smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C=CC[N@@H+](C)CC1CC[NH+](C[C@H](O)c2ccccc2)CC1	ZINC000105862889	527573359	/nfs/dbraw/zinc/57/33/59/527573359.db2.gz	KVBXTZXGNSLSJJ-SFHVURJKSA-N	2	0	288.435	2.550	10	30		CFEERP
CC(C)[N@@H+]1CCC[C@@H]([NH2+]Cc2ccc(C#N)cc2)CC1	ZINC000086841019	179353879	/nfs/dbraw/zinc/35/38/79/179353879.db2.gz	AMCQWJQMLACWHD-QGZVFWFLSA-N	2	0	271.408	2.911	10	30		CFEERP
C[C@@H](c1ccc(C#N)cc1)[N@H+]1[C@@H]2CC[C@H]1CC([NH3+])C2	ZINC000040749002	174393973	/nfs/dbraw/zinc/39/39/73/174393973.db2.gz	KNOGLYHKMHSLQU-RJPYNODJSA-N	2	0	255.365	2.573	10	30		CFEERP
CC[C@H](C)C[N@H+](C)Cc1cc(C#CC[NH3+])cs1	ZINC000043688900	175095528	/nfs/dbraw/zinc/09/55/28/175095528.db2.gz	PMIQUXYUNNIRTH-LBPRGKRZSA-N	2	0	250.411	2.536	10	30		CFEERP
CC(C)C[N@H+](Cc1cc(C#CC[NH3+])cs1)C(C)C	ZINC000043689106	175095605	/nfs/dbraw/zinc/09/56/05/175095605.db2.gz	FNKDHEFZYWIWOD-UHFFFAOYSA-N	2	0	264.438	2.925	10	30		CFEERP
C[N@@H+](Cc1ccsc1)Cc1cc(C#CC[NH3+])cs1	ZINC000043688908	175096096	/nfs/dbraw/zinc/09/60/96/175096096.db2.gz	GYCVJCYPFGHETE-UHFFFAOYSA-N	2	0	276.430	2.752	10	30		CFEERP
CC(C)[N@H+](C)CCCC[NH2+]Cc1ccc(C#N)cc1	ZINC000044573116	175210309	/nfs/dbraw/zinc/21/03/09/175210309.db2.gz	LDJNZEUATATQQU-UHFFFAOYSA-N	2	0	259.397	2.768	10	30		CFEERP
C[N@H+](Cc1ccc(C#CC[NH3+])cc1F)C1CCCC1	ZINC000049608929	175491776	/nfs/dbraw/zinc/49/17/76/175491776.db2.gz	PBYDHXXSVPKTBU-UHFFFAOYSA-N	2	0	260.356	2.510	10	30		CFEERP
CC(C)C[C@@H]1CSC(N[C@@H](C[NH+](C)C)C(C)C)=[NH+]1	ZINC000049222043	519276040	/nfs/dbraw/zinc/27/60/40/519276040.db2.gz	MMDXVSRXGOQOGX-OLZOCXBDSA-N	2	0	271.474	2.680	10	30		CFEERP
C[C@H](c1cccc(C#N)c1)[N@@H+]1C[C@@H](C)[C@](C)(C[NH3+])C1	ZINC000388423286	382607078	/nfs/dbraw/zinc/60/70/78/382607078.db2.gz	QVAMHKJEUKTQLK-XJKCOSOUSA-N	2	0	257.381	2.536	10	30		CFEERP
C=CC[C@@H]1CCCC[C@H]1[NH2+]C[C@H](O)C[NH+]1CCCCC1	ZINC000657844052	413995090	/nfs/dbraw/zinc/99/50/90/413995090.db2.gz	GMWJFZDGLMKUQQ-IXDOHACOSA-N	2	0	280.456	2.558	10	30		CFEERP
CC(C)CC[N@H+](C)Cc1ccc(C#CC[NH3+])s1	ZINC000043684018	175091907	/nfs/dbraw/zinc/09/19/07/175091907.db2.gz	WQYMOCNHHXGODC-UHFFFAOYSA-N	2	0	250.411	2.536	10	30		CFEERP
CCC[C@@H](C)[N@H+](C)Cc1ccc(C#CC[NH3+])s1	ZINC000043683743	175092466	/nfs/dbraw/zinc/09/24/66/175092466.db2.gz	WVPIMPMEVGOTJC-GFCCVEGCSA-N	2	0	250.411	2.679	10	30		CFEERP
C[C@@H]([N@H+](C)Cc1ccc(C#CC[NH3+])s1)C(C)(C)C	ZINC000043684250	175092597	/nfs/dbraw/zinc/09/25/97/175092597.db2.gz	HIXUGLINRQZQFR-GFCCVEGCSA-N	2	0	264.438	2.925	10	30		CFEERP
CC(C)C[C@@H](C)[N@H+](C)Cc1ccc(C#CC[NH3+])s1	ZINC000043684183	175093114	/nfs/dbraw/zinc/09/31/14/175093114.db2.gz	IIXJWWXUULKEKK-CYBMUJFWSA-N	2	0	264.438	2.925	10	30		CFEERP
CC[N@H+](Cc1cc(C#CC[NH3+])cs1)C1CCCC1	ZINC000043688915	175095373	/nfs/dbraw/zinc/09/53/73/175095373.db2.gz	CVIFFVZLXNSUOW-UHFFFAOYSA-N	2	0	262.422	2.823	10	30		CFEERP
CC[C@H]1CCC[N@H+](Cc2cc(C#CC[NH3+])cs2)C1	ZINC000043688926	175095940	/nfs/dbraw/zinc/09/59/40/175095940.db2.gz	GUKMLBNQCUUUQJ-ZDUSSCGKSA-N	2	0	262.422	2.680	10	30		CFEERP
C[N@H+](Cc1cc(C#CC[NH3+])cs1)CC(C)(C)C	ZINC000045086711	175304080	/nfs/dbraw/zinc/30/40/80/175304080.db2.gz	FHZHVCRFDZVAIY-UHFFFAOYSA-N	2	0	250.411	2.536	10	30		CFEERP
C[N@H+](Cc1ccc(F)cc1C#CC[NH3+])CC(C)(C)C	ZINC000045086744	175304385	/nfs/dbraw/zinc/30/43/85/175304385.db2.gz	HVMILYFTTKFHJO-UHFFFAOYSA-N	2	0	262.372	2.614	10	30		CFEERP
C[C@@H]1CCC[N@H+](Cc2cc(C#CC[NH3+])cs2)[C@H]1C	ZINC000252203914	574283631	/nfs/dbraw/zinc/28/36/31/574283631.db2.gz	URIPLTDCDDVJBH-OLZOCXBDSA-N	2	0	262.422	2.679	10	30		CFEERP
CCC[C@@H](C)[N@H+](C)Cc1cc(C#CC[NH3+])cs1	ZINC000043688931	175095306	/nfs/dbraw/zinc/09/53/06/175095306.db2.gz	NFYLIPKUKOWAKA-GFCCVEGCSA-N	2	0	250.411	2.679	10	30		CFEERP
CCCCC[N@H+](C)Cc1cc(C#CC[NH3+])cs1	ZINC000043688902	175096088	/nfs/dbraw/zinc/09/60/88/175096088.db2.gz	QDDKQLSVWGDLLQ-UHFFFAOYSA-N	2	0	250.411	2.680	10	30		CFEERP
Cc1cc(N[C@H]2CC[N@@H+]3CCCC[C@@H]23)c(C#N)c(C)n1	ZINC000219877209	393761206	/nfs/dbraw/zinc/76/12/06/393761206.db2.gz	UZHNBQCOFLPTOJ-HOCLYGCPSA-N	2	0	270.380	2.609	10	30		CFEERP
CC[C@@H]1CCC[N@H+](Cc2sccc2C#CC[NH3+])C1	ZINC000043683724	175091848	/nfs/dbraw/zinc/09/18/48/175091848.db2.gz	ZUHTZDCBXXLPOQ-CYBMUJFWSA-N	2	0	262.422	2.680	10	30		CFEERP
CCCC[N@H+](Cc1sccc1C#CC[NH3+])C1CC1	ZINC000043683848	175092115	/nfs/dbraw/zinc/09/21/15/175092115.db2.gz	QYXILPZPOAVROO-UHFFFAOYSA-N	2	0	262.422	2.823	10	30		CFEERP
CC(C)C[C@@H](C)[N@H+](C)Cc1sccc1C#CC[NH3+]	ZINC000043684185	175092753	/nfs/dbraw/zinc/09/27/53/175092753.db2.gz	SIYZWTAPDMSCSX-CYBMUJFWSA-N	2	0	264.438	2.925	10	30		CFEERP
CC(C)C[N@H+](Cc1ccc(C#CC[NH3+])s1)C1CC1	ZINC000043684181	175093320	/nfs/dbraw/zinc/09/33/20/175093320.db2.gz	QEFSUSNYDFPVDM-UHFFFAOYSA-N	2	0	262.422	2.679	10	30		CFEERP
C[C@H]([N@H+](C)Cc1cc(C#CC[NH3+])cs1)C(C)(C)C	ZINC000043689126	175096164	/nfs/dbraw/zinc/09/61/64/175096164.db2.gz	LMHZLOIESMSSMG-LBPRGKRZSA-N	2	0	264.438	2.925	10	30		CFEERP
CC(C)C[C@@H]1CSC(N[C@H](C)C[NH+]2CCCC2)=[NH+]1	ZINC000049185299	519275553	/nfs/dbraw/zinc/27/55/53/519275553.db2.gz	CNEWSJVLWMNHAH-CHWSQXEVSA-N	2	0	269.458	2.578	10	30		CFEERP
N#CCC[NH2+]CCCCCCCCC[NH2+]CCC#N	ZINC000584650301	348701989	/nfs/dbraw/zinc/70/19/89/348701989.db2.gz	AGWLWSMEVQTPKV-UHFFFAOYSA-N	2	0	264.417	2.724	10	30		CFEERP
CCCCC[N@H+](C)Cc1ccc(C#CC[NH3+])s1	ZINC000043683665	175092037	/nfs/dbraw/zinc/09/20/37/175092037.db2.gz	HWKPVHHVYXFRBG-UHFFFAOYSA-N	2	0	250.411	2.680	10	30		CFEERP
CC[C@@H](C)C[N@H+](C)Cc1cc(C#CC[NH3+])cs1	ZINC000043688899	175095600	/nfs/dbraw/zinc/09/56/00/175095600.db2.gz	PMIQUXYUNNIRTH-GFCCVEGCSA-N	2	0	250.411	2.536	10	30		CFEERP
[NH3+]CC#Cc1ccc(C[NH+]2CCCCCCC2)c(F)c1	ZINC000049608787	175491787	/nfs/dbraw/zinc/49/17/87/175491787.db2.gz	KDGXAOGVOYSDCS-UHFFFAOYSA-N	2	0	274.383	2.902	10	30		CFEERP
CCCCCCC[N@H+](C)CC1CC[NH+](C[C@@H](C)O)CC1	ZINC000172655799	623298238	/nfs/dbraw/zinc/29/82/38/623298238.db2.gz	QUXKVQZKZFZPMP-MRXNPFEDSA-N	2	0	284.488	2.981	10	30		CFEERP
C#CCC[NH+]1CCN(c2cc[nH+]c3c(C)cccc23)CC1	ZINC000091480544	347589263	/nfs/dbraw/zinc/58/92/63/347589263.db2.gz	LAFCJIAQXJKXAL-UHFFFAOYSA-N	2	0	279.387	2.689	10	30		CFEERP
CC(C)[NH+](Cc1cc(C#CC[NH3+])cs1)C(C)C	ZINC000725273770	539629811	/nfs/dbraw/zinc/62/98/11/539629811.db2.gz	CEPLCALQNWAFEH-UHFFFAOYSA-N	2	0	250.411	2.677	10	30		CFEERP
Cc1cc[nH+]c(NC[C@@H]2CC[N@H+](Cc3ccc(C#N)o3)C2)c1	ZINC000371371186	381602328	/nfs/dbraw/zinc/60/23/28/381602328.db2.gz	ASYMMQCGLYDMIG-AWEZNQCLSA-N	2	0	296.374	2.789	10	30		CFEERP
CC(C)[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(C#N)cc2)C1	ZINC000040621337	174354955	/nfs/dbraw/zinc/35/49/55/174354955.db2.gz	IYHZMFSKHXFPAS-HOCLYGCPSA-N	2	0	271.408	2.939	10	30		CFEERP
CCC[N@H+](Cc1ccc(C#CC[NH3+])s1)C(C)C	ZINC000043683635	175091834	/nfs/dbraw/zinc/09/18/34/175091834.db2.gz	FQLYPDTZEZFADP-UHFFFAOYSA-N	2	0	250.411	2.679	10	30		CFEERP
CC[C@@H](C)[N@H+](CC)Cc1ccc(C#CC[NH3+])s1	ZINC000043683626	175091854	/nfs/dbraw/zinc/09/18/54/175091854.db2.gz	LOABUSKRKBOMGZ-GFCCVEGCSA-N	2	0	250.411	2.679	10	30		CFEERP
CCC[C@H](C)[N@H+](C)Cc1ccc(C#CC[NH3+])s1	ZINC000043683745	175092142	/nfs/dbraw/zinc/09/21/42/175092142.db2.gz	WVPIMPMEVGOTJC-LBPRGKRZSA-N	2	0	250.411	2.679	10	30		CFEERP
C[C@@H]1CCC[C@H](C)[N@H+]1Cc1ccc(C#CC[NH3+])s1	ZINC000043683563	175092292	/nfs/dbraw/zinc/09/22/92/175092292.db2.gz	LFQMBPIGWAXXKI-BETUJISGSA-N	2	0	262.422	2.821	10	30		CFEERP
CCCC[N@H+](Cc1cc(C#CC[NH3+])cs1)C1CC1	ZINC000043688966	175096048	/nfs/dbraw/zinc/09/60/48/175096048.db2.gz	YGYTWYPNUIRFHP-UHFFFAOYSA-N	2	0	262.422	2.823	10	30		CFEERP
CC[C@H]1CCCC[N@@H+]1Cc1ccc(C#CC[NH3+])cc1F	ZINC000049608916	175491601	/nfs/dbraw/zinc/49/16/01/175491601.db2.gz	SIYKWXJZCBCPON-INIZCTEOSA-N	2	0	274.383	2.900	10	30		CFEERP
C[C@@H]1CCC[N@H+](Cc2cc(C#CC[NH3+])cs2)[C@@H]1C	ZINC000050566665	618136052	/nfs/dbraw/zinc/13/60/52/618136052.db2.gz	URIPLTDCDDVJBH-CHWSQXEVSA-N	2	0	262.422	2.679	10	30		CFEERP
C=CC[C@@H]1CCCC[C@@H]1[NH2+]C[C@@H](O)C[NH+]1CCCCC1	ZINC000657844053	413996671	/nfs/dbraw/zinc/99/66/71/413996671.db2.gz	GMWJFZDGLMKUQQ-ZACQAIPSSA-N	2	0	280.456	2.558	10	30		CFEERP
CC(C)CC[N@H+](C)Cc1cc(C#CC[NH3+])cs1	ZINC000043689024	175095202	/nfs/dbraw/zinc/09/52/02/175095202.db2.gz	ZGUWBPTYVFKTDL-UHFFFAOYSA-N	2	0	250.411	2.536	10	30		CFEERP
Cc1ncsc1CN(C)C[C@@H]1CC[N@H+](CCCC#N)C1	ZINC000195254423	262248611	/nfs/dbraw/zinc/24/86/11/262248611.db2.gz	AUYNKQCJFXRXCA-AWEZNQCLSA-N	2	0	292.452	2.509	10	30		CFEERP
C[NH+](C)CCC[N@@H+]1CCC[C@@H](c2cccc(C#N)c2)C1	ZINC000013738281	372046839	/nfs/dbraw/zinc/04/68/39/372046839.db2.gz	AKBLTSXPRUVMOS-QGZVFWFLSA-N	2	0	271.408	2.689	10	30		CFEERP
CC[C@H]1CCCC[N@@H+]1Cc1ccc(C#CC[NH3+])s1	ZINC000043683616	175091548	/nfs/dbraw/zinc/09/15/48/175091548.db2.gz	USRGFTWULDPWCG-ZDUSSCGKSA-N	2	0	262.422	2.823	10	30		CFEERP
CCC(CC)[N@H+](C)Cc1ccc(C#CC[NH3+])s1	ZINC000043683716	175092223	/nfs/dbraw/zinc/09/22/23/175092223.db2.gz	FHRMLZPGBFGNQZ-UHFFFAOYSA-N	2	0	250.411	2.679	10	30		CFEERP
CC(C)C[C@H]1CSC(N[C@H](C[NH+](C)C)C(C)C)=[NH+]1	ZINC000049222055	519418180	/nfs/dbraw/zinc/41/81/80/519418180.db2.gz	MMDXVSRXGOQOGX-QWHCGFSZSA-N	2	0	271.474	2.680	10	30		CFEERP
CCC1CC[NH+](Cc2cc(C#CC[NH3+])ccc2OC)CC1	ZINC000049609926	519859115	/nfs/dbraw/zinc/85/91/15/519859115.db2.gz	IUSGPFCZGLDSJT-UHFFFAOYSA-N	2	0	286.419	2.627	10	30		CFEERP
CCC(CC)[N@H+](C)Cc1ccc(C#CC[NH3+])cc1F	ZINC000049609253	521543385	/nfs/dbraw/zinc/54/33/85/521543385.db2.gz	UYXWDBSLAVGLMN-UHFFFAOYSA-N	2	0	262.372	2.756	10	30		CFEERP
CCC[N@H+](Cc1cc(C#CC[NH3+])ccc1OC)C(C)C	ZINC000049608956	521681300	/nfs/dbraw/zinc/68/13/00/521681300.db2.gz	XEKOSQVXSGNYMQ-UHFFFAOYSA-N	2	0	274.408	2.626	10	30		CFEERP
C[N@H+](CCC[NH2+]CCCCC#N)C1CCCCC1	ZINC000049578446	522772810	/nfs/dbraw/zinc/77/28/10/522772810.db2.gz	YLCITAWBMSBEKW-UHFFFAOYSA-N	2	0	251.418	2.924	10	30		CFEERP
C[N@H+](Cc1ccccc1)Cc1ccc(F)cc1C#CC[NH3+]	ZINC000049608527	523348369	/nfs/dbraw/zinc/34/83/69/523348369.db2.gz	SYQQBSUKVHVOAI-UHFFFAOYSA-N	2	0	282.362	2.768	10	30		CFEERP
CC[C@H](C)[N@H+](CC)Cc1ccc(OC)c(C#CC[NH3+])c1	ZINC000049608942	523934934	/nfs/dbraw/zinc/93/49/34/523934934.db2.gz	LMYVHVJLKTWUDF-AWEZNQCLSA-N	2	0	274.408	2.626	10	30		CFEERP
C[C@@H]1CCCC[N@@H+]1Cc1ccc(C#CC[NH3+])cc1F	ZINC000049608399	524115903	/nfs/dbraw/zinc/11/59/03/524115903.db2.gz	IVHRUJUADLOZEN-CYBMUJFWSA-N	2	0	260.356	2.510	10	30		CFEERP
C[C@@H]1CCC[C@H](C)[N@H+]1Cc1ccccc1C#CC[NH3+]	ZINC000049608720	524362828	/nfs/dbraw/zinc/36/28/28/524362828.db2.gz	NBYDDQLIDZOEKG-GASCZTMLSA-N	2	0	256.393	2.760	10	30		CFEERP
Cc1ccc(C[N@@H+](C)Cc2cccc(C#CC[NH3+])c2)o1	ZINC000049609112	524394148	/nfs/dbraw/zinc/39/41/48/524394148.db2.gz	CKKCVJCHVVEWDV-UHFFFAOYSA-N	2	0	268.360	2.530	10	30		CFEERP
CCCCCCC[C@@](C)(C[NH3+])N(C)CCC[NH+](C)C	ZINC000104189882	185921423	/nfs/dbraw/zinc/92/14/23/185921423.db2.gz	OYYJKNHWYMMBDC-INIZCTEOSA-N	2	0	271.493	2.948	10	30		CFEERP
Cc1ccccc1C[N@H+](C)Cc1sccc1C#CC[NH3+]	ZINC000043683948	175091949	/nfs/dbraw/zinc/09/19/49/175091949.db2.gz	SCGRWVXBSGGDQK-UHFFFAOYSA-N	2	0	284.428	2.999	10	30		CFEERP
CC(C)[N@@H+](Cc1sccc1C#CC[NH3+])CC1CC1	ZINC000043684194	175092911	/nfs/dbraw/zinc/09/29/11/175092911.db2.gz	GTEZBQWGVRUPRZ-UHFFFAOYSA-N	2	0	262.422	2.679	10	30		CFEERP
C[C@@H]([N@H+](C)Cc1sccc1C#CC[NH3+])C(C)(C)C	ZINC000043684252	175092984	/nfs/dbraw/zinc/09/29/84/175092984.db2.gz	TVJOHDRBUORDHK-GFCCVEGCSA-N	2	0	264.438	2.925	10	30		CFEERP
CC(C)[C@@H](C)[N@H+](C)Cc1cc(C#CC[NH3+])cs1	ZINC000043688921	175096024	/nfs/dbraw/zinc/09/60/24/175096024.db2.gz	RGBVVUYKSBTPOO-GFCCVEGCSA-N	2	0	250.411	2.535	10	30		CFEERP
CC[C@@H](C)[N@H+](CC)Cc1ccc(F)cc1C#CC[NH3+]	ZINC000049608949	522085643	/nfs/dbraw/zinc/08/56/43/522085643.db2.gz	AOIPJZJTLDONEQ-CYBMUJFWSA-N	2	0	262.372	2.756	10	30		CFEERP
CC[C@H]1CCC[N@H+](Cc2ccccc2C#CC[NH3+])C1	ZINC000049609260	523090957	/nfs/dbraw/zinc/09/09/57/523090957.db2.gz	HHUOAKTWSAFANO-HNNXBMFYSA-N	2	0	256.393	2.619	10	30		CFEERP
C[N@H+](Cc1ccc(C#CC[NH3+])cc1)C1CCCCC1	ZINC000049608579	523205207	/nfs/dbraw/zinc/20/52/07/523205207.db2.gz	VURBKEGCJHDCHF-UHFFFAOYSA-N	2	0	256.393	2.761	10	30		CFEERP
CC[C@@H]1CCC[N@H+](Cc2ccc(C#CC[NH3+])cc2)C1	ZINC000049609261	523253370	/nfs/dbraw/zinc/25/33/70/523253370.db2.gz	MAROTFCLROZCHI-OAHLLOKOSA-N	2	0	256.393	2.619	10	30		CFEERP
CC[C@@H]1CCC[N@@H+]1Cc1ccc(F)c(C#CC[NH3+])c1	ZINC000049608276	523268842	/nfs/dbraw/zinc/26/88/42/523268842.db2.gz	GPFJIFQTXXARJJ-OAHLLOKOSA-N	2	0	260.356	2.510	10	30		CFEERP
C[N@H+](Cc1cccs1)Cc1ccc(C#CC[NH3+])cc1	ZINC000049609091	523446560	/nfs/dbraw/zinc/44/65/60/523446560.db2.gz	PPFXQLBLFYYMHO-UHFFFAOYSA-N	2	0	270.401	2.690	10	30		CFEERP
C[C@H]1C[C@H](C)C[NH+](Cc2ccc(C#CC[NH3+])cc2F)C1	ZINC000049608641	524884944	/nfs/dbraw/zinc/88/49/44/524884944.db2.gz	OREXJBRWRMQROV-KBPBESRZSA-N	2	0	274.383	2.614	10	30		CFEERP
Cc1occc1C[N@@H+](C)Cc1ccccc1C#CC[NH3+]	ZINC000049609917	526825765	/nfs/dbraw/zinc/82/57/65/526825765.db2.gz	KYIWYLBGCGOLCT-UHFFFAOYSA-N	2	0	268.360	2.530	10	30		CFEERP
CCC[N@@H+]1CCC[C@H]([NH2+]Cc2ccc(C#N)cc2)CC1	ZINC000086841028	179353312	/nfs/dbraw/zinc/35/33/12/179353312.db2.gz	YLVFTLHNSOPUPN-KRWDZBQOSA-N	2	0	271.408	2.912	10	30		CFEERP
CCCCCCCCC[NH+]1CCN([C@@H](C)C[NH3+])CC1	ZINC000110444211	186296405	/nfs/dbraw/zinc/29/64/05/186296405.db2.gz	OVQNJBXXHSUNOC-INIZCTEOSA-N	2	0	269.477	2.702	10	30		CFEERP
N#Cc1ccc(C[N@H+]2C[C@@H](C[NH3+])[C@H](c3ccccc3)C2)cc1	ZINC000261725097	383547503	/nfs/dbraw/zinc/54/75/03/383547503.db2.gz	LLODPHVUJUJJJS-MOPGFXCFSA-N	2	0	291.398	2.733	10	30		CFEERP
CC[N@H+](Cc1sccc1C#CC[NH3+])C1CCCC1	ZINC000043683692	175091894	/nfs/dbraw/zinc/09/18/94/175091894.db2.gz	LXHSMSWWZVJNSO-UHFFFAOYSA-N	2	0	262.422	2.823	10	30		CFEERP
C=CCCCCC[N@@H+](C)CC1CC[NH+](C[C@@H](C)O)CC1	ZINC000193336829	333248402	/nfs/dbraw/zinc/24/84/02/333248402.db2.gz	SPWBESRLCFUYLD-MRXNPFEDSA-N	2	0	282.472	2.757	10	30		CFEERP
CCC(CC)[N@H+](C)Cc1ccc(F)cc1C#CC[NH3+]	ZINC000049609255	521542362	/nfs/dbraw/zinc/54/23/62/521542362.db2.gz	IIDYVUQHSQJMBA-UHFFFAOYSA-N	2	0	262.372	2.756	10	30		CFEERP
CCCC[N@H+](Cc1ccc(C#CC[NH3+])cc1F)C1CC1	ZINC000049609604	520544277	/nfs/dbraw/zinc/54/42/77/520544277.db2.gz	YVFXHQUKBMMFMN-UHFFFAOYSA-N	2	0	274.383	2.900	10	30		CFEERP
CC[N@H+](Cc1ccc(F)c(C#CC[NH3+])c1)C1CCCC1	ZINC000049609174	521312734	/nfs/dbraw/zinc/31/27/34/521312734.db2.gz	SGUSYFLEBSCNPO-UHFFFAOYSA-N	2	0	274.383	2.900	10	30		CFEERP
CCC[NH+](CCC)Cc1ccc(C#CC[NH3+])cc1F	ZINC000049608519	521649396	/nfs/dbraw/zinc/64/93/96/521649396.db2.gz	LLYGYJQUZZFOQS-UHFFFAOYSA-N	2	0	262.372	2.758	10	30		CFEERP
CC[C@H]1CCCC[N@@H+]1Cc1ccccc1C#CC[NH3+]	ZINC000049608906	523027159	/nfs/dbraw/zinc/02/71/59/523027159.db2.gz	VHUKUEZMCSXHEA-KRWDZBQOSA-N	2	0	256.393	2.761	10	30		CFEERP
C[N@H+](Cc1ccc(C#CC[NH3+])cc1)Cc1cccc(F)c1	ZINC000049608792	523203315	/nfs/dbraw/zinc/20/33/15/523203315.db2.gz	INMBVDSSXSGKRN-UHFFFAOYSA-N	2	0	282.362	2.768	10	30		CFEERP
C[N@H+](Cc1cccc(F)c1)Cc1ccccc1C#CC[NH3+]	ZINC000049608791	523311759	/nfs/dbraw/zinc/31/17/59/523311759.db2.gz	MCONZYWQTNJISA-UHFFFAOYSA-N	2	0	282.362	2.768	10	30		CFEERP
C[N@H+](Cc1cccs1)Cc1cccc(C#CC[NH3+])c1	ZINC000049609096	523448160	/nfs/dbraw/zinc/44/81/60/523448160.db2.gz	CHOFDEJQTSVCJQ-UHFFFAOYSA-N	2	0	270.401	2.690	10	30		CFEERP
C[C@@H]1CCC[C@@H](C)[NH+]1Cc1ccc(F)cc1C#CC[NH3+]	ZINC000049608743	524278249	/nfs/dbraw/zinc/27/82/49/524278249.db2.gz	TVMUQKVLQIBTFK-ZIAGYGMSSA-N	2	0	274.383	2.899	10	30		CFEERP
C[C@@H]1CCC[C@@H](C)[NH+]1Cc1ccccc1C#CC[NH3+]	ZINC000049608722	524279595	/nfs/dbraw/zinc/27/95/95/524279595.db2.gz	NBYDDQLIDZOEKG-HUUCEWRRSA-N	2	0	256.393	2.760	10	30		CFEERP
Cc1cccc(C[N@@H+](C)Cc2ccccc2C#CC[NH3+])c1	ZINC000049609961	524377169	/nfs/dbraw/zinc/37/71/69/524377169.db2.gz	QYSBUXSRPQVYIA-UHFFFAOYSA-N	2	0	278.399	2.937	10	30		CFEERP
C[C@H]1CCCC[N@@H+]1Cc1ccc(F)cc1C#CC[NH3+]	ZINC000049608404	526251639	/nfs/dbraw/zinc/25/16/39/526251639.db2.gz	KZUJRQPBIJZWRP-ZDUSSCGKSA-N	2	0	260.356	2.510	10	30		CFEERP
[NH3+]CC#Cc1ccc(C[NH+]2CCCCCC2)c(F)c1	ZINC000049608483	527148768	/nfs/dbraw/zinc/14/87/68/527148768.db2.gz	CAEVNRNIMGKTHS-UHFFFAOYSA-N	2	0	260.356	2.512	10	30		CFEERP
[NH3+]CC#Cc1cccc(C[NH+]2CCCCCCC2)c1	ZINC000049608788	527152180	/nfs/dbraw/zinc/15/21/80/527152180.db2.gz	CDBITGFWPNNTHJ-UHFFFAOYSA-N	2	0	256.393	2.763	10	30		CFEERP
C[NH+](C)Cc1ccccc1C[NH2+]Cc1ccc(C#N)cc1	ZINC000020128635	171015635	/nfs/dbraw/zinc/01/56/35/171015635.db2.gz	XGUJPBVVZMLERH-UHFFFAOYSA-N	2	0	279.387	2.910	10	30		CFEERP
CC[C@H]1CCC[N@H+](Cc2ccc(C#CC[NH3+])s2)C1	ZINC000043683722	175091955	/nfs/dbraw/zinc/09/19/55/175091955.db2.gz	UUEQMVFNEWRCPR-ZDUSSCGKSA-N	2	0	262.422	2.680	10	30		CFEERP
CCC[N@H+](Cc1ccc(C#CC[NH3+])cc1F)C1CC1	ZINC000049608969	521681632	/nfs/dbraw/zinc/68/16/32/521681632.db2.gz	JTLMSIJPURTZOG-UHFFFAOYSA-N	2	0	260.356	2.510	10	30		CFEERP
CC(C)C[C@H]1CSC(N[C@@H](C[NH+](C)C)C(C)C)=[NH+]1	ZINC000049222047	519416741	/nfs/dbraw/zinc/41/67/41/519416741.db2.gz	MMDXVSRXGOQOGX-STQMWFEESA-N	2	0	271.474	2.680	10	30		CFEERP
CC(C)[C@@H](C)[N@H+](C)Cc1ccc(F)c(C#CC[NH3+])c1	ZINC000049609239	519791184	/nfs/dbraw/zinc/79/11/84/519791184.db2.gz	WTOUNQPPPBUGEW-CYBMUJFWSA-N	2	0	262.372	2.612	10	30		CFEERP
CC(C)[C@H](C)[N@H+](C)Cc1ccc(F)c(C#CC[NH3+])c1	ZINC000049609240	519811906	/nfs/dbraw/zinc/81/19/06/519811906.db2.gz	WTOUNQPPPBUGEW-ZDUSSCGKSA-N	2	0	262.372	2.612	10	30		CFEERP
CCC1CC[NH+](Cc2ccc(OC)c(C#CC[NH3+])c2)CC1	ZINC000049609927	519859483	/nfs/dbraw/zinc/85/94/83/519859483.db2.gz	SXHXUMUFRBEOPL-UHFFFAOYSA-N	2	0	286.419	2.627	10	30		CFEERP
CC[N@H+](Cc1ccccc1C#CC[NH3+])C1CCCC1	ZINC000049609166	521375767	/nfs/dbraw/zinc/37/57/67/521375767.db2.gz	GOVCQGDCTUTBEV-UHFFFAOYSA-N	2	0	256.393	2.761	10	30		CFEERP
C[N@H+](Cc1ccccc1C#CC[NH3+])C1CCCCC1	ZINC000049608578	523357584	/nfs/dbraw/zinc/35/75/84/523357584.db2.gz	QXMAODHUIXKGRG-UHFFFAOYSA-N	2	0	256.393	2.761	10	30		CFEERP
C[C@@H]1CCC[N@H+](Cc2ccccc2C#CC[NH3+])[C@@H]1C	ZINC000050566681	524235599	/nfs/dbraw/zinc/23/55/99/524235599.db2.gz	YPJFSMDEKGGTRP-HUUCEWRRSA-N	2	0	256.393	2.617	10	30		CFEERP
C[C@@H]1CCC[N@H+](Cc2ccc(F)c(C#CC[NH3+])c2)[C@@H]1C	ZINC000050566701	524236666	/nfs/dbraw/zinc/23/66/66/524236666.db2.gz	IRGZYZREDZBNRR-ZIAGYGMSSA-N	2	0	274.383	2.756	10	30		CFEERP
CC[C@H]1CCCC[N@@H+]1Cc1sccc1C#CC[NH3+]	ZINC000043683620	175091571	/nfs/dbraw/zinc/09/15/71/175091571.db2.gz	NOMMGWYGSWNNQM-AWEZNQCLSA-N	2	0	262.422	2.823	10	30		CFEERP
Cc1ccc(C[N@H+](C)Cc2ccc(C#CC[NH3+])s2)cc1	ZINC000043683581	175091879	/nfs/dbraw/zinc/09/18/79/175091879.db2.gz	KTCNEZUBQYUNBU-UHFFFAOYSA-N	2	0	284.428	2.999	10	30		CFEERP
CC[N@H+](Cc1ccco1)Cc1ccc(C#CC[NH3+])s1	ZINC000043683994	175091996	/nfs/dbraw/zinc/09/19/96/175091996.db2.gz	WGUGTXSGHQYBRL-UHFFFAOYSA-N	2	0	274.389	2.673	10	30		CFEERP
CC(C)[C@@H](C)[N@H+](C)Cc1sccc1C#CC[NH3+]	ZINC000043683708	175092241	/nfs/dbraw/zinc/09/22/41/175092241.db2.gz	YPZIUIWTDPFBSB-GFCCVEGCSA-N	2	0	250.411	2.535	10	30		CFEERP
CC[C@@H]1CCC[N@H+](Cc2cc(C#CC[NH3+])cs2)C1	ZINC000043688925	175095222	/nfs/dbraw/zinc/09/52/22/175095222.db2.gz	GUKMLBNQCUUUQJ-CYBMUJFWSA-N	2	0	262.422	2.680	10	30		CFEERP
C[C@H]1CCC[C@H](C)[NH+]1Cc1cc(C#CC[NH3+])cs1	ZINC000043688845	175095696	/nfs/dbraw/zinc/09/56/96/175095696.db2.gz	NAHLDWFKIQLVJR-STQMWFEESA-N	2	0	262.422	2.821	10	30		CFEERP
Cc1ccccc1C[N@H+](C)Cc1cc(C#CC[NH3+])cs1	ZINC000043689006	175096031	/nfs/dbraw/zinc/09/60/31/175096031.db2.gz	GXGKJDWAWPEKEY-UHFFFAOYSA-N	2	0	284.428	2.999	10	30		CFEERP
CCCCC[N@H+](C)Cc1ccc(OC)c(C#CC[NH3+])c1	ZINC000049609043	520150827	/nfs/dbraw/zinc/15/08/27/520150827.db2.gz	CVKJVCGDEBIEKT-UHFFFAOYSA-N	2	0	274.408	2.627	10	30		CFEERP
CCC(C)(C)[N@H+](C)Cc1ccc(C#CC[NH3+])s1	ZINC000069443122	521303894	/nfs/dbraw/zinc/30/38/94/521303894.db2.gz	LMMPFZVYNQQBQE-UHFFFAOYSA-N	2	0	250.411	2.679	10	30		CFEERP
CC[C@@H](C)C[N@H+](C)Cc1ccc(F)cc1C#CC[NH3+]	ZINC000049609029	521971217	/nfs/dbraw/zinc/97/12/17/521971217.db2.gz	PVYOHEMCKDVTEL-CYBMUJFWSA-N	2	0	262.372	2.614	10	30		CFEERP
C=C(C)C[N@H+](CC)CCOc1ccc(C[NH2+]C)cc1	ZINC000052423404	518600619	/nfs/dbraw/zinc/60/06/19/518600619.db2.gz	HSIWFPGSWTTZMG-UHFFFAOYSA-N	2	0	262.397	2.683	10	30		CFEERP
CC[N@H+](Cc1ccc(C#CC[NH3+])cc1F)C1CCCC1	ZINC000049609171	521298549	/nfs/dbraw/zinc/29/85/49/521298549.db2.gz	BMLMESXKXPRQAF-UHFFFAOYSA-N	2	0	274.383	2.900	10	30		CFEERP
CCC[N@H+](Cc1ccc(OC)c(C#CC[NH3+])c1)C(C)C	ZINC000049608957	521684221	/nfs/dbraw/zinc/68/42/21/521684221.db2.gz	XYZBMERIFBRUCZ-UHFFFAOYSA-N	2	0	274.408	2.626	10	30		CFEERP
CC[C@@H]1CCC[N@H+](Cc2ccc(F)cc2C#CC[NH3+])C1	ZINC000049609273	523253270	/nfs/dbraw/zinc/25/32/70/523253270.db2.gz	BYLYLWYMVZOVBP-CQSZACIVSA-N	2	0	274.383	2.758	10	30		CFEERP
C[N@H+](Cc1ccsc1)Cc1ccc(F)c(C#CC[NH3+])c1	ZINC000049609108	523483827	/nfs/dbraw/zinc/48/38/27/523483827.db2.gz	LQDXCSLYRTWGBF-UHFFFAOYSA-N	2	0	288.391	2.829	10	30		CFEERP
C[C@H]1CCC[C@H](C)[NH+]1Cc1ccc(F)c(C#CC[NH3+])c1	ZINC000049608745	524190908	/nfs/dbraw/zinc/19/09/08/524190908.db2.gz	CBTARHMEDJEQJF-KBPBESRZSA-N	2	0	274.383	2.899	10	30		CFEERP
C[C@H]1CCC[C@H](C)[NH+]1Cc1cccc(C#CC[NH3+])c1	ZINC000049608739	524191212	/nfs/dbraw/zinc/19/12/12/524191212.db2.gz	VEVATIFVIKLYBX-GJZGRUSLSA-N	2	0	256.393	2.760	10	30		CFEERP
Cc1ccccc1C[N@H+](C)Cc1cccc(C#CC[NH3+])c1	ZINC000049609774	525128318	/nfs/dbraw/zinc/12/83/18/525128318.db2.gz	GVVXSRFNNPCBQZ-UHFFFAOYSA-N	2	0	278.399	2.937	10	30		CFEERP
C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(F)cc2C#CC[NH3+])C1	ZINC000049608646	525385302	/nfs/dbraw/zinc/38/53/02/525385302.db2.gz	GOJWNQIVRSSGQV-OKILXGFUSA-N	2	0	274.383	2.614	10	30		CFEERP
C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1ccc(F)c(C#CC[NH3+])c1	ZINC000050566702	525641260	/nfs/dbraw/zinc/64/12/60/525641260.db2.gz	IRGZYZREDZBNRR-UONOGXRCSA-N	2	0	274.383	2.756	10	30		CFEERP
C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1cccc(C#CC[NH3+])c1	ZINC000050566698	525643095	/nfs/dbraw/zinc/64/30/95/525643095.db2.gz	OYLLGGUSAURAPP-LSDHHAIUSA-N	2	0	256.393	2.617	10	30		CFEERP
CC(C)[C@@H](C)[N@H+](C)Cc1ccc(C#CC[NH3+])s1	ZINC000043683705	175091777	/nfs/dbraw/zinc/09/17/77/175091777.db2.gz	FATHNTCGAKFJBO-GFCCVEGCSA-N	2	0	250.411	2.535	10	30		CFEERP
CCC1CC[NH+](Cc2sccc2C#CC[NH3+])CC1	ZINC000043684035	175092194	/nfs/dbraw/zinc/09/21/94/175092194.db2.gz	SRNWEGAVNRVOIO-UHFFFAOYSA-N	2	0	262.422	2.680	10	30		CFEERP
CC[C@H]1CCC[N@H+](Cc2sccc2C#CC[NH3+])C1	ZINC000043683725	175092214	/nfs/dbraw/zinc/09/22/14/175092214.db2.gz	ZUHTZDCBXXLPOQ-ZDUSSCGKSA-N	2	0	262.422	2.680	10	30		CFEERP
CCC[N@H+](Cc1sccc1C#CC[NH3+])C(C)C	ZINC000043683637	175092321	/nfs/dbraw/zinc/09/23/21/175092321.db2.gz	GAHFWZQYICMCJW-UHFFFAOYSA-N	2	0	250.411	2.679	10	30		CFEERP
CC[N@H+](Cc1ccco1)Cc1cc(C#CC[NH3+])cs1	ZINC000043689018	175095320	/nfs/dbraw/zinc/09/53/20/175095320.db2.gz	MXXNPXURLNXXTB-UHFFFAOYSA-N	2	0	274.389	2.673	10	30		CFEERP
CCC(CC)[N@H+](C)Cc1ccc(F)c(C#CC[NH3+])c1	ZINC000049609256	521541564	/nfs/dbraw/zinc/54/15/64/521541564.db2.gz	LFKOXSFIQOYCNN-UHFFFAOYSA-N	2	0	262.372	2.756	10	30		CFEERP
CCCC[N@H+](Cc1ccc(F)cc1C#CC[NH3+])C1CC1	ZINC000049609606	520543602	/nfs/dbraw/zinc/54/36/02/520543602.db2.gz	ZZFAFLWJGPPMDA-UHFFFAOYSA-N	2	0	274.383	2.900	10	30		CFEERP
CC[C@@H]1CCCC[N@@H+]1CCOc1cccc(C#CC[NH3+])c1	ZINC000049608913	523176033	/nfs/dbraw/zinc/17/60/33/523176033.db2.gz	AIBWJAUCWHISFY-QGZVFWFLSA-N	2	0	286.419	2.640	10	30		CFEERP
CC[C@@H]1CCCC[N@@H+]1Cc1ccc(F)cc1C#CC[NH3+]	ZINC000049608919	523178237	/nfs/dbraw/zinc/17/82/37/523178237.db2.gz	DUGQNTTVWMENCY-QGZVFWFLSA-N	2	0	274.383	2.900	10	30		CFEERP
CC[C@@H]1CCCC[N@@H+]1Cc1ccc(OC)c(C#CC[NH3+])c1	ZINC000049608911	523178385	/nfs/dbraw/zinc/17/83/85/523178385.db2.gz	LROHDWYAJXWEDH-QGZVFWFLSA-N	2	0	286.419	2.770	10	30		CFEERP
CC[C@@H]1CCC[N@H+](Cc2cc(C#CC[NH3+])ccc2OC)C1	ZINC000049609263	523248965	/nfs/dbraw/zinc/24/89/65/523248965.db2.gz	FOWRKMILVULGQW-OAHLLOKOSA-N	2	0	286.419	2.627	10	30		CFEERP
CC[C@H](C)[N@H+](CC)Cc1cc(C#CC[NH3+])ccc1OC	ZINC000049608940	523934956	/nfs/dbraw/zinc/93/49/56/523934956.db2.gz	JJNGIGNAJIHWRE-AWEZNQCLSA-N	2	0	274.408	2.626	10	30		CFEERP
COc1ccc(C[NH+]2CCCCCCC2)cc1C#CC[NH3+]	ZINC000049608785	524025236	/nfs/dbraw/zinc/02/52/36/524025236.db2.gz	QXGRUZBMGNTXEE-UHFFFAOYSA-N	2	0	286.419	2.772	10	30		CFEERP
[NH3+]CC#Cc1cc(F)ccc1C[NH+]1CCCCCCC1	ZINC000049608789	527147123	/nfs/dbraw/zinc/14/71/23/527147123.db2.gz	KRZGQQRZNYQYQZ-UHFFFAOYSA-N	2	0	274.383	2.902	10	30		CFEERP
[NH3+]CC#Cc1ccc(OCC[NH+]2CCCCCCC2)cc1	ZINC000049608781	527152330	/nfs/dbraw/zinc/15/23/30/527152330.db2.gz	VYTUHXUALWNRLC-UHFFFAOYSA-N	2	0	286.419	2.642	10	30		CFEERP
CC[C@@H](C)[N@H+](CC)Cc1sccc1C#CC[NH3+]	ZINC000043683630	175091538	/nfs/dbraw/zinc/09/15/38/175091538.db2.gz	CXGAIEGZQDFXIF-GFCCVEGCSA-N	2	0	250.411	2.679	10	30		CFEERP
Cc1cccc(C[N@H+](C)Cc2sccc2C#CC[NH3+])c1	ZINC000043684055	175092248	/nfs/dbraw/zinc/09/22/48/175092248.db2.gz	DRJAOOJRFLKWAR-UHFFFAOYSA-N	2	0	284.428	2.999	10	30		CFEERP
CCC(CC)[N@H+](CCOC)Cc1sccc1C#CC[NH3+]	ZINC000043684226	175092576	/nfs/dbraw/zinc/09/25/76/175092576.db2.gz	DATFCEADJWOIKS-UHFFFAOYSA-N	2	0	294.464	2.695	10	30		CFEERP
CCCCC[N@H+](C)Cc1ccc(F)c(C#CC[NH3+])c1	ZINC000049609048	520153290	/nfs/dbraw/zinc/15/32/90/520153290.db2.gz	GEELSAZREFLQJY-UHFFFAOYSA-N	2	0	262.372	2.758	10	30		CFEERP
CC(C)[C@H](C)[N@H+](C)Cc1ccc(C#CC[NH3+])cc1F	ZINC000049609234	519811811	/nfs/dbraw/zinc/81/18/11/519811811.db2.gz	XCQOWQALSPTRRN-ZDUSSCGKSA-N	2	0	262.372	2.612	10	30		CFEERP
CCCCCCC[C@@H](C[NH3+])N1CC[NH+](C(C)C)CC1	ZINC000059352352	520066879	/nfs/dbraw/zinc/06/68/79/520066879.db2.gz	XWIYWELUNMIABM-INIZCTEOSA-N	2	0	269.477	2.700	10	30		CFEERP
CC[N@H+](Cc1ccco1)Cc1ccc(F)c(C#CC[NH3+])c1	ZINC000049609862	521399396	/nfs/dbraw/zinc/39/93/96/521399396.db2.gz	GVCVGOCYTUAEIR-UHFFFAOYSA-N	2	0	286.350	2.751	10	30		CFEERP
COc1ccc(C#CC[NH3+])cc1C[NH+]1[C@H](C)CCC[C@H]1C	ZINC000049608728	523514515	/nfs/dbraw/zinc/51/45/15/523514515.db2.gz	OXEILHLOQYBXIG-HUUCEWRRSA-N	2	0	286.419	2.768	10	30		CFEERP
COc1ccc(C[NH+]2[C@@H](C)CCC[C@@H]2C)cc1C#CC[NH3+]	ZINC000049608730	524043597	/nfs/dbraw/zinc/04/35/97/524043597.db2.gz	YZCPROQKALEPCP-GJZGRUSLSA-N	2	0	286.419	2.768	10	30		CFEERP
C[C@@H]1CCC[C@H](C)[N@H+]1Cc1ccc(C#CC[NH3+])cc1F	ZINC000049608735	524362961	/nfs/dbraw/zinc/36/29/61/524362961.db2.gz	OWZJTGXEOOTKPZ-OKILXGFUSA-N	2	0	274.383	2.899	10	30		CFEERP
C[C@H]1C[C@H](C)C[NH+](Cc2ccc(F)c(C#CC[NH3+])c2)C1	ZINC000049608650	524884314	/nfs/dbraw/zinc/88/43/14/524884314.db2.gz	LAZFABDEXXNRHQ-KBPBESRZSA-N	2	0	274.383	2.614	10	30		CFEERP
C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(F)c(C#CC[NH3+])c2)C1	ZINC000049608649	525385680	/nfs/dbraw/zinc/38/56/80/525385680.db2.gz	LAZFABDEXXNRHQ-OKILXGFUSA-N	2	0	274.383	2.614	10	30		CFEERP
C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1ccccc1C#CC[NH3+]	ZINC000050566682	525641219	/nfs/dbraw/zinc/64/12/19/525641219.db2.gz	YPJFSMDEKGGTRP-LSDHHAIUSA-N	2	0	256.393	2.617	10	30		CFEERP
[NH3+]CC#Cc1cccc(C[N@@H+]2CCc3sccc3C2)c1	ZINC000049608510	527151169	/nfs/dbraw/zinc/15/11/69/527151169.db2.gz	AQZGRDBWUNTMQD-UHFFFAOYSA-N	2	0	282.412	2.617	10	30		CFEERP
C[C@H]([NH2+][C@H]1CCC[N@H+](C)CC1)c1ccc(C#N)cc1	ZINC000086817885	179345844	/nfs/dbraw/zinc/34/58/44/179345844.db2.gz	PAXBTEMLDIGBJH-BBRMVZONSA-N	2	0	257.381	2.693	10	30		CFEERP
C[NH+](C)CC1CC[NH+]([C@H]2CCCCC[C@H]2C#N)CC1	ZINC000042393658	174708039	/nfs/dbraw/zinc/70/80/39/174708039.db2.gz	PTAGXGBLZOHOBC-HOTGVXAUSA-N	2	0	263.429	2.732	10	30		CFEERP
CCC[C@@H](C)[N@H+](C)Cc1sccc1C#CC[NH3+]	ZINC000043683747	175091715	/nfs/dbraw/zinc/09/17/15/175091715.db2.gz	AGOLPKGNENTDGQ-GFCCVEGCSA-N	2	0	250.411	2.679	10	30		CFEERP
Cc1ccccc1C[N@H+](C)Cc1ccc(C#CC[NH3+])s1	ZINC000043683946	175091961	/nfs/dbraw/zinc/09/19/61/175091961.db2.gz	CZQNSUAKQYKFCL-UHFFFAOYSA-N	2	0	284.428	2.999	10	30		CFEERP
CC[C@H](C)[N@H+](CC)Cc1ccc(C#CC[NH3+])s1	ZINC000043683628	175092183	/nfs/dbraw/zinc/09/21/83/175092183.db2.gz	LOABUSKRKBOMGZ-LBPRGKRZSA-N	2	0	250.411	2.679	10	30		CFEERP
CCC(CC)[N@H+](CCOC)Cc1cc(C#CC[NH3+])cs1	ZINC000043689117	175095362	/nfs/dbraw/zinc/09/53/62/175095362.db2.gz	RFXNFAJWFUGJCU-UHFFFAOYSA-N	2	0	294.464	2.695	10	30		CFEERP
CC(C)C[N@H+](Cc1cc(C#CC[NH3+])cs1)C1CC1	ZINC000043689101	175096002	/nfs/dbraw/zinc/09/60/02/175096002.db2.gz	YHVQWROAOOLVAI-UHFFFAOYSA-N	2	0	262.422	2.679	10	30		CFEERP
CC(C)CC[N@H+](C)Cc1ccc(C#CC[NH3+])cc1F	ZINC000049609904	519651074	/nfs/dbraw/zinc/65/10/74/519651074.db2.gz	WFYACQVFKLLKHY-UHFFFAOYSA-N	2	0	262.372	2.614	10	30		CFEERP
CCC1CC[NH+](Cc2ccccc2C#CC[NH3+])CC1	ZINC000049609924	519859614	/nfs/dbraw/zinc/85/96/14/519859614.db2.gz	NTSQBZBZTCVJMS-UHFFFAOYSA-N	2	0	256.393	2.619	10	30		CFEERP
CC[C@H]1CCC[N@H+](Cc2ccc(F)cc2C#CC[NH3+])C1	ZINC000049609274	523092838	/nfs/dbraw/zinc/09/28/38/523092838.db2.gz	BYLYLWYMVZOVBP-AWEZNQCLSA-N	2	0	274.383	2.758	10	30		CFEERP
CC[C@@H]1CCCC[N@@H+]1Cc1ccc(C#CC[NH3+])cc1	ZINC000049608907	523178003	/nfs/dbraw/zinc/17/80/03/523178003.db2.gz	QTGDXYLAPSASJU-QGZVFWFLSA-N	2	0	256.393	2.761	10	30		CFEERP
CC[C@@H]1CCC[N@H+](Cc2cccc(C#CC[NH3+])c2)C1	ZINC000049609271	523251846	/nfs/dbraw/zinc/25/18/46/523251846.db2.gz	HXFGPHWTRZJLGB-OAHLLOKOSA-N	2	0	256.393	2.619	10	30		CFEERP
CC[C@@H]1CCC[N@H+](Cc2ccc(F)c(C#CC[NH3+])c2)C1	ZINC000049609275	523252883	/nfs/dbraw/zinc/25/28/83/523252883.db2.gz	CDTGYWWXTRZDRI-CQSZACIVSA-N	2	0	274.383	2.758	10	30		CFEERP
C[N@H+](Cc1cc(C#CC[NH3+])cs1)C1CCCCC1	ZINC000043690889	570261709	/nfs/dbraw/zinc/26/17/09/570261709.db2.gz	YCSCOHNDBOLBGQ-UHFFFAOYSA-N	2	0	262.422	2.823	10	30		CFEERP
C[N@H+](Cc1cc(C#CC[NH3+])cs1)Cc1ccc(F)cc1	ZINC000043689035	175095803	/nfs/dbraw/zinc/09/58/03/175095803.db2.gz	SDFSMNYFIMISCA-UHFFFAOYSA-N	2	0	288.391	2.829	10	30		CFEERP
C[N@H+](Cc1ccc(C#CC[NH3+])s1)CC(C)(C)C	ZINC000045086717	175304312	/nfs/dbraw/zinc/30/43/12/175304312.db2.gz	JXQIUTYVYFSFOU-UHFFFAOYSA-N	2	0	250.411	2.536	10	30		CFEERP
CC(C)C[C@H]1CSC(N[C@@H](C)C[NH+]2CCCC2)=[NH+]1	ZINC000049185298	519418011	/nfs/dbraw/zinc/41/80/11/519418011.db2.gz	CNEWSJVLWMNHAH-STQMWFEESA-N	2	0	269.458	2.578	10	30		CFEERP
CC(C)[N@H+](C)CCCC[NH2+][C@@H]1CCCC[C@@H]1C#N	ZINC000054828570	519616827	/nfs/dbraw/zinc/61/68/27/519616827.db2.gz	OXMDHXYLFNCOPY-HUUCEWRRSA-N	2	0	251.418	2.779	10	30		CFEERP
CCC[N@@H+](Cc1ccccc1C#CC[NH3+])CC1CC1	ZINC000049609633	521686742	/nfs/dbraw/zinc/68/67/42/521686742.db2.gz	OXZGVBAIUVOYHH-UHFFFAOYSA-N	2	0	256.393	2.619	10	30		CFEERP
CC[C@H](C)[N@H+](CC)Cc1ccc(F)cc1C#CC[NH3+]	ZINC000049608950	523934052	/nfs/dbraw/zinc/93/40/52/523934052.db2.gz	AOIPJZJTLDONEQ-ZDUSSCGKSA-N	2	0	262.372	2.756	10	30		CFEERP
C[C@@H]1CCCC[N@@H+]1Cc1ccc(F)cc1C#CC[NH3+]	ZINC000049608403	524114104	/nfs/dbraw/zinc/11/41/04/524114104.db2.gz	KZUJRQPBIJZWRP-CYBMUJFWSA-N	2	0	260.356	2.510	10	30		CFEERP
C[C@H]1CCC[C@H](C)[NH+]1CCOc1ccc(C#CC[NH3+])cc1	ZINC000049608718	524191507	/nfs/dbraw/zinc/19/15/07/524191507.db2.gz	RDNIJWMLAUGHHE-HOTGVXAUSA-N	2	0	286.419	2.639	10	30		CFEERP
C[C@@H]1CCC[C@H](C)[N@H+]1CCOc1ccc(C#CC[NH3+])cc1	ZINC000049608717	524364096	/nfs/dbraw/zinc/36/40/96/524364096.db2.gz	RDNIJWMLAUGHHE-IYBDPMFKSA-N	2	0	286.419	2.639	10	30		CFEERP
CCCCCCC[N@H+](C)CC1CC[NH+](C[C@H](C)O)CC1	ZINC000172655804	623297947	/nfs/dbraw/zinc/29/79/47/623297947.db2.gz	QUXKVQZKZFZPMP-INIZCTEOSA-N	2	0	284.488	2.981	10	30		CFEERP
C[N@@H+](Cc1ccsc1)Cc1ccc(C#CC[NH3+])s1	ZINC000043683677	175092179	/nfs/dbraw/zinc/09/21/79/175092179.db2.gz	VVADNBBLHCGXHR-UHFFFAOYSA-N	2	0	276.430	2.752	10	30		CFEERP
CC(C)C[N@H+](Cc1sccc1C#CC[NH3+])C1CC1	ZINC000043684182	175092846	/nfs/dbraw/zinc/09/28/46/175092846.db2.gz	RZFQQJKDNXFVPR-UHFFFAOYSA-N	2	0	262.422	2.679	10	30		CFEERP
CCC[NH+](CCC)Cc1cc(C#CC[NH3+])cs1	ZINC000043688806	175095334	/nfs/dbraw/zinc/09/53/34/175095334.db2.gz	RECRCDHAPAQCRI-UHFFFAOYSA-N	2	0	250.411	2.680	10	30		CFEERP
CCC1CC[NH+](Cc2cccc(C#CC[NH3+])c2)CC1	ZINC000049609930	519859402	/nfs/dbraw/zinc/85/94/02/519859402.db2.gz	QPDZRUVHOKWAEI-UHFFFAOYSA-N	2	0	256.393	2.619	10	30		CFEERP
C=C(C)C[N@H+](CC)CCOc1cccc(C[NH2+]C)c1	ZINC000052423396	518598839	/nfs/dbraw/zinc/59/88/39/518598839.db2.gz	BWRCKJZOSCICLJ-UHFFFAOYSA-N	2	0	262.397	2.683	10	30		CFEERP
CCC[NH+]1CCC([C@H](C)[NH2+][C@H](CC)CC#N)CC1	ZINC000054183406	519847720	/nfs/dbraw/zinc/84/77/20/519847720.db2.gz	NQRBEAQWIGMSJB-DZGCQCFKSA-N	2	0	251.418	2.779	10	30		CFEERP
CCC[C@H](C)[N@H+](C)Cc1ccc(C#CC[NH3+])cc1F	ZINC000049609318	521035088	/nfs/dbraw/zinc/03/50/88/521035088.db2.gz	QIOCCXVEIOXQNV-ZDUSSCGKSA-N	2	0	262.372	2.756	10	30		CFEERP
CCC(C)(C)[N@H+](C)Cc1sccc1C#CC[NH3+]	ZINC000069443118	521307358	/nfs/dbraw/zinc/30/73/58/521307358.db2.gz	GPNJSWVEOMXOIM-UHFFFAOYSA-N	2	0	250.411	2.679	10	30		CFEERP
CCC[N@H+](Cc1ccc(F)cc1C#CC[NH3+])C(C)C	ZINC000049608961	521684284	/nfs/dbraw/zinc/68/42/84/521684284.db2.gz	JKZPFVRCHAIBTK-UHFFFAOYSA-N	2	0	262.372	2.756	10	30		CFEERP
CC[C@H]1CCCC[N@@H+]1CCOc1cccc(C#CC[NH3+])c1	ZINC000049608914	523028035	/nfs/dbraw/zinc/02/80/35/523028035.db2.gz	AIBWJAUCWHISFY-KRWDZBQOSA-N	2	0	286.419	2.640	10	30		CFEERP
C[N@H+](Cc1ccc(F)cc1)Cc1cccc(C#CC[NH3+])c1	ZINC000049609960	523251119	/nfs/dbraw/zinc/25/11/19/523251119.db2.gz	XJKFALMEQUGEHG-UHFFFAOYSA-N	2	0	282.362	2.768	10	30		CFEERP
C[N@H+](Cc1ccccc1)Cc1cccc(C#CC[NH3+])c1	ZINC000049608526	523346057	/nfs/dbraw/zinc/34/60/57/523346057.db2.gz	AGCBAIZSZNWJGE-UHFFFAOYSA-N	2	0	264.372	2.629	10	30		CFEERP
Cc1cccc(C[N@H+](C)Cc2ccc(C#CC[NH3+])cc2)c1	ZINC000049609962	524376303	/nfs/dbraw/zinc/37/63/03/524376303.db2.gz	UXTVMDFMDBVPIA-UHFFFAOYSA-N	2	0	278.399	2.937	10	30		CFEERP
[NH3+]CC#Cc1cc(F)ccc1C[NH+]1CCCCCC1	ZINC000049608485	527146316	/nfs/dbraw/zinc/14/63/16/527146316.db2.gz	BHCHISVUUUNZOP-UHFFFAOYSA-N	2	0	260.356	2.512	10	30		CFEERP
C=CCOc1ccc(C[NH2+]CCC[NH2+]CC)cc1OCC	ZINC000013735039	170584358	/nfs/dbraw/zinc/58/43/58/170584358.db2.gz	KCZCHRUKXUZRSM-UHFFFAOYSA-N	2	0	292.423	2.739	10	30		CFEERP
C[C@H]1CCC[C@H](C)[NH+]1Cc1ccc(C#CC[NH3+])s1	ZINC000043683564	175092271	/nfs/dbraw/zinc/09/22/71/175092271.db2.gz	LFQMBPIGWAXXKI-STQMWFEESA-N	2	0	262.422	2.821	10	30		CFEERP
CC(C)[N@@H+](Cc1ccc(C#CC[NH3+])s1)CC1CC1	ZINC000043684193	175092783	/nfs/dbraw/zinc/09/27/83/175092783.db2.gz	AQGSUBZILQWOTM-UHFFFAOYSA-N	2	0	262.422	2.679	10	30		CFEERP
C[C@H]([N@H+](C)Cc1sccc1C#CC[NH3+])C(C)(C)C	ZINC000043684251	175092887	/nfs/dbraw/zinc/09/28/87/175092887.db2.gz	TVJOHDRBUORDHK-LBPRGKRZSA-N	2	0	264.438	2.925	10	30		CFEERP
C[N@H+](Cc1cc(C#CC[NH3+])cs1)Cc1ccccc1	ZINC000043688810	175096012	/nfs/dbraw/zinc/09/60/12/175096012.db2.gz	KJGAVQAURZZWIB-UHFFFAOYSA-N	2	0	270.401	2.690	10	30		CFEERP
CCCCC[N@H+](C)Cc1cc(C#CC[NH3+])ccc1OC	ZINC000049609042	520153052	/nfs/dbraw/zinc/15/30/52/520153052.db2.gz	WMCILYZWDYQCQG-UHFFFAOYSA-N	2	0	274.408	2.627	10	30		CFEERP
CCCC[N@H+](CC)Cc1ccc(F)cc1C#CC[NH3+]	ZINC000049608566	520478191	/nfs/dbraw/zinc/47/81/91/520478191.db2.gz	CBIDKGYCLWIPKC-UHFFFAOYSA-N	2	0	262.372	2.758	10	30		CFEERP
CC[N@H+](Cc1cccc(C#CC[NH3+])c1)C1CCCC1	ZINC000049609172	521336884	/nfs/dbraw/zinc/33/68/84/521336884.db2.gz	FCCVRIPGBZMLQN-UHFFFAOYSA-N	2	0	256.393	2.761	10	30		CFEERP
C=CC[NH+](CC=C)CCOc1cccc(C[NH2+]CC)c1	ZINC000052376531	518769430	/nfs/dbraw/zinc/76/94/30/518769430.db2.gz	ZQENGFMLOFQQBL-UHFFFAOYSA-N	2	0	274.408	2.849	10	30		CFEERP
C=CC[NH+](CC=C)C[C@@H]1CC[C@@H](C[NH2+]C(C)(C)C)O1	ZINC000052376700	518771553	/nfs/dbraw/zinc/77/15/53/518771553.db2.gz	OOZCBRGWWKZPTR-GJZGRUSLSA-N	2	0	266.429	2.596	10	30		CFEERP
CCC[N@H+](Cc1ccc(F)cc1C#CC[NH3+])C1CC1	ZINC000049608971	521684076	/nfs/dbraw/zinc/68/40/76/521684076.db2.gz	CKJUEFPPPWJGIC-UHFFFAOYSA-N	2	0	260.356	2.510	10	30		CFEERP
CC[C@H]1CCC[N@@H+]1Cc1ccc(C#CC[NH3+])cc1F	ZINC000049608271	523107263	/nfs/dbraw/zinc/10/72/63/523107263.db2.gz	IHCMCYXIVQFYIF-HNNXBMFYSA-N	2	0	260.356	2.510	10	30		CFEERP
CC[C@@H]1CCC[N@@H+]1Cc1ccc(C#CC[NH3+])cc1F	ZINC000049608270	523270269	/nfs/dbraw/zinc/27/02/69/523270269.db2.gz	IHCMCYXIVQFYIF-OAHLLOKOSA-N	2	0	260.356	2.510	10	30		CFEERP
C[C@H]1CCC[C@H](C)[NH+]1Cc1ccc(F)cc1C#CC[NH3+]	ZINC000049608742	524190671	/nfs/dbraw/zinc/19/06/71/524190671.db2.gz	TVMUQKVLQIBTFK-KBPBESRZSA-N	2	0	274.383	2.899	10	30		CFEERP
C[C@@H]1CCC[C@@H](C)[NH+]1Cc1ccc(C#CC[NH3+])cc1F	ZINC000049608737	524279496	/nfs/dbraw/zinc/27/94/96/524279496.db2.gz	OWZJTGXEOOTKPZ-ZIAGYGMSSA-N	2	0	274.383	2.899	10	30		CFEERP
C[C@@H]1CCC[C@H](C)[N@H+]1Cc1cccc(C#CC[NH3+])c1	ZINC000049608738	524364340	/nfs/dbraw/zinc/36/43/40/524364340.db2.gz	VEVATIFVIKLYBX-GASCZTMLSA-N	2	0	256.393	2.760	10	30		CFEERP
C=CC[C@@H]1CCCC[C@@H]1[NH2+]C[C@H](O)C[NH+]1CCCCC1	ZINC000657844051	413997128	/nfs/dbraw/zinc/99/71/28/413997128.db2.gz	GMWJFZDGLMKUQQ-IKGGRYGDSA-N	2	0	280.456	2.558	10	30		CFEERP
CC(C)[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(C#N)cc2)C1	ZINC000040621334	174354666	/nfs/dbraw/zinc/35/46/66/174354666.db2.gz	IYHZMFSKHXFPAS-GOEBONIOSA-N	2	0	271.408	2.939	10	30		CFEERP
C[C@H](c1ccc(C#N)cc1)[N@H+]1[C@@H]2CC[C@H]1CC([NH3+])C2	ZINC000040749003	174393986	/nfs/dbraw/zinc/39/39/86/174393986.db2.gz	KNOGLYHKMHSLQU-GVZPALNKSA-N	2	0	255.365	2.573	10	30		CFEERP
CC[C@@H](C)C[N@H+](C)Cc1ccc(C#CC[NH3+])s1	ZINC000043683657	175091623	/nfs/dbraw/zinc/09/16/23/175091623.db2.gz	QESKOTNCNNEAEL-GFCCVEGCSA-N	2	0	250.411	2.536	10	30		CFEERP
CCC1CC[NH+](Cc2ccc(C#CC[NH3+])s2)CC1	ZINC000043684033	175092402	/nfs/dbraw/zinc/09/24/02/175092402.db2.gz	YQZOFKIBWIPYGS-UHFFFAOYSA-N	2	0	262.422	2.680	10	30		CFEERP
CC(C)C[C@H](C)[N@H+](C)Cc1ccc(C#CC[NH3+])s1	ZINC000043684184	175093134	/nfs/dbraw/zinc/09/31/34/175093134.db2.gz	IIXJWWXUULKEKK-ZDUSSCGKSA-N	2	0	264.438	2.925	10	30		CFEERP
[NH3+]CC#Cc1csc(C[NH+]2CCCCCCC2)c1	ZINC000043688860	175095338	/nfs/dbraw/zinc/09/53/38/175095338.db2.gz	KJLMOMGALWBLER-UHFFFAOYSA-N	2	0	262.422	2.824	10	30		CFEERP
CC(C)[N@@H+](Cc1cc(C#CC[NH3+])cs1)CC1CC1	ZINC000043689107	175095745	/nfs/dbraw/zinc/09/57/45/175095745.db2.gz	PKIIUWDIJMEBOB-UHFFFAOYSA-N	2	0	262.422	2.679	10	30		CFEERP
CC[N@@H+](Cc1cc(C#CC[NH3+])cs1)CC(C)C	ZINC000043688879	175095760	/nfs/dbraw/zinc/09/57/60/175095760.db2.gz	XCRDYYWXNFCNRA-UHFFFAOYSA-N	2	0	250.411	2.536	10	30		CFEERP
CC(C)C[C@@H](C)[N@H+](C)Cc1cc(C#CC[NH3+])cs1	ZINC000043689102	175095933	/nfs/dbraw/zinc/09/59/33/175095933.db2.gz	LOEMRCKOUIOXTB-CYBMUJFWSA-N	2	0	264.438	2.925	10	30		CFEERP
C[C@@H]1C[C@H](C)C[N@@H+](Cc2cc(C#CC[NH3+])cs2)C1	ZINC000043688827	175095947	/nfs/dbraw/zinc/09/59/47/175095947.db2.gz	PQGVNPLVGDCYMJ-BETUJISGSA-N	2	0	262.422	2.536	10	30		CFEERP
CC(C)[N@H+](C)CCCC[NH2+]Cc1cccc(C#N)c1	ZINC000044573150	175210208	/nfs/dbraw/zinc/21/02/08/175210208.db2.gz	IAEHWYFSJAGCHY-UHFFFAOYSA-N	2	0	259.397	2.768	10	30		CFEERP
C[N@H+](Cc1ccc(C#CC[NH3+])cc1F)CC(C)(C)C	ZINC000045086738	175304428	/nfs/dbraw/zinc/30/44/28/175304428.db2.gz	HYUYTTZVRFXKHQ-UHFFFAOYSA-N	2	0	262.372	2.614	10	30		CFEERP
CC(C)CC[N@H+](C)Cc1ccc(F)c(C#CC[NH3+])c1	ZINC000049609907	519650750	/nfs/dbraw/zinc/65/07/50/519650750.db2.gz	MTKFUMGTXZPEGS-UHFFFAOYSA-N	2	0	262.372	2.614	10	30		CFEERP
CCC[C@H](C)[N@H+](C)Cc1ccc(F)c(C#CC[NH3+])c1	ZINC000049609324	521035109	/nfs/dbraw/zinc/03/51/09/521035109.db2.gz	QKZWFRAXHDOJBL-ZDUSSCGKSA-N	2	0	262.372	2.756	10	30		CFEERP
CC[C@@H]1CCC[N@@H+]1Cc1ccc(F)cc1C#CC[NH3+]	ZINC000049608274	523268516	/nfs/dbraw/zinc/26/85/16/523268516.db2.gz	AJFFZGMKJAAPII-MRXNPFEDSA-N	2	0	260.356	2.510	10	30		CFEERP
C[N@H+](Cc1cccc(C#CC[NH3+])c1)C1CCCCC1	ZINC000049608585	523289919	/nfs/dbraw/zinc/28/99/19/523289919.db2.gz	IWNXNJBUKGTQOB-UHFFFAOYSA-N	2	0	256.393	2.761	10	30		CFEERP
COc1ccc(C[N@H+](C)C2CCCCC2)cc1C#CC[NH3+]	ZINC000049608582	524001991	/nfs/dbraw/zinc/00/19/91/524001991.db2.gz	KYKHAPUVUZTKLB-UHFFFAOYSA-N	2	0	286.419	2.770	10	30		CFEERP
COc1ccc(C[N@H+]2[C@H](C)CCC[C@@H]2C)cc1C#CC[NH3+]	ZINC000049608729	524043558	/nfs/dbraw/zinc/04/35/58/524043558.db2.gz	YZCPROQKALEPCP-GASCZTMLSA-N	2	0	286.419	2.768	10	30		CFEERP
C[C@@H]1CCC[N@H+](Cc2ccc(C#CC[NH3+])cc2)[C@@H]1C	ZINC000050566683	524232128	/nfs/dbraw/zinc/23/21/28/524232128.db2.gz	OHMVOXWTUTWPJV-HUUCEWRRSA-N	2	0	256.393	2.617	10	30		CFEERP
C[C@@H]1CCC[N@H+](Cc2ccc(F)cc2C#CC[NH3+])[C@@H]1C	ZINC000050566699	524235086	/nfs/dbraw/zinc/23/50/86/524235086.db2.gz	FQHHYWXWSQXIGL-ZIAGYGMSSA-N	2	0	274.383	2.756	10	30		CFEERP
C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1ccc(C#CC[NH3+])cc1	ZINC000050566684	525641843	/nfs/dbraw/zinc/64/18/43/525641843.db2.gz	OHMVOXWTUTWPJV-LSDHHAIUSA-N	2	0	256.393	2.617	10	30		CFEERP
C[C@H]([NH2+][C@@H]1CCC[N@H+](C)CC1)c1ccc(C#N)cc1	ZINC000086817883	179346068	/nfs/dbraw/zinc/34/60/68/179346068.db2.gz	PAXBTEMLDIGBJH-XJKSGUPXSA-N	2	0	257.381	2.693	10	30		CFEERP
CCCC[N@H+](Cc1ccc(C#CC[NH3+])s1)C1CC1	ZINC000043683846	175092076	/nfs/dbraw/zinc/09/20/76/175092076.db2.gz	VVHAWMPUQRFTHY-UHFFFAOYSA-N	2	0	262.422	2.823	10	30		CFEERP
C[N@H+](Cc1cc(C#CC[NH3+])cs1)Cc1cccc(F)c1	ZINC000043688862	175095925	/nfs/dbraw/zinc/09/59/25/175095925.db2.gz	PZMUZKAASFKIST-UHFFFAOYSA-N	2	0	288.391	2.829	10	30		CFEERP
CCC(CC)[N@H+](C)Cc1cc(C#CC[NH3+])ccc1OC	ZINC000049609250	521543499	/nfs/dbraw/zinc/54/34/99/521543499.db2.gz	KNRLFILRAHNYQH-UHFFFAOYSA-N	2	0	274.408	2.626	10	30		CFEERP
COc1ccc(C[NH+]2[C@H](C)CCC[C@H]2C)cc1C#CC[NH3+]	ZINC000049608731	524043492	/nfs/dbraw/zinc/04/34/92/524043492.db2.gz	YZCPROQKALEPCP-HUUCEWRRSA-N	2	0	286.419	2.768	10	30		CFEERP
C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1ccc(F)cc1C#CC[NH3+]	ZINC000050566700	525643145	/nfs/dbraw/zinc/64/31/45/525643145.db2.gz	FQHHYWXWSQXIGL-UONOGXRCSA-N	2	0	274.383	2.756	10	30		CFEERP
C[C@@H]([NH2+][C@@H]1CCC[N@H+](C)CC1)c1ccc(C#N)cc1	ZINC000086817884	179345903	/nfs/dbraw/zinc/34/59/03/179345903.db2.gz	PAXBTEMLDIGBJH-CZUORRHYSA-N	2	0	257.381	2.693	10	30		CFEERP
C[N@H+](CCS)CCCCCC[NH2+]Cc1ccccc1N	ZINC000584601652	348685577	/nfs/dbraw/zinc/68/55/77/348685577.db2.gz	JDIBDZMCWBXULR-UHFFFAOYSA-N	2	0	295.496	2.780	10	30		CFEERP
Cc1cc(N[C@@H]2CC[N@@H+]3CCCC[C@@H]23)c(C#N)c(C)n1	ZINC000219877162	393760797	/nfs/dbraw/zinc/76/07/97/393760797.db2.gz	UZHNBQCOFLPTOJ-ZBFHGGJFSA-N	2	0	270.380	2.609	10	30		CFEERP
C=CC[C@@H]1CCCC[C@H]1[NH2+]C[C@@H](O)C[NH+]1CCCCC1	ZINC000657844050	413997061	/nfs/dbraw/zinc/99/70/61/413997061.db2.gz	GMWJFZDGLMKUQQ-BRWVUGGUSA-N	2	0	280.456	2.558	10	30		CFEERP
CC[C@@H]1CCCC[N@@H+]1Cc1ccc(C#CC[NH3+])s1	ZINC000043683614	175091669	/nfs/dbraw/zinc/09/16/69/175091669.db2.gz	USRGFTWULDPWCG-CYBMUJFWSA-N	2	0	262.422	2.823	10	30		CFEERP
C[N@H+](Cc1cccs1)Cc1sccc1C#CC[NH3+]	ZINC000043683676	175091798	/nfs/dbraw/zinc/09/17/98/175091798.db2.gz	VNVAEZHWTMNSDN-UHFFFAOYSA-N	2	0	276.430	2.752	10	30		CFEERP
CC(C)C[C@H](C)[N@H+](C)Cc1sccc1C#CC[NH3+]	ZINC000043684186	175093013	/nfs/dbraw/zinc/09/30/13/175093013.db2.gz	SIYZWTAPDMSCSX-ZDUSSCGKSA-N	2	0	264.438	2.925	10	30		CFEERP
C[N@H+](Cc1cccs1)Cc1cc(C#CC[NH3+])cs1	ZINC000043688907	175095548	/nfs/dbraw/zinc/09/55/48/175095548.db2.gz	FVBHMSSJHVTSMZ-UHFFFAOYSA-N	2	0	276.430	2.752	10	30		CFEERP
C[C@@H]1C[C@@H](C)C[NH+](Cc2cc(C#CC[NH3+])cs2)C1	ZINC000043688830	175095844	/nfs/dbraw/zinc/09/58/44/175095844.db2.gz	PQGVNPLVGDCYMJ-CHWSQXEVSA-N	2	0	262.422	2.536	10	30		CFEERP
CC[C@@H](C)C[N@H+](C)Cc1ccc(C#CC[NH3+])cc1F	ZINC000049609025	521970065	/nfs/dbraw/zinc/97/00/65/521970065.db2.gz	IRRXBNMPXPTINZ-CYBMUJFWSA-N	2	0	262.372	2.614	10	30		CFEERP
CC[C@@H]1CCC[N@H+](Cc2ccccc2C#CC[NH3+])C1	ZINC000049609259	523251731	/nfs/dbraw/zinc/25/17/31/523251731.db2.gz	HHUOAKTWSAFANO-OAHLLOKOSA-N	2	0	256.393	2.619	10	30		CFEERP
C[N@H+](Cc1ccsc1)Cc1ccc(C#CC[NH3+])cc1	ZINC000049609101	523484623	/nfs/dbraw/zinc/48/46/23/523484623.db2.gz	QCNXJXSEVODXJB-UHFFFAOYSA-N	2	0	270.401	2.690	10	30		CFEERP
C[C@@H]1CCC[C@@H](C)[NH+]1Cc1ccc(C#CC[NH3+])cc1	ZINC000049608725	524278330	/nfs/dbraw/zinc/27/83/30/524278330.db2.gz	JELDLJKJYWXNHA-HUUCEWRRSA-N	2	0	256.393	2.760	10	30		CFEERP
C[C@@H]1CCC[C@@H](C)[NH+]1CCOc1ccc(C#CC[NH3+])cc1	ZINC000049608719	524280115	/nfs/dbraw/zinc/28/01/15/524280115.db2.gz	RDNIJWMLAUGHHE-HZPDHXFCSA-N	2	0	286.419	2.639	10	30		CFEERP
C[C@@H]1CCC[C@H](C)[N@H+]1Cc1ccc(F)c(C#CC[NH3+])c1	ZINC000049608744	524364436	/nfs/dbraw/zinc/36/44/36/524364436.db2.gz	CBTARHMEDJEQJF-OKILXGFUSA-N	2	0	274.383	2.899	10	30		CFEERP
[NH3+]CC#Cc1ccccc1C[NH+]1CCCCCCC1	ZINC000049608782	527153112	/nfs/dbraw/zinc/15/31/12/527153112.db2.gz	KPHNIKWWOFPRFI-UHFFFAOYSA-N	2	0	256.393	2.763	10	30		CFEERP
C=CC[N@@H+](C)CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1	ZINC000105862892	527572455	/nfs/dbraw/zinc/57/24/55/527572455.db2.gz	KVBXTZXGNSLSJJ-GOSISDBHSA-N	2	0	288.435	2.550	10	30		CFEERP
CC[C@@H]1CCCC[N@@H+]1Cc1sccc1C#CC[NH3+]	ZINC000043683618	175091645	/nfs/dbraw/zinc/09/16/45/175091645.db2.gz	NOMMGWYGSWNNQM-CQSZACIVSA-N	2	0	262.422	2.823	10	30		CFEERP
CC[C@H](C)C[N@H+](C)Cc1ccc(C#CC[NH3+])s1	ZINC000043683659	175091732	/nfs/dbraw/zinc/09/17/32/175091732.db2.gz	QESKOTNCNNEAEL-LBPRGKRZSA-N	2	0	250.411	2.536	10	30		CFEERP
C[C@H]([N@H+](C)Cc1ccc(C#CC[NH3+])s1)C(C)(C)C	ZINC000043684249	175092925	/nfs/dbraw/zinc/09/29/25/175092925.db2.gz	HIXUGLINRQZQFR-LBPRGKRZSA-N	2	0	264.438	2.925	10	30		CFEERP
Cc1ncsc1CN(C)C[C@H]1CC[N@H+](CCCC#N)C1	ZINC000195254437	262248816	/nfs/dbraw/zinc/24/88/16/262248816.db2.gz	AUYNKQCJFXRXCA-CQSZACIVSA-N	2	0	292.452	2.509	10	30		CFEERP
C=CCCCCC[N@@H+](C)CC1CC[NH+](C[C@H](C)O)CC1	ZINC000193336821	333248205	/nfs/dbraw/zinc/24/82/05/333248205.db2.gz	SPWBESRLCFUYLD-INIZCTEOSA-N	2	0	282.472	2.757	10	30		CFEERP
CC(C)CC[N@H+](C)Cc1ccc(F)cc1C#CC[NH3+]	ZINC000049609906	519650449	/nfs/dbraw/zinc/65/04/49/519650449.db2.gz	UJIBCECOXOKMBN-UHFFFAOYSA-N	2	0	262.372	2.614	10	30		CFEERP
CCC1CC[NH+](Cc2ccc(C#CC[NH3+])cc2)CC1	ZINC000049609925	519859673	/nfs/dbraw/zinc/85/96/73/519859673.db2.gz	OHLSXLHTOIYFAK-UHFFFAOYSA-N	2	0	256.393	2.619	10	30		CFEERP
CC[N@@H+](Cc1ccc(F)c(C#CC[NH3+])c1)CC(C)C	ZINC000049608852	521313666	/nfs/dbraw/zinc/31/36/66/521313666.db2.gz	BIFNPFAEKWYEBS-UHFFFAOYSA-N	2	0	262.372	2.614	10	30		CFEERP
CCC[NH+](CCC)Cc1ccc(F)cc1C#CC[NH3+]	ZINC000049608521	521649098	/nfs/dbraw/zinc/64/90/98/521649098.db2.gz	WGLRRCPYASLLGA-UHFFFAOYSA-N	2	0	262.372	2.758	10	30		CFEERP
CC[C@H]1CCCC[N@@H+]1Cc1ccc(F)c(C#CC[NH3+])c1	ZINC000049608922	523027194	/nfs/dbraw/zinc/02/71/94/523027194.db2.gz	GJFIVMZWOBICQP-INIZCTEOSA-N	2	0	274.383	2.900	10	30		CFEERP
CC[C@H]1CCC[N@@H+]1Cc1ccc(F)c(C#CC[NH3+])c1	ZINC000049608277	523108058	/nfs/dbraw/zinc/10/80/58/523108058.db2.gz	GPFJIFQTXXARJJ-HNNXBMFYSA-N	2	0	260.356	2.510	10	30		CFEERP
CC[C@@H]1CCCC[N@@H+]1Cc1cc(C#CC[NH3+])ccc1OC	ZINC000049608909	523178916	/nfs/dbraw/zinc/17/89/16/523178916.db2.gz	AVQCWGXWMKDZIH-QGZVFWFLSA-N	2	0	286.419	2.770	10	30		CFEERP
C[C@@H]1CCC[N@H+](Cc2ccc(C#CC[NH3+])s2)[C@@H]1C	ZINC000050566667	524233020	/nfs/dbraw/zinc/23/30/20/524233020.db2.gz	TUQVGDRAWUCQCI-CHWSQXEVSA-N	2	0	262.422	2.679	10	30		CFEERP
Cc1ccccc1C[N@H+](C)Cc1ccc(C#CC[NH3+])cc1	ZINC000049609773	525127408	/nfs/dbraw/zinc/12/74/08/525127408.db2.gz	WDYKNWSFZWVRMU-UHFFFAOYSA-N	2	0	278.399	2.937	10	30		CFEERP
C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1cc(C#CC[NH3+])cs1	ZINC000050566666	525638432	/nfs/dbraw/zinc/63/84/32/525638432.db2.gz	URIPLTDCDDVJBH-QWHCGFSZSA-N	2	0	262.422	2.679	10	30		CFEERP
Cc1occc1C[N@@H+](C)Cc1cccc(C#CC[NH3+])c1	ZINC000049609920	526824013	/nfs/dbraw/zinc/82/40/13/526824013.db2.gz	GYVYZRPKLYPMDM-UHFFFAOYSA-N	2	0	268.360	2.530	10	30		CFEERP
[NH3+]CC#Cc1ccccc1C[N@@H+]1CCc2ccccc2C1	ZINC000049608574	527153444	/nfs/dbraw/zinc/15/34/44/527153444.db2.gz	SDOHWRWDWYFKIQ-UHFFFAOYSA-N	2	0	276.383	2.555	10	30		CFEERP
Cc1cccc(NC[C@H]2CC[N@H+](Cc3ccc(C#N)o3)C2)[nH+]1	ZINC000092813158	375161221	/nfs/dbraw/zinc/16/12/21/375161221.db2.gz	IULCUDNZLXAFJO-CQSZACIVSA-N	2	0	296.374	2.789	10	30		CFEERP
CCCCC[N@H+](C)Cc1sccc1C#CC[NH3+]	ZINC000043683666	175091693	/nfs/dbraw/zinc/09/16/93/175091693.db2.gz	VFEAICWGSFNELY-UHFFFAOYSA-N	2	0	250.411	2.680	10	30		CFEERP
C[C@@H]1CCC[C@H](C)[N@H+]1Cc1sccc1C#CC[NH3+]	ZINC000043683566	175092123	/nfs/dbraw/zinc/09/21/23/175092123.db2.gz	XPMAIDHHPCCLMA-BETUJISGSA-N	2	0	262.422	2.821	10	30		CFEERP
CC[N@H+](Cc1ccc(C#CC[NH3+])s1)C1CCCC1	ZINC000043683691	175092382	/nfs/dbraw/zinc/09/23/82/175092382.db2.gz	OZMAHQIDANJKAH-UHFFFAOYSA-N	2	0	262.422	2.823	10	30		CFEERP
CCCC[N@H+](CC)Cc1ccc(C#CC[NH3+])cc1F	ZINC000049608564	520477879	/nfs/dbraw/zinc/47/78/79/520477879.db2.gz	JTMYSDJAWFVSBL-UHFFFAOYSA-N	2	0	262.372	2.758	10	30		CFEERP
CC(C)[C@@H](C)[N@H+](C)Cc1ccc(F)cc1C#CC[NH3+]	ZINC000049609237	519791188	/nfs/dbraw/zinc/79/11/88/519791188.db2.gz	ATJBLCCLPNYXSJ-CYBMUJFWSA-N	2	0	262.372	2.612	10	30		CFEERP
CCC[C@@H](C)[N@H+](C)Cc1cc(C#CC[NH3+])ccc1OC	ZINC000049609311	520644790	/nfs/dbraw/zinc/64/47/90/520644790.db2.gz	WZIJHNGYQUJPBA-CQSZACIVSA-N	2	0	274.408	2.626	10	30		CFEERP
CC[C@H]1CCC[N@H+](Cc2ccc(C#CC[NH3+])cc2F)C1	ZINC000049609270	523091559	/nfs/dbraw/zinc/09/15/59/523091559.db2.gz	QDZBBVGMXUMKEQ-AWEZNQCLSA-N	2	0	274.383	2.758	10	30		CFEERP
CC[C@H]1CCC[N@H+](Cc2cccc(C#CC[NH3+])c2)C1	ZINC000049609272	523092929	/nfs/dbraw/zinc/09/29/29/523092929.db2.gz	HXFGPHWTRZJLGB-HNNXBMFYSA-N	2	0	256.393	2.619	10	30		CFEERP
C[N@H+](Cc1ccc(C#CC[NH3+])cc1F)C1CCCCC1	ZINC000049608584	523204842	/nfs/dbraw/zinc/20/48/42/523204842.db2.gz	VOJKEYASIQCBGM-UHFFFAOYSA-N	2	0	274.383	2.900	10	30		CFEERP
C[N@H+](Cc1ccccc1)Cc1ccccc1C#CC[NH3+]	ZINC000049608523	523348068	/nfs/dbraw/zinc/34/80/68/523348068.db2.gz	BASXHWMQACXBGP-UHFFFAOYSA-N	2	0	264.372	2.629	10	30		CFEERP
Cc1ccccc1C[N@@H+](C)Cc1ccccc1C#CC[NH3+]	ZINC000049609772	525127337	/nfs/dbraw/zinc/12/73/37/525127337.db2.gz	DLGQIJYONBSCBE-UHFFFAOYSA-N	2	0	278.399	2.937	10	30		CFEERP
Cc1occc1C[N@@H+](C)Cc1ccc(F)c(C#CC[NH3+])c1	ZINC000049609922	526823685	/nfs/dbraw/zinc/82/36/85/526823685.db2.gz	KWFYZDOHBXRJKQ-UHFFFAOYSA-N	2	0	286.350	2.669	10	30		CFEERP
[NH3+]CC#Cc1cccc(C[N@@H+]2CCc3ccccc3C2)c1	ZINC000049608576	527151638	/nfs/dbraw/zinc/15/16/38/527151638.db2.gz	BKLYERUKHVNBRE-UHFFFAOYSA-N	2	0	276.383	2.555	10	30		CFEERP
CC[N@@H+](Cc1sccc1C#CC[NH3+])CC(C)C	ZINC000043683594	175092428	/nfs/dbraw/zinc/09/24/28/175092428.db2.gz	WYCUPSPOCYLBFT-UHFFFAOYSA-N	2	0	250.411	2.536	10	30		CFEERP
CCC(CC)[N@H+](C)Cc1cc(C#CC[NH3+])cs1	ZINC000043688924	175095404	/nfs/dbraw/zinc/09/54/04/175095404.db2.gz	YXMVJFBGXXUQBS-UHFFFAOYSA-N	2	0	250.411	2.679	10	30		CFEERP
CCCC[N@H+](CC)Cc1ccc(F)c(C#CC[NH3+])c1	ZINC000049608567	520477818	/nfs/dbraw/zinc/47/78/18/520477818.db2.gz	ZOHGPBNKLZEFPU-UHFFFAOYSA-N	2	0	262.372	2.758	10	30		CFEERP
CCCC[N@H+](CC)Cc1cc(C#CC[NH3+])ccc1OC	ZINC000049608561	520479894	/nfs/dbraw/zinc/47/98/94/520479894.db2.gz	KGFQHGCFAZZEHF-UHFFFAOYSA-N	2	0	274.408	2.627	10	30		CFEERP
CC[N@H+](Cc1ccc(F)cc1C#CC[NH3+])C1CCCC1	ZINC000049609173	521316057	/nfs/dbraw/zinc/31/60/57/521316057.db2.gz	BLAITULYXJRLKO-UHFFFAOYSA-N	2	0	274.383	2.900	10	30		CFEERP
CC[C@H]1CCC[N@@H+]1Cc1ccc(F)cc1C#CC[NH3+]	ZINC000049608275	523108267	/nfs/dbraw/zinc/10/82/67/523108267.db2.gz	AJFFZGMKJAAPII-INIZCTEOSA-N	2	0	260.356	2.510	10	30		CFEERP
C[N@H+](Cc1ccc(F)c(C#CC[NH3+])c1)C1CCCCC1	ZINC000049608587	523239415	/nfs/dbraw/zinc/23/94/15/523239415.db2.gz	PUNSAAJRAMKQLD-UHFFFAOYSA-N	2	0	274.383	2.900	10	30		CFEERP
C[C@@H]1CCC[C@H](C)[N@H+]1Cc1ccc(F)cc1C#CC[NH3+]	ZINC000049608741	524362227	/nfs/dbraw/zinc/36/22/27/524362227.db2.gz	TVMUQKVLQIBTFK-OKILXGFUSA-N	2	0	274.383	2.899	10	30		CFEERP
Cc1cc[nH+]c(NC[C@H]2CC[N@H+](Cc3ccc(C#N)o3)C2)c1	ZINC000371371187	381601081	/nfs/dbraw/zinc/60/10/81/381601081.db2.gz	ASYMMQCGLYDMIG-CQSZACIVSA-N	2	0	296.374	2.789	10	30		CFEERP
CC[C@@H]1CCC[N@H+](Cc2ccc(C#CC[NH3+])s2)C1	ZINC000043683720	175091741	/nfs/dbraw/zinc/09/17/41/175091741.db2.gz	UUEQMVFNEWRCPR-CYBMUJFWSA-N	2	0	262.422	2.680	10	30		CFEERP
CC(C)[C@H](C)[N@H+](C)Cc1sccc1C#CC[NH3+]	ZINC000043683710	175092127	/nfs/dbraw/zinc/09/21/27/175092127.db2.gz	YPZIUIWTDPFBSB-LBPRGKRZSA-N	2	0	250.411	2.535	10	30		CFEERP
C[N@H+](Cc1ccc(C#CC[NH3+])s1)Cc1ccc(F)cc1	ZINC000043684052	175092404	/nfs/dbraw/zinc/09/24/04/175092404.db2.gz	XQYXHNQKVYFRDT-UHFFFAOYSA-N	2	0	288.391	2.829	10	30		CFEERP
C[C@H]1C[C@H](C)C[NH+](Cc2cc(C#CC[NH3+])cs2)C1	ZINC000043688828	175095466	/nfs/dbraw/zinc/09/54/66/175095466.db2.gz	PQGVNPLVGDCYMJ-STQMWFEESA-N	2	0	262.422	2.536	10	30		CFEERP
CCC[C@H](C)[N@H+](C)Cc1cc(C#CC[NH3+])cs1	ZINC000043688932	175095892	/nfs/dbraw/zinc/09/58/92/175095892.db2.gz	NFYLIPKUKOWAKA-LBPRGKRZSA-N	2	0	250.411	2.679	10	30		CFEERP
CC1(C)CC[NH+](Cc2ccc(F)c(C#CC[NH3+])c2)CC1	ZINC000061821295	520379856	/nfs/dbraw/zinc/37/98/56/520379856.db2.gz	HCVYCYZSLRFXOU-UHFFFAOYSA-N	2	0	274.383	2.758	10	30		CFEERP
CC[N@H+](CCOc1ccc(C#CC[NH3+])cc1)C1CCCC1	ZINC000049609165	521149247	/nfs/dbraw/zinc/14/92/47/521149247.db2.gz	AJCOLGHWYXBFRW-UHFFFAOYSA-N	2	0	286.419	2.640	10	30		CFEERP
CC[N@@H+]1CCC[C@H](NC2=[NH+][C@H](CC(C)C)CS2)C1	ZINC000049221553	521641529	/nfs/dbraw/zinc/64/15/29/521641529.db2.gz	KDVKWIDLBAPBBZ-QWHCGFSZSA-N	2	0	269.458	2.578	10	30		CFEERP
CC[C@@H]1CCC[N@H+](Cc2ccc(C#CC[NH3+])cc2F)C1	ZINC000049609269	523253290	/nfs/dbraw/zinc/25/32/90/523253290.db2.gz	QDZBBVGMXUMKEQ-CQSZACIVSA-N	2	0	274.383	2.758	10	30		CFEERP
CC[C@H](C)C[N@H+](C)Cc1ccc(C#CC[NH3+])cc1F	ZINC000049609026	523868692	/nfs/dbraw/zinc/86/86/92/523868692.db2.gz	IRRXBNMPXPTINZ-ZDUSSCGKSA-N	2	0	262.372	2.614	10	30		CFEERP
C[C@H]1CCC[N@H+](Cc2cc(C#CC[NH3+])cs2)[C@H]1C	ZINC000252203915	574283660	/nfs/dbraw/zinc/28/36/60/574283660.db2.gz	URIPLTDCDDVJBH-STQMWFEESA-N	2	0	262.422	2.679	10	30		CFEERP
CC1(C)CC[NH+](Cc2cc(C#CC[NH3+])cs2)CC1	ZINC000061821283	623235673	/nfs/dbraw/zinc/23/56/73/623235673.db2.gz	FNOQLLMBSIFWMX-UHFFFAOYSA-N	2	0	262.422	2.680	10	30		CFEERP
Cc1cccc(NC[C@@H]2CC[N@H+](Cc3ccc(C#N)o3)C2)[nH+]1	ZINC000092813157	375161170	/nfs/dbraw/zinc/16/11/70/375161170.db2.gz	IULCUDNZLXAFJO-AWEZNQCLSA-N	2	0	296.374	2.789	10	30		CFEERP
C[C@H]1CCC[C@H](C)[NH+]1Cc1sccc1C#CC[NH3+]	ZINC000043683567	175092245	/nfs/dbraw/zinc/09/22/45/175092245.db2.gz	XPMAIDHHPCCLMA-STQMWFEESA-N	2	0	262.422	2.821	10	30		CFEERP
CC[C@H](C)C[N@H+](C)Cc1sccc1C#CC[NH3+]	ZINC000043683662	175092434	/nfs/dbraw/zinc/09/24/34/175092434.db2.gz	HRJKJBQZGHNGHH-LBPRGKRZSA-N	2	0	250.411	2.536	10	30		CFEERP
C[C@@H]1CCC[C@@H](C)[NH+]1Cc1cc(C#CC[NH3+])cs1	ZINC000043688847	175095194	/nfs/dbraw/zinc/09/51/94/175095194.db2.gz	NAHLDWFKIQLVJR-CHWSQXEVSA-N	2	0	262.422	2.821	10	30		CFEERP
CCCCC[N@H+](C)Cc1ccc(C#CC[NH3+])cc1F	ZINC000049609045	520151357	/nfs/dbraw/zinc/15/13/57/520151357.db2.gz	XDXRCZSBBWZOKK-UHFFFAOYSA-N	2	0	262.372	2.758	10	30		CFEERP
CCC(CC)[N@H+](C)Cc1ccc(OC)c(C#CC[NH3+])c1	ZINC000049609251	521542437	/nfs/dbraw/zinc/54/24/37/521542437.db2.gz	YQJAMAHZRVEHHU-UHFFFAOYSA-N	2	0	274.408	2.626	10	30		CFEERP
CCC[NH+](CCC)Cc1ccc(OC)c(C#CC[NH3+])c1	ZINC000049608517	521648980	/nfs/dbraw/zinc/64/89/80/521648980.db2.gz	WFXNQHRTCLZYLD-UHFFFAOYSA-N	2	0	274.408	2.627	10	30		CFEERP
CC[C@@H](C)[N@H+](CC)Cc1ccc(C#CC[NH3+])cc1F	ZINC000049608945	522085189	/nfs/dbraw/zinc/08/51/89/522085189.db2.gz	GLAQMUDHIBXXIB-CYBMUJFWSA-N	2	0	262.372	2.756	10	30		CFEERP
C=CC[NH+](CC=C)CCOc1ccccc1C[NH2+]CC	ZINC000052376521	518768638	/nfs/dbraw/zinc/76/86/38/518768638.db2.gz	SFTBXLGMPGCGOD-UHFFFAOYSA-N	2	0	274.408	2.849	10	30		CFEERP
C=CC[NH+](CC=C)C[C@@H]1CC[C@H](C[NH2+]C(C)(C)C)O1	ZINC000052376702	518771134	/nfs/dbraw/zinc/77/11/34/518771134.db2.gz	OOZCBRGWWKZPTR-CABCVRRESA-N	2	0	266.429	2.596	10	30		CFEERP
CC(C)C[C@H]1CSC(N[C@H](C)C[NH+]2CCCC2)=[NH+]1	ZINC000049185300	519417780	/nfs/dbraw/zinc/41/77/80/519417780.db2.gz	CNEWSJVLWMNHAH-OLZOCXBDSA-N	2	0	269.458	2.578	10	30		CFEERP
CCC1CC[NH+](Cc2ccc(F)cc2C#CC[NH3+])CC1	ZINC000049609931	519859867	/nfs/dbraw/zinc/85/98/67/519859867.db2.gz	CKRQRWBQFLHRJI-UHFFFAOYSA-N	2	0	274.383	2.758	10	30		CFEERP
CCC[C@@H](C)[N@H+](C)Cc1ccc(F)c(C#CC[NH3+])c1	ZINC000049609323	520645712	/nfs/dbraw/zinc/64/57/12/520645712.db2.gz	QKZWFRAXHDOJBL-CYBMUJFWSA-N	2	0	262.372	2.756	10	30		CFEERP
CCC[C@H](C)[N@H+](C)Cc1ccc(F)cc1C#CC[NH3+]	ZINC000049609322	521035040	/nfs/dbraw/zinc/03/50/40/521035040.db2.gz	ITTXCTWTMJJMHD-ZDUSSCGKSA-N	2	0	262.372	2.756	10	30		CFEERP
CC[C@@H]1CCCC[N@@H+]1Cc1ccc(F)c(C#CC[NH3+])c1	ZINC000049608921	523179016	/nfs/dbraw/zinc/17/90/16/523179016.db2.gz	GJFIVMZWOBICQP-MRXNPFEDSA-N	2	0	274.383	2.900	10	30		CFEERP
C[N@H+](Cc1ccc(F)cc1)Cc1ccc(C#CC[NH3+])cc1	ZINC000049609959	523249352	/nfs/dbraw/zinc/24/93/52/523249352.db2.gz	IBAXPYONQRPYCK-UHFFFAOYSA-N	2	0	282.362	2.768	10	30		CFEERP
C[N@H+](Cc1ccccc1)Cc1ccc(C#CC[NH3+])cc1F	ZINC000049608525	523346509	/nfs/dbraw/zinc/34/65/09/523346509.db2.gz	XIWDHPOCLARMPG-UHFFFAOYSA-N	2	0	282.362	2.768	10	30		CFEERP
COc1ccc(C#CC[NH3+])cc1C[N@H+](C)C1CCCCC1	ZINC000049608581	523512385	/nfs/dbraw/zinc/51/23/85/523512385.db2.gz	GAPNMXXHJXWMOM-UHFFFAOYSA-N	2	0	286.419	2.770	10	30		CFEERP
COc1ccc(C#CC[NH3+])cc1C[NH+]1CCCCCCC1	ZINC000049608784	523513004	/nfs/dbraw/zinc/51/30/04/523513004.db2.gz	LUOCPAHXTLAWQY-UHFFFAOYSA-N	2	0	286.419	2.772	10	30		CFEERP
Cc1cccc(C[N@@H+](C)Cc2cccc(C#CC[NH3+])c2)c1	ZINC000049609963	524376389	/nfs/dbraw/zinc/37/63/89/524376389.db2.gz	DNESBOCPFUSOJD-UHFFFAOYSA-N	2	0	278.399	2.937	10	30		CFEERP
C[NH+](C)CC1CC[NH+]([C@@H]2CCCCC[C@@H]2C#N)CC1	ZINC000042393645	174707878	/nfs/dbraw/zinc/70/78/78/174707878.db2.gz	PTAGXGBLZOHOBC-HZPDHXFCSA-N	2	0	263.429	2.732	10	30		CFEERP
CC(C)[C@H](C)[N@H+](C)Cc1ccc(C#CC[NH3+])s1	ZINC000043683706	175091592	/nfs/dbraw/zinc/09/15/92/175091592.db2.gz	FATHNTCGAKFJBO-LBPRGKRZSA-N	2	0	250.411	2.535	10	30		CFEERP
C[N@H+](Cc1sccc1C#CC[NH3+])Cc1ccc(F)cc1	ZINC000043684053	175092159	/nfs/dbraw/zinc/09/21/59/175092159.db2.gz	YHYXUVGMELWPLC-UHFFFAOYSA-N	2	0	288.391	2.829	10	30		CFEERP
CC(C)C[N@H+](Cc1ccc(C#CC[NH3+])s1)C(C)C	ZINC000043684191	175093252	/nfs/dbraw/zinc/09/32/52/175093252.db2.gz	NIQVUFUNCSAKBJ-UHFFFAOYSA-N	2	0	264.438	2.925	10	30		CFEERP
CCC[C@@H](C)[N@H+](C)Cc1ccc(OC)c(C#CC[NH3+])c1	ZINC000049609313	520647042	/nfs/dbraw/zinc/64/70/42/520647042.db2.gz	UEHYLNAVEFMBOH-CQSZACIVSA-N	2	0	274.408	2.626	10	30		CFEERP
CC[N@H+](Cc1cc(C#CC[NH3+])ccc1OC)C1CCCC1	ZINC000049609168	521286688	/nfs/dbraw/zinc/28/66/88/521286688.db2.gz	CUYAQTBUTVVQRC-UHFFFAOYSA-N	2	0	286.419	2.770	10	30		CFEERP
C[N@H+](Cc1ccsc1)Cc1cccc(C#CC[NH3+])c1	ZINC000049609106	523484260	/nfs/dbraw/zinc/48/42/60/523484260.db2.gz	GNQMTMPZOMQMIT-UHFFFAOYSA-N	2	0	270.401	2.690	10	30		CFEERP
C[C@@H]1CCC[N@H+](Cc2sccc2C#CC[NH3+])[C@@H]1C	ZINC000050566673	524238615	/nfs/dbraw/zinc/23/86/15/524238615.db2.gz	QJKSEKFSNKGHBG-CHWSQXEVSA-N	2	0	262.422	2.679	10	30		CFEERP
C[C@@H]1CCC[C@@H](C)[NH+]1Cc1cccc(C#CC[NH3+])c1	ZINC000049608740	524278103	/nfs/dbraw/zinc/27/81/03/524278103.db2.gz	VEVATIFVIKLYBX-HUUCEWRRSA-N	2	0	256.393	2.760	10	30		CFEERP
C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1sccc1C#CC[NH3+]	ZINC000050566674	525642327	/nfs/dbraw/zinc/64/23/27/525642327.db2.gz	QJKSEKFSNKGHBG-QWHCGFSZSA-N	2	0	262.422	2.679	10	30		CFEERP
C[C@H]1CCCC[N@@H+]1Cc1ccc(C#CC[NH3+])cc1F	ZINC000049608400	526251670	/nfs/dbraw/zinc/25/16/70/526251670.db2.gz	IVHRUJUADLOZEN-ZDUSSCGKSA-N	2	0	260.356	2.510	10	30		CFEERP
[NH3+]CC#Cc1ccccc1C[N@@H+]1CCc2sccc2C1	ZINC000049608507	527152832	/nfs/dbraw/zinc/15/28/32/527152832.db2.gz	DMSRNKZRUGDIRB-UHFFFAOYSA-N	2	0	282.412	2.617	10	30		CFEERP
C[C@@H]([NH2+][C@H]1CCC[N@H+](C)CC1)c1ccc(C#N)cc1	ZINC000086817886	179345789	/nfs/dbraw/zinc/34/57/89/179345789.db2.gz	PAXBTEMLDIGBJH-CJNGLKHVSA-N	2	0	257.381	2.693	10	30		CFEERP
CC(C)[N@@H+]1CCC[C@H]([NH2+]Cc2cccc(C#N)c2)CC1	ZINC000086841034	179352692	/nfs/dbraw/zinc/35/26/92/179352692.db2.gz	RXWQDEUQFIEKFN-KRWDZBQOSA-N	2	0	271.408	2.911	10	30		CFEERP
CC(C)CC[N@H+](C)Cc1sccc1C#CC[NH3+]	ZINC000043684020	175091629	/nfs/dbraw/zinc/09/16/29/175091629.db2.gz	DVORCGYXWQVRTC-UHFFFAOYSA-N	2	0	250.411	2.536	10	30		CFEERP
CCC[C@H](C)[N@H+](C)Cc1sccc1C#CC[NH3+]	ZINC000043683749	175091842	/nfs/dbraw/zinc/09/18/42/175091842.db2.gz	AGOLPKGNENTDGQ-LBPRGKRZSA-N	2	0	250.411	2.679	10	30		CFEERP
CC[NH+]1CCC(C[NH2+]Cc2cc(C#N)ccc2F)CC1	ZINC000044518713	175190831	/nfs/dbraw/zinc/19/08/31/175190831.db2.gz	RSFBTFSLIHRVFK-UHFFFAOYSA-N	2	0	275.371	2.519	10	30		CFEERP
C#CCOc1ccccc1C[NH2+]CCCC[N@@H+](C)C(C)C	ZINC000044573283	175210217	/nfs/dbraw/zinc/21/02/17/175210217.db2.gz	XOQQEHBQPQRMJB-UHFFFAOYSA-N	2	0	288.435	2.909	10	30		CFEERP
C[N@H+](Cc1sccc1C#CC[NH3+])CC(C)(C)C	ZINC000045086723	175304014	/nfs/dbraw/zinc/30/40/14/175304014.db2.gz	UZLVRYCTGYHAIB-UHFFFAOYSA-N	2	0	250.411	2.536	10	30		CFEERP
CCC[C@H](C)[N@H+](C)Cc1ccc(OC)c(C#CC[NH3+])c1	ZINC000049609314	521036859	/nfs/dbraw/zinc/03/68/59/521036859.db2.gz	UEHYLNAVEFMBOH-AWEZNQCLSA-N	2	0	274.408	2.626	10	30		CFEERP
CC[C@@H](C)[N@H+](CC)Cc1cc(C#CC[NH3+])ccc1OC	ZINC000049608939	522084053	/nfs/dbraw/zinc/08/40/53/522084053.db2.gz	JJNGIGNAJIHWRE-CQSZACIVSA-N	2	0	274.408	2.626	10	30		CFEERP
C=C(C)C[N@H+](CC)CCOc1ccccc1C[NH2+]C	ZINC000052423388	518599438	/nfs/dbraw/zinc/59/94/38/518599438.db2.gz	PBJBGWQPLDQBKL-UHFFFAOYSA-N	2	0	262.397	2.683	10	30		CFEERP
CC[N@H+](Cc1ccco1)Cc1cccc(C#CC[NH3+])c1	ZINC000049609860	521398456	/nfs/dbraw/zinc/39/84/56/521398456.db2.gz	BTKYAVLKUBTHCU-UHFFFAOYSA-N	2	0	268.360	2.612	10	30		CFEERP
C[C@H]1CCC[C@H](C)[NH+]1Cc1ccc(C#CC[NH3+])cc1F	ZINC000049608736	524191462	/nfs/dbraw/zinc/19/14/62/524191462.db2.gz	OWZJTGXEOOTKPZ-KBPBESRZSA-N	2	0	274.383	2.899	10	30		CFEERP
C[C@@H]1CCC[N@H+](Cc2ccc(C#CC[NH3+])cc2F)[C@@H]1C	ZINC000050566695	524233063	/nfs/dbraw/zinc/23/30/63/524233063.db2.gz	FKYJYRRZIBRSEM-ZIAGYGMSSA-N	2	0	274.383	2.756	10	30		CFEERP
C[C@@H]1CCC[N@H+](Cc2cccc(C#CC[NH3+])c2)[C@@H]1C	ZINC000050566697	524235004	/nfs/dbraw/zinc/23/50/04/524235004.db2.gz	OYLLGGUSAURAPP-HUUCEWRRSA-N	2	0	256.393	2.617	10	30		CFEERP
C[C@@H]1CCC[C@H](C)[N@H+]1CCOc1cccc(C#CC[NH3+])c1	ZINC000049608732	524362612	/nfs/dbraw/zinc/36/26/12/524362612.db2.gz	QKSJYCDRTBTVND-IYBDPMFKSA-N	2	0	286.419	2.639	10	30		CFEERP
Cc1ccc(C[N@@H+](C)Cc2ccccc2C#CC[NH3+])o1	ZINC000049609109	524394878	/nfs/dbraw/zinc/39/48/78/524394878.db2.gz	YQNFZJUQYQUIMH-UHFFFAOYSA-N	2	0	268.360	2.530	10	30		CFEERP
C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(F)c(C#CC[NH3+])c2)C1	ZINC000049608651	525211023	/nfs/dbraw/zinc/21/10/23/525211023.db2.gz	LAZFABDEXXNRHQ-ZIAGYGMSSA-N	2	0	274.383	2.614	10	30		CFEERP
C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1ccc(C#CC[NH3+])cc1F	ZINC000050566696	525641886	/nfs/dbraw/zinc/64/18/86/525641886.db2.gz	FKYJYRRZIBRSEM-UONOGXRCSA-N	2	0	274.383	2.756	10	30		CFEERP
CC[C@H](C)[N@H+](CC)Cc1sccc1C#CC[NH3+]	ZINC000043683633	175092080	/nfs/dbraw/zinc/09/20/80/175092080.db2.gz	CXGAIEGZQDFXIF-LBPRGKRZSA-N	2	0	250.411	2.679	10	30		CFEERP
CCC(CC)[N@H+](CCOC)Cc1ccc(C#CC[NH3+])s1	ZINC000043684224	175092619	/nfs/dbraw/zinc/09/26/19/175092619.db2.gz	YPFGRMMNLXRURL-UHFFFAOYSA-N	2	0	294.464	2.695	10	30		CFEERP
CC(C)[N@H+](C)CCCC[NH2+][C@H]1CCCC[C@@H]1C#N	ZINC000054828573	519617079	/nfs/dbraw/zinc/61/70/79/519617079.db2.gz	OXMDHXYLFNCOPY-CABCVRRESA-N	2	0	251.418	2.779	10	30		CFEERP
CCCC[N@H+](Cc1ccc(F)c(C#CC[NH3+])c1)C1CC1	ZINC000049609607	520544615	/nfs/dbraw/zinc/54/46/15/520544615.db2.gz	NSFMXYMXZRZBEX-UHFFFAOYSA-N	2	0	274.383	2.900	10	30		CFEERP
CC[N@@H+](Cc1ccc(F)cc1C#CC[NH3+])CC(C)C	ZINC000049608851	521314324	/nfs/dbraw/zinc/31/43/24/521314324.db2.gz	PKWQDKSNOSWILB-UHFFFAOYSA-N	2	0	262.372	2.614	10	30		CFEERP
CC[N@H+](Cc1ccc(OC)c(C#CC[NH3+])c1)C1CCCC1	ZINC000049609169	521322480	/nfs/dbraw/zinc/32/24/80/521322480.db2.gz	RAIVCPTVLRIPOG-UHFFFAOYSA-N	2	0	286.419	2.770	10	30		CFEERP
CC[C@@H](C)[N@H+](CC)Cc1ccc(F)c(C#CC[NH3+])c1	ZINC000049608951	522085862	/nfs/dbraw/zinc/08/58/62/522085862.db2.gz	AIUHBDIYURXKES-CYBMUJFWSA-N	2	0	262.372	2.756	10	30		CFEERP
CC[C@H]1CCCC[N@@H+]1Cc1cccc(C#CC[NH3+])c1	ZINC000049608918	523027288	/nfs/dbraw/zinc/02/72/88/523027288.db2.gz	VUVNJOSBVJYNQH-KRWDZBQOSA-N	2	0	256.393	2.761	10	30		CFEERP
CC[C@H]1CCCC[N@@H+]1Cc1cc(C#CC[NH3+])ccc1OC	ZINC000049608910	523027617	/nfs/dbraw/zinc/02/76/17/523027617.db2.gz	AVQCWGXWMKDZIH-KRWDZBQOSA-N	2	0	286.419	2.770	10	30		CFEERP
CC[C@H]1CCC[N@H+](Cc2ccc(C#CC[NH3+])cc2)C1	ZINC000049609262	523091971	/nfs/dbraw/zinc/09/19/71/523091971.db2.gz	MAROTFCLROZCHI-HNNXBMFYSA-N	2	0	256.393	2.619	10	30		CFEERP
C[C@H]1CCC[C@H](C)[NH+]1CCOc1cccc(C#CC[NH3+])c1	ZINC000049608733	524191419	/nfs/dbraw/zinc/19/14/19/524191419.db2.gz	QKSJYCDRTBTVND-HOTGVXAUSA-N	2	0	286.419	2.639	10	30		CFEERP
Cc1ccc(C[N@@H+](C)Cc2ccc(C#CC[NH3+])cc2)o1	ZINC000049609110	524395251	/nfs/dbraw/zinc/39/52/51/524395251.db2.gz	BHXDYVBFPDOXMT-UHFFFAOYSA-N	2	0	268.360	2.530	10	30		CFEERP
CC[N@H+](Cc1ccco1)Cc1sccc1C#CC[NH3+]	ZINC000043683996	175091614	/nfs/dbraw/zinc/09/16/14/175091614.db2.gz	IECJBUYAYGCQRU-UHFFFAOYSA-N	2	0	274.389	2.673	10	30		CFEERP
C[C@@H]1CCC[C@@H](C)[NH+]1Cc1sccc1C#CC[NH3+]	ZINC000043683568	175092153	/nfs/dbraw/zinc/09/21/53/175092153.db2.gz	XPMAIDHHPCCLMA-CHWSQXEVSA-N	2	0	262.422	2.821	10	30		CFEERP
CC[N@@H+](Cc1ccc(C#CC[NH3+])s1)CC(C)C	ZINC000043683593	175092187	/nfs/dbraw/zinc/09/21/87/175092187.db2.gz	VLCOEJMPYGMOFG-UHFFFAOYSA-N	2	0	250.411	2.536	10	30		CFEERP
CC(C)C[C@H](C)[N@H+](C)Cc1cc(C#CC[NH3+])cs1	ZINC000043689103	175095585	/nfs/dbraw/zinc/09/55/85/175095585.db2.gz	LOEMRCKOUIOXTB-ZDUSSCGKSA-N	2	0	264.438	2.925	10	30		CFEERP
CCC[NH+](CCC)Cc1cc(C#CC[NH3+])ccc1OC	ZINC000049608516	521648955	/nfs/dbraw/zinc/64/89/55/521648955.db2.gz	WYQXDOUBCTYGLK-UHFFFAOYSA-N	2	0	274.408	2.627	10	30		CFEERP
CCC1CC[NH+](Cc2ccc(F)c(C#CC[NH3+])c2)CC1	ZINC000049609932	519859642	/nfs/dbraw/zinc/85/96/42/519859642.db2.gz	YDXMWIOBQLIOIV-UHFFFAOYSA-N	2	0	274.383	2.758	10	30		CFEERP
CCCC[N@H+](Cc1ccc(C#CC[NH3+])cc1)C1CC1	ZINC000049609600	520545186	/nfs/dbraw/zinc/54/51/86/520545186.db2.gz	JLZMOSSBBDYRPD-UHFFFAOYSA-N	2	0	256.393	2.761	10	30		CFEERP
CCC[N@@H+](Cc1ccc(F)cc1C#CC[NH3+])CC1CC1	ZINC000049609640	521684626	/nfs/dbraw/zinc/68/46/26/521684626.db2.gz	RGHZAYWSKQWIRK-UHFFFAOYSA-N	2	0	274.383	2.758	10	30		CFEERP
C[N@H+](Cc1ccc(F)cc1C#CC[NH3+])C1CCCCC1	ZINC000049608586	523254005	/nfs/dbraw/zinc/25/40/05/523254005.db2.gz	PBUUTVICSZTQDI-UHFFFAOYSA-N	2	0	274.383	2.900	10	30		CFEERP
C[N@H+](Cc1cccc(F)c1)Cc1cccc(C#CC[NH3+])c1	ZINC000049608793	523312303	/nfs/dbraw/zinc/31/23/03/523312303.db2.gz	BFPYMYHYSQKZNN-UHFFFAOYSA-N	2	0	282.362	2.768	10	30		CFEERP
[NH3+]CC#Cc1cc(C[NH+]2CCCCCCC2)ccc1F	ZINC000049608790	527146911	/nfs/dbraw/zinc/14/69/11/527146911.db2.gz	QZQHJOUYYWGZLR-UHFFFAOYSA-N	2	0	274.383	2.902	10	30		CFEERP
C[N@H+](Cc1ccsc1)Cc1sccc1C#CC[NH3+]	ZINC000043683678	175092047	/nfs/dbraw/zinc/09/20/47/175092047.db2.gz	YMSSLCBVCYYAFE-UHFFFAOYSA-N	2	0	276.430	2.752	10	30		CFEERP
CC[C@@H](C)C[N@H+](C)Cc1sccc1C#CC[NH3+]	ZINC000043683661	175092088	/nfs/dbraw/zinc/09/20/88/175092088.db2.gz	HRJKJBQZGHNGHH-GFCCVEGCSA-N	2	0	250.411	2.536	10	30		CFEERP
CC(C)C[N@H+](Cc1sccc1C#CC[NH3+])C(C)C	ZINC000043684192	175092664	/nfs/dbraw/zinc/09/26/64/175092664.db2.gz	LPJUMLJBKAROPQ-UHFFFAOYSA-N	2	0	264.438	2.925	10	30		CFEERP
C[C@@H]([N@H+](C)Cc1cc(C#CC[NH3+])cs1)C(C)(C)C	ZINC000043689127	175096271	/nfs/dbraw/zinc/09/62/71/175096271.db2.gz	LMHZLOIESMSSMG-GFCCVEGCSA-N	2	0	264.438	2.925	10	30		CFEERP
C[N@H+](Cc1ccc(F)c(C#CC[NH3+])c1)CC(C)(C)C	ZINC000045086746	175304534	/nfs/dbraw/zinc/30/45/34/175304534.db2.gz	AJXFCRDFGOOHMV-UHFFFAOYSA-N	2	0	262.372	2.614	10	30		CFEERP
CC(C)[C@@H](C)[N@H+](C)Cc1ccc(C#CC[NH3+])cc1F	ZINC000049609233	519791079	/nfs/dbraw/zinc/79/10/79/519791079.db2.gz	XCQOWQALSPTRRN-CYBMUJFWSA-N	2	0	262.372	2.612	10	30		CFEERP
C=C(C)C[N@@H+](CC)Cc1cc(C[NH2+]CCC)no1	ZINC000052423379	518599542	/nfs/dbraw/zinc/59/95/42/518599542.db2.gz	RQZFQHAIWATLGF-UHFFFAOYSA-N	2	0	251.374	2.572	10	30		CFEERP
CC(C)C[C@@H]1CSC(N[C@H](C[NH+](C)C)C(C)C)=[NH+]1	ZINC000049222051	519277283	/nfs/dbraw/zinc/27/72/83/519277283.db2.gz	MMDXVSRXGOQOGX-CHWSQXEVSA-N	2	0	271.474	2.680	10	30		CFEERP
CCC1CC[NH+](Cc2ccc(C#CC[NH3+])cc2F)CC1	ZINC000049609929	519859850	/nfs/dbraw/zinc/85/98/50/519859850.db2.gz	XAXXVCOXLMTFFQ-UHFFFAOYSA-N	2	0	274.383	2.758	10	30		CFEERP
CCC[N@@H+](Cc1ccc(C#CC[NH3+])cc1)CC1CC1	ZINC000049609634	521682108	/nfs/dbraw/zinc/68/21/08/521682108.db2.gz	ASYSPKYXMYQSRU-UHFFFAOYSA-N	2	0	256.393	2.619	10	30		CFEERP
CC[C@@H]1CCCC[N@@H+]1CCOc1ccc(C#CC[NH3+])cc1	ZINC000049608903	523174832	/nfs/dbraw/zinc/17/48/32/523174832.db2.gz	QKDVAHALDSAKJR-QGZVFWFLSA-N	2	0	286.419	2.640	10	30		CFEERP
CC[C@@H]1CCCC[N@@H+]1Cc1ccccc1C#CC[NH3+]	ZINC000049608905	523177317	/nfs/dbraw/zinc/17/73/17/523177317.db2.gz	VHUKUEZMCSXHEA-QGZVFWFLSA-N	2	0	256.393	2.761	10	30		CFEERP
C[N@H+](Cc1ccccc1)Cc1ccc(F)c(C#CC[NH3+])c1	ZINC000049608528	523347271	/nfs/dbraw/zinc/34/72/71/523347271.db2.gz	RNPFYXKPJZNQCB-UHFFFAOYSA-N	2	0	282.362	2.768	10	30		CFEERP
C[C@@H]1CCC[C@@H](C)[NH+]1Cc1ccc(F)c(C#CC[NH3+])c1	ZINC000049608746	524279693	/nfs/dbraw/zinc/27/96/93/524279693.db2.gz	CBTARHMEDJEQJF-ZIAGYGMSSA-N	2	0	274.383	2.899	10	30		CFEERP
C[C@@H]1CCC[C@@H](C)[NH+]1Cc1ccc(C#CC[NH3+])s1	ZINC000043683565	175091724	/nfs/dbraw/zinc/09/17/24/175091724.db2.gz	LFQMBPIGWAXXKI-CHWSQXEVSA-N	2	0	262.422	2.821	10	30		CFEERP
CCC(CC)[N@H+](C)Cc1sccc1C#CC[NH3+]	ZINC000043683718	175091900	/nfs/dbraw/zinc/09/19/00/175091900.db2.gz	WEIIQMNGXGLGJP-UHFFFAOYSA-N	2	0	250.411	2.679	10	30		CFEERP
C[N@H+](Cc1cccs1)Cc1ccc(C#CC[NH3+])s1	ZINC000043683675	175092131	/nfs/dbraw/zinc/09/21/31/175092131.db2.gz	CPOFNQNRRVGYDC-UHFFFAOYSA-N	2	0	276.430	2.752	10	30		CFEERP
CC(C)[C@H](C)[N@H+](C)Cc1cc(C#CC[NH3+])cs1	ZINC000043688922	175095236	/nfs/dbraw/zinc/09/52/36/175095236.db2.gz	RGBVVUYKSBTPOO-LBPRGKRZSA-N	2	0	250.411	2.535	10	30		CFEERP
CCC1CC[NH+](Cc2cc(C#CC[NH3+])cs2)CC1	ZINC000043689028	175095244	/nfs/dbraw/zinc/09/52/44/175095244.db2.gz	DROOFBKDKAUIOC-UHFFFAOYSA-N	2	0	262.422	2.680	10	30		CFEERP
C[C@@H]1CCC[C@H](C)[N@H+]1Cc1cc(C#CC[NH3+])cs1	ZINC000043688843	175095538	/nfs/dbraw/zinc/09/55/38/175095538.db2.gz	NAHLDWFKIQLVJR-BETUJISGSA-N	2	0	262.422	2.821	10	30		CFEERP