-CGTJXYLNSA-N	1	0	289.419	4.082	20	30		CIEDRO
C[N@H+](CCCc1c(Cl)cccc1Cl)CC(C)(C)C#N	ZINC000552085275	334287233	/nfs/dbraw/zinc/28/72/33/334287233.db2.gz	XQLRNQCXSDWDOG-UHFFFAOYSA-N	1	0	299.245	4.408	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H](c2cccnc2)C(C)C)cc1	ZINC000552088645	334287843	/nfs/dbraw/zinc/28/78/43/334287843.db2.gz	OLLXXBVPVXKCLH-IBGZPJMESA-N	1	0	296.414	4.133	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+]CCCc1cccc(C)n1	ZINC000552088497	334287856	/nfs/dbraw/zinc/28/78/56/334287856.db2.gz	KZJFRCWTPNSXJF-MRXNPFEDSA-N	1	0	260.425	4.047	20	30		CIEDRO
Cc1cc([NH+]2CCCCCC2)ccc1N[C@@H]1CC[C@@H](C#N)C1	ZINC000552088519	334287930	/nfs/dbraw/zinc/28/79/30/334287930.db2.gz	LHUMRNBZQDZRRH-IAGOWNOFSA-N	1	0	297.446	4.480	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+]Cc1ccncc1OCc1ccccc1	ZINC000552091809	334288357	/nfs/dbraw/zinc/28/83/57/334288357.db2.gz	YTVLYHCDGOYKPO-MRXNPFEDSA-N	1	0	296.414	4.105	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@@H]1CCOc2ccccc21)c1ccco1	ZINC000552244924	334307658	/nfs/dbraw/zinc/30/76/58/334307658.db2.gz	NNIIYGHEKJUULR-DOTOQJQBSA-N	1	0	297.398	4.443	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCC[C@@H]1CCCC[C@@H]1O)c1ccco1	ZINC000552276114	334311760	/nfs/dbraw/zinc/31/17/60/334311760.db2.gz	LCRYOKRXNVINDY-ULQDDVLXSA-N	1	0	291.435	4.208	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@H]1CCO[C@@H](CC(C)C)C1)c1ccco1	ZINC000552289606	334313647	/nfs/dbraw/zinc/31/36/47/334313647.db2.gz	CXGJEKGASHDKGR-ULQDDVLXSA-N	1	0	291.435	4.470	20	30		CIEDRO
C[C@H](c1cccc(C#N)c1)[N@@H+]1CC[C@@H](c2ccccc2)C1	ZINC000249278668	334331211	/nfs/dbraw/zinc/33/12/11/334331211.db2.gz	OEAWMZAZHXKVDS-DNVCBOLYSA-N	1	0	276.383	4.109	20	30		CIEDRO
N#Cc1ccc2c(c1)CCC[C@@H]2[NH2+]Cc1ccc(F)cc1F	ZINC000552956532	334352786	/nfs/dbraw/zinc/35/27/86/334352786.db2.gz	CVWNAQZCTJKIHW-SFHVURJKSA-N	1	0	298.336	4.004	20	30		CIEDRO
N#CCCCC[N@@H+]1CCCC[C@H]1CCc1ccccc1	ZINC000090010558	334355521	/nfs/dbraw/zinc/35/55/21/334355521.db2.gz	LWPPIMNITQBJGU-SFHVURJKSA-N	1	0	270.420	4.168	20	30		CIEDRO
N#CCCCC[NH2+][C@H](c1ccccc1F)C1CCCC1	ZINC000091319639	334376203	/nfs/dbraw/zinc/37/62/03/334376203.db2.gz	SOXLEGKXBKMSAB-KRWDZBQOSA-N	1	0	274.383	4.340	20	30		CIEDRO
COc1ccc([C@H](C)C[N@H+](CCC#N)CC(C)(C)C)cc1	ZINC000553484561	334387670	/nfs/dbraw/zinc/38/76/70/334387670.db2.gz	SWEIILHQQGTJRI-OAHLLOKOSA-N	1	0	288.435	4.060	20	30		CIEDRO
COc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(C#N)c(F)c2)cc1	ZINC000553790889	334399088	/nfs/dbraw/zinc/39/90/88/334399088.db2.gz	GIKRDHXTYZLBMO-CHWSQXEVSA-N	1	0	298.361	4.118	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+]C[C@H](CO)c1ccccc1Cl	ZINC000554073005	334409079	/nfs/dbraw/zinc/40/90/79/334409079.db2.gz	KRASOJAGXKWBBD-CABCVRRESA-N	1	0	295.854	4.140	20	30		CIEDRO
Cc1cccc2c1[C@@H](C)C[C@H]2[NH2+]CC(C)(C)CCC#N	ZINC000554076486	334409552	/nfs/dbraw/zinc/40/95/52/334409552.db2.gz	FBCJSCMLFYOIMG-GOEBONIOSA-N	1	0	270.420	4.463	20	30		CIEDRO
CCCC[C@@H]1CCC[C@@H]1[NH2+]CC(C)(C)CCC#N	ZINC000554360155	334424030	/nfs/dbraw/zinc/42/40/30/334424030.db2.gz	BGQWEMNHWBBUSF-CABCVRRESA-N	1	0	250.430	4.265	20	30		CIEDRO
CSc1ccccc1C[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000554842018	334455566	/nfs/dbraw/zinc/45/55/66/334455566.db2.gz	BWHFUQCFXMIJSU-CYBMUJFWSA-N	1	0	282.412	4.131	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@H](C)c1cccc(C2CC2)c1	ZINC000556179176	334498479	/nfs/dbraw/zinc/49/84/79/334498479.db2.gz	SXOSYGCZOJCPKO-ZMYBRWDISA-N	1	0	285.431	4.196	20	30		CIEDRO
COc1cc(C[NH2+][C@H](C)c2ccc(C)cc2C)ccc1C#N	ZINC000564439328	334508369	/nfs/dbraw/zinc/50/83/69/334508369.db2.gz	PGTFXAMKCFZXJV-OAHLLOKOSA-N	1	0	294.398	4.035	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@@H](C)c1cnc(OC)c(Cl)c1	ZINC000565520579	334570512	/nfs/dbraw/zinc/57/05/12/334570512.db2.gz	CEIXGRINGYMCQL-NEPJUHHUSA-N	1	0	282.815	4.139	20	30		CIEDRO
C=CCCCCC[NH2+][C@H](C)c1nc2c(s1)CCCC2	ZINC000567421658	334715282	/nfs/dbraw/zinc/71/52/82/334715282.db2.gz	LEQGASOAFIVNBS-CYBMUJFWSA-N	1	0	278.465	4.419	20	30		CIEDRO
COc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(C#N)cc2)c(F)c1	ZINC000268800735	334716655	/nfs/dbraw/zinc/71/66/55/334716655.db2.gz	KAYDMZQBFCMBDB-OLZOCXBDSA-N	1	0	298.361	4.118	20	30		CIEDRO
C[C@H](C[NH2+][C@@H](C)c1ccc(OCC#N)cc1)c1ccccc1	ZINC000271830305	334747220	/nfs/dbraw/zinc/74/72/20/334747220.db2.gz	PNKKUVFWIXNZDS-CVEARBPZSA-N	1	0	294.398	4.043	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H](C)c2cccc(C)c2)cc1	ZINC000157199568	334763199	/nfs/dbraw/zinc/76/31/99/334763199.db2.gz	CGEOZFNKGPFRPT-MRXNPFEDSA-N	1	0	281.399	4.411	20	30		CIEDRO
CCCC1(C[NH2+]Cc2ccc(C#N)cc2C(F)(F)F)CC1	ZINC000568143287	334795994	/nfs/dbraw/zinc/79/59/94/334795994.db2.gz	LHQBFZCFZDNMBQ-UHFFFAOYSA-N	1	0	296.336	4.247	20	30		CIEDRO
C=CCCCC[NH2+][C@H](C)c1nc2ccccc2n1C(F)F	ZINC000569181346	334859569	/nfs/dbraw/zinc/85/95/69/334859569.db2.gz	BOSACDOKEOZYEZ-GFCCVEGCSA-N	1	0	293.361	4.438	20	30		CIEDRO
N#CCCC1CC[NH+](Cc2ccc(-c3ccccc3)o2)CC1	ZINC000569245197	334863628	/nfs/dbraw/zinc/86/36/28/334863628.db2.gz	GFOLWOILMLVRQZ-UHFFFAOYSA-N	1	0	294.398	4.462	20	30		CIEDRO
C[C@H]([NH2+]C1CCC2(CC2)CC1)c1ccc(C#N)c(F)c1	ZINC000576305626	335187429	/nfs/dbraw/zinc/18/74/29/335187429.db2.gz	JDDZOOJNZLDJRX-LBPRGKRZSA-N	1	0	272.367	4.071	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+]Cc1noc2ccccc21	ZINC000576478827	335209913	/nfs/dbraw/zinc/20/99/13/335209913.db2.gz	DUAJDEQTLWSIJG-ZDUSSCGKSA-N	1	0	258.365	4.052	20	30		CIEDRO
N#CCCC1CC[NH+](Cc2cc3cc(F)ccc3o2)CC1	ZINC000576876197	335258985	/nfs/dbraw/zinc/25/89/85/335258985.db2.gz	NXTCDFGFPRUJPE-UHFFFAOYSA-N	1	0	286.350	4.088	20	30		CIEDRO
N#CCC[C@@H](C#N)C[NH2+][C@H](c1ccc(F)cc1)C1CCCC1	ZINC000576979582	335272777	/nfs/dbraw/zinc/27/27/77/335272777.db2.gz	GUKIRKMIZXQDCZ-KSSFIOAISA-N	1	0	299.393	4.090	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+][C@@H](C)c1c(F)cncc1F	ZINC000577306759	335337167	/nfs/dbraw/zinc/33/71/67/335337167.db2.gz	VHVRKKLKLBKYET-NWDGAFQWSA-N	1	0	268.351	4.145	20	30		CIEDRO
N#Cc1ccc(C[NH2+]CCc2csc3ccccc23)s1	ZINC000176957421	335344975	/nfs/dbraw/zinc/34/49/75/335344975.db2.gz	KNMPTZREMFJHMF-UHFFFAOYSA-N	1	0	298.436	4.167	20	30		CIEDRO
Cc1ccccc1CC(C)(C)[NH2+]Cc1cc(C#N)cs1	ZINC000177697232	335379664	/nfs/dbraw/zinc/37/96/64/335379664.db2.gz	QHSUBNOLHRZYPX-UHFFFAOYSA-N	1	0	284.428	4.039	20	30		CIEDRO
CC[C@H]([NH2+]Cc1cc(C#N)cs1)c1cc(F)ccc1F	ZINC000177704997	335380077	/nfs/dbraw/zinc/38/00/77/335380077.db2.gz	UKNVDFXLOMKSEV-HNNXBMFYSA-N	1	0	292.354	4.139	20	30		CIEDRO
C[C@@H]1Cc2ccccc2[C@@H]1[NH2+][C@@H]1CCc2ccc(C#N)cc21	ZINC000577921798	335420905	/nfs/dbraw/zinc/42/09/05/335420905.db2.gz	WEJFBEBJUDUJGA-SMHULIPUSA-N	1	0	288.394	4.069	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@H](CC2CCC2)c2ccccc2)C1	ZINC000349432694	335467779	/nfs/dbraw/zinc/46/77/79/335467779.db2.gz	ZNMXLGPQHXFLGU-BPQIPLTHSA-N	1	0	268.404	4.200	20	30		CIEDRO
CCSc1ccc([C@@H](C)[NH2+]CCCCC#N)cc1	ZINC000179224195	335481771	/nfs/dbraw/zinc/48/17/71/335481771.db2.gz	AKNMHFDWBWBWKI-CYBMUJFWSA-N	1	0	262.422	4.143	20	30		CIEDRO
CCOc1ccccc1[C@@H](CC(C)C)[NH2+]CCCC#N	ZINC000181267386	335756456	/nfs/dbraw/zinc/75/64/56/335756456.db2.gz	AZPSSBJONZCJCC-MRXNPFEDSA-N	1	0	274.408	4.066	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccc(F)cc1C#N)c1ccc(C)cc1	ZINC000181704311	335779603	/nfs/dbraw/zinc/77/96/03/335779603.db2.gz	GNKKATUGWWZOHN-GOSISDBHSA-N	1	0	282.362	4.247	20	30		CIEDRO
C=C(C)C[NH2+]C/C(C)=C/c1cccc(C(F)(F)F)c1	ZINC000579520018	335781269	/nfs/dbraw/zinc/78/12/69/335781269.db2.gz	ZLFNNYAVUPSYFR-KPKJPENVSA-N	1	0	269.310	4.274	20	30		CIEDRO
CCS[C@@H]1CCCC[C@@H]1[NH2+][C@@H](C)c1cccc(C#N)c1	ZINC000181866158	335789130	/nfs/dbraw/zinc/78/91/30/335789130.db2.gz	KHZJKRNAIBNXMZ-RRQGHBQHSA-N	1	0	288.460	4.273	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1cccc(C#N)c1)c1cccc(F)c1F	ZINC000182099758	335798947	/nfs/dbraw/zinc/79/89/47/335798947.db2.gz	FQHGLTBFTLQIAM-NWDGAFQWSA-N	1	0	286.325	4.248	20	30		CIEDRO
CC(C)[C@@H]([NH2+]Cc1ccc(C#N)cn1)c1ccc(Cl)cc1	ZINC000579868761	335913273	/nfs/dbraw/zinc/91/32/73/335913273.db2.gz	IVQSVRYJGHWEGO-QGZVFWFLSA-N	1	0	299.805	4.094	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+]CCCc1c[nH]c2ccccc12	ZINC000185396755	335951217	/nfs/dbraw/zinc/95/12/17/335951217.db2.gz	SBYNJVMVBIOLRB-CQSZACIVSA-N	1	0	256.393	4.045	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000381124977	336050964	/nfs/dbraw/zinc/05/09/64/336050964.db2.gz	ZGFUDYILWTTXQE-NSHDSACASA-N	1	0	257.299	4.322	20	30		CIEDRO
C=CCCCC[NH2+][C@@H](C)c1cccc(OC(F)F)c1	ZINC000381720531	336071557	/nfs/dbraw/zinc/07/15/57/336071557.db2.gz	LCXWSCIBUZTOAJ-LBPRGKRZSA-N	1	0	269.335	4.295	20	30		CIEDRO
CC(C)(C#N)CCC[NH2+][C@H]1CCCCC12CCCC2	ZINC000382485025	336091388	/nfs/dbraw/zinc/09/13/88/336091388.db2.gz	GMYYANAAQMBNEC-HNNXBMFYSA-N	1	0	262.441	4.409	20	30		CIEDRO
CCC1([NH2+]Cc2ccc(C#N)cc2Cl)CCCC1	ZINC000382582287	336094661	/nfs/dbraw/zinc/09/46/61/336094661.db2.gz	WDZBUUGYUAPKCO-UHFFFAOYSA-N	1	0	262.784	4.024	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@H]2CCCCC23CCCC3)c1	ZINC000384057704	336121440	/nfs/dbraw/zinc/12/14/40/336121440.db2.gz	YCTPILGCZSZZCQ-KRWDZBQOSA-N	1	0	268.404	4.151	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000581732298	336139567	/nfs/dbraw/zinc/13/95/67/336139567.db2.gz	NRJQUVUKGNMYOY-CABCVRRESA-N	1	0	256.393	4.344	20	30		CIEDRO
CC(C)Oc1ccccc1[C@@H](C)[NH2+]Cc1ccc(C#N)cc1	ZINC000386013978	336164596	/nfs/dbraw/zinc/16/45/96/336164596.db2.gz	OJCWQFJQSGTWBZ-OAHLLOKOSA-N	1	0	294.398	4.196	20	30		CIEDRO
CC[C@H]1CCCC[C@@H]1[N@H+](C)Cc1ccc(C#N)s1	ZINC000581971207	336181178	/nfs/dbraw/zinc/18/11/78/336181178.db2.gz	MJLLKHLHBLARBF-WFASDCNBSA-N	1	0	262.422	4.020	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)c1ccc(OC)c(Br)c1	ZINC000386897420	336181939	/nfs/dbraw/zinc/18/19/39/336181939.db2.gz	OGQCRKRKDZAQJH-LLVKDONJSA-N	1	0	298.224	4.075	20	30		CIEDRO
C[C@H]([NH2+]C1CC(c2ccc(F)cc2)C1)c1ccc(C#N)cc1	ZINC000387280125	336190842	/nfs/dbraw/zinc/19/08/42/336190842.db2.gz	IUEULAYFODDCIW-LJSZUPLFSA-N	1	0	294.373	4.294	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@@H](C)c1nc2c(s1)CCCC2	ZINC000538408969	517325190	/nfs/dbraw/zinc/32/51/90/517325190.db2.gz	AKHNBYPKVVKYOU-OLZOCXBDSA-N	1	0	278.465	4.417	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)c1sc(-c2cccnc2)nc1C	ZINC000279894984	518702201	/nfs/dbraw/zinc/70/22/01/518702201.db2.gz	GTPHVTTYKNVIOY-LBPRGKRZSA-N	1	0	287.432	4.130	20	30		CIEDRO
CC[C@@H](CC#N)[NH2+][C@@H](C)c1cccc2ccccc21	ZINC000054183160	522467180	/nfs/dbraw/zinc/46/71/80/522467180.db2.gz	HZWKDJNFIHFBJU-ZFWWWQNUSA-N	1	0	252.361	4.183	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CCc2cc(F)ccc21)c1ccc(C#N)cc1	ZINC000278633871	522758641	/nfs/dbraw/zinc/75/86/41/522758641.db2.gz	HEQBMKPERMWAPX-OALUTQOASA-N	1	0	294.373	4.426	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1cc(C)cc(OC)c1)c1ccc(C#N)cc1	ZINC000278829016	522870323	/nfs/dbraw/zinc/87/03/23/522870323.db2.gz	TXFPVCZPIKETQK-LJQANCHMSA-N	1	0	294.398	4.116	20	30		CIEDRO
CC[C@@H]([NH2+][C@H](C)c1ccc(OC)cc1)c1ccc(C#N)cc1	ZINC000278675464	522938390	/nfs/dbraw/zinc/93/83/90/522938390.db2.gz	JMAFTKQWSCEHRM-AUUYWEPGSA-N	1	0	294.398	4.369	20	30		CIEDRO
CC[C@@H]([NH2+][C@H]1CCc2cc(F)ccc21)c1ccc(C#N)cc1	ZINC000278633868	522952095	/nfs/dbraw/zinc/95/20/95/522952095.db2.gz	HEQBMKPERMWAPX-MOPGFXCFSA-N	1	0	294.373	4.426	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+]Cc2cccc3ccccc32)C1	ZINC000192779044	534749200	/nfs/dbraw/zinc/74/92/00/534749200.db2.gz	PXYMMJUHQHGSKE-WMLDXEAASA-N	1	0	264.372	4.012	20	30		CIEDRO
Cc1cc([C@H](C)[NH2+][C@H](C)c2ccc(C#N)cc2)c(C)o1	ZINC000036991954	525529658	/nfs/dbraw/zinc/52/96/58/525529658.db2.gz	MKFOUTPQEZXKKB-OLZOCXBDSA-N	1	0	268.360	4.180	20	30		CIEDRO
C[C@H]([NH2+][C@H](c1ccccc1)C1CC1)c1ccc(C#N)cc1	ZINC000037075245	525598745	/nfs/dbraw/zinc/59/87/45/525598745.db2.gz	MASXFZLJOIMMKB-IFXJQAMLSA-N	1	0	276.383	4.360	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCCc2sccc21)c1cccc(C#N)c1	ZINC000061360183	525613863	/nfs/dbraw/zinc/61/38/63/525613863.db2.gz	PXPMVNJVRGIKBH-LRDDRELGSA-N	1	0	282.412	4.348	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCCc2sccc21)c1ccc(C#N)cc1	ZINC000061326716	525680894	/nfs/dbraw/zinc/68/08/94/525680894.db2.gz	QXURSYUGUYTXGF-WBMJQRKESA-N	1	0	282.412	4.348	20	30		CIEDRO
Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(C#N)cc2)s1	ZINC000036991882	525747367	/nfs/dbraw/zinc/74/73/67/525747367.db2.gz	WTKFQIBQSLRJRU-CHWSQXEVSA-N	1	0	270.401	4.340	20	30		CIEDRO
N#Cc1ccc(C[N@@H+]2CCCCC[C@@H]2c2ccncc2)s1	ZINC000157026173	526612151	/nfs/dbraw/zinc/61/21/51/526612151.db2.gz	FBYYALWGVHSWJG-QGZVFWFLSA-N	1	0	297.427	4.132	20	30		CIEDRO
C=CC1CC[NH+](Cc2cnc(C3CCCC3)s2)CC1	ZINC000353587877	526980143	/nfs/dbraw/zinc/98/01/43/526980143.db2.gz	BVOOTLYAWJTJMO-UHFFFAOYSA-N	1	0	276.449	4.199	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1nc2ccccc2[nH]1)c1ccccc1	ZINC000344854236	527449396	/nfs/dbraw/zinc/44/93/96/527449396.db2.gz	LZEAKMGZTOUMNL-MRXNPFEDSA-N	1	0	291.398	4.360	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCCC(C)(F)F)c1ccco1	ZINC000296637740	527483663	/nfs/dbraw/zinc/48/36/63/527483663.db2.gz	BVIKJWBNSIOMGL-LBPRGKRZSA-N	1	0	257.324	4.312	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccc(CC)nc1)c1ccccc1	ZINC000352761724	527485379	/nfs/dbraw/zinc/48/53/79/527485379.db2.gz	YUCJJUOOLXYKRO-IBGZPJMESA-N	1	0	280.415	4.441	20	30		CIEDRO
CCO[C@H]1C[C@@H]([NH2+]CC(C)(C)CCC#N)C12CCCCC2	ZINC000348226988	528097005	/nfs/dbraw/zinc/09/70/05/528097005.db2.gz	MYARLASOUULLPY-CVEARBPZSA-N	1	0	292.467	4.034	20	30		CIEDRO
CCC[C@H]([NH2+]CC(C)(C)CCC#N)c1ccc(OC)cc1	ZINC000348222202	528215189	/nfs/dbraw/zinc/21/51/89/528215189.db2.gz	IBNPRPYUPUZQFV-KRWDZBQOSA-N	1	0	288.435	4.456	20	30		CIEDRO
CCOc1ccc(Cl)cc1[C@H](C)[NH2+]CC1(CC#N)CC1	ZINC000430764849	528475020	/nfs/dbraw/zinc/47/50/20/528475020.db2.gz	UFMNJOMCQJKBLV-LBPRGKRZSA-N	1	0	292.810	4.083	20	30		CIEDRO
CCC(CC)C[N@H+](CCC#N)Cc1ccc(C)s1	ZINC000353423613	528749783	/nfs/dbraw/zinc/74/97/83/528749783.db2.gz	QOYACUHMXBUPPA-UHFFFAOYSA-N	1	0	264.438	4.208	20	30		CIEDRO
CCC(CC)C[N@H+](CCC#N)Cc1ccc2ncccc2c1	ZINC000353424248	528749890	/nfs/dbraw/zinc/74/98/90/528749890.db2.gz	SWZDURBUQDSLKW-UHFFFAOYSA-N	1	0	295.430	4.387	20	30		CIEDRO
C=C(C)C[N@H+](CC)CCC(=O)Nc1cccc2ccccc21	ZINC000097006616	185150925	/nfs/dbraw/zinc/15/09/25/185150925.db2.gz	LSSNGYJTQUXGBB-UHFFFAOYSA-N	1	0	296.414	4.066	20	30		CIEDRO
CC[C@H]([NH2+]CC(C)(C)CCC#N)c1cccc(OC)c1	ZINC000348217570	529589767	/nfs/dbraw/zinc/58/97/67/529589767.db2.gz	AWSQEOFMCKSWOW-INIZCTEOSA-N	1	0	274.408	4.066	20	30		CIEDRO
C[C@@H]1C[C@@H](c2ccccc2)[N@H+](Cc2cc(C#N)cs2)C1	ZINC000574320825	335010040	/nfs/dbraw/zinc/01/00/40/335010040.db2.gz	ZROTZZVNLDEVDZ-DYVFJYSZSA-N	1	0	282.412	4.203	20	30		CIEDRO
C=CC[N@@H+](CCc1ccc(C)cc1)Cc1cccc(C#N)c1	ZINC000574674211	335038565	/nfs/dbraw/zinc/03/85/65/335038565.db2.gz	HLNXLYBTPQBXBB-UHFFFAOYSA-N	1	0	290.410	4.097	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]Cc1coc(-c2ccccc2)n1	ZINC000574697593	335040598	/nfs/dbraw/zinc/04/05/98/335040598.db2.gz	LRPMKXGMRARQAY-UHFFFAOYSA-N	1	0	270.376	4.034	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H](C)c2ccc(C)o2)cc1	ZINC000034993646	260003448	/nfs/dbraw/zinc/00/34/48/260003448.db2.gz	MZYLJBSOYBFTES-CQSZACIVSA-N	1	0	271.360	4.004	20	30		CIEDRO
CCO[C@H](CC[NH2+][C@H](CC)c1ccc(C#N)cc1)C(C)C	ZINC000447531756	260036957	/nfs/dbraw/zinc/03/69/57/260036957.db2.gz	QVRKEQZBSYTOGJ-QZTJIDSGSA-N	1	0	288.435	4.050	20	30		CIEDRO
Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCc3cc(C#N)ccc32)o1	ZINC000341757060	130024112	/nfs/dbraw/zinc/02/41/12/130024112.db2.gz	HOCFGALTTXUTBQ-CXAGYDPISA-N	1	0	280.371	4.188	20	30		CIEDRO
Cc1ccc([C@H](C)[NH2+][C@@H]2CCCc3cc(C#N)ccc32)o1	ZINC000341757063	130024817	/nfs/dbraw/zinc/02/48/17/130024817.db2.gz	HOCFGALTTXUTBQ-SUMWQHHRSA-N	1	0	280.371	4.188	20	30		CIEDRO
N#Cc1ccc2c(c1)CCC[C@H]2[NH2+]Cc1ccc(F)c(F)c1	ZINC000341758638	130025984	/nfs/dbraw/zinc/02/59/84/130025984.db2.gz	CFCDAUMSMUUSPN-GOSISDBHSA-N	1	0	298.336	4.004	20	30		CIEDRO
Cc1ccccc1C[NH2+][C@@H]1CCCc2cc(C#N)ccc21	ZINC000341760814	130026553	/nfs/dbraw/zinc/02/65/53/130026553.db2.gz	MIEBWTDYAVXGAB-LJQANCHMSA-N	1	0	276.383	4.034	20	30		CIEDRO
C[C@@H]1CCC[C@H]([NH2+][C@H]2CCCc3cc(C#N)ccc32)C1	ZINC000341763246	130028091	/nfs/dbraw/zinc/02/80/91/130028091.db2.gz	WIGSBXXXXSXXBK-SKDZVZGDSA-N	1	0	268.404	4.104	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)c1cccc(F)c1	ZINC000020147843	171035251	/nfs/dbraw/zinc/03/52/51/171035251.db2.gz	ZVWSNNKEEDGEJV-QWHCGFSZSA-N	1	0	268.335	4.109	20	30		CIEDRO
Cc1ccc(C[C@H]2CCC[N@@H+]2CC(C)(C)CCC#N)cc1	ZINC000514080997	260070792	/nfs/dbraw/zinc/07/07/92/260070792.db2.gz	ABPGWQOQTUJDLH-GOSISDBHSA-N	1	0	284.447	4.332	20	30		CIEDRO
C[C@H]([NH2+][C@@H](C)c1ccc(OCC#N)cc1)c1ccccc1	ZINC000037185699	260072977	/nfs/dbraw/zinc/07/29/77/260072977.db2.gz	ACHVSVWQRRUJOD-GJZGRUSLSA-N	1	0	280.371	4.001	20	30		CIEDRO
C[C@@H]1CCCC[C@@H]1CC[NH2+]CC(C)(C)CCC#N	ZINC000344373720	225053544	/nfs/dbraw/zinc/05/35/44/225053544.db2.gz	IJUUXXMSGQZCGX-HUUCEWRRSA-N	1	0	250.430	4.122	20	30		CIEDRO
C[C@H](CCc1ccc(Cl)s1)[NH2+]CCCCC#N	ZINC000344477377	225069814	/nfs/dbraw/zinc/06/98/14/225069814.db2.gz	AAJVOUQKSGGSMK-LLVKDONJSA-N	1	0	270.829	4.006	20	30		CIEDRO
N#CCC[C@@H]([NH2+]Cc1cccc2cc[nH]c21)c1ccccc1	ZINC000344846867	225179545	/nfs/dbraw/zinc/17/95/45/225179545.db2.gz	FZNYPJCBBWJEGI-GOSISDBHSA-N	1	0	289.382	4.303	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H]1CCCc2c3cc(C)ccc3[nH]c21	ZINC000575166093	335074369	/nfs/dbraw/zinc/07/43/69/335074369.db2.gz	XISVBNLYCNPBDV-CXAGYDPISA-N	1	0	268.404	4.408	20	30		CIEDRO
CC[C@@H](Cc1ccccc1)[NH2+][C@H]1CCc2ccc(C#N)cc21	ZINC000575167890	335074456	/nfs/dbraw/zinc/07/44/56/335074456.db2.gz	XKEHMDCIXMPDAD-ICSRJNTNSA-N	1	0	290.410	4.156	20	30		CIEDRO
COc1cc(C[NH2+][C@@H](C)c2cc(C)cc(C)c2)ccc1C#N	ZINC000575168310	335074664	/nfs/dbraw/zinc/07/46/64/335074664.db2.gz	JAEJLNAEXNRJJO-HNNXBMFYSA-N	1	0	294.398	4.035	20	30		CIEDRO
N#CC1CCC(C[NH2+][C@@H]2CCCc3cc(F)ccc32)CC1	ZINC000442868844	226687562	/nfs/dbraw/zinc/68/75/62/226687562.db2.gz	ONKYWHWLYBYIBM-WTNGLUPJSA-N	1	0	286.394	4.123	20	30		CIEDRO
N#Cc1ccc2c(c1)[C@@H]([NH2+][C@H]1CCCc3ccccc31)CC2	ZINC000353320553	228085210	/nfs/dbraw/zinc/08/52/10/228085210.db2.gz	BGZUFVCVZKBIHY-PMACEKPBSA-N	1	0	288.394	4.213	20	30		CIEDRO
N#Cc1ccc2c(c1)[C@H]([NH2+][C@H]1CCCc3ccccc31)CC2	ZINC000353320555	228085394	/nfs/dbraw/zinc/08/53/94/228085394.db2.gz	BGZUFVCVZKBIHY-VQTJNVASSA-N	1	0	288.394	4.213	20	30		CIEDRO
CC(C)(C)[C@H]([NH2+]Cc1ccc(C#N)cc1)c1ccccc1	ZINC000036994625	260061110	/nfs/dbraw/zinc/06/11/10/260061110.db2.gz	WMJSCKMKLCDGGT-GOSISDBHSA-N	1	0	278.399	4.435	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCSc2ccccc21)c1cccc(C#N)c1	ZINC000037316084	260085306	/nfs/dbraw/zinc/08/53/06/260085306.db2.gz	JNSGJPCVKLXRJH-SUMWQHHRSA-N	1	0	294.423	4.446	20	30		CIEDRO
Cc1ccccc1[C@@H]1CCC[N@@H+]1Cc1cc(C#N)cs1	ZINC000180153784	260095031	/nfs/dbraw/zinc/09/50/31/260095031.db2.gz	AUWFSFBDQAPNDJ-KRWDZBQOSA-N	1	0	282.412	4.265	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H](C)c1cccc(F)c1F	ZINC000394128003	260112195	/nfs/dbraw/zinc/11/21/95/260112195.db2.gz	BXVQHPFEPXMHCM-LLVKDONJSA-N	1	0	253.336	4.218	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@H]2CCCCc3ccccc32)c1	ZINC000037748576	260116068	/nfs/dbraw/zinc/11/60/68/260116068.db2.gz	KVEGLLSPMCVIMB-IBGZPJMESA-N	1	0	276.383	4.116	20	30		CIEDRO
CCCCOc1ccc(C[NH2+]Cc2cccc(C#N)c2)cc1	ZINC000073870151	260164826	/nfs/dbraw/zinc/16/48/26/260164826.db2.gz	IEAZMHLJAJUFTR-UHFFFAOYSA-N	1	0	294.398	4.027	20	30		CIEDRO
CC(C)Oc1ccc([C@H](C)[NH2+]Cc2ccc(C#N)cc2)cc1	ZINC000078968469	260172408	/nfs/dbraw/zinc/17/24/08/260172408.db2.gz	UMNOHZGNFOSUQZ-HNNXBMFYSA-N	1	0	294.398	4.196	20	30		CIEDRO
CC(C)(C#N)CCC[NH+]1CCC2(CCCCC2)CC1	ZINC000087608698	260192520	/nfs/dbraw/zinc/19/25/20/260192520.db2.gz	PYEDZDVALFVDMY-UHFFFAOYSA-N	1	0	262.441	4.363	20	30		CIEDRO
C=CCSCC[NH2+][C@H](C)c1ccc(F)cc1Cl	ZINC000221942725	260224099	/nfs/dbraw/zinc/22/40/99/260224099.db2.gz	QJMOXOHMQSLCBV-SNVBAGLBSA-N	1	0	273.804	4.049	20	30		CIEDRO
C=CCCCC[NH2+][C@@H](C)c1ccccc1OC(F)F	ZINC000311631037	260255116	/nfs/dbraw/zinc/25/51/16/260255116.db2.gz	OSCAWUHFAJGKTL-LBPRGKRZSA-N	1	0	269.335	4.295	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)c1ccccc1Br	ZINC000088162707	260278635	/nfs/dbraw/zinc/27/86/35/260278635.db2.gz	PBNQZDNOEBLFKA-NSHDSACASA-N	1	0	268.198	4.066	20	30		CIEDRO
CCCC[C@@H](CCC)[NH2+]C1CCC(C)(C#N)CC1	ZINC000449187416	260284934	/nfs/dbraw/zinc/28/49/34/260284934.db2.gz	QOIAGJJJNOGKKZ-QQFBHYJXSA-N	1	0	250.430	4.407	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1csc(Cl)c1Cl	ZINC000308900321	260296686	/nfs/dbraw/zinc/29/66/86/260296686.db2.gz	BEWPXQOPHPOAKF-VIFPVBQESA-N	1	0	264.221	4.499	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H](C)Cc2ccccc2F)cc1	ZINC000518263397	260363243	/nfs/dbraw/zinc/36/32/43/260363243.db2.gz	MMFWAWNSWZUKPA-HNNXBMFYSA-N	1	0	299.389	4.111	20	30		CIEDRO
Cc1ccccc1[C@@H](C)[NH2+]CCCCC(C)(C)C#N	ZINC000235193336	260408402	/nfs/dbraw/zinc/40/84/02/260408402.db2.gz	UBBDRFDFOTXSSE-OAHLLOKOSA-N	1	0	258.409	4.366	20	30		CIEDRO
C[C@@H](CCc1ccc(Cl)s1)[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000449444786	260589610	/nfs/dbraw/zinc/58/96/10/260589610.db2.gz	DHKFZWTVSBUMFF-AVGNSLFASA-N	1	0	296.867	4.395	20	30		CIEDRO
CC[C@H]([NH2+]CCCCC#N)c1ccccc1OC(F)F	ZINC000118978007	260691000	/nfs/dbraw/zinc/69/10/00/260691000.db2.gz	DOPITJDIOMVPEU-ZDUSSCGKSA-N	1	0	282.334	4.023	20	30		CIEDRO
N#Cc1c(F)cccc1C[NH2+][C@H]1CCC[C@H]1c1ccccc1	ZINC000428497091	260768178	/nfs/dbraw/zinc/76/81/78/260768178.db2.gz	TVTSORJBGVPQNS-LPHOPBHVSA-N	1	0	294.373	4.123	20	30		CIEDRO
N#CCCC[N@H+](Cc1cccc(-c2cccnc2)c1)C1CC1	ZINC000136108501	260924195	/nfs/dbraw/zinc/92/41/95/260924195.db2.gz	PKIFMOLELJQKSW-UHFFFAOYSA-N	1	0	291.398	4.017	20	30		CIEDRO
C=CC[C@H](C)[NH2+]Cc1ccc(-c2ccccc2OC)cc1	ZINC000525709754	261055181	/nfs/dbraw/zinc/05/51/81/261055181.db2.gz	QXQGDOPKBXMPPG-HNNXBMFYSA-N	1	0	281.399	4.416	20	30		CIEDRO
C=C(C)COCC[NH2+][C@H](C)c1ccc2cc(OC)ccc2c1	ZINC000318432046	261081002	/nfs/dbraw/zinc/08/10/02/261081002.db2.gz	MIKOUMFQTHHRDV-OAHLLOKOSA-N	1	0	299.414	4.092	20	30		CIEDRO
CCCC[C@@H](CC)C[NH2+]C1CCC(C)(C#N)CC1	ZINC000449065629	261144135	/nfs/dbraw/zinc/14/41/35/261144135.db2.gz	VAHDKYTZLOWWHB-QQFBHYJXSA-N	1	0	250.430	4.265	20	30		CIEDRO
CC[C@H](Cc1ccc(C)cc1)[N@H+](CC)CCCCC#N	ZINC000173992134	261174159	/nfs/dbraw/zinc/17/41/59/261174159.db2.gz	LTJIICPHJSNARG-GOSISDBHSA-N	1	0	272.436	4.332	20	30		CIEDRO
Cc1ccc([C@@H]2CCC[N@@H+]2CCCCC#N)cc1C	ZINC000102398115	261232908	/nfs/dbraw/zinc/23/29/08/261232908.db2.gz	WYCQLSDBYCPAND-KRWDZBQOSA-N	1	0	256.393	4.134	20	30		CIEDRO
CC(C)Cc1ncc(C[NH2+][C@@H](C)c2ccc(C#N)cc2)s1	ZINC000161987970	261265138	/nfs/dbraw/zinc/26/51/38/261265138.db2.gz	YETVVUVNTFGFPP-ZDUSSCGKSA-N	1	0	299.443	4.064	20	30		CIEDRO
CC(C)(C)C[C@@H]1CC[N@H+](CCCC(C)(C)C#N)C1	ZINC000307770431	261391669	/nfs/dbraw/zinc/39/16/69/261391669.db2.gz	FLFWILLGOLSSQA-AWEZNQCLSA-N	1	0	250.430	4.074	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]CCCc1ccc(Cl)cc1	ZINC000174355282	261568629	/nfs/dbraw/zinc/56/86/29/261568629.db2.gz	WWFDGVHLXZYBAX-UHFFFAOYSA-N	1	0	278.827	4.192	20	30		CIEDRO
Cc1cccc([C@H](C)[NH2+]Cc2ccc(OCC#N)cc2)c1C	ZINC000180559951	261866381	/nfs/dbraw/zinc/86/63/81/261866381.db2.gz	QTXLZOKICMATJI-INIZCTEOSA-N	1	0	294.398	4.057	20	30		CIEDRO
CC[C@H]([NH2+]CCCC(C)(C)C#N)c1ccc(OC)cc1	ZINC000181810303	261912760	/nfs/dbraw/zinc/91/27/60/261912760.db2.gz	MXOQOGMJKCJTDK-INIZCTEOSA-N	1	0	274.408	4.066	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](CCC#N)c1ccccc1)c1ccc(C#N)cc1	ZINC000182052504	261921089	/nfs/dbraw/zinc/92/10/89/261921089.db2.gz	HQJDSTWBIQQBMI-BEFAXECRSA-N	1	0	289.382	4.254	20	30		CIEDRO
C[C@@H]([NH2+]CCCC#N)[C@@H](C)c1ccccc1C(F)(F)F	ZINC000184088432	262008078	/nfs/dbraw/zinc/00/80/78/262008078.db2.gz	CYXXZFLEBVMJGL-VXGBXAGGSA-N	1	0	284.325	4.091	20	30		CIEDRO
Cc1cncc([C@@H](C)[NH2+][C@@H](CCC#N)c2ccccc2)c1	ZINC000184419389	262019677	/nfs/dbraw/zinc/01/96/77/262019677.db2.gz	GDJAETUZTFKHCF-QAPCUYQASA-N	1	0	279.387	4.086	20	30		CIEDRO
Cc1cc([C@@H](C)[NH2+][C@@H]2CCC[C@H](C#N)C2)c(C)s1	ZINC000185770069	262069727	/nfs/dbraw/zinc/06/97/27/262069727.db2.gz	BXGNBTKOSQNECK-KWCYVHTRSA-N	1	0	262.422	4.098	20	30		CIEDRO
CC(C)Oc1cccc([C@H](C)[NH2+][C@H]2CCC[C@H](C#N)C2)c1	ZINC000185780432	262070746	/nfs/dbraw/zinc/07/07/46/262070746.db2.gz	WXIOKJFLQSYHQI-ZOBUZTSGSA-N	1	0	286.419	4.207	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1cccc(OC(F)F)c1	ZINC000185779937	262070908	/nfs/dbraw/zinc/07/09/08/262070908.db2.gz	KSUHZNNOGJYHOQ-OBJOEFQTSA-N	1	0	294.345	4.021	20	30		CIEDRO
CC[N@H+](CCOc1ccccc1)[C@H](C)c1ccc(C#N)cc1	ZINC000497593590	262179222	/nfs/dbraw/zinc/17/92/22/262179222.db2.gz	FNDYBTUETVEVNE-MRXNPFEDSA-N	1	0	294.398	4.020	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+]Cc1ccc(SC)s1	ZINC000390402597	262189373	/nfs/dbraw/zinc/18/93/73/262189373.db2.gz	AIUQBUMXRDNTAA-LLVKDONJSA-N	1	0	255.452	4.304	20	30		CIEDRO
C[C@H]([NH2+][C@H](CCC#N)c1ccccc1)c1cccc(O)c1	ZINC000194935152	262243635	/nfs/dbraw/zinc/24/36/35/262243635.db2.gz	ROYMTZSBLJNNEC-KBXCAEBGSA-N	1	0	280.371	4.088	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1cscc1C)c1ccc(C#N)cc1	ZINC000494479268	262272910	/nfs/dbraw/zinc/27/29/10/262272910.db2.gz	VAQXTPOVASIEMG-MRXNPFEDSA-N	1	0	270.401	4.169	20	30		CIEDRO
CC1(C)[C@H]([NH2+]Cc2cccc(C#N)c2)C[C@@H]1c1ccccc1	ZINC000463542621	262334747	/nfs/dbraw/zinc/33/47/47/262334747.db2.gz	MBAISQOPNJKHSM-RTBURBONSA-N	1	0	290.410	4.230	20	30		CIEDRO
CC(C)[C@@H]([NH2+][C@H](C)CCC#N)c1ccc(Cl)cc1	ZINC000411785148	262706533	/nfs/dbraw/zinc/70/65/33/262706533.db2.gz	AZLZXPMWTDWWLS-IUODEOHRSA-N	1	0	264.800	4.319	20	30		CIEDRO
C[C@H](CCC#N)[NH2+][C@H](c1ccc(F)c(Cl)c1)C1CC1	ZINC000411797221	262706874	/nfs/dbraw/zinc/70/68/74/262706874.db2.gz	UCCLHMLJTSYBMF-BMIGLBTASA-N	1	0	280.774	4.212	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H]2C[C@H](c3cccc(Cl)c3)C2)cc1	ZINC000435782043	262748448	/nfs/dbraw/zinc/74/84/48/262748448.db2.gz	MSAOGRTTXCWWBK-SAABIXHNSA-N	1	0	296.801	4.247	20	30		CIEDRO
Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]CC(C)(C)CC#N	ZINC000414164497	262819706	/nfs/dbraw/zinc/81/97/06/262819706.db2.gz	KFVYJBSFPQPFFY-NSHDSACASA-N	1	0	293.480	4.340	20	30		CIEDRO
C[C@@H]([NH2+]C1(c2ccccc2)CCC1)c1ccc(C#N)c(F)c1	ZINC000272060955	263001926	/nfs/dbraw/zinc/00/19/26/263001926.db2.gz	OYZABVSKURMKRA-CQSZACIVSA-N	1	0	294.373	4.427	20	30		CIEDRO
CC1(C#N)CC[NH+](Cc2ccc(-c3ccccc3)o2)CC1	ZINC000272570850	263006917	/nfs/dbraw/zinc/00/69/17/263006917.db2.gz	VXBWRZMWNHTTAC-UHFFFAOYSA-N	1	0	280.371	4.072	20	30		CIEDRO
CC[C@H]([NH2+]CCCSCC#N)c1ccc(Cl)s1	ZINC000273226235	263014229	/nfs/dbraw/zinc/01/42/29/263014229.db2.gz	BTNKPLCGCXSKIT-JTQLQIEISA-N	1	0	288.869	4.089	20	30		CIEDRO
C[C@@H]([NH2+]CCCC#N)c1ccc(N2CCCCCC2)cc1	ZINC000273301707	263014958	/nfs/dbraw/zinc/01/49/58/263014958.db2.gz	UVDZTZWDXSCILK-MRXNPFEDSA-N	1	0	285.435	4.021	20	30		CIEDRO
CC[C@H](CC#N)[NH2+][C@H]1CC=C(c2ccc(F)cc2)CC1	ZINC000273834541	263019881	/nfs/dbraw/zinc/01/98/81/263019881.db2.gz	GQBWTMNTUKLBBK-SJORKVTESA-N	1	0	272.367	4.043	20	30		CIEDRO
COc1ccc2oc([C@H](C)[NH2+][C@H]3CC[C@H](C#N)C3)c(C)c2c1	ZINC000274603124	263027421	/nfs/dbraw/zinc/02/74/21/263027421.db2.gz	IHLFRACDXXCYNJ-IHRRRGAJSA-N	1	0	298.386	4.093	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CC[C@H](C#N)C1)c1cccc(Cl)c1	ZINC000274633973	263028285	/nfs/dbraw/zinc/02/82/85/263028285.db2.gz	PMBSZWSCXSJNIW-CQDKDKBSSA-N	1	0	262.784	4.073	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](C#N)C1)c1cccc(Cl)c1Cl	ZINC000274648433	263028530	/nfs/dbraw/zinc/02/85/30/263028530.db2.gz	SJHBKRWXHRKIIT-AXFHLTTASA-N	1	0	283.202	4.336	20	30		CIEDRO
C=C(C)[C@H]([NH2+]CCC(C)(C)C#N)c1ccc(F)c(F)c1	ZINC000274923284	263031700	/nfs/dbraw/zinc/03/17/00/263031700.db2.gz	ZJTNPBUBHLBZLZ-HNNXBMFYSA-N	1	0	278.346	4.111	20	30		CIEDRO
C[C@H]([NH2+]CCCC(C)(C)C#N)[C@@H]1CCC[C@H](C)C1	ZINC000452068476	263034043	/nfs/dbraw/zinc/03/40/43/263034043.db2.gz	NCHAXEPXDVFKNQ-SOUVJXGZSA-N	1	0	250.430	4.121	20	30		CIEDRO
CC(C)[C@@H]1C[C@H]([NH2+][C@H](CCC#N)c2ccccc2)CS1	ZINC000277262164	263040495	/nfs/dbraw/zinc/04/04/95/263040495.db2.gz	PBDBGWVXYPUFPI-BBWFWOEESA-N	1	0	288.460	4.151	20	30		CIEDRO
CC[N@H+](CCCCC(C)(C)C#N)[C@H](C)c1cccc(O)c1	ZINC000277649125	263042629	/nfs/dbraw/zinc/04/26/29/263042629.db2.gz	IEDJWZSUZJJMEJ-OAHLLOKOSA-N	1	0	288.435	4.495	20	30		CIEDRO
C[C@@H]([NH2+]CCCCC(C)(C)C#N)c1ccc(F)cc1F	ZINC000277664279	263042794	/nfs/dbraw/zinc/04/27/94/263042794.db2.gz	JFWJKTFCJPLCFQ-GFCCVEGCSA-N	1	0	280.362	4.335	20	30		CIEDRO
CC1(C#N)CC[NH+](Cc2ccc(C3CCC3)cc2)CC1	ZINC000278371535	263047567	/nfs/dbraw/zinc/04/75/67/263047567.db2.gz	GNMQYHBSONOMBX-UHFFFAOYSA-N	1	0	268.404	4.080	20	30		CIEDRO
CCc1ccc([C@H](C)[NH2+]CC2CCC(C#N)CC2)s1	ZINC000282154477	263074681	/nfs/dbraw/zinc/07/46/81/263074681.db2.gz	CZLYYQYHTHJSIY-HSBZDZAISA-N	1	0	276.449	4.291	20	30		CIEDRO
CSc1ccccc1[C@@H](C)[NH2+][C@@H]1CCC[C@@H](C#N)C1	ZINC000282780546	263078712	/nfs/dbraw/zinc/07/87/12/263078712.db2.gz	PMOPNWLPUBHAPX-MGPQQGTHSA-N	1	0	274.433	4.141	20	30		CIEDRO
CSc1ccccc1[C@@H](C)[NH2+][C@H]1CCC[C@H](C#N)C1	ZINC000282780548	263078845	/nfs/dbraw/zinc/07/88/45/263078845.db2.gz	PMOPNWLPUBHAPX-RDBSUJKOSA-N	1	0	274.433	4.141	20	30		CIEDRO
CSc1ccccc1[C@@H](C)[NH2+][C@@H]1CCC[C@H](C#N)C1	ZINC000282780543	263078850	/nfs/dbraw/zinc/07/88/50/263078850.db2.gz	PMOPNWLPUBHAPX-HZSPNIEDSA-N	1	0	274.433	4.141	20	30		CIEDRO
CC[C@H](CC#N)[NH2+]C[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000289485578	263110424	/nfs/dbraw/zinc/11/04/24/263110424.db2.gz	BEGMPFXZTBKITB-SMDDNHRTSA-N	1	0	284.325	4.091	20	30		CIEDRO
CC(C)(CCC#N)C[N@@H+]1CCCn2c(cc3ccccc32)C1	ZINC000290185551	263115272	/nfs/dbraw/zinc/11/52/72/263115272.db2.gz	OBIFMTAYTLPKCB-UHFFFAOYSA-N	1	0	295.430	4.177	20	30		CIEDRO
CC(C)Oc1ccc([C@H]2CCC[C@@H]2[NH2+]CCCC#N)cc1	ZINC000366677249	263115586	/nfs/dbraw/zinc/11/55/86/263115586.db2.gz	KFFJXEHSHZMBDR-MSOLQXFVSA-N	1	0	286.419	4.003	20	30		CIEDRO
CC(C)[N@H+](CCCSCC#N)[C@H](C)c1ccccc1	ZINC000292117075	263128666	/nfs/dbraw/zinc/12/86/66/263128666.db2.gz	HSWHFMUSIKUASB-OAHLLOKOSA-N	1	0	276.449	4.105	20	30		CIEDRO
C[C@H]([NH2+][C@H](CCCC#N)c1ccccc1)c1cccnc1	ZINC000340451046	263155670	/nfs/dbraw/zinc/15/56/70/263155670.db2.gz	ZJNGBFLFDPGVEK-MAUKXSAKSA-N	1	0	279.387	4.167	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH+]2CCC(c3ccc(Cl)cc3)CC2)C1	ZINC000294485461	263162722	/nfs/dbraw/zinc/16/27/22/263162722.db2.gz	HLXVPCUZANKQRC-DYVFJYSZSA-N	1	0	288.822	4.212	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+]Cc2ccc(Cl)c3cccnc23)C1	ZINC000295041371	263171260	/nfs/dbraw/zinc/17/12/60/263171260.db2.gz	MQDZYYAOURMGJZ-JSGCOSHPSA-N	1	0	299.805	4.060	20	30		CIEDRO
CC1(C)[C@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)C[C@H]1c1ccccc1	ZINC000296272276	263188782	/nfs/dbraw/zinc/18/87/82/263188782.db2.gz	DPYMHQNCKGZOBQ-LEUOFYLZSA-N	1	0	282.431	4.241	20	30		CIEDRO
CC(C)Oc1ccc([C@H](C)[NH2+][C@H]2CC[C@@H](CC#N)C2)cc1	ZINC000296279084	263189297	/nfs/dbraw/zinc/18/92/97/263189297.db2.gz	DYPLGMDFCWQOSI-ZOBUZTSGSA-N	1	0	286.419	4.207	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@@H]2CCCc3c4ccccc4[nH]c32)C1	ZINC000296355388	263190423	/nfs/dbraw/zinc/19/04/23/263190423.db2.gz	IMCMOGXQPGSQNO-SUNYJGFJSA-N	1	0	293.414	4.217	20	30		CIEDRO
CC[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1cc(F)ccc1F	ZINC000296361628	263190736	/nfs/dbraw/zinc/19/07/36/263190736.db2.gz	ISTVUXBSFNWHBC-DETPVDSQSA-N	1	0	278.346	4.088	20	30		CIEDRO
CC[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccc(Cl)cc1	ZINC000296508381	263192360	/nfs/dbraw/zinc/19/23/60/263192360.db2.gz	PKMWFDGVMBOYAO-VBNZEHGJSA-N	1	0	276.811	4.463	20	30		CIEDRO
COc1cccc2cc([C@@H](C)[NH2+][C@H]3CC[C@@H](CC#N)C3)oc21	ZINC000296569942	263192953	/nfs/dbraw/zinc/19/29/53/263192953.db2.gz	SWGPYXMVXBQPQT-IPYPFGDCSA-N	1	0	298.386	4.174	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@H](c2ccc(Cl)cc2)C2CC2)C1	ZINC000296647571	263194929	/nfs/dbraw/zinc/19/49/29/263194929.db2.gz	YPWBTPIQNJCGRK-ZLIFDBKOSA-N	1	0	288.822	4.463	20	30		CIEDRO
C[C@H](CCC#N)[NH2+][C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000298459579	263220024	/nfs/dbraw/zinc/22/00/24/263220024.db2.gz	IBPWIXUEEQZSKP-MNOVXSKESA-N	1	0	270.298	4.048	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)CCC#N)c1ccc(Oc2cccnc2)cc1	ZINC000298650831	263223398	/nfs/dbraw/zinc/22/33/98/263223398.db2.gz	XLBYCFIGZMTECR-LSDHHAIUSA-N	1	0	295.386	4.217	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@@H](C)c1nc2ccc(Cl)cc2n1C	ZINC000453303763	263225119	/nfs/dbraw/zinc/22/51/19/263225119.db2.gz	DASUVVFZSIFLBE-NSHDSACASA-N	1	0	291.826	4.090	20	30		CIEDRO
CC[C@@H]([NH2+][C@H](C)CCC#N)c1ccc(Cl)cc1	ZINC000299690035	263252397	/nfs/dbraw/zinc/25/23/97/263252397.db2.gz	NUFOYGWNCJXOOK-BXUZGUMPSA-N	1	0	250.773	4.073	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H](C)CCC#N)c1ccccc1OC(F)F	ZINC000299733118	263253873	/nfs/dbraw/zinc/25/38/73/263253873.db2.gz	YGPVXPBOYKAPSW-WCQYABFASA-N	1	0	282.334	4.021	20	30		CIEDRO
C=C(C)CN1CCC([NH2+][C@H](CCC)c2ccsc2)CC1	ZINC000187705802	263267054	/nfs/dbraw/zinc/26/70/54/263267054.db2.gz	IWAZPQKCCFXXJB-QGZVFWFLSA-N	1	0	292.492	4.219	20	30		CIEDRO
N#CCCC[NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCC1	ZINC000342047399	263383183	/nfs/dbraw/zinc/38/31/83/263383183.db2.gz	LRGHXCWNLBWSCO-OAHLLOKOSA-N	1	0	296.336	4.440	20	30		CIEDRO
C[C@H](CCC(F)(F)F)[NH2+][C@@H]1CCCc2cc(C#N)ccc21	ZINC000417372120	263892360	/nfs/dbraw/zinc/89/23/60/263892360.db2.gz	VQSZRANSBRNBKP-IAQYHMDHSA-N	1	0	296.336	4.256	20	30		CIEDRO
Cc1ccc2cc([C@H](C)[NH2+]CCCCC#N)oc2c1	ZINC000426012358	264308683	/nfs/dbraw/zinc/30/86/83/264308683.db2.gz	DGZFVXITHWNUDF-ZDUSSCGKSA-N	1	0	256.349	4.086	20	30		CIEDRO
C[C@H]([NH2+]Cc1cc(C#N)n(C)c1)c1ccc(C(C)(C)C)cc1	ZINC000189581593	264309894	/nfs/dbraw/zinc/30/98/94/264309894.db2.gz	CPLCEZNIUKTCJV-AWEZNQCLSA-N	1	0	295.430	4.045	20	30		CIEDRO
C[C@@H]([NH2+]Cc1cc(C#N)n(C)c1)c1ccc(C(C)(C)C)cc1	ZINC000189581619	264310490	/nfs/dbraw/zinc/31/04/90/264310490.db2.gz	CPLCEZNIUKTCJV-CQSZACIVSA-N	1	0	295.430	4.045	20	30		CIEDRO
C[C@@H](c1ccccc1)[N@H+](CC1(C#N)CC1)C1CCCC1	ZINC000425460601	264333148	/nfs/dbraw/zinc/33/31/48/264333148.db2.gz	SEZFXSQZYXBRPA-HNNXBMFYSA-N	1	0	268.404	4.296	20	30		CIEDRO
C#CC[C@H]([NH2+][C@@H]1CCCc2ccc(O)cc21)c1ccccc1	ZINC000285134596	264554555	/nfs/dbraw/zinc/55/45/55/264554555.db2.gz	LOTORQUGXRPMPX-VQTJNVASSA-N	1	0	291.394	4.124	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1cccc(OC)c1)c1ccco1	ZINC000285687698	264557588	/nfs/dbraw/zinc/55/75/88/264557588.db2.gz	OFZNIDIJAQFWIU-MRXNPFEDSA-N	1	0	271.360	4.085	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H](C)c1nccs1)c1ccco1	ZINC000286137685	264576170	/nfs/dbraw/zinc/57/61/70/264576170.db2.gz	OGZVNHFRBKOHIG-OLZOCXBDSA-N	1	0	276.405	4.137	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+][C@@H](C)CCCC(F)(F)F	ZINC000426044583	264804507	/nfs/dbraw/zinc/80/45/07/264804507.db2.gz	SXNUENJHWLURQY-NWDGAFQWSA-N	1	0	251.336	4.442	20	30		CIEDRO
Cc1[nH]c2ccc(C[NH2+]Cc3cc(C#N)cs3)cc2c1C	ZINC000343849688	265049370	/nfs/dbraw/zinc/04/93/70/265049370.db2.gz	JHBJBFUVYVEFTD-UHFFFAOYSA-N	1	0	295.411	4.008	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCCCC1(C)C)c1cccc(C#N)c1	ZINC000094323286	265236827	/nfs/dbraw/zinc/23/68/27/265236827.db2.gz	VPPPZJUZRDVAOK-CZUORRHYSA-N	1	0	256.393	4.178	20	30		CIEDRO
C[C@@H]([NH2+][C@H](C)c1cc(F)cc(F)c1)c1ccc(C#N)cc1	ZINC000094826634	265260250	/nfs/dbraw/zinc/26/02/50/265260250.db2.gz	UWPSVYJJPKRBSJ-VXGBXAGGSA-N	1	0	286.325	4.248	20	30		CIEDRO
CC(C)CC[N@H+](CCC(C)(C)C#N)C1CCCC1	ZINC000094848752	265263408	/nfs/dbraw/zinc/26/34/08/265263408.db2.gz	LULYFFLIVMXRLU-UHFFFAOYSA-N	1	0	250.430	4.217	20	30		CIEDRO
C=C(C)C[N@@H+]1CCC[C@@H]1Cc1c(F)cccc1Cl	ZINC000519005420	265294012	/nfs/dbraw/zinc/29/40/12/265294012.db2.gz	WZDBUWLYSDHNEP-GFCCVEGCSA-N	1	0	267.775	4.062	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]C(C)(C)CC)cc1Cl	ZINC000520213177	265689412	/nfs/dbraw/zinc/68/94/12/265689412.db2.gz	GWOMBNWQRMFWTP-UHFFFAOYSA-N	1	0	267.800	4.183	20	30		CIEDRO
CCC[N@H+](CCCC#N)[C@@H]1C[C@@H](OCC)C12CCCCC2	ZINC000357776103	266357912	/nfs/dbraw/zinc/35/79/12/266357912.db2.gz	SJZUDFRAVVACHY-IAGOWNOFSA-N	1	0	292.467	4.130	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H]1CCCOc2ccc(Cl)cc21	ZINC000358046677	266405325	/nfs/dbraw/zinc/40/53/25/266405325.db2.gz	ZXVOEJIZCBYQEM-BXUZGUMPSA-N	1	0	265.784	4.108	20	30		CIEDRO
C[C@@H](CC1CC1)[NH2+][C@H]1CCCCc2cc(C#N)ccc21	ZINC000360650526	266731924	/nfs/dbraw/zinc/73/19/24/266731924.db2.gz	YEBRXINGBMAQHP-UGSOOPFHSA-N	1	0	268.404	4.104	20	30		CIEDRO
N#CCCCC[N@@H+]1CCCC[C@H]1c1nc2ccccc2o1	ZINC000362823325	267051130	/nfs/dbraw/zinc/05/11/30/267051130.db2.gz	QJBCMUDJAWAACT-HNNXBMFYSA-N	1	0	283.375	4.049	20	30		CIEDRO
Cc1cc(C[N@@H+]2CCC[C@H]2c2ccsc2)ccc1C#N	ZINC000362965664	267068272	/nfs/dbraw/zinc/06/82/72/267068272.db2.gz	CXBGGEDAJSQFCY-KRWDZBQOSA-N	1	0	282.412	4.265	20	30		CIEDRO
C[C@H]1C[C@H](c2cccs2)C[N@@H+]1CCCC(C)(C)C#N	ZINC000363307244	267087039	/nfs/dbraw/zinc/08/70/39/267087039.db2.gz	QIHQPVYJRHAPBE-KBPBESRZSA-N	1	0	276.449	4.256	20	30		CIEDRO
CC(C)(CCC#N)C[N@@H+]1CCC[C@H]1[C@H](C#N)c1ccccc1	ZINC000367472566	267092079	/nfs/dbraw/zinc/09/20/79/267092079.db2.gz	PBRJRRLSKHJOTJ-MSOLQXFVSA-N	1	0	295.430	4.088	20	30		CIEDRO
N#CCCCC[N@H+]1CC[C@@H](Cc2ccc(C(F)F)cc2)C1	ZINC000368770494	267202580	/nfs/dbraw/zinc/20/25/80/267202580.db2.gz	PWAQWMWJQYPXHV-HNNXBMFYSA-N	1	0	292.373	4.182	20	30		CIEDRO
C=CCCC[N@@H+](C)[C@H](C)c1nnc(-c2cccc(C)c2)o1	ZINC000369478747	267245408	/nfs/dbraw/zinc/24/54/08/267245408.db2.gz	LYCJTSRSXZUPSZ-CQSZACIVSA-N	1	0	285.391	4.004	20	30		CIEDRO
C=C[C@@H](C)[NH2+][C@H](C)c1csc(-c2csc(C)n2)c1	ZINC000119337179	267322455	/nfs/dbraw/zinc/32/24/55/267322455.db2.gz	UYSPNIOWYKRTGE-NXEZZACHSA-N	1	0	278.446	4.405	20	30		CIEDRO
CC[C@H](CC#N)[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1	ZINC000370490397	267322583	/nfs/dbraw/zinc/32/25/83/267322583.db2.gz	HGPPBACTEVBMRG-WHOHXGKFSA-N	1	0	282.840	4.175	20	30		CIEDRO
C[C@@H]([NH2+]CC1(C#N)CCC1)[C@H](C)c1nc2ccccc2s1	ZINC000418141387	267363134	/nfs/dbraw/zinc/36/31/34/267363134.db2.gz	KZFYWQSIZHMHKD-QWHCGFSZSA-N	1	0	299.443	4.072	20	30		CIEDRO
C[C@@H]([NH2+]CC1(C#N)CCC1)[C@@H](C)c1nc2ccccc2s1	ZINC000418141373	267363746	/nfs/dbraw/zinc/36/37/46/267363746.db2.gz	KZFYWQSIZHMHKD-CHWSQXEVSA-N	1	0	299.443	4.072	20	30		CIEDRO
Cc1cccc(C[NH2+][C@@H]2CCCc3cc(C#N)ccc32)c1C	ZINC000418142070	267363930	/nfs/dbraw/zinc/36/39/30/267363930.db2.gz	GUZCRNCORAXRDC-HXUWFJFHSA-N	1	0	290.410	4.342	20	30		CIEDRO
C[C@H]1C[C@H](c2cccs2)C[N@@H+]1CC(C)(C)CCC#N	ZINC000371397687	267399098	/nfs/dbraw/zinc/39/90/98/267399098.db2.gz	BWRMHXSHOHMPFG-KBPBESRZSA-N	1	0	276.449	4.256	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H]1C[C@@H](CO)c2ccccc21)c1ccco1	ZINC000375896997	267920253	/nfs/dbraw/zinc/92/02/53/267920253.db2.gz	CFALTPSWBFGABP-JCGIZDLHSA-N	1	0	297.398	4.097	20	30		CIEDRO
CC(C)C1CCC(C[NH2+]CC(C)(C)CCC#N)CC1	ZINC000532707759	328805530	/nfs/dbraw/zinc/80/55/30/328805530.db2.gz	IRIDFAMEOYACQV-UHFFFAOYSA-N	1	0	264.457	4.368	20	30		CIEDRO
C=CC[C@H](CO)[NH2+][C@H](C)c1cc2c(ccc3ccccc23)o1	ZINC000186711461	327701061	/nfs/dbraw/zinc/70/10/61/327701061.db2.gz	SVHBHMRKZYOSHQ-UKRRQHHQSA-N	1	0	295.382	4.174	20	30		CIEDRO
C=C[C@@H](C)[NH2+][C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1	ZINC000378800442	327758410	/nfs/dbraw/zinc/75/84/10/327758410.db2.gz	TVWMKHZMRSRPQQ-CHWFTXMASA-N	1	0	255.814	4.058	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1CC[C@@H](Cc2ccccc2)C1	ZINC000189516109	327781103	/nfs/dbraw/zinc/78/11/03/327781103.db2.gz	CYHHPOPJPUGELG-ZWKOTPCHSA-N	1	0	284.447	4.317	20	30		CIEDRO
CCC[C@@H]([NH2+]CCCC(C)(C)C#N)c1ccccc1	ZINC000181766182	327810288	/nfs/dbraw/zinc/81/02/88/327810288.db2.gz	ALJDCBDAPWWIDH-MRXNPFEDSA-N	1	0	258.409	4.447	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)c1cc2ccccc2o1	ZINC000185764161	327844903	/nfs/dbraw/zinc/84/49/03/327844903.db2.gz	FURKBIWPTRZGTA-VNHYZAJKSA-N	1	0	268.360	4.166	20	30		CIEDRO
CCC(CC)[C@@H](CC[NH2+][C@H](C)c1cccc(C#N)c1)OC	ZINC000540607114	327894324	/nfs/dbraw/zinc/89/43/24/327894324.db2.gz	LJHZJAVGAIYLEN-RDTXWAMCSA-N	1	0	288.435	4.050	20	30		CIEDRO
C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+][C@H]1CCC[C@@H](C#N)C1	ZINC000463241736	327911000	/nfs/dbraw/zinc/91/10/00/327911000.db2.gz	HOKXXXBPVQFZEB-ZUMXRPEOSA-N	1	0	286.394	4.121	20	30		CIEDRO
C=CCC[NH2+][C@H](CC(F)(F)F)c1ccccc1C	ZINC000338543774	327983662	/nfs/dbraw/zinc/98/36/62/327983662.db2.gz	SAJYMCBMCCAILQ-CYBMUJFWSA-N	1	0	257.299	4.154	20	30		CIEDRO
C=CC[C@@H](C)[C@H](C)[NH2+]CCc1c[nH]c2cccc(C)c12	ZINC000531704802	328027007	/nfs/dbraw/zinc/02/70/07/328027007.db2.gz	LZAGWTSKNSTDKF-HIFRSBDPSA-N	1	0	270.420	4.209	20	30		CIEDRO
C=C(C[NH2+]Cc1ccccc1Cl)c1ccccc1	ZINC000110057634	328031282	/nfs/dbraw/zinc/03/12/82/328031282.db2.gz	ZQKYEIJTJYLNKD-UHFFFAOYSA-N	1	0	257.764	4.143	20	30		CIEDRO
CC(C)C[N@H+](Cc1ccc(C#N)cc1F)C1CCCC1	ZINC000110364112	328048494	/nfs/dbraw/zinc/04/84/94/328048494.db2.gz	FJZCFHYERHEPCB-UHFFFAOYSA-N	1	0	274.383	4.098	20	30		CIEDRO
Cc1ccc([C@@H](C)C[NH2+][C@@H]2CCc3ccc(C#N)cc32)cc1	ZINC000571092141	328084956	/nfs/dbraw/zinc/08/49/56/328084956.db2.gz	JOXNIJGXPZIOCN-MGPUTAFESA-N	1	0	290.410	4.247	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]Cc1ccc(OC(F)F)c(F)c1	ZINC000571348174	328113312	/nfs/dbraw/zinc/11/33/12/328113312.db2.gz	VJBQUGCHDMPWKT-UHFFFAOYSA-N	1	0	287.325	4.119	20	30		CIEDRO
CCc1cccc(C[NH2+][C@@H](CCC#N)c2ccccc2)c1	ZINC000571611974	328137473	/nfs/dbraw/zinc/13/74/73/328137473.db2.gz	JHDUIPACPFJIHI-IBGZPJMESA-N	1	0	278.399	4.384	20	30		CIEDRO
CC[C@H]([NH2+]C1CCC(C)(C#N)CC1)c1ccccc1	ZINC000414219553	328153414	/nfs/dbraw/zinc/15/34/14/328153414.db2.gz	HTGBKGURUVLYTE-CGZBRXJRSA-N	1	0	256.393	4.200	20	30		CIEDRO
C[C@@H]1C[C@@H]([NH2+]Cc2ccc(CC#N)cc2)c2ccccc21	ZINC000571641841	328167350	/nfs/dbraw/zinc/16/73/50/328167350.db2.gz	RZSXDMCVXDLUEC-AUUYWEPGSA-N	1	0	276.383	4.091	20	30		CIEDRO
Cc1ccccc1[C@@H]([NH2+]Cc1ccccc1C#N)C1CC1	ZINC000270130930	328192137	/nfs/dbraw/zinc/19/21/37/328192137.db2.gz	PONSJKIVZGTDQW-IBGZPJMESA-N	1	0	276.383	4.108	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCOC2(CCCCC2)C1)c1cccc(C#N)c1	ZINC000271862163	328198359	/nfs/dbraw/zinc/19/83/59/328198359.db2.gz	KPKVWGTUPHYBGM-YJBOKZPZSA-N	1	0	298.430	4.091	20	30		CIEDRO
Cc1ccc([C@H](C)[NH2+]C2(c3cccc(C#N)c3)CC2)cc1	ZINC000272285214	328199749	/nfs/dbraw/zinc/19/97/49/328199749.db2.gz	PFFMTHRMEKOLMO-HNNXBMFYSA-N	1	0	276.383	4.207	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH+]2CCC(c3c[nH]c4ccccc43)CC2)C1	ZINC000278527818	328226194	/nfs/dbraw/zinc/22/61/94/328226194.db2.gz	DMEUTTBCMCGDNK-ZBFHGGJFSA-N	1	0	293.414	4.040	20	30		CIEDRO
C#CC[C@@H]([NH2+]CCCCC(C)(C)C#N)c1ccccc1	ZINC000278596289	328227927	/nfs/dbraw/zinc/22/79/27/328227927.db2.gz	DRFCWEAKTOKGLC-QGZVFWFLSA-N	1	0	268.404	4.061	20	30		CIEDRO
CCc1nc([C@@H](C)[NH2+]CCCCC(C)(C)C#N)cs1	ZINC000278634556	328228959	/nfs/dbraw/zinc/22/89/59/328228959.db2.gz	GOPXMVOMJQJBCA-GFCCVEGCSA-N	1	0	279.453	4.076	20	30		CIEDRO
N#CC1CCC(C[NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)CC1	ZINC000281636024	328240992	/nfs/dbraw/zinc/24/09/92/328240992.db2.gz	IPGCLKRKCIZSCR-LRMJVLKBSA-N	1	0	282.431	4.242	20	30		CIEDRO
N#CC1CCC(C[NH2+][C@@H]2CCSc3ccccc32)CC1	ZINC000282224651	328241706	/nfs/dbraw/zinc/24/17/06/328241706.db2.gz	IFISGMAFRVVFJM-ZBCRRDGASA-N	1	0	286.444	4.143	20	30		CIEDRO
Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+]CCCCC#N	ZINC000289259572	328254444	/nfs/dbraw/zinc/25/44/44/328254444.db2.gz	ODUOEEONUVRZGB-QGZVFWFLSA-N	1	0	281.403	4.137	20	30		CIEDRO
Cc1sccc1C[NH2+][C@@H](CCC#N)c1ccccc1	ZINC000293278070	328275215	/nfs/dbraw/zinc/27/52/15/328275215.db2.gz	NYSWCBYINKPMMP-INIZCTEOSA-N	1	0	270.401	4.191	20	30		CIEDRO
N#Cc1ccc2c(c1)[C@@H]([NH2+]Cc1coc3ccccc13)CC2	ZINC000340426115	328275911	/nfs/dbraw/zinc/27/59/11/328275911.db2.gz	LKZHPBHIDINUML-SFHVURJKSA-N	1	0	288.350	4.082	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@@H]2CC3(CCC3)Oc3ccccc32)C1	ZINC000296481788	328290693	/nfs/dbraw/zinc/29/06/93/328290693.db2.gz	OHGQAPMFMDIEAA-YQQAZPJKSA-N	1	0	296.414	4.105	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1cccc(OC(F)F)c1	ZINC000296488712	328290823	/nfs/dbraw/zinc/29/08/23/328290823.db2.gz	OPFVVYBFGUFVLP-DYEKYZERSA-N	1	0	294.345	4.021	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@H]2CCSc3ccc(F)cc32)C1	ZINC000296493860	328290871	/nfs/dbraw/zinc/29/08/71/328290871.db2.gz	OTOCDLGXSXRDJY-WHOFXGATSA-N	1	0	290.407	4.035	20	30		CIEDRO
C=C(C)COCC[NH2+][C@H](C)c1ccccc1SCC	ZINC000537962355	328324598	/nfs/dbraw/zinc/32/45/98/328324598.db2.gz	WCDGTVZZDQPXQQ-CQSZACIVSA-N	1	0	279.449	4.042	20	30		CIEDRO
C=C(C)C[N@H+](CCCO)C(c1ccccc1)c1ccccc1	ZINC000111218658	328331150	/nfs/dbraw/zinc/33/11/50/328331150.db2.gz	DDMCGAWWSPDBOY-UHFFFAOYSA-N	1	0	295.426	4.037	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+][C@@H](COCC(C)C)c1ccco1	ZINC000531961426	328337183	/nfs/dbraw/zinc/33/71/83/328337183.db2.gz	KRUBRRPSMRAURT-XHSDSOJGSA-N	1	0	279.424	4.184	20	30		CIEDRO
CCC1CCC([NH2+][C@@H](C)c2cccc(C#N)c2)CC1	ZINC000049118062	328339901	/nfs/dbraw/zinc/33/99/01/328339901.db2.gz	OYHDFRSBTZMYMJ-CBCUQQMYSA-N	1	0	256.393	4.178	20	30		CIEDRO
C=CC[N@H+](Cc1ccccc1)Cc1ccnc2ccccc12	ZINC000535078265	328383687	/nfs/dbraw/zinc/38/36/87/328383687.db2.gz	PTHQLPBKELPZAH-UHFFFAOYSA-N	1	0	288.394	4.423	20	30		CIEDRO
C[C@@H]1CC[N@H+](Cc2ccc(C#N)s2)[C@@H]2CCCC[C@@H]12	ZINC000535072813	328384283	/nfs/dbraw/zinc/38/42/83/328384283.db2.gz	WIJQSGMEVSMVOS-UHOFOFEASA-N	1	0	274.433	4.020	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+]Cc1ccc2[nH]c(C)cc2c1	ZINC000563690476	328478372	/nfs/dbraw/zinc/47/83/72/328478372.db2.gz	AOEBIXRGVBGHTC-GXTWGEPZSA-N	1	0	256.393	4.167	20	30		CIEDRO
C=CC[N@@H+](CCc1cccnc1)Cc1ccc(Cl)s1	ZINC000172071098	335093392	/nfs/dbraw/zinc/09/33/92/335093392.db2.gz	OVSIBUHVHAJICQ-UHFFFAOYSA-N	1	0	292.835	4.027	20	30		CIEDRO
C[C@@H]([NH2+][C@H](c1ccccc1)C1CC1)c1cccc(C#N)c1	ZINC000037303875	326844237	/nfs/dbraw/zinc/84/42/37/326844237.db2.gz	HEXMYCZLTLVQSR-AUUYWEPGSA-N	1	0	276.383	4.360	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@@H]2CC[C@H]3CCCC[C@@H]3C2)c1	ZINC000037489536	326853744	/nfs/dbraw/zinc/85/37/44/326853744.db2.gz	HFKNJFFPSBYIGN-KZNAEPCWSA-N	1	0	268.404	4.007	20	30		CIEDRO
N#Cc1cccc(C[NH2+]Cc2cccc3ccccc32)c1	ZINC000037501719	326854500	/nfs/dbraw/zinc/85/45/00/326854500.db2.gz	WTYABVYFSUIRGD-UHFFFAOYSA-N	1	0	272.351	4.001	20	30		CIEDRO
C=CCCC[C@H](C)[NH+]1CCC(Cc2cccnc2)CC1	ZINC000538119573	326904387	/nfs/dbraw/zinc/90/43/87/326904387.db2.gz	CFWHADYGNGOQLW-INIZCTEOSA-N	1	0	272.436	4.081	20	30		CIEDRO
C[C@@H](c1c(F)cccc1F)[NH+]1CCC(CCC#N)CC1	ZINC000584050932	326907759	/nfs/dbraw/zinc/90/77/59/326907759.db2.gz	WKOKWQPPPZIFDL-LBPRGKRZSA-N	1	0	278.346	4.042	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+]C[C@@]1(C)OCCc2sccc21	ZINC000584083395	326919879	/nfs/dbraw/zinc/91/98/79/326919879.db2.gz	OMSNZLIICDPPFJ-RHSMWYFYSA-N	1	0	293.476	4.261	20	30		CIEDRO
C=CC[C@H](CO)C[NH2+][C@H](C)c1ccc(SC(C)C)cc1	ZINC000539295852	326935442	/nfs/dbraw/zinc/93/54/42/326935442.db2.gz	ZFRXJZROKYMYCS-CABCVRRESA-N	1	0	293.476	4.022	20	30		CIEDRO
CC(C)c1ccc2c(c1)[C@@H]([NH2+]C[C@H](C#N)CCC#N)CCC2	ZINC000556580010	326951452	/nfs/dbraw/zinc/95/14/52/326951452.db2.gz	AHGZWPJDKMCBLN-KXBFYZLASA-N	1	0	295.430	4.221	20	30		CIEDRO
CCC1CC([NH2+]C2CCC(Oc3ccccc3C#N)CC2)C1	ZINC000556585502	326952101	/nfs/dbraw/zinc/95/21/01/326952101.db2.gz	LZOXGBXCGANWKA-UHFFFAOYSA-N	1	0	298.430	4.026	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@@H](c1ccccc1)[C@@H]1CCOC1	ZINC000557239146	326998226	/nfs/dbraw/zinc/99/82/26/326998226.db2.gz	KTBQMVNNDSRLAR-QYZOEREBSA-N	1	0	287.447	4.489	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+]Cc1cccc(COC)c1	ZINC000557288789	327000696	/nfs/dbraw/zinc/00/06/96/327000696.db2.gz	DCCUOQOUNQVOTB-HNNXBMFYSA-N	1	0	261.409	4.058	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@H](C)c1cccc(NC(C)=O)c1	ZINC000557384881	327003946	/nfs/dbraw/zinc/00/39/46/327003946.db2.gz	MYFRQNZFTPCKNJ-LSDHHAIUSA-N	1	0	288.435	4.431	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+][C@@H](C)c1cccc(NC(C)=O)c1	ZINC000557384878	327004046	/nfs/dbraw/zinc/00/40/46/327004046.db2.gz	MYFRQNZFTPCKNJ-CABCVRRESA-N	1	0	288.435	4.431	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+][C@H](C)c1cccc(NC(C)=O)c1	ZINC000557384880	327004077	/nfs/dbraw/zinc/00/40/77/327004077.db2.gz	MYFRQNZFTPCKNJ-HUUCEWRRSA-N	1	0	288.435	4.431	20	30		CIEDRO
C[C@H](Cc1ccsc1)[NH2+][C@H]1CCCc2cc(C#N)ccc21	ZINC000557515790	327011334	/nfs/dbraw/zinc/01/13/34/327011334.db2.gz	GKWKDDOYXJGJFZ-ACJLOTCBSA-N	1	0	296.439	4.218	20	30		CIEDRO
N#CCC1CCN(c2ccnc3c(Cl)cccc23)CC1	ZINC000557633456	327018152	/nfs/dbraw/zinc/01/81/52/327018152.db2.gz	HESGBJNOALBCLN-UHFFFAOYSA-N	1	0	285.778	4.018	20	30		CIEDRO
Cc1ccc([C@@H](C)[NH2+]Cc2ccc(C#N)s2)cc1C	ZINC000557754911	327025090	/nfs/dbraw/zinc/02/50/90/327025090.db2.gz	NTIVHLCLDIXDPV-CYBMUJFWSA-N	1	0	270.401	4.087	20	30		CIEDRO
CC(C)[C@H](c1ccc(F)cc1)[N@H+](C)CCC(C)(C)C#N	ZINC000558107447	327074250	/nfs/dbraw/zinc/07/42/50/327074250.db2.gz	PCBKLXJJNIMQKN-MRXNPFEDSA-N	1	0	276.399	4.394	20	30		CIEDRO
C[C@@H]1CCc2c(F)cccc2[C@H]1[NH2+]CC(C)(C)CCC#N	ZINC000558248888	327081431	/nfs/dbraw/zinc/08/14/31/327081431.db2.gz	VIFJSACUTRXHBA-DYVFJYSZSA-N	1	0	288.410	4.369	20	30		CIEDRO
CCC1(C[NH2+][C@@H]2CCc3ccc(C#N)cc32)CCCC1	ZINC000558498700	327098924	/nfs/dbraw/zinc/09/89/24/327098924.db2.gz	GCTNFALNYONQCN-QGZVFWFLSA-N	1	0	268.404	4.106	20	30		CIEDRO
C=CC[N@@H+](Cc1cccs1)C[C@H]1CCC2(CCCC2)O1	ZINC000558721721	327116929	/nfs/dbraw/zinc/11/69/29/327116929.db2.gz	DQAOLOMIXIYQCO-OAHLLOKOSA-N	1	0	291.460	4.228	20	30		CIEDRO
N#CCCC1CC[NH+](Cc2cccc(C3CC3)c2)CC1	ZINC000573251042	327129797	/nfs/dbraw/zinc/12/97/97/327129797.db2.gz	SEZAUOYNAURUHC-UHFFFAOYSA-N	1	0	268.404	4.080	20	30		CIEDRO
CC[C@H](CC#N)[NH2+][C@@H](C)CCc1ccc(C(F)(F)F)cc1	ZINC000559055015	327139169	/nfs/dbraw/zinc/13/91/69/327139169.db2.gz	VZEOWDIYZQAHKG-SWLSCSKDSA-N	1	0	298.352	4.308	20	30		CIEDRO
CCOc1cccc2cc([C@H](C)[NH2+][C@H]3CC[C@H](C#N)C3)oc21	ZINC000559150652	327143814	/nfs/dbraw/zinc/14/38/14/327143814.db2.gz	YRFSBNUJQSFFRX-YDHLFZDLSA-N	1	0	298.386	4.174	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@H](C#N)C1)c1cc(Cl)ccc1Cl	ZINC000559154888	327143860	/nfs/dbraw/zinc/14/38/60/327143860.db2.gz	IJUWYGBFBJITCX-SCVCMEIPSA-N	1	0	283.202	4.336	20	30		CIEDRO
C[C@@H]1C[C@@H]1[C@H]([NH2+][C@@H]1CC[C@@H](C#N)C1)c1ccc(Cl)cc1	ZINC000559150203	327143890	/nfs/dbraw/zinc/14/38/90/327143890.db2.gz	TYLBQMMEZVATGC-YUNRHHNCSA-N	1	0	288.822	4.319	20	30		CIEDRO
C=C[C@H]1CCCC[N@H+]1Cc1ccc(C(C)C)nc1C	ZINC000559187691	327145385	/nfs/dbraw/zinc/14/53/85/327145385.db2.gz	UIVSKEOETJEBNI-INIZCTEOSA-N	1	0	258.409	4.054	20	30		CIEDRO
C=C(C)C[N@H+](Cc1ccc(CO)o1)[C@H]1C=CCCCCC1	ZINC000559244809	327149502	/nfs/dbraw/zinc/14/95/02/327149502.db2.gz	YFJSQLHJRBRATQ-INIZCTEOSA-N	1	0	289.419	4.039	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@H]2CCc3sc(Cl)cc32)c1	ZINC000129578682	327156637	/nfs/dbraw/zinc/15/66/37/327156637.db2.gz	LEOAZFUQDCENDT-ZDUSSCGKSA-N	1	0	288.803	4.050	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]Cc1cccc(-c2cccnc2)c1	ZINC000559308023	327157311	/nfs/dbraw/zinc/15/73/11/327157311.db2.gz	BJUKYRZOUAFGTF-UHFFFAOYSA-N	1	0	280.415	4.441	20	30		CIEDRO
C[C@H]([NH2+]CC(C)(C)c1cccs1)c1ccc(C#N)cc1	ZINC000091437212	327170108	/nfs/dbraw/zinc/17/01/08/327170108.db2.gz	JYKQBEYYCOZBSN-ZDUSSCGKSA-N	1	0	284.428	4.248	20	30		CIEDRO
C[C@@H]1CCC[C@H]([NH2+][C@H]2CCc3ccc(C#N)cc32)CC1	ZINC000569413815	327173040	/nfs/dbraw/zinc/17/30/40/327173040.db2.gz	XWWWVSDCIGOVBU-SKDZVZGDSA-N	1	0	268.404	4.104	20	30		CIEDRO
N#Cc1csc(C[N@H+](C2CC2)[C@@H]2CCc3ccccc32)c1	ZINC000092221737	327190456	/nfs/dbraw/zinc/19/04/56/327190456.db2.gz	FVCLENJKVFTNRT-GOSISDBHSA-N	1	0	294.423	4.272	20	30		CIEDRO
C[C@@H]([NH2+]C1CC(C(C)(C)C)C1)c1cccc(C#N)c1	ZINC000569596920	327208389	/nfs/dbraw/zinc/20/83/89/327208389.db2.gz	QLWNMNKZZDOTKW-UWTIGNOOSA-N	1	0	256.393	4.034	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H]1CCc2ccc(OC(F)(F)F)cc21	ZINC000537969912	327239260	/nfs/dbraw/zinc/23/92/60/327239260.db2.gz	XPSLJVAGIHJEIT-IINYFYTJSA-N	1	0	285.309	4.127	20	30		CIEDRO
CC(C)(C#N)CC[N@@H+]1CCC[C@@H]1Cc1ccccc1Cl	ZINC000536473117	327240751	/nfs/dbraw/zinc/24/07/51/327240751.db2.gz	XVFQQRMACCDIIV-OAHLLOKOSA-N	1	0	290.838	4.287	20	30		CIEDRO
C=CC(C)(C)C[NH2+]Cc1cccc(-c2cccnc2)c1	ZINC000449484135	327262844	/nfs/dbraw/zinc/26/28/44/327262844.db2.gz	FKBCTSGFCIJBJL-UHFFFAOYSA-N	1	0	266.388	4.050	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH2+]CC[C@H](c2ccccc2)C(F)(F)F)C1	ZINC000559877384	327267116	/nfs/dbraw/zinc/26/71/16/327267116.db2.gz	LBSMWPOFICUYTG-BPLDGKMQSA-N	1	0	296.336	4.004	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H](C)c1cc(OC)c(OC)cc1C	ZINC000559878561	327267802	/nfs/dbraw/zinc/26/78/02/327267802.db2.gz	QPYGKVZQRXSFBB-AWEZNQCLSA-N	1	0	291.435	4.265	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H](C)c1cc(OC)c(OC)cc1C	ZINC000559878562	327267853	/nfs/dbraw/zinc/26/78/53/327267853.db2.gz	QPYGKVZQRXSFBB-CQSZACIVSA-N	1	0	291.435	4.265	20	30		CIEDRO
C=CC[C@@H](C)[C@H](C)[NH2+]C[C@H]1CC[C@H](c2ccccc2)O1	ZINC000573997423	327279842	/nfs/dbraw/zinc/27/98/42/327279842.db2.gz	IKTWMDUFTGEECD-CYGHRXIMSA-N	1	0	273.420	4.097	20	30		CIEDRO
N#CC1(C[NH2+][C@H]2CC=C(c3ccc(Cl)cc3)CC2)CC1	ZINC000560145923	327287053	/nfs/dbraw/zinc/28/70/53/327287053.db2.gz	CIAQRYSNNWPWJJ-INIZCTEOSA-N	1	0	286.806	4.169	20	30		CIEDRO
CC[N@H+](CCCCCF)[C@H](C)c1ccc(C#N)cc1	ZINC000560157394	327287306	/nfs/dbraw/zinc/28/73/06/327287306.db2.gz	RWZAPXDBXPSEMV-CQSZACIVSA-N	1	0	262.372	4.081	20	30		CIEDRO
C=CC[N@H+](Cc1cccs1)CC(C)(C)CCC#N	ZINC000119949640	327296314	/nfs/dbraw/zinc/29/63/14/327296314.db2.gz	UQBYSJDEHNCMHE-UHFFFAOYSA-N	1	0	262.422	4.066	20	30		CIEDRO
CCCC[C@H]([NH2+]Cc1ccc(C#N)s1)C1CCC1	ZINC000574365373	327318542	/nfs/dbraw/zinc/31/85/42/327318542.db2.gz	AEAVRWBWFUKLHN-HNNXBMFYSA-N	1	0	262.422	4.068	20	30		CIEDRO
C=CCC[C@H]([NH2+]CC1(SC)CCC1)c1ccco1	ZINC000560536518	327321155	/nfs/dbraw/zinc/32/11/55/327321155.db2.gz	HWIUTONAPPSRFG-ZDUSSCGKSA-N	1	0	265.422	4.162	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@H](C)Oc1ccccc1)c1ccco1	ZINC000560546696	327322638	/nfs/dbraw/zinc/32/26/38/327322638.db2.gz	WAYKJEJLTWWAJX-RDJZCZTQSA-N	1	0	285.387	4.344	20	30		CIEDRO
C=CCC[C@H](NCC[C@H](C)[NH+]1CCCCC1)c1ccco1	ZINC000560549744	327323505	/nfs/dbraw/zinc/32/35/05/327323505.db2.gz	HBXZURVVBOLKON-IRXDYDNUSA-N	1	0	290.451	4.141	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+]C1(c2cccc(OC)c2)CC1	ZINC000560573165	327326768	/nfs/dbraw/zinc/32/67/68/327326768.db2.gz	FXSGLYIDMBKCLP-OAHLLOKOSA-N	1	0	259.393	4.019	20	30		CIEDRO
N#CCCCC[N@@H+]1CCC[C@H](c2nc3ccccc3s2)C1	ZINC000560818063	327344778	/nfs/dbraw/zinc/34/47/78/327344778.db2.gz	FEMRSFXIAATGMT-AWEZNQCLSA-N	1	0	299.443	4.170	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC(C)(C)C[C@H]1C)c1ccc(C#N)cc1	ZINC000300145205	332797517	/nfs/dbraw/zinc/79/75/17/332797517.db2.gz	ZJXSONUVZUQYEF-WWGRRREGSA-N	1	0	256.393	4.034	20	30		CIEDRO
N#Cc1ccc(C[NH2+]C[C@H]2CCCC[C@H]2C(F)(F)F)cc1	ZINC000561746883	327416454	/nfs/dbraw/zinc/41/64/54/327416454.db2.gz	DBKBJIXLRQRERR-HUUCEWRRSA-N	1	0	296.336	4.017	20	30		CIEDRO
CC#CCC[NH2+]C/C(C)=C\c1cccc(C(F)(F)F)c1	ZINC000561950842	327433594	/nfs/dbraw/zinc/43/35/94/327433594.db2.gz	IAWNZEKXDLEASL-RAXLEYEMSA-N	1	0	281.321	4.112	20	30		CIEDRO
CC(C)C[C@@H](C)C[C@@H](C)[NH2+]CC(C)(C)CCC#N	ZINC000562046051	327442247	/nfs/dbraw/zinc/44/22/47/327442247.db2.gz	ADXCXGFMTQCTKY-HUUCEWRRSA-N	1	0	252.446	4.367	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1C[C@@H](c2ccccc2)C1(C)C	ZINC000562046824	327442404	/nfs/dbraw/zinc/44/24/04/327442404.db2.gz	YOZIIINUSCGTDL-DLBZAZTESA-N	1	0	284.447	4.488	20	30		CIEDRO
CC1(C)CCC[C@@H]1[NH2+]Cc1ccc(C#N)cc1C(F)(F)F	ZINC000562206094	327456923	/nfs/dbraw/zinc/45/69/23/327456923.db2.gz	MCRVHTIUFUTIIE-AWEZNQCLSA-N	1	0	296.336	4.245	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@@H]2CCCc3ccc(Cl)cc32)C1	ZINC000562569543	327494989	/nfs/dbraw/zinc/49/49/89/327494989.db2.gz	ZPZBOSHGBLIQCC-YLQAJVPDSA-N	1	0	288.822	4.389	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)c1ccc(Br)cc1F	ZINC000381431300	327531196	/nfs/dbraw/zinc/53/11/96/327531196.db2.gz	BPCRQRXVUDVMCU-SNVBAGLBSA-N	1	0	286.188	4.205	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCCCn1ccnc1C)c1ccccc1	ZINC000160021649	327587209	/nfs/dbraw/zinc/58/72/09/327587209.db2.gz	OHATVWWYNUFASU-LJQANCHMSA-N	1	0	297.446	4.269	20	30		CIEDRO
CC[C@@H](Cc1ccccc1)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000116384138	328694052	/nfs/dbraw/zinc/69/40/52/328694052.db2.gz	BOPYYTVOROEEEU-KXBFYZLASA-N	1	0	278.399	4.230	20	30		CIEDRO
Cc1ccc2c(c1)[C@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)[C@@H](C)C2	ZINC000182690611	328822362	/nfs/dbraw/zinc/82/23/62/328822362.db2.gz	OZFFGGBSLIQMRT-AUSJPIAWSA-N	1	0	290.410	4.451	20	30		CIEDRO
C#Cc1ccc(C[NH2+]Cc2ccc(-c3ccncc3)cc2)cc1	ZINC000377659578	329023263	/nfs/dbraw/zinc/02/32/63/329023263.db2.gz	ODHARYUUHXAVNK-UHFFFAOYSA-N	1	0	298.389	4.020	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H](c2ccccn2)C2CCCC2)s1	ZINC000378015599	329037217	/nfs/dbraw/zinc/03/72/17/329037217.db2.gz	ZHCLCLMOYSIPQT-QGZVFWFLSA-N	1	0	297.427	4.036	20	30		CIEDRO
C[C@H](CCN(CCC#N)Cc1ccco1)c1ccccc1	ZINC000193602877	329059863	/nfs/dbraw/zinc/05/98/63/329059863.db2.gz	FJPVIBNDOAQLJY-MRXNPFEDSA-N	1	0	282.387	4.189	20	30		CIEDRO
C=C(CC)C[NH+]1CCC(c2noc3cc(F)ccc32)CC1	ZINC000582635815	329120030	/nfs/dbraw/zinc/12/00/30/329120030.db2.gz	ZKSQQUWHMOUTBG-UHFFFAOYSA-N	1	0	288.366	4.113	20	30		CIEDRO
C[C@H]([NH2+]C[C@@H]1CCc2ccccc21)c1ccc(C#N)c(F)c1	ZINC000538507885	329150044	/nfs/dbraw/zinc/15/00/44/329150044.db2.gz	JTJHSOPKKLCDLO-GUYCJALGSA-N	1	0	294.373	4.078	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H](c1nccs1)c1ccccc1	ZINC000174324219	329157394	/nfs/dbraw/zinc/15/73/94/329157394.db2.gz	JSGBWAQKJZCCCU-OAHLLOKOSA-N	1	0	299.443	4.152	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccc(C#N)cc1F)c1ccccc1	ZINC000178759745	329200367	/nfs/dbraw/zinc/20/03/67/329200367.db2.gz	ZTLIYVOLHSPRCH-LJQANCHMSA-N	1	0	294.373	4.494	20	30		CIEDRO
CC(C)c1cccc2c1OCCC[C@H]2[NH2+]CCCCC#N	ZINC000179108862	329205526	/nfs/dbraw/zinc/20/55/26/329205526.db2.gz	ANJLFMHEMYOCFZ-QGZVFWFLSA-N	1	0	286.419	4.307	20	30		CIEDRO
N#CCSCCC[NH2+][C@H](CC1CCC1)c1ccccc1	ZINC000181360023	329232326	/nfs/dbraw/zinc/23/23/26/329232326.db2.gz	UREVENLPQWHNCP-QGZVFWFLSA-N	1	0	288.460	4.154	20	30		CIEDRO
C=CCC[N@@H+](C)Cc1c(-c2ccccc2)nc2ccccn21	ZINC000467295899	329270886	/nfs/dbraw/zinc/27/08/86/329270886.db2.gz	VXVCQOPJBBVNOB-UHFFFAOYSA-N	1	0	291.398	4.009	20	30		CIEDRO
CC[C@H]([NH2+][C@@H](C)c1cnn(C(C)C)c1)c1ccc(C#N)cc1	ZINC000582944213	329292053	/nfs/dbraw/zinc/29/20/53/329292053.db2.gz	QNJMRNDCGSTBLE-KSSFIOAISA-N	1	0	296.418	4.138	20	30		CIEDRO
C[C@H](c1ccc(C#N)cc1)[N@@H+]1CC[C@](F)(c2ccccc2)C1	ZINC000583036812	329306416	/nfs/dbraw/zinc/30/64/16/329306416.db2.gz	UDPALGMERDEGRB-DNVCBOLYSA-N	1	0	294.373	4.190	20	30		CIEDRO
C[C@@H](c1ccc(C#N)cc1)[N@@H+]1CC[C@@](F)(c2ccccc2)C1	ZINC000583036814	329306507	/nfs/dbraw/zinc/30/65/07/329306507.db2.gz	UDPALGMERDEGRB-KXBFYZLASA-N	1	0	294.373	4.190	20	30		CIEDRO
CCOc1ccccc1[C@H](CC)[NH2+][C@@H]1CCC[C@H](C#N)C1	ZINC000185805966	329329603	/nfs/dbraw/zinc/32/96/03/329329603.db2.gz	BECDEPJTRVJXJY-UXLLHSPISA-N	1	0	286.419	4.208	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1ccc(C)cc1	ZINC000185812827	329329733	/nfs/dbraw/zinc/32/97/33/329329733.db2.gz	DKQZHGRZHJAYRQ-XIRDDKMYSA-N	1	0	256.393	4.118	20	30		CIEDRO
Cc1c(C[NH2+][C@H]2CCC[C@H](C#N)C2)oc2ccc(F)cc12	ZINC000185842456	329330235	/nfs/dbraw/zinc/33/02/35/329330235.db2.gz	VJYGCPZNWIVRNU-JSGCOSHPSA-N	1	0	286.350	4.052	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1ccc(OCC)c(OCC)c1	ZINC000508965911	332853200	/nfs/dbraw/zinc/85/32/00/332853200.db2.gz	OMGHHAGOVNJWRM-AWEZNQCLSA-N	1	0	277.408	4.101	20	30		CIEDRO
CCC(C)(C)c1ccc(C[NH+]2CCC(C)(C#N)CC2)cc1	ZINC000508978621	332853567	/nfs/dbraw/zinc/85/35/67/332853567.db2.gz	OUGNGMVXDOCCRZ-UHFFFAOYSA-N	1	0	284.447	4.500	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](CC)c1ccc(OC(F)F)cc1	ZINC000509008125	332855615	/nfs/dbraw/zinc/85/56/15/332855615.db2.gz	VDRPQSZDBNGSNF-AWEZNQCLSA-N	1	0	269.335	4.295	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)c1nc(-c2ccccc2)cs1	ZINC000509023123	332856182	/nfs/dbraw/zinc/85/61/82/332856182.db2.gz	UUJJVPFULGPIDW-CYBMUJFWSA-N	1	0	272.417	4.427	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1ccccc1C(F)(F)F	ZINC000393771072	329391546	/nfs/dbraw/zinc/39/15/46/329391546.db2.gz	ATKGZXJHTFOABD-LBPRGKRZSA-N	1	0	257.299	4.150	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1cc(F)cc(C(F)(F)F)c1	ZINC000393776661	329428093	/nfs/dbraw/zinc/42/80/93/329428093.db2.gz	NNEOQQLSVULMDD-CYBMUJFWSA-N	1	0	275.289	4.289	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@@H](C)c1cc(OC)ccc1OC	ZINC000398093477	329432821	/nfs/dbraw/zinc/43/28/21/329432821.db2.gz	ZHJNACXUXOULSX-KGLIPLIRSA-N	1	0	277.408	4.099	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@@H](C)c1ccc2c(c1)OCCCO2	ZINC000398105872	329432986	/nfs/dbraw/zinc/43/29/86/329432986.db2.gz	KGIFDLIGTFRAOR-CABCVRRESA-N	1	0	289.419	4.243	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@@H](C)c1ccc(OC)c(F)c1	ZINC000398183543	329438664	/nfs/dbraw/zinc/43/86/64/329438664.db2.gz	PAOXADYEAZODIG-STQMWFEESA-N	1	0	265.372	4.230	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CC)c1ccc(C(F)(F)F)cc1	ZINC000128511874	329608869	/nfs/dbraw/zinc/60/88/69/329608869.db2.gz	FWYHXHRIRPAFNI-CYBMUJFWSA-N	1	0	257.299	4.322	20	30		CIEDRO
C[C@H]1CCC[C@H](CC[NH2+]CC(C)(C)CCC#N)C1	ZINC000135187496	329664793	/nfs/dbraw/zinc/66/47/93/329664793.db2.gz	NMFUAFPNCLQIKW-LSDHHAIUSA-N	1	0	250.430	4.122	20	30		CIEDRO
CC(C)=CCC[C@@H](C)[NH2+][C@@H](C)c1ccc(C#N)cc1F	ZINC000571750360	329919689	/nfs/dbraw/zinc/91/96/89/329919689.db2.gz	OYPKDIXGZMYPLL-KGLIPLIRSA-N	1	0	274.383	4.483	20	30		CIEDRO
Cc1cc(N2CCC(CCC#N)CC2)c2ccccc2[nH+]1	ZINC000572031967	329939048	/nfs/dbraw/zinc/93/90/48/329939048.db2.gz	SXSBOIOGOYKDNN-UHFFFAOYSA-N	1	0	279.387	4.063	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)c1sccc1Br	ZINC000161688195	329951761	/nfs/dbraw/zinc/95/17/61/329951761.db2.gz	ZYZLZCBBYHXLFH-DTWKUNHWSA-N	1	0	274.227	4.126	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1scnc1C)c1ccccc1	ZINC000269354677	330068291	/nfs/dbraw/zinc/06/82/91/330068291.db2.gz	MAZQPYWVTVIVMN-HNNXBMFYSA-N	1	0	272.417	4.249	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@H](C)c1ccc2c(c1)COC2)c1ccccc1	ZINC000271413083	330079683	/nfs/dbraw/zinc/07/96/83/330079683.db2.gz	AYJXBQTYSAEYJD-FOIQADDNSA-N	1	0	291.394	4.132	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@H]1CCc2ccc(OC)cc21)c1ccccc1	ZINC000271422288	330079814	/nfs/dbraw/zinc/07/98/14/330079814.db2.gz	CALUALJTROQRMV-UXHICEINSA-N	1	0	291.394	4.037	20	30		CIEDRO
C#CC[C@H]([NH2+][C@H]1CCc2ccc(OC)cc21)c1ccccc1	ZINC000271422281	330079866	/nfs/dbraw/zinc/07/98/66/330079866.db2.gz	CALUALJTROQRMV-PMACEKPBSA-N	1	0	291.394	4.037	20	30		CIEDRO
C#CC[C@H]([NH2+][C@H](C)c1ccsc1)c1ccccc1	ZINC000271599100	330080909	/nfs/dbraw/zinc/08/09/09/330080909.db2.gz	ZIEJBJVWZCRQNN-CJNGLKHVSA-N	1	0	255.386	4.163	20	30		CIEDRO
C#CC[C@H]([NH2+][C@H]1CCc2ccccc21)c1ccccc1	ZINC000271556029	330081047	/nfs/dbraw/zinc/08/10/47/330081047.db2.gz	SSGSQBLCUZGVPK-OALUTQOASA-N	1	0	261.368	4.028	20	30		CIEDRO
C#CC[C@H]([NH2+][C@@H](C)c1ccc2c(c1)CCO2)c1ccccc1	ZINC000271573565	330081181	/nfs/dbraw/zinc/08/11/81/330081181.db2.gz	VZKAZWBRPIXFRN-KXBFYZLASA-N	1	0	291.394	4.037	20	30		CIEDRO
C=CCC[C@@H]([NH2+][C@H]1CCOC2(CCC2)C1)c1ccccc1	ZINC000271548254	330081410	/nfs/dbraw/zinc/08/14/10/330081410.db2.gz	UOEOPCOPHLIHJQ-ZWKOTPCHSA-N	1	0	285.431	4.385	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@@H](C)c1ccc([S@@](C)=O)cc1	ZINC000271529654	330081438	/nfs/dbraw/zinc/08/14/38/330081438.db2.gz	PIYVUMDEMVEEEJ-DKICVRJWSA-N	1	0	293.476	4.210	20	30		CIEDRO
C#CC[C@@H]([NH2+]CCCCC(F)(F)F)c1ccccc1	ZINC000271656343	330081598	/nfs/dbraw/zinc/08/15/98/330081598.db2.gz	CLYHJTRHPOXMFR-CQSZACIVSA-N	1	0	269.310	4.073	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1cnccc1C)c1ccccc1	ZINC000271673011	330081614	/nfs/dbraw/zinc/08/16/14/330081614.db2.gz	AEFGXGTVKMMGFD-GOSISDBHSA-N	1	0	266.388	4.187	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1c(C)onc1CC)c1ccccc1	ZINC000271744425	330081923	/nfs/dbraw/zinc/08/19/23/330081923.db2.gz	QQSUFXNIZBORHB-GOSISDBHSA-N	1	0	284.403	4.343	20	30		CIEDRO
C[C@@H](Cc1ccc(F)cc1Cl)[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000421853254	330088382	/nfs/dbraw/zinc/08/83/82/330088382.db2.gz	IYEMJRSMHYFBPZ-HUBLWGQQSA-N	1	0	294.801	4.082	20	30		CIEDRO
COc1cc(Cl)ccc1[C@@H](C)[NH2+]CC(C)(C)CCC#N	ZINC000421859285	330090373	/nfs/dbraw/zinc/09/03/73/330090373.db2.gz	SIDOCHPTKDRZIX-GFCCVEGCSA-N	1	0	294.826	4.329	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](C)c1ccncc1Cl	ZINC000421832331	330091236	/nfs/dbraw/zinc/09/12/36/330091236.db2.gz	GQUHVWTVYIUFPT-NWDGAFQWSA-N	1	0	252.789	4.130	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@@H]1CC12CCSCC2)c1ccco1	ZINC000421886037	330096321	/nfs/dbraw/zinc/09/63/21/330096321.db2.gz	RTYNEILCDMEOOE-LSDHHAIUSA-N	1	0	291.460	4.410	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@H]1CC12CCSCC2)c1ccco1	ZINC000421886033	330096348	/nfs/dbraw/zinc/09/63/48/330096348.db2.gz	RTYNEILCDMEOOE-CABCVRRESA-N	1	0	291.460	4.410	20	30		CIEDRO
COc1ccc([C@@H]([NH2+]CC(C)(C)CC#N)C(C)C)c(F)c1	ZINC000421862531	330098490	/nfs/dbraw/zinc/09/84/90/330098490.db2.gz	WLZVKWSGZGXZEG-INIZCTEOSA-N	1	0	292.398	4.061	20	30		CIEDRO
Cc1cccc2c1[C@@H](C)C[C@@H]2[NH2+]Cc1ccc(C#N)s1	ZINC000421875496	330101284	/nfs/dbraw/zinc/10/12/84/330101284.db2.gz	JDOKBKJLQCCDPF-LRDDRELGSA-N	1	0	282.412	4.266	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccc(C#N)s1)c1ccco1	ZINC000421892039	330104501	/nfs/dbraw/zinc/10/45/01/330104501.db2.gz	WEZVEGZMHGIDHH-CQSZACIVSA-N	1	0	272.373	4.010	20	30		CIEDRO
C#CC[C@H]([NH2+][C@H](C)c1sccc1OC)c1ccccc1	ZINC000274568918	330106288	/nfs/dbraw/zinc/10/62/88/330106288.db2.gz	IKWNLXZTWWVIDX-HIFRSBDPSA-N	1	0	285.412	4.172	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)c1nc2ccccc2n1C(F)F	ZINC000275486558	330110070	/nfs/dbraw/zinc/11/00/70/330110070.db2.gz	RQBVVNKGPLMUTF-NSHDSACASA-N	1	0	279.334	4.048	20	30		CIEDRO
Cc1nc(C[NH2+][C@H](CCCC#N)c2ccccc2)sc1C	ZINC000433011601	330121797	/nfs/dbraw/zinc/12/17/97/330121797.db2.gz	OZJGIQZKAONNNH-MRXNPFEDSA-N	1	0	299.443	4.285	20	30		CIEDRO
C[C@H](CC[NH+]1CCC(CCC#N)CC1)c1ccccc1	ZINC000574990269	330123311	/nfs/dbraw/zinc/12/33/11/330123311.db2.gz	QCTQIXJAFDUGPX-MRXNPFEDSA-N	1	0	270.420	4.196	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@@H]1CCO[C@H](C(C)(C)C)C1	ZINC000536829971	330228694	/nfs/dbraw/zinc/22/86/94/330228694.db2.gz	AZGWWWUEZVRECQ-XHSDSOJGSA-N	1	0	267.457	4.305	20	30		CIEDRO
CC(C)C[C@H]1CCC[N@@H+]1CCCCC(C)(C)C#N	ZINC000396927760	330229692	/nfs/dbraw/zinc/22/96/92/330229692.db2.gz	VWVGCAQHHWBHFY-OAHLLOKOSA-N	1	0	250.430	4.217	20	30		CIEDRO
C=CCC[NH2+]C(C)(C)Cc1ccc(C(F)(F)F)cc1	ZINC000527194408	330233259	/nfs/dbraw/zinc/23/32/59/330233259.db2.gz	YXXDOPPDJAJEKZ-UHFFFAOYSA-N	1	0	271.326	4.192	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCCC(C)(C)C1)c1ccc(C#N)cc1F	ZINC000527196566	330234572	/nfs/dbraw/zinc/23/45/72/330234572.db2.gz	ITKHRHGBADWXNM-TZMCWYRMSA-N	1	0	274.383	4.317	20	30		CIEDRO
C[C@@H]([NH2+]C1CCC(Oc2ccccc2C#N)CC1)C1CCC1	ZINC000527528957	330257991	/nfs/dbraw/zinc/25/79/91/330257991.db2.gz	LRJMCLBRUBFHSD-RWBZWWBESA-N	1	0	298.430	4.026	20	30		CIEDRO
CC1(C)CCC[C@H]1CC[NH2+]C1CCC(C)(C#N)CC1	ZINC000527725681	330277549	/nfs/dbraw/zinc/27/75/49/330277549.db2.gz	AFCMBXWAFQLWJJ-UQPPLGOBSA-N	1	0	262.441	4.265	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@@H](C)c1cccc(C(C)C)c1	ZINC000527911923	330290845	/nfs/dbraw/zinc/29/08/45/330290845.db2.gz	UBQAECNQMGNTJB-WBAXXEDZSA-N	1	0	273.420	4.052	20	30		CIEDRO
C=CC(C)(C)CC[NH2+][C@H]1CCCc2nc(C)sc21	ZINC000527925131	330296471	/nfs/dbraw/zinc/29/64/71/330296471.db2.gz	KTZFOZOSYGBBRM-LBPRGKRZSA-N	1	0	264.438	4.021	20	30		CIEDRO
C=CC(C)(C)CC[NH2+][C@@H]1CCCc2nc(C)sc21	ZINC000527925128	330296538	/nfs/dbraw/zinc/29/65/38/330296538.db2.gz	KTZFOZOSYGBBRM-GFCCVEGCSA-N	1	0	264.438	4.021	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@H]2CCCC[C@H](c3ccccc3)C2)C1	ZINC000424188853	330322033	/nfs/dbraw/zinc/32/20/33/330322033.db2.gz	COXZCXMSLAVIOQ-BVBHFADKSA-N	1	0	282.431	4.385	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)c1ccc(F)c(F)c1	ZINC000036953162	330322678	/nfs/dbraw/zinc/32/26/78/330322678.db2.gz	IFAPCHCZPFMSRE-NWDGAFQWSA-N	1	0	286.325	4.248	20	30		CIEDRO
Cc1ccccc1-c1cccc(C[NH+]2CCC(C#N)CC2)c1	ZINC000123724094	330323065	/nfs/dbraw/zinc/32/30/65/330323065.db2.gz	SDZRUUDRGNEISF-UHFFFAOYSA-N	1	0	290.410	4.398	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+]Cc2ccc(-c3ccccc3)s2)C1	ZINC000424191713	330323799	/nfs/dbraw/zinc/32/37/99/330323799.db2.gz	HVONGHTZKJFPHI-HIFRSBDPSA-N	1	0	282.412	4.197	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+]Cc2cc(-c3ccccc3)cs2)C1	ZINC000424194711	330324390	/nfs/dbraw/zinc/32/43/90/330324390.db2.gz	LSDDXUAKQSAZGR-CJNGLKHVSA-N	1	0	282.412	4.197	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@@H](c1cc2ccccc2o1)C(C)C	ZINC000424291751	330335010	/nfs/dbraw/zinc/33/50/10/330335010.db2.gz	FJOAEJAAJQANLZ-TXPKVOOTSA-N	1	0	299.414	4.311	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@@H](C)c1oc2ccccc2c1CC	ZINC000424297461	330336301	/nfs/dbraw/zinc/33/63/01/330336301.db2.gz	QRWWEKWAOQZHQZ-ZQIUZPCESA-N	1	0	299.414	4.237	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@@H]1C[C@@H](C(C)C)c2ccccc21	ZINC000424297370	330336323	/nfs/dbraw/zinc/33/63/23/330336323.db2.gz	QPUDDJXBZHTRBS-FZDIXFNVSA-N	1	0	285.431	4.052	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1cccc(Cl)c1F	ZINC000424317262	330339606	/nfs/dbraw/zinc/33/96/06/330339606.db2.gz	BPUJPZHYIFHPHQ-MISXGVKJSA-N	1	0	280.774	4.212	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@H](c2ccc(Cl)cc2)C2CCC2)C1	ZINC000424318200	330339743	/nfs/dbraw/zinc/33/97/43/330339743.db2.gz	CRUYWRYIHQJIPC-VUCTXSBTSA-N	1	0	288.822	4.463	20	30		CIEDRO
CCC[C@H](CCc1ccccc1)[NH2+][C@@H]1CC[C@H](C#N)C1	ZINC000424319071	330339816	/nfs/dbraw/zinc/33/98/16/330339816.db2.gz	DLHDLFTVHBYBFP-RCCFBDPRSA-N	1	0	270.420	4.070	20	30		CIEDRO
Cc1cc2cc([C@H](C)[NH2+][C@@H]3CC[C@H](C#N)C3)oc2cc1C	ZINC000424321155	330340138	/nfs/dbraw/zinc/34/01/38/330340138.db2.gz	GTNOYULXMRSKTJ-OFQRWUPVSA-N	1	0	282.387	4.393	20	30		CIEDRO
CCSc1ccccc1[C@H](C)[NH2+][C@@H]1CC[C@H](C#N)C1	ZINC000424320740	330340185	/nfs/dbraw/zinc/34/01/85/330340185.db2.gz	GGRMQZSHSUPAEN-MELADBBJSA-N	1	0	274.433	4.141	20	30		CIEDRO
CCc1c2ccccc2oc1[C@H](C)[NH2+][C@@H]1CC[C@H](C#N)C1	ZINC000424321675	330340267	/nfs/dbraw/zinc/34/02/67/330340267.db2.gz	HOVBXGXBBHXOOW-MELADBBJSA-N	1	0	282.387	4.338	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)[C@@H](C)c1nc2ccccc2s1	ZINC000424322720	330340473	/nfs/dbraw/zinc/34/04/73/330340473.db2.gz	ILSXDDVNSRSKQK-YIYPIFLZSA-N	1	0	299.443	4.070	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1nc(-c2ccccc2)cs1	ZINC000424322609	330340527	/nfs/dbraw/zinc/34/05/27/330340527.db2.gz	IIQYMKPKTYLEIZ-VNHYZAJKSA-N	1	0	297.427	4.153	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)[C@H](C)c1ccc(Cl)cc1	ZINC000424324403	330341003	/nfs/dbraw/zinc/34/10/03/330341003.db2.gz	JVIGKCLGYUBGQY-RSUWNVLCSA-N	1	0	276.811	4.114	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc(F)c2ccccc21	ZINC000424324372	330341013	/nfs/dbraw/zinc/34/10/13/330341013.db2.gz	JVBBARQRRJALNN-MELADBBJSA-N	1	0	282.362	4.322	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@@H](c2ccccc2)C2CCCC2)C1	ZINC000424326571	330341264	/nfs/dbraw/zinc/34/12/64/330341264.db2.gz	MDKYSCMHMHQAAF-JLSDUUJJSA-N	1	0	268.404	4.200	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@H](c2ccc(Cl)cc2)C2CC2)C1	ZINC000424325959	330341323	/nfs/dbraw/zinc/34/13/23/330341323.db2.gz	LKIDIBYTBKKBJK-XZJROXQQSA-N	1	0	274.795	4.073	20	30		CIEDRO
COc1ccc([C@H](C)[NH2+][C@H]2CC[C@@H](CC#N)C2)c(Cl)c1	ZINC000424359994	330346865	/nfs/dbraw/zinc/34/68/65/330346865.db2.gz	ZCQWCHMAVWLUBF-AVGNSLFASA-N	1	0	292.810	4.082	20	30		CIEDRO
CC(C)[C@@H]([NH2+]Cc1ccc(C#N)cc1F)c1ccccc1	ZINC000533223686	330353703	/nfs/dbraw/zinc/35/37/03/330353703.db2.gz	ZZVHFOGCOGYQHC-GOSISDBHSA-N	1	0	282.362	4.184	20	30		CIEDRO
C=C(C)C[N@@H+](CC)Cc1nc2cc(C(F)(F)F)ccc2o1	ZINC000119774918	330379679	/nfs/dbraw/zinc/37/96/79/330379679.db2.gz	MDCBLBFRDBQUNO-UHFFFAOYSA-N	1	0	298.308	4.245	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@H](C)c1ccccc1OC	ZINC000119778842	330379852	/nfs/dbraw/zinc/37/98/52/330379852.db2.gz	MAYKGCXSGSHPAL-OAHLLOKOSA-N	1	0	297.398	4.111	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@@H](C)c1ccccc1OC	ZINC000119778690	330379887	/nfs/dbraw/zinc/37/98/87/330379887.db2.gz	MAYKGCXSGSHPAL-HNNXBMFYSA-N	1	0	297.398	4.111	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]Cc2cc3ccccc3[nH]2)cc1	ZINC000058474177	330388390	/nfs/dbraw/zinc/38/83/90/330388390.db2.gz	UQVRPQIURQDROA-UHFFFAOYSA-N	1	0	292.382	4.023	20	30		CIEDRO
C[C@H]([NH2+][C@H](CCC#N)c1ccccc1)c1ccccc1	ZINC000090665183	330394574	/nfs/dbraw/zinc/39/45/74/330394574.db2.gz	KUQRXSULWZNTBY-MAUKXSAKSA-N	1	0	264.372	4.382	20	30		CIEDRO
C[C@@H]1CCCC[C@H]1[NH2+][C@@H](CCC#N)c1ccccc1	ZINC000090665913	330394599	/nfs/dbraw/zinc/39/45/99/330394599.db2.gz	DMBXGNYQGBLAPT-OIISXLGYSA-N	1	0	256.393	4.200	20	30		CIEDRO
C=CCCC[C@H](C)[N@H+]1CC=C(c2c[nH]c3ncccc23)CC1	ZINC000537049184	330394849	/nfs/dbraw/zinc/39/48/49/330394849.db2.gz	WWEWXKALUKOJLO-HNNXBMFYSA-N	1	0	295.430	4.397	20	30		CIEDRO
C[C@@H]([NH2+]CC#Cc1cccc(Cl)c1)c1ccccc1	ZINC000537100072	330399359	/nfs/dbraw/zinc/39/93/59/330399359.db2.gz	BNBCGZHFLBMKSH-CQSZACIVSA-N	1	0	269.775	4.042	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1csc(-c2ccco2)n1)C1CC1	ZINC000121704245	330406010	/nfs/dbraw/zinc/40/60/10/330406010.db2.gz	QRBVJEVMYYRKCE-CQSZACIVSA-N	1	0	288.416	4.238	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(C#N)cc1OC(F)F)C(C)(C)C	ZINC000537290086	330431132	/nfs/dbraw/zinc/43/11/32/330431132.db2.gz	HHQMTNQJLUHQJZ-AWEZNQCLSA-N	1	0	296.361	4.074	20	30		CIEDRO
C[C@H]([NH2+]CC(C)(C)c1ccc(F)cc1)c1cccc(C#N)c1	ZINC000537295223	330431597	/nfs/dbraw/zinc/43/15/97/330431597.db2.gz	JNGVUTDBVDFTEV-AWEZNQCLSA-N	1	0	296.389	4.326	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@@H]1CCc2c1cccc2OC	ZINC000537304096	330432055	/nfs/dbraw/zinc/43/20/55/330432055.db2.gz	MNOQKJFRJVWLEJ-CZUORRHYSA-N	1	0	259.393	4.017	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+]Cc1oc(CCC)nc1C	ZINC000426331628	330504512	/nfs/dbraw/zinc/50/45/12/330504512.db2.gz	SXIDALCAQYVWNF-CQSZACIVSA-N	1	0	264.413	4.160	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1oc(CC)nc1C)c1ccccc1	ZINC000426338075	330504694	/nfs/dbraw/zinc/50/46/94/330504694.db2.gz	CYHKLCUJHFVUKE-MRXNPFEDSA-N	1	0	284.403	4.343	20	30		CIEDRO
N#CCCC[NH2+][C@@H](Cc1ccccc1F)c1ccccc1	ZINC000429416960	330545804	/nfs/dbraw/zinc/54/58/04/330545804.db2.gz	FMAWUKMZTBHNOF-SFHVURJKSA-N	1	0	282.362	4.003	20	30		CIEDRO
CC(C)c1ccc2c(c1)[C@@H]([NH2+]CC1(CC#N)CC1)CCCO2	ZINC000430743466	330572433	/nfs/dbraw/zinc/57/24/33/330572433.db2.gz	OZYBJNTXBXSECE-KRWDZBQOSA-N	1	0	298.430	4.307	20	30		CIEDRO
C[C@H]([NH2+]CC1(CC#N)CC1)c1cc(Cl)cc(Cl)c1	ZINC000430745369	330572642	/nfs/dbraw/zinc/57/26/42/330572642.db2.gz	YVEZQBZRQQDUNX-JTQLQIEISA-N	1	0	283.202	4.338	20	30		CIEDRO
CC[C@@H]([NH2+]CC1(CC#N)CC1)c1cc(Cl)ccc1OC	ZINC000430751678	330572961	/nfs/dbraw/zinc/57/29/61/330572961.db2.gz	YPAFIEJAVXZKJU-CQSZACIVSA-N	1	0	292.810	4.083	20	30		CIEDRO
CC1(C[NH2+][C@@H](CCCC#N)c2ccccc2)CCC1	ZINC000433026979	330613066	/nfs/dbraw/zinc/61/30/66/330613066.db2.gz	IZRZHYAHOGDGAX-INIZCTEOSA-N	1	0	256.393	4.201	20	30		CIEDRO
N#Cc1ccc(C[NH+]2CCC(F)(c3ccccc3)CC2)cc1	ZINC000434499454	330640377	/nfs/dbraw/zinc/64/03/77/330640377.db2.gz	YSRNYWAHCDRKEI-UHFFFAOYSA-N	1	0	294.373	4.019	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+]Cc1ccc(-c2ccccc2)o1	ZINC000435735277	330661314	/nfs/dbraw/zinc/66/13/14/330661314.db2.gz	LFSPIOOUYUWQBJ-LPHOPBHVSA-N	1	0	297.398	4.017	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+][C@H](C)c1oc2ccccc2c1C	ZINC000436303611	330674727	/nfs/dbraw/zinc/67/47/27/330674727.db2.gz	DDTYUBXWAHRBIT-VKJFTORMSA-N	1	0	299.414	4.373	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@@H](C)C[C@H](C)CC(C)C	ZINC000436309693	330675283	/nfs/dbraw/zinc/67/52/83/330675283.db2.gz	PFPTZIWORQTKQX-TWMKSMIVSA-N	1	0	267.457	4.018	20	30		CIEDRO
CCc1cnccc1[C@H](C)[NH2+]Cc1ccc(C#N)cc1Cl	ZINC000439417424	330737984	/nfs/dbraw/zinc/73/79/84/330737984.db2.gz	CSCIFJIOUAVMFQ-LBPRGKRZSA-N	1	0	299.805	4.020	20	30		CIEDRO
CSc1ccc([C@@H](C)[NH2+]CC#Cc2ccccc2)cc1	ZINC000439489513	330739605	/nfs/dbraw/zinc/73/96/05/330739605.db2.gz	CHBZNFCRIFZKNB-OAHLLOKOSA-N	1	0	281.424	4.111	20	30		CIEDRO
Cc1cc(C)c(C[NH2+]CC2CCC(C#N)CC2)c(C)c1	ZINC000441371243	330767012	/nfs/dbraw/zinc/76/70/12/330767012.db2.gz	SQYYNRWOWRGQDA-UHFFFAOYSA-N	1	0	270.420	4.031	20	30		CIEDRO
C[C@@H](C[NH2+]CC1CCC(C#N)CC1)c1cccc(Cl)c1	ZINC000441376492	330767131	/nfs/dbraw/zinc/76/71/31/330767131.db2.gz	APKSBJAVLNEQOI-NFOMZHRRSA-N	1	0	290.838	4.363	20	30		CIEDRO
N#CC1CCC(C[NH2+][C@@H]2CC[C@@H](Cc3ccccc3)C2)CC1	ZINC000441382526	330767226	/nfs/dbraw/zinc/76/72/26/330767226.db2.gz	RWYQZYNFELQWHG-GHBBCFCZSA-N	1	0	296.458	4.317	20	30		CIEDRO
C[C@H]([NH2+]CC1CCC(C#N)CC1)c1ccc(F)c(Cl)c1	ZINC000442098911	330774017	/nfs/dbraw/zinc/77/40/17/330774017.db2.gz	MXVKXBDJSYMNGL-HIFPTAJRSA-N	1	0	294.801	4.460	20	30		CIEDRO
N#CC1CCC(C[NH2+][C@H]2CCCCc3ccccc32)CC1	ZINC000442125860	330774358	/nfs/dbraw/zinc/77/43/58/330774358.db2.gz	JFKCTHLYJOAFOD-RJYAGPCLSA-N	1	0	282.431	4.374	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH2+][C@@H](c2ccc(Cl)cc2)C2CCC2)C1	ZINC000442779233	330782457	/nfs/dbraw/zinc/78/24/57/330782457.db2.gz	CRUYWRYIHQJIPC-CSMYWGQOSA-N	1	0	288.822	4.463	20	30		CIEDRO
Cc1cccc([C@H]([NH2+][C@@H]2CC[C@@H](C#N)C2)C(C)(C)C)c1	ZINC000442787562	330783399	/nfs/dbraw/zinc/78/33/99/330783399.db2.gz	YUFLKJSQGJZSAC-OIISXLGYSA-N	1	0	270.420	4.364	20	30		CIEDRO
Cc1cc(C[NH2+][C@@H]2CC[C@@H](C#N)C2)ccc1-c1ccccc1	ZINC000442831759	330785878	/nfs/dbraw/zinc/78/58/78/330785878.db2.gz	BJHICMRTXAJOSL-VQIMIIECSA-N	1	0	290.410	4.444	20	30		CIEDRO
N#C[C@H]1CC[C@H]([NH2+]CC2(Cc3ccccc3)CCCC2)C1	ZINC000442832840	330785881	/nfs/dbraw/zinc/78/58/81/330785881.db2.gz	ZEKAHHIHVUGOBI-ROUUACIJSA-N	1	0	282.431	4.071	20	30		CIEDRO
C[C@H]([NH2+]C1CCC(C(F)F)CC1)c1ccc(C#N)cc1F	ZINC000442852952	330787184	/nfs/dbraw/zinc/78/71/84/330787184.db2.gz	YTYGDPHKLCBEOI-PKSQDBQZSA-N	1	0	296.336	4.172	20	30		CIEDRO
CC(C)[C@@H](Cc1ccccc1)[NH2+]CC1CCC(C#N)CC1	ZINC000442865085	330788284	/nfs/dbraw/zinc/78/82/84/330788284.db2.gz	FFDQMKSKZFCOGK-CTWPCTMYSA-N	1	0	284.447	4.173	20	30		CIEDRO
CC[C@@H]([NH2+]CC1CCC(C#N)CC1)C1CCCCC1	ZINC000442864036	330788361	/nfs/dbraw/zinc/78/83/61/330788361.db2.gz	FJRRMRGBYGTJKI-VMBOVVBDSA-N	1	0	262.441	4.265	20	30		CIEDRO
Cc1cc(C)cc([C@@H](C)[NH2+]CC2CCC(C#N)CC2)c1	ZINC000442870003	330788988	/nfs/dbraw/zinc/78/89/88/330788988.db2.gz	CKXQFAUFJKMHLZ-KLAILNCOSA-N	1	0	270.420	4.284	20	30		CIEDRO
CCC1(C)CCC([NH2+]CC2CCC(C#N)CC2)CC1	ZINC000442874177	330789421	/nfs/dbraw/zinc/78/94/21/330789421.db2.gz	LXUNUTXMZCHVIA-UHFFFAOYSA-N	1	0	262.441	4.265	20	30		CIEDRO
CC(C)[NH+](CCS[C@H](C)c1cccc(C#N)c1)C(C)C	ZINC000442916290	330791507	/nfs/dbraw/zinc/79/15/07/330791507.db2.gz	AUCXLZUQGGKNAV-OAHLLOKOSA-N	1	0	290.476	4.471	20	30		CIEDRO
CCOc1cccc([C@@H](C)[NH2+]CCCCC(C)(C)C#N)c1	ZINC000444673644	330818396	/nfs/dbraw/zinc/81/83/96/330818396.db2.gz	IHAQOMRAGVNMOG-OAHLLOKOSA-N	1	0	288.435	4.456	20	30		CIEDRO
C=C(CC)C[NH2+][C@H](C)c1nc2ccccc2n1C(F)F	ZINC000444677288	330818589	/nfs/dbraw/zinc/81/85/89/330818589.db2.gz	PMWMFSPUZQSSKP-LLVKDONJSA-N	1	0	279.334	4.048	20	30		CIEDRO
CC[C@H]([NH2+][C@H](C)Cc1cccs1)c1ccc(C#N)cc1	ZINC000447527344	330867889	/nfs/dbraw/zinc/86/78/89/330867889.db2.gz	DUZMPBODWVWCOT-DYVFJYSZSA-N	1	0	284.428	4.292	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+]CCc2cccc(Cl)c2Cl)C1	ZINC000447539780	330868950	/nfs/dbraw/zinc/86/89/50/330868950.db2.gz	HKPFGFGZTYZXAM-DGCLKSJQSA-N	1	0	297.229	4.208	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(C)cc1C)c1ccc(C#N)cc1	ZINC000447541234	330869161	/nfs/dbraw/zinc/86/91/61/330869161.db2.gz	LTNWXRYPWCZENQ-IBGZPJMESA-N	1	0	278.399	4.416	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CCC[C@H](C)C1)c1ccc(C#N)cc1	ZINC000447545394	330869424	/nfs/dbraw/zinc/86/94/24/330869424.db2.gz	XXVHXFAAUDYBFI-JQFCIGGWSA-N	1	0	256.393	4.178	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H](CC)c1ccc(C#N)cc1)c1c(C)noc1C	ZINC000447581250	330871222	/nfs/dbraw/zinc/87/12/22/330871222.db2.gz	SNWSELQTBHOTJU-DLBZAZTESA-N	1	0	297.402	4.355	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+]C[C@H]2CCC[C@@H](C(F)(F)F)C2)C1	ZINC000447582947	330871279	/nfs/dbraw/zinc/87/12/79/330871279.db2.gz	AKYUMWWSAOZTOK-RQJABVFESA-N	1	0	288.357	4.027	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1C[C@H]1Cc1ccccc1)c1ccc(C#N)cc1	ZINC000447583760	330871514	/nfs/dbraw/zinc/87/15/14/330871514.db2.gz	CCIDXXPAHVDXLR-HSALFYBXSA-N	1	0	290.410	4.230	20	30		CIEDRO
CC[C@H]([NH2+]C1(c2ccccc2)CC1)c1ccc(C#N)cc1	ZINC000447586058	330871550	/nfs/dbraw/zinc/87/15/50/330871550.db2.gz	LCVXAGITTORKRE-SFHVURJKSA-N	1	0	276.383	4.288	20	30		CIEDRO
CCCC1(C[NH2+][C@H](CC)c2ccc(C#N)cc2)CC1	ZINC000447585369	330871619	/nfs/dbraw/zinc/87/16/19/330871619.db2.gz	JVSNEQYZKSAENI-MRXNPFEDSA-N	1	0	256.393	4.179	20	30		CIEDRO
CC[C@@H]([NH2+][C@H](c1cccnc1)C1CC1)c1ccc(C#N)cc1	ZINC000447586481	330871775	/nfs/dbraw/zinc/87/17/75/330871775.db2.gz	MQKXWXBEFFVDBL-MOPGFXCFSA-N	1	0	291.398	4.145	20	30		CIEDRO
CC[C@@H]([NH2+]CC1(C)CCCC1)c1ccc(C#N)cc1	ZINC000447588985	330872009	/nfs/dbraw/zinc/87/20/09/330872009.db2.gz	WCCKKJQJNQUUBO-MRXNPFEDSA-N	1	0	256.393	4.179	20	30		CIEDRO
CC[C@H](C[NH2+]C1CCC(C)(C#N)CC1)c1ccccc1	ZINC000449057966	330896074	/nfs/dbraw/zinc/89/60/74/330896074.db2.gz	FUJGSFVFCLJSBU-FAEJEUNOSA-N	1	0	270.420	4.242	20	30		CIEDRO
CC1(C#N)CCC([NH2+]CCCn2ccc3ccccc32)CC1	ZINC000449070350	330897049	/nfs/dbraw/zinc/89/70/49/330897049.db2.gz	JVXNBSRHNHAKKA-UHFFFAOYSA-N	1	0	295.430	4.093	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+]Cc1cccc(Cn2ccnc2)c1	ZINC000449079449	330897817	/nfs/dbraw/zinc/89/78/17/330897817.db2.gz	YWTFCSUNHOKFKX-QGZVFWFLSA-N	1	0	297.446	4.156	20	30		CIEDRO
CCCC[C@@H]1CCC[C@H]1[NH2+]C1CCC(C)(C#N)CC1	ZINC000449119093	330900009	/nfs/dbraw/zinc/90/00/09/330900009.db2.gz	WIIZJXFACVPSEL-KZYLPZIUSA-N	1	0	262.441	4.407	20	30		CIEDRO
N#CCCCC[NH2+][C@H]1CCC[C@@H]1Cc1ccc(Cl)cc1	ZINC000449130912	330900848	/nfs/dbraw/zinc/90/08/48/330900848.db2.gz	IVVKVJPADFISAS-WBVHZDCISA-N	1	0	290.838	4.335	20	30		CIEDRO
CC1(C#N)CCC([NH2+]CCCc2ccc(Cl)cc2)CC1	ZINC000449134812	330901228	/nfs/dbraw/zinc/90/12/28/330901228.db2.gz	LNNSIHPNCXOODH-UHFFFAOYSA-N	1	0	290.838	4.335	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@@H]2CCC[C@H]2Cc2ccccc2)CC1	ZINC000449165206	330902875	/nfs/dbraw/zinc/90/28/75/330902875.db2.gz	UNNKJAGVLYCFSH-LHQJTOJGSA-N	1	0	296.458	4.460	20	30		CIEDRO
CCS[C@@H]1CCC[C@H]([NH2+]C2CCC(C)(C#N)CC2)C1	ZINC000449181340	330904172	/nfs/dbraw/zinc/90/41/72/330904172.db2.gz	GRWCEQNPLMPYAX-PWUWZPNHSA-N	1	0	280.481	4.113	20	30		CIEDRO
CCCCO[C@H]1C[C@H]([NH2+]C2CCC(C)(C#N)CC2)C1(C)C	ZINC000449181139	330904208	/nfs/dbraw/zinc/90/42/08/330904208.db2.gz	FDWWEUBXWSIEPV-LPMVOBIJSA-N	1	0	292.467	4.032	20	30		CIEDRO
CC1(C#N)CCC([NH2+]C[C@@]2(C)CCCc3ccccc32)CC1	ZINC000449212179	330906496	/nfs/dbraw/zinc/90/64/96/330906496.db2.gz	ZJBMDSDWZBTOJE-LYBXBRPPSA-N	1	0	296.458	4.343	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@@H]2C[C@@H]2C2CCCCC2)CC1	ZINC000449222884	330907237	/nfs/dbraw/zinc/90/72/37/330907237.db2.gz	IVRAQIJPPINKEL-JCCCHCCOSA-N	1	0	260.425	4.017	20	30		CIEDRO
CC[C@H](CC#N)[NH2+][C@@H]1CC[C@@H](c2ccc(Cl)cc2)C1	ZINC000449245239	330909358	/nfs/dbraw/zinc/90/93/58/330909358.db2.gz	ZMUPRJWWTCPBEB-FVQBIDKESA-N	1	0	276.811	4.258	20	30		CIEDRO
CSCc1cccc(C[NH2+]C2CCC(C)(C#N)CC2)c1	ZINC000449264913	330910829	/nfs/dbraw/zinc/91/08/29/330910829.db2.gz	NRCJDQFTYLZOFZ-UHFFFAOYSA-N	1	0	288.460	4.112	20	30		CIEDRO
C[C@H]([NH2+]CC(C)(C)CCC#N)[C@H]1CCCC[C@H]1C	ZINC000449329772	330915149	/nfs/dbraw/zinc/91/51/49/330915149.db2.gz	JQJRMLJTHQBFNL-ILXRZTDVSA-N	1	0	250.430	4.121	20	30		CIEDRO
N#CCCC[C@H]([NH2+][C@H]1CCOC2(CCC2)C1)c1ccccc1	ZINC000449340250	330916229	/nfs/dbraw/zinc/91/62/29/330916229.db2.gz	NMPSEOFWYLTEJZ-ROUUACIJSA-N	1	0	298.430	4.113	20	30		CIEDRO
C[C@@]1(C[NH2+]C2CCC(C)(C#N)CC2)C[C@H]1c1ccccc1	ZINC000449340610	330916343	/nfs/dbraw/zinc/91/63/43/330916343.db2.gz	PIOKNSOTYGZDOQ-JEVOJNTISA-N	1	0	282.431	4.242	20	30		CIEDRO
C=CC[C@@H](C)[NH2+]C1CC(c2ccc(Br)cc2)C1	ZINC000162646263	330945824	/nfs/dbraw/zinc/94/58/24/330945824.db2.gz	JAWCFKWKOJIODJ-NUYPLMSZSA-N	1	0	294.236	4.249	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H]2CC[C@@H](c3ccccc3)C2)cc1F	ZINC000449737296	330947297	/nfs/dbraw/zinc/94/72/97/330947297.db2.gz	RGEAJAABDXJLMA-AEFFLSMTSA-N	1	0	294.373	4.123	20	30		CIEDRO
C[C@@](Cc1ccccc1)([NH2+]Cc1ccc(C#N)s1)C1CC1	ZINC000449773650	330949373	/nfs/dbraw/zinc/94/93/73/330949373.db2.gz	IZSAKWJEXWFODX-SFHVURJKSA-N	1	0	296.439	4.121	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+][C@H](c1ccco1)c1ccc(OC)cc1	ZINC000449777746	330949624	/nfs/dbraw/zinc/94/96/24/330949624.db2.gz	RCPOPEZUXWIIDC-KDOFPFPSSA-N	1	0	285.387	4.322	20	30		CIEDRO
N#CC1(C[NH2+][C@@H]2CCC[C@H]2c2ccc(Cl)cc2)CCC1	ZINC000450820094	331001014	/nfs/dbraw/zinc/00/10/14/331001014.db2.gz	MQPVRVDUGBXGPY-JKSUJKDBSA-N	1	0	288.822	4.260	20	30		CIEDRO
C[C@@H]1[C@H](CC(F)(F)F)C[C@H](C)[N@H+]1CCCC(C)(C)C#N	ZINC000451145691	331017393	/nfs/dbraw/zinc/01/73/93/331017393.db2.gz	LDDLYOCCYCUDPU-XQQFMLRXSA-N	1	0	290.373	4.368	20	30		CIEDRO
C[C@@H]1[C@@H](CC(F)(F)F)C[C@H](C)[N@H+]1CC#Cc1ccccc1	ZINC000451150474	331017702	/nfs/dbraw/zinc/01/77/02/331017702.db2.gz	WOTBUVSELPTTPA-SQWLQELKSA-N	1	0	295.348	4.089	20	30		CIEDRO
N#CCCCC[NH2+][C@H](c1ccc(F)c(Cl)c1)C1CC1	ZINC000451352812	331025339	/nfs/dbraw/zinc/02/53/39/331025339.db2.gz	IIKIHBNMRPRJIA-HNNXBMFYSA-N	1	0	280.774	4.214	20	30		CIEDRO
CC(C)(C#N)CC[NH2+][C@@H](c1ccc(F)c(Cl)c1)C1CC1	ZINC000451354374	331025524	/nfs/dbraw/zinc/02/55/24/331025524.db2.gz	MVPBPJAONAOXLY-OAHLLOKOSA-N	1	0	294.801	4.460	20	30		CIEDRO
CC1(C#N)CCC([NH2+]C2(c3ccc(Cl)cc3)CC2)CC1	ZINC000453173287	331097035	/nfs/dbraw/zinc/09/70/35/331097035.db2.gz	JWNNYOYDIBVNKI-UHFFFAOYSA-N	1	0	288.822	4.391	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCCc2c(F)cccc21)c1cccc(C#N)c1	ZINC000453225024	331103692	/nfs/dbraw/zinc/10/36/92/331103692.db2.gz	CUVFSJLZKHCAEK-YJYMSZOUSA-N	1	0	294.373	4.426	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCCc2c(F)cccc21)c1ccc(C#N)cc1	ZINC000453238021	331105448	/nfs/dbraw/zinc/10/54/48/331105448.db2.gz	QBXBFIVQVRMOHE-DJJJIMSYSA-N	1	0	294.373	4.426	20	30		CIEDRO
Cc1ccc(C)c([C@@H](C)[NH2+][C@H]2CC[C@@H](CC#N)C2)c1	ZINC000453282960	331110772	/nfs/dbraw/zinc/11/07/72/331110772.db2.gz	DHKLCXKSFCYHNR-PMPSAXMXSA-N	1	0	256.393	4.036	20	30		CIEDRO
Cc1ccc(C[C@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)C(C)C)cc1	ZINC000453287509	331111356	/nfs/dbraw/zinc/11/13/56/331111356.db2.gz	GHHSIWVVTGCDOH-FHWLQOOXSA-N	1	0	284.447	4.234	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccccc1Cl	ZINC000453287706	331111435	/nfs/dbraw/zinc/11/14/35/331111435.db2.gz	KLUASLDBDKCIRE-AGIUHOORSA-N	1	0	262.784	4.073	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@H]2CCCc3c(Cl)cccc32)C1	ZINC000453290826	331111747	/nfs/dbraw/zinc/11/17/47/331111747.db2.gz	LZKHDLGPQHNUBS-DCGLDWPTSA-N	1	0	288.822	4.389	20	30		CIEDRO
Cc1ccc2cc([C@@H](C)[NH2+][C@H]3CC[C@@H](CC#N)C3)oc2c1	ZINC000453291598	331111780	/nfs/dbraw/zinc/11/17/80/331111780.db2.gz	MCTAFIFMFOLOBU-YCPHGPKFSA-N	1	0	282.387	4.474	20	30		CIEDRO
CC[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccc(F)cc1F	ZINC000453291674	331111895	/nfs/dbraw/zinc/11/18/95/331111895.db2.gz	MZIGJGNDWICUAB-DETPVDSQSA-N	1	0	278.346	4.088	20	30		CIEDRO
CC(C)[C@H](CCc1ccccc1)[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000453294981	331112254	/nfs/dbraw/zinc/11/22/54/331112254.db2.gz	RDBVONGEBLGDTP-FHWLQOOXSA-N	1	0	284.447	4.316	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@@H]2CCSc3c(F)cccc32)C1	ZINC000453295144	331112413	/nfs/dbraw/zinc/11/24/13/331112413.db2.gz	RUFVDQQQGLKEGI-SLEUVZQESA-N	1	0	290.407	4.035	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@@H](C[C@H]1CCOC1)c1ccc(F)cc1	ZINC000453312161	331114925	/nfs/dbraw/zinc/11/49/25/331114925.db2.gz	UUSROAAWXIEVAP-PBHICJAKSA-N	1	0	291.410	4.095	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@H](C)c1ccc2ccccc2n1	ZINC000453313771	331115278	/nfs/dbraw/zinc/11/52/78/331115278.db2.gz	WXSMLTBEHKDFRR-CYBMUJFWSA-N	1	0	254.377	4.098	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@H]1CCSc2ccc(OC)cc21	ZINC000453314382	331115300	/nfs/dbraw/zinc/11/53/00/331115300.db2.gz	YKXTXUVKXXAAGP-AWEZNQCLSA-N	1	0	277.433	4.034	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)c1cccc(-c2ccncc2)c1	ZINC000453321324	331116388	/nfs/dbraw/zinc/11/63/88/331116388.db2.gz	PSPVZZRFSVMBIT-OAHLLOKOSA-N	1	0	266.388	4.365	20	30		CIEDRO
CC[C@H]([NH2+]Cc1cc(C)cs1)c1ccc(C#N)cc1	ZINC000453323040	331116590	/nfs/dbraw/zinc/11/65/90/331116590.db2.gz	RODVEKBCHSGWEU-INIZCTEOSA-N	1	0	270.401	4.169	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@@H]1CCOC2(CCC2)C1)c1ccco1	ZINC000453331702	331117849	/nfs/dbraw/zinc/11/78/49/331117849.db2.gz	ZYPRRXOOAYNMDT-HZPDHXFCSA-N	1	0	289.419	4.226	20	30		CIEDRO
C=C(CC)C[NH2+][C@@H](C)c1sc(C(C)C)nc1C	ZINC000453341202	331119242	/nfs/dbraw/zinc/11/92/42/331119242.db2.gz	CLYIXSVRLZFPCH-NSHDSACASA-N	1	0	252.427	4.192	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H]1CCO[C@@H](c2cccs2)C1)C1CC1	ZINC000453349133	331120315	/nfs/dbraw/zinc/12/03/15/331120315.db2.gz	AZLCHPUSZXUHRJ-OWCLPIDISA-N	1	0	291.460	4.303	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CCCc3cc(F)ccc32)cc1F	ZINC000453363897	331122942	/nfs/dbraw/zinc/12/29/42/331122942.db2.gz	CFSALFKQQOTPFQ-GOSISDBHSA-N	1	0	298.336	4.004	20	30		CIEDRO
C=C[C@@H]1OCCC[C@H]1[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000453374939	331124670	/nfs/dbraw/zinc/12/46/70/331124670.db2.gz	XDGJJIUCXAQWCZ-GLQYFDAESA-N	1	0	299.336	4.090	20	30		CIEDRO
C=CCC1(C[NH2+][C@@H](c2ncc[nH]2)c2ccccc2)CCCC1	ZINC000453384342	331126295	/nfs/dbraw/zinc/12/62/95/331126295.db2.gz	UAFILFIINXAIFO-QGZVFWFLSA-N	1	0	295.430	4.225	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCC1CC(F)(F)C1)c1ccco1	ZINC000453422585	331130739	/nfs/dbraw/zinc/13/07/39/331130739.db2.gz	MUPMQTJFUHZIGC-CYBMUJFWSA-N	1	0	269.335	4.312	20	30		CIEDRO
C=CCSCC[NH2+]Cc1cccc(Cl)c1Cl	ZINC000163896014	331138281	/nfs/dbraw/zinc/13/82/81/331138281.db2.gz	CTBUBEWMWVKJQO-UHFFFAOYSA-N	1	0	276.232	4.002	20	30		CIEDRO
C=C[C@@H](C)[NH2+][C@H](C)c1cc2cc(Br)ccc2o1	ZINC000164610740	331263013	/nfs/dbraw/zinc/26/30/13/331263013.db2.gz	XIOCZMUMOARXRH-NXEZZACHSA-N	1	0	294.192	4.420	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1c(C)nc2scc(C3CC3)n12	ZINC000459528049	331286119	/nfs/dbraw/zinc/28/61/19/331286119.db2.gz	JYSBRIKOUIMTCK-ZDUSSCGKSA-N	1	0	289.448	4.026	20	30		CIEDRO
N#CCCCC[N@@H+]1CC2(CCCC2)[C@H]1c1ccccc1	ZINC000459564410	331288092	/nfs/dbraw/zinc/28/80/92/331288092.db2.gz	FEZJJULLHHAWDI-QGZVFWFLSA-N	1	0	268.404	4.298	20	30		CIEDRO
C[C@@H]([NH2+]CCCCC(C)(C)C#N)c1nc2c(s1)CCC2	ZINC000459626807	331291024	/nfs/dbraw/zinc/29/10/24/331291024.db2.gz	ANTGJSIMSQBGOS-GFCCVEGCSA-N	1	0	291.464	4.002	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+][C@H](C)c1nc2c(s1)CCC2	ZINC000459645389	331291881	/nfs/dbraw/zinc/29/18/81/331291881.db2.gz	GKIBUELTGWQYFT-VXGBXAGGSA-N	1	0	264.438	4.027	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+][C@H](C)CCCc1cccnc1	ZINC000459647482	331292030	/nfs/dbraw/zinc/29/20/30/331292030.db2.gz	JZWPTQUGWFNYCK-NVXWUHKLSA-N	1	0	260.425	4.127	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+][C@@H]2C[C@H]2c2c(F)cccc2Cl)C1	ZINC000459670062	331293318	/nfs/dbraw/zinc/29/33/18/331293318.db2.gz	TYCDVTRSODJQMX-RTWAVKEYSA-N	1	0	292.785	4.007	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+][C@@H]2C[C@H]2c2c(F)cccc2Cl)C1	ZINC000459670066	331293330	/nfs/dbraw/zinc/29/33/30/331293330.db2.gz	TYCDVTRSODJQMX-UUIJZJDISA-N	1	0	292.785	4.007	20	30		CIEDRO
CC(C)(CC#N)C[NH2+]Cc1csc(Cl)c1Cl	ZINC000459728844	331296297	/nfs/dbraw/zinc/29/62/97/331296297.db2.gz	JCXAOEPUPLUJQC-UHFFFAOYSA-N	1	0	277.220	4.084	20	30		CIEDRO
CC(C)(CC#N)C[NH2+]Cc1ccc(F)c(Cl)c1Cl	ZINC000459737761	331297103	/nfs/dbraw/zinc/29/71/03/331297103.db2.gz	WJXMLVZNXDJAQJ-UHFFFAOYSA-N	1	0	289.181	4.162	20	30		CIEDRO
N#CC1(c2ccccc2)CCC([NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)CC1	ZINC000459761908	331299111	/nfs/dbraw/zinc/29/91/11/331299111.db2.gz	NFKDEMYHOAJXCJ-SRSALCCBSA-N	1	0	294.442	4.169	20	30		CIEDRO
CC(C)(C#N)c1ccccc1C[NH2+]C1(C2CCC2)CCC1	ZINC000459778947	331300518	/nfs/dbraw/zinc/30/05/18/331300518.db2.gz	UEFZGWGYSLOLNT-UHFFFAOYSA-N	1	0	282.431	4.300	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)c1ccc(Br)cc1	ZINC000168051696	331308515	/nfs/dbraw/zinc/30/85/15/331308515.db2.gz	JYEDUGSIJRFJBZ-LLVKDONJSA-N	1	0	268.198	4.066	20	30		CIEDRO
CC(C)c1ccc(C[C@H]2CC[N@H+](CCCCC#N)C2)cc1	ZINC000460977791	331309909	/nfs/dbraw/zinc/30/99/09/331309909.db2.gz	HIOPPQLTLAOSDR-GOSISDBHSA-N	1	0	284.447	4.368	20	30		CIEDRO
C=C(C)C[N@H+](CCc1ccc(C)cc1)Cc1ccco1	ZINC000461749312	331314476	/nfs/dbraw/zinc/31/44/76/331314476.db2.gz	WNUMJIMKPRSCJK-UHFFFAOYSA-N	1	0	269.388	4.209	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+]C[C@@H](c1ccco1)N1CCCC1	ZINC000461817572	331314869	/nfs/dbraw/zinc/31/48/69/331314869.db2.gz	AOIJIBWKKREHMS-SJORKVTESA-N	1	0	290.451	4.141	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1	ZINC000461887826	331315089	/nfs/dbraw/zinc/31/50/89/331315089.db2.gz	ZZNMPJRKGPRACX-CQSZACIVSA-N	1	0	266.473	4.020	20	30		CIEDRO
C=C(C)CN1CCC([NH2+]C(CC(C)C)CC(C)C)CC1	ZINC000462051562	331317073	/nfs/dbraw/zinc/31/70/73/331317073.db2.gz	UPGSVFNSAIISKL-UHFFFAOYSA-N	1	0	280.500	4.077	20	30		CIEDRO
CCC[C@H](CCc1ccccc1)[NH2+][C@@H]1CCC[C@H]1C#N	ZINC000462066457	331317171	/nfs/dbraw/zinc/31/71/71/331317171.db2.gz	HOWPAWBABVNOEW-RCCFBDPRSA-N	1	0	270.420	4.070	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+]Cc1nc2ccccc2n1C1CC1	ZINC000462070908	331317190	/nfs/dbraw/zinc/31/71/90/331317190.db2.gz	XVQSGFOEPUGHRV-CQSZACIVSA-N	1	0	283.419	4.206	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+][C@H](COC)c1ccc(C)o1	ZINC000462115992	331317277	/nfs/dbraw/zinc/31/72/77/331317277.db2.gz	FSGDJUBLNSREQN-HUUCEWRRSA-N	1	0	265.397	4.000	20	30		CIEDRO
CC#CCC[N@@H+](CC)[C@H](C)c1cc2ccccc2o1	ZINC000462309312	331318948	/nfs/dbraw/zinc/31/89/48/331318948.db2.gz	CEYYQJBKAYSOQH-CQSZACIVSA-N	1	0	255.361	4.229	20	30		CIEDRO
CC#CCC[N@@H+](CC)[C@@H](C)c1cc2ccccc2o1	ZINC000462309310	331318969	/nfs/dbraw/zinc/31/89/69/331318969.db2.gz	CEYYQJBKAYSOQH-AWEZNQCLSA-N	1	0	255.361	4.229	20	30		CIEDRO
CCC[C@@H](CCc1ccccc1)[NH2+]Cc1ccc(C#N)cc1	ZINC000462728821	331325886	/nfs/dbraw/zinc/32/58/86/331325886.db2.gz	LVYULVFGUNKQGC-FQEVSTJZSA-N	1	0	292.426	4.449	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+]Cc1ccc(C(F)F)cc1	ZINC000462836824	331332201	/nfs/dbraw/zinc/33/22/01/331332201.db2.gz	UHRRTZQJJXNVPS-NWDGAFQWSA-N	1	0	253.336	4.315	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccc(C(F)F)cc1)C1CC1	ZINC000462840550	331332346	/nfs/dbraw/zinc/33/23/46/331332346.db2.gz	RUFZVMVCGSKIIT-OAHLLOKOSA-N	1	0	265.347	4.459	20	30		CIEDRO
C=C(C)C[N@H+](CC)CCCCCn1c(C)nc2ccccc21	ZINC000463070583	331339273	/nfs/dbraw/zinc/33/92/73/331339273.db2.gz	FQNUWXQAZLIKBG-UHFFFAOYSA-N	1	0	299.462	4.413	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)C(C)(C)c1ccccc1	ZINC000463240477	331343719	/nfs/dbraw/zinc/34/37/19/331343719.db2.gz	QXNXOYKQUFQZLG-NJAFHUGGSA-N	1	0	284.447	4.415	20	30		CIEDRO
CC1(C)CCc2ccccc2[C@@H]1[NH2+][C@@H]1CCC[C@@H](C#N)C1	ZINC000463242886	331343857	/nfs/dbraw/zinc/34/38/57/331343857.db2.gz	LTRLMDFLDFDOSO-KYJSFNMBSA-N	1	0	282.431	4.372	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1ccccc1C(F)(F)F	ZINC000463243320	331343995	/nfs/dbraw/zinc/34/39/95/331343995.db2.gz	OSAGSTHTVRUMMD-AVGNSLFASA-N	1	0	296.336	4.438	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+]CCCCCc2ccccc2)C1	ZINC000463285296	331345165	/nfs/dbraw/zinc/34/51/65/331345165.db2.gz	SPSVYODLNIGNGJ-ZWKOTPCHSA-N	1	0	270.420	4.071	20	30		CIEDRO
CCC[C@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)C1CCCCC1	ZINC000463293245	331345605	/nfs/dbraw/zinc/34/56/05/331345605.db2.gz	GCUMZGHGUVDIRR-UAGQMJEPSA-N	1	0	262.441	4.407	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+]CCCCCOC2CCCCC2)C1	ZINC000463295995	331345682	/nfs/dbraw/zinc/34/56/82/331345682.db2.gz	BEYARNVOZWIJFE-IAGOWNOFSA-N	1	0	292.467	4.178	20	30		CIEDRO
CC1(C)CC[N@H+](Cc2ccc(-c3ccccc3C#N)cc2)C1	ZINC000464794455	331368681	/nfs/dbraw/zinc/36/86/81/331368681.db2.gz	MCMHROKTIUWWGB-UHFFFAOYSA-N	1	0	290.410	4.457	20	30		CIEDRO
Cc1ccc([C@H]2C[C@H](C)CC[N@@H+]2Cc2cccc(C#N)c2)o1	ZINC000464832569	331370227	/nfs/dbraw/zinc/37/02/27/331370227.db2.gz	MJNOIJQXUCPXLZ-RDTXWAMCSA-N	1	0	294.398	4.433	20	30		CIEDRO
CCC[C@@]1(C)CCC[N@H+](Cc2ccc(C#N)cc2F)C1	ZINC000464834116	331370267	/nfs/dbraw/zinc/37/02/67/331370267.db2.gz	GBYQAMFLPVLZEW-KRWDZBQOSA-N	1	0	274.383	4.100	20	30		CIEDRO
Cc1cc(C[NH2+]C2CC(C)(c3ccccc3)C2)ccc1C#N	ZINC000466377922	331393985	/nfs/dbraw/zinc/39/39/85/331393985.db2.gz	IMSYLASHLBMACH-UHFFFAOYSA-N	1	0	290.410	4.077	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1cc(C(F)(F)F)ccc1F	ZINC000466385309	331394293	/nfs/dbraw/zinc/39/42/93/331394293.db2.gz	CUERODSDOCWWER-GFCCVEGCSA-N	1	0	275.289	4.289	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1ccc(OCc2ccncc2)cc1	ZINC000466382994	331394295	/nfs/dbraw/zinc/39/42/95/331394295.db2.gz	JGWFHLFLCNPLLX-SFHVURJKSA-N	1	0	296.414	4.105	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1cccc(-c2cccnc2)c1	ZINC000466402253	331395153	/nfs/dbraw/zinc/39/51/53/331395153.db2.gz	TVMTVFPBPYPBRC-SFHVURJKSA-N	1	0	266.388	4.193	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1csc(-c2cccs2)n1	ZINC000466404743	331395323	/nfs/dbraw/zinc/39/53/23/331395323.db2.gz	LOAJMRBOCBABNA-NSHDSACASA-N	1	0	278.446	4.316	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+]Cc1csc(-c2cccs2)n1	ZINC000466404742	331395344	/nfs/dbraw/zinc/39/53/44/331395344.db2.gz	LOAJMRBOCBABNA-LLVKDONJSA-N	1	0	278.446	4.316	20	30		CIEDRO
CC(C)[C@H](C[NH2+]CCc1cccc(C#N)c1)c1ccccc1	ZINC000466408016	331395515	/nfs/dbraw/zinc/39/55/15/331395515.db2.gz	DQWIZHWMNKQIPT-FQEVSTJZSA-N	1	0	292.426	4.130	20	30		CIEDRO
CCC[C@@H]1CCC[N@@H+]([C@H](C)c2ccc(C#N)cc2)C1	ZINC000466482519	331398183	/nfs/dbraw/zinc/39/81/83/331398183.db2.gz	RPVJQYNWWPOFEF-GDBMZVCRSA-N	1	0	256.393	4.131	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@@H](C)c1nc(C(F)(F)F)cs1	ZINC000467412432	331418069	/nfs/dbraw/zinc/41/80/69/331418069.db2.gz	SMPNOJWZSGUGEI-IUCAKERBSA-N	1	0	278.343	4.167	20	30		CIEDRO
CCC[C@H]([NH2+]CCc1cccc(C#N)c1)c1ccccc1	ZINC000467437288	331419233	/nfs/dbraw/zinc/41/92/33/331419233.db2.gz	GSNFQJGRLWBOBU-IBGZPJMESA-N	1	0	278.399	4.232	20	30		CIEDRO
CC[C@H](CC#N)[NH2+][C@H]1CCC[C@@H]1CCc1ccccc1	ZINC000468474482	331435480	/nfs/dbraw/zinc/43/54/80/331435480.db2.gz	GHAWJWOVHXXGBO-KURKYZTESA-N	1	0	270.420	4.070	20	30		CIEDRO
CC[C@@H](CC#N)[NH2+][C@@H](C)CCc1ccc(Cl)s1	ZINC000468475042	331435490	/nfs/dbraw/zinc/43/54/90/331435490.db2.gz	JSTYVTTWFLXNJL-QWRGUYRKSA-N	1	0	270.829	4.004	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)c1ccc(Br)cc1OC	ZINC000469755220	331456957	/nfs/dbraw/zinc/45/69/57/331456957.db2.gz	GETCPIJKTWGIAN-NSHDSACASA-N	1	0	298.224	4.075	20	30		CIEDRO
CC(C)CCC1CC[NH+](CCCC(C)(C)C#N)CC1	ZINC000470004027	331469463	/nfs/dbraw/zinc/46/94/63/331469463.db2.gz	OQJMWUPPHAYEGR-UHFFFAOYSA-N	1	0	264.457	4.465	20	30		CIEDRO
C=CCOCCC[NH2+][C@H](C)c1cccc2ccccc21	ZINC000470764359	331489714	/nfs/dbraw/zinc/48/97/14/331489714.db2.gz	GPEHOAKZKRDXPC-OAHLLOKOSA-N	1	0	269.388	4.083	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+]C[C@H](OC(C)C)c1ccccc1OC	ZINC000471595180	331512074	/nfs/dbraw/zinc/51/20/74/331512074.db2.gz	SFRZNMVVGLTHND-QAPCUYQASA-N	1	0	291.435	4.106	20	30		CIEDRO
C=CCCCC[NH2+][C@@H](C)c1ccc2ccccc2n1	ZINC000471597604	331512305	/nfs/dbraw/zinc/51/23/05/331512305.db2.gz	GNENRSNHGAMZKZ-AWEZNQCLSA-N	1	0	254.377	4.242	20	30		CIEDRO
Cc1ccc([C@H]([NH2+][C@@H]2CC[C@@H](C#N)C2)c2ccccc2)cc1	ZINC000471616821	331513550	/nfs/dbraw/zinc/51/35/50/331513550.db2.gz	CXMWROLGFDNVMR-NSISKUIASA-N	1	0	290.410	4.366	20	30		CIEDRO
C=CCCCC[NH2+]Cc1csc(-c2cccs2)n1	ZINC000472052943	331527626	/nfs/dbraw/zinc/52/76/26/331527626.db2.gz	GJKSIXOTIBVEMH-UHFFFAOYSA-N	1	0	278.446	4.318	20	30		CIEDRO
C=CCCCC[NH2+]Cc1cc(Cl)c(OCC)c(OC)c1	ZINC000472060214	331527877	/nfs/dbraw/zinc/52/78/77/331527877.db2.gz	QZRDLJGQYYNLBP-UHFFFAOYSA-N	1	0	297.826	4.193	20	30		CIEDRO
CC(C)(C)C1CCC(C[NH2+][C@H]2CC[C@@H](C#N)C2)CC1	ZINC000472135244	331529593	/nfs/dbraw/zinc/52/95/93/331529593.db2.gz	WJCHOTWWMFLZBE-KNIAUWFNSA-N	1	0	262.441	4.121	20	30		CIEDRO
C[C@@H]([NH2+]Cc1cccc(C#N)c1)[C@@H](C)c1ccc(Cl)cc1	ZINC000474469442	331588486	/nfs/dbraw/zinc/58/84/86/331588486.db2.gz	HFAUFGOYKQHLLL-ZIAGYGMSSA-N	1	0	298.817	4.493	20	30		CIEDRO
CC(C)C[C@H](C[NH2+]CCCCC#N)c1ccccc1	ZINC000474726904	331596513	/nfs/dbraw/zinc/59/65/13/331596513.db2.gz	IZKGDWUIDLXDRB-QGZVFWFLSA-N	1	0	258.409	4.100	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+]CC1(C)CCC(OC)CC1	ZINC000475219792	331619288	/nfs/dbraw/zinc/61/92/88/331619288.db2.gz	LKVFWOHQVJEPPZ-GTPINHCMSA-N	1	0	267.457	4.306	20	30		CIEDRO
C=CC[C@@H](C)[C@@H](C)[NH2+]CC1CCN(c2ccccc2)CC1	ZINC000475289584	331622594	/nfs/dbraw/zinc/62/25/94/331622594.db2.gz	ZPDNJCILMSQWSI-IAGOWNOFSA-N	1	0	286.463	4.093	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@@H](C)c1ccc(Br)cn1	ZINC000475484164	331632950	/nfs/dbraw/zinc/63/29/50/331632950.db2.gz	CVHNNFAELIQQRS-SRVKXCTJSA-N	1	0	297.240	4.095	20	30		CIEDRO
N#CC1(F)CC[NH+](CCCc2cccc3ccccc32)CC1	ZINC000510939538	332921441	/nfs/dbraw/zinc/92/14/41/332921441.db2.gz	YFBUJXUELGVVAS-UHFFFAOYSA-N	1	0	296.389	4.100	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+]C[C@H]1CCO[C@@H]1c1ccccc1	ZINC000477926640	331694496	/nfs/dbraw/zinc/69/44/96/331694496.db2.gz	KWIRBSOFXFPZNK-KZNAEPCWSA-N	1	0	273.420	4.099	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](C)c1ccc(Br)cn1	ZINC000479409709	331727804	/nfs/dbraw/zinc/72/78/04/331727804.db2.gz	NDOOWTQSVHKJAL-NWDGAFQWSA-N	1	0	297.240	4.240	20	30		CIEDRO
CC[C@H]([NH2+]CCCc1ccccc1F)c1ccc(C#N)cc1	ZINC000479541407	331736053	/nfs/dbraw/zinc/73/60/53/331736053.db2.gz	MVKKQKSMPBVBOV-IBGZPJMESA-N	1	0	296.389	4.371	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]Cc2ccc(C3CC3)cc2)cc1	ZINC000480482153	331774036	/nfs/dbraw/zinc/77/40/36/331774036.db2.gz	OSMGRTZRSFDYRM-UHFFFAOYSA-N	1	0	293.410	4.419	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@H]1CC[C@H](c2ccccc2F)C1	ZINC000482078526	331822812	/nfs/dbraw/zinc/82/28/12/331822812.db2.gz	HEBJGYDXVHEWBJ-KKUMJFAQSA-N	1	0	261.384	4.406	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@H]1CCc2c1cccc2O	ZINC000482539526	331837749	/nfs/dbraw/zinc/83/77/49/331837749.db2.gz	ANHVFVFSLQDOLO-BBRMVZONSA-N	1	0	259.393	4.104	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@@H]1CCc2c1cccc2C	ZINC000482885023	331850466	/nfs/dbraw/zinc/85/04/66/331850466.db2.gz	DBIXTIXTEXEGQR-LJQANCHMSA-N	1	0	293.410	4.337	20	30		CIEDRO
CC[C@@H]([NH2+]CC#Cc1ccccc1)c1ccc(Cl)s1	ZINC000483716547	331882946	/nfs/dbraw/zinc/88/29/46/331882946.db2.gz	SVRIOQGMEFUIBV-CQSZACIVSA-N	1	0	289.831	4.494	20	30		CIEDRO
Cc1ccccc1[C@@H]([NH2+]CC#Cc1ccccc1)C1CC1	ZINC000484082341	331892301	/nfs/dbraw/zinc/89/23/01/331892301.db2.gz	HANYLKQJVCUDAW-FQEVSTJZSA-N	1	0	275.395	4.087	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)c(F)c1)C(C)(C)c1ccccc1	ZINC000484075910	331892398	/nfs/dbraw/zinc/89/23/98/331892398.db2.gz	YSSHFHIXLBLCCA-AWEZNQCLSA-N	1	0	296.389	4.153	20	30		CIEDRO
C=C(C[NH2+]Cc1ccc(OCC)c(F)c1)c1ccccc1	ZINC000486953778	331951775	/nfs/dbraw/zinc/95/17/75/331951775.db2.gz	GUKIHTXPQGAKHF-UHFFFAOYSA-N	1	0	285.362	4.027	20	30		CIEDRO
C[C@H](CC1CCCCC1)[NH2+]Cc1ccc(C#N)cc1	ZINC000487150044	331957131	/nfs/dbraw/zinc/95/71/31/331957131.db2.gz	BNBGCXKMQQTOPJ-CQSZACIVSA-N	1	0	256.393	4.007	20	30		CIEDRO
Cc1cc(C[NH2+]C(C)(C)c2cccc(F)c2)ccc1C#N	ZINC000488112364	331990407	/nfs/dbraw/zinc/99/04/07/331990407.db2.gz	HUKFENVYMPPOIT-UHFFFAOYSA-N	1	0	282.362	4.031	20	30		CIEDRO
C=CCCCCC[NH2+][C@@H](C[C@@H]1CCOC1)c1ccccc1	ZINC000488134022	331991640	/nfs/dbraw/zinc/99/16/40/331991640.db2.gz	ZOJRROPXSXAYHO-HKUYNNGSSA-N	1	0	287.447	4.490	20	30		CIEDRO
C[N@H+](Cc1ccc(C#N)cc1)[C@@H]1CCc2c1cccc2Cl	ZINC000488448009	332009976	/nfs/dbraw/zinc/00/99/76/332009976.db2.gz	YKMGKRAKGQOIJJ-GOSISDBHSA-N	1	0	296.801	4.331	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@@H](C)c1nnc([C@@H](C)CC)[nH]1	ZINC000488499712	332013824	/nfs/dbraw/zinc/01/38/24/332013824.db2.gz	CJCYYGFYLWSXDM-IHRRRGAJSA-N	1	0	278.444	4.104	20	30		CIEDRO
C=C(C)C[N@@H+](CC)[C@@H](C)c1ccc(OC(F)F)cc1	ZINC000488511918	332014712	/nfs/dbraw/zinc/01/47/12/332014712.db2.gz	GYZAZWHWQHVUOI-LBPRGKRZSA-N	1	0	269.335	4.247	20	30		CIEDRO
C=C(C)C[N@@H+](CC)[C@H](C)c1ccc(OC(F)F)cc1	ZINC000488511917	332014799	/nfs/dbraw/zinc/01/47/99/332014799.db2.gz	GYZAZWHWQHVUOI-GFCCVEGCSA-N	1	0	269.335	4.247	20	30		CIEDRO
C=CCCCCC[NH2+][C@@H](CC(F)(F)F)C(C)C	ZINC000489020647	332038057	/nfs/dbraw/zinc/03/80/57/332038057.db2.gz	UTVBBTOBJDRLIT-LBPRGKRZSA-N	1	0	251.336	4.299	20	30		CIEDRO
C[C@H](c1cccc(C#N)c1)[N@H+](C)CC1CCCCC1	ZINC000489087053	332041071	/nfs/dbraw/zinc/04/10/71/332041071.db2.gz	HCWUITOJEZQZPL-CQSZACIVSA-N	1	0	256.393	4.131	20	30		CIEDRO
COc1ccc(CN(CCC#N)CC(C)(C)C)cc1Cl	ZINC000489425725	332051665	/nfs/dbraw/zinc/05/16/65/332051665.db2.gz	WGRUQNHVCLOCER-UHFFFAOYSA-N	1	0	294.826	4.110	20	30		CIEDRO
CC(C)CC[N@@H+](CCC#N)CCCc1cccc(F)c1	ZINC000490104813	332081723	/nfs/dbraw/zinc/08/17/23/332081723.db2.gz	VMSQVSXLQXXTMD-UHFFFAOYSA-N	1	0	276.399	4.020	20	30		CIEDRO
Cc1ccc2c(c1)[C@@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)CCC2	ZINC000490263277	332085832	/nfs/dbraw/zinc/08/58/32/332085832.db2.gz	SLQPIERHLMZDDU-HFTRVMKXSA-N	1	0	268.404	4.044	20	30		CIEDRO
N#Cc1ccc(C[NH2+]C[C@H]2CCCCC(F)(F)C2)c(F)c1	ZINC000491582180	332241306	/nfs/dbraw/zinc/24/13/06/332241306.db2.gz	VAOBPMDWWBFWQY-ZDUSSCGKSA-N	1	0	296.336	4.003	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1ccc(C#N)cc1)c1ccc(F)cc1F	ZINC000172619284	335112088	/nfs/dbraw/zinc/11/20/88/335112088.db2.gz	HHCJZARHTSOGJC-QGZVFWFLSA-N	1	0	286.325	4.077	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@@H](CCOC)c1ccc(C)o1	ZINC000495421203	332518459	/nfs/dbraw/zinc/51/84/59/332518459.db2.gz	ONOXLMIRBQIOLJ-GJZGRUSLSA-N	1	0	265.397	4.000	20	30		CIEDRO
CC[C@@H]1CCCC[C@@H]1[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000252403986	334379109	/nfs/dbraw/zinc/37/91/09/334379109.db2.gz	CAXLUBYVBRSBEU-UNEWFSDZSA-N	1	0	256.393	4.178	20	30		CIEDRO
C[N@H+](CCC(C)(C)C#N)Cc1cccc(C(F)(F)F)c1	ZINC000553709066	334396232	/nfs/dbraw/zinc/39/62/32/334396232.db2.gz	XXNMBCRVTTWCDB-UHFFFAOYSA-N	1	0	284.325	4.077	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H]1CCC[C@H](c2cccnc2)C1	ZINC000502391305	332656229	/nfs/dbraw/zinc/65/62/29/332656229.db2.gz	PUWHQVABOOCKIW-BQFCYCMXSA-N	1	0	272.436	4.442	20	30		CIEDRO
C=C(C[NH2+][C@@H](C)c1cc(C)c(C)o1)c1ccccc1	ZINC000502414693	332658084	/nfs/dbraw/zinc/65/80/84/332658084.db2.gz	MSKDLRWYVXBSJG-AWEZNQCLSA-N	1	0	255.361	4.260	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1C[C@@H](C)c2ccccc21)c1ccc(C#N)cc1	ZINC000266430254	334691826	/nfs/dbraw/zinc/69/18/26/334691826.db2.gz	DBFRWAHEVHEDLF-LPMFXHHGSA-N	1	0	276.383	4.457	20	30		CIEDRO
N#Cc1cccc(CC[NH2+][C@H]2CCc3ccc(Cl)cc32)c1	ZINC000503580783	332693169	/nfs/dbraw/zinc/69/31/69/332693169.db2.gz	FQPAIRNYXABDGF-SFHVURJKSA-N	1	0	296.801	4.031	20	30		CIEDRO
C=C(C)C[NH2+]C/C(C)=C\c1ccccc1C(F)(F)F	ZINC000503583518	332693259	/nfs/dbraw/zinc/69/32/59/332693259.db2.gz	ROYAQLUCFMGIJJ-WQLSENKSSA-N	1	0	269.310	4.274	20	30		CIEDRO
C[C@@H]([NH2+]CCc1cccc(C#N)c1)c1ccc(Cl)s1	ZINC000503591129	332693802	/nfs/dbraw/zinc/69/38/02/332693802.db2.gz	FCAPMJGSVDJRME-LLVKDONJSA-N	1	0	290.819	4.166	20	30		CIEDRO
C=C(C)CN1CCC([NH2+][C@@H]2C[C@@H](C)c3c2cccc3C)CC1	ZINC000504925970	332725339	/nfs/dbraw/zinc/72/53/39/332725339.db2.gz	GCLGNHAPDZFYNQ-VQIMIIECSA-N	1	0	298.474	4.173	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc2occc2c1)c1ccc(C#N)cc1	ZINC000512106103	332953942	/nfs/dbraw/zinc/95/39/42/332953942.db2.gz	NQJWUQLTERXKOI-CYBMUJFWSA-N	1	0	276.339	4.155	20	30		CIEDRO
C[C@H]([NH2+]C1(c2ccccc2)CC1)c1ccc(C#N)cc1F	ZINC000512286424	332961012	/nfs/dbraw/zinc/96/10/12/332961012.db2.gz	CJSCYDLIYOFGBN-ZDUSSCGKSA-N	1	0	280.346	4.037	20	30		CIEDRO
C=CCN1CCC([NH2+][C@H](CC)c2cccc(Cl)c2)CC1	ZINC000173398308	332970755	/nfs/dbraw/zinc/97/07/55/332970755.db2.gz	YMSUQTNXUQXQEH-QGZVFWFLSA-N	1	0	292.854	4.031	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@@H](C)C[C@H]1C)c1ccc(C#N)cc1F	ZINC000512611613	332975784	/nfs/dbraw/zinc/97/57/84/332975784.db2.gz	LNJVVFZRCIINCY-ZFRZLUBXSA-N	1	0	274.383	4.173	20	30		CIEDRO
Cc1cccc([C@H](C)C[NH2+][C@@H](C)c2ccc(C#N)cc2F)c1	ZINC000512620047	332976205	/nfs/dbraw/zinc/97/62/05/332976205.db2.gz	OIUOWINPUKMJIL-CABCVRRESA-N	1	0	296.389	4.460	20	30		CIEDRO
Cc1ccccc1[C@H](C)[NH2+][C@H](C)c1ccc(C#N)cc1F	ZINC000512629674	332976713	/nfs/dbraw/zinc/97/67/13/332976713.db2.gz	JUXIJRXPVBLJPX-UONOGXRCSA-N	1	0	282.362	4.418	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@@H]2CCC[C@@H]2C1)c1ccc(C#N)cc1F	ZINC000512655431	332978059	/nfs/dbraw/zinc/97/80/59/332978059.db2.gz	ULLZYCIKKRJEOH-ARLBYUKCSA-N	1	0	286.394	4.317	20	30		CIEDRO
CC[C@H](C)C[C@H](C)[NH2+][C@H](C)c1ccc(C#N)cc1F	ZINC000512666960	332978981	/nfs/dbraw/zinc/97/89/81/332978981.db2.gz	NBWJCQDBMBFNKC-RWMBFGLXSA-N	1	0	262.372	4.173	20	30		CIEDRO
COc1cccc([C@H](C)[NH2+][C@H](C)c2ccc(C#N)cc2F)c1	ZINC000512668301	332979078	/nfs/dbraw/zinc/97/90/78/332979078.db2.gz	ULAWYHADKUFLHM-QWHCGFSZSA-N	1	0	298.361	4.118	20	30		CIEDRO
N#Cc1ccc(F)c(C[NH2+][C@@H]2CCC[C@H]2c2ccccc2)c1	ZINC000513187498	333007405	/nfs/dbraw/zinc/00/74/05/333007405.db2.gz	BPDUHDXTRJMECJ-PKOBYXMFSA-N	1	0	294.373	4.123	20	30		CIEDRO
C[N@H+](CCCC(C)(C)C#N)CCC1CCCCC1	ZINC000174840677	333008664	/nfs/dbraw/zinc/00/86/64/333008664.db2.gz	FBZLGJXNOVDUFZ-UHFFFAOYSA-N	1	0	250.430	4.219	20	30		CIEDRO
CC[C@H](C)[C@@H](C)[N@H+](CCCC(C)(C)C#N)C1CC1	ZINC000174848422	333008742	/nfs/dbraw/zinc/00/87/42/333008742.db2.gz	PIUFLKPGJLWTMJ-UONOGXRCSA-N	1	0	250.430	4.215	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CCC[C@@]2(CC=CCC2)C1	ZINC000174863083	333009284	/nfs/dbraw/zinc/00/92/84/333009284.db2.gz	CEMHIVHNIWMTMM-KRWDZBQOSA-N	1	0	260.425	4.139	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CCC[C@]2(CC=CCC2)C1	ZINC000174863089	333009355	/nfs/dbraw/zinc/00/93/55/333009355.db2.gz	CEMHIVHNIWMTMM-QGZVFWFLSA-N	1	0	260.425	4.139	20	30		CIEDRO
C[C@@H]1C[C@H](c2ccccc2)[N@H+](Cc2ccccc2C#N)C1	ZINC000513236226	333010214	/nfs/dbraw/zinc/01/02/14/333010214.db2.gz	JZINZMYPBSJKHN-DNVCBOLYSA-N	1	0	276.383	4.141	20	30		CIEDRO
C[C@H]1C[C@H](c2ccccc2)[N@H+](Cc2ccc(F)c(C#N)c2)C1	ZINC000513254816	333010976	/nfs/dbraw/zinc/01/09/76/333010976.db2.gz	BZAJGMNIEDRQFL-IFXJQAMLSA-N	1	0	294.373	4.280	20	30		CIEDRO
C[C@@H]1C[C@@H](c2ccccc2)[N@H+](Cc2ccc(F)c(C#N)c2)C1	ZINC000513254817	333011073	/nfs/dbraw/zinc/01/10/73/333011073.db2.gz	BZAJGMNIEDRQFL-KUHUBIRLSA-N	1	0	294.373	4.280	20	30		CIEDRO
CCc1ccc([C@@H]2CCC[N@H+](CCCCC#N)C2)cc1	ZINC000513360768	333015380	/nfs/dbraw/zinc/01/53/80/333015380.db2.gz	DYGPMPFEUOMMAI-GOSISDBHSA-N	1	0	270.420	4.122	20	30		CIEDRO
CC[C@H](C)[C@H](C)[N@H+](Cc1cc(C#N)cs1)C1CC1	ZINC000513461704	333020767	/nfs/dbraw/zinc/02/07/67/333020767.db2.gz	OHOFJMBJVZJYBE-RYUDHWBXSA-N	1	0	262.422	4.019	20	30		CIEDRO
CC[C@@H](C)[C@H](C)[N@H+](Cc1cc(C#N)cs1)C1CC1	ZINC000513461702	333021321	/nfs/dbraw/zinc/02/13/21/333021321.db2.gz	OHOFJMBJVZJYBE-NEPJUHHUSA-N	1	0	262.422	4.019	20	30		CIEDRO
C[C@H](c1ccc(Cl)cc1)[C@@H](C)[N@H+](C)CCCCC#N	ZINC000175433061	333024805	/nfs/dbraw/zinc/02/48/05/333024805.db2.gz	CBPZJTLYKRPXOA-UONOGXRCSA-N	1	0	278.827	4.458	20	30		CIEDRO
Cc1ccc(C2CC([NH2+]Cc3ccc(C#N)c(F)c3)C2)cc1	ZINC000404832198	333028222	/nfs/dbraw/zinc/02/82/22/333028222.db2.gz	IXZOAHZOUCZOAC-UHFFFAOYSA-N	1	0	294.373	4.042	20	30		CIEDRO
N#Cc1ccc(C[N@@H+]2CCC[C@H](Cc3ccccc3)C2)s1	ZINC000513643765	333028718	/nfs/dbraw/zinc/02/87/18/333028718.db2.gz	WYDBZFMACUKWCD-MRXNPFEDSA-N	1	0	296.439	4.074	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCOc1cccc(F)c1)c1ccco1	ZINC000513665904	333030684	/nfs/dbraw/zinc/03/06/84/333030684.db2.gz	IEORMPJUFKCEAR-INIZCTEOSA-N	1	0	289.350	4.095	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)c(F)c1)c1ccc2c(c1)CCC2	ZINC000404861199	333030750	/nfs/dbraw/zinc/03/07/50/333030750.db2.gz	WMXVHQBZPWQDST-ZDUSSCGKSA-N	1	0	294.373	4.037	20	30		CIEDRO
C[C@@H]1CC[C@H]([NH2+]Cc2ccc(C#N)c(F)c2)c2ccccc21	ZINC000404860666	333030850	/nfs/dbraw/zinc/03/08/50/333030850.db2.gz	WEVYCPHRAABFEC-YJYMSZOUSA-N	1	0	294.373	4.426	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CC1(CCOC)CCCC1)c1ccco1	ZINC000513671987	333031252	/nfs/dbraw/zinc/03/12/52/333031252.db2.gz	HIGFCDCRQHPXNG-MRXNPFEDSA-N	1	0	291.435	4.473	20	30		CIEDRO
CCC(CC)C[N@H+](CCC#N)Cc1sccc1C	ZINC000513724373	333035729	/nfs/dbraw/zinc/03/57/29/333035729.db2.gz	FVERREQCTQLMAR-UHFFFAOYSA-N	1	0	264.438	4.208	20	30		CIEDRO
CC(C)(C)CN(CCC#N)Cc1cccc(Cl)c1F	ZINC000513732589	333036271	/nfs/dbraw/zinc/03/62/71/333036271.db2.gz	HPMIHQYZOUAABZ-UHFFFAOYSA-N	1	0	282.790	4.241	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccccc1COC)c1ccco1	ZINC000513755186	333037727	/nfs/dbraw/zinc/03/77/27/333037727.db2.gz	QKTPVTUANVNNKO-QGZVFWFLSA-N	1	0	285.387	4.223	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccccc1C)c1ccco1	ZINC000513762686	333037913	/nfs/dbraw/zinc/03/79/13/333037913.db2.gz	SFBHOYMYLCSYMR-INIZCTEOSA-N	1	0	255.361	4.385	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1cccc(C)c1)c1ccco1	ZINC000513762692	333038000	/nfs/dbraw/zinc/03/80/00/333038000.db2.gz	SJNWLEVGIMTFFN-INIZCTEOSA-N	1	0	255.361	4.385	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccc(Cl)s1)C1CC1	ZINC000309564195	333045632	/nfs/dbraw/zinc/04/56/32/333045632.db2.gz	KGZCUBPITGXANK-LBPRGKRZSA-N	1	0	255.814	4.236	20	30		CIEDRO
C=CCN1CCC([NH2+][C@H](C)c2ccc3ccccc3c2)CC1	ZINC000177313393	333057424	/nfs/dbraw/zinc/05/74/24/333057424.db2.gz	PQFRUVJLYNQUGE-MRXNPFEDSA-N	1	0	294.442	4.141	20	30		CIEDRO
C[C@H](c1ccc(F)cc1)[N@H+](C)Cc1ccc(F)c(C#N)c1	ZINC000177508612	333060037	/nfs/dbraw/zinc/06/00/37/333060037.db2.gz	RYFBMAAYLDUGEJ-GFCCVEGCSA-N	1	0	286.325	4.029	20	30		CIEDRO
C[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(C#N)cc1C(F)(F)F	ZINC000516941485	333087105	/nfs/dbraw/zinc/08/71/05/333087105.db2.gz	NHYDEXHKTQDSLP-IAQYHMDHSA-N	1	0	296.336	4.245	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H]2CCC[C@H]2C)cc1Cl	ZINC000517545145	333101861	/nfs/dbraw/zinc/10/18/61/333101861.db2.gz	FNAGOWJSJASNAQ-IUODEOHRSA-N	1	0	279.811	4.183	20	30		CIEDRO
C=C(C)C[N@H+](Cc1cc(Br)ccc1F)C1CC1	ZINC000521187246	333114109	/nfs/dbraw/zinc/11/41/09/333114109.db2.gz	FEVIMYBJCMXUEV-UHFFFAOYSA-N	1	0	298.199	4.129	20	30		CIEDRO
C=C(C[NH2+][C@H](C)c1cccc(NC(C)=O)c1)c1ccccc1	ZINC000336853069	335121601	/nfs/dbraw/zinc/12/16/01/335121601.db2.gz	CPDKMBIVTGZNTL-OAHLLOKOSA-N	1	0	294.398	4.009	20	30		CIEDRO
CCC[N@H+](Cc1ccc(C#N)cc1)[C@H]1CCc2ccccc21	ZINC000521192584	333114377	/nfs/dbraw/zinc/11/43/77/333114377.db2.gz	FMXNRXTYRPIYRT-FQEVSTJZSA-N	1	0	290.410	4.458	20	30		CIEDRO
CC(C)[C@@H]1CCc2ccccc2[C@@H]1[NH2+]Cc1ccc(C#N)o1	ZINC000185082189	333135165	/nfs/dbraw/zinc/13/51/65/333135165.db2.gz	MUGWWUCZJBCMHJ-PKOBYXMFSA-N	1	0	294.398	4.201	20	30		CIEDRO
C=CCSCC[NH2+][C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000219174202	333143650	/nfs/dbraw/zinc/14/36/50/333143650.db2.gz	UQEXQABFUYGYNA-LLVKDONJSA-N	1	0	289.366	4.275	20	30		CIEDRO
CC[NH+](CC)Cc1cccc(N[C@@H]2CCC[C@@H](C#N)C2)c1	ZINC000185726789	333147416	/nfs/dbraw/zinc/14/74/16/333147416.db2.gz	MLORMHOTUORSHY-NVXWUHKLSA-N	1	0	285.435	4.023	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+]CCSc2ccc(Cl)cc2)C1	ZINC000185759649	333148283	/nfs/dbraw/zinc/14/82/83/333148283.db2.gz	JBHHZPLLKHDSGC-GXTWGEPZSA-N	1	0	294.851	4.104	20	30		CIEDRO
CCCCOc1cccc(C[NH2+][C@@H]2CCC[C@@H](C#N)C2)c1	ZINC000185783191	333148691	/nfs/dbraw/zinc/14/86/91/333148691.db2.gz	ONFAGGDCNBKBFW-NVXWUHKLSA-N	1	0	286.419	4.037	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+]CC2(c3ccc(Cl)cc3)CC2)C1	ZINC000185811076	333149470	/nfs/dbraw/zinc/14/94/70/333149470.db2.gz	BSNGSJCRLSFRIF-XJKSGUPXSA-N	1	0	288.822	4.044	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+]Cc2ccc3ccccc3c2)C1	ZINC000185818490	333149711	/nfs/dbraw/zinc/14/97/11/333149711.db2.gz	YSXLGTGVHYUXRD-RDTXWAMCSA-N	1	0	264.372	4.012	20	30		CIEDRO
C[C@@H](CCC1CC1)[NH2+][C@@H](CCC#N)c1ccccc1	ZINC000186427871	333160670	/nfs/dbraw/zinc/16/06/70/333160670.db2.gz	RHGICBAOJPHWDR-YOEHRIQHSA-N	1	0	256.393	4.200	20	30		CIEDRO
C=CCCCC[N@H+]1CCC(C(F)(F)F)(C(F)(F)F)C1	ZINC000521543201	333178258	/nfs/dbraw/zinc/17/82/58/333178258.db2.gz	BYUVWEMKALTANG-UHFFFAOYSA-N	1	0	289.263	4.159	20	30		CIEDRO
C=CCCOCC[NH2+][C@@H](c1cccs1)C1CCCC1	ZINC000222441600	333193570	/nfs/dbraw/zinc/19/35/70/333193570.db2.gz	LWLFOFLUHHBRIR-MRXNPFEDSA-N	1	0	279.449	4.162	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+][C@@H](C)c1nc(C2CCCCC2)no1	ZINC000191578701	333221899	/nfs/dbraw/zinc/22/18/99/333221899.db2.gz	LDPOXMWFXMNVOF-MJBXVCDLSA-N	1	0	291.439	4.369	20	30		CIEDRO
C=CCCOCC[NH2+][C@H](C)c1oc2ccccc2c1CC	ZINC000224760780	333225412	/nfs/dbraw/zinc/22/54/12/333225412.db2.gz	XTSTXDYRJKZFIB-CQSZACIVSA-N	1	0	287.403	4.239	20	30		CIEDRO
Cc1ccccc1[C@H]([NH2+]Cc1ccc(C#N)c(F)c1)C(C)C	ZINC000192157167	333231092	/nfs/dbraw/zinc/23/10/92/333231092.db2.gz	KIAUVIXZRORFOZ-LJQANCHMSA-N	1	0	296.389	4.493	20	30		CIEDRO
CCCC[C@H](CCC)[NH2+]Cc1ccc(C#N)s1	ZINC000226269212	333255703	/nfs/dbraw/zinc/25/57/03/333255703.db2.gz	CLIBBRGNTRLUDA-LBPRGKRZSA-N	1	0	250.411	4.068	20	30		CIEDRO
CC[N@H+](Cc1ccc(OC)cc1)[C@@H](C)c1ccc(C#N)cc1	ZINC000193759462	333256873	/nfs/dbraw/zinc/25/68/73/333256873.db2.gz	JDRHWGUSBPBMKB-HNNXBMFYSA-N	1	0	294.398	4.150	20	30		CIEDRO
C[C@@H]([NH2+]CC(C)(C)CCC#N)c1ccccc1OC(F)F	ZINC000229684219	333307710	/nfs/dbraw/zinc/30/77/10/333307710.db2.gz	NSQQUZOGJCMVOT-GFCCVEGCSA-N	1	0	296.361	4.269	20	30		CIEDRO
CC(C)[C@@H]1CCCC[C@@H]1[NH2+]CC(C)(C)CCC#N	ZINC000229700925	333307932	/nfs/dbraw/zinc/30/79/32/333307932.db2.gz	HISDNAPRWIXAKL-GJZGRUSLSA-N	1	0	250.430	4.121	20	30		CIEDRO
C=CCCOCC[NH2+][C@@H](C)c1cccc2ccccc21	ZINC000229859996	333310268	/nfs/dbraw/zinc/31/02/68/333310268.db2.gz	UWWPRTTXPQDJNS-HNNXBMFYSA-N	1	0	269.388	4.083	20	30		CIEDRO
C[C@H]([NH2+]CCCC1CCCC1)c1ccc(C#N)cc1	ZINC000231664752	333327029	/nfs/dbraw/zinc/32/70/29/333327029.db2.gz	CKXAGEWLFNPJAI-AWEZNQCLSA-N	1	0	256.393	4.179	20	30		CIEDRO
N#Cc1ccc(C[N@@H+]2CCCC3(CCCCC3)C2)c(F)c1	ZINC000523587398	333333566	/nfs/dbraw/zinc/33/35/66/333333566.db2.gz	QNOFRDZDOYEESH-UHFFFAOYSA-N	1	0	286.394	4.244	20	30		CIEDRO
C=C(C)C[N@@H+](CCC)Cc1ccc(OCCC)c(OC)c1	ZINC000302745031	333335124	/nfs/dbraw/zinc/33/51/24/333335124.db2.gz	FEEYHTFAPIOKEE-UHFFFAOYSA-N	1	0	291.435	4.272	20	30		CIEDRO
CC(C)(C#N)CCCC[NH2+][C@@H]1CCCCC1(C)C	ZINC000232512763	333337784	/nfs/dbraw/zinc/33/77/84/333337784.db2.gz	QQKQVGPBFLGSJK-CQSZACIVSA-N	1	0	250.430	4.265	20	30		CIEDRO
CC(C)(C#N)CCCC[NH+]1CCC2(CCCC2)CC1	ZINC000232530834	333338131	/nfs/dbraw/zinc/33/81/31/333338131.db2.gz	IJOKQPVVJUAEKR-UHFFFAOYSA-N	1	0	262.441	4.363	20	30		CIEDRO
CC(C)(C#N)CCCC[N@@H+]1CCCc2ccccc2C1	ZINC000232531098	333338147	/nfs/dbraw/zinc/33/81/47/333338147.db2.gz	NDQVHSMTQPZUAF-UHFFFAOYSA-N	1	0	270.420	4.155	20	30		CIEDRO
C[C@H](CCC1CCCCC1)[NH2+]Cc1cccc(C#N)c1	ZINC000523734862	333342877	/nfs/dbraw/zinc/34/28/77/333342877.db2.gz	MQFZYWYLPFDSIM-OAHLLOKOSA-N	1	0	270.420	4.397	20	30		CIEDRO
C[C@@H]1C[C@@H](c2ccc(F)cc2)C[N@@H+]1Cc1ccc(C#N)cc1	ZINC000524072056	333353144	/nfs/dbraw/zinc/35/31/44/333353144.db2.gz	STISWJNIAAWTJG-RDTXWAMCSA-N	1	0	294.373	4.075	20	30		CIEDRO
C[N@H+](CCCCC(C)(C)C#N)C1CCCCCC1	ZINC000234271162	333359362	/nfs/dbraw/zinc/35/93/62/333359362.db2.gz	JDNLNKATTYGMTK-UHFFFAOYSA-N	1	0	250.430	4.361	20	30		CIEDRO
Cc1cc([C@@H](C)[NH2+]CCCCC(C)(C)C#N)c(C)o1	ZINC000235192622	333366349	/nfs/dbraw/zinc/36/63/49/333366349.db2.gz	OZZFLRDVVBJBPB-CYBMUJFWSA-N	1	0	262.397	4.267	20	30		CIEDRO
C=C1CC[NH+](Cc2ccc(OCc3ccccc3)cc2)CC1	ZINC000524563285	333366730	/nfs/dbraw/zinc/36/67/30/333366730.db2.gz	ITBPGRIQDUSRRC-UHFFFAOYSA-N	1	0	293.410	4.418	20	30		CIEDRO
C[C@@H]1CC[C@@H]([NH2+]CCCCC(C)(C)C#N)[C@@H](C)C1	ZINC000235274900	333367132	/nfs/dbraw/zinc/36/71/32/333367132.db2.gz	FWOJUAKYWYYMPH-QLFBSQMISA-N	1	0	250.430	4.121	20	30		CIEDRO
C=CCCCCC[N@@H+](C)Cc1ccc(F)c(F)c1	ZINC000524607948	333368378	/nfs/dbraw/zinc/36/83/78/333368378.db2.gz	BRGDXNWGOUEUAU-UHFFFAOYSA-N	1	0	253.336	4.143	20	30		CIEDRO
C=CCCCCCN(C)Cc1csc(CCC)n1	ZINC000524609386	333368518	/nfs/dbraw/zinc/36/85/18/333368518.db2.gz	WFBQNIZGEJUQAP-UHFFFAOYSA-N	1	0	266.454	4.274	20	30		CIEDRO
C[C@H]1CCC[C@H]([N@H+](C)CCCCC(C)(C)C#N)C1	ZINC000235574020	333370837	/nfs/dbraw/zinc/37/08/37/333370837.db2.gz	FWORCNVRZBEVMO-GJZGRUSLSA-N	1	0	250.430	4.217	20	30		CIEDRO
CC(C)CC[C@@H](C)[NH2+]Cc1cccc(OCCCC#N)c1	ZINC000236605145	333374104	/nfs/dbraw/zinc/37/41/04/333374104.db2.gz	ZCZTUBSDIWTFQG-MRXNPFEDSA-N	1	0	288.435	4.283	20	30		CIEDRO
N#Cc1ccc(C[NH2+]CCc2cccc3ccccc32)cc1	ZINC000237842352	333381970	/nfs/dbraw/zinc/38/19/70/333381970.db2.gz	QKRHZDHWXFQZTH-UHFFFAOYSA-N	1	0	286.378	4.044	20	30		CIEDRO
C[C@H](CC(C)(C)c1ccccc1)[NH2+]Cc1ccc(C#N)cc1	ZINC000315623439	333382728	/nfs/dbraw/zinc/38/27/28/333382728.db2.gz	SVXSIKWWZLXHOI-MRXNPFEDSA-N	1	0	292.426	4.404	20	30		CIEDRO
CC[C@H]([NH2+][C@H](C)c1ccc(C#N)cc1)c1ccccc1OC	ZINC000315731275	333383442	/nfs/dbraw/zinc/38/34/42/333383442.db2.gz	LZFYVXRZROGVGY-KDOFPFPSSA-N	1	0	294.398	4.369	20	30		CIEDRO
C=CCC[N@H+]1CCCCC[C@@H]1c1ccc(OC)cc1	ZINC000524811706	333389224	/nfs/dbraw/zinc/38/92/24/333389224.db2.gz	LKVAUIUKGLYDMP-QGZVFWFLSA-N	1	0	259.393	4.188	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1csc(-c2ccc(F)cc2)n1	ZINC000393746631	333414321	/nfs/dbraw/zinc/41/43/21/333414321.db2.gz	MZGXYRMXGDDSLU-AWEZNQCLSA-N	1	0	290.407	4.394	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1ccc(F)cc1C(F)(F)F	ZINC000393783122	333414670	/nfs/dbraw/zinc/41/46/70/333414670.db2.gz	USFCGYOTRVFGLX-LBPRGKRZSA-N	1	0	275.289	4.289	20	30		CIEDRO
C=C(C)CC[NH2+]C(C)(C)c1nc2ccccc2s1	ZINC000528603467	333448859	/nfs/dbraw/zinc/44/88/59/333448859.db2.gz	PKKHWMYCTGBEJM-UHFFFAOYSA-N	1	0	260.406	4.087	20	30		CIEDRO
C=CC[C@H](Cc1ccccc1)[NH2+][C@H](C)C1CC(F)(F)C1	ZINC000529605511	333500784	/nfs/dbraw/zinc/50/07/84/333500784.db2.gz	DLIKCXYVELDGGW-CZUORRHYSA-N	1	0	279.374	4.197	20	30		CIEDRO
C[C@H](CCc1ccccc1)[NH2+][C@@H](C)c1cccc(C#N)c1	ZINC000037231633	333519972	/nfs/dbraw/zinc/51/99/72/333519972.db2.gz	ORLIAKGIXBNVSN-CVEARBPZSA-N	1	0	278.399	4.230	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(Cl)cc1)c1cccc(C#N)c1	ZINC000037243341	333522594	/nfs/dbraw/zinc/52/25/94/333522594.db2.gz	ZLLFXIZUKAVAAP-LBPRGKRZSA-N	1	0	270.763	4.062	20	30		CIEDRO
CCCC1CCC([NH2+]Cc2ccc(C#N)cc2)CC1	ZINC000037505892	333534398	/nfs/dbraw/zinc/53/43/98/333534398.db2.gz	JQAZIPVLVQCHFZ-UHFFFAOYSA-N	1	0	256.393	4.007	20	30		CIEDRO
C=C(CC)C[NH2+][C@@H](C)c1ccc(OCC)c(OCC)c1	ZINC000538167506	333577637	/nfs/dbraw/zinc/57/76/37/333577637.db2.gz	OBHLJFCIZYHSIY-AWEZNQCLSA-N	1	0	277.408	4.101	20	30		CIEDRO
N#Cc1csc(C[NH2+][C@H]2CCC[C@@H]2c2ccccc2)c1	ZINC000538403760	333589110	/nfs/dbraw/zinc/58/91/10/333589110.db2.gz	XHLBOSALWHZGKZ-SJORKVTESA-N	1	0	282.412	4.046	20	30		CIEDRO
Cc1cccc([C@H](C)C[NH2+][C@H](C)c2ccc(C#N)c(F)c2)c1	ZINC000538506928	333600836	/nfs/dbraw/zinc/60/08/36/333600836.db2.gz	MTDCGWMEDCMSCY-HUUCEWRRSA-N	1	0	296.389	4.460	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCc2cc(F)ccc21)c1ccc(C#N)c(F)c1	ZINC000538508672	333601140	/nfs/dbraw/zinc/60/11/40/333601140.db2.gz	XPGNXUWIOLKHTP-BBATYDOGSA-N	1	0	298.336	4.175	20	30		CIEDRO
C=C[C@H](C)[NH2+][C@@H]1CCc2c1cc(Cl)cc2Cl	ZINC000126901982	333613732	/nfs/dbraw/zinc/61/37/32/333613732.db2.gz	QHFYYWAVEWGLIZ-ISVAXAHUSA-N	1	0	256.176	4.145	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@@H]1CCOC2(CCCCC2)C1	ZINC000127371061	333627416	/nfs/dbraw/zinc/62/74/16/333627416.db2.gz	VZTHOPHXKQSNHP-JKSUJKDBSA-N	1	0	265.441	4.203	20	30		CIEDRO
CC(C)COc1cccc(C[NH2+]CC(C)(C)CCC#N)c1	ZINC000174303268	335152329	/nfs/dbraw/zinc/15/23/29/335152329.db2.gz	OIHUDLNUCVLJHK-UHFFFAOYSA-N	1	0	288.435	4.141	20	30		CIEDRO
C=CCCOCC[NH2+][C@H](CC(C)C)c1cccs1	ZINC000539052741	333652035	/nfs/dbraw/zinc/65/20/35/333652035.db2.gz	LMKALTLMJXPDDL-CQSZACIVSA-N	1	0	267.438	4.018	20	30		CIEDRO
C[C@@H]([NH2+]C1CCC(Oc2ccccc2C#N)CC1)C1(C)CC1	ZINC000539081669	333656268	/nfs/dbraw/zinc/65/62/68/333656268.db2.gz	ONGKLMOQRRJFOA-ODIFPOPNSA-N	1	0	298.430	4.026	20	30		CIEDRO
C=CCCC[NH2+][C@@H](CC)c1ccccc1OC(F)F	ZINC000539251954	333663266	/nfs/dbraw/zinc/66/32/66/333663266.db2.gz	GHAZHQFJSZYSIA-ZDUSSCGKSA-N	1	0	269.335	4.295	20	30		CIEDRO
C=C(C)C[NH2+][C@@H](C)c1ccc(-c2csc(C)n2)cc1	ZINC000539254299	333663301	/nfs/dbraw/zinc/66/33/01/333663301.db2.gz	NQSVTXHHOUSVJU-LBPRGKRZSA-N	1	0	272.417	4.345	20	30		CIEDRO
CC[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1ccc(C#N)c(F)c1	ZINC000539609331	333680926	/nfs/dbraw/zinc/68/09/26/333680926.db2.gz	FEIBNIIBBINMRZ-OGHNNQOOSA-N	1	0	274.383	4.317	20	30		CIEDRO
CC(C)C[C@H](C)[NH2+]CC#Cc1ccc(C(F)(F)F)cc1	ZINC000540186797	333719149	/nfs/dbraw/zinc/71/91/49/333719149.db2.gz	LXKXDACOJBMORB-ZDUSSCGKSA-N	1	0	283.337	4.081	20	30		CIEDRO
CCCc1ccc([C@@H]([NH2+]CC2(C#N)CC2)C(C)C)cc1	ZINC000540550885	333735056	/nfs/dbraw/zinc/73/50/56/333735056.db2.gz	PYQTWTRELJBNEF-KRWDZBQOSA-N	1	0	270.420	4.230	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CCCC[C@@H]2c2ccccc2)s1	ZINC000540575305	333735856	/nfs/dbraw/zinc/73/58/56/333735856.db2.gz	PPOVBPMOKGPYNP-QZTJIDSGSA-N	1	0	296.439	4.436	20	30		CIEDRO
C[C@H](C[NH2+][C@@H](C)c1cccc(C#N)c1)c1ccc(F)cc1	ZINC000540591417	333736229	/nfs/dbraw/zinc/73/62/29/333736229.db2.gz	IXGLXOXDAJKPNR-KGLIPLIRSA-N	1	0	282.362	4.152	20	30		CIEDRO
C[C@H]1CCc2ccccc2[C@H]1[NH2+]Cc1ccc(C#N)cc1F	ZINC000540870084	333750593	/nfs/dbraw/zinc/75/05/93/333750593.db2.gz	LILLJDNDLUCOCJ-DJJJIMSYSA-N	1	0	294.373	4.111	20	30		CIEDRO
C[C@@]1([NH2+]Cc2ccc(C#N)cc2F)CCCc2ccccc21	ZINC000540906497	333752618	/nfs/dbraw/zinc/75/26/18/333752618.db2.gz	ANBZYOAKCIEHHD-LJQANCHMSA-N	1	0	294.373	4.039	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(CC#N)cc1)[C@@H](C)c1ccccc1	ZINC000541613396	333784176	/nfs/dbraw/zinc/78/41/76/333784176.db2.gz	DJQGQHGAQWAIKZ-CVEARBPZSA-N	1	0	278.399	4.034	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(CC#N)cc1)[C@H](C)c1ccccc1	ZINC000541613399	333784366	/nfs/dbraw/zinc/78/43/66/333784366.db2.gz	DJQGQHGAQWAIKZ-JKSUJKDBSA-N	1	0	278.399	4.034	20	30		CIEDRO
CC(C)(C#N)CC[NH2+]C1(Cc2ccccc2)CCCC1	ZINC000541702054	333787479	/nfs/dbraw/zinc/78/74/79/333787479.db2.gz	UYAPBDMJLWXCOT-UHFFFAOYSA-N	1	0	270.420	4.071	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+]Cc1ccc2[nH]c(C)c(C)c2c1	ZINC000541742262	333789061	/nfs/dbraw/zinc/78/90/61/333789061.db2.gz	RWJQOVZSYPNQAS-GFCCVEGCSA-N	1	0	256.393	4.229	20	30		CIEDRO
C[C@@H]([NH2+]C/C=C/c1ccccc1)c1ccc(C#N)c(F)c1	ZINC000541846800	333794148	/nfs/dbraw/zinc/79/41/48/333794148.db2.gz	VNPTZCDGEFNYDD-LHRNQBEKSA-N	1	0	280.346	4.061	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](C)C[C@H]1C)c1ccc(C#N)cc1	ZINC000070111039	333799416	/nfs/dbraw/zinc/79/94/16/333799416.db2.gz	MDFUZKDPSUNCOT-WVZRYYJFSA-N	1	0	256.393	4.034	20	30		CIEDRO
N#CCC1CC[NH+](CCc2ccc3ccccc3c2)CC1	ZINC000541953891	333803838	/nfs/dbraw/zinc/80/38/38/333803838.db2.gz	VTGDLUQMUPLOSG-UHFFFAOYSA-N	1	0	278.399	4.008	20	30		CIEDRO
C=CCC[NH2+][C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000542018645	333806933	/nfs/dbraw/zinc/80/69/33/333806933.db2.gz	WXFRDGADRVTWOT-OAHLLOKOSA-N	1	0	276.383	4.452	20	30		CIEDRO
N#CCCC[NH2+][C@@H](c1ccc(Cl)c(Cl)c1)C1CC1	ZINC000542498013	333828553	/nfs/dbraw/zinc/82/85/53/333828553.db2.gz	DZSJJARCERMKNK-CQSZACIVSA-N	1	0	283.202	4.338	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](C)c1csc(CC)n1	ZINC000542573807	333832489	/nfs/dbraw/zinc/83/24/89/333832489.db2.gz	KYUHBJGXCFBWHP-NWDGAFQWSA-N	1	0	252.427	4.101	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+]CC1(Cc2ccc(F)cc2)CC1	ZINC000542662459	333834716	/nfs/dbraw/zinc/83/47/16/333834716.db2.gz	IQVYIGHTOJQIGD-CQSZACIVSA-N	1	0	261.384	4.093	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+][C@@H]1CCc2[nH]c3ccc(C)cc3c2C1	ZINC000542679094	333836014	/nfs/dbraw/zinc/83/60/14/333836014.db2.gz	HYOWODULCPWPLG-HUUCEWRRSA-N	1	0	282.431	4.278	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@@H]1CCc2[nH]c3ccc(C)cc3c2C1	ZINC000542679095	333836074	/nfs/dbraw/zinc/83/60/74/333836074.db2.gz	HYOWODULCPWPLG-LSDHHAIUSA-N	1	0	282.431	4.278	20	30		CIEDRO
N#CCC[C@@H]([NH2+]Cc1cccc(Cl)c1)c1ccccc1	ZINC000130409841	333841417	/nfs/dbraw/zinc/84/14/17/333841417.db2.gz	NWZMMRAQZYGKFE-QGZVFWFLSA-N	1	0	284.790	4.475	20	30		CIEDRO
Cc1ccsc1[C@H](Cc1ccccc1)[NH2+]CC1(C#N)CC1	ZINC000543452207	333875764	/nfs/dbraw/zinc/87/57/64/333875764.db2.gz	NBORBCWHCWBVGM-INIZCTEOSA-N	1	0	296.439	4.234	20	30		CIEDRO
CC(C)C[C@H]([NH2+]CCCSCC#N)c1cccs1	ZINC000543487918	333877592	/nfs/dbraw/zinc/87/75/92/333877592.db2.gz	WLJNKJMLMHOHHZ-ZDUSSCGKSA-N	1	0	282.478	4.072	20	30		CIEDRO
Cc1c2ccccc2oc1[C@H](C)[NH2+]CCC(C)(C)C#N	ZINC000543518058	333878964	/nfs/dbraw/zinc/87/89/64/333878964.db2.gz	RUBTZQWNXWKCTO-ZDUSSCGKSA-N	1	0	270.376	4.332	20	30		CIEDRO
C=CCC[C@H](C)[NH2+]CC1(c2ccc(OC)cc2)CCC1	ZINC000543621410	333885185	/nfs/dbraw/zinc/88/51/85/333885185.db2.gz	NSOUMISGXGNTRY-HNNXBMFYSA-N	1	0	273.420	4.061	20	30		CIEDRO
CCCCC/C(=C/c1ccccc1)C[NH2+]C[C@H](C)C#N	ZINC000543624132	333885512	/nfs/dbraw/zinc/88/55/12/333885512.db2.gz	QPUBUFXCXFALGY-UWCCDQBKSA-N	1	0	270.420	4.400	20	30		CIEDRO
C=CCSCC[NH2+][C@H](C)c1ccc(SCC)cc1	ZINC000543754919	333895877	/nfs/dbraw/zinc/89/58/77/333895877.db2.gz	OHGBYZTWSYITKQ-CYBMUJFWSA-N	1	0	281.490	4.368	20	30		CIEDRO
C=C(CC)C[NH2+][C@H](C)c1nc(C(C)(C)C)cs1	ZINC000544490586	333933607	/nfs/dbraw/zinc/93/36/07/333933607.db2.gz	ZEEQXKZGLJESDR-LLVKDONJSA-N	1	0	252.427	4.057	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+]Cc1cccc(COC(C)(C)C)c1	ZINC000544575409	333937245	/nfs/dbraw/zinc/93/72/45/333937245.db2.gz	HRBDBBSWUVDGTL-OAHLLOKOSA-N	1	0	275.436	4.446	20	30		CIEDRO
CC(C)(C)[N@H+](CCCSCC#N)Cc1ccc(F)cc1	ZINC000132775921	334005403	/nfs/dbraw/zinc/00/54/03/334005403.db2.gz	RTJXYXOWQHLBNB-UHFFFAOYSA-N	1	0	294.439	4.073	20	30		CIEDRO
C[C@H]1CC[C@H]([NH2+]Cc2ccc(CC#N)cc2)c2ccccc21	ZINC000576226718	335173697	/nfs/dbraw/zinc/17/36/97/335173697.db2.gz	SNOVUWFBNAFRGJ-YWZLYKJASA-N	1	0	290.410	4.481	20	30		CIEDRO
N#Cc1csc(C[N@@H+]2CCCC[C@H]2c2ccccc2)c1	ZINC000546691619	334045947	/nfs/dbraw/zinc/04/59/47/334045947.db2.gz	MNCFVPMSEGSFLN-KRWDZBQOSA-N	1	0	282.412	4.347	20	30		CIEDRO
C=CCCC[NH2+][C@H](c1cccc(Cl)c1)c1ccccn1	ZINC000133769794	334054957	/nfs/dbraw/zinc/05/49/57/334054957.db2.gz	UTIDYAIYJKCHDH-QGZVFWFLSA-N	1	0	286.806	4.380	20	30		CIEDRO
CC(C)[C@H](Cc1ccc(F)cc1)[NH2+]Cc1ccc(C#N)cc1	ZINC000236701570	334066243	/nfs/dbraw/zinc/06/62/43/334066243.db2.gz	FEOQIRWBHZKNDO-IBGZPJMESA-N	1	0	296.389	4.054	20	30		CIEDRO
C=CC[C@@H](CO)[NH2+][C@@H](C)c1ccc(-c2ccccc2)s1	ZINC000547393071	334085225	/nfs/dbraw/zinc/08/52/25/334085225.db2.gz	BTEFCYANEKHNDN-ZFWWWQNUSA-N	1	0	287.428	4.003	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@@H](C)c1ccc(OC)c(Cl)c1	ZINC000547393489	334085418	/nfs/dbraw/zinc/08/54/18/334085418.db2.gz	HSNKHEMGLMDIIO-AAEUAGOBSA-N	1	0	267.800	4.354	20	30		CIEDRO
C=CC[C@@H](CC)[NH2+][C@@H](C)c1ccc(OC)c(Cl)c1	ZINC000547393491	334085435	/nfs/dbraw/zinc/08/54/35/334085435.db2.gz	HSNKHEMGLMDIIO-WCQYABFASA-N	1	0	267.800	4.354	20	30		CIEDRO
C=C(C[NH2+][C@H](C)c1cccc(F)c1)c1ccccc1	ZINC000134369897	334089110	/nfs/dbraw/zinc/08/91/10/334089110.db2.gz	RGGCKSJYKUWANP-CQSZACIVSA-N	1	0	255.336	4.190	20	30		CIEDRO
CC(C)(C#N)CC[NH2+][C@H]1CCCC[C@H]1Cc1ccccc1	ZINC000547509489	334096330	/nfs/dbraw/zinc/09/63/30/334096330.db2.gz	CUNNDGIRKGNWAR-ROUUACIJSA-N	1	0	284.447	4.317	20	30		CIEDRO
N#Cc1ccc(C[NH2+]CC2CCC(c3ccccc3)CC2)o1	ZINC000237841825	334100259	/nfs/dbraw/zinc/10/02/59/334100259.db2.gz	YRTOPLXIJSTIQN-UHFFFAOYSA-N	1	0	294.398	4.215	20	30		CIEDRO
C=CC[C@H](C)[NH2+]Cc1ccc(-c2ccccc2)s1	ZINC000134746864	334102871	/nfs/dbraw/zinc/10/28/71/334102871.db2.gz	SVDUWXSGPRFDRA-ZDUSSCGKSA-N	1	0	257.402	4.469	20	30		CIEDRO
C=CC[C@@H](C)[NH2+]Cc1cc(-c2ccccc2)cs1	ZINC000134749610	334103001	/nfs/dbraw/zinc/10/30/01/334103001.db2.gz	NCBMUTWNUAPWSB-CYBMUJFWSA-N	1	0	257.402	4.469	20	30		CIEDRO
C[N@H+](Cc1cccc(F)c1)Cc1ccccc1C(C)(C)C#N	ZINC000135097992	334115162	/nfs/dbraw/zinc/11/51/62/334115162.db2.gz	HMIOIKIHKMSKTG-UHFFFAOYSA-N	1	0	296.389	4.259	20	30		CIEDRO
CCc1ccc([C@@H]([NH2+]Cc2ccc(C#N)o2)C(C)C)cc1	ZINC000135132903	334116957	/nfs/dbraw/zinc/11/69/57/334116957.db2.gz	RHPUUWWWWOMGPU-SFHVURJKSA-N	1	0	282.387	4.201	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]C1CCC(C(F)(F)F)CC1	ZINC000135143623	334117517	/nfs/dbraw/zinc/11/75/17/334117517.db2.gz	RUMPRJCPRJFKMP-UHFFFAOYSA-N	1	0	276.346	4.027	20	30		CIEDRO
C[N@H+](Cc1ccccc1C(C)(C)C#N)C(C1CC1)C1CC1	ZINC000135161892	334118576	/nfs/dbraw/zinc/11/85/76/334118576.db2.gz	WKKKHRZYUNNOHR-UHFFFAOYSA-N	1	0	282.431	4.108	20	30		CIEDRO
C[C@H](c1cccc(Cl)c1F)[NH+]1CCC(CC#N)CC1	ZINC000547831041	334124359	/nfs/dbraw/zinc/12/43/59/334124359.db2.gz	MFXILKDFUSOUHD-LLVKDONJSA-N	1	0	280.774	4.166	20	30		CIEDRO
C[C@@H](C[NH2+][C@H](C)c1ccc(C#N)cc1)Cc1ccccc1	ZINC000547846396	334126730	/nfs/dbraw/zinc/12/67/30/334126730.db2.gz	ZSFHSUOLWGUMJW-HZPDHXFCSA-N	1	0	278.399	4.088	20	30		CIEDRO
N#CCCCC[N@@H+]1CCC[C@@H]1CCCc1ccccc1	ZINC000135357363	334127249	/nfs/dbraw/zinc/12/72/49/334127249.db2.gz	RKUQXVPWJBNASD-SFHVURJKSA-N	1	0	270.420	4.168	20	30		CIEDRO
C[C@H]([NH2+]CCCCc1ccccc1)c1ccc(C#N)cc1	ZINC000135362795	334127697	/nfs/dbraw/zinc/12/76/97/334127697.db2.gz	OOBNNXKYGOIVKG-INIZCTEOSA-N	1	0	278.399	4.232	20	30		CIEDRO
CC(C)C[C@@H]([NH2+]Cc1ccc(C#N)s1)c1ccccc1	ZINC000135670647	334135942	/nfs/dbraw/zinc/13/59/42/334135942.db2.gz	GDJAPXFFOJIKPL-QGZVFWFLSA-N	1	0	284.428	4.497	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C#N)s1)c1ccc(Cl)s1	ZINC000135675444	334135958	/nfs/dbraw/zinc/13/59/58/334135958.db2.gz	KGFAKXCILYIOSJ-MRVPVSSYSA-N	1	0	282.821	4.185	20	30		CIEDRO
CCC[C@H]1CCCC[C@H]1[NH2+]CCCC(C)(C)C#N	ZINC000548487949	334160093	/nfs/dbraw/zinc/16/00/93/334160093.db2.gz	FSTXVXPDHBGRJK-LSDHHAIUSA-N	1	0	250.430	4.265	20	30		CIEDRO
CCC[C@@H]1CCCC[C@H]1[NH2+]CCCC(C)(C)C#N	ZINC000548487948	334160054	/nfs/dbraw/zinc/16/00/54/334160054.db2.gz	FSTXVXPDHBGRJK-HUUCEWRRSA-N	1	0	250.430	4.265	20	30		CIEDRO
C=CCC[NH2+][C@@H](c1cc(F)cc(Br)c1)C1CC1	ZINC000548492908	334160395	/nfs/dbraw/zinc/16/03/95/334160395.db2.gz	BRXKGXZVQMBIBL-CQSZACIVSA-N	1	0	298.199	4.205	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCCC(C)(C)C1)c1ccc(C#N)cc1	ZINC000079974561	334164737	/nfs/dbraw/zinc/16/47/37/334164737.db2.gz	NZSZOTSONDHLTG-CZUORRHYSA-N	1	0	256.393	4.178	20	30		CIEDRO
CCCc1ccc(C[NH2+][C@H](C)c2ccc(C#N)cc2)cc1	ZINC000549174777	334187189	/nfs/dbraw/zinc/18/71/89/334187189.db2.gz	YGYVQROUJBNNOK-OAHLLOKOSA-N	1	0	278.399	4.362	20	30		CIEDRO
CCCc1ccc(C[NH2+][C@@H](C)c2ccc(C#N)cc2)cc1	ZINC000549174776	334187233	/nfs/dbraw/zinc/18/72/33/334187233.db2.gz	YGYVQROUJBNNOK-HNNXBMFYSA-N	1	0	278.399	4.362	20	30		CIEDRO
CC[C@H](C[N@H+](CC)[C@H]1CC[C@@H](C#N)C1)c1ccccc1	ZINC000549556472	334197894	/nfs/dbraw/zinc/19/78/94/334197894.db2.gz	YMPOYTCIKAJCBM-NUJGCVRESA-N	1	0	270.420	4.194	20	30		CIEDRO
C[C@@H]([NH2+]CC1CC(c2ccccc2)C1)c1cccc(C#N)c1	ZINC000549625587	334200169	/nfs/dbraw/zinc/20/01/69/334200169.db2.gz	PQXBPJUNKBCRIJ-XRTORIHISA-N	1	0	290.410	4.403	20	30		CIEDRO
CC[N@H+](Cc1ccc2ccccc2c1)[C@H]1CC[C@H](C#N)C1	ZINC000549772095	334204608	/nfs/dbraw/zinc/20/46/08/334204608.db2.gz	FBNFQKSWKMFJMO-KXBFYZLASA-N	1	0	278.399	4.354	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H]1CCN([C@H](C)c2ccccc2)C1	ZINC000549833068	334206342	/nfs/dbraw/zinc/20/63/42/334206342.db2.gz	LWLFHGOHBFBYQC-SJLPKXTDSA-N	1	0	286.463	4.014	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@H](C#N)C1)c1cc(Cl)ccc1Cl	ZINC000549938739	334209949	/nfs/dbraw/zinc/20/99/49/334209949.db2.gz	IJUWYGBFBJITCX-NHCYSSNCSA-N	1	0	283.202	4.336	20	30		CIEDRO
CC(C)c1ccc(C[C@@H]2CC[N@@H+]([C@@H]3CC[C@@H](C#N)C3)C2)cc1	ZINC000549938631	334209966	/nfs/dbraw/zinc/20/99/66/334209966.db2.gz	BCGNNRJESKGSHW-WSTZPKSXSA-N	1	0	296.458	4.367	20	30		CIEDRO
CC(C)(C#N)c1ccccc1C[N@@H+]1CC[C@@H](CC2CC2)C1	ZINC000550049185	334211962	/nfs/dbraw/zinc/21/19/62/334211962.db2.gz	LSPODJYEDCQKGA-INIZCTEOSA-N	1	0	282.431	4.110	20	30		CIEDRO
C[C@H]([NH2+]CCC1Cc2ccccc2C1)c1ccc(C#N)cc1	ZINC000550218987	334216500	/nfs/dbraw/zinc/21/65/00/334216500.db2.gz	CLRNJDLACVSRRF-HNNXBMFYSA-N	1	0	290.410	4.014	20	30		CIEDRO
CC[C@H]1CC[C@H]([NH2+][C@@H](C)c2ccc(C#N)cc2F)CC1	ZINC000550830785	334229651	/nfs/dbraw/zinc/22/96/51/334229651.db2.gz	HJBUVCFKVFKQJI-YDHLFZDLSA-N	1	0	274.383	4.317	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-]	ZINC000550856848	334230408	/nfs/dbraw/zinc/23/04/08/334230408.db2.gz	YWNKVOBQVKEDTQ-CQSZACIVSA-N	1	0	290.407	4.108	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H](C)c1ccc(C#N)cc1Cl	ZINC000550856663	334230451	/nfs/dbraw/zinc/23/04/51/334230451.db2.gz	LWVXOTRWBYKBQW-LBPRGKRZSA-N	1	0	276.811	4.465	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H](C)c1ccnn1-c1ccccc1	ZINC000550857053	334230466	/nfs/dbraw/zinc/23/04/66/334230466.db2.gz	MTBUOKSLCWKLSJ-OAHLLOKOSA-N	1	0	283.419	4.125	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H](C)c1ccc(C#N)cc1Cl	ZINC000550856652	334230521	/nfs/dbraw/zinc/23/05/21/334230521.db2.gz	LWVXOTRWBYKBQW-GFCCVEGCSA-N	1	0	276.811	4.465	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)C1CC1	ZINC000550896030	334232655	/nfs/dbraw/zinc/23/26/55/334232655.db2.gz	UTQDUBWYYBGKAM-OKZBNKHCSA-N	1	0	255.405	4.125	20	30		CIEDRO
C[C@@H]1C[C@H]([NH2+]CCCCC#N)C[C@@H](c2ccccc2)C1	ZINC000247040584	334274440	/nfs/dbraw/zinc/27/44/40/334274440.db2.gz	OBYNVGFHOGKIQC-SZMVWBNQSA-N	1	0	270.420	4.242	20	30		CIEDRO
C[C@H]([NH2+]Cc1cccc(C#N)c1F)c1cccc(C2CC2)c1	ZINC000551176258	334240005	/nfs/dbraw/zinc/24/00/05/334240005.db2.gz	VSLSCSFQBHJDSS-ZDUSSCGKSA-N	1	0	294.373	4.426	20	30		CIEDRO
N#CCc1ccc(C[N@@H+]2CCC=C(c3ccccc3)C2)cc1	ZINC000551407335	334249598	/nfs/dbraw/zinc/24/95/98/334249598.db2.gz	PPAMHWYOMUMBDJ-UHFFFAOYSA-N	1	0	288.394	4.042	20	30		CIEDRO
CC[C@@H](C[NH2+]C1(c2cccc(C#N)c2)CC1)c1ccccc1	ZINC000551832704	334263782	/nfs/dbraw/zinc/26/37/82/334263782.db2.gz	CIUKDNNBPVEABZ-KRWDZBQOSA-N	1	0	290.410	4.331	20	30		CIEDRO
C[C@@H](C[NH2+]C1(c2cccc(C#N)c2)CC1)c1ccc(F)cc1	ZINC000551834223	334263852	/nfs/dbraw/zinc/26/38/52/334263852.db2.gz	OOKWNICKNVESFS-AWEZNQCLSA-N	1	0	294.373	4.080	20	30		CIEDRO
C[C@@H]1CC[N@H+](Cc2cc(C#N)cs2)[C@@H]2CCCC[C@H]12	ZINC000551974506	334268551	/nfs/dbraw/zinc/26/85/51/334268551.db2.gz	BTXBUDWPGWHJKJ-DAXOMENPSA-N	1	0	274.433	4.020	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCCNc1ccccc1)c1ccco1	ZINC000552049227	334281500	/nfs/dbraw/zinc/28/15/00/334281500.db2.gz	QQKGQQRNHLEGAL-KRWDZBQOSA-N	1	0	284.403	4.379	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@@H](CC)c1cccc(C)c1	ZINC000552057116	334282418	/nfs/dbraw/zinc/28/24/18/334282418.db2.gz	GEBAQIMZMNAFNH-SQNIBIBYSA-N	1	0	273.420	4.017	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@H]1C[NH2+][C@H](CC)c1cccc(C)c1	ZINC000552057114	334282510	/nfs/dbraw/zinc/28/25/10/334282510.db2.gz	GEBAQIMZMNAFNH-KSZLIROESA-N	1	0	273.420	4.017	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@H](C)c1ccc(OC)c(OC)c1C	ZINC000552055920	334282584	/nfs/dbraw/zinc/28/25/84/334282584.db2.gz	ILXJHIBKHZGELE-KGLIPLIRSA-N	1	0	277.408	4.018	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@]1(C)CCO[C@H]1C1CC1)c1ccco1	ZINC000552067819	334284965	/nfs/dbraw/zinc/28/49/65/334284965.db2.gz	YXZHGIZRSCZSKU-SZMVWBNQSA-N	1	0	289.419	4.082	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCOCc1ccccc1)c1ccco1	ZINC000552249861	334308439	/nfs/dbraw/zinc/30/84/39/334308439.db2.gz	NCCYMDLLCRGYHI-KRWDZBQOSA-N	1	0	285.387	4.093	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCC[C@@H]1CCCC[C@H]1O)c1ccco1	ZINC000552276115	334311602	/nfs/dbraw/zinc/31/16/02/334311602.db2.gz	LCRYOKRXNVINDY-YESZJQIVSA-N	1	0	291.435	4.208	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@H]1CCCCS1)c1ccco1	ZINC000552281783	334312427	/nfs/dbraw/zinc/31/24/27/334312427.db2.gz	JQNJYXBJKJROCK-ZIAGYGMSSA-N	1	0	265.422	4.162	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)c1ccc(OC(F)F)cc1	ZINC000248707581	334314188	/nfs/dbraw/zinc/31/41/88/334314188.db2.gz	AYZMJYJISRCKKB-SCRDCRAPSA-N	1	0	294.345	4.021	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@H](Cc3ccccc3)C2)C1	ZINC000248887200	334320970	/nfs/dbraw/zinc/32/09/70/334320970.db2.gz	MMKOHBBEDFXHOD-AKHDSKFASA-N	1	0	282.431	4.070	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@H]2CC[C@H](Cc3ccccc3)C2)C1	ZINC000248887204	334321004	/nfs/dbraw/zinc/32/10/04/334321004.db2.gz	MMKOHBBEDFXHOD-YRXWBPOGSA-N	1	0	282.431	4.070	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+][C@H](c2ccc(F)cc2)C2CCC2)C1	ZINC000249050844	334325785	/nfs/dbraw/zinc/32/57/85/334325785.db2.gz	XKHNKPYDKUWYRA-XWIAVFTESA-N	1	0	286.394	4.339	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@@H]2CCSc3ccc(F)cc32)C1	ZINC000249053720	334326008	/nfs/dbraw/zinc/32/60/08/334326008.db2.gz	YBXFQYCPZGEAJS-OSAQELSMSA-N	1	0	290.407	4.035	20	30		CIEDRO
C[C@@H]1CCC[C@@H]1[NH2+]C1CCC(Oc2ccccc2C#N)CC1	ZINC000088720168	334340858	/nfs/dbraw/zinc/34/08/58/334340858.db2.gz	SAODOFANKSPPST-LTDKPHRXSA-N	1	0	298.430	4.026	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@H](C)c1cnn(C(C)C)c1	ZINC000552756809	334344105	/nfs/dbraw/zinc/34/41/05/334344105.db2.gz	QENMENAJJGCEOT-LSDHHAIUSA-N	1	0	263.429	4.250	20	30		CIEDRO
N#Cc1ccc2c(c1)CCC[C@H]2[NH2+]C/C=C/c1ccccc1	ZINC000552956874	334352830	/nfs/dbraw/zinc/35/28/30/334352830.db2.gz	VTSXJILSPUBHOG-MUPIXQSSSA-N	1	0	288.394	4.239	20	30		CIEDRO
C[C@@H](Cc1ccc(Cl)cc1)[NH2+]CC(C)(C)CCC#N	ZINC000552963645	334353394	/nfs/dbraw/zinc/35/33/94/334353394.db2.gz	PPDFHOIZIDLLNL-ZDUSSCGKSA-N	1	0	278.827	4.191	20	30		CIEDRO
C[C@H](Cc1ccc(Cl)cc1)[NH2+]CC(C)(C)CCC#N	ZINC000552963644	334353406	/nfs/dbraw/zinc/35/34/06/334353406.db2.gz	PPDFHOIZIDLLNL-CYBMUJFWSA-N	1	0	278.827	4.191	20	30		CIEDRO
C[C@@H]([NH2+]Cc1cccc(Cl)c1)c1ccc(C#N)c(F)c1	ZINC000553767016	334398262	/nfs/dbraw/zinc/39/82/62/334398262.db2.gz	ZUWROKVNRTTYOH-LLVKDONJSA-N	1	0	288.753	4.202	20	30		CIEDRO
C=C(C)[C@H]([NH2+][C@H]1CC[C@H]1C1CC1)c1ccc(F)c(F)c1	ZINC000554095806	334412151	/nfs/dbraw/zinc/41/21/51/334412151.db2.gz	HDNPTUKDBNLLKN-JQFCIGGWSA-N	1	0	277.358	4.360	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+]C1CCN(c2ccccc2)CC1	ZINC000554104641	334412631	/nfs/dbraw/zinc/41/26/31/334412631.db2.gz	LKJMQQVDXMHLOY-KRWDZBQOSA-N	1	0	286.463	4.380	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@@H](C)c1ccc(OC)c(OC)c1C	ZINC000554114999	334413225	/nfs/dbraw/zinc/41/32/25/334413225.db2.gz	KJDSRDKROVTEEM-GJZGRUSLSA-N	1	0	291.435	4.408	20	30		CIEDRO
C[C@@H]([NH2+]CC(C)(C)CCC#N)[C@@H]1C[C@H]1c1ccccc1	ZINC000554365584	334424706	/nfs/dbraw/zinc/42/47/06/334424706.db2.gz	OMGHVUHGPZWDCI-PVAVHDDUSA-N	1	0	270.420	4.098	20	30		CIEDRO
COc1ccc([C@H](C)[C@@H](C)[NH2+]CC(C)(C)CCC#N)cc1	ZINC000554363530	334424736	/nfs/dbraw/zinc/42/47/36/334424736.db2.gz	NLSWKUPUXGECSW-HUUCEWRRSA-N	1	0	288.435	4.107	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@H](Cc2ccccc2)c2cccs2)C1	ZINC000555422870	334478391	/nfs/dbraw/zinc/47/83/91/334478391.db2.gz	LEPQANAGIRGRHP-IXDOHACOSA-N	1	0	296.439	4.314	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+][C@H](C)c1ccc(-n2cccn2)c(F)c1	ZINC000555597315	334483742	/nfs/dbraw/zinc/48/37/42/334483742.db2.gz	DSSYYJJWHDQDAB-ZIAGYGMSSA-N	1	0	287.382	4.017	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@@H](C)c1cnn(C(C)(C)C)c1C	ZINC000556215716	334500436	/nfs/dbraw/zinc/50/04/36/334500436.db2.gz	FNEVZUWJFPCWRH-ZDUSSCGKSA-N	1	0	277.456	4.199	20	30		CIEDRO
C[C@H]1CCC[C@@H]([NH2+]Cc2ccc(C#N)cc2C(F)(F)F)C1	ZINC000564416047	334507654	/nfs/dbraw/zinc/50/76/54/334507654.db2.gz	WIJQFLIKXSTSOA-SMDDNHRTSA-N	1	0	296.336	4.245	20	30		CIEDRO
N#Cc1ccc2c(c1)[C@H]([NH2+]CCc1ccc(Cl)cc1)CC2	ZINC000564498362	334509968	/nfs/dbraw/zinc/50/99/68/334509968.db2.gz	RPMXNXZRSANSCB-GOSISDBHSA-N	1	0	296.801	4.031	20	30		CIEDRO
CCc1ccc(C(C)(C)[NH2+]Cc2ccccc2C#N)cc1	ZINC000163134793	334565022	/nfs/dbraw/zinc/56/50/22/334565022.db2.gz	LDZUKJQAJBSIFP-UHFFFAOYSA-N	1	0	278.399	4.146	20	30		CIEDRO
C=CCCCCC[NH2+][C@@H](Cc1ccccn1)c1cccnc1	ZINC000566983331	334672060	/nfs/dbraw/zinc/67/20/60/334672060.db2.gz	CULWQLIQBGBKAI-IBGZPJMESA-N	1	0	295.430	4.096	20	30		CIEDRO
COc1ccc(C)cc1[C@H](C)[NH2+][C@@H](C)c1cccc(C#N)c1	ZINC000268982636	334719334	/nfs/dbraw/zinc/71/93/34/334719334.db2.gz	PHNXIAJFCGEEPL-GJZGRUSLSA-N	1	0	294.398	4.287	20	30		CIEDRO
C[C@H](C[NH2+][C@@H]1CCc2ccc(C#N)cc21)Cc1cccs1	ZINC000569056001	334853117	/nfs/dbraw/zinc/85/31/17/334853117.db2.gz	YOXFONHYLUJKOS-SCLBCKFNSA-N	1	0	296.439	4.075	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]C[C@H]1CCCC[C@H]1C(F)(F)F	ZINC000573132220	334911281	/nfs/dbraw/zinc/91/12/81/334911281.db2.gz	NJPAOAIWOOPERN-CHWSQXEVSA-N	1	0	290.373	4.275	20	30		CIEDRO
C[C@@H](c1ccc2c(c1)CCC2)[NH+]1CCC(CCC#N)CC1	ZINC000573202926	334916958	/nfs/dbraw/zinc/91/69/58/334916958.db2.gz	OUTZVTNRCDBQFJ-HNNXBMFYSA-N	1	0	282.431	4.252	20	30		CIEDRO
CCc1ccc([C@@H]2CCC[N@H+](Cc3ccc(C#N)o3)C2)cc1	ZINC000576502979	335212192	/nfs/dbraw/zinc/21/21/92/335212192.db2.gz	BIZRZUBRJUYSOZ-QGZVFWFLSA-N	1	0	294.398	4.093	20	30		CIEDRO
C[C@H](Cc1ccsc1)[N@H+](C)[C@H](C)c1cccc(C#N)c1	ZINC000576631261	335228050	/nfs/dbraw/zinc/22/80/50/335228050.db2.gz	VQLCYVMQFNSHDJ-ZIAGYGMSSA-N	1	0	284.428	4.244	20	30		CIEDRO
C[N@H+](Cc1ccc(C#N)c(F)c1)[C@H]1CCCc2ccccc21	ZINC000577255655	335330453	/nfs/dbraw/zinc/33/04/53/335330453.db2.gz	CWCZQVQZDUTGFV-IBGZPJMESA-N	1	0	294.373	4.207	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C#N)s1)C(C)(C)c1ccccc1	ZINC000176962045	335345634	/nfs/dbraw/zinc/34/56/34/335345634.db2.gz	DTWCAXAPNXSMIN-ZDUSSCGKSA-N	1	0	284.428	4.076	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C#N)s1)C(C)(C)c1ccccc1	ZINC000176962060	335345650	/nfs/dbraw/zinc/34/56/50/335345650.db2.gz	DTWCAXAPNXSMIN-CYBMUJFWSA-N	1	0	284.428	4.076	20	30		CIEDRO
Cc1ccccc1CC(C)(C)[NH2+]Cc1ccc(C#N)s1	ZINC000176964588	335348108	/nfs/dbraw/zinc/34/81/08/335348108.db2.gz	BECUBFKYFNETSK-UHFFFAOYSA-N	1	0	284.428	4.039	20	30		CIEDRO
Cc1ccc([C@@H](C)[NH2+]Cc2ccc(CC#N)cc2)cc1C	ZINC000577438340	335352275	/nfs/dbraw/zinc/35/22/75/335352275.db2.gz	JPFHYRRETJHKKL-MRXNPFEDSA-N	1	0	278.399	4.220	20	30		CIEDRO
CC[C@@H](c1ccccc1)[NH+]1CCC(CCC#N)CC1	ZINC000577509449	335362252	/nfs/dbraw/zinc/36/22/52/335362252.db2.gz	GOBZYHVIZSNLTD-KRWDZBQOSA-N	1	0	256.393	4.153	20	30		CIEDRO
C[C@@H]([NH2+]C1CCC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000577534009	335366018	/nfs/dbraw/zinc/36/60/18/335366018.db2.gz	PVANOPZTXKKUDG-CQSZACIVSA-N	1	0	276.383	4.428	20	30		CIEDRO
N#Cc1csc(C[NH2+][C@H]2CCc3cc(Cl)ccc32)c1	ZINC000177692069	335379103	/nfs/dbraw/zinc/37/91/03/335379103.db2.gz	GVSQTMIARKQLNX-HNNXBMFYSA-N	1	0	288.803	4.050	20	30		CIEDRO
Cc1cc(C)cc([C@@H](C)[NH2+]Cc2cc(C#N)cs2)c1	ZINC000177698098	335379687	/nfs/dbraw/zinc/37/96/87/335379687.db2.gz	DREVWYUYGHLJSR-CYBMUJFWSA-N	1	0	270.401	4.087	20	30		CIEDRO
CC[C@@H](c1ccc(F)cc1F)[NH+]1CCC(CCC#N)CC1	ZINC000578130221	335510855	/nfs/dbraw/zinc/51/08/55/335510855.db2.gz	XTMHFQMWFWGTQX-KRWDZBQOSA-N	1	0	292.373	4.432	20	30		CIEDRO
N#CCCCC[NH2+][C@@H](CC(F)(F)F)c1ccc(F)cc1	ZINC000180565183	335608229	/nfs/dbraw/zinc/60/82/29/335608229.db2.gz	ZUMVMEDWPFCJLM-ZDUSSCGKSA-N	1	0	288.288	4.103	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](CC(F)(F)F)c1ccccc1	ZINC000351751980	335620702	/nfs/dbraw/zinc/62/07/02/335620702.db2.gz	BGDDBHKQDFRBPU-CYBMUJFWSA-N	1	0	257.299	4.236	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+]Cc1cnc2ccccc2c1	ZINC000579507069	335777311	/nfs/dbraw/zinc/77/73/11/335777311.db2.gz	ZFPSHPXISCJDNI-HNNXBMFYSA-N	1	0	268.404	4.459	20	30		CIEDRO
C[C@@H](CC(C)(C)c1ccccc1)[NH2+]CCCCC#N	ZINC000181683388	335778295	/nfs/dbraw/zinc/77/82/95/335778295.db2.gz	SOSJXFNQIWQJAN-HNNXBMFYSA-N	1	0	258.409	4.026	20	30		CIEDRO
CSc1cc(C)ccc1C[NH2+][C@@H](C)c1cccc(C#N)c1	ZINC000181889457	335789808	/nfs/dbraw/zinc/78/98/08/335789808.db2.gz	VNRBTLJXWCAUIA-AWEZNQCLSA-N	1	0	296.439	4.439	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H](C)c1cccc(NC(C)=O)c1	ZINC000182543240	335826110	/nfs/dbraw/zinc/82/61/10/335826110.db2.gz	QZCGTYMEGJWGAC-UONOGXRCSA-N	1	0	274.408	4.040	20	30		CIEDRO
COc1ccc(C#N)cc1C[NH2+][C@@H](C)c1cc(C)cc(C)c1	ZINC000182889831	335849006	/nfs/dbraw/zinc/84/90/06/335849006.db2.gz	QYYIZHITMLFVTG-HNNXBMFYSA-N	1	0	294.398	4.035	20	30		CIEDRO
CC(C)(C)C[N@H+](Cc1ccccc1)Cc1ccc(C#N)cn1	ZINC000581258751	336033430	/nfs/dbraw/zinc/03/34/30/336033430.db2.gz	KSTRLLZSZCNGNQ-UHFFFAOYSA-N	1	0	293.414	4.002	20	30		CIEDRO
C=CCC[C@H](C)[NH2+]Cc1ccc2c(c1)nc(CC)n2C1CC1	ZINC000581322995	336049382	/nfs/dbraw/zinc/04/93/82/336049382.db2.gz	MDZPUOGFZJHLGY-AWEZNQCLSA-N	1	0	297.446	4.378	20	30		CIEDRO
CCc1ccc([C@@H](C)[NH2+]Cc2ccc(CC#N)cc2)s1	ZINC000581607404	336111563	/nfs/dbraw/zinc/11/15/63/336111563.db2.gz	AITXLUSOLZHHTA-CYBMUJFWSA-N	1	0	284.428	4.227	20	30		CIEDRO
CC[C@H](CC#N)[NH2+][C@@H]1C[C@H](C)C[C@@H](c2ccccc2)C1	ZINC000383530512	336112425	/nfs/dbraw/zinc/11/24/25/336112425.db2.gz	AUOWQBLGNMVVIF-VDHUWJSZSA-N	1	0	270.420	4.241	20	30		CIEDRO
Cc1ccsc1CN(C)Cc1ccc(C#N)cc1Cl	ZINC000383598342	336114824	/nfs/dbraw/zinc/11/48/24/336114824.db2.gz	ZPHZYOWMQGPIDR-UHFFFAOYSA-N	1	0	290.819	4.214	20	30		CIEDRO
CCC[N@H+](Cc1ccccc1)Cc1ccc(F)c(C#N)c1	ZINC000384347198	336123959	/nfs/dbraw/zinc/12/39/59/336123959.db2.gz	ARGWIDBUNAMISH-UHFFFAOYSA-N	1	0	282.362	4.110	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000581732301	336139573	/nfs/dbraw/zinc/13/95/73/336139573.db2.gz	NRJQUVUKGNMYOY-LSDHHAIUSA-N	1	0	256.393	4.344	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]C1CCC(C(F)(F)F)CC1	ZINC000386508704	336175788	/nfs/dbraw/zinc/17/57/88/336175788.db2.gz	MBJXZUUQURCSFR-UHFFFAOYSA-N	1	0	263.347	4.299	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1sc(C(C)(C)C)nc1C	ZINC000386795391	336179503	/nfs/dbraw/zinc/17/95/03/336179503.db2.gz	PCNJGTJUWVZEPR-NSHDSACASA-N	1	0	266.454	4.366	20	30		CIEDRO
CC[C@@H]1CCCC[C@@H]1[N@H+](C)Cc1ccc(C#N)s1	ZINC000581971204	336180950	/nfs/dbraw/zinc/18/09/50/336180950.db2.gz	MJLLKHLHBLARBF-DOMZBBRYSA-N	1	0	262.422	4.020	20	30		CIEDRO
C[C@@H]([NH2+][C@H](C)c1cccc(F)c1F)c1cccc(C#N)c1	ZINC000182099774	518178428	/nfs/dbraw/zinc/17/84/28/518178428.db2.gz	FQHGLTBFTLQIAM-VXGBXAGGSA-N	1	0	286.325	4.248	20	30		CIEDRO
CCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(C#N)cc2)cc1	ZINC000078973576	521225868	/nfs/dbraw/zinc/22/58/68/521225868.db2.gz	DDVFAWJCULXXJF-LSDHHAIUSA-N	1	0	294.398	4.369	20	30		CIEDRO
CC[N@H+](Cc1ccc(Cl)nc1)[C@H](C)c1ccc(C#N)cc1	ZINC000069220978	521310548	/nfs/dbraw/zinc/31/05/48/521310548.db2.gz	IAKKGFQZDVYMPL-CYBMUJFWSA-N	1	0	299.805	4.190	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccccc1C#N)c1cccc(Cl)c1	ZINC000125273072	522657079	/nfs/dbraw/zinc/65/70/79/522657079.db2.gz	UOCCFCGKHJWCHM-KRWDZBQOSA-N	1	0	284.790	4.453	20	30		CIEDRO
CC[C@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)c1ccccc1	ZINC000036991915	522695885	/nfs/dbraw/zinc/69/58/85/522695885.db2.gz	ONIHEVMWCFKMER-KSSFIOAISA-N	1	0	264.372	4.360	20	30		CIEDRO
CC[C@H]([NH2+][C@@H](C)c1ccc(OC)cc1)c1ccc(C#N)cc1	ZINC000278675472	522696132	/nfs/dbraw/zinc/69/61/32/522696132.db2.gz	JMAFTKQWSCEHRM-LIRRHRJNSA-N	1	0	294.398	4.369	20	30		CIEDRO
CC[C@H]([NH2+][C@@H](CCOC)C(C)(C)C)c1ccc(C#N)cc1	ZINC000338017767	522705479	/nfs/dbraw/zinc/70/54/79/522705479.db2.gz	PYMWWJNJUKQYRY-IRXDYDNUSA-N	1	0	288.435	4.050	20	30		CIEDRO
CC[C@H]([NH2+][C@@H]1CCCc2occc21)c1ccc(C#N)cc1	ZINC000278183439	522718171	/nfs/dbraw/zinc/71/81/71/522718171.db2.gz	DQQJZCQKLRFCEM-DLBZAZTESA-N	1	0	280.371	4.270	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H](C)c1ccccc1)c1ccc(C#N)cc1	ZINC000278206868	522914909	/nfs/dbraw/zinc/91/49/09/522914909.db2.gz	HHXTYRJJSDSKKP-KBXCAEBGSA-N	1	0	264.372	4.360	20	30		CIEDRO
CC[C@@H]([NH2+][C@H]1CCCc2occc21)c1ccc(C#N)cc1	ZINC000278183446	522948954	/nfs/dbraw/zinc/94/89/54/522948954.db2.gz	DQQJZCQKLRFCEM-SJORKVTESA-N	1	0	280.371	4.270	20	30		CIEDRO
Cc1ccccc1[C@@H](C)[NH2+][C@H](C)c1cccc(C#N)c1	ZINC000037228514	525361019	/nfs/dbraw/zinc/36/10/19/525361019.db2.gz	PWAIDDZCTMHIBN-HUUCEWRRSA-N	1	0	264.372	4.279	20	30		CIEDRO
Cc1cc([C@@H](C)[NH2+]C2(c3cccc(C#N)c3)CC2)c(C)o1	ZINC000278888349	525460762	/nfs/dbraw/zinc/46/07/62/525460762.db2.gz	YKXCBPIASRGARV-CYBMUJFWSA-N	1	0	280.371	4.108	20	30		CIEDRO
Cc1cc([C@H](C)[NH2+]Cc2cc(C#N)ccc2F)c(C)s1	ZINC000047944001	525520262	/nfs/dbraw/zinc/52/02/62/525520262.db2.gz	KNUIKVCCFCZGBP-NSHDSACASA-N	1	0	288.391	4.227	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCCc2sccc21)c1cccc(C#N)c1	ZINC000061360181	525564690	/nfs/dbraw/zinc/56/46/90/525564690.db2.gz	PXPMVNJVRGIKBH-BLLLJJGKSA-N	1	0	282.412	4.348	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCSc2ccccc21)c1ccc(C#N)cc1	ZINC000036991844	525579898	/nfs/dbraw/zinc/57/98/98/525579898.db2.gz	GROWFDUQKVVHLG-SUMWQHHRSA-N	1	0	294.423	4.446	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCc2ccccc21)c1ccc(C#N)c(F)c1	ZINC000271957245	525582305	/nfs/dbraw/zinc/58/23/05/525582305.db2.gz	SKEIFYBSUGBBBL-KPZWWZAWSA-N	1	0	280.346	4.035	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1)c1ccc(C#N)cc1	ZINC000224108096	525609602	/nfs/dbraw/zinc/60/96/02/525609602.db2.gz	CTZDYXMTGBEZHT-GLQYFDAESA-N	1	0	296.336	4.330	20	30		CIEDRO
Cc1ccsc1[C@@H](C)[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000070090730	525870489	/nfs/dbraw/zinc/87/04/89/525870489.db2.gz	LMMJQPDYMOOTFD-CHWSQXEVSA-N	1	0	270.401	4.340	20	30		CIEDRO
C[C@H](c1cccc(Cl)c1)[N@H+](C)CCCCC#N	ZINC000061559623	526076981	/nfs/dbraw/zinc/07/69/81/526076981.db2.gz	MTXBCNXOOIEOCQ-GFCCVEGCSA-N	1	0	250.773	4.027	20	30		CIEDRO
CSc1ccccc1[C@@H](C)[NH2+]Cc1cc(C#N)cs1	ZINC000337233657	526186589	/nfs/dbraw/zinc/18/65/89/526186589.db2.gz	AEOCKXORZAAWCL-LLVKDONJSA-N	1	0	288.441	4.192	20	30		CIEDRO
CSc1ccccc1[C@H](C)[NH2+]Cc1cc(C#N)cs1	ZINC000337233658	526193619	/nfs/dbraw/zinc/19/36/19/526193619.db2.gz	AEOCKXORZAAWCL-NSHDSACASA-N	1	0	288.441	4.192	20	30		CIEDRO
Cc1ccc2c(c1)[C@H]([NH2+][C@H](C)c1ccc(C#N)cc1)CC2	ZINC000097988418	526212221	/nfs/dbraw/zinc/21/22/21/526212221.db2.gz	PALZNZOUGJZRKP-AUUYWEPGSA-N	1	0	276.383	4.205	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@@H](CCC(C)C)c1ccoc1	ZINC000353589428	526782591	/nfs/dbraw/zinc/78/25/91/526782591.db2.gz	GISLZIFSAVROFQ-NJAFHUGGSA-N	1	0	291.435	4.328	20	30		CIEDRO
C=C(C[NH2+][C@@H]1CCCc2nc(C)sc21)c1ccccc1	ZINC000346779127	526883233	/nfs/dbraw/zinc/88/32/33/526883233.db2.gz	MSGOLQPBRLQBFY-OAHLLOKOSA-N	1	0	284.428	4.132	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@H](CC)c1ccc(OC)c(OC)c1	ZINC000353846752	527141812	/nfs/dbraw/zinc/14/18/12/527141812.db2.gz	RDWLZRZPMNMLBH-OFQRWUPVSA-N	1	0	291.435	4.345	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccnc(SC)c1)c1ccco1	ZINC000353386186	527448929	/nfs/dbraw/zinc/44/89/29/527448929.db2.gz	LOWQDKJQQNHEMT-CQSZACIVSA-N	1	0	288.416	4.194	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@@H](CC(=O)OC(C)C)c1ccccc1	ZINC000349286116	527465069	/nfs/dbraw/zinc/46/50/69/527465069.db2.gz	TYTYDLHTPHTNHI-RDJZCZTQSA-N	1	0	289.419	4.014	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCCc1cccc(C)n1)c1ccco1	ZINC000353885192	527484164	/nfs/dbraw/zinc/48/41/64/527484164.db2.gz	ZOCMLVWRNPRMFP-KRWDZBQOSA-N	1	0	284.403	4.213	20	30		CIEDRO
C=C[C@H](CO)[NH2+][C@@H](CC)c1ccc(Oc2ccccc2)cc1	ZINC000353568213	527595219	/nfs/dbraw/zinc/59/52/19/527595219.db2.gz	PGQLAGCXEOIXEI-APWZRJJASA-N	1	0	297.398	4.067	20	30		CIEDRO
CCC[C@H]([NH2+]Cc1ccc(C#N)c(OC)c1)c1ccccc1	ZINC000353622209	528226417	/nfs/dbraw/zinc/22/64/17/528226417.db2.gz	MCJKFOHEHOOVMJ-SFHVURJKSA-N	1	0	294.398	4.198	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@H]2C[C@H](c3ccc(F)cc3)C2)CC1	ZINC000336213246	528833515	/nfs/dbraw/zinc/83/35/15/528833515.db2.gz	KKFCFAOCRYBYIP-RSWLEGOBSA-N	1	0	286.394	4.134	20	30		CIEDRO
CCc1ccc(C[N@@H+](CC)[C@H](C)c2ccc(C#N)cc2)cn1	ZINC000347608806	529637333	/nfs/dbraw/zinc/63/73/33/529637333.db2.gz	JZRVPVVCEZYEJX-OAHLLOKOSA-N	1	0	293.414	4.099	20	30		CIEDRO
CCc1ccc(C[N@@H+](CC)[C@@H](C)c2ccc(C#N)cc2)cn1	ZINC000347608797	529637345	/nfs/dbraw/zinc/63/73/45/529637345.db2.gz	JZRVPVVCEZYEJX-HNNXBMFYSA-N	1	0	293.414	4.099	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CCc2ccc(C#N)cc21)c1ccccc1	ZINC000353397233	529672733	/nfs/dbraw/zinc/67/27/33/529672733.db2.gz	IOENHGQVCKSCMN-OALUTQOASA-N	1	0	276.383	4.286	20	30		CIEDRO
C=CCCC[NH2+]C[C@@H](C)c1cccc(Br)c1	ZINC000390352195	262183340	/nfs/dbraw/zinc/18/33/40/262183340.db2.gz	PQAUQLCDYDLHNC-GFCCVEGCSA-N	1	0	282.225	4.108	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H]1CCSc2ccc(Cl)cc21	ZINC000163334605	262396959	/nfs/dbraw/zinc/39/69/59/262396959.db2.gz	ZCKGIDWBHNOAIN-GWCFXTLKSA-N	1	0	267.825	4.431	20	30		CIEDRO
C[C@@H]1C[C@@H]([NH2+]CC(C)(C)CCC#N)c2ccccc21	ZINC000344051561	533642761	/nfs/dbraw/zinc/64/27/61/533642761.db2.gz	KYIMXDCHAJZWQI-CZUORRHYSA-N	1	0	256.393	4.154	20	30		CIEDRO
C[C@@H]1CCC[C@@H]([NH2+][C@H]2CCCc3cc(C#N)ccc32)C1	ZINC000341763244	130028243	/nfs/dbraw/zinc/02/82/43/130028243.db2.gz	WIGSBXXXXSXXBK-QBIMZIAESA-N	1	0	268.404	4.104	20	30		CIEDRO
C[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCCc3cc(C#N)ccc32)C1	ZINC000341763243	130028279	/nfs/dbraw/zinc/02/82/79/130028279.db2.gz	WIGSBXXXXSXXBK-MZMPZRCHSA-N	1	0	268.404	4.104	20	30		CIEDRO
C[C@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)c1cccs1	ZINC000020148256	171035718	/nfs/dbraw/zinc/03/57/18/171035718.db2.gz	LGCNLTREJSCQLD-RYUDHWBXSA-N	1	0	256.374	4.032	20	30		CIEDRO
C[C@H]([NH2+]Cc1cc2ccccc2o1)c1ccc(C#N)cc1	ZINC000035256401	172086884	/nfs/dbraw/zinc/08/68/84/172086884.db2.gz	YKRVQLJANWBPPB-ZDUSSCGKSA-N	1	0	276.339	4.155	20	30		CIEDRO
N#CCCC[C@H]([NH2+]Cc1ccccc1)c1ccccc1	ZINC000353912185	226382361	/nfs/dbraw/zinc/38/23/61/226382361.db2.gz	DVEGRZZIWGNDBO-SFHVURJKSA-N	1	0	264.372	4.211	20	30		CIEDRO
N#CCCC[C@@H]([NH2+]C/C=C/c1ccncc1)c1ccccc1	ZINC000353918659	226820711	/nfs/dbraw/zinc/82/07/11/226820711.db2.gz	ZZFMMPBDXJYJRO-OVKVCFKUSA-N	1	0	291.398	4.120	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+]C2(c3ccc(F)cc3F)CCC2)C1	ZINC000193105355	228000721	/nfs/dbraw/zinc/00/07/21/228000721.db2.gz	PIAFIFKBOKLIRI-OCCSQVGLSA-N	1	0	290.357	4.016	20	30		CIEDRO
N#CCCC[NH+]1CCC(c2ccccc2C(F)(F)F)CC1	ZINC000353566289	228122393	/nfs/dbraw/zinc/12/23/93/228122393.db2.gz	AWFDFTLLNRDIRE-UHFFFAOYSA-N	1	0	296.336	4.189	20	30		CIEDRO
N#Cc1ccc2c(c1)[C@H]([NH2+][C@@H]1CCCc3ccccc31)CC2	ZINC000353320556	228085315	/nfs/dbraw/zinc/08/53/15/228085315.db2.gz	BGZUFVCVZKBIHY-WOJBJXKFSA-N	1	0	288.394	4.213	20	30		CIEDRO
N#Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C3CC3)cc1)CC2	ZINC000353597990	228127900	/nfs/dbraw/zinc/12/79/00/228127900.db2.gz	RJZQZDQRFJLXAL-FQEVSTJZSA-N	1	0	288.394	4.213	20	30		CIEDRO
N#Cc1ccc2c(c1)[C@@H]([NH2+][C@H]1CCCc3sccc31)CC2	ZINC000353640352	228136604	/nfs/dbraw/zinc/13/66/04/228136604.db2.gz	ULLBALBECFLWGY-IRXDYDNUSA-N	1	0	294.423	4.274	20	30		CIEDRO
CC(C)CC[C@H](C)[NH2+][C@H](C)c1ccc(C#N)cc1F	ZINC000512621244	260023414	/nfs/dbraw/zinc/02/34/14/260023414.db2.gz	VSUHJZMIPYHMNW-QWHCGFSZSA-N	1	0	262.372	4.173	20	30		CIEDRO
CC(C)(C)[C@@H]([NH2+]Cc1ccc(C#N)cc1)c1ccccc1	ZINC000036994626	260061112	/nfs/dbraw/zinc/06/11/12/260061112.db2.gz	WMJSCKMKLCDGGT-SFHVURJKSA-N	1	0	278.399	4.435	20	30		CIEDRO
Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C#N)cc1F)[C@@H](C)C2	ZINC000180479679	260103892	/nfs/dbraw/zinc/10/38/92/260103892.db2.gz	XPOIDUXLDFMVOR-DJJJIMSYSA-N	1	0	294.373	4.029	20	30		CIEDRO
COc1cc([C@H](C)[NH2+][C@H](C)c2ccc(C#N)cc2)ccc1F	ZINC000317219300	260133280	/nfs/dbraw/zinc/13/32/80/260133280.db2.gz	HINWMLCSRUUOKA-OLZOCXBDSA-N	1	0	298.361	4.118	20	30		CIEDRO
CC(C)(C)[C@H]1CCC[N@H+](CCCC(C)(C)C#N)CC1	ZINC000087608786	260192314	/nfs/dbraw/zinc/19/23/14/260192314.db2.gz	BDKULMZPBCGMMN-HNNXBMFYSA-N	1	0	264.457	4.465	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@@H](C)CC1)c1ccc(C#N)cc1	ZINC000086883124	260210407	/nfs/dbraw/zinc/21/04/07/260210407.db2.gz	QMIQSCSGIZRPFF-JKIFEVAISA-N	1	0	256.393	4.178	20	30		CIEDRO
N#Cc1cccc(C[NH2+]Cc2cc(Cl)ccc2Cl)c1	ZINC000087758757	260225621	/nfs/dbraw/zinc/22/56/21/260225621.db2.gz	HPGXHXCLYOKXHN-UHFFFAOYSA-N	1	0	291.181	4.155	20	30		CIEDRO
CC(C)(CCc1ccccc1)[NH2+]Cc1ccc(F)c(C#N)c1	ZINC000317574055	260277916	/nfs/dbraw/zinc/27/79/16/260277916.db2.gz	DQWSYBSSOXLXJH-UHFFFAOYSA-N	1	0	296.389	4.198	20	30		CIEDRO
Cc1nc(C)c([C@H](C)[NH2+][C@@H](C)c2ccc(C#N)cc2)s1	ZINC000040517591	260289121	/nfs/dbraw/zinc/28/91/21/260289121.db2.gz	UEVUNMGRYKMNDD-QWRGUYRKSA-N	1	0	285.416	4.043	20	30		CIEDRO
N#Cc1ccc(C[NH2+]C2(Cc3ccccc3)CCCC2)s1	ZINC000517784161	260306856	/nfs/dbraw/zinc/30/68/56/260306856.db2.gz	MQFWMQDKTZKGAR-UHFFFAOYSA-N	1	0	296.439	4.265	20	30		CIEDRO
CC[NH+](CC)Cc1ccc(NC2CCC(C)(C#N)CC2)cc1	ZINC000449273367	260338840	/nfs/dbraw/zinc/33/88/40/260338840.db2.gz	UUEGWGCUOGKFHF-UHFFFAOYSA-N	1	0	299.462	4.413	20	30		CIEDRO
Cc1csc(C2([NH2+]CCCC(C)(C)C#N)CCCC2)n1	ZINC000083215780	260346824	/nfs/dbraw/zinc/34/68/24/260346824.db2.gz	PXOHICCBLRFKKW-UHFFFAOYSA-N	1	0	291.464	4.140	20	30		CIEDRO
C=CCOc1cccc(C[NH2+]Cc2c(C)cc(C)cc2C)c1	ZINC000518273920	260366302	/nfs/dbraw/zinc/36/63/02/260366302.db2.gz	OISJBEMYOKFHDY-UHFFFAOYSA-N	1	0	295.426	4.466	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)c1ccccc1OC(F)(F)F	ZINC000448026566	260583160	/nfs/dbraw/zinc/58/31/60/260583160.db2.gz	ITHDQHDBONHPKP-NSHDSACASA-N	1	0	273.298	4.202	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@@H]1CCC[C@H](c2ncccc2C)C1	ZINC000449485556	260644287	/nfs/dbraw/zinc/64/42/87/260644287.db2.gz	NTKSRACTKQPBEE-JKSUJKDBSA-N	1	0	272.436	4.218	20	30		CIEDRO
N#CCCCC[NH2+]Cc1ccc(SC(F)(F)F)cc1	ZINC000237761435	260704205	/nfs/dbraw/zinc/70/42/05/260704205.db2.gz	WETCULWGCSCAPR-UHFFFAOYSA-N	1	0	288.338	4.082	20	30		CIEDRO
C=CC[C@@H](C)[NH2+]Cc1ccc(-c2ccccc2OC)cc1	ZINC000525709755	261055452	/nfs/dbraw/zinc/05/54/52/261055452.db2.gz	QXQGDOPKBXMPPG-OAHLLOKOSA-N	1	0	281.399	4.416	20	30		CIEDRO
CC(C)(C#N)CCCC[NH2+][C@@H](Cc1ccccc1)C1CC1	ZINC000444687312	261066744	/nfs/dbraw/zinc/06/67/44/261066744.db2.gz	GFWHDZJBFDXDMB-SFHVURJKSA-N	1	0	284.447	4.317	20	30		CIEDRO
CC(C)(C#N)CCCC[NH2+][C@H](Cc1ccccc1)C1CC1	ZINC000444687310	261066869	/nfs/dbraw/zinc/06/68/69/261066869.db2.gz	GFWHDZJBFDXDMB-GOSISDBHSA-N	1	0	284.447	4.317	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)c1ccc(Br)s1	ZINC000161638569	261103637	/nfs/dbraw/zinc/10/36/37/261103637.db2.gz	DVPAETQVYDNJSV-DTWKUNHWSA-N	1	0	274.227	4.126	20	30		CIEDRO
C=CCC[C@H](O)C[N@@H+]1CCCC[C@@H]1c1cccc(Cl)c1	ZINC000444807434	261182631	/nfs/dbraw/zinc/18/26/31/261182631.db2.gz	WQXWOGTVTMJSHZ-DLBZAZTESA-N	1	0	293.838	4.194	20	30		CIEDRO
C[N@H+](Cc1ccc(Cl)cc1)CC(C)(C)CCC#N	ZINC000160815199	261227196	/nfs/dbraw/zinc/22/71/96/261227196.db2.gz	MFXCTKJXJJIFRR-UHFFFAOYSA-N	1	0	264.800	4.102	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]CCCc1c[nH]c2ccccc12	ZINC000174369985	261569229	/nfs/dbraw/zinc/56/92/29/261569229.db2.gz	GCLQIABYSAZEHX-UHFFFAOYSA-N	1	0	283.419	4.020	20	30		CIEDRO
CCCOc1ccc(C[NH2+][C@H](C)c2cccc(C#N)c2)cc1	ZINC000174430078	261571798	/nfs/dbraw/zinc/57/17/98/261571798.db2.gz	NIOGXBKGNMVQHD-OAHLLOKOSA-N	1	0	294.398	4.198	20	30		CIEDRO
CC(C)[C@@H](C[NH2+][C@@H](C)c1ccc(C#N)cc1)c1cccnc1	ZINC000176814673	261670749	/nfs/dbraw/zinc/67/07/49/261670749.db2.gz	MNAZEJDIPDNXML-HNAYVOBHSA-N	1	0	293.414	4.044	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@@H]2CCCC[C@@H]2c2ccccc2)c1	ZINC000314533738	261746024	/nfs/dbraw/zinc/74/60/24/261746024.db2.gz	BUPLMGPWDMXMAY-WOJBJXKFSA-N	1	0	290.410	4.374	20	30		CIEDRO
C[C@@H]([NH2+]CCCCC#N)c1ccc(N2CCCCCC2)cc1	ZINC000178645859	261753881	/nfs/dbraw/zinc/75/38/81/261753881.db2.gz	RABJUJOEWPVZBR-QGZVFWFLSA-N	1	0	299.462	4.411	20	30		CIEDRO
C[C@H]([NH2+]CCCCC#N)c1ccc(N2CCCCCC2)cc1	ZINC000178645846	261753893	/nfs/dbraw/zinc/75/38/93/261753893.db2.gz	RABJUJOEWPVZBR-KRWDZBQOSA-N	1	0	299.462	4.411	20	30		CIEDRO
COc1ccc([C@H](C)[NH2+]CCCCC#N)c2ccccc12	ZINC000178642983	261754140	/nfs/dbraw/zinc/75/41/40/261754140.db2.gz	AXOUAQSGOQGGON-AWEZNQCLSA-N	1	0	282.387	4.193	20	30		CIEDRO
N#CCC[C@H]([NH2+][C@@H]1CCc2cc(F)ccc21)c1ccccc1	ZINC000181577426	261903916	/nfs/dbraw/zinc/90/39/16/261903916.db2.gz	CCZZXFVDCKTEDO-RBUKOAKNSA-N	1	0	294.373	4.448	20	30		CIEDRO
C[C@@H]([NH2+]CCCC#N)[C@H](C)c1ccccc1C(F)(F)F	ZINC000184088446	262007987	/nfs/dbraw/zinc/00/79/87/262007987.db2.gz	CYXXZFLEBVMJGL-NWDGAFQWSA-N	1	0	284.325	4.091	20	30		CIEDRO
Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]CCCC#N	ZINC000184087380	262008030	/nfs/dbraw/zinc/00/80/30/262008030.db2.gz	QRQGJKUIUJAPLD-CYBMUJFWSA-N	1	0	299.443	4.381	20	30		CIEDRO
Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]CCCC#N	ZINC000184088504	262008104	/nfs/dbraw/zinc/00/81/04/262008104.db2.gz	YLUPZOXRGOCILO-GFCCVEGCSA-N	1	0	285.416	4.073	20	30		CIEDRO
C[C@@H](C[NH2+][C@H](C)c1ccc(C#N)cc1)c1ccccc1	ZINC000020137094	262193535	/nfs/dbraw/zinc/19/35/35/262193535.db2.gz	LHYRNDLXEGMJON-LSDHHAIUSA-N	1	0	264.372	4.013	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)c1cc2ccccc2o1	ZINC000193333339	262220832	/nfs/dbraw/zinc/22/08/32/262220832.db2.gz	FURKBIWPTRZGTA-NFAWXSAZSA-N	1	0	268.360	4.166	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H](C)c2cccs2)cc1	ZINC000020148580	262232648	/nfs/dbraw/zinc/23/26/48/262232648.db2.gz	WNBKLGQALVQGOT-CYBMUJFWSA-N	1	0	273.401	4.164	20	30		CIEDRO
C=CC1CC[NH+](Cc2ccccc2OCC(F)(F)F)CC1	ZINC000525785077	262234629	/nfs/dbraw/zinc/23/46/29/262234629.db2.gz	DUAOORVGQBGRFX-UHFFFAOYSA-N	1	0	299.336	4.026	20	30		CIEDRO
N#CCCCC[NH+]1CCC(c2c[nH]c3cc(F)ccc32)CC1	ZINC000111260904	262258833	/nfs/dbraw/zinc/25/88/33/262258833.db2.gz	GOAKZOAXWOUDNH-UHFFFAOYSA-N	1	0	299.393	4.180	20	30		CIEDRO
CC[C@H](CC#N)[NH2+][C@@H](C)CC(C)(C)c1ccccc1	ZINC000054183662	262259720	/nfs/dbraw/zinc/25/97/20/262259720.db2.gz	FJLPNDPEZDPFBJ-GOEBONIOSA-N	1	0	258.409	4.025	20	30		CIEDRO
C[C@H](CCC1CCCCC1)[NH2+][C@@H]1CCC[C@@H](C#N)C1	ZINC000463297557	262311198	/nfs/dbraw/zinc/31/11/98/262311198.db2.gz	NGKWHNSFXAIXIT-DJIMGWMZSA-N	1	0	262.441	4.407	20	30		CIEDRO
C=CCSCC[NH2+][C@@H](C)c1ccc(F)c(Cl)c1	ZINC000221938422	262332332	/nfs/dbraw/zinc/33/23/32/262332332.db2.gz	UFEPOKRVWIWGJZ-JTQLQIEISA-N	1	0	273.804	4.049	20	30		CIEDRO
C=CCSCC[NH2+][C@H](C)c1ccccc1C(F)(F)F	ZINC000221939556	262332671	/nfs/dbraw/zinc/33/26/71/262332671.db2.gz	CALJDADQRUTWKG-LLVKDONJSA-N	1	0	289.366	4.275	20	30		CIEDRO
C[C@H](CCc1ccccc1)[NH2+][C@H](C)c1ccc(C#N)cc1	ZINC000021013438	262373551	/nfs/dbraw/zinc/37/35/51/262373551.db2.gz	RSOOXBHDWNHRAE-HZPDHXFCSA-N	1	0	278.399	4.230	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H]2CCCc3sccc32)cc1	ZINC000061359934	262394979	/nfs/dbraw/zinc/39/49/79/262394979.db2.gz	ZNLCZMHIXZRLAI-KRWDZBQOSA-N	1	0	299.439	4.480	20	30		CIEDRO
N#CCCCC[NH2+]Cc1ccc(-c2ccc(F)cc2)s1	ZINC000237781501	262637729	/nfs/dbraw/zinc/63/77/29/262637729.db2.gz	VNEWZZVVZUODKE-UHFFFAOYSA-N	1	0	288.391	4.338	20	30		CIEDRO
CC[C@@H]([NH2+]CC(C)(C)CC#N)c1cc(Cl)ccc1OC	ZINC000414167568	262820283	/nfs/dbraw/zinc/82/02/83/262820283.db2.gz	PMEIPWGRTWAVHY-CQSZACIVSA-N	1	0	294.826	4.329	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@@H](CCC)c1ccsc1	ZINC000436315847	262853025	/nfs/dbraw/zinc/85/30/25/262853025.db2.gz	QNULOWQCKDOMJU-KBMXLJTQSA-N	1	0	279.449	4.160	20	30		CIEDRO
Cc1occc1C[NH2+][C@@H](CCCC#N)c1ccccc1	ZINC000414451844	262928041	/nfs/dbraw/zinc/92/80/41/262928041.db2.gz	KWKZUHFGMRZHDQ-KRWDZBQOSA-N	1	0	268.360	4.113	20	30		CIEDRO
N#CCCCC[NH2+][C@H](COc1ccccc1)c1ccccc1	ZINC000271659874	262997445	/nfs/dbraw/zinc/99/74/45/262997445.db2.gz	CZYTYKIGKDTIQP-LJQANCHMSA-N	1	0	294.398	4.090	20	30		CIEDRO
CC(C)Oc1ccc([C@H](C)[NH2+]CCC(C)(C)C#N)cc1	ZINC000271992998	263000793	/nfs/dbraw/zinc/00/07/93/263000793.db2.gz	FHKIHUQECJKRQS-AWEZNQCLSA-N	1	0	274.408	4.064	20	30		CIEDRO
C[C@H]([NH2+]CCC(C)(C)C#N)c1c(F)cccc1Cl	ZINC000271999099	263001138	/nfs/dbraw/zinc/00/11/38/263001138.db2.gz	GZTFMVVEZNQARM-JTQLQIEISA-N	1	0	268.763	4.070	20	30		CIEDRO
C[C@H](CCSc1ccccc1)[NH+]1CCC(C)(C#N)CC1	ZINC000272587342	263007295	/nfs/dbraw/zinc/00/72/95/263007295.db2.gz	PAEAASBMUAWGMJ-OAHLLOKOSA-N	1	0	288.460	4.183	20	30		CIEDRO
N#CCCC[NH2+][C@H]1CCCOc2c(Cl)c(Cl)ccc21	ZINC000273184749	263013684	/nfs/dbraw/zinc/01/36/84/263013684.db2.gz	FQUJFZVVYVOOSB-LBPRGKRZSA-N	1	0	299.201	4.100	20	30		CIEDRO
C[C@H]([NH2+]CCCC#N)c1ccc(N2CCCCCC2)cc1	ZINC000273301705	263014806	/nfs/dbraw/zinc/01/48/06/263014806.db2.gz	UVDZTZWDXSCILK-INIZCTEOSA-N	1	0	285.435	4.021	20	30		CIEDRO
COc1ccc2oc([C@H](C)[NH2+][C@@H]3CC[C@@H](C#N)C3)c(C)c2c1	ZINC000274603122	263027500	/nfs/dbraw/zinc/02/75/00/263027500.db2.gz	IHLFRACDXXCYNJ-BFHYXJOUSA-N	1	0	298.386	4.093	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@H](C#N)C1)c1cccc(Cl)c1Cl	ZINC000274648435	263028566	/nfs/dbraw/zinc/02/85/66/263028566.db2.gz	SJHBKRWXHRKIIT-DCAQKATOSA-N	1	0	283.202	4.336	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@@H](C#N)C1)c1cccc(C(F)(F)F)c1	ZINC000274657579	263028788	/nfs/dbraw/zinc/02/87/88/263028788.db2.gz	UVIMQOBFBDNYFL-MISXGVKJSA-N	1	0	282.309	4.048	20	30		CIEDRO
C[C@]1(c2ccccc2)CC[C@H]([NH+]2CCC(C)(C#N)CC2)C1	ZINC000276225104	263035304	/nfs/dbraw/zinc/03/53/04/263035304.db2.gz	MNTHXGVKOUCMDR-HKUYNNGSSA-N	1	0	282.431	4.122	20	30		CIEDRO
C[C@@H]([NH2+]CCC(C)(C)C#N)c1ccc(C(F)(F)F)cc1	ZINC000276341076	263036399	/nfs/dbraw/zinc/03/63/99/263036399.db2.gz	HARMSOYPHWNSFX-LLVKDONJSA-N	1	0	284.325	4.296	20	30		CIEDRO
CC[N@H+](CCCCC(C)(C)C#N)CCc1cccs1	ZINC000277798371	263043205	/nfs/dbraw/zinc/04/32/05/263043205.db2.gz	TWFAABTYJQIFMD-UHFFFAOYSA-N	1	0	278.465	4.333	20	30		CIEDRO
C[N@H+](Cc1csc2ccccc12)[C@@H]1CC[C@@H](C#N)C1	ZINC000278569841	263049145	/nfs/dbraw/zinc/04/91/45/263049145.db2.gz	JEFAOESQPYMKKN-TZMCWYRMSA-N	1	0	270.401	4.025	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]Cc1cc(F)c(Cl)cc1F	ZINC000278761489	263050810	/nfs/dbraw/zinc/05/08/10/263050810.db2.gz	XGQBCFZNNHVPSS-UHFFFAOYSA-N	1	0	286.753	4.038	20	30		CIEDRO
Cc1nc([C@@H]2CCC[N@@H+]2CCCCC(C)(C)C#N)cs1	ZINC000278906402	263051864	/nfs/dbraw/zinc/05/18/64/263051864.db2.gz	VORGVIFYWBLLBS-HNNXBMFYSA-N	1	0	291.464	4.309	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H]1CC[C@@H](c2ccc(F)cc2)C1	ZINC000279655556	263056517	/nfs/dbraw/zinc/05/65/17/263056517.db2.gz	LCOFCNFGVQDNKB-WBVHZDCISA-N	1	0	288.410	4.381	20	30		CIEDRO
C[C@H]([NH2+]CC1CCC(C#N)CC1)c1ccc(Cl)cc1	ZINC000281717879	263071465	/nfs/dbraw/zinc/07/14/65/263071465.db2.gz	PAMPWYTZLHFFAB-HSBZDZAISA-N	1	0	276.811	4.321	20	30		CIEDRO
N#CC1CCC(C[NH2+][C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000282260752	263075418	/nfs/dbraw/zinc/07/54/18/263075418.db2.gz	JZICIVNCZUNIOD-YVZJPGBNSA-N	1	0	282.431	4.242	20	30		CIEDRO
CSc1ccccc1[C@H](C)[NH2+][C@H]1CCC[C@@H](C#N)C1	ZINC000282355263	263076086	/nfs/dbraw/zinc/07/60/86/263076086.db2.gz	PMOPNWLPUBHAPX-MJBXVCDLSA-N	1	0	274.433	4.141	20	30		CIEDRO
N#CC1CCC(C[NH2+][C@@H](c2ccccc2)C2CC2)CC1	ZINC000282464160	263076704	/nfs/dbraw/zinc/07/67/04/263076704.db2.gz	VWBNLHBALBBAOV-JMLCCBQJSA-N	1	0	268.404	4.057	20	30		CIEDRO
CC1(C#N)CC[NH+](C(c2ccccc2)c2ccccc2)CC1	ZINC000283304561	263082128	/nfs/dbraw/zinc/08/21/28/263082128.db2.gz	YRJYHOCGKXYQPW-UHFFFAOYSA-N	1	0	290.410	4.402	20	30		CIEDRO
CC(C)Oc1ccc([C@@H](C)[NH2+]CCCC#N)cc1Cl	ZINC000284274587	263086210	/nfs/dbraw/zinc/08/62/10/263086210.db2.gz	JNXITBZNVMHRLN-GFCCVEGCSA-N	1	0	280.799	4.082	20	30		CIEDRO
C[C@@H]1CC[C@@H](c2ccccc2)[N@H+](CCCCC#N)C1	ZINC000285610006	263094591	/nfs/dbraw/zinc/09/45/91/263094591.db2.gz	QBEYYQPGMXUPON-WBVHZDCISA-N	1	0	256.393	4.153	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]CCc1cc2ccccc2s1	ZINC000293097223	263137917	/nfs/dbraw/zinc/13/79/17/263137917.db2.gz	XLTOGUJWICJVJJ-UHFFFAOYSA-N	1	0	286.444	4.363	20	30		CIEDRO
Cc1cc(F)ccc1C1CC[NH+]([C@@H]2CC[C@@H](C#N)C2)CC1	ZINC000293455630	263140700	/nfs/dbraw/zinc/14/07/00/263140700.db2.gz	CVZNHCMBGWVCMP-RHSMWYFYSA-N	1	0	286.394	4.006	20	30		CIEDRO
C[C@]1(c2ccccc2)CCC[N@@H+]([C@@H]2CC[C@H](C#N)C2)CC1	ZINC000293724255	263147885	/nfs/dbraw/zinc/14/78/85/263147885.db2.gz	YSBNXUZEJOSZLC-UHOSZYNNSA-N	1	0	282.431	4.122	20	30		CIEDRO
N#CCCC[C@@H]([NH2+][C@H]1CCC12CCC2)c1ccccc1	ZINC000340448758	263153621	/nfs/dbraw/zinc/15/36/21/263153621.db2.gz	KCMMRMOOZZBDDY-SJORKVTESA-N	1	0	268.404	4.344	20	30		CIEDRO
Cc1ccnc([C@@H](C)[NH2+][C@H](CCCC#N)c2ccccc2)c1	ZINC000340449695	263155543	/nfs/dbraw/zinc/15/55/43/263155543.db2.gz	VVHAEABZTFHGDX-SJLPKXTDSA-N	1	0	293.414	4.476	20	30		CIEDRO
N#C[C@H]1CC[C@H]([NH+]2CCC(c3cccc(Cl)c3)CC2)C1	ZINC000294203273	263157417	/nfs/dbraw/zinc/15/74/17/263157417.db2.gz	RNGHZDKPHCGUPO-GUYCJALGSA-N	1	0	288.822	4.212	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([N@@H+]2CC=C(c3cccc(Cl)c3)CC2)C1	ZINC000294255762	263158571	/nfs/dbraw/zinc/15/85/71/263158571.db2.gz	UUMMEJPRDSBLSC-CXAGYDPISA-N	1	0	286.806	4.121	20	30		CIEDRO
Cc1cccnc1[C@H]1CCC[C@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)C1	ZINC000294929532	263169393	/nfs/dbraw/zinc/16/93/93/263169393.db2.gz	BNPJSGRPRAXHLJ-XSLAGTTESA-N	1	0	297.446	4.088	20	30		CIEDRO
CCCCOc1ccc(C[NH2+][C@H]2CC[C@@H](CC#N)C2)cc1	ZINC000294949565	263169765	/nfs/dbraw/zinc/16/97/65/263169765.db2.gz	CXPQNFCWKCJMRQ-RDJZCZTQSA-N	1	0	286.419	4.037	20	30		CIEDRO
CC1(C)[C@@H]([NH2+][C@H]2CC[C@@H](CC#N)C2)C[C@H]1c1ccccc1	ZINC000296270052	263188865	/nfs/dbraw/zinc/18/88/65/263188865.db2.gz	DPYMHQNCKGZOBQ-DKIMLUQUSA-N	1	0	282.431	4.241	20	30		CIEDRO
Cc1cc(C)c2c(c1)[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)CCCO2	ZINC000296278938	263189208	/nfs/dbraw/zinc/18/92/08/263189208.db2.gz	DYEFWCZVHPBMFC-XYJFISCASA-N	1	0	298.430	4.189	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccc(F)cc1Cl	ZINC000296413702	263191165	/nfs/dbraw/zinc/19/11/65/263191165.db2.gz	LAMVKKANWZSDIL-GVXVVHGQSA-N	1	0	280.774	4.212	20	30		CIEDRO
CCC[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccccc1	ZINC000296599779	263194131	/nfs/dbraw/zinc/19/41/31/263194131.db2.gz	VNOSPHWZZDEFPV-XIRDDKMYSA-N	1	0	256.393	4.200	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1cccc(C)c1	ZINC000296655979	263194748	/nfs/dbraw/zinc/19/47/48/263194748.db2.gz	ZIEGLRRHBDLYTB-XIRDDKMYSA-N	1	0	256.393	4.118	20	30		CIEDRO
C[C@H](CCC#N)[NH2+][C@@H](C)c1cc2ccccc2s1	ZINC000298945795	263227831	/nfs/dbraw/zinc/22/78/31/263227831.db2.gz	OKAUDGTVVZOWAR-NEPJUHHUSA-N	1	0	258.390	4.244	20	30		CIEDRO
C=C(CC)C[NH2+][C@H]1CCCc2ncc(C(F)(F)F)cc21	ZINC000453338032	263241235	/nfs/dbraw/zinc/24/12/35/263241235.db2.gz	AXEIDTJJUQVJSL-ZDUSSCGKSA-N	1	0	284.325	4.034	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(Cl)cc1F)c1cccc(C#N)c1	ZINC000187577139	263261743	/nfs/dbraw/zinc/26/17/43/263261743.db2.gz	BBPNMKZKFPSOEV-NSHDSACASA-N	1	0	288.753	4.202	20	30		CIEDRO
C=C(C)CN1CCC([NH2+][C@@H](CCC)c2ccsc2)CC1	ZINC000187705787	263267180	/nfs/dbraw/zinc/26/71/80/263267180.db2.gz	IWAZPQKCCFXXJB-KRWDZBQOSA-N	1	0	292.492	4.219	20	30		CIEDRO
CC(C)[C@@H]1CC[C@H]1[NH2+][C@@H](CCC#N)c1ccccc1	ZINC000353632935	263282351	/nfs/dbraw/zinc/28/23/51/263282351.db2.gz	QTGCNLKXQWPMPG-YESZJQIVSA-N	1	0	256.393	4.056	20	30		CIEDRO
C=CCCC[C@H](C)[N@@H+]1CCC[C@@H](c2nccs2)C1	ZINC000340959804	263313761	/nfs/dbraw/zinc/31/37/61/263313761.db2.gz	XLMDUGPMIJDEDA-UONOGXRCSA-N	1	0	264.438	4.067	20	30		CIEDRO
CC(C)C[C@@H]([NH2+]CCCC#N)c1ccc(Cl)cc1	ZINC000341887015	263363376	/nfs/dbraw/zinc/36/33/76/263363376.db2.gz	YQISVUIUZXSIPY-OAHLLOKOSA-N	1	0	264.800	4.321	20	30		CIEDRO
N#CCCC[NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCC1	ZINC000342047397	263383286	/nfs/dbraw/zinc/38/32/86/263383286.db2.gz	LRGHXCWNLBWSCO-HNNXBMFYSA-N	1	0	296.336	4.440	20	30		CIEDRO
CCC[C@@H]([NH2+]CC(C)(C)CCC#N)[C@H]1CC1(C)C	ZINC000417349397	263798115	/nfs/dbraw/zinc/79/81/15/263798115.db2.gz	LATWJEYJGZFZKH-ZIAGYGMSSA-N	1	0	250.430	4.121	20	30		CIEDRO
C=CC[C@H]1[N@H+](Cc2cncn2C(C)C)CCCC1(C)C	ZINC000425335998	264012080	/nfs/dbraw/zinc/01/20/80/264012080.db2.gz	JQCOHQBQOQFMLH-MRXNPFEDSA-N	1	0	275.440	4.031	20	30		CIEDRO
C=CCC[C@H]([NH2+]CC)c1ccc(C(F)(F)F)cc1	ZINC000128511647	264290289	/nfs/dbraw/zinc/29/02/89/264290289.db2.gz	FWYHXHRIRPAFNI-ZDUSSCGKSA-N	1	0	257.299	4.322	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)c1cc(Br)ccc1F	ZINC000161656733	264291365	/nfs/dbraw/zinc/29/13/65/264291365.db2.gz	OSBSOQRQRNJHAH-UWVGGRQHSA-N	1	0	286.188	4.203	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+][C@H]2C[C@H](c3ccc(Cl)cc3)C2)C1	ZINC000475672879	264335744	/nfs/dbraw/zinc/33/57/44/264335744.db2.gz	PENWCTZVERFIMV-ODVANORSSA-N	1	0	288.822	4.258	20	30		CIEDRO
C#CCCCC[NH2+][C@H](C)c1sc(C(C)C)nc1C	ZINC000090398505	264399915	/nfs/dbraw/zinc/39/99/15/264399915.db2.gz	NBSSKVGQCDJQNY-GFCCVEGCSA-N	1	0	264.438	4.029	20	30		CIEDRO
C=C(C)[C@@H]1OCC[C@@H]1C[NH2+][C@@H](C)c1ccc(Cl)s1	ZINC000280508672	264447644	/nfs/dbraw/zinc/44/76/44/264447644.db2.gz	ABICWIRMKUXWDT-WDMOLILDSA-N	1	0	285.840	4.033	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@H](C)c1nccc2ccccc21	ZINC000290825626	264794363	/nfs/dbraw/zinc/79/43/63/264794363.db2.gz	XIAICSOQVPHGSJ-HIFRSBDPSA-N	1	0	254.377	4.240	20	30		CIEDRO
CC(C)(C[NH2+][C@H]1CC[C@H](C#N)C1)Cc1cccc(Cl)c1	ZINC000442777470	264928170	/nfs/dbraw/zinc/92/81/70/264928170.db2.gz	GABJNMJSIGRXJC-HOCLYGCPSA-N	1	0	290.838	4.191	20	30		CIEDRO
N#C[C@H]1CC[C@H]([NH2+]CC2(c3ccc(Cl)cc3)CCC2)C1	ZINC000442783341	264973452	/nfs/dbraw/zinc/97/34/52/264973452.db2.gz	PYHFRIVQJIKNJH-BBRMVZONSA-N	1	0	288.822	4.044	20	30		CIEDRO
CC(C)(C)[C@H]([NH2+]Cc1cc(C#N)cs1)c1ccccc1	ZINC000093492333	265183041	/nfs/dbraw/zinc/18/30/41/265183041.db2.gz	OYOXXXHXOXHRHZ-MRXNPFEDSA-N	1	0	284.428	4.497	20	30		CIEDRO
CC(C)c1ccc(C[NH2+]Cc2cc(C#N)cs2)cc1	ZINC000093492533	265183618	/nfs/dbraw/zinc/18/36/18/265183618.db2.gz	OJLBTLSKFQWGPV-UHFFFAOYSA-N	1	0	270.401	4.033	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCCCC1(C)C)c1cccc(C#N)c1	ZINC000094323287	265236951	/nfs/dbraw/zinc/23/69/51/265236951.db2.gz	VPPPZJUZRDVAOK-BBRMVZONSA-N	1	0	256.393	4.178	20	30		CIEDRO
Cc1ccc([C@H](C)[NH2+][C@H](C)c2cccc(C#N)c2)cc1F	ZINC000094952265	265277965	/nfs/dbraw/zinc/27/79/65/265277965.db2.gz	SVGNKFHJNWOUJQ-KGLIPLIRSA-N	1	0	282.362	4.418	20	30		CIEDRO
CCCc1ccc2[nH+]ccc(N3CCC(CC#N)CC3)c2c1	ZINC000519310528	265390304	/nfs/dbraw/zinc/39/03/04/265390304.db2.gz	RBPUPXNAUOGPJF-UHFFFAOYSA-N	1	0	293.414	4.317	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CC[C@@H](C)C[C@@H]1C)c1cccc(C#N)c1	ZINC000226162046	266001490	/nfs/dbraw/zinc/00/14/90/266001490.db2.gz	OSTNQTRMHFQZGQ-OEUWWYETSA-N	1	0	256.393	4.034	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H]1CCCOc2c(C)cc(C)cc21	ZINC000358059757	266409698	/nfs/dbraw/zinc/40/96/98/266409698.db2.gz	JCRNJKHIQOGHTO-HOCLYGCPSA-N	1	0	259.393	4.071	20	30		CIEDRO
Cc1c2ccccc2oc1[C@@H](C)[NH2+][C@H]1CCC[C@@H](C#N)C1	ZINC000193352322	266668000	/nfs/dbraw/zinc/66/80/00/266668000.db2.gz	AXCBWUMFDAFDIR-KFWWJZLASA-N	1	0	282.387	4.474	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@H]1CCOc2c(F)ccc(F)c21	ZINC000361191357	266799453	/nfs/dbraw/zinc/79/94/53/266799453.db2.gz	RPWDTYNCLNQQML-FZMZJTMJSA-N	1	0	281.346	4.123	20	30		CIEDRO
Cc1cc(C)cc([C@H]2CCC[C@@H]2[NH2+]CCCCC#N)c1	ZINC000367480796	267093320	/nfs/dbraw/zinc/09/33/20/267093320.db2.gz	NNWOPPQIDFHUMD-MSOLQXFVSA-N	1	0	270.420	4.223	20	30		CIEDRO
Cc1cccnc1[C@@H]1CCC[C@H]([NH2+]CC(C)(C)CCC#N)C1	ZINC000367904858	267125614	/nfs/dbraw/zinc/12/56/14/267125614.db2.gz	RJVHKQHZUKHHLN-SJORKVTESA-N	1	0	299.462	4.336	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@H]1CCC[C@@H]1c1ccccc1	ZINC000367898258	267125852	/nfs/dbraw/zinc/12/58/52/267125852.db2.gz	FDNBNIJCMRDFLQ-SJORKVTESA-N	1	0	270.420	4.242	20	30		CIEDRO
C=CC[C@@H](C)[NH2+]C1CCC(O)(c2cccc(Cl)c2)CC1	ZINC000368363649	267166598	/nfs/dbraw/zinc/16/65/98/267166598.db2.gz	VRVADQISLXCANJ-NVPAJSRCSA-N	1	0	293.838	4.024	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccccc1C#N)c1ccc(C2CC2)cc1	ZINC000418117845	267250437	/nfs/dbraw/zinc/25/04/37/267250437.db2.gz	UNAVDGOCARUVJT-AWEZNQCLSA-N	1	0	276.383	4.286	20	30		CIEDRO
Cc1ccc(NC2CC[NH+](CCCC(C)(C)C#N)CC2)cc1	ZINC000370003137	267283209	/nfs/dbraw/zinc/28/32/09/267283209.db2.gz	XNAMAEHOODEDSK-UHFFFAOYSA-N	1	0	299.462	4.201	20	30		CIEDRO
C=CCC[C@H]([NH2+]C1CCC2(CCOCC2)CC1)C1CC1	ZINC000370147697	267295112	/nfs/dbraw/zinc/29/51/12/267295112.db2.gz	FPYFCVUCHQCBIR-KRWDZBQOSA-N	1	0	277.452	4.060	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C1CCC2(CCOCC2)CC1)C1CC1	ZINC000370147698	267295137	/nfs/dbraw/zinc/29/51/37/267295137.db2.gz	FPYFCVUCHQCBIR-QGZVFWFLSA-N	1	0	277.452	4.060	20	30		CIEDRO
N#CC1(C[NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)CCC1	ZINC000418143055	267365528	/nfs/dbraw/zinc/36/55/28/267365528.db2.gz	OLGHCECZVOCJEG-QGZVFWFLSA-N	1	0	284.378	4.045	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+]Cc1ncoc1-c1ccccc1	ZINC000371279483	267381082	/nfs/dbraw/zinc/38/10/82/267381082.db2.gz	IUVPQUQKOAVORD-HNNXBMFYSA-N	1	0	270.376	4.176	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1cc(C#N)ccc1F)c1ccc(C)cc1	ZINC000120127060	267385236	/nfs/dbraw/zinc/38/52/36/267385236.db2.gz	RORLWPDGDWEYJI-GOSISDBHSA-N	1	0	282.362	4.247	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1cccc(OC(C)(C)C)n1)C1CC1	ZINC000540140417	327750015	/nfs/dbraw/zinc/75/00/15/327750015.db2.gz	OXTYNEFCKWYSIK-MRXNPFEDSA-N	1	0	288.435	4.093	20	30		CIEDRO
Cc1cc(C(F)(F)F)ccc1C[NH2+]CC(C)(C)CCC#N	ZINC000188913338	327762059	/nfs/dbraw/zinc/76/20/59/327762059.db2.gz	VIGLGUTWECGPHM-UHFFFAOYSA-N	1	0	298.352	4.433	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+]Cc1ccccc1N1CCCCC1	ZINC000180371342	327805187	/nfs/dbraw/zinc/80/51/87/327805187.db2.gz	DWJYSRLECLDYQY-UHFFFAOYSA-N	1	0	299.462	4.096	20	30		CIEDRO
CC(C)Oc1ccc([C@H](C)[NH2+][C@H]2CCC[C@H](C#N)C2)cc1	ZINC000185818125	327846411	/nfs/dbraw/zinc/84/64/11/327846411.db2.gz	AEAQAUZHJQHKCW-ZOBUZTSGSA-N	1	0	286.419	4.207	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+]Cc1ccc(C#N)cc1C(F)(F)F	ZINC000583472714	327912727	/nfs/dbraw/zinc/91/27/27/327912727.db2.gz	YEDCLJDYUNHLGK-LBPRGKRZSA-N	1	0	296.336	4.411	20	30		CIEDRO
N#Cc1cccc(C[NH2+]CC2(Cc3ccccc3)CCC2)c1	ZINC000531556655	328017475	/nfs/dbraw/zinc/01/74/75/328017475.db2.gz	AHLCGMCXSTXRLU-UHFFFAOYSA-N	1	0	290.410	4.061	20	30		CIEDRO
C[C@H]([N@H+](C)Cc1cccc(OCCCC#N)c1)C(C)(C)C	ZINC000534349885	328047652	/nfs/dbraw/zinc/04/76/52/328047652.db2.gz	OLWQZCWTWYYWKA-HNNXBMFYSA-N	1	0	288.435	4.236	20	30		CIEDRO
CC[N@H+](Cc1ccc(C)cc1)CC(C)(C)CCC#N	ZINC000534336808	328049282	/nfs/dbraw/zinc/04/92/82/328049282.db2.gz	CSFLATSAJUWRES-UHFFFAOYSA-N	1	0	258.409	4.147	20	30		CIEDRO
Cc1ccc([C@H](C)C[NH2+][C@@H]2CCc3ccc(C#N)cc32)cc1	ZINC000571092140	328085023	/nfs/dbraw/zinc/08/50/23/328085023.db2.gz	JOXNIJGXPZIOCN-FOIQADDNSA-N	1	0	290.410	4.247	20	30		CIEDRO
N#Cc1ccc2c(c1)[C@H]([NH2+][C@@H](c1cccs1)C1CC1)CC2	ZINC000571092122	328085046	/nfs/dbraw/zinc/08/50/46/328085046.db2.gz	ITNARYXSZQOKRM-SJLPKXTDSA-N	1	0	294.423	4.348	20	30		CIEDRO
Cc1ccccc1C[C@@H](C)[N@H+](C)Cc1cccc(C#N)c1F	ZINC000571251306	328094541	/nfs/dbraw/zinc/09/45/41/328094541.db2.gz	RAOYOSNGJNINAS-OAHLLOKOSA-N	1	0	296.389	4.069	20	30		CIEDRO
CC1(C)CCc2ccccc2[C@H]([NH2+][C@@H]2CC[C@@H](C#N)C2)C1	ZINC000571302173	328100810	/nfs/dbraw/zinc/10/08/10/328100810.db2.gz	GCAZCHZVXBIBLG-QGPMSJSTSA-N	1	0	282.431	4.372	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@H](CC)CC(F)(F)F)C1CC1	ZINC000414267300	328153872	/nfs/dbraw/zinc/15/38/72/328153872.db2.gz	RYOOAIGNVOZTEW-YPMHNXCESA-N	1	0	263.347	4.299	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H]1CCCC[C@H]1F)c1ccco1	ZINC000414309299	328154563	/nfs/dbraw/zinc/15/45/63/328154563.db2.gz	JGDCLECAZLCWKS-MCIONIFRSA-N	1	0	251.345	4.157	20	30		CIEDRO
C[C@H]1C[C@@H]([NH2+]Cc2ccc(CC#N)cc2)c2ccccc21	ZINC000571641842	328167309	/nfs/dbraw/zinc/16/73/09/328167309.db2.gz	RZSXDMCVXDLUEC-IFXJQAMLSA-N	1	0	276.383	4.091	20	30		CIEDRO
Cc1cc(C[NH2+]CC(C)(C)CC#N)ccc1C(F)(F)F	ZINC000414468114	328183812	/nfs/dbraw/zinc/18/38/12/328183812.db2.gz	XUDIPGMQIHYYAL-UHFFFAOYSA-N	1	0	284.325	4.043	20	30		CIEDRO
CCc1nc(C)c([C@@H](C)[NH2+][C@H](C)c2ccc(C#N)cc2)s1	ZINC000268815216	328186448	/nfs/dbraw/zinc/18/64/48/328186448.db2.gz	PPPRJCFZUSAXSX-VXGBXAGGSA-N	1	0	299.443	4.297	20	30		CIEDRO
N#CCC[C@H]([NH2+][C@H]1CCc2c1cccc2F)c1ccccc1	ZINC000271532180	328196830	/nfs/dbraw/zinc/19/68/30/328196830.db2.gz	RGVAEFAXBNIWLN-OALUTQOASA-N	1	0	294.373	4.448	20	30		CIEDRO
CC(C)[C@@H](CC(F)(F)F)[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000437097742	328197878	/nfs/dbraw/zinc/19/78/78/328197878.db2.gz	NLEASKQSAIYYLK-SMDDNHRTSA-N	1	0	284.325	4.186	20	30		CIEDRO
C[C@@H](CCC#N)[N@H+](C)Cc1csc2ccccc12	ZINC000276349327	328217767	/nfs/dbraw/zinc/21/77/67/328217767.db2.gz	WBRBFWLAWBDKPH-LBPRGKRZSA-N	1	0	258.390	4.025	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH+]2CCC(c3c[nH]c4ccccc43)CC2)C1	ZINC000278527816	328226255	/nfs/dbraw/zinc/22/62/55/328226255.db2.gz	DMEUTTBCMCGDNK-GOEBONIOSA-N	1	0	293.414	4.040	20	30		CIEDRO
CC(C)(C#N)CCCC[NH2+]C1(c2cccc(F)c2)CC1	ZINC000278961807	328232331	/nfs/dbraw/zinc/23/23/31/328232331.db2.gz	ZQGVNABAVUFAAB-UHFFFAOYSA-N	1	0	274.383	4.124	20	30		CIEDRO
Cc1ccoc1C[N@@H+](C)Cc1ccccc1C(C)(C)C#N	ZINC000292307756	328269368	/nfs/dbraw/zinc/26/93/68/328269368.db2.gz	NCRYRFSQVYJURH-UHFFFAOYSA-N	1	0	282.387	4.021	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@H]2CCC[C@@H]2c2ccc(F)cc2)C1	ZINC000294910303	328283779	/nfs/dbraw/zinc/28/37/79/328283779.db2.gz	ACEJDDLJLNAUES-RUGDWHBFSA-N	1	0	286.394	4.134	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)C1	ZINC000295064351	328284826	/nfs/dbraw/zinc/28/48/26/328284826.db2.gz	ORHBBJOOOSIWSR-KYNGSXCRSA-N	1	0	298.405	4.434	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1csc(Cl)c1	ZINC000296288629	328290030	/nfs/dbraw/zinc/29/00/30/328290030.db2.gz	FIMNZGOASSSGAZ-NHCYSSNCSA-N	1	0	268.813	4.134	20	30		CIEDRO
CC(C)CC[C@@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccoc1	ZINC000296390756	328290332	/nfs/dbraw/zinc/29/03/32/328290332.db2.gz	KAXUIUFOJYXBIB-BHYGNILZSA-N	1	0	274.408	4.429	20	30		CIEDRO
CC(C)CC[C@H]([NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccoc1	ZINC000296390762	328290379	/nfs/dbraw/zinc/29/03/79/328290379.db2.gz	KAXUIUFOJYXBIB-XIRDDKMYSA-N	1	0	274.408	4.429	20	30		CIEDRO
COc1ccc(Cl)cc1[C@H](C)[NH2+][C@H]1CC[C@@H](CC#N)C1	ZINC000296497992	328291047	/nfs/dbraw/zinc/29/10/47/328291047.db2.gz	OYBKRDQJRHFFSH-OBJOEFQTSA-N	1	0	292.810	4.082	20	30		CIEDRO
Cc1c2ccccc2oc1[C@H](C)[NH2+]Cc1ccc(C#N)cc1	ZINC000048367624	328305810	/nfs/dbraw/zinc/30/58/10/328305810.db2.gz	VECUUJNCLYXYPO-AWEZNQCLSA-N	1	0	290.366	4.464	20	30		CIEDRO
CCS[C@@H]1CCCC[N@@H+]([C@@H](C)c2ccc(C#N)cc2)C1	ZINC000303694617	328357725	/nfs/dbraw/zinc/35/77/25/328357725.db2.gz	MYFJXTYNBZWUKU-WMLDXEAASA-N	1	0	288.460	4.227	20	30		CIEDRO
CCC[N@H+](Cc1sccc1C)Cc1ccc(C#N)cc1	ZINC000535076182	328384683	/nfs/dbraw/zinc/38/46/83/328384683.db2.gz	UDMYWGPICQPSIG-UHFFFAOYSA-N	1	0	284.428	4.340	20	30		CIEDRO
C=CCOc1ccc(C[N@H+](Cc2ccccn2)C(C)C)cc1	ZINC000535082945	328385572	/nfs/dbraw/zinc/38/55/72/328385572.db2.gz	HJFBUOIJJLREAM-UHFFFAOYSA-N	1	0	296.414	4.057	20	30		CIEDRO
CC(C)(CCC#N)CNc1cc[nH+]c2cc(F)ccc12	ZINC000340897008	328401737	/nfs/dbraw/zinc/40/17/37/328401737.db2.gz	LHTUHTZMRXELBB-UHFFFAOYSA-N	1	0	271.339	4.116	20	30		CIEDRO
C[C@@H]([NH2+]CCCC#N)c1ccccc1OCc1ccccc1	ZINC000341597536	328412614	/nfs/dbraw/zinc/41/26/14/328412614.db2.gz	XWDSCLVZHKWEHQ-MRXNPFEDSA-N	1	0	294.398	4.220	20	30		CIEDRO
CCC(CC)[C@H]([NH2+]CCCC#N)c1cccs1	ZINC000341576854	328413606	/nfs/dbraw/zinc/41/36/06/328413606.db2.gz	UVGYKZDXQVQKJO-AWEZNQCLSA-N	1	0	250.411	4.119	20	30		CIEDRO
CC1(C)CCCC[C@H]1[NH2+][C@@H]1CCc2ccc(C#N)cc21	ZINC000564419284	328462414	/nfs/dbraw/zinc/46/24/14/328462414.db2.gz	NTTZXZDPEGFKBV-IAGOWNOFSA-N	1	0	268.404	4.104	20	30		CIEDRO
C=CC[C@@H](C)[C@@H](C)[NH2+]Cc1ccc2[nH]c(C)cc2c1	ZINC000563690484	328478440	/nfs/dbraw/zinc/47/84/40/328478440.db2.gz	AOEBIXRGVBGHTC-TZMCWYRMSA-N	1	0	256.393	4.167	20	30		CIEDRO
CC1(C[NH2+]Cc2cccc(OCCCC#N)c2)CCCC1	ZINC000066594377	328550868	/nfs/dbraw/zinc/55/08/68/328550868.db2.gz	JEZGYXNMPXRQQX-UHFFFAOYSA-N	1	0	286.419	4.039	20	30		CIEDRO
C[C@H]([NH2+][C@H]1c2ccccc2C[C@H]1C)c1ccc(C#N)cc1	ZINC000538407161	326830238	/nfs/dbraw/zinc/83/02/38/326830238.db2.gz	MPUZCQRPSRZOBY-BIENJYKASA-N	1	0	276.383	4.142	20	30		CIEDRO
C[C@H]([NH2+]C(C1CCC1)C1CCC1)c1ccc(C#N)cc1F	ZINC000556921265	326983521	/nfs/dbraw/zinc/98/35/21/326983521.db2.gz	VEKFFUCWGWBOOF-LBPRGKRZSA-N	1	0	286.394	4.317	20	30		CIEDRO
N#CCCC1CC[NH+](Cc2ccc3ccccc3c2)CC1	ZINC000568862240	327019818	/nfs/dbraw/zinc/01/98/18/327019818.db2.gz	IJBFHLDGEFUEBM-UHFFFAOYSA-N	1	0	278.399	4.356	20	30		CIEDRO
Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(CC#N)cc1)CCC2	ZINC000565832884	327031146	/nfs/dbraw/zinc/03/11/46/327031146.db2.gz	DODVCZKODISRQN-HXUWFJFHSA-N	1	0	290.410	4.228	20	30		CIEDRO
C=CC[N@@H+](Cc1ccc(OC)cc1)[C@H](C)c1ccccc1	ZINC000584190042	327059572	/nfs/dbraw/zinc/05/95/72/327059572.db2.gz	GZDJZASRSHKKCM-MRXNPFEDSA-N	1	0	281.399	4.444	20	30		CIEDRO
CC[C@H]1[C@H](C)CC[N@@H+]1Cc1ccc(C#N)cc1C(F)(F)F	ZINC000558575872	327106554	/nfs/dbraw/zinc/10/65/54/327106554.db2.gz	ZSDRHIXTIWCNCD-ABAIWWIYSA-N	1	0	296.336	4.197	20	30		CIEDRO
CC[C@H]1[C@@H](C)CC[N@@H+]1Cc1ccc(C#N)cc1C(F)(F)F	ZINC000558575874	327106594	/nfs/dbraw/zinc/10/65/94/327106594.db2.gz	ZSDRHIXTIWCNCD-NHYWBVRUSA-N	1	0	296.336	4.197	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@H]1CCOC2(CCCC2)C1	ZINC000449189656	327119490	/nfs/dbraw/zinc/11/94/90/327119490.db2.gz	MMDKHGCOBUUFAZ-HOTGVXAUSA-N	1	0	265.441	4.203	20	30		CIEDRO
N#CCSCCC[N@H+]1CCC[C@@H]1c1ccccc1Cl	ZINC000074981988	327122829	/nfs/dbraw/zinc/12/28/29/327122829.db2.gz	AZDBYXYALOBMRG-OAHLLOKOSA-N	1	0	294.851	4.124	20	30		CIEDRO
C=C(CC)C[NH2+][C@@H](C)c1ccccc1C(F)(F)F	ZINC000313481081	327132935	/nfs/dbraw/zinc/13/29/35/327132935.db2.gz	JUJHIPKAJCWGQO-NSHDSACASA-N	1	0	257.299	4.322	20	30		CIEDRO
C=C(CC)C[NH2+]Cc1csc(-c2ccc(F)cc2)n1	ZINC000313480223	327133224	/nfs/dbraw/zinc/13/32/24/327133224.db2.gz	IOCMGUNSZODGEC-UHFFFAOYSA-N	1	0	276.380	4.005	20	30		CIEDRO
CCOc1cccc2cc([C@H](C)[NH2+][C@H]3CC[C@@H](C#N)C3)oc21	ZINC000559150650	327143746	/nfs/dbraw/zinc/14/37/46/327143746.db2.gz	YRFSBNUJQSFFRX-GUTXKFCHSA-N	1	0	298.386	4.174	20	30		CIEDRO
CCOc1cccc2cc([C@H](C)[NH2+][C@@H]3CC[C@@H](C#N)C3)oc21	ZINC000559150651	327143882	/nfs/dbraw/zinc/14/38/82/327143882.db2.gz	YRFSBNUJQSFFRX-GZBFAFLISA-N	1	0	298.386	4.174	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@@H]1CCO[C@@H](CC(C)C)C1	ZINC000539682290	327146435	/nfs/dbraw/zinc/14/64/35/327146435.db2.gz	KLLBJAMAWWPYDH-BBWFWOEESA-N	1	0	267.457	4.305	20	30		CIEDRO
C[C@H](c1cccc(C#N)c1)[N@@H+]1CC[C@H](c2ccccc2F)C1	ZINC000559299581	327156202	/nfs/dbraw/zinc/15/62/02/327156202.db2.gz	FJVGZRNLBPUOGX-PBHICJAKSA-N	1	0	294.373	4.248	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@@H]2CCc3sc(Cl)cc32)c1	ZINC000129578491	327156572	/nfs/dbraw/zinc/15/65/72/327156572.db2.gz	LEOAZFUQDCENDT-CYBMUJFWSA-N	1	0	288.803	4.050	20	30		CIEDRO
C[N@H+](Cc1ccc(C(C)(C)C)cc1)[C@H]1CC[C@H](C#N)C1	ZINC000569509331	327187122	/nfs/dbraw/zinc/18/71/22/327187122.db2.gz	WGYUMDZGWMQLBA-RDJZCZTQSA-N	1	0	270.420	4.108	20	30		CIEDRO
N#C[C@H]1CC[C@H]([NH2+]CC2(c3ccccc3)CCCCC2)C1	ZINC000569541369	327195376	/nfs/dbraw/zinc/19/53/76/327195376.db2.gz	JZKPVXZRDRLMDH-WMZOPIPTSA-N	1	0	282.431	4.170	20	30		CIEDRO
C=CCCCCC[NH2+]C1CCC2(CCOCC2)CC1	ZINC000569590275	327201535	/nfs/dbraw/zinc/20/15/35/327201535.db2.gz	HLECOBADHOSOLA-UHFFFAOYSA-N	1	0	265.441	4.062	20	30		CIEDRO
C=CC[N@@H+](Cc1ccccc1F)C[C@@H]1CCC(F)(F)C1	ZINC000559778648	327261000	/nfs/dbraw/zinc/26/10/00/327261000.db2.gz	YNSSATBVJNLMPQ-CYBMUJFWSA-N	1	0	283.337	4.249	20	30		CIEDRO
C=CC[N@@H+](Cc1ccccc1F)C[C@H]1CCC(F)(F)C1	ZINC000559778649	327261084	/nfs/dbraw/zinc/26/10/84/327261084.db2.gz	YNSSATBVJNLMPQ-ZDUSSCGKSA-N	1	0	283.337	4.249	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)c1ccc(OC(F)(F)F)cc1	ZINC000387513399	327261120	/nfs/dbraw/zinc/26/11/20/327261120.db2.gz	YZNFTNIJXDHUKB-LLVKDONJSA-N	1	0	273.298	4.202	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H]1CCc2c1ccc(OC)c2F	ZINC000559879056	327267984	/nfs/dbraw/zinc/26/79/84/327267984.db2.gz	TWDGSOQFDWNUDE-AWEZNQCLSA-N	1	0	277.383	4.014	20	30		CIEDRO
CC[N@H+](CCCCCF)[C@@H](C)c1ccc(C#N)cc1	ZINC000560157393	327287334	/nfs/dbraw/zinc/28/73/34/327287334.db2.gz	RWZAPXDBXPSEMV-AWEZNQCLSA-N	1	0	262.372	4.081	20	30		CIEDRO
CC(C)(C#N)CCC[NH2+]C(C)(C)c1ccc(Cl)cc1	ZINC000560181450	327288715	/nfs/dbraw/zinc/28/87/15/327288715.db2.gz	AWHBPVPTAWBNHU-UHFFFAOYSA-N	1	0	278.827	4.495	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H](C)N1CCCC[C@H]1C)c1ccco1	ZINC000560514479	327317397	/nfs/dbraw/zinc/31/73/97/327317397.db2.gz	NNRITQMRNUXZNO-ZACQAIPSSA-N	1	0	290.451	4.139	20	30		CIEDRO
N#CCCCOc1cccc(C[NH2+]CC2CCCCC2)c1	ZINC000507185139	332794052	/nfs/dbraw/zinc/79/40/52/332794052.db2.gz	WCPNYLLTJLLDED-UHFFFAOYSA-N	1	0	286.419	4.039	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+]Cc1c(F)cccc1N1CCCC1	ZINC000560569669	327325635	/nfs/dbraw/zinc/32/56/35/327325635.db2.gz	IDPCAHNDFABYMI-LSDHHAIUSA-N	1	0	290.426	4.116	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+][C@@H](C)c1ccc2n[nH]cc2c1	ZINC000560580948	327327557	/nfs/dbraw/zinc/32/75/57/327327557.db2.gz	ALJFRCIBEQKKHH-XJKSGUPXSA-N	1	0	271.408	4.348	20	30		CIEDRO
Cc1ccc(C[C@H]2CCC[N@@H+]2Cc2cc(C#N)cs2)cc1	ZINC000583373002	327330070	/nfs/dbraw/zinc/33/00/70/327330070.db2.gz	SBSHLTBEMXZXBW-QGZVFWFLSA-N	1	0	296.439	4.135	20	30		CIEDRO
CC(C)[C@@H]([NH2+]CCC#N)c1ccc(C(C)(C)C)cc1	ZINC000560846425	327348218	/nfs/dbraw/zinc/34/82/18/327348218.db2.gz	CLAMNMNZFDAXCW-MRXNPFEDSA-N	1	0	258.409	4.184	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](C)c1cc(C)ccc1OC(F)F	ZINC000560897133	327350709	/nfs/dbraw/zinc/35/07/09/327350709.db2.gz	AGDUNEGSBUJQIQ-NEPJUHHUSA-N	1	0	269.335	4.212	20	30		CIEDRO
CC1=C[C@H](C)C[C@@H](C[NH2+]C2(c3cccc(C#N)c3)CC2)C1	ZINC000564409894	327351664	/nfs/dbraw/zinc/35/16/64/327351664.db2.gz	FBHGZTFOSVZUES-WMLDXEAASA-N	1	0	280.415	4.129	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@H](C)c1ccc([S@@](C)=O)cc1	ZINC000561017252	327358921	/nfs/dbraw/zinc/35/89/21/327358921.db2.gz	XMHDNZJGQWBQJU-BXTJHSDWSA-N	1	0	293.476	4.210	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+][C@@H](C)c1cn(-c2ccccc2)nn1	ZINC000561017124	327358973	/nfs/dbraw/zinc/35/89/73/327358973.db2.gz	LZFRFALXSAAHQJ-CVEARBPZSA-N	1	0	298.434	4.053	20	30		CIEDRO
C=CCCC[NH2+][C@@H](CC)c1ccc(OC(F)F)cc1	ZINC000561199121	327374615	/nfs/dbraw/zinc/37/46/15/327374615.db2.gz	HOHGPHNIPWQPGE-AWEZNQCLSA-N	1	0	269.335	4.295	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+]Cc1nc(-c2ccccc2F)cs1	ZINC000561412135	327393352	/nfs/dbraw/zinc/39/33/52/327393352.db2.gz	YSBMSHQTRFVJCF-GFCCVEGCSA-N	1	0	290.407	4.394	20	30		CIEDRO
C=CCOc1cccc(C[NH2+]Cc2cc3ccccc3[nH]2)c1	ZINC000561438558	327395028	/nfs/dbraw/zinc/39/50/28/327395028.db2.gz	VJHBFVDNXFCCRJ-UHFFFAOYSA-N	1	0	292.382	4.023	20	30		CIEDRO
Cc1ccc(C[C@@H](C)[NH2+][C@@H]2CCc3ccc(C#N)cc32)s1	ZINC000562089769	327448397	/nfs/dbraw/zinc/44/83/97/327448397.db2.gz	YORGJCFTKZWMDG-KZULUSFZSA-N	1	0	296.439	4.136	20	30		CIEDRO
CCOc1cc(C)ccc1C[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000151719379	327495905	/nfs/dbraw/zinc/49/59/05/327495905.db2.gz	DGEPPHQJXSAZRH-HNNXBMFYSA-N	1	0	294.398	4.116	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](C)c1sccc1Br	ZINC000161688316	327608575	/nfs/dbraw/zinc/60/85/75/327608575.db2.gz	ZYZLZCBBYHXLFH-RKDXNWHRSA-N	1	0	274.227	4.126	20	30		CIEDRO
CC(C)(C)[C@H]([NH2+]CCC(C)(C)C#N)c1ccc(F)cc1	ZINC000535664109	328607150	/nfs/dbraw/zinc/60/71/50/328607150.db2.gz	XFQBXIBBVIMFCV-OAHLLOKOSA-N	1	0	276.399	4.442	20	30		CIEDRO
C=C(C)CN1CCC([NH2+][C@@H]2CCCc3ccc(C)cc32)CC1	ZINC000535838780	328643330	/nfs/dbraw/zinc/64/33/30/328643330.db2.gz	FTEYEUFWPCGUPU-HXUWFJFHSA-N	1	0	298.474	4.003	20	30		CIEDRO
CC[NH+](CC)CCC[C@H](C)Nc1ccc(Cl)cc1C#N	ZINC000052856808	328654767	/nfs/dbraw/zinc/65/47/67/328654767.db2.gz	QOFBLQVHOSLWLI-ZDUSSCGKSA-N	1	0	293.842	4.134	20	30		CIEDRO
CC(C)[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(CC#N)cc1	ZINC000399138952	328667638	/nfs/dbraw/zinc/66/76/38/328667638.db2.gz	TWVCVMCBVDLCIL-ZWKOTPCHSA-N	1	0	270.420	4.057	20	30		CIEDRO
CC(C)[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(CC#N)cc1	ZINC000399138950	328667787	/nfs/dbraw/zinc/66/77/87/328667787.db2.gz	TWVCVMCBVDLCIL-ROUUACIJSA-N	1	0	270.420	4.057	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H]1CCc2sc(Br)cc21	ZINC000395370668	328736768	/nfs/dbraw/zinc/73/67/68/328736768.db2.gz	UNFQSQGALMXHAR-SNVBAGLBSA-N	1	0	286.238	4.054	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1cc2cccc(OC)c2o1	ZINC000395723857	328758388	/nfs/dbraw/zinc/75/83/88/328758388.db2.gz	WHISZZVVLUWVKN-LBPRGKRZSA-N	1	0	259.349	4.058	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H](c1ncccc1C)C(C)C	ZINC000563948621	328840608	/nfs/dbraw/zinc/84/06/08/328840608.db2.gz	YBIACGUJYWNEJS-CVEARBPZSA-N	1	0	260.425	4.422	20	30		CIEDRO
C=C(C)COCC[NH2+][C@@H](C)c1ccc(F)c2ccccc21	ZINC000563981786	328842860	/nfs/dbraw/zinc/84/28/60/328842860.db2.gz	WGVODUSYDMZPGZ-AWEZNQCLSA-N	1	0	287.378	4.222	20	30		CIEDRO
C[C@@H]([NH2+]CCC1Cc2ccccc2C1)c1cccc(C#N)c1	ZINC000584358315	328853899	/nfs/dbraw/zinc/85/38/99/328853899.db2.gz	YICUFILPNJDDQI-OAHLLOKOSA-N	1	0	290.410	4.014	20	30		CIEDRO
N#Cc1ccc2c(c1)CCCC[C@@H]2[NH2+]Cc1ccccc1F	ZINC000360822300	328911984	/nfs/dbraw/zinc/91/19/84/328911984.db2.gz	PVGNSKXLHAIQBA-IBGZPJMESA-N	1	0	294.373	4.255	20	30		CIEDRO
N#CC1CCC(C[NH2+]CCC2CCCCCC2)CC1	ZINC000582387328	328975922	/nfs/dbraw/zinc/97/59/22/328975922.db2.gz	SNOXWSSGQGMHKV-UHFFFAOYSA-N	1	0	262.441	4.266	20	30		CIEDRO
CC(C)C[C@H](C)[NH2+]Cc1ccc(C#N)cc1C(F)(F)F	ZINC000582392019	328977699	/nfs/dbraw/zinc/97/76/99/328977699.db2.gz	IDJDEMFWQGJTDR-NSHDSACASA-N	1	0	284.325	4.101	20	30		CIEDRO
CCCC1(C[NH2+][C@H](C)c2ccc(C#N)cc2)CCC1	ZINC000391778382	328980623	/nfs/dbraw/zinc/98/06/23/328980623.db2.gz	LSCCIGNVCAJEQU-CQSZACIVSA-N	1	0	256.393	4.179	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)c1cc(Br)cs1	ZINC000194102387	329065476	/nfs/dbraw/zinc/06/54/76/329065476.db2.gz	JNMWHDCNQVEFKR-IUCAKERBSA-N	1	0	274.227	4.126	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@@H]1CCCc2c3ccccc3[nH]c21	ZINC000393815403	329089693	/nfs/dbraw/zinc/08/96/93/329089693.db2.gz	WQVRHXQOGQKIDO-SUMWQHHRSA-N	1	0	268.404	4.490	20	30		CIEDRO
N#Cc1cccc(CC[NH2+][C@H](CC2CC2)c2ccccc2)c1	ZINC000582699950	329126207	/nfs/dbraw/zinc/12/62/07/329126207.db2.gz	HBVUEWUYXJJYNS-HXUWFJFHSA-N	1	0	290.410	4.232	20	30		CIEDRO
C[C@H]([NH2+]C[C@H]1CCc2ccccc21)c1ccc(C#N)c(F)c1	ZINC000538507886	329150045	/nfs/dbraw/zinc/15/00/45/329150045.db2.gz	JTJHSOPKKLCDLO-SUMWQHHRSA-N	1	0	294.373	4.078	20	30		CIEDRO
N#CCCC[N@@H+]1Cc2ccccc2C[C@H]1c1ccccc1	ZINC000174036717	329153668	/nfs/dbraw/zinc/15/36/68/329153668.db2.gz	COOSYSBNENSFFT-IBGZPJMESA-N	1	0	276.383	4.090	20	30		CIEDRO
COc1ccccc1[C@@H]1CCC[N@@H+]1CCCC(C)(C)C#N	ZINC000174844352	329163799	/nfs/dbraw/zinc/16/37/99/329163799.db2.gz	OVFHAFCVYNKRBN-INIZCTEOSA-N	1	0	286.419	4.162	20	30		CIEDRO
N#CCC[C@H](C#N)C[NH2+][C@@H](CC1CCCC1)c1ccccc1	ZINC000514668995	329172390	/nfs/dbraw/zinc/17/23/90/329172390.db2.gz	SNZGVHKALBOBBF-MJGOQNOKSA-N	1	0	295.430	4.341	20	30		CIEDRO
C=CCN1CCC([NH2+][C@@H](CC)c2ccc(Cl)cc2)CC1	ZINC000177913482	329190600	/nfs/dbraw/zinc/19/06/00/329190600.db2.gz	NKINDXADNVMHJU-KRWDZBQOSA-N	1	0	292.854	4.031	20	30		CIEDRO
Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C#N)cc1)CCC2	ZINC000178951996	329203371	/nfs/dbraw/zinc/20/33/71/329203371.db2.gz	HUVJBJFAMWJVHA-LJQANCHMSA-N	1	0	276.383	4.034	20	30		CIEDRO
Cc1ccc2c(c1)[C@@H]([NH2+]CC(C)(C)CCC#N)CCC2	ZINC000179361147	329204501	/nfs/dbraw/zinc/20/45/01/329204501.db2.gz	ZXEYKRUJDOBZGX-KRWDZBQOSA-N	1	0	270.420	4.292	20	30		CIEDRO
CC(C)[C@@H](CSc1ccccc1)[NH2+]CCCCC#N	ZINC000180429652	329216558	/nfs/dbraw/zinc/21/65/58/329216558.db2.gz	HRQWZEZUENFABV-MRXNPFEDSA-N	1	0	276.449	4.087	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](C)c1cc(C)c(Br)s1	ZINC000308922981	332851475	/nfs/dbraw/zinc/85/14/75/332851475.db2.gz	COFXVBBBQYHHHK-NXEZZACHSA-N	1	0	288.254	4.434	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)c1cc(C)c(Br)s1	ZINC000308922982	332851512	/nfs/dbraw/zinc/85/15/12/332851512.db2.gz	COFXVBBBQYHHHK-UWVGGRQHSA-N	1	0	288.254	4.434	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)c1cc(C)c(Br)s1	ZINC000308922983	332851566	/nfs/dbraw/zinc/85/15/66/332851566.db2.gz	COFXVBBBQYHHHK-VHSXEESVSA-N	1	0	288.254	4.434	20	30		CIEDRO
Cc1ccc([C@H](C)[NH2+]CC(C)(C)CCC#N)s1	ZINC000229693190	329356818	/nfs/dbraw/zinc/35/68/18/329356818.db2.gz	ZSFQMEFRDLVACG-LBPRGKRZSA-N	1	0	250.411	4.037	20	30		CIEDRO
CC[C@@H]([NH2+]CC(C)(C)CCC#N)c1cccs1	ZINC000229693376	329356917	/nfs/dbraw/zinc/35/69/17/329356917.db2.gz	ILDOIGIOABUPPA-GFCCVEGCSA-N	1	0	250.411	4.119	20	30		CIEDRO
Cc1cc([C@H](C)[NH2+]CC(C)(C)CCC#N)c(C)s1	ZINC000229687213	329356969	/nfs/dbraw/zinc/35/69/69/329356969.db2.gz	ARMHOHMATJQFBV-LBPRGKRZSA-N	1	0	264.438	4.346	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccc(C)nc1C)c1ccccc1	ZINC000187435497	329357636	/nfs/dbraw/zinc/35/76/36/329357636.db2.gz	NTFXYSDNAGXWPJ-IBGZPJMESA-N	1	0	280.415	4.496	20	30		CIEDRO
C=C(C)CC[NH2+][C@@H](C)c1ccc(-c2cccnc2)cc1	ZINC000508993100	332854494	/nfs/dbraw/zinc/85/44/94/332854494.db2.gz	XYMJYMPVMFVYDF-HNNXBMFYSA-N	1	0	266.388	4.365	20	30		CIEDRO
C[C@H](Cc1ccccc1C(F)(F)F)[NH2+]CC(C)(C)CC#N	ZINC000459728257	329373263	/nfs/dbraw/zinc/37/32/63/329373263.db2.gz	ILAVMMQURBTMOU-GFCCVEGCSA-N	1	0	298.352	4.166	20	30		CIEDRO
CC(C)(CC#N)C[NH2+]C1CC(c2cccc(Cl)c2)C1	ZINC000459739915	329377280	/nfs/dbraw/zinc/37/72/80/329377280.db2.gz	ZQPWXFKHSBQWRA-UHFFFAOYSA-N	1	0	276.811	4.115	20	30		CIEDRO
Cc1cccc2c1OCC[C@H]2[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000189366859	329380156	/nfs/dbraw/zinc/38/01/56/329380156.db2.gz	QDJPXVKTYPLFKZ-KBXCAEBGSA-N	1	0	292.382	4.041	20	30		CIEDRO
C[C@H](C#N)C[NH2+][C@@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1	ZINC000583242203	329393594	/nfs/dbraw/zinc/39/35/94/329393594.db2.gz	LJHOSAOWFQCFOJ-OSAQELSMSA-N	1	0	296.336	4.091	20	30		CIEDRO
C[C@H]([NH2+]CCC(C)(C)C1CC1)c1cccc(C#N)c1	ZINC000392891940	329397600	/nfs/dbraw/zinc/39/76/00/329397600.db2.gz	URUUNICDKCMKBD-ZDUSSCGKSA-N	1	0	256.393	4.035	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccc(C#N)c(F)c1)c1ccccc1	ZINC000192159924	329429799	/nfs/dbraw/zinc/42/97/99/329429799.db2.gz	SCRGASQTKVBADW-IBGZPJMESA-N	1	0	294.373	4.494	20	30		CIEDRO
Cc1ccc2c(c1)[C@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)CCC2	ZINC000193060705	329438434	/nfs/dbraw/zinc/43/84/34/329438434.db2.gz	SLQPIERHLMZDDU-YXJHDRRASA-N	1	0	268.404	4.044	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+]Cc1ccc(COC)cc1	ZINC000584402366	329456407	/nfs/dbraw/zinc/45/64/07/329456407.db2.gz	MFALURXJCADEED-OAHLLOKOSA-N	1	0	261.409	4.058	20	30		CIEDRO
C=CCCC[NH2+][C@H](C)c1sc(C(C)(C)C)nc1C	ZINC000302094285	332867297	/nfs/dbraw/zinc/86/72/97/332867297.db2.gz	GFEXYVCEQAKAQR-LLVKDONJSA-N	1	0	266.454	4.366	20	30		CIEDRO
CC(C)(C#N)CCC[NH2+][C@H](CC(F)F)c1ccccc1	ZINC000420999456	329797089	/nfs/dbraw/zinc/79/70/89/329797089.db2.gz	UXDXYSQTYGZZLX-CQSZACIVSA-N	1	0	280.362	4.302	20	30		CIEDRO
CCc1cccc(Cl)c1C[NH2+]Cc1ccc(C#N)s1	ZINC000421349596	329815011	/nfs/dbraw/zinc/81/50/11/329815011.db2.gz	IQAZPBFMKGFNOD-UHFFFAOYSA-N	1	0	290.819	4.125	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@H](CC(F)F)c1ccccc1	ZINC000421367990	329823945	/nfs/dbraw/zinc/82/39/45/329823945.db2.gz	FLBZMTZBCYEKTP-GXTWGEPZSA-N	1	0	253.336	4.327	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H](CC(F)F)c2ccccc2)s1	ZINC000421369064	329824089	/nfs/dbraw/zinc/82/40/89/329824089.db2.gz	GWMQTNKYFUHPJR-CQSZACIVSA-N	1	0	292.354	4.106	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+][C@H](CCC#N)c1ccccc1	ZINC000246356671	329839670	/nfs/dbraw/zinc/83/96/70/329839670.db2.gz	IDDTUCRPHOQNQN-ZMSDIMECSA-N	1	0	256.393	4.222	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+][C@H]1c2ccccc2CC12CCOCC2	ZINC000571929189	329930125	/nfs/dbraw/zinc/93/01/25/329930125.db2.gz	BZKMPUCCQGLYLT-FCEWJHQRSA-N	1	0	299.458	4.271	20	30		CIEDRO
C[C@H](CCc1ccccc1F)[NH2+]Cc1ccc(CC#N)cc1	ZINC000572284775	329970175	/nfs/dbraw/zinc/97/01/75/329970175.db2.gz	CBCDEYDNAUXEEU-OAHLLOKOSA-N	1	0	296.389	4.003	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@@H](C)c1ccc(OC)cc1)c1ccccc1	ZINC000271414599	330079608	/nfs/dbraw/zinc/07/96/08/330079608.db2.gz	BAZVWBGAXOTITH-HNAYVOBHSA-N	1	0	279.383	4.110	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@@H](C)c1ccc(OC)c(F)c1)c1ccccc1	ZINC000271414758	330079611	/nfs/dbraw/zinc/07/96/11/330079611.db2.gz	BDUIULINIWLMKU-KBXCAEBGSA-N	1	0	297.373	4.250	20	30		CIEDRO
C#CC[C@H]([NH2+][C@H](C)c1sc(CC)nc1C)c1ccccc1	ZINC000271426804	330079722	/nfs/dbraw/zinc/07/97/22/330079722.db2.gz	CQLMEPCJBYTQFY-CJNGLKHVSA-N	1	0	298.455	4.429	20	30		CIEDRO
C#CC[C@H]([NH2+][C@@H](C)c1ccc2c(c1)COC2)c1ccccc1	ZINC000271413088	330080006	/nfs/dbraw/zinc/08/00/06/330080006.db2.gz	AYJXBQTYSAEYJD-YWZLYKJASA-N	1	0	291.394	4.132	20	30		CIEDRO
C#CC[C@H]([NH2+][C@@H](C)c1ccc(OC)cc1)c1ccccc1	ZINC000271414602	330080040	/nfs/dbraw/zinc/08/00/40/330080040.db2.gz	BAZVWBGAXOTITH-KXBFYZLASA-N	1	0	279.383	4.110	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@H]1CCCc2nc(C)sc21)c1ccccc1	ZINC000271454740	330080052	/nfs/dbraw/zinc/08/00/52/330080052.db2.gz	GQDGXFCLJNSSIW-WBVHZDCISA-N	1	0	296.439	4.183	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@H](C)c1ccc([S@](C)=O)cc1	ZINC000271529656	330081219	/nfs/dbraw/zinc/08/12/19/330081219.db2.gz	PIYVUMDEMVEEEJ-IIMJZQEZSA-N	1	0	293.476	4.210	20	30		CIEDRO
C#CC[C@H]([NH2+][C@@H]1CCc2c1cccc2OC)c1ccccc1	ZINC000271591918	330081426	/nfs/dbraw/zinc/08/14/26/330081426.db2.gz	YMCYHLFODRCKTP-RBUKOAKNSA-N	1	0	291.394	4.037	20	30		CIEDRO
C=CCC[C@@H]([NH2+][C@@H]1CCOC2(CCC2)C1)c1ccccc1	ZINC000271548246	330081488	/nfs/dbraw/zinc/08/14/88/330081488.db2.gz	UOEOPCOPHLIHJQ-QZTJIDSGSA-N	1	0	285.431	4.385	20	30		CIEDRO
C#CC[C@H]([NH2+][C@@H](C)c1cc(C)ccc1O)c1ccccc1	ZINC000273472121	330093095	/nfs/dbraw/zinc/09/30/95/330093095.db2.gz	JUKQPRUUOBOYGV-YJBOKZPZSA-N	1	0	279.383	4.116	20	30		CIEDRO
Cc1ccccc1C[C@@H]([NH2+]Cc1ccc(C#N)s1)C1CC1	ZINC000421868245	330099502	/nfs/dbraw/zinc/09/95/02/330099502.db2.gz	CRDLEGWFSKQRPK-GOSISDBHSA-N	1	0	296.439	4.039	20	30		CIEDRO
C#CC[C@@H]([NH2+][C@@H](CC)c1ccccc1O)c1ccccc1	ZINC000274762726	330107729	/nfs/dbraw/zinc/10/77/29/330107729.db2.gz	KKOCTBXLKKWJGP-ZWKOTPCHSA-N	1	0	279.383	4.198	20	30		CIEDRO
N#Cc1csc(C[N@@H+]2CCC[C@H]2c2cccs2)c1	ZINC000162714206	330108835	/nfs/dbraw/zinc/10/88/35/330108835.db2.gz	XNAYIKHARYQTFD-ZDUSSCGKSA-N	1	0	274.414	4.018	20	30		CIEDRO
C=C(C[NH2+][C@@H](C)c1cnn(C(C)C)c1C)c1ccccc1	ZINC000276347632	330113053	/nfs/dbraw/zinc/11/30/53/330113053.db2.gz	KPUFXCYFCJYXGZ-HNNXBMFYSA-N	1	0	283.419	4.136	20	30		CIEDRO
C#CC[C@H]([NH2+][C@@H](CC)c1ccc(C#N)cc1)c1ccccc1	ZINC000278615892	330117994	/nfs/dbraw/zinc/11/79/94/330117994.db2.gz	GAKAJTQDMJLTLY-PMACEKPBSA-N	1	0	288.394	4.364	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@H](C)c1nc(C(F)(F)F)cs1	ZINC000279044732	330121436	/nfs/dbraw/zinc/12/14/36/330121436.db2.gz	XWTJXHMWEFZZAH-DTWKUNHWSA-N	1	0	278.343	4.167	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+][C@@H](C)c1nc(C(F)(F)F)cs1	ZINC000279044730	330121554	/nfs/dbraw/zinc/12/15/54/330121554.db2.gz	XWTJXHMWEFZZAH-BDAKNGLRSA-N	1	0	278.343	4.167	20	30		CIEDRO
Cc1nc(CC[NH2+][C@@H](CCCC#N)c2ccccc2)cs1	ZINC000433021137	330124493	/nfs/dbraw/zinc/12/44/93/330124493.db2.gz	FRRNSLBCKYYSMS-KRWDZBQOSA-N	1	0	299.443	4.019	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+][C@H]1CC(C)(C)Oc2ccc(N)cc21	ZINC000423438843	330201581	/nfs/dbraw/zinc/20/15/81/330201581.db2.gz	NNIQXXVUHNEFJE-ZENOOKHLSA-N	1	0	288.435	4.061	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@H]1CCO[C@@H](C(C)(C)C)C1	ZINC000536829964	330228637	/nfs/dbraw/zinc/22/86/37/330228637.db2.gz	AZGWWWUEZVRECQ-HRCADAONSA-N	1	0	267.457	4.305	20	30		CIEDRO
C=CCCOCC[NH2+][C@H](C)c1ccc(SC(C)C)cc1	ZINC000536839194	330232264	/nfs/dbraw/zinc/23/22/64/330232264.db2.gz	NJETZLZKYFSXPI-OAHLLOKOSA-N	1	0	293.476	4.430	20	30		CIEDRO
C=CCCOCC[NH2+][C@H](C)c1ccc(OC)c2ccccc21	ZINC000536839616	330234878	/nfs/dbraw/zinc/23/48/78/330234878.db2.gz	NYDWLNLDEXMZIG-OAHLLOKOSA-N	1	0	299.414	4.092	20	30		CIEDRO
COc1ccc2cc([C@@H](C)[NH2+][C@@H]3CC[C@H](C#N)C3)ccc2c1	ZINC000424119242	330246077	/nfs/dbraw/zinc/24/60/77/330246077.db2.gz	FNADGIJKDODFLX-QWQRMKEZSA-N	1	0	294.398	4.191	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](CC)CSc1ccccc1[N+](=O)[O-]	ZINC000536858301	330252592	/nfs/dbraw/zinc/25/25/92/330252592.db2.gz	OABOGCMZQWRKOG-QWHCGFSZSA-N	1	0	294.420	4.020	20	30		CIEDRO
Cc1ccc2c(c1)[C@@H]([NH2+]CC1CCC(C#N)CC1)[C@@H](C)C2	ZINC000580483907	330256620	/nfs/dbraw/zinc/25/66/20/330256620.db2.gz	WDMRIVNTEIFHPB-QAVIERHMSA-N	1	0	282.431	4.148	20	30		CIEDRO
C=CCN(Cc1ccc(Cl)s1)Cc1ccnc(C)c1	ZINC000527535872	330263668	/nfs/dbraw/zinc/26/36/68/330263668.db2.gz	WYRKYOOWOKTQLF-UHFFFAOYSA-N	1	0	292.835	4.293	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc(C(F)(F)F)cc1	ZINC000424135624	330270327	/nfs/dbraw/zinc/27/03/27/330270327.db2.gz	ZOSCHZOWZFFRCC-UHIISALHSA-N	1	0	282.309	4.048	20	30		CIEDRO
CC[C@H](CCc1ccccc1)[NH2+]Cc1ccc(C#N)s1	ZINC000527759883	330281308	/nfs/dbraw/zinc/28/13/08/330281308.db2.gz	CCVYGGGXZURULV-OAHLLOKOSA-N	1	0	284.428	4.121	20	30		CIEDRO
CC[C@H](CCc1ccccc1)[NH2+]Cc1cc(C#N)cs1	ZINC000527759941	330281328	/nfs/dbraw/zinc/28/13/28/330281328.db2.gz	DACQEYIRHZJMFA-MRXNPFEDSA-N	1	0	284.428	4.121	20	30		CIEDRO
Cc1cccc([C@H]([NH2+]Cc2ccc(C#N)c(F)c2)C(C)C)c1	ZINC000527808236	330284602	/nfs/dbraw/zinc/28/46/02/330284602.db2.gz	KQKJUNYEYKVBLA-LJQANCHMSA-N	1	0	296.389	4.493	20	30		CIEDRO
C=CCN1CCC([NH2+][C@@H](C)c2cccc(C(C)C)c2)CC1	ZINC000527859996	330289350	/nfs/dbraw/zinc/28/93/50/330289350.db2.gz	SPAVILIJNSYVDQ-INIZCTEOSA-N	1	0	286.463	4.111	20	30		CIEDRO
C=CC(C)(C)CC[NH2+][C@H]1CCCNc2ccccc21	ZINC000527928994	330296912	/nfs/dbraw/zinc/29/69/12/330296912.db2.gz	VNXFBXNMICMKTK-INIZCTEOSA-N	1	0	258.409	4.125	20	30		CIEDRO
CC[C@H](CCc1ccccc1)[NH2+][C@H]1CCC[C@H](C#N)C1	ZINC000527959479	330300430	/nfs/dbraw/zinc/30/04/30/330300430.db2.gz	YYQVMFIJJNDGQM-KSZLIROESA-N	1	0	270.420	4.070	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1cncn1C(C)C)c1ccccc1	ZINC000424159728	330306184	/nfs/dbraw/zinc/30/61/84/330306184.db2.gz	WCLZBERLHIZVPL-SFHVURJKSA-N	1	0	283.419	4.261	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1cncn1C(C)C)c1ccccc1	ZINC000424159724	330306228	/nfs/dbraw/zinc/30/62/28/330306228.db2.gz	WCLZBERLHIZVPL-GOSISDBHSA-N	1	0	283.419	4.261	20	30		CIEDRO
C[C@@H]([NH2+]CC#Cc1ccc(C(F)(F)F)cc1)C1CCCC1	ZINC000536875823	330309769	/nfs/dbraw/zinc/30/97/69/330309769.db2.gz	JXXIWQFIQPOYNG-CYBMUJFWSA-N	1	0	295.348	4.225	20	30		CIEDRO
C[C@H]([NH2+]CC#Cc1ccc(C(F)(F)F)cc1)C1CCCC1	ZINC000536875853	330309844	/nfs/dbraw/zinc/30/98/44/330309844.db2.gz	JXXIWQFIQPOYNG-ZDUSSCGKSA-N	1	0	295.348	4.225	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)Cc1ccc(Cl)cc1)c1ccc(C#N)cc1	ZINC000036937847	330315121	/nfs/dbraw/zinc/31/51/21/330315121.db2.gz	OYPYQDHHNBXHPC-UONOGXRCSA-N	1	0	298.817	4.493	20	30		CIEDRO
C[C@@H]([NH2+][C@H](C)c1ccc(F)c(F)c1)c1ccc(C#N)cc1	ZINC000036953163	330322727	/nfs/dbraw/zinc/32/27/27/330322727.db2.gz	IFAPCHCZPFMSRE-VXGBXAGGSA-N	1	0	286.325	4.248	20	30		CIEDRO
Cc1cccc(C(C)(C)C[NH2+]Cc2ccc(C#N)cc2F)c1	ZINC000532990350	330323321	/nfs/dbraw/zinc/32/33/21/330323321.db2.gz	PTQGGMNNDBVKLV-UHFFFAOYSA-N	1	0	296.389	4.073	20	30		CIEDRO
N#Cc1ccc(C[NH2+]Cc2ccc3ccccc3c2)c(F)c1	ZINC000105642911	330329277	/nfs/dbraw/zinc/32/92/77/330329277.db2.gz	RTUPXAUYRJLCNY-UHFFFAOYSA-N	1	0	290.341	4.140	20	30		CIEDRO
C[C@H](c1ccc(Cl)cc1)[N@H+](C)Cc1ccc(C#N)cc1	ZINC000044894209	330333787	/nfs/dbraw/zinc/33/37/87/330333787.db2.gz	WVRUVMVQMOPMOJ-CYBMUJFWSA-N	1	0	284.790	4.405	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@H](c1ccc(C)cc1)C1CCC1	ZINC000424290876	330334798	/nfs/dbraw/zinc/33/47/98/330334798.db2.gz	CIEQIMVJUWZDOG-FHWLQOOXSA-N	1	0	285.431	4.017	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@H](C)c1cc2cc(C)c(C)cc2o1	ZINC000424290781	330334802	/nfs/dbraw/zinc/33/48/02/330334802.db2.gz	CHLHNHAHSUFACE-VYDXJSESSA-N	1	0	299.414	4.291	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@H](CC(C)C)c1cccs1	ZINC000424296272	330336108	/nfs/dbraw/zinc/33/61/08/330336108.db2.gz	OBTTWJRMWTZGQS-ZNMIVQPWSA-N	1	0	279.449	4.016	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@H](C)c1ccccc1SCC	ZINC000424297926	330336420	/nfs/dbraw/zinc/33/64/20/330336420.db2.gz	RKADJHDCQVJJEF-YCPHGPKFSA-N	1	0	291.460	4.040	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@@H](C)c1ccc(-c2ccccc2)o1	ZINC000424297687	330336434	/nfs/dbraw/zinc/33/64/34/330336434.db2.gz	RAYCZBOATLCXMR-XIRDDKMYSA-N	1	0	297.398	4.188	20	30		CIEDRO
C=C[C@@H]1OCC[C@H]1C[NH2+][C@@H](c1ccc(C)o1)C1CCCC1	ZINC000424299664	330336861	/nfs/dbraw/zinc/33/68/61/330336861.db2.gz	VWGZRRRLASYDKT-XYJFISCASA-N	1	0	289.419	4.000	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@@H](c2ccccc2)c2ccc(F)cc2)C1	ZINC000424316182	330339505	/nfs/dbraw/zinc/33/95/05/330339505.db2.gz	ASHYMLAAUXIPFL-KYNGSXCRSA-N	1	0	294.373	4.197	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@@H](c2ccc(Cl)cc2)C2CCC2)C1	ZINC000424318199	330339772	/nfs/dbraw/zinc/33/97/72/330339772.db2.gz	CRUYWRYIHQJIPC-JCURWCKSSA-N	1	0	288.822	4.463	20	30		CIEDRO
CC(C)C[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1cccs1	ZINC000424318059	330339785	/nfs/dbraw/zinc/33/97/85/330339785.db2.gz	CLDPQFQFXRXWMS-BFHYXJOUSA-N	1	0	262.422	4.117	20	30		CIEDRO
CC(C)c1cccc2c1OCCC[C@@H]2[NH2+][C@@H]1CC[C@H](C#N)C1	ZINC000424320022	330339976	/nfs/dbraw/zinc/33/99/76/330339976.db2.gz	FLEPZKUACVNQBT-DAYGRLMNSA-N	1	0	298.430	4.306	20	30		CIEDRO
C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+][C@@H]1CC[C@H](C#N)C1	ZINC000424322723	330340529	/nfs/dbraw/zinc/34/05/29/330340529.db2.gz	ILSXDDVNSRSKQK-ZOBORPQBSA-N	1	0	299.443	4.070	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccccc1C(C)(C)C	ZINC000424328039	330341661	/nfs/dbraw/zinc/34/16/61/330341661.db2.gz	NTCHQBOYBODGEN-SOUVJXGZSA-N	1	0	270.420	4.327	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@H](c2ccccc2F)C2CCCC2)C1	ZINC000424328784	330341879	/nfs/dbraw/zinc/34/18/79/330341879.db2.gz	OOBXXOCHCGRDMV-JOQOYGCGSA-N	1	0	286.394	4.339	20	30		CIEDRO
CC(C)COc1ccc([C@@H](C)[NH2+][C@@H]2CC[C@H](C#N)C2)cc1	ZINC000424329203	330341958	/nfs/dbraw/zinc/34/19/58/330341958.db2.gz	PKTNSWHHYHERHN-HLLBOEOZSA-N	1	0	286.419	4.064	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@H]2CCC[C@H]2CCc2ccccc2)C1	ZINC000424330754	330342107	/nfs/dbraw/zinc/34/21/07/330342107.db2.gz	RAQHEVYYAIYJPK-XWSJACJDSA-N	1	0	282.431	4.070	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@H]2CCSc3c(Cl)cccc32)C1	ZINC000424330056	330342179	/nfs/dbraw/zinc/34/21/79/330342179.db2.gz	QCTIVOAITMRBRU-WDMOLILDSA-N	1	0	292.835	4.159	20	30		CIEDRO
CC(C)[C@@H]1C[C@@H]([NH2+][C@@H]2CC[C@H](C#N)C2)c2ccccc21	ZINC000424331177	330342219	/nfs/dbraw/zinc/34/22/19/330342219.db2.gz	RTPMLBOLUSCGJX-IHETXDGRSA-N	1	0	268.404	4.153	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1cccc(Cl)c1Cl	ZINC000424331749	330342701	/nfs/dbraw/zinc/34/27/01/330342701.db2.gz	SJHBKRWXHRKIIT-OUAUKWLOSA-N	1	0	283.202	4.336	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1cccc(-c2ccncc2)c1	ZINC000424337584	330343525	/nfs/dbraw/zinc/34/35/25/330343525.db2.gz	ZOYJEMPPSIQPEO-ZRGWGRIASA-N	1	0	291.398	4.091	20	30		CIEDRO
N#C[C@H]1CC[C@@H]([NH2+][C@@H](CC2CC2)c2ccc(Cl)cc2)C1	ZINC000424337518	330343584	/nfs/dbraw/zinc/34/35/84/330343584.db2.gz	ZHUOENJYZIYABN-XKQJLSEDSA-N	1	0	288.822	4.463	20	30		CIEDRO
COc1ccc([C@@H](C)[NH2+]CC(C)(C)CCC#N)c(Cl)c1	ZINC000424342023	330344195	/nfs/dbraw/zinc/34/41/95/330344195.db2.gz	CBGJYCGPLVBMTM-GFCCVEGCSA-N	1	0	294.826	4.329	20	30		CIEDRO
C=CCCC[N@@H+](C)CCC(=O)Nc1cccc2ccccc21	ZINC000533300087	330356630	/nfs/dbraw/zinc/35/66/30/330356630.db2.gz	AXXHEEYNYWLESG-UHFFFAOYSA-N	1	0	296.414	4.066	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H]2CCC[C@H]2c2ccccc2)c(F)c1	ZINC000533309308	330356925	/nfs/dbraw/zinc/35/69/25/330356925.db2.gz	GINSIIXQJKJQQI-HKUYNNGSSA-N	1	0	294.373	4.123	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCc1ccc(OC(F)F)cc1)C1CC1	ZINC000533362049	330359767	/nfs/dbraw/zinc/35/97/67/330359767.db2.gz	DTTMFEXRQSDTBD-INIZCTEOSA-N	1	0	295.373	4.165	20	30		CIEDRO
CC1(C[NH2+]C2CCC(C#N)(c3ccccc3)CC2)CCC1	ZINC000536908998	330364679	/nfs/dbraw/zinc/36/46/79/330364679.db2.gz	IIAPZCZSKPLFIC-UHFFFAOYSA-N	1	0	282.431	4.170	20	30		CIEDRO
CC(C)[C@H]([NH2+]Cc1ccccc1C#N)c1ccc(F)cc1	ZINC000057627924	330377122	/nfs/dbraw/zinc/37/71/22/330377122.db2.gz	ZHQGYBRIAKCBJW-SFHVURJKSA-N	1	0	282.362	4.184	20	30		CIEDRO
C=CCOc1ccccc1C[NH2+][C@@H](C)c1cccc(OC)c1	ZINC000119640576	330378042	/nfs/dbraw/zinc/37/80/42/330378042.db2.gz	BDORELINUBCPKH-HNNXBMFYSA-N	1	0	297.398	4.111	20	30		CIEDRO
C[C@H](c1ccc2ccccc2c1)[NH+]1CCC(C#N)CC1	ZINC000057872738	330379253	/nfs/dbraw/zinc/37/92/53/330379253.db2.gz	KWKRBRAJEQYFCX-CQSZACIVSA-N	1	0	264.372	4.136	20	30		CIEDRO
Cc1cc(C)c(C[N@H+](C)Cc2cccc(C#N)c2)c(C)c1	ZINC000058006034	330382076	/nfs/dbraw/zinc/38/20/76/330382076.db2.gz	LQKJNLGFELFYCC-UHFFFAOYSA-N	1	0	278.399	4.116	20	30		CIEDRO
CC(C)Oc1ccccc1[C@@H](C)[NH2+]CCCC(C)(C)C#N	ZINC000537023129	330384642	/nfs/dbraw/zinc/38/46/42/330384642.db2.gz	MMHDWGLRECMMMU-OAHLLOKOSA-N	1	0	288.435	4.454	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CC1(c2ccccc2)CCOCC1)C1CC1	ZINC000120131754	330384737	/nfs/dbraw/zinc/38/47/37/330384737.db2.gz	QMHVTZBQTIZCQP-LJQANCHMSA-N	1	0	299.458	4.069	20	30		CIEDRO
COc1cc(C#N)ccc1C[NH2+][C@@H](c1ccccc1)C(C)C	ZINC000120547284	330389425	/nfs/dbraw/zinc/38/94/25/330389425.db2.gz	DJEBRURDSMDMOC-LJQANCHMSA-N	1	0	294.398	4.054	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCCCc1nc(C)cs1)C1CC1	ZINC000120890357	330392045	/nfs/dbraw/zinc/39/20/45/330392045.db2.gz	GXHCGUFGBZWMET-OAHLLOKOSA-N	1	0	278.465	4.109	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1cc(-c2ccccc2)on1)C1CC1	ZINC000120826884	330392686	/nfs/dbraw/zinc/39/26/86/330392686.db2.gz	XINBWHKCBHLAQA-QGZVFWFLSA-N	1	0	282.387	4.176	20	30		CIEDRO
C=CCCC[C@@H](C)[N@@H+]1CC[C@@H](COCc2ccccc2)C1	ZINC000537047465	330394520	/nfs/dbraw/zinc/39/45/20/330394520.db2.gz	NPNLCIZGDIYDFN-IEBWSBKVSA-N	1	0	287.447	4.270	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@@H](CCC#N)c1ccccc1	ZINC000090665457	330394583	/nfs/dbraw/zinc/39/45/83/330394583.db2.gz	VJVFXKJWZFUVCH-IRXDYDNUSA-N	1	0	256.393	4.366	20	30		CIEDRO
C[C@H]1CCC[C@@H]([NH2+][C@@H](CCC#N)c2ccccc2)C1	ZINC000090665538	330394630	/nfs/dbraw/zinc/39/46/30/330394630.db2.gz	IBJKGIWEPDFMQE-UAGQMJEPSA-N	1	0	256.393	4.200	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@H](CCC#N)c1ccccc1	ZINC000090665459	330394694	/nfs/dbraw/zinc/39/46/94/330394694.db2.gz	VJVFXKJWZFUVCH-DLBZAZTESA-N	1	0	256.393	4.366	20	30		CIEDRO
CCC(CC)[C@@H]([NH2+]CCCSCC#N)c1cccs1	ZINC000537076841	330395440	/nfs/dbraw/zinc/39/54/40/330395440.db2.gz	RLMRZFJWSIFNBG-OAHLLOKOSA-N	1	0	296.505	4.462	20	30		CIEDRO
Cc1oc2ccccc2c1C[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000121259285	330398683	/nfs/dbraw/zinc/39/86/83/330398683.db2.gz	XKQWKGFAKNFCLQ-ZDUSSCGKSA-N	1	0	290.366	4.464	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH2+]C2(Cc3ccc(Cl)cc3)CCC2)C1	ZINC000425949472	330498922	/nfs/dbraw/zinc/49/89/22/330498922.db2.gz	IHBHMQBZGQORJW-GDBMZVCRSA-N	1	0	288.822	4.087	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([NH2+][C@@H]2CCCc3sc(Cl)cc32)C1	ZINC000426302321	330503379	/nfs/dbraw/zinc/50/33/79/330503379.db2.gz	RJQDZGWDANVNSW-JFGNBEQYSA-N	1	0	280.824	4.061	20	30		CIEDRO
Cc1ccc(C(C)(C)C[NH2+][C@H]2CCC[C@H](C#N)C2)c(C)c1	ZINC000426324308	330504261	/nfs/dbraw/zinc/50/42/61/330504261.db2.gz	FESWHBSGLQWHDZ-IRXDYDNUSA-N	1	0	284.447	4.253	20	30		CIEDRO
C=CCCCCC[NH2+]C(C)(C)c1cc(C(F)(F)F)on1	ZINC000429230067	330540554	/nfs/dbraw/zinc/54/05/54/330540554.db2.gz	VWCBIUPMMBUFNG-UHFFFAOYSA-N	1	0	290.329	4.265	20	30		CIEDRO
C[C@H]([NH2+]CC1(CC#N)CC1)c1ccc(-c2ccccc2)o1	ZINC000430743820	330572427	/nfs/dbraw/zinc/57/24/27/330572427.db2.gz	LQMRWWNANDAELI-AWEZNQCLSA-N	1	0	280.371	4.291	20	30		CIEDRO
N#CCC1(C[NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)CC1	ZINC000430752802	330573212	/nfs/dbraw/zinc/57/32/12/330573212.db2.gz	IBBUPIKRZGGRNS-QGZVFWFLSA-N	1	0	284.378	4.045	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+]CCC1CC(OC(C)(C)C)C1	ZINC000432425274	330599210	/nfs/dbraw/zinc/59/92/10/330599210.db2.gz	LQBNLTACFDACQP-PCKAHOCUSA-N	1	0	267.457	4.305	20	30		CIEDRO
N#CCCC[C@H]([NH2+]Cc1ccncc1Cl)c1ccccc1	ZINC000433012695	330612100	/nfs/dbraw/zinc/61/21/00/330612100.db2.gz	USMIMLDEPDVQLR-KRWDZBQOSA-N	1	0	299.805	4.260	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H]2CC[C@H](Cc3ccccc3)C2)cc1	ZINC000436232284	330671258	/nfs/dbraw/zinc/67/12/58/330671258.db2.gz	NXCMDXGIXWMOFX-UXHICEINSA-N	1	0	290.410	4.059	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+][C@H]1C[C@H](c2cccc(F)c2)C1	ZINC000436284830	330673421	/nfs/dbraw/zinc/67/34/21/330673421.db2.gz	NYGGLALQZHIHGO-XIRDDKMYSA-N	1	0	261.384	4.406	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@@H](CC(F)(F)F)C(C)C	ZINC000437093319	330693226	/nfs/dbraw/zinc/69/32/26/330693226.db2.gz	GHAZKIONKKCKSQ-SRVKXCTJSA-N	1	0	251.336	4.154	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1nc(C(C)C)c(C)s1)C1CC1	ZINC000438998391	330732064	/nfs/dbraw/zinc/73/20/64/330732064.db2.gz	ITSPNDPTMICXLP-AWEZNQCLSA-N	1	0	278.465	4.409	20	30		CIEDRO
CC(C)Cc1ccc(C[NH2+]CC2CCC(C#N)CC2)cc1	ZINC000441384187	330767227	/nfs/dbraw/zinc/76/72/27/330767227.db2.gz	QKXMIFFAMKOYFJ-UHFFFAOYSA-N	1	0	284.447	4.305	20	30		CIEDRO
CC[C@@H]([NH2+]CC1CCC(C#N)CC1)c1ccc(F)cc1F	ZINC000442088845	330773967	/nfs/dbraw/zinc/77/39/67/330773967.db2.gz	AVCXRGQSNDRHIW-QWQCLYJRSA-N	1	0	292.373	4.335	20	30		CIEDRO
COc1ccccc1[C@H](CC(C)C)[NH2+][C@@H]1CC[C@H](C#N)C1	ZINC000442763506	330781500	/nfs/dbraw/zinc/78/15/00/330781500.db2.gz	GTONPGMUSQKDAK-UXLLHSPISA-N	1	0	286.419	4.064	20	30		CIEDRO
CC(C)(C[NH2+][C@@H]1CC[C@@H](C#N)C1)Cc1cccc(Cl)c1	ZINC000442777467	330782244	/nfs/dbraw/zinc/78/22/44/330782244.db2.gz	GABJNMJSIGRXJC-GDBMZVCRSA-N	1	0	290.838	4.191	20	30		CIEDRO
C[C@@H]([NH2+]C1CCC(C(F)F)CC1)c1cccc(C#N)c1	ZINC000442780658	330782505	/nfs/dbraw/zinc/78/25/05/330782505.db2.gz	NDPAAESBEISHTD-NUYPLMSZSA-N	1	0	278.346	4.033	20	30		CIEDRO
Cc1c(C)c(C)c(C[NH2+][C@@H]2CC[C@@H](C#N)C2)c(C)c1C	ZINC000442833551	330786049	/nfs/dbraw/zinc/78/60/49/330786049.db2.gz	VAWHSLWLFBCFTA-IAGOWNOFSA-N	1	0	270.420	4.011	20	30		CIEDRO
CC(C)c1ccc(C[C@@H](C)[NH2+][C@@H]2CC[C@@H](C#N)C2)cc1	ZINC000442849475	330786742	/nfs/dbraw/zinc/78/67/42/330786742.db2.gz	OBIMJTWWOBJQSQ-QGPMSJSTSA-N	1	0	270.420	4.023	20	30		CIEDRO
CC[C@@H]1C[C@H](C)CC[C@@H]1[NH2+]CC1CCC(C#N)CC1	ZINC000442852366	330787011	/nfs/dbraw/zinc/78/70/11/330787011.db2.gz	HRVJQTHFGPFPDX-LKRQVQDUSA-N	1	0	262.441	4.121	20	30		CIEDRO
CC[C@@H](Cc1ccc(C)cc1)[NH2+]CC1CCC(C#N)CC1	ZINC000442854708	330787300	/nfs/dbraw/zinc/78/73/00/330787300.db2.gz	LGJZKGFBPKXABH-ACBHZAAOSA-N	1	0	284.447	4.236	20	30		CIEDRO
Cc1ccccc1[C@H](CC(F)(F)F)[NH2+][C@H]1CC[C@H](C#N)C1	ZINC000442861362	330787992	/nfs/dbraw/zinc/78/79/92/330787992.db2.gz	XUAMVZQNXMRUHL-YDHLFZDLSA-N	1	0	296.336	4.270	20	30		CIEDRO
CC(C)[C@@H]1CCCC[C@@H]1[NH2+]CC1CCC(C#N)CC1	ZINC000442862353	330788086	/nfs/dbraw/zinc/78/80/86/330788086.db2.gz	ZSJVNMOBSIEMHM-GQGLESIBSA-N	1	0	262.441	4.121	20	30		CIEDRO
Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+]CC1CCC(C#N)CC1	ZINC000442866935	330788557	/nfs/dbraw/zinc/78/85/57/330788557.db2.gz	JQALERWXODGHQJ-IDMDMSBLSA-N	1	0	282.431	4.463	20	30		CIEDRO
CC[C@H]([NH2+]CC1CCC(C#N)CC1)c1cccs1	ZINC000442869474	330788896	/nfs/dbraw/zinc/78/88/96/330788896.db2.gz	BBZSKFYLCVOYOI-RUXDESIVSA-N	1	0	262.422	4.119	20	30		CIEDRO
CCc1ccc([C@H](C)[NH2+]CC2CCC(C#N)CC2)cc1	ZINC000442874147	330789506	/nfs/dbraw/zinc/78/95/06/330789506.db2.gz	LUTOYQHIWNXBAY-OOHWJJMZSA-N	1	0	270.420	4.230	20	30		CIEDRO
Cc1cc(C[NH2+][C@H]2CCc3cc(Cl)ccc32)ccc1C#N	ZINC000443961837	330807995	/nfs/dbraw/zinc/80/79/95/330807995.db2.gz	FLUUWSCXUSCOMQ-SFHVURJKSA-N	1	0	296.801	4.297	20	30		CIEDRO
Cc1cc(C[NH2+][C@H]2CCCc3ccccc32)ccc1C#N	ZINC000443969953	330808087	/nfs/dbraw/zinc/80/80/87/330808087.db2.gz	HSCJLMSIZUKNFM-IBGZPJMESA-N	1	0	276.383	4.034	20	30		CIEDRO
Cc1cc(C[NH2+][C@H](C)CCCC(F)(F)F)ccc1C#N	ZINC000443981782	330808238	/nfs/dbraw/zinc/80/82/38/330808238.db2.gz	BBDYHMBPMODQJH-GFCCVEGCSA-N	1	0	284.325	4.077	20	30		CIEDRO
C=C(CC)C[NH2+][C@@H](C)c1nc2ccccc2n1C(F)F	ZINC000444677292	330818609	/nfs/dbraw/zinc/81/86/09/330818609.db2.gz	PMWMFSPUZQSSKP-NSHDSACASA-N	1	0	279.334	4.048	20	30		CIEDRO
CC(C)(C#N)CCCC[NH2+]C(C)(C)c1cccc(F)c1	ZINC000444686348	330819532	/nfs/dbraw/zinc/81/95/32/330819532.db2.gz	VYNRJADFZYOWAI-UHFFFAOYSA-N	1	0	276.399	4.370	20	30		CIEDRO
Fc1ccc(C#CC[NH2+][C@H]2CCC[C@H]2c2ccccc2)cc1	ZINC000445997913	330842334	/nfs/dbraw/zinc/84/23/34/330842334.db2.gz	CXTOCZUFHWFLJV-PMACEKPBSA-N	1	0	293.385	4.103	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+]CCCCCc2ccc(F)cc2)C1	ZINC000446792896	330854304	/nfs/dbraw/zinc/85/43/04/330854304.db2.gz	AZJJBCWTUZJVOZ-WMZOPIPTSA-N	1	0	288.410	4.210	20	30		CIEDRO
CC(C)[C@H](C[NH2+][C@@H]1CCC[C@@H](C#N)C1)Cc1ccccc1	ZINC000446795966	330854431	/nfs/dbraw/zinc/85/44/31/330854431.db2.gz	PPNVFDJXMOKSTG-CEXWTWQISA-N	1	0	284.447	4.173	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+]CCc2ccc(Cl)cc2Cl)C1	ZINC000447512672	330867513	/nfs/dbraw/zinc/86/75/13/330867513.db2.gz	ZOSBLLOMMRMXCA-SMDDNHRTSA-N	1	0	297.229	4.208	20	30		CIEDRO
CCSCC[C@@H](C)[NH2+][C@H](CC)c1ccc(C#N)cc1	ZINC000447525936	330867841	/nfs/dbraw/zinc/86/78/41/330867841.db2.gz	BLQYUGWBFPUHOB-CZUORRHYSA-N	1	0	276.449	4.131	20	30		CIEDRO
CC(C)(C)[C@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)c1ccccc1	ZINC000447531513	330868111	/nfs/dbraw/zinc/86/81/11/330868111.db2.gz	PWMDEEUWJZQKLG-DJIMGWMZSA-N	1	0	270.420	4.446	20	30		CIEDRO
CC[C@@H]([NH2+]C1(c2ccccc2)CC1)c1ccc(C#N)cc1	ZINC000447586057	330871559	/nfs/dbraw/zinc/87/15/59/330871559.db2.gz	LCVXAGITTORKRE-GOSISDBHSA-N	1	0	276.383	4.288	20	30		CIEDRO
CC1(C#N)CCC([NH2+]Cc2csc3ccccc23)CC1	ZINC000449082129	330897952	/nfs/dbraw/zinc/89/79/52/330897952.db2.gz	KRLQGIGQKBEHJE-UHFFFAOYSA-N	1	0	284.428	4.463	20	30		CIEDRO
CC(C)Oc1ccccc1C[NH2+]C1CCC(C)(C#N)CC1	ZINC000449085151	330898019	/nfs/dbraw/zinc/89/80/19/330898019.db2.gz	KSCNQBLAIIGHPQ-UHFFFAOYSA-N	1	0	286.419	4.036	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@H]2CCc3cc(Cl)ccc32)CC1	ZINC000449096142	330898688	/nfs/dbraw/zinc/89/86/88/330898688.db2.gz	FCVWHEOMWCZAAY-WIHSUSGWSA-N	1	0	288.822	4.389	20	30		CIEDRO
CCC[C@@H](Cc1ccccc1)[NH2+]C1CCC(C)(C#N)CC1	ZINC000449118929	330900008	/nfs/dbraw/zinc/90/00/08/330900008.db2.gz	VANIFLLOGIOJDB-XBMUEBEBSA-N	1	0	284.447	4.460	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000449127561	330900523	/nfs/dbraw/zinc/90/05/23/330900523.db2.gz	WKMSJHMBPLCEIY-QGLXBCBXSA-N	1	0	282.431	4.385	20	30		CIEDRO
CCc1cccc2c1OCC[C@@H]2[NH2+]C1CCC(C)(C#N)CC1	ZINC000449136264	330901214	/nfs/dbraw/zinc/90/12/14/330901214.db2.gz	UPXLKOCUKYUBSA-RMXPPQQLSA-N	1	0	298.430	4.135	20	30		CIEDRO
C=CCCCC[C@@H](C)[NH2+][C@@H](CC)c1nccs1	ZINC000449159986	330902452	/nfs/dbraw/zinc/90/24/52/330902452.db2.gz	KEDTXIPRPMJUQZ-OLZOCXBDSA-N	1	0	252.427	4.319	20	30		CIEDRO
CCO[C@@H]1C[C@@H]([NH2+]C2CCC(C)(C#N)CC2)C1(CC)CC	ZINC000449178889	330904012	/nfs/dbraw/zinc/90/40/12/330904012.db2.gz	YLCAYOUINQEABH-JCCCHCCOSA-N	1	0	292.467	4.032	20	30		CIEDRO
CC(C)CC1(C[NH2+]C2CCC(C)(C#N)CC2)CCC1	ZINC000449185137	330904614	/nfs/dbraw/zinc/90/46/14/330904614.db2.gz	GJHWOEXDOOYPMY-UHFFFAOYSA-N	1	0	262.441	4.265	20	30		CIEDRO
CC[C@H](CC#N)[NH2+][C@@H]1CC[C@H](c2ccc(Cl)cc2)C1	ZINC000449245241	330909336	/nfs/dbraw/zinc/90/93/36/330909336.db2.gz	ZMUPRJWWTCPBEB-NUEKZKHPSA-N	1	0	276.811	4.258	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@H](C)c1nc(C(C)(C)C)no1	ZINC000449280563	330911525	/nfs/dbraw/zinc/91/15/25/330911525.db2.gz	XWMKGNKTZFGSMC-QWHCGFSZSA-N	1	0	279.428	4.153	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]C1CCC(OC2CCCC2)CC1	ZINC000449341070	330916340	/nfs/dbraw/zinc/91/63/40/330916340.db2.gz	RMWDLYWCJVBOLE-UHFFFAOYSA-N	1	0	279.468	4.449	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1cccc(C2CC2)c1	ZINC000449349190	330917130	/nfs/dbraw/zinc/91/71/30/330917130.db2.gz	JBOIUWAJRKBAJX-DEYYWGMASA-N	1	0	268.404	4.297	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+]C[C@@H]1CSc2ccccc21	ZINC000449367334	330919220	/nfs/dbraw/zinc/91/92/20/330919220.db2.gz	VIPSNGBDCOHSIE-MELADBBJSA-N	1	0	261.434	4.066	20	30		CIEDRO
CC(C)C[C@@H](C[NH2+][C@H]1CC[C@@H](CC#N)C1)c1ccccc1	ZINC000449446478	330926381	/nfs/dbraw/zinc/92/63/81/330926381.db2.gz	RKNLQJXCRWFFCM-WDSOQIARSA-N	1	0	284.447	4.488	20	30		CIEDRO
COc1cccc2c(C[NH2+][C@H]3CC[C@@H](CC#N)C3)cccc12	ZINC000449446290	330926382	/nfs/dbraw/zinc/92/63/82/330926382.db2.gz	QAGBJVNLOKDCKY-HOCLYGCPSA-N	1	0	294.398	4.020	20	30		CIEDRO
N#CC[C@@H]1CC[C@H]([NH2+][C@@H]2CCCC23CCCCC3)C1	ZINC000449447276	330926419	/nfs/dbraw/zinc/92/64/19/330926419.db2.gz	YGURRNNDGMKRMY-HRCADAONSA-N	1	0	260.425	4.161	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)[C@H](C)c1nc2ccccc2s1	ZINC000449479938	330929245	/nfs/dbraw/zinc/92/92/45/330929245.db2.gz	WRRZLHDLDCVKQZ-QWHCGFSZSA-N	1	0	274.433	4.344	20	30		CIEDRO
C=CC(C)(C)C[NH2+]C1CC(c2cc(F)cc(F)c2)C1	ZINC000449487503	330930210	/nfs/dbraw/zinc/93/02/10/330930210.db2.gz	YRZNKGXSWVBIJZ-UHFFFAOYSA-N	1	0	265.347	4.013	20	30		CIEDRO
C=CCCCC[C@H](C)[NH2+][C@H]1CCO[C@@H](c2ccncc2)C1	ZINC000449547569	330935441	/nfs/dbraw/zinc/93/54/41/330935441.db2.gz	ISXVYEXZIOAXBS-RYQLBKOJSA-N	1	0	288.435	4.026	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H]2CC[C@H](c3ccccc3)C2)cc1F	ZINC000449737299	330947420	/nfs/dbraw/zinc/94/74/20/330947420.db2.gz	RGEAJAABDXJLMA-WMZOPIPTSA-N	1	0	294.373	4.123	20	30		CIEDRO
N#CC1(C[NH2+][C@@H](c2ccc(Cl)cc2)C2CC2)CCC1	ZINC000450658925	330991787	/nfs/dbraw/zinc/99/17/87/330991787.db2.gz	FHOVMAXBASDMDX-OAHLLOKOSA-N	1	0	274.795	4.075	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCC(C)(F)F)c1ccccc1	ZINC000450679270	330993080	/nfs/dbraw/zinc/99/30/80/330993080.db2.gz	JOQCNOBPFWIQOB-AWEZNQCLSA-N	1	0	253.336	4.329	20	30		CIEDRO
C=CCCCCC[NH+]1CCC(F)(c2ccccn2)CC1	ZINC000450928471	331007653	/nfs/dbraw/zinc/00/76/53/331007653.db2.gz	GNYUKGZCIPGSGX-UHFFFAOYSA-N	1	0	276.399	4.089	20	30		CIEDRO
N#CCCC[N@@H+]1CCc2ccc(-c3ccccc3)cc2C1	ZINC000451158451	331017942	/nfs/dbraw/zinc/01/79/42/331017942.db2.gz	KWRZFNFWWKWKMU-UHFFFAOYSA-N	1	0	276.383	4.015	20	30		CIEDRO
Cc1cc([C@@H](C)[NH2+]Cc2ccc(CC#N)cc2)ccc1F	ZINC000451159551	331018181	/nfs/dbraw/zinc/01/81/81/331018181.db2.gz	AUEGLRZHUBVTAG-CQSZACIVSA-N	1	0	282.362	4.051	20	30		CIEDRO
C=CC[NH2+]C(C)(C)c1nc(-c2ccccc2F)c(C)s1	ZINC000451166800	331018449	/nfs/dbraw/zinc/01/84/49/331018449.db2.gz	PHBMUXVILXGELN-UHFFFAOYSA-N	1	0	290.407	4.268	20	30		CIEDRO
C[C@@H]1C[C@@H](c2ccccc2)[C@@H](C)[N@@H+]1CCC(C)(C)C#N	ZINC000451180404	331019106	/nfs/dbraw/zinc/01/91/06/331019106.db2.gz	GJCBEPSLHMRIKE-BFYDXBDKSA-N	1	0	270.420	4.193	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](C)c1ccccc1C(F)(F)F	ZINC000163315351	331020079	/nfs/dbraw/zinc/02/00/79/331020079.db2.gz	CNLWHTWXRWMRLK-MNOVXSKESA-N	1	0	257.299	4.321	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)c1sc(C(C)(C)C)nc1C	ZINC000163336057	331022639	/nfs/dbraw/zinc/02/26/39/331022639.db2.gz	AKTNFERYKNZVRH-WDEREUQCSA-N	1	0	266.454	4.364	20	30		CIEDRO
C[C@@H]1C[C@@H](C(F)(F)F)CC[N@@H+]1CCCCC(C)(C)C#N	ZINC000451408221	331028032	/nfs/dbraw/zinc/02/80/32/331028032.db2.gz	NEXCKQDRLLCOSB-OLZOCXBDSA-N	1	0	290.373	4.369	20	30		CIEDRO
C=CCCCCC[N@@H+]1CC2(CCOCC2)[C@@H]2CCC[C@@H]21	ZINC000451623928	331037259	/nfs/dbraw/zinc/03/72/59/331037259.db2.gz	DPOGNHHVLNQUDB-SJORKVTESA-N	1	0	277.452	4.014	20	30		CIEDRO
N#Cc1ccc(CN2CC3(CCC3)[C@H]2c2ccco2)cc1F	ZINC000451862495	331045357	/nfs/dbraw/zinc/04/53/57/331045357.db2.gz	VMNUSRASACEALV-QGZVFWFLSA-N	1	0	296.345	4.018	20	30		CIEDRO
C=CCCC[N@@H+]1CCCC[C@@H]1c1nc2ccccc2[nH]1	ZINC000451880109	331046153	/nfs/dbraw/zinc/04/61/53/331046153.db2.gz	UQRICWQRNIIXOI-MRXNPFEDSA-N	1	0	269.392	4.056	20	30		CIEDRO
CC1(C#N)CCC([NH2+]C2(Cc3ccccc3)CCC2)CC1	ZINC000453166248	331096246	/nfs/dbraw/zinc/09/62/46/331096246.db2.gz	NTJMXHCXZZLEKU-UHFFFAOYSA-N	1	0	282.431	4.214	20	30		CIEDRO
CC[C@@H]([NH2+][C@H](CCC#N)c1ccccc1)c1ccncc1	ZINC000453183518	331098260	/nfs/dbraw/zinc/09/82/60/331098260.db2.gz	YVAKNYJWULEPKL-QZTJIDSGSA-N	1	0	279.387	4.167	20	30		CIEDRO
C=CCCCC[NH2+][C@@H](C)c1ncc(-c2ccccc2)n1C	ZINC000453200438	331100720	/nfs/dbraw/zinc/10/07/20/331100720.db2.gz	RDCREBRIVJXFAH-HNNXBMFYSA-N	1	0	283.419	4.094	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@@H]1CSc2ccccc21)C1CC1	ZINC000453218518	331102813	/nfs/dbraw/zinc/10/28/13/331102813.db2.gz	JWVPPRFQFXCIHG-ZBFHGGJFSA-N	1	0	273.445	4.210	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCCc2c(F)cccc21)c1ccc(C#N)cc1	ZINC000453238019	331105511	/nfs/dbraw/zinc/10/55/11/331105511.db2.gz	QBXBFIVQVRMOHE-BFUOFWGJSA-N	1	0	294.373	4.426	20	30		CIEDRO
CC[C@H]([NH2+]C[C@H]1CCCCC1(F)F)c1ccc(C#N)cc1	ZINC000453242727	331106372	/nfs/dbraw/zinc/10/63/72/331106372.db2.gz	FSYLMBITIUVRBV-CVEARBPZSA-N	1	0	292.373	4.424	20	30		CIEDRO
C=CCC[C@@H]([NH2+]C[C@H]1CCCCC1(F)F)C1CC1	ZINC000453260955	331108676	/nfs/dbraw/zinc/10/86/76/331108676.db2.gz	YHTZAUIDZWSQQC-ZIAGYGMSSA-N	1	0	257.368	4.146	20	30		CIEDRO
C=CC(C)(C)C[NH2+][C@@H](C)c1nc(C(F)(F)F)cs1	ZINC000453303908	331113543	/nfs/dbraw/zinc/11/35/43/331113543.db2.gz	DROMUOBAVLYERK-QMMMGPOBSA-N	1	0	278.343	4.025	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)c1sc(-c2cccnc2)nc1C	ZINC000453325850	331117075	/nfs/dbraw/zinc/11/70/75/331117075.db2.gz	USGXHJMNZFFMBU-GFCCVEGCSA-N	1	0	287.432	4.130	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H]1CCO[C@H](c2cccs2)C1)C1CC1	ZINC000453349136	331120340	/nfs/dbraw/zinc/12/03/40/331120340.db2.gz	AZLCHPUSZXUHRJ-PMPSAXMXSA-N	1	0	291.460	4.303	20	30		CIEDRO
C=C(CC)C[NH2+][C@H](C)c1sc(-c2cccnc2)nc1C	ZINC000453358472	331121979	/nfs/dbraw/zinc/12/19/79/331121979.db2.gz	LUXUVEOAESXWRC-GFCCVEGCSA-N	1	0	287.432	4.130	20	30		CIEDRO
C[C@H]1CCc2ccccc2[C@@H]1[NH2+]Cc1ccc(C#N)c(F)c1	ZINC000453369135	331123795	/nfs/dbraw/zinc/12/37/95/331123795.db2.gz	FHFFIUJELHMOKX-ORAYPTAESA-N	1	0	294.373	4.111	20	30		CIEDRO
C=CCC1(C[NH2+][C@@H](C)c2cnn(C(C)C)c2)CCCC1	ZINC000453375928	331124532	/nfs/dbraw/zinc/12/45/32/331124532.db2.gz	PEWOWKAPLKDREE-HNNXBMFYSA-N	1	0	275.440	4.251	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+]C2(Cc3cccc(Cl)c3)CC2)C1	ZINC000453376144	331124832	/nfs/dbraw/zinc/12/48/32/331124832.db2.gz	PEBUSSXQSOALPY-HOCLYGCPSA-N	1	0	288.822	4.087	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+]C2(Cc3cccc(Cl)c3)CC2)C1	ZINC000453376147	331124974	/nfs/dbraw/zinc/12/49/74/331124974.db2.gz	PEBUSSXQSOALPY-ZBFHGGJFSA-N	1	0	288.822	4.087	20	30		CIEDRO
C=CCC[C@@H](CO)[NH2+][C@H](C)c1cc2cc(Cl)ccc2o1	ZINC000453380914	331125705	/nfs/dbraw/zinc/12/57/05/331125705.db2.gz	ZQNYHEXEUHRLOG-RISCZKNCSA-N	1	0	293.794	4.064	20	30		CIEDRO
C=CCCCC[NH2+][C@H]1CCC[C@@H](c2ncccc2C)C1	ZINC000467356513	331174841	/nfs/dbraw/zinc/17/48/41/331174841.db2.gz	WPCUUYJQKKDEMF-SJORKVTESA-N	1	0	272.436	4.362	20	30		CIEDRO
C=CCCCC[NH2+][C@@H](C)c1sc(CC)nc1C	ZINC000471597285	331280341	/nfs/dbraw/zinc/28/03/41/331280341.db2.gz	ODUVKFDSTJLEPA-NSHDSACASA-N	1	0	252.427	4.021	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@@H](C)CC(=O)Nc1cccc(Cl)c1	ZINC000467411187	331280904	/nfs/dbraw/zinc/28/09/04/331280904.db2.gz	BGBMLFOUUHRTMS-JSGCOSHPSA-N	1	0	294.826	4.001	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([N@@H+]2CC3(CCCC3)[C@@H]2c2ccccc2)C1	ZINC000459581108	331289196	/nfs/dbraw/zinc/28/91/96/331289196.db2.gz	PSIVEBPKUYYHLD-NXHRZFHOSA-N	1	0	280.415	4.296	20	30		CIEDRO
C=CCCCCC[NH2+][C@H](C)c1nc2c(s1)CCC2	ZINC000459632877	331291302	/nfs/dbraw/zinc/29/13/02/331291302.db2.gz	OCMMFDJEMWCJPB-GFCCVEGCSA-N	1	0	264.438	4.029	20	30		CIEDRO
CC(C)(CC#N)C[NH2+]Cc1cccc(OC2CCCC2)c1	ZINC000459693627	331294701	/nfs/dbraw/zinc/29/47/01/331294701.db2.gz	NSKDTXOQYHIXIS-UHFFFAOYSA-N	1	0	286.419	4.037	20	30		CIEDRO
CC(C)(C#N)CCC[N@@H+]1CCc2cccc(Cl)c2C1	ZINC000459692726	331294716	/nfs/dbraw/zinc/29/47/16/331294716.db2.gz	VUUDLXUUBAQSQY-UHFFFAOYSA-N	1	0	276.811	4.028	20	30		CIEDRO
CC1(C)[C@@H](C[NH2+]C2CCC(C)(C#N)CC2)[C@@H]1c1ccccc1	ZINC000459714476	331295379	/nfs/dbraw/zinc/29/53/79/331295379.db2.gz	OPYMJEZYTVUNLJ-NRGCRIOASA-N	1	0	296.458	4.488	20	30		CIEDRO
CC(C)(CC#N)C[NH2+][C@H]1CC[C@@](C)(c2ccccc2)C1	ZINC000459728838	331296238	/nfs/dbraw/zinc/29/62/38/331296238.db2.gz	JCCLPIHAGGVCDA-FUHWJXTLSA-N	1	0	270.420	4.026	20	30		CIEDRO
N#CC1(c2ccccc2)CCC([NH2+][C@H]2CCC[C@@H]3C[C@@H]32)CC1	ZINC000459761907	331299097	/nfs/dbraw/zinc/29/90/97/331299097.db2.gz	NFKDEMYHOAJXCJ-JFWNRHRWSA-N	1	0	294.442	4.169	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)c1ccc(Cl)cc1	ZINC000459764797	331299329	/nfs/dbraw/zinc/29/93/29/331299329.db2.gz	NRHOXFCUPBXHGG-LALPHHSUSA-N	1	0	262.784	4.073	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](c1ccccc1)c1ccc(OC)cc1	ZINC000166147115	331306587	/nfs/dbraw/zinc/30/65/87/331306587.db2.gz	MODIARSQVHPFEA-DNVCBOLYSA-N	1	0	281.399	4.339	20	30		CIEDRO
CC#CCC[NH2+]Cc1ccc(-c2nc3ccccc3s2)o1	ZINC000166301393	331307042	/nfs/dbraw/zinc/30/70/42/331307042.db2.gz	DQUQCVKXFFHQIG-UHFFFAOYSA-N	1	0	296.395	4.059	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+]C[C@@H](c1ccco1)N1CCCCC1	ZINC000461796487	331314751	/nfs/dbraw/zinc/31/47/51/331314751.db2.gz	ONHQANFMIDCCOE-SJORKVTESA-N	1	0	290.451	4.141	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+]C[C@H](c1ccco1)N1CCCCC1	ZINC000461796482	331314786	/nfs/dbraw/zinc/31/47/86/331314786.db2.gz	ONHQANFMIDCCOE-DLBZAZTESA-N	1	0	290.451	4.141	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+]CCc1ccc2ccccc2n1	ZINC000462034120	331316858	/nfs/dbraw/zinc/31/68/58/331316858.db2.gz	YLOXFLJWDXCBCA-MRXNPFEDSA-N	1	0	268.404	4.112	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+]CCc1c(C)[nH]c2ccccc21	ZINC000462038877	331316932	/nfs/dbraw/zinc/31/69/32/331316932.db2.gz	MWLCBFJPNGTZFA-OAHLLOKOSA-N	1	0	270.420	4.353	20	30		CIEDRO
CC#CCC[N@H+](C)[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000462321180	331319584	/nfs/dbraw/zinc/31/95/84/331319584.db2.gz	LXZZONIBVUWEQU-LBPRGKRZSA-N	1	0	269.310	4.112	20	30		CIEDRO
C[C@H]1CCCc2ccccc2[C@@H]1[NH2+]Cc1ccc(C#N)cc1	ZINC000462547507	331323301	/nfs/dbraw/zinc/32/33/01/331323301.db2.gz	HFYPEGGDEDTEBW-MGPUTAFESA-N	1	0	290.410	4.362	20	30		CIEDRO
CC[C@H]([NH2+]Cc1cccc(C#N)c1)C(C)(C)c1ccccc1	ZINC000462723505	331325581	/nfs/dbraw/zinc/32/55/81/331325581.db2.gz	DTADQUBJZZOEFP-IBGZPJMESA-N	1	0	292.426	4.404	20	30		CIEDRO
C=CCc1cc(C[NH2+][C@H](C)C[C@@H](C)CC)cc(OC)c1O	ZINC000462738388	331326551	/nfs/dbraw/zinc/32/65/51/331326551.db2.gz	RVCDDWVBKPEFLO-UONOGXRCSA-N	1	0	291.435	4.044	20	30		CIEDRO
C=C[C@H](C)[NH2+][C@H](C)c1csc(-c2ccccc2F)n1	ZINC000462817564	331329991	/nfs/dbraw/zinc/32/99/91/331329991.db2.gz	OHDMOUIEEUPURL-WDEREUQCSA-N	1	0	276.380	4.174	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(C2CCCC2)cc1	ZINC000462901106	331334432	/nfs/dbraw/zinc/33/44/32/331334432.db2.gz	BKWPUOYWMHYVEO-ZWKOTPCHSA-N	1	0	268.404	4.126	20	30		CIEDRO
C[C@H](Nc1cc2c(c[nH+]1)CCCC2)c1ccc(C#N)cc1	ZINC000462946297	331335605	/nfs/dbraw/zinc/33/56/05/331335605.db2.gz	OSRBUZLDSQCQLW-ZDUSSCGKSA-N	1	0	277.371	4.005	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@H]2CCCCC23CCCC3)C1	ZINC000462948906	331335803	/nfs/dbraw/zinc/33/58/03/331335803.db2.gz	XCFVOWVQFBDWHZ-PMPSAXMXSA-N	1	0	260.425	4.161	20	30		CIEDRO
C=C(C)COCC[NH2+][C@@H](C)c1ccc(OC(C)(C)C)cc1	ZINC000463010681	331336934	/nfs/dbraw/zinc/33/69/34/331336934.db2.gz	MSWXTVHGLVHJPO-HNNXBMFYSA-N	1	0	291.435	4.107	20	30		CIEDRO
C=CCCOCC[NH2+][C@@H](C)c1ccc(OC(C)(C)C)cc1	ZINC000463024205	331337347	/nfs/dbraw/zinc/33/73/47/331337347.db2.gz	ODRNGHVZQHNHIB-HNNXBMFYSA-N	1	0	291.435	4.107	20	30		CIEDRO
C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+][C@H]1CCC[C@H](C#N)C1	ZINC000463241733	331343839	/nfs/dbraw/zinc/34/38/39/331343839.db2.gz	HOKXXXBPVQFZEB-KHSSZTOVSA-N	1	0	286.394	4.121	20	30		CIEDRO
CC(C)(C[NH2+][C@H]1CCC[C@@H](C#N)C1)C1CCCCC1	ZINC000463247258	331344233	/nfs/dbraw/zinc/34/42/33/331344233.db2.gz	VLWNWYYMRXXXPZ-ZBFHGGJFSA-N	1	0	262.441	4.265	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@@H]2CCCC[C@H]2c2ccccc2)C1	ZINC000463279882	331344937	/nfs/dbraw/zinc/34/49/37/331344937.db2.gz	KIDNYCFDVJJVHA-XGXHKWSGSA-N	1	0	282.431	4.385	20	30		CIEDRO
CC(C)[C@H]1CC[C@@H](C)C[C@H]1[NH2+][C@H]1CCC[C@H](C#N)C1	ZINC000463292151	331345224	/nfs/dbraw/zinc/34/52/24/331345224.db2.gz	ZXTCERSXUBTSGB-DRRXZNNHSA-N	1	0	262.441	4.119	20	30		CIEDRO
C[C@H](CC(C)(C)c1ccccc1)[NH2+][C@H]1CCC[C@@H](C#N)C1	ZINC000463289385	331345237	/nfs/dbraw/zinc/34/52/37/331345237.db2.gz	OVPPFHJJRRFSTQ-NUJGCVRESA-N	1	0	284.447	4.415	20	30		CIEDRO
C[C@H](CC(C)(C)c1ccccc1)[NH2+][C@@H]1CCC[C@@H](C#N)C1	ZINC000463289384	331345290	/nfs/dbraw/zinc/34/52/90/331345290.db2.gz	OVPPFHJJRRFSTQ-JFIYKMOQSA-N	1	0	284.447	4.415	20	30		CIEDRO
C[C@H](CC(C)(C)c1ccccc1)[NH2+][C@H]1CCC[C@H](C#N)C1	ZINC000463289386	331345346	/nfs/dbraw/zinc/34/53/46/331345346.db2.gz	OVPPFHJJRRFSTQ-RYRKJORJSA-N	1	0	284.447	4.415	20	30		CIEDRO
CC1(C)CC[C@H]([NH2+][C@@H]2CCC[C@H](C#N)C2)c2ccccc21	ZINC000463292984	331345510	/nfs/dbraw/zinc/34/55/10/331345510.db2.gz	BLWRCWMBSNIXLS-DAYGRLMNSA-N	1	0	282.431	4.471	20	30		CIEDRO
CCC[C@H]([NH2+][C@H]1CCC[C@H](C#N)C1)C1CCCCC1	ZINC000463293246	331345572	/nfs/dbraw/zinc/34/55/72/331345572.db2.gz	GCUMZGHGUVDIRR-XIRDDKMYSA-N	1	0	262.441	4.407	20	30		CIEDRO
CC1(C)CC[C@H]([NH2+][C@H]2CCC[C@@H](C#N)C2)c2ccccc21	ZINC000463292987	331345610	/nfs/dbraw/zinc/34/56/10/331345610.db2.gz	BLWRCWMBSNIXLS-VKJFTORMSA-N	1	0	282.431	4.471	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+]CCCCCOC2CCCCC2)C1	ZINC000463295996	331345651	/nfs/dbraw/zinc/34/56/51/331345651.db2.gz	BEYARNVOZWIJFE-IRXDYDNUSA-N	1	0	292.467	4.178	20	30		CIEDRO
N#C[C@H]1CCC[C@@H]([NH2+]CCCCCOC2CCCCC2)C1	ZINC000463295994	331345674	/nfs/dbraw/zinc/34/56/74/331345674.db2.gz	BEYARNVOZWIJFE-DLBZAZTESA-N	1	0	292.467	4.178	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+]CC2(c3ccccc3)CCCC2)C1	ZINC000463301473	331345771	/nfs/dbraw/zinc/34/57/71/331345771.db2.gz	MNWASBAWIHKZAM-SJLPKXTDSA-N	1	0	282.431	4.170	20	30		CIEDRO
CCC1(CC)C[N@@H+]([C@H](C)c2ccc(C#N)cc2)CCS1	ZINC000464570126	331362855	/nfs/dbraw/zinc/36/28/55/331362855.db2.gz	AKVIMYLAOSGIAV-CQSZACIVSA-N	1	0	288.460	4.227	20	30		CIEDRO
C=CCCC[N@@H+]1CC[C@@H](CSc2ccccc2)C1	ZINC000464765019	331366745	/nfs/dbraw/zinc/36/67/45/331366745.db2.gz	JUWCXVNKJSWOHB-OAHLLOKOSA-N	1	0	261.434	4.067	20	30		CIEDRO
CC[C@@]1(C)CCC[N@@H+]([C@H](C)c2ccc(C#N)cc2)C1	ZINC000464778343	331367593	/nfs/dbraw/zinc/36/75/93/331367593.db2.gz	NRDIBKPXOMNIQC-PBHICJAKSA-N	1	0	256.393	4.131	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1cccc(OCc2ccccn2)c1	ZINC000466400396	331394918	/nfs/dbraw/zinc/39/49/18/331394918.db2.gz	CSQWTUJZXRUKSN-KRWDZBQOSA-N	1	0	296.414	4.105	20	30		CIEDRO
C=CCOCCC[NH2+][C@@H](c1ccccc1)c1ccc(F)cc1	ZINC000470770557	331490137	/nfs/dbraw/zinc/49/01/37/331490137.db2.gz	COXDXLXVOZQQBH-IBGZPJMESA-N	1	0	299.389	4.097	20	30		CIEDRO
C=CCOCCC[NH2+][C@H](C)c1ccc(SC(C)C)cc1	ZINC000470779928	331490859	/nfs/dbraw/zinc/49/08/59/331490859.db2.gz	OPKWIBCEEOXSTE-OAHLLOKOSA-N	1	0	293.476	4.430	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH2+][C@@H](c2ccccc2)C2CCCC2)C1	ZINC000471593588	331511744	/nfs/dbraw/zinc/51/17/44/331511744.db2.gz	MDKYSCMHMHQAAF-OLMNPRSZSA-N	1	0	268.404	4.200	20	30		CIEDRO
N#C[C@@H]1CC[C@@H]([NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)C1	ZINC000471597248	331512221	/nfs/dbraw/zinc/51/22/21/331512221.db2.gz	NUDWGHQCYNSKAT-FSPWUOQZSA-N	1	0	284.378	4.043	20	30		CIEDRO
Cc1ccc([C@H]([NH2+][C@H]2CC[C@H](C#N)C2)c2ccccc2)cc1	ZINC000471616819	331513599	/nfs/dbraw/zinc/51/35/99/331513599.db2.gz	CXMWROLGFDNVMR-FFZOFVMBSA-N	1	0	290.410	4.366	20	30		CIEDRO
C=CCCCC[NH2+]Cc1ccc(OCC(F)(F)F)cc1	ZINC000472063681	331528091	/nfs/dbraw/zinc/52/80/91/331528091.db2.gz	PBAAOHWKEJAJTI-UHFFFAOYSA-N	1	0	287.325	4.074	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@@H]2CCC[C@H]2c2ccccc2)c1F	ZINC000475204834	331618151	/nfs/dbraw/zinc/61/81/51/331618151.db2.gz	JSMLZHMAFMSWMV-ZWKOTPCHSA-N	1	0	294.373	4.123	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+]CC1CCN(c2ccccc2)CC1	ZINC000475289583	331622601	/nfs/dbraw/zinc/62/26/01/331622601.db2.gz	ZPDNJCILMSQWSI-DLBZAZTESA-N	1	0	286.463	4.093	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CC[C@@H](c3ccc(F)cc3)C2)cc1	ZINC000475355253	331628719	/nfs/dbraw/zinc/62/87/19/331628719.db2.gz	UZFGGXARHCDUON-IEBWSBKVSA-N	1	0	294.373	4.123	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+][C@H](C)c1ccc(Br)cn1	ZINC000475484162	331632876	/nfs/dbraw/zinc/63/28/76/331632876.db2.gz	CVHNNFAELIQQRS-SDDRHHMPSA-N	1	0	297.240	4.095	20	30		CIEDRO
CCC[C@@H]([NH2+]Cc1cccc(C#N)c1)C1CCCCC1	ZINC000477216636	331679240	/nfs/dbraw/zinc/67/92/40/331679240.db2.gz	JZAQZSPDEXGBNK-GOSISDBHSA-N	1	0	270.420	4.397	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CCCc1ccccc1F)C1CC1	ZINC000479520846	331734796	/nfs/dbraw/zinc/73/47/96/331734796.db2.gz	YOYISLGLUWVWBC-QGZVFWFLSA-N	1	0	261.384	4.093	20	30		CIEDRO
C=CCC[C@@H](CCC)[NH2+][C@@H](C)c1ccncc1F	ZINC000511051069	332925773	/nfs/dbraw/zinc/92/57/73/332925773.db2.gz	QIDSYSDXANKVHT-QWHCGFSZSA-N	1	0	250.361	4.006	20	30		CIEDRO
C=C(C)[C@H]([NH2+][C@H](CC)C1CC1)c1ccc(F)c(F)c1	ZINC000480696629	331785032	/nfs/dbraw/zinc/78/50/32/331785032.db2.gz	WWASPWPYAZJMCL-CVEARBPZSA-N	1	0	265.347	4.360	20	30		CIEDRO
C=C(C)[C@@H]([NH2+]CC[C@@H]1CCCCO1)c1ccc(F)c(F)c1	ZINC000481604075	331810258	/nfs/dbraw/zinc/81/02/58/331810258.db2.gz	KOJSPBUIGVLFSF-WMLDXEAASA-N	1	0	295.373	4.131	20	30		CIEDRO
C=C(C)[C@H]([NH2+]CC[C@H]1CCCCO1)c1ccc(F)c(F)c1	ZINC000481604073	331810314	/nfs/dbraw/zinc/81/03/14/331810314.db2.gz	KOJSPBUIGVLFSF-PBHICJAKSA-N	1	0	295.373	4.131	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CC[C@@H](c3ccccc3F)C2)cc1	ZINC000481808368	331816325	/nfs/dbraw/zinc/81/63/25/331816325.db2.gz	AFYLCMGJFLNLLC-IAGOWNOFSA-N	1	0	294.373	4.123	20	30		CIEDRO
Cc1ccc(C[NH2+][C@@H]2CCCCc3cc(C#N)ccc32)cc1	ZINC000481912101	331818420	/nfs/dbraw/zinc/81/84/20/331818420.db2.gz	UUYTWTFLZQCUGJ-HXUWFJFHSA-N	1	0	290.410	4.424	20	30		CIEDRO
CC1(c2cccc(Cl)c2)CC[NH+](CCCCC#N)CC1	ZINC000483238062	331864362	/nfs/dbraw/zinc/86/43/62/331864362.db2.gz	PJZCJNOASCSASA-UHFFFAOYSA-N	1	0	290.838	4.387	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]2c2ccccc2)cc1F	ZINC000483973869	331890427	/nfs/dbraw/zinc/89/04/27/331890427.db2.gz	CIAVBBXCMICGFJ-IEBWSBKVSA-N	1	0	294.373	4.123	20	30		CIEDRO
CC[C@H]([NH2+]CC#Cc1ccccc1)c1ccc(F)cc1F	ZINC000484083241	331892227	/nfs/dbraw/zinc/89/22/27/331892227.db2.gz	RVMVQRAMLZKAHZ-SFHVURJKSA-N	1	0	285.337	4.057	20	30		CIEDRO
CC(C)(C#N)c1ccccc1C[NH+]1C[C@H]2CCCC[C@@H]2C1	ZINC000486779767	331944630	/nfs/dbraw/zinc/94/46/30/331944630.db2.gz	NXOCUEAEACLPCO-HZPDHXFCSA-N	1	0	282.431	4.110	20	30		CIEDRO
C=CCC[NH2+][C@@H](c1cccc(OC(F)(F)F)c1)C1CC1	ZINC000511589090	332936508	/nfs/dbraw/zinc/93/65/08/332936508.db2.gz	VHWQRDYZVKDFMT-CQSZACIVSA-N	1	0	285.309	4.202	20	30		CIEDRO
C=CCCCCC[NH2+]C(C)(C)c1nc(C)c(C)s1	ZINC000488114721	331990704	/nfs/dbraw/zinc/99/07/04/331990704.db2.gz	UUKNMPVKNCYKFF-UHFFFAOYSA-N	1	0	266.454	4.331	20	30		CIEDRO
Cc1cc(C[N@H+]2C[C@H](C)[C@H]2c2ccccc2)ccc1C#N	ZINC000488470737	332012370	/nfs/dbraw/zinc/01/23/70/332012370.db2.gz	VMJBWTHRSZRSGA-KXBFYZLASA-N	1	0	276.383	4.060	20	30		CIEDRO
C=CCCCCC[NH2+][C@H]1CCO[C@@H]1c1ccc(F)c(F)c1	ZINC000488996936	332037135	/nfs/dbraw/zinc/03/71/35/332037135.db2.gz	OWZOTNRFGFGVBY-DLBZAZTESA-N	1	0	295.373	4.131	20	30		CIEDRO
C[C@@H](c1cccc(C#N)c1)[N@H+](C)CCCc1ccccc1	ZINC000489070352	332040352	/nfs/dbraw/zinc/04/03/52/332040352.db2.gz	HWDATQSVMJNCCV-INIZCTEOSA-N	1	0	278.399	4.184	20	30		CIEDRO
CC(C)C[N@H+](Cc1ccccc1)Cc1ccc(F)cc1C#N	ZINC000489636842	332062424	/nfs/dbraw/zinc/06/24/24/332062424.db2.gz	ULTGOLMORLJSIO-UHFFFAOYSA-N	1	0	296.389	4.356	20	30		CIEDRO
C[C@@H](c1cccc(C#N)c1)[N@H+](C)CCCOc1ccccc1	ZINC000490091715	332081124	/nfs/dbraw/zinc/08/11/24/332081124.db2.gz	NCEYBEQHLGIRSH-INIZCTEOSA-N	1	0	294.398	4.020	20	30		CIEDRO
C=CC[N@@H+](CCc1ccco1)C[C@H](C)c1ccccc1	ZINC000491328957	332191707	/nfs/dbraw/zinc/19/17/07/332191707.db2.gz	JZVWZGPJEMRHGP-INIZCTEOSA-N	1	0	269.388	4.114	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]Cc2occc2C)cc1Cl	ZINC000491402876	332205186	/nfs/dbraw/zinc/20/51/86/332205186.db2.gz	VXHXNXHFHSPHKK-UHFFFAOYSA-N	1	0	291.778	4.096	20	30		CIEDRO
Cc1cc(C[NH2+]C[C@@H]2CCCCC(F)(F)C2)ccc1C#N	ZINC000491572584	332240700	/nfs/dbraw/zinc/24/07/00/332240700.db2.gz	NTBSGUMRYUSDTB-OAHLLOKOSA-N	1	0	292.373	4.172	20	30		CIEDRO
CCSc1cccc(C[NH2+]Cc2cc(C#N)cs2)c1	ZINC000492483113	332399795	/nfs/dbraw/zinc/39/97/95/332399795.db2.gz	JJOCCRWORFASGP-UHFFFAOYSA-N	1	0	288.441	4.022	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](c1ccc(F)cc1)c1ccc(OC)cc1	ZINC000494027163	332461361	/nfs/dbraw/zinc/46/13/61/332461361.db2.gz	GKACOLURKRFQDJ-KUHUBIRLSA-N	1	0	299.389	4.478	20	30		CIEDRO
C[C@H]([NH2+]C[C@H]1CCCCC(F)(F)C1)c1ccc(C#N)cc1	ZINC000494994339	332498814	/nfs/dbraw/zinc/49/88/14/332498814.db2.gz	DKXHIPVUQHBQSK-ZFWWWQNUSA-N	1	0	292.373	4.424	20	30		CIEDRO
N#CC1(CC[N@@H+]2CCC=C(c3ccccn3)C2)CCCCC1	ZINC000575758866	335112654	/nfs/dbraw/zinc/11/26/54/335112654.db2.gz	FFVHRSMRHIBXJI-UHFFFAOYSA-N	1	0	295.430	4.035	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCc1ccc2c(c1)CCO2)c1ccco1	ZINC000552042743	334280421	/nfs/dbraw/zinc/28/04/21/334280421.db2.gz	ZYHFPJLBJDFVNW-KRWDZBQOSA-N	1	0	297.398	4.054	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]CC2CCC(F)(F)CC2)cc1	ZINC000500434536	332608712	/nfs/dbraw/zinc/60/87/12/332608712.db2.gz	RLJMJYJECTZKIE-UHFFFAOYSA-N	1	0	295.373	4.167	20	30		CIEDRO
Cc1ccccc1[C@H]1C[C@H]([NH2+][C@H](C)c2cccc(C#N)c2)C1	ZINC000500867779	332620652	/nfs/dbraw/zinc/62/06/52/332620652.db2.gz	XFFWUZTWLWMRHE-ATZDWAIDSA-N	1	0	290.410	4.464	20	30		CIEDRO
C[C@H]1CCC[C@@H]1[NH2+]C1CCC(C#N)(c2ccccc2)CC1	ZINC000502347819	332654484	/nfs/dbraw/zinc/65/44/84/332654484.db2.gz	WYYOFFZQPJIKAO-BARLLCKDSA-N	1	0	282.431	4.169	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@H]1CCC[C@H]1CCOC)c1ccccc1	ZINC000502404692	332657044	/nfs/dbraw/zinc/65/70/44/332657044.db2.gz	KAMYNMIFKUPPCE-FHWLQOOXSA-N	1	0	287.447	4.489	20	30		CIEDRO
C=C(C[NH2+][C@H](C)c1cnn(C2CCCC2)c1)c1ccccc1	ZINC000502412164	332657794	/nfs/dbraw/zinc/65/77/94/332657794.db2.gz	DQEAMVIHKHAACE-MRXNPFEDSA-N	1	0	295.430	4.362	20	30		CIEDRO
C=C(C[NH2+]C[C@H]1C[C@H]1c1ccccc1)c1ccccc1	ZINC000503021627	332678730	/nfs/dbraw/zinc/67/87/30/332678730.db2.gz	WEQAYXZPBHLXSI-MOPGFXCFSA-N	1	0	263.384	4.093	20	30		CIEDRO
CC[C@H](CC#N)[NH2+]C/C(C)=C\c1ccccc1C(F)(F)F	ZINC000503564630	332692304	/nfs/dbraw/zinc/69/23/04/332692304.db2.gz	CEKFJFHZXRLHJT-GAJOTYCWSA-N	1	0	296.336	4.391	20	30		CIEDRO
C[C@H]([NH2+]C/C=C\c1ccc(F)c(F)c1)c1ccc(C#N)cc1	ZINC000512103409	332953886	/nfs/dbraw/zinc/95/38/86/332953886.db2.gz	GDNZFHHZUQNMFL-ZRMMWKCHSA-N	1	0	298.336	4.200	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1ccccc1)c1ccc(C#N)cc1F	ZINC000512628288	332976637	/nfs/dbraw/zinc/97/66/37/332976637.db2.gz	DHEVRSMOBXIYRG-QWHCGFSZSA-N	1	0	268.335	4.109	20	30		CIEDRO
Cc1cccc(C)c1CC[NH2+][C@H](C)c1ccc(C#N)cc1F	ZINC000512628593	332976648	/nfs/dbraw/zinc/97/66/48/332976648.db2.gz	FNEBUCRTDYEPCX-OAHLLOKOSA-N	1	0	296.389	4.208	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H](C)c1ccc(C#N)cc1F	ZINC000512633641	332976970	/nfs/dbraw/zinc/97/69/70/332976970.db2.gz	AJRLOXXVCKXTBA-CHWSQXEVSA-N	1	0	260.356	4.093	20	30		CIEDRO
C[C@H](CCc1ccccc1)[NH2+][C@@H](C)c1ccc(C#N)cc1F	ZINC000512661760	332978531	/nfs/dbraw/zinc/97/85/31/332978531.db2.gz	UCGAYYGXCISZGT-CABCVRRESA-N	1	0	296.389	4.369	20	30		CIEDRO
C[C@H]([NH2+][C@H](c1ccccc1)C1CC1)c1ccc(C#N)cc1F	ZINC000512660667	332978608	/nfs/dbraw/zinc/97/86/08/332978608.db2.gz	OIKMVGFRBJXGDY-ORAYPTAESA-N	1	0	294.373	4.499	20	30		CIEDRO
CC(C)(C)c1ccc(CC[NH2+]Cc2ccc(C#N)cc2)cc1	ZINC000512809476	332987417	/nfs/dbraw/zinc/98/74/17/332987417.db2.gz	LPIGDHGMJRCAND-UHFFFAOYSA-N	1	0	292.426	4.188	20	30		CIEDRO
C/C(=C/c1ccc(Cl)cc1)C[NH2+]Cc1cccc(C#N)c1	ZINC000513030908	332999884	/nfs/dbraw/zinc/99/98/84/332999884.db2.gz	IOSZIFAPMIHOFM-ZROIWOOFSA-N	1	0	296.801	4.405	20	30		CIEDRO
Cc1ccc(C[C@@H]2CCC[N@@H+]2CCCC(C)(C)C#N)cc1	ZINC000174862044	333009388	/nfs/dbraw/zinc/00/93/88/333009388.db2.gz	KRZLNLJNVXSAPW-SFHVURJKSA-N	1	0	284.447	4.332	20	30		CIEDRO
CC[C@@H]1C[N@H+](CCCCC#N)CC[C@@H]1c1ccccc1	ZINC000174886506	333009991	/nfs/dbraw/zinc/00/99/91/333009991.db2.gz	LJLOTFALLCKUPC-AEFFLSMTSA-N	1	0	270.420	4.196	20	30		CIEDRO
C[C@H]1C[C@H](c2ccccc2)[N@H+](Cc2ccc(C#N)c(F)c2)C1	ZINC000513237047	333010345	/nfs/dbraw/zinc/01/03/45/333010345.db2.gz	SJWWECVIIMHMFR-IFXJQAMLSA-N	1	0	294.373	4.280	20	30		CIEDRO
C[C@H]1C[C@H](c2ccccc2)[N@H+](Cc2ccc(CC#N)cc2)C1	ZINC000513247340	333010917	/nfs/dbraw/zinc/01/09/17/333010917.db2.gz	NJUXCHIDYRSKLQ-OXJNMPFZSA-N	1	0	290.410	4.336	20	30		CIEDRO
CCc1ccc([C@H]2CCC[N@H+](CCCCC#N)C2)cc1	ZINC000513360769	333015316	/nfs/dbraw/zinc/01/53/16/333015316.db2.gz	DYGPMPFEUOMMAI-SFHVURJKSA-N	1	0	270.420	4.122	20	30		CIEDRO
CC[N@H+](CCCOc1cccc2ccccc21)C[C@@H](C)C#N	ZINC000513447530	333019924	/nfs/dbraw/zinc/01/99/24/333019924.db2.gz	NPGVNOVZPYVVDE-INIZCTEOSA-N	1	0	296.414	4.090	20	30		CIEDRO
C=CC[C@H](CC)[NH2+]Cc1ccc(Sc2ccccn2)o1	ZINC000513460386	333021063	/nfs/dbraw/zinc/02/10/63/333021063.db2.gz	DWWWFQHNLUHMFZ-ZDUSSCGKSA-N	1	0	288.416	4.270	20	30		CIEDRO
CC(C)(CCC#N)C[N@@H+]1CCC[C@H](Cc2ccccc2)C1	ZINC000513655925	333029603	/nfs/dbraw/zinc/02/96/03/333029603.db2.gz	PASHWFHTJXTWQN-GOSISDBHSA-N	1	0	284.447	4.271	20	30		CIEDRO
C=CCCC[NH2+]Cc1cc(Br)c(Cl)s1	ZINC000308519911	333032947	/nfs/dbraw/zinc/03/29/47/333032947.db2.gz	HDNYBTSWRXHXRA-UHFFFAOYSA-N	1	0	294.645	4.220	20	30		CIEDRO
Cc1ccccc1C[C@H]1CCC[N@@H+]1CC(C)(C)CCC#N	ZINC000513754333	333037526	/nfs/dbraw/zinc/03/75/26/333037526.db2.gz	KEDVMXVOKAJSKS-GOSISDBHSA-N	1	0	284.447	4.332	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccc(Cl)s1)C1CC1	ZINC000309564194	333045739	/nfs/dbraw/zinc/04/57/39/333045739.db2.gz	KGZCUBPITGXANK-GFCCVEGCSA-N	1	0	255.814	4.236	20	30		CIEDRO
Cc1[nH+]ccc(N[C@@H](C)c2ccc(C#N)cc2)c1Cl	ZINC000312124514	333077024	/nfs/dbraw/zinc/07/70/24/333077024.db2.gz	YHPURGURICINCT-JTQLQIEISA-N	1	0	271.751	4.088	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC[C@H](C#N)C1)c1cc2ccccc2s1	ZINC000517398301	333098901	/nfs/dbraw/zinc/09/89/01/333098901.db2.gz	IFFJVVQONFQCQX-OBJOEFQTSA-N	1	0	270.401	4.244	20	30		CIEDRO
CC(C)CC[C@H]1CCC[C@H]1[NH2+]Cc1cccc(C#N)c1	ZINC000517551762	333102372	/nfs/dbraw/zinc/10/23/72/333102372.db2.gz	VIRWSEQFQQQIAH-QZTJIDSGSA-N	1	0	270.420	4.253	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]C[C@@H]2CCc3ccccc32)cc1	ZINC000517712151	333106565	/nfs/dbraw/zinc/10/65/65/333106565.db2.gz	UHTRKBSJTUMPEA-SFHVURJKSA-N	1	0	293.410	4.071	20	30		CIEDRO
CC(C)(C)C1CCC(C[NH2+]CCCCC#N)CC1	ZINC000183731721	333121956	/nfs/dbraw/zinc/12/19/56/333121956.db2.gz	AQANPNCCVALTHT-UHFFFAOYSA-N	1	0	250.430	4.122	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C(F)F)cc1)c1cccc(C#N)c1	ZINC000183989507	333124227	/nfs/dbraw/zinc/12/42/27/333124227.db2.gz	XUBLKZBYBRGJOL-LBPRGKRZSA-N	1	0	286.325	4.347	20	30		CIEDRO
C[C@@H]([NH2+]C[C@@H]1CCC[C@@H](C)C1)c1cccc(C#N)c1	ZINC000218941752	333138617	/nfs/dbraw/zinc/13/86/17/333138617.db2.gz	AXSRODDEIXCOCL-IIAWOOMASA-N	1	0	256.393	4.035	20	30		CIEDRO
C[C@@H]([NH2+]C[C@H]1CCC[C@@H](C)C1)c1cccc(C#N)c1	ZINC000218941873	333138649	/nfs/dbraw/zinc/13/86/49/333138649.db2.gz	AXSRODDEIXCOCL-FMKPAKJESA-N	1	0	256.393	4.035	20	30		CIEDRO
CC(C)[C@H](C[NH2+][C@H]1CCC[C@H](C#N)C1)c1ccccc1	ZINC000185771363	333148452	/nfs/dbraw/zinc/14/84/52/333148452.db2.gz	UZAJRQHENOKDBR-SZMVWBNQSA-N	1	0	270.420	4.098	20	30		CIEDRO
CC[C@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1ccc(Cl)cc1	ZINC000185772105	333148503	/nfs/dbraw/zinc/14/85/03/333148503.db2.gz	VFIIFPBNKWBCEB-RCBQFDQVSA-N	1	0	276.811	4.463	20	30		CIEDRO
Cc1cc(C)cc([C@H](C)[NH2+][C@H]2CCC[C@H](C#N)C2)c1	ZINC000185817090	333149658	/nfs/dbraw/zinc/14/96/58/333149658.db2.gz	DOBKSHOPCPTMPU-ZOBUZTSGSA-N	1	0	256.393	4.036	20	30		CIEDRO
CC(C)[C@H](Cc1ccc(F)cc1)[NH2+][C@@H]1CCC[C@H](C#N)C1	ZINC000185846702	333150146	/nfs/dbraw/zinc/15/01/46/333150146.db2.gz	OURNWESXJINHCQ-JQHSSLGASA-N	1	0	288.410	4.065	20	30		CIEDRO
N#C[C@H]1CCC[C@H]([NH2+]CC2(c3cccc(Cl)c3)CC2)C1	ZINC000185837883	333150150	/nfs/dbraw/zinc/15/01/50/333150150.db2.gz	PDZVDNMKKXFABY-BBRMVZONSA-N	1	0	288.822	4.044	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)c1c(F)cccc1Cl	ZINC000185852372	333150295	/nfs/dbraw/zinc/15/02/95/333150295.db2.gz	CYHVFGOYLCYKRJ-SDDRHHMPSA-N	1	0	280.774	4.212	20	30		CIEDRO
C=C(C)[C@H]([NH2+][C@@H](C)c1ccncc1)c1ccc(F)c(F)c1	ZINC000186451448	333161079	/nfs/dbraw/zinc/16/10/79/333161079.db2.gz	UVMJPQDIHVXTKC-SJCJKPOMSA-N	1	0	288.341	4.328	20	30		CIEDRO
C=C(C)[C@H]([NH2+]Cc1ccc(C#N)cc1)c1ccc(F)c(F)c1	ZINC000187373990	333170056	/nfs/dbraw/zinc/17/00/56/333170056.db2.gz	ZZFLSNVWHUJNFX-SFHVURJKSA-N	1	0	298.336	4.243	20	30		CIEDRO
CCC[N@H+](Cc1ccccc1C#N)[C@@H]1CCc2ccccc21	ZINC000521819322	333190085	/nfs/dbraw/zinc/19/00/85/333190085.db2.gz	YIYBNJIVXKUPSN-HXUWFJFHSA-N	1	0	290.410	4.458	20	30		CIEDRO
C=CCCOCC[NH2+][C@@H](C)c1cc(Cl)sc1Cl	ZINC000222444006	333193362	/nfs/dbraw/zinc/19/33/62/333193362.db2.gz	KXLFLIKFUCATGP-VIFPVBQESA-N	1	0	294.247	4.298	20	30		CIEDRO
C=CCCOCC[NH2+][C@H](C)c1cc(Cl)sc1Cl	ZINC000222444068	333193447	/nfs/dbraw/zinc/19/34/47/333193447.db2.gz	KXLFLIKFUCATGP-SECBINFHSA-N	1	0	294.247	4.298	20	30		CIEDRO
C=C(C)C[C@H](C)C(=O)Nc1ccc(C[NH+](CC)CC)cc1	ZINC000190582276	333208509	/nfs/dbraw/zinc/20/85/09/333208509.db2.gz	CGJQBSFCUWNWJX-HNNXBMFYSA-N	1	0	288.435	4.069	20	30		CIEDRO
CC(C)[N@H+](Cc1cccs1)Cc1cccc(C#N)c1F	ZINC000223525805	333208726	/nfs/dbraw/zinc/20/87/26/333208726.db2.gz	WJYUUWKIZJRIGK-UHFFFAOYSA-N	1	0	288.391	4.169	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C2CC2)cc1)c1cccc(C#N)c1	ZINC000190804013	333210741	/nfs/dbraw/zinc/21/07/41/333210741.db2.gz	SNUGPBBFEQRFBJ-AWEZNQCLSA-N	1	0	276.383	4.286	20	30		CIEDRO
C=CCC[C@H](CCC)[NH2+][C@H](C)c1nc(C(C)(C)C)no1	ZINC000191569335	333221517	/nfs/dbraw/zinc/22/15/17/333221517.db2.gz	UTSVICXIMOFSTM-OLZOCXBDSA-N	1	0	279.428	4.153	20	30		CIEDRO
CC[C@H](Cc1ccc(Cl)cc1Cl)[NH2+]CC1(C#N)CC1	ZINC000521958829	333228022	/nfs/dbraw/zinc/22/80/22/333228022.db2.gz	PTNXZDIXHXPZJH-CYBMUJFWSA-N	1	0	297.229	4.208	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C#N)c(F)c1)c1ccccc1Cl	ZINC000192079999	333229095	/nfs/dbraw/zinc/22/90/95/333229095.db2.gz	NBZZCSKLHGAWPS-LLVKDONJSA-N	1	0	288.753	4.202	20	30		CIEDRO
C=CCC[C@H](CC)[NH2+]Cc1ccc2ncccc2c1	ZINC000192982885	333240943	/nfs/dbraw/zinc/24/09/43/333240943.db2.gz	RQYVKWXKOKDJDR-INIZCTEOSA-N	1	0	254.377	4.069	20	30		CIEDRO
Cc1ccc2c(c1)[C@@H]([NH2+][C@@H]1CCC[C@H](C#N)C1)CCC2	ZINC000193060720	333242396	/nfs/dbraw/zinc/24/23/96/333242396.db2.gz	SLQPIERHLMZDDU-LESCRADOSA-N	1	0	268.404	4.044	20	30		CIEDRO
Cc1ccccc1[C@@H](C)[N@H+](C)Cc1cccc(C#N)c1	ZINC000193426269	333249799	/nfs/dbraw/zinc/24/97/99/333249799.db2.gz	GTMVQFOWKLUYEC-OAHLLOKOSA-N	1	0	264.372	4.060	20	30		CIEDRO
C=CCCCCC[NH2+]C1(c2ccc(F)cc2)CCOCC1	ZINC000193425761	333249888	/nfs/dbraw/zinc/24/98/88/333249888.db2.gz	TULYEDPFMDMPNB-UHFFFAOYSA-N	1	0	291.410	4.167	20	30		CIEDRO
C=CCCCCC[NH2+][C@H](c1ncc(C)s1)C1CC1	ZINC000193548663	333252784	/nfs/dbraw/zinc/25/27/84/333252784.db2.gz	AWHVGWRYJUOXRB-AWEZNQCLSA-N	1	0	264.438	4.239	20	30		CIEDRO
CC(C)(C)[C@H]([NH2+]Cc1ccccc1C#N)c1ccccc1	ZINC000226190950	333253591	/nfs/dbraw/zinc/25/35/91/333253591.db2.gz	HOCNAUQUTWXUCM-GOSISDBHSA-N	1	0	278.399	4.435	20	30		CIEDRO
C=C(C)C[N@@H+](C)[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000195732511	333262616	/nfs/dbraw/zinc/26/26/16/333262616.db2.gz	ABSVDMUGFNMUKS-LLVKDONJSA-N	1	0	257.299	4.274	20	30		CIEDRO
C=CCSCC[NH2+]C1c2ccccc2-c2ccccc21	ZINC000226728803	333268513	/nfs/dbraw/zinc/26/85/13/333268513.db2.gz	NSPQEYFCIRKDBD-UHFFFAOYSA-N	1	0	281.424	4.265	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@@H]2CCC[C@H](SC)C2)cc1	ZINC000227378285	333282129	/nfs/dbraw/zinc/28/21/29/333282129.db2.gz	SPENKLIPZZWLFR-WBVHZDCISA-N	1	0	291.460	4.015	20	30		CIEDRO
C=CCOc1ccc(C[NH2+][C@H]2CCC[C@@H](SC)C2)cc1	ZINC000227378277	333282202	/nfs/dbraw/zinc/28/22/02/333282202.db2.gz	SPENKLIPZZWLFR-DOTOQJQBSA-N	1	0	291.460	4.015	20	30		CIEDRO
C=C(C[NH2+]Cc1c(Cl)cccc1OC)c1ccccc1	ZINC000227600279	333286468	/nfs/dbraw/zinc/28/64/68/333286468.db2.gz	HYPLJRBUFLRKMG-UHFFFAOYSA-N	1	0	287.790	4.152	20	30		CIEDRO
C[C@@H]1C[C@@H](c2ccccc2)C[N@@H+]1Cc1ccc(F)cc1C#N	ZINC000522469818	333287623	/nfs/dbraw/zinc/28/76/23/333287623.db2.gz	QNQGKGXCUBODBI-RDTXWAMCSA-N	1	0	294.373	4.075	20	30		CIEDRO
C[C@H]1C[C@H](c2ccccc2)C[N@@H+]1Cc1cc(C#N)ccc1F	ZINC000522471010	333287628	/nfs/dbraw/zinc/28/76/28/333287628.db2.gz	YXQFCVNCIGTKLO-YOEHRIQHSA-N	1	0	294.373	4.075	20	30		CIEDRO
C[C@@H]1C[C@@H](c2ccccc2)C[N@@H+]1Cc1cc(C#N)ccc1F	ZINC000522471008	333287733	/nfs/dbraw/zinc/28/77/33/333287733.db2.gz	YXQFCVNCIGTKLO-RHSMWYFYSA-N	1	0	294.373	4.075	20	30		CIEDRO
CC(C)(CCc1ccccc1)[NH2+]CC#Cc1ccccc1	ZINC000229291919	333303253	/nfs/dbraw/zinc/30/32/53/333303253.db2.gz	UNFPUBHXJJDYMQ-UHFFFAOYSA-N	1	0	277.411	4.039	20	30		CIEDRO
Cc1ccc(C)c([C@H](C)[NH2+]CC(C)(C)CCC#N)c1	ZINC000229686032	333307814	/nfs/dbraw/zinc/30/78/14/333307814.db2.gz	JXRJFLVZVMGSED-HNNXBMFYSA-N	1	0	258.409	4.284	20	30		CIEDRO
CCCC1CCC([NH2+]CC(C)(C)CCC#N)CC1	ZINC000229693522	333308015	/nfs/dbraw/zinc/30/80/15/333308015.db2.gz	QHMSMDPGNDMBJH-UHFFFAOYSA-N	1	0	250.430	4.265	20	30		CIEDRO
C=CC1CC[NH+](Cc2ccccc2C(F)(F)F)CC1	ZINC000523607631	333334013	/nfs/dbraw/zinc/33/40/13/333334013.db2.gz	NFCSKLKRBCSFHR-UHFFFAOYSA-N	1	0	269.310	4.103	20	30		CIEDRO
CC(C)[C@@H](c1ccccc1)[N@H+](C)Cc1ccc(C#N)cc1	ZINC000303507573	333343127	/nfs/dbraw/zinc/34/31/27/333343127.db2.gz	NKBWWYAMYXNCTQ-IBGZPJMESA-N	1	0	278.399	4.387	20	30		CIEDRO
C[C@@H]1C[C@H](c2ccc(F)cc2)C[N@@H+]1Cc1ccc(C#N)cc1	ZINC000524072054	333353008	/nfs/dbraw/zinc/35/30/08/333353008.db2.gz	STISWJNIAAWTJG-KDOFPFPSSA-N	1	0	294.373	4.075	20	30		CIEDRO
CC[C@@H]1CCCC[C@@H]1[NH2+]CCCCC(C)(C)C#N	ZINC000233904150	333356027	/nfs/dbraw/zinc/35/60/27/333356027.db2.gz	MHZLDLXWMPNPJT-CABCVRRESA-N	1	0	250.430	4.265	20	30		CIEDRO
CC[C@H]([NH2+]CCCCC(C)(C)C#N)c1ccccc1	ZINC000234041008	333357486	/nfs/dbraw/zinc/35/74/86/333357486.db2.gz	SLXULMNOELTPAP-INIZCTEOSA-N	1	0	258.409	4.447	20	30		CIEDRO
COc1ccc([C@H](C)[NH2+]CCCCC(C)(C)C#N)cc1	ZINC000234903714	333362958	/nfs/dbraw/zinc/36/29/58/333362958.db2.gz	FTSDUUPLXNNOIN-AWEZNQCLSA-N	1	0	274.408	4.066	20	30		CIEDRO
C=CC[C@H](C)[NH2+]Cc1ccc(Br)c(Cl)c1	ZINC000235071055	333365812	/nfs/dbraw/zinc/36/58/12/333365812.db2.gz	JJDFTSWTTZGZLU-VIFPVBQESA-N	1	0	288.616	4.157	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CC(C)(C)C[C@@H]1C)c1ccc(C#N)cc1	ZINC000235539740	333370607	/nfs/dbraw/zinc/37/06/07/333370607.db2.gz	ZJXSONUVZUQYEF-XEZPLFJOSA-N	1	0	256.393	4.034	20	30		CIEDRO
N#CCCCC[NH2+]Cc1ccc(OCc2ccccc2)cc1	ZINC000237817036	333381674	/nfs/dbraw/zinc/38/16/74/333381674.db2.gz	WAOHLAGBVBJBEP-UHFFFAOYSA-N	1	0	294.398	4.049	20	30		CIEDRO
C[C@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2cccc(C#N)c2)C1	ZINC000524755140	333386696	/nfs/dbraw/zinc/38/66/96/333386696.db2.gz	QEGPYDJTHCAHGU-IFXJQAMLSA-N	1	0	294.373	4.280	20	30		CIEDRO
C=CCC[N@@H+](C)[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000524811962	333389295	/nfs/dbraw/zinc/38/92/95/333389295.db2.gz	UDJCTLCHASGDCG-NSHDSACASA-N	1	0	257.299	4.274	20	30		CIEDRO
CC[C@@H]1CCCC[C@@H]1[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000037031973	333465945	/nfs/dbraw/zinc/46/59/45/333465945.db2.gz	CAXLUBYVBRSBEU-LXZKKBNFSA-N	1	0	256.393	4.178	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(-c2ccccc2)s1	ZINC000061892233	333474971	/nfs/dbraw/zinc/47/49/71/333474971.db2.gz	JKIIPZGQDXCMAQ-HOCLYGCPSA-N	1	0	282.412	4.197	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(-c2ccccc2)s1	ZINC000061892232	333475054	/nfs/dbraw/zinc/47/50/54/333475054.db2.gz	JKIIPZGQDXCMAQ-GOEBONIOSA-N	1	0	282.412	4.197	20	30		CIEDRO
C[C@@H]([NH2+]CCc1ccc(Cl)cc1)c1cccc(C#N)c1	ZINC000037218283	333516034	/nfs/dbraw/zinc/51/60/34/333516034.db2.gz	WPHLSARXUDOBLL-CYBMUJFWSA-N	1	0	284.790	4.105	20	30		CIEDRO
Cc1ccccc1C[C@@H](C)[NH2+][C@H](C)c1cccc(C#N)c1	ZINC000037777165	333539362	/nfs/dbraw/zinc/53/93/62/333539362.db2.gz	VAVPCXMBMBMZHR-HZPDHXFCSA-N	1	0	278.399	4.149	20	30		CIEDRO
N#Cc1ccccc1C[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1	ZINC000530359588	333544322	/nfs/dbraw/zinc/54/43/22/333544322.db2.gz	YAXJBIYOHLRDDL-FXAWDEMLSA-N	1	0	290.410	4.059	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@@H](CC)[C@@H]1CCOC1)c1ccccc1	ZINC000537946015	333549091	/nfs/dbraw/zinc/54/90/91/333549091.db2.gz	IYBRDAMWMKCLCF-SQNIBIBYSA-N	1	0	273.420	4.099	20	30		CIEDRO
C=C(C)COCC[NH2+][C@H](C)c1ccc(Cl)cc1Cl	ZINC000125632611	333568590	/nfs/dbraw/zinc/56/85/90/333568590.db2.gz	XIEYBXGDSGBJEB-LLVKDONJSA-N	1	0	288.218	4.237	20	30		CIEDRO
COc1ccc([C@@H](C)[NH2+]CC#Cc2cccc(Cl)c2)cc1	ZINC000538128478	333576063	/nfs/dbraw/zinc/57/60/63/333576063.db2.gz	DNPBSEPABPJDMF-CQSZACIVSA-N	1	0	299.801	4.051	20	30		CIEDRO
C=C(CC)C[NH2+][C@@H](C)c1ccc(-c2ccncc2)cc1	ZINC000538237044	333580635	/nfs/dbraw/zinc/58/06/35/333580635.db2.gz	GYUAEHZWVGVSSM-HNNXBMFYSA-N	1	0	266.388	4.365	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]2c2ccccc2)s1	ZINC000538403599	333589105	/nfs/dbraw/zinc/58/91/05/333589105.db2.gz	MYXHFLUMQAXHLV-IAGOWNOFSA-N	1	0	282.412	4.046	20	30		CIEDRO
C=C(C)COCC[NH2+][C@@H](C)c1cc2cc(Cl)ccc2o1	ZINC000538409821	333589464	/nfs/dbraw/zinc/58/94/64/333589464.db2.gz	YPDQFISJSDYCFJ-LBPRGKRZSA-N	1	0	293.794	4.330	20	30		CIEDRO
Cc1cccc([C@@H](C)C[NH2+][C@@H](C)c2ccc(C#N)c(F)c2)c1	ZINC000538506927	333600902	/nfs/dbraw/zinc/60/09/02/333600902.db2.gz	MTDCGWMEDCMSCY-GJZGRUSLSA-N	1	0	296.389	4.460	20	30		CIEDRO
CCC[C@H]([NH2+]CCC(C)(C)C#N)C1CCCCC1	ZINC000538512254	333602181	/nfs/dbraw/zinc/60/21/81/333602181.db2.gz	ILXLHILRZXPLAQ-HNNXBMFYSA-N	1	0	250.430	4.265	20	30		CIEDRO
C=CCCC[C@@H](C)[NH+]1CCN(C/C=C/c2ccccc2)CC1	ZINC000539197468	333660463	/nfs/dbraw/zinc/66/04/63/333660463.db2.gz	IPDDTIVHQNAZLI-XWGMLZDCSA-N	1	0	298.474	4.062	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CC[C@@H]3CCCC[C@@H]3C2)s1	ZINC000539416696	333670563	/nfs/dbraw/zinc/67/05/63/333670563.db2.gz	XDERYAGSMTUINY-BFHYXJOUSA-N	1	0	274.433	4.068	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@@H]2CC[C@H]3CCCC[C@H]3C2)s1	ZINC000539416698	333670652	/nfs/dbraw/zinc/67/06/52/333670652.db2.gz	XDERYAGSMTUINY-HZSPNIEDSA-N	1	0	274.433	4.068	20	30		CIEDRO
CCC(CC)[C@H]([NH2+]CC1(C#N)CC1)c1ccccc1	ZINC000539490382	333673287	/nfs/dbraw/zinc/67/32/87/333673287.db2.gz	AIQMFULQIMIRDS-INIZCTEOSA-N	1	0	256.393	4.057	20	30		CIEDRO
N#CC1(C[NH2+][C@H](c2ccc(Cl)cc2)C2CCC2)CC1	ZINC000539491993	333673498	/nfs/dbraw/zinc/67/34/98/333673498.db2.gz	WSOMIRALKHMGFF-HNNXBMFYSA-N	1	0	274.795	4.075	20	30		CIEDRO
CC(C)Cc1ccc([C@H]([NH2+]CCCC#N)C2CC2)cc1	ZINC000539492988	333673523	/nfs/dbraw/zinc/67/35/23/333673523.db2.gz	DVVFPXVUJPHEIR-SFHVURJKSA-N	1	0	270.420	4.230	20	30		CIEDRO
CCC[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(C#N)s1	ZINC000539494368	333673767	/nfs/dbraw/zinc/67/37/67/333673767.db2.gz	HUFFZYRJVFTADZ-DOMZBBRYSA-N	1	0	262.422	4.068	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@H]2CCC[C@@H]2C1)c1cccc(C#N)c1	ZINC000539497559	333674231	/nfs/dbraw/zinc/67/42/31/333674231.db2.gz	LJLDXOIGCRTGQQ-PAYONLEZSA-N	1	0	268.404	4.178	20	30		CIEDRO
Cc1cccc2c1CC[C@@H]2[NH2+][C@@H](C)c1ccc(C#N)cc1	ZINC000539508496	333675046	/nfs/dbraw/zinc/67/50/46/333675046.db2.gz	OQDXRUBCTMGGKL-LIRRHRJNSA-N	1	0	276.383	4.205	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCCCC1(C)C)c1ccc(C#N)c(F)c1	ZINC000539610272	333681084	/nfs/dbraw/zinc/68/10/84/333681084.db2.gz	SZGOUHUQFAPOGZ-LRDDRELGSA-N	1	0	274.383	4.317	20	30		CIEDRO
CC[C@H]([NH2+]CCC(C)(C)C#N)c1ccc(Cl)cc1	ZINC000539612752	333681369	/nfs/dbraw/zinc/68/13/69/333681369.db2.gz	AFTZMHGGTUHMSM-AWEZNQCLSA-N	1	0	264.800	4.321	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@H](C)c1cccc(Br)c1	ZINC000128680791	333698155	/nfs/dbraw/zinc/69/81/55/333698155.db2.gz	GKXQALNXLJTMCX-GHMZBOCLSA-N	1	0	268.198	4.064	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+]Cc1cn(CCCCC)nc1C	ZINC000540141229	333712104	/nfs/dbraw/zinc/71/21/04/333712104.db2.gz	GIDQMWZZUDTPBZ-GJZGRUSLSA-N	1	0	277.456	4.072	20	30		CIEDRO
C=CCC[C@@H]([NH2+][C@@H](CC)C1CCOCC1)c1ccccc1	ZINC000540147433	333712704	/nfs/dbraw/zinc/71/27/04/333712704.db2.gz	VHKONEBUKMNITK-RBUKOAKNSA-N	1	0	287.447	4.489	20	30		CIEDRO
C=CCCC[NH2+][C@H](C)c1ccc(OC(C)C)c(OC)c1	ZINC000540355164	333726943	/nfs/dbraw/zinc/72/69/43/333726943.db2.gz	XQVTYLZVVQXCBL-CQSZACIVSA-N	1	0	277.408	4.099	20	30		CIEDRO
C[C@H]([NH2+]CC#Cc1ccccc1Cl)c1ccccc1	ZINC000540404027	333728658	/nfs/dbraw/zinc/72/86/58/333728658.db2.gz	NDWSZXUMHZDMBL-AWEZNQCLSA-N	1	0	269.775	4.042	20	30		CIEDRO
N#Cc1ccc(C[NH2+][C@H]2CCCC[C@@H]2c2ccccc2)s1	ZINC000540575304	333735733	/nfs/dbraw/zinc/73/57/33/333735733.db2.gz	PPOVBPMOKGPYNP-MSOLQXFVSA-N	1	0	296.439	4.436	20	30		CIEDRO
C[C@@H]([NH2+]CC(C)(C)c1ccccc1F)c1cccc(C#N)c1	ZINC000540594156	333736795	/nfs/dbraw/zinc/73/67/95/333736795.db2.gz	ZETVAKRRWZKJFN-CQSZACIVSA-N	1	0	296.389	4.326	20	30		CIEDRO
CC(C)(C#N)CC[NH2+][C@@H](c1ccccc1)c1ccc(F)cc1	ZINC000540665760	333741026	/nfs/dbraw/zinc/74/10/26/333741026.db2.gz	SMYIOTKSSRXECT-SFHVURJKSA-N	1	0	296.389	4.445	20	30		CIEDRO
C[C@H]([NH2+]C1(c2ccc(F)cc2)CC1)c1ccc(C#N)c(F)c1	ZINC000540752872	333745654	/nfs/dbraw/zinc/74/56/54/333745654.db2.gz	KNDGEGFDFPIVOW-LBPRGKRZSA-N	1	0	298.336	4.176	20	30		CIEDRO
C=CCSCC[NH2+][C@H](C)c1ccc(SC)c(F)c1	ZINC000540968720	333756029	/nfs/dbraw/zinc/75/60/29/333756029.db2.gz	KPDCTVHKXLPXMS-LLVKDONJSA-N	1	0	285.453	4.117	20	30		CIEDRO
C=CCC[C@@H](C)[NH2+]CC#Cc1ccc(C(F)(F)F)cc1	ZINC000542667793	333835275	/nfs/dbraw/zinc/83/52/75/333835275.db2.gz	YXGXPRYEDPIOIT-CYBMUJFWSA-N	1	0	281.321	4.001	20	30		CIEDRO
C=CCC[C@H](C)[NH2+][C@H]1CCc2[nH]c3ccc(C)cc3c2C1	ZINC000542679093	333836006	/nfs/dbraw/zinc/83/60/06/333836006.db2.gz	HYOWODULCPWPLG-GJZGRUSLSA-N	1	0	282.431	4.278	20	30		CIEDRO
C=CCCC[NH2+][C@@H](C)c1oc2ccc(OC)cc2c1C	ZINC000543514058	333878851	/nfs/dbraw/zinc/87/88/51/333878851.db2.gz	ZSFRADSGJAHNNZ-ZDUSSCGKSA-N	1	0	273.376	4.367	20	30		CIEDRO
C[C@H](C#N)C[NH2+][C@@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000543620963	333885084	/nfs/dbraw/zinc/88/50/84/333885084.db2.gz	YTKFECRESVTNRZ-BYCMXARLSA-N	1	0	296.336	4.091	20	30		CIEDRO
C=C(C)C[NH2+][C@H](C)[C@@H](C)c1ccccc1C(F)(F)F	ZINC000544461457	333932525	/nfs/dbraw/zinc/93/25/25/333932525.db2.gz	FRHSYJFIJSDNSC-VXGBXAGGSA-N	1	0	271.326	4.363	20	30		CIEDRO
COc1ccc(C#N)cc1C[NH2+][C@@H](C)c1c(C)cccc1C	ZINC000545519963	333986046	/nfs/dbraw/zinc/98/60/46/333986046.db2.gz	WRJZXCSLLPYXOB-HNNXBMFYSA-N	1	0	294.398	4.035	20	30		CIEDRO
CC[C@@H](Cc1ccc(Cl)cc1Cl)[NH2+]C[C@H](C)C#N	ZINC000133035266	334013728	/nfs/dbraw/zinc/01/37/28/334013728.db2.gz	AHXDIAUPTHOWBE-MFKMUULPSA-N	1	0	285.218	4.064	20	30		CIEDRO
Cc1cccc(C)c1[C@H](C)[NH2+]Cc1cccc(C#N)c1	ZINC000546171301	334018183	/nfs/dbraw/zinc/01/81/83/334018183.db2.gz	BYDPASDUDSCQBJ-HNNXBMFYSA-N	1	0	264.372	4.026	20	30		CIEDRO
C[C@@H]1CC[C@H]([NH2+]Cc2ccc(CC#N)cc2)c2ccccc21	ZINC000576226717	335173717	/nfs/dbraw/zinc/17/37/17/335173717.db2.gz	SNOVUWFBNAFRGJ-QRWLVFNGSA-N	1	0	290.410	4.481	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1C[C@H](c2ccccc2)[C@@H]1C)c1ccc(C#N)cc1	ZINC000546621105	334040940	/nfs/dbraw/zinc/04/09/40/334040940.db2.gz	YTZRWAYHTMGVKC-HZVDNRATSA-N	1	0	290.410	4.401	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@H]2CCC[C@H]2c2ccc(F)cc2)c1	ZINC000546658636	334044230	/nfs/dbraw/zinc/04/42/30/334044230.db2.gz	DQWGANNGIXRAMR-OALUTQOASA-N	1	0	294.373	4.123	20	30		CIEDRO
CC[C@H](CC(F)(F)F)[NH2+][C@H](C)c1ccc(C#N)c(F)c1	ZINC000546870534	334052605	/nfs/dbraw/zinc/05/26/05/334052605.db2.gz	JFUOHIGEXIYXFQ-BXKDBHETSA-N	1	0	288.288	4.079	20	30		CIEDRO
Cc1cccc(C)c1[C@@H](C)[NH2+]Cc1ccc(C#N)cc1	ZINC000546883171	334053655	/nfs/dbraw/zinc/05/36/55/334053655.db2.gz	CVOSBEMMEGPAEY-OAHLLOKOSA-N	1	0	264.372	4.026	20	30		CIEDRO
CC(C)[C@@H](C[NH2+]Cc1cc(C#N)cs1)c1ccccc1	ZINC000236694435	334065283	/nfs/dbraw/zinc/06/52/83/334065283.db2.gz	GIULPBIAWVMTTI-QGZVFWFLSA-N	1	0	284.428	4.149	20	30		CIEDRO
CCC[C@H](Cc1ccccc1)[NH2+]Cc1cc(C#N)cs1	ZINC000237032825	334079843	/nfs/dbraw/zinc/07/98/43/334079843.db2.gz	NUUKLOSRJJKIDM-MRXNPFEDSA-N	1	0	284.428	4.121	20	30		CIEDRO
C=CC[C@H](CO)[NH2+][C@@H](C)c1ccc(-c2ccccc2)s1	ZINC000547393068	334085233	/nfs/dbraw/zinc/08/52/33/334085233.db2.gz	BTEFCYANEKHNDN-DZGCQCFKSA-N	1	0	287.428	4.003	20	30		CIEDRO
C[C@@H](CC(C)(C)c1ccccc1)[NH2+]Cc1cc(C#N)cs1	ZINC000237419878	334088635	/nfs/dbraw/zinc/08/86/35/334088635.db2.gz	KCRSJUJPJQLVOM-AWEZNQCLSA-N	1	0	298.455	4.466	20	30		CIEDRO
C=CCOc1ccc(C[NH2+]C2(c3ccccc3F)CC2)cc1	ZINC000076767045	334088644	/nfs/dbraw/zinc/08/86/44/334088644.db2.gz	QQRRKKKOQKGFSD-UHFFFAOYSA-N	1	0	297.373	4.169	20	30		CIEDRO
N#Cc1cccc(C[NH2+]CCc2ccc3ccccc3c2)c1	ZINC000237846252	334100344	/nfs/dbraw/zinc/10/03/44/334100344.db2.gz	IINLIGWWKGJPTE-UHFFFAOYSA-N	1	0	286.378	4.044	20	30		CIEDRO
C=CC[C@@H](C)[NH2+]Cc1ccc(-c2ccccc2)cc1	ZINC000134749899	334102946	/nfs/dbraw/zinc/10/29/46/334102946.db2.gz	OZUBFLRRDSTFCB-OAHLLOKOSA-N	1	0	251.373	4.408	20	30		CIEDRO
CC(C)(C)[C@@H]([NH2+]Cc1ccc(C#N)o1)c1ccccc1	ZINC000135146633	334117790	/nfs/dbraw/zinc/11/77/90/334117790.db2.gz	IQDNHUQHUDDMIS-INIZCTEOSA-N	1	0	268.360	4.028	20	30		CIEDRO
C[C@@H]([N@H+](C)Cc1ccccc1C(C)(C)C#N)C1(C)CC1	ZINC000135281098	334123373	/nfs/dbraw/zinc/12/33/73/334123373.db2.gz	BNPZJOJPBUMOIH-CQSZACIVSA-N	1	0	270.420	4.108	20	30		CIEDRO
C[C@H](C[NH2+][C@@H](C)c1ccc(C#N)cc1)Cc1ccccc1	ZINC000547846395	334126768	/nfs/dbraw/zinc/12/67/68/334126768.db2.gz	ZSFHSUOLWGUMJW-HOTGVXAUSA-N	1	0	278.399	4.088	20	30		CIEDRO
N#CCCCC[N@@H+]1CCC[C@H]1CCCc1ccccc1	ZINC000135357344	334127282	/nfs/dbraw/zinc/12/72/82/334127282.db2.gz	RKUQXVPWJBNASD-GOSISDBHSA-N	1	0	270.420	4.168	20	30		CIEDRO
C[C@H]([NH2+]Cc1cccc(Cl)c1F)c1ccc(C#N)cc1	ZINC000135376058	334128212	/nfs/dbraw/zinc/12/82/12/334128212.db2.gz	WIDYVDRRJHVGTM-NSHDSACASA-N	1	0	288.753	4.202	20	30		CIEDRO
C[C@@H]([NH2+]Cc1ccc(C#N)s1)c1ccc(Cl)cc1	ZINC000135667398	334135721	/nfs/dbraw/zinc/13/57/21/334135721.db2.gz	YHXDVBPTGVTTKX-SNVBAGLBSA-N	1	0	276.792	4.124	20	30		CIEDRO
CC[C@@H](CC#N)[NH2+][C@H](C)CCc1cccc(C(F)(F)F)c1	ZINC000136958848	334166067	/nfs/dbraw/zinc/16/60/67/334166067.db2.gz	BLNBRVJCRSOAMV-DOMZBBRYSA-N	1	0	298.352	4.308	20	30		CIEDRO
C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+]Cc1cccc(C#N)c1	ZINC000080339830	334170717	/nfs/dbraw/zinc/17/07/17/334170717.db2.gz	IUOQPIPJLTYDEW-BFUOFWGJSA-N	1	0	294.373	4.111	20	30		CIEDRO
Cc1ccc(CCC[NH2+][C@@H](C)c2ccc(C#N)cc2)cc1	ZINC000548932869	334180811	/nfs/dbraw/zinc/18/08/11/334180811.db2.gz	GIFANGFRRBNMAF-INIZCTEOSA-N	1	0	278.399	4.150	20	30		CIEDRO
C[C@@H]1CC[N@H+](CCCC(C)(C)C#N)[C@@H](c2ccco2)C1	ZINC000245409365	334190522	/nfs/dbraw/zinc/19/05/22/334190522.db2.gz	LWKMKFXYWTYCBA-HUUCEWRRSA-N	1	0	274.408	4.383	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([N@@H+]2CCC[C@H](c3ccc(F)cc3)CC2)C1	ZINC000549537858	334196775	/nfs/dbraw/zinc/19/67/75/334196775.db2.gz	MILUNVIOGKRQEH-VKJFTORMSA-N	1	0	286.394	4.087	20	30		CIEDRO
C=C(C)[C@@H]([NH2+]CCC1(OC)CCC1)c1ccc(F)c(F)c1	ZINC000549552590	334197738	/nfs/dbraw/zinc/19/77/38/334197738.db2.gz	DVBOQPLJAFVSDE-MRXNPFEDSA-N	1	0	295.373	4.131	20	30		CIEDRO
C=CCC(C)(C)C[NH2+][C@H]1CCN([C@H](C)c2ccccc2)C1	ZINC000549833066	334206303	/nfs/dbraw/zinc/20/63/03/334206303.db2.gz	LWLFHGOHBFBYQC-AEFFLSMTSA-N	1	0	286.463	4.014	20	30		CIEDRO
N#C[C@@H]1CC[C@H]([N@@H+]2CCC[C@@H](CCCc3ccccc3)C2)C1	ZINC000549915240	334208359	/nfs/dbraw/zinc/20/83/59/334208359.db2.gz	CCQVVPRXYZIHQS-AQNXPRMDSA-N	1	0	296.458	4.414	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CC[C@@H](C#N)C1)c1cc(Cl)ccc1Cl	ZINC000549938738	334209857	/nfs/dbraw/zinc/20/98/57/334209857.db2.gz	IJUWYGBFBJITCX-HOSYDEDBSA-N	1	0	283.202	4.336	20	30		CIEDRO
C[C@@H]([NH2+]C[C@@H](c1ccccc1)C1CC1)c1ccc(C#N)cc1	ZINC000550846852	334230133	/nfs/dbraw/zinc/23/01/33/334230133.db2.gz	ISNVTFTXZIHXRH-QRWLVFNGSA-N	1	0	290.410	4.403	20	30		CIEDRO
C[C@@H]([NH2+]Cc1cccc(C#N)c1F)c1cccc(C2CC2)c1	ZINC000551176257	334239956	/nfs/dbraw/zinc/23/99/56/334239956.db2.gz	VSLSCSFQBHJDSS-CYBMUJFWSA-N	1	0	294.373	4.426	20	30		CIEDRO
C=CC[C@H](C)[C@@H](C)[NH2+]CCc1ccc(Cl)c(OC)c1	ZINC000551305040	334244948	/nfs/dbraw/zinc/24/49/48/334244948.db2.gz	SCSXPKHNCOJKQT-QWHCGFSZSA-N	1	0	281.827	4.081	20	30		CIEDRO
C=CC[C@H](C)[C@H](C)[NH2+]CCc1ccc(Cl)c(OC)c1	ZINC000551305041	334244952	/nfs/dbraw/zinc/24/49/52/334244952.db2.gz	SCSXPKHNCOJKQT-STQMWFEESA-N	1	0	281.827	4.081	20	30		CIEDRO
C=CCC[C@@H]([NH2+][C@H](C)c1ccnc(OC)c1)c1ccccc1	ZINC000551314901	334246656	/nfs/dbraw/zinc/24/66/56/334246656.db2.gz	IGCNYRWQUBKCJC-CRAIPNDOSA-N	1	0	296.414	4.448	20	30		CIEDRO
CC(C)c1ccc2c(c1)[C@H]([NH2+]C[C@@H](C#N)CCC#N)CCC2	ZINC000551527481	334252533	/nfs/dbraw/zinc/25/25/33/334252533.db2.gz	AHGZWPJDKMCBLN-DNVCBOLYSA-N	1	0	295.430	4.221	20	30		CIEDRO
CC1(C)CC[C@H]1[NH2+]C1CCC(Oc2ccccc2C#N)CC1	ZINC000551535552	334253302	/nfs/dbraw/zinc/25/33/02/334253302.db2.gz	ZAMADMMJAOHBEI-LEOMRAHMSA-N	1	0	298.430	4.026	20	30		CIEDRO
CC(C)=CCC[C@@H](C)[NH2+]C1(c2cccc(C#N)c2)CC1	ZINC000551572593	334254770	/nfs/dbraw/zinc/25/47/70/334254770.db2.gz	SBNWVSUBGGESQK-OAHLLOKOSA-N	1	0	268.404	4.272	20	30		CIEDRO
CC[C@H](C[NH2+]C1(c2cccc(C#N)c2)CC1)c1ccccc1	ZINC000551832705	334263758	/nfs/dbraw/zinc/26/37/58/334263758.db2.gz	CIUKDNNBPVEABZ-QGZVFWFLSA-N	1	0	290.410	4.331	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCc1csc(CC)n1)c1ccco1	ZINC000552045108	334280810	/nfs/dbraw/zinc/28/08/10/334280810.db2.gz	YICNRKTVBDCGNJ-AWEZNQCLSA-N	1	0	290.432	4.138	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCc1c(F)cccc1F)c1ccco1	ZINC000552049615	334281569	/nfs/dbraw/zinc/28/15/69/334281569.db2.gz	ZNDTYZZHGYYLRC-INIZCTEOSA-N	1	0	291.341	4.397	20	30		CIEDRO
C=CCC[C@H]([NH2+]C[C@](C)(O)C1CCCCC1)c1ccco1	ZINC000552068185	334285274	/nfs/dbraw/zinc/28/52/74/334285274.db2.gz	MIMDSGLNMKLKLD-WMZOPIPTSA-N	1	0	291.435	4.208	20	30		CIEDRO
C=CCC[C@H](C)[NH2+]Cc1ccncc1OCc1ccccc1	ZINC000552091808	334288435	/nfs/dbraw/zinc/28/84/35/334288435.db2.gz	YTVLYHCDGOYKPO-INIZCTEOSA-N	1	0	296.414	4.105	20	30		CIEDRO
C=C(C)CN1CCC([NH2+][C@@H](CC)c2cccc(C)c2)CC1	ZINC000552251383	334308804	/nfs/dbraw/zinc/30/88/04/334308804.db2.gz	UWJRNJAFRCVWBG-IBGZPJMESA-N	1	0	286.463	4.076	20	30		CIEDRO
CCC[C@@H]1[C@@H](C)CCC[N@@H+]1CC(C)(C)CCC#N	ZINC000552301446	334314772	/nfs/dbraw/zinc/31/47/72/334314772.db2.gz	BZNHVAOOQBCQKT-LSDHHAIUSA-N	1	0	250.430	4.217	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)c1c(F)cccc1Cl	ZINC000248727828	334314992	/nfs/dbraw/zinc/31/49/92/334314992.db2.gz	CYHVFGOYLCYKRJ-QJPTWQEYSA-N	1	0	280.774	4.212	20	30		CIEDRO
N#Cc1ccc(C[N@H+]2CC[C@H](c3cccc(Cl)c3)C2)cc1	ZINC000552316870	334316162	/nfs/dbraw/zinc/31/61/62/334316162.db2.gz	QDZFFQJEUCMELC-KRWDZBQOSA-N	1	0	296.801	4.201	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@H](c2ccccc2)C2CCC2)C1	ZINC000248811324	334317881	/nfs/dbraw/zinc/31/78/81/334317881.db2.gz	KOJXVNIRAWZCOK-FHLIZLRMSA-N	1	0	268.404	4.200	20	30		CIEDRO
N#C[C@@H]1CCC[C@H]([NH2+][C@@H](c2ccccc2)C2CCC2)C1	ZINC000248811327	334317998	/nfs/dbraw/zinc/31/79/98/334317998.db2.gz	KOJXVNIRAWZCOK-JLSDUUJJSA-N	1	0	268.404	4.200	20	30		CIEDRO
C=CCC[C@@H]([NH2+]CC1(C(F)(F)F)CC1)c1ccco1	ZINC000552337423	334318275	/nfs/dbraw/zinc/31/82/75/334318275.db2.gz	UBKFRRBPLIRJRV-LLVKDONJSA-N	1	0	273.298	4.219	20	30		CIEDRO
C=CCC[C@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)c1ccccc1	ZINC000248907150	334321497	/nfs/dbraw/zinc/32/14/97/334321497.db2.gz	UYIKUEXGJGQVBI-NJAFHUGGSA-N	1	0	268.404	4.366	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)c1ccc(C(F)(F)F)cc1	ZINC000248916191	334321859	/nfs/dbraw/zinc/32/18/59/334321859.db2.gz	WCHAFVMQHIVFRV-YWPYICTPSA-N	1	0	296.336	4.438	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCC[C@@H](C#N)C1)c1ccc(F)cc1Cl	ZINC000248938236	334322256	/nfs/dbraw/zinc/32/22/56/334322256.db2.gz	YOFSOOZKAJAKFT-LOWVWBTDSA-N	1	0	280.774	4.212	20	30		CIEDRO
C=C(C)[C@H]([NH2+][C@@H]1CCC[C@@H](C#N)C1)c1ccc(F)c(F)c1	ZINC000249048931	334325817	/nfs/dbraw/zinc/32/58/17/334325817.db2.gz	WZFIFZTVUUYEGR-MRRJBJDNSA-N	1	0	290.357	4.254	20	30		CIEDRO
CC[C@H](CSc1ccccc1)[NH2+][C@@H]1CCC[C@@H](C#N)C1	ZINC000249052846	334325958	/nfs/dbraw/zinc/32/59/58/334325958.db2.gz	XZROQYLKRPABQY-BZUAXINKSA-N	1	0	288.460	4.229	20	30		CIEDRO
N#C[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCSc3ccc(F)cc32)C1	ZINC000249053723	334325973	/nfs/dbraw/zinc/32/59/73/334325973.db2.gz	YBXFQYCPZGEAJS-UXIGCNINSA-N	1	0	290.407	4.035	20	30		CIEDRO
CC[N@H+](CCCC(C)(C)C#N)[C@@H]1CCCC[C@H]1C	ZINC000249332944	334332195	/nfs/dbraw/zinc/33/21/95/334332195.db2.gz	HTFXNEWTECWHMZ-HUUCEWRRSA-N	1	0	250.430	4.217	20	30		CIEDRO
C=CCC[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1	ZINC000089512508	334346089	/nfs/dbraw/zinc/34/60/89/334346089.db2.gz	SFPZPSZOIXTSSX-QGZVFWFLSA-N	1	0	296.370	4.392	20	30		CIEDRO
Fc1ccc(C#CC[NH2+]C2(c3cccc(Cl)c3)CC2)cc1	ZINC000552978110	334354275	/nfs/dbraw/zinc/35/42/75/334354275.db2.gz	BGYIYPVULUSJHW-UHFFFAOYSA-N	1	0	299.776	4.110	20	30		CIEDRO
C=CCCC[NH2+][C@H](C)c1cccc(OC(F)(F)F)c1	ZINC000553075472	334360022	/nfs/dbraw/zinc/36/00/22/334360022.db2.gz	OOKNDECHIIQQFD-LLVKDONJSA-N	1	0	273.298	4.202	20	30		CIEDRO
C[C@@H](CCc1ccco1)[NH2+][C@H]1CCCc2cc(C#N)ccc21	ZINC000553305608	334375761	/nfs/dbraw/zinc/37/57/61/334375761.db2.gz	WIMCQXRFPUOBRN-LIRRHRJNSA-N	1	0	294.398	4.140	20	30		CIEDRO
C=C(C)CN1CCC([NH2+][C@H](c2ccccc2)C(C)C)CC1	ZINC000091334284	334376448	/nfs/dbraw/zinc/37/64/48/334376448.db2.gz	CGZJWOZQLJEDJP-IBGZPJMESA-N	1	0	286.463	4.014	20	30		CIEDRO
CC[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1cccc(C#N)c1	ZINC000252423725	334379298	/nfs/dbraw/zinc/37/92/98/334379298.db2.gz	BCLJUCMFAYYXDD-FRFSOERESA-N	1	0	256.393	4.178	20	30		CIEDRO
CC[N@H+](CC1(C#N)CC1)C(c1ccccc1)c1ccccc1	ZINC000553608142	334393272	/nfs/dbraw/zinc/39/32/72/334393272.db2.gz	OEGXJMMFOIFWCO-UHFFFAOYSA-N	1	0	290.410	4.402	20	30		CIEDRO
C[C@H]([NH2+]Cc1cccc(Cl)c1)c1ccc(C#N)c(F)c1	ZINC000553767017	334398268	/nfs/dbraw/zinc/39/82/68/334398268.db2.gz	ZUWROKVNRTTYOH-NSHDSACASA-N	1	0	288.753	4.202	20	30		CIEDRO
CC[C@@H]1CCC[C@@H]([NH2+][C@H](C)c2ccc(C#N)c(F)c2)C1	ZINC000553791664	334398955	/nfs/dbraw/zinc/39/89/55/334398955.db2.gz	XXXLGQGJCJKRGV-XJKCOSOUSA-N	1	0	274.383	4.317	20	30		CIEDRO
COc1ccc([C@@H]([NH2+]CC(C)(C)CCC#N)C(C)C)cc1	ZINC000554065937	334408458	/nfs/dbraw/zinc/40/84/58/334408458.db2.gz	CVYMWMFQNVQCCY-KRWDZBQOSA-N	1	0	288.435	4.312	20	30		CIEDRO
C[C@@H]([NH2+]CC(C)(C)CCC#N)c1ccc(OC(F)F)cc1	ZINC000554360284	334424026	/nfs/dbraw/zinc/42/40/26/334424026.db2.gz	PBUOLEJEOSNDQW-GFCCVEGCSA-N	1	0	296.361	4.269	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H]1CCc2c1ccc(OC)c2F	ZINC000554739488	334450333	/nfs/dbraw/zinc/45/03/33/334450333.db2.gz	YIRILSMVTADWHN-DOMZBBRYSA-N	1	0	277.383	4.156	20	30		CIEDRO
C=CCC[C@@H](CC)[NH2+]CC(C)(C)c1ncccc1C	ZINC000554995162	334464010	/nfs/dbraw/zinc/46/40/10/334464010.db2.gz	WTQUKOTZLIKQGX-OAHLLOKOSA-N	1	0	260.425	4.002	20	30		CIEDRO
C=CCC[NH2+][C@H](C)c1ccc(OCCCC)c(OC)c1	ZINC000555054214	334466571	/nfs/dbraw/zinc/46/65/71/334466571.db2.gz	WCQFDQZSZDBLGF-CQSZACIVSA-N	1	0	277.408	4.101	20	30		CIEDRO
CC(C)=CCC[C@H](C)CC[NH+]1CCC(CC#N)CC1	ZINC000555419798	334477888	/nfs/dbraw/zinc/47/78/88/334477888.db2.gz	BZPWWPLQDIHDGR-INIZCTEOSA-N	1	0	262.441	4.385	20	30		CIEDRO
C[C@H]([NH2+][C@H]1C[C@H](c2ccc(F)cc2)C1)c1ccc(C#N)cc1	ZINC000556201760	334499732	/nfs/dbraw/zinc/49/97/32/334499732.db2.gz	IUEULAYFODDCIW-IXDGSTSKSA-N	1	0	294.373	4.294	20	30		CIEDRO
CC(C)(C)[C@@H]1CCC[C@@H]([NH2+]Cc2nc(C#N)cs2)CC1	ZINC000566038914	334617803	/nfs/dbraw/zinc/61/78/03/334617803.db2.gz	RBTHTPHPBGIYNY-CHWSQXEVSA-N	1	0	291.464	4.099	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)[C@@H]1C[C@H]1c1ccccc1	ZINC000567371487	334710029	/nfs/dbraw/zinc/71/00/29/334710029.db2.gz	ZVCPESVKNUPCFC-VZJWBNGJSA-N	1	0	290.410	4.401	20	30		CIEDRO
CC1(C)C[C@H]([NH2+]Cc2ccc(CC#N)cc2)c2ccccc21	ZINC000567385009	334711382	/nfs/dbraw/zinc/71/13/82/334711382.db2.gz	XDVQWXRKWIKPOG-IBGZPJMESA-N	1	0	290.410	4.265	20	30		CIEDRO
CC(C)(CCC#N)C[NH2+][C@@H]1CCCc2c3ccccc3[nH]c21	ZINC000567391873	334712015	/nfs/dbraw/zinc/71/20/15/334712015.db2.gz	VXHVFHDVCYKIRT-QGZVFWFLSA-N	1	0	295.430	4.465	20	30		CIEDRO
N#CCCC[NH2+][C@@H]1CCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000568072999	334790063	/nfs/dbraw/zinc/79/00/63/334790063.db2.gz	RXAAICOLZVLCBQ-HUUCEWRRSA-N	1	0	296.336	4.235	20	30		CIEDRO
C=CCCC[NH+]1CCC(c2noc3cc(F)ccc32)CC1	ZINC000568331764	334815835	/nfs/dbraw/zinc/81/58/35/334815835.db2.gz	PWODBJZFTGCOGU-UHFFFAOYSA-N	1	0	288.366	4.113	20	30		CIEDRO
C[C@@H]([NH2+][C@H]1CCc2ccc(C#N)cc21)c1cccc(F)c1F	ZINC000568451886	334825400	/nfs/dbraw/zinc/82/54/00/334825400.db2.gz	XJQMXWILSLIMLS-DIFFPNOSSA-N	1	0	298.336	4.175	20	30		CIEDRO
C=CC[C@H](CC)[NH2+][C@H](CC)c1ccc(OC)c(OC)c1	ZINC000343509552	335205827	/nfs/dbraw/zinc/20/58/27/335205827.db2.gz	RKYUCRHHHTYJJP-LSDHHAIUSA-N	1	0	277.408	4.099	20	30		CIEDRO
Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H]1CCc2ccc(C#N)cc21	ZINC000577108560	335301335	/nfs/dbraw/zinc/30/13/35/335301335.db2.gz	XXEOISPDSDNLKC-VQTJNVASSA-N	1	0	288.394	4.131	20	30		CIEDRO
C[C@H]([N@H+](C)Cc1ccc(C#N)cc1C(F)(F)F)C(C)(C)C	ZINC000577313564	335337934	/nfs/dbraw/zinc/33/79/34/335337934.db2.gz	SOWCJEREPHZXJR-NSHDSACASA-N	1	0	298.352	4.443	20	30		CIEDRO
Cc1cccc(C2([NH2+]Cc3ccc(C#N)s3)CCCC2)c1	ZINC000176961682	335345574	/nfs/dbraw/zinc/34/55/74/335345574.db2.gz	OMFASIKJRLYMJO-UHFFFAOYSA-N	1	0	296.439	4.487	20	30		CIEDRO
Cc1cc([C@@H](C)[NH2+]Cc2ccc(CC#N)cc2)c(C)s1	ZINC000347521024	335382925	/nfs/dbraw/zinc/38/29/25/335382925.db2.gz	ASWIMPXXQVEWDI-CYBMUJFWSA-N	1	0	284.428	4.282	20	30		CIEDRO
Cc1cc(C)cc([C@@H](C)[NH2+]Cc2ccccc2C#N)c1	ZINC000179085470	335472842	/nfs/dbraw/zinc/47/28/42/335472842.db2.gz	KAXBFZGKVVYNKS-OAHLLOKOSA-N	1	0	264.372	4.026	20	30		CIEDRO
Cc1ccccc1[C@H]([NH2+]CCCCC#N)C(C)(C)C	ZINC000180089565	335549372	/nfs/dbraw/zinc/54/93/72/335549372.db2.gz	ZGXLSBNRZFNIEG-INIZCTEOSA-N	1	0	258.409	4.366	20	30		CIEDRO
CCC(CC)[C@@H]([NH2+]Cc1ccc(C#N)o1)c1cccs1	ZINC000578215321	335580608	/nfs/dbraw/zinc/58/06/08/335580608.db2.gz	WNKLLQNUJOLCJU-MRXNPFEDSA-N	1	0	288.416	4.480	20	30		CIEDRO
N#Cc1ccc2c(c1)[C@@H]([NH2+]Cc1cccc3ccccc31)CC2	ZINC000578373705	335621994	/nfs/dbraw/zinc/62/19/94/335621994.db2.gz	MTRNKCUJYUWYBQ-NRFANRHFSA-N	1	0	298.389	4.489	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@H](C)[C@@H](C)c1nc2ccccc2s1	ZINC000180948269	335630616	/nfs/dbraw/zinc/63/06/16/335630616.db2.gz	LPKCHAPYNAVLRA-YNEHKIRRSA-N	1	0	274.433	4.343	20	30		CIEDRO
C=CC[C@@H](C)[NH2+][C@@H](C)c1ccc(SC)c(F)c1	ZINC000180949951	335630837	/nfs/dbraw/zinc/63/08/37/335630837.db2.gz	QPMVFWSQESSITR-MNOVXSKESA-N	1	0	253.386	4.163	20	30		CIEDRO
C=CC[C@H](C)[NH2+][C@@H](C)c1ccc(OCC)c(OCC)c1	ZINC000180950822	335630889	/nfs/dbraw/zinc/63/08/89/335630889.db2.gz	BFKCMKHGVVZCSB-KBPBESRZSA-N	1	0	277.408	4.099	20	30		CIEDRO
C[C@@H](C[NH2+][C@H]1CCc2ccc(C#N)cc21)c1ccc(F)cc1	ZINC000579178562	335718379	/nfs/dbraw/zinc/71/83/79/335718379.db2.gz	HBLBKEYGRQYDNH-DJJJIMSYSA-N	1	0	294.373	4.078	20	30		CIEDRO
C[C@@H]([NH2+]CC#Cc1ccc(C(F)(F)F)cc1)c1ccoc1	ZINC000181214303	335754840	/nfs/dbraw/zinc/75/48/40/335754840.db2.gz	LKMYYGADBMWJCR-GFCCVEGCSA-N	1	0	293.288	4.001	20	30		CIEDRO
CCC[C@@H]([NH2+]Cc1ccc(C#N)cc1OC)c1ccccc1	ZINC000181774908	335784732	/nfs/dbraw/zinc/78/47/32/335784732.db2.gz	XEPIKGGOLFJDLQ-GOSISDBHSA-N	1	0	294.398	4.198	20	30		CIEDRO
CCC[C@H]([NH2+]Cc1ccc(C#N)cc1OC)c1ccccc1	ZINC000181774888	335784740	/nfs/dbraw/zinc/78/47/40/335784740.db2.gz	XEPIKGGOLFJDLQ-SFHVURJKSA-N	1	0	294.398	4.198	20	30		CIEDRO
Cc1oc2ccccc2c1C[NH2+][C@H](C)c1cccc(C#N)c1	ZINC000182482143	335822850	/nfs/dbraw/zinc/82/28/50/335822850.db2.gz	CVLOFROWHFIZRI-CYBMUJFWSA-N	1	0	290.366	4.464	20	30		CIEDRO
Cc1ccccc1C([NH2+]CCCC#N)c1ccccc1C	ZINC000183937549	335913403	/nfs/dbraw/zinc/91/34/03/335913403.db2.gz	CJMMTXJNQCXMMK-UHFFFAOYSA-N	1	0	278.399	4.286	20	30		CIEDRO
C[C@@H]([NH2+]CCCC(C)(C)C#N)c1nc(C(C)(C)C)cs1	ZINC000184450326	335926074	/nfs/dbraw/zinc/92/60/74/335926074.db2.gz	SRJHVGVOXFWFMZ-GFCCVEGCSA-N	1	0	293.480	4.421	20	30		CIEDRO
CCCC[C@H]([NH2+]CCCC(C)(C)C#N)C1CCC1	ZINC000184869600	335937691	/nfs/dbraw/zinc/93/76/91/335937691.db2.gz	FLRBPPRNELHHOL-HNNXBMFYSA-N	1	0	250.430	4.265	20	30		CIEDRO
COc1cc(C[NH2+][C@@H](CCC#N)c2ccccc2)ccc1C	ZINC000194392362	336019418	/nfs/dbraw/zinc/01/94/18/336019418.db2.gz	BTKDGIXJFIDJBV-SFHVURJKSA-N	1	0	294.398	4.138	20	30		CIEDRO
C=CCCC[C@H](C)[NH2+][C@H]1c2ccccc2CC12CCOCC2	ZINC000581458742	336080424	/nfs/dbraw/zinc/08/04/24/336080424.db2.gz	JQLMWGIESHVAMJ-LPHOPBHVSA-N	1	0	299.458	4.415	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@H]1c2ccccc2CC12CCOCC2	ZINC000581458741	336080450	/nfs/dbraw/zinc/08/04/50/336080450.db2.gz	JQLMWGIESHVAMJ-APWZRJJASA-N	1	0	299.458	4.415	20	30		CIEDRO
C=CCCC[C@@H](C)[NH2+][C@@H]1c2ccccc2CC12CCOCC2	ZINC000581458744	336080467	/nfs/dbraw/zinc/08/04/67/336080467.db2.gz	JQLMWGIESHVAMJ-VQIMIIECSA-N	1	0	299.458	4.415	20	30		CIEDRO
CCc1ccc([C@H](C)[NH2+]Cc2ccc(CC#N)cc2)s1	ZINC000581607405	336111440	/nfs/dbraw/zinc/11/14/40/336111440.db2.gz	AITXLUSOLZHHTA-ZDUSSCGKSA-N	1	0	284.428	4.227	20	30		CIEDRO
Cc1ccc([C@H]([NH2+]CC2CCC(C#N)CC2)C2CC2)cc1	ZINC000581634123	336115089	/nfs/dbraw/zinc/11/50/89/336115089.db2.gz	AIFSRRLLPBTGAR-RJYAGPCLSA-N	1	0	282.431	4.366	20	30		CIEDRO
C[C@H]1c2c(F)cccc2CC[N@H+]1CCCCC(C)(C)C#N	ZINC000581705470	336131746	/nfs/dbraw/zinc/13/17/46/336131746.db2.gz	HVNGLLFAVYFNSO-AWEZNQCLSA-N	1	0	288.410	4.465	20	30		CIEDRO
C[C@H](CCC(C)(C)C)[NH2+]Cc1ccc(C#N)cc1F	ZINC000386359457	336171398	/nfs/dbraw/zinc/17/13/98/336171398.db2.gz	NXVKRQCSFHXWHC-GFCCVEGCSA-N	1	0	262.372	4.002	20	30		CIEDRO
C=CCC(C)(C)C[NH2+]Cc1ccc(OC(C)C)c(OC)c1	ZINC000386541866	336176195	/nfs/dbraw/zinc/17/61/95/336176195.db2.gz	BZHYSGRHWQZCPE-UHFFFAOYSA-N	1	0	291.435	4.174	20	30		CIEDRO
C=C(C)CC[NH2+][C@H](C)c1cc(Br)cs1	ZINC000386945217	336182893	/nfs/dbraw/zinc/18/28/93/336182893.db2.gz	WMADARBLXRBTMF-SECBINFHSA-N	1	0	274.227	4.127	20	30		CIEDRO
C[C@@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)c1ccc2c(c1)CCC2	ZINC000387245221	336190371	/nfs/dbraw/zinc/19/03/71/336190371.db2.gz	BVAUYUZVPOFLBK-LSDHHAIUSA-N	1	0	290.410	4.459	20	30		CIEDRO
CC[C@H](C)[N@H+](Cc1ccccc1)Cc1cc(C#N)ccc1F	ZINC000387373156	336193425	/nfs/dbraw/zinc/19/34/25/336193425.db2.gz	MCOIQGZYMXOGIH-HNNXBMFYSA-N	1	0	296.389	4.498	20	30		CIEDRO
CC(C)[N@H+](Cc1ccc(C#N)o1)[C@H](C)c1ccccc1	ZINC000292705950	519654030	/nfs/dbraw/zinc/65/40/30/519654030.db2.gz	CVQRFRSSIPWRIQ-CQSZACIVSA-N	1	0	268.360	4.123	20	30		CIEDRO
CC(C)Oc1cccc([C@@H](C)[NH2+]Cc2cccc(C#N)c2)c1	ZINC000078974665	519783399	/nfs/dbraw/zinc/78/33/99/519783399.db2.gz	HNVNRKCPZMCIMF-OAHLLOKOSA-N	1	0	294.398	4.196	20	30		CIEDRO
CCOc1ccc(C[NH2+][C@@H](CC)c2ccc(C#N)cc2)cc1	ZINC000278238206	521007434	/nfs/dbraw/zinc/00/74/34/521007434.db2.gz	KZSXKVZCODSEDB-IBGZPJMESA-N	1	0	294.398	4.198	20	30		CIEDRO
CCOc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(C#N)cc2)cc1	ZINC000078973580	521260538	/nfs/dbraw/zinc/26/05/38/521260538.db2.gz	DDVFAWJCULXXJF-GJZGRUSLSA-N	1	0	294.398	4.369	20	30		CIEDRO
CCOc1ccccc1[C@@H](CC)[NH2+]Cc1cccc(C#N)c1	ZINC000101599404	521576746	/nfs/dbraw/zinc/57/67/46/521576746.db2.gz	KTHXYADZOBOVSG-GOSISDBHSA-N	1	0	294.398	4.198	20	30		CIEDRO
N#CCCC[NH2+][C@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1	ZINC000442852138	534615562	/nfs/dbraw/zinc/61/55/62/534615562.db2.gz	KUPMIRDHAHZYPP-ZFWWWQNUSA-N	1	0	296.336	4.235	20	30		CIEDRO
CC[C@H]([NH2+]C[C@@H](C)c1ncc(C)s1)c1ccc(C#N)cc1	ZINC000278776444	522609545	/nfs/dbraw/zinc/60/95/45/522609545.db2.gz	PNMJFENHZXPXHA-WBMJQRKESA-N	1	0	299.443	4.168	20	30		CIEDRO
CC[C@H]([NH2+]Cc1ccc(C#N)c(OC)c1)c1ccc(C)cc1	ZINC000353605482	522642783	/nfs/dbraw/zinc/64/27/83/522642783.db2.gz	BRJDDIDTINKHTP-SFHVURJKSA-N	1	0	294.398	4.116	20	30		CIEDRO
CC[C@@H]([NH2+]Cc1sccc1C)c1ccc(C#N)cc1	ZINC000278332454	522898535	/nfs/dbraw/zinc/89/85/35/522898535.db2.gz	WKIPMWXKVQAQHQ-OAHLLOKOSA-N	1	0	270.401	4.169	20	30		CIEDRO
CC[C@@H]([NH2+][C@H](C)c1cccc(OC)c1)c1ccc(C#N)cc1	ZINC000278289895	522939092	/nfs/dbraw/zinc/93/90/92/522939092.db2.gz	QYAGLDHBMKQUQJ-AUUYWEPGSA-N	1	0	294.398	4.369	20	30		CIEDRO
Cc1cc(C)cc(C[NH2+][C@@H](C)c2ccc(C#N)cc2)c1	ZINC000038076774	524382809	/nfs/dbraw/zinc/38/28/09/524382809.db2.gz	DWFLWSYYKLFXNG-HNNXBMFYSA-N	1	0	264.372	4.026	20	30		CIEDRO
COc1ccc([C@H]([NH2+]Cc2ccc(C#N)cc2)C(C)C)cc1	ZINC000052661573	525371992	/nfs/dbraw/zinc/37/19/92/525371992.db2.gz	SCMZHMRUDYBFBG-LJQANCHMSA-N	1	0	294.398	4.054	20	30		CIEDRO
C[C@H]([NH2+]Cc1ccc(C2CC2)cc1F)c1ccc(C#N)cc1	ZINC000293341674	525440351	/nfs/dbraw/zinc/44/03/51/525440351.db2.gz	GPEGESIYBYPIOD-ZDUSSCGKSA-N	1	0	294.373	4.426	20	30		CIEDRO
Cc1cc([C@@H](C)[NH2+][C@@H](C)c2ccc(C#N)cc2)c(C)o1	ZINC000036991951	525472073	/nfs/dbraw/zinc/47/20/73/525472073.db2.gz	MKFOUTPQEZXKKB-QWHCGFSZSA-N	1	0	268.360	4.180	20	30		CIEDRO
C[C@H]([NH2+][C@@H]1CCc2c1cccc2F)c1ccc(C#N)cc1	ZINC000097988270	525583415	/nfs/dbraw/zinc/58/34/15/525583415.db2.gz	ALQPZPKHNCXTAY-KPZWWZAWSA-N	1	0	280.346	4.035	20	30		CIEDRO
C[C@H]([NH2+][C@H]1CCSc2ccccc21)c1ccc(C#N)cc1	ZINC000036991846	525629635	/nfs/dbraw/zinc/62/96/35/525629635.db2.gz	GROWFDUQKVVHLG-GUYCJALGSA-N	1	0	294.423	4.446	20	30		CIEDRO
C[C@@H]([NH2+][C@@H]1CCSc2ccccc21)c1ccc(C#N)cc1	ZINC000036991845	525647729	/nfs/dbraw/zinc/64/77/29/525647729.db2.gz	GROWFDUQKVVHLG-CXAGYDPISA-N	1	0	294.423	4.446	20	30		CIEDRO
Cc1ccc([C@H](C)[NH2+]Cc2cccc(C#N)c2)cc1C	ZINC000037748752	525928377	/nfs/dbraw/zinc/92/83/77/525928377.db2.gz	VXYWBSOKCZKDDR-HNNXBMFYSA-N	1	0	264.372	4.026	20	30		CIEDRO
C=C(C)C[NH+]1CCC(c2c[nH]c3ccc(F)cc32)CC1	ZINC000347561718	526605414	/nfs/dbraw/zinc/60/54/14/526605414.db2.gz	SFCACIVCOHVRDZ-UHFFFAOYSA-N	1	0	272.367	4.063	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@@H](c2ccccc2)C2CCC2)c1	ZINC000104698782	526709064	/nfs/dbraw/zinc/70/90/64/526709064.db2.gz	LHGYJTGNGBQTDI-IBGZPJMESA-N	1	0	276.383	4.189	20	30		CIEDRO
N#Cc1cccc(C[NH2+][C@H](c2ccccc2)C2CCC2)c1	ZINC000104698786	526709084	/nfs/dbraw/zinc/70/90/84/526709084.db2.gz	LHGYJTGNGBQTDI-LJQANCHMSA-N	1	0	276.383	4.189	20	30		CIEDRO
C=CCOCCC[NH2+][C@H](CC1CCC1)c1ccccc1	ZINC000348059835	526761668	/nfs/dbraw/zinc/76/16/68/526761668.db2.gz	XCLHKTCHNWLZFV-GOSISDBHSA-N	1	0	273.420	4.100	20	30		CIEDRO
C=CCCC[N@@H+](C)Cc1nc(-c2ccccc2)cs1	ZINC000353736137	527192953	/nfs/dbraw/zinc/19/29/53/527192953.db2.gz	FWXOVBDBGOHEID-UHFFFAOYSA-N	1	0	272.417	4.208	20	30		CIEDRO
C=CCC[C@H]([NH2+]CCC(=O)OC(C)(C)C)c1ccccc1	ZINC000352972534	527483961	/nfs/dbraw/zinc/48/39/61/527483961.db2.gz	XQHUUFMZOKJJAY-INIZCTEOSA-N	1	0	289.419	4.015	20	30		CIEDRO
C=CCC[C@H]([NH2+]Cc1ccnc(SC)c1)c1ccco1	ZINC000353386154	527485767	/nfs/dbraw/zinc/48/57/67/527485767.db2.gz	LOWQDKJQQNHEMT-AWEZNQCLSA-N	1	0	288.416	4.194	20	30		CIEDRO
CC1=C(c2ccco2)C[N@H+](CCCC(C)(C)C#N)CC1	ZINC000367219964	528093663	/nfs/dbraw/zinc/09/36/63/528093663.db2.gz	PKRUQPNUMQINAL-UHFFFAOYSA-N	1	0	272.392	4.089	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@H]2CCSc3ccccc32)CC1	ZINC000336224044	528833506	/nfs/dbraw/zinc/83/35/06/528833506.db2.gz	CFESZOQAKRUIDA-GULBITTBSA-N	1	0	286.444	4.286	20	30		CIEDRO
CC1(C#N)CCC([NH2+][C@@H]2CCCc3sccc32)CC1	ZINC000336219500	528833638	/nfs/dbraw/zinc/83/36/38/528833638.db2.gz	LTFOACCOVXBCSR-CXOJTPOUSA-N	1	0	274.433	4.188	20	30		CIEDRO
CCCCc1oc2ccccc2c1C[NH2+]CCCC#N	ZINC000344335857	529065817	/nfs/dbraw/zinc/06/58/17/529065817.db2.gz	SHPZZMLRPBKTBH-UHFFFAOYSA-N	1	0	270.376	4.169	20	30		CIEDRO
CC[C@@H]([NH2+][C@@H]1CCc2ccc(C#N)cc21)c1ccccc1	ZINC000353397235	529203648	/nfs/dbraw/zinc/20/36/48/529203648.db2.gz	IOENHGQVCKSCMN-RTBURBONSA-N	1	0	276.383	4.286	20	30		CIEDRO
CC[C@H](CC#N)[NH2+][C@H](C)C1CCC(C(F)(F)F)CC1	ZINC000354649538	529301069	/nfs/dbraw/zinc/30/10/69/529301069.db2.gz	OCEXWBXUYXMHQU-IKWCTNDRSA-N	1	0	276.346	4.025	20	30		CIEDRO
CC1(C)CC[C@H]([NH2+][C@H]2CCCc3cc(C#N)ccc32)C1	ZINC000341894720	535328268	/nfs/dbraw/zinc/32/82/68/535328268.db2.gz	FIBYJUXFEPWLKK-RDJZCZTQSA-N	1	0	268.404	4.104	20	30		CIEDRO