smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1cccc(NCc2ccc(Cl)cc2C#N)c1	ZINC000187708662	260111948	/nfs/dbraw/zinc/11/19/48/260111948.db2.gz	DYBLXLRVMJJLAN-UHFFFAOYSA-N	0	0	256.736	4.132	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CCc2sccc2[C@@H]1CC	ZINC000298452528	260154729	/nfs/dbraw/zinc/15/47/29/260154729.db2.gz	VUKXCGCGINXZBY-ZDUSSCGKSA-N	0	0	277.433	4.186	20	30		CIEDRN
CC[C@]1(C)C[C@@H]1C(=O)Nc1cc(C#N)ccc1NC1CC1	ZINC000329078742	529411294	/nfs/dbraw/zinc/41/12/94/529411294.db2.gz	BRPBRBRGOPHRLM-CXAGYDPISA-N	0	0	283.375	4.157	20	30		CIEDRN
C=CCC[C@H](C(=O)N[C@H]1CCC[C@@H](F)C1)c1ccccc1	ZINC000573372185	334932328	/nfs/dbraw/zinc/93/23/28/334932328.db2.gz	CYNOKHYVKUDGQX-IKGGRYGDSA-N	0	0	289.394	4.133	20	30		CIEDRN
CC[C@@H](CC1CCCCC1)C(=O)Nc1nncn1C1CC1	ZINC000329098665	529463113	/nfs/dbraw/zinc/46/31/13/529463113.db2.gz	CXZTUNWNVDLZLO-ZDUSSCGKSA-N	0	0	290.411	4.198	20	30		CIEDRN
CC[C@H](C)CCC(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000352206853	529646560	/nfs/dbraw/zinc/64/65/60/529646560.db2.gz	PPOBEOLRJZPBAG-RDJZCZTQSA-N	0	0	286.419	4.364	20	30		CIEDRN
Cc1ccc([C@H](C)c2noc(-c3ccc(C#N)cc3)n2)cc1	ZINC000573651890	334954825	/nfs/dbraw/zinc/95/48/25/334954825.db2.gz	QMFPRQPOMIOGSS-ZDUSSCGKSA-N	0	0	289.338	4.069	20	30		CIEDRN
CC[C@H](C)NC(=O)Nc1ccccc1S[C@H](C)CC#N	ZINC000066954489	260250162	/nfs/dbraw/zinc/25/01/62/260250162.db2.gz	FUEQPPDGCQNOKN-NWDGAFQWSA-N	0	0	291.420	4.001	20	30		CIEDRN
C=CCC1(C(=O)N2CC(C)(C)[C@H]2c2ccncc2)CCCC1	ZINC000573805230	334967780	/nfs/dbraw/zinc/96/77/80/334967780.db2.gz	RWDWHLXPNLWXHQ-MRXNPFEDSA-N	0	0	298.430	4.128	20	30		CIEDRN
CCC[C@H](C#N)NC(=O)c1cc(C)c(-c2ccccc2)s1	ZINC000573860061	334972321	/nfs/dbraw/zinc/97/23/21/334972321.db2.gz	LBNBWHCDWNUUCR-CQSZACIVSA-N	0	0	298.411	4.146	20	30		CIEDRN
CCN(CCC#N)[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000123328807	187085258	/nfs/dbraw/zinc/08/52/58/187085258.db2.gz	HPGLRLPLQIKGAM-NSHDSACASA-N	0	0	270.298	4.002	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)[C@@H](C)[C@H](C)CC	ZINC000410345832	260488146	/nfs/dbraw/zinc/48/81/46/260488146.db2.gz	ROFNNHFGOVCSQM-KGLIPLIRSA-N	0	0	259.393	4.426	20	30		CIEDRN
N#Cc1cc(C(F)(F)F)ccc1NCCC1(F)CCC1	ZINC000574113286	334993516	/nfs/dbraw/zinc/99/35/16/334993516.db2.gz	JJYBMVHGKKLFHP-UHFFFAOYSA-N	0	0	286.272	4.271	20	30		CIEDRN
N#Cc1cccc(CN(Cc2cccc(F)c2)C2CC2)c1F	ZINC000352865916	227356025	/nfs/dbraw/zinc/35/60/25/227356025.db2.gz	FTTYISMUARNTBQ-UHFFFAOYSA-N	0	0	298.336	4.001	20	30		CIEDRN
COc1ccc(/C=C\C(=O)c2ccc(C)c(C)c2)cc1	ZINC000211763984	189688440	/nfs/dbraw/zinc/68/84/40/189688440.db2.gz	QTSKMQDAUFJRFB-XFFZJAGNSA-N	0	0	266.340	4.208	20	30		CIEDRN
N#CCCCCSc1ncc(-c2ccc(F)cc2)o1	ZINC000121321211	260709260	/nfs/dbraw/zinc/70/92/60/260709260.db2.gz	OPYQQYYTFSRYAT-UHFFFAOYSA-N	0	0	276.336	4.267	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@H]1CC[C@H](C)CC1	ZINC000574330686	335010939	/nfs/dbraw/zinc/01/09/39/335010939.db2.gz	XJCJMIRACYPOFC-HDJSIYSDSA-N	0	0	277.433	4.089	20	30		CIEDRN
Cc1sc2ncnc(SCC(C)(C)CC#N)c2c1C	ZINC000574466414	335022361	/nfs/dbraw/zinc/02/23/61/335022361.db2.gz	ZAVOZVMWXKWNAW-UHFFFAOYSA-N	0	0	291.445	4.340	20	30		CIEDRN
Cc1csc(NC(=O)C(C2CCC2)C2CCC2)c1C#N	ZINC000574554616	335029043	/nfs/dbraw/zinc/02/90/43/335029043.db2.gz	MVGHMEHGRANBBG-UHFFFAOYSA-N	0	0	288.416	4.083	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1cc2cccc(C)c2s1	ZINC000574601579	335033144	/nfs/dbraw/zinc/03/31/44/335033144.db2.gz	FCCJHHGBSIEWQP-AWEZNQCLSA-N	0	0	285.412	4.390	20	30		CIEDRN
CC(C)C1CCC(CN(CCC#N)Cc2cccnc2)CC1	ZINC000574676534	335038897	/nfs/dbraw/zinc/03/88/97/335038897.db2.gz	KOFVECFYZNGDKT-UHFFFAOYSA-N	0	0	299.462	4.260	20	30		CIEDRN
CCc1ccc([C@@H](C#N)NC(=O)C[C@@H](CC)C(C)C)cc1	ZINC000574721937	335042590	/nfs/dbraw/zinc/04/25/90/335042590.db2.gz	QHAWXPFMSUXMPX-NVXWUHKLSA-N	0	0	286.419	4.002	20	30		CIEDRN
C=CC[C@H](C(=O)N1CC2(CCC2)[C@@H]1C(C)C)c1ccccc1	ZINC000574779877	335047011	/nfs/dbraw/zinc/04/70/11/335047011.db2.gz	AQDBGKWQDPRJMC-ROUUACIJSA-N	0	0	297.442	4.383	20	30		CIEDRN
C[C@@H]1CCC[C@@](C#N)(NC(=O)c2cc3ccccc3s2)C1	ZINC000116800161	260005721	/nfs/dbraw/zinc/00/57/21/260005721.db2.gz	VJSOPAKDWXDDJP-SJKOYZFVSA-N	0	0	298.411	4.104	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N(C)[C@H](C)c1cccc(Cl)c1	ZINC000116971237	260019446	/nfs/dbraw/zinc/01/94/46/260019446.db2.gz	RDVOBNDQBBCZIS-NWDGAFQWSA-N	0	0	280.799	4.007	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N(C)[C@@H](C)c1ccc(Cl)cc1	ZINC000116973652	260020008	/nfs/dbraw/zinc/02/00/08/260020008.db2.gz	OBMPJBUHTNRDLT-RYUDHWBXSA-N	0	0	280.799	4.007	20	30		CIEDRN
Cc1cc(N(C)C)ccc1N[C@H](C)c1ccc(C#N)cc1	ZINC000036934878	260052251	/nfs/dbraw/zinc/05/22/51/260052251.db2.gz	ITDMSDQOGHLFKH-CQSZACIVSA-N	0	0	279.387	4.106	20	30		CIEDRN
N#Cc1ccc(NCc2cccs2)cc1C(F)(F)F	ZINC000036984634	260061202	/nfs/dbraw/zinc/06/12/02/260061202.db2.gz	DTTUYRIRNZXVBC-UHFFFAOYSA-N	0	0	282.290	4.251	20	30		CIEDRN
C[C@@H](NCc1nc(C#N)cs1)c1ccc2ccccc2c1	ZINC000352826087	533468702	/nfs/dbraw/zinc/46/87/02/533468702.db2.gz	VSGKKLZFKXSNOB-GFCCVEGCSA-N	0	0	293.395	4.019	20	30		CIEDRN
C[C@@H](NCc1nc(C#N)cs1)c1cc2ccccc2s1	ZINC000352841905	533469204	/nfs/dbraw/zinc/46/92/04/533469204.db2.gz	UAZBYTIDMFOSDP-SNVBAGLBSA-N	0	0	299.424	4.080	20	30		CIEDRN
C[C@@H](Nc1cc(C2CC2)ccn1)c1cccc(C#N)c1	ZINC000353536883	533551627	/nfs/dbraw/zinc/55/16/27/533551627.db2.gz	CPSHPHLGXVIOSZ-GFCCVEGCSA-N	0	0	263.344	4.004	20	30		CIEDRN
COc1cccc(Cl)c1CN(CCC#N)CCC(C)C	ZINC000353422821	533557541	/nfs/dbraw/zinc/55/75/41/533557541.db2.gz	OIKKJFJEFZRVBR-UHFFFAOYSA-N	0	0	294.826	4.110	20	30		CIEDRN
Cc1[nH]nc(-c2ccccc2)c1NC(=O)[C@H]1CC1(C)C	ZINC000330147105	533656681	/nfs/dbraw/zinc/65/66/81/533656681.db2.gz	IKROMNSHHOLXTM-GFCCVEGCSA-N	0	0	269.348	4.019	20	30		CIEDRN
C=CCCC1(c2nc(-c3cc(F)cc(F)c3)no2)CC1	ZINC000575092255	335064248	/nfs/dbraw/zinc/06/42/48/335064248.db2.gz	CBQPAYMNHLSYIQ-UHFFFAOYSA-N	0	0	276.286	4.013	20	30		CIEDRN
Cc1c(CNc2cc(C)nc(C#N)c2)oc2ccc(F)cc12	ZINC000341836979	130083702	/nfs/dbraw/zinc/08/37/02/130083702.db2.gz	AIBCHBRTCYBFHM-UHFFFAOYSA-N	0	0	295.317	4.068	20	30		CIEDRN
O=C(/C=C/c1ccsc1)c1ccc(Cl)s1	ZINC000005852205	170147410	/nfs/dbraw/zinc/14/74/10/170147410.db2.gz	KQHRVKAQGYEHQH-OWOJBTEDSA-N	0	0	254.763	4.359	20	30		CIEDRN
N#CCSc1nc(-c2ccccc2)c(-c2ccccc2)[nH]1	ZINC000005901544	170152679	/nfs/dbraw/zinc/15/26/79/170152679.db2.gz	LSKVIQJXQCIWPD-UHFFFAOYSA-N	0	0	291.379	4.359	20	30		CIEDRN
CCc1c(C)sc(NC(=O)c2ccc(C)c(C)c2)c1C#N	ZINC000006122886	170177552	/nfs/dbraw/zinc/17/75/52/170177552.db2.gz	DFWUWQJLNFWQOX-UHFFFAOYSA-N	0	0	298.411	4.360	20	30		CIEDRN
CCc1c(C)sc(NC(=O)CCC2CCCC2)c1C#N	ZINC000006122840	170177826	/nfs/dbraw/zinc/17/78/26/170177826.db2.gz	XTPVXISYBWUVQJ-UHFFFAOYSA-N	0	0	290.432	4.400	20	30		CIEDRN
C=CCOc1ccccc1CNc1ccc(F)cc1	ZINC000006313058	170190206	/nfs/dbraw/zinc/19/02/06/170190206.db2.gz	NPAWXIBRKQCOKD-UHFFFAOYSA-N	0	0	257.308	4.003	20	30		CIEDRN
Cc1nc2ccccc2c(SCc2ccccc2C#N)n1	ZINC000007005799	170261989	/nfs/dbraw/zinc/26/19/89/170261989.db2.gz	RYFVQWSSSMJLFJ-UHFFFAOYSA-N	0	0	291.379	4.102	20	30		CIEDRN
CC[C@@H](C)[C@@H](C(=O)Nc1cccc(C#N)c1)c1ccccc1	ZINC000007265454	170275327	/nfs/dbraw/zinc/27/53/27/170275327.db2.gz	XQKWYLLHJGCPTQ-RDTXWAMCSA-N	0	0	292.382	4.327	20	30		CIEDRN
N#Cc1cccc(NC(=O)CCCC2CCCCC2)c1	ZINC000007265365	170275333	/nfs/dbraw/zinc/27/53/33/170275333.db2.gz	YGRRZFLLKTWEIE-UHFFFAOYSA-N	0	0	270.376	4.247	20	30		CIEDRN
N#Cc1ccc(/C=C/C(=O)c2ccc(Cl)cc2)cc1	ZINC000007718141	170298817	/nfs/dbraw/zinc/29/88/17/170298817.db2.gz	KSPUPHDQJGCQCN-BJMVGYQFSA-N	0	0	267.715	4.108	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)c2cccc(C)c2)c1	ZINC000009823771	170386589	/nfs/dbraw/zinc/38/65/89/170386589.db2.gz	BTCHTTQGXQIHHF-UHFFFAOYSA-N	0	0	281.355	4.202	20	30		CIEDRN
N#Cc1ccc(CSc2nc3ccccc3o2)c(F)c1	ZINC000010141144	170398395	/nfs/dbraw/zinc/39/83/95/170398395.db2.gz	PFIVVCQMRRBYFN-UHFFFAOYSA-N	0	0	284.315	4.131	20	30		CIEDRN
Cc1cc(C)c(NCc2ccccc2C#N)c(C)c1	ZINC000011040816	170414966	/nfs/dbraw/zinc/41/49/66/170414966.db2.gz	KGYGDWJKGYIDIW-UHFFFAOYSA-N	0	0	250.345	4.096	20	30		CIEDRN
N#Cc1ccc(COc2ccc3ccccc3c2)c(F)c1	ZINC000011231138	170416488	/nfs/dbraw/zinc/41/64/88/170416488.db2.gz	LIJMVTZJTOTPSX-UHFFFAOYSA-N	0	0	277.298	4.430	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)c1cccc(C(F)F)c1	ZINC000171555145	335070817	/nfs/dbraw/zinc/07/08/17/335070817.db2.gz	RZGAOWJMIZOGFP-UHFFFAOYSA-N	0	0	286.281	4.057	20	30		CIEDRN
N#Cc1cccc(/C=C/c2ccc3ccccc3n2)c1	ZINC000014175475	170621726	/nfs/dbraw/zinc/62/17/26/170621726.db2.gz	MLJKNUAQJFBBJL-CSKARUKUSA-N	0	0	256.308	4.277	20	30		CIEDRN
C[C@@H](Nc1ncccc1C#N)c1ccc(Cl)cc1Cl	ZINC000019814392	170880518	/nfs/dbraw/zinc/88/05/18/170880518.db2.gz	ZZJNGWFFBRRXRA-SECBINFHSA-N	0	0	292.169	4.433	20	30		CIEDRN
CSc1ccc(N[C@H](C)c2ccc(C#N)cc2)cc1	ZINC000019906372	170918394	/nfs/dbraw/zinc/91/83/94/170918394.db2.gz	CVAIBBPMTVYGRB-GFCCVEGCSA-N	0	0	268.385	4.453	20	30		CIEDRN
C[C@@H](Nc1cccc(Cl)c1)c1ccc(C#N)cc1	ZINC000019920350	170928296	/nfs/dbraw/zinc/92/82/96/170928296.db2.gz	YISCOVKKYZJAGG-LLVKDONJSA-N	0	0	256.736	4.385	20	30		CIEDRN
N#Cc1cccc(NCc2ccc3ccccc3c2)c1	ZINC000019921883	170929166	/nfs/dbraw/zinc/92/91/66/170929166.db2.gz	UISAXRSTKAQGIQ-UHFFFAOYSA-N	0	0	258.324	4.324	20	30		CIEDRN
CC(C)c1cccc(OCc2cccc(C#N)c2)c1	ZINC000019992877	170962936	/nfs/dbraw/zinc/96/29/36/170962936.db2.gz	PLIJLKXSCRKMOT-UHFFFAOYSA-N	0	0	251.329	4.261	20	30		CIEDRN
Cc1ccc(Cl)cc1NCc1ccc(C#N)cc1F	ZINC000020033146	170974322	/nfs/dbraw/zinc/97/43/22/170974322.db2.gz	AZPDIPKFRSSJKH-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
C#Cc1cccc(NCc2ccc3ccccc3c2)c1	ZINC000020552657	171247686	/nfs/dbraw/zinc/24/76/86/171247686.db2.gz	PMJYZJADRXYSIU-UHFFFAOYSA-N	0	0	257.336	4.433	20	30		CIEDRN
N#Cc1ccccc1OCc1ccc(OC(F)(F)F)cc1	ZINC000020552289	171247687	/nfs/dbraw/zinc/24/76/87/171247687.db2.gz	FSUUPABLYJWZDJ-UHFFFAOYSA-N	0	0	293.244	4.036	20	30		CIEDRN
CCCCC1CCC(C(=O)Nc2ccccc2C#N)CC1	ZINC000020558229	171250663	/nfs/dbraw/zinc/25/06/63/171250663.db2.gz	ARGMRIUOAVTGLB-UHFFFAOYSA-N	0	0	284.403	4.493	20	30		CIEDRN
Cc1cc(OCc2ccc(C#N)cc2F)ccc1Cl	ZINC000020566388	171254804	/nfs/dbraw/zinc/25/48/04/171254804.db2.gz	XITXHBJORPGSDU-UHFFFAOYSA-N	0	0	275.710	4.238	20	30		CIEDRN
COc1ccc2cc(CNc3cccc(C#N)c3)ccc2c1	ZINC000020828344	171275255	/nfs/dbraw/zinc/27/52/55/171275255.db2.gz	VIGTYGADCDJCLE-UHFFFAOYSA-N	0	0	288.350	4.332	20	30		CIEDRN
CCCc1ccc(NCc2ccc(C#N)cc2)cc1	ZINC000021809043	171328535	/nfs/dbraw/zinc/32/85/35/171328535.db2.gz	PTQKUSKSJVPZPD-UHFFFAOYSA-N	0	0	250.345	4.123	20	30		CIEDRN
N#Cc1cccnc1Oc1ccc(Cl)c(Cl)c1	ZINC000022797607	171399578	/nfs/dbraw/zinc/39/95/78/171399578.db2.gz	XYVUJRFTULRGGP-UHFFFAOYSA-N	0	0	265.099	4.052	20	30		CIEDRN
Cc1ccc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1	ZINC000025438154	171457893	/nfs/dbraw/zinc/45/78/93/171457893.db2.gz	OOZPJZVAUVCDMF-UHFFFAOYSA-N	0	0	278.355	4.049	20	30		CIEDRN
N#Cc1c(F)cccc1NCc1cccc(C(F)(F)F)c1	ZINC000035134950	172001872	/nfs/dbraw/zinc/00/18/72/172001872.db2.gz	JUYPSNWFCTULAB-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
N#Cc1ccc(CNc2cc(Cl)ccc2F)c(F)c1	ZINC000035185284	172038958	/nfs/dbraw/zinc/03/89/58/172038958.db2.gz	NKGUCMNRAGNDSZ-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
CC(C)[C@H](Nc1ccc(C#N)cc1)c1ccccc1	ZINC000035254968	172084085	/nfs/dbraw/zinc/08/40/85/172084085.db2.gz	WZZQHNAALWAUEY-KRWDZBQOSA-N	0	0	250.345	4.367	20	30		CIEDRN
CC(C)CCNc1ccc(C#N)c(C(F)(F)F)c1	ZINC000036805563	172722825	/nfs/dbraw/zinc/72/28/25/172722825.db2.gz	XZHLHSFUUBAALX-UHFFFAOYSA-N	0	0	256.271	4.035	20	30		CIEDRN
CCCCc1ccc(Nc2ccc(C#N)cn2)cc1	ZINC000037250979	173063203	/nfs/dbraw/zinc/06/32/03/173063203.db2.gz	HIQBMFNVVNAJFH-UHFFFAOYSA-N	0	0	251.333	4.039	20	30		CIEDRN
Cc1ccc(Cl)cc1NC(=O)C1(C#N)CCCCC1	ZINC000044385438	175169628	/nfs/dbraw/zinc/16/96/28/175169628.db2.gz	IMVINAMHGKMCAZ-UHFFFAOYSA-N	0	0	276.767	4.061	20	30		CIEDRN
Cc1ccc([C@H](C)Nc2ccc(C#N)cc2F)s1	ZINC000044386611	175170140	/nfs/dbraw/zinc/17/01/40/175170140.db2.gz	APUKORHQUYOPBF-JTQLQIEISA-N	0	0	260.337	4.240	20	30		CIEDRN
Cc1ccccc1CSCc1ccc(C#N)cc1	ZINC000047820225	175414023	/nfs/dbraw/zinc/41/40/23/175414023.db2.gz	KDPVCFOWCGJLQX-UHFFFAOYSA-N	0	0	253.370	4.300	20	30		CIEDRN
CCc1ccc(N[C@H](C)c2ccc(OCC#N)cc2)cc1	ZINC000037212915	260074877	/nfs/dbraw/zinc/07/48/77/260074877.db2.gz	USJSPLFAPDHXBW-CQSZACIVSA-N	0	0	280.371	4.324	20	30		CIEDRN
CCc1cc(NCc2ccc(F)c(C#N)c2)ccc1C	ZINC000312472030	260078786	/nfs/dbraw/zinc/07/87/86/260078786.db2.gz	BKLMYADAONGDTK-UHFFFAOYSA-N	0	0	268.335	4.180	20	30		CIEDRN
C[C@@H](Nc1ccc(C#N)c(Cl)c1)c1ccc(N(C)C)cc1	ZINC000037253307	260079045	/nfs/dbraw/zinc/07/90/45/260079045.db2.gz	NIHVXAQJZPTWHR-GFCCVEGCSA-N	0	0	299.805	4.451	20	30		CIEDRN
N#CC1(C(=O)N[C@H]2CC=C(c3ccc(F)cc3)CC2)CCC1	ZINC000329245520	227378469	/nfs/dbraw/zinc/37/84/69/227378469.db2.gz	QOYBEMWVUWVLBB-INIZCTEOSA-N	0	0	298.361	4.412	20	30		CIEDRN
N#CC1(CSCc2sccc2Br)CC1	ZINC000344466391	225067492	/nfs/dbraw/zinc/06/74/92/225067492.db2.gz	AHUKZJNCELZSBX-UHFFFAOYSA-N	0	0	288.235	4.048	20	30		CIEDRN
C[C@H](N[C@H]1CCCCc2cc(C#N)ccc21)c1nccs1	ZINC000334835256	225328191	/nfs/dbraw/zinc/32/81/91/225328191.db2.gz	JEEVRRQLSUSGHQ-LRDDRELGSA-N	0	0	297.427	4.133	20	30		CIEDRN
C[C@H](c1ccccc1)N(CCC#N)Cc1ccccc1	ZINC000346298774	225748296	/nfs/dbraw/zinc/74/82/96/225748296.db2.gz	AQKWDWWARHXSHY-MRXNPFEDSA-N	0	0	264.372	4.163	20	30		CIEDRN
C[C@H](c1cccc(C(F)(F)F)c1)N(C)CC1(C#N)CC1	ZINC000347450849	226159497	/nfs/dbraw/zinc/15/94/97/226159497.db2.gz	BAUUBNWWOLWGOQ-LLVKDONJSA-N	0	0	282.309	4.002	20	30		CIEDRN
N#Cc1c(F)cccc1NCC1(c2ccncc2)CCCC1	ZINC000354047137	226879107	/nfs/dbraw/zinc/87/91/07/226879107.db2.gz	IPTQRMGAZFEXSG-UHFFFAOYSA-N	0	0	295.361	4.016	20	30		CIEDRN
Cc1sc(NC(=O)c2cccc(C(C)C)n2)c(C#N)c1C	ZINC000354799158	227119421	/nfs/dbraw/zinc/11/94/21/227119421.db2.gz	ZJAYXKCYUNMFDK-UHFFFAOYSA-N	0	0	299.399	4.007	20	30		CIEDRN
C=C[C@](C)(CC)c1nc([C@H](OCC)c2ccccc2)no1	ZINC000575217568	335082740	/nfs/dbraw/zinc/08/27/40/335082740.db2.gz	RWXJAXWFCKGZQI-RHSMWYFYSA-N	0	0	286.375	4.049	20	30		CIEDRN
COc1ccc(C#N)cc1NCc1c(C)oc2ccccc21	ZINC000354865280	227182982	/nfs/dbraw/zinc/18/29/82/227182982.db2.gz	ZFGDPFXXTZRCQG-UHFFFAOYSA-N	0	0	292.338	4.234	20	30		CIEDRN
Cc1nc(CCNC(=O)[C@H]2CC[C@H](C(C)C)CC2)c(C)o1	ZINC000329001112	227254405	/nfs/dbraw/zinc/25/44/05/227254405.db2.gz	GXLOKXZNYFCLGK-SHTZXODSSA-N	0	0	292.423	4.253	20	30		CIEDRN
Cc1nnc(NC(=O)[C@@H]2CCC[C@H]3CCCC[C@H]32)s1	ZINC000329037113	227266863	/nfs/dbraw/zinc/26/68/63/227266863.db2.gz	ZFBSUPSFCJHDAY-IJLUTSLNSA-N	0	0	279.409	4.041	20	30		CIEDRN
Cc1nc(C(C)C)oc1C(=O)N[C@@H]1C[C@H]1C1CCCCC1	ZINC000329034947	227267232	/nfs/dbraw/zinc/26/72/32/227267232.db2.gz	CAOOAIFWVMGFBX-UONOGXRCSA-N	0	0	290.407	4.380	20	30		CIEDRN
O=C(CCc1nc2ccccc2o1)N[C@H]1CC12CCCCC2	ZINC000329096127	227293745	/nfs/dbraw/zinc/29/37/45/227293745.db2.gz	BPFILCPLNDGRGY-HNNXBMFYSA-N	0	0	298.386	4.440	20	30		CIEDRN
Cc1nnc(NC(=O)C[C@H](C)C2CCCCC2)n1C1CC1	ZINC000329153244	227329799	/nfs/dbraw/zinc/32/97/99/227329799.db2.gz	UDGWEKSKLBWWEB-NSHDSACASA-N	0	0	290.411	4.116	20	30		CIEDRN
N#Cc1ccc(N[C@@H](c2nccs2)c2ccccc2)cc1	ZINC000301201254	227474957	/nfs/dbraw/zinc/47/49/57/227474957.db2.gz	PLGBACGPJQFPOZ-MRXNPFEDSA-N	0	0	291.379	4.216	20	30		CIEDRN
C[C@H](Nc1ccnc2ccsc21)c1ccc(C#N)cc1	ZINC000301354506	227518325	/nfs/dbraw/zinc/51/83/25/227518325.db2.gz	LLJKZAHSLDRURI-NSHDSACASA-N	0	0	279.368	4.341	20	30		CIEDRN
N#Cc1cnc2ccccc2c1NCc1cc2ccccc2[nH]1	ZINC000301407849	227529823	/nfs/dbraw/zinc/52/98/23/227529823.db2.gz	MZDUHZQJFGRHGW-UHFFFAOYSA-N	0	0	298.349	4.200	20	30		CIEDRN
Cc1cc(C)c2ncc(C#N)c(NC[C@H]3CCCS3)c2c1	ZINC000301605346	227608256	/nfs/dbraw/zinc/60/82/56/227608256.db2.gz	MGGHJFSSGXEYJC-CQSZACIVSA-N	0	0	297.427	4.031	20	30		CIEDRN
C[C@@H](Nc1nc(C(F)(F)F)cs1)c1ccc(C#N)cc1	ZINC000301729558	227654594	/nfs/dbraw/zinc/65/45/94/227654594.db2.gz	OCJMVIHIGJJRIO-MRVPVSSYSA-N	0	0	297.305	4.207	20	30		CIEDRN
Cc1nnc(S[C@H](C)CCC#N)n1[C@@H]1CCC[C@@H](C)C1	ZINC000330540153	227691736	/nfs/dbraw/zinc/69/17/36/227691736.db2.gz	XPGAZVWCSRVWFO-YRGRVCCFSA-N	0	0	292.452	4.122	20	30		CIEDRN
N#Cc1cccc(C#N)c1SCC1CCCCC1	ZINC000302878363	227896232	/nfs/dbraw/zinc/89/62/32/227896232.db2.gz	HBSNPDQPZNSAKT-UHFFFAOYSA-N	0	0	256.374	4.102	20	30		CIEDRN
Cc1c(Nc2cccc(F)c2C#N)cnn1C1CCCC1	ZINC000302885686	227896560	/nfs/dbraw/zinc/89/65/60/227896560.db2.gz	MOWDNYSROKHBNA-UHFFFAOYSA-N	0	0	284.338	4.061	20	30		CIEDRN
N#C[C@@H]1CCC[C@H](Nc2cccc(OC(F)(F)F)c2)C1	ZINC000193076856	227953898	/nfs/dbraw/zinc/95/38/98/227953898.db2.gz	NXEBHXBDXZDPTD-MNOVXSKESA-N	0	0	284.281	4.079	20	30		CIEDRN
O=C(N[C@H](c1cccs1)C1CC1)[C@@H]1CCCCC(=O)N1	ZINC000329885876	227976376	/nfs/dbraw/zinc/97/63/76/227976376.db2.gz	VHABJOFQFYXUBN-FZMZJTMJSA-N	0	0	292.404	4.055	20	30		CIEDRN
O=C(Nc1cccc(-c2cc[nH]n2)c1)[C@@H]1CC12CCCC2	ZINC000329994426	228010022	/nfs/dbraw/zinc/01/00/22/228010022.db2.gz	MEBHMGOTMMPLIM-AWEZNQCLSA-N	0	0	281.359	4.245	20	30		CIEDRN
Cc1onc(-c2ccccc2C)c1C(=O)N[C@H]1C=CCCC1	ZINC000330018456	228017568	/nfs/dbraw/zinc/01/75/68/228017568.db2.gz	SVHOQKYZWGWVDF-AWEZNQCLSA-N	0	0	296.370	4.372	20	30		CIEDRN
N#Cc1cc(CNc2c(F)cccc2Cl)ccc1F	ZINC000193105994	228022352	/nfs/dbraw/zinc/02/23/52/228022352.db2.gz	IBPJTLFUHMAYRD-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
CCc1oc2ccccc2c1CN(CCC#N)CC1CC1	ZINC000353401003	228096224	/nfs/dbraw/zinc/09/62/24/228096224.db2.gz	GSJANDRSXPOKSE-UHFFFAOYSA-N	0	0	282.387	4.121	20	30		CIEDRN
C[C@H]1C[C@@H]1c1ccc(CN(CCC#N)CC(C)(C)C)o1	ZINC000353421036	228100203	/nfs/dbraw/zinc/10/02/03/228100203.db2.gz	IVXXMBLHRGCRKO-ZFWWWQNUSA-N	0	0	274.408	4.165	20	30		CIEDRN
CCc1noc(C)c1C(=O)N[C@H]1CCCCC12CCCC2	ZINC000330143227	228049407	/nfs/dbraw/zinc/04/94/07/228049407.db2.gz	YRTRDJHUGKCDGT-AWEZNQCLSA-N	0	0	290.407	4.353	20	30		CIEDRN
N#C[C@@H]1CCC[C@@H](Nc2cccc3ccccc32)C1	ZINC000193118966	228051784	/nfs/dbraw/zinc/05/17/84/228051784.db2.gz	DHVKYPJWBQOVJQ-UKRRQHHQSA-N	0	0	250.345	4.334	20	30		CIEDRN
Cc1cc(NC(=O)c2cc(C#N)cs2)ccc1C1CC1	ZINC000355949149	228063330	/nfs/dbraw/zinc/06/33/30/228063330.db2.gz	XZQAKIJOXQEAAQ-UHFFFAOYSA-N	0	0	282.368	4.058	20	30		CIEDRN
O=C(C[C@H]1CCOC1)Nc1ncc(C2CCCCC2)s1	ZINC000330202433	228064435	/nfs/dbraw/zinc/06/44/35/228064435.db2.gz	ZHEREZGBTOBIBK-LLVKDONJSA-N	0	0	294.420	4.205	20	30		CIEDRN
Cc1cccc(NC(=O)C[C@@H](CC#N)c2ccccc2)c1	ZINC000353354856	228089886	/nfs/dbraw/zinc/08/98/86/228089886.db2.gz	QJMRFKZUDOTLEO-MRXNPFEDSA-N	0	0	278.355	4.021	20	30		CIEDRN
N#Cc1c(NC(=O)CC2CCCC2)sc2c1CCCC2	ZINC000331813747	228129352	/nfs/dbraw/zinc/12/93/52/228129352.db2.gz	OCSZWIKZGNWVIV-UHFFFAOYSA-N	0	0	288.416	4.017	20	30		CIEDRN
N#CCCC[C@@H](NC(=O)C1CCCCC1)c1ccccc1	ZINC000352165089	228190755	/nfs/dbraw/zinc/19/07/55/228190755.db2.gz	BBCPYBCRIZBBFJ-QGZVFWFLSA-N	0	0	284.403	4.118	20	30		CIEDRN
N#Cc1cc(Cl)cc(OCc2nc(C3CC3)cs2)c1	ZINC000352175187	228191949	/nfs/dbraw/zinc/19/19/49/228191949.db2.gz	SNNXLIDXDFUKNC-UHFFFAOYSA-N	0	0	290.775	4.125	20	30		CIEDRN
Cc1ccc(C#N)c(N[C@H]2CCc3c2cccc3Cl)n1	ZINC000179763710	260068198	/nfs/dbraw/zinc/06/81/98/260068198.db2.gz	CMRLYZAVINEMJR-HNNXBMFYSA-N	0	0	283.762	4.015	20	30		CIEDRN
COc1ccc(CC[C@H](C)Nc2ccc(C#N)cc2)cc1	ZINC000037212059	260074402	/nfs/dbraw/zinc/07/44/02/260074402.db2.gz	LCPYKIUYFDQHAM-AWEZNQCLSA-N	0	0	280.371	4.000	20	30		CIEDRN
CCc1ccccc1N[C@@H](C)c1ccc(OCC#N)cc1	ZINC000037213320	260074939	/nfs/dbraw/zinc/07/49/39/260074939.db2.gz	GWFZDEBEWATXOY-AWEZNQCLSA-N	0	0	280.371	4.324	20	30		CIEDRN
Cc1cc(Cl)c(C(=O)Nc2cccc(C#N)c2)cc1C	ZINC000180234482	260095944	/nfs/dbraw/zinc/09/59/44/260095944.db2.gz	NYFVIGQOBQBQPB-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
Cc1cc(Cl)c(C(=O)Nc2ccc(CC#N)cc2)cc1C	ZINC000180337191	260098175	/nfs/dbraw/zinc/09/81/75/260098175.db2.gz	QDOWYBJGMCRKRK-UHFFFAOYSA-N	0	0	298.773	4.275	20	30		CIEDRN
CC(C)(C)C[C@H](NCc1cc(C#N)cs1)C(F)(F)F	ZINC000180366381	260098998	/nfs/dbraw/zinc/09/89/98/260098998.db2.gz	NZPKAPNYTBROIW-NSHDSACASA-N	0	0	290.354	4.076	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1cccc(Oc2ccccc2)c1	ZINC000180459682	260103005	/nfs/dbraw/zinc/10/30/05/260103005.db2.gz	TVLIEICKQIUWBL-UHFFFAOYSA-N	0	0	281.355	4.127	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@H](CC)c1cccc(Cl)c1	ZINC000180646912	260107838	/nfs/dbraw/zinc/10/78/38/260107838.db2.gz	TVHGSNFNRUDULE-CQSZACIVSA-N	0	0	280.799	4.009	20	30		CIEDRN
Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(C#N)cc2)cc1	ZINC000037508448	260113500	/nfs/dbraw/zinc/11/35/00/260113500.db2.gz	YLSWJHFIKQZJCU-CABCVRRESA-N	0	0	264.372	4.279	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1ccc(-c2ccccn2)cc1	ZINC000517751222	260121759	/nfs/dbraw/zinc/12/17/59/260121759.db2.gz	MYUVDVGEXUUFGQ-HNNXBMFYSA-N	0	0	295.386	4.225	20	30		CIEDRN
C=CCCc1noc(CC(C)(C)CC(=O)c2ccccc2)n1	ZINC000297467340	260127106	/nfs/dbraw/zinc/12/71/06/260127106.db2.gz	YIWBXQXKZASRRX-UHFFFAOYSA-N	0	0	298.386	4.030	20	30		CIEDRN
C=C[C@](C)(CC)c1nc([C@@H](C)c2c(F)cccc2F)no1	ZINC000516812709	260131213	/nfs/dbraw/zinc/13/12/13/260131213.db2.gz	WMARJLNAEHFDTP-MGPLVRAMSA-N	0	0	292.329	4.353	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(Oc2ccncc2)cc1	ZINC000187721059	260164009	/nfs/dbraw/zinc/16/40/09/260164009.db2.gz	RTIWRFMYPZKYDY-GOSISDBHSA-N	0	0	296.370	4.415	20	30		CIEDRN
CC(C)(C)c1ccc(C(=O)NC2(C#N)CCCCC2)s1	ZINC000408003511	260169018	/nfs/dbraw/zinc/16/90/18/260169018.db2.gz	STQJVYAZTCOHAM-UHFFFAOYSA-N	0	0	290.432	4.002	20	30		CIEDRN
C[C@@H](Nc1nc(C(F)(F)F)ccc1C#N)c1ccccc1	ZINC000078831906	260169244	/nfs/dbraw/zinc/16/92/44/260169244.db2.gz	OWCGVUMXXBGCFK-SNVBAGLBSA-N	0	0	291.276	4.145	20	30		CIEDRN
C[C@H](Nc1nc(C(F)(F)F)ccc1C#N)c1ccccc1	ZINC000078831896	260169459	/nfs/dbraw/zinc/16/94/59/260169459.db2.gz	OWCGVUMXXBGCFK-JTQLQIEISA-N	0	0	291.276	4.145	20	30		CIEDRN
N#Cc1ccc(F)cc1CSc1ccc(N)cc1Cl	ZINC000085147629	260201570	/nfs/dbraw/zinc/20/15/70/260201570.db2.gz	DMYRHJNTMGWFRL-UHFFFAOYSA-N	0	0	292.766	4.225	20	30		CIEDRN
N#Cc1ccc(SCc2cccc(F)c2F)c(F)c1	ZINC000525503443	260217256	/nfs/dbraw/zinc/21/72/56/260217256.db2.gz	OLNVPSDLNVJGPG-UHFFFAOYSA-N	0	0	279.286	4.268	20	30		CIEDRN
CCCc1nc(CSc2ccc(C#N)cc2F)cs1	ZINC000525503371	260217538	/nfs/dbraw/zinc/21/75/38/260217538.db2.gz	JLEGXRAIVMZCJR-UHFFFAOYSA-N	0	0	292.404	4.399	20	30		CIEDRN
CCOc1cc(C#N)ccc1OC[C@H]1CCCC(F)(F)C1	ZINC000313091735	260246918	/nfs/dbraw/zinc/24/69/18/260246918.db2.gz	UFMSNSKHBVBINK-ZDUSSCGKSA-N	0	0	295.329	4.161	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N(C)Cc1ccccc1C(F)(F)F	ZINC000190038660	260248672	/nfs/dbraw/zinc/24/86/72/260248672.db2.gz	YECDWSZWVCVWPU-OAHLLOKOSA-N	0	0	299.336	4.266	20	30		CIEDRN
N#Cc1ccc(Oc2ccc3ccccc3c2)cc1[N+](=O)[O-]	ZINC000317529352	260251792	/nfs/dbraw/zinc/25/17/92/260251792.db2.gz	JXYPIEQRKYUVTK-UHFFFAOYSA-N	0	0	290.278	4.412	20	30		CIEDRN
N#Cc1ccc(NC(=O)C2CCCCC2)cc1C(F)(F)F	ZINC000088191883	260290490	/nfs/dbraw/zinc/29/04/90/260290490.db2.gz	UUXKAXDHWSFYPV-UHFFFAOYSA-N	0	0	296.292	4.096	20	30		CIEDRN
N#Cc1ccc(OCc2cnc3ccccc3c2)cc1Cl	ZINC000313400687	260291284	/nfs/dbraw/zinc/29/12/84/260291284.db2.gz	POYDGPBVKMIQQH-UHFFFAOYSA-N	0	0	294.741	4.339	20	30		CIEDRN
CC(C)(C)c1csc(CNc2cccc(CC#N)c2)n1	ZINC000313413690	260292118	/nfs/dbraw/zinc/29/21/18/260292118.db2.gz	WRSFVUGQZDYYKO-UHFFFAOYSA-N	0	0	285.416	4.119	20	30		CIEDRN
C[C@@H](CCNc1cccc(CC#N)c1)c1ccccc1	ZINC000313437203	260293723	/nfs/dbraw/zinc/29/37/23/260293723.db2.gz	NGCCMALWEBGCHQ-HNNXBMFYSA-N	0	0	264.372	4.358	20	30		CIEDRN
Cc1ccccc1C1CC(Nc2cccc(CC#N)c2)C1	ZINC000313443668	260294546	/nfs/dbraw/zinc/29/45/46/260294546.db2.gz	YMUVPLLAIBQXSI-UHFFFAOYSA-N	0	0	276.383	4.419	20	30		CIEDRN
Cc1ccc(NCc2cc(C#N)cs2)c2cccnc12	ZINC000093686712	260301677	/nfs/dbraw/zinc/30/16/77/260301677.db2.gz	BLCBTKSHOFWQCK-UHFFFAOYSA-N	0	0	279.368	4.089	20	30		CIEDRN
CC[C@H](CC(=O)Nc1sc2c(c1C#N)CCC2)C(C)C	ZINC000517921411	260317233	/nfs/dbraw/zinc/31/72/33/260317233.db2.gz	LTYDBRFDARTFLE-LLVKDONJSA-N	0	0	290.432	4.119	20	30		CIEDRN
Cc1cc(NCCC(C)(C)C#N)ccc1Br	ZINC000083637716	260354064	/nfs/dbraw/zinc/35/40/64/260354064.db2.gz	HGYILKCGRPWPJB-UHFFFAOYSA-N	0	0	281.197	4.109	20	30		CIEDRN
COc1cc(C)cc(NC2CCC(C)(C#N)CC2)c1C	ZINC000449290605	260367670	/nfs/dbraw/zinc/36/76/70/260367670.db2.gz	XSYOLUCAWQIJOJ-UHFFFAOYSA-N	0	0	272.392	4.196	20	30		CIEDRN
C=CCCc1ccccc1N[C@@H]1CCOC2(CCC2)C1	ZINC000449305912	260385915	/nfs/dbraw/zinc/38/59/15/260385915.db2.gz	ILLCQRGINRIWKN-MRXNPFEDSA-N	0	0	271.404	4.319	20	30		CIEDRN
C=CC1CCN(C(=O)CCc2ccc(C(C)(C)C)cc2)CC1	ZINC000518378675	260391991	/nfs/dbraw/zinc/39/19/91/260391991.db2.gz	BYDGIXPIQMMOEN-UHFFFAOYSA-N	0	0	299.458	4.341	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1ccc(Oc2ccccc2)o1	ZINC000410124310	260462844	/nfs/dbraw/zinc/46/28/44/260462844.db2.gz	JWGSSPCZKNADQE-ZDUSSCGKSA-N	0	0	285.343	4.156	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1ccc(SC(C)C)cc1	ZINC000410122559	260463439	/nfs/dbraw/zinc/46/34/39/260463439.db2.gz	ZKICZKBFKNGRAV-CQSZACIVSA-N	0	0	277.433	4.272	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@@H](C)Sc1ccccc1Cl	ZINC000410142523	260465870	/nfs/dbraw/zinc/46/58/70/260465870.db2.gz	MAUGVICXWQYBFS-NEPJUHHUSA-N	0	0	297.851	4.292	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)CSc1ccc2ccccc2c1	ZINC000410138970	260466370	/nfs/dbraw/zinc/46/63/70/260466370.db2.gz	WBTHWQVRENBYHV-INIZCTEOSA-N	0	0	299.439	4.403	20	30		CIEDRN
Cc1cccc(NC(=O)Nc2ccc(C#N)cc2Cl)c1C	ZINC000426161348	260478700	/nfs/dbraw/zinc/47/87/00/260478700.db2.gz	NTKWTZUDBFGRHR-UHFFFAOYSA-N	0	0	299.761	4.473	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1ccc(OC)c(F)c1	ZINC000410346452	260487811	/nfs/dbraw/zinc/48/78/11/260487811.db2.gz	VXYPZGSHLOZPBG-UHFFFAOYSA-N	0	0	299.345	4.205	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1scnc1C1CC1	ZINC000410352155	260488222	/nfs/dbraw/zinc/48/82/22/260488222.db2.gz	IJLZFTMNQMELNM-UHFFFAOYSA-N	0	0	298.411	4.391	20	30		CIEDRN
C=CCCCC(=O)N[C@]1(c2ccc(Cl)cc2)C[C@@H]1C	ZINC000410373580	260492415	/nfs/dbraw/zinc/49/24/15/260492415.db2.gz	KOOIMBYZWWERRR-BLLLJJGKSA-N	0	0	277.795	4.048	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N(C)C/C(C)=C\c1ccccc1	ZINC000427225697	260571317	/nfs/dbraw/zinc/57/13/17/260571317.db2.gz	PQHSDVTUFVAYPM-OJSRQPNCSA-N	0	0	271.404	4.151	20	30		CIEDRN
CC[C@H](C)[C@@H](C)C(=O)N(CC)c1ccc(C#N)c(Cl)c1	ZINC000181174628	260573254	/nfs/dbraw/zinc/57/32/54/260573254.db2.gz	SSMWRYFKWVXWOE-NWDGAFQWSA-N	0	0	292.810	4.247	20	30		CIEDRN
C[C@H](CC#N)Sc1ccccc1NC(=O)CCC1CC1	ZINC000115069289	260673936	/nfs/dbraw/zinc/67/39/36/260673936.db2.gz	CTPJYMVGMGHWNG-GFCCVEGCSA-N	0	0	288.416	4.210	20	30		CIEDRN
C[C@H](CC#N)NC(=O)Nc1ccc2c(c1)oc1ccccc12	ZINC000156015224	260779477	/nfs/dbraw/zinc/77/94/77/260779477.db2.gz	FELBVFLUGXCBIU-LLVKDONJSA-N	0	0	293.326	4.010	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@H](C)c1cc2ccccc2s1	ZINC000448930509	260797270	/nfs/dbraw/zinc/79/72/70/260797270.db2.gz	YLPWZPXLXUSGCM-LLVKDONJSA-N	0	0	273.401	4.291	20	30		CIEDRN
Cc1cc(C#N)cc(N(C)[C@H](C)c2cccc(Cl)c2)n1	ZINC000161048379	260804564	/nfs/dbraw/zinc/80/45/64/260804564.db2.gz	SEUAFWMHTRHBNY-GFCCVEGCSA-N	0	0	285.778	4.113	20	30		CIEDRN
CCc1ccccc1C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000156959149	260812902	/nfs/dbraw/zinc/81/29/02/260812902.db2.gz	KKSRVAXIGQKZQV-GOSISDBHSA-N	0	0	292.382	4.024	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)C(C)(C)C1CCCC1	ZINC000448135560	260861316	/nfs/dbraw/zinc/86/13/16/260861316.db2.gz	VLXNWLIWSALASN-UHFFFAOYSA-N	0	0	291.460	4.479	20	30		CIEDRN
Cc1ccc(F)cc1NCc1cccc(OCCCC#N)c1	ZINC000157775402	260862229	/nfs/dbraw/zinc/86/22/29/260862229.db2.gz	ROHKJUWJMJASHB-UHFFFAOYSA-N	0	0	298.361	4.429	20	30		CIEDRN
C=CCC(C)(C)c1nc(C(C)(C)c2cccc(F)c2)no1	ZINC000426570971	260865362	/nfs/dbraw/zinc/86/53/62/260865362.db2.gz	QQLNAQVSCROKTP-UHFFFAOYSA-N	0	0	288.366	4.388	20	30		CIEDRN
COc1ccc(NCc2ccccc2C(C)(C)C#N)cc1F	ZINC000131558437	260876530	/nfs/dbraw/zinc/87/65/30/260876530.db2.gz	UKDPPXABVCRUHO-UHFFFAOYSA-N	0	0	298.361	4.248	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1cc(C)cc(F)c1)c1ccccc1	ZINC000489738767	260926951	/nfs/dbraw/zinc/92/69/51/260926951.db2.gz	OBLOYNDZAZRIQL-QGZVFWFLSA-N	0	0	283.346	4.433	20	30		CIEDRN
Cc1ccc(NCC(C)(C)CCC#N)cc1-c1ncco1	ZINC000152112992	261060177	/nfs/dbraw/zinc/06/01/77/261060177.db2.gz	WJBYIGOCJSNFNG-UHFFFAOYSA-N	0	0	283.375	4.392	20	30		CIEDRN
COc1ccc(OC(F)F)c(NCCCC(C)(C)C#N)c1	ZINC000153294066	261076364	/nfs/dbraw/zinc/07/63/64/261076364.db2.gz	SBDAFPCQNLWYQZ-UHFFFAOYSA-N	0	0	298.333	4.038	20	30		CIEDRN
CC(C)(C#N)CCCNc1ccccc1OCC1CC1	ZINC000154113265	261088254	/nfs/dbraw/zinc/08/82/54/261088254.db2.gz	IKMOLSQLSGAFFF-UHFFFAOYSA-N	0	0	272.392	4.217	20	30		CIEDRN
CC(C)(C)c1cc(NC(=O)c2cccs2)c(C#N)s1	ZINC000154260589	261089755	/nfs/dbraw/zinc/08/97/55/261089755.db2.gz	ONAJAGQYAKSSCX-UHFFFAOYSA-N	0	0	290.413	4.231	20	30		CIEDRN
Cc1ccc(C#N)cc1NCc1ncc(C(C)(C)C)s1	ZINC000448336739	261118653	/nfs/dbraw/zinc/11/86/53/261118653.db2.gz	HMQWKJVHUZRHSF-UHFFFAOYSA-N	0	0	285.416	4.233	20	30		CIEDRN
C[C@@H](SCc1nccs1)c1ccc(C#N)cc1	ZINC000161682828	261121959	/nfs/dbraw/zinc/12/19/59/261121959.db2.gz	FRBFQOVHDRKROZ-SNVBAGLBSA-N	0	0	260.387	4.009	20	30		CIEDRN
C=CCCCNC(=O)N(CC)[C@@H](CC)Cc1ccccc1	ZINC000448384116	261136622	/nfs/dbraw/zinc/13/66/22/261136622.db2.gz	DDLLXARVBAHVLT-KRWDZBQOSA-N	0	0	288.435	4.005	20	30		CIEDRN
C=CCCCNC(=O)N(CC)Cc1ccc2ccccc2c1	ZINC000448384971	261136854	/nfs/dbraw/zinc/13/68/54/261136854.db2.gz	RUWPYXGMGQIIRU-UHFFFAOYSA-N	0	0	296.414	4.338	20	30		CIEDRN
C=CCCCNC(=O)N1CCCC[C@H]1c1ccc(C)cc1	ZINC000448389745	261139082	/nfs/dbraw/zinc/13/90/82/261139082.db2.gz	SECPFFOTAWXTKH-KRWDZBQOSA-N	0	0	286.419	4.198	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccc(OC(C)C)c(C)c1	ZINC000173734915	261169547	/nfs/dbraw/zinc/16/95/47/261169547.db2.gz	XQFMJWLPGLWYLO-UHFFFAOYSA-N	0	0	290.407	4.212	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCCC[C@H]1Cc1ccccc1	ZINC000464447992	261182558	/nfs/dbraw/zinc/18/25/58/261182558.db2.gz	UXIYMZSMIKRSQC-WMZOPIPTSA-N	0	0	285.431	4.213	20	30		CIEDRN
CCc1noc(C)c1CS[C@@H](C)c1ccc(C#N)cc1	ZINC000159802639	261193977	/nfs/dbraw/zinc/19/39/77/261193977.db2.gz	DEGVPTXNPUDLKQ-LBPRGKRZSA-N	0	0	286.400	4.412	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCC1(c2ccccc2)CCCC1	ZINC000464562013	261194247	/nfs/dbraw/zinc/19/42/47/261194247.db2.gz	YUOXOCXQDVYVFN-MRXNPFEDSA-N	0	0	285.431	4.217	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC)C12CC3CC(CC(C3)C1)C2	ZINC000464572561	261195445	/nfs/dbraw/zinc/19/54/45/261195445.db2.gz	VVXCLPURCLRHDV-ISOUWHGUSA-N	0	0	289.463	4.406	20	30		CIEDRN
CSCCCCCNc1ccc(C#N)c(Cl)c1	ZINC000229571014	261201983	/nfs/dbraw/zinc/20/19/83/261201983.db2.gz	KKJMPQAHZHEPFL-UHFFFAOYSA-N	0	0	268.813	4.157	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)NCCC2=CCCC2)cc1	ZINC000160671161	261222357	/nfs/dbraw/zinc/22/23/57/261222357.db2.gz	NSSKIKXZEJNVAP-UHFFFAOYSA-N	0	0	297.402	4.110	20	30		CIEDRN
N#Cc1cccc(C(=O)N(CC2CCC2)c2ccccc2)c1	ZINC000175397775	261226040	/nfs/dbraw/zinc/22/60/40/261226040.db2.gz	JOCSYRXMDYLHIZ-UHFFFAOYSA-N	0	0	290.366	4.005	20	30		CIEDRN
CCCc1nc(CSCCCCC#N)cs1	ZINC000161466507	261247517	/nfs/dbraw/zinc/24/75/17/261247517.db2.gz	PMIIYZZVTYJZFT-UHFFFAOYSA-N	0	0	254.424	4.023	20	30		CIEDRN
C[C@@H](SCCCCC#N)c1ccc(F)cc1F	ZINC000161593345	261253150	/nfs/dbraw/zinc/25/31/50/261253150.db2.gz	QQSGRQWGUJQLTE-SNVBAGLBSA-N	0	0	255.333	4.453	20	30		CIEDRN
CC(C)CCN(CCC#N)C(=O)Nc1ccc(Cl)cc1	ZINC000176335602	261276525	/nfs/dbraw/zinc/27/65/25/261276525.db2.gz	JRMIFNURTIVELW-UHFFFAOYSA-N	0	0	293.798	4.134	20	30		CIEDRN
CCc1nc(CSCc2ccc(F)cc2C#N)cs1	ZINC000103166462	261278681	/nfs/dbraw/zinc/27/86/81/261278681.db2.gz	WDWGTZHTFNVBPN-UHFFFAOYSA-N	0	0	292.404	4.150	20	30		CIEDRN
CCC1(C(=O)Nc2sc3c(c2C#N)CCCC3)CCC1	ZINC000176453843	261287143	/nfs/dbraw/zinc/28/71/43/261287143.db2.gz	FZVRHEUSSLNERV-UHFFFAOYSA-N	0	0	288.416	4.017	20	30		CIEDRN
N#Cc1cnc2ccccc2c1N1CC[C@H](c2ccccc2)C1	ZINC000301107862	261329710	/nfs/dbraw/zinc/32/97/10/261329710.db2.gz	MDHZOSXCCDBILT-INIZCTEOSA-N	0	0	299.377	4.100	20	30		CIEDRN
N#Cc1cnc2ccccc2c1N1CCCc2ccccc2C1	ZINC000301178959	261330860	/nfs/dbraw/zinc/33/08/60/261330860.db2.gz	YDCSGCKMKQBMJP-UHFFFAOYSA-N	0	0	299.377	4.059	20	30		CIEDRN
N#Cc1cccc(SCc2nc3ccccc3s2)c1	ZINC000177106103	261333595	/nfs/dbraw/zinc/33/35/95/261333595.db2.gz	NEUQSGYHWIPLKH-UHFFFAOYSA-N	0	0	282.393	4.460	20	30		CIEDRN
N#Cc1ccc(/C=C/c2cnc(-c3cccs3)s2)nc1	ZINC000177614106	261364442	/nfs/dbraw/zinc/36/44/42/261364442.db2.gz	SLELLILMJLDFFG-AATRIKPKSA-N	0	0	295.392	4.309	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(C)[C@H](c1ccccc1)C(C)C	ZINC000466367600	261395537	/nfs/dbraw/zinc/39/55/37/261395537.db2.gz	XBKABZUXUOIAIH-IRXDYDNUSA-N	0	0	288.435	4.380	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Nc1cccc(C#N)c1C	ZINC000178535655	261397685	/nfs/dbraw/zinc/39/76/85/261397685.db2.gz	NIPAZRUBQZDZPK-UHFFFAOYSA-N	0	0	285.391	4.077	20	30		CIEDRN
Cc1cc(Cl)ccc1C(=O)Nc1cccc(C#N)c1C	ZINC000178629826	261399868	/nfs/dbraw/zinc/39/98/68/261399868.db2.gz	FPUVURDBCWLYFJ-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
N#CCCCC[S@](=O)Cc1ccc(-c2ccccc2)cc1	ZINC000172828371	261512466	/nfs/dbraw/zinc/51/24/66/261512466.db2.gz	CYYFIUUPNBSZIE-NRFANRHFSA-N	0	0	297.423	4.296	20	30		CIEDRN
C[C@@H](Sc1nnc(C2CC2)s1)c1ccc(C#N)cc1	ZINC000173938240	261551210	/nfs/dbraw/zinc/55/12/10/261551210.db2.gz	KCSVKTQGUTVCPL-SECBINFHSA-N	0	0	287.413	4.140	20	30		CIEDRN
CC[C@H](Nc1ccc(C#N)cc1)c1ccc(OC)c(OC)c1	ZINC000314135728	261579558	/nfs/dbraw/zinc/57/95/58/261579558.db2.gz	GSHLTHWBJFNNMX-INIZCTEOSA-N	0	0	296.370	4.139	20	30		CIEDRN
CCN(C(=O)C(C)=C1CCCC1)[C@@H](C)c1ccc(C#N)cc1	ZINC000176576862	261659133	/nfs/dbraw/zinc/65/91/33/261659133.db2.gz	CTWOYFRNYTZUGA-HNNXBMFYSA-N	0	0	296.414	4.358	20	30		CIEDRN
CC[C@H](c1ccc(F)cc1)[S@@](=O)CCCC(C)(C)C#N	ZINC000178103838	261726044	/nfs/dbraw/zinc/72/60/44/261726044.db2.gz	ACUNBJGTDRQVQO-QRWLVFNGSA-N	0	0	295.423	4.355	20	30		CIEDRN
CC(C)(CNc1ncc(C#N)cc1Cl)Cc1ccccc1	ZINC000522692554	261882728	/nfs/dbraw/zinc/88/27/28/261882728.db2.gz	NOGKFQNNRKDGFF-UHFFFAOYSA-N	0	0	299.805	4.287	20	30		CIEDRN
Cc1nnc([C@H](C)Sc2ccc(C#N)cc2Cl)s1	ZINC000181767980	261910542	/nfs/dbraw/zinc/91/05/42/261910542.db2.gz	IZZVXDZRDVFGQI-ZETCQYMHSA-N	0	0	295.820	4.225	20	30		CIEDRN
C[C@@H](C#N)Oc1ccccc1N[C@@H]1CCc2ccc(F)cc21	ZINC000182242296	261931672	/nfs/dbraw/zinc/93/16/72/261931672.db2.gz	SRTPLDSRZOKUBZ-BLLLJJGKSA-N	0	0	296.345	4.216	20	30		CIEDRN
C/C=C/c1ccc(Oc2ccc(C#N)c(C)n2)c(OC)c1	ZINC000487934588	261950620	/nfs/dbraw/zinc/95/06/20/261950620.db2.gz	OQPHQLCGLVECKN-SNAWJCMRSA-N	0	0	280.327	4.096	20	30		CIEDRN
Cc1cc(N[C@@H](C)c2ccc(C#N)cc2)ccc1N(C)C	ZINC000182848880	261953797	/nfs/dbraw/zinc/95/37/97/261953797.db2.gz	OUWJTKPKJFOGOB-AWEZNQCLSA-N	0	0	279.387	4.106	20	30		CIEDRN
N#CCCN(Cc1ccco1)Cc1ccc(C(F)F)cc1	ZINC000183954497	262001608	/nfs/dbraw/zinc/00/16/08/262001608.db2.gz	QKBLPXAATSXNER-UHFFFAOYSA-N	0	0	290.313	4.133	20	30		CIEDRN
Cc1cncc(C(=O)/C=C/c2cnc(C(C)(C)C)s2)c1	ZINC000184772146	262028804	/nfs/dbraw/zinc/02/88/04/262028804.db2.gz	MDXIGFUUDSGAKE-AATRIKPKSA-N	0	0	286.400	4.040	20	30		CIEDRN
CC(C)Cc1ncc(CNc2ccc(CC#N)cc2)s1	ZINC000185149105	262043499	/nfs/dbraw/zinc/04/34/99/262043499.db2.gz	NGFFJXCBDBQFJE-UHFFFAOYSA-N	0	0	285.416	4.020	20	30		CIEDRN
N#Cc1c(Cl)cccc1NC1CCC(F)(F)CC1	ZINC000390007248	262073455	/nfs/dbraw/zinc/07/34/55/262073455.db2.gz	MKCKTMNPVRIHAU-UHFFFAOYSA-N	0	0	270.710	4.201	20	30		CIEDRN
CC#CCCCC(=O)Nc1cc(C(C)(C)C)sc1C#N	ZINC000186094416	262079228	/nfs/dbraw/zinc/07/92/28/262079228.db2.gz	FVPGSZBZIKNPDJ-UHFFFAOYSA-N	0	0	288.416	4.049	20	30		CIEDRN
CC(F)(F)CCCNc1cc(Cl)ccc1C#N	ZINC000390076630	262108053	/nfs/dbraw/zinc/10/80/53/262108053.db2.gz	VIWWNHVSPDHRJF-UHFFFAOYSA-N	0	0	258.699	4.059	20	30		CIEDRN
CC(C)[C@@H](CC1CCCCC1)C(=O)N(C)CC(C)(C)C#N	ZINC000497348594	262145599	/nfs/dbraw/zinc/14/55/99/262145599.db2.gz	ZJYWRWCVYDFHOV-MRXNPFEDSA-N	0	0	292.467	4.237	20	30		CIEDRN
CC(C)[C@H](CC1CCCCC1)C(=O)N(C)CC(C)(C)C#N	ZINC000497348593	262145661	/nfs/dbraw/zinc/14/56/61/262145661.db2.gz	ZJYWRWCVYDFHOV-INIZCTEOSA-N	0	0	292.467	4.237	20	30		CIEDRN
Cc1nc(S[C@H](C)CCC#N)[nH]c1Cc1ccccc1	ZINC000188200104	262151128	/nfs/dbraw/zinc/15/11/28/262151128.db2.gz	LFCBEVDJOMOATR-GFCCVEGCSA-N	0	0	285.416	4.093	20	30		CIEDRN
C[C@H](CCC#N)Sc1nnc(-c2ccc(Cl)cc2)o1	ZINC000188225647	262152438	/nfs/dbraw/zinc/15/24/38/262152438.db2.gz	HTWIWSPQYKFSLO-SECBINFHSA-N	0	0	293.779	4.174	20	30		CIEDRN
C[C@@H](CCC#N)Sc1nc2cc(Cl)ccc2n1C	ZINC000188299036	262152829	/nfs/dbraw/zinc/15/28/29/262152829.db2.gz	FWFWFWZIVNWQPX-VIFPVBQESA-N	0	0	279.796	4.011	20	30		CIEDRN
C/C=C(/CC)C(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1	ZINC000189112012	262167746	/nfs/dbraw/zinc/16/77/46/262167746.db2.gz	DKYGZGIXYHPJLX-YMSVAJCUSA-N	0	0	297.185	4.031	20	30		CIEDRN
C=C(C)CN(CC)C(=O)CC(C)(C)c1ccc(C)cc1	ZINC000497490089	262169744	/nfs/dbraw/zinc/16/97/44/262169744.db2.gz	JERXRSQXVGVCRR-UHFFFAOYSA-N	0	0	273.420	4.087	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cccc(O[C@@H](C)CC)c1	ZINC000497657977	262185958	/nfs/dbraw/zinc/18/59/58/262185958.db2.gz	UKUCCRNVHUZAGS-ZDUSSCGKSA-N	0	0	275.392	4.405	20	30		CIEDRN
CCCCCCCCC[S@@](=O)[C@H](C)c1cnccn1	ZINC000190851937	262186537	/nfs/dbraw/zinc/18/65/37/262186537.db2.gz	LFANVXQHGLYKMJ-AUUYWEPGSA-N	0	0	282.453	4.037	20	30		CIEDRN
Cc1ccc(-c2cc(CSCCCC#N)on2)cc1	ZINC000190901444	262187050	/nfs/dbraw/zinc/18/70/50/262187050.db2.gz	JOPLBXZIGXDXJA-UHFFFAOYSA-N	0	0	272.373	4.187	20	30		CIEDRN
Cc1ccccc1-c1noc([C@@H](C)SCCCC#N)n1	ZINC000190977447	262187666	/nfs/dbraw/zinc/18/76/66/262187666.db2.gz	QIKYMRKVVFHBGS-GFCCVEGCSA-N	0	0	287.388	4.143	20	30		CIEDRN
CC[C@@H](C)CC(=O)Nc1ccccc1S[C@H](C)CC#N	ZINC000191527806	262192965	/nfs/dbraw/zinc/19/29/65/262192965.db2.gz	JRSBEXPKKKFVDH-CHWSQXEVSA-N	0	0	290.432	4.456	20	30		CIEDRN
CCc1ccc(-c2noc(-c3ccc(C#N)cc3C)n2)cc1	ZINC000319402414	262214540	/nfs/dbraw/zinc/21/45/40/262214540.db2.gz	FNHQNQMWMAZTIG-UHFFFAOYSA-N	0	0	289.338	4.146	20	30		CIEDRN
CCCCC1CCC(C(=O)N[C@@](C)(C#N)C(C)C)CC1	ZINC000497831696	262216052	/nfs/dbraw/zinc/21/60/52/262216052.db2.gz	OCGBQCTUBCMQAE-DQPZFDDXSA-N	0	0	278.440	4.037	20	30		CIEDRN
CCCC(=O)Nc1cccc(N[C@H]2CCC[C@H](C#N)C2)c1C	ZINC000193087232	262216060	/nfs/dbraw/zinc/21/60/60/262216060.db2.gz	VZYHMHIYXHRCGG-GJZGRUSLSA-N	0	0	299.418	4.228	20	30		CIEDRN
Cc1ncc(-c2ccc(N[C@@H]3CCC[C@@H](C#N)C3)cc2)o1	ZINC000193139668	262217465	/nfs/dbraw/zinc/21/74/65/262217465.db2.gz	SNJVIYBUNJLZRR-CZUORRHYSA-N	0	0	281.359	4.144	20	30		CIEDRN
CC(C)n1ncc2ccc(N[C@@H]3CCC[C@H](C#N)C3)cc21	ZINC000193207006	262218146	/nfs/dbraw/zinc/21/81/46/262218146.db2.gz	MACABQRACSGRDW-DZGCQCFKSA-N	0	0	282.391	4.111	20	30		CIEDRN
Cc1ccc(N[C@H]2CCC[C@H](C#N)C2)cc1-c1ncco1	ZINC000193268182	262219068	/nfs/dbraw/zinc/21/90/68/262219068.db2.gz	ZOPOECXOTPZFCK-KBPBESRZSA-N	0	0	281.359	4.144	20	30		CIEDRN
Cc1c(N[C@H](C)c2cccc(C#N)c2)cnn1C1CCCC1	ZINC000194631984	262240384	/nfs/dbraw/zinc/24/03/84/262240384.db2.gz	SODLEHXEJOIJLN-CYBMUJFWSA-N	0	0	294.402	4.351	20	30		CIEDRN
CC(C)(C)CN(CCC#N)Cc1ccccc1OC(F)F	ZINC000111250935	262258367	/nfs/dbraw/zinc/25/83/67/262258367.db2.gz	BSXLWWMDCSJVHT-UHFFFAOYSA-N	0	0	296.361	4.050	20	30		CIEDRN
C[C@H](CCC#N)Sc1ccc(Br)cc1	ZINC000188210626	262284757	/nfs/dbraw/zinc/28/47/57/262284757.db2.gz	UNLPYEILDJNWTH-SECBINFHSA-N	0	0	270.195	4.233	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1cccc(F)c1C)c1ccccc1	ZINC000188377361	262293089	/nfs/dbraw/zinc/29/30/89/262293089.db2.gz	HOFVHPDOHCTTEF-OAHLLOKOSA-N	0	0	283.346	4.433	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](C)c1ccc(Cl)cc1	ZINC000184909287	262300401	/nfs/dbraw/zinc/30/04/01/262300401.db2.gz	ZDCNLLPAADUEQF-NWDGAFQWSA-N	0	0	265.784	4.120	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](C)c1ccc(F)cc1Cl	ZINC000185614352	262306457	/nfs/dbraw/zinc/30/64/57/262306457.db2.gz	KIKYRQCSSLAMRC-MNOVXSKESA-N	0	0	283.774	4.259	20	30		CIEDRN
CCCC[C@@H](CCC)NC(=O)[C@H](C)c1cccc(C#N)c1	ZINC000462201864	262318462	/nfs/dbraw/zinc/31/84/62/262318462.db2.gz	FDSFUBWYMXXADF-RHSMWYFYSA-N	0	0	286.419	4.137	20	30		CIEDRN
CCO[C@@H](C)c1nc(CSCCCCC#N)cs1	ZINC000161829385	262320428	/nfs/dbraw/zinc/32/04/28/262320428.db2.gz	OGCWJRWYZJGYIL-NSHDSACASA-N	0	0	284.450	4.168	20	30		CIEDRN
N#CC1(C(=O)N2CCCC3(CCCCC3)CC2)CCCC1	ZINC000188584672	262321220	/nfs/dbraw/zinc/32/12/20/262321220.db2.gz	VBLRFVHTYUHFPQ-UHFFFAOYSA-N	0	0	288.435	4.033	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC(CC)(CC)CC1	ZINC000188618996	262327330	/nfs/dbraw/zinc/32/73/30/262327330.db2.gz	FABNTPOYNRLUDM-AWEZNQCLSA-N	0	0	251.414	4.018	20	30		CIEDRN
C=CCCCSCC(=O)Nc1ccc(F)cc1Cl	ZINC000522757289	262338617	/nfs/dbraw/zinc/33/86/17/262338617.db2.gz	YHXGHQMVEVYBEP-UHFFFAOYSA-N	0	0	287.787	4.117	20	30		CIEDRN
CN(CCCC#N)[C@@H](c1ccc(Cl)cc1)c1ccccn1	ZINC000369117411	262338833	/nfs/dbraw/zinc/33/88/33/262338833.db2.gz	AAZAZMOVTCQRCX-KRWDZBQOSA-N	0	0	299.805	4.060	20	30		CIEDRN
CN(CCCC#N)[C@H](c1ccc(Cl)cc1)c1ccccn1	ZINC000369117412	262339094	/nfs/dbraw/zinc/33/90/94/262339094.db2.gz	AAZAZMOVTCQRCX-QGZVFWFLSA-N	0	0	299.805	4.060	20	30		CIEDRN
N#C[C@H]1CC[C@@H](Nc2cc(Cl)cc(Cl)c2)C1	ZINC000390776558	262345196	/nfs/dbraw/zinc/34/51/96/262345196.db2.gz	FYCGPQGZWSJZDT-GZMMTYOYSA-N	0	0	255.148	4.098	20	30		CIEDRN
N#Cc1ccc(N[C@@H]2CCOC3(CCCC3)C2)cc1Cl	ZINC000094367256	262349312	/nfs/dbraw/zinc/34/93/12/262349312.db2.gz	CQHZEDIHHXYDMS-CQSZACIVSA-N	0	0	290.794	4.115	20	30		CIEDRN
N#Cc1c(F)cccc1Oc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000057797382	262349913	/nfs/dbraw/zinc/34/99/13/262349913.db2.gz	NCRGTLRUQHZTAI-UHFFFAOYSA-N	0	0	292.653	4.051	20	30		CIEDRN
N#Cc1cccnc1NC(c1ccccc1)c1ccccc1	ZINC000022798395	262351020	/nfs/dbraw/zinc/35/10/20/262351020.db2.gz	UPVVYDDPZJYDLX-UHFFFAOYSA-N	0	0	285.350	4.155	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2c(C)cc(C)cc2C)CC1	ZINC000111700710	262365225	/nfs/dbraw/zinc/36/52/25/262365225.db2.gz	ZPUFYZYTGKSXEF-UHFFFAOYSA-N	0	0	272.392	4.042	20	30		CIEDRN
Cc1cccc([C@@H]2CCCCCN2C(=O)CC(C)(C)C#N)c1	ZINC000365491543	262367481	/nfs/dbraw/zinc/36/74/81/262367481.db2.gz	OHZAEMBJKABBSO-KRWDZBQOSA-N	0	0	298.430	4.379	20	30		CIEDRN
C=CCC1(C(=O)N2CCC(CCC#N)CC2)CCCCC1	ZINC000521439064	262372926	/nfs/dbraw/zinc/37/29/26/262372926.db2.gz	BUANWMYDQVCCST-UHFFFAOYSA-N	0	0	288.435	4.055	20	30		CIEDRN
N#Cc1ccc(NCCCC(F)(F)F)c(C(F)(F)F)c1	ZINC000463656212	262382592	/nfs/dbraw/zinc/38/25/92/262382592.db2.gz	CMENLRZCDRWXIO-UHFFFAOYSA-N	0	0	296.214	4.331	20	30		CIEDRN
Cc1ccc2cc(CN(CCC#N)CC(C)(C)C)ccc2n1	ZINC000187182428	262392051	/nfs/dbraw/zinc/39/20/51/262392051.db2.gz	JEZWISRSESDQFY-UHFFFAOYSA-N	0	0	295.430	4.305	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1	ZINC000488812946	262396130	/nfs/dbraw/zinc/39/61/30/262396130.db2.gz	FVVVTBKDPAVGBB-YLFCFFPRSA-N	0	0	275.436	4.160	20	30		CIEDRN
N#Cc1ccc(N[C@H]2CCCc3sccc32)c([N+](=O)[O-])c1	ZINC000061364236	262396250	/nfs/dbraw/zinc/39/62/50/262396250.db2.gz	WXIDRLDFEBABFO-LBPRGKRZSA-N	0	0	299.355	4.017	20	30		CIEDRN
C=CCC1(C(=O)Nc2c(C)onc2CC)CCCCC1	ZINC000410619868	262637874	/nfs/dbraw/zinc/63/78/74/262637874.db2.gz	PZYFKCMGKHSFOJ-UHFFFAOYSA-N	0	0	276.380	4.011	20	30		CIEDRN
CCC[C@H](C#N)N(C)C(=O)C[C@@H]1C[C@H](C)c2c1cccc2C	ZINC000410832836	262668947	/nfs/dbraw/zinc/66/89/47/262668947.db2.gz	FBKUCYMUUAODQL-HRCADAONSA-N	0	0	298.430	4.127	20	30		CIEDRN
CC[C@@H](CC(=O)Nc1ccc(Cl)cc1CC#N)C(C)C	ZINC000410974344	262674361	/nfs/dbraw/zinc/67/43/61/262674361.db2.gz	XUPJAUBKRVSTBU-LBPRGKRZSA-N	0	0	292.810	4.417	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(CC#N)cc2Cl)CC1	ZINC000411016502	262675011	/nfs/dbraw/zinc/67/50/11/262675011.db2.gz	ONTMMNRVEMIWOB-UHFFFAOYSA-N	0	0	288.778	4.091	20	30		CIEDRN
Cc1cc(C(=O)Nc2sc(C(C)(C)C)cc2C#N)co1	ZINC000411009772	262675438	/nfs/dbraw/zinc/67/54/38/262675438.db2.gz	ZAPJTYNBKRYLAS-UHFFFAOYSA-N	0	0	288.372	4.071	20	30		CIEDRN
C=CCCC(=O)Nc1sc2c(c1C#N)[C@H](C)C[C@@H](C)C2	ZINC000411023029	262675569	/nfs/dbraw/zinc/67/55/69/262675569.db2.gz	YGRVMSVYXNFYBE-GHMZBOCLSA-N	0	0	288.416	4.210	20	30		CIEDRN
C[C@@H](SCCC#N)c1ncc(-c2ccccc2)o1	ZINC000413015631	262752823	/nfs/dbraw/zinc/75/28/23/262752823.db2.gz	UIDBZBSNSOGVHQ-LLVKDONJSA-N	0	0	258.346	4.049	20	30		CIEDRN
CC(C)Oc1cccc([C@@H](C)Nc2ncc(C#N)cc2F)c1	ZINC000413061458	262754145	/nfs/dbraw/zinc/75/41/45/262754145.db2.gz	PPIQUASLCLVHOD-GFCCVEGCSA-N	0	0	299.349	4.053	20	30		CIEDRN
N#CC1(CC[S@@](=O)c2cccc(Cl)c2)CCCCC1	ZINC000414227653	262828391	/nfs/dbraw/zinc/82/83/91/262828391.db2.gz	CWCDFLZFWJDQMX-LJQANCHMSA-N	0	0	295.835	4.312	20	30		CIEDRN
CSc1cc(N[C@H]2CC[C@@H](C#N)C2)ccc1Cl	ZINC000414230840	262829840	/nfs/dbraw/zinc/82/98/40/262829840.db2.gz	GTAJXVBNDOGKBA-ZJUUUORDSA-N	0	0	266.797	4.166	20	30		CIEDRN
CC(C)(C#N)CCC[S@@](=O)CC1(C)CCCCC1	ZINC000414283813	262835653	/nfs/dbraw/zinc/83/56/53/262835653.db2.gz	PTYDIEDNGPOODG-GOSISDBHSA-N	0	0	269.454	4.035	20	30		CIEDRN
CC[C@H](C)[C@H]1CCCCN1C(=O)Nc1ccc(CC#N)cc1	ZINC000265695761	262911277	/nfs/dbraw/zinc/91/12/77/262911277.db2.gz	IPDVOTPHPQQVFB-WMLDXEAASA-N	0	0	299.418	4.185	20	30		CIEDRN
COc1cccc(C=C2CC[NH+](CCC(C)(C)C#N)CC2)c1	ZINC000272003555	263001014	/nfs/dbraw/zinc/00/10/14/263001014.db2.gz	IIELUHOUCXPHIM-UHFFFAOYSA-N	0	0	298.430	4.114	20	30		CIEDRN
C[C@H](c1cccc(Cl)c1)[NH+]1CCC(C)(C#N)CC1	ZINC000272514001	263005696	/nfs/dbraw/zinc/00/56/96/263005696.db2.gz	GOXPUIWNRPWBRT-GFCCVEGCSA-N	0	0	262.784	4.027	20	30		CIEDRN
CC(C)(C)c1ccc(NC(=O)N2CCC(C)(C#N)CC2)cc1	ZINC000272607972	263007595	/nfs/dbraw/zinc/00/75/95/263007595.db2.gz	YREDVJKIRKDYKJ-UHFFFAOYSA-N	0	0	299.418	4.142	20	30		CIEDRN
N#C[C@H]1CCC[C@@H](Nc2ccc(N3CCCCC3)cc2)C1	ZINC000274220699	263022001	/nfs/dbraw/zinc/02/20/01/263022001.db2.gz	PQSRWTBYLBJLAW-DOTOQJQBSA-N	0	0	283.419	4.171	20	30		CIEDRN
CC(C)C(C)(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000275930235	263034328	/nfs/dbraw/zinc/03/43/28/263034328.db2.gz	RIMLPHPWINIRKW-UHFFFAOYSA-N	0	0	272.392	4.108	20	30		CIEDRN
C[C@@H](SCCC(C)(C)C#N)c1cccc(C#N)c1	ZINC000276612721	263037491	/nfs/dbraw/zinc/03/74/91/263037491.db2.gz	MCQFNYMMEOMIKX-GFCCVEGCSA-N	0	0	258.390	4.292	20	30		CIEDRN
Cc1nc(-c2ccc(OCCCCC(C)(C)C#N)cc2)no1	ZINC000277670514	263042789	/nfs/dbraw/zinc/04/27/89/263042789.db2.gz	KPMPZKTXSRNPLL-UHFFFAOYSA-N	0	0	299.374	4.144	20	30		CIEDRN
CC(C)(C#N)CC(=O)Nc1ccccc1Cc1ccccc1	ZINC000278154323	263045594	/nfs/dbraw/zinc/04/55/94/263045594.db2.gz	BMPVXAYGWNRGNF-UHFFFAOYSA-N	0	0	292.382	4.156	20	30		CIEDRN
CSc1ccc(C)c(N[C@H]2CCC[C@H](C#N)C2)c1	ZINC000278369490	263047602	/nfs/dbraw/zinc/04/76/02/263047602.db2.gz	CDMTVTWLHKSRJB-STQMWFEESA-N	0	0	260.406	4.211	20	30		CIEDRN
N#C[C@H]1CC[C@H](Sc2nc3cc(Cl)ccc3[nH]2)C1	ZINC000278665145	263049676	/nfs/dbraw/zinc/04/96/76/263049676.db2.gz	XJIWLDQSNYDQNB-WPRPVWTQSA-N	0	0	277.780	4.001	20	30		CIEDRN
N#C[C@@H]1CC[C@H](Sc2nc3cc(Cl)ccc3[nH]2)C1	ZINC000278665134	263049688	/nfs/dbraw/zinc/04/96/88/263049688.db2.gz	XJIWLDQSNYDQNB-SCZZXKLOSA-N	0	0	277.780	4.001	20	30		CIEDRN
CC(C)(C#N)CC(=O)N(c1ccc(F)cc1)C1CCCC1	ZINC000279020131	263052418	/nfs/dbraw/zinc/05/24/18/263052418.db2.gz	ONUUGEHVDCIUOD-UHFFFAOYSA-N	0	0	288.366	4.041	20	30		CIEDRN
CC1(C#N)CCN(C(=O)Nc2ccc(C3CCC3)cc2)CC1	ZINC000279009466	263052514	/nfs/dbraw/zinc/05/25/14/263052514.db2.gz	UTHWPXKBGBBNQK-UHFFFAOYSA-N	0	0	297.402	4.112	20	30		CIEDRN
C=CCOc1cccc(CNc2ccc3c(c2)CCCN3)c1	ZINC000414844022	263058622	/nfs/dbraw/zinc/05/86/22/263058622.db2.gz	DDHMUWGRGCFNCE-UHFFFAOYSA-N	0	0	294.398	4.222	20	30		CIEDRN
CCC[C@H](CC)SCC(=O)Nc1ccc(CC#N)cc1	ZINC000280061142	263058791	/nfs/dbraw/zinc/05/87/91/263058791.db2.gz	ZDNVGUAFVAMWOP-HNNXBMFYSA-N	0	0	290.432	4.003	20	30		CIEDRN
C[C@@H](CSCCCSCC#N)c1ccccc1	ZINC000280068534	263058822	/nfs/dbraw/zinc/05/88/22/263058822.db2.gz	ZXFKZVWLXBVZLK-ZDUSSCGKSA-N	0	0	265.447	4.170	20	30		CIEDRN
CCC[C@@H](NC(=O)c1ccc(CC#N)cc1)c1ccccc1	ZINC000340048893	263059739	/nfs/dbraw/zinc/05/97/39/263059739.db2.gz	WPINUSISFIEZRT-GOSISDBHSA-N	0	0	292.382	4.024	20	30		CIEDRN
CC(C)(C)[C@@H]1CCCN(C(=O)Nc2ccc(CC#N)cc2)C1	ZINC000280626903	263063365	/nfs/dbraw/zinc/06/33/65/263063365.db2.gz	UELOEIHYRXZGGV-OAHLLOKOSA-N	0	0	299.418	4.043	20	30		CIEDRN
Cc1ccc(C)c(NC(=O)c2ccc(C(C)(C)C#N)cc2)c1	ZINC000280630052	263063396	/nfs/dbraw/zinc/06/33/96/263063396.db2.gz	QZZOZEOGNSHMJW-UHFFFAOYSA-N	0	0	292.382	4.357	20	30		CIEDRN
Cc1cccc(NCCCC2(C#N)CCOCC2)c1Cl	ZINC000280996285	263065562	/nfs/dbraw/zinc/06/55/62/263065562.db2.gz	JMCWSGKSWHJDLB-UHFFFAOYSA-N	0	0	292.810	4.161	20	30		CIEDRN
CC(C)c1ccc(NC(=O)N2CC(C)(C#N)C2)c(C(C)C)c1	ZINC000281060932	263066340	/nfs/dbraw/zinc/06/63/40/263066340.db2.gz	YTELLKFEFUHZBH-UHFFFAOYSA-N	0	0	299.418	4.311	20	30		CIEDRN
Cc1cc(Cl)ccc1NCCCC1(C#N)CCOCC1	ZINC000281249845	263067583	/nfs/dbraw/zinc/06/75/83/263067583.db2.gz	QDKYEQKLHJDMHG-UHFFFAOYSA-N	0	0	292.810	4.161	20	30		CIEDRN
Cc1ccc(OCCCC2(C#N)CCOCC2)c(Cl)c1	ZINC000281384139	263068580	/nfs/dbraw/zinc/06/85/80/263068580.db2.gz	PILFTBOKGTVPBJ-UHFFFAOYSA-N	0	0	293.794	4.128	20	30		CIEDRN
CCCC[C@@H](C)C(=O)Nc1ccccc1SCCC#N	ZINC000281760483	263071704	/nfs/dbraw/zinc/07/17/04/263071704.db2.gz	CIVAXGSVYQXLCF-CYBMUJFWSA-N	0	0	290.432	4.457	20	30		CIEDRN
CO[C@H](CSCCCCC#N)c1ccc(Cl)cc1	ZINC000282757693	263078492	/nfs/dbraw/zinc/07/84/92/263078492.db2.gz	ZGHIUOZAJWVPSQ-CQSZACIVSA-N	0	0	283.824	4.455	20	30		CIEDRN
CO[C@H](CSCCCC(C)(C)C#N)c1ccccc1	ZINC000283370279	263082651	/nfs/dbraw/zinc/08/26/51/263082651.db2.gz	LZZMLDHTXGYHBR-OAHLLOKOSA-N	0	0	277.433	4.437	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)Nc1ccc(OC(C)C)c(Cl)c1	ZINC000284986682	263088940	/nfs/dbraw/zinc/08/89/40/263088940.db2.gz	CCZVQMOLKSINPE-HNNXBMFYSA-N	0	0	294.782	4.006	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)N[C@H](C)c1cccc(Cl)c1Cl	ZINC000285451875	263093017	/nfs/dbraw/zinc/09/30/17/263093017.db2.gz	JAKNUVPWMYNHFB-YMTOWFKASA-N	0	0	299.201	4.110	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)Nc1cc(-c2ccc(C)o2)ccc1C	ZINC000286042729	263096970	/nfs/dbraw/zinc/09/69/70/263096970.db2.gz	SYWILCBAWJPHCM-GOSISDBHSA-N	0	0	296.370	4.442	20	30		CIEDRN
Cc1ccnc([C@@H](C)N[C@H](CCC#N)c2ccccc2)c1	ZINC000286172476	263097532	/nfs/dbraw/zinc/09/75/32/263097532.db2.gz	PXGKCPUBJWCELE-NVXWUHKLSA-N	0	0	279.387	4.086	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)O[C@H](C)c1cccc(Cl)c1F	ZINC000286715793	263099323	/nfs/dbraw/zinc/09/93/23/263099323.db2.gz	IQVSRQSESUCHSD-YMTOWFKASA-N	0	0	283.730	4.023	20	30		CIEDRN
C=CCCOCCCCC(=O)N1CCC[C@]1(C)CC(C)C	ZINC000452510518	263104307	/nfs/dbraw/zinc/10/43/07/263104307.db2.gz	NDPRHDMJBAMSSI-GOSISDBHSA-N	0	0	295.467	4.177	20	30		CIEDRN
CN(CCC#N)c1cc(C(F)F)nc2ccc(Cl)cc21	ZINC000288527641	263104677	/nfs/dbraw/zinc/10/46/77/263104677.db2.gz	IIZYCXSFBXVKBS-UHFFFAOYSA-N	0	0	295.720	4.176	20	30		CIEDRN
CC(C)(C#N)CCNc1ccc(OC2CCC2)c(F)c1	ZINC000288720788	263105656	/nfs/dbraw/zinc/10/56/56/263105656.db2.gz	MBADEQGGMDHWNK-UHFFFAOYSA-N	0	0	276.355	4.109	20	30		CIEDRN
CC[C@](C)(C#N)c1nc(-c2ccc(C(C)(F)F)cc2)no1	ZINC000289605555	263111096	/nfs/dbraw/zinc/11/10/96/263111096.db2.gz	AGJPEOROBQOCCC-CQSZACIVSA-N	0	0	291.301	4.040	20	30		CIEDRN
CC1(C#N)CCN(C(=O)c2ccc(C3CCCC3)cc2)CC1	ZINC000290303625	263115954	/nfs/dbraw/zinc/11/59/54/263115954.db2.gz	CDLOBBBUBQABBU-UHFFFAOYSA-N	0	0	296.414	4.110	20	30		CIEDRN
C[C@@H](SCCC#N)c1cccc(Br)c1	ZINC000291623739	263124302	/nfs/dbraw/zinc/12/43/02/263124302.db2.gz	KUGZSEXPMMGMMK-SECBINFHSA-N	0	0	270.195	4.157	20	30		CIEDRN
N#CCCCC(=O)Nc1ccccc1NCC1CCCCC1	ZINC000291781791	263125289	/nfs/dbraw/zinc/12/52/89/263125289.db2.gz	XKYGVFNURDVZGC-UHFFFAOYSA-N	0	0	299.418	4.311	20	30		CIEDRN
N#CCCCC(=O)N(c1ccsc1)C1CCCCC1	ZINC000292429491	263132072	/nfs/dbraw/zinc/13/20/72/263132072.db2.gz	ULJXXBUHQLRICE-UHFFFAOYSA-N	0	0	276.405	4.108	20	30		CIEDRN
N#C[C@H]1CC[C@@H](N2CCc3c(Cl)cc(Cl)cc3C2)C1	ZINC000292762996	263134934	/nfs/dbraw/zinc/13/49/34/263134934.db2.gz	IZTXUYVCKDVAAD-GXFFZTMASA-N	0	0	295.213	4.044	20	30		CIEDRN
C=C(C)CCNC(=O)CCCCCO[C@H]1CCC[C@H](C)C1	ZINC000452718768	263136025	/nfs/dbraw/zinc/13/60/25/263136025.db2.gz	QWHIZSHIEBEOEA-IRXDYDNUSA-N	0	0	295.467	4.225	20	30		CIEDRN
C=C(C)CCNC(=O)[C@H]1C[C@H]1c1ccc(Cl)cc1Cl	ZINC000452725306	263137792	/nfs/dbraw/zinc/13/77/92/263137792.db2.gz	SIFVHYHBAGLKKS-STQMWFEESA-N	0	0	298.213	4.179	20	30		CIEDRN
CC(C)(C)c1ccnc(N[C@H](CCC#N)c2ccccc2)n1	ZINC000293181228	263138488	/nfs/dbraw/zinc/13/84/88/263138488.db2.gz	VVYWPGGTFBJUDW-OAHLLOKOSA-N	0	0	294.402	4.231	20	30		CIEDRN
CC(C)=CCC[C@H](C)NC(=O)c1ccc(C2(C#N)CC2)cc1	ZINC000295646609	263180667	/nfs/dbraw/zinc/18/06/67/263180667.db2.gz	PHBNHNDUSSEDHM-HNNXBMFYSA-N	0	0	296.414	4.106	20	30		CIEDRN
Cc1coc2ccc(NC(=O)[C@]3(C#N)CC34CCCC4)cc12	ZINC000296098719	263185642	/nfs/dbraw/zinc/18/56/42/263185642.db2.gz	XBXMPAGDTHUYHE-GOSISDBHSA-N	0	0	294.354	4.154	20	30		CIEDRN
CC[C@](C)(C#N)c1nc(Cc2cc3ccccc3s2)no1	ZINC000296421102	263191506	/nfs/dbraw/zinc/19/15/06/263191506.db2.gz	LLXQZSDGPLWQBS-MRXNPFEDSA-N	0	0	297.383	4.066	20	30		CIEDRN
CC(C)=CCC[C@@H](C)NC(=O)Nc1ccc(CC#N)cc1	ZINC000296513895	263192340	/nfs/dbraw/zinc/19/23/40/263192340.db2.gz	ZMSMQYGXPJCTSV-CQSZACIVSA-N	0	0	285.391	4.009	20	30		CIEDRN
CCc1c2ccccc2oc1C(=O)N[C@@](C)(C#N)C(C)(C)C	ZINC000297683512	263208053	/nfs/dbraw/zinc/20/80/53/263208053.db2.gz	GSBKNDGKUNPQLW-SFHVURJKSA-N	0	0	298.386	4.053	20	30		CIEDRN
C=CCC(F)(F)c1nc([C@@H]2CCC[C@@H](C)C2)no1	ZINC000340594743	263215723	/nfs/dbraw/zinc/21/57/23/263215723.db2.gz	CLEORRAYGROSLK-NXEZZACHSA-N	0	0	256.296	4.031	20	30		CIEDRN
C=CCC(F)(F)c1nc(C2CCC(C)CC2)no1	ZINC000340594723	263215751	/nfs/dbraw/zinc/21/57/51/263215751.db2.gz	BXXDBWVWPNQYGC-UHFFFAOYSA-N	0	0	256.296	4.031	20	30		CIEDRN
Cc1[nH]c(S[C@@H](C)CCC#N)nc1-c1ccccc1	ZINC000298290570	263217459	/nfs/dbraw/zinc/21/74/59/263217459.db2.gz	QDAMTRDZIKWXFJ-NSHDSACASA-N	0	0	271.389	4.170	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)C2(C)CCCC2)cc1	ZINC000298468318	263219767	/nfs/dbraw/zinc/21/97/67/263219767.db2.gz	YBKJKTPVZZMCNC-UHFFFAOYSA-N	0	0	270.376	4.007	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1ccn(C)c1C1CCC1	ZINC000340623610	263238919	/nfs/dbraw/zinc/23/89/19/263238919.db2.gz	ZYGWMTKBKCYIOL-UHFFFAOYSA-N	0	0	288.435	4.111	20	30		CIEDRN
C#CCCCCC(=O)N1CCCCC[C@@H]1c1ccccc1	ZINC000119643872	263275457	/nfs/dbraw/zinc/27/54/57/263275457.db2.gz	BAVFZUMNTUESSC-GOSISDBHSA-N	0	0	283.415	4.324	20	30		CIEDRN
C[C@@H]1CC[C@H](CC(=O)Nc2ccc(C(C)(C)C#N)cc2)C1	ZINC000119856080	263280075	/nfs/dbraw/zinc/28/00/75/263280075.db2.gz	RXUGVATYLYFIDH-KGLIPLIRSA-N	0	0	284.403	4.253	20	30		CIEDRN
C[C@H]1CC[C@H](CC(=O)Nc2ccc(C(C)(C)C#N)cc2)C1	ZINC000119856242	263280535	/nfs/dbraw/zinc/28/05/35/263280535.db2.gz	RXUGVATYLYFIDH-KBPBESRZSA-N	0	0	284.403	4.253	20	30		CIEDRN
C#CCCCCC(=O)N1CC[C@@H](C)C[C@@H]1c1ccc(C)o1	ZINC000120228903	263284013	/nfs/dbraw/zinc/28/40/13/263284013.db2.gz	CRYHESRSOMDTOI-GDBMZVCRSA-N	0	0	287.403	4.081	20	30		CIEDRN
N#CCC[C@H](Nc1ccnc(Cl)c1)c1ccccc1	ZINC000164343709	263285699	/nfs/dbraw/zinc/28/56/99/263285699.db2.gz	QCTQEMZBEXGQOY-AWEZNQCLSA-N	0	0	271.751	4.192	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)Cc1ccc(Cl)s1	ZINC000121331789	263291167	/nfs/dbraw/zinc/29/11/67/263291167.db2.gz	RSJYRPTXIBNWBA-UHFFFAOYSA-N	0	0	283.824	4.128	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cc3cc(F)ccc3[nH]2)n1	ZINC000340767235	263304901	/nfs/dbraw/zinc/30/49/01/263304901.db2.gz	DJWPLVHHUASVGM-UHFFFAOYSA-N	0	0	285.322	4.211	20	30		CIEDRN
N#CCSCCCSCc1ccccc1C1CC1	ZINC000341567446	263341819	/nfs/dbraw/zinc/34/18/19/263341819.db2.gz	ZBUUTCIFXUISRQ-UHFFFAOYSA-N	0	0	277.458	4.444	20	30		CIEDRN
C=CCCN(C)C(=O)c1cc(C)n(C2CCCCC2)c1C	ZINC000342016869	263378860	/nfs/dbraw/zinc/37/88/60/263378860.db2.gz	XWJNNXIPCVURQX-UHFFFAOYSA-N	0	0	288.435	4.258	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@H](CC)c1cccc(Cl)c1	ZINC000342098800	263386695	/nfs/dbraw/zinc/38/66/95/263386695.db2.gz	GQBNSNWDECBQBM-BXUZGUMPSA-N	0	0	280.799	4.055	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@@H](CC)c1cccc(Cl)c1	ZINC000342098811	263387014	/nfs/dbraw/zinc/38/70/14/263387014.db2.gz	GQBNSNWDECBQBM-RISCZKNCSA-N	0	0	280.799	4.055	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)c1cccnc1C1CC1	ZINC000342504513	263444072	/nfs/dbraw/zinc/44/40/72/263444072.db2.gz	VWCOELOAMXHLKO-UHFFFAOYSA-N	0	0	298.430	4.168	20	30		CIEDRN
N#Cc1ccc(SCc2nc(C3CC3)cs2)cc1	ZINC000342518302	263445522	/nfs/dbraw/zinc/44/55/22/263445522.db2.gz	NNLIPQCANSWDIE-UHFFFAOYSA-N	0	0	272.398	4.184	20	30		CIEDRN
Cc1ccc(C(=O)Nc2ccccc2CC#N)c(Cl)c1C	ZINC000334428196	263625539	/nfs/dbraw/zinc/62/55/39/263625539.db2.gz	SCODGOLLEPIXDN-UHFFFAOYSA-N	0	0	298.773	4.275	20	30		CIEDRN
CCC[C@@H](C(=O)Nc1ccc(Cl)cc1CC#N)C(C)C	ZINC000415736131	263646261	/nfs/dbraw/zinc/64/62/61/263646261.db2.gz	NKOPJGYHUDXVPP-CQSZACIVSA-N	0	0	292.810	4.417	20	30		CIEDRN
C[C@@H](Nc1snc(Cl)c1C#N)c1cccc(Cl)c1	ZINC000048545206	263818341	/nfs/dbraw/zinc/81/83/41/263818341.db2.gz	IEACJSZZNYMUIJ-SSDOTTSWSA-N	0	0	298.198	4.495	20	30		CIEDRN
CC(C)(C)[C@@H]1CCCC[C@@H]1NC(=O)c1ncoc1C1CC1	ZINC000328789744	263872019	/nfs/dbraw/zinc/87/20/19/263872019.db2.gz	YJTNLQSAIMKHKN-OLZOCXBDSA-N	0	0	290.407	4.462	20	30		CIEDRN
CC[C@H](NC(=O)[C@H]1CC12CCCC2)c1c(C)noc1C	ZINC000328795796	263873073	/nfs/dbraw/zinc/87/30/73/263873073.db2.gz	CQGNVEGHPFRQBU-OLZOCXBDSA-N	0	0	276.380	4.279	20	30		CIEDRN
CCc1noc(C)c1C(=O)N[C@@H]1CC[C@@H]2CCCC[C@H]2C1	ZINC000328920023	263902662	/nfs/dbraw/zinc/90/26/62/263902662.db2.gz	AWMWIARDJAIEEU-MELADBBJSA-N	0	0	290.407	4.209	20	30		CIEDRN
CCc1cccnc1NC(=O)c1cnc(C(C)(C)C)s1	ZINC000330394995	263927025	/nfs/dbraw/zinc/92/70/25/263927025.db2.gz	JLHLVXWFFVLPME-UHFFFAOYSA-N	0	0	289.404	4.034	20	30		CIEDRN
CCc1nc(NC(=O)c2occc2C(C)C)sc1C	ZINC000330478394	263946653	/nfs/dbraw/zinc/94/66/53/263946653.db2.gz	XOGFWCNROFJRDM-UHFFFAOYSA-N	0	0	278.377	4.367	20	30		CIEDRN
Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCC1CCCC1	ZINC000330611156	263973693	/nfs/dbraw/zinc/97/36/93/263973693.db2.gz	ONEAKSCEYJXYDA-UHFFFAOYSA-N	0	0	290.363	4.015	20	30		CIEDRN
Cc1noc(C(C)C)c1C(=O)Nc1ncc(C(C)C)s1	ZINC000330893643	264077888	/nfs/dbraw/zinc/07/78/88/264077888.db2.gz	JPHNLSSVIAIQEG-UHFFFAOYSA-N	0	0	293.392	4.323	20	30		CIEDRN
CCC(C)(C)CC(=O)Nc1sc(C)c(C)c1C#N	ZINC000330937203	264082093	/nfs/dbraw/zinc/08/20/93/264082093.db2.gz	AIWXYJQRJRMEER-UHFFFAOYSA-N	0	0	264.394	4.001	20	30		CIEDRN
Cc1cccc(C(=O)NCc2ncc(C(C)(C)C)o2)c1C	ZINC000331022128	264098996	/nfs/dbraw/zinc/09/89/96/264098996.db2.gz	YZEWDUJBCKTBNZ-UHFFFAOYSA-N	0	0	286.375	4.094	20	30		CIEDRN
CCc1ocnc1C(=O)NCC(C)(C)C1=CCCCC1	ZINC000331063043	264111034	/nfs/dbraw/zinc/11/10/34/264111034.db2.gz	PCAPRUDZSXXGGG-UHFFFAOYSA-N	0	0	276.380	4.068	20	30		CIEDRN
C=CCC[C@@H](C(=O)Nc1ccccc1O)c1ccccc1	ZINC000188523137	264121563	/nfs/dbraw/zinc/12/15/63/264121563.db2.gz	NGFHWXQSHBBYDB-OAHLLOKOSA-N	0	0	281.355	4.081	20	30		CIEDRN
Cc1csc([C@H](C)NC(=O)c2ccoc2C(C)C)n1	ZINC000331090583	264133938	/nfs/dbraw/zinc/13/39/38/264133938.db2.gz	VFDXVBQIHKIDLS-JTQLQIEISA-N	0	0	278.377	4.234	20	30		CIEDRN
COc1cc(C)c(NC(=O)N[C@H]2CC[C@H](C)CC2)cc1F	ZINC000331158150	264141724	/nfs/dbraw/zinc/14/17/24/264141724.db2.gz	ZJHKNZYRDAZTLK-UMSPYCQHSA-N	0	0	294.370	4.047	20	30		CIEDRN
C[C@@H]1CC[C@@H](NC(=O)Nc2ccc(C(C)(C)C#N)cc2)C1	ZINC000331282324	264171902	/nfs/dbraw/zinc/17/19/02/264171902.db2.gz	LPLFMXMDJGXRBO-IUODEOHRSA-N	0	0	285.391	4.002	20	30		CIEDRN
Cc1ccc(CNC(=O)Nc2c(C)cc(C)nc2C)c(C)c1	ZINC000331239748	264176272	/nfs/dbraw/zinc/17/62/72/264176272.db2.gz	OTSPDAFDADKOIA-UHFFFAOYSA-N	0	0	297.402	4.150	20	30		CIEDRN
Cc1ccc(NC(=O)c2cnc(C(C)(C)C)s2)cc1O	ZINC000331245688	264178495	/nfs/dbraw/zinc/17/84/95/264178495.db2.gz	LXMUYPRFXPWJJU-UHFFFAOYSA-N	0	0	290.388	4.091	20	30		CIEDRN
CCc1nc(C)c(NC(=O)c2scnc2C(C)C)s1	ZINC000331336986	264193628	/nfs/dbraw/zinc/19/36/28/264193628.db2.gz	QROLHWAVJBOGTD-UHFFFAOYSA-N	0	0	295.433	4.230	20	30		CIEDRN
Cc1cc(C[N@@H+](C)[C@@H](C)c2cccc(C#N)c2)cc(C)c1O	ZINC000425367831	264213498	/nfs/dbraw/zinc/21/34/98/264213498.db2.gz	VCSAIWOEKVHANW-HNNXBMFYSA-N	0	0	294.398	4.074	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1ccc(F)cc1Cl	ZINC000425379416	264217079	/nfs/dbraw/zinc/21/70/79/264217079.db2.gz	ATVSIVUHUFEOLL-UHFFFAOYSA-N	0	0	255.720	4.020	20	30		CIEDRN
N#CC1(CN(Cc2cccs2)Cc2cccs2)CC1	ZINC000343255744	264222728	/nfs/dbraw/zinc/22/27/28/264222728.db2.gz	COIBUUJJFCFEQT-UHFFFAOYSA-N	0	0	288.441	4.116	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N1C[C@H](c2ccc(C)cc2)C[C@H]1C	ZINC000424857415	264233935	/nfs/dbraw/zinc/23/39/35/264233935.db2.gz	RHLVPVXFFPOTPY-NVXWUHKLSA-N	0	0	285.431	4.302	20	30		CIEDRN
C[C@H]1CCCC[C@H]1C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000424857301	264234088	/nfs/dbraw/zinc/23/40/88/264234088.db2.gz	WSNRWBPAQHCJAP-WCQYABFASA-N	0	0	290.794	4.171	20	30		CIEDRN
N#Cc1cnc(N[C@@H]2CCCc3sccc32)c(Cl)c1	ZINC000161065923	264265383	/nfs/dbraw/zinc/26/53/83/264265383.db2.gz	JVDPIELHHCWGMS-GFCCVEGCSA-N	0	0	289.791	4.158	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CCC[C@@H]1C1CCC1)c1ccccc1	ZINC000128694633	264299612	/nfs/dbraw/zinc/29/96/12/264299612.db2.gz	LJBKIIRJEYAYGH-MAUKXSAKSA-N	0	0	283.415	4.137	20	30		CIEDRN
N#Cc1ccc(CNc2ccsc2Cl)c(F)c1	ZINC000189521554	264304585	/nfs/dbraw/zinc/30/45/85/264304585.db2.gz	GNQGJDYICSUXFL-UHFFFAOYSA-N	0	0	266.728	4.024	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1c(C)cc(N(C)C)cc1C	ZINC000129187301	264319520	/nfs/dbraw/zinc/31/95/20/264319520.db2.gz	QXNPECVPSLRZNO-UHFFFAOYSA-N	0	0	286.419	4.076	20	30		CIEDRN
CC(=O)Nc1ccc(S[C@@H](C)c2cccc(C#N)c2)cc1	ZINC000189795829	264326523	/nfs/dbraw/zinc/32/65/23/264326523.db2.gz	FAMDDPOSOYTQSJ-LBPRGKRZSA-N	0	0	296.395	4.370	20	30		CIEDRN
C[C@H](Sc1ccc(O)cc1)c1cccc(C#N)c1	ZINC000189837168	264332650	/nfs/dbraw/zinc/33/26/50/264332650.db2.gz	BECOJLMQJUJAKQ-NSHDSACASA-N	0	0	255.342	4.117	20	30		CIEDRN
COc1ccccc1S[C@H](C)c1cccc(C#N)c1	ZINC000189839614	264334944	/nfs/dbraw/zinc/33/49/44/264334944.db2.gz	JUJRIOPYEYRZNC-GFCCVEGCSA-N	0	0	269.369	4.420	20	30		CIEDRN
C=C(CC)CNC(=O)CCCCCO[C@@H]1CCC[C@H](C)C1	ZINC000456810703	264342832	/nfs/dbraw/zinc/34/28/32/264342832.db2.gz	GMGLAEDPFAYNGY-DLBZAZTESA-N	0	0	295.467	4.225	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1c(C)cc(C)cc1C	ZINC000132662928	264397622	/nfs/dbraw/zinc/39/76/22/264397622.db2.gz	GSBUNAMVVNMBOB-UHFFFAOYSA-N	0	0	260.381	4.042	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1ccccc1OCC1CC1	ZINC000425520758	264433063	/nfs/dbraw/zinc/43/30/63/264433063.db2.gz	RPKVBTRJZHTGKI-UHFFFAOYSA-N	0	0	273.376	4.016	20	30		CIEDRN
C=C1CCN(C(=O)c2csc3cc(C)ccc23)CC1	ZINC000280675314	264457913	/nfs/dbraw/zinc/45/79/13/264457913.db2.gz	HXGVUTUNYGSBJZ-UHFFFAOYSA-N	0	0	271.385	4.002	20	30		CIEDRN
C#CCCCC(=O)Nc1cccc(CSC(C)C)c1C	ZINC000192138472	264560769	/nfs/dbraw/zinc/56/07/69/264560769.db2.gz	JIJAQCOTNHPNML-UHFFFAOYSA-N	0	0	289.444	4.379	20	30		CIEDRN
CSCCCSc1ccc(C#N)c(C(F)(F)F)c1	ZINC000320475620	264579067	/nfs/dbraw/zinc/57/90/67/264579067.db2.gz	ARSFVXPRQZNSCN-UHFFFAOYSA-N	0	0	291.363	4.422	20	30		CIEDRN
C[C@@H]1CCCC[C@@H]1NC(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000193057566	264612192	/nfs/dbraw/zinc/61/21/92/264612192.db2.gz	RREGFBNRSDTBMA-CJNGLKHVSA-N	0	0	299.418	4.188	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(CSCc2ccco2)no1	ZINC000290052996	264750040	/nfs/dbraw/zinc/75/00/40/264750040.db2.gz	ALWNNNHRGRYYGR-NSHDSACASA-N	0	0	278.377	4.166	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(-c2cnc(C)o2)cc1	ZINC000185158696	264990870	/nfs/dbraw/zinc/99/08/70/264990870.db2.gz	KTLSZTLVJNGGBV-GFCCVEGCSA-N	0	0	284.359	4.191	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H]1c1cccc(F)c1	ZINC000185236551	265010732	/nfs/dbraw/zinc/01/07/32/265010732.db2.gz	KLCUUOZAQSPYJJ-BBRMVZONSA-N	0	0	275.367	4.092	20	30		CIEDRN
CC#CCCCC(=O)N(C)[C@@H](C)c1ccccc1Cl	ZINC000185223716	265011712	/nfs/dbraw/zinc/01/17/12/265011712.db2.gz	XCXNHGNSVJAHBP-ZDUSSCGKSA-N	0	0	277.795	4.053	20	30		CIEDRN
N#Cc1cc(N2CC[C@H](c3ccccc3)C2)nc2ccccc12	ZINC000320682123	265017162	/nfs/dbraw/zinc/01/71/62/265017162.db2.gz	NBRIVNIGLMYHBI-INIZCTEOSA-N	0	0	299.377	4.100	20	30		CIEDRN
CC[C@](C)(NCc1ccc(C#N)cc1Cl)C(F)(F)F	ZINC000525886117	265035064	/nfs/dbraw/zinc/03/50/64/265035064.db2.gz	CDJLTBRZQUINLB-LBPRGKRZSA-N	0	0	290.716	4.032	20	30		CIEDRN
CC(C)Oc1ccccc1NCc1cc(C#N)cs1	ZINC000093492661	265183220	/nfs/dbraw/zinc/18/32/20/265183220.db2.gz	TXUSJQNQPFSQMZ-UHFFFAOYSA-N	0	0	272.373	4.019	20	30		CIEDRN
Cc1ccc(Cl)cc1Oc1ccc(C#N)c([N+](=O)[O-])c1	ZINC000094593655	265245895	/nfs/dbraw/zinc/24/58/95/265245895.db2.gz	QMSAHFRUXQZUOA-UHFFFAOYSA-N	0	0	288.690	4.221	20	30		CIEDRN
C=CCC1(C(=O)N2CCC[C@@H](c3ccccc3)C2)CCC1	ZINC000519015568	265297317	/nfs/dbraw/zinc/29/73/17/265297317.db2.gz	GTICMOLRDPVEGR-QGZVFWFLSA-N	0	0	283.415	4.139	20	30		CIEDRN
N#CCCSc1nc(-c2cccs2)nc2ccccc21	ZINC000012424651	265356751	/nfs/dbraw/zinc/35/67/51/265356751.db2.gz	FBKCCCHFTYUBFV-UHFFFAOYSA-N	0	0	297.408	4.364	20	30		CIEDRN
CC(C)(C)CCCCNC(=O)Nc1ccc(F)c(C#N)c1	ZINC000519200411	265361383	/nfs/dbraw/zinc/36/13/83/265361383.db2.gz	JMSGTCZTFQQHDS-UHFFFAOYSA-N	0	0	291.370	4.035	20	30		CIEDRN
C=CCCC1(c2nc(-c3ccc(F)cc3F)no2)CC1	ZINC000519707086	265559072	/nfs/dbraw/zinc/55/90/72/265559072.db2.gz	DMDHWPPJODJTEE-UHFFFAOYSA-N	0	0	276.286	4.013	20	30		CIEDRN
CCC[C@H](C)C(=O)Nc1sc2c(c1C#N)CC[C@@H](C)C2	ZINC000514607848	266019578	/nfs/dbraw/zinc/01/95/78/266019578.db2.gz	XDIXFFYYGJIHLY-MNOVXSKESA-N	0	0	290.432	4.119	20	30		CIEDRN
CC1(C)CCCN(C(=O)C[C@H](CC#N)c2ccccc2)CC1	ZINC000356210239	266072570	/nfs/dbraw/zinc/07/25/70/266072570.db2.gz	UGGGGFIKBJYFOT-KRWDZBQOSA-N	0	0	298.430	4.113	20	30		CIEDRN
C[C@H](NC(=O)CC#N)c1ccccc1-c1ccc(Cl)cc1	ZINC000356818572	266179675	/nfs/dbraw/zinc/17/96/75/266179675.db2.gz	GUGKDNMGAWKYTC-LBPRGKRZSA-N	0	0	298.773	4.098	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1cc[nH]c1	ZINC000356814890	266179687	/nfs/dbraw/zinc/17/96/87/266179687.db2.gz	KBUCCYUXPMUZBI-UHFFFAOYSA-N	0	0	268.360	4.119	20	30		CIEDRN
CCN(CCC#N)Cc1ccc(-c2ccccc2)cc1F	ZINC000356934166	266214264	/nfs/dbraw/zinc/21/42/64/266214264.db2.gz	YJZXNEHHAUIFIC-UHFFFAOYSA-N	0	0	282.362	4.228	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc3ccoc3c2)CC1	ZINC000356954353	266217366	/nfs/dbraw/zinc/21/73/66/266217366.db2.gz	INBBUXGONSLQTM-UHFFFAOYSA-N	0	0	255.317	4.118	20	30		CIEDRN
Cc1occc1SCc1cn2ccccc2c1C#N	ZINC000357087412	266244061	/nfs/dbraw/zinc/24/40/61/266244061.db2.gz	KVKFKIWQGZMHBJ-UHFFFAOYSA-N	0	0	268.341	4.005	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NCc1cc(C)no1	ZINC000357183930	266260761	/nfs/dbraw/zinc/26/07/61/266260761.db2.gz	DSWNJNDKKLSERG-UHFFFAOYSA-N	0	0	270.376	4.447	20	30		CIEDRN
C=CCN(C(=O)c1sc2ccc(F)cc2c1C)C1CC1	ZINC000357514771	266314812	/nfs/dbraw/zinc/31/48/12/266314812.db2.gz	UHVHEYOCDUSING-UHFFFAOYSA-N	0	0	289.375	4.139	20	30		CIEDRN
CC(C)[C@H]1C[C@@H](Nc2cccnc2C#N)c2ccccc21	ZINC000357662551	266341598	/nfs/dbraw/zinc/34/15/98/266341598.db2.gz	PFTXRLRBMLCDFM-NVXWUHKLSA-N	0	0	277.371	4.250	20	30		CIEDRN
C=CC[C@@H](CC)Nc1cc(-c2nc(C(C)C)no2)ccn1	ZINC000357687049	266347533	/nfs/dbraw/zinc/34/75/33/266347533.db2.gz	RNJPDZAZJUUSHY-CYBMUJFWSA-N	0	0	286.379	4.022	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(NCc2ccc(C3CC3)cc2)c1	ZINC000357750818	266355717	/nfs/dbraw/zinc/35/57/17/266355717.db2.gz	UWVUGPKZJKPNEG-UHFFFAOYSA-N	0	0	290.366	4.250	20	30		CIEDRN
N#Cc1ccccc1SCc1ccc(-n2ccnc2)cc1	ZINC000358502338	266470238	/nfs/dbraw/zinc/47/02/38/266470238.db2.gz	XZLZJYJKQBAJBR-UHFFFAOYSA-N	0	0	291.379	4.036	20	30		CIEDRN
Cc1scc(C(=O)Nc2sc(C)c(C)c2C#N)c1C	ZINC000358917818	266506961	/nfs/dbraw/zinc/50/69/61/266506961.db2.gz	HKLFQCXJWWMPFZ-UHFFFAOYSA-N	0	0	290.413	4.167	20	30		CIEDRN
C=CCC1(C(=O)Nc2sc(CCC)nc2C)CCC1	ZINC000359765441	266637273	/nfs/dbraw/zinc/63/72/73/266637273.db2.gz	HMHPNTFUQZWNQK-UHFFFAOYSA-N	0	0	278.421	4.089	20	30		CIEDRN
N#C[C@H]1CCC[C@H](Nc2cc(F)ccc2OCC2CC2)C1	ZINC000193353578	266667841	/nfs/dbraw/zinc/66/78/41/266667841.db2.gz	QBSBAYHGFRBROV-ZFWWWQNUSA-N	0	0	288.366	4.109	20	30		CIEDRN
Cc1nc(CSc2cccc(Cl)c2C#N)cs1	ZINC000360946785	266758945	/nfs/dbraw/zinc/75/89/45/266758945.db2.gz	OXFRLLYKWIICKO-UHFFFAOYSA-N	0	0	280.805	4.269	20	30		CIEDRN
CN(C(=O)CCCC#N)c1ccccc1Oc1ccccc1	ZINC000361685115	266871561	/nfs/dbraw/zinc/87/15/61/266871561.db2.gz	FMWROZUDNRFTMY-UHFFFAOYSA-N	0	0	294.354	4.136	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N(C)[C@H](C)C1CCC1	ZINC000362818178	267050540	/nfs/dbraw/zinc/05/05/40/267050540.db2.gz	SCVVFJLSEGLBRH-CYBMUJFWSA-N	0	0	289.444	4.225	20	30		CIEDRN
CC(C)(C#N)CCC[S@](=O)Cc1cc2ccccc2o1	ZINC000362882731	267056747	/nfs/dbraw/zinc/05/67/47/267056747.db2.gz	KPEBUTUOUFHNFS-FQEVSTJZSA-N	0	0	289.400	4.011	20	30		CIEDRN
C/C=C/CSCc1ncc(-c2ccc(C#N)cc2)o1	ZINC000363277054	267083953	/nfs/dbraw/zinc/08/39/53/267083953.db2.gz	UVTDPCYGCQQHPN-NSCUHMNNSA-N	0	0	270.357	4.023	20	30		CIEDRN
C=CCCCSCC(=O)N1CCC[C@@H]1c1cccs1	ZINC000363308464	267087148	/nfs/dbraw/zinc/08/71/48/267087148.db2.gz	FBWCBSKVZABIPY-CYBMUJFWSA-N	0	0	295.473	4.111	20	30		CIEDRN
CCCCCCCCC(=O)N1CCCC[C@@H]1c1cc[nH]n1	ZINC000367654497	267106541	/nfs/dbraw/zinc/10/65/41/267106541.db2.gz	ALCJIDDGAPGGCC-MRXNPFEDSA-N	0	0	291.439	4.214	20	30		CIEDRN
C=CCCCCNC(=O)Nc1ccc(C)c(-c2ncco2)c1	ZINC000368509329	267178657	/nfs/dbraw/zinc/17/86/57/267178657.db2.gz	PHAMGZMZDAOEFC-UHFFFAOYSA-N	0	0	299.374	4.128	20	30		CIEDRN
N#CCCCCSCc1cccc(Br)c1	ZINC000119233787	267312268	/nfs/dbraw/zinc/31/22/68/267312268.db2.gz	BRHQCAGFOCSNIJ-UHFFFAOYSA-N	0	0	284.222	4.376	20	30		CIEDRN
N#CC1(CNCc2ccc(-c3ccccc3)cc2)CCC1	ZINC000418145710	267366836	/nfs/dbraw/zinc/36/68/36/267366836.db2.gz	YSFIMBAHTFXEAB-UHFFFAOYSA-N	0	0	276.383	4.137	20	30		CIEDRN
C=CCCCC(=O)N1CCCC[C@@H]1c1ccc(F)cc1F	ZINC000371224447	267374258	/nfs/dbraw/zinc/37/42/58/267374258.db2.gz	YZYAJTQUBKPISQ-MRXNPFEDSA-N	0	0	293.357	4.375	20	30		CIEDRN
N#Cc1c(CNc2cccc(C(F)F)c2)cn2ccccc12	ZINC000193443421	267552892	/nfs/dbraw/zinc/55/28/92/267552892.db2.gz	ZBMGGVUKAGIPHL-UHFFFAOYSA-N	0	0	297.308	4.361	20	30		CIEDRN
C=Cc1ccc(C(=O)N[C@@H](CCC#N)c2ccccc2)cc1	ZINC000192186811	335091205	/nfs/dbraw/zinc/09/12/05/335091205.db2.gz	SBRMIMLZGVQZDH-SFHVURJKSA-N	0	0	290.366	4.104	20	30		CIEDRN
Cc1coc(NC(=O)CCCC2CCCCC2)c1C#N	ZINC000583652920	328727079	/nfs/dbraw/zinc/72/70/79/328727079.db2.gz	DBOSJMXLISXBCR-UHFFFAOYSA-N	0	0	274.364	4.149	20	30		CIEDRN
CC(F)(F)CCNc1ccc(C(F)(F)F)cc1C#N	ZINC000379185071	328794220	/nfs/dbraw/zinc/79/42/20/328794220.db2.gz	QVEUUZZGGHQXQM-UHFFFAOYSA-N	0	0	278.224	4.034	20	30		CIEDRN
N#Cc1ccc(CNc2cc(F)ccc2Cl)cc1F	ZINC000190369629	328801023	/nfs/dbraw/zinc/80/10/23/328801023.db2.gz	RAMHPFRRQMZGHB-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1ccc(Cl)cc1Cl	ZINC000104825920	328809809	/nfs/dbraw/zinc/80/98/09/328809809.db2.gz	DJIULTWAEJDPTL-UHFFFAOYSA-N	0	0	272.175	4.032	20	30		CIEDRN
C[C@@H](CCC#N)Sc1nnc(CCC2CCCCC2)o1	ZINC000357428138	328870627	/nfs/dbraw/zinc/87/06/27/328870627.db2.gz	VJHKWPBWFGBGAM-LBPRGKRZSA-N	0	0	293.436	4.367	20	30		CIEDRN
C=C(C)[C@H](NC(=O)[C@@H]1C[C@H]1CCC)c1ccc(F)c(F)c1	ZINC000462501717	327706021	/nfs/dbraw/zinc/70/60/21/327706021.db2.gz	LPELTOVZWQYMNU-KFNAQCHYSA-N	0	0	293.357	4.134	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@H]1CC12CCCCC2)c1ccccc1	ZINC000536533471	327709344	/nfs/dbraw/zinc/70/93/44/327709344.db2.gz	GENNLLNXNVMJSO-WBVHZDCISA-N	0	0	283.415	4.185	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1ccc2[nH]ccc2c1)c1ccccc1	ZINC000187814231	327722421	/nfs/dbraw/zinc/72/24/21/327722421.db2.gz	DHYJLJLGSOHXHK-KRWDZBQOSA-N	0	0	290.366	4.466	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(OC(C)C)cc1F	ZINC000187735487	327720825	/nfs/dbraw/zinc/72/08/25/327720825.db2.gz	DNGXGWJDHOEIEJ-INIZCTEOSA-N	0	0	279.355	4.154	20	30		CIEDRN
N#CCC[C@H](C#N)CN[C@@H](c1ccccc1F)C1CCCC1	ZINC000562990329	327737852	/nfs/dbraw/zinc/73/78/52/327737852.db2.gz	XGGIZXXVQDELFB-RDTXWAMCSA-N	0	0	299.393	4.090	20	30		CIEDRN
C=C[C@H](CC(=O)N1CC(C)(C)[C@@H]2CCC[C@@H]21)c1ccccc1	ZINC000580235624	327746324	/nfs/dbraw/zinc/74/63/24/327746324.db2.gz	AHZSUTHWOYCORO-NXHRZFHOSA-N	0	0	297.442	4.383	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cccc(C)c1Cl	ZINC000188476665	327753418	/nfs/dbraw/zinc/75/34/18/327753418.db2.gz	VZWUNKDERVPENL-CQSZACIVSA-N	0	0	251.757	4.189	20	30		CIEDRN
CC[C@H](C(=O)NCc1ccc(C#N)cc1)C1CCC(C)CC1	ZINC000460764880	327793946	/nfs/dbraw/zinc/79/39/46/327793946.db2.gz	HEQKTVNMJSXACK-UYJHFMRCSA-N	0	0	298.430	4.027	20	30		CIEDRN
Cc1c2ccccc2n(C)c1CNc1ccc(C#N)cc1F	ZINC000318586840	327823756	/nfs/dbraw/zinc/82/37/56/327823756.db2.gz	FDZKCLTUDOVGRN-UHFFFAOYSA-N	0	0	293.345	4.110	20	30		CIEDRN
N#C[C@@H]1CCC[C@H](Nc2cccc(OCC(F)(F)F)c2)C1	ZINC000185742919	327843787	/nfs/dbraw/zinc/84/37/87/327843787.db2.gz	ZZUCHCVFHKSKGY-NEPJUHHUSA-N	0	0	298.308	4.122	20	30		CIEDRN
N#C[C@@H]1CCC[C@@H](Nc2cccc(C(F)F)c2)C1	ZINC000185745218	327843799	/nfs/dbraw/zinc/84/37/99/327843799.db2.gz	QDJUVIQDBGBESP-ZYHUDNBSSA-N	0	0	250.292	4.118	20	30		CIEDRN
CSCCc1ccc(N[C@H]2CCC[C@H](C#N)C2)cc1	ZINC000185745565	327843920	/nfs/dbraw/zinc/84/39/20/327843920.db2.gz	HJMWYSHKKIDPBN-HOCLYGCPSA-N	0	0	274.433	4.086	20	30		CIEDRN
Cc1c2ccccc2n(C)c1CNc1cccc(F)c1C#N	ZINC000318830802	327850579	/nfs/dbraw/zinc/85/05/79/327850579.db2.gz	SHERIADZGAPHMC-UHFFFAOYSA-N	0	0	293.345	4.110	20	30		CIEDRN
N#Cc1cccc(CNc2cc(C(F)(F)F)ccc2F)c1	ZINC000062655422	327853985	/nfs/dbraw/zinc/85/39/85/327853985.db2.gz	VYJSCSNVBITIGG-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
CCCCn1c(C)c(C)nc1S[C@H](C)CCC#N	ZINC000188290031	327862951	/nfs/dbraw/zinc/86/29/51/327862951.db2.gz	PKSMWBSPTFBVSB-LLVKDONJSA-N	0	0	265.426	4.084	20	30		CIEDRN
C=C(C)CN(C)C(=O)Nc1cc(-c2ccccc2)cnc1C	ZINC000364861542	327891406	/nfs/dbraw/zinc/89/14/06/327891406.db2.gz	SWXOFRYUOQMELP-UHFFFAOYSA-N	0	0	295.386	4.097	20	30		CIEDRN
C=CCC[C@H](C(=O)Nc1ccc(O)c(C)c1)c1ccccc1	ZINC000187083139	327943004	/nfs/dbraw/zinc/94/30/04/327943004.db2.gz	IHMAYCVEMWKJCK-KRWDZBQOSA-N	0	0	295.382	4.389	20	30		CIEDRN
CC(C)CCc1ccccc1NC(=O)N(C)[C@@H](C)CC#N	ZINC000531496178	327943164	/nfs/dbraw/zinc/94/31/64/327943164.db2.gz	YSXOIQDFJZHPJD-AWEZNQCLSA-N	0	0	287.407	4.041	20	30		CIEDRN
N#CCCC1CCN(C(=O)CC/C=C\c2ccccc2)CC1	ZINC000563187796	327953573	/nfs/dbraw/zinc/95/35/73/327953573.db2.gz	ZGJDCOFLEMWNRF-WTKPLQERSA-N	0	0	296.414	4.022	20	30		CIEDRN
CCc1ccc2occ(C(=O)N[C@](C)(C#N)C(C)(C)C)c2c1	ZINC000570966560	327966496	/nfs/dbraw/zinc/96/64/96/327966496.db2.gz	VUWIGDNMMWAEIL-GOSISDBHSA-N	0	0	298.386	4.053	20	30		CIEDRN
N#CCCOCCSC(c1ccccc1)c1ccccc1	ZINC000338506378	327982977	/nfs/dbraw/zinc/98/29/77/327982977.db2.gz	QPCGKZHMULARIS-UHFFFAOYSA-N	0	0	297.423	4.439	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@H]1c1ccc(Cl)cc1	ZINC000366100870	327986448	/nfs/dbraw/zinc/98/64/48/327986448.db2.gz	BBDJLWOQZILTRZ-INIZCTEOSA-N	0	0	289.806	4.382	20	30		CIEDRN
CCCOc1ccc(CNc2ccc(F)cc2C#N)cc1	ZINC000097635453	327990132	/nfs/dbraw/zinc/99/01/32/327990132.db2.gz	TYGWXBPNBFQPLI-UHFFFAOYSA-N	0	0	284.334	4.098	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)N[C@H](CCC)c1ccccc1)OCC	ZINC000339430588	328010753	/nfs/dbraw/zinc/01/07/53/328010753.db2.gz	FJDLPEOOFOVETP-IAGOWNOFSA-N	0	0	289.419	4.015	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)[C@@H]1CCCc2ccccc21	ZINC000531518375	328013547	/nfs/dbraw/zinc/01/35/47/328013547.db2.gz	VAVYYQSOQXOSDY-QGZVFWFLSA-N	0	0	298.430	4.085	20	30		CIEDRN
N#Cc1cc(CNc2ccc(Cl)c(F)c2)ccc1F	ZINC000124083857	328015516	/nfs/dbraw/zinc/01/55/16/328015516.db2.gz	CXWILDAFAQSPEP-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
Cc1cccc(SCCOc2ccccc2C#N)c1	ZINC000040696107	328017361	/nfs/dbraw/zinc/01/73/61/328017361.db2.gz	RYLWMFUUMXHSTH-UHFFFAOYSA-N	0	0	269.369	4.038	20	30		CIEDRN
CC[C@H](CC1CCCCC1)C(=O)Nc1cc(CC#N)ccn1	ZINC000531671017	328022434	/nfs/dbraw/zinc/02/24/34/328022434.db2.gz	RYPADFAGYRSHDY-MRXNPFEDSA-N	0	0	299.418	4.083	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1cccc(F)c1)c1ccccc1	ZINC000533967763	328029454	/nfs/dbraw/zinc/02/94/54/328029454.db2.gz	SRQSROPLLULHOT-ZDUSSCGKSA-N	0	0	269.319	4.124	20	30		CIEDRN
C=CCCS[C@H](C)c1nc(-c2ccc(OC)cc2)no1	ZINC000531759656	328030798	/nfs/dbraw/zinc/03/07/98/328030798.db2.gz	VYRJNUAVTKCOIG-LLVKDONJSA-N	0	0	290.388	4.116	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1cc(-c2ccccc2)cnc1C	ZINC000534091292	328034488	/nfs/dbraw/zinc/03/44/88/328034488.db2.gz	DPINDDCCXCFREK-ZDUSSCGKSA-N	0	0	295.386	4.143	20	30		CIEDRN
CCc1cnc(CSc2ccc(C#N)cc2Cl)o1	ZINC000531798236	328034989	/nfs/dbraw/zinc/03/49/89/328034989.db2.gz	NNTCJHQDZAEWAV-UHFFFAOYSA-N	0	0	278.764	4.054	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1cccc(OCC=C)c1	ZINC000538348766	328037410	/nfs/dbraw/zinc/03/74/10/328037410.db2.gz	WJZTURNRDCHAPR-AWEZNQCLSA-N	0	0	288.391	4.118	20	30		CIEDRN
COc1ccc(C)cc1CSc1cccc(C#N)c1	ZINC000531833839	328041028	/nfs/dbraw/zinc/04/10/28/328041028.db2.gz	QNTMZXAXJUAIPX-UHFFFAOYSA-N	0	0	269.369	4.168	20	30		CIEDRN
CC(C)N(CCC#N)Cc1cnc(C2CCCCC2)s1	ZINC000534342168	328050018	/nfs/dbraw/zinc/05/00/18/328050018.db2.gz	PCSHFXBTPJRPLC-UHFFFAOYSA-N	0	0	291.464	4.315	20	30		CIEDRN
C=CCCCN(C)C(=O)[C@@H]1CC[C@H]2CCCC[C@H]2C1	ZINC000534396146	328050764	/nfs/dbraw/zinc/05/07/64/328050764.db2.gz	ITLBGGLWTIQACI-OWCLPIDISA-N	0	0	263.425	4.018	20	30		CIEDRN
CN(Cc1cccc(C#N)c1)C(=O)C[C@H]1CCCC(C)(C)C1	ZINC000534404337	328051333	/nfs/dbraw/zinc/05/13/33/328051333.db2.gz	QQHBWPOJZIMUIP-OAHLLOKOSA-N	0	0	298.430	4.123	20	30		CIEDRN
CN(C(=O)c1cccc(C(C)(C)C)c1)c1ccccc1C#N	ZINC000563367186	328059836	/nfs/dbraw/zinc/05/98/36/328059836.db2.gz	MMXQNRCEKOFFKS-UHFFFAOYSA-N	0	0	292.382	4.132	20	30		CIEDRN
CC[C@@H](CC#N)NCc1ccc(-c2ccccc2C#N)cc1	ZINC000563368537	328059846	/nfs/dbraw/zinc/05/98/46/328059846.db2.gz	XBPRJZVQDULPTD-SFHVURJKSA-N	0	0	289.382	4.007	20	30		CIEDRN
CC(C)SCCNc1cccc(C(F)F)c1C#N	ZINC000563425794	328065838	/nfs/dbraw/zinc/06/58/38/328065838.db2.gz	ROVAJMKLNQVMGV-UHFFFAOYSA-N	0	0	270.348	4.049	20	30		CIEDRN
CC[C@](C)(C#N)c1nc([C@H](c2ccccc2C)C(C)C)no1	ZINC000563479251	328068766	/nfs/dbraw/zinc/06/87/66/328068766.db2.gz	CWRLWCCDMMTPLK-MAUKXSAKSA-N	0	0	297.402	4.357	20	30		CIEDRN
CC[C@H](Sc1ccccc1)C(=O)Nc1ccc(C#N)cc1	ZINC000303524375	328083409	/nfs/dbraw/zinc/08/34/09/328083409.db2.gz	VOGPPMDLHQNSFI-INIZCTEOSA-N	0	0	296.395	4.068	20	30		CIEDRN
N#Cc1cccc(C(=O)Nc2cccc(-c3ccccc3)c2)c1	ZINC000571190508	328091651	/nfs/dbraw/zinc/09/16/51/328091651.db2.gz	LXGOAYDTLDAEBY-UHFFFAOYSA-N	0	0	298.345	4.478	20	30		CIEDRN
C[C@@H]1CC=C(C(=O)Nc2ccc(Cl)cc2CC#N)CC1	ZINC000571297316	328100492	/nfs/dbraw/zinc/10/04/92/328100492.db2.gz	ITKZHALGJLFYGP-LLVKDONJSA-N	0	0	288.778	4.091	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)CCCc1ccc(SC)cc1	ZINC000571286026	328097824	/nfs/dbraw/zinc/09/78/24/328097824.db2.gz	HXVOTYWQMRVRGS-HNNXBMFYSA-N	0	0	291.460	4.202	20	30		CIEDRN
C=CCCCN(C)C(=O)c1[nH]c2c(cccc2Cl)c1C	ZINC000412115275	328104117	/nfs/dbraw/zinc/10/41/17/328104117.db2.gz	BTHFZVLHGHLJOY-UHFFFAOYSA-N	0	0	290.794	4.168	20	30		CIEDRN
C=CCCC(=O)N[C@H](C)c1cc2ccccc2s1	ZINC000171727595	329078446	/nfs/dbraw/zinc/07/84/46/329078446.db2.gz	JRINYBSPBCAWPT-LLVKDONJSA-N	0	0	259.374	4.045	20	30		CIEDRN
C=CCCCC(=O)N1C[C@@H](c2ccccc2)C2(CCC2)C1	ZINC000412663782	328115894	/nfs/dbraw/zinc/11/58/94/328115894.db2.gz	CFNVVTYNRYMZCA-KRWDZBQOSA-N	0	0	283.415	4.139	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)NCc1ccc2sccc2c1	ZINC000571371560	328117354	/nfs/dbraw/zinc/11/73/54/328117354.db2.gz	PRLIUADKSXXCPN-CQSZACIVSA-N	0	0	288.416	4.055	20	30		CIEDRN
Cc1cccc([C@@H]2CCCCN2c2cc(C#N)ccn2)c1C	ZINC000571410276	328120259	/nfs/dbraw/zinc/12/02/59/328120259.db2.gz	REKYQFJNZDEYIZ-SFHVURJKSA-N	0	0	291.398	4.302	20	30		CIEDRN
CC(C)OCCCSc1ccc(C#N)cc1Cl	ZINC000163306406	328121006	/nfs/dbraw/zinc/12/10/06/328121006.db2.gz	UZBHNTVFSUGPRO-UHFFFAOYSA-N	0	0	269.797	4.119	20	30		CIEDRN
C=CCCOCCCCC(=O)N[C@@H]1CCC[C@H]1C(C)(C)C	ZINC000412808495	328125908	/nfs/dbraw/zinc/12/59/08/328125908.db2.gz	GUPGHVFSDAHSMM-HZPDHXFCSA-N	0	0	295.467	4.080	20	30		CIEDRN
Cc1ccc(C)c(-n2ccnc2S[C@@H]2CC[C@@H](C#N)C2)c1	ZINC000430126992	328136891	/nfs/dbraw/zinc/13/68/91/328136891.db2.gz	WDJJWMKXEVKZSS-HUUCEWRRSA-N	0	0	297.427	4.274	20	30		CIEDRN
N#CCCSCCCSc1ccccc1Cl	ZINC000413008802	328139184	/nfs/dbraw/zinc/13/91/84/328139184.db2.gz	ADZXCDQQPMXTDQ-UHFFFAOYSA-N	0	0	271.838	4.469	20	30		CIEDRN
C=CCC1(C(=O)NCC2CCC(F)(F)CC2)CCCC1	ZINC000451480504	328145760	/nfs/dbraw/zinc/14/57/60/328145760.db2.gz	OXFZQEGYUOXOOM-UHFFFAOYSA-N	0	0	285.378	4.065	20	30		CIEDRN
CC[C@@H](CNc1cc(C(C)=O)ccc1C#N)CC(F)(F)F	ZINC000413517663	328148034	/nfs/dbraw/zinc/14/80/34/328148034.db2.gz	HQEKHXYYOBGDSW-LLVKDONJSA-N	0	0	298.308	4.151	20	30		CIEDRN
Cc1ccc(C)c(OCCCSCCCCC#N)c1	ZINC000161172095	328150888	/nfs/dbraw/zinc/15/08/88/328150888.db2.gz	WMMMEFHSGBUAAD-UHFFFAOYSA-N	0	0	277.433	4.499	20	30		CIEDRN
CSc1ccc(CSCCCCC#N)cc1	ZINC000268750498	328185540	/nfs/dbraw/zinc/18/55/40/328185540.db2.gz	VCYXAFLISJHBGA-UHFFFAOYSA-N	0	0	251.420	4.336	20	30		CIEDRN
CCCCCCCCNC(=O)N(C)[C@H](C)c1ccccn1	ZINC000269967287	328191307	/nfs/dbraw/zinc/19/13/07/328191307.db2.gz	XCCASXNRMNJGFS-OAHLLOKOSA-N	0	0	291.439	4.145	20	30		CIEDRN
C=CCCCC(=O)N1CCCCC[C@@H]1c1ccco1	ZINC000176133719	329173941	/nfs/dbraw/zinc/17/39/41/329173941.db2.gz	KQFOKRFAYTVVPP-CQSZACIVSA-N	0	0	261.365	4.080	20	30		CIEDRN
Cc1cc(C)cc(-c2nnc(S[C@@H]3CC[C@@H](C#N)C3)o2)c1	ZINC000278533817	328226383	/nfs/dbraw/zinc/22/63/83/328226383.db2.gz	IWDSICJXZFEWAQ-TZMCWYRMSA-N	0	0	299.399	4.138	20	30		CIEDRN
CC(C)(C)c1cnc(S[C@@H]2CC[C@H](C#N)C2)s1	ZINC000278538144	328226637	/nfs/dbraw/zinc/22/66/37/328226637.db2.gz	JKQWJSGMTZHZAH-VHSXEESVSA-N	0	0	266.435	4.225	20	30		CIEDRN
CC(C)(C)c1cnc(S[C@H]2CC[C@@H](C#N)C2)s1	ZINC000278538146	328226730	/nfs/dbraw/zinc/22/67/30/328226730.db2.gz	JKQWJSGMTZHZAH-ZJUUUORDSA-N	0	0	266.435	4.225	20	30		CIEDRN
N#C[C@@H]1CC[C@H](SC2=Nc3ccccc3CS2)C1	ZINC000278592024	328227810	/nfs/dbraw/zinc/22/78/10/328227810.db2.gz	PWMPVCXJSOZSLV-PWSUYJOCSA-N	0	0	274.414	4.346	20	30		CIEDRN
CC(C)[C@@H]1C[C@@H](CC(=O)NCCCCC#N)c2ccccc21	ZINC000278677332	328229209	/nfs/dbraw/zinc/22/92/09/328229209.db2.gz	HLDGJHKXONDFEM-YJBOKZPZSA-N	0	0	298.430	4.114	20	30		CIEDRN
CCc1ccccc1NC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000279904981	328233729	/nfs/dbraw/zinc/23/37/29/328233729.db2.gz	LMKLGLQTQHIQIG-UHFFFAOYSA-N	0	0	292.382	4.302	20	30		CIEDRN
N#CC1(CCCSc2ccc(F)cc2F)CCOCC1	ZINC000280905740	328237049	/nfs/dbraw/zinc/23/70/49/328237049.db2.gz	FDCHGUOJFHZTPJ-UHFFFAOYSA-N	0	0	297.370	4.157	20	30		CIEDRN
N#CC1(CCCSc2ccc(F)c(F)c2)CCOCC1	ZINC000281006396	328238027	/nfs/dbraw/zinc/23/80/27/328238027.db2.gz	ODRRPRFSYVNOPV-UHFFFAOYSA-N	0	0	297.370	4.157	20	30		CIEDRN
Cc1oc(C#N)cc1C(=O)N(c1cc(C)ccc1C)C(C)C	ZINC000281038234	328238345	/nfs/dbraw/zinc/23/83/45/328238345.db2.gz	VGGXBIDRWCHYDI-UHFFFAOYSA-N	0	0	296.370	4.132	20	30		CIEDRN
CC(C)c1ccccc1NC(=O)NCC1CCC(C#N)CC1	ZINC000282642794	328242819	/nfs/dbraw/zinc/24/28/19/328242819.db2.gz	INEQYQHRTWXEHP-UHFFFAOYSA-N	0	0	299.418	4.261	20	30		CIEDRN
N#C[C@H]1CC[C@H](Sc2nc(-c3ccccc3)co2)C1	ZINC000287506008	328251403	/nfs/dbraw/zinc/25/14/03/328251403.db2.gz	KYMQOOCMKSKDCJ-AAEUAGOBSA-N	0	0	270.357	4.126	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)Nc1cccc(CCC(F)(F)F)c1	ZINC000287697912	328251940	/nfs/dbraw/zinc/25/19/40/328251940.db2.gz	WYRWXGKTBGCOCA-AWEZNQCLSA-N	0	0	298.308	4.060	20	30		CIEDRN
COc1nccc2cc(NC3CCC(C)(C#N)CC3)ccc21	ZINC000583545811	328605726	/nfs/dbraw/zinc/60/57/26/328605726.db2.gz	JXYUOLSPSJRWTK-UHFFFAOYSA-N	0	0	295.386	4.128	20	30		CIEDRN
Cc1ccc(-c2csc(NC(=O)CCCC#N)n2)cc1C	ZINC000290971904	328261403	/nfs/dbraw/zinc/26/14/03/328261403.db2.gz	OUHIDWBMPIMCBK-UHFFFAOYSA-N	0	0	299.399	4.059	20	30		CIEDRN
CCCCc1nc(CNc2cccc(CC#N)c2)cs1	ZINC000453150933	328291893	/nfs/dbraw/zinc/29/18/93/328291893.db2.gz	UBDXMBBGRFSAFZ-UHFFFAOYSA-N	0	0	285.416	4.164	20	30		CIEDRN
CC[C@@H](C#N)NC(=O)c1cc(-c2ccccc2)ccc1Cl	ZINC000110678924	328309011	/nfs/dbraw/zinc/30/90/11/328309011.db2.gz	YGUILQREUOVUNQ-AWEZNQCLSA-N	0	0	298.773	4.039	20	30		CIEDRN
C=CCOc1ccccc1C(=O)Nc1ccc(Cl)cc1	ZINC000048439201	328312862	/nfs/dbraw/zinc/31/28/62/328312862.db2.gz	IXBWCUMQLOGOAN-UHFFFAOYSA-N	0	0	287.746	4.157	20	30		CIEDRN
C[C@H](Cc1ccsc1)Nc1cccc(Cl)c1C#N	ZINC000048553217	328312373	/nfs/dbraw/zinc/31/23/73/328312373.db2.gz	PWRZTCDCLVTBGB-SNVBAGLBSA-N	0	0	276.792	4.316	20	30		CIEDRN
CC(C)C[C@](C)(C#N)NC(=O)C[C@@H]1CCCCC1(C)C	ZINC000534595654	328319542	/nfs/dbraw/zinc/31/95/42/328319542.db2.gz	HGBNMUUGCBPTAF-WMLDXEAASA-N	0	0	278.440	4.037	20	30		CIEDRN
C=C[C@@H](CC(=O)NC1CCCCCC1)c1ccccc1	ZINC000534601917	328320882	/nfs/dbraw/zinc/32/08/82/328320882.db2.gz	REMUFSAUDLIEFE-HNNXBMFYSA-N	0	0	271.404	4.185	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1ccc(OCC)cc1)c1ccccc1	ZINC000534601982	328320961	/nfs/dbraw/zinc/32/09/61/328320961.db2.gz	YIWZOCFVMZXUJO-HNNXBMFYSA-N	0	0	295.382	4.384	20	30		CIEDRN
C=C[C@H](CC(=O)N(C)CC1CCCCC1)c1ccccc1	ZINC000534607649	328322392	/nfs/dbraw/zinc/32/23/92/328322392.db2.gz	NHNFRZXDNQEEPH-QGZVFWFLSA-N	0	0	285.431	4.385	20	30		CIEDRN
CC(C)(CNc1ccc(F)cc1C#N)c1ccccc1	ZINC000111026599	328325648	/nfs/dbraw/zinc/32/56/48/328325648.db2.gz	RGGOIVKMXYWDHK-UHFFFAOYSA-N	0	0	268.335	4.087	20	30		CIEDRN
C=C[C@@H](CC(=O)NCc1ccc(CC)s1)c1ccccc1	ZINC000534633708	328332842	/nfs/dbraw/zinc/33/28/42/328332842.db2.gz	AMKYDBAAWLOGEF-AWEZNQCLSA-N	0	0	299.439	4.287	20	30		CIEDRN
C=C[C@@H](CC(=O)NCc1ccc(C)c(F)c1)c1ccccc1	ZINC000534650302	328336756	/nfs/dbraw/zinc/33/67/56/328336756.db2.gz	QUXPQMHJULWELZ-INIZCTEOSA-N	0	0	297.373	4.110	20	30		CIEDRN
N#Cc1ccc(F)c(CNc2ccc(Cl)c(F)c2)c1	ZINC000049120719	328340071	/nfs/dbraw/zinc/34/00/71/328340071.db2.gz	FJXMHAFPGKDIBH-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C=C[C@@H](CC(=O)N[C@@H]1CCCC(F)(F)C1)c1ccccc1	ZINC000534667692	328345959	/nfs/dbraw/zinc/34/59/59/328345959.db2.gz	YSFWQHZFYJNSEY-DZGCQCFKSA-N	0	0	293.357	4.040	20	30		CIEDRN
C=C[C@H](CC(=O)NCC1(CCC)CC1)c1ccccc1	ZINC000534725159	328359421	/nfs/dbraw/zinc/35/94/21/328359421.db2.gz	NTGHRXFBZVLZFQ-OAHLLOKOSA-N	0	0	271.404	4.043	20	30		CIEDRN
C[C@H]1CCC[C@@](C#N)(NC(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000303680857	328357746	/nfs/dbraw/zinc/35/77/46/328357746.db2.gz	RUPMHHVDJUZHEJ-IFXJQAMLSA-N	0	0	298.430	4.186	20	30		CIEDRN
C=CCCCNc1cccc(OCC(F)(F)F)c1	ZINC000303875100	328362655	/nfs/dbraw/zinc/36/26/55/328362655.db2.gz	QRGNUHVAKYYRPO-UHFFFAOYSA-N	0	0	259.271	4.006	20	30		CIEDRN
CCCC(CCC)SCC(=O)Nc1sccc1C#N	ZINC000049494605	328364174	/nfs/dbraw/zinc/36/41/74/328364174.db2.gz	RAKJFLBGUQDZSN-UHFFFAOYSA-N	0	0	296.461	4.260	20	30		CIEDRN
CCC(CC)[C@H](C)C(=O)N[C@@H](C#N)c1ccccc1Cl	ZINC000534903788	328369606	/nfs/dbraw/zinc/36/96/06/328369606.db2.gz	CARPZMIPJIUXBI-NHYWBVRUSA-N	0	0	292.810	4.093	20	30		CIEDRN
N#Cc1cccc(OCc2ccc(C(F)(F)F)cc2)c1	ZINC000049538279	328370725	/nfs/dbraw/zinc/37/07/25/328370725.db2.gz	KWUSEPCKCBPGKG-UHFFFAOYSA-N	0	0	277.245	4.156	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2ccc(C)cc2Cl)CC1	ZINC000111702060	328376412	/nfs/dbraw/zinc/37/64/12/328376412.db2.gz	FCJXEPJLVYSPOD-UHFFFAOYSA-N	0	0	278.783	4.078	20	30		CIEDRN
N#Cc1ccc(NCc2ccc3ccccc3c2)c(F)c1	ZINC000112012519	328381891	/nfs/dbraw/zinc/38/18/91/328381891.db2.gz	UNIPVCXJMSBDSI-UHFFFAOYSA-N	0	0	276.314	4.463	20	30		CIEDRN
Cc1cc2cc(CN(CCC#N)C(C)C)oc2cc1C	ZINC000535077510	328384618	/nfs/dbraw/zinc/38/46/18/328384618.db2.gz	RACGFYPQBYPNHG-UHFFFAOYSA-N	0	0	270.376	4.174	20	30		CIEDRN
CC[C@H](Nc1cccc(C#N)n1)c1ccc(Cl)s1	ZINC000535131041	328389714	/nfs/dbraw/zinc/38/97/14/328389714.db2.gz	YJQOLEOQAIZWOR-JTQLQIEISA-N	0	0	277.780	4.231	20	30		CIEDRN
C=CCN(CC(F)(F)F)C(=O)C[C@H]1CCCC(C)(C)C1	ZINC000535160516	328393948	/nfs/dbraw/zinc/39/39/48/328393948.db2.gz	DMLUNFQTLOZQFW-GFCCVEGCSA-N	0	0	291.357	4.170	20	30		CIEDRN
CN(C(=O)c1ccc(CC#N)cc1)[C@@H]1CCC[C@@H]1C(C)(C)C	ZINC000416282832	328434152	/nfs/dbraw/zinc/43/41/52/328434152.db2.gz	DETCSHFZCVPKFA-DLBZAZTESA-N	0	0	298.430	4.039	20	30		CIEDRN
CC1(C)CCC[C@H](c2noc(-c3cccc(C#N)c3)n2)C1	ZINC000535357601	328442320	/nfs/dbraw/zinc/44/23/20/328442320.db2.gz	IIWDYNDYQMVYOT-AWEZNQCLSA-N	0	0	281.359	4.292	20	30		CIEDRN
CC[C@@H](Cc1ccccc1)Nc1cccc(F)c1C#N	ZINC000112466146	328439836	/nfs/dbraw/zinc/43/98/36/328439836.db2.gz	GVTPMAWGQUVMAS-AWEZNQCLSA-N	0	0	268.335	4.131	20	30		CIEDRN
C=C[C@@H](CC(=O)N(C)[C@@H](C)C(C)(C)C)c1ccccc1	ZINC000535366674	328444709	/nfs/dbraw/zinc/44/47/09/328444709.db2.gz	BPEYMVZUEQDZBA-GJZGRUSLSA-N	0	0	273.420	4.239	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CCC[C@@](C)(CC)C1)c1ccccc1	ZINC000535404321	328451500	/nfs/dbraw/zinc/45/15/00/328451500.db2.gz	JDICPQNBPOOVDY-QFBILLFUSA-N	0	0	285.431	4.385	20	30		CIEDRN
N#Cc1ccc(OCc2ccc(F)cc2F)c(Cl)c1	ZINC000050884861	328451641	/nfs/dbraw/zinc/45/16/41/328451641.db2.gz	GIZJWBWLPRXZHT-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
C=CCCC(=O)Nc1cccc(Cl)c1Br	ZINC000190097490	328488381	/nfs/dbraw/zinc/48/83/81/328488381.db2.gz	RXUBOVZHSANKJC-UHFFFAOYSA-N	0	0	288.572	4.007	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccc2oc(C3CC3)nc2c1	ZINC000077264964	328489483	/nfs/dbraw/zinc/48/94/83/328489483.db2.gz	NYKKAVNHIMZBDP-UHFFFAOYSA-N	0	0	299.374	4.135	20	30		CIEDRN
N#Cc1cccc(-c2nc(-c3ccc4ccccc4c3)no2)c1	ZINC000391563165	328511707	/nfs/dbraw/zinc/51/17/07/328511707.db2.gz	XYFBWNSHUDJVHM-UHFFFAOYSA-N	0	0	297.317	4.428	20	30		CIEDRN
CC[C@H](C)CC(=O)Nc1sc2c(c1C#N)CC[C@H](C)C2	ZINC000563765044	328512950	/nfs/dbraw/zinc/51/29/50/328512950.db2.gz	ZRVNASBINPSITF-QWRGUYRKSA-N	0	0	290.432	4.119	20	30		CIEDRN
C=CCC1(c2nc([C@H](OCC)c3ccccc3)no2)CCC1	ZINC000563843107	328523987	/nfs/dbraw/zinc/52/39/87/328523987.db2.gz	SEWMKQLUCBWIOB-OAHLLOKOSA-N	0	0	298.386	4.193	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC(F)(F)F)[C@@H](C)C(C)C	ZINC000185704804	328552591	/nfs/dbraw/zinc/55/25/91/328552591.db2.gz	WVSPQNVTHJJCPY-RYUDHWBXSA-N	0	0	279.346	4.024	20	30		CIEDRN
C[C@H]1CN(CCCCC(C)(C)C#N)c2ccccc21	ZINC000398491107	328593309	/nfs/dbraw/zinc/59/33/09/328593309.db2.gz	IESAKAHGYABYGZ-AWEZNQCLSA-N	0	0	256.393	4.330	20	30		CIEDRN
C[C@@H]1CCC[C@](C#N)(NC(=O)c2ccc3ccccc3c2)C1	ZINC000116808271	326795162	/nfs/dbraw/zinc/79/51/62/326795162.db2.gz	BOKOXKKMDNKCPO-KUHUBIRLSA-N	0	0	292.382	4.042	20	30		CIEDRN
C[C@@H](NCc1c(F)cccc1Cl)c1ccc(C#N)cc1	ZINC000035256328	326815224	/nfs/dbraw/zinc/81/52/24/326815224.db2.gz	AABXOYJCIAXYTI-LLVKDONJSA-N	0	0	288.753	4.202	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ccc(C(C)(C)C#N)cc2)n1	ZINC000556365261	326923472	/nfs/dbraw/zinc/92/34/72/326923472.db2.gz	QFUPLFTTZFSWJI-UHFFFAOYSA-N	0	0	295.386	4.391	20	30		CIEDRN
C=C[C@@H](CC(=O)N[C@](C)(CC)C(F)(F)F)c1ccccc1	ZINC000536285596	326934837	/nfs/dbraw/zinc/93/48/37/326934837.db2.gz	LSPZUINKZCQIMV-SWLSCSKDSA-N	0	0	299.336	4.194	20	30		CIEDRN
N#Cc1c(F)cccc1NCc1coc2ccccc12	ZINC000083601628	326936929	/nfs/dbraw/zinc/93/69/29/326936929.db2.gz	FIBUYEGDOINZOT-UHFFFAOYSA-N	0	0	266.275	4.056	20	30		CIEDRN
CC(C)(C#N)CCNc1ccc(F)c(C(F)(F)F)c1	ZINC000087591495	326942328	/nfs/dbraw/zinc/94/23/28/326942328.db2.gz	SQUYZKBQAMPMHC-UHFFFAOYSA-N	0	0	274.261	4.196	20	30		CIEDRN
C/C=C(/C=C\C(=O)N(CC)[C@@H](C)c1ccc(C#N)cc1)CC	ZINC000255133437	326950031	/nfs/dbraw/zinc/95/00/31/326950031.db2.gz	SIBZLIGJJBNQBM-RGNPBJNMSA-N	0	0	296.414	4.380	20	30		CIEDRN
CCc1cc(N[C@H](C)c2ccc(C#N)cc2)ccc1F	ZINC000506661691	332776766	/nfs/dbraw/zinc/77/67/66/332776766.db2.gz	ORWNPNBZHARHNW-GFCCVEGCSA-N	0	0	268.335	4.433	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1ccc(OC(C)C)cc1C	ZINC000557087135	326992782	/nfs/dbraw/zinc/99/27/82/326992782.db2.gz	QDRWTXRGZWUZIK-UHFFFAOYSA-N	0	0	290.407	4.212	20	30		CIEDRN
Cc1cc(C(F)(F)F)c(C#N)c(SC2CCCC2)n1	ZINC000557228923	326997951	/nfs/dbraw/zinc/99/79/51/326997951.db2.gz	ULCSVWJBRJPFFJ-UHFFFAOYSA-N	0	0	286.322	4.315	20	30		CIEDRN
C=C(CC)CNc1ccc(C(=O)NCC(C)C)c(Cl)c1	ZINC000557307241	327001392	/nfs/dbraw/zinc/00/13/92/327001392.db2.gz	QCOHRVABSJKTIQ-UHFFFAOYSA-N	0	0	294.826	4.104	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCc2ccccc2C1(C)C	ZINC000557342586	327002327	/nfs/dbraw/zinc/00/23/27/327002327.db2.gz	HBSOUSYHEVBALB-UHFFFAOYSA-N	0	0	283.415	4.075	20	30		CIEDRN
C=C(C)CCc1noc([C@@H]2[C@H](C)[C@@H]2c2ccccc2)n1	ZINC000557517265	327011097	/nfs/dbraw/zinc/01/10/97/327011097.db2.gz	JFNPBWAFDIROBY-DAXOMENPSA-N	0	0	268.360	4.095	20	30		CIEDRN
CC(C)[C@@H](Nc1cc(C#N)ccn1)c1ccc(F)cc1F	ZINC000557607490	327015973	/nfs/dbraw/zinc/01/59/73/327015973.db2.gz	WKSVGTJRYLHWDO-MRXNPFEDSA-N	0	0	287.313	4.041	20	30		CIEDRN
C[C@@H]1CC[C@@H](Nc2nccc(C#N)c2Cl)c2ccccc21	ZINC000557639837	327018286	/nfs/dbraw/zinc/01/82/86/327018286.db2.gz	UFPYNZAFDVMOTM-IAQYHMDHSA-N	0	0	297.789	4.079	20	30		CIEDRN
N#Cc1ccnc(N[C@@H]2CCC[C@H](c3ccccc3)C2)c1	ZINC000557682503	327020602	/nfs/dbraw/zinc/02/06/02/327020602.db2.gz	OKFHQIZHDCSSRZ-DLBZAZTESA-N	0	0	277.371	4.092	20	30		CIEDRN
C[C@@H]1C[C@@H](c2ccccc2)N(c2ccc(Cl)c(C#N)n2)C1	ZINC000557764315	327025744	/nfs/dbraw/zinc/02/57/44/327025744.db2.gz	OHQPMOUKWPSNNZ-WBMJQRKESA-N	0	0	297.789	4.194	20	30		CIEDRN
CC(C)(C)c1ccccc1C(=O)NCC(C)(C)CCC#N	ZINC000557922453	327035283	/nfs/dbraw/zinc/03/52/83/327035283.db2.gz	KJYOYROFCFTLHE-UHFFFAOYSA-N	0	0	286.419	4.044	20	30		CIEDRN
C=CCCO[C@H](C)C(=O)Nc1cccc(-c2ccccc2)c1	ZINC000557946701	327036749	/nfs/dbraw/zinc/03/67/49/327036749.db2.gz	SAVNZUYCOQRWBG-OAHLLOKOSA-N	0	0	295.382	4.273	20	30		CIEDRN
C=CCC[C@H](C(=O)N[C@@H]1CCC1(C)C)c1ccccc1	ZINC000557977638	327038339	/nfs/dbraw/zinc/03/83/39/327038339.db2.gz	LMJGIKIOVBZELM-JKSUJKDBSA-N	0	0	271.404	4.041	20	30		CIEDRN
C[C@@H]1C[C@@H](CC(=O)NCC(C)(C)CCC#N)CC(C)(C)C1	ZINC000557999688	327039654	/nfs/dbraw/zinc/03/96/54/327039654.db2.gz	LCOMLKWDSGRMOE-CABCVRRESA-N	0	0	292.467	4.285	20	30		CIEDRN
CC[C@H](CC(=O)NCC(C)(C)CCC#N)c1ccccc1	ZINC000557996113	327039743	/nfs/dbraw/zinc/03/97/43/327039743.db2.gz	HEUDWEOWXRHXBR-OAHLLOKOSA-N	0	0	286.419	4.016	20	30		CIEDRN
CCc1cccc2c1OCC[C@H]2Nc1cccc(F)c1C#N	ZINC000506752971	332778948	/nfs/dbraw/zinc/77/89/48/332778948.db2.gz	WORNKIPEYQIPEW-QGZVFWFLSA-N	0	0	296.345	4.195	20	30		CIEDRN
Cc1cc([N+](=O)[O-])cc(Cl)c1NCC(C)(C)CCC#N	ZINC000558043871	327048584	/nfs/dbraw/zinc/04/85/84/327048584.db2.gz	LUKSINIPBXFTLR-UHFFFAOYSA-N	0	0	295.770	4.299	20	30		CIEDRN
C=C[C@H](CC(=O)N(C1CCC1)C1CCC1)c1ccccc1	ZINC000558080743	327061668	/nfs/dbraw/zinc/06/16/68/327061668.db2.gz	QHNBIZLXMAXSAH-OAHLLOKOSA-N	0	0	283.415	4.280	20	30		CIEDRN
Cc1c2ccc(F)cc2nc(CC#N)c1C(C)(C)C	ZINC000558123089	327074397	/nfs/dbraw/zinc/07/43/97/327074397.db2.gz	UXXNTXXOVIGMNX-UHFFFAOYSA-N	0	0	256.324	4.046	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cc(CSCC)ccn1	ZINC000153464003	327075053	/nfs/dbraw/zinc/07/50/53/327075053.db2.gz	FVYXZKIFGKBVMB-UHFFFAOYSA-N	0	0	290.432	4.042	20	30		CIEDRN
CC[C@@H](c1ccccc1OC)N(C)Cc1ccccc1C#N	ZINC000558177336	327077396	/nfs/dbraw/zinc/07/73/96/327077396.db2.gz	UJJPFWZXRHXSBJ-SFHVURJKSA-N	0	0	294.398	4.150	20	30		CIEDRN
N#CCc1ccccc1NC(=O)c1ccc(C2CCC2)cc1	ZINC000558193905	327078012	/nfs/dbraw/zinc/07/80/12/327078012.db2.gz	XYBIAAXLBKBGLC-UHFFFAOYSA-N	0	0	290.366	4.272	20	30		CIEDRN
Cc1ccccc1C[C@H](C)Nc1ccc(C#N)cc1F	ZINC000506835881	332780943	/nfs/dbraw/zinc/78/09/43/332780943.db2.gz	FKAADKOJZXPEOR-ZDUSSCGKSA-N	0	0	268.335	4.049	20	30		CIEDRN
CC#CCCCc1nc(-c2cc(Cl)ccc2C)no1	ZINC000558342059	327088245	/nfs/dbraw/zinc/08/82/45/327088245.db2.gz	STDZMZKEZNPGNI-UHFFFAOYSA-N	0	0	274.751	4.044	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2ccc3c(n2)CCCC3)no1	ZINC000558375689	327089352	/nfs/dbraw/zinc/08/93/52/327089352.db2.gz	YPBPIYNWSDENJF-LBPRGKRZSA-N	0	0	283.375	4.080	20	30		CIEDRN
CC[C@@](C)(C#N)c1nc([C@@H](c2cccc(C)c2)C(C)C)no1	ZINC000558393067	327090159	/nfs/dbraw/zinc/09/01/59/327090159.db2.gz	JAOGGJZBIMTFSL-QAPCUYQASA-N	0	0	297.402	4.357	20	30		CIEDRN
CC(C)(C)CN(C/C=C/c1ccc(F)c(F)c1)CCC#N	ZINC000558400284	327090589	/nfs/dbraw/zinc/09/05/89/327090589.db2.gz	JMYSFDSRJKHARV-GQCTYLIASA-N	0	0	292.373	4.240	20	30		CIEDRN
CC(C)c1ccc(C[NH2+][C@H]2CCc3ccc(C#N)cc32)cc1	ZINC000558503890	327099389	/nfs/dbraw/zinc/09/93/89/327099389.db2.gz	GQYPQEFPSSXTHY-FQEVSTJZSA-N	0	0	290.410	4.459	20	30		CIEDRN
CC(C)Oc1ccc(CNc2cccc(CC#N)c2)cc1	ZINC000313421284	327128626	/nfs/dbraw/zinc/12/86/26/327128626.db2.gz	BUOROKVWEVTZRT-UHFFFAOYSA-N	0	0	280.371	4.152	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1ccc(OC(C)C)cc1C	ZINC000566139279	327146641	/nfs/dbraw/zinc/14/66/41/327146641.db2.gz	SSIGPCXUHQPGFM-UHFFFAOYSA-N	0	0	275.392	4.323	20	30		CIEDRN
C=CCC[C@H](C(=O)N[C@@H]1CCC[C@@H]1C)c1ccccc1	ZINC000409658812	327163070	/nfs/dbraw/zinc/16/30/70/327163070.db2.gz	ZKAIJGBASZZUSR-BHYGNILZSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CCCc1ccccc1NCc1ccc(C#N)cc1OC	ZINC000409852027	327166444	/nfs/dbraw/zinc/16/64/44/327166444.db2.gz	BVWNNFTUJYTDKN-UHFFFAOYSA-N	0	0	292.382	4.298	20	30		CIEDRN
C=CCCc1ccccc1NCc1ccc(C#N)c(F)c1	ZINC000409853663	327166752	/nfs/dbraw/zinc/16/67/52/327166752.db2.gz	OSVLTOBMZFVARU-UHFFFAOYSA-N	0	0	280.346	4.428	20	30		CIEDRN
C=CCCc1ccccc1NCc1ccccc1[N+](=O)[O-]	ZINC000409857263	327166913	/nfs/dbraw/zinc/16/69/13/327166913.db2.gz	SQYZYWXDCQBTTP-UHFFFAOYSA-N	0	0	282.343	4.326	20	30		CIEDRN
N#Cc1ccc(N2CCC[C@H](Cc3ccccc3)C2)c(F)c1	ZINC000518507468	327170427	/nfs/dbraw/zinc/17/04/27/327170427.db2.gz	UMVMLAAWKPAAJA-QGZVFWFLSA-N	0	0	294.373	4.156	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1sc2c(c1C)CCCC2	ZINC000569387791	327171588	/nfs/dbraw/zinc/17/15/88/327171588.db2.gz	FDUXZHKQEPIKNI-UHFFFAOYSA-N	0	0	277.433	4.476	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@H]1C[C@H]1c1ccc2ccccc2c1	ZINC000410130509	327180017	/nfs/dbraw/zinc/18/00/17/327180017.db2.gz	MOPGUBIDWJSJIM-FHWLQOOXSA-N	0	0	293.410	4.414	20	30		CIEDRN
C=CCCC1(C(=O)NCC[C@H](C)c2ccccc2)CC1	ZINC000410210352	327182748	/nfs/dbraw/zinc/18/27/48/327182748.db2.gz	LJMQTOAIIIHXJD-HNNXBMFYSA-N	0	0	271.404	4.043	20	30		CIEDRN
CC(C)=CCC[C@H](C)CC(=O)Nc1snc(C)c1C#N	ZINC000569487496	327185638	/nfs/dbraw/zinc/18/56/38/327185638.db2.gz	JDLLOFWOMWIAGI-NSHDSACASA-N	0	0	291.420	4.034	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1oc(C)cc1C	ZINC000410354452	327187320	/nfs/dbraw/zinc/18/73/20/327187320.db2.gz	QCGKYZUSHYGJSF-UHFFFAOYSA-N	0	0	269.344	4.267	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)Cc1ccccc1F	ZINC000410354018	327187331	/nfs/dbraw/zinc/18/73/31/327187331.db2.gz	ORDIPHXAUOLTJJ-UHFFFAOYSA-N	0	0	283.346	4.126	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1ccc(C)c(OC)c1	ZINC000410345587	327187635	/nfs/dbraw/zinc/18/76/35/327187635.db2.gz	CHPHLWLVKKGPGL-UHFFFAOYSA-N	0	0	295.382	4.375	20	30		CIEDRN
CC(C)(CCC#N)CNc1cc(F)ccc1OC(F)F	ZINC000092173670	327189004	/nfs/dbraw/zinc/18/90/04/327189004.db2.gz	WNMILMKVAJYSIX-UHFFFAOYSA-N	0	0	286.297	4.169	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)[C@H]1CC[C@@H](C)C1	ZINC000410382218	327189191	/nfs/dbraw/zinc/18/91/91/327189191.db2.gz	LNKQCKUJYYDJQV-HIFRSBDPSA-N	0	0	257.377	4.180	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1cc(OC)cs1	ZINC000410382488	327189554	/nfs/dbraw/zinc/18/95/54/327189554.db2.gz	ZZOTUNUGSAPCNL-UHFFFAOYSA-N	0	0	287.384	4.128	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)CC[C@@H]1CC[C@H](C)O1	ZINC000410388716	327190829	/nfs/dbraw/zinc/19/08/29/327190829.db2.gz	ZKLXNFZFTPYXFN-HOCLYGCPSA-N	0	0	287.403	4.091	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H](C)[C@@H](C)c1ccccc1	ZINC000151177648	327209998	/nfs/dbraw/zinc/20/99/98/327209998.db2.gz	DNXPMVXSFXJGPP-HUUCEWRRSA-N	0	0	271.404	4.063	20	30		CIEDRN
C=C(C)CN(C)C(=O)Nc1cccc(OCCC(C)C)c1	ZINC000181651083	327212254	/nfs/dbraw/zinc/21/22/54/327212254.db2.gz	CQIDDXXXZYSJGH-UHFFFAOYSA-N	0	0	290.407	4.151	20	30		CIEDRN
C=C(C)CCSCc1csc(-c2ccccn2)n1	ZINC000507131729	332789300	/nfs/dbraw/zinc/78/93/00/332789300.db2.gz	LEWWMLITRWMTBX-UHFFFAOYSA-N	0	0	276.430	4.405	20	30		CIEDRN
CC(C)(C(=O)Nc1ccc(C#N)cc1Cl)C1CCCC1	ZINC000533877237	327230067	/nfs/dbraw/zinc/23/00/67/327230067.db2.gz	UPYKWKWHWAIGKL-UHFFFAOYSA-N	0	0	290.794	4.367	20	30		CIEDRN
C=C[C@H](CC(=O)NCc1cccc(Cl)c1)c1ccccc1	ZINC000533880000	327231315	/nfs/dbraw/zinc/23/13/15/327231315.db2.gz	YZMJRTPHCWNEJP-OAHLLOKOSA-N	0	0	299.801	4.316	20	30		CIEDRN
C=CCN(Cc1ncc(C2CC2)o1)CC1CCCCC1	ZINC000536366434	327232323	/nfs/dbraw/zinc/23/23/23/327232323.db2.gz	TWFOFTOWTVEHSN-UHFFFAOYSA-N	0	0	274.408	4.120	20	30		CIEDRN
C=CCC(F)(F)c1nc(C2CCC(C)(C)CC2)no1	ZINC000584306608	327232809	/nfs/dbraw/zinc/23/28/09/327232809.db2.gz	OXJPSOFQIGAHNA-UHFFFAOYSA-N	0	0	270.323	4.421	20	30		CIEDRN
C=C[C@@H](CC(=O)NCc1ccc(C)cc1C)c1ccccc1	ZINC000533883146	327235955	/nfs/dbraw/zinc/23/59/55/327235955.db2.gz	TVZCSFQQIMLJJB-KRWDZBQOSA-N	0	0	293.410	4.280	20	30		CIEDRN
CCC(CC)[C@@H](C)C(=O)Nc1cc(C#N)cn1C(C)(C)C	ZINC000536429079	327237598	/nfs/dbraw/zinc/23/75/98/327237598.db2.gz	DACZSPNMTZMUCT-GFCCVEGCSA-N	0	0	289.423	4.126	20	30		CIEDRN
CN(C)c1ccccc1CSc1ccc(C#N)cc1F	ZINC000538529830	327241234	/nfs/dbraw/zinc/24/12/34/327241234.db2.gz	LMSGGPHHWRRHIJ-UHFFFAOYSA-N	0	0	286.375	4.056	20	30		CIEDRN
C=CCN(C(=O)c1cc2c(s1)CCCCCC2)C1CC1	ZINC000537934625	327242547	/nfs/dbraw/zinc/24/25/47/327242547.db2.gz	VVRXUBMIKPTBGL-UHFFFAOYSA-N	0	0	289.444	4.198	20	30		CIEDRN
C=C[C@H](CC(=O)N1C[C@H](C)c2ccccc21)c1ccccc1	ZINC000559667243	327257409	/nfs/dbraw/zinc/25/74/09/327257409.db2.gz	WOPNETNRSLPFLV-JKSUJKDBSA-N	0	0	291.394	4.497	20	30		CIEDRN
C=CCC(F)(F)c1nc(-c2ccc(Cl)cc2)no1	ZINC000559925170	327271615	/nfs/dbraw/zinc/27/16/15/327271615.db2.gz	KEGXOTQSORYAFU-UHFFFAOYSA-N	0	0	270.666	4.058	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1C[C@H](c2ccccc2C)C[C@@H]1C	ZINC000559926528	327271669	/nfs/dbraw/zinc/27/16/69/327271669.db2.gz	ACWOJSCYYMBRPI-JKSUJKDBSA-N	0	0	285.431	4.302	20	30		CIEDRN
Cc1cc(CSCCCCCF)ccc1C#N	ZINC000559952183	327273586	/nfs/dbraw/zinc/27/35/86/327273586.db2.gz	FYPVJGNFRTVPSY-UHFFFAOYSA-N	0	0	251.370	4.240	20	30		CIEDRN
C=CCCCCCNc1cc(NC(C)=O)ccc1Cl	ZINC000559974459	327274731	/nfs/dbraw/zinc/27/47/31/327274731.db2.gz	TTZJZQMKOUVKRP-UHFFFAOYSA-N	0	0	280.799	4.457	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H](C)c1ccccc1C(F)(F)F	ZINC000560000338	327276611	/nfs/dbraw/zinc/27/66/11/327276611.db2.gz	UQEKYRSBLTVWOJ-LLVKDONJSA-N	0	0	299.336	4.485	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H](C)c2ccsc2)n1	ZINC000560024788	327278100	/nfs/dbraw/zinc/27/81/00/327278100.db2.gz	MYGAENDYFBMQQL-SNVBAGLBSA-N	0	0	262.378	4.137	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cc(C)n([C@@H](C)CC)n2)n1	ZINC000560024491	327278148	/nfs/dbraw/zinc/27/81/48/327278148.db2.gz	LTXCZFPYQZATRO-NSHDSACASA-N	0	0	288.395	4.066	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H](c2cccnc2)C(C)C)n1	ZINC000560025461	327278504	/nfs/dbraw/zinc/27/85/04/327278504.db2.gz	ANUSLJLLFGOENC-AWEZNQCLSA-N	0	0	285.391	4.106	20	30		CIEDRN
CC[C@H]1CCCC[C@H]1c1noc(-c2cccc(C#N)c2)n1	ZINC000560048794	327280520	/nfs/dbraw/zinc/28/05/20/327280520.db2.gz	JPMRUMMDDRUBJL-DZGCQCFKSA-N	0	0	281.359	4.292	20	30		CIEDRN
C=CCCCNC(=O)N1CCC[C@H]1c1cccc(Cl)c1	ZINC000448034259	327283119	/nfs/dbraw/zinc/28/31/19/327283119.db2.gz	GZKWGLBLKRYQEX-HNNXBMFYSA-N	0	0	292.810	4.153	20	30		CIEDRN
C=CCCCSc1ncnc2sc(C)cc21	ZINC000560121835	327285350	/nfs/dbraw/zinc/28/53/50/327285350.db2.gz	UBAPFIGKHBOPAG-UHFFFAOYSA-N	0	0	250.392	4.058	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CC[C@H](Cc2ccccc2)[C@H]1C	ZINC000560135688	327285978	/nfs/dbraw/zinc/28/59/78/327285978.db2.gz	WZFOSXFJKDKFCZ-NVXWUHKLSA-N	0	0	285.431	4.068	20	30		CIEDRN
C=CCCCNC(=O)N(CC)[C@@H](CC)c1ccccc1	ZINC000448034793	327289704	/nfs/dbraw/zinc/28/97/04/327289704.db2.gz	LKVFLYMYOBMSNR-INIZCTEOSA-N	0	0	274.408	4.135	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)Nc1ccc2oc3ccccc3c2c1	ZINC000560421576	327306240	/nfs/dbraw/zinc/30/62/40/327306240.db2.gz	CZXPJOXPWNPMTN-GOSISDBHSA-N	0	0	292.338	4.464	20	30		CIEDRN
C=C(C)CCc1noc(CCc2cccc(Cl)c2)n1	ZINC000560457491	327309272	/nfs/dbraw/zinc/30/92/72/327309272.db2.gz	ZSBFBNHFGLYGOR-UHFFFAOYSA-N	0	0	276.767	4.017	20	30		CIEDRN
C=CCC[C@@H](Nc1cnn(C(C)(C)C)c1)c1ccco1	ZINC000560549938	327323468	/nfs/dbraw/zinc/32/34/68/327323468.db2.gz	ZTESCRXZWXNQIV-CQSZACIVSA-N	0	0	273.380	4.351	20	30		CIEDRN
N#C[C@H](Sc1ccc2n[nH]cc2c1)C1CCCCC1	ZINC000560813526	327344623	/nfs/dbraw/zinc/34/46/23/327344623.db2.gz	IRIDBIWMHLJRCY-HNNXBMFYSA-N	0	0	271.389	4.127	20	30		CIEDRN
CCCC[C@@H](CC)CC(=O)NC1(c2cccc(C#N)c2)CC1	ZINC000560843838	327347622	/nfs/dbraw/zinc/34/76/22/327347622.db2.gz	LJYRLKFAQCVLBG-OAHLLOKOSA-N	0	0	298.430	4.270	20	30		CIEDRN
C=CCCCCNc1cc(NC(=O)CC)ccc1C	ZINC000578716568	327348929	/nfs/dbraw/zinc/34/89/29/327348929.db2.gz	ABJALMNOLZSWQC-UHFFFAOYSA-N	0	0	260.381	4.112	20	30		CIEDRN
CN(Cc1cccc(C#N)c1)C(=O)CCCCC(C)(C)C	ZINC000561023169	327358499	/nfs/dbraw/zinc/35/84/99/327358499.db2.gz	VLUYYWBGMVKYOX-UHFFFAOYSA-N	0	0	286.419	4.123	20	30		CIEDRN
CC(C)c1ccc2occ(C(=O)N[C@](C)(C#N)C(C)C)c2c1	ZINC000561098583	327366297	/nfs/dbraw/zinc/36/62/97/327366297.db2.gz	BZLMSWLZVAXEPN-GOSISDBHSA-N	0	0	298.386	4.224	20	30		CIEDRN
C=CCC(CC=C)C(=O)NCc1ccccc1OC1CCC1	ZINC000150740076	327368186	/nfs/dbraw/zinc/36/81/86/327368186.db2.gz	JDMYZXOQPPDWLU-UHFFFAOYSA-N	0	0	299.414	4.003	20	30		CIEDRN
Cc1cc(C#N)nc(SCc2ccc(C(C)C)cc2)n1	ZINC000561187345	327373508	/nfs/dbraw/zinc/37/35/08/327373508.db2.gz	WMHKNWHVIVARMO-UHFFFAOYSA-N	0	0	283.400	4.072	20	30		CIEDRN
C[C@H]1C[C@@H](CCNc2cccc(C(F)F)c2C#N)CCO1	ZINC000583451042	327373848	/nfs/dbraw/zinc/37/38/48/327373848.db2.gz	IXAHGADRZRJRMU-RYUDHWBXSA-N	0	0	294.345	4.113	20	30		CIEDRN
CC(C)c1ccc(C(=O)N2CCC(CCC#N)CC2)s1	ZINC000574760835	327374465	/nfs/dbraw/zinc/37/44/65/327374465.db2.gz	WVZRVIIBFRDQEM-UHFFFAOYSA-N	0	0	290.432	4.027	20	30		CIEDRN
CCCCSCCC(=O)Nc1sc(CC)cc1C#N	ZINC000150814625	327382824	/nfs/dbraw/zinc/38/28/24/327382824.db2.gz	HXMWYYSHBODRHQ-UHFFFAOYSA-N	0	0	296.461	4.044	20	30		CIEDRN
Cc1cc(Oc2ncc(C#N)cc2Cl)c(C)c(C)c1C#N	ZINC000561447814	327395316	/nfs/dbraw/zinc/39/53/16/327395316.db2.gz	GDPBWURQYXGFCS-UHFFFAOYSA-N	0	0	297.745	4.196	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@@H](c2ccccc2)[C@H](C)C1	ZINC000150911487	327398757	/nfs/dbraw/zinc/39/87/57/327398757.db2.gz	BMRAXKAYDOFGBX-VQIMIIECSA-N	0	0	297.442	4.407	20	30		CIEDRN
CC(C)(C)CCCCC(=O)N(C1CC1)C1(C#N)CCC1	ZINC000561793457	327422280	/nfs/dbraw/zinc/42/22/80/327422280.db2.gz	OSMJPTNBMVNWMO-UHFFFAOYSA-N	0	0	276.424	4.030	20	30		CIEDRN
CC(C)(C)CN(CCC#N)Cc1coc(-c2ccccc2)n1	ZINC000157242462	327427384	/nfs/dbraw/zinc/42/73/84/327427384.db2.gz	KORJDXVUTNFTFJ-UHFFFAOYSA-N	0	0	297.402	4.103	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2ccnc(OC3CCC3)c2)no1	ZINC000561891985	327428743	/nfs/dbraw/zinc/42/87/43/327428743.db2.gz	QUTGJSWOMHYDOS-LBPRGKRZSA-N	0	0	299.374	4.133	20	30		CIEDRN
CC(C)C[C@@H](C)CC(=O)N(CCC#N)c1ccc(F)cc1	ZINC000561920624	327430672	/nfs/dbraw/zinc/43/06/72/327430672.db2.gz	PWDZBTGMTZTYMZ-CQSZACIVSA-N	0	0	290.382	4.145	20	30		CIEDRN
CC(C)CCc1ccccc1N[C@H]1CC[C@H](C#N)C1	ZINC000562525217	327487375	/nfs/dbraw/zinc/48/73/75/327487375.db2.gz	QKHGOISISPTTFS-HOCLYGCPSA-N	0	0	256.393	4.379	20	30		CIEDRN
N#CCc1cc(Cl)ccc1NC(=O)C[C@@H]1C=CCCC1	ZINC000562699651	327505580	/nfs/dbraw/zinc/50/55/80/327505580.db2.gz	RKMKTYVZIAYFKV-GFCCVEGCSA-N	0	0	288.778	4.091	20	30		CIEDRN
CC[C@H](Nc1cnn(C(C)(C)C)c1)c1ccc(C#N)cc1	ZINC000569672227	327533697	/nfs/dbraw/zinc/53/36/97/327533697.db2.gz	AJTNBEJLJOHBKZ-INIZCTEOSA-N	0	0	282.391	4.073	20	30		CIEDRN
COc1cc(C#N)ccc1NCc1cccc2ccccc21	ZINC000317375966	327571966	/nfs/dbraw/zinc/57/19/66/327571966.db2.gz	DTAXYURCOLMNPK-UHFFFAOYSA-N	0	0	288.350	4.332	20	30		CIEDRN
C=CCCCNC(=O)N(Cc1ccoc1)C1CCCCC1	ZINC000448385789	327612628	/nfs/dbraw/zinc/61/26/28/327612628.db2.gz	LJWLVGSIUYVCJI-UHFFFAOYSA-N	0	0	290.407	4.090	20	30		CIEDRN
C=CCCCCCNC(=O)Nc1cc2[nH]ccc2cc1C	ZINC000583573267	328617678	/nfs/dbraw/zinc/61/76/78/328617678.db2.gz	PEISCDDCFMDOAZ-UHFFFAOYSA-N	0	0	285.391	4.344	20	30		CIEDRN
Cc1cc(F)cc(-c2noc(-c3ccc(C#N)cc3C)n2)c1	ZINC000389206032	328683640	/nfs/dbraw/zinc/68/36/40/328683640.db2.gz	QZWNJRRPMCYDQW-UHFFFAOYSA-N	0	0	293.301	4.031	20	30		CIEDRN
CCCCCOc1ccc(CN[C@@H](CC)CC#N)cc1	ZINC000054182863	328690069	/nfs/dbraw/zinc/69/00/69/328690069.db2.gz	FUUOGZZESXIYOE-INIZCTEOSA-N	0	0	274.408	4.037	20	30		CIEDRN
Cc1ccc(OCc2cccc(C#N)c2)c(Cl)c1	ZINC000054351100	328691398	/nfs/dbraw/zinc/69/13/98/328691398.db2.gz	CVNULPBRSIOYHK-UHFFFAOYSA-N	0	0	257.720	4.099	20	30		CIEDRN
CC[C@H](C#N)c1ccc(-c2cnc(C3CC3)o2)cc1	ZINC000530251441	328718732	/nfs/dbraw/zinc/71/87/32/328718732.db2.gz	RIJOBXZHJCXCLZ-LLVKDONJSA-N	0	0	252.317	4.236	20	30		CIEDRN
N#Cc1ccc(CNc2ccc(Cl)cc2F)c(F)c1	ZINC000042336094	328763314	/nfs/dbraw/zinc/76/33/14/328763314.db2.gz	LQOWJUZRBOGNJV-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
CCCCC1CCC(C(=O)N(CCC#N)C(C)C)CC1	ZINC000042530385	328768718	/nfs/dbraw/zinc/76/87/18/328768718.db2.gz	IFXJVOWQJULFFK-UHFFFAOYSA-N	0	0	278.440	4.134	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)[C@H]1CCCc2ccccc21	ZINC000532333881	328770311	/nfs/dbraw/zinc/77/03/11/328770311.db2.gz	AKIYDDUOKGJFFI-SFHVURJKSA-N	0	0	283.415	4.291	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)[C@@H]2CC23CCCCC3)cc1	ZINC000532423021	328776760	/nfs/dbraw/zinc/77/67/60/328776760.db2.gz	WPOQTRHVTSMXTA-INIZCTEOSA-N	0	0	296.414	4.397	20	30		CIEDRN
Cc1ccc(Cl)c(Oc2nc(C)ccc2C#N)c1	ZINC000043400494	328789860	/nfs/dbraw/zinc/78/98/60/328789860.db2.gz	VASCGKRLLFMQFU-UHFFFAOYSA-N	0	0	258.708	4.016	20	30		CIEDRN
CCCc1cccc(C(C)C)c1NC(=O)NC[C@@H](C)C#N	ZINC000189988559	328793674	/nfs/dbraw/zinc/79/36/74/328793674.db2.gz	RSPIWHYSBLGQHJ-ZDUSSCGKSA-N	0	0	287.407	4.044	20	30		CIEDRN
C=C[C@H](CC(=O)N(C)[C@H](C)CCCC)c1ccccc1	ZINC000580374154	328797946	/nfs/dbraw/zinc/79/79/46/328797946.db2.gz	AJNNFHPBSLKUQD-HZPDHXFCSA-N	0	0	273.420	4.383	20	30		CIEDRN
C=CCCSCc1ccc(Br)cc1	ZINC000379390097	328804359	/nfs/dbraw/zinc/80/43/59/328804359.db2.gz	MYWVTZYHCHJEHM-UHFFFAOYSA-N	0	0	257.196	4.258	20	30		CIEDRN
C=C(C)COc1cccc(NCc2ccccc2)c1	ZINC000532725337	328807476	/nfs/dbraw/zinc/80/74/76/328807476.db2.gz	GUBXVVNPTPQWRY-UHFFFAOYSA-N	0	0	253.345	4.254	20	30		CIEDRN
C=C(C)CCS[C@@H](C)C(=O)Nc1cc(C)ccc1OC	ZINC000507801532	332824522	/nfs/dbraw/zinc/82/45/22/332824522.db2.gz	MGOBPTQXAKTMLD-ZDUSSCGKSA-N	0	0	293.432	4.030	20	30		CIEDRN
Cc1cc(C#N)cc(C)c1OCCCCC(F)(F)F	ZINC000507855151	332827840	/nfs/dbraw/zinc/82/78/40/332827840.db2.gz	DDFWCSFXDQOONG-UHFFFAOYSA-N	0	0	271.282	4.287	20	30		CIEDRN
C=C(C)CCS[C@@H](C)C(=O)N[C@H](C)c1ccccc1C	ZINC000507838206	332826725	/nfs/dbraw/zinc/82/67/25/332826725.db2.gz	XNQCHMSSHRDTOS-CABCVRRESA-N	0	0	291.460	4.260	20	30		CIEDRN
N#CC1(CCCSCCc2ccccc2)CCOCC1	ZINC000357704926	328874587	/nfs/dbraw/zinc/87/45/87/328874587.db2.gz	HYYYJAHRMOEBGH-UHFFFAOYSA-N	0	0	289.444	4.063	20	30		CIEDRN
C=C(C)CCSCC(=O)N[C@H](C)c1ccc(C)c(C)c1	ZINC000507832979	332826870	/nfs/dbraw/zinc/82/68/70/332826870.db2.gz	FKDZKJVDSHGCLL-OAHLLOKOSA-N	0	0	291.460	4.180	20	30		CIEDRN
C=C(CC)CNc1ccccc1S[C@H](C)CC#N	ZINC000358657953	328889681	/nfs/dbraw/zinc/88/96/81/328889681.db2.gz	BBSLAIHHACHDPM-CYBMUJFWSA-N	0	0	260.406	4.459	20	30		CIEDRN
C=C(C)CCSCCC(=O)Nc1ccccc1OCC	ZINC000507878036	332828880	/nfs/dbraw/zinc/82/88/80/332828880.db2.gz	XAGFLZUBUMIMOO-UHFFFAOYSA-N	0	0	293.432	4.113	20	30		CIEDRN
CC[C@H](CC1CCCC1)C(=O)NCC1CCC(C#N)CC1	ZINC000508346919	332837354	/nfs/dbraw/zinc/83/73/54/332837354.db2.gz	KZTFQBSJZHDLCP-OFLPRAFFSA-N	0	0	290.451	4.039	20	30		CIEDRN
Cc1ccc([C@@H](C)N(C)C(=O)c2ccc(C#N)s2)c(C)c1	ZINC000486803010	329063565	/nfs/dbraw/zinc/06/35/65/329063565.db2.gz	PVECLFINYXJVFN-CYBMUJFWSA-N	0	0	298.411	4.070	20	30		CIEDRN
CC(C)[C@@H](CC(=O)NC1(C#N)CCCCC1)c1ccccc1	ZINC000171296059	329073677	/nfs/dbraw/zinc/07/36/77/329073677.db2.gz	ABOIEFPTYJVEOW-QGZVFWFLSA-N	0	0	298.430	4.159	20	30		CIEDRN
N#Cc1cc(F)c(N2CCC[C@@H]2c2ccsc2)c(F)c1	ZINC000486933909	329080062	/nfs/dbraw/zinc/08/00/62/329080062.db2.gz	XPAJOHJMWZINDI-CQSZACIVSA-N	0	0	290.338	4.239	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N(C)Cc1csc2ccccc12	ZINC000172077731	329082788	/nfs/dbraw/zinc/08/27/88/329082788.db2.gz	URHDYJHDEYPEHG-LBPRGKRZSA-N	0	0	288.416	4.007	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2ccc(N(C)C)cc2F)no1	ZINC000582512531	329099394	/nfs/dbraw/zinc/09/93/94/329099394.db2.gz	KMBNJJXNNIFWIA-LLVKDONJSA-N	0	0	289.354	4.011	20	30		CIEDRN
Cc1[nH]c(SCC2(C#N)CCC2)nc1-c1ccccc1	ZINC000582647228	329124281	/nfs/dbraw/zinc/12/42/81/329124281.db2.gz	ZCHDZYYZASLJCM-UHFFFAOYSA-N	0	0	283.400	4.171	20	30		CIEDRN
N#Cc1cc2c(nc1SCCCCCF)CCCC2	ZINC000582656640	329125687	/nfs/dbraw/zinc/12/56/87/329125687.db2.gz	JOXVKBIJWYILGV-UHFFFAOYSA-N	0	0	278.396	4.064	20	30		CIEDRN
C=C(C)CCc1noc([C@@H]2C[C@H]2c2c(F)cccc2F)n1	ZINC000508595670	332842737	/nfs/dbraw/zinc/84/27/37/332842737.db2.gz	OOAXENZBIUFRJB-GHMZBOCLSA-N	0	0	290.313	4.128	20	30		CIEDRN
CCOc1cc(N[C@H](C)c2cccc(C#N)c2)ccc1C	ZINC000582740527	329134655	/nfs/dbraw/zinc/13/46/55/329134655.db2.gz	PJWYGLNADIELNV-CQSZACIVSA-N	0	0	280.371	4.439	20	30		CIEDRN
Cc1nocc1CSc1ccc(C#N)c(C(F)(F)F)c1	ZINC000582763684	329155313	/nfs/dbraw/zinc/15/53/13/329155313.db2.gz	XBQIDXLXIDOZIU-UHFFFAOYSA-N	0	0	298.289	4.166	20	30		CIEDRN
C=CCCCSCc1nc([C@H](C)OCC(C)C)no1	ZINC000174252517	329155322	/nfs/dbraw/zinc/15/53/22/329155322.db2.gz	KOYLHVYIWXOSDH-LBPRGKRZSA-N	0	0	284.425	4.003	20	30		CIEDRN
C=C(C)CCc1noc(/C=C(\C)Cc2ccccc2OC)n1	ZINC000508615224	332844245	/nfs/dbraw/zinc/84/42/45/332844245.db2.gz	NJEVNBWVSRWDAD-WYMLVPIESA-N	0	0	298.386	4.233	20	30		CIEDRN
C=C(C)CCc1noc([C@H](C)Cc2cccc(F)c2)n1	ZINC000508616198	332844326	/nfs/dbraw/zinc/84/43/26/332844326.db2.gz	UCUYDDTYVSZOJI-GFCCVEGCSA-N	0	0	274.339	4.064	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@H]1c1cccc(Cl)c1	ZINC000175360479	329165040	/nfs/dbraw/zinc/16/50/40/329165040.db2.gz	FSESDKFSQBDFLD-HNNXBMFYSA-N	0	0	277.795	4.360	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@H]1c1ccc(OCC)cc1	ZINC000175170111	329165901	/nfs/dbraw/zinc/16/59/01/329165901.db2.gz	CPNUSEJGVWRMBP-KRWDZBQOSA-N	0	0	287.403	4.105	20	30		CIEDRN
C=CCCCC(=O)Nc1cccc(Br)c1C	ZINC000175524689	329169166	/nfs/dbraw/zinc/16/91/66/329169166.db2.gz	ZASLLUMCRLSJFZ-UHFFFAOYSA-N	0	0	282.181	4.052	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)C1(CC(C)C)CCC1	ZINC000176476478	329175813	/nfs/dbraw/zinc/17/58/13/329175813.db2.gz	LVVCUMFPADSOGK-UHFFFAOYSA-N	0	0	270.376	4.022	20	30		CIEDRN
C#Cc1cccc(NCc2ncc(-c3cccc(F)c3)o2)c1	ZINC000177186542	329180564	/nfs/dbraw/zinc/18/05/64/329180564.db2.gz	BIBDODOACDGDKG-UHFFFAOYSA-N	0	0	292.313	4.074	20	30		CIEDRN
C=C(C)CCc1noc(-c2cc3ccc(F)cc3nc2C)n1	ZINC000508631618	332845206	/nfs/dbraw/zinc/84/52/06/332845206.db2.gz	KSACPGVOUHUKTK-UHFFFAOYSA-N	0	0	297.333	4.241	20	30		CIEDRN
C=C(C)CSCC(=O)Nc1c(Cl)cccc1Cl	ZINC000177866622	329187123	/nfs/dbraw/zinc/18/71/23/329187123.db2.gz	UWZZXBVMYMUDOC-UHFFFAOYSA-N	0	0	290.215	4.241	20	30		CIEDRN
C[C@@H](C(=O)Nc1sccc1C#N)c1cc2ccccc2o1	ZINC000177567248	329187669	/nfs/dbraw/zinc/18/76/69/329187669.db2.gz	MUKHBXYFHUXQOK-SNVBAGLBSA-N	0	0	296.351	4.108	20	30		CIEDRN
C=CCCCCC[N@H+]1C[C@H](C2CCCCC2)C[C@@H]1C(=O)[O-]	ZINC000582796807	329208709	/nfs/dbraw/zinc/20/87/09/329208709.db2.gz	AOPNWOXNXYXQRF-IAGOWNOFSA-N	0	0	293.451	4.088	20	30		CIEDRN
C=C(C)CCc1noc(-c2cccc([C@@H]3CCCOC3)c2)n1	ZINC000508670259	332846964	/nfs/dbraw/zinc/84/69/64/332846964.db2.gz	HHXYMXJRYAJVRS-MRXNPFEDSA-N	0	0	298.386	4.139	20	30		CIEDRN
C=C(C)CCc1noc([C@H](C)Cc2ccc(C)cc2)n1	ZINC000508682809	332847288	/nfs/dbraw/zinc/84/72/88/332847288.db2.gz	XIDGEPZZPKPSMG-CQSZACIVSA-N	0	0	270.376	4.233	20	30		CIEDRN
C=C(C)CCc1noc(CC[C@H](C)c2ccccc2)n1	ZINC000508682417	332847349	/nfs/dbraw/zinc/84/73/49/332847349.db2.gz	WGXIGFGTBHCXOV-AWEZNQCLSA-N	0	0	270.376	4.315	20	30		CIEDRN
C=C(C)CCc1noc(-c2ccc(F)c(CSC)c2)n1	ZINC000508686386	332847416	/nfs/dbraw/zinc/84/74/16/332847416.db2.gz	MCORENDUJCNMDN-UHFFFAOYSA-N	0	0	292.379	4.247	20	30		CIEDRN
C=C(C)CCc1noc([C@H]2C[C@]23CCCc2ccccc23)n1	ZINC000508687212	332847434	/nfs/dbraw/zinc/84/74/34/332847434.db2.gz	RCPAKVSCEVHDNT-APWZRJJASA-N	0	0	294.398	4.340	20	30		CIEDRN
C=CC[C@@H](CC)[NH2+]Cc1nc(-c2ccccc2)cs1	ZINC000393745840	329238901	/nfs/dbraw/zinc/23/89/01/329238901.db2.gz	LWCFUWJPPWLIMQ-CQSZACIVSA-N	0	0	272.417	4.254	20	30		CIEDRN
C[C@H](Nc1cccc(-c2cnco2)c1)c1ccc(C#N)s1	ZINC000182831017	329242452	/nfs/dbraw/zinc/24/24/52/329242452.db2.gz	ZIKJQDHNCXUPHD-NSHDSACASA-N	0	0	295.367	4.448	20	30		CIEDRN
Cc1csc(CSCc2ccc(Cl)cc2C#N)n1	ZINC000184829694	329263208	/nfs/dbraw/zinc/26/32/08/329263208.db2.gz	ZPBKWTGKRHDLAJ-UHFFFAOYSA-N	0	0	294.832	4.410	20	30		CIEDRN
CC#CCCCC(=O)Nc1cccc(-c2csc(C)n2)c1	ZINC000185010732	329264659	/nfs/dbraw/zinc/26/46/59/329264659.db2.gz	IPMCNRUJXJMBNA-UHFFFAOYSA-N	0	0	298.411	4.251	20	30		CIEDRN
Cc1oc2ccccc2c1C(=O)Nc1ccc(CC#N)cc1	ZINC000185011334	329264719	/nfs/dbraw/zinc/26/47/19/329264719.db2.gz	PAISCUDPWLRWTM-UHFFFAOYSA-N	0	0	290.322	4.060	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC=C(c2ccc(F)cc2)CC1	ZINC000185074895	329267781	/nfs/dbraw/zinc/26/77/81/329267781.db2.gz	FXYLDQVLNHZJLZ-AWEZNQCLSA-N	0	0	287.378	4.044	20	30		CIEDRN
Cc1cc(Cl)cc(CNc2cccc(C#N)c2)c1	ZINC000395126143	329277025	/nfs/dbraw/zinc/27/70/25/329277025.db2.gz	CFJCJRIXTJBVCU-UHFFFAOYSA-N	0	0	256.736	4.132	20	30		CIEDRN
C=CCC1(c2nc(-c3cccc4[nH]ccc43)no2)CCC1	ZINC000582870588	329278552	/nfs/dbraw/zinc/27/85/52/329278552.db2.gz	MKJCOOABRFUDOW-UHFFFAOYSA-N	0	0	279.343	4.216	20	30		CIEDRN
COc1ccc(CNc2cccc3ccsc32)cc1C#N	ZINC000395325618	329282510	/nfs/dbraw/zinc/28/25/10/329282510.db2.gz	WRRKYERIGKSWHK-UHFFFAOYSA-N	0	0	294.379	4.394	20	30		CIEDRN
COc1ccc(C#N)cc1NC(=O)CCCCC(C)(C)C	ZINC000583016038	329302940	/nfs/dbraw/zinc/30/29/40/329302940.db2.gz	LOEYCYARTWOOSS-UHFFFAOYSA-N	0	0	288.391	4.112	20	30		CIEDRN
C=CCCCCCNC(=O)Cc1cccc(C(F)F)c1	ZINC000583151573	329323208	/nfs/dbraw/zinc/32/32/08/329323208.db2.gz	BVYXYVACHNEUAB-UHFFFAOYSA-N	0	0	281.346	4.029	20	30		CIEDRN
C=CCNc1nc(-c2cccc(Cl)c2)cs1	ZINC000301579706	332852751	/nfs/dbraw/zinc/85/27/51/332852751.db2.gz	IFAXNOTYQFUYQV-UHFFFAOYSA-N	0	0	250.754	4.061	20	30		CIEDRN
Cc1cc(C)c(C#N)c(N2CCC(c3ccsc3)CC2)n1	ZINC000186517973	329344711	/nfs/dbraw/zinc/34/47/11/329344711.db2.gz	YEQMKHWXEOVDTG-UHFFFAOYSA-N	0	0	297.427	4.016	20	30		CIEDRN
CC(C)(C#N)CCC[S@](=O)CCCCc1ccccc1	ZINC000187111360	329353320	/nfs/dbraw/zinc/35/33/20/329353320.db2.gz	BWPRPXYXDFNDFH-HXUWFJFHSA-N	0	0	291.460	4.088	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)c1ccc2ccccc2c1	ZINC000187522837	329358717	/nfs/dbraw/zinc/35/87/17/329358717.db2.gz	HAJIFYHPXSQKCD-UHFFFAOYSA-N	0	0	294.398	4.384	20	30		CIEDRN
C=CCC[C@@H](C(=O)N[C@H](C)c1ccccn1)c1ccccc1	ZINC000188872793	329372746	/nfs/dbraw/zinc/37/27/46/329372746.db2.gz	CKQBMODCIDDJEO-NVXWUHKLSA-N	0	0	294.398	4.009	20	30		CIEDRN
C=CCC[C@@H](C(=O)Nc1c(C)noc1CC)c1ccccc1	ZINC000188869747	329372852	/nfs/dbraw/zinc/37/28/52/329372852.db2.gz	BJKBJLAWPAAAJW-OAHLLOKOSA-N	0	0	298.386	4.234	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1ccoc1	ZINC000189887237	329388095	/nfs/dbraw/zinc/38/80/95/329388095.db2.gz	NUNBSYLPBXTPEQ-UHFFFAOYSA-N	0	0	269.344	4.384	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)CSC	ZINC000189894557	329388598	/nfs/dbraw/zinc/38/85/98/329388598.db2.gz	CPWQTMYLDTYLFE-CYBMUJFWSA-N	0	0	291.460	4.476	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1ccccc1O	ZINC000189897410	329388607	/nfs/dbraw/zinc/38/86/07/329388607.db2.gz	HQXPBBCMNBMJGI-UHFFFAOYSA-N	0	0	295.382	4.496	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)CO[C@H](C)CC	ZINC000189872784	329388664	/nfs/dbraw/zinc/38/86/64/329388664.db2.gz	CTWPIXZEGPFIQY-CQSZACIVSA-N	0	0	289.419	4.292	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)CO[C@@H](C)CC	ZINC000189872807	329388991	/nfs/dbraw/zinc/38/89/91/329388991.db2.gz	CTWPIXZEGPFIQY-AWEZNQCLSA-N	0	0	289.419	4.292	20	30		CIEDRN
Cc1c(C#N)cccc1C(=O)N[C@@H](C)c1cccc(Cl)c1	ZINC000509033411	332856715	/nfs/dbraw/zinc/85/67/15/332856715.db2.gz	LEBXNBGKTPGAIB-LBPRGKRZSA-N	0	0	298.773	4.011	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1ccccn1	ZINC000189874586	329389760	/nfs/dbraw/zinc/38/97/60/329389760.db2.gz	QEBDKWRJLJNZMI-UHFFFAOYSA-N	0	0	280.371	4.186	20	30		CIEDRN
C=CCC1(C(=O)N(C)Cc2ccc(Cl)c(F)c2)CCC1	ZINC000189872485	329389768	/nfs/dbraw/zinc/38/97/68/329389768.db2.gz	FWVJHHZYTITEBT-UHFFFAOYSA-N	0	0	295.785	4.184	20	30		CIEDRN
C=CCCC(=O)Nc1c(CC=C)cccc1C(C)C	ZINC000189906176	329389916	/nfs/dbraw/zinc/38/99/16/329389916.db2.gz	LLRDEFPEYUGBKZ-UHFFFAOYSA-N	0	0	257.377	4.443	20	30		CIEDRN
N#CCCCSCc1ccc(C(F)(F)F)cc1	ZINC000190886179	329401759	/nfs/dbraw/zinc/40/17/59/329401759.db2.gz	AALMBTUXCLNARX-UHFFFAOYSA-N	0	0	259.296	4.242	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NCc1ncc(C)o1	ZINC000190912549	329402970	/nfs/dbraw/zinc/40/29/70/329402970.db2.gz	LIWCHNSGNSLYAM-UHFFFAOYSA-N	0	0	270.376	4.447	20	30		CIEDRN
C/C=C/c1ccc(NCc2cc(C#N)ccc2OC)cc1	ZINC000583287663	329434221	/nfs/dbraw/zinc/43/42/21/329434221.db2.gz	QMQCGCDKAVPSAH-ONEGZZNKSA-N	0	0	278.355	4.212	20	30		CIEDRN
CCC(CC)C(=O)Nc1ccccc1S[C@@H](C)CC#N	ZINC000193055115	329438467	/nfs/dbraw/zinc/43/84/67/329438467.db2.gz	PEPFOHHJLHVSBE-LBPRGKRZSA-N	0	0	290.432	4.456	20	30		CIEDRN
N#CCc1ccc(CSc2ccc(N)cc2Cl)cc1	ZINC000398993734	329447141	/nfs/dbraw/zinc/44/71/41/329447141.db2.gz	NOKZPRBWRJOPLA-UHFFFAOYSA-N	0	0	288.803	4.281	20	30		CIEDRN
N#Cc1cnccc1Sc1cc(Cl)ccc1Cl	ZINC000399408027	329452667	/nfs/dbraw/zinc/45/26/67/329452667.db2.gz	YLAKSRISBFOSSZ-UHFFFAOYSA-N	0	0	281.167	4.411	20	30		CIEDRN
CC(C)(C#N)CC[S@](=O)c1ccc(-c2ccccc2)cc1	ZINC000583740104	329471590	/nfs/dbraw/zinc/47/15/90/329471590.db2.gz	TVCWRBJPFYMMMB-NRFANRHFSA-N	0	0	297.423	4.401	20	30		CIEDRN
Cc1cccc(C)c1C(=O)N(C)[C@H](C)c1cccc(C#N)c1	ZINC000425633717	329575082	/nfs/dbraw/zinc/57/50/82/329575082.db2.gz	FZPRQERPGYEIBN-OAHLLOKOSA-N	0	0	292.382	4.008	20	30		CIEDRN
CCc1nnc([C@H](C)S[C@H](C)c2ccc(C#N)cc2)o1	ZINC000125636739	329585434	/nfs/dbraw/zinc/58/54/34/329585434.db2.gz	PAPDCXKDUOGJLE-MNOVXSKESA-N	0	0	287.388	4.059	20	30		CIEDRN
C[C@H](c1cccc(C#N)c1)N(C)C(=O)[C@@H]1CCCCC1(C)C	ZINC000425111750	329596148	/nfs/dbraw/zinc/59/61/48/329596148.db2.gz	OSXOMKWXANWRDT-PBHICJAKSA-N	0	0	298.430	4.294	20	30		CIEDRN
C[C@@H](c1cccc(C#N)c1)N(C)C(=O)CCC1CCCC1	ZINC000425122641	329598212	/nfs/dbraw/zinc/59/82/12/329598212.db2.gz	DBLTUBWEBNCTNB-AWEZNQCLSA-N	0	0	284.403	4.048	20	30		CIEDRN
Cc1ccc(C(=O)N(C)[C@H](C)c2cccc(C#N)c2)cc1C	ZINC000425123029	329598289	/nfs/dbraw/zinc/59/82/89/329598289.db2.gz	DCNARVIGLBYYDO-OAHLLOKOSA-N	0	0	292.382	4.008	20	30		CIEDRN
C[C@H](CC1CCCC1)C(=O)N(C)[C@H](C)c1cccc(C#N)c1	ZINC000425132322	329604046	/nfs/dbraw/zinc/60/40/46/329604046.db2.gz	QYASOAHTSMFSOO-HUUCEWRRSA-N	0	0	298.430	4.294	20	30		CIEDRN
C[C@H](c1cccc(C#N)c1)N(C)C(=O)CC1CCCCC1	ZINC000425132787	329604160	/nfs/dbraw/zinc/60/41/60/329604160.db2.gz	ROHRNJPPANZFPG-CQSZACIVSA-N	0	0	284.403	4.048	20	30		CIEDRN
C=CCCCC(=O)N1CC(C)(C)C[C@@H]1c1ccccc1	ZINC000425127599	329605686	/nfs/dbraw/zinc/60/56/86/329605686.db2.gz	ZLDXBIAOPNEQHD-MRXNPFEDSA-N	0	0	271.404	4.343	20	30		CIEDRN
C=CCC[C@@H](C(=O)Nc1ccc(C)nc1)c1ccccc1	ZINC000188722365	329605840	/nfs/dbraw/zinc/60/58/40/329605840.db2.gz	LVXQGIWMYYAEPZ-QGZVFWFLSA-N	0	0	280.371	4.079	20	30		CIEDRN
C=CCC[C@H](C(=O)Nc1ccc(C)nc1)c1ccccc1	ZINC000188722347	329605843	/nfs/dbraw/zinc/60/58/43/329605843.db2.gz	LVXQGIWMYYAEPZ-KRWDZBQOSA-N	0	0	280.371	4.079	20	30		CIEDRN
CSCc1ccc(NCc2cccc(C#N)c2)cc1	ZINC000128997389	329613447	/nfs/dbraw/zinc/61/34/47/329613447.db2.gz	LJDDBGMTESPBDI-UHFFFAOYSA-N	0	0	268.385	4.033	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@@H]1CC[C@@H](c2cccc(F)c2)C1	ZINC000424814957	329615482	/nfs/dbraw/zinc/61/54/82/329615482.db2.gz	VHZSDTWVHDTAQY-GDBMZVCRSA-N	0	0	289.394	4.180	20	30		CIEDRN
C=CCCC(=O)N(CC)CCc1ccc(C(F)(F)F)cc1	ZINC000425163413	329617313	/nfs/dbraw/zinc/61/73/13/329617313.db2.gz	QYCYCFQIKAUTJQ-UHFFFAOYSA-N	0	0	299.336	4.063	20	30		CIEDRN
CSc1ccc(NCc2ccc(C#N)o2)cc1Cl	ZINC000129559728	329618660	/nfs/dbraw/zinc/61/86/60/329618660.db2.gz	KZAUFOBLOQJBQN-UHFFFAOYSA-N	0	0	278.764	4.139	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc(C)c(-c2ncco2)c1	ZINC000131224827	329633211	/nfs/dbraw/zinc/63/32/11/329633211.db2.gz	AGFVXWNADNDMPA-UHFFFAOYSA-N	0	0	296.370	4.357	20	30		CIEDRN
Cc1c(C#N)cccc1C(=O)N(C)c1cccc(C(C)C)c1	ZINC000509609730	332875213	/nfs/dbraw/zinc/87/52/13/332875213.db2.gz	RYNGWVYHBGNYMC-UHFFFAOYSA-N	0	0	292.382	4.267	20	30		CIEDRN
CCCc1noc(CSCCC2(C#N)CCCCC2)n1	ZINC000419390458	329721828	/nfs/dbraw/zinc/72/18/28/329721828.db2.gz	UWHRKJCIDMJPFZ-UHFFFAOYSA-N	0	0	293.436	4.119	20	30		CIEDRN
C=CCOCCSCc1csc(-c2ccc(C)o2)n1	ZINC000419391063	329721951	/nfs/dbraw/zinc/72/19/51/329721951.db2.gz	QQBDXENIPCQGNW-UHFFFAOYSA-N	0	0	295.429	4.147	20	30		CIEDRN
CC(C)(C)c1ccc(CSCc2ncc(C#N)cn2)cc1	ZINC000419398523	329723016	/nfs/dbraw/zinc/72/30/16/329723016.db2.gz	XFHQCYOMTKQHFU-UHFFFAOYSA-N	0	0	297.427	4.079	20	30		CIEDRN
Cc1ccccc1OCCCSCC1(C#N)CCC1	ZINC000419418180	329725380	/nfs/dbraw/zinc/72/53/80/329725380.db2.gz	QNPUETLIJKYDCR-UHFFFAOYSA-N	0	0	275.417	4.191	20	30		CIEDRN
C=CCOCCSCc1ccc(C(F)F)cc1	ZINC000419452987	329730509	/nfs/dbraw/zinc/73/05/09/329730509.db2.gz	QPYUZYFWLRARKI-UHFFFAOYSA-N	0	0	258.333	4.060	20	30		CIEDRN
CC(C)(C)OCCCCSCC1(C#N)CCC1	ZINC000419461449	329731551	/nfs/dbraw/zinc/73/15/51/329731551.db2.gz	HZUTVXDGKOLBJM-UHFFFAOYSA-N	0	0	255.427	4.009	20	30		CIEDRN
N#CC1(CSCCCc2ccsc2)CCC1	ZINC000419461517	329731700	/nfs/dbraw/zinc/73/17/00/329731700.db2.gz	KZOAIHGTJPOAHR-UHFFFAOYSA-N	0	0	251.420	4.108	20	30		CIEDRN
CC(C)OC1CC(S[C@H](C)c2cccc(C#N)c2)C1	ZINC000419463875	329732067	/nfs/dbraw/zinc/73/20/67/329732067.db2.gz	LWWBWKMQXYAKOQ-UWTIGNOOSA-N	0	0	275.417	4.308	20	30		CIEDRN
COC1(CCSCCCC(C)(C)C#N)CCC1	ZINC000419497740	329732401	/nfs/dbraw/zinc/73/24/01/329732401.db2.gz	XREMIBMHZKGQBB-UHFFFAOYSA-N	0	0	255.427	4.009	20	30		CIEDRN
N#CC1(CSCc2ccc(C(F)(F)F)cn2)CCC1	ZINC000419508389	329733827	/nfs/dbraw/zinc/73/38/27/329733827.db2.gz	ZNSXWKIQBGJZTJ-UHFFFAOYSA-N	0	0	286.322	4.027	20	30		CIEDRN
CC(C)(C#N)CCSCC1CCC(F)(F)CC1	ZINC000419482203	329736276	/nfs/dbraw/zinc/73/62/76/329736276.db2.gz	XLPOHLOZINZHTI-UHFFFAOYSA-N	0	0	261.381	4.485	20	30		CIEDRN
CO[C@@H](CSCCCC(C)(C)C#N)CC(C)C	ZINC000419625396	329740645	/nfs/dbraw/zinc/74/06/45/329740645.db2.gz	HIVXWFNRTAJQGA-CYBMUJFWSA-N	0	0	257.443	4.111	20	30		CIEDRN
Cc1ccc2ncc(CSCC3(C#N)CCC3)cc2c1	ZINC000419581364	329741374	/nfs/dbraw/zinc/74/13/74/329741374.db2.gz	LSZZVCBQIRKBAW-UHFFFAOYSA-N	0	0	282.412	4.470	20	30		CIEDRN
C[C@H](SCC1(C#N)CCC1)c1cccc([N+](=O)[O-])c1	ZINC000419591201	329741723	/nfs/dbraw/zinc/74/17/23/329741723.db2.gz	XHUWFFPXZQNMSP-NSHDSACASA-N	0	0	276.361	4.083	20	30		CIEDRN
CO[C@H](CSCc1ccc(CC#N)cc1)CC(C)C	ZINC000419634638	329742865	/nfs/dbraw/zinc/74/28/65/329742865.db2.gz	QVJPPQDHKWQPOE-INIZCTEOSA-N	0	0	277.433	4.047	20	30		CIEDRN
COc1cc(CSCCC2(C#N)CCCCC2)ccn1	ZINC000419648263	329743492	/nfs/dbraw/zinc/74/34/92/329743492.db2.gz	RIMNFKFVZUJBLT-UHFFFAOYSA-N	0	0	290.432	4.188	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H]2C[C@]2(F)c2ccccc2)n1	ZINC000420499564	329770282	/nfs/dbraw/zinc/77/02/82/329770282.db2.gz	CZGUKDSTNHHXTL-GUYCJALGSA-N	0	0	286.350	4.276	20	30		CIEDRN
C=C(C)[C@H]1OCCC[C@H]1c1nc([C@H]2CCCC[C@@H]2C)no1	ZINC000420501482	329770679	/nfs/dbraw/zinc/77/06/79/329770679.db2.gz	HMMCYSUVLSKLJC-BYNSBNAKSA-N	0	0	290.407	4.202	20	30		CIEDRN
CC(C)Sc1ccc([C@H](C)Nc2cncc(C#N)n2)cc1	ZINC000420587870	329778263	/nfs/dbraw/zinc/77/82/63/329778263.db2.gz	RDLXFXUTDSKKBL-LBPRGKRZSA-N	0	0	298.415	4.022	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N[C@@H](CC(F)F)c1ccccc1	ZINC000420873348	329785472	/nfs/dbraw/zinc/78/54/72/329785472.db2.gz	XJOMJDQQNILBPA-KBPBESRZSA-N	0	0	296.361	4.037	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N[C@@H](CC(F)F)c1ccccc1	ZINC000420873350	329785593	/nfs/dbraw/zinc/78/55/93/329785593.db2.gz	XJOMJDQQNILBPA-KGLIPLIRSA-N	0	0	296.361	4.037	20	30		CIEDRN
CC(C)c1ccc(NC(=O)NCc2ccc(C#N)s2)cc1	ZINC000421032065	329802842	/nfs/dbraw/zinc/80/28/42/329802842.db2.gz	GTRJAQSXZXUUFC-UHFFFAOYSA-N	0	0	299.399	4.065	20	30		CIEDRN
CC(C)c1cccc(NC(=O)NCc2ccc(C#N)s2)c1	ZINC000421043075	329803183	/nfs/dbraw/zinc/80/31/83/329803183.db2.gz	PTRNYGDKHFLPIK-UHFFFAOYSA-N	0	0	299.399	4.065	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)N[C@H]2CCC(C)(C)C2)cc1	ZINC000509729873	332880562	/nfs/dbraw/zinc/88/05/62/332880562.db2.gz	QPANEYWYTHVUMN-HNNXBMFYSA-N	0	0	299.418	4.188	20	30		CIEDRN
C=C[C@H](CC(=O)N1CC[C@@H](C2CCCC2)C1)c1ccccc1	ZINC000421644924	329861493	/nfs/dbraw/zinc/86/14/93/329861493.db2.gz	GFBSRGLNYMKSCV-VQIMIIECSA-N	0	0	297.442	4.385	20	30		CIEDRN
CC(C)[C@H]1CC[C@H](C(=O)N[C@H](C)c2ccc(C#N)cc2)CC1	ZINC000509834583	332883447	/nfs/dbraw/zinc/88/34/47/332883447.db2.gz	KFVGJUJGIQDMTE-QGPMSJSTSA-N	0	0	298.430	4.198	20	30		CIEDRN
Cc1csc(NC(=O)N2Cc3ccccc3[C@H]2C)c1C#N	ZINC000571894406	329928554	/nfs/dbraw/zinc/92/85/54/329928554.db2.gz	WMLLGVGWUVWUGU-LLVKDONJSA-N	0	0	297.383	4.037	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1sc2cc(F)ccc2c1C	ZINC000509974766	332887402	/nfs/dbraw/zinc/88/74/02/332887402.db2.gz	ZDJWHLFKXLRMEB-LBPRGKRZSA-N	0	0	291.391	4.433	20	30		CIEDRN
C=CCN(C(=O)c1ccc(-c2ccc(CC)cc2)o1)C1CC1	ZINC000536814736	329932983	/nfs/dbraw/zinc/93/29/83/329932983.db2.gz	KRKCBVNFQIVFGE-UHFFFAOYSA-N	0	0	295.382	4.300	20	30		CIEDRN
C=CCCCCCN(C)C(=O)CCc1ccc(C)s1	ZINC000572294360	329973012	/nfs/dbraw/zinc/97/30/12/329973012.db2.gz	LCZNCXHUUYXBAA-UHFFFAOYSA-N	0	0	279.449	4.194	20	30		CIEDRN
C=CCCC(=O)N(C)[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000263647008	330060323	/nfs/dbraw/zinc/06/03/23/330060323.db2.gz	FQHBQDHVCAUKFI-NSHDSACASA-N	0	0	285.309	4.191	20	30		CIEDRN
C=CCCC(=O)N(CC)[C@@H](C)c1cc2ccccc2o1	ZINC000264009067	330060965	/nfs/dbraw/zinc/06/09/65/330060965.db2.gz	UVBKDSWYYJTECL-ZDUSSCGKSA-N	0	0	271.360	4.309	20	30		CIEDRN
C=CCCO[C@@H](C)c1nc(-c2cccc(Cl)c2)no1	ZINC000264668939	330061735	/nfs/dbraw/zinc/06/17/35/330061735.db2.gz	WISKZWLODFJBRT-JTQLQIEISA-N	0	0	278.739	4.044	20	30		CIEDRN
C=C1CCN([C@@H](C)c2ncc(-c3ccccc3)o2)CC1	ZINC000266049955	330063514	/nfs/dbraw/zinc/06/35/14/330063514.db2.gz	VFOYBFDPMCSXEB-AWEZNQCLSA-N	0	0	268.360	4.055	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@H](c2ccccc2C)C1	ZINC000268144013	330065293	/nfs/dbraw/zinc/06/52/93/330065293.db2.gz	CWDSFAASLAILNX-KRWDZBQOSA-N	0	0	283.415	4.079	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@@H](c2ccccc2C)C1	ZINC000268144017	330065317	/nfs/dbraw/zinc/06/53/17/330065317.db2.gz	CWDSFAASLAILNX-QGZVFWFLSA-N	0	0	283.415	4.079	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(Cc1cccs1)C1CC1	ZINC000268145630	330065319	/nfs/dbraw/zinc/06/53/19/330065319.db2.gz	JGKIULPWEWDGND-UHFFFAOYSA-N	0	0	275.417	4.008	20	30		CIEDRN
C=CCCCC(=O)N(C(C)C)[C@H](C)c1ccsc1	ZINC000421693793	330067596	/nfs/dbraw/zinc/06/75/96/330067596.db2.gz	SSBDTCWOOWBPCV-CYBMUJFWSA-N	0	0	265.422	4.402	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](CC(F)F)c1ccccc1	ZINC000421698105	330068472	/nfs/dbraw/zinc/06/84/72/330068472.db2.gz	HXMMZBWRSKHCHH-JSGCOSHPSA-N	0	0	281.346	4.101	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](CC(F)F)c1ccccc1	ZINC000421698104	330068488	/nfs/dbraw/zinc/06/84/88/330068488.db2.gz	HXMMZBWRSKHCHH-GXTWGEPZSA-N	0	0	281.346	4.101	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](c2ccccc2)C1(C)C	ZINC000421723589	330074545	/nfs/dbraw/zinc/07/45/45/330074545.db2.gz	WGFBLXKVZOKHDO-DOTOQJQBSA-N	0	0	285.431	4.383	20	30		CIEDRN
C#CCCCNc1ccc(CCC(F)(F)F)cc1	ZINC000270948961	330077447	/nfs/dbraw/zinc/07/74/47/330077447.db2.gz	UWRUCZQDOCOZOQ-UHFFFAOYSA-N	0	0	255.283	4.007	20	30		CIEDRN
C=C(C)[C@H](CC(=O)Nc1cc(SC)ccc1C)OCC	ZINC000271835775	330082599	/nfs/dbraw/zinc/08/25/99/330082599.db2.gz	HQUKCGVMWGNTNX-HNNXBMFYSA-N	0	0	293.432	4.027	20	30		CIEDRN
C[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccncc1Cl	ZINC000421833838	330091397	/nfs/dbraw/zinc/09/13/97/330091397.db2.gz	JNYCRNSOJHGWPB-GUYCJALGSA-N	0	0	299.805	4.431	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@H](C)CC1CCCC1	ZINC000510138622	332894379	/nfs/dbraw/zinc/89/43/79/332894379.db2.gz	FPTMEBZBIJZGKI-CQSZACIVSA-N	0	0	291.460	4.479	20	30		CIEDRN
CC#CCCCC(=O)N1CCC(=Cc2ccccc2F)CC1	ZINC000274376606	330105495	/nfs/dbraw/zinc/10/54/95/330105495.db2.gz	XSVIQUAZWGSNSJ-UHFFFAOYSA-N	0	0	299.389	4.025	20	30		CIEDRN
C=C(C)CCSc1nnc(C2CC2)n1Cc1ccccc1	ZINC000274715352	330107838	/nfs/dbraw/zinc/10/78/38/330107838.db2.gz	GBZODKNUMJPZQR-UHFFFAOYSA-N	0	0	299.443	4.262	20	30		CIEDRN
C=CCN(C)C(=O)Nc1cc(C(F)(F)F)ccc1Cl	ZINC000275250720	330109361	/nfs/dbraw/zinc/10/93/61/330109361.db2.gz	YXBTUQBZUWPEBJ-UHFFFAOYSA-N	0	0	292.688	4.009	20	30		CIEDRN
C=CCCN(C)C(=O)N[C@@H](CC)c1ccc(Cl)s1	ZINC000276118671	330112022	/nfs/dbraw/zinc/11/20/22/330112022.db2.gz	FXTBHSYCEPBBEQ-JTQLQIEISA-N	0	0	286.828	4.070	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(Cc2cccc3cccnc32)no1	ZINC000276207874	330112839	/nfs/dbraw/zinc/11/28/39/330112839.db2.gz	OPOQAQXEKGMSCL-SFHVURJKSA-N	0	0	293.370	4.062	20	30		CIEDRN
C=CCN(C)C(=O)Nc1c(CCC)cccc1C(C)C	ZINC000276400664	330113339	/nfs/dbraw/zinc/11/33/39/330113339.db2.gz	GKDXENMMUGPJMD-UHFFFAOYSA-N	0	0	274.408	4.412	20	30		CIEDRN
Cc1cccc(NCc2cccc(OCCCC#N)c2)c1	ZINC000080191452	330113837	/nfs/dbraw/zinc/11/38/37/330113837.db2.gz	NVVCNCLWFFBYHQ-UHFFFAOYSA-N	0	0	280.371	4.290	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@H](c3ccccc3C)C2)CCC1	ZINC000276548309	330114033	/nfs/dbraw/zinc/11/40/33/330114033.db2.gz	ABEQWMNNXWMXPH-INIZCTEOSA-N	0	0	283.415	4.057	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NCc1nnc(C)s1	ZINC000276575089	330114085	/nfs/dbraw/zinc/11/40/85/330114085.db2.gz	OLVJZKUGCDVHRB-UHFFFAOYSA-N	0	0	287.432	4.311	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@@H](c3ccccc3C)C2)CCC1	ZINC000276548313	330114350	/nfs/dbraw/zinc/11/43/50/330114350.db2.gz	ABEQWMNNXWMXPH-MRXNPFEDSA-N	0	0	283.415	4.057	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCCS1	ZINC000276510068	330114354	/nfs/dbraw/zinc/11/43/54/330114354.db2.gz	ZCZUTXVVQLHXON-OAHLLOKOSA-N	0	0	289.444	4.373	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)CCCC(C)=O	ZINC000276690205	330114391	/nfs/dbraw/zinc/11/43/91/330114391.db2.gz	XSQLLHOTQDJENR-UHFFFAOYSA-N	0	0	287.403	4.236	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)Cc1cccnc1C	ZINC000162791087	330115078	/nfs/dbraw/zinc/11/50/78/330115078.db2.gz	RENPQQZQMOVSKJ-UHFFFAOYSA-N	0	0	292.835	4.293	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CCC(c2ccsc2)CC1	ZINC000276912608	330115170	/nfs/dbraw/zinc/11/51/70/330115170.db2.gz	KYUOENLKGUHOOD-MRXNPFEDSA-N	0	0	277.433	4.056	20	30		CIEDRN
C=CCCCCNC(=O)c1c(Cl)cc(F)cc1Cl	ZINC000277568513	330116572	/nfs/dbraw/zinc/11/65/72/330116572.db2.gz	AUZDEQSYKMJOFH-UHFFFAOYSA-N	0	0	290.165	4.219	20	30		CIEDRN
COc1cc(C)c(OCCCC(C)(C)C#N)c(C)c1	ZINC000424097298	330227731	/nfs/dbraw/zinc/22/77/31/330227731.db2.gz	AFCQLEUROPEQQM-UHFFFAOYSA-N	0	0	261.365	4.021	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1ccc2ccn(C)c2c1	ZINC000527199692	330235895	/nfs/dbraw/zinc/23/58/95/330235895.db2.gz	GRPRTGCPAXFATK-CYBMUJFWSA-N	0	0	285.391	4.045	20	30		CIEDRN
CC(C)(C#N)CCSCc1ccc(-c2ccccn2)nc1	ZINC000424117202	330243705	/nfs/dbraw/zinc/24/37/05/330243705.db2.gz	BGPMMQUMAAWFKB-UHFFFAOYSA-N	0	0	297.427	4.317	20	30		CIEDRN
C=CCCCSCc1ccc(-c2ccccn2)nc1	ZINC000424120635	330249370	/nfs/dbraw/zinc/24/93/70/330249370.db2.gz	HMQKBTWBDTZBNC-UHFFFAOYSA-N	0	0	270.401	4.343	20	30		CIEDRN
C[C@@H]1C[C@H]1c1ccc(CNc2cccc(F)c2C#N)o1	ZINC000036138634	330249753	/nfs/dbraw/zinc/24/97/53/330249753.db2.gz	HOTUITBZPUMGBS-ZYHUDNBSSA-N	0	0	270.307	4.026	20	30		CIEDRN
N#CC1(CSCc2ccc(-c3ccccn3)nc2)CCC1	ZINC000424130372	330259809	/nfs/dbraw/zinc/25/98/09/330259809.db2.gz	ZFCUQYHEYBWHQC-UHFFFAOYSA-N	0	0	295.411	4.071	20	30		CIEDRN
C=CCCOc1ccccc1-c1cc(C(F)(F)F)nn1C	ZINC000527588582	330264509	/nfs/dbraw/zinc/26/45/09/330264509.db2.gz	LQPGOCRJGWBPQR-UHFFFAOYSA-N	0	0	296.292	4.061	20	30		CIEDRN
C=CCC[C@H](C)Nc1cccc(C2CCOCC2)c1	ZINC000527993238	330299264	/nfs/dbraw/zinc/29/92/64/330299264.db2.gz	DIYUZPQKFQLJKF-AWEZNQCLSA-N	0	0	259.393	4.347	20	30		CIEDRN
CCC(C#N)(CC)c1nc([C@@H]2CCCc3ccccc32)no1	ZINC000528088510	330307435	/nfs/dbraw/zinc/30/74/35/330307435.db2.gz	BWVTULBCLLCGPF-OAHLLOKOSA-N	0	0	295.386	4.119	20	30		CIEDRN
CCN(C(=O)[C@H]1CCCC12CC2)[C@H](C)c1ccc(C#N)cc1	ZINC000528152290	330309826	/nfs/dbraw/zinc/30/98/26/330309826.db2.gz	FAKTVCWPXGAPQX-RHSMWYFYSA-N	0	0	296.414	4.048	20	30		CIEDRN
CCC(C#N)(CC)c1nc(C(C)(C)Cc2ccccc2)no1	ZINC000528182813	330314164	/nfs/dbraw/zinc/31/41/64/330314164.db2.gz	LANLFYQREQNHFD-UHFFFAOYSA-N	0	0	297.402	4.171	20	30		CIEDRN
CC[C@](C)(C#N)c1nc(-c2ccccc2CC(C)C)no1	ZINC000528226036	330315959	/nfs/dbraw/zinc/31/59/59/330315959.db2.gz	XYRWHEFKNHLLBM-QGZVFWFLSA-N	0	0	283.375	4.126	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)CCc1ccc(Cl)c(Cl)c1	ZINC000116853718	330322598	/nfs/dbraw/zinc/32/25/98/330322598.db2.gz	QOZWSNSRVDKRPX-SNVBAGLBSA-N	0	0	286.202	4.007	20	30		CIEDRN
C=CC[C@H](C)NC(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1Cl	ZINC000116857131	330322879	/nfs/dbraw/zinc/32/28/79/330322879.db2.gz	YZXDXBAVSGRQOM-MVWJERBFSA-N	0	0	298.213	4.178	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)c1oc2c(cccc2Cl)c1C	ZINC000116858138	330323407	/nfs/dbraw/zinc/32/34/07/330323407.db2.gz	FFDDZTMMSNYLHS-SECBINFHSA-N	0	0	277.751	4.089	20	30		CIEDRN
Cc1ccc(CN(CC#N)[C@@H]2CCc3ccccc32)cc1	ZINC000533028370	330324897	/nfs/dbraw/zinc/32/48/97/330324897.db2.gz	YZVDCNNQEDHMJN-LJQANCHMSA-N	0	0	276.383	4.008	20	30		CIEDRN
C[C@H](Cc1ccsc1)Nc1c(C#N)cnc2ccccc21	ZINC000044386600	330327914	/nfs/dbraw/zinc/32/79/14/330327914.db2.gz	NSQYGHQCFAKBND-GFCCVEGCSA-N	0	0	293.395	4.211	20	30		CIEDRN
C[C@H](NCc1ccc(C#N)cc1)c1nc(C(C)(C)C)cs1	ZINC000106476655	330338580	/nfs/dbraw/zinc/33/85/80/330338580.db2.gz	NVIWTCWLSJTASA-LBPRGKRZSA-N	0	0	299.443	4.163	20	30		CIEDRN
C=CCOc1ccccc1C(=O)Nc1cccc(C)c1C	ZINC000045158036	330338911	/nfs/dbraw/zinc/33/89/11/330338911.db2.gz	LMWSGKQNMTXAQB-UHFFFAOYSA-N	0	0	281.355	4.121	20	30		CIEDRN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)CC1=CCCCC1	ZINC000106611323	330340846	/nfs/dbraw/zinc/34/08/46/330340846.db2.gz	CHJKQSWJLFWFCW-UHFFFAOYSA-N	0	0	296.414	4.186	20	30		CIEDRN
CCN(C(=O)CC1=CCCCC1)[C@H](C)c1ccc(C#N)cc1	ZINC000106611380	330340860	/nfs/dbraw/zinc/34/08/60/330340860.db2.gz	TZNHATGZRKGVNM-OAHLLOKOSA-N	0	0	296.414	4.358	20	30		CIEDRN
C=C[C@@H]1OCCC[C@H]1c1nc([C@H]2CCCC(C)(C)C2)no1	ZINC000424361362	330346940	/nfs/dbraw/zinc/34/69/40/330346940.db2.gz	LJAPAPYKCSKJKN-MJBXVCDLSA-N	0	0	290.407	4.202	20	30		CIEDRN
C[C@H](Cc1ccccc1)C(=O)Nc1ccc(C#N)cc1Cl	ZINC000580492976	330348971	/nfs/dbraw/zinc/34/89/71/330348971.db2.gz	ZYJRKNIYCKUZMC-GFCCVEGCSA-N	0	0	298.773	4.029	20	30		CIEDRN
CCC[C@@H](C)C(=O)Nc1ccccc1SC[C@H](C)C#N	ZINC000108238141	330353326	/nfs/dbraw/zinc/35/33/26/330353326.db2.gz	WINKFUMOMQWAQU-CHWSQXEVSA-N	0	0	290.432	4.313	20	30		CIEDRN
C=CCC[C@@H](NC(=O)c1ccccc1OC)c1ccccc1	ZINC000533261150	330355781	/nfs/dbraw/zinc/35/57/81/330355781.db2.gz	MYCYBCONWFAXMV-QGZVFWFLSA-N	0	0	295.382	4.133	20	30		CIEDRN
C=C(CC)CNc1ccccc1OCC(F)(F)F	ZINC000536881752	330360781	/nfs/dbraw/zinc/36/07/81/330360781.db2.gz	MHYSSJSANKFZDB-UHFFFAOYSA-N	0	0	259.271	4.006	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N1CCC[C@@H]1c1ccccc1Cl	ZINC000116974387	330362832	/nfs/dbraw/zinc/36/28/32/330362832.db2.gz	MFHHMOHBJDCXDO-IUODEOHRSA-N	0	0	292.810	4.151	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N1CCC[C@H]1c1ccccc1Cl	ZINC000116974389	330362902	/nfs/dbraw/zinc/36/29/02/330362902.db2.gz	MFHHMOHBJDCXDO-WFASDCNBSA-N	0	0	292.810	4.151	20	30		CIEDRN
C=CCCC(=O)N1CCCCC[C@H]1c1cccc(C)c1	ZINC000117730456	330366532	/nfs/dbraw/zinc/36/65/32/330366532.db2.gz	SCIPSXOJGZSMBX-KRWDZBQOSA-N	0	0	271.404	4.405	20	30		CIEDRN
C=CCCCSCC(=O)Nc1cc(Cl)ccc1C	ZINC000117944959	330366616	/nfs/dbraw/zinc/36/66/16/330366616.db2.gz	WNFYFWWCRXNIKS-UHFFFAOYSA-N	0	0	283.824	4.286	20	30		CIEDRN
C[C@@H](SCc1ccc(C#N)cc1)c1ccc(C#N)cc1	ZINC000118446111	330367238	/nfs/dbraw/zinc/36/72/38/330367238.db2.gz	FFFJKVPNVDRRKI-CYBMUJFWSA-N	0	0	278.380	4.424	20	30		CIEDRN
CC[C@@H]1c2ccsc2CCN1Cc1ccc(C#N)s1	ZINC000119133073	330371197	/nfs/dbraw/zinc/37/11/97/330371197.db2.gz	JUYRKUZHZOFXSA-CQSZACIVSA-N	0	0	288.441	4.191	20	30		CIEDRN
CC(C)([NH2+]Cc1ccc(C#N)cc1)c1cccc(Cl)c1	ZINC000119381534	330374028	/nfs/dbraw/zinc/37/40/28/330374028.db2.gz	AJNKSTSWDCPKKN-UHFFFAOYSA-N	0	0	284.790	4.237	20	30		CIEDRN
COc1ccccc1-c1nc(-c2ccc(C#N)cc2)cs1	ZINC000057382587	330374627	/nfs/dbraw/zinc/37/46/27/330374627.db2.gz	JLKDPRULSOCXBF-UHFFFAOYSA-N	0	0	292.363	4.357	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@@H](C)c1ccc(OC(C)C)cc1	ZINC000424561333	330376135	/nfs/dbraw/zinc/37/61/35/330376135.db2.gz	BETMKJYKJOUWLR-AWEZNQCLSA-N	0	0	289.419	4.253	20	30		CIEDRN
N#Cc1c(F)cccc1Sc1ccc(F)cc1F	ZINC000057680761	330378260	/nfs/dbraw/zinc/37/82/60/330378260.db2.gz	OQRZTDJVVZZESQ-UHFFFAOYSA-N	0	0	265.259	4.127	20	30		CIEDRN
C[C@H](Cc1ccccc1F)Nc1c(F)cc(C#N)cc1F	ZINC000303060965	332903510	/nfs/dbraw/zinc/90/35/10/332903510.db2.gz	YFVIENBMACPBPM-SNVBAGLBSA-N	0	0	290.288	4.019	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1ccc(Cl)cc1C	ZINC000424573537	330384775	/nfs/dbraw/zinc/38/47/75/330384775.db2.gz	YGPZSBYMHAZOCN-UHFFFAOYSA-N	0	0	251.757	4.189	20	30		CIEDRN
C=CCc1ccc(OCc2ccc(Cl)cn2)c(OC)c1	ZINC000120146181	330385767	/nfs/dbraw/zinc/38/57/67/330385767.db2.gz	AYPXUYYQFRCCCA-UHFFFAOYSA-N	0	0	289.762	4.051	20	30		CIEDRN
C=C(C)COc1ccc(N(C)C(=O)c2ccc(C)cc2)cc1	ZINC000120217671	330386308	/nfs/dbraw/zinc/38/63/08/330386308.db2.gz	BNZCAIJFGYBAGB-UHFFFAOYSA-N	0	0	295.382	4.227	20	30		CIEDRN
CCCc1cc(C(=O)N(C)c2cccc(C#N)c2)sc1C	ZINC000120590534	330390480	/nfs/dbraw/zinc/39/04/80/330390480.db2.gz	NXBHSXPOGAZNOY-UHFFFAOYSA-N	0	0	298.411	4.157	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@H](C)c1cccc(OC(F)F)c1	ZINC000424591875	330394155	/nfs/dbraw/zinc/39/41/55/330394155.db2.gz	OJAAKQQUUQKQAI-LLVKDONJSA-N	0	0	297.345	4.068	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccccc1N1CCCCC1	ZINC000121007627	330394787	/nfs/dbraw/zinc/39/47/87/330394787.db2.gz	BRVHBGLCMMKSDC-UHFFFAOYSA-N	0	0	298.430	4.384	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1cc(C#N)ccc1C)c1ccccc1	ZINC000121230331	330398013	/nfs/dbraw/zinc/39/80/13/330398013.db2.gz	FGCXFCOOQRTEIX-MRXNPFEDSA-N	0	0	290.366	4.165	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)NCCc1csc2ccccc12	ZINC000424599085	330399582	/nfs/dbraw/zinc/39/95/82/330399582.db2.gz	IYBXMGAMFLUHIT-UHFFFAOYSA-N	0	0	287.428	4.162	20	30		CIEDRN
C=CCCOCCCCC(=O)N[C@@H]1CCC[C@@H](C(C)C)C1	ZINC000537190331	330413436	/nfs/dbraw/zinc/41/34/36/330413436.db2.gz	CGOQFXJFLPQDGH-IAGOWNOFSA-N	0	0	295.467	4.080	20	30		CIEDRN
Cc1cc(N[C@@H](C)c2cccc(C#N)c2)ccc1F	ZINC000061116976	330428749	/nfs/dbraw/zinc/42/87/49/330428749.db2.gz	FCJSZDGDCCFPIK-LBPRGKRZSA-N	0	0	254.308	4.179	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)C[C@H](C)c1ccc(F)cc1	ZINC000537224225	330429418	/nfs/dbraw/zinc/42/94/18/330429418.db2.gz	JQMNYOWZUVEVIP-KBPBESRZSA-N	0	0	277.383	4.180	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)C[C@H]1CCc2ccccc2C1	ZINC000537226744	330429430	/nfs/dbraw/zinc/42/94/30/330429430.db2.gz	VRMOTZRXSNCPCG-CVEARBPZSA-N	0	0	285.431	4.043	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)CC[C@@H](C)c1ccccc1	ZINC000537224155	330429484	/nfs/dbraw/zinc/42/94/84/330429484.db2.gz	IDSTXPCFZBRVFQ-CVEARBPZSA-N	0	0	273.420	4.431	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)CC(C)(C)c1ccccc1	ZINC000537239951	330430243	/nfs/dbraw/zinc/43/02/43/330430243.db2.gz	VBZUCSSNJNCTPY-HNNXBMFYSA-N	0	0	273.420	4.215	20	30		CIEDRN
CCOCc1ccc(N[C@@H](C)c2cccc(C#N)c2)cc1	ZINC000537450901	330437355	/nfs/dbraw/zinc/43/73/55/330437355.db2.gz	VCIZSGCYJRNLBZ-AWEZNQCLSA-N	0	0	280.371	4.268	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)[C@H]2CCC[C@H](F)C2)c1	ZINC000424638365	330438075	/nfs/dbraw/zinc/43/80/75/330438075.db2.gz	JZLDQGIMNTXUGK-KBPBESRZSA-N	0	0	291.366	4.108	20	30		CIEDRN
Cc1cccc2c(C(=O)N(CCC#N)CCC(C)C)coc21	ZINC000424639151	330438256	/nfs/dbraw/zinc/43/82/56/330438256.db2.gz	GGFKYBCEQDDUCB-UHFFFAOYSA-N	0	0	298.386	4.143	20	30		CIEDRN
C=C(C)COc1cccc(NCc2ccccc2[N+](=O)[O-])c1	ZINC000537720677	330457207	/nfs/dbraw/zinc/45/72/07/330457207.db2.gz	OUTFEMMSVVLRFK-UHFFFAOYSA-N	0	0	298.342	4.162	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CC[C@H](C)C2(CCC2)C1)c1ccccc1	ZINC000537823013	330458334	/nfs/dbraw/zinc/45/83/34/330458334.db2.gz	HRNPAVOSMUSYOB-IRXDYDNUSA-N	0	0	297.442	4.385	20	30		CIEDRN
C=CC[C@H](C)NC(=O)c1ccc(-c2ccc(C)o2)s1	ZINC000514203722	330461597	/nfs/dbraw/zinc/46/15/97/330461597.db2.gz	LHFSKMZSEDUZDQ-JTQLQIEISA-N	0	0	275.373	4.011	20	30		CIEDRN
CCOC1CC(CCNc2cccc(C(F)F)c2C#N)C1	ZINC000514799710	330465532	/nfs/dbraw/zinc/46/55/32/330465532.db2.gz	ZSLZHWKUVHXHGW-UHFFFAOYSA-N	0	0	294.345	4.113	20	30		CIEDRN
N#Cc1ccc(NCC2(c3ccccc3)CCC2)cc1	ZINC000514909377	330467523	/nfs/dbraw/zinc/46/75/23/330467523.db2.gz	HPYRPEOUIRBDQX-UHFFFAOYSA-N	0	0	262.356	4.092	20	30		CIEDRN
N#Cc1cccc(NC(c2ccccc2)c2ccccc2)n1	ZINC000315448227	330476284	/nfs/dbraw/zinc/47/62/84/330476284.db2.gz	RZNDQGMRSBQRQM-UHFFFAOYSA-N	0	0	285.350	4.155	20	30		CIEDRN
N#Cc1ccc(N2CCC[C@@H]2C2CCCCC2)c([N+](=O)[O-])c1	ZINC000515555219	330479696	/nfs/dbraw/zinc/47/96/96/330479696.db2.gz	URCWQCQHIOEMLE-OAHLLOKOSA-N	0	0	299.374	4.016	20	30		CIEDRN
CC(C)[C@H]1CCCN1c1ccc(C#N)c(C(F)(F)F)c1	ZINC000083662323	330481570	/nfs/dbraw/zinc/48/15/70/330481570.db2.gz	LESMTCJCXANOAR-CQSZACIVSA-N	0	0	282.309	4.202	20	30		CIEDRN
C=CCC(C)(C)c1nc(-c2ccc(F)c(C)c2)no1	ZINC000426401643	330506986	/nfs/dbraw/zinc/50/69/86/330506986.db2.gz	ALOORKIJZDAMJY-UHFFFAOYSA-N	0	0	260.312	4.038	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)CC1(C)CC1	ZINC000428345255	330519993	/nfs/dbraw/zinc/51/99/93/330519993.db2.gz	LEZFKLUUKZTTER-UHFFFAOYSA-N	0	0	283.824	4.106	20	30		CIEDRN
C=CCN(C)C(=O)Nc1ccc(C)c(OCCC(C)C)c1	ZINC000429417491	330545880	/nfs/dbraw/zinc/54/58/80/330545880.db2.gz	LEVUWUFHUVNJRO-UHFFFAOYSA-N	0	0	290.407	4.070	20	30		CIEDRN
C=CCN(C)C(=O)Nc1ccc(OC2CCCCC2)cc1	ZINC000429422656	330546118	/nfs/dbraw/zinc/54/61/18/330546118.db2.gz	HTQHXOXXNJXMPA-UHFFFAOYSA-N	0	0	288.391	4.048	20	30		CIEDRN
C=CCC(C)(C)C(=O)N(C)Cc1ccc2ccccc2c1	ZINC000429931119	330556592	/nfs/dbraw/zinc/55/65/92/330556592.db2.gz	VUCIGHQHYGVHRB-UHFFFAOYSA-N	0	0	281.399	4.401	20	30		CIEDRN
C=CCN(C(=O)c1ccc2c(c1)CCC=C2)c1ccccc1	ZINC000430716452	330571213	/nfs/dbraw/zinc/57/12/13/330571213.db2.gz	DALIFBGHLAFFBT-UHFFFAOYSA-N	0	0	289.378	4.479	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)CC1CCCCCC1	ZINC000431832010	330589456	/nfs/dbraw/zinc/58/94/56/330589456.db2.gz	IXNOOJBOZLAOPL-UHFFFAOYSA-N	0	0	270.376	4.166	20	30		CIEDRN
CC[C@@H](C)[C@@H]1CCCCN1C(=O)Nc1cccc(C#N)c1C	ZINC000432258970	330596392	/nfs/dbraw/zinc/59/63/92/330596392.db2.gz	PUBNXPXZGZOOCD-DYVFJYSZSA-N	0	0	299.418	4.299	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)Nc1c(C)cc(C)cc1C	ZINC000432483956	330599639	/nfs/dbraw/zinc/59/96/39/330599639.db2.gz	SAWXJRRELYDIJP-UHFFFAOYSA-N	0	0	274.408	4.336	20	30		CIEDRN
CC(C)C1CCC(N(C)C(=O)c2ccc(CC#N)cc2)CC1	ZINC000432549248	330600318	/nfs/dbraw/zinc/60/03/18/330600318.db2.gz	IQAMZXRIWOMLOF-UHFFFAOYSA-N	0	0	298.430	4.039	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)N(C)C[C@@H](C)c1ccccc1	ZINC000432568426	330601050	/nfs/dbraw/zinc/60/10/50/330601050.db2.gz	SSZWFLKCGFRKHH-OAHLLOKOSA-N	0	0	288.435	4.034	20	30		CIEDRN
CC(C)CCN(CCC(C)C)C(=O)c1cscc1C#N	ZINC000432590949	330601641	/nfs/dbraw/zinc/60/16/41/330601641.db2.gz	CXWIPADRWRZZGP-UHFFFAOYSA-N	0	0	292.448	4.154	20	30		CIEDRN
C=C(C)COc1cccc(N[C@@H](C)CC2(OC)CCC2)c1	ZINC000433017322	330612245	/nfs/dbraw/zinc/61/22/45/330612245.db2.gz	BMAIRGSAKPDKLE-HNNXBMFYSA-N	0	0	289.419	4.401	20	30		CIEDRN
C=C(C)CNC(=O)[C@H](Sc1ccccc1)c1ccccc1	ZINC000153040886	330638806	/nfs/dbraw/zinc/63/88/06/330638806.db2.gz	LDNLXPHTDXGAOO-QGZVFWFLSA-N	0	0	297.423	4.212	20	30		CIEDRN
C=CCC[C@H](NC(=O)c1ccc(OC)cc1)c1ccccc1	ZINC000435279444	330652345	/nfs/dbraw/zinc/65/23/45/330652345.db2.gz	KICAFXGKGMHMLH-SFHVURJKSA-N	0	0	295.382	4.133	20	30		CIEDRN
C=CCC[C@@H](NC(=O)Cc1ccccc1F)c1ccccc1	ZINC000435286584	330652523	/nfs/dbraw/zinc/65/25/23/330652523.db2.gz	DNJJFNNCGHKCJR-GOSISDBHSA-N	0	0	297.373	4.192	20	30		CIEDRN
C=CCC[C@@H](NC(=O)c1ccc(C)nc1C)c1ccccc1	ZINC000435294033	330652557	/nfs/dbraw/zinc/65/25/57/330652557.db2.gz	FQGBNVQREOJUPR-GOSISDBHSA-N	0	0	294.398	4.136	20	30		CIEDRN
CCC(C)(C)CC(=O)Nc1ccc(OC(C)C)c(C#N)c1	ZINC000435352001	330653375	/nfs/dbraw/zinc/65/33/75/330653375.db2.gz	YPEMFZMMEFLCFL-UHFFFAOYSA-N	0	0	288.391	4.110	20	30		CIEDRN
C=CCCCSCc1noc(Cc2ccccc2C)n1	ZINC000435382396	330653554	/nfs/dbraw/zinc/65/35/54/330653554.db2.gz	ZPTZRONTVSQJEJ-UHFFFAOYSA-N	0	0	288.416	4.168	20	30		CIEDRN
N#Cc1c(F)cccc1N[C@H]1C[C@H](c2ccccc2)C1	ZINC000435588315	330658121	/nfs/dbraw/zinc/65/81/21/330658121.db2.gz	LRNBBCGJNZJQFA-HDJSIYSDSA-N	0	0	266.319	4.055	20	30		CIEDRN
C=CC[C@H]1N(C(=O)Nc2ccccc2)CCCC1(C)C	ZINC000435685305	330660239	/nfs/dbraw/zinc/66/02/39/330660239.db2.gz	WLBHMAMDHGWZRK-OAHLLOKOSA-N	0	0	272.392	4.285	20	30		CIEDRN
Cc1ccc([C@@H]2CCCN2c2c(C#N)cccc2C#N)s1	ZINC000436383788	330676310	/nfs/dbraw/zinc/67/63/10/330676310.db2.gz	COQMJEMWPLISJK-HNNXBMFYSA-N	0	0	293.395	4.141	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1cc(C(C)C)c(O)cc1C	ZINC000436644020	330682057	/nfs/dbraw/zinc/68/20/57/330682057.db2.gz	HELDAGHAHCNLEL-CQSZACIVSA-N	0	0	289.419	4.299	20	30		CIEDRN
C=C(C)CCc1noc(-c2ccc(C(C)C)cc2O)n1	ZINC000436687579	330682653	/nfs/dbraw/zinc/68/26/53/330682653.db2.gz	ROSOSEJZLDGOAM-UHFFFAOYSA-N	0	0	272.348	4.074	20	30		CIEDRN
C=CCCC(=O)NCc1ccc(Sc2ccccc2)cc1	ZINC000437012170	330691048	/nfs/dbraw/zinc/69/10/48/330691048.db2.gz	KEKVMKUMOGQFRQ-UHFFFAOYSA-N	0	0	297.423	4.420	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H]1C[C@H]1c1ccc2ccccc2c1	ZINC000437281074	330696950	/nfs/dbraw/zinc/69/69/50/330696950.db2.gz	POZRYMYGWGCLTD-RBUKOAKNSA-N	0	0	291.394	4.006	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@H]1C[C@H](c2cccc(Cl)c2)C1	ZINC000437432459	330699655	/nfs/dbraw/zinc/69/96/55/330699655.db2.gz	HGGGXQLNZUBYKE-QRTARXTBSA-N	0	0	291.822	4.305	20	30		CIEDRN
CC(C)(C)c1ccc([C@@H](C#N)NC(=O)C2=CCCCC2)cc1	ZINC000437867667	330710189	/nfs/dbraw/zinc/71/01/89/330710189.db2.gz	JOVHBWSBPNCOSC-QGZVFWFLSA-N	0	0	296.414	4.165	20	30		CIEDRN
Cc1cc(C#N)ccc1C(=O)N1CCC(CCC(C)C)CC1	ZINC000438970046	330731631	/nfs/dbraw/zinc/73/16/31/330731631.db2.gz	RJWQLVIISBICKW-UHFFFAOYSA-N	0	0	298.430	4.155	20	30		CIEDRN
N#Cc1cccc(C(=O)CSc2ccccc2Cl)c1	ZINC000439041315	330732826	/nfs/dbraw/zinc/73/28/26/330732826.db2.gz	QCZMFLHQNCYFGW-UHFFFAOYSA-N	0	0	287.771	4.187	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)c1ccc(Cl)cc1F	ZINC000439184959	330735311	/nfs/dbraw/zinc/73/53/11/330735311.db2.gz	YHJHVUFBZDPZQB-SNVBAGLBSA-N	0	0	269.747	4.044	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1cccc(C(C)(F)F)c1	ZINC000439373143	330737640	/nfs/dbraw/zinc/73/76/40/330737640.db2.gz	SUNSEJGDIBDIDD-LBPRGKRZSA-N	0	0	282.334	4.275	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1ccc2occ(C)c2c1	ZINC000439373051	330737677	/nfs/dbraw/zinc/73/76/77/330737677.db2.gz	SXYXVLDIUOUILO-GFCCVEGCSA-N	0	0	272.348	4.217	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1cccc2ccsc21	ZINC000439423235	330737992	/nfs/dbraw/zinc/73/79/92/330737992.db2.gz	PALWLHBOVWMRTO-GFCCVEGCSA-N	0	0	274.389	4.378	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1cccc2ccsc21	ZINC000439423236	330738007	/nfs/dbraw/zinc/73/80/07/330738007.db2.gz	PALWLHBOVWMRTO-LBPRGKRZSA-N	0	0	274.389	4.378	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1ccc2nc(C3CC3)oc2c1	ZINC000439426025	330738113	/nfs/dbraw/zinc/73/81/13/330738113.db2.gz	VIKONTBTIHIDQG-LBPRGKRZSA-N	0	0	299.374	4.181	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1sc(C)nc1CC(C)C	ZINC000439434894	330738327	/nfs/dbraw/zinc/73/83/27/330738327.db2.gz	FNXICNZIDGBIRS-GFCCVEGCSA-N	0	0	295.452	4.126	20	30		CIEDRN
Cc1ccccc1NCc1ccc(C#N)cc1OC(F)F	ZINC000439556756	330740371	/nfs/dbraw/zinc/74/03/71/330740371.db2.gz	NICMVKSFXWAEHK-UHFFFAOYSA-N	0	0	288.297	4.080	20	30		CIEDRN
CC(C)COc1ccc(N[C@H](C)c2ccc(C#N)cc2)cn1	ZINC000439600108	330741024	/nfs/dbraw/zinc/74/10/24/330741024.db2.gz	WNHDSNHDMTYZTR-CQSZACIVSA-N	0	0	295.386	4.161	20	30		CIEDRN
N#CCC[C@@H](NC(=O)[C@H]1CC12CCCCC2)c1ccccc1	ZINC000439673764	330741920	/nfs/dbraw/zinc/74/19/20/330741920.db2.gz	OJGBKTIAUCUZOA-IAGOWNOFSA-N	0	0	296.414	4.118	20	30		CIEDRN
C=CCn1c(SC[C@H](F)CC)nnc1-c1cccs1	ZINC000440584980	330751306	/nfs/dbraw/zinc/75/13/06/330751306.db2.gz	PYPHHHQPRCADGK-SNVBAGLBSA-N	0	0	297.424	4.033	20	30		CIEDRN
Cc1cc(NCc2ccc(C#N)o2)cc(C)c1Cl	ZINC000441208328	330763070	/nfs/dbraw/zinc/76/30/70/330763070.db2.gz	RGMIZXNWXZHLKA-UHFFFAOYSA-N	0	0	260.724	4.034	20	30		CIEDRN
CC[C@@H](F)CNc1ccccc1S[C@H](C)CC#N	ZINC000442116819	330774272	/nfs/dbraw/zinc/77/42/72/330774272.db2.gz	BBCYITNAWYUTRW-VXGBXAGGSA-N	0	0	266.385	4.241	20	30		CIEDRN
N#Cc1cc(CNc2cc(Cl)cc(F)c2F)ccc1F	ZINC000442133744	330774450	/nfs/dbraw/zinc/77/44/50/330774450.db2.gz	OFGAXGQBKQAJLB-UHFFFAOYSA-N	0	0	296.679	4.241	20	30		CIEDRN
CC[C@@H]1CCC[C@H]1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000448669653	330775927	/nfs/dbraw/zinc/77/59/27/330775927.db2.gz	SXFFUZANCSNQBI-CZUORRHYSA-N	0	0	284.403	4.253	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@@H](C)c1ccccc1SC	ZINC000442614452	330777510	/nfs/dbraw/zinc/77/75/10/330777510.db2.gz	ZBWPRVVXAJWCCX-ZDUSSCGKSA-N	0	0	292.448	4.077	20	30		CIEDRN
CCc1cc(Br)ccc1N[C@H]1CC[C@H](C#N)C1	ZINC000442836600	330786107	/nfs/dbraw/zinc/78/61/07/330786107.db2.gz	OCXYPVPWPGYWID-GWCFXTLKSA-N	0	0	293.208	4.116	20	30		CIEDRN
CC(C)c1cnc(S[C@H](C)c2cccc(C#N)c2)n1C	ZINC000442906427	330791301	/nfs/dbraw/zinc/79/13/01/330791301.db2.gz	HNTVEJXPMXMFBY-GFCCVEGCSA-N	0	0	285.416	4.268	20	30		CIEDRN
C=CCn1c2ccccc2nc1SCc1cncc(C)c1	ZINC000442902098	330791375	/nfs/dbraw/zinc/79/13/75/330791375.db2.gz	RJJXKLUIICMTPU-UHFFFAOYSA-N	0	0	295.411	4.218	20	30		CIEDRN
Cc1nc(CCS[C@H](C)c2cccc(C#N)c2)cs1	ZINC000443135223	330795530	/nfs/dbraw/zinc/79/55/30/330795530.db2.gz	RCJCZPLLSDKMDW-LLVKDONJSA-N	0	0	288.441	4.360	20	30		CIEDRN
N#Cc1ccc(S[C@@H]2CCc3c2cccc3Cl)nc1	ZINC000443533742	330800963	/nfs/dbraw/zinc/80/09/63/330800963.db2.gz	WTTWAFCPUZPSQK-CQSZACIVSA-N	0	0	286.787	4.386	20	30		CIEDRN
CCOCc1ccc(NCc2ccc(C#N)c(C)c2)cc1	ZINC000443999912	330809018	/nfs/dbraw/zinc/80/90/18/330809018.db2.gz	FKHDGSIHAHXWOR-UHFFFAOYSA-N	0	0	280.371	4.015	20	30		CIEDRN
COc1cccc2c1N(CCCCC(C)(C)C#N)CCC2	ZINC000444645826	330816262	/nfs/dbraw/zinc/81/62/62/330816262.db2.gz	HWGQOYIJZWMPLR-UHFFFAOYSA-N	0	0	286.419	4.168	20	30		CIEDRN
CCN1CCN(CCCCC(C)(C)C#N)c2ccccc21	ZINC000444661125	330817410	/nfs/dbraw/zinc/81/74/10/330817410.db2.gz	HHNOTYUZXFLPJC-UHFFFAOYSA-N	0	0	285.435	4.053	20	30		CIEDRN
CC(C)N(C)c1ccccc1CNc1ccc(C#N)cc1	ZINC000445615026	330832927	/nfs/dbraw/zinc/83/29/27/330832927.db2.gz	DECAGJCVDNRGGE-UHFFFAOYSA-N	0	0	279.387	4.015	20	30		CIEDRN
N#C[C@@H]1CCC[C@H](Nc2cccc3ccsc32)C1	ZINC000446825008	330855116	/nfs/dbraw/zinc/85/51/16/330855116.db2.gz	HSHDKWFPERHAQM-YPMHNXCESA-N	0	0	256.374	4.396	20	30		CIEDRN
COCc1cccc(CSCc2ccccc2C#N)c1	ZINC000446937875	330858445	/nfs/dbraw/zinc/85/84/45/330858445.db2.gz	GLVQGGRVFKKESS-UHFFFAOYSA-N	0	0	283.396	4.138	20	30		CIEDRN
COc1cc(C)cc(N[C@H](C#N)C2CCCCC2)c1C	ZINC000447177919	330862614	/nfs/dbraw/zinc/86/26/14/330862614.db2.gz	WQMUFEZMKUIBRL-MRXNPFEDSA-N	0	0	272.392	4.196	20	30		CIEDRN
CC[C@@H](Nc1cccc(C)c1)c1ccc(C#N)cc1	ZINC000447586690	330871772	/nfs/dbraw/zinc/87/17/72/330871772.db2.gz	NICPDYXPCFPBFF-QGZVFWFLSA-N	0	0	250.345	4.430	20	30		CIEDRN
CC[C@H](Nc1cc(C)ccc1OC)c1ccc(C#N)cc1	ZINC000447602789	330873328	/nfs/dbraw/zinc/87/33/28/330873328.db2.gz	UHPIYLNWKKSKSR-INIZCTEOSA-N	0	0	280.371	4.439	20	30		CIEDRN
C[C@H](C#N)C(=O)Nc1ccc(Cl)cc1Nc1ccccc1	ZINC000447704637	330874310	/nfs/dbraw/zinc/87/43/10/330874310.db2.gz	RSLOQGPUOIPNCN-LLVKDONJSA-N	0	0	299.761	4.182	20	30		CIEDRN
C=CCCCNC(=O)N[C@@H](c1ccc(Cl)cc1)C1CC1	ZINC000447968716	330881649	/nfs/dbraw/zinc/88/16/49/330881649.db2.gz	RLWVEVQRVZNKKX-OAHLLOKOSA-N	0	0	292.810	4.057	20	30		CIEDRN
CCOc1cc(F)ccc1NC1CCC(C)(C#N)CC1	ZINC000449046371	330895068	/nfs/dbraw/zinc/89/50/68/330895068.db2.gz	LQCVHRXCLJYGIZ-UHFFFAOYSA-N	0	0	276.355	4.109	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(F)cc2C)CCCC1	ZINC000449100970	330899090	/nfs/dbraw/zinc/89/90/90/330899090.db2.gz	XYSVECCILMLKJP-UHFFFAOYSA-N	0	0	261.340	4.209	20	30		CIEDRN
Cn1ccc2ccc(NC3CCC(C)(C#N)CC3)cc21	ZINC000449271189	330911213	/nfs/dbraw/zinc/91/12/13/330911213.db2.gz	RZGUUGDRVSSHQX-UHFFFAOYSA-N	0	0	267.376	4.063	20	30		CIEDRN
Cc1cc2ccccc2c(N[C@@H]2CC[C@@H](C#N)C2)c1	ZINC000449411969	330923397	/nfs/dbraw/zinc/92/33/97/330923397.db2.gz	LCJIQATVGJQBFG-UKRRQHHQSA-N	0	0	250.345	4.252	20	30		CIEDRN
C=CCC1(C(=O)NCc2ccc(Cl)s2)CCCC1	ZINC000449468552	330928225	/nfs/dbraw/zinc/92/82/25/330928225.db2.gz	PQNYILCGAVISNE-UHFFFAOYSA-N	0	0	283.824	4.154	20	30		CIEDRN
C[C@@H](CCc1ccsc1)Nc1cccc(CC#N)c1	ZINC000449705986	330945303	/nfs/dbraw/zinc/94/53/03/330945303.db2.gz	ZTXWFZWPWWANJI-ZDUSSCGKSA-N	0	0	270.401	4.247	20	30		CIEDRN
C=CC(C)(C)C(=O)N1CC[C@H](c2ccccc2)[C@@H](CC)C1	ZINC000450020369	330958815	/nfs/dbraw/zinc/95/88/15/330958815.db2.gz	WVKVEOBFMUHHBW-RDJZCZTQSA-N	0	0	285.431	4.241	20	30		CIEDRN
C=CCC1(C(=O)N2C[C@@H]3CCCC[C@H]3C2)CCCCC1	ZINC000450064807	330960180	/nfs/dbraw/zinc/96/01/80/330960180.db2.gz	FLJRUTJZDOLXFD-HOTGVXAUSA-N	0	0	275.436	4.162	20	30		CIEDRN
C=CCC1(C(=O)N2C[C@H]3CCCC[C@@H]3C2)CCCCC1	ZINC000450064808	330960225	/nfs/dbraw/zinc/96/02/25/330960225.db2.gz	FLJRUTJZDOLXFD-HZPDHXFCSA-N	0	0	275.436	4.162	20	30		CIEDRN
CCC[C@@H]1CCC[C@H]1C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000450192220	330965209	/nfs/dbraw/zinc/96/52/09/330965209.db2.gz	IOJZQDPEOGRPGR-KBAYOESNSA-N	0	0	298.430	4.364	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@@H](C)C3(CCC3)C2)CCCC1	ZINC000450370712	330974876	/nfs/dbraw/zinc/97/48/76/330974876.db2.gz	ARFQBHUYJLWVPM-OAHLLOKOSA-N	0	0	275.436	4.162	20	30		CIEDRN
C=CC(C)(C)C(=O)N1CC=C(c2ccc(CC)cc2)CC1	ZINC000450378021	330975318	/nfs/dbraw/zinc/97/53/18/330975318.db2.gz	KQIBYWANCTWKBF-UHFFFAOYSA-N	0	0	283.415	4.077	20	30		CIEDRN
N#Cc1c(Cl)cccc1N[C@H]1CCCC(F)(F)C1	ZINC000450383986	330975555	/nfs/dbraw/zinc/97/55/55/330975555.db2.gz	APFJMTGXTLJLDR-VIFPVBQESA-N	0	0	270.710	4.201	20	30		CIEDRN
C=CC(C)(C)C(=O)N1CCc2ccc(C(C)(C)C)cc2C1	ZINC000450511981	330984460	/nfs/dbraw/zinc/98/44/60/330984460.db2.gz	ONUYFQMHAJCNCU-UHFFFAOYSA-N	0	0	285.431	4.081	20	30		CIEDRN
N#CC1(COc2cc(Cl)ccc2Cl)CCC1	ZINC000450569293	330987165	/nfs/dbraw/zinc/98/71/65/330987165.db2.gz	UUPPDQRALUBNCC-UHFFFAOYSA-N	0	0	256.132	4.066	20	30		CIEDRN
N#CC1(CSCc2cccc(Br)c2)CCC1	ZINC000450591833	330988379	/nfs/dbraw/zinc/98/83/79/330988379.db2.gz	GNEFROXDCPWYMY-UHFFFAOYSA-N	0	0	296.233	4.376	20	30		CIEDRN
C=CCn1c2ccccc2nc1S[C@@H]1CC[C@H](C#N)C1	ZINC000450614153	330989416	/nfs/dbraw/zinc/98/94/16/330989416.db2.gz	VZZJJKJWWSVKPR-QWHCGFSZSA-N	0	0	283.400	4.007	20	30		CIEDRN
Cc1cc(C#N)cc(N[C@H]2CCCC[C@H]2CC(F)(F)F)n1	ZINC000450664086	330992007	/nfs/dbraw/zinc/99/20/07/330992007.db2.gz	UGXGCRQNFJSRNM-STQMWFEESA-N	0	0	297.324	4.185	20	30		CIEDRN
C[C@H](NCC1(C#N)CCC1)c1cccc(C(F)(F)F)c1	ZINC000450666945	330992065	/nfs/dbraw/zinc/99/20/65/330992065.db2.gz	ZDTQDDGMAOZACB-NSHDSACASA-N	0	0	282.309	4.050	20	30		CIEDRN
CCCCSc1nnc(S[C@@H]2CC[C@@H](C#N)C2)s1	ZINC000450726308	330996226	/nfs/dbraw/zinc/99/62/26/330996226.db2.gz	UPWKXWZQIJIRSN-NXEZZACHSA-N	0	0	299.490	4.215	20	30		CIEDRN
Cc1c2ccccc2oc1[C@@H](C)NCC1(C#N)CCC1	ZINC000450726626	330996274	/nfs/dbraw/zinc/99/62/74/330996274.db2.gz	VNVCWTQMHXOLBJ-CYBMUJFWSA-N	0	0	268.360	4.086	20	30		CIEDRN
CCCOc1cccc(CSc2ccc(C#N)cn2)c1	ZINC000450805369	331000386	/nfs/dbraw/zinc/00/03/86/331000386.db2.gz	ZYFQMRYXJRKYJC-UHFFFAOYSA-N	0	0	284.384	4.034	20	30		CIEDRN
CC(C)(C)c1cc(CSc2ccc(C#N)cc2)no1	ZINC000450807409	331000582	/nfs/dbraw/zinc/00/05/82/331000582.db2.gz	GDWHDJKLHJZSMI-UHFFFAOYSA-N	0	0	272.373	4.136	20	30		CIEDRN
N#Cc1cccnc1N1CCCC[C@@H]1c1ccc(Cl)cc1	ZINC000450826517	331001410	/nfs/dbraw/zinc/00/14/10/331001410.db2.gz	GEGWNULPRUOSOW-MRXNPFEDSA-N	0	0	297.789	4.338	20	30		CIEDRN
CCCc1nc(C)c(CSc2cccc(C#N)c2)o1	ZINC000450858147	331003225	/nfs/dbraw/zinc/00/32/25/331003225.db2.gz	KOJBTFSPKNLAAF-UHFFFAOYSA-N	0	0	272.373	4.100	20	30		CIEDRN
CC(F)(F)CCSc1cccc(Cl)c1C#N	ZINC000450901256	331005970	/nfs/dbraw/zinc/00/59/70/331005970.db2.gz	HHMYCLAJAGRDQA-UHFFFAOYSA-N	0	0	261.724	4.349	20	30		CIEDRN
N#C[C@H]1CC[C@@H](SCc2ccccc2C2CC2)C1	ZINC000450904432	331006157	/nfs/dbraw/zinc/00/61/57/331006157.db2.gz	FGYHFMADRXXPPU-SWLSCSKDSA-N	0	0	257.402	4.489	20	30		CIEDRN
CC#CCCSC1CCC(C(F)(F)F)CC1	ZINC000451039824	331013098	/nfs/dbraw/zinc/01/30/98/331013098.db2.gz	ZWKIUXNBUBSLSS-UHFFFAOYSA-N	0	0	250.329	4.254	20	30		CIEDRN
CC(C)(C)c1ccccc1NC(=O)Cc1ccc(C#N)cc1	ZINC000194707391	331016841	/nfs/dbraw/zinc/01/68/41/331016841.db2.gz	WXZTXXBQPWNBKS-UHFFFAOYSA-N	0	0	292.382	4.037	20	30		CIEDRN
N#CC1(CN[C@@H](c2ccc(F)c(Cl)c2)C2CC2)CCC1	ZINC000451357668	331025556	/nfs/dbraw/zinc/02/55/56/331025556.db2.gz	TXFBASVZGULFCK-OAHLLOKOSA-N	0	0	292.785	4.214	20	30		CIEDRN
C=CCC1(C(=O)N2Cc3ccc(C)cc3C2)CCCCC1	ZINC000451387361	331026840	/nfs/dbraw/zinc/02/68/40/331026840.db2.gz	ZBNDHIOTQRYMLR-UHFFFAOYSA-N	0	0	283.415	4.364	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl	ZINC000451393629	331027327	/nfs/dbraw/zinc/02/73/27/331027327.db2.gz	KFKHOEMWDDCDGZ-WCQYABFASA-N	0	0	298.213	4.178	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000451627842	331037221	/nfs/dbraw/zinc/03/72/21/331037221.db2.gz	ZGUJVUDWYAXTCA-ULQDDVLXSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CCC1(C(=O)N2CCC=C(c3ccco3)C2)CCCC1	ZINC000451662044	331037975	/nfs/dbraw/zinc/03/79/75/331037975.db2.gz	JIDRLUGDEMYFTJ-UHFFFAOYSA-N	0	0	285.387	4.032	20	30		CIEDRN
C/C=C\c1ccc(NC(=O)[C@]2(C#N)CC23CCCC3)cc1	ZINC000451771085	331041585	/nfs/dbraw/zinc/04/15/85/331041585.db2.gz	QPVDHFGGEJYJHH-OTZGOOTISA-N	0	0	280.371	4.132	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1[C@H](C)[C@@H](CC(F)(F)F)C[C@@H]1C	ZINC000452226075	331059312	/nfs/dbraw/zinc/05/93/12/331059312.db2.gz	ALQVDWHOKOHFCU-YVECIDJPSA-N	0	0	291.357	4.167	20	30		CIEDRN
C=CCC1(C(=O)NC[C@H]2CCCCC2(F)F)CCCC1	ZINC000452310911	331061853	/nfs/dbraw/zinc/06/18/53/331061853.db2.gz	ULIYGKLDEPVFLP-CYBMUJFWSA-N	0	0	285.378	4.065	20	30		CIEDRN
C=CCC1(C(=O)N[C@H](C)c2ccc(F)c(C)c2)CCC1	ZINC000452320164	331062285	/nfs/dbraw/zinc/06/22/85/331062285.db2.gz	SKUACGYAXDORKY-CYBMUJFWSA-N	0	0	275.367	4.058	20	30		CIEDRN
N#Cc1ccc(CSc2cccc(O)c2)c(Cl)c1	ZINC000163644171	331065029	/nfs/dbraw/zinc/06/50/29/331065029.db2.gz	JXYKVPCNTWADIB-UHFFFAOYSA-N	0	0	275.760	4.210	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@]1(C)CC(C)C	ZINC000452513367	331067150	/nfs/dbraw/zinc/06/71/50/331067150.db2.gz	REWBKQRNAHSNBW-GDBMZVCRSA-N	0	0	251.414	4.016	20	30		CIEDRN
CCCCC1CCC(C(=O)N[C@H]2CC[C@@H](CC#N)C2)CC1	ZINC000452561528	331069070	/nfs/dbraw/zinc/06/90/70/331069070.db2.gz	BMPAWXYFMATSTH-XGHPGWEVSA-N	0	0	290.451	4.182	20	30		CIEDRN
CC1(C)CC(CC(=O)Nc2ccc(CC#N)cc2Cl)C1	ZINC000452646038	331070937	/nfs/dbraw/zinc/07/09/37/331070937.db2.gz	OKNYKPRWJDFPHE-UHFFFAOYSA-N	0	0	290.794	4.171	20	30		CIEDRN
CC(C)(C)CCC(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452651180	331071148	/nfs/dbraw/zinc/07/11/48/331071148.db2.gz	ZWHBBABINXPXMH-UHFFFAOYSA-N	0	0	278.783	4.171	20	30		CIEDRN
C[C@H](CC(C)(C)C)C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452654099	331071208	/nfs/dbraw/zinc/07/12/08/331071208.db2.gz	QAGQIMFTXTWBSB-LLVKDONJSA-N	0	0	292.810	4.417	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccccc1C(C)(F)F	ZINC000452680392	331072145	/nfs/dbraw/zinc/07/21/45/331072145.db2.gz	XQNAIHFKRMCJOU-LLVKDONJSA-N	0	0	267.319	4.339	20	30		CIEDRN
C=C(C)CCNC(=O)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1	ZINC000452715049	331072679	/nfs/dbraw/zinc/07/26/79/331072679.db2.gz	BNULOBLZAUXZEQ-KBPBESRZSA-N	0	0	298.213	4.179	20	30		CIEDRN
C=C(C)CCNC(=O)C[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000452720787	331073740	/nfs/dbraw/zinc/07/37/40/331073740.db2.gz	FLHGYBNKEWODCX-GFCCVEGCSA-N	0	0	299.336	4.281	20	30		CIEDRN
C=C(C)CCNC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000452728280	331074537	/nfs/dbraw/zinc/07/45/37/331074537.db2.gz	DCDYHMNWEBFZSC-GXTWGEPZSA-N	0	0	295.785	4.055	20	30		CIEDRN
C=CCC1(C(=O)NC[C@@H]2CCCC2(F)F)CCCCC1	ZINC000452828630	331078862	/nfs/dbraw/zinc/07/88/62/331078862.db2.gz	ROUGCIWRBUHRGI-ZDUSSCGKSA-N	0	0	285.378	4.065	20	30		CIEDRN
C=CCOCCCC(=O)Nc1cc(C)cc2ccccc21	ZINC000452839053	331079139	/nfs/dbraw/zinc/07/91/39/331079139.db2.gz	DEWDHVWWZGPCMK-UHFFFAOYSA-N	0	0	283.371	4.070	20	30		CIEDRN
C=CCCCC(=O)Nc1cc(C)c(C)cc1Cl	ZINC000452884302	331080026	/nfs/dbraw/zinc/08/00/26/331080026.db2.gz	PREKZDKVKLZNRZ-UHFFFAOYSA-N	0	0	251.757	4.252	20	30		CIEDRN
C=C(C)[C@H](CC(=O)Nc1cc(C)c(C)cc1Cl)OCC	ZINC000452886644	331080038	/nfs/dbraw/zinc/08/00/38/331080038.db2.gz	ROUWHGCTTJHMLH-HNNXBMFYSA-N	0	0	295.810	4.267	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(C(=O)C(C)C)cc1	ZINC000452970081	331082273	/nfs/dbraw/zinc/08/22/73/331082273.db2.gz	FICPURPFNQTGRQ-QGZVFWFLSA-N	0	0	273.376	4.066	20	30		CIEDRN
Cc1cc(C#N)cc(NCc2ccccc2C(C)(C)C#N)c1	ZINC000453137205	331093163	/nfs/dbraw/zinc/09/31/63/331093163.db2.gz	CODBXLPNABHNFC-UHFFFAOYSA-N	0	0	289.382	4.280	20	30		CIEDRN
C=CC(C)(C)c1nc(C2(c3ccccc3)CCC2)no1	ZINC000453144643	331093944	/nfs/dbraw/zinc/09/39/44/331093944.db2.gz	KNXJYHYHPGIIEC-UHFFFAOYSA-N	0	0	268.360	4.003	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cc3ccccc3nc2C)n1	ZINC000453187609	331098982	/nfs/dbraw/zinc/09/89/82/331098982.db2.gz	OJOWSADEANAPTM-UHFFFAOYSA-N	0	0	293.370	4.447	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H](CC)CC(F)(F)F)n1	ZINC000453189638	331099125	/nfs/dbraw/zinc/09/91/25/331099125.db2.gz	RWBVVZFNMKVUSF-SECBINFHSA-N	0	0	276.302	4.369	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc([C@H]2CSc3ccccc32)no1	ZINC000453231368	331104649	/nfs/dbraw/zinc/10/46/49/331104649.db2.gz	VMWWUCGHPSPOFJ-AAEUAGOBSA-N	0	0	286.400	4.377	20	30		CIEDRN
C=CCCc1noc([C@H](C)CSCc2ccccc2)n1	ZINC000453238464	331105554	/nfs/dbraw/zinc/10/55/54/331105554.db2.gz	QFMCABSFGKJTIK-CYBMUJFWSA-N	0	0	288.416	4.225	20	30		CIEDRN
C=CCCc1noc(CCCCC(=O)c2ccc(C)cc2)n1	ZINC000453241057	331106019	/nfs/dbraw/zinc/10/60/19/331106019.db2.gz	VDUBSIIQGXTKLC-UHFFFAOYSA-N	0	0	298.386	4.092	20	30		CIEDRN
C=CCCc1noc([C@@H]2C[C@@H]2c2cccc(Cl)c2)n1	ZINC000453247617	331107146	/nfs/dbraw/zinc/10/71/46/331107146.db2.gz	OBDGUPSLUHQYJG-CHWSQXEVSA-N	0	0	274.751	4.113	20	30		CIEDRN
CC(C)Oc1cccc(N[C@@H]2CCc3ccc(C#N)cc32)c1	ZINC000453284913	331110993	/nfs/dbraw/zinc/11/09/93/331110993.db2.gz	GJAPPNVCJMOLLM-LJQANCHMSA-N	0	0	292.382	4.445	20	30		CIEDRN
CC#CCN(C)C(=O)Nc1ccc(C(C)C)cc1C(C)C	ZINC000454407990	331145546	/nfs/dbraw/zinc/14/55/46/331145546.db2.gz	LPCMQEBUYPYPDG-UHFFFAOYSA-N	0	0	286.419	4.420	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N1CC2(CCCC2)[C@@H]1c1ccccc1	ZINC000454521155	331147891	/nfs/dbraw/zinc/14/78/91/331147891.db2.gz	JKJGTOMSQZRKRW-RDJZCZTQSA-N	0	0	298.430	4.278	20	30		CIEDRN
CCOc1ccc(C#N)cc1NC(=O)C1=CCC(C)(C)CC1	ZINC000454993724	331158398	/nfs/dbraw/zinc/15/83/98/331158398.db2.gz	GLEBEGGYVMUGQP-UHFFFAOYSA-N	0	0	298.386	4.032	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)N1C[C@H](C(C)C)[C@@H]1C(C)C	ZINC000455004463	331158719	/nfs/dbraw/zinc/15/87/19/331158719.db2.gz	RPGFOUPCLLPOMZ-WBVHZDCISA-N	0	0	299.418	4.011	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)NCC[C@H](C)F	ZINC000455245898	331163122	/nfs/dbraw/zinc/16/31/22/331163122.db2.gz	MBGXWNNPMSDFPR-ZDUSSCGKSA-N	0	0	292.398	4.408	20	30		CIEDRN
C=C(C)CCNC(=O)N[C@@H](CC)c1ccc(Cl)s1	ZINC000455303731	331164858	/nfs/dbraw/zinc/16/48/58/331164858.db2.gz	AVFUKDKCHUTCBQ-JTQLQIEISA-N	0	0	286.828	4.118	20	30		CIEDRN
C=C(C)CCNC(=O)N1CCC[C@@H]1c1ccccc1Cl	ZINC000455317800	331165822	/nfs/dbraw/zinc/16/58/22/331165822.db2.gz	XTYNQYKQRBESQD-OAHLLOKOSA-N	0	0	292.810	4.153	20	30		CIEDRN
C=CC(C)(C)CNC(=O)N1CCC[C@@H]1c1ccc(C)s1	ZINC000455366534	331167333	/nfs/dbraw/zinc/16/73/33/331167333.db2.gz	MIJBKGIFXLLUEU-CYBMUJFWSA-N	0	0	292.448	4.115	20	30		CIEDRN
C=CC(C)(C)CNC(=O)N1CCC[C@@H]1c1ccccc1C	ZINC000455371144	331167527	/nfs/dbraw/zinc/16/75/27/331167527.db2.gz	SCYNCAXRWRQFDZ-MRXNPFEDSA-N	0	0	286.419	4.054	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N(C)Cc1occc1C	ZINC000455379474	331167810	/nfs/dbraw/zinc/16/78/10/331167810.db2.gz	HKEZUTJEXLPHPB-UHFFFAOYSA-N	0	0	298.386	4.371	20	30		CIEDRN
C=CC(C)(C)CNC(=O)N1CC2(CCC2)[C@H]1c1ccccc1	ZINC000455380207	331167974	/nfs/dbraw/zinc/16/79/74/331167974.db2.gz	GBNVCKXSSUIURH-MRXNPFEDSA-N	0	0	298.430	4.135	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1cccc(-c2ncco2)c1C	ZINC000455483736	331170754	/nfs/dbraw/zinc/17/07/54/331170754.db2.gz	GSRSYAWXAAPPAE-UHFFFAOYSA-N	0	0	299.374	4.080	20	30		CIEDRN
C=CCC1(CNC(=O)N(C)[C@@H](C)c2ccco2)CCCC1	ZINC000455483195	331170819	/nfs/dbraw/zinc/17/08/19/331170819.db2.gz	UUEBLXURGXFMIN-AWEZNQCLSA-N	0	0	290.407	4.119	20	30		CIEDRN
C=CCCCCCOc1cc(C)ccc1NC(C)=O	ZINC000195391830	331171166	/nfs/dbraw/zinc/17/11/66/331171166.db2.gz	XHGGVBLGBHAYBC-UHFFFAOYSA-N	0	0	261.365	4.079	20	30		CIEDRN
C=CCCCCCSc1nnc(-c2ccoc2C)n1C	ZINC000195419042	331172948	/nfs/dbraw/zinc/17/29/48/331172948.db2.gz	WHMVTESQPICGIR-UHFFFAOYSA-N	0	0	291.420	4.222	20	30		CIEDRN
C=CCCCCCSc1nccn1Cc1ccccn1	ZINC000195441294	331173493	/nfs/dbraw/zinc/17/34/93/331173493.db2.gz	ZQTHHFUOULWINM-UHFFFAOYSA-N	0	0	287.432	4.165	20	30		CIEDRN
CC[C@@H](C)[C@@H]1CCCCN1C(=O)Nc1cccc(CC#N)c1	ZINC000455909405	331180487	/nfs/dbraw/zinc/18/04/87/331180487.db2.gz	BKYGBHMOTUQATG-PBHICJAKSA-N	0	0	299.418	4.185	20	30		CIEDRN
Cc1cc(C)c(CNc2ccc(C#N)cc2[N+](=O)[O-])c(C)c1	ZINC000195732202	331181172	/nfs/dbraw/zinc/18/11/72/331181172.db2.gz	YVFWREIOSPUJRX-UHFFFAOYSA-N	0	0	295.342	4.004	20	30		CIEDRN
Cc1cscc1NC(=O)C(C)(C)Cc1ccc(C#N)cc1	ZINC000455988711	331181942	/nfs/dbraw/zinc/18/19/42/331181942.db2.gz	GICHHVKKQZLWDO-UHFFFAOYSA-N	0	0	298.411	4.136	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cc(OCC)ccc1Cl	ZINC000456042191	331183149	/nfs/dbraw/zinc/18/31/49/331183149.db2.gz	IFYFSNHRKUJWDN-HNNXBMFYSA-N	0	0	281.783	4.280	20	30		CIEDRN
CCC[C@H](CC1CCCC1)C(=O)N[C@H]1CC[C@@H](CC#N)C1	ZINC000456046689	331183234	/nfs/dbraw/zinc/18/32/34/331183234.db2.gz	JSQNWZITGKKZHB-BBWFWOEESA-N	0	0	290.451	4.182	20	30		CIEDRN
CCC1(NC(=O)C[C@@H](CC#N)c2ccccc2)CCCCC1	ZINC000456242972	331187109	/nfs/dbraw/zinc/18/71/09/331187109.db2.gz	ZXNCXTMETPEBJH-QGZVFWFLSA-N	0	0	298.430	4.303	20	30		CIEDRN
C=CCC1(NC(=O)[C@@H](C)c2cccc(C#N)c2)CCCCC1	ZINC000456360594	331190889	/nfs/dbraw/zinc/19/08/89/331190889.db2.gz	DPQYWBRUIGRGRY-HNNXBMFYSA-N	0	0	296.414	4.057	20	30		CIEDRN
C=CCCC(=O)N1CCCC[C@H]1c1ccc(Cl)cc1	ZINC000456412783	331192323	/nfs/dbraw/zinc/19/23/23/331192323.db2.gz	HRQNHXDTWBWKDS-HNNXBMFYSA-N	0	0	277.795	4.360	20	30		CIEDRN
C=CCC1(CNC(=O)c2cc[nH]c2C2CCC2)CCCC1	ZINC000456510298	331194655	/nfs/dbraw/zinc/19/46/55/331194655.db2.gz	RTGWQLOLLOVDKH-UHFFFAOYSA-N	0	0	286.419	4.149	20	30		CIEDRN
CCc1ccc([C@@H](C)C(=O)Nc2cccc(CC#N)c2)cc1	ZINC000456741768	331199608	/nfs/dbraw/zinc/19/96/08/331199608.db2.gz	YYLWLSQQNFBZRY-CQSZACIVSA-N	0	0	292.382	4.057	20	30		CIEDRN
N#CCc1cccc(NC(=O)CCCC2CCCC2)c1	ZINC000456742284	331199807	/nfs/dbraw/zinc/19/98/07/331199807.db2.gz	ZSPRZCJSEFFMKF-UHFFFAOYSA-N	0	0	270.376	4.052	20	30		CIEDRN
C=C(CC)CNC(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1	ZINC000456828641	331206357	/nfs/dbraw/zinc/20/63/57/331206357.db2.gz	MOSCYYPDJXYQGW-MSOLQXFVSA-N	0	0	279.383	4.026	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N[C@@H](C)C1CCCC1	ZINC000456900471	331208546	/nfs/dbraw/zinc/20/85/46/331208546.db2.gz	XJLTVKFPMDWBQL-ZDUSSCGKSA-N	0	0	289.444	4.273	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)Cc1ccc(C)c(C)c1	ZINC000456942000	331208885	/nfs/dbraw/zinc/20/88/85/331208885.db2.gz	BFRWZMOBSNDHIY-UHFFFAOYSA-N	0	0	271.404	4.030	20	30		CIEDRN
C=CCC1(C(=O)N(C)Cc2ccc(C)c(C)c2)CCC1	ZINC000456961205	331209205	/nfs/dbraw/zinc/20/92/05/331209205.db2.gz	LYYNMKGTELLVFA-UHFFFAOYSA-N	0	0	271.404	4.008	20	30		CIEDRN
C=CCCOCCCCC(=O)N1CC[C@H](CC(C)(C)C)C1	ZINC000457093114	331212082	/nfs/dbraw/zinc/21/20/82/331212082.db2.gz	UKLJUXIMTVECSL-MRXNPFEDSA-N	0	0	295.467	4.034	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CC2(CCCC2)[C@H]1C(C)C	ZINC000457152712	331213048	/nfs/dbraw/zinc/21/30/48/331213048.db2.gz	XZWKYKQALCIKNJ-GDBMZVCRSA-N	0	0	263.425	4.016	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC2(CCCC2)[C@H]1C(C)C	ZINC000457173698	331213810	/nfs/dbraw/zinc/21/38/10/331213810.db2.gz	RGWLKLQXMZUZQI-MRXNPFEDSA-N	0	0	275.436	4.182	20	30		CIEDRN
C[C@@H]1CCCC[C@@]1(C)NC(=O)C[C@H](CC#N)c1ccccc1	ZINC000457238425	331216874	/nfs/dbraw/zinc/21/68/74/331216874.db2.gz	CVSYTKAPCMPMJB-HHXXYDBFSA-N	0	0	298.430	4.159	20	30		CIEDRN
CC#CCCCC(=O)N1CC2(CCCC2)[C@H]1c1ccccc1	ZINC000457285534	331218060	/nfs/dbraw/zinc/21/80/60/331218060.db2.gz	RHUVOCPRWAQUOO-LJQANCHMSA-N	0	0	295.426	4.324	20	30		CIEDRN
CC(C)CCCCC(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000457666130	331230652	/nfs/dbraw/zinc/23/06/52/331230652.db2.gz	QBHQHVLJNSNZHH-KRWDZBQOSA-N	0	0	286.419	4.364	20	30		CIEDRN
C=CCC[C@H](NC(=O)[C@H](C)CC(F)(F)F)c1ccccc1	ZINC000457674000	331230840	/nfs/dbraw/zinc/23/08/40/331230840.db2.gz	MEIRDCXKHJBIOU-OCCSQVGLSA-N	0	0	299.336	4.399	20	30		CIEDRN
CC(C)(C)C1CC(C(=O)N[C@@H](CCC#N)c2ccccc2)C1	ZINC000457678387	331230897	/nfs/dbraw/zinc/23/08/97/331230897.db2.gz	ZXSPXNWXBMYMHL-JCYILVPMSA-N	0	0	298.430	4.220	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)[C@H](CC)CC(F)F	ZINC000457769083	331233805	/nfs/dbraw/zinc/23/38/05/331233805.db2.gz	DOXVSJSNMZGQBF-OAHLLOKOSA-N	0	0	295.373	4.273	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)[C@@H](CC)CC(F)F	ZINC000457774851	331233971	/nfs/dbraw/zinc/23/39/71/331233971.db2.gz	JEJHDIIAAQXMNS-LBPRGKRZSA-N	0	0	281.346	4.425	20	30		CIEDRN
CCC[C@H](NC(=O)[C@H](C)c1cccc(C#N)c1)C1CCCC1	ZINC000458314884	331248288	/nfs/dbraw/zinc/24/82/88/331248288.db2.gz	DALKNURXZODNBU-KDOFPFPSSA-N	0	0	298.430	4.137	20	30		CIEDRN
CCC[C@@H](NC(=O)C[C@H](CC#N)c1ccccc1)C1CCC1	ZINC000458333301	331249139	/nfs/dbraw/zinc/24/91/39/331249139.db2.gz	OOISRZBZKSELMB-ZWKOTPCHSA-N	0	0	298.430	4.159	20	30		CIEDRN
C=CCCC1(C(=O)N[C@H](C)c2ccc(Cl)cc2)CC1	ZINC000458362277	331250046	/nfs/dbraw/zinc/25/00/46/331250046.db2.gz	HZHWVXODFBFELD-GFCCVEGCSA-N	0	0	277.795	4.264	20	30		CIEDRN
C[C@@H]1CC[C@H](C)N1C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000458797700	331259990	/nfs/dbraw/zinc/25/99/90/331259990.db2.gz	GNXJXCRLRSRKJQ-HLLBOEOZSA-N	0	0	299.418	4.004	20	30		CIEDRN
CCN(C(=O)N[C@H](CCCC#N)c1ccccc1)C1CCC1	ZINC000458804414	331260137	/nfs/dbraw/zinc/26/01/37/331260137.db2.gz	SMEHKKRRMHKYBY-QGZVFWFLSA-N	0	0	299.418	4.006	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)N(Cc1cccs1)C(C)C	ZINC000458815478	331261310	/nfs/dbraw/zinc/26/13/10/331261310.db2.gz	XUMCBAATIMOJCV-UHFFFAOYSA-N	0	0	294.464	4.270	20	30		CIEDRN
C=CCN(CC=C)C(=O)N[C@H](C)c1cccc(C2CC2)c1	ZINC000458872878	331262055	/nfs/dbraw/zinc/26/20/55/331262055.db2.gz	GTVGLNAIBTVLOB-CQSZACIVSA-N	0	0	284.403	4.009	20	30		CIEDRN
C=CC(C)(C)CNC(=O)N(CC)[C@H](C)c1ccc(F)cc1	ZINC000458982577	331263581	/nfs/dbraw/zinc/26/35/81/331263581.db2.gz	BKSGASJHYRNFAZ-CYBMUJFWSA-N	0	0	292.398	4.130	20	30		CIEDRN
C=C(C)CCNC(=O)N1CC[C@H](C)C[C@H]1c1ccc(C)o1	ZINC000459009260	331266244	/nfs/dbraw/zinc/26/62/44/331266244.db2.gz	VLPVMKQPPQNLLK-ZFWWWQNUSA-N	0	0	290.407	4.037	20	30		CIEDRN
C=C(C)CCNC(=O)N1CC[C@@H](C)C[C@H]1c1ccc(C)o1	ZINC000459009257	331266266	/nfs/dbraw/zinc/26/62/66/331266266.db2.gz	VLPVMKQPPQNLLK-HIFRSBDPSA-N	0	0	290.407	4.037	20	30		CIEDRN
CC(C)(C)c1ccc(NC(=O)NCC(C)(C)CC#N)cc1	ZINC000459225053	331272025	/nfs/dbraw/zinc/27/20/25/331272025.db2.gz	BMZUOAVHWZMFEG-UHFFFAOYSA-N	0	0	287.407	4.045	20	30		CIEDRN
CC(C)[C@]1(C)C[C@H]1NC(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000459264870	331274014	/nfs/dbraw/zinc/27/40/14/331274014.db2.gz	ZTBHQOZOZGRWIN-QAPCUYQASA-N	0	0	299.418	4.044	20	30		CIEDRN
CCC[C@@H](NC(=O)Nc1ccc(CC#N)cc1)C1CCCC1	ZINC000459273628	331274309	/nfs/dbraw/zinc/27/43/09/331274309.db2.gz	GCKUAHGHCHCMFH-QGZVFWFLSA-N	0	0	299.418	4.233	20	30		CIEDRN
N#C[C@H]1CCC[C@@H]1NCc1ccc(-c2ccsc2)cc1	ZINC000459452314	331282076	/nfs/dbraw/zinc/28/20/76/331282076.db2.gz	BLJAQORRASWMHI-WBVHZDCISA-N	0	0	282.412	4.197	20	30		CIEDRN
N#C[C@H]1CCC[C@@H]1NCc1ccc(-c2cccs2)cc1	ZINC000459482796	331284252	/nfs/dbraw/zinc/28/42/52/331284252.db2.gz	RNRSMDLPLOFJAE-CVEARBPZSA-N	0	0	282.412	4.197	20	30		CIEDRN
Cc1ccc(Cl)c(NC(=O)NCC(C)(C)CC#N)c1C	ZINC000459521121	331285691	/nfs/dbraw/zinc/28/56/91/331285691.db2.gz	DBDBXORNLARVCK-UHFFFAOYSA-N	0	0	293.798	4.018	20	30		CIEDRN
N#CCC[C@@H](C#N)CN1CC2(CCCC2)[C@@H]1c1ccccc1	ZINC000459576977	331288907	/nfs/dbraw/zinc/28/89/07/331288907.db2.gz	VNWZXNHQJZJPDQ-WMZOPIPTSA-N	0	0	293.414	4.047	20	30		CIEDRN
Cc1sc(NC(=O)CC(C)(C)C2CC2)c(C#N)c1C	ZINC000459844629	331302540	/nfs/dbraw/zinc/30/25/40/331302540.db2.gz	JPBIKZMTOHKSIK-UHFFFAOYSA-N	0	0	276.405	4.001	20	30		CIEDRN
Cc1sc(NC(=O)[C@]2(C)CCC[C@H]2C)c(C#N)c1C	ZINC000459848469	331302644	/nfs/dbraw/zinc/30/26/44/331302644.db2.gz	ZKLGZHMOJZCPCY-RFAUZJTJSA-N	0	0	276.405	4.001	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc(OCCC)cc1C	ZINC000460018598	331304435	/nfs/dbraw/zinc/30/44/35/331304435.db2.gz	IUKBHHQPNCXAKI-UHFFFAOYSA-N	0	0	275.392	4.325	20	30		CIEDRN
C=CCN(Cc1cccc(C#N)c1)C(=O)[C@@H](CC)CC(C)C	ZINC000460060957	331304885	/nfs/dbraw/zinc/30/48/85/331304885.db2.gz	LJMDTFZQPHJZIE-SFHVURJKSA-N	0	0	298.430	4.145	20	30		CIEDRN
CC(C)(C)c1ccccc1C(=O)Nc1cccc(C#N)c1	ZINC000166521698	331307397	/nfs/dbraw/zinc/30/73/97/331307397.db2.gz	FDMUHLAWTBYFRN-UHFFFAOYSA-N	0	0	278.355	4.108	20	30		CIEDRN
C=C(C)Cn1c([C@H](C)CC)nnc1N1CCCCC[C@@H]1C	ZINC000460960266	331309466	/nfs/dbraw/zinc/30/94/66/331309466.db2.gz	RGKMXLXQTDRDBW-CABCVRRESA-N	0	0	290.455	4.137	20	30		CIEDRN
N#Cc1ccc2c(c1)N(Cc1ccc(C(F)F)cc1)CC2	ZINC000461374976	331312608	/nfs/dbraw/zinc/31/26/08/331312608.db2.gz	LURBUHUCAILVPP-UHFFFAOYSA-N	0	0	284.309	4.059	20	30		CIEDRN
N#Cc1cccc(CNc2cccc(C3CCC3)c2)c1	ZINC000461724930	331314100	/nfs/dbraw/zinc/31/41/00/331314100.db2.gz	CVQPIUULSISJIC-UHFFFAOYSA-N	0	0	262.356	4.438	20	30		CIEDRN
Cc1ccccc1-c1noc([C@H](C)c2cccc(C#N)c2)n1	ZINC000461800091	331314789	/nfs/dbraw/zinc/31/47/89/331314789.db2.gz	ZIDYDCOTMMCEHN-CYBMUJFWSA-N	0	0	289.338	4.069	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1c(C)cccc1F	ZINC000461927342	331315539	/nfs/dbraw/zinc/31/55/39/331315539.db2.gz	UFNPVIKLYJDZGO-LBPRGKRZSA-N	0	0	264.344	4.000	20	30		CIEDRN
Cc1nc(NCC2CCC(F)(F)CC2)c(Cl)cc1C#N	ZINC000461957659	331316177	/nfs/dbraw/zinc/31/61/77/331316177.db2.gz	KUXNKTXKGXKOQO-UHFFFAOYSA-N	0	0	299.752	4.153	20	30		CIEDRN
CCCCCN(CCCCC)C(=O)N[C@H]1CCC[C@H]1C#N	ZINC000461961889	331316357	/nfs/dbraw/zinc/31/63/57/331316357.db2.gz	WISJIRFJCCZVCJ-HOTGVXAUSA-N	0	0	293.455	4.071	20	30		CIEDRN
C[C@H]1CCC[C@@](C#N)(NC(=O)c2cccc(C3CCC3)c2)C1	ZINC000462104671	331317351	/nfs/dbraw/zinc/31/73/51/331317351.db2.gz	LICAJFPRHNMRSJ-IFXJQAMLSA-N	0	0	296.414	4.156	20	30		CIEDRN
CCCc1ccc([C@H](NC(=O)CCCC#N)C(C)C)cc1	ZINC000462142666	331317963	/nfs/dbraw/zinc/31/79/63/331317963.db2.gz	WWFAAUMLFCMVNX-GOSISDBHSA-N	0	0	286.419	4.146	20	30		CIEDRN
CCCc1ccc([C@@H](NC(=O)CCCC#N)C(C)C)cc1	ZINC000462143098	331317964	/nfs/dbraw/zinc/31/79/64/331317964.db2.gz	WWFAAUMLFCMVNX-SFHVURJKSA-N	0	0	286.419	4.146	20	30		CIEDRN
CCC[C@]1(C)CCCN(C(=O)[C@@H](C)c2cccc(C#N)c2)C1	ZINC000462194234	331318209	/nfs/dbraw/zinc/31/82/09/331318209.db2.gz	ZUNHDJWDBUMLAY-HNAYVOBHSA-N	0	0	298.430	4.091	20	30		CIEDRN
CC(C)C[C@H]1CCCCN1C(=O)[C@H](C)c1cccc(C#N)c1	ZINC000462197287	331318264	/nfs/dbraw/zinc/31/82/64/331318264.db2.gz	CXTATUARHRJRRQ-CRAIPNDOSA-N	0	0	298.430	4.089	20	30		CIEDRN
CC(C)C[C@H]1CCCCN1C(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000462197288	331318287	/nfs/dbraw/zinc/31/82/87/331318287.db2.gz	CXTATUARHRJRRQ-MAUKXSAKSA-N	0	0	298.430	4.089	20	30		CIEDRN
Cc1ccc(NCCOc2cccc(C#N)c2)c(Cl)c1	ZINC000462208096	331318507	/nfs/dbraw/zinc/31/85/07/331318507.db2.gz	CEJXSRVOEDYFPF-UHFFFAOYSA-N	0	0	286.762	4.011	20	30		CIEDRN
Cc1c(Cl)cccc1NCCOc1cccc(C#N)c1	ZINC000462216110	331318531	/nfs/dbraw/zinc/31/85/31/331318531.db2.gz	WSZWPBGNCQSZPX-UHFFFAOYSA-N	0	0	286.762	4.011	20	30		CIEDRN
C[C@@H](CC1CCCCC1)NC(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000462314849	331319156	/nfs/dbraw/zinc/31/91/56/331319156.db2.gz	IBVVFOQQUOUXIM-GJZGRUSLSA-N	0	0	298.430	4.137	20	30		CIEDRN
C[C@@H](C(=O)N[C@@H](C)CC1CCCCC1)c1cccc(C#N)c1	ZINC000462314850	331319184	/nfs/dbraw/zinc/31/91/84/331319184.db2.gz	IBVVFOQQUOUXIM-LSDHHAIUSA-N	0	0	298.430	4.137	20	30		CIEDRN
C=CCCC[C@H](C)Sc1nnc(C(C)(C)C)o1	ZINC000462384230	331321119	/nfs/dbraw/zinc/32/11/19/331321119.db2.gz	MKVSBZYLXZBZPL-JTQLQIEISA-N	0	0	254.399	4.204	20	30		CIEDRN
C[C@H]1CCCN(c2c(C#N)cnc3ccc(Cl)cc32)CC1	ZINC000462389468	331321153	/nfs/dbraw/zinc/32/11/53/331321153.db2.gz	RUUGARHXKPGTRB-LBPRGKRZSA-N	0	0	299.805	4.386	20	30		CIEDRN
CC(C)(C)C[C@H]1CCCN1c1ccc(C#N)cc1F	ZINC000462805244	331329858	/nfs/dbraw/zinc/32/98/58/331329858.db2.gz	GXRAVJRVTLWFIQ-CYBMUJFWSA-N	0	0	260.356	4.102	20	30		CIEDRN
N#Cc1cc(F)ccc1N1CCC[C@@H](Cc2ccccc2)C1	ZINC000462820630	331331011	/nfs/dbraw/zinc/33/10/11/331331011.db2.gz	ORBRJYDWZAVWKY-INIZCTEOSA-N	0	0	294.373	4.156	20	30		CIEDRN
CCS[C@@H]1CCCCN(c2c(Cl)cccc2C#N)C1	ZINC000462832294	331332020	/nfs/dbraw/zinc/33/20/20/331332020.db2.gz	FHTGHXRUUSVBNK-CYBMUJFWSA-N	0	0	294.851	4.324	20	30		CIEDRN
C[C@H]1C[C@H](c2ccc(F)cc2)CN1c1ccc(F)cc1C#N	ZINC000462857560	331332869	/nfs/dbraw/zinc/33/28/69/331332869.db2.gz	SRWHLOCXEYHCML-WFASDCNBSA-N	0	0	298.336	4.219	20	30		CIEDRN
CS[C@H]1CCC[C@H](Nc2c(Cl)cccc2C#N)C1	ZINC000462868841	331333291	/nfs/dbraw/zinc/33/32/91/331333291.db2.gz	STDINNJWZAKSLM-RYUDHWBXSA-N	0	0	280.824	4.298	20	30		CIEDRN
N#Cc1csc(CNc2cccc(C3CCC3)c2)c1	ZINC000462874646	331333536	/nfs/dbraw/zinc/33/35/36/331333536.db2.gz	QLLNVYJCTVCPPU-UHFFFAOYSA-N	0	0	268.385	4.499	20	30		CIEDRN
N#Cc1cccc(Cl)c1N1CC[C@@H](Cc2ccccc2)C1	ZINC000462875884	331333697	/nfs/dbraw/zinc/33/36/97/331333697.db2.gz	UNEZKOQMWACMTL-HNNXBMFYSA-N	0	0	296.801	4.281	20	30		CIEDRN
CO[C@@H](CNc1ccc(C#N)cc1)c1ccc(Cl)cc1	ZINC000462890073	331334125	/nfs/dbraw/zinc/33/41/25/331334125.db2.gz	AOPDDOFWEXUWJC-INIZCTEOSA-N	0	0	286.762	4.011	20	30		CIEDRN
C[C@H]1CN(c2cccc(F)c2C#N)CC[C@@H]1c1ccccc1	ZINC000462903145	331334473	/nfs/dbraw/zinc/33/44/73/331334473.db2.gz	QSBAWZORKBBBDW-HOCLYGCPSA-N	0	0	294.373	4.327	20	30		CIEDRN
CC[C@@H](CC#N)NCc1ccc(C2CCCC2)cc1	ZINC000462916230	331334995	/nfs/dbraw/zinc/33/49/95/331334995.db2.gz	YWTQKPNUVJPTKK-KRWDZBQOSA-N	0	0	256.393	4.126	20	30		CIEDRN
N#Cc1cc(F)ccc1NCCCSc1ccccc1	ZINC000462916964	331335062	/nfs/dbraw/zinc/33/50/62/331335062.db2.gz	LYGHOFLYYJRZHK-UHFFFAOYSA-N	0	0	286.375	4.292	20	30		CIEDRN
C[C@H](CNc1ccc(C#N)cc1)c1ccc(F)cc1F	ZINC000463007886	331336918	/nfs/dbraw/zinc/33/69/18/331336918.db2.gz	DXMXXMGSIMSJJZ-LLVKDONJSA-N	0	0	272.298	4.052	20	30		CIEDRN
C[C@@H](c1nc(CCC(C)(C)C)no1)c1cccc(C#N)c1	ZINC000463047783	331338638	/nfs/dbraw/zinc/33/86/38/331338638.db2.gz	GWMIWSXCYLFULM-GFCCVEGCSA-N	0	0	283.375	4.072	20	30		CIEDRN
C[C@H](CCc1ccsc1)Nc1ccc(CC#N)cc1	ZINC000463054898	331338867	/nfs/dbraw/zinc/33/88/67/331338867.db2.gz	SMYJCQDMAUVVBA-CYBMUJFWSA-N	0	0	270.401	4.247	20	30		CIEDRN
CCC1(c2noc([C@@H](C)c3cccc(C#N)c3)n2)CCCC1	ZINC000463054668	331338889	/nfs/dbraw/zinc/33/88/89/331338889.db2.gz	MOKUPSHYMPAVAZ-ZDUSSCGKSA-N	0	0	295.386	4.315	20	30		CIEDRN
CCc1cccc(C)c1NC(=O)[C@H](C)c1cccc(C#N)c1	ZINC000463068142	331339176	/nfs/dbraw/zinc/33/91/76/331339176.db2.gz	GKZHKNNVJVYFDI-CQSZACIVSA-N	0	0	292.382	4.171	20	30		CIEDRN
C[C@H](CNc1cccc(F)c1C#N)Sc1ccccc1	ZINC000463081021	331339790	/nfs/dbraw/zinc/33/97/90/331339790.db2.gz	HRJDAKCKVQHQMR-GFCCVEGCSA-N	0	0	286.375	4.290	20	30		CIEDRN
N#Cc1ccc(Sc2nc3cc(F)ccc3o2)c(F)c1	ZINC000463080121	331339860	/nfs/dbraw/zinc/33/98/60/331339860.db2.gz	RTMRHMZTVNMPNT-UHFFFAOYSA-N	0	0	288.278	4.129	20	30		CIEDRN
C=CCCNc1ccc(Oc2ccccc2C#N)c(F)c1	ZINC000463226201	331342912	/nfs/dbraw/zinc/34/29/12/331342912.db2.gz	VZXPGPJSKKSVOY-UHFFFAOYSA-N	0	0	282.318	4.478	20	30		CIEDRN
CCc1ccc(N[C@@H]2CCC[C@H](C#N)C2)cc1CC	ZINC000463236542	331343559	/nfs/dbraw/zinc/34/35/59/331343559.db2.gz	LLCMGBOHZHEZQF-XJKSGUPXSA-N	0	0	256.393	4.306	20	30		CIEDRN
CC(C)(C#N)CCSc1n[nH]c(C=Cc2ccccc2)n1	ZINC000463262665	331344649	/nfs/dbraw/zinc/34/46/49/331344649.db2.gz	SZLBKCCBVVLFTI-HJWRWDBZSA-N	0	0	298.415	4.007	20	30		CIEDRN
C=CCN(CC=C)C(=O)[C@H](Sc1ccccc1)C(C)C	ZINC000463266046	331344733	/nfs/dbraw/zinc/34/47/33/331344733.db2.gz	MMEVCWQAJQLDAS-MRXNPFEDSA-N	0	0	289.444	4.004	20	30		CIEDRN
Cc1ccc(Br)c(N[C@H]2CCC[C@@H](C#N)C2)c1	ZINC000463290786	331345421	/nfs/dbraw/zinc/34/54/21/331345421.db2.gz	LCQVLCXYOZEVDP-NEPJUHHUSA-N	0	0	293.208	4.252	20	30		CIEDRN
CCCCOc1ccccc1N[C@H]1CCC[C@@H](C#N)C1	ZINC000463290701	331345457	/nfs/dbraw/zinc/34/54/57/331345457.db2.gz	UCLRDVMKFJHQDM-CABCVRRESA-N	0	0	272.392	4.360	20	30		CIEDRN
CC(C)[C@H](C(=O)Nc1ccc(F)c(C#N)c1)c1ccccc1	ZINC000463483067	331348437	/nfs/dbraw/zinc/34/84/37/331348437.db2.gz	VZQIFZXAZNKNMZ-KRWDZBQOSA-N	0	0	296.345	4.076	20	30		CIEDRN
CCCCC[C@@H]1CCCN1c1ccc([N+](=O)[O-])c(C#N)c1	ZINC000463659479	331350321	/nfs/dbraw/zinc/35/03/21/331350321.db2.gz	WZBKPNISYRTTPO-CQSZACIVSA-N	0	0	287.363	4.016	20	30		CIEDRN
C=CC[C@H](C)NC(=O)c1ccc(-c2ccc(CC)cc2)o1	ZINC000463728158	331351008	/nfs/dbraw/zinc/35/10/08/331351008.db2.gz	IZEPBWOGWINYCG-ZDUSSCGKSA-N	0	0	283.371	4.203	20	30		CIEDRN
CC(C)[C@H](C#N)NC(=O)c1ccc(C2CCCCC2)cc1	ZINC000463822984	331352119	/nfs/dbraw/zinc/35/21/19/331352119.db2.gz	BCPILZPFKPCJSY-KRWDZBQOSA-N	0	0	284.403	4.012	20	30		CIEDRN
C=CCN(C(=O)Nc1cccc(C2CCC2)c1)C1CC1	ZINC000463859551	331352590	/nfs/dbraw/zinc/35/25/90/331352590.db2.gz	ZDTWLVXURVLNSI-UHFFFAOYSA-N	0	0	270.376	4.136	20	30		CIEDRN
CC#CCS[C@H](C)c1nc(-c2ccc(C)c(F)c2)no1	ZINC000464094617	331356823	/nfs/dbraw/zinc/35/68/23/331356823.db2.gz	IGWZAJDVXIQBMU-LLVKDONJSA-N	0	0	290.363	4.002	20	30		CIEDRN
CCCC[C@H](CC)CC(=O)N[C@@](C)(C#N)C(C)(C)C	ZINC000464155341	331357189	/nfs/dbraw/zinc/35/71/89/331357189.db2.gz	CUWLCPBIJNACMP-BBRMVZONSA-N	0	0	266.429	4.037	20	30		CIEDRN
C[C@H](CC1CCCCC1)C(=O)N[C@@](C)(C#N)C(C)(C)C	ZINC000464158096	331357290	/nfs/dbraw/zinc/35/72/90/331357290.db2.gz	MAKCTTXOZYLZRV-DYVFJYSZSA-N	0	0	278.440	4.037	20	30		CIEDRN
CC(C)(C)[C@](C)(C#N)NC(=O)C[C@@H]1CCCC(C)(C)C1	ZINC000464165602	331357399	/nfs/dbraw/zinc/35/73/99/331357399.db2.gz	FVNWGJKHRNBKOC-GUYCJALGSA-N	0	0	278.440	4.037	20	30		CIEDRN
Cc1cc2cc(C(=O)N[C@@](C)(C#N)C(C)(C)C)oc2cc1C	ZINC000464169702	331357446	/nfs/dbraw/zinc/35/74/46/331357446.db2.gz	MGJHZQZCLADTGR-SFHVURJKSA-N	0	0	298.386	4.108	20	30		CIEDRN
CCC(C)(C)[C@H]1CCCN1C(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000464213357	331358059	/nfs/dbraw/zinc/35/80/59/331358059.db2.gz	XLKNPWZDNZTHDO-WMLDXEAASA-N	0	0	298.430	4.089	20	30		CIEDRN
CC(C)(C)[C@@](C)(C#N)NC(=O)c1ccc(C2CCCC2)cc1	ZINC000464291857	331359388	/nfs/dbraw/zinc/35/93/88/331359388.db2.gz	SISQLONIPYGZDX-LJQANCHMSA-N	0	0	298.430	4.402	20	30		CIEDRN
Cc1ccc(-c2ccsc2C(=O)N[C@@H](C#N)C(C)C)cc1	ZINC000464292327	331359399	/nfs/dbraw/zinc/35/93/99/331359399.db2.gz	DPLVXONIFZOPNZ-HNNXBMFYSA-N	0	0	298.411	4.002	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)[C@H](CC)c1ccccc1	ZINC000464321995	331359713	/nfs/dbraw/zinc/35/97/13/331359713.db2.gz	RVVSOWZADZMRGJ-GOSISDBHSA-N	0	0	297.398	4.031	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](CC)c1ccc(C)cc1	ZINC000464443844	331360328	/nfs/dbraw/zinc/36/03/28/331360328.db2.gz	BZGYWIBOKFMJNS-ZBFHGGJFSA-N	0	0	259.393	4.165	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC)[C@@H](C)c1ccc(F)cc1	ZINC000464435415	331360488	/nfs/dbraw/zinc/36/04/88/331360488.db2.gz	DAWXCVJJVIDWON-KBPBESRZSA-N	0	0	277.383	4.338	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ncc(-c2ccccc2)s1	ZINC000464439341	331360541	/nfs/dbraw/zinc/36/05/41/331360541.db2.gz	OGPSUVWEMPBUPQ-GFCCVEGCSA-N	0	0	286.400	4.351	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)CCC1CCCCC1	ZINC000464437236	331360630	/nfs/dbraw/zinc/36/06/30/331360630.db2.gz	NYWOSXUGUDWXDZ-CQSZACIVSA-N	0	0	251.414	4.018	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H](CC(C)C)c1cccs1	ZINC000464440873	331360720	/nfs/dbraw/zinc/36/07/20/331360720.db2.gz	SOZFHMZGJOVRQW-AWEZNQCLSA-N	0	0	277.433	4.145	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccc(Oc2ccccc2)cn1	ZINC000464440815	331360728	/nfs/dbraw/zinc/36/07/28/331360728.db2.gz	RXCWDEOOONKBRV-UHFFFAOYSA-N	0	0	294.354	4.006	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](CCC)Cc1ccccc1	ZINC000464445526	331360753	/nfs/dbraw/zinc/36/07/53/331360753.db2.gz	XCRNKTYHFHVKLI-WBVHZDCISA-N	0	0	273.420	4.116	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H]1CCC[C@@H]1CCCC	ZINC000464443536	331360765	/nfs/dbraw/zinc/36/07/65/331360765.db2.gz	RLTFBIJOESFEJD-KKUMJFAQSA-N	0	0	251.414	4.064	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccc(OCCC)c(Cl)c1	ZINC000464442586	331360805	/nfs/dbraw/zinc/36/08/05/331360805.db2.gz	OSHRDMRICDKBFU-UHFFFAOYSA-N	0	0	293.794	4.261	20	30		CIEDRN
C=C(C)[C@@H](NC(=O)C(CC)CC)c1ccc(F)c(F)c1	ZINC000464447745	331360837	/nfs/dbraw/zinc/36/08/37/331360837.db2.gz	MGNNYOOEVLBUQF-OAHLLOKOSA-N	0	0	281.346	4.134	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@@H](C)c1cc(C)ccc1C	ZINC000464525797	331361823	/nfs/dbraw/zinc/36/18/23/331361823.db2.gz	OPXNGNPQRNOLHS-HOTGVXAUSA-N	0	0	273.420	4.425	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CCC)Cc1ccc(F)cc1	ZINC000464530988	331361945	/nfs/dbraw/zinc/36/19/45/331361945.db2.gz	VSXGMZFAEYKKGW-CQSZACIVSA-N	0	0	277.383	4.167	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CCC(C)C)C1CCCC1	ZINC000464552504	331362399	/nfs/dbraw/zinc/36/23/99/331362399.db2.gz	HDYUZXHCVXPHDX-OAHLLOKOSA-N	0	0	265.441	4.406	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC)Cc1cccc(Cl)c1	ZINC000464553227	331362412	/nfs/dbraw/zinc/36/24/12/331362412.db2.gz	REYPNWIDZRKAPN-ZDUSSCGKSA-N	0	0	279.811	4.291	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CC[C@@H]2CCCC[C@@H]2C1	ZINC000464561343	331362569	/nfs/dbraw/zinc/36/25/69/331362569.db2.gz	TUUYPFASDBHXRX-CAOSSQGBSA-N	0	0	263.425	4.064	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccnn1[C@H](C)CC(C)C	ZINC000464563419	331362574	/nfs/dbraw/zinc/36/25/74/331362574.db2.gz	JZZCVSUOKSQBOD-UONOGXRCSA-N	0	0	277.412	4.031	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC)Cc1ccc(Cl)cc1	ZINC000464559708	331362582	/nfs/dbraw/zinc/36/25/82/331362582.db2.gz	KJBDFHDMFOLRGG-CYBMUJFWSA-N	0	0	279.811	4.291	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@H]1CCCCC12CCCC2	ZINC000464560164	331362620	/nfs/dbraw/zinc/36/26/20/331362620.db2.gz	LZEVXAFUIMHZJB-HNNXBMFYSA-N	0	0	278.440	4.097	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCCCC1CCCCC1	ZINC000464566126	331362721	/nfs/dbraw/zinc/36/27/21/331362721.db2.gz	DFOWYKZZCVJWBN-AWEZNQCLSA-N	0	0	251.414	4.065	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCc1ccc(Cl)cc1Cl	ZINC000464565789	331362753	/nfs/dbraw/zinc/36/27/53/331362753.db2.gz	BBIJMKUJKNIPHY-JTQLQIEISA-N	0	0	286.202	4.212	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000464568741	331362818	/nfs/dbraw/zinc/36/28/18/331362818.db2.gz	UWUAUERUVXPMKA-SNVBAGLBSA-N	0	0	287.281	4.126	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(Cc1ccc(C#N)cc1)CC(C)C	ZINC000464573072	331362899	/nfs/dbraw/zinc/36/28/99/331362899.db2.gz	XERCMRDKKMTTQY-INIZCTEOSA-N	0	0	298.430	4.145	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1nc2ccc(C)cc2s1	ZINC000464571770	331362969	/nfs/dbraw/zinc/36/29/69/331362969.db2.gz	SYROCKPFNIFPMW-NSHDSACASA-N	0	0	274.389	4.146	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC)c1ccc(OCC)cc1	ZINC000464571436	331362973	/nfs/dbraw/zinc/36/29/73/331362973.db2.gz	OQLCGYZOQNXQOJ-AWEZNQCLSA-N	0	0	275.392	4.041	20	30		CIEDRN
CC[C@@H](CC(=O)Nc1ccc(C#N)c(F)c1)c1ccccc1	ZINC000464641602	331363994	/nfs/dbraw/zinc/36/39/94/331363994.db2.gz	FDOLTTFJYDNJDR-ZDUSSCGKSA-N	0	0	296.345	4.220	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(-c2ccccc2)cn1	ZINC000464646503	331364093	/nfs/dbraw/zinc/36/40/93/331364093.db2.gz	HQBRHKVPFQNBFI-CQSZACIVSA-N	0	0	280.371	4.289	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(O[C@@H](C)CC)cc1	ZINC000464647877	331364180	/nfs/dbraw/zinc/36/41/80/331364180.db2.gz	CDULQDAAKYFTQG-KBPBESRZSA-N	0	0	275.392	4.405	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCc1ccc2[nH]c(C)c(C)c2c1	ZINC000464648280	331364192	/nfs/dbraw/zinc/36/41/92/331364192.db2.gz	NDWDYURUQPMUIA-GFCCVEGCSA-N	0	0	284.403	4.003	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(O[C@@H](C)CC)cc1	ZINC000464647878	331364235	/nfs/dbraw/zinc/36/42/35/331364235.db2.gz	CDULQDAAKYFTQG-KGLIPLIRSA-N	0	0	275.392	4.405	20	30		CIEDRN
CCC[C@@H](CC1CCCC1)C(=O)N[C@@H](C#N)C(C)(C)C	ZINC000464710254	331365121	/nfs/dbraw/zinc/36/51/21/331365121.db2.gz	JSQDNRCCNQOHQU-GJZGRUSLSA-N	0	0	278.440	4.037	20	30		CIEDRN
N#CCN(C1CC1)[C@@H]1CCCC[C@@H]1C1CCCCC1	ZINC000464728966	331365485	/nfs/dbraw/zinc/36/54/85/331365485.db2.gz	HPGHQSJITFDSAW-IAGOWNOFSA-N	0	0	260.425	4.113	20	30		CIEDRN
C=C[C@H](C)NC(=O)N(C)[C@@H](C)[C@H](C)c1ccc(Cl)cc1	ZINC000464752926	331365590	/nfs/dbraw/zinc/36/55/90/331365590.db2.gz	QFLNJIRQSVKSPH-AVGNSLFASA-N	0	0	294.826	4.048	20	30		CIEDRN
C=C[C@@H](C)NC(=O)c1cc(C)c(-c2ccc(F)cc2)s1	ZINC000465106014	331378487	/nfs/dbraw/zinc/37/84/87/331378487.db2.gz	BRBWRMUKEKXDTF-LLVKDONJSA-N	0	0	289.375	4.167	20	30		CIEDRN
C=C[C@H](C)NC(=O)Nc1ccccc1Oc1ccccc1	ZINC000465179671	331380328	/nfs/dbraw/zinc/38/03/28/331380328.db2.gz	QVCSSCROYMMBDZ-ZDUSSCGKSA-N	0	0	282.343	4.175	20	30		CIEDRN
C=C[C@H](C)NC(=O)N[C@H](c1cccs1)C(CC)CC	ZINC000465287312	331381312	/nfs/dbraw/zinc/38/13/12/331381312.db2.gz	CPGHCFVANYVZLX-FZMZJTMJSA-N	0	0	280.437	4.099	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@@H](CCC)CCc1ccccc1	ZINC000466052255	331388953	/nfs/dbraw/zinc/38/89/53/331388953.db2.gz	ATECAZRVZIUFLM-WBVHZDCISA-N	0	0	288.435	4.052	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)N[C@H](C)C[C@H](C)CC	ZINC000466166820	331390317	/nfs/dbraw/zinc/39/03/17/331390317.db2.gz	OCPDDZKEIHXJHJ-ZIAGYGMSSA-N	0	0	294.464	4.270	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCC1(C)CCCCCC1	ZINC000466251547	331391681	/nfs/dbraw/zinc/39/16/81/331391681.db2.gz	IPGWDZLRZLVBQN-CQSZACIVSA-N	0	0	251.414	4.065	20	30		CIEDRN
CC#CCCCC(=O)N1CCCCc2c(Cl)cccc21	ZINC000466246151	331391653	/nfs/dbraw/zinc/39/16/53/331391653.db2.gz	YAHBXDKQZZKJNV-UHFFFAOYSA-N	0	0	289.806	4.203	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000466267860	331391933	/nfs/dbraw/zinc/39/19/33/331391933.db2.gz	YRTKJPUQKITGJU-XBOKISCZSA-N	0	0	283.415	4.293	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCCc1c(C)oc2ccccc21	ZINC000466310420	331392590	/nfs/dbraw/zinc/39/25/90/331392590.db2.gz	ZRDZFKLSOPZUEY-CYBMUJFWSA-N	0	0	285.387	4.002	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](C)C2(CCCCC2)C1	ZINC000466314255	331392635	/nfs/dbraw/zinc/39/26/35/331392635.db2.gz	MKTPWIAEMKUELI-CVEARBPZSA-N	0	0	277.452	4.408	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCC1(CC)CCCCC1	ZINC000466316867	331392700	/nfs/dbraw/zinc/39/27/00/331392700.db2.gz	HVSKTBSNBOHAGY-AWEZNQCLSA-N	0	0	251.414	4.065	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(CC1CCCCC1)C1CC1	ZINC000466326438	331392893	/nfs/dbraw/zinc/39/28/93/331392893.db2.gz	RRGXRGSUBULAEC-OAHLLOKOSA-N	0	0	278.440	4.095	20	30		CIEDRN
C=C(C)COc1cccc(NCc2cn(C(C)C)nc2C)c1	ZINC000466344537	331393002	/nfs/dbraw/zinc/39/30/02/331393002.db2.gz	BHUPWNBYRWYIKY-UHFFFAOYSA-N	0	0	299.418	4.339	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)NCc1ccc(Cl)cc1Cl	ZINC000466361834	331393416	/nfs/dbraw/zinc/39/34/16/331393416.db2.gz	YSVWJYYQLJNADB-CQSZACIVSA-N	0	0	286.202	4.212	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)NCc1ccc(Cl)cc1Cl	ZINC000466361833	331393466	/nfs/dbraw/zinc/39/34/66/331393466.db2.gz	YSVWJYYQLJNADB-AWEZNQCLSA-N	0	0	286.202	4.212	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(C)Cc1ccc2ccccc2c1	ZINC000466366474	331393574	/nfs/dbraw/zinc/39/35/74/331393574.db2.gz	HZVQKZSPINHDAG-SFHVURJKSA-N	0	0	296.414	4.336	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(C)[C@H](CC)Cc1ccccc1	ZINC000466367051	331393600	/nfs/dbraw/zinc/39/36/00/331393600.db2.gz	OVACJWDQFVUSQI-DLBZAZTESA-N	0	0	288.435	4.004	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1ccc(Cl)cc1C	ZINC000466367291	331393648	/nfs/dbraw/zinc/39/36/48/331393648.db2.gz	RYEOSHCJRNZEBA-GFCCVEGCSA-N	0	0	266.772	4.125	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CCC[C@@H]1CCCCC	ZINC000466377603	331393901	/nfs/dbraw/zinc/39/39/01/331393901.db2.gz	FXOHQVHBQYSLKD-GJZGRUSLSA-N	0	0	266.429	4.095	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1cccc(COC(C)C)c1	ZINC000466377507	331393942	/nfs/dbraw/zinc/39/39/42/331393942.db2.gz	FHUHLWAFZVINEJ-OAHLLOKOSA-N	0	0	290.407	4.088	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(C)Cc1ccc(C(C)C)cc1	ZINC000466378294	331394037	/nfs/dbraw/zinc/39/40/37/331394037.db2.gz	KPWLHHKQLRDKIU-KRWDZBQOSA-N	0	0	288.435	4.306	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(Cc1ccco1)C1CCCC1	ZINC000466386529	331394361	/nfs/dbraw/zinc/39/43/61/331394361.db2.gz	PUHNZOWEPYXXPV-CQSZACIVSA-N	0	0	290.407	4.089	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000466385947	331394389	/nfs/dbraw/zinc/39/43/89/331394389.db2.gz	LXPFFIULGGQKDK-UHFFFAOYSA-N	0	0	273.163	4.033	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CCC[C@@H]1c1cccc(C)c1	ZINC000466406326	331395394	/nfs/dbraw/zinc/39/53/94/331395394.db2.gz	SYOPZSODSXJPGQ-DLBZAZTESA-N	0	0	286.419	4.196	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NC(C)(C)c1cccc(Cl)c1	ZINC000466414465	331395780	/nfs/dbraw/zinc/39/57/80/331395780.db2.gz	APUSWQYDEVGGPU-GFCCVEGCSA-N	0	0	279.811	4.294	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCCC[C@H]1[C@@H](C)CC	ZINC000466418682	331396040	/nfs/dbraw/zinc/39/60/40/331396040.db2.gz	ZSKGULQSJSDJET-KKUMJFAQSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](c1ccccc1C)C(C)C	ZINC000466418054	331396067	/nfs/dbraw/zinc/39/60/67/331396067.db2.gz	UMFGVZJGUUKWGX-NVXWUHKLSA-N	0	0	273.420	4.411	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(OC(C)(C)C)cc1	ZINC000466428316	331396831	/nfs/dbraw/zinc/39/68/31/331396831.db2.gz	KWSZLLQEJXBXIQ-CYBMUJFWSA-N	0	0	275.392	4.405	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H](CC)C(C)(C)c1ccccc1	ZINC000466432742	331396899	/nfs/dbraw/zinc/39/68/99/331396899.db2.gz	YYYGBPVIKBSTBV-KRWDZBQOSA-N	0	0	285.431	4.053	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cc(-c2ccccc2)ns1	ZINC000466429839	331396955	/nfs/dbraw/zinc/39/69/55/331396955.db2.gz	DRNJXNXLCROKAG-GFCCVEGCSA-N	0	0	286.400	4.351	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@H](C)Cc1ccc(Cl)cc1	ZINC000466433978	331397004	/nfs/dbraw/zinc/39/70/04/331397004.db2.gz	MPWJNMKUVJUZKM-ZIAGYGMSSA-N	0	0	293.838	4.332	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC)[C@@H](CC)Cc1ccccc1	ZINC000466437455	331397087	/nfs/dbraw/zinc/39/70/87/331397087.db2.gz	BJQXQSPSFXMOJC-WMZOPIPTSA-N	0	0	287.447	4.459	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NC[C@@H]1CCC[C@H](C(F)(F)F)C1	ZINC000466437437	331397095	/nfs/dbraw/zinc/39/70/95/331397095.db2.gz	BVDVMGNYNLDOKD-XQQFMLRXSA-N	0	0	291.357	4.074	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)[C@H](C)CC(=C)C	ZINC000466439270	331397104	/nfs/dbraw/zinc/39/71/04/331397104.db2.gz	WJWMCPCTGSJGLU-OAHLLOKOSA-N	0	0	263.425	4.184	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CC(C)(C)c2ccccc21	ZINC000466437560	331397136	/nfs/dbraw/zinc/39/71/36/331397136.db2.gz	CUBNDCUCMFAZIP-CZUORRHYSA-N	0	0	271.404	4.128	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cccc(CSCC)c1	ZINC000466438714	331397155	/nfs/dbraw/zinc/39/71/55/331397155.db2.gz	OOOMVLXENCPPDO-ZDUSSCGKSA-N	0	0	277.433	4.481	20	30		CIEDRN
N#Cc1ccccc1SCc1ccc(F)cc1F	ZINC000466483373	331398213	/nfs/dbraw/zinc/39/82/13/331398213.db2.gz	VTVUVZZRNMXUKR-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
C=CCn1c(SCC/C=C\CC)nnc1-c1ccco1	ZINC000466495505	331398511	/nfs/dbraw/zinc/39/85/11/331398511.db2.gz	MSUWWMZTJDUWIX-WAYWQWQTSA-N	0	0	289.404	4.173	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1sc2cccc(F)c2c1C	ZINC000466525744	331399045	/nfs/dbraw/zinc/39/90/45/331399045.db2.gz	CFRYTMMTYUBTBQ-LLVKDONJSA-N	0	0	291.391	4.433	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)[C@H](OC(C)(C)C)c1ccccc1	ZINC000466529205	331399166	/nfs/dbraw/zinc/39/91/66/331399166.db2.gz	NMITTWPTOKRDEK-HZPDHXFCSA-N	0	0	289.419	4.014	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1cc(C2CC2)nc2ccccc21	ZINC000466529081	331399198	/nfs/dbraw/zinc/39/91/98/331399198.db2.gz	QBSCQVVOQZXVAN-AWEZNQCLSA-N	0	0	294.398	4.197	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)CCOc1ccc2ccccc2c1	ZINC000466535219	331399388	/nfs/dbraw/zinc/39/93/88/331399388.db2.gz	XOHBQAFFVIJNIF-QGZVFWFLSA-N	0	0	297.398	4.080	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)C1(c2cccs2)CCCCC1	ZINC000466539698	331399465	/nfs/dbraw/zinc/39/94/65/331399465.db2.gz	IEXLJLZYUXEHSL-AWEZNQCLSA-N	0	0	291.460	4.421	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@H](CC)Sc1ccccc1	ZINC000466542388	331399541	/nfs/dbraw/zinc/39/95/41/331399541.db2.gz	QMKPJQZPPLZPQI-ZFWWWQNUSA-N	0	0	277.433	4.028	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@](C)(CCc2ccccc2)C1	ZINC000466544061	331399590	/nfs/dbraw/zinc/39/95/90/331399590.db2.gz	NCEORKGGLVOEMJ-PXNSSMCTSA-N	0	0	299.458	4.460	20	30		CIEDRN
C=CCCN(C)C(=O)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl	ZINC000466649380	331400659	/nfs/dbraw/zinc/40/06/59/331400659.db2.gz	ZYTBMCLLCIDEFV-CHWSQXEVSA-N	0	0	298.213	4.131	20	30		CIEDRN
C=CCCN(C)C(=O)[C@H]1C[C@H]1c1cccc(Cl)c1Cl	ZINC000466641291	331401341	/nfs/dbraw/zinc/40/13/41/331401341.db2.gz	SEGAKALPCRBRBA-RYUDHWBXSA-N	0	0	298.213	4.131	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cnn([C@@H](C)CC)c1C1CC1	ZINC000466643921	331401536	/nfs/dbraw/zinc/40/15/36/331401536.db2.gz	HBFHMFOUCSVKHG-OLZOCXBDSA-N	0	0	289.423	4.272	20	30		CIEDRN
C[C@@H](SCCCSCC#N)c1ccc(F)cc1	ZINC000466653803	331401870	/nfs/dbraw/zinc/40/18/70/331401870.db2.gz	JVHGUWGUOXFNMP-LLVKDONJSA-N	0	0	269.410	4.267	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](C)Oc2ccc(Cl)cc21	ZINC000466858144	331406530	/nfs/dbraw/zinc/40/65/30/331406530.db2.gz	GIEOZDYSVFBKTA-VXGBXAGGSA-N	0	0	293.794	4.056	20	30		CIEDRN
CC#CCCCC(=O)N1c2ccccc2S[C@@H](C)[C@@H]1C	ZINC000466872095	331406946	/nfs/dbraw/zinc/40/69/46/331406946.db2.gz	VQLXWGADUHVNCC-KBPBESRZSA-N	0	0	287.428	4.096	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1nc2c(ccc(F)c2F)s1	ZINC000466879158	331407047	/nfs/dbraw/zinc/40/70/47/331407047.db2.gz	XTRQWGJEKUOPIO-MRVPVSSYSA-N	0	0	296.342	4.115	20	30		CIEDRN
C=CCCN(C)C(=O)[C@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1	ZINC000467080330	331410820	/nfs/dbraw/zinc/41/08/20/331410820.db2.gz	FJWMAWOPVDCBFA-KGLIPLIRSA-N	0	0	298.213	4.131	20	30		CIEDRN
C=CCCN(C)C(=O)N[C@@H](CC(C)C)c1ccccc1C	ZINC000467105015	331411157	/nfs/dbraw/zinc/41/11/57/331411157.db2.gz	DBLIZJDSLAWSJN-KRWDZBQOSA-N	0	0	288.435	4.300	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)NCCC1=CCCCCC1	ZINC000467175943	331411707	/nfs/dbraw/zinc/41/17/07/331411707.db2.gz	LVRUYZKRYOTXFL-UHFFFAOYSA-N	0	0	297.402	4.269	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@@H](Cc2ccccc2)C1	ZINC000467318497	331415003	/nfs/dbraw/zinc/41/50/03/331415003.db2.gz	QGGFDVOFOGNDLI-SFHVURJKSA-N	0	0	297.442	4.236	20	30		CIEDRN
N#C[C@@H]1CCC[C@H](Nc2ccc(F)c(C3CC3)c2)C1	ZINC000467446027	331419710	/nfs/dbraw/zinc/41/97/10/331419710.db2.gz	UYWVUCRFDHNGTK-YPMHNXCESA-N	0	0	258.340	4.197	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@H]1Cc1ccccc1C	ZINC000467529238	331421163	/nfs/dbraw/zinc/42/11/63/331421163.db2.gz	LJAWGVAMITZTKB-IBGZPJMESA-N	0	0	297.442	4.297	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H]1CC[C@H]2CCCC[C@H]2C1	ZINC000467733481	331423428	/nfs/dbraw/zinc/42/34/28/331423428.db2.gz	WXTLSYBEDQJNFO-HYVNUMGLSA-N	0	0	275.436	4.230	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(F)ccc1NC(C)C	ZINC000467757637	331423852	/nfs/dbraw/zinc/42/38/52/331423852.db2.gz	IIHJURIUDPEKJX-LBPRGKRZSA-N	0	0	278.371	4.187	20	30		CIEDRN
Cc1cc(C)c(CN(C#N)c2ccc(F)c(C#N)c2)c(C)c1	ZINC000467762474	331423885	/nfs/dbraw/zinc/42/38/85/331423885.db2.gz	MYPQGBGCSFDMOD-UHFFFAOYSA-N	0	0	293.345	4.110	20	30		CIEDRN
CCCCOc1cccc(NCc2ccc(F)c(C#N)c2)c1	ZINC000467762451	331423901	/nfs/dbraw/zinc/42/39/01/331423901.db2.gz	MRACJFABOIPZPI-UHFFFAOYSA-N	0	0	298.361	4.488	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC)[C@H]1CCCC[C@H]1C	ZINC000467823620	331424336	/nfs/dbraw/zinc/42/43/36/331424336.db2.gz	OODSKAWIOZEGLH-ZBFHGGJFSA-N	0	0	263.425	4.182	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(Cc1cccc(F)c1)C1CC1	ZINC000467829484	331424347	/nfs/dbraw/zinc/42/43/47/331424347.db2.gz	FXEQWULDOVBGKW-UHFFFAOYSA-N	0	0	287.378	4.085	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC(C)C)C1CCCC1	ZINC000467830140	331424351	/nfs/dbraw/zinc/42/43/51/331424351.db2.gz	ZKMGMCUNWWXZKZ-UHFFFAOYSA-N	0	0	263.425	4.182	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H](C)c1ccc2ncsc2c1	ZINC000467881214	331425227	/nfs/dbraw/zinc/42/52/27/331425227.db2.gz	XLSFHKFKNDNICX-MEDUHNTESA-N	0	0	288.416	4.076	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H](CC)c1ccccc1OCC	ZINC000467945514	331425965	/nfs/dbraw/zinc/42/59/65/331425965.db2.gz	KBNCFJYDXBJWLO-MAUKXSAKSA-N	0	0	289.419	4.255	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@@H](CC)CSc1ccccc1	ZINC000467962545	331426026	/nfs/dbraw/zinc/42/60/26/331426026.db2.gz	GCEUXABPSCMHNX-YOEHRIQHSA-N	0	0	291.460	4.276	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@@H](C#N)c1ccc(C(C)(C)C)cc1	ZINC000467972525	331426160	/nfs/dbraw/zinc/42/61/60/331426160.db2.gz	BFGOMMXIEDUOKV-LPHOPBHVSA-N	0	0	298.430	4.267	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(OCCC)cc1	ZINC000467979742	331426273	/nfs/dbraw/zinc/42/62/73/331426273.db2.gz	CHTYWHNGSPKULZ-INIZCTEOSA-N	0	0	261.365	4.016	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H](C(C)(C)C)CC1	ZINC000468010684	331426602	/nfs/dbraw/zinc/42/66/02/331426602.db2.gz	AOGHIZLKMITVHK-YOEHRIQHSA-N	0	0	265.441	4.264	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cccc(CSCC)c1	ZINC000468030483	331427147	/nfs/dbraw/zinc/42/71/47/331427147.db2.gz	LEGZCAGWWADVBP-INIZCTEOSA-N	0	0	277.433	4.481	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc2oc(C3CC3)nc2c1	ZINC000468105192	331428649	/nfs/dbraw/zinc/42/86/49/331428649.db2.gz	VZYJOGGVLBQDLT-KRWDZBQOSA-N	0	0	284.359	4.246	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N(C)C1CCC(CC)CC1	ZINC000468102785	331428654	/nfs/dbraw/zinc/42/86/54/331428654.db2.gz	HSRWWSWQSAJHBD-ZBCRRDGASA-N	0	0	251.414	4.016	20	30		CIEDRN
Cc1cccc(C)c1Oc1ccccc1NC(=O)[C@@H](C)C#N	ZINC000468130061	331429136	/nfs/dbraw/zinc/42/91/36/331429136.db2.gz	DRQBZRFSQPTIJJ-AWEZNQCLSA-N	0	0	294.354	4.194	20	30		CIEDRN
C=CCCN(C)C(=O)c1ccccc1N(C)c1ccccc1	ZINC000468181731	331429734	/nfs/dbraw/zinc/42/97/34/331429734.db2.gz	DDPHIEJGBUSINW-UHFFFAOYSA-N	0	0	294.398	4.103	20	30		CIEDRN
C=CCCN(C)C(=O)c1ccccc1Oc1ccccc1	ZINC000468192986	331429892	/nfs/dbraw/zinc/42/98/92/331429892.db2.gz	SOSYZBJMCVPSDO-UHFFFAOYSA-N	0	0	281.355	4.127	20	30		CIEDRN
C=C(C)COc1cccc(N[C@@H](C)CC2CCOCC2)c1	ZINC000468390245	331433527	/nfs/dbraw/zinc/43/35/27/331433527.db2.gz	SLUBZJVFYPYVJI-HNNXBMFYSA-N	0	0	289.419	4.259	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Cc1cccc(C(F)F)c1	ZINC000468423809	331434837	/nfs/dbraw/zinc/43/48/37/331434837.db2.gz	ROTQVMUDRMQFRQ-LBPRGKRZSA-N	0	0	281.346	4.028	20	30		CIEDRN
COc1cccc([C@H](C)Sc2cccc(C#N)c2)c1	ZINC000468654661	331438328	/nfs/dbraw/zinc/43/83/28/331438328.db2.gz	AFHIYTXMCBDOPR-LBPRGKRZSA-N	0	0	269.369	4.420	20	30		CIEDRN
C=CCC(CC=C)C(=O)NCc1cc(F)c(Cl)cc1F	ZINC000468834165	331440780	/nfs/dbraw/zinc/44/07/80/331440780.db2.gz	CNNNGTCWVDIOAJ-UHFFFAOYSA-N	0	0	299.748	4.003	20	30		CIEDRN
C=CCN(Cc1cccc(C#N)c1)C(=O)CC(C)(C)CCC	ZINC000468971752	331443420	/nfs/dbraw/zinc/44/34/20/331443420.db2.gz	OADIEYIFQWPCLU-UHFFFAOYSA-N	0	0	298.430	4.289	20	30		CIEDRN
CCCNc1ccc(C#N)cc1NC(=O)C[C@@H](C)C(C)C	ZINC000469146411	331446560	/nfs/dbraw/zinc/44/65/60/331446560.db2.gz	ZXRYHUKQPMKKBS-CYBMUJFWSA-N	0	0	287.407	4.001	20	30		CIEDRN
CCc1c(C)sc(NC(=O)CC(CC)CC)c1C#N	ZINC000469477067	331452487	/nfs/dbraw/zinc/45/24/87/331452487.db2.gz	ZNNOIBPODRDNNT-UHFFFAOYSA-N	0	0	278.421	4.255	20	30		CIEDRN
CC(C)(C#N)CC(=O)NC(C)(C)CC1CCCCCC1	ZINC000469822766	331462134	/nfs/dbraw/zinc/46/21/34/331462134.db2.gz	ZTBHCATZZIVHHU-UHFFFAOYSA-N	0	0	278.440	4.182	20	30		CIEDRN
C=CCN(C(=O)C[C@@H]1CCC[C@H]1C)c1ccccc1	ZINC000469929322	331465334	/nfs/dbraw/zinc/46/53/34/331465334.db2.gz	OMEFKJRFFVSBQD-CABCVRRESA-N	0	0	257.377	4.032	20	30		CIEDRN
CCc1c(C)sc(NC(=O)C[C@@H]2CCC[C@H]2C)c1C#N	ZINC000469964367	331467036	/nfs/dbraw/zinc/46/70/36/331467036.db2.gz	LGJSBJZPPSGZFX-PWSUYJOCSA-N	0	0	290.432	4.255	20	30		CIEDRN
C=CC[C@@H](C(=O)NC1CCC2(CC2)CC1)c1ccccc1	ZINC000470074898	331470882	/nfs/dbraw/zinc/47/08/82/331470882.db2.gz	KVLKOQOWNPQOMM-QGZVFWFLSA-N	0	0	283.415	4.185	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)[C@H]2CC23CCCC3)CCCC1(C)C	ZINC000470293405	331478226	/nfs/dbraw/zinc/47/82/26/331478226.db2.gz	QEGMOHWAWXKOLE-CABCVRRESA-N	0	0	275.436	4.160	20	30		CIEDRN
C=CCCC(=O)Nc1cnn(-c2cccc(C)c2)c1CCC	ZINC000470335490	331479671	/nfs/dbraw/zinc/47/96/71/331479671.db2.gz	XSWMHDIMCVWRFQ-UHFFFAOYSA-N	0	0	297.402	4.038	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)C[C@@H]1CCC[C@@H](C)C1	ZINC000471162279	331503175	/nfs/dbraw/zinc/50/31/75/331503175.db2.gz	UXCVKISVTVKMTD-HUUCEWRRSA-N	0	0	278.440	4.134	20	30		CIEDRN
C=CCCCCNC(=O)C(c1ccccc1)c1ccccc1	ZINC000471667540	331514351	/nfs/dbraw/zinc/51/43/51/331514351.db2.gz	KMTJDXGQKBNFSY-UHFFFAOYSA-N	0	0	293.410	4.291	20	30		CIEDRN
C=CCCCCNC(=O)C[C@H](CC)c1ccccc1	ZINC000471701044	331516342	/nfs/dbraw/zinc/51/63/42/331516342.db2.gz	FIWKRQHJHSHHNF-HNNXBMFYSA-N	0	0	259.393	4.043	20	30		CIEDRN
C=CCCCCNC(=O)[C@H]1C[C@@H]1c1c(F)cccc1Cl	ZINC000471707583	331517083	/nfs/dbraw/zinc/51/70/83/331517083.db2.gz	WETQBRBDMCHNII-RYUDHWBXSA-N	0	0	295.785	4.055	20	30		CIEDRN
C=CCCCCNC(=O)c1ccc(-c2ccccc2)o1	ZINC000471714893	331517882	/nfs/dbraw/zinc/51/78/82/331517882.db2.gz	IUHBBNMIZFOYQD-UHFFFAOYSA-N	0	0	269.344	4.033	20	30		CIEDRN
C=CCOc1ccc(CNc2cccc3ccn(C)c32)cc1	ZINC000471805708	331521204	/nfs/dbraw/zinc/52/12/04/331521204.db2.gz	UGNAETUTUQYATG-UHFFFAOYSA-N	0	0	292.382	4.355	20	30		CIEDRN
C[C@H](CC(=O)N(C)Cc1ccc(C#N)cc1)C1CCCCC1	ZINC000510737607	332914422	/nfs/dbraw/zinc/91/44/22/332914422.db2.gz	SAMIFAWOOHSGKQ-OAHLLOKOSA-N	0	0	298.430	4.123	20	30		CIEDRN
CCN(CCC#N)C(=O)C1(C2CCCCC2)CCCCC1	ZINC000471861240	331522862	/nfs/dbraw/zinc/52/28/62/331522862.db2.gz	ZZXWRQHTXNTNDR-UHFFFAOYSA-N	0	0	290.451	4.279	20	30		CIEDRN
N#Cc1ccc(OCC2CCC(C(F)(F)F)CC2)cc1	ZINC000471884927	331523200	/nfs/dbraw/zinc/52/32/00/331523200.db2.gz	BSFWMLBJTPXTAL-UHFFFAOYSA-N	0	0	283.293	4.306	20	30		CIEDRN
CC#CCSCC1CCC(C(F)(F)F)CC1	ZINC000471921329	331524107	/nfs/dbraw/zinc/52/41/07/331524107.db2.gz	VZPAKEFVNXMNFE-UHFFFAOYSA-N	0	0	250.329	4.112	20	30		CIEDRN
CSc1cccc(C)c1NCc1ccc(CC#N)cc1	ZINC000471991602	331525463	/nfs/dbraw/zinc/52/54/63/331525463.db2.gz	JYRUAZYQHBORDM-UHFFFAOYSA-N	0	0	282.412	4.395	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)[C@@H](C)c1ccc(Cl)c(Cl)c1	ZINC000472164172	331530802	/nfs/dbraw/zinc/53/08/02/331530802.db2.gz	SNAFNKFTHGHESE-ZJUUUORDSA-N	0	0	286.202	4.178	20	30		CIEDRN
C=CCCCCNC(=O)N(C)[C@@H](C)c1c(F)cccc1F	ZINC000472882814	331544984	/nfs/dbraw/zinc/54/49/84/331544984.db2.gz	RVWMMHKYTKQLKH-LBPRGKRZSA-N	0	0	296.361	4.024	20	30		CIEDRN
C=CCCCCNC(=O)Nc1c(CC)cccc1CC	ZINC000473497922	331552019	/nfs/dbraw/zinc/55/20/19/331552019.db2.gz	MJILMZAPWNFOMH-UHFFFAOYSA-N	0	0	274.408	4.289	20	30		CIEDRN
CC(C)(C)OCCCCNc1ccc(Cl)c(C#N)c1	ZINC000473679241	331555620	/nfs/dbraw/zinc/55/56/20/331555620.db2.gz	GTOODHRJFAGUJR-UHFFFAOYSA-N	0	0	280.799	4.219	20	30		CIEDRN
CC(C)(C)OCCCCOc1cc(Cl)ccc1C#N	ZINC000473681126	331555846	/nfs/dbraw/zinc/55/58/46/331555846.db2.gz	IYMZLUDWHSQLLI-UHFFFAOYSA-N	0	0	281.783	4.186	20	30		CIEDRN
Cc1cc(C#N)cc(C)c1OCCCCOC(C)(C)C	ZINC000473682113	331555903	/nfs/dbraw/zinc/55/59/03/331555903.db2.gz	YUHDINBRNDPOTO-UHFFFAOYSA-N	0	0	275.392	4.149	20	30		CIEDRN
C=CCCCCNC(=O)N(C1CC1)C1CCC(C)CC1	ZINC000474073649	331567978	/nfs/dbraw/zinc/56/79/78/331567978.db2.gz	ILNSAIJYOXSYHT-UHFFFAOYSA-N	0	0	278.440	4.095	20	30		CIEDRN
C=CCCCCNC(=O)N(Cc1ccco1)C1CCCC1	ZINC000474076200	331568186	/nfs/dbraw/zinc/56/81/86/331568186.db2.gz	QVXZZKGONDFRSB-UHFFFAOYSA-N	0	0	290.407	4.090	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000474082528	331568197	/nfs/dbraw/zinc/56/81/97/331568197.db2.gz	RMSJLCRHKPHVGO-UHFFFAOYSA-N	0	0	267.731	4.164	20	30		CIEDRN
Cc1ccc(NC(=O)C[C@@H](CC#N)c2ccccc2)cc1C	ZINC000474083349	331568911	/nfs/dbraw/zinc/56/89/11/331568911.db2.gz	PAEVCNVKMMJVGE-QGZVFWFLSA-N	0	0	292.382	4.330	20	30		CIEDRN
C=CCCCCNC(=O)N1CCc2sccc2[C@@H]1CC	ZINC000474099589	331570296	/nfs/dbraw/zinc/57/02/96/331570296.db2.gz	VBAWHPLHCNEZFK-AWEZNQCLSA-N	0	0	292.448	4.123	20	30		CIEDRN
C=CCCCCNC(=O)N1CCc2sccc2[C@H]1CC	ZINC000474099594	331570327	/nfs/dbraw/zinc/57/03/27/331570327.db2.gz	VBAWHPLHCNEZFK-CQSZACIVSA-N	0	0	292.448	4.123	20	30		CIEDRN
C=CCCC1(C(=O)NCc2cccc(C(F)(F)F)c2)CC1	ZINC000474194992	331575026	/nfs/dbraw/zinc/57/50/26/331575026.db2.gz	ISWXKHHKWXLJNY-UHFFFAOYSA-N	0	0	297.320	4.068	20	30		CIEDRN
CCN(C(=O)[C@@H]1CC12CCCC2)[C@@H](C)c1ccc(C#N)cc1	ZINC000474362068	331581954	/nfs/dbraw/zinc/58/19/54/331581954.db2.gz	LXQXLYFXWPSILD-YOEHRIQHSA-N	0	0	296.414	4.048	20	30		CIEDRN
CCc1ccccc1NC(=O)C[C@H](CC#N)c1ccccc1	ZINC000474427054	331586413	/nfs/dbraw/zinc/58/64/13/331586413.db2.gz	PAQPOEMDFUSONQ-KRWDZBQOSA-N	0	0	292.382	4.275	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cccc(OCCC)c2)CC1	ZINC000474776443	331597668	/nfs/dbraw/zinc/59/76/68/331597668.db2.gz	PMZWONVHAVFAHN-UHFFFAOYSA-N	0	0	273.376	4.160	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc3oc(CC)nc3c2)CC1	ZINC000474960123	331606865	/nfs/dbraw/zinc/60/68/65/331606865.db2.gz	NCKWRCCAMJDIQC-UHFFFAOYSA-N	0	0	284.359	4.075	20	30		CIEDRN
C[C@@H]1CCC[C@H](CNC(=O)c2ccc(C(C)(C)C#N)cc2)C1	ZINC000475118505	331615427	/nfs/dbraw/zinc/61/54/27/331615427.db2.gz	AARQICQSBYLIGX-CABCVRRESA-N	0	0	298.430	4.044	20	30		CIEDRN
C[C@@H]1CCC[C@@H](CNC(=O)c2ccc(C(C)(C)C#N)cc2)C1	ZINC000475118509	331615472	/nfs/dbraw/zinc/61/54/72/331615472.db2.gz	AARQICQSBYLIGX-HUUCEWRRSA-N	0	0	298.430	4.044	20	30		CIEDRN
C[C@@H]1CCCC[C@H]1CNC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000475177150	331617064	/nfs/dbraw/zinc/61/70/64/331617064.db2.gz	YBTQFVDMBLWQLZ-ZBFHGGJFSA-N	0	0	298.430	4.044	20	30		CIEDRN
C=CCN(C(=O)c1cccc(C(C)C)n1)c1ccccc1	ZINC000475432143	331631924	/nfs/dbraw/zinc/63/19/24/331631924.db2.gz	QOGVPGUXWPBBJD-UHFFFAOYSA-N	0	0	280.371	4.038	20	30		CIEDRN
C[C@H]1CC[C@H](CNC(=O)Nc2ccc(C(C)(C)C#N)cc2)C1	ZINC000475477888	331632452	/nfs/dbraw/zinc/63/24/52/331632452.db2.gz	NBJUWUAEWDURCI-KBPBESRZSA-N	0	0	299.418	4.045	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@H]1CCCC1(C)C	ZINC000475507220	331634344	/nfs/dbraw/zinc/63/43/44/331634344.db2.gz	DNGZTKITHVFFMI-CQSZACIVSA-N	0	0	251.414	4.018	20	30		CIEDRN
CCN(C(=O)[C@H]1CCCC1(C)C)[C@H](C)c1ccc(C#N)cc1	ZINC000475614648	331639428	/nfs/dbraw/zinc/63/94/28/331639428.db2.gz	WSFOJDGXOOJQQD-RHSMWYFYSA-N	0	0	298.430	4.294	20	30		CIEDRN
C=CCCC1(C(=O)N[C@H]2CCC[C@H](C(C)C)C2)CC1	ZINC000475662328	331640634	/nfs/dbraw/zinc/64/06/34/331640634.db2.gz	REIHEZCHVCXFEG-GJZGRUSLSA-N	0	0	263.425	4.064	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000475814195	331645524	/nfs/dbraw/zinc/64/55/24/331645524.db2.gz	LONFTSQVSXSLGB-IRAQGIFJSA-N	0	0	283.415	4.293	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(OCC(F)F)cc2)CC1	ZINC000476249972	331658611	/nfs/dbraw/zinc/65/86/11/331658611.db2.gz	BCHHGGGWEZCWPM-UHFFFAOYSA-N	0	0	295.329	4.015	20	30		CIEDRN
C=CCCC1(C(=O)N2CC[C@H](c3ccccc3)[C@H]2C)CC1	ZINC000476280653	331659847	/nfs/dbraw/zinc/65/98/47/331659847.db2.gz	VXBUKTQGZHWBCT-WBVHZDCISA-N	0	0	283.415	4.137	20	30		CIEDRN
CC(C)(C#N)CCCOc1cc(Cl)ccc1F	ZINC000476460115	331664488	/nfs/dbraw/zinc/66/44/88/331664488.db2.gz	MSBISAQRNFULBA-UHFFFAOYSA-N	0	0	255.720	4.188	20	30		CIEDRN
C[C@@H]1CC[C@@H](NC(=O)c2ccc(C(C)(C)C#N)cc2)C[C@H]1C	ZINC000476675754	331668429	/nfs/dbraw/zinc/66/84/29/331668429.db2.gz	LESPGFILURBYHB-CKEIUWERSA-N	0	0	298.430	4.042	20	30		CIEDRN
C=C(C)[C@H](NC(=O)NC(CC)CC)c1ccc(F)c(F)c1	ZINC000476699927	331669012	/nfs/dbraw/zinc/66/90/12/331669012.db2.gz	YMFISZTZFFWMBJ-HNNXBMFYSA-N	0	0	296.361	4.070	20	30		CIEDRN
CC(C)(C#N)c1ccc(C(=O)N[C@@H]2CCCC(C)(C)C2)cc1	ZINC000476920324	331671071	/nfs/dbraw/zinc/67/10/71/331671071.db2.gz	GIOYXYZKWXJZJZ-MRXNPFEDSA-N	0	0	298.430	4.186	20	30		CIEDRN
CC1(C)CCCCN(C(=O)C[C@@H](CC#N)c2ccccc2)C1	ZINC000476923702	331671086	/nfs/dbraw/zinc/67/10/86/331671086.db2.gz	ONVGJIPRGOBPQJ-QGZVFWFLSA-N	0	0	298.430	4.113	20	30		CIEDRN
C[C@@H]1CCC[C@@H](NC(=O)c2ccc(C(C)(C)C#N)cc2)CC1	ZINC000476932067	331671335	/nfs/dbraw/zinc/67/13/35/331671335.db2.gz	YZCBSSJVFCOZEP-RHSMWYFYSA-N	0	0	298.430	4.186	20	30		CIEDRN
CCC[C@@H](CC)S[C@@H](C)C(=O)Nc1cccc(C#N)c1	ZINC000477043488	331673785	/nfs/dbraw/zinc/67/37/85/331673785.db2.gz	KYPZFPYQUVVNPI-SWLSCSKDSA-N	0	0	290.432	4.197	20	30		CIEDRN
N#Cc1ncccc1OCc1ccc(-c2cccs2)cc1	ZINC000477043144	331673907	/nfs/dbraw/zinc/67/39/07/331673907.db2.gz	LTGRYECTEHMKCF-UHFFFAOYSA-N	0	0	292.363	4.261	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H]2CC[C@@H]3CCCC[C@H]3C2)CCC1	ZINC000477890838	331692798	/nfs/dbraw/zinc/69/27/98/331692798.db2.gz	JBXTXETXVHWYOZ-HRCADAONSA-N	0	0	275.436	4.208	20	30		CIEDRN
C=CCC[C@H](Nc1cnn([C@H](C)CC)c1C)C1CC1	ZINC000477920438	331693907	/nfs/dbraw/zinc/69/39/07/331693907.db2.gz	YTLJVGBYLLWEJG-DOMZBBRYSA-N	0	0	261.413	4.319	20	30		CIEDRN
COc1ccc(CNc2ccc(C3CC3)c(C)c2)cc1C#N	ZINC000478323592	331703939	/nfs/dbraw/zinc/70/39/39/331703939.db2.gz	GIICHTZSMTXKJY-UHFFFAOYSA-N	0	0	292.382	4.365	20	30		CIEDRN
C=CCC1(C(=O)NCCc2c(C)cc(C)cc2C)CCC1	ZINC000478338978	331704265	/nfs/dbraw/zinc/70/42/65/331704265.db2.gz	IIKYHDPQFPWICD-UHFFFAOYSA-N	0	0	285.431	4.017	20	30		CIEDRN
N#Cc1cc(Cl)ccc1CNc1cc(F)c(F)cc1F	ZINC000478345508	331704405	/nfs/dbraw/zinc/70/44/05/331704405.db2.gz	XKKSFCNKJMSJPZ-UHFFFAOYSA-N	0	0	296.679	4.241	20	30		CIEDRN
C=CCC1(C(=O)N2C[C@@H](c3ccccc3)C(C)(C)C2)CCC1	ZINC000478340189	331704406	/nfs/dbraw/zinc/70/44/06/331704406.db2.gz	PTYBFBRRGYAALT-KRWDZBQOSA-N	0	0	297.442	4.385	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@@H](C(C)(C)C)C1	ZINC000478432267	331706141	/nfs/dbraw/zinc/70/61/41/331706141.db2.gz	HSQDQUWWCSMXTP-OAHLLOKOSA-N	0	0	263.425	4.040	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H]1C[C@H](c2ccc(Cl)cc2)C1	ZINC000478545949	331708269	/nfs/dbraw/zinc/70/82/69/331708269.db2.gz	XVSBHNDNHVBJFZ-FRFSOERESA-N	0	0	291.822	4.305	20	30		CIEDRN
C=C[C@@H](CC(=O)N(CC1CC1)CC1CCC1)c1ccccc1	ZINC000478623437	331710527	/nfs/dbraw/zinc/71/05/27/331710527.db2.gz	NYHBHMYWMHRJEF-SFHVURJKSA-N	0	0	297.442	4.385	20	30		CIEDRN
CC(C)(C)c1cnc(SCC#Cc2ccccc2)o1	ZINC000478715811	331712165	/nfs/dbraw/zinc/71/21/65/331712165.db2.gz	JZRNBWBHPOXDAF-UHFFFAOYSA-N	0	0	271.385	4.116	20	30		CIEDRN
N#C[C@H](SCc1ccc2c(c1)OCO2)C1CCCCC1	ZINC000478754993	331713489	/nfs/dbraw/zinc/71/34/89/331713489.db2.gz	IXNGZCWNOYXHNN-INIZCTEOSA-N	0	0	289.400	4.121	20	30		CIEDRN
C=CCCCCCn1c2ccsc2c(=O)cc1C	ZINC000478823696	331714907	/nfs/dbraw/zinc/71/49/07/331714907.db2.gz	GEFCUQQPLLVJFO-UHFFFAOYSA-N	0	0	261.390	4.118	20	30		CIEDRN
C=CCn1c(SCCC2CC2)nnc1-c1cccs1	ZINC000479127187	331720895	/nfs/dbraw/zinc/72/08/95/331720895.db2.gz	KUZRFPGSIFDUQX-UHFFFAOYSA-N	0	0	291.445	4.085	20	30		CIEDRN
Cc1csc2c1ncnc2Sc1ccc(C#N)cc1	ZINC000479372769	331725879	/nfs/dbraw/zinc/72/58/79/331725879.db2.gz	BTCWYCMBMFFGRB-UHFFFAOYSA-N	0	0	283.381	4.023	20	30		CIEDRN
CSc1cccc(NCc2ccc(C#N)c(F)c2)c1C	ZINC000479472542	331732128	/nfs/dbraw/zinc/73/21/28/331732128.db2.gz	CVLKVMBZZOQWHQ-UHFFFAOYSA-N	0	0	286.375	4.340	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](c1ccccc1)c1ccc(F)cc1	ZINC000479503699	331733707	/nfs/dbraw/zinc/73/37/07/331733707.db2.gz	OFGBNWPILHZAMN-IBGZPJMESA-N	0	0	297.373	4.388	20	30		CIEDRN
Cc1cc(-c2noc(-c3cccc(C#N)c3C)n2)ccc1F	ZINC000511153717	332928409	/nfs/dbraw/zinc/92/84/09/332928409.db2.gz	GGEJKSXTQTVXKZ-UHFFFAOYSA-N	0	0	293.301	4.031	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(O[C@H](C)CC)cc1	ZINC000479542583	331736195	/nfs/dbraw/zinc/73/61/95/331736195.db2.gz	KKWCKTURUWVMNC-CYBMUJFWSA-N	0	0	261.365	4.159	20	30		CIEDRN
C=CCCCC(=O)Nc1cccc(OCC(C)C)c1	ZINC000479565762	331737673	/nfs/dbraw/zinc/73/76/73/331737673.db2.gz	AUKAKBHNDSHRJG-UHFFFAOYSA-N	0	0	261.365	4.016	20	30		CIEDRN
C=CCCCC(=O)Nc1cc(Cl)c(OC)c(Cl)c1	ZINC000479566839	331737763	/nfs/dbraw/zinc/73/77/63/331737763.db2.gz	MHKDCJUPFUCIBC-UHFFFAOYSA-N	0	0	288.174	4.297	20	30		CIEDRN
C=CCCCC(=O)N(CCC)[C@@H](C)c1ccccc1OC	ZINC000479574963	331738226	/nfs/dbraw/zinc/73/82/26/331738226.db2.gz	PKPACHQMAPJWSW-HNNXBMFYSA-N	0	0	289.419	4.351	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@H](CCC)C(C)C	ZINC000479589782	331739214	/nfs/dbraw/zinc/73/92/14/331739214.db2.gz	AIIOKDPCKLBRAB-OAHLLOKOSA-N	0	0	279.449	4.335	20	30		CIEDRN
C=CCOCCCS[C@H](C)c1ccc(F)c(F)c1	ZINC000479590874	331739429	/nfs/dbraw/zinc/73/94/29/331739429.db2.gz	VCVDRNSDUUKPAY-LLVKDONJSA-N	0	0	272.360	4.352	20	30		CIEDRN
C=CCOCCCS[C@H]1CCc2ccc(F)cc21	ZINC000479603393	331740134	/nfs/dbraw/zinc/74/01/34/331740134.db2.gz	CYJXKXDTEVCSIX-HNNXBMFYSA-N	0	0	266.381	4.139	20	30		CIEDRN
CC[C@@H](C#N)Nc1cc(-c2ccc(C)o2)ccc1C	ZINC000479830289	331746884	/nfs/dbraw/zinc/74/68/84/331746884.db2.gz	QSFRSYMNHQZJLN-AWEZNQCLSA-N	0	0	254.333	4.278	20	30		CIEDRN
C=CCC1(C(=O)N2CCC[C@@](C)(CCC)C2)CCC1	ZINC000479882665	331751002	/nfs/dbraw/zinc/75/10/02/331751002.db2.gz	FNPFBVMMTYCGOF-MRXNPFEDSA-N	0	0	263.425	4.162	20	30		CIEDRN
C=CC1CCN(C(=O)c2ccc(F)c3ccccc23)CC1	ZINC000480009932	331754005	/nfs/dbraw/zinc/75/40/05/331754005.db2.gz	ZERWYGHWNGBLNC-UHFFFAOYSA-N	0	0	283.346	4.017	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)[C@@H]1CCC(F)(F)C1	ZINC000480019639	331754807	/nfs/dbraw/zinc/75/48/07/331754807.db2.gz	WUILCDRIRNMURI-CQSZACIVSA-N	0	0	285.378	4.017	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cc(-c3ccccc3)ns2)CC1	ZINC000480053485	331755804	/nfs/dbraw/zinc/75/58/04/331755804.db2.gz	KXIODLLZCUHVQL-UHFFFAOYSA-N	0	0	298.411	4.495	20	30		CIEDRN
C=CCNc1ccc(-c2csc(C(F)(F)F)n2)cc1	ZINC000480152495	331760040	/nfs/dbraw/zinc/76/00/40/331760040.db2.gz	YAPONXXALJJWLS-UHFFFAOYSA-N	0	0	284.306	4.427	20	30		CIEDRN
C=CCCCSCCC(=O)Nc1ccc(OCC)cc1	ZINC000480390182	331771472	/nfs/dbraw/zinc/77/14/72/331771472.db2.gz	RLMZCMYJIXWRMN-UHFFFAOYSA-N	0	0	293.432	4.113	20	30		CIEDRN
CC(C)(C#N)CCCSCc1nc2ccccc2[nH]1	ZINC000480397872	331771720	/nfs/dbraw/zinc/77/17/20/331771720.db2.gz	VOLPLGSXXRGUEM-UHFFFAOYSA-N	0	0	273.405	4.126	20	30		CIEDRN
C=CCOc1cccc(CNc2cnn([C@H](C)CC)c2C)c1	ZINC000480474880	331773854	/nfs/dbraw/zinc/77/38/54/331773854.db2.gz	WRGALKPRDVKUDU-CQSZACIVSA-N	0	0	299.418	4.339	20	30		CIEDRN
Cc1c(C#N)cccc1-c1nc(-c2cccc(Cl)c2)no1	ZINC000511191756	332929169	/nfs/dbraw/zinc/92/91/69/332929169.db2.gz	VSMIAHQDRRJYIF-UHFFFAOYSA-N	0	0	295.729	4.237	20	30		CIEDRN
C=CCOc1cccc(NC(=O)[C@H](CC)CCCC)c1	ZINC000511321333	332930496	/nfs/dbraw/zinc/93/04/96/332930496.db2.gz	DJQXERZFULKCEB-CQSZACIVSA-N	0	0	275.392	4.406	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1cnc2ccccc2c1C	ZINC000482273148	331829929	/nfs/dbraw/zinc/82/99/29/331829929.db2.gz	CMKQFVREXLYUFG-UHFFFAOYSA-N	0	0	296.414	4.362	20	30		CIEDRN
Cc1c(C#N)cccc1C(=O)Nc1ccc(C2CCC2)cc1	ZINC000511378854	332931094	/nfs/dbraw/zinc/93/10/94/332931094.db2.gz	ADGPWBWEBVZCOD-UHFFFAOYSA-N	0	0	290.366	4.387	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)C(CC)CC	ZINC000482912583	331852059	/nfs/dbraw/zinc/85/20/59/331852059.db2.gz	SBTFKWGXPOFINN-UHFFFAOYSA-N	0	0	251.414	4.018	20	30		CIEDRN
N#Cc1ccc(Sc2ccnc(-c3ccccc3)n2)cc1	ZINC000511396473	332931513	/nfs/dbraw/zinc/93/15/13/332931513.db2.gz	VDNMTUMPDHBYAA-UHFFFAOYSA-N	0	0	289.363	4.166	20	30		CIEDRN
Cc1cc(C(=O)Nc2ccccc2C#N)c(C)cc1Cl	ZINC000483043196	331856369	/nfs/dbraw/zinc/85/63/69/331856369.db2.gz	FVAIOSZGJIOWMP-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
C=CCCCC(=O)N(C)C1CCC(CCC)CC1	ZINC000483093825	331857592	/nfs/dbraw/zinc/85/75/92/331857592.db2.gz	CJBCCRVHKSJGJP-UHFFFAOYSA-N	0	0	251.414	4.160	20	30		CIEDRN
N#Cc1cc(F)ccc1CSc1ccccc1F	ZINC000483207025	331862990	/nfs/dbraw/zinc/86/29/90/331862990.db2.gz	KADRXGLZLHQIRX-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@@H]1CC2CCC1CC2)c1ccccc1	ZINC000483460919	331876482	/nfs/dbraw/zinc/87/64/82/331876482.db2.gz	RIGLOGCCSRFINH-XAWIXRBMSA-N	0	0	283.415	4.041	20	30		CIEDRN
CCN(C[C@H](C)C#N)C(=O)c1sccc1-c1ccccc1	ZINC000483607725	331879510	/nfs/dbraw/zinc/87/95/10/331879510.db2.gz	PKCSQTYUFNVNLL-CYBMUJFWSA-N	0	0	298.411	4.037	20	30		CIEDRN
C[C@H]1CC(C)(C)CC[C@H]1NC(=O)Nc1ccc(CC#N)cc1	ZINC000483846018	331886364	/nfs/dbraw/zinc/88/63/64/331886364.db2.gz	FIUPCAXEHUSKHO-XJKSGUPXSA-N	0	0	299.418	4.089	20	30		CIEDRN
C[C@@H]1CC(C)(C)CC[C@@H]1NC(=O)Nc1ccc(CC#N)cc1	ZINC000483846014	331886401	/nfs/dbraw/zinc/88/64/01/331886401.db2.gz	FIUPCAXEHUSKHO-CJNGLKHVSA-N	0	0	299.418	4.089	20	30		CIEDRN
CSc1ccc(N(C)Cc2ccc(C#N)c(F)c2)cc1	ZINC000483917985	331889156	/nfs/dbraw/zinc/88/91/56/331889156.db2.gz	FJQNGMCOYRXOEA-UHFFFAOYSA-N	0	0	286.375	4.056	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cccc2ccc(O)cc21	ZINC000484747199	331904884	/nfs/dbraw/zinc/90/48/84/331904884.db2.gz	LPUXVWDSYJCIHY-UHFFFAOYSA-N	0	0	269.344	4.086	20	30		CIEDRN
N#Cc1cc(Cl)ccc1NC[C@@H]1CCC(F)(F)C1	ZINC000485399103	331913537	/nfs/dbraw/zinc/91/35/37/331913537.db2.gz	BERGFQACMLRGAS-SECBINFHSA-N	0	0	270.710	4.059	20	30		CIEDRN
N#Cc1cc(Cl)ccc1NC[C@H]1CCC(F)(F)C1	ZINC000485399104	331913582	/nfs/dbraw/zinc/91/35/82/331913582.db2.gz	BERGFQACMLRGAS-VIFPVBQESA-N	0	0	270.710	4.059	20	30		CIEDRN
CC(C)(SCCCSCC#N)c1ccccc1	ZINC000485487191	331915567	/nfs/dbraw/zinc/91/55/67/331915567.db2.gz	FKLWVZSYPJPGLK-UHFFFAOYSA-N	0	0	265.447	4.302	20	30		CIEDRN
C=CCCCCCSCc1nccn1CC(F)(F)F	ZINC000485559716	331916763	/nfs/dbraw/zinc/91/67/63/331916763.db2.gz	IVRZZDKGFUOTFE-UHFFFAOYSA-N	0	0	292.370	4.425	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1nc(C(C)(C)C)cs1	ZINC000485597142	331918573	/nfs/dbraw/zinc/91/85/73/331918573.db2.gz	HSRWKGKJXBBDEE-NSHDSACASA-N	0	0	293.436	4.013	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(Cl)cc2OCC)CCC1	ZINC000485717803	331922032	/nfs/dbraw/zinc/92/20/32/331922032.db2.gz	JDHQGDFPYALUGC-UHFFFAOYSA-N	0	0	293.794	4.424	20	30		CIEDRN
N#Cc1cccnc1/C=C\c1csc(-c2cccs2)n1	ZINC000485977011	331928434	/nfs/dbraw/zinc/92/84/34/331928434.db2.gz	LVGVBCJJCVPAEC-WAYWQWQTSA-N	0	0	295.392	4.309	20	30		CIEDRN
N#CCn1c(/C=C\c2ccc(Cl)cc2)nc2ccccc21	ZINC000485980517	331928618	/nfs/dbraw/zinc/92/86/18/331928618.db2.gz	RIYLWXVIMCSVPP-YFHOEESVSA-N	0	0	293.757	4.384	20	30		CIEDRN
N#CCn1c(/C=C\c2c(F)cccc2F)nc2ccccc21	ZINC000486101522	331931510	/nfs/dbraw/zinc/93/15/10/331931510.db2.gz	JQZOXPYVCVFXCF-HJWRWDBZSA-N	0	0	295.292	4.008	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@H](C)c1c(F)cccc1F	ZINC000486328263	331935051	/nfs/dbraw/zinc/93/50/51/331935051.db2.gz	QHZPPDSDYSNZIS-CYBMUJFWSA-N	0	0	295.373	4.273	20	30		CIEDRN
CCCc1nc(CNc2ccc(C#N)cc2Cl)cs1	ZINC000486563842	331939601	/nfs/dbraw/zinc/93/96/01/331939601.db2.gz	UAKUSYFJWMLJNP-UHFFFAOYSA-N	0	0	291.807	4.233	20	30		CIEDRN
CC(C)(C)CN(C(=O)c1ccc(C#N)s1)c1ccccc1	ZINC000486610101	331940341	/nfs/dbraw/zinc/94/03/41/331940341.db2.gz	YAYRAMAERYUHOJ-UHFFFAOYSA-N	0	0	298.411	4.313	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1ccc(C)cc1Cl	ZINC000486769293	331944195	/nfs/dbraw/zinc/94/41/95/331944195.db2.gz	FEZPOCVAYZFPKC-LBPRGKRZSA-N	0	0	278.783	4.221	20	30		CIEDRN
COc1cc(C)cc(NCc2ccc(C#N)c(C)c2)c1C	ZINC000487163651	331957701	/nfs/dbraw/zinc/95/77/01/331957701.db2.gz	UINCYKAUXKWVPQ-UHFFFAOYSA-N	0	0	280.371	4.104	20	30		CIEDRN
CC(C)c1ccc(/C=C/CC(=O)NCCCCC#N)cc1	ZINC000487527203	331972428	/nfs/dbraw/zinc/97/24/28/331972428.db2.gz	DFECTGRMVFHKLA-VOTSOKGWSA-N	0	0	284.403	4.023	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1ccc(C)cc1)c1ccccc1	ZINC000487570362	331975262	/nfs/dbraw/zinc/97/52/62/331975262.db2.gz	HTDPGYUXAUQSGY-QGZVFWFLSA-N	0	0	265.356	4.293	20	30		CIEDRN
C=CCC[C@H](C(=O)NCc1ccccc1)c1ccccc1	ZINC000487584202	331976305	/nfs/dbraw/zinc/97/63/05/331976305.db2.gz	QNSMIGCMTJBNFY-SFHVURJKSA-N	0	0	279.383	4.053	20	30		CIEDRN
C=CCN(CC=C)C(=O)N[C@@H]1CCC[C@H](c2ccccc2)C1	ZINC000487753376	331980564	/nfs/dbraw/zinc/98/05/64/331980564.db2.gz	ULLPQNXTERWUSU-ZWKOTPCHSA-N	0	0	298.430	4.096	20	30		CIEDRN
C=CCC[C@H](C(=O)N(C)c1ccccc1)c1ccccc1	ZINC000487808571	331981878	/nfs/dbraw/zinc/98/18/78/331981878.db2.gz	XXUKUCBECPPWKN-SFHVURJKSA-N	0	0	279.383	4.399	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cccc2ccsc21	ZINC000487923849	331984494	/nfs/dbraw/zinc/98/44/94/331984494.db2.gz	YVYKKVCLJZSZKY-UHFFFAOYSA-N	0	0	259.374	4.442	20	30		CIEDRN
N#Cc1c(F)cccc1CSCCOc1ccccc1	ZINC000488248145	331995740	/nfs/dbraw/zinc/99/57/40/331995740.db2.gz	KONVWXFHRHKJRD-UHFFFAOYSA-N	0	0	287.359	4.010	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1nc(CC)cs1)c1ccccc1	ZINC000488327561	332000067	/nfs/dbraw/zinc/00/00/67/332000067.db2.gz	DTOJXNOMCRWQFA-CQSZACIVSA-N	0	0	286.400	4.004	20	30		CIEDRN
CCc1c(C)sc(NC(=O)C[C@@H]2C=CCCC2)c1C#N	ZINC000488341979	332000988	/nfs/dbraw/zinc/00/09/88/332000988.db2.gz	WEYGFERIZQXIKA-GFCCVEGCSA-N	0	0	288.416	4.176	20	30		CIEDRN
C=CCCCCCN(C)Cc1nc(C(F)(F)F)cs1	ZINC000488416258	332005796	/nfs/dbraw/zinc/00/57/96/332005796.db2.gz	BZDCUMUVGXQFQQ-UHFFFAOYSA-N	0	0	292.370	4.340	20	30		CIEDRN
C=CCN(C(=O)c1cc(C)c(F)c(C)c1)c1ccccc1	ZINC000488435824	332008135	/nfs/dbraw/zinc/00/81/35/332008135.db2.gz	ROXXICFHQOYZHC-UHFFFAOYSA-N	0	0	283.346	4.275	20	30		CIEDRN
CCC(CC)CN(CCC#N)Cc1ccc(C#N)c(C)c1	ZINC000488441944	332008865	/nfs/dbraw/zinc/00/88/65/332008865.db2.gz	LPANBXRVDWLQOX-UHFFFAOYSA-N	0	0	283.419	4.019	20	30		CIEDRN
N#CCCN(CCc1cc(Cl)ccc1Cl)CC1CC1	ZINC000488445479	332009369	/nfs/dbraw/zinc/00/93/69/332009369.db2.gz	YFGNHHDOKKSEGE-UHFFFAOYSA-N	0	0	297.229	4.162	20	30		CIEDRN
C=CCC[C@H](NC(=O)N1CC[C@H]2CCC[C@H]21)c1ccccc1	ZINC000488520774	332015355	/nfs/dbraw/zinc/01/53/55/332015355.db2.gz	TVDKCHWZGFMAET-FGTMMUONSA-N	0	0	298.430	4.278	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1ncc(C(C)(C)C)s1	ZINC000488547027	332016527	/nfs/dbraw/zinc/01/65/27/332016527.db2.gz	RPTMYZIBTKLWFD-NSHDSACASA-N	0	0	293.436	4.013	20	30		CIEDRN
C=C1CCN([C@H](C)c2ccc(Br)cc2)CC1	ZINC000488585392	332016715	/nfs/dbraw/zinc/01/67/15/332016715.db2.gz	UTRWCDKCYLARPT-GFCCVEGCSA-N	0	0	280.209	4.162	20	30		CIEDRN
CC(C)CN(C(=O)C[C@H]1C=CCCC1)c1ccc(C#N)cc1	ZINC000488636934	332020516	/nfs/dbraw/zinc/02/05/16/332020516.db2.gz	BAVLSTRQYQRZHZ-INIZCTEOSA-N	0	0	296.414	4.294	20	30		CIEDRN
N#CCc1cccc(C(=O)Nc2ccc(C3CCC3)cc2)c1	ZINC000488636103	332020628	/nfs/dbraw/zinc/02/06/28/332020628.db2.gz	HMRKGOOPHXMEGD-UHFFFAOYSA-N	0	0	290.366	4.272	20	30		CIEDRN
C=CC[C@H](C(=O)N(CCC)CC(C)C)c1ccccc1	ZINC000488663156	332021074	/nfs/dbraw/zinc/02/10/74/332021074.db2.gz	DVLFYFIIGJIDFV-KRWDZBQOSA-N	0	0	273.420	4.241	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1cccc(OCC)c1)c1ccccc1	ZINC000488660568	332021086	/nfs/dbraw/zinc/02/10/86/332021086.db2.gz	PCKJYAFOOFGCEK-GOSISDBHSA-N	0	0	295.382	4.384	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)C[C@H]1C=CCCC1	ZINC000488702086	332022009	/nfs/dbraw/zinc/02/20/09/332022009.db2.gz	LUODUISIAFAJAD-HNNXBMFYSA-N	0	0	287.378	4.087	20	30		CIEDRN
C=CCn1cccc1C(=O)Nc1cc(CC)ccc1CC	ZINC000488742904	332023719	/nfs/dbraw/zinc/02/37/19/332023719.db2.gz	GPWQJMHZFIPOFU-UHFFFAOYSA-N	0	0	282.387	4.051	20	30		CIEDRN
C=CCCCSc1nc(C(F)(F)F)ccc1C#N	ZINC000488760250	332024515	/nfs/dbraw/zinc/02/45/15/332024515.db2.gz	DQTUIYDMJHFTRR-UHFFFAOYSA-N	0	0	272.295	4.030	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Cc1cccc(C)c1Cl	ZINC000488796252	332026053	/nfs/dbraw/zinc/02/60/53/332026053.db2.gz	GSSDHGGBSZCCCA-CYBMUJFWSA-N	0	0	279.811	4.052	20	30		CIEDRN
C=CC[C@H](C(=O)NC/C=C\c1ccccc1)c1ccccc1	ZINC000488813328	332026724	/nfs/dbraw/zinc/02/67/24/332026724.db2.gz	GOPJESOQGNWNPU-PMTSLALWSA-N	0	0	291.394	4.176	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1ccc(C(C)(C)C)s1	ZINC000488812129	332026732	/nfs/dbraw/zinc/02/67/32/332026732.db2.gz	DZCYJKKTLQEQND-LBPRGKRZSA-N	0	0	277.433	4.226	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1cc(Cl)ccc1Cl	ZINC000488816437	332027078	/nfs/dbraw/zinc/02/70/78/332027078.db2.gz	NDKVGXQLHGUXTQ-NSHDSACASA-N	0	0	284.186	4.174	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1cc(C)c(C)cc1Cl	ZINC000488819409	332027217	/nfs/dbraw/zinc/02/72/17/332027217.db2.gz	SGNJQMACHASYDC-ZDUSSCGKSA-N	0	0	277.795	4.138	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1ccc(-c2ccccc2)o1	ZINC000488828243	332027859	/nfs/dbraw/zinc/02/78/59/332027859.db2.gz	PDOYYDUCLQLJRS-OAHLLOKOSA-N	0	0	281.355	4.127	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1csc2ccccc12	ZINC000488830964	332028092	/nfs/dbraw/zinc/02/80/92/332028092.db2.gz	ADIRKMJBGLCYNU-LBPRGKRZSA-N	0	0	271.385	4.082	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1ccc(C)c(C)c1Cl	ZINC000488834533	332028230	/nfs/dbraw/zinc/02/82/30/332028230.db2.gz	XOAVOYXMMBIOBM-CYBMUJFWSA-N	0	0	277.795	4.138	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1oc2ccc(F)cc2c1C	ZINC000488844688	332028950	/nfs/dbraw/zinc/02/89/50/332028950.db2.gz	UZHHHMCOEMHLGI-CYBMUJFWSA-N	0	0	287.334	4.061	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Cc1c(Cl)cccc1Cl	ZINC000488844638	332029035	/nfs/dbraw/zinc/02/90/35/332029035.db2.gz	OWMFHUAZXGZKCU-LLVKDONJSA-N	0	0	298.213	4.103	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1ccc2ccccc2c1	ZINC000488844665	332029041	/nfs/dbraw/zinc/02/90/41/332029041.db2.gz	PDOSBOSEPPBSRM-KRWDZBQOSA-N	0	0	265.356	4.021	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1csc2c1CC[C@H](C)C2	ZINC000488854704	332029712	/nfs/dbraw/zinc/02/97/12/332029712.db2.gz	NQXCNFUDAQHTPR-QWHCGFSZSA-N	0	0	289.444	4.054	20	30		CIEDRN
C=C1CCN(C(=O)C[C@@H]2C[C@H](C)c3c2cccc3C)CC1	ZINC000488870049	332030490	/nfs/dbraw/zinc/03/04/90/332030490.db2.gz	BQKBKYKAUAOGOJ-HOTGVXAUSA-N	0	0	283.415	4.155	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)[C@@H](C)Cc1ccc(Cl)cc1	ZINC000488875451	332030930	/nfs/dbraw/zinc/03/09/30/332030930.db2.gz	DXIOGASEFJKDJS-BBRMVZONSA-N	0	0	291.822	4.086	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)C[C@@H]1CCCCC1(C)C	ZINC000488876547	332031037	/nfs/dbraw/zinc/03/10/37/332031037.db2.gz	IGXKNMPXCQAKOF-LSDHHAIUSA-N	0	0	263.425	4.160	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)C[C@H]1CCCCC1(C)C	ZINC000488876546	332031132	/nfs/dbraw/zinc/03/11/32/332031132.db2.gz	IGXKNMPXCQAKOF-HUUCEWRRSA-N	0	0	263.425	4.160	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@@H]1C[C@@H]1c1ccc([C@@H]2C[C@H]2C)o1	ZINC000488881514	332031845	/nfs/dbraw/zinc/03/18/45/332031845.db2.gz	ORYZGNWTQRVGFW-DGXTUMSLSA-N	0	0	299.414	4.074	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)CC/C=C/c1ccccc1	ZINC000488883874	332032100	/nfs/dbraw/zinc/03/21/00/332032100.db2.gz	XPBPOWSUAIZBAQ-NIUUYTMRSA-N	0	0	269.388	4.047	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)C[C@@H](CC)c1ccc(C)cc1	ZINC000488889018	332032400	/nfs/dbraw/zinc/03/24/00/332032400.db2.gz	ZJTMXCUVUWPICL-AEFFLSMTSA-N	0	0	285.431	4.446	20	30		CIEDRN
C=CCn1c(SC2CCCC2)nnc1-c1ccccc1C	ZINC000488924102	332034073	/nfs/dbraw/zinc/03/40/73/332034073.db2.gz	XMZCFEJDHWLOID-UHFFFAOYSA-N	0	0	299.443	4.474	20	30		CIEDRN
C=CCCCN(C)C(=O)C[C@H]1C[C@@H](C)c2c1cccc2C	ZINC000488960533	332035636	/nfs/dbraw/zinc/03/56/36/332035636.db2.gz	LOORPGMCMPSKTE-HZPDHXFCSA-N	0	0	285.431	4.401	20	30		CIEDRN
C=CCn1cccc1C(=O)N(CC)[C@@H](CC)c1ccccc1	ZINC000488985612	332036735	/nfs/dbraw/zinc/03/67/35/332036735.db2.gz	RGZJZYHQRKGITH-KRWDZBQOSA-N	0	0	296.414	4.288	20	30		CIEDRN
C=CCCCN(C)C(=O)[C@@H](CCC=C)c1ccccc1	ZINC000489009398	332037509	/nfs/dbraw/zinc/03/75/09/332037509.db2.gz	ILQNZAQOURSLMA-KRWDZBQOSA-N	0	0	271.404	4.161	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1[C@@H]2CCC[C@@H]21	ZINC000489090314	332041206	/nfs/dbraw/zinc/04/12/06/332041206.db2.gz	VOCFXFUNMKLJSK-ALXJQNPVSA-N	0	0	298.430	4.459	20	30		CIEDRN
C=C[C@@H]1CCCCN1Cc1ncc(-c2ccc(C)cc2)o1	ZINC000489423052	332051089	/nfs/dbraw/zinc/05/10/89/332051089.db2.gz	HBADHXOWKFXFQV-MRXNPFEDSA-N	0	0	282.387	4.191	20	30		CIEDRN
C=C[C@@H]1CCCCN1Cc1ncc(-c2ccccc2)s1	ZINC000489439253	332052875	/nfs/dbraw/zinc/05/28/75/332052875.db2.gz	QUAAUEYGQDVNSH-OAHLLOKOSA-N	0	0	284.428	4.351	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@H]1CCC(C)(C)C1)c1ccccc1	ZINC000489632893	332062200	/nfs/dbraw/zinc/06/22/00/332062200.db2.gz	WTYCYQKBWOFSBU-HOTGVXAUSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H]1CCC[C@@H](c2ccccc2)C1	ZINC000489642904	332062715	/nfs/dbraw/zinc/06/27/15/332062715.db2.gz	RPOIEFPNYLMSLA-ZIFCJYIRSA-N	0	0	285.431	4.431	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1ccc(SCC)cc1	ZINC000489738221	332066509	/nfs/dbraw/zinc/06/65/09/332066509.db2.gz	UQFFLQTVNAXTNT-UHFFFAOYSA-N	0	0	277.433	4.131	20	30		CIEDRN
C=CCC[C@H](C(=O)NCCC1=CCCC1)c1ccccc1	ZINC000489757952	332066958	/nfs/dbraw/zinc/06/69/58/332066958.db2.gz	YBRGBMUUKBZXEN-SFHVURJKSA-N	0	0	283.415	4.353	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@@H](CCC)c1ccccc1	ZINC000489769042	332067206	/nfs/dbraw/zinc/06/72/06/332067206.db2.gz	OGIGACNUSPUVMF-INIZCTEOSA-N	0	0	273.420	4.289	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@@H]1C[C@H]1c1ccccc1CC	ZINC000489826845	332069335	/nfs/dbraw/zinc/06/93/35/332069335.db2.gz	QGAMHDCAACUZAO-DLBZAZTESA-N	0	0	285.431	4.071	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)C[C@H](C)c1ccccc1C	ZINC000489858725	332070589	/nfs/dbraw/zinc/07/05/89/332070589.db2.gz	LZBMQZJZZHJNFN-HNNXBMFYSA-N	0	0	273.420	4.207	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)CSc1ccccc1Cl	ZINC000489882150	332071538	/nfs/dbraw/zinc/07/15/38/332071538.db2.gz	JLSYQZSMNULWCO-UHFFFAOYSA-N	0	0	297.851	4.151	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@@H](C)c1cn(C)c2ccccc12	ZINC000489907691	332072476	/nfs/dbraw/zinc/07/24/76/332072476.db2.gz	LKSZLJICRRHGHQ-AWEZNQCLSA-N	0	0	298.430	4.000	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(C)c(Oc2cc(C)ccn2)c1	ZINC000172712353	332942397	/nfs/dbraw/zinc/94/23/97/332942397.db2.gz	DMQKKYSKNDGIAD-UHFFFAOYSA-N	0	0	296.370	4.395	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@@H](C)CSc1ccccc1	ZINC000489942456	332073520	/nfs/dbraw/zinc/07/35/20/332073520.db2.gz	PCZIULZEOHAORA-AWEZNQCLSA-N	0	0	291.460	4.133	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)c1cc(C)c(F)c(C)c1	ZINC000489960676	332074660	/nfs/dbraw/zinc/07/46/60/332074660.db2.gz	WIIHXVCUVOGCBK-UHFFFAOYSA-N	0	0	290.382	4.035	20	30		CIEDRN
C=CCn1cccc1C(=O)N(Cc1ccccc1)[C@H](C)CC	ZINC000490022980	332076981	/nfs/dbraw/zinc/07/69/81/332076981.db2.gz	CZAXJHPRXYVDQF-MRXNPFEDSA-N	0	0	296.414	4.115	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)CCCc1ccc(C)s1	ZINC000490037023	332077725	/nfs/dbraw/zinc/07/77/25/332077725.db2.gz	GZFSEBZSUCNBGE-UHFFFAOYSA-N	0	0	279.449	4.098	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1sccc1C(C)C	ZINC000490036147	332077748	/nfs/dbraw/zinc/07/77/48/332077748.db2.gz	DZFFRHZILZXCFW-UHFFFAOYSA-N	0	0	265.422	4.204	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@H](C)c1cccc(Cl)c1	ZINC000490036330	332077833	/nfs/dbraw/zinc/07/78/33/332077833.db2.gz	FUPKPFHPTQEJGT-GFCCVEGCSA-N	0	0	279.811	4.162	20	30		CIEDRN
C=CCN(C)C(=O)C[C@@H](Cc1ccccc1)c1ccccc1	ZINC000490045113	332078324	/nfs/dbraw/zinc/07/83/24/332078324.db2.gz	NCWRWYKSILCCQI-LJQANCHMSA-N	0	0	293.410	4.047	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1ccc(C(C)(F)F)cc1	ZINC000490061729	332079497	/nfs/dbraw/zinc/07/94/97/332079497.db2.gz	SNOCWNVNLMZBSN-UHFFFAOYSA-N	0	0	281.346	4.130	20	30		CIEDRN
C=CCC[C@@H](C(=O)N[C@@H](C)CC(F)(F)F)c1ccccc1	ZINC000490260450	332085644	/nfs/dbraw/zinc/08/56/44/332085644.db2.gz	PKKCTGHBZFSUSK-GXTWGEPZSA-N	0	0	299.336	4.194	20	30		CIEDRN
C=CC[C@@H](C(=O)N1CCc2c1cccc2F)c1ccccc1	ZINC000490252838	332085660	/nfs/dbraw/zinc/08/56/60/332085660.db2.gz	RAABTQHPXUGBQZ-OAHLLOKOSA-N	0	0	295.357	4.075	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(Cl)c2ccncc12	ZINC000490626516	332096758	/nfs/dbraw/zinc/09/67/58/332096758.db2.gz	OJRHBEBRWFQQJH-MRXNPFEDSA-N	0	0	288.778	4.429	20	30		CIEDRN
C[C@@H]([C@H](C)NC(=O)C1(C#N)CCCCC1)C1CCCCC1	ZINC000490887266	332124888	/nfs/dbraw/zinc/12/48/88/332124888.db2.gz	LOTPPWPAHKZNRG-GJZGRUSLSA-N	0	0	290.451	4.182	20	30		CIEDRN
CCCCN(C(=O)CC(C)(C)C#N)[C@@H](C)c1ccccc1	ZINC000490901187	332127652	/nfs/dbraw/zinc/12/76/52/332127652.db2.gz	ZJOCYVSGFSETJN-HNNXBMFYSA-N	0	0	286.419	4.316	20	30		CIEDRN
CCCN(C(=O)CC(C)(C)C#N)[C@@H](CC)c1ccccc1	ZINC000490933552	332130511	/nfs/dbraw/zinc/13/05/11/332130511.db2.gz	KZTDWRDIYPBNHE-INIZCTEOSA-N	0	0	286.419	4.316	20	30		CIEDRN
C=CC1CCN(C(=O)N[C@H](c2ccccc2C)C2CC2)CC1	ZINC000491131615	332154716	/nfs/dbraw/zinc/15/47/16/332154716.db2.gz	HLLYMJLUSWEFNI-SFHVURJKSA-N	0	0	298.430	4.054	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)Nc1ccc(CC)cc1	ZINC000491399227	332204754	/nfs/dbraw/zinc/20/47/54/332204754.db2.gz	VWDHBPWGTIKZKP-UHFFFAOYSA-N	0	0	298.386	4.105	20	30		CIEDRN
CC#CCN(C)[C@@H](C)c1ncc(-c2ccc(Cl)cc2)o1	ZINC000575334877	335095565	/nfs/dbraw/zinc/09/55/65/335095565.db2.gz	BOCZVPSDICLKGV-LBPRGKRZSA-N	0	0	288.778	4.011	20	30		CIEDRN
C#C[C@@H](C)N(C)C(=O)Nc1cc(-c2ccc(C)o2)ccc1C	ZINC000491507128	332225445	/nfs/dbraw/zinc/22/54/45/332225445.db2.gz	UCNMRXVAGFOSHS-CYBMUJFWSA-N	0	0	296.370	4.049	20	30		CIEDRN
N#Cc1ccc(N[C@@H](c2ccccc2)[C@H]2CCCO2)c(F)c1	ZINC000172144771	335096090	/nfs/dbraw/zinc/09/60/90/335096090.db2.gz	QGSQMVITJNGLFF-MSOLQXFVSA-N	0	0	296.345	4.030	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)C[C@H](C)c1cccc(F)c1	ZINC000172231717	335098269	/nfs/dbraw/zinc/09/82/69/335098269.db2.gz	KURLRHQIZIYOQU-ZDUSSCGKSA-N	0	0	296.345	4.138	20	30		CIEDRN
C#CCN(C(=O)N(c1ccccc1)c1ccccc1)C1CC1	ZINC000491697005	332292360	/nfs/dbraw/zinc/29/23/60/332292360.db2.gz	GCHPYZQHZOWJOY-UHFFFAOYSA-N	0	0	290.366	4.042	20	30		CIEDRN
C/C=C(/C=C\C(=O)N(Cc1ccc(C#N)cc1)C(C)C)CC	ZINC000492156626	332384945	/nfs/dbraw/zinc/38/49/45/332384945.db2.gz	JYIGGMADYDVJIB-GXYBGBDGSA-N	0	0	296.414	4.208	20	30		CIEDRN
C=CCSCC(=O)Nc1cccc(Oc2ccccc2)c1	ZINC000492731181	332411283	/nfs/dbraw/zinc/41/12/83/332411283.db2.gz	ZZHJSCZUWOFHOF-UHFFFAOYSA-N	0	0	299.395	4.337	20	30		CIEDRN
CCN(C(=O)/C=C\C1CCCC1)[C@H](C)c1ccc(C#N)cc1	ZINC000493373700	332437649	/nfs/dbraw/zinc/43/76/49/332437649.db2.gz	VNLMTJADUXOZPV-VSKPTYQZSA-N	0	0	296.414	4.214	20	30		CIEDRN
COc1ccc(C#N)cc1N[C@H](C)c1ccc(F)cc1F	ZINC000493836204	332455964	/nfs/dbraw/zinc/45/59/64/332455964.db2.gz	OWBGZVPAJOMACS-SNVBAGLBSA-N	0	0	288.297	4.018	20	30		CIEDRN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)/C=C\C1CCCC1	ZINC000493844300	332456371	/nfs/dbraw/zinc/45/63/71/332456371.db2.gz	AHQHMBFVOQQRSJ-QXMHVHEDSA-N	0	0	296.414	4.042	20	30		CIEDRN
C=CC[C@@H](C)[C@H](C)Nc1cc(NC(=O)NCC)ccc1C	ZINC000494440660	332473284	/nfs/dbraw/zinc/47/32/84/332473284.db2.gz	YPOHUQIMNMLTNZ-OCCSQVGLSA-N	0	0	289.423	4.149	20	30		CIEDRN
Cc1ccc(N[C@@H]2CCC[C@H](C#N)C2)cc1OC(C)C	ZINC000494485045	332475309	/nfs/dbraw/zinc/47/53/09/332475309.db2.gz	QUYDPLAJUBJUBR-LSDHHAIUSA-N	0	0	272.392	4.277	20	30		CIEDRN
Cc1ccc(N[C@@H]2CCC[C@@H](C#N)C2)cc1OC(C)C	ZINC000494485044	332475367	/nfs/dbraw/zinc/47/53/67/332475367.db2.gz	QUYDPLAJUBJUBR-HUUCEWRRSA-N	0	0	272.392	4.277	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)N[C@H](C)c1cccc(C)c1C	ZINC000495198803	332511558	/nfs/dbraw/zinc/51/15/58/332511558.db2.gz	ALZIFNRGQPHWSX-HZPDHXFCSA-N	0	0	286.419	4.115	20	30		CIEDRN
COCC[C@@H](Sc1cccc(C#N)c1)c1ccccc1	ZINC000495253128	332513226	/nfs/dbraw/zinc/51/32/26/332513226.db2.gz	NZVPQFVEOVHIBF-QGZVFWFLSA-N	0	0	283.396	4.428	20	30		CIEDRN
N#Cc1ccc(SCc2ccc(F)cc2Cl)nc1	ZINC000495266477	332513661	/nfs/dbraw/zinc/51/36/61/332513661.db2.gz	GNPWXKLMAXBLJG-UHFFFAOYSA-N	0	0	278.739	4.038	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1nc2c(ccc(F)c2F)s1	ZINC000495285350	332514051	/nfs/dbraw/zinc/51/40/51/332514051.db2.gz	OFDFVZMKXVFUEM-UHFFFAOYSA-N	0	0	296.342	4.115	20	30		CIEDRN
C=C(CC)CSc1nnc(-c2ccc(Cl)cc2)o1	ZINC000552962284	334353263	/nfs/dbraw/zinc/35/32/63/334353263.db2.gz	JZBLNGWBUWHCQB-UHFFFAOYSA-N	0	0	280.780	4.448	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](c2cccc(Cl)c2)C1	ZINC000496806420	332560763	/nfs/dbraw/zinc/56/07/63/332560763.db2.gz	PNTCVSCAEHMLGP-RHSMWYFYSA-N	0	0	291.822	4.258	20	30		CIEDRN
CC(C)(CCC#N)CNC(=O)[C@@H]1CCC[C@H]2CCCC[C@H]21	ZINC000553755886	334397832	/nfs/dbraw/zinc/39/78/32/334397832.db2.gz	MXHZXOCJYOGCQA-BZUAXINKSA-N	0	0	290.451	4.039	20	30		CIEDRN
CC(C)(C#N)C(=O)NCC1(C2CCCCC2)CCCCC1	ZINC000498820648	332573667	/nfs/dbraw/zinc/57/36/67/332573667.db2.gz	PKJHQJZKDLAIHW-UHFFFAOYSA-N	0	0	290.451	4.183	20	30		CIEDRN
CCC[C@H](CC1CCCC1)C(=O)NCC#Cc1ccccc1	ZINC000499285220	332583600	/nfs/dbraw/zinc/58/36/00/332583600.db2.gz	DFOUUYFPYTWRLJ-LJQANCHMSA-N	0	0	297.442	4.151	20	30		CIEDRN
CCC[C@@H](CC1CCCC1)C(=O)NCc1ccc(C#N)cc1	ZINC000499410818	332585528	/nfs/dbraw/zinc/58/55/28/332585528.db2.gz	FBRZZTDKKKSAII-SFHVURJKSA-N	0	0	298.430	4.171	20	30		CIEDRN
C=C(C)COc1cccc(N[C@@H]2C[C@@H](C)O[C@@H](C)C2)c1	ZINC000247300079	334278784	/nfs/dbraw/zinc/27/87/84/334278784.db2.gz	ZQMUIUNFNMLBFW-MIFYACCESA-N	0	0	275.392	4.009	20	30		CIEDRN
N#CC1(CCCOc2cccc3ccccc32)CCOCC1	ZINC000499906663	332595487	/nfs/dbraw/zinc/59/54/87/332595487.db2.gz	NUPGPYLOCDYOJK-UHFFFAOYSA-N	0	0	295.382	4.319	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1cc(Cl)ccc1C	ZINC000500104547	332599384	/nfs/dbraw/zinc/59/93/84/332599384.db2.gz	OZKXIBUKUYZGHI-LBPRGKRZSA-N	0	0	266.772	4.125	20	30		CIEDRN
Cc1ccc(C#N)c(N2CCC[C@@H](c3ccccc3)CC2)n1	ZINC000500255154	332603996	/nfs/dbraw/zinc/60/39/96/332603996.db2.gz	VGMGWHCWIRXCJF-QGZVFWFLSA-N	0	0	291.398	4.036	20	30		CIEDRN
C=CCC[C@H](NC(=O)c1ccc(O)c(C)c1)c1ccccc1	ZINC000500292012	332604345	/nfs/dbraw/zinc/60/43/45/332604345.db2.gz	YEPCGAGWHFSVCC-KRWDZBQOSA-N	0	0	295.382	4.138	20	30		CIEDRN
N#Cc1cccc(NCc2cc(C(F)(F)F)ccc2F)c1	ZINC000500838025	332619876	/nfs/dbraw/zinc/61/98/76/332619876.db2.gz	QDFNVVGVXRTKIT-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
COc1cc(C#N)ccc1CNc1ccc(Cl)cc1C	ZINC000500842886	332620144	/nfs/dbraw/zinc/62/01/44/332620144.db2.gz	TUDLKZZQRFBZEV-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
COc1cc(C#N)ccc1CNc1cc(C)ccc1Cl	ZINC000500881592	332621363	/nfs/dbraw/zinc/62/13/63/332621363.db2.gz	YFBZFSAAYJATNB-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
CN(Cc1ccc(F)cc1Cl)c1ccc(C#N)cc1F	ZINC000501226226	332629009	/nfs/dbraw/zinc/62/90/09/332629009.db2.gz	UGVHNTPQHPFMGD-UHFFFAOYSA-N	0	0	292.716	4.126	20	30		CIEDRN
C[C@H]1c2cc(Cl)cc(Cl)c2CCN1CC1(C#N)CC1	ZINC000501530166	332634717	/nfs/dbraw/zinc/63/47/17/332634717.db2.gz	VYIGKXHUACLPOO-JTQLQIEISA-N	0	0	295.213	4.216	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@H]1CCCC(F)(F)C1	ZINC000501525502	332634890	/nfs/dbraw/zinc/63/48/90/332634890.db2.gz	WGYFPPMYSZGDTD-LBPRGKRZSA-N	0	0	299.386	4.088	20	30		CIEDRN
N#CC1(CN(Cc2ccccc2F)c2ccc(F)cc2)CC1	ZINC000501526413	332634956	/nfs/dbraw/zinc/63/49/56/332634956.db2.gz	BDOWDHQBXFUIGN-UHFFFAOYSA-N	0	0	298.336	4.275	20	30		CIEDRN
CC(C)(C#N)CC(=O)N1CCC[C@H]1CCC1CCCCC1	ZINC000501739456	332639758	/nfs/dbraw/zinc/63/97/58/332639758.db2.gz	CCLFARFEYCIKAB-INIZCTEOSA-N	0	0	290.451	4.278	20	30		CIEDRN
N#Cc1c(F)cccc1N(Cc1ccc(F)cc1)C1CC1	ZINC000501922088	332643356	/nfs/dbraw/zinc/64/33/56/332643356.db2.gz	LFWRGOIYWAAJGC-UHFFFAOYSA-N	0	0	284.309	4.005	20	30		CIEDRN
N#C[C@H](Sc1ccc(N)cc1Cl)C1CCCCC1	ZINC000502133118	332649293	/nfs/dbraw/zinc/64/92/93/332649293.db2.gz	HJUFABQNUCEMOJ-AWEZNQCLSA-N	0	0	280.824	4.487	20	30		CIEDRN
C=CCC(CC=C)C(=O)NCCc1c(C)cc(C)cc1C	ZINC000502167304	332649804	/nfs/dbraw/zinc/64/98/04/332649804.db2.gz	DTDSYMFVGWSGJK-UHFFFAOYSA-N	0	0	285.431	4.039	20	30		CIEDRN
COCC1CCC(Nc2cccc(C(F)F)c2C#N)CC1	ZINC000566481476	334651742	/nfs/dbraw/zinc/65/17/42/334651742.db2.gz	DHEWDQMWGXDEOT-UHFFFAOYSA-N	0	0	294.345	4.113	20	30		CIEDRN
Cc1cc(C)cc(NC(=O)Nc2cc(C#N)ccc2C)c1	ZINC000502472086	332662311	/nfs/dbraw/zinc/66/23/11/332662311.db2.gz	ILYHUOXHAOBRGL-UHFFFAOYSA-N	0	0	279.343	4.128	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)C1C[C@@H](C)C[C@H](C)C1	ZINC000503420559	332689153	/nfs/dbraw/zinc/68/91/53/332689153.db2.gz	SSNSXZLJYSMQKV-KBPBESRZSA-N	0	0	278.440	4.037	20	30		CIEDRN
CCCC[C@H](C)C(=O)N(Cc1ccc(C#N)cc1)C(C)C	ZINC000503461660	332690142	/nfs/dbraw/zinc/69/01/42/332690142.db2.gz	CYXASYZSKTXIBR-HNNXBMFYSA-N	0	0	286.419	4.122	20	30		CIEDRN
CC[C@H]1CCC[C@H](Nc2nc(C(F)(F)F)ccc2C#N)C1	ZINC000086485551	332690740	/nfs/dbraw/zinc/69/07/40/332690740.db2.gz	VVWNJDUDNDCABY-JQWIXIFHSA-N	0	0	297.324	4.353	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N1CC(C)(C)[C@@H]1c1cccs1	ZINC000504079231	332703489	/nfs/dbraw/zinc/70/34/89/332703489.db2.gz	VASWMZQTLGUKCX-OCCSQVGLSA-N	0	0	292.448	4.195	20	30		CIEDRN
C=CCCCCCNC(=O)CCc1cnc2ccccc2c1	ZINC000568898737	334846103	/nfs/dbraw/zinc/84/61/03/334846103.db2.gz	PZZLPDVWRTWYSS-UHFFFAOYSA-N	0	0	296.414	4.030	20	30		CIEDRN
C=C[C@@H](CC(=O)NC1CC(C(C)(C)C)C1)c1ccccc1	ZINC000504810940	332721385	/nfs/dbraw/zinc/72/13/85/332721385.db2.gz	RQIINOSDMASLOM-OOHWJJMZSA-N	0	0	285.431	4.287	20	30		CIEDRN
CC(C)(C)C1CC(NC(=O)C[C@@H](CC#N)c2ccccc2)C1	ZINC000504838586	332721890	/nfs/dbraw/zinc/72/18/90/332721890.db2.gz	KXWFPUZKZJQVHF-KLAILNCOSA-N	0	0	298.430	4.015	20	30		CIEDRN
CCOC1CC(CSc2ccc(C#N)cc2Cl)C1	ZINC000504944202	332725964	/nfs/dbraw/zinc/72/59/64/332725964.db2.gz	TUMSICOKWXBRNV-UHFFFAOYSA-N	0	0	281.808	4.119	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N[C@H]1CCC[C@@H]1C	ZINC000505001287	332727288	/nfs/dbraw/zinc/72/72/88/332727288.db2.gz	RCEPBHQQVHTVBL-ZFWWWQNUSA-N	0	0	272.392	4.115	20	30		CIEDRN
Cc1ccccc1-c1noc(/C=C\c2ccccc2C#N)n1	ZINC000504990950	332727387	/nfs/dbraw/zinc/72/73/87/332727387.db2.gz	JNWSDTFLNHGIHT-KHPPLWFESA-N	0	0	287.322	4.087	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CC[C@@H](C2CC2)C1	ZINC000505005452	332727574	/nfs/dbraw/zinc/72/75/74/332727574.db2.gz	LDISHROMKXXLEH-MRXNPFEDSA-N	0	0	284.403	4.069	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CCC(CC)CC1	ZINC000505016427	332727916	/nfs/dbraw/zinc/72/79/16/332727916.db2.gz	HGUVBDYBXHNKAV-UHFFFAOYSA-N	0	0	286.419	4.459	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N(C)Cc1ccco1	ZINC000505023205	332728104	/nfs/dbraw/zinc/72/81/04/332728104.db2.gz	KGCYEEWWSCTBDY-UHFFFAOYSA-N	0	0	284.359	4.062	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N(C)[C@@H](C)CCC	ZINC000505023011	332728197	/nfs/dbraw/zinc/72/81/97/332728197.db2.gz	IQNHARVHRHBNHG-AWEZNQCLSA-N	0	0	274.408	4.458	20	30		CIEDRN
C=CCCCCNC(=O)Nc1ccccc1CCC=C	ZINC000505036586	332728756	/nfs/dbraw/zinc/72/87/56/332728756.db2.gz	XYEVSEJRPBGMQX-UHFFFAOYSA-N	0	0	272.392	4.283	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CCC(C)CC1	ZINC000505046790	332729209	/nfs/dbraw/zinc/72/92/09/332729209.db2.gz	ZDZYPBWITVPKPJ-UHFFFAOYSA-N	0	0	272.392	4.069	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCc1ccc(C(F)(F)F)cc1C	ZINC000505098798	332731091	/nfs/dbraw/zinc/73/10/91/332731091.db2.gz	NYDMZARSACENGM-UHFFFAOYSA-N	0	0	299.336	4.232	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000505353630	332738591	/nfs/dbraw/zinc/73/85/91/332738591.db2.gz	PZJXMJKAUOSXOO-JUWJPQTCSA-N	0	0	295.426	4.459	20	30		CIEDRN
C=C(C)CCn1cnc2scc(-c3ccccc3)c2c1=O	ZINC000505448500	332740822	/nfs/dbraw/zinc/74/08/22/332740822.db2.gz	AVOTZPMDBYAPCL-UHFFFAOYSA-N	0	0	296.395	4.091	20	30		CIEDRN
C=C(C)CCSc1nnc(C(C)C)n1Cc1ccco1	ZINC000505488641	332741892	/nfs/dbraw/zinc/74/18/92/332741892.db2.gz	WCXQAEBAEHRAAX-UHFFFAOYSA-N	0	0	291.420	4.101	20	30		CIEDRN
CCN(C(=O)c1cc(C#N)ccc1Cl)c1cccc(C)c1	ZINC000505605671	332746228	/nfs/dbraw/zinc/74/62/28/332746228.db2.gz	DUVBOOQEGYCUCH-UHFFFAOYSA-N	0	0	298.773	4.187	20	30		CIEDRN
CCCC[C@@H](CC)C(=O)N[C@@H](C#N)c1ccccc1Cl	ZINC000505661874	332748635	/nfs/dbraw/zinc/74/86/35/332748635.db2.gz	OPPOOMLQHOGMRP-DOMZBBRYSA-N	0	0	292.810	4.237	20	30		CIEDRN
CC(C)(C)c1ccc([C@H](C#N)NC(=O)C2(C)CCCC2)cc1	ZINC000505815058	332753271	/nfs/dbraw/zinc/75/32/71/332753271.db2.gz	JHOMYQNBMLLLJK-INIZCTEOSA-N	0	0	298.430	4.245	20	30		CIEDRN
CC(C)C[C@@H](C)CC(=O)N[C@H](C#N)c1ccc(Cl)cc1	ZINC000505819185	332753676	/nfs/dbraw/zinc/75/36/76/332753676.db2.gz	FIQYSZHRLDBEAM-IUODEOHRSA-N	0	0	292.810	4.093	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCc1ccc(OCCC)cc1C	ZINC000505848153	332754612	/nfs/dbraw/zinc/75/46/12/332754612.db2.gz	NBMHZQWFHCZVFY-UHFFFAOYSA-N	0	0	289.419	4.002	20	30		CIEDRN
CCCC[C@H](CC)CC(=O)N[C@H](C#N)c1ccccc1F	ZINC000505923651	332757959	/nfs/dbraw/zinc/75/79/59/332757959.db2.gz	WWDKHKOVOYCTRN-XJKSGUPXSA-N	0	0	290.382	4.113	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)N[C@@H](CC(C)C)c1ccccc1C	ZINC000512324255	332963034	/nfs/dbraw/zinc/96/30/34/332963034.db2.gz	RBVAEYIKIUQDJU-WMZOPIPTSA-N	0	0	286.419	4.138	20	30		CIEDRN
Cc1ccc(/C=C\c2ccc(C#N)cn2)c(Br)c1	ZINC000512326689	332963321	/nfs/dbraw/zinc/96/33/21/332963321.db2.gz	VCZFOCVOVPVZIV-ALCCZGGFSA-N	0	0	299.171	4.195	20	30		CIEDRN
C=CCCC(=O)N[C@H](c1ccc(Cl)cc1)[C@@H]1C[C@@H]1C	ZINC000304053165	332965254	/nfs/dbraw/zinc/96/52/54/332965254.db2.gz	PEGQCTXNQOCADQ-SGIREYDYSA-N	0	0	277.795	4.120	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)Nc1cccc(Nc2ccccc2)c1	ZINC000512687537	332980185	/nfs/dbraw/zinc/98/01/85/332980185.db2.gz	TVDWISRPQQSFBS-GOSISDBHSA-N	0	0	293.370	4.309	20	30		CIEDRN
N#CCSCCCSCc1cccc(Cl)c1	ZINC000174015597	332988717	/nfs/dbraw/zinc/98/87/17/332988717.db2.gz	LVCTYGLWOPKGGU-UHFFFAOYSA-N	0	0	271.838	4.220	20	30		CIEDRN
C[C@@H](CC1CCCC1)C(=O)Nc1ccc(C#N)cc1Cl	ZINC000512848230	332989477	/nfs/dbraw/zinc/98/94/77/332989477.db2.gz	BOPFLLNPMCIEIU-NSHDSACASA-N	0	0	290.794	4.367	20	30		CIEDRN
N#CCSCCCN(c1ccccc1)C1CCCC1	ZINC000174157554	332992757	/nfs/dbraw/zinc/99/27/57/332992757.db2.gz	QCTZHEMDFZMYJC-UHFFFAOYSA-N	0	0	274.433	4.082	20	30		CIEDRN
C=CCN(CC=C)C(=O)N[C@@H](CC)c1ccc(Cl)s1	ZINC000513079616	333003240	/nfs/dbraw/zinc/00/32/40/333003240.db2.gz	ARQHFTRXSYSNIX-NSHDSACASA-N	0	0	298.839	4.236	20	30		CIEDRN
N#Cc1csc(C[NH+]2CCC3(CCCCC3)CC2)c1	ZINC000513116786	333005162	/nfs/dbraw/zinc/00/51/62/333005162.db2.gz	LFFFSAPVWCCPQF-UHFFFAOYSA-N	0	0	274.433	4.166	20	30		CIEDRN
COc1ccc(F)cc1[C@@H](C)Nc1ccc(F)cc1C#N	ZINC000174689866	333005730	/nfs/dbraw/zinc/00/57/30/333005730.db2.gz	CZYZEOAGFWFNKN-SNVBAGLBSA-N	0	0	288.297	4.018	20	30		CIEDRN
CC(C)(C#N)CCCN1CCCSc2ccccc21	ZINC000174810317	333007631	/nfs/dbraw/zinc/00/76/31/333007631.db2.gz	ZJGAMXSJQWDKFZ-UHFFFAOYSA-N	0	0	274.433	4.319	20	30		CIEDRN
CC(=O)[C@@H](C)SCc1ccc(-c2ccccc2C#N)cc1	ZINC000175190998	333016738	/nfs/dbraw/zinc/01/67/38/333016738.db2.gz	GPKWBQMIVPWSET-CQSZACIVSA-N	0	0	295.407	4.436	20	30		CIEDRN
C=CCCCC(=O)N[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000175252117	333018407	/nfs/dbraw/zinc/01/84/07/333018407.db2.gz	WGBXVVQZXUZTFQ-LLVKDONJSA-N	0	0	285.309	4.239	20	30		CIEDRN
C=CCCCC(=O)N(C)[C@H](C)c1ccccc1Cl	ZINC000175242225	333018437	/nfs/dbraw/zinc/01/84/37/333018437.db2.gz	ORSGAXPPCGUXCZ-GFCCVEGCSA-N	0	0	265.784	4.216	20	30		CIEDRN
CCCCCN(C(=O)c1ccc(C#N)cc1)[C@@H](C)CCC	ZINC000513444773	333019678	/nfs/dbraw/zinc/01/96/78/333019678.db2.gz	PNZSJJVKSDYFGZ-HNNXBMFYSA-N	0	0	286.419	4.379	20	30		CIEDRN
N#Cc1csc(CNc2ccc3c(c2)CCCC3)c1	ZINC000404730674	333024922	/nfs/dbraw/zinc/02/49/22/333024922.db2.gz	ZHTGXEREGZZYFZ-UHFFFAOYSA-N	0	0	268.385	4.111	20	30		CIEDRN
N#Cc1cnc(Sc2cc(F)ccc2F)c(Cl)c1	ZINC000513602741	333026187	/nfs/dbraw/zinc/02/61/87/333026187.db2.gz	JFMLFTKOLXIPFO-UHFFFAOYSA-N	0	0	282.702	4.036	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@@H](c2ccccc2)CC1	ZINC000175538246	333026373	/nfs/dbraw/zinc/02/63/73/333026373.db2.gz	NXLXSRJFUARYNE-QGZVFWFLSA-N	0	0	271.404	4.139	20	30		CIEDRN
N#Cc1cnc(N(CC2CCCCC2)C2CC2)c(Cl)c1	ZINC000513621788	333027209	/nfs/dbraw/zinc/02/72/09/333027209.db2.gz	YSMJLGXBLABPGZ-UHFFFAOYSA-N	0	0	289.810	4.156	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1Cc2cc(C)ccc2CC1(C)C	ZINC000513628704	333027442	/nfs/dbraw/zinc/02/74/42/333027442.db2.gz	BTEOTMLBQFDMPF-HNNXBMFYSA-N	0	0	285.431	4.261	20	30		CIEDRN
N#Cc1cnc(Oc2ccc(F)c(Cl)c2)c(Cl)c1	ZINC000513636066	333028313	/nfs/dbraw/zinc/02/83/13/333028313.db2.gz	VQCUANQPQDMZPD-UHFFFAOYSA-N	0	0	283.089	4.191	20	30		CIEDRN
Cc1ccccc1CSc1ncc(C#N)cc1Cl	ZINC000513652050	333029419	/nfs/dbraw/zinc/02/94/19/333029419.db2.gz	IINNIJGLZKPNNC-UHFFFAOYSA-N	0	0	274.776	4.207	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@@H]1c1cccc(C)c1C	ZINC000175763298	333032153	/nfs/dbraw/zinc/03/21/53/333032153.db2.gz	CSDCZMQARNWAAS-QGZVFWFLSA-N	0	0	271.404	4.323	20	30		CIEDRN
COc1ccc(Cl)cc1CN(CCC#N)CC(C)(C)C	ZINC000513736844	333036697	/nfs/dbraw/zinc/03/66/97/333036697.db2.gz	NAVJMOPHBZSZOE-UHFFFAOYSA-N	0	0	294.826	4.110	20	30		CIEDRN
Cc1ccc(-c2ccc(CN(C)[C@H](C)CC#N)s2)cc1	ZINC000513737019	333036737	/nfs/dbraw/zinc/03/67/37/333036737.db2.gz	RULUZHYTCXYIJT-CQSZACIVSA-N	0	0	284.428	4.458	20	30		CIEDRN
C=CCCCC(=O)N1CC[C@@H](C)C[C@H]1c1ccc(CC)o1	ZINC000176107114	333039473	/nfs/dbraw/zinc/03/94/73/333039473.db2.gz	IOQCXNNLIUEUPT-ZBFHGGJFSA-N	0	0	289.419	4.498	20	30		CIEDRN
C[C@H](C#N)CN(C)Cc1sc2ccccc2c1Cl	ZINC000513961314	333055225	/nfs/dbraw/zinc/05/52/25/333055225.db2.gz	AKYKCDCTVJLEMH-SNVBAGLBSA-N	0	0	278.808	4.146	20	30		CIEDRN
COC(=O)c1cccc(CSCCCC(C)(C)C#N)c1	ZINC000177244449	333055681	/nfs/dbraw/zinc/05/56/81/333055681.db2.gz	ONNXMYICTZOAND-UHFFFAOYSA-N	0	0	291.416	4.036	20	30		CIEDRN
COC(=O)c1ccc(CSCCCC(C)(C)C#N)cc1	ZINC000177244284	333055699	/nfs/dbraw/zinc/05/56/99/333055699.db2.gz	FLMFUOOCUPNFBW-UHFFFAOYSA-N	0	0	291.416	4.036	20	30		CIEDRN
Cc1cccc(-n2c3ccccc3nc2SCCC#N)c1	ZINC000513973671	333057034	/nfs/dbraw/zinc/05/70/34/333057034.db2.gz	AQOPPJVXISYSAE-UHFFFAOYSA-N	0	0	293.395	4.340	20	30		CIEDRN
C[C@@H](SC[C@H]1CCC(C)(C)O1)c1ccc(C#N)cc1	ZINC000184824467	333057924	/nfs/dbraw/zinc/05/79/24/333057924.db2.gz	OXLKINVQMHGDAM-IUODEOHRSA-N	0	0	275.417	4.310	20	30		CIEDRN
C=CCCCC(=O)N(c1ccc(OC)cc1)[C@H](C)C1CC1	ZINC000177790025	333063037	/nfs/dbraw/zinc/06/30/37/333063037.db2.gz	CGGYTDRVJYRGJU-CQSZACIVSA-N	0	0	287.403	4.183	20	30		CIEDRN
C=CCCCC(=O)N(c1ccc(OC)cc1)[C@@H](C)C1CC1	ZINC000177790014	333063121	/nfs/dbraw/zinc/06/31/21/333063121.db2.gz	CGGYTDRVJYRGJU-AWEZNQCLSA-N	0	0	287.403	4.183	20	30		CIEDRN
C=C(C)CS[C@H](C)c1nc(Cc2ccccc2)no1	ZINC000177866350	333064412	/nfs/dbraw/zinc/06/44/12/333064412.db2.gz	FJBUAXXQLMIGLX-GFCCVEGCSA-N	0	0	274.389	4.031	20	30		CIEDRN
C=C(C)CS[C@H](C)C(=O)Nc1ccccc1C(C)C	ZINC000177865388	333064432	/nfs/dbraw/zinc/06/44/32/333064432.db2.gz	WZZKEJSQBUIEOM-CYBMUJFWSA-N	0	0	277.433	4.446	20	30		CIEDRN
C=C(C)CSCc1ncc(-c2ccc(OC)cc2)o1	ZINC000177873177	333064843	/nfs/dbraw/zinc/06/48/43/333064843.db2.gz	SREQWEDGHFASGS-UHFFFAOYSA-N	0	0	275.373	4.160	20	30		CIEDRN
CCC1(C(=O)Nc2ccc(C#N)c(Cl)c2)CCCC1	ZINC000311347378	333067458	/nfs/dbraw/zinc/06/74/58/333067458.db2.gz	KPZQRHHHGRTTEL-UHFFFAOYSA-N	0	0	276.767	4.121	20	30		CIEDRN
C=CCn1c(S[C@@H](C)CCC)nnc1-c1ccco1	ZINC000178414347	333072456	/nfs/dbraw/zinc/07/24/56/333072456.db2.gz	TZUFFSZBXIWCSW-NSHDSACASA-N	0	0	277.393	4.005	20	30		CIEDRN
C[C@H](C(=O)Nc1sc(-c2ccccc2)cc1C#N)C1CC1	ZINC000178440568	333072821	/nfs/dbraw/zinc/07/28/21/333072821.db2.gz	RIDZYUSJDLQJLG-NSHDSACASA-N	0	0	296.395	4.271	20	30		CIEDRN
COc1cc(C(C)=O)ccc1SCc1ccccc1C#N	ZINC000178695567	333076674	/nfs/dbraw/zinc/07/66/74/333076674.db2.gz	INGMTOYKOGLXRP-UHFFFAOYSA-N	0	0	297.379	4.062	20	30		CIEDRN
N#Cc1ccc(NCCCCC2CCOCC2)c(Cl)c1	ZINC000312235330	333078654	/nfs/dbraw/zinc/07/86/54/333078654.db2.gz	MVGRJNIVNKECCK-UHFFFAOYSA-N	0	0	292.810	4.220	20	30		CIEDRN
CC[C@H]1CCCCCN1C(=O)Nc1scc(C)c1C#N	ZINC000520833305	333081219	/nfs/dbraw/zinc/08/12/19/333081219.db2.gz	VKEYRXWVRHVDRC-LBPRGKRZSA-N	0	0	291.420	4.115	20	30		CIEDRN
CCc1ccc2occ(C(=O)Nc3ccccc3C#N)c2c1	ZINC000516805305	333082934	/nfs/dbraw/zinc/08/29/34/333082934.db2.gz	HILFOGXILPFIRT-UHFFFAOYSA-N	0	0	290.322	4.119	20	30		CIEDRN
CCS[C@@H](C)c1noc([C@@H]2C[C@H]2c2cccc(C#N)c2)n1	ZINC000516857829	333084443	/nfs/dbraw/zinc/08/44/43/333084443.db2.gz	JBMHHCLWZCFHTE-LEWSCRJBSA-N	0	0	299.399	4.026	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2ccccc2OCC)no1	ZINC000516892254	333085461	/nfs/dbraw/zinc/08/54/61/333085461.db2.gz	BLRILZUQGZUCBG-LBPRGKRZSA-N	0	0	272.348	4.205	20	30		CIEDRN
C=C(C)CCc1noc(Cc2cccc(C(F)F)c2)n1	ZINC000516893559	333085632	/nfs/dbraw/zinc/08/56/32/333085632.db2.gz	PMLIOYMZHGPQIR-UHFFFAOYSA-N	0	0	278.302	4.107	20	30		CIEDRN
Cc1oc(C#N)cc1-c1nc(-c2cc(Cl)ccc2C)no1	ZINC000517261387	333096110	/nfs/dbraw/zinc/09/61/10/333096110.db2.gz	LRIXXOPWCGOUFL-UHFFFAOYSA-N	0	0	299.717	4.139	20	30		CIEDRN
C=C1CCN(C(=O)C[C@@H]2C[C@@H](C)CC(C)(C)C2)CC1	ZINC000517454643	333099907	/nfs/dbraw/zinc/09/99/07/333099907.db2.gz	GKTXBRABUJUYKX-CABCVRRESA-N	0	0	263.425	4.018	20	30		CIEDRN
C=C1CCN(C(=O)C[C@H]2C[C@@H](C)CC(C)(C)C2)CC1	ZINC000517454645	333099943	/nfs/dbraw/zinc/09/99/43/333099943.db2.gz	GKTXBRABUJUYKX-HUUCEWRRSA-N	0	0	263.425	4.018	20	30		CIEDRN
C=C(C)CN(CC)C(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1	ZINC000517482976	333100372	/nfs/dbraw/zinc/10/03/72/333100372.db2.gz	SEFWTEZROVLEFZ-RTBURBONSA-N	0	0	293.410	4.368	20	30		CIEDRN
C=CCOc1cccc(C[NH2+]Cc2ccc([C@H]3C[C@H]3C)o2)c1	ZINC000517543050	333101826	/nfs/dbraw/zinc/10/18/26/333101826.db2.gz	MZYRXYUCJVMMBR-KDOFPFPSSA-N	0	0	297.398	4.258	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)Nc1c(C)cccc1F	ZINC000182774924	333117564	/nfs/dbraw/zinc/11/75/64/333117564.db2.gz	IIYONCHNBSTIIE-UHFFFAOYSA-N	0	0	298.361	4.354	20	30		CIEDRN
C=CCN[C@H](c1ccccc1C(F)(F)F)C(F)(F)F	ZINC000183344164	333120292	/nfs/dbraw/zinc/12/02/92/333120292.db2.gz	UFXGFFQQSSJBLQ-SNVBAGLBSA-N	0	0	283.215	4.084	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1c(C)cccc1SC	ZINC000184606108	333130491	/nfs/dbraw/zinc/13/04/91/333130491.db2.gz	XYKUCHUWPHHTLM-UHFFFAOYSA-N	0	0	275.417	4.424	20	30		CIEDRN
C[C@@H]1CCC[C@H]1CC(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000184641907	333130865	/nfs/dbraw/zinc/13/08/65/333130865.db2.gz	MIXXBFRXOGJMLK-KGLIPLIRSA-N	0	0	284.403	4.253	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000184869395	333132900	/nfs/dbraw/zinc/13/29/00/333132900.db2.gz	GFWYHKROIITJPR-MRXNPFEDSA-N	0	0	285.431	4.070	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cc(C)c(Cl)cc1OC	ZINC000184892441	333133114	/nfs/dbraw/zinc/13/31/14/333133114.db2.gz	OMFVQILFRVJMTJ-LLVKDONJSA-N	0	0	281.783	4.198	20	30		CIEDRN
CC#CCCCC(=O)N(C)Cc1c2ccccc2oc1CC	ZINC000184928896	333133427	/nfs/dbraw/zinc/13/34/27/333133427.db2.gz	CEWCCZHXVHMCTA-UHFFFAOYSA-N	0	0	297.398	4.147	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](C)c1cc(C)sc1C	ZINC000185094570	333135581	/nfs/dbraw/zinc/13/55/81/333135581.db2.gz	RPKXNTTWRPHRFD-ZYHUDNBSSA-N	0	0	265.422	4.144	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(Cc2ccncc2)cc1	ZINC000185110395	333135601	/nfs/dbraw/zinc/13/56/01/333135601.db2.gz	CIUFGAKCYXSCEZ-HNNXBMFYSA-N	0	0	294.398	4.213	20	30		CIEDRN
CC#CCCCC(=O)N[C@H](CC)c1cccc(Cl)c1	ZINC000185119364	333135751	/nfs/dbraw/zinc/13/57/51/333135751.db2.gz	UALZAUSOXPYKNH-OAHLLOKOSA-N	0	0	277.795	4.101	20	30		CIEDRN
CC(C)C[C@@H](C)C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000185193669	333136541	/nfs/dbraw/zinc/13/65/41/333136541.db2.gz	PFKRQEQALJXIMC-CYBMUJFWSA-N	0	0	272.392	4.108	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H]1C1CCCCC1	ZINC000185221100	333136777	/nfs/dbraw/zinc/13/67/77/333136777.db2.gz	XJAZPGDKHBZDDP-GOEBONIOSA-N	0	0	263.425	4.160	20	30		CIEDRN
CC#CCCCC(=O)N[C@H](C)c1oc2ccccc2c1C	ZINC000185205083	333136799	/nfs/dbraw/zinc/13/67/99/333136799.db2.gz	BLZDLRXIBGRBDX-CQSZACIVSA-N	0	0	283.371	4.112	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@H]1C1CCCCC1	ZINC000185221158	333136845	/nfs/dbraw/zinc/13/68/45/333136845.db2.gz	XJAZPGDKHBZDDP-ZBFHGGJFSA-N	0	0	263.425	4.160	20	30		CIEDRN
CSc1cccc(C)c1NCc1ccc(C#N)cc1F	ZINC000185435819	333140497	/nfs/dbraw/zinc/14/04/97/333140497.db2.gz	BNTKGEDKEHYSSW-UHFFFAOYSA-N	0	0	286.375	4.340	20	30		CIEDRN
CSc1cccc(C)c1NCc1ccccc1C#N	ZINC000185433522	333140500	/nfs/dbraw/zinc/14/05/00/333140500.db2.gz	GNBIXQOJOAAHPE-UHFFFAOYSA-N	0	0	268.385	4.201	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NC(C)(C)CCc1ccccc1	ZINC000185440434	333140784	/nfs/dbraw/zinc/14/07/84/333140784.db2.gz	DMHVHZVRWYVKIX-HNNXBMFYSA-N	0	0	273.420	4.116	20	30		CIEDRN
CCSc1cccc(CNc2ccc(CC#N)cc2)c1	ZINC000185478370	333141563	/nfs/dbraw/zinc/14/15/63/333141563.db2.gz	SBSPTABVMVELNR-UHFFFAOYSA-N	0	0	282.412	4.477	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)Cc1ccc(F)cc1Cl	ZINC000185498611	333141998	/nfs/dbraw/zinc/14/19/98/333141998.db2.gz	AJDHGJOBVZXVKX-LLVKDONJSA-N	0	0	283.774	4.040	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCC1(Sc2ccccc2)CC1	ZINC000185517297	333142636	/nfs/dbraw/zinc/14/26/36/333142636.db2.gz	DAJQCKCGVQXIIW-AWEZNQCLSA-N	0	0	289.444	4.030	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](c2ccccc2C)C[C@@H]1C	ZINC000185623793	333145251	/nfs/dbraw/zinc/14/52/51/333145251.db2.gz	LKBDHVRSDFYKKM-ULQDDVLXSA-N	0	0	285.431	4.302	20	30		CIEDRN
CC#CCCCC(=O)N1CCC[C@H](C)[C@@H]1c1ccc(C)cc1	ZINC000185634287	333145328	/nfs/dbraw/zinc/14/53/28/333145328.db2.gz	ZKORDELMDWNZPU-FXAWDEMLSA-N	0	0	297.442	4.488	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](CC)c1ccc(F)cc1F	ZINC000185628109	333145414	/nfs/dbraw/zinc/14/54/14/333145414.db2.gz	DWXSSFKHBMCXFX-ABAIWWIYSA-N	0	0	281.346	4.134	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cc(C(F)(F)F)ccc1F	ZINC000185659408	333146158	/nfs/dbraw/zinc/14/61/58/333146158.db2.gz	KBKVNNZDMZLHKR-SECBINFHSA-N	0	0	289.272	4.385	20	30		CIEDRN
CC(C)COc1ccccc1N[C@@H]1CCC[C@H](C#N)C1	ZINC000185738297	333147716	/nfs/dbraw/zinc/14/77/16/333147716.db2.gz	BGRKMHNPBLOQAY-LSDHHAIUSA-N	0	0	272.392	4.216	20	30		CIEDRN
CC(C)(C)Oc1ccccc1N[C@@H]1CCC[C@@H](C#N)C1	ZINC000185748353	333147821	/nfs/dbraw/zinc/14/78/21/333147821.db2.gz	RJIDNZNOCOFCTN-ZIAGYGMSSA-N	0	0	272.392	4.358	20	30		CIEDRN
CC#CCCCC(=O)Nc1cccc(Cl)c1OC(C)C	ZINC000185835236	333149973	/nfs/dbraw/zinc/14/99/73/333149973.db2.gz	ORRPMEMMLNRZLZ-UHFFFAOYSA-N	0	0	293.794	4.259	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H]1[C@@H](C)CCC	ZINC000185889427	333151225	/nfs/dbraw/zinc/15/12/25/333151225.db2.gz	MCSYNDIOJFHOHZ-KKUMJFAQSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=CCC[C@H](NC(=O)CCCC#CC)c1ccccc1	ZINC000185907147	333151656	/nfs/dbraw/zinc/15/16/56/333151656.db2.gz	YNOFAUHGNJLECF-KRWDZBQOSA-N	0	0	269.388	4.004	20	30		CIEDRN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)C[C@H]1CCC[C@@H]1C	ZINC000185906637	333151692	/nfs/dbraw/zinc/15/16/92/333151692.db2.gz	UNINOYVSAYBZGE-MAUKXSAKSA-N	0	0	298.430	4.122	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cccnc1-c1ccccc1	ZINC000185944503	333152223	/nfs/dbraw/zinc/15/22/23/333152223.db2.gz	OYYRXQXDBVPVBD-AWEZNQCLSA-N	0	0	280.371	4.289	20	30		CIEDRN
C=C(C)[C@H](NC(=O)c1cccs1)c1ccc(F)c(F)c1	ZINC000186034533	333153677	/nfs/dbraw/zinc/15/36/77/333153677.db2.gz	IBSUIPNUWGYOAM-AWEZNQCLSA-N	0	0	293.338	4.074	20	30		CIEDRN
C=C(C)[C@H](NC(=O)c1ccccc1)c1ccc(F)c(F)c1	ZINC000186041301	333153897	/nfs/dbraw/zinc/15/38/97/333153897.db2.gz	LGTUUVGLAGVONV-INIZCTEOSA-N	0	0	287.309	4.012	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cc(C(C)(C)C)sc1C#N	ZINC000186094392	333154686	/nfs/dbraw/zinc/15/46/86/333154686.db2.gz	LJBSXTIXBUFLFX-LLVKDONJSA-N	0	0	290.432	4.458	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NC1(c2ccc(F)cc2F)CCC1	ZINC000186105478	333154972	/nfs/dbraw/zinc/15/49/72/333154972.db2.gz	JIOPIOYDOFSTKL-LBPRGKRZSA-N	0	0	293.357	4.063	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@@H](C)c1cccs1)c1ccccc1	ZINC000186197300	333156419	/nfs/dbraw/zinc/15/64/19/333156419.db2.gz	WNCTUVHVQSSIOV-DZGCQCFKSA-N	0	0	285.412	4.285	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1Cc2ccccc2C[C@@H]1CC	ZINC000186365053	333159648	/nfs/dbraw/zinc/15/96/48/333159648.db2.gz	RTVFRALVHFPLTM-SFHVURJKSA-N	0	0	283.415	4.118	20	30		CIEDRN
C=CCC[C@@H](C(=O)NC(C1CC1)C1CC1)c1ccccc1	ZINC000186382919	333159986	/nfs/dbraw/zinc/15/99/86/333159986.db2.gz	UHGRVFXRTQRPHL-QGZVFWFLSA-N	0	0	283.415	4.041	20	30		CIEDRN
C=CCC[C@H](C(=O)NCc1ccsc1)c1ccccc1	ZINC000186700372	333164572	/nfs/dbraw/zinc/16/45/72/333164572.db2.gz	CTMQLLQIZDSZFX-INIZCTEOSA-N	0	0	285.412	4.114	20	30		CIEDRN
N#Cc1ccc(NCc2cccc(OC(F)(F)F)c2)cc1	ZINC000220500131	333167056	/nfs/dbraw/zinc/16/70/56/333167056.db2.gz	VYGVYHWTHXDQBI-UHFFFAOYSA-N	0	0	292.260	4.069	20	30		CIEDRN
Cc1ccc([C@H](C)NCc2ccc(Cl)cc2C#N)cc1	ZINC000187411027	333170559	/nfs/dbraw/zinc/17/05/59/333170559.db2.gz	KGSXETUWLOWCSF-ZDUSSCGKSA-N	0	0	284.790	4.371	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1ccc(OC)cc1C)c1ccccc1	ZINC000187455373	333171077	/nfs/dbraw/zinc/17/10/77/333171077.db2.gz	JMERKEPUGYOQED-QGZVFWFLSA-N	0	0	295.382	4.302	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(C)c(-c2nc(C)co2)c1	ZINC000188821237	333174375	/nfs/dbraw/zinc/17/43/75/333174375.db2.gz	MQNAPGXKCKEZFC-SFHVURJKSA-N	0	0	298.386	4.499	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1cccc(C)c1F)c1ccccc1	ZINC000188976030	333177010	/nfs/dbraw/zinc/17/70/10/333177010.db2.gz	GQLGDMBYHAGDJV-HNNXBMFYSA-N	0	0	283.346	4.433	20	30		CIEDRN
Cc1csc2c1ncnc2N[C@H](C)c1ccc(C#N)cc1	ZINC000222281839	333179669	/nfs/dbraw/zinc/17/96/69/333179669.db2.gz	IAUKRWJTDTYNGL-LLVKDONJSA-N	0	0	294.383	4.045	20	30		CIEDRN
C=CCCCS[C@H](C)C(=O)N[C@H](C)c1ccccc1C	ZINC000564166518	333181695	/nfs/dbraw/zinc/18/16/95/333181695.db2.gz	UVXBGQPOTIDODA-HUUCEWRRSA-N	0	0	291.460	4.260	20	30		CIEDRN
Cc1ccccc1CN(Cc1cc(C#N)ccc1F)C1CC1	ZINC000521814938	333189316	/nfs/dbraw/zinc/18/93/16/333189316.db2.gz	UECHSFZWIRKCLF-UHFFFAOYSA-N	0	0	294.373	4.170	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1ccc(F)c(OC)c1)c1ccccc1	ZINC000189423286	333192489	/nfs/dbraw/zinc/19/24/89/333192489.db2.gz	PLCVECQECSPZFB-ZDUSSCGKSA-N	0	0	299.345	4.133	20	30		CIEDRN
C=CCCS[C@@H](C)C(=O)Nc1ccc(C)cc1Cl	ZINC000575845562	335122763	/nfs/dbraw/zinc/12/27/63/335122763.db2.gz	RTPKEBAUEQRDEY-NSHDSACASA-N	0	0	283.824	4.285	20	30		CIEDRN
CC(C)c1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C#N)cc1)CC2	ZINC000189611775	333196218	/nfs/dbraw/zinc/19/62/18/333196218.db2.gz	KOAIQQSWLSYFIH-HXUWFJFHSA-N	0	0	290.410	4.459	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)CC/C=C/c1ccccc1	ZINC000189921947	333200538	/nfs/dbraw/zinc/20/05/38/333200538.db2.gz	WHOMAAJFOLNONM-MDWZMJQESA-N	0	0	298.430	4.411	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)CCCC(C)(C)C	ZINC000189939719	333200750	/nfs/dbraw/zinc/20/07/50/333200750.db2.gz	ZCDFCQPBTCCPMP-UHFFFAOYSA-N	0	0	266.429	4.134	20	30		CIEDRN
CN(C(=O)c1ccc(C2CCC2)cc1)c1cccc(C#N)c1	ZINC000190123046	333203462	/nfs/dbraw/zinc/20/34/62/333203462.db2.gz	GIDUBFMTFQONAJ-UHFFFAOYSA-N	0	0	290.366	4.102	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(Cl)cc2F)CCC1	ZINC000190381430	333206279	/nfs/dbraw/zinc/20/62/79/333206279.db2.gz	HMQMJPXXKLFNGH-UHFFFAOYSA-N	0	0	267.731	4.164	20	30		CIEDRN
C=CCC1(C(=O)Nc2cc(Cl)ccc2C)CCC1	ZINC000190434302	333206850	/nfs/dbraw/zinc/20/68/50/333206850.db2.gz	ALZKGKGFYWXVIG-UHFFFAOYSA-N	0	0	263.768	4.333	20	30		CIEDRN
N#Cc1cccc(CNc2ccc(Cl)cc2F)c1F	ZINC000223726891	333211610	/nfs/dbraw/zinc/21/16/10/333211610.db2.gz	HUUQDCLLALCOSF-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C=CCC1(C(=O)N2CCC3(CCCCC3)CC2)CCC1	ZINC000191033271	333214034	/nfs/dbraw/zinc/21/40/34/333214034.db2.gz	DSVHISZJQXDJHD-UHFFFAOYSA-N	0	0	275.436	4.306	20	30		CIEDRN
C=CCC1(C(=O)NC[C@H](CC)c2ccccc2)CCC1	ZINC000191386256	333218970	/nfs/dbraw/zinc/21/89/70/333218970.db2.gz	FJQJSBJQXFBAQF-HNNXBMFYSA-N	0	0	271.404	4.043	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(-c3nccs3)cc2)CCC1	ZINC000191569273	333221608	/nfs/dbraw/zinc/22/16/08/333221608.db2.gz	XLVLBBPEMVNSLW-UHFFFAOYSA-N	0	0	298.411	4.495	20	30		CIEDRN
CC(C)(CCC#N)CNc1cc(F)ccc1OCC1CC1	ZINC000191806706	333225649	/nfs/dbraw/zinc/22/56/49/333225649.db2.gz	FXNHNRWZXXQSQB-UHFFFAOYSA-N	0	0	290.382	4.356	20	30		CIEDRN
N#Cc1cc(NC(=O)c2csc(Cl)c2)ccc1Cl	ZINC000191818058	333225909	/nfs/dbraw/zinc/22/59/09/333225909.db2.gz	FVAJMDXZCOWZRN-UHFFFAOYSA-N	0	0	297.166	4.179	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccccc2CCC)CCC1	ZINC000191869144	333226819	/nfs/dbraw/zinc/22/68/19/333226819.db2.gz	KYYSLDPRCSZSHZ-UHFFFAOYSA-N	0	0	257.377	4.324	20	30		CIEDRN
CC(C)(C#N)CCCN(Cc1c(F)cccc1F)C1CC1	ZINC000192298742	333234132	/nfs/dbraw/zinc/23/41/32/333234132.db2.gz	TVPORRAQHSPSDU-UHFFFAOYSA-N	0	0	292.373	4.259	20	30		CIEDRN
C=CCCCCCSCC(=O)Nc1ccccc1OC	ZINC000192549405	333236428	/nfs/dbraw/zinc/23/64/28/333236428.db2.gz	FHWHJMJWKZTBFW-UHFFFAOYSA-N	0	0	293.432	4.113	20	30		CIEDRN
N#Cc1cccc(CSCc2cc(-c3ccco3)on2)c1	ZINC000193082225	333242298	/nfs/dbraw/zinc/24/22/98/333242298.db2.gz	QSJDFXQBHYBTRB-UHFFFAOYSA-N	0	0	296.351	4.240	20	30		CIEDRN
N#Cc1ccc(NC(=O)c2coc3ccccc32)c(Cl)c1	ZINC000226346712	333257619	/nfs/dbraw/zinc/25/76/19/333257619.db2.gz	XTAKONNOEAMVCS-UHFFFAOYSA-N	0	0	296.713	4.210	20	30		CIEDRN
CCCOc1cc(C)ccc1NCc1ccccc1C#N	ZINC000226365666	333258117	/nfs/dbraw/zinc/25/81/17/333258117.db2.gz	YDHHTVZNPQSXIN-UHFFFAOYSA-N	0	0	280.371	4.268	20	30		CIEDRN
C=CCN(Cc1cccc(C#N)c1)Cc1cc(F)ccc1F	ZINC000195729218	333262248	/nfs/dbraw/zinc/26/22/48/333262248.db2.gz	MVSSQGGBIDMOQX-UHFFFAOYSA-N	0	0	298.336	4.025	20	30		CIEDRN
Cc1c(Cl)cccc1C(=O)N(CCC#N)CCC(C)C	ZINC000194568522	333272752	/nfs/dbraw/zinc/27/27/52/333272752.db2.gz	JQQRALKBWIFLSR-UHFFFAOYSA-N	0	0	292.810	4.050	20	30		CIEDRN
CC(=O)c1ccc(O[C@@H](C)c2ccc(C#N)cc2)cc1F	ZINC000194644147	333274396	/nfs/dbraw/zinc/27/43/96/333274396.db2.gz	CUTSFBBOZYKEDY-LBPRGKRZSA-N	0	0	283.302	4.040	20	30		CIEDRN
C[C@@H](CCC1CCCCC1)NC(=O)c1sccc1C#N	ZINC000522314542	333282299	/nfs/dbraw/zinc/28/22/99/333282299.db2.gz	ICBOLYMCIYHPEW-LBPRGKRZSA-N	0	0	290.432	4.099	20	30		CIEDRN
N#C[C@@H](Sc1ncnc2sccc21)C1CCCCC1	ZINC000522333101	333282931	/nfs/dbraw/zinc/28/29/31/333282931.db2.gz	DKPNTNJZXBPGPK-GFCCVEGCSA-N	0	0	289.429	4.256	20	30		CIEDRN
CS[C@H]1CCC[C@H](Nc2cc(Cl)ccc2C#N)C1	ZINC000227652664	333287254	/nfs/dbraw/zinc/28/72/54/333287254.db2.gz	PEMHAJWELLSTPP-STQMWFEESA-N	0	0	280.824	4.298	20	30		CIEDRN
C=CCCC(=O)NCC1(c2cccc(F)c2)CCCCC1	ZINC000522539079	333289226	/nfs/dbraw/zinc/28/92/26/333289226.db2.gz	YTVQIJBULSDHLV-UHFFFAOYSA-N	0	0	289.394	4.110	20	30		CIEDRN
CC(C)(C)[C@H]1CCCN(c2ccc(Cl)c(C#N)n2)CC1	ZINC000522568046	333290422	/nfs/dbraw/zinc/29/04/22/333290422.db2.gz	INWGJOCBECNWIG-LBPRGKRZSA-N	0	0	291.826	4.259	20	30		CIEDRN
C=CCCC(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2	ZINC000522598674	333292121	/nfs/dbraw/zinc/29/21/21/333292121.db2.gz	RKDIOISXCYYRDJ-UHFFFAOYSA-N	0	0	287.359	4.023	20	30		CIEDRN
C=CC[C@@H](C)Nc1cc(C)c(C#N)c2nc3ccccc3n21	ZINC000522631490	333293643	/nfs/dbraw/zinc/29/36/43/333293643.db2.gz	AIEMCCSZMRMPDO-CYBMUJFWSA-N	0	0	290.370	4.044	20	30		CIEDRN
C=CCCCN(C)C(=O)CCCCCc1cccs1	ZINC000522945829	333300691	/nfs/dbraw/zinc/30/06/91/333300691.db2.gz	ZBUWLRRMFFIHLW-UHFFFAOYSA-N	0	0	279.449	4.276	20	30		CIEDRN
C=CCCCN(C)C(=O)c1ccc2[nH]c3c(c2c1)CCCC3	ZINC000522954131	333300976	/nfs/dbraw/zinc/30/09/76/333300976.db2.gz	DIEWSHFKZXMJPN-UHFFFAOYSA-N	0	0	296.414	4.085	20	30		CIEDRN
CSC(C)(C)CNc1ccc(C#N)c(C(F)(F)F)c1	ZINC000229404237	333304508	/nfs/dbraw/zinc/30/45/08/333304508.db2.gz	OIKQCSLJMMSZCJ-UHFFFAOYSA-N	0	0	288.338	4.131	20	30		CIEDRN
C=CCCC[N@@H+](C)Cc1ncc(-c2ccc(Cl)cc2)o1	ZINC000523010592	333304529	/nfs/dbraw/zinc/30/45/29/333304529.db2.gz	LWGJDVYZSGDHFA-UHFFFAOYSA-N	0	0	290.794	4.393	20	30		CIEDRN
C=C(C)CN(CC)C(=O)C[C@H](C)c1ccc(CC)cc1	ZINC000523087043	333307285	/nfs/dbraw/zinc/30/72/85/333307285.db2.gz	JXFQCZNFFTYSMY-HNNXBMFYSA-N	0	0	273.420	4.167	20	30		CIEDRN
C=CC1CCN(C(=O)C[C@H](CC)c2ccc(C)cc2)CC1	ZINC000523086729	333307343	/nfs/dbraw/zinc/30/73/43/333307343.db2.gz	TZHIEGDWTHRHCL-KRWDZBQOSA-N	0	0	285.431	4.303	20	30		CIEDRN
N#Cc1cc(CNc2cccc(C(F)(F)F)c2)ccc1F	ZINC000229721192	333308572	/nfs/dbraw/zinc/30/85/72/333308572.db2.gz	MQNOOLPWTSISDG-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
Cc1ccc(Cl)cc1NCc1ccc(F)c(C#N)c1	ZINC000229721379	333308586	/nfs/dbraw/zinc/30/85/86/333308586.db2.gz	DERBFOUDJOLPRO-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
Cc1ccccc1SCc1ccc(F)c(C#N)c1	ZINC000229754085	333309472	/nfs/dbraw/zinc/30/94/72/333309472.db2.gz	QQCOUEAEOVPATL-UHFFFAOYSA-N	0	0	257.333	4.298	20	30		CIEDRN
C=CCCC(=O)Nc1ccc2oc3ccccc3c2c1	ZINC000523226480	333313168	/nfs/dbraw/zinc/31/31/68/333313168.db2.gz	KIVLLUFOCJLLDD-UHFFFAOYSA-N	0	0	265.312	4.491	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(Oc2cccc(OC)c2)cc1	ZINC000523273517	333313573	/nfs/dbraw/zinc/31/35/73/333313573.db2.gz	NFWHSQCPEXJRIQ-UHFFFAOYSA-N	0	0	297.354	4.392	20	30		CIEDRN
CS[C@H]1CCC[C@@H](Nc2c(C#N)cnc3ccccc32)C1	ZINC000230906979	333322467	/nfs/dbraw/zinc/32/24/67/333322467.db2.gz	JCOIBCATFMSFRB-KGLIPLIRSA-N	0	0	297.427	4.193	20	30		CIEDRN
CCCCSCCC(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000523509903	333331277	/nfs/dbraw/zinc/33/12/77/333331277.db2.gz	BAHRLTCHCDDKKL-UHFFFAOYSA-N	0	0	296.823	4.074	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1cn(CC)c2ccccc12	ZINC000523545364	333332640	/nfs/dbraw/zinc/33/26/40/333332640.db2.gz	YLMQLLNUHYRRHU-UHFFFAOYSA-N	0	0	298.430	4.480	20	30		CIEDRN
C[C@H](C#N)N[C@@H](CC1CCCCC1)c1ccccc1	ZINC000523624669	333334390	/nfs/dbraw/zinc/33/43/90/333334390.db2.gz	VWDPBXSIDFOGJO-PBHICJAKSA-N	0	0	256.393	4.200	20	30		CIEDRN
CC(C)(C#N)CCCCOc1cccc(Cl)c1	ZINC000232521461	333337948	/nfs/dbraw/zinc/33/79/48/333337948.db2.gz	FATPPIVOHKGGNT-UHFFFAOYSA-N	0	0	251.757	4.439	20	30		CIEDRN
CC(=O)c1ccc(F)cc1OCCCCC(C)(C)C#N	ZINC000232555320	333338666	/nfs/dbraw/zinc/33/86/66/333338666.db2.gz	NHEVNVACHLTSBK-UHFFFAOYSA-N	0	0	277.339	4.127	20	30		CIEDRN
N#C[C@H](Nc1cccc2c1CCCC2)C1CCCCC1	ZINC000523738352	333343023	/nfs/dbraw/zinc/34/30/23/333343023.db2.gz	PWHOJEPJGZVCNT-SFHVURJKSA-N	0	0	268.404	4.450	20	30		CIEDRN
C[C@@H](Sc1nc2ccccc2n1C)c1ccc(C#N)cc1	ZINC000303702450	333345502	/nfs/dbraw/zinc/34/55/02/333345502.db2.gz	OFHRLEVFCBZZDD-GFCCVEGCSA-N	0	0	293.395	4.298	20	30		CIEDRN
C=CCCSc1ncnc2sc3c(c21)CCCC3	ZINC000303775591	333346346	/nfs/dbraw/zinc/34/63/46/333346346.db2.gz	HUUCSMHNUSJHBU-UHFFFAOYSA-N	0	0	276.430	4.238	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)[C@H](C)c1cccs1	ZINC000303911738	333348094	/nfs/dbraw/zinc/34/80/94/333348094.db2.gz	UNKDVBSKOKYOBL-CQSZACIVSA-N	0	0	291.460	4.447	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N(CCC)[C@H]1CCc2ccccc21	ZINC000523948913	333349897	/nfs/dbraw/zinc/34/98/97/333349897.db2.gz	CJBIODUOGJKFSB-YOEHRIQHSA-N	0	0	286.419	4.060	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N(CCC)[C@@H]1CCc2ccccc21	ZINC000523948911	333349961	/nfs/dbraw/zinc/34/99/61/333349961.db2.gz	CJBIODUOGJKFSB-RHSMWYFYSA-N	0	0	286.419	4.060	20	30		CIEDRN
C=CCCC(=O)Nc1nc(-c2ccc(C)cc2C)cs1	ZINC000523956304	333350190	/nfs/dbraw/zinc/35/01/90/333350190.db2.gz	KFLCVOXUPXAYPM-UHFFFAOYSA-N	0	0	286.400	4.332	20	30		CIEDRN
C=CC[C@H](C)NC(=O)c1ccccc1N(C)c1ccccc1	ZINC000523960833	333350213	/nfs/dbraw/zinc/35/02/13/333350213.db2.gz	JUEUSKGPXSJVQO-HNNXBMFYSA-N	0	0	294.398	4.149	20	30		CIEDRN
C=CC[C@H](C)NC(=O)c1cccc(Oc2ccccc2)c1	ZINC000523968415	333350279	/nfs/dbraw/zinc/35/02/79/333350279.db2.gz	SFGLBAQRHPTDRL-AWEZNQCLSA-N	0	0	281.355	4.173	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@@H](c1ccccc1)C(C)(C)C	ZINC000523986502	333350738	/nfs/dbraw/zinc/35/07/38/333350738.db2.gz	FHCPDRXFUIZCBZ-ZFWWWQNUSA-N	0	0	274.408	4.038	20	30		CIEDRN
CSCc1cccc(Nc2ncc(C#N)cc2Cl)c1	ZINC000524461849	333362718	/nfs/dbraw/zinc/36/27/18/333362718.db2.gz	NCPVVIDRHNFMMJ-UHFFFAOYSA-N	0	0	289.791	4.213	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)[C@@H](C)C(C)(C)C	ZINC000524538645	333365611	/nfs/dbraw/zinc/36/56/11/333365611.db2.gz	BVWDNHRMMZFELY-CQSZACIVSA-N	0	0	265.441	4.264	20	30		CIEDRN
C=CCNC(=O)Nc1cccc(CSC2CCCC2)c1	ZINC000524629042	333369349	/nfs/dbraw/zinc/36/93/49/333369349.db2.gz	LOOSMPWNUGLMJP-UHFFFAOYSA-N	0	0	290.432	4.170	20	30		CIEDRN
C[C@H](CCc1ccccc1)Nc1nccc(C#N)c1Cl	ZINC000235434592	333369559	/nfs/dbraw/zinc/36/95/59/333369559.db2.gz	OTISYJWEJGAQLZ-GFCCVEGCSA-N	0	0	285.778	4.040	20	30		CIEDRN
C=C1CCN(CCOc2c(Cl)cccc2Cl)CC1	ZINC000524676210	333370990	/nfs/dbraw/zinc/37/09/90/333370990.db2.gz	LNKBALRVUNMAQG-UHFFFAOYSA-N	0	0	286.202	4.024	20	30		CIEDRN
N#Cc1cc(F)ccc1N1CCC(c2ccccc2F)CC1	ZINC000524688537	333371349	/nfs/dbraw/zinc/37/13/49/333371349.db2.gz	YJJWGCCSWAXUFO-UHFFFAOYSA-N	0	0	298.336	4.220	20	30		CIEDRN
C=CCOc1cccc(NC(=O)Nc2ccc(C)cc2)c1	ZINC000524697560	333371621	/nfs/dbraw/zinc/37/16/21/333371621.db2.gz	JYBWXEDDGNNEMI-UHFFFAOYSA-N	0	0	282.343	4.204	20	30		CIEDRN
Cc1cc(C)cc(C[S@@](=O)CCCCC(C)(C)C#N)c1	ZINC000235736595	333371841	/nfs/dbraw/zinc/37/18/41/333371841.db2.gz	CHJUFASDGYECTL-FQEVSTJZSA-N	0	0	291.460	4.272	20	30		CIEDRN
Cc1ccc(C)c([S@](=O)CCCCC(C)(C)C#N)c1	ZINC000235773892	333371984	/nfs/dbraw/zinc/37/19/84/333371984.db2.gz	ODIDTQIPRZTPHY-LJQANCHMSA-N	0	0	277.433	4.131	20	30		CIEDRN
C=CCCCCCn1nc(C)c(Br)c1C	ZINC000235828003	333372443	/nfs/dbraw/zinc/37/24/43/333372443.db2.gz	YRZKEDBQBTZEBL-UHFFFAOYSA-N	0	0	271.202	4.009	20	30		CIEDRN
COc1ccc(-c2nc3cc(C)ccc3s2)cc1C#N	ZINC000524728723	333373297	/nfs/dbraw/zinc/37/32/97/333373297.db2.gz	NNZPSIYZYXTMBG-UHFFFAOYSA-N	0	0	280.352	4.152	20	30		CIEDRN
C=CCOc1ccc(CNc2cccc3ncccc32)cc1	ZINC000236684846	333374704	/nfs/dbraw/zinc/37/47/04/333374704.db2.gz	UEGYZEOPMKRIOP-UHFFFAOYSA-N	0	0	290.366	4.412	20	30		CIEDRN
Cc1ccc([C@H](C)Nc2ccc([N+](=O)[O-])cc2C#N)c(C)c1	ZINC000315887416	333384406	/nfs/dbraw/zinc/38/44/06/333384406.db2.gz	PEJPOSMIZIVDBO-ZDUSSCGKSA-N	0	0	295.342	4.256	20	30		CIEDRN
CC(C)C[C@@H]1CCCCCN1C(=O)Nc1ccc(C#N)cc1	ZINC000524886237	333391782	/nfs/dbraw/zinc/39/17/82/333391782.db2.gz	JMOXNHAMEVJZQG-KRWDZBQOSA-N	0	0	299.418	4.381	20	30		CIEDRN
C=CCN(C(=O)Cc1ccc(CC)cc1)c1ccccc1	ZINC000525017372	333395769	/nfs/dbraw/zinc/39/57/69/333395769.db2.gz	SCWRPOSGKLPOOK-UHFFFAOYSA-N	0	0	279.383	4.011	20	30		CIEDRN
C[C@H]1CCCC[C@@H]1OCCSc1ccc(C#N)cc1F	ZINC000525115865	333398726	/nfs/dbraw/zinc/39/87/26/333398726.db2.gz	DKKFCFWENLOKDS-WFASDCNBSA-N	0	0	293.407	4.385	20	30		CIEDRN
N#Cc1ccc(S[C@@H](C#N)C2CCCCC2)c(F)c1	ZINC000525116813	333398995	/nfs/dbraw/zinc/39/89/95/333398995.db2.gz	PLKYJBIZVFHOEW-HNNXBMFYSA-N	0	0	274.364	4.262	20	30		CIEDRN
C=CCn1c2ccccc2nc1SCc1ncc(CC)o1	ZINC000525190609	333402917	/nfs/dbraw/zinc/40/29/17/333402917.db2.gz	IHQJCHNRONACLE-UHFFFAOYSA-N	0	0	299.399	4.065	20	30		CIEDRN
CC(C)(C)c1ccc(C(=O)Nc2ccc(F)cc2C#N)cc1	ZINC000316974635	333407795	/nfs/dbraw/zinc/40/77/95/333407795.db2.gz	BQXSGLWPTBORIT-UHFFFAOYSA-N	0	0	296.345	4.247	20	30		CIEDRN
CC(C)(C)CCCNC(=O)C[C@H](CC#N)c1ccccc1	ZINC000526005635	333418657	/nfs/dbraw/zinc/41/86/57/333418657.db2.gz	AIJOAZCZHPOULT-INIZCTEOSA-N	0	0	286.419	4.016	20	30		CIEDRN
C=CCN(C(=O)N[C@H](CC(C)C)c1cccs1)C1CC1	ZINC000537910952	333429313	/nfs/dbraw/zinc/42/93/13/333429313.db2.gz	KDXBCFDIAXEQPN-CQSZACIVSA-N	0	0	292.448	4.195	20	30		CIEDRN
N#Cc1ccc(NCCc2cc(F)cc(F)c2)cc1Cl	ZINC000061846644	333449734	/nfs/dbraw/zinc/44/97/34/333449734.db2.gz	VQHQMMKGHGTYQY-UHFFFAOYSA-N	0	0	292.716	4.144	20	30		CIEDRN
Cc1ccccc1C1CC(Nc2ccc(CC#N)cc2)C1	ZINC000037071517	333472145	/nfs/dbraw/zinc/47/21/45/333472145.db2.gz	BFNJFYYVRBUEAY-UHFFFAOYSA-N	0	0	276.383	4.419	20	30		CIEDRN
C[C@H](Nc1ccc(CC#N)cc1)c1c(F)cccc1F	ZINC000037071317	333472256	/nfs/dbraw/zinc/47/22/56/333472256.db2.gz	NGMVZXZMVIBDIJ-NSHDSACASA-N	0	0	272.298	4.204	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)[C@H]1[C@H](C2CC2)[C@@H]1C	ZINC000529270052	333480646	/nfs/dbraw/zinc/48/06/46/333480646.db2.gz	DNKQNRYXFMTKBH-AFAVFJNCSA-N	0	0	269.388	4.036	20	30		CIEDRN
CCC(C#N)(CC)C(=O)NC[C@@H]1CCC[C@H]1c1ccccc1	ZINC000529440689	333487176	/nfs/dbraw/zinc/48/71/76/333487176.db2.gz	DOXJJCJKYDXVDO-IRXDYDNUSA-N	0	0	298.430	4.016	20	30		CIEDRN
COc1ccc(Cl)cc1N[C@H](C)c1cccc(C#N)c1	ZINC000037200739	333512925	/nfs/dbraw/zinc/51/29/25/333512925.db2.gz	CMLZYOBXZRKROO-LLVKDONJSA-N	0	0	286.762	4.393	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cccc(C2CCOCC2)c1	ZINC000529936713	333515166	/nfs/dbraw/zinc/51/51/66/333515166.db2.gz	UWDNLEPMCZCAPZ-CQSZACIVSA-N	0	0	287.403	4.121	20	30		CIEDRN
CC(C)(C#N)c1ccc(-c2cnc(C3CC3)o2)cc1	ZINC000530251317	333530222	/nfs/dbraw/zinc/53/02/22/333530222.db2.gz	QSMRLPXSSZEMQO-UHFFFAOYSA-N	0	0	252.317	4.020	20	30		CIEDRN
Cc1cc(C)c(CNc2ccc(CC#N)cc2)cc1C	ZINC000037301941	333531530	/nfs/dbraw/zinc/53/15/30/333531530.db2.gz	OTPLGPQECNBZHO-UHFFFAOYSA-N	0	0	264.372	4.290	20	30		CIEDRN
N#Cc1cccc(CSc2ccc(F)cc2F)c1	ZINC000037374880	333532556	/nfs/dbraw/zinc/53/25/56/333532556.db2.gz	PICZMSIARASJFW-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
COc1cc(C(C)=O)ccc1SCc1ccc(C#N)cc1	ZINC000123454260	333533160	/nfs/dbraw/zinc/53/31/60/333533160.db2.gz	IFJCXKAJLKUEOZ-UHFFFAOYSA-N	0	0	297.379	4.062	20	30		CIEDRN
N#Cc1cnc2ccccc2c1NC1CCCCCC1	ZINC000037507647	333534270	/nfs/dbraw/zinc/53/42/70/333534270.db2.gz	QFZLIUSOZUVIPS-UHFFFAOYSA-N	0	0	265.360	4.241	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)Nc1cscc1C	ZINC000123586531	333548754	/nfs/dbraw/zinc/54/87/54/333548754.db2.gz	HREDNSXJQOANAK-UHFFFAOYSA-N	0	0	292.429	4.338	20	30		CIEDRN
Cc1cc(Cl)ccc1C(=O)N[C@H](C)c1ccc(C#N)cc1	ZINC000124401764	333558659	/nfs/dbraw/zinc/55/86/59/333558659.db2.gz	VYAJKKSGRKEBRP-GFCCVEGCSA-N	0	0	298.773	4.011	20	30		CIEDRN
C=CCN(CC=C)C(=O)c1cc2c(ccc3ccccc23)[nH]1	ZINC000125034590	333563016	/nfs/dbraw/zinc/56/30/16/333563016.db2.gz	IEURMWXDNNFTGV-UHFFFAOYSA-N	0	0	290.366	4.135	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N(CC)Cc1ccccc1C	ZINC000538287294	333583097	/nfs/dbraw/zinc/58/30/97/333583097.db2.gz	XNOMBNJQSDPFFG-INIZCTEOSA-N	0	0	288.435	4.271	20	30		CIEDRN
C=CCCOCCCCC(=O)N1CCCC[C@H]1[C@@H](C)CC	ZINC000538302667	333583735	/nfs/dbraw/zinc/58/37/35/333583735.db2.gz	YWRXFNXJWYWTHB-IRXDYDNUSA-N	0	0	295.467	4.177	20	30		CIEDRN
C=CCCOCCCCC(=O)N1CCCC[C@@H]1[C@H](C)CC	ZINC000538302666	333584126	/nfs/dbraw/zinc/58/41/26/333584126.db2.gz	YWRXFNXJWYWTHB-IAGOWNOFSA-N	0	0	295.467	4.177	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)C1(c2cccc(Cl)c2)CC1	ZINC000538331526	333585559	/nfs/dbraw/zinc/58/55/59/333585559.db2.gz	IMEZUDVKCLAXII-CYBMUJFWSA-N	0	0	291.822	4.233	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1cc(C)ccc1C	ZINC000538338871	333586092	/nfs/dbraw/zinc/58/60/92/333586092.db2.gz	HCWCDIRJJOQDAA-CQSZACIVSA-N	0	0	260.381	4.170	20	30		CIEDRN
Cc1c2ccccc2oc1[C@H](NCC1(C#N)CC1)C(C)C	ZINC000538388875	333587574	/nfs/dbraw/zinc/58/75/74/333587574.db2.gz	IJHGRIMULQMNON-MRXNPFEDSA-N	0	0	282.387	4.332	20	30		CIEDRN
C[C@@H]1c2cc(Cl)c(Cl)cc2CCN1CC1(C#N)CC1	ZINC000538392105	333588112	/nfs/dbraw/zinc/58/81/12/333588112.db2.gz	KITGLHYTSSWHAE-SNVBAGLBSA-N	0	0	295.213	4.216	20	30		CIEDRN
N#CC1(CS[C@@H]2CCc3c2cccc3Cl)CC1	ZINC000538418557	333591156	/nfs/dbraw/zinc/59/11/56/333591156.db2.gz	LHQZRYTWDKYXMI-CYBMUJFWSA-N	0	0	263.793	4.364	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)C[C@H](C)c1ccccc1	ZINC000126242846	333595170	/nfs/dbraw/zinc/59/51/70/333595170.db2.gz	IGLFDFGWRWUVCK-HNNXBMFYSA-N	0	0	286.419	4.159	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@@H]1CCC[C@H]1CC)c1ccccc1	ZINC000126518904	333599033	/nfs/dbraw/zinc/59/90/33/333599033.db2.gz	IXAVGZUCQCTWRF-BFYDXBDKSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CCC[C@H](Nc1ccc(COCC)cc1)C1CC1	ZINC000538554358	333606202	/nfs/dbraw/zinc/60/62/02/333606202.db2.gz	RUMVLBVHNAYJAI-KRWDZBQOSA-N	0	0	259.393	4.380	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1ccc(OC)cc1C)c1ccccc1	ZINC000126993992	333614881	/nfs/dbraw/zinc/61/48/81/333614881.db2.gz	SMBQCSUVEMCIGR-HNNXBMFYSA-N	0	0	295.382	4.302	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C1CC1)[C@H]1CCc2ccccc21	ZINC000127306003	333626033	/nfs/dbraw/zinc/62/60/33/333626033.db2.gz	COURXLJYUWOVGZ-IBGZPJMESA-N	0	0	295.426	4.433	20	30		CIEDRN
C=CCCCC(=O)N1[C@H](C)c2ccc(F)cc2C[C@@H]1C	ZINC000538798724	333631527	/nfs/dbraw/zinc/63/15/27/333631527.db2.gz	VLUNELDABMUJJI-QWHCGFSZSA-N	0	0	275.367	4.016	20	30		CIEDRN
CCC(CC)(CC)CNC(=O)Nc1ccc(CC#N)cc1	ZINC000127868788	333637031	/nfs/dbraw/zinc/63/70/31/333637031.db2.gz	FKCQKDXQXZNSGX-UHFFFAOYSA-N	0	0	287.407	4.091	20	30		CIEDRN
C=CCN(C(=O)c1ccc(-c2ccccc2)cc1)C1CC1	ZINC000539033544	333649697	/nfs/dbraw/zinc/64/96/97/333649697.db2.gz	FKFLVXATAJIDTE-UHFFFAOYSA-N	0	0	277.367	4.144	20	30		CIEDRN
C=C(CC)CS[C@H](C)C(=O)Nc1ccccc1Cl	ZINC000539094254	333657487	/nfs/dbraw/zinc/65/74/87/333657487.db2.gz	SNYHSMMKWFPYBY-LLVKDONJSA-N	0	0	283.824	4.366	20	30		CIEDRN
C=C(CC)CSc1nnc(-c2ccc(C)cc2)o1	ZINC000539111881	333659059	/nfs/dbraw/zinc/65/90/59/333659059.db2.gz	OVSVLZWOCIUZPN-UHFFFAOYSA-N	0	0	260.362	4.103	20	30		CIEDRN
C=C[C@@H](C)NC(=O)N(C)Cc1ccccc1-c1ccccc1	ZINC000128368690	333663563	/nfs/dbraw/zinc/66/35/63/333663563.db2.gz	AQUQKTPRPNWUOX-OAHLLOKOSA-N	0	0	294.398	4.070	20	30		CIEDRN
Cc1cc(C)c(NC(=O)c2ccc(Cl)c(C#N)c2)c(C)c1	ZINC000539368983	333667665	/nfs/dbraw/zinc/66/76/65/333667665.db2.gz	XGIDMCZSRRDXSE-UHFFFAOYSA-N	0	0	298.773	4.389	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N1C[C@H](C)[C@H]1c1ccccc1	ZINC000539391089	333668797	/nfs/dbraw/zinc/66/87/97/333668797.db2.gz	YUODNGISHCQTJB-ZOBUZTSGSA-N	0	0	286.419	4.134	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)C(C)(C)C1CCCC1	ZINC000539428948	333671076	/nfs/dbraw/zinc/67/10/76/333671076.db2.gz	BYXJWZWPWWGESN-ZDUSSCGKSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1cc2cc(C)ccc2o1	ZINC000539428567	333671104	/nfs/dbraw/zinc/67/11/04/333671104.db2.gz	ARIAFFMRPIFFLH-CYBMUJFWSA-N	0	0	271.360	4.216	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1cc(OC)ccc1Cl	ZINC000539449604	333672008	/nfs/dbraw/zinc/67/20/08/333672008.db2.gz	SCADOXUGBLUGAA-NSHDSACASA-N	0	0	296.798	4.215	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)[C@@H]1CC[C@@H](C)C1	ZINC000539548714	333678031	/nfs/dbraw/zinc/67/80/31/333678031.db2.gz	RXVUMDMEYAMKBY-VXGBXAGGSA-N	0	0	297.851	4.352	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1ccccc1OCC)c1ccccc1	ZINC000128512144	333679971	/nfs/dbraw/zinc/67/99/71/333679971.db2.gz	VLIZZZMCTKZUMU-OAHLLOKOSA-N	0	0	295.382	4.384	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)NCc1ccc(-c2ccccc2)o1	ZINC000539739008	333688514	/nfs/dbraw/zinc/68/85/14/333688514.db2.gz	OSCVUHPNLYUPQI-HNNXBMFYSA-N	0	0	298.386	4.101	20	30		CIEDRN
CCC[C@@H](C#N)NC(=O)[C@@H](CC1CCCCC1)C(C)C	ZINC000539929288	333703329	/nfs/dbraw/zinc/70/33/29/333703329.db2.gz	UHCUIVUYWRNSBU-HOTGVXAUSA-N	0	0	278.440	4.037	20	30		CIEDRN
CCC[C@H](C#N)NC(=O)C1(c2cccc(C)c2)CCCCC1	ZINC000539927699	333703332	/nfs/dbraw/zinc/70/33/32/333703332.db2.gz	RGEUAXFIPWFFPM-QGZVFWFLSA-N	0	0	298.430	4.005	20	30		CIEDRN
C=CCN(C(=O)Nc1cc(Cl)c(C)cc1Cl)C1CC1	ZINC000540080312	333708731	/nfs/dbraw/zinc/70/87/31/333708731.db2.gz	RXQJHNHASKNZNU-UHFFFAOYSA-N	0	0	299.201	4.484	20	30		CIEDRN
C=CCN(C(=O)c1oc2ccc(Cl)cc2c1C)C1CC1	ZINC000540133015	333711110	/nfs/dbraw/zinc/71/11/10/333711110.db2.gz	OMFOJBRPWFJSLT-UHFFFAOYSA-N	0	0	289.762	4.185	20	30		CIEDRN
C=C(CC)CS[C@@H](C)c1nc(-c2ccccc2)no1	ZINC000540193823	333720310	/nfs/dbraw/zinc/72/03/10/333720310.db2.gz	RKSOFUXBHSIARD-LBPRGKRZSA-N	0	0	274.389	4.497	20	30		CIEDRN
CC1CCC(N(C)c2cc(C#N)c3ccccc3n2)CC1	ZINC000068772449	333728664	/nfs/dbraw/zinc/72/86/64/333728664.db2.gz	SLYDAIKLBRJXAO-UHFFFAOYSA-N	0	0	279.387	4.121	20	30		CIEDRN
CCC[C@@H](CC)Nc1cc(C#N)c2ccccc2n1	ZINC000068770430	333728743	/nfs/dbraw/zinc/72/87/43/333728743.db2.gz	FDZHOQGLOMANNG-CYBMUJFWSA-N	0	0	253.349	4.097	20	30		CIEDRN
CCC1(C)CCN(c2cc(C#N)c3ccccc3n2)CC1	ZINC000068796394	333730299	/nfs/dbraw/zinc/73/02/99/333730299.db2.gz	GRSNDYHYGBOMEE-UHFFFAOYSA-N	0	0	279.387	4.123	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N(Cc1ccccc1)C1CC1	ZINC000540564984	333735296	/nfs/dbraw/zinc/73/52/96/333735296.db2.gz	UKYULBFTVGITDR-HNNXBMFYSA-N	0	0	286.419	4.105	20	30		CIEDRN
C[C@@H](SCC1(C#N)CC1)c1cccc(Cl)c1	ZINC000540615495	333735855	/nfs/dbraw/zinc/73/58/55/333735855.db2.gz	MYTXCPSFUAWFIU-SNVBAGLBSA-N	0	0	251.782	4.438	20	30		CIEDRN
N#CC1(CN[C@@H](Cc2ccccc2)c2ccccc2F)CC1	ZINC000540590537	333735974	/nfs/dbraw/zinc/73/59/74/333735974.db2.gz	JTGUALLIFLJDRA-SFHVURJKSA-N	0	0	294.373	4.003	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)C[C@H](C)c1ccccc1C	ZINC000540620706	333738782	/nfs/dbraw/zinc/73/87/82/333738782.db2.gz	OEJPXACIIOTMLL-JKSUJKDBSA-N	0	0	273.420	4.350	20	30		CIEDRN
CC(C)C[C@H]1C[C@H](Nc2cc(Cl)ccc2C#N)CCO1	ZINC000540709110	333743037	/nfs/dbraw/zinc/74/30/37/333743037.db2.gz	KSHBMWXWGUXZQD-CABCVRRESA-N	0	0	292.810	4.217	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N[C@H](c1ccc(C)cc1)C1CC1	ZINC000540766320	333746447	/nfs/dbraw/zinc/74/64/47/333746447.db2.gz	ABEARMMZNAYLSK-IAGOWNOFSA-N	0	0	286.419	4.100	20	30		CIEDRN
CCC(CC)CN(CC)C(=O)c1ccc(Cl)c(C#N)c1	ZINC000540883983	333751379	/nfs/dbraw/zinc/75/13/79/333751379.db2.gz	JXOGFQZOSHDQKB-UHFFFAOYSA-N	0	0	292.810	4.110	20	30		CIEDRN
COc1ccc(C#N)cc1CSc1nc2ccccc2o1	ZINC000129263615	333754314	/nfs/dbraw/zinc/75/43/14/333754314.db2.gz	NYTBGONIFOSMIN-UHFFFAOYSA-N	0	0	296.351	4.000	20	30		CIEDRN
C=C(C)CS[C@H](C)c1nc(-c2ccc(OC)cc2)no1	ZINC000129357347	333756749	/nfs/dbraw/zinc/75/67/49/333756749.db2.gz	XWDYRFXVIDBLRG-LLVKDONJSA-N	0	0	290.388	4.116	20	30		CIEDRN
C=CCCC(=O)Nc1ncc(C2CCCCC2)s1	ZINC000541073160	333761552	/nfs/dbraw/zinc/76/15/52/333761552.db2.gz	ZQNFKFJFZMCGDK-UHFFFAOYSA-N	0	0	264.394	4.096	20	30		CIEDRN
N#Cc1cc(NCc2ccc3ncccc3c2)ccc1Cl	ZINC000069501329	333767528	/nfs/dbraw/zinc/76/75/28/333767528.db2.gz	OOBVOUQRANHPQU-UHFFFAOYSA-N	0	0	293.757	4.372	20	30		CIEDRN
COc1ccc(C#N)cc1NC1CC(c2cccc(F)c2)C1	ZINC000541257288	333767818	/nfs/dbraw/zinc/76/78/18/333767818.db2.gz	HRSXGAYTXVAJMA-UHFFFAOYSA-N	0	0	296.345	4.064	20	30		CIEDRN
COc1ccc(C#N)cc1NC1CC(c2ccccc2F)C1	ZINC000541255117	333767901	/nfs/dbraw/zinc/76/79/01/333767901.db2.gz	FNPVJCBLOIBYAK-UHFFFAOYSA-N	0	0	296.345	4.064	20	30		CIEDRN
N#Cc1ccc(-c2nc3c(cccc3F)n2C2CC2)cc1	ZINC000069836282	333793719	/nfs/dbraw/zinc/79/37/19/333793719.db2.gz	YAGNYONMOOMPPW-UHFFFAOYSA-N	0	0	277.302	4.049	20	30		CIEDRN
C[C@@H](NCc1cc2ccccc2o1)c1ccc(C#N)cc1F	ZINC000541904858	333798075	/nfs/dbraw/zinc/79/80/75/333798075.db2.gz	AQSDDHTUKVZGGU-GFCCVEGCSA-N	0	0	294.329	4.294	20	30		CIEDRN
N#Cc1ccc(F)c(CSc2ccc(Cl)cn2)c1	ZINC000070211224	333801726	/nfs/dbraw/zinc/80/17/26/333801726.db2.gz	JNZAAMMZXMFYJK-UHFFFAOYSA-N	0	0	278.739	4.038	20	30		CIEDRN
C=C1CCN(c2cnc3cc(Cl)c(Cl)cc3n2)CC1	ZINC000542045106	333808463	/nfs/dbraw/zinc/80/84/63/333808463.db2.gz	OWSUQRKVDRYNLM-UHFFFAOYSA-N	0	0	294.185	4.093	20	30		CIEDRN
N#Cc1ccc(-c2ccc(OCCOCC3CC3)cc2)cc1	ZINC000542054007	333808870	/nfs/dbraw/zinc/80/88/70/333808870.db2.gz	CPOANSKARRYGKS-UHFFFAOYSA-N	0	0	293.366	4.031	20	30		CIEDRN
CSc1cccc(NCc2cccc(C#N)c2F)c1C	ZINC000542224546	333817246	/nfs/dbraw/zinc/81/72/46/333817246.db2.gz	NCUGZQKDRKUREQ-UHFFFAOYSA-N	0	0	286.375	4.340	20	30		CIEDRN
CC(C)c1cccc(-c2ccc(C(=O)NCCCC#N)o2)c1	ZINC000542227264	333817374	/nfs/dbraw/zinc/81/73/74/333817374.db2.gz	WKCUGZKTBNKJTC-UHFFFAOYSA-N	0	0	296.370	4.104	20	30		CIEDRN
C=CCCCN[C@@H](c1cccc(F)c1F)C(F)(F)F	ZINC000542259796	333819269	/nfs/dbraw/zinc/81/92/69/333819269.db2.gz	PKXJRPNVOCMOPC-LBPRGKRZSA-N	0	0	279.252	4.124	20	30		CIEDRN
C[C@H]1C[C@H](C(=O)Nc2ccccc2CC#N)CC(C)(C)C1	ZINC000567513514	333825235	/nfs/dbraw/zinc/82/52/35/333825235.db2.gz	AKUOJIIIWSFGOY-ZFWWWQNUSA-N	0	0	284.403	4.154	20	30		CIEDRN
C=CCCCCCN(C)C(=O)NC[C@@H](C)c1ccccc1	ZINC000542536130	333831280	/nfs/dbraw/zinc/83/12/80/333831280.db2.gz	ORMPWVYVLCFPBY-MRXNPFEDSA-N	0	0	288.435	4.178	20	30		CIEDRN
C=CCC[C@@H](C)Nc1cccc(CC(=O)OC(C)(C)C)c1	ZINC000542703506	333837616	/nfs/dbraw/zinc/83/76/16/333837616.db2.gz	UEFVJPNKWXWUNB-CQSZACIVSA-N	0	0	289.419	4.337	20	30		CIEDRN
C=C[C@H](CC(=O)N1CC[C@@]2(CC[C@H](C)C2)C1)c1ccccc1	ZINC000542871100	333846493	/nfs/dbraw/zinc/84/64/93/333846493.db2.gz	SUKHBJNQXHFTET-SQGPQFPESA-N	0	0	297.442	4.385	20	30		CIEDRN
CCOc1ccccc1[C@H](CC)Nc1nccc(C)c1C#N	ZINC000543132613	333859662	/nfs/dbraw/zinc/85/96/62/333859662.db2.gz	MEHQORSKPHXUOM-INIZCTEOSA-N	0	0	295.386	4.224	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)C23CCC(CC2)C3)c1	ZINC000543146449	333860957	/nfs/dbraw/zinc/86/09/57/333860957.db2.gz	BMOBECXAVKTQLJ-UHFFFAOYSA-N	0	0	285.387	4.160	20	30		CIEDRN
CC(C)COc1ccccc1NCc1cccc(C#N)c1F	ZINC000543164116	333861979	/nfs/dbraw/zinc/86/19/79/333861979.db2.gz	HRVCZEOVFYPJEV-UHFFFAOYSA-N	0	0	298.361	4.344	20	30		CIEDRN
CCCOc1cccc(NCc2ccc(CC#N)cc2)c1	ZINC000543162863	333862189	/nfs/dbraw/zinc/86/21/89/333862189.db2.gz	MUIMYDMCHMWLAG-UHFFFAOYSA-N	0	0	280.371	4.154	20	30		CIEDRN
C[C@@H](CCC(C)(C)C)C(=O)N[C@@H](C#N)C1CCCCC1	ZINC000543453587	333876077	/nfs/dbraw/zinc/87/60/77/333876077.db2.gz	PROCVAVLVQPPQO-ZFWWWQNUSA-N	0	0	278.440	4.037	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N[C@H](CC)c1ccc(C)cc1	ZINC000543705400	333889815	/nfs/dbraw/zinc/88/98/15/333889815.db2.gz	TVQXGCCASGZCJS-HZPDHXFCSA-N	0	0	274.408	4.100	20	30		CIEDRN
CCC(C)(C)c1ccc(C(=O)N2CCC(CC#N)CC2)cc1	ZINC000543833241	333902193	/nfs/dbraw/zinc/90/21/93/333902193.db2.gz	LTEGDINDDIDPSP-UHFFFAOYSA-N	0	0	298.430	4.140	20	30		CIEDRN
C=CCCC(=O)N(c1nc(C)cs1)c1ccccc1	ZINC000072080196	333903086	/nfs/dbraw/zinc/90/30/86/333903086.db2.gz	OXTZISATHIUMGM-UHFFFAOYSA-N	0	0	272.373	4.082	20	30		CIEDRN
N#Cc1ccc(CSCCCc2ccsc2)cc1	ZINC000543957972	333906874	/nfs/dbraw/zinc/90/68/74/333906874.db2.gz	RBCCSMKCFPCBSI-UHFFFAOYSA-N	0	0	273.426	4.486	20	30		CIEDRN
CC[C@H](Nc1nccc(C)c1C#N)c1cc(F)ccc1F	ZINC000544145066	333918789	/nfs/dbraw/zinc/91/87/89/333918789.db2.gz	DQXWOZRNVRGCJW-HNNXBMFYSA-N	0	0	287.313	4.103	20	30		CIEDRN
Cc1ccnc(N(C)[C@H](C)c2cc3ccccc3o2)c1C#N	ZINC000544145254	333918859	/nfs/dbraw/zinc/91/88/59/333918859.db2.gz	IVIAHMXJJPNYEY-CYBMUJFWSA-N	0	0	291.354	4.205	20	30		CIEDRN
C=C[C@@H](CC(=O)N1C[C@@H](C)CC(C)(C)C1)c1ccccc1	ZINC000544319651	333924469	/nfs/dbraw/zinc/92/44/69/333924469.db2.gz	AUZNTQNKUZIHGZ-HOTGVXAUSA-N	0	0	285.431	4.241	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(NC[C@H](C)c2ccc(F)cc2)c1	ZINC000544393598	333928615	/nfs/dbraw/zinc/92/86/15/333928615.db2.gz	BEVBEGGETOYKND-LBPRGKRZSA-N	0	0	296.345	4.116	20	30		CIEDRN
CCC[C@H]1CCCCN1C(=O)c1ccc(Cl)c(C#N)c1	ZINC000544485179	333933534	/nfs/dbraw/zinc/93/35/34/333933534.db2.gz	QSPYICSHIJWCQH-AWEZNQCLSA-N	0	0	290.794	4.006	20	30		CIEDRN
C[C@@H](NCC#N)c1ccc(-c2ccc(Cl)cc2)s1	ZINC000544521756	333934434	/nfs/dbraw/zinc/93/44/34/333934434.db2.gz	DPCIBZXVAKBCPJ-SNVBAGLBSA-N	0	0	276.792	4.243	20	30		CIEDRN
C=CCC[C@@H](C)Nc1cnn([C@@H](C)CC)c1C1CC1	ZINC000544602015	333939617	/nfs/dbraw/zinc/93/96/17/333939617.db2.gz	GTFOZFQTKDEBIC-OLZOCXBDSA-N	0	0	261.413	4.498	20	30		CIEDRN
Cc1cc(C)cc(-c2noc(-c3ccc(C#N)cc3C)n2)c1	ZINC000544728513	333944625	/nfs/dbraw/zinc/94/46/25/333944625.db2.gz	HKFVXWAUVGHFAU-UHFFFAOYSA-N	0	0	289.338	4.201	20	30		CIEDRN
C=CCCc1ccccc1N[C@@H]1CCO[C@H](C(F)(F)F)C1	ZINC000576193950	335167480	/nfs/dbraw/zinc/16/74/80/335167480.db2.gz	MHSZMNRBOGLUSJ-HIFRSBDPSA-N	0	0	299.336	4.327	20	30		CIEDRN
C=CCCO[C@@H](C)c1nc(C[C@@H](C)c2ccccc2)no1	ZINC000545052017	333960317	/nfs/dbraw/zinc/96/03/17/333960317.db2.gz	SZVXCTXRWSLUEN-KGLIPLIRSA-N	0	0	286.375	4.070	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(OC(C)C)cc1C	ZINC000545215986	333970135	/nfs/dbraw/zinc/97/01/35/333970135.db2.gz	YGQHQYLYNJMXDJ-AWEZNQCLSA-N	0	0	275.392	4.323	20	30		CIEDRN
N#CCc1ccc(NC/C=C\c2ccc(F)cc2)cc1	ZINC000545369234	333980311	/nfs/dbraw/zinc/98/03/11/333980311.db2.gz	HAMPNEIQNHKDDT-UPHRSURJSA-N	0	0	266.319	4.017	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1cccc(SCC)c1	ZINC000073991133	333981798	/nfs/dbraw/zinc/98/17/98/333981798.db2.gz	BKEMDEVTFGIIRU-UHFFFAOYSA-N	0	0	278.421	4.229	20	30		CIEDRN
C[C@@H]1CCCC[C@H]1c1noc(C2(C#N)CCCCC2)n1	ZINC000545691755	333995069	/nfs/dbraw/zinc/99/50/69/333995069.db2.gz	SBNFEYVUPROSAS-CHWSQXEVSA-N	0	0	273.380	4.089	20	30		CIEDRN
C=C[C@@H](Cc1nc([C@H](C)SCC)no1)c1ccccc1	ZINC000545783188	334000553	/nfs/dbraw/zinc/00/05/53/334000553.db2.gz	CPVBOFGBMQCNLH-STQMWFEESA-N	0	0	288.416	4.396	20	30		CIEDRN
C=C[C@@H](Cc1nc([C@@H](C)SCC)no1)c1ccccc1	ZINC000545783186	334000576	/nfs/dbraw/zinc/00/05/76/334000576.db2.gz	CPVBOFGBMQCNLH-OLZOCXBDSA-N	0	0	288.416	4.396	20	30		CIEDRN
Cc1ccc(C[C@@H](C#N)Sc2ccccc2)cc1	ZINC000074339474	334004168	/nfs/dbraw/zinc/00/41/68/334004168.db2.gz	RREDNWVNSOBNCK-INIZCTEOSA-N	0	0	253.370	4.222	20	30		CIEDRN
C[C@H](CC1CCCCC1)C(=O)N(C)Cc1cccc(C#N)c1	ZINC000074435930	334005880	/nfs/dbraw/zinc/00/58/80/334005880.db2.gz	FIXHLFUJJLGPHY-OAHLLOKOSA-N	0	0	298.430	4.123	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@H]1CCCc2ccccc21	ZINC000545924245	334006638	/nfs/dbraw/zinc/00/66/38/334006638.db2.gz	XFJOGJMOHWVZLT-YOEHRIQHSA-N	0	0	271.404	4.125	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccc(Cl)c2cccnc12	ZINC000545924327	334006670	/nfs/dbraw/zinc/00/66/70/334006670.db2.gz	HJMCUZYCHOIYAR-UHFFFAOYSA-N	0	0	286.762	4.020	20	30		CIEDRN
N#CCc1ccnc(NCc2ccc(-c3ccccc3)cc2)c1	ZINC000545926998	334006919	/nfs/dbraw/zinc/00/69/19/334006919.db2.gz	CWLKXQBOUZBOFG-UHFFFAOYSA-N	0	0	299.377	4.427	20	30		CIEDRN
CC(C)(C)c1ccc(CNc2cc(CC#N)ccn2)cc1	ZINC000545926916	334006975	/nfs/dbraw/zinc/00/69/75/334006975.db2.gz	MBDPQVLITLIHKA-UHFFFAOYSA-N	0	0	279.387	4.057	20	30		CIEDRN
C=CCn1cccc1C(=O)Nc1ccc(OC(C)C)cc1C	ZINC000576209189	335170333	/nfs/dbraw/zinc/17/03/33/335170333.db2.gz	ULVCSIJRDJZIIN-UHFFFAOYSA-N	0	0	298.386	4.022	20	30		CIEDRN
N#Cc1cccc(NCc2cccc(-c3cccnc3)c2)c1	ZINC000132882204	334008910	/nfs/dbraw/zinc/00/89/10/334008910.db2.gz	ZYSIUOBSJXRRSK-UHFFFAOYSA-N	0	0	285.350	4.232	20	30		CIEDRN
Cc1c(Cl)cnc(Oc2ccc(Cl)cc2F)c1C#N	ZINC000546000932	334011437	/nfs/dbraw/zinc/01/14/37/334011437.db2.gz	MHCCJNKAOGJHAH-UHFFFAOYSA-N	0	0	297.116	4.500	20	30		CIEDRN
C=C[C@H](CC(=O)N1CC[C@H](C)C(C)(C)C1)c1ccccc1	ZINC000546139325	334016433	/nfs/dbraw/zinc/01/64/33/334016433.db2.gz	JJBVWNRVNPBXGO-JKSUJKDBSA-N	0	0	285.431	4.241	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)c1ccc(C(C)C)s1	ZINC000546183753	334018900	/nfs/dbraw/zinc/01/89/00/334018900.db2.gz	DJWDMRQEGVNIIY-UHFFFAOYSA-N	0	0	284.384	4.304	20	30		CIEDRN
Cc1cccc(-c2noc(/C=C/c3cccc(C#N)c3)n2)c1	ZINC000546231796	334021400	/nfs/dbraw/zinc/02/14/00/334021400.db2.gz	QMRXJMJVLQEJEI-CMDGGOBGSA-N	0	0	287.322	4.087	20	30		CIEDRN
C=CCCCc1nc([C@H]2CCCc3ccccc32)no1	ZINC000546289651	334025357	/nfs/dbraw/zinc/02/53/57/334025357.db2.gz	XZBNQMIZNBJVEJ-HNNXBMFYSA-N	0	0	268.360	4.047	20	30		CIEDRN
CCc1ccccc1-c1noc(-c2ccc(C#N)cc2C)n1	ZINC000546319048	334027468	/nfs/dbraw/zinc/02/74/68/334027468.db2.gz	CSKUFGPLKASCIR-UHFFFAOYSA-N	0	0	289.338	4.146	20	30		CIEDRN
C=CCCOCCCCc1nc([C@@H]2CCCC[C@H]2C)no1	ZINC000546396789	334030616	/nfs/dbraw/zinc/03/06/16/334030616.db2.gz	ZAPOICHEWNEFPM-HUUCEWRRSA-N	0	0	292.423	4.279	20	30		CIEDRN
C=CCCO[C@@H](C)c1nc([C@H](C)c2ccccc2C)no1	ZINC000546546514	334038266	/nfs/dbraw/zinc/03/82/66/334038266.db2.gz	VHFKIKYHYARPIS-KGLIPLIRSA-N	0	0	286.375	4.184	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cnc(-c2ccccc2)s1	ZINC000546632461	334042333	/nfs/dbraw/zinc/04/23/33/334042333.db2.gz	XWARMMXKSWLCCX-GFCCVEGCSA-N	0	0	286.400	4.351	20	30		CIEDRN
Cc1csc([C@@H](C#N)C(=O)c2cccc(C3CCC3)c2)n1	ZINC000546679893	334045599	/nfs/dbraw/zinc/04/55/99/334045599.db2.gz	PFHRVPYUNRUKDS-HNNXBMFYSA-N	0	0	296.395	4.209	20	30		CIEDRN
C=CCCc1csc(-c2c(F)cccc2F)n1	ZINC000546730736	334048889	/nfs/dbraw/zinc/04/88/89/334048889.db2.gz	CDPBEWGWPJAQQN-UHFFFAOYSA-N	0	0	251.301	4.207	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1nc(C)oc1-c1ccccc1	ZINC000546756792	334050050	/nfs/dbraw/zinc/05/00/50/334050050.db2.gz	ZAIPDPSXESPUJM-CYBMUJFWSA-N	0	0	298.386	4.125	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@@H](C(C)C)CC1	ZINC000133751170	334053334	/nfs/dbraw/zinc/05/33/34/334053334.db2.gz	URUQZRSZMBZEEU-OAHLLOKOSA-N	0	0	263.425	4.040	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@H]1C(C)(C)CC	ZINC000133775980	334055320	/nfs/dbraw/zinc/05/53/20/334055320.db2.gz	ZKLCSUJNWQCHEO-HNNXBMFYSA-N	0	0	263.425	4.182	20	30		CIEDRN
C=CCC(CC=C)c1nc(Cc2ccccc2F)no1	ZINC000546960752	334057990	/nfs/dbraw/zinc/05/79/90/334057990.db2.gz	ZSKDAKDNBNNIQT-UHFFFAOYSA-N	0	0	272.323	4.035	20	30		CIEDRN
C=CCCCc1nc(Cc2cccc3ccccc32)no1	ZINC000547019189	334061838	/nfs/dbraw/zinc/06/18/38/334061838.db2.gz	KXKWIKNXIPUQJL-UHFFFAOYSA-N	0	0	278.355	4.322	20	30		CIEDRN
C=CCC[C@H](NC(=O)c1occc1C)c1ccccc1	ZINC000133842313	334063322	/nfs/dbraw/zinc/06/33/22/334063322.db2.gz	XRRIUQVFFVYLLG-HNNXBMFYSA-N	0	0	269.344	4.025	20	30		CIEDRN
Cc1ccc(SCc2ccccc2C(C)(C)C#N)nc1	ZINC000133936365	334072953	/nfs/dbraw/zinc/07/29/53/334072953.db2.gz	YGMAQNWCZIQHNR-UHFFFAOYSA-N	0	0	282.412	4.484	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CCCC[C@H]1CCC	ZINC000547341260	334081232	/nfs/dbraw/zinc/08/12/32/334081232.db2.gz	GIJIYPFZTJLAIW-RRFJBIMHSA-N	0	0	251.414	4.064	20	30		CIEDRN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@H]1CCC[C@H](C)C1	ZINC000134157912	334082479	/nfs/dbraw/zinc/08/24/79/334082479.db2.gz	VRINRXPADKZYFJ-YJBOKZPZSA-N	0	0	298.430	4.122	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@@H](C)c1ccc(F)cc1Cl	ZINC000077621905	334109911	/nfs/dbraw/zinc/10/99/11/334109911.db2.gz	KQAGVHMTNBQRHU-NSHDSACASA-N	0	0	298.789	4.148	20	30		CIEDRN
CCCC(=O)Nc1sc(-c2ccccc2)cc1C#N	ZINC000077687434	334112173	/nfs/dbraw/zinc/11/21/73/334112173.db2.gz	FUOIUMSJORXTBS-UHFFFAOYSA-N	0	0	270.357	4.025	20	30		CIEDRN
CCc1cc(CCCSc2ccc(C#N)c(C)c2)on1	ZINC000564329531	334113266	/nfs/dbraw/zinc/11/32/66/334113266.db2.gz	WKHIVJPBIOTXSR-UHFFFAOYSA-N	0	0	286.400	4.142	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CCCC[C@@H]1C(C)C)c1ccccc1	ZINC000135100940	334115502	/nfs/dbraw/zinc/11/55/02/334115502.db2.gz	QVWRFHZFDGLHSC-FUHWJXTLSA-N	0	0	285.431	4.383	20	30		CIEDRN
Cc1nc(SCc2ccc(Cl)cc2C#N)oc1C	ZINC000547821104	334122773	/nfs/dbraw/zinc/12/27/73/334122773.db2.gz	JUSHLJRIPLBMTG-UHFFFAOYSA-N	0	0	278.764	4.109	20	30		CIEDRN
Cc1csc(-c2ccc(Nc3ccncc3C#N)cc2)n1	ZINC000547824923	334123404	/nfs/dbraw/zinc/12/34/04/334123404.db2.gz	KMEIHOPTNABWMT-UHFFFAOYSA-N	0	0	292.367	4.129	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1ccccc1SC(C)C	ZINC000135412729	334129235	/nfs/dbraw/zinc/12/92/35/334129235.db2.gz	FJCOYUXLKLHVMV-GFCCVEGCSA-N	0	0	278.421	4.273	20	30		CIEDRN
CC(C)(C#N)CCCOc1ccc(OCC2CC2)cc1	ZINC000135494547	334131709	/nfs/dbraw/zinc/13/17/09/334131709.db2.gz	JTFDEAYUVUZVOK-UHFFFAOYSA-N	0	0	273.376	4.184	20	30		CIEDRN
CC(C)(C)c1ccc(NCc2ccc(C#N)o2)cc1	ZINC000135560301	334133278	/nfs/dbraw/zinc/13/32/78/334133278.db2.gz	XVRIJXZPTRYCAW-UHFFFAOYSA-N	0	0	254.333	4.061	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)N2[C@@H](C)CC[C@@H]2C)c1	ZINC000135659162	334135322	/nfs/dbraw/zinc/13/53/22/334135322.db2.gz	UHKUGSLEZNKZLK-KBPBESRZSA-N	0	0	288.391	4.046	20	30		CIEDRN
C[C@H]1CCCC[C@H]1CNc1nc(C(F)(F)F)ccc1C#N	ZINC000078834858	334141304	/nfs/dbraw/zinc/14/13/04/334141304.db2.gz	JJUMYWJUQMKPMS-JQWIXIFHSA-N	0	0	297.324	4.210	20	30		CIEDRN
CC[C@H]1CCCN(c2c(C#N)cnc3ccccc32)CC1	ZINC000079343553	334151929	/nfs/dbraw/zinc/15/19/29/334151929.db2.gz	LIQJRYZHXDCQCX-AWEZNQCLSA-N	0	0	279.387	4.123	20	30		CIEDRN
C=C(C)CSCc1coc(-c2ccc(F)cc2)n1	ZINC000079350877	334152253	/nfs/dbraw/zinc/15/22/53/334152253.db2.gz	PBVCEBJQPCIJMC-UHFFFAOYSA-N	0	0	263.337	4.290	20	30		CIEDRN
Clc1cccc(C#CCNc2cccc3cc[nH]c32)c1	ZINC000548467714	334158112	/nfs/dbraw/zinc/15/81/12/334158112.db2.gz	UJNJLHMZSMTASZ-UHFFFAOYSA-N	0	0	280.758	4.285	20	30		CIEDRN
N#Cc1cc(Cl)ccc1CSC[C@H]1CCCCO1	ZINC000548469944	334158561	/nfs/dbraw/zinc/15/85/61/334158561.db2.gz	XJEFLYUJCOLSIA-CQSZACIVSA-N	0	0	281.808	4.014	20	30		CIEDRN
Cc1ccc(C[C@H](C)Nc2ccc(F)cc2C#N)s1	ZINC000080245122	334168336	/nfs/dbraw/zinc/16/83/36/334168336.db2.gz	OANIXYKBHMGGAJ-JTQLQIEISA-N	0	0	274.364	4.110	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CC[C@H](CC(C)C)C1)c1ccccc1	ZINC000137086497	334169753	/nfs/dbraw/zinc/16/97/53/334169753.db2.gz	YNHMDSKDOPCNEC-SJORKVTESA-N	0	0	285.431	4.241	20	30		CIEDRN
COC[C@H](C)Nc1ccc(Oc2ccc(C#N)cc2)cc1C	ZINC000080466658	334171928	/nfs/dbraw/zinc/17/19/28/334171928.db2.gz	IXSKDYCRJXEFJN-AWEZNQCLSA-N	0	0	296.370	4.106	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1ccc(C)cc1OC	ZINC000548771626	334173625	/nfs/dbraw/zinc/17/36/25/334173625.db2.gz	RURYBBPGAXFVLE-UHFFFAOYSA-N	0	0	295.382	4.375	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)NCC(C1CC1)C1CC1	ZINC000548878876	334178028	/nfs/dbraw/zinc/17/80/28/334178028.db2.gz	AQXHHKCNVKSVBY-UHFFFAOYSA-N	0	0	298.430	4.363	20	30		CIEDRN
C[C@@H]1C[C@@H](CCNc2c(Cl)cccc2C#N)C[C@H](C)O1	ZINC000548991637	334182198	/nfs/dbraw/zinc/18/21/98/334182198.db2.gz	LLQFNDKRIHSIGT-CLLJXQQHSA-N	0	0	292.810	4.217	20	30		CIEDRN
C[C@@H]1CC(CCNc2c(Cl)cccc2C#N)C[C@@H](C)O1	ZINC000548991639	334182228	/nfs/dbraw/zinc/18/22/28/334182228.db2.gz	LLQFNDKRIHSIGT-VXGBXAGGSA-N	0	0	292.810	4.217	20	30		CIEDRN
N#Cc1cccc(NC(=O)c2cc(F)c3ccccc3c2)c1	ZINC000549013043	334182508	/nfs/dbraw/zinc/18/25/08/334182508.db2.gz	RPNVBXNVSRIAJX-UHFFFAOYSA-N	0	0	290.297	4.103	20	30		CIEDRN
CC[C@H](C)C(=O)N(Cc1ccccc1)c1ccccc1C#N	ZINC000564361559	334183089	/nfs/dbraw/zinc/18/30/89/334183089.db2.gz	TWKMQMRAMKCALG-HNNXBMFYSA-N	0	0	292.382	4.138	20	30		CIEDRN
C=CCOCCSc1nc2cc(Cl)cc(C)c2o1	ZINC000549038273	334183289	/nfs/dbraw/zinc/18/32/89/334183289.db2.gz	QTZQLNOVJXAJIJ-UHFFFAOYSA-N	0	0	283.780	4.084	20	30		CIEDRN
N#CCS[C@H](c1ccccc1)c1ccc(F)cc1	ZINC000549200398	334187630	/nfs/dbraw/zinc/18/76/30/334187630.db2.gz	UXEYBMAXDGGPGU-OAHLLOKOSA-N	0	0	257.333	4.172	20	30		CIEDRN
C[C@@H]1C[C@@H](CCNc2ccc(Cl)cc2C#N)C[C@H](C)O1	ZINC000549259859	334188962	/nfs/dbraw/zinc/18/89/62/334188962.db2.gz	PKQIVERPYCUDFT-CLLJXQQHSA-N	0	0	292.810	4.217	20	30		CIEDRN
CC(C)c1nsc(Oc2ccc(C#N)c3ccccc23)n1	ZINC000549294380	334189577	/nfs/dbraw/zinc/18/95/77/334189577.db2.gz	WLYCUPKSWPDYOH-UHFFFAOYSA-N	0	0	295.367	4.479	20	30		CIEDRN
N#Cc1ccc(Oc2ncnc3ccccc32)c2ccccc12	ZINC000549302985	334189856	/nfs/dbraw/zinc/18/98/56/334189856.db2.gz	JQWABXVQQJKBEG-UHFFFAOYSA-N	0	0	297.317	4.447	20	30		CIEDRN
C=C(C)Cn1c([C@@H](C)CC)nnc1N(C)Cc1ccccc1	ZINC000549639798	334200790	/nfs/dbraw/zinc/20/07/90/334200790.db2.gz	PVQLSJNQEYGQRM-HNNXBMFYSA-N	0	0	298.434	4.004	20	30		CIEDRN
N#CCc1ccccc1NC(=O)CCCC1CCCC1	ZINC000550100275	334212964	/nfs/dbraw/zinc/21/29/64/334212964.db2.gz	RHTVYAIKADOJAG-UHFFFAOYSA-N	0	0	270.376	4.052	20	30		CIEDRN
C[C@@](C#N)(NC(=O)[C@H]1CCCC(C)(C)C1)C1CCCCC1	ZINC000550123340	334213672	/nfs/dbraw/zinc/21/36/72/334213672.db2.gz	WDXBSYNZABZDSU-KSSFIOAISA-N	0	0	290.451	4.182	20	30		CIEDRN
CC[C@H](C)[C@H](C)C(=O)N(CC)[C@H](C)c1ccc(C#N)cc1	ZINC000245728314	334215656	/nfs/dbraw/zinc/21/56/56/334215656.db2.gz	PVNSCWXANZGJSV-SOUVJXGZSA-N	0	0	286.419	4.150	20	30		CIEDRN
Cc1ccccc1C(C)(C)NCc1cccc(F)c1C#N	ZINC000550262419	334218099	/nfs/dbraw/zinc/21/80/99/334218099.db2.gz	GIZJZIXYRPAIBT-UHFFFAOYSA-N	0	0	282.362	4.031	20	30		CIEDRN
C[C@@H]1CCCC[C@@H]1CC(=O)N[C@](C)(C#N)C1CCCCC1	ZINC000550350077	334220748	/nfs/dbraw/zinc/22/07/48/334220748.db2.gz	KIMNFCQOXJBYJV-IIDMSEBBSA-N	0	0	290.451	4.182	20	30		CIEDRN
CC[C@H](CC1CCCC1)C(=O)N1CCc2ccc(C#N)cc21	ZINC000550522533	334223815	/nfs/dbraw/zinc/22/38/15/334223815.db2.gz	DCIMNUYHEKJLQJ-MRXNPFEDSA-N	0	0	296.414	4.054	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccnc(-c2ccccc2)c1	ZINC000550599142	334225099	/nfs/dbraw/zinc/22/50/99/334225099.db2.gz	SPBWLIWGGTZWRM-UHFFFAOYSA-N	0	0	280.371	4.289	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CC[C@@H](c2ccc(Cl)cc2)C1	ZINC000550629525	334225735	/nfs/dbraw/zinc/22/57/35/334225735.db2.gz	SXMVUHSEDZIQPD-CQSZACIVSA-N	0	0	291.822	4.258	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H]1CCC[C@H]1c1ccccc1	ZINC000550628096	334225745	/nfs/dbraw/zinc/22/57/45/334225745.db2.gz	SVHZPPKPAIFWNQ-HOTGVXAUSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CCC(F)(F)c1nc(C[C@H](C)c2ccccc2)no1	ZINC000551015527	334236408	/nfs/dbraw/zinc/23/64/08/334236408.db2.gz	DXHGLCHSVYKXMD-NSHDSACASA-N	0	0	278.302	4.084	20	30		CIEDRN
C=CCC(C)(C)c1noc(Cc2cccc(C(F)F)c2)n1	ZINC000551136704	334239272	/nfs/dbraw/zinc/23/92/72/334239272.db2.gz	PWFNNHCIMATLTG-UHFFFAOYSA-N	0	0	292.329	4.452	20	30		CIEDRN
C=CCC(C)(C)c1noc(Cc2ccc(Cl)c(F)c2)n1	ZINC000551139856	334239323	/nfs/dbraw/zinc/23/93/23/334239323.db2.gz	JDWKSSYKFSPJHK-UHFFFAOYSA-N	0	0	294.757	4.307	20	30		CIEDRN
C=CCC(C)(C)c1noc(/C=C\c2ccc([N+](=O)[O-])cc2)n1	ZINC000551142350	334239378	/nfs/dbraw/zinc/23/93/78/334239378.db2.gz	AURQFWLJBCDYAV-YFHOEESVSA-N	0	0	299.330	4.002	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H]2C[C@@]23CCc2ccccc23)n1	ZINC000551140878	334239405	/nfs/dbraw/zinc/23/94/05/334239405.db2.gz	XNPKTTQXMSEJHF-DNVCBOLYSA-N	0	0	294.398	4.295	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H](C)Cc2ccccc2F)n1	ZINC000551140132	334239498	/nfs/dbraw/zinc/23/94/98/334239498.db2.gz	PPEUYBVFDMYXHC-GFCCVEGCSA-N	0	0	288.366	4.409	20	30		CIEDRN
N#CC[C@@H](Cc1nc(CC2CCCC2)no1)c1ccccc1	ZINC000551155857	334239753	/nfs/dbraw/zinc/23/97/53/334239753.db2.gz	NHQLOILXQFBRBH-INIZCTEOSA-N	0	0	295.386	4.042	20	30		CIEDRN
CC[C@H]1CCCC[C@@H]1c1noc(-c2ccc(CC#N)cc2)n1	ZINC000551182963	334240269	/nfs/dbraw/zinc/24/02/69/334240269.db2.gz	SQGJJHNCAPSNDJ-HOCLYGCPSA-N	0	0	295.386	4.486	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H](C)c2cccc(F)c2)n1	ZINC000551469558	334251200	/nfs/dbraw/zinc/25/12/00/334251200.db2.gz	DRNDNNUNWYCZPM-LLVKDONJSA-N	0	0	274.339	4.214	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2coc(-c3ccccc3)n2)n1	ZINC000551472218	334251203	/nfs/dbraw/zinc/25/12/03/334251203.db2.gz	PUXNIMRCXRMBHD-UHFFFAOYSA-N	0	0	295.342	4.245	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ccc(C(F)(F)F)cn2)n1	ZINC000551492965	334251601	/nfs/dbraw/zinc/25/16/01/334251601.db2.gz	ACMHDECTGHXVGT-UHFFFAOYSA-N	0	0	297.280	4.004	20	30		CIEDRN
C=CCC(C)(C)c1noc(Cc2ccc(F)cc2Cl)n1	ZINC000551497068	334251695	/nfs/dbraw/zinc/25/16/95/334251695.db2.gz	RLQXIXQPWSVFAI-UHFFFAOYSA-N	0	0	294.757	4.307	20	30		CIEDRN
C=CCC(C)(C)c1noc(C2(c3ccccc3)CCC2)n1	ZINC000551496644	334251729	/nfs/dbraw/zinc/25/17/29/334251729.db2.gz	OFJCAUHJMFYLBE-UHFFFAOYSA-N	0	0	282.387	4.393	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2csc(Cl)c2)n1	ZINC000551495886	334251745	/nfs/dbraw/zinc/25/17/45/334251745.db2.gz	FKGFLSZUGMSJIS-UHFFFAOYSA-N	0	0	268.769	4.305	20	30		CIEDRN
CC[C@@H]1CCCC[C@@H]1c1noc(-c2ccc(C#N)cc2)n1	ZINC000551532512	334252984	/nfs/dbraw/zinc/25/29/84/334252984.db2.gz	WBNGRBDYIDEREI-HIFRSBDPSA-N	0	0	281.359	4.292	20	30		CIEDRN
CC[C@@H]1CCCC[C@@H]1c1noc(Cc2cccc(C#N)c2)n1	ZINC000551535388	334253297	/nfs/dbraw/zinc/25/32/97/334253297.db2.gz	XYCGTMWAVJPGIC-CVEARBPZSA-N	0	0	295.386	4.216	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cccc(-c2nc(C)co2)c1	ZINC000551595221	334255573	/nfs/dbraw/zinc/25/55/73/334255573.db2.gz	VREDYKUBXMJTSY-UHFFFAOYSA-N	0	0	284.359	4.191	20	30		CIEDRN
CCC[C@H](C(=O)N(CCC#N)c1ccc(F)cc1)C(C)C	ZINC000551924802	334266483	/nfs/dbraw/zinc/26/64/83/334266483.db2.gz	GOTGXEHHLNHHSK-INIZCTEOSA-N	0	0	290.382	4.145	20	30		CIEDRN
CC(C)[C@@H]1CC[C@H]1Nc1cccc(OCCCC#N)c1	ZINC000552061975	334283512	/nfs/dbraw/zinc/28/35/12/334283512.db2.gz	HVGAVDKONIWQQJ-DLBZAZTESA-N	0	0	272.392	4.216	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)N[C@H]1CCCc2ccc(C(C)C)cc21	ZINC000552136632	334293740	/nfs/dbraw/zinc/29/37/40/334293740.db2.gz	FTBAZOJIXGMIMP-HKUYNNGSSA-N	0	0	298.430	4.243	20	30		CIEDRN
CCOc1ccc(C#N)cc1N[C@@H](C)c1ccccc1F	ZINC000552495459	334331968	/nfs/dbraw/zinc/33/19/68/334331968.db2.gz	YEVHHAVVNWNAKG-LBPRGKRZSA-N	0	0	284.334	4.269	20	30		CIEDRN
Cc1nc(CSCc2ccccc2C#N)sc1C	ZINC000088305767	334335683	/nfs/dbraw/zinc/33/56/83/334335683.db2.gz	NFBVLEBCQCHTBL-UHFFFAOYSA-N	0	0	274.414	4.065	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)N[C@H]1CC(C)(C)CCc2ccccc21	ZINC000552592686	334338390	/nfs/dbraw/zinc/33/83/90/334338390.db2.gz	RHFQMNDLCCGDAG-LPHOPBHVSA-N	0	0	298.430	4.146	20	30		CIEDRN
C=CCN(CCC#N)C(=O)[C@@H](CC1CCCCC1)C(C)C	ZINC000552755963	334344120	/nfs/dbraw/zinc/34/41/20/334344120.db2.gz	WOUAXSFUCKPMJD-KRWDZBQOSA-N	0	0	290.451	4.157	20	30		CIEDRN
C=CCCC(=O)N[C@@H](C)Cc1c(Cl)cccc1Cl	ZINC000089335948	334344316	/nfs/dbraw/zinc/34/43/16/334344316.db2.gz	HQCMJQRWHIIVJM-JTQLQIEISA-N	0	0	286.202	4.007	20	30		CIEDRN
N#Cc1cccc(NC(=O)c2cccc(-c3ccoc3)c2)c1	ZINC000089648622	334347885	/nfs/dbraw/zinc/34/78/85/334347885.db2.gz	PHWPWXRCHSBPBS-UHFFFAOYSA-N	0	0	288.306	4.071	20	30		CIEDRN
Cc1cc(N(C)Cc2csc3ccccc23)cc(C#N)n1	ZINC000552937347	334351916	/nfs/dbraw/zinc/35/19/16/334351916.db2.gz	CGFGJXUQENSRQS-UHFFFAOYSA-N	0	0	293.395	4.113	20	30		CIEDRN
N#Cc1ccc(CNc2ccnc3c(Cl)cccc23)cc1	ZINC000552959214	334353039	/nfs/dbraw/zinc/35/30/39/334353039.db2.gz	UVFKLECWIHMVIC-UHFFFAOYSA-N	0	0	293.757	4.372	20	30		CIEDRN
Cc1nsc(N[C@@H]2CCC[C@@H]2c2ccccc2)c1C#N	ZINC000553058649	334359267	/nfs/dbraw/zinc/35/92/67/334359267.db2.gz	HWRGRZHLRVVMQX-UKRRQHHQSA-N	0	0	283.400	4.071	20	30		CIEDRN
CCC[C@@H](CC)Sc1nccc(C#N)c1Cl	ZINC000553223932	334370120	/nfs/dbraw/zinc/37/01/20/334370120.db2.gz	HJSPBCKOICNXAH-SNVBAGLBSA-N	0	0	254.786	4.277	20	30		CIEDRN
C=C1CCN(C(=O)c2coc3ccc(C(C)C)cc23)CC1	ZINC000553287323	334373793	/nfs/dbraw/zinc/37/37/93/334373793.db2.gz	LSHFVFZNRRCFHA-UHFFFAOYSA-N	0	0	283.371	4.348	20	30		CIEDRN
N#Cc1ccnc(NC2CCC(c3ccccc3)CC2)c1	ZINC000553310112	334376334	/nfs/dbraw/zinc/37/63/34/334376334.db2.gz	WMMMSNLKZYLSRX-UHFFFAOYSA-N	0	0	277.371	4.092	20	30		CIEDRN
CC(C)SCCNc1ccc(C#N)cc1C(F)(F)F	ZINC000553365641	334380857	/nfs/dbraw/zinc/38/08/57/334380857.db2.gz	VAJYVOWEARXJTD-UHFFFAOYSA-N	0	0	288.338	4.131	20	30		CIEDRN
Cc1cc(C#N)nc(N[C@H](c2ccccc2C)C(C)(C)C)n1	ZINC000553426947	334384190	/nfs/dbraw/zinc/38/41/90/334384190.db2.gz	OBCSOGRDIOQSTD-MRXNPFEDSA-N	0	0	294.402	4.164	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H]1CCCc2sc(Cl)cc21	ZINC000553490375	334388120	/nfs/dbraw/zinc/38/81/20/334388120.db2.gz	JUJBAKUGFLKKCD-LLVKDONJSA-N	0	0	297.851	4.497	20	30		CIEDRN
N#Cc1cnccc1SCc1ccccc1C1CC1	ZINC000553526864	334390139	/nfs/dbraw/zinc/39/01/39/334390139.db2.gz	CTEBNMSHQHHJOH-UHFFFAOYSA-N	0	0	266.369	4.123	20	30		CIEDRN
CC(C)c1ccc2c(c1)[C@@H](Nc1cc(C#N)ccn1)CC2	ZINC000553540048	334390657	/nfs/dbraw/zinc/39/06/57/334390657.db2.gz	NEFCQAFUIZEQRW-KRWDZBQOSA-N	0	0	277.371	4.176	20	30		CIEDRN
C[C@H](Nc1cc(C#N)ccn1)c1cc(Cl)ccc1Cl	ZINC000553542729	334390828	/nfs/dbraw/zinc/39/08/28/334390828.db2.gz	KMYUXQBKWYFMEY-VIFPVBQESA-N	0	0	292.169	4.433	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1ccccc1OC(F)F	ZINC000553608505	334393136	/nfs/dbraw/zinc/39/31/36/334393136.db2.gz	YHSOQQDYSIRBHN-NSHDSACASA-N	0	0	298.333	4.154	20	30		CIEDRN
N#Cc1ccc(N2CCC=C(c3ccco3)C2)cc1Cl	ZINC000553607699	334393167	/nfs/dbraw/zinc/39/31/67/334393167.db2.gz	HKFALGFFUPZABX-UHFFFAOYSA-N	0	0	284.746	4.098	20	30		CIEDRN
Cc1cccnc1SCc1ccc(C#N)cc1Cl	ZINC000553849567	334400551	/nfs/dbraw/zinc/40/05/51/334400551.db2.gz	GDPZVZHUUWXILB-UHFFFAOYSA-N	0	0	274.776	4.207	20	30		CIEDRN
C/C=C\c1ccc(NC(=O)c2ccc(C#N)c(Cl)c2)cc1	ZINC000554014868	334406179	/nfs/dbraw/zinc/40/61/79/334406179.db2.gz	JICWSZHQDCZIEX-IHWYPQMZSA-N	0	0	296.757	4.497	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)N1CCc2ccccc21	ZINC000554374918	334426469	/nfs/dbraw/zinc/42/64/69/334426469.db2.gz	MMSRGSYYHLNZJA-UHFFFAOYSA-N	0	0	298.430	4.237	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2nccc3ccccc32)n1	ZINC000572547469	334442221	/nfs/dbraw/zinc/44/22/21/334442221.db2.gz	NTFHFIQPVCBFHT-UHFFFAOYSA-N	0	0	279.343	4.139	20	30		CIEDRN
CC(C)c1nc2cc(NCc3cc(C#N)cs3)ccc2o1	ZINC000093687008	334476671	/nfs/dbraw/zinc/47/66/71/334476671.db2.gz	YAMVFSLNLPYAHT-UHFFFAOYSA-N	0	0	297.383	4.496	20	30		CIEDRN
C=CCCCCCNc1cc(Cl)ccc1NC(C)=O	ZINC000556072617	334494134	/nfs/dbraw/zinc/49/41/34/334494134.db2.gz	FBBJXKLXFRQPCO-UHFFFAOYSA-N	0	0	280.799	4.457	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@H]1CC2CCC1CC2)c1ccccc1	ZINC000556077714	334494360	/nfs/dbraw/zinc/49/43/60/334494360.db2.gz	JNRHYVVMCCZBLO-NRLXWARBSA-N	0	0	283.415	4.041	20	30		CIEDRN
C=CCCCCCNc1cccc(NC(=O)C(C)C)c1	ZINC000564526636	334510744	/nfs/dbraw/zinc/51/07/44/334510744.db2.gz	BDFDISVPNITZMZ-UHFFFAOYSA-N	0	0	274.408	4.439	20	30		CIEDRN
CCc1ccccc1CCSCCC(C)(C)C#N	ZINC000564789046	334520840	/nfs/dbraw/zinc/52/08/40/334520840.db2.gz	ACDSWAKUAWCEJF-UHFFFAOYSA-N	0	0	261.434	4.465	20	30		CIEDRN
C=CCCCN(C)C(=O)c1c(C)[nH]c2ccc(Cl)cc21	ZINC000153099454	334554678	/nfs/dbraw/zinc/55/46/78/334554678.db2.gz	QILVBESVPDTXEC-UHFFFAOYSA-N	0	0	290.794	4.168	20	30		CIEDRN
N#Cc1c(NCCCOC2CCCC2)cccc1C(F)F	ZINC000565510960	334569665	/nfs/dbraw/zinc/56/96/65/334569665.db2.gz	KYEHSGKLVYPTPV-UHFFFAOYSA-N	0	0	294.345	4.257	20	30		CIEDRN
C=CCCCC(=O)N1C[C@H](C)CSc2ccccc21	ZINC000565586771	334576274	/nfs/dbraw/zinc/57/62/74/334576274.db2.gz	IXCNNDVQFKVQQX-ZDUSSCGKSA-N	0	0	275.417	4.118	20	30		CIEDRN
N#Cc1cc(NCCC2(F)CCC2)ccc1C(F)(F)F	ZINC000565854994	334603478	/nfs/dbraw/zinc/60/34/78/334603478.db2.gz	PQFKJOOQXVGSEB-UHFFFAOYSA-N	0	0	286.272	4.271	20	30		CIEDRN
N#CCC[C@H](NC(=O)CC1CCCCC1)c1ccccc1	ZINC000153523875	334612885	/nfs/dbraw/zinc/61/28/85/334612885.db2.gz	ACTCAPYGQVADBP-KRWDZBQOSA-N	0	0	284.403	4.118	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1cccc(CSC)c1	ZINC000566126424	334625924	/nfs/dbraw/zinc/62/59/24/334625924.db2.gz	PXMWXVOUIIXPDD-UHFFFAOYSA-N	0	0	263.406	4.090	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N(C)[C@@H]1CCCc2ccccc21	ZINC000566139343	334627278	/nfs/dbraw/zinc/62/72/78/334627278.db2.gz	WZEXCCKSVYVCSD-MRXNPFEDSA-N	0	0	271.404	4.125	20	30		CIEDRN
N#Cc1c(N[C@@H]2CCC[C@H](F)C2)cccc1C(F)F	ZINC000566483941	334651891	/nfs/dbraw/zinc/65/18/91/334651891.db2.gz	XZSHSWWUZRPPCJ-VHSXEESVSA-N	0	0	268.282	4.188	20	30		CIEDRN
CC[C@H](CC#N)NCc1ccc([C@H](C)C(F)(F)F)cc1	ZINC000566863965	334667553	/nfs/dbraw/zinc/66/75/53/334667553.db2.gz	NXIGPBNLIFLUNZ-SMDDNHRTSA-N	0	0	284.325	4.134	20	30		CIEDRN
Cc1csc(NC(=O)[C@@H]2CCC(C)=C(C)C2)c1C#N	ZINC000567050202	334676660	/nfs/dbraw/zinc/67/66/60/334676660.db2.gz	GEZNUTRBXOFCIC-GFCCVEGCSA-N	0	0	274.389	4.003	20	30		CIEDRN
CC(C)C[C@H](C)CC(=O)N[C@H](CCC#N)c1ccccc1	ZINC000153724948	334678311	/nfs/dbraw/zinc/67/83/11/334678311.db2.gz	KWBPJGPWZHSOQP-DOTOQJQBSA-N	0	0	286.419	4.220	20	30		CIEDRN
C=C(C)CSCC(=O)N[C@H](c1cccs1)C(C)(C)C	ZINC000155061007	334711962	/nfs/dbraw/zinc/71/19/62/334711962.db2.gz	YOXYGTXRAOOJSL-CQSZACIVSA-N	0	0	297.489	4.261	20	30		CIEDRN
CCN(C[C@@H](C)C#N)C(=O)c1coc2ccc(C(C)C)cc21	ZINC000567497822	334725788	/nfs/dbraw/zinc/72/57/88/334725788.db2.gz	PCGMDGACGCCITM-ZDUSSCGKSA-N	0	0	298.386	4.178	20	30		CIEDRN
CC(C)(C#N)CCCSCc1nc(C2CCCC2)no1	ZINC000155981624	334733099	/nfs/dbraw/zinc/73/30/99/334733099.db2.gz	NBGJAIYAVREMMD-UHFFFAOYSA-N	0	0	293.436	4.290	20	30		CIEDRN
C[C@@H](Nc1cccc(OCCCC#N)c1)c1ccc(F)cn1	ZINC000272012901	334748815	/nfs/dbraw/zinc/74/88/15/334748815.db2.gz	NHEONVCCSMTTLI-CYBMUJFWSA-N	0	0	299.349	4.076	20	30		CIEDRN
C=CCCNc1cccc(COCc2ccc(OC)cc2)c1	ZINC000157169386	334762067	/nfs/dbraw/zinc/76/20/67/334762067.db2.gz	ANJVRYDAPYWQBX-UHFFFAOYSA-N	0	0	297.398	4.400	20	30		CIEDRN
CC[C@H](C)CNc1ccccc1SC[C@@H](C)C#N	ZINC000157817280	334784840	/nfs/dbraw/zinc/78/48/40/334784840.db2.gz	DWGHIEIVRCOLOQ-STQMWFEESA-N	0	0	262.422	4.396	20	30		CIEDRN
Cc1nc(CCSc2ccc(C#N)cc2Cl)cs1	ZINC000158180308	334794757	/nfs/dbraw/zinc/79/47/57/334794757.db2.gz	YOEJBXDGAVFXPT-UHFFFAOYSA-N	0	0	294.832	4.311	20	30		CIEDRN
C=CCCCCCNC(=O)c1cccc(C(F)F)c1	ZINC000568171212	334799796	/nfs/dbraw/zinc/79/97/96/334799796.db2.gz	CVVIYCFNHXHHRD-UHFFFAOYSA-N	0	0	267.319	4.100	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1nc(C2CC2)cs1)c1ccccc1	ZINC000158731024	334812474	/nfs/dbraw/zinc/81/24/74/334812474.db2.gz	DFYQRHHFCSTKKA-LBPRGKRZSA-N	0	0	298.411	4.319	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2cnc3ccsc3c2)no1	ZINC000568325185	334815373	/nfs/dbraw/zinc/81/53/73/334815373.db2.gz	RQUACHSUZUGAOT-SNVBAGLBSA-N	0	0	285.372	4.416	20	30		CIEDRN
C=CCC(CC=C)c1nc(-c2ccc(F)cc2F)no1	ZINC000568540666	334829727	/nfs/dbraw/zinc/82/97/27/334829727.db2.gz	LABOGOVNUUFWNX-UHFFFAOYSA-N	0	0	276.286	4.251	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(Cc2ccc(C)cc2)no1	ZINC000572642933	334868851	/nfs/dbraw/zinc/86/88/51/334868851.db2.gz	XPYSMUXAPCGTID-ZDUSSCGKSA-N	0	0	256.349	4.039	20	30		CIEDRN
C=CC(C)(C)CNC(=O)CCCc1ccc(SC)cc1	ZINC000573122468	334910625	/nfs/dbraw/zinc/91/06/25/334910625.db2.gz	HVDXKKAIFPZTTM-UHFFFAOYSA-N	0	0	291.460	4.060	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N1CCC(c2ccccc2F)CC1	ZINC000576460837	335206389	/nfs/dbraw/zinc/20/63/89/335206389.db2.gz	YYTWMNNNPQDOHI-UHFFFAOYSA-N	0	0	289.394	4.134	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(-c2ccc(C(C)C)nc2)no1	ZINC000576671004	335232622	/nfs/dbraw/zinc/23/26/22/335232622.db2.gz	PQOPTKSERLXZCC-MRXNPFEDSA-N	0	0	271.364	4.109	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(C)c(F)cc1Cl	ZINC000576785711	335247488	/nfs/dbraw/zinc/24/74/88/335247488.db2.gz	IEYQPYBVJVUZFT-JTQLQIEISA-N	0	0	269.747	4.328	20	30		CIEDRN
CC(C)=CCC[C@H](C)CC(=O)NC1(C#N)CCCCC1	ZINC000576875737	335258679	/nfs/dbraw/zinc/25/86/79/335258679.db2.gz	IEKVOLALKFYCSN-HNNXBMFYSA-N	0	0	276.424	4.102	20	30		CIEDRN
C[C@H]1C[C@H](CC(=O)Nc2ccccc2C#N)CC(C)(C)C1	ZINC000576890965	335261322	/nfs/dbraw/zinc/26/13/22/335261322.db2.gz	HNSJBBAVAFHXSO-UONOGXRCSA-N	0	0	284.403	4.349	20	30		CIEDRN
C=CCC(C)(C)c1noc(COc2ccc(C)c(C)c2)n1	ZINC000577071408	335295116	/nfs/dbraw/zinc/29/51/16/335295116.db2.gz	MZBPRVNPDOVKQB-UHFFFAOYSA-N	0	0	286.375	4.119	20	30		CIEDRN
C=CCCCCCNC(=O)N(C)[C@H](C)c1ccccc1	ZINC000577074184	335295658	/nfs/dbraw/zinc/29/56/58/335295658.db2.gz	YNKRJZCCKQVUGQ-OAHLLOKOSA-N	0	0	274.408	4.135	20	30		CIEDRN
Cc1csc(NC(=O)c2csc3ccccc32)c1C#N	ZINC000580599337	335296993	/nfs/dbraw/zinc/29/69/93/335296993.db2.gz	PTIHFQFAJJFIFK-UHFFFAOYSA-N	0	0	298.392	4.395	20	30		CIEDRN
N#Cc1ccc(CNc2cccc(F)c2Cl)c(F)c1	ZINC000577099984	335300015	/nfs/dbraw/zinc/30/00/15/335300015.db2.gz	LLODZAUOGQZHAN-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C=CCCCNc1ccccc1OC[C@@H]1CCCCO1	ZINC000577149621	335309371	/nfs/dbraw/zinc/30/93/71/335309371.db2.gz	HULRRLCONHBJLZ-HNNXBMFYSA-N	0	0	275.392	4.013	20	30		CIEDRN
C=CCC(C)(C)c1noc(C(F)(F)c2ccccc2)n1	ZINC000577197718	335321123	/nfs/dbraw/zinc/32/11/23/335321123.db2.gz	POWFJZFGESGQOH-UHFFFAOYSA-N	0	0	278.302	4.063	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)C1(C(F)F)CCCC1	ZINC000577295189	335336519	/nfs/dbraw/zinc/33/65/19/335336519.db2.gz	VXGAZTLHJHIMSQ-UHFFFAOYSA-N	0	0	299.386	4.088	20	30		CIEDRN
C[C@@H](NCc1ccc(C#N)s1)c1ccc(F)cc1Cl	ZINC000176972383	335349369	/nfs/dbraw/zinc/34/93/69/335349369.db2.gz	FXYOCIFRCAIWPX-SECBINFHSA-N	0	0	294.782	4.263	20	30		CIEDRN
N#Cc1cc(CNc2cccc(F)c2Cl)ccc1F	ZINC000577420751	335350964	/nfs/dbraw/zinc/35/09/64/335350964.db2.gz	KGXWBYIHZJKKME-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C=C(C)CCNC(=O)Nc1cccc(Cl)c1Cl	ZINC000577470545	335355897	/nfs/dbraw/zinc/35/58/97/335355897.db2.gz	DMVJGLGDYLEEFL-UHFFFAOYSA-N	0	0	273.163	4.081	20	30		CIEDRN
N#Cc1c(C(F)F)cccc1N1Cc2ccccc2C1	ZINC000577668164	335387308	/nfs/dbraw/zinc/38/73/08/335387308.db2.gz	ZEDJRWVYGYIQPS-UHFFFAOYSA-N	0	0	270.282	4.016	20	30		CIEDRN
CC(C)Oc1ccc(F)cc1NCc1cccc(C#N)c1	ZINC000178363012	335427619	/nfs/dbraw/zinc/42/76/19/335427619.db2.gz	MQYYZMMUNIRVHT-UHFFFAOYSA-N	0	0	284.334	4.097	20	30		CIEDRN
C=CCCCNC(=O)N[C@@H](CC)c1ccc(Cl)s1	ZINC000578021655	335462975	/nfs/dbraw/zinc/46/29/75/335462975.db2.gz	OVQQJMJSJNAMGX-JTQLQIEISA-N	0	0	286.828	4.118	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1ccc2oc(C)nc2c1	ZINC000179693426	335508428	/nfs/dbraw/zinc/50/84/28/335508428.db2.gz	GFQDZGCGJOTOIH-LLVKDONJSA-N	0	0	287.363	4.003	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1cccc(-c2ncco2)c1	ZINC000179755263	335514958	/nfs/dbraw/zinc/51/49/58/335514958.db2.gz	ZOAZFWKCBSZOOJ-CYBMUJFWSA-N	0	0	299.374	4.208	20	30		CIEDRN
C=CCCCCCNC(=O)C1CCC(C(F)(F)F)CC1	ZINC000578140612	335523918	/nfs/dbraw/zinc/52/39/18/335523918.db2.gz	OCEHSUCUBHVIGR-UHFFFAOYSA-N	0	0	291.357	4.218	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(-c2ncco2)cc1C	ZINC000578336269	335613848	/nfs/dbraw/zinc/61/38/48/335613848.db2.gz	AOAXSPJXGHWIHE-KRWDZBQOSA-N	0	0	284.359	4.191	20	30		CIEDRN
C=CC1CCN(C(=O)[C@@H](C)CCCc2ccccc2)CC1	ZINC000180639583	335615075	/nfs/dbraw/zinc/61/50/75/335615075.db2.gz	RIUJUNGTAVIFNQ-INIZCTEOSA-N	0	0	285.431	4.070	20	30		CIEDRN
CCCCN(C(=O)c1ccc(C#N)s1)C1CCCCC1	ZINC000579034177	335703168	/nfs/dbraw/zinc/70/31/68/335703168.db2.gz	XFEBYVUPTSZTTR-UHFFFAOYSA-N	0	0	290.432	4.195	20	30		CIEDRN
CCC(CC)N(CC)C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000579279560	335731141	/nfs/dbraw/zinc/73/11/41/335731141.db2.gz	OKCAVJOLICSVAQ-UHFFFAOYSA-N	0	0	293.798	4.254	20	30		CIEDRN
N#Cc1csc(CNc2nc3cc(Cl)ccc3o2)c1	ZINC000181504849	335765296	/nfs/dbraw/zinc/76/52/96/335765296.db2.gz	YRYPAMARDIHETE-UHFFFAOYSA-N	0	0	289.747	4.026	20	30		CIEDRN
Cc1cc(S[C@H](C)c2nc(C(C)C)no2)ccc1C#N	ZINC000579591953	335816244	/nfs/dbraw/zinc/81/62/44/335816244.db2.gz	VTHVKDHFIWSGSG-LLVKDONJSA-N	0	0	287.388	4.226	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1cccc(COCC)c1	ZINC000183083719	335861731	/nfs/dbraw/zinc/86/17/31/335861731.db2.gz	PQNXBMLEWPOMID-AWEZNQCLSA-N	0	0	290.407	4.089	20	30		CIEDRN
C=CCCCN(C)C(=O)CC1CCC(C(F)(F)F)CC1	ZINC000183130367	335864984	/nfs/dbraw/zinc/86/49/84/335864984.db2.gz	SVNPMDWNXBTPSB-UHFFFAOYSA-N	0	0	291.357	4.170	20	30		CIEDRN
COc1ccc(CNc2cccc(C)c2Cl)cc1C#N	ZINC000380323881	335971188	/nfs/dbraw/zinc/97/11/88/335971188.db2.gz	ZYQWFIUORVHOGN-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
CC(C)(C)C(C)(C)Nc1nc(C(F)(F)F)ccc1C#N	ZINC000380328910	335972787	/nfs/dbraw/zinc/97/27/87/335972787.db2.gz	QTHGBPQFBSJSBA-UHFFFAOYSA-N	0	0	285.313	4.209	20	30		CIEDRN
C=CCS[C@H](C)C(=O)Nc1ccccc1[C@H](C)CC	ZINC000581153840	336016572	/nfs/dbraw/zinc/01/65/72/336016572.db2.gz	MMTGIKYCCNHLEL-CHWSQXEVSA-N	0	0	277.433	4.446	20	30		CIEDRN
C=CC[C@@H](c1nc(C(C)(C)C)no1)c1ccccc1	ZINC000581201468	336024014	/nfs/dbraw/zinc/02/40/14/336024014.db2.gz	ZXAZWBDDGXAMBO-CYBMUJFWSA-N	0	0	256.349	4.075	20	30		CIEDRN
N#Cc1ccc(OC[C@H]2CCCC(F)(F)C2)c(Cl)c1	ZINC000381003935	336043636	/nfs/dbraw/zinc/04/36/36/336043636.db2.gz	JLWLGTHILDRLJS-NSHDSACASA-N	0	0	285.721	4.416	20	30		CIEDRN
C=CCCCCCNc1cc(C)ccc1NC(C)=O	ZINC000195448264	336054025	/nfs/dbraw/zinc/05/40/25/336054025.db2.gz	QLGCCUQGKCDFLR-UHFFFAOYSA-N	0	0	260.381	4.112	20	30		CIEDRN
N#Cc1ccc(NC[C@@H]2CCCCC2(F)F)cc1Cl	ZINC000381457936	336064652	/nfs/dbraw/zinc/06/46/52/336064652.db2.gz	AAPQJSDKBMVETL-NSHDSACASA-N	0	0	284.737	4.449	20	30		CIEDRN
N#Cc1ccc(Cl)cc1OC[C@H]1CCCC1(F)F	ZINC000381740309	336072149	/nfs/dbraw/zinc/07/21/49/336072149.db2.gz	ULPALUGVYQVRMI-SNVBAGLBSA-N	0	0	271.694	4.026	20	30		CIEDRN
Cc1cc(NCc2cccc(Cl)c2Cl)cc(C#N)n1	ZINC000581446346	336079266	/nfs/dbraw/zinc/07/92/66/336079266.db2.gz	QFJUKVMJXAIELK-UHFFFAOYSA-N	0	0	292.169	4.181	20	30		CIEDRN
C=C(C)CS[C@@H](C)C(=O)Nc1cccc2ccccc21	ZINC000581689033	336128562	/nfs/dbraw/zinc/12/85/62/336128562.db2.gz	ZBPBISRUDAPHED-ZDUSSCGKSA-N	0	0	285.412	4.476	20	30		CIEDRN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@H]1CC[C@H](C)CC1	ZINC000581729069	336138952	/nfs/dbraw/zinc/13/89/52/336138952.db2.gz	IAVRUZDVTXXZAS-RZDIXWSQSA-N	0	0	298.430	4.122	20	30		CIEDRN
N#CCc1ccc(NC(=O)c2ccc3sccc3c2)cc1	ZINC000386157253	336167055	/nfs/dbraw/zinc/16/70/55/336167055.db2.gz	KAXFPMVWPCBGPN-UHFFFAOYSA-N	0	0	292.363	4.220	20	30		CIEDRN
N#Cc1cc(NC(=O)c2cccc3ccccc32)ccc1F	ZINC000386386159	336171939	/nfs/dbraw/zinc/17/19/39/336171939.db2.gz	ILTQFILOVNHSSL-UHFFFAOYSA-N	0	0	290.297	4.103	20	30		CIEDRN
Cc1ccc(C#N)c(Nc2cccc3ccsc32)n1	ZINC000386436817	336173801	/nfs/dbraw/zinc/17/38/01/336173801.db2.gz	NXRMGIQKKWVGBJ-UHFFFAOYSA-N	0	0	265.341	4.220	20	30		CIEDRN
CC(C)(C)OC(=O)CCCCSc1ccccc1C#N	ZINC000581966426	336180633	/nfs/dbraw/zinc/18/06/33/336180633.db2.gz	ATMDPHPVEJWJSY-UHFFFAOYSA-N	0	0	291.416	4.162	20	30		CIEDRN
C[C@@H]1CCC[C@H]1CC(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000352197948	533886733	/nfs/dbraw/zinc/88/67/33/533886733.db2.gz	HICHURONLHONDJ-BPQIPLTHSA-N	0	0	298.430	4.364	20	30		CIEDRN
C[C@@H]([C@H](C)NC(=O)[C@]1(C)CCCNC1=O)C1CCCCC1	ZINC000330308633	534034502	/nfs/dbraw/zinc/03/45/02/534034502.db2.gz	MISVSVXBURNHQN-GDZNZVCISA-N	0	0	294.439	4.304	20	30		CIEDRN
C[C@@H]1C[C@H]1[C@H](Nc1ccc(C#N)cn1)c1ccc(Cl)cc1	ZINC000301418294	534045257	/nfs/dbraw/zinc/04/52/57/534045257.db2.gz	BITUDNVMIDKSFT-RGYTYGDFSA-N	0	0	297.789	4.416	20	30		CIEDRN
Cc1ccc(-c2ncc[nH]2)cc1NC(=O)[C@H]1C[C@@H]1C1CC1	ZINC000330050163	534219127	/nfs/dbraw/zinc/21/91/27/534219127.db2.gz	KGCQHGLYAXMDHV-KGLIPLIRSA-N	0	0	281.359	4.019	20	30		CIEDRN
C[C@@H](Cc1cccs1)Nc1ccc2cc(C#N)ccc2n1	ZINC000301969843	534256570	/nfs/dbraw/zinc/25/65/70/534256570.db2.gz	CKQHPTUTIXZLMZ-LBPRGKRZSA-N	0	0	293.395	4.211	20	30		CIEDRN
C[C@H](CC(=O)N[C@@H]1CCCc2c[nH]nc21)C1CCCCC1	ZINC000330102402	534299348	/nfs/dbraw/zinc/29/93/48/534299348.db2.gz	GCVZHFWFKWYUGH-IUODEOHRSA-N	0	0	289.423	4.350	20	30		CIEDRN
COc1cccc(N(Cc2cccc(C#N)c2)CC(C)C)c1	ZINC000554219024	518166228	/nfs/dbraw/zinc/16/62/28/518166228.db2.gz	BKKQVCLSGWQIDF-UHFFFAOYSA-N	0	0	294.398	4.229	20	30		CIEDRN
C[C@H]1CC[C@]2(CCN(c3c(C#N)cnc4ccccc43)C2)C1	ZINC000302030072	518184462	/nfs/dbraw/zinc/18/44/62/518184462.db2.gz	BNKGGGQHYIKOOU-LIRRHRJNSA-N	0	0	291.398	4.123	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(N2CCC[C@@H]2c2cccs2)c1	ZINC000273180164	518299457	/nfs/dbraw/zinc/29/94/57/518299457.db2.gz	GWVMUXNDVYTNEH-OAHLLOKOSA-N	0	0	296.395	4.164	20	30		CIEDRN
C=CCCC(=O)Nc1cccc(Oc2ccccc2)c1	ZINC000060364678	518695828	/nfs/dbraw/zinc/69/58/28/518695828.db2.gz	RNAPPOFWWGMKLV-UHFFFAOYSA-N	0	0	267.328	4.384	20	30		CIEDRN
C=CCC[C@@H](CC)Nc1cccc(NC(=O)N(C)C)c1C	ZINC000279568024	518709849	/nfs/dbraw/zinc/70/98/49/518709849.db2.gz	AHACSOINWFMAAO-CQSZACIVSA-N	0	0	289.423	4.245	20	30		CIEDRN
CC(C)(C)c1ccccc1NC(=O)c1cc(C#N)cs1	ZINC000084059031	519059357	/nfs/dbraw/zinc/05/93/57/519059357.db2.gz	ZEMCYCNXWASAQY-UHFFFAOYSA-N	0	0	284.384	4.170	20	30		CIEDRN
CC(C)(CNc1snc(Cl)c1C#N)c1cccs1	ZINC000301297582	519271153	/nfs/dbraw/zinc/27/11/53/519271153.db2.gz	SSYXTJZJYQHSJI-UHFFFAOYSA-N	0	0	297.836	4.119	20	30		CIEDRN
CCN(C(=O)c1ccc(C)cc1)[C@H](C)c1ccc(C#N)cc1	ZINC000045499002	520080480	/nfs/dbraw/zinc/08/04/80/520080480.db2.gz	QFKSWMXTERCCOD-OAHLLOKOSA-N	0	0	292.382	4.090	20	30		CIEDRN
CCOc1cc(N[C@@H](C)c2cccc(C#N)c2)ccc1OC	ZINC000193011357	520764245	/nfs/dbraw/zinc/76/42/45/520764245.db2.gz	AFVLNQPTXDPBGP-ZDUSSCGKSA-N	0	0	296.370	4.139	20	30		CIEDRN
COc1ccc(C(=O)/C=C\c2ccc(Cl)cc2)cc1	ZINC000004726312	523544343	/nfs/dbraw/zinc/54/43/43/523544343.db2.gz	RESSHTKZHPRDTR-WCIBSUBMSA-N	0	0	272.731	4.245	20	30		CIEDRN
C[C@H]1CC[C@H](CC(=O)N(C)c2cc(Cl)ccc2C#N)C1	ZINC000156793996	524398678	/nfs/dbraw/zinc/39/86/78/524398678.db2.gz	JVTRKFCFZLAZJP-RYUDHWBXSA-N	0	0	290.794	4.001	20	30		CIEDRN
C[C@@H]1CC[C@@H](CC(=O)N(C)c2cc(Cl)ccc2C#N)C1	ZINC000156794126	524579492	/nfs/dbraw/zinc/57/94/92/524579492.db2.gz	JVTRKFCFZLAZJP-VXGBXAGGSA-N	0	0	290.794	4.001	20	30		CIEDRN
Cc1cc(Cl)c2ncc(C#N)c(NCc3ccoc3)c2c1	ZINC000338484134	524852926	/nfs/dbraw/zinc/85/29/26/524852926.db2.gz	KHJRXENMRGGXEZ-UHFFFAOYSA-N	0	0	297.745	4.273	20	30		CIEDRN
Cc1cccc2c1N(C(=O)c1cc(C#N)cs1)CC[C@H]2C	ZINC000297776817	524949023	/nfs/dbraw/zinc/94/90/23/524949023.db2.gz	JUXQGCZYNBFIFV-LLVKDONJSA-N	0	0	296.395	4.082	20	30		CIEDRN
N#Cc1ccnc(N2CCC[C@H]2c2cccs2)c1Cl	ZINC000336297523	534822830	/nfs/dbraw/zinc/82/28/30/534822830.db2.gz	PRZXIHUPIHUEOG-NSHDSACASA-N	0	0	289.791	4.010	20	30		CIEDRN
C[C@@H](N(C)c1ccc(C#N)c(Cl)c1)C(C)(C)C	ZINC000061851145	524983406	/nfs/dbraw/zinc/98/34/06/524983406.db2.gz	HWSVIDVAQRLGHG-SNVBAGLBSA-N	0	0	250.773	4.082	20	30		CIEDRN
Cc1ccc(NCc2cccc(C#N)c2)cc1C(F)(F)F	ZINC000052076741	525283381	/nfs/dbraw/zinc/28/33/81/525283381.db2.gz	YUHCXHHWMMMJPG-UHFFFAOYSA-N	0	0	290.288	4.498	20	30		CIEDRN
Cc1c(C#N)cccc1C(=O)N1CCCC2(CCCCC2)C1	ZINC000338121895	525536082	/nfs/dbraw/zinc/53/60/82/525536082.db2.gz	RDKGMIKDAILJRM-UHFFFAOYSA-N	0	0	296.414	4.053	20	30		CIEDRN
C[C@H](Nc1cc(Cl)ccc1C#N)c1ccc(C#N)cc1	ZINC000036954443	525644990	/nfs/dbraw/zinc/64/49/90/525644990.db2.gz	DCUYOGFGCNDWFB-NSHDSACASA-N	0	0	281.746	4.256	20	30		CIEDRN
C[C@H](Nc1ccc(C#N)cc1)c1cccc(N2CCCC2)c1	ZINC000154055451	525647342	/nfs/dbraw/zinc/64/73/42/525647342.db2.gz	HGTUWYGAQMOBSM-HNNXBMFYSA-N	0	0	291.398	4.332	20	30		CIEDRN
Cc1ccc([C@@H](C)N(C)c2snc(Cl)c2C#N)cc1	ZINC000301526593	525687499	/nfs/dbraw/zinc/68/74/99/525687499.db2.gz	NQMFYOSGRSEYCL-SNVBAGLBSA-N	0	0	291.807	4.174	20	30		CIEDRN
Cc1nc(C)c(CNC(=O)[C@@H]2CC[C@@H]3CCCC[C@H]3C2)o1	ZINC000329188445	534881308	/nfs/dbraw/zinc/88/13/08/534881308.db2.gz	QLEBJNKAFWVQHL-SOUVJXGZSA-N	0	0	290.407	4.354	20	30		CIEDRN
Cc1ccc(-c2ncco2)cc1NCc1cccc(C#N)c1	ZINC000157107973	525837467	/nfs/dbraw/zinc/83/74/67/525837467.db2.gz	AZTXIZGHDLRPRG-UHFFFAOYSA-N	0	0	289.338	4.134	20	30		CIEDRN
C[C@@H](OC(=O)CC(C)(C)C(F)(F)F)c1ccc(C#N)cc1	ZINC000280564282	525885492	/nfs/dbraw/zinc/88/54/92/525885492.db2.gz	VKRVKSCNYBVUMI-SNVBAGLBSA-N	0	0	299.292	4.141	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N1[C@@H](C)C[C@H]2CCCC[C@@H]21	ZINC000083560546	526001768	/nfs/dbraw/zinc/00/17/68/526001768.db2.gz	TZOAMGSNBJCTGW-LXZKKBNFSA-N	0	0	297.402	4.052	20	30		CIEDRN
C[C@@H](c1ccco1)N(Cc1cccc(C#N)c1F)C1CC1	ZINC000340839880	526137715	/nfs/dbraw/zinc/13/77/15/526137715.db2.gz	IUHVMOQCKGUAEY-LBPRGKRZSA-N	0	0	284.334	4.016	20	30		CIEDRN
Cc1ccc2c(c1)[C@@H](Nc1nc(C)ccc1C#N)CCC2	ZINC000340960927	526192878	/nfs/dbraw/zinc/19/28/78/526192878.db2.gz	HNAFQINWBBDPSP-KRWDZBQOSA-N	0	0	277.371	4.060	20	30		CIEDRN
CSc1ccccc1[C@H](C)Nc1nccc(C)c1C#N	ZINC000336919245	526195778	/nfs/dbraw/zinc/19/57/78/526195778.db2.gz	FIMIPVYYNOBXBR-LBPRGKRZSA-N	0	0	283.400	4.157	20	30		CIEDRN
C=CCN(Cc1cc2cc(F)ccc2o1)CC(F)(F)F	ZINC000352734133	526332007	/nfs/dbraw/zinc/33/20/07/526332007.db2.gz	WDVZXMQJQQCWLE-UHFFFAOYSA-N	0	0	287.256	4.122	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)Cc1cccc(C)n1	ZINC000347377695	526335590	/nfs/dbraw/zinc/33/55/90/526335590.db2.gz	DUSOBUMIOBAILD-UHFFFAOYSA-N	0	0	292.835	4.293	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)c1ccc2cc[nH]c2c1	ZINC000033219787	526375697	/nfs/dbraw/zinc/37/56/97/526375697.db2.gz	OLCAXXBNNPDUCR-UHFFFAOYSA-N	0	0	296.395	4.058	20	30		CIEDRN
C=C(C)CCSCC(=O)Nc1c(C)cc(C)cc1C	ZINC000350721779	526460421	/nfs/dbraw/zinc/46/04/21/526460421.db2.gz	WTDGRFFXTXTUQA-UHFFFAOYSA-N	0	0	277.433	4.250	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1ccc(C2=CCCC2)cc1	ZINC000351730990	526544798	/nfs/dbraw/zinc/54/47/98/526544798.db2.gz	OPSXQASVDLQTRS-UHFFFAOYSA-N	0	0	269.388	4.292	20	30		CIEDRN
Cc1noc(C)c1[C@@H](C)CNc1c(Cl)cccc1C#N	ZINC000129475306	526565907	/nfs/dbraw/zinc/56/59/07/526565907.db2.gz	FRPNTHJPAXXILA-VIFPVBQESA-N	0	0	289.766	4.032	20	30		CIEDRN
N#Cc1ccc(CNCc2ccc(C3CC3)cc2F)c(F)c1	ZINC000291762322	526622937	/nfs/dbraw/zinc/62/29/37/526622937.db2.gz	RQFBFRBNPIZDDU-UHFFFAOYSA-N	0	0	298.336	4.004	20	30		CIEDRN
N#Cc1ccc(CSCc2ccc(F)cc2)cc1	ZINC000058238468	526632758	/nfs/dbraw/zinc/63/27/58/526632758.db2.gz	FUDZRJIFSMPMMR-UHFFFAOYSA-N	0	0	257.333	4.131	20	30		CIEDRN
N#Cc1ccc(SCC(=O)CC2CC2)cc1C(F)(F)F	ZINC000278769287	526684849	/nfs/dbraw/zinc/68/48/49/526684849.db2.gz	SRLBAIGZLKFTBM-UHFFFAOYSA-N	0	0	299.317	4.038	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)c1ccc(OC(C)C)cc1	ZINC000191628564	526704455	/nfs/dbraw/zinc/70/44/55/526704455.db2.gz	JUYPKCRNOZAZEG-AWEZNQCLSA-N	0	0	275.392	4.039	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cccc(-c2nc(C)c(C)o2)c1	ZINC000185440936	526714796	/nfs/dbraw/zinc/71/47/96/526714796.db2.gz	QBPZYSIOZIYNJJ-LBPRGKRZSA-N	0	0	298.386	4.499	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccccc1OCC1CC1	ZINC000185650656	526715118	/nfs/dbraw/zinc/71/51/18/526715118.db2.gz	RDQQKOQTRAPJFO-ZDUSSCGKSA-N	0	0	273.376	4.016	20	30		CIEDRN
N#Cc1cccc(NCc2ccc(C(F)F)cc2)c1	ZINC000150057111	526723890	/nfs/dbraw/zinc/72/38/90/526723890.db2.gz	JVHVUGVIJDCPQE-UHFFFAOYSA-N	0	0	258.271	4.108	20	30		CIEDRN
C=C(C)[C@@H]1OCC[C@@H]1c1nc(C2CCC(C)(C)CC2)no1	ZINC000347497549	526784833	/nfs/dbraw/zinc/78/48/33/526784833.db2.gz	HLUOZTIJHDFPHD-KBPBESRZSA-N	0	0	290.407	4.202	20	30		CIEDRN
CC(C)(CNC(=O)c1ncoc1C1CC1)C1=CCCCC1	ZINC000329133530	526949524	/nfs/dbraw/zinc/94/95/24/526949524.db2.gz	POTZOMNCSLESNP-UHFFFAOYSA-N	0	0	288.391	4.383	20	30		CIEDRN
CC(C)(CC(=O)N[C@@H](CCCC#N)c1ccccc1)C1CC1	ZINC000352180986	526967610	/nfs/dbraw/zinc/96/76/10/526967610.db2.gz	XDNGGAQMWNFNMR-KRWDZBQOSA-N	0	0	298.430	4.364	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2cccc(SC)c2C)CC1	ZINC000335103946	526970859	/nfs/dbraw/zinc/97/08/59/526970859.db2.gz	YLVDCJURHWMJES-UHFFFAOYSA-N	0	0	290.432	4.147	20	30		CIEDRN
CC(C)(CCC#N)CNC(=O)Nc1cccc2ccccc21	ZINC000348170091	526994512	/nfs/dbraw/zinc/99/45/12/526994512.db2.gz	QHRCSBWLHAXHAT-UHFFFAOYSA-N	0	0	295.386	4.291	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cnn([C@@H](C)CC)c1C1CC1	ZINC000344362123	526999459	/nfs/dbraw/zinc/99/94/59/526999459.db2.gz	NTNGQBURZWAVQU-LBPRGKRZSA-N	0	0	289.423	4.272	20	30		CIEDRN
C=CCC1(C(=O)N(C)Cc2cc(Cl)ccc2F)CCC1	ZINC000347228652	527038276	/nfs/dbraw/zinc/03/82/76/527038276.db2.gz	MSVMMQPOKGHPKF-UHFFFAOYSA-N	0	0	295.785	4.184	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@@]3(C)[C@@H](C2)C3(F)F)CCCCC1	ZINC000334698700	527047182	/nfs/dbraw/zinc/04/71/82/527047182.db2.gz	YKCQDXHQLUCEQM-HIFRSBDPSA-N	0	0	297.389	4.017	20	30		CIEDRN
C=CCCC(=O)N1CCC(c2c(C)[nH]c3ccccc32)CC1	ZINC000102335851	527068641	/nfs/dbraw/zinc/06/86/41/527068641.db2.gz	DJGXAISCGJUBBL-UHFFFAOYSA-N	0	0	296.414	4.149	20	30		CIEDRN
C=CCCC1(C(=O)N[C@H](C)c2cc(C)sc2C)CC1	ZINC000354398077	527094469	/nfs/dbraw/zinc/09/44/69/527094469.db2.gz	YYCKAUCEJCNFCT-GFCCVEGCSA-N	0	0	277.433	4.289	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cccc(-c3ncc(C)o3)c2)CC1	ZINC000355836595	527096835	/nfs/dbraw/zinc/09/68/35/527096835.db2.gz	XJTLJRFBHJTODJ-UHFFFAOYSA-N	0	0	296.370	4.335	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc3nn(C(C)C)cc3c2)CC1	ZINC000356116646	527097547	/nfs/dbraw/zinc/09/75/47/527097547.db2.gz	VWPQLUDRAHBZDF-UHFFFAOYSA-N	0	0	297.402	4.302	20	30		CIEDRN
C=CCCCC(=O)N[C@H]1CCCc2sc(Cl)cc21	ZINC000344630682	527110812	/nfs/dbraw/zinc/11/08/12/527110812.db2.gz	QKOGTSLMHKDNBO-NSHDSACASA-N	0	0	283.824	4.251	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)c2ccoc2Cl)CCCC1(C)C	ZINC000347476286	527117518	/nfs/dbraw/zinc/11/75/18/527117518.db2.gz	ZATWGWNVYIREHY-LBPRGKRZSA-N	0	0	281.783	4.140	20	30		CIEDRN
CC(=O)c1ccc(C#N)cc1NC1CC(c2ccccc2)C1	ZINC000302090609	527230257	/nfs/dbraw/zinc/23/02/57/527230257.db2.gz	GUCFEWGUBOICHA-UHFFFAOYSA-N	0	0	290.366	4.119	20	30		CIEDRN
C=CCCCSCC(=O)c1cc(C)n(CC)c1C	ZINC000344553701	527247767	/nfs/dbraw/zinc/24/77/67/527247767.db2.gz	HRXVBENRHGHTKX-UHFFFAOYSA-N	0	0	265.422	4.007	20	30		CIEDRN
C=CCC[C@H](NC(=O)c1cc(C(C)C)on1)c1ccccc1	ZINC000343355355	527481712	/nfs/dbraw/zinc/48/17/12/527481712.db2.gz	KJIABHSADBIDDB-HNNXBMFYSA-N	0	0	298.386	4.235	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1cc2[nH]ccc2cc1C	ZINC000336094489	527602071	/nfs/dbraw/zinc/60/20/71/527602071.db2.gz	SIUREPUEDSHNBU-AWEZNQCLSA-N	0	0	283.375	4.049	20	30		CIEDRN
CC(C)(C)CCC(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000352206874	527652604	/nfs/dbraw/zinc/65/26/04/527652604.db2.gz	PUNMZURBOXXVCF-MRXNPFEDSA-N	0	0	286.419	4.364	20	30		CIEDRN
CC(C)(C)CCC(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000352206873	527652799	/nfs/dbraw/zinc/65/27/99/527652799.db2.gz	PUNMZURBOXXVCF-INIZCTEOSA-N	0	0	286.419	4.364	20	30		CIEDRN
CC(C)(C)CN(CCC#N)Cc1coc2ccccc12	ZINC000353420184	527681485	/nfs/dbraw/zinc/68/14/85/527681485.db2.gz	OGVJAZYSDKUFLV-UHFFFAOYSA-N	0	0	270.376	4.195	20	30		CIEDRN
CC1(C)C[C@]1(C#N)NC(=O)[C@@H]1CCC[C@@H]2CCCC[C@@H]12	ZINC000330150445	527769011	/nfs/dbraw/zinc/76/90/11/527769011.db2.gz	KTXZSKULPHKXSH-ZOMKSWQUSA-N	0	0	274.408	4.242	20	30		CIEDRN
CC(C)CC[C@@H](NC(=O)[C@H](C)C#N)c1ccc(Cl)cc1	ZINC000347085535	527809141	/nfs/dbraw/zinc/80/91/41/527809141.db2.gz	ZSHQSZBBOIUUBQ-IUODEOHRSA-N	0	0	292.810	4.093	20	30		CIEDRN
CC1(CNC(=O)Cc2ccc3n[nH]cc3c2)CCCCCC1	ZINC000330027926	527899322	/nfs/dbraw/zinc/89/93/22/527899322.db2.gz	NUZGZDSCHBRTLZ-UHFFFAOYSA-N	0	0	299.418	4.422	20	30		CIEDRN
CC(C)[C@]1(C)C[C@@H]1C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000352173754	527970568	/nfs/dbraw/zinc/97/05/68/527970568.db2.gz	FTECBWPJGHHBGG-LMMKCTJWSA-N	0	0	298.430	4.220	20	30		CIEDRN
CC1=C(C(=O)N[C@H](CCCC#N)c2ccccc2)CCC1	ZINC000352205426	528079962	/nfs/dbraw/zinc/07/99/62/528079962.db2.gz	FXEJGIVGWWMZEG-QGZVFWFLSA-N	0	0	282.387	4.038	20	30		CIEDRN
CC(C)c1ccccc1N(C)C(=O)c1cc(C#N)cs1	ZINC000335996488	528190622	/nfs/dbraw/zinc/19/06/22/528190622.db2.gz	VZJUVMBPPXUVBT-UHFFFAOYSA-N	0	0	284.384	4.020	20	30		CIEDRN
CC(C)Oc1ccccc1CSCC1(C#N)CC1	ZINC000344459988	528257031	/nfs/dbraw/zinc/25/70/31/528257031.db2.gz	KOKKHIBXBXYZJY-UHFFFAOYSA-N	0	0	261.390	4.011	20	30		CIEDRN
CC(C)c1nc(NCCCCC#N)cc(C(C)(C)C)n1	ZINC000192304123	528292943	/nfs/dbraw/zinc/29/29/43/528292943.db2.gz	OGOXERVPZJEBSA-UHFFFAOYSA-N	0	0	274.412	4.003	20	30		CIEDRN
CC(C)C[C@H](C)C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000352217421	528454430	/nfs/dbraw/zinc/45/44/30/528454430.db2.gz	JQXUBJSOBVWKRB-RDJZCZTQSA-N	0	0	286.419	4.220	20	30		CIEDRN
CCC(C)(C)CC(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000352179784	528498530	/nfs/dbraw/zinc/49/85/30/528498530.db2.gz	BWYXFOCBSNMCNJ-MRXNPFEDSA-N	0	0	286.419	4.364	20	30		CIEDRN
CCN(C[C@H](C)C#N)C(=O)c1cscc1-c1ccccc1	ZINC000353433036	528704318	/nfs/dbraw/zinc/70/43/18/528704318.db2.gz	SUVJFUJGXIESFV-CYBMUJFWSA-N	0	0	298.411	4.037	20	30		CIEDRN
CCCC[C@@H](CC)CC(=O)N(CCC#N)Cc1ccco1	ZINC000343757730	528771100	/nfs/dbraw/zinc/77/11/00/528771100.db2.gz	GABGEWHCCVPEHR-OAHLLOKOSA-N	0	0	290.407	4.128	20	30		CIEDRN
CCN(Cc1cccs1)c1ccc2cc(C#N)ccc2n1	ZINC000301977995	528854696	/nfs/dbraw/zinc/85/46/96/528854696.db2.gz	NPEMHDWVHDUMMI-UHFFFAOYSA-N	0	0	293.395	4.194	20	30		CIEDRN
CC1(C)CC(C(=O)Nc2csc(-c3ccccn3)n2)C1	ZINC000329083287	528881866	/nfs/dbraw/zinc/88/18/66/528881866.db2.gz	FCVHWZNRJUTCBN-UHFFFAOYSA-N	0	0	287.388	4.229	20	30		CIEDRN
CCSCC[C@@H](C)N(C)c1ccc2cc(C#N)ccc2n1	ZINC000301972029	529184760	/nfs/dbraw/zinc/18/47/60/529184760.db2.gz	HCSINSVNYYRXPW-CYBMUJFWSA-N	0	0	299.443	4.074	20	30		CIEDRN
CCS[C@H]1CCC[C@@H](Nc2ccc(Cl)c(C#N)n2)C1	ZINC000301572667	529229126	/nfs/dbraw/zinc/22/91/26/529229126.db2.gz	XJLYKYIQNUSIAS-MNOVXSKESA-N	0	0	295.839	4.083	20	30		CIEDRN
CC[C@@H](C)n1ncc(N[C@@H]2CCc3ccc(C#N)cc32)c1C	ZINC000353619668	529444013	/nfs/dbraw/zinc/44/40/13/529444013.db2.gz	CXEGTVCPGGUYMG-SJKOYZFVSA-N	0	0	294.402	4.134	20	30		CIEDRN
CCc1[nH]nc(NC(=O)C[C@@H]2CCc3ccccc3C2)c1C	ZINC000329748481	529469619	/nfs/dbraw/zinc/46/96/19/529469619.db2.gz	FKDVAUIQQCVDMU-CYBMUJFWSA-N	0	0	297.402	4.064	20	30		CIEDRN
CCc1cc(C2CC2)nc(NC(=O)[C@@H]2CCC(C)(C)C2)n1	ZINC000329612970	529526770	/nfs/dbraw/zinc/52/67/70/529526770.db2.gz	CORCORJNFASGMQ-GFCCVEGCSA-N	0	0	287.407	4.331	20	30		CIEDRN
CC[C@H](NC(=O)[C@@H]1CCC[C@@H]2CCCC[C@H]12)c1ncc[nH]1	ZINC000329096038	529581344	/nfs/dbraw/zinc/58/13/44/529581344.db2.gz	LBLHMSGUPYPBDN-XQLPTFJDSA-N	0	0	289.423	4.424	20	30		CIEDRN
CCc1cnc(CNC(=O)[C@@H]2CCC[C@@H]3CCCC[C@H]23)o1	ZINC000329080340	529637631	/nfs/dbraw/zinc/63/76/31/529637631.db2.gz	COBOQXCSOVZBMY-AEGPPILISA-N	0	0	290.407	4.300	20	30		CIEDRN
CC(C)CC(C)(C)C(=O)Nc1cc(C#N)c2ccccc2n1	ZINC000573405249	334935461	/nfs/dbraw/zinc/93/54/61/334935461.db2.gz	VWEBDLRTFJTPMU-UHFFFAOYSA-N	0	0	295.386	4.117	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)CC1(C)CCCC1	ZINC000573519938	334944153	/nfs/dbraw/zinc/94/41/53/334944153.db2.gz	HFQNMCADYOOHGJ-UHFFFAOYSA-N	0	0	289.394	4.311	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H](Cc2ccc(C)cc2)C1	ZINC000573535735	334945091	/nfs/dbraw/zinc/94/50/91/334945091.db2.gz	BIIQVFAWFWKFTM-HKUYNNGSSA-N	0	0	299.458	4.378	20	30		CIEDRN
Cc1cc(C#N)nc(Sc2ccc(Cl)c(Cl)c2)n1	ZINC000231937414	260232528	/nfs/dbraw/zinc/23/25/28/260232528.db2.gz	AXSMPMYAKDASQP-UHFFFAOYSA-N	0	0	296.182	4.115	20	30		CIEDRN
C=CCC1(c2nc(-c3cnc4ccsc4c3)no2)CCC1	ZINC000573724714	334961452	/nfs/dbraw/zinc/96/14/52/334961452.db2.gz	KNPYEELPBPAVIZ-UHFFFAOYSA-N	0	0	297.383	4.344	20	30		CIEDRN
CC#CCCCc1nc(-c2ccc3nc(C)sc3c2)no1	ZINC000573763254	334964299	/nfs/dbraw/zinc/96/42/99/334964299.db2.gz	ZAWVACOQJBEJFU-UHFFFAOYSA-N	0	0	297.383	4.001	20	30		CIEDRN
N#Cc1cccc(CSc2cccc(F)c2)c1F	ZINC000223552269	260324385	/nfs/dbraw/zinc/32/43/85/260324385.db2.gz	CQGMKFRXHLUPCU-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
C=CCn1cccc1-c1nc([C@H](C)c2ccccc2C)no1	ZINC000573841318	334970670	/nfs/dbraw/zinc/97/06/70/334970670.db2.gz	BTXDWKSHQYBSJE-CQSZACIVSA-N	0	0	293.370	4.184	20	30		CIEDRN
CCC[C@@H](C#N)NC(=O)c1cc(C)c(-c2ccccc2)s1	ZINC000573860060	334972265	/nfs/dbraw/zinc/97/22/65/334972265.db2.gz	LBNBWHCDWNUUCR-AWEZNQCLSA-N	0	0	298.411	4.146	20	30		CIEDRN
Cc1sc(NC(=O)[C@@H]2CCC(C)=C(C)C2)c(C#N)c1C	ZINC000573923947	334977512	/nfs/dbraw/zinc/97/75/12/334977512.db2.gz	UPGHZQBBNKOEGA-CYBMUJFWSA-N	0	0	288.416	4.312	20	30		CIEDRN
C[C@@H]1CSC(SCc2ccccc2C(C)(C)C#N)=N1	ZINC000155747360	261106585	/nfs/dbraw/zinc/10/65/85/261106585.db2.gz	RFDGQEIPOWLARN-LLVKDONJSA-N	0	0	290.457	4.212	20	30		CIEDRN
C=CCCCNC(=O)N(C1CC1)C1CCC(CC)CC1	ZINC000448371999	261132235	/nfs/dbraw/zinc/13/22/35/261132235.db2.gz	CKUXRJQKRXZLAR-UHFFFAOYSA-N	0	0	278.440	4.095	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1ccc(OC(C)C)cc1C	ZINC000574452102	335020700	/nfs/dbraw/zinc/02/07/00/335020700.db2.gz	ZNABLDSFCUIBPQ-AWEZNQCLSA-N	0	0	290.407	4.258	20	30		CIEDRN
N#Cc1c(N[C@H]2CCCC(F)(F)C2)cccc1C(F)F	ZINC000574651292	335037483	/nfs/dbraw/zinc/03/74/83/335037483.db2.gz	KJPHUAJCNYIPNL-VIFPVBQESA-N	0	0	286.272	4.486	20	30		CIEDRN
C[C@@H](C#N)CN(C(=O)Nc1csc2ccccc12)C1CC1	ZINC000352835327	533128138	/nfs/dbraw/zinc/12/81/38/533128138.db2.gz	XOAAVHRZBNXKJZ-NSHDSACASA-N	0	0	299.399	4.057	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N(C)[C@H](C)c1ccc(Cl)cc1	ZINC000116973655	260019407	/nfs/dbraw/zinc/01/94/07/260019407.db2.gz	OBMPJBUHTNRDLT-NWDGAFQWSA-N	0	0	280.799	4.007	20	30		CIEDRN
CS[C@@H]1CCC[C@H](Nc2cc(Cl)ccc2C#N)C1	ZINC000227652659	260031887	/nfs/dbraw/zinc/03/18/87/260031887.db2.gz	PEMHAJWELLSTPP-QWHCGFSZSA-N	0	0	280.824	4.298	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H](C)c2ccc(Cl)s2)CCC1	ZINC000188492096	262300705	/nfs/dbraw/zinc/30/07/05/262300705.db2.gz	BWTWEBRTYDZAFB-JTQLQIEISA-N	0	0	283.824	4.325	20	30		CIEDRN
C=C(C)[C@H](NCc1cnc(C)s1)c1ccc(F)c(F)c1	ZINC000187369298	260033467	/nfs/dbraw/zinc/03/34/67/260033467.db2.gz	WBMHGIDNRIQSAY-HNNXBMFYSA-N	0	0	294.370	4.137	20	30		CIEDRN
N#Cc1cccc(COc2cccc(Cl)c2Cl)c1	ZINC000021013353	262373701	/nfs/dbraw/zinc/37/37/01/262373701.db2.gz	MESQDQDXWNZVBK-UHFFFAOYSA-N	0	0	278.138	4.444	20	30		CIEDRN
C=CCC(C)(C)c1noc(CC2CC(OC(C)(C)C)C2)n1	ZINC000575064867	335061161	/nfs/dbraw/zinc/06/11/61/335061161.db2.gz	RKBGTRDSDJCZKW-UHFFFAOYSA-N	0	0	292.423	4.060	20	30		CIEDRN
CCCCCc1ccc(NC(=O)NCCCCC#N)cc1	ZINC000171362565	335063354	/nfs/dbraw/zinc/06/33/54/335063354.db2.gz	AQNZKJLEVRCXLE-UHFFFAOYSA-N	0	0	287.407	4.235	20	30		CIEDRN
COc1cc(C#N)ccc1CNc1ccc(F)c(C2CC2)c1	ZINC000352613080	533496800	/nfs/dbraw/zinc/49/68/00/533496800.db2.gz	TWQDUVPMPAPHOR-UHFFFAOYSA-N	0	0	296.345	4.195	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)N(CCC)C2CC2)c1	ZINC000171401376	335064503	/nfs/dbraw/zinc/06/45/03/335064503.db2.gz	HDBHWBRJRXBCMX-UHFFFAOYSA-N	0	0	288.391	4.048	20	30		CIEDRN
N#Cc1cccc(/C=C\c2nc3ccccc3s2)c1	ZINC000198785167	130748216	/nfs/dbraw/zinc/74/82/16/130748216.db2.gz	YWUNBDQSHYSSJP-HJWRWDBZSA-N	0	0	262.337	4.338	20	30		CIEDRN
C=CCCC(=O)N[C@@H](C)c1cc(F)c(Cl)cc1Cl	ZINC000171422552	335065553	/nfs/dbraw/zinc/06/55/53/335065553.db2.gz	GHOALAWNHCUPNX-QMMMGPOBSA-N	0	0	290.165	4.276	20	30		CIEDRN
C=CCNc1nnc(SCc2ccccc2Cl)s1	ZINC000005784990	170140316	/nfs/dbraw/zinc/14/03/16/170140316.db2.gz	FWSXGXZQMYTONA-UHFFFAOYSA-N	0	0	297.836	4.082	20	30		CIEDRN
C=CCNc1nnc(SCc2cccc(Cl)c2)s1	ZINC000005784984	170140458	/nfs/dbraw/zinc/14/04/58/170140458.db2.gz	CYXCZHSCDOIABQ-UHFFFAOYSA-N	0	0	297.836	4.082	20	30		CIEDRN
CC[C@H](C)[C@H](C(=O)Nc1cccc(C#N)c1)c1ccccc1	ZINC000007265453	170275381	/nfs/dbraw/zinc/27/53/81/170275381.db2.gz	XQKWYLLHJGCPTQ-KSSFIOAISA-N	0	0	292.382	4.327	20	30		CIEDRN
N#Cc1ccsc1NC(=O)c1ccc(Cl)c(Cl)c1	ZINC000007796818	170303696	/nfs/dbraw/zinc/30/36/96/170303696.db2.gz	BCYGTDXZMRTRJU-UHFFFAOYSA-N	0	0	297.166	4.179	20	30		CIEDRN
C=CCNc1nc(-c2oc3ccccc3c2C)cs1	ZINC000007843424	170304588	/nfs/dbraw/zinc/30/45/88/170304588.db2.gz	MEVFWWJVRQXEFV-UHFFFAOYSA-N	0	0	270.357	4.463	20	30		CIEDRN
Cc1cc(C(=O)Nc2ccc(CC#N)cc2)c(C)n1C(C)C	ZINC000008126343	170320122	/nfs/dbraw/zinc/32/01/22/170320122.db2.gz	CJSRKPRWWKGBEP-UHFFFAOYSA-N	0	0	295.386	4.004	20	30		CIEDRN
CCC[C@H](C(=O)Nc1ccc(CC#N)cc1)c1ccccc1	ZINC000008126056	170320276	/nfs/dbraw/zinc/32/02/76/170320276.db2.gz	DIMHWNXDLZSLGL-SFHVURJKSA-N	0	0	292.382	4.275	20	30		CIEDRN
CC(C)c1ccccc1NC=C1C(=O)CC(C)(C)CC1=O	ZINC000010120804	170398217	/nfs/dbraw/zinc/39/82/17/170398217.db2.gz	VETHCSDVRHMUIH-UHFFFAOYSA-N	0	0	285.387	4.064	20	30		CIEDRN
N#Cc1ccc(COc2c(Cl)cccc2Cl)cc1	ZINC000011834306	170445596	/nfs/dbraw/zinc/44/55/96/170445596.db2.gz	KVQLLKZQOJYQQD-UHFFFAOYSA-N	0	0	278.138	4.444	20	30		CIEDRN
CC[C@@H](C)[C@@H](C(=O)Nc1ccc(C#N)cc1)c1ccccc1	ZINC000014908343	170648070	/nfs/dbraw/zinc/64/80/70/170648070.db2.gz	RCUSTUHAOYMIJM-RDTXWAMCSA-N	0	0	292.382	4.327	20	30		CIEDRN
C#Cc1cccc(NCc2ccccc2Br)c1	ZINC000019877029	170905784	/nfs/dbraw/zinc/90/57/84/170905784.db2.gz	LZYBEUWQUWQWGA-UHFFFAOYSA-N	0	0	286.172	4.043	20	30		CIEDRN
N#Cc1ccc(CNc2ccc(C(F)(F)F)cc2)cc1	ZINC000019909883	170921178	/nfs/dbraw/zinc/92/11/78/170921178.db2.gz	NZBUJJWLLWNLEL-UHFFFAOYSA-N	0	0	276.261	4.189	20	30		CIEDRN
C[C@@H](Nc1ccc(C#N)cc1)c1cccc(Cl)c1	ZINC000019951498	170939684	/nfs/dbraw/zinc/93/96/84/170939684.db2.gz	XJMVSFCWDSACDB-LLVKDONJSA-N	0	0	256.736	4.385	20	30		CIEDRN
CC(C)c1ccc(CNc2ccc(OCC#N)cc2)cc1	ZINC000020126439	171010184	/nfs/dbraw/zinc/01/01/84/171010184.db2.gz	SGWADOYJLYNDBV-UHFFFAOYSA-N	0	0	280.371	4.324	20	30		CIEDRN
N#Cc1cccc(OCc2cccc(C(F)(F)F)c2)c1	ZINC000020297990	171138097	/nfs/dbraw/zinc/13/80/97/171138097.db2.gz	CEIIWXOUNDYBRY-UHFFFAOYSA-N	0	0	277.245	4.156	20	30		CIEDRN
CC(C)Sc1ccccc1C(=O)Nc1ccc(C#N)cc1	ZINC000020612857	171267399	/nfs/dbraw/zinc/26/73/99/171267399.db2.gz	ZKSZTZZHLYRYKY-UHFFFAOYSA-N	0	0	296.395	4.311	20	30		CIEDRN
COc1ccc2cc(CNc3ccc(C#N)cc3)ccc2c1	ZINC000020828549	171275047	/nfs/dbraw/zinc/27/50/47/171275047.db2.gz	RMUJGAZKZYNJSN-UHFFFAOYSA-N	0	0	288.350	4.332	20	30		CIEDRN
Cc1cc(Cl)ccc1OCc1ccccc1C#N	ZINC000021518610	171314830	/nfs/dbraw/zinc/31/48/30/171314830.db2.gz	HNEPPDRMZGFEAH-UHFFFAOYSA-N	0	0	257.720	4.099	20	30		CIEDRN
C#Cc1cccc(NC(=O)c2ccc(Cl)c(Cl)c2)c1	ZINC000022408939	171387036	/nfs/dbraw/zinc/38/70/36/171387036.db2.gz	STWANXDWTZWIMM-UHFFFAOYSA-N	0	0	290.149	4.227	20	30		CIEDRN
N#Cc1c(F)cccc1NCc1ccc(Cl)s1	ZINC000026727198	171496778	/nfs/dbraw/zinc/49/67/78/171496778.db2.gz	FDVZYIGFMHMKKY-UHFFFAOYSA-N	0	0	266.728	4.024	20	30		CIEDRN
N#Cc1cccc(OCCCOc2ccc(Cl)cc2)c1	ZINC000034652312	171847797	/nfs/dbraw/zinc/84/77/97/171847797.db2.gz	RHJKMTLEKIKAIH-UHFFFAOYSA-N	0	0	287.746	4.060	20	30		CIEDRN
C[C@H](Nc1ccc(CC#N)cc1)c1ccc(F)cc1	ZINC000035019457	171937483	/nfs/dbraw/zinc/93/74/83/171937483.db2.gz	XTXQNTHUOMLCRP-LBPRGKRZSA-N	0	0	254.308	4.065	20	30		CIEDRN
Cc1nc2ccc(NCc3ccc(C#N)cc3)cc2s1	ZINC000035019798	171938441	/nfs/dbraw/zinc/93/84/41/171938441.db2.gz	LLPYMXQXAHLYTR-UHFFFAOYSA-N	0	0	279.368	4.089	20	30		CIEDRN
N#Cc1ccc(F)c(CSc2cc(F)ccc2F)c1	ZINC000035122047	171992214	/nfs/dbraw/zinc/99/22/14/171992214.db2.gz	PIBUXCNJSAWFBA-UHFFFAOYSA-N	0	0	279.286	4.268	20	30		CIEDRN
N#Cc1ccc(F)c(CNc2ccc3ccccc3c2)c1	ZINC000035206699	172051023	/nfs/dbraw/zinc/05/10/23/172051023.db2.gz	HPWZBGJLUBFNIB-UHFFFAOYSA-N	0	0	276.314	4.463	20	30		CIEDRN
C[C@H](CCc1ccco1)Nc1ccc(C#N)c(Cl)c1	ZINC000035452059	172205586	/nfs/dbraw/zinc/20/55/86/172205586.db2.gz	BZYMHTJWFIIDIR-LLVKDONJSA-N	0	0	274.751	4.238	20	30		CIEDRN
C[C@@H](Nc1ccc(C#N)c(C(F)(F)F)c1)c1ccccn1	ZINC000035695168	172363863	/nfs/dbraw/zinc/36/38/63/172363863.db2.gz	UNLFYZYIHYLSGC-SNVBAGLBSA-N	0	0	291.276	4.145	20	30		CIEDRN
N#Cc1ccc(F)c(CSc2ccc(F)c(F)c2)c1	ZINC000037375160	173164055	/nfs/dbraw/zinc/16/40/55/173164055.db2.gz	RWHMBLMSCYIABT-UHFFFAOYSA-N	0	0	279.286	4.268	20	30		CIEDRN
Cc1ccc(CNc2ccc(C#N)c(Cl)c2)s1	ZINC000037393165	173173564	/nfs/dbraw/zinc/17/35/64/173173564.db2.gz	BCGIVYIBOVJPRC-UHFFFAOYSA-N	0	0	262.765	4.194	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cc(C(C)=O)ccc1Cl	ZINC000188010762	260069702	/nfs/dbraw/zinc/06/97/02/260069702.db2.gz	KHVGBXZTBARHFH-HNNXBMFYSA-N	0	0	279.767	4.083	20	30		CIEDRN
Cc1ccc(C(C)C)cc1Oc1ccc(C#N)cn1	ZINC000037981464	173941963	/nfs/dbraw/zinc/94/19/63/173941963.db2.gz	XAWGRXZHCQHHGT-UHFFFAOYSA-N	0	0	252.317	4.177	20	30		CIEDRN
Cc1cc(C#N)ccc1Oc1ccc([N+](=O)[O-])cc1Cl	ZINC000038080992	174090395	/nfs/dbraw/zinc/09/03/95/174090395.db2.gz	NPPFYBFYVSOCRT-UHFFFAOYSA-N	0	0	288.690	4.221	20	30		CIEDRN
N#CC1(C(=O)Nc2cc(Cl)ccc2Cl)CCCC1	ZINC000044292894	175160307	/nfs/dbraw/zinc/16/03/07/175160307.db2.gz	KAYVRFFNXVLYDK-UHFFFAOYSA-N	0	0	283.158	4.016	20	30		CIEDRN
Cc1ccccc1CNc1c(C#N)cnc2ccccc21	ZINC000048265890	175424122	/nfs/dbraw/zinc/42/41/22/175424122.db2.gz	SMEQRGMWLDNTMR-UHFFFAOYSA-N	0	0	273.339	4.027	20	30		CIEDRN
CC(C)Oc1ccc(Nc2cccc(F)c2C#N)cc1	ZINC000071601492	176228725	/nfs/dbraw/zinc/22/87/25/176228725.db2.gz	ZYBLHJDEMOWBSM-UHFFFAOYSA-N	0	0	270.307	4.228	20	30		CIEDRN
N#Cc1c(F)cccc1Nc1ccccc1C(F)(F)F	ZINC000071630748	176236526	/nfs/dbraw/zinc/23/65/26/176236526.db2.gz	QOIRYJYEQGNDNV-UHFFFAOYSA-N	0	0	280.224	4.460	20	30		CIEDRN
C=CCCC(=O)N[C@H](CCCC)c1ccc(OC)cc1	ZINC000078483880	177345861	/nfs/dbraw/zinc/34/58/61/177345861.db2.gz	BMOGVCYKFBTFKG-MRXNPFEDSA-N	0	0	275.392	4.009	20	30		CIEDRN
C[C@H]1CCCN(c2ccc(C#N)c(C(F)(F)F)c2)CC1	ZINC000078535518	177351251	/nfs/dbraw/zinc/35/12/51/177351251.db2.gz	LEJCDNSQSURREW-NSHDSACASA-N	0	0	282.309	4.203	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)c1cc(C)oc1C	ZINC000078651785	177366742	/nfs/dbraw/zinc/36/67/42/177366742.db2.gz	HERTZQRZIIHILC-UHFFFAOYSA-N	0	0	275.392	4.105	20	30		CIEDRN
CC(C)CC[C@@H](NC(=O)c1ccc(C#N)cc1)C(C)(C)C	ZINC000078733040	177378571	/nfs/dbraw/zinc/37/85/71/177378571.db2.gz	HQSCTGSKMNBBCW-MRXNPFEDSA-N	0	0	286.419	4.139	20	30		CIEDRN
C[C@H](Nc1ccc(C#N)c(Cl)c1)c1cccc(C#N)c1	ZINC000037253479	260079041	/nfs/dbraw/zinc/07/90/41/260079041.db2.gz	ACXCPEUSJLEZNO-NSHDSACASA-N	0	0	281.746	4.256	20	30		CIEDRN
N#C[C@@H]1CC[C@@H](Nc2ccc3nc(C(F)F)sc3c2)C1	ZINC000334583067	225017147	/nfs/dbraw/zinc/01/71/47/225017147.db2.gz	RDIAXRAXKDLORY-RKDXNWHRSA-N	0	0	293.342	4.338	20	30		CIEDRN
C[C@H](S[C@@H](C)c1ccc(C#N)cc1)c1nc(C2CC2)no1	ZINC000118444178	225054525	/nfs/dbraw/zinc/05/45/25/225054525.db2.gz	FBLGMCPJWMNBLT-QWRGUYRKSA-N	0	0	299.399	4.374	20	30		CIEDRN
N#CC1(CSCc2c(Cl)ccc3cccnc32)CC1	ZINC000344465812	225067288	/nfs/dbraw/zinc/06/72/88/225067288.db2.gz	PWDGTFJBPQLOHR-UHFFFAOYSA-N	0	0	288.803	4.425	20	30		CIEDRN
C[C@H](SCc1ccc(F)cn1)c1ccc(C#N)cc1	ZINC000344788116	225168912	/nfs/dbraw/zinc/16/89/12/225168912.db2.gz	DJNQRCUFUHBPRX-NSHDSACASA-N	0	0	272.348	4.087	20	30		CIEDRN
N#CC1(CSCc2ccc(F)c(Cl)c2)CC1	ZINC000344830121	225174792	/nfs/dbraw/zinc/17/47/92/225174792.db2.gz	QZOOAPKBVDAZMO-UHFFFAOYSA-N	0	0	255.745	4.016	20	30		CIEDRN
Cc1cc(C(=O)CSc2cccc(C#N)c2)c(C)s1	ZINC000344827506	225175182	/nfs/dbraw/zinc/17/51/82/225175182.db2.gz	OYOVMGWDYLCKBN-UHFFFAOYSA-N	0	0	287.409	4.212	20	30		CIEDRN
C[C@H](Sc1ccc([N+](=O)[O-])cc1)c1cccc(C#N)c1	ZINC000190907944	225185774	/nfs/dbraw/zinc/18/57/74/225185774.db2.gz	LRPWFQCXHLSSCK-NSHDSACASA-N	0	0	284.340	4.320	20	30		CIEDRN
N#Cc1cc(NC(=O)c2sccc2Cl)ccc1Cl	ZINC000334978581	225383183	/nfs/dbraw/zinc/38/31/83/225383183.db2.gz	QWBMORLUYKGUBQ-UHFFFAOYSA-N	0	0	297.166	4.179	20	30		CIEDRN
N#CC1(C(=O)N[C@H]2C[C@H](c3ccc(F)cc3)C2)CCCC1	ZINC000329252075	227384309	/nfs/dbraw/zinc/38/43/09/227384309.db2.gz	VFIQKUFWCFJNAG-CTYIDZIISA-N	0	0	286.350	4.112	20	30		CIEDRN
C[C@H](CC#N)NC(=O)c1cc(-c2ccccc2)ccc1Cl	ZINC000171768583	335078225	/nfs/dbraw/zinc/07/82/25/335078225.db2.gz	NAQUWHCFXHVICE-GFCCVEGCSA-N	0	0	298.773	4.039	20	30		CIEDRN
Cc1sc(NC(=O)c2ccoc2C(C)C)c(C#N)c1C	ZINC000335707746	226722365	/nfs/dbraw/zinc/72/23/65/226722365.db2.gz	JUITUYPARXIYJU-UHFFFAOYSA-N	0	0	288.372	4.205	20	30		CIEDRN
Cc1ccc(C#N)cc1NCc1cnc(C(C)C)s1	ZINC000354870823	227188230	/nfs/dbraw/zinc/18/82/30/227188230.db2.gz	WQDVAEKDJIGCBF-UHFFFAOYSA-N	0	0	271.389	4.059	20	30		CIEDRN
C=C(C)CN(C)C(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000180017920	260087557	/nfs/dbraw/zinc/08/75/57/260087557.db2.gz	YVBOCSLCTBBKKK-UHFFFAOYSA-N	0	0	280.371	4.393	20	30		CIEDRN
Cc1nnc(NC(=O)[C@@H]2CCC[C@@H]3CCCC[C@@H]23)s1	ZINC000329037313	227267775	/nfs/dbraw/zinc/26/77/75/227267775.db2.gz	ZFBSUPSFCJHDAY-QJPTWQEYSA-N	0	0	279.409	4.041	20	30		CIEDRN
N#Cc1ccc(NC2CC2)c(NC(=O)[C@H]2CC23CCCC3)c1	ZINC000329086840	227288982	/nfs/dbraw/zinc/28/89/82/227288982.db2.gz	HARVIXRLDGKZEK-CQSZACIVSA-N	0	0	295.386	4.301	20	30		CIEDRN
N#Cc1cccc(NCc2cscc2C(F)(F)F)c1	ZINC000352839531	227315088	/nfs/dbraw/zinc/31/50/88/227315088.db2.gz	MVJDPUQXDCNQKS-UHFFFAOYSA-N	0	0	282.290	4.251	20	30		CIEDRN
C[C@@H]1C[C@@H](CC(=O)Nc2nncn2C2CC2)CC(C)(C)C1	ZINC000329127912	227316706	/nfs/dbraw/zinc/31/67/06/227316706.db2.gz	VCDHWKZLOSPBLH-NEPJUHHUSA-N	0	0	290.411	4.054	20	30		CIEDRN
C[C@@H]1CC(=O)N[C@H](C(=O)N[C@H]2CCCCC23CCCC3)C1	ZINC000329138463	227322032	/nfs/dbraw/zinc/32/20/32/227322032.db2.gz	DUWMLJPPCCPXEG-IHRRRGAJSA-N	0	0	292.423	4.201	20	30		CIEDRN
C[C@@H]1CC(=O)N[C@H](C(=O)N[C@@H]2CCCCC23CCCC3)C1	ZINC000329138464	227322505	/nfs/dbraw/zinc/32/25/05/227322505.db2.gz	DUWMLJPPCCPXEG-MELADBBJSA-N	0	0	292.423	4.201	20	30		CIEDRN
Cc1ccc(NC(=O)[C@H]2CCC(=O)[C@@H](C)C2)c2cccnc12	ZINC000329153581	227329939	/nfs/dbraw/zinc/32/99/39/227329939.db2.gz	AFLXWFQYLNQTMU-STQMWFEESA-N	0	0	296.370	4.137	20	30		CIEDRN
Cc1nc(C)c(CNC(=O)CC2CCCCCC2)o1	ZINC000329168849	227336700	/nfs/dbraw/zinc/33/67/00/227336700.db2.gz	JGRHZNACLGMBPS-UHFFFAOYSA-N	0	0	264.369	4.108	20	30		CIEDRN
C[C@H](NC(=O)[C@@H]1CCC[C@@H]2CCCC[C@H]12)c1ccon1	ZINC000329193391	227346310	/nfs/dbraw/zinc/34/63/10/227346310.db2.gz	SKQCELZNPKHISW-XDQVBPFNSA-N	0	0	276.380	4.299	20	30		CIEDRN
O=C(NCc1cc(-c2ccccc2)on1)[C@H]1CC12CCCC2	ZINC000329271170	227397677	/nfs/dbraw/zinc/39/76/77/227397677.db2.gz	HKMOEULTBCBJIF-OAHLLOKOSA-N	0	0	296.370	4.378	20	30		CIEDRN
N#Cc1cccnc1N(Cc1ccccc1)Cc1ccccc1	ZINC000301056853	227432197	/nfs/dbraw/zinc/43/21/97/227432197.db2.gz	HKDVYXCYJNHDEB-UHFFFAOYSA-N	0	0	299.377	4.160	20	30		CIEDRN
N#Cc1c(F)cccc1N[C@@H]1CCCOc2ccccc21	ZINC000301129623	227457529	/nfs/dbraw/zinc/45/75/29/227457529.db2.gz	QIHPIYJQQLLNQK-OAHLLOKOSA-N	0	0	282.318	4.023	20	30		CIEDRN
N#Cc1c(F)cccc1N1CCC[C@H]1c1cccc(F)c1	ZINC000301140526	227460607	/nfs/dbraw/zinc/46/06/07/227460607.db2.gz	HTXVGHGMLWOTRC-INIZCTEOSA-N	0	0	284.309	4.178	20	30		CIEDRN
Cc1ccc(Cl)cc1Oc1ccc(C#N)cc1[N+](=O)[O-]	ZINC000301461133	227546138	/nfs/dbraw/zinc/54/61/38/227546138.db2.gz	IZOGMQPVWIBIQY-UHFFFAOYSA-N	0	0	288.690	4.221	20	30		CIEDRN
Cc1ccccc1Sc1ccc(Cl)c(C#N)n1	ZINC000301555203	227572094	/nfs/dbraw/zinc/57/20/94/227572094.db2.gz	WJFYBBOJMSVWTA-UHFFFAOYSA-N	0	0	260.749	4.066	20	30		CIEDRN
N#Cc1ccc(CNc2ncc(-c3ccccc3)s2)cc1	ZINC000301542380	227578715	/nfs/dbraw/zinc/57/87/15/227578715.db2.gz	COYNQWVDMCTWLF-UHFFFAOYSA-N	0	0	291.379	4.294	20	30		CIEDRN
Cc1cccc([C@@H](C)CNc2snc(Cl)c2C#N)c1	ZINC000301381178	227524869	/nfs/dbraw/zinc/52/48/69/227524869.db2.gz	YPRDIZJUGBSWMT-JTQLQIEISA-N	0	0	291.807	4.192	20	30		CIEDRN
O=C(N[C@@H]1CCCCC12CCCC2)c1c[nH]c2ncccc12	ZINC000329608393	227647014	/nfs/dbraw/zinc/64/70/14/227647014.db2.gz	ISFRROBBKRAVNJ-OAHLLOKOSA-N	0	0	297.402	4.371	20	30		CIEDRN
N#Cc1ccc(N[C@@H](c2ccccc2)C2CCCCC2)nn1	ZINC000301869670	227712045	/nfs/dbraw/zinc/71/20/45/227712045.db2.gz	CNNDTJSIOQQLQO-SFHVURJKSA-N	0	0	292.386	4.082	20	30		CIEDRN
Cc1cc(C)nc(NC(=O)[C@@H]2CCC[C@@H]3CCCC[C@H]23)n1	ZINC000329640688	227750255	/nfs/dbraw/zinc/75/02/55/227750255.db2.gz	XFGXULICCGGFIF-SOUVJXGZSA-N	0	0	287.407	4.288	20	30		CIEDRN
N#Cc1cnc(N[C@H](CC2CCCC2)c2ccccc2)cn1	ZINC000302265967	227835328	/nfs/dbraw/zinc/83/53/28/227835328.db2.gz	FWEDUHFPBKXJRH-QGZVFWFLSA-N	0	0	292.386	4.082	20	30		CIEDRN
Cc1noc(C(C)C)c1C(=O)N[C@@H]1CC[C@@H]2CCC[C@@H]2C1	ZINC000329678410	227838059	/nfs/dbraw/zinc/83/80/59/227838059.db2.gz	VNZFYRSTRYAZBZ-BFHYXJOUSA-N	0	0	290.407	4.380	20	30		CIEDRN
Cc1ccc(NCc2ccc3ccccc3c2)nc1C#N	ZINC000302604188	227869915	/nfs/dbraw/zinc/86/99/15/227869915.db2.gz	CVXXLWUFLBXNDR-UHFFFAOYSA-N	0	0	273.339	4.027	20	30		CIEDRN
Cc1cc(CNc2c(C#N)cccc2C#N)ccc1Cl	ZINC000302873375	227895294	/nfs/dbraw/zinc/89/52/94/227895294.db2.gz	DBRADVKXGDQAAW-UHFFFAOYSA-N	0	0	281.746	4.004	20	30		CIEDRN
C[C@@H]1C[C@@H](C(=O)Nc2ccc3ccoc3c2)CCC1=O	ZINC000329845224	227964753	/nfs/dbraw/zinc/96/47/53/227964753.db2.gz	QFCHFGPKEHLNFF-PWSUYJOCSA-N	0	0	271.316	4.026	20	30		CIEDRN
Cc1nc2cc(NC(=O)[C@@H]3CC34CCCC4)ccc2o1	ZINC000329965351	228000065	/nfs/dbraw/zinc/00/00/65/228000065.db2.gz	RASAKXJDAWRQFH-LBPRGKRZSA-N	0	0	270.332	4.305	20	30		CIEDRN
Cc1ccc(NC(=O)[C@@H]2CC23CCCC3)c2n[nH]cc21	ZINC000329973652	228003621	/nfs/dbraw/zinc/00/36/21/228003621.db2.gz	WWYUTYASXHDGPC-LBPRGKRZSA-N	0	0	269.348	4.040	20	30		CIEDRN
O=C(NCC[C@@H]1C(=O)Nc2ccccc21)[C@H]1CC12CCCC2	ZINC000329998647	228011783	/nfs/dbraw/zinc/01/17/83/228011783.db2.gz	SRVKCKBPHJLADN-UONOGXRCSA-N	0	0	298.386	4.299	20	30		CIEDRN
Cc1nc(CC2CC2)oc1C(=O)N[C@@H]1CCCCC1(C)C	ZINC000330009381	228015378	/nfs/dbraw/zinc/01/53/78/228015378.db2.gz	HGHVYWHUNNLRPZ-CYBMUJFWSA-N	0	0	290.407	4.209	20	30		CIEDRN
Cc1coc2ccc(NC(=O)[C@H]3CCO[C@@H](C)C3)cc12	ZINC000330047573	228026479	/nfs/dbraw/zinc/02/64/79/228026479.db2.gz	HUCJIQASPNZOCG-RYUDHWBXSA-N	0	0	273.332	4.144	20	30		CIEDRN
C[C@H]1C[C@H]1c1ccc(CN(CCC#N)CC(C)(C)C)o1	ZINC000353421029	228100116	/nfs/dbraw/zinc/10/01/16/228100116.db2.gz	IVXXMBLHRGCRKO-DZGCQCFKSA-N	0	0	274.408	4.165	20	30		CIEDRN
Cc1ccc(-c2cccnc2)cc1NC(=O)[C@H]1CC[C@H](C)O1	ZINC000330086149	228036031	/nfs/dbraw/zinc/03/60/31/228036031.db2.gz	LZJZILKDZVUWMH-SUMWQHHRSA-N	0	0	296.370	4.213	20	30		CIEDRN
Cc1coc2ccc(NC(=O)[C@@H]3CC(=O)N[C@H](C)C3)cc12	ZINC000330104982	228040298	/nfs/dbraw/zinc/04/02/98/228040298.db2.gz	JIBARBMKMJIZDU-MNOVXSKESA-N	0	0	286.331	4.084	20	30		CIEDRN
Cc1coc2ccc(NC(=O)[C@@H]3CCC(=O)[C@H](C)C3)cc12	ZINC000330116498	228043256	/nfs/dbraw/zinc/04/32/56/228043256.db2.gz	VNKMGRYTGVGIEP-ZYHUDNBSSA-N	0	0	285.343	4.335	20	30		CIEDRN
Cc1nnccc1NC(=O)CC(C)(C)C1CCCCC1	ZINC000330135817	228047272	/nfs/dbraw/zinc/04/72/72/228047272.db2.gz	SUKTYVZWWYQKRI-UHFFFAOYSA-N	0	0	275.396	4.370	20	30		CIEDRN
Cc1ccc(NC(=O)C[C@H](CC#N)c2ccccc2)cc1	ZINC000353306465	228083034	/nfs/dbraw/zinc/08/30/34/228083034.db2.gz	QBWMFPXFRRQMFQ-INIZCTEOSA-N	0	0	278.355	4.021	20	30		CIEDRN
Cc1ccc(NC(=O)C[C@@H](CC#N)c2ccccc2)cc1F	ZINC000353354837	228089908	/nfs/dbraw/zinc/08/99/08/228089908.db2.gz	QFGXDULBTRDLER-OAHLLOKOSA-N	0	0	296.345	4.160	20	30		CIEDRN
N#Cc1cccnc1/C=C/c1nc(-c2ccccc2)cs1	ZINC000352019728	228174468	/nfs/dbraw/zinc/17/44/68/228174468.db2.gz	DGZAACOGBWWCNN-CMDGGOBGSA-N	0	0	289.363	4.247	20	30		CIEDRN
N#CCCC[C@H](NC(=O)C1=CCCCCC1)c1ccccc1	ZINC000352180078	228192392	/nfs/dbraw/zinc/19/23/92/228192392.db2.gz	HNCJYONIESEMSG-SFHVURJKSA-N	0	0	296.414	4.428	20	30		CIEDRN
Cc1sc2ncnc(NCC(C)(C)CCC#N)c2c1C	ZINC000352205832	228198831	/nfs/dbraw/zinc/19/88/31/228198831.db2.gz	IYWWZAQVTUIDAZ-UHFFFAOYSA-N	0	0	288.420	4.050	20	30		CIEDRN
C[C@@H]1CCC[C@@H](c2noc([C@@]3(C#N)CC34CCCC4)n2)C1	ZINC000333788834	228214582	/nfs/dbraw/zinc/21/45/82/228214582.db2.gz	CYDZMLSNHZTRGO-XNJGSVPQSA-N	0	0	285.391	4.089	20	30		CIEDRN
C[C@H]1CCC[C@@](C#N)(NC(=O)c2cccc3ccccc32)C1	ZINC000116806306	260005724	/nfs/dbraw/zinc/00/57/24/260005724.db2.gz	JWAIRWAXCIZMPF-IFXJQAMLSA-N	0	0	292.382	4.042	20	30		CIEDRN
Cc1ccccc1[C@H](C)CC(=O)N[C@]1(C#N)CCC[C@H](C)C1	ZINC000116800975	260005962	/nfs/dbraw/zinc/00/59/62/260005962.db2.gz	VRYQNBBXQYOPRE-ZSZQSSIHSA-N	0	0	298.430	4.077	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)Nc1ccsc1	ZINC000356563862	260033498	/nfs/dbraw/zinc/03/34/98/260033498.db2.gz	JGMITUNYLHVSBA-UHFFFAOYSA-N	0	0	290.363	4.107	20	30		CIEDRN
CCOc1cc(C#N)ccc1OC/C=C\c1ccccc1	ZINC000207642726	260039075	/nfs/dbraw/zinc/03/90/75/260039075.db2.gz	UFDFVVCFVNHDMN-TWGQIWQCSA-N	0	0	279.339	4.049	20	30		CIEDRN
C=C(C)[C@H](NCc1ncc(C)s1)c1ccc(F)c(F)c1	ZINC000187784962	260058549	/nfs/dbraw/zinc/05/85/49/260058549.db2.gz	XMHMSOSDLNGNFQ-HNNXBMFYSA-N	0	0	294.370	4.137	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cccc(F)c1Cl	ZINC000297633820	260130822	/nfs/dbraw/zinc/13/08/22/260130822.db2.gz	CWMRDQXLHNVJLJ-UHFFFAOYSA-N	0	0	255.720	4.020	20	30		CIEDRN
CCc1cccc(N[C@@H](C)c2ccc(OCC#N)cc2)c1	ZINC000037214339	260074507	/nfs/dbraw/zinc/07/45/07/260074507.db2.gz	KYODQYLZGNYORB-AWEZNQCLSA-N	0	0	280.371	4.324	20	30		CIEDRN
Cc1nc2cc(N[C@@H](C)c3cccc(C#N)c3)ccc2o1	ZINC000037232799	260076280	/nfs/dbraw/zinc/07/62/80/260076280.db2.gz	LDKBCIYLEBFASK-NSHDSACASA-N	0	0	277.327	4.181	20	30		CIEDRN
C=C(C)CN[C@H](c1ccccc1OC(F)F)C(F)(F)F	ZINC000179898704	260079358	/nfs/dbraw/zinc/07/93/58/260079358.db2.gz	PZGITDXKRJCXTM-LLVKDONJSA-N	0	0	295.251	4.057	20	30		CIEDRN
Cc1nc(N[C@@H](C)Cc2cccs2)c(Cl)cc1C#N	ZINC000394121092	260083152	/nfs/dbraw/zinc/08/31/52/260083152.db2.gz	WLWFQTOYDHMDBA-VIFPVBQESA-N	0	0	291.807	4.020	20	30		CIEDRN
CCC(C)(C)OCCNc1cccc(C(F)F)c1C#N	ZINC000521370565	260088825	/nfs/dbraw/zinc/08/88/25/260088825.db2.gz	XFHVCVXXISTHGI-UHFFFAOYSA-N	0	0	282.334	4.113	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@H](C)c1oc2ccccc2c1C	ZINC000180714307	260109035	/nfs/dbraw/zinc/10/90/35/260109035.db2.gz	DBTBUELZZKZVJV-CYBMUJFWSA-N	0	0	286.375	4.020	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@@H](C)c1oc2ccccc2c1C	ZINC000180714327	260109322	/nfs/dbraw/zinc/10/93/22/260109322.db2.gz	DBTBUELZZKZVJV-ZDUSSCGKSA-N	0	0	286.375	4.020	20	30		CIEDRN
C=CCCc1noc([C@@H]2CCC[C@H](C(F)(F)F)C2)n1	ZINC000297370890	260119623	/nfs/dbraw/zinc/11/96/23/260119623.db2.gz	QMFFHNMHPOIBCW-ZJUUUORDSA-N	0	0	274.286	4.024	20	30		CIEDRN
CC(C)c1ccc(NC(=O)CSCC#N)c(C(C)C)c1	ZINC000027138610	260120542	/nfs/dbraw/zinc/12/05/42/260120542.db2.gz	LNGSYHRRMOTZDH-UHFFFAOYSA-N	0	0	290.432	4.129	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cc(-c2nc(C)co2)ccc1C	ZINC000297532562	260128150	/nfs/dbraw/zinc/12/81/50/260128150.db2.gz	BCINMKDKIFCILR-UHFFFAOYSA-N	0	0	298.386	4.499	20	30		CIEDRN
Cc1nc(N2CCC[C@H]2C2CCCC2)c(Cl)cc1C#N	ZINC000312497616	260131580	/nfs/dbraw/zinc/13/15/80/260131580.db2.gz	DKISMHWKIWXJNQ-HNNXBMFYSA-N	0	0	289.810	4.074	20	30		CIEDRN
C[C@@H](NCc1ccsc1Cl)c1ccc(C#N)cc1	ZINC000312561327	260149758	/nfs/dbraw/zinc/14/97/58/260149758.db2.gz	TUELEXVUBKWYFX-SNVBAGLBSA-N	0	0	276.792	4.124	20	30		CIEDRN
C[C@H]1CCc2ccccc2N1CCCC(C)(C)C#N	ZINC000087608407	260192258	/nfs/dbraw/zinc/19/22/58/260192258.db2.gz	LBDRLTZYGZWQNO-AWEZNQCLSA-N	0	0	256.393	4.158	20	30		CIEDRN
CCCOc1ccc(OCCCC(C)(C)C#N)cc1	ZINC000087608971	260192344	/nfs/dbraw/zinc/19/23/44/260192344.db2.gz	NPOSKHQDPRJAJC-UHFFFAOYSA-N	0	0	261.365	4.184	20	30		CIEDRN
C=CCOc1ccc(CNCc2ccsc2Cl)cc1	ZINC000312753822	260197583	/nfs/dbraw/zinc/19/75/83/260197583.db2.gz	BMTAPTPRCIDXAK-UHFFFAOYSA-N	0	0	293.819	4.256	20	30		CIEDRN
C=CCOc1ccccc1CNCc1ccsc1Cl	ZINC000312783608	260201723	/nfs/dbraw/zinc/20/17/23/260201723.db2.gz	ROTMROZHJSOACC-UHFFFAOYSA-N	0	0	293.819	4.256	20	30		CIEDRN
Cc1ccccc1CN(Cc1ccccc1C#N)C1CC1	ZINC000521814286	260210319	/nfs/dbraw/zinc/21/03/19/260210319.db2.gz	SHVYOJSQWREPOF-UHFFFAOYSA-N	0	0	276.383	4.031	20	30		CIEDRN
N#Cc1ccc(SCCc2ccccc2)c(F)c1	ZINC000525503897	260217292	/nfs/dbraw/zinc/21/72/92/260217292.db2.gz	LFPACIOQFFQTIX-UHFFFAOYSA-N	0	0	257.333	4.032	20	30		CIEDRN
Cc1cccc(-n2ccnc2SCCC(C)(C)C#N)c1	ZINC000525503117	260217583	/nfs/dbraw/zinc/21/75/83/260217583.db2.gz	PTYMEQQDNHIDPT-UHFFFAOYSA-N	0	0	285.416	4.213	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1c(C)cccc1OC(F)F	ZINC000069333552	260247719	/nfs/dbraw/zinc/24/77/19/260247719.db2.gz	GXDIQMQLOKAFOY-UHFFFAOYSA-N	0	0	298.333	4.026	20	30		CIEDRN
N#CCCOc1cc(C(F)(F)F)cc(C(F)(F)F)c1	ZINC000070192478	260265571	/nfs/dbraw/zinc/26/55/71/260265571.db2.gz	CBLMJJJTXKUMDW-UHFFFAOYSA-N	0	0	283.171	4.017	20	30		CIEDRN
N#CCc1cccc(N[C@@H]2CCC[C@@H](C(F)(F)F)C2)c1	ZINC000313427924	260293004	/nfs/dbraw/zinc/29/30/04/260293004.db2.gz	NPRSUEKSVBSLMC-TZMCWYRMSA-N	0	0	282.309	4.286	20	30		CIEDRN
C[C@@H](CCc1ccccc1)Nc1cccc(CC#N)c1	ZINC000313431992	260293014	/nfs/dbraw/zinc/29/30/14/260293014.db2.gz	BNZMXNHRRIDKSP-HNNXBMFYSA-N	0	0	264.372	4.186	20	30		CIEDRN
C[C@H](CCc1ccccc1)Nc1cccc(CC#N)c1	ZINC000313431993	260293032	/nfs/dbraw/zinc/29/30/32/260293032.db2.gz	BNZMXNHRRIDKSP-OAHLLOKOSA-N	0	0	264.372	4.186	20	30		CIEDRN
CC(C)[C@@H](C(=O)Nc1ccc(CC#N)cc1)c1ccccc1	ZINC000079319276	260304218	/nfs/dbraw/zinc/30/42/18/260304218.db2.gz	ONJMSRZDKGQKBX-GOSISDBHSA-N	0	0	292.382	4.131	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1nc2cc(F)c(F)cc2s1	ZINC000517895271	260315713	/nfs/dbraw/zinc/31/57/13/260315713.db2.gz	JYBJTYLEZBZQET-UHFFFAOYSA-N	0	0	296.342	4.115	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N[C@@H]1CCc2sc(Cl)cc21	ZINC000518021966	260335291	/nfs/dbraw/zinc/33/52/91/260335291.db2.gz	GATWRYIZAUUYGD-GXSJLCMTSA-N	0	0	298.839	4.043	20	30		CIEDRN
CC(C)(C#N)CCCNc1ccc(Br)cc1	ZINC000083640739	260353668	/nfs/dbraw/zinc/35/36/68/260353668.db2.gz	WNLAKJAGFWAZOT-UHFFFAOYSA-N	0	0	281.197	4.191	20	30		CIEDRN
Cc1sc(NC(=O)C2(C(F)F)CCCC2)c(C#N)c1C	ZINC000518246991	260360857	/nfs/dbraw/zinc/36/08/57/260360857.db2.gz	XCCUFTZHEAVWPV-UHFFFAOYSA-N	0	0	298.358	4.001	20	30		CIEDRN
N#Cc1ccc(N[C@H](c2ccccc2)C2CC2)c(F)c1	ZINC000094195336	260389913	/nfs/dbraw/zinc/38/99/13/260389913.db2.gz	FLDJJHDANYOBSY-QGZVFWFLSA-N	0	0	266.319	4.261	20	30		CIEDRN
CC[C@@H](C)C[C@H](C)Nc1nc(C(F)(F)F)ccc1C#N	ZINC000090795426	260413095	/nfs/dbraw/zinc/41/30/95/260413095.db2.gz	WZGFSFTUMJAFEQ-ZJUUUORDSA-N	0	0	285.313	4.209	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1cc(F)c(Cl)cc1Cl	ZINC000410124316	260462535	/nfs/dbraw/zinc/46/25/35/260462535.db2.gz	JWODJJNHTBXARM-QMMMGPOBSA-N	0	0	290.165	4.217	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)CSCc1ccc(Cl)cc1	ZINC000410134679	260464284	/nfs/dbraw/zinc/46/42/84/260464284.db2.gz	BMOWKRYMCCFNTG-AWEZNQCLSA-N	0	0	297.851	4.044	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@H](C)CC1CCCCC1	ZINC000410143094	260465611	/nfs/dbraw/zinc/46/56/11/260465611.db2.gz	ONSABIPNNXPFIO-HIFRSBDPSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)CCc1ccc2ccccc2c1	ZINC000410141392	260465863	/nfs/dbraw/zinc/46/58/63/260465863.db2.gz	GFCRWNIXLJEDKZ-SFHVURJKSA-N	0	0	281.399	4.243	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)CC[C@H](C)c1ccccc1	ZINC000410138219	260466116	/nfs/dbraw/zinc/46/61/16/260466116.db2.gz	DRKXRUNTRPPFSW-GOEBONIOSA-N	0	0	259.393	4.041	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](C)c1ccc(SC)cc1	ZINC000410235241	260474107	/nfs/dbraw/zinc/47/41/07/260474107.db2.gz	HHYNXJCERJYHLD-OLZOCXBDSA-N	0	0	277.433	4.188	20	30		CIEDRN
Cc1c(Cl)cccc1NCC(C)(C)CCC#N	ZINC000092142162	260485306	/nfs/dbraw/zinc/48/53/06/260485306.db2.gz	NTDYVWCXLSLLGD-UHFFFAOYSA-N	0	0	250.773	4.390	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1cncc(CC)c1	ZINC000410343066	260487431	/nfs/dbraw/zinc/48/74/31/260487431.db2.gz	BKLVFPFAICIWHA-UHFFFAOYSA-N	0	0	280.371	4.015	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)C1(C)CCCC1	ZINC000410350398	260488381	/nfs/dbraw/zinc/48/83/81/260488381.db2.gz	SWLCDTQOOGAJDJ-UHFFFAOYSA-N	0	0	257.377	4.324	20	30		CIEDRN
C=CCC(C)(C)c1nc(-c2cccc3[nH]ccc32)no1	ZINC000426411200	260524907	/nfs/dbraw/zinc/52/49/07/260524907.db2.gz	LNLJRCRQZZFAJK-UHFFFAOYSA-N	0	0	267.332	4.072	20	30		CIEDRN
CC(C)(C)CN(CCC#N)Cc1ncc(-c2ccccc2)o1	ZINC000109813079	260644383	/nfs/dbraw/zinc/64/43/83/260644383.db2.gz	HAHWXLFBBPXNNL-UHFFFAOYSA-N	0	0	297.402	4.103	20	30		CIEDRN
CC[C@@H](Nc1ccc(C#N)cc1[N+](=O)[O-])c1cccs1	ZINC000049531235	260663205	/nfs/dbraw/zinc/66/32/05/260663205.db2.gz	YRSPTXMSYSZBAG-LLVKDONJSA-N	0	0	287.344	4.091	20	30		CIEDRN
C[C@@H](CC#N)Sc1ccccc1NC(=O)CCC1CC1	ZINC000115069286	260673868	/nfs/dbraw/zinc/67/38/68/260673868.db2.gz	CTPJYMVGMGHWNG-LBPRGKRZSA-N	0	0	288.416	4.210	20	30		CIEDRN
CCc1ccsc1C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000153162256	260687980	/nfs/dbraw/zinc/68/79/80/260687980.db2.gz	WJLYZKFIBSWFAN-OAHLLOKOSA-N	0	0	298.411	4.085	20	30		CIEDRN
CCC(=CC(=O)Nc1cccc(OCCCC#N)c1)CC	ZINC000122554580	260720363	/nfs/dbraw/zinc/72/03/63/260720363.db2.gz	ZTURXXYCGAVKBK-UHFFFAOYSA-N	0	0	286.375	4.054	20	30		CIEDRN
Cc1cccc(Cl)c1NCc1cccc(F)c1C#N	ZINC000427419956	260732009	/nfs/dbraw/zinc/73/20/09/260732009.db2.gz	ICNDAKGZPASUSF-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
C=C(C)CS[C@@H](C)c1nc(Cc2ccc(F)cc2)no1	ZINC000088306961	260768551	/nfs/dbraw/zinc/76/85/51/260768551.db2.gz	UNTRIJVDBRUQNM-NSHDSACASA-N	0	0	292.379	4.170	20	30		CIEDRN
C=CCC[C@H](C(=O)Nc1csc(C)n1)c1ccccc1	ZINC000427664021	260801889	/nfs/dbraw/zinc/80/18/89/260801889.db2.gz	QKFYNWJKGZBNRW-AWEZNQCLSA-N	0	0	286.400	4.140	20	30		CIEDRN
Cc1sc(NC(=O)[C@H]2CCCCC2(C)C)c(C#N)c1C	ZINC000448100172	260834381	/nfs/dbraw/zinc/83/43/81/260834381.db2.gz	YZENIOIZTKATTK-CYBMUJFWSA-N	0	0	290.432	4.392	20	30		CIEDRN
C[C@H](CNc1cccc(Cl)c1C#N)c1ccccc1	ZINC000157766281	260861516	/nfs/dbraw/zinc/86/15/16/260861516.db2.gz	LCDFOAAHBLAEDT-GFCCVEGCSA-N	0	0	270.763	4.427	20	30		CIEDRN
Cc1cc(CNc2cccc(Cl)c2)ccc1C#N	ZINC000443956394	260942700	/nfs/dbraw/zinc/94/27/00/260942700.db2.gz	GKBJLPXSYXSVFU-UHFFFAOYSA-N	0	0	256.736	4.132	20	30		CIEDRN
C=CCC[C@@H](NC(=O)N1CCCC12CCC2)c1ccccc1	ZINC000445225333	260955100	/nfs/dbraw/zinc/95/51/00/260955100.db2.gz	QPGXABAMWQGSDU-QGZVFWFLSA-N	0	0	298.430	4.422	20	30		CIEDRN
CC#CCCSCc1cc(F)cc2cccnc21	ZINC000360506589	261071054	/nfs/dbraw/zinc/07/10/54/261071054.db2.gz	FYRXFEUSKGKUHG-UHFFFAOYSA-N	0	0	259.349	4.021	20	30		CIEDRN
C[C@@H](C(=O)N[C@H](CCC#N)c1ccccc1)c1cccs1	ZINC000153576341	261080391	/nfs/dbraw/zinc/08/03/91/261080391.db2.gz	KTZATSDPTFWIAK-UKRRQHHQSA-N	0	0	298.411	4.013	20	30		CIEDRN
CCc1noc([C@H](C)Sc2ccc(C#N)cc2Cl)n1	ZINC000154159503	261088732	/nfs/dbraw/zinc/08/87/32/261088732.db2.gz	WMQXVFUWLLQARQ-QMMMGPOBSA-N	0	0	293.779	4.010	20	30		CIEDRN
C=CCCCC[C@H](C)Nc1cccc(N(C)C(C)=O)c1	ZINC000449047041	261126117	/nfs/dbraw/zinc/12/61/17/261126117.db2.gz	PWKWCLCOXAAKLR-AWEZNQCLSA-N	0	0	274.408	4.216	20	30		CIEDRN
CCOc1cccc(CNc2ccc(Cl)cc2C#N)c1	ZINC000052857184	261148666	/nfs/dbraw/zinc/14/86/66/261148666.db2.gz	LVQGTVHXHLOVCZ-UHFFFAOYSA-N	0	0	286.762	4.222	20	30		CIEDRN
C=CCN(CC=C)C(=O)Nc1ccc(OC(C)(C)C)cc1	ZINC000173685632	261168001	/nfs/dbraw/zinc/16/80/01/261168001.db2.gz	WTYFFXSQYFCROY-UHFFFAOYSA-N	0	0	288.391	4.070	20	30		CIEDRN
C[C@H](Sc1ccccc1C#N)c1ccc(C#N)cc1	ZINC000173709374	261168879	/nfs/dbraw/zinc/16/88/79/261168879.db2.gz	OGHNYDXBBFTJCD-LBPRGKRZSA-N	0	0	264.353	4.283	20	30		CIEDRN
C=CC[C@H]1N(C(=O)[C@@H]2C[C@H]2CCC)CCCC1(C)C	ZINC000462348616	261186144	/nfs/dbraw/zinc/18/61/44/261186144.db2.gz	WQPZMIMKQCJDNW-RBSFLKMASA-N	0	0	263.425	4.016	20	30		CIEDRN
C=CC[C@H]1N(C(=O)NCc2ccsc2)CCCC1(C)C	ZINC000444869993	261192462	/nfs/dbraw/zinc/19/24/62/261192462.db2.gz	FYTSRELCCDJGJQ-CQSZACIVSA-N	0	0	292.448	4.024	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(Cc1ccc(CC)cc1)C1CC1	ZINC000464556761	261194000	/nfs/dbraw/zinc/19/40/00/261194000.db2.gz	TYZWUTSFNHDBNF-HNNXBMFYSA-N	0	0	285.431	4.342	20	30		CIEDRN
CCC[C@@H](C(=O)Nc1ccc(C#N)c(F)c1)c1ccccc1	ZINC000464642159	261206908	/nfs/dbraw/zinc/20/69/08/261206908.db2.gz	GWRDJVNOLBSYCM-MRXNPFEDSA-N	0	0	296.345	4.220	20	30		CIEDRN
Cc1cccc2c1[C@H](C)C[C@@H]2CC(=O)N[C@H](C#N)C(C)(C)C	ZINC000464712423	261217078	/nfs/dbraw/zinc/21/70/78/261217078.db2.gz	QIFKQWBROPQOFH-IIAWOOMASA-N	0	0	298.430	4.030	20	30		CIEDRN
C=C[C@H](C)NC(=O)N(CC1CCC1)[C@H](C)c1ccccc1	ZINC000464757138	261220604	/nfs/dbraw/zinc/22/06/04/261220604.db2.gz	UJHSVEAXBZYBSJ-LSDHHAIUSA-N	0	0	286.419	4.134	20	30		CIEDRN
N#Cc1cc(F)ccc1N[C@@H]1CCO[C@H](c2ccccc2)C1	ZINC000160623426	261220749	/nfs/dbraw/zinc/22/07/49/261220749.db2.gz	KAOQSXBQOOKWQG-AEFFLSMTSA-N	0	0	296.345	4.030	20	30		CIEDRN
C=C[C@H](C)NC(=O)N(CC)[C@@H](C)c1cc2ccccc2o1	ZINC000464753182	261222593	/nfs/dbraw/zinc/22/25/93/261222593.db2.gz	HLSKXWVJADZKMQ-STQMWFEESA-N	0	0	286.375	4.100	20	30		CIEDRN
CC[C@H]1CCCCN1C(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000160730158	261225228	/nfs/dbraw/zinc/22/52/28/261225228.db2.gz	YXRHVRISDQJALZ-IRXDYDNUSA-N	0	0	299.418	4.006	20	30		CIEDRN
N#Cc1cccc(NC(=O)c2ccc(F)c3ccccc23)c1	ZINC000318516542	261230014	/nfs/dbraw/zinc/23/00/14/261230014.db2.gz	OSFDMBKHBIXWOT-UHFFFAOYSA-N	0	0	290.297	4.103	20	30		CIEDRN
CC(C)(C#N)CCC[S@](=O)[C@H]1CCCc2ccccc21	ZINC000161205784	261239973	/nfs/dbraw/zinc/23/99/73/261239973.db2.gz	ZHVMOZGFISSBSU-OXJNMPFZSA-N	0	0	289.444	4.143	20	30		CIEDRN
CC(C)(C#N)CCC[S@@](=O)[C@H]1CCCc2ccccc21	ZINC000161205700	261240175	/nfs/dbraw/zinc/24/01/75/261240175.db2.gz	ZHVMOZGFISSBSU-JXFKEZNVSA-N	0	0	289.444	4.143	20	30		CIEDRN
CC(C)(C#N)CCCSCc1cc(-c2ccco2)on1	ZINC000161684903	261256487	/nfs/dbraw/zinc/25/64/87/261256487.db2.gz	AOIIPDJWQARIQB-UHFFFAOYSA-N	0	0	290.388	4.498	20	30		CIEDRN
CCC(CC)CN(CCC#N)C(=O)Nc1cccc(C)c1	ZINC000176337845	261277040	/nfs/dbraw/zinc/27/70/40/261277040.db2.gz	RAIHHSCYOMMLHO-UHFFFAOYSA-N	0	0	287.407	4.179	20	30		CIEDRN
Cc1ccc(C(=O)N(CCC#N)CCC(C)C)cc1Cl	ZINC000103439947	261283153	/nfs/dbraw/zinc/28/31/53/261283153.db2.gz	DBKHNCODWCJLQO-UHFFFAOYSA-N	0	0	292.810	4.050	20	30		CIEDRN
N#Cc1ccc(C[N@@H+]2CCC[C@@H]2c2cccs2)s1	ZINC000162706354	261292291	/nfs/dbraw/zinc/29/22/91/261292291.db2.gz	HFVNORZSXNDNJL-CYBMUJFWSA-N	0	0	274.414	4.018	20	30		CIEDRN
CC(C)Sc1ccc(Cl)cc1N[C@@H](C)C#N	ZINC000105413277	261358699	/nfs/dbraw/zinc/35/86/99/261358699.db2.gz	BSKJVWDSPDBCRP-VIFPVBQESA-N	0	0	254.786	4.164	20	30		CIEDRN
N#Cc1ccc(NCc2ccc(F)cc2C(F)(F)F)cc1	ZINC000107821705	261381102	/nfs/dbraw/zinc/38/11/02/261381102.db2.gz	GQFNAIOLVBWZNF-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
N#Cc1cccc(C[S@@](=O)c2ccc3ccccc3c2)c1	ZINC000108004626	261383037	/nfs/dbraw/zinc/38/30/37/261383037.db2.gz	OBWXXHAKNBEBOX-NRFANRHFSA-N	0	0	291.375	4.019	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)c1cc2ccccc2s1	ZINC000178385243	261387929	/nfs/dbraw/zinc/38/79/29/261387929.db2.gz	IWLQQDJYEZPNOD-UHFFFAOYSA-N	0	0	292.363	4.334	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)CC/C=C/c1ccccc1	ZINC000178376671	261388160	/nfs/dbraw/zinc/38/81/60/261388160.db2.gz	KCVCZWAGHIBAPY-BJMVGYQFSA-N	0	0	290.366	4.299	20	30		CIEDRN
Cc1cccc(NC(=O)Nc2cccc(C#N)c2C)c1C	ZINC000178551946	261398402	/nfs/dbraw/zinc/39/84/02/261398402.db2.gz	ROQKPBHFQGCGTN-UHFFFAOYSA-N	0	0	279.343	4.128	20	30		CIEDRN
CC[C@@H]1CCCCCN1C(=O)Nc1cccc(C#N)c1C	ZINC000178586893	261399254	/nfs/dbraw/zinc/39/92/54/261399254.db2.gz	GDMKTSSAFBQWTL-OAHLLOKOSA-N	0	0	285.391	4.053	20	30		CIEDRN
CC(C)c1ccc([C@H](C)CC(=O)NCCCCC#N)cc1	ZINC000172411900	261500867	/nfs/dbraw/zinc/50/08/67/261500867.db2.gz	RPHQDQRMGHUCPA-OAHLLOKOSA-N	0	0	286.419	4.114	20	30		CIEDRN
N#CCSCCCSc1cccc(Cl)c1	ZINC000174016577	261553591	/nfs/dbraw/zinc/55/35/91/261553591.db2.gz	RROFPLDZOPLQMW-UHFFFAOYSA-N	0	0	257.811	4.079	20	30		CIEDRN
N#Cc1c(F)cccc1NCc1ccc(F)c(Cl)c1	ZINC000112013839	261568157	/nfs/dbraw/zinc/56/81/57/261568157.db2.gz	HAROHPGXVKOMAE-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(CCSC)cc1	ZINC000188137751	261850986	/nfs/dbraw/zinc/85/09/86/261850986.db2.gz	AFUMNZZANMXCFU-INIZCTEOSA-N	0	0	277.433	4.133	20	30		CIEDRN
C=CCNC(=O)N1CCCCC[C@H]1c1ccc(Cl)cc1	ZINC000522709676	261907497	/nfs/dbraw/zinc/90/74/97/261907497.db2.gz	SSVHAQOBGDRVEM-HNNXBMFYSA-N	0	0	292.810	4.153	20	30		CIEDRN
CCCCCCCC(=O)Nc1ccccc1O[C@@H](C)C#N	ZINC000182060733	261921196	/nfs/dbraw/zinc/92/11/96/261921196.db2.gz	HQSUPFXKQFCDFW-AWEZNQCLSA-N	0	0	288.391	4.276	20	30		CIEDRN
N#CCCSc1ccccc1NCc1cccc(F)c1	ZINC000108352816	261923214	/nfs/dbraw/zinc/92/32/14/261923214.db2.gz	JOWONIZZHUCWJI-UHFFFAOYSA-N	0	0	286.375	4.444	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000185277752	262048352	/nfs/dbraw/zinc/04/83/52/262048352.db2.gz	FRBAGFWHERIYFR-ZDUSSCGKSA-N	0	0	270.376	4.029	20	30		CIEDRN
CC[C@@H]1[C@@H](C)CCN1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000186088211	262079423	/nfs/dbraw/zinc/07/94/23/262079423.db2.gz	KRGLQDYNKQRQEB-XJKSGUPXSA-N	0	0	299.418	4.140	20	30		CIEDRN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)C[C@H]1C=CCCC1	ZINC000186517941	262096491	/nfs/dbraw/zinc/09/64/91/262096491.db2.gz	NASBNAPHWACXPS-INIZCTEOSA-N	0	0	296.414	4.042	20	30		CIEDRN
CCC1(CC)CCN(C(=O)Nc2ccc(CC#N)cc2)CC1	ZINC000187011019	262120961	/nfs/dbraw/zinc/12/09/61/262120961.db2.gz	XOQXOOZTOMYJFH-UHFFFAOYSA-N	0	0	299.418	4.187	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](c1ccccn1)C1CCCC1	ZINC000364071796	262136458	/nfs/dbraw/zinc/13/64/58/262136458.db2.gz	CTZJCWWENUNWRD-PBHICJAKSA-N	0	0	286.419	4.031	20	30		CIEDRN
CC#CCCCC(=O)N1CCC[C@@H]1c1ccc(C)c(C)c1	ZINC000364078728	262141337	/nfs/dbraw/zinc/14/13/37/262141337.db2.gz	IOIVTXGSTXXOPJ-GOSISDBHSA-N	0	0	283.415	4.161	20	30		CIEDRN
C[C@H](CCC#N)Sc1nnc(-c2c[nH]c3ccccc32)o1	ZINC000188213785	262151598	/nfs/dbraw/zinc/15/15/98/262151598.db2.gz	KKYHGJKMNKWNML-SNVBAGLBSA-N	0	0	298.371	4.002	20	30		CIEDRN
C[C@@H](CCC#N)Sc1nnc(-c2c[nH]c3ccccc32)o1	ZINC000188213763	262151652	/nfs/dbraw/zinc/15/16/52/262151652.db2.gz	KKYHGJKMNKWNML-JTQLQIEISA-N	0	0	298.371	4.002	20	30		CIEDRN
Cc1nn(-c2ccccc2)c(C)c1NCCCC(C)(C)C#N	ZINC000189019310	262166501	/nfs/dbraw/zinc/16/65/01/262166501.db2.gz	JNJOUYFOEZXQFK-UHFFFAOYSA-N	0	0	296.418	4.231	20	30		CIEDRN
C=C(C)CN(CC)C(=O)CCCCc1ccc(C)cc1	ZINC000497466355	262166672	/nfs/dbraw/zinc/16/66/72/262166672.db2.gz	ASYJFQLSDYSYAO-UHFFFAOYSA-N	0	0	273.420	4.132	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)c1cccc(F)c1Cl	ZINC000189953640	262177734	/nfs/dbraw/zinc/17/77/34/262177734.db2.gz	IAUFTVXWQBKUHT-UHFFFAOYSA-N	0	0	296.773	4.024	20	30		CIEDRN
N#CCCCSCc1cccc(OCC(F)(F)F)c1	ZINC000190919781	262187301	/nfs/dbraw/zinc/18/73/01/262187301.db2.gz	AZFIQTTWPGTCBP-UHFFFAOYSA-N	0	0	289.322	4.165	20	30		CIEDRN
CCCCCCCC(=O)N1CCC[C@@H]1c1nccs1	ZINC000364236731	262189224	/nfs/dbraw/zinc/18/92/24/262189224.db2.gz	ILXUJOOZHRZCPI-CYBMUJFWSA-N	0	0	280.437	4.167	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)NCCCCC#N	ZINC000191472547	262192446	/nfs/dbraw/zinc/19/24/46/262192446.db2.gz	NPDDNKHLHRPGLQ-UHFFFAOYSA-N	0	0	299.418	4.354	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H]1c1ccc(C)cc1	ZINC000364300137	262197127	/nfs/dbraw/zinc/19/71/27/262197127.db2.gz	AZMHGMGFSDBNFV-DOTOQJQBSA-N	0	0	271.404	4.261	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)C[C@@H]1CCC[C@@H](C)C1	ZINC000497796405	262210037	/nfs/dbraw/zinc/21/00/37/262210037.db2.gz	BAAITUGGSZJXDH-SJLPKXTDSA-N	0	0	285.431	4.418	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)C[C@H](C)CCC	ZINC000497796803	262210299	/nfs/dbraw/zinc/21/02/99/262210299.db2.gz	IVLKFJGAJDIZGO-OAHLLOKOSA-N	0	0	259.393	4.028	20	30		CIEDRN
CC(C)OCc1ccc(N[C@H]2CCC[C@@H](C#N)C2)cc1	ZINC000193087059	262216130	/nfs/dbraw/zinc/21/61/30/262216130.db2.gz	RSQMQBNLTAZQAM-WBVHZDCISA-N	0	0	272.392	4.106	20	30		CIEDRN
CCCC(=O)Nc1cccc(N[C@@H]2CCC[C@@H](C#N)C2)c1C	ZINC000193087249	262216227	/nfs/dbraw/zinc/21/62/27/262216227.db2.gz	VZYHMHIYXHRCGG-HUUCEWRRSA-N	0	0	299.418	4.228	20	30		CIEDRN
Cc1ncc(-c2ccc(N[C@@H]3CCC[C@H](C#N)C3)cc2)o1	ZINC000193139642	262217144	/nfs/dbraw/zinc/21/71/44/262217144.db2.gz	SNJVIYBUNJLZRR-XJKSGUPXSA-N	0	0	281.359	4.144	20	30		CIEDRN
Cc1ncc(-c2ccc(N[C@H]3CCC[C@@H](C#N)C3)cc2)o1	ZINC000193139680	262217190	/nfs/dbraw/zinc/21/71/90/262217190.db2.gz	SNJVIYBUNJLZRR-CJNGLKHVSA-N	0	0	281.359	4.144	20	30		CIEDRN
Cc1coc(-c2cc(N[C@@H]3CCC[C@H](C#N)C3)ccc2C)n1	ZINC000193269163	262219389	/nfs/dbraw/zinc/21/93/89/262219389.db2.gz	VCACKMQDJHYNAC-LSDHHAIUSA-N	0	0	295.386	4.453	20	30		CIEDRN
CC(F)(F)c1cccc(N[C@H]2CCC[C@@H](C#N)C2)c1	ZINC000193322726	262220475	/nfs/dbraw/zinc/22/04/75/262220475.db2.gz	RJBMNLPXRYKNJF-YPMHNXCESA-N	0	0	264.319	4.293	20	30		CIEDRN
CC(F)(F)c1cccc(N[C@@H]2CCC[C@H](C#N)C2)c1	ZINC000193322695	262220525	/nfs/dbraw/zinc/22/05/25/262220525.db2.gz	RJBMNLPXRYKNJF-WCQYABFASA-N	0	0	264.319	4.293	20	30		CIEDRN
C=C(C)CSCc1nc(-c2ccccc2)oc1C	ZINC000497853225	262220661	/nfs/dbraw/zinc/22/06/61/262220661.db2.gz	NIRRYJDBZCWCFQ-UHFFFAOYSA-N	0	0	259.374	4.459	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@H](c3ccccc3)[C@@H](C)C2)CCC1	ZINC000188165714	262225820	/nfs/dbraw/zinc/22/58/20/262225820.db2.gz	IXSBSVCNLWQAEY-WMZOPIPTSA-N	0	0	297.442	4.385	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1nsc2ccc(C)cc21	ZINC000497936333	262235581	/nfs/dbraw/zinc/23/55/81/262235581.db2.gz	GRSKXZVUDZVFEP-LBPRGKRZSA-N	0	0	288.416	4.079	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@H](OC(C)C)c1ccccc1	ZINC000497938937	262236170	/nfs/dbraw/zinc/23/61/70/262236170.db2.gz	SOGWNZLZWJBYJN-DOTOQJQBSA-N	0	0	289.419	4.014	20	30		CIEDRN
C=CCC(C)(C)C(=O)N(C)c1ccc(F)c(Cl)c1	ZINC000498015755	262248181	/nfs/dbraw/zinc/24/81/81/262248181.db2.gz	NJSUIQLMWKRZTN-UHFFFAOYSA-N	0	0	269.747	4.044	20	30		CIEDRN
CC[C@@H](CC#N)NCc1ccc(F)c(-c2cccs2)c1	ZINC000054183971	262259776	/nfs/dbraw/zinc/25/97/76/262259776.db2.gz	XCZNXZXFNKBJGF-ZDUSSCGKSA-N	0	0	288.391	4.336	20	30		CIEDRN
CC[C@H](CC#N)NCc1ccc(SC(F)(F)F)cc1	ZINC000054182012	262260212	/nfs/dbraw/zinc/26/02/12/262260212.db2.gz	AAQXFMUCOXQTKY-LLVKDONJSA-N	0	0	288.338	4.080	20	30		CIEDRN
C=CCN(C(=O)c1oc(CC(C)C)nc1C)c1ccccc1	ZINC000188429815	262296615	/nfs/dbraw/zinc/29/66/15/262296615.db2.gz	YMGOAWGBMJCGFO-UHFFFAOYSA-N	0	0	298.386	4.014	20	30		CIEDRN
C[C@H](CC#N)N(C)C(=O)c1ccc(C(C)(C)C)c(Cl)c1	ZINC000354820382	262296814	/nfs/dbraw/zinc/29/68/14/262296814.db2.gz	MEMGRTZQWODILP-LLVKDONJSA-N	0	0	292.810	4.012	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](C)c1ccc(Cl)cc1	ZINC000184909266	262299986	/nfs/dbraw/zinc/29/99/86/262299986.db2.gz	ZDCNLLPAADUEQF-NEPJUHHUSA-N	0	0	265.784	4.120	20	30		CIEDRN
CC(C)Oc1ccc2ccccc2c1CN(C)[C@@H](C)CC#N	ZINC000161794141	262319456	/nfs/dbraw/zinc/31/94/56/262319456.db2.gz	OHAQRDGZEOKWIV-HNNXBMFYSA-N	0	0	296.414	4.361	20	30		CIEDRN
C=CCCCS[C@H](C)C(=O)Nc1cccc(C)c1C	ZINC000522756902	262338731	/nfs/dbraw/zinc/33/87/31/262338731.db2.gz	MOELGYRYXCDECI-CQSZACIVSA-N	0	0	277.433	4.330	20	30		CIEDRN
C=CCCCS[C@H](C)C(=O)Nc1ccc(C)c(F)c1	ZINC000522757741	262339106	/nfs/dbraw/zinc/33/91/06/262339106.db2.gz	RUORARANXIUWBM-GFCCVEGCSA-N	0	0	281.396	4.161	20	30		CIEDRN
C=CCCCSCc1cccc(C(=O)NCC(C)C)c1	ZINC000522758923	262339019	/nfs/dbraw/zinc/33/90/19/262339019.db2.gz	XMPCISWDBBZCGC-UHFFFAOYSA-N	0	0	291.460	4.272	20	30		CIEDRN
C=CCCCS[C@@H](C)C(=O)Nc1ccc(C)c(F)c1	ZINC000522757742	262339220	/nfs/dbraw/zinc/33/92/20/262339220.db2.gz	RUORARANXIUWBM-LBPRGKRZSA-N	0	0	281.396	4.161	20	30		CIEDRN
C=CCOc1ccc(CNc2cc(C)cc(C)c2)cc1	ZINC000021024962	262374470	/nfs/dbraw/zinc/37/44/70/262374470.db2.gz	KBGJKARNJAXDLT-UHFFFAOYSA-N	0	0	267.372	4.480	20	30		CIEDRN
CCSc1cccc(CNc2ccc(C#N)cc2)c1	ZINC000488680516	262380590	/nfs/dbraw/zinc/38/05/90/262380590.db2.gz	ZHLXHTBOEPPLJW-UHFFFAOYSA-N	0	0	268.385	4.282	20	30		CIEDRN
CN(CCCSCC#N)c1ccc(-c2ccccc2)cc1	ZINC000525821294	262384006	/nfs/dbraw/zinc/38/40/06/262384006.db2.gz	GECKODNQYUHTJB-UHFFFAOYSA-N	0	0	296.439	4.437	20	30		CIEDRN
C=CCNC(=O)N(Cc1ccccc1)[C@H](C)c1ccccc1	ZINC000461114839	262393145	/nfs/dbraw/zinc/39/31/45/262393145.db2.gz	RACZMGBIHZBPPI-MRXNPFEDSA-N	0	0	294.398	4.145	20	30		CIEDRN
N#Cc1c(F)cccc1N[C@@H]1CCCc2sccc21	ZINC000061325874	262393993	/nfs/dbraw/zinc/39/39/93/262393993.db2.gz	GJHJLCCQYSKYOC-CYBMUJFWSA-N	0	0	272.348	4.248	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)c1coc(C)c1	ZINC000187239139	262394813	/nfs/dbraw/zinc/39/48/13/262394813.db2.gz	ZAFQOUUZEDOTBS-UHFFFAOYSA-N	0	0	295.791	4.131	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1ccc(OC(C)C)cc1Cl	ZINC000187242254	262395153	/nfs/dbraw/zinc/39/51/53/262395153.db2.gz	BCGOVQUACFAORK-LLVKDONJSA-N	0	0	296.798	4.213	20	30		CIEDRN
C=CC1CCN(C(=O)c2ccc(C3=CCCC3)cc2)CC1	ZINC000354205199	262554469	/nfs/dbraw/zinc/55/44/69/262554469.db2.gz	QFWDSACCUADRAF-UHFFFAOYSA-N	0	0	281.399	4.292	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cc(C)c(F)cc1Cl	ZINC000410852570	262669872	/nfs/dbraw/zinc/66/98/72/262669872.db2.gz	LOMFHNDRDKTDGO-UHFFFAOYSA-N	0	0	269.747	4.328	20	30		CIEDRN
CC(C)N(C(=O)c1sccc1C#N)[C@H](C)c1ccccc1	ZINC000410896061	262670815	/nfs/dbraw/zinc/67/08/15/262670815.db2.gz	KJTJEKMCHPQDRW-CYBMUJFWSA-N	0	0	298.411	4.232	20	30		CIEDRN
CC(C)C[C@H](C)C(=O)Nc1ccc(Cl)cc1CC#N	ZINC000410971622	262674170	/nfs/dbraw/zinc/67/41/70/262674170.db2.gz	SLCFIHFLLHOFNN-NSHDSACASA-N	0	0	278.783	4.027	20	30		CIEDRN
CC(C)(C)c1cc(C#N)c(NC(=O)Cc2ccccc2)s1	ZINC000411005152	262674893	/nfs/dbraw/zinc/67/48/93/262674893.db2.gz	FIEOSIFOSVLGQY-UHFFFAOYSA-N	0	0	298.411	4.098	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cc(-c2ncc[nH]2)ccc1C	ZINC000366525542	262685051	/nfs/dbraw/zinc/68/50/51/262685051.db2.gz	WPUNUILNIGGQEF-UHFFFAOYSA-N	0	0	295.386	4.092	20	30		CIEDRN
C[C@H]1CCC(=O)[C@@H](Sc2ccc(C#N)cc2Cl)C1	ZINC000450871565	262693450	/nfs/dbraw/zinc/69/34/50/262693450.db2.gz	RFDSKGLODURRCK-XPTSAGLGSA-N	0	0	279.792	4.061	20	30		CIEDRN
C=CC[C@@H](Cc1ccccc1)NC(=O)[C@H](C)c1ccsc1	ZINC000412837128	262743598	/nfs/dbraw/zinc/74/35/98/262743598.db2.gz	HBZBGRVDJIYAKQ-PBHICJAKSA-N	0	0	299.439	4.155	20	30		CIEDRN
C=CC[C@H](Cc1ccccc1)NC(=O)C1(CC=C)CCC1	ZINC000413989511	262796740	/nfs/dbraw/zinc/79/67/40/262796740.db2.gz	RABSEFVWELVMPV-QGZVFWFLSA-N	0	0	283.415	4.036	20	30		CIEDRN
Cc1ccccc1C[S@@](=O)CCC1(C#N)CCCCC1	ZINC000414242420	262822439	/nfs/dbraw/zinc/82/24/39/262822439.db2.gz	PUHPVNQRZMNBDG-FQEVSTJZSA-N	0	0	289.444	4.108	20	30		CIEDRN
CCC1CCC(N(C)C(=O)Nc2ccc(CC#N)cc2)CC1	ZINC000264015981	262858373	/nfs/dbraw/zinc/85/83/73/262858373.db2.gz	COHCGYACNJUTGB-UHFFFAOYSA-N	0	0	299.418	4.185	20	30		CIEDRN
Cc1nc(C)c(CSCCCC(C)(C)C#N)s1	ZINC000268722784	262956886	/nfs/dbraw/zinc/95/68/86/262956886.db2.gz	JBUUIZITJMNODX-UHFFFAOYSA-N	0	0	268.451	4.323	20	30		CIEDRN
CSc1ccc(C)c(NC(=O)C2(C#N)CCCCC2)c1	ZINC000271910680	263000041	/nfs/dbraw/zinc/00/00/41/263000041.db2.gz	IMNRVWNCIQKVDW-UHFFFAOYSA-N	0	0	288.416	4.130	20	30		CIEDRN
Cc1ccc(Cl)c2ccc(N3CCC(C)(C#N)CC3)nc12	ZINC000272587039	263007371	/nfs/dbraw/zinc/00/73/71/263007371.db2.gz	ZHEDTJCTSUMBQT-UHFFFAOYSA-N	0	0	299.805	4.327	20	30		CIEDRN
N#CCCN(Cc1ccc(Cl)cc1Cl)CC1CC1	ZINC000353417613	263021545	/nfs/dbraw/zinc/02/15/45/263021545.db2.gz	UXISKZXWSBIRNI-UHFFFAOYSA-N	0	0	283.202	4.119	20	30		CIEDRN
N#C[C@H]1CCC[C@H](Nc2ccc(N3CCCCC3)cc2)C1	ZINC000274220705	263022107	/nfs/dbraw/zinc/02/21/07/263022107.db2.gz	PQSRWTBYLBJLAW-RDJZCZTQSA-N	0	0	283.419	4.171	20	30		CIEDRN
CC(C)(C)[C@](C)(C#N)NC(=O)c1ccc(Cl)cc1Cl	ZINC000274330457	263023141	/nfs/dbraw/zinc/02/31/41/263023141.db2.gz	LZAZRJQTSYJVMQ-AWEZNQCLSA-N	0	0	299.201	4.052	20	30		CIEDRN
C[C@H](CCC(=O)N[C@](C)(C#N)C(C)(C)C)c1ccccc1	ZINC000274321113	263023228	/nfs/dbraw/zinc/02/32/28/263023228.db2.gz	KIRYNUPAFZPTSH-RDTXWAMCSA-N	0	0	286.419	4.015	20	30		CIEDRN
C[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(Cl)cn1	ZINC000274819111	263030958	/nfs/dbraw/zinc/03/09/58/263030958.db2.gz	BHRMQBDCSRPPLC-GUYCJALGSA-N	0	0	299.805	4.431	20	30		CIEDRN
CC[C@H](C#N)Nc1ccccc1COCc1ccccc1	ZINC000275464048	263033294	/nfs/dbraw/zinc/03/32/94/263033294.db2.gz	KSAVZRYRGYBGTB-QGZVFWFLSA-N	0	0	280.371	4.117	20	30		CIEDRN
CO[C@H](C)c1nc(CSCCC(C)(C)C#N)cs1	ZINC000276618227	263037371	/nfs/dbraw/zinc/03/73/71/263037371.db2.gz	NEBJSTSKKXHSDF-SNVBAGLBSA-N	0	0	284.450	4.024	20	30		CIEDRN
N#CCCCCSCc1ccc(C(F)(F)F)cn1	ZINC000277537241	263041876	/nfs/dbraw/zinc/04/18/76/263041876.db2.gz	DVBGISYKNJWAPZ-UHFFFAOYSA-N	0	0	274.311	4.027	20	30		CIEDRN
CC(C)(C#N)CCSCc1ccc(C(F)(F)F)cn1	ZINC000277787705	263043195	/nfs/dbraw/zinc/04/31/95/263043195.db2.gz	HBZDYWRREUYHNJ-UHFFFAOYSA-N	0	0	288.338	4.273	20	30		CIEDRN
C[C@@H](c1ccccc1)[S@@](=O)CCCCC(C)(C)C#N	ZINC000277850155	263043935	/nfs/dbraw/zinc/04/39/35/263043935.db2.gz	LISQPOKDWDNWBD-LIRRHRJNSA-N	0	0	277.433	4.216	20	30		CIEDRN
C[C@@H](c1ccccc1)[S@](=O)CCCCC(C)(C)C#N	ZINC000277850151	263044000	/nfs/dbraw/zinc/04/40/00/263044000.db2.gz	LISQPOKDWDNWBD-IFXJQAMLSA-N	0	0	277.433	4.216	20	30		CIEDRN
CCc1noc(C)c1CSCCCCC(C)(C)C#N	ZINC000277870176	263044193	/nfs/dbraw/zinc/04/41/93/263044193.db2.gz	MJCFYWQVSOHBFS-UHFFFAOYSA-N	0	0	280.437	4.499	20	30		CIEDRN
N#C[C@@H]1CC[C@@H](Sc2ccc3ccccc3n2)C1	ZINC000278566800	263049093	/nfs/dbraw/zinc/04/90/93/263049093.db2.gz	NDUSDHPEAUPFQL-DGCLKSJQSA-N	0	0	254.358	4.019	20	30		CIEDRN
CC(C)Oc1cccc([C@@H](C)OC(=O)CC(C)(C)C#N)c1	ZINC000278824915	263051154	/nfs/dbraw/zinc/05/11/54/263051154.db2.gz	QBNAMWYHJHTJGR-CYBMUJFWSA-N	0	0	289.375	4.018	20	30		CIEDRN
CC(C)Sc1ccccc1NC(=O)CC(C)(C)C#N	ZINC000279085107	263052769	/nfs/dbraw/zinc/05/27/69/263052769.db2.gz	VOZYYFDHIXUDHE-UHFFFAOYSA-N	0	0	276.405	4.065	20	30		CIEDRN
CCC1(CC)CCN(C(=O)c2ccc(C(C)(C)C#N)cc2)C1	ZINC000279827494	263057631	/nfs/dbraw/zinc/05/76/31/263057631.db2.gz	IQKNSGSXEFQYGT-UHFFFAOYSA-N	0	0	298.430	4.140	20	30		CIEDRN
CCCN(C(=O)c1ccc(C(C)(C)C#N)cc1)C(C)(C)C	ZINC000280393761	263060969	/nfs/dbraw/zinc/06/09/69/263060969.db2.gz	QQJOYBYATHATJJ-UHFFFAOYSA-N	0	0	286.419	4.138	20	30		CIEDRN
CC(C)[C@H](C)N(C(=O)c1ccc(C(C)(C)C#N)cc1)C1CC1	ZINC000280631392	263063364	/nfs/dbraw/zinc/06/33/64/263063364.db2.gz	QNRYHJQKSWEGDB-AWEZNQCLSA-N	0	0	298.430	4.137	20	30		CIEDRN
CC(C)(C)[C@H]1CCCN(C(=O)Nc2ccc(CC#N)cc2)C1	ZINC000280626899	263063367	/nfs/dbraw/zinc/06/33/67/263063367.db2.gz	UELOEIHYRXZGGV-HNNXBMFYSA-N	0	0	299.418	4.043	20	30		CIEDRN
CC(C)c1ccc(NCCCC2(C#N)CCOCC2)cc1	ZINC000280966442	263065321	/nfs/dbraw/zinc/06/53/21/263065321.db2.gz	HLIVBEUJEPGQDP-UHFFFAOYSA-N	0	0	286.419	4.322	20	30		CIEDRN
Cc1ccc(C)c(SCCCC2(C#N)CCOCC2)c1	ZINC000281094163	263066546	/nfs/dbraw/zinc/06/65/46/263066546.db2.gz	XRXGCXOLKBCWOI-UHFFFAOYSA-N	0	0	289.444	4.496	20	30		CIEDRN
N#CC1(CCCOc2ccc3ccccc3c2)CCOCC1	ZINC000281395314	263068554	/nfs/dbraw/zinc/06/85/54/263068554.db2.gz	QCXFYXSBQIVHOM-UHFFFAOYSA-N	0	0	295.382	4.319	20	30		CIEDRN
Cc1ccc(N(CCC#N)C(=O)c2ccoc2C2CC2)cc1	ZINC000281434687	263069168	/nfs/dbraw/zinc/06/91/68/263069168.db2.gz	CJXYIRPFMGJCCT-UHFFFAOYSA-N	0	0	294.354	4.026	20	30		CIEDRN
N#CCN(C(=O)c1cccc(C2CCC2)c1)c1ccccc1	ZINC000282036874	263073933	/nfs/dbraw/zinc/07/39/33/263073933.db2.gz	ZPVJIPFYXWYLGQ-UHFFFAOYSA-N	0	0	290.366	4.124	20	30		CIEDRN
N#CC1CCC(CNC(=O)c2cccc(C3CCC3)c2)CC1	ZINC000282544032	263077225	/nfs/dbraw/zinc/07/72/25/263077225.db2.gz	AXIQWSIRULKRNZ-UHFFFAOYSA-N	0	0	296.414	4.014	20	30		CIEDRN
CO[C@@H](CSCCCC(C)(C)C#N)c1ccccc1	ZINC000283370277	263082554	/nfs/dbraw/zinc/08/25/54/263082554.db2.gz	LZZMLDHTXGYHBR-HNNXBMFYSA-N	0	0	277.433	4.437	20	30		CIEDRN
N#CCCN1CCCC[C@H]1c1ccccc1C(F)(F)F	ZINC000340177591	263083359	/nfs/dbraw/zinc/08/33/59/263083359.db2.gz	RMFHNMIVROGYOY-AWEZNQCLSA-N	0	0	282.309	4.146	20	30		CIEDRN
C=CCC1(C(=O)N2CC(C)(C)[C@H]2C(C)C)CCCC1	ZINC000452408904	263086950	/nfs/dbraw/zinc/08/69/50/263086950.db2.gz	PZWYJTBVGHUDQQ-CQSZACIVSA-N	0	0	263.425	4.016	20	30		CIEDRN
CCCc1cccc(C(C)C)c1NC(=O)N1CC(C)(C#N)C1	ZINC000284683477	263087589	/nfs/dbraw/zinc/08/75/89/263087589.db2.gz	OEFPTUNBNADNHV-UHFFFAOYSA-N	0	0	299.418	4.140	20	30		CIEDRN
CCC(C)(C)c1ccc(C[S@@](=O)CCCCC#N)cc1	ZINC000285118934	263090189	/nfs/dbraw/zinc/09/01/89/263090189.db2.gz	NCECNGLTDLMJPP-FQEVSTJZSA-N	0	0	291.460	4.317	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)O[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000285607393	263094561	/nfs/dbraw/zinc/09/45/61/263094561.db2.gz	IYSNZGJNAZKYGE-QMTHXVAHSA-N	0	0	299.292	4.249	20	30		CIEDRN
Cc1ccnc([C@H](C)Nc2cccc(OCCCC#N)c2)c1	ZINC000286002659	263096767	/nfs/dbraw/zinc/09/67/67/263096767.db2.gz	HPZNRCWBGWKKRV-HNNXBMFYSA-N	0	0	295.386	4.246	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)N[C@@H](C)c1cc(Cl)ccc1Cl	ZINC000286667707	263099081	/nfs/dbraw/zinc/09/90/81/263099081.db2.gz	DBWMUUCYFWBNQC-XPTSAGLGSA-N	0	0	299.201	4.110	20	30		CIEDRN
CC[C@@H]([NH2+]CCCC#N)c1cc(Cl)cc(Cl)c1[O-]	ZINC000287812993	263102741	/nfs/dbraw/zinc/10/27/41/263102741.db2.gz	UUPHOEWSUQQDCS-GFCCVEGCSA-N	0	0	287.190	4.043	20	30		CIEDRN
Cc1ncsc1CO/N=C/c1ccc(C(C)C)cc1	ZINC000289329457	263109318	/nfs/dbraw/zinc/10/93/18/263109318.db2.gz	DIVIMDAHIFHVJL-CAOOACKPSA-N	0	0	274.389	4.126	20	30		CIEDRN
C[C@@H](c1noc(-c2ccc(C(C)(C)C#N)cc2)n1)C1CC1	ZINC000290028860	263114049	/nfs/dbraw/zinc/11/40/49/263114049.db2.gz	HZMZJHQCNIISHC-LLVKDONJSA-N	0	0	281.359	4.051	20	30		CIEDRN
CC(C)CN(C(=O)CCCC#N)c1ccc(Cl)cc1	ZINC000291232739	263120970	/nfs/dbraw/zinc/12/09/70/263120970.db2.gz	AIEZKZXJTVOOQV-UHFFFAOYSA-N	0	0	278.783	4.023	20	30		CIEDRN
Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)CCCC#N	ZINC000291849473	263126010	/nfs/dbraw/zinc/12/60/10/263126010.db2.gz	GITDWYFYAYPVQW-HNNXBMFYSA-N	0	0	299.418	4.006	20	30		CIEDRN
Cc1cc(NCCC(C)(C)C#N)ccc1-c1ccncc1	ZINC000292152164	263129134	/nfs/dbraw/zinc/12/91/34/263129134.db2.gz	VKFLDMZTBRARKU-UHFFFAOYSA-N	0	0	279.387	4.409	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H](C)c1cccc(OC(F)F)c1	ZINC000292252149	263130070	/nfs/dbraw/zinc/13/00/70/263130070.db2.gz	MJUSIOPRCNJTKC-LLVKDONJSA-N	0	0	297.345	4.068	20	30		CIEDRN
N#CCCCC(=O)N1CCCCC[C@H]1/C=C/c1ccccc1	ZINC000292285767	263130536	/nfs/dbraw/zinc/13/05/36/263130536.db2.gz	LZMIIKBKPYMCSF-JKGDOXCYSA-N	0	0	296.414	4.165	20	30		CIEDRN
Cc1nc2ccccc2c(NC(=O)CCCC#N)c1C(C)C	ZINC000292456338	263132491	/nfs/dbraw/zinc/13/24/91/263132491.db2.gz	WJXDONFFJYOLPP-UHFFFAOYSA-N	0	0	295.386	4.299	20	30		CIEDRN
Cc1ccc(NC(=O)[C@]2(C#N)CC23CCCC3)c(Cl)c1	ZINC000294315416	263159797	/nfs/dbraw/zinc/15/97/97/263159797.db2.gz	YYKRVFJAOCZYBN-MRXNPFEDSA-N	0	0	288.778	4.061	20	30		CIEDRN
N#CC[C@@H]1CC[C@H](Nc2ccc(C(F)(F)F)cc2C#N)C1	ZINC000295032843	263171138	/nfs/dbraw/zinc/17/11/38/263171138.db2.gz	RZKFWCHVRHUOBQ-GWCFXTLKSA-N	0	0	293.292	4.071	20	30		CIEDRN
Cc1[nH]c(S[C@H]2CC[C@H](C#N)C2)nc1-c1ccccc1	ZINC000295154817	263173537	/nfs/dbraw/zinc/17/35/37/263173537.db2.gz	GMSWHHXUTDBRLJ-JSGCOSHPSA-N	0	0	283.400	4.170	20	30		CIEDRN
CC[C@H](CC(=O)N[C@H]1CC[C@@H](CC#N)C1)c1ccc(C)cc1	ZINC000295554226	263179321	/nfs/dbraw/zinc/17/93/21/263179321.db2.gz	MWONJFCYCCDXOI-JZXOWHBKSA-N	0	0	298.430	4.077	20	30		CIEDRN
CC(C)(C)Sc1ccc(NC(=O)C(C)(C)C#N)cc1F	ZINC000295551257	263179442	/nfs/dbraw/zinc/17/94/42/263179442.db2.gz	MHWGPFKZDFBVMZ-UHFFFAOYSA-N	0	0	294.395	4.205	20	30		CIEDRN
Cc1cnc(/C=C2/C(=O)c3cccc(C)c3[C@@H]2C)s1	ZINC000295768522	263181758	/nfs/dbraw/zinc/18/17/58/263181758.db2.gz	BNIDANXXUANNBH-ZTFCMROMSA-N	0	0	269.369	4.143	20	30		CIEDRN
Cc1cnc(/C=C2\C(=O)c3ccccc3C2(C)C)s1	ZINC000295829398	263182867	/nfs/dbraw/zinc/18/28/67/263182867.db2.gz	HBEWJZWZKHPPTI-MDWZMJQESA-N	0	0	269.369	4.009	20	30		CIEDRN
Cc1cc(C(F)(F)F)c(C#N)c(S[C@H](C)CCC#N)n1	ZINC000298318864	263217963	/nfs/dbraw/zinc/21/79/63/263217963.db2.gz	NGLMDELRPILXAS-SECBINFHSA-N	0	0	299.321	4.065	20	30		CIEDRN
Cc1cc(C(F)(F)F)c(C#N)c(S[C@@H](C)CCC#N)n1	ZINC000298318868	263218027	/nfs/dbraw/zinc/21/80/27/263218027.db2.gz	NGLMDELRPILXAS-VIFPVBQESA-N	0	0	299.321	4.065	20	30		CIEDRN
C=C[C@@](C)(CCOC)C(=O)Nc1cccc2ccccc21	ZINC000187745715	263268209	/nfs/dbraw/zinc/26/82/09/263268209.db2.gz	MSIUCCDIWZCSQG-SFHVURJKSA-N	0	0	283.371	4.007	20	30		CIEDRN
N#CCC[C@H](Nc1ccc(C#N)cc1F)c1ccccc1	ZINC000164277457	263270495	/nfs/dbraw/zinc/27/04/95/263270495.db2.gz	VAKVVNSWMHTFMN-INIZCTEOSA-N	0	0	279.318	4.154	20	30		CIEDRN
C#CCCCCC(=O)Nc1ccccc1OC1CCCC1	ZINC000119636955	263275976	/nfs/dbraw/zinc/27/59/76/263275976.db2.gz	LXNIEPRVWUMEKZ-UHFFFAOYSA-N	0	0	285.387	4.140	20	30		CIEDRN
C#CCCCCC(=O)Nc1ccc(CCC(F)(F)F)cc1	ZINC000119980341	263280966	/nfs/dbraw/zinc/28/09/66/263280966.db2.gz	SOZKGBHUFDPAOL-UHFFFAOYSA-N	0	0	297.320	4.314	20	30		CIEDRN
C#CCCCCC(=O)N1CC[C@H](C)C[C@H]1c1ccc(C)o1	ZINC000120229067	263283966	/nfs/dbraw/zinc/28/39/66/263283966.db2.gz	CRYHESRSOMDTOI-HOCLYGCPSA-N	0	0	287.403	4.081	20	30		CIEDRN
C#CCCCCC(=O)N1CCCC[C@@H]1c1ccc(C)cc1	ZINC000120204555	263284875	/nfs/dbraw/zinc/28/48/75/263284875.db2.gz	XEKFNJQNTVNKPS-GOSISDBHSA-N	0	0	283.415	4.242	20	30		CIEDRN
CC(C)(C)c1nccc(N[C@@H](CCC#N)c2ccccc2)n1	ZINC000164337639	263285734	/nfs/dbraw/zinc/28/57/34/263285734.db2.gz	XCZBDJHIPDWQOG-HNNXBMFYSA-N	0	0	294.402	4.231	20	30		CIEDRN
N#CCC[C@H](Nc1ccc(F)cc1[N+](=O)[O-])c1ccccc1	ZINC000164348151	263287434	/nfs/dbraw/zinc/28/74/34/263287434.db2.gz	RZQLSQJVRVTKBP-AWEZNQCLSA-N	0	0	299.305	4.191	20	30		CIEDRN
N#CCC[C@H](Nc1ccc(Cl)c(C#N)n1)c1ccccc1	ZINC000164353680	263289330	/nfs/dbraw/zinc/28/93/30/263289330.db2.gz	MYUPGBWBKVCQTK-AWEZNQCLSA-N	0	0	296.761	4.064	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)c1ccccc1	ZINC000045603623	263301088	/nfs/dbraw/zinc/30/10/88/263301088.db2.gz	VJJMAWZSHHESRG-UHFFFAOYSA-N	0	0	291.803	4.230	20	30		CIEDRN
CC(C)c1ccc2occ(C(=O)N(C)C3(C#N)CCC3)c2c1	ZINC000341105711	263322250	/nfs/dbraw/zinc/32/22/50/263322250.db2.gz	QKNSIYXOYHIIEM-UHFFFAOYSA-N	0	0	296.370	4.074	20	30		CIEDRN
CCCCCCCCCC(=O)N1CC[C@H]([C@H]2CCOC2)C1	ZINC000366723831	263327573	/nfs/dbraw/zinc/32/75/73/263327573.db2.gz	ZBTBUISTRIGNFO-IRXDYDNUSA-N	0	0	295.467	4.012	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N[C@@H](CC)c1ccc(F)cc1F	ZINC000341505822	263339698	/nfs/dbraw/zinc/33/96/98/263339698.db2.gz	ZYPQIXNFERPCQY-WFASDCNBSA-N	0	0	296.361	4.070	20	30		CIEDRN
CCO[C@@H](C)c1nc(CSCCC(C)(C)C#N)cs1	ZINC000341972813	263372979	/nfs/dbraw/zinc/37/29/79/263372979.db2.gz	VWORSMPXBFMWOT-NSHDSACASA-N	0	0	298.477	4.414	20	30		CIEDRN
C=C1CCN(C(=O)c2cn(CC(C)C)c3ccccc23)CC1	ZINC000342088844	263391215	/nfs/dbraw/zinc/39/12/15/263391215.db2.gz	FZEYKEFXGGGMMI-UHFFFAOYSA-N	0	0	296.414	4.090	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@@H](CC(C)C)c1ccccc1	ZINC000342503146	263443367	/nfs/dbraw/zinc/44/33/67/263443367.db2.gz	CTJAHHNCDLIXDF-HOCLYGCPSA-N	0	0	274.408	4.038	20	30		CIEDRN
CCN(CCC#N)C(=O)N(c1ccccc1)c1ccccc1	ZINC000342564573	263448311	/nfs/dbraw/zinc/44/83/11/263448311.db2.gz	HFNCSKLATXLPNI-UHFFFAOYSA-N	0	0	293.370	4.180	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)Nc1cc(Cl)c(Cl)cc1F	ZINC000334179520	263499853	/nfs/dbraw/zinc/49/98/53/263499853.db2.gz	CZBSRVKVVDDQBE-LBPRGKRZSA-N	0	0	289.137	4.011	20	30		CIEDRN
N#Cc1ccnc(N2CCC[C@H]2c2ccsc2)c1Cl	ZINC000334320007	263575959	/nfs/dbraw/zinc/57/59/59/263575959.db2.gz	VFPXGOITHBETHV-LBPRGKRZSA-N	0	0	289.791	4.010	20	30		CIEDRN
C[C@@H](Nc1ccc2ccn(C)c2c1)c1cccc(C#N)c1	ZINC000188019433	263617396	/nfs/dbraw/zinc/61/73/96/263617396.db2.gz	CCXCEXQBXJXHCN-CYBMUJFWSA-N	0	0	275.355	4.223	20	30		CIEDRN
Cc1nsc(NCc2ccc(C3CCC3)cc2)c1C#N	ZINC000343225326	263787089	/nfs/dbraw/zinc/78/70/89/263787089.db2.gz	IKLYYQYOKJBLPW-UHFFFAOYSA-N	0	0	283.400	4.203	20	30		CIEDRN
CC(C)(C)[C@@H]1CCC[C@@H]1NC(=O)Nc1cccc(CC#N)c1	ZINC000417214926	263788907	/nfs/dbraw/zinc/78/89/07/263788907.db2.gz	VZNJIIKRHHKNKE-CVEARBPZSA-N	0	0	299.418	4.089	20	30		CIEDRN
CC(C)Sc1ccc([C@H](C)Nc2cnc(C#N)cn2)cc1	ZINC000123754138	263814374	/nfs/dbraw/zinc/81/43/74/263814374.db2.gz	SDAKGCFWHHNCEG-LBPRGKRZSA-N	0	0	298.415	4.022	20	30		CIEDRN
C[C@@H](Sc1ccc(C#N)cc1)c1nc(C(C)(C)C)no1	ZINC000048511979	263817974	/nfs/dbraw/zinc/81/79/74/263817974.db2.gz	USRFBMNTRVFKHJ-SNVBAGLBSA-N	0	0	287.388	4.092	20	30		CIEDRN
Cc1noc([C@H](C)NC(=O)[C@@H]2CC[C@@H]3CCCC[C@H]3C2)n1	ZINC000328795103	263872825	/nfs/dbraw/zinc/87/28/25/263872825.db2.gz	SZLHSCCNYQKZET-DOERSZECSA-N	0	0	291.395	4.002	20	30		CIEDRN
N#CC1(NC(=O)C[C@@H]2CCc3ccccc3C2)CCCCC1	ZINC000328795958	263872891	/nfs/dbraw/zinc/87/28/91/263872891.db2.gz	CUHDJHRUSOYYFX-OAHLLOKOSA-N	0	0	296.414	4.365	20	30		CIEDRN
C=CCC[C@@H](NC(=O)N1CCCC[C@@H]1C=C)c1ccccc1	ZINC000425932652	263914897	/nfs/dbraw/zinc/91/48/97/263914897.db2.gz	QVRYBGQCMIBXAW-ZWKOTPCHSA-N	0	0	298.430	4.444	20	30		CIEDRN
CCCc1nc(C)c(C(=O)N[C@@](C)(C#N)CC(C)C)s1	ZINC000330478113	263946699	/nfs/dbraw/zinc/94/66/99/263946699.db2.gz	KAXKOLKHADCYOH-OAHLLOKOSA-N	0	0	293.436	4.037	20	30		CIEDRN
CC1=C(C(=O)NCc2cccc(OC(C)(C)C)n2)CCC1	ZINC000330599428	263982365	/nfs/dbraw/zinc/98/23/65/263982365.db2.gz	XMIOQJQCDWWZEN-UHFFFAOYSA-N	0	0	288.391	4.216	20	30		CIEDRN
CC(C)(C)c1ncc(C(=O)Nc2cc(Cl)ccn2)s1	ZINC000330750946	264029404	/nfs/dbraw/zinc/02/94/04/264029404.db2.gz	BNRFRMXTSRVSIP-UHFFFAOYSA-N	0	0	295.795	4.125	20	30		CIEDRN
CCCCc1ccc(NC(=O)N[C@@H]2CCC[C@H]2C#N)cc1	ZINC000330778382	264035030	/nfs/dbraw/zinc/03/50/30/264035030.db2.gz	VIXINPGECJZQMP-GOEBONIOSA-N	0	0	285.391	4.047	20	30		CIEDRN
CC(C)Oc1c(F)cc(NC(=O)NC2CCCC2)cc1F	ZINC000330837351	264051674	/nfs/dbraw/zinc/05/16/74/264051674.db2.gz	WUYQKXSDKWSTOI-UHFFFAOYSA-N	0	0	298.333	4.021	20	30		CIEDRN
Cc1cc([C@@H](C)NC(=O)Nc2ccsc2)c(C)o1	ZINC000330935035	264080550	/nfs/dbraw/zinc/08/05/50/264080550.db2.gz	LIKKHVOMXANPGF-SECBINFHSA-N	0	0	264.350	4.045	20	30		CIEDRN
CCO[C@H](C)c1ncc(C(=O)N[C@H](C)C2CCCC2)s1	ZINC000330925389	264094585	/nfs/dbraw/zinc/09/45/85/264094585.db2.gz	VVZQKESRKVPALB-GHMZBOCLSA-N	0	0	296.436	4.124	20	30		CIEDRN
CC(C)c1ccsc1C(=O)Nc1cnc(C(C)C)nc1	ZINC000331062140	264110863	/nfs/dbraw/zinc/11/08/63/264110863.db2.gz	COIZMTIQQPEIKQ-UHFFFAOYSA-N	0	0	289.404	4.421	20	30		CIEDRN
CC1(C)CCCC[C@H]1NC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000331079138	264116112	/nfs/dbraw/zinc/11/61/12/264116112.db2.gz	XAGISQYZIOKAOG-IAGOWNOFSA-N	0	0	298.430	4.159	20	30		CIEDRN
CCc1cc(C)c(C(=O)Nc2cc(C)c(O)c(C)c2)o1	ZINC000331093571	264120306	/nfs/dbraw/zinc/12/03/06/264120306.db2.gz	YKLFRMSOGRCFOC-UHFFFAOYSA-N	0	0	273.332	4.109	20	30		CIEDRN
C[C@H](c1cccc(C#N)c1)N(C)Cc1ccsc1Cl	ZINC000425363113	264135968	/nfs/dbraw/zinc/13/59/68/264135968.db2.gz	ATYRKXRTEATRTO-LLVKDONJSA-N	0	0	290.819	4.466	20	30		CIEDRN
CC[C@H](C)n1ncc(NC(=O)N[C@@H]2CCCC[C@H]2C)c1C	ZINC000331170314	264145627	/nfs/dbraw/zinc/14/56/27/264145627.db2.gz	ZFHHZELCVLJFCK-MBNYWOFBSA-N	0	0	292.427	4.067	20	30		CIEDRN
CC[C@H](C)n1ncc(NC(=O)N[C@H](C)C2CCCC2)c1C	ZINC000331127883	264147304	/nfs/dbraw/zinc/14/73/04/264147304.db2.gz	OEKWOJRDOTVKOK-NWDGAFQWSA-N	0	0	292.427	4.067	20	30		CIEDRN
CC[C@H](C)n1ncc(NC(=O)N[C@@H](C)C2CCCC2)c1C	ZINC000331127884	264147463	/nfs/dbraw/zinc/14/74/63/264147463.db2.gz	OEKWOJRDOTVKOK-RYUDHWBXSA-N	0	0	292.427	4.067	20	30		CIEDRN
CCc1nc(NC(=O)c2ccc(C(C)C)nc2)sc1C	ZINC000331226067	264150560	/nfs/dbraw/zinc/15/05/60/264150560.db2.gz	FGAMZWONTZVQKW-UHFFFAOYSA-N	0	0	289.404	4.169	20	30		CIEDRN
Cc1cc(C)c(NC(=O)NCCC2=CCCCC2)c(C)n1	ZINC000331228549	264151446	/nfs/dbraw/zinc/15/14/46/264151446.db2.gz	FSNFATPVWMNKMT-UHFFFAOYSA-N	0	0	287.407	4.223	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)N1CCC[C@H]1CC(C)(C)C	ZINC000331211327	264162393	/nfs/dbraw/zinc/16/23/93/264162393.db2.gz	YPPOJPATFOPKKR-HNNXBMFYSA-N	0	0	299.418	4.313	20	30		CIEDRN
Cc1cc(C(=O)Nc2nc(CC(C)(C)C)cs2)co1	ZINC000331266304	264167239	/nfs/dbraw/zinc/16/72/39/264167239.db2.gz	CCVBDHWWIBNFNT-UHFFFAOYSA-N	0	0	278.377	4.269	20	30		CIEDRN
CCOCc1ccc(NC(=O)N[C@@H]2CCC[C@H](C)C2)cc1	ZINC000331237808	264175109	/nfs/dbraw/zinc/17/51/09/264175109.db2.gz	HZVKQMIAIXYLNS-XJKSGUPXSA-N	0	0	290.407	4.128	20	30		CIEDRN
Cc1ccc([C@H](C)NC(=O)Nc2c(C)cc(C)nc2C)cc1	ZINC000331289223	264196400	/nfs/dbraw/zinc/19/64/00/264196400.db2.gz	ATCMZIXBCUWBPQ-AWEZNQCLSA-N	0	0	297.402	4.402	20	30		CIEDRN
CC[C@H](C)[C@@H](C)NC(=O)Nc1cc2[nH]ccc2cc1C	ZINC000331296708	264197853	/nfs/dbraw/zinc/19/78/53/264197853.db2.gz	OATWJSWCEJNGKG-CMPLNLGQSA-N	0	0	273.380	4.237	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(N[C@H]2CCCc3sccc32)c1	ZINC000161065082	264265540	/nfs/dbraw/zinc/26/55/40/264265540.db2.gz	IPZKVNZQMGDHOV-HNNXBMFYSA-N	0	0	296.395	4.312	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1cc(Cl)ccc1F	ZINC000425399415	264276986	/nfs/dbraw/zinc/27/69/86/264276986.db2.gz	DSCQHWRAJSRESG-UHFFFAOYSA-N	0	0	255.720	4.020	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1cc(C)c(Cl)cc1OC	ZINC000425407474	264284272	/nfs/dbraw/zinc/28/42/72/264284272.db2.gz	PONAUSJEXWUFMR-UHFFFAOYSA-N	0	0	281.783	4.198	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1cccc(-c2ccccn2)c1C	ZINC000165487118	264349713	/nfs/dbraw/zinc/34/97/13/264349713.db2.gz	JQRPGTLKAQZVNJ-UHFFFAOYSA-N	0	0	294.398	4.095	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccc(OC(C)C)cc1F	ZINC000077438307	264356244	/nfs/dbraw/zinc/35/62/44/264356244.db2.gz	BEJRWCRQTVKULM-UHFFFAOYSA-N	0	0	294.370	4.043	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1cc(Cl)sc1Cl	ZINC000281209701	264476828	/nfs/dbraw/zinc/47/68/28/264476828.db2.gz	CQRVITALZVVQLD-ZETCQYMHSA-N	0	0	278.204	4.139	20	30		CIEDRN
C#CCCCC(=O)Nc1cc(C(F)(F)F)ccc1Cl	ZINC000192031201	264552943	/nfs/dbraw/zinc/55/29/43/264552943.db2.gz	KFTZMBOUNIOKOG-UHFFFAOYSA-N	0	0	289.684	4.101	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)NC2CCCCCC2)cc1	ZINC000193058038	264612112	/nfs/dbraw/zinc/61/21/12/264612112.db2.gz	KIBILFZLRNGPJM-UHFFFAOYSA-N	0	0	299.418	4.332	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cc(-c2ncco2)ccc1C	ZINC000293403298	264939223	/nfs/dbraw/zinc/93/92/23/264939223.db2.gz	JWNUYOFECNZDJI-UHFFFAOYSA-N	0	0	284.359	4.191	20	30		CIEDRN
CC#CCCCC(=O)N(C)[C@H](C)c1ccccc1Cl	ZINC000185223731	265011019	/nfs/dbraw/zinc/01/10/19/265011019.db2.gz	XCXNHGNSVJAHBP-CYBMUJFWSA-N	0	0	277.795	4.053	20	30		CIEDRN
N#CC1(CSCc2ccc(F)cc2Cl)CC1	ZINC000344480519	265060716	/nfs/dbraw/zinc/06/07/16/265060716.db2.gz	GGKUACMZZPVCQK-UHFFFAOYSA-N	0	0	255.745	4.016	20	30		CIEDRN
N#Cc1csc(CNc2cccc3ccccc32)c1	ZINC000093684866	265189607	/nfs/dbraw/zinc/18/96/07/265189607.db2.gz	VRIIPGCKXUNMJN-UHFFFAOYSA-N	0	0	264.353	4.385	20	30		CIEDRN
N#Cc1ccc(C(F)(F)F)nc1SC1CCCCC1	ZINC000094336948	265238473	/nfs/dbraw/zinc/23/84/73/265238473.db2.gz	FNPLCOSHDUPMLZ-UHFFFAOYSA-N	0	0	286.322	4.397	20	30		CIEDRN
Cc1ccccc1CSc1ccc(C#N)c([N+](=O)[O-])c1	ZINC000094593733	265245737	/nfs/dbraw/zinc/24/57/37/265245737.db2.gz	IWMVHMPDJNWOCZ-UHFFFAOYSA-N	0	0	284.340	4.067	20	30		CIEDRN
N#Cc1ccc(F)c(CSc2cccc(F)c2)c1	ZINC000094623142	265245796	/nfs/dbraw/zinc/24/57/96/265245796.db2.gz	ZLTVQWXKKWRXCM-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
Cc1cc(C)cc(CSc2ccc(C#N)c([N+](=O)[O-])c2)c1	ZINC000094718351	265250358	/nfs/dbraw/zinc/25/03/58/265250358.db2.gz	NXXNRKGMLLEEQF-UHFFFAOYSA-N	0	0	298.367	4.376	20	30		CIEDRN
Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(C#N)cc2)cc1F	ZINC000094837107	265261957	/nfs/dbraw/zinc/26/19/57/265261957.db2.gz	VZVYEOJBPFBSFH-UONOGXRCSA-N	0	0	282.362	4.418	20	30		CIEDRN
CC(C)(C)c1csc(COc2ccc(C#N)c(F)c2)n1	ZINC000094937225	265274576	/nfs/dbraw/zinc/27/45/76/265274576.db2.gz	OSSNHBVXTNTSOB-UHFFFAOYSA-N	0	0	290.363	4.030	20	30		CIEDRN
CC(C)OCc1ccccc1CNc1ccc(C#N)cc1	ZINC000518989852	265282721	/nfs/dbraw/zinc/28/27/21/265282721.db2.gz	VDMAWZQOSBCYPY-UHFFFAOYSA-N	0	0	280.371	4.095	20	30		CIEDRN
CCN(C(=O)c1ccc(CC#N)cc1)c1ccccc1Cl	ZINC000518993707	265283648	/nfs/dbraw/zinc/28/36/48/265283648.db2.gz	MKJYKGSZGKNDJN-UHFFFAOYSA-N	0	0	298.773	4.073	20	30		CIEDRN
Cc1ccc(-c2nc3cc(C#N)ccc3[nH]2)cc1Cl	ZINC000096874471	265392297	/nfs/dbraw/zinc/39/22/97/265392297.db2.gz	UBSOQYJGPXRESI-UHFFFAOYSA-N	0	0	267.719	4.063	20	30		CIEDRN
C=C1CCN(C(=O)C2(c3cccc(C)c3)CCCCC2)CC1	ZINC000519459717	265440839	/nfs/dbraw/zinc/44/08/39/265440839.db2.gz	YDGVHLARLMMUOP-UHFFFAOYSA-N	0	0	297.442	4.376	20	30		CIEDRN
C=CCCO[C@@H](C)C(=O)Nc1ccc(CCC(C)C)cc1	ZINC000519874122	265638284	/nfs/dbraw/zinc/63/82/84/265638284.db2.gz	ZNWRHWWNDHWUQS-HNNXBMFYSA-N	0	0	289.419	4.195	20	30		CIEDRN
C=CC[C@@H](C(=O)N(C)[C@H](C)CCCC)c1ccccc1	ZINC000520300221	265767935	/nfs/dbraw/zinc/76/79/35/265767935.db2.gz	QBVKXUFITDMMRU-NVXWUHKLSA-N	0	0	273.420	4.383	20	30		CIEDRN
N#Cc1cnc(NCc2cc3ccccc3s2)c(Cl)c1	ZINC000514618364	266020503	/nfs/dbraw/zinc/02/05/03/266020503.db2.gz	VMOVHDDTDMQMNI-UHFFFAOYSA-N	0	0	299.786	4.433	20	30		CIEDRN
Cc1c(F)cccc1NC(=O)C[C@H](CC#N)c1ccccc1	ZINC000356208859	266071497	/nfs/dbraw/zinc/07/14/97/266071497.db2.gz	DAJPOADZIDUFFV-HNNXBMFYSA-N	0	0	296.345	4.160	20	30		CIEDRN
Cc1cc(F)cc(NC(=O)C[C@@H](CC#N)c2ccccc2)c1	ZINC000356488650	266124336	/nfs/dbraw/zinc/12/43/36/266124336.db2.gz	ZPYGYIFVAPDIDM-OAHLLOKOSA-N	0	0	296.345	4.160	20	30		CIEDRN
CC(C)(C#N)CCCOc1cc(F)ccc1Cl	ZINC000193154399	266164960	/nfs/dbraw/zinc/16/49/60/266164960.db2.gz	JZZMFIVROBISAM-UHFFFAOYSA-N	0	0	255.720	4.188	20	30		CIEDRN
C[C@@H]1CC[C@H](NC(=O)C[C@H](CC#N)c2ccccc2)C[C@H]1C	ZINC000356817080	266179881	/nfs/dbraw/zinc/17/98/81/266179881.db2.gz	RCPXRAPGYPYTPP-LMSBXDPUSA-N	0	0	298.430	4.015	20	30		CIEDRN
CCCOc1cccc2c(NCC3(CC#N)CC3)ccnc12	ZINC000357011476	266232154	/nfs/dbraw/zinc/23/21/54/266232154.db2.gz	OJORHFHJXFQFAA-UHFFFAOYSA-N	0	0	295.386	4.129	20	30		CIEDRN
C=CCCC1(C(=O)N[C@@H]2CCCc3ccc(F)cc32)CC1	ZINC000357485140	266307174	/nfs/dbraw/zinc/30/71/74/266307174.db2.gz	WHPNPJGFRONTJR-MRXNPFEDSA-N	0	0	287.378	4.066	20	30		CIEDRN
N#Cc1ccccc1/C=C\c1nc([C@H]2CCCCS2)no1	ZINC000357547085	266319695	/nfs/dbraw/zinc/31/96/95/266319695.db2.gz	KXWJKMDVRJPSFD-QIAWRQBBSA-N	0	0	297.383	4.070	20	30		CIEDRN
Cc1ccc(C#N)c(N[C@@H]2CCc3sc(Cl)cc32)n1	ZINC000357582419	266330954	/nfs/dbraw/zinc/33/09/54/266330954.db2.gz	PERCTECMLHKNOJ-LLVKDONJSA-N	0	0	289.791	4.076	20	30		CIEDRN
N#Cc1cccc(C#N)c1N[C@H]1CCc2sc(Cl)cc21	ZINC000357601919	266334239	/nfs/dbraw/zinc/33/42/39/266334239.db2.gz	LQCBSPIQPVQPBX-LBPRGKRZSA-N	0	0	299.786	4.244	20	30		CIEDRN
C=CCC[C@@H](NC(=O)CC[C@H](C)SC)c1ccccc1	ZINC000358706493	266488472	/nfs/dbraw/zinc/48/84/72/266488472.db2.gz	IROSBJLRSNICNI-GOEBONIOSA-N	0	0	291.460	4.342	20	30		CIEDRN
N#CC1(CSCc2ccc(C(F)F)cc2)CC1	ZINC000359083572	266532364	/nfs/dbraw/zinc/53/23/64/266532364.db2.gz	GGLKPJXHTFQJBY-UHFFFAOYSA-N	0	0	253.317	4.161	20	30		CIEDRN
CC[C@@H]1CCCN(c2c(C#N)cnc3c(C)cc(F)cc32)C1	ZINC000359682555	266623550	/nfs/dbraw/zinc/62/35/50/266623550.db2.gz	OBUMTLADRWUBMT-CYBMUJFWSA-N	0	0	297.377	4.180	20	30		CIEDRN
Cc1sc(NC(=O)CC2(C)CCCC2)c(C#N)c1C	ZINC000360935241	266757376	/nfs/dbraw/zinc/75/73/76/266757376.db2.gz	FRVUKHXYRCZGRG-UHFFFAOYSA-N	0	0	276.405	4.146	20	30		CIEDRN
CCc1nnc([C@H](C)Sc2cccc(Cl)c2C#N)o1	ZINC000360946513	266759177	/nfs/dbraw/zinc/75/91/77/266759177.db2.gz	NNLQHAHVGKFYHP-QMMMGPOBSA-N	0	0	293.779	4.010	20	30		CIEDRN
Cn1cc(-c2cccc(/C=C/C(=O)c3cccs3)c2)cn1	ZINC000362417508	266982805	/nfs/dbraw/zinc/98/28/05/266982805.db2.gz	JXDIAILGOUNHDE-BQYQJAHWSA-N	0	0	294.379	4.045	20	30		CIEDRN
C=CCCCCCS[C@@H](C)c1nnc(CC)o1	ZINC000362460914	266990327	/nfs/dbraw/zinc/99/03/27/266990327.db2.gz	PCUQDJLQSVBEPU-NSHDSACASA-N	0	0	254.399	4.173	20	30		CIEDRN
CCCC(C)(C)CC(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000362778670	267044546	/nfs/dbraw/zinc/04/45/46/267044546.db2.gz	BHPKMFCUCSAZQL-INIZCTEOSA-N	0	0	286.419	4.364	20	30		CIEDRN
N#CCCCC(=O)Nc1cccc(Nc2ccccc2)c1	ZINC000362793174	267046581	/nfs/dbraw/zinc/04/65/81/267046581.db2.gz	DBSYHSQTRTZSFE-UHFFFAOYSA-N	0	0	279.343	4.063	20	30		CIEDRN
C[C@@H](Nc1ccc(C#N)cc1)c1nc(C(F)(F)F)cs1	ZINC000362855278	267054212	/nfs/dbraw/zinc/05/42/12/267054212.db2.gz	YRJNYAYTVRZAPR-MRVPVSSYSA-N	0	0	297.305	4.207	20	30		CIEDRN
N#Cc1nc(N2CCC[C@H]2c2ccsc2)ccc1Cl	ZINC000370091474	267290045	/nfs/dbraw/zinc/29/00/45/267290045.db2.gz	VZRIEEIRTKTEAQ-ZDUSSCGKSA-N	0	0	289.791	4.010	20	30		CIEDRN
C=CCCC(=O)N(C1CC1)[C@@H]1CCOc2cc(C)c(C)cc21	ZINC000370190393	267298517	/nfs/dbraw/zinc/29/85/17/267298517.db2.gz	GAMYDRVNBXLHJO-QGZVFWFLSA-N	0	0	299.414	4.084	20	30		CIEDRN
CCCCCCCC(=O)N1CCC[C@@H]1c1cccc(C)n1	ZINC000119105645	267301535	/nfs/dbraw/zinc/30/15/35/267301535.db2.gz	VVOSIYZVYIUGOH-QGZVFWFLSA-N	0	0	288.435	4.414	20	30		CIEDRN
C=CCCC(=O)Nc1cc(-c2cncc(F)c2)ccc1C	ZINC000370284661	267307073	/nfs/dbraw/zinc/30/70/73/267307073.db2.gz	FPCIOPLHIUFDRW-UHFFFAOYSA-N	0	0	284.334	4.101	20	30		CIEDRN
Cc1cnc([C@H]2CCCCN2Cc2ccc(C#N)cc2)s1	ZINC000371346158	267394288	/nfs/dbraw/zinc/39/42/88/267394288.db2.gz	VHRXFIYVWPJHHP-MRXNPFEDSA-N	0	0	297.427	4.050	20	30		CIEDRN
C[C@@H](Nc1cccc2c1OCCC2)c1ccc(C#N)s1	ZINC000371486046	267416375	/nfs/dbraw/zinc/41/63/75/267416375.db2.gz	SNIPRHNILLASPB-LLVKDONJSA-N	0	0	284.384	4.118	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](CC)c1nc(-c2ccccc2)c[nH]1	ZINC000371882313	267478305	/nfs/dbraw/zinc/47/83/05/267478305.db2.gz	BLBHZULDOWKXGQ-HNNXBMFYSA-N	0	0	297.402	4.000	20	30		CIEDRN
C=C[C@H](CC(=O)N1CC2(CCC2)C[C@@H]1C)c1ccccc1	ZINC000372915079	267616302	/nfs/dbraw/zinc/61/63/02/267616302.db2.gz	YUNCJUGMESOCOH-JKSUJKDBSA-N	0	0	283.415	4.137	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H]1/C=C/c1cccs1	ZINC000375119003	267831781	/nfs/dbraw/zinc/83/17/81/267831781.db2.gz	BHIBRPRMLZTONH-VMFRVMOISA-N	0	0	289.444	4.355	20	30		CIEDRN
CC(=O)c1sccc1OCc1ccc(Cl)cc1C#N	ZINC000193515998	267997728	/nfs/dbraw/zinc/99/77/28/267997728.db2.gz	RZFVFAMUOKSOTR-UHFFFAOYSA-N	0	0	291.759	4.055	20	30		CIEDRN
N#CCc1ccc(N[C@@H]2CCC[C@H](c3cccnc3)C2)cc1	ZINC000376739073	268013326	/nfs/dbraw/zinc/01/33/26/268013326.db2.gz	WMWHXMPMGLGMSY-QFBILLFUSA-N	0	0	291.398	4.286	20	30		CIEDRN
CC#CCCCC(=O)N1C[C@H]2CCCC[C@@]21c1ccccc1	ZINC000376953505	268034021	/nfs/dbraw/zinc/03/40/21/268034021.db2.gz	GGRJLSDILMLOPP-UYAOXDASSA-N	0	0	295.426	4.108	20	30		CIEDRN
Cc1csc([C@@H](C#N)C(=O)c2ccc(C3CCC3)cc2)n1	ZINC000192187749	335091186	/nfs/dbraw/zinc/09/11/86/335091186.db2.gz	JRGOLVZOHFPVGH-HNNXBMFYSA-N	0	0	296.395	4.209	20	30		CIEDRN
C=CCCCNC(=O)Nc1ccc2c3c(cccc31)CC2	ZINC000570792294	327619597	/nfs/dbraw/zinc/61/95/97/327619597.db2.gz	QWLKVFJSJWZFCF-UHFFFAOYSA-N	0	0	280.371	4.026	20	30		CIEDRN
C=CCN(C(=O)[C@H](C)c1ccc2ccccc2c1)C1CC1	ZINC000537929301	327625544	/nfs/dbraw/zinc/62/55/44/327625544.db2.gz	BFCSSEUCQJUTSC-CQSZACIVSA-N	0	0	279.383	4.120	20	30		CIEDRN
C=C(C)C(C)(C)c1nc(Cc2nccc3ccccc32)no1	ZINC000562969558	327693225	/nfs/dbraw/zinc/69/32/25/327693225.db2.gz	MAHRKUDBDVWAFE-UHFFFAOYSA-N	0	0	293.370	4.062	20	30		CIEDRN
CC(C)Oc1ccc(C#N)cc1NC(=O)C[C@@H]1C=CCCC1	ZINC000187063398	327707610	/nfs/dbraw/zinc/70/76/10/327707610.db2.gz	OBOWUAFZJHFDNJ-CQSZACIVSA-N	0	0	298.386	4.030	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)[C@@H]1CCC(C)=C(C)C1	ZINC000580198457	327729763	/nfs/dbraw/zinc/72/97/63/327729763.db2.gz	FAWXDLDHPMTXES-OAHLLOKOSA-N	0	0	276.424	4.054	20	30		CIEDRN
COc1ccc(C(C)(C)CNc2ccc(F)cc2C#N)cc1	ZINC000462802976	327785305	/nfs/dbraw/zinc/78/53/05/327785305.db2.gz	OVXURKNPLLTYLB-UHFFFAOYSA-N	0	0	298.361	4.096	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cccc(C)c1Cl	ZINC000582112989	327870881	/nfs/dbraw/zinc/87/08/81/327870881.db2.gz	OJKGHDRMOXVYCK-UHFFFAOYSA-N	0	0	251.757	4.189	20	30		CIEDRN
CC(C)c1nc(COc2cc(Cl)cc(C#N)c2)cs1	ZINC000388360883	327874152	/nfs/dbraw/zinc/87/41/52/327874152.db2.gz	HZBVKROTCXANSH-UHFFFAOYSA-N	0	0	292.791	4.371	20	30		CIEDRN
C=C(C)CCc1noc(Cc2ccc(SCC)cc2)n1	ZINC000508674208	327937026	/nfs/dbraw/zinc/93/70/26/327937026.db2.gz	YDXCGPOSYLEXJC-UHFFFAOYSA-N	0	0	288.416	4.281	20	30		CIEDRN
C[C@@H]1CCCN(c2cccc(C(F)F)c2C#N)CC1	ZINC000571009821	327974482	/nfs/dbraw/zinc/97/44/82/327974482.db2.gz	JMZNKCNTYBBXSC-LLVKDONJSA-N	0	0	264.319	4.122	20	30		CIEDRN
N#CCCOCCSCc1c(Cl)cccc1Cl	ZINC000338546881	327984525	/nfs/dbraw/zinc/98/45/25/327984525.db2.gz	SFACWVKSNKYLAL-UHFFFAOYSA-N	0	0	290.215	4.157	20	30		CIEDRN
Cc1cn(CCOc2c(Cl)cccc2Cl)cc1C#N	ZINC000531578069	328015894	/nfs/dbraw/zinc/01/58/94/328015894.db2.gz	CSVRHKWWNYUDGZ-UHFFFAOYSA-N	0	0	295.169	4.054	20	30		CIEDRN
COc1ccccc1SCCCOc1cccc(C#N)c1	ZINC000041030583	328021245	/nfs/dbraw/zinc/02/12/45/328021245.db2.gz	BAMAVIPHSNTMQB-UHFFFAOYSA-N	0	0	299.395	4.128	20	30		CIEDRN
CCCC(CCC)C(=O)N(CCC#N)C(C)(C)CC	ZINC000410726003	328021431	/nfs/dbraw/zinc/02/14/31/328021431.db2.gz	RCKVTJYIQCKVME-UHFFFAOYSA-N	0	0	266.429	4.134	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@H](C)[C@H]2CCCC[C@H]21	ZINC000531823749	328040044	/nfs/dbraw/zinc/04/00/44/328040044.db2.gz	UZDFMSRWMALROM-USXIJHARSA-N	0	0	275.436	4.182	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cc(C(F)(F)F)ccc1O	ZINC000531833146	328041248	/nfs/dbraw/zinc/04/12/48/328041248.db2.gz	NPCAWNRYWARKQN-UHFFFAOYSA-N	0	0	299.292	4.118	20	30		CIEDRN
C=CCCC(=O)N[C@@H]1CCCc2ccc(C(C)C)cc21	ZINC000534241179	328041329	/nfs/dbraw/zinc/04/13/29/328041329.db2.gz	AXRLPBLCWJSDET-QGZVFWFLSA-N	0	0	271.404	4.270	20	30		CIEDRN
C=CCC[C@@H](NC(=O)NC(C)(C)C1CC1)c1ccccc1	ZINC000534291994	328044640	/nfs/dbraw/zinc/04/46/40/328044640.db2.gz	TUJZNJXDNBNQGR-MRXNPFEDSA-N	0	0	286.419	4.182	20	30		CIEDRN
C=CC1CCN(C(=O)C[C@@H](c2ccccc2)C(C)C)CC1	ZINC000110359670	328046688	/nfs/dbraw/zinc/04/66/88/328046688.db2.gz	NMYSRWINETWAOI-GOSISDBHSA-N	0	0	285.431	4.241	20	30		CIEDRN
Cc1cccc(C(=O)N[C@@H](C)c2ccc(C#N)cc2)c1Cl	ZINC000534357847	328048285	/nfs/dbraw/zinc/04/82/85/328048285.db2.gz	BLYNSXQZPLXMKG-LBPRGKRZSA-N	0	0	298.773	4.011	20	30		CIEDRN
C[C@@H](NC(=O)C[C@@H]1CCCC(C)(C)C1)c1ccc(C#N)cc1	ZINC000534399987	328051326	/nfs/dbraw/zinc/05/13/26/328051326.db2.gz	DYDYCWVFWKIOBI-ZBFHGGJFSA-N	0	0	298.430	4.342	20	30		CIEDRN
Cc1cnn(-c2ccc(C)cc2NCCCC(C)(C)C#N)c1	ZINC000152072035	328056422	/nfs/dbraw/zinc/05/64/22/328056422.db2.gz	YTTAPUIGFFLSCW-UHFFFAOYSA-N	0	0	296.418	4.231	20	30		CIEDRN
C[C@H](SCC1(C#N)CCC1)c1nc(-c2ccccc2)no1	ZINC000563622902	328078228	/nfs/dbraw/zinc/07/82/28/328078228.db2.gz	ORUQSOAEAHIKCW-LBPRGKRZSA-N	0	0	299.399	4.225	20	30		CIEDRN
C/C=C\c1ccc(NC(=O)c2c(F)cc(C#N)cc2F)cc1	ZINC000563646090	328080608	/nfs/dbraw/zinc/08/06/08/328080608.db2.gz	MVOUXSBUIZVWKW-IHWYPQMZSA-N	0	0	298.292	4.122	20	30		CIEDRN
Cc1csc(NC(=O)C[C@H]2CCCC[C@@H]2C)c1C#N	ZINC000563649245	328081026	/nfs/dbraw/zinc/08/10/26/328081026.db2.gz	ILQMZAQXXGLXPR-CMPLNLGQSA-N	0	0	276.405	4.083	20	30		CIEDRN
Cc1ccc(C(=O)NC2(C#N)CCCCC2)c2ccccc12	ZINC000411271165	328081783	/nfs/dbraw/zinc/08/17/83/328081783.db2.gz	YSNCDJKBQXUYHZ-UHFFFAOYSA-N	0	0	292.382	4.105	20	30		CIEDRN
Cc1cc(CNc2cccc3ccncc32)ccc1C#N	ZINC000571128987	328087438	/nfs/dbraw/zinc/08/74/38/328087438.db2.gz	JKBXBQQDLODTTO-UHFFFAOYSA-N	0	0	273.339	4.027	20	30		CIEDRN
C=C1CCN(C(=O)c2ccc(C(C)(C)C)c(Cl)c2)CC1	ZINC000571096152	328085272	/nfs/dbraw/zinc/08/52/72/328085272.db2.gz	HYOPWTNFZAZQSZ-UHFFFAOYSA-N	0	0	291.822	4.430	20	30		CIEDRN
Cc1ccc(C#N)c(NCc2ccc3ccccc3c2)n1	ZINC000160839306	328087960	/nfs/dbraw/zinc/08/79/60/328087960.db2.gz	SFBFHPCTYHDFJV-UHFFFAOYSA-N	0	0	273.339	4.027	20	30		CIEDRN
CCc1nocc1CSCc1ccc(C#N)cc1Cl	ZINC000571298703	328100490	/nfs/dbraw/zinc/10/04/90/328100490.db2.gz	YENDRLKPYMOEKS-UHFFFAOYSA-N	0	0	292.791	4.195	20	30		CIEDRN
CC1(C)CCC[C@@H](c2noc(-c3ccc(CC#N)cc3)n2)C1	ZINC000534450894	328114615	/nfs/dbraw/zinc/11/46/15/328114615.db2.gz	WDOWXRDNBVHQFC-OAHLLOKOSA-N	0	0	295.386	4.486	20	30		CIEDRN
CC(C)(C#N)CC[S@@](=O)c1ccc(Cl)cc1Cl	ZINC000322990887	328122516	/nfs/dbraw/zinc/12/25/16/328122516.db2.gz	CRCAKAQEMIRZJX-QGZVFWFLSA-N	0	0	290.215	4.041	20	30		CIEDRN
C[C@H](c1cccc2ccccc21)[N@H+](C)CC(C)(C)C#N	ZINC000571480249	328124674	/nfs/dbraw/zinc/12/46/74/328124674.db2.gz	MLSHQIRZVJOGGZ-CQSZACIVSA-N	0	0	266.388	4.382	20	30		CIEDRN
C=CCC[C@@H](C(=O)N[C@@H]1C[C@H]1c1ccco1)c1ccccc1	ZINC000412943810	328131253	/nfs/dbraw/zinc/13/12/53/328131253.db2.gz	MXFQRCCLKIUOQA-BRWVUGGUSA-N	0	0	295.382	4.002	20	30		CIEDRN
C=CCC[C@H](Nc1ccc([C@H]2CCOC2)cc1)C1CC1	ZINC000571543813	328132795	/nfs/dbraw/zinc/13/27/95/328132795.db2.gz	ZUORZEMLFRNSDI-WMZOPIPTSA-N	0	0	271.404	4.347	20	30		CIEDRN
C[C@@H]1[C@H](C)Sc2ccccc2N1CCCCC#N	ZINC000161119561	328132799	/nfs/dbraw/zinc/13/27/99/328132799.db2.gz	ZTTHLGLRBQUXTK-OLZOCXBDSA-N	0	0	260.406	4.070	20	30		CIEDRN
Cc1ccc(Nc2nc(CSCCC#N)cs2)cc1	ZINC000413016560	328140593	/nfs/dbraw/zinc/14/05/93/328140593.db2.gz	WEWZKXBOEMETSC-UHFFFAOYSA-N	0	0	289.429	4.342	20	30		CIEDRN
N#CCCSCc1csc(-c2ccsc2)n1	ZINC000413016792	328140624	/nfs/dbraw/zinc/14/06/24/328140624.db2.gz	XFDLWYAKRIGTIC-UHFFFAOYSA-N	0	0	266.416	4.018	20	30		CIEDRN
N#CC1(CSCCn2ccc3cc(Cl)ccc32)CC1	ZINC000571608609	328137398	/nfs/dbraw/zinc/13/73/98/328137398.db2.gz	RTOLQFCEPDCLSQ-UHFFFAOYSA-N	0	0	290.819	4.332	20	30		CIEDRN
Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)SCCC#N	ZINC000413009516	328139342	/nfs/dbraw/zinc/13/93/42/328139342.db2.gz	CWUVZXIXVCMIBB-CYBMUJFWSA-N	0	0	290.432	4.092	20	30		CIEDRN
Cc1nc(CSCCC#N)oc1-c1ccc(Cl)cc1	ZINC000413013534	328139977	/nfs/dbraw/zinc/13/99/77/328139977.db2.gz	OKCGMLPZNQRYDN-UHFFFAOYSA-N	0	0	292.791	4.450	20	30		CIEDRN
Cc1cc([C@H](Nc2ncc(C#N)cc2F)C2CC2)ccc1F	ZINC000413211364	328142509	/nfs/dbraw/zinc/14/25/09/328142509.db2.gz	PTVMAYBPHIAEAK-MRXNPFEDSA-N	0	0	299.324	4.103	20	30		CIEDRN
Cc1ccc(C)c([C@@H]2CCCN2c2ncc(C#N)cc2F)c1	ZINC000413209579	328142534	/nfs/dbraw/zinc/14/25/34/328142534.db2.gz	UUMFYCIWYVHSSZ-KRWDZBQOSA-N	0	0	295.361	4.051	20	30		CIEDRN
CC(C)CN(C(=O)Nc1ccc(CC#N)cc1)C1CCCC1	ZINC000267926348	328181279	/nfs/dbraw/zinc/18/12/79/328181279.db2.gz	KOBWDAIDFQXKDI-UHFFFAOYSA-N	0	0	299.418	4.185	20	30		CIEDRN
CC(C)[C@@H]1c2ccccc2C(=O)/C1=C\c1cncs1	ZINC000277755589	328222449	/nfs/dbraw/zinc/22/24/49/328222449.db2.gz	ZPJHHLNYXSDUOH-XIEDVDOYSA-N	0	0	269.369	4.163	20	30		CIEDRN
N#CCCN(CCC#N)Cc1ccc(-c2ccsc2)cc1	ZINC000277753606	328222587	/nfs/dbraw/zinc/22/25/87/328222587.db2.gz	PTVXKBQRLDMEQW-UHFFFAOYSA-N	0	0	295.411	4.044	20	30		CIEDRN
C=C(C)CSCC(=O)Nc1c(CC)cccc1CC	ZINC000177867408	329187257	/nfs/dbraw/zinc/18/72/57/329187257.db2.gz	NIBJVYSZNNNNQN-UHFFFAOYSA-N	0	0	277.433	4.059	20	30		CIEDRN
Cc1cc(C)cc(-c2nnc(S[C@H]3CC[C@@H](C#N)C3)o2)c1	ZINC000278533816	328226478	/nfs/dbraw/zinc/22/64/78/328226478.db2.gz	IWDSICJXZFEWAQ-OCCSQVGLSA-N	0	0	299.399	4.138	20	30		CIEDRN
CC(C)(C#N)CCCCN1C[C@@H]2CCC(=O)c3cccc1c32	ZINC000278541707	328226922	/nfs/dbraw/zinc/22/69/22/328226922.db2.gz	AHBNDSIRIQEHBO-AWEZNQCLSA-N	0	0	296.414	4.287	20	30		CIEDRN
CCN(C(=O)CC(C)(C)C#N)c1cccc2ccccc21	ZINC000278545900	328226926	/nfs/dbraw/zinc/22/69/26/328226926.db2.gz	NQRTWGCTUMFPPJ-UHFFFAOYSA-N	0	0	280.371	4.133	20	30		CIEDRN
N#C[C@H]1CC[C@@H](SC2=Nc3ccccc3CS2)C1	ZINC000278592017	328227868	/nfs/dbraw/zinc/22/78/68/328227868.db2.gz	PWMPVCXJSOZSLV-CMPLNLGQSA-N	0	0	274.414	4.346	20	30		CIEDRN
N#C[C@@H]1CC[C@@H](SC2=Nc3ccccc3CS2)C1	ZINC000278592027	328227878	/nfs/dbraw/zinc/22/78/78/328227878.db2.gz	PWMPVCXJSOZSLV-ZYHUDNBSSA-N	0	0	274.414	4.346	20	30		CIEDRN
N#C[C@H]1CC[C@H](SC2=Nc3ccccc3CS2)C1	ZINC000278592021	328227989	/nfs/dbraw/zinc/22/79/89/328227989.db2.gz	PWMPVCXJSOZSLV-JQWIXIFHSA-N	0	0	274.414	4.346	20	30		CIEDRN
N#C[C@H]1CC[C@@H](Sc2ncc(-c3ccc(F)cc3)o2)C1	ZINC000278696226	328229694	/nfs/dbraw/zinc/22/96/94/328229694.db2.gz	ZVSVAAKMPHJRNZ-GXFFZTMASA-N	0	0	288.347	4.265	20	30		CIEDRN
C[C@H](OC(=O)CC(C)(C)C#N)c1cccc(Cl)c1F	ZINC000278839978	328230931	/nfs/dbraw/zinc/23/09/31/328230931.db2.gz	RLHHMWSGZFCGGM-VIFPVBQESA-N	0	0	283.730	4.023	20	30		CIEDRN
CCCc1occc1C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000281653528	328240952	/nfs/dbraw/zinc/24/09/52/328240952.db2.gz	WJLIULCQQMZDDC-MRXNPFEDSA-N	0	0	296.370	4.007	20	30		CIEDRN
N#Cc1cccnc1Oc1ccccc1NCCCCCF	ZINC000284036548	328245456	/nfs/dbraw/zinc/24/54/56/328245456.db2.gz	IRSMNYPRPKFLSD-UHFFFAOYSA-N	0	0	299.349	4.297	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)Nc1ccc(CCC(F)(F)F)cc1	ZINC000287522297	328251734	/nfs/dbraw/zinc/25/17/34/328251734.db2.gz	OPIUWUMACPVGQR-AWEZNQCLSA-N	0	0	298.308	4.060	20	30		CIEDRN
CC1(C#N)CCN(C(=O)Nc2cccc(C3CCC3)c2)CC1	ZINC000292173319	328268357	/nfs/dbraw/zinc/26/83/57/328268357.db2.gz	YTHJVGKPASBVQC-UHFFFAOYSA-N	0	0	297.402	4.112	20	30		CIEDRN
CC/C(C)=C/C(=O)Nc1ccccc1S[C@H](C)CC#N	ZINC000294717128	328282880	/nfs/dbraw/zinc/28/28/80/328282880.db2.gz	UVYVTYHSTSDCBX-XZHRJIJLSA-N	0	0	288.416	4.376	20	30		CIEDRN
N#CC[C@@H]1CC[C@H](NC(=O)c2ccc(C3CCCC3)cc2)C1	ZINC000295564656	328285999	/nfs/dbraw/zinc/28/59/99/328285999.db2.gz	ODEGCAUXZMOPLO-KSSFIOAISA-N	0	0	296.414	4.156	20	30		CIEDRN
C[C@H](CCC#N)Sc1nnc(-c2ccc(Cl)s2)o1	ZINC000298343220	328295999	/nfs/dbraw/zinc/29/59/99/328295999.db2.gz	OFCFTNPHDCKVLD-SSDOTTSWSA-N	0	0	299.808	4.236	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(Cc2nccc3ccccc32)no1	ZINC000582148361	328302831	/nfs/dbraw/zinc/30/28/31/328302831.db2.gz	LADMXBHPHZJMSY-SFHVURJKSA-N	0	0	293.370	4.062	20	30		CIEDRN
N#Cc1cc(/C=C/c2nc3ccccc3s2)ccc1F	ZINC000534481940	328304247	/nfs/dbraw/zinc/30/42/47/328304247.db2.gz	NEHLVZPGCPMBQQ-SOFGYWHQSA-N	0	0	280.327	4.477	20	30		CIEDRN
C[C@@H](Sc1ccc(C#N)cc1)c1cccc([N+](=O)[O-])c1	ZINC000048512034	328309340	/nfs/dbraw/zinc/30/93/40/328309340.db2.gz	OHSYKGVQUBPFHY-LLVKDONJSA-N	0	0	284.340	4.320	20	30		CIEDRN
N#Cc1ccc(CNc2ccc(Cl)c(F)c2)c(F)c1	ZINC000048442970	328313006	/nfs/dbraw/zinc/31/30/06/328313006.db2.gz	KZNFSZNABNWEDA-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
Cc1cccc(CSCCOc2cccc(C#N)c2)c1	ZINC000048446362	328313087	/nfs/dbraw/zinc/31/30/87/328313087.db2.gz	VVZYCMBHTMKPNB-UHFFFAOYSA-N	0	0	283.396	4.179	20	30		CIEDRN
Cc1cccc(CSCCOc2ccccc2C#N)c1	ZINC000048555413	328314840	/nfs/dbraw/zinc/31/48/40/328314840.db2.gz	ZDPCFWADLHUQCH-UHFFFAOYSA-N	0	0	283.396	4.179	20	30		CIEDRN
C[C@@H]1CCN(Cc2cccc(C#N)c2)c2ccccc21	ZINC000048574358	328316153	/nfs/dbraw/zinc/31/61/53/328316153.db2.gz	WVNKMUSXZGFIEF-CQSZACIVSA-N	0	0	262.356	4.072	20	30		CIEDRN
C=C[C@@H](CC(=O)N(C)C1CCC(C)CC1)c1ccccc1	ZINC000534607919	328322451	/nfs/dbraw/zinc/32/24/51/328322451.db2.gz	GYVISZVKEUFUHI-PQUAAJSLSA-N	0	0	285.431	4.383	20	30		CIEDRN
N#Cc1cc(NC(=O)CC2CCCCC2)ccc1Cl	ZINC000048824278	328324774	/nfs/dbraw/zinc/32/47/74/328324774.db2.gz	SBOBJVVYMVKTSN-UHFFFAOYSA-N	0	0	276.767	4.121	20	30		CIEDRN
CCCCS[C@@H](C)C(=O)Nc1ccc(Cl)c(C#N)c1	ZINC000048824203	328324781	/nfs/dbraw/zinc/32/47/81/328324781.db2.gz	UWFNPNYXBAISPL-JTQLQIEISA-N	0	0	296.823	4.072	20	30		CIEDRN
CC(C)CC[C@@H]1CCC[C@H]1NC(=O)c1ccc(CC#N)cc1	ZINC000534613626	328325215	/nfs/dbraw/zinc/32/52/15/328325215.db2.gz	HXBFYBGRMUSRKG-FUHWJXTLSA-N	0	0	298.430	4.087	20	30		CIEDRN
C=C[C@@H](CC(=O)N[C@H](C)Cc1ccsc1)c1ccccc1	ZINC000534644914	328330480	/nfs/dbraw/zinc/33/04/80/328330480.db2.gz	BOJLBAHDDCDPLE-ZBFHGGJFSA-N	0	0	299.439	4.155	20	30		CIEDRN
C=C[C@@H](CC(=O)N([C@@H](C)C(C)C)C1CC1)c1ccccc1	ZINC000534646067	328333823	/nfs/dbraw/zinc/33/38/23/328333823.db2.gz	BECXTWUHKGKXCW-HOTGVXAUSA-N	0	0	285.431	4.382	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1cc(F)cc(F)c1)c1ccccc1	ZINC000534651994	328337544	/nfs/dbraw/zinc/33/75/44/328337544.db2.gz	KRCSOYDAHZVPTD-LBPRGKRZSA-N	0	0	287.309	4.263	20	30		CIEDRN
C=C[C@@H](CC(=O)N[C@H]1CCCC(F)(F)C1)c1ccccc1	ZINC000534667695	328345954	/nfs/dbraw/zinc/34/59/54/328345954.db2.gz	YSFWQHZFYJNSEY-ZFWWWQNUSA-N	0	0	293.357	4.040	20	30		CIEDRN
C=C[C@H](CC(=O)NC(C)(C)c1cccs1)c1ccccc1	ZINC000534678468	328352496	/nfs/dbraw/zinc/35/24/96/328352496.db2.gz	BXOAMFHNWHNTRL-CQSZACIVSA-N	0	0	299.439	4.459	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2ccc(C(F)(F)F)cc2)CC1	ZINC000111419397	328354815	/nfs/dbraw/zinc/35/48/15/328354815.db2.gz	BKSKHIALMWESIN-UHFFFAOYSA-N	0	0	298.308	4.135	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(Oc2cccc(C)c2C)nc1	ZINC000303619823	328355041	/nfs/dbraw/zinc/35/50/41/328355041.db2.gz	MXFLRBNMFMYZAG-UHFFFAOYSA-N	0	0	296.370	4.395	20	30		CIEDRN
C=C[C@H](CC(=O)NCCc1ccccc1C)c1ccccc1	ZINC000534725411	328359368	/nfs/dbraw/zinc/35/93/68/328359368.db2.gz	HWCOPJYBSHTRMI-QGZVFWFLSA-N	0	0	293.410	4.014	20	30		CIEDRN
C=C[C@H](CC(=O)N1CC[C@H](C)C[C@H](C)C1)c1ccccc1	ZINC000534724275	328359450	/nfs/dbraw/zinc/35/94/50/328359450.db2.gz	ZBPGGPAKVLOJSA-YESZJQIVSA-N	0	0	285.431	4.241	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CCC[C@H](CC)CC1)c1ccccc1	ZINC000534690828	328356425	/nfs/dbraw/zinc/35/64/25/328356425.db2.gz	KSHADEVJPHHKGW-IRXDYDNUSA-N	0	0	285.431	4.385	20	30		CIEDRN
C=CCN(CCc1ccccc1)C(=O)[C@H]1CCC[C@@H](C)C1	ZINC000303810418	328357420	/nfs/dbraw/zinc/35/74/20/328357420.db2.gz	BXERQXDWQIEXAI-AEFFLSMTSA-N	0	0	285.431	4.070	20	30		CIEDRN
C=C(C)CN1CCSC[C@H]1c1ccc(Cl)cc1	ZINC000303686651	328357728	/nfs/dbraw/zinc/35/77/28/328357728.db2.gz	UCCNZRVINQMWPL-AWEZNQCLSA-N	0	0	267.825	4.006	20	30		CIEDRN
C=CCOc1cccc(NC(=O)c2c(C)cc(C)cc2C)c1	ZINC000534873293	328366457	/nfs/dbraw/zinc/36/64/57/328366457.db2.gz	JTAXKYVJFCGMDR-UHFFFAOYSA-N	0	0	295.382	4.429	20	30		CIEDRN
CCC(CC)[C@@H](C)C(=O)Nc1sc(C)c(C)c1C#N	ZINC000534884434	328366857	/nfs/dbraw/zinc/36/68/57/328366857.db2.gz	BCGNJISMDCJCLX-SNVBAGLBSA-N	0	0	278.421	4.247	20	30		CIEDRN
CCC(CC)[C@@H](C)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000534912061	328368389	/nfs/dbraw/zinc/36/83/89/328368389.db2.gz	BXDBWOARMYXGNQ-SNVBAGLBSA-N	0	0	290.432	4.119	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)[C@@H]2CCC[C@@H](C)C2)c1	ZINC000303953269	328369826	/nfs/dbraw/zinc/36/98/26/328369826.db2.gz	ZNXHAXIFEOGRGR-HUUCEWRRSA-N	0	0	287.403	4.406	20	30		CIEDRN
C=CCCC(=O)CSc1nc2cc(Cl)cc(C)c2o1	ZINC000534978307	328372502	/nfs/dbraw/zinc/37/25/02/328372502.db2.gz	PNTQWLWWKRWCHX-UHFFFAOYSA-N	0	0	295.791	4.417	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2c(CC)cccc2CC)CC1	ZINC000111706847	328376395	/nfs/dbraw/zinc/37/63/95/328376395.db2.gz	OUUXQWUUIVOVRR-UHFFFAOYSA-N	0	0	286.419	4.241	20	30		CIEDRN
CC[C@](C)(C#N)NC(=O)C/C=C\c1ccc(C(C)C)cc1	ZINC000535010941	328376570	/nfs/dbraw/zinc/37/65/70/328376570.db2.gz	IMLIVRQKDYDCDU-HPFMTEOYSA-N	0	0	284.403	4.022	20	30		CIEDRN
COc1cc(C#N)ccc1CNc1cccc(C)c1Cl	ZINC000535041632	328378665	/nfs/dbraw/zinc/37/86/65/328378665.db2.gz	LTGULHZRDLPWBC-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
N#CCc1ccc(NCc2ccc(F)cc2Cl)cc1	ZINC000049899942	328381017	/nfs/dbraw/zinc/38/10/17/328381017.db2.gz	MWHWDWKIUOFKTM-UHFFFAOYSA-N	0	0	274.726	4.157	20	30		CIEDRN
CC(C)Oc1ccccc1CNc1ccc(C#N)cc1F	ZINC000112012311	328381522	/nfs/dbraw/zinc/38/15/22/328381522.db2.gz	NNLOPGRXJLTJRG-UHFFFAOYSA-N	0	0	284.334	4.097	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@H](C)c1oc2ccccc2c1C	ZINC000172062166	335093037	/nfs/dbraw/zinc/09/30/37/335093037.db2.gz	UUCJFEUOQHPOJL-DGCLKSJQSA-N	0	0	286.375	4.066	20	30		CIEDRN
C=C(C)[C@H](CC(=O)N1CCC(CCC(C)C)CC1)OCC	ZINC000535151536	328390633	/nfs/dbraw/zinc/39/06/33/328390633.db2.gz	HSKOWJBQODZKCR-KRWDZBQOSA-N	0	0	295.467	4.033	20	30		CIEDRN
CC(C)CCC(=O)Nc1cc(C(C)(C)C)sc1C#N	ZINC000535254933	328398564	/nfs/dbraw/zinc/39/85/64/328398564.db2.gz	LWASCQHXERYBFE-UHFFFAOYSA-N	0	0	278.421	4.292	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2ccc(Br)o2)no1	ZINC000546638616	328394121	/nfs/dbraw/zinc/39/41/21/328394121.db2.gz	HVFHXSRAOPDQKV-MRVPVSSYSA-N	0	0	297.152	4.162	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)[C@@H]1CCCC(C)(C)C1	ZINC000535212427	328394773	/nfs/dbraw/zinc/39/47/73/328394773.db2.gz	SYULCHBFSVCNMG-CQSZACIVSA-N	0	0	278.440	4.182	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@H](C)C1CCCC1)c1ccccc1	ZINC000188008163	328426878	/nfs/dbraw/zinc/42/68/78/328426878.db2.gz	AFJYOHGMJSMNBJ-PBHICJAKSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=C[C@H](CC(=O)N(C)[C@@H]1CCC[C@@H](C)C1)c1ccccc1	ZINC000535331332	328440252	/nfs/dbraw/zinc/44/02/52/328440252.db2.gz	CMHUWWUGTHLQMA-JFIYKMOQSA-N	0	0	285.431	4.383	20	30		CIEDRN
CC(C)C[C@](C)(C#N)NC(=O)C[C@H]1CCCC(C)(C)C1	ZINC000535326744	328441422	/nfs/dbraw/zinc/44/14/22/328441422.db2.gz	ROCNQDOEUULHIW-RHSMWYFYSA-N	0	0	278.440	4.037	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CCc2cccc(F)c21)c1ccccc1	ZINC000535380028	328447810	/nfs/dbraw/zinc/44/78/10/328447810.db2.gz	QQSYWYWWXUVDTO-AWEZNQCLSA-N	0	0	295.357	4.075	20	30		CIEDRN
CCC[C@H](C)C(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1	ZINC000112910692	328451528	/nfs/dbraw/zinc/45/15/28/328451528.db2.gz	HMTGXAHUZVKROI-ZANVPECISA-N	0	0	299.201	4.110	20	30		CIEDRN
CC(C)(C#N)C(=O)Nc1ccc2c(c1)C(C)(C)CC2(C)C	ZINC000535444392	328452553	/nfs/dbraw/zinc/45/25/53/328452553.db2.gz	ABRSNEASCOWJQP-UHFFFAOYSA-N	0	0	284.403	4.134	20	30		CIEDRN
CO[C@@H]1CCC[C@H](CC(=O)Nc2cccc3ocnc32)C1	ZINC000328873281	328458980	/nfs/dbraw/zinc/45/89/80/328458980.db2.gz	IZXQTCCHVUGAEN-NWDGAFQWSA-N	0	0	288.347	4.011	20	30		CIEDRN
Cc1nc(CNC(=O)c2cc(C(C)C)oc2C)sc1C	ZINC000330606693	328463152	/nfs/dbraw/zinc/46/31/52/328463152.db2.gz	IUOBIDOATOYRNR-UHFFFAOYSA-N	0	0	292.404	4.290	20	30		CIEDRN
CC(C)C[C@H](C)n1nccc1NC(=O)NC1(C)CCCC1	ZINC000331099070	328477084	/nfs/dbraw/zinc/47/70/84/328477084.db2.gz	CGOPENOAJYIJJV-ZDUSSCGKSA-N	0	0	292.427	4.149	20	30		CIEDRN
C=C(CC)CNC(=O)c1ccc(Cl)cc1C(F)(F)F	ZINC000456810103	328487607	/nfs/dbraw/zinc/48/76/07/328487607.db2.gz	DMMFLTNHSHESJL-UHFFFAOYSA-N	0	0	291.700	4.055	20	30		CIEDRN
C#CCCCCNC(=O)Nc1c(CC=C)cccc1C(C)C	ZINC000191421141	328511000	/nfs/dbraw/zinc/51/10/00/328511000.db2.gz	QWFRTJTYWVPEIO-UHFFFAOYSA-N	0	0	298.430	4.464	20	30		CIEDRN
C#CCCCC(=O)Nc1cc(Cl)ccc1C(F)(F)F	ZINC000289572097	328527443	/nfs/dbraw/zinc/52/74/43/328527443.db2.gz	HDULYONJMXFXQJ-UHFFFAOYSA-N	0	0	289.684	4.101	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@H]1c1cccs1	ZINC000184973042	328543540	/nfs/dbraw/zinc/54/35/40/328543540.db2.gz	PVIPVMAKRDZNQU-OLZOCXBDSA-N	0	0	263.406	4.014	20	30		CIEDRN
N#Cc1cnccc1Sc1ccc2ccccc2c1	ZINC000399495658	326806974	/nfs/dbraw/zinc/80/69/74/326806974.db2.gz	ICOBNZJLORDSHZ-UHFFFAOYSA-N	0	0	262.337	4.258	20	30		CIEDRN
N#Cc1cnccc1Oc1cc(Cl)cc(Cl)c1	ZINC000399545849	326807539	/nfs/dbraw/zinc/80/75/39/326807539.db2.gz	BQEGZOQXUWGDKY-UHFFFAOYSA-N	0	0	265.099	4.052	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N(C)[C@H](C)c1cccc(Cl)c1	ZINC000116971239	326817338	/nfs/dbraw/zinc/81/73/38/326817338.db2.gz	RDVOBNDQBBCZIS-VXGBXAGGSA-N	0	0	280.799	4.007	20	30		CIEDRN
C=CCOc1cccc(NC(=O)[C@H](C)c2ccccc2F)c1	ZINC000108967090	326817481	/nfs/dbraw/zinc/81/74/81/326817481.db2.gz	BNKVLQANTMAVTB-CYBMUJFWSA-N	0	0	299.345	4.133	20	30		CIEDRN
CC(C)(C#N)CCCN[C@@H](c1ccccc1)C(F)(F)F	ZINC000533479730	326840261	/nfs/dbraw/zinc/84/02/61/326840261.db2.gz	NCWNDJUDBXYPGG-ZDUSSCGKSA-N	0	0	284.325	4.210	20	30		CIEDRN
CC(C)(C#N)CCCN[C@H](c1ccccc1)C(F)(F)F	ZINC000533479729	326840297	/nfs/dbraw/zinc/84/02/97/326840297.db2.gz	NCWNDJUDBXYPGG-CYBMUJFWSA-N	0	0	284.325	4.210	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1ncccc1Cl)c1ccccc1	ZINC000179940105	326843801	/nfs/dbraw/zinc/84/38/01/326843801.db2.gz	NEYQUSYJJNMINJ-LBPRGKRZSA-N	0	0	286.762	4.033	20	30		CIEDRN
C=CCN(C(=O)[C@H]1C[C@@H]1c1sccc1C)c1ccccc1	ZINC000533509858	326845457	/nfs/dbraw/zinc/84/54/57/326845457.db2.gz	KEUZTBREEBVUSJ-HOTGVXAUSA-N	0	0	297.423	4.379	20	30		CIEDRN
Cc1ccc(C#N)c(N[C@@H]2CC[C@H](c3ccc(F)cc3)C2)n1	ZINC000530537772	326854226	/nfs/dbraw/zinc/85/42/26/326854226.db2.gz	YNVKNNAFQDSKAT-WMLDXEAASA-N	0	0	295.361	4.149	20	30		CIEDRN
Cc1ccc(CNc2ccc(Cl)c(C#N)c2)s1	ZINC000036972788	326874873	/nfs/dbraw/zinc/87/48/73/326874873.db2.gz	INVKRLLPLVGILL-UHFFFAOYSA-N	0	0	262.765	4.194	20	30		CIEDRN
Cc1cccc(C(C)C)c1NC(=O)Cc1cccc(C#N)c1	ZINC000530675184	326885877	/nfs/dbraw/zinc/88/58/77/326885877.db2.gz	OTFSHPDWRRBDMQ-UHFFFAOYSA-N	0	0	292.382	4.171	20	30		CIEDRN
CCc1ccc(-c2noc(C3(C#N)CCCCC3)n2)cc1	ZINC000530879228	326894560	/nfs/dbraw/zinc/89/45/60/326894560.db2.gz	FRUURNOUIYPZJP-UHFFFAOYSA-N	0	0	281.359	4.024	20	30		CIEDRN
CC(C)(C#N)CCNc1ccc(C(F)(F)F)cc1	ZINC000087590928	326942318	/nfs/dbraw/zinc/94/23/18/326942318.db2.gz	FUDMCJJMLPWAJB-UHFFFAOYSA-N	0	0	256.271	4.057	20	30		CIEDRN
C=C(C)CCSc1nnc(-c2cccc(Cl)c2)n1C	ZINC000506388043	332771907	/nfs/dbraw/zinc/77/19/07/332771907.db2.gz	VBWKFONNZJUCBB-UHFFFAOYSA-N	0	0	293.823	4.194	20	30		CIEDRN
C=CCn1c(SCC[C@@H](C)F)nnc1-c1cccs1	ZINC000506395647	332772258	/nfs/dbraw/zinc/77/22/58/332772258.db2.gz	OQUDTYNESOLLMM-SNVBAGLBSA-N	0	0	297.424	4.033	20	30		CIEDRN
Cc1cc(OCc2ncc(Cl)s2)c(C)c(C)c1C#N	ZINC000506414982	332772413	/nfs/dbraw/zinc/77/24/13/332772413.db2.gz	GQDIUDNACAIWQZ-UHFFFAOYSA-N	0	0	292.791	4.172	20	30		CIEDRN
CC(C)(C)CN(CCC#N)C(=O)CC/C=C\c1ccccc1	ZINC000255061552	326921139	/nfs/dbraw/zinc/92/11/39/326921139.db2.gz	LHTNOJNVPXPZIC-GHXNOFRVSA-N	0	0	298.430	4.268	20	30		CIEDRN
CC[C@H]1CCCCN1C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000075997331	326922255	/nfs/dbraw/zinc/92/22/55/326922255.db2.gz	YVEHEOKJNDMEMW-ZDUSSCGKSA-N	0	0	291.782	4.008	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H]2CC23CCCCC3)n1	ZINC000556360206	326922613	/nfs/dbraw/zinc/92/26/13/326922613.db2.gz	LJGKHXIWGLRKMK-LBPRGKRZSA-N	0	0	260.381	4.361	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H](C)c2cccs2)n1	ZINC000556361528	326923559	/nfs/dbraw/zinc/92/35/59/326923559.db2.gz	HAEIPSYDJZVTRW-JTQLQIEISA-N	0	0	262.378	4.137	20	30		CIEDRN
Cc1cccc(CSCc2ccccc2C#N)c1	ZINC000047826471	326925505	/nfs/dbraw/zinc/92/55/05/326925505.db2.gz	WHKSHZAAMVZFOI-UHFFFAOYSA-N	0	0	253.370	4.300	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](c1ccc(F)c(C)c1)C1CC1	ZINC000536281789	326934822	/nfs/dbraw/zinc/93/48/22/326934822.db2.gz	SVNQOVFAJFURSW-QGZVFWFLSA-N	0	0	275.367	4.058	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CCc2cccc(C)c21)c1ccccc1	ZINC000536287334	326935023	/nfs/dbraw/zinc/93/50/23/326935023.db2.gz	SCVOTFGVQKGCSC-INIZCTEOSA-N	0	0	291.394	4.244	20	30		CIEDRN
CC1(C)CCCC[C@H]1CC(=O)N(C1CC1)C1(C#N)CCC1	ZINC000556456026	326943078	/nfs/dbraw/zinc/94/30/78/326943078.db2.gz	LGIDWJWOQQMSLW-AWEZNQCLSA-N	0	0	288.435	4.030	20	30		CIEDRN
CC(C)(C#N)CCOc1cccc(C(F)(F)F)c1	ZINC000087596001	326943393	/nfs/dbraw/zinc/94/33/93/326943393.db2.gz	ONZXXFOSSQXDCN-UHFFFAOYSA-N	0	0	257.255	4.024	20	30		CIEDRN
N#Cc1ccc(/C=C\c2cc3ccccc3s2)nc1	ZINC000255323986	326964618	/nfs/dbraw/zinc/96/46/18/326964618.db2.gz	LOLFHUOKRLMELM-FPLPWBNLSA-N	0	0	262.337	4.338	20	30		CIEDRN
N#CCC[C@H](C#N)COc1ccc(-c2ccccc2)cc1	ZINC000557279410	327000264	/nfs/dbraw/zinc/00/02/64/327000264.db2.gz	GWYZHXHSLOAFID-OAHLLOKOSA-N	0	0	276.339	4.176	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(C[C@H](C)c2ccccc2)no1	ZINC000564610450	327001343	/nfs/dbraw/zinc/00/13/43/327001343.db2.gz	OWFDMPIVMPUHSS-GUYCJALGSA-N	0	0	270.376	4.270	20	30		CIEDRN
N#Cc1cccc(/C=C\C(=O)Nc2cccc(C(F)F)c2)c1	ZINC000255679009	327003859	/nfs/dbraw/zinc/00/38/59/327003859.db2.gz	JHSMABUQXBWGSX-FPLPWBNLSA-N	0	0	298.292	4.148	20	30		CIEDRN
Cc1cc(C#N)nc(N[C@@H](C)c2cc3ccccc3s2)n1	ZINC000557426209	327004996	/nfs/dbraw/zinc/00/49/96/327004996.db2.gz	UWUASEKNIPXECD-NSHDSACASA-N	0	0	294.383	4.045	20	30		CIEDRN
CCCCCOc1ccc(Oc2nc(C)cc(C#N)n2)cc1	ZINC000557467912	327007165	/nfs/dbraw/zinc/00/71/65/327007165.db2.gz	XWMHSIWSNLOWRM-UHFFFAOYSA-N	0	0	297.358	4.018	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(Cc2c(F)cccc2F)no1	ZINC000557510087	327010845	/nfs/dbraw/zinc/01/08/45/327010845.db2.gz	UAHGTXFVCXMHTO-SNVBAGLBSA-N	0	0	278.302	4.008	20	30		CIEDRN
C[C@H](CC(C)(C)c1ccccc1)Nc1cc(C#N)ccn1	ZINC000557527792	327011993	/nfs/dbraw/zinc/01/19/93/327011993.db2.gz	VGOANJAGRGPRNE-CQSZACIVSA-N	0	0	279.387	4.122	20	30		CIEDRN
CCCN(c1nc(C)cc(C#N)n1)[C@H](CC)c1ccccc1	ZINC000557556856	327013240	/nfs/dbraw/zinc/01/32/40/327013240.db2.gz	RKEYZRFURVLWHJ-QGZVFWFLSA-N	0	0	294.402	4.024	20	30		CIEDRN
Cc1nnc(SCc2ccc(C(C)C)cc2)c(C#N)c1C	ZINC000557570960	327013421	/nfs/dbraw/zinc/01/34/21/327013421.db2.gz	XBWNMVPRPWTMII-UHFFFAOYSA-N	0	0	297.427	4.381	20	30		CIEDRN
Cc1cccc([C@H]2CCCCN2c2ccnc(C#N)c2)c1C	ZINC000557578507	327014207	/nfs/dbraw/zinc/01/42/07/327014207.db2.gz	JICKUSGAMHGBNF-LJQANCHMSA-N	0	0	291.398	4.302	20	30		CIEDRN
N#Cc1ccnc(N2CCCC[C@@H]2c2ccccc2)c1Cl	ZINC000557633855	327018168	/nfs/dbraw/zinc/01/81/68/327018168.db2.gz	VSJNBYZKMQJYAB-OAHLLOKOSA-N	0	0	297.789	4.338	20	30		CIEDRN
N#Cc1ccc(N(Cc2ccccc2Cl)CC2CC2)nc1	ZINC000557697053	327021354	/nfs/dbraw/zinc/02/13/54/327021354.db2.gz	LDMFJSWUMHMSGW-UHFFFAOYSA-N	0	0	297.789	4.023	20	30		CIEDRN
COc1ccc(CSc2ccc(F)cc2F)cc1C#N	ZINC000087833718	327025554	/nfs/dbraw/zinc/02/55/54/327025554.db2.gz	ZSCLEHYVYDMHEA-UHFFFAOYSA-N	0	0	291.322	4.137	20	30		CIEDRN
Cc1cc(C#N)ccc1C(=O)N(CC(C)C)c1ccccc1	ZINC000557780718	327026671	/nfs/dbraw/zinc/02/66/71/327026671.db2.gz	LVQQOVLQZQAKSY-UHFFFAOYSA-N	0	0	292.382	4.170	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)NCCc1cc2ccccc2s1	ZINC000506585719	332775031	/nfs/dbraw/zinc/77/50/31/332775031.db2.gz	HOCOZOSGHROBGR-KRWDZBQOSA-N	0	0	287.428	4.162	20	30		CIEDRN
C[C@H](CC1CCCCC1)C(=O)NCC(C)(C)CCC#N	ZINC000557997339	327039847	/nfs/dbraw/zinc/03/98/47/327039847.db2.gz	QGHGQCGPDRQKQY-CQSZACIVSA-N	0	0	278.440	4.039	20	30		CIEDRN
C=CCCC(=O)Nc1ncc(-c2cccc(C)c2)s1	ZINC000558006130	327039884	/nfs/dbraw/zinc/03/98/84/327039884.db2.gz	SMHYZRMAIRPTOO-UHFFFAOYSA-N	0	0	272.373	4.023	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@@H](C(C)(C)C)C[C@@H]2C)CCC1	ZINC000576763508	327039964	/nfs/dbraw/zinc/03/99/64/327039964.db2.gz	UMLVGUDIZCBTCJ-LSDHHAIUSA-N	0	0	277.452	4.406	20	30		CIEDRN
CC[C@H](CC#N)NC(=O)c1ccc(C(C)(C)C)c(Cl)c1	ZINC000584204136	327063479	/nfs/dbraw/zinc/06/34/79/327063479.db2.gz	VEFPANPVTXMPKK-GFCCVEGCSA-N	0	0	292.810	4.060	20	30		CIEDRN
Cc1nsc(SCc2cc(C)ccc2C)c1C#N	ZINC000584193113	327064417	/nfs/dbraw/zinc/06/44/17/327064417.db2.gz	AJYVCFQIORRWPO-UHFFFAOYSA-N	0	0	274.414	4.232	20	30		CIEDRN
CC1(C)CN(CC#Cc2ccccc2)[C@@H]1c1cccs1	ZINC000558184392	327077653	/nfs/dbraw/zinc/07/76/53/327077653.db2.gz	RMWQSSZENQUWBB-QGZVFWFLSA-N	0	0	281.424	4.183	20	30		CIEDRN
CC[C@@H](CC#N)Nc1c(Cl)cc(Cl)cc1[N+](=O)[O-]	ZINC000553494996	327077967	/nfs/dbraw/zinc/07/79/67/327077967.db2.gz	RRPHERBUTRTAJD-QMMMGPOBSA-N	0	0	288.134	4.006	20	30		CIEDRN
CCc1cc(C(=O)Nc2scc(C)c2C#N)sc1C	ZINC000558243379	327081230	/nfs/dbraw/zinc/08/12/30/327081230.db2.gz	AJXIJPPMPCXBNC-UHFFFAOYSA-N	0	0	290.413	4.113	20	30		CIEDRN
CC[C@@H](CC(=O)Nc1cc(C#N)c2ccccc2n1)C(C)C	ZINC000558248456	327081415	/nfs/dbraw/zinc/08/14/15/327081415.db2.gz	WGRANSXNXJZOBS-ZDUSSCGKSA-N	0	0	295.386	4.117	20	30		CIEDRN
Cc1cc(C)c(NC(=O)c2ccc(C#N)c(Cl)c2)c(C)c1	ZINC000153476915	327084159	/nfs/dbraw/zinc/08/41/59/327084159.db2.gz	HHKYMWJKSJUTNV-UHFFFAOYSA-N	0	0	298.773	4.389	20	30		CIEDRN
C=CCCC1(C(=O)N2CCC[C@H](c3ccccc3)C2)CC1	ZINC000558299850	327086151	/nfs/dbraw/zinc/08/61/51/327086151.db2.gz	BQJFSUXAPPBSKI-KRWDZBQOSA-N	0	0	283.415	4.139	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(Cc2c[nH]c3cccc(C)c23)no1	ZINC000558326947	327087285	/nfs/dbraw/zinc/08/72/85/327087285.db2.gz	DSXYZHZVDKPRFX-SFHVURJKSA-N	0	0	295.386	4.304	20	30		CIEDRN
Cc1ccc(OCCCCNc2ccc(C#N)cc2F)cc1	ZINC000506849122	332781175	/nfs/dbraw/zinc/78/11/75/332781175.db2.gz	CDGNUCAWMRFVJR-UHFFFAOYSA-N	0	0	298.361	4.277	20	30		CIEDRN
Cc1c(COC(C)(C)C)cccc1NC[C@@H](C#N)CCC#N	ZINC000573111743	327095529	/nfs/dbraw/zinc/09/55/29/327095529.db2.gz	LURFLSQEAXEDOL-OAHLLOKOSA-N	0	0	299.418	4.166	20	30		CIEDRN
C=CCn1c([C@H](C)CC)nnc1N(C)[C@@H](C)c1ccccc1	ZINC000558452077	327095546	/nfs/dbraw/zinc/09/55/46/327095546.db2.gz	CSWQGMIDGGFZAE-CABCVRRESA-N	0	0	298.434	4.175	20	30		CIEDRN
C=CCn1c([C@@H](C)CC)nnc1N(C)[C@H](C)c1ccccc1	ZINC000558452094	327095571	/nfs/dbraw/zinc/09/55/71/327095571.db2.gz	CSWQGMIDGGFZAE-LSDHHAIUSA-N	0	0	298.434	4.175	20	30		CIEDRN
CC(C)(C#N)c1ccc(C(=O)NCC2(C)CCCCC2)cc1	ZINC000558549883	327103814	/nfs/dbraw/zinc/10/38/14/327103814.db2.gz	IHBYFRYKWPRSLI-UHFFFAOYSA-N	0	0	298.430	4.188	20	30		CIEDRN
CC1(CNC(=O)C[C@H](CC#N)c2ccccc2)CCCCC1	ZINC000558552101	327104394	/nfs/dbraw/zinc/10/43/94/327104394.db2.gz	KROLYLOPBIPFES-KRWDZBQOSA-N	0	0	298.430	4.161	20	30		CIEDRN
CSCc1cccc(Nc2ccc(C#N)c([N+](=O)[O-])c2)c1	ZINC000558589255	327107826	/nfs/dbraw/zinc/10/78/26/327107826.db2.gz	CLVNRUSJSGPOQS-UHFFFAOYSA-N	0	0	299.355	4.073	20	30		CIEDRN
CCc1nc(C(C)C)ccc1COc1ccccc1C#N	ZINC000558808730	327121503	/nfs/dbraw/zinc/12/15/03/327121503.db2.gz	WWBKQKPKDXCVIF-UHFFFAOYSA-N	0	0	280.371	4.218	20	30		CIEDRN
C=CCOCCSc1ncc(-c2ccc(Cl)cc2)o1	ZINC000558828012	327123057	/nfs/dbraw/zinc/12/30/57/327123057.db2.gz	XVHVLVDUXPNLLF-UHFFFAOYSA-N	0	0	295.791	4.290	20	30		CIEDRN
N#Cc1ccc(SCCC2CCOCC2)c(Cl)c1	ZINC000558845348	327125491	/nfs/dbraw/zinc/12/54/91/327125491.db2.gz	SWASVAIGDWUUKS-UHFFFAOYSA-N	0	0	281.808	4.120	20	30		CIEDRN
Cc1nc(C(C)C)ccc1COc1cc(F)cc(C#N)c1	ZINC000558854697	327127153	/nfs/dbraw/zinc/12/71/53/327127153.db2.gz	QVWJBWVNJMTPRM-UHFFFAOYSA-N	0	0	284.334	4.103	20	30		CIEDRN
C=C[C@@H]1CCCCN1c1ncc(C)c(-c2ccccc2F)n1	ZINC000558946405	327133925	/nfs/dbraw/zinc/13/39/25/327133925.db2.gz	GQUMWPLWTJTYQH-CQSZACIVSA-N	0	0	297.377	4.136	20	30		CIEDRN
CN(Cc1c(Cl)cccc1Cl)[C@H]1CC[C@@H](C#N)C1	ZINC000559067043	327139889	/nfs/dbraw/zinc/13/98/89/327139889.db2.gz	WENBIXDFBKEGGI-MNOVXSKESA-N	0	0	283.202	4.117	20	30		CIEDRN
N#C[C@@H](NC(=O)c1cccc2ccccc21)C1CCCCC1	ZINC000128952675	327154961	/nfs/dbraw/zinc/15/49/61/327154961.db2.gz	ZEZURILMENJEPI-GOSISDBHSA-N	0	0	292.382	4.042	20	30		CIEDRN
C[C@H](c1ccco1)N(Cc1ccc(F)cc1C#N)C1CC1	ZINC000086233119	327156177	/nfs/dbraw/zinc/15/61/77/327156177.db2.gz	JBAYMBNOWGUTDX-GFCCVEGCSA-N	0	0	284.334	4.016	20	30		CIEDRN
C=CCCc1ccccc1NC[C@@H]1CCO[C@@H](C)C1	ZINC000409835734	327165291	/nfs/dbraw/zinc/16/52/91/327165291.db2.gz	KZXXDIODLYIUPA-LSDHHAIUSA-N	0	0	259.393	4.032	20	30		CIEDRN
CC(C)COCCS[C@@H](C)c1cccc(C#N)c1	ZINC000409846289	327166150	/nfs/dbraw/zinc/16/61/50/327166150.db2.gz	ACNDORKPQUIKEI-ZDUSSCGKSA-N	0	0	263.406	4.025	20	30		CIEDRN
CC(C)COCCS[C@H](C)c1cccc(C#N)c1	ZINC000409846288	327166157	/nfs/dbraw/zinc/16/61/57/327166157.db2.gz	ACNDORKPQUIKEI-CYBMUJFWSA-N	0	0	263.406	4.025	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H](C)c1nc(C(C)(C)C)cs1	ZINC000569386506	327171465	/nfs/dbraw/zinc/17/14/65/327171465.db2.gz	HJIINYKFELOOCK-NSHDSACASA-N	0	0	294.464	4.220	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H](C)c1nc(C(C)(C)C)cs1	ZINC000569386504	327171496	/nfs/dbraw/zinc/17/14/96/327171496.db2.gz	HJIINYKFELOOCK-LLVKDONJSA-N	0	0	294.464	4.220	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)C[C@H](C)c1ccc(CC)cc1	ZINC000410129837	327180069	/nfs/dbraw/zinc/18/00/69/327180069.db2.gz	HGRJRJSNHRLHFK-YOEHRIQHSA-N	0	0	273.420	4.214	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1	ZINC000410130511	327180263	/nfs/dbraw/zinc/18/02/63/327180263.db2.gz	MOPGUBIDWJSJIM-IPMKNSEASA-N	0	0	293.410	4.414	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)C[C@H](c1ccccc1)C(F)(F)F	ZINC000410146481	327181366	/nfs/dbraw/zinc/18/13/66/327181366.db2.gz	YKTKEBGGYKYURF-ZIAGYGMSSA-N	0	0	299.336	4.194	20	30		CIEDRN
C=CC[N@H+](CC1CCCCC1)[C@@H](C)c1ccc(C(=O)[O-])o1	ZINC000569491901	327185051	/nfs/dbraw/zinc/18/50/51/327185051.db2.gz	DYTMWEWYOHPIKY-ZDUSSCGKSA-N	0	0	291.391	4.107	20	30		CIEDRN
Cc1c(NCc2ccc(C#N)o2)cccc1C(F)(F)F	ZINC000159427122	327186451	/nfs/dbraw/zinc/18/64/51/327186451.db2.gz	VFFGSABSQNASDI-UHFFFAOYSA-N	0	0	280.249	4.091	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)CCOc1ccccc1	ZINC000410354398	327187224	/nfs/dbraw/zinc/18/72/24/327187224.db2.gz	WCEHPZKNEWDIKQ-UHFFFAOYSA-N	0	0	295.382	4.213	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1ccccc1OC	ZINC000410344926	327187494	/nfs/dbraw/zinc/18/74/94/327187494.db2.gz	NIWKGKFMTVVFEL-UHFFFAOYSA-N	0	0	281.355	4.066	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1cccc(F)c1	ZINC000410353526	327187814	/nfs/dbraw/zinc/18/78/14/327187814.db2.gz	NOEHCRUWAXXWQF-UHFFFAOYSA-N	0	0	269.319	4.197	20	30		CIEDRN
N#CC1(CCSC[C@@H]2CCCOC2)CCCCC1	ZINC000569559838	327197485	/nfs/dbraw/zinc/19/74/85/327197485.db2.gz	PDEHVYKSKJKREK-CQSZACIVSA-N	0	0	267.438	4.010	20	30		CIEDRN
C=CCCCSCCC(=O)N1CCCc2ccccc21	ZINC000507118388	332788247	/nfs/dbraw/zinc/78/82/47/332788247.db2.gz	YGPCSMGGDAZCME-UHFFFAOYSA-N	0	0	289.444	4.055	20	30		CIEDRN
N#CC1(CSCc2ccccc2C(F)(F)F)CC1	ZINC000507132011	332789186	/nfs/dbraw/zinc/78/91/86/332789186.db2.gz	HUDCJFRIFXEOAE-UHFFFAOYSA-N	0	0	271.307	4.242	20	30		CIEDRN
Cc1sc(NC(=O)C(C)(C)C2CCCC2)c(C#N)c1C	ZINC000533876468	327229815	/nfs/dbraw/zinc/22/98/15/327229815.db2.gz	RTUMUXGBTJISMO-UHFFFAOYSA-N	0	0	290.432	4.392	20	30		CIEDRN
N#Cc1cccc(Cl)c1NC1CCC(F)(F)CC1	ZINC000536391056	327235114	/nfs/dbraw/zinc/23/51/14/327235114.db2.gz	NLIMDCPRLFOLCO-UHFFFAOYSA-N	0	0	270.710	4.201	20	30		CIEDRN
N#Cc1ccc(CSCCCCF)c(OC(F)F)c1	ZINC000507135725	332789869	/nfs/dbraw/zinc/78/98/69/332789869.db2.gz	UVXZDSLBWHCUDY-UHFFFAOYSA-N	0	0	289.322	4.143	20	30		CIEDRN
CC[C@H](C)[C@@H]1CCCCN1C(=O)Nc1cc(C#N)ccc1C	ZINC000531080829	327240739	/nfs/dbraw/zinc/24/07/39/327240739.db2.gz	KDUWTRKNGRMZEJ-GUYCJALGSA-N	0	0	299.418	4.299	20	30		CIEDRN
CC[C@@H](CC(=O)N[C@](C)(C#N)CC(C)C)c1ccccc1	ZINC000559575469	327254322	/nfs/dbraw/zinc/25/43/22/327254322.db2.gz	UYWPTPFAVUYJJN-YJBOKZPZSA-N	0	0	286.419	4.015	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1C[C@H](c2ccccc2C)C[C@H]1C	ZINC000559926527	327271698	/nfs/dbraw/zinc/27/16/98/327271698.db2.gz	ACWOJSCYYMBRPI-HZPDHXFCSA-N	0	0	285.431	4.302	20	30		CIEDRN
N#Cc1cc(F)ccc1CSCCCCCF	ZINC000559956114	327273486	/nfs/dbraw/zinc/27/34/86/327273486.db2.gz	WQUJZUZVVVBXLC-UHFFFAOYSA-N	0	0	255.333	4.070	20	30		CIEDRN
C=CCC(C)(C)c1noc(COc2ccsc2Cl)n1	ZINC000560008219	327276093	/nfs/dbraw/zinc/27/60/93/327276093.db2.gz	GQSJEERSMVBKPN-UHFFFAOYSA-N	0	0	298.795	4.217	20	30		CIEDRN
COC(C)(C)CCSc1cccc(Cl)c1C#N	ZINC000560003639	327276879	/nfs/dbraw/zinc/27/68/79/327276879.db2.gz	JAFQXWGNAZJYTG-UHFFFAOYSA-N	0	0	269.797	4.119	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cc(C)n([C@H](C)CC)n2)n1	ZINC000560024490	327278087	/nfs/dbraw/zinc/27/80/87/327278087.db2.gz	LTXCZFPYQZATRO-LLVKDONJSA-N	0	0	288.395	4.066	20	30		CIEDRN
C=CCC(C)(C)c1noc(C(C)(C)c2ccc(F)cc2)n1	ZINC000560024323	327278136	/nfs/dbraw/zinc/27/81/36/327278136.db2.gz	JUBJVEYOJAUSTM-UHFFFAOYSA-N	0	0	288.366	4.388	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ccc(Cl)cc2)n1	ZINC000560025026	327278139	/nfs/dbraw/zinc/27/81/39/327278139.db2.gz	PKQBTXHDWNQEGP-UHFFFAOYSA-N	0	0	262.740	4.244	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ccc(C#N)c(Cl)c2)n1	ZINC000560029306	327278143	/nfs/dbraw/zinc/27/81/43/327278143.db2.gz	SNDBHRKZAFCBIT-UHFFFAOYSA-N	0	0	287.750	4.115	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H](C)Oc2ccccc2F)n1	ZINC000560025180	327278165	/nfs/dbraw/zinc/27/81/65/327278165.db2.gz	OTPFHDHXKWASPW-LLVKDONJSA-N	0	0	290.338	4.202	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ccnn2C(CC)CC)n1	ZINC000560025843	327278521	/nfs/dbraw/zinc/27/85/21/327278521.db2.gz	UHWRUHKVJBQDBM-UHFFFAOYSA-N	0	0	288.395	4.148	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N(C)[C@@H]1CCCc2ccccc21	ZINC000560033332	327278856	/nfs/dbraw/zinc/27/88/56/327278856.db2.gz	APVOLCNDWLBHII-AEFFLSMTSA-N	0	0	271.404	4.125	20	30		CIEDRN
C=CC(C)(C)C(=O)Nc1ccc2oc(C(C)C)nc2c1	ZINC000560069454	327282140	/nfs/dbraw/zinc/28/21/40/327282140.db2.gz	TXWXSNVMVFGSNY-UHFFFAOYSA-N	0	0	272.348	4.102	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)[C@@H](C)C(CC)CC)s1	ZINC000560097998	327283983	/nfs/dbraw/zinc/28/39/83/327283983.db2.gz	UJUOIUUPERZNCI-JTQLQIEISA-N	0	0	278.421	4.193	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)[C@@H]2CC=CC[C@H]2C)CCCC1(C)C	ZINC000560120205	327285363	/nfs/dbraw/zinc/28/53/63/327285363.db2.gz	IPNWMQVZNKBHAM-OAGGEKHMSA-N	0	0	275.436	4.182	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCc1ccc(C)cc1OCCC	ZINC000560242470	327292481	/nfs/dbraw/zinc/29/24/81/327292481.db2.gz	MMEWQSIEOJOTRP-UHFFFAOYSA-N	0	0	289.419	4.002	20	30		CIEDRN
C=C(C)COc1ccc(Cl)c(C(F)(F)F)c1	ZINC000564680182	327296981	/nfs/dbraw/zinc/29/69/81/327296981.db2.gz	BHODTMJVPNYRML-UHFFFAOYSA-N	0	0	250.647	4.314	20	30		CIEDRN
C=C(C)CCSCc1nc(-c2ccc(C)cc2)no1	ZINC000560442355	327307746	/nfs/dbraw/zinc/30/77/46/327307746.db2.gz	JYMMKRIORUICBQ-UHFFFAOYSA-N	0	0	274.389	4.244	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)C1CC(C)(C)C1	ZINC000560692398	327337183	/nfs/dbraw/zinc/33/71/83/327337183.db2.gz	ASDYNSUOJZRQGF-UHFFFAOYSA-N	0	0	271.404	4.028	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H]1CCc2sc(Cl)cc21	ZINC000560770332	327342165	/nfs/dbraw/zinc/34/21/65/327342165.db2.gz	QDPXGJMVJYNIPQ-SNVBAGLBSA-N	0	0	283.824	4.107	20	30		CIEDRN
C=CCCC(=O)Nc1cccc(COc2ccc(F)cc2)c1	ZINC000560994341	327356831	/nfs/dbraw/zinc/35/68/31/327356831.db2.gz	MNEVJQWOFLNRKJ-UHFFFAOYSA-N	0	0	299.345	4.309	20	30		CIEDRN
CC(=O)c1ccsc1NCC#Cc1ccccc1Cl	ZINC000427423429	327374803	/nfs/dbraw/zinc/37/48/03/327374803.db2.gz	DQVVZYXYWXKUBE-UHFFFAOYSA-N	0	0	289.787	4.068	20	30		CIEDRN
N#Cc1c(F)cccc1CNc1ccc2ccoc2c1	ZINC000427436539	327376523	/nfs/dbraw/zinc/37/65/23/327376523.db2.gz	SCSRHVHHLPGYSM-UHFFFAOYSA-N	0	0	266.275	4.056	20	30		CIEDRN
C=CCC(F)(F)c1nc(-c2occc2C(C)C)no1	ZINC000561285043	327382497	/nfs/dbraw/zinc/38/24/97/327382497.db2.gz	REWARZAOBSANEL-UHFFFAOYSA-N	0	0	268.263	4.121	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N1CCC2(CCCC2)CC1	ZINC000561295595	327383383	/nfs/dbraw/zinc/38/33/83/327383383.db2.gz	HXCXCSQOKXQDJX-HNNXBMFYSA-N	0	0	278.440	4.097	20	30		CIEDRN
C=CCCSCC(=O)N[C@@H](c1cccs1)C(C)(C)C	ZINC000154976530	327388373	/nfs/dbraw/zinc/38/83/73/327388373.db2.gz	IEPJNRNSHFMRII-AWEZNQCLSA-N	0	0	297.489	4.261	20	30		CIEDRN
N#Cc1ccc(N2CCCC3(CCCCC3)C2)cc1[N+](=O)[O-]	ZINC000561409658	327393360	/nfs/dbraw/zinc/39/33/60/327393360.db2.gz	CHHUSNFIAYMDHR-UHFFFAOYSA-N	0	0	299.374	4.017	20	30		CIEDRN
N#Cc1c(N[C@H]2CCC[C@@H](F)C2)cccc1C(F)F	ZINC000566483943	327394109	/nfs/dbraw/zinc/39/41/09/327394109.db2.gz	XZSHSWWUZRPPCJ-ZJUUUORDSA-N	0	0	268.282	4.188	20	30		CIEDRN
C=CCCCCCN(C)[C@@H](C)c1nc(C(C)(C)C)no1	ZINC000150877514	327394134	/nfs/dbraw/zinc/39/41/34/327394134.db2.gz	TZGGPFWQTLEDKF-ZDUSSCGKSA-N	0	0	279.428	4.106	20	30		CIEDRN
N#Cc1cnccc1Nc1ccc(CCC(F)(F)F)cc1	ZINC000561428387	327394325	/nfs/dbraw/zinc/39/43/25/327394325.db2.gz	XDPOJWIQNKKWKO-UHFFFAOYSA-N	0	0	291.276	4.192	20	30		CIEDRN
CC(C)(C)Oc1ccccc1NCc1ccc(C#N)s1	ZINC000150883354	327395242	/nfs/dbraw/zinc/39/52/42/327395242.db2.gz	WADNMEXJFBGKTC-UHFFFAOYSA-N	0	0	286.400	4.409	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@H](c2ccccc2)[C@H](C)C1	ZINC000150911384	327398741	/nfs/dbraw/zinc/39/87/41/327398741.db2.gz	BMRAXKAYDOFGBX-APWZRJJASA-N	0	0	297.442	4.407	20	30		CIEDRN
C=CCCC(=O)N[C@H]1CCC[C@H](C(C)(C)C)CC1	ZINC000474275934	331578457	/nfs/dbraw/zinc/57/84/57/331578457.db2.gz	QDCZBPCQDRUKAU-KBPBESRZSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CC[C@H](C(C)(C)C)C[C@@H]1C	ZINC000561867853	327427635	/nfs/dbraw/zinc/42/76/35/327427635.db2.gz	OLBBYVQLGCCARP-GRDNDAEWSA-N	0	0	265.441	4.262	20	30		CIEDRN
C=CC1CCN(C(=O)C2(CC(C)C)CCCC2)CC1	ZINC000151141435	327443012	/nfs/dbraw/zinc/44/30/12/327443012.db2.gz	UZESAFJLQAASFG-UHFFFAOYSA-N	0	0	263.425	4.018	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](c2ccc(CC)cc2)C1	ZINC000562119812	327450575	/nfs/dbraw/zinc/45/05/75/327450575.db2.gz	CIVROGBQBIYSMX-MAUKXSAKSA-N	0	0	285.431	4.167	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@H](c2ccc(CC)cc2)C1	ZINC000562114797	327450890	/nfs/dbraw/zinc/45/08/90/327450890.db2.gz	CJFOVYWXJJUCNJ-IBGZPJMESA-N	0	0	297.442	4.333	20	30		CIEDRN
N#CCn1c(/C=C/c2ccc(F)cc2F)nc2ccccc21	ZINC000562288600	327463815	/nfs/dbraw/zinc/46/38/15/327463815.db2.gz	RRMYWPUHEMGNSY-SOFGYWHQSA-N	0	0	295.292	4.008	20	30		CIEDRN
C=C(C)CN(CC)C(=O)C1(c2ccc(F)cc2)CCCC1	ZINC000248234749	327472123	/nfs/dbraw/zinc/47/21/23/327472123.db2.gz	MCCIFLGDLFMVEP-UHFFFAOYSA-N	0	0	289.394	4.062	20	30		CIEDRN
C=CCCCC(=O)N1[C@H](C)C[C@H](c2ccccc2)[C@H]1C	ZINC000248345712	327475316	/nfs/dbraw/zinc/47/53/16/327475316.db2.gz	NCMHBRAOVHFMCG-INMHGKMJSA-N	0	0	271.404	4.136	20	30		CIEDRN
N#Cc1cc(N[C@H](CC2CCCC2)c2ccccc2)ncn1	ZINC000562419939	327480263	/nfs/dbraw/zinc/48/02/63/327480263.db2.gz	KOVXPLLDOMJKNR-QGZVFWFLSA-N	0	0	292.386	4.082	20	30		CIEDRN
CCC[C@@H](C)C(=O)N(CC)c1ccc(C#N)c(Cl)c1	ZINC000156563378	327526735	/nfs/dbraw/zinc/52/67/35/327526735.db2.gz	GCGYLGCLXNSFJM-LLVKDONJSA-N	0	0	278.783	4.001	20	30		CIEDRN
C=C(C)CCc1noc(CO[C@H]2CCCC[C@H]2CC)n1	ZINC000569766637	327545880	/nfs/dbraw/zinc/54/58/80/327545880.db2.gz	IPPVUXAIKRFBON-KGLIPLIRSA-N	0	0	278.396	4.064	20	30		CIEDRN
CC1(C)CCC(c2noc(-c3ccc(CC#N)cc3)n2)CC1	ZINC000570603264	327603183	/nfs/dbraw/zinc/60/31/83/327603183.db2.gz	AFRGXRPVOQIXSG-UHFFFAOYSA-N	0	0	295.386	4.486	20	30		CIEDRN
CN(C(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1cccc(C#N)c1	ZINC000318138947	327605793	/nfs/dbraw/zinc/60/57/93/327605793.db2.gz	YHLYBKIRHCUDJU-GVDBMIGSSA-N	0	0	296.414	4.128	20	30		CIEDRN
Cc1ccc(OC(F)F)c(CNc2cccc(C#N)c2)c1	ZINC000526085382	328619256	/nfs/dbraw/zinc/61/92/56/328619256.db2.gz	QXLGOUVACFZGFQ-UHFFFAOYSA-N	0	0	288.297	4.080	20	30		CIEDRN
C=CCN(C(=O)c1cccc(C)c1Cl)c1ccccc1	ZINC000535876920	328644988	/nfs/dbraw/zinc/64/49/88/328644988.db2.gz	PUTHYBPJGTWTFG-UHFFFAOYSA-N	0	0	285.774	4.481	20	30		CIEDRN
N#Cc1cc(Cl)ccc1NCCc1cccc(F)c1	ZINC000052857089	328654860	/nfs/dbraw/zinc/65/48/60/328654860.db2.gz	YFIZYWNZHBARLR-UHFFFAOYSA-N	0	0	274.726	4.005	20	30		CIEDRN
Cc1ccc([C@H]2CCCN2c2ccc(C#N)cc2)s1	ZINC000114710629	328656097	/nfs/dbraw/zinc/65/60/97/328656097.db2.gz	JFLCYBXYDYPBLM-OAHLLOKOSA-N	0	0	268.385	4.270	20	30		CIEDRN
CCC[C@@H](NC(=O)c1ccc(CC#N)cc1)C1CCCCC1	ZINC000536104892	328656522	/nfs/dbraw/zinc/65/65/22/328656522.db2.gz	ZVFPUCICALPMIY-GOSISDBHSA-N	0	0	298.430	4.231	20	30		CIEDRN
C[C@H](C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1)C(C)(C)C	ZINC000399168507	328669285	/nfs/dbraw/zinc/66/92/85/328669285.db2.gz	KSHWEQMUIHMVAU-SECBINFHSA-N	0	0	298.308	4.198	20	30		CIEDRN
N#Cc1ccc(CSC[C@H]2CCCCO2)c(Cl)c1	ZINC000527368027	328673675	/nfs/dbraw/zinc/67/36/75/328673675.db2.gz	RWQKXMZYGJVPIQ-CYBMUJFWSA-N	0	0	281.808	4.014	20	30		CIEDRN
Cc1ccc(C#N)c(Sc2cccc(Cl)c2)n1	ZINC000054185502	328689328	/nfs/dbraw/zinc/68/93/28/328689328.db2.gz	DUYVMDBHSVNVCO-UHFFFAOYSA-N	0	0	260.749	4.066	20	30		CIEDRN
C=CCCS[C@H](C)C(=O)N1c2ccccc2CC[C@@H]1C	ZINC000532261813	328711818	/nfs/dbraw/zinc/71/18/18/328711818.db2.gz	LTYMVNKJYSAZRI-UONOGXRCSA-N	0	0	289.444	4.052	20	30		CIEDRN
C=CCNc1ccc(Oc2cccc(C(F)(F)F)n2)cc1	ZINC000532302577	328712870	/nfs/dbraw/zinc/71/28/70/328712870.db2.gz	MMHIKCLGSHOKQA-UHFFFAOYSA-N	0	0	294.276	4.491	20	30		CIEDRN
Cc1c(C#N)cccc1NCc1cccc(OC(C)(C)C)n1	ZINC000507643844	332818132	/nfs/dbraw/zinc/81/81/32/332818132.db2.gz	JCELKAUKNJZMLF-UHFFFAOYSA-N	0	0	295.386	4.051	20	30		CIEDRN
N#Cc1ccc(C(=O)Nc2cccc3ccsc32)cc1	ZINC000395407268	328737334	/nfs/dbraw/zinc/73/73/34/328737334.db2.gz	GSWBIHWIMOEMKS-UHFFFAOYSA-N	0	0	278.336	4.025	20	30		CIEDRN
C[C@@H](NCc1ccc(C#N)cc1F)c1ccccc1Cl	ZINC000042336066	328763188	/nfs/dbraw/zinc/76/31/88/328763188.db2.gz	DJPWKKYFTDXSHQ-LLVKDONJSA-N	0	0	288.753	4.202	20	30		CIEDRN
CCOc1cc(C#N)ccc1OCc1cc(C)cc(C)c1	ZINC000042273597	328763987	/nfs/dbraw/zinc/76/39/87/328763987.db2.gz	MFWCPPLTALOXFT-UHFFFAOYSA-N	0	0	281.355	4.153	20	30		CIEDRN
N#Cc1ccc(OCc2cccc(F)c2F)c(Cl)c1	ZINC000042313470	328765485	/nfs/dbraw/zinc/76/54/85/328765485.db2.gz	HZMISMZSMPRLIT-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
C[C@H](NCc1ccc(F)cc1C#N)c1ccccc1Cl	ZINC000103138880	328766164	/nfs/dbraw/zinc/76/61/64/328766164.db2.gz	UYCHFIHHXCHZJQ-NSHDSACASA-N	0	0	288.753	4.202	20	30		CIEDRN
CCCc1ccccc1NCc1ccc(C#N)cc1F	ZINC000042373801	328767287	/nfs/dbraw/zinc/76/72/87/328767287.db2.gz	FKCXEZLTQKLKNA-UHFFFAOYSA-N	0	0	268.335	4.262	20	30		CIEDRN
COc1ccc(Cl)c(N[C@@H](C)c2cccc(C#N)c2)c1	ZINC000043317099	328786484	/nfs/dbraw/zinc/78/64/84/328786484.db2.gz	ASODHIUTBLTBIM-NSHDSACASA-N	0	0	286.762	4.393	20	30		CIEDRN
CCc1ccc(CC)c(NCc2cc(C#N)cs2)c1	ZINC000532744181	328807902	/nfs/dbraw/zinc/80/79/02/328807902.db2.gz	SLSMZEICIOYLBT-UHFFFAOYSA-N	0	0	270.401	4.357	20	30		CIEDRN
CC[C@@](C)(NCC#Cc1ccccc1Cl)C(F)(F)F	ZINC000532747292	328808391	/nfs/dbraw/zinc/80/83/91/328808391.db2.gz	ZIDWULSXKFKWPI-CYBMUJFWSA-N	0	0	289.728	4.012	20	30		CIEDRN
Cc1cc(C)cc([C@@H](C)Nc2snc(Cl)c2C#N)c1	ZINC000301176127	328827364	/nfs/dbraw/zinc/82/73/64/328827364.db2.gz	GBPXGKXZXYOGQH-SNVBAGLBSA-N	0	0	291.807	4.458	20	30		CIEDRN
Cc1ccc([C@@H](C)N(C)c2ccc(Cl)c(C#N)n2)cc1	ZINC000301520747	328828555	/nfs/dbraw/zinc/82/85/55/328828555.db2.gz	LGXURQIOPLWKON-GFCCVEGCSA-N	0	0	285.778	4.113	20	30		CIEDRN
Cc1ccc(Oc2snc(Cl)c2C#N)cc1C	ZINC000301919897	328830325	/nfs/dbraw/zinc/83/03/25/328830325.db2.gz	DHXFNSVOJCXXEX-UHFFFAOYSA-N	0	0	264.737	4.077	20	30		CIEDRN
C=CCCO[C@@H](C)c1nc(-c2ccc(Cl)cc2F)no1	ZINC000563981286	328842813	/nfs/dbraw/zinc/84/28/13/328842813.db2.gz	PNCRIMPQUFTFLR-VIFPVBQESA-N	0	0	296.729	4.183	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cc(C)c(OC)cc1Cl	ZINC000571681964	328852253	/nfs/dbraw/zinc/85/22/53/328852253.db2.gz	PNZBXOUNZSLOMJ-OAHLLOKOSA-N	0	0	281.783	4.198	20	30		CIEDRN
C=CCCC1(C(=O)Nc2sc(CCC)nc2C)CC1	ZINC000356869254	328863918	/nfs/dbraw/zinc/86/39/18/328863918.db2.gz	DMIAFVLVWCTXEF-UHFFFAOYSA-N	0	0	278.421	4.089	20	30		CIEDRN
C=C(C)CCS[C@@H](C)C(=O)Nc1cc(F)ccc1C	ZINC000507817968	332826291	/nfs/dbraw/zinc/82/62/91/332826291.db2.gz	BFBKKPNLTSSGQY-LBPRGKRZSA-N	0	0	281.396	4.161	20	30		CIEDRN
C[C@@H]1CCN(Cc2ccc(C#N)s2)c2ccccc21	ZINC000507861949	332828143	/nfs/dbraw/zinc/82/81/43/332828143.db2.gz	SXFDOFCYZHXSRO-GFCCVEGCSA-N	0	0	268.385	4.134	20	30		CIEDRN
C[C@@H](CCNc1c(C#N)cccc1C#N)c1ccccc1	ZINC000358685021	328892148	/nfs/dbraw/zinc/89/21/48/328892148.db2.gz	RHZYBRCXHPTXTA-AWEZNQCLSA-N	0	0	275.355	4.036	20	30		CIEDRN
Cc1cc(F)cc2c1ncc(C#N)c2N1CCC[C@H](C)CC1	ZINC000360536223	328908683	/nfs/dbraw/zinc/90/86/83/328908683.db2.gz	ULSMZBRUTSUFOJ-LBPRGKRZSA-N	0	0	297.377	4.180	20	30		CIEDRN
Cc1ccc(NC(=O)Nc2cc(C#N)cn2C(C)(C)C)cc1	ZINC000508071577	332833234	/nfs/dbraw/zinc/83/32/34/332833234.db2.gz	NHVJANGGLCFKNJ-UHFFFAOYSA-N	0	0	296.374	4.067	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1cccc(C)c1Cl	ZINC000580397123	328931045	/nfs/dbraw/zinc/93/10/45/328931045.db2.gz	SBGOISDCPYBQHR-NSHDSACASA-N	0	0	266.772	4.125	20	30		CIEDRN
CC(C)COc1ccccc1NCc1ccc(F)c(C#N)c1	ZINC000389711323	328950256	/nfs/dbraw/zinc/95/02/56/328950256.db2.gz	FGLBIYLCQJTWPZ-UHFFFAOYSA-N	0	0	298.361	4.344	20	30		CIEDRN
C[C@H](CCOCc1ccccc1)Nc1ccc(C#N)cc1F	ZINC000390214479	328966653	/nfs/dbraw/zinc/96/66/53/328966653.db2.gz	WRGOKRNVOJNAPI-CQSZACIVSA-N	0	0	298.361	4.105	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)CC(C)(C)C2CC2)CCCC1(C)C	ZINC000508074034	332833496	/nfs/dbraw/zinc/83/34/96/332833496.db2.gz	NKUUWBHRLOBHMX-HNNXBMFYSA-N	0	0	277.452	4.406	20	30		CIEDRN
CC[C@@H](CC(=O)N(C)c1ccccc1C#N)c1ccccc1	ZINC000508086040	332833539	/nfs/dbraw/zinc/83/35/39/332833539.db2.gz	ZQKHAXZWYPATAV-HNNXBMFYSA-N	0	0	292.382	4.105	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCCC[C@H]1c1ncc(C)s1	ZINC000375102559	329000542	/nfs/dbraw/zinc/00/05/42/329000542.db2.gz	AGIPVUSYLSPWHF-JSGCOSHPSA-N	0	0	292.448	4.107	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCCC[C@H]1c1ncc(C)s1	ZINC000375102561	329000546	/nfs/dbraw/zinc/00/05/46/329000546.db2.gz	AGIPVUSYLSPWHF-OCCSQVGLSA-N	0	0	292.448	4.107	20	30		CIEDRN
C=C(C)CCSCC(=O)N1CCC[C@@H]1c1cccs1	ZINC000375639847	329004829	/nfs/dbraw/zinc/00/48/29/329004829.db2.gz	GJHKRPKEVXUBPQ-CYBMUJFWSA-N	0	0	295.473	4.111	20	30		CIEDRN
N#CC[C@@H]1C[C@H]2[C@H](CCC[C@@H]2Nc2ccsc2Cl)O1	ZINC000377393921	329014061	/nfs/dbraw/zinc/01/40/61/329014061.db2.gz	VDMBJJDBRHBBIF-DCQANWLSSA-N	0	0	296.823	4.053	20	30		CIEDRN
C[C@@H](Nc1cccc2c1OCCC2)c1ccc(C#N)cc1	ZINC000378132636	329041082	/nfs/dbraw/zinc/04/10/82/329041082.db2.gz	IUKPFWBFIUGOFV-CYBMUJFWSA-N	0	0	278.355	4.056	20	30		CIEDRN
C=CCCC(=O)NCc1sc2ccc(Cl)cc2c1C	ZINC000508374285	332837659	/nfs/dbraw/zinc/83/76/59/332837659.db2.gz	FZYVPDONUYIRQA-UHFFFAOYSA-N	0	0	293.819	4.446	20	30		CIEDRN
CCCCCCC(=O)N1CC=C(c2ccc(C#N)cc2)CC1	ZINC000378359539	329047514	/nfs/dbraw/zinc/04/75/14/329047514.db2.gz	YTXAXUVDQKFALA-UHFFFAOYSA-N	0	0	296.414	4.144	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H](C)CC1CCCCC1	ZINC000508415513	332838238	/nfs/dbraw/zinc/83/82/38/332838238.db2.gz	AURAWSSLXYANSV-ZDUSSCGKSA-N	0	0	251.414	4.064	20	30		CIEDRN
Cc1ccc(CN(CCC#N)Cc2ccco2)cc1Cl	ZINC000193602838	329059870	/nfs/dbraw/zinc/05/98/70/329059870.db2.gz	GXSOCQBBVYWBEQ-UHFFFAOYSA-N	0	0	288.778	4.157	20	30		CIEDRN
C=CCN(C(=O)c1csc(C(C)C)n1)c1ccccc1	ZINC000171428249	329075324	/nfs/dbraw/zinc/07/53/24/329075324.db2.gz	NQXZCCKTCCDKPG-UHFFFAOYSA-N	0	0	286.400	4.099	20	30		CIEDRN
C=CC[C@H]1N(C(=O)C2CC3(CCC3)C2)CCCC1(C)C	ZINC000582547437	329105377	/nfs/dbraw/zinc/10/53/77/329105377.db2.gz	FNYCDMKWIUENIO-OAHLLOKOSA-N	0	0	275.436	4.160	20	30		CIEDRN
C=C(C)CCc1noc(C(C)(C)c2ccc(F)cc2)n1	ZINC000508593306	332842658	/nfs/dbraw/zinc/84/26/58/332842658.db2.gz	FCQSOVHTCWOHGV-UHFFFAOYSA-N	0	0	274.339	4.043	20	30		CIEDRN
Cc1ccc([C@H](C)N(C)Cc2cc(F)ccc2C#N)cc1	ZINC000469083894	329148436	/nfs/dbraw/zinc/14/84/36/329148436.db2.gz	WTLZADFYKBOMRE-AWEZNQCLSA-N	0	0	282.362	4.199	20	30		CIEDRN
Cc1ccc([C@@H](C)N(C)Cc2cc(F)ccc2C#N)cc1	ZINC000469084086	329149612	/nfs/dbraw/zinc/14/96/12/329149612.db2.gz	WTLZADFYKBOMRE-CQSZACIVSA-N	0	0	282.362	4.199	20	30		CIEDRN
C=CCCC(=O)N1CC[C@H](C)C[C@H]1c1ccc(CC)o1	ZINC000173634551	329149769	/nfs/dbraw/zinc/14/97/69/329149769.db2.gz	OIUOLPXOMQSSCO-ZFWWWQNUSA-N	0	0	275.392	4.108	20	30		CIEDRN
C=CCCCSCc1nc([C@@H](C)OCC(C)C)no1	ZINC000174252531	329155437	/nfs/dbraw/zinc/15/54/37/329155437.db2.gz	KOYLHVYIWXOSDH-GFCCVEGCSA-N	0	0	284.425	4.003	20	30		CIEDRN
C=CCOCCCC(=O)N(c1cc(C)ccc1C)C(C)C	ZINC000175181269	329163125	/nfs/dbraw/zinc/16/31/25/329163125.db2.gz	ZZVDMYOVJFNJIE-UHFFFAOYSA-N	0	0	289.419	4.028	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@H]1c1cccc(C)c1	ZINC000175391027	329164710	/nfs/dbraw/zinc/16/47/10/329164710.db2.gz	WBPSCDYPMLQFMJ-INIZCTEOSA-N	0	0	257.377	4.015	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@@H]1c1cccc(Cl)c1	ZINC000175360463	329165078	/nfs/dbraw/zinc/16/50/78/329165078.db2.gz	FSESDKFSQBDFLD-OAHLLOKOSA-N	0	0	277.795	4.360	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@@H]1c1ccc(OCC)cc1	ZINC000175170126	329165911	/nfs/dbraw/zinc/16/59/11/329165911.db2.gz	CPNUSEJGVWRMBP-QGZVFWFLSA-N	0	0	287.403	4.105	20	30		CIEDRN
C=CCCCC(=O)N1CC[C@@H](C)[C@H]1c1cccc(F)c1	ZINC000176339057	329174343	/nfs/dbraw/zinc/17/43/43/329174343.db2.gz	HGANKNMWJUODSO-DYVFJYSZSA-N	0	0	275.367	4.092	20	30		CIEDRN
CC(C)C1(CNC(=O)Nc2ccc(C(C)(C)C#N)cc2)CC1	ZINC000176258758	329175977	/nfs/dbraw/zinc/17/59/77/329175977.db2.gz	JVRRKVPCWQDRKG-UHFFFAOYSA-N	0	0	299.418	4.045	20	30		CIEDRN
C=C(C)CCc1noc(CSc2ccccc2C)n1	ZINC000508658353	332845615	/nfs/dbraw/zinc/84/56/15/332845615.db2.gz	AYFKTNJLFWOJMR-UHFFFAOYSA-N	0	0	274.389	4.179	20	30		CIEDRN
CC(C)(C)C1CCC(CC(=O)NCCCCC#N)CC1	ZINC000178077679	329192397	/nfs/dbraw/zinc/19/23/97/329192397.db2.gz	PIZYQSSSRKRGPB-UHFFFAOYSA-N	0	0	278.440	4.039	20	30		CIEDRN
C=C(C)CCc1noc(/C=C/c2cccc(C)c2)n1	ZINC000508645393	332845913	/nfs/dbraw/zinc/84/59/13/332845913.db2.gz	MRKDCCDNEHCETD-CSKARUKUSA-N	0	0	254.333	4.057	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(C)c(-c2nc(C)co2)c1	ZINC000178157757	329196069	/nfs/dbraw/zinc/19/60/69/329196069.db2.gz	FYRVRPWXGVCYIU-UHFFFAOYSA-N	0	0	284.359	4.253	20	30		CIEDRN
C=C(C)CCc1noc(-c2cc(F)c(Cl)cc2F)n1	ZINC000508661781	332846161	/nfs/dbraw/zinc/84/61/61/332846161.db2.gz	KOMHZBLODOGWHP-UHFFFAOYSA-N	0	0	284.693	4.177	20	30		CIEDRN
C=CCCCC(=O)N(C)[C@@H](C)c1sc(C(C)C)nc1C	ZINC000179204106	329205974	/nfs/dbraw/zinc/20/59/74/329205974.db2.gz	SRTVBTWJMNVMHZ-ZDUSSCGKSA-N	0	0	294.464	4.451	20	30		CIEDRN
C=CCCCC(=O)N(C)[C@H](C)c1sc(C(C)C)nc1C	ZINC000179204094	329206105	/nfs/dbraw/zinc/20/61/05/329206105.db2.gz	SRTVBTWJMNVMHZ-CYBMUJFWSA-N	0	0	294.464	4.451	20	30		CIEDRN
C#CCCCCC(=O)N1CCC[C@@H]1c1ccccc1Cl	ZINC000179792204	329207934	/nfs/dbraw/zinc/20/79/34/329207934.db2.gz	VKJPETAPXXPVMS-MRXNPFEDSA-N	0	0	289.806	4.197	20	30		CIEDRN
C=C(C)CCc1noc(/C=C\c2nc3ccccc3s2)n1	ZINC000508665912	332846622	/nfs/dbraw/zinc/84/66/22/332846622.db2.gz	NNNBCRAPRXQBMJ-KTKRTIGZSA-N	0	0	297.383	4.358	20	30		CIEDRN
C=C(C)CCc1noc(/C(C)=C/c2ccc(C)cc2)n1	ZINC000508671517	332846956	/nfs/dbraw/zinc/84/69/56/332846956.db2.gz	NCBUYRVUNPENNA-SDNWHVSQSA-N	0	0	268.360	4.447	20	30		CIEDRN
N#CCCN(Cc1ccc(Oc2ccccc2)o1)CC1CC1	ZINC000180429667	329216635	/nfs/dbraw/zinc/21/66/35/329216635.db2.gz	XAXXAIXDTIOGAW-UHFFFAOYSA-N	0	0	296.370	4.198	20	30		CIEDRN
N#Cc1ccc(SCc2ccncc2)cc1C(F)(F)F	ZINC000181052391	329225486	/nfs/dbraw/zinc/22/54/86/329225486.db2.gz	IEWVVRUPLUATMR-UHFFFAOYSA-N	0	0	294.301	4.264	20	30		CIEDRN
C=C(C)CN(C)Cc1ncc(-c2ccccc2Cl)o1	ZINC000181303057	329230736	/nfs/dbraw/zinc/23/07/36/329230736.db2.gz	VBGBGCLPWRADQD-UHFFFAOYSA-N	0	0	276.767	4.003	20	30		CIEDRN
C=C(C)Cn1c(C(C)C)nnc1N(CC)Cc1ccccc1	ZINC000460929338	329233967	/nfs/dbraw/zinc/23/39/67/329233967.db2.gz	DRVNFDJHXLNNLZ-UHFFFAOYSA-N	0	0	298.434	4.004	20	30		CIEDRN
CCCCCCCC(=O)N1C[C@@H](C)C[C@@H]1c1cccnc1	ZINC000182163631	329240393	/nfs/dbraw/zinc/24/03/93/329240393.db2.gz	BDTAZFPBELKAAC-DOTOQJQBSA-N	0	0	288.435	4.352	20	30		CIEDRN
O=C(/C=C/c1cccc(-c2ccccn2)c1)c1ccncc1	ZINC000182241534	329240964	/nfs/dbraw/zinc/24/09/64/329240964.db2.gz	AKTQATKCLIYTFB-BQYQJAHWSA-N	0	0	286.334	4.040	20	30		CIEDRN
CCC(=O)CCCSc1ccc(C#N)cc1Cl	ZINC000183891136	329253978	/nfs/dbraw/zinc/25/39/78/329253978.db2.gz	UTONMKOIBQMKJU-UHFFFAOYSA-N	0	0	267.781	4.063	20	30		CIEDRN
CC[C@H](CC#N)NCc1ccc(-c2c(F)cccc2F)o1	ZINC000184094648	329256242	/nfs/dbraw/zinc/25/62/42/329256242.db2.gz	HTFSURQICPBVNC-LLVKDONJSA-N	0	0	290.313	4.007	20	30		CIEDRN
C=CCC[C@H](NC(=O)Nc1ccncc1F)c1ccccc1	ZINC000184225584	329258171	/nfs/dbraw/zinc/25/81/71/329258171.db2.gz	BXFDHWDXPAUOSG-HNNXBMFYSA-N	0	0	299.349	4.050	20	30		CIEDRN
Cc1csc(C(C#N)=C([O-])c2ccc(C(C)C)s2)n1	ZINC000184547902	329259737	/nfs/dbraw/zinc/25/97/37/329259737.db2.gz	IYYDHMJKLGGVGB-JTQLQIEISA-N	0	0	290.413	4.127	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CCSc2c(F)cccc21	ZINC000185076488	329267763	/nfs/dbraw/zinc/26/77/63/329267763.db2.gz	QFDIKRJZOSTRLX-BXUZGUMPSA-N	0	0	293.407	4.081	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H]1CCSc2c(F)cccc21	ZINC000185076523	329267782	/nfs/dbraw/zinc/26/77/82/329267782.db2.gz	QFDIKRJZOSTRLX-RISCZKNCSA-N	0	0	293.407	4.081	20	30		CIEDRN
CC(C)c1c(N[C@H]2CC[C@@H](C#N)C2)cnn1-c1ccccc1	ZINC000582884039	329285126	/nfs/dbraw/zinc/28/51/26/329285126.db2.gz	YMCFSNDZZWXPLY-CABCVRRESA-N	0	0	294.402	4.100	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(Oc2cccnc2)cc1	ZINC000582930547	329286221	/nfs/dbraw/zinc/28/62/21/329286221.db2.gz	NJTJDNFGRSUNHF-SFHVURJKSA-N	0	0	296.370	4.415	20	30		CIEDRN
CCC[C@H](C)[C@@H]1CCCN1c1nccc(C#N)c1Cl	ZINC000582921470	329288982	/nfs/dbraw/zinc/28/89/82/329288982.db2.gz	CJVYUHYWLPSSTB-AAEUAGOBSA-N	0	0	277.799	4.012	20	30		CIEDRN
CC[C@@H](Nc1ccc2c(c1)ncn2C)c1ccc(C#N)cc1	ZINC000584390573	329325254	/nfs/dbraw/zinc/32/52/54/329325254.db2.gz	RTIUOMHYXUVPAH-MRXNPFEDSA-N	0	0	290.370	4.008	20	30		CIEDRN
Cc1coc2ccc(NC(=O)c3cccc(CC#N)c3)cc12	ZINC000185789040	329331752	/nfs/dbraw/zinc/33/17/52/329331752.db2.gz	AMKMUAFMIJGFRF-UHFFFAOYSA-N	0	0	290.322	4.060	20	30		CIEDRN
C=C(C)CCN[C@H](c1cccc(F)c1F)C(F)(F)F	ZINC000508981160	332853598	/nfs/dbraw/zinc/85/35/98/332853598.db2.gz	ZXABQNODRKXTLN-GFCCVEGCSA-N	0	0	279.252	4.124	20	30		CIEDRN
C=CCCC(=O)Nc1cccnc1-c1ccc(C)s1	ZINC000187053845	329351796	/nfs/dbraw/zinc/35/17/96/329351796.db2.gz	NVLLLDLIPYUPOI-UHFFFAOYSA-N	0	0	272.373	4.023	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H](C)c2cc(C)sc2C)CCC1	ZINC000188405068	329368612	/nfs/dbraw/zinc/36/86/12/329368612.db2.gz	DJEUHWOSNWNXIS-LBPRGKRZSA-N	0	0	277.433	4.289	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1cccc(C2CC2)n1)c1ccccc1	ZINC000498111963	329368707	/nfs/dbraw/zinc/36/87/07/329368707.db2.gz	ORCCPVCGBHZKOM-CQSZACIVSA-N	0	0	292.382	4.257	20	30		CIEDRN
N#CCCCCSC[C@@H]1CCC2(CCCCC2)O1	ZINC000188751987	329372853	/nfs/dbraw/zinc/37/28/53/329372853.db2.gz	GCHZMQPKJKKLPB-AWEZNQCLSA-N	0	0	267.438	4.295	20	30		CIEDRN
C=CCC1(C(=O)Nc2cccc(F)c2C)CCCC1	ZINC000450057655	329384985	/nfs/dbraw/zinc/38/49/85/329384985.db2.gz	AABRWBIYDMBUPL-UHFFFAOYSA-N	0	0	261.340	4.209	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1cncc(C)c1	ZINC000189895293	329388615	/nfs/dbraw/zinc/38/86/15/329388615.db2.gz	AROJJOHXAXSVSY-UHFFFAOYSA-N	0	0	294.398	4.494	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1oc(C)nc1C	ZINC000189912044	329390324	/nfs/dbraw/zinc/39/03/24/329390324.db2.gz	HJECETQCKLWBSA-UHFFFAOYSA-N	0	0	298.386	4.396	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc3cnn(C(C)C)c3c2)CCC1	ZINC000190896249	329401735	/nfs/dbraw/zinc/40/17/35/329401735.db2.gz	UZNWPOJMDDZWKD-UHFFFAOYSA-N	0	0	297.402	4.302	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccco1	ZINC000191468932	329414899	/nfs/dbraw/zinc/41/48/99/329414899.db2.gz	CNWOIEVWWZDTAE-UHFFFAOYSA-N	0	0	298.386	4.453	20	30		CIEDRN
C=CCC1(C(=O)N(C)c2ccccc2SC)CCC1	ZINC000191916779	329422320	/nfs/dbraw/zinc/42/23/20/329422320.db2.gz	UIHMWZUJORADAX-UHFFFAOYSA-N	0	0	275.417	4.118	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1cc2cccc(C)c2s1	ZINC000583284931	329432580	/nfs/dbraw/zinc/43/25/80/329432580.db2.gz	ZZEZSDFEISKILN-UHFFFAOYSA-N	0	0	273.401	4.248	20	30		CIEDRN
N#CCc1ccc(CSc2ncccc2Cl)cc1	ZINC000399000581	329447457	/nfs/dbraw/zinc/44/74/57/329447457.db2.gz	BXXGYXANUSKAQS-UHFFFAOYSA-N	0	0	274.776	4.093	20	30		CIEDRN
N#CCc1ccc(CNc2cc(Cl)ccc2F)cc1	ZINC000399115719	329448552	/nfs/dbraw/zinc/44/85/52/329448552.db2.gz	MMFDNMQFAAOPTR-UHFFFAOYSA-N	0	0	274.726	4.157	20	30		CIEDRN
N#CCc1ccc(CSc2nc3ccccc3o2)cc1	ZINC000399170375	329449134	/nfs/dbraw/zinc/44/91/34/329449134.db2.gz	GGZABFIZNKSFBJ-UHFFFAOYSA-N	0	0	280.352	4.186	20	30		CIEDRN
N#Cc1cnccc1Oc1ccc(Cc2ccccc2)cc1	ZINC000399400764	329452546	/nfs/dbraw/zinc/45/25/46/329452546.db2.gz	AMGKZHYREBJCHU-UHFFFAOYSA-N	0	0	286.334	4.336	20	30		CIEDRN
Cc1cc(CN2CCCC(C)(C)[C@@H]2C#N)cc2cccnc12	ZINC000583851554	329489134	/nfs/dbraw/zinc/48/91/34/329489134.db2.gz	MMMHOWDIROLFBQ-KRWDZBQOSA-N	0	0	293.414	4.057	20	30		CIEDRN
C/C=C/c1ccc(NCCOc2ccc(C#N)cc2)cc1	ZINC000584494312	329501992	/nfs/dbraw/zinc/50/19/92/329501992.db2.gz	FJYDTTYGJKLKNJ-NSCUHMNNSA-N	0	0	278.355	4.082	20	30		CIEDRN
C=CCN(CC=C)C(=O)c1ccccc1Cc1ccccc1	ZINC000301944532	332863119	/nfs/dbraw/zinc/86/31/19/332863119.db2.gz	HYQSGZIGQFUHEK-UHFFFAOYSA-N	0	0	291.394	4.092	20	30		CIEDRN
C=CCC[C@@H](Nc1cccc(C#N)n1)c1ccccc1	ZINC000532933564	329546867	/nfs/dbraw/zinc/54/68/67/329546867.db2.gz	AZBNLGNTQHHUMT-MRXNPFEDSA-N	0	0	263.344	4.073	20	30		CIEDRN
CC1(C)CC[C@@H](Nc2cccc(OCCCC#N)c2)C1	ZINC000149882481	329547104	/nfs/dbraw/zinc/54/71/04/329547104.db2.gz	ZJOWZNVNLXUTSH-OAHLLOKOSA-N	0	0	272.392	4.360	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1ccc(C)cc1SC	ZINC000425607146	329556441	/nfs/dbraw/zinc/55/64/41/329556441.db2.gz	NKNXXQWAXGNSNW-UHFFFAOYSA-N	0	0	263.406	4.258	20	30		CIEDRN
C=CCCOCCCCC(=O)Nc1ccccc1C(F)F	ZINC000425078540	329582231	/nfs/dbraw/zinc/58/22/31/329582231.db2.gz	WSKHICASLMEPRA-UHFFFAOYSA-N	0	0	297.345	4.326	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(Cl)cc1COC	ZINC000425117426	329597148	/nfs/dbraw/zinc/59/71/48/329597148.db2.gz	WCWIPGYGGKGTSV-LLVKDONJSA-N	0	0	281.783	4.027	20	30		CIEDRN
C[C@H](c1cccc(C#N)c1)N(C)C(=O)[C@@H]1CC12CCCCC2	ZINC000425119905	329597598	/nfs/dbraw/zinc/59/75/98/329597598.db2.gz	AJBMOBJXPIIBBZ-PBHICJAKSA-N	0	0	296.414	4.048	20	30		CIEDRN
C[C@H](c1cccc(C#N)c1)N(C)C(=O)C[C@@H]1CCC[C@@H](C)C1	ZINC000425132342	329604219	/nfs/dbraw/zinc/60/42/19/329604219.db2.gz	QYPJUMNTTWQXLY-BZUAXINKSA-N	0	0	298.430	4.294	20	30		CIEDRN
CC[C@@H](CC(=O)N(C)[C@@H](C)c1cccc(C#N)c1)C(C)C	ZINC000425127958	329605861	/nfs/dbraw/zinc/60/58/61/329605861.db2.gz	JMCJJSYWPRQHQA-HOCLYGCPSA-N	0	0	286.419	4.150	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@H]1CC[C@H](c2cccc(F)c2)C1	ZINC000424814959	329615540	/nfs/dbraw/zinc/61/55/40/329615540.db2.gz	VHZSDTWVHDTAQY-HOCLYGCPSA-N	0	0	289.394	4.180	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@H]1CC[C@H](c2ccc(F)cc2)C1	ZINC000424807023	329616651	/nfs/dbraw/zinc/61/66/51/329616651.db2.gz	DVBVNXURYAQQRH-HOCLYGCPSA-N	0	0	289.394	4.180	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](c2ccccc2)C[C@H]1C	ZINC000424824403	329622091	/nfs/dbraw/zinc/62/20/91/329622091.db2.gz	CEUVPDFIWJKIPJ-NVXWUHKLSA-N	0	0	285.431	4.383	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@H](C)c1ccccc1SC	ZINC000424827072	329622486	/nfs/dbraw/zinc/62/24/86/329622486.db2.gz	QIGPQHKCSXNKDI-GFCCVEGCSA-N	0	0	277.433	4.188	20	30		CIEDRN
CC[C@@H](Nc1ncc2c(c1C#N)CCC2)c1cccs1	ZINC000425226211	329643555	/nfs/dbraw/zinc/64/35/55/329643555.db2.gz	HJNMNOWPDXBMPD-CQSZACIVSA-N	0	0	283.400	4.067	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1ccccc1C(F)F	ZINC000425699655	329648069	/nfs/dbraw/zinc/64/80/69/329648069.db2.gz	JBAIXUWPHDHLRV-LLVKDONJSA-N	0	0	282.334	4.491	20	30		CIEDRN
Cc1nsc(SCc2cc(C)cc(C)c2)c1C#N	ZINC000564050957	329661529	/nfs/dbraw/zinc/66/15/29/329661529.db2.gz	QOIZVCXYZDPBNC-UHFFFAOYSA-N	0	0	274.414	4.232	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(-c2ccc(F)c(C)c2)no1	ZINC000525954757	329682716	/nfs/dbraw/zinc/68/27/16/329682716.db2.gz	LRQIFPCICXONEC-HNNXBMFYSA-N	0	0	260.312	4.038	20	30		CIEDRN
N#CCN(C(=O)[C@@H]1CCC[C@H]2CCCC[C@H]21)c1ccccc1	ZINC000514686554	329684407	/nfs/dbraw/zinc/68/44/07/329684407.db2.gz	AKGNQDJCCBKUAH-KBAYOESNSA-N	0	0	296.414	4.150	20	30		CIEDRN
CC(C)Oc1cccc(CSCC2(C#N)CCC2)c1	ZINC000419391979	329722179	/nfs/dbraw/zinc/72/21/79/329722179.db2.gz	NUELFUJLWIRALL-UHFFFAOYSA-N	0	0	275.417	4.401	20	30		CIEDRN
C=C(C)CS[C@H](C)c1nnc(-c2ccc(C)cc2)o1	ZINC000419414881	329725087	/nfs/dbraw/zinc/72/50/87/329725087.db2.gz	HHRGFJSDFYXXOL-GFCCVEGCSA-N	0	0	274.389	4.415	20	30		CIEDRN
N#Cc1cnc(CS[C@@H]2CCCCc3ccccc32)nc1	ZINC000419416193	329725115	/nfs/dbraw/zinc/72/51/15/329725115.db2.gz	IPJLNMRIABDODX-MRXNPFEDSA-N	0	0	295.411	4.049	20	30		CIEDRN
N#CC1(CSCc2cccc(F)c2Cl)CCC1	ZINC000419437956	329729067	/nfs/dbraw/zinc/72/90/67/329729067.db2.gz	GSISHZHVIGXVGS-UHFFFAOYSA-N	0	0	269.772	4.406	20	30		CIEDRN
N#CC1(CCSCC[C@H]2CCCO2)CCCCC1	ZINC000419461092	329731595	/nfs/dbraw/zinc/73/15/95/329731595.db2.gz	HCSBVIVRYPUKAT-CQSZACIVSA-N	0	0	267.438	4.153	20	30		CIEDRN
C[C@H](SCCC1CCOCC1)c1cccc(C#N)c1	ZINC000419464259	329732136	/nfs/dbraw/zinc/73/21/36/329732136.db2.gz	NBMGHXVIFWVLQH-ZDUSSCGKSA-N	0	0	275.417	4.169	20	30		CIEDRN
C=C(C)CCSCc1cnc2c(cnn2C(C)C)c1	ZINC000419472687	329735201	/nfs/dbraw/zinc/73/52/01/329735201.db2.gz	IGDYPAWXJDHRIP-UHFFFAOYSA-N	0	0	275.421	4.212	20	30		CIEDRN
N#Cc1cc(Cl)ccc1CSCCC1CCOCC1	ZINC000419480584	329736128	/nfs/dbraw/zinc/73/61/28/329736128.db2.gz	QFJILMIVRLCDTJ-UHFFFAOYSA-N	0	0	295.835	4.262	20	30		CIEDRN
CC[C@@H](CSCCC1(C#N)CCCCC1)OC	ZINC000419621103	329740210	/nfs/dbraw/zinc/74/02/10/329740210.db2.gz	FNUIZVSWFLXFBE-ZDUSSCGKSA-N	0	0	255.427	4.009	20	30		CIEDRN
N#CCCCSCc1ccc(-c2ncco2)cc1F	ZINC000419626518	329740657	/nfs/dbraw/zinc/74/06/57/329740657.db2.gz	XFMFSEJQEAADRJ-UHFFFAOYSA-N	0	0	276.336	4.018	20	30		CIEDRN
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)SCC1(C#N)CCC1	ZINC000419579530	329741069	/nfs/dbraw/zinc/74/10/69/329741069.db2.gz	JZNREAHWLBHDDL-GFCCVEGCSA-N	0	0	290.388	4.391	20	30		CIEDRN
N#CC1(CSCCOC2CCCCCC2)CCC1	ZINC000419585332	329741611	/nfs/dbraw/zinc/74/16/11/329741611.db2.gz	QAQTURIPKDSWCL-UHFFFAOYSA-N	0	0	267.438	4.153	20	30		CIEDRN
Cc1c(C#N)cccc1C(=O)N1CC[C@@H](C)c2ccccc21	ZINC000509622302	332875514	/nfs/dbraw/zinc/87/55/14/332875514.db2.gz	CMFPSPUEXBRVFV-CYBMUJFWSA-N	0	0	290.366	4.021	20	30		CIEDRN
N#CC1(c2nc(-c3ccsc3Cl)no2)CCCCC1	ZINC000420499181	329769993	/nfs/dbraw/zinc/76/99/93/329769993.db2.gz	AFEYSNZDVKSADR-UHFFFAOYSA-N	0	0	293.779	4.177	20	30		CIEDRN
C=C(C)CCc1noc([C@@]2(C)C[C@@H]2c2ccccc2)n1	ZINC000420506216	329771910	/nfs/dbraw/zinc/77/19/10/329771910.db2.gz	ROTJEADIZHHDNB-PBHICJAKSA-N	0	0	268.360	4.024	20	30		CIEDRN
CCc1ccc(C(=O)[C@H](C)Sc2ccc(C#N)cc2)cc1	ZINC000509679315	332878625	/nfs/dbraw/zinc/87/86/25/332878625.db2.gz	HTERPABAMLPZLS-ZDUSSCGKSA-N	0	0	295.407	4.484	20	30		CIEDRN
CCn1c2ccc(C#N)cc2nc1-c1cccc(Cl)c1	ZINC000086635852	332875474	/nfs/dbraw/zinc/87/54/74/332875474.db2.gz	PJGPGULVKVBPSC-UHFFFAOYSA-N	0	0	281.746	4.248	20	30		CIEDRN
N#Cc1cc(F)ccc1COc1cc(F)ccc1Cl	ZINC000509801225	332881940	/nfs/dbraw/zinc/88/19/40/332881940.db2.gz	DPHNKDIOBJDDHG-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@H](C)c1ccccc1OC(C)C	ZINC000525960264	329887510	/nfs/dbraw/zinc/88/75/10/329887510.db2.gz	RPIJBWQFKSYUQB-KDOFPFPSSA-N	0	0	289.419	4.253	20	30		CIEDRN
C=CCOCCCc1nc(-c2ccc3ccccc3c2)no1	ZINC000571841683	329924326	/nfs/dbraw/zinc/92/43/26/329924326.db2.gz	XJNLLGODWGKLQI-UHFFFAOYSA-N	0	0	294.354	4.025	20	30		CIEDRN
Cc1nc(CSCCC2(C#N)CCCCC2)co1	ZINC000571938205	329932042	/nfs/dbraw/zinc/93/20/42/329932042.db2.gz	BXXBJKGNUWEKQY-UHFFFAOYSA-N	0	0	264.394	4.080	20	30		CIEDRN
C=CCN(C)C(=O)c1ccccc1Sc1ccccc1	ZINC000161627933	329947966	/nfs/dbraw/zinc/94/79/66/329947966.db2.gz	GFSMSYQDVCBFHQ-UHFFFAOYSA-N	0	0	283.396	4.096	20	30		CIEDRN
CC(C)[C@@H]1CCC[C@@H](NC(=O)Nc2ccc(CC#N)cc2)C1	ZINC000510018154	332888379	/nfs/dbraw/zinc/88/83/79/332888379.db2.gz	HBFPLJMJAWIFIB-NVXWUHKLSA-N	0	0	299.418	4.089	20	30		CIEDRN
CC(C)CCc1noc(CSCCCC(C)(C)C#N)n1	ZINC000161650578	329950152	/nfs/dbraw/zinc/95/01/52/329950152.db2.gz	PZQPOVGUBRRDGF-UHFFFAOYSA-N	0	0	295.452	4.221	20	30		CIEDRN
CC(C)(C)c1cnc(S[C@@H](C#N)c2ccccc2)o1	ZINC000572179871	329952494	/nfs/dbraw/zinc/95/24/94/329952494.db2.gz	GUBXBWQGFWCUPK-LBPRGKRZSA-N	0	0	272.373	4.329	20	30		CIEDRN
C=CCN(C(=O)C1CCC(c2ccccc2)CC1)C1CC1	ZINC000536821930	329968436	/nfs/dbraw/zinc/96/84/36/329968436.db2.gz	OKKUDDQAAPFVDO-UHFFFAOYSA-N	0	0	283.415	4.137	20	30		CIEDRN
C=CCCC1(c2nc(-c3cncc4ccccc43)no2)CC1	ZINC000572323006	329974543	/nfs/dbraw/zinc/97/45/43/329974543.db2.gz	TXQOVYUKLGRSKP-UHFFFAOYSA-N	0	0	291.354	4.283	20	30		CIEDRN
Cc1c(F)ccc(Cl)c1NCc1ccc(C#N)cc1F	ZINC000432707612	330004913	/nfs/dbraw/zinc/00/49/13/330004913.db2.gz	NRRITCKAAYLCHY-UHFFFAOYSA-N	0	0	292.716	4.410	20	30		CIEDRN
C=CCCC(=O)N(C)[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000263647004	330060071	/nfs/dbraw/zinc/06/00/71/330060071.db2.gz	FQHBQDHVCAUKFI-LLVKDONJSA-N	0	0	285.309	4.191	20	30		CIEDRN
C=CCCCCCN(C)C(=O)N[C@H](C)c1ccc(C#N)cc1	ZINC000265730788	330063299	/nfs/dbraw/zinc/06/32/99/330063299.db2.gz	AYJBFVQMLIOAOL-OAHLLOKOSA-N	0	0	299.418	4.007	20	30		CIEDRN
C=CCCCC(=O)N1CC[C@H](c2ccc(Cl)cc2)C1	ZINC000267179234	330064605	/nfs/dbraw/zinc/06/46/05/330064605.db2.gz	NKTVIUVENMIRKE-AWEZNQCLSA-N	0	0	277.795	4.012	20	30		CIEDRN
N#Cc1ccc(CN(Cc2ccco2)Cc2ccco2)s1	ZINC000162571223	330071709	/nfs/dbraw/zinc/07/17/09/330071709.db2.gz	DRFZQQRZXYMHKL-UHFFFAOYSA-N	0	0	298.367	4.008	20	30		CIEDRN
C=C(C)[C@H](CC(=O)Nc1c(CC)cccc1CC)OCC	ZINC000270020504	330073142	/nfs/dbraw/zinc/07/31/42/330073142.db2.gz	FEBAGKUKFZBLSC-INIZCTEOSA-N	0	0	289.419	4.121	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1sc(C)nc1C)c1ccccc1	ZINC000270396943	330074983	/nfs/dbraw/zinc/07/49/83/330074983.db2.gz	UKPFIUDACOEWCD-CYBMUJFWSA-N	0	0	286.400	4.058	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)Nc1cc(C)ccc1C	ZINC000272239102	330085006	/nfs/dbraw/zinc/08/50/06/330085006.db2.gz	GFRUNPYJZQCOJY-UHFFFAOYSA-N	0	0	298.386	4.159	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CC2(C1)CCCCC2)c1ccccc1	ZINC000273771493	330097612	/nfs/dbraw/zinc/09/76/12/330097612.db2.gz	QVUJDHBHQHEIGQ-INIZCTEOSA-N	0	0	283.415	4.139	20	30		CIEDRN
C=CCC(CC=C)c1nc([C@@H]2CCCCS2)no1	ZINC000274033973	330103035	/nfs/dbraw/zinc/10/30/35/330103035.db2.gz	OMGXXFVCUDSCBI-LBPRGKRZSA-N	0	0	264.394	4.264	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCCCC[C@H]1c1cccn1C	ZINC000274297102	330104046	/nfs/dbraw/zinc/10/40/46/330104046.db2.gz	RJMCGLVZMLWYMN-WBVHZDCISA-N	0	0	288.435	4.071	20	30		CIEDRN
C=C(C)[C@H](N[C@H](C)c1cncs1)c1ccc(F)c(F)c1	ZINC000274758158	330107479	/nfs/dbraw/zinc/10/74/79/330107479.db2.gz	JLAONUNAUVYPGY-BMIGLBTASA-N	0	0	294.370	4.389	20	30		CIEDRN
C=C(C)[C@@H](NCc1occc1C)c1ccc(F)c(F)c1	ZINC000274855021	330108137	/nfs/dbraw/zinc/10/81/37/330108137.db2.gz	YPGQRFSRGAOPGC-MRXNPFEDSA-N	0	0	277.314	4.273	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1ccc(OC2CCCC2)cc1	ZINC000276258184	330112818	/nfs/dbraw/zinc/11/28/18/330112818.db2.gz	FITKLFRDZGEIOA-UHFFFAOYSA-N	0	0	288.391	4.048	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000276357631	330113280	/nfs/dbraw/zinc/11/32/80/330113280.db2.gz	VJAYGFMUNHFYIL-UHFFFAOYSA-N	0	0	273.163	4.033	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)NCC(=C)C	ZINC000276439592	330113497	/nfs/dbraw/zinc/11/34/97/330113497.db2.gz	RBEACJRMAODIAM-UHFFFAOYSA-N	0	0	272.392	4.236	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](C)C1	ZINC000276446724	330113659	/nfs/dbraw/zinc/11/36/59/330113659.db2.gz	SMSSFCOGVNTPOE-AWEZNQCLSA-N	0	0	286.419	4.412	20	30		CIEDRN
C=CCC[C@@H]([NH2+][C@H](CCCO)c1ccccc1)c1ccco1	ZINC000276443855	330113649	/nfs/dbraw/zinc/11/36/49/330113649.db2.gz	KSMAUJPXXMNHOA-QZTJIDSGSA-N	0	0	299.414	4.390	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)Cc1scnc1C	ZINC000162791359	330115053	/nfs/dbraw/zinc/11/50/53/330115053.db2.gz	WOTTWIHKASUCRF-UHFFFAOYSA-N	0	0	298.864	4.355	20	30		CIEDRN
C#CCCCC(=O)N(C)[C@@H](C)c1ccc(Cl)c(Cl)c1	ZINC000277004250	330115360	/nfs/dbraw/zinc/11/53/60/330115360.db2.gz	KISWJFUKLDIKCB-NSHDSACASA-N	0	0	298.213	4.316	20	30		CIEDRN
C=CCCCC(=O)Oc1ccc(-c2c(C)noc2C)cc1	ZINC000277245387	330115685	/nfs/dbraw/zinc/11/56/85/330115685.db2.gz	PTIAQGBVFNLEHL-UHFFFAOYSA-N	0	0	285.343	4.220	20	30		CIEDRN
C=CCC[C@H](Nc1nnc(C2CC2)o1)c1ccccc1	ZINC000278456642	330116853	/nfs/dbraw/zinc/11/68/53/330116853.db2.gz	SIMGBVHRSYCJDY-AWEZNQCLSA-N	0	0	269.348	4.066	20	30		CIEDRN
Cc1cc(SCC2CC(F)(F)C2)ccc1C#N	ZINC000574988982	330124701	/nfs/dbraw/zinc/12/47/01/330124701.db2.gz	YQLARWBGSQNBDE-UHFFFAOYSA-N	0	0	253.317	4.004	20	30		CIEDRN
Cc1[nH]c2ccccc2c1C(=O)CSCC1(C#N)CCC1	ZINC000580421525	330128957	/nfs/dbraw/zinc/12/89/57/330128957.db2.gz	VJVZYGKWINKSIM-UHFFFAOYSA-N	0	0	298.411	4.086	20	30		CIEDRN
C=CCN(CCC#N)CC(c1ccccc1)c1ccccc1	ZINC000580423708	330129658	/nfs/dbraw/zinc/12/96/58/330129658.db2.gz	LNEYHWCKSRWMJF-UHFFFAOYSA-N	0	0	290.410	4.220	20	30		CIEDRN
C=CCCC1(C(=O)N2CC[C@@H](C(C)(C)C)C[C@@H]2C)CC1	ZINC000580458951	330141312	/nfs/dbraw/zinc/14/13/12/330141312.db2.gz	RMFZLVYHZRUIQQ-LSDHHAIUSA-N	0	0	277.452	4.406	20	30		CIEDRN
COc1ccc(/C=C/c2ccc(C#N)cn2)c2ccccc12	ZINC000510314015	332899963	/nfs/dbraw/zinc/89/99/63/332899963.db2.gz	QSFOZVQLZNETII-JXMROGBWSA-N	0	0	286.334	4.285	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)NCCc1ccc(C(C)C)cc1	ZINC000527194961	330233216	/nfs/dbraw/zinc/23/32/16/330233216.db2.gz	GSNLKDHKFGCJND-SFHVURJKSA-N	0	0	273.420	4.071	20	30		CIEDRN
C[C@H](NCc1c(F)cccc1Cl)c1ccc(C#N)cc1	ZINC000035256327	330244457	/nfs/dbraw/zinc/24/44/57/330244457.db2.gz	AABXOYJCIAXYTI-NSHDSACASA-N	0	0	288.753	4.202	20	30		CIEDRN
CO[C@@H](CSCCC1(C#N)CCCCC1)C1CC1	ZINC000424154599	330302000	/nfs/dbraw/zinc/30/20/00/330302000.db2.gz	OMDCBSMXGYSCDE-AWEZNQCLSA-N	0	0	267.438	4.009	20	30		CIEDRN
C=C(C)CCSCc1ccc(-c2ccccn2)nc1	ZINC000424128615	330259894	/nfs/dbraw/zinc/25/98/94/330259894.db2.gz	WQNOWUWINLCNKA-UHFFFAOYSA-N	0	0	270.401	4.343	20	30		CIEDRN
CC(C)(C#N)c1ccc(-c2ccc3c(c2)CCOC3)cc1	ZINC000527590164	330264842	/nfs/dbraw/zinc/26/48/42/330264842.db2.gz	PJHOYRTXFCXLBG-UHFFFAOYSA-N	0	0	277.367	4.227	20	30		CIEDRN
CCC(F)(F)C(C)(C)CNc1ccc(CC#N)cc1	ZINC000527642944	330268801	/nfs/dbraw/zinc/26/88/01/330268801.db2.gz	AHINNWBIIXXIGT-UHFFFAOYSA-N	0	0	266.335	4.236	20	30		CIEDRN
N#Cc1ccc(NCCc2ccccc2)cc1C(F)(F)F	ZINC000036805567	330275536	/nfs/dbraw/zinc/27/55/36/330275536.db2.gz	PVPKKZWMLPZQGN-UHFFFAOYSA-N	0	0	290.288	4.232	20	30		CIEDRN
CCC(C#N)(CC)C(=O)Nc1ccc(-c2nccs2)cc1	ZINC000527748700	330280824	/nfs/dbraw/zinc/28/08/24/330280824.db2.gz	RGAKEWRAHXEACS-UHFFFAOYSA-N	0	0	299.399	4.079	20	30		CIEDRN
CCN(Cc1ccc(Cl)s1)C(=O)C(C#N)(CC)CC	ZINC000527779316	330282976	/nfs/dbraw/zinc/28/29/76/330282976.db2.gz	GBJOUGQJVFACRV-UHFFFAOYSA-N	0	0	298.839	4.080	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)[C@@H]1C[C@H]1c1ccsc1	ZINC000527906457	330290213	/nfs/dbraw/zinc/29/02/13/330290213.db2.gz	XZMNNRBEQGGZID-DLBZAZTESA-N	0	0	297.423	4.066	20	30		CIEDRN
CC[C@@H](Nc1cccc2c1OCC2)c1ccc(C#N)cc1	ZINC000527957352	330294813	/nfs/dbraw/zinc/29/48/13/330294813.db2.gz	ALCXSHNWGQHUCQ-MRXNPFEDSA-N	0	0	278.355	4.056	20	30		CIEDRN
CCCOc1ccc(-c2noc(C(C#N)(CC)CC)n2)cc1	ZINC000528103938	330308083	/nfs/dbraw/zinc/30/80/83/330308083.db2.gz	MUECEYPTVSWENS-UHFFFAOYSA-N	0	0	299.374	4.107	20	30		CIEDRN
CCCOc1ccc(NC(=O)C(C#N)(CC)CC)c(C)c1	ZINC000528113014	330308452	/nfs/dbraw/zinc/30/84/52/330308452.db2.gz	HCWCFBYTASBPGG-UHFFFAOYSA-N	0	0	288.391	4.052	20	30		CIEDRN
CCC(C#N)(CC)c1nc(-c2cc(Cl)ccc2C)no1	ZINC000528135289	330308968	/nfs/dbraw/zinc/30/89/68/330308968.db2.gz	IVFGXDPKLIXXQM-UHFFFAOYSA-N	0	0	289.766	4.280	20	30		CIEDRN
CCCCOc1cccc(NC(=O)C(C#N)(CC)CC)c1	ZINC000528142259	330309522	/nfs/dbraw/zinc/30/95/22/330309522.db2.gz	QPICQJVJHFIBEO-UHFFFAOYSA-N	0	0	288.391	4.134	20	30		CIEDRN
CCC(C#N)(CC)c1nc([C@H](C)c2ccccc2C)no1	ZINC000528145209	330309612	/nfs/dbraw/zinc/30/96/12/330309612.db2.gz	ABKZWYFTDKRROQ-CYBMUJFWSA-N	0	0	283.375	4.111	20	30		CIEDRN
C=CC(C)(C)c1nc(-c2ccccc2OC2CCC2)no1	ZINC000528258546	330317658	/nfs/dbraw/zinc/31/76/58/330317658.db2.gz	CAUYJMJTKIYTTJ-UHFFFAOYSA-N	0	0	284.359	4.132	20	30		CIEDRN
C=CC[C@H](C)NC(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1	ZINC000116851489	330321715	/nfs/dbraw/zinc/32/17/15/330321715.db2.gz	AVBKUGDVPZORHX-MORSLUCNSA-N	0	0	279.383	4.024	20	30		CIEDRN
CCN(Cc1ncccc1Cl)[C@@H](C)c1ccc(C#N)cc1	ZINC000528360355	330322141	/nfs/dbraw/zinc/32/21/41/330322141.db2.gz	XALRUHIKLMMGTJ-ZDUSSCGKSA-N	0	0	299.805	4.190	20	30		CIEDRN
C=CC[C@H](C)NC(=O)c1oc2c(cccc2Cl)c1C	ZINC000116858137	330323382	/nfs/dbraw/zinc/32/33/82/330323382.db2.gz	FFDDZTMMSNYLHS-VIFPVBQESA-N	0	0	277.751	4.089	20	30		CIEDRN
C=CCCc1ccccc1NCc1cncn1C(C)C	ZINC000424195010	330324521	/nfs/dbraw/zinc/32/45/21/330324521.db2.gz	SNXRRRFDYUQVEQ-UHFFFAOYSA-N	0	0	269.392	4.195	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)C[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000116862287	330325318	/nfs/dbraw/zinc/32/53/18/330325318.db2.gz	UJDFHZBSBQMPFZ-VXGBXAGGSA-N	0	0	299.336	4.280	20	30		CIEDRN
Cc1cc(C)c(C#N)c(N[C@H](C)CCc2ccccc2)n1	ZINC000044289518	330327237	/nfs/dbraw/zinc/32/72/37/330327237.db2.gz	KRUKPPFSVHXLGF-CQSZACIVSA-N	0	0	279.387	4.003	20	30		CIEDRN
CCC(C#N)(CC)C(=O)Nc1ccc(C(C)C)cc1	ZINC000044764811	330332877	/nfs/dbraw/zinc/33/28/77/330332877.db2.gz	HZVTVPPVLGZQDH-UHFFFAOYSA-N	0	0	258.365	4.078	20	30		CIEDRN
C[C@@H](Sc1ccc(C#N)cn1)c1ccccc1Cl	ZINC000045110445	330338733	/nfs/dbraw/zinc/33/87/33/330338733.db2.gz	HJVAYVXFDSIRKN-SNVBAGLBSA-N	0	0	274.776	4.460	20	30		CIEDRN
C=C(C)C(C)(C)c1nc(Cc2c(C)[nH]c3ccccc32)no1	ZINC000424347825	330344947	/nfs/dbraw/zinc/34/49/47/330344947.db2.gz	MBXFJCHQUDIDIY-UHFFFAOYSA-N	0	0	295.386	4.304	20	30		CIEDRN
C=C(C)C(C)(C)c1nc([C@@H](OCC)c2ccccc2)no1	ZINC000424350147	330345196	/nfs/dbraw/zinc/34/51/96/330345196.db2.gz	APQGLERIFIFBQU-AWEZNQCLSA-N	0	0	286.375	4.049	20	30		CIEDRN
C=C(C)C(C)(C)c1nc([C@H](OCC)c2ccccc2)no1	ZINC000424350149	330345259	/nfs/dbraw/zinc/34/52/59/330345259.db2.gz	APQGLERIFIFBQU-CQSZACIVSA-N	0	0	286.375	4.049	20	30		CIEDRN
C=C(C)C(C)(C)c1nc(Cc2c[nH]c3cc(F)ccc23)no1	ZINC000424352469	330345673	/nfs/dbraw/zinc/34/56/73/330345673.db2.gz	YNOUQHUUTRKQLI-UHFFFAOYSA-N	0	0	299.349	4.135	20	30		CIEDRN
CCCC[C@H](Sc1ccc(C#N)cc1Cl)C(=O)OC	ZINC000533177602	330351657	/nfs/dbraw/zinc/35/16/57/330351657.db2.gz	XITUSULROJOQOR-ZDUSSCGKSA-N	0	0	297.807	4.036	20	30		CIEDRN
C=C(C)COc1cccc(NCc2cccc(COC)c2)c1	ZINC000533208867	330352903	/nfs/dbraw/zinc/35/29/03/330352903.db2.gz	WBIRVAOVCGMYKA-UHFFFAOYSA-N	0	0	297.398	4.400	20	30		CIEDRN
CCCC[C@H](CC)C(=O)N[C@](C)(C#N)C1CCCCC1	ZINC000580499475	330354814	/nfs/dbraw/zinc/35/48/14/330354814.db2.gz	ONINQRRFMLDCNV-WMLDXEAASA-N	0	0	278.440	4.182	20	30		CIEDRN
C=C(CC)CSCC(=O)Nc1ccc(F)cc1Cl	ZINC000536881141	330360721	/nfs/dbraw/zinc/36/07/21/330360721.db2.gz	JVPYRXPUAGLCNE-UHFFFAOYSA-N	0	0	287.787	4.117	20	30		CIEDRN
C=CCN(C(=O)C[C@@H](CC)c1ccc(C)cc1)C1CC1	ZINC000536881379	330360848	/nfs/dbraw/zinc/36/08/48/330360848.db2.gz	HHLDXSFFQUZBAA-OAHLLOKOSA-N	0	0	271.404	4.056	20	30		CIEDRN
N#CCN(Cc1cc(Cl)cc(Cl)c1)C1CCCC1	ZINC000538717947	330363155	/nfs/dbraw/zinc/36/31/55/330363155.db2.gz	KMUFUZJMKIUWLR-UHFFFAOYSA-N	0	0	283.202	4.262	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1ccc(Cl)cc1F	ZINC000424519964	330364039	/nfs/dbraw/zinc/36/40/39/330364039.db2.gz	BICPBFBDJDEDRB-UHFFFAOYSA-N	0	0	255.720	4.020	20	30		CIEDRN
C=CCn1c(SCC(=C)CC)nnc1-c1ccoc1C	ZINC000536899523	330364462	/nfs/dbraw/zinc/36/44/62/330364462.db2.gz	DZMJMVFCHBCSIE-UHFFFAOYSA-N	0	0	289.404	4.091	20	30		CIEDRN
CCCC(=O)Nc1ccc(Oc2ccccc2C#N)cc1	ZINC000055428116	330365456	/nfs/dbraw/zinc/36/54/56/330365456.db2.gz	SJEYCAZIDFKOIH-UHFFFAOYSA-N	0	0	280.327	4.089	20	30		CIEDRN
C=CCCCSCC(=O)Nc1cc(Cl)ccc1F	ZINC000117944756	330366651	/nfs/dbraw/zinc/36/66/51/330366651.db2.gz	NCSCNEBOQZFMKS-UHFFFAOYSA-N	0	0	287.787	4.117	20	30		CIEDRN
Cc1ccc(S[C@H](C)c2ccc(C#N)cc2)nc1	ZINC000118175727	330366784	/nfs/dbraw/zinc/36/67/84/330366784.db2.gz	QRGZTWDZWCGVSF-GFCCVEGCSA-N	0	0	254.358	4.115	20	30		CIEDRN
C=CCCC(=O)N[C@@H](c1ccc(F)cc1F)C(C)(C)C	ZINC000119134840	330371251	/nfs/dbraw/zinc/37/12/51/330371251.db2.gz	VJIQWPGPCKQFPF-HNNXBMFYSA-N	0	0	281.346	4.134	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@H](C)c1ccccc1Cl	ZINC000424541391	330371555	/nfs/dbraw/zinc/37/15/55/330371555.db2.gz	KCRPTPRYIOLFPV-LLVKDONJSA-N	0	0	265.784	4.120	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1ccc(-c2nccs2)cc1	ZINC000424553757	330374611	/nfs/dbraw/zinc/37/46/11/330374611.db2.gz	CZMYVCSVNYJSNA-UHFFFAOYSA-N	0	0	286.400	4.351	20	30		CIEDRN
CC(C)(C#N)CCN(Cc1cccs1)CC(F)(F)F	ZINC000119705349	330378958	/nfs/dbraw/zinc/37/89/58/330378958.db2.gz	SSNVEWVIUDMBSU-UHFFFAOYSA-N	0	0	290.354	4.052	20	30		CIEDRN
C=CCCCCCNc1ccc2cc[nH]c(=O)c2c1	ZINC000424568353	330380236	/nfs/dbraw/zinc/38/02/36/330380236.db2.gz	BQEQEVIQZXXANA-UHFFFAOYSA-N	0	0	256.349	4.099	20	30		CIEDRN
CC[C@@H]1CCC[C@H]1NC(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000119921921	330380365	/nfs/dbraw/zinc/38/03/65/330380365.db2.gz	DYDFCJAZSXBEHX-CZUORRHYSA-N	0	0	299.418	4.188	20	30		CIEDRN
C=C[C@@H](CC(=O)N[C@@H](CC)CCC)c1ccccc1	ZINC000119860544	330380474	/nfs/dbraw/zinc/38/04/74/330380474.db2.gz	CCQUHXHTKKUHRS-HOCLYGCPSA-N	0	0	259.393	4.041	20	30		CIEDRN
COc1cccc(CSCc2cccc(C#N)c2F)c1	ZINC000537046456	330394309	/nfs/dbraw/zinc/39/43/09/330394309.db2.gz	MCEDCXLTFBSZNO-UHFFFAOYSA-N	0	0	287.359	4.139	20	30		CIEDRN
C=CCCC[C@H](C)Sc1nnc(-c2ccoc2C)n1C	ZINC000537074068	330396933	/nfs/dbraw/zinc/39/69/33/330396933.db2.gz	URRINXVPDXHQQU-NSHDSACASA-N	0	0	291.420	4.220	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1cccc2[nH]ccc21)c1ccccc1	ZINC000125341477	330398254	/nfs/dbraw/zinc/39/82/54/330398254.db2.gz	IDAGTOGCLMEUNY-AWEZNQCLSA-N	0	0	290.366	4.466	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@H](C)c1ccccc1)c1ccccc1	ZINC000121403638	330400089	/nfs/dbraw/zinc/40/00/89/330400089.db2.gz	GBVSSCGEAXXJQM-HZPDHXFCSA-N	0	0	279.383	4.224	20	30		CIEDRN
C=CC[C@H](C)NC(=O)C[C@@H](C)c1ccccc1C(F)(F)F	ZINC000121347728	330400718	/nfs/dbraw/zinc/40/07/18/330400718.db2.gz	SVOJOVAREZHLAX-NEPJUHHUSA-N	0	0	299.336	4.280	20	30		CIEDRN
CCCC(CCC)C(=O)Nc1cccc(C#N)c1C	ZINC000510441319	332903654	/nfs/dbraw/zinc/90/36/54/332903654.db2.gz	FZVGGVGCRVFTTF-UHFFFAOYSA-N	0	0	258.365	4.022	20	30		CIEDRN
C=CCN(C(=O)c1ccc2ncccc2c1)c1ccccc1	ZINC000122067827	330411496	/nfs/dbraw/zinc/41/14/96/330411496.db2.gz	ZAFPXETUKRQZPQ-UHFFFAOYSA-N	0	0	288.350	4.068	20	30		CIEDRN
C=CCCOCCCCC(=O)N1CCC[C@@H](C)[C@@H]1CCC	ZINC000537200140	330414558	/nfs/dbraw/zinc/41/45/58/330414558.db2.gz	DWZDLSXURTXPEC-SJORKVTESA-N	0	0	295.467	4.177	20	30		CIEDRN
CC[C@H](C#N)N[C@H](CCc1ccccc1)c1ccccc1	ZINC000122208855	330415827	/nfs/dbraw/zinc/41/58/27/330415827.db2.gz	VUANKSJXOWEHOF-RTBURBONSA-N	0	0	278.399	4.252	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)C(C)(C)Cc1ccccc1	ZINC000537228251	330429508	/nfs/dbraw/zinc/42/95/08/330429508.db2.gz	BYVBWKXDXMRCLM-OAHLLOKOSA-N	0	0	273.420	4.116	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)COc1cccc2ccccc21	ZINC000537240054	330430197	/nfs/dbraw/zinc/43/01/97/330430197.db2.gz	WXPHZLYLWKDLOS-HNNXBMFYSA-N	0	0	297.398	4.080	20	30		CIEDRN
Cc1cccc2c(C(=O)N(CCC#N)CC(C)(C)C)coc21	ZINC000424641340	330439032	/nfs/dbraw/zinc/43/90/32/330439032.db2.gz	BYYXKKKIYXVMBK-UHFFFAOYSA-N	0	0	298.386	4.143	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)NC[C@@H]1CCC[C@@H](C(F)(F)F)C1	ZINC000424708318	330451954	/nfs/dbraw/zinc/45/19/54/330451954.db2.gz	DVQIVQSLYXFRLW-VXGBXAGGSA-N	0	0	291.357	4.074	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCCc2ccc(F)c(F)c21	ZINC000537700882	330455962	/nfs/dbraw/zinc/45/59/62/330455962.db2.gz	HUFVODMCFUINDA-UHFFFAOYSA-N	0	0	291.341	4.012	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N[C@H](c1ccccc1)C1CCC1	ZINC000514249933	330461978	/nfs/dbraw/zinc/46/19/78/330461978.db2.gz	MMVXGLAQVDGIGJ-DLBZAZTESA-N	0	0	286.419	4.182	20	30		CIEDRN
CC(C)O[C@H](CSc1cccnc1C#N)c1ccccc1	ZINC000514873538	330466634	/nfs/dbraw/zinc/46/66/34/330466634.db2.gz	SFQCUCMHEMZBEV-MRXNPFEDSA-N	0	0	298.411	4.212	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@@H](CC)c1ccccc1OC	ZINC000515181651	330472332	/nfs/dbraw/zinc/47/23/32/330472332.db2.gz	STYPJIIJEBWESQ-ZBFHGGJFSA-N	0	0	289.419	4.207	20	30		CIEDRN
CN(C(=O)[C@@H]1CCC[C@@H]2CCCC[C@@H]12)c1ccc(C#N)cc1	ZINC000515327317	330474990	/nfs/dbraw/zinc/47/49/90/330474990.db2.gz	MXQVHWVJHZEDSL-CGTJXYLNSA-N	0	0	296.414	4.128	20	30		CIEDRN
CC(C)C[C@@H]1CCCCCN1C(=O)c1cc(C#N)cs1	ZINC000084113221	330484273	/nfs/dbraw/zinc/48/42/73/330484273.db2.gz	APAWLPIOTXCIEN-AWEZNQCLSA-N	0	0	290.432	4.051	20	30		CIEDRN
C[C@@H]1CCC[C@@H]1Nc1ccc(C#N)cc1C(F)(F)F	ZINC000084219493	330484720	/nfs/dbraw/zinc/48/47/20/330484720.db2.gz	MEOIVEZYNXNBFB-SKDRFNHKSA-N	0	0	268.282	4.178	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(C2Cc3ccccc3C2)no1	ZINC000515914926	330484888	/nfs/dbraw/zinc/48/48/88/330484888.db2.gz	GQKAQLHGSVZECK-GFCCVEGCSA-N	0	0	268.360	4.022	20	30		CIEDRN
C[C@@H]1CC(Nc2nc(C(F)(F)F)ccc2C#N)C[C@@H](C)C1	ZINC000084439159	330485831	/nfs/dbraw/zinc/48/58/31/330485831.db2.gz	BKIMGHCFLFEOBH-UWVGGRQHSA-N	0	0	297.324	4.209	20	30		CIEDRN
CCCN(CC1CCCCC1)C(=O)Nc1ccc(C#N)cc1	ZINC000516077340	330486760	/nfs/dbraw/zinc/48/67/60/330486760.db2.gz	HSNGHKBYKRRBEK-UHFFFAOYSA-N	0	0	299.418	4.382	20	30		CIEDRN
C=CCC1(C(=O)NCc2cccc(C(C)=O)c2)CCCCC1	ZINC000516313778	330490770	/nfs/dbraw/zinc/49/07/70/330490770.db2.gz	WAKXWEUYRYFTJL-UHFFFAOYSA-N	0	0	299.414	4.032	20	30		CIEDRN
C=CCCCCCNC(=O)N1CCC[C@@H]1c1cccs1	ZINC000516488934	330493048	/nfs/dbraw/zinc/49/30/48/330493048.db2.gz	QDKXTESAUFJSJD-CQSZACIVSA-N	0	0	292.448	4.341	20	30		CIEDRN
N#Cc1ccc(Cl)cc1NCc1ccc2ccccc2n1	ZINC000086114371	330493982	/nfs/dbraw/zinc/49/39/82/330493982.db2.gz	ONKDGRINTZXCIB-UHFFFAOYSA-N	0	0	293.757	4.372	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1ccc(-c2ccccc2)c(C)n1	ZINC000516517024	330494234	/nfs/dbraw/zinc/49/42/34/330494234.db2.gz	LMFJDCSMIOXQGY-CYBMUJFWSA-N	0	0	295.386	4.143	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000426213926	330501762	/nfs/dbraw/zinc/50/17/62/330501762.db2.gz	DIEBFMDWTNGBOF-CVEARBPZSA-N	0	0	286.419	4.115	20	30		CIEDRN
C=CC1CCN(C(=O)C[C@H](C)c2c[nH]c3ccccc32)CC1	ZINC000426321008	330504054	/nfs/dbraw/zinc/50/40/54/330504054.db2.gz	APSIPVVFMJSMAG-AWEZNQCLSA-N	0	0	296.414	4.086	20	30		CIEDRN
COc1cc(C)cc(NCC(C)(C)CCC#N)c1C	ZINC000426551497	330512109	/nfs/dbraw/zinc/51/21/09/330512109.db2.gz	GOSUUKADUNSHEG-UHFFFAOYSA-N	0	0	260.381	4.054	20	30		CIEDRN
CC(C)(c1noc(-c2ccc(C#N)o2)n1)C1CCCCC1	ZINC000426632988	330513427	/nfs/dbraw/zinc/51/34/27/330513427.db2.gz	AFLUHTOHMOICAM-UHFFFAOYSA-N	0	0	285.347	4.059	20	30		CIEDRN
C=C(C)CNC(=O)Nc1cccc(COC(C)(C)C)c1C	ZINC000429334288	330544050	/nfs/dbraw/zinc/54/40/50/330544050.db2.gz	LWNOQRWXYYFYSM-UHFFFAOYSA-N	0	0	290.407	4.008	20	30		CIEDRN
CCCN(C(=O)c1ccc(C#N)o1)[C@H](CC)c1ccccc1	ZINC000429817151	330555413	/nfs/dbraw/zinc/55/54/13/330555413.db2.gz	KUYRFSOKJBAOQP-MRXNPFEDSA-N	0	0	296.370	4.155	20	30		CIEDRN
C=CCN(C)C(=O)N[C@H](c1ccc(C(C)C)cc1)C(C)C	ZINC000429833700	330555579	/nfs/dbraw/zinc/55/55/79/330555579.db2.gz	ZQZVIPIQQNWMQC-KRWDZBQOSA-N	0	0	288.435	4.335	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cccc(OCCC)c1	ZINC000429865738	330555867	/nfs/dbraw/zinc/55/58/67/330555867.db2.gz	IOIRNSMHDAXJSZ-UHFFFAOYSA-N	0	0	261.365	4.016	20	30		CIEDRN
N#C[C@H]1CC[C@@H](Sc2ccc(Br)cc2)C1	ZINC000430089761	330559249	/nfs/dbraw/zinc/55/92/49/330559249.db2.gz	NWJDZNOWUNRBJP-JOYOIKCWSA-N	0	0	282.206	4.233	20	30		CIEDRN
Cc1cccc(-n2ccnc2S[C@H]2CC[C@H](C#N)C2)c1C	ZINC000430123095	330561779	/nfs/dbraw/zinc/56/17/79/330561779.db2.gz	OXISCWOLSAYOAF-GJZGRUSLSA-N	0	0	297.427	4.274	20	30		CIEDRN
N#C[C@H]1CC[C@H](Sc2ccccc2Br)C1	ZINC000430144009	330562457	/nfs/dbraw/zinc/56/24/57/330562457.db2.gz	CZWMHQCDCAKSDZ-UWVGGRQHSA-N	0	0	282.206	4.233	20	30		CIEDRN
C=CCCCCNC(=O)N(CC)[C@H](C)Cc1ccsc1	ZINC000430324693	330567029	/nfs/dbraw/zinc/56/70/29/330567029.db2.gz	TYPDHYUXIXBJBA-CQSZACIVSA-N	0	0	294.464	4.067	20	30		CIEDRN
C=Cc1ccc(C(=O)Nc2cc(C#N)cn2C(C)(C)C)cc1	ZINC000430694336	330570698	/nfs/dbraw/zinc/57/06/98/330570698.db2.gz	JWCRFVHDLWAQSK-UHFFFAOYSA-N	0	0	293.370	4.010	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc(Br)cc1C	ZINC000430904469	330576614	/nfs/dbraw/zinc/57/66/14/330576614.db2.gz	RSSNANKLVAADQR-UHFFFAOYSA-N	0	0	296.208	4.298	20	30		CIEDRN
CC(C)c1cc(N[C@H](CCCC#N)c2ccccc2)ncn1	ZINC000431496050	330585680	/nfs/dbraw/zinc/58/56/80/330585680.db2.gz	QZNDGRQOHQFXIE-MRXNPFEDSA-N	0	0	294.402	4.447	20	30		CIEDRN
CCc1ncnc(N[C@@H](CCCC#N)c2ccccc2)c1F	ZINC000431502281	330585805	/nfs/dbraw/zinc/58/58/05/330585805.db2.gz	MTFVFLMCPMRMAA-HNNXBMFYSA-N	0	0	298.365	4.025	20	30		CIEDRN
CC[C@@H](CC(=O)Nc1cccc(C#N)c1C)c1ccccc1	ZINC000431827879	330589275	/nfs/dbraw/zinc/58/92/75/330589275.db2.gz	JXTSRAHJUAVVHX-HNNXBMFYSA-N	0	0	292.382	4.389	20	30		CIEDRN
C=CCN(C)C(=O)NCc1ccc(C2CCCCC2)cc1	ZINC000432128680	330593402	/nfs/dbraw/zinc/59/34/02/330593402.db2.gz	ZNFFYGBIKXKUKY-UHFFFAOYSA-N	0	0	286.419	4.062	20	30		CIEDRN
N#Cc1cccc(C#N)c1NCc1cc2ccccc2s1	ZINC000432174422	330594492	/nfs/dbraw/zinc/59/44/92/330594492.db2.gz	UUSNOBNBADGKTF-UHFFFAOYSA-N	0	0	289.363	4.257	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)N(CCC)Cc1ccccc1	ZINC000432552379	330600476	/nfs/dbraw/zinc/60/04/76/330600476.db2.gz	DHRKSDJPZFKZML-UHFFFAOYSA-N	0	0	288.435	4.211	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)N1CCC=C(c2ccccc2)C1	ZINC000432570566	330601119	/nfs/dbraw/zinc/60/11/19/330601119.db2.gz	CEJDRAZRUGDOFO-UHFFFAOYSA-N	0	0	298.430	4.088	20	30		CIEDRN
N#CCCC[C@H](NCc1ncc(C2CC2)o1)c1ccccc1	ZINC000433018405	330612364	/nfs/dbraw/zinc/61/23/64/330612364.db2.gz	GWNCLROOKKDDJM-INIZCTEOSA-N	0	0	295.386	4.077	20	30		CIEDRN
CCC1(C(=O)N(Cc2ccc(C#N)cc2)CC(C)C)CCC1	ZINC000433875565	330632466	/nfs/dbraw/zinc/63/24/66/330632466.db2.gz	TUGQRTUFOOZEOA-UHFFFAOYSA-N	0	0	298.430	4.123	20	30		CIEDRN
CC1(C)CCCN(C(=O)c2cc3ccccc3s2)[C@H]1C#N	ZINC000434019791	330634250	/nfs/dbraw/zinc/63/42/50/330634250.db2.gz	BJFFRXMYSUKHKV-HNNXBMFYSA-N	0	0	298.411	4.056	20	30		CIEDRN
C[C@@H](CC1CCCCC1)C(=O)N1CCCC(C)(C)[C@H]1C#N	ZINC000434029546	330634436	/nfs/dbraw/zinc/63/44/36/330634436.db2.gz	CANHLAZDFWRGRH-GOEBONIOSA-N	0	0	290.451	4.134	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1C[C@@H](c2ccccc2)C(C)(C)C1	ZINC000434104374	330635403	/nfs/dbraw/zinc/63/54/03/330635403.db2.gz	PQMHDEBCAQUKLN-SFHVURJKSA-N	0	0	297.442	4.407	20	30		CIEDRN
C=CCC[C@H](NC(=O)c1ccc(Cl)o1)c1ccccc1	ZINC000435267068	330651916	/nfs/dbraw/zinc/65/19/16/330651916.db2.gz	LLKHWTHRERZVEV-ZDUSSCGKSA-N	0	0	289.762	4.370	20	30		CIEDRN
C=CCC[C@H](NC(=O)Cc1cccc(F)c1)c1ccccc1	ZINC000435297364	330652559	/nfs/dbraw/zinc/65/25/59/330652559.db2.gz	JSCFQBODCRTDNQ-SFHVURJKSA-N	0	0	297.373	4.192	20	30		CIEDRN
CC(C)(C#N)CCCC[S@@](=O)C1CCC(C)(C)CC1	ZINC000435428179	330654795	/nfs/dbraw/zinc/65/47/95/330654795.db2.gz	PGUXGAJTQVGXLD-LJQANCHMSA-N	0	0	283.481	4.424	20	30		CIEDRN
C=CCC[C@H](NC(=O)N1[C@H](C)CC[C@H]1C)c1ccccc1	ZINC000435761028	330662330	/nfs/dbraw/zinc/66/23/30/330662330.db2.gz	LWJDLHQAJOIWGF-INMHGKMJSA-N	0	0	286.419	4.276	20	30		CIEDRN
C=CCc1cc(C)cc(OC)c1OCCC(F)(F)F	ZINC000435804903	330663483	/nfs/dbraw/zinc/66/34/83/330663483.db2.gz	WFDXGDNBRQUQGW-UHFFFAOYSA-N	0	0	274.282	4.063	20	30		CIEDRN
COCc1nc(CSCCCCC(C)(C)C#N)cs1	ZINC000435885280	330664441	/nfs/dbraw/zinc/66/44/41/330664441.db2.gz	IDZKHHLAXSXCQK-UHFFFAOYSA-N	0	0	298.477	4.243	20	30		CIEDRN
CC[C@@H](C#N)Nc1cccc(COC(C)(C)C)c1C	ZINC000435931560	330665468	/nfs/dbraw/zinc/66/54/68/330665468.db2.gz	XHHKVCKRDWNYKY-AWEZNQCLSA-N	0	0	260.381	4.024	20	30		CIEDRN
CCCOc1ccc(C(F)(F)F)cc1N[C@H](C#N)CC	ZINC000435934487	330666087	/nfs/dbraw/zinc/66/60/87/330666087.db2.gz	HOHRLBDDYWXKQQ-NSHDSACASA-N	0	0	286.297	4.208	20	30		CIEDRN
C=C(CC)CSCc1nc(-c2ccccc2F)no1	ZINC000435994182	330667351	/nfs/dbraw/zinc/66/73/51/330667351.db2.gz	OARFRJIYSCWSTK-UHFFFAOYSA-N	0	0	278.352	4.075	20	30		CIEDRN
C=C(C)CCc1noc(-c2cc3ccccc3cc2O)n1	ZINC000436689495	330682783	/nfs/dbraw/zinc/68/27/83/330682783.db2.gz	RPUNDGCTFJYLTO-UHFFFAOYSA-N	0	0	280.327	4.104	20	30		CIEDRN
C=CC(C)(C)C(=O)N(C)Cc1ccc(Cl)c(Cl)c1	ZINC000448580855	330687288	/nfs/dbraw/zinc/68/72/88/330687288.db2.gz	NPGCZUKJDYYWRP-UHFFFAOYSA-N	0	0	286.202	4.164	20	30		CIEDRN
C=CCC[C@H](CC)Nc1ccc(C(=O)NC(C)(C)C)cc1	ZINC000437144685	330694679	/nfs/dbraw/zinc/69/46/79/330694679.db2.gz	RGNXJTBOSGXVTA-HNNXBMFYSA-N	0	0	288.435	4.372	20	30		CIEDRN
C=CC[C@@H](C)[C@H](C)Nc1cc(NC(=O)N(C)C)ccc1C	ZINC000437344065	330697893	/nfs/dbraw/zinc/69/78/93/330697893.db2.gz	IBAYAEAVMJINCG-OCCSQVGLSA-N	0	0	289.423	4.101	20	30		CIEDRN
Cc1cccc(OCc2ccc(C#N)cc2Cl)c1	ZINC000162968061	330700011	/nfs/dbraw/zinc/70/00/11/330700011.db2.gz	RWHHRXTXULJPLL-UHFFFAOYSA-N	0	0	257.720	4.099	20	30		CIEDRN
N#Cc1ccc(Nc2nc(C3CCCC3)cs2)cc1	ZINC000437668156	330706284	/nfs/dbraw/zinc/70/62/84/330706284.db2.gz	AFWSRQHMVQMQBJ-UHFFFAOYSA-N	0	0	269.373	4.416	20	30		CIEDRN
Cc1ccc2cc(CNc3cccc(C#N)c3C)ccc2n1	ZINC000437808178	330709398	/nfs/dbraw/zinc/70/93/98/330709398.db2.gz	ZYVNLMDMWZLBGY-UHFFFAOYSA-N	0	0	287.366	4.335	20	30		CIEDRN
Cc1csc(CSCc2ccc(C#N)cc2Cl)n1	ZINC000438871825	330730276	/nfs/dbraw/zinc/73/02/76/330730276.db2.gz	HOCFGNMZESQCMR-UHFFFAOYSA-N	0	0	294.832	4.410	20	30		CIEDRN
Cc1cccc([C@@H]2CCCN2c2nccc(C#N)c2Cl)c1	ZINC000439111039	330733976	/nfs/dbraw/zinc/73/39/76/330733976.db2.gz	WMWJTLHSFVMNCM-HNNXBMFYSA-N	0	0	297.789	4.257	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1ccc(F)cc1OC(C)C	ZINC000439367624	330737544	/nfs/dbraw/zinc/73/75/44/330737544.db2.gz	FAHPYFGVCPYNJA-CYBMUJFWSA-N	0	0	294.370	4.089	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1c(F)cc(Cl)cc1F	ZINC000439375932	330737644	/nfs/dbraw/zinc/73/76/44/330737644.db2.gz	FBGVFBLJKPMNAF-VIFPVBQESA-N	0	0	288.725	4.094	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@@H]1C[C@]12CCc1ccccc12	ZINC000439494352	330739612	/nfs/dbraw/zinc/73/96/12/330739612.db2.gz	JLYGUDAFTXOIQL-ICSRJNTNSA-N	0	0	297.442	4.095	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@H]1C[C@]12CCc1ccccc12	ZINC000439494353	330739644	/nfs/dbraw/zinc/73/96/44/330739644.db2.gz	JLYGUDAFTXOIQL-QUCCMNQESA-N	0	0	297.442	4.095	20	30		CIEDRN
Cc1cccc(OCc2ccc(C#N)cc2OC(F)F)c1	ZINC000439552022	330740302	/nfs/dbraw/zinc/74/03/02/330740302.db2.gz	PQEPMSLPWYQBGX-UHFFFAOYSA-N	0	0	289.281	4.047	20	30		CIEDRN
CCCC[C@@H](CC)CN(C#N)c1ccc(F)c(C#N)c1	ZINC000439717059	330742322	/nfs/dbraw/zinc/74/23/22/330742322.db2.gz	TXESNKHRFCDWQG-CYBMUJFWSA-N	0	0	273.355	4.201	20	30		CIEDRN
C=C1CCN(C(=O)[C@@H](C)c2ccc3ccccc3c2)CC1	ZINC000439945382	330744930	/nfs/dbraw/zinc/74/49/30/330744930.db2.gz	VTPWZZICMAEDKK-HNNXBMFYSA-N	0	0	279.383	4.122	20	30		CIEDRN
CCCc1ccccc1NC(=O)c1cccc(C#N)c1C	ZINC000510514940	332905691	/nfs/dbraw/zinc/90/56/91/332905691.db2.gz	OOUFINCGKQCBDH-UHFFFAOYSA-N	0	0	278.355	4.072	20	30		CIEDRN
C[C@H](SCCC(=O)OC(C)(C)C)c1ccc(C#N)cc1	ZINC000440588707	330751469	/nfs/dbraw/zinc/75/14/69/330751469.db2.gz	OWTJEUFZNMZVPL-LBPRGKRZSA-N	0	0	291.416	4.084	20	30		CIEDRN
Cc1cc(NCC2CCC(C#N)CC2)c2cccc(F)c2n1	ZINC000440650099	330753570	/nfs/dbraw/zinc/75/35/70/330753570.db2.gz	RRNBEVBNBYRDLP-UHFFFAOYSA-N	0	0	297.377	4.424	20	30		CIEDRN
C=CCC1(C(=O)Nc2cc(Cl)cc(F)c2F)CCC1	ZINC000441578834	330771055	/nfs/dbraw/zinc/77/10/55/330771055.db2.gz	WENPKJSGTNAVNM-UHFFFAOYSA-N	0	0	285.721	4.303	20	30		CIEDRN
Cc1ccc(NCC(C)(C)CCC#N)c(Br)c1	ZINC000162132939	330772886	/nfs/dbraw/zinc/77/28/86/330772886.db2.gz	FTVGFORLZMZTIX-UHFFFAOYSA-N	0	0	295.224	4.499	20	30		CIEDRN
C=CCC1(C(=O)N(C)Cc2ccc(C#N)cc2)CCCCC1	ZINC000448662887	330773394	/nfs/dbraw/zinc/77/33/94/330773394.db2.gz	BXTGWLNMYUQQJG-UHFFFAOYSA-N	0	0	296.414	4.043	20	30		CIEDRN
C[C@H](SCc1cccc([N+](=O)[O-])c1)c1cccc(C#N)c1	ZINC000442737853	330781230	/nfs/dbraw/zinc/78/12/30/330781230.db2.gz	NINNPBDCQBDHRP-LBPRGKRZSA-N	0	0	298.367	4.461	20	30		CIEDRN
Cc1cc(N[C@H]2CCC[C@@H](C#N)C2)cc(C)c1Cl	ZINC000442807564	330784915	/nfs/dbraw/zinc/78/49/15/330784915.db2.gz	DWBIZPFDNQGVTC-OLZOCXBDSA-N	0	0	262.784	4.451	20	30		CIEDRN
Cc1cc(N[C@@H]2CCC[C@H](C#N)C2)cc(C)c1Cl	ZINC000442807565	330784953	/nfs/dbraw/zinc/78/49/53/330784953.db2.gz	DWBIZPFDNQGVTC-QWHCGFSZSA-N	0	0	262.784	4.451	20	30		CIEDRN
N#C[C@@H]1CC[C@@H](Nc2cc(Cl)cc(C(F)(F)F)c2)C1	ZINC000442836085	330785958	/nfs/dbraw/zinc/78/59/58/330785958.db2.gz	GHYGTJIFRDHJFL-LDYMZIIASA-N	0	0	288.700	4.463	20	30		CIEDRN
N#C[C@H]1CC[C@@H](Nc2cccc(C(F)F)c2Cl)C1	ZINC000442834715	330785974	/nfs/dbraw/zinc/78/59/74/330785974.db2.gz	KRLPJVPPNWLSEG-DTWKUNHWSA-N	0	0	270.710	4.382	20	30		CIEDRN
N#C[C@H]1CC[C@@H](Nc2cc(Cl)cc(C(F)(F)F)c2)C1	ZINC000442836079	330785990	/nfs/dbraw/zinc/78/59/90/330785990.db2.gz	GHYGTJIFRDHJFL-GZMMTYOYSA-N	0	0	288.700	4.463	20	30		CIEDRN
CSc1ccc(Cl)cc1N[C@@H]1CC[C@H](C#N)C1	ZINC000442868529	330788651	/nfs/dbraw/zinc/78/86/51/330788651.db2.gz	NYOIRPWXOUSFRT-GXSJLCMTSA-N	0	0	266.797	4.166	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000448681930	330793190	/nfs/dbraw/zinc/79/31/90/330793190.db2.gz	SABXLWYCRQSSOL-SNVBAGLBSA-N	0	0	285.309	4.095	20	30		CIEDRN
Cc1nc(CCS[C@@H](C)c2cccc(C#N)c2)cs1	ZINC000443135224	330795621	/nfs/dbraw/zinc/79/56/21/330795621.db2.gz	RCJCZPLLSDKMDW-NSHDSACASA-N	0	0	288.441	4.360	20	30		CIEDRN
N#Cc1nc(Sc2ccccc2F)ccc1C(F)(F)F	ZINC000443405944	330798933	/nfs/dbraw/zinc/79/89/33/330798933.db2.gz	CKJSBQRSIIMZPN-UHFFFAOYSA-N	0	0	298.264	4.262	20	30		CIEDRN
Cc1sc(NC(=O)c2c(C)cccc2C)c(C#N)c1C	ZINC000443815087	330806193	/nfs/dbraw/zinc/80/61/93/330806193.db2.gz	IYZUQCHZSHBXEE-UHFFFAOYSA-N	0	0	284.384	4.106	20	30		CIEDRN
CCC(CC)(C(=O)Nc1ccc(C#N)cc1)c1ccccc1	ZINC000443830529	330806235	/nfs/dbraw/zinc/80/62/35/330806235.db2.gz	AQAHGQHZGFZTBR-UHFFFAOYSA-N	0	0	292.382	4.255	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1cc(Cl)c(C)cc1Cl	ZINC000443953264	330807851	/nfs/dbraw/zinc/80/78/51/330807851.db2.gz	RXUUBOZOJNROSQ-VIFPVBQESA-N	0	0	287.190	4.388	20	30		CIEDRN
Cc1cc(CNc2ccccc2Cl)ccc1C#N	ZINC000443991117	330808568	/nfs/dbraw/zinc/80/85/68/330808568.db2.gz	TUCKEELWQYFROK-UHFFFAOYSA-N	0	0	256.736	4.132	20	30		CIEDRN
CCSCc1ccnc(NCc2ccc(C#N)c(C)c2)c1	ZINC000444006648	330809218	/nfs/dbraw/zinc/80/92/18/330809218.db2.gz	XTEWMBFXMKUIJW-UHFFFAOYSA-N	0	0	297.427	4.127	20	30		CIEDRN
CC(C)(c1noc(C2(C#N)CCCCC2)n1)c1ccccc1	ZINC000445473840	330829488	/nfs/dbraw/zinc/82/94/88/330829488.db2.gz	WLFCZGMFZXMILS-UHFFFAOYSA-N	0	0	295.386	4.121	20	30		CIEDRN
Cc1cscc1-c1noc(/C=C\c2ccc(C#N)cc2)n1	ZINC000445623633	330833182	/nfs/dbraw/zinc/83/31/82/330833182.db2.gz	LDEYVMDMIJFMMR-SREVYHEPSA-N	0	0	293.351	4.149	20	30		CIEDRN
N#Cc1cnc2ccccc2c1N1CCCC2(CCCC2)C1	ZINC000445665127	330834292	/nfs/dbraw/zinc/83/42/92/330834292.db2.gz	OKPGVHULJKKIDJ-UHFFFAOYSA-N	0	0	291.398	4.267	20	30		CIEDRN
Cc1cc(Cl)ccc1NC(=O)c1ccc(C#N)cc1C	ZINC000160021284	330856951	/nfs/dbraw/zinc/85/69/51/330856951.db2.gz	QLSJSWXRURIBEL-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
Oc1ccccc1SCC#Cc1ccccc1Cl	ZINC000446973949	330859082	/nfs/dbraw/zinc/85/90/82/330859082.db2.gz	GNTPMMDBGVLXRP-UHFFFAOYSA-N	0	0	274.772	4.189	20	30		CIEDRN
CC(=O)Nc1ccc(SCc2ccc(C#N)c(C)c2)cc1	ZINC000447295515	330863632	/nfs/dbraw/zinc/86/36/32/330863632.db2.gz	LGEPLPQSWUPUDZ-UHFFFAOYSA-N	0	0	296.395	4.117	20	30		CIEDRN
Cc1cc(CSc2nc3ccccc3o2)ccc1C#N	ZINC000447293346	330863667	/nfs/dbraw/zinc/86/36/67/330863667.db2.gz	VSLWAKCKFPDODU-UHFFFAOYSA-N	0	0	280.352	4.300	20	30		CIEDRN
Cc1cc(CSCc2nc3ccccc3[nH]2)ccc1C#N	ZINC000447414812	330866659	/nfs/dbraw/zinc/86/66/59/330866659.db2.gz	UKKHWHKVRFZHQN-UHFFFAOYSA-N	0	0	293.395	4.176	20	30		CIEDRN
CC[C@H](Nc1cnn([C@H](C)C2CC2)c1)c1ccc(C#N)cc1	ZINC000447597764	330872776	/nfs/dbraw/zinc/87/27/76/330872776.db2.gz	GTUZKPKZBFEOJL-ACJLOTCBSA-N	0	0	294.402	4.289	20	30		CIEDRN
CC(C)(C)Oc1cc(F)ccc1N[C@@H]1CCC[C@H](C#N)C1	ZINC000447598348	330873015	/nfs/dbraw/zinc/87/30/15/330873015.db2.gz	HSTUHBOFZIZRNQ-GXTWGEPZSA-N	0	0	290.382	4.497	20	30		CIEDRN
CC[C@@H](Nc1cnn(CC(C)C)c1C)c1ccc(C#N)cc1	ZINC000447602962	330873289	/nfs/dbraw/zinc/87/32/89/330873289.db2.gz	URYOCGVHFPWSAT-QGZVFWFLSA-N	0	0	296.418	4.282	20	30		CIEDRN
C=CCc1ccccc1OCCCC1CCOCC1	ZINC000447777756	330876529	/nfs/dbraw/zinc/87/65/29/330876529.db2.gz	GYDPQHXVMJOBMT-UHFFFAOYSA-N	0	0	260.377	4.001	20	30		CIEDRN
N#Cc1cccc(OCCSCCCc2ccccc2)c1	ZINC000303107256	332906532	/nfs/dbraw/zinc/90/65/32/332906532.db2.gz	NADGPLVUMSDIEC-UHFFFAOYSA-N	0	0	297.423	4.303	20	30		CIEDRN
Cc1sccc1C(=O)N(CC(C)C)c1ccc(C#N)cc1	ZINC000448821574	330884890	/nfs/dbraw/zinc/88/48/90/330884890.db2.gz	GZZZTVZAJNVWGZ-UHFFFAOYSA-N	0	0	298.411	4.231	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H](C)c2ccccc2)CCCC1	ZINC000449040742	330894690	/nfs/dbraw/zinc/89/46/90/330894690.db2.gz	JRRPHWFJCPNNGD-AWEZNQCLSA-N	0	0	257.377	4.000	20	30		CIEDRN
C=CCCCC[C@H](C)Nc1cccc(NC(C)=O)c1	ZINC000449041908	330894801	/nfs/dbraw/zinc/89/48/01/330894801.db2.gz	PDHSCFMVPWBXRL-ZDUSSCGKSA-N	0	0	260.381	4.192	20	30		CIEDRN
C=CCCCC[C@@H](C)Nc1cccc(C[S@](C)=O)c1	ZINC000449054905	330895691	/nfs/dbraw/zinc/89/56/91/330895691.db2.gz	RYVMJXLMBOTLGF-KUHUBIRLSA-N	0	0	279.449	4.112	20	30		CIEDRN
Cc1ccc2cccc(NC3CCC(C)(C#N)CC3)c2n1	ZINC000449219350	330907054	/nfs/dbraw/zinc/90/70/54/330907054.db2.gz	DFFCWSCZDFSKGB-UHFFFAOYSA-N	0	0	279.387	4.428	20	30		CIEDRN
C=CCC1(C(=O)N[C@H](C)c2ccc(OC)cc2)CCCC1	ZINC000449435574	330925324	/nfs/dbraw/zinc/92/53/24/330925324.db2.gz	WCGWLNCOXCLXBC-CQSZACIVSA-N	0	0	287.403	4.009	20	30		CIEDRN
CC(C)(C)[C@@H]1C[C@@H](Nc2cccc(CC#N)c2)CS1	ZINC000449697540	330944435	/nfs/dbraw/zinc/94/44/35/330944435.db2.gz	LURUQANVPXPEBI-CABCVRRESA-N	0	0	274.433	4.085	20	30		CIEDRN
C=CCC1(C(=O)N(C)Cc2ccc(C)s2)CCCC1	ZINC000449838150	330951610	/nfs/dbraw/zinc/95/16/10/330951610.db2.gz	ZDFRJSCZJMGHCO-UHFFFAOYSA-N	0	0	277.433	4.151	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1cc2ccncc2s1	ZINC000449917430	330954761	/nfs/dbraw/zinc/95/47/61/330954761.db2.gz	UPYFQDKTZPUDRL-UHFFFAOYSA-N	0	0	288.416	4.115	20	30		CIEDRN
C=CC(C)(C)C(=O)N1CC[C@@H](c2ccccc2)[C@H](CC)C1	ZINC000450020368	330958776	/nfs/dbraw/zinc/95/87/76/330958776.db2.gz	WVKVEOBFMUHHBW-NVXWUHKLSA-N	0	0	285.431	4.241	20	30		CIEDRN
C[C@@H]1CC[C@H](C(=O)N[C@@H](CCC#N)c2ccccc2)C[C@@H]1C	ZINC000450192663	330965230	/nfs/dbraw/zinc/96/52/30/330965230.db2.gz	KQDUSNXMPFGIGU-FZCLSBEQSA-N	0	0	298.430	4.220	20	30		CIEDRN
N#Cc1ccc(COc2c(F)cccc2F)c(Cl)c1	ZINC000162995953	330973643	/nfs/dbraw/zinc/97/36/43/330973643.db2.gz	SLAOLSRIHZFPFI-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
N#Cc1c(Cl)cccc1NC[C@H]1CCC(F)(F)C1	ZINC000450499627	330983843	/nfs/dbraw/zinc/98/38/43/330983843.db2.gz	JHMQUFFCTNXLAH-VIFPVBQESA-N	0	0	270.710	4.059	20	30		CIEDRN
C=CCn1c(C)nnc1SCc1c(C)cccc1Cl	ZINC000450644743	330991017	/nfs/dbraw/zinc/99/10/17/330991017.db2.gz	DNZWPNPTDVQZPO-UHFFFAOYSA-N	0	0	293.823	4.027	20	30		CIEDRN
COc1ccccc1[C@@H](CC(C)C)NCC1(C#N)CCC1	ZINC000450687817	330993728	/nfs/dbraw/zinc/99/37/28/330993728.db2.gz	WBNOISIQNUOOIR-MRXNPFEDSA-N	0	0	286.419	4.066	20	30		CIEDRN
C[C@H](Sc1ccc(C#N)cc1)C(=O)C1CCCCC1	ZINC000450810549	331000641	/nfs/dbraw/zinc/00/06/41/331000641.db2.gz	NCDUMNQTFNUMDR-LBPRGKRZSA-N	0	0	273.401	4.188	20	30		CIEDRN
N#CC1(CN(CCC(F)(F)F)Cc2ccccc2)CCC1	ZINC000450840698	331002182	/nfs/dbraw/zinc/00/21/82/331002182.db2.gz	YRAXRYOORUPYLR-UHFFFAOYSA-N	0	0	296.336	4.135	20	30		CIEDRN
N#CC1(CN2CC=C(c3cccc(Cl)c3)CC2)CCC1	ZINC000450888849	331004964	/nfs/dbraw/zinc/00/49/64/331004964.db2.gz	ARKPWPGOLCUJJK-UHFFFAOYSA-N	0	0	286.806	4.123	20	30		CIEDRN
C[C@H]1CCC(=O)[C@H](Sc2cccc(Cl)c2C#N)C1	ZINC000450899826	331005824	/nfs/dbraw/zinc/00/58/24/331005824.db2.gz	DVDRLALLDQPVEM-LKFCYVNXSA-N	0	0	279.792	4.061	20	30		CIEDRN
N#C[C@H]1CC[C@H](Sc2cc(Cl)ccc2F)C1	ZINC000450964948	331008844	/nfs/dbraw/zinc/00/88/44/331008844.db2.gz	UBZTWMRUOXWRJA-WPRPVWTQSA-N	0	0	255.745	4.263	20	30		CIEDRN
C=CCSc1ccccc1NC(=O)CSC1CCC1	ZINC000450994924	331010974	/nfs/dbraw/zinc/01/09/74/331010974.db2.gz	RXTBRXWMPCDPSM-UHFFFAOYSA-N	0	0	293.457	4.189	20	30		CIEDRN
C=CCOCCCSC1CCC(C(F)(F)F)CC1	ZINC000451037337	331012913	/nfs/dbraw/zinc/01/29/13/331012913.db2.gz	ICSADOYEWVPQOX-UHFFFAOYSA-N	0	0	282.371	4.433	20	30		CIEDRN
C=CCC1(C(=O)N(C)Cc2cccc3[nH]ccc32)CCCC1	ZINC000451174214	331018810	/nfs/dbraw/zinc/01/88/10/331018810.db2.gz	CPZQROQXYQPXPY-UHFFFAOYSA-N	0	0	296.414	4.263	20	30		CIEDRN
C=CCC1(C(=O)NC[C@H]2CCC(F)(F)C2)CCCCC1	ZINC000451385883	331026693	/nfs/dbraw/zinc/02/66/93/331026693.db2.gz	UGJBEUUBHWYKFQ-ZDUSSCGKSA-N	0	0	285.378	4.065	20	30		CIEDRN
C=CCC1(C(=O)N2CCC[C@H](C3CC3)C2)CCCCC1	ZINC000451789113	331041976	/nfs/dbraw/zinc/04/19/76/331041976.db2.gz	QGKQWQCPUCSUDD-INIZCTEOSA-N	0	0	275.436	4.162	20	30		CIEDRN
C=CCC1(C(=O)N2CCCc3occc3C2)CCCCC1	ZINC000451807037	331043011	/nfs/dbraw/zinc/04/30/11/331043011.db2.gz	FYCMSZABRVZDAR-UHFFFAOYSA-N	0	0	287.403	4.081	20	30		CIEDRN
N#Cc1ccc(F)c(CN2CC3(CCC3)[C@H]2c2ccco2)c1	ZINC000451833594	331044128	/nfs/dbraw/zinc/04/41/28/331044128.db2.gz	IEJQIRJFWWJKOO-QGZVFWFLSA-N	0	0	296.345	4.018	20	30		CIEDRN
C=CCC1(C(=O)Nc2cccc(C3CC3)n2)CCCC1	ZINC000452137994	331055525	/nfs/dbraw/zinc/05/55/25/331055525.db2.gz	AXLDCFYYJMHHLV-UHFFFAOYSA-N	0	0	270.376	4.034	20	30		CIEDRN
Cc1csc(C(=O)N[C@@H](CCCC#N)c2ccccc2)c1	ZINC000452137311	331055544	/nfs/dbraw/zinc/05/55/44/331055544.db2.gz	CZYSOXQQVQVXKV-HNNXBMFYSA-N	0	0	298.411	4.222	20	30		CIEDRN
Cc1sccc1C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000452138549	331055694	/nfs/dbraw/zinc/05/56/94/331055694.db2.gz	JLFOTMRLHQGTGN-MRXNPFEDSA-N	0	0	298.411	4.222	20	30		CIEDRN
C=CCC1(C(=O)N2CC(C)(C)[C@@H]2C2CC2)CCCCC1	ZINC000452153394	331056272	/nfs/dbraw/zinc/05/62/72/331056272.db2.gz	PNSHKPGMZYLYBT-HNNXBMFYSA-N	0	0	275.436	4.160	20	30		CIEDRN
CC[C@@H]1CCC[C@@H]1CNC(=O)C[C@H](CC#N)c1ccccc1	ZINC000452526906	331067493	/nfs/dbraw/zinc/06/74/93/331067493.db2.gz	KYWMCMNQUOAIOW-BPQIPLTHSA-N	0	0	298.430	4.016	20	30		CIEDRN
CC(C)[C@@H](CC1CCCC1)C(=O)N[C@H]1CC[C@@H](CC#N)C1	ZINC000452561649	331069036	/nfs/dbraw/zinc/06/90/36/331069036.db2.gz	LNDSJKSDBFRAMI-YESZJQIVSA-N	0	0	290.451	4.037	20	30		CIEDRN
CC(C)(CC(=O)Nc1ccc(CC#N)cc1Cl)C1CC1	ZINC000452638798	331070675	/nfs/dbraw/zinc/07/06/75/331070675.db2.gz	BDDDFGQSZPYFBO-UHFFFAOYSA-N	0	0	290.794	4.171	20	30		CIEDRN
C[C@@H]1CC[C@H](CC(=O)Nc2ccc(CC#N)cc2Cl)C1	ZINC000452642209	331070885	/nfs/dbraw/zinc/07/08/85/331070885.db2.gz	GKSOQMPZRXDZAP-YPMHNXCESA-N	0	0	290.794	4.171	20	30		CIEDRN
CCC(CC)[C@@H](C)C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452646336	331070969	/nfs/dbraw/zinc/07/09/69/331070969.db2.gz	QCJQFUUHDXGBPF-LLVKDONJSA-N	0	0	292.810	4.417	20	30		CIEDRN
C=C(C)CCNC(=O)[C@@H](C)c1ccc2cc(OC)ccc2c1	ZINC000452719091	331073422	/nfs/dbraw/zinc/07/34/22/331073422.db2.gz	RZDSDZPKTLWKCS-AWEZNQCLSA-N	0	0	297.398	4.034	20	30		CIEDRN
C=C(C)CCNC(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1Cl	ZINC000452722942	331074033	/nfs/dbraw/zinc/07/40/33/331074033.db2.gz	LQRFIBRJRPGNDJ-NEPJUHHUSA-N	0	0	298.213	4.179	20	30		CIEDRN
C=CC(C)(C)CNC(=O)[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000452774106	331076006	/nfs/dbraw/zinc/07/60/06/331076006.db2.gz	KGICTCLMAIEKAT-NSHDSACASA-N	0	0	299.336	4.137	20	30		CIEDRN
C=CC(C)(C)CNC(=O)C[C@@H](c1ccccc1)C(F)(F)F	ZINC000452774355	331076150	/nfs/dbraw/zinc/07/61/50/331076150.db2.gz	LDWCXSBBOUCFSB-ZDUSSCGKSA-N	0	0	299.336	4.051	20	30		CIEDRN
C=CCC1(C(=O)NC[C@H]2CCCC2(F)F)CCCCC1	ZINC000452828621	331078942	/nfs/dbraw/zinc/07/89/42/331078942.db2.gz	ROUGCIWRBUHRGI-CYBMUJFWSA-N	0	0	285.378	4.065	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)Nc1cc(C)c(C)cc1Cl)OCC	ZINC000452886655	331080034	/nfs/dbraw/zinc/08/00/34/331080034.db2.gz	ROUWHGCTTJHMLH-OAHLLOKOSA-N	0	0	295.810	4.267	20	30		CIEDRN
C=CC(C)(C)c1nc(Cc2cccc(C(F)(F)F)c2)no1	ZINC000453064558	331085835	/nfs/dbraw/zinc/08/58/35/331085835.db2.gz	WVNPXEZPMSVLMR-UHFFFAOYSA-N	0	0	296.292	4.143	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ncccc2SCC)n1	ZINC000453184363	331098358	/nfs/dbraw/zinc/09/83/58/331098358.db2.gz	HTVQKTPIDFKUJI-UHFFFAOYSA-N	0	0	289.404	4.097	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H]2CCCCC2(F)F)n1	ZINC000453190607	331099360	/nfs/dbraw/zinc/09/93/60/331099360.db2.gz	VCKHFEPRALXMFE-SNVBAGLBSA-N	0	0	270.323	4.216	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc([C@H]2CSc3ccccc32)no1	ZINC000453213124	331102183	/nfs/dbraw/zinc/10/21/83/331102183.db2.gz	GWPCRCWEBBLTBA-LRDDRELGSA-N	0	0	286.400	4.161	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc([C@@H]2CSc3ccccc32)no1	ZINC000453231371	331104571	/nfs/dbraw/zinc/10/45/71/331104571.db2.gz	VMWWUCGHPSPOFJ-DGCLKSJQSA-N	0	0	286.400	4.377	20	30		CIEDRN
C=CCCc1noc([C@H]2C[C@@H]2c2c(F)cccc2Cl)n1	ZINC000453233290	331104813	/nfs/dbraw/zinc/10/48/13/331104813.db2.gz	JWYWYBDGEGNQDT-UWVGGRQHSA-N	0	0	292.741	4.252	20	30		CIEDRN
C=CCCc1noc([C@@H]2C[C@@H]2c2ccc([C@@H]3C[C@@H]3C)o2)n1	ZINC000453250697	331107755	/nfs/dbraw/zinc/10/77/55/331107755.db2.gz	YQPHMJKILZVBTD-QNWHQSFQSA-N	0	0	284.359	4.176	20	30		CIEDRN
C=CCC[C@H](NCc1cnc(CCC)o1)c1ccco1	ZINC000453383076	331126096	/nfs/dbraw/zinc/12/60/96/331126096.db2.gz	MEMBPPOCVSBOCQ-AWEZNQCLSA-N	0	0	274.364	4.017	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1C[C@H](c2ccc(C)cc2)C[C@@H]1C	ZINC000470585430	331139247	/nfs/dbraw/zinc/13/92/47/331139247.db2.gz	WTADPOGQWLXOSJ-KVSKMBFKSA-N	0	0	285.431	4.302	20	30		CIEDRN
C=CCN(CC=C)C(=O)c1ccc([C@@H](C)C(F)(F)F)cc1	ZINC000454147604	331139763	/nfs/dbraw/zinc/13/97/63/331139763.db2.gz	DBOVOCVFJVFVKX-GFCCVEGCSA-N	0	0	297.320	4.167	20	30		CIEDRN
C=CC(C)(C)CNC(=O)Nc1ccccc1C(F)(F)F	ZINC000454159704	331140326	/nfs/dbraw/zinc/14/03/26/331140326.db2.gz	ILNPBVFCDFLOQZ-UHFFFAOYSA-N	0	0	286.297	4.039	20	30		CIEDRN
C=C(CC)CNC(=O)Nc1ccccc1C(C)(C)C	ZINC000454213381	331141953	/nfs/dbraw/zinc/14/19/53/331141953.db2.gz	WXHUEEVYMQPLKM-UHFFFAOYSA-N	0	0	260.381	4.072	20	30		CIEDRN
CCc1ccc(CC)c(NC(=O)N[C@H]2CC[C@@H](CC#N)C2)c1	ZINC000454896981	331156086	/nfs/dbraw/zinc/15/60/86/331156086.db2.gz	XGQWXPCCPJVAHR-HOCLYGCPSA-N	0	0	299.418	4.015	20	30		CIEDRN
CC(C)Oc1ccc(C#N)cc1NC(=O)C1=CC[C@@H](C)CC1	ZINC000454985418	331158174	/nfs/dbraw/zinc/15/81/74/331158174.db2.gz	XHZQYNLQXWFEGD-CYBMUJFWSA-N	0	0	298.386	4.030	20	30		CIEDRN
C=C(CC)CNC(=O)Nc1cc(C(F)F)ccc1Cl	ZINC000455000897	331158556	/nfs/dbraw/zinc/15/85/56/331158556.db2.gz	WSIMAIAJJDTCAD-UHFFFAOYSA-N	0	0	288.725	4.365	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](F)C1	ZINC000455250337	331163218	/nfs/dbraw/zinc/16/32/18/331163218.db2.gz	RJPKNXSCLADAMD-CQSZACIVSA-N	0	0	290.382	4.114	20	30		CIEDRN
C=CC(C)(C)CNC(=O)N1CCC[C@H]1c1cccc(C)c1	ZINC000455363895	331167158	/nfs/dbraw/zinc/16/71/58/331167158.db2.gz	ICRJHQLIZBKIDS-INIZCTEOSA-N	0	0	286.419	4.054	20	30		CIEDRN
C=CCN(CCC#N)C(=O)Nc1c(CC)cc(C)cc1CC	ZINC000455366084	331167345	/nfs/dbraw/zinc/16/73/45/331167345.db2.gz	ZUMZHNDNYJJTKM-UHFFFAOYSA-N	0	0	299.418	4.053	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CC[C@@H]1C(C)C	ZINC000455374270	331167594	/nfs/dbraw/zinc/16/75/94/331167594.db2.gz	BXUODICDOXLPMO-MRXNPFEDSA-N	0	0	272.392	4.067	20	30		CIEDRN
C=C(CC)CNC(=O)Nc1c(F)cccc1SCC	ZINC000455472435	331170164	/nfs/dbraw/zinc/17/01/64/331170164.db2.gz	SGZNSUBWFSWOGL-UHFFFAOYSA-N	0	0	282.384	4.025	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)c1ccc([C@H](C)C(F)(F)F)cc1	ZINC000455680032	331175353	/nfs/dbraw/zinc/17/53/53/331175353.db2.gz	CRYVVCUBUYUCLE-MNOVXSKESA-N	0	0	285.309	4.047	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Nc1cncc(Cl)c1C	ZINC000455709011	331176003	/nfs/dbraw/zinc/17/60/03/331176003.db2.gz	HOTWCCAHYZGVLM-UHFFFAOYSA-N	0	0	295.814	4.254	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1ccccc1C(C)(F)F	ZINC000455811910	331178117	/nfs/dbraw/zinc/17/81/17/331178117.db2.gz	RXKIGLKMVABXHF-UHFFFAOYSA-N	0	0	282.334	4.228	20	30		CIEDRN
N#Cc1ccc(OCc2ccc3ccccc3c2)cc1	ZINC000195595920	331178209	/nfs/dbraw/zinc/17/82/09/331178209.db2.gz	CHXCSTKFDNQGJV-UHFFFAOYSA-N	0	0	259.308	4.290	20	30		CIEDRN
CC(C)(C)C[C@@H]1CCN(C(=O)Nc2cccc(CC#N)c2)C1	ZINC000455899396	331179916	/nfs/dbraw/zinc/17/99/16/331179916.db2.gz	AHPOWMCRMWXKST-HNNXBMFYSA-N	0	0	299.418	4.043	20	30		CIEDRN
CC(C)C[C@@]1(C)CCCN1C(=O)Nc1cccc(CC#N)c1	ZINC000455908519	331180433	/nfs/dbraw/zinc/18/04/33/331180433.db2.gz	RAYHSLUOKGSUEN-GOSISDBHSA-N	0	0	299.418	4.185	20	30		CIEDRN
CCCCN(CCCC)C(=O)Nc1cccc(CC#N)c1	ZINC000455909832	331180646	/nfs/dbraw/zinc/18/06/46/331180646.db2.gz	BYEFCSQELPNLAQ-UHFFFAOYSA-N	0	0	287.407	4.187	20	30		CIEDRN
CC1(C)CN(C(=O)Nc2cccc(CC#N)c2)CC(C)(C)C1	ZINC000455912411	331180777	/nfs/dbraw/zinc/18/07/77/331180777.db2.gz	XMADCKMCFBYQIU-UHFFFAOYSA-N	0	0	299.418	4.043	20	30		CIEDRN
CCC1(CC)CCN(C(=O)Nc2cccc(CC#N)c2)CC1	ZINC000455913171	331180820	/nfs/dbraw/zinc/18/08/20/331180820.db2.gz	YPZKPHOMKMFBCT-UHFFFAOYSA-N	0	0	299.418	4.187	20	30		CIEDRN
CC(C)C[C@H]1CCCCN1C(=O)Nc1cccc(CC#N)c1	ZINC000455916524	331180898	/nfs/dbraw/zinc/18/08/98/331180898.db2.gz	IQCFWRVVAUQHNQ-QGZVFWFLSA-N	0	0	299.418	4.185	20	30		CIEDRN
C[C@H](c1cccs1)N(C)C(=O)Nc1cccc(CC#N)c1	ZINC000455914679	331180917	/nfs/dbraw/zinc/18/09/17/331180917.db2.gz	HEDINKOUXBSUND-GFCCVEGCSA-N	0	0	299.399	4.039	20	30		CIEDRN
CC[C@H]1CCCC[C@@H]1N(C)C(=O)Nc1cccc(CC#N)c1	ZINC000455914621	331180935	/nfs/dbraw/zinc/18/09/35/331180935.db2.gz	GWLFFFCNYXHKGJ-RDJZCZTQSA-N	0	0	299.418	4.185	20	30		CIEDRN
CCC[C@H]1[C@H](C)CCCN1C(=O)Nc1cccc(CC#N)c1	ZINC000455924316	331181340	/nfs/dbraw/zinc/18/13/40/331181340.db2.gz	VNBUXZITSBIFCK-PBHICJAKSA-N	0	0	299.418	4.185	20	30		CIEDRN
C=CCN(C(=O)c1ccc([C@@H](C)C(F)(F)F)cc1)C1CC1	ZINC000455994460	331182066	/nfs/dbraw/zinc/18/20/66/331182066.db2.gz	MMVDOPZCFGDZPD-LLVKDONJSA-N	0	0	297.320	4.143	20	30		CIEDRN
C=CCC1(NC(=O)c2nc(C(C)C)oc2C)CCCCC1	ZINC000456360530	331190983	/nfs/dbraw/zinc/19/09/83/331190983.db2.gz	DHNGYKATFGKDAB-UHFFFAOYSA-N	0	0	290.407	4.115	20	30		CIEDRN
C=CCC1(C(=O)Nc2scnc2C(C)C)CCCC1	ZINC000456439512	331192719	/nfs/dbraw/zinc/19/27/19/331192719.db2.gz	OIBBUQDGEADFDE-UHFFFAOYSA-N	0	0	278.421	4.342	20	30		CIEDRN
C=CCC1(CNC(=O)[C@H](C)c2cccs2)CCCC1	ZINC000456484239	331193615	/nfs/dbraw/zinc/19/36/15/331193615.db2.gz	IYWBLMSIKQDGPP-CYBMUJFWSA-N	0	0	277.433	4.104	20	30		CIEDRN
C=CCC1(CNC(=O)C2CCC(F)(F)CC2)CCCC1	ZINC000456487100	331193908	/nfs/dbraw/zinc/19/39/08/331193908.db2.gz	OITODHAIJDWATJ-UHFFFAOYSA-N	0	0	285.378	4.065	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NC1(Cc2cccc(Cl)c2)CC1	ZINC000456722201	331199105	/nfs/dbraw/zinc/19/91/05/331199105.db2.gz	GIYRGJPHCZNEKV-ZDUSSCGKSA-N	0	0	291.822	4.134	20	30		CIEDRN
CC1=C(C(=O)Nc2cccc(CC#N)c2)CCC(C)(C)C1	ZINC000456726542	331199302	/nfs/dbraw/zinc/19/93/02/331199302.db2.gz	BDBVABDODFDSMK-UHFFFAOYSA-N	0	0	282.387	4.218	20	30		CIEDRN
CCc1ccc([C@H](C)C(=O)Nc2cccc(CC#N)c2)cc1	ZINC000456741766	331199599	/nfs/dbraw/zinc/19/95/99/331199599.db2.gz	YYLWLSQQNFBZRY-AWEZNQCLSA-N	0	0	292.382	4.057	20	30		CIEDRN
CC(C)c1ccsc1C(=O)Nc1cccc(CC#N)c1	ZINC000456738836	331199655	/nfs/dbraw/zinc/19/96/55/331199655.db2.gz	VAJROHWEOATRNK-UHFFFAOYSA-N	0	0	284.384	4.190	20	30		CIEDRN
CC[C@@H]1CC[C@H](C)N(C(=O)C[C@@H](CC#N)c2ccccc2)C1	ZINC000456822761	331205791	/nfs/dbraw/zinc/20/57/91/331205791.db2.gz	RVTLEQABCXNPCH-LZLYRXPVSA-N	0	0	298.430	4.111	20	30		CIEDRN
C=C(CC)CNC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000456829228	331206391	/nfs/dbraw/zinc/20/63/91/331206391.db2.gz	DONBMFUDRXSQCS-OCCSQVGLSA-N	0	0	295.785	4.055	20	30		CIEDRN
C=C(CC)CNC(=O)[C@H]1C[C@H]1c1cccc2ccccc21	ZINC000456831943	331206805	/nfs/dbraw/zinc/20/68/05/331206805.db2.gz	VPTQIYBSJCDQBT-ROUUACIJSA-N	0	0	279.383	4.026	20	30		CIEDRN
Cc1cc(C(=O)Nc2cc(C)cc(C#N)c2)c(C)n1C(C)C	ZINC000456960008	331209192	/nfs/dbraw/zinc/20/91/92/331209192.db2.gz	HBXOCNQMFAYNFC-UHFFFAOYSA-N	0	0	295.386	4.118	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@H](CC(C)(C)C)C1	ZINC000457036105	331210665	/nfs/dbraw/zinc/21/06/65/331210665.db2.gz	WYUIIBKGYMYOKI-CQSZACIVSA-N	0	0	263.425	4.040	20	30		CIEDRN
Cc1ccc(-c2noc(-c3ccc(C#N)cc3C)n2)c(F)c1	ZINC000460145406	331212769	/nfs/dbraw/zinc/21/27/69/331212769.db2.gz	HIRJUMIGNNKXIY-UHFFFAOYSA-N	0	0	293.301	4.031	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC2(CCCC2)[C@H]1C(C)C	ZINC000457146948	331212896	/nfs/dbraw/zinc/21/28/96/331212896.db2.gz	PQMHYBGYVZAFCI-LSDHHAIUSA-N	0	0	263.425	4.016	20	30		CIEDRN
C[C@@H]1CCCC[C@]1(C)NC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000457238426	331216826	/nfs/dbraw/zinc/21/68/26/331216826.db2.gz	CVSYTKAPCMPMJB-SUMDDJOVSA-N	0	0	298.430	4.159	20	30		CIEDRN
C[C@@H]1CCCC[C@]1(C)NC(=O)C[C@H](CC#N)c1ccccc1	ZINC000457238424	331216842	/nfs/dbraw/zinc/21/68/42/331216842.db2.gz	CVSYTKAPCMPMJB-AYBZRNKSSA-N	0	0	298.430	4.159	20	30		CIEDRN
C=CCCC(=O)N1CC2(CCCC2)[C@H]1c1ccccc1	ZINC000457278063	331217962	/nfs/dbraw/zinc/21/79/62/331217962.db2.gz	LFBAMZLCBQFPTE-QGZVFWFLSA-N	0	0	269.388	4.097	20	30		CIEDRN
C=CCC1(C(=O)N2CC(C(C)(C)C)C2)CCCCC1	ZINC000457357009	331219877	/nfs/dbraw/zinc/21/98/77/331219877.db2.gz	VFMCLDRTAOUVPY-UHFFFAOYSA-N	0	0	263.425	4.018	20	30		CIEDRN
CC(C)c1cccc(CC(=O)Nc2ccc(CC#N)cc2)c1	ZINC000457390475	331220851	/nfs/dbraw/zinc/22/08/51/331220851.db2.gz	BVOHSLJYVNZSNL-UHFFFAOYSA-N	0	0	292.382	4.057	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)[C@H](CC)CC(F)F	ZINC000457483577	331224458	/nfs/dbraw/zinc/22/44/58/331224458.db2.gz	FWVZSEPKHQLCNI-GFCCVEGCSA-N	0	0	299.336	4.022	20	30		CIEDRN
C=C1CCN(C(=O)C(C)(C)Cc2ccc(Cl)cc2)CC1	ZINC000457543810	331226414	/nfs/dbraw/zinc/22/64/14/331226414.db2.gz	UQSZRZNBRRMQRL-UHFFFAOYSA-N	0	0	291.822	4.087	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)[C@@H](C)CC(F)(F)F	ZINC000457551493	331226676	/nfs/dbraw/zinc/22/66/76/331226676.db2.gz	APRMVXSCHOBAOX-LBPRGKRZSA-N	0	0	291.357	4.170	20	30		CIEDRN
CC(C)CCCCC(=O)N[C@H](CCC#N)c1ccccc1	ZINC000457666133	331230667	/nfs/dbraw/zinc/23/06/67/331230667.db2.gz	QBHQHVLJNSNZHH-QGZVFWFLSA-N	0	0	286.419	4.364	20	30		CIEDRN
C=CCC[C@@H](NC(=O)[C@@H](C)CC(F)(F)F)c1ccccc1	ZINC000457673994	331230839	/nfs/dbraw/zinc/23/08/39/331230839.db2.gz	MEIRDCXKHJBIOU-GXTWGEPZSA-N	0	0	299.336	4.399	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)[C@@H](CC)CC(F)F	ZINC000457769082	331233841	/nfs/dbraw/zinc/23/38/41/331233841.db2.gz	DOXVSJSNMZGQBF-HNNXBMFYSA-N	0	0	295.373	4.273	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)[C@H](C)C1CCC1	ZINC000457781881	331234229	/nfs/dbraw/zinc/23/42/29/331234229.db2.gz	YLOXDWXJCPSVSM-OAHLLOKOSA-N	0	0	271.404	4.028	20	30		CIEDRN
CC(C)c1ccc(/C=C/CC(=O)NCC(C)(C)CC#N)cc1	ZINC000457992512	331239583	/nfs/dbraw/zinc/23/95/83/331239583.db2.gz	LDWBYGNERGXLMY-AATRIKPKSA-N	0	0	298.430	4.269	20	30		CIEDRN
CC1(C)CCCN1C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000458799054	331260025	/nfs/dbraw/zinc/26/00/25/331260025.db2.gz	IZRRBDKRCLBHOB-MRXNPFEDSA-N	0	0	299.418	4.006	20	30		CIEDRN
C=C(C)CCNC(=O)N1CCCC[C@H]1c1ccc(F)cc1	ZINC000459008192	331266123	/nfs/dbraw/zinc/26/61/23/331266123.db2.gz	UBRJCOSDABNJNO-INIZCTEOSA-N	0	0	290.382	4.029	20	30		CIEDRN
C=C(C)CCNC(=O)N1CCCC[C@@H]1c1ccc(F)cc1	ZINC000459008193	331266138	/nfs/dbraw/zinc/26/61/38/331266138.db2.gz	UBRJCOSDABNJNO-MRXNPFEDSA-N	0	0	290.382	4.029	20	30		CIEDRN
C=C(CC)CNC(=O)N(Cc1ccoc1)C1CCCCC1	ZINC000459084952	331269833	/nfs/dbraw/zinc/26/98/33/331269833.db2.gz	UXJQLOOWIYPQDU-UHFFFAOYSA-N	0	0	290.407	4.090	20	30		CIEDRN
CC(C)C[C@@H]1C[C@H]1NC(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000459246366	331272884	/nfs/dbraw/zinc/27/28/84/331272884.db2.gz	WHOMJOAXRSXOFF-CZUORRHYSA-N	0	0	299.418	4.044	20	30		CIEDRN
C=CC(C)(C)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000459808901	331301910	/nfs/dbraw/zinc/30/19/10/331301910.db2.gz	HCRSPFSFQVTIKH-UHFFFAOYSA-N	0	0	258.148	4.144	20	30		CIEDRN
CC(C)(C)c1ccccc1NC(=O)c1cscc1C#N	ZINC000459840592	331302556	/nfs/dbraw/zinc/30/25/56/331302556.db2.gz	SPSJKUJBHGBJGE-UHFFFAOYSA-N	0	0	284.384	4.170	20	30		CIEDRN
CCC[C@H](CC(C)C)C(=O)Nc1sccc1C#N	ZINC000459851555	331302589	/nfs/dbraw/zinc/30/25/89/331302589.db2.gz	ANVMNMBXXRAQAF-LLVKDONJSA-N	0	0	264.394	4.021	20	30		CIEDRN
CC[C@@H]1CCC[C@@H]1C(=O)Nc1sc(C)c(C)c1C#N	ZINC000459846900	331302609	/nfs/dbraw/zinc/30/26/09/331302609.db2.gz	RUXYFMJXOFFSIX-NEPJUHHUSA-N	0	0	276.405	4.001	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@]1(C)CCC[C@H]1C	ZINC000459876412	331302706	/nfs/dbraw/zinc/30/27/06/331302706.db2.gz	DJAJQSUBZWIDRS-CZUORRHYSA-N	0	0	277.433	4.089	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)C(C)(C)C(C)(C)C	ZINC000459886430	331302964	/nfs/dbraw/zinc/30/29/64/331302964.db2.gz	ZSUFQQZOFRNAOI-UHFFFAOYSA-N	0	0	279.449	4.335	20	30		CIEDRN
C=CCN(C(=O)[C@H](CC)CC(F)(F)F)c1ccccc1	ZINC000459934079	331303628	/nfs/dbraw/zinc/30/36/28/331303628.db2.gz	RTLLCEZEZQPNTH-GFCCVEGCSA-N	0	0	285.309	4.184	20	30		CIEDRN
CC[C@@H](CC(C)C)C(=O)N(Cc1ccc(C#N)cc1)C1CC1	ZINC000459944256	331303718	/nfs/dbraw/zinc/30/37/18/331303718.db2.gz	JQMLKJPJBHZUIC-KRWDZBQOSA-N	0	0	298.430	4.122	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)[C@@H](CC)c1ccc(F)cc1	ZINC000461092871	331311300	/nfs/dbraw/zinc/31/13/00/331311300.db2.gz	GPSXNNFKCDXGJW-CJNGLKHVSA-N	0	0	277.383	4.180	20	30		CIEDRN
N#Cc1ccc(SCC(=O)CCC2CCCC2)cc1	ZINC000461411608	331313064	/nfs/dbraw/zinc/31/30/64/331313064.db2.gz	PPXLIOSLCKXBCL-UHFFFAOYSA-N	0	0	273.401	4.190	20	30		CIEDRN
C=Cc1ccc(CCNc2cc(C(C)=O)ccc2C#N)cc1	ZINC000461872378	331315056	/nfs/dbraw/zinc/31/50/56/331315056.db2.gz	SSWJXTLGAQHNLC-UHFFFAOYSA-N	0	0	290.366	4.058	20	30		CIEDRN
CCCCCN(CCCCC)C(=O)N[C@@H]1CCC[C@H]1C#N	ZINC000461961891	331315814	/nfs/dbraw/zinc/31/58/14/331315814.db2.gz	WISJIRFJCCZVCJ-JKSUJKDBSA-N	0	0	293.455	4.071	20	30		CIEDRN
Cc1nc(NC[C@@H]2CCCC(F)(F)C2)c(Cl)cc1C#N	ZINC000461955652	331316169	/nfs/dbraw/zinc/31/61/69/331316169.db2.gz	FVZYFXYWBOGVKH-SNVBAGLBSA-N	0	0	299.752	4.153	20	30		CIEDRN
Cc1nc(N2C[C@H](C)[C@H]2c2ccccc2)c(Cl)cc1C#N	ZINC000461966786	331316450	/nfs/dbraw/zinc/31/64/50/331316450.db2.gz	PBEPZLSLAQXMKY-ZBEGNZNMSA-N	0	0	297.789	4.113	20	30		CIEDRN
CCCC[C@@H]1CCC[C@@H]1NC(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000462021377	331316823	/nfs/dbraw/zinc/31/68/23/331316823.db2.gz	VNSKNEJOCDWOTC-LESCRADOSA-N	0	0	298.430	4.137	20	30		CIEDRN
Cc1ccccc1C1(CNC(=O)CCCC#N)CCCCC1	ZINC000462042360	331316938	/nfs/dbraw/zinc/31/69/38/331316938.db2.gz	YCDSYUREULKYLJ-UHFFFAOYSA-N	0	0	298.430	4.007	20	30		CIEDRN
C[C@H](C(=O)NCCCCC1CCCC1)c1cccc(C#N)c1	ZINC000462183149	331318067	/nfs/dbraw/zinc/31/80/67/331318067.db2.gz	RVUGMHVDSWBSHC-HNNXBMFYSA-N	0	0	298.430	4.138	20	30		CIEDRN
N#Cc1cccc(OCCNc2cccc3ccccc32)c1	ZINC000462220583	331318555	/nfs/dbraw/zinc/31/85/55/331318555.db2.gz	GIGVFLNLOMLERX-UHFFFAOYSA-N	0	0	288.350	4.202	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H]1CCCCC12CCCC2	ZINC000462386853	331321170	/nfs/dbraw/zinc/32/11/70/331321170.db2.gz	GVHSLKSCVYAPES-INIZCTEOSA-N	0	0	275.436	4.374	20	30		CIEDRN
C=CCCC[C@@H](C)Sc1nc2nc(C)ccc2o1	ZINC000462405015	331321529	/nfs/dbraw/zinc/32/15/29/331321529.db2.gz	AUCKYOMINRDBQM-LLVKDONJSA-N	0	0	262.378	4.368	20	30		CIEDRN
CC(C)C[C@H](C)C(=O)N(CC(C)C)c1ccc(C#N)cc1	ZINC000462430123	331321854	/nfs/dbraw/zinc/32/18/54/331321854.db2.gz	HKBBUSMSNDSSJA-HNNXBMFYSA-N	0	0	286.419	4.229	20	30		CIEDRN
CCC1(CNC(=O)[C@H](C)c2cccc(C#N)c2)CCCCC1	ZINC000462497642	331322910	/nfs/dbraw/zinc/32/29/10/331322910.db2.gz	AMUWFHZIQFAGPA-OAHLLOKOSA-N	0	0	298.430	4.138	20	30		CIEDRN
C=CCOc1ccc(OCc2csc(C(C)C)n2)cc1	ZINC000462665059	331324713	/nfs/dbraw/zinc/32/47/13/331324713.db2.gz	RNGOTFGLWVTORN-UHFFFAOYSA-N	0	0	289.400	4.410	20	30		CIEDRN
C=C(C)[C@H](CC(=O)Nc1cccc(C2CCC2)c1)OCC	ZINC000462730041	331325829	/nfs/dbraw/zinc/32/58/29/331325829.db2.gz	FJNWUQNDNFXQAB-KRWDZBQOSA-N	0	0	287.403	4.264	20	30		CIEDRN
CCCCOc1cccc(CNc2ccc(F)cc2C#N)c1	ZINC000462773102	331328291	/nfs/dbraw/zinc/32/82/91/331328291.db2.gz	FBPLBCRXRVBGCQ-UHFFFAOYSA-N	0	0	298.361	4.488	20	30		CIEDRN
CC(C)COc1ccccc1CNc1ccc(F)cc1C#N	ZINC000462775766	331328507	/nfs/dbraw/zinc/32/85/07/331328507.db2.gz	HYMDTMWSRUXGMD-UHFFFAOYSA-N	0	0	298.361	4.344	20	30		CIEDRN
CCc1ccc(CNc2c(Cl)cccc2C#N)s1	ZINC000462793571	331329322	/nfs/dbraw/zinc/32/93/22/331329322.db2.gz	RFEGAWGSRRIBNS-UHFFFAOYSA-N	0	0	276.792	4.448	20	30		CIEDRN
Cc1ccc(SCCNc2ccc(F)cc2C#N)cc1	ZINC000462791881	331329342	/nfs/dbraw/zinc/32/93/42/331329342.db2.gz	TXDPXGGPFNLPIP-UHFFFAOYSA-N	0	0	286.375	4.210	20	30		CIEDRN
C[C@H](CCc1ccsc1)Nc1cccc(C#N)c1	ZINC000462795883	331329444	/nfs/dbraw/zinc/32/94/44/331329444.db2.gz	YDJADOVILQHQLO-GFCCVEGCSA-N	0	0	256.374	4.053	20	30		CIEDRN
Cc1ccc(CN(C)c2c(Cl)cccc2C#N)s1	ZINC000462823529	331331343	/nfs/dbraw/zinc/33/13/43/331331343.db2.gz	VLGSMRFTROIYQD-UHFFFAOYSA-N	0	0	276.792	4.218	20	30		CIEDRN
C[C@@H](CNc1c(Cl)cccc1C#N)Oc1ccccc1	ZINC000462832817	331332003	/nfs/dbraw/zinc/33/20/03/331332003.db2.gz	JDHFWPJFXXGSND-LBPRGKRZSA-N	0	0	286.762	4.091	20	30		CIEDRN
N#C[C@H]1CCC[C@H](Nc2cccc(C3CCC3)c2)C1	ZINC000462872031	331333492	/nfs/dbraw/zinc/33/34/92/331333492.db2.gz	SSSDPIRKDDZHMC-BBRMVZONSA-N	0	0	254.377	4.448	20	30		CIEDRN
N#Cc1ccc(N[C@@H]2CC[C@@H]3CCC[C@@H]3C2)c(F)c1	ZINC000462900664	331334391	/nfs/dbraw/zinc/33/43/91/331334391.db2.gz	DCUYSJCAZWOCJI-BFHYXJOUSA-N	0	0	258.340	4.078	20	30		CIEDRN
N#Cc1cc(F)ccc1NCCc1cccc(Cl)c1	ZINC000462926937	331335311	/nfs/dbraw/zinc/33/53/11/331335311.db2.gz	FIPXSPUWMSTIAT-UHFFFAOYSA-N	0	0	274.726	4.005	20	30		CIEDRN
CC[C@]1(C)CCCN(c2c(C#N)cnc3ccccc32)C1	ZINC000462948926	331335638	/nfs/dbraw/zinc/33/56/38/331335638.db2.gz	XGDAWMTZXDZGGM-GOSISDBHSA-N	0	0	279.387	4.123	20	30		CIEDRN
C=CCC[C@H](C)Nc1ccc(-n2cnc(C)c2C)cc1	ZINC000463023489	331337393	/nfs/dbraw/zinc/33/73/93/331337393.db2.gz	MINRNXNSPONJMG-ZDUSSCGKSA-N	0	0	269.392	4.256	20	30		CIEDRN
C=CCCCC(=O)N1CC[C@@H](C)C2(CCCCC2)C1	ZINC000463038466	331338159	/nfs/dbraw/zinc/33/81/59/331338159.db2.gz	WMFIGNHORCXYMJ-OAHLLOKOSA-N	0	0	263.425	4.162	20	30		CIEDRN
CCC[C@@]1(C)CCCN(c2ccc(Cl)c(C#N)n2)C1	ZINC000463068294	331339205	/nfs/dbraw/zinc/33/92/05/331339205.db2.gz	KDMWOUYZJHVGJY-HNNXBMFYSA-N	0	0	277.799	4.013	20	30		CIEDRN
Cc1ccc(CC[C@H](C)Nc2c(F)cc(C#N)cc2F)o1	ZINC000463071396	331339352	/nfs/dbraw/zinc/33/93/52/331339352.db2.gz	RCVPHUBSPQKLEU-JTQLQIEISA-N	0	0	290.313	4.171	20	30		CIEDRN
CCC[C@@]1(C)CCCN(c2ncc(C#N)cc2Cl)C1	ZINC000463072154	331339383	/nfs/dbraw/zinc/33/93/83/331339383.db2.gz	ZIGHQCXWRKQRMA-HNNXBMFYSA-N	0	0	277.799	4.013	20	30		CIEDRN
C[C@H](CNc1ccc(C#N)cc1F)Sc1ccccc1	ZINC000463080667	331339816	/nfs/dbraw/zinc/33/98/16/331339816.db2.gz	CXYBKUCDRXRLGB-GFCCVEGCSA-N	0	0	286.375	4.290	20	30		CIEDRN
CC1(C)CC(Cc2noc(/C=C\c3ccccc3C#N)n2)C1	ZINC000463183155	331341715	/nfs/dbraw/zinc/34/17/15/331341715.db2.gz	GZTXTEJNVIIMHY-FPLPWBNLSA-N	0	0	293.370	4.090	20	30		CIEDRN
CCc1ccc(N[C@@H]2CCC[C@@H](C#N)C2)cc1CC	ZINC000463236541	331343511	/nfs/dbraw/zinc/34/35/11/331343511.db2.gz	LLCMGBOHZHEZQF-CZUORRHYSA-N	0	0	256.393	4.306	20	30		CIEDRN
CC(C)Oc1cc(F)ccc1N[C@H]1CCC[C@@H](C#N)C1	ZINC000463245812	331344062	/nfs/dbraw/zinc/34/40/62/331344062.db2.gz	UXACFFPDWPWIDT-OCCSQVGLSA-N	0	0	276.355	4.107	20	30		CIEDRN
CCc1ccc(CC)c(N[C@H]2CCC[C@H](C#N)C2)c1	ZINC000463278923	331344248	/nfs/dbraw/zinc/34/42/48/331344248.db2.gz	FBITXRGXAKAPJP-HOCLYGCPSA-N	0	0	256.393	4.306	20	30		CIEDRN
C=CCN(CC=C)C(=O)[C@@H](CC(C)C)c1ccccc1	ZINC000463264579	331344722	/nfs/dbraw/zinc/34/47/22/331344722.db2.gz	ZJVOUTITDPIJES-KRWDZBQOSA-N	0	0	271.404	4.017	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)[C@H](CC)c2ccccc2)s1	ZINC000463458515	331347994	/nfs/dbraw/zinc/34/79/94/331347994.db2.gz	OATAAKARNPNFGG-OAHLLOKOSA-N	0	0	298.411	4.314	20	30		CIEDRN
C=CCCCN(C)C(=O)N[C@@H]1CCCCC12CCCC2	ZINC000463543275	331349283	/nfs/dbraw/zinc/34/92/83/331349283.db2.gz	KQPMZIDILVJJTF-OAHLLOKOSA-N	0	0	278.440	4.097	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)c2cc(C)cc(F)c2)c1	ZINC000463555831	331349479	/nfs/dbraw/zinc/34/94/79/331349479.db2.gz	GZEMBONYWDETSB-UHFFFAOYSA-N	0	0	299.345	4.341	20	30		CIEDRN
CCN(CC(C)(C)C)C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000463571123	331349708	/nfs/dbraw/zinc/34/97/08/331349708.db2.gz	QSYLBQOLNDQCFN-UHFFFAOYSA-N	0	0	293.798	4.112	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)c1cc(C)cc(F)c1	ZINC000463841949	331352355	/nfs/dbraw/zinc/35/23/55/331352355.db2.gz	WOVVZNJIUJXNBL-UHFFFAOYSA-N	0	0	289.394	4.343	20	30		CIEDRN
C=C1CCN(C(=O)c2ccc(-c3ccc(CC)cc3)o2)CC1	ZINC000463879888	331352750	/nfs/dbraw/zinc/35/27/50/331352750.db2.gz	QQEHNBQBAWMMTF-UHFFFAOYSA-N	0	0	295.382	4.301	20	30		CIEDRN
C=CCCC(=O)N1CCc2c1cccc2-c1ccccc1	ZINC000463900930	331353322	/nfs/dbraw/zinc/35/33/22/331353322.db2.gz	BKHXEAWYXGFUBO-UHFFFAOYSA-N	0	0	277.367	4.209	20	30		CIEDRN
CCCC[C@@H](CC)C(=O)N(CC)c1ccc(C#N)cc1	ZINC000463957814	331354097	/nfs/dbraw/zinc/35/40/97/331354097.db2.gz	GRWVDHVIACDNAC-OAHLLOKOSA-N	0	0	272.392	4.128	20	30		CIEDRN
CC(C)(C)[C@@H](C#N)NC(=O)c1ccc(C2CCCC2)cc1	ZINC000464038548	331355307	/nfs/dbraw/zinc/35/53/07/331355307.db2.gz	BDFRZZCFXFSODL-MRXNPFEDSA-N	0	0	284.403	4.012	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@@]1(C)CCc2ccccc2C1	ZINC000464084522	331356505	/nfs/dbraw/zinc/35/65/05/331356505.db2.gz	ZJIMJXJFCOOQAC-FQEVSTJZSA-N	0	0	299.458	4.386	20	30		CIEDRN
CC(C)(C)[C@](C)(C#N)NC(=O)C[C@@H]1CCCCC1(C)C	ZINC000464162517	331357343	/nfs/dbraw/zinc/35/73/43/331357343.db2.gz	NEKVBVRLJMUZPH-GUYCJALGSA-N	0	0	278.440	4.037	20	30		CIEDRN
CC(C)(C)[C@](C)(C#N)NC(=O)C[C@H]1CCCC(C)(C)C1	ZINC000464165601	331357405	/nfs/dbraw/zinc/35/74/05/331357405.db2.gz	FVNWGJKHRNBKOC-DYVFJYSZSA-N	0	0	278.440	4.037	20	30		CIEDRN
Cc1ccc(C(=O)N[C@](C)(C#N)C(C)(C)C)c(Cl)c1C	ZINC000464168592	331357463	/nfs/dbraw/zinc/35/74/63/331357463.db2.gz	HPTQBKNHQWXXPS-MRXNPFEDSA-N	0	0	292.810	4.015	20	30		CIEDRN
Cc1cc2cc(C(=O)N[C@](C)(C#N)C(C)(C)C)oc2cc1C	ZINC000464169700	331357501	/nfs/dbraw/zinc/35/75/01/331357501.db2.gz	MGJHZQZCLADTGR-GOSISDBHSA-N	0	0	298.386	4.108	20	30		CIEDRN
C=CCC[C@@H](NC(=O)C(CC)CC)c1ccccc1	ZINC000464200914	331357937	/nfs/dbraw/zinc/35/79/37/331357937.db2.gz	UUDCSUFBJJASHH-MRXNPFEDSA-N	0	0	259.393	4.246	20	30		CIEDRN
CC[C@@H](C)N(C(=O)[C@H](C)c1cccc(C#N)c1)[C@@H](C)CC	ZINC000464335300	331359720	/nfs/dbraw/zinc/35/97/20/331359720.db2.gz	MTBRPBSKMQQMLG-QLFBSQMISA-N	0	0	286.419	4.087	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](c1ccccc1)C1CCC1	ZINC000464435863	331360512	/nfs/dbraw/zinc/36/05/12/331360512.db2.gz	ADUSAOSAPBQIJL-YOEHRIQHSA-N	0	0	271.404	4.246	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(Oc2ccccc2)nc1	ZINC000464436761	331360572	/nfs/dbraw/zinc/36/05/72/331360572.db2.gz	FGNRHZYOIIFJNU-AWEZNQCLSA-N	0	0	296.370	4.415	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ncc(-c2ccccc2)s1	ZINC000464439342	331360629	/nfs/dbraw/zinc/36/06/29/331360629.db2.gz	OGPSUVWEMPBUPQ-LBPRGKRZSA-N	0	0	286.400	4.351	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccc(OCCCC)cc1C	ZINC000464441391	331360718	/nfs/dbraw/zinc/36/07/18/331360718.db2.gz	NBEAFQKURWXJDJ-UHFFFAOYSA-N	0	0	287.403	4.306	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(Cc1cccc(F)c1)C(C)C	ZINC000464443317	331360815	/nfs/dbraw/zinc/36/08/15/331360815.db2.gz	AMEYOYDIPVOWEK-CQSZACIVSA-N	0	0	277.383	4.165	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](c1ccccc1)C(C)(C)C	ZINC000464448051	331360925	/nfs/dbraw/zinc/36/09/25/331360925.db2.gz	FVLQHWAYILOHRQ-GOEBONIOSA-N	0	0	273.420	4.492	20	30		CIEDRN
C=CCC[C@H](C(=O)N(C)[C@H]1CC[C@@H](C)C1)c1ccccc1	ZINC000464477805	331361220	/nfs/dbraw/zinc/36/12/20/331361220.db2.gz	CMHMKWCKDDRXAE-NJAFHUGGSA-N	0	0	285.431	4.383	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)Cc1ccc2ccccc2c1	ZINC000464532195	331361947	/nfs/dbraw/zinc/36/19/47/331361947.db2.gz	XPXQUFHCTWKKLD-HNNXBMFYSA-N	0	0	281.399	4.401	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H](CC(C)C)c1ccccc1	ZINC000464534752	331362019	/nfs/dbraw/zinc/36/20/19/331362019.db2.gz	LYHIJZFTYXGIEP-KRWDZBQOSA-N	0	0	271.404	4.084	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1nc(-c2cccs2)cs1	ZINC000464570220	331362061	/nfs/dbraw/zinc/36/20/61/331362061.db2.gz	OTRKMCRAAWUVMR-SNVBAGLBSA-N	0	0	292.429	4.412	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(Cc1ccc(F)cc1)C(C)C	ZINC000464540443	331362111	/nfs/dbraw/zinc/36/21/11/331362111.db2.gz	KATGGJQYIRCLTD-CQSZACIVSA-N	0	0	277.383	4.165	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCc1cccc(OCCCC)c1	ZINC000464551797	331362368	/nfs/dbraw/zinc/36/23/68/331362368.db2.gz	JQDUAZFHWCTUMW-HNNXBMFYSA-N	0	0	289.419	4.084	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@@H](C)c1c(F)cccc1F	ZINC000464558785	331362479	/nfs/dbraw/zinc/36/24/79/331362479.db2.gz	HAPNEZYATUZBMI-NEPJUHHUSA-N	0	0	281.346	4.087	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(Cc1ccco1)c1ccccc1	ZINC000464558449	331362482	/nfs/dbraw/zinc/36/24/82/331362482.db2.gz	YIRWRYYVWXNCQW-HNNXBMFYSA-N	0	0	283.371	4.415	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(Cc1ccccc1F)C(C)C	ZINC000464557176	331362485	/nfs/dbraw/zinc/36/24/85/331362485.db2.gz	XTVQXBZPIGURRY-CQSZACIVSA-N	0	0	277.383	4.165	20	30		CIEDRN
CC#CCCCC(=O)Nc1nc2c(cc(C)cc2C)s1	ZINC000464557760	331362489	/nfs/dbraw/zinc/36/24/89/331362489.db2.gz	YKUBFKYBMMVURY-UHFFFAOYSA-N	0	0	286.400	4.045	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(C)c(Cl)c1	ZINC000464559006	331362513	/nfs/dbraw/zinc/36/25/13/331362513.db2.gz	SHVAGXNJTMBCQG-LLVKDONJSA-N	0	0	251.757	4.189	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H](C)c1ccc(Cl)cc1Cl	ZINC000464559527	331362653	/nfs/dbraw/zinc/36/26/53/331362653.db2.gz	VEPPLTKCKBKQEX-NSHDSACASA-N	0	0	298.213	4.364	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)Cc1c(F)cccc1Cl	ZINC000464564091	331362760	/nfs/dbraw/zinc/36/27/60/331362760.db2.gz	BAYKHXHQNCLZNM-NSHDSACASA-N	0	0	283.774	4.040	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(Cc1ccccc1)[C@@H](C)CC	ZINC000464574478	331362911	/nfs/dbraw/zinc/36/29/11/331362911.db2.gz	XEXZOPVUTPHOKE-CVEARBPZSA-N	0	0	273.420	4.416	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)C1CCC(CC)CC1	ZINC000464572251	331362919	/nfs/dbraw/zinc/36/29/19/331362919.db2.gz	RYXAJMUCHPOMCP-WLYUNCDWSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC(C)C)C1CCCC1	ZINC000464573075	331362980	/nfs/dbraw/zinc/36/29/80/331362980.db2.gz	XFPXMNDCVSVKCR-AWEZNQCLSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCCc1cccc2ccccc21	ZINC000464572546	331362981	/nfs/dbraw/zinc/36/29/81/331362981.db2.gz	VQWMRUDGJAPWES-OAHLLOKOSA-N	0	0	281.399	4.101	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(Cc1ccccc1)CC(C)C	ZINC000464570537	331362988	/nfs/dbraw/zinc/36/29/88/331362988.db2.gz	MEDUGKZNOZEREE-INIZCTEOSA-N	0	0	273.420	4.274	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H](C)c1ccccc1C(F)(F)F	ZINC000464654018	331364049	/nfs/dbraw/zinc/36/40/49/331364049.db2.gz	ZVXDXOMYFFFDTI-LBPRGKRZSA-N	0	0	297.320	4.076	20	30		CIEDRN
CC#CCCCC(=O)N1CC2(CCCC2)c2c1cccc2F	ZINC000464651963	331364198	/nfs/dbraw/zinc/36/41/98/331364198.db2.gz	UBMHNNOKHLUNFV-UHFFFAOYSA-N	0	0	299.389	4.178	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cnc(C(F)(F)F)cc2C)CC1	ZINC000464672682	331364606	/nfs/dbraw/zinc/36/46/06/331364606.db2.gz	WCUUECHQUMYTFA-UHFFFAOYSA-N	0	0	298.308	4.094	20	30		CIEDRN
CC(C)(C)[C@@H](C#N)NC(=O)c1ccc(C2CCCCC2)cc1	ZINC000464714897	331365177	/nfs/dbraw/zinc/36/51/77/331365177.db2.gz	WVUUIAJDYYNSTK-QGZVFWFLSA-N	0	0	298.430	4.402	20	30		CIEDRN
CC(C)c1ccc(C(=O)N[C@@H](C#N)C(C)(C)C)cc1Cl	ZINC000464714647	331365206	/nfs/dbraw/zinc/36/52/06/331365206.db2.gz	VGPAHHXTZRLIAK-AWEZNQCLSA-N	0	0	292.810	4.131	20	30		CIEDRN
C[C@H]1C[C@H](c2ccccc2F)N(Cc2ccccc2C#N)C1	ZINC000464729164	331365467	/nfs/dbraw/zinc/36/54/67/331365467.db2.gz	ZSLRVLBBPTXCLS-IFXJQAMLSA-N	0	0	294.373	4.280	20	30		CIEDRN
C=C[C@@H](C)NC(=O)N[C@@H](C)c1ccc(SC(C)C)cc1	ZINC000464756509	331366289	/nfs/dbraw/zinc/36/62/89/331366289.db2.gz	RFGSUZJDWRUSCB-OLZOCXBDSA-N	0	0	292.448	4.122	20	30		CIEDRN
C=C[C@H](C)NC(=O)N[C@@H](C)c1ccc(SC(C)C)cc1	ZINC000464756512	331366355	/nfs/dbraw/zinc/36/63/55/331366355.db2.gz	RFGSUZJDWRUSCB-STQMWFEESA-N	0	0	292.448	4.122	20	30		CIEDRN
Cc1ccc([C@@H]2C[C@H](C)CCN2Cc2ccccc2C#N)o1	ZINC000464829433	331370135	/nfs/dbraw/zinc/37/01/35/331370135.db2.gz	JLHHEIHVDRIKLK-KDOFPFPSSA-N	0	0	294.398	4.433	20	30		CIEDRN
N#Cc1ccc(SCc2nc3cc(F)ccc3o2)cc1	ZINC000464895467	331373049	/nfs/dbraw/zinc/37/30/49/331373049.db2.gz	PXDCOSJCCIQYCP-UHFFFAOYSA-N	0	0	284.315	4.131	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1cc(F)cc(Cl)c1	ZINC000464967949	331374617	/nfs/dbraw/zinc/37/46/17/331374617.db2.gz	VZRASJKFMRAGFH-UHFFFAOYSA-N	0	0	283.774	4.298	20	30		CIEDRN
C=C[C@H](C)NC(=O)c1ccc(SCc2ccccc2)cc1	ZINC000465101370	331378298	/nfs/dbraw/zinc/37/82/98/331378298.db2.gz	GLFUZYMJPLTSLM-AWEZNQCLSA-N	0	0	297.423	4.283	20	30		CIEDRN
C=C[C@H](C)NC(=O)c1ccccc1Sc1ccccc1	ZINC000465145671	331379639	/nfs/dbraw/zinc/37/96/39/331379639.db2.gz	JNZLPUKVGXBFIW-ZDUSSCGKSA-N	0	0	283.396	4.142	20	30		CIEDRN
C=C[C@@H](C)NC(=O)Nc1ccccc1-c1cccs1	ZINC000465176953	331380230	/nfs/dbraw/zinc/38/02/30/331380230.db2.gz	MTZXERCOWYFUOO-LLVKDONJSA-N	0	0	272.373	4.111	20	30		CIEDRN
C=C[C@@H](C)NC(=O)Nc1cccc(Oc2ccccc2)c1	ZINC000465251361	331380849	/nfs/dbraw/zinc/38/08/49/331380849.db2.gz	IAFUWKWHDGIOOS-CYBMUJFWSA-N	0	0	282.343	4.175	20	30		CIEDRN
C=C[C@@H](C)NC(=O)Nc1cccc(-c2cccs2)c1	ZINC000465265883	331380884	/nfs/dbraw/zinc/38/08/84/331380884.db2.gz	YTOJJXMSRLUIRP-LLVKDONJSA-N	0	0	272.373	4.111	20	30		CIEDRN
C=C[C@H](C)NC(=O)Nc1cccc(-c2cccs2)c1	ZINC000465265885	331380901	/nfs/dbraw/zinc/38/09/01/331380901.db2.gz	YTOJJXMSRLUIRP-NSHDSACASA-N	0	0	272.373	4.111	20	30		CIEDRN
C=C[C@H](C)NC(=O)Nc1cc(Cl)ccc1SCC	ZINC000465264652	331380902	/nfs/dbraw/zinc/38/09/02/331380902.db2.gz	ZZSVXZMIAHSOJA-VIFPVBQESA-N	0	0	284.812	4.148	20	30		CIEDRN
C=C[C@H](C)NC(=O)Nc1ccc(-c2ncc(C(C)C)o2)cc1	ZINC000465260903	331380949	/nfs/dbraw/zinc/38/09/49/331380949.db2.gz	VAGPLXWYLZHNPA-LBPRGKRZSA-N	0	0	299.374	4.161	20	30		CIEDRN
C=CCCCCCN(C)C(=O)NC1CCC(C)(C)CC1	ZINC000466012345	331388802	/nfs/dbraw/zinc/38/88/02/331388802.db2.gz	SGIAVZUPGLGQBU-UHFFFAOYSA-N	0	0	280.456	4.343	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@](C)(c1ccccc1)C(F)(F)F	ZINC000466236819	331391396	/nfs/dbraw/zinc/39/13/96/331391396.db2.gz	QHLXVPSQGRWJCU-IUODEOHRSA-N	0	0	299.336	4.183	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@](C)(c1ccccc1)C(F)(F)F	ZINC000466236824	331391451	/nfs/dbraw/zinc/39/14/51/331391451.db2.gz	QHLXVPSQGRWJCU-WFASDCNBSA-N	0	0	299.336	4.183	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1[C@H](C)c2ccc(F)cc2C[C@@H]1C	ZINC000466242936	331391502	/nfs/dbraw/zinc/39/15/02/331391502.db2.gz	FVCLUHVNUGQMQK-MELADBBJSA-N	0	0	289.394	4.262	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1[C@@H](C)Cc2cc(F)ccc2[C@@H]1C	ZINC000466242934	331391523	/nfs/dbraw/zinc/39/15/23/331391523.db2.gz	FVCLUHVNUGQMQK-IHRRRGAJSA-N	0	0	289.394	4.262	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1csc2ccccc12	ZINC000466248740	331391577	/nfs/dbraw/zinc/39/15/77/331391577.db2.gz	LWKRXBUHHSGYOA-NSHDSACASA-N	0	0	259.374	4.442	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](CC)CSc1ccccc1	ZINC000466249924	331391665	/nfs/dbraw/zinc/39/16/65/331391665.db2.gz	NDKWYTVUTXFROA-GJZGRUSLSA-N	0	0	291.460	4.276	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cc(F)c(SC)c(F)c1	ZINC000466257023	331391749	/nfs/dbraw/zinc/39/17/49/331391749.db2.gz	ISIRPUBRSHYCLK-SECBINFHSA-N	0	0	285.359	4.228	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1c(C)oc2ccccc21	ZINC000466267069	331391952	/nfs/dbraw/zinc/39/19/52/331391952.db2.gz	XXXPNQUTSSLCTC-LBPRGKRZSA-N	0	0	271.360	4.216	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(OCC)c2cccnc12	ZINC000466319816	331392663	/nfs/dbraw/zinc/39/26/63/331392663.db2.gz	VVMMZYXFZJXNOH-ZDUSSCGKSA-N	0	0	298.386	4.174	20	30		CIEDRN
C=CC[C@H](C)NC(=O)NCC(CC)(CC)c1ccccc1	ZINC000466355038	331393212	/nfs/dbraw/zinc/39/32/12/331393212.db2.gz	FJZHUPIRDAUFSX-HNNXBMFYSA-N	0	0	288.435	4.008	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(CC(C)C)C(CC)CC	ZINC000466366564	331393233	/nfs/dbraw/zinc/39/32/33/331393233.db2.gz	JGJLJKHDDXWGHC-AWEZNQCLSA-N	0	0	268.445	4.197	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(C)[C@H](C)c1cccc(Cl)c1	ZINC000466366863	331393602	/nfs/dbraw/zinc/39/36/02/331393602.db2.gz	MJNAYHJLVZVSOG-DOMZBBRYSA-N	0	0	294.826	4.397	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(CC)[C@H](C)c1ccc(F)cc1	ZINC000466366576	331393619	/nfs/dbraw/zinc/39/36/19/331393619.db2.gz	JIWTWXLDKSFSCI-CZUORRHYSA-N	0	0	292.398	4.273	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CC[C@H](C)C[C@H]1c1ccco1	ZINC000466367620	331393627	/nfs/dbraw/zinc/39/36/27/331393627.db2.gz	XJNGIANRWJFGMT-KKUMJFAQSA-N	0	0	290.407	4.117	20	30		CIEDRN
N#Cc1cc(Cl)ccc1NCc1cccc2cc[nH]c21	ZINC000466368384	331393684	/nfs/dbraw/zinc/39/36/84/331393684.db2.gz	JMQDBVCMADCPQK-UHFFFAOYSA-N	0	0	281.746	4.305	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(C)C/C(C)=C/c1ccccc1	ZINC000466377694	331393907	/nfs/dbraw/zinc/39/39/07/331393907.db2.gz	GUONRFZPAIWTSH-VOGRQWBCSA-N	0	0	286.419	4.086	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1ccccc1-c1ccccc1	ZINC000466383700	331394255	/nfs/dbraw/zinc/39/42/55/331394255.db2.gz	RQZJZLOQSYRKMG-UHFFFAOYSA-N	0	0	280.371	4.393	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(Cc1ccc(F)cc1)C(C)C	ZINC000466386416	331394353	/nfs/dbraw/zinc/39/43/53/331394353.db2.gz	PNVDIRXADYWJNQ-MRXNPFEDSA-N	0	0	292.398	4.100	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(CCC)CCc1cccs1	ZINC000466398488	331394901	/nfs/dbraw/zinc/39/49/01/331394901.db2.gz	XSZVRWCHJNPYMA-AWEZNQCLSA-N	0	0	294.464	4.067	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(C)[C@H](C)c1c(F)cccc1F	ZINC000466402729	331395219	/nfs/dbraw/zinc/39/52/19/331395219.db2.gz	AGJNIJAUPAXBGB-NEPJUHHUSA-N	0	0	296.361	4.022	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CCCCC[C@H]1c1ccco1	ZINC000466405170	331395271	/nfs/dbraw/zinc/39/52/71/331395271.db2.gz	FRCWEBYONIMQRG-GJZGRUSLSA-N	0	0	290.407	4.261	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(CC1CC1)C1CCCCC1	ZINC000466409379	331395473	/nfs/dbraw/zinc/39/54/73/331395473.db2.gz	XCDZMKCLLMSOBC-OAHLLOKOSA-N	0	0	278.440	4.095	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@H](c1ccccc1)C(C)C	ZINC000466415417	331395909	/nfs/dbraw/zinc/39/59/09/331395909.db2.gz	FKSRLZAMLXKAJO-RDJZCZTQSA-N	0	0	273.420	4.444	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(C)c(C)c2ncccc12	ZINC000466415847	331395947	/nfs/dbraw/zinc/39/59/47/331395947.db2.gz	HWSUYKRJYAEAIV-ZDUSSCGKSA-N	0	0	282.387	4.392	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H]1C[C@@H]1c1c(F)cccc1Cl	ZINC000466421980	331396275	/nfs/dbraw/zinc/39/62/75/331396275.db2.gz	PDBJOOXHTCXBLD-MJVIPROJSA-N	0	0	295.785	4.054	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCCCCCOC1CCCCC1	ZINC000466422293	331396277	/nfs/dbraw/zinc/39/62/77/331396277.db2.gz	KLOILLBGMKJXDR-INIZCTEOSA-N	0	0	295.467	4.225	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1C[C@@H]1c1c(F)cccc1Cl	ZINC000466421979	331396315	/nfs/dbraw/zinc/39/63/15/331396315.db2.gz	PDBJOOXHTCXBLD-COPLHBTASA-N	0	0	295.785	4.054	20	30		CIEDRN
N#CCN(C(=O)c1cccc2ccsc21)c1ccccc1	ZINC000466425227	331396664	/nfs/dbraw/zinc/39/66/64/331396664.db2.gz	LJRNSQJJPNUWCW-UHFFFAOYSA-N	0	0	292.363	4.072	20	30		CIEDRN
CC#CCCCC(=O)N1CCC[C@H]1CCC1CCCC1	ZINC000466426897	331396701	/nfs/dbraw/zinc/39/67/01/331396701.db2.gz	TZGSMXHQXWRVDC-KRWDZBQOSA-N	0	0	275.436	4.141	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@@H](CC)Cc1ccc(C)cc1	ZINC000466438645	331397112	/nfs/dbraw/zinc/39/71/12/331397112.db2.gz	NIXQEPNOUFXGFY-WMZOPIPTSA-N	0	0	287.447	4.377	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC)[C@H](CC)Cc1ccccc1	ZINC000466437454	331397147	/nfs/dbraw/zinc/39/71/47/331397147.db2.gz	BJQXQSPSFXMOJC-SJLPKXTDSA-N	0	0	287.447	4.459	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(C)ccc1-n1cc(C)cn1	ZINC000466438664	331397148	/nfs/dbraw/zinc/39/71/48/331397148.db2.gz	NQPHERNYYRTMQJ-HNNXBMFYSA-N	0	0	297.402	4.030	20	30		CIEDRN
C=CCC[C@@H](NC(=O)[C@@H](C)CC(=C)C)c1ccccc1	ZINC000466441088	331397234	/nfs/dbraw/zinc/39/72/34/331397234.db2.gz	LPVFKRHBTUVMBN-DOTOQJQBSA-N	0	0	271.404	4.412	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](C1CCCCC1)C(F)(F)F	ZINC000466440581	331397246	/nfs/dbraw/zinc/39/72/46/331397246.db2.gz	DFHPMGBHFJKJHU-DGCLKSJQSA-N	0	0	291.357	4.216	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1c(Cl)cc(F)cc1Cl	ZINC000466527053	331398634	/nfs/dbraw/zinc/39/86/34/331398634.db2.gz	DMMGIMJIIKWHEJ-SECBINFHSA-N	0	0	290.165	4.217	20	30		CIEDRN
C=C[C@@H](CC(=O)N(CC)c1ncccc1C)c1ccccc1	ZINC000466516594	331398899	/nfs/dbraw/zinc/39/88/99/331398899.db2.gz	GPCXNMYDCMGQMG-INIZCTEOSA-N	0	0	294.398	4.103	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cc(F)cc(Cl)c1	ZINC000466519473	331398936	/nfs/dbraw/zinc/39/89/36/331398936.db2.gz	QNMISEWMUYKFAK-SECBINFHSA-N	0	0	255.720	4.020	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1ccccc1C(C)(C)C	ZINC000466528876	331399153	/nfs/dbraw/zinc/39/91/53/331399153.db2.gz	MNBLELFLLWOSAU-ZDUSSCGKSA-N	0	0	259.393	4.069	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@@H](c1ccccc1)[C@H](C)CC	ZINC000466532271	331399246	/nfs/dbraw/zinc/39/92/46/331399246.db2.gz	WMXSFPJWILDSGX-HYVNUMGLSA-N	0	0	273.420	4.287	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@@H](c1ccc(F)cc1)C(C)C	ZINC000466534297	331399308	/nfs/dbraw/zinc/39/93/08/331399308.db2.gz	OOWAIPYXDYAPSV-JKSUJKDBSA-N	0	0	277.383	4.036	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)[C@@H](CC)Sc1ccccc1	ZINC000466542387	331399566	/nfs/dbraw/zinc/39/95/66/331399566.db2.gz	QMKPJQZPPLZPQI-UKRRQHHQSA-N	0	0	277.433	4.028	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)C(C)(C)Cc1cccc(Cl)c1	ZINC000466543916	331399608	/nfs/dbraw/zinc/39/96/08/331399608.db2.gz	MNMJRPBEHMNTHX-OAHLLOKOSA-N	0	0	293.838	4.380	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(C(=O)C(C)(C)C)cc1	ZINC000466545239	331399732	/nfs/dbraw/zinc/39/97/32/331399732.db2.gz	ZHIYBBHUNWTIKS-ZDUSSCGKSA-N	0	0	287.403	4.456	20	30		CIEDRN
C=CCCCC(=O)Nc1cc(Cl)c(Cl)cc1F	ZINC000466569442	331400080	/nfs/dbraw/zinc/40/00/80/331400080.db2.gz	FXLRJCRRIZRKST-UHFFFAOYSA-N	0	0	276.138	4.427	20	30		CIEDRN
C=CCCN(C)C(=O)c1sccc1-c1ccccc1	ZINC000466648128	331401645	/nfs/dbraw/zinc/40/16/45/331401645.db2.gz	MBHGTZIBCKDODA-UHFFFAOYSA-N	0	0	271.385	4.063	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H](Cc2ccccc2)C1	ZINC000466657209	331401985	/nfs/dbraw/zinc/40/19/85/331401985.db2.gz	YNIYKSCXBFBYEF-WMZOPIPTSA-N	0	0	285.431	4.070	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@]1(CCC)C(F)(F)F	ZINC000466874169	331406926	/nfs/dbraw/zinc/40/69/26/331406926.db2.gz	NQGZGKIHXWIFGO-JSGCOSHPSA-N	0	0	291.357	4.312	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(-c2ccc[nH]2)cc1	ZINC000466872747	331406934	/nfs/dbraw/zinc/40/69/34/331406934.db2.gz	YHJNLVZMFSACOH-ZDUSSCGKSA-N	0	0	268.360	4.223	20	30		CIEDRN
C=CCCN(C)C(=O)N[C@@H](c1ccccc1)C1CCCC1	ZINC000466979160	331409592	/nfs/dbraw/zinc/40/95/92/331409592.db2.gz	NQQAWRHJCPVNNO-KRWDZBQOSA-N	0	0	286.419	4.135	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H]1CC[C@@H]2CCCC[C@@H]2C1	ZINC000467429357	331418788	/nfs/dbraw/zinc/41/87/88/331418788.db2.gz	WZXZGWUGVSYPEG-KLZNWCGWSA-N	0	0	263.425	4.064	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cccc(OCCC)c1	ZINC000467519548	331421137	/nfs/dbraw/zinc/42/11/37/331421137.db2.gz	QZFSEBJOSNRCLR-MRXNPFEDSA-N	0	0	261.365	4.016	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1nc2ccsc2s1	ZINC000467537042	331421337	/nfs/dbraw/zinc/42/13/37/331421337.db2.gz	VFBXJKSDCWCOLM-UHFFFAOYSA-N	0	0	278.402	4.065	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC1CCCCC1)C1CC1	ZINC000467830586	331424342	/nfs/dbraw/zinc/42/43/42/331424342.db2.gz	BTRJURDMPNXKIT-UHFFFAOYSA-N	0	0	275.436	4.326	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)CCCCc1ccccc1	ZINC000467831980	331424387	/nfs/dbraw/zinc/42/43/87/331424387.db2.gz	MPOQPBSBTVNYFQ-UHFFFAOYSA-N	0	0	285.431	4.236	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc(C)cc1OCCC	ZINC000467832921	331424393	/nfs/dbraw/zinc/42/43/93/331424393.db2.gz	FCEATVUPACSOME-UHFFFAOYSA-N	0	0	287.403	4.491	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCCCc2ccccc21	ZINC000467836186	331424442	/nfs/dbraw/zinc/42/44/42/331424442.db2.gz	HBLRIXACJHQGPH-UHFFFAOYSA-N	0	0	269.388	4.124	20	30		CIEDRN
CC(C)c1ccc(C(=O)N[C@](C)(C#N)C(C)C)cc1Cl	ZINC000467856155	331424809	/nfs/dbraw/zinc/42/48/09/331424809.db2.gz	ORZARXOXVYWJKE-MRXNPFEDSA-N	0	0	292.810	4.131	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)NCCCCc1ccc(F)c(F)c1	ZINC000467908112	331425600	/nfs/dbraw/zinc/42/56/00/331425600.db2.gz	FFVKSNAXIJDHNO-KRWDZBQOSA-N	0	0	295.373	4.006	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1nc2cc(F)c(F)cc2s1	ZINC000467949305	331425957	/nfs/dbraw/zinc/42/59/57/331425957.db2.gz	PBBRRQZJSUIXOQ-CQSZACIVSA-N	0	0	296.342	4.115	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1nc2cc(F)c(F)cc2s1	ZINC000467949304	331425990	/nfs/dbraw/zinc/42/59/90/331425990.db2.gz	PBBRRQZJSUIXOQ-AWEZNQCLSA-N	0	0	296.342	4.115	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N(C)C1CCC(C)(C)CC1	ZINC000467979470	331426232	/nfs/dbraw/zinc/42/62/32/331426232.db2.gz	VSIOITXHIPHNTB-MRXNPFEDSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N(C)C1CCC(C)(C)CC1	ZINC000467979469	331426275	/nfs/dbraw/zinc/42/62/75/331426275.db2.gz	VSIOITXHIPHNTB-INIZCTEOSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)NCc1cc(Cl)sc1Cl	ZINC000467989226	331426387	/nfs/dbraw/zinc/42/63/87/331426387.db2.gz	ULLZBRUIFLYHSZ-GFCCVEGCSA-N	0	0	292.231	4.273	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H](C)c1cccc(C)c1C	ZINC000468011737	331426673	/nfs/dbraw/zinc/42/66/73/331426673.db2.gz	MTAUKBKAZJHOBY-RHSMWYFYSA-N	0	0	259.393	4.083	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@@H](C)c1ccccc1C(F)(F)F	ZINC000468031600	331427100	/nfs/dbraw/zinc/42/71/00/331427100.db2.gz	RDBRPCNUUVAYIS-NHYWBVRUSA-N	0	0	299.336	4.485	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N(C)C1CCC(CC)CC1	ZINC000468102784	331428666	/nfs/dbraw/zinc/42/86/66/331428666.db2.gz	HSRWWSWQSAJHBD-XUJLQICISA-N	0	0	251.414	4.016	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc2oc(C3CC3)nc2c1	ZINC000468105193	331428669	/nfs/dbraw/zinc/42/86/69/331428669.db2.gz	VZYJOGGVLBQDLT-QGZVFWFLSA-N	0	0	284.359	4.246	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N(CC)Cc1cccc(Cl)c1	ZINC000468117830	331428888	/nfs/dbraw/zinc/42/88/88/331428888.db2.gz	AOZHUCXBWLWOCA-INIZCTEOSA-N	0	0	279.811	4.291	20	30		CIEDRN
C=CCCCNC(=O)c1c(C)c(C)oc1-c1ccccc1	ZINC000468369512	331432971	/nfs/dbraw/zinc/43/29/71/331432971.db2.gz	XWQFNYVVYKXPQK-UHFFFAOYSA-N	0	0	283.371	4.259	20	30		CIEDRN
C=CCCCNC(=O)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1	ZINC000468372534	331433038	/nfs/dbraw/zinc/43/30/38/331433038.db2.gz	LJCZQXKHVYECAU-UONOGXRCSA-N	0	0	298.213	4.179	20	30		CIEDRN
C=CCCCNC(=O)C[C@H]1C[C@@H](C)c2c1cccc2C	ZINC000468374631	331433140	/nfs/dbraw/zinc/43/31/40/331433140.db2.gz	XRHWFALQXFPYSH-HUUCEWRRSA-N	0	0	271.404	4.058	20	30		CIEDRN
C=CCCCNC(=O)[C@@H](c1cccc(Cl)c1)C(C)C	ZINC000468389795	331433482	/nfs/dbraw/zinc/43/34/82/331433482.db2.gz	LYGZZVLWQGCZMJ-OAHLLOKOSA-N	0	0	279.811	4.162	20	30		CIEDRN
C=CCCCNC(=O)c1ccc(-c2ccc(C)o2)s1	ZINC000468402617	331434305	/nfs/dbraw/zinc/43/43/05/331434305.db2.gz	QNFZGFNDCPBLSJ-UHFFFAOYSA-N	0	0	275.373	4.013	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc2cn(C(C)C)nc2c1	ZINC000469207273	331447676	/nfs/dbraw/zinc/44/76/76/331447676.db2.gz	FTFZQUVVLMFBCL-CYBMUJFWSA-N	0	0	285.391	4.158	20	30		CIEDRN
CCCC1(C(=O)Nc2sc(C)c(CC)c2C#N)CCC1	ZINC000469476074	331452459	/nfs/dbraw/zinc/45/24/59/331452459.db2.gz	JIETUNNDHAZDAW-UHFFFAOYSA-N	0	0	290.432	4.400	20	30		CIEDRN
CC(C)[C@H]1CCC[C@H](NC(=O)c2ccc(CC#N)cc2)CC1	ZINC000469478595	331452593	/nfs/dbraw/zinc/45/25/93/331452593.db2.gz	UVKAYSALKALIGY-WMZOPIPTSA-N	0	0	298.430	4.087	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)Cc1cc(C)cc(C)c1	ZINC000470105122	331471818	/nfs/dbraw/zinc/47/18/18/331471818.db2.gz	NDTUSDAKPKTECR-UHFFFAOYSA-N	0	0	271.404	4.030	20	30		CIEDRN
CC1=C(C(=O)NC2(C#N)CCC(C(C)(C)C)CC2)CCC1	ZINC000470193904	331474963	/nfs/dbraw/zinc/47/49/63/331474963.db2.gz	MEINDQBWDNGZNA-UHFFFAOYSA-N	0	0	288.435	4.102	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)c2cc(C(C)C)no2)CCCC1(C)C	ZINC000470271185	331477189	/nfs/dbraw/zinc/47/71/89/331477189.db2.gz	RXRHXURAWYIJRT-HNNXBMFYSA-N	0	0	290.407	4.005	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)c2ccc(F)c(F)c2)CCCC1(C)C	ZINC000470270828	331477251	/nfs/dbraw/zinc/47/72/51/331477251.db2.gz	NUGCOSRCIWRBAE-HNNXBMFYSA-N	0	0	293.357	4.172	20	30		CIEDRN
C=CC[C@H]1N(C(=O)C[C@@H]2C=CCCC2)CCCC1(C)C	ZINC000470293501	331478347	/nfs/dbraw/zinc/47/83/47/331478347.db2.gz	REBCVEPGEUWKBH-HZPDHXFCSA-N	0	0	275.436	4.326	20	30		CIEDRN
C=CC[C@H]1N(C(=O)CCC2CCC2)CCCC1(C)C	ZINC000470296091	331478496	/nfs/dbraw/zinc/47/84/96/331478496.db2.gz	KTIORIIUGIUWSO-OAHLLOKOSA-N	0	0	263.425	4.160	20	30		CIEDRN
C=C(C)[C@H](CC(=O)Nc1ccc(C2CCC2)cc1)OCC	ZINC000470475256	331483513	/nfs/dbraw/zinc/48/35/13/331483513.db2.gz	HTGFMHBTWSSJSG-KRWDZBQOSA-N	0	0	287.403	4.264	20	30		CIEDRN
N#Cc1ccc(C(=O)Nc2ccc(C3CCC3)cc2)s1	ZINC000470511673	331484337	/nfs/dbraw/zinc/48/43/37/331484337.db2.gz	QMHLGSUSZLSESK-UHFFFAOYSA-N	0	0	282.368	4.140	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)[C@@H](C)c1ccsc1	ZINC000470646899	331486911	/nfs/dbraw/zinc/48/69/11/331486911.db2.gz	NJKUAJVWROHQHN-HNNXBMFYSA-N	0	0	299.439	4.457	20	30		CIEDRN
Cc1ccc([C@H]2OCCC[C@H]2Nc2ccc(C#N)cc2)cc1	ZINC000470874649	331493453	/nfs/dbraw/zinc/49/34/53/331493453.db2.gz	XCAUSKBJHOAKDE-RTBURBONSA-N	0	0	292.382	4.199	20	30		CIEDRN
Cc1cc(/C=C\c2ccc(C#N)cn2)ccc1Br	ZINC000470874159	331493509	/nfs/dbraw/zinc/49/35/09/331493509.db2.gz	UHYXWPMUPCRXFQ-DJWKRKHSSA-N	0	0	299.171	4.195	20	30		CIEDRN
Cc1cc(Sc2ccc(C#N)cc2F)nc(C(C)C)n1	ZINC000471047550	331499513	/nfs/dbraw/zinc/49/95/13/331499513.db2.gz	KBACMQRCYPXJPM-UHFFFAOYSA-N	0	0	287.363	4.070	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(F)cc1	ZINC000471128206	331501797	/nfs/dbraw/zinc/50/17/97/331501797.db2.gz	AYDYZTUXGVTFGN-UHFFFAOYSA-N	0	0	298.361	4.436	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)[C@@H]1CCCC(C)(C)C1	ZINC000471169824	331502915	/nfs/dbraw/zinc/50/29/15/331502915.db2.gz	QZNAHERLDKVHOI-CQSZACIVSA-N	0	0	278.440	4.134	20	30		CIEDRN
Cn1ccc2cccc(NCc3ccc(Cl)cc3C#N)c21	ZINC000471542419	331510103	/nfs/dbraw/zinc/51/01/03/331510103.db2.gz	ZIIKRFCOKCTFDF-UHFFFAOYSA-N	0	0	295.773	4.315	20	30		CIEDRN
C=CCCCCNC(=O)C1(c2ccc(F)cc2)CCCC1	ZINC000471673249	331514801	/nfs/dbraw/zinc/51/48/01/331514801.db2.gz	DRTLCDJPRBMGGJ-UHFFFAOYSA-N	0	0	289.394	4.110	20	30		CIEDRN
C=CCCCCNC(=O)C(C)(C)c1ccc(Cl)cc1	ZINC000471675047	331514980	/nfs/dbraw/zinc/51/49/80/331514980.db2.gz	ZSTMQJPOIJRDGT-UHFFFAOYSA-N	0	0	279.811	4.090	20	30		CIEDRN
C=CCCCCNC(=O)CSCc1ccc(Cl)cc1	ZINC000471676348	331515156	/nfs/dbraw/zinc/51/51/56/331515156.db2.gz	BPARCRMHARQKCD-UHFFFAOYSA-N	0	0	297.851	4.046	20	30		CIEDRN
C=CCCCCNC(=O)c1cc(Cl)sc1Cl	ZINC000471679060	331515216	/nfs/dbraw/zinc/51/52/16/331515216.db2.gz	MYRFHMQFPCAHKU-UHFFFAOYSA-N	0	0	278.204	4.141	20	30		CIEDRN
C=CCCCCNC(=O)CCc1ccc(-c2ccccc2)[nH]1	ZINC000471679699	331515221	/nfs/dbraw/zinc/51/52/21/331515221.db2.gz	PIXFKCWPESXFJT-UHFFFAOYSA-N	0	0	296.414	4.087	20	30		CIEDRN
C=CCCCCNC(=O)[C@@H](C)Sc1ccc(Cl)cc1	ZINC000471679859	331515243	/nfs/dbraw/zinc/51/52/43/331515243.db2.gz	QELKWKUAKZCTTB-GFCCVEGCSA-N	0	0	297.851	4.293	20	30		CIEDRN
C=CCCCCNC(=O)c1ccc(SC(C)C)cc1	ZINC000471684264	331515562	/nfs/dbraw/zinc/51/55/62/331515562.db2.gz	FBPGJESELUYDCF-UHFFFAOYSA-N	0	0	277.433	4.273	20	30		CIEDRN
C=CCCCCNC(=O)[C@H]1C[C@H]1c1ccc2ccccc2c1	ZINC000471699863	331516379	/nfs/dbraw/zinc/51/63/79/331516379.db2.gz	DGQKHPISXHNLIB-OALUTQOASA-N	0	0	293.410	4.416	20	30		CIEDRN
C=CCCCCNC(=O)Cc1cc(Cl)ccc1Cl	ZINC000471701592	331516595	/nfs/dbraw/zinc/51/65/95/331516595.db2.gz	PXRJOJGPJLJJJR-UHFFFAOYSA-N	0	0	286.202	4.008	20	30		CIEDRN
CCN(Cc1ccc(C#N)cc1F)c1ccc2[nH]ccc2c1	ZINC000471812972	331521585	/nfs/dbraw/zinc/52/15/85/331521585.db2.gz	XTVAVLOGFWYAQI-UHFFFAOYSA-N	0	0	293.345	4.205	20	30		CIEDRN
C[C@@H](CC(=O)N(C)Cc1ccc(C#N)cc1)C1CCCCC1	ZINC000510737606	332914568	/nfs/dbraw/zinc/91/45/68/332914568.db2.gz	SAMIFAWOOHSGKQ-HNNXBMFYSA-N	0	0	298.430	4.123	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)[C@H](C)c1ccc(Cl)c(Cl)c1	ZINC000472164157	331530698	/nfs/dbraw/zinc/53/06/98/331530698.db2.gz	SNAFNKFTHGHESE-NXEZZACHSA-N	0	0	286.202	4.178	20	30		CIEDRN
CCCc1cc(C(=O)Nc2ccccc2C#N)ccc1Cl	ZINC000472817928	331543568	/nfs/dbraw/zinc/54/35/68/331543568.db2.gz	IUAFQYMPJYDOJG-UHFFFAOYSA-N	0	0	298.773	4.416	20	30		CIEDRN
C=CCCCCNC(=O)NCc1csc2ccccc12	ZINC000472824331	331543889	/nfs/dbraw/zinc/54/38/89/331543889.db2.gz	FMPRKLTWIRPTMR-UHFFFAOYSA-N	0	0	288.416	4.057	20	30		CIEDRN
C=CCCCCNC(=O)N1CCC[C@@H]1c1ccc(C)s1	ZINC000472839912	331544219	/nfs/dbraw/zinc/54/42/19/331544219.db2.gz	SEKFASJJDXVANW-CQSZACIVSA-N	0	0	292.448	4.259	20	30		CIEDRN
C=CCCCCNC(=O)N(C)[C@H](C)c1ccc(F)c(F)c1	ZINC000472851591	331544635	/nfs/dbraw/zinc/54/46/35/331544635.db2.gz	PVFQUXCGVWCBKC-GFCCVEGCSA-N	0	0	296.361	4.024	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CCC[C@](C)(c2ccccc2)C1	ZINC000473590501	331554146	/nfs/dbraw/zinc/55/41/46/331554146.db2.gz	PMZFQBOXLVZIEM-MOPGFXCFSA-N	0	0	285.431	4.169	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@](C)(c2ccccc2)C1	ZINC000473590505	331554199	/nfs/dbraw/zinc/55/41/99/331554199.db2.gz	PMZFQBOXLVZIEM-RBUKOAKNSA-N	0	0	285.431	4.169	20	30		CIEDRN
C=CCCCCNC(=O)Nc1ccc(OCCC)cc1C	ZINC000473659667	331554997	/nfs/dbraw/zinc/55/49/97/331554997.db2.gz	LDMVUPSCUKKURH-UHFFFAOYSA-N	0	0	290.407	4.262	20	30		CIEDRN
CC(C)(C#N)c1ccc(C(=O)Nc2cccc(Cl)c2)cc1	ZINC000474077343	331568166	/nfs/dbraw/zinc/56/81/66/331568166.db2.gz	ABLSTJUSWXOPQI-UHFFFAOYSA-N	0	0	298.773	4.393	20	30		CIEDRN
C=CCCCCNC(=O)N1CC[C@H](C)C[C@@H]1c1ccco1	ZINC000474076523	331568206	/nfs/dbraw/zinc/56/82/06/331568206.db2.gz	BQGIFKGIEAULKA-LSDHHAIUSA-N	0	0	290.407	4.119	20	30		CIEDRN
C=CCCCCNC(=O)N1CC[C@@H](C)C[C@H]1c1ccco1	ZINC000474076520	331568210	/nfs/dbraw/zinc/56/82/10/331568210.db2.gz	BQGIFKGIEAULKA-CABCVRRESA-N	0	0	290.407	4.119	20	30		CIEDRN
C=CCC[C@H](C(=O)N[C@H]1CC[C@@H](C)C1)c1ccccc1	ZINC000474127714	331572609	/nfs/dbraw/zinc/57/26/09/331572609.db2.gz	WXTJKYMCQJOGHH-PVAVHDDUSA-N	0	0	271.404	4.041	20	30		CIEDRN
C[C@@H](Nc1ncc(C#N)cc1Cl)[C@H](C)c1ccccc1	ZINC000474185754	331574534	/nfs/dbraw/zinc/57/45/34/331574534.db2.gz	RIGVALUYAKTHFP-NWDGAFQWSA-N	0	0	285.778	4.211	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CC[C@H](Cc2ccccc2)C1	ZINC000474327313	331580387	/nfs/dbraw/zinc/58/03/87/331580387.db2.gz	JMULCSRROBUNBJ-CGTJXYLNSA-N	0	0	285.431	4.116	20	30		CIEDRN
C=CCCC1(C(=O)NC[C@@H](CC)c2ccccc2)CC1	ZINC000474423607	331586408	/nfs/dbraw/zinc/58/64/08/331586408.db2.gz	CPTLSQULWVJDCI-OAHLLOKOSA-N	0	0	271.404	4.043	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@@H]1CCCC[C@@H]1CC	ZINC000474432081	331586727	/nfs/dbraw/zinc/58/67/27/331586727.db2.gz	PICZHYJHDDUTEZ-GOEBONIOSA-N	0	0	291.460	4.479	20	30		CIEDRN
N#CC[C@H](CC(=O)NCCCC1CCCC1)c1ccccc1	ZINC000474696323	331594614	/nfs/dbraw/zinc/59/46/14/331594614.db2.gz	JKTQQJJBNGMFAK-GOSISDBHSA-N	0	0	298.430	4.161	20	30		CIEDRN
C=CCCC(=O)Nc1cccc(COC(C)(C)C)c1C	ZINC000474769589	331597453	/nfs/dbraw/zinc/59/74/53/331597453.db2.gz	SUBBKXNXUSVBAG-UHFFFAOYSA-N	0	0	275.392	4.215	20	30		CIEDRN
Cc1cc(Cl)ccc1OCc1ccc(F)cc1C#N	ZINC000303213585	332919165	/nfs/dbraw/zinc/91/91/65/332919165.db2.gz	SHAWEQKXWMMAQY-UHFFFAOYSA-N	0	0	275.710	4.238	20	30		CIEDRN
C=CCCC(=O)N(CC(C)C)c1ccc(Cl)cc1	ZINC000475061395	331613501	/nfs/dbraw/zinc/61/35/01/331613501.db2.gz	JKMRZWJIZPTELG-UHFFFAOYSA-N	0	0	265.784	4.295	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](C)c1cc2cccc(F)c2o1	ZINC000475084189	331614115	/nfs/dbraw/zinc/61/41/15/331614115.db2.gz	MMXHQKSEYJSPPJ-RYUDHWBXSA-N	0	0	289.350	4.351	20	30		CIEDRN
C=CCCC1(C(=O)N[C@H](C)c2ccc(F)c(Cl)c2)CC1	ZINC000475106034	331615309	/nfs/dbraw/zinc/61/53/09/331615309.db2.gz	GWCGFVAQCUFXCN-LLVKDONJSA-N	0	0	295.785	4.403	20	30		CIEDRN
C[C@H]1CCC[C@H](CNC(=O)c2ccc(C(C)(C)C#N)cc2)C1	ZINC000475118507	331615476	/nfs/dbraw/zinc/61/54/76/331615476.db2.gz	AARQICQSBYLIGX-GJZGRUSLSA-N	0	0	298.430	4.044	20	30		CIEDRN
C=CCN(C(=O)N[C@@H](CC1CCC1)c1ccccc1)C1CC1	ZINC000498360950	331616120	/nfs/dbraw/zinc/61/61/20/331616120.db2.gz	UEBTXPHFEBJUMB-SFHVURJKSA-N	0	0	298.430	4.278	20	30		CIEDRN
C[C@@H]1CCCC[C@@H]1CNC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000475177147	331617034	/nfs/dbraw/zinc/61/70/34/331617034.db2.gz	YBTQFVDMBLWQLZ-GDBMZVCRSA-N	0	0	298.430	4.044	20	30		CIEDRN
CCC[C@](C)(CC)C(=O)Nc1cc(C#N)ccc1C	ZINC000475383270	331630297	/nfs/dbraw/zinc/63/02/97/331630297.db2.gz	LWHVEUUCNPYZCP-INIZCTEOSA-N	0	0	258.365	4.022	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@@H]1CCCC1(C)C	ZINC000475507219	331634242	/nfs/dbraw/zinc/63/42/42/331634242.db2.gz	DNGZTKITHVFFMI-AWEZNQCLSA-N	0	0	251.414	4.018	20	30		CIEDRN
C=C(C)[C@H](NC(=O)[C@@H]1C[C@]1(C)CC)c1ccc(F)c(F)c1	ZINC000475661215	331640502	/nfs/dbraw/zinc/64/05/02/331640502.db2.gz	LQUMMJSJCIHKEI-NUTKFTJISA-N	0	0	293.357	4.134	20	30		CIEDRN
C=CCCC1(C(=O)N2CCC[C@H](Cc3ccccc3)C2)CC1	ZINC000475660934	331640531	/nfs/dbraw/zinc/64/05/31/331640531.db2.gz	ZHRNVVIOBXYZIQ-GOSISDBHSA-N	0	0	297.442	4.214	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)c1ccc(Cl)c(C)c1	ZINC000475729362	331643501	/nfs/dbraw/zinc/64/35/01/331643501.db2.gz	FHWZLTSAFPZIFM-UHFFFAOYSA-N	0	0	292.810	4.241	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)C[C@H](C)CC(C)C	ZINC000475728376	331643555	/nfs/dbraw/zinc/64/35/55/331643555.db2.gz	ADJOGDALTPBSPE-CQSZACIVSA-N	0	0	266.429	4.037	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](C)c1cc2cccc(F)c2o1	ZINC000475750395	331644832	/nfs/dbraw/zinc/64/48/32/331644832.db2.gz	UFNNQEVFBXSQIC-NSHDSACASA-N	0	0	275.323	4.105	20	30		CIEDRN
C=CCOc1ccccc1CNC(=O)[C@@](C)(CC)CCC	ZINC000475942091	331649232	/nfs/dbraw/zinc/64/92/32/331649232.db2.gz	WGPJAUSZONEXCM-SFHVURJKSA-N	0	0	289.419	4.084	20	30		CIEDRN
Cc1ccc(C#N)cc1OCc1cccc(C(F)F)c1	ZINC000475992953	331650737	/nfs/dbraw/zinc/65/07/37/331650737.db2.gz	BEUWNIJWZJNFBR-UHFFFAOYSA-N	0	0	273.282	4.383	20	30		CIEDRN
C=CCCC1(C(=O)N(C)CCc2ccc(Cl)cc2)CC1	ZINC000476040687	331651834	/nfs/dbraw/zinc/65/18/34/331651834.db2.gz	KWLCTLWCTNVNTN-UHFFFAOYSA-N	0	0	291.822	4.087	20	30		CIEDRN
C=CCCCCCN(C)C(=O)C[C@@H](CC#N)c1ccccc1	ZINC000476089967	331654787	/nfs/dbraw/zinc/65/47/87/331654787.db2.gz	KGWGZPCLKJENQU-GOSISDBHSA-N	0	0	298.430	4.279	20	30		CIEDRN
CC[C@H]1CCC[C@@H](NC(=O)c2ccc(C(C)(C)C#N)cc2)C1	ZINC000476095441	331654916	/nfs/dbraw/zinc/65/49/16/331654916.db2.gz	MBOADQZNIJZZMM-WMLDXEAASA-N	0	0	298.430	4.186	20	30		CIEDRN
CC[C@@H](C)C[C@H](C)NC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000476102639	331655069	/nfs/dbraw/zinc/65/50/69/331655069.db2.gz	YMPNFGCIQIUPRB-KGLIPLIRSA-N	0	0	286.419	4.042	20	30		CIEDRN
C[C@@H]1CCC[C@@H](C)N(C(=O)c2ccc(C(C)(C)C#N)cc2)C1	ZINC000476110425	331655317	/nfs/dbraw/zinc/65/53/17/331655317.db2.gz	BUOMGAZEWFKDEK-HUUCEWRRSA-N	0	0	298.430	4.138	20	30		CIEDRN
C=CCCC1(C(=O)NC[C@@H](C)Sc2ccccc2)CC1	ZINC000476126091	331655688	/nfs/dbraw/zinc/65/56/88/331655688.db2.gz	APEXRIYNBLOENX-CQSZACIVSA-N	0	0	289.444	4.030	20	30		CIEDRN
C=CCCC1(C(=O)N2CC[C@@H](Cc3ccccc3)[C@H]2C)CC1	ZINC000476237573	331658179	/nfs/dbraw/zinc/65/81/79/331658179.db2.gz	MKTJAJNJAOJIIA-AEFFLSMTSA-N	0	0	297.442	4.213	20	30		CIEDRN
CCC[C@@H]1CCCN(C(=O)C[C@@H](CC#N)c2ccccc2)C1	ZINC000476297897	331660504	/nfs/dbraw/zinc/66/05/04/331660504.db2.gz	DLBWPQDJDJVUAR-SJLPKXTDSA-N	0	0	298.430	4.113	20	30		CIEDRN
CCC1(CNC(=O)C[C@H](CC#N)c2ccccc2)CCCC1	ZINC000476336181	331661846	/nfs/dbraw/zinc/66/18/46/331661846.db2.gz	NAAKPAYNYQZAMP-KRWDZBQOSA-N	0	0	298.430	4.161	20	30		CIEDRN
Cc1cc(C(=O)Nc2cccc(C#N)c2C)c(C)cc1Cl	ZINC000476434834	331664127	/nfs/dbraw/zinc/66/41/27/331664127.db2.gz	WNJONMAWQVFYRP-UHFFFAOYSA-N	0	0	298.773	4.389	20	30		CIEDRN
CC(C)c1cnc(S[C@@H](C)c2ccc(C#N)cc2)n1C	ZINC000476531660	331665860	/nfs/dbraw/zinc/66/58/60/331665860.db2.gz	HBLQMJAPMGGCHY-LBPRGKRZSA-N	0	0	285.416	4.268	20	30		CIEDRN
CC(C)c1cnc(S[C@@H](C#N)C2CCCCC2)n1C	ZINC000476546091	331666274	/nfs/dbraw/zinc/66/62/74/331666274.db2.gz	MJXZPIFGTNDECF-AWEZNQCLSA-N	0	0	277.437	4.108	20	30		CIEDRN
CC[C@H](c1ccc(Cl)cc1)N1CCC(F)(C#N)CC1	ZINC000510964453	332922306	/nfs/dbraw/zinc/92/23/06/332922306.db2.gz	BTQIPULQUXQUEJ-CQSZACIVSA-N	0	0	280.774	4.119	20	30		CIEDRN
C=CCCC1(C(=O)N[C@@H]2CC[C@@H](Cc3ccccc3)C2)CC1	ZINC000476927051	331671387	/nfs/dbraw/zinc/67/13/87/331671387.db2.gz	VXOIZHWTFOXBKI-ZWKOTPCHSA-N	0	0	297.442	4.260	20	30		CIEDRN
C=C(C)CSCCOc1ccc(SC)cc1	ZINC000477013400	331672594	/nfs/dbraw/zinc/67/25/94/331672594.db2.gz	WSMMLYKYAHYWAX-UHFFFAOYSA-N	0	0	254.420	4.097	20	30		CIEDRN
CCC[C@H](CC)SCCC(=O)Nc1ccccc1C#N	ZINC000477045145	331674051	/nfs/dbraw/zinc/67/40/51/331674051.db2.gz	DMPUHTNUXPNLKI-AWEZNQCLSA-N	0	0	290.432	4.199	20	30		CIEDRN
CCOC(=O)c1cccc(SCCCC(C)(C)C#N)c1	ZINC000477049389	331674253	/nfs/dbraw/zinc/67/42/53/331674253.db2.gz	MMHCQKZTFGUVNH-UHFFFAOYSA-N	0	0	291.416	4.285	20	30		CIEDRN
CCOC(=O)c1cccc(SCc2cccc(C#N)c2)c1	ZINC000477066041	331674914	/nfs/dbraw/zinc/67/49/14/331674914.db2.gz	MVXJJUCOPFYALW-UHFFFAOYSA-N	0	0	297.379	4.027	20	30		CIEDRN
C=CCCC1(C(=O)N2C[C@H](c3ccc(C)cc3)C[C@@H]2C)CC1	ZINC000477095630	331676143	/nfs/dbraw/zinc/67/61/43/331676143.db2.gz	YQBGVBNNNXLVDO-FUHWJXTLSA-N	0	0	297.442	4.446	20	30		CIEDRN
N#Cc1cccc(CSCc2ccn(C3CCCC3)n2)c1	ZINC000477344752	331682321	/nfs/dbraw/zinc/68/23/21/331682321.db2.gz	ADBGLBJQHMDXCX-UHFFFAOYSA-N	0	0	297.427	4.303	20	30		CIEDRN
C=CCCC(=O)Nc1cc(-c2ccc(C)o2)ccc1C	ZINC000477528483	331686466	/nfs/dbraw/zinc/68/64/66/331686466.db2.gz	NYUGAJKGBMMYOU-UHFFFAOYSA-N	0	0	269.344	4.468	20	30		CIEDRN
N#Cc1ccc(SCC2CCCCC2)c([N+](=O)[O-])c1	ZINC000477592822	331687490	/nfs/dbraw/zinc/68/74/90/331687490.db2.gz	YUAKXMATIXFAPR-UHFFFAOYSA-N	0	0	276.361	4.139	20	30		CIEDRN
C=C[C@H](CC(=O)N(CC)[C@@H](C)C(F)(F)F)c1ccccc1	ZINC000477944910	331695228	/nfs/dbraw/zinc/69/52/28/331695228.db2.gz	CWGGCOLUBZHDRA-QWHCGFSZSA-N	0	0	299.336	4.146	20	30		CIEDRN
CCCn1ccc(-c2nc3cc(C#N)ccc3n2CCC)c1	ZINC000478204633	331700501	/nfs/dbraw/zinc/70/05/01/331700501.db2.gz	GFQDBBFVPYPMJS-UHFFFAOYSA-N	0	0	292.386	4.196	20	30		CIEDRN
C=CCC1(C(=O)NCc2ccc(Cl)cc2Cl)CCC1	ZINC000478253602	331701953	/nfs/dbraw/zinc/70/19/53/331701953.db2.gz	NXTWUWFYUWHKCJ-UHFFFAOYSA-N	0	0	298.213	4.356	20	30		CIEDRN
CCc1ccc(NC(=O)NCC(C)(C)CCC#N)cc1C	ZINC000478568204	331708748	/nfs/dbraw/zinc/70/87/48/331708748.db2.gz	AXDXOLNWPSIAGI-UHFFFAOYSA-N	0	0	287.407	4.009	20	30		CIEDRN
C=CCC1(C(=O)N[C@H](C)CCCC(C)C)CCC1	ZINC000478581708	331709100	/nfs/dbraw/zinc/70/91/00/331709100.db2.gz	PQNUYQXNKRYKCL-CQSZACIVSA-N	0	0	251.414	4.064	20	30		CIEDRN
Cc1ccc2oc(SCc3ccc(C#N)c(F)c3)nc2c1	ZINC000478723766	331712414	/nfs/dbraw/zinc/71/24/14/331712414.db2.gz	LDHDTGKDAXWWMM-UHFFFAOYSA-N	0	0	298.342	4.439	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc2occ(C)c2c1	ZINC000479058189	331719313	/nfs/dbraw/zinc/71/93/13/331719313.db2.gz	KBNOCVFSXJYDEX-UHFFFAOYSA-N	0	0	269.344	4.448	20	30		CIEDRN
C=CCN(C(=O)[C@H]1CC12CCCCC2)c1ccccc1	ZINC000479080485	331719838	/nfs/dbraw/zinc/71/98/38/331719838.db2.gz	SFRMCJOJTABDFX-MRXNPFEDSA-N	0	0	269.388	4.176	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1cc2c(s1)-c1ccccc1CC2	ZINC000479213934	331721880	/nfs/dbraw/zinc/72/18/80/331721880.db2.gz	KHGQLVQOAZLGSK-UHFFFAOYSA-N	0	0	297.423	4.162	20	30		CIEDRN
CSc1ccc(C)c(NCC#Cc2ccccc2)c1	ZINC000479478949	331732510	/nfs/dbraw/zinc/73/25/10/331732510.db2.gz	JGCRHHIYDNQOTI-UHFFFAOYSA-N	0	0	267.397	4.181	20	30		CIEDRN
CCc1ccc(NCc2ccc(C#N)c(F)c2)cc1F	ZINC000479493029	331733225	/nfs/dbraw/zinc/73/32/25/331733225.db2.gz	YXBNFSMXAUANSO-UHFFFAOYSA-N	0	0	272.298	4.011	20	30		CIEDRN
C=CCCCC(=O)N(Cc1ccc(CC)cc1)C1CC1	ZINC000479534999	331735776	/nfs/dbraw/zinc/73/57/76/331735776.db2.gz	YSHUWHSEAUHWBG-UHFFFAOYSA-N	0	0	271.404	4.096	20	30		CIEDRN
C=CCCCC(=O)N(CCC)[C@H]1CCc2ccccc21	ZINC000479573181	331738287	/nfs/dbraw/zinc/73/82/87/331738287.db2.gz	HDNBKKKWKUYAEE-KRWDZBQOSA-N	0	0	271.404	4.269	20	30		CIEDRN
C=CCOCCCS[C@H](C)c1ccccc1C	ZINC000479594941	331739785	/nfs/dbraw/zinc/73/97/85/331739785.db2.gz	SLOKZMWAYHLHIA-CQSZACIVSA-N	0	0	250.407	4.382	20	30		CIEDRN
CC#CCCCC(=O)N[C@H](C)C1(c2ccccc2)CCCC1	ZINC000479773522	331745529	/nfs/dbraw/zinc/74/55/29/331745529.db2.gz	QJFURRNCINAAEE-QGZVFWFLSA-N	0	0	297.442	4.197	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@@H](Cc3ccccc3)[C@H]2C)CCC1	ZINC000479869514	331749695	/nfs/dbraw/zinc/74/96/95/331749695.db2.gz	ZDJHAHHJWBEHPW-AEFFLSMTSA-N	0	0	297.442	4.213	20	30		CIEDRN
C=CCC1(C(=O)NCCCc2cccc(Cl)c2)CCC1	ZINC000479931416	331752084	/nfs/dbraw/zinc/75/20/84/331752084.db2.gz	MBRGDBILSOLAGG-UHFFFAOYSA-N	0	0	291.822	4.135	20	30		CIEDRN
C=C(CC)CNc1ccccc1-c1csc(C)n1	ZINC000480149664	331759964	/nfs/dbraw/zinc/75/99/64/331759964.db2.gz	OYAHEFLMLOMWBI-UHFFFAOYSA-N	0	0	258.390	4.497	20	30		CIEDRN
C=CCCCC(=O)N[C@H](C)[C@H](C)C1CCCCC1	ZINC000480356556	331769504	/nfs/dbraw/zinc/76/95/04/331769504.db2.gz	VIGBSIFAAPJUKY-UONOGXRCSA-N	0	0	251.414	4.064	20	30		CIEDRN
COCCC[C@@H](Cc1ccccc1)Nc1ccc(C#N)cc1	ZINC000480557813	331777692	/nfs/dbraw/zinc/77/76/92/331777692.db2.gz	UFCUZWGLDOZHGP-IBGZPJMESA-N	0	0	294.398	4.008	20	30		CIEDRN
C=CCn1c(S[C@@H](C)CC)nnc1-c1cccs1	ZINC000481401872	331805876	/nfs/dbraw/zinc/80/58/76/331805876.db2.gz	LPVSQALSKKRLLP-JTQLQIEISA-N	0	0	279.434	4.083	20	30		CIEDRN
C=C(C)[C@H](N[C@H](C)c1ncc(C)o1)c1ccc(F)c(F)c1	ZINC000481578101	331809620	/nfs/dbraw/zinc/80/96/20/331809620.db2.gz	BXWFDOPUQHVAEU-ABAIWWIYSA-N	0	0	292.329	4.229	20	30		CIEDRN
CCC(CC)N(CC(C)C)C(=O)Nc1ccc(C#N)cc1	ZINC000481737086	331814402	/nfs/dbraw/zinc/81/44/02/331814402.db2.gz	JWEQHMWTWWNUEF-UHFFFAOYSA-N	0	0	287.407	4.237	20	30		CIEDRN
CCC(C)(C)c1ccc(C(=O)N[C@H](C#N)C(C)(C)C)cc1	ZINC000511280453	332930048	/nfs/dbraw/zinc/93/00/48/332930048.db2.gz	ZJYLDAROYQWYOY-OAHLLOKOSA-N	0	0	286.419	4.042	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)Nc1cccc(F)c1	ZINC000481988164	331820473	/nfs/dbraw/zinc/82/04/73/331820473.db2.gz	KIGLJIWNBPXGFA-UHFFFAOYSA-N	0	0	290.382	4.426	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)c1cccc(F)c1F	ZINC000482883323	331850323	/nfs/dbraw/zinc/85/03/23/331850323.db2.gz	YELFYWJBADSVLR-UHFFFAOYSA-N	0	0	293.357	4.173	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)c1ccc2[nH]ccc2c1	ZINC000482883881	331850468	/nfs/dbraw/zinc/85/04/68/331850468.db2.gz	ZQOZSYBFAPGYOQ-UHFFFAOYSA-N	0	0	296.414	4.376	20	30		CIEDRN
C=CCCC1(C(=O)N(C)c2nc3ccccc3s2)CC1	ZINC000483171091	331861792	/nfs/dbraw/zinc/86/17/92/331861792.db2.gz	ULYAMNNMPXMSKJ-UHFFFAOYSA-N	0	0	286.400	4.006	20	30		CIEDRN
Cc1ccc2c(c1)CN(Cc1ccc(Cl)cc1C#N)C2	ZINC000483335249	331870211	/nfs/dbraw/zinc/87/02/11/331870211.db2.gz	HRKDHEVOSMCWCH-UHFFFAOYSA-N	0	0	282.774	4.036	20	30		CIEDRN
C=CCCC1(C(=O)N2CCC[C@H]2Cc2ccc(C)cc2)CC1	ZINC000483530509	331878714	/nfs/dbraw/zinc/87/87/14/331878714.db2.gz	JUIWDZUOZNJCMH-SFHVURJKSA-N	0	0	297.442	4.275	20	30		CIEDRN
Cc1cc(C(=O)N[C@@](C)(C#N)C(C)(C)C)c(C)cc1Cl	ZINC000483986659	331890840	/nfs/dbraw/zinc/89/08/40/331890840.db2.gz	WLQBQGVWEXRDGG-INIZCTEOSA-N	0	0	292.810	4.015	20	30		CIEDRN
C[C@@H](NCC#Cc1ccccc1)c1c(F)cccc1Cl	ZINC000484075593	331892259	/nfs/dbraw/zinc/89/22/59/331892259.db2.gz	KUGLKGSMLZXJPR-CYBMUJFWSA-N	0	0	287.765	4.181	20	30		CIEDRN
Cc1cccc2ncnc(Sc3ccc(C#N)cc3F)c12	ZINC000484828678	331905946	/nfs/dbraw/zinc/90/59/46/331905946.db2.gz	KADSCZPEYYYGBR-UHFFFAOYSA-N	0	0	295.342	4.100	20	30		CIEDRN
C=CCCC(=O)N1C[C@H](c2ccccc2)[C@H]2CCCC[C@@H]21	ZINC000485560831	331916766	/nfs/dbraw/zinc/91/67/66/331916766.db2.gz	RBRMLLNKYSGRNW-KURKYZTESA-N	0	0	283.415	4.137	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000485578816	331917737	/nfs/dbraw/zinc/91/77/37/331917737.db2.gz	DCEAXYAGLZHEKZ-ZDUSSCGKSA-N	0	0	298.308	4.278	20	30		CIEDRN
Cc1cc(CSC[C@H](C)C(F)(F)F)ccc1C#N	ZINC000485580339	331917823	/nfs/dbraw/zinc/91/78/23/331917823.db2.gz	GWVZFXJJMXGIFM-JTQLQIEISA-N	0	0	273.323	4.298	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)Cc1c(C)cccc1Cl	ZINC000485784033	331923673	/nfs/dbraw/zinc/92/36/73/331923673.db2.gz	MFIDZILTEKWHAR-UHFFFAOYSA-N	0	0	298.773	4.010	20	30		CIEDRN
CCOc1c(Cl)cccc1CNc1ccc(C#N)cc1	ZINC000485971102	331927970	/nfs/dbraw/zinc/92/79/70/331927970.db2.gz	VCRCTNOALFTLJI-UHFFFAOYSA-N	0	0	286.762	4.222	20	30		CIEDRN
CCCCOc1ccc(/C=C\c2ncccc2C#N)cc1	ZINC000486080357	331930845	/nfs/dbraw/zinc/93/08/45/331930845.db2.gz	ZLNXSZAZMYEZKN-FLIBITNWSA-N	0	0	278.355	4.303	20	30		CIEDRN
N#Cc1cccnc1/C=C\c1csc(Cl)c1Cl	ZINC000486080416	331931098	/nfs/dbraw/zinc/93/10/98/331931098.db2.gz	VUOSVKRYHOLKRN-ARJAWSKDSA-N	0	0	281.167	4.492	20	30		CIEDRN
O=C(c1ccc(NCC#Cc2ccccc2)cc1)C1CCC1	ZINC000486187868	331933125	/nfs/dbraw/zinc/93/31/25/331933125.db2.gz	DEKBDCMOVFCDTJ-UHFFFAOYSA-N	0	0	289.378	4.133	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N1CCCCC[C@H]1C	ZINC000486231563	331933749	/nfs/dbraw/zinc/93/37/49/331933749.db2.gz	NHFNELUKDCQXIT-CQSZACIVSA-N	0	0	289.444	4.369	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1sc(CCC)nc1C	ZINC000486348956	331935466	/nfs/dbraw/zinc/93/54/66/331935466.db2.gz	XSFUXMXPHYFERT-NSHDSACASA-N	0	0	295.452	4.270	20	30		CIEDRN
N#Cc1ccc(CNc2csc3ccccc23)s1	ZINC000486514815	331938929	/nfs/dbraw/zinc/93/89/29/331938929.db2.gz	DZURJWXKMLWVTB-UHFFFAOYSA-N	0	0	270.382	4.447	20	30		CIEDRN
CC(C)(C)CN(C(=O)c1sccc1C#N)c1ccccc1	ZINC000486612890	331940498	/nfs/dbraw/zinc/94/04/98/331940498.db2.gz	YRTCLOQWJMRUNY-UHFFFAOYSA-N	0	0	298.411	4.313	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1cccc(Cl)c1C	ZINC000486755261	331943950	/nfs/dbraw/zinc/94/39/50/331943950.db2.gz	PBSJEQCIATYBAS-GFCCVEGCSA-N	0	0	278.783	4.221	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1ccc(C)cc1Cl	ZINC000486769290	331944138	/nfs/dbraw/zinc/94/41/38/331944138.db2.gz	FEZPOCVAYZFPKC-GFCCVEGCSA-N	0	0	278.783	4.221	20	30		CIEDRN
CC(C)(C#N)c1ccccc1COc1ccc(F)cc1	ZINC000486881900	331948263	/nfs/dbraw/zinc/94/82/63/331948263.db2.gz	DYGXKQHBVCLCHZ-UHFFFAOYSA-N	0	0	269.319	4.206	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@@H](c1ccccc1Cl)C(C)C	ZINC000487039762	331955102	/nfs/dbraw/zinc/95/51/02/331955102.db2.gz	UUPIOIIVMUIUFZ-OAHLLOKOSA-N	0	0	294.826	4.255	20	30		CIEDRN
COc1ccc(CS[C@@H]2CC[C@@H](C#N)C2)cc1Cl	ZINC000487176080	331958252	/nfs/dbraw/zinc/95/82/52/331958252.db2.gz	LCQRBBNTJKZNEM-ZYHUDNBSSA-N	0	0	281.808	4.274	20	30		CIEDRN
CC(C)N(C(=O)c1cc(C#N)ccc1Cl)c1ccccc1	ZINC000511722771	332940705	/nfs/dbraw/zinc/94/07/05/332940705.db2.gz	NWWQHMNHWFWMCR-UHFFFAOYSA-N	0	0	298.773	4.267	20	30		CIEDRN
Cc1ccc(C#N)cc1NCc1cc(-c2ccccc2)no1	ZINC000511666137	332939047	/nfs/dbraw/zinc/93/90/47/332939047.db2.gz	MZZAPEXGFCAEBA-UHFFFAOYSA-N	0	0	289.338	4.134	20	30		CIEDRN
CC(C)c1cccc(NC(=O)c2cccc(F)c2C#N)c1	ZINC000487592135	331976456	/nfs/dbraw/zinc/97/64/56/331976456.db2.gz	OQGDDDDHMJUGFA-UHFFFAOYSA-N	0	0	282.318	4.073	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N1CCC[C@H]1CCC1CCCC1	ZINC000487683436	331978861	/nfs/dbraw/zinc/97/88/61/331978861.db2.gz	DOESCFIFFDQYRW-ZBFHGGJFSA-N	0	0	278.440	4.095	20	30		CIEDRN
C=CCC[C@@H](C(=O)N(C)[C@@H](C)C(C)C)c1ccccc1	ZINC000487691002	331978985	/nfs/dbraw/zinc/97/89/85/331978985.db2.gz	QTRCOUJUAMHIND-DOTOQJQBSA-N	0	0	273.420	4.239	20	30		CIEDRN
Cc1nc(N2CCC[C@@H]2c2ccccc2Cl)ccc1C#N	ZINC000488066555	331988748	/nfs/dbraw/zinc/98/87/48/331988748.db2.gz	PCGWJYSLXDVMQC-MRXNPFEDSA-N	0	0	297.789	4.257	20	30		CIEDRN
N#Cc1c(F)cccc1CSc1ccc(F)cc1F	ZINC000488218569	331994308	/nfs/dbraw/zinc/99/43/08/331994308.db2.gz	PUNAEBCMKMKHME-UHFFFAOYSA-N	0	0	279.286	4.268	20	30		CIEDRN
CC(C)O[C@@H](COc1ccc(C#N)c(F)c1)c1ccccc1	ZINC000488232884	331994980	/nfs/dbraw/zinc/99/49/80/331994980.db2.gz	KIUZYQVJXFCDKO-SFHVURJKSA-N	0	0	299.345	4.242	20	30		CIEDRN
C=CC[C@@H](C(=O)N(C)c1cccc(C)c1)c1ccccc1	ZINC000488324227	331999726	/nfs/dbraw/zinc/99/97/26/331999726.db2.gz	UYNRTBHJPCUDIT-GOSISDBHSA-N	0	0	279.383	4.318	20	30		CIEDRN
CC(C)CCN(CCC#N)Cc1cc2ccc(F)cc2[nH]1	ZINC000488332952	332000168	/nfs/dbraw/zinc/00/01/68/332000168.db2.gz	CBDQIUWTVPLPRW-UHFFFAOYSA-N	0	0	287.382	4.069	20	30		CIEDRN
C=CCC[C@H](C(=O)N(C)C[C@H](C)CC)c1ccccc1	ZINC000488388819	332003292	/nfs/dbraw/zinc/00/32/92/332003292.db2.gz	RDZQAYNIKXPHCE-WBVHZDCISA-N	0	0	273.420	4.241	20	30		CIEDRN
C=CCn1cccc1C(=O)N(C)[C@@H](C)c1cc(C)ccc1C	ZINC000488384871	332003386	/nfs/dbraw/zinc/00/33/86/332003386.db2.gz	BIEWGXVMMWBBHT-INIZCTEOSA-N	0	0	296.414	4.124	20	30		CIEDRN
N#Cc1ccc(NC[C@@H]2CCCCC(F)(F)C2)cc1	ZINC000488427159	332007101	/nfs/dbraw/zinc/00/71/01/332007101.db2.gz	FQWXTDJQOWSOKZ-CYBMUJFWSA-N	0	0	264.319	4.186	20	30		CIEDRN
CC(=O)c1ccc(C#N)cc1N(C)Cc1cccc(C)c1C	ZINC000488458613	332011027	/nfs/dbraw/zinc/01/10/27/332011027.db2.gz	IQRTZTNZYZHXED-UHFFFAOYSA-N	0	0	292.382	4.014	20	30		CIEDRN
Cc1cccc(CSCc2ccc(F)cc2C#N)c1	ZINC000488477915	332012806	/nfs/dbraw/zinc/01/28/06/332012806.db2.gz	ASZZBHGOIYGWHX-UHFFFAOYSA-N	0	0	271.360	4.439	20	30		CIEDRN
COc1ccccc1CSCc1ccc(F)cc1C#N	ZINC000488480280	332012827	/nfs/dbraw/zinc/01/28/27/332012827.db2.gz	IFLQAZHTWDITBG-UHFFFAOYSA-N	0	0	287.359	4.139	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1ccc(OCCC)cc1	ZINC000488557597	332017342	/nfs/dbraw/zinc/01/73/42/332017342.db2.gz	LLYMWZZEPNMQAJ-HNNXBMFYSA-N	0	0	288.391	4.048	20	30		CIEDRN
C=C(C)CNC(=O)N1CCC[C@@H]1c1cccc2ccccc21	ZINC000488566150	332017790	/nfs/dbraw/zinc/01/77/90/332017790.db2.gz	UDGHMDWFLMTXCB-GOSISDBHSA-N	0	0	294.398	4.262	20	30		CIEDRN
C=C(C)CNC(=O)N[C@H](C)c1ccc(SC(C)C)cc1	ZINC000488578872	332018780	/nfs/dbraw/zinc/01/87/80/332018780.db2.gz	HXKJGFIAZMOJHR-CYBMUJFWSA-N	0	0	292.448	4.123	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1ccc(-c2ccc[nH]2)cc1	ZINC000488597447	332019978	/nfs/dbraw/zinc/01/99/78/332019978.db2.gz	PAIUBFHWNVZZQP-INIZCTEOSA-N	0	0	295.386	4.254	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1ccc(C2CC2)c(C)c1	ZINC000488597349	332019986	/nfs/dbraw/zinc/01/99/86/332019986.db2.gz	DVBJCPJWTYNESD-INIZCTEOSA-N	0	0	284.403	4.445	20	30		CIEDRN
CCN(C[C@H](C)C#N)[C@@H]1CCc2c1cc(Cl)cc2Cl	ZINC000488641677	332020838	/nfs/dbraw/zinc/02/08/38/332020838.db2.gz	FDTZCHKWJZERGX-MEBBXXQBSA-N	0	0	297.229	4.462	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)CC1CCC(C)(C)CC1	ZINC000488817970	332027282	/nfs/dbraw/zinc/02/72/82/332027282.db2.gz	PVKLBLTWGFKIKN-HNNXBMFYSA-N	0	0	263.425	4.160	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)C[C@H](C)c1ccc(F)cc1F	ZINC000488822180	332027372	/nfs/dbraw/zinc/02/73/72/332027372.db2.gz	WCTPUNRHQDHXKN-GXTWGEPZSA-N	0	0	293.357	4.026	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1cccc(Cl)c1Cl	ZINC000488822922	332027594	/nfs/dbraw/zinc/02/75/94/332027594.db2.gz	XGMHMHYHMMCSSY-JTQLQIEISA-N	0	0	284.186	4.174	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1cc(SC)ccc1Cl	ZINC000488839715	332028640	/nfs/dbraw/zinc/02/86/40/332028640.db2.gz	MYZLNZJXXULBLO-LLVKDONJSA-N	0	0	295.835	4.243	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Cc1c(Cl)cccc1Cl	ZINC000488844639	332028981	/nfs/dbraw/zinc/02/89/81/332028981.db2.gz	OWMFHUAZXGZKCU-NSHDSACASA-N	0	0	298.213	4.103	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1ccc(-c2ccccc2F)o1	ZINC000488844362	332028992	/nfs/dbraw/zinc/02/89/92/332028992.db2.gz	OHUONRKREJWQRR-ZDUSSCGKSA-N	0	0	299.345	4.266	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1oc2ccc(F)cc2c1C	ZINC000488844689	332029039	/nfs/dbraw/zinc/02/90/39/332029039.db2.gz	UZHHHMCOEMHLGI-ZDUSSCGKSA-N	0	0	287.334	4.061	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Cc1cc(Cl)ccc1Cl	ZINC000488861665	332030120	/nfs/dbraw/zinc/03/01/20/332030120.db2.gz	RBZWYWTXRLZPQU-ZDUSSCGKSA-N	0	0	298.213	4.103	20	30		CIEDRN
C=CC[C@@H](C(=O)N1CCCCC[C@@H]1C)c1ccccc1	ZINC000488866070	332030351	/nfs/dbraw/zinc/03/03/51/332030351.db2.gz	VZSGSQAOGWWODS-DOTOQJQBSA-N	0	0	271.404	4.137	20	30		CIEDRN
C=C1CCN(C(=O)C[C@H]2C[C@H](C)c3c2cccc3C)CC1	ZINC000488870051	332030413	/nfs/dbraw/zinc/03/04/13/332030413.db2.gz	BQKBKYKAUAOGOJ-JKSUJKDBSA-N	0	0	283.415	4.155	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@H](C)Sc1ccc(C)cc1	ZINC000488872420	332030695	/nfs/dbraw/zinc/03/06/95/332030695.db2.gz	AFEYSLKJQWYXTD-LSDHHAIUSA-N	0	0	289.444	4.043	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)C[C@@H]1CCCCC1(C)C	ZINC000488876545	332031096	/nfs/dbraw/zinc/03/10/96/332031096.db2.gz	IGXKNMPXCQAKOF-GJZGRUSLSA-N	0	0	263.425	4.160	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)C[C@H](C)c1c[nH]c2ccccc21	ZINC000488875873	332031149	/nfs/dbraw/zinc/03/11/49/332031149.db2.gz	GZLRBBRWEKKQKJ-GJZGRUSLSA-N	0	0	296.414	4.229	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@H](C)c1cc2ccccc2o1	ZINC000488877876	332031323	/nfs/dbraw/zinc/03/13/23/332031323.db2.gz	JDIFWIFXJLOGQG-UKRRQHHQSA-N	0	0	283.371	4.103	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1ccc(OC(C)(C)C)cc1	ZINC000488878221	332031334	/nfs/dbraw/zinc/03/13/34/332031334.db2.gz	LJYQJGAUAUFQCB-HNNXBMFYSA-N	0	0	287.403	4.045	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)[C@H]1CC[C@H](C(C)C)CC1	ZINC000488881799	332031818	/nfs/dbraw/zinc/03/18/18/332031818.db2.gz	UDSWLWARUPDCER-JYJNAYRXSA-N	0	0	263.425	4.016	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@H]1CC[C@H](C(C)C)CC1	ZINC000488881798	332031937	/nfs/dbraw/zinc/03/19/37/332031937.db2.gz	UDSWLWARUPDCER-BZUAXINKSA-N	0	0	263.425	4.016	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@@H]1C[C@@H]1c1ccc([C@@H]2C[C@@H]2C)o1	ZINC000488881513	332031980	/nfs/dbraw/zinc/03/19/80/332031980.db2.gz	ORYZGNWTQRVGFW-CQJMVSDSSA-N	0	0	299.414	4.074	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)C[C@H](CC)c1ccc(C)cc1	ZINC000488889023	332032441	/nfs/dbraw/zinc/03/24/41/332032441.db2.gz	ZJTMXCUVUWPICL-WMZOPIPTSA-N	0	0	285.431	4.446	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@@H]1CCc2ccc(C(C)C)cc21	ZINC000488914390	332033619	/nfs/dbraw/zinc/03/36/19/332033619.db2.gz	JJSWPZTVNAATLF-SUMWQHHRSA-N	0	0	286.419	4.061	20	30		CIEDRN
C=CCCCN(C)C(=O)C[C@@H]1C[C@@H](C)c2c1cccc2C	ZINC000488960531	332035629	/nfs/dbraw/zinc/03/56/29/332035629.db2.gz	LOORPGMCMPSKTE-CVEARBPZSA-N	0	0	285.431	4.401	20	30		CIEDRN
C=CCn1cccc1C(=O)Nc1ccc(O[C@H](C)CC)cc1	ZINC000489058510	332039829	/nfs/dbraw/zinc/03/98/29/332039829.db2.gz	OABUVWNEAUVDIY-CQSZACIVSA-N	0	0	298.386	4.104	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@@H]1CCCCC	ZINC000489290165	332045393	/nfs/dbraw/zinc/04/53/93/332045393.db2.gz	ASQIKFXJLYMYRN-INIZCTEOSA-N	0	0	263.425	4.326	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@@H]1CCCc1ccccc1	ZINC000489344874	332047921	/nfs/dbraw/zinc/04/79/21/332047921.db2.gz	BCETZNHCTCQDHF-SFHVURJKSA-N	0	0	285.431	4.357	20	30		CIEDRN
C=C[C@@H]1CCCCN1Cc1ncc(-c2cccc(F)c2)o1	ZINC000489460431	332053957	/nfs/dbraw/zinc/05/39/57/332053957.db2.gz	UWVYUUBKJGQFTI-OAHLLOKOSA-N	0	0	286.350	4.021	20	30		CIEDRN
C=CCCN(C)C(=O)C[C@H]1C[C@H](C)c2c1cccc2C	ZINC000489573984	332059853	/nfs/dbraw/zinc/05/98/53/332059853.db2.gz	RJDAGOYBUNEEBZ-LSDHHAIUSA-N	0	0	271.404	4.010	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@@H]1CCC(C)(C)C1)c1ccccc1	ZINC000489632891	332062228	/nfs/dbraw/zinc/06/22/28/332062228.db2.gz	WTYCYQKBWOFSBU-CVEARBPZSA-N	0	0	271.404	4.041	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H]1CCC[C@H](c2ccccc2)C1	ZINC000489638099	332062619	/nfs/dbraw/zinc/06/26/19/332062619.db2.gz	VPXUKSSQMCGWRC-ZWKOTPCHSA-N	0	0	283.415	4.023	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1scnc1C1CC1)c1ccccc1	ZINC000489649595	332063207	/nfs/dbraw/zinc/06/32/07/332063207.db2.gz	CGAIQJFGQNCFBH-CQSZACIVSA-N	0	0	298.411	4.319	20	30		CIEDRN
C=CCC[C@H](C(=O)NCC1(C)CCC1)c1ccccc1	ZINC000489668713	332063993	/nfs/dbraw/zinc/06/39/93/332063993.db2.gz	BVNWSWIFIKQPDV-INIZCTEOSA-N	0	0	271.404	4.043	20	30		CIEDRN
Cc1ccc([C@@H](C)N(C)Cc2ccc(F)cc2C#N)cc1	ZINC000489677008	332064375	/nfs/dbraw/zinc/06/43/75/332064375.db2.gz	JUMYXHPJRMOGLB-CQSZACIVSA-N	0	0	282.362	4.199	20	30		CIEDRN
C=CCC(C)(C)C(=O)N(C)Cc1cccc(OC(C)C)c1	ZINC000489678275	332064417	/nfs/dbraw/zinc/06/44/17/332064417.db2.gz	MJXOALFPYZFTAG-UHFFFAOYSA-N	0	0	289.419	4.035	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(C(=O)C2CCC2)cc1	ZINC000489683294	332064650	/nfs/dbraw/zinc/06/46/50/332064650.db2.gz	QUDMCBZWDCJOPN-SFHVURJKSA-N	0	0	285.387	4.210	20	30		CIEDRN
C=CCC[C@H](C(=O)Nc1ncccc1CC)c1ccccc1	ZINC000489717255	332065822	/nfs/dbraw/zinc/06/58/22/332065822.db2.gz	CBBUEVHDPVFJSO-KRWDZBQOSA-N	0	0	294.398	4.333	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1cccc(Cl)c1Cl	ZINC000489734092	332066464	/nfs/dbraw/zinc/06/64/64/332066464.db2.gz	MYOLWOVXMATSLY-UHFFFAOYSA-N	0	0	286.202	4.326	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@@H]1C[C@H]1c1ccccc1Cl	ZINC000489761768	332067252	/nfs/dbraw/zinc/06/72/52/332067252.db2.gz	BPCWAGPHNJVTCR-UONOGXRCSA-N	0	0	291.822	4.162	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)CCCc1sccc1C	ZINC000489826803	332069359	/nfs/dbraw/zinc/06/93/59/332069359.db2.gz	PWYKBDJIXKMCCX-UHFFFAOYSA-N	0	0	279.449	4.098	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1sc(C(C)(C)C)nc1C	ZINC000489858085	332070620	/nfs/dbraw/zinc/07/06/20/332070620.db2.gz	LESKUIAJPSBDDV-UHFFFAOYSA-N	0	0	294.464	4.081	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)C[C@@H](C=C)c1ccccc1	ZINC000489887678	332071952	/nfs/dbraw/zinc/07/19/52/332071952.db2.gz	RTWQIGHRCUWHPU-OAHLLOKOSA-N	0	0	271.404	4.065	20	30		CIEDRN
C=CCn1cccc1C(=O)N1CCC[C@@H](C)c2ccccc21	ZINC000489964078	332074786	/nfs/dbraw/zinc/07/47/86/332074786.db2.gz	RPVNKJMYIUFVTI-OAHLLOKOSA-N	0	0	294.398	4.218	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)C/C=C/c1ccc(C)cc1	ZINC000490035172	332077730	/nfs/dbraw/zinc/07/77/30/332077730.db2.gz	VWUXRSBANYCOEJ-VOTSOKGWSA-N	0	0	271.404	4.117	20	30		CIEDRN
C=C(C)CNC(=O)c1cc(C)c(-c2ccc(F)cc2)s1	ZINC000490036088	332077755	/nfs/dbraw/zinc/07/77/55/332077755.db2.gz	VVFNBPBQRPARMA-UHFFFAOYSA-N	0	0	289.375	4.169	20	30		CIEDRN
CC(C)c1ccc2c(c1)[C@H](Nc1cnccc1C#N)CC2	ZINC000490052136	332078697	/nfs/dbraw/zinc/07/86/97/332078697.db2.gz	YKSDGWIAWKJREQ-QGZVFWFLSA-N	0	0	277.371	4.176	20	30		CIEDRN
C=C(C)CNC(=O)c1cc(-c2ccccc2)ccc1Cl	ZINC000490061131	332079507	/nfs/dbraw/zinc/07/95/07/332079507.db2.gz	OFCZAECWBCXDRZ-UHFFFAOYSA-N	0	0	285.774	4.313	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@@H](C)CCc1ccccc1F	ZINC000490069272	332079749	/nfs/dbraw/zinc/07/97/49/332079749.db2.gz	WFARPBCKYSWYIT-AWEZNQCLSA-N	0	0	291.410	4.113	20	30		CIEDRN
Cc1cccc2c(Oc3cc(Cl)ccc3C#N)ncnc12	ZINC000490072193	332080158	/nfs/dbraw/zinc/08/01/58/332080158.db2.gz	AJNFNRPAWSAVAO-UHFFFAOYSA-N	0	0	295.729	4.256	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@@H](CC)CC(F)(F)F)c1ccccc1	ZINC000490220595	332084970	/nfs/dbraw/zinc/08/49/70/332084970.db2.gz	BWQNCWNSTZNXRP-UONOGXRCSA-N	0	0	299.336	4.194	20	30		CIEDRN
C=CC[C@H](C(=O)N(C)C[C@@H]1CC=CCC1)c1ccccc1	ZINC000490243143	332085409	/nfs/dbraw/zinc/08/54/09/332085409.db2.gz	ITHJTMVQDCQUKJ-AEFFLSMTSA-N	0	0	283.415	4.161	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@@H](C)CCC1CC1)c1ccccc1	ZINC000490251674	332085426	/nfs/dbraw/zinc/08/54/26/332085426.db2.gz	OFXGJYDMMULSRD-YOEHRIQHSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CC[C@@H](C(=O)N(C)C[C@@H]1CC=CCC1)c1ccccc1	ZINC000490243166	332085429	/nfs/dbraw/zinc/08/54/29/332085429.db2.gz	ITHJTMVQDCQUKJ-SJLPKXTDSA-N	0	0	283.415	4.161	20	30		CIEDRN
C=C[C@H](CC(=O)N(C)C1(C)CCCC1)c1ccccc1	ZINC000490679166	332103144	/nfs/dbraw/zinc/10/31/44/332103144.db2.gz	CRQOLEWOMZGPND-OAHLLOKOSA-N	0	0	271.404	4.137	20	30		CIEDRN
C[C@H](NC(=O)C1(C#N)CCCCC1)[C@@H](C)C1CCCCC1	ZINC000490887259	332125000	/nfs/dbraw/zinc/12/50/00/332125000.db2.gz	LOTPPWPAHKZNRG-CABCVRRESA-N	0	0	290.451	4.182	20	30		CIEDRN
C#CCN(C(=O)Nc1c(C)cc(C)cc1C)C1CCCC1	ZINC000491038720	332141347	/nfs/dbraw/zinc/14/13/47/332141347.db2.gz	KVZOZHNSQXFJGP-UHFFFAOYSA-N	0	0	284.403	4.022	20	30		CIEDRN
C=CCN(C)C(=O)C1(Cc2cccc(Cl)c2)CCCC1	ZINC000491074197	332147111	/nfs/dbraw/zinc/14/71/11/332147111.db2.gz	GMBQTAVZSUXSSQ-UHFFFAOYSA-N	0	0	291.822	4.087	20	30		CIEDRN
CCCCN(C(=O)c1cc(C#N)ccc1Cl)[C@H](C)CC	ZINC000511877602	332946408	/nfs/dbraw/zinc/94/64/08/332946408.db2.gz	VSCYYGYVYRUOEJ-GFCCVEGCSA-N	0	0	292.810	4.252	20	30		CIEDRN
C#C[C@H](C)N(C)C(=O)Nc1ccc(-c2ccccc2)cc1C	ZINC000491371135	332198519	/nfs/dbraw/zinc/19/85/19/332198519.db2.gz	CTJPVOPAUWMQKQ-HNNXBMFYSA-N	0	0	292.382	4.147	20	30		CIEDRN
C=CCSCc1csc(-c2ccccc2OC)n1	ZINC000172190042	335096883	/nfs/dbraw/zinc/09/68/83/335096883.db2.gz	STUCNOKOFAJRMT-UHFFFAOYSA-N	0	0	277.414	4.238	20	30		CIEDRN
C=CCN(CC(F)(F)F)C(=O)C[C@H](C)c1ccccc1C	ZINC000172229836	335098195	/nfs/dbraw/zinc/09/81/95/335098195.db2.gz	ABAWCYMFAWSROD-ZDUSSCGKSA-N	0	0	299.336	4.066	20	30		CIEDRN
C#C[C@H](C)N(C)C(=O)Nc1c(C(C)C)cccc1C(C)C	ZINC000491676903	332282005	/nfs/dbraw/zinc/28/20/05/332282005.db2.gz	ZNLBWNPMDOSFCH-AWEZNQCLSA-N	0	0	286.419	4.419	20	30		CIEDRN
C=C(C)CSCc1cc(C#N)ccc1Br	ZINC000491861618	332372466	/nfs/dbraw/zinc/37/24/66/332372466.db2.gz	BYTZVKMHHYYGCJ-UHFFFAOYSA-N	0	0	282.206	4.130	20	30		CIEDRN
C=CCCO[C@H](C)C(=O)Nc1ccc(CCCCC)cc1	ZINC000492246749	332388860	/nfs/dbraw/zinc/38/88/60/332388860.db2.gz	UIHGVCINROBMHS-OAHLLOKOSA-N	0	0	289.419	4.339	20	30		CIEDRN
C[C@H](C#N)Oc1ccccc1NC(=O)/C=C\C1CCCCC1	ZINC000492520824	332401295	/nfs/dbraw/zinc/40/12/95/332401295.db2.gz	KKBUOEUJRSWEDB-XMXAVACDSA-N	0	0	298.386	4.052	20	30		CIEDRN
CCOc1cc(N[C@@H](C)c2ccc(C#N)cc2)ccc1C	ZINC000575441460	335104299	/nfs/dbraw/zinc/10/42/99/335104299.db2.gz	CKUNIFGHWFLDNM-AWEZNQCLSA-N	0	0	280.371	4.439	20	30		CIEDRN
CCN(C[C@@H](C)C#N)C(=O)C/C=C/c1ccc(C(C)C)cc1	ZINC000493047070	332424151	/nfs/dbraw/zinc/42/41/51/332424151.db2.gz	OZYNXZBEQXIZGT-MOEXGYKKSA-N	0	0	298.430	4.221	20	30		CIEDRN
CCN(C[C@@H](C)C#N)C(=O)C/C=C\c1ccc(C(C)C)cc1	ZINC000493047521	332424192	/nfs/dbraw/zinc/42/41/92/332424192.db2.gz	OZYNXZBEQXIZGT-WLMCBFPDSA-N	0	0	298.430	4.221	20	30		CIEDRN
COc1ccc(C#N)cc1N[C@@H](C)c1ccc(Cl)cc1	ZINC000493835035	332455962	/nfs/dbraw/zinc/45/59/62/332455962.db2.gz	KYGMICWDLWVPMJ-NSHDSACASA-N	0	0	286.762	4.393	20	30		CIEDRN
Cc1ccc(CCCC(=O)Nc2ccc(CC#N)cc2)cc1	ZINC000493926112	332458325	/nfs/dbraw/zinc/45/83/25/332458325.db2.gz	AIHXIPIMFOJAOM-UHFFFAOYSA-N	0	0	292.382	4.023	20	30		CIEDRN
CC(C)(C)CN(CCC#N)C(=O)CCCC1CCCC1	ZINC000494412395	332472494	/nfs/dbraw/zinc/47/24/94/332472494.db2.gz	INHJQZIOKNSDAO-UHFFFAOYSA-N	0	0	278.440	4.135	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)N[C@H](C)c1cc(C)cc(C)c1	ZINC000494886355	332489738	/nfs/dbraw/zinc/48/97/38/332489738.db2.gz	OGEQZCKUKZWENE-WBVHZDCISA-N	0	0	286.419	4.115	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)N[C@H](c1ccccc1)C1CCC1	ZINC000494906527	332490606	/nfs/dbraw/zinc/49/06/06/332490606.db2.gz	FILRJRPSTHGYLK-QZTJIDSGSA-N	0	0	298.430	4.278	20	30		CIEDRN
CC(C)(C)CN(Cc1ccccc1)C(=O)CC(C)(C)C#N	ZINC000496067797	332537848	/nfs/dbraw/zinc/53/78/48/332537848.db2.gz	DKIQORUVEGFFNL-UHFFFAOYSA-N	0	0	286.419	4.001	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](c2cccc(Cl)c2)C1	ZINC000496806422	332560746	/nfs/dbraw/zinc/56/07/46/332560746.db2.gz	PNTCVSCAEHMLGP-YOEHRIQHSA-N	0	0	291.822	4.258	20	30		CIEDRN
C=CCOc1ccc(C(=O)N(CC)c2cccc(C)c2)cc1	ZINC000498874745	332574514	/nfs/dbraw/zinc/57/45/14/332574514.db2.gz	QSAMMAUGQRUXCW-UHFFFAOYSA-N	0	0	295.382	4.227	20	30		CIEDRN
N#Cc1cccnc1N(Cc1ccc2ccccc2c1)C1CC1	ZINC000498983797	332576771	/nfs/dbraw/zinc/57/67/71/332576771.db2.gz	FPHRRRKCAIKZOF-UHFFFAOYSA-N	0	0	299.377	4.275	20	30		CIEDRN
C=CCN(C(=O)c1c(F)ccc(C)c1F)c1ccccc1	ZINC000499282434	332583525	/nfs/dbraw/zinc/58/35/25/332583525.db2.gz	UECSISSEMIIZKB-UHFFFAOYSA-N	0	0	287.309	4.106	20	30		CIEDRN
C=CC1CCN(C(=O)[C@H](CCC)CC2CCCC2)CC1	ZINC000499351442	332584716	/nfs/dbraw/zinc/58/47/16/332584716.db2.gz	SQRSRROFZGRDBB-QGZVFWFLSA-N	0	0	277.452	4.408	20	30		CIEDRN
Cc1ccnc(NC[C@@H]2CCC[C@@H](C(F)(F)F)C2)c1C#N	ZINC000554732972	334449811	/nfs/dbraw/zinc/44/98/11/334449811.db2.gz	WDOJMHPWHHKRNJ-VXGBXAGGSA-N	0	0	297.324	4.042	20	30		CIEDRN
N#Cc1ccc(C(F)(F)F)c(NCCCC(F)(F)F)c1	ZINC000499828616	332593865	/nfs/dbraw/zinc/59/38/65/332593865.db2.gz	IGSGBXJXDFVZFK-UHFFFAOYSA-N	0	0	296.214	4.331	20	30		CIEDRN
CN(CC#N)[C@H](c1ccc(Cl)cc1)C1CCCC1	ZINC000499909247	332595775	/nfs/dbraw/zinc/59/57/75/332595775.db2.gz	KHNUGYFVORARMZ-HNNXBMFYSA-N	0	0	262.784	4.027	20	30		CIEDRN
CCC[C@H](CC1CCCCC1)C(=O)N1CCC(C#N)CC1	ZINC000500021579	332597636	/nfs/dbraw/zinc/59/76/36/332597636.db2.gz	WUVXXGZFFHDHFG-QGZVFWFLSA-N	0	0	290.451	4.135	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1ccccc1C(C)C	ZINC000500095940	332599059	/nfs/dbraw/zinc/59/90/59/332599059.db2.gz	CECKKXDDMUFHEQ-ZDUSSCGKSA-N	0	0	260.381	4.286	20	30		CIEDRN
CCCCOc1cccc(CNc2nc(C)ccc2C#N)c1	ZINC000500271313	332604184	/nfs/dbraw/zinc/60/41/84/332604184.db2.gz	BYUMMBWCQVHUOQ-UHFFFAOYSA-N	0	0	295.386	4.053	20	30		CIEDRN
Cc1ccc(C#N)c(NC[C@@H]2CCCC[C@@H]2C(F)(F)F)n1	ZINC000500296329	332604395	/nfs/dbraw/zinc/60/43/95/332604395.db2.gz	KKAWGPYKUQNSDM-STQMWFEESA-N	0	0	297.324	4.042	20	30		CIEDRN
C=CCCc1ccccc1NC/C=C/c1ccncc1	ZINC000500399115	332606804	/nfs/dbraw/zinc/60/68/04/332606804.db2.gz	FLAYJZADOBEISH-VOTSOKGWSA-N	0	0	264.372	4.326	20	30		CIEDRN
N#Cc1c(F)cccc1NCCc1ccc(F)cc1Cl	ZINC000500433206	332608833	/nfs/dbraw/zinc/60/88/33/332608833.db2.gz	SPMOFAUMNCFJRF-UHFFFAOYSA-N	0	0	292.716	4.144	20	30		CIEDRN
CC[C@H]1C[C@@]1(NCc1ccccc1C#N)c1cccc(C)c1	ZINC000500503560	332611479	/nfs/dbraw/zinc/61/14/79/332611479.db2.gz	OPINCTXHGOBCFS-ICSRJNTNSA-N	0	0	290.410	4.282	20	30		CIEDRN
C[C@@H](CNc1c(F)cc(C#N)cc1F)c1ccc(F)cc1	ZINC000500501471	332611498	/nfs/dbraw/zinc/61/14/98/332611498.db2.gz	HHRSANVDTPAMII-JTQLQIEISA-N	0	0	290.288	4.191	20	30		CIEDRN
CC(C)CN(Cc1ccc(C#N)cc1)C(=O)C1(C)CCCC1	ZINC000500545907	332612609	/nfs/dbraw/zinc/61/26/09/332612609.db2.gz	CCQRHMFVKHEOMS-UHFFFAOYSA-N	0	0	298.430	4.123	20	30		CIEDRN
CCOc1ccc(C#N)cc1NCc1ccc(SC)cc1	ZINC000500969411	332623144	/nfs/dbraw/zinc/62/31/44/332623144.db2.gz	AUWKVKRSFSGEIK-UHFFFAOYSA-N	0	0	298.411	4.291	20	30		CIEDRN
CCOc1ccc(C#N)cc1NCc1ccc([C@H]2C[C@@H]2C)o1	ZINC000500997354	332623883	/nfs/dbraw/zinc/62/38/83/332623883.db2.gz	HLHBHDAMFZCZBH-WFASDCNBSA-N	0	0	296.370	4.285	20	30		CIEDRN
COc1ccc(C#N)cc1NCc1ccc2ccccc2c1	ZINC000501007324	332624046	/nfs/dbraw/zinc/62/40/46/332624046.db2.gz	YEROOGZSZRHDLP-UHFFFAOYSA-N	0	0	288.350	4.332	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCC(C)(C)C1=CCCCC1	ZINC000501015022	332624185	/nfs/dbraw/zinc/62/41/85/332624185.db2.gz	NQGVGFIBNWILSN-UHFFFAOYSA-N	0	0	263.425	4.232	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCCCCCc1ccc(F)cc1	ZINC000501676341	332638550	/nfs/dbraw/zinc/63/85/50/332638550.db2.gz	FSPJSUKUGIXDKC-UHFFFAOYSA-N	0	0	291.410	4.257	20	30		CIEDRN
Cc1cc(C)cc([C@@H](C)NC(=O)Nc2ccc(C#N)cc2)c1	ZINC000501998435	332644982	/nfs/dbraw/zinc/64/49/82/332644982.db2.gz	YHTKJQCXJOSAAU-CQSZACIVSA-N	0	0	293.370	4.058	20	30		CIEDRN
CC1(C)CCCC[C@H]1CC(=O)Nc1ccc(CC#N)cc1	ZINC000502313846	332653488	/nfs/dbraw/zinc/65/34/88/332653488.db2.gz	DFWLAERWFYHNEG-HNNXBMFYSA-N	0	0	284.403	4.298	20	30		CIEDRN
C=C(C)CN(CC)C(=O)CCOc1ccccc1C(C)C	ZINC000502311248	332653532	/nfs/dbraw/zinc/65/35/32/332653532.db2.gz	SOQVBGNMALULBY-UHFFFAOYSA-N	0	0	289.419	4.004	20	30		CIEDRN
CC[C@@H](C)[C@@H](C)C(=O)Nc1sc2c(c1C#N)CCCC2	ZINC000502501240	332663501	/nfs/dbraw/zinc/66/35/01/332663501.db2.gz	LNTDLJNDNBMGDM-GHMZBOCLSA-N	0	0	290.432	4.119	20	30		CIEDRN
CC[C@H](C)[C@@H](C)C(=O)Nc1sc2c(c1C#N)CCCC2	ZINC000502501275	332663523	/nfs/dbraw/zinc/66/35/23/332663523.db2.gz	LNTDLJNDNBMGDM-WDEREUQCSA-N	0	0	290.432	4.119	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@H]1C[C@H](C)C[C@H](C)C1	ZINC000502523533	332664610	/nfs/dbraw/zinc/66/46/10/332664610.db2.gz	GBCBEGXLOGZXDB-FICVDOATSA-N	0	0	291.460	4.335	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)[C@H](CC)CCCC	ZINC000503090767	332681308	/nfs/dbraw/zinc/68/13/08/332681308.db2.gz	CVGJQNAJINDFTJ-QGZVFWFLSA-N	0	0	273.420	4.418	20	30		CIEDRN
Cc1ccc([C@H](C)N(C)C(=O)c2sccc2C#N)c(C)c1	ZINC000503296035	332685903	/nfs/dbraw/zinc/68/59/03/332685903.db2.gz	OGLCPXORGIWVRM-ZDUSSCGKSA-N	0	0	298.411	4.070	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)NC2(C)CCCC2)c1	ZINC000503382309	332688066	/nfs/dbraw/zinc/68/80/66/332688066.db2.gz	BCXDTKCXGPOUTM-UHFFFAOYSA-N	0	0	288.391	4.096	20	30		CIEDRN
C=CCN(CCc1ccccc1)C(=O)[C@@H](C)CCCC	ZINC000503465791	332690292	/nfs/dbraw/zinc/69/02/92/332690292.db2.gz	VUIRATPGRBPZGG-INIZCTEOSA-N	0	0	273.420	4.070	20	30		CIEDRN
C=CC1CCN(C(=O)CC2CCC(C)(C)CC2)CC1	ZINC000503685131	332695435	/nfs/dbraw/zinc/69/54/35/332695435.db2.gz	MPJROZPAMJCXHF-UHFFFAOYSA-N	0	0	263.425	4.018	20	30		CIEDRN
C=CC1CCN(C(=O)C[C@H]2CCCCC2(C)C)CC1	ZINC000503699052	332695610	/nfs/dbraw/zinc/69/56/10/332695610.db2.gz	URNATIBHOZQTPE-OAHLLOKOSA-N	0	0	263.425	4.018	20	30		CIEDRN
C=CCCCC(=O)N(C)c1nc2c(cccc2Cl)s1	ZINC000568753241	334839305	/nfs/dbraw/zinc/83/93/05/334839305.db2.gz	LBGRGIJFTJRTBT-UHFFFAOYSA-N	0	0	294.807	4.269	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)CCc1ccccc1C	ZINC000504395812	332710791	/nfs/dbraw/zinc/71/07/91/332710791.db2.gz	VPVPSHDRYGMJID-UHFFFAOYSA-N	0	0	293.410	4.142	20	30		CIEDRN
Cc1sc(NC(=O)CCCC(C)(C)C)c(C#N)c1C	ZINC000504416445	332711273	/nfs/dbraw/zinc/71/12/73/332711273.db2.gz	PREKFZNZGXTTFF-UHFFFAOYSA-N	0	0	278.421	4.392	20	30		CIEDRN
CCc1ccc2occ(C(=O)Nc3cccc(C#N)c3)c2c1	ZINC000504541844	332714393	/nfs/dbraw/zinc/71/43/93/332714393.db2.gz	LDUVQNLFGFPAGK-UHFFFAOYSA-N	0	0	290.322	4.119	20	30		CIEDRN
C=CCCC(=O)N[C@H](C)c1ccc(SC(C)C)cc1	ZINC000504734336	332719629	/nfs/dbraw/zinc/71/96/29/332719629.db2.gz	YGNIOHGKPRKRDL-CYBMUJFWSA-N	0	0	277.433	4.331	20	30		CIEDRN
N#Cc1cnccc1/C=C\c1cc(F)cc(C(F)(F)F)c1	ZINC000504732808	332719633	/nfs/dbraw/zinc/71/96/33/332719633.db2.gz	SCBPLEWRZUKZKS-UPHRSURJSA-N	0	0	292.235	4.282	20	30		CIEDRN
N#Cc1cnccc1/C=C/c1cc(C(F)(F)F)ccc1F	ZINC000504732306	332719699	/nfs/dbraw/zinc/71/96/99/332719699.db2.gz	QXDJMOPWLMWCKF-OWOJBTEDSA-N	0	0	292.235	4.282	20	30		CIEDRN
C=CC[C@H](C(=O)NC1CC(C(C)(C)C)C1)c1ccccc1	ZINC000504866876	332723193	/nfs/dbraw/zinc/72/31/93/332723193.db2.gz	GTNIJGYQYWJCIT-JCYILVPMSA-N	0	0	285.431	4.287	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CC[C@H](C2CC2)C1	ZINC000505005451	332727578	/nfs/dbraw/zinc/72/75/78/332727578.db2.gz	LDISHROMKXXLEH-INIZCTEOSA-N	0	0	284.403	4.069	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CC[C@H](C)[C@@H](C)C1	ZINC000505011111	332727790	/nfs/dbraw/zinc/72/77/90/332727790.db2.gz	QHGOXLCJAMBCEM-GJZGRUSLSA-N	0	0	286.419	4.315	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CCC[C@@H](CC)C1	ZINC000505045686	332728908	/nfs/dbraw/zinc/72/89/08/332728908.db2.gz	KJPPBZUZOJPFDY-OAHLLOKOSA-N	0	0	286.419	4.459	20	30		CIEDRN
CC(C)CCN(CCC#N)C(=O)CCC1CCCCC1	ZINC000505179122	332733036	/nfs/dbraw/zinc/73/30/36/332733036.db2.gz	FNPUBDXFFFWAOZ-UHFFFAOYSA-N	0	0	278.440	4.135	20	30		CIEDRN
CCc1ccc(NC(=O)N[C@@H](C)c2ccc(C#N)cc2)cc1	ZINC000505323961	332737331	/nfs/dbraw/zinc/73/73/31/332737331.db2.gz	AZOCUPNJPZDMGT-ZDUSSCGKSA-N	0	0	293.370	4.003	20	30		CIEDRN
CC(C)(C)CN(Cc1ccccc1)c1ccc(C#N)cn1	ZINC000505615047	332746829	/nfs/dbraw/zinc/74/68/29/332746829.db2.gz	YGMOCHADAPJZKT-UHFFFAOYSA-N	0	0	279.387	4.006	20	30		CIEDRN
C[C@H](CNc1ccc(C#N)c(Cl)c1)Oc1ccccc1	ZINC000505776059	332751999	/nfs/dbraw/zinc/75/19/99/332751999.db2.gz	HZBCQXGCLVLWKZ-GFCCVEGCSA-N	0	0	286.762	4.091	20	30		CIEDRN
C[C@H](CC(=O)N[C@H](C#N)c1ccc(Cl)cc1)C(C)(C)C	ZINC000505800633	332753109	/nfs/dbraw/zinc/75/31/09/332753109.db2.gz	DFKQWPWWXXHJQE-BXUZGUMPSA-N	0	0	292.810	4.093	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H](C)c1cc2cccc(F)c2o1	ZINC000505981584	332758769	/nfs/dbraw/zinc/75/87/69/332758769.db2.gz	LTUPELRUYLYDRY-NSHDSACASA-N	0	0	289.350	4.351	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CC[C@H](c2ccccc2)C[C@@H]1C	ZINC000512420090	332967717	/nfs/dbraw/zinc/96/77/17/332967717.db2.gz	GXPRUAFUXWCXAP-RDJZCZTQSA-N	0	0	285.431	4.383	20	30		CIEDRN
C=CC1CCN(C(=O)C2CCC(c3ccccc3)CC2)CC1	ZINC000173314119	332968883	/nfs/dbraw/zinc/96/88/83/332968883.db2.gz	KTQWKXCKMJJPRU-UHFFFAOYSA-N	0	0	297.442	4.385	20	30		CIEDRN
N#CC1(C(=O)N2CCCC3(C2)CCCCCC3)CCCC1	ZINC000173373681	332970193	/nfs/dbraw/zinc/97/01/93/332970193.db2.gz	MQHZDIYQLOKZDW-UHFFFAOYSA-N	0	0	288.435	4.033	20	30		CIEDRN
COc1cc(F)ccc1N[C@H](C)c1ccc(C#N)cc1F	ZINC000512652762	332978150	/nfs/dbraw/zinc/97/81/50/332978150.db2.gz	BGYVXXSDYLCQHE-SNVBAGLBSA-N	0	0	288.297	4.018	20	30		CIEDRN
CCc1cccc(N[C@@H](C)c2ccc(C#N)cc2F)c1	ZINC000512666448	332979149	/nfs/dbraw/zinc/97/91/49/332979149.db2.gz	KNGLNWICESRAHY-LBPRGKRZSA-N	0	0	268.335	4.433	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)[C@H](C)c1cccc(CC(C)C)c1	ZINC000512745486	332983064	/nfs/dbraw/zinc/98/30/64/332983064.db2.gz	ZGENCOITLJUXRI-HUUCEWRRSA-N	0	0	273.420	4.069	20	30		CIEDRN
C=CCC1(C(=O)N(C)[C@@H](C)C2CCCCC2)CCC1	ZINC000512746143	332983112	/nfs/dbraw/zinc/98/31/12/332983112.db2.gz	BZSLSQPELZZOAA-AWEZNQCLSA-N	0	0	263.425	4.160	20	30		CIEDRN
C[C@H](CCC(C)(C)C)NC(=O)c1cc(C#N)ccc1Cl	ZINC000512783746	332985745	/nfs/dbraw/zinc/98/57/45/332985745.db2.gz	REZVHTPKNRRIGT-LLVKDONJSA-N	0	0	292.810	4.156	20	30		CIEDRN
C=CCOc1cccc(CNc2ccc3c(c2)CCC3)c1	ZINC000512955038	332995396	/nfs/dbraw/zinc/99/53/96/332995396.db2.gz	MESRJKMNDLRWSS-UHFFFAOYSA-N	0	0	279.383	4.352	20	30		CIEDRN
CC[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)C(C)C	ZINC000513228222	333009866	/nfs/dbraw/zinc/00/98/66/333009866.db2.gz	IZZRJNWDBJVPBJ-HNNXBMFYSA-N	0	0	287.407	4.044	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000175095675	333014887	/nfs/dbraw/zinc/01/48/87/333014887.db2.gz	QAGGAQJYAMAUBB-NSHDSACASA-N	0	0	285.309	4.239	20	30		CIEDRN
N#Cc1c(NC(=O)CCC2CCC2)sc2c1CCCC2	ZINC000175259185	333018762	/nfs/dbraw/zinc/01/87/62/333018762.db2.gz	TXFDTYSONFTFGP-UHFFFAOYSA-N	0	0	288.416	4.017	20	30		CIEDRN
C=CCCCC(=O)Nc1cc(Br)ccc1C	ZINC000175349532	333022472	/nfs/dbraw/zinc/02/24/72/333022472.db2.gz	MCQSKCLEXGNFFE-UHFFFAOYSA-N	0	0	282.181	4.052	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(OCCC)cc1C	ZINC000175390651	333023680	/nfs/dbraw/zinc/02/36/80/333023680.db2.gz	DKJJTNHXFIGEQG-UHFFFAOYSA-N	0	0	261.365	4.079	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@@H]1Cc1ccccc1Cl	ZINC000175410483	333024107	/nfs/dbraw/zinc/02/41/07/333024107.db2.gz	QQIKBQHKKMNLBL-OAHLLOKOSA-N	0	0	291.822	4.230	20	30		CIEDRN
CC[C@H](CC(C)C)C(=O)Nc1ccc(C#N)cc1Cl	ZINC000308087554	333024260	/nfs/dbraw/zinc/02/42/60/333024260.db2.gz	LCQSJTPAKYTUAG-GFCCVEGCSA-N	0	0	278.783	4.222	20	30		CIEDRN
Cc1cc2cc(Nc3ncc(C#N)cc3Cl)ccc2[nH]1	ZINC000513607859	333026417	/nfs/dbraw/zinc/02/64/17/333026417.db2.gz	IFUMDKKJSIIAHB-UHFFFAOYSA-N	0	0	282.734	4.140	20	30		CIEDRN
Cc1ccc(C)c(Oc2ncc(C#N)cc2Cl)c1	ZINC000513636367	333028128	/nfs/dbraw/zinc/02/81/28/333028128.db2.gz	ZBTZALGDQIDGIQ-UHFFFAOYSA-N	0	0	258.708	4.016	20	30		CIEDRN
N#Cc1cnc(Sc2ccc(F)cc2F)c(Cl)c1	ZINC000513651687	333029315	/nfs/dbraw/zinc/02/93/15/333029315.db2.gz	DAFBABWZTKYCLH-UHFFFAOYSA-N	0	0	282.702	4.036	20	30		CIEDRN
C=CCCCC(=O)N[C@H](c1ccccc1)C1CCC1	ZINC000175706044	333029776	/nfs/dbraw/zinc/02/97/76/333029776.db2.gz	NLRNRUUEIMIXKE-QGZVFWFLSA-N	0	0	257.377	4.000	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(COC2CCCC2)cc1	ZINC000175741591	333031254	/nfs/dbraw/zinc/03/12/54/333031254.db2.gz	RLZPRWORUHKTNN-UHFFFAOYSA-N	0	0	287.403	4.441	20	30		CIEDRN
CC(C)(C)CN(C/C=C/c1ccc(F)cc1)CCC#N	ZINC000513726046	333035859	/nfs/dbraw/zinc/03/58/59/333035859.db2.gz	WLMKZOOUBKZQEL-GQCTYLIASA-N	0	0	274.383	4.101	20	30		CIEDRN
CC(C)(C)CN(CCC#N)Cc1ccccc1Cl	ZINC000513729395	333036045	/nfs/dbraw/zinc/03/60/45/333036045.db2.gz	ORJXMOQURJNDRX-UHFFFAOYSA-N	0	0	264.800	4.102	20	30		CIEDRN
CC(C)(C)CN(CCC#N)Cc1ccc(Cl)cc1	ZINC000513737054	333036638	/nfs/dbraw/zinc/03/66/38/333036638.db2.gz	SQNMSQBXCOOTHY-UHFFFAOYSA-N	0	0	264.800	4.102	20	30		CIEDRN
Cc1ccccc1C[C@H]1CCCN1c1cccc(F)c1C#N	ZINC000513744355	333037178	/nfs/dbraw/zinc/03/71/78/333037178.db2.gz	JTDUFKTUZZTXLJ-MRXNPFEDSA-N	0	0	294.373	4.217	20	30		CIEDRN
N#Cc1cnc(SCCCc2ccccc2)c(Cl)c1	ZINC000513760825	333037984	/nfs/dbraw/zinc/03/79/84/333037984.db2.gz	QHDYCEGLZUAVTK-UHFFFAOYSA-N	0	0	288.803	4.332	20	30		CIEDRN
C=CCCCC(=O)Nc1cccc(Oc2ccccn2)c1	ZINC000176106876	333039421	/nfs/dbraw/zinc/03/94/21/333039421.db2.gz	AZXNVIGFJNWGCA-UHFFFAOYSA-N	0	0	282.343	4.169	20	30		CIEDRN
CCCn1c2ccc(F)cc2nc1-c1ccc(C#N)cc1	ZINC000513855818	333043416	/nfs/dbraw/zinc/04/34/16/333043416.db2.gz	LIWZQIODWHWENO-UHFFFAOYSA-N	0	0	279.318	4.124	20	30		CIEDRN
CCCn1c2ccc(F)cc2nc1-c1cccc(C#N)c1	ZINC000513857314	333043677	/nfs/dbraw/zinc/04/36/77/333043677.db2.gz	JXEVCFWSMQNSLY-UHFFFAOYSA-N	0	0	279.318	4.124	20	30		CIEDRN
N#Cc1csc(/C=C/c2ccc3ccccc3n2)c1	ZINC000176836232	333048571	/nfs/dbraw/zinc/04/85/71/333048571.db2.gz	PUZWKKUVFIYNMF-BQYQJAHWSA-N	0	0	262.337	4.338	20	30		CIEDRN
COc1ccc2nc(C)cc(OCCCC(C)(C)C#N)c2c1	ZINC000177248441	333056049	/nfs/dbraw/zinc/05/60/49/333056049.db2.gz	KZFJTXNZUMZHSZ-UHFFFAOYSA-N	0	0	298.386	4.261	20	30		CIEDRN
CCCCc1ccc(C(=O)COc2ccc(C#N)cc2)cc1	ZINC000514053387	333062467	/nfs/dbraw/zinc/06/24/67/333062467.db2.gz	SVOWAKWUHKHULC-UHFFFAOYSA-N	0	0	293.366	4.163	20	30		CIEDRN
Cc1ccc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)c(C)c1	ZINC000177775413	333062887	/nfs/dbraw/zinc/06/28/87/333062887.db2.gz	LYTMRECOFQCPQP-CQSZACIVSA-N	0	0	298.411	4.373	20	30		CIEDRN
C=C(C)CS[C@H](C)C(=O)Nc1cccc(SC)c1	ZINC000177864638	333064569	/nfs/dbraw/zinc/06/45/69/333064569.db2.gz	GONUARXWMVRBOY-LLVKDONJSA-N	0	0	281.446	4.045	20	30		CIEDRN
C=C(C)CS[C@H](C)C(=O)Nc1cccc(Cl)c1C	ZINC000177865361	333064579	/nfs/dbraw/zinc/06/45/79/333064579.db2.gz	QEVPOBJRROKQLN-LLVKDONJSA-N	0	0	283.824	4.285	20	30		CIEDRN
C=CCCCC(=O)N1CCS[C@H](C)[C@H]1c1ccccc1	ZINC000177869420	333064731	/nfs/dbraw/zinc/06/47/31/333064731.db2.gz	FDDQEEAYSYNBKV-PBHICJAKSA-N	0	0	289.444	4.048	20	30		CIEDRN
C=CCCCC(=O)Nc1cc(C(F)(F)F)ccc1C	ZINC000177934311	333065874	/nfs/dbraw/zinc/06/58/74/333065874.db2.gz	ZERNEDOYLKERCH-UHFFFAOYSA-N	0	0	271.282	4.309	20	30		CIEDRN
Cc1nc(Oc2ccc(Cl)cc2F)c(Cl)cc1C#N	ZINC000311405062	333067967	/nfs/dbraw/zinc/06/79/67/333067967.db2.gz	AVWABIDPPRLQKR-UHFFFAOYSA-N	0	0	297.116	4.500	20	30		CIEDRN
Cc1ccc(F)cc1Oc1nc(C)c(C#N)cc1Cl	ZINC000311679794	333071118	/nfs/dbraw/zinc/07/11/18/333071118.db2.gz	IOYFRDXWVWINBC-UHFFFAOYSA-N	0	0	276.698	4.155	20	30		CIEDRN
CC(C)SCCNc1ccc(C#N)c(C(F)(F)F)c1	ZINC000311689595	333071409	/nfs/dbraw/zinc/07/14/09/333071409.db2.gz	FGZGWGDBFCEAHM-UHFFFAOYSA-N	0	0	288.338	4.131	20	30		CIEDRN
Cc1nc(N[C@@H](C)c2ccccc2Cl)ccc1C#N	ZINC000311893524	333074255	/nfs/dbraw/zinc/07/42/55/333074255.db2.gz	YVWHUCCIGACTGW-NSHDSACASA-N	0	0	271.751	4.088	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)c1ccccc1C(C)C	ZINC000516639584	333079784	/nfs/dbraw/zinc/07/97/84/333079784.db2.gz	LPCGCSNIXKTRHF-CQSZACIVSA-N	0	0	259.393	4.375	20	30		CIEDRN
C=CCC(C)(C)c1noc(Cc2cccc(Cl)c2)n1	ZINC000516669357	333080127	/nfs/dbraw/zinc/08/01/27/333080127.db2.gz	VKSGZZCYOLCJDC-UHFFFAOYSA-N	0	0	276.767	4.168	20	30		CIEDRN
N#Cc1ccc(N2CCC[C@H]2C2CCCCC2)cc1[N+](=O)[O-]	ZINC000516943037	333087296	/nfs/dbraw/zinc/08/72/96/333087296.db2.gz	PXRGZMJJTBYRBS-INIZCTEOSA-N	0	0	299.374	4.016	20	30		CIEDRN
Cc1ccc(Cl)cc1OCCCC(C)(C)C#N	ZINC000088729871	333091623	/nfs/dbraw/zinc/09/16/23/333091623.db2.gz	SGAKATKMJWPDED-UHFFFAOYSA-N	0	0	251.757	4.357	20	30		CIEDRN
Cc1ccc(C)c(CSc2ccc([N+](=O)[O-])cc2C#N)c1	ZINC000517360978	333097877	/nfs/dbraw/zinc/09/78/77/333097877.db2.gz	MELAIKBNPJCLRX-UHFFFAOYSA-N	0	0	298.367	4.376	20	30		CIEDRN
C=CCCCN(C)C(=O)c1cscc1-c1ccccc1	ZINC000517443583	333099747	/nfs/dbraw/zinc/09/97/47/333099747.db2.gz	VHNLUZVUWOZAGJ-UHFFFAOYSA-N	0	0	285.412	4.453	20	30		CIEDRN
N#Cc1ccnc(SC[C@H]2CCCc3ccccc32)c1	ZINC000517522690	333101055	/nfs/dbraw/zinc/10/10/55/333101055.db2.gz	LQFXCCYAURQLQM-OAHLLOKOSA-N	0	0	280.396	4.165	20	30		CIEDRN
C=CCN(C(=O)[C@H](C)c1ccccc1F)c1ccccc1	ZINC000517518843	333101076	/nfs/dbraw/zinc/10/10/76/333101076.db2.gz	WILDNOGPYMHQLQ-CQSZACIVSA-N	0	0	283.346	4.148	20	30		CIEDRN
C=CCOc1cccc(C[NH2+]Cc2ccc([C@H]3C[C@@H]3C)o2)c1	ZINC000517543051	333101735	/nfs/dbraw/zinc/10/17/35/333101735.db2.gz	MZYRXYUCJVMMBR-KSSFIOAISA-N	0	0	297.398	4.258	20	30		CIEDRN
C=CCOc1cccc(C[NH2+]Cc2ccc([C@@H]3C[C@@H]3C)o2)c1	ZINC000517543049	333101881	/nfs/dbraw/zinc/10/18/81/333101881.db2.gz	MZYRXYUCJVMMBR-KBXCAEBGSA-N	0	0	297.398	4.258	20	30		CIEDRN
N#Cc1ccc(N[C@@H]2CCC[C@@H]2c2ccccc2)cc1	ZINC000517665128	333105442	/nfs/dbraw/zinc/10/54/42/333105442.db2.gz	SVXFLQFSVZVCQI-QZTJIDSGSA-N	0	0	262.356	4.306	20	30		CIEDRN
N#Cc1ccc(N2CCCC3(CCCCC3)C2)c([N+](=O)[O-])c1	ZINC000517664793	333105473	/nfs/dbraw/zinc/10/54/73/333105473.db2.gz	AYPUTGYGBNRORI-UHFFFAOYSA-N	0	0	299.374	4.017	20	30		CIEDRN
N#Cc1cnc(N2CCCC3(CCCCC3)C2)c(Cl)c1	ZINC000517666108	333105545	/nfs/dbraw/zinc/10/55/45/333105545.db2.gz	TUHSRCDCYYMAFT-UHFFFAOYSA-N	0	0	289.810	4.157	20	30		CIEDRN
CC(C)c1ccccc1N(C)C(=O)c1ccc(F)c(C#N)c1	ZINC000520888101	333107470	/nfs/dbraw/zinc/10/74/70/333107470.db2.gz	CZZJBYJPBRLKRV-UHFFFAOYSA-N	0	0	296.345	4.097	20	30		CIEDRN
C=CCc1ccccc1OCc1noc(-c2cccs2)n1	ZINC000520933662	333107925	/nfs/dbraw/zinc/10/79/25/333107925.db2.gz	JYKYTMUOACDYMO-UHFFFAOYSA-N	0	0	298.367	4.106	20	30		CIEDRN
C[C@@H](c1noc(-c2ccc(C#N)c(Cl)c2)n1)C(C)(C)C	ZINC000575835953	335121537	/nfs/dbraw/zinc/12/15/37/335121537.db2.gz	SMYAGPNUQKIVFB-VIFPVBQESA-N	0	0	289.766	4.411	20	30		CIEDRN
C=CCN[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F	ZINC000183344146	333120287	/nfs/dbraw/zinc/12/02/87/333120287.db2.gz	UFXGFFQQSSJBLQ-JTQLQIEISA-N	0	0	283.215	4.084	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)c1ccc(Cl)cc1SCC	ZINC000184171599	333125321	/nfs/dbraw/zinc/12/53/21/333125321.db2.gz	KNVGUUGRDCXLGC-SNVBAGLBSA-N	0	0	283.824	4.146	20	30		CIEDRN
C[C@@H](Nc1cc(Cl)nc(C2CC2)n1)c1ccc(C#N)cc1	ZINC000217969627	333125379	/nfs/dbraw/zinc/12/53/79/333125379.db2.gz	LTWLTVSTPLQPCA-SNVBAGLBSA-N	0	0	298.777	4.052	20	30		CIEDRN
C=CC[C@H](C)NC(=O)c1ccc(Cl)cc1SCC	ZINC000184171582	333125409	/nfs/dbraw/zinc/12/54/09/333125409.db2.gz	KNVGUUGRDCXLGC-JTQLQIEISA-N	0	0	283.824	4.146	20	30		CIEDRN
Cc1cc2occ(C(=O)Nc3ccccc3C#N)c2cc1C	ZINC000184650857	333131130	/nfs/dbraw/zinc/13/11/30/333131130.db2.gz	JUPGCXHBMPWPQI-UHFFFAOYSA-N	0	0	290.322	4.174	20	30		CIEDRN
C[C@H](SC[C@@H]1CCC(C)(C)O1)c1ccc(C#N)cc1	ZINC000184824404	333132500	/nfs/dbraw/zinc/13/25/00/333132500.db2.gz	OXLKINVQMHGDAM-WFASDCNBSA-N	0	0	275.417	4.310	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(C)cc1Br	ZINC000184888622	333132987	/nfs/dbraw/zinc/13/29/87/333132987.db2.gz	XOASBSOQBHHORN-NSHDSACASA-N	0	0	296.208	4.298	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](C)c1ccccc1Cl	ZINC000184907264	333133245	/nfs/dbraw/zinc/13/32/45/333133245.db2.gz	HVKXNWWPDVIUKC-NWDGAFQWSA-N	0	0	265.784	4.120	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(Cl)ccc1F	ZINC000184993010	333134028	/nfs/dbraw/zinc/13/40/28/333134028.db2.gz	WPBBSKOCXHZCBG-VIFPVBQESA-N	0	0	255.720	4.020	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](C)c1ccc(OC(C)C)cc1	ZINC000185172907	333136377	/nfs/dbraw/zinc/13/63/77/333136377.db2.gz	FMCPRVKCTHGDKO-HUUCEWRRSA-N	0	0	289.419	4.253	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H]1CCc1ccccc1	ZINC000185216135	333136768	/nfs/dbraw/zinc/13/67/68/333136768.db2.gz	BVBXVHBFUFHJHG-WMZOPIPTSA-N	0	0	285.431	4.213	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC)[C@H](C)c1cccc(OC)c1	ZINC000185227808	333137002	/nfs/dbraw/zinc/13/70/02/333137002.db2.gz	WFLJNFKGSIXLDS-LSDHHAIUSA-N	0	0	289.419	4.207	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@H](C)c1cccc(Cl)c1	ZINC000185223537	333137064	/nfs/dbraw/zinc/13/70/64/333137064.db2.gz	HHNRIRNKDDFKJN-CHWSQXEVSA-N	0	0	279.811	4.462	20	30		CIEDRN
C=Cc1ccc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1	ZINC000185249057	333137419	/nfs/dbraw/zinc/13/74/19/333137419.db2.gz	IJTCFBVFVQYADL-UHFFFAOYSA-N	0	0	290.366	4.383	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CCc2c1cccc2Cl	ZINC000185261227	333137637	/nfs/dbraw/zinc/13/76/37/333137637.db2.gz	CEIBTAOAKLWYMH-IAQYHMDHSA-N	0	0	277.795	4.046	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cccc(COCC2CC2)c1	ZINC000185275821	333137885	/nfs/dbraw/zinc/13/78/85/333137885.db2.gz	BSAQDVHNQXQQJO-AWEZNQCLSA-N	0	0	287.403	4.154	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cccc(Br)c1C	ZINC000185421104	333140328	/nfs/dbraw/zinc/14/03/28/333140328.db2.gz	CCYITVXRNPGEQN-JTQLQIEISA-N	0	0	296.208	4.298	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C1CC1)[C@H]1CCc2ccccc21	ZINC000185443998	333140750	/nfs/dbraw/zinc/14/07/50/333140750.db2.gz	KRUCRCLNDKCMJJ-KDOFPFPSSA-N	0	0	283.415	4.267	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(CCSC)cc1	ZINC000185442224	333140897	/nfs/dbraw/zinc/14/08/97/333140897.db2.gz	MCQHMSTZDIKPPN-ZDUSSCGKSA-N	0	0	277.433	4.133	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NC(C)(C)Cc1ccccc1C	ZINC000185457803	333141041	/nfs/dbraw/zinc/14/10/41/333141041.db2.gz	MQIRFJWPBUIZDS-OAHLLOKOSA-N	0	0	273.420	4.035	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H](C)c1ccc(SCC)cc1	ZINC000185470100	333141356	/nfs/dbraw/zinc/14/13/56/333141356.db2.gz	OGNHVIXJDZMHCR-AWEZNQCLSA-N	0	0	289.444	4.169	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCC1(Sc2ccccc2)CC1	ZINC000185517316	333142508	/nfs/dbraw/zinc/14/25/08/333142508.db2.gz	DAJQCKCGVQXIIW-CQSZACIVSA-N	0	0	289.444	4.030	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCCC2(CCCCC2)C1	ZINC000185532998	333143138	/nfs/dbraw/zinc/14/31/38/333143138.db2.gz	LGAHOIDZUUGQOI-HNNXBMFYSA-N	0	0	263.425	4.162	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(Cc1ccc(F)cc1)CC1CC1	ZINC000185581068	333144148	/nfs/dbraw/zinc/14/41/48/333144148.db2.gz	CAVXJMMZZRQZEE-AWEZNQCLSA-N	0	0	289.394	4.167	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C(C)C)C1CCCCC1	ZINC000185588343	333144376	/nfs/dbraw/zinc/14/43/76/333144376.db2.gz	AEHBEZGFCYCJKF-CQSZACIVSA-N	0	0	251.414	4.158	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](c2ccccc2C)C[C@H]1C	ZINC000185623828	333145075	/nfs/dbraw/zinc/14/50/75/333145075.db2.gz	LKBDHVRSDFYKKM-BBWFWOEESA-N	0	0	285.431	4.302	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cccc2ccc(C)nc21	ZINC000185644360	333145637	/nfs/dbraw/zinc/14/56/37/333145637.db2.gz	FKVRYJJWSSRJLW-GFCCVEGCSA-N	0	0	268.360	4.084	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NC1(c2cccc(Cl)c2)CC1	ZINC000185650891	333145868	/nfs/dbraw/zinc/14/58/68/333145868.db2.gz	RJNQOFVCQKATMK-LBPRGKRZSA-N	0	0	277.795	4.048	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](C)C(C)(C)c1ccccc1	ZINC000185660314	333146171	/nfs/dbraw/zinc/14/61/71/333146171.db2.gz	KTZNDACVLOTBOK-GJZGRUSLSA-N	0	0	273.420	4.071	20	30		CIEDRN
Cc1cc(N2CCCC2)ccc1N[C@@H]1CCC[C@@H](C#N)C1	ZINC000185722256	333147276	/nfs/dbraw/zinc/14/72/76/333147276.db2.gz	UUQKZPLNCSKGRM-HZPDHXFCSA-N	0	0	283.419	4.090	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cccc(Oc2ccccn2)c1	ZINC000185729064	333147460	/nfs/dbraw/zinc/14/74/60/333147460.db2.gz	GPGWAEBXIGVQMN-CQSZACIVSA-N	0	0	296.370	4.415	20	30		CIEDRN
N#C[C@@H]1CCC[C@H](Nc2ccc(F)cc2OCC2CC2)C1	ZINC000185730233	333147484	/nfs/dbraw/zinc/14/74/84/333147484.db2.gz	XFRFDBQLZULVKT-HIFRSBDPSA-N	0	0	288.366	4.109	20	30		CIEDRN
CC(C)COc1ccccc1N[C@@H]1CCC[C@@H](C#N)C1	ZINC000185738341	333147643	/nfs/dbraw/zinc/14/76/43/333147643.db2.gz	BGRKMHNPBLOQAY-HUUCEWRRSA-N	0	0	272.392	4.216	20	30		CIEDRN
Cc1ccc(N[C@@H]2CCC[C@@H](C#N)C2)cc1OCC(F)F	ZINC000185745327	333147953	/nfs/dbraw/zinc/14/79/53/333147953.db2.gz	OUPTZEXFGCXQCS-CHWSQXEVSA-N	0	0	294.345	4.133	20	30		CIEDRN
CC#CCCCC(=O)N1CC[C@H](c2ccccc2)[C@H](CC)C1	ZINC000185745261	333147958	/nfs/dbraw/zinc/14/79/58/333147958.db2.gz	VMQVYPJWOQNEDK-MJGOQNOKSA-N	0	0	297.442	4.222	20	30		CIEDRN
CC[C@H]([NH2+][C@H]1CCC[C@H](C#N)C1)c1cccc(Cl)c1	ZINC000185777432	333148556	/nfs/dbraw/zinc/14/85/56/333148556.db2.gz	WTVRZPKMRYMKDG-RCBQFDQVSA-N	0	0	276.811	4.463	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(Cl)cc1OCC	ZINC000185845899	333150186	/nfs/dbraw/zinc/15/01/86/333150186.db2.gz	COOJZTMYIRINTJ-NSHDSACASA-N	0	0	281.783	4.280	20	30		CIEDRN
CC(C)(C)C[C@H](N[C@@H]1CCC[C@H](C#N)C1)C(F)(F)F	ZINC000185891494	333151227	/nfs/dbraw/zinc/15/12/27/333151227.db2.gz	SOMBRTNGWMAXAV-TUAOUCFPSA-N	0	0	276.346	4.025	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cccnc1-c1ccccc1	ZINC000185944518	333152128	/nfs/dbraw/zinc/15/21/28/333152128.db2.gz	OYYRXQXDBVPVBD-CQSZACIVSA-N	0	0	280.371	4.289	20	30		CIEDRN
CC#CCCCC(=O)Nc1sc2c(c1C)CCCC2	ZINC000185951163	333152149	/nfs/dbraw/zinc/15/21/49/333152149.db2.gz	SRPRIDFCEMSPFQ-UHFFFAOYSA-N	0	0	275.417	4.067	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCC1(c2ccccc2Cl)CC1	ZINC000185964917	333152574	/nfs/dbraw/zinc/15/25/74/333152574.db2.gz	QSGFVDUDZPNBSG-ZDUSSCGKSA-N	0	0	291.822	4.090	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cc(C)cc2cccnc21	ZINC000185977391	333152765	/nfs/dbraw/zinc/15/27/65/333152765.db2.gz	DEPTXTPCIFVOJH-CYBMUJFWSA-N	0	0	268.360	4.084	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CC=C(c2cccc(C)c2)CC1	ZINC000185982991	333152856	/nfs/dbraw/zinc/15/28/56/333152856.db2.gz	PMGMIKZWMAFZKT-MRXNPFEDSA-N	0	0	283.415	4.213	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1cc(C)ccc1OC)c1ccccc1	ZINC000186005577	333153341	/nfs/dbraw/zinc/15/33/41/333153341.db2.gz	ZNJHDJGQDXDNMI-INIZCTEOSA-N	0	0	295.382	4.302	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(F)cc1OCCC	ZINC000186031486	333153827	/nfs/dbraw/zinc/15/38/27/333153827.db2.gz	WACQCUGIOQKQGZ-LBPRGKRZSA-N	0	0	279.355	4.155	20	30		CIEDRN
C=C(C)[C@@H](NC(=O)C[C@H]1C=CCC1)c1ccc(F)c(F)c1	ZINC000186044571	333153996	/nfs/dbraw/zinc/15/39/96/333153996.db2.gz	BEUQTLBINMUDBW-YVEFUNNKSA-N	0	0	291.341	4.055	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1ccc(F)cc1C)c1ccccc1	ZINC000186109627	333155054	/nfs/dbraw/zinc/15/50/54/333155054.db2.gz	RDWMXBJWPKEAOH-MRXNPFEDSA-N	0	0	283.346	4.433	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(C(C)=O)c(Cl)c1	ZINC000186136823	333155597	/nfs/dbraw/zinc/15/55/97/333155597.db2.gz	BXXSYSCSTFFTNM-SNVBAGLBSA-N	0	0	279.767	4.083	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Nc1c(F)cccc1OC	ZINC000186262163	333157677	/nfs/dbraw/zinc/15/76/77/333157677.db2.gz	KIEYWMYOQCJDHX-UHFFFAOYSA-N	0	0	294.370	4.044	20	30		CIEDRN
CC#CCCCC(=O)Nc1cccc(NC2CCCC2)c1	ZINC000186421852	333160402	/nfs/dbraw/zinc/16/04/02/333160402.db2.gz	MUZCVZNDGOOURK-UHFFFAOYSA-N	0	0	284.403	4.173	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1cccc(COC)c1)c1ccccc1	ZINC000186583684	333163313	/nfs/dbraw/zinc/16/33/13/333163313.db2.gz	WRLSBRAHPGICAN-SFHVURJKSA-N	0	0	295.382	4.131	20	30		CIEDRN
C=CCC[C@@H](C(=O)NCc1ccsc1)c1ccccc1	ZINC000186700392	333164425	/nfs/dbraw/zinc/16/44/25/333164425.db2.gz	CTMQLLQIZDSZFX-MRXNPFEDSA-N	0	0	285.412	4.114	20	30		CIEDRN
N#Cc1cc(Cl)ccc1CSc1cccc(O)c1	ZINC000186697934	333164501	/nfs/dbraw/zinc/16/45/01/333164501.db2.gz	XEFFRNVIMUQSCI-UHFFFAOYSA-N	0	0	275.760	4.210	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1cc(C#N)ccc1C)c1ccccc1	ZINC000187264699	333169038	/nfs/dbraw/zinc/16/90/38/333169038.db2.gz	PSXSWOMPXJIUGQ-KRWDZBQOSA-N	0	0	290.366	4.165	20	30		CIEDRN
C=CCC[C@@H](C(=O)Nc1cccc(O)c1)c1ccccc1	ZINC000187273389	333169150	/nfs/dbraw/zinc/16/91/50/333169150.db2.gz	SBSCSSZSCTXCHS-QGZVFWFLSA-N	0	0	281.355	4.081	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1ccc(OC)cc1C)c1ccccc1	ZINC000187455360	333171191	/nfs/dbraw/zinc/17/11/91/333171191.db2.gz	JMERKEPUGYOQED-KRWDZBQOSA-N	0	0	295.382	4.302	20	30		CIEDRN
CCCc1nc(COc2ccc(C#N)c(Cl)c2)cs1	ZINC000220986024	333171917	/nfs/dbraw/zinc/17/19/17/333171917.db2.gz	HLMPISZHPZLUJX-UHFFFAOYSA-N	0	0	292.791	4.200	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(C)c(-c2nc(C)co2)c1	ZINC000188821219	333174426	/nfs/dbraw/zinc/17/44/26/333174426.db2.gz	MQNAPGXKCKEZFC-GOSISDBHSA-N	0	0	298.386	4.499	20	30		CIEDRN
C=CCCC(=O)N[C@H](c1ccc(Cl)cc1)C1CCC1	ZINC000521511487	333174949	/nfs/dbraw/zinc/17/49/49/333174949.db2.gz	NFHCCFPWXINBHZ-INIZCTEOSA-N	0	0	277.795	4.264	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC)Cc1c[nH]c2ccccc12	ZINC000188903908	333175672	/nfs/dbraw/zinc/17/56/72/333175672.db2.gz	KJIUGJZQIZAKMK-CQSZACIVSA-N	0	0	284.403	4.119	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1cc(F)ccc1OC)c1ccccc1	ZINC000188929673	333176355	/nfs/dbraw/zinc/17/63/55/333176355.db2.gz	HPBDISZMZCLHFQ-OAHLLOKOSA-N	0	0	299.345	4.133	20	30		CIEDRN
C=CCC[C@@H](C(=O)N(C)Cc1ccoc1C)c1ccccc1	ZINC000189043289	333178950	/nfs/dbraw/zinc/17/89/50/333178950.db2.gz	BULZJJITXAAURM-GOSISDBHSA-N	0	0	297.398	4.296	20	30		CIEDRN
Cc1ccc(-n2cc(NCC(C)(C)CCC#N)cn2)c(C)c1	ZINC000189077156	333180294	/nfs/dbraw/zinc/18/02/94/333180294.db2.gz	QKMIXEYSQMHTSN-UHFFFAOYSA-N	0	0	296.418	4.231	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@@H](c3ccccc3)[C@@H]2C)CCC1	ZINC000189102518	333181156	/nfs/dbraw/zinc/18/11/56/333181156.db2.gz	ARPQQJKPAYMUAU-DOTOQJQBSA-N	0	0	283.415	4.137	20	30		CIEDRN
C=C1CCN(c2nc(C)nc3sc4c(c32)CCCC4)CC1	ZINC000521727587	333185212	/nfs/dbraw/zinc/18/52/12/333185212.db2.gz	ZMGJTJNZORHMCV-UHFFFAOYSA-N	0	0	299.443	4.035	20	30		CIEDRN
C=CCC1(C(=O)N2CCC[C@@H](CC(C)C)C2)CCC1	ZINC000189330806	333190641	/nfs/dbraw/zinc/19/06/41/333190641.db2.gz	PCKKVIHEUXBWNC-HNNXBMFYSA-N	0	0	263.425	4.018	20	30		CIEDRN
CCN(Cc1cccc(F)c1)c1c(F)cc(C#N)cc1F	ZINC000521857886	333193817	/nfs/dbraw/zinc/19/38/17/333193817.db2.gz	CNFVYSUFKYGGLR-UHFFFAOYSA-N	0	0	290.288	4.002	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cccc(Cl)c1C	ZINC000189758951	333198701	/nfs/dbraw/zinc/19/87/01/333198701.db2.gz	DEBLPPGYRRTTAO-AWEZNQCLSA-N	0	0	251.757	4.189	20	30		CIEDRN
C=CCC1(C(=O)N2CC=C(c3cccc(C)c3)CC2)CCC1	ZINC000189949505	333200969	/nfs/dbraw/zinc/20/09/69/333200969.db2.gz	XVLQHEOLZHDBDY-UHFFFAOYSA-N	0	0	295.426	4.357	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)C/C=C/c1ccc(C)cc1	ZINC000189954941	333201273	/nfs/dbraw/zinc/20/12/73/333201273.db2.gz	IKDCHFHRJYVERK-SOFGYWHQSA-N	0	0	298.430	4.329	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@H](C)c1ccc(OC(F)F)cc1	ZINC000190071959	333202939	/nfs/dbraw/zinc/20/29/39/333202939.db2.gz	ZFDZGAJNTYKPQZ-BZNIZROVSA-N	0	0	297.345	4.068	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC=Cc2ccccc21	ZINC000190135032	333203543	/nfs/dbraw/zinc/20/35/43/333203543.db2.gz	JMXAKNVQWLLCQZ-AWEZNQCLSA-N	0	0	255.361	4.039	20	30		CIEDRN
N#CCCCCSCc1cc(Cl)ccc1F	ZINC000190187164	333204304	/nfs/dbraw/zinc/20/43/04/333204304.db2.gz	NBNFKEPPUYTNFV-UHFFFAOYSA-N	0	0	257.761	4.406	20	30		CIEDRN
CC(C)Oc1cc(F)ccc1OCCCC(C)(C)C#N	ZINC000190267759	333205032	/nfs/dbraw/zinc/20/50/32/333205032.db2.gz	LFDSTVIYKFOSAE-UHFFFAOYSA-N	0	0	279.355	4.322	20	30		CIEDRN
N#Cc1ccc(CNc2cccc3ccccc32)cc1F	ZINC000190312187	333205415	/nfs/dbraw/zinc/20/54/15/333205415.db2.gz	STXRRPOBXOVTCR-UHFFFAOYSA-N	0	0	276.314	4.463	20	30		CIEDRN
N#Cc1ccc(CNc2ccc(F)c(Cl)c2)cc1F	ZINC000190313679	333205427	/nfs/dbraw/zinc/20/54/27/333205427.db2.gz	MQCKINKSHVSWAB-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
FC(F)c1cccc(NCC#Cc2ccccc2)c1	ZINC000190366273	333206049	/nfs/dbraw/zinc/20/60/49/333206049.db2.gz	GLRUBRWZBYDZQE-UHFFFAOYSA-N	0	0	257.283	4.088	20	30		CIEDRN
C=CCCCC(=O)N1CCCSc2ccc(F)cc21	ZINC000190443130	333207028	/nfs/dbraw/zinc/20/70/28/333207028.db2.gz	ZDVMFJPZRVNSOI-UHFFFAOYSA-N	0	0	279.380	4.011	20	30		CIEDRN
C=CCC1(C(=O)N[C@H](C)c2cccc(OCC)c2)CCC1	ZINC000190485663	333207493	/nfs/dbraw/zinc/20/74/93/333207493.db2.gz	AYKIZJYKIWXYIZ-CQSZACIVSA-N	0	0	287.403	4.009	20	30		CIEDRN
N#CCCCCSCCOc1ccc(Cl)c(F)c1	ZINC000191088279	333214900	/nfs/dbraw/zinc/21/49/00/333214900.db2.gz	CBIJCQMXJKLVKY-UHFFFAOYSA-N	0	0	287.787	4.285	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N(C)[C@H](CC)c1ccccc1OC	ZINC000521940246	333224512	/nfs/dbraw/zinc/22/45/12/333224512.db2.gz	CZELHTRTQVBLIG-CRAIPNDOSA-N	0	0	289.419	4.207	20	30		CIEDRN
C=CCCC(=O)NCC(C)(C)c1ccc(C(F)(F)F)cc1	ZINC000191752078	333224740	/nfs/dbraw/zinc/22/47/40/333224740.db2.gz	QAODEDGWBCEBDP-UHFFFAOYSA-N	0	0	299.336	4.065	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cc(Cl)ccc1F	ZINC000191806313	333225554	/nfs/dbraw/zinc/22/55/54/333225554.db2.gz	XTAVRFGFCTZETK-CYBMUJFWSA-N	0	0	255.720	4.020	20	30		CIEDRN
C=CC1CCN(C(=O)CCCC2CCCCC2)CC1	ZINC000521956438	333227008	/nfs/dbraw/zinc/22/70/08/333227008.db2.gz	VZIXSMGSODVJOA-UHFFFAOYSA-N	0	0	263.425	4.162	20	30		CIEDRN
C#CC(C)(C)N(C)C(=O)N(c1ccccc1)c1ccccc1	ZINC000192851216	333240028	/nfs/dbraw/zinc/24/00/28/333240028.db2.gz	BYJOEHKVWHBNMS-UHFFFAOYSA-N	0	0	292.382	4.288	20	30		CIEDRN
Cc1ccc(C(=O)Nc2ccc(C#N)cc2Cl)c(C)c1	ZINC000225780194	333240477	/nfs/dbraw/zinc/24/04/77/333240477.db2.gz	NDGRVHARCVOYSM-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
CCCCN(C(=O)c1cccc(C#N)c1)[C@@H]1CCC[C@@H](C)C1	ZINC000575896347	335129139	/nfs/dbraw/zinc/12/91/39/335129139.db2.gz	LCBNZLKHBGISSN-CRAIPNDOSA-N	0	0	298.430	4.379	20	30		CIEDRN
CC(C)CN(C(=O)Nc1ccc(C(C)(C)C#N)cc1)C1CC1	ZINC000193046679	333241814	/nfs/dbraw/zinc/24/18/14/333241814.db2.gz	INGGDQOSIJHEJL-UHFFFAOYSA-N	0	0	299.418	4.140	20	30		CIEDRN
C=CCCCNc1cccc(Br)c1C	ZINC000226150980	333251928	/nfs/dbraw/zinc/25/19/28/333251928.db2.gz	KWMCPNPVLVDAAR-UHFFFAOYSA-N	0	0	254.171	4.136	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@H](CC)c1ccccc1	ZINC000193643110	333254544	/nfs/dbraw/zinc/25/45/44/333254544.db2.gz	SPSAQICMLKHXIO-QGZVFWFLSA-N	0	0	299.439	4.457	20	30		CIEDRN
C[C@@H](SCCOc1ccccc1C#N)c1ccccc1	ZINC000195594924	333256673	/nfs/dbraw/zinc/25/66/73/333256673.db2.gz	XUPPNEGQIDYXRE-CQSZACIVSA-N	0	0	283.396	4.431	20	30		CIEDRN
C=CCN(CCc1ccccc1)C(=O)N[C@H](CC)CCC	ZINC000195725841	333262002	/nfs/dbraw/zinc/26/20/02/333262002.db2.gz	SWGAFVJJWAMUFL-QGZVFWFLSA-N	0	0	288.435	4.005	20	30		CIEDRN
CC1(C)CCCC[C@@H]1C(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000194391405	333270368	/nfs/dbraw/zinc/27/03/68/333270368.db2.gz	BLPPINGQLQHYSN-SJORKVTESA-N	0	0	298.430	4.364	20	30		CIEDRN
CCC(=O)c1ccc(O[C@@H](C)c2ccc(C#N)cc2)cc1	ZINC000194622063	333273187	/nfs/dbraw/zinc/27/31/87/333273187.db2.gz	BJRJZHRHEOCIMB-ZDUSSCGKSA-N	0	0	279.339	4.291	20	30		CIEDRN
CC(=O)c1ccc(O[C@@H](C)c2cccc(C#N)c2)cc1F	ZINC000194644111	333274485	/nfs/dbraw/zinc/27/44/85/333274485.db2.gz	PJBBJDUZVGKLKQ-LBPRGKRZSA-N	0	0	283.302	4.040	20	30		CIEDRN
N#Cc1ccc(C(F)(F)F)nc1NCCCC1CCCC1	ZINC000227115177	333276460	/nfs/dbraw/zinc/27/64/60/333276460.db2.gz	IAZQNTWXAOAUTP-UHFFFAOYSA-N	0	0	297.324	4.354	20	30		CIEDRN
N#Cc1ccc(NCc2c(F)cccc2F)c(Cl)c1	ZINC000227217417	333278246	/nfs/dbraw/zinc/27/82/46/333278246.db2.gz	FYCBHQMDFWUXMF-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
CS[C@@H]1CCC[C@@H](Nc2cc(C#N)c3ccccc3n2)C1	ZINC000227652633	333287177	/nfs/dbraw/zinc/28/71/77/333287177.db2.gz	VWIKWCXBMCBWKE-ZIAGYGMSSA-N	0	0	297.427	4.193	20	30		CIEDRN
C[C@H](NCC(F)(F)c1ccccc1)c1ccc(C#N)cc1	ZINC000227899526	333290304	/nfs/dbraw/zinc/29/03/04/333290304.db2.gz	DKHVYJXHCGNFQT-ZDUSSCGKSA-N	0	0	286.325	4.001	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@H](c1ccc(Cl)cc1)C1CC1	ZINC000522575735	333290546	/nfs/dbraw/zinc/29/05/46/333290546.db2.gz	CKJTXWZBGZUTRH-NHYWBVRUSA-N	0	0	292.810	4.055	20	30		CIEDRN
C[C@H](CC(=O)N[C@]1(C#N)CCC[C@@H](C)C1)C1CCCCC1	ZINC000522644450	333294687	/nfs/dbraw/zinc/29/46/87/333294687.db2.gz	WAKIZGFOAXFIBX-IIDMSEBBSA-N	0	0	290.451	4.182	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1ccc(OCCC)c(Cl)c1	ZINC000522654436	333295183	/nfs/dbraw/zinc/29/51/83/333295183.db2.gz	WWWLAUMGXDHSNL-NSHDSACASA-N	0	0	296.798	4.215	20	30		CIEDRN
C[C@H](CCC(C)(C)C)Nc1ncc(C#N)cc1Cl	ZINC000522904880	333299353	/nfs/dbraw/zinc/29/93/53/333299353.db2.gz	VINIOVREXDBKCT-SNVBAGLBSA-N	0	0	265.788	4.233	20	30		CIEDRN
N#Cc1cc(NCCC2=CCCC2)nc2ccccc12	ZINC000229174761	333301183	/nfs/dbraw/zinc/30/11/83/333301183.db2.gz	NCZKHLJYFLPOPM-UHFFFAOYSA-N	0	0	263.344	4.019	20	30		CIEDRN
CCC[C@@H](C#N)NC(=O)c1ccc(C2CCCCC2)cc1	ZINC000522962286	333301444	/nfs/dbraw/zinc/30/14/44/333301444.db2.gz	QIEZCPPRTWELFV-KRWDZBQOSA-N	0	0	284.403	4.156	20	30		CIEDRN
N#Cc1ccc(F)cc1COc1cccc(Cl)c1F	ZINC000229508337	333305695	/nfs/dbraw/zinc/30/56/95/333305695.db2.gz	NHNCZGPZBNIZOP-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
C=C(C)CN(CC)C(=O)C[C@@H](C)c1ccc(CC)cc1	ZINC000523087044	333307435	/nfs/dbraw/zinc/30/74/35/333307435.db2.gz	JXFQCZNFFTYSMY-OAHLLOKOSA-N	0	0	273.420	4.167	20	30		CIEDRN
Cc1ccc(NCc2ccc(F)c(C#N)c2)cc1Cl	ZINC000229721700	333308487	/nfs/dbraw/zinc/30/84/87/333308487.db2.gz	GKXPZRQOGSRKON-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
Cc1cccc(Cl)c1NCc1ccc(F)c(C#N)c1	ZINC000229723997	333308578	/nfs/dbraw/zinc/30/85/78/333308578.db2.gz	QWYGIDOUZSJHNS-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
CCc1c(C)sc(NC(=O)CCC(C)(C)C)c1C#N	ZINC000523110471	333309450	/nfs/dbraw/zinc/30/94/50/333309450.db2.gz	MHQIIWAVARAUMW-UHFFFAOYSA-N	0	0	278.421	4.255	20	30		CIEDRN
CCc1ccc([C@@H](C)CC(=O)NC2(C#N)CCCCC2)cc1	ZINC000523121632	333310067	/nfs/dbraw/zinc/31/00/67/333310067.db2.gz	KLOJLQSDJFWNSE-HNNXBMFYSA-N	0	0	298.430	4.085	20	30		CIEDRN
N#Cc1ccc(F)cc1CSCc1ccccc1	ZINC000229948411	333311868	/nfs/dbraw/zinc/31/18/68/333311868.db2.gz	XHSVSZCUCSJVRA-UHFFFAOYSA-N	0	0	257.333	4.131	20	30		CIEDRN
Cc1ccc2[nH]c(SCc3cc(F)ccc3C#N)nc2c1	ZINC000229949405	333312084	/nfs/dbraw/zinc/31/20/84/333312084.db2.gz	HXXCNSLAFDEOEH-UHFFFAOYSA-N	0	0	297.358	4.174	20	30		CIEDRN
Cc1cccc(SCc2cc(F)ccc2C#N)c1	ZINC000229949970	333312101	/nfs/dbraw/zinc/31/21/01/333312101.db2.gz	PUWKSGPCPCHYOA-UHFFFAOYSA-N	0	0	257.333	4.298	20	30		CIEDRN
C=CCCC(=O)Nc1ccccc1Cc1ccccc1	ZINC000523226237	333313074	/nfs/dbraw/zinc/31/30/74/333313074.db2.gz	TVSMZPLZHWAYQG-UHFFFAOYSA-N	0	0	265.356	4.182	20	30		CIEDRN
N#Cc1cc(F)ccc1NCCc1ccc(Cl)s1	ZINC000230900022	333322439	/nfs/dbraw/zinc/32/24/39/333322439.db2.gz	PZJBTTWWEHKWTQ-UHFFFAOYSA-N	0	0	280.755	4.067	20	30		CIEDRN
C[C@@H](CC(F)(F)F)Nc1ccc(C(F)(F)F)c(C#N)c1	ZINC000231750229	333329035	/nfs/dbraw/zinc/32/90/35/333329035.db2.gz	MNWUSLPKZJDDAG-ZETCQYMHSA-N	0	0	296.214	4.330	20	30		CIEDRN
C[C@H](CC(F)(F)F)Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000231749747	333329203	/nfs/dbraw/zinc/32/92/03/333329203.db2.gz	MIXGJHHMDLUAOG-SSDOTTSWSA-N	0	0	296.214	4.330	20	30		CIEDRN
C=CCN(C(=O)[C@@H](C)c1cccc(C)c1)c1ccccc1	ZINC000523498530	333330085	/nfs/dbraw/zinc/33/00/85/333330085.db2.gz	QBSJSTQTXGIMBQ-INIZCTEOSA-N	0	0	279.383	4.318	20	30		CIEDRN
C=CCCOc1ccc(-c2ccccc2)cc1[N+](=O)[O-]	ZINC000523497452	333330218	/nfs/dbraw/zinc/33/02/18/333330218.db2.gz	GYHVBCVNJSERAV-UHFFFAOYSA-N	0	0	269.300	4.217	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)CCSCCCC	ZINC000523509889	333331353	/nfs/dbraw/zinc/33/13/53/333331353.db2.gz	AFUJWCKTDFBNAP-UHFFFAOYSA-N	0	0	297.489	4.186	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@H](CC)Nc1ccccc1	ZINC000523562954	333333142	/nfs/dbraw/zinc/33/31/42/333333142.db2.gz	CVZKEFHKUYNAIX-KRWDZBQOSA-N	0	0	288.435	4.082	20	30		CIEDRN
CC(C)(C#N)CCCC[S@](=O)Cc1ccc(Cl)cc1	ZINC000232526403	333337975	/nfs/dbraw/zinc/33/79/75/333337975.db2.gz	HTMDJLXFARTYGG-IBGZPJMESA-N	0	0	297.851	4.309	20	30		CIEDRN
CC(C)C1CC(Nc2cccc(OCCCC#N)c2)C1	ZINC000232541568	333338468	/nfs/dbraw/zinc/33/84/68/333338468.db2.gz	SACFIBGEEBUXPI-UHFFFAOYSA-N	0	0	272.392	4.216	20	30		CIEDRN
Cc1ccccc1[C@@H]1C[C@H](C)N(c2ccc(C#N)cc2F)C1	ZINC000303768396	333346146	/nfs/dbraw/zinc/34/61/46/333346146.db2.gz	IYRLNIXQAPHEDP-GOEBONIOSA-N	0	0	294.373	4.388	20	30		CIEDRN
C=CCCCCN(CCC(F)(F)F)CC(F)(F)F	ZINC000575955248	335135006	/nfs/dbraw/zinc/13/50/06/335135006.db2.gz	VWXQABTVEUCGFX-UHFFFAOYSA-N	0	0	277.252	4.159	20	30		CIEDRN
C=CCCSc1nc2cc(Cl)ccc2n1CCOC	ZINC000303884972	333347890	/nfs/dbraw/zinc/34/78/90/333347890.db2.gz	YVQWEXBEYUBCLK-UHFFFAOYSA-N	0	0	296.823	4.004	20	30		CIEDRN
N#Cc1cc(F)c(NCCc2cc3ccccc3o2)c(F)c1	ZINC000303931012	333348492	/nfs/dbraw/zinc/34/84/92/333348492.db2.gz	ZXYYPRVZQWGRHL-UHFFFAOYSA-N	0	0	298.292	4.237	20	30		CIEDRN
C=CCN(CC=C)C(=O)[C@H](C)Sc1cccc(Cl)c1	ZINC000523868914	333348772	/nfs/dbraw/zinc/34/87/72/333348772.db2.gz	AVSGGWZGEULSBG-LBPRGKRZSA-N	0	0	295.835	4.021	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@H](C)CC(C)(C)c1ccccc1	ZINC000523877328	333349005	/nfs/dbraw/zinc/34/90/05/333349005.db2.gz	SYYQPLOGWNKRHW-LSDHHAIUSA-N	0	0	288.435	4.007	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@@H](CC(C)C)c1cccs1	ZINC000523949189	333349881	/nfs/dbraw/zinc/34/98/81/333349881.db2.gz	OGWCCHWLXJAPCJ-OLZOCXBDSA-N	0	0	280.437	4.099	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@H](c1cccs1)C(CC)CC	ZINC000523981590	333350452	/nfs/dbraw/zinc/35/04/52/333350452.db2.gz	HADZIFMCZYYGLE-WFASDCNBSA-N	0	0	294.464	4.489	20	30		CIEDRN
C=CCn1c2ccccc2nc1S[C@H](C)c1cccnc1	ZINC000523981184	333350596	/nfs/dbraw/zinc/35/05/96/333350596.db2.gz	FOGOLQQVBGOIDZ-CYBMUJFWSA-N	0	0	295.411	4.471	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@H](c1ccccc1)C(C)(C)C	ZINC000523986494	333350794	/nfs/dbraw/zinc/35/07/94/333350794.db2.gz	FHCPDRXFUIZCBZ-DZGCQCFKSA-N	0	0	274.408	4.038	20	30		CIEDRN
Cc1nc2ccccc2cc1OCc1ccc(CC#N)cc1	ZINC000575958357	335135359	/nfs/dbraw/zinc/13/53/59/335135359.db2.gz	LUJVRPNLCABHOC-UHFFFAOYSA-N	0	0	288.350	4.188	20	30		CIEDRN
CC(C)C[C@H](C)CC(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000524089711	333353328	/nfs/dbraw/zinc/35/33/28/333353328.db2.gz	ZYDIOHAZQHRBCZ-NSHDSACASA-N	0	0	278.783	4.222	20	30		CIEDRN
COc1cccc(S[C@H](C#N)C2CCCCC2)c1	ZINC000524535203	333365080	/nfs/dbraw/zinc/36/50/80/333365080.db2.gz	RSKWOVNCIMLSHB-OAHLLOKOSA-N	0	0	261.390	4.260	20	30		CIEDRN
C[C@@H](Nc1nccc(C#N)c1Cl)c1ccc(Cl)s1	ZINC000235285474	333367309	/nfs/dbraw/zinc/36/73/09/333367309.db2.gz	DKEAJQKPVZIPQI-SSDOTTSWSA-N	0	0	298.198	4.495	20	30		CIEDRN
Cc1ccccc1[C@@H](C)Nc1nccc(C#N)c1Cl	ZINC000235285863	333367328	/nfs/dbraw/zinc/36/73/28/333367328.db2.gz	YZSQWKLXIUDISJ-LLVKDONJSA-N	0	0	271.751	4.088	20	30		CIEDRN
CC(C)CCCNc1cccc(OCCCC#N)c1	ZINC000338420778	335136254	/nfs/dbraw/zinc/13/62/54/335136254.db2.gz	BCBDCZFZEABZEP-UHFFFAOYSA-N	0	0	260.381	4.217	20	30		CIEDRN
C[C@H](Nc1nccc(C#N)c1Cl)c1ccc(Cl)cc1	ZINC000235538800	333370771	/nfs/dbraw/zinc/37/07/71/333370771.db2.gz	OOERCLHUFMMDGQ-VIFPVBQESA-N	0	0	292.169	4.433	20	30		CIEDRN
CC(C)(C)CCCNc1nc(C(F)(F)F)ccc1C#N	ZINC000313485142	333378736	/nfs/dbraw/zinc/37/87/36/333378736.db2.gz	TXDZGWYHYZQUHQ-UHFFFAOYSA-N	0	0	285.313	4.210	20	30		CIEDRN
N#Cc1cc(Cl)cc(OCc2ccc3ncccc3c2)c1	ZINC000314697643	333381929	/nfs/dbraw/zinc/38/19/29/333381929.db2.gz	BYIGMJGRRFNDIW-UHFFFAOYSA-N	0	0	294.741	4.339	20	30		CIEDRN
C=CCOc1ccccc1CNc1ccc2oc(C)nc2c1	ZINC000237846340	333381980	/nfs/dbraw/zinc/38/19/80/333381980.db2.gz	ZUDSSQAQTFKDGJ-UHFFFAOYSA-N	0	0	294.354	4.313	20	30		CIEDRN
N#Cc1cc(N2CCC[C@H]2C2CCCC2)nc2ccccc12	ZINC000316345593	333388357	/nfs/dbraw/zinc/38/83/57/333388357.db2.gz	QQEVZLRKIMTTGE-SFHVURJKSA-N	0	0	291.398	4.265	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Nc1cccc2c1ccn2C	ZINC000524831974	333389828	/nfs/dbraw/zinc/38/98/28/333389828.db2.gz	LJMHMUIFNLWHBA-UHFFFAOYSA-N	0	0	299.418	4.388	20	30		CIEDRN
CC(C)c1cccc(Oc2c(C#N)nnc3ccccc32)c1	ZINC000524842989	333390182	/nfs/dbraw/zinc/39/01/82/333390182.db2.gz	URVFQOWZUABLBO-UHFFFAOYSA-N	0	0	289.338	4.417	20	30		CIEDRN
Cc1cccc(NCCOc2ccc(C#N)cc2)c1Cl	ZINC000525313358	333408382	/nfs/dbraw/zinc/40/83/82/333408382.db2.gz	HGCXSNXWRSXUAS-UHFFFAOYSA-N	0	0	286.762	4.011	20	30		CIEDRN
CCCn1ccc2ccc(NC(=O)C(C#N)(CC)CC)cc21	ZINC000528712731	333453231	/nfs/dbraw/zinc/45/32/31/333453231.db2.gz	FJNZADLNXIBXKH-UHFFFAOYSA-N	0	0	297.402	4.320	20	30		CIEDRN
CCC(C#N)(CC)C(=O)Nc1nc(CC(C)(C)C)cs1	ZINC000528973137	333467068	/nfs/dbraw/zinc/46/70/68/333467068.db2.gz	NRXZUZXTSDJCGQ-UHFFFAOYSA-N	0	0	293.436	4.000	20	30		CIEDRN
C[C@@H](Nc1ccc(CC#N)cc1)c1ccccc1F	ZINC000037071446	333472191	/nfs/dbraw/zinc/47/21/91/333472191.db2.gz	LUWKKFASLSUIHC-GFCCVEGCSA-N	0	0	254.308	4.065	20	30		CIEDRN
C[C@H](Nc1ccc(CC#N)cc1)c1cccc(F)c1	ZINC000037071533	333472208	/nfs/dbraw/zinc/47/22/08/333472208.db2.gz	RXNNJNQWBUWUHP-LBPRGKRZSA-N	0	0	254.308	4.065	20	30		CIEDRN
C=C(C)CCNc1ccccc1NC(=O)c1ccccc1	ZINC000576025513	335142917	/nfs/dbraw/zinc/14/29/17/335142917.db2.gz	JBZJCCAWSTUUIF-UHFFFAOYSA-N	0	0	280.371	4.317	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1ccc(OC)c2ccccc12	ZINC000529260469	333480329	/nfs/dbraw/zinc/48/03/29/333480329.db2.gz	NDBQGHNTMPPUDB-UHFFFAOYSA-N	0	0	298.386	4.278	20	30		CIEDRN
CC(C)[C@@H](Nc1ccc(C#N)cc1[N+](=O)[O-])c1ccccc1	ZINC000037122341	333487215	/nfs/dbraw/zinc/48/72/15/333487215.db2.gz	RGNRUUFXAGSPIB-QGZVFWFLSA-N	0	0	295.342	4.276	20	30		CIEDRN
N#Cc1cccc(OCCCSc2ccccc2)c1	ZINC000037139234	333497299	/nfs/dbraw/zinc/49/72/99/333497299.db2.gz	PIAIKVDPRRDKSW-UHFFFAOYSA-N	0	0	269.369	4.119	20	30		CIEDRN
N#CC1(C(=O)Nc2cccc(C3CCCCC3)c2)CCC1	ZINC000529651599	333503960	/nfs/dbraw/zinc/50/39/60/333503960.db2.gz	XPBGXPRCQGMOBU-UHFFFAOYSA-N	0	0	282.387	4.367	20	30		CIEDRN
Cc1ccc(F)cc1N[C@H](C)c1cccc(C#N)c1	ZINC000037212748	333514856	/nfs/dbraw/zinc/51/48/56/333514856.db2.gz	ZGEKJADLJNBCPN-GFCCVEGCSA-N	0	0	254.308	4.179	20	30		CIEDRN
C=CCOc1ccccc1CNc1cccc(CC)c1	ZINC000037214348	333515639	/nfs/dbraw/zinc/51/56/39/333515639.db2.gz	QSSLHUVDKZKBNS-UHFFFAOYSA-N	0	0	267.372	4.426	20	30		CIEDRN
C[C@H](CN(C)C(=O)c1cccc(CC#N)c1)C1CCCCC1	ZINC000530041473	333521268	/nfs/dbraw/zinc/52/12/68/333521268.db2.gz	UXCBIMFXCLOCMG-OAHLLOKOSA-N	0	0	298.430	4.041	20	30		CIEDRN
C=CCC(C)(C)c1noc(Cc2cnc3ccccc3c2)n1	ZINC000576008907	335141463	/nfs/dbraw/zinc/14/14/63/335141463.db2.gz	HTKWEUSPOWVFPE-UHFFFAOYSA-N	0	0	293.370	4.062	20	30		CIEDRN
CC1CCC(Nc2cccc(OCCCC#N)c2)CC1	ZINC000037777377	333539468	/nfs/dbraw/zinc/53/94/68/333539468.db2.gz	KUQIJPKKKOELFO-UHFFFAOYSA-N	0	0	272.392	4.360	20	30		CIEDRN
C[C@H]1CCCC[C@H]1Nc1cccc(OCCCC#N)c1	ZINC000037777389	333539561	/nfs/dbraw/zinc/53/95/61/333539561.db2.gz	ZMRLYAKUWPDLNN-WMLDXEAASA-N	0	0	272.392	4.360	20	30		CIEDRN
COc1cc(C)ccc1N[C@H](C)c1ccc(C#N)cc1	ZINC000037783139	333540081	/nfs/dbraw/zinc/54/00/81/333540081.db2.gz	SYFCQOKHJDWSTQ-CYBMUJFWSA-N	0	0	266.344	4.048	20	30		CIEDRN
C=CCN(C(=O)CCc1ccc(Cl)cc1Cl)C1CC1	ZINC000537929412	333547632	/nfs/dbraw/zinc/54/76/32/333547632.db2.gz	ITILHABIYZNFIM-UHFFFAOYSA-N	0	0	298.213	4.103	20	30		CIEDRN
CC1(C(=O)Nc2sc3c(c2C#N)CCCCCC3)CC1	ZINC000124962557	333562847	/nfs/dbraw/zinc/56/28/47/333562847.db2.gz	IAFRAQIOALMTSM-UHFFFAOYSA-N	0	0	288.416	4.017	20	30		CIEDRN
Cc1ncn(Cc2ccc(-c3ccccc3C#N)cc2)c1C	ZINC000125113501	333564013	/nfs/dbraw/zinc/56/40/13/333564013.db2.gz	XGXARFJJHWUQSO-UHFFFAOYSA-N	0	0	287.366	4.087	20	30		CIEDRN
C=C(CC)CSCC(=O)Nc1ccc(C)cc1Cl	ZINC000537993585	333569906	/nfs/dbraw/zinc/56/99/06/333569906.db2.gz	OFWIYEPMBPKGNQ-UHFFFAOYSA-N	0	0	283.824	4.286	20	30		CIEDRN
CC1=C(C(=O)Nc2cc(C(C)(C)C)sc2C#N)CCC1	ZINC000538072016	333572875	/nfs/dbraw/zinc/57/28/75/333572875.db2.gz	PUCRVBWURRNJGS-UHFFFAOYSA-N	0	0	288.416	4.356	20	30		CIEDRN
Cc1cccc(N(C)C(=O)c2ccc(Cl)c(C#N)c2)c1C	ZINC000538267864	333582259	/nfs/dbraw/zinc/58/22/59/333582259.db2.gz	YMNYQAYNSVMQCW-UHFFFAOYSA-N	0	0	298.773	4.105	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1cc2cccc(C)c2o1	ZINC000538332298	333585411	/nfs/dbraw/zinc/58/54/11/333585411.db2.gz	ACMLZTUSAMYPPI-CYBMUJFWSA-N	0	0	271.360	4.216	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)C/C=C\c1ccc(C)cc1	ZINC000538336135	333585857	/nfs/dbraw/zinc/58/58/57/333585857.db2.gz	SXCJIHRUHNYHHX-GQSKFBFOSA-N	0	0	271.404	4.259	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1cc(Cl)ccc1F	ZINC000538341193	333586153	/nfs/dbraw/zinc/58/61/53/333586153.db2.gz	VLAGMZYMZURZCM-JTQLQIEISA-N	0	0	284.762	4.345	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@H](C)c1ccc(Cl)cc1	ZINC000126580190	333600143	/nfs/dbraw/zinc/60/01/43/333600143.db2.gz	PNQUEESEWXYCGR-GFCCVEGCSA-N	0	0	280.799	4.009	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cccc(COCC2CC2)c1	ZINC000126663835	333602099	/nfs/dbraw/zinc/60/20/99/333602099.db2.gz	SGJBDBHXLZMJRB-UHFFFAOYSA-N	0	0	299.414	4.320	20	30		CIEDRN
C=C(CC)CS[C@H](C)c1nc(C(C)(C)C)no1	ZINC000539095075	333657500	/nfs/dbraw/zinc/65/75/00/333657500.db2.gz	PMAIRZFKHUWSOC-SNVBAGLBSA-N	0	0	254.399	4.128	20	30		CIEDRN
CCCCCN(C(=O)c1sccc1C#N)[C@@H](C)CCC	ZINC000128126982	333642994	/nfs/dbraw/zinc/64/29/94/333642994.db2.gz	REVYUFVOOOEJPZ-ZDUSSCGKSA-N	0	0	292.448	4.441	20	30		CIEDRN
C=C[C@H](C)NC(=O)N1CCC[C@H]1c1cccc2ccccc21	ZINC000128140080	333643040	/nfs/dbraw/zinc/64/30/40/333643040.db2.gz	OQFRVTQTELOPKV-KSSFIOAISA-N	0	0	294.398	4.261	20	30		CIEDRN
C=CCCC(=O)N1CCc2cc(Cl)c(Cl)cc2[C@H]1C	ZINC000539035656	333649690	/nfs/dbraw/zinc/64/96/90/333649690.db2.gz	SKHWRTOPLMMBDM-SNVBAGLBSA-N	0	0	298.213	4.405	20	30		CIEDRN
C=C(CC)CS[C@@H](C)C(=O)Nc1ccccc1Cl	ZINC000539094265	333657453	/nfs/dbraw/zinc/65/74/53/333657453.db2.gz	SNYHSMMKWFPYBY-NSHDSACASA-N	0	0	283.824	4.366	20	30		CIEDRN
CC(C)Cn1ncc(NCc2ccc(C#N)cc2)c1C(C)C	ZINC000539224120	333662082	/nfs/dbraw/zinc/66/20/82/333662082.db2.gz	YTFJJMBZHHIKAZ-UHFFFAOYSA-N	0	0	296.418	4.146	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N1CCC[C@]2(CC=CCC2)C1	ZINC000539390741	333668793	/nfs/dbraw/zinc/66/87/93/333668793.db2.gz	WBFLNWQIPYLLGK-FUHWJXTLSA-N	0	0	290.451	4.263	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1cccc(SCC)c1	ZINC000539435605	333671398	/nfs/dbraw/zinc/67/13/98/333671398.db2.gz	NLMNDXHBECGNIA-ZDUSSCGKSA-N	0	0	277.433	4.273	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)C[C@H](C)c1ccccc1F	ZINC000539438090	333671471	/nfs/dbraw/zinc/67/14/71/333671471.db2.gz	VETYUDRYCKOFJT-UONOGXRCSA-N	0	0	277.383	4.180	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N(CC)Cc1ccc(C)cc1	ZINC000539469423	333672810	/nfs/dbraw/zinc/67/28/10/333672810.db2.gz	OIFWMFOORMPRID-INIZCTEOSA-N	0	0	288.435	4.271	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N(Cc1ccccc1)C(C)C	ZINC000539475117	333673007	/nfs/dbraw/zinc/67/30/07/333673007.db2.gz	GKJQSKCMOQTMDR-INIZCTEOSA-N	0	0	288.435	4.351	20	30		CIEDRN
C[C@@H](NCc1ccc(C#N)o1)c1cccc(Cl)c1Cl	ZINC000174407626	335153983	/nfs/dbraw/zinc/15/39/83/335153983.db2.gz	YRQUVINKTJLHRG-SECBINFHSA-N	0	0	295.169	4.309	20	30		CIEDRN
CCC[C@@H](CC)SCCCC1(C#N)CCOCC1	ZINC000539708505	333686488	/nfs/dbraw/zinc/68/64/88/333686488.db2.gz	DOUJDIQXPYSUFD-CQSZACIVSA-N	0	0	269.454	4.399	20	30		CIEDRN
CCSc1ccccc1OCc1cc(C#N)ccc1OC	ZINC000539951040	333704237	/nfs/dbraw/zinc/70/42/37/333704237.db2.gz	MCWCTULLVQHWDW-UHFFFAOYSA-N	0	0	299.395	4.258	20	30		CIEDRN
C=C[C@H](CC(=O)N1[C@H](CC)CC[C@@H]1C)c1ccccc1	ZINC000540091863	333709647	/nfs/dbraw/zinc/70/96/47/333709647.db2.gz	RJEOAEPCEXGDKS-ZMSDIMECSA-N	0	0	271.404	4.136	20	30		CIEDRN
C=C(CC)CSCCC(=O)Nc1ccccc1OCC	ZINC000540193253	333720124	/nfs/dbraw/zinc/72/01/24/333720124.db2.gz	KEXOAELTUQHROU-UHFFFAOYSA-N	0	0	293.432	4.113	20	30		CIEDRN
C=C(CC)CSCc1nccn1Cc1ccccc1	ZINC000540194506	333720313	/nfs/dbraw/zinc/72/03/13/333720313.db2.gz	NSRUCXGMAKTXCL-UHFFFAOYSA-N	0	0	272.417	4.131	20	30		CIEDRN
C=C(CC)CS[C@H](C)C(=O)Nc1ccccc1C	ZINC000540193965	333720316	/nfs/dbraw/zinc/72/03/16/333720316.db2.gz	FXKAJJBHKPOXFI-CYBMUJFWSA-N	0	0	263.406	4.021	20	30		CIEDRN
C=C(CC)CSc1nc2ccccc2c(=O)n1C(C)C	ZINC000540217950	333721772	/nfs/dbraw/zinc/72/17/72/333721772.db2.gz	VXBUCZNFLIRMLM-UHFFFAOYSA-N	0	0	288.416	4.036	20	30		CIEDRN
C=CCN(CC=C)C(=O)CCCc1ccc2ccccc2c1	ZINC000540465242	333730882	/nfs/dbraw/zinc/73/08/82/333730882.db2.gz	JFLMZSUPYLTRAG-UHFFFAOYSA-N	0	0	293.410	4.363	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N(C)C[C@H](C)c1ccccc1	ZINC000540487800	333731861	/nfs/dbraw/zinc/73/18/61/333731861.db2.gz	AHVJQHKCPPSBEL-JKSUJKDBSA-N	0	0	288.435	4.176	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N1CCC2(C1)CCCCC2	ZINC000540489129	333731880	/nfs/dbraw/zinc/73/18/80/333731880.db2.gz	PMEOMUKLBQXRKI-HNNXBMFYSA-N	0	0	278.440	4.097	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1cc(Cl)ccc1Cl	ZINC000540532175	333734205	/nfs/dbraw/zinc/73/42/05/333734205.db2.gz	OLDPOMWUMKAPRJ-JTQLQIEISA-N	0	0	286.202	4.468	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)CCc1cc(C)cc(C)c1	ZINC000540533174	333734243	/nfs/dbraw/zinc/73/42/43/333734243.db2.gz	RMXIOLQWNPGFPR-MRXNPFEDSA-N	0	0	273.420	4.097	20	30		CIEDRN
C[C@@H](SCC1(C#N)CC1)c1ccc(Cl)cc1	ZINC000540614648	333738410	/nfs/dbraw/zinc/73/84/10/333738410.db2.gz	RZBOVRPKXYSROK-SNVBAGLBSA-N	0	0	251.782	4.438	20	30		CIEDRN
N#CC1(CSCc2cccc(C(F)(F)F)c2)CC1	ZINC000540614716	333738412	/nfs/dbraw/zinc/73/84/12/333738412.db2.gz	WMKPFQTXUOKZCZ-UHFFFAOYSA-N	0	0	271.307	4.242	20	30		CIEDRN
C=CCC[C@@H](Nc1ccc(NC(C)=O)c(Cl)c1)C1CC1	ZINC000540700637	333742303	/nfs/dbraw/zinc/74/23/03/333742303.db2.gz	DMNKMDCVEBLFRE-OAHLLOKOSA-N	0	0	292.810	4.455	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)CC(C)(C)c1ccccc1	ZINC000069178259	333753933	/nfs/dbraw/zinc/75/39/33/333753933.db2.gz	AXZDJCGETUMGCS-UHFFFAOYSA-N	0	0	292.382	4.173	20	30		CIEDRN
CCCC[C@H](Sc1cccc(Cl)c1C#N)C(=O)OC	ZINC000541171770	333763555	/nfs/dbraw/zinc/76/35/55/333763555.db2.gz	DXGRZAAWUMDMQB-ZDUSSCGKSA-N	0	0	297.807	4.036	20	30		CIEDRN
C/C(=C/c1cccc(C(F)(F)F)c1)CN(C)C[C@H](C)C#N	ZINC000576147931	335160509	/nfs/dbraw/zinc/16/05/09/335160509.db2.gz	SOSNXXSNBARWOI-FFXRNRBCSA-N	0	0	296.336	4.200	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(NCc2ccc([C@@H]3C[C@H]3C)o2)c1	ZINC000542519903	333830481	/nfs/dbraw/zinc/83/04/81/333830481.db2.gz	VASVWZAGGGIAFX-BDJLRTHQSA-N	0	0	294.354	4.089	20	30		CIEDRN
Cc1ccc(N2CC[C@@H](c3ccccc3)C[C@H]2C)nc1C#N	ZINC000543065964	333854869	/nfs/dbraw/zinc/85/48/69/333854869.db2.gz	BGJJNIKUJHVOIK-NVXWUHKLSA-N	0	0	291.398	4.034	20	30		CIEDRN
Cc1ccnc(N[C@@H](C)c2c(F)cccc2Cl)c1C#N	ZINC000543137635	333859838	/nfs/dbraw/zinc/85/98/38/333859838.db2.gz	ACVSUXLTJXWICG-JTQLQIEISA-N	0	0	289.741	4.227	20	30		CIEDRN
C=CCC[C@H](C)Nc1cc(OC)c(Cl)cc1OC	ZINC000130656705	333865304	/nfs/dbraw/zinc/86/53/04/333865304.db2.gz	HNWTXBWUMNWZIV-JTQLQIEISA-N	0	0	269.772	4.124	20	30		CIEDRN
C=CCN(C(=O)[C@H](c1cccc(Cl)c1)C(C)C)C1CC1	ZINC000543455110	333876079	/nfs/dbraw/zinc/87/60/79/333876079.db2.gz	QWYXNLSCPMSNAU-INIZCTEOSA-N	0	0	291.822	4.257	20	30		CIEDRN
N#Cc1ccncc1NC1CCC(c2ccc(F)cc2)CC1	ZINC000543789848	333898893	/nfs/dbraw/zinc/89/88/93/333898893.db2.gz	GZTHVFHXPNYOHD-UHFFFAOYSA-N	0	0	295.361	4.231	20	30		CIEDRN
N#Cc1c(Cl)cccc1S[C@H]1Cc2ccccc2C1=O	ZINC000543958532	333906848	/nfs/dbraw/zinc/90/68/48/333906848.db2.gz	OELFATHGTDDSFA-HNNXBMFYSA-N	0	0	299.782	4.111	20	30		CIEDRN
N#Cc1nc(N2CCCC[C@H]2c2ccccc2)ccc1Cl	ZINC000544022991	333910803	/nfs/dbraw/zinc/91/08/03/333910803.db2.gz	ALMMQMKQUFUSSV-INIZCTEOSA-N	0	0	297.789	4.338	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cc(F)c(SC)c(F)c1	ZINC000544066873	333913968	/nfs/dbraw/zinc/91/39/68/333913968.db2.gz	ZAQVUQLLOBJDIC-UHFFFAOYSA-N	0	0	297.370	4.394	20	30		CIEDRN
N#Cc1cccc(-c2nc(CCC3CCCCC3)no2)c1	ZINC000544141706	333918337	/nfs/dbraw/zinc/91/83/37/333918337.db2.gz	IGKIEMSROQSDJM-UHFFFAOYSA-N	0	0	281.359	4.121	20	30		CIEDRN
C[C@@H]1CCC[C@H](c2noc(CCc3ccc(C#N)cc3)n2)C1	ZINC000544263685	333923183	/nfs/dbraw/zinc/92/31/83/333923183.db2.gz	WVGKVXJAHMTSKC-CJNGLKHVSA-N	0	0	295.386	4.020	20	30		CIEDRN
C[C@H](CCC(C)(C)C)C(=O)Nc1ccc(F)cc1C#N	ZINC000544447921	333931811	/nfs/dbraw/zinc/93/18/11/333931811.db2.gz	UECBOGBKOVDEGE-LLVKDONJSA-N	0	0	276.355	4.098	20	30		CIEDRN
C[C@H](NCC#N)c1ccc(-c2ccc(Cl)cc2)s1	ZINC000544521753	333934260	/nfs/dbraw/zinc/93/42/60/333934260.db2.gz	DPCIBZXVAKBCPJ-JTQLQIEISA-N	0	0	276.792	4.243	20	30		CIEDRN
C=CCC[C@H](C)Nc1cnn(CC(C)C)c1C(F)F	ZINC000544573460	333936768	/nfs/dbraw/zinc/93/67/68/333936768.db2.gz	RWWYXRQRRNXFQK-NSHDSACASA-N	0	0	271.355	4.243	20	30		CIEDRN
C=CCn1c(SC[C@@H]2CCC[C@H](C)C2)nnc1C1CC1	ZINC000544857941	333949447	/nfs/dbraw/zinc/94/94/47/333949447.db2.gz	CCTHVLMVPMKHJC-QWHCGFSZSA-N	0	0	291.464	4.260	20	30		CIEDRN
C=C[C@H](Cc1nc(-c2nc(C)cs2)no1)c1ccccc1	ZINC000545080380	333962311	/nfs/dbraw/zinc/96/23/11/333962311.db2.gz	CPLNCIIFELHKKZ-GFCCVEGCSA-N	0	0	297.383	4.014	20	30		CIEDRN
Cc1cc(CSc2cc(C#N)ccn2)c2ccccc2n1	ZINC000074015788	333982079	/nfs/dbraw/zinc/98/20/79/333982079.db2.gz	ORKNCDNUPNAJMB-UHFFFAOYSA-N	0	0	291.379	4.102	20	30		CIEDRN
C=C[C@H](Cc1nc(-c2cccc(F)c2)no1)c1ccccc1	ZINC000545533094	333987164	/nfs/dbraw/zinc/98/71/64/333987164.db2.gz	OTDJZNIBDOTUIU-CYBMUJFWSA-N	0	0	294.329	4.388	20	30		CIEDRN
Cc1cc2cc(C(=O)c3ccc(C#N)cc3)oc2cc1C	ZINC000545829536	334002427	/nfs/dbraw/zinc/00/24/27/334002427.db2.gz	KHLABXPDAQANRJ-UHFFFAOYSA-N	0	0	275.307	4.152	20	30		CIEDRN
C=CCCC(=O)NCC[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000074387723	334005154	/nfs/dbraw/zinc/00/51/54/334005154.db2.gz	PPNWLGKKSHANNO-LBPRGKRZSA-N	0	0	299.336	4.281	20	30		CIEDRN
C[C@@H](CC1CCCCC1)C(=O)Nc1ccccc1C#N	ZINC000074396850	334005336	/nfs/dbraw/zinc/00/53/36/334005336.db2.gz	WLXZELQWKAKKSF-ZDUSSCGKSA-N	0	0	270.376	4.103	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(O)c2ccccc12	ZINC000545954601	334009109	/nfs/dbraw/zinc/00/91/09/334009109.db2.gz	PMLBYNIUBZMUGF-LBPRGKRZSA-N	0	0	269.344	4.086	20	30		CIEDRN
C=CCC(CC=C)C(=O)NC1(c2ccc(Cl)cc2)CC1	ZINC000132888117	334009179	/nfs/dbraw/zinc/00/91/79/334009179.db2.gz	TYHYPYMMVADDDO-UHFFFAOYSA-N	0	0	289.806	4.214	20	30		CIEDRN
N#Cc1cc(-c2ccccc2)sc1NC(=O)CC1CCC1	ZINC000074719733	334012382	/nfs/dbraw/zinc/01/23/82/334012382.db2.gz	CGRJMRRKWNNWJP-UHFFFAOYSA-N	0	0	296.395	4.415	20	30		CIEDRN
CC(C)c1ccc(C(=O)Nc2ccc(F)c(C#N)c2)s1	ZINC000546185292	334018933	/nfs/dbraw/zinc/01/89/33/334018933.db2.gz	ZNIFKVOVZMXLHV-UHFFFAOYSA-N	0	0	288.347	4.135	20	30		CIEDRN
C=CCC(CC=C)c1nc(Cc2cc(C)ccc2OC)no1	ZINC000546247936	334022434	/nfs/dbraw/zinc/02/24/34/334022434.db2.gz	UEGQZVFSOGUVFS-UHFFFAOYSA-N	0	0	298.386	4.213	20	30		CIEDRN
C=CCCOCCCCc1nc([C@H]2CCCC[C@@H]2C)no1	ZINC000546396788	334030631	/nfs/dbraw/zinc/03/06/31/334030631.db2.gz	ZAPOICHEWNEFPM-GJZGRUSLSA-N	0	0	292.423	4.279	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@]1(C)CCCc2ccccc21	ZINC000546526462	334037422	/nfs/dbraw/zinc/03/74/22/334037422.db2.gz	JDXQHRUVOPPOPL-LJQANCHMSA-N	0	0	283.415	4.123	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N[C@H](C)c1c(F)cccc1Cl	ZINC000546667736	334044841	/nfs/dbraw/zinc/04/48/41/334044841.db2.gz	UVFXCOPUWICOIV-MNOVXSKESA-N	0	0	298.789	4.194	20	30		CIEDRN
C=CCC[C@H](NC(=O)c1ccc(C)o1)c1ccccc1	ZINC000133708555	334050799	/nfs/dbraw/zinc/05/07/99/334050799.db2.gz	UHMIBKOOLMIAAN-HNNXBMFYSA-N	0	0	269.344	4.025	20	30		CIEDRN
C=CCC[C@H](NC(=O)CCCCSC)c1ccccc1	ZINC000133717897	334050971	/nfs/dbraw/zinc/05/09/71/334050971.db2.gz	USDZHFCHPKNDMQ-INIZCTEOSA-N	0	0	291.460	4.343	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@H](C(C)C)CC1	ZINC000133751337	334053476	/nfs/dbraw/zinc/05/34/76/334053476.db2.gz	URUQZRSZMBZEEU-HNNXBMFYSA-N	0	0	263.425	4.040	20	30		CIEDRN
C=C[C@H](Cc1nc(-c2ccc(F)cc2)no1)c1ccccc1	ZINC000546956966	334057621	/nfs/dbraw/zinc/05/76/21/334057621.db2.gz	YJTYIULIBIBTID-CYBMUJFWSA-N	0	0	294.329	4.388	20	30		CIEDRN
C=CCC[C@H](NC(=O)CCC1CC1)c1ccccc1	ZINC000133811913	334059458	/nfs/dbraw/zinc/05/94/58/334059458.db2.gz	VJSJVYPDVYBCMB-INIZCTEOSA-N	0	0	257.377	4.000	20	30		CIEDRN
CCSc1ccccc1OCc1ccc(C#N)cc1	ZINC000133818337	334059902	/nfs/dbraw/zinc/05/99/02/334059902.db2.gz	FGNTVYSFQQTYIL-UHFFFAOYSA-N	0	0	269.369	4.249	20	30		CIEDRN
C=CCCO[C@@H](C)c1nc(-c2cc(C)cc(C)c2)no1	ZINC000547103178	334066685	/nfs/dbraw/zinc/06/66/85/334066685.db2.gz	ZEDCQUVUIXAQHV-ZDUSSCGKSA-N	0	0	272.348	4.007	20	30		CIEDRN
C=CCCc1nc(Cc2cc(Cl)ccc2Cl)no1	ZINC000547142111	334068817	/nfs/dbraw/zinc/06/88/17/334068817.db2.gz	AIFVCFDTEMBZBJ-UHFFFAOYSA-N	0	0	283.158	4.086	20	30		CIEDRN
C[C@H](Cc1noc(-c2cc(C#N)cs2)n1)c1ccccc1	ZINC000547177234	334070870	/nfs/dbraw/zinc/07/08/70/334070870.db2.gz	PLVVZIUUNOFHKG-LLVKDONJSA-N	0	0	295.367	4.016	20	30		CIEDRN
C=CCC[C@H](NC(=O)C[C@H]1C=CCC1)c1ccccc1	ZINC000133942530	334074011	/nfs/dbraw/zinc/07/40/11/334074011.db2.gz	HDFYCDMOPINADQ-RDJZCZTQSA-N	0	0	269.388	4.166	20	30		CIEDRN
CC[C@H](CC#N)NCc1ccc(-c2ccc(Cl)cc2)o1	ZINC000547285402	334076008	/nfs/dbraw/zinc/07/60/08/334076008.db2.gz	SZWFXSKCOFGBLU-CQSZACIVSA-N	0	0	288.778	4.382	20	30		CIEDRN
CC[C@H](CC#N)NCc1ccc(-c2ccccc2)cc1F	ZINC000547287174	334076127	/nfs/dbraw/zinc/07/61/27/334076127.db2.gz	FXGHBDJTNICNKC-QGZVFWFLSA-N	0	0	282.362	4.275	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](C)c1ccccc1OC(C)C	ZINC000547337498	334080842	/nfs/dbraw/zinc/08/08/42/334080842.db2.gz	BZBSFWZUHGVRGE-GJZGRUSLSA-N	0	0	289.419	4.253	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2ccc(F)c(C)c2)no1	ZINC000547346336	334081820	/nfs/dbraw/zinc/08/18/20/334081820.db2.gz	BIGBTPATFLFFQW-LLVKDONJSA-N	0	0	260.312	4.254	20	30		CIEDRN
N#Cc1ccc(NC[C@H]2CCOc3ccccc32)cc1Cl	ZINC000134510557	334092723	/nfs/dbraw/zinc/09/27/23/334092723.db2.gz	NFJDJPYNLUKOAP-CYBMUJFWSA-N	0	0	298.773	4.190	20	30		CIEDRN
C=CC[C@H](C)Nc1ncc(C(F)(F)F)cc1Cl	ZINC000134715787	334101594	/nfs/dbraw/zinc/10/15/94/334101594.db2.gz	MMTVTASKIGRAJV-ZETCQYMHSA-N	0	0	264.678	4.130	20	30		CIEDRN
C=CCn1c2ccccc2nc1SCc1ncccc1C	ZINC000547627575	334103982	/nfs/dbraw/zinc/10/39/82/334103982.db2.gz	LBWQZUKHTRZREJ-UHFFFAOYSA-N	0	0	295.411	4.218	20	30		CIEDRN
N#Cc1ccc(Cl)cc1N[C@H]1CCc2cc(F)ccc21	ZINC000134825496	334105355	/nfs/dbraw/zinc/10/53/55/334105355.db2.gz	FBMOGMPAYNQQNC-HNNXBMFYSA-N	0	0	286.737	4.450	20	30		CIEDRN
N#Cc1cc(F)ccc1CSc1nc2ccccc2o1	ZINC000077564732	334108628	/nfs/dbraw/zinc/10/86/28/334108628.db2.gz	SDSMGKAALGUKTP-UHFFFAOYSA-N	0	0	284.315	4.131	20	30		CIEDRN
Cc1cc([C@H](C)Nc2nccc(C)c2C#N)c(C)s1	ZINC000135068550	334114419	/nfs/dbraw/zinc/11/44/19/334114419.db2.gz	QCVJXOMMFJLWAU-NSHDSACASA-N	0	0	271.389	4.113	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@@H](CC)c1cc(F)ccc1F	ZINC000077857683	334116874	/nfs/dbraw/zinc/11/68/74/334116874.db2.gz	OOWGKCFSWQVDOH-HNNXBMFYSA-N	0	0	296.361	4.024	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@H](CC)c1cc(F)ccc1F	ZINC000077857685	334116891	/nfs/dbraw/zinc/11/68/91/334116891.db2.gz	OOWGKCFSWQVDOH-OAHLLOKOSA-N	0	0	296.361	4.024	20	30		CIEDRN
CC(C)[C@H]([NH2+]Cc1ccc(C#N)o1)c1ccc(Cl)cc1	ZINC000135137727	334117336	/nfs/dbraw/zinc/11/73/36/334117336.db2.gz	USJOOIFRNCWVBN-INIZCTEOSA-N	0	0	288.778	4.292	20	30		CIEDRN
C=CCN(CC=C)C(=O)Nc1cccc(C(F)(F)F)c1C	ZINC000135196254	334119595	/nfs/dbraw/zinc/11/95/95/334119595.db2.gz	XSABWQBQCYLVET-UHFFFAOYSA-N	0	0	298.308	4.220	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1cccc(C(F)(F)F)c1C	ZINC000135237451	334120702	/nfs/dbraw/zinc/12/07/02/334120702.db2.gz	HEPVDORZEOEIAS-SECBINFHSA-N	0	0	286.297	4.100	20	30		CIEDRN
C[C@@H](CC#N)NC(=O)Nc1ccc2oc3ccccc3c2c1	ZINC000547823875	334123135	/nfs/dbraw/zinc/12/31/35/334123135.db2.gz	NCSVYQWMRIJOTM-NSHDSACASA-N	0	0	293.326	4.010	20	30		CIEDRN
C[C@H](CC#N)NC(=O)Nc1ccc2oc3ccccc3c2c1	ZINC000547823874	334123169	/nfs/dbraw/zinc/12/31/69/334123169.db2.gz	NCSVYQWMRIJOTM-LLVKDONJSA-N	0	0	293.326	4.010	20	30		CIEDRN
CCCN(CC#N)C(=O)C[C@@H](C)c1ccc(C(C)C)cc1	ZINC000078082797	334123460	/nfs/dbraw/zinc/12/34/60/334123460.db2.gz	DDFAEXOLLNJEPF-OAHLLOKOSA-N	0	0	286.419	4.066	20	30		CIEDRN
Cc1cc(NC(=O)N(CCC#N)CC2CC2)ccc1C1CC1	ZINC000547845682	334126667	/nfs/dbraw/zinc/12/66/67/334126667.db2.gz	PWZJYPQFAYVEHT-UHFFFAOYSA-N	0	0	297.402	4.030	20	30		CIEDRN
CCCOc1cccc(NCc2cc(C#N)ccc2F)c1	ZINC000078279794	334129753	/nfs/dbraw/zinc/12/97/53/334129753.db2.gz	SRPLDNZTNVQKHD-UHFFFAOYSA-N	0	0	284.334	4.098	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@H](C)Cc1ccsc1)c1ccccc1	ZINC000547953918	334131251	/nfs/dbraw/zinc/13/12/51/334131251.db2.gz	CQXYRUPNSNVCJP-RHSMWYFYSA-N	0	0	299.439	4.155	20	30		CIEDRN
C=CCCCCCN(C)C(=O)C1CCC(F)(F)CC1	ZINC000135490133	334131719	/nfs/dbraw/zinc/13/17/19/334131719.db2.gz	YXTMQKRXTWEVRU-UHFFFAOYSA-N	0	0	273.367	4.017	20	30		CIEDRN
CC(C)Oc1ccc(OCCCC(C)(C)C#N)cc1	ZINC000135505006	334132039	/nfs/dbraw/zinc/13/20/39/334132039.db2.gz	PJMVYNPDAZROBX-UHFFFAOYSA-N	0	0	261.365	4.183	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)N[C@@H]1CCCC1(C)C	ZINC000078366216	334132211	/nfs/dbraw/zinc/13/22/11/334132211.db2.gz	INRXZZUZEPBZIZ-CQSZACIVSA-N	0	0	292.448	4.024	20	30		CIEDRN
CC(C)CCN(CCC#N)C(=O)C[C@@H](C)C1CCCCC1	ZINC000078419708	334133313	/nfs/dbraw/zinc/13/33/13/334133313.db2.gz	WUCMVZDGTXFZSU-MRXNPFEDSA-N	0	0	292.467	4.381	20	30		CIEDRN
CCCCc1ccc(NC(=O)N(CCC#N)CC2CC2)cc1	ZINC000078440137	334133732	/nfs/dbraw/zinc/13/37/32/334133732.db2.gz	BLTZCUHERKKIDI-UHFFFAOYSA-N	0	0	299.418	4.187	20	30		CIEDRN
Cc1cc(C)cc(NC(=O)N(CCC#N)CCC(C)C)c1	ZINC000078452951	334133890	/nfs/dbraw/zinc/13/38/90/334133890.db2.gz	HSZPZDBVJROOHS-UHFFFAOYSA-N	0	0	287.407	4.097	20	30		CIEDRN
C=CCCCNC(=O)c1sc(C2CCCCC2)nc1C	ZINC000548065118	334137896	/nfs/dbraw/zinc/13/78/96/334137896.db2.gz	JFTIYOFJRARANB-UHFFFAOYSA-N	0	0	292.448	4.195	20	30		CIEDRN
CC[C@@H]1CCCC[C@@H]1Nc1nc(C(F)(F)F)ccc1C#N	ZINC000078833788	334141294	/nfs/dbraw/zinc/14/12/94/334141294.db2.gz	KHEBKAUQNKCULJ-PWSUYJOCSA-N	0	0	297.324	4.353	20	30		CIEDRN
C[C@@H](Sc1ccncc1C#N)c1ccc(Cl)cc1	ZINC000548152378	334143191	/nfs/dbraw/zinc/14/31/91/334143191.db2.gz	HLVMIHUORNMHGV-SNVBAGLBSA-N	0	0	274.776	4.460	20	30		CIEDRN
CCC(=O)Nc1ccc(N[C@H](C)c2ccc(C#N)cc2)cc1	ZINC000078990111	334145100	/nfs/dbraw/zinc/14/51/00/334145100.db2.gz	RJVXSBXCFLAENR-CYBMUJFWSA-N	0	0	293.370	4.080	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CCCCC[C@H]1C)c1ccccc1	ZINC000548252262	334147147	/nfs/dbraw/zinc/14/71/47/334147147.db2.gz	CSQWXCDJBYNEJS-CVEARBPZSA-N	0	0	271.404	4.137	20	30		CIEDRN
C=C(C)CSCc1csc(-c2ccco2)n1	ZINC000079093251	334147654	/nfs/dbraw/zinc/14/76/54/334147654.db2.gz	NSMPXPQJZVIGRS-UHFFFAOYSA-N	0	0	251.376	4.212	20	30		CIEDRN
C=CC[C@@H](C(=O)NCCCc1cccs1)c1ccccc1	ZINC000548288155	334148797	/nfs/dbraw/zinc/14/87/97/334148797.db2.gz	VIZRSNIDLBAZCE-QGZVFWFLSA-N	0	0	299.439	4.157	20	30		CIEDRN
C=C[C@H](Cc1nc(Cc2ccccc2)no1)c1ccccc1	ZINC000136293540	334151429	/nfs/dbraw/zinc/15/14/29/334151429.db2.gz	WXYQHKRLUFOMAJ-MRXNPFEDSA-N	0	0	290.366	4.173	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@H](C)c1cc(C)sc1C	ZINC000079336217	334151814	/nfs/dbraw/zinc/15/18/14/334151814.db2.gz	HHUWYTLHVZHRQK-GFCCVEGCSA-N	0	0	280.437	4.034	20	30		CIEDRN
CC[C@H]1CCCN(c2cc(C#N)c3ccccc3n2)CC1	ZINC000079343515	334151989	/nfs/dbraw/zinc/15/19/89/334151989.db2.gz	AHMCVCDJTKJDCG-AWEZNQCLSA-N	0	0	279.387	4.123	20	30		CIEDRN
CCc1ccc(NC(=O)c2cccc(SCC#N)c2)cc1	ZINC000079381442	334152989	/nfs/dbraw/zinc/15/29/89/334152989.db2.gz	BNPIYRRZESRDNB-UHFFFAOYSA-N	0	0	296.395	4.117	20	30		CIEDRN
N#Cc1cc(Cl)ccc1CSC[C@@H]1CCCCO1	ZINC000548469943	334158451	/nfs/dbraw/zinc/15/84/51/334158451.db2.gz	XJEFLYUJCOLSIA-AWEZNQCLSA-N	0	0	281.808	4.014	20	30		CIEDRN
Cc1cc(C)cc(NC(=O)c2ccc(C#N)c(Cl)c2)c1	ZINC000548630901	334164368	/nfs/dbraw/zinc/16/43/68/334164368.db2.gz	ASPMBUCVIGBLSK-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)Cc1cccc(C)c1	ZINC000548749073	334169022	/nfs/dbraw/zinc/16/90/22/334169022.db2.gz	SYZXUBGWNLELSS-UHFFFAOYSA-N	0	0	293.410	4.142	20	30		CIEDRN
C=CCNC(=O)N([C@@H](C)c1ccc2ccccc2c1)C1CC1	ZINC000080596228	334172683	/nfs/dbraw/zinc/17/26/83/334172683.db2.gz	GXPGWBPTBWBIQP-AWEZNQCLSA-N	0	0	294.398	4.261	20	30		CIEDRN
N#Cc1cc(NCc2ncc(-c3cccs3)o2)ccc1F	ZINC000080757669	334173299	/nfs/dbraw/zinc/17/32/99/334173299.db2.gz	GRKUSJXHKSKUIJ-UHFFFAOYSA-N	0	0	299.330	4.026	20	30		CIEDRN
C=CCCc1ccccc1NCc1ccc2[nH]cnc2c1	ZINC000548780048	334173771	/nfs/dbraw/zinc/17/37/71/334173771.db2.gz	FIJKJBWEMXKVGM-UHFFFAOYSA-N	0	0	277.371	4.294	20	30		CIEDRN
CCc1nccn1Cc1ccc(-c2ccccc2C#N)cc1	ZINC000080877277	334174883	/nfs/dbraw/zinc/17/48/83/334174883.db2.gz	PXBOQWWYPJUDIL-UHFFFAOYSA-N	0	0	287.366	4.032	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)Nc1cccc(F)c1C	ZINC000081158058	334179649	/nfs/dbraw/zinc/17/96/49/334179649.db2.gz	APNLXBKAYANJBA-UHFFFAOYSA-N	0	0	298.361	4.354	20	30		CIEDRN
CO[C@@H](CSc1ccc(C#N)cc1)c1ccccc1	ZINC000548966410	334181560	/nfs/dbraw/zinc/18/15/60/334181560.db2.gz	ZVRBVRCMJBQOBY-INIZCTEOSA-N	0	0	269.369	4.038	20	30		CIEDRN
CO[C@H](CSc1ccc(C#N)cc1)c1ccccc1	ZINC000548966412	334181645	/nfs/dbraw/zinc/18/16/45/334181645.db2.gz	ZVRBVRCMJBQOBY-MRXNPFEDSA-N	0	0	269.369	4.038	20	30		CIEDRN
Cc1cc(Cl)c2ncc(C#N)c(N3CCC[C@@H]3C)c2c1	ZINC000548987666	334182000	/nfs/dbraw/zinc/18/20/00/334182000.db2.gz	GDQOGCGHKYWLFK-NSHDSACASA-N	0	0	285.778	4.057	20	30		CIEDRN
COC1(CCSc2cccc(Cl)c2C#N)CCC1	ZINC000549058105	334183974	/nfs/dbraw/zinc/18/39/74/334183974.db2.gz	KPVGBXNXBKDMQO-UHFFFAOYSA-N	0	0	281.808	4.263	20	30		CIEDRN
C=CCC1(C(=O)NCC2CC(c3ccccc3)C2)CCC1	ZINC000549316754	334189963	/nfs/dbraw/zinc/18/99/63/334189963.db2.gz	SJPAJYZIDVHUQZ-UHFFFAOYSA-N	0	0	283.415	4.043	20	30		CIEDRN
CCc1nc(C(C)C)ccc1CSc1ccc(C#N)cn1	ZINC000549346883	334190783	/nfs/dbraw/zinc/19/07/83/334190783.db2.gz	FLWWLLNLKAIMDP-UHFFFAOYSA-N	0	0	297.427	4.326	20	30		CIEDRN
CCc1ccc(CSc2ccc(C#N)cc2Cl)nc1	ZINC000549374725	334191660	/nfs/dbraw/zinc/19/16/60/334191660.db2.gz	SKWVWSFRCYFJEZ-UHFFFAOYSA-N	0	0	288.803	4.461	20	30		CIEDRN
C=CC[C@@H](C(=O)N(C)Cc1sccc1C)c1ccccc1	ZINC000549574603	334198495	/nfs/dbraw/zinc/19/84/95/334198495.db2.gz	WUXLKEXNBJAZTF-MRXNPFEDSA-N	0	0	299.439	4.375	20	30		CIEDRN
CC[C@@H](CC(=O)Nc1ccccc1CC#N)c1ccccc1	ZINC000549713570	334202618	/nfs/dbraw/zinc/20/26/18/334202618.db2.gz	YJJNBSNBBNEHSM-HNNXBMFYSA-N	0	0	292.382	4.275	20	30		CIEDRN
CO[C@@H](CSCc1ccc(CC#N)cc1)c1ccccc1	ZINC000549953731	334210044	/nfs/dbraw/zinc/21/00/44/334210044.db2.gz	YQTASWVXYBJHPO-SFHVURJKSA-N	0	0	297.423	4.374	20	30		CIEDRN
CCc1nc(C(C)C)ccc1CN1CCCC(C)(C)[C@H]1C#N	ZINC000549999129	334210929	/nfs/dbraw/zinc/21/09/29/334210929.db2.gz	RRVCJBCGZGAOOG-GOSISDBHSA-N	0	0	299.462	4.282	20	30		CIEDRN
C[C@](C#N)(NC(=O)[C@@H]1CCCC(C)(C)C1)C1CCCCC1	ZINC000550123341	334213702	/nfs/dbraw/zinc/21/37/02/334213702.db2.gz	WDXBSYNZABZDSU-RDTXWAMCSA-N	0	0	290.451	4.182	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H](C)C(C)(C)c1ccccc1	ZINC000550247369	334217238	/nfs/dbraw/zinc/21/72/38/334217238.db2.gz	HGTPALPKJYWSSX-AWEZNQCLSA-N	0	0	273.420	4.071	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CCC[C@@H](Cc2ccccc2)C1	ZINC000550382296	334221359	/nfs/dbraw/zinc/22/13/59/334221359.db2.gz	ZNGKUTIQBATMLE-KRWDZBQOSA-N	0	0	285.431	4.070	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@H]1C[C@@H]1c1ccccc1)c1ccccc1	ZINC000550492165	334223377	/nfs/dbraw/zinc/22/33/77/334223377.db2.gz	XRKOTECKXYIIIR-LZQZEXGQSA-N	0	0	291.394	4.019	20	30		CIEDRN
C=CCC(F)(F)c1nc(C(C)(C)c2ccccc2)no1	ZINC000551052426	334237146	/nfs/dbraw/zinc/23/71/46/334237146.db2.gz	AEXFVIXFUVNSIS-UHFFFAOYSA-N	0	0	278.302	4.063	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H]2CCC(=O)[C@H](C)C2(C)C)n1	ZINC000551110484	334238801	/nfs/dbraw/zinc/23/88/01/334238801.db2.gz	WKGRSOSQPSUYOD-RYUDHWBXSA-N	0	0	290.407	4.032	20	30		CIEDRN
C=CCC(C)(C)c1noc(/C=C(\C)c2ccccc2OC)n1	ZINC000551139876	334239260	/nfs/dbraw/zinc/23/92/60/334239260.db2.gz	JKGOMVHFKTYQAS-OUKQBFOZSA-N	0	0	298.386	4.492	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ccoc2C(F)(F)F)n1	ZINC000551139699	334239285	/nfs/dbraw/zinc/23/92/85/334239285.db2.gz	JVDUOLLNNYSTCJ-UHFFFAOYSA-N	0	0	286.253	4.202	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H]2Cc3cc(C)c(C)cc3O2)n1	ZINC000551138332	334239322	/nfs/dbraw/zinc/23/93/22/334239322.db2.gz	RKEIREGYFGEGIZ-OAHLLOKOSA-N	0	0	298.386	4.216	20	30		CIEDRN
C=CCC(C)(C)c1noc(C[C@H](C)c2cccc(F)c2)n1	ZINC000551140041	334239479	/nfs/dbraw/zinc/23/94/79/334239479.db2.gz	MDZASMCDAJHOAC-LBPRGKRZSA-N	0	0	288.366	4.409	20	30		CIEDRN
N#CC[C@H](Cc1nc(CC2CCCC2)no1)c1ccccc1	ZINC000551155858	334239751	/nfs/dbraw/zinc/23/97/51/334239751.db2.gz	NHQLOILXQFBRBH-MRXNPFEDSA-N	0	0	295.386	4.042	20	30		CIEDRN
C=CCC(F)(F)c1nc([C@@H]2CCCC[C@H]2CC)no1	ZINC000551182704	334240146	/nfs/dbraw/zinc/24/01/46/334240146.db2.gz	JHVMXNUPVOTCFC-GHMZBOCLSA-N	0	0	270.323	4.421	20	30		CIEDRN
CC[C@@H]1CCCC[C@@H]1c1noc(-c2cc(C#N)oc2C)n1	ZINC000551184186	334240260	/nfs/dbraw/zinc/24/02/60/334240260.db2.gz	FOGZFAAQJLUCNP-YPMHNXCESA-N	0	0	285.347	4.194	20	30		CIEDRN
CC[C@H]1CCCC[C@H]1c1noc(-c2ccc(CC#N)cc2)n1	ZINC000551182962	334240334	/nfs/dbraw/zinc/24/03/34/334240334.db2.gz	SQGJJHNCAPSNDJ-GOEBONIOSA-N	0	0	295.386	4.486	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)c1occc1C(C)C	ZINC000551195042	334240542	/nfs/dbraw/zinc/24/05/42/334240542.db2.gz	JDUKSDLJMVGPNE-UHFFFAOYSA-N	0	0	289.400	4.293	20	30		CIEDRN
C=Cc1ccc(C(=O)N(C)c2cc(Cl)ccc2C#N)cc1	ZINC000551231858	334241702	/nfs/dbraw/zinc/24/17/02/334241702.db2.gz	HTWOBBIJPGCEGA-UHFFFAOYSA-N	0	0	296.757	4.131	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc(C(=O)C(C)(C)C)cc1	ZINC000551453408	334250750	/nfs/dbraw/zinc/25/07/50/334250750.db2.gz	MBKSOZNDRSXRMG-UHFFFAOYSA-N	0	0	287.403	4.456	20	30		CIEDRN
C=CCC(C)(C)c1noc(CO[C@@H]2CCCC[C@H]2CC)n1	ZINC000551491759	334251558	/nfs/dbraw/zinc/25/15/58/334251558.db2.gz	HNDFETAYXGKIQS-ZIAGYGMSSA-N	0	0	292.423	4.409	20	30		CIEDRN
C=CCC(C)(C)c1noc(CO[C@H]2CCCC[C@@H]2CC)n1	ZINC000551491756	334251599	/nfs/dbraw/zinc/25/15/99/334251599.db2.gz	HNDFETAYXGKIQS-KBPBESRZSA-N	0	0	292.423	4.409	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)c1ccc(C=C)cc1	ZINC000551518510	334252147	/nfs/dbraw/zinc/25/21/47/334252147.db2.gz	IPRNBRXIJOPNAN-UHFFFAOYSA-N	0	0	295.357	4.297	20	30		CIEDRN
CC[C@H]1CCCC[C@H]1c1noc(Cc2cccc(C#N)c2)n1	ZINC000551535391	334253392	/nfs/dbraw/zinc/25/33/92/334253392.db2.gz	XYCGTMWAVJPGIC-JKSUJKDBSA-N	0	0	295.386	4.216	20	30		CIEDRN
C=CCCCC(=O)NC1(c2ccc(Cl)cc2)CCC1	ZINC000551693245	334257825	/nfs/dbraw/zinc/25/78/25/334257825.db2.gz	NMHBQUDKTYLZRA-UHFFFAOYSA-N	0	0	277.795	4.192	20	30		CIEDRN
CCC(CC)N(C(=O)c1cc(C#N)ccc1Cl)C1CC1	ZINC000551976142	334268711	/nfs/dbraw/zinc/26/87/11/334268711.db2.gz	UJVDPTIWSIJXQI-UHFFFAOYSA-N	0	0	290.794	4.005	20	30		CIEDRN
N#Cc1csc(C(=O)Nc2ccc(Cl)cc2Cl)c1	ZINC000084058136	334269610	/nfs/dbraw/zinc/26/96/10/334269610.db2.gz	TUZIKSAVZVCBET-UHFFFAOYSA-N	0	0	297.166	4.179	20	30		CIEDRN
C=C(C)CCc1noc(COc2ccccc2C(C)C)n1	ZINC000552047849	334281282	/nfs/dbraw/zinc/28/12/82/334281282.db2.gz	HJLQGNLRDPQDLN-UHFFFAOYSA-N	0	0	286.375	4.281	20	30		CIEDRN
N#Cc1ccc(CN2CC3(CCC3)[C@H]2c2ccccc2)s1	ZINC000552085847	334287356	/nfs/dbraw/zinc/28/73/56/334287356.db2.gz	OCTZBSRJWWLRJH-QGZVFWFLSA-N	0	0	294.423	4.347	20	30		CIEDRN
CN(Cc1ccc(-c2ccccc2)s1)CC(C)(C)C#N	ZINC000552085304	334287391	/nfs/dbraw/zinc/28/73/91/334287391.db2.gz	YQBNCJRYZBQSJL-UHFFFAOYSA-N	0	0	284.428	4.397	20	30		CIEDRN
C=CCC[C@@H](CCC)Nc1ccc(F)c(NC(=O)NC)c1	ZINC000552087982	334287903	/nfs/dbraw/zinc/28/79/03/334287903.db2.gz	YCCCMWGFJALGLC-GFCCVEGCSA-N	0	0	293.386	4.124	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)N[C@H]1CCCc2ccc(C(C)C)cc21	ZINC000552136633	334293733	/nfs/dbraw/zinc/29/37/33/334293733.db2.gz	FTBAZOJIXGMIMP-PKOBYXMFSA-N	0	0	298.430	4.243	20	30		CIEDRN
CCC[C@H](C(=O)Nc1cc(C#N)ccc1NCC)C(C)C	ZINC000552349508	334319603	/nfs/dbraw/zinc/31/96/03/334319603.db2.gz	DPMVRBWVVHAKQL-AWEZNQCLSA-N	0	0	287.407	4.001	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)N[C@H]1CCC[C@H](C(C)(C)C)CC1	ZINC000552491528	334331803	/nfs/dbraw/zinc/33/18/03/334331803.db2.gz	RBOPJVSXTHNJMZ-GRDNDAEWSA-N	0	0	278.440	4.037	20	30		CIEDRN
C=CCCc1csc(N[C@@H]2CCOc3ccccc32)n1	ZINC000090065603	334356744	/nfs/dbraw/zinc/35/67/44/334356744.db2.gz	VZWFGZKKOUTNIW-CQSZACIVSA-N	0	0	286.400	4.197	20	30		CIEDRN
CC(C)(C)CCCCC(=O)Nc1ccc(CC#N)cc1	ZINC000553052924	334359011	/nfs/dbraw/zinc/35/90/11/334359011.db2.gz	FAVBVMYICRJETD-UHFFFAOYSA-N	0	0	272.392	4.298	20	30		CIEDRN
Cc1nsc(N[C@@H]2CCC[C@H]2c2ccccc2)c1C#N	ZINC000553058647	334359254	/nfs/dbraw/zinc/35/92/54/334359254.db2.gz	HWRGRZHLRVVMQX-DZGCQCFKSA-N	0	0	283.400	4.071	20	30		CIEDRN
C=CCOc1ccc(CNC(=O)[C@@](C)(CC)CCC)cc1	ZINC000553063579	334359604	/nfs/dbraw/zinc/35/96/04/334359604.db2.gz	CLTKOANTPXMUKX-SFHVURJKSA-N	0	0	289.419	4.084	20	30		CIEDRN
CCN(C(=O)c1ccc(Cl)c(C#N)c1)c1ccccc1C	ZINC000553112765	334362110	/nfs/dbraw/zinc/36/21/10/334362110.db2.gz	FFVAPPIDCAMLNQ-UHFFFAOYSA-N	0	0	298.773	4.187	20	30		CIEDRN
Cc1cc(NCc2ccc(Cl)cc2Cl)cc(C#N)n1	ZINC000553236961	334371036	/nfs/dbraw/zinc/37/10/36/334371036.db2.gz	HMNNRRLDPTWPHI-UHFFFAOYSA-N	0	0	292.169	4.181	20	30		CIEDRN
CC[C@H]1CC[C@H](C(=O)N[C@@H](CCC#N)c2ccccc2)CC1	ZINC000251928292	334372001	/nfs/dbraw/zinc/37/20/01/334372001.db2.gz	SVYZLZUZJJUZEN-SZMVWBNQSA-N	0	0	298.430	4.364	20	30		CIEDRN
Cc1cc(N2CCC[C@H]2c2ccc(C)c(C)c2)cc(C#N)n1	ZINC000553330791	334377970	/nfs/dbraw/zinc/37/79/70/334377970.db2.gz	KLPIVBDFXHSATE-IBGZPJMESA-N	0	0	291.398	4.220	20	30		CIEDRN
N#Cc1cccc(CNc2c(F)cc(Cl)cc2F)c1	ZINC000091552086	334380395	/nfs/dbraw/zinc/38/03/95/334380395.db2.gz	OGCVAYGZMJLAFX-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CCCc2sc(Cl)cc21	ZINC000553507365	334389069	/nfs/dbraw/zinc/38/90/69/334389069.db2.gz	HCIXFDXVEQHGGW-CMPLNLGQSA-N	0	0	297.851	4.497	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H]1CCCc2sc(Cl)cc21	ZINC000553507373	334389129	/nfs/dbraw/zinc/38/91/29/334389129.db2.gz	HCIXFDXVEQHGGW-JQWIXIFHSA-N	0	0	297.851	4.497	20	30		CIEDRN
Cc1ccc(C#N)c(N[C@H]2C[C@H](c3ccc(Cl)cc3)C2)n1	ZINC000553562977	334391914	/nfs/dbraw/zinc/39/19/14/334391914.db2.gz	AWARAGRZVKFAQB-KOMQPUFPSA-N	0	0	297.789	4.273	20	30		CIEDRN
CCc1ccc(NC(=O)c2cc(C#N)cs2)cc1Cl	ZINC000553569142	334392103	/nfs/dbraw/zinc/39/21/03/334392103.db2.gz	XSLFOOUCXWAHEV-UHFFFAOYSA-N	0	0	290.775	4.088	20	30		CIEDRN
C=C[C@H](CC(=O)NC(C1CCC1)C1CCC1)c1ccccc1	ZINC000553625330	334393664	/nfs/dbraw/zinc/39/36/64/334393664.db2.gz	KWLNJLSPWDCCBO-OAHLLOKOSA-N	0	0	297.442	4.431	20	30		CIEDRN
C=CCCCCNC(=O)N1C[C@H](C)C[C@@H]1c1ccccc1	ZINC000553720141	334396713	/nfs/dbraw/zinc/39/67/13/334396713.db2.gz	QPKLPVNZZNSFHG-NVXWUHKLSA-N	0	0	286.419	4.135	20	30		CIEDRN
C[C@H]1C[C@H](c2ccccc2)N(c2ccc(C#N)cc2)C1	ZINC000553729189	334397182	/nfs/dbraw/zinc/39/71/82/334397182.db2.gz	WXSGDMCWYWCGED-KBXCAEBGSA-N	0	0	262.356	4.146	20	30		CIEDRN
CSCc1ccc(CNc2cccc(F)c2C#N)cc1	ZINC000553729002	334397214	/nfs/dbraw/zinc/39/72/14/334397214.db2.gz	KVGNKPAKEOXVAN-UHFFFAOYSA-N	0	0	286.375	4.172	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1C[C@H](C)C[C@@H]1c1ccccc1	ZINC000553792450	334399013	/nfs/dbraw/zinc/39/90/13/334399013.db2.gz	MSQWUJPVFISCFK-HYVNUMGLSA-N	0	0	286.419	4.134	20	30		CIEDRN
C[C@H]1CC[C@@]2(CCN(c3cc(C#N)c4ccccc4n3)C2)C1	ZINC000554620350	334443610	/nfs/dbraw/zinc/44/36/10/334443610.db2.gz	VEEKLQSHWCCOIR-IFXJQAMLSA-N	0	0	291.398	4.123	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cccc(F)c1Cl	ZINC000554782884	334452184	/nfs/dbraw/zinc/45/21/84/334452184.db2.gz	SVBVKUBXBNKENK-CYBMUJFWSA-N	0	0	255.720	4.020	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(Cc2cccc(Cl)c2)no1	ZINC000554787646	334452355	/nfs/dbraw/zinc/45/23/55/334452355.db2.gz	UGUZCOZDPYUTJD-HNNXBMFYSA-N	0	0	276.767	4.168	20	30		CIEDRN
Cc1nc(C)c(CNc2cccc(C(F)F)c2C#N)s1	ZINC000555034354	334465782	/nfs/dbraw/zinc/46/57/82/334465782.db2.gz	QRXXHSQKBHLHLS-UHFFFAOYSA-N	0	0	293.342	4.181	20	30		CIEDRN
C=CCCCN(C)C(=O)c1cc2cc(C)ccc2s1	ZINC000555031959	334465821	/nfs/dbraw/zinc/46/58/21/334465821.db2.gz	WJXORHLKHGDRBD-UHFFFAOYSA-N	0	0	273.401	4.248	20	30		CIEDRN
Cc1cc(NC[C@H]2CCC[C@H](C(F)(F)F)C2)cc(C#N)n1	ZINC000572550641	334469348	/nfs/dbraw/zinc/46/93/48/334469348.db2.gz	TXZZYWBCGVVTFB-RYUDHWBXSA-N	0	0	297.324	4.042	20	30		CIEDRN
CC(C)(C)/C=C\C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000254916092	334494108	/nfs/dbraw/zinc/49/41/08/334494108.db2.gz	IXZMRKTUSZRPKC-KHPPLWFESA-N	0	0	270.376	4.029	20	30		CIEDRN
N#CC1(CSc2nc(-c3ccc(F)cc3)c[nH]2)CCC1	ZINC000556235120	334502242	/nfs/dbraw/zinc/50/22/42/334502242.db2.gz	FUBXKACPVWULBY-UHFFFAOYSA-N	0	0	287.363	4.002	20	30		CIEDRN
C=CCC(F)(F)c1nc(Cc2c(C)cc(C)cc2C)no1	ZINC000556275557	334505587	/nfs/dbraw/zinc/50/55/87/334505587.db2.gz	FRENWAOIYXKAHE-UHFFFAOYSA-N	0	0	292.329	4.254	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)CCc1ccc(C)s1	ZINC000564433798	334508140	/nfs/dbraw/zinc/50/81/40/334508140.db2.gz	WIEMHVCACJQNAT-UHFFFAOYSA-N	0	0	299.439	4.204	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(C[C@@H](C)c2ccccc2)no1	ZINC000564610448	334513634	/nfs/dbraw/zinc/51/36/34/334513634.db2.gz	OWFDMPIVMPUHSS-CXAGYDPISA-N	0	0	270.376	4.270	20	30		CIEDRN
C[C@@](C#N)(NC(=O)c1cccc(C2CC2)c1)C1CCCCC1	ZINC000564735137	334518391	/nfs/dbraw/zinc/51/83/91/334518391.db2.gz	IYXWWZSXLOTZNX-IBGZPJMESA-N	0	0	296.414	4.156	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1ccn(CC)n1	ZINC000565010439	334534394	/nfs/dbraw/zinc/53/43/94/334534394.db2.gz	LLEYHLUQIJIKSV-UHFFFAOYSA-N	0	0	297.402	4.007	20	30		CIEDRN
CC[C@H](CC1CCCC1)C(=O)N1CCC(CCC#N)CC1	ZINC000565020789	334534991	/nfs/dbraw/zinc/53/49/91/334534991.db2.gz	OIVOHHRDZZJGFA-QGZVFWFLSA-N	0	0	290.451	4.135	20	30		CIEDRN
C=C(C)[C@H](CC(=O)Nc1ccc(/C=C\C)cc1)OCC	ZINC000565109025	334538913	/nfs/dbraw/zinc/53/89/13/334538913.db2.gz	BRQWFUUIGACVRB-WRLNGNIRSA-N	0	0	273.376	4.030	20	30		CIEDRN
CC(C)(C)C(C)(C)CNC(=O)c1cc(C#N)ccc1Cl	ZINC000565440361	334563936	/nfs/dbraw/zinc/56/39/36/334563936.db2.gz	BBDVOMWXGZXWTM-UHFFFAOYSA-N	0	0	292.810	4.014	20	30		CIEDRN
Cc1cc(N[C@H](C)c2cc3ccccc3s2)cc(C#N)n1	ZINC000565792460	334597915	/nfs/dbraw/zinc/59/79/15/334597915.db2.gz	SFCRGQOEXVNXGO-GFCCVEGCSA-N	0	0	293.395	4.071	20	30		CIEDRN
N#Cc1cccc(N2CCCC[C@@H]2c2cccc(Cl)c2)n1	ZINC000565865215	334603976	/nfs/dbraw/zinc/60/39/76/334603976.db2.gz	JPRKDIXSPDWEPN-MRXNPFEDSA-N	0	0	297.789	4.338	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@H](C)c1ccccc1OC(C)C	ZINC000566113805	334624407	/nfs/dbraw/zinc/62/44/07/334624407.db2.gz	KMAPCAPVGQZCQT-CQSZACIVSA-N	0	0	289.419	4.253	20	30		CIEDRN
CC1(C)CCCC[C@H]1CC(=O)N1CCC(CCC#N)CC1	ZINC000566273204	334640008	/nfs/dbraw/zinc/64/00/08/334640008.db2.gz	AUMLPGKDIIKWOS-INIZCTEOSA-N	0	0	290.451	4.135	20	30		CIEDRN
CC1(C)CCC(c2noc(-c3cccc(CC#N)c3)n2)CC1	ZINC000566340294	334643537	/nfs/dbraw/zinc/64/35/37/334643537.db2.gz	UHMFGHJGECIKLW-UHFFFAOYSA-N	0	0	295.386	4.486	20	30		CIEDRN
CC1(C)C[C@@H](CNc2cccc(C(F)F)c2C#N)CCO1	ZINC000566688484	334660494	/nfs/dbraw/zinc/66/04/94/334660494.db2.gz	AUEUJIMCNZVMAV-NSHDSACASA-N	0	0	294.345	4.113	20	30		CIEDRN
Cc1ccc(C(=O)N[C@H](CCC#N)c2ccccc2)cc1C	ZINC000153599902	334674646	/nfs/dbraw/zinc/67/46/46/334674646.db2.gz	UOIVMCWIIOFKOY-GOSISDBHSA-N	0	0	292.382	4.078	20	30		CIEDRN
CC[C@H](CC(=O)N[C@@H](CCC#N)c1ccccc1)C(C)C	ZINC000153639796	334675392	/nfs/dbraw/zinc/67/53/92/334675392.db2.gz	VQCBOTOHXMVUAL-WBVHZDCISA-N	0	0	286.419	4.220	20	30		CIEDRN
CC1(C)CCCC[C@@H]1CC(=O)Nc1sccc1C#N	ZINC000154034921	334686113	/nfs/dbraw/zinc/68/61/13/334686113.db2.gz	HIHFXKZIFDIURT-GFCCVEGCSA-N	0	0	276.405	4.165	20	30		CIEDRN
CC(C)(CC#N)CSc1cc2c(cc1Cl)OCCO2	ZINC000567180915	334688083	/nfs/dbraw/zinc/68/80/83/334688083.db2.gz	YCIQOVBYKHFCIQ-UHFFFAOYSA-N	0	0	297.807	4.143	20	30		CIEDRN
CCCCN(CCCC)C(=O)c1ccc(C#N)c(Cl)c1	ZINC000154282189	334692141	/nfs/dbraw/zinc/69/21/41/334692141.db2.gz	UHDDRQQNEKLKMX-UHFFFAOYSA-N	0	0	292.810	4.254	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cncc(C(F)(F)F)c2)n1	ZINC000567256426	334698247	/nfs/dbraw/zinc/69/82/47/334698247.db2.gz	IQQCYMOOXIECBA-UHFFFAOYSA-N	0	0	297.280	4.004	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2ccc(C(C)C)nc2)no1	ZINC000567279408	334700578	/nfs/dbraw/zinc/70/05/78/334700578.db2.gz	IUOPZSIVMHRXBM-LBPRGKRZSA-N	0	0	271.364	4.325	20	30		CIEDRN
N#Cc1ccc(-c2nc3ccc(F)cc3n2C2CC2)cc1	ZINC000154947198	334708596	/nfs/dbraw/zinc/70/85/96/334708596.db2.gz	GRMKNLHIBYTSQU-UHFFFAOYSA-N	0	0	277.302	4.049	20	30		CIEDRN
CCCCCC(=O)N(CC)c1ccc(C#N)c(Cl)c1	ZINC000156579950	334744505	/nfs/dbraw/zinc/74/45/05/334744505.db2.gz	JCSSLUMZZCJYEM-UHFFFAOYSA-N	0	0	278.783	4.145	20	30		CIEDRN
N#CCN(Cc1csc(C2CCCC2)n1)C1CCCC1	ZINC000156589858	334744797	/nfs/dbraw/zinc/74/47/97/334744797.db2.gz	BTQOELUBOGDINE-UHFFFAOYSA-N	0	0	289.448	4.069	20	30		CIEDRN
CC[C@@H]1CCCCCN1C(=O)c1ccc(C#N)c(Cl)c1	ZINC000157485526	334772739	/nfs/dbraw/zinc/77/27/39/334772739.db2.gz	VXIKIQIUULPTQZ-CQSZACIVSA-N	0	0	290.794	4.006	20	30		CIEDRN
COc1cc(C#N)ccc1CNc1cccc(C(F)F)c1	ZINC000158037694	334790580	/nfs/dbraw/zinc/79/05/80/334790580.db2.gz	LIIRMFWVMABAIR-UHFFFAOYSA-N	0	0	288.297	4.117	20	30		CIEDRN
C=CCN(CC=C)Cc1cnc(-c2ccsc2)s1	ZINC000158131883	334793315	/nfs/dbraw/zinc/79/33/15/334793315.db2.gz	NNAMJNJSRTULNE-UHFFFAOYSA-N	0	0	276.430	4.046	20	30		CIEDRN
CCS[C@H](C)c1noc(-c2ccc(C#N)c(Cl)c2)n1	ZINC000568326544	334815345	/nfs/dbraw/zinc/81/53/45/334815345.db2.gz	IJTUMRKGLQVSAD-MRVPVSSYSA-N	0	0	293.779	4.076	20	30		CIEDRN
C=CCCC1(c2nc(-c3cccc(C)c3)no2)CC1	ZINC000568496356	334827087	/nfs/dbraw/zinc/82/70/87/334827087.db2.gz	SIURKYIBEANSQQ-UHFFFAOYSA-N	0	0	254.333	4.043	20	30		CIEDRN
CCc1ccc([C@@H](C#N)NC(=O)C2(CC(C)C)CCC2)cc1	ZINC000568562331	334830457	/nfs/dbraw/zinc/83/04/57/334830457.db2.gz	QBUPFGYKYSMPNC-QGZVFWFLSA-N	0	0	298.430	4.146	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc([C@H](C)c2cccs2)no1	ZINC000568813189	334841863	/nfs/dbraw/zinc/84/18/63/334841863.db2.gz	REIFGBMWMDCKKR-GHMZBOCLSA-N	0	0	262.378	4.353	20	30		CIEDRN
N#Cc1ccc(N2CCC(c3ccccc3F)CC2)cc1	ZINC000568813141	334841940	/nfs/dbraw/zinc/84/19/40/334841940.db2.gz	PDJDEKIZIIOGAP-UHFFFAOYSA-N	0	0	280.346	4.081	20	30		CIEDRN
C=CCCC1(c2nc(CO[C@H]3CCCC[C@H]3C)no2)CC1	ZINC000568932047	334847392	/nfs/dbraw/zinc/84/73/92/334847392.db2.gz	URPIPFGSKICXRZ-KGLIPLIRSA-N	0	0	290.407	4.163	20	30		CIEDRN
C=CCCCCS(=O)(=O)[C@H](C)c1cccc(Cl)c1	ZINC000569082495	334854414	/nfs/dbraw/zinc/85/44/14/334854414.db2.gz	OYYBYQOERCMFTR-GFCCVEGCSA-N	0	0	286.824	4.172	20	30		CIEDRN
C=CCCCCSc1nnc(-c2ccc(OC)cc2)o1	ZINC000569189159	334860408	/nfs/dbraw/zinc/86/04/08/334860408.db2.gz	NOZVRVJILMAEPG-UHFFFAOYSA-N	0	0	290.388	4.194	20	30		CIEDRN
CC#CCCCc1nc(-c2ccc(SCC)cc2)no1	ZINC000569290356	334865596	/nfs/dbraw/zinc/86/55/96/334865596.db2.gz	OVBXBTURGDENGN-UHFFFAOYSA-N	0	0	286.400	4.195	20	30		CIEDRN
Cc1cc(Cl)ccc1C(=O)N(CCC#N)CC(C)(C)C	ZINC000163997275	334874956	/nfs/dbraw/zinc/87/49/56/334874956.db2.gz	YHIBLACDOYZHBD-UHFFFAOYSA-N	0	0	292.810	4.050	20	30		CIEDRN
CCN(C(=O)[C@H]1CC[C@H](C)CC1)[C@@H](C)c1ccc(C#N)cc1	ZINC000573253884	334921945	/nfs/dbraw/zinc/92/19/45/334921945.db2.gz	IICLIMBDZIICPV-MPGHIAIKSA-N	0	0	298.430	4.294	20	30		CIEDRN
CC(C)(C)CCc1noc(-c2ccc(C#N)c(Cl)c2)n1	ZINC000576671454	335233060	/nfs/dbraw/zinc/23/30/60/335233060.db2.gz	VUCAROZOPZKHRF-UHFFFAOYSA-N	0	0	289.766	4.240	20	30		CIEDRN
N#CC1(CCn2ccc3cc(F)ccc3c2=O)CCCCC1	ZINC000576703028	335237006	/nfs/dbraw/zinc/23/70/06/335237006.db2.gz	JNTPSOXAOFZFLX-UHFFFAOYSA-N	0	0	298.361	4.005	20	30		CIEDRN
CC(C)(C)c1ccc(C[S@@](=O)CCC(C)(C)C#N)cc1	ZINC000576760928	335244677	/nfs/dbraw/zinc/24/46/77/335244677.db2.gz	VIOQVVZICNKQDO-FQEVSTJZSA-N	0	0	291.460	4.173	20	30		CIEDRN
CC(C)c1ccc(NC(=O)NC[C@H](C)C#N)c(C(C)C)c1	ZINC000176359178	335264551	/nfs/dbraw/zinc/26/45/51/335264551.db2.gz	SBTGKKXFZPRLBU-CYBMUJFWSA-N	0	0	287.407	4.215	20	30		CIEDRN
C=C(C)CCc1noc([C@H]2CC[C@@H](C(F)(F)F)C2)n1	ZINC000577025786	335283617	/nfs/dbraw/zinc/28/36/17/335283617.db2.gz	SVLLVNWMHDZTAI-VHSXEESVSA-N	0	0	274.286	4.024	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(C(C)(C)c2ccccc2)no1	ZINC000577025509	335283782	/nfs/dbraw/zinc/28/37/82/335283782.db2.gz	MRLQDUNJQVEORP-QGZVFWFLSA-N	0	0	270.376	4.249	20	30		CIEDRN
Cc1ccc(C#N)cc1NCc1sccc1Cl	ZINC000379969874	335287655	/nfs/dbraw/zinc/28/76/55/335287655.db2.gz	GQQJRXTYKAOWBU-UHFFFAOYSA-N	0	0	262.765	4.194	20	30		CIEDRN
CC1(C)CCC[C@@H](CC(=O)N2CCC(CCC#N)CC2)C1	ZINC000577065047	335294250	/nfs/dbraw/zinc/29/42/50/335294250.db2.gz	RFEHMJUTYBSZGD-INIZCTEOSA-N	0	0	290.451	4.135	20	30		CIEDRN
C=C(C)CCNc1ccc(C(=O)NC2CCCCC2)cc1	ZINC000577099939	335300033	/nfs/dbraw/zinc/30/00/33/335300033.db2.gz	KEUCUKWADHAVCS-UHFFFAOYSA-N	0	0	286.419	4.127	20	30		CIEDRN
Cc1csc(NC(=O)CC2CCCCCC2)c1C#N	ZINC000577245339	335329356	/nfs/dbraw/zinc/32/93/56/335329356.db2.gz	MVXPPNDJBMWJDR-UHFFFAOYSA-N	0	0	276.405	4.227	20	30		CIEDRN
C=CCC(C)(C)c1noc(CCCc2ccccc2)n1	ZINC000577302965	335337297	/nfs/dbraw/zinc/33/72/97/335337297.db2.gz	JAIVSQLOARAWIK-UHFFFAOYSA-N	0	0	270.376	4.099	20	30		CIEDRN
CC(C)(C#N)CCN1CCc2c1cccc2C(F)(F)F	ZINC000577902694	335419218	/nfs/dbraw/zinc/41/92/18/335419218.db2.gz	MXZNLCMPWXBSSI-UHFFFAOYSA-N	0	0	282.309	4.008	20	30		CIEDRN
CC(C)n1ncc2ccc(NCc3cc(C#N)cs3)cc21	ZINC000178207316	335421921	/nfs/dbraw/zinc/42/19/21/335421921.db2.gz	VTOYKJMXQPEZPV-UHFFFAOYSA-N	0	0	296.399	4.162	20	30		CIEDRN
CC(C)CCN(CCC#N)C(=O)c1ccc(C(F)F)cc1	ZINC000349431213	335467541	/nfs/dbraw/zinc/46/75/41/335467541.db2.gz	IUHCFQQDELIKEP-UHFFFAOYSA-N	0	0	294.345	4.026	20	30		CIEDRN
CCc1ccc([C@H](C#N)NC(=O)[C@H](C)C(CC)CC)cc1	ZINC000578047603	335471659	/nfs/dbraw/zinc/47/16/59/335471659.db2.gz	LDMWVQZUMHMIFC-DYVFJYSZSA-N	0	0	286.419	4.002	20	30		CIEDRN
CCN(C(=O)[C@@H]1C[C@]1(C)CC)c1ccc(C#N)c(Cl)c1	ZINC000179526369	335498878	/nfs/dbraw/zinc/49/88/78/335498878.db2.gz	TWOKWDWHTFTGAH-BBRMVZONSA-N	0	0	290.794	4.001	20	30		CIEDRN
C=C[C@@](C)(CCOC)c1nc([C@@H]2CCCC(C)(C)C2)no1	ZINC000578367730	335621118	/nfs/dbraw/zinc/62/11/18/335621118.db2.gz	JTBFEHRFBDOZLY-DYVFJYSZSA-N	0	0	292.423	4.234	20	30		CIEDRN
C=CC[C@H](C)NC(=O)CCCc1ccc2ccccc2c1	ZINC000180871785	335627526	/nfs/dbraw/zinc/62/75/26/335627526.db2.gz	WDZGOZRUKCSDAQ-HNNXBMFYSA-N	0	0	281.399	4.243	20	30		CIEDRN
C=CCC(C)(C)c1noc(C(C)(C)c2cccs2)n1	ZINC000578458059	335637486	/nfs/dbraw/zinc/63/74/86/335637486.db2.gz	XLWCVHFSACYZHL-UHFFFAOYSA-N	0	0	276.405	4.311	20	30		CIEDRN
C[C@H](c1ncc(C(C)(C)C)o1)N1CCC(CCC#N)CC1	ZINC000579105998	335709533	/nfs/dbraw/zinc/70/95/33/335709533.db2.gz	KHIDYGVTWNUZPY-CYBMUJFWSA-N	0	0	289.423	4.049	20	30		CIEDRN
CC(=O)c1ccc(NCCCC(C)(C)C#N)cc1Cl	ZINC000181038426	335748698	/nfs/dbraw/zinc/74/86/98/335748698.db2.gz	NBLPIOLNRLYKOE-UHFFFAOYSA-N	0	0	278.783	4.284	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N(C)[C@H](C)c1ccccc1	ZINC000181396845	335760504	/nfs/dbraw/zinc/76/05/04/335760504.db2.gz	INDKGMOMNIWCER-HUUCEWRRSA-N	0	0	274.408	4.134	20	30		CIEDRN
Cc1cnc([C@H](N[C@@H](C)c2cccc(C#N)c2)C2CC2)s1	ZINC000181820616	335786688	/nfs/dbraw/zinc/78/66/88/335786688.db2.gz	OAJFLNXHNWRZCN-BLLLJJGKSA-N	0	0	297.427	4.125	20	30		CIEDRN
N#CC1(c2ccc(C(=O)Nc3cccc(Cl)c3)cc2)CC1	ZINC000182244171	335806100	/nfs/dbraw/zinc/80/61/00/335806100.db2.gz	KPWNNMFGRHASHF-UHFFFAOYSA-N	0	0	296.757	4.147	20	30		CIEDRN
C=CCCC(=O)Nc1cc(F)c(OC(C)(C)C)c(F)c1	ZINC000182613945	335830740	/nfs/dbraw/zinc/83/07/40/335830740.db2.gz	VHPDKPLKJUROJQ-UHFFFAOYSA-N	0	0	283.318	4.047	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1cccc(C(F)F)c1	ZINC000182622790	335831494	/nfs/dbraw/zinc/83/14/94/335831494.db2.gz	NADFVFMLDJXIAM-NSHDSACASA-N	0	0	267.319	4.099	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1cccc2[nH]ccc21	ZINC000183078210	335860903	/nfs/dbraw/zinc/86/09/03/335860903.db2.gz	RYZCPFRRIORLSX-GFCCVEGCSA-N	0	0	271.364	4.034	20	30		CIEDRN
CO[C@@H](C)c1cccc(N[C@@H](C)c2cccc(C#N)c2)c1	ZINC000183094504	335862604	/nfs/dbraw/zinc/86/26/04/335862604.db2.gz	PETAXLVREQLXKU-KBPBESRZSA-N	0	0	280.371	4.439	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1ccccc1CSC	ZINC000184756903	335932862	/nfs/dbraw/zinc/93/28/62/335932862.db2.gz	MGIWZWHCMODRDP-CYBMUJFWSA-N	0	0	292.448	4.416	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1scnc1C1CCCC1	ZINC000185243701	335949205	/nfs/dbraw/zinc/94/92/05/335949205.db2.gz	DIBJRMQPQBGYJK-GFCCVEGCSA-N	0	0	292.448	4.275	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(-c2cnc3ccsc3c2)no1	ZINC000580917962	335983785	/nfs/dbraw/zinc/98/37/85/335983785.db2.gz	JGEOJFCZCDUBMH-OAHLLOKOSA-N	0	0	285.372	4.200	20	30		CIEDRN
CC[C@H](CC#N)NCc1c(OC(C)C)ccc2ccccc21	ZINC000581123897	336011131	/nfs/dbraw/zinc/01/11/31/336011131.db2.gz	RUNVCMUUZZLQFM-MRXNPFEDSA-N	0	0	296.414	4.409	20	30		CIEDRN
N#CCc1ccc(N[C@@H]2CCCC23CCCC3)cc1	ZINC000380881819	336038403	/nfs/dbraw/zinc/03/84/03/336038403.db2.gz	CQVKHBQEYOEHPE-MRXNPFEDSA-N	0	0	254.377	4.277	20	30		CIEDRN
CC#CCCCc1nc([C@H]2CCCC[C@H]2CC)no1	ZINC000581384724	336066373	/nfs/dbraw/zinc/06/63/73/336066373.db2.gz	JDVJDBDFPDZYOG-KGLIPLIRSA-N	0	0	260.381	4.099	20	30		CIEDRN
CC#CCCCc1nc([C@@H]2CCCC[C@H]2CC)no1	ZINC000581384726	336066378	/nfs/dbraw/zinc/06/63/78/336066378.db2.gz	JDVJDBDFPDZYOG-ZIAGYGMSSA-N	0	0	260.381	4.099	20	30		CIEDRN
Cc1cc(Cl)ccc1NCc1cccc(C#N)c1F	ZINC000381629971	336069612	/nfs/dbraw/zinc/06/96/12/336069612.db2.gz	AQLAOAIKCJXGNG-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
Cc1cc(Cl)ccc1NCc1ccc(C#N)cc1F	ZINC000381766416	336072901	/nfs/dbraw/zinc/07/29/01/336072901.db2.gz	ZJEABOYWJPOJIV-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
C=CCCC1(c2nc(-c3cscc3C)no2)CC1	ZINC000581454785	336080146	/nfs/dbraw/zinc/08/01/46/336080146.db2.gz	AYOIGRMMOIBAQB-UHFFFAOYSA-N	0	0	260.362	4.104	20	30		CIEDRN
Cc1cc(OC[C@@H]2CCCC2(F)F)c(C)c(C)c1C#N	ZINC000382078028	336081508	/nfs/dbraw/zinc/08/15/08/336081508.db2.gz	HTJZPFPHMAWUKY-ZDUSSCGKSA-N	0	0	279.330	4.298	20	30		CIEDRN
Cc1ccc(C#N)cc1OC[C@@H]1CCCCC1(F)F	ZINC000382093862	336081697	/nfs/dbraw/zinc/08/16/97/336081697.db2.gz	JIHNZRSRTDOTEH-ZDUSSCGKSA-N	0	0	265.303	4.071	20	30		CIEDRN
C=CCN(CC=C)C(=O)[C@@H](CCc1ccccc1)C(C)C	ZINC000581619815	336113804	/nfs/dbraw/zinc/11/38/04/336113804.db2.gz	QKZXXAWVJOZZHP-SFHVURJKSA-N	0	0	285.431	4.092	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1cc2ccccc2nc1C	ZINC000581717511	336136201	/nfs/dbraw/zinc/13/62/01/336136201.db2.gz	FPRGCJLVFIXPME-CYBMUJFWSA-N	0	0	282.387	4.018	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)C(C1CCC1)C1CCC1	ZINC000385093130	336137901	/nfs/dbraw/zinc/13/79/01/336137901.db2.gz	MECFUWUKNJAGLZ-UHFFFAOYSA-N	0	0	282.387	4.022	20	30		CIEDRN
C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cscn1	ZINC000581839216	336150553	/nfs/dbraw/zinc/15/05/53/336150553.db2.gz	WAXROGBZNAPXAX-ZFWWWQNUSA-N	0	0	285.416	4.229	20	30		CIEDRN
N#Cc1ccc(NC(=O)C2(C3CCC3)CCC2)c(Cl)c1	ZINC000581870513	336155303	/nfs/dbraw/zinc/15/53/03/336155303.db2.gz	WCYQIYHNPSZFDP-UHFFFAOYSA-N	0	0	288.778	4.121	20	30		CIEDRN
Cc1ccc2oc(C(=O)Nc3ccc(CC#N)cc3)cc2c1	ZINC000385841057	336157991	/nfs/dbraw/zinc/15/79/91/336157991.db2.gz	ZSWJXRBJEAZUSR-UHFFFAOYSA-N	0	0	290.322	4.060	20	30		CIEDRN
CC(C)(C)c1cccc(C(=O)NCC2CCC(C#N)CC2)c1	ZINC000581892583	336161676	/nfs/dbraw/zinc/16/16/76/336161676.db2.gz	PUAKCSNAVQESQX-UHFFFAOYSA-N	0	0	298.430	4.044	20	30		CIEDRN
N#Cc1cccc(CNc2cccc(C(F)F)c2)c1F	ZINC000386123476	336166471	/nfs/dbraw/zinc/16/64/71/336166471.db2.gz	CPZBBZRSQFAFJR-UHFFFAOYSA-N	0	0	276.261	4.247	20	30		CIEDRN
C[C@H]1CC[C@@]2(CCN(c3ccc4cc(C#N)ccc4n3)C2)C1	ZINC000302062243	533730614	/nfs/dbraw/zinc/73/06/14/533730614.db2.gz	UFGWWNRKRPVUKQ-IFXJQAMLSA-N	0	0	291.398	4.123	20	30		CIEDRN
COc1cccc2c1CC[C@H]2Nc1c(Cl)cccc1C#N	ZINC000301661502	533873769	/nfs/dbraw/zinc/87/37/69/533873769.db2.gz	UOSHNOMEOVDLKH-OAHLLOKOSA-N	0	0	298.773	4.320	20	30		CIEDRN
Cc1c(NC2CCC(C)(C#N)CC2)cnn1C1CCCC1	ZINC000333513486	533923456	/nfs/dbraw/zinc/92/34/56/533923456.db2.gz	FPPVGBQEKMYJSF-UHFFFAOYSA-N	0	0	286.423	4.191	20	30		CIEDRN
Cc1c(N[C@@H]2CC[C@@H](C#N)C2)cccc1OCC(F)(F)F	ZINC000442852699	533924438	/nfs/dbraw/zinc/92/44/38/533924438.db2.gz	LHGXENSFWSCIIG-VXGBXAGGSA-N	0	0	298.308	4.040	20	30		CIEDRN
Cc1c2ccccc2oc1[C@@H](C)NC(=O)[C@@H]1C[C@@]12CCOC2	ZINC000330046346	533979986	/nfs/dbraw/zinc/97/99/86/533979986.db2.gz	ISGHJYGEFAPYEA-UVBSCNOISA-N	0	0	299.370	4.185	20	30		CIEDRN
Cc1ccc(NC(=O)NCC(C)(C)CCC#N)cc1Cl	ZINC000348150204	534184074	/nfs/dbraw/zinc/18/40/74/534184074.db2.gz	CMYFGABRQGWFMK-UHFFFAOYSA-N	0	0	293.798	4.100	20	30		CIEDRN
C=CCCC(=O)N[C@@H](CC(C)C)c1ccccc1OCC	ZINC000470249170	517322525	/nfs/dbraw/zinc/32/25/25/517322525.db2.gz	WLHXZFFQAGBMOX-INIZCTEOSA-N	0	0	289.419	4.255	20	30		CIEDRN
Cc1cccc(CCS[C@@H](C)c2ccc(C#N)cc2)n1	ZINC000563146830	518190249	/nfs/dbraw/zinc/19/02/49/518190249.db2.gz	JZOAUHOTMDMVBA-AWEZNQCLSA-N	0	0	282.412	4.299	20	30		CIEDRN
N#Cc1cnc(N2CCC[C@@H]2c2ccsc2)c(Cl)c1	ZINC000114708835	518196729	/nfs/dbraw/zinc/19/67/29/518196729.db2.gz	GLZODTHHGXALNT-CYBMUJFWSA-N	0	0	289.791	4.010	20	30		CIEDRN
CC(C)(C)c1cccc(Oc2ncccc2C#N)c1	ZINC000037412908	519056127	/nfs/dbraw/zinc/05/61/27/519056127.db2.gz	JELXLWMOOZFMSU-UHFFFAOYSA-N	0	0	252.317	4.043	20	30		CIEDRN
C=CC[C@@H](C)[C@H](C)Nc1cccc(NC(=O)N(C)C)c1C	ZINC000279749164	519095395	/nfs/dbraw/zinc/09/53/95/519095395.db2.gz	YMHJCBRGLMAKBV-OCCSQVGLSA-N	0	0	289.423	4.101	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1ccnc(C)c1	ZINC000279663866	519140600	/nfs/dbraw/zinc/14/06/00/519140600.db2.gz	FUXHIGNKYGAECM-UHFFFAOYSA-N	0	0	294.398	4.494	20	30		CIEDRN
C=CCn1c(C)nnc1SCc1cccc(C(F)F)c1	ZINC000279858622	519174994	/nfs/dbraw/zinc/17/49/94/519174994.db2.gz	FOBMSAUCVARJAJ-UHFFFAOYSA-N	0	0	295.358	4.002	20	30		CIEDRN
CC(C)[C@H]1CN(C(=O)c2cc(C#N)cs2)c2ccccc21	ZINC000278305066	519826267	/nfs/dbraw/zinc/82/62/67/519826267.db2.gz	BKYILXANCBBBNG-CQSZACIVSA-N	0	0	296.395	4.020	20	30		CIEDRN
CC(C)c1nnc(CS[C@@H](C)c2ccc(C#N)cc2)o1	ZINC000125634365	519888749	/nfs/dbraw/zinc/88/87/49/519888749.db2.gz	MYBGBOUPHQZUEN-NSHDSACASA-N	0	0	287.388	4.059	20	30		CIEDRN
CC(C)n1ccnc1S[C@H](C)c1ccc(C#N)cc1	ZINC000265361827	520036583	/nfs/dbraw/zinc/03/65/83/520036583.db2.gz	FHJGTTBRSYHSEP-GFCCVEGCSA-N	0	0	271.389	4.189	20	30		CIEDRN
CC(C)n1ccnc1S[C@@H](C)c1ccc(C#N)cc1	ZINC000265361828	520038059	/nfs/dbraw/zinc/03/80/59/520038059.db2.gz	FHJGTTBRSYHSEP-LBPRGKRZSA-N	0	0	271.389	4.189	20	30		CIEDRN
Cc1ccc2cccc(NC(=O)[C@H]3CCC(=O)[C@@H](C)C3)c2n1	ZINC000329000888	534478398	/nfs/dbraw/zinc/47/83/98/534478398.db2.gz	VUQVAAYCXMHYLQ-FZMZJTMJSA-N	0	0	296.370	4.137	20	30		CIEDRN
CCC[C@@H](C)C(=O)N(Cc1ccco1)c1ccccc1C#N	ZINC000264940105	520602925	/nfs/dbraw/zinc/60/29/25/520602925.db2.gz	YWHDDEUWFRQANQ-CQSZACIVSA-N	0	0	296.370	4.121	20	30		CIEDRN
CCC(CC)(CC)SCC(=O)Nc1sccc1C#N	ZINC000191932031	521403756	/nfs/dbraw/zinc/40/37/56/521403756.db2.gz	MEXVVZBHELDXKZ-UHFFFAOYSA-N	0	0	296.461	4.260	20	30		CIEDRN
Cc1cccc(-n2ccnc2S[C@H](C)CCC#N)c1C	ZINC000347626670	534568494	/nfs/dbraw/zinc/56/84/94/534568494.db2.gz	KRZSTHQUYJTZII-CYBMUJFWSA-N	0	0	285.416	4.274	20	30		CIEDRN
CCC1(CC)Oc2ccc(NCc3ccc(C#N)o3)cc2O1	ZINC000190422329	521692002	/nfs/dbraw/zinc/69/20/02/521692002.db2.gz	HZZDJVIDWJGZGG-UHFFFAOYSA-N	0	0	298.342	4.051	20	30		CIEDRN
CCS[C@@H]1CCC[C@@H]1Nc1ccc(C#N)c(Cl)c1	ZINC000226127656	521725480	/nfs/dbraw/zinc/72/54/80/521725480.db2.gz	BPKRBGYEWSGLNT-UONOGXRCSA-N	0	0	280.824	4.298	20	30		CIEDRN
CC[C@@H](C)N(Cc1ccccc1)C(=O)c1cc(C#N)cs1	ZINC000084071210	522099664	/nfs/dbraw/zinc/09/96/64/522099664.db2.gz	QKABDXAPONAPGK-CYBMUJFWSA-N	0	0	298.411	4.061	20	30		CIEDRN
Cc1cnc([C@@H](C)S[C@@H](C)c2ccc(C#N)cc2)o1	ZINC000356077666	534626501	/nfs/dbraw/zinc/62/65/01/534626501.db2.gz	LAMRDVAVTABYDU-NWDGAFQWSA-N	0	0	272.373	4.410	20	30		CIEDRN
CC[C@H](Nc1cc(OC)cc(OC)c1)c1ccc(C#N)cc1	ZINC000278381236	522764197	/nfs/dbraw/zinc/76/41/97/522764197.db2.gz	DBIDLJGFXVFXBO-SFHVURJKSA-N	0	0	296.370	4.139	20	30		CIEDRN
CC[C@H](Nc1ccc(C#N)nc1)c1ccc(Cl)cc1	ZINC000301558663	522764784	/nfs/dbraw/zinc/76/47/84/522764784.db2.gz	HXCQEOKHDRQSOP-HNNXBMFYSA-N	0	0	271.751	4.170	20	30		CIEDRN
CC[C@H](Nc1cccc(F)c1C#N)c1nc(C)cs1	ZINC000264244605	522773509	/nfs/dbraw/zinc/77/35/09/522773509.db2.gz	KCBWOPOABKRPTD-LBPRGKRZSA-N	0	0	275.352	4.026	20	30		CIEDRN
CN(C(=O)CC1CCC(C)(C)CC1)c1ccc(C#N)cc1	ZINC000337811091	523795205	/nfs/dbraw/zinc/79/52/05/523795205.db2.gz	NZEPMILZYCOULO-UHFFFAOYSA-N	0	0	284.403	4.128	20	30		CIEDRN
CN(C(=O)CCC(C)(C)C)c1cc(Cl)ccc1C#N	ZINC000156943654	523797191	/nfs/dbraw/zinc/79/71/91/523797191.db2.gz	OVLWWXKQDSNOKP-UHFFFAOYSA-N	0	0	278.783	4.001	20	30		CIEDRN
O=C(NCc1cc(-c2ccccc2)no1)[C@@H]1CC12CCCC2	ZINC000329962786	534755317	/nfs/dbraw/zinc/75/53/17/534755317.db2.gz	PLHJODAMIZDLGI-HNNXBMFYSA-N	0	0	296.370	4.378	20	30		CIEDRN
N#Cc1cc(NCc2cc3ccccc3[nH]2)c2ccccc2n1	ZINC000301404517	534776841	/nfs/dbraw/zinc/77/68/41/534776841.db2.gz	KWWCUQSVCHZWMT-UHFFFAOYSA-N	0	0	298.349	4.200	20	30		CIEDRN
N#Cc1ccc(F)c(CNc2ccc(F)c(C3CC3)c2)c1	ZINC000352618358	534787910	/nfs/dbraw/zinc/78/79/10/534787910.db2.gz	PFQKAARHPUQFKB-UHFFFAOYSA-N	0	0	284.309	4.326	20	30		CIEDRN
N#Cc1ccc(SCc2ccc(F)cn2)c(Cl)c1	ZINC000344603877	534798611	/nfs/dbraw/zinc/79/86/11/534798611.db2.gz	IKVXMVGRGAUDCJ-UHFFFAOYSA-N	0	0	278.739	4.038	20	30		CIEDRN
Cc1ccc(Cl)cc1Oc1ccc(Cl)c(C#N)n1	ZINC000301602833	524759045	/nfs/dbraw/zinc/75/90/45/524759045.db2.gz	WOSVAMXJCCDFHA-UHFFFAOYSA-N	0	0	279.126	4.361	20	30		CIEDRN
C[C@H](NC(=O)C1(C#N)CCCC1)c1cccc2ccccc21	ZINC000052752649	524897115	/nfs/dbraw/zinc/89/71/15/524897115.db2.gz	FXNJTEVFGMPSQW-AWEZNQCLSA-N	0	0	292.382	4.101	20	30		CIEDRN
Cc1cc(N(C)C)ccc1N[C@@H](C)c1cccc(C#N)c1	ZINC000037274239	525024123	/nfs/dbraw/zinc/02/41/23/525024123.db2.gz	LARQKTIDKXVDAI-AWEZNQCLSA-N	0	0	279.387	4.106	20	30		CIEDRN
Cc1cc(Oc2nnc(C)c(C)c2C#N)cc(C)c1Cl	ZINC000040221097	525389128	/nfs/dbraw/zinc/38/91/28/525389128.db2.gz	JHVJCOAJHCKXHX-UHFFFAOYSA-N	0	0	287.750	4.028	20	30		CIEDRN
Cc1cc([C@@H](C)NC(=O)c2ccc(C#N)cc2C)c(C)s1	ZINC000161235094	525457555	/nfs/dbraw/zinc/45/75/55/525457555.db2.gz	FUHSTEGJBBFQAO-GFCCVEGCSA-N	0	0	298.411	4.036	20	30		CIEDRN
Cc1c(C#N)cccc1C(=O)Nc1cccc(C(F)F)c1	ZINC000337797231	525547020	/nfs/dbraw/zinc/54/70/20/525547020.db2.gz	GPFSSKVUJQRWBO-UHFFFAOYSA-N	0	0	286.281	4.057	20	30		CIEDRN
C[C@H](Nc1cc(C2CC2)ccn1)c1ccc(C#N)cc1	ZINC000290037686	525640697	/nfs/dbraw/zinc/64/06/97/525640697.db2.gz	DFTRXXGRXPFYSJ-LBPRGKRZSA-N	0	0	263.344	4.004	20	30		CIEDRN
Cc1ccnc(N[C@@H](c2ccccn2)C2CCCC2)c1C#N	ZINC000363663350	525699253	/nfs/dbraw/zinc/69/92/53/525699253.db2.gz	DWQLJHBTCZNMDQ-QGZVFWFLSA-N	0	0	292.386	4.000	20	30		CIEDRN
Cc1nc(C(C)C)sc1C(=O)Nc1cccc(C#N)c1C	ZINC000335682675	534878211	/nfs/dbraw/zinc/87/82/11/534878211.db2.gz	BKZYNEZELGULPD-UHFFFAOYSA-N	0	0	299.399	4.007	20	30		CIEDRN
Cc1nc(C)c(CNC(=O)[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)o1	ZINC000329188444	534881206	/nfs/dbraw/zinc/88/12/06/534881206.db2.gz	QLEBJNKAFWVQHL-RRFJBIMHSA-N	0	0	290.407	4.354	20	30		CIEDRN
C[C@H](OC(=O)CC(C)(C)C(F)(F)F)c1ccc(C#N)cc1	ZINC000280564277	525880252	/nfs/dbraw/zinc/88/02/52/525880252.db2.gz	VKRVKSCNYBVUMI-JTQLQIEISA-N	0	0	299.292	4.141	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N1[C@H](C)C[C@@H]2CCCC[C@@H]21	ZINC000083560547	526001588	/nfs/dbraw/zinc/00/15/88/526001588.db2.gz	TZOAMGSNBJCTGW-KMFMINBZSA-N	0	0	297.402	4.052	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N1[C@@H](C)C[C@@H]2CCCC[C@@H]21	ZINC000083560548	526001750	/nfs/dbraw/zinc/00/17/50/526001750.db2.gz	TZOAMGSNBJCTGW-QRTARXTBSA-N	0	0	297.402	4.052	20	30		CIEDRN
Cc1cnccc1SCc1ccc(C#N)cc1Cl	ZINC000338622666	526244011	/nfs/dbraw/zinc/24/40/11/526244011.db2.gz	LTGNPSFOOSRXHY-UHFFFAOYSA-N	0	0	274.776	4.207	20	30		CIEDRN
C=C(C)CCc1noc(-c2ccc3nc(C)sc3c2)n1	ZINC000347237729	526465177	/nfs/dbraw/zinc/46/51/77/526465177.db2.gz	HAWYDMRXDVXFRU-UHFFFAOYSA-N	0	0	285.372	4.163	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1cc(C)n(C2CCCCC2)c1C	ZINC000351536447	526498511	/nfs/dbraw/zinc/49/85/11/526498511.db2.gz	JSJIDNBTAPCEMA-UHFFFAOYSA-N	0	0	288.435	4.258	20	30		CIEDRN
N#Cc1c(F)cccc1N[C@@H](c1ccccc1)C1CC1	ZINC000041075435	526524259	/nfs/dbraw/zinc/52/42/59/526524259.db2.gz	IMYZNBWJIQMPGT-KRWDZBQOSA-N	0	0	266.319	4.261	20	30		CIEDRN
CC(C)(C)OC(=O)c1cccc(CSCCCC#N)c1	ZINC000192593653	526532130	/nfs/dbraw/zinc/53/21/30/526532130.db2.gz	JUQOZTKIMIHGEO-UHFFFAOYSA-N	0	0	291.416	4.179	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1ccc(C)c(OC(F)F)c1	ZINC000114817228	526534133	/nfs/dbraw/zinc/53/41/33/526534133.db2.gz	UHTICQIVRYAXLM-UHFFFAOYSA-N	0	0	298.333	4.026	20	30		CIEDRN
Cc1noc(C)c1[C@H](C)CNc1cccc(Cl)c1C#N	ZINC000297515081	526575990	/nfs/dbraw/zinc/57/59/90/526575990.db2.gz	OAZDJTSXJNTHOA-SECBINFHSA-N	0	0	289.766	4.032	20	30		CIEDRN
N#Cc1ccc(CNc2ccc(OC3CCCC3)cc2)o1	ZINC000156224683	526628695	/nfs/dbraw/zinc/62/86/95/526628695.db2.gz	WEKJJDJMJDFRDZ-UHFFFAOYSA-N	0	0	282.343	4.085	20	30		CIEDRN
N#Cc1ccc(NCc2csc3ccccc23)cc1	ZINC000048337140	526665353	/nfs/dbraw/zinc/66/53/53/526665353.db2.gz	OPWZKQQWQXIHML-UHFFFAOYSA-N	0	0	264.353	4.385	20	30		CIEDRN
CC(C)(C)[C@@H]1NC(=O)CC[C@H]1NC(=O)[C@@H]1CCCC1(C)C	ZINC000329212916	526680973	/nfs/dbraw/zinc/68/09/73/526680973.db2.gz	IQEONGWFESOGOV-OUCADQQQSA-N	0	0	294.439	4.303	20	30		CIEDRN
N#Cc1cccc(CN2CCC[C@H]2c2ccsc2)c1F	ZINC000340765587	526704314	/nfs/dbraw/zinc/70/43/14/526704314.db2.gz	XOJCZYVYIULOBJ-HNNXBMFYSA-N	0	0	286.375	4.096	20	30		CIEDRN
N#Cc1cccc(CNc2ccccc2N2CCCCC2)c1	ZINC000078707309	526711144	/nfs/dbraw/zinc/71/11/44/526711144.db2.gz	ALHRYWQZWRPXJU-UHFFFAOYSA-N	0	0	291.398	4.161	20	30		CIEDRN
N#Cc1cccc(CSCc2ccccc2F)c1	ZINC000058238614	526712201	/nfs/dbraw/zinc/71/22/01/526712201.db2.gz	CZKALBWSNYJKOQ-UHFFFAOYSA-N	0	0	257.333	4.131	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(OC)ccc1OC(C)C	ZINC000185708866	526713938	/nfs/dbraw/zinc/71/39/38/526713938.db2.gz	MUHNWIYRJHTFMS-ZDUSSCGKSA-N	0	0	291.391	4.023	20	30		CIEDRN
N#Cc1cccc(NCc2csc3ccccc23)c1	ZINC000054462615	526723987	/nfs/dbraw/zinc/72/39/87/526723987.db2.gz	VOHXLCLJQKYHFM-UHFFFAOYSA-N	0	0	264.353	4.385	20	30		CIEDRN
Cc1oc(C#N)cc1C(=O)N1CCC[C@@H](C)c2ccccc21	ZINC000280975661	526755621	/nfs/dbraw/zinc/75/56/21/526755621.db2.gz	CLJWUFWBIHEZGM-GFCCVEGCSA-N	0	0	294.354	4.004	20	30		CIEDRN
Cc1oc(C#N)cc1C(=O)Nc1ccccc1C(C)(C)C	ZINC000281062039	526758861	/nfs/dbraw/zinc/75/88/61/526758861.db2.gz	YYWOZWQSJZHOGB-UHFFFAOYSA-N	0	0	282.343	4.010	20	30		CIEDRN
C=C(C)[C@H](Nc1nc(CC)ns1)c1ccc(F)c(F)c1	ZINC000302487068	526822137	/nfs/dbraw/zinc/82/21/37/526822137.db2.gz	ZCOLHYAXQNHCFV-ZDUSSCGKSA-N	0	0	295.358	4.108	20	30		CIEDRN
C=C(C)[C@H]1OCC[C@H]1c1nc(C2CCC(C)(C)CC2)no1	ZINC000347497586	526849768	/nfs/dbraw/zinc/84/97/68/526849768.db2.gz	HLUOZTIJHDFPHD-ZIAGYGMSSA-N	0	0	290.407	4.202	20	30		CIEDRN
C=CCOc1ccc(Oc2ncnc3c(C)csc32)cc1	ZINC000480065175	526894847	/nfs/dbraw/zinc/89/48/47/526894847.db2.gz	ZLZWNJPZWIXDIW-UHFFFAOYSA-N	0	0	298.367	4.357	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2ccccc2C(C)(F)F)CC1	ZINC000334606935	526970914	/nfs/dbraw/zinc/97/09/14/526970914.db2.gz	YBLHLADLZCDEQV-UHFFFAOYSA-N	0	0	294.345	4.228	20	30		CIEDRN
CC(C)(CCC#N)CNc1ccc(OC2CCCC2)nc1	ZINC000347917245	527001292	/nfs/dbraw/zinc/00/12/92/527001292.db2.gz	OIIZZKLGMWQKSS-UHFFFAOYSA-N	0	0	287.407	4.145	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000352166380	527030334	/nfs/dbraw/zinc/03/03/34/527030334.db2.gz	NJTNVTIBONSDEY-GOSISDBHSA-N	0	0	296.414	4.306	20	30		CIEDRN
C=CCCC(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000185881594	527068240	/nfs/dbraw/zinc/06/82/40/527068240.db2.gz	FHJFUNIIRMNULY-UHFFFAOYSA-N	0	0	277.795	4.012	20	30		CIEDRN
C=CCCC(=O)N1CCCC[C@H]1c1cc2ccccc2[nH]1	ZINC000108288458	527069524	/nfs/dbraw/zinc/06/95/24/527069524.db2.gz	HJPRWSQJGDIPJZ-KRWDZBQOSA-N	0	0	282.387	4.188	20	30		CIEDRN
C=CCCC(=O)N1C[C@H](c2ccccc2)c2ccccc21	ZINC000347384123	527072867	/nfs/dbraw/zinc/07/28/67/527072867.db2.gz	WYNNYHVBNSAAAT-QGZVFWFLSA-N	0	0	277.367	4.131	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(-c3cnco3)cc2)CC1	ZINC000354691903	527096140	/nfs/dbraw/zinc/09/61/40/527096140.db2.gz	VIDJDPBOYLSAAO-UHFFFAOYSA-N	0	0	282.343	4.027	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1c(C)cc(OC)c(C)c1C	ZINC000352931517	527186823	/nfs/dbraw/zinc/18/68/23/527186823.db2.gz	WPORHLZTMIPUPF-UHFFFAOYSA-N	0	0	290.407	4.050	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(N2CCC(C)(C(C)C)CC2)c1	ZINC000302397742	527224205	/nfs/dbraw/zinc/22/42/05/527224205.db2.gz	JJANDOXXGOCZGQ-UHFFFAOYSA-N	0	0	284.403	4.023	20	30		CIEDRN
C=CC[C@H]1N(C(=O)c2ccc(C3CC3)cn2)CCCC1(C)C	ZINC000347486016	527226270	/nfs/dbraw/zinc/22/62/70/527226270.db2.gz	PAZLYCXMJFABSW-QGZVFWFLSA-N	0	0	298.430	4.166	20	30		CIEDRN
CC(=O)c1ccc(C#N)cc1N1CCC[C@H]1c1ccsc1	ZINC000347401212	527229720	/nfs/dbraw/zinc/22/97/20/527229720.db2.gz	BSZMIALBTQTZRZ-INIZCTEOSA-N	0	0	296.395	4.164	20	30		CIEDRN
C=CCCCSCc1csc([C@H](C)OCC)n1	ZINC000346976169	527249028	/nfs/dbraw/zinc/24/90/28/527249028.db2.gz	YYFUHDXFMLAZCC-NSHDSACASA-N	0	0	271.451	4.440	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CC1(C)C	ZINC000355603055	527259565	/nfs/dbraw/zinc/25/95/65/527259565.db2.gz	WOMNAUQEENNWFE-HNNXBMFYSA-N	0	0	286.419	4.459	20	30		CIEDRN
C=CCCN(C)C(=O)c1c(C)c(C)oc1-c1ccccc1	ZINC000344284170	527315827	/nfs/dbraw/zinc/31/58/27/527315827.db2.gz	JHYMJTJCTYGDQJ-UHFFFAOYSA-N	0	0	283.371	4.212	20	30		CIEDRN
C=CCCN(C)C(=O)c1cc2ccccc2c2cccnc12	ZINC000344258337	527316224	/nfs/dbraw/zinc/31/62/24/527316224.db2.gz	AXLBAWDYENBGBU-UHFFFAOYSA-N	0	0	290.366	4.036	20	30		CIEDRN
CC(C)(C#N)CC(=O)N1CC2(CCCC2)[C@H]1c1ccccc1	ZINC000334757069	527452827	/nfs/dbraw/zinc/45/28/27/527452827.db2.gz	PNOMOBDDXNTIDO-QGZVFWFLSA-N	0	0	296.414	4.070	20	30		CIEDRN
Cc1ncsc1CS[C@H](C)c1cccc(C#N)c1	ZINC000290873333	527514663	/nfs/dbraw/zinc/51/46/63/527514663.db2.gz	ZZDOWTZUSYRWLY-LLVKDONJSA-N	0	0	274.414	4.318	20	30		CIEDRN
CC(=O)N[C@H](C(=O)NC1CCC2(CC2)CC1)C1CCCC1	ZINC000329949269	527543471	/nfs/dbraw/zinc/54/34/71/527543471.db2.gz	LLAWKVXHVMQDKQ-HNNXBMFYSA-N	0	0	292.423	4.201	20	30		CIEDRN
CC(=O)N[C@H](CC1CCC1)C(=O)N[C@@H]1CCC[C@H](C)CC1	ZINC000329963076	527544296	/nfs/dbraw/zinc/54/42/96/527544296.db2.gz	SLLPBVLMNIITHV-APHBMKBZSA-N	0	0	294.439	4.447	20	30		CIEDRN
CCCN(CC#N)C(=O)C[C@@H]1C[C@@H](C(C)C)c2ccccc21	ZINC000345693285	527873488	/nfs/dbraw/zinc/87/34/88/527873488.db2.gz	QAQYFKCFOOKUPL-YJBOKZPZSA-N	0	0	298.430	4.066	20	30		CIEDRN
CC1(C)C(=O)Nc2cc(C(=O)NCCC3=CCCC3)ccc21	ZINC000329002493	527897560	/nfs/dbraw/zinc/89/75/60/527897560.db2.gz	WHFONMDTTGMVAF-UHFFFAOYSA-N	0	0	298.386	4.371	20	30		CIEDRN
CCC[C@H](C)CC(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000352174394	528030041	/nfs/dbraw/zinc/03/00/41/528030041.db2.gz	MNQKDBUBNLZLTQ-RDJZCZTQSA-N	0	0	286.419	4.364	20	30		CIEDRN
CCCC1(C(=O)Nc2ccc(C(C)(C)C#N)cc2)CCC1	ZINC000332419102	528033246	/nfs/dbraw/zinc/03/32/46/528033246.db2.gz	AWOGACKLCCLMFL-UHFFFAOYSA-N	0	0	284.403	4.397	20	30		CIEDRN
CC(C)c1ccc(C(=O)N(C)CC(C)(C)C#N)cc1Cl	ZINC000353269484	528059316	/nfs/dbraw/zinc/05/93/16/528059316.db2.gz	BUARYFWMOFLDOP-UHFFFAOYSA-N	0	0	292.810	4.085	20	30		CIEDRN
CC1CCC(OCC(=O)Nc2scnc2C2CC2)CC1	ZINC000330020643	528208509	/nfs/dbraw/zinc/20/85/09/528208509.db2.gz	WTSIRZOZIITDIO-UHFFFAOYSA-N	0	0	294.420	4.204	20	30		CIEDRN
CCC(C)(C)C1CCC2(C[C@@H]2C(=O)N[C@H](C)CC#N)CC1	ZINC000352102801	528491688	/nfs/dbraw/zinc/49/16/88/528491688.db2.gz	SJKQOMRTVREUCY-XYSPPFBYSA-N	0	0	290.451	4.037	20	30		CIEDRN
CCC(C)(C)C1CCC2(C[C@@H]2C(=O)NCCCC#N)CC1	ZINC000354612246	528492079	/nfs/dbraw/zinc/49/20/79/528492079.db2.gz	KROJPHPRDNEJGA-SWKXRBFHSA-N	0	0	290.451	4.039	20	30		CIEDRN
CCCOCc1ccccc1CNc1ccc(F)cc1C#N	ZINC000301385716	528598767	/nfs/dbraw/zinc/59/87/67/528598767.db2.gz	WWRAIHMVTCJNMT-UHFFFAOYSA-N	0	0	298.361	4.236	20	30		CIEDRN
CC(C)[C@@H](Nc1cccc(C#N)n1)c1ccc(F)cc1F	ZINC000301658784	528599594	/nfs/dbraw/zinc/59/95/94/528599594.db2.gz	WKKGDTCJNAHPBA-MRXNPFEDSA-N	0	0	287.313	4.041	20	30		CIEDRN
CC(C)[C@@H](Nc1ccc([N+](=O)[O-])c(C#N)c1)c1ccccc1	ZINC000301813227	528600469	/nfs/dbraw/zinc/60/04/69/528600469.db2.gz	YUOFTNUOPKGPDW-QGZVFWFLSA-N	0	0	295.342	4.276	20	30		CIEDRN
CCC(C)(C)c1ccc(NC(=O)N2CCC(C#N)CC2)cc1	ZINC000334799351	528606630	/nfs/dbraw/zinc/60/66/30/528606630.db2.gz	AMJJKZRPBQJRIQ-UHFFFAOYSA-N	0	0	299.418	4.142	20	30		CIEDRN
CC(C)[C@@H]1CCCCN1C(=O)C[C@@H](CC#N)c1ccccc1	ZINC000356117151	528648742	/nfs/dbraw/zinc/64/87/42/528648742.db2.gz	LXYUAGIDIPSJEU-MSOLQXFVSA-N	0	0	298.430	4.111	20	30		CIEDRN
CC(C)[C@@H]1CCC[C@@H](NC(=O)[C@@H]2C[C@H](C)CC(=O)N2)CC1	ZINC000329077729	528676108	/nfs/dbraw/zinc/67/61/08/528676108.db2.gz	CQSRPAMCVSOZME-YJNKXOJESA-N	0	0	294.439	4.303	20	30		CIEDRN
CC(C)[C@@H]1CCC[C@H](NC(=O)c2ncoc2C2CC2)CC1	ZINC000329142716	528683386	/nfs/dbraw/zinc/68/33/86/528683386.db2.gz	VEAYJAYYSRZRLP-OCCSQVGLSA-N	0	0	290.407	4.462	20	30		CIEDRN
CCC(CC)CC(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000352174695	528735076	/nfs/dbraw/zinc/73/50/76/528735076.db2.gz	PAMXBIMEMTZHMX-QGZVFWFLSA-N	0	0	286.419	4.364	20	30		CIEDRN
CCOc1ccccc1N[C@@H](C)c1ccc(OCC#N)cc1	ZINC000192911658	528746727	/nfs/dbraw/zinc/74/67/27/528746727.db2.gz	ADWPAEOWMWWSHD-AWEZNQCLSA-N	0	0	296.370	4.161	20	30		CIEDRN
CCCc1nsc(Oc2cc(C)c(C#N)c(C)c2C)n1	ZINC000461882495	528799323	/nfs/dbraw/zinc/79/93/23/528799323.db2.gz	LXNJRZOAYWQZAH-UHFFFAOYSA-N	0	0	287.388	4.080	20	30		CIEDRN
CC1(C)CC(C(=O)Nc2ccc3nnc(C4CCC4)n3c2)C1	ZINC000329087776	528882715	/nfs/dbraw/zinc/88/27/15/528882715.db2.gz	HOSKFDLXKTTZKP-UHFFFAOYSA-N	0	0	298.390	4.021	20	30		CIEDRN
CCCC[C@H](C)C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000352175662	528885051	/nfs/dbraw/zinc/88/50/51/528885051.db2.gz	WXESTNAOHNHWJU-RDJZCZTQSA-N	0	0	286.419	4.364	20	30		CIEDRN
CC1(C)CCC[C@@H](NC(=O)Cc2ccc3c[nH]nc3c2)C1	ZINC000329262927	528953471	/nfs/dbraw/zinc/95/34/71/528953471.db2.gz	BIPSORDMUVIGFX-CQSZACIVSA-N	0	0	285.391	4.031	20	30		CIEDRN
CCC1(C(=O)Nc2csc(-c3ccccn3)n2)CCC1	ZINC000329578533	529015016	/nfs/dbraw/zinc/01/50/16/529015016.db2.gz	WIWJDXAQNZXXCH-UHFFFAOYSA-N	0	0	287.388	4.373	20	30		CIEDRN
CCC[C@@H](Nc1ccc(C#N)cn1)c1ccc(F)cc1F	ZINC000301646581	529023168	/nfs/dbraw/zinc/02/31/68/529023168.db2.gz	PRMKOWQNUFIRPU-OAHLLOKOSA-N	0	0	287.313	4.185	20	30		CIEDRN
CC[C@H](c1nnc(SCC2(C#N)CC2)o1)c1ccccc1	ZINC000349157586	529187676	/nfs/dbraw/zinc/18/76/76/529187676.db2.gz	HKHHBAYAEYNSOF-ZDUSSCGKSA-N	0	0	299.399	4.007	20	30		CIEDRN
CCS[C@H]1CCCC[C@H]1Nc1ccc(C#N)cc1	ZINC000301567172	529228525	/nfs/dbraw/zinc/22/85/25/529228525.db2.gz	QFJFQPHFTNKJEW-CABCVRRESA-N	0	0	260.406	4.034	20	30		CIEDRN
CC[C@@H]1CCC[C@@H](NC(=O)c2oc(CC3CC3)nc2C)C1	ZINC000330010099	529302319	/nfs/dbraw/zinc/30/23/19/529302319.db2.gz	HVLPBBPBVCACBN-TZMCWYRMSA-N	0	0	290.407	4.209	20	30		CIEDRN
CC[C@@H]1CCC[C@H](NC(=O)c2oc(CC3CC3)nc2C)C1	ZINC000330010098	529312949	/nfs/dbraw/zinc/31/29/49/529312949.db2.gz	HVLPBBPBVCACBN-OCCSQVGLSA-N	0	0	290.407	4.209	20	30		CIEDRN
CC[C@H](CC1CCCC1)C(=O)N[C@@H]1CCCc2c[nH]nc21	ZINC000330124090	529319172	/nfs/dbraw/zinc/31/91/72/529319172.db2.gz	LELVFQGSPPAOQE-UKRRQHHQSA-N	0	0	289.423	4.350	20	30		CIEDRN
C[C@H](Nc1ccc(C#N)cn1)c1ccccc1C(F)(F)F	ZINC000057142085	570387837	/nfs/dbraw/zinc/38/78/37/570387837.db2.gz	ZRBSTRQDVKYXTG-JTQLQIEISA-N	0	0	291.276	4.145	20	30		CIEDRN
Cc1c2ccccc2oc1[C@H](C)Nc1cccnc1C#N	ZINC000573313236	334926454	/nfs/dbraw/zinc/92/64/54/334926454.db2.gz	NJCOBFSAGSXLRI-LBPRGKRZSA-N	0	0	277.327	4.181	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H](C)OCCC(C)C)n1	ZINC000573345032	334929908	/nfs/dbraw/zinc/92/99/08/334929908.db2.gz	PUOBXTGYEYDVHP-GFCCVEGCSA-N	0	0	266.385	4.047	20	30		CIEDRN
C=CCC[C@H](C(=O)N[C@H]1CCC[C@H](F)C1)c1ccccc1	ZINC000573372186	334932330	/nfs/dbraw/zinc/93/23/30/334932330.db2.gz	CYNOKHYVKUDGQX-ULQDDVLXSA-N	0	0	289.394	4.133	20	30		CIEDRN
CCc1cc(C2CC2)nc(NC(=O)[C@H]2CCC(C)(C)C2)n1	ZINC000329612974	529526358	/nfs/dbraw/zinc/52/63/58/529526358.db2.gz	CORCORJNFASGMQ-LBPRGKRZSA-N	0	0	287.407	4.331	20	30		CIEDRN
CC[C@H](NC(=O)C[C@H]1CCCC(=O)N1)c1cccs1	ZINC000329260099	529579627	/nfs/dbraw/zinc/57/96/27/529579627.db2.gz	AVGRCHXQFVEPOG-MNOVXSKESA-N	0	0	280.393	4.055	20	30		CIEDRN
CC[C@H](NC(=O)[C@@H]1CCC[C@@H]2CCCC[C@@H]12)c1ncc[nH]1	ZINC000329096039	529580941	/nfs/dbraw/zinc/58/09/41/529580941.db2.gz	LBLHMSGUPYPBDN-YJNKXOJESA-N	0	0	289.423	4.424	20	30		CIEDRN
CCc1nc2sccc2c(Oc2ccc(C#N)cc2F)n1	ZINC000301839352	529751952	/nfs/dbraw/zinc/75/19/52/529751952.db2.gz	OAHGUFCQRNFMBF-UHFFFAOYSA-N	0	0	299.330	4.057	20	30		CIEDRN
CC[C@H](C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N	ZINC000066954487	260250168	/nfs/dbraw/zinc/25/01/68/260250168.db2.gz	FUEQPPDGCQNOKN-RYUDHWBXSA-N	0	0	291.420	4.001	20	30		CIEDRN
O=C(/C=C/c1c(Cl)cccc1Cl)c1ccco1	ZINC000103216937	185816934	/nfs/dbraw/zinc/81/69/34/185816934.db2.gz	HGVZUAGUUSMIDY-VOTSOKGWSA-N	0	0	267.111	4.483	20	30		CIEDRN
N#Cc1cc(F)ccc1NCCc1ccc(Cl)cc1	ZINC000104248884	185942755	/nfs/dbraw/zinc/94/27/55/185942755.db2.gz	FYDSTXRKQGBFDC-UHFFFAOYSA-N	0	0	274.726	4.005	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1nc(C(C)(C)C)co1)c1ccccc1	ZINC000573859987	334972286	/nfs/dbraw/zinc/97/22/86/334972286.db2.gz	BCYJZGVUFWGSSL-ZDUSSCGKSA-N	0	0	298.386	4.271	20	30		CIEDRN
CC[C@H](C)n1ncc(NC2CCC(C)(C#N)CC2)c1C	ZINC000449287486	260362452	/nfs/dbraw/zinc/36/24/52/260362452.db2.gz	WTGIUYYMPDMUJM-YGONEPDPSA-N	0	0	274.412	4.047	20	30		CIEDRN
C=CC(C)(C)C(=O)Nc1ccccc1SC[C@H](C)C#N	ZINC000410460456	260529588	/nfs/dbraw/zinc/52/95/88/260529588.db2.gz	VTUVWYKWVSPENT-GFCCVEGCSA-N	0	0	288.416	4.089	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)c1cscc1-c1ccccc1	ZINC000574087687	334991311	/nfs/dbraw/zinc/99/13/11/334991311.db2.gz	JIYHIADHALOOIQ-GFCCVEGCSA-N	0	0	271.385	4.110	20	30		CIEDRN
CCCCCCCC(=O)N[C@@H](CC)c1ccncc1	ZINC000158019965	261157348	/nfs/dbraw/zinc/15/73/48/261157348.db2.gz	PDIHMBNDJKTVGB-HNNXBMFYSA-N	0	0	262.397	4.009	20	30		CIEDRN
N#CCCCCSCc1coc(-c2cccs2)n1	ZINC000161377130	261245467	/nfs/dbraw/zinc/24/54/67/261245467.db2.gz	WMXJAJHRBZJXPT-UHFFFAOYSA-N	0	0	278.402	4.330	20	30		CIEDRN
C[C@H](Sc1ccc(C#N)cn1)c1ccc(F)cc1F	ZINC000497683192	262189167	/nfs/dbraw/zinc/18/91/67/262189167.db2.gz	LWIMPIBAKSHJPZ-VIFPVBQESA-N	0	0	276.311	4.085	20	30		CIEDRN
Cc1csc(NC(=O)[C@H]2CCCC(C)(C)C2)c1C#N	ZINC000575023017	335056482	/nfs/dbraw/zinc/05/64/82/335056482.db2.gz	NCPMRIZVAOHCTR-NSHDSACASA-N	0	0	276.405	4.083	20	30		CIEDRN
Cc1ccc(C(C)(C)C(=O)Nc2cc(C#N)ccc2C)cc1	ZINC000171165561	335057597	/nfs/dbraw/zinc/05/75/97/335057597.db2.gz	YSLPKEPCQRKMNT-UHFFFAOYSA-N	0	0	292.382	4.091	20	30		CIEDRN
N#CCCCCSc1cccc(Br)c1	ZINC000055307768	262347681	/nfs/dbraw/zinc/34/76/81/262347681.db2.gz	UWJJLGICWUDTJR-UHFFFAOYSA-N	0	0	270.195	4.235	20	30		CIEDRN
N#Cc1ccc(CS[C@H]2CCCc3ccccc32)nc1	ZINC000575068728	335061375	/nfs/dbraw/zinc/06/13/75/335061375.db2.gz	SGHXEKUWGAACIC-KRWDZBQOSA-N	0	0	280.396	4.264	20	30		CIEDRN
N#Cc1ccc(COc2cc(F)ccc2Cl)cc1F	ZINC000404161687	260061725	/nfs/dbraw/zinc/06/17/25/260061725.db2.gz	QTGBFAUMMQTYKK-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
N#Cc1c(F)cccc1N[C@H](c1ccccc1)[C@@H]1CCCO1	ZINC000171372903	335063545	/nfs/dbraw/zinc/06/35/45/335063545.db2.gz	HJVYSTBIDAVUNY-ZWKOTPCHSA-N	0	0	296.345	4.030	20	30		CIEDRN
C[C@@H](c1ccc(F)cc1)N(C)Cc1ccc(F)cc1C#N	ZINC000171374928	335063853	/nfs/dbraw/zinc/06/38/53/335063853.db2.gz	HEVUVHZOPJRKAO-LBPRGKRZSA-N	0	0	286.325	4.029	20	30		CIEDRN
COc1ccc(C#N)cc1CNc1ccc(F)c(C2CC2)c1	ZINC000352618907	533271963	/nfs/dbraw/zinc/27/19/63/533271963.db2.gz	WEYYKOYPUUSRQT-UHFFFAOYSA-N	0	0	296.345	4.195	20	30		CIEDRN
CSCCCS[C@H](C)c1cccc(C#N)c1	ZINC000190899175	533575361	/nfs/dbraw/zinc/57/53/61/533575361.db2.gz	LFPJMIGHXJLGMS-LLVKDONJSA-N	0	0	251.420	4.106	20	30		CIEDRN
C[C@H](CC#N)N(C)Cc1cccc(Oc2ccccc2)c1	ZINC000353415875	533603277	/nfs/dbraw/zinc/60/32/77/533603277.db2.gz	KHCPTPSIAZKMTK-OAHLLOKOSA-N	0	0	280.371	4.213	20	30		CIEDRN
Cc1[nH]nc(-c2ccccc2)c1NC(=O)[C@H]1C[C@@H]1C1CC1	ZINC000330139551	533655926	/nfs/dbraw/zinc/65/59/26/533655926.db2.gz	WJHZCFCAMJGCHZ-KGLIPLIRSA-N	0	0	281.359	4.019	20	30		CIEDRN
Cc1[nH]nc(-c2ccccc2)c1NC(=O)[C@@H]1C[C@@H]1C1CC1	ZINC000330139555	533656363	/nfs/dbraw/zinc/65/63/63/533656363.db2.gz	WJHZCFCAMJGCHZ-ZIAGYGMSSA-N	0	0	281.359	4.019	20	30		CIEDRN
Cc1cc(NCc2csc3ccccc23)cc(C#N)n1	ZINC000341721238	129996748	/nfs/dbraw/zinc/99/67/48/129996748.db2.gz	KJVMJZQRMYOFMA-UHFFFAOYSA-N	0	0	279.368	4.089	20	30		CIEDRN
Cc1nsc(N[C@@H]2CCc3c2cccc3Cl)c1C#N	ZINC000341759455	130025230	/nfs/dbraw/zinc/02/52/30/130025230.db2.gz	FZNYMQGOARQLSB-CYBMUJFWSA-N	0	0	289.791	4.076	20	30		CIEDRN
N#Cc1ccc2c(c1)CCC[C@H]2NCc1c(F)cccc1F	ZINC000341829338	130062210	/nfs/dbraw/zinc/06/22/10/130062210.db2.gz	UJPZHINRNNGOAI-GOSISDBHSA-N	0	0	298.336	4.004	20	30		CIEDRN
C[C@H](SCc1ccc(F)cc1C#N)c1cccnc1	ZINC000341906497	130119792	/nfs/dbraw/zinc/11/97/92/130119792.db2.gz	YJWCTOAJQUFUTJ-NSHDSACASA-N	0	0	272.348	4.087	20	30		CIEDRN
CCSc1ccc([C@@H](C)Nc2cc(C#N)ccn2)cc1	ZINC000341945746	130153150	/nfs/dbraw/zinc/15/31/50/130153150.db2.gz	PYTLGRDRXFJFCT-GFCCVEGCSA-N	0	0	283.400	4.238	20	30		CIEDRN
N#Cc1ccc(CSCCOC2CCC2)c(Cl)c1	ZINC000342095138	130256671	/nfs/dbraw/zinc/25/66/71/130256671.db2.gz	ZPDYOYIIQIPWFM-UHFFFAOYSA-N	0	0	281.808	4.014	20	30		CIEDRN
C=CCSc1nnc(Nc2ccc(C)c(C)c2)s1	ZINC000005168068	170073310	/nfs/dbraw/zinc/07/33/10/170073310.db2.gz	QAIGLLONHXRVCP-UHFFFAOYSA-N	0	0	277.418	4.177	20	30		CIEDRN
N#Cc1ccc(NC(=O)c2cccc(Cl)c2)cc1Cl	ZINC000005749796	170136602	/nfs/dbraw/zinc/13/66/02/170136602.db2.gz	HCDKHUIOFQOSEY-UHFFFAOYSA-N	0	0	291.137	4.117	20	30		CIEDRN
CC[C@@H](C)[C@H](C(=O)Nc1cccc(C#N)c1)c1ccccc1	ZINC000007265452	170275286	/nfs/dbraw/zinc/27/52/86/170275286.db2.gz	XQKWYLLHJGCPTQ-KDOFPFPSSA-N	0	0	292.382	4.327	20	30		CIEDRN
CC(C)c1cccc(Oc2ccc([N+](=O)[O-])cc2C#N)c1	ZINC000007980718	170311246	/nfs/dbraw/zinc/31/12/46/170311246.db2.gz	QIMXEDPBFQELEW-UHFFFAOYSA-N	0	0	282.299	4.382	20	30		CIEDRN
Cc1ccc(Sc2ccc([N+](=O)[O-])cc2C#N)c(C)c1	ZINC000007983505	170311565	/nfs/dbraw/zinc/31/15/65/170311565.db2.gz	CLTOHKLQWPEFJM-UHFFFAOYSA-N	0	0	284.340	4.235	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)CCc2ccccc2)c1	ZINC000009823768	170386321	/nfs/dbraw/zinc/38/63/21/170386321.db2.gz	IWLMNYFWZGHQCH-UHFFFAOYSA-N	0	0	295.382	4.213	20	30		CIEDRN
N#Cc1ccccc1OCc1ccc(Cl)c(Cl)c1	ZINC000011897436	170457580	/nfs/dbraw/zinc/45/75/80/170457580.db2.gz	UBVKZDCWUKDSPY-UHFFFAOYSA-N	0	0	278.138	4.444	20	30		CIEDRN
CC(C)c1ccc(CNc2ccc(C#N)cc2)cc1	ZINC000019231209	170756660	/nfs/dbraw/zinc/75/66/60/170756660.db2.gz	XPBUJMPUTAQAPB-UHFFFAOYSA-N	0	0	250.345	4.294	20	30		CIEDRN
N#Cc1cccc(CNc2ccc(C(F)(F)F)cc2)c1	ZINC000019909824	170921314	/nfs/dbraw/zinc/92/13/14/170921314.db2.gz	RBNZCUSOPOVVTE-UHFFFAOYSA-N	0	0	276.261	4.189	20	30		CIEDRN
N#Cc1cccc(CNc2ccccc2OC(F)(F)F)c1	ZINC000019913376	170923246	/nfs/dbraw/zinc/92/32/46/170923246.db2.gz	CQYGBWHASXVJHC-UHFFFAOYSA-N	0	0	292.260	4.069	20	30		CIEDRN
Cc1c(Cl)cccc1NCc1ccc(C#N)cc1F	ZINC000020042724	170976261	/nfs/dbraw/zinc/97/62/61/170976261.db2.gz	GIYKIWKAHHDCID-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
Cc1nc2cc(N[C@H](C)c3ccc(C#N)cc3)ccc2o1	ZINC000020144009	171029907	/nfs/dbraw/zinc/02/99/07/171029907.db2.gz	OCYMPYRHKXNURR-LLVKDONJSA-N	0	0	277.327	4.181	20	30		CIEDRN
N#Cc1cccc(C(=O)Nc2cccc(Cl)c2Cl)c1	ZINC000020246535	171100160	/nfs/dbraw/zinc/10/01/60/171100160.db2.gz	FCCBCYMUHIZOMW-UHFFFAOYSA-N	0	0	291.137	4.117	20	30		CIEDRN
N#Cc1cccc(COc2ccc(C(F)(F)F)cc2)c1	ZINC000020304841	171141465	/nfs/dbraw/zinc/14/14/65/171141465.db2.gz	FPGZSOYTIQJCGX-UHFFFAOYSA-N	0	0	277.245	4.156	20	30		CIEDRN
Cc1ccc(N[C@H](C)c2ccc(C#N)cc2)c(F)c1	ZINC000020372027	171168474	/nfs/dbraw/zinc/16/84/74/171168474.db2.gz	FOFPXUVFJQTEPJ-GFCCVEGCSA-N	0	0	254.308	4.179	20	30		CIEDRN
Cc1ccc(F)c(N[C@H](C)c2ccc(C#N)cc2)c1	ZINC000020471771	171214780	/nfs/dbraw/zinc/21/47/80/171214780.db2.gz	ZYHAZVNTABYCAS-GFCCVEGCSA-N	0	0	254.308	4.179	20	30		CIEDRN
C#Cc1cccc(NC(=O)c2ccc3ccccc3c2)c1	ZINC000022761098	171397892	/nfs/dbraw/zinc/39/78/92/171397892.db2.gz	XTSNQIODIHKKHC-UHFFFAOYSA-N	0	0	271.319	4.073	20	30		CIEDRN
N#Cc1cccc(COc2c(Cl)cccc2Cl)c1	ZINC000037389266	173172175	/nfs/dbraw/zinc/17/21/75/173172175.db2.gz	MVFLPBTYMLDJOV-UHFFFAOYSA-N	0	0	278.138	4.444	20	30		CIEDRN
N#CC1(C(=O)Nc2ccc(Cl)cc2Cl)CCCC1	ZINC000044292923	175160086	/nfs/dbraw/zinc/16/00/86/175160086.db2.gz	VCAJSWIEXBKOPY-UHFFFAOYSA-N	0	0	283.158	4.016	20	30		CIEDRN
N#CC1(C(=O)Nc2ccc(Cl)c(Cl)c2)CCCC1	ZINC000044292876	175160371	/nfs/dbraw/zinc/16/03/71/175160371.db2.gz	ILMJBRFKQBVPAI-UHFFFAOYSA-N	0	0	283.158	4.016	20	30		CIEDRN
Cc1ccc(NC(=O)C2(C#N)CCCCC2)cc1Cl	ZINC000044385116	175169770	/nfs/dbraw/zinc/16/97/70/175169770.db2.gz	JRZBEJWAVGPCSA-UHFFFAOYSA-N	0	0	276.767	4.061	20	30		CIEDRN
CCCn1c2ccc(Cl)cc2nc1SCCCC#N	ZINC000071816610	176269484	/nfs/dbraw/zinc/26/94/84/176269484.db2.gz	UNUQXYOZLXNEAR-UHFFFAOYSA-N	0	0	293.823	4.496	20	30		CIEDRN
CC(C)[C@@H](NC(=O)Nc1ccc(C#N)cc1)c1ccccc1	ZINC000071855684	176277931	/nfs/dbraw/zinc/27/79/31/176277931.db2.gz	FLFAZNCWXMPPMS-QGZVFWFLSA-N	0	0	293.370	4.077	20	30		CIEDRN
CC[C@H](NC(=O)c1ccc(C#N)cc1)c1cccc(Cl)c1	ZINC000071861853	176279798	/nfs/dbraw/zinc/27/97/98/176279798.db2.gz	KMPZRRGGPJSHLY-INIZCTEOSA-N	0	0	298.773	4.093	20	30		CIEDRN
C=CCCO[C@H](C)C(=O)N(c1cc(C)ccc1C)C(C)C	ZINC000078472020	177344249	/nfs/dbraw/zinc/34/42/49/177344249.db2.gz	VKCBGPZGBPOXQL-MRXNPFEDSA-N	0	0	289.419	4.026	20	30		CIEDRN
Cc1cccc(N[C@@H](C)c2ccc(OCC#N)cc2)c1C	ZINC000037215584	260075369	/nfs/dbraw/zinc/07/53/69/260075369.db2.gz	PWKYXRVBUXXZIZ-HNNXBMFYSA-N	0	0	280.371	4.379	20	30		CIEDRN
N#Cc1cc(CN(Cc2ccccc2F)C2CC2)ccc1F	ZINC000344405162	225050687	/nfs/dbraw/zinc/05/06/87/225050687.db2.gz	NLPYMVBMBODGGD-UHFFFAOYSA-N	0	0	298.336	4.001	20	30		CIEDRN
Cc1nc(C)c(C#N)c(SCCCC2CCCC2)n1	ZINC000344216817	225011785	/nfs/dbraw/zinc/01/17/85/225011785.db2.gz	TZCJSZCJSUBWOR-UHFFFAOYSA-N	0	0	275.421	4.028	20	30		CIEDRN
N#CC1(CSCc2ccc(Br)s2)CC1	ZINC000344475254	225069669	/nfs/dbraw/zinc/06/96/69/225069669.db2.gz	MOENPKLNGSTVSL-UHFFFAOYSA-N	0	0	288.235	4.048	20	30		CIEDRN
Cc1cc(C(=O)CS[C@H](C)c2ccc(C#N)cc2)c(C)[nH]1	ZINC000118446570	225090651	/nfs/dbraw/zinc/09/06/51/225090651.db2.gz	MMDXLTCDFHROAR-CYBMUJFWSA-N	0	0	298.411	4.180	20	30		CIEDRN
Cc1ccc(C#N)c(NCCc2csc3ccccc23)n1	ZINC000346818827	225930698	/nfs/dbraw/zinc/93/06/98/225930698.db2.gz	DQEZJNJKNXTVOX-UHFFFAOYSA-N	0	0	293.395	4.131	20	30		CIEDRN
Cc1oc2ccc(NC(=O)c3cscc3C#N)cc2c1C	ZINC000347222267	226091129	/nfs/dbraw/zinc/09/11/29/226091129.db2.gz	YNTRIHBWDDRYNN-UHFFFAOYSA-N	0	0	296.351	4.235	20	30		CIEDRN
N#Cc1cnccc1/C=C/c1csc(-c2ccsc2)n1	ZINC000347441703	226157715	/nfs/dbraw/zinc/15/77/15/226157715.db2.gz	LJDINFARBUXCDD-OWOJBTEDSA-N	0	0	295.392	4.309	20	30		CIEDRN
N#CC1(CCCSc2cccc(F)c2)CCOCC1	ZINC000347781165	226375329	/nfs/dbraw/zinc/37/53/29/226375329.db2.gz	UEKZMHFNSFMKIK-UHFFFAOYSA-N	0	0	279.380	4.018	20	30		CIEDRN
N#CCCCC(=O)NCc1ccc(C2CCCCC2)cc1	ZINC000348225680	226427059	/nfs/dbraw/zinc/42/70/59/226427059.db2.gz	BZISZDLIBLBRNY-UHFFFAOYSA-N	0	0	284.403	4.044	20	30		CIEDRN
C[C@H](C(=O)Nc1sccc1C#N)c1cccc(Cl)c1	ZINC000335676520	226538527	/nfs/dbraw/zinc/53/85/27/226538527.db2.gz	WZIXFMYCSXFPLE-VIFPVBQESA-N	0	0	290.775	4.015	20	30		CIEDRN
CC[C@@](C)(C#N)c1nc([C@H](c2ccc(C)cc2)C(C)C)no1	ZINC000575162015	335073827	/nfs/dbraw/zinc/07/38/27/335073827.db2.gz	HXVZBOCIGQLUNF-YJBOKZPZSA-N	0	0	297.402	4.357	20	30		CIEDRN
Cc1ccc(C(=O)N(CCC#N)CCC(C)C)c(Cl)c1	ZINC000191235733	226616644	/nfs/dbraw/zinc/61/66/44/226616644.db2.gz	GSXLECNKRTVFQX-UHFFFAOYSA-N	0	0	292.810	4.050	20	30		CIEDRN
Cc1oc(C(C)C)cc1C(=O)N(CCC#N)CCC(C)C	ZINC000352576102	227081427	/nfs/dbraw/zinc/08/14/27/227081427.db2.gz	GUPIFHJNFQFALM-UHFFFAOYSA-N	0	0	290.407	4.113	20	30		CIEDRN
Cc1cc([C@@H](C)Nc2ncc(C#N)cc2Cl)c(C)s1	ZINC000354722819	227082334	/nfs/dbraw/zinc/08/23/34/227082334.db2.gz	GQFNIMNQPXKDCU-SECBINFHSA-N	0	0	291.807	4.458	20	30		CIEDRN
Cc1ccc(Cl)c(NC(=O)c2sccc2C#N)c1C	ZINC000336528127	227096421	/nfs/dbraw/zinc/09/64/21/227096421.db2.gz	DNIYJBYCPQWMAU-UHFFFAOYSA-N	0	0	290.775	4.142	20	30		CIEDRN
CCN(C(=O)Nc1cc(C#N)ccc1C)C1CCCCC1	ZINC000171892093	335083823	/nfs/dbraw/zinc/08/38/23/335083823.db2.gz	WAWJAXVVNFUQTJ-UHFFFAOYSA-N	0	0	285.391	4.053	20	30		CIEDRN
COc1ccc(C#N)cc1NCc1cc2cc(F)ccc2o1	ZINC000354840105	227156393	/nfs/dbraw/zinc/15/63/93/227156393.db2.gz	GMBMJGUUGXMJEZ-UHFFFAOYSA-N	0	0	296.301	4.064	20	30		CIEDRN
Cc1cc(NC(=O)[C@@H]2CC23CCCC3)cc2n[nH]cc21	ZINC000329047357	227270610	/nfs/dbraw/zinc/27/06/10/227270610.db2.gz	JUXWMGZEEXYTLT-ZDUSSCGKSA-N	0	0	269.348	4.040	20	30		CIEDRN
N#CC1(NC(=O)[C@@H]2CCC[C@@H]3CCCC[C@@H]23)CCCC1	ZINC000329072245	227283406	/nfs/dbraw/zinc/28/34/06/227283406.db2.gz	ODVSMEQXOPMDGF-RRFJBIMHSA-N	0	0	274.408	4.386	20	30		CIEDRN
Cc1nnc(NC(=O)C[C@H]2CCCCC2(C)C)n1C1CC1	ZINC000329151472	227329192	/nfs/dbraw/zinc/32/91/92/227329192.db2.gz	SIUBQXFQPHQHJF-GFCCVEGCSA-N	0	0	290.411	4.116	20	30		CIEDRN
NC(=O)[C@@H]1CCC[C@H](C(=O)NC(C2CCC2)C2CCC2)C1	ZINC000329183334	227342270	/nfs/dbraw/zinc/34/22/70/227342270.db2.gz	FOZUMDSLFULINT-KGLIPLIRSA-N	0	0	292.423	4.253	20	30		CIEDRN
C[C@@H](Nc1snc(Cl)c1C#N)c1ccc(Cl)cc1	ZINC000301121409	227455771	/nfs/dbraw/zinc/45/57/71/227455771.db2.gz	ZGOBSGGRMHASHK-SSDOTTSWSA-N	0	0	298.198	4.495	20	30		CIEDRN
CCOc1cccc([C@@H](C)Nc2ccc(C#N)cc2)c1	ZINC000301125340	227456466	/nfs/dbraw/zinc/45/64/66/227456466.db2.gz	YBOWQDRJMAGPLJ-CYBMUJFWSA-N	0	0	266.344	4.130	20	30		CIEDRN
Cc1ccccc1[C@@H](Nc1ncccc1C#N)C(C)C	ZINC000301234612	227483494	/nfs/dbraw/zinc/48/34/94/227483494.db2.gz	KWQZCDAKUAZOCT-INIZCTEOSA-N	0	0	265.360	4.071	20	30		CIEDRN
C[C@H](c1ccccc1)[C@H](C)Nc1snc(Cl)c1C#N	ZINC000301463150	227547107	/nfs/dbraw/zinc/54/71/07/227547107.db2.gz	FRFIKGDYHQPSBC-UWVGGRQHSA-N	0	0	291.807	4.272	20	30		CIEDRN
Cc1ccc([C@@H]2[C@@H](C)CCCN2c2ccc(C#N)cn2)cc1	ZINC000301559548	227586691	/nfs/dbraw/zinc/58/66/91/227586691.db2.gz	IBEQKCBBCVWVDZ-KXBFYZLASA-N	0	0	291.398	4.239	20	30		CIEDRN
Cc1ccc([C@@H]2[C@H](C)CCCN2c2ncccc2C#N)cc1	ZINC000301569817	227591583	/nfs/dbraw/zinc/59/15/83/227591583.db2.gz	KOIOBTAQCYDHIS-QAPCUYQASA-N	0	0	291.398	4.239	20	30		CIEDRN
Cc1c(CNc2ccc(F)cc2C#N)oc2ccccc12	ZINC000301394620	227527973	/nfs/dbraw/zinc/52/79/73/227527973.db2.gz	KOLPVVVJHXXILR-UHFFFAOYSA-N	0	0	280.302	4.364	20	30		CIEDRN
Cc1nnccc1NC(=O)C12CC3C[C@@](C)(C1)C[C@](C)(C3)C2	ZINC000329644948	227753372	/nfs/dbraw/zinc/75/33/72/227753372.db2.gz	AQKSJMGKHKDJFH-DWLODGJJSA-N	0	0	299.418	4.370	20	30		CIEDRN
C[C@H](Nc1cccc(C#N)n1)c1cc2cccc(F)c2o1	ZINC000353042511	227935097	/nfs/dbraw/zinc/93/50/97/227935097.db2.gz	HSXBPUULMVCLAM-JTQLQIEISA-N	0	0	281.290	4.012	20	30		CIEDRN
Cc1ccc(N(C)Cc2csc3ccccc23)nc1C#N	ZINC000302602233	227869474	/nfs/dbraw/zinc/86/94/74/227869474.db2.gz	CJIMIMBVCDQBPD-UHFFFAOYSA-N	0	0	293.395	4.113	20	30		CIEDRN
Cc1ccc(N[C@H]2CCSc3c(F)cccc32)nc1C#N	ZINC000302619458	227870212	/nfs/dbraw/zinc/87/02/12/227870212.db2.gz	GPRALCXHLATPIH-ZDUSSCGKSA-N	0	0	299.374	4.050	20	30		CIEDRN
C[C@H]1CCC[C@@H](Nc2snc(Cl)c2C#N)CC1	ZINC000302674232	227871022	/nfs/dbraw/zinc/87/10/22/227871022.db2.gz	PDGXLYJGEAXRDW-DTWKUNHWSA-N	0	0	269.801	4.049	20	30		CIEDRN
Cc1cc(C)cc([C@H](C)Nc2ccc(C)c(C#N)n2)c1	ZINC000302670345	227874187	/nfs/dbraw/zinc/87/41/87/227874187.db2.gz	RIUXPDQZXHVBMR-AWEZNQCLSA-N	0	0	265.360	4.052	20	30		CIEDRN
Cc1ccc(-c2cccnc2)cc1NC(=O)[C@@H]1CO[C@@H](C)C1	ZINC000330060695	228029683	/nfs/dbraw/zinc/02/96/83/228029683.db2.gz	NBWPSECEVRWQAC-BBRMVZONSA-N	0	0	296.370	4.070	20	30		CIEDRN
Cc1ccc(-c2cccnc2)cc1NC(=O)[C@H]1CO[C@@H](C)C1	ZINC000330060698	228030101	/nfs/dbraw/zinc/03/01/01/228030101.db2.gz	NBWPSECEVRWQAC-XJKSGUPXSA-N	0	0	296.370	4.070	20	30		CIEDRN
O=C(NC1CCC(C(=O)NCC2CCCC2)CC1)C1CC1	ZINC000329971035	228003309	/nfs/dbraw/zinc/00/33/09/228003309.db2.gz	VGMKELIHILYRMK-UHFFFAOYSA-N	0	0	292.423	4.058	20	30		CIEDRN
Cc1nc(CC2CC2)oc1C(=O)N[C@H]1CCCCC1(C)C	ZINC000330009383	228015624	/nfs/dbraw/zinc/01/56/24/228015624.db2.gz	HGHVYWHUNNLRPZ-ZDUSSCGKSA-N	0	0	290.407	4.209	20	30		CIEDRN
Cc1nc(CC2CC2)oc1C(=O)N[C@@H]1CCC[C@H](C)[C@H]1C	ZINC000330029567	228021159	/nfs/dbraw/zinc/02/11/59/228021159.db2.gz	QGOYWJVOUBJIAM-MISXGVKJSA-N	0	0	290.407	4.065	20	30		CIEDRN
N#C[C@H]1CCC[C@H](Nc2cccc3ccccc32)C1	ZINC000193118955	228051611	/nfs/dbraw/zinc/05/16/11/228051611.db2.gz	DHVKYPJWBQOVJQ-ZFWWWQNUSA-N	0	0	250.345	4.334	20	30		CIEDRN
N#C[C@@H]1CCC[C@@H]1NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1	ZINC000330227656	228072749	/nfs/dbraw/zinc/07/27/49/228072749.db2.gz	PIXIMWTZOGSYNK-ZDCRXTMVSA-N	0	0	294.807	4.154	20	30		CIEDRN
C[C@@H]1CC[C@@H](CC(=O)N[C@@H](CCCC#N)c2ccccc2)C1	ZINC000352192482	228194983	/nfs/dbraw/zinc/19/49/83/228194983.db2.gz	MNFORDHFGKLMDL-NUJGCVRESA-N	0	0	298.430	4.364	20	30		CIEDRN
N#CCCC[C@@H](NC(=O)CC1=CCCCC1)c1ccccc1	ZINC000352215743	228200512	/nfs/dbraw/zinc/20/05/12/228200512.db2.gz	GEDPBIZFMXWSCU-GOSISDBHSA-N	0	0	296.414	4.428	20	30		CIEDRN
Cc1cc(C(=O)N[C@@H](CCCC#N)c2ccccc2)c(C)o1	ZINC000352215343	228200519	/nfs/dbraw/zinc/20/05/19/228200519.db2.gz	CJVLGEOVVHXJEU-KRWDZBQOSA-N	0	0	296.370	4.061	20	30		CIEDRN
N#C[C@]1(C(=O)Nc2cccc3ccsc32)CC12CCCC2	ZINC000333550085	228203771	/nfs/dbraw/zinc/20/37/71/228203771.db2.gz	MKAIPRMECBKFKP-KRWDZBQOSA-N	0	0	296.395	4.314	20	30		CIEDRN
N#Cc1ccc(Oc2ccc(NC(=O)CC3CC3)cc2)cc1	ZINC000519979097	260038270	/nfs/dbraw/zinc/03/82/70/260038270.db2.gz	LOFHFMZIBWOXRM-UHFFFAOYSA-N	0	0	292.338	4.089	20	30		CIEDRN
Cc1nc(N[C@H](C)Cc2cccs2)c(Cl)cc1C#N	ZINC000394121086	260083143	/nfs/dbraw/zinc/08/31/43/260083143.db2.gz	WLWFQTOYDHMDBA-SECBINFHSA-N	0	0	291.807	4.020	20	30		CIEDRN
Cc1cnn(CCCCCSc2ccc(C#N)cc2)c1	ZINC000521367782	260087245	/nfs/dbraw/zinc/08/72/45/260087245.db2.gz	WUCCQXKAZSKUBE-UHFFFAOYSA-N	0	0	285.416	4.026	20	30		CIEDRN
N#Cc1ccc(CN2CCC[C@H]2c2ccc(Cl)cc2)o1	ZINC000180148428	260094684	/nfs/dbraw/zinc/09/46/84/260094684.db2.gz	GHBOADGFRRNLEK-INIZCTEOSA-N	0	0	286.762	4.142	20	30		CIEDRN
C=C(C)CN(C)C(=O)[C@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000180398088	260100434	/nfs/dbraw/zinc/10/04/34/260100434.db2.gz	BPWFLGOXIYKJPW-NEPJUHHUSA-N	0	0	298.213	4.131	20	30		CIEDRN
C=C(C)CN(C)C(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1Cl	ZINC000180399245	260100624	/nfs/dbraw/zinc/10/06/24/260100624.db2.gz	FNLPRKTVDFFAMS-VXGBXAGGSA-N	0	0	298.213	4.131	20	30		CIEDRN
Cc1cc(Cl)c(C(=O)N(CC#N)c2ccccc2)cc1C	ZINC000180610326	260106837	/nfs/dbraw/zinc/10/68/37/260106837.db2.gz	RMCUYPBINFSHOO-UHFFFAOYSA-N	0	0	298.773	4.127	20	30		CIEDRN
C=CCN(CC=C)C(=O)c1ccc(-c2ccc(C)o2)s1	ZINC000180661544	260108292	/nfs/dbraw/zinc/10/82/92/260108292.db2.gz	JWOYANARAVHFOP-UHFFFAOYSA-N	0	0	287.384	4.131	20	30		CIEDRN
N#Cc1ccc2[nH]c(-c3ccc(C(F)F)cc3)nc2c1	ZINC000526042261	260112436	/nfs/dbraw/zinc/11/24/36/260112436.db2.gz	DKCYJISOBORRBV-UHFFFAOYSA-N	0	0	269.254	4.039	20	30		CIEDRN
C=CCCCS[C@H](C)C(=O)Nc1ccccc1C	ZINC000117944511	260118065	/nfs/dbraw/zinc/11/80/65/260118065.db2.gz	DNUQGGVXILKTAJ-CYBMUJFWSA-N	0	0	263.406	4.021	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc([C@@H](C)c2c(F)cccc2F)no1	ZINC000516812710	260130998	/nfs/dbraw/zinc/13/09/98/260130998.db2.gz	WMARJLNAEHFDTP-QFYYESIMSA-N	0	0	292.329	4.353	20	30		CIEDRN
C=C[C@](C)(CC)c1nc([C@H](C)c2c(F)cccc2F)no1	ZINC000516812711	260131143	/nfs/dbraw/zinc/13/11/43/260131143.db2.gz	WMARJLNAEHFDTP-QLJPJBMISA-N	0	0	292.329	4.353	20	30		CIEDRN
Cc1nc(Oc2ccc3ccccc3c2)ccc1C#N	ZINC000312530126	260141475	/nfs/dbraw/zinc/14/14/75/260141475.db2.gz	VIQXLENXNJXTAX-UHFFFAOYSA-N	0	0	260.296	4.207	20	30		CIEDRN
C=CCn1c(C)nnc1S[C@H](C)c1ccc(Cl)cc1	ZINC000299109461	260173004	/nfs/dbraw/zinc/17/30/04/260173004.db2.gz	YHQANKCODOZIOB-SNVBAGLBSA-N	0	0	293.823	4.279	20	30		CIEDRN
N#C[C@@H](NC(=O)c1ccc2ccccc2c1)C1CCCCC1	ZINC000080288934	260179502	/nfs/dbraw/zinc/17/95/02/260179502.db2.gz	JSKDWDRROADUEQ-GOSISDBHSA-N	0	0	292.382	4.042	20	30		CIEDRN
C=CCOc1ccc(C[NH2+]Cc2ccccc2CC)cc1	ZINC000084200342	260190885	/nfs/dbraw/zinc/19/08/85/260190885.db2.gz	WNZCUVXKRDXAQC-UHFFFAOYSA-N	0	0	281.399	4.104	20	30		CIEDRN
N#Cc1ccc(C[S@@](=O)c2ccc3ccccc3c2)cc1	ZINC000084265095	260190972	/nfs/dbraw/zinc/19/09/72/260190972.db2.gz	NSGIBISRBPKNMD-NRFANRHFSA-N	0	0	291.375	4.019	20	30		CIEDRN
CC(C)(C#N)CCCOc1ccccc1C(F)(F)F	ZINC000087608913	260192431	/nfs/dbraw/zinc/19/24/31/260192431.db2.gz	HABIRPZDAYSMGO-UHFFFAOYSA-N	0	0	271.282	4.414	20	30		CIEDRN
CC(C)(C#N)CCCCSC1(CO)CCCCC1	ZINC000312966880	260224685	/nfs/dbraw/zinc/22/46/85/260224685.db2.gz	GKMCGRGQLNXVGH-UHFFFAOYSA-N	0	0	269.454	4.135	20	30		CIEDRN
N#Cc1ccc(NC(=O)CC2CCCC2)cc1C(F)(F)F	ZINC000088191904	260289958	/nfs/dbraw/zinc/28/99/58/260289958.db2.gz	GICUKFKAMVZXSI-UHFFFAOYSA-N	0	0	296.292	4.096	20	30		CIEDRN
CC(C)(C)c1ccccc1NC(=O)N(CCC#N)CC1CC1	ZINC000078455641	260300391	/nfs/dbraw/zinc/30/03/91/260300391.db2.gz	OXPXXDAHNPEJFR-UHFFFAOYSA-N	0	0	299.418	4.142	20	30		CIEDRN
Cc1ccc2cccc(NCc3cc(C#N)cs3)c2n1	ZINC000093688035	260300758	/nfs/dbraw/zinc/30/07/58/260300758.db2.gz	ALWFASVFZRBGKG-UHFFFAOYSA-N	0	0	279.368	4.089	20	30		CIEDRN
CC(C)c1ccc(CN(CCC#N)Cc2cccnc2)cc1	ZINC000078663658	260301490	/nfs/dbraw/zinc/30/14/90/260301490.db2.gz	JNCKIQJFNLHBLE-UHFFFAOYSA-N	0	0	293.414	4.121	20	30		CIEDRN
Cc1nc2ccc(NCc3cc(C#N)cs3)cc2s1	ZINC000093685974	260301535	/nfs/dbraw/zinc/30/15/35/260301535.db2.gz	KSPRPPRAQPSHLJ-UHFFFAOYSA-N	0	0	285.397	4.150	20	30		CIEDRN
N#Cc1ccc(F)cc1CSc1cccc(F)c1C#N	ZINC000517833111	260310107	/nfs/dbraw/zinc/31/01/07/260310107.db2.gz	RJQBCTMVUZGUDZ-UHFFFAOYSA-N	0	0	286.306	4.000	20	30		CIEDRN
Cc1ccc(C(=O)COc2ccc(C#N)cc2Cl)cc1C	ZINC000008252182	260334693	/nfs/dbraw/zinc/33/46/93/260334693.db2.gz	QVQSFDWNEGVVRX-UHFFFAOYSA-N	0	0	299.757	4.090	20	30		CIEDRN
C=C(C)CSc1nnc(-c2ccccc2Cl)o1	ZINC000518125197	260344190	/nfs/dbraw/zinc/34/41/90/260344190.db2.gz	IAENQENLNROIKU-UHFFFAOYSA-N	0	0	266.753	4.058	20	30		CIEDRN
C=C1CCN(C(=O)c2ccc(OCCCCC)cc2)CC1	ZINC000518136682	260345007	/nfs/dbraw/zinc/34/50/07/260345007.db2.gz	SWVBTWWJTGGYLF-UHFFFAOYSA-N	0	0	287.403	4.048	20	30		CIEDRN
C=C1CCN(C(=O)CCSc2ccccc2Cl)CC1	ZINC000518178467	260350138	/nfs/dbraw/zinc/35/01/38/260350138.db2.gz	WHUDDBGOQJJHSG-UHFFFAOYSA-N	0	0	295.835	4.001	20	30		CIEDRN
C=CCOc1cccc(NC(=O)c2ccoc2CCC)c1	ZINC000409516634	260414346	/nfs/dbraw/zinc/41/43/46/260414346.db2.gz	XKGXSPSGJQFMIA-UHFFFAOYSA-N	0	0	285.343	4.049	20	30		CIEDRN
N#Cc1ccc(F)c(CSCc2ccccc2F)c1	ZINC000518482711	260437619	/nfs/dbraw/zinc/43/76/19/260437619.db2.gz	WZPAPCHMKYNVQV-UHFFFAOYSA-N	0	0	275.323	4.270	20	30		CIEDRN
C=CCC(C)(C)c1noc(C2(c3ccccc3OC)CC2)n1	ZINC000518503122	260440709	/nfs/dbraw/zinc/44/07/09/260440709.db2.gz	QUTINYHFQXLPIL-UHFFFAOYSA-N	0	0	298.386	4.012	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)C[C@H](C)C1CCCCC1	ZINC000410116139	260462176	/nfs/dbraw/zinc/46/21/76/260462176.db2.gz	ARYFDJIUOCCDCJ-DZGCQCFKSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1ccc(C)c(C)c1Cl	ZINC000410125484	260463268	/nfs/dbraw/zinc/46/32/68/260463268.db2.gz	YBGDRCNYZCFFHV-LBPRGKRZSA-N	0	0	265.784	4.041	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Cc1c(Cl)cccc1Cl	ZINC000410120824	260463522	/nfs/dbraw/zinc/46/35/22/260463522.db2.gz	MOPHHJCTWBQEOY-JTQLQIEISA-N	0	0	286.202	4.007	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000410149997	260467270	/nfs/dbraw/zinc/46/72/70/260467270.db2.gz	YSHOGRATWRTHTD-SMDDNHRTSA-N	0	0	299.336	4.280	20	30		CIEDRN
Cc1cc(Cl)ccc1NCC(C)(C)CCC#N	ZINC000092139470	260485135	/nfs/dbraw/zinc/48/51/35/260485135.db2.gz	UQRABBPXWRRHQC-UHFFFAOYSA-N	0	0	250.773	4.390	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)[C@H](C)CC(=C)C	ZINC000410344085	260487496	/nfs/dbraw/zinc/48/74/96/260487496.db2.gz	HJPKEIHFTOWOEL-CQSZACIVSA-N	0	0	257.377	4.346	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@]1(c2ccc(Cl)cc2)C[C@@H]1C	ZINC000410366280	260491224	/nfs/dbraw/zinc/49/12/24/260491224.db2.gz	NZLAQMKEZRSARY-DCGLDWPTSA-N	0	0	291.822	4.294	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1ncccc1CC	ZINC000410369990	260491374	/nfs/dbraw/zinc/49/13/74/260491374.db2.gz	ZJHSUTQCSOHAES-UHFFFAOYSA-N	0	0	280.371	4.015	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1cc(F)cc(F)c1	ZINC000410370195	260491597	/nfs/dbraw/zinc/49/15/97/260491597.db2.gz	BAAKCHHJEOXRCD-UHFFFAOYSA-N	0	0	287.309	4.336	20	30		CIEDRN
Cc1cc(C#N)cc(N[C@H](C)c2cccc(Cl)c2)n1	ZINC000161002524	260567193	/nfs/dbraw/zinc/56/71/93/260567193.db2.gz	ANBTVCCLWZJINU-LLVKDONJSA-N	0	0	271.751	4.088	20	30		CIEDRN
CC[C@H](Nc1ccc(C#N)cc1[N+](=O)[O-])c1cccs1	ZINC000049531234	260663217	/nfs/dbraw/zinc/66/32/17/260663217.db2.gz	YRSPTXMSYSZBAG-NSHDSACASA-N	0	0	287.344	4.091	20	30		CIEDRN
C=CCN(C(=O)C[C@H](C)c1c(C)noc1C)c1ccccc1	ZINC000156290228	260785160	/nfs/dbraw/zinc/78/51/60/260785160.db2.gz	XJKWTQWKDIPKHZ-ZDUSSCGKSA-N	0	0	298.386	4.004	20	30		CIEDRN
C=CCC[C@H](C(=O)Nc1ccc(O)cc1C)c1ccccc1	ZINC000427637271	260794828	/nfs/dbraw/zinc/79/48/28/260794828.db2.gz	FZHDCSPIIPBTLP-KRWDZBQOSA-N	0	0	295.382	4.389	20	30		CIEDRN
C[C@H](Nc1cnn([C@@H](C)C2CC2)c1)c1ccc(C#N)cc1F	ZINC000427897596	260877030	/nfs/dbraw/zinc/87/70/30/260877030.db2.gz	YLMOGJHBGBVKDL-RYUDHWBXSA-N	0	0	298.365	4.038	20	30		CIEDRN
C[C@@H](CCC(=O)Nc1sccc1C#N)c1ccccc1	ZINC000136564086	260927534	/nfs/dbraw/zinc/92/75/34/260927534.db2.gz	QYAZNLCIZCCNNV-LBPRGKRZSA-N	0	0	284.384	4.142	20	30		CIEDRN
CC(C)(CCC#N)CNc1ccc2nc(C3CC3)oc2c1	ZINC000152494584	261064819	/nfs/dbraw/zinc/06/48/19/261064819.db2.gz	GBKCICKWTFPGBJ-UHFFFAOYSA-N	0	0	283.375	4.447	20	30		CIEDRN
N#Cc1ccc(CNc2ccc3nc(C4CC4)oc3c2)s1	ZINC000152505315	261064870	/nfs/dbraw/zinc/06/48/70/261064870.db2.gz	ZKOIPUSRSSEOEL-UHFFFAOYSA-N	0	0	295.367	4.250	20	30		CIEDRN
CC[C@@H](C)c1ccc(OC[C@@H](C#N)CCC#N)cc1	ZINC000153052595	261073075	/nfs/dbraw/zinc/07/30/75/261073075.db2.gz	SPPFDCZUDYIDND-ZIAGYGMSSA-N	0	0	256.349	4.022	20	30		CIEDRN
C/C=C(\C=C\C(=O)N[C@H](CCC#N)c1ccccc1)CC	ZINC000153585190	261080938	/nfs/dbraw/zinc/08/09/38/261080938.db2.gz	NIBPBYQGIXTNPJ-DJRJIQKLSA-N	0	0	282.387	4.060	20	30		CIEDRN
Cc1cccc(OC(F)F)c1NCCCC(C)(C)C#N	ZINC000153677435	261081949	/nfs/dbraw/zinc/08/19/49/261081949.db2.gz	MYXXDQTVPFXXER-UHFFFAOYSA-N	0	0	282.334	4.338	20	30		CIEDRN
C=CCN(CC=C)C(=O)N[C@@H]1C[C@H](C(C)C)c2ccccc21	ZINC000448285188	261089951	/nfs/dbraw/zinc/08/99/51/261089951.db2.gz	HJYZCLXLWQIZPT-QZTJIDSGSA-N	0	0	298.430	4.255	20	30		CIEDRN
N#Cc1ccc(OC[C@@H]2CCCCC2(F)F)c(Cl)c1	ZINC000394499298	261102086	/nfs/dbraw/zinc/10/20/86/261102086.db2.gz	LIXJNDBYCPFFTG-NSHDSACASA-N	0	0	285.721	4.416	20	30		CIEDRN
C=CCCCNC(=O)N1CCCCC[C@@H]1c1ccc(C)o1	ZINC000448389974	261139891	/nfs/dbraw/zinc/13/98/91/261139891.db2.gz	QABOSUSQLOVWMT-OAHLLOKOSA-N	0	0	290.407	4.181	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1ccc(OC(C)C)c(C)c1	ZINC000173718690	261168625	/nfs/dbraw/zinc/16/86/25/261168625.db2.gz	IQXPUBAFSMLFBS-UHFFFAOYSA-N	0	0	290.407	4.212	20	30		CIEDRN
N#Cc1ccccc1SCc1cc(-c2ccco2)on1	ZINC000173719331	261168842	/nfs/dbraw/zinc/16/88/42/261168842.db2.gz	SRJWLFMHYQWAGB-UHFFFAOYSA-N	0	0	282.324	4.099	20	30		CIEDRN
C#CCN(CC)C(=S)Nc1ccccc1-c1ccccc1	ZINC000490604921	261169397	/nfs/dbraw/zinc/16/93/97/261169397.db2.gz	NNLHCJRJDBNYMN-UHFFFAOYSA-N	0	0	294.423	4.006	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)[C@@H]2C[C@H]2CCC)CCCC1(C)C	ZINC000462348615	261186259	/nfs/dbraw/zinc/18/62/59/261186259.db2.gz	WQPZMIMKQCJDNW-KFWWJZLASA-N	0	0	263.425	4.016	20	30		CIEDRN
C[C@H](Nc1ccc(Cl)cc1C#N)c1cccc(O)c1	ZINC000174719816	261194177	/nfs/dbraw/zinc/19/41/77/261194177.db2.gz	UDQYTKCVDGFYEE-JTQLQIEISA-N	0	0	272.735	4.090	20	30		CIEDRN
Cc1cccc2c1[C@H](C)C[C@H]2CC(=O)N[C@H](C#N)C(C)(C)C	ZINC000464712428	261215078	/nfs/dbraw/zinc/21/50/78/261215078.db2.gz	QIFKQWBROPQOFH-IJEWVQPXSA-N	0	0	298.430	4.030	20	30		CIEDRN
CC(C)(C#N)CCC[S@@](=O)[C@@H]1CCCc2ccccc21	ZINC000161205527	261240012	/nfs/dbraw/zinc/24/00/12/261240012.db2.gz	ZHVMOZGFISSBSU-UZLBHIALSA-N	0	0	289.444	4.143	20	30		CIEDRN
Cc1ccccc1OCCCSCCCCC#N	ZINC000161672798	261256278	/nfs/dbraw/zinc/25/62/78/261256278.db2.gz	HHZKSIGMAVSCRS-UHFFFAOYSA-N	0	0	263.406	4.191	20	30		CIEDRN
CCc1noc(C)c1CSCCCC(C)(C)C#N	ZINC000161945148	261264452	/nfs/dbraw/zinc/26/44/52/261264452.db2.gz	RNJFCKPVRIBVCQ-UHFFFAOYSA-N	0	0	266.410	4.109	20	30		CIEDRN
CCSCc1ccc(C(=O)Nc2ccccc2C#N)cc1	ZINC000102830974	261271174	/nfs/dbraw/zinc/27/11/74/261271174.db2.gz	USSXTEAOYCDSDD-UHFFFAOYSA-N	0	0	296.395	4.064	20	30		CIEDRN
CCc1cccc(CC)c1NC(=O)c1ccc(C#N)cc1C	ZINC000162367046	261279508	/nfs/dbraw/zinc/27/95/08/261279508.db2.gz	SEXWIWMGENMCPU-UHFFFAOYSA-N	0	0	292.382	4.244	20	30		CIEDRN
CCC(CC)CN(CC)C(=O)Nc1ccc(CC#N)cc1	ZINC000162604848	261287866	/nfs/dbraw/zinc/28/78/66/261287866.db2.gz	PGDDWXJSLVGADG-UHFFFAOYSA-N	0	0	287.407	4.043	20	30		CIEDRN
CCC(CC)CN(CCC#N)C(=O)c1ccc(Cl)cc1	ZINC000104542608	261296418	/nfs/dbraw/zinc/29/64/18/261296418.db2.gz	PIAWZRMTSSIRFP-UHFFFAOYSA-N	0	0	292.810	4.132	20	30		CIEDRN
N#Cc1cnc2ccccc2c1N1CCC2(C1)CCCCC2	ZINC000301446739	261333762	/nfs/dbraw/zinc/33/37/62/261333762.db2.gz	JZMXUVVNJZXNFK-UHFFFAOYSA-N	0	0	291.398	4.267	20	30		CIEDRN
Cc1nc2ccccc2nc1CSc1cccc(C#N)c1	ZINC000177103821	261333799	/nfs/dbraw/zinc/33/37/99/261333799.db2.gz	OHQIIXVKNHTNDE-UHFFFAOYSA-N	0	0	291.379	4.102	20	30		CIEDRN
CC(C)(C#N)CCCOc1ccc(Cl)cc1F	ZINC000177203655	261339052	/nfs/dbraw/zinc/33/90/52/261339052.db2.gz	SRVKNOZKKRVBJE-UHFFFAOYSA-N	0	0	255.720	4.188	20	30		CIEDRN
N#Cc1cc(N2CCC3(CCCCC3)CC2)ccc1[N+](=O)[O-]	ZINC000301788339	261340722	/nfs/dbraw/zinc/34/07/22/261340722.db2.gz	XTPQLBMJHZNNGH-UHFFFAOYSA-N	0	0	299.374	4.017	20	30		CIEDRN
Cc1cc(Cl)c(C(C)C)cc1Oc1ccc(C#N)nn1	ZINC000301947035	261345171	/nfs/dbraw/zinc/34/51/71/261345171.db2.gz	XSZHONALKDSFHX-UHFFFAOYSA-N	0	0	287.750	4.226	20	30		CIEDRN
Cc1ccc2ccnc(NCC3CCC(C#N)CC3)c2c1	ZINC000518762846	261362258	/nfs/dbraw/zinc/36/22/58/261362258.db2.gz	PTJKGOVGKVTCDJ-UHFFFAOYSA-N	0	0	279.387	4.285	20	30		CIEDRN
CSc1ccccc1NCc1cc(C#N)ccc1F	ZINC000178232585	261380792	/nfs/dbraw/zinc/38/07/92/261380792.db2.gz	FWOKYIROROZNQZ-UHFFFAOYSA-N	0	0	272.348	4.031	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(Cc1ccccc1C)C1CC1	ZINC000466367165	261396548	/nfs/dbraw/zinc/39/65/48/261396548.db2.gz	QIPIDEMVWXNGSW-INIZCTEOSA-N	0	0	286.419	4.024	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)N(C)C1CCCCCC1	ZINC000178562155	261398295	/nfs/dbraw/zinc/39/82/95/261398295.db2.gz	HUYUSIZIIYENSM-UHFFFAOYSA-N	0	0	285.391	4.053	20	30		CIEDRN
CC[C@@H](NC(=O)Nc1cccc(C#N)c1C)c1cccs1	ZINC000178578028	261398909	/nfs/dbraw/zinc/39/89/09/261398909.db2.gz	GKLHDSUAVFXCJH-CYBMUJFWSA-N	0	0	299.399	4.201	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(Cc1ccccc1)CC(C)C	ZINC000466384592	261399575	/nfs/dbraw/zinc/39/95/75/261399575.db2.gz	ULEIWZAZRYRKGQ-QGZVFWFLSA-N	0	0	288.435	4.209	20	30		CIEDRN
CC(C)c1ccc(C[S@@](=O)Cc2cccc(C#N)c2)cc1	ZINC000170982559	261453574	/nfs/dbraw/zinc/45/35/74/261453574.db2.gz	MVIVLSHGVYPYQL-OAQYLSRUSA-N	0	0	297.423	4.131	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@@H](C)c1cccc(F)c1	ZINC000460378852	261536249	/nfs/dbraw/zinc/53/62/49/261536249.db2.gz	ZZHFVDWORQCDPT-AWEZNQCLSA-N	0	0	277.383	4.134	20	30		CIEDRN
C[C@@H](Nc1ccc2c(c1)C(=O)CCC2)c1ccc(C#N)cc1	ZINC000175513396	261610818	/nfs/dbraw/zinc/61/08/18/261610818.db2.gz	CTLPYIWIEMOJCT-CYBMUJFWSA-N	0	0	290.366	4.250	20	30		CIEDRN
CSc1ccc(NC(=O)C2(C#N)CCCC2)cc1Cl	ZINC000175914471	261629972	/nfs/dbraw/zinc/62/99/72/261629972.db2.gz	GGOCVMBXQISHEX-UHFFFAOYSA-N	0	0	294.807	4.084	20	30		CIEDRN
CCC1(C(=O)Nc2cc(C#N)ccc2C)CCCCC1	ZINC000460679817	261682469	/nfs/dbraw/zinc/68/24/69/261682469.db2.gz	PLVXMYWAJHICIF-UHFFFAOYSA-N	0	0	270.376	4.166	20	30		CIEDRN
CC[C@@H](c1ccc(F)cc1)[S@](=O)CCCC(C)(C)C#N	ZINC000178103855	261726076	/nfs/dbraw/zinc/72/60/76/261726076.db2.gz	ACUNBJGTDRQVQO-MGPUTAFESA-N	0	0	295.423	4.355	20	30		CIEDRN
Cc1nc(SCCCCC#N)[nH]c1Cc1ccccc1	ZINC000182791195	261950818	/nfs/dbraw/zinc/95/08/18/261950818.db2.gz	GOXASZHEJLGILB-UHFFFAOYSA-N	0	0	285.416	4.095	20	30		CIEDRN
CCCCCCCC(=O)NC[C@@H](C)c1ncc(C)s1	ZINC000184051465	262006193	/nfs/dbraw/zinc/00/61/93/262006193.db2.gz	ZTRHNDZZUSAHAA-GFCCVEGCSA-N	0	0	282.453	4.032	20	30		CIEDRN
N#CCCSc1ccccc1NC(=O)Nc1ccccc1	ZINC000108431271	262040291	/nfs/dbraw/zinc/04/02/91/262040291.db2.gz	YLVZPQFZRMMOJS-UHFFFAOYSA-N	0	0	297.383	4.336	20	30		CIEDRN
Cc1ccc(N[C@@H]2CCC[C@H](C#N)C2)cc1OC(F)F	ZINC000185729739	262068818	/nfs/dbraw/zinc/06/88/18/262068818.db2.gz	SSBHVWPYLZQFKS-NWDGAFQWSA-N	0	0	280.318	4.091	20	30		CIEDRN
N#C[C@H]1CCC[C@@H](Nc2ccc(SC(F)F)cc2)C1	ZINC000185734711	262068822	/nfs/dbraw/zinc/06/88/22/262068822.db2.gz	LCTIKPNXLVCGBG-CMPLNLGQSA-N	0	0	282.359	4.496	20	30		CIEDRN
CC(F)(F)CCCNc1ccc(Cl)cc1C#N	ZINC000390073496	262105135	/nfs/dbraw/zinc/10/51/35/262105135.db2.gz	OYIBPGOZBAHITK-UHFFFAOYSA-N	0	0	258.699	4.059	20	30		CIEDRN
CCCCCCCC(=O)NC[C@@H](C)c1nc(C)cs1	ZINC000186028841	262076127	/nfs/dbraw/zinc/07/61/27/262076127.db2.gz	USYYMQWRGZEICC-GFCCVEGCSA-N	0	0	282.453	4.032	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)C[C@@H]2C=CCCC2)cc1	ZINC000186586074	262100707	/nfs/dbraw/zinc/10/07/07/262100707.db2.gz	DAEPIAMRSUMEGO-CQSZACIVSA-N	0	0	282.387	4.173	20	30		CIEDRN
C[C@H](CCC#N)Sc1nnc(-c2ccccc2Cl)o1	ZINC000188314457	262153532	/nfs/dbraw/zinc/15/35/32/262153532.db2.gz	SLEVYQDOTOIPOL-SECBINFHSA-N	0	0	293.779	4.174	20	30		CIEDRN
C#CCCCCC(=O)Nc1ccc(OC(C)C)cc1Cl	ZINC000188315507	262154092	/nfs/dbraw/zinc/15/40/92/262154092.db2.gz	IHLNUFSJNDKIHR-UHFFFAOYSA-N	0	0	293.794	4.259	20	30		CIEDRN
CC(C)(CCC#N)CNc1ccc(-c2cnco2)cc1	ZINC000119753289	262170869	/nfs/dbraw/zinc/17/08/69/262170869.db2.gz	UORYWCLZCUDFMA-UHFFFAOYSA-N	0	0	269.348	4.083	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000190258710	262181494	/nfs/dbraw/zinc/18/14/94/262181494.db2.gz	CEIZVAZTYZSORV-KRWDZBQOSA-N	0	0	270.376	4.029	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cccc(O[C@@H](C)CC)c1	ZINC000497634570	262183763	/nfs/dbraw/zinc/18/37/63/262183763.db2.gz	SHRBVQSYQHDADF-KGLIPLIRSA-N	0	0	275.392	4.405	20	30		CIEDRN
N#CCCCSCc1csc(C2CCCC2)n1	ZINC000190929780	262187282	/nfs/dbraw/zinc/18/72/82/262187282.db2.gz	QPMZFPOKQBIDKW-UHFFFAOYSA-N	0	0	266.435	4.338	20	30		CIEDRN
C[C@@H](Sc1ccc(C#N)cn1)c1ccc(F)c(F)c1	ZINC000497682916	262189482	/nfs/dbraw/zinc/18/94/82/262189482.db2.gz	GQUASNOXCFGWIJ-SECBINFHSA-N	0	0	276.311	4.085	20	30		CIEDRN
CC[C@@H](C)CC(=O)Nc1ccccc1SC[C@H](C)C#N	ZINC000191482279	262192553	/nfs/dbraw/zinc/19/25/53/262192553.db2.gz	WJRLAJJNDGEPAY-CHWSQXEVSA-N	0	0	290.432	4.313	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H]1c1ccc(F)c(F)c1	ZINC000364311781	262199127	/nfs/dbraw/zinc/19/91/27/262199127.db2.gz	AAOIWGGKBKTQNS-LRDDRELGSA-N	0	0	293.357	4.231	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@H]1c1ccc(F)c(F)c1	ZINC000364311783	262199167	/nfs/dbraw/zinc/19/91/67/262199167.db2.gz	AAOIWGGKBKTQNS-WBMJQRKESA-N	0	0	293.357	4.231	20	30		CIEDRN
CC(C)(CCC#N)CNc1ccc2scnc2c1	ZINC000192257827	262200833	/nfs/dbraw/zinc/20/08/33/262200833.db2.gz	FEFVNEVVZFMJBP-UHFFFAOYSA-N	0	0	259.378	4.038	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)c1cccc(Cl)c1	ZINC000497797473	262210924	/nfs/dbraw/zinc/21/09/24/262210924.db2.gz	ANOPDTCDBCPSBM-UHFFFAOYSA-N	0	0	285.774	4.168	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)c1ccc(Cl)cc1	ZINC000497798261	262210936	/nfs/dbraw/zinc/21/09/36/262210936.db2.gz	KBEAFGMBTDMSDY-UHFFFAOYSA-N	0	0	285.774	4.168	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)c1cc(CC)c(C)s1	ZINC000497799289	262211654	/nfs/dbraw/zinc/21/16/54/262211654.db2.gz	TTZANINRNMJPBU-UHFFFAOYSA-N	0	0	299.439	4.447	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@H](c1cccc(C)c1)C(C)(C)C	ZINC000497807507	262212369	/nfs/dbraw/zinc/21/23/69/262212369.db2.gz	BNMHQRHTLDPSNG-MRXNPFEDSA-N	0	0	288.435	4.300	20	30		CIEDRN
N#C[C@@H]1CCC[C@@H](Nc2cccc(COCC3CC3)c2)C1	ZINC000193088205	262215890	/nfs/dbraw/zinc/21/58/90/262215890.db2.gz	WJWVHBAGHHZFEG-NVXWUHKLSA-N	0	0	284.403	4.107	20	30		CIEDRN
CCCCC1CCC(C(=O)N[C@](C)(C#N)C(C)C)CC1	ZINC000497831697	262215909	/nfs/dbraw/zinc/21/59/09/262215909.db2.gz	OCGBQCTUBCMQAE-VMBOVVBDSA-N	0	0	278.440	4.037	20	30		CIEDRN
C=CCN(CC=C)C(=O)[C@@H]1C[C@@H]1c1cccc2ccccc21	ZINC000502885583	262233186	/nfs/dbraw/zinc/23/31/86/262233186.db2.gz	AFWMVWVPNRMEKQ-RTBURBONSA-N	0	0	291.394	4.144	20	30		CIEDRN
C=CCN(CC=C)C(=O)[C@H]1C[C@@H]1c1cccc2ccccc21	ZINC000502885580	262233296	/nfs/dbraw/zinc/23/32/96/262233296.db2.gz	AFWMVWVPNRMEKQ-MOPGFXCFSA-N	0	0	291.394	4.144	20	30		CIEDRN
CC[C@H](CC#N)NCc1cccc(OCc2ccccc2)c1	ZINC000184087600	262269204	/nfs/dbraw/zinc/26/92/04/262269204.db2.gz	BGRVPQPXILAZEB-GOSISDBHSA-N	0	0	294.398	4.047	20	30		CIEDRN
C#CCCCCC(=O)Nc1ccccc1SC(F)F	ZINC000119517654	262274516	/nfs/dbraw/zinc/27/45/16/262274516.db2.gz	CFSIYQCWWBHUSQ-UHFFFAOYSA-N	0	0	283.343	4.133	20	30		CIEDRN
CC(C)(C#N)CCCSC[C@H]1Cc2ccccc2O1	ZINC000365070734	262276789	/nfs/dbraw/zinc/27/67/89/262276789.db2.gz	ZXJOOPWXXSDUHN-CQSZACIVSA-N	0	0	275.417	4.053	20	30		CIEDRN
C=CCC1(C(=O)Nc2cccc(CC(F)(F)F)c2)CCC1	ZINC000188406608	262294620	/nfs/dbraw/zinc/29/46/20/262294620.db2.gz	FBCUTQZKYFKHLX-UHFFFAOYSA-N	0	0	297.320	4.476	20	30		CIEDRN
C[C@@H](CC#N)N(C)C(=O)c1ccc(C(C)(C)C)c(Cl)c1	ZINC000354820383	262296815	/nfs/dbraw/zinc/29/68/15/262296815.db2.gz	MEMGRTZQWODILP-NSHDSACASA-N	0	0	292.810	4.012	20	30		CIEDRN
N#CCCCCSCc1cc(-c2ccccc2)no1	ZINC000161240383	262313463	/nfs/dbraw/zinc/31/34/63/262313463.db2.gz	FCZBHFUHEHYRGF-UHFFFAOYSA-N	0	0	272.373	4.269	20	30		CIEDRN
CC(C)Oc1cccc(CSCCCCC#N)c1	ZINC000161537101	262316847	/nfs/dbraw/zinc/31/68/47/262316847.db2.gz	JBINDIBICFDTAS-UHFFFAOYSA-N	0	0	263.406	4.401	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CC=C(c2cccc(C)c2)CC1	ZINC000188563704	262317756	/nfs/dbraw/zinc/31/77/56/262317756.db2.gz	QOMUJWBWVMZXED-IBGZPJMESA-N	0	0	283.415	4.213	20	30		CIEDRN
N#CCCCCSCc1csc(-c2ccoc2)n1	ZINC000161752456	262319276	/nfs/dbraw/zinc/31/92/76/262319276.db2.gz	NCCVIVZBBGWLEF-UHFFFAOYSA-N	0	0	278.402	4.330	20	30		CIEDRN
C=CCC[C@H](C(=O)Nc1c(C)onc1CC)c1ccccc1	ZINC000188844469	262325261	/nfs/dbraw/zinc/32/52/61/262325261.db2.gz	OOVDJRROUVKQSU-HNNXBMFYSA-N	0	0	298.386	4.234	20	30		CIEDRN
N#Cc1cc(Cl)ccc1N[C@H]1CSc2ccccc21	ZINC000522758661	262339058	/nfs/dbraw/zinc/33/90/58/262339058.db2.gz	HWOYWXWUXMPHGC-AWEZNQCLSA-N	0	0	286.787	4.471	20	30		CIEDRN
N#Cc1cc(F)c(N[C@@H]2CSc3ccccc32)c(F)c1	ZINC000522759046	262339229	/nfs/dbraw/zinc/33/92/29/262339229.db2.gz	AQRCAFABCSBOLG-CYBMUJFWSA-N	0	0	288.322	4.095	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)c2c(C)coc2C)CCCC1(C)C	ZINC000355337912	262362482	/nfs/dbraw/zinc/36/24/82/262362482.db2.gz	HQLIYDMNDOZCBS-AWEZNQCLSA-N	0	0	275.392	4.103	20	30		CIEDRN
C=CC[C@H]1N(C(=O)c2c(C)coc2C)CCCC1(C)C	ZINC000355337915	262362662	/nfs/dbraw/zinc/36/26/62/262362662.db2.gz	HQLIYDMNDOZCBS-CQSZACIVSA-N	0	0	275.392	4.103	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Nc1ccc(F)c(OC)c1	ZINC000187120300	262381848	/nfs/dbraw/zinc/38/18/48/262381848.db2.gz	KLXUMUFUFSYZMW-UHFFFAOYSA-N	0	0	294.370	4.044	20	30		CIEDRN
C[C@@H](CC#N)N(C)Cc1cc(Cl)cc(C(F)(F)F)c1	ZINC000187181039	262392232	/nfs/dbraw/zinc/39/22/32/262392232.db2.gz	IQWQBMWJPGEQKD-VIFPVBQESA-N	0	0	290.716	4.093	20	30		CIEDRN
C=C(C)CN(C)C(=O)Nc1ccc(OC(C)C)cc1Cl	ZINC000187234702	262393762	/nfs/dbraw/zinc/39/37/62/262393762.db2.gz	OZOLBZMJQYCLSW-UHFFFAOYSA-N	0	0	296.798	4.167	20	30		CIEDRN
C=CCn1cccc1C(=O)Nc1csc2ccccc12	ZINC000488812965	262396447	/nfs/dbraw/zinc/39/64/47/262396447.db2.gz	GBPHUYYITFFKIK-UHFFFAOYSA-N	0	0	282.368	4.141	20	30		CIEDRN
N#Cc1ccc(N[C@@H]2CCCc3sccc32)c([N+](=O)[O-])c1	ZINC000061364235	262396498	/nfs/dbraw/zinc/39/64/98/262396498.db2.gz	WXIDRLDFEBABFO-GFCCVEGCSA-N	0	0	299.355	4.017	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1ccc(O[C@@H](C)CC)cc1	ZINC000488871244	262402580	/nfs/dbraw/zinc/40/25/80/262402580.db2.gz	FAZSNOMDAULBTP-HOCLYGCPSA-N	0	0	287.403	4.045	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)C[C@H](C)c1ccc(CC)cc1	ZINC000488876462	262441572	/nfs/dbraw/zinc/44/15/72/262441572.db2.gz	FYWFMSBYKSCQSF-MAUKXSAKSA-N	0	0	285.431	4.310	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(SCc2cccnc2)cc1	ZINC000338618429	262550930	/nfs/dbraw/zinc/55/09/30/262550930.db2.gz	REOQCEIUESXTTD-UHFFFAOYSA-N	0	0	298.411	4.279	20	30		CIEDRN
N#Cc1ccc([N+](=O)[O-])c(N[C@@H]2CCCc3sccc32)c1	ZINC000124790446	262561681	/nfs/dbraw/zinc/56/16/81/262561681.db2.gz	JVQCSBFPKBPHGH-GFCCVEGCSA-N	0	0	299.355	4.017	20	30		CIEDRN
C=CCCS[C@@H](C)C(=O)N[C@@H](CCC)c1ccccc1	ZINC000339091024	262596872	/nfs/dbraw/zinc/59/68/72/262596872.db2.gz	LMPYAFJAICYMOC-HOCLYGCPSA-N	0	0	291.460	4.342	20	30		CIEDRN
Cc1cc(CSc2ccc(Cl)cn2)ccc1C#N	ZINC000447298040	262654521	/nfs/dbraw/zinc/65/45/21/262654521.db2.gz	CKVCIRZMTLEVEX-UHFFFAOYSA-N	0	0	274.776	4.207	20	30		CIEDRN
C[C@H]1Cc2c(C#N)c(NC(=O)C3(C)CC3)sc2[C@@H](C)C1	ZINC000410969007	262674167	/nfs/dbraw/zinc/67/41/67/262674167.db2.gz	FDSCBOVLEDVCHO-ZJUUUORDSA-N	0	0	288.416	4.044	20	30		CIEDRN
N#CCc1cc(Cl)ccc1NC(=O)CC1=CCCCC1	ZINC000410974250	262674364	/nfs/dbraw/zinc/67/43/64/262674364.db2.gz	XEEXIHWTAJPLAH-UHFFFAOYSA-N	0	0	288.778	4.235	20	30		CIEDRN
CC(C)(C)c1cc(C#N)c(NC(=O)C[C@H]2C=CCC2)s1	ZINC000411009759	262675553	/nfs/dbraw/zinc/67/55/53/262675553.db2.gz	YXWWDMILBCKSBF-NSHDSACASA-N	0	0	288.416	4.212	20	30		CIEDRN
CC(C)c1cccc2c1N(C(=O)CC(C)(C)C#N)CCC2	ZINC000411079433	262677468	/nfs/dbraw/zinc/67/74/68/262677468.db2.gz	FVGZSJYPEMZRCN-UHFFFAOYSA-N	0	0	284.403	4.029	20	30		CIEDRN
C[C@@H](CCC#N)N(C)Cc1c(Cl)cccc1Cl	ZINC000411203993	262684346	/nfs/dbraw/zinc/68/43/46/262684346.db2.gz	UBHYZRDJUUOZOF-JTQLQIEISA-N	0	0	271.191	4.117	20	30		CIEDRN
C[C@H](Sc1cccc(C#N)c1)C(=O)C1CCCCC1	ZINC000450867056	262692460	/nfs/dbraw/zinc/69/24/60/262692460.db2.gz	XSDWGQLHUUXGJY-LBPRGKRZSA-N	0	0	273.401	4.188	20	30		CIEDRN
C[C@H](CCC#N)Sc1nc2ccc(Cl)cc2o1	ZINC000412983301	262750225	/nfs/dbraw/zinc/75/02/25/262750225.db2.gz	MUQKCEPWDWFAHR-MRVPVSSYSA-N	0	0	266.753	4.266	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(C)cc1SC	ZINC000413889957	262791909	/nfs/dbraw/zinc/79/19/09/262791909.db2.gz	AAFNXKIZBDZCJY-GFCCVEGCSA-N	0	0	263.406	4.258	20	30		CIEDRN
C=C[C@@H](CC(=O)N[C@@H](C(C)C)C(F)(F)F)c1ccccc1	ZINC000413987941	262796573	/nfs/dbraw/zinc/79/65/73/262796573.db2.gz	OOYAQQPAQCWCQN-WFASDCNBSA-N	0	0	299.336	4.049	20	30		CIEDRN
C=CC[C@H](Cc1ccccc1)NC(=O)c1occc1C(C)C	ZINC000413990848	262796944	/nfs/dbraw/zinc/79/69/44/262796944.db2.gz	UKIHLAGFQSQONX-MRXNPFEDSA-N	0	0	297.398	4.320	20	30		CIEDRN
N#CCCSc1ccccc1NC(=O)CC1CCCC1	ZINC000264494886	262889508	/nfs/dbraw/zinc/88/95/08/262889508.db2.gz	FECKNWKFVOKNBP-UHFFFAOYSA-N	0	0	288.416	4.211	20	30		CIEDRN
CCCCCC(=O)Nc1ccccc1SC[C@@H](C)C#N	ZINC000264524080	262889868	/nfs/dbraw/zinc/88/98/68/262889868.db2.gz	LQOYUQAJOQSXTD-ZDUSSCGKSA-N	0	0	290.432	4.457	20	30		CIEDRN
CCCCCCCC(=O)N(C)[C@@H](CC)c1ccncc1	ZINC000265630887	262910181	/nfs/dbraw/zinc/91/01/81/262910181.db2.gz	QHJAPJRYRUSOCH-INIZCTEOSA-N	0	0	276.424	4.352	20	30		CIEDRN
COc1ccccc1-c1ccc([C@H](C)N(C)CCC#N)cc1	ZINC000266053574	262913344	/nfs/dbraw/zinc/91/33/44/262913344.db2.gz	ZKTUYVACVKNRFR-HNNXBMFYSA-N	0	0	294.398	4.269	20	30		CIEDRN
CC(C)(C)c1ccc(C(=O)N(CC#N)c2ccccc2)s1	ZINC000268669009	262955639	/nfs/dbraw/zinc/95/56/39/262955639.db2.gz	AAKCQFREOVTHJO-UHFFFAOYSA-N	0	0	298.411	4.216	20	30		CIEDRN
CC(C)(C)OC(=O)Nc1cccc(CON=C2CCC2)c1	ZINC000271702724	262998222	/nfs/dbraw/zinc/99/82/22/262998222.db2.gz	DITSGIZXMJYGPA-UHFFFAOYSA-N	0	0	290.363	4.090	20	30		CIEDRN
CC(C)(C#N)CCN1CC[C@@H]1c1ccc(Cl)cc1	ZINC000272070946	263002023	/nfs/dbraw/zinc/00/20/23/263002023.db2.gz	YVTOKQVNASAJAU-CQSZACIVSA-N	0	0	262.784	4.027	20	30		CIEDRN
CC[C@@H](CC(=O)N1CCC(C)(C#N)CC1)c1ccc(C)cc1	ZINC000272520458	263005669	/nfs/dbraw/zinc/00/56/69/263005669.db2.gz	LBCWIIXMVNBSJZ-INIZCTEOSA-N	0	0	298.430	4.031	20	30		CIEDRN
CC1(C#N)CC[NH+](CCSc2ccc(Cl)cc2)CC1	ZINC000272580684	263007118	/nfs/dbraw/zinc/00/71/18/263007118.db2.gz	ODPJZYUAMZZQHT-UHFFFAOYSA-N	0	0	294.851	4.058	20	30		CIEDRN
C[C@@H](c1ccc(F)c(Cl)c1)N1CCC(C)(C#N)CC1	ZINC000272618624	263007608	/nfs/dbraw/zinc/00/76/08/263007608.db2.gz	ULJAQCQGJZDILP-NSHDSACASA-N	0	0	280.774	4.166	20	30		CIEDRN
CC[C@H](CC1CCCC1)C(=O)Nc1sccc1C#N	ZINC000414686248	263032400	/nfs/dbraw/zinc/03/24/00/263032400.db2.gz	FVMUIWNZRUNLTC-GFCCVEGCSA-N	0	0	276.405	4.165	20	30		CIEDRN
CC(C)(C#N)CCSCc1ccn(C2CCCC2)n1	ZINC000276557729	263037210	/nfs/dbraw/zinc/03/72/10/263037210.db2.gz	BRRLEIYEJPYGKW-UHFFFAOYSA-N	0	0	277.437	4.171	20	30		CIEDRN
CC(C)(C#N)CCSCc1ccc(-n2ccnc2)cc1	ZINC000276555612	263037220	/nfs/dbraw/zinc/03/72/20/263037220.db2.gz	BJUJKEABXMJQOE-UHFFFAOYSA-N	0	0	285.416	4.045	20	30		CIEDRN
C/C=C(/CC)C(=O)N[C@H](C#N)c1c(Cl)cccc1Cl	ZINC000277163271	263039965	/nfs/dbraw/zinc/03/99/65/263039965.db2.gz	LHKZYTSGOXQWAB-KNVNGTOESA-N	0	0	297.185	4.031	20	30		CIEDRN
Cc1ccc(C)c(C[S@](=O)CCCCC(C)(C)C#N)c1	ZINC000278152096	263045650	/nfs/dbraw/zinc/04/56/50/263045650.db2.gz	CCERMCAXXJVABX-HXUWFJFHSA-N	0	0	291.460	4.272	20	30		CIEDRN
C[C@@H](NC(=O)CC(C)(C)C#N)c1cccc(Cl)c1Cl	ZINC000278302791	263046632	/nfs/dbraw/zinc/04/66/32/263046632.db2.gz	ICPRRMNZLQELFC-SECBINFHSA-N	0	0	299.201	4.110	20	30		CIEDRN
N#C[C@@H]1CC[C@@H]([N@@H+]2CCC[C@@H]2c2nc3ccccc3s2)C1	ZINC000278562451	263048823	/nfs/dbraw/zinc/04/88/23/263048823.db2.gz	IMJYMKAPOXHYAR-UMVBOHGHSA-N	0	0	297.427	4.125	20	30		CIEDRN
CC(=O)c1sccc1OCCCCC(C)(C)C#N	ZINC000278752946	263050550	/nfs/dbraw/zinc/05/05/50/263050550.db2.gz	WOMXKUMUJVXMNL-UHFFFAOYSA-N	0	0	265.378	4.050	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000279716405	263057039	/nfs/dbraw/zinc/05/70/39/263057039.db2.gz	AYTSHJMKRCXTJW-UHFFFAOYSA-N	0	0	298.430	4.306	20	30		CIEDRN
Cc1cccc(N(C)C(=O)c2ccc(C(C)(C)C#N)cc2)c1	ZINC000280284599	263060248	/nfs/dbraw/zinc/06/02/48/263060248.db2.gz	NSGYFJMBZMSZHH-UHFFFAOYSA-N	0	0	292.382	4.073	20	30		CIEDRN
CC(C)(C)[C@H]1CCCN1C(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000280500262	263062237	/nfs/dbraw/zinc/06/22/37/263062237.db2.gz	KXRIDYRKOSYVBH-MRXNPFEDSA-N	0	0	298.430	4.138	20	30		CIEDRN
C=CCOc1ccccc1CNc1ccc2c(c1)CCCN2	ZINC000414846706	263062415	/nfs/dbraw/zinc/06/24/15/263062415.db2.gz	HNQMRDABZKADNY-UHFFFAOYSA-N	0	0	294.398	4.222	20	30		CIEDRN
CC(C)[C@@H](C)N(C(=O)c1ccc(C(C)(C)C#N)cc1)C1CC1	ZINC000280631394	263063440	/nfs/dbraw/zinc/06/34/40/263063440.db2.gz	QNRYHJQKSWEGDB-CQSZACIVSA-N	0	0	298.430	4.137	20	30		CIEDRN
CC(C)c1ccccc1NCCCC1(C#N)CCOCC1	ZINC000280917629	263064972	/nfs/dbraw/zinc/06/49/72/263064972.db2.gz	CXLGGUNIBKYOFB-UHFFFAOYSA-N	0	0	286.419	4.322	20	30		CIEDRN
C[C@@H]1CCCC[C@H]1N(C)C(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000281031609	263065918	/nfs/dbraw/zinc/06/59/18/263065918.db2.gz	YPYNZWOLBDLMKZ-RHSMWYFYSA-N	0	0	298.430	4.138	20	30		CIEDRN
Cc1cc(Cl)ccc1OCCCC1(C#N)CCOCC1	ZINC000281213166	263067216	/nfs/dbraw/zinc/06/72/16/263067216.db2.gz	DJJLITOLZMJWBC-UHFFFAOYSA-N	0	0	293.794	4.128	20	30		CIEDRN
Cc1ccc(Cl)cc1OCCCC1(C#N)CCOCC1	ZINC000281249946	263067605	/nfs/dbraw/zinc/06/76/05/263067605.db2.gz	GUWWZDSEBQROQQ-UHFFFAOYSA-N	0	0	293.794	4.128	20	30		CIEDRN
CCCc1occc1C(=O)N(CCC#N)c1ccc(C)cc1	ZINC000281825594	263072033	/nfs/dbraw/zinc/07/20/33/263072033.db2.gz	ZWFGPUBXYYCENJ-UHFFFAOYSA-N	0	0	296.370	4.101	20	30		CIEDRN
CCCn1nc(C)c(/C=C/C(=O)c2cc(C)c(C)o2)c1C	ZINC000282095202	263074262	/nfs/dbraw/zinc/07/42/62/263074262.db2.gz	ITNOPIYMGNDRLB-BQYQJAHWSA-N	0	0	286.375	4.016	20	30		CIEDRN
CCCC[C@H](C)C(=O)Nc1cccc(OCCCC#N)c1	ZINC000282188374	263074910	/nfs/dbraw/zinc/07/49/10/263074910.db2.gz	PBHCUCWMDIBGHT-AWEZNQCLSA-N	0	0	288.391	4.134	20	30		CIEDRN
CCCc1ccccc1NC(=O)NCC1CCC(C#N)CC1	ZINC000282702756	263078081	/nfs/dbraw/zinc/07/80/81/263078081.db2.gz	MPSZUQOWXQILTG-UHFFFAOYSA-N	0	0	299.418	4.091	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)N[C@@H](C)c1cc2ccccc2s1	ZINC000285250513	263091650	/nfs/dbraw/zinc/09/16/50/263091650.db2.gz	AMKQQMULJBOCCC-MEDUHNTESA-N	0	0	286.400	4.018	20	30		CIEDRN
CC[C@@](C)(C#N)c1nc(-c2c(Cl)cccc2Cl)no1	ZINC000285630076	263094707	/nfs/dbraw/zinc/09/47/07/263094707.db2.gz	WDHYWULXQSHEQJ-ZDUSSCGKSA-N	0	0	296.157	4.235	20	30		CIEDRN
CN(CCCC(C)(C)C#N)c1cccc2cccnc21	ZINC000340221367	263097056	/nfs/dbraw/zinc/09/70/56/263097056.db2.gz	UUEYUEVHPQJZTO-UHFFFAOYSA-N	0	0	267.376	4.001	20	30		CIEDRN
C[C@H](c1ccc(C(C)(C)C)cc1)[S@](=O)CCCC#N	ZINC000287108154	263101014	/nfs/dbraw/zinc/10/10/14/263101014.db2.gz	APHDPKSFOODACE-BFUOFWGJSA-N	0	0	277.433	4.098	20	30		CIEDRN
CC[C@H]([NH2+]CCCC#N)c1cc(Cl)cc(Cl)c1[O-]	ZINC000287812995	263102687	/nfs/dbraw/zinc/10/26/87/263102687.db2.gz	UUPHOEWSUQQDCS-LBPRGKRZSA-N	0	0	287.190	4.043	20	30		CIEDRN
C=CCCOCCCCC(=O)N1CCC[C@@]1(C)CC(C)C	ZINC000452510520	263104435	/nfs/dbraw/zinc/10/44/35/263104435.db2.gz	NDPRHDMJBAMSSI-SFHVURJKSA-N	0	0	295.467	4.177	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)Nc1ccccc1CCC(F)(F)F	ZINC000288563659	263104774	/nfs/dbraw/zinc/10/47/74/263104774.db2.gz	JZQJNLULTLECRB-CQSZACIVSA-N	0	0	298.308	4.060	20	30		CIEDRN
C[C@@H](CC#N)Sc1ccccc1NCCC(C)(C)C#N	ZINC000288631091	263105280	/nfs/dbraw/zinc/10/52/80/263105280.db2.gz	BAFYFBZOODWEBK-ZDUSSCGKSA-N	0	0	287.432	4.433	20	30		CIEDRN
C[C@H](C#N)CSc1ccccc1NCCC(C)(C)C#N	ZINC000288685186	263105473	/nfs/dbraw/zinc/10/54/73/263105473.db2.gz	JHJVNOJJUCGDTG-CYBMUJFWSA-N	0	0	287.432	4.290	20	30		CIEDRN
CCCOc1ccc(Cl)cc1NC(=O)[C@](C)(C#N)CC	ZINC000288999610	263106873	/nfs/dbraw/zinc/10/68/73/263106873.db2.gz	ZDQLBBQFUJFVON-HNNXBMFYSA-N	0	0	294.782	4.007	20	30		CIEDRN
C[C@@H](SCCC(C)(C)C#N)c1ccccc1[N+](=O)[O-]	ZINC000289414519	263110110	/nfs/dbraw/zinc/11/01/10/263110110.db2.gz	OZUQBKNMQLRBDW-LLVKDONJSA-N	0	0	278.377	4.329	20	30		CIEDRN
CC[C@@](C)(C#N)c1nc(-c2ccc(C(C)(F)F)cc2)no1	ZINC000289605551	263111079	/nfs/dbraw/zinc/11/10/79/263111079.db2.gz	AGJPEOROBQOCCC-AWEZNQCLSA-N	0	0	291.301	4.040	20	30		CIEDRN
C[C@H](c1noc(-c2ccc(C(C)(C)C#N)cc2)n1)C1CC1	ZINC000290028863	263114042	/nfs/dbraw/zinc/11/40/42/263114042.db2.gz	HZMZJHQCNIISHC-NSHDSACASA-N	0	0	281.359	4.051	20	30		CIEDRN
CC(C)N(C(=O)CCCC#N)c1ccc(Cl)c(Cl)c1	ZINC000291417918	263122535	/nfs/dbraw/zinc/12/25/35/263122535.db2.gz	WRIUBBGPKJTRKI-UHFFFAOYSA-N	0	0	299.201	4.429	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)CCCC#N	ZINC000291460030	263122899	/nfs/dbraw/zinc/12/28/99/263122899.db2.gz	AISTUYHTRAAGKF-UHFFFAOYSA-N	0	0	270.376	4.171	20	30		CIEDRN
Cc1ccc2ncc(C#N)c(OCCCC(C)(C)C#N)c2c1	ZINC000291715276	263124982	/nfs/dbraw/zinc/12/49/82/263124982.db2.gz	WASUPFJKOCVBAM-UHFFFAOYSA-N	0	0	293.370	4.124	20	30		CIEDRN
C[C@H](c1ccccc1Cl)N(C(=O)CCCC#N)C1CC1	ZINC000291800600	263125731	/nfs/dbraw/zinc/12/57/31/263125731.db2.gz	NCJYMOSQFVGHQF-GFCCVEGCSA-N	0	0	290.794	4.086	20	30		CIEDRN
C=CCN(CCC#N)Cc1nc(C2CCCCC2)cs1	ZINC000292328663	263131095	/nfs/dbraw/zinc/13/10/95/263131095.db2.gz	WGKUXLDAAJLRBX-UHFFFAOYSA-N	0	0	289.448	4.092	20	30		CIEDRN
CC(C)COc1ccc(NC(=O)CCCC#N)cc1Cl	ZINC000292715619	263134227	/nfs/dbraw/zinc/13/42/27/263134227.db2.gz	SZKGOVJUTUPIGO-UHFFFAOYSA-N	0	0	294.782	4.007	20	30		CIEDRN
C=C(C)CCNC(=O)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1	ZINC000452715051	263134687	/nfs/dbraw/zinc/13/46/87/263134687.db2.gz	BNULOBLZAUXZEQ-UONOGXRCSA-N	0	0	298.213	4.179	20	30		CIEDRN
C=C(C)CCNC(=O)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1	ZINC000452715052	263134699	/nfs/dbraw/zinc/13/46/99/263134699.db2.gz	BNULOBLZAUXZEQ-ZIAGYGMSSA-N	0	0	298.213	4.179	20	30		CIEDRN
C=C(C)CCNC(=O)c1ccc(C(F)(F)F)cc1Cl	ZINC000452717420	263136194	/nfs/dbraw/zinc/13/61/94/263136194.db2.gz	KZQJVKKGVPUPFS-UHFFFAOYSA-N	0	0	291.700	4.055	20	30		CIEDRN
C=CCN(CCC#N)C(=O)Nc1c(C)cccc1C(C)C	ZINC000292901401	263136317	/nfs/dbraw/zinc/13/63/17/263136317.db2.gz	WDLXEXAKDVSVSF-UHFFFAOYSA-N	0	0	285.391	4.052	20	30		CIEDRN
CC(C)(C)c1ccnc(N[C@@H](CCC#N)c2ccccc2)n1	ZINC000293181223	263138545	/nfs/dbraw/zinc/13/85/45/263138545.db2.gz	VVYWPGGTFBJUDW-HNNXBMFYSA-N	0	0	294.402	4.231	20	30		CIEDRN
C=CC(C)(C)CNC(=O)c1ccccc1SC(C)C	ZINC000452774126	263145742	/nfs/dbraw/zinc/14/57/42/263145742.db2.gz	KJOKSSVDKCILHU-UHFFFAOYSA-N	0	0	277.433	4.129	20	30		CIEDRN
CCCCCCCC(=O)N1CC(C)(C)[C@@H]1c1ccncc1	ZINC000294120480	263156327	/nfs/dbraw/zinc/15/63/27/263156327.db2.gz	ZEEOIZZWLJKHME-KRWDZBQOSA-N	0	0	288.435	4.352	20	30		CIEDRN
N#C[C@@]1(C(=O)Nc2ccc3ccccc3c2)CC12CCCC2	ZINC000294268201	263159029	/nfs/dbraw/zinc/15/90/29/263159029.db2.gz	RJPWXTCJIRZOOL-LJQANCHMSA-N	0	0	290.366	4.252	20	30		CIEDRN
N#C[C@]1(C(=O)Nc2csc3ccccc23)CC12CCCC2	ZINC000294949946	263169714	/nfs/dbraw/zinc/16/97/14/263169714.db2.gz	KHSVXQIGFHYDMH-KRWDZBQOSA-N	0	0	296.395	4.314	20	30		CIEDRN
CCc1cccc(CC)c1NC(=O)N[C@H]1CC[C@@H](CC#N)C1	ZINC000296354783	263190461	/nfs/dbraw/zinc/19/04/61/263190461.db2.gz	BBZPJKSVIDWKRP-BBRMVZONSA-N	0	0	299.418	4.015	20	30		CIEDRN
N#CC[C@@H]1CC[C@H](NC(=O)Nc2cccc3ccccc32)C1	ZINC000296371232	263190733	/nfs/dbraw/zinc/19/07/33/263190733.db2.gz	RKHNMQRXFITZMG-ZFWWWQNUSA-N	0	0	293.370	4.044	20	30		CIEDRN
N#C[C@@]1(C(=O)Nc2cccc3ccccc32)CC12CCCC2	ZINC000297494012	263205570	/nfs/dbraw/zinc/20/55/70/263205570.db2.gz	KUHJBGAFZTYPSY-LJQANCHMSA-N	0	0	290.366	4.252	20	30		CIEDRN
N#C[C@]1(C(=O)Nc2cccc3ccccc32)CC12CCCC2	ZINC000297494006	263205571	/nfs/dbraw/zinc/20/55/71/263205571.db2.gz	KUHJBGAFZTYPSY-IBGZPJMESA-N	0	0	290.366	4.252	20	30		CIEDRN
N#CC[C@@H]1CC[C@H](NC(=O)Nc2ccc(C3CCC3)cc2)C1	ZINC000298327749	263217674	/nfs/dbraw/zinc/21/76/74/263217674.db2.gz	FGEYVJBWTSXBMK-GUYCJALGSA-N	0	0	297.402	4.158	20	30		CIEDRN
C[C@H](CCC#N)Sc1nc2cc(Cl)ccc2o1	ZINC000298417954	263219577	/nfs/dbraw/zinc/21/95/77/263219577.db2.gz	RAXGNUOJVNOTDF-MRVPVSSYSA-N	0	0	266.753	4.266	20	30		CIEDRN
CCCCCCCC(=O)N1CCC[C@H]1c1ccc[nH]1	ZINC000298888206	263227421	/nfs/dbraw/zinc/22/74/21/263227421.db2.gz	YNWPNXODASNKAQ-HNNXBMFYSA-N	0	0	262.397	4.039	20	30		CIEDRN
CCCCc1nc(CO/N=C/c2cccs2)cs1	ZINC000299204526	263235145	/nfs/dbraw/zinc/23/51/45/263235145.db2.gz	CFMKRQGXQSRBPO-RIYZIHGNSA-N	0	0	280.418	4.098	20	30		CIEDRN
CCCCCCCCCC(=O)Nc1c(C)noc1C	ZINC000299478999	263242993	/nfs/dbraw/zinc/24/29/93/263242993.db2.gz	FFPLPNCSFRMJLC-UHFFFAOYSA-N	0	0	266.385	4.371	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)[C@H](C)c1ccc(F)cc1	ZINC000121619156	263297093	/nfs/dbraw/zinc/29/70/93/263297093.db2.gz	NHHKXSCDGUHHGZ-CYBMUJFWSA-N	0	0	275.367	4.114	20	30		CIEDRN
CC(C)c1cnc(NCC(C)(C)CCC#N)s1	ZINC000340904889	263308797	/nfs/dbraw/zinc/30/87/97/263308797.db2.gz	VCBFVTCOKGEEIC-UHFFFAOYSA-N	0	0	251.399	4.008	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H](CC1CCC1)c1ccccc1	ZINC000341328462	263331312	/nfs/dbraw/zinc/33/13/12/263331312.db2.gz	FLYRMPFYFNQYNZ-SFHVURJKSA-N	0	0	283.415	4.228	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N[C@H](CC)c1ccc(F)cc1F	ZINC000341505821	263340197	/nfs/dbraw/zinc/34/01/97/263340197.db2.gz	ZYPQIXNFERPCQY-SWLSCSKDSA-N	0	0	296.361	4.070	20	30		CIEDRN
C=C(C)CS[C@@H](C)c1nccn1-c1ccccc1	ZINC000341953212	263371163	/nfs/dbraw/zinc/37/11/63/263371163.db2.gz	LXGJNGVACKQANL-ZDUSSCGKSA-N	0	0	258.390	4.243	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N1CCCC(C)(C)C1	ZINC000342010007	263377369	/nfs/dbraw/zinc/37/73/69/263377369.db2.gz	XEHBHHLPSSJCIG-UHFFFAOYSA-N	0	0	289.444	4.227	20	30		CIEDRN
N#CCCCCSCc1cc2c(cc1Cl)OCCO2	ZINC000342078953	263385175	/nfs/dbraw/zinc/38/51/75/263385175.db2.gz	FUULXRJNKGDMBM-UHFFFAOYSA-N	0	0	297.807	4.038	20	30		CIEDRN
CSc1ccc([C@H](C)Nc2cc(C#N)cc(C)n2)cc1	ZINC000343045527	263577454	/nfs/dbraw/zinc/57/74/54/263577454.db2.gz	MUJUDHFSEDPLKJ-LBPRGKRZSA-N	0	0	283.400	4.157	20	30		CIEDRN
C=CCCCC(=O)N(C)c1ccc(-c2nccs2)cc1	ZINC000415844030	263649639	/nfs/dbraw/zinc/64/96/39/263649639.db2.gz	YMFQXOSJIBYNOO-UHFFFAOYSA-N	0	0	286.400	4.129	20	30		CIEDRN
CCCC1(C(=O)N[C@H]2CCCc3cc(C#N)ccc32)CCC1	ZINC000416112743	263675032	/nfs/dbraw/zinc/67/50/32/263675032.db2.gz	WHQFXUBKYMFWGF-KRWDZBQOSA-N	0	0	296.414	4.022	20	30		CIEDRN
CC(C)[C@H]1CC[C@@H](C)C[C@@H]1NC(=O)[C@@H]1C[C@H](C)CC(=O)N1	ZINC000328707783	263847498	/nfs/dbraw/zinc/84/74/98/263847498.db2.gz	AWNBAVHWBAEUNJ-SEBNEYGDSA-N	0	0	294.439	4.159	20	30		CIEDRN
C[C@H](CCC1CCCCC1)NC(=O)[C@]1(C)CCC(=O)NC1	ZINC000328767609	263858383	/nfs/dbraw/zinc/85/83/83/263858383.db2.gz	FTCWPRRTCJLKTA-CXAGYDPISA-N	0	0	294.439	4.449	20	30		CIEDRN
Cc1nc(CCNC(=O)CC2(C)CCCCC2)c(C)o1	ZINC000328919321	263902103	/nfs/dbraw/zinc/90/21/03/263902103.db2.gz	ARCOQQMPDRCFGA-UHFFFAOYSA-N	0	0	278.396	4.151	20	30		CIEDRN
CCc1nc(NC(=O)c2cc[nH]c2C(C)C)sc1C	ZINC000330562694	263966074	/nfs/dbraw/zinc/96/60/74/263966074.db2.gz	CXSSUSHXTDQKCW-UHFFFAOYSA-N	0	0	277.393	4.102	20	30		CIEDRN
Cc1ccoc1C(=O)N[C@@H](C)c1nc(C(C)(C)C)cs1	ZINC000330661321	263991498	/nfs/dbraw/zinc/99/14/98/263991498.db2.gz	VFBNTLLTJMBPBA-JTQLQIEISA-N	0	0	292.404	4.408	20	30		CIEDRN
CC[C@H](C)NC(=O)Nc1cc(C(C)(C)C)nn1C(C)(C)C	ZINC000330632640	264001114	/nfs/dbraw/zinc/00/11/14/264001114.db2.gz	IQBNYCQCTTZSGK-NSHDSACASA-N	0	0	294.443	4.060	20	30		CIEDRN
Cc1ccc(C(=O)Nc2nc(CC(C)(C)C)cs2)cn1	ZINC000330689372	264004193	/nfs/dbraw/zinc/00/41/93/264004193.db2.gz	VSHXGMYXUQBOIP-UHFFFAOYSA-N	0	0	289.404	4.071	20	30		CIEDRN
CC(C)(C)c1ccc(NC(=O)N[C@@H]2CCC[C@H]2C#N)cc1	ZINC000330777389	264035048	/nfs/dbraw/zinc/03/50/48/264035048.db2.gz	UMXGNBOHFWTYMT-SWLSCSKDSA-N	0	0	285.391	4.002	20	30		CIEDRN
CC(C)Sc1ccccc1C(=O)N[C@@H]1CCC[C@H]1C#N	ZINC000330841340	264065083	/nfs/dbraw/zinc/06/50/83/264065083.db2.gz	JSSILFZTWJKFSR-GXTWGEPZSA-N	0	0	288.416	4.184	20	30		CIEDRN
CCc1cnc(NC(=O)c2cnc(C(C)(C)C)s2)s1	ZINC000330908515	264074531	/nfs/dbraw/zinc/07/45/31/264074531.db2.gz	CXCVPDQVWPUFPH-UHFFFAOYSA-N	0	0	295.433	4.096	20	30		CIEDRN
CCC(CC)NC(=O)c1ccc(Cl)c(N)c1Cl	ZINC000330972880	264101019	/nfs/dbraw/zinc/10/10/19/264101019.db2.gz	UKOIRUDGJDRMOC-UHFFFAOYSA-N	0	0	275.179	4.069	20	30		CIEDRN
CCc1noc(C)c1C(=O)N[C@H](C)CC1CCCCC1	ZINC000330982270	264102279	/nfs/dbraw/zinc/10/22/79/264102279.db2.gz	JYZFJDCHWRYSHZ-LLVKDONJSA-N	0	0	278.396	4.209	20	30		CIEDRN
CC(C)c1ncncc1C(=O)NC1CCC(C(C)C)CC1	ZINC000331064572	264111356	/nfs/dbraw/zinc/11/13/56/264111356.db2.gz	FDEFKTUGZMRPJU-UHFFFAOYSA-N	0	0	289.423	4.119	20	30		CIEDRN
CCc1nc(C(=O)NCC(C)(C)C2=CCCCC2)co1	ZINC000331092521	264120068	/nfs/dbraw/zinc/12/00/68/264120068.db2.gz	YBOYMUNBSRJHIQ-UHFFFAOYSA-N	0	0	276.380	4.068	20	30		CIEDRN
COC1(CNC(=O)c2ccoc2C(C)C)CCC(C)CC1	ZINC000331133069	264148705	/nfs/dbraw/zinc/14/87/05/264148705.db2.gz	QZEVCJJACGEKFE-UHFFFAOYSA-N	0	0	293.407	4.303	20	30		CIEDRN
CCc1cccc(NC(=O)C2(C#N)CCCCC2)c1CC	ZINC000331183043	264155961	/nfs/dbraw/zinc/15/59/61/264155961.db2.gz	XXACMPAZXNKOAQ-UHFFFAOYSA-N	0	0	284.403	4.224	20	30		CIEDRN
CC(C)C(C)(C)CNC(=O)Nc1ccc2cc[nH]c2c1	ZINC000331210818	264162623	/nfs/dbraw/zinc/16/26/23/264162623.db2.gz	IHHSUBRBGLUOPX-UHFFFAOYSA-N	0	0	273.380	4.176	20	30		CIEDRN
Cc1oc(C#N)cc1C(=O)NC(CC(C)C)CC(C)C	ZINC000331220376	264165797	/nfs/dbraw/zinc/16/57/97/264165797.db2.gz	JIYGQFBBDSFBNP-UHFFFAOYSA-N	0	0	276.380	4.225	20	30		CIEDRN
CC(C)C[C@H](C)n1nccc1NC(=O)N[C@@H]1CC[C@@H](C)C1	ZINC000331284594	264173012	/nfs/dbraw/zinc/17/30/12/264173012.db2.gz	FXCCYYOMMQJMOS-HZSPNIEDSA-N	0	0	292.427	4.005	20	30		CIEDRN
CCOCc1ccc(NC(=O)NC2(C)CCCCC2)cc1	ZINC000331254282	264182617	/nfs/dbraw/zinc/18/26/17/264182617.db2.gz	STAUAKCKQVZXQU-UHFFFAOYSA-N	0	0	290.407	4.272	20	30		CIEDRN
Cc1ccc([C@@H](C)NC(=O)Nc2c(C)cc(C)nc2C)cc1	ZINC000331289224	264197141	/nfs/dbraw/zinc/19/71/41/264197141.db2.gz	ATCMZIXBCUWBPQ-CQSZACIVSA-N	0	0	297.402	4.402	20	30		CIEDRN
CC(C)Oc1ccc(NC(=O)N[C@@H]2CC[C@@H](C)C2)c(F)c1	ZINC000331295405	264197802	/nfs/dbraw/zinc/19/78/02/264197802.db2.gz	NGCIZVUGNKBUGR-VXGBXAGGSA-N	0	0	294.370	4.127	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cccc(Cl)c1OC	ZINC000126263143	264210557	/nfs/dbraw/zinc/21/05/57/264210557.db2.gz	HUWURPBUIYMLIS-UHFFFAOYSA-N	0	0	279.767	4.056	20	30		CIEDRN
C[C@@H](c1cccc(C#N)c1)N(C)Cc1csc(C2CC2)n1	ZINC000425367491	264212291	/nfs/dbraw/zinc/21/22/91/264212291.db2.gz	SXFRYVOVCGGGIM-LBPRGKRZSA-N	0	0	297.427	4.085	20	30		CIEDRN
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000424857300	264234152	/nfs/dbraw/zinc/23/41/52/264234152.db2.gz	WSNRWBPAQHCJAP-DGCLKSJQSA-N	0	0	290.794	4.171	20	30		CIEDRN
Cc1csc2nc(C)nc(Oc3ccc(C#N)cc3F)c12	ZINC000127595112	264263195	/nfs/dbraw/zinc/26/31/95/264263195.db2.gz	INBNCMHQIRCEER-UHFFFAOYSA-N	0	0	299.330	4.111	20	30		CIEDRN
N#Cc1nc(N[C@@H]2CCCc3sccc32)ccc1Cl	ZINC000161063970	264265480	/nfs/dbraw/zinc/26/54/80/264265480.db2.gz	VLPJKAOVNRUYCK-LLVKDONJSA-N	0	0	289.791	4.158	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1ccc(C)cc1Br	ZINC000425408926	264285314	/nfs/dbraw/zinc/28/53/14/264285314.db2.gz	TTZNVOHYJVYFCI-UHFFFAOYSA-N	0	0	296.208	4.298	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(F)cn1	ZINC000189907983	264336409	/nfs/dbraw/zinc/33/64/09/264336409.db2.gz	RFZATTCJFXSRPB-UHFFFAOYSA-N	0	0	298.361	4.325	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N(C)[C@@H](C)c1cccc(C#N)c1	ZINC000425488654	264354494	/nfs/dbraw/zinc/35/44/94/264354494.db2.gz	NDUXTOGHCIYVNW-GJZGRUSLSA-N	0	0	299.418	4.005	20	30		CIEDRN
C#CCCCCC(=O)N1CCC[C@@H]1c1cccc(C)c1C	ZINC000180250601	264394484	/nfs/dbraw/zinc/39/44/84/264394484.db2.gz	PBYRUVPRDCQXEN-GOSISDBHSA-N	0	0	283.415	4.161	20	30		CIEDRN
N#Cc1ccc(Nc2cccc(CCC(F)(F)F)c2)nc1	ZINC000133482332	264434445	/nfs/dbraw/zinc/43/44/45/264434445.db2.gz	KFCMMZJSNLIJPD-UHFFFAOYSA-N	0	0	291.276	4.192	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1cc(C(C)=O)ccc1Cl	ZINC000425532506	264443857	/nfs/dbraw/zinc/44/38/57/264443857.db2.gz	BWEUEDQNFSFULE-UHFFFAOYSA-N	0	0	279.767	4.083	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccccc2OCC(F)F)CCC1	ZINC000191925438	264541451	/nfs/dbraw/zinc/54/14/51/264541451.db2.gz	LFUGFFZALJAWSI-UHFFFAOYSA-N	0	0	295.329	4.015	20	30		CIEDRN
C=CCC[C@@H](NC(=O)c1cc[nH]c1C1CC1)c1ccccc1	ZINC000285334708	264553545	/nfs/dbraw/zinc/55/35/45/264553545.db2.gz	QYPMFRKPPIMWRA-QGZVFWFLSA-N	0	0	294.398	4.329	20	30		CIEDRN
C#CCCCC(=O)Nc1ccc(N2CCCC[C@H]2C)cc1C	ZINC000192152296	264561157	/nfs/dbraw/zinc/56/11/57/264561157.db2.gz	PFVPDZZVHVFYIE-MRXNPFEDSA-N	0	0	298.430	4.116	20	30		CIEDRN
CC#CCCCC(=O)N1C[C@@H](C)CC[C@@H]1c1ccccc1	ZINC000288466701	264682291	/nfs/dbraw/zinc/68/22/91/264682291.db2.gz	QFGUQPUDGTZOSQ-FUHWJXTLSA-N	0	0	283.415	4.180	20	30		CIEDRN
C[C@H](Oc1cc(Cl)ccc1F)c1cccc(C#N)c1	ZINC000478779155	264723952	/nfs/dbraw/zinc/72/39/52/264723952.db2.gz	AACCUYKLWWYJCY-JTQLQIEISA-N	0	0	275.710	4.491	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(Cc1ccco1)Cc1ccco1	ZINC000184342156	264751636	/nfs/dbraw/zinc/75/16/36/264751636.db2.gz	VKLZBVVRFNTRLH-CQSZACIVSA-N	0	0	287.359	4.004	20	30		CIEDRN
C=CCC(F)(F)C(=O)N1CCCC[C@@H]1c1ccc(F)cc1	ZINC000293305786	264928341	/nfs/dbraw/zinc/92/83/41/264928341.db2.gz	IITJCGNNTHUENX-CQSZACIVSA-N	0	0	297.320	4.091	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc(Oc2cc(C)[nH]n2)cc1	ZINC000293506360	264965298	/nfs/dbraw/zinc/96/52/98/264965298.db2.gz	WYDYYNIGTKPGOG-UHFFFAOYSA-N	0	0	299.374	4.051	20	30		CIEDRN
CC#CCCCC(=O)N(C)[C@H](C)c1cccc(Cl)c1	ZINC000185223577	265011175	/nfs/dbraw/zinc/01/11/75/265011175.db2.gz	OCJYSPBZGKRAKD-CYBMUJFWSA-N	0	0	277.795	4.053	20	30		CIEDRN
CC#CCCCC(=O)N1CCC[C@@H]1c1ccccc1Cl	ZINC000185231066	265011412	/nfs/dbraw/zinc/01/14/12/265011412.db2.gz	XWDUWGGQHIKLDI-MRXNPFEDSA-N	0	0	289.806	4.197	20	30		CIEDRN
CC#CCCCC(=O)Nc1cc(Cl)ccc1SC	ZINC000185274392	265018091	/nfs/dbraw/zinc/01/80/91/265018091.db2.gz	YUVCBYDGGJIBKA-UHFFFAOYSA-N	0	0	281.808	4.194	20	30		CIEDRN
N#Cc1ccc(NCC2(Sc3ccccc3)CC2)c(F)c1	ZINC000518845618	265179643	/nfs/dbraw/zinc/17/96/43/265179643.db2.gz	DILFIULLOHZUHA-UHFFFAOYSA-N	0	0	298.386	4.434	20	30		CIEDRN
CC(C)c1cccc(NCc2cc(C#N)cs2)c1	ZINC000093492465	265184152	/nfs/dbraw/zinc/18/41/52/265184152.db2.gz	PWTFXCNXWVAMSL-UHFFFAOYSA-N	0	0	256.374	4.355	20	30		CIEDRN
C=CCC1(C(=O)Nc2cc(C)c(OC)cc2Cl)CCC1	ZINC000519666868	265529599	/nfs/dbraw/zinc/52/95/99/265529599.db2.gz	GZNYCTILVQKJIP-UHFFFAOYSA-N	0	0	293.794	4.342	20	30		CIEDRN
CCc1c(C)sc(NC(=O)[C@H]2CCC[C@@H](C)C2)c1C#N	ZINC000519733554	265570475	/nfs/dbraw/zinc/57/04/75/265570475.db2.gz	ONUMCZIJZLECML-PWSUYJOCSA-N	0	0	290.432	4.255	20	30		CIEDRN
Cc1cccc2cc(C(=O)Nc3cccc(C#N)c3)sc21	ZINC000520276054	265761481	/nfs/dbraw/zinc/76/14/81/265761481.db2.gz	BXHADRMUZACORZ-UHFFFAOYSA-N	0	0	292.363	4.334	20	30		CIEDRN
C=CCC[C@@H](Nc1cccc(OC)c1)c1ccco1	ZINC000520439282	265822104	/nfs/dbraw/zinc/82/21/04/265822104.db2.gz	FEVXPRUEGXYPRP-OAHLLOKOSA-N	0	0	257.333	4.408	20	30		CIEDRN
CCC[C@@H](C)C(=O)Nc1sc2c(c1C#N)CC[C@H](C)C2	ZINC000514607850	266019643	/nfs/dbraw/zinc/01/96/43/266019643.db2.gz	XDIXFFYYGJIHLY-WDEREUQCSA-N	0	0	290.432	4.119	20	30		CIEDRN
CC1CCC(c2noc(-c3ccc(CC#N)cc3)n2)CC1	ZINC000356190306	266067091	/nfs/dbraw/zinc/06/70/91/266067091.db2.gz	HQRTZCBSIOAZTI-UHFFFAOYSA-N	0	0	281.359	4.096	20	30		CIEDRN
CC[C@@]1(C)CCCN(C(=O)C[C@H](CC#N)c2ccccc2)C1	ZINC000356248054	266081202	/nfs/dbraw/zinc/08/12/02/266081202.db2.gz	NUSOAZUJYXMUQE-HKUYNNGSSA-N	0	0	298.430	4.113	20	30		CIEDRN
C=CCCC1(C(=O)N(C)Cc2cc3ccccc3o2)CC1	ZINC000356294247	266089805	/nfs/dbraw/zinc/08/98/05/266089805.db2.gz	BIRGGGPBCVJDRS-UHFFFAOYSA-N	0	0	283.371	4.138	20	30		CIEDRN
CCC1(CC)CCN(C(=O)C[C@@H](CC#N)c2ccccc2)C1	ZINC000356363396	266102782	/nfs/dbraw/zinc/10/27/82/266102782.db2.gz	JAQCJMPQQNNTIA-QGZVFWFLSA-N	0	0	298.430	4.113	20	30		CIEDRN
C=CCCC1(C(=O)N[C@H]2CC(C)(C)Oc3ccccc32)CC1	ZINC000356425114	266111012	/nfs/dbraw/zinc/11/10/12/266111012.db2.gz	PRSOQKCYYSPCLG-HNNXBMFYSA-N	0	0	299.414	4.151	20	30		CIEDRN
CCCC1(CNC(=O)C[C@@H](CC#N)c2ccccc2)CCC1	ZINC000356428083	266112350	/nfs/dbraw/zinc/11/23/50/266112350.db2.gz	KRJHWPCAGRVTAV-QGZVFWFLSA-N	0	0	298.430	4.161	20	30		CIEDRN
C=CCCC1(C(=O)N[C@@H]2CC[C@H](C)c3ccccc32)CC1	ZINC000356569260	266139058	/nfs/dbraw/zinc/13/90/58/266139058.db2.gz	SXFYAVYIHOHDGU-WMLDXEAASA-N	0	0	283.415	4.488	20	30		CIEDRN
C=CCCC1(C(=O)N[C@H]2CCCc3cc(F)ccc32)CC1	ZINC000356641567	266153359	/nfs/dbraw/zinc/15/33/59/266153359.db2.gz	YZJXVWSDSCAILA-INIZCTEOSA-N	0	0	287.378	4.066	20	30		CIEDRN
Cc1ccc([C@H]2CCCN2c2snc(C)c2C#N)s1	ZINC000367264180	266307070	/nfs/dbraw/zinc/30/70/70/266307070.db2.gz	KTSHTZPONOXXOV-GFCCVEGCSA-N	0	0	289.429	4.035	20	30		CIEDRN
N#Cc1cccc(C#N)c1NCc1ccc2sccc2c1	ZINC000357588523	266331550	/nfs/dbraw/zinc/33/15/50/266331550.db2.gz	AFJZOHUOAYEIDD-UHFFFAOYSA-N	0	0	289.363	4.257	20	30		CIEDRN
N#Cc1cccc(SCc2ccccc2C2CC2)n1	ZINC000357614592	266336804	/nfs/dbraw/zinc/33/68/04/266336804.db2.gz	HTZZGVNWDAGODT-UHFFFAOYSA-N	0	0	266.369	4.123	20	30		CIEDRN
C=CCOCCCSCc1nc2ccccc2s1	ZINC000359149302	266542525	/nfs/dbraw/zinc/54/25/25/266542525.db2.gz	WKYDUQDFCJWCQH-UHFFFAOYSA-N	0	0	279.430	4.122	20	30		CIEDRN
C=CCCCNc1ccccc1-c1csc(C)n1	ZINC000359622725	266607739	/nfs/dbraw/zinc/60/77/39/266607739.db2.gz	SXDJOCNIMGGTLF-UHFFFAOYSA-N	0	0	258.390	4.497	20	30		CIEDRN
Cc1cc(N[C@@H]2CCC[C@H](C#N)C2)c2cccnc2c1C	ZINC000193267402	266664938	/nfs/dbraw/zinc/66/49/38/266664938.db2.gz	WQYUQINLNFKIBX-LSDHHAIUSA-N	0	0	279.387	4.346	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(C(C)=O)c(Cl)c2)CC1	ZINC000360021198	266669961	/nfs/dbraw/zinc/66/99/61/266669961.db2.gz	DUHOXSDDXPNDFU-UHFFFAOYSA-N	0	0	291.778	4.228	20	30		CIEDRN
CCCC[C@H](CC)C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000361961936	266912168	/nfs/dbraw/zinc/91/21/68/266912168.db2.gz	MTQVXISLZXTCKC-DOTOQJQBSA-N	0	0	286.419	4.364	20	30		CIEDRN
C[C@@H](N(Cc1ccccc1)C(=O)CCCC#N)C(C)(C)C	ZINC000362169125	266937602	/nfs/dbraw/zinc/93/76/02/266937602.db2.gz	YJXMEUFCNRGVHP-OAHLLOKOSA-N	0	0	286.419	4.144	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N(CCC)CC(F)F	ZINC000362770113	267043415	/nfs/dbraw/zinc/04/34/15/267043415.db2.gz	PXJUTQFYRPANKV-UHFFFAOYSA-N	0	0	299.386	4.082	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N(C)[C@@H](C)C1CCC1	ZINC000362818179	267050452	/nfs/dbraw/zinc/05/04/52/267050452.db2.gz	SCVVFJLSEGLBRH-ZDUSSCGKSA-N	0	0	289.444	4.225	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N1C[C@H](C)CC[C@H]1C	ZINC000362819932	267051588	/nfs/dbraw/zinc/05/15/88/267051588.db2.gz	ISGQCSUMQUDUAR-ZIAGYGMSSA-N	0	0	289.444	4.225	20	30		CIEDRN
CC(C)C[C@H](NC(=O)c1ccc(C#N)s1)c1ccccc1	ZINC000362881826	267056741	/nfs/dbraw/zinc/05/67/41/267056741.db2.gz	BGMHAOLDKBBILW-HNNXBMFYSA-N	0	0	298.411	4.137	20	30		CIEDRN
CC#CCCCC(=O)N1CCCC[C@@H]1c1ccc(F)cc1	ZINC000368760764	267203071	/nfs/dbraw/zinc/20/30/71/267203071.db2.gz	HJSLDKJQLCAXLU-QGZVFWFLSA-N	0	0	287.378	4.073	20	30		CIEDRN
N#CCCCN1CCC[C@H]1c1nc(C2CCCCC2)co1	ZINC000370208360	267299174	/nfs/dbraw/zinc/29/91/74/267299174.db2.gz	SUPTZAXOFKQJOE-INIZCTEOSA-N	0	0	287.407	4.163	20	30		CIEDRN
Cc1ccc(-c2ccc(CNCC3(C#N)CCC3)o2)cc1	ZINC000418145911	267366082	/nfs/dbraw/zinc/36/60/82/267366082.db2.gz	ZJNCUIPZCDVRAD-UHFFFAOYSA-N	0	0	280.371	4.039	20	30		CIEDRN
N#Cc1ccc(NC(=O)c2sccc2Cl)cc1Cl	ZINC000306105118	268023244	/nfs/dbraw/zinc/02/32/44/268023244.db2.gz	RUIVSJBHYWQCMN-UHFFFAOYSA-N	0	0	297.166	4.179	20	30		CIEDRN
CC#CCCCC(=O)N1C[C@H]2CCCC[C@]21c1ccccc1	ZINC000376953504	268033922	/nfs/dbraw/zinc/03/39/22/268033922.db2.gz	GGRJLSDILMLOPP-QUCCMNQESA-N	0	0	295.426	4.108	20	30		CIEDRN
CC#CCCCC(=O)N1C[C@@H]2CCCC[C@]21c1ccccc1	ZINC000376953503	268034011	/nfs/dbraw/zinc/03/40/11/268034011.db2.gz	GGRJLSDILMLOPP-ICSRJNTNSA-N	0	0	295.426	4.108	20	30		CIEDRN
CC#CCCCC(=O)N1CCC[C@H]1c1cc(C)cc(C)c1	ZINC000376954615	268034055	/nfs/dbraw/zinc/03/40/55/268034055.db2.gz	LRQNMXIVSREFIK-SFHVURJKSA-N	0	0	283.415	4.161	20	30		CIEDRN
N#Cc1ccc(C(=O)Nc2ccc(Cl)cc2Cl)s1	ZINC000336421626	328752893	/nfs/dbraw/zinc/75/28/93/328752893.db2.gz	DFMIXNPHDNSKCX-UHFFFAOYSA-N	0	0	297.166	4.179	20	30		CIEDRN
N#Cc1c(F)cccc1Oc1c(F)c(F)cc(F)c1F	ZINC000170639257	327647507	/nfs/dbraw/zinc/64/75/07/327647507.db2.gz	DALYBIUGWCYNCW-UHFFFAOYSA-N	0	0	285.171	4.046	20	30		CIEDRN
CC[C@H](CC#N)NC(=O)N(c1ccccc1)c1ccccc1	ZINC000186435293	327690412	/nfs/dbraw/zinc/69/04/12/327690412.db2.gz	SVVUENDYUMIJTF-OAHLLOKOSA-N	0	0	293.370	4.227	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H](C)c1cc(C)cc(C)c1	ZINC000580220507	327738215	/nfs/dbraw/zinc/73/82/15/327738215.db2.gz	MEXBZOILKVTVED-AWEZNQCLSA-N	0	0	259.393	4.083	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc3occ(C)c3c2)CCOCC1	ZINC000563009368	327748664	/nfs/dbraw/zinc/74/86/64/327748664.db2.gz	ICRKNWACOYCHFI-UHFFFAOYSA-N	0	0	299.370	4.053	20	30		CIEDRN
Cc1ccc([C@@H](C)Nc2ccc(F)cc2C#N)cc1	ZINC000113317552	327786247	/nfs/dbraw/zinc/78/62/47/327786247.db2.gz	UVGPJECFOLDNLY-GFCCVEGCSA-N	0	0	254.308	4.179	20	30		CIEDRN
CC(C)(C#N)CCCSCCOc1ccccc1	ZINC000177155497	327787960	/nfs/dbraw/zinc/78/79/60/327787960.db2.gz	XFGGVXMZUKBJCL-UHFFFAOYSA-N	0	0	263.406	4.129	20	30		CIEDRN
CCCOc1ccccc1NCCCC(C)(C)C#N	ZINC000178357685	327793896	/nfs/dbraw/zinc/79/38/96/327793896.db2.gz	IFCRPTLRYXRELN-UHFFFAOYSA-N	0	0	260.381	4.217	20	30		CIEDRN
C=C(CC)CS[C@H](C)C(=O)Nc1ccc(SC)cc1	ZINC000540193414	327809094	/nfs/dbraw/zinc/80/90/94/327809094.db2.gz	HNQSWHIBTIURRW-GFCCVEGCSA-N	0	0	295.473	4.435	20	30		CIEDRN
N#C[C@@H]1CCC[C@@H](Nc2ccccc2OCC(F)(F)F)C1	ZINC000185736776	327843652	/nfs/dbraw/zinc/84/36/52/327843652.db2.gz	MQXLHZOCTWQGPN-VXGBXAGGSA-N	0	0	298.308	4.122	20	30		CIEDRN
N#C[C@@H]1CCC[C@H](Nc2cccc(SC(F)F)c2)C1	ZINC000185745785	327843792	/nfs/dbraw/zinc/84/37/92/327843792.db2.gz	OCWXPSCZOWJHRW-MNOVXSKESA-N	0	0	282.359	4.496	20	30		CIEDRN
Cc1nc(-c2cccc(N[C@@H]3CCC[C@@H](C#N)C3)c2)oc1C	ZINC000185741131	327843959	/nfs/dbraw/zinc/84/39/59/327843959.db2.gz	VUDWEJYJDKXCKB-GDBMZVCRSA-N	0	0	295.386	4.453	20	30		CIEDRN
N#C[C@@H]1CCC[C@H](Nc2ccccc2CC(F)(F)F)C1	ZINC000185749761	327844196	/nfs/dbraw/zinc/84/41/96/327844196.db2.gz	VKQFPWPRHVOKQO-YPMHNXCESA-N	0	0	282.309	4.286	20	30		CIEDRN
CC(C)c1nccc(Nc2cccc(OCCCC#N)c2)n1	ZINC000110243974	327887269	/nfs/dbraw/zinc/88/72/69/327887269.db2.gz	OAZHYQUOPZKOIB-UHFFFAOYSA-N	0	0	296.374	4.026	20	30		CIEDRN
CCC(CC)N(C(=O)Nc1cc(C#N)ccc1C)C1CC1	ZINC000531421859	327904413	/nfs/dbraw/zinc/90/44/13/327904413.db2.gz	FZTOJUOVWHNFQF-UHFFFAOYSA-N	0	0	285.391	4.052	20	30		CIEDRN
C=CCCS[C@@H](C)C(=O)Nc1cccc(Cl)c1C	ZINC000151995846	327914397	/nfs/dbraw/zinc/91/43/97/327914397.db2.gz	PIIMHBJDCBLQHE-NSHDSACASA-N	0	0	283.824	4.285	20	30		CIEDRN
N#CCCCCSCc1cc(-c2cccs2)on1	ZINC000161181520	327916124	/nfs/dbraw/zinc/91/61/24/327916124.db2.gz	YUQZMALCJQFOPU-UHFFFAOYSA-N	0	0	278.402	4.330	20	30		CIEDRN
C=C[C@@H](CC(=O)NCCCC(C)(C)C)c1ccccc1	ZINC000533949881	327943819	/nfs/dbraw/zinc/94/38/19/327943819.db2.gz	WREKWFSXIYNRIS-HNNXBMFYSA-N	0	0	273.420	4.289	20	30		CIEDRN
CCCn1c2ccc(C#N)cc2nc1-c1ccc(F)cc1	ZINC000033559355	327943903	/nfs/dbraw/zinc/94/39/03/327943903.db2.gz	IYGBRVAITRGWTB-UHFFFAOYSA-N	0	0	279.318	4.124	20	30		CIEDRN
C=CCc1ccc(OCc2nc(C)sc2C)c(OC)c1	ZINC000337667234	327957238	/nfs/dbraw/zinc/95/72/38/327957238.db2.gz	MSLHXEWJAGLDIN-UHFFFAOYSA-N	0	0	289.400	4.076	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)CC[C@@H](C)c1ccccc1	ZINC000488883503	327960211	/nfs/dbraw/zinc/96/02/11/327960211.db2.gz	WMRSSUBJDHQIOL-NVXWUHKLSA-N	0	0	271.404	4.137	20	30		CIEDRN
CC[C@@H]1[C@H](c2ccc(C)cc2)CCN1C(=O)CC(C)(C)C#N	ZINC000365991494	327976346	/nfs/dbraw/zinc/97/63/46/327976346.db2.gz	VGSFHMLVVYAUSB-DLBZAZTESA-N	0	0	298.430	4.029	20	30		CIEDRN
C=CCOc1ccc(CNc2cccc(C3CC3)n2)cc1	ZINC000339429913	328010418	/nfs/dbraw/zinc/01/04/18/328010418.db2.gz	VMRMVQAILFRKRB-UHFFFAOYSA-N	0	0	280.371	4.136	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)c1ccc2ccccc2c1	ZINC000531518364	328013531	/nfs/dbraw/zinc/01/35/31/328013531.db2.gz	NNNZUQPZQCTTGZ-UHFFFAOYSA-N	0	0	294.398	4.432	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc(O)c2ccccc12	ZINC000531579884	328016218	/nfs/dbraw/zinc/01/62/18/328016218.db2.gz	GYVGOIWFJUCIQR-UHFFFAOYSA-N	0	0	281.355	4.252	20	30		CIEDRN
N#Cc1cccc(CNc2ccc(F)c(C(F)(F)F)c2)c1	ZINC000040712569	328017722	/nfs/dbraw/zinc/01/77/22/328017722.db2.gz	NTTKGDSRORYCAH-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
CCCCC1CCC(C(=O)Nc2cc(CC#N)ccn2)CC1	ZINC000531674109	328022741	/nfs/dbraw/zinc/02/27/41/328022741.db2.gz	YXHZREPUXIMINJ-UHFFFAOYSA-N	0	0	299.418	4.083	20	30		CIEDRN
CCc1cccc(CC)c1NC(=O)c1ccc(CC#N)cc1	ZINC000533965355	328030616	/nfs/dbraw/zinc/03/06/16/328030616.db2.gz	LXIGFDPGOVUTQZ-UHFFFAOYSA-N	0	0	292.382	4.130	20	30		CIEDRN
C=C[C@@H](CC(=O)NCC1(CC(C)C)CC1)c1ccccc1	ZINC000533990401	328032120	/nfs/dbraw/zinc/03/21/20/328032120.db2.gz	NEMJDXJHBVJSKP-INIZCTEOSA-N	0	0	285.431	4.289	20	30		CIEDRN
C=CCNc1cc(COc2cccc(F)c2)ccc1OC	ZINC000531791182	328034477	/nfs/dbraw/zinc/03/44/77/328034477.db2.gz	WYIQRGQYOZCTCB-UHFFFAOYSA-N	0	0	287.334	4.011	20	30		CIEDRN
C=CCCc1csc(-c2ccccc2OCC)n1	ZINC000534144248	328036726	/nfs/dbraw/zinc/03/67/26/328036726.db2.gz	BKPFXOQYDPNDDR-UHFFFAOYSA-N	0	0	259.374	4.327	20	30		CIEDRN
CC(C)[C@H]1CCc2ccccc2N1CCCSCC#N	ZINC000534218703	328039766	/nfs/dbraw/zinc/03/97/66/328039766.db2.gz	RQGNFXCCKZOCJT-MRXNPFEDSA-N	0	0	288.460	4.111	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@H](C)[C@@H]2CCCC[C@@H]21	ZINC000531823750	328039991	/nfs/dbraw/zinc/03/99/91/328039991.db2.gz	UZDFMSRWMALROM-XIRDDKMYSA-N	0	0	275.436	4.182	20	30		CIEDRN
C=CCCC(=O)Nc1nc2c(ccc3ccccc23)s1	ZINC000110313185	328044996	/nfs/dbraw/zinc/04/49/96/328044996.db2.gz	PCFUWMLUYJQKJC-UHFFFAOYSA-N	0	0	282.368	4.354	20	30		CIEDRN
C=CC1CCN(C(=O)c2ccc(Cl)cc2Cl)CC1	ZINC000110366370	328048942	/nfs/dbraw/zinc/04/89/42/328048942.db2.gz	NAJZOLLAUOCRHH-UHFFFAOYSA-N	0	0	284.186	4.032	20	30		CIEDRN
CCSc1ccccc1OCc1ccc(C#N)cc1F	ZINC000534386935	328050396	/nfs/dbraw/zinc/05/03/96/328050396.db2.gz	GMXGIQYIXLZSCM-UHFFFAOYSA-N	0	0	287.359	4.388	20	30		CIEDRN
COc1c(F)cc(F)cc1N[C@@H](C)c1ccc(C#N)cc1	ZINC000531859745	328051022	/nfs/dbraw/zinc/05/10/22/328051022.db2.gz	RRRGVIGNPWTWGB-JTQLQIEISA-N	0	0	288.297	4.018	20	30		CIEDRN
Cc1cc(C(=O)N(C)[C@@H](C)CC#N)sc1-c1ccccc1	ZINC000563376808	328058398	/nfs/dbraw/zinc/05/83/98/328058398.db2.gz	KLPXSJXYDIKZAY-ZDUSSCGKSA-N	0	0	298.411	4.098	20	30		CIEDRN
C[C@H](Oc1ccccc1N[C@H]1CC[C@@H](C#N)C1)C(F)(F)F	ZINC000563482393	328069909	/nfs/dbraw/zinc/06/99/09/328069909.db2.gz	KWFRWHIWAIFQPX-TUAOUCFPSA-N	0	0	298.308	4.120	20	30		CIEDRN
C=CCCCCSCc1nnc(C(C)C)s1	ZINC000563622745	328078158	/nfs/dbraw/zinc/07/81/58/328078158.db2.gz	MXGFUTSCACWTCU-UHFFFAOYSA-N	0	0	256.440	4.251	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@@H](CC(C)C)C1	ZINC000152202124	328079871	/nfs/dbraw/zinc/07/98/71/328079871.db2.gz	FMJMQPKCYRNMIM-HNNXBMFYSA-N	0	0	263.425	4.040	20	30		CIEDRN
C/C=C\c1ccc(NCc2ccc(C#N)c(OC)c2)cc1	ZINC000563650735	328081229	/nfs/dbraw/zinc/08/12/29/328081229.db2.gz	OISZXRYGFNJFFA-ARJAWSKDSA-N	0	0	278.355	4.212	20	30		CIEDRN
CCN(C(=O)c1cc(Cl)ccc1C)c1ccc(C#N)cc1	ZINC000152253574	328082872	/nfs/dbraw/zinc/08/28/72/328082872.db2.gz	FFTBXTRZOSRYRU-UHFFFAOYSA-N	0	0	298.773	4.187	20	30		CIEDRN
N#Cc1cc(CN2CCC[C@@H]2c2ccsc2)ccc1F	ZINC000160854586	328089125	/nfs/dbraw/zinc/08/91/25/328089125.db2.gz	WKVBDYQKUYLYRP-MRXNPFEDSA-N	0	0	286.375	4.096	20	30		CIEDRN
Cc1nsc(NCc2c(Cl)cccc2Cl)c1C#N	ZINC000571308925	328102876	/nfs/dbraw/zinc/10/28/76/328102876.db2.gz	XOWZZVNRYWYSLS-UHFFFAOYSA-N	0	0	298.198	4.242	20	30		CIEDRN
C=C1CCN(C(=O)CCc2ccc(C(C)(C)C)cc2)CC1	ZINC000521443132	328106374	/nfs/dbraw/zinc/10/63/74/328106374.db2.gz	JYJOMBYUYUFRHL-UHFFFAOYSA-N	0	0	285.431	4.095	20	30		CIEDRN
C=CCCC(=O)N[C@@H](C)c1cc2ccccc2s1	ZINC000171727591	329078547	/nfs/dbraw/zinc/07/85/47/329078547.db2.gz	JRINYBSPBCAWPT-NSHDSACASA-N	0	0	259.374	4.045	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@H]1CC[C@H](c2ccc(Cl)cc2)C1	ZINC000412582125	328112690	/nfs/dbraw/zinc/11/26/90/328112690.db2.gz	APJGVDGEEQYCFG-ZFWWWQNUSA-N	0	0	291.822	4.305	20	30		CIEDRN
CC[C@H](C)Oc1cc(C)ccc1CNc1cc(C#N)ccn1	ZINC000571589770	328136242	/nfs/dbraw/zinc/13/62/42/328136242.db2.gz	SFADIRBYLLEIHS-AWEZNQCLSA-N	0	0	295.386	4.051	20	30		CIEDRN
CSCCCSCc1ccccc1C(C)(C)C#N	ZINC000413011271	328139638	/nfs/dbraw/zinc/13/96/38/328139638.db2.gz	VHZKHSAUPNMHOC-UHFFFAOYSA-N	0	0	279.474	4.474	20	30		CIEDRN
Cc1ccc(Cl)cc1NCc1ccc(C#N)s1	ZINC000155350860	328163590	/nfs/dbraw/zinc/16/35/90/328163590.db2.gz	WKLHAVXFRAICKD-UHFFFAOYSA-N	0	0	262.765	4.194	20	30		CIEDRN
CCCOc1cccc(CSc2cc(C#N)ccn2)c1	ZINC000436476702	328167167	/nfs/dbraw/zinc/16/71/67/328167167.db2.gz	TYGLSUDTVQAOBU-UHFFFAOYSA-N	0	0	284.384	4.034	20	30		CIEDRN
CC(C)(C)[C@@](C)(C#N)NC(=O)c1cccc(-c2ccoc2)c1	ZINC000274383620	328210814	/nfs/dbraw/zinc/21/08/14/328210814.db2.gz	YZYHFSMZVQFPQI-GOSISDBHSA-N	0	0	296.370	4.005	20	30		CIEDRN
N#CCCN(CCC#N)Cc1ccc(-c2cccs2)cc1	ZINC000277757983	328222429	/nfs/dbraw/zinc/22/24/29/328222429.db2.gz	QAWZUSLQIHEFCD-UHFFFAOYSA-N	0	0	295.411	4.044	20	30		CIEDRN
N#Cc1sc(N[C@@H](c2ccccc2)C2CC2)nc1Cl	ZINC000278692160	328229715	/nfs/dbraw/zinc/22/97/15/328229715.db2.gz	MCXHFOJJZBQLKB-LBPRGKRZSA-N	0	0	289.791	4.231	20	30		CIEDRN
CC(C)(C#N)CC(=O)Nc1ncc(C2CCCCC2)s1	ZINC000278901849	328232025	/nfs/dbraw/zinc/23/20/25/328232025.db2.gz	YSIAVFHVPGBPIU-UHFFFAOYSA-N	0	0	291.420	4.069	20	30		CIEDRN
C[C@@H](C#N)CSc1ccccc1NCCCCCF	ZINC000284016698	328245321	/nfs/dbraw/zinc/24/53/21/328245321.db2.gz	HXRWCHYYXMCVQZ-ZDUSSCGKSA-N	0	0	280.412	4.490	20	30		CIEDRN
CC[C@@H]([NH2+][C@H](C)c1ccc(C#N)cc1)c1ccc(F)cc1[O-]	ZINC000286297168	328249381	/nfs/dbraw/zinc/24/93/81/328249381.db2.gz	WLJXZWGIHSTRKA-SJKOYZFVSA-N	0	0	298.361	4.205	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)Nc1cccc(CCC(F)(F)F)c1	ZINC000287697914	328251875	/nfs/dbraw/zinc/25/18/75/328251875.db2.gz	WYRWXGKTBGCOCA-CQSZACIVSA-N	0	0	298.308	4.060	20	30		CIEDRN
CC(C)CCN(CCC#N)Cc1ccc(C(F)F)cc1	ZINC000183954590	329255180	/nfs/dbraw/zinc/25/51/80/329255180.db2.gz	BDHMPUWOHMHZAV-UHFFFAOYSA-N	0	0	280.362	4.386	20	30		CIEDRN
CCN(C(=O)CCCC#N)[C@H](C)c1cc2ccccc2o1	ZINC000292174183	328268420	/nfs/dbraw/zinc/26/84/20/328268420.db2.gz	AJGLTDZMHCLACJ-CYBMUJFWSA-N	0	0	284.359	4.036	20	30		CIEDRN
CC/C(C)=C/C(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1	ZINC000294526922	328281669	/nfs/dbraw/zinc/28/16/69/328281669.db2.gz	HAMJTDGJDVKYCJ-PPGNKHEKSA-N	0	0	297.185	4.031	20	30		CIEDRN
N#C[C@@]1(c2nc(-c3ccccc3Cl)no2)CC12CCCC2	ZINC000296066560	328288833	/nfs/dbraw/zinc/28/88/33/328288833.db2.gz	XPWQALXXQCDLIL-MRXNPFEDSA-N	0	0	299.761	4.115	20	30		CIEDRN
CC(C)C[C@@]1(C)CCCN1C(=O)Nc1ccc(CC#N)cc1	ZINC000296200948	328289496	/nfs/dbraw/zinc/28/94/96/328289496.db2.gz	DNLQMRJPVYSREO-GOSISDBHSA-N	0	0	299.418	4.185	20	30		CIEDRN
C=C(C)CCc1noc(-c2ncoc2-c2ccc(C)cc2)n1	ZINC000582148168	328302133	/nfs/dbraw/zinc/30/21/33/328302133.db2.gz	AOUOCAHZAQNBHN-UHFFFAOYSA-N	0	0	295.342	4.209	20	30		CIEDRN
C[C@@H](Cc1ccsc1)Nc1cccc(Cl)c1C#N	ZINC000048553212	328312385	/nfs/dbraw/zinc/31/23/85/328312385.db2.gz	PWRZTCDCLVTBGB-JTQLQIEISA-N	0	0	276.792	4.316	20	30		CIEDRN
CC(C)C[C@@](C)(C#N)NC(=O)c1cc2sccc2s1	ZINC000534596625	328319422	/nfs/dbraw/zinc/31/94/22/328319422.db2.gz	JNCRQDXSPOPMDQ-AWEZNQCLSA-N	0	0	292.429	4.021	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@H]1CCCC[C@H]1C)c1ccccc1	ZINC000534601070	328320430	/nfs/dbraw/zinc/32/04/30/328320430.db2.gz	SXIRNBLMEPXHCQ-INMHGKMJSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=C[C@@H](CC(=O)NCc1ccc(F)c(C)c1)c1ccccc1	ZINC000534604273	328321407	/nfs/dbraw/zinc/32/14/07/328321407.db2.gz	JQAHXOYSRWWSDS-INIZCTEOSA-N	0	0	297.373	4.110	20	30		CIEDRN
N#Cc1c(Cl)cccc1NCCc1ccc(F)cc1	ZINC000048935473	328326184	/nfs/dbraw/zinc/32/61/84/328326184.db2.gz	BQCFOZITNQTMLV-UHFFFAOYSA-N	0	0	274.726	4.005	20	30		CIEDRN
C[C@H](CCc1ccco1)Nc1cccc(Cl)c1C#N	ZINC000048936371	328326249	/nfs/dbraw/zinc/32/62/49/328326249.db2.gz	SNZPYQOXPBGPNW-LLVKDONJSA-N	0	0	274.751	4.238	20	30		CIEDRN
N#CC1(COc2c(F)cc(Cl)cc2Cl)CCC1	ZINC000583083977	329311914	/nfs/dbraw/zinc/31/19/14/329311914.db2.gz	OOVUWAYQMIFFPQ-UHFFFAOYSA-N	0	0	274.122	4.205	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@@H]1CCCC(F)(F)C1)c1ccccc1	ZINC000534667694	328345740	/nfs/dbraw/zinc/34/57/40/328345740.db2.gz	YSFWQHZFYJNSEY-UKRRQHHQSA-N	0	0	293.357	4.040	20	30		CIEDRN
C[C@@H](c1ccc(C#N)cc1)N1CCCc2ccccc21	ZINC000303661018	328352471	/nfs/dbraw/zinc/35/24/71/328352471.db2.gz	DGZJRXYQRWDTMI-AWEZNQCLSA-N	0	0	262.356	4.072	20	30		CIEDRN
C=C[C@@H](CC(=O)NC(C)(C)c1cccs1)c1ccccc1	ZINC000534678467	328352529	/nfs/dbraw/zinc/35/25/29/328352529.db2.gz	BXOAMFHNWHNTRL-AWEZNQCLSA-N	0	0	299.439	4.459	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2cccc3ccccc32)CC1	ZINC000111419238	328354746	/nfs/dbraw/zinc/35/47/46/328354746.db2.gz	NTEIAZHRQRQWBY-UHFFFAOYSA-N	0	0	280.371	4.270	20	30		CIEDRN
CC(C)C[C@H]1CCCCCN1C(=O)c1ccc(CC#N)cc1	ZINC000534664134	328351506	/nfs/dbraw/zinc/35/15/06/328351506.db2.gz	FMSMNHABVBVOGO-GOSISDBHSA-N	0	0	298.430	4.184	20	30		CIEDRN
C=C[C@@H](CC(=O)NC1(C)CCCCC1)c1ccccc1	ZINC000534734666	328359911	/nfs/dbraw/zinc/35/99/11/328359911.db2.gz	BHEOXDVXTVGNGO-HNNXBMFYSA-N	0	0	271.404	4.185	20	30		CIEDRN
C=C[C@H](CC(=O)N1CC[C@@H](C)C[C@@H](C)C1)c1ccccc1	ZINC000534724272	328359339	/nfs/dbraw/zinc/35/93/39/328359339.db2.gz	ZBPGGPAKVLOJSA-BRWVUGGUSA-N	0	0	285.431	4.241	20	30		CIEDRN
N#CCc1ccc(-c2nc(-c3ccccc3Cl)no2)cc1	ZINC000534693263	328356603	/nfs/dbraw/zinc/35/66/03/328356603.db2.gz	WMEOUYKLKISGKL-UHFFFAOYSA-N	0	0	295.729	4.123	20	30		CIEDRN
C[C@@H]1CCC[C@](C#N)(NC(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000303680858	328357741	/nfs/dbraw/zinc/35/77/41/328357741.db2.gz	RUPMHHVDJUZHEJ-KUHUBIRLSA-N	0	0	298.430	4.186	20	30		CIEDRN
C[C@H](c1ccc(C#N)cc1)N1CCc2ccc(Cl)cc2C1	ZINC000534904993	328369390	/nfs/dbraw/zinc/36/93/90/328369390.db2.gz	ITLWEUALSSPQOW-CYBMUJFWSA-N	0	0	296.801	4.331	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)[C@H]2CCC[C@H](C)C2)c1	ZINC000303953268	328369739	/nfs/dbraw/zinc/36/97/39/328369739.db2.gz	ZNXHAXIFEOGRGR-GJZGRUSLSA-N	0	0	287.403	4.406	20	30		CIEDRN
COc1ccc(/C=C/c2ccc3ccccc3n2)cc1C#N	ZINC000303956532	328370229	/nfs/dbraw/zinc/37/02/29/328370229.db2.gz	XOXQJCLGBYBFHJ-RMKNXTFCSA-N	0	0	286.334	4.285	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2cccc(C(C)C)c2)CC1	ZINC000111711894	328376653	/nfs/dbraw/zinc/37/66/53/328376653.db2.gz	UUUYAXGYMCDNKU-UHFFFAOYSA-N	0	0	272.392	4.240	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)c1cc2c(s1)CCCC2	ZINC000050212891	328390253	/nfs/dbraw/zinc/39/02/53/328390253.db2.gz	SOIFKDAVLNHGHI-UHFFFAOYSA-N	0	0	296.395	4.059	20	30		CIEDRN
C=C(C)[C@H](CC(=O)Nc1cccc(SCC)c1)OCC	ZINC000535134998	328391238	/nfs/dbraw/zinc/39/12/38/328391238.db2.gz	XMDQOTMUMMUDCM-HNNXBMFYSA-N	0	0	293.432	4.108	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)N(CC)c1cccc(Cl)c1)OCC	ZINC000535138363	328392085	/nfs/dbraw/zinc/39/20/85/328392085.db2.gz	OTKGZUUWSMGYPT-OAHLLOKOSA-N	0	0	295.810	4.064	20	30		CIEDRN
C=C(C)[C@H](CC(=O)N(CC)c1cccc(Cl)c1)OCC	ZINC000535138360	328392156	/nfs/dbraw/zinc/39/21/56/328392156.db2.gz	OTKGZUUWSMGYPT-HNNXBMFYSA-N	0	0	295.810	4.064	20	30		CIEDRN
N#CCN(C(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1ccccc1	ZINC000535211074	328394905	/nfs/dbraw/zinc/39/49/05/328394905.db2.gz	OAXCPLDUYKXMHL-GVDBMIGSSA-N	0	0	296.414	4.150	20	30		CIEDRN
CC[C@H](C)N(C(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1)[C@@H](C)CC	ZINC000415406186	328427180	/nfs/dbraw/zinc/42/71/80/328427180.db2.gz	WZJCZIRAGSBTHB-DFEHZGFQSA-N	0	0	298.430	4.087	20	30		CIEDRN
CCCc1cc(C(=O)N[C@](C)(C#N)CC(C)C)sc1C	ZINC000535324258	328441428	/nfs/dbraw/zinc/44/14/28/328441428.db2.gz	DWBRPKIEYVRVMB-INIZCTEOSA-N	0	0	292.448	4.067	20	30		CIEDRN
CCCc1cc(C(=O)N[C@@](C)(C#N)CC(C)C)sc1C	ZINC000535324269	328441523	/nfs/dbraw/zinc/44/15/23/328441523.db2.gz	DWBRPKIEYVRVMB-MRXNPFEDSA-N	0	0	292.448	4.067	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@H](C)C[C@H](C)CC)c1ccccc1	ZINC000535387249	328449350	/nfs/dbraw/zinc/44/93/50/328449350.db2.gz	JEFMILAJKYDDGF-BZUAXINKSA-N	0	0	273.420	4.287	20	30		CIEDRN
CC(C)CCC1CCN(C(=O)c2ccc(CC#N)cc2)CC1	ZINC000535442357	328452122	/nfs/dbraw/zinc/45/21/22/328452122.db2.gz	VQFIWGMDRFYDNF-UHFFFAOYSA-N	0	0	298.430	4.041	20	30		CIEDRN
C=CCC[C@H](N[C@H]1COCc2ccccc21)c1ccco1	ZINC000417365578	328457599	/nfs/dbraw/zinc/45/75/99/328457599.db2.gz	NURTZFZJPZQXID-IRXDYDNUSA-N	0	0	283.371	4.148	20	30		CIEDRN
O=C(NCCOc1cncc(Cl)c1)C1CCCCCC1	ZINC000328792042	328458601	/nfs/dbraw/zinc/45/86/01/328458601.db2.gz	RGVOVQYVCBFDBQ-UHFFFAOYSA-N	0	0	296.798	4.041	20	30		CIEDRN
C[C@@H]1CC(=O)N[C@H](C(=O)N[C@@H]2CCCC[C@@H]2C(C)(C)C)C1	ZINC000328792569	328458635	/nfs/dbraw/zinc/45/86/35/328458635.db2.gz	ZUNNNFWIUCKGLF-FQUUOJAGSA-N	0	0	294.439	4.303	20	30		CIEDRN
CC(C)[C@@H]1CCCC[C@H]1NC(=O)c1cccc(CC#N)c1	ZINC000330546158	328462884	/nfs/dbraw/zinc/46/28/84/328462884.db2.gz	VEBIPAFYJREBAF-DLBZAZTESA-N	0	0	284.403	4.272	20	30		CIEDRN
CCC[C@@H](NC(=O)c1oc(C)nc1C)C1CCCCC1	ZINC000330990130	328470960	/nfs/dbraw/zinc/47/09/60/328470960.db2.gz	YDIACFYNDAOMGJ-CQSZACIVSA-N	0	0	278.396	4.345	20	30		CIEDRN
CC(C)OC1CCC(Nc2c(Cl)cccc2C#N)CC1	ZINC000130090404	328487675	/nfs/dbraw/zinc/48/76/75/328487675.db2.gz	VBIAQNBARZVJCB-UHFFFAOYSA-N	0	0	292.810	4.360	20	30		CIEDRN
C=C(C)CCc1noc(CCCSC(C)(C)C)n1	ZINC000285167336	328520072	/nfs/dbraw/zinc/52/00/72/328520072.db2.gz	PZRUDLCAWVCTLG-UHFFFAOYSA-N	0	0	268.426	4.043	20	30		CIEDRN
CC#CCCCC(=O)N1CCC[C@@H]1c1ccc(Cl)cc1	ZINC000185207946	328547653	/nfs/dbraw/zinc/54/76/53/328547653.db2.gz	GCYPLZNHFCPDQN-MRXNPFEDSA-N	0	0	289.806	4.197	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1cc(F)ccc1OC)c1ccccc1	ZINC000093547918	328594086	/nfs/dbraw/zinc/59/40/86/328594086.db2.gz	GDPHPPRMDMCNPB-CYBMUJFWSA-N	0	0	299.345	4.133	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@H](C)C(CC)CC	ZINC000535586248	328594965	/nfs/dbraw/zinc/59/49/65/328594965.db2.gz	TVYLUNCIZMWIAO-CYBMUJFWSA-N	0	0	279.449	4.335	20	30		CIEDRN
CC(C)Oc1ccc(CNc2cccc(F)c2C#N)cc1	ZINC000035230952	326813712	/nfs/dbraw/zinc/81/37/12/326813712.db2.gz	PWQAMDSBOMMKPV-UHFFFAOYSA-N	0	0	284.334	4.097	20	30		CIEDRN
CC#CCCCC(=O)Nc1cccnc1-c1ccc(C)s1	ZINC000187065727	326820943	/nfs/dbraw/zinc/82/09/43/326820943.db2.gz	MPAROEITLNWLJU-UHFFFAOYSA-N	0	0	298.411	4.251	20	30		CIEDRN
CN(C(=O)c1cc2sccc2s1)c1cccc(C#N)c1	ZINC000109360261	326841795	/nfs/dbraw/zinc/84/17/95/326841795.db2.gz	UUJJVGRVCWCOEN-UHFFFAOYSA-N	0	0	298.392	4.111	20	30		CIEDRN
N#CC1(C(=O)NC2CCC3(CCCCC3)CC2)CCCC1	ZINC000188331169	326872535	/nfs/dbraw/zinc/87/25/35/326872535.db2.gz	GNSJKCBSIWRIOW-UHFFFAOYSA-N	0	0	288.435	4.080	20	30		CIEDRN
C[C@H](C#N)CN(Cc1cc(Cl)ccc1Cl)C1CC1	ZINC000533596058	326872606	/nfs/dbraw/zinc/87/26/06/326872606.db2.gz	DTGRAVSZLKJNLT-SNVBAGLBSA-N	0	0	283.202	4.117	20	30		CIEDRN
C=CC(C)(C)C(=O)N(C)[C@H](C)c1sc(C(C)C)nc1C	ZINC000297987572	326887084	/nfs/dbraw/zinc/88/70/84/326887084.db2.gz	YIOSNUVLBFZSID-GFCCVEGCSA-N	0	0	294.464	4.307	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)c1cc2ccccn2c1	ZINC000530817129	326892372	/nfs/dbraw/zinc/89/23/72/326892372.db2.gz	ILHYKQAVKYRPOR-UHFFFAOYSA-N	0	0	296.414	4.148	20	30		CIEDRN
C=C(C)CSCc1coc(-c2ccc(C)cc2)n1	ZINC000530873721	326894389	/nfs/dbraw/zinc/89/43/89/326894389.db2.gz	GSQPRPHZVIAMKD-UHFFFAOYSA-N	0	0	259.374	4.459	20	30		CIEDRN
C=CCCCc1nc(-c2cccc(Br)c2)no1	ZINC000530892055	326894897	/nfs/dbraw/zinc/89/48/97/326894897.db2.gz	FHHQTTSOMOYLMG-UHFFFAOYSA-N	0	0	293.164	4.008	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1cccc(C)c1C	ZINC000124440191	326912895	/nfs/dbraw/zinc/91/28/95/326912895.db2.gz	WMAANUJJZVXMAW-ZDUSSCGKSA-N	0	0	260.381	4.170	20	30		CIEDRN
N#Cc1ccc(SCCCCF)cc1C(F)(F)F	ZINC000506394507	332772082	/nfs/dbraw/zinc/77/20/82/332772082.db2.gz	BHJNWEQUCIBLDK-UHFFFAOYSA-N	0	0	277.286	4.419	20	30		CIEDRN
CC1(C)CCC[C@@H](CC(=O)N(CC#N)c2ccccc2)C1	ZINC000533763605	326929865	/nfs/dbraw/zinc/92/98/65/326929865.db2.gz	CGDSFNADEJCTTI-HNNXBMFYSA-N	0	0	284.403	4.150	20	30		CIEDRN
C=CCCO[C@H](C)c1nc([C@@H]2CCCC[C@@H]2CC)no1	ZINC000556388730	326931240	/nfs/dbraw/zinc/93/12/40/326931240.db2.gz	VUCAOPNPKRWOJX-HZSPNIEDSA-N	0	0	278.396	4.407	20	30		CIEDRN
CSc1cccc(NCCCC(C)(C)C#N)c1C	ZINC000538138838	326933059	/nfs/dbraw/zinc/93/30/59/326933059.db2.gz	FNPPKSHQHIIALN-UHFFFAOYSA-N	0	0	262.422	4.459	20	30		CIEDRN
CCc1cccc(NC(=O)c2ccc(F)c(C#N)c2)c1CC	ZINC000556455322	326942965	/nfs/dbraw/zinc/94/29/65/326942965.db2.gz	WQAXPZGKUSFZON-UHFFFAOYSA-N	0	0	296.345	4.074	20	30		CIEDRN
CCC[C@@H](C(=O)N[C@@](C)(C#N)C1CCCCC1)C(C)C	ZINC000556685397	326958466	/nfs/dbraw/zinc/95/84/66/326958466.db2.gz	PWYUIFUPVYSPLK-WBVHZDCISA-N	0	0	278.440	4.037	20	30		CIEDRN
CN(C(=O)[C@@H]1CCC[C@H]2CCCC[C@@H]21)c1cccc(C#N)c1	ZINC000556810055	326967443	/nfs/dbraw/zinc/96/74/43/326967443.db2.gz	JZFGTCCHJRCXBM-BPQIPLTHSA-N	0	0	296.414	4.128	20	30		CIEDRN
C[C@H]1CCC[C@@](C#N)(NC(=O)CCCCC(C)(C)C)C1	ZINC000553321558	326975128	/nfs/dbraw/zinc/97/51/28/326975128.db2.gz	BALOFGTYBUSUQN-WMLDXEAASA-N	0	0	278.440	4.182	20	30		CIEDRN
C=CCC[C@@H](Nc1ccc2c(c1)ncn2C)c1ccco1	ZINC000556889922	326979358	/nfs/dbraw/zinc/97/93/58/326979358.db2.gz	KUFLZSGLMWZUBH-CQSZACIVSA-N	0	0	281.359	4.286	20	30		CIEDRN
CCCCN(C(=O)c1ccc(F)c(C#N)c1)c1ccccc1	ZINC000556902709	326980697	/nfs/dbraw/zinc/98/06/97/326980697.db2.gz	RFPVGIYRGWIPPQ-UHFFFAOYSA-N	0	0	296.345	4.144	20	30		CIEDRN
CCNc1ccc(C#N)cc1NC(=O)C[C@H](C)CC(C)C	ZINC000556930901	326984252	/nfs/dbraw/zinc/98/42/52/326984252.db2.gz	URSDECQYXHJZAN-CYBMUJFWSA-N	0	0	287.407	4.001	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)N1C[C@H](C(C)(C)C)c2ccccc21	ZINC000557020158	326989727	/nfs/dbraw/zinc/98/97/27/326989727.db2.gz	HCIHOVXWXFKCLF-KBXCAEBGSA-N	0	0	284.403	4.103	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@@H]1CCC[C@H]2CCCC[C@H]21	ZINC000557034831	326990168	/nfs/dbraw/zinc/99/01/68/326990168.db2.gz	VXLPYYOHCXILME-QKPAOTATSA-N	0	0	263.425	4.064	20	30		CIEDRN
CNc1ccc(C#N)cc1NC(=O)[C@H](C)CC1CCCCC1	ZINC000557061744	326991827	/nfs/dbraw/zinc/99/18/27/326991827.db2.gz	NTXHYEAQOFFCQW-CYBMUJFWSA-N	0	0	299.418	4.145	20	30		CIEDRN
C=C(CC)CSCC(=O)c1c(C)[nH]c2ccccc21	ZINC000557304168	327001027	/nfs/dbraw/zinc/00/10/27/327001027.db2.gz	KSDZHPHDOOHGOP-UHFFFAOYSA-N	0	0	273.401	4.358	20	30		CIEDRN
Cc1ccc(N[C@@H]2CCc3ccc(C#N)cc32)c(F)c1	ZINC000564432878	327001408	/nfs/dbraw/zinc/00/14/08/327001408.db2.gz	RVXWNXLMFWCNDM-MRXNPFEDSA-N	0	0	266.319	4.105	20	30		CIEDRN
CCCC(C)(C)CC(=O)Nc1cc(C#N)ccc1NCC	ZINC000557399686	327004351	/nfs/dbraw/zinc/00/43/51/327004351.db2.gz	WDVFXOPSCSMHGD-UHFFFAOYSA-N	0	0	287.407	4.145	20	30		CIEDRN
CC(C)(C#N)CCSCc1noc(C2CCCCC2)n1	ZINC000557497475	327009152	/nfs/dbraw/zinc/00/91/52/327009152.db2.gz	SBQSOMYBOIRIRJ-UHFFFAOYSA-N	0	0	293.436	4.290	20	30		CIEDRN
Cc1nc(NCC(C)(C)CCC#N)ccc1-c1ccccc1	ZINC000557531425	327012067	/nfs/dbraw/zinc/01/20/67/327012067.db2.gz	XUPOLPAVBADCAQ-UHFFFAOYSA-N	0	0	293.414	4.221	20	30		CIEDRN
Cc1nsc(N[C@H](C)c2c(C)cccc2C)c1C#N	ZINC000557632634	327017379	/nfs/dbraw/zinc/01/73/79/327017379.db2.gz	SVBCLZUIXDJVCO-GFCCVEGCSA-N	0	0	271.389	4.113	20	30		CIEDRN
C=CCC[C@@H](Nc1ccc(F)cn1)c1ccccc1	ZINC000557639286	327018284	/nfs/dbraw/zinc/01/82/84/327018284.db2.gz	DZAGJFHWRHYANS-OAHLLOKOSA-N	0	0	256.324	4.340	20	30		CIEDRN
CCc1cc(CC)nc(N[C@H](CCC#N)c2ccccc2)n1	ZINC000557643992	327018520	/nfs/dbraw/zinc/01/85/20/327018520.db2.gz	NRLLPJBQAAAYDJ-QGZVFWFLSA-N	0	0	294.402	4.058	20	30		CIEDRN
C[C@@H]1C[C@@H](c2ccccc2)N(c2nccc(C#N)c2Cl)C1	ZINC000557763077	327025507	/nfs/dbraw/zinc/02/55/07/327025507.db2.gz	PMUNUCWQPBNLKP-DOMZBBRYSA-N	0	0	297.789	4.194	20	30		CIEDRN
CC/C=C\CCNc1cccc(OCCCC#N)c1	ZINC000342671163	327028222	/nfs/dbraw/zinc/02/82/22/327028222.db2.gz	KBOKUIMQKQAEKT-ARJAWSKDSA-N	0	0	258.365	4.137	20	30		CIEDRN
C=C(C)CN(CC)C(=O)COc1ccccc1[C@H](C)CC	ZINC000255932356	327032877	/nfs/dbraw/zinc/03/28/77/327032877.db2.gz	VWDOXVGJRDUPGZ-OAHLLOKOSA-N	0	0	289.419	4.004	20	30		CIEDRN
N#Cc1ccc(C(=O)Nc2cccc(-c3ccccc3)c2)cc1	ZINC000557961055	327037615	/nfs/dbraw/zinc/03/76/15/327037615.db2.gz	XSZIDYUNAGKKOJ-UHFFFAOYSA-N	0	0	298.345	4.478	20	30		CIEDRN
C=CCN(C(=O)[C@@H](C)Cc1ccccc1)c1ccccc1	ZINC000558028141	327046328	/nfs/dbraw/zinc/04/63/28/327046328.db2.gz	BFJCATUJLOYODF-INIZCTEOSA-N	0	0	279.383	4.084	20	30		CIEDRN
CC#CCN(C)C(=O)c1cc2sc3ccccc3c2s1	ZINC000558048277	327050439	/nfs/dbraw/zinc/05/04/39/327050439.db2.gz	ZRWMXKYNVDMZTE-UHFFFAOYSA-N	0	0	299.420	4.211	20	30		CIEDRN
C=CCN(C(=O)c1cc2cc(C)ccc2s1)C1CC1	ZINC000584165593	327054188	/nfs/dbraw/zinc/05/41/88/327054188.db2.gz	RXYPHLAANMZRJH-UHFFFAOYSA-N	0	0	271.385	4.000	20	30		CIEDRN
CC[C@@H](CC#N)NC(=O)c1ccc(C(C)(C)C)c(Cl)c1	ZINC000584204137	327063518	/nfs/dbraw/zinc/06/35/18/327063518.db2.gz	VEFPANPVTXMPKK-LBPRGKRZSA-N	0	0	292.810	4.060	20	30		CIEDRN
CCN(Cc1c(F)cccc1F)c1cccc(F)c1C#N	ZINC000506785640	332780190	/nfs/dbraw/zinc/78/01/90/332780190.db2.gz	BELUOQBGDMMXTI-UHFFFAOYSA-N	0	0	290.288	4.002	20	30		CIEDRN
CC[C@H](C)CCC(=O)Nc1cc(C#N)ccc1OC(C)C	ZINC000506789582	332780192	/nfs/dbraw/zinc/78/01/92/332780192.db2.gz	HVOODRXZPGIHMK-ZDUSSCGKSA-N	0	0	288.391	4.110	20	30		CIEDRN
N#Cc1cnc(N[C@H]2CCC[C@H]2c2ccccc2)c(Cl)c1	ZINC000558116517	327074691	/nfs/dbraw/zinc/07/46/91/327074691.db2.gz	KEVRVBVGADEGCO-HOCLYGCPSA-N	0	0	297.789	4.355	20	30		CIEDRN
Cc1ccc([C@@H]2CCCN2c2cccc(F)c2C#N)cc1	ZINC000506816712	332780759	/nfs/dbraw/zinc/78/07/59/332780759.db2.gz	LSWJXZPIRINHMF-KRWDZBQOSA-N	0	0	280.346	4.347	20	30		CIEDRN
N#CCC[C@@H](C#N)CSc1nc(-c2ccccc2)cs1	ZINC000066399972	327080445	/nfs/dbraw/zinc/08/04/45/327080445.db2.gz	XIRQTWCPFLJAQN-LBPRGKRZSA-N	0	0	299.424	4.346	20	30		CIEDRN
CC[C@](C)(C#N)c1nc([C@@H](c2cccc(C)c2)C(C)C)no1	ZINC000558393065	327090162	/nfs/dbraw/zinc/09/01/62/327090162.db2.gz	JAOGGJZBIMTFSL-CRAIPNDOSA-N	0	0	297.402	4.357	20	30		CIEDRN
Cc1c(C#N)cccc1NCc1ccc2occc2c1	ZINC000558404545	327091450	/nfs/dbraw/zinc/09/14/50/327091450.db2.gz	HVFKZEGCMDDECZ-UHFFFAOYSA-N	0	0	262.312	4.225	20	30		CIEDRN
N#Cc1ccc(COc2cc(Cl)ccc2F)c(F)c1	ZINC000533813851	327093891	/nfs/dbraw/zinc/09/38/91/327093891.db2.gz	FRFCCYVKBRHHIT-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
CC(C)c1ccc(C[NH2+][C@@H]2CCc3ccc(C#N)cc32)cc1	ZINC000558503891	327099393	/nfs/dbraw/zinc/09/93/93/327099393.db2.gz	GQYPQEFPSSXTHY-HXUWFJFHSA-N	0	0	290.410	4.459	20	30		CIEDRN
COc1cc(F)c(F)cc1N[C@H](C)c1cccc(C#N)c1	ZINC000558509398	327099759	/nfs/dbraw/zinc/09/97/59/327099759.db2.gz	OXDZKEJNMXTJPB-SNVBAGLBSA-N	0	0	288.297	4.018	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1cnc(C2CC2)s1	ZINC000558591305	327107813	/nfs/dbraw/zinc/10/78/13/327107813.db2.gz	LCNOOVDNHKJSMG-UHFFFAOYSA-N	0	0	298.411	4.391	20	30		CIEDRN
C[C@@H](CCNc1ccc(C#N)c([N+](=O)[O-])c1)c1ccccc1	ZINC000317630461	327131299	/nfs/dbraw/zinc/13/12/99/327131299.db2.gz	WHWIGOXPNSCGOR-ZDUSSCGKSA-N	0	0	295.342	4.072	20	30		CIEDRN
CN(Cc1c(Cl)cccc1Cl)[C@@H]1CC[C@H](C#N)C1	ZINC000559067045	327139767	/nfs/dbraw/zinc/13/97/67/327139767.db2.gz	WENBIXDFBKEGGI-WDEREUQCSA-N	0	0	283.202	4.117	20	30		CIEDRN
Cc1nc(Oc2cc(Cl)cc(Cl)c2)ccc1C#N	ZINC000381209140	327151610	/nfs/dbraw/zinc/15/16/10/327151610.db2.gz	TVJYWKXEGFJVBK-UHFFFAOYSA-N	0	0	279.126	4.361	20	30		CIEDRN
CC(C)(C#N)CCCCN1CCc2c1c(F)ccc2F	ZINC000559289848	327155303	/nfs/dbraw/zinc/15/53/03/327155303.db2.gz	QQETXCDPAMPYFJ-UHFFFAOYSA-N	0	0	278.346	4.047	20	30		CIEDRN
CC[C@H](C)CSc1ccc(C(F)(F)F)c(C#N)n1	ZINC000409724469	327163711	/nfs/dbraw/zinc/16/37/11/327163711.db2.gz	XHRXETIIIDTCJN-QMMMGPOBSA-N	0	0	274.311	4.110	20	30		CIEDRN
C=CCCc1ccccc1NCc1cccc(C#N)c1	ZINC000409862182	327166223	/nfs/dbraw/zinc/16/62/23/327166223.db2.gz	NNRKCHBQBGHZEJ-UHFFFAOYSA-N	0	0	262.356	4.289	20	30		CIEDRN
C=CCCc1ccccc1NCc1ccc(C)nc1C	ZINC000409864230	327166353	/nfs/dbraw/zinc/16/63/53/327166353.db2.gz	LIIIISQAWWJKHL-UHFFFAOYSA-N	0	0	266.388	4.429	20	30		CIEDRN
C=CCCc1ccccc1NCc1csc(CC)n1	ZINC000409865914	327166467	/nfs/dbraw/zinc/16/64/67/327166467.db2.gz	UZJPIOVVFXCXOJ-UHFFFAOYSA-N	0	0	272.417	4.436	20	30		CIEDRN
COc1ccccc1[C@@H](C)Sc1snc(C)c1C#N	ZINC000569381505	327170324	/nfs/dbraw/zinc/17/03/24/327170324.db2.gz	IDWQMCFOGWGSFB-SNVBAGLBSA-N	0	0	290.413	4.185	20	30		CIEDRN
N#Cc1ccc(N2CCC[C@@H](Cc3ccccc3)C2)c(F)c1	ZINC000518507467	327170567	/nfs/dbraw/zinc/17/05/67/327170567.db2.gz	UMVMLAAWKPAAJA-KRWDZBQOSA-N	0	0	294.373	4.156	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1ccccc1Cc1ccccc1	ZINC000569384083	327171443	/nfs/dbraw/zinc/17/14/43/327171443.db2.gz	JYGNLOUSBBWWBT-OAHLLOKOSA-N	0	0	294.398	4.364	20	30		CIEDRN
CN(Cc1ccc(C#N)o1)Cc1c(Cl)cccc1Cl	ZINC000507110204	332787148	/nfs/dbraw/zinc/78/71/48/332787148.db2.gz	JMNWFTCYVXIJEC-UHFFFAOYSA-N	0	0	295.169	4.090	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1ccc2c(c1)COC2)c1ccccc1	ZINC000091673351	327175517	/nfs/dbraw/zinc/17/55/17/327175517.db2.gz	FURXYYUIUPDVCY-CQSZACIVSA-N	0	0	293.366	4.015	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)[C@@H](C)Sc1ccc(Cl)cc1	ZINC000410128667	327179939	/nfs/dbraw/zinc/17/99/39/327179939.db2.gz	UKULTSXZPYEQRR-DGCLKSJQSA-N	0	0	297.851	4.292	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@@H]1C[C@H]1c1c(F)cccc1Cl	ZINC000410130701	327180102	/nfs/dbraw/zinc/18/01/02/327180102.db2.gz	NHEYJEDZSRLHLY-QJPTWQEYSA-N	0	0	295.785	4.054	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1ccc(C2CCC2)cc1	ZINC000410146099	327181407	/nfs/dbraw/zinc/18/14/07/327181407.db2.gz	SXUMLVVNEDQTDH-MRXNPFEDSA-N	0	0	257.377	4.039	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1ccc(Cl)cn1	ZINC000410355206	327187317	/nfs/dbraw/zinc/18/73/17/327187317.db2.gz	QFLYHNDFLNHMOS-UHFFFAOYSA-N	0	0	286.762	4.106	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1ccccc1	ZINC000410377405	327188507	/nfs/dbraw/zinc/18/85/07/327188507.db2.gz	AYPOBEXHAMUMPE-UHFFFAOYSA-N	0	0	251.329	4.058	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1cc(F)ccc1OC	ZINC000410394020	327190063	/nfs/dbraw/zinc/19/00/63/327190063.db2.gz	SRIZVCYUDUZWNZ-UHFFFAOYSA-N	0	0	299.345	4.205	20	30		CIEDRN
CCOc1cc(C#N)ccc1OCCSc1ccccc1	ZINC000092260963	327190277	/nfs/dbraw/zinc/19/02/77/327190277.db2.gz	KSPHHABBHOOYTC-UHFFFAOYSA-N	0	0	299.395	4.128	20	30		CIEDRN
C=C(C)CCSCc1nc2ccccc2nc1C	ZINC000507117132	332787963	/nfs/dbraw/zinc/78/79/63/332787963.db2.gz	SVVSEUGAOMGLIZ-UHFFFAOYSA-N	0	0	258.390	4.138	20	30		CIEDRN
CCOC1CC(CSCCCCC(C)(C)C#N)C1	ZINC000507123290	332788827	/nfs/dbraw/zinc/78/88/27/332788827.db2.gz	YPDBYHROASITBN-UHFFFAOYSA-N	0	0	269.454	4.255	20	30		CIEDRN
C=CCCc1csc(-c2cnn(-c3ccccc3)c2)n1	ZINC000536389638	327234883	/nfs/dbraw/zinc/23/48/83/327234883.db2.gz	CVTSRFRKELBPAU-UHFFFAOYSA-N	0	0	281.384	4.114	20	30		CIEDRN
C=C[C@H](CC(=O)NCC1CCCCC1)c1ccccc1	ZINC000533882613	327235541	/nfs/dbraw/zinc/23/55/41/327235541.db2.gz	PKDRVTVIXSVAAS-MRXNPFEDSA-N	0	0	271.404	4.043	20	30		CIEDRN
C=C(C)CCSCc1ccc(S(=O)(=O)C(C)C)cc1	ZINC000507136020	332789975	/nfs/dbraw/zinc/78/99/75/332789975.db2.gz	WUPJKBNKGJATFP-UHFFFAOYSA-N	0	0	298.473	4.068	20	30		CIEDRN
CC[C@@H](C)[C@H]1CCCCN1C(=O)Nc1cc(C#N)ccc1C	ZINC000531080827	327240719	/nfs/dbraw/zinc/24/07/19/327240719.db2.gz	KDUWTRKNGRMZEJ-CXAGYDPISA-N	0	0	299.418	4.299	20	30		CIEDRN
CCCCCOc1c(Br)cccc1CC#N	ZINC000555956259	327250307	/nfs/dbraw/zinc/25/03/07/327250307.db2.gz	ZFKNAKRPRPRDHR-UHFFFAOYSA-N	0	0	282.181	4.084	20	30		CIEDRN
C=CCC[C@H]([NH2+]CC1(OCC)CCCC1)c1ccco1	ZINC000559893070	327268764	/nfs/dbraw/zinc/26/87/64/327268764.db2.gz	MXNUORMRENYOMW-HNNXBMFYSA-N	0	0	277.408	4.226	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2oc(C(C)C)nc2C)n1	ZINC000560008311	327276190	/nfs/dbraw/zinc/27/61/90/327276190.db2.gz	KDFQGUMCVIXCJW-UHFFFAOYSA-N	0	0	275.352	4.010	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ccc(F)cc2C)n1	ZINC000560021488	327277990	/nfs/dbraw/zinc/27/79/90/327277990.db2.gz	BTEFVEFZONTQEI-UHFFFAOYSA-N	0	0	260.312	4.038	20	30		CIEDRN
C=CCC(C)(C)c1nc(C2(c3ccccc3OC)CC2)no1	ZINC000560024784	327278119	/nfs/dbraw/zinc/27/81/19/327278119.db2.gz	MXEIXKORYMROCN-UHFFFAOYSA-N	0	0	298.386	4.012	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)[C@H](C)C(CC)CC)s1	ZINC000560097999	327284106	/nfs/dbraw/zinc/28/41/06/327284106.db2.gz	UJUOIUUPERZNCI-SNVBAGLBSA-N	0	0	278.421	4.193	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)c1ccc2c(c1)CCC=C2	ZINC000560101345	327284218	/nfs/dbraw/zinc/28/42/18/327284218.db2.gz	MFJWWQTUWOIBLG-UHFFFAOYSA-N	0	0	288.350	4.078	20	30		CIEDRN
C=CCCCC(=O)NC(C)(C)c1ccc(Cl)cc1	ZINC000560155425	327287351	/nfs/dbraw/zinc/28/73/51/327287351.db2.gz	BPETYKBZVCHOAZ-UHFFFAOYSA-N	0	0	265.784	4.048	20	30		CIEDRN
C=C(C)CCc1noc(-c2sc(C(C)C)nc2C)n1	ZINC000560457290	327309448	/nfs/dbraw/zinc/30/94/48/327309448.db2.gz	QUJRBIMGKCBPLX-UHFFFAOYSA-N	0	0	277.393	4.134	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(Cc2c(F)cccc2Cl)no1	ZINC000583346838	327312387	/nfs/dbraw/zinc/31/23/87/327312387.db2.gz	LDSUFBSUOUMUFV-HNNXBMFYSA-N	0	0	294.757	4.307	20	30		CIEDRN
Cc1ccc(CNc2c(C#N)cnc3ccccc32)s1	ZINC000050225670	327314052	/nfs/dbraw/zinc/31/40/52/327314052.db2.gz	VFKLGXMAGFTPRX-UHFFFAOYSA-N	0	0	279.368	4.089	20	30		CIEDRN
CCc1cc(NC(=O)c2cc(C#N)ccc2Cl)ccc1C	ZINC000560630752	327332171	/nfs/dbraw/zinc/33/21/71/327332171.db2.gz	VOXLYIJQFJKTAW-UHFFFAOYSA-N	0	0	298.773	4.335	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cc(Cl)ccc1F	ZINC000459866065	331302716	/nfs/dbraw/zinc/30/27/16/331302716.db2.gz	KMLGRNOPFUFZEL-UHFFFAOYSA-N	0	0	255.720	4.020	20	30		CIEDRN
N#Cc1cccc(C2(NC(=O)CC3CCCCCC3)CC2)c1	ZINC000560842131	327347397	/nfs/dbraw/zinc/34/73/97/327347397.db2.gz	QEVCMMGFOICLQB-UHFFFAOYSA-N	0	0	296.414	4.024	20	30		CIEDRN
C=CCCCC(=O)N1CCC(c2ccc(F)cc2C)CC1	ZINC000560941179	327353093	/nfs/dbraw/zinc/35/30/93/327353093.db2.gz	RRXUUZWAADVWHI-UHFFFAOYSA-N	0	0	289.394	4.196	20	30		CIEDRN
Cc1cc(N2CCC[C@H](c3ccccc3)CC2)cc(C#N)n1	ZINC000561188537	327372531	/nfs/dbraw/zinc/37/25/31/327372531.db2.gz	APZCGVDWBUNMJI-KRWDZBQOSA-N	0	0	291.398	4.036	20	30		CIEDRN
CC(=O)c1ccsc1NCc1ccc(Cl)cc1C#N	ZINC000427423921	327375078	/nfs/dbraw/zinc/37/50/78/327375078.db2.gz	IMXJUCPJKIUMBF-UHFFFAOYSA-N	0	0	290.775	4.088	20	30		CIEDRN
Cc1cc(-c2ccc(C#N)c(F)c2)nc2sccc21	ZINC000427457648	327380307	/nfs/dbraw/zinc/38/03/07/327380307.db2.gz	VECGMCANRCGECS-UHFFFAOYSA-N	0	0	268.316	4.283	20	30		CIEDRN
CCC[C@]1(C)CCCN(c2nccc(C#N)c2Cl)C1	ZINC000561263840	327380840	/nfs/dbraw/zinc/38/08/40/327380840.db2.gz	FTUPDNFZSVCWBH-OAHLLOKOSA-N	0	0	277.799	4.013	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H]1C[C@H]1c1cccc(Cl)c1	ZINC000150830741	327386611	/nfs/dbraw/zinc/38/66/11/327386611.db2.gz	JQTIYESCRQHAKN-JKSUJKDBSA-N	0	0	289.806	4.081	20	30		CIEDRN
N#Cc1ccc(Sc2ccc(Cl)c(Cl)c2)nc1	ZINC000088304032	327387649	/nfs/dbraw/zinc/38/76/49/327387649.db2.gz	ORMMVSTZIFYRCC-UHFFFAOYSA-N	0	0	281.167	4.411	20	30		CIEDRN
C=CCCSCC(=O)N(CC)[C@@H](C)c1ccc(F)cc1	ZINC000154969802	327388490	/nfs/dbraw/zinc/38/84/90/327388490.db2.gz	CCNJHEVJLPGCOP-ZDUSSCGKSA-N	0	0	295.423	4.045	20	30		CIEDRN
C[C@@H](c1c(F)cccc1F)N(C)Cc1ccccc1C#N	ZINC000507227122	332798805	/nfs/dbraw/zinc/79/88/05/332798805.db2.gz	CTWNBASRNXDFEE-LBPRGKRZSA-N	0	0	286.325	4.029	20	30		CIEDRN
C[C@@H]1C[C@H](c2ccccc2)N(c2ncc(C#N)cc2Cl)C1	ZINC000561447346	327395355	/nfs/dbraw/zinc/39/53/55/327395355.db2.gz	BKILDRQJWBJJSD-MLGOLLRUSA-N	0	0	297.789	4.194	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@@H](c2ccccc2)[C@@H](C)C1	ZINC000150911553	327398717	/nfs/dbraw/zinc/39/87/17/327398717.db2.gz	BMRAXKAYDOFGBX-QFBILLFUSA-N	0	0	297.442	4.407	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1c(C)cc(OC)c(C)c1C	ZINC000561711935	327412914	/nfs/dbraw/zinc/41/29/14/327412914.db2.gz	ISOQFFVUGPXBNO-UHFFFAOYSA-N	0	0	287.403	4.327	20	30		CIEDRN
C=CCC1(c2nc(-c3ccc(F)c(F)c3)no2)CCC1	ZINC000561915643	327430570	/nfs/dbraw/zinc/43/05/70/327430570.db2.gz	YQCFFOZKHOOFSF-UHFFFAOYSA-N	0	0	276.286	4.013	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H](C)[C@@H](C)c1ccccc1	ZINC000151177771	327451658	/nfs/dbraw/zinc/45/16/58/327451658.db2.gz	DNXPMVXSFXJGPP-CABCVRRESA-N	0	0	271.404	4.063	20	30		CIEDRN
C=CC[C@H](C)NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000247557463	327456282	/nfs/dbraw/zinc/45/62/82/327456282.db2.gz	UFPVLPBISGLAGP-ZMLRMANQSA-N	0	0	298.213	4.178	20	30		CIEDRN
N#CC1(CNCc2ccc(Oc3cccc(F)c3)cc2)CC1	ZINC000562392189	327478156	/nfs/dbraw/zinc/47/81/56/327478156.db2.gz	XEMRVORKSHYOJO-UHFFFAOYSA-N	0	0	296.345	4.011	20	30		CIEDRN
C=CCCCCNc1cccc(-c2ncco2)c1C	ZINC000562562797	327492399	/nfs/dbraw/zinc/49/23/99/327492399.db2.gz	QVTMCAPVDAAISK-UHFFFAOYSA-N	0	0	256.349	4.418	20	30		CIEDRN
CCCC[C@H](CC)C(=O)N[C@@H](C#N)c1ccc(CC)cc1	ZINC000569852572	327552196	/nfs/dbraw/zinc/55/21/96/327552196.db2.gz	MSUMYSLQOVMSBU-RDJZCZTQSA-N	0	0	286.419	4.146	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CCC(C)(C2CC2)CC1)c1ccccc1	ZINC000569864790	327552560	/nfs/dbraw/zinc/55/25/60/327552560.db2.gz	REZWHVREGAPSCM-INIZCTEOSA-N	0	0	297.442	4.385	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1cc(C2CC2)ccn1)c1ccccc1	ZINC000569894904	327554923	/nfs/dbraw/zinc/55/49/23/327554923.db2.gz	GFOJKIYUEXNXDR-QGZVFWFLSA-N	0	0	292.382	4.257	20	30		CIEDRN
C=CCCc1csc(-c2cc(F)ccc2F)n1	ZINC000569895797	327554967	/nfs/dbraw/zinc/55/49/67/327554967.db2.gz	UWQMFONFTCTANO-UHFFFAOYSA-N	0	0	251.301	4.207	20	30		CIEDRN
CC(C)c1nc([C@@H](C)NCc2ccc(CC#N)cc2)cs1	ZINC000570024027	327563114	/nfs/dbraw/zinc/56/31/14/327563114.db2.gz	GGJKTMPQJDFICO-CYBMUJFWSA-N	0	0	299.443	4.183	20	30		CIEDRN
Cc1csc(NC(=O)C[C@H]2CCC[C@H](C)C2)c1C#N	ZINC000570078596	327567970	/nfs/dbraw/zinc/56/79/70/327567970.db2.gz	UUJMMDSZBCSCLL-JQWIXIFHSA-N	0	0	276.405	4.083	20	30		CIEDRN
C=CCCCNC(=O)N1CC=C(c2cc(C)cc(C)c2)CC1	ZINC000570172025	327574006	/nfs/dbraw/zinc/57/40/06/327574006.db2.gz	FWXSZIORXLOHKW-UHFFFAOYSA-N	0	0	298.430	4.068	20	30		CIEDRN
Cc1nsc(Oc2ccc(Cl)cc2Cl)c1C#N	ZINC000570193958	327575189	/nfs/dbraw/zinc/57/51/89/327575189.db2.gz	KYQOVLOPZWQERN-UHFFFAOYSA-N	0	0	285.155	4.422	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(Cc2ccc(C)s2)no1	ZINC000570435550	327591024	/nfs/dbraw/zinc/59/10/24/327591024.db2.gz	WHNIUFUVRLSPIF-JTQLQIEISA-N	0	0	262.378	4.100	20	30		CIEDRN
C=CCOc1ccccc1CN[C@@H](C)c1ncccc1CC	ZINC000507507764	332810546	/nfs/dbraw/zinc/81/05/46/332810546.db2.gz	ITRBENHIGNDVRA-HNNXBMFYSA-N	0	0	296.414	4.060	20	30		CIEDRN
C=CCOc1ccccc1CN[C@H](C)c1ncccc1CC	ZINC000507507766	332810679	/nfs/dbraw/zinc/81/06/79/332810679.db2.gz	ITRBENHIGNDVRA-OAHLLOKOSA-N	0	0	296.414	4.060	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)c1cc[nH]c1C(C)C	ZINC000570705790	327612428	/nfs/dbraw/zinc/61/24/28/327612428.db2.gz	JSZRIQJXJNBRCC-UHFFFAOYSA-N	0	0	296.414	4.357	20	30		CIEDRN
Cc1cc(C)cc([C@H](C)Nc2cccc(F)c2C#N)c1	ZINC000113412428	328616286	/nfs/dbraw/zinc/61/62/86/328616286.db2.gz	VHGOOZLNWBSNNL-ZDUSSCGKSA-N	0	0	268.335	4.487	20	30		CIEDRN
N#Cc1cc(NCc2ccc(C(F)(F)F)cc2)ccc1F	ZINC000051635231	328626512	/nfs/dbraw/zinc/62/65/12/328626512.db2.gz	CCIXZWLJGXKKJE-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
N#Cc1cc(NCc2ccc(Cl)c(F)c2)ccc1F	ZINC000051636255	328626555	/nfs/dbraw/zinc/62/65/55/328626555.db2.gz	OVTBBRKCHXSTMN-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
Cc1ccc(NCc2ccccc2C#N)cc1C(F)(F)F	ZINC000052076743	328638740	/nfs/dbraw/zinc/63/87/40/328638740.db2.gz	SRVLICVMFDJGKE-UHFFFAOYSA-N	0	0	290.288	4.498	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)N1CCC[C@@H](C(C)(C)C)CC1)OCC	ZINC000535890055	328646250	/nfs/dbraw/zinc/64/62/50/328646250.db2.gz	WLSFRHCLEREXHC-HZPDHXFCSA-N	0	0	295.467	4.033	20	30		CIEDRN
N#Cc1ccccc1/C=C\c1nc2ccccc2s1	ZINC000535912086	328647693	/nfs/dbraw/zinc/64/76/93/328647693.db2.gz	XLLKFHYHNUDOBS-KTKRTIGZSA-N	0	0	262.337	4.338	20	30		CIEDRN
C=C[C@H](CC(=O)NCc1ccccc1Cl)c1ccccc1	ZINC000536084378	328655650	/nfs/dbraw/zinc/65/56/50/328655650.db2.gz	ILNWSSJBZDVUOJ-CQSZACIVSA-N	0	0	299.801	4.316	20	30		CIEDRN
C=CCSc1ccccc1C(=O)NC[C@H]1CCC[C@H]1C	ZINC000536093490	328656331	/nfs/dbraw/zinc/65/63/31/328656331.db2.gz	SRBSQUIMQSPXRK-ZIAGYGMSSA-N	0	0	289.444	4.131	20	30		CIEDRN
CC1(C)CCC[C@H](c2noc(Cc3ccc(C#N)cc3)n2)C1	ZINC000536143201	328658280	/nfs/dbraw/zinc/65/82/80/328658280.db2.gz	WHVVNHWSLGKCKI-HNNXBMFYSA-N	0	0	295.386	4.216	20	30		CIEDRN
C[C@@H](NC(=O)c1ccc(CC#N)cc1)[C@H](C)C1CCCCC1	ZINC000536174352	328660007	/nfs/dbraw/zinc/66/00/07/328660007.db2.gz	WAJFRWYOIYMUJK-LSDHHAIUSA-N	0	0	298.430	4.087	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1ccccc1C(C)=O)c1ccccc1	ZINC000536219003	328662036	/nfs/dbraw/zinc/66/20/36/328662036.db2.gz	FITAPRDTLXDFIF-HNNXBMFYSA-N	0	0	293.366	4.188	20	30		CIEDRN
N#CCN(Cc1ccc(-c2ccccc2)o1)C1CCCC1	ZINC000536662966	328675257	/nfs/dbraw/zinc/67/52/57/328675257.db2.gz	NENPCTFRLHUQHW-UHFFFAOYSA-N	0	0	280.371	4.215	20	30		CIEDRN
C=C(C)CN(CC)C(=O)C[C@@H](C)Cc1ccc(Cl)cc1	ZINC000536753459	328689986	/nfs/dbraw/zinc/68/99/86/328689986.db2.gz	YSLVSRXNNROAFX-AWEZNQCLSA-N	0	0	293.838	4.333	20	30		CIEDRN
C=C(C)CN(CC)C(=O)C[C@H](c1ccccc1)C(F)(F)F	ZINC000102983368	328716232	/nfs/dbraw/zinc/71/62/32/328716232.db2.gz	YDKKQNHAOOVORB-CQSZACIVSA-N	0	0	299.336	4.147	20	30		CIEDRN
CC[C@H]1CC[C@H](C)N1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000336472007	328755545	/nfs/dbraw/zinc/75/55/45/328755545.db2.gz	QWWGJZHBRMITOR-BBRMVZONSA-N	0	0	299.418	4.283	20	30		CIEDRN
CC[C@H](CC(=O)Nc1ccccc1C#N)c1ccccc1	ZINC000103357498	328767838	/nfs/dbraw/zinc/76/78/38/328767838.db2.gz	WFUSKHZQZZNANJ-CQSZACIVSA-N	0	0	278.355	4.081	20	30		CIEDRN
CC[C@@H](CC(=O)Nc1ccccc1C#N)c1ccccc1	ZINC000103357497	328767885	/nfs/dbraw/zinc/76/78/85/328767885.db2.gz	WFUSKHZQZZNANJ-AWEZNQCLSA-N	0	0	278.355	4.081	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)[C@@H]1CCCc2ccccc21	ZINC000532333880	328770347	/nfs/dbraw/zinc/77/03/47/328770347.db2.gz	AKIYDDUOKGJFFI-GOSISDBHSA-N	0	0	283.415	4.291	20	30		CIEDRN
CCOc1ccccc1CSc1cccc(C#N)c1	ZINC000532344843	328772962	/nfs/dbraw/zinc/77/29/62/328772962.db2.gz	RVGZAUQURRIZLP-UHFFFAOYSA-N	0	0	269.369	4.249	20	30		CIEDRN
CCc1cccc(NC(=O)N[C@H](C)c2ccc(C#N)cc2)c1	ZINC000043333232	328786869	/nfs/dbraw/zinc/78/68/69/328786869.db2.gz	MUVJLMWUBSMWFR-CYBMUJFWSA-N	0	0	293.370	4.003	20	30		CIEDRN
C=CCN(C(=O)c1cc(C)ccc1C)c1ccccc1	ZINC000104797009	328808650	/nfs/dbraw/zinc/80/86/50/328808650.db2.gz	MYGQMXOYYGTASR-UHFFFAOYSA-N	0	0	265.356	4.136	20	30		CIEDRN
CN(C(=O)CC1CCC(C)(C)CC1)c1cccc(C#N)c1	ZINC000532780754	328810284	/nfs/dbraw/zinc/81/02/84/328810284.db2.gz	XNJLASYZCCDCQK-UHFFFAOYSA-N	0	0	284.403	4.128	20	30		CIEDRN
C=C(C)CCS[C@H]1CCN(c2ccccc2Cl)C1=O	ZINC000507804041	332824535	/nfs/dbraw/zinc/82/45/35/332824535.db2.gz	MTICTERBQAEKCI-AWEZNQCLSA-N	0	0	295.835	4.145	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)C[C@H](C)COC	ZINC000356201349	328860985	/nfs/dbraw/zinc/86/09/85/328860985.db2.gz	IJIITYPZRXTYJJ-AWEZNQCLSA-N	0	0	289.419	4.150	20	30		CIEDRN
C=C(C)CCS[C@H](C)C(=O)N(CC)C1CCCCC1	ZINC000507817818	332826208	/nfs/dbraw/zinc/82/62/08/332826208.db2.gz	HGBAYLVRPGLJNE-CQSZACIVSA-N	0	0	283.481	4.256	20	30		CIEDRN
C=C(C)CCS[C@H](C)C(=O)N[C@@H](C)c1ccc(F)cc1	ZINC000507836356	332827234	/nfs/dbraw/zinc/82/72/34/332827234.db2.gz	LFXPHXFQFUHKLW-QWHCGFSZSA-N	0	0	295.423	4.091	20	30		CIEDRN
C=C(C)CCS[C@@H](C)C(=O)N(CC)Cc1ccccc1	ZINC000507875288	332828627	/nfs/dbraw/zinc/82/86/27/332828627.db2.gz	PFAHEWVGPCRAOB-HNNXBMFYSA-N	0	0	291.460	4.123	20	30		CIEDRN
C=C(C)CCSCC(=O)Nc1ccc(C)c(Cl)c1	ZINC000507873963	332828629	/nfs/dbraw/zinc/82/86/29/332828629.db2.gz	LRBMOWJTEVSMMR-UHFFFAOYSA-N	0	0	283.824	4.286	20	30		CIEDRN
C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)CCCC#N	ZINC000359986572	328900911	/nfs/dbraw/zinc/90/09/11/328900911.db2.gz	SEKNMCNQMRXDQK-JTQLQIEISA-N	0	0	299.201	4.207	20	30		CIEDRN
Cc1cc(NC(=O)c2ccc(C#N)cc2)cc(C)c1Cl	ZINC000508072022	332833225	/nfs/dbraw/zinc/83/32/25/332833225.db2.gz	PMYDGFNRJLGQAO-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1cccc(C)c1Cl	ZINC000580397122	328931017	/nfs/dbraw/zinc/93/10/17/328931017.db2.gz	SBGOISDCPYBQHR-LLVKDONJSA-N	0	0	266.772	4.125	20	30		CIEDRN
C=CCC(CC=C)C(=O)NC(C)(C)c1ccccc1C	ZINC000507993061	332831010	/nfs/dbraw/zinc/83/10/10/332831010.db2.gz	NIAKZVHTOMUKCW-UHFFFAOYSA-N	0	0	271.404	4.115	20	30		CIEDRN
CC(C)(c1nc(C2CCCC2)no1)c1cc(F)cc(C#N)c1	ZINC000507998231	332831286	/nfs/dbraw/zinc/83/12/86/332831286.db2.gz	JOQAPSQILDKHCJ-UHFFFAOYSA-N	0	0	299.349	4.064	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCCC[C@@H]1c1ncc(C)s1	ZINC000375102565	329000484	/nfs/dbraw/zinc/00/04/84/329000484.db2.gz	AGIPVUSYLSPWHF-TZMCWYRMSA-N	0	0	292.448	4.107	20	30		CIEDRN
Cc1csc(NC(=O)[C@@H](C)CC2CCCC2)c1C#N	ZINC000582445413	329002642	/nfs/dbraw/zinc/00/26/42/329002642.db2.gz	RVKNRVPQTHDVML-JTQLQIEISA-N	0	0	276.405	4.083	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@@H](c2csc(C)c2)C1	ZINC000375377637	329003002	/nfs/dbraw/zinc/00/30/02/329003002.db2.gz	NLYOQWMPDWBSEC-OAHLLOKOSA-N	0	0	289.444	4.141	20	30		CIEDRN
N#CCCCCSc1nnc(CCC2CCCCC2)o1	ZINC000122594443	329004129	/nfs/dbraw/zinc/00/41/29/329004129.db2.gz	GGGNJNABRNJBFA-UHFFFAOYSA-N	0	0	293.436	4.368	20	30		CIEDRN
C[C@@H](Nc1cccc(-c2cnco2)c1)c1ccc(C#N)cc1	ZINC000193910277	329063697	/nfs/dbraw/zinc/06/36/97/329063697.db2.gz	GBDSSJQRLVXNHX-CYBMUJFWSA-N	0	0	289.338	4.386	20	30		CIEDRN
C[C@H](Nc1cccc(-c2cnco2)c1)c1ccc(C#N)cc1	ZINC000193910263	329063839	/nfs/dbraw/zinc/06/38/39/329063839.db2.gz	GBDSSJQRLVXNHX-ZDUSSCGKSA-N	0	0	289.338	4.386	20	30		CIEDRN
CC(C)[C@H](C)CC(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000171408942	329075553	/nfs/dbraw/zinc/07/55/53/329075553.db2.gz	LBDNPBPYIFIKFL-CYBMUJFWSA-N	0	0	272.392	4.108	20	30		CIEDRN
C=C(C)CCc1noc(C(C)(C)c2ccccc2C)n1	ZINC000508595402	332842729	/nfs/dbraw/zinc/84/27/29/332842729.db2.gz	NINNTPDWKPSUGL-UHFFFAOYSA-N	0	0	270.376	4.213	20	30		CIEDRN
C=C(C)CCc1noc(C/C=C\c2ccc(C)cc2)n1	ZINC000508593925	332842744	/nfs/dbraw/zinc/84/27/44/332842744.db2.gz	HLMODHWNGWLHEZ-PLNGDYQASA-N	0	0	268.360	4.143	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1cc(C2CC2)ccn1)c1ccccc1	ZINC000582758695	329147221	/nfs/dbraw/zinc/14/72/21/329147221.db2.gz	GIWRQAIKUFBIPS-AWEZNQCLSA-N	0	0	292.382	4.257	20	30		CIEDRN
C=C(C)CCc1noc(C[C@@H](C)c2ccccc2C)n1	ZINC000508607706	332843644	/nfs/dbraw/zinc/84/36/44/332843644.db2.gz	BXESOIGLYNUGPA-CQSZACIVSA-N	0	0	270.376	4.233	20	30		CIEDRN
C=CCCS[C@@H](C)c1nc(Cc2ccccc2)no1	ZINC000173834003	329152384	/nfs/dbraw/zinc/15/23/84/329152384.db2.gz	RWOFZIKZVCBCNF-LBPRGKRZSA-N	0	0	274.389	4.031	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@H]1c1ccccc1C	ZINC000175373732	329164713	/nfs/dbraw/zinc/16/47/13/329164713.db2.gz	KLXBYNWJNKLULI-INIZCTEOSA-N	0	0	257.377	4.015	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](CC)c1ccccc1OC(F)F	ZINC000175276463	329167123	/nfs/dbraw/zinc/16/71/23/329167123.db2.gz	JFQDJWMEEIIGGG-ZDUSSCGKSA-N	0	0	297.345	4.212	20	30		CIEDRN
C=CCCCC(=O)N1C[C@@H](C)C[C@H]1c1cccc(F)c1	ZINC000175964740	329170748	/nfs/dbraw/zinc/17/07/48/329170748.db2.gz	KVNCDOUMSNMQML-BBRMVZONSA-N	0	0	275.367	4.092	20	30		CIEDRN
C=CCCCC(=O)N1C[C@@H](C)C[C@H]1c1ccccc1F	ZINC000176008064	329173143	/nfs/dbraw/zinc/17/31/43/329173143.db2.gz	MJSIKFPYMIRFRD-BBRMVZONSA-N	0	0	275.367	4.092	20	30		CIEDRN
C=CCCCC(=O)N[C@H](C)c1ccc(-c2ccncc2)cc1	ZINC000176322677	329174797	/nfs/dbraw/zinc/17/47/97/329174797.db2.gz	DKWMVMCBMSUUNT-OAHLLOKOSA-N	0	0	294.398	4.282	20	30		CIEDRN
C=C(C)CCc1noc(CSCc2cccc(C)c2)n1	ZINC000508631347	332845300	/nfs/dbraw/zinc/84/53/00/332845300.db2.gz	JUJATNTXSSFXCZ-UHFFFAOYSA-N	0	0	288.416	4.320	20	30		CIEDRN
C=CCCCC(=O)N(C)[C@@H](c1ccccc1)C(F)(F)F	ZINC000177820625	329187128	/nfs/dbraw/zinc/18/71/28/329187128.db2.gz	MAUAWXGVQDRYHA-AWEZNQCLSA-N	0	0	285.309	4.105	20	30		CIEDRN
C=CCCCC(=O)Nc1cc(C)ccc1Br	ZINC000179300847	329207141	/nfs/dbraw/zinc/20/71/41/329207141.db2.gz	IYROYMLVPBARRY-UHFFFAOYSA-N	0	0	282.181	4.052	20	30		CIEDRN
C=CCCCC(=O)N1CC=C(c2ccc(OCC)cc2)CC1	ZINC000179779903	329207652	/nfs/dbraw/zinc/20/76/52/329207652.db2.gz	JFOFCPKNFFYFIY-UHFFFAOYSA-N	0	0	299.414	4.057	20	30		CIEDRN
C=CCCCCC[N@H+]1C[C@H](C2CCCCC2)C[C@H]1C(=O)[O-]	ZINC000582796809	329208843	/nfs/dbraw/zinc/20/88/43/329208843.db2.gz	AOPNWOXNXYXQRF-SJORKVTESA-N	0	0	293.451	4.088	20	30		CIEDRN
C=C(C)CCc1noc(COc2ccc(Cl)cc2C)n1	ZINC000508665462	332846658	/nfs/dbraw/zinc/84/66/58/332846658.db2.gz	LZAGCQNVSXXBJG-UHFFFAOYSA-N	0	0	292.766	4.119	20	30		CIEDRN
C=C(C)CCc1noc(-c2ccc(C(F)(F)F)cc2)n1	ZINC000508663756	332846670	/nfs/dbraw/zinc/84/66/70/332846670.db2.gz	QJAXDBWYNVXTRE-UHFFFAOYSA-N	0	0	282.265	4.264	20	30		CIEDRN
C#CCCCCC(=O)N[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000179643631	329210419	/nfs/dbraw/zinc/21/04/19/329210419.db2.gz	ZOOVFWVEVWMBTI-LBPRGKRZSA-N	0	0	297.320	4.076	20	30		CIEDRN
C=C[C@@H](Cc1nc(CCC(=C)C)no1)c1ccccc1	ZINC000508679200	332847074	/nfs/dbraw/zinc/84/70/74/332847074.db2.gz	MJCVBHBDPWAXGA-AWEZNQCLSA-N	0	0	268.360	4.091	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc(C2CCC2)cc1	ZINC000508688200	332847553	/nfs/dbraw/zinc/84/75/53/332847553.db2.gz	GYJUHSYWLPKIII-UHFFFAOYSA-N	0	0	257.377	4.495	20	30		CIEDRN
C=C(C)CCc1noc([C@H](C)OC2CCCCCC2)n1	ZINC000508687259	332847593	/nfs/dbraw/zinc/84/75/93/332847593.db2.gz	SAOZHJKXSZBHQK-ZDUSSCGKSA-N	0	0	278.396	4.379	20	30		CIEDRN
C[C@@H]1CC(C(=O)N[C@@H](CCC#N)c2ccccc2)C[C@@H](C)C1	ZINC000181159693	329233061	/nfs/dbraw/zinc/23/30/61/329233061.db2.gz	ZOACAZBBEPGJCW-MPGHIAIKSA-N	0	0	298.430	4.220	20	30		CIEDRN
COc1cc(-c2ccccc2)ccc1CN(C)[C@@H](C)CC#N	ZINC000183420490	329247568	/nfs/dbraw/zinc/24/75/68/329247568.db2.gz	MLXATAUYLRDINJ-HNNXBMFYSA-N	0	0	294.398	4.096	20	30		CIEDRN
N#Cc1cnc2ccccc2c1N[C@@H]1CCc2ccccc2C1	ZINC000321097614	329258939	/nfs/dbraw/zinc/25/89/39/329258939.db2.gz	LNVXAVFMPWNBIZ-QGZVFWFLSA-N	0	0	299.377	4.076	20	30		CIEDRN
N#CCc1ccc(NCc2cccc(-c3cccnc3)c2)cc1	ZINC000185144106	329266627	/nfs/dbraw/zinc/26/66/27/329266627.db2.gz	ORJFIIFBRHWSMC-UHFFFAOYSA-N	0	0	299.377	4.427	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCc1oc2ccc(F)cc2c1C	ZINC000185271333	329269893	/nfs/dbraw/zinc/26/98/93/329269893.db2.gz	AXLAZKFOIPZNCB-LLVKDONJSA-N	0	0	289.350	4.099	20	30		CIEDRN
CC(C)c1c(N[C@@H]2CC[C@H](C#N)C2)cnn1-c1ccccc1	ZINC000582884042	329285170	/nfs/dbraw/zinc/28/51/70/329285170.db2.gz	YMCFSNDZZWXPLY-LSDHHAIUSA-N	0	0	294.402	4.100	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(CSCc2ccccc2)no1	ZINC000582931067	329286219	/nfs/dbraw/zinc/28/62/19/329286219.db2.gz	GDJDJFHXRGIKNO-INIZCTEOSA-N	0	0	288.416	4.357	20	30		CIEDRN
CCC[C@H](C)[C@H]1CCCN1c1nccc(C#N)c1Cl	ZINC000582921472	329289004	/nfs/dbraw/zinc/28/90/04/329289004.db2.gz	CJVYUHYWLPSSTB-WCQYABFASA-N	0	0	277.799	4.012	20	30		CIEDRN
Cc1ccccc1[C@@H]1C[C@H](C)N(c2cccc(F)c2C#N)C1	ZINC000582992149	329294390	/nfs/dbraw/zinc/29/43/90/329294390.db2.gz	WMILTQWPKHUIRD-LSDHHAIUSA-N	0	0	294.373	4.388	20	30		CIEDRN
Cc1ccccc1[C@H]1C[C@@H](C)N(c2cccc(F)c2C#N)C1	ZINC000582992146	329294487	/nfs/dbraw/zinc/29/44/87/329294487.db2.gz	WMILTQWPKHUIRD-CABCVRRESA-N	0	0	294.373	4.388	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2ccccc2OC(F)F)no1	ZINC000583050550	329303821	/nfs/dbraw/zinc/30/38/21/329303821.db2.gz	WYZSIPKUYRQCSR-SNVBAGLBSA-N	0	0	294.301	4.408	20	30		CIEDRN
C=CC1CCN(C(=O)c2cc3cc(C)ccc3s2)CC1	ZINC000583054123	329304013	/nfs/dbraw/zinc/30/40/13/329304013.db2.gz	GHEDODGEFFYXBT-UHFFFAOYSA-N	0	0	285.412	4.248	20	30		CIEDRN
C=C(C)CCc1noc(/C=C/c2ccc(F)c(F)c2)n1	ZINC000584377513	329306758	/nfs/dbraw/zinc/30/67/58/329306758.db2.gz	SHNQWLKILKELDT-VMPITWQZSA-N	0	0	276.286	4.027	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)N(C)c2ccccc2)c1	ZINC000583182268	329347564	/nfs/dbraw/zinc/34/75/64/329347564.db2.gz	FZWDAGWTSJEACV-UHFFFAOYSA-N	0	0	296.370	4.310	20	30		CIEDRN
CCCCCCCCC(=O)N1CCC([C@@H]2CCCO2)CC1	ZINC000187498608	329358278	/nfs/dbraw/zinc/35/82/78/329358278.db2.gz	GREWVSUALMVTII-KRWDZBQOSA-N	0	0	295.467	4.155	20	30		CIEDRN
C=CCC1(C(=O)N[C@H](C)c2cc(C)sc2C)CCC1	ZINC000188405041	329368594	/nfs/dbraw/zinc/36/85/94/329368594.db2.gz	DJEUHWOSNWNXIS-GFCCVEGCSA-N	0	0	277.433	4.289	20	30		CIEDRN
C=C(C)CCN[C@H](c1c(F)cccc1F)C(F)(F)F	ZINC000509021192	332856169	/nfs/dbraw/zinc/85/61/69/332856169.db2.gz	JBRRUBLLYZKIRA-GFCCVEGCSA-N	0	0	279.252	4.124	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)CCCOCC	ZINC000189888250	329388590	/nfs/dbraw/zinc/38/85/90/329388590.db2.gz	REJLWGKUKAGJRF-UHFFFAOYSA-N	0	0	289.419	4.294	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)CC[C@H](C)OC	ZINC000189896415	329388982	/nfs/dbraw/zinc/38/89/82/329388982.db2.gz	IELMZDCHMUSTAW-AWEZNQCLSA-N	0	0	289.419	4.292	20	30		CIEDRN
C=CCNC(=O)Nc1c(CCC)cccc1C(C)C	ZINC000189967800	329389884	/nfs/dbraw/zinc/38/98/84/329389884.db2.gz	RIKIXQMUZKZRRU-UHFFFAOYSA-N	0	0	260.381	4.070	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(-c3ncco3)cc2)CCC1	ZINC000189906112	329389942	/nfs/dbraw/zinc/38/99/42/329389942.db2.gz	QUUBQZGYHKWZPA-UHFFFAOYSA-N	0	0	282.343	4.027	20	30		CIEDRN
C=CCC1(C(=O)N(CC)Cc2c[nH]c3ccccc23)CCC1	ZINC000190802140	329402775	/nfs/dbraw/zinc/40/27/75/329402775.db2.gz	WSFJMTLWQUMHKM-UHFFFAOYSA-N	0	0	296.414	4.263	20	30		CIEDRN
N#CCCCSCc1ccc(F)c(Br)c1	ZINC000190918032	329402948	/nfs/dbraw/zinc/40/29/48/329402948.db2.gz	QKZVHCRJQXUVEM-UHFFFAOYSA-N	0	0	288.185	4.125	20	30		CIEDRN
CCN(C(=O)c1cccc(C#N)c1C)c1ccccc1Cl	ZINC000509080325	332858457	/nfs/dbraw/zinc/85/84/57/332858457.db2.gz	HRGGEHPMQRLEDA-UHFFFAOYSA-N	0	0	298.773	4.187	20	30		CIEDRN
C=CCC1(C(=O)N(Cc2cccc(F)c2)C2CC2)CCC1	ZINC000191867041	329424248	/nfs/dbraw/zinc/42/42/48/329424248.db2.gz	LMPNFSCKPCGMJF-UHFFFAOYSA-N	0	0	287.378	4.063	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H](CC)c2ccc(OC)cc2)CCC1	ZINC000191852935	329424351	/nfs/dbraw/zinc/42/43/51/329424351.db2.gz	OCLMOBJNLRSAKF-INIZCTEOSA-N	0	0	287.403	4.009	20	30		CIEDRN
CC(C)c1cnc(NCc2c(F)cc(C#N)cc2F)s1	ZINC000192755600	329435906	/nfs/dbraw/zinc/43/59/06/329435906.db2.gz	FOCWUKFTSLISSR-UHFFFAOYSA-N	0	0	293.342	4.028	20	30		CIEDRN
Cc1ccc2cccc(OCc3ccc(CC#N)cc3)c2n1	ZINC000398988269	329446974	/nfs/dbraw/zinc/44/69/74/329446974.db2.gz	JLVNIOOCPXCOMH-UHFFFAOYSA-N	0	0	288.350	4.188	20	30		CIEDRN
N#CCc1ccc(CNc2ccc(F)c(Cl)c2)cc1	ZINC000399126666	329448466	/nfs/dbraw/zinc/44/84/66/329448466.db2.gz	SREQKGYSIRXNKW-UHFFFAOYSA-N	0	0	274.726	4.157	20	30		CIEDRN
N#CCc1ccc(COc2ccc(Cl)c(F)c2)cc1	ZINC000399121207	329448475	/nfs/dbraw/zinc/44/84/75/329448475.db2.gz	IBNLTRYUWXOPIC-UHFFFAOYSA-N	0	0	275.710	4.124	20	30		CIEDRN
COc1ccc(SCc2ccc(CC#N)cc2)cc1	ZINC000399134020	329448679	/nfs/dbraw/zinc/44/86/79/329448679.db2.gz	PMFAKYODBDXZHG-UHFFFAOYSA-N	0	0	269.369	4.054	20	30		CIEDRN
C=CCCO[C@@H](C)C(=O)N(c1ccc(Cl)cc1)C(C)C	ZINC000509156311	332860505	/nfs/dbraw/zinc/86/05/05/332860505.db2.gz	LCNVVLMUQSGILT-ZDUSSCGKSA-N	0	0	295.810	4.063	20	30		CIEDRN
Cc1nsc(S[C@H](C)c2ccc(F)cc2)c1C#N	ZINC000584550961	329520751	/nfs/dbraw/zinc/52/07/51/329520751.db2.gz	OCUPOEIQLXVJRC-SECBINFHSA-N	0	0	278.377	4.316	20	30		CIEDRN
Cc1c(C#N)cccc1C(=O)Nc1cccc2ccsc21	ZINC000509282661	332863630	/nfs/dbraw/zinc/86/36/30/332863630.db2.gz	CFWHQLAVYCJMCU-UHFFFAOYSA-N	0	0	292.363	4.334	20	30		CIEDRN
CS[C@H]1CCC[C@@H](Nc2nc(C)c(C#N)cc2Cl)C1	ZINC000311600035	329540327	/nfs/dbraw/zinc/54/03/27/329540327.db2.gz	STNSBMYXCDUOIN-NEPJUHHUSA-N	0	0	295.839	4.001	20	30		CIEDRN
CCC(C)(C)C1CCC(NC(=O)C2(C#N)CCCC2)CC1	ZINC000105143239	329546579	/nfs/dbraw/zinc/54/65/79/329546579.db2.gz	ZGVSSSJLAHIUIQ-UHFFFAOYSA-N	0	0	290.451	4.182	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@H](CC(C)(C)C)C(F)(F)F	ZINC000424787985	329588492	/nfs/dbraw/zinc/58/84/92/329588492.db2.gz	NMIHEESEGXMLJX-SNVBAGLBSA-N	0	0	279.346	4.072	20	30		CIEDRN
CCOc1cc(C#N)ccc1OCCC1(C#N)CCCCC1	ZINC000418825765	329592696	/nfs/dbraw/zinc/59/26/96/329592696.db2.gz	PQCKZTXWMGQSRV-UHFFFAOYSA-N	0	0	298.386	4.200	20	30		CIEDRN
C[C@@H](c1cccc(C#N)c1)N(C)C(=O)[C@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000425108182	329595340	/nfs/dbraw/zinc/59/53/40/329595340.db2.gz	KMWSKQDYMNKIDP-LLDVTBCESA-N	0	0	298.430	4.150	20	30		CIEDRN
C[C@@H](c1cccc(C#N)c1)N(C)C(=O)[C@H]1CC12CCCCC2	ZINC000425119907	329597606	/nfs/dbraw/zinc/59/76/06/329597606.db2.gz	AJBMOBJXPIIBBZ-WMLDXEAASA-N	0	0	296.414	4.048	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1cccc2ccc(C)nc21	ZINC000127434823	329599842	/nfs/dbraw/zinc/59/98/42/329599842.db2.gz	UDRDQXQHEHDCLT-UHFFFAOYSA-N	0	0	296.414	4.362	20	30		CIEDRN
CSCCc1ccc(NCc2cc(C#N)cs2)cc1	ZINC000129089738	329614447	/nfs/dbraw/zinc/61/44/47/329614447.db2.gz	CHOMQZRAZZHSNB-UHFFFAOYSA-N	0	0	288.441	4.137	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)[C@H]1CCC[C@H](F)C1	ZINC000424805548	329616258	/nfs/dbraw/zinc/61/62/58/329616258.db2.gz	BGTJXRCBDNHQQR-IRXDYDNUSA-N	0	0	289.394	4.120	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@@H]1CC[C@H](c2ccc(F)cc2)C1	ZINC000424807021	329616702	/nfs/dbraw/zinc/61/67/02/329616702.db2.gz	DVBVNXURYAQQRH-GOEBONIOSA-N	0	0	289.394	4.180	20	30		CIEDRN
C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@@H]1CC1(C)C	ZINC000129339043	329616845	/nfs/dbraw/zinc/61/68/45/329616845.db2.gz	NRCDSXQZRNUPNL-RYUDHWBXSA-N	0	0	288.416	4.065	20	30		CIEDRN
Cc1cnc(-c2cccc(NCc3ccc(C#N)s3)c2)o1	ZINC000131084381	329631423	/nfs/dbraw/zinc/63/14/23/329631423.db2.gz	LFIWIOBVSDIQOB-UHFFFAOYSA-N	0	0	295.367	4.195	20	30		CIEDRN
CC(C)(CCC#N)CNC(=O)Nc1ccccc1C(F)F	ZINC000425698985	329648115	/nfs/dbraw/zinc/64/81/15/329648115.db2.gz	HCWYQFVTFDARAY-UHFFFAOYSA-N	0	0	295.333	4.076	20	30		CIEDRN
N#Cc1ccc(-c2csc(C3CCCC3)n2)cc1	ZINC000058114939	329678691	/nfs/dbraw/zinc/67/86/91/329678691.db2.gz	PTFSSGPRMCNTLI-UHFFFAOYSA-N	0	0	254.358	4.339	20	30		CIEDRN
CC[C@H](Nc1cccc(OCCCC#N)c1)[C@@H]1C[C@H]1C	ZINC000322091922	329686398	/nfs/dbraw/zinc/68/63/98/329686398.db2.gz	WNNXFASRNQSSFG-XYPHTWIQSA-N	0	0	272.392	4.216	20	30		CIEDRN
C=CCCCNc1cc(Cc2ccccn2)ccc1C	ZINC000509503297	332871996	/nfs/dbraw/zinc/87/19/96/332871996.db2.gz	ZYHHLXGFVOHWEM-UHFFFAOYSA-N	0	0	266.388	4.359	20	30		CIEDRN
C[C@@H](SCCc1cncs1)c1ccc(C#N)cc1	ZINC000419430548	329728414	/nfs/dbraw/zinc/72/84/14/329728414.db2.gz	VYRQIVOUSTYHDD-LLVKDONJSA-N	0	0	274.414	4.052	20	30		CIEDRN
C[C@H](SCCOCC1CCC1)c1cccc(C#N)c1	ZINC000419458892	329731450	/nfs/dbraw/zinc/73/14/50/329731450.db2.gz	CGNKNRXNUFSLGM-ZDUSSCGKSA-N	0	0	275.417	4.169	20	30		CIEDRN
CC(=O)c1ccc(CSCCCC(C)(C)C#N)cc1	ZINC000419510835	329733975	/nfs/dbraw/zinc/73/39/75/329733975.db2.gz	UOOHDYPEOBKXER-UHFFFAOYSA-N	0	0	275.417	4.452	20	30		CIEDRN
C[C@H](SCC1(C#N)CCC1)c1nccn1-c1ccccc1	ZINC000419476473	329735738	/nfs/dbraw/zinc/73/57/38/329735738.db2.gz	OSNNPUVOFHGPDP-AWEZNQCLSA-N	0	0	297.427	4.360	20	30		CIEDRN
Cc1nc(C(C)C)ccc1CSCC1(C#N)CC1	ZINC000419489113	329736843	/nfs/dbraw/zinc/73/68/43/329736843.db2.gz	FAEGYBBXQLUFTL-UHFFFAOYSA-N	0	0	260.406	4.050	20	30		CIEDRN
CC(C)COCCSCCC1(C#N)CCCCC1	ZINC000419490535	329737156	/nfs/dbraw/zinc/73/71/56/329737156.db2.gz	KBUBETRUOZYWAC-UHFFFAOYSA-N	0	0	269.454	4.256	20	30		CIEDRN
CCc1nc(C(C)C)ccc1CSCC1(C#N)CC1	ZINC000419493622	329737267	/nfs/dbraw/zinc/73/72/67/329737267.db2.gz	NQCBGFSGDHCOTO-UHFFFAOYSA-N	0	0	274.433	4.304	20	30		CIEDRN
CO[C@H](CSCCCC(C)(C)C#N)Cc1ccccc1	ZINC000419532842	329737947	/nfs/dbraw/zinc/73/79/47/329737947.db2.gz	NVMHUZSZUUWMIA-INIZCTEOSA-N	0	0	291.460	4.307	20	30		CIEDRN
N#CC1(CSCCC2(C#N)CCCCC2)CCC1	ZINC000419579153	329741114	/nfs/dbraw/zinc/74/11/14/329741114.db2.gz	JLKYLFHIQJYUNQ-UHFFFAOYSA-N	0	0	262.422	4.278	20	30		CIEDRN
N#CC1(CSc2ncc(Cl)cc2Cl)CCC1	ZINC000419578648	329741140	/nfs/dbraw/zinc/74/11/40/329741140.db2.gz	IVQIAIJZVDYMDJ-UHFFFAOYSA-N	0	0	273.188	4.174	20	30		CIEDRN
N#CC1(CCSCCn2cc(Cl)cn2)CCCCC1	ZINC000419595053	329742164	/nfs/dbraw/zinc/74/21/64/329742164.db2.gz	VOPSZTORPOSXAP-UHFFFAOYSA-N	0	0	297.855	4.134	20	30		CIEDRN
C=CCCO[C@@H](C)c1nc(-c2ccsc2Cl)no1	ZINC000420500828	329770417	/nfs/dbraw/zinc/77/04/17/329770417.db2.gz	FUWUMYHYLBLBAF-QMMMGPOBSA-N	0	0	284.768	4.105	20	30		CIEDRN
C=C(C)[C@H]1OCCC[C@H]1c1nc([C@H]2CCCC[C@H]2C)no1	ZINC000420501488	329770701	/nfs/dbraw/zinc/77/07/01/329770701.db2.gz	HMMCYSUVLSKLJC-LXTVHRRPSA-N	0	0	290.407	4.202	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H](CC)CC(F)F)n1	ZINC000420505687	329771713	/nfs/dbraw/zinc/77/17/13/329771713.db2.gz	RWPVKHLUMFRAOO-VIFPVBQESA-N	0	0	258.312	4.072	20	30		CIEDRN
CC1(C)CC[C@@H](c2noc(CCCC#N)n2)c2ccccc21	ZINC000420510754	329772858	/nfs/dbraw/zinc/77/28/58/329772858.db2.gz	PBLPHIOXERYOLT-CQSZACIVSA-N	0	0	295.386	4.119	20	30		CIEDRN
C=CCC(CC=C)c1nc(-c2ccc(SC)cn2)no1	ZINC000420513573	329773510	/nfs/dbraw/zinc/77/35/10/329773510.db2.gz	KQIUYLYNCCTCDY-UHFFFAOYSA-N	0	0	287.388	4.089	20	30		CIEDRN
Cc1c(C#N)c(C#N)ccc1NC(=O)C1(C)CCCCCC1	ZINC000421557052	329845845	/nfs/dbraw/zinc/84/58/45/329845845.db2.gz	KNMGUWQTRYFPGS-UHFFFAOYSA-N	0	0	295.386	4.037	20	30		CIEDRN
CCc1nc(-c2cn(CCC#N)c3ccccc23)cs1	ZINC000075731724	329878474	/nfs/dbraw/zinc/87/84/74/329878474.db2.gz	LZGYRHLRVIDTLW-UHFFFAOYSA-N	0	0	281.384	4.241	20	30		CIEDRN
C[C@@H]1Sc2ccccc2N(CCCSCC#N)[C@H]1C	ZINC000161229345	329915800	/nfs/dbraw/zinc/91/58/00/329915800.db2.gz	HVNKKPCWDYGJCA-STQMWFEESA-N	0	0	292.473	4.023	20	30		CIEDRN
CCc1cccc(OCCSCCC(C)(C)C#N)c1	ZINC000571917174	329931139	/nfs/dbraw/zinc/93/11/39/329931139.db2.gz	OTWSSCLIZLBRSR-UHFFFAOYSA-N	0	0	277.433	4.301	20	30		CIEDRN
C=CCCCCCNc1cccc(CN(CC)C(C)=O)c1	ZINC000571969109	329933898	/nfs/dbraw/zinc/93/38/98/329933898.db2.gz	KQHUNMIQUGJTMN-UHFFFAOYSA-N	0	0	288.435	4.213	20	30		CIEDRN
C=CCC(CC=C)c1nc(C2(COC)CCCCC2)no1	ZINC000572083814	329942899	/nfs/dbraw/zinc/94/28/99/329942899.db2.gz	RFWMYDUVZSVMHG-UHFFFAOYSA-N	0	0	290.407	4.154	20	30		CIEDRN
C[C@H](Nc1ncc(C#N)cc1Cl)c1ccccc1Cl	ZINC000572130386	329944612	/nfs/dbraw/zinc/94/46/12/329944612.db2.gz	DCLHNPSOJKAMKT-VIFPVBQESA-N	0	0	292.169	4.433	20	30		CIEDRN
C=CCN(C)C(=O)[C@@H](Sc1ccccc1)c1ccccc1	ZINC000161648149	329950081	/nfs/dbraw/zinc/95/00/81/329950081.db2.gz	ULLVRVQISMKWNV-KRWDZBQOSA-N	0	0	297.423	4.164	20	30		CIEDRN
C=CCN(C)C(=O)c1cc(C)c(-c2ccc(F)cc2)s1	ZINC000161695129	329952352	/nfs/dbraw/zinc/95/23/52/329952352.db2.gz	BYPTUCKPJSQOEL-UHFFFAOYSA-N	0	0	289.375	4.121	20	30		CIEDRN
C=C(Cl)CSc1nnc(C[C@H](C)c2ccccc2)o1	ZINC000255939364	329966415	/nfs/dbraw/zinc/96/64/15/329966415.db2.gz	RROUWIBTTCKPDO-JTQLQIEISA-N	0	0	294.807	4.260	20	30		CIEDRN
C=CCCCCCN(C)C(=O)CCNc1ccccc1C	ZINC000572289776	329972415	/nfs/dbraw/zinc/97/24/15/329972415.db2.gz	QNRYEFAVRWVAAQ-UHFFFAOYSA-N	0	0	288.435	4.002	20	30		CIEDRN
Cc1cccc(Cl)c1NC(=O)c1cccc(C#N)c1C	ZINC000510073095	332890565	/nfs/dbraw/zinc/89/05/65/332890565.db2.gz	QLVLINNQGMJVER-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
C=C(C)CN(CC)C(=O)[C@H](CC)CC1CCCCC1	ZINC000510089107	332891745	/nfs/dbraw/zinc/89/17/45/332891745.db2.gz	MAHHTXRBCZPGIA-MRXNPFEDSA-N	0	0	265.441	4.408	20	30		CIEDRN
C=C(C)CN(CC)C(=O)[C@@H](CC)CC1CCCCC1	ZINC000510089105	332891751	/nfs/dbraw/zinc/89/17/51/332891751.db2.gz	MAHHTXRBCZPGIA-INIZCTEOSA-N	0	0	265.441	4.408	20	30		CIEDRN
C=CCCC(=O)N1CCCCC[C@H]1c1ccccc1	ZINC000263700599	330060193	/nfs/dbraw/zinc/06/01/93/330060193.db2.gz	UFTFXHTUYTUILL-INIZCTEOSA-N	0	0	257.377	4.097	20	30		CIEDRN
C=C1CCN(C(=O)[C@@H]2C[C@H]2c2ccc3ccccc3c2)CC1	ZINC000264580960	330061698	/nfs/dbraw/zinc/06/16/98/330061698.db2.gz	VGXGTNOQRMEXFO-RBUKOAKNSA-N	0	0	291.394	4.122	20	30		CIEDRN
C=CCCO[C@H](C)c1nc(-c2cccc(Cl)c2)no1	ZINC000264668940	330061760	/nfs/dbraw/zinc/06/17/60/330061760.db2.gz	WISKZWLODFJBRT-SNVBAGLBSA-N	0	0	278.739	4.044	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1cccc2cnccc21	ZINC000266665998	330064052	/nfs/dbraw/zinc/06/40/52/330064052.db2.gz	ICRINHHDDBOXLT-UHFFFAOYSA-N	0	0	282.387	4.053	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H]1CCSc2ccccc21	ZINC000268131433	330065586	/nfs/dbraw/zinc/06/55/86/330065586.db2.gz	FNTBSJCTKNZPAK-OAHLLOKOSA-N	0	0	287.428	4.108	20	30		CIEDRN
C=CCCO[C@H](C)C(=O)N(C(C)C)[C@H](C)c1ccsc1	ZINC000421694585	330067655	/nfs/dbraw/zinc/06/76/55/330067655.db2.gz	VLALOMVLIJKUBZ-ZIAGYGMSSA-N	0	0	295.448	4.027	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](CC(F)F)c1ccccc1	ZINC000421698107	330068481	/nfs/dbraw/zinc/06/84/81/330068481.db2.gz	HXMMZBWRSKHCHH-TZMCWYRMSA-N	0	0	281.346	4.101	20	30		CIEDRN
C=CCC[C@@H](NC(=O)CCC(F)(F)F)c1ccccc1	ZINC000269403829	330070002	/nfs/dbraw/zinc/07/00/02/330070002.db2.gz	MKKDDGNSFYYTGQ-CYBMUJFWSA-N	0	0	285.309	4.153	20	30		CIEDRN
CC#CCCCC(=O)N(C(C)C)[C@H](C)c1ccsc1	ZINC000421686898	330070378	/nfs/dbraw/zinc/07/03/78/330070378.db2.gz	CVLHLADNLPJLOO-CQSZACIVSA-N	0	0	277.433	4.240	20	30		CIEDRN
C#CC[C@@H](NCc1csc(C(C)(C)C)n1)c1ccccc1	ZINC000270167283	330073959	/nfs/dbraw/zinc/07/39/59/330073959.db2.gz	GYUWQADOANDRBS-MRXNPFEDSA-N	0	0	298.455	4.295	20	30		CIEDRN
C#CC[C@@H]([NH2+]Cc1cnc(C(C)(C)C)s1)c1ccccc1	ZINC000270218267	330074203	/nfs/dbraw/zinc/07/42/03/330074203.db2.gz	OXWBLPRDEUVQJZ-MRXNPFEDSA-N	0	0	298.455	4.295	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](c2ccccc2)C1(C)C	ZINC000421723591	330074565	/nfs/dbraw/zinc/07/45/65/330074565.db2.gz	WGFBLXKVZOKHDO-RDJZCZTQSA-N	0	0	285.431	4.383	20	30		CIEDRN
C=CCC[C@@H](NCc1ncc(C2CC2)o1)c1ccccc1	ZINC000271738253	330082608	/nfs/dbraw/zinc/08/26/08/330082608.db2.gz	OYAPCGBWEKXGIC-MRXNPFEDSA-N	0	0	282.387	4.349	20	30		CIEDRN
C=CCCO[C@H](C)c1nc([C@@H]2CCCC[C@H]2C)no1	ZINC000273799043	330097693	/nfs/dbraw/zinc/09/76/93/330097693.db2.gz	HOHWHSNZHAQLGQ-JHJVBQTASA-N	0	0	264.369	4.017	20	30		CIEDRN
C=CCCO[C@H](C)c1nc([C@H]2CCC[C@H](C)C2)no1	ZINC000273945292	330100915	/nfs/dbraw/zinc/10/09/15/330100915.db2.gz	NKATVSYPZWFUMT-XQQFMLRXSA-N	0	0	264.369	4.017	20	30		CIEDRN
C=CCCO[C@H](C)c1nc([C@@H]2CCC[C@H](C)C2)no1	ZINC000273945295	330101077	/nfs/dbraw/zinc/10/10/77/330101077.db2.gz	NKATVSYPZWFUMT-YNEHKIRRSA-N	0	0	264.369	4.017	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](C)c1ccccc1OC(F)F	ZINC000274290427	330104316	/nfs/dbraw/zinc/10/43/16/330104316.db2.gz	NZEKVYMAFQCRCJ-NWDGAFQWSA-N	0	0	297.345	4.068	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(Cc1cccs1)C(C)C	ZINC000274295660	330104484	/nfs/dbraw/zinc/10/44/84/330104484.db2.gz	QKMWJFNKOVQYMP-CYBMUJFWSA-N	0	0	265.422	4.087	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCCC[C@@H]1c1ccc(F)cc1	ZINC000274364337	330105460	/nfs/dbraw/zinc/10/54/60/330105460.db2.gz	TWKJBLWCAFNYSY-WMLDXEAASA-N	0	0	289.394	4.482	20	30		CIEDRN
C=C(C)CCSc1nnc(COc2cccc(C)c2)o1	ZINC000274755468	330107339	/nfs/dbraw/zinc/10/73/39/330107339.db2.gz	RFYHGEODGQBGTJ-UHFFFAOYSA-N	0	0	290.388	4.015	20	30		CIEDRN
C=C(C)[C@@H](N[C@H](C)c1cncs1)c1ccc(F)c(F)c1	ZINC000274758162	330107592	/nfs/dbraw/zinc/10/75/92/330107592.db2.gz	JLAONUNAUVYPGY-MEBBXXQBSA-N	0	0	294.370	4.389	20	30		CIEDRN
CCN(Cc1ccc(Cl)s1)Cc1cc(C#N)cs1	ZINC000162750745	330111446	/nfs/dbraw/zinc/11/14/46/330111446.db2.gz	RYGXNVTUXIDXHP-UHFFFAOYSA-N	0	0	296.848	4.357	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1ccccc1SC(C)C	ZINC000276095740	330111871	/nfs/dbraw/zinc/11/18/71/330111871.db2.gz	NETOXKWPRCBZLR-UHFFFAOYSA-N	0	0	278.421	4.227	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1cccc(C(F)(F)F)c1C	ZINC000276165300	330112053	/nfs/dbraw/zinc/11/20/53/330112053.db2.gz	SEGNXWLGNNOYHS-UHFFFAOYSA-N	0	0	286.297	4.054	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)NC1CCC1	ZINC000276387951	330113105	/nfs/dbraw/zinc/11/31/05/330113105.db2.gz	HUCXGGOQDRLWOB-UHFFFAOYSA-N	0	0	272.392	4.213	20	30		CIEDRN
C=CCC[C@H]([NH2+]Cc1ccc(OC)cc1)c1ccco1	ZINC000276446310	330113356	/nfs/dbraw/zinc/11/33/56/330113356.db2.gz	LGDBJNQQGSFOOB-INIZCTEOSA-N	0	0	271.360	4.085	20	30		CIEDRN
C=CCC1(C(=O)Nc2cc(-c3ncco3)ccc2C)CCC1	ZINC000276580566	330114138	/nfs/dbraw/zinc/11/41/38/330114138.db2.gz	BWAWNLGNBJCVFH-UHFFFAOYSA-N	0	0	296.370	4.335	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@@H](c3cccc(C)c3)C2)CCC1	ZINC000276569870	330114272	/nfs/dbraw/zinc/11/42/72/330114272.db2.gz	AOQLASIVPOMJKB-QGZVFWFLSA-N	0	0	283.415	4.057	20	30		CIEDRN
C=C(C)[C@H](Cc1nc(-c2coc3ccccc32)no1)OCC	ZINC000277898968	330118186	/nfs/dbraw/zinc/11/81/86/330118186.db2.gz	LCTRDGMUQJLDLS-HNNXBMFYSA-N	0	0	298.342	4.007	20	30		CIEDRN
C=CCCO[C@H](C)c1nc(-c2coc3ccccc23)no1	ZINC000277837681	330118638	/nfs/dbraw/zinc/11/86/38/330118638.db2.gz	FODVZKGJOOJQDR-LLVKDONJSA-N	0	0	284.315	4.137	20	30		CIEDRN
C=CC[C@@H](C)[C@H](C)Nc1cccc(NC(=O)NCC)c1C	ZINC000278927774	330120875	/nfs/dbraw/zinc/12/08/75/330120875.db2.gz	XBZFQRGOPBSIGA-OCCSQVGLSA-N	0	0	289.423	4.149	20	30		CIEDRN
C=CC[C@H](C)[C@@H](C)Nc1cccc(NC(=O)NCC)c1C	ZINC000278927771	330120966	/nfs/dbraw/zinc/12/09/66/330120966.db2.gz	XBZFQRGOPBSIGA-GXTWGEPZSA-N	0	0	289.423	4.149	20	30		CIEDRN
C=CCCC1(C(=O)N2CC[C@H](C(C)(C)C)C[C@@H]2C)CC1	ZINC000580458949	330141189	/nfs/dbraw/zinc/14/11/89/330141189.db2.gz	RMFZLVYHZRUIQQ-GJZGRUSLSA-N	0	0	277.452	4.406	20	30		CIEDRN
C=CCc1cccc(F)c1OCCCC(C)(C)C#N	ZINC000424100931	330233412	/nfs/dbraw/zinc/23/34/12/330233412.db2.gz	LYGWTFIFLJYMAW-UHFFFAOYSA-N	0	0	261.340	4.263	20	30		CIEDRN
C[C@H](Nc1cccc(F)c1C#N)c1c(F)cccc1F	ZINC000036138642	330249595	/nfs/dbraw/zinc/24/95/95/330249595.db2.gz	MXMZVJZHMGDJNO-VIFPVBQESA-N	0	0	276.261	4.149	20	30		CIEDRN
N#Cc1c(F)cccc1NCc1cccc2ccccc21	ZINC000036138550	330249633	/nfs/dbraw/zinc/24/96/33/330249633.db2.gz	QNRFBYVHKBGWMH-UHFFFAOYSA-N	0	0	276.314	4.463	20	30		CIEDRN
N#CCc1ccc(-c2ccc(OC3CC3)cc2)s1	ZINC000527586983	330264477	/nfs/dbraw/zinc/26/44/77/330264477.db2.gz	BGPMEIBZBZJAFQ-UHFFFAOYSA-N	0	0	255.342	4.022	20	30		CIEDRN
CCC(F)(F)C(C)(C)CNc1cc(C#N)ccc1OC	ZINC000527721028	330277051	/nfs/dbraw/zinc/27/70/51/330277051.db2.gz	REMKNQCUMZGJIF-UHFFFAOYSA-N	0	0	282.334	4.050	20	30		CIEDRN
CCC(C#N)(CC)C(=O)N(C)Cc1ccc2ccccc2c1	ZINC000527691065	330279366	/nfs/dbraw/zinc/27/93/66/330279366.db2.gz	KWRWTXBGFYOUTR-UHFFFAOYSA-N	0	0	294.398	4.128	20	30		CIEDRN
COCc1ccc(NCc2ccc([C@@H]3C[C@@H]3C)o2)cc1C#N	ZINC000527762169	330281460	/nfs/dbraw/zinc/28/14/60/330281460.db2.gz	GUBHMGVQLMNQOA-YVEFUNNKSA-N	0	0	296.370	4.033	20	30		CIEDRN
N#Cc1ccc(CNc2cccc(C3CCOCC3)c2)s1	ZINC000527799907	330284074	/nfs/dbraw/zinc/28/40/74/330284074.db2.gz	WHWNUJGOXWOAOT-UHFFFAOYSA-N	0	0	298.411	4.126	20	30		CIEDRN
CCC(C#N)(CC)C(=O)NC1CCC(c2ccccc2)CC1	ZINC000527868440	330285780	/nfs/dbraw/zinc/28/57/80/330285780.db2.gz	DJUGFODMOYYOHZ-UHFFFAOYSA-N	0	0	298.430	4.159	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1cc2cscc2s1	ZINC000527904946	330289805	/nfs/dbraw/zinc/28/98/05/330289805.db2.gz	XWHIBQFFKYHTQS-UHFFFAOYSA-N	0	0	265.403	4.001	20	30		CIEDRN
C[C@H](CC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccco1	ZINC000527872434	330290879	/nfs/dbraw/zinc/29/08/79/330290879.db2.gz	VCPCDPVJVWTMLS-CYBMUJFWSA-N	0	0	296.370	4.213	20	30		CIEDRN
N#Cc1cccc(NC2CC(c3ccccc3F)C2)c1	ZINC000036842298	330292419	/nfs/dbraw/zinc/29/24/19/330292419.db2.gz	OXLWSNWRUOFRMT-UHFFFAOYSA-N	0	0	266.319	4.055	20	30		CIEDRN
N#C[C@H]1CCC[C@H](Nc2cccc(C3CCOCC3)c2)C1	ZINC000527994209	330299350	/nfs/dbraw/zinc/29/93/50/330299350.db2.gz	HRVPPHDTFPZIST-YOEHRIQHSA-N	0	0	284.403	4.075	20	30		CIEDRN
CCC(C#N)(CC)C(=O)Nc1ccc(OC(C)C)cc1C	ZINC000528072476	330307090	/nfs/dbraw/zinc/30/70/90/330307090.db2.gz	XDSDYFSXHVQAMT-UHFFFAOYSA-N	0	0	288.391	4.051	20	30		CIEDRN
CCC(C#N)(CC)c1nc([C@H]2CCCc3ccccc32)no1	ZINC000528088505	330307450	/nfs/dbraw/zinc/30/74/50/330307450.db2.gz	BWVTULBCLLCGPF-HNNXBMFYSA-N	0	0	295.386	4.119	20	30		CIEDRN
CCC(C#N)(CC)c1nc([C@@H](C)c2ccc(C)cc2)no1	ZINC000528134777	330308855	/nfs/dbraw/zinc/30/88/55/330308855.db2.gz	UCDVSNIPAMMKBE-ZDUSSCGKSA-N	0	0	283.375	4.111	20	30		CIEDRN
CCN(C(=O)[C@H]1CCCC12CC2)[C@@H](C)c1ccc(C#N)cc1	ZINC000528152291	330309807	/nfs/dbraw/zinc/30/98/07/330309807.db2.gz	FAKTVCWPXGAPQX-WMLDXEAASA-N	0	0	296.414	4.048	20	30		CIEDRN
CCC(C#N)(CC)c1nc(-c2cccc(Cl)c2F)no1	ZINC000528157477	330310070	/nfs/dbraw/zinc/31/00/70/330310070.db2.gz	KPAGYPKHTDTHBP-UHFFFAOYSA-N	0	0	293.729	4.110	20	30		CIEDRN
CCC(C#N)(CC)C(=O)N(C)c1cccc(C(C)C)c1	ZINC000528192988	330312417	/nfs/dbraw/zinc/31/24/17/330312417.db2.gz	FVYIPOKWTDJVLJ-UHFFFAOYSA-N	0	0	272.392	4.103	20	30		CIEDRN
C=CCOc1ccc(CNc2cccc(COC)c2)cc1	ZINC000036917919	330313454	/nfs/dbraw/zinc/31/34/54/330313454.db2.gz	JCMMTBCIPVUXBU-UHFFFAOYSA-N	0	0	283.371	4.010	20	30		CIEDRN
C=CCCCc1nc(-c2ccccc2OC2CCC2)no1	ZINC000528258298	330317627	/nfs/dbraw/zinc/31/76/27/330317627.db2.gz	LIYQMIIYBLKPFE-UHFFFAOYSA-N	0	0	284.359	4.177	20	30		CIEDRN
C=CC[C@H](C)NC(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1Cl	ZINC000116857134	330323014	/nfs/dbraw/zinc/32/30/14/330323014.db2.gz	YZXDXBAVSGRQOM-WCQGTBRESA-N	0	0	298.213	4.178	20	30		CIEDRN
C[C@@H](CC(=O)Nc1ccc(Cl)c(C#N)c1)c1ccccc1	ZINC000105414511	330326378	/nfs/dbraw/zinc/32/63/78/330326378.db2.gz	NMOFQXRYZKRBRR-LBPRGKRZSA-N	0	0	298.773	4.344	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)c1oc2ccccc2c1C	ZINC000106421513	330337724	/nfs/dbraw/zinc/33/77/24/330337724.db2.gz	YZSCTYZJHXEJQX-UHFFFAOYSA-N	0	0	298.386	4.334	20	30		CIEDRN
C[C@@H](NCc1ccc(C#N)cc1)c1nc(C(C)(C)C)cs1	ZINC000106476659	330338524	/nfs/dbraw/zinc/33/85/24/330338524.db2.gz	NVIWTCWLSJTASA-GFCCVEGCSA-N	0	0	299.443	4.163	20	30		CIEDRN
C=C(C)C(C)(C)c1nc([C@H]2CSc3ccccc32)no1	ZINC000424363123	330347471	/nfs/dbraw/zinc/34/74/71/330347471.db2.gz	OSZWACMDNUUZAG-LBPRGKRZSA-N	0	0	286.400	4.161	20	30		CIEDRN
COCCCCCSc1ccc(C#N)cc1Cl	ZINC000533167533	330351765	/nfs/dbraw/zinc/35/17/65/330351765.db2.gz	QSRJLENENKPKHS-UHFFFAOYSA-N	0	0	269.797	4.120	20	30		CIEDRN
CCC(CC)(NCC#N)c1ccc(Cl)c(Cl)c1	ZINC000107900161	330351777	/nfs/dbraw/zinc/35/17/77/330351777.db2.gz	BCEJQPWNGSWHPW-UHFFFAOYSA-N	0	0	271.191	4.122	20	30		CIEDRN
Cc1cc(Oc2cccc(C#N)n2)cc(C)c1Cl	ZINC000081621300	330351882	/nfs/dbraw/zinc/35/18/82/330351882.db2.gz	ZJHWIOBJHZOKGE-UHFFFAOYSA-N	0	0	258.708	4.016	20	30		CIEDRN
CC(C)n1ccnc1SCC#Cc1ccccc1Cl	ZINC000533331296	330358602	/nfs/dbraw/zinc/35/86/02/330358602.db2.gz	YWHRPSYWBANJJD-UHFFFAOYSA-N	0	0	290.819	4.261	20	30		CIEDRN
CC(C)N(Cc1cc(C#N)ccc1F)c1ccccc1	ZINC000533352045	330359298	/nfs/dbraw/zinc/35/92/98/330359298.db2.gz	WUALVOURUQDTCT-UHFFFAOYSA-N	0	0	268.335	4.112	20	30		CIEDRN
C=C(CC)CSCC(=O)Nc1c(CC)cccc1CC	ZINC000536881745	330360806	/nfs/dbraw/zinc/36/08/06/330360806.db2.gz	NIMYRJXQICEXST-UHFFFAOYSA-N	0	0	291.460	4.449	20	30		CIEDRN
C=C(CC)CS[C@@H](C)C(=O)N[C@H](C)c1ccccc1C	ZINC000536881900	330360844	/nfs/dbraw/zinc/36/08/44/330360844.db2.gz	PJWAPYMPZYKRTQ-CABCVRRESA-N	0	0	291.460	4.260	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)NC(c1ccccc1)c1ccccc1	ZINC000116971256	330362719	/nfs/dbraw/zinc/36/27/19/330362719.db2.gz	BXUXWAVQWMXVIX-OAHLLOKOSA-N	0	0	294.398	4.040	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N1CCC[C@@H]1c1ccccc1Cl	ZINC000116974385	330362885	/nfs/dbraw/zinc/36/28/85/330362885.db2.gz	MFHHMOHBJDCXDO-SWLSCSKDSA-N	0	0	292.810	4.151	20	30		CIEDRN
C=C(CC)C[N@@H+]1CCCC[C@@H]1c1nc2ccccc2o1	ZINC000536902823	330363650	/nfs/dbraw/zinc/36/36/50/330363650.db2.gz	AASVHOALWSKVJC-OAHLLOKOSA-N	0	0	270.376	4.321	20	30		CIEDRN
Cc1cc(F)ccc1NCc1cccc(OCCCC#N)c1	ZINC000085303600	330364830	/nfs/dbraw/zinc/36/48/30/330364830.db2.gz	DTQRXASRDWRJGQ-UHFFFAOYSA-N	0	0	298.361	4.429	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1cccc(Cl)c1C	ZINC000424522517	330365318	/nfs/dbraw/zinc/36/53/18/330365318.db2.gz	HJWXWOVBGPDGEM-UHFFFAOYSA-N	0	0	251.757	4.189	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(C(C)C)cc2)CCOCC1	ZINC000424526577	330365720	/nfs/dbraw/zinc/36/57/20/330365720.db2.gz	OEFKCAVWAWOBFT-UHFFFAOYSA-N	0	0	287.403	4.121	20	30		CIEDRN
C=CCCCSc1nnc(C[C@H](C)c2ccccc2)o1	ZINC000117547947	330365974	/nfs/dbraw/zinc/36/59/74/330365974.db2.gz	AADZWNQSKAZPNP-ZDUSSCGKSA-N	0	0	288.416	4.474	20	30		CIEDRN
C=CCCCS[C@H](C)C(=O)Nc1cc(C)ccc1C	ZINC000117944533	330366580	/nfs/dbraw/zinc/36/65/80/330366580.db2.gz	HFWBPOALXZQFTM-CQSZACIVSA-N	0	0	277.433	4.330	20	30		CIEDRN
C=CCCCS[C@H](C)c1nc(C(C)(C)C)no1	ZINC000117943611	330366663	/nfs/dbraw/zinc/36/66/63/330366663.db2.gz	ZELWPDMWMXJATM-SNVBAGLBSA-N	0	0	254.399	4.128	20	30		CIEDRN
Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C(C)C	ZINC000056470092	330368006	/nfs/dbraw/zinc/36/80/06/330368006.db2.gz	NDDZCOLSTGVOKZ-UHFFFAOYSA-N	0	0	294.354	4.254	20	30		CIEDRN
Cc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(C#N)s2)s1	ZINC000119259633	330371542	/nfs/dbraw/zinc/37/15/42/330371542.db2.gz	ACRHTOPXDPKKDO-CQSZACIVSA-N	0	0	288.441	4.327	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)NCc1ccc2cc(OC)ccc2c1	ZINC000424551717	330374359	/nfs/dbraw/zinc/37/43/59/330374359.db2.gz	AAYKQWOOESBWDD-UHFFFAOYSA-N	0	0	297.398	4.067	20	30		CIEDRN
CCC(CC)CC(=O)N(CC)c1ccc(C#N)c(Cl)c1	ZINC000536973785	330375026	/nfs/dbraw/zinc/37/50/26/330375026.db2.gz	ZBTOEWGCDKDXCY-UHFFFAOYSA-N	0	0	292.810	4.391	20	30		CIEDRN
C=CCc1ccccc1OCc1ccc(CC#N)cc1	ZINC000544080608	330376071	/nfs/dbraw/zinc/37/60/71/330376071.db2.gz	LXAPIZDVGWFQBP-UHFFFAOYSA-N	0	0	263.340	4.060	20	30		CIEDRN
CC[C@@H]1CCC[C@@H]1NC(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000119921611	330380278	/nfs/dbraw/zinc/38/02/78/330380278.db2.gz	DYDFCJAZSXBEHX-CJNGLKHVSA-N	0	0	299.418	4.188	20	30		CIEDRN
C[C@H](c1cccc(Cl)c1)N(C)Cc1ccccc1C#N	ZINC000058000614	330381683	/nfs/dbraw/zinc/38/16/83/330381683.db2.gz	KPJGLACITFAHOL-CYBMUJFWSA-N	0	0	284.790	4.405	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@H](C)c1cccc(OC(C)C)c1	ZINC000424585381	330389663	/nfs/dbraw/zinc/38/96/63/330389663.db2.gz	CGVQKWAFBACFGW-CQSZACIVSA-N	0	0	289.419	4.253	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)C(C)(C)c1ccccc1C	ZINC000058706761	330391001	/nfs/dbraw/zinc/39/10/01/330391001.db2.gz	NMTMUJQQEOZDQZ-UHFFFAOYSA-N	0	0	292.382	4.091	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1ccc(COC(C)C)cc1	ZINC000424591847	330394229	/nfs/dbraw/zinc/39/42/29/330394229.db2.gz	AQQVFEHRFGEXJT-UHFFFAOYSA-N	0	0	275.392	4.152	20	30		CIEDRN
CCc1c(C)sc(NC(=O)[C@@H](C)c2ccccc2)c1C#N	ZINC000121076663	330396084	/nfs/dbraw/zinc/39/60/84/330396084.db2.gz	WOYUHUWCRVLBHM-NSHDSACASA-N	0	0	298.411	4.233	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc(N2CCCC2)cc1C	ZINC000121267166	330398831	/nfs/dbraw/zinc/39/88/31/330398831.db2.gz	OFEPILBLDQGGFC-UHFFFAOYSA-N	0	0	298.430	4.302	20	30		CIEDRN
CCN(C(=O)CCC1CCC1)c1ccc(C#N)c(Cl)c1	ZINC000091207177	330399565	/nfs/dbraw/zinc/39/95/65/330399565.db2.gz	LLQDMNQTIFSHCF-UHFFFAOYSA-N	0	0	290.794	4.145	20	30		CIEDRN
CCc1ccc(NC(=O)c2cccc(CC#N)c2)cc1CC	ZINC000537147070	330407847	/nfs/dbraw/zinc/40/78/47/330407847.db2.gz	WLBLQZBOPRUZMD-UHFFFAOYSA-N	0	0	292.382	4.130	20	30		CIEDRN
C[C@H](Nc1cc(F)c(F)c(F)c1)c1cccc(C#N)c1	ZINC000061099882	330428478	/nfs/dbraw/zinc/42/84/78/330428478.db2.gz	ZKGUZZDNYYZHCT-VIFPVBQESA-N	0	0	276.261	4.149	20	30		CIEDRN
Cc1cc(N[C@@H](C)c2ccc(C#N)cc2)ccc1F	ZINC000061117555	330428904	/nfs/dbraw/zinc/42/89/04/330428904.db2.gz	OQLRUGCMUUIKQI-LBPRGKRZSA-N	0	0	254.308	4.179	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)C[C@@H]1CCc2ccccc2C1	ZINC000537226756	330429452	/nfs/dbraw/zinc/42/94/52/330429452.db2.gz	VRMOTZRXSNCPCG-HZPDHXFCSA-N	0	0	285.431	4.043	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Cc1c[nH]c2c1cccc2CC	ZINC000537230782	330429734	/nfs/dbraw/zinc/42/97/34/330429734.db2.gz	UDGDHBDBIJLILC-AWEZNQCLSA-N	0	0	298.430	4.134	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@@H](C)SCc1ccccc1	ZINC000537240296	330430208	/nfs/dbraw/zinc/43/02/08/330430208.db2.gz	YTYCIEGLGWOWIS-LSDHHAIUSA-N	0	0	291.460	4.169	20	30		CIEDRN
C[C@H]1CCN(CCC(C)(C)C#N)c2ccccc2S1	ZINC000537383767	330435457	/nfs/dbraw/zinc/43/54/57/330435457.db2.gz	AZSNQUCZWLVDCQ-ZDUSSCGKSA-N	0	0	274.433	4.317	20	30		CIEDRN
Cc1ccc(C#N)cc1OCc1coc(-c2ccccc2)n1	ZINC000123000076	330438489	/nfs/dbraw/zinc/43/84/89/330438489.db2.gz	HZBZFCYKJNIUNJ-UHFFFAOYSA-N	0	0	290.322	4.101	20	30		CIEDRN
CCc1ccccc1NC(=O)c1ccc(Cl)c(C#N)c1	ZINC000537545762	330440917	/nfs/dbraw/zinc/44/09/17/330440917.db2.gz	GFUUMRXDNPFYAQ-UHFFFAOYSA-N	0	0	284.746	4.026	20	30		CIEDRN
C=CCC[C@H](NC(=O)[C@H]1CCC[C@H](F)C1)c1ccccc1	ZINC000424732157	330453842	/nfs/dbraw/zinc/45/38/42/330453842.db2.gz	GYNURPAAJCLUIO-ULQDDVLXSA-N	0	0	289.394	4.338	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1cnn([C@@H](C)CC)c1C1CC1	ZINC000424749646	330462324	/nfs/dbraw/zinc/46/23/24/330462324.db2.gz	RCUDHCJAYYGHJM-LBPRGKRZSA-N	0	0	289.423	4.272	20	30		CIEDRN
N#CC1(c2ccc(-c3nc(CC4CCCC4)no3)cc2)CC1	ZINC000514737134	330464079	/nfs/dbraw/zinc/46/40/79/330464079.db2.gz	OFJSNBIHJZSMAY-UHFFFAOYSA-N	0	0	293.370	4.024	20	30		CIEDRN
Cc1cc(C)c(C#N)c(N[C@@H](C)c2c(F)cccc2F)n1	ZINC000515501945	330478699	/nfs/dbraw/zinc/47/86/99/330478699.db2.gz	XTGOHHOLRSATLK-NSHDSACASA-N	0	0	287.313	4.021	20	30		CIEDRN
N#Cc1ncccc1N[C@@H]1CCC[C@@H](c2ccccc2)C1	ZINC000515564706	330479841	/nfs/dbraw/zinc/47/98/41/330479841.db2.gz	CRIFPJALRJWOBQ-HZPDHXFCSA-N	0	0	277.371	4.092	20	30		CIEDRN
N#Cc1ccc(N[C@H]2CSc3ccccc32)cc1Cl	ZINC000083748540	330482305	/nfs/dbraw/zinc/48/23/05/330482305.db2.gz	IIMIZXFKEZJIOO-AWEZNQCLSA-N	0	0	286.787	4.471	20	30		CIEDRN
C=CCCC1(c2nc(-c3c[nH]c4ccccc43)no2)CC1	ZINC000515855815	330483588	/nfs/dbraw/zinc/48/35/88/330483588.db2.gz	KWDSZCZYWWDQPK-UHFFFAOYSA-N	0	0	279.343	4.216	20	30		CIEDRN
N#Cc1csc(C(=O)Nc2cccc3ccccc32)c1	ZINC000084057899	330483654	/nfs/dbraw/zinc/48/36/54/330483654.db2.gz	UBLJAXJMDOLHCH-UHFFFAOYSA-N	0	0	278.336	4.025	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)NCC1(CC)CCC1	ZINC000084164803	330484882	/nfs/dbraw/zinc/48/48/82/330484882.db2.gz	CNBNPGOOKPDUQL-UHFFFAOYSA-N	0	0	292.448	4.026	20	30		CIEDRN
C=CCN(CC=C)C(=O)[C@H](C)c1ccc2ccccc2c1	ZINC000084523254	330486213	/nfs/dbraw/zinc/48/62/13/330486213.db2.gz	HDESBOOUCJYKKB-OAHLLOKOSA-N	0	0	279.383	4.144	20	30		CIEDRN
C/C=C/c1ccc(NC(=O)c2cc(C#N)ccc2Cl)cc1	ZINC000516107831	330486647	/nfs/dbraw/zinc/48/66/47/330486647.db2.gz	KMQPKOBOXSQGMT-NSCUHMNNSA-N	0	0	296.757	4.497	20	30		CIEDRN
CCCc1ccc(C(=O)Nc2sc(C)c(C)c2C#N)cc1	ZINC000516273574	330490629	/nfs/dbraw/zinc/49/06/29/330490629.db2.gz	VAPRMSLVUZZUAC-UHFFFAOYSA-N	0	0	298.411	4.441	20	30		CIEDRN
C=CCC(C)(C)c1nc(-c2ccccc2OC(F)F)no1	ZINC000426438155	330509297	/nfs/dbraw/zinc/50/92/97/330509297.db2.gz	BLAMDPHAJBLORP-UHFFFAOYSA-N	0	0	294.301	4.192	20	30		CIEDRN
C=CCC(C)(C)c1nc(-c2ccc(C(C)C)nc2)no1	ZINC000426628512	330513299	/nfs/dbraw/zinc/51/32/99/330513299.db2.gz	MQDGEVIIXIOQHI-UHFFFAOYSA-N	0	0	271.364	4.109	20	30		CIEDRN
CC[C@@H](NCc1cccc(F)c1C#N)c1ccc(C)cc1	ZINC000428306860	330519601	/nfs/dbraw/zinc/51/96/01/330519601.db2.gz	RNTRHLAVVMLGJF-GOSISDBHSA-N	0	0	282.362	4.247	20	30		CIEDRN
C=CCN(CCC#N)[C@H](C)c1cc(Cl)ccc1Cl	ZINC000428862667	330533170	/nfs/dbraw/zinc/53/31/70/330533170.db2.gz	OKOJAEGKVVMEGU-LLVKDONJSA-N	0	0	283.202	4.456	20	30		CIEDRN
C=C(C)CNC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000429205164	330539972	/nfs/dbraw/zinc/53/99/72/330539972.db2.gz	QQFJZCPLRWVEJY-UHFFFAOYSA-N	0	0	292.688	4.056	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H](C)c1cccc(OC(C)C)c1	ZINC000429828178	330555521	/nfs/dbraw/zinc/55/55/21/330555521.db2.gz	DHONQFRPYYCIGX-CQSZACIVSA-N	0	0	289.419	4.253	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H](C)CC(C)(C)c1ccccc1	ZINC000429892073	330556130	/nfs/dbraw/zinc/55/61/30/330556130.db2.gz	SNEMRLNXXYMBJX-OAHLLOKOSA-N	0	0	287.447	4.461	20	30		CIEDRN
N#C[C@@H]1CC[C@H](S[C@@H]2CCCc3ccccc32)C1	ZINC000430091950	330559674	/nfs/dbraw/zinc/55/96/74/330559674.db2.gz	VORKJOGQEBGPPQ-IVMMDQJWSA-N	0	0	257.402	4.489	20	30		CIEDRN
Cc1cc(C)cc(-n2ccnc2S[C@@H]2CC[C@H](C#N)C2)c1	ZINC000430111281	330561101	/nfs/dbraw/zinc/56/11/01/330561101.db2.gz	PQQXYTMZBXTERY-GOEBONIOSA-N	0	0	297.427	4.274	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)[C@@H]1[C@H](C)[C@@H]1c1ccccc1	ZINC000430794749	330574464	/nfs/dbraw/zinc/57/44/64/330574464.db2.gz	RCAUQWSXSFSSEF-DJIMGWMZSA-N	0	0	298.430	4.015	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)[C@H]1[C@H](c2ccccc2)[C@@H]1C	ZINC000430794748	330574515	/nfs/dbraw/zinc/57/45/15/330574515.db2.gz	RCAUQWSXSFSSEF-BHYGNILZSA-N	0	0	298.430	4.015	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H]1C[C@H]1c1cccc2ccccc21	ZINC000431134812	330579769	/nfs/dbraw/zinc/57/97/69/330579769.db2.gz	YNRNHRPCODCKOD-NLWGTHIKSA-N	0	0	293.410	4.414	20	30		CIEDRN
CC(C)c1ccc(/C=C/CC(=O)NCC2(CC#N)CC2)cc1	ZINC000431165803	330580775	/nfs/dbraw/zinc/58/07/75/330580775.db2.gz	HDKLGFPLLOUIOT-ONEGZZNKSA-N	0	0	296.414	4.023	20	30		CIEDRN
N#Cc1ccc(N[C@H]2C[C@H](c3ccc(F)cc3)C2)cc1	ZINC000431500124	330585756	/nfs/dbraw/zinc/58/57/56/330585756.db2.gz	OHPRUESBXAMXNI-CZIWCDLHSA-N	0	0	266.319	4.055	20	30		CIEDRN
N#CCCC[C@H](Nc1ccccc1[N+](=O)[O-])c1ccccc1	ZINC000431509167	330586038	/nfs/dbraw/zinc/58/60/38/330586038.db2.gz	BTRLIFZIIYWGIC-HNNXBMFYSA-N	0	0	295.342	4.442	20	30		CIEDRN
C=CCC(C)(C)C(=O)N(CC)Cc1ccc(Cl)s1	ZINC000431729200	330588470	/nfs/dbraw/zinc/58/84/70/330588470.db2.gz	BXAOQVWVMPJZJM-UHFFFAOYSA-N	0	0	285.840	4.352	20	30		CIEDRN
N#Cc1cscc1C(=O)Nc1ccc(Cl)c(Cl)c1	ZINC000432047330	330591683	/nfs/dbraw/zinc/59/16/83/330591683.db2.gz	OFALZKKDGDZDKD-UHFFFAOYSA-N	0	0	297.166	4.179	20	30		CIEDRN
N#Cc1cc(NCc2cc3c(cccc3F)[nH]2)ccc1Cl	ZINC000432413545	330598812	/nfs/dbraw/zinc/59/88/12/330598812.db2.gz	HNDFFSXPOGWHCU-UHFFFAOYSA-N	0	0	299.736	4.444	20	30		CIEDRN
N#Cc1cc(NCc2cc3ccc(F)cc3[nH]2)ccc1Cl	ZINC000432417110	330598959	/nfs/dbraw/zinc/59/89/59/330598959.db2.gz	KMJGHVOXBDURDC-UHFFFAOYSA-N	0	0	299.736	4.444	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)Nc1ccc(C)c(C)c1	ZINC000432452776	330599370	/nfs/dbraw/zinc/59/93/70/330599370.db2.gz	DLTQWAFUPIAZJI-UHFFFAOYSA-N	0	0	260.381	4.027	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)Nc1cccc(Cl)c1C	ZINC000432487115	330599665	/nfs/dbraw/zinc/59/96/65/330599665.db2.gz	BGZNZFMULALJLD-UHFFFAOYSA-N	0	0	280.799	4.372	20	30		CIEDRN
C=CCC[C@@H](CC)Nc1cccc(NC(=O)NCC)c1C	ZINC000433067442	330615914	/nfs/dbraw/zinc/61/59/14/330615914.db2.gz	NKPKYMDJHLZVOS-CQSZACIVSA-N	0	0	289.423	4.293	20	30		CIEDRN
Cc1ccc(NC(=O)[C@H](C#N)CCc2ccccc2)cc1C	ZINC000433122000	330617612	/nfs/dbraw/zinc/61/76/12/330617612.db2.gz	UIHTXGHIBKHYHQ-KRWDZBQOSA-N	0	0	292.382	4.015	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)c2ccc(F)cc2C)c1	ZINC000433717541	330630337	/nfs/dbraw/zinc/63/03/37/330630337.db2.gz	IQDQDXZJRIGIJW-UHFFFAOYSA-N	0	0	299.345	4.341	20	30		CIEDRN
C[C@@H](CCC(=O)N1CCCC(C)(C)[C@@H]1C#N)c1ccccc1	ZINC000434039018	330634857	/nfs/dbraw/zinc/63/48/57/330634857.db2.gz	WPGXTWGSCHIXNF-RDJZCZTQSA-N	0	0	298.430	4.111	20	30		CIEDRN
CC1(C)CCCN(C(=O)CC/C=C/c2ccccc2)[C@H]1C#N	ZINC000434038373	330634911	/nfs/dbraw/zinc/63/49/11/330634911.db2.gz	UALSSJJIVUYPOR-CEUCYRDJSA-N	0	0	296.414	4.021	20	30		CIEDRN
C=CCC[C@H](NC(=O)N1CC[C@@H](CC)C1)c1ccccc1	ZINC000435102465	330649366	/nfs/dbraw/zinc/64/93/66/330649366.db2.gz	HUOPSHWAYNOXFB-WBVHZDCISA-N	0	0	286.419	4.135	20	30		CIEDRN
C=CCC[C@@H](NC(=O)CCC(C)C)c1ccccc1	ZINC000435275988	330652295	/nfs/dbraw/zinc/65/22/95/330652295.db2.gz	WBVKJICRHUFLKA-MRXNPFEDSA-N	0	0	259.393	4.246	20	30		CIEDRN
C=CCC[C@H](NC(=O)c1cccc(OC)c1)c1ccccc1	ZINC000435299989	330652551	/nfs/dbraw/zinc/65/25/51/330652551.db2.gz	SLLOQJTXAHAFFF-SFHVURJKSA-N	0	0	295.382	4.133	20	30		CIEDRN
Cc1oc(C#N)cc1C(=O)Nc1ccc(Cl)c(Cl)c1	ZINC000435398107	330654049	/nfs/dbraw/zinc/65/40/49/330654049.db2.gz	BJZUELLCWUDYCR-UHFFFAOYSA-N	0	0	295.125	4.019	20	30		CIEDRN
N#Cc1ccc(N[C@@H]2C[C@H]2c2ccc3ccccc3c2)cn1	ZINC000435571114	330657515	/nfs/dbraw/zinc/65/75/15/330657515.db2.gz	RHXZLBVXQHSPEO-RBUKOAKNSA-N	0	0	285.350	4.074	20	30		CIEDRN
Cc1cc(/C=C/c2nc3ccccc3o2)ccc1C#N	ZINC000435742158	330661658	/nfs/dbraw/zinc/66/16/58/330661658.db2.gz	SSDWBPRBAWCSLW-VQHVLOKHSA-N	0	0	260.296	4.178	20	30		CIEDRN
Cc1ccc(/C=C\c2ccc(C#N)cn2)cc1Cl	ZINC000435751468	330662171	/nfs/dbraw/zinc/66/21/71/330662171.db2.gz	GHDWWMZGLSDIIH-XQRVVYSFSA-N	0	0	254.720	4.086	20	30		CIEDRN
CCCOc1ccc(C(F)(F)F)cc1N[C@@H](C#N)CC	ZINC000435934486	330666085	/nfs/dbraw/zinc/66/60/85/330666085.db2.gz	HOHRLBDDYWXKQQ-LLVKDONJSA-N	0	0	286.297	4.208	20	30		CIEDRN
N#CC1(CSCc2ccc(Cl)cc2F)CC1	ZINC000435993414	330667347	/nfs/dbraw/zinc/66/73/47/330667347.db2.gz	MEHXTSJFTKPCGZ-UHFFFAOYSA-N	0	0	255.745	4.016	20	30		CIEDRN
N#Cc1cccc(C#N)c1Nc1cccc2ccsc21	ZINC000436390976	330676481	/nfs/dbraw/zinc/67/64/81/330676481.db2.gz	RABOODRJGYAGLP-UHFFFAOYSA-N	0	0	275.336	4.388	20	30		CIEDRN
C=CC[C@H](C)[C@@H](C)Nc1cc(NC(=O)N(C)C)ccc1C	ZINC000437344063	330697956	/nfs/dbraw/zinc/69/79/56/330697956.db2.gz	IBAYAEAVMJINCG-GXTWGEPZSA-N	0	0	289.423	4.101	20	30		CIEDRN
N#Cc1cccc(CSCc2cc(F)cc(F)c2)c1	ZINC000438310744	330721319	/nfs/dbraw/zinc/72/13/19/330721319.db2.gz	CHCCYAKTBIJVIW-UHFFFAOYSA-N	0	0	275.323	4.270	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Nc1nc(CC)c(C)s1	ZINC000438561936	330727344	/nfs/dbraw/zinc/72/73/44/330727344.db2.gz	MYIZOGGUEBMMMA-UHFFFAOYSA-N	0	0	295.452	4.224	20	30		CIEDRN
N#Cc1c(Cl)cccc1N1CCC[C@@H]1c1ccco1	ZINC000450338375	330728434	/nfs/dbraw/zinc/72/84/34/330728434.db2.gz	KAKBGDFLOFLKRX-CQSZACIVSA-N	0	0	272.735	4.146	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1cc(CC)ccc1CC	ZINC000438765819	330729256	/nfs/dbraw/zinc/72/92/56/330729256.db2.gz	KOUGFLZSUHTGAT-UHFFFAOYSA-N	0	0	274.408	4.241	20	30		CIEDRN
Cc1cc(C#N)ccc1C(=O)N1CCCCC[C@@H]1CC(C)C	ZINC000438823586	330729515	/nfs/dbraw/zinc/72/95/15/330729515.db2.gz	KJFLSPCDFNWJOZ-QGZVFWFLSA-N	0	0	298.430	4.298	20	30		CIEDRN
N#Cc1ccccc1NCc1cccc(-c2ccncc2)c1	ZINC000438923947	330730922	/nfs/dbraw/zinc/73/09/22/330730922.db2.gz	BRRASWIPVLIKNX-UHFFFAOYSA-N	0	0	285.350	4.232	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1ccc(OC(C)C)cc1F	ZINC000439519347	330739994	/nfs/dbraw/zinc/73/99/94/330739994.db2.gz	JCMHURCFCIYSME-GFCCVEGCSA-N	0	0	294.370	4.089	20	30		CIEDRN
N#Cc1ccccc1SCc1cc(F)ccc1F	ZINC000439541530	330740144	/nfs/dbraw/zinc/74/01/44/330740144.db2.gz	MWOVPKKTOJDERA-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
C=CCCC(=O)N1CCC[C@@H](CCCc2ccccc2)C1	ZINC000439700806	330742063	/nfs/dbraw/zinc/74/20/63/330742063.db2.gz	UCJFQIJHDHJPGV-GOSISDBHSA-N	0	0	285.431	4.214	20	30		CIEDRN
C=C1CCN(C(=O)[C@H](C)c2ccc3ccccc3c2)CC1	ZINC000439945383	330744969	/nfs/dbraw/zinc/74/49/69/330744969.db2.gz	VTPWZZICMAEDKK-OAHLLOKOSA-N	0	0	279.383	4.122	20	30		CIEDRN
CCCC[C@@H](CC)CC(=O)N(C)c1ccc(C#N)cc1	ZINC000440043214	330745865	/nfs/dbraw/zinc/74/58/65/330745865.db2.gz	CYRPFYWQOGIWPK-CQSZACIVSA-N	0	0	272.392	4.128	20	30		CIEDRN
CCN(CCCC(C)(C)C#N)c1ccccc1Cl	ZINC000440628499	330752933	/nfs/dbraw/zinc/75/29/33/330752933.db2.gz	KLRWJDVULUAOKI-UHFFFAOYSA-N	0	0	264.800	4.496	20	30		CIEDRN
C=CCCC(=O)N(Cc1ccc(F)cc1)c1cncc(C)c1	ZINC000441422453	330768221	/nfs/dbraw/zinc/76/82/21/330768221.db2.gz	DDKAOMUFTWZLIQ-UHFFFAOYSA-N	0	0	298.361	4.029	20	30		CIEDRN
C=CCC[C@H](NC(=O)C(C)C)c1ccc(C(F)(F)F)cc1	ZINC000441563808	330770841	/nfs/dbraw/zinc/77/08/41/330770841.db2.gz	HGRUFWZWYNOJRG-AWEZNQCLSA-N	0	0	299.336	4.485	20	30		CIEDRN
CC[C@H](F)CNc1cccc(OCc2cccc(C#N)c2)c1	ZINC000442095107	330774015	/nfs/dbraw/zinc/77/40/15/330774015.db2.gz	VITRIQIVPAJKQS-INIZCTEOSA-N	0	0	298.361	4.297	20	30		CIEDRN
C=C(CC)CNc1cccc(C[S@](=O)c2ccccc2)c1	ZINC000442108710	330774085	/nfs/dbraw/zinc/77/40/85/330774085.db2.gz	OAWJKVWRBYHUJS-NRFANRHFSA-N	0	0	299.439	4.373	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1cc(Cl)cc(F)c1F	ZINC000442190344	330774717	/nfs/dbraw/zinc/77/47/17/330774717.db2.gz	RFFJVQSUJJOAIP-UHFFFAOYSA-N	0	0	288.725	4.048	20	30		CIEDRN
C=CC(C)(C)C(=O)Nc1ccc(-c2cnc(C3CC3)o2)cc1	ZINC000448668422	330775333	/nfs/dbraw/zinc/77/53/33/330775333.db2.gz	NZTBEOWXLRKQPN-UHFFFAOYSA-N	0	0	296.370	4.370	20	30		CIEDRN
C=CCCC(=O)Nc1cc(C)ccc1OCc1ccccc1	ZINC000442422523	330775679	/nfs/dbraw/zinc/77/56/79/330775679.db2.gz	HTQOWNMQWDVSKN-UHFFFAOYSA-N	0	0	295.382	4.479	20	30		CIEDRN
CC[C@H](F)CSCc1ccc(C#N)cc1OC(F)F	ZINC000442554633	330776835	/nfs/dbraw/zinc/77/68/35/330776835.db2.gz	ZLSPPCIKHNTJBX-NSHDSACASA-N	0	0	289.322	4.141	20	30		CIEDRN
N#Cc1cc(Cl)cc(OCCCCC2CCOCC2)c1	ZINC000380369224	330785892	/nfs/dbraw/zinc/78/58/92/330785892.db2.gz	QOIQURVBRDZMQN-UHFFFAOYSA-N	0	0	293.794	4.187	20	30		CIEDRN
N#C[C@H]1CC[C@H](Nc2cccc(C(F)F)c2Cl)C1	ZINC000442834716	330785991	/nfs/dbraw/zinc/78/59/91/330785991.db2.gz	KRLPJVPPNWLSEG-IUCAKERBSA-N	0	0	270.710	4.382	20	30		CIEDRN
CCc1cc(Br)ccc1N[C@@H]1CC[C@H](C#N)C1	ZINC000442836614	330786164	/nfs/dbraw/zinc/78/61/64/330786164.db2.gz	OCXYPVPWPGYWID-GXFFZTMASA-N	0	0	293.208	4.116	20	30		CIEDRN
CCSCc1cccc(N[C@@H]2CC[C@H](C#N)C2)c1	ZINC000442863613	330788237	/nfs/dbraw/zinc/78/82/37/330788237.db2.gz	XYWPMYHBPDSEHB-SWLSCSKDSA-N	0	0	260.406	4.044	20	30		CIEDRN
CSc1ccc(N[C@H]2CC[C@@H](C#N)C2)cc1Cl	ZINC000442867407	330788747	/nfs/dbraw/zinc/78/87/47/330788747.db2.gz	LGMMHVVALADABS-ZJUUUORDSA-N	0	0	266.797	4.166	20	30		CIEDRN
C[C@H](Sc1nc2ccccc2n1C)c1cccc(C#N)c1	ZINC000442914290	330791477	/nfs/dbraw/zinc/79/14/77/330791477.db2.gz	LXLOYVDIOHRGRS-LBPRGKRZSA-N	0	0	293.395	4.298	20	30		CIEDRN
N#Cc1nc(SCc2ccccc2)ccc1C(F)(F)F	ZINC000443407589	330798992	/nfs/dbraw/zinc/79/89/92/330798992.db2.gz	IGPKOMUQOSBYGY-UHFFFAOYSA-N	0	0	294.301	4.264	20	30		CIEDRN
CC(C)CCSc1ccc(C(F)(F)F)c(C#N)n1	ZINC000443506851	330800448	/nfs/dbraw/zinc/80/04/48/330800448.db2.gz	HKADTDGHVAFZOD-UHFFFAOYSA-N	0	0	274.311	4.110	20	30		CIEDRN
N#Cc1ccccc1COc1ccccc1OC(F)(F)F	ZINC000157838323	330806217	/nfs/dbraw/zinc/80/62/17/330806217.db2.gz	JWJGXOIVDPKIHK-UHFFFAOYSA-N	0	0	293.244	4.036	20	30		CIEDRN
C=CCOCCCC(=O)N(c1ccc(Cl)cc1)C(C)C	ZINC000443866856	330806839	/nfs/dbraw/zinc/80/68/39/330806839.db2.gz	HGRHYLXIFQXYMB-UHFFFAOYSA-N	0	0	295.810	4.064	20	30		CIEDRN
CCc1ccccc1NCc1ccc(C#N)c(C)c1	ZINC000443958516	330807913	/nfs/dbraw/zinc/80/79/13/330807913.db2.gz	LHNRESBESHFADF-UHFFFAOYSA-N	0	0	250.345	4.041	20	30		CIEDRN
CC1(C)CCCN(Cc2cccc(C(F)(F)F)c2)[C@@H]1C#N	ZINC000444724576	330821945	/nfs/dbraw/zinc/82/19/45/330821945.db2.gz	DOLVTFBOKBDDHA-CQSZACIVSA-N	0	0	296.336	4.220	20	30		CIEDRN
CC[C@H]1CC[C@H](C(=O)Nc2sc(C)c(C)c2C#N)CC1	ZINC000445570695	330831607	/nfs/dbraw/zinc/83/16/07/330831607.db2.gz	IEMCKGZFXOPFDV-JOCQHMNTSA-N	0	0	290.432	4.392	20	30		CIEDRN
C=CCCc1nc(C(C)(C)c2cccc(Cl)c2F)no1	ZINC000445588124	330832267	/nfs/dbraw/zinc/83/22/67/330832267.db2.gz	PVKWANOBWYKFBD-UHFFFAOYSA-N	0	0	294.757	4.307	20	30		CIEDRN
N#Cc1ccccc1SCc1cc(F)cc(F)c1	ZINC000445610949	330832869	/nfs/dbraw/zinc/83/28/69/330832869.db2.gz	UYCCUIRCLIDKCE-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
N#Cc1ccc(CNc2cc(F)cc(Cl)c2)s1	ZINC000159333394	330846213	/nfs/dbraw/zinc/84/62/13/330846213.db2.gz	GXJYOCXFQJMSBN-UHFFFAOYSA-N	0	0	266.728	4.024	20	30		CIEDRN
N#Cc1c(CNc2ccccc2Cl)cn2ccccc12	ZINC000446624258	330850982	/nfs/dbraw/zinc/85/09/82/330850982.db2.gz	NLZUJXCKKVQATL-UHFFFAOYSA-N	0	0	281.746	4.076	20	30		CIEDRN
N#Cc1c(CNc2ccc(Cl)cc2)cn2ccccc12	ZINC000446628131	330851049	/nfs/dbraw/zinc/85/10/49/330851049.db2.gz	JQRIQUHTOQLOFO-UHFFFAOYSA-N	0	0	281.746	4.076	20	30		CIEDRN
C=CCn1c(C)nnc1SCc1ccc(C2CCC2)cc1	ZINC000447115270	330861615	/nfs/dbraw/zinc/86/16/15/330861615.db2.gz	XPFIDOKCOWVHHS-UHFFFAOYSA-N	0	0	299.443	4.332	20	30		CIEDRN
C[C@@H]1C[C@@H](CSc2cccc(Cl)c2C#N)CCO1	ZINC000447289363	330863449	/nfs/dbraw/zinc/86/34/49/330863449.db2.gz	YLJWHZPHAHTDDR-MNOVXSKESA-N	0	0	281.808	4.119	20	30		CIEDRN
Cc1cc(CSc2ncnc3ccsc32)ccc1C#N	ZINC000447293422	330863628	/nfs/dbraw/zinc/86/36/28/330863628.db2.gz	WCIICEFYSNAQEL-UHFFFAOYSA-N	0	0	297.408	4.164	20	30		CIEDRN
C=CCCCCCSc1nnc(-c2ccco2)n1CC	ZINC000447293213	330863668	/nfs/dbraw/zinc/86/36/68/330863668.db2.gz	AIWBSDVKUVLVTQ-UHFFFAOYSA-N	0	0	291.420	4.397	20	30		CIEDRN
C[C@H]1C[C@H](CSc2ccc(C#N)cc2Cl)CCO1	ZINC000447310195	330864136	/nfs/dbraw/zinc/86/41/36/330864136.db2.gz	VNPNLJMMDWRRRH-CMPLNLGQSA-N	0	0	281.808	4.119	20	30		CIEDRN
N#CCCCNC1(c2c(Cl)cccc2Cl)CCC1	ZINC000447397005	330866271	/nfs/dbraw/zinc/86/62/71/330866271.db2.gz	YJHDUNBVJOJTKW-UHFFFAOYSA-N	0	0	283.202	4.266	20	30		CIEDRN
N#Cc1cc(NCc2cc(Cl)ccc2F)ccc1F	ZINC000160809061	330876400	/nfs/dbraw/zinc/87/64/00/330876400.db2.gz	DFZVWTLEQWXYPU-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@@H]1C[C@H](C(C)C)c2ccccc21	ZINC000447967745	330881699	/nfs/dbraw/zinc/88/16/99/330881699.db2.gz	ZZAAZOWTXDTVPK-IAOVAPTHSA-N	0	0	286.419	4.135	20	30		CIEDRN
CC1(C#N)CCC(Nc2ccc(Br)cc2)CC1	ZINC000449004466	330890707	/nfs/dbraw/zinc/89/07/07/330890707.db2.gz	XSZDISRXYAGQDN-UHFFFAOYSA-N	0	0	293.208	4.333	20	30		CIEDRN
C[C@@H](C#N)CN(Cc1cc(Cl)sc1Cl)C1CC1	ZINC000449037997	330894511	/nfs/dbraw/zinc/89/45/11/330894511.db2.gz	QRRDWUJKIRWCGX-QMMMGPOBSA-N	0	0	289.231	4.179	20	30		CIEDRN
C=CCCCC[C@@H](C)Nc1ccc(F)c(NC(C)=O)c1	ZINC000449046240	330895072	/nfs/dbraw/zinc/89/50/72/330895072.db2.gz	LHNWGBYHKMTSSB-GFCCVEGCSA-N	0	0	278.371	4.331	20	30		CIEDRN
C=CCCCC[C@H](C)Nc1ccc(F)c(NC(C)=O)c1	ZINC000449046241	330895123	/nfs/dbraw/zinc/89/51/23/330895123.db2.gz	LHNWGBYHKMTSSB-LBPRGKRZSA-N	0	0	278.371	4.331	20	30		CIEDRN
CC1(C#N)CCC(Nc2cc(F)cc(Cl)c2)CC1	ZINC000449046807	330895259	/nfs/dbraw/zinc/89/52/59/330895259.db2.gz	OBSGHWGZVDUSMH-UHFFFAOYSA-N	0	0	266.747	4.363	20	30		CIEDRN
CO[C@H](C)c1cccc(NC2CCC(C)(C#N)CC2)c1	ZINC000449054072	330895580	/nfs/dbraw/zinc/89/55/80/330895580.db2.gz	NMYPBYCKELOKFJ-BZOOQXSSSA-N	0	0	272.392	4.278	20	30		CIEDRN
COc1cc(C)ccc1CN[C@@H](CCC#N)c1ccccc1	ZINC000449205869	330906168	/nfs/dbraw/zinc/90/61/68/330906168.db2.gz	OHEIXRIGDPWWBN-SFHVURJKSA-N	0	0	294.398	4.138	20	30		CIEDRN
N#CCc1cccc(N[C@H]2CCCC[C@@H]2C2CC2)c1	ZINC000449692255	330943930	/nfs/dbraw/zinc/94/39/30/330943930.db2.gz	AWNYVILPZWYGRV-SJORKVTESA-N	0	0	254.377	4.133	20	30		CIEDRN
COc1ccc([C@H](C)[C@@H](C)Nc2cccc(CC#N)c2)cc1	ZINC000449704390	330945167	/nfs/dbraw/zinc/94/51/67/330945167.db2.gz	VUMCMSACLGAPDK-HUUCEWRRSA-N	0	0	294.398	4.365	20	30		CIEDRN
Cc1nn(C(C)(C)C)c(C)c1CNc1cc(C)cc(C#N)c1	ZINC000449760898	330948421	/nfs/dbraw/zinc/94/84/21/330948421.db2.gz	SIABDNUDOKDYJO-UHFFFAOYSA-N	0	0	296.418	4.047	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@H](c3ccccc3C)C2)CCCC1	ZINC000449831096	330951502	/nfs/dbraw/zinc/95/15/02/330951502.db2.gz	SOKPSJKXQWCPOV-KRWDZBQOSA-N	0	0	297.442	4.447	20	30		CIEDRN
C=CC(C)(C)C(=O)Nc1sc2c(c1C)CCCC2	ZINC000449938107	330955521	/nfs/dbraw/zinc/95/55/21/330955521.db2.gz	IFJFIPOFSMIDCC-UHFFFAOYSA-N	0	0	263.406	4.086	20	30		CIEDRN
CCCNc1ccc(C#N)cc1NC(=O)c1cc(C)cs1	ZINC000449936410	330955546	/nfs/dbraw/zinc/95/55/46/330955546.db2.gz	CWJKLYZMQRTGTO-UHFFFAOYSA-N	0	0	299.399	4.002	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(-c3ncco3)cc2)CCCC1	ZINC000450328780	330972865	/nfs/dbraw/zinc/97/28/65/330972865.db2.gz	PCTZKASYTXEGNC-UHFFFAOYSA-N	0	0	296.370	4.417	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc3c(c2)COC3)CCCCC1	ZINC000450355241	330974350	/nfs/dbraw/zinc/97/43/50/330974350.db2.gz	QBOJELXRZQRJBP-UHFFFAOYSA-N	0	0	285.387	4.182	20	30		CIEDRN
N#Cc1c(Cl)cccc1N[C@@H]1CCCC(F)(F)C1	ZINC000450383977	330975607	/nfs/dbraw/zinc/97/56/07/330975607.db2.gz	APFJMTGXTLJLDR-SECBINFHSA-N	0	0	270.710	4.201	20	30		CIEDRN
C[C@@H]1C[C@H](c2cccnc2)N(c2cccc(Cl)c2C#N)C1	ZINC000450444217	330980047	/nfs/dbraw/zinc/98/00/47/330980047.db2.gz	XYYQGFQTOAYXHS-SJKOYZFVSA-N	0	0	297.789	4.194	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@@H]1CC=C(c2ccc(F)cc2)CC1	ZINC000450466808	330981875	/nfs/dbraw/zinc/98/18/75/330981875.db2.gz	JTJAOJKQJZQPEU-MRXNPFEDSA-N	0	0	287.378	4.090	20	30		CIEDRN
N#CCC1(CNc2ccnc3cc(F)c(Cl)cc32)CC1	ZINC000450502842	330984128	/nfs/dbraw/zinc/98/41/28/330984128.db2.gz	QSJIDCRHXLATJQ-UHFFFAOYSA-N	0	0	289.741	4.133	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1c(C)cccc1Cl	ZINC000450655696	330991542	/nfs/dbraw/zinc/99/15/42/330991542.db2.gz	ZBUOZHNLZMTGQB-LBPRGKRZSA-N	0	0	265.784	4.123	20	30		CIEDRN
CC[C@@H](NCC1(C#N)CCC1)c1ccccc1OC(F)F	ZINC000450668533	330992215	/nfs/dbraw/zinc/99/22/15/330992215.db2.gz	ZYFIBIQLBOEVJN-CYBMUJFWSA-N	0	0	294.345	4.023	20	30		CIEDRN
Cc1cc([N+](=O)[O-])cc(Cl)c1N[C@H]1CC[C@@H](CC#N)C1	ZINC000450672953	330992541	/nfs/dbraw/zinc/99/25/41/330992541.db2.gz	MKWLZKSRNYZGHB-QWRGUYRKSA-N	0	0	293.754	4.051	20	30		CIEDRN
N#CC1(CSc2ccc(F)c(Cl)c2)CCC1	ZINC000450710588	330994854	/nfs/dbraw/zinc/99/48/54/330994854.db2.gz	GVGXYAZRPZBOHI-UHFFFAOYSA-N	0	0	255.745	4.265	20	30		CIEDRN
N#Cc1ccc(N2CCCC[C@@H]2c2ccc(Cl)cc2)nc1	ZINC000450822354	331001096	/nfs/dbraw/zinc/00/10/96/331001096.db2.gz	BADSTBFSNIGDOT-MRXNPFEDSA-N	0	0	297.789	4.338	20	30		CIEDRN
N#C[C@H]1CC[C@H](SCc2cccc(Cl)c2)C1	ZINC000450825323	331001322	/nfs/dbraw/zinc/00/13/22/331001322.db2.gz	YFOHQLUQIAXDMY-GWCFXTLKSA-N	0	0	251.782	4.265	20	30		CIEDRN
N#C[C@H]1CC[C@@H](SCc2cccc(OC(F)F)c2)C1	ZINC000450863734	331003651	/nfs/dbraw/zinc/00/36/51/331003651.db2.gz	SONIGGUJFLLCCE-GXFFZTMASA-N	0	0	283.343	4.213	20	30		CIEDRN
N#CC1(CSc2nc3cc(F)cc(Cl)c3o2)CCC1	ZINC000450908728	331006534	/nfs/dbraw/zinc/00/65/34/331006534.db2.gz	MRUORIKCJYTVBX-UHFFFAOYSA-N	0	0	296.754	4.406	20	30		CIEDRN
N#CC1(COc2ccc(OCC3CC3)c(Cl)c2)CCC1	ZINC000450965922	331009032	/nfs/dbraw/zinc/00/90/32/331009032.db2.gz	IUGOEEDHSORURM-UHFFFAOYSA-N	0	0	291.778	4.201	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H](C)c2ccc(Cl)cn2)CCCC1	ZINC000450965359	331009118	/nfs/dbraw/zinc/00/91/18/331009118.db2.gz	XBMFAANHIDIVOZ-LBPRGKRZSA-N	0	0	292.810	4.049	20	30		CIEDRN
C=CC(C)(C)C(=O)NC[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000451030615	331012542	/nfs/dbraw/zinc/01/25/42/331012542.db2.gz	JFSVNRDBFPJEDU-NSHDSACASA-N	0	0	299.336	4.137	20	30		CIEDRN
C=CCC1(C(=O)N[C@H]2CCCc3c(O)cccc32)CCCC1	ZINC000451133117	331016883	/nfs/dbraw/zinc/01/68/83/331016883.db2.gz	ZKETXWMOKLZJKI-INIZCTEOSA-N	0	0	299.414	4.022	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@@H](C)C(F)(F)C2)CCCCC1	ZINC000451174095	331018743	/nfs/dbraw/zinc/01/87/43/331018743.db2.gz	XUFYTWWPJNBYQL-CYBMUJFWSA-N	0	0	285.378	4.017	20	30		CIEDRN
C=CCCCNC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000451298091	331023652	/nfs/dbraw/zinc/02/36/52/331023652.db2.gz	VKXYLZOPVZWWGX-GXTWGEPZSA-N	0	0	295.785	4.055	20	30		CIEDRN
CCC(C)(C)c1ccc(NC(=O)c2cc(C#N)[nH]c2C)cc1	ZINC000451307976	331023952	/nfs/dbraw/zinc/02/39/52/331023952.db2.gz	BTZQZFFUHGFNTP-UHFFFAOYSA-N	0	0	295.386	4.135	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)C[C@@H]1CC[C@H]2C[C@H]21	ZINC000451325931	331024517	/nfs/dbraw/zinc/02/45/17/331024517.db2.gz	PDJRFBHVXPVPOE-OKZBNKHCSA-N	0	0	283.415	4.028	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(O)cc2CC)CCCC1	ZINC000451352680	331025299	/nfs/dbraw/zinc/02/52/99/331025299.db2.gz	LUXMFBYAHQBRNB-UHFFFAOYSA-N	0	0	273.376	4.030	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(O)cc2CC)CCCCC1	ZINC000451355681	331025444	/nfs/dbraw/zinc/02/54/44/331025444.db2.gz	VURNAPZZCDSNMC-UHFFFAOYSA-N	0	0	287.403	4.420	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)C[C@@H]1CC[C@H]2C[C@H]21	ZINC000451458204	331030257	/nfs/dbraw/zinc/03/02/57/331030257.db2.gz	OGKLCCPNUNETMB-HRCADAONSA-N	0	0	269.388	4.180	20	30		CIEDRN
C=CCC1(C(=O)N2CCC(C)=C(c3ccco3)C2)CCCC1	ZINC000451517485	331032142	/nfs/dbraw/zinc/03/21/42/331032142.db2.gz	JTMFXGJJYLMTDP-UHFFFAOYSA-N	0	0	299.414	4.422	20	30		CIEDRN
C=CC(C)(C)C(=O)Nc1cc(Cl)c(Cl)cc1F	ZINC000451637614	331037493	/nfs/dbraw/zinc/03/74/93/331037493.db2.gz	XTCVOCIDAGIFQO-UHFFFAOYSA-N	0	0	276.138	4.283	20	30		CIEDRN
N#Cc1ccc(CSCc2ccco2)c(Cl)c1	ZINC000163426993	331037879	/nfs/dbraw/zinc/03/78/79/331037879.db2.gz	FEVNGDMIOXJZKL-UHFFFAOYSA-N	0	0	263.749	4.238	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(F)c(C(C)=O)c2)CCCC1	ZINC000451667071	331038125	/nfs/dbraw/zinc/03/81/25/331038125.db2.gz	WENOLFVTRAWADD-UHFFFAOYSA-N	0	0	289.350	4.103	20	30		CIEDRN
C=CCC1(C(=O)N2CCC=C(c3ccco3)C2)CCCCC1	ZINC000451669652	331038290	/nfs/dbraw/zinc/03/82/90/331038290.db2.gz	YFLOZIAAYNVQEG-UHFFFAOYSA-N	0	0	299.414	4.422	20	30		CIEDRN
C/C=C\c1ccc(NC(=O)[C@@]2(C#N)CC23CCCC3)cc1	ZINC000451771088	331041520	/nfs/dbraw/zinc/04/15/20/331041520.db2.gz	QPVDHFGGEJYJHH-XBNAYTBKSA-N	0	0	280.371	4.132	20	30		CIEDRN
CCc1c2ccccc2oc1C(=O)NCC(C)(C)CCC#N	ZINC000451773382	331041619	/nfs/dbraw/zinc/04/16/19/331041619.db2.gz	LPANBTCFTXOFTE-UHFFFAOYSA-N	0	0	298.386	4.055	20	30		CIEDRN
C=C(C)CCN1CCC[C@H](C(F)(F)F)[C@@H]1C(F)(F)F	ZINC000451835424	331044286	/nfs/dbraw/zinc/04/42/86/331044286.db2.gz	FVOJVJFRFYJLQD-VHSXEESVSA-N	0	0	289.263	4.158	20	30		CIEDRN
C[C@H](c1cccc(C#N)c1)N1CC2(CCC2)[C@H]1c1ccco1	ZINC000451856363	331044853	/nfs/dbraw/zinc/04/48/53/331044853.db2.gz	PPEVLWKPJDLJDA-RDTXWAMCSA-N	0	0	292.382	4.439	20	30		CIEDRN
Cc1ccc(NC(=O)N[C@H](CCC#N)c2ccccc2)cc1	ZINC000163547325	331054782	/nfs/dbraw/zinc/05/47/82/331054782.db2.gz	SWCWKSIBBWNQQR-QGZVFWFLSA-N	0	0	293.370	4.162	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1ccc2cc[nH]c2c1)c1ccccc1	ZINC000194817141	331060918	/nfs/dbraw/zinc/06/09/18/331060918.db2.gz	WVEAOVIWINZMQC-QGZVFWFLSA-N	0	0	290.366	4.466	20	30		CIEDRN
C=CCC1(C(=O)NC[C@@H]2CCCCC2(F)F)CCCC1	ZINC000452310913	331061837	/nfs/dbraw/zinc/06/18/37/331061837.db2.gz	ULIYGKLDEPVFLP-ZDUSSCGKSA-N	0	0	285.378	4.065	20	30		CIEDRN
N#Cc1ccc(CSc2ccccc2O)c(Cl)c1	ZINC000163643906	331064991	/nfs/dbraw/zinc/06/49/91/331064991.db2.gz	FKUSIKSEPJBQEX-UHFFFAOYSA-N	0	0	275.760	4.210	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H]2C[C@@H](C)Oc3ccccc32)CCCC1	ZINC000452483408	331066075	/nfs/dbraw/zinc/06/60/75/331066075.db2.gz	WUXQCVOJQSPCGF-GDBMZVCRSA-N	0	0	299.414	4.151	20	30		CIEDRN
CC(C)C[C@]1(C)CCCN1C(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000452514365	331067144	/nfs/dbraw/zinc/06/71/44/331067144.db2.gz	SQHMRYRTNSWQNW-KXBFYZLASA-N	0	0	298.430	4.089	20	30		CIEDRN
CCCC[C@H](C)N(CCCC)C(=O)c1cc(C#N)[nH]c1C	ZINC000452518280	331067412	/nfs/dbraw/zinc/06/74/12/331067412.db2.gz	DSXODUFDOFZLEG-ZDUSSCGKSA-N	0	0	289.423	4.016	20	30		CIEDRN
CCCC[C@@H](C)N(CCCC)C(=O)c1cc(C#N)[nH]c1C	ZINC000452518277	331067451	/nfs/dbraw/zinc/06/74/51/331067451.db2.gz	DSXODUFDOFZLEG-CYBMUJFWSA-N	0	0	289.423	4.016	20	30		CIEDRN
CC[C@@H]1CCC[C@H]1CNC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000452526919	331067590	/nfs/dbraw/zinc/06/75/90/331067590.db2.gz	KYWMCMNQUOAIOW-NXHRZFHOSA-N	0	0	298.430	4.016	20	30		CIEDRN
N#Cc1cc(NCc2ccc(F)c(Cl)c2)ccc1F	ZINC000163670150	331068079	/nfs/dbraw/zinc/06/80/79/331068079.db2.gz	GJYQWVCXWDFMBF-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
CC(C)(CC(=O)N[C@H]1CC[C@@H](CC#N)C1)C1CCCCC1	ZINC000452556913	331068705	/nfs/dbraw/zinc/06/87/05/331068705.db2.gz	NLESACUHYOASRE-HOCLYGCPSA-N	0	0	290.451	4.182	20	30		CIEDRN
C[C@H]1C[C@H](CC(=O)N[C@H]2CC[C@@H](CC#N)C2)CC(C)(C)C1	ZINC000452560350	331068904	/nfs/dbraw/zinc/06/89/04/331068904.db2.gz	CPRDMNAHYFNIAQ-JONQDZQNSA-N	0	0	290.451	4.037	20	30		CIEDRN
C[C@H]1CC[C@@H](CC(=O)Nc2ccc(CC#N)cc2Cl)C1	ZINC000452642208	331070856	/nfs/dbraw/zinc/07/08/56/331070856.db2.gz	GKSOQMPZRXDZAP-WCQYABFASA-N	0	0	290.794	4.171	20	30		CIEDRN
C[C@@H]1CCC[C@H]1CC(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452642972	331070858	/nfs/dbraw/zinc/07/08/58/331070858.db2.gz	IEIUDGVFXMDCSL-YPMHNXCESA-N	0	0	290.794	4.171	20	30		CIEDRN
CC[C@H](C)CCC(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452649454	331071079	/nfs/dbraw/zinc/07/10/79/331071079.db2.gz	KBMFMRIJHVIYMN-NSHDSACASA-N	0	0	278.783	4.171	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccccc1C(C)(F)F	ZINC000452680393	331072123	/nfs/dbraw/zinc/07/21/23/331072123.db2.gz	XQNAIHFKRMCJOU-NSHDSACASA-N	0	0	267.319	4.339	20	30		CIEDRN
C=C(C)CCNC(=O)[C@@H](C)c1ccc2ccccc2c1	ZINC000452715064	331072753	/nfs/dbraw/zinc/07/27/53/331072753.db2.gz	BSPAQCRAXWCXPP-AWEZNQCLSA-N	0	0	267.372	4.026	20	30		CIEDRN
C=C(C)CCNC(=O)Cc1csc2ccc(Cl)cc12	ZINC000452715457	331072781	/nfs/dbraw/zinc/07/27/81/331072781.db2.gz	CUOXKMVZKJIDHM-UHFFFAOYSA-N	0	0	293.819	4.180	20	30		CIEDRN
C=C(C)CCNC(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1	ZINC000452722139	331073941	/nfs/dbraw/zinc/07/39/41/331073941.db2.gz	JAHSTFKGTJNBBL-MSOLQXFVSA-N	0	0	279.383	4.026	20	30		CIEDRN
C=C(C)CCNC(=O)[C@H]1C[C@H]1c1cccc(Cl)c1Cl	ZINC000452722944	331074076	/nfs/dbraw/zinc/07/40/76/331074076.db2.gz	LQRFIBRJRPGNDJ-RYUDHWBXSA-N	0	0	298.213	4.179	20	30		CIEDRN
C=CC(C)(C)CNC(=O)c1cc(SC)ccc1Cl	ZINC000452776021	331076588	/nfs/dbraw/zinc/07/65/88/331076588.db2.gz	JURRXINALFCVJR-UHFFFAOYSA-N	0	0	283.824	4.004	20	30		CIEDRN
C=CC(C)(C)CNC(=O)c1ccc(CCC(F)(F)F)cc1	ZINC000452776783	331076743	/nfs/dbraw/zinc/07/67/43/331076743.db2.gz	SKHVCHFOPRSGBP-UHFFFAOYSA-N	0	0	299.336	4.124	20	30		CIEDRN
N#CC[C@H](CC(=O)NCC1CCCCCC1)c1ccccc1	ZINC000452796637	331078097	/nfs/dbraw/zinc/07/80/97/331078097.db2.gz	SWAQGSJFDLXPSK-GOSISDBHSA-N	0	0	298.430	4.161	20	30		CIEDRN
Cc1cccc(CNc2ccccc2S[C@@H](C)CC#N)n1	ZINC000453077777	331087003	/nfs/dbraw/zinc/08/70/03/331087003.db2.gz	BSHKPDAYQOLJMX-AWEZNQCLSA-N	0	0	297.427	4.396	20	30		CIEDRN
CCSCCNc1ccccc1SC[C@@H](C)C#N	ZINC000453081500	331087382	/nfs/dbraw/zinc/08/73/82/331087382.db2.gz	FYVYQWRRKFGZOC-LBPRGKRZSA-N	0	0	280.462	4.103	20	30		CIEDRN
Cc1cccc(CNc2ccccc2SC[C@H](C)C#N)n1	ZINC000453086428	331087860	/nfs/dbraw/zinc/08/78/60/331087860.db2.gz	LDYVRHPKHNHVOE-CYBMUJFWSA-N	0	0	297.427	4.254	20	30		CIEDRN
CC(C)(C)c1cc(CNc2ccc(C#N)cc2Cl)no1	ZINC000453105867	331089719	/nfs/dbraw/zinc/08/97/19/331089719.db2.gz	HZQCNTDORPYHGW-UHFFFAOYSA-N	0	0	289.766	4.109	20	30		CIEDRN
C=C[C@@H]1OCC[C@H]1c1nc(-c2ccc3sccc3c2)no1	ZINC000453114749	331090495	/nfs/dbraw/zinc/09/04/95/331090495.db2.gz	GXVPVOCETYVRSK-OLZOCXBDSA-N	0	0	298.367	4.010	20	30		CIEDRN
N#CCc1ccc(NCCCC2CCOCC2)c(Cl)c1	ZINC000453132029	331092506	/nfs/dbraw/zinc/09/25/06/331092506.db2.gz	QAXCFCZFRYGLHQ-UHFFFAOYSA-N	0	0	292.810	4.025	20	30		CIEDRN
CCOc1ccc(Cl)c(NCCCC(C)(C)C#N)c1	ZINC000453154194	331094856	/nfs/dbraw/zinc/09/48/56/331094856.db2.gz	RLDPDGGGEVJOJG-UHFFFAOYSA-N	0	0	280.799	4.481	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2scnc2C(C)C)n1	ZINC000453184896	331098550	/nfs/dbraw/zinc/09/85/50/331098550.db2.gz	JHOWLMGEOVVMEU-UHFFFAOYSA-N	0	0	277.393	4.170	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H](CC)CC(F)(F)F)n1	ZINC000453189639	331099241	/nfs/dbraw/zinc/09/92/41/331099241.db2.gz	RWBVVZFNMKVUSF-VIFPVBQESA-N	0	0	276.302	4.369	20	30		CIEDRN
C=CCCC1(c2nc([C@H]3CSc4ccccc43)no2)CC1	ZINC000453211376	331101831	/nfs/dbraw/zinc/10/18/31/331101831.db2.gz	FEJJZXYECZLSKZ-ZDUSSCGKSA-N	0	0	298.411	4.305	20	30		CIEDRN
C=CCCc1noc([C@@H]2C[C@H]2c2ccccc2Cl)n1	ZINC000453212847	331101981	/nfs/dbraw/zinc/10/19/81/331101981.db2.gz	BEHSFZSWWBBIDH-NWDGAFQWSA-N	0	0	274.751	4.113	20	30		CIEDRN
C=CCCc1noc([C@@H]2C[C@H]2c2c(F)cccc2Cl)n1	ZINC000453233287	331104804	/nfs/dbraw/zinc/10/48/04/331104804.db2.gz	JWYWYBDGEGNQDT-NXEZZACHSA-N	0	0	292.741	4.252	20	30		CIEDRN
C=CCCc1noc([C@@H]2C[C@@H]2c2c(F)cccc2Cl)n1	ZINC000453233292	331104898	/nfs/dbraw/zinc/10/48/98/331104898.db2.gz	JWYWYBDGEGNQDT-VHSXEESVSA-N	0	0	292.741	4.252	20	30		CIEDRN
C=CCCc1noc([C@H](C)c2ccc(C(=O)C(C)C)cc2)n1	ZINC000453234541	331104982	/nfs/dbraw/zinc/10/49/82/331104982.db2.gz	LHCRLXWMBWJPRL-CYBMUJFWSA-N	0	0	298.386	4.179	20	30		CIEDRN
N#Cc1ccc2c(c1)[C@H](Nc1ccccc1OCCF)CC2	ZINC000453247231	331107023	/nfs/dbraw/zinc/10/70/23/331107023.db2.gz	DPYPQWMBZHTAPA-MRXNPFEDSA-N	0	0	296.345	4.006	20	30		CIEDRN
CCCn1ncc(N[C@H](C)c2ccc(C#N)cc2)c1C1CC1	ZINC000453287961	331111516	/nfs/dbraw/zinc/11/15/16/331111516.db2.gz	LEKMDHPOIXNNJJ-CYBMUJFWSA-N	0	0	294.402	4.215	20	30		CIEDRN
CCc1ccc(N[C@@H](C)c2cccc(C#N)c2)cc1OC	ZINC000453391689	331127348	/nfs/dbraw/zinc/12/73/48/331127348.db2.gz	ZAULDAZGPOQRIE-ZDUSSCGKSA-N	0	0	280.371	4.302	20	30		CIEDRN
CCCN(Cc1ccc(C#N)cc1)C(=O)C1=CC[C@H](C)CC1	ZINC000454593907	331149427	/nfs/dbraw/zinc/14/94/27/331149427.db2.gz	MGYAKZJUEKVTNQ-HNNXBMFYSA-N	0	0	296.414	4.043	20	30		CIEDRN
C[C@@H]1CC=C(C(=O)Nc2cccc(OCCCC#N)c2)CC1	ZINC000454862857	331155196	/nfs/dbraw/zinc/15/51/96/331155196.db2.gz	PLYSSGBICGCROI-CQSZACIVSA-N	0	0	298.386	4.054	20	30		CIEDRN
C=CCCCN(C)C(=O)N[C@@H](C)c1cccc(C2CC2)c1	ZINC000455120423	331161102	/nfs/dbraw/zinc/16/11/02/331161102.db2.gz	SRJZJSYXBFDFFC-AWEZNQCLSA-N	0	0	286.419	4.233	20	30		CIEDRN
C=CC(C)(C)CNC(=O)Nc1c(C)c(C)ccc1Cl	ZINC000455282684	331164326	/nfs/dbraw/zinc/16/43/26/331164326.db2.gz	UZKXTFAJFRCQPP-UHFFFAOYSA-N	0	0	280.799	4.291	20	30		CIEDRN
C=C(C)CCNC(=O)N(CC)[C@@H](CC)c1ccccc1	ZINC000455310840	331165446	/nfs/dbraw/zinc/16/54/46/331165446.db2.gz	MZWYCZGYLFHSGF-INIZCTEOSA-N	0	0	274.408	4.135	20	30		CIEDRN
C=C(C)CCNC(=O)N(C)[C@@H](C)c1ccc(Cl)cc1	ZINC000455317326	331165904	/nfs/dbraw/zinc/16/59/04/331165904.db2.gz	XBALIKAJNPBXNS-LBPRGKRZSA-N	0	0	280.799	4.009	20	30		CIEDRN
CC#CCN(C)C(=O)Nc1cc(-c2ccc(C)o2)ccc1C	ZINC000455358305	331166889	/nfs/dbraw/zinc/16/68/89/331166889.db2.gz	RZMHEBVAGQDGNB-UHFFFAOYSA-N	0	0	296.370	4.050	20	30		CIEDRN
C=CC(C)(C)CNC(=O)N(C)[C@@H](C)c1ccc(Cl)cc1	ZINC000455371533	331167515	/nfs/dbraw/zinc/16/75/15/331167515.db2.gz	SMUKILUHJUBRNG-LBPRGKRZSA-N	0	0	294.826	4.255	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CC[C@H](CC2CC2)C1	ZINC000455378965	331167852	/nfs/dbraw/zinc/16/78/52/331167852.db2.gz	GSONKKSQPCJTMD-MRXNPFEDSA-N	0	0	298.430	4.459	20	30		CIEDRN
C=C(CC)CNC(=O)N(C)Cc1csc2ccccc12	ZINC000455527931	331172325	/nfs/dbraw/zinc/17/23/25/331172325.db2.gz	WHJMYHDVWHWBFZ-UHFFFAOYSA-N	0	0	288.416	4.009	20	30		CIEDRN
C=C(CC)CNC(=O)N1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2	ZINC000455550790	331172947	/nfs/dbraw/zinc/17/29/47/331172947.db2.gz	YRHWOAHUGQWVHK-BCDXTJNWSA-N	0	0	298.430	4.073	20	30		CIEDRN
C=C(CC)CNC(=O)N(C)[C@@H](C)c1ccc(Cl)cc1	ZINC000455565982	331173048	/nfs/dbraw/zinc/17/30/48/331173048.db2.gz	XMNFJJBJTAAJNP-LBPRGKRZSA-N	0	0	280.799	4.009	20	30		CIEDRN
C=C(CC)CNC(=O)N(C)[C@H](C)c1cc2ccccc2o1	ZINC000455564146	331173060	/nfs/dbraw/zinc/17/30/60/331173060.db2.gz	UUVFTIWPOVJPIL-CYBMUJFWSA-N	0	0	286.375	4.101	20	30		CIEDRN
C=C(CC)CNC(=O)N(C)[C@H](C)c1ccc(Cl)cc1	ZINC000455565981	331173091	/nfs/dbraw/zinc/17/30/91/331173091.db2.gz	XMNFJJBJTAAJNP-GFCCVEGCSA-N	0	0	280.799	4.009	20	30		CIEDRN
C=C(CC)CNC(=O)N(C)[C@@H](C)c1cc2ccccc2o1	ZINC000455564149	331173113	/nfs/dbraw/zinc/17/31/13/331173113.db2.gz	UUVFTIWPOVJPIL-ZDUSSCGKSA-N	0	0	286.375	4.101	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1cc(C)c(C)cc1Cl	ZINC000455732614	331176502	/nfs/dbraw/zinc/17/65/02/331176502.db2.gz	MKYNHVAVJQMNQK-LLVKDONJSA-N	0	0	266.772	4.043	20	30		CIEDRN
CC(C)(CCC#N)CNC(=O)Nc1ccc2c(c1)CCCC2	ZINC000455734536	331176625	/nfs/dbraw/zinc/17/66/25/331176625.db2.gz	QHPIWKLACPZXPP-UHFFFAOYSA-N	0	0	299.418	4.017	20	30		CIEDRN
C=CCN(C(=O)Nc1cc(C)c(C)cc1Cl)C1CC1	ZINC000455753287	331177101	/nfs/dbraw/zinc/17/71/01/331177101.db2.gz	VGNILKQOULKRDL-UHFFFAOYSA-N	0	0	278.783	4.139	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccccc1C(C)(F)F	ZINC000455799818	331177946	/nfs/dbraw/zinc/17/79/46/331177946.db2.gz	DXJDNTDADSLAMK-UHFFFAOYSA-N	0	0	282.334	4.228	20	30		CIEDRN
C=CCC1(NC(=O)Nc2cccc(CC#N)c2)CCCCC1	ZINC000455910209	331180589	/nfs/dbraw/zinc/18/05/89/331180589.db2.gz	UBZMJJQVNXRFHX-UHFFFAOYSA-N	0	0	297.402	4.153	20	30		CIEDRN
C[C@H](CCC(C)(C)C)NC(=O)Nc1cccc(CC#N)c1	ZINC000455916454	331180921	/nfs/dbraw/zinc/18/09/21/331180921.db2.gz	ILAZJSBJYMOQME-CYBMUJFWSA-N	0	0	287.407	4.089	20	30		CIEDRN
CC(C)C[C@H]1CCCN(C(=O)Nc2cccc(CC#N)c2)C1	ZINC000455920213	331181148	/nfs/dbraw/zinc/18/11/48/331181148.db2.gz	NGNFPYTZSMJICR-MRXNPFEDSA-N	0	0	299.418	4.043	20	30		CIEDRN
CC(C)CCC[C@@H](C)NC(=O)Nc1cccc(CC#N)c1	ZINC000455921453	331181158	/nfs/dbraw/zinc/18/11/58/331181158.db2.gz	OVDOAYXSLAFQQK-CQSZACIVSA-N	0	0	287.407	4.089	20	30		CIEDRN
CC1(C)CC=C(C(=O)N[C@H](CCC#N)c2ccccc2)CC1	ZINC000455987891	331181927	/nfs/dbraw/zinc/18/19/27/331181927.db2.gz	FMQYKXMTOULRDH-QGZVFWFLSA-N	0	0	296.414	4.284	20	30		CIEDRN
CC[C@H](NC(=O)Nc1cc(C)cc(C#N)c1)c1cccs1	ZINC000456016165	331182515	/nfs/dbraw/zinc/18/25/15/331182515.db2.gz	YXVQOUGJBWQOSL-AWEZNQCLSA-N	0	0	299.399	4.201	20	30		CIEDRN
C=CCCN(C)C(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000456028264	331182796	/nfs/dbraw/zinc/18/27/96/331182796.db2.gz	PNBOWNBGWSZRKV-NWDGAFQWSA-N	0	0	298.213	4.131	20	30		CIEDRN
C[C@@H]1CC=C(C(=O)N[C@@H](CCCC#N)c2ccccc2)CC1	ZINC000456077211	331183966	/nfs/dbraw/zinc/18/39/66/331183966.db2.gz	ZBHMGIVMBLUPEQ-QAPCUYQASA-N	0	0	296.414	4.284	20	30		CIEDRN
C=CCC1(C(=O)N2C[C@@H](C3CC3)[C@@H]2C2CC2)CCCCC1	ZINC000456259497	331187655	/nfs/dbraw/zinc/18/76/55/331187655.db2.gz	RKSOCEKLZDKFCV-IRXDYDNUSA-N	0	0	287.447	4.160	20	30		CIEDRN
CCCCCc1ccc(NC(=O)N[C@@H](CC)CC#N)cc1	ZINC000460125061	331193224	/nfs/dbraw/zinc/19/32/24/331193224.db2.gz	OENISJIVGYSTDJ-HNNXBMFYSA-N	0	0	287.407	4.233	20	30		CIEDRN
C=CCC1(CNC(=O)c2ccccc2SC)CCCC1	ZINC000456481236	331193446	/nfs/dbraw/zinc/19/34/46/331193446.db2.gz	AXSCKWVEIGVKGM-UHFFFAOYSA-N	0	0	289.444	4.275	20	30		CIEDRN
Cc1ccsc1CCCC(=O)Nc1cccc(CC#N)c1	ZINC000456745590	331199892	/nfs/dbraw/zinc/19/98/92/331199892.db2.gz	HIYJKFYOIGWFQX-UHFFFAOYSA-N	0	0	298.411	4.084	20	30		CIEDRN
C=CCCCc1nc(C2(c3ccccc3)CCC2)no1	ZINC000460133628	331205305	/nfs/dbraw/zinc/20/53/05/331205305.db2.gz	HMGUEIVCUCHAGO-UHFFFAOYSA-N	0	0	268.360	4.048	20	30		CIEDRN
C=CCCOCCCCC(=O)NC[C@H]1CCCC(C)(C)C1	ZINC000456893214	331208413	/nfs/dbraw/zinc/20/84/13/331208413.db2.gz	ZALSUNAWDKYBOS-INIZCTEOSA-N	0	0	295.467	4.082	20	30		CIEDRN
C=CCCOCCCCC(=O)N[C@@H](C)[C@@H]1CCC[C@H](C)C1	ZINC000456997412	331209785	/nfs/dbraw/zinc/20/97/85/331209785.db2.gz	ITJQLBGYIMXKKB-YESZJQIVSA-N	0	0	295.467	4.080	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@@H](CC(C)(C)C)C1	ZINC000457036096	331210690	/nfs/dbraw/zinc/21/06/90/331210690.db2.gz	WYUIIBKGYMYOKI-AWEZNQCLSA-N	0	0	263.425	4.040	20	30		CIEDRN
C=CCCC(=O)N[C@H]1CC[C@H](c2cccc(Cl)c2)C1	ZINC000457052852	331210975	/nfs/dbraw/zinc/21/09/75/331210975.db2.gz	ATHBGEAVKFXMHU-ZFWWWQNUSA-N	0	0	277.795	4.059	20	30		CIEDRN
CC[C@]1(C(C)C)C[C@H]1NC(=O)C[C@H](CC#N)c1ccccc1	ZINC000457308567	331218620	/nfs/dbraw/zinc/21/86/20/331218620.db2.gz	WKTOKOGAENFTMM-YQVWRLOYSA-N	0	0	298.430	4.015	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N1CC(C(C)(C)C)C1	ZINC000457337966	331219370	/nfs/dbraw/zinc/21/93/70/331219370.db2.gz	FLFSAOOOAXMBNL-UHFFFAOYSA-N	0	0	289.444	4.083	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)[C@@H](CC)CC(F)F)c1	ZINC000457545485	331226596	/nfs/dbraw/zinc/22/65/96/331226596.db2.gz	WCDQEXSKKRSSML-LBPRGKRZSA-N	0	0	297.345	4.261	20	30		CIEDRN
C=C(C)[C@H]1OCCC[C@H]1C(=O)Nc1ccc(/C=C\C)cc1	ZINC000457809572	331235090	/nfs/dbraw/zinc/23/50/90/331235090.db2.gz	OWDSXNUTLKLMJC-LYYDLTQRSA-N	0	0	285.387	4.030	20	30		CIEDRN
CC(C)(CC#N)CNC(=O)c1cscc1-c1ccccc1	ZINC000458015704	331240892	/nfs/dbraw/zinc/24/08/92/331240892.db2.gz	DFKLUYQWPDIDJU-UHFFFAOYSA-N	0	0	298.411	4.085	20	30		CIEDRN
C=CCC1(C(=O)NC2CCC(C(F)F)CC2)CCCC1	ZINC000458156103	331243918	/nfs/dbraw/zinc/24/39/18/331243918.db2.gz	DULOVKFVSIQACY-UHFFFAOYSA-N	0	0	285.378	4.063	20	30		CIEDRN
CC1(NC(=O)N[C@@H](CCCC#N)c2ccccc2)CCCC1	ZINC000458265242	331246769	/nfs/dbraw/zinc/24/67/69/331246769.db2.gz	NRYPHQTWMMOCMQ-INIZCTEOSA-N	0	0	299.418	4.053	20	30		CIEDRN
CCCC[C@H](C)N(CCCC)C(=O)NCC1(CC#N)CC1	ZINC000458718691	331257664	/nfs/dbraw/zinc/25/76/64/331257664.db2.gz	BKJXSNKLICEJCO-HNNXBMFYSA-N	0	0	293.455	4.071	20	30		CIEDRN
C[C@@H]1CC[C@@H](C)N1C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000458797690	331260026	/nfs/dbraw/zinc/26/00/26/331260026.db2.gz	GNXJXCRLRSRKJQ-BFYDXBDKSA-N	0	0	299.418	4.004	20	30		CIEDRN
CC[C@@H]1CCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000458798620	331260041	/nfs/dbraw/zinc/26/00/41/331260041.db2.gz	IFUQGSUBRLGMCC-SJORKVTESA-N	0	0	299.418	4.006	20	30		CIEDRN
C=CC(C)(C)CNC(=O)N(Cc1ccc(C)s1)C(C)C	ZINC000458993469	331264941	/nfs/dbraw/zinc/26/49/41/331264941.db2.gz	XNAZUFFFYDQYJJ-UHFFFAOYSA-N	0	0	294.464	4.189	20	30		CIEDRN
C=C(C)CCNC(=O)N1CC[C@H](C)C[C@@H]1c1ccc(C)o1	ZINC000459009256	331266165	/nfs/dbraw/zinc/26/61/65/331266165.db2.gz	VLPVMKQPPQNLLK-DZGCQCFKSA-N	0	0	290.407	4.037	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)NCC(=C)CC	ZINC000459080557	331269488	/nfs/dbraw/zinc/26/94/88/331269488.db2.gz	PSGKCQJRCCVVBL-UHFFFAOYSA-N	0	0	298.839	4.065	20	30		CIEDRN
N#C[C@@H]1CCC[C@H]1NCc1ccc(-c2cccs2)cc1	ZINC000459482806	331284313	/nfs/dbraw/zinc/28/43/13/331284313.db2.gz	RNRSMDLPLOFJAE-JKSUJKDBSA-N	0	0	282.412	4.197	20	30		CIEDRN
CCC[C@H](NC(=O)Nc1cccc(CC#N)c1)C1CCCC1	ZINC000459610082	331290507	/nfs/dbraw/zinc/29/05/07/331290507.db2.gz	MGGCGUCYSQLSEN-KRWDZBQOSA-N	0	0	299.418	4.233	20	30		CIEDRN
CC[C@H]1CCC[C@@H]1C(=O)Nc1sc(C)c(C)c1C#N	ZINC000459846904	331302528	/nfs/dbraw/zinc/30/25/28/331302528.db2.gz	RUXYFMJXOFFSIX-RYUDHWBXSA-N	0	0	276.405	4.001	20	30		CIEDRN
C=CCC1(C(=O)N2CCC[C@@H]3CCCC[C@@H]32)CCCC1	ZINC000459876561	331302731	/nfs/dbraw/zinc/30/27/31/331302731.db2.gz	ORDFBKDAKIJWNJ-HOTGVXAUSA-N	0	0	275.436	4.304	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@@]1(C)CCC[C@H]1C	ZINC000459876411	331302787	/nfs/dbraw/zinc/30/27/87/331302787.db2.gz	DJAJQSUBZWIDRS-CJNGLKHVSA-N	0	0	277.433	4.089	20	30		CIEDRN
Cc1ccc(C)c([C@@H](C)N(C)C(=O)c2cscc2C#N)c1	ZINC000459972608	331303940	/nfs/dbraw/zinc/30/39/40/331303940.db2.gz	LOVQOKQTHHLJEV-CYBMUJFWSA-N	0	0	298.411	4.070	20	30		CIEDRN
N#Cc1cccc(NCc2ccc(F)cc2C(F)(F)F)c1	ZINC000167081642	331307789	/nfs/dbraw/zinc/30/77/89/331307789.db2.gz	RMQWKKUPAQEASA-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
CC(C)(C)c1ccccc1C(=O)Nc1ccc(C#N)cc1	ZINC000166999501	331307879	/nfs/dbraw/zinc/30/78/79/331307879.db2.gz	SNWPLRWOGCSUCL-UHFFFAOYSA-N	0	0	278.355	4.108	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)c1nnc(C(C)C)n1CC	ZINC000460238789	331308553	/nfs/dbraw/zinc/30/85/53/331308553.db2.gz	QFZYLMDGYVFEIG-UHFFFAOYSA-N	0	0	298.434	4.004	20	30		CIEDRN
C=CCCC(=O)N1CC[C@@H](Cc2ccc(C(C)C)cc2)C1	ZINC000461189783	331311844	/nfs/dbraw/zinc/31/18/44/331311844.db2.gz	IUSFGSFYXNDDPL-KRWDZBQOSA-N	0	0	285.431	4.167	20	30		CIEDRN
Cc1nc(N2CCC[C@H]2c2ccccc2)c(Cl)cc1C#N	ZINC000461731103	331314128	/nfs/dbraw/zinc/31/41/28/331314128.db2.gz	ONVSPKDKZBEGNL-INIZCTEOSA-N	0	0	297.789	4.257	20	30		CIEDRN
C[C@H](c1nc(C2CCCCC2)no1)c1cccc(C#N)c1	ZINC000461789139	331314733	/nfs/dbraw/zinc/31/47/33/331314733.db2.gz	BUROFUDBLQXYPB-LBPRGKRZSA-N	0	0	281.359	4.141	20	30		CIEDRN
CCCC1CCC(NC(=O)[C@H](C)c2cccc(C#N)c2)CC1	ZINC000461921369	331315528	/nfs/dbraw/zinc/31/55/28/331315528.db2.gz	LPQKISUTJPJBMG-KSTDHSDQSA-N	0	0	298.430	4.137	20	30		CIEDRN
CCCCCN(CCCCC)C(=O)N[C@@H]1CCC[C@@H]1C#N	ZINC000461961890	331315782	/nfs/dbraw/zinc/31/57/82/331315782.db2.gz	WISJIRFJCCZVCJ-HZPDHXFCSA-N	0	0	293.455	4.071	20	30		CIEDRN
Cc1nc(NC[C@H]2CCCC(F)(F)C2)c(Cl)cc1C#N	ZINC000461955651	331316194	/nfs/dbraw/zinc/31/61/94/331316194.db2.gz	FVZYFXYWBOGVKH-JTQLQIEISA-N	0	0	299.752	4.153	20	30		CIEDRN
CCCCCN(C(=O)N[C@@H]1CCC[C@@H]1C#N)[C@@H](C)CCC	ZINC000461961660	331316324	/nfs/dbraw/zinc/31/63/24/331316324.db2.gz	BHURGMDTQDTHCI-ARFHVFGLSA-N	0	0	293.455	4.069	20	30		CIEDRN
Cc1nc(N2CCCC23CCCCC3)c(Cl)cc1C#N	ZINC000461974112	331316514	/nfs/dbraw/zinc/31/65/14/331316514.db2.gz	OFRFLRDPCFKSSF-UHFFFAOYSA-N	0	0	289.810	4.218	20	30		CIEDRN
C[C@@H](c1c(F)cccc1F)N(C)c1cccc(F)c1C#N	ZINC000499016508	331316735	/nfs/dbraw/zinc/31/67/35/331316735.db2.gz	LOCMHDVNRVZKKW-JTQLQIEISA-N	0	0	290.288	4.173	20	30		CIEDRN
CCCCN(C(=O)CCCC#N)[C@@H](CC)c1ccccc1	ZINC000462085247	331317159	/nfs/dbraw/zinc/31/71/59/331317159.db2.gz	RREZHCLKCXVURU-KRWDZBQOSA-N	0	0	286.419	4.460	20	30		CIEDRN
CCCCN(C(=O)CCCC#N)[C@H](CC)c1ccccc1	ZINC000462085248	331317227	/nfs/dbraw/zinc/31/72/27/331317227.db2.gz	RREZHCLKCXVURU-QGZVFWFLSA-N	0	0	286.419	4.460	20	30		CIEDRN
CC#CCC[N@H+](Cc1cccs1)Cc1ccccc1OC	ZINC000462318394	331319363	/nfs/dbraw/zinc/31/93/63/331319363.db2.gz	XXGOQABPGMLKNA-UHFFFAOYSA-N	0	0	299.439	4.172	20	30		CIEDRN
C[C@@H](C(=O)N(C)[C@@H](C)C1CCCCC1)c1cccc(C#N)c1	ZINC000462340273	331320111	/nfs/dbraw/zinc/32/01/11/331320111.db2.gz	LLQUHPPILBHXFT-CABCVRRESA-N	0	0	298.430	4.089	20	30		CIEDRN
CC#CCCSCc1nc(-c2ccc(Cl)cc2)no1	ZINC000462365240	331320598	/nfs/dbraw/zinc/32/05/98/331320598.db2.gz	KKZIUXWKBLPMMM-UHFFFAOYSA-N	0	0	292.791	4.037	20	30		CIEDRN
C[C@H](CNc1ccc(F)cc1C#N)c1ccc(F)cc1	ZINC000462381239	331320966	/nfs/dbraw/zinc/32/09/66/331320966.db2.gz	OXFXFQOJSPHDAS-LLVKDONJSA-N	0	0	272.298	4.052	20	30		CIEDRN
CC#CCCSCc1ccc(SC)c(OC)c1	ZINC000462380207	331320968	/nfs/dbraw/zinc/32/09/68/331320968.db2.gz	KHKYVLSHBLJLHK-UHFFFAOYSA-N	0	0	266.431	4.064	20	30		CIEDRN
C=CCC1(C(=O)NCCc2ccc(Cl)c(C)c2)CCC1	ZINC000462444651	331322060	/nfs/dbraw/zinc/32/20/60/331322060.db2.gz	DBSCNNZFCSZYPB-UHFFFAOYSA-N	0	0	291.822	4.054	20	30		CIEDRN
C=CCCC(=O)N[C@H]1c2ccccc2CC[C@@H]1C(C)C	ZINC000462589802	331323651	/nfs/dbraw/zinc/32/36/51/331323651.db2.gz	GQNFSSWVRIGGCG-CRAIPNDOSA-N	0	0	271.404	4.029	20	30		CIEDRN
C=CCOc1ccc(OCc2csc(CCC)n2)cc1	ZINC000462665342	331324853	/nfs/dbraw/zinc/32/48/53/331324853.db2.gz	IVWYJXNFRGHYLO-UHFFFAOYSA-N	0	0	289.400	4.239	20	30		CIEDRN
N#Cc1cccc(Cl)c1NC[C@@H]1CCOc2ccccc21	ZINC000462829356	331331765	/nfs/dbraw/zinc/33/17/65/331331765.db2.gz	BSWVIKFCDYDFGS-ZDUSSCGKSA-N	0	0	298.773	4.190	20	30		CIEDRN
Cc1ccccc1[C@H]1C[C@@H](C)N(c2ccc(F)cc2C#N)C1	ZINC000462852301	331332697	/nfs/dbraw/zinc/33/26/97/331332697.db2.gz	LCWSYXYYNWSHAA-ZBFHGGJFSA-N	0	0	294.373	4.388	20	30		CIEDRN
N#Cc1cc(N[C@@H]2C[C@H]2Cc2ccccc2)nc2ccccc12	ZINC000462870561	331333452	/nfs/dbraw/zinc/33/34/52/331333452.db2.gz	KEZSXCXUFGQTBN-DNVCBOLYSA-N	0	0	299.377	4.150	20	30		CIEDRN
N#Cc1cccc(Cl)c1N1CC[C@H](Cc2ccccc2)C1	ZINC000462875885	331333707	/nfs/dbraw/zinc/33/37/07/331333707.db2.gz	UNEZKOQMWACMTL-OAHLLOKOSA-N	0	0	296.801	4.281	20	30		CIEDRN
COc1ccc([C@H](C)CCNc2cccc(F)c2C#N)cc1	ZINC000462883275	331333991	/nfs/dbraw/zinc/33/39/91/331333991.db2.gz	JGJDGSACGUEEJR-CYBMUJFWSA-N	0	0	298.361	4.312	20	30		CIEDRN
C[C@@H](CNc1ccc(F)cc1C#N)Cc1cccs1	ZINC000462901964	331334371	/nfs/dbraw/zinc/33/43/71/331334371.db2.gz	GYVBONXKEFGJEF-LLVKDONJSA-N	0	0	274.364	4.050	20	30		CIEDRN
N#Cc1cccc(Cl)c1NCCCOc1ccccc1	ZINC000462916620	331335103	/nfs/dbraw/zinc/33/51/03/331335103.db2.gz	GNTWTSIKXXGLSZ-UHFFFAOYSA-N	0	0	286.762	4.093	20	30		CIEDRN
Cc1ccc(Cl)cc1Oc1ncc(C#N)cc1Cl	ZINC000462946198	331335602	/nfs/dbraw/zinc/33/56/02/331335602.db2.gz	JUZXCYBKGSDAID-UHFFFAOYSA-N	0	0	279.126	4.361	20	30		CIEDRN
CC#CCSc1nnc(-c2ccccc2)c2ccccc21	ZINC000463038951	331338290	/nfs/dbraw/zinc/33/82/90/331338290.db2.gz	QNFLETDNSPYKFK-UHFFFAOYSA-N	0	0	290.391	4.412	20	30		CIEDRN
C[C@H](c1nc(CCC(C)(C)C)no1)c1cccc(C#N)c1	ZINC000463047784	331338640	/nfs/dbraw/zinc/33/86/40/331338640.db2.gz	GWMIWSXCYLFULM-LBPRGKRZSA-N	0	0	283.375	4.072	20	30		CIEDRN
C[C@@H](c1nc(-c2ccc(Cl)o2)no1)c1cccc(C#N)c1	ZINC000463048823	331338648	/nfs/dbraw/zinc/33/86/48/331338648.db2.gz	OQEFUUAVEMQSTN-SECBINFHSA-N	0	0	299.717	4.006	20	30		CIEDRN
C[C@@H]1C[C@H](c2cccc(F)c2)N(c2cccc(F)c2C#N)C1	ZINC000463075857	331339572	/nfs/dbraw/zinc/33/95/72/331339572.db2.gz	FFWCRRFCNKSUQN-KZULUSFZSA-N	0	0	298.336	4.424	20	30		CIEDRN
C=CCOCCCC(=O)N(C)C1CCC(C(C)(C)C)CC1	ZINC000463128562	331340944	/nfs/dbraw/zinc/34/09/44/331340944.db2.gz	GYMQGOGSRQXPNT-UHFFFAOYSA-N	0	0	295.467	4.033	20	30		CIEDRN
CC(C)Oc1cc(F)ccc1N[C@@H]1CCC[C@H](C#N)C1	ZINC000463245810	331344027	/nfs/dbraw/zinc/34/40/27/331344027.db2.gz	UXACFFPDWPWIDT-GXTWGEPZSA-N	0	0	276.355	4.107	20	30		CIEDRN
Cc1ccc(N[C@H]2CCC[C@@H](C#N)C2)cc1Br	ZINC000463288251	331345347	/nfs/dbraw/zinc/34/53/47/331345347.db2.gz	ZSRLMOWSSFCNAU-NEPJUHHUSA-N	0	0	293.208	4.252	20	30		CIEDRN
CCCCOc1ccccc1N[C@H]1CCC[C@H](C#N)C1	ZINC000463290702	331345388	/nfs/dbraw/zinc/34/53/88/331345388.db2.gz	UCLRDVMKFJHQDM-GJZGRUSLSA-N	0	0	272.392	4.360	20	30		CIEDRN
CCSCc1cccc(N[C@@H]2CCC[C@H](C#N)C2)c1	ZINC000463291885	331345403	/nfs/dbraw/zinc/34/54/03/331345403.db2.gz	PZBJMFYVGDPEQT-DZGCQCFKSA-N	0	0	274.433	4.434	20	30		CIEDRN
CCCCN(C(=O)[C@H](C)c1cccc(C#N)c1)[C@H](C)CC	ZINC000463343045	331346347	/nfs/dbraw/zinc/34/63/47/331346347.db2.gz	AHTMDBBXYUBPHX-HUUCEWRRSA-N	0	0	286.419	4.089	20	30		CIEDRN
C=CCOc1cccc(NC(=O)N(CC)CC(C)(C)C)c1	ZINC000463520787	331348988	/nfs/dbraw/zinc/34/89/88/331348988.db2.gz	PKDXPPLPOKDZPJ-UHFFFAOYSA-N	0	0	290.407	4.151	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CCC)CCc1cccs1	ZINC000463540645	331349207	/nfs/dbraw/zinc/34/92/07/331349207.db2.gz	DVAKTTNAJGEKAU-UHFFFAOYSA-N	0	0	291.460	4.298	20	30		CIEDRN
Cc1cc([C@H](C)Nc2ccc([N+](=O)[O-])c(C#N)c2)ccc1F	ZINC000463646939	331350193	/nfs/dbraw/zinc/35/01/93/331350193.db2.gz	CDGPUXZIWGBBTR-NSHDSACASA-N	0	0	299.305	4.087	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1cccc(C2CCC2)c1	ZINC000463826468	331352242	/nfs/dbraw/zinc/35/22/42/331352242.db2.gz	LOJKELQWNKBGST-UHFFFAOYSA-N	0	0	272.392	4.384	20	30		CIEDRN
C=CCC(CC=C)C(=O)NCCc1c(C)oc2ccccc21	ZINC000464251756	331358629	/nfs/dbraw/zinc/35/86/29/331358629.db2.gz	SBMQSUNAPQRNBK-UHFFFAOYSA-N	0	0	297.398	4.168	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)[C@@H](CC)c1ccccc1	ZINC000464274631	331359074	/nfs/dbraw/zinc/35/90/74/331359074.db2.gz	IQKUQAUKOIMTDX-INIZCTEOSA-N	0	0	286.419	4.159	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)[C@@H](C)CC(=C)C)c1	ZINC000464438289	331360549	/nfs/dbraw/zinc/36/05/49/331360549.db2.gz	AIKGVMRBXXLALD-AWEZNQCLSA-N	0	0	273.376	4.182	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NC1CCC(CCC)CC1	ZINC000464438624	331360556	/nfs/dbraw/zinc/36/05/56/331360556.db2.gz	BERUNLYHJPWNDE-NFOMZHRRSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC)c1cc(C)ccc1C	ZINC000464441395	331360676	/nfs/dbraw/zinc/36/06/76/331360676.db2.gz	NCNJCSSVWRLXJR-HNNXBMFYSA-N	0	0	259.393	4.259	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccccc1OCCCC	ZINC000464443273	331360752	/nfs/dbraw/zinc/36/07/52/331360752.db2.gz	ZXYOVQSGWVLEFH-CQSZACIVSA-N	0	0	275.392	4.406	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](c1ccccc1)C(C)(C)C	ZINC000464448052	331360834	/nfs/dbraw/zinc/36/08/34/331360834.db2.gz	FVLQHWAYILOHRQ-HOCLYGCPSA-N	0	0	273.420	4.492	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCCC[C@H]1Cc1ccccc1	ZINC000464447989	331360844	/nfs/dbraw/zinc/36/08/44/331360844.db2.gz	UXIYMZSMIKRSQC-AEFFLSMTSA-N	0	0	285.431	4.213	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)c1cccc2ccccc21	ZINC000464450005	331360893	/nfs/dbraw/zinc/36/08/93/331360893.db2.gz	LPRLDXYMZPKTFM-AWEZNQCLSA-N	0	0	267.372	4.405	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@H](C)c1cc(C)ccc1C	ZINC000464525798	331361787	/nfs/dbraw/zinc/36/17/87/331361787.db2.gz	OPXNGNPQRNOLHS-HZPDHXFCSA-N	0	0	273.420	4.425	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)C(CC)CC	ZINC000464522193	331361796	/nfs/dbraw/zinc/36/17/96/331361796.db2.gz	IGICZBBJEMSGBQ-UHFFFAOYSA-N	0	0	259.393	4.028	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(Cc1ccc(F)cc1)C(C)C	ZINC000464540442	331362105	/nfs/dbraw/zinc/36/21/05/331362105.db2.gz	KATGGJQYIRCLTD-AWEZNQCLSA-N	0	0	277.383	4.165	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(C)nn1-c1ccccc1C	ZINC000464555324	331362453	/nfs/dbraw/zinc/36/24/53/331362453.db2.gz	YOPLQLMJYKGSSA-AWEZNQCLSA-N	0	0	297.402	4.030	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1nc(-c2ccccc2)cs1	ZINC000464553375	331362459	/nfs/dbraw/zinc/36/24/59/331362459.db2.gz	XJQIELCHXSQVBE-GFCCVEGCSA-N	0	0	286.400	4.351	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cccc(OC(F)(F)F)c1	ZINC000464559277	331362511	/nfs/dbraw/zinc/36/25/11/331362511.db2.gz	GCRZEOQEMLWCFA-JTQLQIEISA-N	0	0	287.281	4.126	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CC[C@H]2CCCC[C@H]2C1	ZINC000464561344	331362564	/nfs/dbraw/zinc/36/25/64/331362564.db2.gz	TUUYPFASDBHXRX-XUWVNRHRSA-N	0	0	263.425	4.064	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC(C)C)c1cccc(OC)c1	ZINC000464564282	331362725	/nfs/dbraw/zinc/36/27/25/331362725.db2.gz	CAVCGYMLTUABLN-OAHLLOKOSA-N	0	0	289.419	4.287	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(Cc1ccc(Cl)cc1)C1CC1	ZINC000464565686	331362751	/nfs/dbraw/zinc/36/27/51/331362751.db2.gz	CPNANLUSANODLU-CYBMUJFWSA-N	0	0	291.822	4.433	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(Cc1ccccc1)[C@@H](C)C1CC1	ZINC000464568646	331362805	/nfs/dbraw/zinc/36/28/05/331362805.db2.gz	UFFSDQSHROZIID-HOTGVXAUSA-N	0	0	285.431	4.416	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(Cc1ccccc1F)CC(C)C	ZINC000464567853	331362884	/nfs/dbraw/zinc/36/28/84/331362884.db2.gz	FXPWJMHTHXGABJ-HNNXBMFYSA-N	0	0	291.410	4.413	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCCc1cccc2ccccc21	ZINC000464572545	331362906	/nfs/dbraw/zinc/36/29/06/331362906.db2.gz	VQWMRUDGJAPWES-HNNXBMFYSA-N	0	0	281.399	4.101	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC(C)C)c1ccc(OC)cc1	ZINC000464570526	331362960	/nfs/dbraw/zinc/36/29/60/331362960.db2.gz	OSYOYQPADZFRJT-OAHLLOKOSA-N	0	0	289.419	4.287	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(Cc1ccccc1)[C@@H](C)CC	ZINC000464574480	331362976	/nfs/dbraw/zinc/36/29/76/331362976.db2.gz	XEXZOPVUTPHOKE-HOTGVXAUSA-N	0	0	273.420	4.416	20	30		CIEDRN
CC(C)(CC(=O)Nc1ccc(C#N)c(F)c1)c1ccccc1	ZINC000464636389	331363991	/nfs/dbraw/zinc/36/39/91/331363991.db2.gz	FZSWFPSOHFUJHW-UHFFFAOYSA-N	0	0	296.345	4.004	20	30		CIEDRN
CC(C)c1ccc(C(=O)Nc2ccc(C#N)c(F)c2)s1	ZINC000464642845	331364156	/nfs/dbraw/zinc/36/41/56/331364156.db2.gz	KFJMNZKEEKAJRT-UHFFFAOYSA-N	0	0	288.347	4.135	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCCc1ccc2ccccc2c1	ZINC000464651306	331364219	/nfs/dbraw/zinc/36/42/19/331364219.db2.gz	RFYFKSLMMOPUJB-HNNXBMFYSA-N	0	0	281.399	4.101	20	30		CIEDRN
CCc1ccc([C@H](C)C(=O)Nc2ccc(C#N)c(F)c2)cc1	ZINC000464650709	331364223	/nfs/dbraw/zinc/36/42/23/331364223.db2.gz	SYAMUOPFXYTFPZ-LBPRGKRZSA-N	0	0	296.345	4.002	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](C)c1ccccc1C(F)(F)F	ZINC000464651155	331364245	/nfs/dbraw/zinc/36/42/45/331364245.db2.gz	CWYSBDVORHVPKI-RYUDHWBXSA-N	0	0	299.336	4.485	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(Cc1ccccc1)CC1CCC1	ZINC000464653917	331364368	/nfs/dbraw/zinc/36/43/68/331364368.db2.gz	YNBGDQDQUNAHIF-MRXNPFEDSA-N	0	0	285.431	4.418	20	30		CIEDRN
Cc1c2ccccc2oc1C(=O)Nc1ccc(C#N)c(F)c1	ZINC000464656733	331364376	/nfs/dbraw/zinc/36/43/76/331364376.db2.gz	ZFHIIPKUOBTLHY-UHFFFAOYSA-N	0	0	294.285	4.004	20	30		CIEDRN
CC(C)(C)[C@@H](C#N)NC(=O)c1cscc1-c1ccccc1	ZINC000464714507	331365235	/nfs/dbraw/zinc/36/52/35/331365235.db2.gz	UONKZODCIZVWOT-OAHLLOKOSA-N	0	0	298.411	4.083	20	30		CIEDRN
C=C[C@H](C)NC(=O)N(CCCC)Cc1ccccc1Cl	ZINC000464754129	331366258	/nfs/dbraw/zinc/36/62/58/331366258.db2.gz	VQVHQFHXFICRQZ-ZDUSSCGKSA-N	0	0	294.826	4.226	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)CC(C)(C)CC	ZINC000465054372	331377083	/nfs/dbraw/zinc/37/70/83/331377083.db2.gz	XHDPCPURZYGJML-UHFFFAOYSA-N	0	0	265.422	4.089	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)CC(C)(C)CC	ZINC000465073492	331377554	/nfs/dbraw/zinc/37/75/54/331377554.db2.gz	WESIBWCSNUCHGJ-UHFFFAOYSA-N	0	0	277.383	4.167	20	30		CIEDRN
C=C[C@@H](C)NC(=O)c1ccc(SCc2ccccc2)cc1	ZINC000465101371	331378339	/nfs/dbraw/zinc/37/83/39/331378339.db2.gz	GLFUZYMJPLTSLM-CQSZACIVSA-N	0	0	297.423	4.283	20	30		CIEDRN
C=CCCCCCN(C)C(=O)N[C@H](C)C[C@H](C)CC	ZINC000466175271	331389838	/nfs/dbraw/zinc/38/98/38/331389838.db2.gz	YNZJPEDMWQDNSF-HUUCEWRRSA-N	0	0	268.445	4.199	20	30		CIEDRN
C=C[C@@H](C)NC(=O)Nc1ccc2c(c1)oc1ccccc12	ZINC000465161586	331379790	/nfs/dbraw/zinc/37/97/90/331379790.db2.gz	AIEFQANZROJFRG-LLVKDONJSA-N	0	0	280.327	4.282	20	30		CIEDRN
C=C[C@@H](C)NC(=O)Nc1ccccc1SC1CCCC1	ZINC000465160534	331379836	/nfs/dbraw/zinc/37/98/36/331379836.db2.gz	ZZXROUHJDBZAFA-GFCCVEGCSA-N	0	0	290.432	4.417	20	30		CIEDRN
CCC(C)(C)CC(=O)N(CC(C)C)c1ccc(C#N)cc1	ZINC000465176547	331380238	/nfs/dbraw/zinc/38/02/38/331380238.db2.gz	LWYPLOUTXNTSBV-UHFFFAOYSA-N	0	0	286.419	4.374	20	30		CIEDRN
C=C[C@@H](C)NC(=O)Nc1ccc(C(F)(F)F)cc1Cl	ZINC000465259446	331380825	/nfs/dbraw/zinc/38/08/25/331380825.db2.gz	PDULNMADGSESST-SSDOTTSWSA-N	0	0	292.688	4.055	20	30		CIEDRN
C=CCN(CCc1ccccc1)C(=O)Nc1ccsc1	ZINC000465589190	331385085	/nfs/dbraw/zinc/38/50/85/331385085.db2.gz	DFUZGIJVYOBHDL-UHFFFAOYSA-N	0	0	286.400	4.011	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@H](CC)C(C)(C)c1ccccc1	ZINC000465970912	331388085	/nfs/dbraw/zinc/38/80/85/331388085.db2.gz	FMBNVSXXSLFPJI-GOEBONIOSA-N	0	0	288.435	4.007	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@@H](CCC)CCc1ccccc1	ZINC000466052254	331388944	/nfs/dbraw/zinc/38/89/44/331388944.db2.gz	ATECAZRVZIUFLM-RDJZCZTQSA-N	0	0	288.435	4.052	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)N[C@@H](C)C[C@H](C)CC	ZINC000466166817	331390318	/nfs/dbraw/zinc/39/03/18/331390318.db2.gz	OCPDDZKEIHXJHJ-KGLIPLIRSA-N	0	0	294.464	4.270	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)N[C@H](C)C[C@@H](C)CC	ZINC000466176052	331390709	/nfs/dbraw/zinc/39/07/09/331390709.db2.gz	ZWAKYCXKFGARCV-JKSUJKDBSA-N	0	0	288.435	4.209	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@](C)(c1ccccc1)C(F)(F)F	ZINC000466236821	331391406	/nfs/dbraw/zinc/39/14/06/331391406.db2.gz	QHLXVPSQGRWJCU-SWLSCSKDSA-N	0	0	299.336	4.183	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](C)c1c(C)cccc1C	ZINC000466238872	331391435	/nfs/dbraw/zinc/39/14/35/331391435.db2.gz	BHVWFLLITAZDGA-CABCVRRESA-N	0	0	259.393	4.083	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](C#N)c1ccc(C(C)(C)C)cc1	ZINC000466240305	331391557	/nfs/dbraw/zinc/39/15/57/331391557.db2.gz	OUNYIHXHNKWHKC-WMLDXEAASA-N	0	0	298.430	4.267	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](CC)CSc1ccccc1	ZINC000466249923	331391639	/nfs/dbraw/zinc/39/16/39/331391639.db2.gz	NDKWYTVUTXFROA-CABCVRRESA-N	0	0	291.460	4.276	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(F)c(SC)c(F)c1	ZINC000466257024	331391680	/nfs/dbraw/zinc/39/16/80/331391680.db2.gz	ISIRPUBRSHYCLK-VIFPVBQESA-N	0	0	285.359	4.228	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCc1cc(Cl)sc1Cl	ZINC000466260663	331391840	/nfs/dbraw/zinc/39/18/40/331391840.db2.gz	WLJROWGQFBXUIL-QMMMGPOBSA-N	0	0	292.231	4.273	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](c1cccc(C)c1)C(F)(F)F	ZINC000466261424	331391842	/nfs/dbraw/zinc/39/18/42/331391842.db2.gz	SVKWKPMDZULZCW-TZMCWYRMSA-N	0	0	299.336	4.317	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N1CCC[C@@H]1c1ccccc1C	ZINC000466365801	331393533	/nfs/dbraw/zinc/39/35/33/331393533.db2.gz	ABLCHBOGWXAVNB-NVXWUHKLSA-N	0	0	286.419	4.196	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(CC)[C@@H](C)c1ccc(F)cc1	ZINC000466366577	331393661	/nfs/dbraw/zinc/39/36/61/331393661.db2.gz	JIWTWXLDKSFSCI-XJKSGUPXSA-N	0	0	292.398	4.273	20	30		CIEDRN
N#Cc1cccc(Cl)c1NCc1cccc2cc[nH]c21	ZINC000466376927	331393793	/nfs/dbraw/zinc/39/37/93/331393793.db2.gz	PRBKHUHXKFLOPN-UHFFFAOYSA-N	0	0	281.746	4.305	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(C)C/C(C)=C\c1ccccc1	ZINC000466377693	331393913	/nfs/dbraw/zinc/39/39/13/331393913.db2.gz	GUONRFZPAIWTSH-REZBVGGZSA-N	0	0	286.419	4.086	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N1CCC[C@H]1CCCCC	ZINC000466377604	331393979	/nfs/dbraw/zinc/39/39/79/331393979.db2.gz	FXOHQVHBQYSLKD-HUUCEWRRSA-N	0	0	266.429	4.095	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(Cc1ccc(C)s1)C(C)C	ZINC000466379541	331394072	/nfs/dbraw/zinc/39/40/72/331394072.db2.gz	ZCMLOVXLAWBMMY-CQSZACIVSA-N	0	0	294.464	4.331	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N[C@@H](CC(C)(C)C)C(F)(F)F	ZINC000466379475	331394084	/nfs/dbraw/zinc/39/40/84/331394084.db2.gz	DHXLJQDBADWCNM-QWRGUYRKSA-N	0	0	294.361	4.007	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N1CCC[C@H]1c1ccc(F)cc1	ZINC000466385017	331394194	/nfs/dbraw/zinc/39/41/94/331394194.db2.gz	YLSYANWQVUQGMQ-CVEARBPZSA-N	0	0	290.382	4.027	20	30		CIEDRN
C=CCCOCCCCC(=O)N1CC(C)(C)CC(C)(C)C1	ZINC000466385314	331394253	/nfs/dbraw/zinc/39/42/53/331394253.db2.gz	CUNBFTARZWDYNC-UHFFFAOYSA-N	0	0	295.467	4.034	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N1CCCC(C)(C)[C@@H]1CC=C	ZINC000466384403	331394272	/nfs/dbraw/zinc/39/42/72/331394272.db2.gz	XBVPYVXYRGYBHS-CABCVRRESA-N	0	0	278.440	4.117	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CCC[C@H]1c1ccc(F)cc1	ZINC000466385018	331394292	/nfs/dbraw/zinc/39/42/92/331394292.db2.gz	YLSYANWQVUQGMQ-HOTGVXAUSA-N	0	0	290.382	4.027	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(C)[C@@H](C)c1ccccc1Cl	ZINC000466387878	331394487	/nfs/dbraw/zinc/39/44/87/331394487.db2.gz	VYJQUOKBFKIESB-QWHCGFSZSA-N	0	0	294.826	4.397	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1ccc(OCCC)cc1C	ZINC000466390678	331394572	/nfs/dbraw/zinc/39/45/72/331394572.db2.gz	UZQPVRYSPNGFOO-CQSZACIVSA-N	0	0	290.407	4.260	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1ccc(CCCCC)cc1	ZINC000466391674	331394584	/nfs/dbraw/zinc/39/45/84/331394584.db2.gz	YFNPTLAGQAOBIK-UHFFFAOYSA-N	0	0	274.408	4.459	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(C)[C@@H](C)c1c(F)cccc1F	ZINC000466402730	331395188	/nfs/dbraw/zinc/39/51/88/331395188.db2.gz	AGJNIJAUPAXBGB-NWDGAFQWSA-N	0	0	296.361	4.022	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1ccc(OCCC)c(Cl)c1	ZINC000466402237	331395238	/nfs/dbraw/zinc/39/52/38/331395238.db2.gz	SWOVVHBEBJZEAL-UHFFFAOYSA-N	0	0	296.798	4.169	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N1CCCCC[C@@H]1c1ccco1	ZINC000466405171	331395356	/nfs/dbraw/zinc/39/53/56/331395356.db2.gz	FRCWEBYONIMQRG-HUUCEWRRSA-N	0	0	290.407	4.261	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1cccc(Cl)c1C	ZINC000466405806	331395416	/nfs/dbraw/zinc/39/54/16/331395416.db2.gz	ITYDCLKFYAATLS-LLVKDONJSA-N	0	0	266.772	4.125	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1c(CC)cccc1CC	ZINC000466409818	331395638	/nfs/dbraw/zinc/39/56/38/331395638.db2.gz	OLXRKHRRCWCRIL-OAHLLOKOSA-N	0	0	274.408	4.288	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](c1ccccc1C)C(C)C	ZINC000466418056	331395981	/nfs/dbraw/zinc/39/59/81/331395981.db2.gz	UMFGVZJGUUKWGX-WBVHZDCISA-N	0	0	273.420	4.411	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](Cc2ccccc2)[C@H]1C	ZINC000466427227	331396778	/nfs/dbraw/zinc/39/67/78/331396778.db2.gz	WPKQTJQUJCHFHC-JZXOWHBKSA-N	0	0	285.431	4.068	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCCCC[C@H]1CC(C)C	ZINC000466430678	331396906	/nfs/dbraw/zinc/39/69/06/331396906.db2.gz	HWBAHNSPAFWXIX-HOTGVXAUSA-N	0	0	265.441	4.406	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1C[C@H](C)Sc2ccccc21	ZINC000466440985	331396911	/nfs/dbraw/zinc/39/69/11/331396911.db2.gz	HPYRRMDYMCYLDT-STQMWFEESA-N	0	0	275.417	4.116	20	30		CIEDRN
CC#CCCCC(=O)N[C@H](c1ccccc1Cl)C(C)C	ZINC000466437280	331397107	/nfs/dbraw/zinc/39/71/07/331397107.db2.gz	ACJQLGLPNLBDFA-KRWDZBQOSA-N	0	0	291.822	4.347	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC)[C@H](CC)Cc1ccccc1	ZINC000466437453	331397134	/nfs/dbraw/zinc/39/71/34/331397134.db2.gz	BJQXQSPSFXMOJC-FUHWJXTLSA-N	0	0	287.447	4.459	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCCc2cccc(Cl)c21	ZINC000466441349	331397204	/nfs/dbraw/zinc/39/72/04/331397204.db2.gz	KCGRNSSOWGGOHJ-GFCCVEGCSA-N	0	0	277.795	4.222	20	30		CIEDRN
C=CCCCCNC(=O)N[C@@H](C)c1cc2ccccc2o1	ZINC000466496199	331398534	/nfs/dbraw/zinc/39/85/34/331398534.db2.gz	RNIUIQYSEIZYSN-ZDUSSCGKSA-N	0	0	286.375	4.149	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1c(Cl)cc(F)cc1Cl	ZINC000466527054	331398582	/nfs/dbraw/zinc/39/85/82/331398582.db2.gz	DMMGIMJIIKWHEJ-VIFPVBQESA-N	0	0	290.165	4.217	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccccc1NC(C)(C)C	ZINC000466499453	331398588	/nfs/dbraw/zinc/39/85/88/331398588.db2.gz	MVKOVGLZFALMHR-ZDUSSCGKSA-N	0	0	274.408	4.438	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1ccc(-c2ccccc2)nc1C	ZINC000466525033	331399029	/nfs/dbraw/zinc/39/90/29/331399029.db2.gz	FPPYWWGUCAXYDI-MRXNPFEDSA-N	0	0	294.398	4.142	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)CCOc1ccccc1C(C)C	ZINC000466531219	331399184	/nfs/dbraw/zinc/39/91/84/331399184.db2.gz	XNEAGBFZZDPKQH-HNNXBMFYSA-N	0	0	289.419	4.050	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1ccccc1C(C)(C)C	ZINC000466528875	331399222	/nfs/dbraw/zinc/39/92/22/331399222.db2.gz	MNBLELFLLWOSAU-CYBMUJFWSA-N	0	0	259.393	4.069	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@H](c1ccc(F)cc1)C(C)C	ZINC000466534295	331399328	/nfs/dbraw/zinc/39/93/28/331399328.db2.gz	OOWAIPYXDYAPSV-HOTGVXAUSA-N	0	0	277.383	4.036	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)C1(CC(C)C)CCCC1	ZINC000466540063	331399442	/nfs/dbraw/zinc/39/94/42/331399442.db2.gz	DEYUZCLTGSNTLN-CQSZACIVSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CC[C@](C)(CCc2ccccc2)C1	ZINC000466544063	331399557	/nfs/dbraw/zinc/39/95/57/331399557.db2.gz	NCEORKGGLVOEMJ-XLIONFOSSA-N	0	0	299.458	4.460	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1cc(F)ccc1-c1ccoc1	ZINC000466542663	331399626	/nfs/dbraw/zinc/39/96/26/331399626.db2.gz	VYLUGMOZFZRJNT-AWEZNQCLSA-N	0	0	287.334	4.170	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(C(=O)C(C)(C)C)cc1	ZINC000466545237	331399705	/nfs/dbraw/zinc/39/97/05/331399705.db2.gz	ZHIYBBHUNWTIKS-CYBMUJFWSA-N	0	0	287.403	4.456	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1ccc2c(ccn2CC(C)C)c1	ZINC000466560800	331399901	/nfs/dbraw/zinc/39/99/01/331399901.db2.gz	AXMNIPLQENHFDA-UHFFFAOYSA-N	0	0	299.418	4.337	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cnn([C@H](C)CC)c1C1CC1	ZINC000466643919	331401543	/nfs/dbraw/zinc/40/15/43/331401543.db2.gz	HBFHMFOUCSVKHG-CHWSQXEVSA-N	0	0	289.423	4.272	20	30		CIEDRN
C=CCCN(C)C(=O)N[C@@H](CCC)CCc1ccccc1	ZINC000466783214	331404794	/nfs/dbraw/zinc/40/47/94/331404794.db2.gz	UPPWMTXCAUPHII-KRWDZBQOSA-N	0	0	288.435	4.005	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(c1cccc(C)c1)C(C)C	ZINC000466873667	331406927	/nfs/dbraw/zinc/40/69/27/331406927.db2.gz	RNQDZQOADKDFJG-OAHLLOKOSA-N	0	0	259.393	4.339	20	30		CIEDRN
C=CCOc1cccc(NC(=O)c2csc(Cl)c2)c1	ZINC000466913030	331407980	/nfs/dbraw/zinc/40/79/80/331407980.db2.gz	FFZSRTGWJWZQPY-UHFFFAOYSA-N	0	0	293.775	4.219	20	30		CIEDRN
C=CCCN(C)C(=O)[C@H](CC)c1cccc(C(F)(F)F)c1	ZINC000467056416	331410775	/nfs/dbraw/zinc/41/07/75/331410775.db2.gz	FKUOHOKWJYWBAO-CQSZACIVSA-N	0	0	299.336	4.234	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H](C)Cc1ccc(C)cc1C	ZINC000467329513	331415202	/nfs/dbraw/zinc/41/52/02/331415202.db2.gz	BZSPOROJDREDED-INIZCTEOSA-N	0	0	285.431	4.119	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H](C)Cc1cc(C)cc(C)c1	ZINC000467349647	331415734	/nfs/dbraw/zinc/41/57/34/331415734.db2.gz	YBRCWZHTYWLMQK-MRXNPFEDSA-N	0	0	285.431	4.119	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H]1CCC[C@H](C(C)C)C1	ZINC000467349386	331415746	/nfs/dbraw/zinc/41/57/46/331415746.db2.gz	JDDZLNFTMKEDDF-HOTGVXAUSA-N	0	0	263.425	4.086	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1ccc(OCCC(C)C)cc1	ZINC000467395499	331417554	/nfs/dbraw/zinc/41/75/54/331417554.db2.gz	UBZJIWOKIWGGGZ-AWEZNQCLSA-N	0	0	290.407	4.198	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@@H](C)c1cccc(OC(C)C)c1	ZINC000467604592	331422854	/nfs/dbraw/zinc/42/28/54/331422854.db2.gz	HNAWZUVXJANEAT-KSSFIOAISA-N	0	0	289.419	4.253	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@H](C)c1cccc(OC(C)C)c1	ZINC000467604591	331422872	/nfs/dbraw/zinc/42/28/72/331422872.db2.gz	HNAWZUVXJANEAT-KDOFPFPSSA-N	0	0	289.419	4.253	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H](C)c1ccccc1Cl	ZINC000467748149	331423737	/nfs/dbraw/zinc/42/37/37/331423737.db2.gz	UJNBRRLRYKXILN-GFCCVEGCSA-N	0	0	277.795	4.286	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H](c1ccccc1)C(C)C	ZINC000467744941	331423749	/nfs/dbraw/zinc/42/37/49/331423749.db2.gz	WOJZXSBUMYGTHZ-QGZVFWFLSA-N	0	0	271.404	4.268	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)Cc1c(F)cccc1Cl	ZINC000467749868	331423753	/nfs/dbraw/zinc/42/37/53/331423753.db2.gz	SGMLXUAIBYMHNH-UHFFFAOYSA-N	0	0	295.785	4.206	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CCC)Cc1ccc(F)cc1	ZINC000467832376	331424339	/nfs/dbraw/zinc/42/43/39/331424339.db2.gz	QSKQZGFFIKNGRG-UHFFFAOYSA-N	0	0	289.394	4.333	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC)Cc1ccccc1C	ZINC000467828284	331424390	/nfs/dbraw/zinc/42/43/90/331424390.db2.gz	KQZACZNEMSSCCI-UHFFFAOYSA-N	0	0	271.404	4.112	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@H](C)CSc1ccc(C)cc1	ZINC000467881933	331425219	/nfs/dbraw/zinc/42/52/19/331425219.db2.gz	XTVXFVJYJVWAPD-PBHICJAKSA-N	0	0	291.460	4.194	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@H](C)c1ccc2ncsc2c1	ZINC000467881213	331425225	/nfs/dbraw/zinc/42/52/25/331425225.db2.gz	XLSFHKFKNDNICX-BZNIZROVSA-N	0	0	288.416	4.076	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(OC(C)C)c(OC)c1	ZINC000467922562	331425740	/nfs/dbraw/zinc/42/57/40/331425740.db2.gz	JGDFEAPICYIUNV-KRWDZBQOSA-N	0	0	291.391	4.023	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)NC[C@H]1CCCC[C@@H]1C(F)(F)F	ZINC000467979610	331426279	/nfs/dbraw/zinc/42/62/79/331426279.db2.gz	VZYXBPSIEBFMHZ-MBNYWOFBSA-N	0	0	291.357	4.074	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@H](C)C(C)(C)c1ccccc1	ZINC000468006980	331426658	/nfs/dbraw/zinc/42/66/58/331426658.db2.gz	SUXMJJDPXZUXAO-KDOFPFPSSA-N	0	0	273.420	4.071	20	30		CIEDRN
C=CCCCNC(=O)CCc1ccc(Cl)c(Cl)c1	ZINC000468366704	331432829	/nfs/dbraw/zinc/43/28/29/331432829.db2.gz	HVHBTYMMXDQDHH-UHFFFAOYSA-N	0	0	286.202	4.008	20	30		CIEDRN
C=CCCCNC(=O)C(C)(C)CCCc1ccccc1	ZINC000468379945	331433201	/nfs/dbraw/zinc/43/32/01/331433201.db2.gz	AFSHXWYRHREYCW-UHFFFAOYSA-N	0	0	273.420	4.118	20	30		CIEDRN
C=C(C)COc1cccc(N[C@H](C)CC2CCOCC2)c1	ZINC000468390246	331433515	/nfs/dbraw/zinc/43/35/15/331433515.db2.gz	SLUBZJVFYPYVJI-OAHLLOKOSA-N	0	0	289.419	4.259	20	30		CIEDRN
C=CCCCNC(=O)c1c[nH]cc1-c1ccc(Cl)s1	ZINC000468403911	331434241	/nfs/dbraw/zinc/43/42/41/331434241.db2.gz	SJEPKKDOEUXIJQ-UHFFFAOYSA-N	0	0	294.807	4.093	20	30		CIEDRN
C=CCCCNC(=O)C[C@@H](C)c1ccccc1C(F)(F)F	ZINC000468404111	331434442	/nfs/dbraw/zinc/43/44/42/331434442.db2.gz	UKFFNCLCMRHDRV-GFCCVEGCSA-N	0	0	299.336	4.281	20	30		CIEDRN
N#Cc1ccc(SCc2ccc(F)c(Cl)c2)nc1	ZINC000468459455	331435172	/nfs/dbraw/zinc/43/51/72/331435172.db2.gz	IMGZGDVUKJGXLF-UHFFFAOYSA-N	0	0	278.739	4.038	20	30		CIEDRN
Cc1ccc(CC[C@@H](C)Nc2ccc(CC#N)cc2)cc1	ZINC000468475672	331435482	/nfs/dbraw/zinc/43/54/82/331435482.db2.gz	OGBUIKFFWSTVTJ-MRXNPFEDSA-N	0	0	278.399	4.494	20	30		CIEDRN
C[C@H]1[C@H](c2ccccc2)C[C@@H]1Nc1ccc(CC#N)cc1	ZINC000468474901	331435501	/nfs/dbraw/zinc/43/55/01/331435501.db2.gz	JAIDEAIQYIWYST-KYNGSXCRSA-N	0	0	276.383	4.357	20	30		CIEDRN
N#Cc1cccc(SCC(=O)c2cccc(Cl)c2)c1	ZINC000468636490	331437932	/nfs/dbraw/zinc/43/79/32/331437932.db2.gz	BSRCKUTWBKFUHU-UHFFFAOYSA-N	0	0	287.771	4.187	20	30		CIEDRN
N#Cc1cccc(SCC(=O)c2ccc(Cl)cc2)c1	ZINC000468641850	331438133	/nfs/dbraw/zinc/43/81/33/331438133.db2.gz	NFHOBQHUYLMGHX-UHFFFAOYSA-N	0	0	287.771	4.187	20	30		CIEDRN
C[C@H]1CCCC[C@@H]1OCCSc1cccc(C#N)c1	ZINC000468647883	331438282	/nfs/dbraw/zinc/43/82/82/331438282.db2.gz	MBJJSTSZDYODTE-BBRMVZONSA-N	0	0	275.417	4.246	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)C1(c2c(Cl)cccc2Cl)CC1	ZINC000468780347	331439829	/nfs/dbraw/zinc/43/98/29/331439829.db2.gz	BLFQWAAWWSILKV-SNVBAGLBSA-N	0	0	298.213	4.106	20	30		CIEDRN
C=CCCN(C)C(=O)CCC[C@H](C)c1cccc(OC)c1	ZINC000468955936	331443199	/nfs/dbraw/zinc/44/31/99/331443199.db2.gz	OFLRGGQUAYYQFE-HNNXBMFYSA-N	0	0	289.419	4.004	20	30		CIEDRN
C=CCN(Cc1ccc(OC)cc1)C(=O)CC(CC)CC	ZINC000468976356	331443446	/nfs/dbraw/zinc/44/34/46/331443446.db2.gz	OZIHUZITRSFGPC-UHFFFAOYSA-N	0	0	289.419	4.036	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1c2ccccc2SC[C@@H]1C	ZINC000469104459	331445794	/nfs/dbraw/zinc/44/57/94/331445794.db2.gz	RSFQKMLNFFTASZ-ZDUSSCGKSA-N	0	0	287.428	4.282	20	30		CIEDRN
CCCNc1ccc(C#N)cc1NC(=O)CCC(C)(C)C	ZINC000469124974	331446175	/nfs/dbraw/zinc/44/61/75/331446175.db2.gz	XRSPSWMHWKBIKK-UHFFFAOYSA-N	0	0	287.407	4.145	20	30		CIEDRN
Cc1ccc(C#N)cc1OCc1cc(-c2ccccc2)on1	ZINC000469219533	331447850	/nfs/dbraw/zinc/44/78/50/331447850.db2.gz	NSEOCFRAJFYRCM-UHFFFAOYSA-N	0	0	290.322	4.101	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1ccc(C(C)(C)C(F)(F)F)cc1	ZINC000469760831	331457031	/nfs/dbraw/zinc/45/70/31/331457031.db2.gz	NVPKEITZVWSSPD-UHFFFAOYSA-N	0	0	299.336	4.175	20	30		CIEDRN
C=C[C@@H](CC(=O)NC1CCC2(CC2)CC1)c1ccccc1	ZINC000470106051	331471871	/nfs/dbraw/zinc/47/18/71/331471871.db2.gz	SCMOUUULLLUODU-HNNXBMFYSA-N	0	0	283.415	4.185	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC(CCC(C)C)CC1	ZINC000470239468	331476073	/nfs/dbraw/zinc/47/60/73/331476073.db2.gz	ZHDDNQVFELSIAE-UHFFFAOYSA-N	0	0	277.452	4.430	20	30		CIEDRN
C=CC[C@H]1N(C(=O)[C@H]2[C@@H]3CCCC[C@@H]32)CCCC1(C)C	ZINC000470267262	331476963	/nfs/dbraw/zinc/47/69/63/331476963.db2.gz	PEHCONDJLMAYRJ-QXSJWSMHSA-N	0	0	275.436	4.016	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@H](C)CC1CCCCC1	ZINC000470479001	331483497	/nfs/dbraw/zinc/48/34/97/331483497.db2.gz	ZVYCJINNDINTBV-CJNGLKHVSA-N	0	0	251.414	4.064	20	30		CIEDRN
CC(C)CCC1CCN(C(=O)Nc2ccc(C#N)cc2)CC1	ZINC000470554668	331485185	/nfs/dbraw/zinc/48/51/85/331485185.db2.gz	AEKKLSYXRKBSCC-UHFFFAOYSA-N	0	0	299.418	4.238	20	30		CIEDRN
C=CCCCCNC(=O)c1cc(C)c(C)cc1Cl	ZINC000471669644	331514572	/nfs/dbraw/zinc/51/45/72/331514572.db2.gz	AZEVRZCEYURVST-UHFFFAOYSA-N	0	0	265.784	4.043	20	30		CIEDRN
C=CCCCCNC(=O)c1cccc(Cl)c1Cl	ZINC000471671362	331514601	/nfs/dbraw/zinc/51/46/01/331514601.db2.gz	VWRUQQUIFNQDPT-UHFFFAOYSA-N	0	0	272.175	4.080	20	30		CIEDRN
C=CCCCCNC(=O)c1cccc(-c2ccoc2)c1	ZINC000471672295	331514812	/nfs/dbraw/zinc/51/48/12/331514812.db2.gz	USKCXYHZKDEIIM-UHFFFAOYSA-N	0	0	269.344	4.033	20	30		CIEDRN
C=CCCCCNC(=O)Cc1ccc(Cl)c(Cl)c1	ZINC000471674576	331514938	/nfs/dbraw/zinc/51/49/38/331514938.db2.gz	UIDBCGNFAMZTIW-UHFFFAOYSA-N	0	0	286.202	4.008	20	30		CIEDRN
C=CCCCCNC(=O)[C@H](c1ccc(F)cc1)C(C)C	ZINC000471710630	331517380	/nfs/dbraw/zinc/51/73/80/331517380.db2.gz	CJHQXMQCNZKPKH-INIZCTEOSA-N	0	0	277.383	4.038	20	30		CIEDRN
C=CCCCCNC(=O)[C@H](OC(C)(C)C)c1ccccc1	ZINC000471713272	331517536	/nfs/dbraw/zinc/51/75/36/331517536.db2.gz	GHLFDEQZCYRPRT-MRXNPFEDSA-N	0	0	289.419	4.015	20	30		CIEDRN
C=CCCCCNC(=O)c1cc(Cl)ccc1Cl	ZINC000471715084	331517914	/nfs/dbraw/zinc/51/79/14/331517914.db2.gz	JRAWWJGCWBNJSW-UHFFFAOYSA-N	0	0	272.175	4.080	20	30		CIEDRN
N#CCCCOc1cccc(N[C@@H]2CC[C@@H]2C2CCC2)c1	ZINC000510739725	332914456	/nfs/dbraw/zinc/91/44/56/332914456.db2.gz	YDCAHJQARLBHJF-QZTJIDSGSA-N	0	0	284.403	4.360	20	30		CIEDRN
CCN(Cc1cccc(C#N)c1F)c1ccc2[nH]ccc2c1	ZINC000472171767	331530814	/nfs/dbraw/zinc/53/08/14/331530814.db2.gz	MTKGRZUECXHKJQ-UHFFFAOYSA-N	0	0	293.345	4.205	20	30		CIEDRN
C=CCCCCNC(=O)N1CC=C(c2cccc(C)c2)CC1	ZINC000472851904	331544779	/nfs/dbraw/zinc/54/47/79/331544779.db2.gz	ONBPOZKILYAQMA-UHFFFAOYSA-N	0	0	298.430	4.150	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)c1cccn1C(C)C	ZINC000473363332	331550399	/nfs/dbraw/zinc/55/03/99/331550399.db2.gz	USHCLZMUUDPDGJ-UHFFFAOYSA-N	0	0	296.414	4.288	20	30		CIEDRN
C=C[C@](C)(CCOC)C(=O)N(C)c1cccc(C(C)C)c1	ZINC000473656036	331554859	/nfs/dbraw/zinc/55/48/59/331554859.db2.gz	AMMVVNAFDSTGAC-GOSISDBHSA-N	0	0	289.419	4.002	20	30		CIEDRN
C[C@@H](CCOc1ccc(C#N)c(F)c1)OCc1ccccc1	ZINC000473674609	331555504	/nfs/dbraw/zinc/55/55/04/331555504.db2.gz	JGCQGYDIWWTGAH-AWEZNQCLSA-N	0	0	299.345	4.072	20	30		CIEDRN
CC(C)(C)OCCCCSCc1cccc(C#N)c1	ZINC000473787024	331557764	/nfs/dbraw/zinc/55/77/64/331557764.db2.gz	QXFVFGSVFFTEIM-UHFFFAOYSA-N	0	0	277.433	4.387	20	30		CIEDRN
C[C@@H](CC(=O)N[C@@H](C)c1ccc(C#N)cc1)C1CCCCC1	ZINC000510789438	332917172	/nfs/dbraw/zinc/91/71/72/332917172.db2.gz	DOTAWZDRSXCGKS-GJZGRUSLSA-N	0	0	298.430	4.342	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N1CCC[C@@H]1c1cc(C)ccc1C	ZINC000474261225	331576977	/nfs/dbraw/zinc/57/69/77/331576977.db2.gz	XOHYDPXYOPLTLQ-DOTOQJQBSA-N	0	0	286.419	4.115	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N1CCC[C@@H]1c1cc(C)ccc1C	ZINC000474261226	331577073	/nfs/dbraw/zinc/57/70/73/331577073.db2.gz	XOHYDPXYOPLTLQ-NVXWUHKLSA-N	0	0	286.419	4.115	20	30		CIEDRN
Cc1cc(C(=O)Nc2ccc(CC#N)cc2)c(C)cc1Cl	ZINC000474292725	331579898	/nfs/dbraw/zinc/57/98/98/331579898.db2.gz	UTUJGEZOBFOEMH-UHFFFAOYSA-N	0	0	298.773	4.275	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CC[C@@H](Cc2ccccc2)C1	ZINC000474327684	331580411	/nfs/dbraw/zinc/58/04/11/331580411.db2.gz	JMULCSRROBUNBJ-RYQLBKOJSA-N	0	0	285.431	4.116	20	30		CIEDRN
Cc1cc(Oc2cc(Cl)ccc2C#N)nc(C(C)C)n1	ZINC000474769381	331597400	/nfs/dbraw/zinc/59/74/00/331597400.db2.gz	BUWGCKHGLHPXOZ-UHFFFAOYSA-N	0	0	287.750	4.226	20	30		CIEDRN
CC[C@@H]1CCCC[C@H]1NC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000474784326	331598042	/nfs/dbraw/zinc/59/80/42/331598042.db2.gz	KNFFCODEJFUWBV-RHSMWYFYSA-N	0	0	298.430	4.186	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@H]1CCCC1(C)C	ZINC000475284254	331621731	/nfs/dbraw/zinc/62/17/31/331621731.db2.gz	CRDGXPLXBAXRQV-CQSZACIVSA-N	0	0	277.433	4.089	20	30		CIEDRN
CCC1(C)CCN(C(=O)c2ccc(C(C)(C)C#N)cc2)CC1	ZINC000475450365	331632201	/nfs/dbraw/zinc/63/22/01/331632201.db2.gz	GBQPOLNXSAPDHN-UHFFFAOYSA-N	0	0	298.430	4.140	20	30		CIEDRN
C[C@@H]1CC[C@@H](CNC(=O)Nc2ccc(C(C)(C)C#N)cc2)C1	ZINC000475477900	331632460	/nfs/dbraw/zinc/63/24/60/331632460.db2.gz	NBJUWUAEWDURCI-ZIAGYGMSSA-N	0	0	299.418	4.045	20	30		CIEDRN
C=C(C)[C@@H](NC(=O)[C@@H](C)CCC)c1ccc(F)c(F)c1	ZINC000475675105	331641716	/nfs/dbraw/zinc/64/17/16/331641716.db2.gz	GLMQKZXKEGDDHL-XHDPSFHLSA-N	0	0	281.346	4.134	20	30		CIEDRN
C[C@@H](CC1CCCC1)C(=O)Nc1ccc(Cl)c(C#N)c1	ZINC000510940131	332921387	/nfs/dbraw/zinc/92/13/87/332921387.db2.gz	UVIDMUPKLZHLAK-NSHDSACASA-N	0	0	290.794	4.367	20	30		CIEDRN
CC(C)(C(=O)CSc1cccc(C#N)c1)c1ccccc1	ZINC000475971700	331650435	/nfs/dbraw/zinc/65/04/35/331650435.db2.gz	JQXQKEHLXGPFSJ-UHFFFAOYSA-N	0	0	295.407	4.197	20	30		CIEDRN
CC[C@@H]1CCCCCN1C(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000476093091	331654693	/nfs/dbraw/zinc/65/46/93/331654693.db2.gz	XKGSICGPIBHPNJ-QGZVFWFLSA-N	0	0	298.430	4.283	20	30		CIEDRN
CC(C)(C#N)c1ccc(C(=O)N[C@@H]2CCCCC2(C)C)cc1	ZINC000476309087	331661024	/nfs/dbraw/zinc/66/10/24/331661024.db2.gz	YLAMXZREMIWECS-MRXNPFEDSA-N	0	0	298.430	4.186	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cc(C)ccc2Cl)CC1	ZINC000476335709	331661807	/nfs/dbraw/zinc/66/18/07/331661807.db2.gz	LRYDYKHWWCOGRZ-UHFFFAOYSA-N	0	0	263.768	4.333	20	30		CIEDRN
C=CCCC1(C(=O)N2CCC(C)(c3ccccc3)CC2)CC1	ZINC000476488755	331665182	/nfs/dbraw/zinc/66/51/82/331665182.db2.gz	WOGVAPOLACDHSY-UHFFFAOYSA-N	0	0	297.442	4.313	20	30		CIEDRN
CC(C)(C#N)CCCSc1ncnc2ccsc21	ZINC000476488117	331665199	/nfs/dbraw/zinc/66/51/99/331665199.db2.gz	YCLJMHKJCKFLEB-UHFFFAOYSA-N	0	0	277.418	4.113	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cc3[nH]ccc3cc2C)CC1	ZINC000476892097	331670958	/nfs/dbraw/zinc/67/09/58/331670958.db2.gz	ZSXDYUHOAMHCRT-UHFFFAOYSA-N	0	0	268.360	4.161	20	30		CIEDRN
CCC[C@H](CC)S[C@@H](C)C(=O)Nc1cccc(C#N)c1	ZINC000477043491	331673724	/nfs/dbraw/zinc/67/37/24/331673724.db2.gz	KYPZFPYQUVVNPI-WFASDCNBSA-N	0	0	290.432	4.197	20	30		CIEDRN
C=CCCC1(C(=O)N(C)c2ccc(OC(C)C)cc2)CC1	ZINC000477095778	331676153	/nfs/dbraw/zinc/67/61/53/331676153.db2.gz	HPMYCSZDAKIIQD-UHFFFAOYSA-N	0	0	287.403	4.183	20	30		CIEDRN
C=CCCC1(C(=O)N2C[C@@H](c3ccc(C)cc3)C[C@@H]2C)CC1	ZINC000477095636	331676156	/nfs/dbraw/zinc/67/61/56/331676156.db2.gz	YQBGVBNNNXLVDO-WMZOPIPTSA-N	0	0	297.442	4.446	20	30		CIEDRN
C=CCCC1(C(=O)N(C)C/C(C)=C\c2ccccc2)CC1	ZINC000477104133	331676614	/nfs/dbraw/zinc/67/66/14/331676614.db2.gz	WHHUYVNZDULVLK-PEZBUJJGSA-N	0	0	283.415	4.295	20	30		CIEDRN
C=CCCCC(=O)N1CC=C(c2cccc(Cl)c2)CC1	ZINC000477358171	331682502	/nfs/dbraw/zinc/68/25/02/331682502.db2.gz	UTSZZOCXXQBGNG-UHFFFAOYSA-N	0	0	289.806	4.312	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(F)c(Cl)c2)CCC1	ZINC000478262034	331702050	/nfs/dbraw/zinc/70/20/50/331702050.db2.gz	YCOOXSUCEBRWHM-UHFFFAOYSA-N	0	0	267.731	4.164	20	30		CIEDRN
N#Cc1cc(Cl)ccc1CNc1c(F)cc(F)cc1F	ZINC000478361094	331704538	/nfs/dbraw/zinc/70/45/38/331704538.db2.gz	KEUYDFONFOSSMT-UHFFFAOYSA-N	0	0	296.679	4.241	20	30		CIEDRN
C=CCCC(=O)N1CCC(C)(c2cccc(Cl)c2)CC1	ZINC000478437452	331706124	/nfs/dbraw/zinc/70/61/24/331706124.db2.gz	PQDOZWRGBMGIGM-UHFFFAOYSA-N	0	0	291.822	4.186	20	30		CIEDRN
C=CCC1(C(=O)NCCc2ccc3ccccc3c2)CCC1	ZINC000478671347	331711420	/nfs/dbraw/zinc/71/14/20/331711420.db2.gz	DSYOFTGVIALRJP-UHFFFAOYSA-N	0	0	293.410	4.245	20	30		CIEDRN
CC(C)Oc1ccc(O[C@H](C)c2cccc(C#N)c2)cc1	ZINC000478779731	331713765	/nfs/dbraw/zinc/71/37/65/331713765.db2.gz	KLMNCPKGCGQFMG-CQSZACIVSA-N	0	0	281.355	4.485	20	30		CIEDRN
C[C@H](Oc1ccc(F)cc1Cl)c1ccc(C#N)cc1	ZINC000478788706	331713927	/nfs/dbraw/zinc/71/39/27/331713927.db2.gz	VBQHDHNSVSFDQT-JTQLQIEISA-N	0	0	275.710	4.491	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1cc(C)c(O)c(C)c1)c1ccccc1	ZINC000478794175	331714145	/nfs/dbraw/zinc/71/41/45/331714145.db2.gz	LGCTVEVYLITLOA-OAHLLOKOSA-N	0	0	295.382	4.307	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1cc(C)c(O)c(C)c1)c1ccccc1	ZINC000478794167	331714146	/nfs/dbraw/zinc/71/41/46/331714146.db2.gz	LGCTVEVYLITLOA-HNNXBMFYSA-N	0	0	295.382	4.307	20	30		CIEDRN
CCC(=O)c1ccc(O[C@@H](C)c2ccc(C#N)cc2)c(F)c1	ZINC000478794304	331714252	/nfs/dbraw/zinc/71/42/52/331714252.db2.gz	FVFUQSNUNSTTQO-LBPRGKRZSA-N	0	0	297.329	4.430	20	30		CIEDRN
CCC(CC)CN(CCC#N)C(=O)[C@H](C)CC1CCCC1	ZINC000511123664	332927437	/nfs/dbraw/zinc/92/74/37/332927437.db2.gz	UGMMEDCQKGSHJW-OAHLLOKOSA-N	0	0	292.467	4.381	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc2oc(C)c(C)c2c1	ZINC000479007294	331718598	/nfs/dbraw/zinc/71/85/98/331718598.db2.gz	SHUOUYRMQXGEGR-UHFFFAOYSA-N	0	0	257.333	4.344	20	30		CIEDRN
C=C(C)CN(C)C(=O)C1(c2ccc(F)cc2)CCCCC1	ZINC000479213743	331721926	/nfs/dbraw/zinc/72/19/26/331721926.db2.gz	JDTLWRMDVBBCNM-UHFFFAOYSA-N	0	0	289.394	4.062	20	30		CIEDRN
C=C(C)CN(C)C(=O)C[C@H](C)c1ccc(C(C)C)cc1	ZINC000479211415	331722004	/nfs/dbraw/zinc/72/20/04/331722004.db2.gz	FLEPINDXYYWBIZ-HNNXBMFYSA-N	0	0	273.420	4.338	20	30		CIEDRN
C=C(C)CN(C)C(=O)[C@@H](C)c1ccc(Cl)c(Cl)c1	ZINC000479236233	331722194	/nfs/dbraw/zinc/72/21/94/331722194.db2.gz	AWFMFCJMQJUTPY-JTQLQIEISA-N	0	0	286.202	4.131	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1ccccc1OC1CCCCC1	ZINC000479256006	331723057	/nfs/dbraw/zinc/72/30/57/331723057.db2.gz	XXYUZALWGSBDRB-UHFFFAOYSA-N	0	0	287.403	4.046	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)[C@@H]2CCC(F)(F)C2)c1	ZINC000479374724	331726042	/nfs/dbraw/zinc/72/60/42/331726042.db2.gz	IJZVIDVKNXVTDK-GFCCVEGCSA-N	0	0	295.329	4.015	20	30		CIEDRN
Cc1cc2c(ncnc2SCC#Cc2ccccc2)s1	ZINC000479523555	331734805	/nfs/dbraw/zinc/73/48/05/331734805.db2.gz	QHHNGYFKRFESRB-UHFFFAOYSA-N	0	0	296.420	4.144	20	30		CIEDRN
CC1=CCC[C@@H](C)[C@@H]1CNc1ccc(CC#N)cc1	ZINC000479540754	331735924	/nfs/dbraw/zinc/73/59/24/331735924.db2.gz	LTRFFRBMUMALEW-RHSMWYFYSA-N	0	0	254.377	4.157	20	30		CIEDRN
C=CCC[C@@H](Nc1cccc(-n2cc(C)[nH]c2=O)c1)C1CC1	ZINC000479545763	331736377	/nfs/dbraw/zinc/73/63/77/331736377.db2.gz	QPLQLOHSMXWNBA-QGZVFWFLSA-N	0	0	297.402	4.043	20	30		CIEDRN
C=CCCCC(=O)NCCc1cc(Cl)cc(Cl)c1	ZINC000479548854	331736706	/nfs/dbraw/zinc/73/67/06/331736706.db2.gz	FDLBLMHEBQSCKK-UHFFFAOYSA-N	0	0	286.202	4.008	20	30		CIEDRN
C[C@H](CC(=O)N(C)c1cc(Cl)ccc1C#N)C(C)(C)C	ZINC000479583063	331739005	/nfs/dbraw/zinc/73/90/05/331739005.db2.gz	VGDCZKZFYHPUDJ-LLVKDONJSA-N	0	0	292.810	4.247	20	30		CIEDRN
C=CCOCCCSCc1cccc(OC(C)C)c1	ZINC000479588991	331739258	/nfs/dbraw/zinc/73/92/58/331739258.db2.gz	XRQYQOUICBUXES-UHFFFAOYSA-N	0	0	280.433	4.300	20	30		CIEDRN
C=CCOCCCS[C@@H]1CCc2ccc(F)cc21	ZINC000479603398	331740173	/nfs/dbraw/zinc/74/01/73/331740173.db2.gz	CYJXKXDTEVCSIX-OAHLLOKOSA-N	0	0	266.381	4.139	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(OC(C)C)c(C)c1	ZINC000479765039	331745396	/nfs/dbraw/zinc/74/53/96/331745396.db2.gz	BAIIPNAYSAPEAN-UHFFFAOYSA-N	0	0	261.365	4.077	20	30		CIEDRN
COc1cc(C#N)ccc1Oc1nc2cccc(C)c2s1	ZINC000479862480	331749272	/nfs/dbraw/zinc/74/92/72/331749272.db2.gz	KKZCHXBSIOZEQF-UHFFFAOYSA-N	0	0	296.351	4.277	20	30		CIEDRN
CCc1cc(NC(=O)NCC(C)(C)CCC#N)ccc1C	ZINC000480728025	331786247	/nfs/dbraw/zinc/78/62/47/331786247.db2.gz	CSFYFFYSJGDQHC-UHFFFAOYSA-N	0	0	287.407	4.009	20	30		CIEDRN
C=CCCCC(=O)N[C@H]1CCCC[C@H]1c1ccccc1	ZINC000481154346	331799216	/nfs/dbraw/zinc/79/92/16/331799216.db2.gz	LROOIHSAWSQEHJ-IRXDYDNUSA-N	0	0	271.404	4.185	20	30		CIEDRN
C=CCn1c(S[C@H](C)CCC)nnc1-c1cccs1	ZINC000481407541	331806348	/nfs/dbraw/zinc/80/63/48/331806348.db2.gz	ZHELAOLERKCTNE-LLVKDONJSA-N	0	0	293.461	4.473	20	30		CIEDRN
C=CCCCC(=O)N1CCCc2c(Cl)ccc(F)c21	ZINC000481463490	331807517	/nfs/dbraw/zinc/80/75/17/331807517.db2.gz	GAMGWEOVBZORNY-UHFFFAOYSA-N	0	0	281.758	4.115	20	30		CIEDRN
Cc1cccc2c1N(C1CC1)CCN2CCCC(C)(C)C#N	ZINC000481571729	331809474	/nfs/dbraw/zinc/80/94/74/331809474.db2.gz	PSSDVNBGKUUSIL-UHFFFAOYSA-N	0	0	297.446	4.114	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1ccc2oc(C)c(C)c2c1	ZINC000481636946	331810713	/nfs/dbraw/zinc/81/07/13/331810713.db2.gz	XICPQPICSLSYAD-JTQLQIEISA-N	0	0	272.348	4.136	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2ccc(C3CC3)c(C)c2)CC1	ZINC000481892696	331817782	/nfs/dbraw/zinc/81/77/82/331817782.db2.gz	KVOMXVFHIPPVQW-UHFFFAOYSA-N	0	0	284.403	4.302	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)c1ccc(F)c(F)c1	ZINC000482831997	331847605	/nfs/dbraw/zinc/84/76/05/331847605.db2.gz	ZCNMJWJEFSEYRK-UHFFFAOYSA-N	0	0	293.357	4.173	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)N[C@@H](C)[C@@H](C)CC	ZINC000303456390	332931260	/nfs/dbraw/zinc/93/12/60/332931260.db2.gz	MMJWDQTXOYCUKQ-GJZGRUSLSA-N	0	0	280.456	4.199	20	30		CIEDRN
CC[C@@H]1CCCC[C@H]1C(=O)Nc1sc(C)c(C)c1C#N	ZINC000483075479	331857030	/nfs/dbraw/zinc/85/70/30/331857030.db2.gz	PIZKVHCZUOYESO-CHWSQXEVSA-N	0	0	290.432	4.392	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccccc2CCC)CC1	ZINC000483266966	331865933	/nfs/dbraw/zinc/86/59/33/331865933.db2.gz	WPGFHZKEESCSOR-UHFFFAOYSA-N	0	0	257.377	4.324	20	30		CIEDRN
C=C(C)[C@@H](NC(=O)N(CC)CCC)c1ccc(F)c(F)c1	ZINC000483288026	331867549	/nfs/dbraw/zinc/86/75/49/331867549.db2.gz	ZXIDJMBFAWSYPG-OAHLLOKOSA-N	0	0	296.361	4.024	20	30		CIEDRN
C=CCCC1(C(=O)N(CC=C)Cc2ccccc2F)CC1	ZINC000483334423	331870027	/nfs/dbraw/zinc/87/00/27/331870027.db2.gz	CSXNUAWITYZELI-UHFFFAOYSA-N	0	0	287.378	4.087	20	30		CIEDRN
CCCN(CC#N)Cc1cc(C(F)(F)F)ccc1Cl	ZINC000511469945	332932572	/nfs/dbraw/zinc/93/25/72/332932572.db2.gz	BHVUSDOFLOZSFL-UHFFFAOYSA-N	0	0	290.716	4.094	20	30		CIEDRN
C=CCOc1ccc(CNc2ncccc2F)cc1Cl	ZINC000483836101	331885688	/nfs/dbraw/zinc/88/56/88/331885688.db2.gz	NMRZNGDDTMPZFK-UHFFFAOYSA-N	0	0	292.741	4.051	20	30		CIEDRN
C[C@H]1CC(C)(C)CC[C@@H]1NC(=O)Nc1ccc(CC#N)cc1	ZINC000483846013	331886274	/nfs/dbraw/zinc/88/62/74/331886274.db2.gz	FIUPCAXEHUSKHO-BBRMVZONSA-N	0	0	299.418	4.089	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cc(F)cc(Cl)c2)CC1	ZINC000483845617	331886409	/nfs/dbraw/zinc/88/64/09/331886409.db2.gz	DHLTUPQDDGDXPH-UHFFFAOYSA-N	0	0	267.731	4.164	20	30		CIEDRN
CCC[C@](C)(CC)C(=O)Nc1ccc(C#N)cc1Cl	ZINC000483870014	331887974	/nfs/dbraw/zinc/88/79/74/331887974.db2.gz	PZJPUFCCJUVGEJ-HNNXBMFYSA-N	0	0	278.783	4.367	20	30		CIEDRN
C[C@@H](C#N)CN(C)c1ccc2c(Cl)ccc(Cl)c2n1	ZINC000484143722	331893615	/nfs/dbraw/zinc/89/36/15/331893615.db2.gz	YFMSQPMARAADPB-VIFPVBQESA-N	0	0	294.185	4.137	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)C2CC(C)(C)C2)c1	ZINC000511492106	332933255	/nfs/dbraw/zinc/93/32/55/332933255.db2.gz	HUKZRMGKXMYAOH-UHFFFAOYSA-N	0	0	273.376	4.016	20	30		CIEDRN
C=CCN(C(=O)[C@H](C)Sc1ccccc1)c1ccccc1	ZINC000484288403	331895746	/nfs/dbraw/zinc/89/57/46/331895746.db2.gz	XIEWRXYSXPMHBH-HNNXBMFYSA-N	0	0	297.423	4.386	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000484442423	331898319	/nfs/dbraw/zinc/89/83/19/331898319.db2.gz	SPFMRRCNELXYFE-OAHLLOKOSA-N	0	0	289.394	4.278	20	30		CIEDRN
CC(C)c1ccc([C@H](C)CC(=O)N[C@@]2(C#N)CC2(C)C)cc1	ZINC000484916889	331907168	/nfs/dbraw/zinc/90/71/68/331907168.db2.gz	GIVBLVWAUJCNES-AUUYWEPGSA-N	0	0	298.430	4.112	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N[C@@H](C)CC(C)C	ZINC000485512800	331915938	/nfs/dbraw/zinc/91/59/38/331915938.db2.gz	CXIKWLSQBWNXPM-ZDUSSCGKSA-N	0	0	277.433	4.129	20	30		CIEDRN
C=CCCCCCSCC(=O)Nc1ccc(F)cc1F	ZINC000485563316	331916939	/nfs/dbraw/zinc/91/69/39/331916939.db2.gz	WACGHSRPHOURCT-UHFFFAOYSA-N	0	0	299.386	4.383	20	30		CIEDRN
C=CCCCCCSCC(=O)Nc1c(F)cccc1F	ZINC000485577948	331917642	/nfs/dbraw/zinc/91/76/42/331917642.db2.gz	JVPFIEVEWXBTAA-UHFFFAOYSA-N	0	0	299.386	4.383	20	30		CIEDRN
C[C@H](SC[C@H]1CCO[C@H](C)C1)c1cccc(C#N)c1	ZINC000485578292	331917862	/nfs/dbraw/zinc/91/78/62/331917862.db2.gz	FFIJLFUSWVSRKM-IPYPFGDCSA-N	0	0	275.417	4.168	20	30		CIEDRN
C=CCCCCCSCC(=O)NCc1sccc1C	ZINC000485601573	331918632	/nfs/dbraw/zinc/91/86/32/331918632.db2.gz	ORXZJLRLKDJJGC-UHFFFAOYSA-N	0	0	297.489	4.152	20	30		CIEDRN
N#CCCCCN1CCc2cc(-c3ccccc3)ccc21	ZINC000485978445	331928379	/nfs/dbraw/zinc/92/83/79/331928379.db2.gz	JGFNPGUESAEXRW-UHFFFAOYSA-N	0	0	276.383	4.410	20	30		CIEDRN
Cc1ccc(-c2nc(/C=C\c3ncccc3C#N)co2)cc1	ZINC000485980422	331928412	/nfs/dbraw/zinc/92/84/12/331928412.db2.gz	QWCYBRFVOHFVDN-HJWRWDBZSA-N	0	0	287.322	4.087	20	30		CIEDRN
CCCCOc1ccc(/C=C/c2ncccc2C#N)cc1	ZINC000486080350	331930778	/nfs/dbraw/zinc/93/07/78/331930778.db2.gz	ZLNXSZAZMYEZKN-DHZHZOJOSA-N	0	0	278.355	4.303	20	30		CIEDRN
N#CCn1c(/C=C/c2sccc2Cl)nc2ccccc21	ZINC000486077777	331930898	/nfs/dbraw/zinc/93/08/98/331930898.db2.gz	SJLHHEZTWFOKDQ-AATRIKPKSA-N	0	0	299.786	4.445	20	30		CIEDRN
Cc1cccc(/C=C/c2nc3ccccc3n2CC#N)c1	ZINC000486105416	331931659	/nfs/dbraw/zinc/93/16/59/331931659.db2.gz	WYPMAMGMUAFFQV-MDZDMXLPSA-N	0	0	273.339	4.039	20	30		CIEDRN
CCCC(C)(C)CC(=O)N(C)c1cc(Cl)ccc1C#N	ZINC000486205624	331933419	/nfs/dbraw/zinc/93/34/19/331933419.db2.gz	QVMAZUMEARNAFG-UHFFFAOYSA-N	0	0	292.810	4.391	20	30		CIEDRN
C=CCCO[C@H](C)C(=O)N(CC(C)(C)C)c1ccccc1	ZINC000486599733	331940129	/nfs/dbraw/zinc/94/01/29/331940129.db2.gz	GLKZRKXUDROEAA-OAHLLOKOSA-N	0	0	289.419	4.047	20	30		CIEDRN
C=C(C)CS[C@@H](C)C(=O)N1c2ccccc2CC[C@@H]1C	ZINC000486772025	331944148	/nfs/dbraw/zinc/94/41/48/331944148.db2.gz	SWJVPICJVJAOOV-KBPBESRZSA-N	0	0	289.444	4.052	20	30		CIEDRN
C=CCN(CCc1ccccc1)C(=O)c1ccc(C)cc1F	ZINC000486911575	331949273	/nfs/dbraw/zinc/94/92/73/331949273.db2.gz	NHZRQUGYDSUMQM-UHFFFAOYSA-N	0	0	297.373	4.005	20	30		CIEDRN
N#Cc1cccnc1N[C@H]1CCC[C@@H](c2ccccc2)C1	ZINC000487107177	331956541	/nfs/dbraw/zinc/95/65/41/331956541.db2.gz	ZKTABEJGXIGXBZ-WBVHZDCISA-N	0	0	277.371	4.092	20	30		CIEDRN
N#Cc1ccc(N[C@@H]2CCC[C@H](c3ccccc3)C2)cn1	ZINC000487136788	331956905	/nfs/dbraw/zinc/95/69/05/331956905.db2.gz	KPPVSSGBSYVTBB-JKSUJKDBSA-N	0	0	277.371	4.092	20	30		CIEDRN
COc1ccc(CS[C@@H]2CC[C@H](C#N)C2)cc1Cl	ZINC000487176077	331958415	/nfs/dbraw/zinc/95/84/15/331958415.db2.gz	LCQRBBNTJKZNEM-CMPLNLGQSA-N	0	0	281.808	4.274	20	30		CIEDRN
CN(Cc1ccccc1C(C)(C)C#N)c1ccc(F)cc1	ZINC000487383204	331968378	/nfs/dbraw/zinc/96/83/78/331968378.db2.gz	YMDJRBIPYNNKKZ-UHFFFAOYSA-N	0	0	282.362	4.263	20	30		CIEDRN
N#CCC[C@@H](NCc1scnc1C1CC1)c1ccccc1	ZINC000487566251	331975113	/nfs/dbraw/zinc/97/51/13/331975113.db2.gz	AZEKCXTVAZBHDF-OAHLLOKOSA-N	0	0	297.427	4.155	20	30		CIEDRN
C=CC[C@@H](C(=O)NCCC1=CCCCC1)c1ccccc1	ZINC000487588070	331976530	/nfs/dbraw/zinc/97/65/30/331976530.db2.gz	QETWHCQFQUKSFY-GOSISDBHSA-N	0	0	283.415	4.353	20	30		CIEDRN
CC1(CC(=O)Nc2cc(C#N)ccc2NC2CC2)CCCC1	ZINC000487598707	331976641	/nfs/dbraw/zinc/97/66/41/331976641.db2.gz	OGMKVWBYQQXCHN-UHFFFAOYSA-N	0	0	297.402	4.041	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1cccc(C)c1)c1ccccc1	ZINC000487613369	331977046	/nfs/dbraw/zinc/97/70/46/331977046.db2.gz	CLKINENTCLWMHA-QGZVFWFLSA-N	0	0	265.356	4.293	20	30		CIEDRN
C=CC[C@H](C(=O)NC[C@H](C)c1ccccc1)c1ccccc1	ZINC000487624639	331977278	/nfs/dbraw/zinc/97/72/78/331977278.db2.gz	FCRMHJHIPGZPRL-LPHOPBHVSA-N	0	0	293.410	4.266	20	30		CIEDRN
C=CC[C@H](C(=O)NC1CCCCCC1)c1ccccc1	ZINC000487632908	331977709	/nfs/dbraw/zinc/97/77/09/331977709.db2.gz	BPVIYODSLJJFGK-KRWDZBQOSA-N	0	0	271.404	4.185	20	30		CIEDRN
CC(C)[C@H](c1ccccc1)N(C)C(=O)c1ccc(C#N)s1	ZINC000487668645	331978670	/nfs/dbraw/zinc/97/86/70/331978670.db2.gz	RJYVUNWOKOYKIH-MRXNPFEDSA-N	0	0	298.411	4.089	20	30		CIEDRN
Cc1nc(N[C@H](C)c2cc3ccccc3s2)ccc1C#N	ZINC000487760559	331980819	/nfs/dbraw/zinc/98/08/19/331980819.db2.gz	JMDOQQKRYHTXMC-GFCCVEGCSA-N	0	0	293.395	4.071	20	30		CIEDRN
C=CCC[C@H](C(=O)N(CC)CC(=C)C)c1ccccc1	ZINC000487802461	331981483	/nfs/dbraw/zinc/98/14/83/331981483.db2.gz	PCZADFJONNZPFM-KRWDZBQOSA-N	0	0	271.404	4.161	20	30		CIEDRN
Cc1ccc2ncc(C#N)c(N3C[C@@H]4CCCC[C@H]4C3)c2c1	ZINC000488080507	331989512	/nfs/dbraw/zinc/98/95/12/331989512.db2.gz	VRKNTPGDLNNQOE-GJZGRUSLSA-N	0	0	291.398	4.041	20	30		CIEDRN
N#Cc1ccc(NCCc2cccc(F)c2F)cc1Cl	ZINC000488184947	331993126	/nfs/dbraw/zinc/99/31/26/331993126.db2.gz	ZQYDMHWTCDBQKX-UHFFFAOYSA-N	0	0	292.716	4.144	20	30		CIEDRN
N#Cc1c(F)cccc1CSc1ccc(N)cc1Cl	ZINC000488263448	331996689	/nfs/dbraw/zinc/99/66/89/331996689.db2.gz	KFFMRBSSFCIVOQ-UHFFFAOYSA-N	0	0	292.766	4.225	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CCC(C)(c2ccccc2)CC1	ZINC000488373383	332002657	/nfs/dbraw/zinc/00/26/57/332002657.db2.gz	CKYMYRIMJOZCKH-UHFFFAOYSA-N	0	0	285.431	4.169	20	30		CIEDRN
C=CCC[C@H](C(=O)N(C)C[C@@H](C)CC)c1ccccc1	ZINC000488388818	332003387	/nfs/dbraw/zinc/00/33/87/332003387.db2.gz	RDZQAYNIKXPHCE-RDJZCZTQSA-N	0	0	273.420	4.241	20	30		CIEDRN
CC(C)c1ccc(/C=C\CC(=O)N[C@@](C)(C#N)C(C)C)cc1	ZINC000488463415	332011594	/nfs/dbraw/zinc/01/15/94/332011594.db2.gz	ZVUOCVSLAITYOB-RURPWVQCSA-N	0	0	298.430	4.268	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)[C@@H]1CCCCCC(=O)C1	ZINC000488564365	332017816	/nfs/dbraw/zinc/01/78/16/332017816.db2.gz	QPBRQIHHKGOTTM-MRXNPFEDSA-N	0	0	299.414	4.283	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1ccc(C)c(CC)c1	ZINC000488567727	332017978	/nfs/dbraw/zinc/01/79/78/332017978.db2.gz	ZHRGUKLHXFVKOD-MRXNPFEDSA-N	0	0	272.392	4.130	20	30		CIEDRN
C=C(C)CNC(=O)N(CCCC)Cc1ccccc1Cl	ZINC000488576649	332018659	/nfs/dbraw/zinc/01/86/59/332018659.db2.gz	KCALMBLBPYCWFK-UHFFFAOYSA-N	0	0	294.826	4.228	20	30		CIEDRN
C=C(C)CNC(=O)N[C@H](c1ccc(Cl)cc1)C1CCC1	ZINC000488583975	332019064	/nfs/dbraw/zinc/01/90/64/332019064.db2.gz	SLJCAXFOBRGSOH-HNNXBMFYSA-N	0	0	292.810	4.057	20	30		CIEDRN
N#Cc1cccc(N[C@H]2CCCc3sc(Cl)cc32)n1	ZINC000488724265	332022775	/nfs/dbraw/zinc/02/27/75/332022775.db2.gz	SAWIWVZEDHGTBM-NSHDSACASA-N	0	0	289.791	4.158	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@@H](C)Cc1cccc(Cl)c1	ZINC000488818723	332027314	/nfs/dbraw/zinc/02/73/14/332027314.db2.gz	RJAHQLATQXJQOB-XJKSGUPXSA-N	0	0	291.822	4.086	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)C[C@@H](C)c1ccc(F)cc1F	ZINC000488822182	332027406	/nfs/dbraw/zinc/02/74/06/332027406.db2.gz	WCTPUNRHQDHXKN-OCCSQVGLSA-N	0	0	293.357	4.026	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1ccc(Cl)c(Cl)c1	ZINC000488838699	332028460	/nfs/dbraw/zinc/02/84/60/332028460.db2.gz	DQRSKFBWDANYFH-LLVKDONJSA-N	0	0	284.186	4.174	20	30		CIEDRN
N#Cc1ccc(-c2ccccc2)nc1SCCCF	ZINC000488846658	332029194	/nfs/dbraw/zinc/02/91/94/332029194.db2.gz	ZHCXUZSROBIRSZ-UHFFFAOYSA-N	0	0	272.348	4.072	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)C[C@H](c1ccccc1)C(C)C	ZINC000488855515	332029604	/nfs/dbraw/zinc/02/96/04/332029604.db2.gz	ANAZIXPMIAJYMR-ROUUACIJSA-N	0	0	285.431	4.383	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)C[C@H](CC)c1ccccc1	ZINC000488862092	332030093	/nfs/dbraw/zinc/03/00/93/332030093.db2.gz	HEXLEKDZQJSFJM-RDJZCZTQSA-N	0	0	271.404	4.137	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)CCc1ccc2ccccc2c1	ZINC000488868822	332030195	/nfs/dbraw/zinc/03/01/95/332030195.db2.gz	PCHDABONCDADAR-IBGZPJMESA-N	0	0	293.410	4.340	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1oc2c(cccc2C)c1C	ZINC000488871316	332030443	/nfs/dbraw/zinc/03/04/43/332030443.db2.gz	FKTRDZNJGRMWDT-CQSZACIVSA-N	0	0	283.371	4.230	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1ccc(Oc2ccccc2)o1	ZINC000488875418	332030915	/nfs/dbraw/zinc/03/09/15/332030915.db2.gz	DVNWRXUQHVTIEN-CQSZACIVSA-N	0	0	297.354	4.253	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)C[C@@H](C)c1ccccc1C	ZINC000488875466	332031092	/nfs/dbraw/zinc/03/10/92/332031092.db2.gz	DYAAJBBULUQJCP-CVEARBPZSA-N	0	0	271.404	4.056	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)[C@H](C)c1cccc(Cl)c1	ZINC000488878266	332031358	/nfs/dbraw/zinc/03/13/58/332031358.db2.gz	IJQSTRPYHWWERO-DOMZBBRYSA-N	0	0	277.795	4.011	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)[C@H](C)c1cc2ccccc2o1	ZINC000488877875	332031406	/nfs/dbraw/zinc/03/14/06/332031406.db2.gz	JDIFWIFXJLOGQG-HIFRSBDPSA-N	0	0	283.371	4.103	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1ccc(C(C)C)s1	ZINC000488882646	332031935	/nfs/dbraw/zinc/03/19/35/332031935.db2.gz	QNBUITZJDGVDSC-LBPRGKRZSA-N	0	0	263.406	4.052	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1cccc(OC2CCCC2)c1	ZINC000488885330	332032140	/nfs/dbraw/zinc/03/21/40/332032140.db2.gz	VBFROEXILBFAEV-MRXNPFEDSA-N	0	0	299.414	4.189	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)C[C@@H](CC)c1ccc(C)cc1	ZINC000488889021	332032437	/nfs/dbraw/zinc/03/24/37/332032437.db2.gz	ZJTMXCUVUWPICL-SJLPKXTDSA-N	0	0	285.431	4.446	20	30		CIEDRN
C=CCCCSc1nnc(-c2cccc(Cl)c2)n1C	ZINC000488916714	332033525	/nfs/dbraw/zinc/03/35/25/332033525.db2.gz	UQLFFGHIEYPEDL-UHFFFAOYSA-N	0	0	293.823	4.194	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1cccc2ccsc21	ZINC000488914789	332033626	/nfs/dbraw/zinc/03/36/26/332033626.db2.gz	QZOBIVJXYRRKBN-CYBMUJFWSA-N	0	0	286.400	4.474	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@@H](C)C[C@H](C)CC)c1ccccc1	ZINC000488982015	332036490	/nfs/dbraw/zinc/03/64/90/332036490.db2.gz	NGNUFQHTAVYNDC-VYDXJSESSA-N	0	0	273.420	4.287	20	30		CIEDRN
C=CCC[C@@H](C(=O)NC[C@H](C)C(C)C)c1ccccc1	ZINC000489006989	332037408	/nfs/dbraw/zinc/03/74/08/332037408.db2.gz	FQNBKZBOKSYMPS-DOTOQJQBSA-N	0	0	273.420	4.145	20	30		CIEDRN
C=C[C@@H]1CCCCN1Cc1ncc(-c2ccccc2F)o1	ZINC000489405460	332050393	/nfs/dbraw/zinc/05/03/93/332050393.db2.gz	QOPJUAFTAZTCFO-CYBMUJFWSA-N	0	0	286.350	4.021	20	30		CIEDRN
C=C[C@@H]1CCCCN1Cc1csc(Cc2ccccc2)n1	ZINC000489424276	332051195	/nfs/dbraw/zinc/05/11/95/332051195.db2.gz	IKENBPJVTVVRLU-QGZVFWFLSA-N	0	0	298.455	4.274	20	30		CIEDRN
CC(C)(C)c1ccc([C@@H](C#N)NC(=O)C2CC(C)(C)C2)cc1	ZINC000511737002	332941430	/nfs/dbraw/zinc/94/14/30/332941430.db2.gz	JJPDLWYJUKOXJY-MRXNPFEDSA-N	0	0	298.430	4.101	20	30		CIEDRN
C=CCCCSc1nnc(-c2cccs2)n1CC=C	ZINC000489436358	332052184	/nfs/dbraw/zinc/05/21/84/332052184.db2.gz	VKQCJDRDWCWBLR-UHFFFAOYSA-N	0	0	291.445	4.251	20	30		CIEDRN
C=C[C@@H]1CCCCN1Cc1csc(-c2ccc(C)o2)n1	ZINC000489448178	332053084	/nfs/dbraw/zinc/05/30/84/332053084.db2.gz	QYYRABDAUQILRZ-CQSZACIVSA-N	0	0	288.416	4.252	20	30		CIEDRN
C=C[C@H]1CCCCN1Cc1sccc1Br	ZINC000489445814	332053284	/nfs/dbraw/zinc/05/32/84/332053284.db2.gz	HAPOTPTUHKZJTJ-JTQLQIEISA-N	0	0	286.238	4.051	20	30		CIEDRN
N#Cc1cc(F)ccc1CN1CCC[C@@H]1c1ccc(F)cc1	ZINC000489563603	332059464	/nfs/dbraw/zinc/05/94/64/332059464.db2.gz	CMMPFDQHAVSAJN-GOSISDBHSA-N	0	0	298.336	4.174	20	30		CIEDRN
Cc1cccc([C@H]2CCCN2Cc2ccc(F)cc2C#N)c1	ZINC000489570074	332059739	/nfs/dbraw/zinc/05/97/39/332059739.db2.gz	WDROHFMZLSRJCN-LJQANCHMSA-N	0	0	294.373	4.343	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccc(C)c(OC(C)C)c1	ZINC000489591054	332060632	/nfs/dbraw/zinc/06/06/32/332060632.db2.gz	YQPMYQAWBYPWIY-UHFFFAOYSA-N	0	0	290.407	4.212	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@H](CC=C)c1ccccc1	ZINC000489643425	332062739	/nfs/dbraw/zinc/06/27/39/332062739.db2.gz	TYEDTABWBXEZNE-DOTOQJQBSA-N	0	0	271.404	4.207	20	30		CIEDRN
C=CCCCSc1nnc(-c2ccc(F)cc2)n1CC	ZINC000489660523	332063635	/nfs/dbraw/zinc/06/36/35/332063635.db2.gz	XGUIEYXLUGDZTB-UHFFFAOYSA-N	0	0	291.395	4.162	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H]1CCC[C@H](c2ccccc2)C1	ZINC000489665801	332063794	/nfs/dbraw/zinc/06/37/94/332063794.db2.gz	MFVYLOIHLALNSY-SZMVWBNQSA-N	0	0	285.431	4.431	20	30		CIEDRN
C=CC[C@@H](C(=O)N1Cc2ccccc2[C@H]1C)c1ccccc1	ZINC000489683284	332064706	/nfs/dbraw/zinc/06/47/06/332064706.db2.gz	QQGKCPCXLRUIPB-DNVCBOLYSA-N	0	0	291.394	4.450	20	30		CIEDRN
C=CCC[C@@H](C(=O)Nc1cccnc1C)c1ccccc1	ZINC000489694848	332065047	/nfs/dbraw/zinc/06/50/47/332065047.db2.gz	BXCSQOXZRASQIS-MRXNPFEDSA-N	0	0	280.371	4.079	20	30		CIEDRN
C=CCC[C@@H](C(=O)N[C@H](C)CC(C)C)c1ccccc1	ZINC000489696006	332065254	/nfs/dbraw/zinc/06/52/54/332065254.db2.gz	IERFCNPMEHXBLQ-NVXWUHKLSA-N	0	0	273.420	4.287	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1c(C)oc2ccccc21	ZINC000489713543	332065634	/nfs/dbraw/zinc/06/56/34/332065634.db2.gz	JZGFVMSNEWCFQF-UHFFFAOYSA-N	0	0	271.360	4.073	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1c(Cl)cccc1Cl	ZINC000489737226	332066486	/nfs/dbraw/zinc/06/64/86/332066486.db2.gz	SZHLNHIOPTWNRX-UHFFFAOYSA-N	0	0	286.202	4.326	20	30		CIEDRN
C=CCN(CC=C)C(=O)Nc1ccc(C2CCC2)cc1	ZINC000489739471	332066519	/nfs/dbraw/zinc/06/65/19/332066519.db2.gz	DOQCCDVRLDKKNG-UHFFFAOYSA-N	0	0	270.376	4.160	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@H](CCC)c1ccccc1	ZINC000489769045	332067340	/nfs/dbraw/zinc/06/73/40/332067340.db2.gz	OGIGACNUSPUVMF-MRXNPFEDSA-N	0	0	273.420	4.289	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1ccccc1CSCC	ZINC000489799822	332068305	/nfs/dbraw/zinc/06/83/05/332068305.db2.gz	KRKIXMAXJGWEDB-UHFFFAOYSA-N	0	0	291.460	4.272	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1cc2cc(C)ccc2o1	ZINC000489860777	332070533	/nfs/dbraw/zinc/07/05/33/332070533.db2.gz	PSWFSHFHCKIQMC-UHFFFAOYSA-N	0	0	271.360	4.073	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)C[C@@H](C)c1ccc(F)cc1F	ZINC000489904292	332072482	/nfs/dbraw/zinc/07/24/82/332072482.db2.gz	CTXGQVVDQLLENU-GFCCVEGCSA-N	0	0	295.373	4.177	20	30		CIEDRN
Cc1ccc2oc(SCc3ccc(F)cc3C#N)nc2c1	ZINC000303612225	332942391	/nfs/dbraw/zinc/94/23/91/332942391.db2.gz	OSCFSEIDRFWSJO-UHFFFAOYSA-N	0	0	298.342	4.439	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1cccc(SCC)c1	ZINC000489937506	332073389	/nfs/dbraw/zinc/07/33/89/332073389.db2.gz	VJDUUFKRGORLRR-UHFFFAOYSA-N	0	0	277.433	4.131	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@@H](c1ccncc1)C(C)C	ZINC000498576619	332074997	/nfs/dbraw/zinc/07/49/97/332074997.db2.gz	LIKXXAMJIRZEJJ-QGZVFWFLSA-N	0	0	288.435	4.026	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)Cc1ccc(SCC)cc1	ZINC000489976502	332075389	/nfs/dbraw/zinc/07/53/89/332075389.db2.gz	GWACWZCTOAQPNT-UHFFFAOYSA-N	0	0	291.460	4.060	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)C[C@H](CC)c1ccccc1	ZINC000490007289	332076321	/nfs/dbraw/zinc/07/63/21/332076321.db2.gz	UWCVUCCOADOXTK-HNNXBMFYSA-N	0	0	273.420	4.289	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1cncc(-c2ccccc2)c1	ZINC000490012324	332076555	/nfs/dbraw/zinc/07/65/55/332076555.db2.gz	IEYNFENIJSIUNO-UHFFFAOYSA-N	0	0	294.398	4.081	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@H](c1ccc(F)cc1)C(C)C	ZINC000490086019	332080886	/nfs/dbraw/zinc/08/08/86/332080886.db2.gz	FQWWKVDBMOKTKL-INIZCTEOSA-N	0	0	291.410	4.284	20	30		CIEDRN
C[C@H](c1cc(Cl)ccc1Cl)N(C)C[C@H](C)C#N	ZINC000490159216	332083369	/nfs/dbraw/zinc/08/33/69/332083369.db2.gz	QEKLIQQTALRAPO-NXEZZACHSA-N	0	0	271.191	4.146	20	30		CIEDRN
C=CCCC1(C(=O)NCc2ccc(C(C)(F)F)cc2)CC1	ZINC000490179125	332083834	/nfs/dbraw/zinc/08/38/34/332083834.db2.gz	VRGMOGWXOSCPCK-UHFFFAOYSA-N	0	0	293.357	4.161	20	30		CIEDRN
C[C@H](C#N)CN(C)[C@H]1CCc2c1cc(Cl)cc2Cl	ZINC000490189534	332083941	/nfs/dbraw/zinc/08/39/41/332083941.db2.gz	ZEJBOCDTYWNJOI-OTYXRUKQSA-N	0	0	283.202	4.072	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@H](C)CCC1CC1)c1ccccc1	ZINC000490251670	332085274	/nfs/dbraw/zinc/08/52/74/332085274.db2.gz	OFXGJYDMMULSRD-RHSMWYFYSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CC[C@H](C(=O)N(C)C[C@H]1CC=CCC1)c1ccccc1	ZINC000490243167	332085411	/nfs/dbraw/zinc/08/54/11/332085411.db2.gz	ITHJTMVQDCQUKJ-WMZOPIPTSA-N	0	0	283.415	4.161	20	30		CIEDRN
C=CCC1(C(=O)NCc2ccc(C(C)(F)F)cc2)CCC1	ZINC000490274445	332085810	/nfs/dbraw/zinc/08/58/10/332085810.db2.gz	OPAXQIBVKPUHRY-UHFFFAOYSA-N	0	0	293.357	4.161	20	30		CIEDRN
C=CCN(C)C(=O)c1cc(Cl)ccc1SCCCC	ZINC000491021302	332139898	/nfs/dbraw/zinc/13/98/98/332139898.db2.gz	UPRVHVDGWGVEIB-UHFFFAOYSA-N	0	0	297.851	4.490	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@H](c1ccccc1C)C1CC1	ZINC000491128919	332154566	/nfs/dbraw/zinc/15/45/66/332154566.db2.gz	BOSIULYJEMKMJJ-KRWDZBQOSA-N	0	0	286.419	4.054	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@H](C)c1cc2ccccc2s1	ZINC000172135498	335095820	/nfs/dbraw/zinc/09/58/20/335095820.db2.gz	XEOWVFZLBPZGBN-NWDGAFQWSA-N	0	0	288.416	4.226	20	30		CIEDRN
C#CCN(C(=O)Nc1c(C)cccc1Cl)C1CCCC1	ZINC000491778618	332343800	/nfs/dbraw/zinc/34/38/00/332343800.db2.gz	YVKKWNXBRNIWSZ-UHFFFAOYSA-N	0	0	290.794	4.058	20	30		CIEDRN
C/C=C(/C=C/C(=O)Nc1cccc(OCCCC#N)c1)CC	ZINC000492118696	332383609	/nfs/dbraw/zinc/38/36/09/332383609.db2.gz	ZQANCIQXPBJYLJ-IJLQRFOLSA-N	0	0	298.386	4.220	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)CSCCC(C)C	ZINC000493667775	332449291	/nfs/dbraw/zinc/44/92/91/332449291.db2.gz	XCYWQAUBMSUPIE-UHFFFAOYSA-N	0	0	297.489	4.042	20	30		CIEDRN
COc1ccc(C#N)cc1N[C@H](C)c1cc(F)ccc1F	ZINC000493838814	332456055	/nfs/dbraw/zinc/45/60/55/332456055.db2.gz	ZJFDOKAASFZQHO-SNVBAGLBSA-N	0	0	288.297	4.018	20	30		CIEDRN
CC[C@@H](Sc1cc(C#N)ccn1)c1ccccc1	ZINC000494075084	332462602	/nfs/dbraw/zinc/46/26/02/332462602.db2.gz	LFIZVMYKHQMQJD-CQSZACIVSA-N	0	0	254.358	4.197	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)N[C@@H](c1ccc(C)cc1)C1CC1	ZINC000494244008	332468256	/nfs/dbraw/zinc/46/82/56/332468256.db2.gz	FWJYRWIINXWYKU-ROUUACIJSA-N	0	0	298.430	4.196	20	30		CIEDRN
C=CCC[C@H](CC)Nc1cc(NC(=O)NCC)ccc1C	ZINC000494513891	332476723	/nfs/dbraw/zinc/47/67/23/332476723.db2.gz	VPRGYVPTQFYGSU-AWEZNQCLSA-N	0	0	289.423	4.293	20	30		CIEDRN
C=C1CCN(C(=O)C(C)(C)CCCc2ccccc2)CC1	ZINC000494731013	332484685	/nfs/dbraw/zinc/48/46/85/332484685.db2.gz	NLRNVYIBDNFFTO-UHFFFAOYSA-N	0	0	285.431	4.214	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N[C@H](C)CCCC(F)(F)F	ZINC000494793159	332485895	/nfs/dbraw/zinc/48/58/95/332485895.db2.gz	IMBMDULJKXMQGI-NWDGAFQWSA-N	0	0	294.361	4.152	20	30		CIEDRN
C=CCC[C@H](C(=O)N(C)CC1CCCC1)c1ccccc1	ZINC000494832730	332486923	/nfs/dbraw/zinc/48/69/23/332486923.db2.gz	FQXZZWGJMOZBJJ-SFHVURJKSA-N	0	0	285.431	4.385	20	30		CIEDRN
C=CCC[C@@H](C(=O)N(C)CC1CCCC1)c1ccccc1	ZINC000494832729	332486964	/nfs/dbraw/zinc/48/69/64/332486964.db2.gz	FQXZZWGJMOZBJJ-GOSISDBHSA-N	0	0	285.431	4.385	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)C/C(C)=C\c1ccccc1	ZINC000494862739	332488724	/nfs/dbraw/zinc/48/87/24/332488724.db2.gz	DNLKPWRKMRURRD-IRVMHKCDSA-N	0	0	271.404	4.151	20	30		CIEDRN
C=CCCCCNC(=O)Nc1c(C)cc(OC)c(C)c1C	ZINC000495010667	332499742	/nfs/dbraw/zinc/49/97/42/332499742.db2.gz	UKDONGOPLRQPRH-UHFFFAOYSA-N	0	0	290.407	4.098	20	30		CIEDRN
C=CCCO[C@@H](C)C(=O)NC1CCC(C(C)(C)CC)CC1	ZINC000495316968	332514721	/nfs/dbraw/zinc/51/47/21/332514721.db2.gz	SEJNYDYOTTUXLL-FHERZECASA-N	0	0	295.467	4.079	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(F)cc1OC(C)(C)C	ZINC000498825759	332573905	/nfs/dbraw/zinc/57/39/05/332573905.db2.gz	OHTBGOSGSCODSL-UHFFFAOYSA-N	0	0	279.355	4.298	20	30		CIEDRN
CCC[C@@H](CC1CCCCC1)C(=O)N(CC)C[C@H](C)C#N	ZINC000499395131	332585361	/nfs/dbraw/zinc/58/53/61/332585361.db2.gz	XDTOXCZIQVUFHC-WBVHZDCISA-N	0	0	292.467	4.381	20	30		CIEDRN
CCC[C@H](CC1CCCC1)C(=O)NCc1ccc(C#N)cc1	ZINC000499410817	332585475	/nfs/dbraw/zinc/58/54/75/332585475.db2.gz	FBRZZTDKKKSAII-GOSISDBHSA-N	0	0	298.430	4.171	20	30		CIEDRN
N#Cc1cccc(N[C@H]2CCC[C@H](c3cccnc3)C2)c1	ZINC000500393026	332606288	/nfs/dbraw/zinc/60/62/88/332606288.db2.gz	AAUZFGBJRBXCFI-YJBOKZPZSA-N	0	0	277.371	4.092	20	30		CIEDRN
C=CCCc1ccccc1NCc1cccc(OC)c1OC	ZINC000500450408	332609787	/nfs/dbraw/zinc/60/97/87/332609787.db2.gz	GBQRIZIFWZNTTB-UHFFFAOYSA-N	0	0	297.398	4.435	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)[C@H]2CCCC2(C)C)cc1	ZINC000500716543	332616682	/nfs/dbraw/zinc/61/66/82/332616682.db2.gz	WLLHUZAOQNGJMY-OAHLLOKOSA-N	0	0	284.403	4.253	20	30		CIEDRN
COc1cc(C#N)ccc1CNc1cc(Cl)ccc1C	ZINC000500877717	332621071	/nfs/dbraw/zinc/62/10/71/332621071.db2.gz	XOWDNSZFGNLVSR-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
COc1cc(C#N)ccc1CNc1cccc2c1CCCC2	ZINC000500877592	332621108	/nfs/dbraw/zinc/62/11/08/332621108.db2.gz	SWLGFYFBNAQIJE-UHFFFAOYSA-N	0	0	292.382	4.058	20	30		CIEDRN
COc1ccc(C#N)cc1NCc1cc2ccccc2s1	ZINC000500979251	332623345	/nfs/dbraw/zinc/62/33/45/332623345.db2.gz	HZCBGWLGGYIZMG-UHFFFAOYSA-N	0	0	294.379	4.394	20	30		CIEDRN
CC(C)Oc1ccc(C#N)cc1NCc1ccc(Cl)o1	ZINC000501007483	332623960	/nfs/dbraw/zinc/62/39/60/332623960.db2.gz	XWGHJXABHLPTDB-UHFFFAOYSA-N	0	0	290.750	4.204	20	30		CIEDRN
C=CCOc1cccc(NC(=O)C[C@H](C)c2ccccc2)c1	ZINC000501155500	332627749	/nfs/dbraw/zinc/62/77/49/332627749.db2.gz	OCXQDQXBACYBEL-HNNXBMFYSA-N	0	0	295.382	4.384	20	30		CIEDRN
CCN(CCC#N)[C@@H](C)c1cc(Cl)ccc1Cl	ZINC000154854006	334705889	/nfs/dbraw/zinc/70/58/89/334705889.db2.gz	RIMYXMKZEKYQTJ-JTQLQIEISA-N	0	0	271.191	4.290	20	30		CIEDRN
C=CCCc1ccccc1N[C@@H]1CCC[C@H](C#N)C1	ZINC000502310087	332653233	/nfs/dbraw/zinc/65/32/33/332653233.db2.gz	OCWYCWIWASOGAR-GOEBONIOSA-N	0	0	254.377	4.299	20	30		CIEDRN
C=CCC[C@H](CCC)Nc1cccc2c1ccn(C)c2=O	ZINC000502319047	332653731	/nfs/dbraw/zinc/65/37/31/332653731.db2.gz	IOYXNZYICDMASC-AWEZNQCLSA-N	0	0	284.403	4.085	20	30		CIEDRN
C=CCCc1ccccc1N[C@H](C)C1CCOCC1	ZINC000502365664	332655007	/nfs/dbraw/zinc/65/50/07/332655007.db2.gz	LRPZYFDRDMNWBE-CQSZACIVSA-N	0	0	259.393	4.032	20	30		CIEDRN
N#Cc1ccc(SCc2c(F)cccc2F)cc1	ZINC000502901349	332675657	/nfs/dbraw/zinc/67/56/57/332675657.db2.gz	FXRKHMKPSIBHKN-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
CCc1c(C)sc(NC(=O)[C@@H](C)[C@H](C)CC)c1C#N	ZINC000503027735	332678906	/nfs/dbraw/zinc/67/89/06/332678906.db2.gz	PMYYUELGIAKAOL-ZJUUUORDSA-N	0	0	278.421	4.111	20	30		CIEDRN
CC#CCCSCc1nc(-c2ccsc2)oc1C	ZINC000154934340	334708439	/nfs/dbraw/zinc/70/84/39/334708439.db2.gz	NHPUYPFLXZYMTC-UHFFFAOYSA-N	0	0	277.414	4.358	20	30		CIEDRN
N#Cc1ccc(SCCc2c(F)cccc2Cl)nc1	ZINC000503915720	332699036	/nfs/dbraw/zinc/69/90/36/332699036.db2.gz	GAUGGAYFMMUNKT-UHFFFAOYSA-N	0	0	292.766	4.081	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N1CC(CC)(CC)C1	ZINC000504212995	332706111	/nfs/dbraw/zinc/70/61/11/332706111.db2.gz	YLBMABABPVEFQQ-UHFFFAOYSA-N	0	0	289.444	4.227	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1cc(C)n(CC)c1C	ZINC000504276335	332707326	/nfs/dbraw/zinc/70/73/26/332707326.db2.gz	CBNOJWDSLQXBRK-UHFFFAOYSA-N	0	0	296.414	4.496	20	30		CIEDRN
C[C@H](NC(=O)C[C@@H]1CCCCC1(C)C)c1ccc(C#N)cc1	ZINC000504429582	332711731	/nfs/dbraw/zinc/71/17/31/332711731.db2.gz	SVEDGFDOUBNMQV-YOEHRIQHSA-N	0	0	298.430	4.342	20	30		CIEDRN
C[C@H](NC(=O)CC1CCC(C)(C)CC1)c1ccc(C#N)cc1	ZINC000504436913	332711977	/nfs/dbraw/zinc/71/19/77/332711977.db2.gz	RVLUKUSMKXLLPR-AWEZNQCLSA-N	0	0	298.430	4.342	20	30		CIEDRN
CCc1cccc2c(/C=C/c3ccncc3C#N)c[nH]c21	ZINC000504731643	332719664	/nfs/dbraw/zinc/71/96/64/332719664.db2.gz	PSWZGESXIHOIFL-VOTSOKGWSA-N	0	0	273.339	4.167	20	30		CIEDRN
CCc1cccc2c(/C=C\c3ccncc3C#N)c[nH]c21	ZINC000504731633	332719684	/nfs/dbraw/zinc/71/96/84/332719684.db2.gz	PSWZGESXIHOIFL-SREVYHEPSA-N	0	0	273.339	4.167	20	30		CIEDRN
CCCCOc1ccccc1/C=C/c1ccncc1C#N	ZINC000504733931	332719701	/nfs/dbraw/zinc/71/97/01/332719701.db2.gz	WOAPSDXMXVQRQU-CMDGGOBGSA-N	0	0	278.355	4.303	20	30		CIEDRN
Cc1cc(SC[C@@H](C)C(F)(F)F)ccc1C#N	ZINC000569244611	334863214	/nfs/dbraw/zinc/86/32/14/334863214.db2.gz	WEUBSYXKPRCCJA-SECBINFHSA-N	0	0	259.296	4.157	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1C[C@H](C)CC[C@@H]1C	ZINC000505002041	332727280	/nfs/dbraw/zinc/72/72/80/332727280.db2.gz	ZRWMCJPZRLHYLW-CABCVRRESA-N	0	0	286.419	4.458	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1C[C@@H](C)CC[C@@H]1C	ZINC000505002042	332727290	/nfs/dbraw/zinc/72/72/90/332727290.db2.gz	ZRWMCJPZRLHYLW-GJZGRUSLSA-N	0	0	286.419	4.458	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)NCc1ccc(F)cc1	ZINC000505005086	332727602	/nfs/dbraw/zinc/72/76/02/332727602.db2.gz	IIADLKUXKPPYPH-UHFFFAOYSA-N	0	0	298.361	4.266	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CCC(C)(C)C1	ZINC000505011325	332727676	/nfs/dbraw/zinc/72/76/76/332727676.db2.gz	TYISUAOKVVILIV-UHFFFAOYSA-N	0	0	272.392	4.069	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N(CC)C(C)C	ZINC000505035001	332728588	/nfs/dbraw/zinc/72/85/88/332728588.db2.gz	JJWAFVGJKPQQRE-UHFFFAOYSA-N	0	0	260.381	4.067	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1C[C@@H](C)C[C@H]1C	ZINC000505034863	332728599	/nfs/dbraw/zinc/72/85/99/332728599.db2.gz	HZCDCQZJXIUJRS-UONOGXRCSA-N	0	0	272.392	4.067	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CC[C@@H]2CCC[C@@H]21	ZINC000505046732	332729123	/nfs/dbraw/zinc/72/91/23/332729123.db2.gz	YCGQDQAXCGOVGC-RDJZCZTQSA-N	0	0	284.403	4.212	20	30		CIEDRN
CCCCCc1ccc(NC(=O)[C@@](C)(C#N)CC)cc1	ZINC000505160036	332732832	/nfs/dbraw/zinc/73/28/32/332732832.db2.gz	LPTUFRAPZNJECH-QGZVFWFLSA-N	0	0	272.392	4.298	20	30		CIEDRN
C=C(C)CCSc1nnc(-c2ccc(Cl)cc2)o1	ZINC000505462650	332741551	/nfs/dbraw/zinc/74/15/51/332741551.db2.gz	SRSQXKSIKOMEJH-UHFFFAOYSA-N	0	0	280.780	4.448	20	30		CIEDRN
CC(C)(C)CC(=O)N[C@H](C#N)c1ccc(C(C)(C)C)cc1	ZINC000505798019	332752927	/nfs/dbraw/zinc/75/29/27/332752927.db2.gz	YKGMFDKUXVDNIC-OAHLLOKOSA-N	0	0	286.419	4.101	20	30		CIEDRN
CC[C@]1(C)C[C@@H]1C(=O)N[C@@H](C#N)c1ccc(C(C)(C)C)cc1	ZINC000505810256	332753454	/nfs/dbraw/zinc/75/34/54/332753454.db2.gz	YAJHGPUAMWTGNR-JTDSTZFVSA-N	0	0	298.430	4.101	20	30		CIEDRN
CCC[C@H](C)C(=O)N[C@@H](C#N)c1ccc(C(C)(C)C)cc1	ZINC000505825358	332754023	/nfs/dbraw/zinc/75/40/23/332754023.db2.gz	IVWZLOCJMWAYQN-BBRMVZONSA-N	0	0	286.419	4.101	20	30		CIEDRN
CCCCCC(=O)N[C@H](C#N)c1ccc(C(C)(C)C)cc1	ZINC000505833620	332754292	/nfs/dbraw/zinc/75/42/92/332754292.db2.gz	QGMLGQUFMIYGIM-MRXNPFEDSA-N	0	0	286.419	4.245	20	30		CIEDRN
CCC1(C(=O)N[C@@H](C#N)c2ccc(C(C)(C)C)cc2)CCC1	ZINC000505840294	332754322	/nfs/dbraw/zinc/75/43/22/332754322.db2.gz	XFYFXNFPFDQQOP-INIZCTEOSA-N	0	0	298.430	4.245	20	30		CIEDRN
C=CCN(C/C(C)=C/c1ccccc1)CC(F)(F)F	ZINC000511974074	332949290	/nfs/dbraw/zinc/94/92/90/332949290.db2.gz	QACXRFXNXUIYSW-JLHYYAGUSA-N	0	0	269.310	4.140	20	30		CIEDRN
N#CCN(Cc1ccc(-c2ccccc2Cl)o1)C1CC1	ZINC000511975866	332949293	/nfs/dbraw/zinc/94/92/93/332949293.db2.gz	XIIHENWRVTXYAB-UHFFFAOYSA-N	0	0	286.762	4.088	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1cc(F)c2ccccc2c1	ZINC000512099136	332953744	/nfs/dbraw/zinc/95/37/44/332953744.db2.gz	MKZAKTMZEJDIRL-CQSZACIVSA-N	0	0	271.335	4.063	20	30		CIEDRN
Cc1cc(F)cc(N[C@H](C)c2ccc(C#N)cc2F)c1	ZINC000512277549	332961300	/nfs/dbraw/zinc/96/13/00/332961300.db2.gz	BQMFDYRWSYGOEP-LLVKDONJSA-N	0	0	272.298	4.318	20	30		CIEDRN
CCOc1ccccc1N[C@@H](C)c1ccc(C#N)cc1F	ZINC000512293532	332961880	/nfs/dbraw/zinc/96/18/80/332961880.db2.gz	FKYFCWQGKQVXDI-LBPRGKRZSA-N	0	0	284.334	4.269	20	30		CIEDRN
C[C@@H](Nc1ccc(F)cc1)c1ccc(C#N)cc1F	ZINC000512660646	332978421	/nfs/dbraw/zinc/97/84/21/332978421.db2.gz	OFHCEVGMBINRBJ-SNVBAGLBSA-N	0	0	258.271	4.010	20	30		CIEDRN
COc1ccccc1[C@@H](C)N[C@@H](C)c1ccc(C#N)cc1F	ZINC000512661572	332978615	/nfs/dbraw/zinc/97/86/15/332978615.db2.gz	SPCKTLXOSVZRRR-QWHCGFSZSA-N	0	0	298.361	4.118	20	30		CIEDRN
Cc1ccc(N[C@@H](C)c2ccc(C#N)cc2F)cc1F	ZINC000512665474	332978846	/nfs/dbraw/zinc/97/88/46/332978846.db2.gz	GAYZIMSKKCLDOJ-NSHDSACASA-N	0	0	272.298	4.318	20	30		CIEDRN
C=CCCCCCN(C)C(=O)NCC(=C)c1ccccc1	ZINC000512668311	332979011	/nfs/dbraw/zinc/97/90/11/332979011.db2.gz	UMVLEVCFCJDKME-UHFFFAOYSA-N	0	0	286.419	4.088	20	30		CIEDRN
C=CCC1(C(=O)N(C)[C@H](C)C2CCCCC2)CCC1	ZINC000512746144	332982983	/nfs/dbraw/zinc/98/29/83/332982983.db2.gz	BZSLSQPELZZOAA-CQSZACIVSA-N	0	0	263.425	4.160	20	30		CIEDRN
N#Cc1ccc(COc2ccc(F)c(Cl)c2)cc1F	ZINC000404053967	332983039	/nfs/dbraw/zinc/98/30/39/332983039.db2.gz	GEWLMHVOPHFGEM-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
CCCN(CC#N)Cc1ccc(-c2ccccc2)cc1OC	ZINC000512754497	332983908	/nfs/dbraw/zinc/98/39/08/332983908.db2.gz	CYOZRZSLTDTSPX-UHFFFAOYSA-N	0	0	294.398	4.098	20	30		CIEDRN
Cc1c(Cl)cccc1NCc1ccc(C#N)c(F)c1	ZINC000404109295	332987428	/nfs/dbraw/zinc/98/74/28/332987428.db2.gz	IQCCWEOAERMUAB-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
CCc1ccc(NCc2ccc(C#N)c(F)c2)cc1C	ZINC000404143853	332990110	/nfs/dbraw/zinc/99/01/10/332990110.db2.gz	NLHIYYJWRJWMOO-UHFFFAOYSA-N	0	0	268.335	4.180	20	30		CIEDRN
C[C@@H]1CCN(CCCSCC#N)c2ccccc2S1	ZINC000174112626	332991450	/nfs/dbraw/zinc/99/14/50/332991450.db2.gz	YTUQZBFWJXRKOB-CYBMUJFWSA-N	0	0	292.473	4.024	20	30		CIEDRN
N#Cc1ccc(OC[C@H]2CCC(F)(F)C2)c(Cl)c1	ZINC000305999377	333003213	/nfs/dbraw/zinc/00/32/13/333003213.db2.gz	NHDWYELTQQGJHT-JTQLQIEISA-N	0	0	271.694	4.026	20	30		CIEDRN
CCCCC[C@@H]1CCCN1C(=O)NCC(C)(C)CCC#N	ZINC000513107806	333004720	/nfs/dbraw/zinc/00/47/20/333004720.db2.gz	IJLAIADCWALNJF-OAHLLOKOSA-N	0	0	293.455	4.071	20	30		CIEDRN
CC[C@H]1CCCCCN1C(=O)c1cc(C#N)ccc1Cl	ZINC000513281226	333012045	/nfs/dbraw/zinc/01/20/45/333012045.db2.gz	LVKUQRRVEMHFKQ-ZDUSSCGKSA-N	0	0	290.794	4.006	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1cc(C#N)ccc1Cl	ZINC000513281801	333012451	/nfs/dbraw/zinc/01/24/51/333012451.db2.gz	UKUBHORHDVJMKM-UHFFFAOYSA-N	0	0	290.794	4.030	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Nc1cccc(F)c1C	ZINC000175032771	333013346	/nfs/dbraw/zinc/01/33/46/333013346.db2.gz	ROGHZWORBCWNHK-UHFFFAOYSA-N	0	0	278.371	4.344	20	30		CIEDRN
C=CCCCN(C)C(=O)[C@@H]1CCC[C@@H]2CCCC[C@@H]12	ZINC000513377022	333016230	/nfs/dbraw/zinc/01/62/30/333016230.db2.gz	RHOJRHYGUSGJBU-ARFHVFGLSA-N	0	0	263.425	4.018	20	30		CIEDRN
C=CCCCC(=O)N(C)[C@@H](C)c1cc2ccccc2o1	ZINC000175221885	333017685	/nfs/dbraw/zinc/01/76/85/333017685.db2.gz	GDTBAWZRNXNQHK-ZDUSSCGKSA-N	0	0	271.360	4.309	20	30		CIEDRN
C=CCCCC(=O)N(C)[C@H](C)c1cccc(Cl)c1	ZINC000175241463	333018340	/nfs/dbraw/zinc/01/83/40/333018340.db2.gz	JTJKOKHYPALTNI-GFCCVEGCSA-N	0	0	265.784	4.216	20	30		CIEDRN
C=C1CCN(Cc2cc(Cl)ccc2OC(F)F)CC1	ZINC000513503194	333023177	/nfs/dbraw/zinc/02/31/77/333023177.db2.gz	MQSSZIOLRUHLIY-UHFFFAOYSA-N	0	0	287.737	4.093	20	30		CIEDRN
Cc1ccccc1[C@H]1CCCN1c1ncc(C#N)cc1Cl	ZINC000513615648	333026696	/nfs/dbraw/zinc/02/66/96/333026696.db2.gz	SSMUNAOPSOKDCI-MRXNPFEDSA-N	0	0	297.789	4.257	20	30		CIEDRN
N#Cc1cnc(Nc2cccc(Cl)c2)c(Cl)c1	ZINC000513615471	333026731	/nfs/dbraw/zinc/02/67/31/333026731.db2.gz	RAWOXQNBBZEEGQ-UHFFFAOYSA-N	0	0	264.115	4.004	20	30		CIEDRN
C=CCCCC(=O)N[C@H](C)c1cc2ccccc2s1	ZINC000175597679	333026830	/nfs/dbraw/zinc/02/68/30/333026830.db2.gz	DKOAHAMDGPADQM-GFCCVEGCSA-N	0	0	273.401	4.435	20	30		CIEDRN
Cc1cc(N[C@H](C)c2ccccc2Cl)cc(C#N)n1	ZINC000308283099	333026919	/nfs/dbraw/zinc/02/69/19/333026919.db2.gz	ZDKMAVSOJWZABF-LLVKDONJSA-N	0	0	271.751	4.088	20	30		CIEDRN
C[C@H](C#N)CN(C(=O)Nc1ccc(C(C)(C)C)cc1)C1CC1	ZINC000513654052	333029309	/nfs/dbraw/zinc/02/93/09/333029309.db2.gz	JBZOHBNAOKHLFO-CYBMUJFWSA-N	0	0	299.418	4.140	20	30		CIEDRN
CC(C)CCN(CCC#N)Cc1ccc(Cl)s1	ZINC000513714126	333034933	/nfs/dbraw/zinc/03/49/33/333034933.db2.gz	YQWGMGZZWDUPJH-UHFFFAOYSA-N	0	0	270.829	4.163	20	30		CIEDRN
CCc1ccc(-c2ccc(CN(C)[C@@H](C)CC#N)o2)cc1	ZINC000513716957	333035179	/nfs/dbraw/zinc/03/51/79/333035179.db2.gz	KEBDLZUGNZVGQT-AWEZNQCLSA-N	0	0	282.387	4.243	20	30		CIEDRN
CC(C)(C)CN(CCC#N)Cc1c(F)cccc1Cl	ZINC000513730163	333035997	/nfs/dbraw/zinc/03/59/97/333035997.db2.gz	WRNRFXWMFFILDO-UHFFFAOYSA-N	0	0	282.790	4.241	20	30		CIEDRN
CC(C)(C)CN(CCC#N)Cc1cccc(C(F)(F)F)c1	ZINC000513737042	333036748	/nfs/dbraw/zinc/03/67/48/333036748.db2.gz	SHTDETYYSQZIQM-UHFFFAOYSA-N	0	0	298.352	4.467	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@H](C)c1c(F)cccc1Cl	ZINC000176156473	333039713	/nfs/dbraw/zinc/03/97/13/333039713.db2.gz	ABRVGHMPKCMFJX-LLVKDONJSA-N	0	0	298.789	4.148	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N(C)CCC1CCCCC1	ZINC000513865249	333044547	/nfs/dbraw/zinc/04/45/47/333044547.db2.gz	CXUXVXKAURQUQH-UHFFFAOYSA-N	0	0	299.418	4.301	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc2scnc2c1	ZINC000177070421	333053154	/nfs/dbraw/zinc/05/31/54/333053154.db2.gz	BDOGMTKIOSTPKD-UHFFFAOYSA-N	0	0	272.373	4.003	20	30		CIEDRN
C=CCc1cc([N+](=O)[O-])ccc1OCCCC(C)(C)C#N	ZINC000177210451	333055356	/nfs/dbraw/zinc/05/53/56/333055356.db2.gz	ADNVUGZNYXWSDC-UHFFFAOYSA-N	0	0	288.347	4.032	20	30		CIEDRN
Cc1ccc(C#N)cc1OCc1sccc1Cl	ZINC000310275237	333056433	/nfs/dbraw/zinc/05/64/33/333056433.db2.gz	FKDUZSQDCJWILL-UHFFFAOYSA-N	0	0	263.749	4.161	20	30		CIEDRN
CC(C)c1ccc(NC(=O)c2cc(C#N)c[nH]2)c(C(C)C)c1	ZINC000177529500	333060169	/nfs/dbraw/zinc/06/01/69/333060169.db2.gz	FSEMUEWRWXUFIW-UHFFFAOYSA-N	0	0	295.386	4.385	20	30		CIEDRN
Cc1ccc(Oc2ccc(C#N)c(C)n2)c(Cl)c1	ZINC000310953085	333062957	/nfs/dbraw/zinc/06/29/57/333062957.db2.gz	ZQWBWVRLXOIJQV-UHFFFAOYSA-N	0	0	258.708	4.016	20	30		CIEDRN
C=CCCCCN[C@H](c1ccccc1)C(F)(F)F	ZINC000310991913	333063277	/nfs/dbraw/zinc/06/32/77/333063277.db2.gz	HWPNPXGOXSPYRL-CYBMUJFWSA-N	0	0	257.299	4.236	20	30		CIEDRN
Cc1ccc(C#N)cc1OC[C@@H]1CCCC(F)(F)C1	ZINC000311165120	333065649	/nfs/dbraw/zinc/06/56/49/333065649.db2.gz	QVXJRIPEIFRHCN-CYBMUJFWSA-N	0	0	265.303	4.071	20	30		CIEDRN
CC(C)CCC1CCN(C(=O)c2cccc(CC#N)c2)CC1	ZINC000177931977	333065778	/nfs/dbraw/zinc/06/57/78/333065778.db2.gz	HRFOTBSQAHYKEJ-UHFFFAOYSA-N	0	0	298.430	4.041	20	30		CIEDRN
CCCc1nc(COc2cc(Cl)cc(C#N)c2)cs1	ZINC000311419906	333068134	/nfs/dbraw/zinc/06/81/34/333068134.db2.gz	DTQDCIMRWYPMGU-UHFFFAOYSA-N	0	0	292.791	4.200	20	30		CIEDRN
CCOc1cc(C)ccc1NCc1cc(C#N)ccc1F	ZINC000178305202	333070628	/nfs/dbraw/zinc/07/06/28/333070628.db2.gz	PEFKCYIGWFQBPR-UHFFFAOYSA-N	0	0	284.334	4.017	20	30		CIEDRN
N#Cc1cccc(COc2ccc(Cl)cc2F)c1F	ZINC000311635862	333070737	/nfs/dbraw/zinc/07/07/37/333070737.db2.gz	NWRUADYDDUSAKB-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
C=CCOc1ccc(-c2nnc(SCC(C)C)o2)cc1	ZINC000178330811	333071190	/nfs/dbraw/zinc/07/11/90/333071190.db2.gz	CTYOCCUOJDFQJW-UHFFFAOYSA-N	0	0	290.388	4.050	20	30		CIEDRN
CC(C)SCCNc1ccc(C(F)(F)F)c(C#N)c1	ZINC000312022230	333075853	/nfs/dbraw/zinc/07/58/53/333075853.db2.gz	WMELLRSEPFXERU-UHFFFAOYSA-N	0	0	288.338	4.131	20	30		CIEDRN
CC(C)C[C@H](C)CNc1cccc(OCCCC#N)c1	ZINC000312155432	333077626	/nfs/dbraw/zinc/07/76/26/333077626.db2.gz	OERJMNAZEIXNAI-HNNXBMFYSA-N	0	0	274.408	4.463	20	30		CIEDRN
C=CC[NH+](CC=C)[C@@H](C)c1ccc(OC(F)(F)F)cc1	ZINC000516675466	333080286	/nfs/dbraw/zinc/08/02/86/333080286.db2.gz	JEXWTRZJQPJLIZ-LBPRGKRZSA-N	0	0	285.309	4.320	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(-c2ccc3ncccc3c2)no1	ZINC000516812774	333083050	/nfs/dbraw/zinc/08/30/50/333083050.db2.gz	ZCBWFWOGUMOVCW-QGZVFWFLSA-N	0	0	279.343	4.139	20	30		CIEDRN
CCCCN(C(=O)CC(C)(C)C#N)[C@H]1CCC[C@@H](C)C1	ZINC000516886947	333085373	/nfs/dbraw/zinc/08/53/73/333085373.db2.gz	HYZMZMXICVKGKB-CABCVRRESA-N	0	0	278.440	4.134	20	30		CIEDRN
CC[C@@H](C)Oc1ccc(-c2noc([C@@](C)(C#N)CC)n2)cc1	ZINC000517201568	333094405	/nfs/dbraw/zinc/09/44/05/333094405.db2.gz	ONONEROLZKISFL-SJKOYZFVSA-N	0	0	299.374	4.105	20	30		CIEDRN
CN(C(=O)c1cccc(C(C)(C)C)c1)c1ccc(C#N)cc1	ZINC000517244008	333095763	/nfs/dbraw/zinc/09/57/63/333095763.db2.gz	XXIKMEFEPOVEQZ-UHFFFAOYSA-N	0	0	292.382	4.132	20	30		CIEDRN
CCC(CC)CN(CCC#N)C(=O)CC1=CCCCC1	ZINC000517354730	333097740	/nfs/dbraw/zinc/09/77/40/333097740.db2.gz	CHNDVJMYXDBWQZ-UHFFFAOYSA-N	0	0	276.424	4.055	20	30		CIEDRN
Cc1ccc(CCNc2cccc(C(F)F)c2C#N)o1	ZINC000517390951	333098512	/nfs/dbraw/zinc/09/85/12/333098512.db2.gz	KVHDQTPGRDHMQH-UHFFFAOYSA-N	0	0	276.286	4.052	20	30		CIEDRN
C=C1CCN(Cc2c(Cl)cccc2Cl)CC1	ZINC000517468347	333100168	/nfs/dbraw/zinc/10/01/68/333100168.db2.gz	JNXQCERYKHBKAN-UHFFFAOYSA-N	0	0	256.176	4.145	20	30		CIEDRN
CC[C@](C)(C#N)NC(=O)CC1CCC(c2ccccc2)CC1	ZINC000517461799	333100211	/nfs/dbraw/zinc/10/02/11/333100211.db2.gz	PDEVCYRHHSCPEN-GXOAENINSA-N	0	0	298.430	4.159	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)C[C@H]2CCCC[C@H]2C)s1	ZINC000521249872	333116214	/nfs/dbraw/zinc/11/62/14/333116214.db2.gz	FOYSJHYCXLMZOL-VXGBXAGGSA-N	0	0	290.432	4.337	20	30		CIEDRN
CC(C)COc1ccc(CNc2ccc(CC#N)cc2)cc1	ZINC000183280512	333119879	/nfs/dbraw/zinc/11/98/79/333119879.db2.gz	CHZDPFHVSOMVRA-UHFFFAOYSA-N	0	0	294.398	4.400	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@]1(C)Cc1ccccc1	ZINC000183997889	333124271	/nfs/dbraw/zinc/12/42/71/333124271.db2.gz	XJSYHPBATWBNRG-VQIMIIECSA-N	0	0	285.431	4.213	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1c(F)cccc1OC)c1ccccc1	ZINC000184441270	333128572	/nfs/dbraw/zinc/12/85/72/333128572.db2.gz	VFOXRKVBAXTOOQ-ZDUSSCGKSA-N	0	0	299.345	4.133	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1c(C)cccc1SC	ZINC000184612305	333130591	/nfs/dbraw/zinc/13/05/91/333130591.db2.gz	CQCJGNQOZMMISD-LBPRGKRZSA-N	0	0	263.406	4.258	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](C)c1ccccc1Cl	ZINC000184907234	333133065	/nfs/dbraw/zinc/13/30/65/333133065.db2.gz	HVKXNWWPDVIUKC-RYUDHWBXSA-N	0	0	265.784	4.120	20	30		CIEDRN
CC#CCCCC(=O)NC(c1ccccc1)c1ccccc1	ZINC000184889530	333133085	/nfs/dbraw/zinc/13/30/85/333133085.db2.gz	UNLNHBRLSBDEOJ-UHFFFAOYSA-N	0	0	291.394	4.086	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccccc1C(C)(C)C	ZINC000184884543	333133116	/nfs/dbraw/zinc/13/31/16/333133116.db2.gz	MQYOSXBERZBGHV-UHFFFAOYSA-N	0	0	257.377	4.116	20	30		CIEDRN
CC#CCCCC(=O)N[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000184910639	333133268	/nfs/dbraw/zinc/13/32/68/333133268.db2.gz	FNKCKDGKJKOCGM-GFCCVEGCSA-N	0	0	297.320	4.076	20	30		CIEDRN
CC#CCCCC(=O)N(C)Cc1cccc(Cl)c1Cl	ZINC000184962458	333133960	/nfs/dbraw/zinc/13/39/60/333133960.db2.gz	LCBLZXIRHDFREO-UHFFFAOYSA-N	0	0	298.213	4.145	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccccc1OCCC	ZINC000184981039	333134130	/nfs/dbraw/zinc/13/41/30/333134130.db2.gz	PJCWWUYKNFUJFP-ZDUSSCGKSA-N	0	0	261.365	4.016	20	30		CIEDRN
CC#CCCCC(=O)N(C)[C@H](C)c1cc2ccccc2o1	ZINC000185020594	333134585	/nfs/dbraw/zinc/13/45/85/333134585.db2.gz	KEFALXNBUTZDNN-CQSZACIVSA-N	0	0	283.371	4.146	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(OC(C)C)cc1	ZINC000185177182	333136438	/nfs/dbraw/zinc/13/64/38/333136438.db2.gz	FMBVZTOTEYKALI-CYBMUJFWSA-N	0	0	261.365	4.015	20	30		CIEDRN
N#Cc1ccc(SCc2cncc(F)c2)c(Cl)c1	ZINC000185197054	333136687	/nfs/dbraw/zinc/13/66/87/333136687.db2.gz	NPYURUJJSKVZEQ-UHFFFAOYSA-N	0	0	278.739	4.038	20	30		CIEDRN
CC(C)C[C@H](C)C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000185193686	333136695	/nfs/dbraw/zinc/13/66/95/333136695.db2.gz	PFKRQEQALJXIMC-ZDUSSCGKSA-N	0	0	272.392	4.108	20	30		CIEDRN
CC#CCCCC(=O)N(Cc1ccccc1)[C@@H](C)C1CC1	ZINC000185192721	333136705	/nfs/dbraw/zinc/13/67/05/333136705.db2.gz	AKLCTHUALYMWFC-INIZCTEOSA-N	0	0	283.415	4.007	20	30		CIEDRN
CC#CCCCC(=O)N1CCCCC[C@@H]1c1ccccc1	ZINC000185218958	333136742	/nfs/dbraw/zinc/13/67/42/333136742.db2.gz	XGUUMJLNPYQCDY-GOSISDBHSA-N	0	0	283.415	4.324	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@@H](C)c1ccccc1Cl	ZINC000185223663	333136753	/nfs/dbraw/zinc/13/67/53/333136753.db2.gz	FGJXWLQQAVCHDN-OLZOCXBDSA-N	0	0	279.811	4.462	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@H]1CCc1ccccc1	ZINC000185216155	333136787	/nfs/dbraw/zinc/13/67/87/333136787.db2.gz	BVBXVHBFUFHJHG-AEFFLSMTSA-N	0	0	285.431	4.213	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@@H](C)c1ccccc1Cl	ZINC000185223645	333137009	/nfs/dbraw/zinc/13/70/09/333137009.db2.gz	FGJXWLQQAVCHDN-STQMWFEESA-N	0	0	279.811	4.462	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccccc1OCC(C)C	ZINC000185230362	333137279	/nfs/dbraw/zinc/13/72/79/333137279.db2.gz	BMESXAWKGHUZIQ-CQSZACIVSA-N	0	0	275.392	4.262	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cccc(-n2nc(C)cc2C)c1	ZINC000185324674	333138824	/nfs/dbraw/zinc/13/88/24/333138824.db2.gz	NZYWVYKYBYSFGE-CYBMUJFWSA-N	0	0	297.402	4.030	20	30		CIEDRN
CSc1cccc(C)c1NCc1cc(C#N)ccc1F	ZINC000185439283	333140785	/nfs/dbraw/zinc/14/07/85/333140785.db2.gz	YVJUGPQFPKGEQV-UHFFFAOYSA-N	0	0	286.375	4.340	20	30		CIEDRN
Cc1oc2ccccc2c1C(=O)N(CCC#N)CC(C)(C)C	ZINC000185486719	333141572	/nfs/dbraw/zinc/14/15/72/333141572.db2.gz	HVQHHFFIRPSIMB-UHFFFAOYSA-N	0	0	298.386	4.143	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H]1Cc1ccc(C)cc1	ZINC000185556472	333143663	/nfs/dbraw/zinc/14/36/63/333143663.db2.gz	BMCRWPAXSVHYSH-WMZOPIPTSA-N	0	0	285.431	4.131	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(F)cc1OCC1CC1	ZINC000185650283	333145889	/nfs/dbraw/zinc/14/58/89/333145889.db2.gz	BUFZTQXMKUKJEP-GFCCVEGCSA-N	0	0	291.366	4.155	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@@H](CC)Cc1ccccc1	ZINC000185676044	333146378	/nfs/dbraw/zinc/14/63/78/333146378.db2.gz	WRDWZDQPSARRFG-RDJZCZTQSA-N	0	0	273.420	4.068	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC(C)(C)C)CC(F)(F)F	ZINC000185699171	333146757	/nfs/dbraw/zinc/14/67/57/333146757.db2.gz	XWAYJGHKBLRGDV-NSHDSACASA-N	0	0	279.346	4.026	20	30		CIEDRN
C[C@@H](SCc1ccccc1C(C)(C)C#N)c1cnccn1	ZINC000185706489	333147103	/nfs/dbraw/zinc/14/71/03/333147103.db2.gz	DXYPHPFXKDGYPA-CYBMUJFWSA-N	0	0	297.427	4.272	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@](C)(CCC)C1	ZINC000185729566	333147490	/nfs/dbraw/zinc/14/74/90/333147490.db2.gz	URMQWOIAIZWXJA-GOEBONIOSA-N	0	0	251.414	4.018	20	30		CIEDRN
CCSc1cccc(N[C@H]2CCC[C@@H](C#N)C2)c1	ZINC000185747643	333147843	/nfs/dbraw/zinc/14/78/43/333147843.db2.gz	ZMWZWCHNIYLLCS-OLZOCXBDSA-N	0	0	260.406	4.293	20	30		CIEDRN
CCSc1cccc(N[C@H]2CCC[C@H](C#N)C2)c1	ZINC000185747606	333147887	/nfs/dbraw/zinc/14/78/87/333147887.db2.gz	ZMWZWCHNIYLLCS-STQMWFEESA-N	0	0	260.406	4.293	20	30		CIEDRN
CC(C)(C)Oc1ccccc1N[C@@H]1CCC[C@H](C#N)C1	ZINC000185748315	333147894	/nfs/dbraw/zinc/14/78/94/333147894.db2.gz	RJIDNZNOCOFCTN-UONOGXRCSA-N	0	0	272.392	4.358	20	30		CIEDRN
CC(C)(C)Oc1ccccc1N[C@H]1CCC[C@H](C#N)C1	ZINC000185748338	333147912	/nfs/dbraw/zinc/14/79/12/333147912.db2.gz	RJIDNZNOCOFCTN-KBPBESRZSA-N	0	0	272.392	4.358	20	30		CIEDRN
CC(C)Oc1ccc(F)cc1N[C@@H]1CCC[C@@H](C#N)C1	ZINC000185745682	333147943	/nfs/dbraw/zinc/14/79/43/333147943.db2.gz	HOQRUBLCQZEXHE-TZMCWYRMSA-N	0	0	276.355	4.107	20	30		CIEDRN
CC#CCCCC(=O)Nc1cccc(C(F)(F)F)c1C	ZINC000185854108	333150298	/nfs/dbraw/zinc/15/02/98/333150298.db2.gz	LLHHHLBIVDLMTH-UHFFFAOYSA-N	0	0	283.293	4.146	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(C)ccc1Cl	ZINC000185865472	333150443	/nfs/dbraw/zinc/15/04/43/333150443.db2.gz	QNFZXTQSQWZOGB-NSHDSACASA-N	0	0	251.757	4.189	20	30		CIEDRN
CC#CCCCC(=O)Nc1cccc(N2CCCCCC2)c1	ZINC000185882617	333150884	/nfs/dbraw/zinc/15/08/84/333150884.db2.gz	SLAPECHPWQQLJT-UHFFFAOYSA-N	0	0	298.430	4.199	20	30		CIEDRN
CC#CCCCC(=O)N1CCC[C@@H]1CCCc1ccccc1	ZINC000185889634	333151209	/nfs/dbraw/zinc/15/12/09/333151209.db2.gz	SRLDSEATAJXUSZ-IBGZPJMESA-N	0	0	297.442	4.194	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)Cc1cccc(OC(C)C)c1	ZINC000185944907	333152229	/nfs/dbraw/zinc/15/22/29/333152229.db2.gz	AHFSORKNXFXLNO-HNNXBMFYSA-N	0	0	289.419	4.035	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)Cc1ccc(Cl)c(F)c1	ZINC000185962846	333152616	/nfs/dbraw/zinc/15/26/16/333152616.db2.gz	YSOMRGWMESDJKG-NSHDSACASA-N	0	0	283.774	4.040	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](c2cc(C)cc(C)c2)C1	ZINC000186043209	333153961	/nfs/dbraw/zinc/15/39/61/333153961.db2.gz	PNKDQQZWUWYTEW-DLBZAZTESA-N	0	0	285.431	4.222	20	30		CIEDRN
C=C(C)[C@H](NC(=O)[C@H]1CC=CCC1)c1ccc(F)c(F)c1	ZINC000186044465	333154047	/nfs/dbraw/zinc/15/40/47/333154047.db2.gz	UYVROSTXQQDTTC-LRDDRELGSA-N	0	0	291.341	4.055	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(C(C)(C)C)sc1C#N	ZINC000186094370	333154847	/nfs/dbraw/zinc/15/48/47/333154847.db2.gz	LJBSXTIXBUFLFX-NSHDSACASA-N	0	0	290.432	4.458	20	30		CIEDRN
C=CC[C@@H](C(=O)N(C)Cc1ccccc1F)c1ccccc1	ZINC000186139192	333155630	/nfs/dbraw/zinc/15/56/30/333155630.db2.gz	ZABOEPRSALZALQ-QGZVFWFLSA-N	0	0	297.373	4.144	20	30		CIEDRN
C=CC[C@H](C(=O)N(C)Cc1ccc(F)cc1)c1ccccc1	ZINC000186156359	333155632	/nfs/dbraw/zinc/15/56/32/333155632.db2.gz	SJWIAGNUGZVOBD-SFHVURJKSA-N	0	0	297.373	4.144	20	30		CIEDRN
Cc1ccccc1SCc1cccc(C#N)c1F	ZINC000219766062	333156754	/nfs/dbraw/zinc/15/67/54/333156754.db2.gz	NNBNJXWUTIQBHC-UHFFFAOYSA-N	0	0	257.333	4.298	20	30		CIEDRN
C=CCC[C@@H](C(=O)Nc1cccc(C)n1)c1ccccc1	ZINC000186221488	333156864	/nfs/dbraw/zinc/15/68/64/333156864.db2.gz	FZWUPNSQBSHVLL-MRXNPFEDSA-N	0	0	280.371	4.079	20	30		CIEDRN
C=CCC[C@@H](C(=O)Nc1cc(C)ccn1)c1ccccc1	ZINC000186220174	333156980	/nfs/dbraw/zinc/15/69/80/333156980.db2.gz	BYBVJRMCZOZETI-MRXNPFEDSA-N	0	0	280.371	4.079	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1nc(C2CC2)cs1)c1ccccc1	ZINC000186589949	333163307	/nfs/dbraw/zinc/16/33/07/333163307.db2.gz	ICFHTBYSKXUZBN-CQSZACIVSA-N	0	0	298.411	4.319	20	30		CIEDRN
C=CCC[C@@H](C(=O)NCCc1ccsc1)c1ccccc1	ZINC000186611473	333163482	/nfs/dbraw/zinc/16/34/82/333163482.db2.gz	VXKNWYHVCHOWFN-QGZVFWFLSA-N	0	0	299.439	4.157	20	30		CIEDRN
N#Cc1ccc(NCc2cc(F)cc(F)c2)c(Cl)c1	ZINC000220396411	333165990	/nfs/dbraw/zinc/16/59/90/333165990.db2.gz	WBXROTDKRJPVSD-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C=CC[C@@H](C(=O)N(C)c1ccc(F)cc1)c1ccccc1	ZINC000186964889	333166820	/nfs/dbraw/zinc/16/68/20/333166820.db2.gz	ORCVRXKLQYDQSO-QGZVFWFLSA-N	0	0	283.346	4.148	20	30		CIEDRN
C=C(C)COc1cc(/C=C(\C)c2cnccn2)ccc1OC	ZINC000187649241	333173460	/nfs/dbraw/zinc/17/34/60/333173460.db2.gz	LVVAVXLJIMCQOH-NTEUORMPSA-N	0	0	296.370	4.001	20	30		CIEDRN
N#Cc1ccnc(SCc2ccc(F)c(Cl)c2)c1	ZINC000188960134	333176724	/nfs/dbraw/zinc/17/67/24/333176724.db2.gz	YVDGTPUAENQWJV-UHFFFAOYSA-N	0	0	278.739	4.038	20	30		CIEDRN
C=CCC1(C(=O)N2CCSC3(CCCCC3)C2)CCC1	ZINC000189044171	333179000	/nfs/dbraw/zinc/17/90/00/333179000.db2.gz	FLIJUZSTFKEKRI-UHFFFAOYSA-N	0	0	293.476	4.011	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@@H](c3ccccc3)[C@H]2C)CCC1	ZINC000189102494	333181071	/nfs/dbraw/zinc/18/10/71/333181071.db2.gz	ARPQQJKPAYMUAU-NVXWUHKLSA-N	0	0	283.415	4.137	20	30		CIEDRN
CC(C)CCc1ccc(NC(=O)C2(C#N)CCCC2)cc1	ZINC000521718691	333184698	/nfs/dbraw/zinc/18/46/98/333184698.db2.gz	LFWKZAMZWLTXHR-UHFFFAOYSA-N	0	0	284.403	4.298	20	30		CIEDRN
N#Cc1cccc(C(=O)Nc2cccc3ccsc32)c1	ZINC000337461523	335127039	/nfs/dbraw/zinc/12/70/39/335127039.db2.gz	QICIYNRYIMZTBM-UHFFFAOYSA-N	0	0	278.336	4.025	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N(CC)Cc1ccc(Cl)s1	ZINC000190027836	333202089	/nfs/dbraw/zinc/20/20/89/333202089.db2.gz	CWTILEKGYPMYNR-AWEZNQCLSA-N	0	0	285.840	4.352	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H](C)c1ccc(OC(F)F)cc1	ZINC000190071939	333202952	/nfs/dbraw/zinc/20/29/52/333202952.db2.gz	ZFDZGAJNTYKPQZ-BDJLRTHQSA-N	0	0	297.345	4.068	20	30		CIEDRN
CC(C)(C#N)c1ccccc1CSCC[C@@H]1CCCO1	ZINC000190163455	333204004	/nfs/dbraw/zinc/20/40/04/333204004.db2.gz	OFXUGWHBJJOZBI-HNNXBMFYSA-N	0	0	289.444	4.290	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@@H](c3cc(C)cc(C)c3)C2)CCC1	ZINC000190196603	333204182	/nfs/dbraw/zinc/20/41/82/333204182.db2.gz	IMGYOESQTLHJIQ-QGZVFWFLSA-N	0	0	297.442	4.366	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@H](c3cc(C)cc(C)c3)C2)CCC1	ZINC000190196623	333204189	/nfs/dbraw/zinc/20/41/89/333204189.db2.gz	IMGYOESQTLHJIQ-KRWDZBQOSA-N	0	0	297.442	4.366	20	30		CIEDRN
CCOc1cc(C)ccc1NCc1ccc(C#N)c(F)c1	ZINC000190348734	333205766	/nfs/dbraw/zinc/20/57/66/333205766.db2.gz	ABCNNVLZEGUXFT-UHFFFAOYSA-N	0	0	284.334	4.017	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CC[C@H](C(F)(F)F)C(C)(C)C1	ZINC000190695796	333209725	/nfs/dbraw/zinc/20/97/25/333209725.db2.gz	HDIQJCCVHGXODO-SMDDNHRTSA-N	0	0	291.357	4.026	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](C(F)(F)F)C(C)(C)C1	ZINC000190695832	333209804	/nfs/dbraw/zinc/20/98/04/333209804.db2.gz	HDIQJCCVHGXODO-BXUZGUMPSA-N	0	0	291.357	4.026	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(COC(C)C)cc1	ZINC000190997255	333213187	/nfs/dbraw/zinc/21/31/87/333213187.db2.gz	UQERKOKKIXVGER-KRWDZBQOSA-N	0	0	275.392	4.152	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cccc(COCC2CC2)c1	ZINC000191016527	333213657	/nfs/dbraw/zinc/21/36/57/333213657.db2.gz	RQLDMBLDLSUNJH-GOSISDBHSA-N	0	0	287.403	4.154	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cccc(COCC2CC2)c1	ZINC000191016546	333213668	/nfs/dbraw/zinc/21/36/68/333213668.db2.gz	RQLDMBLDLSUNJH-SFHVURJKSA-N	0	0	287.403	4.154	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(Cl)cc2C)CCC1	ZINC000191375482	333218818	/nfs/dbraw/zinc/21/88/18/333218818.db2.gz	QGMSXDRRMUEEFR-UHFFFAOYSA-N	0	0	263.768	4.333	20	30		CIEDRN
Cn1cc(CNc2cccc(-c3cccs3)c2)cc1C#N	ZINC000191382943	333219075	/nfs/dbraw/zinc/21/90/75/333219075.db2.gz	AWELDKBKRHGVNV-UHFFFAOYSA-N	0	0	293.395	4.237	20	30		CIEDRN
CC[C@H](C)CC(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl	ZINC000191510287	333220642	/nfs/dbraw/zinc/22/06/42/333220642.db2.gz	BLBAADVVDCGMOO-CABZTGNLSA-N	0	0	299.201	4.110	20	30		CIEDRN
CC[C@H](C)CC(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1	ZINC000191541050	333221104	/nfs/dbraw/zinc/22/11/04/333221104.db2.gz	IOLYDKVFNSTYNL-ZANVPECISA-N	0	0	299.201	4.110	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(Cc2ccc(C)c(OC)c2)no1	ZINC000521940604	333224398	/nfs/dbraw/zinc/22/43/98/333224398.db2.gz	YEPSFAYNOAZKBJ-CYBMUJFWSA-N	0	0	286.375	4.047	20	30		CIEDRN
N#Cc1ccnc(SCc2cccc(Cl)c2F)c1	ZINC000191823350	333225964	/nfs/dbraw/zinc/22/59/64/333225964.db2.gz	NWRKCGFVZQCVBT-UHFFFAOYSA-N	0	0	278.739	4.038	20	30		CIEDRN
C=CC1CCN(C(=O)CC23CC4CC(CC(C4)C2)C3)CC1	ZINC000521956834	333227706	/nfs/dbraw/zinc/22/77/06/333227706.db2.gz	GBOIZHAXOUAGFO-UHFFFAOYSA-N	0	0	287.447	4.018	20	30		CIEDRN
C=CC1CCN(c2ccnc3cc(Cl)ccc32)CC1	ZINC000521960155	333228338	/nfs/dbraw/zinc/22/83/38/333228338.db2.gz	IAQUEUOGIUGKDO-UHFFFAOYSA-N	0	0	272.779	4.291	20	30		CIEDRN
CCC(C)(C)C1CCC2(C[C@@H]2C(=O)NC(C)(C)C#N)CC1	ZINC000575889712	335128685	/nfs/dbraw/zinc/12/86/85/335128685.db2.gz	GPRURWFBFPIGET-TXKKKEFDSA-N	0	0	290.451	4.037	20	30		CIEDRN
C=CCC[C@@H](NC(=O)c1ccoc1Cl)c1ccccc1	ZINC000192344248	333234450	/nfs/dbraw/zinc/23/44/50/333234450.db2.gz	SNBNTBSFKIXZEJ-CQSZACIVSA-N	0	0	289.762	4.370	20	30		CIEDRN
CCCCN(C(=O)c1cccc(C#N)c1)[C@@H]1CCC[C@H](C)C1	ZINC000575896348	335129079	/nfs/dbraw/zinc/12/90/79/335129079.db2.gz	LCBNZLKHBGISSN-MAUKXSAKSA-N	0	0	298.430	4.379	20	30		CIEDRN
Cc1ccc(NC(=O)Nc2ccc(C#N)cc2Cl)cc1	ZINC000225799892	333240675	/nfs/dbraw/zinc/24/06/75/333240675.db2.gz	HCBNJWYOMRRUHL-UHFFFAOYSA-N	0	0	285.734	4.164	20	30		CIEDRN
N#Cc1ccc(CN(C(=O)CC2CCCCC2)C2CC2)cc1	ZINC000193047200	333241861	/nfs/dbraw/zinc/24/18/61/333241861.db2.gz	WDKYGJMWGAHYIR-UHFFFAOYSA-N	0	0	296.414	4.020	20	30		CIEDRN
CC(C)CCc1ccc(NC(=O)c2sccc2C#N)cc1	ZINC000522111492	333242146	/nfs/dbraw/zinc/24/21/46/333242146.db2.gz	TVSKRWZUTDKFGE-UHFFFAOYSA-N	0	0	298.411	4.461	20	30		CIEDRN
C[C@H](C#N)N[C@H](CCCc1ccccc1)c1ccccc1	ZINC000193087661	333242516	/nfs/dbraw/zinc/24/25/16/333242516.db2.gz	ZMMPAEYSKONKBP-VQIMIIECSA-N	0	0	278.399	4.252	20	30		CIEDRN
C[C@@H](C#N)N[C@H](CCCc1ccccc1)c1ccccc1	ZINC000193087648	333242533	/nfs/dbraw/zinc/24/25/33/333242533.db2.gz	ZMMPAEYSKONKBP-QFBILLFUSA-N	0	0	278.399	4.252	20	30		CIEDRN
Cc1csc(NC(=O)C[C@H](C)C2CCCCC2)c1C#N	ZINC000564189019	333256131	/nfs/dbraw/zinc/25/61/31/333256131.db2.gz	IGXBPFDAMXLDOH-NSHDSACASA-N	0	0	290.432	4.473	20	30		CIEDRN
N#Cc1ccccc1OCCSC/C=C/c1ccccc1	ZINC000195594896	333256677	/nfs/dbraw/zinc/25/66/77/333256677.db2.gz	KAQUHGBUBOCQHQ-RMKNXTFCSA-N	0	0	295.407	4.384	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC(F)F)c1ccc(F)cc1	ZINC000193871172	333259971	/nfs/dbraw/zinc/25/99/71/333259971.db2.gz	YPIMQYARAUYBMG-UHFFFAOYSA-N	0	0	297.320	4.192	20	30		CIEDRN
COc1ccc(CNc2cccc(C(F)F)c2C#N)cc1	ZINC000575911775	335130295	/nfs/dbraw/zinc/13/02/95/335130295.db2.gz	VBCJXUBSAOGXGL-UHFFFAOYSA-N	0	0	288.297	4.117	20	30		CIEDRN
CC(C)N(CCC#N)C(=O)c1ccc(-c2ccccc2)cc1	ZINC000522236665	333269214	/nfs/dbraw/zinc/26/92/14/333269214.db2.gz	FIVXIJSAJFSODC-UHFFFAOYSA-N	0	0	292.382	4.118	20	30		CIEDRN
C[C@@H](c1cccc(C#N)c1)N(C)C(=O)C[C@@H]1CCCC[C@H]1C	ZINC000575917649	335130717	/nfs/dbraw/zinc/13/07/17/335130717.db2.gz	FQBPERPANPATLD-VYDXJSESSA-N	0	0	298.430	4.294	20	30		CIEDRN
N#Cc1ccc(OCC(=O)c2csc3ccccc23)cc1	ZINC000194518380	333272231	/nfs/dbraw/zinc/27/22/31/333272231.db2.gz	DHUTVKARFHJQHP-UHFFFAOYSA-N	0	0	293.347	4.035	20	30		CIEDRN
CCCCN(CCCC)C(=O)Nc1cc(C#N)ccc1C	ZINC000194591685	333273024	/nfs/dbraw/zinc/27/30/24/333273024.db2.gz	RBKZFVRILRCTKA-UHFFFAOYSA-N	0	0	287.407	4.301	20	30		CIEDRN
CC(=O)c1ccc(O[C@@H](C)c2ccc(C#N)cc2)c(F)c1	ZINC000194643837	333274443	/nfs/dbraw/zinc/27/44/43/333274443.db2.gz	QTHQPZLEFUVKNY-LBPRGKRZSA-N	0	0	283.302	4.040	20	30		CIEDRN
C[C@@H]1CC[C@@H](Nc2nc(C(F)(F)F)ccc2C#N)[C@@H](C)C1	ZINC000227116700	333276765	/nfs/dbraw/zinc/27/67/65/333276765.db2.gz	BGFRTCKAIMFYEN-JFGNBEQYSA-N	0	0	297.324	4.209	20	30		CIEDRN
CCCC[C@H](CC)CC(=O)Nc1scc(C)c1C#N	ZINC000564191247	333277112	/nfs/dbraw/zinc/27/71/12/333277112.db2.gz	ZEINTNORSOPQJA-LBPRGKRZSA-N	0	0	278.421	4.473	20	30		CIEDRN
Cc1ccc2oc(Oc3ccc(C#N)cc3C)nc2c1	ZINC000522272101	333277636	/nfs/dbraw/zinc/27/76/36/333277636.db2.gz	HNRTUQWPMCIJFZ-UHFFFAOYSA-N	0	0	264.284	4.109	20	30		CIEDRN
COc1ccc(C#N)cc1CNc1cc(C)ccc1Cl	ZINC000227260168	333278748	/nfs/dbraw/zinc/27/87/48/333278748.db2.gz	NRUMJHATUBBOAN-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
C[C@@H](CCC1CCCCC1)NC(=O)c1ccc(C#N)cc1	ZINC000522316205	333282341	/nfs/dbraw/zinc/28/23/41/333282341.db2.gz	ICMKDHZMYDEZOU-AWEZNQCLSA-N	0	0	284.403	4.037	20	30		CIEDRN
CCCCC1CCC(C(=O)N2CCC(C)(C#N)CC2)CC1	ZINC000227516435	333284166	/nfs/dbraw/zinc/28/41/66/333284166.db2.gz	MSVVCCBPXSMVTL-UHFFFAOYSA-N	0	0	290.451	4.135	20	30		CIEDRN
C[C@@H](CCC1CCCCC1)Nc1ncccc1C#N	ZINC000522405838	333286512	/nfs/dbraw/zinc/28/65/12/333286512.db2.gz	HHMODIBOBBTHPT-ZDUSSCGKSA-N	0	0	257.381	4.114	20	30		CIEDRN
C=CCCC(=O)Nc1ccccc1-c1ccccc1	ZINC000522480412	333287935	/nfs/dbraw/zinc/28/79/35/333287935.db2.gz	WXKRMBFKBPWTFM-UHFFFAOYSA-N	0	0	251.329	4.258	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(Oc2ccccc2OC)cc1	ZINC000522481312	333288028	/nfs/dbraw/zinc/28/80/28/333288028.db2.gz	IFGYNJXERYQJOR-UHFFFAOYSA-N	0	0	297.354	4.392	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(Oc2cccnc2)c(C)c1	ZINC000522570530	333290568	/nfs/dbraw/zinc/29/05/68/333290568.db2.gz	WOEIVWFMFOTBDR-UHFFFAOYSA-N	0	0	282.343	4.087	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@H](c1ccc(Cl)cc1)C(C)C	ZINC000522576132	333290580	/nfs/dbraw/zinc/29/05/80/333290580.db2.gz	TVDLBWCESUOAPG-WFASDCNBSA-N	0	0	294.826	4.301	20	30		CIEDRN
N#Cc1ccc(Cl)cc1NCc1cccc2cc[nH]c21	ZINC000228032559	333293082	/nfs/dbraw/zinc/29/30/82/333293082.db2.gz	JGWYEZLYLUJLIJ-UHFFFAOYSA-N	0	0	281.746	4.305	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N(Cc1cccc(C)c1)CC(C)C	ZINC000522632656	333293577	/nfs/dbraw/zinc/29/35/77/333293577.db2.gz	JVMVCFXZJATEHK-MRXNPFEDSA-N	0	0	288.435	4.127	20	30		CIEDRN
C[C@@H]1CCC[C@@](C#N)(NC(=O)CCCC2CCCCC2)C1	ZINC000522643847	333294290	/nfs/dbraw/zinc/29/42/90/333294290.db2.gz	RVSBMFFTZJNDBQ-CRAIPNDOSA-N	0	0	290.451	4.326	20	30		CIEDRN
C[C@@H]1CCC[C@](C#N)(NC(=O)CCCC2CCCCC2)C1	ZINC000522643849	333294296	/nfs/dbraw/zinc/29/42/96/333294296.db2.gz	RVSBMFFTZJNDBQ-QAPCUYQASA-N	0	0	290.451	4.326	20	30		CIEDRN
C=CC[C@H](C)NC(=O)c1ccccc1Nc1ccccc1	ZINC000522644610	333294594	/nfs/dbraw/zinc/29/45/94/333294594.db2.gz	BZKGFBAXFSXCMA-AWEZNQCLSA-N	0	0	280.371	4.125	20	30		CIEDRN
C=CCNC(=O)N(CCCCC)Cc1ccc(Cl)cc1	ZINC000522935171	333300548	/nfs/dbraw/zinc/30/05/48/333300548.db2.gz	NAVCUXCZIFBSAF-UHFFFAOYSA-N	0	0	294.826	4.228	20	30		CIEDRN
C=CCCCN(C)C(=O)COc1ccccc1[C@H](C)CC	ZINC000522954886	333300969	/nfs/dbraw/zinc/30/09/69/333300969.db2.gz	SOZJELQYSMFDCZ-OAHLLOKOSA-N	0	0	289.419	4.004	20	30		CIEDRN
CSc1ccc([C@@H](C)NCc2ccccc2C#N)cc1	ZINC000229803186	333309830	/nfs/dbraw/zinc/30/98/30/333309830.db2.gz	AVMIIKWKTTWZBQ-CYBMUJFWSA-N	0	0	282.412	4.131	20	30		CIEDRN
CCc1ccc([C@H](C)CC(=O)NC2(C#N)CCCCC2)cc1	ZINC000523121633	333310111	/nfs/dbraw/zinc/31/01/11/333310111.db2.gz	KLOJLQSDJFWNSE-OAHLLOKOSA-N	0	0	298.430	4.085	20	30		CIEDRN
C=CCOc1cccc(NC(=O)C2CCCCCC2)c1	ZINC000523156780	333311533	/nfs/dbraw/zinc/31/15/33/333311533.db2.gz	QCWZHSDBYORGKX-UHFFFAOYSA-N	0	0	273.376	4.160	20	30		CIEDRN
Cc1ccc(C#N)cc1OCc1csc(C(C)C)n1	ZINC000229948107	333311871	/nfs/dbraw/zinc/31/18/71/333311871.db2.gz	HLHGZQFEXPYUMD-UHFFFAOYSA-N	0	0	272.373	4.026	20	30		CIEDRN
Cc1ccccc1SCc1cc(F)ccc1C#N	ZINC000229949959	333312027	/nfs/dbraw/zinc/31/20/27/333312027.db2.gz	OAEGUVLVNFTHJG-UHFFFAOYSA-N	0	0	257.333	4.298	20	30		CIEDRN
N#Cc1cccc(CNc2ccc(Cl)c(F)c2)c1F	ZINC000230054899	333312516	/nfs/dbraw/zinc/31/25/16/333312516.db2.gz	CJYSKMMBUDSEKP-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
N#Cc1cccc(CNc2ccccc2C(F)(F)F)c1F	ZINC000230054702	333312536	/nfs/dbraw/zinc/31/25/36/333312536.db2.gz	WNXLSNSZQGFQAF-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
Cc1cc(Br)cc(NCC(C)(C)CCC#N)c1	ZINC000230227487	333315797	/nfs/dbraw/zinc/31/57/97/333315797.db2.gz	OMHAKHDCLJAIIU-UHFFFAOYSA-N	0	0	295.224	4.499	20	30		CIEDRN
CS[C@H]1CCC[C@H](Nc2c(C#N)cnc3ccccc32)C1	ZINC000230906988	333322415	/nfs/dbraw/zinc/32/24/15/333322415.db2.gz	JCOIBCATFMSFRB-KBPBESRZSA-N	0	0	297.427	4.193	20	30		CIEDRN
Cc1cc(C#N)ccc1-c1nc([C@H]2CCC[C@H](C)C2)no1	ZINC000230997661	333323598	/nfs/dbraw/zinc/32/35/98/333323598.db2.gz	LPLFOMZYLOQQLU-FZMZJTMJSA-N	0	0	281.359	4.210	20	30		CIEDRN
Cc1cc(C#N)ccc1OCc1csc(C(C)(C)C)n1	ZINC000523382181	333324948	/nfs/dbraw/zinc/32/49/48/333324948.db2.gz	KKSBTDGHGONBJX-UHFFFAOYSA-N	0	0	286.400	4.200	20	30		CIEDRN
C[C@@H](Nc1ccc(C#N)cc1F)c1cccc(F)c1F	ZINC000231631879	333326243	/nfs/dbraw/zinc/32/62/43/333326243.db2.gz	DZIOECWDZNETOD-SECBINFHSA-N	0	0	276.261	4.149	20	30		CIEDRN
C=CCCCCCN(C)c1ccc(Br)cn1	ZINC000523534065	333332316	/nfs/dbraw/zinc/33/23/16/333332316.db2.gz	LRCVYPJZWWEKGR-UHFFFAOYSA-N	0	0	283.213	4.027	20	30		CIEDRN
CCCCSCCC(=O)Nc1ccc(Cl)c(C#N)c1	ZINC000523496675	333330222	/nfs/dbraw/zinc/33/02/22/333330222.db2.gz	IXYDFYLYPBPJBI-UHFFFAOYSA-N	0	0	296.823	4.074	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1cccc(-n2cccc2)c1	ZINC000523511106	333331407	/nfs/dbraw/zinc/33/14/07/333331407.db2.gz	USDRSEVZRGGJEN-UHFFFAOYSA-N	0	0	296.414	4.296	20	30		CIEDRN
C=CCCS[C@H](C(=O)N1CCCCC1)c1ccccc1	ZINC000523521811	333332022	/nfs/dbraw/zinc/33/20/22/333332022.db2.gz	DXSCEKBFNUBGSB-INIZCTEOSA-N	0	0	289.444	4.050	20	30		CIEDRN
C=CCCSCc1cc(Br)ccc1F	ZINC000523518474	333332047	/nfs/dbraw/zinc/33/20/47/333332047.db2.gz	BRVLGIDEIDDZPD-UHFFFAOYSA-N	0	0	275.186	4.398	20	30		CIEDRN
C=CCCSCc1cc(F)ccc1Br	ZINC000523521800	333332127	/nfs/dbraw/zinc/33/21/27/333332127.db2.gz	DJMXDRVHHXTEKH-UHFFFAOYSA-N	0	0	275.186	4.398	20	30		CIEDRN
C=CCCCCCN(C)C(=O)NCc1ccc(C)cc1C	ZINC000523566826	333333061	/nfs/dbraw/zinc/33/30/61/333333061.db2.gz	ICAOMGUFGAIKFD-UHFFFAOYSA-N	0	0	288.435	4.191	20	30		CIEDRN
C=CCCCCCN(C)C(=O)N[C@H]1C[C@H](C)C[C@H](C)C1	ZINC000523567331	333333278	/nfs/dbraw/zinc/33/32/78/333333278.db2.gz	XIXPFBDHDLPXPN-ZSHCYNCHSA-N	0	0	280.456	4.199	20	30		CIEDRN
Cc1cc(F)c(Br)cc1NCCC(C)(C)C#N	ZINC000232099959	333333912	/nfs/dbraw/zinc/33/39/12/333333912.db2.gz	IWGNQPXUXOYVOC-UHFFFAOYSA-N	0	0	299.187	4.248	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)c2cccc3[nH]ccc32)CCCC1(C)C	ZINC000575945588	335134497	/nfs/dbraw/zinc/13/44/97/335134497.db2.gz	ANYIXTWHMJBMDT-KRWDZBQOSA-N	0	0	296.414	4.375	20	30		CIEDRN
CC(C)(C#N)CCCCOc1c(Cl)cccc1[N+](=O)[O-]	ZINC000232518372	333337832	/nfs/dbraw/zinc/33/78/32/333337832.db2.gz	DLCWEAXAQNHXTN-UHFFFAOYSA-N	0	0	296.754	4.347	20	30		CIEDRN
CC(C)(C#N)CCCC[S@](=O)c1ccc2c(c1)CCC2	ZINC000232526651	333338007	/nfs/dbraw/zinc/33/80/07/333338007.db2.gz	ZUGVHBZPYPPLAG-FQEVSTJZSA-N	0	0	289.444	4.003	20	30		CIEDRN
C=CCCCCCOc1ccc(CCC(C)=O)cc1	ZINC000232564812	333338834	/nfs/dbraw/zinc/33/88/34/333338834.db2.gz	KJOGZNLUVWOKAQ-UHFFFAOYSA-N	0	0	260.377	4.333	20	30		CIEDRN
CCc1c(C)sc(NC(=O)[C@H](C)C(C)(C)C)c1C#N	ZINC000523714444	333341354	/nfs/dbraw/zinc/34/13/54/333341354.db2.gz	DVQGMMRMCPHGLY-VIFPVBQESA-N	0	0	278.421	4.111	20	30		CIEDRN
CC(C)Oc1ccccc1N[C@H](C#N)C1CCCCC1	ZINC000523740452	333342973	/nfs/dbraw/zinc/34/29/73/333342973.db2.gz	NMPWUUWKEDMPBD-MRXNPFEDSA-N	0	0	272.392	4.358	20	30		CIEDRN
C=CCN(CC=C)C(=O)N[C@H](CCC(C)C)C(C)(C)C	ZINC000523770402	333344796	/nfs/dbraw/zinc/34/47/96/333344796.db2.gz	SXWZBHUISFUAAV-OAHLLOKOSA-N	0	0	280.456	4.221	20	30		CIEDRN
CCC1(CC)CCN(c2nccc(C#N)c2Cl)CC1	ZINC000232932619	333345723	/nfs/dbraw/zinc/34/57/23/333345723.db2.gz	LDCVEBSRECSALG-UHFFFAOYSA-N	0	0	277.799	4.013	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@@H](C)CC(C)(C)c1ccccc1	ZINC000523877325	333348968	/nfs/dbraw/zinc/34/89/68/333348968.db2.gz	SYYQPLOGWNKRHW-CABCVRRESA-N	0	0	288.435	4.007	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@@H](c1ccccc1)C1CCCC1	ZINC000523943901	333349703	/nfs/dbraw/zinc/34/97/03/333349703.db2.gz	OGJGSYHTJMGJHE-PBHICJAKSA-N	0	0	286.419	4.182	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@H](c1ccccc1)C1CCCC1	ZINC000523943903	333349806	/nfs/dbraw/zinc/34/98/06/333349806.db2.gz	OGJGSYHTJMGJHE-WMLDXEAASA-N	0	0	286.419	4.182	20	30		CIEDRN
C=CC[C@H](C)NC(=O)CSc1ccc2ccccc2c1	ZINC000523950337	333349854	/nfs/dbraw/zinc/34/98/54/333349854.db2.gz	YBUDRBQVHXWUIX-ZDUSSCGKSA-N	0	0	285.412	4.013	20	30		CIEDRN
C=CCCC(=O)NCCc1c(C)cc(C(C)(C)C)cc1C	ZINC000523953455	333349945	/nfs/dbraw/zinc/34/99/45/333349945.db2.gz	HSBGHCYUPWHUIX-UHFFFAOYSA-N	0	0	287.447	4.226	20	30		CIEDRN
C=CCCC(=O)Nc1nc(-c2ccc(C)cc2)cs1	ZINC000523955574	333350145	/nfs/dbraw/zinc/35/01/45/333350145.db2.gz	YRKNTDGGUCYHHQ-UHFFFAOYSA-N	0	0	272.373	4.023	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)[C@@H](CCC)CC1CCCCC1	ZINC000523967372	333350283	/nfs/dbraw/zinc/35/02/83/333350283.db2.gz	LUJXTQLLLFAYNU-ZBFHGGJFSA-N	0	0	265.441	4.454	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@@H](c1cccs1)C(CC)CC	ZINC000523981589	333350558	/nfs/dbraw/zinc/35/05/58/333350558.db2.gz	HADZIFMCZYYGLE-SWLSCSKDSA-N	0	0	294.464	4.489	20	30		CIEDRN
Cc1oc(-c2ccsc2)nc1COc1ccc(C#N)cc1	ZINC000524007899	333351377	/nfs/dbraw/zinc/35/13/77/333351377.db2.gz	RGMWZQXEDFVXPV-UHFFFAOYSA-N	0	0	296.351	4.162	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1cc2cc(C)ccc2[nH]1	ZINC000524147066	333354452	/nfs/dbraw/zinc/35/44/52/333354452.db2.gz	PMGJOELPUUZJQM-UHFFFAOYSA-N	0	0	284.403	4.295	20	30		CIEDRN
CCCC[C@H](CC)CC(=O)Nc1ccc(CC#N)cc1	ZINC000524208902	333356380	/nfs/dbraw/zinc/35/63/80/333356380.db2.gz	QTBWWASGOJTOIE-AWEZNQCLSA-N	0	0	272.392	4.298	20	30		CIEDRN
N#Cc1cnc(NCC2(c3ccccc3)CCC2)c(Cl)c1	ZINC000524234967	333356974	/nfs/dbraw/zinc/35/69/74/333356974.db2.gz	CGEIMPGHOMVFKP-UHFFFAOYSA-N	0	0	297.789	4.140	20	30		CIEDRN
CC[C@H](Nc1nccc(C#N)c1Cl)c1cccs1	ZINC000234040253	333357408	/nfs/dbraw/zinc/35/74/08/333357408.db2.gz	VCXDKFLJTMUBCI-JTQLQIEISA-N	0	0	277.780	4.231	20	30		CIEDRN
CC[C@H](CC(=O)Nc1cccc(C#N)c1)c1ccc(C)cc1	ZINC000524250076	333358064	/nfs/dbraw/zinc/35/80/64/333358064.db2.gz	AVGIKAVXCSXVRN-MRXNPFEDSA-N	0	0	292.382	4.389	20	30		CIEDRN
Cc1ccc(CN(C)Cc2cccc(C#N)c2)c(Cl)c1	ZINC000234294346	333359531	/nfs/dbraw/zinc/35/95/31/333359531.db2.gz	DLPANWLNPNLZQB-UHFFFAOYSA-N	0	0	284.790	4.152	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)N(C)[C@@H](C)CCC)c1	ZINC000524305386	333359546	/nfs/dbraw/zinc/35/95/46/333359546.db2.gz	JKDAXUIXFMIQCE-AWEZNQCLSA-N	0	0	290.407	4.294	20	30		CIEDRN
CC(C)CC[C@H]1CCC[C@@H]1NC(=O)c1cccc(CC#N)c1	ZINC000524329504	333360104	/nfs/dbraw/zinc/36/01/04/333360104.db2.gz	MHAGUVGEJUGVTG-AEFFLSMTSA-N	0	0	298.430	4.087	20	30		CIEDRN
COc1ccc(S[C@@H](C#N)C2CCCCC2)cc1	ZINC000524534323	333365077	/nfs/dbraw/zinc/36/50/77/333365077.db2.gz	NMWKACYUDUPRJC-HNNXBMFYSA-N	0	0	261.390	4.260	20	30		CIEDRN
Cc1ccc(C)c([C@H](C)[N@H+](C)Cc2ccccc2C#N)c1	ZINC000524594231	333367603	/nfs/dbraw/zinc/36/76/03/333367603.db2.gz	IRTJXADGRGETQY-INIZCTEOSA-N	0	0	278.399	4.368	20	30		CIEDRN
Cc1ccc([N+](=O)[O-])c(OCCCCC(C)(C)C#N)c1	ZINC000235757826	333371971	/nfs/dbraw/zinc/37/19/71/333371971.db2.gz	MLACEQKIZMCTOJ-UHFFFAOYSA-N	0	0	276.336	4.002	20	30		CIEDRN
Cc1cc([N+](=O)[O-])ccc1OCCCCC(C)(C)C#N	ZINC000235750863	333372043	/nfs/dbraw/zinc/37/20/43/333372043.db2.gz	UYUQRMYESPBWAW-UHFFFAOYSA-N	0	0	276.336	4.002	20	30		CIEDRN
CC[C@@H](CC#N)NCc1ccc(OCc2ccccc2)cc1	ZINC000236909461	333376296	/nfs/dbraw/zinc/37/62/96/333376296.db2.gz	ZNDCFYIQEWIMMV-SFHVURJKSA-N	0	0	294.398	4.047	20	30		CIEDRN
N#CCc1ccc(NCc2coc(-c3ccccc3)n2)cc1	ZINC000237835673	333381764	/nfs/dbraw/zinc/38/17/64/333381764.db2.gz	RVZWOCGKHOVYKE-UHFFFAOYSA-N	0	0	289.338	4.020	20	30		CIEDRN
N#Cc1ccc(CNc2cccc(OC3CCCC3)c2)cc1	ZINC000237844754	333381985	/nfs/dbraw/zinc/38/19/85/333381985.db2.gz	UQKIWWNRVRWSKU-UHFFFAOYSA-N	0	0	292.382	4.492	20	30		CIEDRN
C[C@@H](CCc1ccco1)Nc1cc(C#N)c2ccccc2n1	ZINC000315682767	333382866	/nfs/dbraw/zinc/38/28/66/333382866.db2.gz	MBOHOQLBTFSVMN-ZDUSSCGKSA-N	0	0	291.354	4.133	20	30		CIEDRN
CCCCc1ccc(NC(=O)Cc2ccc(C#N)cc2)cc1	ZINC000315818368	333383876	/nfs/dbraw/zinc/38/38/76/333383876.db2.gz	UQUACYRURJDXOC-UHFFFAOYSA-N	0	0	292.382	4.082	20	30		CIEDRN
N#Cc1ccc(N[C@@H]2C[C@@H]2c2c(F)cccc2Cl)cc1	ZINC000524842856	333390021	/nfs/dbraw/zinc/39/00/21/333390021.db2.gz	YFEHQJYJJBDPMF-SWLSCSKDSA-N	0	0	286.737	4.319	20	30		CIEDRN
C=CCCC1(C(=O)NCc2ccc3sccc3c2)CC1	ZINC000575035108	333390036	/nfs/dbraw/zinc/39/00/36/333390036.db2.gz	OVVQFAHJMRUALK-UHFFFAOYSA-N	0	0	285.412	4.264	20	30		CIEDRN
CC(C)C[C@@H](C(=O)Nc1cccc(C#N)c1)c1ccccc1	ZINC000524854568	333390805	/nfs/dbraw/zinc/39/08/05/333390805.db2.gz	YUYMOUGZPUZKMF-GOSISDBHSA-N	0	0	292.382	4.327	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@@H]1CCC[C@@H](C)C1	ZINC000524983872	333394721	/nfs/dbraw/zinc/39/47/21/333394721.db2.gz	FMCMOKYZBMZVMF-HUUCEWRRSA-N	0	0	251.414	4.018	20	30		CIEDRN
CCCCc1nc(CN2CCC(CCC#N)CC2)cs1	ZINC000575984861	335138106	/nfs/dbraw/zinc/13/81/06/335138106.db2.gz	KRULQCKGHDXHPM-UHFFFAOYSA-N	0	0	291.464	4.001	20	30		CIEDRN
Cc1cccc(OCCSc2ccccc2C#N)c1	ZINC000525085086	333398429	/nfs/dbraw/zinc/39/84/29/333398429.db2.gz	RVVYCMMGBKKEAO-UHFFFAOYSA-N	0	0	269.369	4.038	20	30		CIEDRN
N#Cc1ccc(S[C@H](C#N)C2CCCCC2)c(F)c1	ZINC000525116814	333398902	/nfs/dbraw/zinc/39/89/02/333398902.db2.gz	PLKYJBIZVFHOEW-OAHLLOKOSA-N	0	0	274.364	4.262	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)NCCCC(C)(C)C	ZINC000525355178	333409856	/nfs/dbraw/zinc/40/98/56/333409856.db2.gz	UZURYIBZFWPWBT-UHFFFAOYSA-N	0	0	288.435	4.211	20	30		CIEDRN
CC(C)(C#N)c1ccc(C(=O)N(C2CC2)C2CCCC2)cc1	ZINC000526002082	333418327	/nfs/dbraw/zinc/41/83/27/333418327.db2.gz	FIJROAQIQUGZCP-UHFFFAOYSA-N	0	0	296.414	4.035	20	30		CIEDRN
C=CCCSCc1ncc(-c2ccccc2F)o1	ZINC000173833714	335141584	/nfs/dbraw/zinc/14/15/84/335141584.db2.gz	ACIXLXMNPULEKC-UHFFFAOYSA-N	0	0	263.337	4.290	20	30		CIEDRN
C=CCS[C@@H](C)c1nc(Cc2ccc(Cl)cc2)no1	ZINC000173825541	335141768	/nfs/dbraw/zinc/14/17/68/335141768.db2.gz	VEWCPLLMKISLRT-JTQLQIEISA-N	0	0	294.807	4.294	20	30		CIEDRN
CCC(C#N)(CC)C(=O)Nc1cnc(-c2ccccc2)s1	ZINC000528945759	333465699	/nfs/dbraw/zinc/46/56/99/333465699.db2.gz	GKDVFPQDYQRGGU-UHFFFAOYSA-N	0	0	299.399	4.079	20	30		CIEDRN
Cc1cc(C)c(CNc2ccc(CC#N)cc2)c(C)c1	ZINC000037071262	333472254	/nfs/dbraw/zinc/47/22/54/333472254.db2.gz	FXGFRNQIAHXTFV-UHFFFAOYSA-N	0	0	264.372	4.290	20	30		CIEDRN
CCC(C#N)(CC)C(=O)N[C@H]1CCC[C@@H](c2ccccc2)C1	ZINC000529163080	333475489	/nfs/dbraw/zinc/47/54/89/333475489.db2.gz	CYNACXXRVQGJOD-SJORKVTESA-N	0	0	298.430	4.159	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)[C@H]1CCCC12CC2	ZINC000529271519	333480614	/nfs/dbraw/zinc/48/06/14/333480614.db2.gz	JHRAREVHBIBUDH-OAHLLOKOSA-N	0	0	269.388	4.324	20	30		CIEDRN
CC(C)Cn1ccc2cc(NC[C@@H](C#N)CCC#N)ccc21	ZINC000576031196	335143433	/nfs/dbraw/zinc/14/34/33/335143433.db2.gz	HIDCGYUYSMRATK-OAHLLOKOSA-N	0	0	294.402	4.153	20	30		CIEDRN
C=CCCCC(=O)N1CC[C@H](c2cccc(F)c2)C1(C)C	ZINC000530036598	333521013	/nfs/dbraw/zinc/52/10/13/333521013.db2.gz	NMDCSAJLPPGTDT-MRXNPFEDSA-N	0	0	289.394	4.277	20	30		CIEDRN
CC[C@H]1CC[C@H](C(=O)Nc2ccc(C#N)cc2Cl)CC1	ZINC000328333733	333524547	/nfs/dbraw/zinc/52/45/47/333524547.db2.gz	JFEIWWMERLWVLF-AULYBMBSSA-N	0	0	290.794	4.367	20	30		CIEDRN
C[C@@H](Nc1cccc(OC(F)F)c1)c1cccc(C#N)c1	ZINC000037293324	333531326	/nfs/dbraw/zinc/53/13/26/333531326.db2.gz	DUHMTWYSPNRQKS-LLVKDONJSA-N	0	0	288.297	4.333	20	30		CIEDRN
N#Cc1ccc(NCc2ccccc2Cl)cc1Cl	ZINC000037389972	333532493	/nfs/dbraw/zinc/53/24/93/333532493.db2.gz	VSBKPSWBDYZZHI-UHFFFAOYSA-N	0	0	277.154	4.477	20	30		CIEDRN
COc1cc(C)ccc1N[C@@H](C)c1cccc(C#N)c1	ZINC000037783339	333540104	/nfs/dbraw/zinc/54/01/04/333540104.db2.gz	XTPXITYECJTWBX-ZDUSSCGKSA-N	0	0	266.344	4.048	20	30		CIEDRN
C=CCN(Cc1cnc(C2CC2)s1)c1ccccc1	ZINC000530412002	333546879	/nfs/dbraw/zinc/54/68/79/333546879.db2.gz	YXRVMGRDFJELAY-UHFFFAOYSA-N	0	0	270.401	4.213	20	30		CIEDRN
CCN(C(=O)C[C@@H]1CC[C@H](C)C1)[C@H](C)c1ccc(C#N)cc1	ZINC000123924956	333554517	/nfs/dbraw/zinc/55/45/17/333554517.db2.gz	OPHGMCCDIINXOM-ZMSDIMECSA-N	0	0	298.430	4.294	20	30		CIEDRN
C[C@H](CCC(=O)Nc1ccc(F)cc1C#N)c1ccccc1	ZINC000124105916	333556067	/nfs/dbraw/zinc/55/60/67/333556067.db2.gz	FKXDQQWDUPWJSB-CYBMUJFWSA-N	0	0	296.345	4.220	20	30		CIEDRN
Cc1ccc(CCCCC(=O)N(CC#N)C2CCCC2)cc1	ZINC000125202447	333565024	/nfs/dbraw/zinc/56/50/24/333565024.db2.gz	GEGORWJCBPZIEU-UHFFFAOYSA-N	0	0	298.430	4.003	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)c1cccc(C)c1C	ZINC000125594119	333567936	/nfs/dbraw/zinc/56/79/36/333567936.db2.gz	WVGXNNJSXADGDW-UHFFFAOYSA-N	0	0	257.377	4.035	20	30		CIEDRN
CCC[C@H](C)CC(=O)N(CC)c1ccc(C#N)c(Cl)c1	ZINC000538073007	333572844	/nfs/dbraw/zinc/57/28/44/333572844.db2.gz	DKJBAULQAAXJNB-LBPRGKRZSA-N	0	0	292.810	4.391	20	30		CIEDRN
COc1ccc(C#N)cc1CNc1cccc(SC)c1C	ZINC000538138898	333575997	/nfs/dbraw/zinc/57/59/97/333575997.db2.gz	MZHXIIVNIXCUOP-UHFFFAOYSA-N	0	0	298.411	4.209	20	30		CIEDRN
N#Cc1cccc(Sc2ncncc2-c2ccccc2)c1	ZINC000538147490	333576621	/nfs/dbraw/zinc/57/66/21/333576621.db2.gz	LMCSXQOGBZRDDD-UHFFFAOYSA-N	0	0	289.363	4.166	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N(C)Cc1ccc(CC)cc1	ZINC000538291217	333583375	/nfs/dbraw/zinc/58/33/75/333583375.db2.gz	PFDNDCBSQXPPSS-OAHLLOKOSA-N	0	0	288.435	4.135	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)C1(CC(C)C)CCC1	ZINC000538335492	333585861	/nfs/dbraw/zinc/58/58/61/333585861.db2.gz	JPBLUYXZQLFKGF-CQSZACIVSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1ccc(COCC)cc1	ZINC000538353920	333586921	/nfs/dbraw/zinc/58/69/21/333586921.db2.gz	IIFONMZUWMPBMS-AWEZNQCLSA-N	0	0	290.407	4.089	20	30		CIEDRN
COc1cc(C)nc(CS[C@@H](C)c2ccc(C#N)cc2)c1	ZINC000538524862	333603967	/nfs/dbraw/zinc/60/39/67/333603967.db2.gz	CKFLHVNOBZAFGT-ZDUSSCGKSA-N	0	0	298.411	4.265	20	30		CIEDRN
C=CCCOCCCCC(=O)Nc1ccc(C)c(CC)c1	ZINC000538707230	333612796	/nfs/dbraw/zinc/61/27/96/333612796.db2.gz	CWERURBVBNSYGZ-UHFFFAOYSA-N	0	0	289.419	4.259	20	30		CIEDRN
CC[C@H](C#N)Sc1nc(C)nc2sc(C)c(C)c21	ZINC000127007410	333615305	/nfs/dbraw/zinc/61/53/05/333615305.db2.gz	XSZWCNJDWXAXQJ-SNVBAGLBSA-N	0	0	277.418	4.011	20	30		CIEDRN
N#CCCCN(Cc1ccsc1)c1ccccc1	ZINC000066831696	333629486	/nfs/dbraw/zinc/62/94/86/333629486.db2.gz	PQKYCPYPTUYGLX-UHFFFAOYSA-N	0	0	256.374	4.058	20	30		CIEDRN
C=C(CC)CS[C@@H](C)c1nc(C(C)(C)C)no1	ZINC000539095074	333657503	/nfs/dbraw/zinc/65/75/03/333657503.db2.gz	PMAIRZFKHUWSOC-JTQLQIEISA-N	0	0	254.399	4.128	20	30		CIEDRN
CSc1ccccc1NCc1ccc(C#N)cc1F	ZINC000128383560	333665881	/nfs/dbraw/zinc/66/58/81/333665881.db2.gz	RMUFMTCCXXIRBW-UHFFFAOYSA-N	0	0	272.348	4.031	20	30		CIEDRN
C=CCCOCCCCC(=O)Nc1ccc(Cl)cc1C	ZINC000539366915	333667616	/nfs/dbraw/zinc/66/76/16/333667616.db2.gz	HSBUUVMATXZOBG-UHFFFAOYSA-N	0	0	295.810	4.350	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N1CCC[C@H]1c1ccsc1	ZINC000539390713	333668779	/nfs/dbraw/zinc/66/87/79/333668779.db2.gz	VUBSVHXOIOXGHF-HIFRSBDPSA-N	0	0	292.448	4.339	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1cccc(-c2ccoc2)c1	ZINC000539434052	333671234	/nfs/dbraw/zinc/67/12/34/333671234.db2.gz	RGYIUTXKDLZJPT-AWEZNQCLSA-N	0	0	283.371	4.421	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1cc(F)c(Cl)cc1F	ZINC000539434808	333671279	/nfs/dbraw/zinc/67/12/79/333671279.db2.gz	WHIQXWBMOLFEBM-VIFPVBQESA-N	0	0	287.737	4.093	20	30		CIEDRN
N#CC1(CN(Cc2ccco2)c2ccc(Cl)cc2)CC1	ZINC000539453364	333672182	/nfs/dbraw/zinc/67/21/82/333672182.db2.gz	KWOJARBEKLISIF-UHFFFAOYSA-N	0	0	286.762	4.243	20	30		CIEDRN
CC(C)(C)CC(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1	ZINC000068454794	333700957	/nfs/dbraw/zinc/70/09/57/333700957.db2.gz	NRPRDVIXLUEHJD-LBPRGKRZSA-N	0	0	299.201	4.110	20	30		CIEDRN
CCC[C@H](C#N)NC(=O)[C@@H](CC1CCCCC1)C(C)C	ZINC000539929287	333703293	/nfs/dbraw/zinc/70/32/93/333703293.db2.gz	UHCUIVUYWRNSBU-CVEARBPZSA-N	0	0	278.440	4.037	20	30		CIEDRN
C=CCN(C(=O)N[C@@H](CC)c1ccc(Cl)s1)C1CC1	ZINC000540111587	333710412	/nfs/dbraw/zinc/71/04/12/333710412.db2.gz	HDKUPEAPBPJKCR-NSHDSACASA-N	0	0	298.839	4.213	20	30		CIEDRN
C=CCN(C(=O)CCCc1csc2ccccc12)C1CC1	ZINC000540129996	333710905	/nfs/dbraw/zinc/71/09/05/333710905.db2.gz	GBUXFIKHLYTHEA-UHFFFAOYSA-N	0	0	299.439	4.401	20	30		CIEDRN
Cc1cc(C(=O)N(CCC#N)CC(C)(C)C)ccc1Cl	ZINC000128827148	333715490	/nfs/dbraw/zinc/71/54/90/333715490.db2.gz	SDGXLKNNSUYECX-UHFFFAOYSA-N	0	0	292.810	4.050	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)CC[C@H](C)SC	ZINC000540218082	333721620	/nfs/dbraw/zinc/72/16/20/333721620.db2.gz	CCZPPIQPJIGVLB-AWEZNQCLSA-N	0	0	283.481	4.113	20	30		CIEDRN
CCN(Cc1cccs1)c1cc(C#N)c2ccccc2n1	ZINC000068772452	333728675	/nfs/dbraw/zinc/72/86/75/333728675.db2.gz	WZMNZDQRCIDSOJ-UHFFFAOYSA-N	0	0	293.395	4.194	20	30		CIEDRN
C=CCCOCCCCC(=O)N[C@@H]1CCC(C)(C)C[C@@H]1C	ZINC000540485660	333731720	/nfs/dbraw/zinc/73/17/20/333731720.db2.gz	NSPSVIDHVXAPQI-JKSUJKDBSA-N	0	0	295.467	4.080	20	30		CIEDRN
CC(C)(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1	ZINC000068824611	333732897	/nfs/dbraw/zinc/73/28/97/333732897.db2.gz	MNXXQEGYBSETMZ-UHFFFAOYSA-N	0	0	294.354	4.335	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1ccc(F)c(CSC)c1	ZINC000540530409	333733960	/nfs/dbraw/zinc/73/39/60/333733960.db2.gz	BVHBRZJIWPOMGF-GFCCVEGCSA-N	0	0	295.423	4.163	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)COc1ccc2ccccc2c1	ZINC000540533614	333734301	/nfs/dbraw/zinc/73/43/01/333734301.db2.gz	VOHWDSDPXQOOPJ-OAHLLOKOSA-N	0	0	297.398	4.080	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1cccc(CSC)c1	ZINC000540557754	333735387	/nfs/dbraw/zinc/73/53/87/333735387.db2.gz	QTPDLIMYSZEYRH-CYBMUJFWSA-N	0	0	292.448	4.416	20	30		CIEDRN
N#Cc1ccc(NC(=O)CC2CC(c3ccccc3)C2)cc1	ZINC000540604508	333737310	/nfs/dbraw/zinc/73/73/10/333737310.db2.gz	WBGPGTYFKMITOO-UHFFFAOYSA-N	0	0	290.366	4.081	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1cccc(C)c1F)c1ccccc1	ZINC000540618581	333738718	/nfs/dbraw/zinc/73/87/18/333738718.db2.gz	QHZDDXUMQYNTRF-AWEZNQCLSA-N	0	0	283.346	4.433	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N[C@@H](C)c1cc(C)sc1C	ZINC000540768538	333746429	/nfs/dbraw/zinc/74/64/29/333746429.db2.gz	PNMCWBHGFOYIJL-AAEUAGOBSA-N	0	0	280.437	4.080	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N[C@H](c1ccc(C)cc1)C1CC1	ZINC000540766319	333746483	/nfs/dbraw/zinc/74/64/83/333746483.db2.gz	ABEARMMZNAYLSK-DLBZAZTESA-N	0	0	286.419	4.100	20	30		CIEDRN
C=CCC[C@H](Nc1cnn(CCCC)c1C)C1CC1	ZINC000540779599	333746964	/nfs/dbraw/zinc/74/69/64/333746964.db2.gz	OQRIBVODQFSBLV-HNNXBMFYSA-N	0	0	261.413	4.148	20	30		CIEDRN
COC1CCC(CCNc2cc(Cl)ccc2C#N)CC1	ZINC000541624115	333784665	/nfs/dbraw/zinc/78/46/65/333784665.db2.gz	LGPMQVGFJCGDCM-UHFFFAOYSA-N	0	0	292.810	4.219	20	30		CIEDRN
C=CCOc1ccccc1CNCc1ccc([C@@H]2C[C@@H]2C)o1	ZINC000069752716	333786941	/nfs/dbraw/zinc/78/69/41/333786941.db2.gz	JERCOBICDFPNQX-WMLDXEAASA-N	0	0	297.398	4.258	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CC(C2CCCCC2)C1)c1ccccc1	ZINC000576137512	335159529	/nfs/dbraw/zinc/15/95/29/335159529.db2.gz	DIVAXQLKLDDJMM-INIZCTEOSA-N	0	0	297.442	4.385	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cccc([C@H](C)OC)c1	ZINC000130068538	333810351	/nfs/dbraw/zinc/81/03/51/333810351.db2.gz	FOVQFXRGOVLVAI-ZDUSSCGKSA-N	0	0	273.376	4.101	20	30		CIEDRN
CC1(CNc2c(C#N)cnc3ccccc32)CCCC1	ZINC000070543184	333815903	/nfs/dbraw/zinc/81/59/03/333815903.db2.gz	XJDRSTYOCUZZNZ-UHFFFAOYSA-N	0	0	265.360	4.099	20	30		CIEDRN
CCN(Cc1cccs1)c1ncc(Cl)c(C)c1C#N	ZINC000542210523	333816171	/nfs/dbraw/zinc/81/61/71/333816171.db2.gz	BJAFTNQHFQSCCL-UHFFFAOYSA-N	0	0	291.807	4.003	20	30		CIEDRN
CC(C)Oc1ccccc1NCc1cccc(C#N)c1F	ZINC000542233685	333817816	/nfs/dbraw/zinc/81/78/16/333817816.db2.gz	UOSOKHSKYUOLIA-UHFFFAOYSA-N	0	0	284.334	4.097	20	30		CIEDRN
C=C(CC)CN[C@@H](c1cccc(F)c1F)C(F)(F)F	ZINC000542260526	333819118	/nfs/dbraw/zinc/81/91/18/333819118.db2.gz	DERPDQWCQYSIIE-LBPRGKRZSA-N	0	0	279.252	4.124	20	30		CIEDRN
C=CCC1(c2nc(-c3ccc(N(C)C)cc3C)no2)CCC1	ZINC000564255495	333824114	/nfs/dbraw/zinc/82/41/14/333824114.db2.gz	WHXAMMPWXAZPQA-UHFFFAOYSA-N	0	0	297.402	4.109	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(N[C@@H]2CC[C@H]3CCC[C@H]3C2)c1	ZINC000542505499	333828944	/nfs/dbraw/zinc/82/89/44/333828944.db2.gz	CZTMULKSSQBSID-UKPHBRMFSA-N	0	0	282.387	4.142	20	30		CIEDRN
C[C@@H](CCC(C)(C)C)C(=O)N[C@]1(C#N)CCC[C@@H](C)C1	ZINC000542527177	333830948	/nfs/dbraw/zinc/83/09/48/333830948.db2.gz	SPHJMKOCFOFBOY-JKIFEVAISA-N	0	0	278.440	4.037	20	30		CIEDRN
N#CCC[C@H](NCc1csc(C2CC2)n1)c1ccccc1	ZINC000130486745	333844637	/nfs/dbraw/zinc/84/46/37/333844637.db2.gz	HBDZXTHANZQBKD-INIZCTEOSA-N	0	0	297.427	4.155	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1ccn(Cc2ccccc2)c1	ZINC000542869275	333846483	/nfs/dbraw/zinc/84/64/83/333846483.db2.gz	UDIDXDILCDVAOB-INIZCTEOSA-N	0	0	296.414	4.011	20	30		CIEDRN
C=C[C@H](CC(=O)N1CC[C@]2(CC[C@@H](C)C2)C1)c1ccccc1	ZINC000542871096	333846635	/nfs/dbraw/zinc/84/66/35/333846635.db2.gz	SUKHBJNQXHFTET-HLIPFELVSA-N	0	0	297.442	4.385	20	30		CIEDRN
CC(C)c1ncc(CN[C@H](CCC#N)c2ccccc2)s1	ZINC000130509784	333848013	/nfs/dbraw/zinc/84/80/13/333848013.db2.gz	PYTQIVZFEJVERF-MRXNPFEDSA-N	0	0	299.443	4.401	20	30		CIEDRN
Cc1c(Cl)cnc(N(C)[C@@H](C)c2ccccc2)c1C#N	ZINC000543137007	333859918	/nfs/dbraw/zinc/85/99/18/333859918.db2.gz	IDUWGXWPSFGUAB-LBPRGKRZSA-N	0	0	285.778	4.113	20	30		CIEDRN
N#Cc1c(F)cccc1N1CCC(Cc2ccccc2)CC1	ZINC000071650021	333868485	/nfs/dbraw/zinc/86/84/85/333868485.db2.gz	HZFUUERRLBAIKZ-UHFFFAOYSA-N	0	0	294.373	4.156	20	30		CIEDRN
CCCc1ccccc1NC(=O)c1ccc(Cl)c(C#N)c1	ZINC000543469335	333876777	/nfs/dbraw/zinc/87/67/77/333876777.db2.gz	RDUXLRVOGGYGLF-UHFFFAOYSA-N	0	0	298.773	4.416	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2ccc(C)cc2F)no1	ZINC000564268572	333877714	/nfs/dbraw/zinc/87/77/14/333877714.db2.gz	CLQIFRQPGQMKQX-NSHDSACASA-N	0	0	260.312	4.254	20	30		CIEDRN
CC#CCCNC(=O)c1cc2sc3ccccc3c2s1	ZINC000543604702	333883870	/nfs/dbraw/zinc/88/38/70/333883870.db2.gz	BGAKNRHACGKJQM-UHFFFAOYSA-N	0	0	299.420	4.259	20	30		CIEDRN
C=CCN(C(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1)c1ccccc1	ZINC000071846390	333885817	/nfs/dbraw/zinc/88/58/17/333885817.db2.gz	UYQQJDKPJHYKQW-QZTJIDSGSA-N	0	0	295.357	4.148	20	30		CIEDRN
C=CCC[C@H](NC(=O)N(C)[C@H](C)CC)c1ccccc1	ZINC000130926765	333889722	/nfs/dbraw/zinc/88/97/22/333889722.db2.gz	VOGCYBMYCPTULC-ZBFHGGJFSA-N	0	0	274.408	4.134	20	30		CIEDRN
C=CCC[C@@H](NC(=O)N(CC)C(C)C)c1ccccc1	ZINC000130979652	333892655	/nfs/dbraw/zinc/89/26/55/333892655.db2.gz	ZATCCNWBPSJWBS-MRXNPFEDSA-N	0	0	274.408	4.134	20	30		CIEDRN
CC(C)CCOCCSc1cccc(Cl)c1C#N	ZINC000543960795	333907241	/nfs/dbraw/zinc/90/72/41/333907241.db2.gz	ZKHFPDGOAOZUJC-UHFFFAOYSA-N	0	0	283.824	4.366	20	30		CIEDRN
Cc1ccc([C@H]2CCCN2c2nccc(C)c2C#N)cc1C	ZINC000544066206	333913964	/nfs/dbraw/zinc/91/39/64/333913964.db2.gz	LYVSPNYUENSNNL-GOSISDBHSA-N	0	0	291.398	4.220	20	30		CIEDRN
COc1cccc(CSCc2ccc(CC#N)cc2)c1	ZINC000544082863	333915160	/nfs/dbraw/zinc/91/51/60/333915160.db2.gz	XHTOHJLRJASPLQ-UHFFFAOYSA-N	0	0	283.396	4.195	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N[C@H](C)c1c(C)cccc1C	ZINC000544435184	333931305	/nfs/dbraw/zinc/93/13/05/333931305.db2.gz	LCYCDIYENYHALI-HUUCEWRRSA-N	0	0	274.408	4.018	20	30		CIEDRN
CCOc1ccccc1NCc1ccccc1C(C)(C)C#N	ZINC000131423628	333935798	/nfs/dbraw/zinc/93/57/98/333935798.db2.gz	WWAFOEXRPYTWQG-UHFFFAOYSA-N	0	0	294.398	4.499	20	30		CIEDRN
C=CCN(C/C=C/c1ccc(F)cc1F)CC(F)(F)F	ZINC000544608620	333940194	/nfs/dbraw/zinc/94/01/94/333940194.db2.gz	ZAMZFPFCXJPXNI-ONEGZZNKSA-N	0	0	291.263	4.028	20	30		CIEDRN
C=CCCC(=O)NC(c1ccccc1C)c1ccccc1C	ZINC000544824709	333947499	/nfs/dbraw/zinc/94/74/99/333947499.db2.gz	RXLSPGKVVDFJQL-UHFFFAOYSA-N	0	0	293.410	4.475	20	30		CIEDRN
C=CCCO[C@H](C)c1nc([C@H]2CCCc3ccccc32)no1	ZINC000544979455	333956245	/nfs/dbraw/zinc/95/62/45/333956245.db2.gz	TYGULTQQJFSGRZ-CJNGLKHVSA-N	0	0	298.386	4.192	20	30		CIEDRN
C=CCCO[C@H](C)c1nc(C[C@@H](C)c2ccccc2)no1	ZINC000545052019	333960298	/nfs/dbraw/zinc/96/02/98/333960298.db2.gz	SZVXCTXRWSLUEN-ZIAGYGMSSA-N	0	0	286.375	4.070	20	30		CIEDRN
N#Cc1ccc(NCc2csc(-c3ccsc3)n2)cc1	ZINC000072816639	333962316	/nfs/dbraw/zinc/96/23/16/333962316.db2.gz	BLMCEERREDOGSR-UHFFFAOYSA-N	0	0	297.408	4.355	20	30		CIEDRN
CC[C@H](CC#N)NC(=O)[C@@H](CC1CCCCC1)C(C)C	ZINC000545156782	333965117	/nfs/dbraw/zinc/96/51/17/333965117.db2.gz	GLROYEYENDUEMB-CVEARBPZSA-N	0	0	278.440	4.037	20	30		CIEDRN
CC[C@@](C)(C#N)c1nc(-c2ccc3ccccc3c2)no1	ZINC000564290340	333980582	/nfs/dbraw/zinc/98/05/82/333980582.db2.gz	PZMDKTNPORNUPG-KRWDZBQOSA-N	0	0	277.327	4.081	20	30		CIEDRN
Cc1cccc(C)c1[C@H](C)NC(=O)Nc1ccc(C#N)cc1	ZINC000545472322	333983819	/nfs/dbraw/zinc/98/38/19/333983819.db2.gz	TUYZBVVMKZRKMX-AWEZNQCLSA-N	0	0	293.370	4.058	20	30		CIEDRN
C[C@H]1CCCC[C@@H]1c1noc(C2(C#N)CCCCC2)n1	ZINC000545691764	333995134	/nfs/dbraw/zinc/99/51/34/333995134.db2.gz	SBNFEYVUPROSAS-STQMWFEESA-N	0	0	273.380	4.089	20	30		CIEDRN
C=CCCOCCCCc1nc([C@@H](C)C(C)(C)C)no1	ZINC000545732495	333997249	/nfs/dbraw/zinc/99/72/49/333997249.db2.gz	JOIHKOKRIQOFGR-CYBMUJFWSA-N	0	0	280.412	4.135	20	30		CIEDRN
CC[C@H](CC#N)NC(=O)C/C=C/c1ccc(C(C)C)cc1	ZINC000545880713	334003690	/nfs/dbraw/zinc/00/36/90/334003690.db2.gz	UKNKOVLGRSKWBM-FUTAKVPZSA-N	0	0	284.403	4.022	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](C)[C@H]2CCCC[C@H]21	ZINC000545923967	334006575	/nfs/dbraw/zinc/00/65/75/334006575.db2.gz	DBFDFQOFNXSQPA-CAOSSQGBSA-N	0	0	263.425	4.016	20	30		CIEDRN
C=CCCc1nc(Cc2ccc(Cl)cc2Cl)no1	ZINC000546253149	334022653	/nfs/dbraw/zinc/02/26/53/334022653.db2.gz	JRJWVMZWIIBFQW-UHFFFAOYSA-N	0	0	283.158	4.086	20	30		CIEDRN
C[C@H]1CCCC[C@H]1c1noc(CCc2ccc(C#N)cc2)n1	ZINC000546401017	334030788	/nfs/dbraw/zinc/03/07/88/334030788.db2.gz	QVLLYXKNJWLYBD-XJKSGUPXSA-N	0	0	295.386	4.020	20	30		CIEDRN
C[C@H](c1noc(/C=C\c2cccc(C#N)c2)n1)C(C)(C)C	ZINC000546418524	334031657	/nfs/dbraw/zinc/03/16/57/334031657.db2.gz	GAGDSOHAEQAEGB-JLVNDZCYSA-N	0	0	281.359	4.261	20	30		CIEDRN
N#Cc1ccc(/C=C\c2nc([C@@H]3CCCCS3)no2)cc1	ZINC000546517843	334037086	/nfs/dbraw/zinc/03/70/86/334037086.db2.gz	FDWKMRIYFSGVCC-CKXPSTMWSA-N	0	0	297.383	4.070	20	30		CIEDRN
N#Cc1ccc(C(=O)c2cc3cc(Cl)cc(F)c3o2)cc1	ZINC000546537660	334037787	/nfs/dbraw/zinc/03/77/87/334037787.db2.gz	ZGIFKGBUPPTDPS-UHFFFAOYSA-N	0	0	299.688	4.328	20	30		CIEDRN
Cc1ccccc1[C@@H](C)c1noc(-c2cccc(C#N)c2)n1	ZINC000546547140	334038214	/nfs/dbraw/zinc/03/82/14/334038214.db2.gz	CGJYLAQVZRFLFE-CYBMUJFWSA-N	0	0	289.338	4.069	20	30		CIEDRN
C=CCCC[C@@H](C)Sc1nncn1-c1ccccc1F	ZINC000546611906	334040133	/nfs/dbraw/zinc/04/01/33/334040133.db2.gz	NUYUDKRBIRBYJO-GFCCVEGCSA-N	0	0	291.395	4.243	20	30		CIEDRN
C=CCCC[C@H](C)Sc1nncn1-c1ccccc1F	ZINC000546611907	334040195	/nfs/dbraw/zinc/04/01/95/334040195.db2.gz	NUYUDKRBIRBYJO-LBPRGKRZSA-N	0	0	291.395	4.243	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](c1ccccc1)C(F)(F)F	ZINC000546630418	334042108	/nfs/dbraw/zinc/04/21/08/334042108.db2.gz	QTTZRNKFPFLTSJ-AAEUAGOBSA-N	0	0	285.309	4.009	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc2oc(C(C)C)nc2c1	ZINC000546636144	334042728	/nfs/dbraw/zinc/04/27/28/334042728.db2.gz	PYOHEXDEZCJKBI-GFCCVEGCSA-N	0	0	286.375	4.492	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2ccc(Cl)cc2)no1	ZINC000546639664	334042944	/nfs/dbraw/zinc/04/29/44/334042944.db2.gz	MIALXLWIBCCYGR-JTQLQIEISA-N	0	0	262.740	4.460	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(CCCc2ccccc2)no1	ZINC000546639595	334042991	/nfs/dbraw/zinc/04/29/91/334042991.db2.gz	QWQLMIQFMNLIAD-CQSZACIVSA-N	0	0	270.376	4.315	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N[C@@H](c1ccccc1C)C1CC1	ZINC000546660890	334044441	/nfs/dbraw/zinc/04/44/41/334044441.db2.gz	VTLMMXYKUHDYKK-DOTOQJQBSA-N	0	0	286.419	4.100	20	30		CIEDRN
CCC(=O)Nc1ccc(C)c(NCCCC(C)(C)C#N)c1	ZINC000133682331	334049928	/nfs/dbraw/zinc/04/99/28/334049928.db2.gz	GFCPYYFDQSIJON-UHFFFAOYSA-N	0	0	287.407	4.085	20	30		CIEDRN
N#CCc1ccc(NC/C=C/c2ccc(F)cc2F)cc1	ZINC000546782799	334050555	/nfs/dbraw/zinc/05/05/55/334050555.db2.gz	PMSQLXXJVKLFIJ-OWOJBTEDSA-N	0	0	284.309	4.156	20	30		CIEDRN
C=CCC[C@H](NC(=O)[C@@H](C)c1cccnc1)c1ccccc1	ZINC000133713539	334051030	/nfs/dbraw/zinc/05/10/30/334051030.db2.gz	QZEHQVGBRGTRMV-YJBOKZPZSA-N	0	0	294.398	4.009	20	30		CIEDRN
C=CCC[C@H](NC(=O)Cc1cccs1)c1ccccc1	ZINC000133743359	334052178	/nfs/dbraw/zinc/05/21/78/334052178.db2.gz	IOBOUTACRVBFOV-INIZCTEOSA-N	0	0	285.412	4.114	20	30		CIEDRN
C=CCC[C@@H](NC(=O)CCC1CC1)c1ccccc1	ZINC000133812120	334059426	/nfs/dbraw/zinc/05/94/26/334059426.db2.gz	VJSJVYPDVYBCMB-MRXNPFEDSA-N	0	0	257.377	4.000	20	30		CIEDRN
C=CCC(CC=C)c1nc(-c2ccc(C)c(OC)c2)no1	ZINC000546983611	334059685	/nfs/dbraw/zinc/05/96/85/334059685.db2.gz	IPPBZGMEQIYEMJ-UHFFFAOYSA-N	0	0	284.359	4.289	20	30		CIEDRN
CCc1ccccc1-c1noc(-c2ccc(CC#N)cc2)n1	ZINC000547021080	334062032	/nfs/dbraw/zinc/06/20/32/334062032.db2.gz	KMMIRBSELJWSLM-UHFFFAOYSA-N	0	0	289.338	4.032	20	30		CIEDRN
C=CCC(CC=C)c1nc(Cc2cccc(C)c2)no1	ZINC000547025088	334062628	/nfs/dbraw/zinc/06/26/28/334062628.db2.gz	ZUZKGIKRCXOFIT-UHFFFAOYSA-N	0	0	268.360	4.205	20	30		CIEDRN
C[C@H]1CCC[C@H](c2noc(-c3cccc(CC#N)c3)n2)C1	ZINC000547052026	334063987	/nfs/dbraw/zinc/06/39/87/334063987.db2.gz	CTGFYWPZTILYKK-JSGCOSHPSA-N	0	0	281.359	4.096	20	30		CIEDRN
C=CCCO[C@H](C)c1nc([C@H](C)c2ccc(C)cc2)no1	ZINC000547087442	334065978	/nfs/dbraw/zinc/06/59/78/334065978.db2.gz	BUQANBLRWLTACP-ZIAGYGMSSA-N	0	0	286.375	4.184	20	30		CIEDRN
Cc1cc(C)cc(-c2noc(C3(C#N)CCCCC3)n2)c1	ZINC000547098946	334066529	/nfs/dbraw/zinc/06/65/29/334066529.db2.gz	UFEQTUDXHPHLHG-UHFFFAOYSA-N	0	0	281.359	4.079	20	30		CIEDRN
Cc1cc(C#N)ccc1OCc1ccc(C(F)F)cc1	ZINC000547302071	334077235	/nfs/dbraw/zinc/07/72/35/334077235.db2.gz	GCVIHRXRCKOJKC-UHFFFAOYSA-N	0	0	273.282	4.383	20	30		CIEDRN
C=CCNC(=O)Nc1ccc(N[C@@H](C)c2ccccc2)cc1	ZINC000076316519	334078870	/nfs/dbraw/zinc/07/88/70/334078870.db2.gz	OXCVFZPTSZBOQX-AWEZNQCLSA-N	0	0	295.386	4.167	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CCCC[C@@H]1CCC	ZINC000547341261	334081398	/nfs/dbraw/zinc/08/13/98/334081398.db2.gz	GIJIYPFZTJLAIW-SOUVJXGZSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2nccc3ccccc32)no1	ZINC000547346387	334082019	/nfs/dbraw/zinc/08/20/19/334082019.db2.gz	LPOWTUVXNFBGHV-GFCCVEGCSA-N	0	0	279.343	4.355	20	30		CIEDRN
C=CCCCCNC(=O)Nc1ccc(OC(C)C)cc1C	ZINC000547448605	334089563	/nfs/dbraw/zinc/08/95/63/334089563.db2.gz	HZYOKJANQBXKCO-UHFFFAOYSA-N	0	0	290.407	4.260	20	30		CIEDRN
CCCC[C@H](CCC)NC(=O)N1CCC(CCC#N)CC1	ZINC000564322918	334094972	/nfs/dbraw/zinc/09/49/72/334094972.db2.gz	CNOHXFAAQWDOSS-INIZCTEOSA-N	0	0	293.455	4.071	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccc(C(C)C)cc1	ZINC000077179308	334097732	/nfs/dbraw/zinc/09/77/32/334097732.db2.gz	YEMZIHGKZZFQIY-UHFFFAOYSA-N	0	0	260.381	4.240	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1cccc2cc[nH]c21	ZINC000547526868	334098627	/nfs/dbraw/zinc/09/86/27/334098627.db2.gz	JAXDCKAJKHGILE-LBPRGKRZSA-N	0	0	271.364	4.034	20	30		CIEDRN
C=C[C@@H](CC(=O)NC(C)(CC)CC)c1ccccc1	ZINC000134681921	334100300	/nfs/dbraw/zinc/10/03/00/334100300.db2.gz	NHYCWXUCDMURDZ-AWEZNQCLSA-N	0	0	259.393	4.041	20	30		CIEDRN
C=CC[C@@H](C)Nc1ncc(C(F)(F)F)cc1Cl	ZINC000134715809	334101588	/nfs/dbraw/zinc/10/15/88/334101588.db2.gz	MMTVTASKIGRAJV-SSDOTTSWSA-N	0	0	264.678	4.130	20	30		CIEDRN
C=CCC[C@@H](C(=O)N(CC1CC1)C(C)C)c1ccccc1	ZINC000547630037	334104164	/nfs/dbraw/zinc/10/41/64/334104164.db2.gz	YINBESKRBPHCEA-GOSISDBHSA-N	0	0	285.431	4.383	20	30		CIEDRN
Cc1ccc(Br)c(NCCC(C)(C)C#N)c1	ZINC000134864518	334106229	/nfs/dbraw/zinc/10/62/29/334106229.db2.gz	UYZLKZLJHYAGPZ-UHFFFAOYSA-N	0	0	281.197	4.109	20	30		CIEDRN
CCC(=O)c1cccc(N[C@@H](C#N)C2CCCCC2)c1	ZINC000135067421	334114375	/nfs/dbraw/zinc/11/43/75/334114375.db2.gz	RULVPARSEUWHIL-INIZCTEOSA-N	0	0	270.376	4.164	20	30		CIEDRN
N#Cc1cnccc1Nc1ccc(Nc2ccccc2)cc1	ZINC000547828597	334123709	/nfs/dbraw/zinc/12/37/09/334123709.db2.gz	MRYDONYTBNIYLZ-UHFFFAOYSA-N	0	0	286.338	4.440	20	30		CIEDRN
C[C@H](Nc1ccc(C(F)(F)F)c(C#N)c1)c1ccccn1	ZINC000135306275	334124682	/nfs/dbraw/zinc/12/46/82/334124682.db2.gz	YOTDLKNNNBXFBH-JTQLQIEISA-N	0	0	291.276	4.145	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1coc(C2CCCCC2)n1	ZINC000547946957	334130458	/nfs/dbraw/zinc/13/04/58/334130458.db2.gz	VPPZTPCFZGRFKU-CYBMUJFWSA-N	0	0	290.407	4.197	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@H](C)c1cc2ccccc2o1	ZINC000135474211	334131145	/nfs/dbraw/zinc/13/11/45/334131145.db2.gz	KVMYGPKZSGEYGA-PXAZEXFGSA-N	0	0	271.360	4.212	20	30		CIEDRN
Fc1ccc(C#CCNc2cccc(C(F)F)c2)cc1	ZINC000135565318	334133543	/nfs/dbraw/zinc/13/35/43/334133543.db2.gz	SSULEDANLQJRKA-UHFFFAOYSA-N	0	0	275.273	4.227	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)N2[C@H](C)CC[C@@H]2C)c1	ZINC000135659134	334135389	/nfs/dbraw/zinc/13/53/89/334135389.db2.gz	UHKUGSLEZNKZLK-OKILXGFUSA-N	0	0	288.391	4.046	20	30		CIEDRN
CCCOc1ccccc1NCc1ccc(C#N)s1	ZINC000135692340	334136478	/nfs/dbraw/zinc/13/64/78/334136478.db2.gz	VRNQXGBQPGKLEU-UHFFFAOYSA-N	0	0	272.373	4.021	20	30		CIEDRN
N#Cc1cc(Cl)ccc1CNc1cccc2cc[nH]c21	ZINC000548140243	334142155	/nfs/dbraw/zinc/14/21/55/334142155.db2.gz	KOXLFUSFKFKTQG-UHFFFAOYSA-N	0	0	281.746	4.305	20	30		CIEDRN
Cc1cc(F)ccc1CSc1cccc(C#N)c1	ZINC000548147028	334142717	/nfs/dbraw/zinc/14/27/17/334142717.db2.gz	OOLMFDJOVQPSKO-UHFFFAOYSA-N	0	0	257.333	4.298	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N[C@H](C(C)(C)C)C(F)(F)F	ZINC000548183804	334145728	/nfs/dbraw/zinc/14/57/28/334145728.db2.gz	OWDSYMMNHIJKFI-WDEREUQCSA-N	0	0	294.361	4.007	20	30		CIEDRN
C[C@H](O)[C@H](C)SCc1ccc(-c2ccccc2C#N)cc1	ZINC000079046005	334146345	/nfs/dbraw/zinc/14/63/45/334146345.db2.gz	LZBHVWOGZSGMEX-KBPBESRZSA-N	0	0	297.423	4.228	20	30		CIEDRN
C[C@@H](O)[C@@H](C)SCc1ccc(-c2ccccc2C#N)cc1	ZINC000079045997	334146413	/nfs/dbraw/zinc/14/64/13/334146413.db2.gz	LZBHVWOGZSGMEX-ZIAGYGMSSA-N	0	0	297.423	4.228	20	30		CIEDRN
C=C[C@H](CC(=O)N1CCCCC[C@@H]1C)c1ccccc1	ZINC000548252266	334147120	/nfs/dbraw/zinc/14/71/20/334147120.db2.gz	CSQWXCDJBYNEJS-JKSUJKDBSA-N	0	0	271.404	4.137	20	30		CIEDRN
CC[C@@H]1CCCN(c2cc(C#N)c3ccccc3n2)CC1	ZINC000079343510	334152023	/nfs/dbraw/zinc/15/20/23/334152023.db2.gz	AHMCVCDJTKJDCG-CQSZACIVSA-N	0	0	279.387	4.123	20	30		CIEDRN
Cc1cccc(C)c1NC(=O)c1cccc(SCC#N)c1	ZINC000079382272	334153084	/nfs/dbraw/zinc/15/30/84/334153084.db2.gz	HVDNGUCUIKXYNC-UHFFFAOYSA-N	0	0	296.395	4.171	20	30		CIEDRN
N#CCCCCN1CCCSc2ccc(Cl)cc21	ZINC000079503503	334155962	/nfs/dbraw/zinc/15/59/62/334155962.db2.gz	YJEHOMKOLNHCIC-UHFFFAOYSA-N	0	0	280.824	4.336	20	30		CIEDRN
C=CCCC(=O)N1CCCSc2ccc(Cl)cc21	ZINC000079721298	334160965	/nfs/dbraw/zinc/16/09/65/334160965.db2.gz	IZZNAXTXCRFWDW-UHFFFAOYSA-N	0	0	281.808	4.135	20	30		CIEDRN
C=CCC[C@H](C(=O)NCC(C1CC1)C1CC1)c1ccccc1	ZINC000548617797	334163889	/nfs/dbraw/zinc/16/38/89/334163889.db2.gz	PJRIZGCDEOGXDH-SFHVURJKSA-N	0	0	297.442	4.289	20	30		CIEDRN
C[C@H](CCc1ccc(F)cc1)Nc1ccc(CC#N)cc1	ZINC000136953382	334165863	/nfs/dbraw/zinc/16/58/63/334165863.db2.gz	GOJNMLIXFKQRCG-CQSZACIVSA-N	0	0	282.362	4.325	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)Cc1cccc(C)c1	ZINC000548772084	334173542	/nfs/dbraw/zinc/17/35/42/334173542.db2.gz	OLPNOFVOHNHTJV-UHFFFAOYSA-N	0	0	279.383	4.295	20	30		CIEDRN
Cc1cc(NC(=O)Cc2cccc(C#N)c2)cc(C)c1Cl	ZINC000548908098	334179907	/nfs/dbraw/zinc/17/99/07/334179907.db2.gz	YORMSSLXTLVWSZ-UHFFFAOYSA-N	0	0	298.773	4.010	20	30		CIEDRN
C[C@@H]1C[C@@H](CCNc2ccc(C#N)c(Cl)c2)C[C@H](C)O1	ZINC000548987933	334182048	/nfs/dbraw/zinc/18/20/48/334182048.db2.gz	VZLOYJBEPQMBNK-CLLJXQQHSA-N	0	0	292.810	4.217	20	30		CIEDRN
C=CCCC(=O)N1CCCC[C@@H]1c1cccc(C)c1C	ZINC000081323378	334185268	/nfs/dbraw/zinc/18/52/68/334185268.db2.gz	VPXZIPMFILAPDD-QGZVFWFLSA-N	0	0	271.404	4.323	20	30		CIEDRN
C[C@@H]1CC(CCNc2ccc(Cl)cc2C#N)C[C@@H](C)O1	ZINC000549259861	334188906	/nfs/dbraw/zinc/18/89/06/334188906.db2.gz	PKQIVERPYCUDFT-VXGBXAGGSA-N	0	0	292.810	4.217	20	30		CIEDRN
CCc1nc(C(C)C)ccc1COc1ccc(C#N)cc1	ZINC000549300701	334189691	/nfs/dbraw/zinc/18/96/91/334189691.db2.gz	VTTMWXRCHGLPQC-UHFFFAOYSA-N	0	0	280.371	4.218	20	30		CIEDRN
COC1(CCSc2ccc(C#N)cc2Cl)CCC1	ZINC000549374040	334191634	/nfs/dbraw/zinc/19/16/34/334191634.db2.gz	HGCLQSJIIWJQNE-UHFFFAOYSA-N	0	0	281.808	4.263	20	30		CIEDRN
N#CCCN(Cc1ccco1)Cc1csc2ccccc12	ZINC000081518102	334193901	/nfs/dbraw/zinc/19/39/01/334193901.db2.gz	XHLXNLRSQTZVBY-UHFFFAOYSA-N	0	0	296.395	4.410	20	30		CIEDRN
C=CCCSCc1cc(C#N)ccc1Br	ZINC000549555643	334197777	/nfs/dbraw/zinc/19/77/77/334197777.db2.gz	GDKJMCIKIHEHFG-UHFFFAOYSA-N	0	0	282.206	4.130	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)N1[C@H](C)C[C@@H]2CCCC[C@H]21	ZINC000245681225	334211865	/nfs/dbraw/zinc/21/18/65/334211865.db2.gz	KPAZNEIXHKJMOD-HACGYAERSA-N	0	0	297.402	4.052	20	30		CIEDRN
CCCC[C@@H](CC)CC(=O)Nc1ccccc1CC#N	ZINC000550099961	334212944	/nfs/dbraw/zinc/21/29/44/334212944.db2.gz	GHBJPZRWONAWAW-CQSZACIVSA-N	0	0	272.392	4.298	20	30		CIEDRN
CCCC[C@H](CC)CC(=O)Nc1ccccc1CC#N	ZINC000550099960	334212996	/nfs/dbraw/zinc/21/29/96/334212996.db2.gz	GHBJPZRWONAWAW-AWEZNQCLSA-N	0	0	272.392	4.298	20	30		CIEDRN
CCN(C[C@@H](C)C#N)[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000245752207	334217511	/nfs/dbraw/zinc/21/75/11/334217511.db2.gz	GWUQVXFUOVRJDJ-NWDGAFQWSA-N	0	0	284.325	4.248	20	30		CIEDRN
CC[C@H](CC(=O)N[C@](C)(C#N)C1CCCCC1)C(C)C	ZINC000550351465	334220782	/nfs/dbraw/zinc/22/07/82/334220782.db2.gz	LLCVIFXHSGXLMT-RHSMWYFYSA-N	0	0	278.440	4.037	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)[C@]2(C)C[C@H]3C[C@H]3C2)c1	ZINC000550545174	334224231	/nfs/dbraw/zinc/22/42/31/334224231.db2.gz	JKGCLYZNBLVVTA-ZSBFGKGUSA-N	0	0	285.387	4.016	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc(CCSC)cc1	ZINC000550594143	334224876	/nfs/dbraw/zinc/22/48/76/334224876.db2.gz	XMYNHTQGGKASMS-UHFFFAOYSA-N	0	0	277.433	4.133	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cc(C(F)(F)F)ccc1F	ZINC000550632953	334225598	/nfs/dbraw/zinc/22/55/98/334225598.db2.gz	QMECROMJFIFTJG-UHFFFAOYSA-N	0	0	289.272	4.385	20	30		CIEDRN
C[C@@](C#N)(NC(=O)c1coc2ccccc21)C1CCCCC1	ZINC000550747285	334228211	/nfs/dbraw/zinc/22/82/11/334228211.db2.gz	BICDIPGMMMUAQF-SFHVURJKSA-N	0	0	296.370	4.025	20	30		CIEDRN
C=CCC(C)(C)c1noc(Cc2c(C)[nH]c3ccccc32)n1	ZINC000551140306	334239414	/nfs/dbraw/zinc/23/94/14/334239414.db2.gz	RHWWVTGPEIGRMP-UHFFFAOYSA-N	0	0	295.386	4.304	20	30		CIEDRN
C=CCC(C)(C)c1noc(C[C@@H](C)c2cccc(F)c2)n1	ZINC000551140040	334239442	/nfs/dbraw/zinc/23/94/42/334239442.db2.gz	MDZASMCDAJHOAC-GFCCVEGCSA-N	0	0	288.366	4.409	20	30		CIEDRN
C=CCC(C)(C)c1noc(CCSc2ccccc2)n1	ZINC000551141853	334239494	/nfs/dbraw/zinc/23/94/94/334239494.db2.gz	BAHAWXFMCQOLGU-UHFFFAOYSA-N	0	0	288.416	4.258	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCc1ccc2ccccc2c1	ZINC000551222175	334241460	/nfs/dbraw/zinc/24/14/60/334241460.db2.gz	VACBCHFFXGXGIN-UHFFFAOYSA-N	0	0	267.372	4.058	20	30		CIEDRN
CCC(CC)[C@H](C)C(=O)N[C@@](C)(C#N)C1CCCCC1	ZINC000551305111	334244840	/nfs/dbraw/zinc/24/48/40/334244840.db2.gz	AYLBZJKYXSHLND-GUYCJALGSA-N	0	0	278.440	4.037	20	30		CIEDRN
N#Cc1ccc(CSCCCCCF)c(F)c1	ZINC000551372604	334248022	/nfs/dbraw/zinc/24/80/22/334248022.db2.gz	FJFCWBKELPUIDG-UHFFFAOYSA-N	0	0	255.333	4.070	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2coc3ccccc23)n1	ZINC000551497769	334251749	/nfs/dbraw/zinc/25/17/49/334251749.db2.gz	XGZXQZQGILTBCR-UHFFFAOYSA-N	0	0	268.316	4.337	20	30		CIEDRN
C=C(C)[C@H]1OCC[C@H]1c1nc([C@@H]2CCCC[C@@H]2CC)no1	ZINC000551534537	334253349	/nfs/dbraw/zinc/25/33/49/334253349.db2.gz	NNYHONKRTBBCQM-GBJTYRQASA-N	0	0	290.407	4.202	20	30		CIEDRN
CC[C@H]1CCCC[C@@H]1c1noc(Cc2cccc(C#N)c2)n1	ZINC000551535389	334253419	/nfs/dbraw/zinc/25/34/19/334253419.db2.gz	XYCGTMWAVJPGIC-HOTGVXAUSA-N	0	0	295.386	4.216	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CCC(CCC(C)C)CC1	ZINC000551604972	334255808	/nfs/dbraw/zinc/25/58/08/334255808.db2.gz	WGPKDMDXKFAXHC-UHFFFAOYSA-N	0	0	265.441	4.264	20	30		CIEDRN
C=CC[C@H](C)NC(=O)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1	ZINC000246677036	334266829	/nfs/dbraw/zinc/26/68/29/334266829.db2.gz	IJKQNPIHYYZOON-HERUPUMHSA-N	0	0	298.213	4.178	20	30		CIEDRN
CC(C)c1cccc(C(C)C)c1NC(=O)NC[C@@H](C)C#N	ZINC000084907439	334279115	/nfs/dbraw/zinc/27/91/15/334279115.db2.gz	VJCKHKULFCHRPC-ZDUSSCGKSA-N	0	0	287.407	4.215	20	30		CIEDRN
N#Cc1ccc(Oc2ccc(C(F)(F)F)cn2)c(Cl)c1	ZINC000141499396	334301206	/nfs/dbraw/zinc/30/12/06/334301206.db2.gz	CWOZINXILUAJGM-UHFFFAOYSA-N	0	0	298.651	4.418	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cc(C)c(OC)cc1Cl	ZINC000552272203	334310581	/nfs/dbraw/zinc/31/05/81/334310581.db2.gz	HBPLRFXPZVDAJM-UHFFFAOYSA-N	0	0	281.783	4.198	20	30		CIEDRN
CCc1ccc(NC(=O)c2cscc2C#N)cc1Cl	ZINC000552373236	334321354	/nfs/dbraw/zinc/32/13/54/334321354.db2.gz	RJDLCIFZQFSECL-UHFFFAOYSA-N	0	0	290.775	4.088	20	30		CIEDRN
CCN(C(=O)[C@@H]1C[C@]1(C)C(C)C)[C@@H](C)c1ccc(C#N)cc1	ZINC000249399198	334333299	/nfs/dbraw/zinc/33/32/99/334333299.db2.gz	BSDFMBLUHUIIBY-UCLAIMLFSA-N	0	0	298.430	4.150	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)N[C@@H]1CC(C)(C)CCc2ccccc21	ZINC000552592685	334338397	/nfs/dbraw/zinc/33/83/97/334338397.db2.gz	RHFQMNDLCCGDAG-APWZRJJASA-N	0	0	298.430	4.146	20	30		CIEDRN
Cc1ccc2oc(SCc3cccc(C#N)c3F)nc2c1	ZINC000552832013	334346933	/nfs/dbraw/zinc/34/69/33/334346933.db2.gz	LKBUQXSWIAJPST-UHFFFAOYSA-N	0	0	298.342	4.439	20	30		CIEDRN
Cc1nsc(N2C[C@@H](c3ccccc3C)C[C@@H]2C)c1C#N	ZINC000553102316	334361554	/nfs/dbraw/zinc/36/15/54/334361554.db2.gz	KIKJKISWTRYRDF-JSGCOSHPSA-N	0	0	297.427	4.014	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N([C@@H](C)c1ccccc1)C1CC1	ZINC000553139281	334364338	/nfs/dbraw/zinc/36/43/38/334364338.db2.gz	IHKRDICCRLGMFB-CABCVRRESA-N	0	0	271.404	4.341	20	30		CIEDRN
C[C@@H](NC(=O)CCCCC(C)(C)C)c1ccc(C#N)cc1	ZINC000553144405	334364639	/nfs/dbraw/zinc/36/46/39/334364639.db2.gz	SAGPRZMYHNQUOB-CQSZACIVSA-N	0	0	286.419	4.342	20	30		CIEDRN
C[C@@H]1CCN(c2nccc(C#N)c2Cl)[C@@H]2CCCC[C@@H]12	ZINC000553152221	334365366	/nfs/dbraw/zinc/36/53/66/334365366.db2.gz	GNDIAPAVAHOJHC-KWCYVHTRSA-N	0	0	289.810	4.012	20	30		CIEDRN
CCC[C@H]1[C@@H](C)CCCN1c1nccc(C#N)c1Cl	ZINC000553154892	334365572	/nfs/dbraw/zinc/36/55/72/334365572.db2.gz	SMAGKCWIHOIUID-AAEUAGOBSA-N	0	0	277.799	4.012	20	30		CIEDRN
CC(C)[C@@H](C)C(=O)Nc1cc(C(C)(C)C)sc1C#N	ZINC000091208313	334373529	/nfs/dbraw/zinc/37/35/29/334373529.db2.gz	JUQJYWPTDOHZOW-SNVBAGLBSA-N	0	0	278.421	4.148	20	30		CIEDRN
Cc1cc(NCc2ccc3ccccc3c2)cc(C#N)n1	ZINC000553317861	334377183	/nfs/dbraw/zinc/37/71/83/334377183.db2.gz	PYSYDFRSPUPUHP-UHFFFAOYSA-N	0	0	273.339	4.027	20	30		CIEDRN
CSCc1ccc(CNc2ccc(C#N)cc2F)cc1	ZINC000553389086	334381930	/nfs/dbraw/zinc/38/19/30/334381930.db2.gz	WPEHJZAGOSVHSE-UHFFFAOYSA-N	0	0	286.375	4.172	20	30		CIEDRN
C[C@@H]1CCC[C@H](Nc2nc(C(F)(F)F)ccc2C#N)[C@H]1C	ZINC000252674861	334385245	/nfs/dbraw/zinc/38/52/45/334385245.db2.gz	UXJNRGKTTWXWPX-SCVCMEIPSA-N	0	0	297.324	4.209	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H]1CCCc2sc(Cl)cc21	ZINC000553490763	334388080	/nfs/dbraw/zinc/38/80/80/334388080.db2.gz	QKPAMBUYHFTIAY-XHDPSFHLSA-N	0	0	297.851	4.497	20	30		CIEDRN
C=CCCCC(=O)N1C[C@H](C)CC[C@H]1c1ccccc1	ZINC000553510022	334389152	/nfs/dbraw/zinc/38/91/52/334389152.db2.gz	ORZSELNFKCSGKC-WBVHZDCISA-N	0	0	271.404	4.343	20	30		CIEDRN
N#Cc1cccnc1NCCCCc1ccc(Cl)s1	ZINC000553588677	334392879	/nfs/dbraw/zinc/39/28/79/334392879.db2.gz	ABRDTNFSWBZYOV-UHFFFAOYSA-N	0	0	291.807	4.103	20	30		CIEDRN
N#Cc1c(F)cccc1N1CC[C@H]1c1ccc(Cl)cc1	ZINC000553604787	334393159	/nfs/dbraw/zinc/39/31/59/334393159.db2.gz	YZDCEADXIWQGBE-HNNXBMFYSA-N	0	0	286.737	4.302	20	30		CIEDRN
C=CCNc1cccc(OCc2cccc(F)c2)c1	ZINC000553803626	334399478	/nfs/dbraw/zinc/39/94/78/334399478.db2.gz	CAIHSLNYOZWEQW-UHFFFAOYSA-N	0	0	257.308	4.003	20	30		CIEDRN
CCc1ccc([C@@H](C#N)NC(=O)[C@H](C)CC(C)(C)C)cc1	ZINC000554790403	334452626	/nfs/dbraw/zinc/45/26/26/334452626.db2.gz	RAJKFGHDGLJSAH-CZUORRHYSA-N	0	0	286.419	4.002	20	30		CIEDRN
N#Cc1csc(/C=C\c2ccc3ccc(Cl)cc3n2)n1	ZINC000555123537	334469081	/nfs/dbraw/zinc/46/90/81/334469081.db2.gz	LJQAMOOSNMASTL-WAYWQWQTSA-N	0	0	297.770	4.387	20	30		CIEDRN
Cc1ccc2ncc(C#N)c(N3CC[C@H](CC4CC4)C3)c2c1	ZINC000555247725	334472996	/nfs/dbraw/zinc/47/29/96/334472996.db2.gz	HPAYEOUBJVUOMB-OAHLLOKOSA-N	0	0	291.398	4.041	20	30		CIEDRN
Cc1cccc([C@H](C)C(=O)N[C@](C)(C#N)C2CCCCC2)c1	ZINC000555902371	334491739	/nfs/dbraw/zinc/49/17/39/334491739.db2.gz	DRWNJCBMBXDWML-HNAYVOBHSA-N	0	0	298.430	4.077	20	30		CIEDRN
CC(C)(c1noc(-c2ccc(C#N)cc2)n1)C1=CCCCC1	ZINC000556016245	334493192	/nfs/dbraw/zinc/49/31/92/334493192.db2.gz	MVOWMAVFGGNOET-UHFFFAOYSA-N	0	0	293.370	4.386	20	30		CIEDRN
C=CCC(F)(F)c1nc([C@H]2CCCC[C@@H]2C)no1	ZINC000556292200	334507037	/nfs/dbraw/zinc/50/70/37/334507037.db2.gz	IKBHFBXKPVDPIR-UWVGGRQHSA-N	0	0	256.296	4.031	20	30		CIEDRN
N#CCC[C@H](C#N)COc1ccccc1-c1ccccc1	ZINC000152695027	334509026	/nfs/dbraw/zinc/50/90/26/334509026.db2.gz	DQQZQVJKBMCNAA-OAHLLOKOSA-N	0	0	276.339	4.176	20	30		CIEDRN
CCC[C@H](C#N)NC(=O)c1ccc(C(C)(C)C)c(Cl)c1	ZINC000564697194	334516886	/nfs/dbraw/zinc/51/68/86/334516886.db2.gz	VPSVYXKOGVOJFK-GFCCVEGCSA-N	0	0	292.810	4.060	20	30		CIEDRN
N#CCC[C@H](C#N)COc1ccc(Oc2ccccc2)cc1	ZINC000152849353	334519090	/nfs/dbraw/zinc/51/90/90/334519090.db2.gz	IRFBJULEXSVMIK-OAHLLOKOSA-N	0	0	292.338	4.301	20	30		CIEDRN
C=C(C)CCc1noc([C@H]2C[C@H]2c2ccc(F)cc2F)n1	ZINC000565389675	334558744	/nfs/dbraw/zinc/55/87/44/334558744.db2.gz	FZUPLJRNILNVNV-STQMWFEESA-N	0	0	290.313	4.128	20	30		CIEDRN
CC(C)(C)c1ccc(C(=O)Nc2ccccc2C#N)s1	ZINC000153209002	334570617	/nfs/dbraw/zinc/57/06/17/334570617.db2.gz	FRNNEGCFLYDYOL-UHFFFAOYSA-N	0	0	284.384	4.170	20	30		CIEDRN
CC(C)COc1cccc(NCCCC(C)(C)C#N)c1	ZINC000153400394	334597858	/nfs/dbraw/zinc/59/78/58/334597858.db2.gz	DAAPVIQNLVKHAV-UHFFFAOYSA-N	0	0	274.408	4.463	20	30		CIEDRN
C=CCCC(=O)N[C@@](C)(Cc1ccc(Cl)cc1)C(C)C	ZINC000565854760	334603409	/nfs/dbraw/zinc/60/34/09/334603409.db2.gz	FKCPYWWIKAKWTM-KRWDZBQOSA-N	0	0	293.838	4.380	20	30		CIEDRN
CC(C)=CCC[C@H](C)CC(=O)NCc1ccc(CC#N)cc1	ZINC000565895148	334607050	/nfs/dbraw/zinc/60/70/50/334607050.db2.gz	RYPAMVAXILGOKA-INIZCTEOSA-N	0	0	298.430	4.141	20	30		CIEDRN
CCc1cccc(C)c1NC(=O)c1ccc(C#N)c(Cl)c1	ZINC000153479558	334607887	/nfs/dbraw/zinc/60/78/87/334607887.db2.gz	MVIANOTWCSFCBH-UHFFFAOYSA-N	0	0	298.773	4.335	20	30		CIEDRN
C=CCCCCCNC(=O)c1cnn(C(CC)CC)c1C	ZINC000566019774	334616963	/nfs/dbraw/zinc/61/69/63/334616963.db2.gz	RTAVTOZGFIFHEK-UHFFFAOYSA-N	0	0	291.439	4.029	20	30		CIEDRN
C=CCCCCCNC(=O)Nc1cccc2[nH]ccc21	ZINC000566423349	334647548	/nfs/dbraw/zinc/64/75/48/334647548.db2.gz	LKAVDVJHVGXFJZ-UHFFFAOYSA-N	0	0	271.364	4.036	20	30		CIEDRN
CC[C@@H](C)CNc1ccc(Oc2ccnc(C#N)c2)cc1	ZINC000566827525	334665905	/nfs/dbraw/zinc/66/59/05/334665905.db2.gz	YYXVYFHPKQJJJW-CYBMUJFWSA-N	0	0	281.359	4.204	20	30		CIEDRN
C=CCNC(=O)Nc1ccc(Oc2ccc(C)cc2)cc1	ZINC000566987444	334672219	/nfs/dbraw/zinc/67/22/19/334672219.db2.gz	WDKHNTOWLGPJIY-UHFFFAOYSA-N	0	0	282.343	4.095	20	30		CIEDRN
CC1(C)CCCN(Cc2cc3cc(F)ccc3o2)[C@H]1C#N	ZINC000567013481	334672995	/nfs/dbraw/zinc/67/29/95/334672995.db2.gz	GINRPBWTLNLNFD-INIZCTEOSA-N	0	0	286.350	4.086	20	30		CIEDRN
CC(C)c1ccc(NC(=O)N2CCC(CCC#N)CC2)cc1	ZINC000567164710	334686488	/nfs/dbraw/zinc/68/64/88/334686488.db2.gz	VXRJWDYQYYMXBL-UHFFFAOYSA-N	0	0	299.418	4.358	20	30		CIEDRN
CC(C)=CCC[C@H](C)CC(=O)Nc1sccc1C#N	ZINC000567353684	334707630	/nfs/dbraw/zinc/70/76/30/334707630.db2.gz	FZUODFZPURSXJY-LBPRGKRZSA-N	0	0	276.405	4.331	20	30		CIEDRN
C=CCCO[C@@H](C)c1nc(Cc2cc3ccccc3o2)no1	ZINC000567373995	334710231	/nfs/dbraw/zinc/71/02/31/334710231.db2.gz	GAVFGNPGZTXUPH-LBPRGKRZSA-N	0	0	298.342	4.060	20	30		CIEDRN
C=CCN(C)C(=O)N[C@H](c1ccc(Cl)cc1F)C(C)C	ZINC000155868816	334730825	/nfs/dbraw/zinc/73/08/25/334730825.db2.gz	CZROFIUXOCCMRM-AWEZNQCLSA-N	0	0	298.789	4.004	20	30		CIEDRN
C=CCn1c(C)nnc1SCC[C@@H]1CCC[C@H](C)C1	ZINC000567595169	334738324	/nfs/dbraw/zinc/73/83/24/334738324.db2.gz	VXIXMMUULQAAOM-JSGCOSHPSA-N	0	0	279.453	4.081	20	30		CIEDRN
N#CCCC[C@@H](NC(=O)C1CC2(CCC2)C1)c1ccccc1	ZINC000567615027	334740685	/nfs/dbraw/zinc/74/06/85/334740685.db2.gz	KWQYYAGSMZCSDC-QGZVFWFLSA-N	0	0	296.414	4.118	20	30		CIEDRN
C=C(C)CNC(=O)N(CC1CCC1)[C@@H](C)c1ccccc1	ZINC000156448555	334742628	/nfs/dbraw/zinc/74/26/28/334742628.db2.gz	FUQRLDZBZUEQHB-HNNXBMFYSA-N	0	0	286.419	4.135	20	30		CIEDRN
N#CC1(C(=O)Nc2cccc(-c3cccs3)c2)CCCC1	ZINC000156627907	334745578	/nfs/dbraw/zinc/74/55/78/334745578.db2.gz	NSESRLNCYIFQEH-UHFFFAOYSA-N	0	0	296.395	4.438	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1occc1-c1ccc(F)cc1	ZINC000157175548	334762280	/nfs/dbraw/zinc/76/22/80/334762280.db2.gz	HHQFSHRQIMWDAK-UHFFFAOYSA-N	0	0	287.334	4.124	20	30		CIEDRN
N#Cc1cccc(SCc2cn3cc(Cl)ccc3n2)c1	ZINC000158651877	334808962	/nfs/dbraw/zinc/80/89/62/334808962.db2.gz	IZBBGRWGANLBQI-UHFFFAOYSA-N	0	0	299.786	4.152	20	30		CIEDRN
C=CCCC1(C(=O)N(C)[C@@H]2CCCc3ccccc32)CC1	ZINC000568462548	334825874	/nfs/dbraw/zinc/82/58/74/334825874.db2.gz	GKIZCPPGBUXRCG-QGZVFWFLSA-N	0	0	283.415	4.269	20	30		CIEDRN
C/C=C\c1ccc(NCc2ccc(C#N)cc2F)cc1	ZINC000568557590	334830291	/nfs/dbraw/zinc/83/02/91/334830291.db2.gz	ULCKQKVDQFDRPF-IHWYPQMZSA-N	0	0	266.319	4.343	20	30		CIEDRN
CC#CCCCc1nc(Cc2cccc3ccccc32)no1	ZINC000568798086	334841354	/nfs/dbraw/zinc/84/13/54/334841354.db2.gz	SPCUFBUEQWZBLE-UHFFFAOYSA-N	0	0	290.366	4.160	20	30		CIEDRN
C=CCN(CC=C)Cc1csc(Nc2ccc(C)cc2)n1	ZINC000569219184	334861783	/nfs/dbraw/zinc/86/17/83/334861783.db2.gz	WYTXFMDTCSQGQB-UHFFFAOYSA-N	0	0	299.443	4.369	20	30		CIEDRN
C=CCCC1(c2nc(-c3ccc(C)cc3)no2)CC1	ZINC000572760747	334876248	/nfs/dbraw/zinc/87/62/48/334876248.db2.gz	YTKHJOSHMRYTSQ-UHFFFAOYSA-N	0	0	254.333	4.043	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)C[C@@H]1CC[C@@H](C)C1	ZINC000165100879	334891966	/nfs/dbraw/zinc/89/19/66/334891966.db2.gz	IMCBROYHSBAPDK-ZIAGYGMSSA-N	0	0	277.433	4.089	20	30		CIEDRN
CC(C)(C)c1cc(C#N)c(NC(=O)[C@@]23C[C@@H]2CCC3)s1	ZINC000573234189	334920038	/nfs/dbraw/zinc/92/00/38/334920038.db2.gz	KSBFRVRKWMXILD-ZBEGNZNMSA-N	0	0	288.416	4.046	20	30		CIEDRN
N#Cc1c(NCCc2cccc(F)c2)cccc1C(F)F	ZINC000573255870	334922220	/nfs/dbraw/zinc/92/22/20/334922220.db2.gz	NYGRXGWFBFKTLW-UHFFFAOYSA-N	0	0	290.288	4.290	20	30		CIEDRN
C=C(C)[C@H]1OCC[C@H]1c1nc([C@H]2CCCC(C)(C)C2)no1	ZINC000576312944	335188297	/nfs/dbraw/zinc/18/82/97/335188297.db2.gz	ONAKPVFGMBBKFL-BFHYXJOUSA-N	0	0	290.407	4.202	20	30		CIEDRN
CC1(C)CC[C@@H](Nc2cc(C#N)ccn2)c2ccccc21	ZINC000576364209	335195316	/nfs/dbraw/zinc/19/53/16/335195316.db2.gz	KDFNXUNMIPCUAE-MRXNPFEDSA-N	0	0	277.371	4.178	20	30		CIEDRN
N#C[C@H](C(=O)c1ccc(C2CCCC2)cc1)c1ccccn1	ZINC000576509376	335212564	/nfs/dbraw/zinc/21/25/64/335212564.db2.gz	AZKOAYMCOASAEL-KRWDZBQOSA-N	0	0	290.366	4.229	20	30		CIEDRN
C[C@H](Sc1cccc(F)c1C#N)C(=O)c1ccccc1	ZINC000576539891	335216851	/nfs/dbraw/zinc/21/68/51/335216851.db2.gz	JFJFZGKSRFWACP-NSHDSACASA-N	0	0	285.343	4.061	20	30		CIEDRN
C=C(C)CCSCC/C=C/c1cncc(OC)c1	ZINC000576637134	335229040	/nfs/dbraw/zinc/22/90/40/335229040.db2.gz	POEMGSJEDNBDKW-GQCTYLIASA-N	0	0	263.406	4.193	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(-c2ccc(C(C)C)nc2)no1	ZINC000576671003	335232850	/nfs/dbraw/zinc/23/28/50/335232850.db2.gz	PQOPTKSERLXZCC-INIZCTEOSA-N	0	0	271.364	4.109	20	30		CIEDRN
N#Cc1ccccc1SC[C@@H]1CCC2(CCCC2)O1	ZINC000576683840	335234326	/nfs/dbraw/zinc/23/43/26/335234326.db2.gz	GHCBWTVMIWEMJR-AWEZNQCLSA-N	0	0	273.401	4.142	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@H](C(C)(C)C)C[C@H]2C)CCC1	ZINC000576763499	335244931	/nfs/dbraw/zinc/24/49/31/335244931.db2.gz	UMLVGUDIZCBTCJ-CABCVRRESA-N	0	0	277.452	4.406	20	30		CIEDRN
Cc1ccsc1CN(C)c1ccc2cc(C#N)ccc2n1	ZINC000576770650	335246377	/nfs/dbraw/zinc/24/63/77/335246377.db2.gz	VELUHGLXNSJDBY-UHFFFAOYSA-N	0	0	293.395	4.113	20	30		CIEDRN
CC(C)(C#N)CCCSc1cccc(F)c1C#N	ZINC000576811924	335250232	/nfs/dbraw/zinc/25/02/32/335250232.db2.gz	JOJWZJHXXMTWEE-UHFFFAOYSA-N	0	0	262.353	4.119	20	30		CIEDRN
C[C@@H]1C[C@@H](CC(=O)Nc2ccccc2C#N)CC(C)(C)C1	ZINC000576890964	335261445	/nfs/dbraw/zinc/26/14/45/335261445.db2.gz	HNSJBBAVAFHXSO-KGLIPLIRSA-N	0	0	284.403	4.349	20	30		CIEDRN
C=C(C)CN(CC)C(=O)CCCc1ccc(SC)cc1	ZINC000577062871	335293937	/nfs/dbraw/zinc/29/39/37/335293937.db2.gz	BTDKQKPLTSSQLF-UHFFFAOYSA-N	0	0	291.460	4.156	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2coc3cc(F)ccc32)n1	ZINC000577088199	335297988	/nfs/dbraw/zinc/29/79/88/335297988.db2.gz	XJRQECROVJLIMP-UHFFFAOYSA-N	0	0	286.306	4.476	20	30		CIEDRN
C=CCCCC(=O)Nc1ncc(-c2ccccc2F)s1	ZINC000577127272	335305703	/nfs/dbraw/zinc/30/57/03/335305703.db2.gz	RJQLDQFPJQEDGN-UHFFFAOYSA-N	0	0	290.363	4.244	20	30		CIEDRN
N#Cc1ccc(-c2nc(-c3ccccc3F)no2)cc1Cl	ZINC000577300271	335336957	/nfs/dbraw/zinc/33/69/57/335336957.db2.gz	HNDKGMOFYHAGBP-UHFFFAOYSA-N	0	0	299.692	4.068	20	30		CIEDRN
CC(C)(C#N)CCSCc1ccc(F)c(F)c1	ZINC000577404686	335349329	/nfs/dbraw/zinc/34/93/29/335349329.db2.gz	CQEQFVVVWGPHGD-UHFFFAOYSA-N	0	0	255.333	4.138	20	30		CIEDRN
CCCC[C@@H](C)N(CCCC)C(=O)CC(C)(C)C#N	ZINC000577409800	335350053	/nfs/dbraw/zinc/35/00/53/335350053.db2.gz	JCHKNKDMYVCZJR-CQSZACIVSA-N	0	0	266.429	4.134	20	30		CIEDRN
N#Cc1ccc(CC(=O)Nc2cccc(C3CCC3)c2)cc1	ZINC000577553018	335367967	/nfs/dbraw/zinc/36/79/67/335367967.db2.gz	IZZQMOJULDJKES-UHFFFAOYSA-N	0	0	290.366	4.007	20	30		CIEDRN
CC(C)CCOc1cccc(NCc2ccc(C#N)o2)c1	ZINC000177556531	335374406	/nfs/dbraw/zinc/37/44/06/335374406.db2.gz	KCWMPQBNHNPELJ-UHFFFAOYSA-N	0	0	284.359	4.188	20	30		CIEDRN
CC(C)(C#N)CCSCCOc1ccc(Cl)cc1	ZINC000577654313	335386455	/nfs/dbraw/zinc/38/64/55/335386455.db2.gz	SNQJXSYVBAFADF-UHFFFAOYSA-N	0	0	283.824	4.392	20	30		CIEDRN
C[C@@H](Oc1ccc(C#N)cc1)c1ncc(-c2ccccc2)o1	ZINC000178301431	335425226	/nfs/dbraw/zinc/42/52/26/335425226.db2.gz	KYOWMJKZHYWMJD-CYBMUJFWSA-N	0	0	290.322	4.353	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)c1cccc(C(F)F)c1	ZINC000178376465	335428084	/nfs/dbraw/zinc/42/80/84/335428084.db2.gz	QAMKUUVAFXCQEL-UHFFFAOYSA-N	0	0	286.281	4.057	20	30		CIEDRN
CC(C)CCCS[C@H](C)C(=O)Nc1ccccc1C#N	ZINC000180101011	335550591	/nfs/dbraw/zinc/55/05/91/335550591.db2.gz	UVDCIPALLFSXMS-CYBMUJFWSA-N	0	0	290.432	4.055	20	30		CIEDRN
CC(C)Cc1ccc([C@@H](C)NCc2nc(C#N)cs2)cc1	ZINC000352827234	335631829	/nfs/dbraw/zinc/63/18/29/335631829.db2.gz	XVNIXUVWBDESGI-CYBMUJFWSA-N	0	0	299.443	4.064	20	30		CIEDRN
C=CCCCC[C@@H](C)Nc1cccc2c1CCN2C(C)=O	ZINC000578483484	335639770	/nfs/dbraw/zinc/63/97/70/335639770.db2.gz	IHPHCZNMDAXCBB-CQSZACIVSA-N	0	0	286.419	4.142	20	30		CIEDRN
Cc1cc(C#N)nc(S[C@H](C)c2ccc(Cl)cc2)n1	ZINC000578657181	335660492	/nfs/dbraw/zinc/66/04/92/335660492.db2.gz	YHHMGPWIOIPYMJ-SNVBAGLBSA-N	0	0	289.791	4.163	20	30		CIEDRN
C=CCCCNc1ccc(Oc2cccnc2)cc1	ZINC000578734905	335667688	/nfs/dbraw/zinc/66/76/88/335667688.db2.gz	UJYBYPXZTOCTDV-UHFFFAOYSA-N	0	0	254.333	4.252	20	30		CIEDRN
N#Cc1ccc(CSc2ccc(F)c(Cl)c2)nc1	ZINC000578956282	335692856	/nfs/dbraw/zinc/69/28/56/335692856.db2.gz	WBVSAUPDEKUSHV-UHFFFAOYSA-N	0	0	278.739	4.038	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N(C)[C@@H](C)c1ccccc1F	ZINC000181378321	335759516	/nfs/dbraw/zinc/75/95/16/335759516.db2.gz	NCQRULBOSCLTDS-KBPBESRZSA-N	0	0	292.398	4.273	20	30		CIEDRN
C[C@H](CCCc1ccccc1)C(=O)Nc1ccccc1C#N	ZINC000182231921	335805159	/nfs/dbraw/zinc/80/51/59/335805159.db2.gz	BOYOGXQAZCTEBK-OAHLLOKOSA-N	0	0	292.382	4.156	20	30		CIEDRN
C=CCCCC(=O)N[C@H]1CCCOc2cc(Cl)ccc21	ZINC000182441898	335820055	/nfs/dbraw/zinc/82/00/55/335820055.db2.gz	XSJLWNKOWJZLMV-AWEZNQCLSA-N	0	0	293.794	4.026	20	30		CIEDRN
CCOc1cc(C)ccc1N[C@H](C#N)C1CCCCC1	ZINC000579752556	335879645	/nfs/dbraw/zinc/87/96/45/335879645.db2.gz	UXHVWCFRNBYYAK-MRXNPFEDSA-N	0	0	272.392	4.278	20	30		CIEDRN
Cc1cccc([C@@H](C)NCc2ccc(F)cc2C#N)c1C	ZINC000183733276	335904145	/nfs/dbraw/zinc/90/41/45/335904145.db2.gz	HBLNHLJGXLBDOS-CQSZACIVSA-N	0	0	282.362	4.165	20	30		CIEDRN
CC[C@H](CC#N)NC(=O)CC1CCC(c2ccccc2)CC1	ZINC000183940370	335913552	/nfs/dbraw/zinc/91/35/52/335913552.db2.gz	DWYOHFKROZHWFO-VMWRSERWSA-N	0	0	298.430	4.159	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)CC1(CSc2ccccc2)CC1	ZINC000184561175	335928845	/nfs/dbraw/zinc/92/88/45/335928845.db2.gz	HOJRRMMSGOOTMK-CQSZACIVSA-N	0	0	289.444	4.030	20	30		CIEDRN
N#CCc1ccc(NC/C=C/c2ccc(F)cc2)cc1	ZINC000185146977	335946978	/nfs/dbraw/zinc/94/69/78/335946978.db2.gz	HAMPNEIQNHKDDT-OWOJBTEDSA-N	0	0	266.319	4.017	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)c1occc1C(C)C	ZINC000580907350	335983032	/nfs/dbraw/zinc/98/30/32/335983032.db2.gz	GEMGJBHTUKEJIO-UHFFFAOYSA-N	0	0	283.371	4.231	20	30		CIEDRN
COc1ccc(C#N)cc1CNc1cccc(C)c1Cl	ZINC000380412270	335983461	/nfs/dbraw/zinc/98/34/61/335983461.db2.gz	HOTVMJSRCOSSHN-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
CC(C)c1ccc(NC(=O)NCC2(C#N)CC2)c(C(C)C)c1	ZINC000581287503	336037172	/nfs/dbraw/zinc/03/71/72/336037172.db2.gz	VRWICJPVBLJVDQ-UHFFFAOYSA-N	0	0	299.418	4.359	20	30		CIEDRN
CC(C)(C)CC(=O)CSc1cccc(Cl)c1C#N	ZINC000581327605	336050455	/nfs/dbraw/zinc/05/04/55/336050455.db2.gz	KCCXDEUDVQBVGR-UHFFFAOYSA-N	0	0	281.808	4.309	20	30		CIEDRN
C=CCCCCCNC(=O)Nc1ccccc1CSC	ZINC000581319399	336048251	/nfs/dbraw/zinc/04/82/51/336048251.db2.gz	ZMXGAUDNXVILIK-UHFFFAOYSA-N	0	0	292.448	4.418	20	30		CIEDRN
CC#CCCCc1nc([C@H]2CCCC[C@@H]2CC)no1	ZINC000581384723	336066348	/nfs/dbraw/zinc/06/63/48/336066348.db2.gz	JDVJDBDFPDZYOG-KBPBESRZSA-N	0	0	260.381	4.099	20	30		CIEDRN
N#Cc1ccc(F)c(COc2ccc(Cl)cc2F)c1	ZINC000381866476	336074745	/nfs/dbraw/zinc/07/47/45/336074745.db2.gz	VRWNGFSPQHLDGK-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
N#Cc1cc(Cl)cc(OC[C@H]2CCCCC2(F)F)c1	ZINC000382065546	336081159	/nfs/dbraw/zinc/08/11/59/336081159.db2.gz	GSVDCKLCTXUVJK-LLVKDONJSA-N	0	0	285.721	4.416	20	30		CIEDRN
CCCC[C@H](C)N(CCCC)C(=O)c1cc(C#N)cs1	ZINC000581508406	336091957	/nfs/dbraw/zinc/09/19/57/336091957.db2.gz	NBKZCLRESOBPON-ZDUSSCGKSA-N	0	0	292.448	4.441	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(Cc2cc(C)cc(C)c2)no1	ZINC000581632675	336115073	/nfs/dbraw/zinc/11/50/73/336115073.db2.gz	FCGPXEWNGUTZFP-QGZVFWFLSA-N	0	0	270.376	4.131	20	30		CIEDRN
Cc1ccnc(NC[C@H]2CCCC[C@H]2C(F)(F)F)c1C#N	ZINC000581905774	336164046	/nfs/dbraw/zinc/16/40/46/336164046.db2.gz	WKRWGBZLZFILJP-DGCLKSJQSA-N	0	0	297.324	4.042	20	30		CIEDRN
Cc1csc(NC(=O)c2cc(C)cc(Cl)c2)c1C#N	ZINC000581908889	336164270	/nfs/dbraw/zinc/16/42/70/336164270.db2.gz	ZWPKGSJDWSIYFR-UHFFFAOYSA-N	0	0	290.775	4.142	20	30		CIEDRN
N#Cc1cccc(NC(=O)c2ccc3sccc3c2)c1	ZINC000386155398	336167176	/nfs/dbraw/zinc/16/71/76/336167176.db2.gz	JQBHNAPDVDWGPD-UHFFFAOYSA-N	0	0	278.336	4.025	20	30		CIEDRN
N#CCc1ccc(NC(=O)c2cccc3ccsc32)cc1	ZINC000386219671	336168219	/nfs/dbraw/zinc/16/82/19/336168219.db2.gz	JLKCRYANCVHCML-UHFFFAOYSA-N	0	0	292.363	4.220	20	30		CIEDRN
N#C[C@@H](NC(=O)c1cccc2ccsc21)C1CCCCC1	ZINC000386228022	336168679	/nfs/dbraw/zinc/16/86/79/336168679.db2.gz	LOAMKMAGMHNHTI-OAHLLOKOSA-N	0	0	298.411	4.104	20	30		CIEDRN
CN(C(=O)c1cccc2ccsc21)c1cccc(C#N)c1	ZINC000386257476	336169230	/nfs/dbraw/zinc/16/92/30/336169230.db2.gz	UHGHPPMVVNGDAT-UHFFFAOYSA-N	0	0	292.363	4.050	20	30		CIEDRN
COc1ccc(C#N)cc1CNc1cccc2ccsc21	ZINC000386494588	336175855	/nfs/dbraw/zinc/17/58/55/336175855.db2.gz	ZCAVWKZXIJTESW-UHFFFAOYSA-N	0	0	294.379	4.394	20	30		CIEDRN
Cc1cc(COc2cccc(N3CCCC3)c2)ccc1C#N	ZINC000581972267	336181261	/nfs/dbraw/zinc/18/12/61/336181261.db2.gz	DTHIXZHXGQZYIX-UHFFFAOYSA-N	0	0	292.382	4.046	20	30		CIEDRN
CCCCN(CCCCC(C)(C)C#N)CC(F)(F)F	ZINC000387026056	336183866	/nfs/dbraw/zinc/18/38/66/336183866.db2.gz	NKYPQGRTCQWDJD-UHFFFAOYSA-N	0	0	278.362	4.371	20	30		CIEDRN
Cc1cc(CNc2ccc3cc(C#N)ccc3n2)ccc1F	ZINC000301835425	533741661	/nfs/dbraw/zinc/74/16/61/533741661.db2.gz	WKPVVOQQWNJKQG-UHFFFAOYSA-N	0	0	291.329	4.166	20	30		CIEDRN
C[C@@H](SCc1ccc(F)cn1)c1cccc(C#N)c1	ZINC000344900742	533997955	/nfs/dbraw/zinc/99/79/55/533997955.db2.gz	MOQYQDXFOFFAKN-LLVKDONJSA-N	0	0	272.348	4.087	20	30		CIEDRN
C[C@@H](Sc1cccc(C#N)n1)c1ccc(Cl)cc1	ZINC000301842803	534008954	/nfs/dbraw/zinc/00/89/54/534008954.db2.gz	KDHPAQRHZQYPHV-SNVBAGLBSA-N	0	0	274.776	4.460	20	30		CIEDRN
C[C@@H](c1ccc(C(C)(C)C)cc1)[S@@](=O)CCCCC#N	ZINC000352369786	534048027	/nfs/dbraw/zinc/04/80/27/534048027.db2.gz	ACZPSBVLMSUKPP-XOBRGWDASA-N	0	0	291.460	4.488	20	30		CIEDRN
C[C@H](SCC1(C#N)CC1)c1c(F)cccc1F	ZINC000344485744	534123464	/nfs/dbraw/zinc/12/34/64/534123464.db2.gz	QGXCVGNOSUKDEH-VIFPVBQESA-N	0	0	253.317	4.063	20	30		CIEDRN
C[C@@H]1CC[C@H](C(=O)Nc2ncc3c(n2)CCC(C)(C)C3)C1	ZINC000330168841	534216140	/nfs/dbraw/zinc/21/61/40/534216140.db2.gz	BCUVEWCFDNZCSH-NEPJUHHUSA-N	0	0	287.407	4.016	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cccc(C2CCOCC2)c1	ZINC000529935807	517341563	/nfs/dbraw/zinc/34/15/63/517341563.db2.gz	NSOBAYXFCOFWAU-SFHVURJKSA-N	0	0	287.403	4.121	20	30		CIEDRN
CCC[C@@H]1[C@H](C)CCCN1C(=O)Nc1ccc(CC#N)cc1	ZINC000174717140	517603761	/nfs/dbraw/zinc/60/37/61/517603761.db2.gz	QTUPPQXPZNJQRE-RHSMWYFYSA-N	0	0	299.418	4.185	20	30		CIEDRN
CCC[C@@]1(C)CCCN(C(=O)Nc2ccc(CC#N)cc2)C1	ZINC000174715239	517606813	/nfs/dbraw/zinc/60/68/13/517606813.db2.gz	SOYJJHULUFPQQW-SFHVURJKSA-N	0	0	299.418	4.187	20	30		CIEDRN
Cc1noc(C)c1CNC(=O)[C@@H]1CCC[C@@H]2CCCC[C@H]12	ZINC000329006581	534331836	/nfs/dbraw/zinc/33/18/36/534331836.db2.gz	NBIMZPNSIWXMJK-SOUVJXGZSA-N	0	0	290.407	4.354	20	30		CIEDRN
COc1cc(N[C@H](C#N)C2CCCCC2)c(C)cc1C	ZINC000479836789	518139315	/nfs/dbraw/zinc/13/93/15/518139315.db2.gz	CFSDGSLATNGZDK-MRXNPFEDSA-N	0	0	272.392	4.196	20	30		CIEDRN
Cc1cc(C(=O)CS[C@H](C)c2cccc(C#N)c2)c(C)[nH]1	ZINC000443143607	518186503	/nfs/dbraw/zinc/18/65/03/518186503.db2.gz	JMWRUMWGSWJVPP-CYBMUJFWSA-N	0	0	298.411	4.180	20	30		CIEDRN
O=C(C[C@H]1C=CCCC1)Nc1n[nH]c2cc(F)ccc21	ZINC000330011732	534338349	/nfs/dbraw/zinc/33/83/49/534338349.db2.gz	JJXODEFGELAFII-JTQLQIEISA-N	0	0	273.311	4.036	20	30		CIEDRN
CC(C)(C)CC(=O)N(Cc1ccco1)c1ccccc1C#N	ZINC000298406119	518612631	/nfs/dbraw/zinc/61/26/31/518612631.db2.gz	WTMDHXUIGUTARX-UHFFFAOYSA-N	0	0	296.370	4.121	20	30		CIEDRN
C=C(C)CSc1nnc(-c2cccs2)n1C1CC1	ZINC000048412459	518626227	/nfs/dbraw/zinc/62/62/27/518626227.db2.gz	AJHACIMKLZMZLK-UHFFFAOYSA-N	0	0	277.418	4.010	20	30		CIEDRN
C=CCCCNC(=O)Nc1cc(-c2nc(C)co2)ccc1C	ZINC000279588224	518701974	/nfs/dbraw/zinc/70/19/74/518701974.db2.gz	QCMIOEIRWZYERP-UHFFFAOYSA-N	0	0	299.374	4.046	20	30		CIEDRN
CC(C)Oc1ccc(Oc2ccc(Cl)c(C#N)n2)cc1	ZINC000301569825	519781288	/nfs/dbraw/zinc/78/12/88/519781288.db2.gz	KORKBPLJDQZQJP-UHFFFAOYSA-N	0	0	288.734	4.186	20	30		CIEDRN
CCCC(=O)CSc1ccc(C#N)c(C(F)(F)F)c1	ZINC000289383399	519861930	/nfs/dbraw/zinc/86/19/30/519861930.db2.gz	PXEFKYLYNZYSLR-UHFFFAOYSA-N	0	0	287.306	4.038	20	30		CIEDRN
Cc1oc2ccc(NC(=O)[C@@H]3CCO[C@H]3C)cc2c1C	ZINC000330086915	534550642	/nfs/dbraw/zinc/55/06/42/534550642.db2.gz	MSCIGJVAXFAXEQ-WCQYABFASA-N	0	0	273.332	4.063	20	30		CIEDRN
CCCc1nc(C)c(CNc2ccc(Cl)cc2C#N)o1	ZINC000292419324	521498978	/nfs/dbraw/zinc/49/89/78/521498978.db2.gz	WJGPVQSBGPEEMX-UHFFFAOYSA-N	0	0	289.766	4.073	20	30		CIEDRN
COCCSCCCS[C@@H](C)c1cccc(C#N)c1	ZINC000278414865	521776268	/nfs/dbraw/zinc/77/62/68/521776268.db2.gz	WHUGYOLURIFZDM-ZDUSSCGKSA-N	0	0	295.473	4.122	20	30		CIEDRN
Cc1cnc([C@H](C)NC(=O)C[C@H]2CCc3ccccc3C2)o1	ZINC000329413168	534629616	/nfs/dbraw/zinc/62/96/16/534629616.db2.gz	DPHKYDKNQDZJQF-KBPBESRZSA-N	0	0	298.386	4.196	20	30		CIEDRN
N#CCCN(CC1CC1)C(=O)c1ccc(C2CCCC2)cc1	ZINC000354910990	534641150	/nfs/dbraw/zinc/64/11/50/534641150.db2.gz	CWGYCOMBKPSDGZ-UHFFFAOYSA-N	0	0	296.414	4.110	20	30		CIEDRN
CCc1noc([C@@H](C)S[C@H](C)c2ccc(C#N)cc2)n1	ZINC000076326704	522911440	/nfs/dbraw/zinc/91/14/40/522911440.db2.gz	REXGGPJRNRLJFE-GHMZBOCLSA-N	0	0	287.388	4.059	20	30		CIEDRN
CC[C@H](c1ccccc1)N(CC)C(=O)c1cc(C#N)oc1C	ZINC000280504705	522941393	/nfs/dbraw/zinc/94/13/93/522941393.db2.gz	CJLRWBVETXUCCB-QGZVFWFLSA-N	0	0	296.370	4.073	20	30		CIEDRN
CC[C@@H](c1ccccc1)N(CC)C(=O)c1cc(C#N)oc1C	ZINC000280504704	523097653	/nfs/dbraw/zinc/09/76/53/523097653.db2.gz	CJLRWBVETXUCCB-KRWDZBQOSA-N	0	0	296.370	4.073	20	30		CIEDRN
CC[C@@H]1CCC[C@H](Nc2snc(Cl)c2C#N)C1	ZINC000301328143	523307763	/nfs/dbraw/zinc/30/77/63/523307763.db2.gz	CFGVXKGCKDTYBF-BDAKNGLRSA-N	0	0	269.801	4.049	20	30		CIEDRN
CC[C@H](C)N(Cc1ccccc1)C(=O)c1cc(C#N)cs1	ZINC000084071212	523943205	/nfs/dbraw/zinc/94/32/05/523943205.db2.gz	QKABDXAPONAPGK-ZDUSSCGKSA-N	0	0	298.411	4.061	20	30		CIEDRN
Cc1ccc(C)c(N(C(=O)c2cc(C#N)cs2)C(C)C)c1	ZINC000084093412	524113147	/nfs/dbraw/zinc/11/31/47/524113147.db2.gz	NLCLLCHUNWAUNY-UHFFFAOYSA-N	0	0	298.411	4.292	20	30		CIEDRN
C[C@@H](CCc1ccco1)Nc1ccc(Cl)cc1C#N	ZINC000052858017	524547668	/nfs/dbraw/zinc/54/76/68/524547668.db2.gz	ZNXMRRFHORYWIZ-NSHDSACASA-N	0	0	274.751	4.238	20	30		CIEDRN
C[C@@H](Cn1cc(C#N)c(=O)c2ccccc21)C1CCCCC1	ZINC000292748041	524946644	/nfs/dbraw/zinc/94/66/44/524946644.db2.gz	VJXZYQJNRUDBQH-AWEZNQCLSA-N	0	0	294.398	4.090	20	30		CIEDRN
Cc1nc(C(=O)N[C@@H]2CCCCC23CCCC3)c(C)o1	ZINC000329200432	534868316	/nfs/dbraw/zinc/86/83/16/534868316.db2.gz	XIKHFKIPVBGJAG-CYBMUJFWSA-N	0	0	276.380	4.099	20	30		CIEDRN
C[C@H](Nc1cc(Cl)ccc1C#N)c1cccc(O)c1	ZINC000036954510	525643380	/nfs/dbraw/zinc/64/33/80/525643380.db2.gz	DZGXHNBMDPLDHG-JTQLQIEISA-N	0	0	272.735	4.090	20	30		CIEDRN
Cc1ccnc(N[C@H](c2ccccn2)C2CCCC2)c1C#N	ZINC000363663349	525702042	/nfs/dbraw/zinc/70/20/42/525702042.db2.gz	DWQLJHBTCZNMDQ-KRWDZBQOSA-N	0	0	292.386	4.000	20	30		CIEDRN
Cc1ccnc([C@@H](C)Nc2ccc(OC(C)C)c(C#N)c2)c1	ZINC000290305582	525713629	/nfs/dbraw/zinc/71/36/29/525713629.db2.gz	IGTPYAUENHJZFV-CQSZACIVSA-N	0	0	295.386	4.222	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)c1ccc(C(C)C)cn1	ZINC000353709050	526356839	/nfs/dbraw/zinc/35/68/39/526356839.db2.gz	MJVJZVHTQXRTKI-UHFFFAOYSA-N	0	0	294.398	4.033	20	30		CIEDRN
C=CCN(Cc1ccsc1)Cc1ccccc1F	ZINC000352655583	526378807	/nfs/dbraw/zinc/37/88/07/526378807.db2.gz	SWRDACXSWACJHC-UHFFFAOYSA-N	0	0	261.365	4.075	20	30		CIEDRN
Cc1noc(C)c1CS[C@@H](C)c1ccc(C#N)cc1	ZINC000118443710	526527617	/nfs/dbraw/zinc/52/76/17/526527617.db2.gz	ATWUUHNYSDAVQH-LBPRGKRZSA-N	0	0	272.373	4.158	20	30		CIEDRN
N#Cc1cc(NCc2ccc(Cl)s2)ccc1F	ZINC000051635699	526572444	/nfs/dbraw/zinc/57/24/44/526572444.db2.gz	OHWJEJCDSPAUPC-UHFFFAOYSA-N	0	0	266.728	4.024	20	30		CIEDRN
Cc1noc(C)c1[C@H](C)CNc1ccc(C#N)c(Cl)c1	ZINC000129586456	526576149	/nfs/dbraw/zinc/57/61/49/526576149.db2.gz	NIAZOFSIKNYZKW-SECBINFHSA-N	0	0	289.766	4.032	20	30		CIEDRN
N#Cc1ccc(NCCc2ccccc2F)cc1Cl	ZINC000061845804	526662496	/nfs/dbraw/zinc/66/24/96/526662496.db2.gz	YRALZNRCIHZASB-UHFFFAOYSA-N	0	0	274.726	4.005	20	30		CIEDRN
N#Cc1ccc(NCc2ccccc2F)c(C(F)(F)F)c1	ZINC000036973766	526664580	/nfs/dbraw/zinc/66/45/80/526664580.db2.gz	FFHAVLAWXBFGLN-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
N#Cc1ccc(N[C@@H]2CCc3c2cccc3O)cc1Cl	ZINC000036852700	526666515	/nfs/dbraw/zinc/66/65/15/526666515.db2.gz	ZQKOYXFSQVOCPA-OAHLLOKOSA-N	0	0	284.746	4.017	20	30		CIEDRN
Cc1nc(C(C)C)ccc1CSc1cc(C#N)ccn1	ZINC000292789829	526669454	/nfs/dbraw/zinc/66/94/54/526669454.db2.gz	ZICJYTLUINSHQH-UHFFFAOYSA-N	0	0	283.400	4.072	20	30		CIEDRN
Cc1nc(C)c(C#N)c(S[C@H]2CCCc3ccccc32)n1	ZINC000340942752	526688493	/nfs/dbraw/zinc/68/84/93/526688493.db2.gz	STWFQAVFFCBOPR-INIZCTEOSA-N	0	0	295.411	4.135	20	30		CIEDRN
N#Cc1cccc(CN2CCC[C@@H]2c2ccsc2)c1F	ZINC000340765588	526703610	/nfs/dbraw/zinc/70/36/10/526703610.db2.gz	XOJCZYVYIULOBJ-OAHLLOKOSA-N	0	0	286.375	4.096	20	30		CIEDRN
Cc1nsc(N[C@@H]2CCc3cc(Cl)ccc32)c1C#N	ZINC000340013078	526716203	/nfs/dbraw/zinc/71/62/03/526716203.db2.gz	DAMHHFQBHZIOLT-CYBMUJFWSA-N	0	0	289.791	4.076	20	30		CIEDRN
Cc1oc(C#N)cc1C(=O)N1CCC[C@H](C)c2ccccc21	ZINC000280975664	526755854	/nfs/dbraw/zinc/75/58/54/526755854.db2.gz	CLJWUFWBIHEZGM-LBPRGKRZSA-N	0	0	294.354	4.004	20	30		CIEDRN
N#Cc1sc(N2CCC[C@@H]2c2cccs2)nc1Cl	ZINC000278465261	526799844	/nfs/dbraw/zinc/79/98/44/526799844.db2.gz	BPLHBLRCBCESRH-MRVPVSSYSA-N	0	0	295.820	4.071	20	30		CIEDRN
N#Cc1sc(N2CCC[C@H]2c2ccccc2)nc1Cl	ZINC000278659924	526800750	/nfs/dbraw/zinc/80/07/50/526800750.db2.gz	JASGMUOKMQGGNN-NSHDSACASA-N	0	0	289.791	4.010	20	30		CIEDRN
C=CCOc1cccc(CNc2cc(C3CC3)ccn2)c1	ZINC000353152717	526905591	/nfs/dbraw/zinc/90/55/91/526905591.db2.gz	MMHALEVGNZUYEO-UHFFFAOYSA-N	0	0	280.371	4.136	20	30		CIEDRN
Cc1nc(CSCc2cccc(C#N)c2F)sc1C	ZINC000340856949	526913819	/nfs/dbraw/zinc/91/38/19/526913819.db2.gz	RPOXLLWYLUGAQD-UHFFFAOYSA-N	0	0	292.404	4.204	20	30		CIEDRN
C=CC(C)(C)C(=O)Nc1cc(C(F)F)ccc1Cl	ZINC000296638322	526948219	/nfs/dbraw/zinc/94/82/19/526948219.db2.gz	WGPUKGQNQPDCGL-UHFFFAOYSA-N	0	0	273.710	4.428	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@H](C)c1nc2ccccc2n1C(C)C	ZINC000295864813	526948546	/nfs/dbraw/zinc/94/85/46/526948546.db2.gz	OPILBAFJMIJPEA-CYBMUJFWSA-N	0	0	299.418	4.007	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2cc(SC)ccc2C)CC1	ZINC000336153291	526969353	/nfs/dbraw/zinc/96/93/53/526969353.db2.gz	CPLCMSJDUXHMEU-UHFFFAOYSA-N	0	0	290.432	4.147	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cnn(CC(C)C)c1C(F)F	ZINC000344192944	526998309	/nfs/dbraw/zinc/99/83/09/526998309.db2.gz	IUDWEJARUTZUGS-UHFFFAOYSA-N	0	0	299.365	4.018	20	30		CIEDRN
C=CCC1(c2nc([C@@H]3C[C@H]3c3ccccc3)no2)CCC1	ZINC000347269295	527065328	/nfs/dbraw/zinc/06/53/28/527065328.db2.gz	RSURIMOAOZAERF-LSDHHAIUSA-N	0	0	280.371	4.339	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)c2ccc(C#N)cc2C)CCCC1(C)C	ZINC000347423037	527117930	/nfs/dbraw/zinc/11/79/30/527117930.db2.gz	GAMLIAVGALMLIU-KRWDZBQOSA-N	0	0	296.414	4.074	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NCCC(C)(C)O	ZINC000352554436	527260117	/nfs/dbraw/zinc/26/01/17/527260117.db2.gz	RXPXPHCRGLPTHN-UHFFFAOYSA-N	0	0	261.409	4.111	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NCc1ncc(C)cn1	ZINC000345409276	527260570	/nfs/dbraw/zinc/26/05/70/527260570.db2.gz	OWNLGUYVWJVCCB-UHFFFAOYSA-N	0	0	281.403	4.249	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1ccccc1C(C)(F)F	ZINC000334581609	527453311	/nfs/dbraw/zinc/45/33/11/527453311.db2.gz	SUERFCCSJBEAPA-GFCCVEGCSA-N	0	0	294.345	4.371	20	30		CIEDRN
C=CCC[C@H](NC(=O)c1cc(C)n(C)c1C)c1ccccc1	ZINC000353477736	527481826	/nfs/dbraw/zinc/48/18/26/527481826.db2.gz	QVLLIUKVDBDEDM-SFHVURJKSA-N	0	0	296.414	4.079	20	30		CIEDRN
CC(=O)N[C@H](CC1CCC1)C(=O)NC1CCCCCC1	ZINC000330217145	527544359	/nfs/dbraw/zinc/54/43/59/527544359.db2.gz	NPMTYROUMQHUBI-OAHLLOKOSA-N	0	0	280.412	4.201	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1c(C)cc(C)cc1C	ZINC000334857041	527600941	/nfs/dbraw/zinc/60/09/41/527600941.db2.gz	JNDUAYCBZZISBT-HNNXBMFYSA-N	0	0	272.392	4.184	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1cccc(C(F)F)c1	ZINC000335884070	527602173	/nfs/dbraw/zinc/60/21/73/527602173.db2.gz	MPJDHVKWORTLJQ-ZDUSSCGKSA-N	0	0	280.318	4.197	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N(C)c1ccc(OC(C)C)cc1	ZINC000191589237	527607165	/nfs/dbraw/zinc/60/71/65/527607165.db2.gz	RPGZJNUNBGYMLP-QGZVFWFLSA-N	0	0	275.392	4.039	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cccc2ccc(C)nc21	ZINC000344067585	527613387	/nfs/dbraw/zinc/61/33/87/527613387.db2.gz	RENZEUZPSFWVJT-QGZVFWFLSA-N	0	0	268.360	4.084	20	30		CIEDRN
C=C[C@](C)(CCOC)C(=O)Nc1ccc(C2CC2)c(C)c1	ZINC000353517177	527622081	/nfs/dbraw/zinc/62/20/81/527622081.db2.gz	UEEMIUMQLCHLLG-GOSISDBHSA-N	0	0	287.403	4.040	20	30		CIEDRN
CC(C)(C)CN(CCC#N)Cc1cc2ccccc2o1	ZINC000353420549	527681012	/nfs/dbraw/zinc/68/10/12/527681012.db2.gz	RXOFDKKFXNOUQA-UHFFFAOYSA-N	0	0	270.376	4.195	20	30		CIEDRN
CC(C)CCN(CCC#N)Cc1ccccc1Cl	ZINC000353418270	527716245	/nfs/dbraw/zinc/71/62/45/527716245.db2.gz	BZYPGCJQBLVBNZ-UHFFFAOYSA-N	0	0	264.800	4.102	20	30		CIEDRN
CC(C)CCOc1cccc(N[C@H]2CC[C@@H](C#N)C2)c1	ZINC000442851450	527786742	/nfs/dbraw/zinc/78/67/42/527786742.db2.gz	DVVZXRJTJLYDSO-ZBFHGGJFSA-N	0	0	272.392	4.216	20	30		CIEDRN
CCC1CCC(CNC(=O)Cc2ccc3n[nH]cc3c2)CC1	ZINC000329986641	527825137	/nfs/dbraw/zinc/82/51/37/527825137.db2.gz	FMPQBDQNEWSNQQ-UHFFFAOYSA-N	0	0	299.418	4.278	20	30		CIEDRN
CC1(CNC(=O)C2CCC(NC(=O)C3CC3)CC2)CCC1	ZINC000330013251	527897996	/nfs/dbraw/zinc/89/79/96/527897996.db2.gz	LXCXVLRMHPFJFA-UHFFFAOYSA-N	0	0	292.423	4.058	20	30		CIEDRN
CC(C)[C@]1(C)C[C@H]1C(=O)N[C@@H]1CCC(=O)N[C@H]1C(C)(C)C	ZINC000329217258	527977298	/nfs/dbraw/zinc/97/72/98/527977298.db2.gz	PWFYXMRHKBBKMW-RKCSVJPLSA-N	0	0	294.439	4.159	20	30		CIEDRN
CC1=C(C)CN(C(=O)Nc2ccc(C(C)(C)C#N)cc2)CC1	ZINC000336193810	528089007	/nfs/dbraw/zinc/08/90/07/528089007.db2.gz	DCTYVPXNKXDVKU-UHFFFAOYSA-N	0	0	297.402	4.062	20	30		CIEDRN
CC(C)c1ccc(CN(C(=O)CC(C)(C)C#N)C2CC2)cc1	ZINC000468904884	528089779	/nfs/dbraw/zinc/08/97/79/528089779.db2.gz	KJYCANAJXSCACC-UHFFFAOYSA-N	0	0	298.430	4.241	20	30		CIEDRN
CC(C)c1ccc2c(c1)[C@H](Nc1ncccc1C#N)CC2	ZINC000302433050	528155790	/nfs/dbraw/zinc/15/57/90/528155790.db2.gz	PCFYGIAAMLBGPR-QGZVFWFLSA-N	0	0	277.371	4.176	20	30		CIEDRN
CC(C)c1nc([C@H](C)NCc2ccc(C#N)s2)cs1	ZINC000347783231	528313348	/nfs/dbraw/zinc/31/33/48/528313348.db2.gz	ZNZUNLPMVWKYAY-JTQLQIEISA-N	0	0	291.445	4.050	20	30		CIEDRN
CCN(CCC#N)C(=O)C[C@H]1C[C@@H](C(C)C)c2ccccc21	ZINC000345813603	528367955	/nfs/dbraw/zinc/36/79/55/528367955.db2.gz	IOAKLBLTMSIHSY-QAPCUYQASA-N	0	0	298.430	4.066	20	30		CIEDRN
CC1(C#N)CCN(c2ccc3ccc(Cl)cc3n2)CC1	ZINC000335692353	528841874	/nfs/dbraw/zinc/84/18/74/528841874.db2.gz	AIEWBJLRXWXENF-UHFFFAOYSA-N	0	0	285.778	4.018	20	30		CIEDRN
CCC[C@@H](C)CC(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000352174396	528874336	/nfs/dbraw/zinc/87/43/36/528874336.db2.gz	MNQKDBUBNLZLTQ-WBVHZDCISA-N	0	0	286.419	4.364	20	30		CIEDRN
CC1(C)CCC(C(=O)Nc2nc(C3CC3)c[nH]2)CC1	ZINC000329302728	528895896	/nfs/dbraw/zinc/89/58/96/528895896.db2.gz	NNLHSXVGAKOYRR-UHFFFAOYSA-N	0	0	261.369	4.092	20	30		CIEDRN
CC(C)[C@H](C)CC(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000352226439	528940188	/nfs/dbraw/zinc/94/01/88/528940188.db2.gz	TZJZLZSPCVYEAL-WBVHZDCISA-N	0	0	286.419	4.220	20	30		CIEDRN
CC1(C)CCC[C@@H]1C(=O)Nc1ncn(C2CCCCC2)n1	ZINC000330082636	528962814	/nfs/dbraw/zinc/96/28/14/528962814.db2.gz	KJLWQVWLTVCLHR-CYBMUJFWSA-N	0	0	290.411	4.198	20	30		CIEDRN
CC1(C)CCC[C@H]1NC(=O)CCc1nc2ccccc2o1	ZINC000330228243	528986224	/nfs/dbraw/zinc/98/62/24/528986224.db2.gz	PNCPRJBGPBTWEJ-CQSZACIVSA-N	0	0	286.375	4.296	20	30		CIEDRN
CCC[C@@H](NC(=O)[C@@H](C)C#N)c1ccc(Cl)c(Cl)c1	ZINC000347029253	528986570	/nfs/dbraw/zinc/98/65/70/528986570.db2.gz	AJTOFHMSCNJGPN-TVQRCGJNSA-N	0	0	299.201	4.110	20	30		CIEDRN
CC1(C)CC[C@@H](C(=O)N[C@H](CCCC#N)c2ccccc2)C1	ZINC000352218729	529017304	/nfs/dbraw/zinc/01/73/04/529017304.db2.gz	NPBCBWXYBUUQPK-IAGOWNOFSA-N	0	0	298.430	4.364	20	30		CIEDRN
CC1(C)CC[C@H](C(=O)Nc2ncn(C3CCCCC3)n2)C1	ZINC000329493999	529038357	/nfs/dbraw/zinc/03/83/57/529038357.db2.gz	DAVGGTNGUATHNS-LBPRGKRZSA-N	0	0	290.411	4.198	20	30		CIEDRN
CC[C@@H](Nc1cc(C2CC2)ccn1)c1ccc(C#N)cc1	ZINC000353550640	529209143	/nfs/dbraw/zinc/20/91/43/529209143.db2.gz	RPTKZNPMKFWBGL-QGZVFWFLSA-N	0	0	277.371	4.394	20	30		CIEDRN
CC[C@@H](Sc1nc(C)nc(C)c1C#N)c1ccccc1	ZINC000352855495	529254442	/nfs/dbraw/zinc/25/44/42/529254442.db2.gz	OTXFDNWDHCPETB-OAHLLOKOSA-N	0	0	283.400	4.209	20	30		CIEDRN
CC[C@@H]1CCCN1C(=O)Nc1c(C)noc1-c1ccccc1	ZINC000330062256	529301545	/nfs/dbraw/zinc/30/15/45/529301545.db2.gz	APJNMVLODSXYLK-CQSZACIVSA-N	0	0	299.374	4.070	20	30		CIEDRN
N#Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(F)c1	ZINC000036886873	119131572	/nfs/dbraw/zinc/13/15/72/119131572.db2.gz	LKJQSDVFAVRQJZ-UHFFFAOYSA-N	0	0	292.653	4.051	20	30		CIEDRN
CC[C@H](NC(=O)C[C@H]1CCCCNC1=O)c1cccs1	ZINC000329247544	529579426	/nfs/dbraw/zinc/57/94/26/529579426.db2.gz	RWAOYJCWYSKZFS-NEPJUHHUSA-N	0	0	294.420	4.302	20	30		CIEDRN
CCc1nc(C)c(C(=O)N[C@H]2CCCCC23CCCC3)o1	ZINC000329132210	529717620	/nfs/dbraw/zinc/71/76/20/529717620.db2.gz	AQGLTIQRKDEPFF-ZDUSSCGKSA-N	0	0	290.407	4.353	20	30		CIEDRN
Cc1cc(C#N)nc(N[C@@H](c2ccccc2)C2CCCC2)n1	ZINC000573750830	334963699	/nfs/dbraw/zinc/96/36/99/334963699.db2.gz	XFLAWPXPMMODJB-KRWDZBQOSA-N	0	0	292.386	4.000	20	30		CIEDRN
CCN(CCCCC(C)(C)C#N)c1ccccc1F	ZINC000233444385	260300830	/nfs/dbraw/zinc/30/08/30/260300830.db2.gz	KSOWXVTYAUOWMZ-UHFFFAOYSA-N	0	0	262.372	4.372	20	30		CIEDRN
CCCc1ncc(CNc2cccc(C(F)F)c2C#N)o1	ZINC000574099975	334992427	/nfs/dbraw/zinc/99/24/27/334992427.db2.gz	JTEYHSVUABRTCV-UHFFFAOYSA-N	0	0	291.301	4.048	20	30		CIEDRN
C=CCCCNc1ccccc1S[C@@H](C)CC#N	ZINC000157183704	260827491	/nfs/dbraw/zinc/82/74/91/260827491.db2.gz	YQQCJIJILMOWRX-ZDUSSCGKSA-N	0	0	260.406	4.459	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N1CCC[C@@H]1c1ccc(C)c(C)c1	ZINC000574184670	334999144	/nfs/dbraw/zinc/99/91/44/334999144.db2.gz	NZAIEGDANGGXAA-NVXWUHKLSA-N	0	0	286.419	4.115	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc([C@@H](C)Oc2ccccc2)no1	ZINC000574433698	335019276	/nfs/dbraw/zinc/01/92/76/335019276.db2.gz	MJLNPNUQMUBJKS-CHWSQXEVSA-N	0	0	272.348	4.279	20	30		CIEDRN
CCc1ccc([C@@H]2C[C@H](C)CCN2c2cc(C#N)ccn2)o1	ZINC000574474851	335022820	/nfs/dbraw/zinc/02/28/20/335022820.db2.gz	ZNFACAJUUVADAC-CJNGLKHVSA-N	0	0	295.386	4.086	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(Cc2csc(C(C)C)n2)no1	ZINC000574484240	335023271	/nfs/dbraw/zinc/02/32/71/335023271.db2.gz	PPASNUOLVVRQMF-OAHLLOKOSA-N	0	0	291.420	4.094	20	30		CIEDRN
CCC(C)(C)C(=O)CSc1cccc(Cl)c1C#N	ZINC000574487942	335023530	/nfs/dbraw/zinc/02/35/30/335023530.db2.gz	FGGSQOAVZCWIRB-UHFFFAOYSA-N	0	0	281.808	4.309	20	30		CIEDRN
C=CCCCCSc1nnc(C)n1Cc1ccccc1	ZINC000574519791	335026219	/nfs/dbraw/zinc/02/62/19/335026219.db2.gz	GKXNRIKOSBEESI-UHFFFAOYSA-N	0	0	287.432	4.083	20	30		CIEDRN
N#Cc1c(N[C@@H]2CCCC(F)(F)C2)cccc1C(F)F	ZINC000574651285	335037383	/nfs/dbraw/zinc/03/73/83/335037383.db2.gz	KJPHUAJCNYIPNL-SECBINFHSA-N	0	0	286.272	4.486	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H]2CCCc3c(O)cccc32)n1	ZINC000574657842	335037974	/nfs/dbraw/zinc/03/79/74/335037974.db2.gz	HKECCAJMPMTZNQ-AWEZNQCLSA-N	0	0	298.386	4.097	20	30		CIEDRN
CC[C@@H](CC#N)NCc1ccc(Cl)c(C(F)(F)F)c1	ZINC000184083553	262007850	/nfs/dbraw/zinc/00/78/50/262007850.db2.gz	ABOXGIXDLZNIOM-JTQLQIEISA-N	0	0	290.716	4.141	20	30		CIEDRN
Cc1cc(C)c(C#N)c(SC[C@H]2CCC(F)(F)C2)n1	ZINC000574764447	335045799	/nfs/dbraw/zinc/04/57/99/335045799.db2.gz	TYXNAXPSUNPBJP-NSHDSACASA-N	0	0	282.359	4.098	20	30		CIEDRN
COc1ccccc1[C@@H](CC(C)C)Nc1cccc(C#N)n1	ZINC000301853530	532968303	/nfs/dbraw/zinc/96/83/03/532968303.db2.gz	QJQLBJUJSIAACH-MRXNPFEDSA-N	0	0	295.386	4.161	20	30		CIEDRN
Cc1csc(NC(=O)[C@@H]2CCCC(C)(C)C2)c1C#N	ZINC000575023016	335056531	/nfs/dbraw/zinc/05/65/31/335056531.db2.gz	NCPMRIZVAOHCTR-LLVKDONJSA-N	0	0	276.405	4.083	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](C)c1ccc(Cl)cc1	ZINC000184909305	262300273	/nfs/dbraw/zinc/30/02/73/262300273.db2.gz	ZDCNLLPAADUEQF-VXGBXAGGSA-N	0	0	265.784	4.120	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000187703295	260052437	/nfs/dbraw/zinc/05/24/37/260052437.db2.gz	LHPJFZUFQYTRFK-OCCSQVGLSA-N	0	0	299.336	4.051	20	30		CIEDRN
C[C@@H](Nc1nccc2ccc(F)cc21)c1ccc(C#N)cc1	ZINC000354556302	533566522	/nfs/dbraw/zinc/56/65/22/533566522.db2.gz	CFKXYICEIOCHAQ-GFCCVEGCSA-N	0	0	291.329	4.419	20	30		CIEDRN
N#Cc1cccc(NC(=O)C[C@H]2CCCc3ccccc32)c1	ZINC000341744904	130017679	/nfs/dbraw/zinc/01/76/79/130017679.db2.gz	ITITVFWICGPEQG-MRXNPFEDSA-N	0	0	290.366	4.007	20	30		CIEDRN
Cc1nsc(N[C@H]2CCc3c2cccc3Cl)c1C#N	ZINC000341759457	130025336	/nfs/dbraw/zinc/02/53/36/130025336.db2.gz	FZNYMQGOARQLSB-ZDUSSCGKSA-N	0	0	289.791	4.076	20	30		CIEDRN
N#Cc1ccc(CSCc2cccnc2)c(Cl)c1	ZINC000342011011	130197008	/nfs/dbraw/zinc/19/70/08/130197008.db2.gz	DJWXPLQQPHYZRI-UHFFFAOYSA-N	0	0	274.776	4.040	20	30		CIEDRN
C/C=C\c1ccc(NCc2cccc(C#N)c2F)cc1	ZINC000575112227	335066473	/nfs/dbraw/zinc/06/64/73/335066473.db2.gz	HTPXSRFTUJCKID-RQOWECAXSA-N	0	0	266.319	4.343	20	30		CIEDRN
C/C=C/c1ccc(NCc2cccc(C#N)c2F)cc1	ZINC000575112226	335066576	/nfs/dbraw/zinc/06/65/76/335066576.db2.gz	HTPXSRFTUJCKID-DUXPYHPUSA-N	0	0	266.319	4.343	20	30		CIEDRN
C[C@@H](C#N)Sc1nnc(-c2ccccc2)c2ccccc21	ZINC000005339980	170087751	/nfs/dbraw/zinc/08/77/51/170087751.db2.gz	MABLNOYQNVOHNT-LBPRGKRZSA-N	0	0	291.379	4.301	20	30		CIEDRN
CCCCNC(=S)Nc1cc(Cl)ccc1C	ZINC000006330340	170192384	/nfs/dbraw/zinc/19/23/84/170192384.db2.gz	JDROJIQWANBCPF-UHFFFAOYSA-N	0	0	256.802	4.146	20	30		CIEDRN
CC(=O)Nc1ccc(/C=C/C(=O)c2cccc(Cl)c2)cc1	ZINC000006340557	170193917	/nfs/dbraw/zinc/19/39/17/170193917.db2.gz	BXMHZQUDBNHXOF-JXMROGBWSA-N	0	0	299.757	4.195	20	30		CIEDRN
CC(C)(C)c1ccc(NC(=O)C2(C#N)CCCC2)cc1	ZINC000007334545	170277968	/nfs/dbraw/zinc/27/79/68/170277968.db2.gz	NMCIVXGESIMFEQ-UHFFFAOYSA-N	0	0	270.376	4.007	20	30		CIEDRN
N#CCc1ccc(NC(=O)CCC2CCCCC2)cc1	ZINC000008125779	170320159	/nfs/dbraw/zinc/32/01/59/170320159.db2.gz	TZFUBDKOGRDKKO-UHFFFAOYSA-N	0	0	270.376	4.052	20	30		CIEDRN
N#Cc1cccc(/C=C/c2nc3ccccc3s2)c1	ZINC000014176875	170621816	/nfs/dbraw/zinc/62/18/16/170621816.db2.gz	YWUNBDQSHYSSJP-CMDGGOBGSA-N	0	0	262.337	4.338	20	30		CIEDRN
Cc1ccc(SCC(=O)c2ccc(C#N)cc2)c(C)c1	ZINC000018551851	170750396	/nfs/dbraw/zinc/75/03/96/170750396.db2.gz	NWRFBOBDGOPZEA-UHFFFAOYSA-N	0	0	281.380	4.150	20	30		CIEDRN
CC(C)c1ccccc1NCc1cccc(C#N)c1	ZINC000019907208	170919377	/nfs/dbraw/zinc/91/93/77/170919377.db2.gz	SRAHGMCFNLCJSZ-UHFFFAOYSA-N	0	0	250.345	4.294	20	30		CIEDRN
C[C@@H](NCc1nc2ccccc2s1)c1ccc(C#N)cc1	ZINC000020136111	171023725	/nfs/dbraw/zinc/02/37/25/171023725.db2.gz	KJGAJYLMDZCRMY-GFCCVEGCSA-N	0	0	293.395	4.019	20	30		CIEDRN
N#Cc1ccc(CNc2cccc(Cl)c2F)c(F)c1	ZINC000020369384	171166993	/nfs/dbraw/zinc/16/69/93/171166993.db2.gz	LTGLRRRLNNQZJZ-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C#Cc1cccc(NCc2cccc3ccccc32)c1	ZINC000020545053	171242810	/nfs/dbraw/zinc/24/28/10/171242810.db2.gz	TZMTXSBJZYRVOH-UHFFFAOYSA-N	0	0	257.336	4.433	20	30		CIEDRN
CC(C)CCNc1nc(-c2ccc(C#N)cc2)cs1	ZINC000021224835	171299924	/nfs/dbraw/zinc/29/99/24/171299924.db2.gz	XEVOYFVCHVHWPD-UHFFFAOYSA-N	0	0	271.389	4.140	20	30		CIEDRN
N#Cc1ccccc1NCc1cccc(Cl)c1Cl	ZINC000021509002	171309318	/nfs/dbraw/zinc/30/93/18/171309318.db2.gz	CWFQAIZFLOUUHR-UHFFFAOYSA-N	0	0	277.154	4.477	20	30		CIEDRN
N#Cc1ccc(COc2cccc(C(F)(F)F)c2)c(F)c1	ZINC000021800273	171325730	/nfs/dbraw/zinc/32/57/30/171325730.db2.gz	QHMYJLWHLMHYRL-UHFFFAOYSA-N	0	0	295.235	4.295	20	30		CIEDRN
Cc1ccc(C)c(SCc2ccccc2C#N)c1	ZINC000022149317	171357874	/nfs/dbraw/zinc/35/78/74/171357874.db2.gz	SZPBPGNUJHUWFE-UHFFFAOYSA-N	0	0	253.370	4.467	20	30		CIEDRN
N#Cc1ccc(NCc2ccc(Cl)cc2Cl)cc1	ZINC000022151103	171358506	/nfs/dbraw/zinc/35/85/06/171358506.db2.gz	RXCAGANALCLWMY-UHFFFAOYSA-N	0	0	277.154	4.477	20	30		CIEDRN
O=C1c2ccccc2CCC/C1=C\c1ccccc1F	ZINC000026833866	171500516	/nfs/dbraw/zinc/50/05/16/171500516.db2.gz	XPRYWIAJSBVCRI-NTCAYCPXSA-N	0	0	266.315	4.428	20	30		CIEDRN
CC(C)c1nc(COc2ccc(C#N)cc2Cl)cs1	ZINC000031653793	171641595	/nfs/dbraw/zinc/64/15/95/171641595.db2.gz	KLMGGGTXMFGJFY-UHFFFAOYSA-N	0	0	292.791	4.371	20	30		CIEDRN
Cc1cc2c(ncnc2SCc2ccc(C#N)cc2)s1	ZINC000031944817	171666489	/nfs/dbraw/zinc/66/64/89/171666489.db2.gz	ZQYBBYUBHFLDET-UHFFFAOYSA-N	0	0	297.408	4.164	20	30		CIEDRN
N#Cc1cccc(CNc2ccc3ccccc3c2)c1	ZINC000035141377	172008904	/nfs/dbraw/zinc/00/89/04/172008904.db2.gz	KKSCGBSOBUQRFB-UHFFFAOYSA-N	0	0	258.324	4.324	20	30		CIEDRN
N#Cc1cc(NCc2cccc3cccnc32)ccc1Cl	ZINC000035222579	172065793	/nfs/dbraw/zinc/06/57/93/172065793.db2.gz	YPTPWMVBIVNKHU-UHFFFAOYSA-N	0	0	293.757	4.372	20	30		CIEDRN
N#Cc1cc(NCc2cccc(Cl)c2)ccc1Cl	ZINC000035224459	172068902	/nfs/dbraw/zinc/06/89/02/172068902.db2.gz	WYNCTPVLZGBDHR-UHFFFAOYSA-N	0	0	277.154	4.477	20	30		CIEDRN
CC(C)[C@@H](Nc1ccc(C#N)cc1)c1ccccc1	ZINC000035254970	172084190	/nfs/dbraw/zinc/08/41/90/172084190.db2.gz	WZZQHNAALWAUEY-QGZVFWFLSA-N	0	0	250.345	4.367	20	30		CIEDRN
C[C@@H](CCc1ccco1)Nc1ccc(C#N)c(Cl)c1	ZINC000035452058	172205353	/nfs/dbraw/zinc/20/53/53/172205353.db2.gz	BZYMHTJWFIIDIR-NSHDSACASA-N	0	0	274.751	4.238	20	30		CIEDRN
C=CCn1c(SCc2cc(C)ccc2C)nnc1C1CC1	ZINC000035523641	172242919	/nfs/dbraw/zinc/24/29/19/172242919.db2.gz	YLUGQOPAPAMHLB-UHFFFAOYSA-N	0	0	299.443	4.251	20	30		CIEDRN
C[C@H](Nc1ccc(C#N)c(C(F)(F)F)c1)c1ccccn1	ZINC000035695166	172363653	/nfs/dbraw/zinc/36/36/53/172363653.db2.gz	UNLFYZYIHYLSGC-JTQLQIEISA-N	0	0	291.276	4.145	20	30		CIEDRN
Cc1ccc(N[C@H](C)c2cccc(C#N)c2)cc1C	ZINC000037202384	173026326	/nfs/dbraw/zinc/02/63/26/173026326.db2.gz	XPUGGVIXHSBYSP-CQSZACIVSA-N	0	0	250.345	4.348	20	30		CIEDRN
Cc1cc(C)c(NCc2ccc(C#N)cc2)c(C)c1	ZINC000037497520	173236368	/nfs/dbraw/zinc/23/63/68/173236368.db2.gz	UWRYVSGVYNBQIL-UHFFFAOYSA-N	0	0	250.345	4.096	20	30		CIEDRN
CCc1cccc(C)c1NCc1ccc(C#N)cc1	ZINC000037500621	173238002	/nfs/dbraw/zinc/23/80/02/173238002.db2.gz	ANPPPSBHYKUDKA-UHFFFAOYSA-N	0	0	250.345	4.041	20	30		CIEDRN
O=C(/C=C/c1ccnc2ccccc12)c1ccc(F)c(F)c1	ZINC000040584826	174345535	/nfs/dbraw/zinc/34/55/35/174345535.db2.gz	CYAMGPKLFSKWFI-SOFGYWHQSA-N	0	0	295.288	4.409	20	30		CIEDRN
N#CC1(C(=O)Nc2cccc(C(F)(F)F)c2)CCCCC1	ZINC000044385131	175169516	/nfs/dbraw/zinc/16/95/16/175169516.db2.gz	DWEUBULKCGWFNL-UHFFFAOYSA-N	0	0	296.292	4.118	20	30		CIEDRN
Cc1ccc(CNc2ccc(Cl)cc2C#N)s1	ZINC000052858294	175539440	/nfs/dbraw/zinc/53/94/40/175539440.db2.gz	CKDIELZIHWLBIT-UHFFFAOYSA-N	0	0	262.765	4.194	20	30		CIEDRN
COc1ccc(Nc2cccc(F)c2C#N)cc1Cl	ZINC000071627770	176235459	/nfs/dbraw/zinc/23/54/59/176235459.db2.gz	ODBVSOLROSVVKT-UHFFFAOYSA-N	0	0	276.698	4.103	20	30		CIEDRN
C=CCN(C(=O)[C@H]1C[C@H]1c1ccc(F)cc1)c1ccccc1	ZINC000071846393	176276008	/nfs/dbraw/zinc/27/60/08/176276008.db2.gz	UYQQJDKPJHYKQW-ROUUACIJSA-N	0	0	295.357	4.148	20	30		CIEDRN
C=CCCO[C@@H](C)C(=O)N(c1cc(C)ccc1C)C(C)C	ZINC000078472022	177344219	/nfs/dbraw/zinc/34/42/19/177344219.db2.gz	VKCBGPZGBPOXQL-INIZCTEOSA-N	0	0	289.419	4.026	20	30		CIEDRN
Cc1ccnc(N[C@H]2CCc3c2cccc3Cl)c1C#N	ZINC000343448547	224751581	/nfs/dbraw/zinc/75/15/81/224751581.db2.gz	ZWKMOBLTOHGDMY-HNNXBMFYSA-N	0	0	283.762	4.015	20	30		CIEDRN
O=C(Cc1ccc2c[nH]nc2c1)N[C@@H]1CC[C@@H]2CCC[C@H]2C1	ZINC000329246158	227378833	/nfs/dbraw/zinc/37/88/33/227378833.db2.gz	ANFUILCMTVDGQV-OFQRWUPVSA-N	0	0	297.402	4.031	20	30		CIEDRN
N#Cc1cccc(CN(Cc2ccccc2F)C2CC2)c1F	ZINC000352870334	227380002	/nfs/dbraw/zinc/38/00/02/227380002.db2.gz	PWKNIKBSXAEXQS-UHFFFAOYSA-N	0	0	298.336	4.001	20	30		CIEDRN
Cc1ccc(Cl)c(NC(=O)c2ccc(CC#N)cc2)c1C	ZINC000334709962	225283050	/nfs/dbraw/zinc/28/30/50/225283050.db2.gz	GRSUWVSBHTZTGJ-UHFFFAOYSA-N	0	0	298.773	4.275	20	30		CIEDRN
N#Cc1csc(C[NH2+][C@@H]2CCc3sc(Cl)cc32)c1	ZINC000334755562	225309154	/nfs/dbraw/zinc/30/91/54/225309154.db2.gz	DWWWVEZFAFWDHT-LLVKDONJSA-N	0	0	294.832	4.112	20	30		CIEDRN
C[C@@H]1CC(C)(C)CN1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000334910143	225362332	/nfs/dbraw/zinc/36/23/32/225362332.db2.gz	BGJWYCAKGYYWAU-CYBMUJFWSA-N	0	0	299.418	4.140	20	30		CIEDRN
Cc1ccc(C#N)cc1OCc1cc(F)cc2cccnc21	ZINC000345551110	225554019	/nfs/dbraw/zinc/55/40/19/225554019.db2.gz	SVQUGDHELMNGSR-UHFFFAOYSA-N	0	0	292.313	4.133	20	30		CIEDRN
N#Cc1cccc(S[C@@H]2CCc3ccc(F)cc32)c1	ZINC000468640200	226001289	/nfs/dbraw/zinc/00/12/89/226001289.db2.gz	VRUZEZLDNSKKOF-MRXNPFEDSA-N	0	0	269.344	4.477	20	30		CIEDRN
C[C@]1(C(=O)N[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)CCC(=O)NC1	ZINC000329256086	227387489	/nfs/dbraw/zinc/38/74/89/227387489.db2.gz	DNADFTHDGZXTSD-CFAJVAMVSA-N	0	0	292.423	4.058	20	30		CIEDRN
Cc1oc(C#N)cc1-c1nc([C@H]2CCCC(C)(C)C2)no1	ZINC000347264063	226105126	/nfs/dbraw/zinc/10/51/26/226105126.db2.gz	NFRTYYSOCLJNSZ-NSHDSACASA-N	0	0	285.347	4.194	20	30		CIEDRN
N#CCC[C@@H](Nc1ncccc1Cl)c1ccccc1	ZINC000347407577	226148242	/nfs/dbraw/zinc/14/82/42/226148242.db2.gz	AIMWFCUCYZECCK-CQSZACIVSA-N	0	0	271.751	4.192	20	30		CIEDRN
Cc1c(C(C)C)c(=O)c2ccccc2n1CC1(C#N)CCC1	ZINC000335290646	226220451	/nfs/dbraw/zinc/22/04/51/226220451.db2.gz	YUPSAXPMNMKAIP-UHFFFAOYSA-N	0	0	294.398	4.127	20	30		CIEDRN
Cc1cc(NCCCC2(C#N)CCOCC2)ccc1C1CC1	ZINC000347853870	226379275	/nfs/dbraw/zinc/37/92/75/226379275.db2.gz	AIIZWVDMVZXMOD-UHFFFAOYSA-N	0	0	298.430	4.385	20	30		CIEDRN
CCC[C@@H](C(=O)N[C@H](C#N)c1ccc(CC)cc1)C(C)C	ZINC000575160640	335073775	/nfs/dbraw/zinc/07/37/75/335073775.db2.gz	OERVIDKYVUJMJK-IAGOWNOFSA-N	0	0	286.419	4.002	20	30		CIEDRN
CC[C@@](C)(C#N)c1nc([C@@H](c2ccc(C)cc2)C(C)C)no1	ZINC000575162014	335073799	/nfs/dbraw/zinc/07/37/99/335073799.db2.gz	HXVZBOCIGQLUNF-QAPCUYQASA-N	0	0	297.402	4.357	20	30		CIEDRN
CO[C@H](C)c1cccc(N[C@@H]2CCc3ccc(C#N)cc32)c1	ZINC000575168561	335074752	/nfs/dbraw/zinc/07/47/52/335074752.db2.gz	VVHWHOLPIPRRER-BFUOFWGJSA-N	0	0	292.382	4.365	20	30		CIEDRN
N#Cc1csc(C(=O)Nc2csc3ccccc23)c1	ZINC000352598447	227101330	/nfs/dbraw/zinc/10/13/30/227101330.db2.gz	PYARBFNZTOACNR-UHFFFAOYSA-N	0	0	284.365	4.087	20	30		CIEDRN
N#Cc1ccccc1CNc1ccc(F)c(C2CC2)c1	ZINC000352612005	227106578	/nfs/dbraw/zinc/10/65/78/227106578.db2.gz	LYCOBGLVAVPLEA-UHFFFAOYSA-N	0	0	266.319	4.187	20	30		CIEDRN
N#Cc1c(F)cccc1Oc1cnc2ccccc2c1	ZINC000191861851	227200085	/nfs/dbraw/zinc/20/00/85/227200085.db2.gz	HTGLLFAULNAPLL-UHFFFAOYSA-N	0	0	264.259	4.038	20	30		CIEDRN
Cc1nc(CCNC(=O)C2CCC(C)(C)CC2)c(C)o1	ZINC000329061569	227277561	/nfs/dbraw/zinc/27/75/61/227277561.db2.gz	ZIGMULJCAVZOMD-UHFFFAOYSA-N	0	0	278.396	4.007	20	30		CIEDRN
N#CC1CCC(CNC(=O)C(C2CCC2)C2CCC2)CC1	ZINC000329114304	227307057	/nfs/dbraw/zinc/30/70/57/227307057.db2.gz	LYAOIEARZQELQD-UHFFFAOYSA-N	0	0	288.435	4.489	20	30		CIEDRN
C[C@H]1C[C@@H](CC(=O)Nc2nncn2C2CC2)CC(C)(C)C1	ZINC000329127914	227316610	/nfs/dbraw/zinc/31/66/10/227316610.db2.gz	VCDHWKZLOSPBLH-RYUDHWBXSA-N	0	0	290.411	4.054	20	30		CIEDRN
O=C(N[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1c[nH]c2ncccc12	ZINC000329139831	227321404	/nfs/dbraw/zinc/32/14/04/227321404.db2.gz	JCHAEDGTQLDCGB-BFHYXJOUSA-N	0	0	297.402	4.226	20	30		CIEDRN
N#Cc1nc(SC2CCCCC2)ccc1Cl	ZINC000301529209	227573338	/nfs/dbraw/zinc/57/33/38/227573338.db2.gz	KHFTWVBGGSCDAQ-UHFFFAOYSA-N	0	0	252.770	4.031	20	30		CIEDRN
Cc1cccnc1NC(=O)N[C@H]1CCCCC12CCCC2	ZINC000329545737	227592746	/nfs/dbraw/zinc/59/27/46/227592746.db2.gz	GVJHZQOVXKIHST-AWEZNQCLSA-N	0	0	287.407	4.219	20	30		CIEDRN
C[C@H](Nc1nc2ccccc2s1)c1cccc(C#N)c1	ZINC000301425095	227535234	/nfs/dbraw/zinc/53/52/34/227535234.db2.gz	GLJYNEKUELCJHG-NSHDSACASA-N	0	0	279.368	4.341	20	30		CIEDRN
Cc1cccc([C@H]2CCCCN2c2ccc(C#N)nc2)c1C	ZINC000301798234	227682975	/nfs/dbraw/zinc/68/29/75/227682975.db2.gz	ZKXOTTPPKCDKTI-LJQANCHMSA-N	0	0	291.398	4.302	20	30		CIEDRN
N#Cc1ccc(C(F)(F)F)c(NCc2ccc(F)cc2)c1	ZINC000301737420	227658578	/nfs/dbraw/zinc/65/85/78/227658578.db2.gz	VUYCNRPRVPPGAN-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
N#Cc1cccc(N[C@@H](c2ccccc2)C2CCCC2)n1	ZINC000301819960	227690418	/nfs/dbraw/zinc/69/04/18/227690418.db2.gz	GBBSSJIIPCZGIP-SFHVURJKSA-N	0	0	277.371	4.297	20	30		CIEDRN
N#Cc1cccc(Nc2ccc(OC3CCCC3)c(F)c2)n1	ZINC000301818506	227691159	/nfs/dbraw/zinc/69/11/59/227691159.db2.gz	FQUCADCTKDSLMW-UHFFFAOYSA-N	0	0	297.333	4.157	20	30		CIEDRN
Cc1ncc(NC(=O)C[C@H]2CCC[C@H](C)C2)c(C2CC2)n1	ZINC000329650876	227766937	/nfs/dbraw/zinc/76/69/37/227766937.db2.gz	CPFJKFSTKIQYPD-AAEUAGOBSA-N	0	0	287.407	4.467	20	30		CIEDRN
N#Cc1ccc(N[C@@H]2CCCOc3cc(F)ccc32)cc1	ZINC000301982221	227747964	/nfs/dbraw/zinc/74/79/64/227747964.db2.gz	AJGZMWLJVZBWPG-MRXNPFEDSA-N	0	0	282.318	4.023	20	30		CIEDRN
Cc1c2ccccc2oc1[C@@H](C)Nc1ccc(C)c(C#N)n1	ZINC000302621183	227870481	/nfs/dbraw/zinc/87/04/81/227870481.db2.gz	GXVGUIZZBXLDON-CYBMUJFWSA-N	0	0	291.354	4.489	20	30		CIEDRN
N#Cc1cccc(C#N)c1NCc1ccc2ccccc2c1	ZINC000302910004	227898833	/nfs/dbraw/zinc/89/88/33/227898833.db2.gz	YWUHTFDGWLACCQ-UHFFFAOYSA-N	0	0	283.334	4.195	20	30		CIEDRN
Cc1cc(NC(=O)C[C@H](CC#N)c2ccccc2)ccc1F	ZINC000355607366	227917926	/nfs/dbraw/zinc/91/79/26/227917926.db2.gz	NNENABHHFSSIGQ-HNNXBMFYSA-N	0	0	296.345	4.160	20	30		CIEDRN
O=C(Nc1cncnc1)C1(c2cccc(F)c2)CCCCC1	ZINC000329771375	227943514	/nfs/dbraw/zinc/94/35/14/227943514.db2.gz	JTEAGCCMGCUGMY-UHFFFAOYSA-N	0	0	299.349	4.106	20	30		CIEDRN
O=C(N[C@@H](c1cccs1)C1CC1)[C@@H]1CCCCC(=O)N1	ZINC000329885877	227976373	/nfs/dbraw/zinc/97/63/73/227976373.db2.gz	VHABJOFQFYXUBN-SMDDNHRTSA-N	0	0	292.404	4.055	20	30		CIEDRN
Cc1nc(CC2CC2)oc1C(=O)NCCC1CCCCC1	ZINC000330032203	228022791	/nfs/dbraw/zinc/02/27/91/228022791.db2.gz	UQJQTOKPOQOIQC-UHFFFAOYSA-N	0	0	290.407	4.211	20	30		CIEDRN
COc1cc(C#N)ccc1OCc1cccc(C(F)F)c1	ZINC000356040987	228096838	/nfs/dbraw/zinc/09/68/38/228096838.db2.gz	OYHLTGPECYBBQO-UHFFFAOYSA-N	0	0	289.281	4.083	20	30		CIEDRN
N#Cc1csc(CN2CCCCC[C@@H]2c2ccccc2)n1	ZINC000356069378	228109050	/nfs/dbraw/zinc/10/90/50/228109050.db2.gz	VGYNGVIGHGCBHS-MRXNPFEDSA-N	0	0	297.427	4.132	20	30		CIEDRN
N#CC1(C(=O)N[C@@H]2CCC[C@@H](c3ccccc3)C2)CCC1	ZINC000330202526	228064633	/nfs/dbraw/zinc/06/46/33/228064633.db2.gz	ZKVOUVREBGECFJ-HZPDHXFCSA-N	0	0	282.387	4.363	20	30		CIEDRN
Cc1cc(C#N)cc(NC(=O)N2[C@H](C)C[C@@H]3CCCC[C@@H]32)c1	ZINC000332304612	228154976	/nfs/dbraw/zinc/15/49/76/228154976.db2.gz	VYDVMRQAGPGSPV-KMFMINBZSA-N	0	0	297.402	4.052	20	30		CIEDRN
N#CCc1ccc(NC(=O)N[C@@H]2C[C@H]2C2CCCCC2)cc1	ZINC000330334573	228155503	/nfs/dbraw/zinc/15/55/03/228155503.db2.gz	QSXMDARFEQXIOQ-DLBZAZTESA-N	0	0	297.402	4.047	20	30		CIEDRN
Cc1ccc(C(=O)N[C@H](CCCC#N)c2ccccc2)cc1	ZINC000352166579	228190795	/nfs/dbraw/zinc/19/07/95/228190795.db2.gz	OFDROKBIQDCHBA-GOSISDBHSA-N	0	0	292.382	4.160	20	30		CIEDRN
Cc1cccc(C(=O)N[C@H](CCCC#N)c2ccccc2)c1	ZINC000352176093	228191791	/nfs/dbraw/zinc/19/17/91/228191791.db2.gz	ZUZADQNTGXUQBM-GOSISDBHSA-N	0	0	292.382	4.160	20	30		CIEDRN
C[C@@H]1CC=CC[C@H]1C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000352174712	228191821	/nfs/dbraw/zinc/19/18/21/228191821.db2.gz	PDGYFUAIFGKLHR-KBAYOESNSA-N	0	0	296.414	4.140	20	30		CIEDRN
N#CCCC[C@@H](NC(=O)C1=CCCCC1)c1ccccc1	ZINC000352193879	228194975	/nfs/dbraw/zinc/19/49/75/228194975.db2.gz	URLCYOPAIKJBKL-QGZVFWFLSA-N	0	0	282.387	4.038	20	30		CIEDRN
N#CCCC[C@@H](NC(=O)C[C@@H]1C=CCCC1)c1ccccc1	ZINC000352216375	228200657	/nfs/dbraw/zinc/20/06/57/228200657.db2.gz	HKKXTIVIBUETIN-SJLPKXTDSA-N	0	0	296.414	4.284	20	30		CIEDRN
Cc1ccc(Cl)cc1NC(=O)[C@]1(C#N)CC12CCCC2	ZINC000336236701	228219084	/nfs/dbraw/zinc/21/90/84/228219084.db2.gz	ULHJAUUTDXWIAS-MRXNPFEDSA-N	0	0	288.778	4.061	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1ccc(C(F)(F)F)cc1Cl	ZINC000180479812	260104025	/nfs/dbraw/zinc/10/40/25/260104025.db2.gz	RAEPQHQASMTKPX-UHFFFAOYSA-N	0	0	291.700	4.007	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1cccc(-c2nc(C)c(C)o2)c1	ZINC000117003145	260020750	/nfs/dbraw/zinc/02/07/50/260020750.db2.gz	LBYKREHZOXGTGX-LLVKDONJSA-N	0	0	299.374	4.045	20	30		CIEDRN
C=CCCCSc1nnc(-c2ccccc2C)o1	ZINC000117546460	260035909	/nfs/dbraw/zinc/03/59/09/260035909.db2.gz	IJWLGOSZDDKOCE-UHFFFAOYSA-N	0	0	260.362	4.103	20	30		CIEDRN
Cc1ccc(C#N)c(N[C@@H]2CCc3c2cccc3Cl)n1	ZINC000179763697	260068192	/nfs/dbraw/zinc/06/81/92/260068192.db2.gz	CMRLYZAVINEMJR-OAHLLOKOSA-N	0	0	283.762	4.015	20	30		CIEDRN
C=C(C)CN(C)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000180016634	260087283	/nfs/dbraw/zinc/08/72/83/260087283.db2.gz	HYEITMKHFNSMPQ-UHFFFAOYSA-N	0	0	273.163	4.033	20	30		CIEDRN
C=C(C)CN(C)C(=O)[C@H]1C[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000180398128	260100560	/nfs/dbraw/zinc/10/05/60/260100560.db2.gz	BPWFLGOXIYKJPW-RYUDHWBXSA-N	0	0	298.213	4.131	20	30		CIEDRN
C=C(C)CN(C)C(=O)[C@H]1C[C@H]1c1cccc(Cl)c1Cl	ZINC000180399304	260100687	/nfs/dbraw/zinc/10/06/87/260100687.db2.gz	FNLPRKTVDFFAMS-RYUDHWBXSA-N	0	0	298.213	4.131	20	30		CIEDRN
C=C(C)CN(C)C(=O)[C@H]1C[C@H]1c1ccc(Cl)cc1Cl	ZINC000180398500	260100730	/nfs/dbraw/zinc/10/07/30/260100730.db2.gz	OHLCOPBPJCJRPI-STQMWFEESA-N	0	0	298.213	4.131	20	30		CIEDRN
C=C(C)CN(C)C(=O)CCCCCO[C@H]1CCC[C@@H](C)C1	ZINC000180438706	260101843	/nfs/dbraw/zinc/10/18/43/260101843.db2.gz	RHUBDEBGCOWBMN-SJORKVTESA-N	0	0	295.467	4.177	20	30		CIEDRN
C=C(C)CN(C)C(=O)C[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000180446545	260102171	/nfs/dbraw/zinc/10/21/71/260102171.db2.gz	XDFOJXNGNSJWJP-LBPRGKRZSA-N	0	0	299.336	4.234	20	30		CIEDRN
C=C(C)CN(C)C(=O)C[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000180446560	260102482	/nfs/dbraw/zinc/10/24/82/260102482.db2.gz	XDFOJXNGNSJWJP-GFCCVEGCSA-N	0	0	299.336	4.234	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1oc2ccc(Cl)cc2c1C	ZINC000180457208	260102862	/nfs/dbraw/zinc/10/28/62/260102862.db2.gz	ZIYIOMCFBVUPOP-UHFFFAOYSA-N	0	0	277.751	4.043	20	30		CIEDRN
C=C(C)CN(C)C(=O)C[C@@H](C)c1ccccc1C(F)(F)F	ZINC000180464609	260102885	/nfs/dbraw/zinc/10/28/85/260102885.db2.gz	YYKAJFKEKGGXNL-GFCCVEGCSA-N	0	0	299.336	4.234	20	30		CIEDRN
C=CC(C)(C)C(=O)Nc1cc(-c2nc(C)co2)ccc1C	ZINC000297651449	260131300	/nfs/dbraw/zinc/13/13/00/260131300.db2.gz	JEOOVXLCKVAPIN-UHFFFAOYSA-N	0	0	284.359	4.109	20	30		CIEDRN
C[C@H](NCc1ccsc1Cl)c1ccc(C#N)cc1	ZINC000312561326	260149312	/nfs/dbraw/zinc/14/93/12/260149312.db2.gz	TUELEXVUBKWYFX-JTQLQIEISA-N	0	0	276.792	4.124	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cc(C(=O)CC)ccc1Cl	ZINC000298608247	260159380	/nfs/dbraw/zinc/15/93/80/260159380.db2.gz	KJLLFTBCSTYDJX-UHFFFAOYSA-N	0	0	293.794	4.474	20	30		CIEDRN
N#Cc1cc(F)ccc1CSc1ccc(N)cc1Cl	ZINC000071263398	260160865	/nfs/dbraw/zinc/16/08/65/260160865.db2.gz	MLKIYJUQLSXKIL-UHFFFAOYSA-N	0	0	292.766	4.225	20	30		CIEDRN
Cc1ccc(C(F)(F)F)cc1NC(=O)C1(C#N)CCCC1	ZINC000073853545	260164608	/nfs/dbraw/zinc/16/46/08/260164608.db2.gz	ILCLTEWVHJQHJS-UHFFFAOYSA-N	0	0	296.292	4.036	20	30		CIEDRN
C[C@@H](Nc1cccc(C#N)n1)c1ccc(Cl)cc1Cl	ZINC000081595226	260183940	/nfs/dbraw/zinc/18/39/40/260183940.db2.gz	AAOYJKQJHBKIRG-SECBINFHSA-N	0	0	292.169	4.433	20	30		CIEDRN
N#Cc1cc(F)ccc1NC(=O)c1ccc2ccccc2c1	ZINC000317323574	260185547	/nfs/dbraw/zinc/18/55/47/260185547.db2.gz	CQYSGFWZIHZWDW-UHFFFAOYSA-N	0	0	290.297	4.103	20	30		CIEDRN
CCc1ccccc1C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000312808049	260205909	/nfs/dbraw/zinc/20/59/09/260205909.db2.gz	RMTKTEYAPMQWMM-UHFFFAOYSA-N	0	0	284.746	4.026	20	30		CIEDRN
CC1(C)CCCN(c2cc(C#N)c3ccccc3n2)CC1	ZINC000087658072	260216971	/nfs/dbraw/zinc/21/69/71/260216971.db2.gz	XLJNPXFXIRFPMK-UHFFFAOYSA-N	0	0	279.387	4.123	20	30		CIEDRN
Cc1ccoc1CNc1ccc(C(F)(F)F)c(C#N)c1	ZINC000312925128	260222014	/nfs/dbraw/zinc/22/20/14/260222014.db2.gz	DFPSEMCRVVMULK-UHFFFAOYSA-N	0	0	280.249	4.091	20	30		CIEDRN
CC[C@@H]1CC[C@@H](C)N1C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000408091716	260226136	/nfs/dbraw/zinc/22/61/36/260226136.db2.gz	VZVIRPMCQQJQJH-ZWNOBZJWSA-N	0	0	291.782	4.006	20	30		CIEDRN
CC[C@@H]1CC[C@H](C)N1C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000408091708	260226375	/nfs/dbraw/zinc/22/63/75/260226375.db2.gz	VZVIRPMCQQJQJH-GXFFZTMASA-N	0	0	291.782	4.006	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)Nc1ccc2c(c1)Cc1ccccc1-2	ZINC000317451452	260229209	/nfs/dbraw/zinc/22/92/09/260229209.db2.gz	SVPDWJAVQXJOQX-IBGZPJMESA-N	0	0	290.366	4.136	20	30		CIEDRN
N#Cc1cc(C(F)(F)F)ccc1N[C@H]1CC=CCC1	ZINC000088748714	260234394	/nfs/dbraw/zinc/23/43/94/260234394.db2.gz	QBERCKMFVJKPAE-LBPRGKRZSA-N	0	0	266.266	4.098	20	30		CIEDRN
C=CCC[C@H](C(=O)Nc1ccncc1C)c1ccccc1	ZINC000187726506	260253643	/nfs/dbraw/zinc/25/36/43/260253643.db2.gz	CYCHZBXQRHMWBK-INIZCTEOSA-N	0	0	280.371	4.079	20	30		CIEDRN
CC(C)(C)CN(CCC#N)Cc1cnc(C(C)(C)C)s1	ZINC000093101234	260261286	/nfs/dbraw/zinc/26/12/86/260261286.db2.gz	YINCPOCUNWBEDM-UHFFFAOYSA-N	0	0	293.480	4.202	20	30		CIEDRN
CCCc1nc(COc2c(C)cc(C#N)cc2C)cs1	ZINC000088154541	260278089	/nfs/dbraw/zinc/27/80/89/260278089.db2.gz	FBIGVYVEQRNLMF-UHFFFAOYSA-N	0	0	286.400	4.163	20	30		CIEDRN
Cc1ccc(C#N)cc1NCc1cnc2ccccc2c1	ZINC000313320853	260283536	/nfs/dbraw/zinc/28/35/36/260283536.db2.gz	WKZHUTABYVWWRS-UHFFFAOYSA-N	0	0	273.339	4.027	20	30		CIEDRN
Cc1cc(C)c(-c2nnc(SCCCC#N)o2)c(C)c1	ZINC000075457033	260291048	/nfs/dbraw/zinc/29/10/48/260291048.db2.gz	KSFOXEVGHCFMOS-UHFFFAOYSA-N	0	0	287.388	4.058	20	30		CIEDRN
N#CCc1cccc(N[C@@H]2CCC[C@H](C(F)(F)F)C2)c1	ZINC000313427919	260293079	/nfs/dbraw/zinc/29/30/79/260293079.db2.gz	NPRSUEKSVBSLMC-GXTWGEPZSA-N	0	0	282.309	4.286	20	30		CIEDRN
Cc1cc(C)c(CNc2cccc(CC#N)c2)cc1C	ZINC000313438697	260294536	/nfs/dbraw/zinc/29/45/36/260294536.db2.gz	PYVRRFVKDSZXJY-UHFFFAOYSA-N	0	0	264.372	4.290	20	30		CIEDRN
Cc1cc2cccnc2c(NC2CCC(C)(C#N)CC2)c1	ZINC000449210235	260295682	/nfs/dbraw/zinc/29/56/82/260295682.db2.gz	GXIMFDGMGQKQBP-UHFFFAOYSA-N	0	0	279.387	4.428	20	30		CIEDRN
N#CCc1cccc(NC[C@@H]2CCC3(CCCCC3)O2)c1	ZINC000313454575	260295745	/nfs/dbraw/zinc/29/57/45/260295745.db2.gz	WCQYHEVDQHUQSG-KRWDZBQOSA-N	0	0	284.403	4.046	20	30		CIEDRN
Cc1ccc(C)c(NC(=O)N(CCC#N)CCC(C)C)c1	ZINC000078438003	260300327	/nfs/dbraw/zinc/30/03/27/260300327.db2.gz	CQZFNQLHQTXKGR-UHFFFAOYSA-N	0	0	287.407	4.097	20	30		CIEDRN
CC(C)[C@H](C(=O)Nc1ccc(CC#N)cc1)c1ccccc1	ZINC000079319273	260303707	/nfs/dbraw/zinc/30/37/07/260303707.db2.gz	ONJMSRZDKGQKBX-SFHVURJKSA-N	0	0	292.382	4.131	20	30		CIEDRN
C=C1CCN(C(=O)c2ccccc2Cc2ccccc2)CC1	ZINC000517805379	260308051	/nfs/dbraw/zinc/30/80/51/260308051.db2.gz	DHNKIQMFYMTLFA-UHFFFAOYSA-N	0	0	291.394	4.070	20	30		CIEDRN
N#CCc1ccc(NC(=O)CCCC2CCCCC2)cc1	ZINC000008126124	260309349	/nfs/dbraw/zinc/30/93/49/260309349.db2.gz	OQVDXZOXXJPVHT-UHFFFAOYSA-N	0	0	284.403	4.442	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1ccc(CCCC)cc1	ZINC000517896755	260315692	/nfs/dbraw/zinc/31/56/92/260315692.db2.gz	SAGXWYCIZFRFON-UHFFFAOYSA-N	0	0	274.408	4.459	20	30		CIEDRN
C(#Cc1ccccc1)CNc1ccc(-c2ccccn2)cc1	ZINC000520908447	260315765	/nfs/dbraw/zinc/31/57/65/260315765.db2.gz	RHRNBSWLVVSZII-UHFFFAOYSA-N	0	0	284.362	4.212	20	30		CIEDRN
Cc1cc(Br)ccc1NCCC(C)(C)C#N	ZINC000083637611	260353935	/nfs/dbraw/zinc/35/39/35/260353935.db2.gz	HHDCUQWNSPILJI-UHFFFAOYSA-N	0	0	281.197	4.109	20	30		CIEDRN
CC(C)(C#N)CCNc1cc(Cl)cc(Cl)c1	ZINC000083637766	260354234	/nfs/dbraw/zinc/35/42/34/260354234.db2.gz	PWXYMHADABSGGO-UHFFFAOYSA-N	0	0	257.164	4.345	20	30		CIEDRN
C=CCN1C(=O)c2ccccc2N[C@H]1c1cccc(C)c1C	ZINC000518216731	260356900	/nfs/dbraw/zinc/35/69/00/260356900.db2.gz	NKRDNDUNQKISPD-GOSISDBHSA-N	0	0	292.382	4.056	20	30		CIEDRN
CC(C)c1ccc(NCc2cccc(C#N)c2F)cc1	ZINC000223729813	260357657	/nfs/dbraw/zinc/35/76/57/260357657.db2.gz	GVHASABVFWARDJ-UHFFFAOYSA-N	0	0	268.335	4.433	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1cc2sccc2s1	ZINC000518225329	260360397	/nfs/dbraw/zinc/36/03/97/260360397.db2.gz	HBAVBOFEGRUGHZ-UHFFFAOYSA-N	0	0	265.403	4.001	20	30		CIEDRN
C[C@H](CC#N)N(C)C(=O)Nc1cccc(-c2cccs2)c1	ZINC000086285004	260388620	/nfs/dbraw/zinc/38/86/20/260388620.db2.gz	SYOHPNWSQMAQNR-GFCCVEGCSA-N	0	0	299.399	4.181	20	30		CIEDRN
CC[C@@H](Nc1ccc(C#N)cc1F)c1ccc(OC)cc1	ZINC000094195323	260389737	/nfs/dbraw/zinc/38/97/37/260389737.db2.gz	IFRBLXQYRDTZDN-MRXNPFEDSA-N	0	0	284.334	4.269	20	30		CIEDRN
CC[C@H](Nc1ccc(C#N)cc1F)c1ccc(OC)cc1	ZINC000094195322	260389851	/nfs/dbraw/zinc/38/98/51/260389851.db2.gz	IFRBLXQYRDTZDN-INIZCTEOSA-N	0	0	284.334	4.269	20	30		CIEDRN
CCC[C@H](NC(=O)c1sccc1C#N)C1CCCCC1	ZINC000409495756	260412712	/nfs/dbraw/zinc/41/27/12/260412712.db2.gz	OXOQLPZKTRMEKF-AWEZNQCLSA-N	0	0	290.432	4.099	20	30		CIEDRN
Cc1ccc(C#N)cc1NCc1cccc(C(F)F)c1	ZINC000131838303	260417398	/nfs/dbraw/zinc/41/73/98/260417398.db2.gz	QZRRGSNMXOXCNJ-UHFFFAOYSA-N	0	0	272.298	4.416	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)CC1CC(c2ccccc2)C1	ZINC000410132794	260464408	/nfs/dbraw/zinc/46/44/08/260464408.db2.gz	FBLGEZMFBOYUQT-PREGVCBESA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1ccc(Cl)c(Cl)c1	ZINC000410141439	260465903	/nfs/dbraw/zinc/46/59/03/260465903.db2.gz	GSLLGEZJHROKIW-JTQLQIEISA-N	0	0	272.175	4.078	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000410149992	260467502	/nfs/dbraw/zinc/46/75/02/260467502.db2.gz	YSHOGRATWRTHTD-BXUZGUMPSA-N	0	0	299.336	4.280	20	30		CIEDRN
C=CCC1(C(=O)NCC[C@@H](C)c2ccccc2)CCC1	ZINC000410216111	260473129	/nfs/dbraw/zinc/47/31/29/260473129.db2.gz	CRWFWTILJGOWPJ-OAHLLOKOSA-N	0	0	271.404	4.043	20	30		CIEDRN
CC(C)n1c2ccc(Cl)cc2nc1-c1ccc(C#N)o1	ZINC000524728602	260473750	/nfs/dbraw/zinc/47/37/50/260473750.db2.gz	BGCFRWDSDDUTGD-UHFFFAOYSA-N	0	0	285.734	4.402	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@@H](C)c1ccc(SC)cc1	ZINC000410233637	260474015	/nfs/dbraw/zinc/47/40/15/260474015.db2.gz	KBKSRTKWFCQIMM-LRDDRELGSA-N	0	0	277.433	4.188	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)[C@](C)(C=C)CC	ZINC000410364568	260491154	/nfs/dbraw/zinc/49/11/54/260491154.db2.gz	IMKIXBFVUNGALN-QGZVFWFLSA-N	0	0	257.377	4.346	20	30		CIEDRN
N#Cc1ccc(F)c(COc2ccc(Cl)c(F)c2)c1	ZINC000133328460	260519346	/nfs/dbraw/zinc/51/93/46/260519346.db2.gz	SZFBYWJXCXRIMC-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
Cc1cscc1CNc1ccc(C#N)c(Cl)c1	ZINC000094878105	260549890	/nfs/dbraw/zinc/54/98/90/260549890.db2.gz	MNCANKPMJYNWMW-UHFFFAOYSA-N	0	0	262.765	4.194	20	30		CIEDRN
C=CCC[C@@H](C(=O)NCC(C)(C)CC)c1ccccc1	ZINC000428251730	260554895	/nfs/dbraw/zinc/55/48/95/260554895.db2.gz	YCBMNZPQXONEOS-MRXNPFEDSA-N	0	0	273.420	4.289	20	30		CIEDRN
C/C(=C\c1ccccc1)CN(C)C(=O)C1(C#N)CCCCC1	ZINC000427216595	260572396	/nfs/dbraw/zinc/57/23/96/260572396.db2.gz	GEKXMYKFLRZOMD-DTQAZKPQSA-N	0	0	296.414	4.022	20	30		CIEDRN
C=C(C)CN(C)C(=O)Nc1ccccc1-c1ccccc1	ZINC000181503323	260585097	/nfs/dbraw/zinc/58/50/97/260585097.db2.gz	CKIVNUXGEUPJKR-UHFFFAOYSA-N	0	0	280.371	4.393	20	30		CIEDRN
CCC1CCC(c2noc(C3(C#N)CCCC3)n2)CC1	ZINC000408227721	260680828	/nfs/dbraw/zinc/68/08/28/260680828.db2.gz	YMNHQEQKPNNIEG-UHFFFAOYSA-N	0	0	273.380	4.089	20	30		CIEDRN
CCSCc1ccc(N[C@H]2CCC[C@@H](C#N)C2)cc1	ZINC000449602881	260755003	/nfs/dbraw/zinc/75/50/03/260755003.db2.gz	UVZFYYNWEOFHQY-ZBFHGGJFSA-N	0	0	274.433	4.434	20	30		CIEDRN
CC(C)(C#N)c1ccccc1CN(CC(F)(F)F)C1CC1	ZINC000125973923	260772533	/nfs/dbraw/zinc/77/25/33/260772533.db2.gz	BPVULRJGUYAXMG-UHFFFAOYSA-N	0	0	296.336	4.014	20	30		CIEDRN
CC(C)C[C@H]1CCCN(C(=O)Nc2ccc(CC#N)cc2)C1	ZINC000127870781	260808503	/nfs/dbraw/zinc/80/85/03/260808503.db2.gz	PAZGOAJRKFCMTB-MRXNPFEDSA-N	0	0	299.418	4.043	20	30		CIEDRN
C=CCCCNc1cc(C(=O)N(C)C(C)C)ccc1Cl	ZINC000157185155	260828608	/nfs/dbraw/zinc/82/86/08/260828608.db2.gz	BFNYPIAKYCOFDO-UHFFFAOYSA-N	0	0	294.826	4.199	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Nc1ccccc1COC	ZINC000158189786	260876529	/nfs/dbraw/zinc/87/65/29/260876529.db2.gz	NIPFTLGOSVFCFF-UHFFFAOYSA-N	0	0	290.407	4.043	20	30		CIEDRN
C[C@@H](C(=O)Nc1ccc(C(C)(C)C#N)cc1)c1cccs1	ZINC000151822971	261056135	/nfs/dbraw/zinc/05/61/35/261056135.db2.gz	YJLOXWNSWIZCSR-GFCCVEGCSA-N	0	0	298.411	4.291	20	30		CIEDRN
C[C@@H](CC#N)Sc1ccccc1NCC1CCC1	ZINC000152723555	261068796	/nfs/dbraw/zinc/06/87/96/261068796.db2.gz	ZWNAQSJDWQEOPV-LBPRGKRZSA-N	0	0	260.406	4.293	20	30		CIEDRN
CC(C)c1cccc(C(C)C)c1NC(=O)N[C@H](C)CC#N	ZINC000153245606	261075852	/nfs/dbraw/zinc/07/58/52/261075852.db2.gz	MIVWELXLXDSHFP-CYBMUJFWSA-N	0	0	287.407	4.357	20	30		CIEDRN
C[C@@H](C(=O)N[C@@H](CCC#N)c1ccccc1)c1cccs1	ZINC000153576169	261080298	/nfs/dbraw/zinc/08/02/98/261080298.db2.gz	KTZATSDPTFWIAK-HIFRSBDPSA-N	0	0	298.411	4.013	20	30		CIEDRN
N#Cc1ccc(CN[C@@H](c2ccccc2F)C2CCCC2)o1	ZINC000154237912	261089846	/nfs/dbraw/zinc/08/98/46/261089846.db2.gz	HMFFAUYCNOFSRC-GOSISDBHSA-N	0	0	298.361	4.311	20	30		CIEDRN
CC[C@@H](CC#N)NC(=O)Nc1ccccc1-c1cccs1	ZINC000155635479	261105491	/nfs/dbraw/zinc/10/54/91/261105491.db2.gz	ZFGJPXJMEBNZKZ-LBPRGKRZSA-N	0	0	299.399	4.229	20	30		CIEDRN
N#Cc1ccc(Cl)cc1OCc1cccc2cccnc21	ZINC000161646864	261107918	/nfs/dbraw/zinc/10/79/18/261107918.db2.gz	UILMBKOGBMFAEO-UHFFFAOYSA-N	0	0	294.741	4.339	20	30		CIEDRN
C=CCCCC[C@@H](C)Nc1cccc(N(C)C(C)=O)c1	ZINC000449047042	261126353	/nfs/dbraw/zinc/12/63/53/261126353.db2.gz	PWKWCLCOXAAKLR-CQSZACIVSA-N	0	0	274.408	4.216	20	30		CIEDRN
C=CCCCNC(=O)N1CCCC[C@@H]1c1ccc(F)cc1	ZINC000448380963	261135433	/nfs/dbraw/zinc/13/54/33/261135433.db2.gz	BJEDHPNRQFERRM-MRXNPFEDSA-N	0	0	290.382	4.029	20	30		CIEDRN
C=CCCCNC(=O)N1CCCC[C@H]1c1ccc(F)cc1	ZINC000448380962	261135471	/nfs/dbraw/zinc/13/54/71/261135471.db2.gz	BJEDHPNRQFERRM-INIZCTEOSA-N	0	0	290.382	4.029	20	30		CIEDRN
CC[C@H]1CCCCCN1C(=O)Nc1cc(C#N)ccc1C	ZINC000172443617	261155719	/nfs/dbraw/zinc/15/57/19/261155719.db2.gz	WXIUKWQAQCUUFO-HNNXBMFYSA-N	0	0	285.391	4.053	20	30		CIEDRN
C#CCN(CC)C(=O)Nc1c(CCC)cccc1C(C)C	ZINC000490740796	261196381	/nfs/dbraw/zinc/19/63/81/261196381.db2.gz	QZPRCZASNHCMQK-UHFFFAOYSA-N	0	0	286.419	4.250	20	30		CIEDRN
CC#CCCn1c(COc2ccccc2)nc2ccccc21	ZINC000462370007	261196509	/nfs/dbraw/zinc/19/65/09/261196509.db2.gz	PBEQZZRBYSQONZ-UHFFFAOYSA-N	0	0	290.366	4.029	20	30		CIEDRN
CCOc1ccc(CNc2c(Cl)cccc2C#N)cc1	ZINC000462372426	261198249	/nfs/dbraw/zinc/19/82/49/261198249.db2.gz	JAGWQPRIEIOUTD-UHFFFAOYSA-N	0	0	286.762	4.222	20	30		CIEDRN
C[C@H](C(=O)Nc1cccc(C#N)c1)c1ccc(Cl)s1	ZINC000174923864	261201291	/nfs/dbraw/zinc/20/12/91/261201291.db2.gz	YCTOVZPCRVQUNF-VIFPVBQESA-N	0	0	290.775	4.015	20	30		CIEDRN
C=C[C@@H](C)NC(=O)N(CC1CCC1)[C@H](C)c1ccccc1	ZINC000464757136	261220705	/nfs/dbraw/zinc/22/07/05/261220705.db2.gz	UJHSVEAXBZYBSJ-HUUCEWRRSA-N	0	0	286.419	4.134	20	30		CIEDRN
N#Cc1c(F)cccc1N[C@H]1CCO[C@H](c2ccccc2)C1	ZINC000160685470	261222120	/nfs/dbraw/zinc/22/21/20/261222120.db2.gz	YKJVSJBLKVKNHG-KSSFIOAISA-N	0	0	296.345	4.030	20	30		CIEDRN
Cc1cccc(NC(=O)c2cccc(SCC#N)c2)c1C	ZINC000175494474	261229454	/nfs/dbraw/zinc/22/94/54/261229454.db2.gz	AVHOSGCKDMPCSB-UHFFFAOYSA-N	0	0	296.395	4.171	20	30		CIEDRN
Cc1nc(CN(Cc2ccc(C#N)cc2)C(C)C)sc1C	ZINC000176337991	261277255	/nfs/dbraw/zinc/27/72/55/261277255.db2.gz	BXAASEJRRBTELR-UHFFFAOYSA-N	0	0	299.443	4.042	20	30		CIEDRN
N#Cc1ccc(SCC[C@H]2CCCC2=O)c(Cl)c1	ZINC000163283572	261310951	/nfs/dbraw/zinc/31/09/51/261310951.db2.gz	QNQANVGKWKTHRA-LLVKDONJSA-N	0	0	279.792	4.063	20	30		CIEDRN
CC(=O)CCCCSc1ccc(C#N)cc1Cl	ZINC000163310759	261311687	/nfs/dbraw/zinc/31/16/87/261311687.db2.gz	NVAITTRDUFAMHN-UHFFFAOYSA-N	0	0	267.781	4.063	20	30		CIEDRN
Cc1c(CSc2cccc(C#N)c2)cccc1[N+](=O)[O-]	ZINC000177096904	261332254	/nfs/dbraw/zinc/33/22/54/261332254.db2.gz	FZNRHQXEBZUPML-UHFFFAOYSA-N	0	0	284.340	4.067	20	30		CIEDRN
C=CCCC[C@@H](C)Nc1nc(C(F)(F)F)ccc1C#N	ZINC000301988540	261345205	/nfs/dbraw/zinc/34/52/05/261345205.db2.gz	DXHUVORHVFGJAK-SNVBAGLBSA-N	0	0	283.297	4.129	20	30		CIEDRN
Cc1cc(N[C@@H](CCC#N)c2ccccc2)nc(C2CC2)n1	ZINC000164346141	261348542	/nfs/dbraw/zinc/34/85/42/261348542.db2.gz	IVHMWZDOQYVHHH-INIZCTEOSA-N	0	0	292.386	4.119	20	30		CIEDRN
Cc1cc(N[C@H](CCC#N)c2ccccc2)nc(C2CC2)n1	ZINC000164346262	261348658	/nfs/dbraw/zinc/34/86/58/261348658.db2.gz	IVHMWZDOQYVHHH-MRXNPFEDSA-N	0	0	292.386	4.119	20	30		CIEDRN
C[C@H](NCc1ccc(C#N)cc1)c1c(F)cccc1Cl	ZINC000177714328	261367938	/nfs/dbraw/zinc/36/79/38/261367938.db2.gz	BBGMQIRLGVHGJI-NSHDSACASA-N	0	0	288.753	4.202	20	30		CIEDRN
N#Cc1ccc(OC/C=C/c2ccccc2)c(Cl)c1	ZINC000007857163	261383989	/nfs/dbraw/zinc/38/39/89/261383989.db2.gz	WDEKGEDBFNBFAT-QPJJXVBHSA-N	0	0	269.731	4.304	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)C[C@H](C)c1ccccc1F	ZINC000178380325	261388808	/nfs/dbraw/zinc/38/88/08/261388808.db2.gz	VVANWIPPSGLOQJ-LBPRGKRZSA-N	0	0	296.345	4.138	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)c1cc2c(s1)CCCC2	ZINC000178389103	261389168	/nfs/dbraw/zinc/38/91/68/261389168.db2.gz	MGCYEFZIUIROBV-UHFFFAOYSA-N	0	0	296.395	4.059	20	30		CIEDRN
CCN(C(=O)c1ccc(C#N)cc1C)c1cc(C)ccc1C	ZINC000178602284	261399025	/nfs/dbraw/zinc/39/90/25/261399025.db2.gz	HEKISDPHPWEMLT-UHFFFAOYSA-N	0	0	292.382	4.150	20	30		CIEDRN
CSc1cccc(NC(=O)Nc2cccc(C#N)c2C)c1	ZINC000178579912	261399147	/nfs/dbraw/zinc/39/91/47/261399147.db2.gz	BPUPOCSKACJMDZ-UHFFFAOYSA-N	0	0	297.383	4.233	20	30		CIEDRN
Cc1cccc(N[C@H](C)c2cccc(C#N)c2)c1F	ZINC000179928322	261420437	/nfs/dbraw/zinc/42/04/37/261420437.db2.gz	FQNXHAYOSPKWQH-GFCCVEGCSA-N	0	0	254.308	4.179	20	30		CIEDRN
N#CCCCCNC(=O)N1CCCCC[C@@H]1c1ccccc1	ZINC000171449014	261465842	/nfs/dbraw/zinc/46/58/42/261465842.db2.gz	KJAXCYYZQVMWHE-QGZVFWFLSA-N	0	0	299.418	4.007	20	30		CIEDRN
CCCC[C@H](CC)Cn1cc(C#N)c(=O)c2ccccc21	ZINC000171555190	261471154	/nfs/dbraw/zinc/47/11/54/261471154.db2.gz	YYROSHGUSFFCNP-AWEZNQCLSA-N	0	0	282.387	4.090	20	30		CIEDRN
CC(=O)CCCSc1ccc(C#N)c(C(F)(F)F)c1	ZINC000181064457	261883831	/nfs/dbraw/zinc/88/38/31/261883831.db2.gz	LVHRGADRGBQHRI-UHFFFAOYSA-N	0	0	287.306	4.038	20	30		CIEDRN
CCCCCCCC(=O)NC[C@H](C)c1ncc(C)s1	ZINC000184051479	262006648	/nfs/dbraw/zinc/00/66/48/262006648.db2.gz	ZTRHNDZZUSAHAA-LBPRGKRZSA-N	0	0	282.453	4.032	20	30		CIEDRN
Cc1cncc([C@H](C)Nc2cccc(OCCCC#N)c2)c1	ZINC000184437543	262020590	/nfs/dbraw/zinc/02/05/90/262020590.db2.gz	JYNAFUSLKCNCKY-HNNXBMFYSA-N	0	0	295.386	4.246	20	30		CIEDRN
CC(C)C[C@@H](C)C(=O)Nc1ccccc1SCCC#N	ZINC000185349028	262051896	/nfs/dbraw/zinc/05/18/96/262051896.db2.gz	QMXZJPSPXQDUQV-CYBMUJFWSA-N	0	0	290.432	4.313	20	30		CIEDRN
N#C[C@@H]1CCC[C@H](Nc2ccc(SC(F)F)cc2)C1	ZINC000185734770	262068808	/nfs/dbraw/zinc/06/88/08/262068808.db2.gz	LCTIKPNXLVCGBG-PWSUYJOCSA-N	0	0	282.359	4.496	20	30		CIEDRN
N#C[C@H]1CCC[C@H](Nc2ccc(SC(F)F)cc2)C1	ZINC000185734730	262068809	/nfs/dbraw/zinc/06/88/09/262068809.db2.gz	LCTIKPNXLVCGBG-JQWIXIFHSA-N	0	0	282.359	4.496	20	30		CIEDRN
C/C(=C\C(C)(C)C)C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000185785860	262070903	/nfs/dbraw/zinc/07/09/03/262070903.db2.gz	MDJXCIKRVRWVCF-FIFPYPGSSA-N	0	0	284.403	4.140	20	30		CIEDRN
CCCCCCCC(=O)NC[C@H](C)c1nc(C)cs1	ZINC000186028857	262076479	/nfs/dbraw/zinc/07/64/79/262076479.db2.gz	USYYMQWRGZEICC-LBPRGKRZSA-N	0	0	282.453	4.032	20	30		CIEDRN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)C[C@@H]1C=CCCC1	ZINC000186517958	262096064	/nfs/dbraw/zinc/09/60/64/262096064.db2.gz	NASBNAPHWACXPS-MRXNPFEDSA-N	0	0	296.414	4.042	20	30		CIEDRN
CC[C@@H](C#N)Sc1nc2cc(F)cc(Cl)c2o1	ZINC000187996078	262147307	/nfs/dbraw/zinc/14/73/07/262147307.db2.gz	UEQNNPGNIKAPKE-ZETCQYMHSA-N	0	0	270.716	4.015	20	30		CIEDRN
Cc1coc(SCc2ccccc2C(C)(C)C#N)n1	ZINC000188345137	262154582	/nfs/dbraw/zinc/15/45/82/262154582.db2.gz	OSASAFOCBJCYKI-UHFFFAOYSA-N	0	0	272.373	4.077	20	30		CIEDRN
N#Cc1ccc(Oc2ccccc2[N+](=O)[O-])c2ccccc12	ZINC000319186821	262182924	/nfs/dbraw/zinc/18/29/24/262182924.db2.gz	LBOAKZISBFLAQJ-UHFFFAOYSA-N	0	0	290.278	4.412	20	30		CIEDRN
Cc1cc(COc2cc(F)cc(C#N)c2)c2ccccc2n1	ZINC000319193491	262183223	/nfs/dbraw/zinc/18/32/23/262183223.db2.gz	MEDQJAIDNIMIRF-UHFFFAOYSA-N	0	0	292.313	4.133	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cccc(O[C@H](C)CC)c1	ZINC000497634572	262183922	/nfs/dbraw/zinc/18/39/22/262183922.db2.gz	SHRBVQSYQHDADF-UONOGXRCSA-N	0	0	275.392	4.405	20	30		CIEDRN
C=CCn1cccc1C(=O)Nc1cccc(O[C@@H](C)CC)c1	ZINC000497659876	262185981	/nfs/dbraw/zinc/18/59/81/262185981.db2.gz	HDIJTWXMGMGZMF-AWEZNQCLSA-N	0	0	298.386	4.104	20	30		CIEDRN
Cc1ccc(SCc2ccccc2C#N)cc1C	ZINC000020016706	262186148	/nfs/dbraw/zinc/18/61/48/262186148.db2.gz	KZSNXKZWNUCJBD-UHFFFAOYSA-N	0	0	253.370	4.467	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@@H](CC)c1ccc(Cl)s1	ZINC000497663851	262186460	/nfs/dbraw/zinc/18/64/60/262186460.db2.gz	VZVBJPHJDDJKRS-JTQLQIEISA-N	0	0	286.828	4.070	20	30		CIEDRN
C[C@@H](Sc1cc(C#N)ccn1)c1ccc(Cl)cc1	ZINC000497671078	262187881	/nfs/dbraw/zinc/18/78/81/262187881.db2.gz	KJXREAVUZUGQNX-SNVBAGLBSA-N	0	0	274.776	4.460	20	30		CIEDRN
C[C@H](NC(=O)CC(C)(C)C#N)c1cc2ccccc2s1	ZINC000497679117	262189037	/nfs/dbraw/zinc/18/90/37/262189037.db2.gz	DYUCELSCLCPKSH-NSHDSACASA-N	0	0	286.400	4.018	20	30		CIEDRN
CC#CCCNC(=O)Nc1ccccc1Oc1ccccc1	ZINC000497681008	262189426	/nfs/dbraw/zinc/18/94/26/262189426.db2.gz	UXCMTAQSJXTKCF-UHFFFAOYSA-N	0	0	294.354	4.014	20	30		CIEDRN
CCCCCOc1ccc(Oc2ncccc2C#N)cc1	ZINC000497722150	262195884	/nfs/dbraw/zinc/19/58/84/262195884.db2.gz	KWWYOBYTNWJJKA-UHFFFAOYSA-N	0	0	282.343	4.315	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H]1c1ccc(C)cc1	ZINC000364300140	262196982	/nfs/dbraw/zinc/19/69/82/262196982.db2.gz	AZMHGMGFSDBNFV-NVXWUHKLSA-N	0	0	271.404	4.261	20	30		CIEDRN
CC(C)(CCC#N)CNc1ccc(N2C[C@H]3CC[C@@H]2C3)cc1	ZINC000192217913	262200174	/nfs/dbraw/zinc/20/01/74/262200174.db2.gz	FGDSWXHCDTTYBN-MAUKXSAKSA-N	0	0	297.446	4.417	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)C[C@@H]1CCC[C@H](C)C1	ZINC000497796404	262210104	/nfs/dbraw/zinc/21/01/04/262210104.db2.gz	BAAITUGGSZJXDH-FUHWJXTLSA-N	0	0	285.431	4.418	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)c1ccc(C)c(C)c1	ZINC000497796997	262210297	/nfs/dbraw/zinc/21/02/97/262210297.db2.gz	OGNJONBXSXDBHU-UHFFFAOYSA-N	0	0	279.383	4.132	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)C[C@H]1CCC[C@@H](C)C1	ZINC000497796403	262210352	/nfs/dbraw/zinc/21/03/52/262210352.db2.gz	BAAITUGGSZJXDH-AEFFLSMTSA-N	0	0	285.431	4.418	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)c1cc(C)c(C)s1	ZINC000497796653	262210353	/nfs/dbraw/zinc/21/03/53/262210353.db2.gz	FHFLDUHWNMFWMW-UHFFFAOYSA-N	0	0	285.412	4.193	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)c1sccc1CC	ZINC000497799685	262211687	/nfs/dbraw/zinc/21/16/87/262211687.db2.gz	WUEHDOQADGQKDI-UHFFFAOYSA-N	0	0	285.412	4.139	20	30		CIEDRN
N#C[C@H]1CCC[C@H](Nc2ccc3oc(C4CC4)nc3c2)C1	ZINC000193083945	262215386	/nfs/dbraw/zinc/21/53/86/262215386.db2.gz	AYYSQRCPXHMKPZ-AAEUAGOBSA-N	0	0	281.359	4.199	20	30		CIEDRN
CC(C)OCc1ccc(N[C@H]2CCC[C@H](C#N)C2)cc1	ZINC000193087002	262216009	/nfs/dbraw/zinc/21/60/09/262216009.db2.gz	RSQMQBNLTAZQAM-RDJZCZTQSA-N	0	0	272.392	4.106	20	30		CIEDRN
CC(C)n1ncc2ccc(N[C@@H]3CCC[C@@H](C#N)C3)cc21	ZINC000193207034	262217936	/nfs/dbraw/zinc/21/79/36/262217936.db2.gz	MACABQRACSGRDW-UKRRQHHQSA-N	0	0	282.391	4.111	20	30		CIEDRN
Cc1ccc(N[C@@H]2CCC[C@H](C#N)C2)cc1-c1ncco1	ZINC000193268172	262219044	/nfs/dbraw/zinc/21/90/44/262219044.db2.gz	ZOPOECXOTPZFCK-UONOGXRCSA-N	0	0	281.359	4.144	20	30		CIEDRN
C=CCOc1ccc(CNc2cc(F)ccc2F)cc1	ZINC000020544397	262249085	/nfs/dbraw/zinc/24/90/85/262249085.db2.gz	IGBQSPIYRSRALH-UHFFFAOYSA-N	0	0	275.298	4.142	20	30		CIEDRN
CC(C)c1nc(CN(CCC#N)CC(C)(C)C)cs1	ZINC000111250476	262257940	/nfs/dbraw/zinc/25/79/40/262257940.db2.gz	FYOVXFAEDSPKPI-UHFFFAOYSA-N	0	0	279.453	4.028	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@@H](c3ccc(C)cc3)C2)CCC1	ZINC000365084238	262277155	/nfs/dbraw/zinc/27/71/55/262277155.db2.gz	ILQXNGLUUZGDFE-QGZVFWFLSA-N	0	0	283.415	4.057	20	30		CIEDRN
C=CCC1(C(=O)N2C[C@H](c3cccs3)C[C@H]2C)CCC1	ZINC000365153178	262280547	/nfs/dbraw/zinc/28/05/47/262280547.db2.gz	ACWFTZYDTZHOAJ-ZIAGYGMSSA-N	0	0	289.444	4.199	20	30		CIEDRN
C=CCC1(C(=O)N2C[C@@H](c3cccs3)C[C@@H]2C)CCC1	ZINC000365153168	262280643	/nfs/dbraw/zinc/28/06/43/262280643.db2.gz	ACWFTZYDTZHOAJ-KBPBESRZSA-N	0	0	289.444	4.199	20	30		CIEDRN
C[C@@H](CCC#N)Sc1nccn1-c1cccc(Cl)c1	ZINC000188259933	262287384	/nfs/dbraw/zinc/28/73/84/262287384.db2.gz	CQAIIQKENIWYPV-NSHDSACASA-N	0	0	291.807	4.310	20	30		CIEDRN
C[C@@H](CCC#N)Sc1ccccc1Br	ZINC000188276162	262288047	/nfs/dbraw/zinc/28/80/47/262288047.db2.gz	FQACHCIRHHDFTH-VIFPVBQESA-N	0	0	270.195	4.233	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1cc(OC)ccc1F)c1ccccc1	ZINC000188512750	262305180	/nfs/dbraw/zinc/30/51/80/262305180.db2.gz	DIKHFRNBUNUHEC-OAHLLOKOSA-N	0	0	299.345	4.133	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1ccc(F)c(C)c1)c1ccccc1	ZINC000488366025	262315500	/nfs/dbraw/zinc/31/55/00/262315500.db2.gz	KSFFUFNRAOIZMM-INIZCTEOSA-N	0	0	283.346	4.433	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N(C)Cc1ccc(Cl)c(F)c1	ZINC000188554338	262316162	/nfs/dbraw/zinc/31/61/62/262316162.db2.gz	WFNOLKNJLBKYHP-HNNXBMFYSA-N	0	0	283.774	4.040	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](c2cc(C)cc(C)c2)C1	ZINC000188581692	262319154	/nfs/dbraw/zinc/31/91/54/262319154.db2.gz	GKBUQBWGMJHDME-LPHOPBHVSA-N	0	0	285.431	4.222	20	30		CIEDRN
C=CCCC(=O)N1CCC[C@]1(c1ccccc1)C(F)(F)F	ZINC000162140324	262325004	/nfs/dbraw/zinc/32/50/04/262325004.db2.gz	BGKXKCKLURAOIQ-HNNXBMFYSA-N	0	0	297.320	4.033	20	30		CIEDRN
C=CCCCSCC(=O)N[C@@H](c1ccccc1)C(C)C	ZINC000522756385	262338632	/nfs/dbraw/zinc/33/86/32/262338632.db2.gz	TURRZHDYVPLDOH-QGZVFWFLSA-N	0	0	291.460	4.199	20	30		CIEDRN
N#Cc1cc(Cl)ccc1N[C@@H]1CSc2ccccc21	ZINC000522758662	262339061	/nfs/dbraw/zinc/33/90/61/262339061.db2.gz	HWOYWXWUXMPHGC-CQSZACIVSA-N	0	0	286.787	4.471	20	30		CIEDRN
C=CCCCSCC(=O)Nc1cccc(SC)c1	ZINC000117944666	262366612	/nfs/dbraw/zinc/36/66/12/262366612.db2.gz	OZNJMFSEVDZQJM-UHFFFAOYSA-N	0	0	281.446	4.046	20	30		CIEDRN
CC(C)CN(C(=O)[C@@H](C)c1cccc(C#N)c1)C1CCCC1	ZINC000462244350	262384927	/nfs/dbraw/zinc/38/49/27/262384927.db2.gz	LBOUVQDLOGFYFH-HNNXBMFYSA-N	0	0	298.430	4.089	20	30		CIEDRN
N#Cc1cccc(COc2ccccc2-c2nccs2)c1	ZINC000187221978	262393096	/nfs/dbraw/zinc/39/30/96/262393096.db2.gz	NPEKCOFUDJZZMB-UHFFFAOYSA-N	0	0	292.363	4.261	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@@H]1CC[C@@H]2CCCC[C@H]2C1	ZINC000488812944	262395692	/nfs/dbraw/zinc/39/56/92/262395692.db2.gz	FVVVTBKDPAVGBB-MWDXBVQZSA-N	0	0	275.436	4.160	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1ccc(C2CCC2)cc1	ZINC000488811494	262396489	/nfs/dbraw/zinc/39/64/89/262396489.db2.gz	BURCQQPDQBTBHG-QGZVFWFLSA-N	0	0	269.388	4.135	20	30		CIEDRN
N#Cc1ccc(N2CC[C@@H](c3ccccc3)C2)cc1Cl	ZINC000061851207	262403820	/nfs/dbraw/zinc/40/38/20/262403820.db2.gz	PCCJKYYQCCXVPP-OAHLLOKOSA-N	0	0	282.774	4.206	20	30		CIEDRN
Cc1ccc(Oc2ccc(C#N)cc2Cl)c([N+](=O)[O-])c1	ZINC000062794076	262422013	/nfs/dbraw/zinc/42/20/13/262422013.db2.gz	ATXWKWNUAOAHOV-UHFFFAOYSA-N	0	0	288.690	4.221	20	30		CIEDRN
CC(C)(C#N)CC(=O)N[C@@H]1CC(C)(C)CCc2ccccc21	ZINC000337706063	262466772	/nfs/dbraw/zinc/46/67/72/262466772.db2.gz	BMPRBMOXADIBEV-MRXNPFEDSA-N	0	0	298.430	4.146	20	30		CIEDRN
N#Cc1ccc(/C=C\c2ccc(C(F)F)cc2)nc1	ZINC000575230895	335085550	/nfs/dbraw/zinc/08/55/50/335085550.db2.gz	BSTUQNNHNRYXOQ-CLTKARDFSA-N	0	0	256.255	4.061	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(-c2csc(C)n2)cc1	ZINC000338618937	262551066	/nfs/dbraw/zinc/55/10/66/262551066.db2.gz	UHJHCEOOURQVHD-UHFFFAOYSA-N	0	0	272.373	4.023	20	30		CIEDRN
C=CCCC(=O)N(Cc1ccco1)c1cccc(Cl)c1	ZINC000338605744	262551811	/nfs/dbraw/zinc/55/18/11/262551811.db2.gz	HEDSHFFURWAYMJ-UHFFFAOYSA-N	0	0	289.762	4.432	20	30		CIEDRN
CCCc1ccc(CSc2nnc(C)c(C)c2C#N)cc1	ZINC000511839241	262612141	/nfs/dbraw/zinc/61/21/41/262612141.db2.gz	AEELGFCZBAJGJW-UHFFFAOYSA-N	0	0	297.427	4.210	20	30		CIEDRN
C[C@H](C(=O)Nc1ccc(CC#N)cc1Cl)C(C)(C)C	ZINC000411021467	262675184	/nfs/dbraw/zinc/67/51/84/262675184.db2.gz	WKOCENOOUCEBEF-SNVBAGLBSA-N	0	0	278.783	4.027	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@H]1C[C@@H]1c1ccccc1	ZINC000411183456	262683384	/nfs/dbraw/zinc/68/33/84/262683384.db2.gz	RSWUVDAGIQZEKV-SJORKVTESA-N	0	0	297.423	4.066	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H](C)c1cc2ccccc2o1	ZINC000429918802	262685930	/nfs/dbraw/zinc/68/59/30/262685930.db2.gz	PTBXAKYPTKQRBP-LBPRGKRZSA-N	0	0	271.360	4.212	20	30		CIEDRN
C=CC[C@@H](Cc1ccccc1)NC(=O)[C@@H](C)c1cccs1	ZINC000412846893	262745084	/nfs/dbraw/zinc/74/50/84/262745084.db2.gz	XLZDARZIFQACFP-HOCLYGCPSA-N	0	0	299.439	4.155	20	30		CIEDRN
CCOc1ccccc1[C@H](CC)Nc1ncc(C#N)cc1F	ZINC000413117103	262755653	/nfs/dbraw/zinc/75/56/53/262755653.db2.gz	XEGBXCRNBZETNX-HNNXBMFYSA-N	0	0	299.349	4.054	20	30		CIEDRN
C=CC[C@@H](Cc1ccccc1)NC(=O)C1(CC=C)CCC1	ZINC000413989510	262796629	/nfs/dbraw/zinc/79/66/29/262796629.db2.gz	RABSEFVWELVMPV-KRWDZBQOSA-N	0	0	283.415	4.036	20	30		CIEDRN
Cc1ccc([S@](=O)CCC2(C#N)CCCCC2)c(C)c1	ZINC000414230851	262829399	/nfs/dbraw/zinc/82/93/99/262829399.db2.gz	ONBARZYVRDUXKM-HXUWFJFHSA-N	0	0	289.444	4.275	20	30		CIEDRN
C=CCCCC[C@H](C)Nc1cccc([C@@H]2CCC(=O)N2)c1	ZINC000414314516	262842278	/nfs/dbraw/zinc/84/22/78/262842278.db2.gz	LEMOROAVTVIUQE-YOEHRIQHSA-N	0	0	286.419	4.185	20	30		CIEDRN
N#CCCCCNC(=O)Nc1ccccc1-c1cccs1	ZINC000264067619	262862775	/nfs/dbraw/zinc/86/27/75/262862775.db2.gz	ANHSNQQKPJWBBY-UHFFFAOYSA-N	0	0	299.399	4.230	20	30		CIEDRN
CC(C)c1oc([C@H]2CCCN2CC#N)nc1-c1ccccc1	ZINC000266934611	262921937	/nfs/dbraw/zinc/92/19/37/262921937.db2.gz	PKGKNBCUZJIYDE-OAHLLOKOSA-N	0	0	295.386	4.125	20	30		CIEDRN
C[C@@H](c1nc2ccccc2s1)N(C)CCC(C)(C)C#N	ZINC000271999057	263001075	/nfs/dbraw/zinc/00/10/75/263001075.db2.gz	GYUJOTLDUHDADR-LBPRGKRZSA-N	0	0	287.432	4.229	20	30		CIEDRN
Cc1c(F)c(F)ccc1NCC(C)(C)CCC#N	ZINC000414595158	263003300	/nfs/dbraw/zinc/00/33/00/263003300.db2.gz	YWRXFMHHIWFAPE-UHFFFAOYSA-N	0	0	252.308	4.015	20	30		CIEDRN
CC(C)(C)[C@](C)(C#N)NC(=O)c1cccc(Cl)c1Cl	ZINC000272450507	263004621	/nfs/dbraw/zinc/00/46/21/263004621.db2.gz	VYQOUOAAFIZLTH-AWEZNQCLSA-N	0	0	299.201	4.052	20	30		CIEDRN
CC1(C#N)CC[NH+](Cc2ccccc2OC2CCCC2)CC1	ZINC000272512978	263005806	/nfs/dbraw/zinc/00/58/06/263005806.db2.gz	JOSZDIPZGUGDBM-UHFFFAOYSA-N	0	0	298.430	4.134	20	30		CIEDRN
C[C@H](c1ccc(F)c(Cl)c1)N1CCC(C)(C#N)CC1	ZINC000272618622	263007560	/nfs/dbraw/zinc/00/75/60/263007560.db2.gz	ULJAQCQGJZDILP-LLVKDONJSA-N	0	0	280.774	4.166	20	30		CIEDRN
CCCCCCCC(=O)Nc1ccccc1-c1cn[nH]c1	ZINC000273207353	263013803	/nfs/dbraw/zinc/01/38/03/263013803.db2.gz	JUNJHVZZVYJSKG-UHFFFAOYSA-N	0	0	285.391	4.376	20	30		CIEDRN
CC(C)(C)Sc1ccc(NC(=O)NCCCC#N)cc1	ZINC000273197800	263013986	/nfs/dbraw/zinc/01/39/86/263013986.db2.gz	KTHPUDPWTNVQMR-UHFFFAOYSA-N	0	0	291.420	4.002	20	30		CIEDRN
CC(C)(C)[C@@](C)(C#N)NC(=O)c1ccc(Cl)cc1Cl	ZINC000274330459	263023041	/nfs/dbraw/zinc/02/30/41/263023041.db2.gz	LZAZRJQTSYJVMQ-CQSZACIVSA-N	0	0	299.201	4.052	20	30		CIEDRN
Cc1c2cccc(C)c2oc1C(=O)N[C@](C)(C#N)C(C)(C)C	ZINC000274355276	263023404	/nfs/dbraw/zinc/02/34/04/263023404.db2.gz	RXCYCNRRSDBRCB-GOSISDBHSA-N	0	0	298.386	4.108	20	30		CIEDRN
C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(Cl)cn1	ZINC000274819105	263030727	/nfs/dbraw/zinc/03/07/27/263030727.db2.gz	BHRMQBDCSRPPLC-DYVFJYSZSA-N	0	0	299.805	4.431	20	30		CIEDRN
CC[C@@H](CC1CCCC1)C(=O)Nc1sccc1C#N	ZINC000414686250	263032304	/nfs/dbraw/zinc/03/23/04/263032304.db2.gz	FVMUIWNZRUNLTC-LBPRGKRZSA-N	0	0	276.405	4.165	20	30		CIEDRN
Cc1oc(-c2ccccc2)nc1CSCCCC#N	ZINC000276585310	263037287	/nfs/dbraw/zinc/03/72/87/263037287.db2.gz	HIRIEFZOBUMABI-UHFFFAOYSA-N	0	0	272.373	4.187	20	30		CIEDRN
CCCCCCC[C@H](CC(=O)[O-])[NH2+]Cc1cccs1	ZINC000277142372	263039917	/nfs/dbraw/zinc/03/99/17/263039917.db2.gz	CDDYESGWSJOOSM-CYBMUJFWSA-N	0	0	283.437	4.042	20	30		CIEDRN
N#CCCCSCc1nc(-c2ccccc2)cs1	ZINC000277779943	263043189	/nfs/dbraw/zinc/04/31/89/263043189.db2.gz	GNXFXDSTTWLCEC-UHFFFAOYSA-N	0	0	274.414	4.347	20	30		CIEDRN
C[C@H](c1ccccc1)[S@](=O)CCCCC(C)(C)C#N	ZINC000277850149	263044038	/nfs/dbraw/zinc/04/40/38/263044038.db2.gz	LISQPOKDWDNWBD-AUUYWEPGSA-N	0	0	277.433	4.216	20	30		CIEDRN
CC(C)n1ccc(CSCCCCC(C)(C)C#N)n1	ZINC000277928071	263044729	/nfs/dbraw/zinc/04/47/29/263044729.db2.gz	PPZRVIHNEQUICD-UHFFFAOYSA-N	0	0	279.453	4.417	20	30		CIEDRN
CCCN(C(=O)CC(C)(C)C#N)c1ccc(Cl)cc1	ZINC000278369719	263047571	/nfs/dbraw/zinc/04/75/71/263047571.db2.gz	PDWXKIZFMMZVCO-UHFFFAOYSA-N	0	0	278.783	4.023	20	30		CIEDRN
N#C[C@@H]1CC[C@H](Sc2nc3ccccc3n2C(F)F)C1	ZINC000278489959	263048330	/nfs/dbraw/zinc/04/83/30/263048330.db2.gz	BBCFLJLKRWKOTA-ZJUUUORDSA-N	0	0	293.342	4.216	20	30		CIEDRN
CC(C)(C#N)CC(=O)Nc1cccc(-c2cccs2)c1	ZINC000278707918	263049888	/nfs/dbraw/zinc/04/98/88/263049888.db2.gz	KOOVORDOHFZWLC-UHFFFAOYSA-N	0	0	284.384	4.293	20	30		CIEDRN
CC(C)(C)SCCSc1snc(Cl)c1C#N	ZINC000278870236	263051498	/nfs/dbraw/zinc/05/14/98/263051498.db2.gz	VERSXBNCBSBDNE-UHFFFAOYSA-N	0	0	292.882	4.292	20	30		CIEDRN
N#CCCN(Cc1ccco1)Cc1cccc(C(F)F)c1	ZINC000279582621	263056100	/nfs/dbraw/zinc/05/61/00/263056100.db2.gz	COBLLKPPHWJFHL-UHFFFAOYSA-N	0	0	290.313	4.133	20	30		CIEDRN
N#CCC[C@H](C#N)CSCc1ccc(C(F)(F)F)cc1	ZINC000280226773	263059779	/nfs/dbraw/zinc/05/97/79/263059779.db2.gz	GYCWHQWRLCZTPF-GFCCVEGCSA-N	0	0	298.333	4.382	20	30		CIEDRN
Cc1ccc(C(=O)/C=C/c2cn(C(C)C)nc2C)s1	ZINC000280865966	263064690	/nfs/dbraw/zinc/06/46/90/263064690.db2.gz	BEYWJELTMLHROL-VOTSOKGWSA-N	0	0	274.389	4.038	20	30		CIEDRN
Cc1ccccc1CSCCCC1(C#N)CCOCC1	ZINC000280926505	263065049	/nfs/dbraw/zinc/06/50/49/263065049.db2.gz	GXPLKTQBGONBBA-UHFFFAOYSA-N	0	0	289.444	4.329	20	30		CIEDRN
CC(C)c1ccc(OCCCC2(C#N)CCOCC2)cc1	ZINC000281249592	263067475	/nfs/dbraw/zinc/06/74/75/263067475.db2.gz	GSAWAXOVHUPLKC-UHFFFAOYSA-N	0	0	287.403	4.289	20	30		CIEDRN
Cc1cscc1NC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000281353066	263068225	/nfs/dbraw/zinc/06/82/25/263068225.db2.gz	WYHPBZVILBDPPW-UHFFFAOYSA-N	0	0	284.384	4.110	20	30		CIEDRN
Cc1ccc(NCCCC2(C#N)CCOCC2)c(Cl)c1	ZINC000281366766	263068423	/nfs/dbraw/zinc/06/84/23/263068423.db2.gz	YCIRLYIXZVHMPO-UHFFFAOYSA-N	0	0	292.810	4.161	20	30		CIEDRN
Cc1cc(OCCCC2(C#N)CCOCC2)ccc1Cl	ZINC000281393164	263068506	/nfs/dbraw/zinc/06/85/06/263068506.db2.gz	PXSCHBGDDHBAAT-UHFFFAOYSA-N	0	0	293.794	4.128	20	30		CIEDRN
C[C@@H](CCC(=O)NCC1CCC(C#N)CC1)c1ccccc1	ZINC000282546216	263077308	/nfs/dbraw/zinc/07/73/08/263077308.db2.gz	BBVRVCIQUVTBKG-GTPINHCMSA-N	0	0	298.430	4.016	20	30		CIEDRN
CC[C@@H](CC(=O)NCC1CCC(C#N)CC1)c1ccccc1	ZINC000282854802	263079119	/nfs/dbraw/zinc/07/91/19/263079119.db2.gz	XDNBVVGNVSGYNH-JCYILVPMSA-N	0	0	298.430	4.016	20	30		CIEDRN
CC(C)c1ccoc1C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000284349649	263086497	/nfs/dbraw/zinc/08/64/97/263086497.db2.gz	YFMQZZCFOPIFKT-MRXNPFEDSA-N	0	0	296.370	4.178	20	30		CIEDRN
C[C@@H]1CC=CC[C@H]1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000284476779	263087182	/nfs/dbraw/zinc/08/71/82/263087182.db2.gz	YTQZWJNMSGFUGS-CZUORRHYSA-N	0	0	282.387	4.029	20	30		CIEDRN
CC(C)c1ccoc1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000284577779	263087383	/nfs/dbraw/zinc/08/73/83/263087383.db2.gz	RSEBPBPIEKPKGM-UHFFFAOYSA-N	0	0	296.370	4.456	20	30		CIEDRN
C[C@@H](C#N)CSc1ccccc1NCCCCF	ZINC000285091745	263090060	/nfs/dbraw/zinc/09/00/60/263090060.db2.gz	IFXLFWQHMQMBOC-LBPRGKRZSA-N	0	0	266.385	4.100	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)N[C@@H](C)c1cc2ccccc2s1	ZINC000285250520	263091641	/nfs/dbraw/zinc/09/16/41/263091641.db2.gz	AMKQQMULJBOCCC-ZBEGNZNMSA-N	0	0	286.400	4.018	20	30		CIEDRN
Cc1nc(C(F)(F)F)ccc1OCCCC(C)(C)C#N	ZINC000285294737	263091898	/nfs/dbraw/zinc/09/18/98/263091898.db2.gz	VPMKFVBUGDOJEQ-UHFFFAOYSA-N	0	0	286.297	4.118	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)O[C@H](C)c1cccc(OC(C)C)c1	ZINC000285731841	263095494	/nfs/dbraw/zinc/09/54/94/263095494.db2.gz	KEUNTCPKATWVTQ-CXAGYDPISA-N	0	0	289.375	4.018	20	30		CIEDRN
C[C@@H](c1ccc(C(C)(C)C)cc1)[S@@](=O)CCCC#N	ZINC000287108155	263100990	/nfs/dbraw/zinc/10/09/90/263100990.db2.gz	APHDPKSFOODACE-DJJJIMSYSA-N	0	0	277.433	4.098	20	30		CIEDRN
C[C@H](c1ccc(C(C)(C)C)cc1)[S@@](=O)CCCC#N	ZINC000287108157	263101028	/nfs/dbraw/zinc/10/10/28/263101028.db2.gz	APHDPKSFOODACE-YJYMSZOUSA-N	0	0	277.433	4.098	20	30		CIEDRN
C=C(C)CCNc1ccccc1SC[C@@H](C)C#N	ZINC000288638781	263105344	/nfs/dbraw/zinc/10/53/44/263105344.db2.gz	CIIAIZAXSBREIB-ZDUSSCGKSA-N	0	0	260.406	4.316	20	30		CIEDRN
C=C(C)CCc1noc(-c2ccc(C(C)(C)C#N)cc2)n1	ZINC000289077117	263107355	/nfs/dbraw/zinc/10/73/55/263107355.db2.gz	JHFFDIHZOHRVSF-UHFFFAOYSA-N	0	0	281.359	4.046	20	30		CIEDRN
Cc1ccc(-c2csc(NC(=O)CCCC#N)n2)c(C)c1	ZINC000290898337	263119028	/nfs/dbraw/zinc/11/90/28/263119028.db2.gz	DRRHPKVENMTUQX-UHFFFAOYSA-N	0	0	299.399	4.059	20	30		CIEDRN
C[C@H](OC(=O)CCCC#N)c1ccc(C(F)(F)F)cc1	ZINC000291624737	263124250	/nfs/dbraw/zinc/12/42/50/263124250.db2.gz	FFZYMUKPSHFCGQ-JTQLQIEISA-N	0	0	285.265	4.003	20	30		CIEDRN
CCCN(C(=O)CCCC#N)[C@H](CC)c1ccccc1	ZINC000292389377	263131797	/nfs/dbraw/zinc/13/17/97/263131797.db2.gz	QSMCXTPIRNRGRB-MRXNPFEDSA-N	0	0	272.392	4.070	20	30		CIEDRN
N#C[C@@H]1CC[C@@H](N2CCc3c(Cl)cc(Cl)cc3C2)C1	ZINC000292763009	263134736	/nfs/dbraw/zinc/13/47/36/263134736.db2.gz	IZTXUYVCKDVAAD-ZWNOBZJWSA-N	0	0	295.213	4.044	20	30		CIEDRN
Cc1nc(C(C)C)ccc1CN(CCC#N)Cc1ccco1	ZINC000292841218	263135508	/nfs/dbraw/zinc/13/55/08/263135508.db2.gz	PQHLGYJSUSPSRC-UHFFFAOYSA-N	0	0	297.402	4.022	20	30		CIEDRN
CC(C)(CCC#N)CNc1ccc(C2CCC2)cn1	ZINC000292933215	263136633	/nfs/dbraw/zinc/13/66/33/263136633.db2.gz	HBDTZYCSAZPWAY-UHFFFAOYSA-N	0	0	257.381	4.091	20	30		CIEDRN
C=C(C)CCNC(=O)[C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000452722210	263137328	/nfs/dbraw/zinc/13/73/28/263137328.db2.gz	JMZCHPODHYEOHY-VXGBXAGGSA-N	0	0	298.213	4.179	20	30		CIEDRN
Cc1cc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)no1	ZINC000340443176	263152188	/nfs/dbraw/zinc/15/21/88/263152188.db2.gz	FMAXQLCSQWRBOD-GDBMZVCRSA-N	0	0	283.375	4.069	20	30		CIEDRN
Cc1cc(Cl)ccc1NC(=O)[C@@]1(C#N)CC12CCCC2	ZINC000294356113	263160308	/nfs/dbraw/zinc/16/03/08/263160308.db2.gz	JKFJFZVIWDSASZ-INIZCTEOSA-N	0	0	288.778	4.061	20	30		CIEDRN
Cc1cccc(NC(=O)[C@@]2(C#N)CC23CCCC3)c1Cl	ZINC000295232708	263174793	/nfs/dbraw/zinc/17/47/93/263174793.db2.gz	ZLBBKKPULMAMPT-INIZCTEOSA-N	0	0	288.778	4.061	20	30		CIEDRN
Cc1ccc2c(C(=O)N[C@H]3CC[C@@H](CC#N)C3)csc2c1	ZINC000295506384	263178754	/nfs/dbraw/zinc/17/87/54/263178754.db2.gz	GUAJSAKOKABBIG-STQMWFEESA-N	0	0	298.411	4.022	20	30		CIEDRN
CCc1c2ccccc2oc1C(=O)N[C@](C)(C#N)C(C)(C)C	ZINC000297683506	263208065	/nfs/dbraw/zinc/20/80/65/263208065.db2.gz	GSBKNDGKUNPQLW-GOSISDBHSA-N	0	0	298.386	4.053	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)c1cc(F)ccc1Cl	ZINC000297904947	263211957	/nfs/dbraw/zinc/21/19/57/263211957.db2.gz	YXUNSBKOOKUUAQ-UHFFFAOYSA-N	0	0	296.773	4.071	20	30		CIEDRN
CCCc1ccccc1NC(=O)[C@@]1(C#N)CC12CCCC2	ZINC000298173107	263215573	/nfs/dbraw/zinc/21/55/73/263215573.db2.gz	CNJHGHMMIKVIMN-SFHVURJKSA-N	0	0	282.387	4.052	20	30		CIEDRN
Cc1[nH]c(S[C@H](C)CCC#N)nc1-c1ccccc1	ZINC000298290568	263217115	/nfs/dbraw/zinc/21/71/15/263217115.db2.gz	QDAMTRDZIKWXFJ-LLVKDONJSA-N	0	0	271.389	4.170	20	30		CIEDRN
CCC[C@@H](C)N(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000298479668	263220280	/nfs/dbraw/zinc/22/02/80/263220280.db2.gz	FNSKWIACKFVTCL-CYBMUJFWSA-N	0	0	287.407	4.140	20	30		CIEDRN
N#CCCCC(=O)Nc1c(Cl)cc(Cl)cc1Cl	ZINC000298676655	263223449	/nfs/dbraw/zinc/22/34/49/263223449.db2.gz	XVAGUJUJSXLXJG-UHFFFAOYSA-N	0	0	291.565	4.279	20	30		CIEDRN
C=CCCO[C@H](C)C(=O)Nc1ccccc1SC(C)C	ZINC000122178913	263300463	/nfs/dbraw/zinc/30/04/63/263300463.db2.gz	TWGDBKYLCDRMLX-CYBMUJFWSA-N	0	0	293.432	4.107	20	30		CIEDRN
COc1cccc2c(NCC(C)(C)CCC#N)cc(C)nc12	ZINC000340890859	263312243	/nfs/dbraw/zinc/31/22/43/263312243.db2.gz	HNYHYLSVDSRQQV-UHFFFAOYSA-N	0	0	297.402	4.294	20	30		CIEDRN
CCCCCCCCCC(=O)N1CC[C@@H]([C@@H]2CCOC2)C1	ZINC000366723830	263327656	/nfs/dbraw/zinc/32/76/56/263327656.db2.gz	ZBTBUISTRIGNFO-IAGOWNOFSA-N	0	0	295.467	4.012	20	30		CIEDRN
CC(C)(C)CCCCC(=O)N(CCC#N)Cc1ccco1	ZINC000341330396	263331072	/nfs/dbraw/zinc/33/10/72/263331072.db2.gz	XEFFXEXBTIFUGL-UHFFFAOYSA-N	0	0	290.407	4.128	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N[C@H](CC)c1ccc(F)cc1F	ZINC000341505820	263340203	/nfs/dbraw/zinc/34/02/03/263340203.db2.gz	ZYPQIXNFERPCQY-IUODEOHRSA-N	0	0	296.361	4.070	20	30		CIEDRN
Cc1cccc(C(=O)Nc2ccccc2SCCC#N)c1	ZINC000341801965	263350290	/nfs/dbraw/zinc/35/02/90/263350290.db2.gz	GMFOWIJXGQDCOZ-UHFFFAOYSA-N	0	0	296.395	4.253	20	30		CIEDRN
CCC(CC)[C@H](C)C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000341876893	263360977	/nfs/dbraw/zinc/36/09/77/263360977.db2.gz	PWUXGUGPTARVCV-WMLDXEAASA-N	0	0	286.419	4.220	20	30		CIEDRN
CCC(CC)[C@H](C)C(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000341876895	263361500	/nfs/dbraw/zinc/36/15/00/263361500.db2.gz	PWUXGUGPTARVCV-YOEHRIQHSA-N	0	0	286.419	4.220	20	30		CIEDRN
C=CCCS[C@@H](C)C(=O)Nc1ccccc1SC	ZINC000341912775	263366138	/nfs/dbraw/zinc/36/61/38/263366138.db2.gz	AEFKWAGPCBRRQJ-NSHDSACASA-N	0	0	281.446	4.045	20	30		CIEDRN
N#CCCSc1nc2ccccc2n1-c1ccc(F)cc1	ZINC000342026526	263380555	/nfs/dbraw/zinc/38/05/55/263380555.db2.gz	UVBZUBGFNJSSLP-UHFFFAOYSA-N	0	0	297.358	4.170	20	30		CIEDRN
CC(C)(C#N)CCCCSCCOC1CCC1	ZINC000342078954	263384900	/nfs/dbraw/zinc/38/49/00/263384900.db2.gz	FVOIHOTXWNXRKT-UHFFFAOYSA-N	0	0	255.427	4.009	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@@H](CC)c1cccc(Cl)c1	ZINC000342098808	263387067	/nfs/dbraw/zinc/38/70/67/263387067.db2.gz	GQBNSNWDECBQBM-FZMZJTMJSA-N	0	0	280.799	4.055	20	30		CIEDRN
C=CCCOCCCCC(=O)N(C)c1cc(C)cc(C)c1	ZINC000342623095	263455538	/nfs/dbraw/zinc/45/55/38/263455538.db2.gz	OLYQCZJUNJLELU-UHFFFAOYSA-N	0	0	289.419	4.029	20	30		CIEDRN
COc1cc(NCCCC(C)(C)C#N)c(Cl)c(OC)c1	ZINC000417057960	263778552	/nfs/dbraw/zinc/77/85/52/263778552.db2.gz	CVIDGKDMMUNISG-UHFFFAOYSA-N	0	0	296.798	4.099	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1cc2cc(F)ccc2s1	ZINC000428049815	263804593	/nfs/dbraw/zinc/80/45/93/263804593.db2.gz	PPBMFHFDQNRLDQ-CYBMUJFWSA-N	0	0	289.375	4.221	20	30		CIEDRN
CCSCC[C@@H](C)Nc1ccc(C#N)c(Cl)c1	ZINC000122789526	263805454	/nfs/dbraw/zinc/80/54/54/263805454.db2.gz	AFAAQOKVHNUIBK-SNVBAGLBSA-N	0	0	268.813	4.155	20	30		CIEDRN
CCC1(CNC(=O)Nc2scnc2C2CC2)CCCC1	ZINC000328935453	263892751	/nfs/dbraw/zinc/89/27/51/263892751.db2.gz	QJWQHOOEMCJBTC-UHFFFAOYSA-N	0	0	293.436	4.317	20	30		CIEDRN
Cc1nnc(NC(=O)[C@@H](C)CC2CCCCC2)n1C1CC1	ZINC000328977909	263910837	/nfs/dbraw/zinc/91/08/37/263910837.db2.gz	DKFCZLDMKWVHAO-NSHDSACASA-N	0	0	290.411	4.116	20	30		CIEDRN
CO[C@@H]1CCC[C@H](C(=O)Nc2nc(C3CCC3)cs2)C1	ZINC000328989886	263912285	/nfs/dbraw/zinc/91/22/85/263912285.db2.gz	HYFLRPGDGSRQNT-NWDGAFQWSA-N	0	0	294.420	4.204	20	30		CIEDRN
Cc1nc(C(=O)N[C@@H]2CCC[C@@H]2CCC(C)C)c(C)o1	ZINC000330470524	263943978	/nfs/dbraw/zinc/94/39/78/263943978.db2.gz	MQYIHZZJSLDFGE-ZIAGYGMSSA-N	0	0	278.396	4.201	20	30		CIEDRN
CCc1onc(C)c1C(=O)NCCCC1CCCCC1	ZINC000330782497	264052524	/nfs/dbraw/zinc/05/25/24/264052524.db2.gz	HEFZLQLTKLZRBY-UHFFFAOYSA-N	0	0	278.396	4.211	20	30		CIEDRN
Cc1cc([C@@H](C)NC(=O)c2cc(C(C)(C)C)on2)c(C)o1	ZINC000330890282	264064028	/nfs/dbraw/zinc/06/40/28/264064028.db2.gz	WAWCOTZCTBECCS-SNVBAGLBSA-N	0	0	290.363	4.248	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@H]1c1cccc(C)c1	ZINC000125806631	264069395	/nfs/dbraw/zinc/06/93/95/264069395.db2.gz	VJYAHJREELSZIY-SFHVURJKSA-N	0	0	283.415	4.427	20	30		CIEDRN
Cc1cc(C#N)cc(C)c1OCc1ncc(C(C)(C)C)o1	ZINC000330958554	264088480	/nfs/dbraw/zinc/08/84/80/264088480.db2.gz	DHVQVKAHAPRTKN-UHFFFAOYSA-N	0	0	284.359	4.040	20	30		CIEDRN
C[C@@H]1CC[C@H](NC(=O)C[C@H](CC#N)c2ccccc2)[C@H](C)C1	ZINC000331066857	264112199	/nfs/dbraw/zinc/11/21/99/264112199.db2.gz	QICKXHQZORYKBQ-LMSBXDPUSA-N	0	0	298.430	4.015	20	30		CIEDRN
CC1(C)CCCC[C@@H]1NC(=O)C[C@H](CC#N)c1ccccc1	ZINC000331079139	264116117	/nfs/dbraw/zinc/11/61/17/264116117.db2.gz	XAGISQYZIOKAOG-IRXDYDNUSA-N	0	0	298.430	4.159	20	30		CIEDRN
C=CCC(CC=C)C(=O)N([C@H](C)c1ccco1)C1CC1	ZINC000126091854	264122927	/nfs/dbraw/zinc/12/29/27/264122927.db2.gz	DECNJKPXQRORRJ-CYBMUJFWSA-N	0	0	273.376	4.100	20	30		CIEDRN
CC(C)c1ccc([C@H](C)CC(=O)N[C@@H]2CCC[C@H]2C#N)cc1	ZINC000331115104	264128520	/nfs/dbraw/zinc/12/85/20/264128520.db2.gz	VBHLATDFSHNMIA-FHLIZLRMSA-N	0	0	298.430	4.112	20	30		CIEDRN
CC(C)(CC1CCCCCC1)NC(=O)NCCCCC#N	ZINC000188522153	264132019	/nfs/dbraw/zinc/13/20/19/264132019.db2.gz	MHCPBMCRRLPESA-UHFFFAOYSA-N	0	0	293.455	4.119	20	30		CIEDRN
CC[C@H](C)n1ncc(NC(=O)NC2(C)CCCCC2)c1C	ZINC000331149479	264138560	/nfs/dbraw/zinc/13/85/60/264138560.db2.gz	TYFOXXYHAFTTGM-LBPRGKRZSA-N	0	0	292.427	4.020	20	30		CIEDRN
Cc1nc([C@@H](C)NC(=O)c2ccc(C(C)C)nc2)cs1	ZINC000331226755	264150495	/nfs/dbraw/zinc/15/04/95/264150495.db2.gz	FNQFYSGYNNZKDJ-SNVBAGLBSA-N	0	0	289.404	4.036	20	30		CIEDRN
Cc1ccc(C(=O)NCC2(C(N)=O)CCCC2)c(Cl)c1	ZINC000331177399	264153920	/nfs/dbraw/zinc/15/39/20/264153920.db2.gz	XNVORBKDXFCPJA-UHFFFAOYSA-N	0	0	294.782	4.049	20	30		CIEDRN
CC(C)c1csc(NC(=O)c2ccc(C(C)C)nc2)n1	ZINC000331221619	264166839	/nfs/dbraw/zinc/16/68/39/264166839.db2.gz	CEESLZGVCQSERP-UHFFFAOYSA-N	0	0	289.404	4.421	20	30		CIEDRN
CCC(CC)(CC)NC(=O)Nc1c(C)cc(C)nc1C	ZINC000331240343	264176430	/nfs/dbraw/zinc/17/64/30/264176430.db2.gz	PPMIAXKXQAYDIF-UHFFFAOYSA-N	0	0	277.412	4.111	20	30		CIEDRN
CCOCc1ccc(NC(=O)N[C@H]2CC[C@H](C)CC2)cc1	ZINC000331253000	264181719	/nfs/dbraw/zinc/18/17/19/264181719.db2.gz	QZHZRKPIHBEQLV-CTYIDZIISA-N	0	0	290.407	4.128	20	30		CIEDRN
Cc1sc(NC(=O)c2ccc(C(C)C)nc2)c(C#N)c1C	ZINC000331254192	264182468	/nfs/dbraw/zinc/18/24/68/264182468.db2.gz	WQHQDZTXIRMLRZ-UHFFFAOYSA-N	0	0	299.399	4.391	20	30		CIEDRN
CC[C@H](NC(=O)c1coc(C2CCCCC2)n1)C(F)F	ZINC000331318160	264189004	/nfs/dbraw/zinc/18/90/04/264189004.db2.gz	JVRIWWWKKGMFCU-JTQLQIEISA-N	0	0	286.322	4.071	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1cc(C)n(C(C)C)c1C	ZINC000343259612	264237371	/nfs/dbraw/zinc/23/73/71/264237371.db2.gz	NSLAJZIKLMALNH-CYBMUJFWSA-N	0	0	276.424	4.160	20	30		CIEDRN
N#Cc1ccc(Oc2nc(-c3ccccc3)ns2)c(F)c1	ZINC000127596544	264263615	/nfs/dbraw/zinc/26/36/15/264263615.db2.gz	SGLFZVQYFCWWJX-UHFFFAOYSA-N	0	0	297.314	4.008	20	30		CIEDRN
CC[C@@H](Cc1ccccc1C)C(=O)Nc1sccc1C#N	ZINC000425393804	264274916	/nfs/dbraw/zinc/27/49/16/264274916.db2.gz	DKZLWEPNCQMWRT-ZDUSSCGKSA-N	0	0	298.411	4.136	20	30		CIEDRN
N#Cc1c(F)cccc1Oc1nc(-c2ccccc2)ns1	ZINC000128370382	264291177	/nfs/dbraw/zinc/29/11/77/264291177.db2.gz	CYYLSWDAVBZPHW-UHFFFAOYSA-N	0	0	297.314	4.008	20	30		CIEDRN
CC(F)(F)c1cccc(NCc2cc(C#N)cs2)c1	ZINC000189545654	264306563	/nfs/dbraw/zinc/30/65/63/264306563.db2.gz	IFLRRAPUJAMOKL-UHFFFAOYSA-N	0	0	278.327	4.344	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N(Cc1ccc(C#N)cc1)CC(C)C	ZINC000425429774	264310289	/nfs/dbraw/zinc/31/02/89/264310289.db2.gz	AYZLEBBOHCHOIT-UHFFFAOYSA-N	0	0	298.430	4.145	20	30		CIEDRN
CC(=O)Nc1ccc(S[C@H](C)c2cccc(C#N)c2)cc1	ZINC000189795850	264326601	/nfs/dbraw/zinc/32/66/01/264326601.db2.gz	FAMDDPOSOYTQSJ-GFCCVEGCSA-N	0	0	296.395	4.370	20	30		CIEDRN
COc1ccc(S[C@H](C)c2cccc(C#N)c2)cc1	ZINC000189806931	264327262	/nfs/dbraw/zinc/32/72/62/264327262.db2.gz	IFGFSJLQYYPPSD-GFCCVEGCSA-N	0	0	269.369	4.420	20	30		CIEDRN
COc1ccc(S[C@@H](C)c2cccc(C#N)c2)cc1	ZINC000189806912	264327393	/nfs/dbraw/zinc/32/73/93/264327393.db2.gz	IFGFSJLQYYPPSD-LBPRGKRZSA-N	0	0	269.369	4.420	20	30		CIEDRN
Cc1cncc(CSc2ccc(C#N)cc2Cl)c1	ZINC000189856048	264335216	/nfs/dbraw/zinc/33/52/16/264335216.db2.gz	ONHHKIULBYGRDW-UHFFFAOYSA-N	0	0	274.776	4.207	20	30		CIEDRN
C=C(CC)CNC(=O)CCCCCO[C@H]1CCC[C@H](C)C1	ZINC000456810714	264342895	/nfs/dbraw/zinc/34/28/95/264342895.db2.gz	GMGLAEDPFAYNGY-IRXDYDNUSA-N	0	0	295.467	4.225	20	30		CIEDRN
C=CCCCN(C)C(=O)c1cc(C2CC2)nc2ccccc21	ZINC000076650523	264346437	/nfs/dbraw/zinc/34/64/37/264346437.db2.gz	YHXXBNQYPUIBHV-UHFFFAOYSA-N	0	0	294.398	4.150	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccccc1C(F)(F)F	ZINC000076937352	264350389	/nfs/dbraw/zinc/35/03/89/264350389.db2.gz	AOOPSZPTTUFRQF-UHFFFAOYSA-N	0	0	286.297	4.135	20	30		CIEDRN
C=CCCCN(C)C(=O)N[C@H](C)c1cc2ccccc2o1	ZINC000076976021	264350543	/nfs/dbraw/zinc/35/05/43/264350543.db2.gz	PIYRNISGKFGMGE-CYBMUJFWSA-N	0	0	286.375	4.101	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N(C)[C@H](C)c1cccc(C#N)c1	ZINC000425488655	264354545	/nfs/dbraw/zinc/35/45/45/264354545.db2.gz	NDUXTOGHCIYVNW-HUUCEWRRSA-N	0	0	299.418	4.005	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccc(C)c(OC(F)F)c1	ZINC000077493531	264356125	/nfs/dbraw/zinc/35/61/25/264356125.db2.gz	IGUFINPFXYJZJU-UHFFFAOYSA-N	0	0	298.333	4.026	20	30		CIEDRN
C=CCC[C@@H](C)Nc1cccc(NC(=O)C(C)C)c1	ZINC000130603243	264359657	/nfs/dbraw/zinc/35/96/57/264359657.db2.gz	ZUCAROAQQAZQCD-CYBMUJFWSA-N	0	0	260.381	4.048	20	30		CIEDRN
C[C@@H]1CCCC[C@@H]1C(=O)N(C)c1cc(Cl)ccc1C#N	ZINC000425535243	264449354	/nfs/dbraw/zinc/44/93/54/264449354.db2.gz	SMTCWXGYCKZZJG-RISCZKNCSA-N	0	0	290.794	4.001	20	30		CIEDRN
N#Cc1ccc(-c2nc(-c3ccc4ccccc4c3)no2)cc1	ZINC000391564205	264507068	/nfs/dbraw/zinc/50/70/68/264507068.db2.gz	YNJRHODUAMYHKA-UHFFFAOYSA-N	0	0	297.317	4.428	20	30		CIEDRN
N#CC1(CN(Cc2ccsc2)c2ccccc2)CC1	ZINC000343324332	264856699	/nfs/dbraw/zinc/85/66/99/264856699.db2.gz	KXIGAXPGSZRHAW-UHFFFAOYSA-N	0	0	268.385	4.058	20	30		CIEDRN
Cc1cc2occ(C(=O)NC3(C#N)CCCCC3)c2cc1C	ZINC000184912817	264894267	/nfs/dbraw/zinc/89/42/67/264894267.db2.gz	ZZHXDHIYQTUGSK-UHFFFAOYSA-N	0	0	296.370	4.006	20	30		CIEDRN
N#CC1(CSCc2c(F)cccc2Cl)CC1	ZINC000344481988	265060887	/nfs/dbraw/zinc/06/08/87/265060887.db2.gz	IFQXKKVYFFCYAJ-UHFFFAOYSA-N	0	0	255.745	4.016	20	30		CIEDRN
N#Cc1ccc(Sc2cccc(Cl)c2)cc1[N+](=O)[O-]	ZINC000094593728	265246203	/nfs/dbraw/zinc/24/62/03/265246203.db2.gz	PFKWVUGIGZTTBZ-UHFFFAOYSA-N	0	0	290.731	4.271	20	30		CIEDRN
CC(C)(C)c1csc(CNc2ccc(F)c(C#N)c2)n1	ZINC000094964006	265278700	/nfs/dbraw/zinc/27/87/00/265278700.db2.gz	SMZAGDYUXSBPHA-UHFFFAOYSA-N	0	0	289.379	4.063	20	30		CIEDRN
C=C1CCN(C(=O)c2cc(C(C)C)nc3ccccc32)CC1	ZINC000519089570	265317376	/nfs/dbraw/zinc/31/73/76/265317376.db2.gz	ZOLDZJCWDWQFNO-UHFFFAOYSA-N	0	0	294.398	4.150	20	30		CIEDRN
C=CCC[C@@H](NCc1nc2cc(C)ccc2[nH]1)c1ccco1	ZINC000519197345	265363435	/nfs/dbraw/zinc/36/34/35/265363435.db2.gz	RIZQJLTWNJFZHV-OAHLLOKOSA-N	0	0	295.386	4.261	20	30		CIEDRN
CCOc1cc(C#N)ccc1OCc1c(C)cccc1C	ZINC000096810263	265385066	/nfs/dbraw/zinc/38/50/66/265385066.db2.gz	PHRRDFCNHPNZOO-UHFFFAOYSA-N	0	0	281.355	4.153	20	30		CIEDRN
CC(C)[C@H](Nc1ccc(C#N)c([N+](=O)[O-])c1)c1ccccc1	ZINC000519610289	265495300	/nfs/dbraw/zinc/49/53/00/265495300.db2.gz	HULOTFXPKXJALJ-KRWDZBQOSA-N	0	0	295.342	4.276	20	30		CIEDRN
Cc1ccccc1OCCNc1ccc(C#N)c(Cl)c1	ZINC000520320195	265774583	/nfs/dbraw/zinc/77/45/83/265774583.db2.gz	OUJBHRUAXNIRCS-UHFFFAOYSA-N	0	0	286.762	4.011	20	30		CIEDRN
C=CCOc1cccc(NC(=O)N[C@@H](CC)C(C)(C)C)c1	ZINC000520666649	265888956	/nfs/dbraw/zinc/88/89/56/265888956.db2.gz	ZMKFNPRYYVNJGB-HNNXBMFYSA-N	0	0	290.407	4.198	20	30		CIEDRN
CCC[C@@H](C)C(=O)Nc1sc2c(c1C#N)CC[C@@H](C)C2	ZINC000514607845	266019487	/nfs/dbraw/zinc/01/94/87/266019487.db2.gz	XDIXFFYYGJIHLY-GHMZBOCLSA-N	0	0	290.432	4.119	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1cnccc1C	ZINC000356160449	266060200	/nfs/dbraw/zinc/06/02/00/266060200.db2.gz	ATGWYBPHGZOPGI-UHFFFAOYSA-N	0	0	294.398	4.494	20	30		CIEDRN
CC[C@H](C)C[C@@H](C)NC(=O)C[C@H](CC#N)c1ccccc1	ZINC000356186269	266065789	/nfs/dbraw/zinc/06/57/89/266065789.db2.gz	AXTVJKPUYYDFLY-UXLLHSPISA-N	0	0	286.419	4.015	20	30		CIEDRN
C[C@@H]1CCC[C@@H](C)N(C(=O)C[C@@H](CC#N)c2ccccc2)C1	ZINC000356190499	266067340	/nfs/dbraw/zinc/06/73/40/266067340.db2.gz	KSVLOPIAOVROET-JFIYKMOQSA-N	0	0	298.430	4.111	20	30		CIEDRN
C=CCCOCCCCc1nc(C2CCC(C)CC2)no1	ZINC000356190993	266067661	/nfs/dbraw/zinc/06/76/61/266067661.db2.gz	JMNHNPHZCJCTNI-UHFFFAOYSA-N	0	0	292.423	4.279	20	30		CIEDRN
Cc1cccc(C)c1NC(=O)C[C@H](CC#N)c1ccccc1	ZINC000356252665	266080915	/nfs/dbraw/zinc/08/09/15/266080915.db2.gz	LLSSWMQCFDXEQQ-KRWDZBQOSA-N	0	0	292.382	4.330	20	30		CIEDRN
Cc1cccc(C)c1NC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000356252669	266080981	/nfs/dbraw/zinc/08/09/81/266080981.db2.gz	LLSSWMQCFDXEQQ-QGZVFWFLSA-N	0	0	292.382	4.330	20	30		CIEDRN
Cc1cscc1NC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000356523900	266130274	/nfs/dbraw/zinc/13/02/74/266130274.db2.gz	WPXRALZBBUYZMV-CQSZACIVSA-N	0	0	284.384	4.083	20	30		CIEDRN
C[C@@H]1CC[C@H](NC(=O)C[C@@H](CC#N)c2ccccc2)C[C@@H]1C	ZINC000356817078	266179414	/nfs/dbraw/zinc/17/94/14/266179414.db2.gz	RCPXRAPGYPYTPP-ATLSCFEFSA-N	0	0	298.430	4.015	20	30		CIEDRN
CC(C)(C#N)CCCNc1c2c(cc3c1CCC3)CCC2	ZINC000357268672	266270011	/nfs/dbraw/zinc/27/00/11/266270011.db2.gz	MCEMZAVPIBVJJW-UHFFFAOYSA-N	0	0	282.431	4.406	20	30		CIEDRN
N#CCCCN[C@@H](c1cccc2ccccc21)C(F)(F)F	ZINC000357809452	266369735	/nfs/dbraw/zinc/36/97/35/266369735.db2.gz	AYKIYOJLKPIAIF-HNNXBMFYSA-N	0	0	292.304	4.337	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(C)c3ncccc23)CCC1	ZINC000357969406	266391565	/nfs/dbraw/zinc/39/15/65/266391565.db2.gz	PSNMYRYXYFVZLJ-UHFFFAOYSA-N	0	0	280.371	4.228	20	30		CIEDRN
CCc1ccc2occ(C(=O)NCC(C)(C)CCC#N)c2c1	ZINC000359761175	266636479	/nfs/dbraw/zinc/63/64/79/266636479.db2.gz	AOOUBEOFDHANIV-UHFFFAOYSA-N	0	0	298.386	4.055	20	30		CIEDRN
Cc1nc(N[C@@H]2CCc3ccccc32)c(Cl)cc1C#N	ZINC000359848743	266645426	/nfs/dbraw/zinc/64/54/26/266645426.db2.gz	XLPHKOOGHGLNBH-OAHLLOKOSA-N	0	0	283.762	4.015	20	30		CIEDRN
N#C[C@@H]1CCC[C@@H](Nc2cc(F)ccc2OCC2CC2)C1	ZINC000193353584	266668140	/nfs/dbraw/zinc/66/81/40/266668140.db2.gz	QBSBAYHGFRBROV-UKRRQHHQSA-N	0	0	288.366	4.109	20	30		CIEDRN
CCS[C@@H]1CCC[C@@H](Nc2ncc(C#N)cc2Cl)C1	ZINC000362131281	266931987	/nfs/dbraw/zinc/93/19/87/266931987.db2.gz	XDTRFJPZXKPCNE-VXGBXAGGSA-N	0	0	295.839	4.083	20	30		CIEDRN
C[C@@H]1CC(C)(C)c2ccccc2N1C(=O)CC(C)(C)C#N	ZINC000362725481	267039613	/nfs/dbraw/zinc/03/96/13/267039613.db2.gz	QFMCUYAKCOJRPB-CYBMUJFWSA-N	0	0	284.403	4.029	20	30		CIEDRN
C[C@@H]1CC(C)(C)N(C(=O)CC(C)(C)C#N)c2ccccc21	ZINC000362737497	267040480	/nfs/dbraw/zinc/04/04/80/267040480.db2.gz	QDFZXORYBZXTCD-CYBMUJFWSA-N	0	0	284.403	4.245	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N1Cc2ccccc2C1	ZINC000362761335	267043374	/nfs/dbraw/zinc/04/33/74/267043374.db2.gz	XMJVCBQWPGEBJX-UHFFFAOYSA-N	0	0	295.407	4.121	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CC=C(c2cccc(F)c2)CC1	ZINC000368769786	267202900	/nfs/dbraw/zinc/20/29/00/267202900.db2.gz	JJZWSKGQAJTYTR-CQSZACIVSA-N	0	0	287.378	4.044	20	30		CIEDRN
C=CCCCC(=O)N1CCC(=Cc2cccc(F)c2)CC1	ZINC000370064887	267288246	/nfs/dbraw/zinc/28/82/46/267288246.db2.gz	LDXFCXHEYBBCNI-UHFFFAOYSA-N	0	0	287.378	4.188	20	30		CIEDRN
N#CCCCCSc1nnc(-c2cccc(Cl)c2)o1	ZINC000120068700	267356314	/nfs/dbraw/zinc/35/63/14/267356314.db2.gz	GTUUUDHEOMSDQX-UHFFFAOYSA-N	0	0	293.779	4.176	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@H]1c1ccc(C)cc1	ZINC000372719321	267594957	/nfs/dbraw/zinc/59/49/57/267594957.db2.gz	SXPYSTPUELNZBQ-INIZCTEOSA-N	0	0	257.377	4.015	20	30		CIEDRN
Cc1nc(-c2cccc(NCc3ccc(C#N)o3)c2)oc1C	ZINC000121477724	267659622	/nfs/dbraw/zinc/65/96/22/267659622.db2.gz	SUYNBQXMZQNMGY-UHFFFAOYSA-N	0	0	293.326	4.035	20	30		CIEDRN
C#CCCCC(=O)Nc1ccccc1-c1c(F)cccc1F	ZINC000373774153	267709442	/nfs/dbraw/zinc/70/94/42/267709442.db2.gz	FZTGZUIEGNRTKF-UHFFFAOYSA-N	0	0	299.320	4.374	20	30		CIEDRN
Cc1cccc(OCCNc2ccc(Cl)cc2C#N)c1	ZINC000052858039	327618063	/nfs/dbraw/zinc/61/80/63/327618063.db2.gz	VMSMEYQVYVNOOZ-UHFFFAOYSA-N	0	0	286.762	4.011	20	30		CIEDRN
N#CC1(c2nc(-c3cccc(Cl)c3)no2)CCCCC1	ZINC000177719997	327727392	/nfs/dbraw/zinc/72/73/92/327727392.db2.gz	XMANOHUUHPNPHD-UHFFFAOYSA-N	0	0	287.750	4.115	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(CC)[C@H](C)Cc1ccsc1	ZINC000466401519	327737210	/nfs/dbraw/zinc/73/72/10/327737210.db2.gz	ZRQUFZVKWKBXQO-HIFRSBDPSA-N	0	0	294.464	4.065	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(C(C)(C)c2ccccc2)no1	ZINC000580257939	327749518	/nfs/dbraw/zinc/74/95/18/327749518.db2.gz	DQYLRLKUSKZMCK-CYBMUJFWSA-N	0	0	270.376	4.465	20	30		CIEDRN
CCCC[C@@H](CCC)NC(=O)C1(c2ccc(C#N)cc2)CC1	ZINC000189235673	327768796	/nfs/dbraw/zinc/76/87/96/327768796.db2.gz	DKNFMFZDYGHQRS-QGZVFWFLSA-N	0	0	298.430	4.065	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N(C)Cc1cccc(OC(C)C)c1	ZINC000188547665	327916798	/nfs/dbraw/zinc/91/67/98/327916798.db2.gz	MEVYGYCYNWUXOF-GOSISDBHSA-N	0	0	289.419	4.035	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@H](CC(C)(C)C)C(F)(F)F	ZINC000188573516	327917687	/nfs/dbraw/zinc/91/76/87/327917687.db2.gz	NVHAJWZWYLMFOS-MFKMUULPSA-N	0	0	279.346	4.072	20	30		CIEDRN
CC(C)=CCC[C@H](C)CC(=O)N(C1CC1)C1(C#N)CCC1	ZINC000563180723	327952867	/nfs/dbraw/zinc/95/28/67/327952867.db2.gz	TXTIDINGWSMPBW-HNNXBMFYSA-N	0	0	288.435	4.196	20	30		CIEDRN
Cc1oc2ccccc2c1CNc1cccc(F)c1C#N	ZINC000123237194	327964295	/nfs/dbraw/zinc/96/42/95/327964295.db2.gz	GIGIGVUWMGRUFM-UHFFFAOYSA-N	0	0	280.302	4.364	20	30		CIEDRN
C=CC[C@H]1N(C(=O)c2cccc(C#N)c2C)CCCC1(C)C	ZINC000338037941	327964599	/nfs/dbraw/zinc/96/45/99/327964599.db2.gz	WUDKJILISAZDBK-QGZVFWFLSA-N	0	0	296.414	4.074	20	30		CIEDRN
C=CCC1(c2nc(-c3cscc3C)no2)CCC1	ZINC000582446775	329004727	/nfs/dbraw/zinc/00/47/27/329004727.db2.gz	DUFWLAZUDLMVOZ-UHFFFAOYSA-N	0	0	260.362	4.104	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)Cc1cc(C)no1	ZINC000563255118	328001919	/nfs/dbraw/zinc/00/19/19/328001919.db2.gz	DZYGJEQMHGSOGR-UHFFFAOYSA-N	0	0	298.386	4.016	20	30		CIEDRN
C=CCC(CC=C)c1nc(Cc2ccc(C)c(OC)c2)no1	ZINC000563305595	328011285	/nfs/dbraw/zinc/01/12/85/328011285.db2.gz	LPHRSLVFNDLKMV-UHFFFAOYSA-N	0	0	298.386	4.213	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCCC[C@@H]1[C@H](C)CC	ZINC000531559884	328017701	/nfs/dbraw/zinc/01/77/01/328017701.db2.gz	PAAPNZKUUARKTC-GDBMZVCRSA-N	0	0	263.425	4.182	20	30		CIEDRN
CC1CC(C#N)(C(=O)N(Cc2ccccc2)CC(C)(C)C)C1	ZINC000531563631	328018314	/nfs/dbraw/zinc/01/83/14/328018314.db2.gz	GQWBXJIFFZLUJK-UHFFFAOYSA-N	0	0	298.430	4.001	20	30		CIEDRN
C=C[C@H](CC(=O)N1CCC(CC)(CC)C1)c1ccccc1	ZINC000533987841	328031853	/nfs/dbraw/zinc/03/18/53/328031853.db2.gz	BOJCMVNHPIGMKW-MRXNPFEDSA-N	0	0	285.431	4.385	20	30		CIEDRN
CC(C)N(CCC#N)Cc1cc2ccccc2s1	ZINC000534341705	328050001	/nfs/dbraw/zinc/05/00/01/328050001.db2.gz	QNCJHLPMMXYVNM-UHFFFAOYSA-N	0	0	258.390	4.025	20	30		CIEDRN
CCCCc1nc(COc2cccc(F)c2C#N)cs1	ZINC000534384055	328050147	/nfs/dbraw/zinc/05/01/47/328050147.db2.gz	MTBVUZWPILCRMA-UHFFFAOYSA-N	0	0	290.363	4.075	20	30		CIEDRN
C=CCC[C@@H](NC(=O)N1CC=C(C)CC1)c1ccccc1	ZINC000534441238	328053341	/nfs/dbraw/zinc/05/33/41/328053341.db2.gz	PMENFDNYORGKNM-QGZVFWFLSA-N	0	0	284.403	4.056	20	30		CIEDRN
CCCN(C(=O)Nc1ccc(C(C)(C)C#N)cc1)C(C)C	ZINC000563360192	328056364	/nfs/dbraw/zinc/05/63/64/328056364.db2.gz	BOEGCSJVYWYNBB-UHFFFAOYSA-N	0	0	287.407	4.140	20	30		CIEDRN
CCCCCn1cc(C#N)c(=O)c2cc(C)cc(Cl)c21	ZINC000563457295	328067784	/nfs/dbraw/zinc/06/77/84/328067784.db2.gz	SNWUPKSXAKXORQ-UHFFFAOYSA-N	0	0	288.778	4.025	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@H](CC(C)C)C1	ZINC000152202205	328079887	/nfs/dbraw/zinc/07/98/87/328079887.db2.gz	FMJMQPKCYRNMIM-OAHLLOKOSA-N	0	0	263.425	4.040	20	30		CIEDRN
C=C(C)CCc1noc(-c2ccccc2CSCC)n1	ZINC000571124025	328087284	/nfs/dbraw/zinc/08/72/84/328087284.db2.gz	LIPCXEXDULAPTJ-UHFFFAOYSA-N	0	0	288.416	4.498	20	30		CIEDRN
C=CCCC(=O)Nc1cccc(Br)c1Cl	ZINC000571107626	328086108	/nfs/dbraw/zinc/08/61/08/328086108.db2.gz	QWXFJFIIMBEEEE-UHFFFAOYSA-N	0	0	288.572	4.007	20	30		CIEDRN
CC(C)(C#N)CCCSCc1ccc(F)cc1	ZINC000160979032	328105104	/nfs/dbraw/zinc/10/51/04/328105104.db2.gz	LZETTXDPHILETD-UHFFFAOYSA-N	0	0	251.370	4.389	20	30		CIEDRN
Cc1c2c(nc3cc(F)ccc13)-c1cc(C#N)ccc1C2	ZINC000571338213	328111530	/nfs/dbraw/zinc/11/15/30/328111530.db2.gz	ABFXFBCSBBWLGI-UHFFFAOYSA-N	0	0	274.298	4.125	20	30		CIEDRN
CC(C)(C)CC(=O)Nc1nc(-c2cccc(C#N)c2)cs1	ZINC000161061693	328123480	/nfs/dbraw/zinc/12/34/80/328123480.db2.gz	RJQSAFPQDVLPIQ-UHFFFAOYSA-N	0	0	299.399	4.056	20	30		CIEDRN
N#Cc1cccc(NCc2ncc(-c3ccccc3)s2)c1	ZINC000161078924	328125058	/nfs/dbraw/zinc/12/50/58/328125058.db2.gz	VGKZMXYSPJNRQY-UHFFFAOYSA-N	0	0	291.379	4.294	20	30		CIEDRN
C=CCCOCCCCC(=O)N[C@H]1CCC[C@@H]1C(C)(C)C	ZINC000412808493	328125870	/nfs/dbraw/zinc/12/58/70/328125870.db2.gz	GUPGHVFSDAHSMM-HOTGVXAUSA-N	0	0	295.467	4.080	20	30		CIEDRN
C=C[C@@H](CC(=O)N(CC)Cc1occc1C)c1ccccc1	ZINC000412790593	328126309	/nfs/dbraw/zinc/12/63/09/328126309.db2.gz	OGDIPHWSYMNBSO-INIZCTEOSA-N	0	0	297.398	4.296	20	30		CIEDRN
C=CCC1(c2nc(-c3cccc(C)c3)no2)CCC1	ZINC000571564034	328134250	/nfs/dbraw/zinc/13/42/50/328134250.db2.gz	YKSFRNNQCKJMEK-UHFFFAOYSA-N	0	0	254.333	4.043	20	30		CIEDRN
N#CCCSCc1csc(C2CCCCC2)n1	ZINC000413016735	328140583	/nfs/dbraw/zinc/14/05/83/328140583.db2.gz	WUIJVKJRRNUISH-UHFFFAOYSA-N	0	0	266.435	4.338	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(O)cc2SC)CCCC1	ZINC000451382214	328135789	/nfs/dbraw/zinc/13/57/89/328135789.db2.gz	HLIURLTWXCCLOS-UHFFFAOYSA-N	0	0	291.416	4.189	20	30		CIEDRN
CC[C@@H](C)Oc1cc(C)ccc1CNc1cc(C#N)ccn1	ZINC000571589771	328136131	/nfs/dbraw/zinc/13/61/31/328136131.db2.gz	SFADIRBYLLEIHS-CQSZACIVSA-N	0	0	295.386	4.051	20	30		CIEDRN
C[C@@H](C#N)CSc1ccccc1NCCC(F)(F)F	ZINC000571605679	328137521	/nfs/dbraw/zinc/13/75/21/328137521.db2.gz	DDWYBMIJTNEPQB-JTQLQIEISA-N	0	0	288.338	4.303	20	30		CIEDRN
N#Cc1cc(F)c(NC2CCC(C(F)F)CC2)c(F)c1	ZINC000413454476	328147213	/nfs/dbraw/zinc/14/72/13/328147213.db2.gz	WCBOHFIQMMJBAB-UHFFFAOYSA-N	0	0	286.272	4.072	20	30		CIEDRN
C[C@@H](ON=C1CCC1)c1nc(-c2ccc(Cl)cc2)no1	ZINC000266612534	328169687	/nfs/dbraw/zinc/16/96/87/328169687.db2.gz	IFXHXKXICOWAHA-SECBINFHSA-N	0	0	291.738	4.008	20	30		CIEDRN
C=CCCCCCNC(=O)c1c(F)cccc1SC	ZINC000571653098	328213551	/nfs/dbraw/zinc/21/35/51/328213551.db2.gz	FWBXFXCCDZAJMK-UHFFFAOYSA-N	0	0	281.396	4.024	20	30		CIEDRN
C=CCCCC(=O)N(C)[C@H](c1ccccc1)C(F)(F)F	ZINC000177820638	329187101	/nfs/dbraw/zinc/18/71/01/329187101.db2.gz	MAUAWXGVQDRYHA-CQSZACIVSA-N	0	0	285.309	4.105	20	30		CIEDRN
N#CCCCCNc1nc2cc(Cl)cc(Cl)c2o1	ZINC000278607191	328228174	/nfs/dbraw/zinc/22/81/74/328228174.db2.gz	FRFNSTKSXHMBPG-UHFFFAOYSA-N	0	0	284.146	4.240	20	30		CIEDRN
Cc1occc1SCc1ccc(C#N)cc1Cl	ZINC000220980026	329204216	/nfs/dbraw/zinc/20/42/16/329204216.db2.gz	LARCKNNTNLPYLZ-UHFFFAOYSA-N	0	0	263.749	4.405	20	30		CIEDRN
N#C[C@@H]1CC[C@@H](Sc2ncc(-c3ccc(F)cc3)o2)C1	ZINC000278696235	328229788	/nfs/dbraw/zinc/22/97/88/328229788.db2.gz	ZVSVAAKMPHJRNZ-ZWNOBZJWSA-N	0	0	288.347	4.265	20	30		CIEDRN
Cc1ccccc1[C@H](c1noc(CC(C)(C)C#N)n1)C(C)C	ZINC000289024041	328253794	/nfs/dbraw/zinc/25/37/94/328253794.db2.gz	FTUVIULKZSUJFS-MRXNPFEDSA-N	0	0	297.402	4.258	20	30		CIEDRN
Cc1cc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)no1	ZINC000340443188	328277970	/nfs/dbraw/zinc/27/79/70/328277970.db2.gz	FMAXQLCSQWRBOD-HOCLYGCPSA-N	0	0	283.375	4.069	20	30		CIEDRN
CC(C)c1cccc(NC(=O)N[C@H]2CC[C@@H](CC#N)C2)c1	ZINC000296454827	328290651	/nfs/dbraw/zinc/29/06/51/328290651.db2.gz	UWSLRTAOYYAHKH-BBRMVZONSA-N	0	0	285.391	4.014	20	30		CIEDRN
C[C@H](c1ccc(CN(C)[C@@H](C)CC#N)cc1)C(F)(F)F	ZINC000296889481	328292536	/nfs/dbraw/zinc/29/25/36/328292536.db2.gz	XWJPUNNBXJACBF-NWDGAFQWSA-N	0	0	284.325	4.086	20	30		CIEDRN
Cc1sc2nc(C)nc(S[C@@H](C)CCC#N)c2c1C	ZINC000340585931	328294965	/nfs/dbraw/zinc/29/49/65/328294965.db2.gz	ADUJWOHPUHKOIS-QMMMGPOBSA-N	0	0	291.445	4.401	20	30		CIEDRN
C=CCC[C@@H]([NH2+]Cc1cccc(OCC)c1)c1ccco1	ZINC000514092972	328300977	/nfs/dbraw/zinc/30/09/77/328300977.db2.gz	HKRGWOXTLTVSSE-QGZVFWFLSA-N	0	0	285.387	4.475	20	30		CIEDRN
C=CCOc1ccccc1C(=O)Nc1cccc(Cl)c1	ZINC000048439204	328312744	/nfs/dbraw/zinc/31/27/44/328312744.db2.gz	MXVNDHIHRYYTQE-UHFFFAOYSA-N	0	0	287.746	4.157	20	30		CIEDRN
N#Cc1ccc(SCC(=O)c2ccc(Cl)cc2)cc1	ZINC000048512080	328309208	/nfs/dbraw/zinc/30/92/08/328309208.db2.gz	ZEUKSQGDUNDVMZ-UHFFFAOYSA-N	0	0	287.771	4.187	20	30		CIEDRN
Cc1ccccc1CSCCOc1ccccc1C#N	ZINC000048552736	328312398	/nfs/dbraw/zinc/31/23/98/328312398.db2.gz	ANRVVSIBOSYZAL-UHFFFAOYSA-N	0	0	283.396	4.179	20	30		CIEDRN
CC(C)C[C@](C)(C#N)NC(=O)CC[C@@H](C)c1ccccc1	ZINC000534597813	328314348	/nfs/dbraw/zinc/31/43/48/328314348.db2.gz	TXMVVQZKKJELMX-CRAIPNDOSA-N	0	0	286.419	4.015	20	30		CIEDRN
Cc1ccc(CNc2ccc(C#N)c(Cl)c2)cc1F	ZINC000110974942	328322847	/nfs/dbraw/zinc/32/28/47/328322847.db2.gz	SIWCSPWHOJEPPO-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@@H]1CCCC[C@@H]1C)c1ccccc1	ZINC000534601072	328320346	/nfs/dbraw/zinc/32/03/46/328320346.db2.gz	SXIRNBLMEPXHCQ-ZMSDIMECSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=C[C@@H](CC(=O)N(C)CC1CCCCC1)c1ccccc1	ZINC000534607648	328322308	/nfs/dbraw/zinc/32/23/08/328322308.db2.gz	NHNFRZXDNQEEPH-KRWDZBQOSA-N	0	0	285.431	4.385	20	30		CIEDRN
CC(C)CC[C@H]1CCC[C@H]1NC(=O)c1ccc(CC#N)cc1	ZINC000534613627	328325206	/nfs/dbraw/zinc/32/52/06/328325206.db2.gz	HXBFYBGRMUSRKG-SJLPKXTDSA-N	0	0	298.430	4.087	20	30		CIEDRN
C[C@@H](CCc1ccco1)Nc1cccc(Cl)c1C#N	ZINC000048936367	328326225	/nfs/dbraw/zinc/32/62/25/328326225.db2.gz	SNZPYQOXPBGPNW-NSHDSACASA-N	0	0	274.751	4.238	20	30		CIEDRN
CN(Cc1cccc(Cl)c1)c1c(F)cc(C#N)cc1F	ZINC000111141884	328328026	/nfs/dbraw/zinc/32/80/26/328328026.db2.gz	FQAWUSWZEGNABN-UHFFFAOYSA-N	0	0	292.716	4.126	20	30		CIEDRN
CN(Cc1ccc(Cl)cc1)c1c(F)cc(C#N)cc1F	ZINC000111141814	328328046	/nfs/dbraw/zinc/32/80/46/328328046.db2.gz	XUKXFHZLIKWURN-UHFFFAOYSA-N	0	0	292.716	4.126	20	30		CIEDRN
CC(C)n1c2cc(F)ccc2nc1-c1cccc(C#N)c1	ZINC000534628297	328328262	/nfs/dbraw/zinc/32/82/62/328328262.db2.gz	RLWFRODPVMBCQL-UHFFFAOYSA-N	0	0	279.318	4.295	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@H](C)Cc1ccsc1)c1ccccc1	ZINC000534644911	328330536	/nfs/dbraw/zinc/33/05/36/328330536.db2.gz	BOJLBAHDDCDPLE-GDBMZVCRSA-N	0	0	299.439	4.155	20	30		CIEDRN
C=C[C@H](CC(=O)NCc1ccc(CC)s1)c1ccccc1	ZINC000534633709	328333016	/nfs/dbraw/zinc/33/30/16/328333016.db2.gz	AMKYDBAAWLOGEF-CQSZACIVSA-N	0	0	299.439	4.287	20	30		CIEDRN
C=C[C@H](CC(=O)NCc1ccc(C)c(F)c1)c1ccccc1	ZINC000534650303	328336848	/nfs/dbraw/zinc/33/68/48/328336848.db2.gz	QUXPQMHJULWELZ-MRXNPFEDSA-N	0	0	297.373	4.110	20	30		CIEDRN
C=C[C@@H](Cc1nc(-c2ccccc2)no1)c1ccccc1	ZINC000534673356	328348771	/nfs/dbraw/zinc/34/87/71/328348771.db2.gz	LAUDNPVFEHOUPY-AWEZNQCLSA-N	0	0	276.339	4.249	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CCC[C@@H](CCC)C1)c1ccccc1	ZINC000534720978	328359098	/nfs/dbraw/zinc/35/90/98/328359098.db2.gz	GTERPVIXJDXNPB-SJORKVTESA-N	0	0	285.431	4.385	20	30		CIEDRN
C=C[C@H](CC(=O)NCCc1ccc(C)cc1)c1ccccc1	ZINC000534675526	328356060	/nfs/dbraw/zinc/35/60/60/328356060.db2.gz	DUXFISILWAMLHT-GOSISDBHSA-N	0	0	293.410	4.014	20	30		CIEDRN
Cc1ccccc1[C@H](C)CC(=O)Nc1ccc(F)c(C#N)c1	ZINC000303689746	328357696	/nfs/dbraw/zinc/35/76/96/328357696.db2.gz	MHYAYRSYZCRRSM-CYBMUJFWSA-N	0	0	296.345	4.138	20	30		CIEDRN
C=C[C@H](CC(=O)NC(C)(C)c1ccccc1)c1ccccc1	ZINC000534743666	328359866	/nfs/dbraw/zinc/35/98/66/328359866.db2.gz	WNIBEHDNTFIUOE-MRXNPFEDSA-N	0	0	293.410	4.398	20	30		CIEDRN
C=CCCNc1cccc(OCc2cccc(C#N)c2)c1	ZINC000303787609	328358179	/nfs/dbraw/zinc/35/81/79/328358179.db2.gz	DURVTJHJRQXVHK-UHFFFAOYSA-N	0	0	278.355	4.125	20	30		CIEDRN
C=CCCNc1ccc(Cl)cc1OCC(F)(F)F	ZINC000303775724	328358330	/nfs/dbraw/zinc/35/83/30/328358330.db2.gz	CFYIRYBJJHPASZ-UHFFFAOYSA-N	0	0	279.689	4.269	20	30		CIEDRN
COc1cc(C#N)ccc1O[C@@H]1CCCc2ccc(F)cc21	ZINC000534799233	328362163	/nfs/dbraw/zinc/36/21/63/328362163.db2.gz	AWWCUZIWORHTSX-MRXNPFEDSA-N	0	0	297.329	4.162	20	30		CIEDRN
CCc1ccc([C@@H]2C[C@H](C)CCN2c2cccc(C#N)n2)o1	ZINC000534881393	328366701	/nfs/dbraw/zinc/36/67/01/328366701.db2.gz	DTBFFKCEQIOXGX-CJNGLKHVSA-N	0	0	295.386	4.086	20	30		CIEDRN
N#CCc1cccc(-c2nc(-c3ccccc3Cl)no2)c1	ZINC000172054813	335092729	/nfs/dbraw/zinc/09/27/29/335092729.db2.gz	BRFWNGPELAJMJS-UHFFFAOYSA-N	0	0	295.729	4.123	20	30		CIEDRN
CC[C@@H](C)Oc1cccc(NCc2cccc(C#N)c2)c1	ZINC000049593056	328374178	/nfs/dbraw/zinc/37/41/78/328374178.db2.gz	CEMPPAMPEWIBET-CQSZACIVSA-N	0	0	280.371	4.348	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)C2CCCCCC2)s1	ZINC000101817527	328377644	/nfs/dbraw/zinc/37/76/44/328377644.db2.gz	GLNQZAMTEMLJHN-UHFFFAOYSA-N	0	0	276.405	4.091	20	30		CIEDRN
CCN(C(=O)C1CCCCCC1)[C@@H](C)c1ccc(C#N)cc1	ZINC000101812660	328377679	/nfs/dbraw/zinc/37/76/79/328377679.db2.gz	LURBFDHEMITKQU-HNNXBMFYSA-N	0	0	298.430	4.438	20	30		CIEDRN
CC(C)(C)c1ccc([C@H](C#N)NC(=O)C2CCCCC2)cc1	ZINC000049904284	328381450	/nfs/dbraw/zinc/38/14/50/328381450.db2.gz	MELHGYCXUKMUIX-KRWDZBQOSA-N	0	0	298.430	4.245	20	30		CIEDRN
CC(C)C[C@H](Nc1cccc(C#N)n1)c1ccccc1	ZINC000535134506	328391216	/nfs/dbraw/zinc/39/12/16/328391216.db2.gz	ONKNNQIAPLQJKG-INIZCTEOSA-N	0	0	265.360	4.153	20	30		CIEDRN
CN(C(=O)C[C@@H]1CCCC(C)(C)C1)c1ccc(C#N)cc1	ZINC000535212260	328394708	/nfs/dbraw/zinc/39/47/08/328394708.db2.gz	YZCWUFSKVMZENJ-HNNXBMFYSA-N	0	0	284.403	4.128	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)C[C@H]1C[C@H]1c1ccccc1	ZINC000341678526	328413965	/nfs/dbraw/zinc/41/39/65/328413965.db2.gz	QDBASCRKVIZESL-SJORKVTESA-N	0	0	298.430	4.111	20	30		CIEDRN
CC1(C)CCC[C@H](c2noc(C3(C#N)CCCCC3)n2)C1	ZINC000535281245	328437530	/nfs/dbraw/zinc/43/75/30/328437530.db2.gz	NISJTNPXYUQJPW-ZDUSSCGKSA-N	0	0	287.407	4.479	20	30		CIEDRN
C=C[C@@H](CC(=O)N(C)[C@H](C)C(C)(C)C)c1ccccc1	ZINC000535366673	328444794	/nfs/dbraw/zinc/44/47/94/328444794.db2.gz	BPEYMVZUEQDZBA-CABCVRRESA-N	0	0	273.420	4.239	20	30		CIEDRN
CCC[C@H](C)C(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1	ZINC000112910695	328451456	/nfs/dbraw/zinc/45/14/56/328451456.db2.gz	HMTGXAHUZVKROI-TVQRCGJNSA-N	0	0	299.201	4.110	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CCC[C@](C)(CC)C1)c1ccccc1	ZINC000535404320	328451541	/nfs/dbraw/zinc/45/15/41/328451541.db2.gz	JDICPQNBPOOVDY-LPHOPBHVSA-N	0	0	285.431	4.385	20	30		CIEDRN
C=C[C@@H](CC(=O)NCCc1cccc(C)c1)c1ccccc1	ZINC000535408064	328451738	/nfs/dbraw/zinc/45/17/38/328451738.db2.gz	ADFAEPZAYRGFNR-SFHVURJKSA-N	0	0	293.410	4.014	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@@H]1c1ccsc1	ZINC000123636050	328454097	/nfs/dbraw/zinc/45/40/97/328454097.db2.gz	ZSLWPMUDZITAKP-OAHLLOKOSA-N	0	0	275.417	4.180	20	30		CIEDRN
CO[C@H]1CCC[C@@H](CC(=O)Nc2cccc3ocnc32)C1	ZINC000328873280	328458971	/nfs/dbraw/zinc/45/89/71/328458971.db2.gz	IZXQTCCHVUGAEN-NEPJUHHUSA-N	0	0	288.347	4.011	20	30		CIEDRN
C[C@@H]1CCCC[C@@H]1CNC(=O)Nc1scnc1C1CC1	ZINC000328908292	328459791	/nfs/dbraw/zinc/45/97/91/328459791.db2.gz	CUPNOOBCNYFVAJ-ZYHUDNBSSA-N	0	0	293.436	4.173	20	30		CIEDRN
CC[C@H](NC(=O)c1ccc(Cl)c(N)c1Cl)C(C)C	ZINC000330992141	328471390	/nfs/dbraw/zinc/47/13/90/328471390.db2.gz	YMYYDYPOGZPFIP-JTQLQIEISA-N	0	0	289.206	4.315	20	30		CIEDRN
C[C@H]1CC(NC(=O)C[C@@H](CC#N)c2ccccc2)C[C@H](C)C1	ZINC000331055764	328476797	/nfs/dbraw/zinc/47/67/97/328476797.db2.gz	KRHHTXWOLALSTF-BFYDXBDKSA-N	0	0	298.430	4.015	20	30		CIEDRN
C#CCCCC(=O)N(C)Cc1ccccc1-c1ccccc1	ZINC000192102517	328521080	/nfs/dbraw/zinc/52/10/80/328521080.db2.gz	VGIGSWPARAUIRG-UHFFFAOYSA-N	0	0	291.394	4.116	20	30		CIEDRN
C=CCC(C)(C)C(=O)O[C@H](C)c1nc2ccccc2o1	ZINC000292248309	328536686	/nfs/dbraw/zinc/53/66/86/328536686.db2.gz	OVRNBGFQJWHHIV-LLVKDONJSA-N	0	0	273.332	4.034	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1C[C@H](c2ccc(F)cc2)C[C@@H]1C	ZINC000292905608	328542260	/nfs/dbraw/zinc/54/22/60/328542260.db2.gz	VFMNPUVZDVKVIZ-DZGCQCFKSA-N	0	0	289.394	4.132	20	30		CIEDRN
CCc1cc(NCc2cccc(C#N)c2F)ccc1F	ZINC000506296502	332768821	/nfs/dbraw/zinc/76/88/21/332768821.db2.gz	ZKWUAGHWGOIJGR-UHFFFAOYSA-N	0	0	272.298	4.011	20	30		CIEDRN
N#Cc1c(F)cccc1SCc1cccc(F)c1F	ZINC000582160110	328580251	/nfs/dbraw/zinc/58/02/51/328580251.db2.gz	PJDRBEJMVAXHSS-UHFFFAOYSA-N	0	0	279.286	4.268	20	30		CIEDRN
N#Cc1cc(Cl)ccc1NCc1ccc(Cl)cc1	ZINC000052856646	328654806	/nfs/dbraw/zinc/65/48/06/328654806.db2.gz	LAPZDVGOBRLULW-UHFFFAOYSA-N	0	0	277.154	4.477	20	30		CIEDRN
C=CCn1c(SC[C@H](C)c2ccccc2)nnc1C1CC1	ZINC000116610413	326792118	/nfs/dbraw/zinc/79/21/18/326792118.db2.gz	BDECDOVDEXSKHS-ZDUSSCGKSA-N	0	0	299.443	4.237	20	30		CIEDRN
CSCc1ccc(NCc2ccc(C#N)cc2F)cc1	ZINC000533446607	326834046	/nfs/dbraw/zinc/83/40/46/326834046.db2.gz	XOUNEAREJOJIJD-UHFFFAOYSA-N	0	0	286.375	4.172	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1ccc2occ(C)c2c1	ZINC000187984727	326839346	/nfs/dbraw/zinc/83/93/46/326839346.db2.gz	OKZREPYUQXZRRD-UHFFFAOYSA-N	0	0	272.348	4.171	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1ncccc1Cl)c1ccccc1	ZINC000179940116	326843833	/nfs/dbraw/zinc/84/38/33/326843833.db2.gz	NEYQUSYJJNMINJ-GFCCVEGCSA-N	0	0	286.762	4.033	20	30		CIEDRN
CCN(C(=O)C[C@H]1CCCC[C@@H]1C)c1ccc(C#N)cc1	ZINC000533573678	326865529	/nfs/dbraw/zinc/86/55/29/326865529.db2.gz	BKWBHBBWXWFPPM-GOEBONIOSA-N	0	0	284.403	4.128	20	30		CIEDRN
CC(C)CCc1ccc(NC(=O)N(C)[C@H](C)CC#N)cc1	ZINC000530780392	326890877	/nfs/dbraw/zinc/89/08/77/326890877.db2.gz	ZTZMWPSAVKVMLR-CQSZACIVSA-N	0	0	287.407	4.041	20	30		CIEDRN
CC(C)CCc1ccc(NC(=O)N(C)[C@@H](C)CC#N)cc1	ZINC000530780385	326890888	/nfs/dbraw/zinc/89/08/88/326890888.db2.gz	ZTZMWPSAVKVMLR-AWEZNQCLSA-N	0	0	287.407	4.041	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)[C@H]1CCCC(C)(C)C1	ZINC000533712830	326915235	/nfs/dbraw/zinc/91/52/35/326915235.db2.gz	UYGBMUCICVHZFC-AWEZNQCLSA-N	0	0	270.376	4.022	20	30		CIEDRN
C=CCC(F)(F)c1nc(Cc2ccc(Cl)cc2C)no1	ZINC000556320425	326918168	/nfs/dbraw/zinc/91/81/68/326918168.db2.gz	KERPZAFOSMUWPW-UHFFFAOYSA-N	0	0	298.720	4.290	20	30		CIEDRN
Cc1cc(OCc2csc(C3CC3)n2)c(C)c(C)c1C#N	ZINC000506415215	332772360	/nfs/dbraw/zinc/77/23/60/332772360.db2.gz	HGBKVOHQKVQXDS-UHFFFAOYSA-N	0	0	298.411	4.396	20	30		CIEDRN
COc1cccc(F)c1[C@H](C)Nc1ccc(F)cc1C#N	ZINC000078420772	326923229	/nfs/dbraw/zinc/92/32/29/326923229.db2.gz	LWLPXTMWYSMIDE-JTQLQIEISA-N	0	0	288.297	4.018	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H]2CCc3cccc(OC)c32)n1	ZINC000556365006	326923402	/nfs/dbraw/zinc/92/34/02/326923402.db2.gz	LBNBIFDVCJTWEJ-ZDUSSCGKSA-N	0	0	298.386	4.010	20	30		CIEDRN
C=CCC(C)(C)c1noc(COc2cc(C)cc(C)c2)n1	ZINC000556364959	326923407	/nfs/dbraw/zinc/92/34/07/326923407.db2.gz	KKVHFWAOIVEAOS-UHFFFAOYSA-N	0	0	286.375	4.119	20	30		CIEDRN
C=CCCCCNc1cccc(OCCCC#N)c1	ZINC000556414296	326940332	/nfs/dbraw/zinc/94/03/32/326940332.db2.gz	PKZRPVHYQACXDU-UHFFFAOYSA-N	0	0	258.365	4.137	20	30		CIEDRN
CC(C)(C#N)CCOc1ccc([N+](=O)[O-])c2ccccc12	ZINC000087596177	326943272	/nfs/dbraw/zinc/94/32/72/326943272.db2.gz	NIXXVSQRKUGZDX-UHFFFAOYSA-N	0	0	284.315	4.067	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)C/C=C\c1ccc(F)cc1	ZINC000255195341	326957119	/nfs/dbraw/zinc/95/71/19/326957119.db2.gz	PUACZHLYEQLBJH-IHWYPQMZSA-N	0	0	294.329	4.048	20	30		CIEDRN
C=C1CCN(C(=O)c2sccc2-c2ccccc2)CC1	ZINC000556928492	326983981	/nfs/dbraw/zinc/98/39/81/326983981.db2.gz	CVALTCJIQSDOKU-UHFFFAOYSA-N	0	0	283.396	4.207	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc2c(Cl)cccc2n1	ZINC000556931626	326984346	/nfs/dbraw/zinc/98/43/46/326984346.db2.gz	HFMNTIJYTOEYDG-UHFFFAOYSA-N	0	0	288.778	4.429	20	30		CIEDRN
C=CCN(C(=O)Nc1cccc(O[C@H](C)CC)c1)C1CC1	ZINC000557243393	326998341	/nfs/dbraw/zinc/99/83/41/326998341.db2.gz	UTSOEHPXKKSLDY-CYBMUJFWSA-N	0	0	288.391	4.046	20	30		CIEDRN
C=CCCCCSCc1nccn1CC(F)(F)F	ZINC000557293938	327000562	/nfs/dbraw/zinc/00/05/62/327000562.db2.gz	CZEHWPSDNYZGDQ-UHFFFAOYSA-N	0	0	278.343	4.035	20	30		CIEDRN
Cc1cc(C#N)nc(N[C@H](C)c2cc3ccccc3s2)n1	ZINC000557426205	327005022	/nfs/dbraw/zinc/00/50/22/327005022.db2.gz	UWUASEKNIPXECD-LLVKDONJSA-N	0	0	294.383	4.045	20	30		CIEDRN
N#Cc1ccnc(N[C@H](c2ccc(Cl)cc2)C2CC2)c1	ZINC000557479411	327007767	/nfs/dbraw/zinc/00/77/67/327007767.db2.gz	YGHOQUCJXLJUPF-INIZCTEOSA-N	0	0	283.762	4.170	20	30		CIEDRN
C=C(C)CCNc1ccc(C(=O)N(CC)CC)c(Cl)c1	ZINC000557509382	327010612	/nfs/dbraw/zinc/01/06/12/327010612.db2.gz	ZOPNLSCXGZEHQC-UHFFFAOYSA-N	0	0	294.826	4.200	20	30		CIEDRN
C[C@H]1CC[C@H](Nc2nccc(C#N)c2Cl)c2ccccc21	ZINC000557639839	327018267	/nfs/dbraw/zinc/01/82/67/327018267.db2.gz	UFPYNZAFDVMOTM-NHYWBVRUSA-N	0	0	297.789	4.079	20	30		CIEDRN
N#Cc1ccnc(N[C@H]2CCC[C@@H](c3ccccc3)C2)c1	ZINC000557682508	327020663	/nfs/dbraw/zinc/02/06/63/327020663.db2.gz	OKFHQIZHDCSSRZ-SJORKVTESA-N	0	0	277.371	4.092	20	30		CIEDRN
COc1ccc(CSc2ccc(F)c(F)c2)cc1C#N	ZINC000087833715	327025505	/nfs/dbraw/zinc/02/55/05/327025505.db2.gz	IILQYIJXALCMSY-UHFFFAOYSA-N	0	0	291.322	4.137	20	30		CIEDRN
COc1ccc(CSc2cc(F)ccc2F)cc1C#N	ZINC000087833722	327025574	/nfs/dbraw/zinc/02/55/74/327025574.db2.gz	VBJVOHHJFJWDQU-UHFFFAOYSA-N	0	0	291.322	4.137	20	30		CIEDRN
CC(C)(CCNC(=O)C[C@H](CC#N)c1ccccc1)C1CC1	ZINC000557987586	327039273	/nfs/dbraw/zinc/03/92/73/327039273.db2.gz	IUFHXBWODKNNGN-INIZCTEOSA-N	0	0	298.430	4.016	20	30		CIEDRN
C[C@H]1C[C@@H](CC(=O)NCC(C)(C)CCC#N)CC(C)(C)C1	ZINC000557999689	327039601	/nfs/dbraw/zinc/03/96/01/327039601.db2.gz	LCOMLKWDSGRMOE-GJZGRUSLSA-N	0	0	292.467	4.285	20	30		CIEDRN
C[C@@H]1C[C@H](CC(=O)NCC(C)(C)CCC#N)CC(C)(C)C1	ZINC000557999690	327039747	/nfs/dbraw/zinc/03/97/47/327039747.db2.gz	LCOMLKWDSGRMOE-HUUCEWRRSA-N	0	0	292.467	4.285	20	30		CIEDRN
C/C=C\c1ccc(NCCOc2cccc(C#N)c2)cc1	ZINC000584137929	327048299	/nfs/dbraw/zinc/04/82/99/327048299.db2.gz	LNGNLQFPXWHUSR-RQOWECAXSA-N	0	0	278.355	4.082	20	30		CIEDRN
C=CCC[C@@H](Nc1cnn(CC(C)C)c1C)C1CC1	ZINC000558135401	327075549	/nfs/dbraw/zinc/07/55/49/327075549.db2.gz	PVIPGIPOVFAXIJ-OAHLLOKOSA-N	0	0	261.413	4.004	20	30		CIEDRN
N#CCc1ccc(CSCc2c(F)cccc2F)cc1	ZINC000558142406	327075822	/nfs/dbraw/zinc/07/58/22/327075822.db2.gz	PJQDWCSFDCIDTJ-UHFFFAOYSA-N	0	0	289.350	4.464	20	30		CIEDRN
CC[C@H](CC#N)Nc1c(Cl)cc(Cl)cc1[N+](=O)[O-]	ZINC000553494995	327078045	/nfs/dbraw/zinc/07/80/45/327078045.db2.gz	RRPHERBUTRTAJD-MRVPVSSYSA-N	0	0	288.134	4.006	20	30		CIEDRN
Cc1csc(NC(=O)c2ccc(Cl)cc2C)c1C#N	ZINC000558244870	327081163	/nfs/dbraw/zinc/08/11/63/327081163.db2.gz	VQVGMQJEHNRTLT-UHFFFAOYSA-N	0	0	290.775	4.142	20	30		CIEDRN
Cc1csc(NC(=O)C[C@H](C)c2ccccc2C)c1C#N	ZINC000558244847	327081279	/nfs/dbraw/zinc/08/12/79/327081279.db2.gz	VIEYODFHNOGEPQ-LBPRGKRZSA-N	0	0	298.411	4.369	20	30		CIEDRN
N#Cc1c(F)cccc1Nc1cccc(N2CCCC2)c1	ZINC000506833638	332780966	/nfs/dbraw/zinc/78/09/66/332780966.db2.gz	RVVNCISXKFXXFY-UHFFFAOYSA-N	0	0	281.334	4.041	20	30		CIEDRN
COCc1ccccc1/C=C(\C)CNc1cccc(C#N)c1	ZINC000506852566	332781098	/nfs/dbraw/zinc/78/10/98/332781098.db2.gz	XGADAFXFKJABRL-XNTDXEJSSA-N	0	0	292.382	4.220	20	30		CIEDRN
N#Cc1c(C(F)F)cccc1N1CCc2sccc2C1	ZINC000558520417	327100978	/nfs/dbraw/zinc/10/09/78/327100978.db2.gz	OMSNIBZOBLNGIS-UHFFFAOYSA-N	0	0	290.338	4.120	20	30		CIEDRN
N#Cc1ccc(NC[C@H]2CC[C@@H](c3ccccc3)O2)c(F)c1	ZINC000558600329	327108305	/nfs/dbraw/zinc/10/83/05/327108305.db2.gz	VNTUJOGMLLYDJC-QAPCUYQASA-N	0	0	296.345	4.030	20	30		CIEDRN
C/C(=C\c1ccccc1C(F)(F)F)CNCC1(C#N)CC1	ZINC000558621054	327109162	/nfs/dbraw/zinc/10/91/62/327109162.db2.gz	BTHQQWVQYBTLRD-XYOKQWHBSA-N	0	0	294.320	4.002	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)C[C@@H](C)n2cccc2)CCCC1(C)C	ZINC000558694706	327115066	/nfs/dbraw/zinc/11/50/66/327115066.db2.gz	JIZPOWZEMBDNLT-CVEARBPZSA-N	0	0	288.435	4.033	20	30		CIEDRN
C=CC[C@H]1N(C(=O)C[C@H](C)n2cccc2)CCCC1(C)C	ZINC000558694710	327115091	/nfs/dbraw/zinc/11/50/91/327115091.db2.gz	JIZPOWZEMBDNLT-JKSUJKDBSA-N	0	0	288.435	4.033	20	30		CIEDRN
C=CC[C@H]1N(C(=O)C[C@@H](C)n2cccc2)CCCC1(C)C	ZINC000558694708	327115095	/nfs/dbraw/zinc/11/50/95/327115095.db2.gz	JIZPOWZEMBDNLT-HZPDHXFCSA-N	0	0	288.435	4.033	20	30		CIEDRN
C[C@H](CC(C)(C)C)C(=O)N[C@](C)(C#N)C1CCCCC1	ZINC000558717325	327116781	/nfs/dbraw/zinc/11/67/81/327116781.db2.gz	NDGAJGZKSQFUFV-CXAGYDPISA-N	0	0	278.440	4.037	20	30		CIEDRN
N#Cc1ccc(Oc2nc(C3CC3)ns2)c2ccccc12	ZINC000559007025	327137795	/nfs/dbraw/zinc/13/77/95/327137795.db2.gz	DWJGOTYXIGLCAP-UHFFFAOYSA-N	0	0	293.351	4.233	20	30		CIEDRN
Cc1cccc2c1[C@H](C)C[C@@H]2CC(=O)N(CCC#N)C(C)C	ZINC000559043035	327138919	/nfs/dbraw/zinc/13/89/19/327138919.db2.gz	CLOXBFMVTNQIJD-HZPDHXFCSA-N	0	0	298.430	4.127	20	30		CIEDRN
Cc1cccc2c1[C@@H](C)C[C@@H]2CC(=O)N(CCC#N)C(C)C	ZINC000559043036	327138964	/nfs/dbraw/zinc/13/89/64/327138964.db2.gz	CLOXBFMVTNQIJD-JKSUJKDBSA-N	0	0	298.430	4.127	20	30		CIEDRN
CCc1nc(C(C)C)ccc1CN(CC#N)C1CCCC1	ZINC000559099785	327141360	/nfs/dbraw/zinc/14/13/60/327141360.db2.gz	FNPZJEKAHDJLFC-UHFFFAOYSA-N	0	0	285.435	4.036	20	30		CIEDRN
C=CCCSCC(=O)N(CCC)Cc1ccc(C)cc1	ZINC000559154641	327143872	/nfs/dbraw/zinc/14/38/72/327143872.db2.gz	LHHOTGKSBWAQGW-UHFFFAOYSA-N	0	0	291.460	4.043	20	30		CIEDRN
C=CCCSCC[C@@H](C)OCc1ccccc1	ZINC000559156478	327144059	/nfs/dbraw/zinc/14/40/59/327144059.db2.gz	GIDFWSKTWCTLRN-CQSZACIVSA-N	0	0	250.407	4.291	20	30		CIEDRN
N#CCc1cccc(C(=O)Nc2cccc(C3CCC3)c2)c1	ZINC000564650182	327148762	/nfs/dbraw/zinc/14/87/62/327148762.db2.gz	WNPAYJJVBULQIQ-UHFFFAOYSA-N	0	0	290.366	4.272	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCc1cccc(Cl)c1Cl	ZINC000559292727	327155593	/nfs/dbraw/zinc/15/55/93/327155593.db2.gz	JURKZPHIQIYATA-UHFFFAOYSA-N	0	0	286.202	4.212	20	30		CIEDRN
N#Cc1ccc(NCc2ccc(C(F)F)cc2)c(F)c1	ZINC000131407011	327162045	/nfs/dbraw/zinc/16/20/45/327162045.db2.gz	ICAKYZFYHXGVHU-UHFFFAOYSA-N	0	0	276.261	4.247	20	30		CIEDRN
N#CCc1ccc(NCc2cc(Cl)ccc2F)cc1	ZINC000131985703	327166711	/nfs/dbraw/zinc/16/67/11/327166711.db2.gz	WATWYVONCSUMGE-UHFFFAOYSA-N	0	0	274.726	4.157	20	30		CIEDRN
C=CCCc1ccccc1NCc1cn2cccc(C)c2n1	ZINC000409856498	327166742	/nfs/dbraw/zinc/16/67/42/327166742.db2.gz	IAVDLSIYFWFADR-UHFFFAOYSA-N	0	0	291.398	4.373	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1ccccc1Cc1ccccc1	ZINC000569384082	327171544	/nfs/dbraw/zinc/17/15/44/327171544.db2.gz	JYGNLOUSBBWWBT-HNNXBMFYSA-N	0	0	294.398	4.364	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)[C@@H](C)CCCc1ccccc1	ZINC000410128227	327179716	/nfs/dbraw/zinc/17/97/16/327179716.db2.gz	QYBFBYGZYRNSSY-DOTOQJQBSA-N	0	0	273.420	4.116	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)[C@H](C)CCCc1ccccc1	ZINC000410128228	327179762	/nfs/dbraw/zinc/17/97/62/327179762.db2.gz	QYBFBYGZYRNSSY-NVXWUHKLSA-N	0	0	273.420	4.116	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@@H](C)CSc1ccc(F)cc1	ZINC000410131339	327180184	/nfs/dbraw/zinc/18/01/84/327180184.db2.gz	QZMPDXXMRUROLX-JSGCOSHPSA-N	0	0	295.423	4.025	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1cc(Cl)ccc1Cl	ZINC000410145959	327181386	/nfs/dbraw/zinc/18/13/86/327181386.db2.gz	QUZCNWRUQDJADK-SNVBAGLBSA-N	0	0	272.175	4.078	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1sccc1OC	ZINC000410360873	327188052	/nfs/dbraw/zinc/18/80/52/327188052.db2.gz	BXHPXNSMEDFVFC-UHFFFAOYSA-N	0	0	287.384	4.128	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1ccc(F)cc1	ZINC000410379704	327189198	/nfs/dbraw/zinc/18/91/98/327189198.db2.gz	PYHFWOSEOSNKIS-UHFFFAOYSA-N	0	0	269.319	4.197	20	30		CIEDRN
C[C@H](c1ccc(C#N)cc1)N(C)Cc1c(F)cccc1F	ZINC000559366723	327196339	/nfs/dbraw/zinc/19/63/39/327196339.db2.gz	OZMQZPITADORRJ-GFCCVEGCSA-N	0	0	286.325	4.029	20	30		CIEDRN
CCCC[C@@H](CC)CC(=O)N[C@@](C)(C#N)CC(C)C	ZINC000533878026	327231198	/nfs/dbraw/zinc/23/11/98/327231198.db2.gz	UOYKNHZQNCZHIA-GDBMZVCRSA-N	0	0	266.429	4.037	20	30		CIEDRN
CCCC[C@H](CC)CC(=O)N[C@@](C)(C#N)CC(C)C	ZINC000533878027	327231312	/nfs/dbraw/zinc/23/13/12/327231312.db2.gz	UOYKNHZQNCZHIA-GOEBONIOSA-N	0	0	266.429	4.037	20	30		CIEDRN
C=C[C@H](CC(=O)NCc1ccc(C)cc1C)c1ccccc1	ZINC000533883147	327235944	/nfs/dbraw/zinc/23/59/44/327235944.db2.gz	TVZCSFQQIMLJJB-QGZVFWFLSA-N	0	0	293.410	4.280	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)C[C@H]1CCCC[C@H]1C	ZINC000531070096	327238879	/nfs/dbraw/zinc/23/88/79/327238879.db2.gz	HFEOPVQSZCRMLM-IUODEOHRSA-N	0	0	270.376	4.022	20	30		CIEDRN
CC[C@H](Cc1ccccc1)C(=O)Nc1cc(C#N)ccc1C	ZINC000531082419	327241132	/nfs/dbraw/zinc/24/11/32/327241132.db2.gz	XEHASEXFZFNOLG-QGZVFWFLSA-N	0	0	292.382	4.074	20	30		CIEDRN
C[C@H](CC1CCCCC1)C(=O)N1CCc2ccc(C#N)cc21	ZINC000559474009	327247732	/nfs/dbraw/zinc/24/77/32/327247732.db2.gz	MJPFUAIHZFOGJL-CQSZACIVSA-N	0	0	296.414	4.054	20	30		CIEDRN
CC1(C)CCCC[C@@H]1CC(=O)N1CCc2ccc(C#N)cc21	ZINC000559473972	327247846	/nfs/dbraw/zinc/24/78/46/327247846.db2.gz	JYSBWSZSVXECMS-MRXNPFEDSA-N	0	0	296.414	4.054	20	30		CIEDRN
C[C@@H](CC1CCCCC1)C(=O)N1CCc2ccc(C#N)cc21	ZINC000559474008	327247864	/nfs/dbraw/zinc/24/78/64/327247864.db2.gz	MJPFUAIHZFOGJL-AWEZNQCLSA-N	0	0	296.414	4.054	20	30		CIEDRN
C[C@@H](c1ccccc1Cl)N(C)C(=O)c1cccc(C#N)c1	ZINC000043749837	327262944	/nfs/dbraw/zinc/26/29/44/327262944.db2.gz	PQLJDGONKQIZTC-LBPRGKRZSA-N	0	0	298.773	4.045	20	30		CIEDRN
CC(C)(C)C(C)(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000559923803	327272133	/nfs/dbraw/zinc/27/21/33/327272133.db2.gz	BLFBDSKHNWVSOR-UHFFFAOYSA-N	0	0	286.419	4.499	20	30		CIEDRN
N#Cc1cccc(-c2nc(-c3ccc(Cl)cc3F)no2)c1	ZINC000560006300	327277013	/nfs/dbraw/zinc/27/70/13/327277013.db2.gz	PEMTWCUUSPKJGU-UHFFFAOYSA-N	0	0	299.692	4.068	20	30		CIEDRN
C=CCC(C)(C)c1noc(/C=C/c2cccc([N+](=O)[O-])c2)n1	ZINC000560021716	327277989	/nfs/dbraw/zinc/27/79/89/327277989.db2.gz	HNJNOOBIYFEDFU-CMDGGOBGSA-N	0	0	299.330	4.002	20	30		CIEDRN
C=CCC(C)(C)c1noc(COC/C=C/c2ccccc2)n1	ZINC000560022074	327277993	/nfs/dbraw/zinc/27/79/93/327277993.db2.gz	QSIQXHGGNYEFLV-DHZHZOJOSA-N	0	0	298.386	4.153	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H](C)c2ccsc2)n1	ZINC000560024786	327278210	/nfs/dbraw/zinc/27/82/10/327278210.db2.gz	MYGAENDYFBMQQL-JTQLQIEISA-N	0	0	262.378	4.137	20	30		CIEDRN
C=CCC(C)(C)c1noc(C[C@H](C)c2ccc(F)cc2)n1	ZINC000560025130	327278249	/nfs/dbraw/zinc/27/82/49/327278249.db2.gz	ZHFYFDXBWLKFIZ-LBPRGKRZSA-N	0	0	288.366	4.409	20	30		CIEDRN
C=CCCC1(c2nc(Cc3cc4ccccc4o3)no2)CC1	ZINC000560044133	327280015	/nfs/dbraw/zinc/28/00/15/327280015.db2.gz	RGFOSVKRKDELDL-UHFFFAOYSA-N	0	0	294.354	4.404	20	30		CIEDRN
CO[C@@H](CSCc1ccccc1C#N)c1ccccc1	ZINC000560063024	327282046	/nfs/dbraw/zinc/28/20/46/327282046.db2.gz	JZJJWBAHYHGTKP-KRWDZBQOSA-N	0	0	283.396	4.179	20	30		CIEDRN
C=CCCCN(C)C(=O)c1ccc(CCC(F)(F)F)cc1	ZINC000153099073	327308222	/nfs/dbraw/zinc/30/82/22/327308222.db2.gz	JNIOFHONQDKBOM-UHFFFAOYSA-N	0	0	299.336	4.220	20	30		CIEDRN
CC(C)(C)C[C@H](Nc1cc(C#N)ncn1)c1ccc(F)cc1	ZINC000583359449	327318535	/nfs/dbraw/zinc/31/85/35/327318535.db2.gz	UMKAIICGUSERFJ-HNNXBMFYSA-N	0	0	298.365	4.077	20	30		CIEDRN
CC(C)(C)[C@H]1CCC[C@H](NC(=O)CC(C)(C)C#N)CC1	ZINC000507187794	332794289	/nfs/dbraw/zinc/79/42/89/332794289.db2.gz	MAHJCXASIDVAMM-KBPBESRZSA-N	0	0	278.440	4.037	20	30		CIEDRN
CC[C@H](C)CCC(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1	ZINC000560549638	327323568	/nfs/dbraw/zinc/32/35/68/327323568.db2.gz	RJPBYRWKTILNNC-RYQLBKOJSA-N	0	0	298.430	4.111	20	30		CIEDRN
C=CCC[C@@H]([NH2+]CCc1ccc(F)c(F)c1)c1ccco1	ZINC000560552277	327324001	/nfs/dbraw/zinc/32/40/01/327324001.db2.gz	ODKPHGPPLLNQEW-MRXNPFEDSA-N	0	0	291.341	4.397	20	30		CIEDRN
Cc1ccc(C[N@H+]2CC=C(c3ccc(C#N)cc3)CC2)s1	ZINC000560674985	327336028	/nfs/dbraw/zinc/33/60/28/327336028.db2.gz	HIMUWPHOSYTRPF-UHFFFAOYSA-N	0	0	294.423	4.218	20	30		CIEDRN
C=CCCC[C@@H](C)Sc1nnc(C(C)(C)C)o1	ZINC000462384231	331321049	/nfs/dbraw/zinc/32/10/49/331321049.db2.gz	MKVSBZYLXZBZPL-SNVBAGLBSA-N	0	0	254.399	4.204	20	30		CIEDRN
C=C(CC)CSCCC(=O)Nc1ccccc1C	ZINC000560938733	327353229	/nfs/dbraw/zinc/35/32/29/327353229.db2.gz	BLWQDFMTYQMFHE-UHFFFAOYSA-N	0	0	263.406	4.023	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cccc(-c2ncco2)c1C	ZINC000560988779	327356340	/nfs/dbraw/zinc/35/63/40/327356340.db2.gz	CJKVCFKBMNFUMX-QGZVFWFLSA-N	0	0	284.359	4.191	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)c1cc(C(C)C)oc1C	ZINC000584314417	327375138	/nfs/dbraw/zinc/37/51/38/327375138.db2.gz	HPQVEXYDJHBCML-UHFFFAOYSA-N	0	0	290.407	4.304	20	30		CIEDRN
C=CCCCCOc1cccc(Oc2ncccn2)c1	ZINC000561223123	327376845	/nfs/dbraw/zinc/37/68/45/327376845.db2.gz	XMVVETKENNYFKM-UHFFFAOYSA-N	0	0	270.332	4.004	20	30		CIEDRN
CC(C)(C)CCCCC(=O)NC1(c2cccc(C#N)c2)CC1	ZINC000561225125	327377488	/nfs/dbraw/zinc/37/74/88/327377488.db2.gz	IUPKKXHYWICPDN-UHFFFAOYSA-N	0	0	298.430	4.270	20	30		CIEDRN
C[C@H]1CCC[C@H](C(=O)Nc2ccc(C(C)(C)C#N)cc2)C1	ZINC000150781985	327377691	/nfs/dbraw/zinc/37/76/91/327377691.db2.gz	RRRZINYCQKJUBT-KBPBESRZSA-N	0	0	284.403	4.253	20	30		CIEDRN
C=CCCCCSCc1noc(-c2scnc2C)n1	ZINC000561244925	327378543	/nfs/dbraw/zinc/37/85/43/327378543.db2.gz	YHGRFWRJYJPOCP-UHFFFAOYSA-N	0	0	295.433	4.091	20	30		CIEDRN
Cc1ccccc1[C@H]1CCCN1c1nccc(C#N)c1Cl	ZINC000561261414	327380788	/nfs/dbraw/zinc/38/07/88/327380788.db2.gz	QWISIRTXEJURPA-OAHLLOKOSA-N	0	0	297.789	4.257	20	30		CIEDRN
CCC[C@@]1(C)CCCN(c2nccc(C#N)c2Cl)C1	ZINC000561263833	327380906	/nfs/dbraw/zinc/38/09/06/327380906.db2.gz	FTUPDNFZSVCWBH-HNNXBMFYSA-N	0	0	277.799	4.013	20	30		CIEDRN
N#Cc1cccc(Cl)c1N1CCC=C(c2ccco2)C1	ZINC000561358876	327388554	/nfs/dbraw/zinc/38/85/54/327388554.db2.gz	IJRWOZWVAVAHMK-UHFFFAOYSA-N	0	0	284.746	4.098	20	30		CIEDRN
N#Cc1c(F)cccc1CNc1cccc2c1CCCC2	ZINC000427527383	327390763	/nfs/dbraw/zinc/39/07/63/327390763.db2.gz	IRJIQJFKFUHJCK-UHFFFAOYSA-N	0	0	280.346	4.188	20	30		CIEDRN
C=CCCCN(C)C(=O)NCc1cc2ccccc2s1	ZINC000561392170	327391647	/nfs/dbraw/zinc/39/16/47/327391647.db2.gz	VOSPMUPTQPKVAV-UHFFFAOYSA-N	0	0	288.416	4.009	20	30		CIEDRN
Cc1cc(Oc2cnc3ccccc3n2)c(C)c(C)c1C#N	ZINC000561448352	327395384	/nfs/dbraw/zinc/39/53/84/327395384.db2.gz	QSEFJKLYJFPGGT-UHFFFAOYSA-N	0	0	289.338	4.219	20	30		CIEDRN
C=C[C@@](C)(CCOC)c1nc(CCC2CCCCC2)no1	ZINC000561877753	327427953	/nfs/dbraw/zinc/42/79/53/327427953.db2.gz	KLVJDOXYLVJGHG-KRWDZBQOSA-N	0	0	292.423	4.063	20	30		CIEDRN
C=C(C)CN(CC)C(=O)[C@H](C)Oc1cccc(C(C)C)c1	ZINC000248207426	327472098	/nfs/dbraw/zinc/47/20/98/327472098.db2.gz	BRTFWKMXDLMKGD-HNNXBMFYSA-N	0	0	289.419	4.002	20	30		CIEDRN
Cc1ccc(C#N)c(SCc2cccc(Cl)c2)n1	ZINC000562519151	327488151	/nfs/dbraw/zinc/48/81/51/327488151.db2.gz	GXOUMMPNNNXBDD-UHFFFAOYSA-N	0	0	274.776	4.207	20	30		CIEDRN
COc1cc(C#N)ccc1NCc1ccc(C(C)C)nc1C	ZINC000562561973	327494234	/nfs/dbraw/zinc/49/42/34/327494234.db2.gz	PAEUPLUHMGNDAI-UHFFFAOYSA-N	0	0	295.386	4.006	20	30		CIEDRN
C=CCC1(c2nc(-c3c(C)noc3C)no2)CCCCC1	ZINC000562784780	327515006	/nfs/dbraw/zinc/51/50/06/327515006.db2.gz	HDDQOUGNUODXLV-UHFFFAOYSA-N	0	0	287.363	4.119	20	30		CIEDRN
C=CCCSCc1coc(-c2cccs2)n1	ZINC000151947395	327529676	/nfs/dbraw/zinc/52/96/76/327529676.db2.gz	YUWGGYSNGYLPKF-UHFFFAOYSA-N	0	0	251.376	4.212	20	30		CIEDRN
C/C(=C/c1ccccc1)CN(CCC#N)Cc1ccco1	ZINC000159594515	327545461	/nfs/dbraw/zinc/54/54/61/327545461.db2.gz	VIYSEJIUIARBGM-SSZFMOIBSA-N	0	0	280.371	4.099	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H](Cc2ccc(C)cc2)C1	ZINC000569900076	327554638	/nfs/dbraw/zinc/55/46/38/327554638.db2.gz	OPUSZPPULZYQOF-QUCCMNQESA-N	0	0	299.458	4.378	20	30		CIEDRN
CN(C(=O)[C@@H]1CC[C@H]2CCCC[C@@H]2C1)c1cccc(C#N)c1	ZINC000318138945	327605769	/nfs/dbraw/zinc/60/57/69/327605769.db2.gz	YHLYBKIRHCUDJU-BRWVUGGUSA-N	0	0	296.414	4.128	20	30		CIEDRN
N#Cc1ccc(OCc2ccc(C(F)(F)F)cc2)cc1F	ZINC000113649781	328628745	/nfs/dbraw/zinc/62/87/45/328628745.db2.gz	DPHLVXNXGOBISR-UHFFFAOYSA-N	0	0	295.235	4.295	20	30		CIEDRN
CC1(C)CCC[C@H](c2noc(C3(C#N)CCCC3)n2)C1	ZINC000536008122	328652438	/nfs/dbraw/zinc/65/24/38/328652438.db2.gz	QGWFDPXZGIYRGO-LBPRGKRZSA-N	0	0	273.380	4.089	20	30		CIEDRN
N#Cc1cc(Cl)ccc1N1CC[C@@H](c2ccccc2)C1	ZINC000052859771	328654646	/nfs/dbraw/zinc/65/46/46/328654646.db2.gz	WZKIZQYOGKBNNJ-CQSZACIVSA-N	0	0	282.774	4.206	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@@H](CC)C(C)(C)C)c1ccccc1	ZINC000536189372	328661338	/nfs/dbraw/zinc/66/13/38/328661338.db2.gz	YPRFFOKYXOFQDZ-ZBFHGGJFSA-N	0	0	273.420	4.287	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@H](C)c1cc2ccccc2o1	ZINC000053986197	328674444	/nfs/dbraw/zinc/67/44/44/328674444.db2.gz	MUTWGZRUCQNNMK-CYBMUJFWSA-N	0	0	286.375	4.101	20	30		CIEDRN
N#Cc1ccc(-c2nc(-c3coc4ccccc34)no2)cc1	ZINC000389202040	328675087	/nfs/dbraw/zinc/67/50/87/328675087.db2.gz	QGGYLERMWMDVGA-UHFFFAOYSA-N	0	0	287.278	4.021	20	30		CIEDRN
CC[C@H](CC#N)NCc1cccc(Oc2ccccc2)c1	ZINC000054182215	328690024	/nfs/dbraw/zinc/69/00/24/328690024.db2.gz	OKENUPDUWYNTSL-MRXNPFEDSA-N	0	0	280.371	4.261	20	30		CIEDRN
C[C@@H]1CCN(c2ccc3cc(C#N)ccc3n2)CC12CCC2	ZINC000536765736	328693899	/nfs/dbraw/zinc/69/38/99/328693899.db2.gz	ATOVMNVYZABWLJ-CQSZACIVSA-N	0	0	291.398	4.123	20	30		CIEDRN
Cc1ccnc(N[C@@H](c2ccccc2)C(C)C)c1C#N	ZINC000542280599	328696408	/nfs/dbraw/zinc/69/64/08/328696408.db2.gz	RLIAIQILHYGPNV-MRXNPFEDSA-N	0	0	265.360	4.071	20	30		CIEDRN
Cc1sc(NC(=O)[C@@H]2CC23CCCCC3)c(C#N)c1C	ZINC000532180025	328702692	/nfs/dbraw/zinc/70/26/92/328702692.db2.gz	ZVBOQTPJJJPFBD-ZDUSSCGKSA-N	0	0	288.416	4.146	20	30		CIEDRN
CN(C(=O)c1ccc2sccc2c1)c1ccccc1C#N	ZINC000395333505	328736146	/nfs/dbraw/zinc/73/61/46/328736146.db2.gz	SQEHIAUDEXWYOV-UHFFFAOYSA-N	0	0	292.363	4.050	20	30		CIEDRN
Cc1cn(Cc2coc(-c3cccc(Cl)c3)n2)cc1C#N	ZINC000532343473	328772612	/nfs/dbraw/zinc/77/26/12/328772612.db2.gz	YCTGLBSNOQBMNG-UHFFFAOYSA-N	0	0	297.745	4.025	20	30		CIEDRN
CC(C)(CCC#N)CN1CCc2c1cccc2Cl	ZINC000507706255	332819820	/nfs/dbraw/zinc/81/98/20/332819820.db2.gz	GZFWELRNLOJFSO-UHFFFAOYSA-N	0	0	262.784	4.032	20	30		CIEDRN
COc1ccc(Cl)c(N[C@H](C)c2ccc(C#N)cc2)c1	ZINC000043316444	328786443	/nfs/dbraw/zinc/78/64/43/328786443.db2.gz	OQJZQIILXBDODE-LLVKDONJSA-N	0	0	286.762	4.393	20	30		CIEDRN
Cc1ccc(C#N)c(Oc2ccc(Cl)c(Cl)c2)n1	ZINC000043400547	328789961	/nfs/dbraw/zinc/78/99/61/328789961.db2.gz	YVYVFMMPRKGNHH-UHFFFAOYSA-N	0	0	279.126	4.361	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)CCC(C)(C)O	ZINC000580392507	328801930	/nfs/dbraw/zinc/80/19/30/328801930.db2.gz	BDDNCZRTTJEMLS-UHFFFAOYSA-N	0	0	289.419	4.028	20	30		CIEDRN
CC(C)N(Cc1ccc(C#N)cc1F)c1ccccc1	ZINC000532659185	328803578	/nfs/dbraw/zinc/80/35/78/328803578.db2.gz	RYKRTJHICSMQRE-UHFFFAOYSA-N	0	0	268.335	4.112	20	30		CIEDRN
C=CCN(CC(F)(F)F)C(=O)CC1CCC(C)(C)CC1	ZINC000507722157	332820822	/nfs/dbraw/zinc/82/08/22/332820822.db2.gz	CBTUZQXTGNWIFP-UHFFFAOYSA-N	0	0	291.357	4.170	20	30		CIEDRN
N#Cc1ccc(SCC(=O)C2CCCCC2)c(Cl)c1	ZINC000532845876	328814029	/nfs/dbraw/zinc/81/40/29/328814029.db2.gz	YRJAIPMJTDZNLR-UHFFFAOYSA-N	0	0	293.819	4.453	20	30		CIEDRN
CC(C)CC[C@@H]1CCCN1c1ccc(Cl)c(C#N)n1	ZINC000301682661	328829555	/nfs/dbraw/zinc/82/95/55/328829555.db2.gz	GSYIXINUPOCTLR-LBPRGKRZSA-N	0	0	277.799	4.012	20	30		CIEDRN
C[C@@H]1CCCc2ccccc2[C@@H]1Nc1ccc(C#N)cn1	ZINC000302156983	328830822	/nfs/dbraw/zinc/83/08/22/328830822.db2.gz	FIFFJGWDYANGGZ-FZKQIMNGSA-N	0	0	277.371	4.079	20	30		CIEDRN
CC[C@H](CC#N)Nc1cnc2cc(Cl)c(Cl)cc2n1	ZINC000302180990	328831587	/nfs/dbraw/zinc/83/15/87/328831587.db2.gz	YLWHXZWOFFAZLU-MRVPVSSYSA-N	0	0	295.173	4.041	20	30		CIEDRN
CCCC[C@H](C)N(CCCC)C(=O)c1ccc(C#N)s1	ZINC000563980586	328842840	/nfs/dbraw/zinc/84/28/40/328842840.db2.gz	KROUPWSEUQPPTA-ZDUSSCGKSA-N	0	0	292.448	4.441	20	30		CIEDRN
C=C(C)CCSCC(=O)Nc1ccc(F)cc1Cl	ZINC000507805756	332824975	/nfs/dbraw/zinc/82/49/75/332824975.db2.gz	XHJVHMXTFKFFFQ-UHFFFAOYSA-N	0	0	287.787	4.117	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cccc(-c3cnco3)c2)CC1	ZINC000354785923	328858300	/nfs/dbraw/zinc/85/83/00/328858300.db2.gz	NJHWNIKFTCFMJU-UHFFFAOYSA-N	0	0	282.343	4.027	20	30		CIEDRN
C=CCCC1(C(=O)N[C@@H](CC)c2ccc(F)cc2F)CC1	ZINC000356149413	328860832	/nfs/dbraw/zinc/86/08/32/328860832.db2.gz	UEQNLCHLBHSSKL-HNNXBMFYSA-N	0	0	293.357	4.279	20	30		CIEDRN
C=C(C)CCSCC(=O)c1c(C)[nH]c2ccccc21	ZINC000507818935	332826204	/nfs/dbraw/zinc/82/62/04/332826204.db2.gz	PNSOVHWYIDFJBT-UHFFFAOYSA-N	0	0	273.401	4.358	20	30		CIEDRN
C=CCCC1(C(=O)Nc2nc(C3CCC3)cs2)CC1	ZINC000357124259	328866192	/nfs/dbraw/zinc/86/61/92/328866192.db2.gz	LPIMXLHONWAYCL-UHFFFAOYSA-N	0	0	276.405	4.096	20	30		CIEDRN
C=CCOc1ccc(OCCCCC(F)(F)F)cc1	ZINC000507820771	332826558	/nfs/dbraw/zinc/82/65/58/332826558.db2.gz	IMVYNNIULUINEP-UHFFFAOYSA-N	0	0	274.282	4.363	20	30		CIEDRN
C=C(C)CCSCCC(=O)Nc1ccccc1C	ZINC000507833599	332826857	/nfs/dbraw/zinc/82/68/57/332826857.db2.gz	KKMAJEIATVSPLM-UHFFFAOYSA-N	0	0	263.406	4.023	20	30		CIEDRN
CCOc1cc(C#N)ccc1OCCCSCC(C)C	ZINC000507842519	332827391	/nfs/dbraw/zinc/82/73/91/332827391.db2.gz	SZJUIWUHROELDF-UHFFFAOYSA-N	0	0	293.432	4.115	20	30		CIEDRN
C=CCC1(C(=O)N(C)c2ccc(SC)cc2)CCC1	ZINC000358772079	328894312	/nfs/dbraw/zinc/89/43/12/328894312.db2.gz	YWNYIRVSPDVTAB-UHFFFAOYSA-N	0	0	275.417	4.118	20	30		CIEDRN
N#Cc1ccccc1OCCSCCCc1ccccc1	ZINC000507878124	332828911	/nfs/dbraw/zinc/82/89/11/332828911.db2.gz	FWEIWSOHYCEVKH-UHFFFAOYSA-N	0	0	297.423	4.303	20	30		CIEDRN
C=CCCCC(=O)N(Cc1ccco1)c1ccccc1	ZINC000360139254	328904804	/nfs/dbraw/zinc/90/48/04/328904804.db2.gz	JQNZIXQLGFQBCE-UHFFFAOYSA-N	0	0	269.344	4.169	20	30		CIEDRN
N#CCCCC(=O)Nc1cccc(-c2cccs2)c1	ZINC000360139425	328904809	/nfs/dbraw/zinc/90/48/09/328904809.db2.gz	DBNBUUYCCPFMFE-UHFFFAOYSA-N	0	0	270.357	4.047	20	30		CIEDRN
Cc1cc(F)cc2c1ncc(C#N)c2N1CCC[C@@H](C)CC1	ZINC000360536222	328908641	/nfs/dbraw/zinc/90/86/41/328908641.db2.gz	ULSMZBRUTSUFOJ-GFCCVEGCSA-N	0	0	297.377	4.180	20	30		CIEDRN
COc1ccc([C@H](CCC#N)Nc2ccc(F)cc2)cc1	ZINC000582340525	328964370	/nfs/dbraw/zinc/96/43/70/328964370.db2.gz	UILYAZABTBIRLT-KRWDZBQOSA-N	0	0	284.334	4.291	20	30		CIEDRN
C=C[C@H](CC(=O)N1C[C@@H]2CCCCC[C@H]21)c1ccccc1	ZINC000372587354	328966228	/nfs/dbraw/zinc/96/62/28/328966228.db2.gz	MOCDCKHGHNISNV-BPQIPLTHSA-N	0	0	283.415	4.137	20	30		CIEDRN
CC[C@](C)(NCCC1(C#N)CCCCC1)C(F)(F)F	ZINC000582406563	328981439	/nfs/dbraw/zinc/98/14/39/328981439.db2.gz	XKSPSCHAIIFFGX-LBPRGKRZSA-N	0	0	276.346	4.171	20	30		CIEDRN
C=CCC1(C(=O)N[C@H](C)[C@H](C)c2ccccc2)CCC1	ZINC000188707985	329006140	/nfs/dbraw/zinc/00/61/40/329006140.db2.gz	YHUBDVPYPOFCOZ-LSDHHAIUSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)c(F)c1)CC(F)(F)F	ZINC000511956342	332948635	/nfs/dbraw/zinc/94/86/35/332948635.db2.gz	JFAFWFHSSHQNMM-UHFFFAOYSA-N	0	0	281.680	4.029	20	30		CIEDRN
N#CC[C@@H]1C[C@H]2[C@H](CCC[C@H]2Nc2ccsc2Cl)O1	ZINC000377393932	329013905	/nfs/dbraw/zinc/01/39/05/329013905.db2.gz	VDMBJJDBRHBBIF-UZWSLXQKSA-N	0	0	296.823	4.053	20	30		CIEDRN
CC(C)c1ccc([C@H]2CCCN2C(=O)CC(C)(C)C#N)cc1	ZINC000377572146	329019376	/nfs/dbraw/zinc/01/93/76/329019376.db2.gz	GVDIPYHEHYOPHW-QGZVFWFLSA-N	0	0	298.430	4.413	20	30		CIEDRN
CCCC[C@@H](CC)CC(=O)NCC1CCC(C#N)CC1	ZINC000508363100	332837571	/nfs/dbraw/zinc/83/75/71/332837571.db2.gz	QDXHZUDKCSSQCF-QQFBHYJXSA-N	0	0	278.440	4.039	20	30		CIEDRN
CCc1nc2cc(N[C@H](C)c3cccc(C#N)c3)ccc2o1	ZINC000193928574	329063709	/nfs/dbraw/zinc/06/37/09/329063709.db2.gz	ZJNKETFOPJOMRF-GFCCVEGCSA-N	0	0	291.354	4.435	20	30		CIEDRN
CCN(CCC#N)C(=O)c1cc(C)c(-c2ccccc2)s1	ZINC000582495869	329100838	/nfs/dbraw/zinc/10/08/38/329100838.db2.gz	TYHMENVUTRRHLW-UHFFFAOYSA-N	0	0	298.411	4.099	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N1CC[C@@H]1c1ccc(Cl)cc1	ZINC000582684081	329128147	/nfs/dbraw/zinc/12/81/47/329128147.db2.gz	SOEWNHPLUKBXEC-HUUCEWRRSA-N	0	0	292.810	4.151	20	30		CIEDRN
N#Cc1cc(Oc2ccc(NCC3CCCC3)cc2)ccn1	ZINC000582695439	329128819	/nfs/dbraw/zinc/12/88/19/329128819.db2.gz	PTRDMMZFFRQHNE-UHFFFAOYSA-N	0	0	293.370	4.348	20	30		CIEDRN
C=C(C)CCc1noc(C(C)(C)c2cccc(F)c2)n1	ZINC000508594190	332842764	/nfs/dbraw/zinc/84/27/64/332842764.db2.gz	ILJOJUPTBUBYDE-UHFFFAOYSA-N	0	0	274.339	4.043	20	30		CIEDRN
C[C@@H](Oc1ccc(C#N)cc1)c1nc(CCC(C)(C)C)no1	ZINC000508601145	332843551	/nfs/dbraw/zinc/84/35/51/332843551.db2.gz	TYXNONRWTQMLDT-GFCCVEGCSA-N	0	0	299.374	4.060	20	30		CIEDRN
C=C(C)CSCC(=O)Nc1cc(Cl)ccc1Cl	ZINC000177868970	329187255	/nfs/dbraw/zinc/18/72/55/329187255.db2.gz	KAIPMXZSAZETTQ-UHFFFAOYSA-N	0	0	290.215	4.241	20	30		CIEDRN
C[C@H](CC#N)Nc1nc2cc(C(F)(F)F)ccc2s1	ZINC000174715650	329161004	/nfs/dbraw/zinc/16/10/04/329161004.db2.gz	NYKDWUBWGOZTEU-SSDOTTSWSA-N	0	0	285.294	4.029	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@@H]1c1cccc(C)c1	ZINC000175391043	329164715	/nfs/dbraw/zinc/16/47/15/329164715.db2.gz	WBPSCDYPMLQFMJ-MRXNPFEDSA-N	0	0	257.377	4.015	20	30		CIEDRN
C=C(C)CCc1noc(Cc2c[nH]c3c2cccc3CC)n1	ZINC000508615499	332844376	/nfs/dbraw/zinc/84/43/76/332844376.db2.gz	OERYKMBJKFVEJG-UHFFFAOYSA-N	0	0	295.386	4.213	20	30		CIEDRN
C=CCCCC(=O)N(Cc1ccccn1)c1ccc(F)cc1	ZINC000175656394	329167683	/nfs/dbraw/zinc/16/76/83/329167683.db2.gz	GVZCLDNGSXVFGK-UHFFFAOYSA-N	0	0	298.361	4.110	20	30		CIEDRN
N#Cc1ccc(COc2ccc(F)cc2Cl)c(F)c1	ZINC000037855663	329170095	/nfs/dbraw/zinc/17/00/95/329170095.db2.gz	ZZOXOSFWCWAQOQ-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
C=C(C)CCc1noc([C@@H](C)Oc2ccccc2Cl)n1	ZINC000508633450	332845250	/nfs/dbraw/zinc/84/52/50/332845250.db2.gz	SBILPTRCVITYIA-LLVKDONJSA-N	0	0	292.766	4.372	20	30		CIEDRN
C=CCCCC(=O)N(Cc1ccco1)Cc1ccccc1	ZINC000177517661	329184988	/nfs/dbraw/zinc/18/49/88/329184988.db2.gz	AHHHMLYDHVQYMI-UHFFFAOYSA-N	0	0	283.371	4.165	20	30		CIEDRN
C=CCCCC(=O)Nc1cnccc1-c1cccc(F)c1	ZINC000177525818	329185207	/nfs/dbraw/zinc/18/52/07/329185207.db2.gz	UFQGTKARPRAYTA-UHFFFAOYSA-N	0	0	284.334	4.183	20	30		CIEDRN
C=C(C)CSCC(=O)Nc1cccc(Cl)c1Cl	ZINC000177871853	329187278	/nfs/dbraw/zinc/18/72/78/329187278.db2.gz	SAVPRCLZHBUJAQ-UHFFFAOYSA-N	0	0	290.215	4.241	20	30		CIEDRN
C=C(C)CCc1noc(-c2cccc(C(F)(F)F)c2)n1	ZINC000508659119	332846393	/nfs/dbraw/zinc/84/63/93/332846393.db2.gz	CUUOZHDHZDOKFG-UHFFFAOYSA-N	0	0	282.265	4.264	20	30		CIEDRN
C=C(C)CCc1noc(-c2cc(C)nc3ccccc32)n1	ZINC000508646501	332845957	/nfs/dbraw/zinc/84/59/57/332845957.db2.gz	SRQSHVSSIVPVGE-UHFFFAOYSA-N	0	0	279.343	4.102	20	30		CIEDRN
C=C(C)CCc1noc(COc2ccc3ccccc3c2)n1	ZINC000508660968	332846423	/nfs/dbraw/zinc/84/64/23/332846423.db2.gz	IOJVHQSCZDVGEN-UHFFFAOYSA-N	0	0	294.354	4.311	20	30		CIEDRN
CC[C@@H](C)CCC(=O)N(Cc1ccc(C#N)cc1)C(C)C	ZINC000508581252	332842232	/nfs/dbraw/zinc/84/22/32/332842232.db2.gz	ICCFOUMPAVYKCL-OAHLLOKOSA-N	0	0	286.419	4.122	20	30		CIEDRN
C=C(C)CCc1noc(CCSc2ccc(F)cc2)n1	ZINC000508664587	332846615	/nfs/dbraw/zinc/84/66/15/332846615.db2.gz	SQRPLIKJCXWEBA-UHFFFAOYSA-N	0	0	292.379	4.052	20	30		CIEDRN
C=CCCCCC[N@H+]1C[C@@H](C2CCCCC2)C[C@@H]1C(=O)[O-]	ZINC000582796806	329208820	/nfs/dbraw/zinc/20/88/20/329208820.db2.gz	AOPNWOXNXYXQRF-DLBZAZTESA-N	0	0	293.451	4.088	20	30		CIEDRN
C=C(C)CCc1noc(-c2ccc(F)cc2Cl)n1	ZINC000508669562	332846895	/nfs/dbraw/zinc/84/68/95/332846895.db2.gz	CNBNFLPGBBFZTH-UHFFFAOYSA-N	0	0	266.703	4.038	20	30		CIEDRN
C=C(C)CCc1noc(-c2cc(C)nn2C(CC)CC)n1	ZINC000508676294	332847104	/nfs/dbraw/zinc/84/71/04/332847104.db2.gz	CNBNURFHMLTWGO-UHFFFAOYSA-N	0	0	288.395	4.111	20	30		CIEDRN
C=C(C)CCc1noc([C@H](C)c2ccc(Cl)s2)n1	ZINC000508674552	332847117	/nfs/dbraw/zinc/84/71/17/332847117.db2.gz	ZMOHBQASSFMBLX-SECBINFHSA-N	0	0	282.796	4.445	20	30		CIEDRN
C=C(C)CCc1noc([C@H]2C[C@@H]2c2cc(F)ccc2F)n1	ZINC000508685512	332847280	/nfs/dbraw/zinc/84/72/80/332847280.db2.gz	HCJGXONOVCRSKY-YPMHNXCESA-N	0	0	290.313	4.128	20	30		CIEDRN
C=C(C)CCc1noc(C[C@H](C)c2cccc(F)c2)n1	ZINC000508685404	332847418	/nfs/dbraw/zinc/84/74/18/332847418.db2.gz	GEULERBSJAGDGA-LBPRGKRZSA-N	0	0	274.339	4.064	20	30		CIEDRN
CCOc1ccc(C#N)cc1NCc1cccc2[nH]ccc21	ZINC000181419728	329236561	/nfs/dbraw/zinc/23/65/61/329236561.db2.gz	MYHYXUSHNHBWQB-UHFFFAOYSA-N	0	0	291.354	4.050	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CC=C(c2ccc(F)cc2)CC1	ZINC000185074916	329267844	/nfs/dbraw/zinc/26/78/44/329267844.db2.gz	FXYLDQVLNHZJLZ-CQSZACIVSA-N	0	0	287.378	4.044	20	30		CIEDRN
CC#CCCCC(=O)N1CCC[C@H]1c1cccc(Cl)c1	ZINC000185213613	329268935	/nfs/dbraw/zinc/26/89/35/329268935.db2.gz	MJMQEUKWOFTYRA-INIZCTEOSA-N	0	0	289.806	4.197	20	30		CIEDRN
Cc1oc2ccccc2c1C(=O)Nc1cc(C#N)ccc1C	ZINC000185332698	329270685	/nfs/dbraw/zinc/27/06/85/329270685.db2.gz	OIOQMTKFGQMOQG-UHFFFAOYSA-N	0	0	290.322	4.174	20	30		CIEDRN
CCc1ccc([C@H](NCc2nc(C#N)cs2)C(C)C)cc1	ZINC000395165570	329277998	/nfs/dbraw/zinc/27/79/98/329277998.db2.gz	ORTVEMWVOMSGOY-QGZVFWFLSA-N	0	0	299.443	4.064	20	30		CIEDRN
CC(C)c1c(N[C@@H]2CC[C@@H](C#N)C2)cnn1-c1ccccc1	ZINC000582884041	329285271	/nfs/dbraw/zinc/28/52/71/329285271.db2.gz	YMCFSNDZZWXPLY-HUUCEWRRSA-N	0	0	294.402	4.100	20	30		CIEDRN
CCc1nocc1CSCCCCC(C)(C)C#N	ZINC000582915629	329288380	/nfs/dbraw/zinc/28/83/80/329288380.db2.gz	HZGQQEMYNOEQCU-UHFFFAOYSA-N	0	0	266.410	4.190	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cnccc1-c1cccc(F)c1	ZINC000185810096	329329566	/nfs/dbraw/zinc/32/95/66/329329566.db2.gz	DURBJCNRGLLVNX-ZDUSSCGKSA-N	0	0	298.361	4.429	20	30		CIEDRN
CCCCCCCC(=O)N1CCC[C@@H]1c1cccnc1	ZINC000085814585	329378586	/nfs/dbraw/zinc/37/85/86/329378586.db2.gz	KEQBTQJDZSZAMQ-MRXNPFEDSA-N	0	0	274.408	4.106	20	30		CIEDRN
C=CCC1(C(=O)Nc2cccc(-c3nc(C)co3)c2)CCC1	ZINC000189322463	329379851	/nfs/dbraw/zinc/37/98/51/329379851.db2.gz	NBXIMTFJWGJJPJ-UHFFFAOYSA-N	0	0	296.370	4.335	20	30		CIEDRN
C=CCN(Cc1ccc2nc(C)ccc2c1)CC(F)(F)F	ZINC000189792169	329385747	/nfs/dbraw/zinc/38/57/47/329385747.db2.gz	SODPOEWICRZAMK-UHFFFAOYSA-N	0	0	294.320	4.094	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)no1	ZINC000189875090	329389671	/nfs/dbraw/zinc/38/96/71/329389671.db2.gz	OVARGQFUHPXGBH-UHFFFAOYSA-N	0	0	284.359	4.087	20	30		CIEDRN
Cc1c(C#N)cccc1C(=O)Nc1ccccc1C(C)C	ZINC000509035435	332856960	/nfs/dbraw/zinc/85/69/60/332856960.db2.gz	SNGKDFSUCKVBRI-UHFFFAOYSA-N	0	0	278.355	4.242	20	30		CIEDRN
N#CCCCS[C@H]1CCc2c1cccc2Cl	ZINC000190985429	329404438	/nfs/dbraw/zinc/40/44/38/329404438.db2.gz	TWICTUOEKSLDKG-ZDUSSCGKSA-N	0	0	251.782	4.364	20	30		CIEDRN
COc1ccc(Cl)c(CSCCCCC#N)c1	ZINC000191052107	329406151	/nfs/dbraw/zinc/40/61/51/329406151.db2.gz	WDYRBMBTCAJWOB-UHFFFAOYSA-N	0	0	269.797	4.276	20	30		CIEDRN
C=CCCCS[C@@H](C)C(=O)NCCC1=CCCCC1	ZINC000583267740	329413942	/nfs/dbraw/zinc/41/39/42/329413942.db2.gz	DJLBFCBPUGJWHD-AWEZNQCLSA-N	0	0	281.465	4.081	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1c(F)cccc1SCC	ZINC000583292834	329437172	/nfs/dbraw/zinc/43/71/72/329437172.db2.gz	FZROASIYADNOMF-JTQLQIEISA-N	0	0	282.384	4.024	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1c(F)cccc1SCC	ZINC000583292835	329437399	/nfs/dbraw/zinc/43/73/99/329437399.db2.gz	FZROASIYADNOMF-SNVBAGLBSA-N	0	0	282.384	4.024	20	30		CIEDRN
CC(C)c1ccccc1NCc1ccc(CC#N)cc1	ZINC000398999508	329447456	/nfs/dbraw/zinc/44/74/56/329447456.db2.gz	BWLJHRCURNREEE-UHFFFAOYSA-N	0	0	264.372	4.488	20	30		CIEDRN
N#CCc1ccc(CSc2ccc(F)c(F)c2)cc1	ZINC000399116668	329448620	/nfs/dbraw/zinc/44/86/20/329448620.db2.gz	GEHLVXCETBGPJH-UHFFFAOYSA-N	0	0	275.323	4.323	20	30		CIEDRN
C=CCN(C(=O)c1coc(C2CCCC2)n1)c1ccccc1	ZINC000509146392	332860108	/nfs/dbraw/zinc/86/01/08/332860108.db2.gz	JELYWECMHNVOCM-UHFFFAOYSA-N	0	0	296.370	4.165	20	30		CIEDRN
CCCCC[C@@H]1CCCN1C(=O)c1cccc(C#N)c1C	ZINC000509162632	332860543	/nfs/dbraw/zinc/86/05/43/332860543.db2.gz	LZDJZPZFUVYVJS-MRXNPFEDSA-N	0	0	284.403	4.052	20	30		CIEDRN
CC#CCN(C)C(=O)c1cc(-c2ccccc2)ccc1Cl	ZINC000583775057	329476727	/nfs/dbraw/zinc/47/67/27/329476727.db2.gz	URJOFAZIUFMSAV-UHFFFAOYSA-N	0	0	297.785	4.102	20	30		CIEDRN
C=CCCCCSCc1nnc(-c2ccccc2)n1C	ZINC000584520006	329510014	/nfs/dbraw/zinc/51/00/14/329510014.db2.gz	KFJTXGJPCAKQQV-UHFFFAOYSA-N	0	0	287.432	4.072	20	30		CIEDRN
C[C@@H](CCC(=O)N(C1CC1)C1(C#N)CCC1)c1ccccc1	ZINC000584520670	329510154	/nfs/dbraw/zinc/51/01/54/329510154.db2.gz	SGPHMVPASIMROT-HNNXBMFYSA-N	0	0	296.414	4.008	20	30		CIEDRN
N#Cc1ccc(CNc2cc(Cl)cc3cccnc32)cc1	ZINC000036918484	329522044	/nfs/dbraw/zinc/52/20/44/329522044.db2.gz	PMGWMXPAINVQAS-UHFFFAOYSA-N	0	0	293.757	4.372	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N1CCCC2(CCCC2)C1	ZINC000527093778	329543871	/nfs/dbraw/zinc/54/38/71/329543871.db2.gz	WDUBTJLYDVXHMM-UHFFFAOYSA-N	0	0	297.402	4.055	20	30		CIEDRN
CSc1ccc(Cl)cc1NCc1ccc(C#N)o1	ZINC000123826437	329563362	/nfs/dbraw/zinc/56/33/62/329563362.db2.gz	GRRBSPAENZIKKJ-UHFFFAOYSA-N	0	0	278.764	4.139	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1cccc(F)c1Cl	ZINC000425626978	329565412	/nfs/dbraw/zinc/56/54/12/329565412.db2.gz	UPHIIRCDKXXDBK-UHFFFAOYSA-N	0	0	255.720	4.020	20	30		CIEDRN
C[C@@H](c1cccc(C#N)c1)N(C)C(=O)C(C)(C)C(C)(C)C	ZINC000425639509	329591036	/nfs/dbraw/zinc/59/10/36/329591036.db2.gz	PGESVGBXERNBGH-ZDUSSCGKSA-N	0	0	286.419	4.150	20	30		CIEDRN
C[C@H](c1cccc(C#N)c1)N(C)C(=O)C(C)(C)C(C)(C)C	ZINC000425639507	329591048	/nfs/dbraw/zinc/59/10/48/329591048.db2.gz	PGESVGBXERNBGH-CYBMUJFWSA-N	0	0	286.419	4.150	20	30		CIEDRN
CC[C@H](CC(C)C)C(=O)N(C)[C@@H](C)c1cccc(C#N)c1	ZINC000425106958	329595015	/nfs/dbraw/zinc/59/50/15/329595015.db2.gz	INXWSQXPSWQKIY-GOEBONIOSA-N	0	0	286.419	4.150	20	30		CIEDRN
C[C@@H](c1cccc(C#N)c1)N(C)C(=O)C[C@H]1CCC[C@@H](C)C1	ZINC000425132348	329604163	/nfs/dbraw/zinc/60/41/63/329604163.db2.gz	QYPJUMNTTWQXLY-PMPSAXMXSA-N	0	0	298.430	4.294	20	30		CIEDRN
Cc1ccc(C(=O)N(C)[C@H](C)c2cccc(C#N)c2)c(C)c1	ZINC000425135292	329604918	/nfs/dbraw/zinc/60/49/18/329604918.db2.gz	VLIWMQRPNPKJQL-OAHLLOKOSA-N	0	0	292.382	4.008	20	30		CIEDRN
C[C@@H](c1cccc(C#N)c1)N(C)C(=O)CCCC(C)(C)C	ZINC000425134900	329604923	/nfs/dbraw/zinc/60/49/23/329604923.db2.gz	VIWSMOKEMQCFDD-AWEZNQCLSA-N	0	0	286.419	4.294	20	30		CIEDRN
CSCc1ccc(NCc2cc(C#N)cs2)cc1	ZINC000129035734	329613894	/nfs/dbraw/zinc/61/38/94/329613894.db2.gz	QEAVDKMALVXAKU-UHFFFAOYSA-N	0	0	274.414	4.095	20	30		CIEDRN
COc1ccc(CNc2ccc(CSC)cc2)cc1C#N	ZINC000129025695	329614107	/nfs/dbraw/zinc/61/41/07/329614107.db2.gz	XMCNPCVCXUXTSV-UHFFFAOYSA-N	0	0	298.411	4.042	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cccc(-c2nc(C)co2)c1	ZINC000188735680	329614721	/nfs/dbraw/zinc/61/47/21/329614721.db2.gz	JYUBIMNQKYUTIJ-QGZVFWFLSA-N	0	0	284.359	4.191	20	30		CIEDRN
Cc1ccc(-c2ncc(CNc3ccc(C#N)cc3)s2)o1	ZINC000132851843	329649274	/nfs/dbraw/zinc/64/92/74/329649274.db2.gz	PNNKUNGIFIDCSS-UHFFFAOYSA-N	0	0	295.367	4.195	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1ccccc1C(F)F	ZINC000425705347	329654905	/nfs/dbraw/zinc/65/49/05/329654905.db2.gz	SFWFKGVFHDJNMI-SNVBAGLBSA-N	0	0	268.307	4.100	20	30		CIEDRN
Cc1csc(-c2cccc(OCC3(C#N)CCC3)c2)n1	ZINC000418870370	329660329	/nfs/dbraw/zinc/66/03/29/329660329.db2.gz	TZOVHPHSQXODQI-UHFFFAOYSA-N	0	0	284.384	4.191	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@@H](CC(C)(C)C)c1ccccc1	ZINC000498162441	329690884	/nfs/dbraw/zinc/69/08/84/329690884.db2.gz	LLNAOUYIIUMTRI-INIZCTEOSA-N	0	0	288.435	4.381	20	30		CIEDRN
Cc1cccc(CN(C)c2c(C#N)cnc3ccccc32)c1	ZINC000314816495	329700005	/nfs/dbraw/zinc/70/00/05/329700005.db2.gz	PULDYDWEVULFSK-UHFFFAOYSA-N	0	0	287.366	4.051	20	30		CIEDRN
N#Cc1ccc2c(c1)CCC[C@H]2Nc1ncccc1Cl	ZINC000419021955	329703871	/nfs/dbraw/zinc/70/38/71/329703871.db2.gz	ZDKWNSRQNAINCH-OAHLLOKOSA-N	0	0	283.762	4.096	20	30		CIEDRN
CC(C)(C#N)CCCOc1ccc(C#N)c2ccccc12	ZINC000419058544	329706944	/nfs/dbraw/zinc/70/69/44/329706944.db2.gz	WJWOIJQKRUAOBC-UHFFFAOYSA-N	0	0	278.355	4.420	20	30		CIEDRN
COCc1ccccc1OCCC1(C#N)CCCCC1	ZINC000419092144	329707789	/nfs/dbraw/zinc/70/77/89/329707789.db2.gz	VKFXCAVBXAWADF-UHFFFAOYSA-N	0	0	273.376	4.076	20	30		CIEDRN
CCN(C(=O)c1cccc(C#N)c1C)c1cc(C)ccc1C	ZINC000509537998	332872962	/nfs/dbraw/zinc/87/29/62/332872962.db2.gz	CGMHBPTYQIRAOS-UHFFFAOYSA-N	0	0	292.382	4.150	20	30		CIEDRN
CCc1ccc(CSCc2nc(C#N)cs2)cc1	ZINC000419404694	329723925	/nfs/dbraw/zinc/72/39/25/329723925.db2.gz	GMMUVTCATPTMSL-UHFFFAOYSA-N	0	0	274.414	4.011	20	30		CIEDRN
CCCc1nc(CSCCC2(C#N)CCCCC2)no1	ZINC000419405767	329724142	/nfs/dbraw/zinc/72/41/42/329724142.db2.gz	VPKXGHVUUXNADH-UHFFFAOYSA-N	0	0	293.436	4.119	20	30		CIEDRN
CC(C)OCCSCCC1(C#N)CCCCC1	ZINC000419408567	329724286	/nfs/dbraw/zinc/72/42/86/329724286.db2.gz	XWYCPUMNSHYIQX-UHFFFAOYSA-N	0	0	255.427	4.009	20	30		CIEDRN
C[C@H](SCC1(C#N)CCC1)c1ccc(C#N)cc1	ZINC000419411831	329724642	/nfs/dbraw/zinc/72/46/42/329724642.db2.gz	BWXZUJUQMLDSHF-LBPRGKRZSA-N	0	0	256.374	4.046	20	30		CIEDRN
N#CC1(CSCc2cc(F)ccc2Cl)CCC1	ZINC000419469572	329726928	/nfs/dbraw/zinc/72/69/28/329726928.db2.gz	YPTDABOCRSOLHF-UHFFFAOYSA-N	0	0	269.772	4.406	20	30		CIEDRN
C[C@H]1C[C@H](CSCCC2(C#N)CCCCC2)CCO1	ZINC000419499970	329732468	/nfs/dbraw/zinc/73/24/68/329732468.db2.gz	PLYFVMMRGNZELN-LSDHHAIUSA-N	0	0	281.465	4.399	20	30		CIEDRN
N#CC1(CCSCCC2CCOCC2)CCCCC1	ZINC000419472542	329735058	/nfs/dbraw/zinc/73/50/58/329735058.db2.gz	BISFHIPVJAKLJS-UHFFFAOYSA-N	0	0	281.465	4.400	20	30		CIEDRN
COCCCCSCCC1(C#N)CCCCC1	ZINC000419472771	329735242	/nfs/dbraw/zinc/73/52/42/329735242.db2.gz	ISQSKTUMQUBBAS-UHFFFAOYSA-N	0	0	255.427	4.010	20	30		CIEDRN
C[C@@H](SCC1(C#N)CCC1)c1cccc([N+](=O)[O-])c1	ZINC000419591200	329741742	/nfs/dbraw/zinc/74/17/42/329741742.db2.gz	XHUWFFPXZQNMSP-LLVKDONJSA-N	0	0	276.361	4.083	20	30		CIEDRN
N#Cc1ccc(SCCOc2ccccc2Cl)cc1	ZINC000509633428	332875650	/nfs/dbraw/zinc/87/56/50/332875650.db2.gz	JYXQZUOLOUWVSR-UHFFFAOYSA-N	0	0	289.787	4.383	20	30		CIEDRN
C=CCC(C)(C)C(=O)N(CC)Cc1ccccc1Cl	ZINC000431860355	329777668	/nfs/dbraw/zinc/77/76/68/329777668.db2.gz	IPAFXUYKURMWTL-UHFFFAOYSA-N	0	0	279.811	4.291	20	30		CIEDRN
N#CCCN(CCC#N)Cc1ccc(Cl)c2ccccc12	ZINC000420928431	329793243	/nfs/dbraw/zinc/79/32/43/329793243.db2.gz	CYNIYWISSGDXMI-UHFFFAOYSA-N	0	0	297.789	4.123	20	30		CIEDRN
Cc1cc(Cl)cc(C#N)c1OCCCC(C)(C)C#N	ZINC000421202395	329805488	/nfs/dbraw/zinc/80/54/88/329805488.db2.gz	QMROJQRTSBEXOM-UHFFFAOYSA-N	0	0	276.767	4.229	20	30		CIEDRN
Cc1cccc2cc(OCCCC(C)(C)C#N)cnc12	ZINC000421194842	329807173	/nfs/dbraw/zinc/80/71/73/329807173.db2.gz	GZPBNCOYMXFZMK-UHFFFAOYSA-N	0	0	268.360	4.252	20	30		CIEDRN
CC(C)OCc1ccc(NCc2ccc(C#N)c(F)c2)cc1	ZINC000421339766	329813933	/nfs/dbraw/zinc/81/39/33/329813933.db2.gz	SRCYNESDVIZBBV-UHFFFAOYSA-N	0	0	298.361	4.234	20	30		CIEDRN
CC(C)OCc1cccc(NCc2ccc(C#N)c(F)c2)c1	ZINC000421341126	329814021	/nfs/dbraw/zinc/81/40/21/329814021.db2.gz	VKPSKCDZMVNOIP-UHFFFAOYSA-N	0	0	298.361	4.234	20	30		CIEDRN
CCC1(C(=O)Nc2ccc(C#N)c(C#N)c2C)CCCCC1	ZINC000421559959	329846362	/nfs/dbraw/zinc/84/63/62/329846362.db2.gz	PKPPTZCLHYPOQV-UHFFFAOYSA-N	0	0	295.386	4.037	20	30		CIEDRN
C=CCn1c(SCCCC)nnc1-c1cccc(C)c1	ZINC000302697650	332881674	/nfs/dbraw/zinc/88/16/74/332881674.db2.gz	KFSCFSYGOVIIIN-UHFFFAOYSA-N	0	0	287.432	4.332	20	30		CIEDRN
N#Cc1ccccc1NCc1csc(-c2cccs2)n1	ZINC000509886166	332884634	/nfs/dbraw/zinc/88/46/34/332884634.db2.gz	NYJSPHFDBPGIFO-UHFFFAOYSA-N	0	0	297.408	4.355	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H](C)Oc2cccc(C)c2)n1	ZINC000572017830	329937998	/nfs/dbraw/zinc/93/79/98/329937998.db2.gz	QBRKGTJGPSOYNL-ZDUSSCGKSA-N	0	0	286.375	4.372	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CC[C@@H](c2ccc(C)cc2C)C1	ZINC000510004004	332887977	/nfs/dbraw/zinc/88/79/77/332887977.db2.gz	XNBLPCOROIGYKZ-MRXNPFEDSA-N	0	0	285.431	4.222	20	30		CIEDRN
CSCCCSc1cccc(Cl)c1C#N	ZINC000320066630	329945903	/nfs/dbraw/zinc/94/59/03/329945903.db2.gz	CQEDJTLYZSTNCR-UHFFFAOYSA-N	0	0	257.811	4.057	20	30		CIEDRN
COc1nc(C)cc(C)c1CSCc1cccc(C#N)c1	ZINC000572318394	329973587	/nfs/dbraw/zinc/97/35/87/329973587.db2.gz	HXPHHGLOJODULA-UHFFFAOYSA-N	0	0	298.411	4.012	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)c1cccc2cc[nH]c21	ZINC000079428307	330034789	/nfs/dbraw/zinc/03/47/89/330034789.db2.gz	KKJGHJOKDZMJNY-UHFFFAOYSA-N	0	0	296.395	4.058	20	30		CIEDRN
N#Cc1ccc(CNC2(C(F)F)CCCCC2)c(Cl)c1	ZINC000510085605	332891495	/nfs/dbraw/zinc/89/14/95/332891495.db2.gz	LYOBTYGZVHECSW-UHFFFAOYSA-N	0	0	298.764	4.269	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccc2nc(C3CC3)oc2c1	ZINC000079851826	330061556	/nfs/dbraw/zinc/06/15/56/330061556.db2.gz	SEWUKABKBDHHAQ-UHFFFAOYSA-N	0	0	299.374	4.135	20	30		CIEDRN
C=CCCS[C@@H](C)C(=O)Nc1ccc(SC)cc1	ZINC000265766854	330063271	/nfs/dbraw/zinc/06/32/71/330063271.db2.gz	LCJIVRHEQCJOTC-NSHDSACASA-N	0	0	281.446	4.045	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@H]1c1ccccc1C	ZINC000268157707	330065456	/nfs/dbraw/zinc/06/54/56/330065456.db2.gz	GJRRNPSTTXDEOQ-SFHVURJKSA-N	0	0	283.415	4.427	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@@H]1c1ccccc1C	ZINC000268157705	330065536	/nfs/dbraw/zinc/06/55/36/330065536.db2.gz	GJRRNPSTTXDEOQ-GOSISDBHSA-N	0	0	283.415	4.427	20	30		CIEDRN
C=CCCCSCc1nc([C@@H](C)SCC)no1	ZINC000268756833	330066398	/nfs/dbraw/zinc/06/63/98/330066398.db2.gz	XZQOKBZQULSFTO-SNVBAGLBSA-N	0	0	272.439	4.083	20	30		CIEDRN
C=CCCO[C@@H](C)C(=O)N(C(C)C)[C@H](C)c1ccsc1	ZINC000421694582	330067559	/nfs/dbraw/zinc/06/75/59/330067559.db2.gz	VLALOMVLIJKUBZ-KGLIPLIRSA-N	0	0	295.448	4.027	20	30		CIEDRN
C=CCCO[C@@H](C)C(=O)N(C(C)C)[C@@H](C)c1ccsc1	ZINC000421694580	330067575	/nfs/dbraw/zinc/06/75/75/330067575.db2.gz	VLALOMVLIJKUBZ-KBPBESRZSA-N	0	0	295.448	4.027	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](CC(F)F)c1ccccc1	ZINC000421698106	330068498	/nfs/dbraw/zinc/06/84/98/330068498.db2.gz	HXMMZBWRSKHCHH-OCCSQVGLSA-N	0	0	281.346	4.101	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](c2ccccc2)C1(C)C	ZINC000421723590	330074580	/nfs/dbraw/zinc/07/45/80/330074580.db2.gz	WGFBLXKVZOKHDO-NVXWUHKLSA-N	0	0	285.431	4.383	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)c2cc[nH]c2CCC)c1	ZINC000421759870	330076366	/nfs/dbraw/zinc/07/63/66/330076366.db2.gz	DNCLUPCHAURXHI-UHFFFAOYSA-N	0	0	298.386	4.174	20	30		CIEDRN
C=CCN(C(=O)Nc1cccc(SC(F)F)c1)C1CC1	ZINC000271568698	330081220	/nfs/dbraw/zinc/08/12/20/330081220.db2.gz	QOAFORZTARQYIH-UHFFFAOYSA-N	0	0	298.358	4.184	20	30		CIEDRN
C=CCC[C@H](NCc1ncc(C2CC2)o1)c1ccccc1	ZINC000271738251	330081878	/nfs/dbraw/zinc/08/18/78/330081878.db2.gz	OYAPCGBWEKXGIC-INIZCTEOSA-N	0	0	282.387	4.349	20	30		CIEDRN
C#CC[C@H](NCc1nc(C(C)(C)C)cs1)c1ccccc1	ZINC000271708800	330081964	/nfs/dbraw/zinc/08/19/64/330081964.db2.gz	NYZWIPGHNBEWGQ-HNNXBMFYSA-N	0	0	298.455	4.295	20	30		CIEDRN
C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccncc1Cl	ZINC000421833837	330091437	/nfs/dbraw/zinc/09/14/37/330091437.db2.gz	JNYCRNSOJHGWPB-DYVFJYSZSA-N	0	0	299.805	4.431	20	30		CIEDRN
C=CCCO[C@H](C)c1nc([C@H]2CCCC[C@@H]2C)no1	ZINC000273799047	330097610	/nfs/dbraw/zinc/09/76/10/330097610.db2.gz	HOHWHSNZHAQLGQ-XQQFMLRXSA-N	0	0	264.369	4.017	20	30		CIEDRN
CC[C@H](CC1CCCCC1)C(=O)NCC#Cc1ccccc1	ZINC000510137616	332894316	/nfs/dbraw/zinc/89/43/16/332894316.db2.gz	WRFMUPJYRDLBOG-LJQANCHMSA-N	0	0	297.442	4.151	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H]1c1ccc(F)cc1	ZINC000274264611	330104142	/nfs/dbraw/zinc/10/41/42/330104142.db2.gz	DQSZDKKRGRDKBC-BBRMVZONSA-N	0	0	275.367	4.092	20	30		CIEDRN
CC#CCCCC(=O)Nc1cc(C(F)F)ccc1Cl	ZINC000274330918	330105267	/nfs/dbraw/zinc/10/52/67/330105267.db2.gz	JBNQFRYKXQCWRH-UHFFFAOYSA-N	0	0	285.721	4.410	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1ccc(SC)c(Cl)c1	ZINC000276094010	330111784	/nfs/dbraw/zinc/11/17/84/330111784.db2.gz	NANVTFQHGRMFMN-UHFFFAOYSA-N	0	0	284.812	4.102	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1cccc(Cl)c1OC(C)C	ZINC000276011693	330111900	/nfs/dbraw/zinc/11/19/00/330111900.db2.gz	AUTDNASBRQRAIH-UHFFFAOYSA-N	0	0	296.798	4.167	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1ccccc1C(C)(C)C	ZINC000276342064	330113051	/nfs/dbraw/zinc/11/30/51/330113051.db2.gz	SFGCBDHUPVIDOF-UHFFFAOYSA-N	0	0	260.381	4.024	20	30		CIEDRN
C#CCCCC(=O)N(C)[C@H](C)c1ccc(Cl)c(Cl)c1	ZINC000277004247	330115118	/nfs/dbraw/zinc/11/51/18/330115118.db2.gz	KISWJFUKLDIKCB-LLVKDONJSA-N	0	0	298.213	4.316	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Oc1ccc(-c2c(C)noc2C)cc1	ZINC000277252992	330115546	/nfs/dbraw/zinc/11/55/46/330115546.db2.gz	QJWBAHOXNLIUFM-SFHVURJKSA-N	0	0	299.370	4.466	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC)c1ccc2[nH]ccc2c1	ZINC000276731817	330117021	/nfs/dbraw/zinc/11/70/21/330117021.db2.gz	XVXKQXCGGOOJHD-CYBMUJFWSA-N	0	0	270.376	4.123	20	30		CIEDRN
C=CCCO[C@@H](C)c1nc(-c2coc3ccccc23)no1	ZINC000277837684	330118197	/nfs/dbraw/zinc/11/81/97/330118197.db2.gz	FODVZKGJOOJQDR-NSHDSACASA-N	0	0	284.315	4.137	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)CC(C)(C)OC	ZINC000278759626	330119650	/nfs/dbraw/zinc/11/96/50/330119650.db2.gz	KBZCHYRRCWKQCK-UHFFFAOYSA-N	0	0	289.419	4.292	20	30		CIEDRN
CC(C)CSc1nc(-c2ccccc2)ccc1C#N	ZINC000510206166	332896299	/nfs/dbraw/zinc/89/62/99/332896299.db2.gz	ARJHHRXTGPFOSX-UHFFFAOYSA-N	0	0	268.385	4.368	20	30		CIEDRN
CC(C)(C)c1ccc(C(=O)Nc2ccc(F)c(C#N)c2)cc1	ZINC000302999859	332898410	/nfs/dbraw/zinc/89/84/10/332898410.db2.gz	HOCBSIWFFWOSRI-UHFFFAOYSA-N	0	0	296.345	4.247	20	30		CIEDRN
C[C@@H](CNc1ccc(C#N)c(Cl)c1)CC(F)(F)F	ZINC000396884282	330228270	/nfs/dbraw/zinc/22/82/70/330228270.db2.gz	KLDYVGZTPDKICN-MRVPVSSYSA-N	0	0	276.689	4.212	20	30		CIEDRN
C=CCN[C@@H](c1cccc2ccccc21)C(F)(F)F	ZINC000510395402	332902084	/nfs/dbraw/zinc/90/20/84/332902084.db2.gz	JESBTYSWUBHMQN-AWEZNQCLSA-N	0	0	265.278	4.219	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(-c2ccccc2Cl)no1	ZINC000527196685	330234846	/nfs/dbraw/zinc/23/48/46/330234846.db2.gz	XRBUQCDEUXPBLJ-CQSZACIVSA-N	0	0	262.740	4.244	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)NCc1c(Cl)cccc1Cl	ZINC000527198250	330235662	/nfs/dbraw/zinc/23/56/62/330235662.db2.gz	PQFQRDDBCLVXIJ-AWEZNQCLSA-N	0	0	286.202	4.212	20	30		CIEDRN
N#Cc1ccccc1CSc1cc(F)ccc1F	ZINC000035121671	330242332	/nfs/dbraw/zinc/24/23/32/330242332.db2.gz	NPAXZZUULZHJSQ-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
N#Cc1ccccc1OCCSc1cc(F)ccc1F	ZINC000035676289	330249143	/nfs/dbraw/zinc/24/91/43/330249143.db2.gz	BEJDXCLILLDARB-UHFFFAOYSA-N	0	0	291.322	4.008	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(Cc2ccccc2Cl)no1	ZINC000527487521	330250351	/nfs/dbraw/zinc/25/03/51/330250351.db2.gz	MHYYFLWSPWFBKJ-HNNXBMFYSA-N	0	0	276.767	4.168	20	30		CIEDRN
C[C@H]1CC(F)(F)CC[N@@H+]1Cc1ccccc1C(C)(C)C#N	ZINC000528764376	330257837	/nfs/dbraw/zinc/25/78/37/330257837.db2.gz	FESMRFWYGBYFHW-ZDUSSCGKSA-N	0	0	292.373	4.107	20	30		CIEDRN
C=CCOc1cccc(NC(=O)NC2CCCCCC2)c1	ZINC000510352837	332900843	/nfs/dbraw/zinc/90/08/43/332900843.db2.gz	FUGORMSUSDPTBP-UHFFFAOYSA-N	0	0	288.391	4.096	20	30		CIEDRN
CCN(C(=O)CC1(C)CCCCC1)c1ccc(C#N)cc1	ZINC000510353813	332900909	/nfs/dbraw/zinc/90/09/09/332900909.db2.gz	HHUYYXSYKUIJTF-UHFFFAOYSA-N	0	0	284.403	4.272	20	30		CIEDRN
CCCCCNc1ccc(C#N)c(C(F)(F)F)c1	ZINC000036805561	330275576	/nfs/dbraw/zinc/27/55/76/330275576.db2.gz	XZMMBGXMWYGWOK-UHFFFAOYSA-N	0	0	256.271	4.179	20	30		CIEDRN
CCN(C(=O)C[C@@H]1CCC[C@@H](C)C1)c1ccc(C#N)cc1	ZINC000510380255	332901590	/nfs/dbraw/zinc/90/15/90/332901590.db2.gz	RBZIUJUEQYRNDR-GDBMZVCRSA-N	0	0	284.403	4.128	20	30		CIEDRN
N#C[C@H]1CCC[C@@H](Nc2cccc(C3CCOCC3)c2)C1	ZINC000527994205	330299327	/nfs/dbraw/zinc/29/93/27/330299327.db2.gz	HRVPPHDTFPZIST-WMLDXEAASA-N	0	0	284.403	4.075	20	30		CIEDRN
CCC(C#N)(CC)c1nc(Cc2ccc(C(C)C)cc2)no1	ZINC000528095076	330307756	/nfs/dbraw/zinc/30/77/56/330307756.db2.gz	OPBCKPXTLPQBHH-UHFFFAOYSA-N	0	0	297.402	4.365	20	30		CIEDRN
CCC(C#N)(CC)c1nc(-c2ccc(OC(C)C)cc2)no1	ZINC000528107482	330308189	/nfs/dbraw/zinc/30/81/89/330308189.db2.gz	SODBDVQDTKVPNI-UHFFFAOYSA-N	0	0	299.374	4.105	20	30		CIEDRN
CCC(C#N)(CC)c1nc([C@@H](C)c2ccccc2C)no1	ZINC000528145211	330309643	/nfs/dbraw/zinc/30/96/43/330309643.db2.gz	ABKZWYFTDKRROQ-ZDUSSCGKSA-N	0	0	283.375	4.111	20	30		CIEDRN
N#Cc1ccc(Sc2nc3ccccc3s2)c(F)c1	ZINC000036886943	330311950	/nfs/dbraw/zinc/31/19/50/330311950.db2.gz	FSQJCHBKPARKGK-UHFFFAOYSA-N	0	0	286.356	4.458	20	30		CIEDRN
CCC(C#N)(CC)c1nc(-c2occc2C(C)C)no1	ZINC000528199586	330312700	/nfs/dbraw/zinc/31/27/00/330312700.db2.gz	DSOQWIIZFHUSQO-UHFFFAOYSA-N	0	0	273.336	4.034	20	30		CIEDRN
C=CCC1(c2nc([C@H]3CC[C@@H](C)O3)no2)CCCCC1	ZINC000528237186	330316903	/nfs/dbraw/zinc/31/69/03/330316903.db2.gz	MAUKRUXEHITELJ-CHWSQXEVSA-N	0	0	276.380	4.088	20	30		CIEDRN
C=CCCC1(c2nc(C(C)(C)c3cc(C)ccn3)no2)CC1	ZINC000528263030	330317945	/nfs/dbraw/zinc/31/79/45/330317945.db2.gz	MFMMSKUGFSKUDC-UHFFFAOYSA-N	0	0	297.402	4.097	20	30		CIEDRN
C=CC[C@H](C)NC(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1	ZINC000116851493	330321605	/nfs/dbraw/zinc/32/16/05/330321605.db2.gz	AVBKUGDVPZORHX-VHSSKADRSA-N	0	0	279.383	4.024	20	30		CIEDRN
C=CCCC[N@@H+](C)Cc1c(C)cc(C)c(C(C)=O)c1C	ZINC000532978895	330323737	/nfs/dbraw/zinc/32/37/37/330323737.db2.gz	OEJFSEDDHPMDGB-UHFFFAOYSA-N	0	0	273.420	4.212	20	30		CIEDRN
Clc1ccccc1C#CCSCc1ccco1	ZINC000533010161	330323997	/nfs/dbraw/zinc/32/39/97/330323997.db2.gz	VPKCEJIDQVWCLJ-UHFFFAOYSA-N	0	0	262.761	4.218	20	30		CIEDRN
C=CC[C@H](C)NC(=O)C[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000116862285	330325211	/nfs/dbraw/zinc/32/52/11/330325211.db2.gz	UJDFHZBSBQMPFZ-NEPJUHHUSA-N	0	0	299.336	4.280	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)C[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000116862291	330325274	/nfs/dbraw/zinc/32/52/74/330325274.db2.gz	UJDFHZBSBQMPFZ-NWDGAFQWSA-N	0	0	299.336	4.280	20	30		CIEDRN
N#Cc1c(Cl)cccc1SCC[C@H]1CCCCO1	ZINC000580484938	330325784	/nfs/dbraw/zinc/32/57/84/330325784.db2.gz	GRIRZWWTHFCBPW-LLVKDONJSA-N	0	0	281.808	4.263	20	30		CIEDRN
C=CCN(C(=O)C[C@@H](C)c1ccccc1)c1ccccc1	ZINC000105446346	330326451	/nfs/dbraw/zinc/32/64/51/330326451.db2.gz	PYNXUWHHGBJAMR-MRXNPFEDSA-N	0	0	279.383	4.399	20	30		CIEDRN
N#Cc1cc2c(nc1NCc1ccc(Cl)cc1)CCCC2	ZINC000044298187	330327328	/nfs/dbraw/zinc/32/73/28/330327328.db2.gz	UAIGJMVREUVABO-UHFFFAOYSA-N	0	0	297.789	4.098	20	30		CIEDRN
CN(CC(C)(C)C)c1ccc(C#N)c(C(F)(F)F)c1	ZINC000045088919	330338371	/nfs/dbraw/zinc/33/83/71/330338371.db2.gz	MIBKUWILPQJZAM-UHFFFAOYSA-N	0	0	270.298	4.059	20	30		CIEDRN
C=CCOc1ccccc1C(=O)Nc1ccccc1SC	ZINC000045169534	330340560	/nfs/dbraw/zinc/34/05/60/330340560.db2.gz	KALLMPOVCSKHPJ-UHFFFAOYSA-N	0	0	299.395	4.226	20	30		CIEDRN
C=C(C)C(C)(C)c1nc(-c2ccccc2COCC)no1	ZINC000424342675	330344298	/nfs/dbraw/zinc/34/42/98/330344298.db2.gz	YYHACQBCQIOWPC-UHFFFAOYSA-N	0	0	286.375	4.127	20	30		CIEDRN
C=C(C)C(C)(C)c1nc(-c2ccc(Cl)cc2OC)no1	ZINC000424355434	330346247	/nfs/dbraw/zinc/34/62/47/330346247.db2.gz	JJDJKQADKZJLPD-UHFFFAOYSA-N	0	0	292.766	4.252	20	30		CIEDRN
C=C[C@@H]1OCCC[C@H]1c1nc([C@H]2CCCC[C@@H]2CC)no1	ZINC000424356423	330346440	/nfs/dbraw/zinc/34/64/40/330346440.db2.gz	BKNKPIQLMNMTST-XQLPTFJDSA-N	0	0	290.407	4.202	20	30		CIEDRN
CCCC[C@@H](Sc1ccc(C#N)cc1Cl)C(=O)OC	ZINC000533177601	330351446	/nfs/dbraw/zinc/35/14/46/330351446.db2.gz	XITUSULROJOQOR-CYBMUJFWSA-N	0	0	297.807	4.036	20	30		CIEDRN
CCC[C@@H](C)C(=O)Nc1ccccc1SC[C@@H](C)C#N	ZINC000108238135	330353370	/nfs/dbraw/zinc/35/33/70/330353370.db2.gz	WINKFUMOMQWAQU-QWHCGFSZSA-N	0	0	290.432	4.313	20	30		CIEDRN
N#Cc1ccc(NC(=O)c2cc3sccc3s2)cc1	ZINC000108498907	330354058	/nfs/dbraw/zinc/35/40/58/330354058.db2.gz	BCSRJNAWPVLUKA-UHFFFAOYSA-N	0	0	284.365	4.087	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1ccc(Cl)cc1Cl	ZINC000116996407	330363081	/nfs/dbraw/zinc/36/30/81/330363081.db2.gz	JMIVOYRAEJSNCF-MRVPVSSYSA-N	0	0	273.163	4.080	20	30		CIEDRN
Cc1ccc(NCc2ccc(C#N)cc2F)c2cccnc12	ZINC000533308843	330356879	/nfs/dbraw/zinc/35/68/79/330356879.db2.gz	BSZFXTLRQVNSEW-UHFFFAOYSA-N	0	0	291.329	4.166	20	30		CIEDRN
C=C(CC)CS[C@H](C)C(=O)Nc1cccc(C)c1	ZINC000536881877	330360770	/nfs/dbraw/zinc/36/07/70/330360770.db2.gz	ONCCOLMUQSOWIR-CYBMUJFWSA-N	0	0	263.406	4.021	20	30		CIEDRN
C=C(CC)CNc1ccc(C(=O)NC2CCCC2)cc1C	ZINC000536881695	330360784	/nfs/dbraw/zinc/36/07/84/330360784.db2.gz	MFQUQZNLNHRFQW-UHFFFAOYSA-N	0	0	286.419	4.046	20	30		CIEDRN
C=C(CC)COc1cccc(NC(=O)c2cccs2)c1	ZINC000536882071	330360977	/nfs/dbraw/zinc/36/09/77/330360977.db2.gz	UJLYKMFTCDEKBU-UHFFFAOYSA-N	0	0	287.384	4.345	20	30		CIEDRN
C=CCn1c(SCC(=C)CC)nnc1-c1cccs1	ZINC000536904736	330363689	/nfs/dbraw/zinc/36/36/89/330363689.db2.gz	KQTNETORCSNABI-UHFFFAOYSA-N	0	0	291.445	4.251	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1ccc(C)cc1Cl	ZINC000424521234	330364270	/nfs/dbraw/zinc/36/42/70/330364270.db2.gz	DMLOPGHFPCVABL-UHFFFAOYSA-N	0	0	251.757	4.189	20	30		CIEDRN
N#Cc1ccccc1Oc1ccc(NC(=O)C2CCC2)cc1	ZINC000055428152	330365360	/nfs/dbraw/zinc/36/53/60/330365360.db2.gz	QKRNYUDMPAUKGO-UHFFFAOYSA-N	0	0	292.338	4.089	20	30		CIEDRN
C=CCCCSc1nnc(C[C@@H](C)c2ccccc2)o1	ZINC000117547949	330365916	/nfs/dbraw/zinc/36/59/16/330365916.db2.gz	AADZWNQSKAZPNP-CYBMUJFWSA-N	0	0	288.416	4.474	20	30		CIEDRN
CC(C)COc1ccccc1NCc1ccc(C#N)s1	ZINC000119037228	330369379	/nfs/dbraw/zinc/36/93/79/330369379.db2.gz	PZTCXCCCPZPBRF-UHFFFAOYSA-N	0	0	286.400	4.267	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@@H](C)c1cc2ccccc2o1	ZINC000424543480	330372627	/nfs/dbraw/zinc/37/26/27/330372627.db2.gz	OLQUZKGYYDSMJQ-LBPRGKRZSA-N	0	0	271.360	4.212	20	30		CIEDRN
CC(C)([NH2+]Cc1cccc(C#N)c1)c1cccc(Cl)c1	ZINC000119371449	330373633	/nfs/dbraw/zinc/37/36/33/330373633.db2.gz	BSGAOEMLVRBHDE-UHFFFAOYSA-N	0	0	284.790	4.237	20	30		CIEDRN
C[C@H](C#N)N[C@H](Cc1ccccc1Cl)c1ccccc1	ZINC000119762988	330379527	/nfs/dbraw/zinc/37/95/27/330379527.db2.gz	UYIYTDPSQWVENQ-CXAGYDPISA-N	0	0	284.790	4.125	20	30		CIEDRN
CCCOc1ccc(Cl)cc1NCc1ccc(C#N)o1	ZINC000119786191	330379863	/nfs/dbraw/zinc/37/98/63/330379863.db2.gz	IBGZLBDAPWLABA-UHFFFAOYSA-N	0	0	290.750	4.206	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N1CC=C(c2ccc(F)cc2)CC1	ZINC000424575018	330384914	/nfs/dbraw/zinc/38/49/14/330384914.db2.gz	ZKYRFNAQDPSPIK-UHFFFAOYSA-N	0	0	287.378	4.044	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)[C@H](C)c1ccccc1	ZINC000120490542	330388768	/nfs/dbraw/zinc/38/87/68/330388768.db2.gz	DJBRSHLSXFQRTG-OAHLLOKOSA-N	0	0	297.373	4.144	20	30		CIEDRN
C=CCN(Cc1cccc(C#N)c1)C(=O)[C@H](CCC)C(C)C	ZINC000120832647	330392761	/nfs/dbraw/zinc/39/27/61/330392761.db2.gz	HTIJIKHQKVZTDI-GOSISDBHSA-N	0	0	298.430	4.145	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc(C)cc1Cl	ZINC000120935993	330393320	/nfs/dbraw/zinc/39/33/20/330393320.db2.gz	RUZPRBVJFPDSFP-UHFFFAOYSA-N	0	0	263.768	4.355	20	30		CIEDRN
CCN(CC#N)Cc1csc(-c2ccc(C(C)C)cc2)n1	ZINC000121015639	330395001	/nfs/dbraw/zinc/39/50/01/330395001.db2.gz	RUAUZGJOSTYKCK-UHFFFAOYSA-N	0	0	299.443	4.279	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)Cc1cccc(Cl)c1	ZINC000121225220	330398027	/nfs/dbraw/zinc/39/80/27/330398027.db2.gz	JBOMQWSVHBJUMG-UHFFFAOYSA-N	0	0	277.795	4.067	20	30		CIEDRN
C=CCN(C)[C@H](C)c1ncc(-c2ccc(Cl)cc2)o1	ZINC000121407860	330399969	/nfs/dbraw/zinc/39/99/69/330399969.db2.gz	WZXNGGYXBHXJBO-LLVKDONJSA-N	0	0	276.767	4.174	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)[C@@H]1C[C@H]1c1ccccc1C	ZINC000121480945	330401783	/nfs/dbraw/zinc/40/17/83/330401783.db2.gz	PVJBDXMRTIQMBL-DLBZAZTESA-N	0	0	298.430	4.077	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1ccc(F)cc1F)c1ccccc1	ZINC000121911825	330408278	/nfs/dbraw/zinc/40/82/78/330408278.db2.gz	NMIZFHBLSLTAIH-GFCCVEGCSA-N	0	0	287.309	4.263	20	30		CIEDRN
CC[C@@H](C#N)N[C@@H](Cc1ccccc1)c1sccc1C	ZINC000122244320	330416296	/nfs/dbraw/zinc/41/62/96/330416296.db2.gz	VXCMDVRNRQWXDN-HOTGVXAUSA-N	0	0	284.428	4.232	20	30		CIEDRN
CC[C@H](C#N)N[C@H](Cc1ccccc1)c1ccccc1F	ZINC000122245980	330416308	/nfs/dbraw/zinc/41/63/08/330416308.db2.gz	QISQNCZYIBGKIW-CRAIPNDOSA-N	0	0	282.362	4.001	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)C[C@@H](C)c1ccc(F)cc1	ZINC000537224239	330429441	/nfs/dbraw/zinc/42/94/41/330429441.db2.gz	JQMNYOWZUVEVIP-KGLIPLIRSA-N	0	0	277.383	4.180	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N1[C@H](C)C[C@H]2CCCC[C@@H]21	ZINC000537266663	330431802	/nfs/dbraw/zinc/43/18/02/330431802.db2.gz	VRVVHPDZVHTEBL-JJXSEGSLSA-N	0	0	278.440	4.094	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N[C@H](c1ccco1)c1ccccc1	ZINC000537437325	330436860	/nfs/dbraw/zinc/43/68/60/330436860.db2.gz	MYXFGHCXTLFKNY-RDJZCZTQSA-N	0	0	298.386	4.023	20	30		CIEDRN
N#Cc1ccc(SCCCCC2CCOCC2)c(F)c1	ZINC000537500689	330440057	/nfs/dbraw/zinc/44/00/57/330440057.db2.gz	OCWBCFILFJIOKS-UHFFFAOYSA-N	0	0	293.407	4.386	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@H](CC)c1ccc(F)cc1F	ZINC000424679925	330444919	/nfs/dbraw/zinc/44/49/19/330444919.db2.gz	MBFRJYCSLNVXRT-CQSZACIVSA-N	0	0	281.346	4.134	20	30		CIEDRN
C[C@H](C#N)CN(Cc1cccc(Cl)c1Cl)C1CC1	ZINC000537660993	330454678	/nfs/dbraw/zinc/45/46/78/330454678.db2.gz	LCMBROBNZKHWCE-SNVBAGLBSA-N	0	0	283.202	4.117	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CC[C@@H](C)C2(CCC2)C1)c1ccccc1	ZINC000537823015	330458322	/nfs/dbraw/zinc/45/83/22/330458322.db2.gz	HRNPAVOSMUSYOB-SJORKVTESA-N	0	0	297.442	4.385	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@@H]1CCC(C)(C)C1	ZINC000514185876	330460361	/nfs/dbraw/zinc/46/03/61/330460361.db2.gz	LKJRTMVXQLGJKU-CQSZACIVSA-N	0	0	251.414	4.018	20	30		CIEDRN
Cc1cc(CNc2cccc(Cl)c2C#N)ccc1F	ZINC000514898382	330466950	/nfs/dbraw/zinc/46/69/50/330466950.db2.gz	AQJXOYULLBLHSU-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
CC(C)C[C@@](C)(C#N)NC(=O)c1ccc(C2CCC2)cc1	ZINC000514982884	330468973	/nfs/dbraw/zinc/46/89/73/330468973.db2.gz	APRWNFGJMDBDJU-SFHVURJKSA-N	0	0	284.403	4.012	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)N[C@@H](C)CCC(C)C	ZINC000515295754	330474338	/nfs/dbraw/zinc/47/43/38/330474338.db2.gz	DWRHPPMJDULHJQ-AWEZNQCLSA-N	0	0	294.464	4.270	20	30		CIEDRN
Cc1ccc(NCCC(C)(C)C#N)c(Br)c1	ZINC000083637531	330481574	/nfs/dbraw/zinc/48/15/74/330481574.db2.gz	NCFHVGDJTUQVGA-UHFFFAOYSA-N	0	0	281.197	4.109	20	30		CIEDRN
C=CCC1(C(=O)N2C[C@@H](C)[C@H]2c2ccccc2)CCCC1	ZINC000515848664	330483982	/nfs/dbraw/zinc/48/39/82/330483982.db2.gz	JEQRSHCGJRFAJK-WBVHZDCISA-N	0	0	283.415	4.343	20	30		CIEDRN
C=CCNC(=O)[C@@H](C)S[C@@H](C)c1cccc2ccccc21	ZINC000516380781	330492127	/nfs/dbraw/zinc/49/21/27/330492127.db2.gz	CECLCOPZVYTBDO-UONOGXRCSA-N	0	0	299.439	4.325	20	30		CIEDRN
C=CCC[C@H](NC(=O)N(C)[C@@H]1CC1(C)C)c1ccccc1	ZINC000425915478	330498619	/nfs/dbraw/zinc/49/86/19/330498619.db2.gz	AJBWASSZWHYEMJ-JKSUJKDBSA-N	0	0	286.419	4.134	20	30		CIEDRN
C=CCC(C)(C)c1nc(-c2nccc3ccccc32)no1	ZINC000426450698	330509736	/nfs/dbraw/zinc/50/97/36/330509736.db2.gz	MWKPKWMCAVEYHB-UHFFFAOYSA-N	0	0	279.343	4.139	20	30		CIEDRN
C=CCN(C)C(=O)c1cn(CCCCC)c2ccccc12	ZINC000428289841	330519237	/nfs/dbraw/zinc/51/92/37/330519237.db2.gz	VPLNPJPGAYQCMG-UHFFFAOYSA-N	0	0	284.403	4.090	20	30		CIEDRN
C=CCC[C@H](NC(=O)NCC(C)(C)C)c1ccccc1	ZINC000429073466	330538208	/nfs/dbraw/zinc/53/82/08/330538208.db2.gz	JXNZDEAVZDVNGH-HNNXBMFYSA-N	0	0	274.408	4.039	20	30		CIEDRN
CC(C)(C#N)C(=O)Nc1ccc(C(C)(C)C(F)(F)F)cc1	ZINC000429221478	330540377	/nfs/dbraw/zinc/54/03/77/330540377.db2.gz	NHKGTJMLUOIDAR-UHFFFAOYSA-N	0	0	298.308	4.015	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc(OCC)c(Cl)c1	ZINC000429829894	330555465	/nfs/dbraw/zinc/55/54/65/330555465.db2.gz	OXFHCMJUJCQJBS-UHFFFAOYSA-N	0	0	281.783	4.280	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc2nc(C)sc2c1	ZINC000429853095	330555791	/nfs/dbraw/zinc/55/57/91/330555791.db2.gz	YOZUTZVOJQSBSF-UHFFFAOYSA-N	0	0	274.389	4.146	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000429906049	330556316	/nfs/dbraw/zinc/55/63/16/330556316.db2.gz	GZEBLSWCHRBLKD-UHFFFAOYSA-N	0	0	299.458	4.460	20	30		CIEDRN
C=CCC(C)(C)C(=O)N(C)Cc1c(F)cccc1Cl	ZINC000429934023	330556663	/nfs/dbraw/zinc/55/66/63/330556663.db2.gz	YLHGCWCSVXWVFG-UHFFFAOYSA-N	0	0	283.774	4.040	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCc1ccc2cc(OC)ccc2c1	ZINC000429944887	330556686	/nfs/dbraw/zinc/55/66/86/330556686.db2.gz	OYFYDKGGGPNNSY-UHFFFAOYSA-N	0	0	297.398	4.067	20	30		CIEDRN
N#C[C@@H]1CC[C@H](Sc2ccc(Br)cc2)C1	ZINC000430089762	330559248	/nfs/dbraw/zinc/55/92/48/330559248.db2.gz	NWJDZNOWUNRBJP-SKDRFNHKSA-N	0	0	282.206	4.233	20	30		CIEDRN
C=CCN(CC=C)C(=O)N[C@H]1CCc2ccc(C(C)C)cc21	ZINC000430181440	330562964	/nfs/dbraw/zinc/56/29/64/330562964.db2.gz	VORDTFSOOPUAJQ-SFHVURJKSA-N	0	0	298.430	4.181	20	30		CIEDRN
C=CCN(C)C(=O)N[C@@H]1C[C@@H]2CCC(C)(C)c3cccc1c32	ZINC000430311193	330566921	/nfs/dbraw/zinc/56/69/21/330566921.db2.gz	HMEOLRVZIKDYQG-XJKSGUPXSA-N	0	0	298.430	4.114	20	30		CIEDRN
COCc1ccccc1/C=C(C)/C=C/c1ccncc1C#N	ZINC000431157729	330580428	/nfs/dbraw/zinc/58/04/28/330580428.db2.gz	XTSPJFJTTQYZFK-XHBXSBNISA-N	0	0	290.366	4.216	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000431305087	330583172	/nfs/dbraw/zinc/58/31/72/330583172.db2.gz	LSLZIBPROZPXPY-SJORKVTESA-N	0	0	299.418	4.075	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cccc(-c2nccs2)c1	ZINC000431331003	330583473	/nfs/dbraw/zinc/58/34/73/330583473.db2.gz	YWHZWAGBSCSFHZ-UHFFFAOYSA-N	0	0	286.400	4.351	20	30		CIEDRN
N#Cc1nccnc1NCc1ccc(C2CCCCC2)cc1	ZINC000431434608	330584617	/nfs/dbraw/zinc/58/46/17/330584617.db2.gz	WZLSROUNLIWYPS-UHFFFAOYSA-N	0	0	292.386	4.008	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@@H]1CC2CCC1CC2	ZINC000431760452	330588673	/nfs/dbraw/zinc/58/86/73/330588673.db2.gz	RQNYKEQYROLNTC-ZBCRRDGASA-N	0	0	289.444	4.089	20	30		CIEDRN
CCc1cc(Cl)c(Cl)cc1OC[C@H](C#N)CCC#N	ZINC000432249592	330595909	/nfs/dbraw/zinc/59/59/09/330595909.db2.gz	GJZLAZSPWOKNNZ-JTQLQIEISA-N	0	0	297.185	4.378	20	30		CIEDRN
CCc1c(C)sc(NC(=O)c2ccccc2CC)c1C#N	ZINC000432680572	330603354	/nfs/dbraw/zinc/60/33/54/330603354.db2.gz	ROVNDOBPEJWWBG-UHFFFAOYSA-N	0	0	298.411	4.305	20	30		CIEDRN
Cc1c(F)ccc(Cl)c1NCc1cccc(C#N)c1	ZINC000432703013	330603923	/nfs/dbraw/zinc/60/39/23/330603923.db2.gz	JXZZCWFWOIOTQO-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
C=C(C)CNC(=O)Nc1cc(-c2ccc(C)o2)ccc1C	ZINC000432970237	330611672	/nfs/dbraw/zinc/61/16/72/330611672.db2.gz	GJDCNIAFLOMKNP-UHFFFAOYSA-N	0	0	284.359	4.261	20	30		CIEDRN
FC(F)(F)Oc1ccc(C#CCNc2ccccc2)cc1	ZINC000433420003	330627909	/nfs/dbraw/zinc/62/79/09/330627909.db2.gz	IHYDLGXDPWSZGJ-UHFFFAOYSA-N	0	0	291.272	4.049	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1ccc(Cl)c(OC)c1	ZINC000433632801	330629548	/nfs/dbraw/zinc/62/95/48/330629548.db2.gz	KLAQVRJMSZVTLQ-NSHDSACASA-N	0	0	296.798	4.215	20	30		CIEDRN
C[C@@H](CC(=O)N1CCCC(C)(C)[C@@H]1C#N)C1CCCCC1	ZINC000434029995	330634559	/nfs/dbraw/zinc/63/45/59/330634559.db2.gz	FLVMMVYBDZELMS-HOCLYGCPSA-N	0	0	290.451	4.134	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1c(C)c(C)ccc1Cl	ZINC000434474643	330639479	/nfs/dbraw/zinc/63/94/79/330639479.db2.gz	QCYCSAQCGVEBLX-UHFFFAOYSA-N	0	0	280.799	4.387	20	30		CIEDRN
N#Cc1ccc(/C=C\c2ncc(Br)s2)s1	ZINC000434636306	330642185	/nfs/dbraw/zinc/64/21/85/330642185.db2.gz	ZDUFZNROTMSDEB-ARJAWSKDSA-N	0	0	297.202	4.009	20	30		CIEDRN
Cc1cc(OCc2csc(C(C)(C)C)n2)ccc1C#N	ZINC000434646732	330642225	/nfs/dbraw/zinc/64/22/25/330642225.db2.gz	RGYROPCXSFSQBL-UHFFFAOYSA-N	0	0	286.400	4.200	20	30		CIEDRN
COc1ccc(C#N)cc1CSCc1cccc(F)c1	ZINC000434926456	330646800	/nfs/dbraw/zinc/64/68/00/330646800.db2.gz	OPVYOJJUQVQXMB-UHFFFAOYSA-N	0	0	287.359	4.139	20	30		CIEDRN
C=CCC[C@H](NC(=O)c1cc(C(C)C)no1)c1ccccc1	ZINC000435277160	330652247	/nfs/dbraw/zinc/65/22/47/330652247.db2.gz	ATMYKFLRECODAN-HNNXBMFYSA-N	0	0	298.386	4.235	20	30		CIEDRN
C=CCC[C@@H](NC(=O)c1cc(C(C)C)no1)c1ccccc1	ZINC000435277161	330652315	/nfs/dbraw/zinc/65/23/15/330652315.db2.gz	ATMYKFLRECODAN-OAHLLOKOSA-N	0	0	298.386	4.235	20	30		CIEDRN
C=CCC[C@@H](NC(=O)[C@@H]1Cc2ccccc21)c1ccccc1	ZINC000435301961	330652637	/nfs/dbraw/zinc/65/26/37/330652637.db2.gz	KTQFZZDRAZTHTD-RTBURBONSA-N	0	0	291.394	4.150	20	30		CIEDRN
C=CCC[C@@H](NC(=O)N[C@@H]1CC=CCC1)c1ccccc1	ZINC000435765933	330662446	/nfs/dbraw/zinc/66/24/46/330662446.db2.gz	ZOSBAFDLAXVGOJ-IAGOWNOFSA-N	0	0	284.403	4.102	20	30		CIEDRN
C=CCC1(c2nc(-c3cc(C)c(O)c(C)c3)no2)CCC1	ZINC000436876384	330687285	/nfs/dbraw/zinc/68/72/85/330687285.db2.gz	YRQILWQLIUVJOP-UHFFFAOYSA-N	0	0	284.359	4.057	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2cc(C)c(O)c(C)c2)no1	ZINC000436876329	330687293	/nfs/dbraw/zinc/68/72/93/330687293.db2.gz	YGPIEKJVGZNIMG-LBPRGKRZSA-N	0	0	272.348	4.129	20	30		CIEDRN
Cc1cc(C#N)ccc1C(=O)N1CCCCC[C@H]1CC(C)C	ZINC000438823585	330729545	/nfs/dbraw/zinc/72/95/45/330729545.db2.gz	KJFLSPCDFNWJOZ-KRWDZBQOSA-N	0	0	298.430	4.298	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2cc(CC)ccc2CC)CC1	ZINC000438861356	330730131	/nfs/dbraw/zinc/73/01/31/330730131.db2.gz	RQNAWXGBNIMWTI-UHFFFAOYSA-N	0	0	286.419	4.241	20	30		CIEDRN
Cc1cc(C#N)ccc1C(=O)N(CCC(C)C)C1CCCC1	ZINC000438908800	330730705	/nfs/dbraw/zinc/73/07/05/330730705.db2.gz	WNXNJWAZVVEDBP-UHFFFAOYSA-N	0	0	298.430	4.298	20	30		CIEDRN
Cc1cc(C#N)ccc1C(=O)N(CC(C)C)CC(C)(C)C	ZINC000439290135	330736390	/nfs/dbraw/zinc/73/63/90/330736390.db2.gz	UIGDNRXKRDZBNI-UHFFFAOYSA-N	0	0	286.419	4.011	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1c(C)cccc1SC	ZINC000439389131	330737768	/nfs/dbraw/zinc/73/77/68/330737768.db2.gz	REVMUAAHHCETLW-LBPRGKRZSA-N	0	0	278.421	4.193	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1cccc(OCC(=C)C)c1	ZINC000439530464	330740037	/nfs/dbraw/zinc/74/00/37/330740037.db2.gz	HOSTUVCBZCCXJL-CQSZACIVSA-N	0	0	288.391	4.118	20	30		CIEDRN
CC(C)(CCC#N)CNc1ccc2oc(C3CC3)nc2c1	ZINC000156635696	330741910	/nfs/dbraw/zinc/74/19/10/330741910.db2.gz	UXQGKAZHGYRHGZ-UHFFFAOYSA-N	0	0	283.375	4.447	20	30		CIEDRN
C=C(C)CN(C)C(=O)Nc1cc(Cl)c(Cl)cc1F	ZINC000439973024	330745348	/nfs/dbraw/zinc/74/53/48/330745348.db2.gz	QRUBCHVIIYHRPJ-UHFFFAOYSA-N	0	0	291.153	4.172	20	30		CIEDRN
Cc1sc(NC(=O)C2(CC(C)C)CC2)c(C#N)c1C	ZINC000440434145	330748312	/nfs/dbraw/zinc/74/83/12/330748312.db2.gz	PGEWCLGLWCTVHR-UHFFFAOYSA-N	0	0	276.405	4.001	20	30		CIEDRN
Cc1ccc(/C=C\CC(=O)N(CCC#N)CCC(C)C)cc1	ZINC000440559003	330750652	/nfs/dbraw/zinc/75/06/52/330750652.db2.gz	PSDTTXKGEGWLBC-XQRVVYSFSA-N	0	0	298.430	4.187	20	30		CIEDRN
C=CCOc1cccc(NC(=O)C2(CC(C)C)CC2)c1	ZINC000440693759	330754229	/nfs/dbraw/zinc/75/42/29/330754229.db2.gz	OMUWYSMYSOTNNZ-UHFFFAOYSA-N	0	0	273.376	4.016	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC)c1ccc(Cl)cc1F	ZINC000441429937	330768377	/nfs/dbraw/zinc/76/83/77/330768377.db2.gz	PVGQASUFSPTEOS-NSHDSACASA-N	0	0	283.774	4.434	20	30		CIEDRN
C=CCC[C@H](NC(=O)C1CC1)c1ccc(C(F)(F)F)cc1	ZINC000441551761	330770673	/nfs/dbraw/zinc/77/06/73/330770673.db2.gz	NUMRMXGNHBARCJ-AWEZNQCLSA-N	0	0	297.320	4.239	20	30		CIEDRN
CC[C@@H](F)CNc1cccc(OCc2cccc(C#N)c2)c1	ZINC000442095108	330773975	/nfs/dbraw/zinc/77/39/75/330773975.db2.gz	VITRIQIVPAJKQS-MRXNPFEDSA-N	0	0	298.361	4.297	20	30		CIEDRN
CC[C@H]1CCC[C@H]1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000448669654	330775904	/nfs/dbraw/zinc/77/59/04/330775904.db2.gz	SXFFUZANCSNQBI-XJKSGUPXSA-N	0	0	284.403	4.253	20	30		CIEDRN
N#Cc1ccc(CNc2cccc3ccccc32)s1	ZINC000157462940	330775990	/nfs/dbraw/zinc/77/59/90/330775990.db2.gz	JPEZDDBYGAHCSP-UHFFFAOYSA-N	0	0	264.353	4.385	20	30		CIEDRN
Cc1csc(-c2cccc(N[C@H]3CC[C@@H](C#N)C3)c2)n1	ZINC000442849725	330786780	/nfs/dbraw/zinc/78/67/80/330786780.db2.gz	CMQFPRZRSXVCEH-DOMZBBRYSA-N	0	0	283.400	4.223	20	30		CIEDRN
CCC(C)(C)c1ccc(N[C@H]2CC[C@H](C#N)C2)cc1	ZINC000442851790	330787007	/nfs/dbraw/zinc/78/70/07/330787007.db2.gz	GPPFAIWMZHVRRF-BBRMVZONSA-N	0	0	256.393	4.478	20	30		CIEDRN
Cc1csc(-c2ccc(N[C@H]3CC[C@H](C#N)C3)cc2)n1	ZINC000442859020	330787788	/nfs/dbraw/zinc/78/77/88/330787788.db2.gz	PUROYUMGAAXBNB-WFASDCNBSA-N	0	0	283.400	4.223	20	30		CIEDRN
Fc1ccc(C#CCNc2ccc3ccoc3c2)cc1	ZINC000442870681	330788922	/nfs/dbraw/zinc/78/89/22/330788922.db2.gz	GVGYDUKBZCLNBJ-UHFFFAOYSA-N	0	0	265.287	4.036	20	30		CIEDRN
N#C[C@@H]1CC[C@H](NC2(c3c(Cl)cccc3Cl)CC2)C1	ZINC000442875740	330789564	/nfs/dbraw/zinc/78/95/64/330789564.db2.gz	OSOGSLMTUSOWEV-MNOVXSKESA-N	0	0	295.213	4.264	20	30		CIEDRN
N#C[C@@H]1CC[C@@H](NC2(c3c(Cl)cccc3Cl)CC2)C1	ZINC000442875737	330789605	/nfs/dbraw/zinc/78/96/05/330789605.db2.gz	OSOGSLMTUSOWEV-GHMZBOCLSA-N	0	0	295.213	4.264	20	30		CIEDRN
C[C@H](Sc1nc2ccccc2[nH]1)c1cccc(C#N)c1	ZINC000442907204	330791363	/nfs/dbraw/zinc/79/13/63/330791363.db2.gz	YSHJTQNZRUPIHJ-NSHDSACASA-N	0	0	279.368	4.288	20	30		CIEDRN
C=CCCC[C@H](C)SCC(=O)Nc1ccccc1	ZINC000443409576	330798939	/nfs/dbraw/zinc/79/89/39/330798939.db2.gz	XIWPXLCMCBSGIF-ZDUSSCGKSA-N	0	0	263.406	4.103	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc2cn(C(C)C)nc2c1	ZINC000443492545	330800376	/nfs/dbraw/zinc/80/03/76/330800376.db2.gz	OVWAANZYDWMFGG-KRWDZBQOSA-N	0	0	285.391	4.158	20	30		CIEDRN
COc1ccc(Cl)c(NCc2ccc(C#N)c(C)c2)c1	ZINC000443988598	330808628	/nfs/dbraw/zinc/80/86/28/330808628.db2.gz	LVZKNFKCDNSISL-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
Cc1cc(CNc2cc(F)cc(Cl)c2)ccc1C#N	ZINC000444004126	330809098	/nfs/dbraw/zinc/80/90/98/330809098.db2.gz	WSLRMSRZUDDUFW-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
Cc1cc(CN2CCCC(C)(C)[C@@H]2C#N)c2ccccc2n1	ZINC000444723658	330821927	/nfs/dbraw/zinc/82/19/27/330821927.db2.gz	ABNYLOMZIXWQDK-SFHVURJKSA-N	0	0	293.414	4.057	20	30		CIEDRN
C=CCCO[C@H](C)c1nc(-c2cc3cc(C)ccc3o2)no1	ZINC000445748698	330835466	/nfs/dbraw/zinc/83/54/66/330835466.db2.gz	JTIZBQHDQFIPHO-GFCCVEGCSA-N	0	0	298.342	4.445	20	30		CIEDRN
C=C[C@H](Cc1nc(-c2cc(C)oc2C)no1)c1ccccc1	ZINC000445850392	330839865	/nfs/dbraw/zinc/83/98/65/330839865.db2.gz	SMMLVSSFMAXJRU-CQSZACIVSA-N	0	0	294.354	4.459	20	30		CIEDRN
Cc1ccc(NCc2cn3ccccc3c2C#N)cc1C	ZINC000446640397	330851127	/nfs/dbraw/zinc/85/11/27/330851127.db2.gz	WTNCTAXHCBLNEI-UHFFFAOYSA-N	0	0	275.355	4.040	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N1CCCC2(CCCC2)C1	ZINC000446654344	330851243	/nfs/dbraw/zinc/85/12/43/330851243.db2.gz	QLGCXABPASXAIR-OAHLLOKOSA-N	0	0	278.440	4.097	20	30		CIEDRN
N#C[C@H]1CCC[C@@H](Nc2cccc3ccsc32)C1	ZINC000446825006	330855176	/nfs/dbraw/zinc/85/51/76/330855176.db2.gz	HSHDKWFPERHAQM-WCQYABFASA-N	0	0	256.374	4.396	20	30		CIEDRN
C=CCC[C@H](CC)Nc1cnn(C2CCCC2)c1C	ZINC000446891816	330857242	/nfs/dbraw/zinc/85/72/42/330857242.db2.gz	CXBYEPLESWAVAO-AWEZNQCLSA-N	0	0	261.413	4.463	20	30		CIEDRN
C=CCCCCCSc1ccc(NC(C)=O)cc1	ZINC000447299682	330863882	/nfs/dbraw/zinc/86/38/82/330863882.db2.gz	SSUPHQLXZGVMRH-UHFFFAOYSA-N	0	0	263.406	4.484	20	30		CIEDRN
C=CCc1ccccc1OCc1nc(C)c(C)s1	ZINC000447366687	330865711	/nfs/dbraw/zinc/86/57/11/330865711.db2.gz	TWWSWMGNPQHRNU-UHFFFAOYSA-N	0	0	259.374	4.067	20	30		CIEDRN
CC[C@H](Nc1cccc(NC(C)=O)c1)c1ccc(C#N)cc1	ZINC000447575166	330870697	/nfs/dbraw/zinc/87/06/97/330870697.db2.gz	QXFOQOZENHKGFF-SFHVURJKSA-N	0	0	293.370	4.080	20	30		CIEDRN
COc1cccc(C)c1NCc1ccccc1C(C)(C)C#N	ZINC000194558544	330875266	/nfs/dbraw/zinc/87/52/66/330875266.db2.gz	LHZJEUQSULVQBD-UHFFFAOYSA-N	0	0	294.398	4.417	20	30		CIEDRN
CCN(C(=O)CCCC(C)C)[C@@H](C)c1ccc(C#N)cc1	ZINC000448777533	330883516	/nfs/dbraw/zinc/88/35/16/330883516.db2.gz	MUDTZCUPQCELNY-HNNXBMFYSA-N	0	0	286.419	4.294	20	30		CIEDRN
CC1(C#N)CCC(Nc2cccc(Br)c2)CC1	ZINC000449043366	330894944	/nfs/dbraw/zinc/89/49/44/330894944.db2.gz	XRESZWOMUZWJRC-UHFFFAOYSA-N	0	0	293.208	4.333	20	30		CIEDRN
CC1(C#N)CCC(Nc2ccccc2OC(F)F)CC1	ZINC000449045941	330895126	/nfs/dbraw/zinc/89/51/26/330895126.db2.gz	JHHXFGAWCMXPDO-UHFFFAOYSA-N	0	0	280.318	4.172	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(F)cc2F)CCCC1	ZINC000449054004	330895541	/nfs/dbraw/zinc/89/55/41/330895541.db2.gz	DMIAHDDKELFPMI-UHFFFAOYSA-N	0	0	265.303	4.040	20	30		CIEDRN
C=CCC1(C(=O)N(CC)Cc2cccs2)CCCC1	ZINC000449097879	330898774	/nfs/dbraw/zinc/89/87/74/330898774.db2.gz	GIQIWYFNRYHHDI-UHFFFAOYSA-N	0	0	277.433	4.233	20	30		CIEDRN
C=CCC1(C(=O)N(C)Cc2sccc2C)CCCC1	ZINC000449096433	330898863	/nfs/dbraw/zinc/89/88/63/330898863.db2.gz	HNQPWNNBVGXEBB-UHFFFAOYSA-N	0	0	277.433	4.151	20	30		CIEDRN
CCSCc1ccc(N[C@@H]2CC[C@H](C#N)C2)cc1	ZINC000449597901	330938795	/nfs/dbraw/zinc/93/87/95/330938795.db2.gz	GWYNBJKJMIDRTA-DZGCQCFKSA-N	0	0	260.406	4.044	20	30		CIEDRN
C[C@@H](Nc1cccc(CC#N)c1)[C@@H](C)c1ccccc1	ZINC000449695119	330944276	/nfs/dbraw/zinc/94/42/76/330944276.db2.gz	HUFUKGMVESIKHK-HUUCEWRRSA-N	0	0	264.372	4.357	20	30		CIEDRN
C=CCC1(C(=O)Nc2nc(C3CC3)cs2)CCCC1	ZINC000449797850	330950529	/nfs/dbraw/zinc/95/05/29/330950529.db2.gz	MPZOWYDXPDLYGU-UHFFFAOYSA-N	0	0	276.405	4.096	20	30		CIEDRN
COc1c(C)ccc(NCC(C)(C)CCC#N)c1C	ZINC000162959897	330970540	/nfs/dbraw/zinc/97/05/40/330970540.db2.gz	JMIOGVMJRSNHQB-UHFFFAOYSA-N	0	0	260.381	4.054	20	30		CIEDRN
C=CCC1(C(=O)NC2CCC(F)(F)CC2)CCCCC1	ZINC000450291497	330971072	/nfs/dbraw/zinc/97/10/72/330971072.db2.gz	GCEPGKAVLLRLMN-UHFFFAOYSA-N	0	0	285.378	4.207	20	30		CIEDRN
N#C[C@@H]1CC[C@@H](Sc2ccc(F)c(Cl)c2)C1	ZINC000450707916	330994672	/nfs/dbraw/zinc/99/46/72/330994672.db2.gz	BYQUVOCLDKXYDK-RKDXNWHRSA-N	0	0	255.745	4.263	20	30		CIEDRN
CC1(C#N)CCN(CCc2c(Cl)cccc2Cl)CC1	ZINC000450715657	330995247	/nfs/dbraw/zinc/99/52/47/330995247.db2.gz	XHBVBFPHGJAVLN-UHFFFAOYSA-N	0	0	297.229	4.162	20	30		CIEDRN
CCOc1cccc2cc([C@@H](C)NCC3(C#N)CCC3)oc21	ZINC000450727602	330996407	/nfs/dbraw/zinc/99/64/07/330996407.db2.gz	YXTPFDZJHRHZLV-CYBMUJFWSA-N	0	0	298.386	4.176	20	30		CIEDRN
C=CCC1(C(=O)NCCCCCSC)CCCCC1	ZINC000450747664	330997672	/nfs/dbraw/zinc/99/76/72/330997672.db2.gz	PVSHQMSODIJQSQ-UHFFFAOYSA-N	0	0	283.481	4.163	20	30		CIEDRN
N#Cc1cccc(SC[C@H]2CCCC2(F)F)c1	ZINC000450854952	331003036	/nfs/dbraw/zinc/00/30/36/331003036.db2.gz	DSSHIUJXNWMPTM-LLVKDONJSA-N	0	0	253.317	4.086	20	30		CIEDRN
CCCc1nc(C)c(CSc2ccccc2C#N)o1	ZINC000450854769	331003080	/nfs/dbraw/zinc/00/30/80/331003080.db2.gz	GVCIALJVWUBMHY-UHFFFAOYSA-N	0	0	272.373	4.100	20	30		CIEDRN
N#Cc1ccc(SC2CCC(C(F)(F)F)CC2)nc1	ZINC000450869402	331003936	/nfs/dbraw/zinc/00/39/36/331003936.db2.gz	JWYGMHKBCSOUNB-UHFFFAOYSA-N	0	0	286.322	4.166	20	30		CIEDRN
N#C[C@H]1CC[C@H](SCc2ccccc2C2CC2)C1	ZINC000450904433	331006145	/nfs/dbraw/zinc/00/61/45/331006145.db2.gz	FGYHFMADRXXPPU-WFASDCNBSA-N	0	0	257.402	4.489	20	30		CIEDRN
C=CCC1(C(=O)Nc2cc(C)c(O)c(C)c2C)CCCC1	ZINC000450978027	331009822	/nfs/dbraw/zinc/00/98/22/331009822.db2.gz	CPYWCWQMNIAOIR-UHFFFAOYSA-N	0	0	287.403	4.392	20	30		CIEDRN
C[C@H](CCCC(F)(F)F)Nc1cccc(F)c1C#N	ZINC000163254774	331010261	/nfs/dbraw/zinc/01/02/61/331010261.db2.gz	PSVGPVFDLDQBJS-SECBINFHSA-N	0	0	274.261	4.230	20	30		CIEDRN
Cc1ccc(F)c(C(=O)Nc2ccc(C(C)(C)C#N)cc2)c1	ZINC000194692604	331010981	/nfs/dbraw/zinc/01/09/81/331010981.db2.gz	KLBNHFCODKQBGN-UHFFFAOYSA-N	0	0	296.345	4.188	20	30		CIEDRN
CC[C@H](C#N)SC1CCC(C(F)(F)F)CC1	ZINC000451036097	331012770	/nfs/dbraw/zinc/01/27/70/331012770.db2.gz	JNVMITMZBKKQFF-HWOCKDDLSA-N	0	0	251.317	4.143	20	30		CIEDRN
N#CC1(CSc2ccc(Cl)cc2Cl)CC1	ZINC000451035079	331012791	/nfs/dbraw/zinc/01/27/91/331012791.db2.gz	AMNQJUTVMNBQID-UHFFFAOYSA-N	0	0	258.173	4.389	20	30		CIEDRN
C=CCOCCSC1CCC(C(F)(F)F)CC1	ZINC000451044582	331013325	/nfs/dbraw/zinc/01/33/25/331013325.db2.gz	WASBWEHHYYSIQG-UHFFFAOYSA-N	0	0	268.344	4.043	20	30		CIEDRN
N#CCCCSC1CCC(C(F)(F)F)CC1	ZINC000451045111	331013354	/nfs/dbraw/zinc/01/33/54/331013354.db2.gz	WXTRDPDJEDLLSO-UHFFFAOYSA-N	0	0	251.317	4.144	20	30		CIEDRN
N#CC1(CN2CC[C@@H](C(F)(F)F)c3ccccc32)CCC1	ZINC000451063132	331014352	/nfs/dbraw/zinc/01/43/52/331014352.db2.gz	LGOKXZHLFGRLCH-CYBMUJFWSA-N	0	0	294.320	4.236	20	30		CIEDRN
C[C@H](c1ccc(CN(C)CC(C)(C)C#N)cc1)C(F)(F)F	ZINC000451062196	331014389	/nfs/dbraw/zinc/01/43/89/331014389.db2.gz	JNVYTCZXJKRLLU-GFCCVEGCSA-N	0	0	298.352	4.334	20	30		CIEDRN
C[C@@H](NCc1cccc(F)c1C#N)c1cccc(C2CC2)c1	ZINC000451116460	331016237	/nfs/dbraw/zinc/01/62/37/331016237.db2.gz	QRSJHYVAXQGVPH-CYBMUJFWSA-N	0	0	294.373	4.426	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H]2CCOc3c(C)cccc32)CCCC1	ZINC000451122409	331016563	/nfs/dbraw/zinc/01/65/63/331016563.db2.gz	RCVWIRRQQZXFKR-MRXNPFEDSA-N	0	0	299.414	4.071	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H]2CCCc3c(O)cccc32)CCCC1	ZINC000451133119	331016889	/nfs/dbraw/zinc/01/68/89/331016889.db2.gz	ZKETXWMOKLZJKI-MRXNPFEDSA-N	0	0	299.414	4.022	20	30		CIEDRN
C[C@@H](CCCC(F)(F)F)Nc1ccc(CC#N)cc1	ZINC000163306443	331018138	/nfs/dbraw/zinc/01/81/38/331018138.db2.gz	RCGYJPFXZKAJBG-NSHDSACASA-N	0	0	270.298	4.286	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@H]1CCC[C@H](c2ccccc2)C1	ZINC000451172408	331018629	/nfs/dbraw/zinc/01/86/29/331018629.db2.gz	VYIAKCAYHMEDHT-HOTGVXAUSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CCC1(C(=O)N2CC3(CCC3)C[C@@H]2C)CCCCC1	ZINC000451188350	331019597	/nfs/dbraw/zinc/01/95/97/331019597.db2.gz	DIPTXSDOSJRIOM-HNNXBMFYSA-N	0	0	275.436	4.304	20	30		CIEDRN
C=CCCCNC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000451298095	331023684	/nfs/dbraw/zinc/02/36/84/331023684.db2.gz	VKXYLZOPVZWWGX-OCCSQVGLSA-N	0	0	295.785	4.055	20	30		CIEDRN
C=CCC1(C(=O)N2CCC(C)=C(C)C2)CCCCC1	ZINC000451382606	331026519	/nfs/dbraw/zinc/02/65/19/331026519.db2.gz	IJBPOJDOSKDTII-UHFFFAOYSA-N	0	0	261.409	4.082	20	30		CIEDRN
N#CC1(CN2CCCC[C@H]2c2ccc(Cl)cc2)CC1	ZINC000451733255	331040529	/nfs/dbraw/zinc/04/05/29/331040529.db2.gz	IGHUVRSJAXWCEL-HNNXBMFYSA-N	0	0	274.795	4.171	20	30		CIEDRN
N#Cc1c(F)cccc1CN1CC2(CCC2)[C@H]1c1ccco1	ZINC000451853869	331044807	/nfs/dbraw/zinc/04/48/07/331044807.db2.gz	MICICFXCUQEHOO-QGZVFWFLSA-N	0	0	296.345	4.018	20	30		CIEDRN
CC(C)(C#N)CCN1CCCC[C@H]1c1nc2ccccc2[nH]1	ZINC000451879130	331045954	/nfs/dbraw/zinc/04/59/54/331045954.db2.gz	PGHYIXVFIFFIOP-INIZCTEOSA-N	0	0	296.418	4.030	20	30		CIEDRN
Cc1ccc(NC(=O)N[C@@H](CCC#N)c2ccccc2)cc1	ZINC000163547245	331054748	/nfs/dbraw/zinc/05/47/48/331054748.db2.gz	SWCWKSIBBWNQQR-KRWDZBQOSA-N	0	0	293.370	4.162	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@@H]1CCCc2sc(Cl)cc21	ZINC000452124768	331055247	/nfs/dbraw/zinc/05/52/47/331055247.db2.gz	RNMUYFRBFMPECS-SNVBAGLBSA-N	0	0	283.824	4.107	20	30		CIEDRN
CC(C)CCCC(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000452137689	331055548	/nfs/dbraw/zinc/05/55/48/331055548.db2.gz	GDGRQWKCVDKUSA-KRWDZBQOSA-N	0	0	286.419	4.364	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc([C@@H]3CCOC3)cc2)CCCC1	ZINC000452157220	331056418	/nfs/dbraw/zinc/05/64/18/331056418.db2.gz	YIMHNPLMIZFEHU-MRXNPFEDSA-N	0	0	299.414	4.266	20	30		CIEDRN
C=CCC1(C(=O)N2CC(C3CCCCC3)C2)CCCC1	ZINC000452169395	331057009	/nfs/dbraw/zinc/05/70/09/331057009.db2.gz	XGXAKTFYXJVOEP-UHFFFAOYSA-N	0	0	275.436	4.162	20	30		CIEDRN
C=CCCCC(=O)N[C@H](C)c1cccc(C2CC2)c1	ZINC000452196057	331058098	/nfs/dbraw/zinc/05/80/98/331058098.db2.gz	QWXBMCWZFQGGPT-CYBMUJFWSA-N	0	0	257.377	4.098	20	30		CIEDRN
C=CCCC1(C(=O)N[C@H](C)c2ccc(F)c(C)c2)CC1	ZINC000452316715	331062129	/nfs/dbraw/zinc/06/21/29/331062129.db2.gz	BMQAZXPTOBWZMB-CYBMUJFWSA-N	0	0	275.367	4.058	20	30		CIEDRN
CN(CC(C)(C)C#N)C(=O)C1=C(c2ccccc2)CCCC1	ZINC000452433747	331064691	/nfs/dbraw/zinc/06/46/91/331064691.db2.gz	MABFPNBENRNJER-UHFFFAOYSA-N	0	0	296.414	4.022	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@]1(C)CC(C)C	ZINC000452513368	331067111	/nfs/dbraw/zinc/06/71/11/331067111.db2.gz	REWBKQRNAHSNBW-GOEBONIOSA-N	0	0	251.414	4.016	20	30		CIEDRN
CC(C)C[C@]1(C)CCCN1C(=O)[C@H](C)c1cccc(C#N)c1	ZINC000452514347	331067129	/nfs/dbraw/zinc/06/71/29/331067129.db2.gz	SQHMRYRTNSWQNW-BEFAXECRSA-N	0	0	298.430	4.089	20	30		CIEDRN
C=CCCC(=O)N[C@@H](c1ccc(F)c(Cl)c1)C1CC1	ZINC000452586837	331069675	/nfs/dbraw/zinc/06/96/75/331069675.db2.gz	FCXSQODDTPZTOL-OAHLLOKOSA-N	0	0	281.758	4.013	20	30		CIEDRN
CC(C)C[C@@H]1C[C@H]1C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452640121	331070805	/nfs/dbraw/zinc/07/08/05/331070805.db2.gz	DNDJYAOOBDLOBH-CHWSQXEVSA-N	0	0	290.794	4.027	20	30		CIEDRN
C[C@H]1CCC[C@@H]1CC(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452642971	331070810	/nfs/dbraw/zinc/07/08/10/331070810.db2.gz	IEIUDGVFXMDCSL-WCQYABFASA-N	0	0	290.794	4.171	20	30		CIEDRN
CCC[C@H](C(=O)Nc1ccc(CC#N)cc1Cl)C(C)C	ZINC000452645883	331070972	/nfs/dbraw/zinc/07/09/72/331070972.db2.gz	PHLREVJDWRWRAK-ZDUSSCGKSA-N	0	0	292.810	4.417	20	30		CIEDRN
C[C@@H]1CCC[C@H](C(=O)Nc2ccc(CC#N)cc2Cl)C1	ZINC000452649692	331071002	/nfs/dbraw/zinc/07/10/02/331071002.db2.gz	XJRRWVHHSVPPHF-YPMHNXCESA-N	0	0	290.794	4.171	20	30		CIEDRN
C[C@H]1CCC[C@@H](C(=O)Nc2ccc(CC#N)cc2Cl)C1	ZINC000452649691	331071049	/nfs/dbraw/zinc/07/10/49/331071049.db2.gz	XJRRWVHHSVPPHF-WCQYABFASA-N	0	0	290.794	4.171	20	30		CIEDRN
CC[C@H](CC(=O)Nc1ccc(CC#N)cc1Cl)C(C)C	ZINC000452651045	331071129	/nfs/dbraw/zinc/07/11/29/331071129.db2.gz	WDZSPUVMCRMLJI-CYBMUJFWSA-N	0	0	292.810	4.417	20	30		CIEDRN
CCC[C@H](NC(=O)c1cc(C#N)ccc1Cl)C(C)(C)C	ZINC000452681043	331072094	/nfs/dbraw/zinc/07/20/94/331072094.db2.gz	YPZYVRDOLNLVTD-AWEZNQCLSA-N	0	0	292.810	4.156	20	30		CIEDRN
C=C(C)CCNC(=O)C[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000452717993	331073252	/nfs/dbraw/zinc/07/32/52/331073252.db2.gz	NMUQLFFFMZGOTD-GFCCVEGCSA-N	0	0	299.336	4.281	20	30		CIEDRN
C=C(C)CCNC(=O)C[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000452720788	331073665	/nfs/dbraw/zinc/07/36/65/331073665.db2.gz	FLHGYBNKEWODCX-LBPRGKRZSA-N	0	0	299.336	4.281	20	30		CIEDRN
C=C(C)CCNC(=O)[C@H](C)c1ccc(Cl)c(Cl)c1	ZINC000452720466	331073708	/nfs/dbraw/zinc/07/37/08/331073708.db2.gz	XABBLDKCVUZTPL-SNVBAGLBSA-N	0	0	286.202	4.179	20	30		CIEDRN
C=C(C)CCNC(=O)CCc1ccc(Cl)c(Cl)c1	ZINC000452720803	331073719	/nfs/dbraw/zinc/07/37/19/331073719.db2.gz	FOZJYJCZBFRRAZ-UHFFFAOYSA-N	0	0	286.202	4.008	20	30		CIEDRN
C=C(C)CCNC(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000452722208	331073898	/nfs/dbraw/zinc/07/38/98/331073898.db2.gz	JMZCHPODHYEOHY-NWDGAFQWSA-N	0	0	298.213	4.179	20	30		CIEDRN
C=C(C)CCNC(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1	ZINC000452722142	331073901	/nfs/dbraw/zinc/07/39/01/331073901.db2.gz	JAHSTFKGTJNBBL-ZWKOTPCHSA-N	0	0	279.383	4.026	20	30		CIEDRN
C=CC(C)(C)CNC(=O)c1sc2ccc(C#N)cc2c1C	ZINC000452781294	331077592	/nfs/dbraw/zinc/07/75/92/331077592.db2.gz	HMQYMCIRUQCWAQ-UHFFFAOYSA-N	0	0	298.411	4.023	20	30		CIEDRN
COc1ccc(C#N)cc1NCc1ccc(C(C)C)nc1C	ZINC000453074483	331086731	/nfs/dbraw/zinc/08/67/31/331086731.db2.gz	CYJULTNOWRPVKF-UHFFFAOYSA-N	0	0	295.386	4.006	20	30		CIEDRN
Cc1nc(C(C)C)ccc1CNc1ccc(F)c(C#N)c1	ZINC000453080966	331087215	/nfs/dbraw/zinc/08/72/15/331087215.db2.gz	FCWDODFWQFOTJF-UHFFFAOYSA-N	0	0	283.350	4.136	20	30		CIEDRN
CCSCCNc1ccccc1S[C@@H](C)CC#N	ZINC000453090581	331088308	/nfs/dbraw/zinc/08/83/08/331088308.db2.gz	PFMAXRFGEHNLKD-LBPRGKRZSA-N	0	0	280.462	4.246	20	30		CIEDRN
C=CCCc1ccccc1NCc1nnc(C(C)C)s1	ZINC000453127118	331091900	/nfs/dbraw/zinc/09/19/00/331091900.db2.gz	QVSXQCUPMLRTSO-UHFFFAOYSA-N	0	0	287.432	4.392	20	30		CIEDRN
CC(C)(C#N)c1ccccc1CNc1cccc(CC#N)c1	ZINC000453140779	331093558	/nfs/dbraw/zinc/09/35/58/331093558.db2.gz	GITUVFUPUNULDS-UHFFFAOYSA-N	0	0	289.382	4.166	20	30		CIEDRN
Cc1ccccc1CCCNc1cccc(CC#N)c1	ZINC000453144718	331093928	/nfs/dbraw/zinc/09/39/28/331093928.db2.gz	KUORPOPNRWADCX-UHFFFAOYSA-N	0	0	264.372	4.106	20	30		CIEDRN
Cc1cc(C#N)cc(NCCCCC(F)(F)F)c1	ZINC000453151504	331094654	/nfs/dbraw/zinc/09/46/54/331094654.db2.gz	VFBVULCTPJOHTB-UHFFFAOYSA-N	0	0	256.271	4.011	20	30		CIEDRN
C=CCCCC[C@@H](C)Nc1ccc(NC(C)=O)cc1OC	ZINC000453167544	331096351	/nfs/dbraw/zinc/09/63/51/331096351.db2.gz	DEOLJAUEOJEMOW-CYBMUJFWSA-N	0	0	290.407	4.200	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H]2CCCCC2(F)F)n1	ZINC000453190606	331099411	/nfs/dbraw/zinc/09/94/11/331099411.db2.gz	VCKHFEPRALXMFE-JTQLQIEISA-N	0	0	270.323	4.216	20	30		CIEDRN
CC(C)c1ccoc1-c1noc([C@@]2(C#N)CC23CCCC3)n1	ZINC000453191050	331099421	/nfs/dbraw/zinc/09/94/21/331099421.db2.gz	VXJGEFKFGMZBBZ-KRWDZBQOSA-N	0	0	297.358	4.178	20	30		CIEDRN
C=CCCc1noc(-c2cc(C3CC3)nc3ccccc32)n1	ZINC000453228731	331104184	/nfs/dbraw/zinc/10/41/84/331104184.db2.gz	BSSYOBVUMAJZSG-UHFFFAOYSA-N	0	0	291.354	4.281	20	30		CIEDRN
C=CCCc1noc([C@@H](C)CSCc2ccccc2)n1	ZINC000453238465	331105541	/nfs/dbraw/zinc/10/55/41/331105541.db2.gz	QFMCABSFGKJTIK-ZDUSSCGKSA-N	0	0	288.416	4.225	20	30		CIEDRN
N#Cc1ccc2c(c1)[C@@H](Nc1ccccc1OCCF)CC2	ZINC000453247229	331107012	/nfs/dbraw/zinc/10/70/12/331107012.db2.gz	DPYPQWMBZHTAPA-INIZCTEOSA-N	0	0	296.345	4.006	20	30		CIEDRN
CCc1ccc(N[C@H](C)c2ccc(C#N)cc2)cc1OC	ZINC000453337889	331118729	/nfs/dbraw/zinc/11/87/29/331118729.db2.gz	AWXPYLNNYUJCKL-CYBMUJFWSA-N	0	0	280.371	4.302	20	30		CIEDRN
C=CCCCC(=O)N1C[C@@H](c2ccc(C)cc2)C[C@@H]1C	ZINC000470573965	331138840	/nfs/dbraw/zinc/13/88/40/331138840.db2.gz	KKLVSWVREOHJLU-RDJZCZTQSA-N	0	0	271.404	4.056	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1C[C@H](c2ccc(C)cc2)C[C@H]1C	ZINC000470585431	331139246	/nfs/dbraw/zinc/13/92/46/331139246.db2.gz	WTADPOGQWLXOSJ-SZVBFZGTSA-N	0	0	285.431	4.302	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1C[C@@H](c2ccc(C)cc2)C[C@H]1C	ZINC000470585429	331139260	/nfs/dbraw/zinc/13/92/60/331139260.db2.gz	WTADPOGQWLXOSJ-HHXXYDBFSA-N	0	0	285.431	4.302	20	30		CIEDRN
Cc1cccc(NC(=O)C(C)(C)Cc2ccc(C#N)cc2)c1	ZINC000454170468	331140687	/nfs/dbraw/zinc/14/06/87/331140687.db2.gz	MZMCGLKEKFWQMT-UHFFFAOYSA-N	0	0	292.382	4.074	20	30		CIEDRN
CC(C)(C)C[C@@H]1CCN(C(=O)Nc2ccc(CC#N)cc2)C1	ZINC000454344225	331144582	/nfs/dbraw/zinc/14/45/82/331144582.db2.gz	NIESIHRWVFJODG-HNNXBMFYSA-N	0	0	299.418	4.043	20	30		CIEDRN
CCC[C@@H](NC(=O)Nc1ccc(CC#N)cc1)C(C)(C)C	ZINC000454350766	331144677	/nfs/dbraw/zinc/14/46/77/331144677.db2.gz	ZYRAXERVCFDOCS-OAHLLOKOSA-N	0	0	287.407	4.089	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)C1=CC[C@@H](C)CC1	ZINC000454426604	331145835	/nfs/dbraw/zinc/14/58/35/331145835.db2.gz	FOHNKTFHAUROFU-CYBMUJFWSA-N	0	0	275.417	4.009	20	30		CIEDRN
C=C(C)CCNC(=O)Nc1cc(C(F)(F)F)ccc1C	ZINC000454936498	331157220	/nfs/dbraw/zinc/15/72/20/331157220.db2.gz	PWEICDMNYAAJJU-UHFFFAOYSA-N	0	0	286.297	4.102	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)N1C[C@@H](C(C)C)[C@@H]1C(C)C	ZINC000455004462	331158718	/nfs/dbraw/zinc/15/87/18/331158718.db2.gz	RPGFOUPCLLPOMZ-RDJZCZTQSA-N	0	0	299.418	4.011	20	30		CIEDRN
C=C(C)CCNC(=O)Nc1c(F)cc(Cl)c(C)c1F	ZINC000455033448	331159272	/nfs/dbraw/zinc/15/92/72/331159272.db2.gz	DHICCDLIIHOTRS-UHFFFAOYSA-N	0	0	288.725	4.014	20	30		CIEDRN
C=CC(C)(C)CNC(=O)N1CCC[C@H]1c1ccc(C)s1	ZINC000455366536	331167382	/nfs/dbraw/zinc/16/73/82/331167382.db2.gz	MIJBKGIFXLLUEU-ZDUSSCGKSA-N	0	0	292.448	4.115	20	30		CIEDRN
C=CC(C)(C)CNC(=O)N1CC[C@H]1c1ccc(Cl)cc1	ZINC000455370392	331167477	/nfs/dbraw/zinc/16/74/77/331167477.db2.gz	QVJPOFVXDIMSKT-AWEZNQCLSA-N	0	0	292.810	4.009	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)NC1(C(C)C)CC1	ZINC000455375201	331167734	/nfs/dbraw/zinc/16/77/34/331167734.db2.gz	CLSGNQYWADOSPH-UHFFFAOYSA-N	0	0	272.392	4.115	20	30		CIEDRN
C=CCCCCNC(=O)Nc1cccc(-c2ncco2)c1C	ZINC000455495077	331171014	/nfs/dbraw/zinc/17/10/14/331171014.db2.gz	VHPGNROOHJIIFV-UHFFFAOYSA-N	0	0	299.374	4.128	20	30		CIEDRN
CCC[C@H](C)N(C)C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000455699371	331175749	/nfs/dbraw/zinc/17/57/49/331175749.db2.gz	HCBAQVIBFUAPSX-NSHDSACASA-N	0	0	293.798	4.058	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1cc(C)c(C)cc1Cl	ZINC000455728471	331176321	/nfs/dbraw/zinc/17/63/21/331176321.db2.gz	BKDTVOMEXSORLY-UHFFFAOYSA-N	0	0	280.799	4.387	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1ccccc1C(C)(F)F	ZINC000455773084	331177465	/nfs/dbraw/zinc/17/74/65/331177465.db2.gz	OSJDNWCMVPUCLG-LLVKDONJSA-N	0	0	282.334	4.275	20	30		CIEDRN
C[C@@H](C1CCCCC1)N(C)C(=O)Nc1cccc(CC#N)c1	ZINC000455908799	331180517	/nfs/dbraw/zinc/18/05/17/331180517.db2.gz	RJYZYJRCBPVNAQ-AWEZNQCLSA-N	0	0	299.418	4.185	20	30		CIEDRN
CC(C)C1(C)CCN(C(=O)Nc2cccc(CC#N)c2)CC1	ZINC000455913357	331180823	/nfs/dbraw/zinc/18/08/23/331180823.db2.gz	ZBNZXZWOTKTZMG-UHFFFAOYSA-N	0	0	299.418	4.043	20	30		CIEDRN
CCC(CC)CN(CC)C(=O)Nc1cccc(CC#N)c1	ZINC000455914576	331180876	/nfs/dbraw/zinc/18/08/76/331180876.db2.gz	GSLMZXPTFPTNPY-UHFFFAOYSA-N	0	0	287.407	4.043	20	30		CIEDRN
CCC[C@@]1(C)CCCN(C(=O)Nc2cccc(CC#N)c2)C1	ZINC000455926703	331181338	/nfs/dbraw/zinc/18/13/38/331181338.db2.gz	YUPGVPQEJSRUCI-SFHVURJKSA-N	0	0	299.418	4.187	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1ccc([C@@H](C)C(F)(F)F)cc1	ZINC000456011324	331182419	/nfs/dbraw/zinc/18/24/19/331182419.db2.gz	DOBIXZXYFGJOCO-BXUZGUMPSA-N	0	0	299.336	4.437	20	30		CIEDRN
CC(C)=CCC[C@H](C)NC(=O)[C@H](C#N)CCc1ccccc1	ZINC000456050370	331183393	/nfs/dbraw/zinc/18/33/93/331183393.db2.gz	GCIXKQBTHSAPHR-WMZOPIPTSA-N	0	0	298.430	4.010	20	30		CIEDRN
C[C@H]1CC=C(C(=O)N[C@H](CCCC#N)c2ccccc2)CC1	ZINC000456077210	331183986	/nfs/dbraw/zinc/18/39/86/331183986.db2.gz	ZBHMGIVMBLUPEQ-MAUKXSAKSA-N	0	0	296.414	4.284	20	30		CIEDRN
C=CCC1(NC(=O)[C@@H]2CCCC(F)(F)C2)CCCCC1	ZINC000456359535	331190848	/nfs/dbraw/zinc/19/08/48/331190848.db2.gz	CFBQVUHRQJOELG-CYBMUJFWSA-N	0	0	285.378	4.207	20	30		CIEDRN
C=CCC1(NC(=O)CCCC(F)(F)F)CCCCC1	ZINC000456359947	331190855	/nfs/dbraw/zinc/19/08/55/331190855.db2.gz	COKQYFKRUSVXJW-UHFFFAOYSA-N	0	0	277.330	4.114	20	30		CIEDRN
C=CCC1(NC(=O)[C@H](CC)CC(F)(F)F)CCCCC1	ZINC000456367510	331191341	/nfs/dbraw/zinc/19/13/41/331191341.db2.gz	OEMCVPZNCBYBJL-GFCCVEGCSA-N	0	0	291.357	4.360	20	30		CIEDRN
C=CCC1(NC(=O)c2ccc(SC)o2)CCCCC1	ZINC000456372163	331191531	/nfs/dbraw/zinc/19/15/31/331191531.db2.gz	TYCOIILFDLYAEN-UHFFFAOYSA-N	0	0	279.405	4.010	20	30		CIEDRN
C=CCC1(CNC(=O)[C@H](CC)CC(F)(F)F)CCCC1	ZINC000456498534	331194384	/nfs/dbraw/zinc/19/43/84/331194384.db2.gz	ATOFYYWNVNAQFB-GFCCVEGCSA-N	0	0	291.357	4.218	20	30		CIEDRN
N#CCC[C@H](Nc1ncc(C#N)cc1Cl)c1ccccc1	ZINC000164305132	331197317	/nfs/dbraw/zinc/19/73/17/331197317.db2.gz	UVDBLTJCBRNPEA-HNNXBMFYSA-N	0	0	296.761	4.064	20	30		CIEDRN
N#CCC[C@@H](Nc1nc2cc(F)ccc2o1)c1ccccc1	ZINC000164312514	331199046	/nfs/dbraw/zinc/19/90/46/331199046.db2.gz	IBAQZXUBTSHCGY-CQSZACIVSA-N	0	0	295.317	4.424	20	30		CIEDRN
C[C@@H](CCC(=O)Nc1cccc(CC#N)c1)c1ccccc1	ZINC000456760533	331200828	/nfs/dbraw/zinc/20/08/28/331200828.db2.gz	WZXWYZBBBCJEAV-HNNXBMFYSA-N	0	0	292.382	4.275	20	30		CIEDRN
C=CCC1(C(=O)Nc2cccc(CC#N)c2)CCCCC1	ZINC000456760038	331200832	/nfs/dbraw/zinc/20/08/32/331200832.db2.gz	WLXFVMVSKNOYCY-UHFFFAOYSA-N	0	0	282.387	4.218	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(O)c(F)c2F)CCCCC1	ZINC000456778615	331203164	/nfs/dbraw/zinc/20/31/64/331203164.db2.gz	HHHZEDXBXFHFMX-UHFFFAOYSA-N	0	0	295.329	4.136	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NC1(C(C)(C)c2ccccc2)CC1	ZINC000456803105	331204455	/nfs/dbraw/zinc/20/44/55/331204455.db2.gz	HJMZFAGGOIQFJD-HNNXBMFYSA-N	0	0	285.431	4.215	20	30		CIEDRN
C=C(CC)CNC(=O)[C@@H](C)c1ccc2ccccc2c1	ZINC000456809311	331204657	/nfs/dbraw/zinc/20/46/57/331204657.db2.gz	BHHFYLPVOTUMBY-AWEZNQCLSA-N	0	0	267.372	4.026	20	30		CIEDRN
C=C(CC)CNC(=O)CCC[C@H](C)c1cccc(OC)c1	ZINC000456815723	331205552	/nfs/dbraw/zinc/20/55/52/331205552.db2.gz	ZBZBOICBBOODPW-HNNXBMFYSA-N	0	0	289.419	4.051	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@H](C1CC1)C1CCC1)c1ccccc1	ZINC000457246930	331217213	/nfs/dbraw/zinc/21/72/13/331217213.db2.gz	OGBSOZYKQHLWAF-ROUUACIJSA-N	0	0	283.415	4.041	20	30		CIEDRN
C=CCCCC(=O)N1CC2(CCCC2)[C@H]1c1ccccc1	ZINC000457280773	331218039	/nfs/dbraw/zinc/21/80/39/331218039.db2.gz	NNPXDSDMEBVNET-GOSISDBHSA-N	0	0	283.415	4.487	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)c2[nH]ccc2C2CC2)c1	ZINC000457544404	331226547	/nfs/dbraw/zinc/22/65/47/331226547.db2.gz	URRACNNRDWGSTK-UHFFFAOYSA-N	0	0	296.370	4.099	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)[C@H](C)CC(F)(F)F	ZINC000457551492	331226719	/nfs/dbraw/zinc/22/67/19/331226719.db2.gz	APRMVXSCHOBAOX-GFCCVEGCSA-N	0	0	291.357	4.170	20	30		CIEDRN
C=CCC[C@@H](NC(=O)[C@@H](CC)CC(F)F)c1ccccc1	ZINC000457681301	331231106	/nfs/dbraw/zinc/23/11/06/331231106.db2.gz	PZOFRTFNTFSFPE-DZGCQCFKSA-N	0	0	295.373	4.492	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)[C@H](C)C2CCC2)CCCC1(C)C	ZINC000457759744	331233499	/nfs/dbraw/zinc/23/34/99/331233499.db2.gz	KFFWWIQDOMABPX-HIFRSBDPSA-N	0	0	263.425	4.016	20	30		CIEDRN
Cc1cccc2c1[C@@H](C)C[C@H]2CC(=O)NCC(C)(C)CC#N	ZINC000457990889	331239459	/nfs/dbraw/zinc/23/94/59/331239459.db2.gz	ICXWKOHAZYNBCL-GJZGRUSLSA-N	0	0	298.430	4.032	20	30		CIEDRN
CC[C@H](CC1CCCCC1)C(=O)NCC(C)(C)CC#N	ZINC000457994879	331239869	/nfs/dbraw/zinc/23/98/69/331239869.db2.gz	PBAFRNYLZRDDNA-OAHLLOKOSA-N	0	0	278.440	4.039	20	30		CIEDRN
CCC[C@H](CC1CCCC1)C(=O)NCC(C)(C)CC#N	ZINC000457997626	331240278	/nfs/dbraw/zinc/24/02/78/331240278.db2.gz	VZWZXEBKHMKZNM-OAHLLOKOSA-N	0	0	278.440	4.039	20	30		CIEDRN
CC(C)(CC#N)CNC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000458016747	331240936	/nfs/dbraw/zinc/24/09/36/331240936.db2.gz	GBRATKANASBRJH-IAGOWNOFSA-N	0	0	298.430	4.016	20	30		CIEDRN
C=CC(C)(C)C(=O)N1CC2(CCCCC2)[C@H]1C(C)C	ZINC000458170833	331244165	/nfs/dbraw/zinc/24/41/65/331244165.db2.gz	IHILEDYDPAEDKN-CQSZACIVSA-N	0	0	263.425	4.016	20	30		CIEDRN
CC(C)N(C(=O)N[C@H](CCCC#N)c1ccccc1)C1CC1	ZINC000458801108	331260106	/nfs/dbraw/zinc/26/01/06/331260106.db2.gz	MNOZOKWTOZHUKK-QGZVFWFLSA-N	0	0	299.418	4.004	20	30		CIEDRN
C[C@@H]1CCCCN1C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000458807663	331260431	/nfs/dbraw/zinc/26/04/31/331260431.db2.gz	XWUOCWDBIPBYNA-NVXWUHKLSA-N	0	0	299.418	4.006	20	30		CIEDRN
C=C(C)CCNC(=O)N1CCCCC[C@@H]1c1ccc(C)o1	ZINC000458997184	331265314	/nfs/dbraw/zinc/26/53/14/331265314.db2.gz	ISWRWAAVXSVSIB-OAHLLOKOSA-N	0	0	290.407	4.181	20	30		CIEDRN
COc1cc(NCC(C)(C)CCC#N)cc(OC)c1Cl	ZINC000459743688	331297659	/nfs/dbraw/zinc/29/76/59/331297659.db2.gz	GBPQHOPBALBNRH-UHFFFAOYSA-N	0	0	296.798	4.099	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@@]1(C)CCC[C@@H]1C	ZINC000459876410	331302807	/nfs/dbraw/zinc/30/28/07/331302807.db2.gz	DJAJQSUBZWIDRS-BBRMVZONSA-N	0	0	277.433	4.089	20	30		CIEDRN
CC[C@H](c1ccccc1)N(CC)C(=O)c1cscc1C#N	ZINC000459973141	331304002	/nfs/dbraw/zinc/30/40/02/331304002.db2.gz	OEVYBRQQRYCBNM-MRXNPFEDSA-N	0	0	298.411	4.233	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)[C@]1(C)CC=CCC1	ZINC000460014759	331304381	/nfs/dbraw/zinc/30/43/81/331304381.db2.gz	AROBTWSQPXIBNB-GOSISDBHSA-N	0	0	287.378	4.087	20	30		CIEDRN
CCCCCN(C(=O)c1cscc1C#N)[C@@H](C)CCC	ZINC000460049248	331304711	/nfs/dbraw/zinc/30/47/11/331304711.db2.gz	JRUADRVFMXCLJX-ZDUSSCGKSA-N	0	0	292.448	4.441	20	30		CIEDRN
C=CC[C@@H](C)[NH2+][C@@H](c1ccccc1)c1ccc(OC)cc1	ZINC000166146940	331306737	/nfs/dbraw/zinc/30/67/37/331306737.db2.gz	MODIARSQVHPFEA-BEFAXECRSA-N	0	0	281.399	4.339	20	30		CIEDRN
C=C(C)Cn1c(C2CC2)nnc1N(C)c1cc(C)cc(C)c1	ZINC000460955972	331309440	/nfs/dbraw/zinc/30/94/40/331309440.db2.gz	ZNWLAWAOQWBCCY-UHFFFAOYSA-N	0	0	296.418	4.116	20	30		CIEDRN
C=CCCCN(C)C(=O)c1ccc(Cl)cc1SCC	ZINC000460999928	331310204	/nfs/dbraw/zinc/31/02/04/331310204.db2.gz	IXMUCIOBUNAWMT-UHFFFAOYSA-N	0	0	297.851	4.490	20	30		CIEDRN
C=C(CC)CSCc1cncc(C(F)(F)F)c1	ZINC000461244651	331312033	/nfs/dbraw/zinc/31/20/33/331312033.db2.gz	IFUYUNFEIBBMKL-UHFFFAOYSA-N	0	0	261.312	4.300	20	30		CIEDRN
N#Cc1ccc(OCC(=O)CCC2CCCC2)c(Cl)c1	ZINC000461402636	331313041	/nfs/dbraw/zinc/31/30/41/331313041.db2.gz	NLIMSNVYHZJSHF-UHFFFAOYSA-N	0	0	291.778	4.130	20	30		CIEDRN
Cc1cc(C)c2ncc(C#N)c(N3CCCCCC3)c2c1	ZINC000461460337	331313471	/nfs/dbraw/zinc/31/34/71/331313471.db2.gz	LUCHRDUYZKAZTA-UHFFFAOYSA-N	0	0	279.387	4.104	20	30		CIEDRN
CC[C@@H]1CCCN(c2c(C#N)cnc3ccc(Cl)cc32)C1	ZINC000461452762	331313487	/nfs/dbraw/zinc/31/34/87/331313487.db2.gz	JXOWTSHRWLJGLN-GFCCVEGCSA-N	0	0	299.805	4.386	20	30		CIEDRN
CCCNc1ccc(C#N)cc1NC(=O)CC1CCCCC1	ZINC000461692380	331313986	/nfs/dbraw/zinc/31/39/86/331313986.db2.gz	DZJVNEPVGJZESD-UHFFFAOYSA-N	0	0	299.418	4.289	20	30		CIEDRN
CCCNc1ccc(C#N)cc1NC(=O)CCC1CCCC1	ZINC000461699923	331314066	/nfs/dbraw/zinc/31/40/66/331314066.db2.gz	LGWOPKALSMVGDL-UHFFFAOYSA-N	0	0	299.418	4.289	20	30		CIEDRN
CC[C@H](CC(F)(F)F)Nc1nc(C)c(C#N)cc1Cl	ZINC000461933478	331315643	/nfs/dbraw/zinc/31/56/43/331315643.db2.gz	DAPGIUGDTUZUHR-SECBINFHSA-N	0	0	291.704	4.058	20	30		CIEDRN
Cc1nc(N2CCCC3(CCCC3)C2)c(Cl)cc1C#N	ZINC000461938539	331315701	/nfs/dbraw/zinc/31/57/01/331315701.db2.gz	YNIZGQOTBLTITK-UHFFFAOYSA-N	0	0	289.810	4.076	20	30		CIEDRN
Cc1nc(N2[C@H](C)C[C@H]3CCCC[C@H]32)c(Cl)cc1C#N	ZINC000461947415	331316052	/nfs/dbraw/zinc/31/60/52/331316052.db2.gz	JPOVRFUHUVWKPA-IXPVHAAZSA-N	0	0	289.810	4.073	20	30		CIEDRN
Cc1cc(Sc2cccc(C#N)c2)c(F)cc1[N+](=O)[O-]	ZINC000461956985	331316207	/nfs/dbraw/zinc/31/62/07/331316207.db2.gz	JEZJHXFSAASFJF-UHFFFAOYSA-N	0	0	288.303	4.065	20	30		CIEDRN
C[C@H](c1c(F)cccc1F)N(C)c1cccc(F)c1C#N	ZINC000499016509	331316717	/nfs/dbraw/zinc/31/67/17/331316717.db2.gz	LOCMHDVNRVZKKW-SNVBAGLBSA-N	0	0	290.288	4.173	20	30		CIEDRN
CCC[C@@H]1[C@@H](C)CCCN1C(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000462215347	331318627	/nfs/dbraw/zinc/31/86/27/331318627.db2.gz	VZXWLXIZFYDLPS-RLFYNMQTSA-N	0	0	298.430	4.089	20	30		CIEDRN
CC#CCCSCc1nc(-c2cccs2)oc1C	ZINC000462355045	331320376	/nfs/dbraw/zinc/32/03/76/331320376.db2.gz	DZZABSUIRRSSQH-UHFFFAOYSA-N	0	0	277.414	4.358	20	30		CIEDRN
Cc1[nH]c2ccc(CNc3ccc(F)cc3C#N)cc2c1C	ZINC000462375805	331320934	/nfs/dbraw/zinc/32/09/34/331320934.db2.gz	HIHOFTNXTHVGRY-UHFFFAOYSA-N	0	0	293.345	4.408	20	30		CIEDRN
CC#CCCSc1nc(C(F)(F)F)nc2ccccc21	ZINC000462387357	331321218	/nfs/dbraw/zinc/32/12/18/331321218.db2.gz	JQMXYROCOKBGOG-UHFFFAOYSA-N	0	0	296.317	4.154	20	30		CIEDRN
C=CCC(CC=C)C(=O)NCCc1ccc(Cl)c(C)c1	ZINC000462456345	331322358	/nfs/dbraw/zinc/32/23/58/331322358.db2.gz	VPZLATFWGQNOBM-UHFFFAOYSA-N	0	0	291.822	4.076	20	30		CIEDRN
C[C@H](C(=O)NCCC1=CCCCCC1)c1cccc(C#N)c1	ZINC000462504909	331322986	/nfs/dbraw/zinc/32/29/86/331322986.db2.gz	SXHZQBDRWLAGQO-HNNXBMFYSA-N	0	0	296.414	4.059	20	30		CIEDRN
N#Cc1cccc(Cl)c1N1CC[C@@H](c2ccccc2)C1	ZINC000462803948	331329741	/nfs/dbraw/zinc/32/97/41/331329741.db2.gz	BGVNVVTWSSQVAK-OAHLLOKOSA-N	0	0	282.774	4.206	20	30		CIEDRN
N#Cc1cc(F)ccc1NCCc1ccc(F)cc1Cl	ZINC000462835795	331332193	/nfs/dbraw/zinc/33/21/93/331332193.db2.gz	RGGQRTIJGWMISU-UHFFFAOYSA-N	0	0	292.716	4.144	20	30		CIEDRN
Cc1ccccc1[C@@H]1C[C@@H](C)N(c2ccc(F)cc2C#N)C1	ZINC000462852298	331332646	/nfs/dbraw/zinc/33/26/46/331332646.db2.gz	LCWSYXYYNWSHAA-GDBMZVCRSA-N	0	0	294.373	4.388	20	30		CIEDRN
CS[C@H]1CCC[C@@H](Nc2c(Cl)cccc2C#N)C1	ZINC000462868839	331333365	/nfs/dbraw/zinc/33/33/65/331333365.db2.gz	STDINNJWZAKSLM-NEPJUHHUSA-N	0	0	280.824	4.298	20	30		CIEDRN
N#Cc1ccc(N[C@H]2C[C@H]2Cc2ccccc2)cc1Cl	ZINC000462883772	331333905	/nfs/dbraw/zinc/33/39/05/331333905.db2.gz	NNYDTSGGHOHMJQ-PBHICJAKSA-N	0	0	282.774	4.255	20	30		CIEDRN
CC[C@H](C)[C@@H](Nc1ccc(C#N)cn1)c1ccc(Cl)cc1	ZINC000462890979	331334096	/nfs/dbraw/zinc/33/40/96/331334096.db2.gz	PGWRCGXNHXRGFO-YVEFUNNKSA-N	0	0	299.805	4.228	20	30		CIEDRN
C[C@H]1CN(c2ccc(F)cc2C#N)CC[C@@H]1c1ccccc1	ZINC000462893997	331334160	/nfs/dbraw/zinc/33/41/60/331334160.db2.gz	HTIUHJFYKLDZHL-KSSFIOAISA-N	0	0	294.373	4.327	20	30		CIEDRN
CCCNc1ccc(C#N)cc1NC(=O)[C@@H](C)CC(C)C	ZINC000462989895	331336462	/nfs/dbraw/zinc/33/64/62/331336462.db2.gz	HULJHKNYMKLBIS-ZDUSSCGKSA-N	0	0	287.407	4.001	20	30		CIEDRN
C=C[C@@H](CC(=O)N(CC)CC(C)(C)C)c1ccccc1	ZINC000462987373	331336505	/nfs/dbraw/zinc/33/65/05/331336505.db2.gz	CGMIVLUGNXNOOS-HNNXBMFYSA-N	0	0	273.420	4.241	20	30		CIEDRN
C[C@@H](CNc1ccc(C#N)cc1F)c1ccc(F)cc1F	ZINC000463028164	331337535	/nfs/dbraw/zinc/33/75/35/331337535.db2.gz	JOJMHNIKSQQMNS-JTQLQIEISA-N	0	0	290.288	4.191	20	30		CIEDRN
C[C@@H](c1noc([C@@H](C)c2cccc(C#N)c2)n1)C(C)(C)C	ZINC000463054967	331338856	/nfs/dbraw/zinc/33/88/56/331338856.db2.gz	LSIZAZGEITYUIO-RYUDHWBXSA-N	0	0	283.375	4.243	20	30		CIEDRN
CCC[C@]1(C)CCCN(c2ncc(C#N)cc2Cl)C1	ZINC000463072155	331339289	/nfs/dbraw/zinc/33/92/89/331339289.db2.gz	ZIGHQCXWRKQRMA-OAHLLOKOSA-N	0	0	277.799	4.013	20	30		CIEDRN
C[C@@H](CNc1ccc(F)cc1C#N)Sc1ccccc1	ZINC000463077122	331339589	/nfs/dbraw/zinc/33/95/89/331339589.db2.gz	FSXXQSPMRUIYPW-LBPRGKRZSA-N	0	0	286.375	4.290	20	30		CIEDRN
C[C@@H](CNc1ccc(C#N)cc1F)Sc1ccccc1	ZINC000463080668	331339750	/nfs/dbraw/zinc/33/97/50/331339750.db2.gz	CXYBKUCDRXRLGB-LBPRGKRZSA-N	0	0	286.375	4.290	20	30		CIEDRN
CC(C)[C@H](C)SCc1cn2ccccc2c1C#N	ZINC000463219315	331342580	/nfs/dbraw/zinc/34/25/80/331342580.db2.gz	OTKZIAMKCZYZIA-LBPRGKRZSA-N	0	0	258.390	4.089	20	30		CIEDRN
N#C[C@@H]1CCC[C@H](Nc2cc(Cl)cc(Cl)c2)C1	ZINC000463234841	331343435	/nfs/dbraw/zinc/34/34/35/331343435.db2.gz	BDGZQBCQFGPTBH-SKDRFNHKSA-N	0	0	269.175	4.488	20	30		CIEDRN
CCc1ccc(N[C@H]2CCC[C@@H](C#N)C2)cc1CC	ZINC000463236540	331343487	/nfs/dbraw/zinc/34/34/87/331343487.db2.gz	LLCMGBOHZHEZQF-CJNGLKHVSA-N	0	0	256.393	4.306	20	30		CIEDRN
CC#CCSc1ncc(-c2ccc(Cl)cc2)o1	ZINC000463250565	331344347	/nfs/dbraw/zinc/34/43/47/331344347.db2.gz	OGAMZVFRVAOELS-UHFFFAOYSA-N	0	0	263.749	4.110	20	30		CIEDRN
Cc1cc(C(F)(F)F)c(C#N)c(SCC2CCC2)n1	ZINC000463259638	331344546	/nfs/dbraw/zinc/34/45/46/331344546.db2.gz	AGBOAJSCWNYROO-UHFFFAOYSA-N	0	0	286.322	4.173	20	30		CIEDRN
CCc1ccc(CC)c(N[C@@H]2CCC[C@@H](C#N)C2)c1	ZINC000463278921	331344933	/nfs/dbraw/zinc/34/49/33/331344933.db2.gz	FBITXRGXAKAPJP-GDBMZVCRSA-N	0	0	256.393	4.306	20	30		CIEDRN
C=CCN(CC=C)C(=O)c1ccccc1OC1CCCCC1	ZINC000463281934	331344956	/nfs/dbraw/zinc/34/49/56/331344956.db2.gz	WNGVKAIJFIXESW-UHFFFAOYSA-N	0	0	299.414	4.212	20	30		CIEDRN
CCN(C(=O)[C@H](C)c1cccc(C#N)c1)c1ccccc1C	ZINC000463282945	331345023	/nfs/dbraw/zinc/34/50/23/331345023.db2.gz	ZGYQYVCSUZIZRD-OAHLLOKOSA-N	0	0	292.382	4.023	20	30		CIEDRN
Cc1c(Br)cccc1N[C@H]1CCC[C@@H](C#N)C1	ZINC000463287182	331345324	/nfs/dbraw/zinc/34/53/24/331345324.db2.gz	JESPOYDMTXPHJG-NEPJUHHUSA-N	0	0	293.208	4.252	20	30		CIEDRN
Cc1ccc([C@@H](C)Nc2ccc([N+](=O)[O-])c(C#N)c2)c(C)c1	ZINC000463420324	331347326	/nfs/dbraw/zinc/34/73/26/331347326.db2.gz	QVIVGKGBMCELBS-CYBMUJFWSA-N	0	0	295.342	4.256	20	30		CIEDRN
C=CCN(CCc1ccccc1)C(=O)c1cc(C)cc(F)c1	ZINC000463501310	331348607	/nfs/dbraw/zinc/34/86/07/331348607.db2.gz	NHZRQWWLNNHBGA-UHFFFAOYSA-N	0	0	297.373	4.005	20	30		CIEDRN
C=CCCCN(C)C(=O)C1CCC(c2ccccc2)CC1	ZINC000463675714	331350341	/nfs/dbraw/zinc/35/03/41/331350341.db2.gz	QFBOHHZQRUVCTH-UHFFFAOYSA-N	0	0	285.431	4.385	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1cccc(F)c1Cl	ZINC000464082389	331356489	/nfs/dbraw/zinc/35/64/89/331356489.db2.gz	NYPWXBHCMGPOQV-UHFFFAOYSA-N	0	0	283.774	4.298	20	30		CIEDRN
CC#CCS[C@@H](C)c1nc(-c2ccc(C)c(F)c2)no1	ZINC000464094618	331356816	/nfs/dbraw/zinc/35/68/16/331356816.db2.gz	IGWZAJDVXIQBMU-NSHDSACASA-N	0	0	290.363	4.002	20	30		CIEDRN
CC[C@@H](CC(=O)N[C@](C)(C#N)C(C)(C)C)c1ccccc1	ZINC000464160574	331357237	/nfs/dbraw/zinc/35/72/37/331357237.db2.gz	XFKDDGGUSDLMRQ-KBXCAEBGSA-N	0	0	286.419	4.015	20	30		CIEDRN
CC(C)(C)[C@@](C)(C#N)NC(=O)C[C@H]1CCCCC1(C)C	ZINC000464162515	331357401	/nfs/dbraw/zinc/35/74/01/331357401.db2.gz	NEKVBVRLJMUZPH-CXAGYDPISA-N	0	0	278.440	4.037	20	30		CIEDRN
CCCc1cc(C(=O)N[C@@](C)(C#N)C(C)(C)C)sc1C	ZINC000464163963	331357409	/nfs/dbraw/zinc/35/74/09/331357409.db2.gz	MCIDMQRYVGSKBP-INIZCTEOSA-N	0	0	292.448	4.067	20	30		CIEDRN
CC(C)(C)[C@@](C)(C#N)NC(=O)C[C@@H]1CCCCC1(C)C	ZINC000464162518	331357413	/nfs/dbraw/zinc/35/74/13/331357413.db2.gz	NEKVBVRLJMUZPH-SUMWQHHRSA-N	0	0	278.440	4.037	20	30		CIEDRN
CC(C)(C)c1ccc(C(=O)N[C@](C)(C#N)C(C)(C)C)s1	ZINC000464169920	331357518	/nfs/dbraw/zinc/35/75/18/331357518.db2.gz	NEGSPMOOQBNFEC-MRXNPFEDSA-N	0	0	292.448	4.104	20	30		CIEDRN
CC[C@H](C)N(C(=O)[C@H](C)c1cccc(C#N)c1)[C@@H](C)CC	ZINC000464335301	331359775	/nfs/dbraw/zinc/35/97/75/331359775.db2.gz	MTBRPBSKMQQMLG-SOUVJXGZSA-N	0	0	286.419	4.087	20	30		CIEDRN
C=CCC[C@H](NC(=O)N1CC(C)(CC)C1)c1ccccc1	ZINC000464383107	331360064	/nfs/dbraw/zinc/36/00/64/331360064.db2.gz	LTMMHEZQLSSVNZ-INIZCTEOSA-N	0	0	286.419	4.135	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCCCCCc1ccccc1	ZINC000464436124	331360461	/nfs/dbraw/zinc/36/04/61/331360461.db2.gz	IQMWVDHWICMAML-INIZCTEOSA-N	0	0	273.420	4.118	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)CCC1CCCCC1	ZINC000464437233	331360536	/nfs/dbraw/zinc/36/05/36/331360536.db2.gz	NYWOSXUGUDWXDZ-AWEZNQCLSA-N	0	0	251.414	4.018	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(Oc2ccccc2)nc1	ZINC000464436762	331360544	/nfs/dbraw/zinc/36/05/44/331360544.db2.gz	FGNRHZYOIIFJNU-CQSZACIVSA-N	0	0	296.370	4.415	20	30		CIEDRN
CC#CCCCC(=O)N[C@H](CCC)C1CCCCC1	ZINC000464436784	331360582	/nfs/dbraw/zinc/36/05/82/331360582.db2.gz	FLEKBOHMUULRHD-MRXNPFEDSA-N	0	0	263.425	4.045	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccc(OC2CCCC2)cc1	ZINC000464441661	331360633	/nfs/dbraw/zinc/36/06/33/331360633.db2.gz	MBVVBMJTBQANGR-UHFFFAOYSA-N	0	0	285.387	4.140	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CCC[C@@H]1CCCC	ZINC000464443539	331360798	/nfs/dbraw/zinc/36/07/98/331360798.db2.gz	RLTFBIJOESFEJD-SOUVJXGZSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCCC[C@@H]1Cc1ccccc1	ZINC000464447990	331360845	/nfs/dbraw/zinc/36/08/45/331360845.db2.gz	UXIYMZSMIKRSQC-FUHWJXTLSA-N	0	0	285.431	4.213	20	30		CIEDRN
CCCC[C@H](CC)C(=O)N(CCC#N)C(C)(C)CC	ZINC000464465642	331361094	/nfs/dbraw/zinc/36/10/94/331361094.db2.gz	ZVJFKCBNQBPAJR-AWEZNQCLSA-N	0	0	266.429	4.134	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1cscc1-c1ccccc1	ZINC000464492595	331361467	/nfs/dbraw/zinc/36/14/67/331361467.db2.gz	FBZGVIZOSCGRDD-AWEZNQCLSA-N	0	0	285.412	4.500	20	30		CIEDRN
C=CC[C@@H](C(=O)N(C)[C@H]1CCC(C)(C)C1)c1ccccc1	ZINC000464491569	331361532	/nfs/dbraw/zinc/36/15/32/331361532.db2.gz	YNFSWPPGASBSPM-DLBZAZTESA-N	0	0	285.431	4.383	20	30		CIEDRN
CC#CCCCC(=O)N(CC)[C@@H](CC)c1ccccc1	ZINC000464548557	331362280	/nfs/dbraw/zinc/36/22/80/331362280.db2.gz	KYFJYFNXTZOTBD-KRWDZBQOSA-N	0	0	271.404	4.180	20	30		CIEDRN
CC#CCCCC(=O)N(Cc1ccc(C(C)C)cc1)C1CC1	ZINC000464558761	331362535	/nfs/dbraw/zinc/36/25/35/331362535.db2.gz	ZSWUEMPSEGTPAI-UHFFFAOYSA-N	0	0	297.442	4.495	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000464563489	331362764	/nfs/dbraw/zinc/36/27/64/331362764.db2.gz	KXZOCLHFNWWGMR-SNVBAGLBSA-N	0	0	271.282	4.246	20	30		CIEDRN
N#Cc1ccc(NC(=O)CC/C=C/c2ccccc2)cc1F	ZINC000464639303	331364056	/nfs/dbraw/zinc/36/40/56/331364056.db2.gz	TXQXCVGLQQXRBF-XBXARRHUSA-N	0	0	294.329	4.129	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)c1cccc(C(C)C)c1	ZINC000464645753	331364169	/nfs/dbraw/zinc/36/41/69/331364169.db2.gz	DSKPMVDENDGQIA-CQSZACIVSA-N	0	0	259.393	4.375	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H]1CC(C)(C)C	ZINC000464650299	331364220	/nfs/dbraw/zinc/36/42/20/331364220.db2.gz	YFYJQYHFJMCWSL-UONOGXRCSA-N	0	0	251.414	4.016	20	30		CIEDRN
N#Cc1ccc(NC(=O)c2ccc(C3CCC3)cc2)cc1F	ZINC000464649098	331364237	/nfs/dbraw/zinc/36/42/37/331364237.db2.gz	UOSJIJWFVJDMNL-UHFFFAOYSA-N	0	0	294.329	4.217	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](C)c1ccccc1C(F)(F)F	ZINC000464651156	331364238	/nfs/dbraw/zinc/36/42/38/331364238.db2.gz	CWYSBDVORHVPKI-VXGBXAGGSA-N	0	0	299.336	4.485	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)Nc1cc(Cl)ccc1OC(C)C	ZINC000464661249	331364442	/nfs/dbraw/zinc/36/44/42/331364442.db2.gz	FKRKEDJYQZSANY-OAHLLOKOSA-N	0	0	294.782	4.006	20	30		CIEDRN
CC(C)(C)[C@@H](C#N)NC(=O)CC(C)(C)C1CCCCC1	ZINC000464709198	331365045	/nfs/dbraw/zinc/36/50/45/331365045.db2.gz	HRWBTOURZAINKW-CQSZACIVSA-N	0	0	278.440	4.037	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)CC(C)(C)CC	ZINC000465027428	331376187	/nfs/dbraw/zinc/37/61/87/331376187.db2.gz	DWXCEJREJHCIPY-UHFFFAOYSA-N	0	0	259.393	4.028	20	30		CIEDRN
C=C[C@H](C)NC(=O)CCCc1cc(Cl)sc1Cl	ZINC000465101388	331378344	/nfs/dbraw/zinc/37/83/44/331378344.db2.gz	GOZVCERVNBNNDH-QMMMGPOBSA-N	0	0	292.231	4.068	20	30		CIEDRN
C=C[C@H](C)NC(=O)c1sccc1-c1ccc(C)cc1	ZINC000465112602	331378695	/nfs/dbraw/zinc/37/86/95/331378695.db2.gz	QTXWNYQHTYRAEU-LBPRGKRZSA-N	0	0	271.385	4.028	20	30		CIEDRN
C=C[C@H](C)NC(=O)c1ccc(CSc2ccccc2)cc1	ZINC000465113926	331378789	/nfs/dbraw/zinc/37/87/89/331378789.db2.gz	SQLYONJGXAQRRQ-AWEZNQCLSA-N	0	0	297.423	4.283	20	30		CIEDRN
C=C[C@@H](C)NC(=O)CC1CCC(c2ccccc2)CC1	ZINC000465117023	331378950	/nfs/dbraw/zinc/37/89/50/331378950.db2.gz	SUGLBHFXTDSSCJ-HPUBIQBYSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=C[C@H](C)NC(=O)Nc1cccc(COC(C)(C)C)c1C	ZINC000465234559	331380750	/nfs/dbraw/zinc/38/07/50/331380750.db2.gz	NSHDIQJYRRNHGU-LBPRGKRZSA-N	0	0	290.407	4.006	20	30		CIEDRN
C=C[C@@H](C)NC(=O)Nc1cc(Cl)ccc1SCC	ZINC000465264651	331380938	/nfs/dbraw/zinc/38/09/38/331380938.db2.gz	ZZSVXZMIAHSOJA-SECBINFHSA-N	0	0	284.812	4.148	20	30		CIEDRN
C=CCOc1cccc(NC(=O)N[C@H](C)C[C@@H](C)CC)c1	ZINC000466172760	331390512	/nfs/dbraw/zinc/39/05/12/331390512.db2.gz	KUSMBERCLFOKLB-UONOGXRCSA-N	0	0	290.407	4.198	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)N[C@@H](C)C[C@@H](C)CC	ZINC000466176049	331390648	/nfs/dbraw/zinc/39/06/48/331390648.db2.gz	ZWAKYCXKFGARCV-HOTGVXAUSA-N	0	0	288.435	4.209	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cn(CC(C)C)nc1C(F)F	ZINC000466232606	331391319	/nfs/dbraw/zinc/39/13/19/331391319.db2.gz	FAVVSUTZVWWAGW-LLVKDONJSA-N	0	0	299.365	4.018	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1c2ccccc2CC[C@H]1C	ZINC000466245380	331391651	/nfs/dbraw/zinc/39/16/51/331391651.db2.gz	IBIFCPVOKLFTQX-KEYYUXOJSA-N	0	0	271.404	4.029	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H]1c2ccccc2CCC[C@H]1C	ZINC000466306390	331392492	/nfs/dbraw/zinc/39/24/92/331392492.db2.gz	JSQMGZGTYMTVCT-BEFAXECRSA-N	0	0	283.415	4.010	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(CC)Cc1ccccc1Cl	ZINC000466366632	331393628	/nfs/dbraw/zinc/39/36/28/331393628.db2.gz	KAZYBRPWOTVRLK-CQSZACIVSA-N	0	0	294.826	4.226	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(Cc1cccc(F)c1)C(C)C	ZINC000466379022	331393934	/nfs/dbraw/zinc/39/39/34/331393934.db2.gz	UUXSJSMQYJGDDK-INIZCTEOSA-N	0	0	292.398	4.100	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CCC[C@H]1c1cccc(F)c1	ZINC000466380178	331394141	/nfs/dbraw/zinc/39/41/41/331394141.db2.gz	MDQOTVHUVHYLCH-HOTGVXAUSA-N	0	0	290.382	4.027	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N1CCc2sccc2[C@@H]1CC	ZINC000466382445	331394169	/nfs/dbraw/zinc/39/41/69/331394169.db2.gz	GVEFOIGSWXOCLF-OCCSQVGLSA-N	0	0	292.448	4.122	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N1CCCC(C)(C)[C@H]1CC=C	ZINC000466384409	331394232	/nfs/dbraw/zinc/39/42/32/331394232.db2.gz	XBVPYVXYRGYBHS-HUUCEWRRSA-N	0	0	278.440	4.117	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1ccc(C)c(C(F)(F)F)c1	ZINC000466395415	331394788	/nfs/dbraw/zinc/39/47/88/331394788.db2.gz	KJPWZYAFBRXQTK-UHFFFAOYSA-N	0	0	286.297	4.054	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(C)[C@@H](C)c1cc(C)ccc1C	ZINC000466410030	331395653	/nfs/dbraw/zinc/39/56/53/331395653.db2.gz	PNWPKTDLTQRJLD-JKSUJKDBSA-N	0	0	288.435	4.361	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCCC[C@H]1[C@H](C)CC	ZINC000466418681	331396058	/nfs/dbraw/zinc/39/60/58/331396058.db2.gz	ZSKGULQSJSDJET-ILXRZTDVSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](Cc2ccccc2)[C@H]1C	ZINC000466427228	331396712	/nfs/dbraw/zinc/39/67/12/331396712.db2.gz	WPKQTJQUJCHFHC-LZLYRXPVSA-N	0	0	285.431	4.068	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H]1CCCCC	ZINC000466428478	331396817	/nfs/dbraw/zinc/39/68/17/331396817.db2.gz	NGXFOGVDONCYTO-GJZGRUSLSA-N	0	0	251.414	4.160	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC1CCC1)c1ccccc1	ZINC000466429947	331396890	/nfs/dbraw/zinc/39/68/90/331396890.db2.gz	BQENSDIWEWFDLW-OAHLLOKOSA-N	0	0	271.404	4.422	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](CC)C(C)(C)c1ccccc1	ZINC000466431781	331396923	/nfs/dbraw/zinc/39/69/23/331396923.db2.gz	RUPCUHWSIKSIJY-NVXWUHKLSA-N	0	0	287.447	4.461	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCCCC[C@@H]1CC(C)C	ZINC000466430679	331396940	/nfs/dbraw/zinc/39/69/40/331396940.db2.gz	HWBAHNSPAFWXIX-HZPDHXFCSA-N	0	0	265.441	4.406	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC(C)C)C(CC)CC	ZINC000466435361	331397034	/nfs/dbraw/zinc/39/70/34/331397034.db2.gz	SLGZSMRNRKJNDI-CQSZACIVSA-N	0	0	253.430	4.262	20	30		CIEDRN
CC#CCCCC(=O)NC1CCC(C)(c2ccccc2)CC1	ZINC000466433651	331397045	/nfs/dbraw/zinc/39/70/45/331397045.db2.gz	FAHXAFGFYCWZKE-UHFFFAOYSA-N	0	0	297.442	4.197	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CC(C)(C)c2ccccc21	ZINC000466437562	331397164	/nfs/dbraw/zinc/39/71/64/331397164.db2.gz	CUBNDCUCMFAZIP-XJKSGUPXSA-N	0	0	271.404	4.128	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccnc(Oc2ccccc2)c1	ZINC000466443187	331397220	/nfs/dbraw/zinc/39/72/20/331397220.db2.gz	CCXGNDAMJMBZJI-AWEZNQCLSA-N	0	0	296.370	4.415	20	30		CIEDRN
C=CCn1c(SCC/C=C/CC)nnc1-c1ccco1	ZINC000466495504	331398535	/nfs/dbraw/zinc/39/85/35/331398535.db2.gz	MSUWWMZTJDUWIX-AATRIKPKSA-N	0	0	289.404	4.173	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1ccccc1CSCC	ZINC000466525229	331399011	/nfs/dbraw/zinc/39/90/11/331399011.db2.gz	AEBCTOTVEFPLQJ-AWEZNQCLSA-N	0	0	277.433	4.024	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1ccccc1SC(C)C	ZINC000466526985	331399038	/nfs/dbraw/zinc/39/90/38/331399038.db2.gz	CTTZFGKWDNOYNZ-ZDUSSCGKSA-N	0	0	277.433	4.272	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NC[C@H]1CCCC[C@@H]1C(F)(F)F	ZINC000466527849	331399115	/nfs/dbraw/zinc/39/91/15/331399115.db2.gz	FUJFWIZGIVCIID-XQQFMLRXSA-N	0	0	291.357	4.074	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@@H](OC(C)(C)C)c1ccccc1	ZINC000466529204	331399156	/nfs/dbraw/zinc/39/91/56/331399156.db2.gz	NMITTWPTOKRDEK-HOTGVXAUSA-N	0	0	289.419	4.014	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)C(c1ccccc1)c1ccccc1	ZINC000466528983	331399197	/nfs/dbraw/zinc/39/91/97/331399197.db2.gz	IUTPHCFJGAWPRR-SFHVURJKSA-N	0	0	293.410	4.289	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)C(C)(C)c1ccc(Cl)cc1	ZINC000466531704	331399208	/nfs/dbraw/zinc/39/92/08/331399208.db2.gz	ZDOKVBLKQXVHEO-AWEZNQCLSA-N	0	0	279.811	4.089	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@H](c1ccccc1)[C@@H](C)CC	ZINC000466532273	331399256	/nfs/dbraw/zinc/39/92/56/331399256.db2.gz	WMXSFPJWILDSGX-XIRDDKMYSA-N	0	0	273.420	4.287	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@H](c1ccccc1)[C@H](C)CC	ZINC000466532272	331399327	/nfs/dbraw/zinc/39/93/27/331399327.db2.gz	WMXSFPJWILDSGX-PVAVHDDUSA-N	0	0	273.420	4.287	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@@H](CC)CC1CCCC1	ZINC000466540247	331399475	/nfs/dbraw/zinc/39/94/75/331399475.db2.gz	JWEBTWKJDAALAT-GJZGRUSLSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)[C@H](CC)CC1CCCC1	ZINC000466540248	331399483	/nfs/dbraw/zinc/39/94/83/331399483.db2.gz	JWEBTWKJDAALAT-HUUCEWRRSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1cccc(OCCC(C)C)c1	ZINC000466559202	331399854	/nfs/dbraw/zinc/39/98/54/331399854.db2.gz	MWEIOLGWWZTBKN-UHFFFAOYSA-N	0	0	290.407	4.151	20	30		CIEDRN
C=CCCN(C)C(=O)CCCc1csc2ccccc12	ZINC000466634969	331401074	/nfs/dbraw/zinc/40/10/74/331401074.db2.gz	SMEINXZUJFUUAB-UHFFFAOYSA-N	0	0	287.428	4.259	20	30		CIEDRN
C=CCCN(C)C(=O)[C@@H](c1cccc(Cl)c1)C(C)C	ZINC000466634122	331401162	/nfs/dbraw/zinc/40/11/62/331401162.db2.gz	JAVPURKWYYSBPL-OAHLLOKOSA-N	0	0	279.811	4.114	20	30		CIEDRN
C=CCCN(C)C(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1Cl	ZINC000466641289	331401290	/nfs/dbraw/zinc/40/12/90/331401290.db2.gz	SEGAKALPCRBRBA-NEPJUHHUSA-N	0	0	298.213	4.131	20	30		CIEDRN
C=CCCN(C)C(=O)[C@H](C)c1ccc(Cl)c(Cl)c1	ZINC000466643352	331401381	/nfs/dbraw/zinc/40/13/81/331401381.db2.gz	WJQBUKLRGPVVPW-SNVBAGLBSA-N	0	0	286.202	4.131	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccc(C(=O)C(C)(C)C)cc1	ZINC000466647367	331401589	/nfs/dbraw/zinc/40/15/89/331401589.db2.gz	HPVDODGCZGNUPL-UHFFFAOYSA-N	0	0	285.387	4.048	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCCCCC1CCCC1	ZINC000466652009	331401698	/nfs/dbraw/zinc/40/16/98/331401698.db2.gz	RQFBAKNCGPBESJ-CQSZACIVSA-N	0	0	251.414	4.065	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)CC(C)(C)c1ccc(C)cc1	ZINC000466656948	331401941	/nfs/dbraw/zinc/40/19/41/331401941.db2.gz	XWKGAUXJOSWQPE-INIZCTEOSA-N	0	0	287.447	4.333	20	30		CIEDRN
C[C@@H]1CCC[C@@H]1CNC(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000466700786	331402543	/nfs/dbraw/zinc/40/25/43/331402543.db2.gz	VVSMCBBFPRHPHL-ZIAGYGMSSA-N	0	0	299.418	4.045	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(F)c(C2CC2)c1	ZINC000466759336	331404249	/nfs/dbraw/zinc/40/42/49/331404249.db2.gz	VLOTVOHOEZSSNX-LLVKDONJSA-N	0	0	261.340	4.244	20	30		CIEDRN
CC(C)C[C@H]1CCCCN1c1ncc(C#N)cc1Cl	ZINC000466824127	331405702	/nfs/dbraw/zinc/40/57/02/331405702.db2.gz	SKTIROMEVXIIMM-CYBMUJFWSA-N	0	0	277.799	4.012	20	30		CIEDRN
CC#CCCCC(=O)N(C)[C@H]1CCC[C@H]1c1ccc(C)cc1	ZINC000466862978	331406698	/nfs/dbraw/zinc/40/66/98/331406698.db2.gz	XNQRQYFDCZOLNJ-OALUTQOASA-N	0	0	297.442	4.283	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000466863251	331406709	/nfs/dbraw/zinc/40/67/09/331406709.db2.gz	NCGYYBIWSDDUCU-JTQLQIEISA-N	0	0	296.292	4.118	20	30		CIEDRN
CC#CCCCC(=O)N1c2ccccc2S[C@@H](C)[C@H]1C	ZINC000466872097	331406920	/nfs/dbraw/zinc/40/69/20/331406920.db2.gz	VQLXWGADUHVNCC-KGLIPLIRSA-N	0	0	287.428	4.096	20	30		CIEDRN
CC#CCCCC(=O)N1c2ccccc2S[C@H](C)[C@@H]1C	ZINC000466872099	331406958	/nfs/dbraw/zinc/40/69/58/331406958.db2.gz	VQLXWGADUHVNCC-UONOGXRCSA-N	0	0	287.428	4.096	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1C[C@H](C)CSc2ccccc21	ZINC000466878205	331407072	/nfs/dbraw/zinc/40/70/72/331407072.db2.gz	QFMBEXBBCSDLNA-UONOGXRCSA-N	0	0	289.444	4.364	20	30		CIEDRN
C=CCCN(C)C(=O)N[C@H](CC(C)C)c1cccs1	ZINC000466984411	331409670	/nfs/dbraw/zinc/40/96/70/331409670.db2.gz	ZLEBWZMFBFDSTE-CYBMUJFWSA-N	0	0	280.437	4.053	20	30		CIEDRN
C=CCCN(C)C(=O)N[C@H](CC)c1cccc(Cl)c1	ZINC000466984121	331409673	/nfs/dbraw/zinc/40/96/73/331409673.db2.gz	XVCKKKPUFWBNNB-CQSZACIVSA-N	0	0	280.799	4.009	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H](CC)c1cccs1	ZINC000467349231	331415747	/nfs/dbraw/zinc/41/57/47/331415747.db2.gz	WFHBNUQTGQONLH-CYBMUJFWSA-N	0	0	263.406	4.084	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H](C)c1cc(C)cc(C)c1	ZINC000467350237	331415795	/nfs/dbraw/zinc/41/57/95/331415795.db2.gz	OHZHCUZSDAWGJS-HNNXBMFYSA-N	0	0	271.404	4.249	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H]1CCC[C@H]1CCCC	ZINC000467360652	331416283	/nfs/dbraw/zinc/41/62/83/331416283.db2.gz	YXQZAUFNPNMFHN-ZBFHGGJFSA-N	0	0	263.425	4.230	20	30		CIEDRN
CC(C)[C@H](Nc1ccc(C#N)nc1)c1ccc(F)cc1F	ZINC000467449443	331419918	/nfs/dbraw/zinc/41/99/18/331419918.db2.gz	JUKAQTOUDARIIM-INIZCTEOSA-N	0	0	287.313	4.041	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC=C)CCc1ccccc1	ZINC000467817846	331424385	/nfs/dbraw/zinc/42/43/85/331424385.db2.gz	SKIXMIWZMGXETH-UHFFFAOYSA-N	0	0	283.415	4.012	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC)c1cccc(C)c1C	ZINC000467818235	331424394	/nfs/dbraw/zinc/42/43/94/331424394.db2.gz	YHZLTGLLBOBYLX-UHFFFAOYSA-N	0	0	271.404	4.425	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H]1CCCC[C@@H]1C(C)C	ZINC000467838457	331424441	/nfs/dbraw/zinc/42/44/41/331424441.db2.gz	IWLKDDTUDNHQGZ-CVEARBPZSA-N	0	0	263.425	4.086	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H]1CCCC[C@@H]1C(C)C	ZINC000467838459	331424483	/nfs/dbraw/zinc/42/44/83/331424483.db2.gz	IWLKDDTUDNHQGZ-HZPDHXFCSA-N	0	0	263.425	4.086	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N(C)CCc1cccc2ccccc21	ZINC000467842263	331424660	/nfs/dbraw/zinc/42/46/60/331424660.db2.gz	CXAGMZGFJSABOZ-HXUWFJFHSA-N	0	0	295.426	4.443	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H]1CC[C@H](Cc2ccccc2)C1	ZINC000467879437	331425065	/nfs/dbraw/zinc/42/50/65/331425065.db2.gz	WOAYTJLIQKXVNJ-ZIFCJYIRSA-N	0	0	285.431	4.116	20	30		CIEDRN
C=CCOc1ccc(C(=O)Nc2ccc3ccoc3c2)cc1	ZINC000467900471	331425455	/nfs/dbraw/zinc/42/54/55/331425455.db2.gz	LENZIPFWQSIFQV-UHFFFAOYSA-N	0	0	293.322	4.250	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(OC2CCC2)c(F)c1	ZINC000467959415	331426018	/nfs/dbraw/zinc/42/60/18/331426018.db2.gz	OBMSUXAWTMGHGW-QGZVFWFLSA-N	0	0	291.366	4.298	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)NCc1ccc(C)cc1OC(C)C	ZINC000467974740	331426220	/nfs/dbraw/zinc/42/62/20/331426220.db2.gz	WMLRQVAJERYMHB-GOSISDBHSA-N	0	0	289.419	4.001	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@H]1CC(C)(C)c2ccccc21	ZINC000467987062	331426299	/nfs/dbraw/zinc/42/62/99/331426299.db2.gz	YMXPZMNSOWEYKW-YJBOKZPZSA-N	0	0	271.404	4.128	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@@H](C)C(C)(C)c1ccccc1	ZINC000468006981	331426627	/nfs/dbraw/zinc/42/66/27/331426627.db2.gz	SUXMJJDPXZUXAO-KSSFIOAISA-N	0	0	273.420	4.071	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(Oc2ccccn2)cc1	ZINC000468020413	331426723	/nfs/dbraw/zinc/42/67/23/331426723.db2.gz	NOCBMMYHXBIYSZ-GOSISDBHSA-N	0	0	296.370	4.415	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H](CCC)Cc1ccccc1	ZINC000468026336	331426802	/nfs/dbraw/zinc/42/68/02/331426802.db2.gz	NLLWIRJNLYIYET-FUHWJXTLSA-N	0	0	273.420	4.116	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@H](CCC)Cc1ccccc1	ZINC000468026335	331426827	/nfs/dbraw/zinc/42/68/27/331426827.db2.gz	NLLWIRJNLYIYET-AEFFLSMTSA-N	0	0	273.420	4.116	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(-c2ccccc2)cn1	ZINC000468023539	331426836	/nfs/dbraw/zinc/42/68/36/331426836.db2.gz	ZKGOOIYZIPZUKP-GOSISDBHSA-N	0	0	280.371	4.289	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N(C)C1CCCCC1	ZINC000468262444	331431372	/nfs/dbraw/zinc/43/13/72/331431372.db2.gz	UAVKIBMRCDGTBF-UHFFFAOYSA-N	0	0	289.444	4.369	20	30		CIEDRN
CCc1ccc([C@@H](NC(=O)CC(C)(C)C#N)C(C)C)cc1	ZINC000498271780	331433436	/nfs/dbraw/zinc/43/34/36/331433436.db2.gz	JKPQOBWFBIVSGY-KRWDZBQOSA-N	0	0	286.419	4.002	20	30		CIEDRN
C=CCCCNC(=O)c1cccc(N[C@H](C)C(C)C)c1C	ZINC000468389887	331433510	/nfs/dbraw/zinc/43/35/10/331433510.db2.gz	NORLTPWYTFRKTI-OAHLLOKOSA-N	0	0	288.435	4.147	20	30		CIEDRN
C=CCCCNC(=O)CCCSc1ccc(Cl)cc1	ZINC000468394596	331433813	/nfs/dbraw/zinc/43/38/13/331433813.db2.gz	HYDDKSCJMPDKHX-UHFFFAOYSA-N	0	0	297.851	4.295	20	30		CIEDRN
Cc1cc2c(ccc(OCc3ccccc3C#N)c2F)[nH]1	ZINC000468400969	331434180	/nfs/dbraw/zinc/43/41/80/331434180.db2.gz	HMOMWPWWOYYDAA-UHFFFAOYSA-N	0	0	280.302	4.066	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCCc2cccc(Cl)c21	ZINC000468713467	331439022	/nfs/dbraw/zinc/43/90/22/331439022.db2.gz	CQUUQGGEPDZHHS-UHFFFAOYSA-N	0	0	289.806	4.388	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CC[C@@](C)(c2ccc(C)cc2)C1	ZINC000468942433	331442689	/nfs/dbraw/zinc/44/26/89/331442689.db2.gz	JEZDIBZGPSNDNQ-RTBURBONSA-N	0	0	285.431	4.087	20	30		CIEDRN
Cc1ccc(C#N)cc1OCc1cc(-c2cccs2)on1	ZINC000469012521	331444171	/nfs/dbraw/zinc/44/41/71/331444171.db2.gz	PRWPVZRQHKXDSY-UHFFFAOYSA-N	0	0	296.351	4.162	20	30		CIEDRN
C=CCCCCCN(C)C(=O)C[C@H]1CC[C@@H](C)C1	ZINC000469135237	331444573	/nfs/dbraw/zinc/44/45/73/331444573.db2.gz	QBTAPWCHNLDMDM-CABCVRRESA-N	0	0	251.414	4.018	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1ccccc1CSCC	ZINC000469307195	331449410	/nfs/dbraw/zinc/44/94/10/331449410.db2.gz	WTUWCTXTFJOUFH-AWEZNQCLSA-N	0	0	291.460	4.414	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1cccc(Cl)c1C	ZINC000469748813	331456798	/nfs/dbraw/zinc/45/67/98/331456798.db2.gz	OCQHSWNOUXKCGR-LLVKDONJSA-N	0	0	265.784	4.123	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N(C)Cc1ccc(F)c(Cl)c1	ZINC000470017493	331469883	/nfs/dbraw/zinc/46/98/83/331469883.db2.gz	JCOAPJKYHXQPKY-OAHLLOKOSA-N	0	0	283.774	4.040	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N(C)Cc1cc(Cl)ccc1F	ZINC000470113653	331472002	/nfs/dbraw/zinc/47/20/02/331472002.db2.gz	ZYRXZWXHPMMRRA-HNNXBMFYSA-N	0	0	283.774	4.040	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)Cc1cc(Cl)ccc1F	ZINC000470108410	331472117	/nfs/dbraw/zinc/47/21/17/331472117.db2.gz	XIXCKBGHSVVTTL-UHFFFAOYSA-N	0	0	295.785	4.206	20	30		CIEDRN
CCC[C@@H](C)C(=O)NC1(C#N)CCC(C(C)(C)C)CC1	ZINC000470184553	331474611	/nfs/dbraw/zinc/47/46/11/331474611.db2.gz	HDCLPSALOPKDLM-TUBUQKNSSA-N	0	0	278.440	4.037	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)c2ccc3cc[nH]c3c2)CCCC1(C)C	ZINC000470266207	331476952	/nfs/dbraw/zinc/47/69/52/331476952.db2.gz	JGFPGJCOTKUWAB-KRWDZBQOSA-N	0	0	296.414	4.375	20	30		CIEDRN
N#Cc1cnccc1/C=C\c1ccc(Cl)cc1Cl	ZINC000470278464	331477567	/nfs/dbraw/zinc/47/75/67/331477567.db2.gz	FIQOVUPJGMQVIU-UPHRSURJSA-N	0	0	275.138	4.430	20	30		CIEDRN
CCCCOc1ccc(/C=C\c2ccncc2C#N)cc1	ZINC000470281101	331477698	/nfs/dbraw/zinc/47/76/98/331477698.db2.gz	UNVZPCSRNHFTBL-DAXSKMNVSA-N	0	0	278.355	4.303	20	30		CIEDRN
N#Cc1cnccc1/C=C\c1ccc2ccccc2c1	ZINC000470284970	331477882	/nfs/dbraw/zinc/47/78/82/331477882.db2.gz	SQPIVELIALQAHP-VURMDHGXSA-N	0	0	256.308	4.277	20	30		CIEDRN
COc1ccc2cc(/C=C/c3ccncc3C#N)ccc2c1	ZINC000470289813	331478144	/nfs/dbraw/zinc/47/81/44/331478144.db2.gz	OBFUBTLNZRYUMD-DUXPYHPUSA-N	0	0	286.334	4.285	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)c2ccc(C)cc2)CCCC1(C)C	ZINC000470291871	331478391	/nfs/dbraw/zinc/47/83/91/331478391.db2.gz	HXYGGXYNMPALLB-INIZCTEOSA-N	0	0	271.404	4.202	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCCC(C)(C)[C@H]1CC=C	ZINC000470299583	331478640	/nfs/dbraw/zinc/47/86/40/331478640.db2.gz	RMPVNZLFTAZDRX-MRXNPFEDSA-N	0	0	275.436	4.348	20	30		CIEDRN
C=CCC[C@@H](C(=O)NCc1cscc1C)c1ccccc1	ZINC000470463151	331483201	/nfs/dbraw/zinc/48/32/01/331483201.db2.gz	GUIJWMJUHFCQKU-QGZVFWFLSA-N	0	0	299.439	4.423	20	30		CIEDRN
C=CCC1(C(=O)N[C@H](C)CC2CCCCC2)CCC1	ZINC000470467127	331483229	/nfs/dbraw/zinc/48/32/29/331483229.db2.gz	NZVCQQDPADVMMQ-CQSZACIVSA-N	0	0	263.425	4.208	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](c2ccc(C)cc2)C[C@@H]1C	ZINC000470563093	331485484	/nfs/dbraw/zinc/48/54/84/331485484.db2.gz	FYTFCCRMAAEQNP-BQFCYCMXSA-N	0	0	285.431	4.302	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)[C@H]1C[C@@]1(C)CC	ZINC000470647136	331486725	/nfs/dbraw/zinc/48/67/25/331486725.db2.gz	QYMHMNLCJJVXJE-SJLPKXTDSA-N	0	0	271.404	4.028	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)CCC(C)C	ZINC000470648720	331486846	/nfs/dbraw/zinc/48/68/46/331486846.db2.gz	GUSDFVRLSDFQRO-UHFFFAOYSA-N	0	0	259.393	4.028	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)C1CCCCC1	ZINC000470647574	331486884	/nfs/dbraw/zinc/48/68/84/331486884.db2.gz	YFLRDIYKLMRBCZ-UHFFFAOYSA-N	0	0	271.404	4.172	20	30		CIEDRN
CCCC1(C(=O)Nc2sc3c(c2C#N)CCCC3)CC1	ZINC000471100414	331501404	/nfs/dbraw/zinc/50/14/04/331501404.db2.gz	RUQZXLCJVACVHU-UHFFFAOYSA-N	0	0	288.416	4.017	20	30		CIEDRN
CCCC1(C(=O)N(Cc2ccc(C#N)cc2)CC(C)C)CC1	ZINC000471153754	331502592	/nfs/dbraw/zinc/50/25/92/331502592.db2.gz	YMHJLMHBDZKWDN-UHFFFAOYSA-N	0	0	298.430	4.123	20	30		CIEDRN
CCC(CC)N(C(=O)CC(C)(C)C#N)c1cccc(C)c1	ZINC000471432272	331508338	/nfs/dbraw/zinc/50/83/38/331508338.db2.gz	RRXTZWMSEBXYAF-UHFFFAOYSA-N	0	0	286.419	4.457	20	30		CIEDRN
C=CCCCCNC(=O)[C@H](C)CCCc1ccccc1	ZINC000471668457	331514683	/nfs/dbraw/zinc/51/46/83/331514683.db2.gz	QZXPCQWANOZBOZ-MRXNPFEDSA-N	0	0	273.420	4.118	20	30		CIEDRN
C=CCCCCNC(=O)c1ccccc1SC(C)C	ZINC000471674073	331514814	/nfs/dbraw/zinc/51/48/14/331514814.db2.gz	OHOOLSWPUVPZPA-UHFFFAOYSA-N	0	0	277.433	4.273	20	30		CIEDRN
C=CCCCCNC(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1	ZINC000471699864	331516442	/nfs/dbraw/zinc/51/64/42/331516442.db2.gz	DGQKHPISXHNLIB-RBUKOAKNSA-N	0	0	293.410	4.416	20	30		CIEDRN
C=CCCCCNC(=O)CCc1ccc2ccccc2c1	ZINC000471701372	331516538	/nfs/dbraw/zinc/51/65/38/331516538.db2.gz	OQHKZRVOJNVXEQ-UHFFFAOYSA-N	0	0	281.399	4.245	20	30		CIEDRN
C=CCCCCNC(=O)c1ccccc1CCC(F)(F)F	ZINC000471710471	331517370	/nfs/dbraw/zinc/51/73/70/331517370.db2.gz	BKJIAXDKVZWPQS-UHFFFAOYSA-N	0	0	299.336	4.268	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)N[C@H](C)[C@H](C)CC	ZINC000471736169	331518678	/nfs/dbraw/zinc/51/86/78/331518678.db2.gz	JVLSLLWHCFYJPM-HZPDHXFCSA-N	0	0	288.435	4.209	20	30		CIEDRN
CCN(Cc1ccc(C#N)s1)c1ccc2[nH]ccc2c1	ZINC000471805774	331521354	/nfs/dbraw/zinc/52/13/54/331521354.db2.gz	STYZMEIFJTXNDD-UHFFFAOYSA-N	0	0	281.384	4.128	20	30		CIEDRN
N#CCCCOc1cccc(N[C@@H]2CC[C@H]2C2CCC2)c1	ZINC000510739727	332914436	/nfs/dbraw/zinc/91/44/36/332914436.db2.gz	YDCAHJQARLBHJF-ZWKOTPCHSA-N	0	0	284.403	4.360	20	30		CIEDRN
C=C(C)CNC(=O)Nc1c(CCC)cccc1C(C)C	ZINC000471879159	331523116	/nfs/dbraw/zinc/52/31/16/331523116.db2.gz	ZJVUTDOKLOJNPN-UHFFFAOYSA-N	0	0	274.408	4.460	20	30		CIEDRN
Cc1cc2c(ccc(OCc3ccc(CC#N)cc3)c2F)[nH]1	ZINC000471889244	331523454	/nfs/dbraw/zinc/52/34/54/331523454.db2.gz	WHWXXKZPFIWMSF-UHFFFAOYSA-N	0	0	294.329	4.261	20	30		CIEDRN
N#CCCCOc1cccc(N[C@H]2CC[C@@H]2C2CCC2)c1	ZINC000510739724	332914469	/nfs/dbraw/zinc/91/44/69/332914469.db2.gz	YDCAHJQARLBHJF-MSOLQXFVSA-N	0	0	284.403	4.360	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1cc(C)oc1C(F)(F)F	ZINC000472397435	331536449	/nfs/dbraw/zinc/53/64/49/331536449.db2.gz	NPAAMMBEQPYECV-SECBINFHSA-N	0	0	289.297	4.081	20	30		CIEDRN
COc1cccc(N(CCCC(C)(C)C#N)CC(C)C)c1	ZINC000472442172	331536926	/nfs/dbraw/zinc/53/69/26/331536926.db2.gz	JBKBSPIHYGAKTR-UHFFFAOYSA-N	0	0	288.435	4.488	20	30		CIEDRN
C=CCCCC(=O)Nc1nn([C@H](C)c2ccccc2)cc1C	ZINC000472855408	331544650	/nfs/dbraw/zinc/54/46/50/331544650.db2.gz	HPFHCQWVOMRKDH-OAHLLOKOSA-N	0	0	297.402	4.096	20	30		CIEDRN
C[C@@H](CCSc1ccc(C#N)cn1)OCc1ccccc1	ZINC000473670620	331555350	/nfs/dbraw/zinc/55/53/50/331555350.db2.gz	QHPVPQWIFANXPF-AWEZNQCLSA-N	0	0	298.411	4.041	20	30		CIEDRN
COc1c(CNc2cccc(F)c2C#N)oc2ccccc21	ZINC000473720043	331556102	/nfs/dbraw/zinc/55/61/02/331556102.db2.gz	HLLOBWGQYWMKOW-UHFFFAOYSA-N	0	0	296.301	4.064	20	30		CIEDRN
COc1c(CNc2ccc(C#N)cc2F)oc2ccccc21	ZINC000473722117	331556128	/nfs/dbraw/zinc/55/61/28/331556128.db2.gz	DAEOSEGBGTZKEB-UHFFFAOYSA-N	0	0	296.301	4.064	20	30		CIEDRN
CC(C)COc1ccccc1CNc1ccc(C#N)cc1F	ZINC000303180905	332916423	/nfs/dbraw/zinc/91/64/23/332916423.db2.gz	XGDGZXDQQVYUAE-UHFFFAOYSA-N	0	0	298.361	4.344	20	30		CIEDRN
C=CCCCCNC(=O)N[C@H](c1ccco1)c1ccccc1	ZINC000473898397	331559895	/nfs/dbraw/zinc/55/98/95/331559895.db2.gz	SNNIUYMZUAILNB-KRWDZBQOSA-N	0	0	298.386	4.025	20	30		CIEDRN
Cc1ccc(NC(=O)C[C@@H](CC#N)c2ccccc2)c(C)c1	ZINC000474081390	331568751	/nfs/dbraw/zinc/56/87/51/331568751.db2.gz	OXOWHGXTHRXNMM-QGZVFWFLSA-N	0	0	292.382	4.330	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CCCCC(C)(C)C1)c1ccccc1	ZINC000474107353	331571408	/nfs/dbraw/zinc/57/14/08/331571408.db2.gz	YAFLIUMHYMDOKZ-INIZCTEOSA-N	0	0	285.431	4.385	20	30		CIEDRN
C=CCCC(=O)N[C@@H]1CCC[C@@H](C(C)(C)C)CC1	ZINC000474275937	331578503	/nfs/dbraw/zinc/57/85/03/331578503.db2.gz	QDCZBPCQDRUKAU-ZIAGYGMSSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H]1CC[C@@H](Cc2ccccc2)C1	ZINC000474327685	331580379	/nfs/dbraw/zinc/58/03/79/331580379.db2.gz	JMULCSRROBUNBJ-SZMVWBNQSA-N	0	0	285.431	4.116	20	30		CIEDRN
C=CCCCCNC(=O)c1occc1-c1ccc(F)cc1	ZINC000474590134	331590750	/nfs/dbraw/zinc/59/07/50/331590750.db2.gz	ZXWLULREOWEQHK-UHFFFAOYSA-N	0	0	287.334	4.172	20	30		CIEDRN
CC[C@@H]1CCCC[C@H]1NC(=O)C[C@H](CC#N)c1ccccc1	ZINC000474785900	331598185	/nfs/dbraw/zinc/59/81/85/331598185.db2.gz	WBCWEBJSEMCDSL-BPQIPLTHSA-N	0	0	298.430	4.159	20	30		CIEDRN
C=CCCC1(C(=O)NCCc2cccc3ccccc32)CC1	ZINC000474876836	331602273	/nfs/dbraw/zinc/60/22/73/331602273.db2.gz	XBYJPZFFHCFNJO-UHFFFAOYSA-N	0	0	293.410	4.245	20	30		CIEDRN
C=C(C)[C@H](NCc1cnccc1C)c1ccc(F)c(F)c1	ZINC000474929002	331604615	/nfs/dbraw/zinc/60/46/15/331604615.db2.gz	OAXMSVWFLZRUNM-KRWDZBQOSA-N	0	0	288.341	4.075	20	30		CIEDRN
C[C@H]1CCCC[C@@H]1CNC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000475177148	331616945	/nfs/dbraw/zinc/61/69/45/331616945.db2.gz	YBTQFVDMBLWQLZ-GOEBONIOSA-N	0	0	298.430	4.044	20	30		CIEDRN
C[C@@H](CC(C)(C)C)C(=O)N(Cc1ccc(C#N)cc1)C1CC1	ZINC000475338764	331627601	/nfs/dbraw/zinc/62/76/01/331627601.db2.gz	SNYVLKFYMXQUNH-AWEZNQCLSA-N	0	0	298.430	4.122	20	30		CIEDRN
C=CCC[C@@H](CC)Nc1cccc(-n2cc(C)[nH]c2=O)c1	ZINC000475510916	331634724	/nfs/dbraw/zinc/63/47/24/331634724.db2.gz	KEIPQWLJTAPRGE-CQSZACIVSA-N	0	0	285.391	4.043	20	30		CIEDRN
C=CCCC1(C(=O)N2CC3(CCC3)c3c2cccc3F)CC1	ZINC000475528116	331635698	/nfs/dbraw/zinc/63/56/98/331635698.db2.gz	ODWLWLYSCXUTFA-UHFFFAOYSA-N	0	0	299.389	4.340	20	30		CIEDRN
CC[C@H](NC(=O)C[C@@H](CC#N)c1ccccc1)C(C)(C)C	ZINC000475647625	331640216	/nfs/dbraw/zinc/64/02/16/331640216.db2.gz	FNPJJCGGTIZIPK-CVEARBPZSA-N	0	0	286.419	4.015	20	30		CIEDRN
C=CCCCC(=O)N(C)[C@@H]1CCC[C@@H]1c1ccc(C)cc1	ZINC000475653342	331640246	/nfs/dbraw/zinc/64/02/46/331640246.db2.gz	VKPZAEVIKXQOLC-QZTJIDSGSA-N	0	0	285.431	4.446	20	30		CIEDRN
CC[C@H](NC(=O)C[C@H](CC#N)c1ccccc1)C(C)(C)C	ZINC000475647626	331640324	/nfs/dbraw/zinc/64/03/24/331640324.db2.gz	FNPJJCGGTIZIPK-HOTGVXAUSA-N	0	0	286.419	4.015	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCC(C)(C)C1=CCCCC1	ZINC000475673180	331641304	/nfs/dbraw/zinc/64/13/04/331641304.db2.gz	GNUHQIVWTUAPCM-AWEZNQCLSA-N	0	0	263.425	4.232	20	30		CIEDRN
N#Cc1cccnc1SCCCCc1ccccc1	ZINC000475742803	331644536	/nfs/dbraw/zinc/64/45/36/331644536.db2.gz	BPLMEUVJHBOXPQ-UHFFFAOYSA-N	0	0	268.385	4.068	20	30		CIEDRN
C=CCCC1(C(=O)N(C)c2ccc(SC)cc2)CC1	ZINC000475901839	331648190	/nfs/dbraw/zinc/64/81/90/331648190.db2.gz	QCKQTIHLKUQDCB-UHFFFAOYSA-N	0	0	275.417	4.118	20	30		CIEDRN
N#Cc1ccc(OCc2cccc(C(F)F)c2)c(F)c1	ZINC000475899313	331648253	/nfs/dbraw/zinc/64/82/53/331648253.db2.gz	PXWBJNVYHXODFL-UHFFFAOYSA-N	0	0	277.245	4.214	20	30		CIEDRN
C=CCOCCCSCc1cccc(Cl)c1	ZINC000475988579	331650808	/nfs/dbraw/zinc/65/08/08/331650808.db2.gz	YRXMMJLJSAXKSD-UHFFFAOYSA-N	0	0	256.798	4.166	20	30		CIEDRN
C=CCCC1(C(=O)N2C[C@@H](c3ccccc3C)C[C@H]2C)CC1	ZINC000476088562	331654448	/nfs/dbraw/zinc/65/44/48/331654448.db2.gz	CWWRBYVBPIHARB-SJORKVTESA-N	0	0	297.442	4.446	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1[C@@H](C)C1(F)F	ZINC000476141313	331656168	/nfs/dbraw/zinc/65/61/68/331656168.db2.gz	JHFYSPQPWDSBLY-BXUZGUMPSA-N	0	0	293.357	4.378	20	30		CIEDRN
C[C@@H](NC(=O)C[C@@H](CC#N)c1ccccc1)C1CCCCC1	ZINC000476169186	331656557	/nfs/dbraw/zinc/65/65/57/331656557.db2.gz	VYWLXJAZSWONBM-CRAIPNDOSA-N	0	0	298.430	4.159	20	30		CIEDRN
Cc1cc(F)cc(NC(=O)c2ccc(C(C)(C)C#N)cc2)c1	ZINC000476403575	331663528	/nfs/dbraw/zinc/66/35/28/331663528.db2.gz	VKXMWNDHQBLYKB-UHFFFAOYSA-N	0	0	296.345	4.188	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)Nc1ccsc1	ZINC000476486346	331665059	/nfs/dbraw/zinc/66/50/59/331665059.db2.gz	HCGYIGOUXRGHPE-UHFFFAOYSA-N	0	0	278.421	4.348	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(-c3ccc[nH]3)cc2)CC1	ZINC000476604806	331667075	/nfs/dbraw/zinc/66/70/75/331667075.db2.gz	NEXDVFJQBYKLMM-UHFFFAOYSA-N	0	0	280.371	4.367	20	30		CIEDRN
C=CCCC1(C(=O)NCC(C)(C)C2=CCCCC2)CC1	ZINC000476760475	331669506	/nfs/dbraw/zinc/66/95/06/331669506.db2.gz	YSQXBPIXYCRPIL-UHFFFAOYSA-N	0	0	275.436	4.376	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N1C[C@@H](C)c2ccccc21	ZINC000476785902	331669774	/nfs/dbraw/zinc/66/97/74/331669774.db2.gz	CYTFNLRWCSGBRK-CYBMUJFWSA-N	0	0	291.354	4.022	20	30		CIEDRN
C=C(C)CSCC(=O)Nc1ccc(Cl)c(Cl)c1	ZINC000476997779	331672354	/nfs/dbraw/zinc/67/23/54/331672354.db2.gz	CPKBAMIBOWBDHS-UHFFFAOYSA-N	0	0	290.215	4.241	20	30		CIEDRN
C=C(C)CS[C@H](C)C(=O)N[C@@H](CCC)c1ccccc1	ZINC000477023387	331672924	/nfs/dbraw/zinc/67/29/24/331672924.db2.gz	XASZASKEYPIATG-ZBFHGGJFSA-N	0	0	291.460	4.342	20	30		CIEDRN
N#Cc1ccc(N[C@H]2CC=C(c3ccc(F)cc3)CC2)cn1	ZINC000477065887	331674925	/nfs/dbraw/zinc/67/49/25/331674925.db2.gz	DJCDMBNUSPXWSS-INIZCTEOSA-N	0	0	293.345	4.140	20	30		CIEDRN
N#Cc1cccc(N[C@@H](CC2CCC2)c2ccccc2)n1	ZINC000477083576	331675672	/nfs/dbraw/zinc/67/56/72/331675672.db2.gz	KQOPXIQSOSKJKJ-KRWDZBQOSA-N	0	0	277.371	4.297	20	30		CIEDRN
C=CCCC1(C(=O)N(C)C/C(C)=C/c2ccccc2)CC1	ZINC000477104132	331676624	/nfs/dbraw/zinc/67/66/24/331676624.db2.gz	WHHUYVNZDULVLK-JQIJEIRASA-N	0	0	283.415	4.295	20	30		CIEDRN
C=CCOc1ccc(OCc2ccn(C3CCCC3)n2)cc1	ZINC000477353167	331682458	/nfs/dbraw/zinc/68/24/58/331682458.db2.gz	NNWOFNHWLLWWOQ-UHFFFAOYSA-N	0	0	298.386	4.142	20	30		CIEDRN
N#Cc1ccccc1SCc1ccn(C2CCCC2)n1	ZINC000477531579	331686380	/nfs/dbraw/zinc/68/63/80/331686380.db2.gz	VJZLIFLCEKJKMB-UHFFFAOYSA-N	0	0	283.400	4.162	20	30		CIEDRN
N#Cc1ccc(Oc2cccc(NCC3CC3)c2)cc1	ZINC000477618517	331687592	/nfs/dbraw/zinc/68/75/92/331687592.db2.gz	PPYIGWKQBFRARC-UHFFFAOYSA-N	0	0	264.328	4.172	20	30		CIEDRN
CC(C)(C)CN(CCC#N)C(=O)CCC1CCCCC1	ZINC000477777776	331690544	/nfs/dbraw/zinc/69/05/44/331690544.db2.gz	SUNOFSRDQDQMKU-UHFFFAOYSA-N	0	0	278.440	4.135	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1nc2cc(F)c(C)cc2s1	ZINC000478067315	331697135	/nfs/dbraw/zinc/69/71/35/331697135.db2.gz	OXJLKQKTEZVOKT-JTQLQIEISA-N	0	0	292.379	4.285	20	30		CIEDRN
C=CCC(CC=C)C(=O)NC1CCC(C(C)C)CC1	ZINC000478296593	331703118	/nfs/dbraw/zinc/70/31/18/331703118.db2.gz	HKUBTKCLDBABBN-UHFFFAOYSA-N	0	0	263.425	4.086	20	30		CIEDRN
Cc1cc(NCc2cccc(C#N)c2F)ccc1C1CC1	ZINC000478345563	331704411	/nfs/dbraw/zinc/70/44/11/331704411.db2.gz	RATQLHFUMHNOJZ-UHFFFAOYSA-N	0	0	280.346	4.495	20	30		CIEDRN
C=CCOc1ccc(/C=C(\C)c2cnccn2)cc1Cl	ZINC000478351795	331704654	/nfs/dbraw/zinc/70/46/54/331704654.db2.gz	UAEVLALSTMOSOP-FMIVXFBMSA-N	0	0	286.762	4.255	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(Cl)c(F)c2)CCC1	ZINC000478669520	331711438	/nfs/dbraw/zinc/71/14/38/331711438.db2.gz	HRESZMZJZHHALI-UHFFFAOYSA-N	0	0	267.731	4.164	20	30		CIEDRN
N#Cc1ccc(CSCCC(F)(F)F)c(Cl)c1	ZINC000478755205	331713479	/nfs/dbraw/zinc/71/34/79/331713479.db2.gz	MCBMAYZHJGKDIP-UHFFFAOYSA-N	0	0	279.714	4.397	20	30		CIEDRN
C[C@@H](Oc1cccc(Cl)c1F)c1cccc(C#N)c1	ZINC000478792649	331714254	/nfs/dbraw/zinc/71/42/54/331714254.db2.gz	AWUHTEANPUABKA-SNVBAGLBSA-N	0	0	275.710	4.491	20	30		CIEDRN
CCC(CC)CN(CCC#N)C(=O)[C@@H](C)CC1CCCC1	ZINC000511123663	332927372	/nfs/dbraw/zinc/92/73/72/332927372.db2.gz	UGMMEDCQKGSHJW-HNNXBMFYSA-N	0	0	292.467	4.381	20	30		CIEDRN
N#Cc1cc(Cl)ccc1Cn1ccc(-c2cccs2)n1	ZINC000478945947	331718061	/nfs/dbraw/zinc/71/80/61/331718061.db2.gz	BEZCAQCWECMDMI-UHFFFAOYSA-N	0	0	299.786	4.185	20	30		CIEDRN
C=CCC1(C(=O)NCc2ccc(C)cc2SC)CCC1	ZINC000479161584	331720969	/nfs/dbraw/zinc/72/09/69/331720969.db2.gz	WAHCFSOPBDVQAH-UHFFFAOYSA-N	0	0	289.444	4.080	20	30		CIEDRN
C=C(C)CN(C)C(=O)[C@H](CCC)CC1CCCC1	ZINC000479244945	331722706	/nfs/dbraw/zinc/72/27/06/331722706.db2.gz	NOVUPLMAKSYKPY-OAHLLOKOSA-N	0	0	251.414	4.018	20	30		CIEDRN
C=CCCCC(=O)Nc1ncc(Cc2ccccc2)s1	ZINC000479504577	331733955	/nfs/dbraw/zinc/73/39/55/331733955.db2.gz	RNGJJSJHADOECZ-UHFFFAOYSA-N	0	0	286.400	4.029	20	30		CIEDRN
N#Cc1ccc(CSCc2cccc(F)c2F)cc1F	ZINC000479514901	331734272	/nfs/dbraw/zinc/73/42/72/331734272.db2.gz	XLCQIZZYBGQGTG-UHFFFAOYSA-N	0	0	293.313	4.409	20	30		CIEDRN
C=CCCCC(=O)N[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F	ZINC000479571430	331738219	/nfs/dbraw/zinc/73/82/19/331738219.db2.gz	SZIUGBRSWNVOGZ-TZMCWYRMSA-N	0	0	297.320	4.034	20	30		CIEDRN
CC(C)C[C@H](C)CC(=O)N(C)c1cc(Cl)ccc1C#N	ZINC000479575060	331738583	/nfs/dbraw/zinc/73/85/83/331738583.db2.gz	QEPODPHEMJZFRV-LBPRGKRZSA-N	0	0	292.810	4.247	20	30		CIEDRN
CN(C(=O)CCCC(C)(C)C)c1cc(Cl)ccc1C#N	ZINC000479581251	331738691	/nfs/dbraw/zinc/73/86/91/331738691.db2.gz	RVXBAKBBOMDACB-UHFFFAOYSA-N	0	0	292.810	4.391	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](c1nc2ccccc2[nH]1)[C@H](C)CC	ZINC000479579652	331738726	/nfs/dbraw/zinc/73/87/26/331738726.db2.gz	OTICVUGRQWZPDF-CXAGYDPISA-N	0	0	299.418	4.123	20	30		CIEDRN
CCC[C@H](C(=O)Nc1ccc(C(C)(C)C#N)cc1)C(C)C	ZINC000479686734	331743469	/nfs/dbraw/zinc/74/34/69/331743469.db2.gz	GBCNBOIJPAJTPE-INIZCTEOSA-N	0	0	286.419	4.499	20	30		CIEDRN
C=CCCCC(=O)N(C)CC(C)(C)c1ccc(C)cc1	ZINC000479855306	331748775	/nfs/dbraw/zinc/74/87/75/331748775.db2.gz	YXUDTYMIRNOWJH-UHFFFAOYSA-N	0	0	273.420	4.087	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@H](Cc3ccccc3)[C@H]2C)CCC1	ZINC000479869516	331749704	/nfs/dbraw/zinc/74/97/04/331749704.db2.gz	ZDJHAHHJWBEHPW-SJLPKXTDSA-N	0	0	297.442	4.213	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)C[C@H](C)CC)c1	ZINC000480044441	331755571	/nfs/dbraw/zinc/75/55/71/331755571.db2.gz	UNYDHOJVCPVWMR-CYBMUJFWSA-N	0	0	261.365	4.016	20	30		CIEDRN
C=CCCCCCN(C)C(=O)CC(C)(C)C(F)(F)F	ZINC000480090003	331757841	/nfs/dbraw/zinc/75/78/41/331757841.db2.gz	GFLZKQMBKHFZEQ-UHFFFAOYSA-N	0	0	279.346	4.170	20	30		CIEDRN
C=CCC1(C(=O)N[C@H]2CCC[C@H]2c2ccccc2)CCC1	ZINC000480107993	331758334	/nfs/dbraw/zinc/75/83/34/331758334.db2.gz	UGGRIBMNNHZWFS-IRXDYDNUSA-N	0	0	283.415	4.185	20	30		CIEDRN
CC[C@H](C)CC(=O)N[C@@H](C#N)c1c(Cl)cccc1Cl	ZINC000480178033	331761808	/nfs/dbraw/zinc/76/18/08/331761808.db2.gz	HFCDZTZWSQFXOZ-CABZTGNLSA-N	0	0	299.201	4.110	20	30		CIEDRN
C=C[C@@H](CC(=O)NC(C)(C)C(C)(C)C)c1ccccc1	ZINC000480626069	331780698	/nfs/dbraw/zinc/78/06/98/331780698.db2.gz	NCKRKHSRXNVKLF-AWEZNQCLSA-N	0	0	273.420	4.287	20	30		CIEDRN
C[C@H](CC#N)NC(=O)Nc1ccc2c(c1)C(C)(C)CC2(C)C	ZINC000480900673	331790954	/nfs/dbraw/zinc/79/09/54/331790954.db2.gz	RYUNCXJTHGQOHW-GFCCVEGCSA-N	0	0	299.418	4.069	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1ccccc1C(C)(C)C	ZINC000481276015	331802471	/nfs/dbraw/zinc/80/24/71/331802471.db2.gz	AAQORYHDZOHYKM-UHFFFAOYSA-N	0	0	259.393	4.022	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H]1CC[C@@H](c2ccccc2F)C1	ZINC000511237394	332929845	/nfs/dbraw/zinc/92/98/45/332929845.db2.gz	XNCGCAGHEBZWNI-KGLIPLIRSA-N	0	0	289.394	4.180	20	30		CIEDRN
C=CCN(CC=C)C(=O)Nc1ccc(C2CC2)c(C)c1	ZINC000481929141	331818899	/nfs/dbraw/zinc/81/88/99/331818899.db2.gz	WHHFXXZRVHIFNB-UHFFFAOYSA-N	0	0	270.376	4.078	20	30		CIEDRN
C=CC[C@@H](C(=O)N1Cc2ccc(C)cc2C1)c1ccccc1	ZINC000482836971	331848100	/nfs/dbraw/zinc/84/81/00/331848100.db2.gz	OLLHZYDXPYVHOS-LJQANCHMSA-N	0	0	291.394	4.197	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H]1CC[C@H](c2ccccc2F)C1	ZINC000482901275	331851822	/nfs/dbraw/zinc/85/18/22/331851822.db2.gz	UKRAFARDLGBMMI-PMUMKWKESA-N	0	0	289.394	4.180	20	30		CIEDRN
CC(C)(CC(=O)Nc1ccccc1C#N)C1CCCCC1	ZINC000483043746	331856635	/nfs/dbraw/zinc/85/66/35/331856635.db2.gz	GOUACDUGSBJCDB-UHFFFAOYSA-N	0	0	284.403	4.493	20	30		CIEDRN
COc1cccc(CSCc2ccc(F)cc2C#N)c1	ZINC000483153107	331860741	/nfs/dbraw/zinc/86/07/41/331860741.db2.gz	NQSJFJDSHRSPSN-UHFFFAOYSA-N	0	0	287.359	4.139	20	30		CIEDRN
CCCCCN(CCCCC)C(=O)CC(C)(C)C#N	ZINC000483282723	331866993	/nfs/dbraw/zinc/86/69/93/331866993.db2.gz	KQPDMWRVKZSBFC-UHFFFAOYSA-N	0	0	266.429	4.135	20	30		CIEDRN
C=CCCC(=O)NC1(c2cccc(Cl)c2)CCCC1	ZINC000483306761	331868421	/nfs/dbraw/zinc/86/84/21/331868421.db2.gz	FPWZRHPPLOLMCP-UHFFFAOYSA-N	0	0	277.795	4.192	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2	ZINC000511429357	332932095	/nfs/dbraw/zinc/93/20/95/332932095.db2.gz	QJCUJLFGNHEEDL-NRSFXHEJSA-N	0	0	298.430	4.071	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cc(CC)ccc2CC)CC1	ZINC000483735656	331883815	/nfs/dbraw/zinc/88/38/15/331883815.db2.gz	XOOHXNBOWHPKHN-UHFFFAOYSA-N	0	0	271.404	4.496	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)[C@H]1CCCC[C@@H]1CC	ZINC000483842255	331886145	/nfs/dbraw/zinc/88/61/45/331886145.db2.gz	YZULXPQPXCSJFE-GJZGRUSLSA-N	0	0	278.440	4.182	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)[C@@H]1CCCC[C@@H]1CC	ZINC000483842257	331886126	/nfs/dbraw/zinc/88/61/26/331886126.db2.gz	YZULXPQPXCSJFE-LSDHHAIUSA-N	0	0	278.440	4.182	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)[C@H]1CCCC[C@H]1CC	ZINC000483842254	331886180	/nfs/dbraw/zinc/88/61/80/331886180.db2.gz	YZULXPQPXCSJFE-CABCVRRESA-N	0	0	278.440	4.182	20	30		CIEDRN
C[C@@H]1CC(C)(C)CC[C@H]1NC(=O)Nc1ccc(CC#N)cc1	ZINC000483846016	331886421	/nfs/dbraw/zinc/88/64/21/331886421.db2.gz	FIUPCAXEHUSKHO-CZUORRHYSA-N	0	0	299.418	4.089	20	30		CIEDRN
CC(C)C[C@@](C)(C#N)NC(=O)c1ccc(F)c2ccccc12	ZINC000483868792	331887733	/nfs/dbraw/zinc/88/77/33/331887733.db2.gz	HLTNYQTWXREVIZ-SFHVURJKSA-N	0	0	298.361	4.037	20	30		CIEDRN
C=CCN(C(=O)CCc1ccc(C)cc1)c1ccccc1	ZINC000484251258	331894890	/nfs/dbraw/zinc/89/48/90/331894890.db2.gz	FHNSKMHGRFVGSZ-UHFFFAOYSA-N	0	0	279.383	4.147	20	30		CIEDRN
CCN(CC#N)Cc1cc(Cl)ccc1OC1CCCC1	ZINC000511501940	332933435	/nfs/dbraw/zinc/93/34/35/332933435.db2.gz	ALYBSFZUOIHAKD-UHFFFAOYSA-N	0	0	292.810	4.007	20	30		CIEDRN
CC1(C)C[C@]1(C#N)NC(=O)c1ccc(C2CCCCC2)cc1	ZINC000484919357	331907298	/nfs/dbraw/zinc/90/72/98/331907298.db2.gz	NWAYYJKMRTUKJD-LJQANCHMSA-N	0	0	296.414	4.156	20	30		CIEDRN
N#Cc1cccc(Cl)c1NC[C@H]1CCC(F)(F)C1	ZINC000485418376	331913854	/nfs/dbraw/zinc/91/38/54/331913854.db2.gz	UUGCSNLCRJOBKS-VIFPVBQESA-N	0	0	270.710	4.059	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N1C[C@H](C)C[C@H](C)C1	ZINC000485466302	331915019	/nfs/dbraw/zinc/91/50/19/331915019.db2.gz	PLZYJUXEAPAZQX-OKILXGFUSA-N	0	0	289.444	4.083	20	30		CIEDRN
C=CCSc1ccccc1C(=O)NCCC(C)(C)C	ZINC000485471502	331915200	/nfs/dbraw/zinc/91/52/00/331915200.db2.gz	VCRMPTTUHGLWAH-UHFFFAOYSA-N	0	0	277.433	4.131	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N[C@H](C)CC(C)C	ZINC000485512799	331915923	/nfs/dbraw/zinc/91/59/23/331915923.db2.gz	CXIKWLSQBWNXPM-CYBMUJFWSA-N	0	0	277.433	4.129	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N[C@H]1CCC(C)(C)C1	ZINC000485520021	331916049	/nfs/dbraw/zinc/91/60/49/331916049.db2.gz	RNIRLLDUEWUCGM-ZDUSSCGKSA-N	0	0	289.444	4.273	20	30		CIEDRN
C=CCCC(=O)N1C[C@H](c2ccccc2)[C@H]2CCCC[C@H]21	ZINC000485560832	331916828	/nfs/dbraw/zinc/91/68/28/331916828.db2.gz	RBRMLLNKYSGRNW-KZNAEPCWSA-N	0	0	283.415	4.137	20	30		CIEDRN
C=CCCCCCSCc1ccc(C(=O)NC)cc1	ZINC000485580247	331917853	/nfs/dbraw/zinc/91/78/53/331917853.db2.gz	YGRCCCQPLDJRLE-UHFFFAOYSA-N	0	0	277.433	4.026	20	30		CIEDRN
C=CCCCCCSCc1cccc(C(=O)N(C)C)c1	ZINC000485579604	331917866	/nfs/dbraw/zinc/91/78/66/331917866.db2.gz	FODLTOSFSHMAKE-UHFFFAOYSA-N	0	0	291.460	4.368	20	30		CIEDRN
Cc1cccc(CC(=O)Nc2cc(C#N)ccc2C)c1Cl	ZINC000485780689	331923771	/nfs/dbraw/zinc/92/37/71/331923771.db2.gz	GNZGQSTZJHHLKN-UHFFFAOYSA-N	0	0	298.773	4.010	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)c2cccn2C(C)C)c1	ZINC000485821636	331924425	/nfs/dbraw/zinc/92/44/25/331924425.db2.gz	RKLCKRACOCZEGT-UHFFFAOYSA-N	0	0	298.386	4.276	20	30		CIEDRN
N#Cc1cccnc1/C=C/c1ccc(Cl)c(Cl)c1	ZINC000485985765	331928526	/nfs/dbraw/zinc/92/85/26/331928526.db2.gz	ZNHQMUPFHCDSIL-GQCTYLIASA-N	0	0	275.138	4.430	20	30		CIEDRN
COc1cc(C#N)cc(OCc2ccc(C(F)F)cc2)c1	ZINC000486102159	331931517	/nfs/dbraw/zinc/93/15/17/331931517.db2.gz	PPTLFWZCALBQDD-UHFFFAOYSA-N	0	0	289.281	4.083	20	30		CIEDRN
Cc1ccc(/C=C\c2nc3ccccc3n2CC#N)cc1	ZINC000486102421	331931536	/nfs/dbraw/zinc/93/15/36/331931536.db2.gz	JOAZFRCEPDDZFD-KHPPLWFESA-N	0	0	273.339	4.039	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N(C)Cc1ccc(F)cc1C	ZINC000486487212	331938351	/nfs/dbraw/zinc/93/83/51/331938351.db2.gz	LQYCDVANNLMKIJ-CQSZACIVSA-N	0	0	292.398	4.020	20	30		CIEDRN
C=C[C@H]1CCCCN1c1nc(C(F)F)nc2ccccc21	ZINC000486497588	331938741	/nfs/dbraw/zinc/93/87/41/331938741.db2.gz	SYWSTVWUILSKSJ-NSHDSACASA-N	0	0	289.329	4.112	20	30		CIEDRN
CC(C)(C)CN(C(=O)c1cc(C#N)cs1)c1ccccc1	ZINC000486602796	331940410	/nfs/dbraw/zinc/94/04/10/331940410.db2.gz	LQTSJOZLVOEHPB-UHFFFAOYSA-N	0	0	298.411	4.313	20	30		CIEDRN
CC(C)(C)[C@H]1C[C@@H](Nc2ccc(Cl)cc2C#N)CCO1	ZINC000487114204	331956539	/nfs/dbraw/zinc/95/65/39/331956539.db2.gz	YKJPMXQACBNUTB-DZGCQCFKSA-N	0	0	292.810	4.217	20	30		CIEDRN
N#Cc1cccc(CNc2ccc(C3CCC3)cc2)c1	ZINC000487168766	331957880	/nfs/dbraw/zinc/95/78/80/331957880.db2.gz	AVIUCMSJYMLRQA-UHFFFAOYSA-N	0	0	262.356	4.438	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@@H]1CCCC[C@@H]1C)c1ccccc1	ZINC000487613642	331977038	/nfs/dbraw/zinc/97/70/38/331977038.db2.gz	FFHQNGGNKSYQST-BHYGNILZSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CC[C@@H](C(=O)N1CCCc2ccccc21)c1ccccc1	ZINC000487613000	331977080	/nfs/dbraw/zinc/97/70/80/331977080.db2.gz	BBALJPIULYMACT-GOSISDBHSA-N	0	0	291.394	4.326	20	30		CIEDRN
C=CCC[C@H](C(=O)N1CCCC[C@@H]1C)c1ccccc1	ZINC000487611067	331977181	/nfs/dbraw/zinc/97/71/81/331977181.db2.gz	XKRPWMZLGNJPKS-RDJZCZTQSA-N	0	0	271.404	4.137	20	30		CIEDRN
N#Cc1ccc(NC[C@@H]2SCCc3ccccc32)c(F)c1	ZINC000487663000	331978470	/nfs/dbraw/zinc/97/84/70/331978470.db2.gz	GIQNMBIOAZMLHY-KRWDZBQOSA-N	0	0	298.386	4.140	20	30		CIEDRN
C=CC[C@@H](C(=O)NCc1ccc(F)c(C)c1)c1ccccc1	ZINC000487786037	331981421	/nfs/dbraw/zinc/98/14/21/331981421.db2.gz	RILJOBMFCBWVBM-QGZVFWFLSA-N	0	0	297.373	4.110	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@H](C)CCc1ccco1)c1ccccc1	ZINC000487787737	331981423	/nfs/dbraw/zinc/98/14/23/331981423.db2.gz	QVIPDCBEMABYCN-CRAIPNDOSA-N	0	0	297.398	4.077	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@@H](C)CCc1ccco1)c1ccccc1	ZINC000487787742	331981445	/nfs/dbraw/zinc/98/14/45/331981445.db2.gz	QVIPDCBEMABYCN-YJBOKZPZSA-N	0	0	297.398	4.077	20	30		CIEDRN
Cc1nc(N[C@H](C)c2ccc3ccccc3c2)ccc1C#N	ZINC000487907546	331983884	/nfs/dbraw/zinc/98/38/84/331983884.db2.gz	KVPHCPZDLDBHLX-CYBMUJFWSA-N	0	0	287.366	4.010	20	30		CIEDRN
Cc1cccc2[nH]cc(CCNc3ccc(C#N)cc3F)c21	ZINC000487974139	331986445	/nfs/dbraw/zinc/98/64/45/331986445.db2.gz	LBLAFLUFEQABHN-UHFFFAOYSA-N	0	0	293.345	4.142	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1cccc2ccc(C)nc21	ZINC000488250994	331995940	/nfs/dbraw/zinc/99/59/40/331995940.db2.gz	HLZFBZAQARCVBJ-OAHLLOKOSA-N	0	0	295.386	4.116	20	30		CIEDRN
Cc1ccccc1SCc1cccc(F)c1C#N	ZINC000488258405	331996478	/nfs/dbraw/zinc/99/64/78/331996478.db2.gz	AZOLWTKXRJZNTP-UHFFFAOYSA-N	0	0	257.333	4.298	20	30		CIEDRN
CC(C)O[C@@H](COc1ccc(C#N)cc1F)c1ccccc1	ZINC000488276202	331996812	/nfs/dbraw/zinc/99/68/12/331996812.db2.gz	CUQNTEQZSYVXGZ-SFHVURJKSA-N	0	0	299.345	4.242	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1nc(CC)cs1)c1ccccc1	ZINC000488327560	331999943	/nfs/dbraw/zinc/99/99/43/331999943.db2.gz	DTOJXNOMCRWQFA-AWEZNQCLSA-N	0	0	286.400	4.004	20	30		CIEDRN
CCC[C@@H](C(=O)Nc1cc(C#N)cn1C(C)(C)C)C(C)C	ZINC000488329212	332000102	/nfs/dbraw/zinc/00/01/02/332000102.db2.gz	WDWGNWSJBBQMKV-CQSZACIVSA-N	0	0	289.423	4.126	20	30		CIEDRN
CCC[C@@H](C(=O)Nc1sc(CC)cc1C#N)C(C)C	ZINC000488375933	332002975	/nfs/dbraw/zinc/00/29/75/332002975.db2.gz	LSRHPMJKNIDZOL-CYBMUJFWSA-N	0	0	278.421	4.193	20	30		CIEDRN
Cc1cccc2c1[C@H](C)C[C@@H]2CC(=O)N[C@](C)(C#N)C(C)C	ZINC000488396721	332003841	/nfs/dbraw/zinc/00/38/41/332003841.db2.gz	YPJVSQYPXPJWLS-SPYBWZPUSA-N	0	0	298.430	4.030	20	30		CIEDRN
Cc1cc(C)c(C#N)c(N[C@H]2CCc3c2cccc3Cl)n1	ZINC000511714051	332940509	/nfs/dbraw/zinc/94/05/09/332940509.db2.gz	HUCBRRKRVAPDKD-INIZCTEOSA-N	0	0	297.789	4.323	20	30		CIEDRN
N#Cc1cnc(NC[C@@H]2CCCCC(F)(F)C2)c(Cl)c1	ZINC000488486553	332013141	/nfs/dbraw/zinc/01/31/41/332013141.db2.gz	XXAZQAJNUBPXAH-SNVBAGLBSA-N	0	0	299.752	4.234	20	30		CIEDRN
CC(C)(C#N)c1ccccc1COc1ccc(F)cc1F	ZINC000488495596	332013863	/nfs/dbraw/zinc/01/38/63/332013863.db2.gz	WYVQPLDBKNPAGH-UHFFFAOYSA-N	0	0	287.309	4.345	20	30		CIEDRN
N#Cc1cc(F)ccc1CSCc1ccc(F)c(F)c1	ZINC000488538087	332016210	/nfs/dbraw/zinc/01/62/10/332016210.db2.gz	CYNNJYJVNOCTDD-UHFFFAOYSA-N	0	0	293.313	4.409	20	30		CIEDRN
C=C(C)CNC(=O)N[C@H](c1ccc(Cl)cc1F)C(C)C	ZINC000488562762	332017525	/nfs/dbraw/zinc/01/75/25/332017525.db2.gz	IQGSZNVQFRRSRK-AWEZNQCLSA-N	0	0	298.789	4.052	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)[C@H]1CCCCCC(=O)C1	ZINC000488564364	332017793	/nfs/dbraw/zinc/01/77/93/332017793.db2.gz	QPBRQIHHKGOTTM-INIZCTEOSA-N	0	0	299.414	4.283	20	30		CIEDRN
Cc1ccc(CSCc2ccc(F)cc2C#N)cc1	ZINC000488569659	332017941	/nfs/dbraw/zinc/01/79/41/332017941.db2.gz	OKKREIAWSASUHY-UHFFFAOYSA-N	0	0	271.360	4.439	20	30		CIEDRN
C=C(C)CNC(=O)N[C@@H](c1ccc(Cl)cc1)C1CCC1	ZINC000488583977	332019031	/nfs/dbraw/zinc/01/90/31/332019031.db2.gz	SLJCAXFOBRGSOH-OAHLLOKOSA-N	0	0	292.810	4.057	20	30		CIEDRN
C=CCC[C@@H](C(=O)NCCC(C)(C)C)c1ccccc1	ZINC000488607113	332020125	/nfs/dbraw/zinc/02/01/25/332020125.db2.gz	HQBRZOICXHMNGI-MRXNPFEDSA-N	0	0	273.420	4.289	20	30		CIEDRN
C=CCC[C@@H](C(=O)NCC1CCCC1)c1ccccc1	ZINC000488614130	332020223	/nfs/dbraw/zinc/02/02/23/332020223.db2.gz	YEUNPJCUMSOUBS-QGZVFWFLSA-N	0	0	271.404	4.043	20	30		CIEDRN
C=CCC[C@@H](C(=O)N(C)[C@H](C)CCC)c1ccccc1	ZINC000488623425	332020307	/nfs/dbraw/zinc/02/03/07/332020307.db2.gz	DGJWXLVFLSWBGA-NVXWUHKLSA-N	0	0	273.420	4.383	20	30		CIEDRN
CCN(C[C@@H](C)C#N)[C@@H]1CCc2c1cc(Cl)cc2Cl	ZINC000488641682	332020753	/nfs/dbraw/zinc/02/07/53/332020753.db2.gz	FDTZCHKWJZERGX-ZUZCIYMTSA-N	0	0	297.229	4.462	20	30		CIEDRN
C=CC[C@@H](C(=O)N(CCC)CC(C)C)c1ccccc1	ZINC000488663157	332021068	/nfs/dbraw/zinc/02/10/68/332021068.db2.gz	DVLFYFIIGJIDFV-QGZVFWFLSA-N	0	0	273.420	4.241	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1ccc2ccoc2c1	ZINC000488672013	332021314	/nfs/dbraw/zinc/02/13/14/332021314.db2.gz	INABFCSRUCTBNB-CQSZACIVSA-N	0	0	270.332	4.005	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@@H](C)c1cc(C)oc1C)c1ccccc1	ZINC000488707360	332022071	/nfs/dbraw/zinc/02/20/71/332022071.db2.gz	WWHAKZGFPIUCBK-WMLDXEAASA-N	0	0	297.398	4.434	20	30		CIEDRN
CCSc1cccc(CNc2c(C#N)cccc2C#N)c1	ZINC000488715488	332022376	/nfs/dbraw/zinc/02/23/76/332022376.db2.gz	WLKGRQDHUDVNLA-UHFFFAOYSA-N	0	0	293.395	4.154	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Cc1cccc(C)c1Cl	ZINC000488796253	332026137	/nfs/dbraw/zinc/02/61/37/332026137.db2.gz	GSSDHGGBSZCCCA-ZDUSSCGKSA-N	0	0	279.811	4.052	20	30		CIEDRN
C=CCN(C(=O)C[C@@H]1C[C@H](C)c2c1cccc2C)C1CC1	ZINC000488812044	332026687	/nfs/dbraw/zinc/02/66/87/332026687.db2.gz	DICOOSWUOOOGOK-GJZGRUSLSA-N	0	0	283.415	4.153	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Cc1ccc(Cl)cc1Cl	ZINC000488836791	332028484	/nfs/dbraw/zinc/02/84/84/332028484.db2.gz	BEWVFKMJWRMNCI-ZDUSSCGKSA-N	0	0	298.213	4.103	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)C[C@H](C)C1CCCCC1	ZINC000488868384	332030209	/nfs/dbraw/zinc/03/02/09/332030209.db2.gz	JQVOOEQQTRLBIY-GOEBONIOSA-N	0	0	263.425	4.160	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)C[C@@H](C)C1CCCCC1	ZINC000488868386	332030224	/nfs/dbraw/zinc/03/02/24/332030224.db2.gz	JQVOOEQQTRLBIY-ZBFHGGJFSA-N	0	0	263.425	4.160	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)[C@H](C)CC1CCCCC1	ZINC000488869228	332030420	/nfs/dbraw/zinc/03/04/20/332030420.db2.gz	AKQMZQQCLOHUHQ-ZBFHGGJFSA-N	0	0	263.425	4.160	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)[C@@H](C)Sc1ccc(C)cc1	ZINC000488872417	332030747	/nfs/dbraw/zinc/03/07/47/332030747.db2.gz	AFEYSLKJQWYXTD-CABCVRRESA-N	0	0	289.444	4.043	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@@H](C)c1cccc(Cl)c1	ZINC000488878270	332031310	/nfs/dbraw/zinc/03/13/10/332031310.db2.gz	IJQSTRPYHWWERO-SWLSCSKDSA-N	0	0	277.795	4.011	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@@H]1C[C@@H]1c1ccc([C@H]2C[C@H]2C)o1	ZINC000488881515	332031898	/nfs/dbraw/zinc/03/18/98/332031898.db2.gz	ORYZGNWTQRVGFW-RBGFHDKUSA-N	0	0	299.414	4.074	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1cccc2ccsc21	ZINC000488914790	332033648	/nfs/dbraw/zinc/03/36/48/332033648.db2.gz	QZOBIVJXYRRKBN-ZDUSSCGKSA-N	0	0	286.400	4.474	20	30		CIEDRN
C=CCC[C@@H](C(=O)NC[C@@H](C)C(C)C)c1ccccc1	ZINC000489006990	332037276	/nfs/dbraw/zinc/03/72/76/332037276.db2.gz	FQNBKZBOKSYMPS-NVXWUHKLSA-N	0	0	273.420	4.145	20	30		CIEDRN
C=CCC[C@@H](C(=O)N(CC1CC1)CC1CC1)c1ccccc1	ZINC000489035160	332038626	/nfs/dbraw/zinc/03/86/26/332038626.db2.gz	CLKYYUGBTFCYJH-LJQANCHMSA-N	0	0	297.442	4.385	20	30		CIEDRN
C=CCn1cccc1C(=O)Nc1ccccc1OCCCC	ZINC000489071390	332040202	/nfs/dbraw/zinc/04/02/02/332040202.db2.gz	IGNMOGZKRPYJRQ-UHFFFAOYSA-N	0	0	298.386	4.105	20	30		CIEDRN
C=C[C@H]1CCCCN1Cc1ncc(-c2ccccc2)s1	ZINC000489439252	332052703	/nfs/dbraw/zinc/05/27/03/332052703.db2.gz	QUAAUEYGQDVNSH-HNNXBMFYSA-N	0	0	284.428	4.351	20	30		CIEDRN
C=C[C@H]1CCCCN1Cc1csc(CCCC)n1	ZINC000489490446	332055982	/nfs/dbraw/zinc/05/59/82/332055982.db2.gz	NTGLPPRWNQYJOQ-AWEZNQCLSA-N	0	0	264.438	4.026	20	30		CIEDRN
N#Cc1cc(F)ccc1CN1CCC[C@H]1c1ccc(F)cc1	ZINC000489563609	332059356	/nfs/dbraw/zinc/05/93/56/332059356.db2.gz	CMMPFDQHAVSAJN-SFHVURJKSA-N	0	0	298.336	4.174	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@H]1CC12CCCCC2)c1ccccc1	ZINC000489595490	332060968	/nfs/dbraw/zinc/06/09/68/332060968.db2.gz	ZCFVHMOSRKMISN-IRXDYDNUSA-N	0	0	283.415	4.185	20	30		CIEDRN
CC#CCCCC(=O)N[C@H]1CCC[C@@H](c2ccccc2)C1	ZINC000489638096	332062470	/nfs/dbraw/zinc/06/24/70/332062470.db2.gz	VPXUKSSQMCGWRC-MSOLQXFVSA-N	0	0	283.415	4.023	20	30		CIEDRN
C=CCC[C@@H](C(=O)NCC1(C)CCC1)c1ccccc1	ZINC000489668714	332064055	/nfs/dbraw/zinc/06/40/55/332064055.db2.gz	BVNWSWIFIKQPDV-MRXNPFEDSA-N	0	0	271.404	4.043	20	30		CIEDRN
C=CC[C@H](C(=O)NCC1(CC)CCC1)c1ccccc1	ZINC000489689422	332064855	/nfs/dbraw/zinc/06/48/55/332064855.db2.gz	IQGFUWZVTZEZIK-INIZCTEOSA-N	0	0	271.404	4.043	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)C1(C)CCCCCC1	ZINC000489734601	332066445	/nfs/dbraw/zinc/06/64/45/332066445.db2.gz	NZIMQXCZCKLYNE-UHFFFAOYSA-N	0	0	251.414	4.065	20	30		CIEDRN
C=CC[C@H](C(=O)N1CCc2cccc(F)c21)c1ccccc1	ZINC000489739623	332066507	/nfs/dbraw/zinc/06/65/07/332066507.db2.gz	OPJKXSPBRIGKSG-INIZCTEOSA-N	0	0	295.357	4.075	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)C1(CC)CCCCC1	ZINC000489735376	332066512	/nfs/dbraw/zinc/06/65/12/332066512.db2.gz	DMJBRBGRZMHPGR-UHFFFAOYSA-N	0	0	251.414	4.065	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1ccc(C2CCC2)cc1	ZINC000489781928	332067531	/nfs/dbraw/zinc/06/75/31/332067531.db2.gz	UOMIEFQKLIAIEU-GFCCVEGCSA-N	0	0	258.365	4.040	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@H](C)c1ccc(Cl)s1	ZINC000489824179	332069105	/nfs/dbraw/zinc/06/91/05/332069105.db2.gz	IVIUOBFTMPZHLD-SNVBAGLBSA-N	0	0	285.840	4.224	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@@H](C)Cc1ccc(Cl)cc1	ZINC000489879753	332071394	/nfs/dbraw/zinc/07/13/94/332071394.db2.gz	CHYNBDWZTWCMFR-ZDUSSCGKSA-N	0	0	293.838	4.237	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@@H](C)Cc1ccccc1	ZINC000498574329	332071928	/nfs/dbraw/zinc/07/19/28/332071928.db2.gz	JFITXZDBMNMYJL-INIZCTEOSA-N	0	0	273.420	4.070	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1cc(Cl)sc1Cl	ZINC000489907292	332072636	/nfs/dbraw/zinc/07/26/36/332072636.db2.gz	KKVJHBJZFWFQQN-UHFFFAOYSA-N	0	0	292.231	4.387	20	30		CIEDRN
C[C@H](CC1CCCCC1)C(=O)Nc1ccc(F)c(C#N)c1	ZINC000303614516	332942386	/nfs/dbraw/zinc/94/23/86/332942386.db2.gz	ZMWHSPNGYNVTBV-GFCCVEGCSA-N	0	0	288.366	4.242	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1c[nH]cc1-c1ccccc1	ZINC000489964622	332074794	/nfs/dbraw/zinc/07/47/94/332074794.db2.gz	JPBUASCKDYBBAM-UHFFFAOYSA-N	0	0	282.387	4.014	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@H](C)SCc1ccccc1	ZINC000489967256	332075047	/nfs/dbraw/zinc/07/50/47/332075047.db2.gz	SUNVPIDKPSFCCA-AWEZNQCLSA-N	0	0	291.460	4.027	20	30		CIEDRN
CC(C)c1ccc(/C=C/CC(=O)N[C@@H](C#N)C(C)(C)C)cc1	ZINC000489979881	332075412	/nfs/dbraw/zinc/07/54/12/332075412.db2.gz	IIHRCYHYCXTHAE-LXXRFIIISA-N	0	0	298.430	4.268	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1cc(SC)ccc1Cl	ZINC000489979151	332075442	/nfs/dbraw/zinc/07/54/42/332075442.db2.gz	OLUVXCUPUNYRDB-UHFFFAOYSA-N	0	0	297.851	4.394	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)CCc1c[nH]c2ccc(C)cc12	ZINC000490036440	332077737	/nfs/dbraw/zinc/07/77/37/332077737.db2.gz	YTXLUAUCNKLEGX-UHFFFAOYSA-N	0	0	298.430	4.127	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@H](C)CCc1ccccc1F	ZINC000490069275	332079927	/nfs/dbraw/zinc/07/99/27/332079927.db2.gz	WFARPBCKYSWYIT-CQSZACIVSA-N	0	0	291.410	4.113	20	30		CIEDRN
C=CCN(C)C(=O)C12CC3(C)CC(C)(CC(C)(C3)C1)C2	ZINC000490077031	332080446	/nfs/dbraw/zinc/08/04/46/332080446.db2.gz	CKQXFVNLAXGMDE-UHFFFAOYSA-N	0	0	275.436	4.018	20	30		CIEDRN
C=CCSc1ccccc1C(=O)NCC(C)(C)CC=C	ZINC000490091740	332081191	/nfs/dbraw/zinc/08/11/91/332081191.db2.gz	TUZJGWLMHANTML-UHFFFAOYSA-N	0	0	289.444	4.297	20	30		CIEDRN
C=C(C)CNC(=O)c1ccc(-c2ccc(C)cc2)cc1F	ZINC000490102205	332081750	/nfs/dbraw/zinc/08/17/50/332081750.db2.gz	YDEUKQRHAXRYRW-UHFFFAOYSA-N	0	0	283.346	4.107	20	30		CIEDRN
C=CCC[C@@H](C(=O)N[C@H](C)CCC1CC1)c1ccccc1	ZINC000490239163	332085237	/nfs/dbraw/zinc/08/52/37/332085237.db2.gz	DTLQBOHUKVYJRJ-CRAIPNDOSA-N	0	0	285.431	4.431	20	30		CIEDRN
C=CC[C@H](C(=O)N1CC[C@@H](C(C)(C)C)C1)c1ccccc1	ZINC000490251458	332085288	/nfs/dbraw/zinc/08/52/88/332085288.db2.gz	POHUOUFEVACEHS-SJORKVTESA-N	0	0	285.431	4.241	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)[C@@H](C)CC1CCCC1	ZINC000490269964	332085783	/nfs/dbraw/zinc/08/57/83/332085783.db2.gz	FHBQEGSILHPBBW-HNNXBMFYSA-N	0	0	289.419	4.053	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1ccc(-c2ccco2)cc1F	ZINC000490501837	332090235	/nfs/dbraw/zinc/09/02/35/332090235.db2.gz	VHWXOEIZINZAAJ-LLVKDONJSA-N	0	0	288.322	4.172	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)C1CCC(C)(C)CC1	ZINC000490564986	332092171	/nfs/dbraw/zinc/09/21/71/332092171.db2.gz	DQJCEGTXPLBXJQ-UHFFFAOYSA-N	0	0	270.376	4.022	20	30		CIEDRN
CC(C)c1ccc([C@@H]2CCCCN2CCC#N)cc1	ZINC000490613369	332095329	/nfs/dbraw/zinc/09/53/29/332095329.db2.gz	XSTBQYMCLHWYRW-KRWDZBQOSA-N	0	0	256.393	4.251	20	30		CIEDRN
C[C@H](c1cc(F)ccc1F)N(C)c1cccc(F)c1C#N	ZINC000303647757	332943650	/nfs/dbraw/zinc/94/36/50/332943650.db2.gz	WNZWMZPOKLBCPJ-SNVBAGLBSA-N	0	0	290.288	4.173	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)NCC1CCC(c2ccccc2)CC1	ZINC000511843100	332944167	/nfs/dbraw/zinc/94/41/67/332944167.db2.gz	IPVVJMSHICQVRQ-KVWWFHCMSA-N	0	0	298.430	4.016	20	30		CIEDRN
CCC[C@H](CC1CCCC1)C(=O)NCc1cccc(C#N)c1	ZINC000303651743	332944365	/nfs/dbraw/zinc/94/43/65/332944365.db2.gz	XFTXRESQIUYANU-GOSISDBHSA-N	0	0	298.430	4.171	20	30		CIEDRN
C=CCN(CC=C)C(=O)Nc1ccc(CC)c(Cl)c1	ZINC000490785820	332115594	/nfs/dbraw/zinc/11/55/94/332115594.db2.gz	VENCLOZDSIZDQB-UHFFFAOYSA-N	0	0	278.783	4.108	20	30		CIEDRN
C=CCSCC(=O)Nc1ccc([C@@H](C)CC)cc1	ZINC000490823264	332118032	/nfs/dbraw/zinc/11/80/32/332118032.db2.gz	SLWRSQKVLXFWPM-LBPRGKRZSA-N	0	0	263.406	4.058	20	30		CIEDRN
CCCCN(C(=O)CC(C)(C)C#N)[C@H](C)c1ccccc1	ZINC000490901191	332127783	/nfs/dbraw/zinc/12/77/83/332127783.db2.gz	ZJOCYVSGFSETJN-OAHLLOKOSA-N	0	0	286.419	4.316	20	30		CIEDRN
C=CCN(C)C(=O)c1ccccc1Nc1cccc(C)c1C	ZINC000491116595	332151057	/nfs/dbraw/zinc/15/10/57/332151057.db2.gz	YOUAGNQILNWGLO-UHFFFAOYSA-N	0	0	294.398	4.305	20	30		CIEDRN
C=CCN(Cc1c(F)cccc1Cl)CC(F)(F)F	ZINC000511909875	332947652	/nfs/dbraw/zinc/94/76/52/332947652.db2.gz	GUVZUENZHUTBLA-UHFFFAOYSA-N	0	0	281.680	4.029	20	30		CIEDRN
C#CCN(C)C(=O)Nc1c(C(C)C)cccc1C(C)C	ZINC000491327077	332190939	/nfs/dbraw/zinc/19/09/39/332190939.db2.gz	SQMIZTWFFASIEQ-UHFFFAOYSA-N	0	0	272.392	4.030	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)Nc1cc(C)cc(C)c1	ZINC000491367832	332198111	/nfs/dbraw/zinc/19/81/11/332198111.db2.gz	OBEKMGMHUULQRX-UHFFFAOYSA-N	0	0	298.386	4.159	20	30		CIEDRN
C#C[C@@H](N[C@H](C)c1cc(C)ccn1)c1ccc(Cl)cc1	ZINC000491496725	332223206	/nfs/dbraw/zinc/22/32/06/332223206.db2.gz	SLSYKSIUGTUSBK-CZUORRHYSA-N	0	0	284.790	4.069	20	30		CIEDRN
CCN(C(=O)/C=C\C(C)(C)C)[C@H](C)c1ccc(C#N)cc1	ZINC000491683862	332285880	/nfs/dbraw/zinc/28/58/80/332285880.db2.gz	BKYIJONEQWZVCD-XMXAVACDSA-N	0	0	284.403	4.070	20	30		CIEDRN
CC(C)[C@@H]1CCCC[C@@H]1NC(=O)Nc1ccc(CC#N)cc1	ZINC000491836008	332371355	/nfs/dbraw/zinc/37/13/55/332371355.db2.gz	VLRKBMFKBSCWNR-IRXDYDNUSA-N	0	0	299.418	4.089	20	30		CIEDRN
C/C=C(/C=C\C(=O)Nc1cccc(OCCCC#N)c1)CC	ZINC000492118697	332383679	/nfs/dbraw/zinc/38/36/79/332383679.db2.gz	ZQANCIQXPBJYLJ-WKTISOBESA-N	0	0	298.386	4.220	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)/C=C\c1cncc(C)c1	ZINC000493295832	332434383	/nfs/dbraw/zinc/43/43/83/332434383.db2.gz	YOXXOYVXKXBRQS-KHPPLWFESA-N	0	0	292.382	4.161	20	30		CIEDRN
C[C@H](CCCC(F)(F)F)Nc1c(F)cc(C#N)cc1F	ZINC000493529940	332443831	/nfs/dbraw/zinc/44/38/31/332443831.db2.gz	RIJZOYKANYTTDP-MRVPVSSYSA-N	0	0	292.251	4.369	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)/C=C/C1(C)CCOCC1	ZINC000493674933	332449551	/nfs/dbraw/zinc/44/95/51/332449551.db2.gz	BBRANAZITTUVDT-ZHACJKMWSA-N	0	0	299.414	4.117	20	30		CIEDRN
C=CCOc1ccc(CNc2cnn([C@@H](C)C3CC3)c2)cc1	ZINC000494394689	332471971	/nfs/dbraw/zinc/47/19/71/332471971.db2.gz	SGZOMBCSVUOTMS-AWEZNQCLSA-N	0	0	297.402	4.031	20	30		CIEDRN
CC(C)(C)CCCC(=O)Nc1ccc(C#N)cc1Cl	ZINC000494608468	332480033	/nfs/dbraw/zinc/48/00/33/332480033.db2.gz	KCWPOUHLIPIWCK-UHFFFAOYSA-N	0	0	278.783	4.367	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)N[C@@H](C)c1cc(C)sc1C	ZINC000494698186	332483436	/nfs/dbraw/zinc/48/34/36/332483436.db2.gz	HZEKUVHIFPATMZ-GXTWGEPZSA-N	0	0	292.448	4.176	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)N[C@H](C)c1cc(C)sc1C	ZINC000494698188	332483496	/nfs/dbraw/zinc/48/34/96/332483496.db2.gz	HZEKUVHIFPATMZ-OCCSQVGLSA-N	0	0	292.448	4.176	20	30		CIEDRN
C=CC[C@H](C)[C@H](C)Nc1cnn(CC(C)C)c1C(F)F	ZINC000495146449	332508451	/nfs/dbraw/zinc/50/84/51/332508451.db2.gz	FEFQCKUDQSUURK-RYUDHWBXSA-N	0	0	285.382	4.489	20	30		CIEDRN
CC(C)(C#N)CNC(=O)Nc1cccc(-c2ccccc2)c1	ZINC000495516529	332521468	/nfs/dbraw/zinc/52/14/68/332521468.db2.gz	NYGVDVSMSHCDQT-UHFFFAOYSA-N	0	0	293.370	4.025	20	30		CIEDRN
CCc1ccc(C[NH2+][C@H]2CCCc3cc(C#N)ccc32)cc1	ZINC000553293833	334374232	/nfs/dbraw/zinc/37/42/32/334374232.db2.gz	LHDZEJQAFLGLTH-FQEVSTJZSA-N	0	0	290.410	4.288	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](c2cccc(Cl)c2)C1	ZINC000496650989	332555762	/nfs/dbraw/zinc/55/57/62/332555762.db2.gz	NGKKXLOPCWFERJ-HIFRSBDPSA-N	0	0	291.822	4.258	20	30		CIEDRN
CC(C)(CCC#N)CNC(=O)[C@@H]1CCC[C@@H]2CCCC[C@H]12	ZINC000553755887	334397795	/nfs/dbraw/zinc/39/77/95/334397795.db2.gz	MXHZXOCJYOGCQA-HRCADAONSA-N	0	0	290.451	4.039	20	30		CIEDRN
C=CCNC(=O)Nc1ccc(S[C@@H](C)CC)cc1C	ZINC000498836958	332573900	/nfs/dbraw/zinc/57/39/00/332573900.db2.gz	JHSDCKXOVYPYTD-LBPRGKRZSA-N	0	0	278.421	4.193	20	30		CIEDRN
CCC[C@@]1(C(F)(F)F)CCCN1Cc1cccc(C#N)c1	ZINC000499052282	332577622	/nfs/dbraw/zinc/57/76/22/332577622.db2.gz	DDOXLQYKZGRUER-HNNXBMFYSA-N	0	0	296.336	4.255	20	30		CIEDRN
COc1cc(C#N)ccc1CSc1ccc(F)c(F)c1	ZINC000499315308	332584100	/nfs/dbraw/zinc/58/41/00/332584100.db2.gz	FJHOPTZNCPDPBV-UHFFFAOYSA-N	0	0	291.322	4.137	20	30		CIEDRN
N#CC1(CCCSC2CCCCC2)CCOCC1	ZINC000499924916	332595867	/nfs/dbraw/zinc/59/58/67/332595867.db2.gz	AFYQHQWZRYDPRV-UHFFFAOYSA-N	0	0	267.438	4.153	20	30		CIEDRN
Cc1ccc(C#N)c(N2CCC[C@H](c3ccccc3)CC2)n1	ZINC000500255117	332603986	/nfs/dbraw/zinc/60/39/86/332603986.db2.gz	VGMGWHCWIRXCJF-KRWDZBQOSA-N	0	0	291.398	4.036	20	30		CIEDRN
Cc1ccc(C#N)c(NC[C@H]2CCCC[C@H]2C(F)(F)F)n1	ZINC000500296326	332604390	/nfs/dbraw/zinc/60/43/90/332604390.db2.gz	KKAWGPYKUQNSDM-CHWSQXEVSA-N	0	0	297.324	4.042	20	30		CIEDRN
C=CCCc1ccccc1NC/C=C\c1ccncc1	ZINC000500399114	332606921	/nfs/dbraw/zinc/60/69/21/332606921.db2.gz	FLAYJZADOBEISH-SREVYHEPSA-N	0	0	264.372	4.326	20	30		CIEDRN
N#Cc1ccc(NCCc2ccc(F)cc2Cl)c(F)c1	ZINC000500407132	332607522	/nfs/dbraw/zinc/60/75/22/332607522.db2.gz	HJCNRTCFTAZZQW-UHFFFAOYSA-N	0	0	292.716	4.144	20	30		CIEDRN
C=CCCc1ccccc1NCc1cnn2ccccc12	ZINC000500453072	332610003	/nfs/dbraw/zinc/61/00/03/332610003.db2.gz	UOHWMBLCOGHMSG-UHFFFAOYSA-N	0	0	277.371	4.065	20	30		CIEDRN
COc1cccc([C@H](C)Nc2c(F)cc(C#N)cc2F)c1	ZINC000500501418	332611617	/nfs/dbraw/zinc/61/16/17/332611617.db2.gz	HCGFZVOPCMGXMF-JTQLQIEISA-N	0	0	288.297	4.018	20	30		CIEDRN
COc1cccc([C@@H](C)Nc2c(F)cc(C#N)cc2F)c1	ZINC000500501429	332611626	/nfs/dbraw/zinc/61/16/26/332611626.db2.gz	HCGFZVOPCMGXMF-SNVBAGLBSA-N	0	0	288.297	4.018	20	30		CIEDRN
Cc1c(C#N)cccc1NCc1cc2ccccc2o1	ZINC000500750292	332617677	/nfs/dbraw/zinc/61/76/77/332617677.db2.gz	PBHGDYAKVHHHLM-UHFFFAOYSA-N	0	0	262.312	4.225	20	30		CIEDRN
C=CCOc1cccc(NC(=O)c2ccc(SC)cc2)c1	ZINC000501154438	332627751	/nfs/dbraw/zinc/62/77/51/332627751.db2.gz	HNGNLNZHIPDWPV-UHFFFAOYSA-N	0	0	299.395	4.226	20	30		CIEDRN
Cc1ccc([C@H]2CCC[C@H]2N(C)C(=O)CC(C)(C)C#N)cc1	ZINC000501271228	332629745	/nfs/dbraw/zinc/62/97/45/332629745.db2.gz	CRAVMPLMCDZZII-IAGOWNOFSA-N	0	0	298.430	4.029	20	30		CIEDRN
C=CCN(C)C(=O)c1csc(-c2ccc(Cl)cc2)c1	ZINC000501506232	332634575	/nfs/dbraw/zinc/63/45/75/332634575.db2.gz	AUYLZVQMNRRXJD-UHFFFAOYSA-N	0	0	291.803	4.327	20	30		CIEDRN
C=CCCc1ccccc1N[C@H]1CCO[C@H](C(C)C)C1	ZINC000502308236	332653355	/nfs/dbraw/zinc/65/33/55/332653355.db2.gz	HDCXKLHJULNNLX-WMZOPIPTSA-N	0	0	273.420	4.421	20	30		CIEDRN
CC[C@@H](C)[C@H](C)C(=O)Nc1sc2c(c1C#N)CCCC2	ZINC000502501269	332663579	/nfs/dbraw/zinc/66/35/79/332663579.db2.gz	LNTDLJNDNBMGDM-MNOVXSKESA-N	0	0	290.432	4.119	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)[C@H]2C[C@H](C)C[C@H](C)C2)s1	ZINC000504098568	332704061	/nfs/dbraw/zinc/70/40/61/332704061.db2.gz	ZPRWQVJNUZTWQA-GDNZZTSVSA-N	0	0	290.432	4.193	20	30		CIEDRN
CC(C)(C)CCCC(=O)Nc1ccc(Cl)c(C#N)c1	ZINC000504380614	332710088	/nfs/dbraw/zinc/71/00/88/332710088.db2.gz	FDLRNGKRYKEHSE-UHFFFAOYSA-N	0	0	278.783	4.367	20	30		CIEDRN
CC(C)(C)CCCC(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000504495093	332713271	/nfs/dbraw/zinc/71/32/71/332713271.db2.gz	CKFPKNGKEHGZOR-UHFFFAOYSA-N	0	0	278.783	4.367	20	30		CIEDRN
N#Cc1cnccc1/C=C/c1cc2ccccc2s1	ZINC000504710394	332719233	/nfs/dbraw/zinc/71/92/33/332719233.db2.gz	BAXLKPGXJVLWIX-AATRIKPKSA-N	0	0	262.337	4.338	20	30		CIEDRN
C=CCCC(=O)N1c2ccccc2C(C)(C)C[C@H]1C	ZINC000504860932	332722930	/nfs/dbraw/zinc/72/29/30/332722930.db2.gz	FPVHAXPJDUGTJR-CYBMUJFWSA-N	0	0	257.377	4.056	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc2c(c1)O[C@@](C)(CC)O2	ZINC000504896612	332724019	/nfs/dbraw/zinc/72/40/19/332724019.db2.gz	YULFMLGFZGQDJJ-KRWDZBQOSA-N	0	0	289.375	4.125	20	30		CIEDRN
Cc1cc(SC[C@H](C)C(F)(F)F)ccc1C#N	ZINC000569244612	334863326	/nfs/dbraw/zinc/86/33/26/334863326.db2.gz	WEUBSYXKPRCCJA-VIFPVBQESA-N	0	0	259.296	4.157	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N(CCC)CCC	ZINC000505000242	332727355	/nfs/dbraw/zinc/72/73/55/332727355.db2.gz	BFCHUHGDMUKMER-UHFFFAOYSA-N	0	0	274.408	4.459	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)Nc1ccc(O)cc1C	ZINC000505016705	332727911	/nfs/dbraw/zinc/72/79/11/332727911.db2.gz	LFGYHQZKXLIQSE-UHFFFAOYSA-N	0	0	296.370	4.463	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N[C@@H]1CC12CCCC2	ZINC000505052045	332729446	/nfs/dbraw/zinc/72/94/46/332729446.db2.gz	NRFIERWLRDMVJY-MRXNPFEDSA-N	0	0	284.403	4.259	20	30		CIEDRN
Cc1cccc2cc(C(=O)N(CCC#N)CCC(C)C)oc21	ZINC000505214289	332733878	/nfs/dbraw/zinc/73/38/78/332733878.db2.gz	YPDHRSVCOAINMW-UHFFFAOYSA-N	0	0	298.386	4.143	20	30		CIEDRN
CCC[C@H](C)C(=O)N[C@@H](C#N)c1c(Cl)cccc1Cl	ZINC000505515520	332742798	/nfs/dbraw/zinc/74/27/98/332742798.db2.gz	VVJDVGCOCGYJRC-CABZTGNLSA-N	0	0	299.201	4.110	20	30		CIEDRN
CCC[C@@H](C)C(=O)N[C@H](C#N)c1c(Cl)cccc1Cl	ZINC000505515519	332742802	/nfs/dbraw/zinc/74/28/02/332742802.db2.gz	VVJDVGCOCGYJRC-BXKDBHETSA-N	0	0	299.201	4.110	20	30		CIEDRN
COc1ccc([C@H](C)Nc2ccc(C#N)cc2)c(C)c1OC	ZINC000572795104	334879244	/nfs/dbraw/zinc/87/92/44/334879244.db2.gz	NMLJLTQNHIEIEN-ZDUSSCGKSA-N	0	0	296.370	4.057	20	30		CIEDRN
C=CCCC(=O)N[C@H](C)c1ccc(F)c2ccccc21	ZINC000572514309	332760495	/nfs/dbraw/zinc/76/04/95/332760495.db2.gz	JTMJZYKEZSAYKI-GFCCVEGCSA-N	0	0	271.335	4.122	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CCc2c(cccc2C(C)C)C1	ZINC000506068913	332761290	/nfs/dbraw/zinc/76/12/90/332761290.db2.gz	BUQZEFKVVLAJSB-UHFFFAOYSA-N	0	0	285.431	4.297	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1cc(Cl)c(F)cc1Cl	ZINC000512100356	332953994	/nfs/dbraw/zinc/95/39/94/332953994.db2.gz	STBJAHULOKXOGT-QMMMGPOBSA-N	0	0	290.165	4.217	20	30		CIEDRN
N#Cc1ccccc1-c1ccc(CSc2ncc[nH]2)cc1	ZINC000172930395	332954206	/nfs/dbraw/zinc/95/42/06/332954206.db2.gz	HNVKXXFWTPWMPK-UHFFFAOYSA-N	0	0	291.379	4.241	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CC[C@H](c2ccccc2)C[C@H]1C	ZINC000512420091	332967676	/nfs/dbraw/zinc/96/76/76/332967676.db2.gz	GXPRUAFUXWCXAP-WBVHZDCISA-N	0	0	285.431	4.383	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)C1CCC(c2ccccc2)CC1	ZINC000173538165	332973768	/nfs/dbraw/zinc/97/37/68/332973768.db2.gz	VLMMWOQNMIWJJU-ODIFPOPNSA-N	0	0	271.404	4.041	20	30		CIEDRN
COc1cc(F)ccc1N[C@@H](C)c1ccc(C#N)cc1F	ZINC000512652761	332978063	/nfs/dbraw/zinc/97/80/63/332978063.db2.gz	BGYVXXSDYLCQHE-JTQLQIEISA-N	0	0	288.297	4.018	20	30		CIEDRN
CCc1cccc(N[C@H](C)c2ccc(C#N)cc2F)c1	ZINC000512666447	332979040	/nfs/dbraw/zinc/97/90/40/332979040.db2.gz	KNGLNWICESRAHY-GFCCVEGCSA-N	0	0	268.335	4.433	20	30		CIEDRN
C=CCCC(=O)N1CCc2ccccc2[C@H]1c1ccccc1	ZINC000512680879	332979923	/nfs/dbraw/zinc/97/99/23/332979923.db2.gz	GZFVOHYHOACDOC-HXUWFJFHSA-N	0	0	291.394	4.127	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N(C)[C@@H](C)C1CCCCC1	ZINC000512726268	332981825	/nfs/dbraw/zinc/98/18/25/332981825.db2.gz	VPHXMVQNGXTIIS-BBRMVZONSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)CCc1cncc(C)c1	ZINC000512779886	332985458	/nfs/dbraw/zinc/98/54/58/332985458.db2.gz	VCHZUCYPOKAERB-UHFFFAOYSA-N	0	0	294.398	4.080	20	30		CIEDRN
Cc1cccc(Cl)c1NCc1ccc(C#N)c(F)c1	ZINC000404106116	332987299	/nfs/dbraw/zinc/98/72/99/332987299.db2.gz	GSDJESGFLWDBCI-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
C=CCOc1cccc(CNc2cccc(CC)c2)c1	ZINC000512934817	332994479	/nfs/dbraw/zinc/99/44/79/332994479.db2.gz	WZZWRHRKPSGATE-UHFFFAOYSA-N	0	0	267.372	4.426	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CCC(C)(CC(C)C)CC1	ZINC000575793814	335115621	/nfs/dbraw/zinc/11/56/21/335115621.db2.gz	LNJDRSKWBPGBCS-KRWDZBQOSA-N	0	0	265.441	4.264	20	30		CIEDRN
N#Cc1ccc(-c2csc(NCc3ccccc3)n2)cc1	ZINC000306444525	333006760	/nfs/dbraw/zinc/00/67/60/333006760.db2.gz	PCJNQHRPXUDYCU-UHFFFAOYSA-N	0	0	291.379	4.294	20	30		CIEDRN
C[C@@H](CNc1cccc(F)c1C#N)c1ccc(F)cc1	ZINC000513182241	333007379	/nfs/dbraw/zinc/00/73/79/333007379.db2.gz	FTWQBDKHYZMDRL-NSHDSACASA-N	0	0	272.298	4.052	20	30		CIEDRN
C[C@H]1C[C@@H](c2ccccc2)[N@H+](Cc2ccc(C#N)cc2F)C1	ZINC000513265190	333011359	/nfs/dbraw/zinc/01/13/59/333011359.db2.gz	CVZJAWHTJMNVEH-LIRRHRJNSA-N	0	0	294.373	4.280	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(-c2nccs2)cc1	ZINC000175202119	333017205	/nfs/dbraw/zinc/01/72/05/333017205.db2.gz	XFCHELZNKHSYFI-UHFFFAOYSA-N	0	0	272.373	4.105	20	30		CIEDRN
C=C(CC)CSCc1ccc(S(=O)(=O)C(C)C)cc1	ZINC000513445486	333019734	/nfs/dbraw/zinc/01/97/34/333019734.db2.gz	YUMOCZQRDGGPDZ-UHFFFAOYSA-N	0	0	298.473	4.068	20	30		CIEDRN
C=CCCCC(=O)N[C@H](C)c1cccc(OC(C)C)c1	ZINC000175329918	333021684	/nfs/dbraw/zinc/02/16/84/333021684.db2.gz	HVXKSLUVULQRDU-CQSZACIVSA-N	0	0	275.392	4.007	20	30		CIEDRN
N#Cc1ccc(NC(=O)c2csc3ccccc32)cc1F	ZINC000308121170	333025060	/nfs/dbraw/zinc/02/50/60/333025060.db2.gz	QBTCNKOAUCUWIG-UHFFFAOYSA-N	0	0	296.326	4.164	20	30		CIEDRN
N#Cc1ccc(NC(=O)c2ccc3sccc3c2)cc1F	ZINC000308121685	333025080	/nfs/dbraw/zinc/02/50/80/333025080.db2.gz	QOCDTVDSFAAMEA-UHFFFAOYSA-N	0	0	296.326	4.164	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc2oc(C(F)(F)F)nc2c1	ZINC000175446379	333025108	/nfs/dbraw/zinc/02/51/08/333025108.db2.gz	GAZDRIFJVXDOAO-UHFFFAOYSA-N	0	0	298.264	4.141	20	30		CIEDRN
N#Cc1cnc(Sc2cccc(Cl)c2)c(Cl)c1	ZINC000513603737	333026152	/nfs/dbraw/zinc/02/61/52/333026152.db2.gz	QZRDYVDPAPPAAN-UHFFFAOYSA-N	0	0	281.167	4.411	20	30		CIEDRN
C=CCCCC(=O)Nc1sc2c(c1C#N)CCCCC2	ZINC000175597416	333026796	/nfs/dbraw/zinc/02/67/96/333026796.db2.gz	FCXTUEPXJOPDMA-UHFFFAOYSA-N	0	0	288.416	4.183	20	30		CIEDRN
N#Cc1cnc(Sc2ccc3c(c2)CCC3)c(Cl)c1	ZINC000513630687	333027799	/nfs/dbraw/zinc/02/77/99/333027799.db2.gz	RIGMGSFNIIEWQL-UHFFFAOYSA-N	0	0	286.787	4.247	20	30		CIEDRN
N#Cc1cnc(N(CC2CC2)C2CCCCC2)c(Cl)c1	ZINC000513640026	333028356	/nfs/dbraw/zinc/02/83/56/333028356.db2.gz	ITPSPAPQOGUJKX-UHFFFAOYSA-N	0	0	289.810	4.156	20	30		CIEDRN
C=CCCC(=O)N(C)[C@H](C)[C@@H](C)c1ccc(Cl)cc1	ZINC000175705671	333029830	/nfs/dbraw/zinc/02/98/30/333029830.db2.gz	HNULXPNOHBNFND-CHWSQXEVSA-N	0	0	279.811	4.257	20	30		CIEDRN
C=CCCCC(=O)N(C)[C@H](C)Cc1ccc(Cl)cc1	ZINC000175723682	333030677	/nfs/dbraw/zinc/03/06/77/333030677.db2.gz	HQTRXLBASIPZCA-CYBMUJFWSA-N	0	0	279.811	4.086	20	30		CIEDRN
C[C@@H](C#N)CN(C(=O)Nc1ccccc1C(C)(C)C)C1CC1	ZINC000513667149	333030941	/nfs/dbraw/zinc/03/09/41/333030941.db2.gz	RTNLAXVCNVSXHD-ZDUSSCGKSA-N	0	0	299.418	4.140	20	30		CIEDRN
CC(C)(C)CN(C/C=C\c1ccc(F)cc1)CCC#N	ZINC000513726049	333035840	/nfs/dbraw/zinc/03/58/40/333035840.db2.gz	WLMKZOOUBKZQEL-XQRVVYSFSA-N	0	0	274.383	4.101	20	30		CIEDRN
C[C@H](C(=O)Nc1cccc(C#N)c1)c1cc2ccccc2o1	ZINC000175883563	333036487	/nfs/dbraw/zinc/03/64/87/333036487.db2.gz	WGUYASGIUDLCGJ-LBPRGKRZSA-N	0	0	290.322	4.047	20	30		CIEDRN
CC(C)(C)CN(CCC#N)Cc1ccc(Cl)c(F)c1	ZINC000513736927	333036675	/nfs/dbraw/zinc/03/66/75/333036675.db2.gz	PCGVKUVOTOCVLA-UHFFFAOYSA-N	0	0	282.790	4.241	20	30		CIEDRN
C[C@@H](Cc1ccccc1Cl)C(=O)Nc1cccc(C#N)c1	ZINC000513746611	333037413	/nfs/dbraw/zinc/03/74/13/333037413.db2.gz	AJHHJBZSSYASSJ-LBPRGKRZSA-N	0	0	298.773	4.029	20	30		CIEDRN
COc1ccc(Cl)cc1CN(CCC#N)CCC(C)C	ZINC000513750160	333037608	/nfs/dbraw/zinc/03/76/08/333037608.db2.gz	BQNPXRPKRJVNTH-UHFFFAOYSA-N	0	0	294.826	4.110	20	30		CIEDRN
C=C1CCN(C(=O)CCCc2ccc(CC(C)C)cc2)CC1	ZINC000513779329	333038781	/nfs/dbraw/zinc/03/87/81/333038781.db2.gz	CEHZEHKMAKWKEW-UHFFFAOYSA-N	0	0	299.458	4.386	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)C/C=C/c1ccc(F)cc1	ZINC000176144253	333039778	/nfs/dbraw/zinc/03/97/78/333039778.db2.gz	PUACZHLYEQLBJH-NSCUHMNNSA-N	0	0	294.329	4.048	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)c2oc(C)cc2C)c1	ZINC000176417762	333041982	/nfs/dbraw/zinc/04/19/82/333041982.db2.gz	FPBMUSLFCIKKFA-UHFFFAOYSA-N	0	0	285.343	4.104	20	30		CIEDRN
N#Cc1ccc(-c2nc3cccc(Cl)c3s2)cc1	ZINC000513857355	333043720	/nfs/dbraw/zinc/04/37/20/333043720.db2.gz	KKKBWKBOGCFHTC-UHFFFAOYSA-N	0	0	270.744	4.488	20	30		CIEDRN
N#Cc1ccccc1SCc1nc2cc(F)ccc2o1	ZINC000176621661	333044357	/nfs/dbraw/zinc/04/43/57/333044357.db2.gz	MWVZPYBUIFUMBG-UHFFFAOYSA-N	0	0	284.315	4.131	20	30		CIEDRN
C=CCOc1ccc(-c2nc3ccccc3n2CC)cc1	ZINC000513871331	333045213	/nfs/dbraw/zinc/04/52/13/333045213.db2.gz	OUUZTYNLYREPIU-UHFFFAOYSA-N	0	0	278.355	4.288	20	30		CIEDRN
C=C(C)CSc1nnc(-c2cc3ccccc3o2)o1	ZINC000176802537	333047654	/nfs/dbraw/zinc/04/76/54/333047654.db2.gz	DAVPZLIVWVZEOP-UHFFFAOYSA-N	0	0	272.329	4.151	20	30		CIEDRN
C=CCNC(=O)N[C@H](C)c1ccc(Oc2ccccc2)cc1	ZINC000513899495	333048707	/nfs/dbraw/zinc/04/87/07/333048707.db2.gz	DOUBCGILDAYJSH-CQSZACIVSA-N	0	0	296.370	4.025	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)c1cc(C)ccc1C	ZINC000176992202	333051665	/nfs/dbraw/zinc/05/16/65/333051665.db2.gz	CWHXJHFVHMRCBH-UHFFFAOYSA-N	0	0	257.377	4.035	20	30		CIEDRN
C[C@@H](C#N)CN(C)Cc1ccccc1Oc1ccccc1	ZINC000513957669	333054837	/nfs/dbraw/zinc/05/48/37/333054837.db2.gz	COCYYHXOMWSTKY-HNNXBMFYSA-N	0	0	280.371	4.070	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(OC2CCC2)c(F)c1	ZINC000177214019	333055167	/nfs/dbraw/zinc/05/51/67/333055167.db2.gz	MAROZTYILWWZMG-UHFFFAOYSA-N	0	0	277.339	4.052	20	30		CIEDRN
CC(C)(C#N)CCCn1c2ccccc2nc1C(F)(F)F	ZINC000177246126	333055833	/nfs/dbraw/zinc/05/58/33/333055833.db2.gz	FFMYGTMHJSUVIK-UHFFFAOYSA-N	0	0	295.308	4.385	20	30		CIEDRN
CC(C)CC[C@@H]1CCCCN1C(=O)c1cccc(CC#N)c1	ZINC000177500361	333059734	/nfs/dbraw/zinc/05/97/34/333059734.db2.gz	VLUOAFAGBOQMAK-SFHVURJKSA-N	0	0	298.430	4.184	20	30		CIEDRN
C[C@@H](C(=O)Nc1ccccc1C#N)c1cc2ccccc2o1	ZINC000177565424	333060383	/nfs/dbraw/zinc/06/03/83/333060383.db2.gz	WFONWBCRJYBBLB-GFCCVEGCSA-N	0	0	290.322	4.047	20	30		CIEDRN
C=CCCCC(=O)Nc1ccccc1OCC(C)C	ZINC000177561892	333060464	/nfs/dbraw/zinc/06/04/64/333060464.db2.gz	NEOVPBOYZKVWLA-UHFFFAOYSA-N	0	0	261.365	4.016	20	30		CIEDRN
C=CCCCC(=O)N(Cc1ccccc1)[C@@H](C)C1CC1	ZINC000177835772	333063728	/nfs/dbraw/zinc/06/37/28/333063728.db2.gz	YYLDUXDXAAWXTN-HNNXBMFYSA-N	0	0	271.404	4.170	20	30		CIEDRN
C=CCCCC(=O)N1CCS[C@@H](C)[C@@H]1c1ccccc1	ZINC000177869406	333064685	/nfs/dbraw/zinc/06/46/85/333064685.db2.gz	FDDQEEAYSYNBKV-WMLDXEAASA-N	0	0	289.444	4.048	20	30		CIEDRN
C=C(C)CSCC(=O)Nc1cccc2ccccc21	ZINC000177867390	333064854	/nfs/dbraw/zinc/06/48/54/333064854.db2.gz	VSVUUSLRUQBMNV-UHFFFAOYSA-N	0	0	271.385	4.088	20	30		CIEDRN
Cc1ccc(Cl)c(Oc2ccc(C#N)c(C)n2)c1	ZINC000311220387	333066129	/nfs/dbraw/zinc/06/61/29/333066129.db2.gz	UOUNFUCNWCLAIF-UHFFFAOYSA-N	0	0	258.708	4.016	20	30		CIEDRN
C[C@H](Sc1ccccc1C#N)c1cccc([N+](=O)[O-])c1	ZINC000172682581	335119077	/nfs/dbraw/zinc/11/90/77/335119077.db2.gz	KQLLEZVRRSXURI-NSHDSACASA-N	0	0	284.340	4.320	20	30		CIEDRN
Cc1nc(N[C@@H](C)c2ccccc2)c(Cl)cc1C#N	ZINC000311441899	333068440	/nfs/dbraw/zinc/06/84/40/333068440.db2.gz	GSTGCNCBLFJKBC-JTQLQIEISA-N	0	0	271.751	4.088	20	30		CIEDRN
C/C=C(/C=C/C(=O)N(CC)[C@@H](C)c1ccc(C#N)cc1)CC	ZINC000178160194	333068763	/nfs/dbraw/zinc/06/87/63/333068763.db2.gz	SIBZLIGJJBNQBM-KOFNFPICSA-N	0	0	296.414	4.380	20	30		CIEDRN
COCc1cccc(OCc2ccccc2C(C)(C)C#N)c1	ZINC000178380711	333071767	/nfs/dbraw/zinc/07/17/67/333071767.db2.gz	VMVQAUGBSQLHHH-UHFFFAOYSA-N	0	0	295.382	4.213	20	30		CIEDRN
CC(C)(CNc1cccc(C(F)F)c1C#N)C(F)(F)F	ZINC000516938115	333087189	/nfs/dbraw/zinc/08/71/89/333087189.db2.gz	SMCDXZOAHOXQKD-UHFFFAOYSA-N	0	0	292.251	4.496	20	30		CIEDRN
C=C(C)CCc1noc([C@H](C)c2cn(C)c3ccccc23)n1	ZINC000517201638	333094397	/nfs/dbraw/zinc/09/43/97/333094397.db2.gz	CZMDUXNJPRNXFA-CYBMUJFWSA-N	0	0	295.386	4.222	20	30		CIEDRN
C=C(C)CN(CC)C(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1	ZINC000517482968	333100410	/nfs/dbraw/zinc/10/04/10/333100410.db2.gz	SEFWTEZROVLEFZ-MOPGFXCFSA-N	0	0	293.410	4.368	20	30		CIEDRN
CC(C)Oc1ccccc1COc1ccc(C#N)c(F)c1	ZINC000517525453	333101145	/nfs/dbraw/zinc/10/11/45/333101145.db2.gz	XECXWLAUUMHYPK-UHFFFAOYSA-N	0	0	285.318	4.064	20	30		CIEDRN
C=CCN1C(=O)c2ccccc2N[C@@H]1c1ccc(CC)s1	ZINC000520897305	333107388	/nfs/dbraw/zinc/10/73/88/333107388.db2.gz	XUTHCDBDALTMNX-INIZCTEOSA-N	0	0	298.411	4.063	20	30		CIEDRN
C=CCCO[C@H](C)C(=O)Nc1ccccc1CCC(C)C	ZINC000520924563	333107805	/nfs/dbraw/zinc/10/78/05/333107805.db2.gz	DRFJGTPBNQRMEN-OAHLLOKOSA-N	0	0	289.419	4.195	20	30		CIEDRN
CC(C)CCN(C(=O)Nc1cccc(C#N)c1)C1CCCC1	ZINC000521153228	333112741	/nfs/dbraw/zinc/11/27/41/333112741.db2.gz	VPCGOYHROWKBST-UHFFFAOYSA-N	0	0	299.418	4.381	20	30		CIEDRN
C[C@H](c1noc(-c2ccc(C#N)c(Cl)c2)n1)C(C)(C)C	ZINC000575835952	335121605	/nfs/dbraw/zinc/12/16/05/335121605.db2.gz	SMYAGPNUQKIVFB-SECBINFHSA-N	0	0	289.766	4.411	20	30		CIEDRN
CC(C)CN(C(=O)CC1=CCCCC1)c1ccc(C#N)cc1	ZINC000521245271	333116314	/nfs/dbraw/zinc/11/63/14/333116314.db2.gz	NVPJPCWOWJGTFQ-UHFFFAOYSA-N	0	0	296.414	4.438	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1cccc(OC2CCCC2)c1	ZINC000521273951	333116893	/nfs/dbraw/zinc/11/68/93/333116893.db2.gz	ILLDPANPNHQMLQ-UHFFFAOYSA-N	0	0	287.403	4.046	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@]1(C)Cc1ccccc1	ZINC000183997837	333124113	/nfs/dbraw/zinc/12/41/13/333124113.db2.gz	XJSYHPBATWBNRG-LPHOPBHVSA-N	0	0	285.431	4.213	20	30		CIEDRN
C[C@H]1CCC[C@@H]1CC(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000184641889	333130912	/nfs/dbraw/zinc/13/09/12/333130912.db2.gz	MIXXBFRXOGJMLK-UONOGXRCSA-N	0	0	284.403	4.253	20	30		CIEDRN
CSc1cccc(C)c1NC(=O)c1cccc(CC#N)c1	ZINC000184635894	333130915	/nfs/dbraw/zinc/13/09/15/333130915.db2.gz	GMCSXLGFKATASP-UHFFFAOYSA-N	0	0	296.395	4.035	20	30		CIEDRN
C=CCCCCS[C@@H](C)c1nc(C(C)C)no1	ZINC000575854513	335123897	/nfs/dbraw/zinc/12/38/97/335123897.db2.gz	RCYYYHDDCJEETD-NSHDSACASA-N	0	0	254.399	4.344	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cccc(Cl)c1C	ZINC000184868793	333132772	/nfs/dbraw/zinc/13/27/72/333132772.db2.gz	KMZHBNBKQJXSKT-JTQLQIEISA-N	0	0	251.757	4.189	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(Cl)cc1F	ZINC000184881637	333132834	/nfs/dbraw/zinc/13/28/34/333132834.db2.gz	QZLVXJUIWQQYHJ-VIFPVBQESA-N	0	0	255.720	4.020	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(Br)cc1C	ZINC000184962534	333133838	/nfs/dbraw/zinc/13/38/38/333133838.db2.gz	OBZDDAOFGGDUKH-LLVKDONJSA-N	0	0	296.208	4.298	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CCC)Cc1ccccc1	ZINC000184969263	333133937	/nfs/dbraw/zinc/13/39/37/333133937.db2.gz	KZNBSTMHTNXNPL-HNNXBMFYSA-N	0	0	259.393	4.028	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cc(OCC)ccc1OCC	ZINC000184983359	333134132	/nfs/dbraw/zinc/13/41/32/333134132.db2.gz	LMSGDDIEVNDXOZ-CYBMUJFWSA-N	0	0	291.391	4.025	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)Cc1ccccc1C(F)(F)F	ZINC000184993740	333134159	/nfs/dbraw/zinc/13/41/59/333134159.db2.gz	DLKFEGUCNVVRNU-LBPRGKRZSA-N	0	0	299.336	4.266	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](C)c1cccc(OC(C)C)c1	ZINC000185142576	333136021	/nfs/dbraw/zinc/13/60/21/333136021.db2.gz	JCBZPSALCFIEHX-HUUCEWRRSA-N	0	0	289.419	4.253	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](C)c1ccc(OC(C)C)cc1	ZINC000185172929	333136383	/nfs/dbraw/zinc/13/63/83/333136383.db2.gz	FMCPRVKCTHGDKO-CABCVRRESA-N	0	0	289.419	4.253	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cc(Br)ccc1C	ZINC000185194192	333136656	/nfs/dbraw/zinc/13/66/56/333136656.db2.gz	GOHFTHYUOUUANS-LLVKDONJSA-N	0	0	296.208	4.298	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H]1C1CCCCC1	ZINC000185221141	333136750	/nfs/dbraw/zinc/13/67/50/333136750.db2.gz	XJAZPGDKHBZDDP-HOCLYGCPSA-N	0	0	263.425	4.160	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H]1C1CCCCC1	ZINC000185221123	333136819	/nfs/dbraw/zinc/13/68/19/333136819.db2.gz	XJAZPGDKHBZDDP-GDBMZVCRSA-N	0	0	263.425	4.160	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCc1ccc2ccccc2c1	ZINC000185222333	333136924	/nfs/dbraw/zinc/13/69/24/333136924.db2.gz	PNNOEGLJDLSFEZ-CQSZACIVSA-N	0	0	267.372	4.058	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NC(C)(C)CCc1ccccc1	ZINC000185440451	333140760	/nfs/dbraw/zinc/14/07/60/333140760.db2.gz	DMHVHZVRWYVKIX-OAHLLOKOSA-N	0	0	273.420	4.116	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](C)c1nc(C(C)(C)C)cs1	ZINC000185492784	333141771	/nfs/dbraw/zinc/14/17/71/333141771.db2.gz	PGOUSZIHONQDSR-NEPJUHHUSA-N	0	0	294.464	4.220	20	30		CIEDRN
CC#CCCCC(=O)N[C@H](C)c1cc2ccccc2s1	ZINC000185500348	333142172	/nfs/dbraw/zinc/14/21/72/333142172.db2.gz	JGBCUASHIHKCKS-CYBMUJFWSA-N	0	0	285.412	4.272	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@H]1Cc1ccc(C)cc1	ZINC000185556504	333143567	/nfs/dbraw/zinc/14/35/67/333143567.db2.gz	BMCRWPAXSVHYSH-AEFFLSMTSA-N	0	0	285.431	4.131	20	30		CIEDRN
CC#CCCCC(=O)N(c1ccc(OC)cc1)[C@@H](C)C1CC1	ZINC000185569711	333143994	/nfs/dbraw/zinc/14/39/94/333143994.db2.gz	VMRWMEAPVHFYOZ-HNNXBMFYSA-N	0	0	299.414	4.020	20	30		CIEDRN
CC#CCCCC(=O)N(c1cc(C)ccc1C)C(C)C	ZINC000185621349	333145197	/nfs/dbraw/zinc/14/51/97/333145197.db2.gz	SKRITVQSGUBTEV-UHFFFAOYSA-N	0	0	271.404	4.238	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](CC)c1ccc(F)cc1F	ZINC000185628070	333145356	/nfs/dbraw/zinc/14/53/56/333145356.db2.gz	DWXSSFKHBMCXFX-NHYWBVRUSA-N	0	0	281.346	4.134	20	30		CIEDRN
CC#CCCCC(=O)N1CCC[C@@H](C)[C@@H]1c1ccc(C)cc1	ZINC000185634302	333145557	/nfs/dbraw/zinc/14/55/57/333145557.db2.gz	ZKORDELMDWNZPU-YLJYHZDGSA-N	0	0	297.442	4.488	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NC1(c2cccc(Cl)c2)CC1	ZINC000185650908	333145814	/nfs/dbraw/zinc/14/58/14/333145814.db2.gz	RJNQOFVCQKATMK-GFCCVEGCSA-N	0	0	277.795	4.048	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](C)C(C)(C)c1ccccc1	ZINC000185660333	333146165	/nfs/dbraw/zinc/14/61/65/333146165.db2.gz	KTZNDACVLOTBOK-CABCVRRESA-N	0	0	273.420	4.071	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](C)C(C)(C)c1ccccc1	ZINC000185660374	333146167	/nfs/dbraw/zinc/14/61/67/333146167.db2.gz	KTZNDACVLOTBOK-HUUCEWRRSA-N	0	0	273.420	4.071	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](C)C[C@@H]1c1ccc(C)o1	ZINC000185728892	333147443	/nfs/dbraw/zinc/14/74/43/333147443.db2.gz	JJQNEBXPCRCHNC-OFQRWUPVSA-N	0	0	289.419	4.490	20	30		CIEDRN
CC#CCCCC(=O)N1CC[C@@H](c2ccccc2)[C@H](CC)C1	ZINC000185745304	333147802	/nfs/dbraw/zinc/14/78/02/333147802.db2.gz	VMQVYPJWOQNEDK-IEBWSBKVSA-N	0	0	297.442	4.222	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccc(CCC(F)(F)F)cc1	ZINC000185809887	333149448	/nfs/dbraw/zinc/14/94/48/333149448.db2.gz	JEEJRALCHAJUDU-UHFFFAOYSA-N	0	0	297.320	4.314	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cc(C)ccc1Cl	ZINC000185865489	333150487	/nfs/dbraw/zinc/15/04/87/333150487.db2.gz	QNFZXTQSQWZOGB-LLVKDONJSA-N	0	0	251.757	4.189	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)C[C@@H]1CCC[C@H]1C	ZINC000185870296	333150778	/nfs/dbraw/zinc/15/07/78/333150778.db2.gz	LOZUZBLRYHHYOV-KGLIPLIRSA-N	0	0	277.433	4.089	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@@H](C)c1cn(C)c2ccccc12	ZINC000185876679	333150945	/nfs/dbraw/zinc/15/09/45/333150945.db2.gz	XRUSWHBRXWTHCL-GJZGRUSLSA-N	0	0	298.430	4.143	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1[C@H](C)C[C@@H](c2ccccc2)[C@@H]1C	ZINC000185899643	333151505	/nfs/dbraw/zinc/15/15/05/333151505.db2.gz	UEKXAQMZJYLUNL-UIBIWLFHSA-N	0	0	285.431	4.382	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCC1(c2ccccc2Cl)CC1	ZINC000185964937	333152565	/nfs/dbraw/zinc/15/25/65/333152565.db2.gz	QSGFVDUDZPNBSG-CYBMUJFWSA-N	0	0	291.822	4.090	20	30		CIEDRN
C=CCCCN(C)C(=O)c1coc2cc(C)c(C)cc21	ZINC000185965941	333152595	/nfs/dbraw/zinc/15/25/95/333152595.db2.gz	DHPOIIAHUMVLNV-UHFFFAOYSA-N	0	0	271.360	4.088	20	30		CIEDRN
CC[C@@H](C(=O)Nc1cccc(C#N)c1C)c1ccc(F)cc1	ZINC000185968367	333152643	/nfs/dbraw/zinc/15/26/43/333152643.db2.gz	RXNJGZKYFVGPLF-MRXNPFEDSA-N	0	0	296.345	4.138	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1cc(F)ccc1C)c1ccccc1	ZINC000186001491	333153130	/nfs/dbraw/zinc/15/31/30/333153130.db2.gz	QYEWLJPCWGFSKH-MRXNPFEDSA-N	0	0	283.346	4.433	20	30		CIEDRN
C=C(C)[C@H](NC(=O)C[C@@H]1C=CCC1)c1ccc(F)c(F)c1	ZINC000186044595	333154049	/nfs/dbraw/zinc/15/40/49/333154049.db2.gz	BEUQTLBINMUDBW-PXAZEXFGSA-N	0	0	291.341	4.055	20	30		CIEDRN
C=CCC[C@H](C(=O)NCc1cccs1)c1ccccc1	ZINC000186097821	333154798	/nfs/dbraw/zinc/15/47/98/333154798.db2.gz	SODMUFYPXANGNZ-INIZCTEOSA-N	0	0	285.412	4.114	20	30		CIEDRN
C=CCC[C@H](C(=O)NCCc1cccs1)c1ccccc1	ZINC000186204157	333156696	/nfs/dbraw/zinc/15/66/96/333156696.db2.gz	HFMAMTWYEXEFCS-KRWDZBQOSA-N	0	0	299.439	4.157	20	30		CIEDRN
C=C(C)[C@H](N[C@H](C)c1cccnc1)c1ccc(F)c(F)c1	ZINC000186445991	333161137	/nfs/dbraw/zinc/16/11/37/333161137.db2.gz	QOSWZEXRZOXACB-PXAZEXFGSA-N	0	0	288.341	4.328	20	30		CIEDRN
CC(C)[C@]1(C)C[C@H]1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000186463702	333161348	/nfs/dbraw/zinc/16/13/48/333161348.db2.gz	WZIBHRYCNRYDRK-YJBOKZPZSA-N	0	0	284.403	4.108	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@@H](C)Cc1cccs1)c1ccccc1	ZINC000186628998	333163798	/nfs/dbraw/zinc/16/37/98/333163798.db2.gz	HFZVUQKTINJNEI-WMLDXEAASA-N	0	0	299.439	4.155	20	30		CIEDRN
CCN(C(=O)C[C@@H]1CCC[C@@H]1C)[C@@H](C)c1ccc(C#N)cc1	ZINC000186626949	333163902	/nfs/dbraw/zinc/16/39/02/333163902.db2.gz	VNZSHZFGCFDHSM-MPGHIAIKSA-N	0	0	298.430	4.294	20	30		CIEDRN
C[C@H](c1cccs1)N(C)Cc1ccc(Cl)cc1C#N	ZINC000186681022	333164292	/nfs/dbraw/zinc/16/42/92/333164292.db2.gz	YYIDYBIQNNWDKU-LLVKDONJSA-N	0	0	290.819	4.466	20	30		CIEDRN
C[C@@H](c1cccs1)N(C)Cc1ccc(Cl)cc1C#N	ZINC000186681003	333164392	/nfs/dbraw/zinc/16/43/92/333164392.db2.gz	YYIDYBIQNNWDKU-NSHDSACASA-N	0	0	290.819	4.466	20	30		CIEDRN
C=CCC[C@H](C(=O)N(C)C1CCCC1)c1ccccc1	ZINC000186734572	333164818	/nfs/dbraw/zinc/16/48/18/333164818.db2.gz	TXOHFGWFGRGLAE-KRWDZBQOSA-N	0	0	271.404	4.137	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1cc(F)c(OC)cc1C	ZINC000186767033	333164925	/nfs/dbraw/zinc/16/49/25/333164925.db2.gz	PSXDKRFINPEFAY-LBPRGKRZSA-N	0	0	294.370	4.009	20	30		CIEDRN
C[C@H]1CCC[C@H]1CC(=O)N(C)c1cc(Cl)ccc1C#N	ZINC000186841566	333165493	/nfs/dbraw/zinc/16/54/93/333165493.db2.gz	USKLAAZYJXXISO-RYUDHWBXSA-N	0	0	290.794	4.001	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@@H](CC)CCC)c1ccccc1	ZINC000187244463	333168872	/nfs/dbraw/zinc/16/88/72/333168872.db2.gz	KEZSJPKAPZBGFN-HOTGVXAUSA-N	0	0	259.393	4.041	20	30		CIEDRN
C=CCC[C@H](C(=O)Nc1cccc(O)c1)c1ccccc1	ZINC000187273370	333169036	/nfs/dbraw/zinc/16/90/36/333169036.db2.gz	SBSCSSZSCTXCHS-KRWDZBQOSA-N	0	0	281.355	4.081	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1cc(C#N)ccc1C)c1ccccc1	ZINC000187264721	333169079	/nfs/dbraw/zinc/16/90/79/333169079.db2.gz	PSXSWOMPXJIUGQ-QGZVFWFLSA-N	0	0	290.366	4.165	20	30		CIEDRN
C=C(C)[C@H](NCc1cccc(O)c1)c1ccc(F)c(F)c1	ZINC000187371486	333169657	/nfs/dbraw/zinc/16/96/57/333169657.db2.gz	HYVSGEQNZQCMQT-KRWDZBQOSA-N	0	0	289.325	4.077	20	30		CIEDRN
C=C(C)[C@H](NCc1ccsc1)c1ccc(F)c(F)c1	ZINC000187370604	333169686	/nfs/dbraw/zinc/16/96/86/333169686.db2.gz	ZZLGWSQPERCRPA-HNNXBMFYSA-N	0	0	279.355	4.433	20	30		CIEDRN
C[C@@H](NCc1ccc(Cl)cc1C#N)c1ccccc1	ZINC000187400449	333170193	/nfs/dbraw/zinc/17/01/93/333170193.db2.gz	GJOFEXIZSYEGKL-GFCCVEGCSA-N	0	0	270.763	4.062	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NC1(Cc2cccc(F)c2)CCC1	ZINC000187533253	333172093	/nfs/dbraw/zinc/17/20/93/333172093.db2.gz	HOSDTXUIUFMSQG-AWEZNQCLSA-N	0	0	289.394	4.009	20	30		CIEDRN
C=CC[C@H](C(=O)N(C)Cc1ccc(C)s1)c1ccccc1	ZINC000187543342	333172425	/nfs/dbraw/zinc/17/24/25/333172425.db2.gz	BYPBIFNCEOIBDX-KRWDZBQOSA-N	0	0	299.439	4.375	20	30		CIEDRN
C=CCC[C@H](C(=O)Nc1cnccc1C)c1ccccc1	ZINC000187626036	333173066	/nfs/dbraw/zinc/17/30/66/333173066.db2.gz	QCWLZGXVENRIFN-INIZCTEOSA-N	0	0	280.371	4.079	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1ccc2c(c1)COC2)c1ccccc1	ZINC000188935225	333176499	/nfs/dbraw/zinc/17/64/99/333176499.db2.gz	NJRROJCYFYARNF-GOSISDBHSA-N	0	0	293.366	4.015	20	30		CIEDRN
COCCSCc1ccc(-c2ccccc2C#N)cc1	ZINC000521541369	333178027	/nfs/dbraw/zinc/17/80/27/333178027.db2.gz	ZJIHZPQYRGXHSH-UHFFFAOYSA-N	0	0	283.396	4.105	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)CC2=CCCCC2)c1	ZINC000521599547	333179451	/nfs/dbraw/zinc/17/94/51/333179451.db2.gz	ZMQQNWGZQKEYNC-UHFFFAOYSA-N	0	0	285.387	4.471	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@H](c3ccccc3)[C@H]2C)CCC1	ZINC000189102538	333181126	/nfs/dbraw/zinc/18/11/26/333181126.db2.gz	ARPQQJKPAYMUAU-WBVHZDCISA-N	0	0	283.415	4.137	20	30		CIEDRN
C=CCC[C@@H](C(=O)N1CCCC2(CC2)C1)c1ccccc1	ZINC000189242309	333187479	/nfs/dbraw/zinc/18/74/79/333187479.db2.gz	WCILSFGRAVJCQT-QGZVFWFLSA-N	0	0	283.415	4.139	20	30		CIEDRN
C=CCC1(C(=O)Nc2cc(C)ccc2Cl)CCC1	ZINC000189437830	333192786	/nfs/dbraw/zinc/19/27/86/333192786.db2.gz	UXZGMOCCSZTLJY-UHFFFAOYSA-N	0	0	263.768	4.333	20	30		CIEDRN
Cn1ccc2cccc(N[C@@H](C#N)C3CCCCC3)c21	ZINC000189587714	333195798	/nfs/dbraw/zinc/19/57/98/333195798.db2.gz	VXDBFFBAOALGJW-INIZCTEOSA-N	0	0	267.376	4.063	20	30		CIEDRN
CC(C)c1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C#N)cc1)CC2	ZINC000189611797	333196223	/nfs/dbraw/zinc/19/62/23/333196223.db2.gz	KOAIQQSWLSYFIH-FQEVSTJZSA-N	0	0	290.410	4.459	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000189760261	333198687	/nfs/dbraw/zinc/19/86/87/333198687.db2.gz	VTEUBNOOJMJJAQ-LJQANCHMSA-N	0	0	285.431	4.070	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)c1ccc(Cl)c(C)c1	ZINC000189917642	333200580	/nfs/dbraw/zinc/20/05/80/333200580.db2.gz	PBRSZRBXRYHAIE-UHFFFAOYSA-N	0	0	292.810	4.193	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H]1CCSc2c(F)cccc21	ZINC000189962171	333201230	/nfs/dbraw/zinc/20/12/30/333201230.db2.gz	KJDJWLFWONZADF-CZUORRHYSA-N	0	0	293.407	4.081	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@@H]1CCSc2c(F)cccc21	ZINC000189962188	333201283	/nfs/dbraw/zinc/20/12/83/333201283.db2.gz	KJDJWLFWONZADF-CJNGLKHVSA-N	0	0	293.407	4.081	20	30		CIEDRN
N#Cc1ccc(CNc2cc(Cl)ccc2F)cc1F	ZINC000190323452	333205417	/nfs/dbraw/zinc/20/54/17/333205417.db2.gz	UVEUSZHVMZGWJG-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
CCCOc1cccc(NCc2ccc(C#N)c(F)c2)c1	ZINC000190338796	333205771	/nfs/dbraw/zinc/20/57/71/333205771.db2.gz	OWNFQKHGFVAQQX-UHFFFAOYSA-N	0	0	284.334	4.098	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H](C)c1ccc(Cl)s1	ZINC000190382994	333206248	/nfs/dbraw/zinc/20/62/48/333206248.db2.gz	SUDQDKQOIUXSJK-TVQRCGJNSA-N	0	0	271.813	4.181	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(N3CCCC3)cc2C)CCC1	ZINC000190609277	333209073	/nfs/dbraw/zinc/20/90/73/333209073.db2.gz	UQVWWENPMPGLSF-UHFFFAOYSA-N	0	0	298.430	4.280	20	30		CIEDRN
C=CCCCCCNC(=O)Nc1ccc(COCC)cc1	ZINC000575879008	335127787	/nfs/dbraw/zinc/12/77/87/335127787.db2.gz	GCRLQXSTIDCEFI-UHFFFAOYSA-N	0	0	290.407	4.091	20	30		CIEDRN
N#CCc1ccc(NC(=O)c2ccc(C3CCC3)cc2)cc1	ZINC000191141800	333215997	/nfs/dbraw/zinc/21/59/97/333215997.db2.gz	VNWJSGABYORWLH-UHFFFAOYSA-N	0	0	290.366	4.272	20	30		CIEDRN
CC[C@H](C)CC(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1	ZINC000191541077	333221050	/nfs/dbraw/zinc/22/10/50/333221050.db2.gz	IOLYDKVFNSTYNL-TVQRCGJNSA-N	0	0	299.201	4.110	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1sc2c(c1C#N)CCCC2	ZINC000191798221	333225602	/nfs/dbraw/zinc/22/56/02/333225602.db2.gz	ZRAMBPYUANZYCC-INIZCTEOSA-N	0	0	288.416	4.039	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(C)cc1Br	ZINC000191796732	333225719	/nfs/dbraw/zinc/22/57/19/333225719.db2.gz	AGVKWICUKKAINX-AWEZNQCLSA-N	0	0	296.208	4.298	20	30		CIEDRN
CC(C)(C)c1cnc(CSc2cccc(F)c2C#N)o1	ZINC000521965167	333228411	/nfs/dbraw/zinc/22/84/11/333228411.db2.gz	MHNSVTBEQUHCMT-UHFFFAOYSA-N	0	0	290.363	4.275	20	30		CIEDRN
N#Cc1c(NC2CCC(F)(F)CC2)cccc1C(F)F	ZINC000522014434	333230259	/nfs/dbraw/zinc/23/02/59/333230259.db2.gz	SWJNVFXNZUDGIG-UHFFFAOYSA-N	0	0	286.272	4.486	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cc(F)ccc1OCC1CC1	ZINC000192277612	333234026	/nfs/dbraw/zinc/23/40/26/333234026.db2.gz	AFDIWUDYXSQMCK-QGZVFWFLSA-N	0	0	291.366	4.155	20	30		CIEDRN
N#Cc1ccc(OCc2ccc(F)cc2Cl)c(F)c1	ZINC000225240825	333234079	/nfs/dbraw/zinc/23/40/79/333234079.db2.gz	ZTXSZLHLWQNISP-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
C=CCCCCCSCc1cc(-c2cnn(C)c2)no1	ZINC000192547059	333236403	/nfs/dbraw/zinc/23/64/03/333236403.db2.gz	MZTVYHNJOQWZFY-UHFFFAOYSA-N	0	0	291.420	4.055	20	30		CIEDRN
CCN(C(=O)c1cccc(Cl)c1C)c1ccc(C#N)cc1	ZINC000192631262	333237208	/nfs/dbraw/zinc/23/72/08/333237208.db2.gz	OIWPABBKBAMBAU-UHFFFAOYSA-N	0	0	298.773	4.187	20	30		CIEDRN
Cc1c(Cl)cccc1C(=O)Nc1cccc(C#N)c1C	ZINC000192755776	333238970	/nfs/dbraw/zinc/23/89/70/333238970.db2.gz	HYKNMQWFKJRZOM-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
N#Cc1ccc(/C=C/c2cccc(C(F)(F)F)c2)nc1	ZINC000193445539	333250228	/nfs/dbraw/zinc/25/02/28/333250228.db2.gz	NBZGMALLLCARFG-GQCTYLIASA-N	0	0	274.245	4.142	20	30		CIEDRN
CCc1ccsc1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000193494345	333251626	/nfs/dbraw/zinc/25/16/26/333251626.db2.gz	JVKDCRRSQYPTIE-UHFFFAOYSA-N	0	0	298.411	4.364	20	30		CIEDRN
C=CCN(CC=C)C(=O)Nc1ccc(O[C@H](C)CC)cc1	ZINC000193693587	333255663	/nfs/dbraw/zinc/25/56/63/333255663.db2.gz	AQKQZPAJSMPUHB-CQSZACIVSA-N	0	0	288.391	4.070	20	30		CIEDRN
Cc1ccccc1CCC(=O)Nc1ccc(C#N)cc1Cl	ZINC000226348421	333257812	/nfs/dbraw/zinc/25/78/12/333257812.db2.gz	LSZHXIOSHFIMSU-UHFFFAOYSA-N	0	0	298.773	4.091	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)[C@@H]1CCCCC1(C)C	ZINC000226583158	333265369	/nfs/dbraw/zinc/26/53/69/333265369.db2.gz	QNUWWQPMGIHALV-AWEZNQCLSA-N	0	0	270.376	4.022	20	30		CIEDRN
N#Cc1cccc(OCC(=O)c2csc3ccccc23)c1	ZINC000194515844	333272125	/nfs/dbraw/zinc/27/21/25/333272125.db2.gz	MYKKZBIZEDPRGF-UHFFFAOYSA-N	0	0	293.347	4.035	20	30		CIEDRN
C[C@H]1CCC[C@H](CNc2nc(C(F)(F)F)ccc2C#N)C1	ZINC000227115623	333276599	/nfs/dbraw/zinc/27/65/99/333276599.db2.gz	RKPYEVYDTCNYLO-QWRGUYRKSA-N	0	0	297.324	4.210	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(Cl)c(OC)c2)CCC1	ZINC000194881000	333278446	/nfs/dbraw/zinc/27/84/46/333278446.db2.gz	FVZVRXNEJHDRGC-UHFFFAOYSA-N	0	0	279.767	4.034	20	30		CIEDRN
N#C[C@H](Sc1ncnc2sccc21)C1CCCCC1	ZINC000522333102	333282947	/nfs/dbraw/zinc/28/29/47/333282947.db2.gz	DKPNTNJZXBPGPK-LBPRGKRZSA-N	0	0	289.429	4.256	20	30		CIEDRN
C=CCCC(=O)N(Cc1ccc(F)cc1F)C1CCCC1	ZINC000522473257	333287694	/nfs/dbraw/zinc/28/76/94/333287694.db2.gz	KRXFWIOURHYGAU-UHFFFAOYSA-N	0	0	293.357	4.202	20	30		CIEDRN
COc1ccc(CNc2cc(C)ccc2Cl)cc1C#N	ZINC000227751868	333288113	/nfs/dbraw/zinc/28/81/13/333288113.db2.gz	IUSXGAUHNSELCX-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@@H](c1ccc(Cl)cc1)C1CC1	ZINC000522575734	333290533	/nfs/dbraw/zinc/29/05/33/333290533.db2.gz	CKJTXWZBGZUTRH-IAQYHMDHSA-N	0	0	292.810	4.055	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@@H](c1ccc(Cl)cc1)C1CC1	ZINC000522575736	333290625	/nfs/dbraw/zinc/29/06/25/333290625.db2.gz	CKJTXWZBGZUTRH-XHDPSFHLSA-N	0	0	292.810	4.055	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N(CCCC)Cc1ccccc1F	ZINC000522636408	333293811	/nfs/dbraw/zinc/29/38/11/333293811.db2.gz	ZMHPZZVDKRSYDG-AWEZNQCLSA-N	0	0	292.398	4.102	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Cc1coc2cc(C)c(C(C)C)cc12	ZINC000522643035	333294271	/nfs/dbraw/zinc/29/42/71/333294271.db2.gz	ZDOWWFSCJMGRCC-AWEZNQCLSA-N	0	0	299.414	4.488	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)C1(c2cccc(Cl)c2)CCCC1	ZINC000522643440	333294477	/nfs/dbraw/zinc/29/44/77/333294477.db2.gz	ZJXWENIJORCBQN-CYBMUJFWSA-N	0	0	291.822	4.233	20	30		CIEDRN
C[C@@H](CC(=O)N[C@]1(C#N)CCC[C@@H](C)C1)C1CCCCC1	ZINC000522644452	333294701	/nfs/dbraw/zinc/29/47/01/333294701.db2.gz	WAKIZGFOAXFIBX-RVKKMQEKSA-N	0	0	290.451	4.182	20	30		CIEDRN
C=CCCCN(C)C(=O)CCOc1ccc2ccccc2c1	ZINC000522961493	333301344	/nfs/dbraw/zinc/30/13/44/333301344.db2.gz	YJAYUOBMIWNNFT-UHFFFAOYSA-N	0	0	297.398	4.033	20	30		CIEDRN
CCC[C@H](C#N)NC(=O)c1ccc(C2CCCCC2)cc1	ZINC000522962287	333301494	/nfs/dbraw/zinc/30/14/94/333301494.db2.gz	QIEZCPPRTWELFV-QGZVFWFLSA-N	0	0	284.403	4.156	20	30		CIEDRN
C=CCCCN(C)C(=O)c1ccc(OCCCCC)cc1	ZINC000522964046	333301696	/nfs/dbraw/zinc/30/16/96/333301696.db2.gz	WUGFQGSBIJZQFE-UHFFFAOYSA-N	0	0	289.419	4.294	20	30		CIEDRN
C=CCCCN(C)C(=O)N[C@H](CCC)Cc1ccccc1	ZINC000522985807	333303236	/nfs/dbraw/zinc/30/32/36/333303236.db2.gz	NKPUUBALIXHWLV-QGZVFWFLSA-N	0	0	288.435	4.005	20	30		CIEDRN
C=CCCCN(C)C(=O)N[C@H](CC(C)C)c1ccccc1	ZINC000522991367	333303655	/nfs/dbraw/zinc/30/36/55/333303655.db2.gz	GCYYCBQCTQVQTH-QGZVFWFLSA-N	0	0	288.435	4.381	20	30		CIEDRN
N#Cc1cccc(COc2cccc(Cl)c2F)c1F	ZINC000229514078	333305752	/nfs/dbraw/zinc/30/57/52/333305752.db2.gz	UQMNSNCKIHNTLW-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
N#Cc1cc(NCc2cccc3cc[nH]c32)ccc1Cl	ZINC000229628222	333306822	/nfs/dbraw/zinc/30/68/22/333306822.db2.gz	XESUNBPCSYXJIX-UHFFFAOYSA-N	0	0	281.746	4.305	20	30		CIEDRN
Cc1ccc(SCc2ccc(F)c(C#N)c2)cc1	ZINC000229753507	333309419	/nfs/dbraw/zinc/30/94/19/333309419.db2.gz	NOTAKRSIODVIAP-UHFFFAOYSA-N	0	0	257.333	4.298	20	30		CIEDRN
C=C1CCN(C(=O)C[C@H](CC)c2ccc(C)cc2)CC1	ZINC000523153058	333311437	/nfs/dbraw/zinc/31/14/37/333311437.db2.gz	PAUMZIXOVJNJSN-INIZCTEOSA-N	0	0	271.404	4.057	20	30		CIEDRN
C=CCCCN(C)C(=O)C[C@@H](C)c1ccc(CC)cc1	ZINC000523159157	333311629	/nfs/dbraw/zinc/31/16/29/333311629.db2.gz	NAFQETRXMCWPGQ-OAHLLOKOSA-N	0	0	273.420	4.167	20	30		CIEDRN
CSc1ccccc1NCc1cccc(C#N)c1F	ZINC000230054612	333312526	/nfs/dbraw/zinc/31/25/26/333312526.db2.gz	BHJKAZFMJVSQOS-UHFFFAOYSA-N	0	0	272.348	4.031	20	30		CIEDRN
C=CCCC(=O)N(Cc1ccccc1F)c1ccccc1	ZINC000523223216	333312952	/nfs/dbraw/zinc/31/29/52/333312952.db2.gz	QZWILMGLRPQRQQ-UHFFFAOYSA-N	0	0	283.346	4.325	20	30		CIEDRN
C=CCCC(=O)N(Cc1ccccc1)Cc1ccc(F)cc1	ZINC000523285217	333314655	/nfs/dbraw/zinc/31/46/55/333314655.db2.gz	CUOIFHLYLUICME-UHFFFAOYSA-N	0	0	297.373	4.321	20	30		CIEDRN
C=CCC(F)(F)c1nc([C@H](C)c2ccc(C)cc2)no1	ZINC000564194493	333315308	/nfs/dbraw/zinc/31/53/08/333315308.db2.gz	XSLIDIGXLUAEHB-LLVKDONJSA-N	0	0	278.302	4.198	20	30		CIEDRN
C=CCCCC(=O)NC1(Cc2ccc(Cl)cc2)CCC1	ZINC000564195197	333321342	/nfs/dbraw/zinc/32/13/42/333321342.db2.gz	HEAFCQWQPFHKHE-UHFFFAOYSA-N	0	0	291.822	4.278	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)N[C@@H](C)[C@H](C)CC)c1	ZINC000523420934	333326114	/nfs/dbraw/zinc/32/61/14/333326114.db2.gz	IAVCALZIELWLTL-KGLIPLIRSA-N	0	0	290.407	4.198	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)Nc1cc(Cl)c(F)c(Cl)c1	ZINC000232039474	333333227	/nfs/dbraw/zinc/33/32/27/333333227.db2.gz	YVVRTHHXSRNASF-LBPRGKRZSA-N	0	0	289.137	4.011	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1csc(C(C)(C)C)n1	ZINC000523510831	333331275	/nfs/dbraw/zinc/33/12/75/333331275.db2.gz	CLRFTDNKKLBHPA-UHFFFAOYSA-N	0	0	294.464	4.259	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@H]1CCCc2ccccc21	ZINC000523510516	333331286	/nfs/dbraw/zinc/33/12/86/333331286.db2.gz	LVVNENRMTNCWQP-SFHVURJKSA-N	0	0	285.431	4.311	20	30		CIEDRN
C=CCCCCCN(C)C(=O)CCc1ccccc1C	ZINC000523511048	333331454	/nfs/dbraw/zinc/33/14/54/333331454.db2.gz	RENGQWZIASSFNC-UHFFFAOYSA-N	0	0	273.420	4.132	20	30		CIEDRN
C=CCCCCCN(C)C(=O)CSc1ccc(C)cc1	ZINC000523511344	333331474	/nfs/dbraw/zinc/33/14/74/333331474.db2.gz	BQJOQYOPGQPAKP-UHFFFAOYSA-N	0	0	291.460	4.292	20	30		CIEDRN
C=CCCCCCN(C)C(=O)CCc1ccc(C)cc1C	ZINC000523511628	333331546	/nfs/dbraw/zinc/33/15/46/333331546.db2.gz	PVRJSXNPFIKZJA-UHFFFAOYSA-N	0	0	287.447	4.441	20	30		CIEDRN
C=CCCSCCCOc1ccc(Cl)cc1	ZINC000523520561	333331962	/nfs/dbraw/zinc/33/19/62/333331962.db2.gz	XQFRNWZYJTXWQP-UHFFFAOYSA-N	0	0	256.798	4.418	20	30		CIEDRN
C=CCCCCCN(C)C(=O)N[C@@H](CC)C(C)(C)C	ZINC000523523316	333332122	/nfs/dbraw/zinc/33/21/22/333332122.db2.gz	RZNLFMITMCPTTH-AWEZNQCLSA-N	0	0	268.445	4.199	20	30		CIEDRN
Cc1cc(NCCC(C)(C)C#N)cc(C)c1Br	ZINC000232032195	333333174	/nfs/dbraw/zinc/33/31/74/333333174.db2.gz	XFOPNVLIVMLLQS-UHFFFAOYSA-N	0	0	295.224	4.418	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)CC1CCC(C)CC1	ZINC000523710522	333341002	/nfs/dbraw/zinc/34/10/02/333341002.db2.gz	LGPUJBIMBGMJOH-UHFFFAOYSA-N	0	0	291.460	4.479	20	30		CIEDRN
Cn1c2ccccc2nc1S[C@@H](C#N)C1CCCCC1	ZINC000523712472	333341182	/nfs/dbraw/zinc/34/11/82/333341182.db2.gz	WLCIEXQPCOFRHD-HNNXBMFYSA-N	0	0	285.416	4.138	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)[C@@H](C)C(C)(C)C	ZINC000523714471	333341338	/nfs/dbraw/zinc/34/13/38/333341338.db2.gz	FRHYELPQAHKIGB-CYBMUJFWSA-N	0	0	277.383	4.023	20	30		CIEDRN
C=CCCOc1ccc(-c2noc(CCCC)n2)cc1	ZINC000303799763	333346720	/nfs/dbraw/zinc/34/67/20/333346720.db2.gz	LJPCYIVUMIVAQF-UHFFFAOYSA-N	0	0	272.348	4.034	20	30		CIEDRN
C=CCN(CC=C)C(=O)[C@@H](C)Sc1cccc(Cl)c1	ZINC000523868913	333348676	/nfs/dbraw/zinc/34/86/76/333348676.db2.gz	AVSGGWZGEULSBG-GFCCVEGCSA-N	0	0	295.835	4.021	20	30		CIEDRN
C=CCCC(=O)N(Cc1cccc(F)c1)C1CCCC1	ZINC000523946804	333349899	/nfs/dbraw/zinc/34/98/99/333349899.db2.gz	QQCDINDYVSDELY-UHFFFAOYSA-N	0	0	275.367	4.063	20	30		CIEDRN
C=CCCC(=O)Nc1nc(-c2ccc(C)cc2)c(C)s1	ZINC000523956548	333350164	/nfs/dbraw/zinc/35/01/64/333350164.db2.gz	AXWIXMHQNSRWNB-UHFFFAOYSA-N	0	0	286.400	4.332	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)c1ccccc1Oc1ccccc1	ZINC000523966461	333350297	/nfs/dbraw/zinc/35/02/97/333350297.db2.gz	VZVCGVTTWQHCBG-CQSZACIVSA-N	0	0	281.355	4.173	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1ccccc1CCC(C)C	ZINC000523983842	333350659	/nfs/dbraw/zinc/35/06/59/333350659.db2.gz	SVYXLCSGPIXKNJ-CQSZACIVSA-N	0	0	274.408	4.361	20	30		CIEDRN
CC(C)C[C@@H](C)CC(=O)Nc1sc2c(c1C#N)CCC2	ZINC000524088577	333353121	/nfs/dbraw/zinc/35/31/21/333353121.db2.gz	KEDPGIRBHYCPFI-LLVKDONJSA-N	0	0	290.432	4.119	20	30		CIEDRN
C=CCCCCCN(C)C(=O)NCCCC(C)(C)C	ZINC000524149462	333354614	/nfs/dbraw/zinc/35/46/14/333354614.db2.gz	RWHTZRUAYNJTSV-UHFFFAOYSA-N	0	0	268.445	4.201	20	30		CIEDRN
CC(C)(C(=O)Nc1ccc(C#N)cc1)c1cccc(Cl)c1	ZINC000524239273	333357511	/nfs/dbraw/zinc/35/75/11/333357511.db2.gz	SITKGGSLVRHITN-UHFFFAOYSA-N	0	0	298.773	4.128	20	30		CIEDRN
CSc1ccc(Nc2nccc(C#N)c2Cl)cc1	ZINC000235058954	333365468	/nfs/dbraw/zinc/36/54/68/333365468.db2.gz	ZZELWVFNRURLEQ-UHFFFAOYSA-N	0	0	275.764	4.072	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)[C@H](C)C(C)(C)C	ZINC000524538644	333365490	/nfs/dbraw/zinc/36/54/90/333365490.db2.gz	BVWDNHRMMZFELY-AWEZNQCLSA-N	0	0	265.441	4.264	20	30		CIEDRN
Cc1cccc([C@@H](C)NC(=O)Nc2cccc(C#N)c2)c1C	ZINC000524551043	333366201	/nfs/dbraw/zinc/36/62/01/333366201.db2.gz	TUUIKWWUWGZWDW-CQSZACIVSA-N	0	0	293.370	4.058	20	30		CIEDRN
CC1=C[C@H](C)C[C@H](CNc2ccc(CC#N)cc2)C1	ZINC000235399138	333368893	/nfs/dbraw/zinc/36/88/93/333368893.db2.gz	ILFCVEJMFAKQMN-BBRMVZONSA-N	0	0	254.377	4.157	20	30		CIEDRN
C[C@H](CCNc1nccc(C#N)c1Cl)c1ccccc1	ZINC000235458298	333369771	/nfs/dbraw/zinc/36/97/71/333369771.db2.gz	VPCAJQPUPXUYKQ-GFCCVEGCSA-N	0	0	285.778	4.212	20	30		CIEDRN
N#Cc1ccc(Cl)cc1NC[C@@H]1CCc2ccccc2N1	ZINC000524690076	333371417	/nfs/dbraw/zinc/37/14/17/333371417.db2.gz	RXPLSQVXEBGLGC-HNNXBMFYSA-N	0	0	297.789	4.050	20	30		CIEDRN
N#Cc1ccc(Cl)cc1NC[C@H]1CCc2ccccc2N1	ZINC000524690077	333371447	/nfs/dbraw/zinc/37/14/47/333371447.db2.gz	RXPLSQVXEBGLGC-OAHLLOKOSA-N	0	0	297.789	4.050	20	30		CIEDRN
Cc1cc(C)cc(C[S@](=O)CCCCC(C)(C)C#N)c1	ZINC000235736856	333371795	/nfs/dbraw/zinc/37/17/95/333371795.db2.gz	CHJUFASDGYECTL-HXUWFJFHSA-N	0	0	291.460	4.272	20	30		CIEDRN
Cc1c(OCCCCC(C)(C)C#N)cccc1[N+](=O)[O-]	ZINC000235783552	333372129	/nfs/dbraw/zinc/37/21/29/333372129.db2.gz	RZLXAIMIRCZJBP-UHFFFAOYSA-N	0	0	276.336	4.002	20	30		CIEDRN
C=CCCS[C@@H]1CCCN(c2ccccc2Cl)C1=O	ZINC000524728797	333373200	/nfs/dbraw/zinc/37/32/00/333373200.db2.gz	BNHPCYDBSNXVSQ-CQSZACIVSA-N	0	0	295.835	4.145	20	30		CIEDRN
N#Cc1ccnc(Sc2cc(F)ccc2F)c1Cl	ZINC000236165608	333373255	/nfs/dbraw/zinc/37/32/55/333373255.db2.gz	URSAOBWNLMBQIA-UHFFFAOYSA-N	0	0	282.702	4.036	20	30		CIEDRN
N#Cc1ccnc(Oc2ccc(F)cc2Cl)c1Cl	ZINC000236257492	333373401	/nfs/dbraw/zinc/37/34/01/333373401.db2.gz	POMKGWXVTMSOKZ-UHFFFAOYSA-N	0	0	283.089	4.191	20	30		CIEDRN
COc1ccc(CNc2cccc(C#N)c2)c2ccccc12	ZINC000237195685	333378318	/nfs/dbraw/zinc/37/83/18/333378318.db2.gz	OPBUYIIDAIQSTH-UHFFFAOYSA-N	0	0	288.350	4.332	20	30		CIEDRN
COc1ccc(CC[C@H](C)Nc2ccc(CC#N)cc2)cc1	ZINC000237256898	333378672	/nfs/dbraw/zinc/37/86/72/333378672.db2.gz	YXLJCEAOPGBLFK-HNNXBMFYSA-N	0	0	294.398	4.194	20	30		CIEDRN
N#Cc1cc(N2CCC[C@@H]2C2CCCC2)nc2ccccc12	ZINC000316345589	333388328	/nfs/dbraw/zinc/38/83/28/333388328.db2.gz	QQEVZLRKIMTTGE-GOSISDBHSA-N	0	0	291.398	4.265	20	30		CIEDRN
N#CCN(Cc1ccc2ccccc2c1)C1CCCC1	ZINC000524811710	333389075	/nfs/dbraw/zinc/38/90/75/333389075.db2.gz	HBFVMZXOXSCWRM-UHFFFAOYSA-N	0	0	264.372	4.108	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)NC[C@H](C)C(C)C)c1	ZINC000524832547	333389824	/nfs/dbraw/zinc/38/98/24/333389824.db2.gz	YYIIMRTVXAPBOA-AWEZNQCLSA-N	0	0	290.407	4.055	20	30		CIEDRN
Cc1cccc([C@@H](C)CNc2nc(C)cc(C)c2C#N)c1	ZINC000524948252	333393906	/nfs/dbraw/zinc/39/39/06/333393906.db2.gz	BCGVNKOQNPHRDC-AWEZNQCLSA-N	0	0	279.387	4.094	20	30		CIEDRN
C[C@H](Sc1ccc(C#N)cc1F)c1ccc(C#N)cc1	ZINC000525117636	333399015	/nfs/dbraw/zinc/39/90/15/333399015.db2.gz	VNSKNGOIJMUWQW-NSHDSACASA-N	0	0	282.343	4.422	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)NC[C@H](C)C(C)C	ZINC000525317977	333408638	/nfs/dbraw/zinc/40/86/38/333408638.db2.gz	QKUYWXAJRCIJDB-HNNXBMFYSA-N	0	0	280.456	4.056	20	30		CIEDRN
CC[C@@H](Nc1cccc(OCCCC#N)c1)C1CCC1	ZINC000322300113	333412985	/nfs/dbraw/zinc/41/29/85/333412985.db2.gz	ULERUUCOEWGJAJ-QGZVFWFLSA-N	0	0	272.392	4.360	20	30		CIEDRN
COc1cccc([C@@H](C)Nc2ccc(C#N)c(Cl)c2)c1	ZINC000036963986	333443226	/nfs/dbraw/zinc/44/32/26/333443226.db2.gz	QILDHRFBJIMQGO-LLVKDONJSA-N	0	0	286.762	4.393	20	30		CIEDRN
C[C@H](Cc1ccsc1)Nc1ccc(C#N)c(Cl)c1	ZINC000061846327	333449737	/nfs/dbraw/zinc/44/97/37/333449737.db2.gz	SAHCJEPPCZBBRO-SNVBAGLBSA-N	0	0	276.792	4.316	20	30		CIEDRN
Cc1cccc(OCCNc2ccc(C#N)c(Cl)c2)c1	ZINC000061846467	333449739	/nfs/dbraw/zinc/44/97/39/333449739.db2.gz	WVBLNRCNRVAALA-UHFFFAOYSA-N	0	0	286.762	4.011	20	30		CIEDRN
C=CCS[C@H](C)c1nc(Cc2ccc(Cl)cc2)no1	ZINC000173825558	335141633	/nfs/dbraw/zinc/14/16/33/335141633.db2.gz	VEWCPLLMKISLRT-SNVBAGLBSA-N	0	0	294.807	4.294	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)C[C@@H](C)c2ccco2)CCCC1(C)C	ZINC000529182182	333476346	/nfs/dbraw/zinc/47/63/46/333476346.db2.gz	DGDDQNGSFSNGQM-ZBFHGGJFSA-N	0	0	289.419	4.367	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)[C@H]1CCCC12CC2	ZINC000529219304	333477491	/nfs/dbraw/zinc/47/74/91/333477491.db2.gz	RHOWLNOSLJDUQO-QGZVFWFLSA-N	0	0	283.415	4.172	20	30		CIEDRN
CCC(C#N)(CC)C(=O)N1CC2(CCCCC2)[C@H]1C(C)C	ZINC000529483977	333489834	/nfs/dbraw/zinc/48/98/34/333489834.db2.gz	VHBLRUOUGOPLHS-OAHLLOKOSA-N	0	0	290.451	4.134	20	30		CIEDRN
N#CCN(Cc1ccsc1C(F)(F)F)C1CCCC1	ZINC000529532595	333494244	/nfs/dbraw/zinc/49/42/44/333494244.db2.gz	SLQAEVPAUGQVRK-UHFFFAOYSA-N	0	0	288.338	4.035	20	30		CIEDRN
CCc1ccccc1N[C@@H](C)c1cccc(C#N)c1	ZINC000037213472	333514866	/nfs/dbraw/zinc/51/48/66/333514866.db2.gz	YYOPEYXUZKFZKP-ZDUSSCGKSA-N	0	0	250.345	4.294	20	30		CIEDRN
Cc1ccc(N[C@H](C)c2cccc(C#N)c2)cc1F	ZINC000037213286	333514880	/nfs/dbraw/zinc/51/48/80/333514880.db2.gz	CVGYOSNKVQIXNE-GFCCVEGCSA-N	0	0	254.308	4.179	20	30		CIEDRN
Cc1ccc(C)c(N[C@@H](C)c2cccc(C#N)c2)c1	ZINC000037216100	333515850	/nfs/dbraw/zinc/51/58/50/333515850.db2.gz	DNBPKJJTLGSSCK-AWEZNQCLSA-N	0	0	250.345	4.348	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@@H]1C[C@H]1c1ccsc1)c1ccccc1	ZINC000530000898	333516971	/nfs/dbraw/zinc/51/69/71/333516971.db2.gz	LSSRIZKCCUHWSL-XOKHGSTOSA-N	0	0	297.423	4.080	20	30		CIEDRN
C[C@H](c1cccc(Cl)c1)N(C)c1ccc(C#N)cc1	ZINC000062016663	333526042	/nfs/dbraw/zinc/52/60/42/333526042.db2.gz	KOKXHFQIEDMFSB-GFCCVEGCSA-N	0	0	270.763	4.409	20	30		CIEDRN
Cc1ccc(CNc2ccc(C#N)c(C(F)(F)F)c2)cc1	ZINC000037306410	333531758	/nfs/dbraw/zinc/53/17/58/333531758.db2.gz	XXSQLIMNOPDRRO-UHFFFAOYSA-N	0	0	290.288	4.498	20	30		CIEDRN
Cc1ccccc1SCCOc1ccc(C#N)cc1	ZINC000037665755	333536041	/nfs/dbraw/zinc/53/60/41/333536041.db2.gz	SFWWSGLVEOPLSR-UHFFFAOYSA-N	0	0	269.369	4.038	20	30		CIEDRN
N#CCCCOc1cccc(NCC2CCCCC2)c1	ZINC000037777407	333539471	/nfs/dbraw/zinc/53/94/71/333539471.db2.gz	BCJCDWRBXMECAO-UHFFFAOYSA-N	0	0	272.392	4.361	20	30		CIEDRN
CCOc1cc(C)ccc1N[C@H](C)c1cccc(C#N)c1	ZINC000037778054	333539564	/nfs/dbraw/zinc/53/95/64/333539564.db2.gz	KHBDZXMZJBKIKM-CQSZACIVSA-N	0	0	280.371	4.439	20	30		CIEDRN
C=CCC[C@@H](NC(=O)N(CC=C)C1CC1)c1ccccc1	ZINC000537925959	333540720	/nfs/dbraw/zinc/54/07/20/333540720.db2.gz	DASMQUAKQLHOAZ-QGZVFWFLSA-N	0	0	284.403	4.054	20	30		CIEDRN
N#CCCCCSc1nnc(Nc2ccccc2)s1	ZINC000123497050	333547484	/nfs/dbraw/zinc/54/74/84/333547484.db2.gz	RYMXCMYGHNMDJY-UHFFFAOYSA-N	0	0	290.417	4.068	20	30		CIEDRN
C=CCn1c2ccccc2nc1SCCC(C)(C)C#N	ZINC000123679415	333550725	/nfs/dbraw/zinc/55/07/25/333550725.db2.gz	MDKRVWXYDPHQTG-UHFFFAOYSA-N	0	0	285.416	4.254	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cc(C)ccc1Cl	ZINC000124523870	333559572	/nfs/dbraw/zinc/55/95/72/333559572.db2.gz	UTMBIYPTKKUSNV-UHFFFAOYSA-N	0	0	263.768	4.355	20	30		CIEDRN
C=CCn1c(C)nnc1S[C@H](C)c1cccc(Cl)c1	ZINC000124906205	333562222	/nfs/dbraw/zinc/56/22/22/333562222.db2.gz	FNDIKQQYAVFFJE-SNVBAGLBSA-N	0	0	293.823	4.279	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)c1cccc2ccccc21	ZINC000063960447	333562324	/nfs/dbraw/zinc/56/23/24/333562324.db2.gz	HJPYZQCNETUPPS-UHFFFAOYSA-N	0	0	286.334	4.272	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc(OCC)cc1C	ZINC000125400925	333566520	/nfs/dbraw/zinc/56/65/20/333566520.db2.gz	XYJIXBJVLYARGI-UHFFFAOYSA-N	0	0	273.376	4.101	20	30		CIEDRN
CCc1ccsc1C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000064681033	333567771	/nfs/dbraw/zinc/56/77/71/333567771.db2.gz	IEGVQYOWMMQOCU-UHFFFAOYSA-N	0	0	290.775	4.088	20	30		CIEDRN
N#Cc1ccnc(SCc2ccccc2C(F)(F)F)c1	ZINC000125684228	333568907	/nfs/dbraw/zinc/56/89/07/333568907.db2.gz	ZURKCGVBWIVOSR-UHFFFAOYSA-N	0	0	294.301	4.264	20	30		CIEDRN
C=C(CC)CNc1cccc(OCC(F)(F)F)c1	ZINC000537993439	333569992	/nfs/dbraw/zinc/56/99/92/333569992.db2.gz	MBLPVXOLBXRMCY-UHFFFAOYSA-N	0	0	259.271	4.006	20	30		CIEDRN
C=C(CC)CSc1nnc(C)n1[C@H]1CCC[C@@H](C)C1	ZINC000538012183	333571118	/nfs/dbraw/zinc/57/11/18/333571118.db2.gz	NAUVSQXOKPMOSK-OCCSQVGLSA-N	0	0	279.453	4.396	20	30		CIEDRN
CSc1cccc(NCCOc2ccc(C#N)cc2)c1C	ZINC000538137470	333576059	/nfs/dbraw/zinc/57/60/59/333576059.db2.gz	LPKHBTBGANGPTM-UHFFFAOYSA-N	0	0	298.411	4.080	20	30		CIEDRN
N#Cc1cccc(CSCc2ccc(F)c(F)c2)c1F	ZINC000538147231	333576332	/nfs/dbraw/zinc/57/63/32/333576332.db2.gz	IEAGFDXMAJGJRU-UHFFFAOYSA-N	0	0	293.313	4.409	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N[C@H](C)c1cccc(F)c1F	ZINC000538287864	333583069	/nfs/dbraw/zinc/58/30/69/333583069.db2.gz	SGCFLJLFUCCDBV-VXGBXAGGSA-N	0	0	296.361	4.070	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1ccc(CSC)cc1	ZINC000538327596	333585567	/nfs/dbraw/zinc/58/55/67/333585567.db2.gz	DCYJMHABOUTFPK-ZDUSSCGKSA-N	0	0	277.433	4.024	20	30		CIEDRN
C=CCCOCCCCC(=O)N(C)[C@H]1CCCC[C@H]1CC	ZINC000538417966	333591195	/nfs/dbraw/zinc/59/11/95/333591195.db2.gz	WPUCGJYPQNYASJ-SJORKVTESA-N	0	0	295.467	4.177	20	30		CIEDRN
COc1ccc(F)cc1N[C@@H](C)c1ccc(C#N)c(F)c1	ZINC000538589834	333607805	/nfs/dbraw/zinc/60/78/05/333607805.db2.gz	BVKDDQOBAPFIBD-JTQLQIEISA-N	0	0	288.297	4.018	20	30		CIEDRN
C=CCCC(=O)N[C@@H](C)[C@@H](C)c1ccccc1C(F)(F)F	ZINC000127209557	333623192	/nfs/dbraw/zinc/62/31/92/333623192.db2.gz	JVCQKAHTSXCMNA-NEPJUHHUSA-N	0	0	299.336	4.280	20	30		CIEDRN
C=C(C)COc1cc(CNc2ccccc2)ccc1OC	ZINC000174286154	335152171	/nfs/dbraw/zinc/15/21/71/335152171.db2.gz	DIOJIBBCCTUVRO-UHFFFAOYSA-N	0	0	283.371	4.262	20	30		CIEDRN
C=CCN(C(=O)Nc1cc(C(F)(F)F)ccc1C)C1CC1	ZINC000539008289	333648720	/nfs/dbraw/zinc/64/87/20/333648720.db2.gz	IEFVVBLCJSROLV-UHFFFAOYSA-N	0	0	298.308	4.196	20	30		CIEDRN
Cc1csc(NC(=O)C/C=C/c2ccc(C)cc2)c1C#N	ZINC000576096398	335152598	/nfs/dbraw/zinc/15/25/98/335152598.db2.gz	FUWGVLYTGFKSPA-ONEGZZNKSA-N	0	0	296.395	4.279	20	30		CIEDRN
C=C(CC)COc1cccc(NC(=O)c2ccccc2)c1	ZINC000539096066	333657917	/nfs/dbraw/zinc/65/79/17/333657917.db2.gz	UOOHLAPKJZJVNK-UHFFFAOYSA-N	0	0	281.355	4.284	20	30		CIEDRN
C=CCCOCCCCC(=O)N1CCC[C@H]1C(C)(C)CC	ZINC000539383746	333668423	/nfs/dbraw/zinc/66/84/23/333668423.db2.gz	XTSYMYGFBCSHHB-INIZCTEOSA-N	0	0	295.467	4.177	20	30		CIEDRN
C=CCCOCCCCC(=O)N1CCC[C@@H](CC(C)C)C1	ZINC000539388492	333668425	/nfs/dbraw/zinc/66/84/25/333668425.db2.gz	MHTSEJQFZOOKAL-KRWDZBQOSA-N	0	0	295.467	4.034	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N1C[C@@H](C)[C@H]1c1ccccc1	ZINC000539391086	333668689	/nfs/dbraw/zinc/66/86/89/333668689.db2.gz	YUODNGISHCQTJB-VYDXJSESSA-N	0	0	286.419	4.134	20	30		CIEDRN
C=CCCOCCCCC(=O)N1CCCC[C@H]1CC(C)C	ZINC000539390566	333668772	/nfs/dbraw/zinc/66/87/72/333668772.db2.gz	BJPLWWNSYUUJEB-KRWDZBQOSA-N	0	0	295.467	4.177	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N(Cc1ccccc1)C(C)C	ZINC000539475119	333673014	/nfs/dbraw/zinc/67/30/14/333673014.db2.gz	GKJQSKCMOQTMDR-MRXNPFEDSA-N	0	0	288.435	4.351	20	30		CIEDRN
CCC(CC)N(C(=O)c1ccc(C2(C#N)CC2)cc1)C1CC1	ZINC000539628512	333682132	/nfs/dbraw/zinc/68/21/32/333682132.db2.gz	FKYGWKRWLWNLFK-UHFFFAOYSA-N	0	0	296.414	4.035	20	30		CIEDRN
CN(C(=O)c1cc2ccccc2s1)c1ccccc1C#N	ZINC000128662778	333692950	/nfs/dbraw/zinc/69/29/50/333692950.db2.gz	UWAFAGYPHLYRGB-UHFFFAOYSA-N	0	0	292.363	4.050	20	30		CIEDRN
C=CCN(C(=O)N[C@H](CC)c1ccc(Cl)s1)C1CC1	ZINC000540111578	333710361	/nfs/dbraw/zinc/71/03/61/333710361.db2.gz	HDKUPEAPBPJKCR-LLVKDONJSA-N	0	0	298.839	4.213	20	30		CIEDRN
C=CCN(C(=O)C[C@H](C)c1ccc(C(C)C)cc1)C1CC1	ZINC000540133176	333711124	/nfs/dbraw/zinc/71/11/24/333711124.db2.gz	AWUCGIZWQILIMD-HNNXBMFYSA-N	0	0	285.431	4.481	20	30		CIEDRN
C=CCN(C(=O)CCc1cc(Cl)cc(Cl)c1)C1CC1	ZINC000540135232	333711175	/nfs/dbraw/zinc/71/11/75/333711175.db2.gz	XZGNRUAJQFXBSC-UHFFFAOYSA-N	0	0	298.213	4.103	20	30		CIEDRN
C=C(CC)CNc1ccc(C)c(OCC2CCOCC2)c1	ZINC000540193996	333720247	/nfs/dbraw/zinc/72/02/47/333720247.db2.gz	IHCHZWKXNYGNLM-UHFFFAOYSA-N	0	0	289.419	4.179	20	30		CIEDRN
CCC[C@H](CC)Nc1cc(C#N)c2ccccc2n1	ZINC000068770433	333728676	/nfs/dbraw/zinc/72/86/76/333728676.db2.gz	FDZHOQGLOMANNG-ZDUSSCGKSA-N	0	0	253.349	4.097	20	30		CIEDRN
N#Cc1cc(NCC2CCCCC2)nc2ccccc12	ZINC000068769917	333728774	/nfs/dbraw/zinc/72/87/74/333728774.db2.gz	ATXPYCUVXAJTDC-UHFFFAOYSA-N	0	0	265.360	4.099	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N1CCC[C@H]1C1CCCC1	ZINC000540487781	333732029	/nfs/dbraw/zinc/73/20/29/333732029.db2.gz	NVOBFBVKLDEORD-ZBFHGGJFSA-N	0	0	278.440	4.095	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@H](C)CSc1ccccc1	ZINC000540532334	333734154	/nfs/dbraw/zinc/73/41/54/333734154.db2.gz	OVPLEVLLPWYGEI-CABCVRRESA-N	0	0	291.460	4.276	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)[C@H](C)CSc1ccccc1	ZINC000540532339	333734157	/nfs/dbraw/zinc/73/41/57/333734157.db2.gz	OVPLEVLLPWYGEI-HUUCEWRRSA-N	0	0	291.460	4.276	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000540535495	333734245	/nfs/dbraw/zinc/73/42/45/333734245.db2.gz	WGNCTEOTSJFISD-IILDEKEXSA-N	0	0	275.436	4.064	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cc(SC)ccc1C	ZINC000540537763	333734419	/nfs/dbraw/zinc/73/44/19/333734419.db2.gz	ZWRQMJONLHTXAN-UHFFFAOYSA-N	0	0	275.417	4.424	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)[C@@H](C)CCc1cccc(F)c1	ZINC000540539180	333734478	/nfs/dbraw/zinc/73/44/78/333734478.db2.gz	UQLGNYKMGKNOQU-LSDHHAIUSA-N	0	0	291.410	4.255	20	30		CIEDRN
COc1cc(C#N)ccc1CNc1cc(SC)ccc1C	ZINC000540619060	333738571	/nfs/dbraw/zinc/73/85/71/333738571.db2.gz	VJWKJVBNLHTEOM-UHFFFAOYSA-N	0	0	298.411	4.209	20	30		CIEDRN
CCN(C(=O)[C@H]1CC[C@H](C)C1)c1ccc(C#N)c(Cl)c1	ZINC000540658324	333740675	/nfs/dbraw/zinc/74/06/75/333740675.db2.gz	RFBXKHCIKZBPSZ-RYUDHWBXSA-N	0	0	290.794	4.001	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(COc2ccc(Cl)cc2)no1	ZINC000564234042	333740942	/nfs/dbraw/zinc/74/09/42/333740942.db2.gz	LAZYWEOEMNKSQY-NSHDSACASA-N	0	0	292.766	4.372	20	30		CIEDRN
CC(C)C[C@@H]1C[C@H](Nc2cc(Cl)ccc2C#N)CCO1	ZINC000540709114	333742916	/nfs/dbraw/zinc/74/29/16/333742916.db2.gz	KSHBMWXWGUXZQD-HUUCEWRRSA-N	0	0	292.810	4.217	20	30		CIEDRN
N#Cc1cc(NC2CCCCCC2)nc2ccccc12	ZINC000069052349	333750695	/nfs/dbraw/zinc/75/06/95/333750695.db2.gz	ILAROIOEZOLTJH-UHFFFAOYSA-N	0	0	265.360	4.241	20	30		CIEDRN
CCC(CC)CC(=O)Nc1ccccc1SCCC#N	ZINC000129188046	333752384	/nfs/dbraw/zinc/75/23/84/333752384.db2.gz	OAMUOTRNQHYTJL-UHFFFAOYSA-N	0	0	290.432	4.457	20	30		CIEDRN
C=C(C)COc1cccc(NCc2csc(CC)n2)c1	ZINC000129266575	333754326	/nfs/dbraw/zinc/75/43/26/333754326.db2.gz	VWMJVMYKJWPDOR-UHFFFAOYSA-N	0	0	288.416	4.273	20	30		CIEDRN
CO[C@H](C)CSCc1ccc(-c2ccccc2C#N)cc1	ZINC000541074725	333761467	/nfs/dbraw/zinc/76/14/67/333761467.db2.gz	WFPALFIVVFLDFC-CQSZACIVSA-N	0	0	297.423	4.493	20	30		CIEDRN
Cc1ccnc(N[C@@H](c2ccc(Cl)cc2)C2CC2)c1C#N	ZINC000541280700	333769605	/nfs/dbraw/zinc/76/96/05/333769605.db2.gz	XMEMCGOKZUPUML-MRXNPFEDSA-N	0	0	297.789	4.478	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccc(-c2ccc[nH]2)cc1	ZINC000541454047	333776674	/nfs/dbraw/zinc/77/66/74/333776674.db2.gz	KMKIKLBKDUUVNO-UHFFFAOYSA-N	0	0	283.375	4.112	20	30		CIEDRN
N#Cc1c(NC(=O)CCC2CCCC2)sc2c1CCC2	ZINC000069610828	333776802	/nfs/dbraw/zinc/77/68/02/333776802.db2.gz	BTWFBVMJOIEVRS-UHFFFAOYSA-N	0	0	288.416	4.017	20	30		CIEDRN
C=CCCCc1nc(-c2ccc(Cl)cc2F)no1	ZINC000576128036	335158507	/nfs/dbraw/zinc/15/85/07/335158507.db2.gz	RKGCXDIIACSOJH-UHFFFAOYSA-N	0	0	266.703	4.038	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)[C@@H](C)CCC(C)(C)C	ZINC000541584197	333782317	/nfs/dbraw/zinc/78/23/17/333782317.db2.gz	XWVZBZIWSZVFJC-ZDUSSCGKSA-N	0	0	272.392	4.268	20	30		CIEDRN
N#Cc1ccc(CNc2cccc(C(F)F)c2Cl)o1	ZINC000541763855	333791031	/nfs/dbraw/zinc/79/10/31/333791031.db2.gz	ZIAZGCXHCXOHNK-UHFFFAOYSA-N	0	0	282.677	4.354	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)c1cccc(SC)c1	ZINC000129872795	333797123	/nfs/dbraw/zinc/79/71/23/333797123.db2.gz	LEFKVZJIOVGPQQ-UHFFFAOYSA-N	0	0	275.417	4.140	20	30		CIEDRN
Cc1nc2ccccc2cc1OCc1ccc(F)cc1C#N	ZINC000576140128	335159805	/nfs/dbraw/zinc/15/98/05/335159805.db2.gz	AWSPCWVFLFYLQT-UHFFFAOYSA-N	0	0	292.313	4.133	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2ccc(C)c(OC)c2)no1	ZINC000576145355	335160191	/nfs/dbraw/zinc/16/01/91/335160191.db2.gz	CUTRUSNDCUMCFB-LBPRGKRZSA-N	0	0	272.348	4.123	20	30		CIEDRN
Cc1ccc(C(=O)N(C)c2cccc(C#N)c2)c(Cl)c1C	ZINC000542144605	333811783	/nfs/dbraw/zinc/81/17/83/333811783.db2.gz	QYQVBRHPTJBEBL-UHFFFAOYSA-N	0	0	298.773	4.105	20	30		CIEDRN
CC(C)(C)c1cnc(SCc2ccc(F)cc2C#N)o1	ZINC000130119131	333816642	/nfs/dbraw/zinc/81/66/42/333816642.db2.gz	PDUJZKRLMZFQIR-UHFFFAOYSA-N	0	0	290.363	4.275	20	30		CIEDRN
Cc1ccc2oc(S[C@H](C#N)C3CCCCC3)nc2n1	ZINC000542219059	333816853	/nfs/dbraw/zinc/81/68/53/333816853.db2.gz	UNMZGMUCIMRSSS-CYBMUJFWSA-N	0	0	287.388	4.096	20	30		CIEDRN
C/C(=C/c1cccc(C(F)(F)F)c1)CN(C)C[C@@H](C)C#N	ZINC000576147932	335160497	/nfs/dbraw/zinc/16/04/97/335160497.db2.gz	SOSNXXSNBARWOI-OTAKNEKHSA-N	0	0	296.336	4.200	20	30		CIEDRN
C=C(CC)CN[C@H](c1cccc(F)c1F)C(F)(F)F	ZINC000542260525	333819208	/nfs/dbraw/zinc/81/92/08/333819208.db2.gz	DERPDQWCQYSIIE-GFCCVEGCSA-N	0	0	279.252	4.124	20	30		CIEDRN
CC(C)[C@H](NCC1(C#N)CC1)c1ccc(Cl)cc1F	ZINC000542919413	333849627	/nfs/dbraw/zinc/84/96/27/333849627.db2.gz	NGWPFKICNAJKFY-AWEZNQCLSA-N	0	0	280.774	4.070	20	30		CIEDRN
N#Cc1cccc(SCCCc2ccsc2)c1	ZINC000543033079	333853313	/nfs/dbraw/zinc/85/33/13/333853313.db2.gz	YKCLHPXZIYEYCQ-UHFFFAOYSA-N	0	0	259.399	4.345	20	30		CIEDRN
N#CCC[C@H](NCc1ccccc1Cl)c1ccccc1	ZINC000130604578	333857281	/nfs/dbraw/zinc/85/72/81/333857281.db2.gz	JTHNEXAJWGPZEP-KRWDZBQOSA-N	0	0	284.790	4.475	20	30		CIEDRN
Cc1c(Cl)cnc(N2C[C@@H](C)[C@H]2c2ccccc2)c1C#N	ZINC000543133905	333859651	/nfs/dbraw/zinc/85/96/51/333859651.db2.gz	MHFYSJWQABQZRU-BZNIZROVSA-N	0	0	297.789	4.113	20	30		CIEDRN
C=CCNC(=O)[C@H](C)S[C@H](C)c1ccc(C(C)C)cc1	ZINC000543151970	333861185	/nfs/dbraw/zinc/86/11/85/333861185.db2.gz	XJBAPDKHMRXIQF-KGLIPLIRSA-N	0	0	291.460	4.295	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1ccccc1Nc1ccccc1	ZINC000071808883	333879737	/nfs/dbraw/zinc/87/97/37/333879737.db2.gz	UFSACFIWWPUTRF-UHFFFAOYSA-N	0	0	294.398	4.468	20	30		CIEDRN
C=CCN(C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1)c1ccccc1	ZINC000071846392	333885812	/nfs/dbraw/zinc/88/58/12/333885812.db2.gz	UYQQJDKPJHYKQW-ZWKOTPCHSA-N	0	0	295.357	4.148	20	30		CIEDRN
C=CCCN[C@@H](c1ccc(OC(F)F)cc1)C(F)(F)F	ZINC000543753939	333895823	/nfs/dbraw/zinc/89/58/23/333895823.db2.gz	KQHWXNNHDQPNNJ-NSHDSACASA-N	0	0	295.251	4.057	20	30		CIEDRN
C[C@H](Sc1cccc(Cl)c1C#N)C(=O)OC(C)(C)C	ZINC000543958331	333906875	/nfs/dbraw/zinc/90/68/75/333906875.db2.gz	BCICFAVQQUSWLN-VIFPVBQESA-N	0	0	297.807	4.034	20	30		CIEDRN
Cc1cccc(C)c1[C@@H](C)NC(=O)Nc1cccc(C#N)c1	ZINC000544844041	333948798	/nfs/dbraw/zinc/94/87/98/333948798.db2.gz	IRSJGVVECPAIOB-CQSZACIVSA-N	0	0	293.370	4.058	20	30		CIEDRN
C=CCC(CC=C)c1nc(Cc2ccc(F)cc2F)no1	ZINC000544951561	333954738	/nfs/dbraw/zinc/95/47/38/333954738.db2.gz	SEOZJPFEVSLDBD-UHFFFAOYSA-N	0	0	290.313	4.174	20	30		CIEDRN
C=C[C@@H](Cc1nc(-c2nc(C)cs2)no1)c1ccccc1	ZINC000545080381	333962293	/nfs/dbraw/zinc/96/22/93/333962293.db2.gz	CPLNCIIFELHKKZ-LBPRGKRZSA-N	0	0	297.383	4.014	20	30		CIEDRN
C=C[C@@H](Cc1nc([C@H](C)C2CC2)no1)c1ccccc1	ZINC000545103216	333963206	/nfs/dbraw/zinc/96/32/06/333963206.db2.gz	IJXNRYLWUCAPHW-OLZOCXBDSA-N	0	0	268.360	4.095	20	30		CIEDRN
C=C[C@@H](Cc1nc(CCC(F)(F)F)no1)c1ccccc1	ZINC000545579641	333989497	/nfs/dbraw/zinc/98/94/97/333989497.db2.gz	DNKNTMLWILMTQB-NSHDSACASA-N	0	0	296.292	4.077	20	30		CIEDRN
C=CCCCc1nc([C@@H](C)c2ccc(C)cc2)no1	ZINC000545672069	333994255	/nfs/dbraw/zinc/99/42/55/333994255.db2.gz	QUUDAZORAVAKCU-ZDUSSCGKSA-N	0	0	256.349	4.039	20	30		CIEDRN
C[C@@H](c1noc(/C=C/c2ccc(C#N)cc2)n1)C(C)(C)C	ZINC000545727010	333997012	/nfs/dbraw/zinc/99/70/12/333997012.db2.gz	HNEJGAMKXGJSSO-VMPCVLLUSA-N	0	0	281.359	4.261	20	30		CIEDRN
C=CCCOCCCCc1nc([C@H](C)C(C)(C)C)no1	ZINC000545732496	333997294	/nfs/dbraw/zinc/99/72/94/333997294.db2.gz	JOIHKOKRIQOFGR-ZDUSSCGKSA-N	0	0	280.412	4.135	20	30		CIEDRN
C=CCCc1nc(-c2ccc(O[C@H](C)CC)cc2)no1	ZINC000545754109	333998546	/nfs/dbraw/zinc/99/85/46/333998546.db2.gz	PKAYHMPFRQTXLA-GFCCVEGCSA-N	0	0	272.348	4.033	20	30		CIEDRN
Cc1ccc(C[C@H](C#N)Sc2ccccc2)cc1	ZINC000074339476	334004225	/nfs/dbraw/zinc/00/42/25/334004225.db2.gz	RREDNWVNSOBNCK-MRXNPFEDSA-N	0	0	253.370	4.222	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H]1CCC[C@H]1c1ccccc1	ZINC000132773735	334005342	/nfs/dbraw/zinc/00/53/42/334005342.db2.gz	KLDSMTAXJOMKEZ-ZWKOTPCHSA-N	0	0	283.415	4.207	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@@H]1CCCc2ccccc21	ZINC000545924242	334006756	/nfs/dbraw/zinc/00/67/56/334006756.db2.gz	XFJOGJMOHWVZLT-RHSMWYFYSA-N	0	0	271.404	4.125	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(Cc2ccccc2Cl)no1	ZINC000545933622	334007541	/nfs/dbraw/zinc/00/75/41/334007541.db2.gz	WYASKQCGOOXUQX-LLVKDONJSA-N	0	0	276.767	4.384	20	30		CIEDRN
N#Cc1ccc(NCc2cccc(-c3cccnc3)c2)cc1	ZINC000132862609	334008160	/nfs/dbraw/zinc/00/81/60/334008160.db2.gz	AKRUGFOIJHQIGF-UHFFFAOYSA-N	0	0	285.350	4.232	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)N[C@H]1CCC[C@H]1CC	ZINC000132859919	334008240	/nfs/dbraw/zinc/00/82/40/334008240.db2.gz	WEYWMODOJFDSFO-HIFRSBDPSA-N	0	0	292.448	4.024	20	30		CIEDRN
N#Cc1cccc(NCc2cccc(-c3ccccn3)c2)c1	ZINC000132871303	334008432	/nfs/dbraw/zinc/00/84/32/334008432.db2.gz	QNIKNMSTDLQSIV-UHFFFAOYSA-N	0	0	285.350	4.232	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(O)c2ccccc12	ZINC000545954600	334009205	/nfs/dbraw/zinc/00/92/05/334009205.db2.gz	PMLBYNIUBZMUGF-GFCCVEGCSA-N	0	0	269.344	4.086	20	30		CIEDRN
C=CCC[C@@H](CCC)Nc1cccc2c1CCN2C(C)=O	ZINC000545985869	334010844	/nfs/dbraw/zinc/01/08/44/334010844.db2.gz	ULPLBZVRASOLCT-OAHLLOKOSA-N	0	0	286.419	4.142	20	30		CIEDRN
CCCCn1ncc(N[C@@H](C)c2ccc(C#N)cc2)c1C	ZINC000133039434	334014087	/nfs/dbraw/zinc/01/40/87/334014087.db2.gz	ROFUDHKXGNBHFB-ZDUSSCGKSA-N	0	0	282.391	4.036	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@H](CC)CC(F)(F)F)c1ccccc1	ZINC000546169450	334018008	/nfs/dbraw/zinc/01/80/08/334018008.db2.gz	UVWRTBFUNWQBQM-TZMCWYRMSA-N	0	0	299.336	4.194	20	30		CIEDRN
N#Cc1ccc(SCc2cccc(-n3cccn3)c2)cc1	ZINC000546189582	334019102	/nfs/dbraw/zinc/01/91/02/334019102.db2.gz	JKRLDRGABWNHKX-UHFFFAOYSA-N	0	0	291.379	4.036	20	30		CIEDRN
C[C@@H](CC(=O)Nc1sccc1C#N)C1CCCCC1	ZINC000133216735	334028086	/nfs/dbraw/zinc/02/80/86/334028086.db2.gz	CDHREQOKXACECG-NSHDSACASA-N	0	0	276.405	4.165	20	30		CIEDRN
C[C@@H](c1noc(/C=C\c2cccc(C#N)c2)n1)C(C)(C)C	ZINC000546418525	334031597	/nfs/dbraw/zinc/03/15/97/334031597.db2.gz	GAGDSOHAEQAEGB-LAUAKBEESA-N	0	0	281.359	4.261	20	30		CIEDRN
C[C@@H](c1noc(/C=C/c2cccc(C#N)c2)n1)C(C)(C)C	ZINC000546418522	334031622	/nfs/dbraw/zinc/03/16/22/334031622.db2.gz	GAGDSOHAEQAEGB-BCPZQOPPSA-N	0	0	281.359	4.261	20	30		CIEDRN
Cc1cc(C#N)ccc1-c1nc([C@@H](C)C(C)(C)C)no1	ZINC000546424451	334032033	/nfs/dbraw/zinc/03/20/33/334032033.db2.gz	FFXNVUVTFWGKSF-LLVKDONJSA-N	0	0	269.348	4.066	20	30		CIEDRN
C=CCCc1nc(-c2ccc(N3CC[C@@H](C)C3)c(C)c2)no1	ZINC000546493877	334035667	/nfs/dbraw/zinc/03/56/67/334035667.db2.gz	GWYJSGPGFMYRLL-CYBMUJFWSA-N	0	0	297.402	4.010	20	30		CIEDRN
C=CCCc1nc(-c2ccc(N3CC[C@H](C)C3)c(C)c2)no1	ZINC000546493883	334035682	/nfs/dbraw/zinc/03/56/82/334035682.db2.gz	GWYJSGPGFMYRLL-ZDUSSCGKSA-N	0	0	297.402	4.010	20	30		CIEDRN
C=CCCO[C@H](C)c1nc([C@@H](C)c2ccccc2C)no1	ZINC000546546516	334038237	/nfs/dbraw/zinc/03/82/37/334038237.db2.gz	VHFKIKYHYARPIS-UONOGXRCSA-N	0	0	286.375	4.184	20	30		CIEDRN
N#Cc1ccc(NCc2cc3ccccc3s2)cc1	ZINC000546622874	334041066	/nfs/dbraw/zinc/04/10/66/334041066.db2.gz	FIMCTCZEHSBTLR-UHFFFAOYSA-N	0	0	264.353	4.385	20	30		CIEDRN
CCc1oc2ccccc2c1CNc1cc(CC#N)ccn1	ZINC000546634906	334042554	/nfs/dbraw/zinc/04/25/54/334042554.db2.gz	LNPURNHWEYPXNZ-UHFFFAOYSA-N	0	0	291.354	4.068	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cccc(CSC)c1	ZINC000546638335	334042696	/nfs/dbraw/zinc/04/26/96/334042696.db2.gz	DFDCVDDRPZUKHS-GFCCVEGCSA-N	0	0	263.406	4.090	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N[C@@H](C)c1c(F)cccc1Cl	ZINC000546667738	334044805	/nfs/dbraw/zinc/04/48/05/334044805.db2.gz	UVFXCOPUWICOIV-WDEREUQCSA-N	0	0	298.789	4.194	20	30		CIEDRN
Cc1csc([C@H](C#N)C(=O)c2cccc(C3CCC3)c2)n1	ZINC000546679894	334045461	/nfs/dbraw/zinc/04/54/61/334045461.db2.gz	PFHRVPYUNRUKDS-OAHLLOKOSA-N	0	0	296.395	4.209	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H](C)c1c(C)cccc1C	ZINC000546866743	334052335	/nfs/dbraw/zinc/05/23/35/334052335.db2.gz	RPSNRQKJAHREPO-HNNXBMFYSA-N	0	0	271.404	4.249	20	30		CIEDRN
CC(C)c1ccc(C(=O)N(C)c2ccc(C#N)cc2)s1	ZINC000546894986	334054358	/nfs/dbraw/zinc/05/43/58/334054358.db2.gz	UMVOYZUQKCJJSI-UHFFFAOYSA-N	0	0	284.384	4.020	20	30		CIEDRN
COc1cccc(OCc2ccccc2C(C)(C)C#N)c1	ZINC000133800272	334058436	/nfs/dbraw/zinc/05/84/36/334058436.db2.gz	KMRWNJUMXKYICP-UHFFFAOYSA-N	0	0	281.355	4.075	20	30		CIEDRN
C[C@H]1CCC[C@H](c2noc(C3(C#N)CCCCC3)n2)C1	ZINC000547056554	334064282	/nfs/dbraw/zinc/06/42/82/334064282.db2.gz	JRLSQNMYMOBLHT-STQMWFEESA-N	0	0	273.380	4.089	20	30		CIEDRN
Cc1cc(C)cc(-c2noc(-c3ccc(CC#N)cc3)n2)c1	ZINC000547102893	334066539	/nfs/dbraw/zinc/06/65/39/334066539.db2.gz	CARNANMKMVCAHD-UHFFFAOYSA-N	0	0	289.338	4.087	20	30		CIEDRN
C=CCCCc1nc([C@@H](C)c2ccccc2C)no1	ZINC000547249902	334074931	/nfs/dbraw/zinc/07/49/31/334074931.db2.gz	LXHVFJBQQPHVCW-ZDUSSCGKSA-N	0	0	256.349	4.039	20	30		CIEDRN
N#Cc1ccc(NCc2cnc(-c3ccsc3)s2)cc1	ZINC000547325471	334079493	/nfs/dbraw/zinc/07/94/93/334079493.db2.gz	GQEMXXVUFDNIKC-UHFFFAOYSA-N	0	0	297.408	4.355	20	30		CIEDRN
CCSc1cccc(C(=O)Nc2ccc(CC#N)cc2)c1	ZINC000134110525	334080677	/nfs/dbraw/zinc/08/06/77/334080677.db2.gz	BDVFUQWJUJZING-UHFFFAOYSA-N	0	0	296.395	4.117	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H]1CCCC[C@@H]1CCC	ZINC000547341259	334081325	/nfs/dbraw/zinc/08/13/25/334081325.db2.gz	GIJIYPFZTJLAIW-KKUMJFAQSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H]1CCCC[C@H]1CCC	ZINC000547341262	334081421	/nfs/dbraw/zinc/08/14/21/334081421.db2.gz	GIJIYPFZTJLAIW-ZNMIVQPWSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=CCCCN(C)C(=O)c1ccc(-c2ccccc2F)o1	ZINC000076491398	334082638	/nfs/dbraw/zinc/08/26/38/334082638.db2.gz	MGTDKRDWNXBFPE-UHFFFAOYSA-N	0	0	287.334	4.124	20	30		CIEDRN
CC1(C)Cc2cccc(CNc3ccc(CC#N)cc3)c2O1	ZINC000134267727	334086033	/nfs/dbraw/zinc/08/60/33/334086033.db2.gz	JFUMNUCZRZDGMR-UHFFFAOYSA-N	0	0	292.382	4.078	20	30		CIEDRN
C=CCCCN(C)C(=O)c1cc2cc(F)ccc2s1	ZINC000076650956	334086675	/nfs/dbraw/zinc/08/66/75/334086675.db2.gz	PCOKUXWEIJNZIA-UHFFFAOYSA-N	0	0	277.364	4.079	20	30		CIEDRN
C=CCCn1cnc2scc(-c3ccc(C)cc3)c2c1=O	ZINC000547464418	334090437	/nfs/dbraw/zinc/09/04/37/334090437.db2.gz	XSBNWVVUKWPTAL-UHFFFAOYSA-N	0	0	296.395	4.010	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1cccc2cc[nH]c21)c1ccccc1	ZINC000547497836	334094537	/nfs/dbraw/zinc/09/45/37/334094537.db2.gz	XUZRRPQRFHWMMX-AWEZNQCLSA-N	0	0	290.366	4.466	20	30		CIEDRN
C=CCCC[C@@H](C)N1CCO[C@@H](c2ccc(F)cc2F)C1	ZINC000547648056	334105528	/nfs/dbraw/zinc/10/55/28/334105528.db2.gz	SUBCCBZWYDTEMH-CXAGYDPISA-N	0	0	295.373	4.083	20	30		CIEDRN
N#Cc1cccc(CNc2ccc(F)cc2OCC2CC2)c1	ZINC000077464457	334105619	/nfs/dbraw/zinc/10/56/19/334105619.db2.gz	YCUKYTQKWOXWEO-UHFFFAOYSA-N	0	0	296.345	4.098	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)c1ccc(Cl)c(C)c1	ZINC000135024017	334112623	/nfs/dbraw/zinc/11/26/23/334112623.db2.gz	GEGGAJQRLTVXTH-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1ccsc1)c1ccccc1	ZINC000135056671	334113967	/nfs/dbraw/zinc/11/39/67/334113967.db2.gz	VZLSSRQIJIPXHW-GFCCVEGCSA-N	0	0	257.358	4.047	20	30		CIEDRN
Cc1ccnc(N(C)[C@@H](C)c2cccc(Cl)c2)c1C#N	ZINC000135076702	334114594	/nfs/dbraw/zinc/11/45/94/334114594.db2.gz	PPVYJIAYVPKHKO-LBPRGKRZSA-N	0	0	285.778	4.113	20	30		CIEDRN
N#Cc1cccc(SCCCCc2ccccc2)n1	ZINC000547791756	334118875	/nfs/dbraw/zinc/11/88/75/334118875.db2.gz	JFFUHLQQQQSMOK-UHFFFAOYSA-N	0	0	268.385	4.068	20	30		CIEDRN
Clc1ccccc1C#CCNc1cccc2cc[nH]c21	ZINC000547811750	334121095	/nfs/dbraw/zinc/12/10/95/334121095.db2.gz	CMLKLZJFKNUTLJ-UHFFFAOYSA-N	0	0	280.758	4.285	20	30		CIEDRN
CC[C@@](C)(NCc1ccc(Cl)cc1C#N)C(F)(F)F	ZINC000547833819	334125069	/nfs/dbraw/zinc/12/50/69/334125069.db2.gz	VWLQONLKZKMYOZ-GFCCVEGCSA-N	0	0	290.716	4.032	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@H](CC)c1ccc(C)cc1	ZINC000078318565	334130998	/nfs/dbraw/zinc/13/09/98/334130998.db2.gz	QYSSTHSPKCCEIS-MRXNPFEDSA-N	0	0	274.408	4.054	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@@H](C)c1cc2ccccc2o1	ZINC000135474180	334131250	/nfs/dbraw/zinc/13/12/50/334131250.db2.gz	KVMYGPKZSGEYGA-SJCJKPOMSA-N	0	0	271.360	4.212	20	30		CIEDRN
CC(=O)Nc1cc(NCC(C)(C)CCC#N)ccc1Cl	ZINC000135527279	334132557	/nfs/dbraw/zinc/13/25/57/334132557.db2.gz	AVLJIOGNJZSRTO-UHFFFAOYSA-N	0	0	293.798	4.040	20	30		CIEDRN
C=CCN(CCc1ccccc1)C(=O)c1ccc(F)c(C)c1	ZINC000078414026	334133173	/nfs/dbraw/zinc/13/31/73/334133173.db2.gz	ZWHWUVDFNKNCCM-UHFFFAOYSA-N	0	0	297.373	4.005	20	30		CIEDRN
CCc1cccc(NC(=O)N(CCC#N)CCC(C)C)c1	ZINC000078457746	334134129	/nfs/dbraw/zinc/13/41/29/334134129.db2.gz	ISMNXODOMSYQJZ-UHFFFAOYSA-N	0	0	287.407	4.043	20	30		CIEDRN
C=C(C)CSCc1coc(-c2cccs2)n1	ZINC000078541954	334135561	/nfs/dbraw/zinc/13/55/61/334135561.db2.gz	CLCSDYMOFFMTDZ-UHFFFAOYSA-N	0	0	251.376	4.212	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)c1cc(C)ccc1F	ZINC000078651715	334138409	/nfs/dbraw/zinc/13/84/09/334138409.db2.gz	DREBKOQZPBTWDC-UHFFFAOYSA-N	0	0	289.394	4.343	20	30		CIEDRN
CCCc1nc(CNc2ccc(Cl)c(C#N)c2)cs1	ZINC000078794914	334140765	/nfs/dbraw/zinc/14/07/65/334140765.db2.gz	GPWBBDQAPKRWIE-UHFFFAOYSA-N	0	0	291.807	4.233	20	30		CIEDRN
N#Cc1ccc(C(F)(F)F)nc1NCCC1=CCCCC1	ZINC000078832455	334141232	/nfs/dbraw/zinc/14/12/32/334141232.db2.gz	NYKVJMOLXUFDNG-UHFFFAOYSA-N	0	0	295.308	4.274	20	30		CIEDRN
C[C@@H]1CCC[C@@H](Nc2nc(C(F)(F)F)ccc2C#N)[C@@H]1C	ZINC000078832569	334141243	/nfs/dbraw/zinc/14/12/43/334141243.db2.gz	UXJNRGKTTWXWPX-CKYFFXLPSA-N	0	0	297.324	4.209	20	30		CIEDRN
CN(c1nc(C(F)(F)F)ccc1C#N)C1CCCCCC1	ZINC000078833441	334141284	/nfs/dbraw/zinc/14/12/84/334141284.db2.gz	KLMKANJPDLDGTB-UHFFFAOYSA-N	0	0	297.324	4.131	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)C[C@@H](C)n1cccc1	ZINC000548420908	334155261	/nfs/dbraw/zinc/15/52/61/334155261.db2.gz	XRRIMDYSWLVNTA-QGZVFWFLSA-N	0	0	296.414	4.044	20	30		CIEDRN
N#Cc1cnccc1Nc1ccc(OC2CCCC2)cc1	ZINC000548479889	334159341	/nfs/dbraw/zinc/15/93/41/334159341.db2.gz	FIFMAWBMDKZYIS-UHFFFAOYSA-N	0	0	279.343	4.018	20	30		CIEDRN
CC(C)c1ccc(CSc2ccncc2C#N)cc1	ZINC000548480316	334159526	/nfs/dbraw/zinc/15/95/26/334159526.db2.gz	DMEDKLCGLIYHQR-UHFFFAOYSA-N	0	0	268.385	4.369	20	30		CIEDRN
CC[C@H](C#N)Nc1ccc(-c2ccccc2)cc1C	ZINC000548683717	334165735	/nfs/dbraw/zinc/16/57/35/334165735.db2.gz	FHOSLQBMIDBXMB-MRXNPFEDSA-N	0	0	250.345	4.376	20	30		CIEDRN
C[C@H](CCc1ccccc1F)Nc1ccc(CC#N)cc1	ZINC000136953717	334165825	/nfs/dbraw/zinc/16/58/25/334165825.db2.gz	JJWAKMCTMNYEKC-CQSZACIVSA-N	0	0	282.362	4.325	20	30		CIEDRN
C=CCCCCCN(C)C(=O)C1(C)CCCCC1	ZINC000548693473	334166216	/nfs/dbraw/zinc/16/62/16/334166216.db2.gz	MVSLLFPONRSTCL-UHFFFAOYSA-N	0	0	251.414	4.162	20	30		CIEDRN
Cc1ccc(C[C@@H](C)Nc2ccc(F)cc2C#N)s1	ZINC000080245119	334168408	/nfs/dbraw/zinc/16/84/08/334168408.db2.gz	OANIXYKBHMGGAJ-SNVBAGLBSA-N	0	0	274.364	4.110	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1cccc(F)c1C)c1ccccc1	ZINC000137179751	334171028	/nfs/dbraw/zinc/17/10/28/334171028.db2.gz	BDMRFAMANYXZCG-CQSZACIVSA-N	0	0	283.346	4.433	20	30		CIEDRN
Cc1ccc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cc1C	ZINC000080452288	334171728	/nfs/dbraw/zinc/17/17/28/334171728.db2.gz	AMAZDZHQQPACPF-CQSZACIVSA-N	0	0	298.411	4.373	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)NCCCC1CC1	ZINC000548809141	334175085	/nfs/dbraw/zinc/17/50/85/334175085.db2.gz	VXGWSXFWQFDITD-UHFFFAOYSA-N	0	0	272.392	4.117	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1cc2ccccn2c1	ZINC000548838445	334175833	/nfs/dbraw/zinc/17/58/33/334175833.db2.gz	XOIAGAODTORJEZ-UHFFFAOYSA-N	0	0	290.366	4.310	20	30		CIEDRN
C=C[C@H](CC(=O)NCC(C)(C)C(F)(F)F)c1ccccc1	ZINC000549061899	334184364	/nfs/dbraw/zinc/18/43/64/334184364.db2.gz	WURGUQZMGBEQER-GFCCVEGCSA-N	0	0	299.336	4.051	20	30		CIEDRN
Cc1nc(C(C)C)ccc1COc1ccc(C#N)c(F)c1	ZINC000549336739	334190046	/nfs/dbraw/zinc/19/00/46/334190046.db2.gz	IKNIIGMFIWHFNK-UHFFFAOYSA-N	0	0	284.334	4.103	20	30		CIEDRN
N#CCc1ccc(N[C@H]2CCC[C@@H](C3CC3)C2)cc1	ZINC000081633385	334201193	/nfs/dbraw/zinc/20/11/93/334201193.db2.gz	ALYGSPBSECYYFS-WBVHZDCISA-N	0	0	254.377	4.133	20	30		CIEDRN
CC[C@H](CC(=O)Nc1ccccc1CC#N)c1ccccc1	ZINC000549713571	334202578	/nfs/dbraw/zinc/20/25/78/334202578.db2.gz	YJJNBSNBBNEHSM-OAHLLOKOSA-N	0	0	292.382	4.275	20	30		CIEDRN
C=C(C)[C@H](CC(=O)N(CC)c1ccccc1Cl)OCC	ZINC000549958553	334210370	/nfs/dbraw/zinc/21/03/70/334210370.db2.gz	MMOPVYCZNLVMFW-HNNXBMFYSA-N	0	0	295.810	4.064	20	30		CIEDRN
CC(C)CC1(C(=O)N2CCc3ccc(C#N)cc32)CCCC1	ZINC000550154099	334214428	/nfs/dbraw/zinc/21/44/28/334214428.db2.gz	NWTBWKQRQLXBKY-UHFFFAOYSA-N	0	0	296.414	4.054	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1occc1C(C)C	ZINC000550323713	334220439	/nfs/dbraw/zinc/22/04/39/334220439.db2.gz	PJPZSIFGZKRNQL-UHFFFAOYSA-N	0	0	263.381	4.221	20	30		CIEDRN
N#Cc1ccccc1NC(=O)[C@@H]1CC[C@@H]2CCCC[C@H]2C1	ZINC000245876424	334222622	/nfs/dbraw/zinc/22/26/22/334222622.db2.gz	HEJNTYMNJFELBP-SOUVJXGZSA-N	0	0	282.387	4.103	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H](CCC)Cc1ccccc1	ZINC000550604920	334225018	/nfs/dbraw/zinc/22/50/18/334225018.db2.gz	YZIZGHXOIXSMNM-MRXNPFEDSA-N	0	0	273.420	4.116	20	30		CIEDRN
C=C1CCN(C(=O)[C@H](CCc2ccccc2)C(C)C)CC1	ZINC000550721167	334227901	/nfs/dbraw/zinc/22/79/01/334227901.db2.gz	JVLHVTVUTZNZGT-GOSISDBHSA-N	0	0	285.431	4.070	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CCC[C@@H](C(C)(C)C)CC1	ZINC000550829785	334229622	/nfs/dbraw/zinc/22/96/22/334229622.db2.gz	LBBZEGKLGNIJEZ-CQSZACIVSA-N	0	0	265.441	4.264	20	30		CIEDRN
N#Cc1ccc(COc2cnc3ccc(Cl)cc3c2)cc1	ZINC000550982951	334235464	/nfs/dbraw/zinc/23/54/64/334235464.db2.gz	IFSBBKCHPHTSEO-UHFFFAOYSA-N	0	0	294.741	4.339	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ccoc2CCC)n1	ZINC000551108962	334238851	/nfs/dbraw/zinc/23/88/51/334238851.db2.gz	HVPXXNCXZIRELY-UHFFFAOYSA-N	0	0	260.337	4.136	20	30		CIEDRN
C=CCC(C)(C)c1noc(/C=C\c2ccccc2OC)n1	ZINC000551472833	334251187	/nfs/dbraw/zinc/25/11/87/334251187.db2.gz	ZUQWOYGJHUELMZ-KHPPLWFESA-N	0	0	284.359	4.102	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ccc(F)cc2Cl)n1	ZINC000551471448	334251277	/nfs/dbraw/zinc/25/12/77/334251277.db2.gz	FJYQTHHEKIIFDT-UHFFFAOYSA-N	0	0	280.730	4.383	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H]2CCCC(F)(F)C2)n1	ZINC000551492100	334251513	/nfs/dbraw/zinc/25/15/13/334251513.db2.gz	LWBWZSAULDOYMA-JTQLQIEISA-N	0	0	270.323	4.216	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H]2Cc3ccccc3S2)n1	ZINC000551492452	334251565	/nfs/dbraw/zinc/25/15/65/334251565.db2.gz	QSFADBFPFGTFAY-CYBMUJFWSA-N	0	0	286.400	4.313	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H](C)COc2ccccc2)n1	ZINC000551499597	334251706	/nfs/dbraw/zinc/25/17/06/334251706.db2.gz	TWBVKTFXTAFTOK-CYBMUJFWSA-N	0	0	286.375	4.106	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ccccc2OC(C)C)n1	ZINC000551496307	334251708	/nfs/dbraw/zinc/25/17/08/334251708.db2.gz	IMRSIEOYKFGRAY-UHFFFAOYSA-N	0	0	286.375	4.378	20	30		CIEDRN
CC[C@H]1CCCC[C@@H]1c1noc(-c2ccc(C#N)cc2)n1	ZINC000551532514	334252934	/nfs/dbraw/zinc/25/29/34/334252934.db2.gz	WBNGRBDYIDEREI-ZFWWWQNUSA-N	0	0	281.359	4.292	20	30		CIEDRN
CC[C@@H]1CCCC[C@H]1c1noc(-c2ccc(C#N)cc2)n1	ZINC000551532513	334252995	/nfs/dbraw/zinc/25/29/95/334252995.db2.gz	WBNGRBDYIDEREI-UKRRQHHQSA-N	0	0	281.359	4.292	20	30		CIEDRN
C=C(C)[C@H]1OCC[C@H]1c1nc([C@H]2CCCC[C@H]2CC)no1	ZINC000551534540	334253369	/nfs/dbraw/zinc/25/33/69/334253369.db2.gz	NNYHONKRTBBCQM-LXTVHRRPSA-N	0	0	290.407	4.202	20	30		CIEDRN
C[C@H](C#N)CNCc1ccc(-c2ccc(Cl)cc2)cc1	ZINC000551552350	334253905	/nfs/dbraw/zinc/25/39/05/334253905.db2.gz	MCEPKOVQBPOEJK-CYBMUJFWSA-N	0	0	284.790	4.256	20	30		CIEDRN
CC#CCCCC(=O)NC1(c2ccc(Cl)cc2)CCC1	ZINC000551695707	334258077	/nfs/dbraw/zinc/25/80/77/334258077.db2.gz	CKKCTKSHPAVMRJ-UHFFFAOYSA-N	0	0	289.806	4.029	20	30		CIEDRN
C=CCn1c(C(C)C)nnc1N(Cc1ccccc1)C(C)C	ZINC000564381969	334258481	/nfs/dbraw/zinc/25/84/81/334258481.db2.gz	ZFMSUTVZPFEECD-UHFFFAOYSA-N	0	0	298.434	4.003	20	30		CIEDRN
CCC[C@@H](C(=O)N(CCC#N)c1ccc(F)cc1)C(C)C	ZINC000551924803	334266402	/nfs/dbraw/zinc/26/64/02/334266402.db2.gz	GOTGXEHHLNHHSK-MRXNPFEDSA-N	0	0	290.382	4.145	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Cc1coc2ccccc12	ZINC000552026925	334278215	/nfs/dbraw/zinc/27/82/15/334278215.db2.gz	LCZQZKZVAIBHKI-UHFFFAOYSA-N	0	0	285.387	4.180	20	30		CIEDRN
CC(C)[C@@H]1CC[C@@H]1Nc1cccc(OCCCC#N)c1	ZINC000552061977	334283572	/nfs/dbraw/zinc/28/35/72/334283572.db2.gz	HVGAVDKONIWQQJ-IRXDYDNUSA-N	0	0	272.392	4.216	20	30		CIEDRN
C=C1CCN(C(=O)c2ccccc2Nc2ccccc2)CC1	ZINC000552106034	334290382	/nfs/dbraw/zinc/29/03/82/334290382.db2.gz	TUHVAMVZENALPW-UHFFFAOYSA-N	0	0	292.382	4.222	20	30		CIEDRN
CSc1ccc(C)c(C(=O)Nc2ccc(CC#N)cc2)c1	ZINC000248174721	334296477	/nfs/dbraw/zinc/29/64/77/334296477.db2.gz	YMZUBORGNHRDHC-UHFFFAOYSA-N	0	0	296.395	4.035	20	30		CIEDRN
CCCCn1c(C)c(C)nc1SCc1ccc(C#N)cc1	ZINC000248224159	334297256	/nfs/dbraw/zinc/29/72/56/334297256.db2.gz	IPTLEHWQSQZKME-UHFFFAOYSA-N	0	0	299.443	4.464	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CC[C@H](C(C)(C)C)C[C@H]1C	ZINC000552195954	334301414	/nfs/dbraw/zinc/30/14/14/334301414.db2.gz	IRUNBCWGIBPBTR-KGLIPLIRSA-N	0	0	265.441	4.262	20	30		CIEDRN
C=CCC[C@H](NCc1ccc(F)cc1F)c1ccco1	ZINC000552252500	334308968	/nfs/dbraw/zinc/30/89/68/334308968.db2.gz	PISIUVRJMODQBK-HNNXBMFYSA-N	0	0	277.314	4.355	20	30		CIEDRN
C=CCC[C@@H](NCc1ccc(F)cc1F)c1ccco1	ZINC000552252501	334309101	/nfs/dbraw/zinc/30/91/01/334309101.db2.gz	PISIUVRJMODQBK-OAHLLOKOSA-N	0	0	277.314	4.355	20	30		CIEDRN
N#Cc1csc(CN2CC3(CCC3)[C@@H]2c2ccccc2)c1	ZINC000552316580	334316185	/nfs/dbraw/zinc/31/61/85/334316185.db2.gz	GCUSENWKXYOSKM-KRWDZBQOSA-N	0	0	294.423	4.347	20	30		CIEDRN
C=CCC[C@H](C)Nc1ccc(F)cc1OC1CCOCC1	ZINC000552326496	334317332	/nfs/dbraw/zinc/31/73/32/334317332.db2.gz	UQXZYIKEKJVZIS-ZDUSSCGKSA-N	0	0	293.382	4.150	20	30		CIEDRN
CCNc1ccc(C#N)cc1NC(=O)[C@@H](C)C(CC)CC	ZINC000552355093	334319727	/nfs/dbraw/zinc/31/97/27/334319727.db2.gz	YFTIBNQARACHER-LBPRGKRZSA-N	0	0	287.407	4.001	20	30		CIEDRN
CCOc1ccc(C#N)cc1N[C@H](C)c1ccccc1F	ZINC000552495450	334332012	/nfs/dbraw/zinc/33/20/12/334332012.db2.gz	YEVHHAVVNWNAKG-GFCCVEGCSA-N	0	0	284.334	4.269	20	30		CIEDRN
CC(C)C[C@H](C)CC(=O)Nc1cc(C#N)ccc1NC1CC1	ZINC000552586517	334338048	/nfs/dbraw/zinc/33/80/48/334338048.db2.gz	JZCGBBOFJKZCFB-ZDUSSCGKSA-N	0	0	299.418	4.143	20	30		CIEDRN
N#Cc1ccc(NCC(C2CC2)C2CC2)cc1Cl	ZINC000088457800	334338778	/nfs/dbraw/zinc/33/87/78/334338778.db2.gz	SXOQLAKRESPJCN-UHFFFAOYSA-N	0	0	260.768	4.060	20	30		CIEDRN
C=CCn1c(SC[C@H](C)CC)nnc1-c1ccoc1C	ZINC000088492518	334339039	/nfs/dbraw/zinc/33/90/39/334339039.db2.gz	WJYNPOMSYHLIHT-LLVKDONJSA-N	0	0	291.420	4.171	20	30		CIEDRN
C=CCN(CCC#N)C(=O)[C@H](CC1CCCCC1)C(C)C	ZINC000552755964	334344035	/nfs/dbraw/zinc/34/40/35/334344035.db2.gz	WOUAXSFUCKPMJD-QGZVFWFLSA-N	0	0	290.451	4.157	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc2c(Cl)cccc2n1	ZINC000552780271	334344765	/nfs/dbraw/zinc/34/47/65/334344765.db2.gz	JHYLXBLVMOGSDJ-NSHDSACASA-N	0	0	288.778	4.429	20	30		CIEDRN
C=CC[N@H+](CCCC(=O)c1ccccc1)Cc1cccs1	ZINC000552810178	334345932	/nfs/dbraw/zinc/34/59/32/334345932.db2.gz	PPLCJZUNCHIAPI-UHFFFAOYSA-N	0	0	299.439	4.399	20	30		CIEDRN
N#Cc1ccsc1NC(=O)c1cccc(-c2ccoc2)c1	ZINC000089720848	334349231	/nfs/dbraw/zinc/34/92/31/334349231.db2.gz	BYBFYAZCYHQLOR-UHFFFAOYSA-N	0	0	294.335	4.132	20	30		CIEDRN
N#Cc1ccccc1NC(=O)c1cccc(-c2ccoc2)c1	ZINC000089719119	334349414	/nfs/dbraw/zinc/34/94/14/334349414.db2.gz	LFRJYPFPXYQHPS-UHFFFAOYSA-N	0	0	288.306	4.071	20	30		CIEDRN
Cc1ccccc1[C@@H](C)N(C)c1nccc(C#N)c1Cl	ZINC000552952230	334352570	/nfs/dbraw/zinc/35/25/70/334352570.db2.gz	XAZVDLIKRXMXHL-GFCCVEGCSA-N	0	0	285.778	4.113	20	30		CIEDRN
Cc1ccc([C@H]2CCCN2c2nccc(C#N)c2Cl)cc1	ZINC000552976189	334354260	/nfs/dbraw/zinc/35/42/60/334354260.db2.gz	NGDAVVJORAQZSD-OAHLLOKOSA-N	0	0	297.789	4.257	20	30		CIEDRN
Cc1cc(C#N)nc(N[C@H](CC(C)(C)C)c2ccccc2)n1	ZINC000553080709	334360334	/nfs/dbraw/zinc/36/03/34/334360334.db2.gz	WWQKRSPGYXXXHE-MRXNPFEDSA-N	0	0	294.402	4.246	20	30		CIEDRN
C[C@H](NC(=O)CCCCC(C)(C)C)c1ccc(C#N)cc1	ZINC000553144404	334364653	/nfs/dbraw/zinc/36/46/53/334364653.db2.gz	SAGPRZMYHNQUOB-AWEZNQCLSA-N	0	0	286.419	4.342	20	30		CIEDRN
Cc1nsc(N[C@H]2CC(C)(C)c3ccccc32)c1C#N	ZINC000553169899	334366313	/nfs/dbraw/zinc/36/63/13/334366313.db2.gz	HMZUUCGVWSTIPJ-AWEZNQCLSA-N	0	0	283.400	4.158	20	30		CIEDRN
CCOC(=O)CC(C)(C)CCSc1ccccc1C#N	ZINC000553399323	334382743	/nfs/dbraw/zinc/38/27/43/334382743.db2.gz	LTUIUCPYLOETST-UHFFFAOYSA-N	0	0	291.416	4.020	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)cc1Cl)C1CC1	ZINC000553652683	334394538	/nfs/dbraw/zinc/39/45/38/334394538.db2.gz	DBXAZWPOHKGDKZ-UHFFFAOYSA-N	0	0	256.176	4.144	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCc1cccc(SCC)c1	ZINC000553668744	334395018	/nfs/dbraw/zinc/39/50/18/334395018.db2.gz	TYDNBEHZYQXDJT-UHFFFAOYSA-N	0	0	277.433	4.017	20	30		CIEDRN
Cc1cc(Oc2ncnc3ccccc32)c(C)c(C)c1C#N	ZINC000553727525	334397020	/nfs/dbraw/zinc/39/70/20/334397020.db2.gz	CUXLRNMGOPUBMF-UHFFFAOYSA-N	0	0	289.338	4.219	20	30		CIEDRN
CC(C)C[C@@H]1C[C@@H](Nc2ccc(C#N)c(Cl)c2)CCO1	ZINC000553785980	334398822	/nfs/dbraw/zinc/39/88/22/334398822.db2.gz	ODVVZSQNJIFNPI-LSDHHAIUSA-N	0	0	292.810	4.217	20	30		CIEDRN
C=CCC(CC=C)C(=O)NC[C@H](c1ccccc1)C1CC1	ZINC000554389948	334428084	/nfs/dbraw/zinc/42/80/84/334428084.db2.gz	WVCRPKXXLSXUEU-GOSISDBHSA-N	0	0	283.415	4.065	20	30		CIEDRN
C[C@@H]1CC[C@]2(CCN(c3cc(C#N)c4ccccc4n3)C2)C1	ZINC000554620352	334443689	/nfs/dbraw/zinc/44/36/89/334443689.db2.gz	VEEKLQSHWCCOIR-KUHUBIRLSA-N	0	0	291.398	4.123	20	30		CIEDRN
C[C@@H](CC(C)(C)C)C(=O)Nc1cc(C#N)c2ccccc2n1	ZINC000554776213	334451650	/nfs/dbraw/zinc/45/16/50/334451650.db2.gz	UCRCQTPXLWYMNB-LBPRGKRZSA-N	0	0	295.386	4.117	20	30		CIEDRN
C=C(C)CCNc1ccccc1-c1csc(C)n1	ZINC000554781404	334451888	/nfs/dbraw/zinc/45/18/88/334451888.db2.gz	YKUUIJITJNZVAC-UHFFFAOYSA-N	0	0	258.390	4.497	20	30		CIEDRN
N#CCc1ccccc1NC(=O)CC/C=C/c1ccccc1	ZINC000555526652	334480487	/nfs/dbraw/zinc/48/04/87/334480487.db2.gz	HOGLLXBPOLFTLP-ONNFQVAWSA-N	0	0	290.366	4.185	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(-c2ccccn2)cc1	ZINC000564521064	334510632	/nfs/dbraw/zinc/51/06/32/334510632.db2.gz	KZVJGHUCQSCSRR-CQSZACIVSA-N	0	0	280.371	4.289	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1cc(Cl)ccc1OC(C)C	ZINC000564688686	334516619	/nfs/dbraw/zinc/51/66/19/334516619.db2.gz	ASKSZFBSQFWVMV-NSHDSACASA-N	0	0	296.798	4.213	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1ccc2nccc(C)c2c1	ZINC000565261559	334548788	/nfs/dbraw/zinc/54/87/88/334548788.db2.gz	BGODROFCVMYTSJ-AWEZNQCLSA-N	0	0	282.387	4.018	20	30		CIEDRN
CC[C@H]1CCCC[C@@H]1C(=O)Nc1scc(C)c1C#N	ZINC000565328556	334553112	/nfs/dbraw/zinc/55/31/12/334553112.db2.gz	GFKIARUQTFQYED-RYUDHWBXSA-N	0	0	276.405	4.083	20	30		CIEDRN
C=CCCCN(C)C(=O)C[C@@H](CC)c1ccc(OC)cc1	ZINC000153100725	334554644	/nfs/dbraw/zinc/55/46/44/334554644.db2.gz	IJEANBSFLHFZCP-OAHLLOKOSA-N	0	0	289.419	4.004	20	30		CIEDRN
CC(C)(C)CCCC(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000153257488	334576837	/nfs/dbraw/zinc/57/68/37/334576837.db2.gz	AKEYFZDDSKEIKA-INIZCTEOSA-N	0	0	286.419	4.364	20	30		CIEDRN
CC(C)Oc1ccc(Cl)cc1N[C@H]1CC[C@@H](C#N)C1	ZINC000565804126	334598309	/nfs/dbraw/zinc/59/83/09/334598309.db2.gz	FKGQEAUXTONOOR-YPMHNXCESA-N	0	0	278.783	4.231	20	30		CIEDRN
N#Cc1c(N[C@H]2CCC[C@H](F)C2)cccc1C(F)F	ZINC000566483939	334652087	/nfs/dbraw/zinc/65/20/87/334652087.db2.gz	XZSHSWWUZRPPCJ-UWVGGRQHSA-N	0	0	268.282	4.188	20	30		CIEDRN
C[C@@H]1C[C@H](C(C)(C)C)CCN1C(=O)c1cccc(CC#N)c1	ZINC000566640393	334658824	/nfs/dbraw/zinc/65/88/24/334658824.db2.gz	HSZIHGPVQRILCE-RHSMWYFYSA-N	0	0	298.430	4.039	20	30		CIEDRN
Cc1csc(NC(=O)[C@@H](C)Cc2ccc(C)cc2)c1C#N	ZINC000566761349	334663366	/nfs/dbraw/zinc/66/33/66/334663366.db2.gz	BYTBRULKMIXUHE-LBPRGKRZSA-N	0	0	298.411	4.054	20	30		CIEDRN
CN(C(=O)c1ccc(C#N)c(Cl)c1)C1CCCCCC1	ZINC000153938156	334683637	/nfs/dbraw/zinc/68/36/37/334683637.db2.gz	LZZRIYPEBLYPDW-UHFFFAOYSA-N	0	0	290.794	4.006	20	30		CIEDRN
N#Cc1cccc(CSc2ccc(C#N)cc2Cl)c1	ZINC000154178090	334689861	/nfs/dbraw/zinc/68/98/61/334689861.db2.gz	FBTFUJVWCPZXFT-UHFFFAOYSA-N	0	0	284.771	4.376	20	30		CIEDRN
N#Cc1c(F)cccc1SCc1cc(F)ccc1F	ZINC000567331182	334704198	/nfs/dbraw/zinc/70/41/98/334704198.db2.gz	ATWKMVJTASETKX-UHFFFAOYSA-N	0	0	279.286	4.268	20	30		CIEDRN
COc1cc(C)c(N[C@@H](C)c2cccc(C#N)c2)cc1OC	ZINC000271940148	334748179	/nfs/dbraw/zinc/74/81/79/334748179.db2.gz	LQMUNWUHMYIBCS-ZDUSSCGKSA-N	0	0	296.370	4.057	20	30		CIEDRN
C[C@H](Nc1cccc(OCCCC#N)c1)c1ccc(F)cn1	ZINC000272012903	334748857	/nfs/dbraw/zinc/74/88/57/334748857.db2.gz	NHEONVCCSMTTLI-ZDUSSCGKSA-N	0	0	299.349	4.076	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@@H](C)c1cccc(OC)c1	ZINC000156789309	334749830	/nfs/dbraw/zinc/74/98/30/334749830.db2.gz	KNTKYPSABZVXJE-HNNXBMFYSA-N	0	0	289.419	4.004	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1ccc(OC(F)F)cc1	ZINC000156800296	334750231	/nfs/dbraw/zinc/75/02/31/334750231.db2.gz	HWECJMQIOCDMHF-UHFFFAOYSA-N	0	0	297.345	4.106	20	30		CIEDRN
N#Cc1cc(Cl)cc(OC[C@@H]2CCC3(CCCC3)O2)c1	ZINC000312891569	334755716	/nfs/dbraw/zinc/75/57/16/334755716.db2.gz	WMHNNQFFMDAOQK-AWEZNQCLSA-N	0	0	291.778	4.082	20	30		CIEDRN
N#CC1(CCSC[C@H]2CCCCO2)CCCCC1	ZINC000572587336	334760310	/nfs/dbraw/zinc/76/03/10/334760310.db2.gz	UYHDHIJVYIMHJK-CQSZACIVSA-N	0	0	267.438	4.153	20	30		CIEDRN
C=CCCNc1ccccc1C(=O)N(C)C1CCCCC1	ZINC000157161804	334761702	/nfs/dbraw/zinc/76/17/02/334761702.db2.gz	NXKOBKYFYJTITO-UHFFFAOYSA-N	0	0	286.419	4.079	20	30		CIEDRN
CCC(CC)C(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl	ZINC000157881718	334786963	/nfs/dbraw/zinc/78/69/63/334786963.db2.gz	LJYODVQDJXQIJL-LBPRGKRZSA-N	0	0	299.201	4.110	20	30		CIEDRN
N#Cc1cccc(S[C@H](C#N)C2CCCCC2)c1	ZINC000158668222	334809522	/nfs/dbraw/zinc/80/95/22/334809522.db2.gz	GTWHRZZAAZZBNS-OAHLLOKOSA-N	0	0	256.374	4.123	20	30		CIEDRN
C=C(C)CCc1noc(Cc2c(C)cccc2Cl)n1	ZINC000568563729	334830487	/nfs/dbraw/zinc/83/04/87/334830487.db2.gz	IBIXOHPPTXUBKT-UHFFFAOYSA-N	0	0	276.767	4.131	20	30		CIEDRN
C=C(C)CCc1noc(-c2cc3cc(F)ccc3o2)n1	ZINC000568671727	334835624	/nfs/dbraw/zinc/83/56/24/334835624.db2.gz	RUGUNYNOVHQAEW-UHFFFAOYSA-N	0	0	272.279	4.131	20	30		CIEDRN
Cc1cc(C)c(C#N)c(N[C@@H](C)c2cccc(C)c2C)n1	ZINC000569163129	334858633	/nfs/dbraw/zinc/85/86/33/334858633.db2.gz	BKDXBNLMQOMBNC-HNNXBMFYSA-N	0	0	279.387	4.360	20	30		CIEDRN
N#CC1(C(=O)Nc2ccc(C3CCC3)cc2)CCCCC1	ZINC000572812142	334880274	/nfs/dbraw/zinc/88/02/74/334880274.db2.gz	PVQKPQLEKWHDCS-UHFFFAOYSA-N	0	0	282.387	4.367	20	30		CIEDRN
CC1(C)CC[C@H](Nc2cc(C#N)ccn2)c2ccccc21	ZINC000576364206	335195394	/nfs/dbraw/zinc/19/53/94/335195394.db2.gz	KDFNXUNMIPCUAE-INIZCTEOSA-N	0	0	277.371	4.178	20	30		CIEDRN
CC(C)=CCNc1ccccc1SC[C@@H](C)C#N	ZINC000576430086	335202521	/nfs/dbraw/zinc/20/25/21/335202521.db2.gz	IYPSNRBMVIWYKE-ZDUSSCGKSA-N	0	0	260.406	4.316	20	30		CIEDRN
C=CCCCCSCCC(=O)Nc1ccccc1C	ZINC000576730556	335241135	/nfs/dbraw/zinc/24/11/35/335241135.db2.gz	JYWCYAIXKHDNQW-UHFFFAOYSA-N	0	0	277.433	4.413	20	30		CIEDRN
C=C(C)CCc1noc(-c2cc(C(C)C)oc2C)n1	ZINC000576741321	335241788	/nfs/dbraw/zinc/24/17/88/335241788.db2.gz	FOQHOBQXPCTXKZ-UHFFFAOYSA-N	0	0	260.337	4.270	20	30		CIEDRN
C=CC(C)(C)C(=O)NC(C)(C)c1cccc(Cl)c1F	ZINC000576767159	335245725	/nfs/dbraw/zinc/24/57/25/335245725.db2.gz	HCSMKYZCJYVWTE-UHFFFAOYSA-N	0	0	283.774	4.043	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H]1CCCc2ccc(C)cc21	ZINC000576811416	335250189	/nfs/dbraw/zinc/25/01/89/335250189.db2.gz	FMJVOMLYZROWTC-SFHVURJKSA-N	0	0	283.415	4.257	20	30		CIEDRN
CC1(C)CCC[C@H](CC(=O)N2CCC(CCC#N)CC2)C1	ZINC000577065048	335294241	/nfs/dbraw/zinc/29/42/41/335294241.db2.gz	RFEHMJUTYBSZGD-MRXNPFEDSA-N	0	0	290.451	4.135	20	30		CIEDRN
C=CCCCCCNC(=O)N(C)[C@@H](C)c1ccccc1	ZINC000577074180	335295703	/nfs/dbraw/zinc/29/57/03/335295703.db2.gz	YNKRJZCCKQVUGQ-HNNXBMFYSA-N	0	0	274.408	4.135	20	30		CIEDRN
N#Cc1ccc(-c2ccc(OCc3ccccn3)cc2)cc1	ZINC000192967660	335326336	/nfs/dbraw/zinc/32/63/36/335326336.db2.gz	XFGGQCDGAAFLSA-UHFFFAOYSA-N	0	0	286.334	4.199	20	30		CIEDRN
CCc1ccc([C@@H](C#N)NC(=O)[C@@H](C)CC2CCCC2)cc1	ZINC000577300605	335337144	/nfs/dbraw/zinc/33/71/44/335337144.db2.gz	IVLVFTSZWAIIBN-KBXCAEBGSA-N	0	0	298.430	4.146	20	30		CIEDRN
N#Cc1ccc(SCc2cn3ccccc3n2)c(Cl)c1	ZINC000176898132	335339205	/nfs/dbraw/zinc/33/92/05/335339205.db2.gz	NRULCQYZDGOZDB-UHFFFAOYSA-N	0	0	299.786	4.152	20	30		CIEDRN
CCCC[C@H](C)N(CCCC)C(=O)CC(C)(C)C#N	ZINC000577409799	335349959	/nfs/dbraw/zinc/34/99/59/335349959.db2.gz	JCHKNKDMYVCZJR-AWEZNQCLSA-N	0	0	266.429	4.134	20	30		CIEDRN
N#Cc1ccc(CNc2ccc(CC(F)(F)F)cc2)s1	ZINC000176975279	335350984	/nfs/dbraw/zinc/35/09/84/335350984.db2.gz	WNKNXVKCSPGXGG-UHFFFAOYSA-N	0	0	296.317	4.337	20	30		CIEDRN
N#Cc1csc(CNc2ccccc2OCC2CC2)c1	ZINC000177705091	335380225	/nfs/dbraw/zinc/38/02/25/335380225.db2.gz	PIEFZNFDENTPOT-UHFFFAOYSA-N	0	0	284.384	4.021	20	30		CIEDRN
C=C(C)CCS[C@@H](C)C(=O)Nc1ccccc1SC	ZINC000577676168	335387791	/nfs/dbraw/zinc/38/77/91/335387791.db2.gz	WWAOCJVVDOSAGD-LBPRGKRZSA-N	0	0	295.473	4.435	20	30		CIEDRN
CCc1ccc([C@@H](C#N)NC(=O)[C@H](C)C(CC)CC)cc1	ZINC000578047602	335471575	/nfs/dbraw/zinc/47/15/75/335471575.db2.gz	LDMWVQZUMHMIFC-CXAGYDPISA-N	0	0	286.419	4.002	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1ccc2oc(C)nc2c1	ZINC000179693416	335508709	/nfs/dbraw/zinc/50/87/09/335508709.db2.gz	GFQDZGCGJOTOIH-NSHDSACASA-N	0	0	287.363	4.003	20	30		CIEDRN
C=CCOc1cccc(NC(=O)c2csc(C)c2C)c1	ZINC000179848288	335525007	/nfs/dbraw/zinc/52/50/07/335525007.db2.gz	SPGRJLMWWCULKG-UHFFFAOYSA-N	0	0	287.384	4.182	20	30		CIEDRN
CC(C)c1noc([C@H](C)Sc2cccc(F)c2C#N)n1	ZINC000578710434	335665295	/nfs/dbraw/zinc/66/52/95/335665295.db2.gz	OPRKCTQYYRRCNH-VIFPVBQESA-N	0	0	291.351	4.057	20	30		CIEDRN
Cc1cccc(NCc2ccc(C#N)cc2C(F)(F)F)c1	ZINC000578923543	335690205	/nfs/dbraw/zinc/69/02/05/335690205.db2.gz	CSYOCYKCBLKLHO-UHFFFAOYSA-N	0	0	290.288	4.498	20	30		CIEDRN
C[C@@H](c1ncc(C(C)(C)C)o1)N1CCC(CCC#N)CC1	ZINC000579105999	335709513	/nfs/dbraw/zinc/70/95/13/335709513.db2.gz	KHIDYGVTWNUZPY-ZDUSSCGKSA-N	0	0	289.423	4.049	20	30		CIEDRN
N#Cc1ccc(CNc2ccc(F)cc2)c(C(F)(F)F)c1	ZINC000579412166	335745478	/nfs/dbraw/zinc/74/54/78/335745478.db2.gz	JZEUZGBULKDZAQ-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N(C)[C@H](C)c1ccc(F)cc1	ZINC000181424330	335761681	/nfs/dbraw/zinc/76/16/81/335761681.db2.gz	LIRUIYJTMZETBE-ZIAGYGMSSA-N	0	0	292.398	4.273	20	30		CIEDRN
C=CCC[C@@H](Nc1ccc(NC(=O)CC)cc1)C1CC1	ZINC000182224013	335805014	/nfs/dbraw/zinc/80/50/14/335805014.db2.gz	YIEORHCCZFRAOO-MRXNPFEDSA-N	0	0	272.392	4.192	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)C[C@H](C)c1ccccc1	ZINC000182609118	335829993	/nfs/dbraw/zinc/82/99/93/335829993.db2.gz	KENGCHJVHQACNQ-GJZGRUSLSA-N	0	0	259.393	4.041	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)C[C@@H](C)c1ccccc1	ZINC000182609085	335830085	/nfs/dbraw/zinc/83/00/85/335830085.db2.gz	KENGCHJVHQACNQ-CABCVRRESA-N	0	0	259.393	4.041	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)C[C@@H](C=C)c1ccccc1	ZINC000182619825	335831082	/nfs/dbraw/zinc/83/10/82/335831082.db2.gz	FNOGENVGIGDEBR-HZPDHXFCSA-N	0	0	271.404	4.207	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@H]1C[C@H]1c1sccc1C	ZINC000182628976	335831957	/nfs/dbraw/zinc/83/19/57/335831957.db2.gz	ZVVBRHFUTQTREC-MJBXVCDLSA-N	0	0	277.433	4.021	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)[C@@H](CC)c1ccc(OC)cc1	ZINC000182627572	335831965	/nfs/dbraw/zinc/83/19/65/335831965.db2.gz	RCCPNAHZZRTPAV-PBHICJAKSA-N	0	0	289.419	4.050	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@H](CC)c1ccc(OC)cc1	ZINC000182627555	335831972	/nfs/dbraw/zinc/83/19/72/335831972.db2.gz	RCCPNAHZZRTPAV-WMLDXEAASA-N	0	0	289.419	4.050	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@@H](CC)c1ccc(OC)cc1	ZINC000182627534	335832026	/nfs/dbraw/zinc/83/20/26/335832026.db2.gz	RCCPNAHZZRTPAV-YOEHRIQHSA-N	0	0	289.419	4.050	20	30		CIEDRN
CC[C@H](CC#N)NCc1ccc(-c2ccccc2OC)cc1	ZINC000184096745	335918062	/nfs/dbraw/zinc/91/80/62/335918062.db2.gz	YPZCQFXSTSMCBT-QGZVFWFLSA-N	0	0	294.398	4.144	20	30		CIEDRN
CC(C)c1ccc2c(c1)[C@@H](Nc1cccnc1C#N)CC2	ZINC000580747125	335961842	/nfs/dbraw/zinc/96/18/42/335961842.db2.gz	NVCSBLJNBPDLSX-INIZCTEOSA-N	0	0	277.371	4.176	20	30		CIEDRN
N#Cc1c(F)cccc1SC[C@@H]1CCC(F)(F)C1	ZINC000580785212	335967159	/nfs/dbraw/zinc/96/71/59/335967159.db2.gz	RQIHVIPIVIRZCB-SECBINFHSA-N	0	0	271.307	4.225	20	30		CIEDRN
CC(C)(C#N)CC[S@@](=O)[C@H]1CCc2c1cccc2Cl	ZINC000580868122	335976510	/nfs/dbraw/zinc/97/65/10/335976510.db2.gz	GKYUNEOYAYXAGT-IFXJQAMLSA-N	0	0	295.835	4.016	20	30		CIEDRN
Cc1csc(NC(=O)c2cccc(C3CCC3)c2)c1C#N	ZINC000580917004	335983892	/nfs/dbraw/zinc/98/38/92/335983892.db2.gz	PNLVGPXFSDTCFG-UHFFFAOYSA-N	0	0	296.395	4.448	20	30		CIEDRN
CC(C)(C)c1cccc(C(=O)N2CCC(CCC#N)CC2)c1	ZINC000581141457	336014935	/nfs/dbraw/zinc/01/49/35/336014935.db2.gz	VJKSEKCPXHGHNH-UHFFFAOYSA-N	0	0	298.430	4.140	20	30		CIEDRN
CCOc1ccc(Oc2nc(C)c(C#N)cc2Cl)cc1	ZINC000380747661	336024738	/nfs/dbraw/zinc/02/47/38/336024738.db2.gz	VGMBNFWCBNRMCY-UHFFFAOYSA-N	0	0	288.734	4.106	20	30		CIEDRN
Cc1ccc(Cl)cc1Oc1ccc(C#N)c(C)n1	ZINC000381123695	336051125	/nfs/dbraw/zinc/05/11/25/336051125.db2.gz	DKTOGTDPAFGNII-UHFFFAOYSA-N	0	0	258.708	4.016	20	30		CIEDRN
N#Cc1ccc(NC[C@H]2CCCC2(F)F)cc1Cl	ZINC000381480087	336066288	/nfs/dbraw/zinc/06/62/88/336066288.db2.gz	FGUHXUBLMAJDKV-SNVBAGLBSA-N	0	0	270.710	4.059	20	30		CIEDRN
C=CCC1(C(=O)N2CCc3sc(Cl)cc3C2)CCC1	ZINC000581609195	336111845	/nfs/dbraw/zinc/11/18/45/336111845.db2.gz	UANVYOSZNGYMLL-UHFFFAOYSA-N	0	0	295.835	4.033	20	30		CIEDRN
CCc1ccc(NCc2cc(C#N)ccc2F)cc1C	ZINC000383533022	336112763	/nfs/dbraw/zinc/11/27/63/336112763.db2.gz	MYYOSXPUVNAMPH-UHFFFAOYSA-N	0	0	268.335	4.180	20	30		CIEDRN
C=CCCO[C@@H](C)c1nc(C2CCCCCC2)no1	ZINC000581726825	336138482	/nfs/dbraw/zinc/13/84/82/336138482.db2.gz	KKDZHWRDOWTCEV-LBPRGKRZSA-N	0	0	264.369	4.161	20	30		CIEDRN
CCc1cc(NCc2ccc(OC)c(C#N)c2)ccc1C	ZINC000385287008	336143538	/nfs/dbraw/zinc/14/35/38/336143538.db2.gz	XGBHYGQXTCYZPA-UHFFFAOYSA-N	0	0	280.371	4.050	20	30		CIEDRN
CCc1ccc(NCc2ccc(C#N)s2)cc1C	ZINC000385335662	336144444	/nfs/dbraw/zinc/14/44/44/336144444.db2.gz	SUMHTQPYPTUGCM-UHFFFAOYSA-N	0	0	256.374	4.103	20	30		CIEDRN
C=CCC(C)(C)c1noc(C2(c3ccc(F)cc3)CC2)n1	ZINC000581828709	336148664	/nfs/dbraw/zinc/14/86/64/336148664.db2.gz	NACPEGGWSCJHDN-UHFFFAOYSA-N	0	0	286.350	4.142	20	30		CIEDRN
N#Cc1ccn(Cc2ccc(C3CCCC3)cc2)c1	ZINC000581846122	336151219	/nfs/dbraw/zinc/15/12/19/336151219.db2.gz	FDAOFUXLBYODOZ-UHFFFAOYSA-N	0	0	250.345	4.066	20	30		CIEDRN
Cc1ccccc1CCC(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000385799817	336157132	/nfs/dbraw/zinc/15/71/32/336157132.db2.gz	RTEUAOXTQHZNEU-UHFFFAOYSA-N	0	0	298.773	4.091	20	30		CIEDRN
CCCCC1CCC(C(=O)NCc2ccc(C#N)cc2)CC1	ZINC000386026746	336164688	/nfs/dbraw/zinc/16/46/88/336164688.db2.gz	UNZRQTVUCGAWFH-UHFFFAOYSA-N	0	0	298.430	4.171	20	30		CIEDRN
CCC(CC)[C@@H]([NH2+]Cc1nc(C#N)cs1)c1ccccc1	ZINC000386089875	336166350	/nfs/dbraw/zinc/16/63/50/336166350.db2.gz	FQHPVZFTKGGRTR-QGZVFWFLSA-N	0	0	299.443	4.282	20	30		CIEDRN
CCC(CC)[C@H]([NH2+]Cc1nc(C#N)cs1)c1ccccc1	ZINC000386089874	336166380	/nfs/dbraw/zinc/16/63/80/336166380.db2.gz	FQHPVZFTKGGRTR-KRWDZBQOSA-N	0	0	299.443	4.282	20	30		CIEDRN
CN(C(=O)c1ccc2sccc2c1)c1cccc(C#N)c1	ZINC000386123297	336166481	/nfs/dbraw/zinc/16/64/81/336166481.db2.gz	COJJDNZSGXGWDI-UHFFFAOYSA-N	0	0	292.363	4.050	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1ccc2[nH]c(C)c(C)c2c1	ZINC000386633465	336176781	/nfs/dbraw/zinc/17/67/81/336176781.db2.gz	VDCJZJSGTIAONL-UHFFFAOYSA-N	0	0	284.403	4.117	20	30		CIEDRN
CCCC1(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)CC1	ZINC000386775938	336179278	/nfs/dbraw/zinc/17/92/78/336179278.db2.gz	JETZFJLLASYQPZ-UHFFFAOYSA-N	0	0	296.292	4.096	20	30		CIEDRN
C[C@@H]1CCC[C@H](NC(=O)C[C@H]2CCCCNC2=O)CC1	ZINC000329474791	533815531	/nfs/dbraw/zinc/81/55/31/533815531.db2.gz	AZMVUTGQRZWWGK-MCIONIFRSA-N	0	0	280.412	4.058	20	30		CIEDRN
CSCc1cccc(CNc2cccc(F)c2C#N)c1	ZINC000302517679	533859377	/nfs/dbraw/zinc/85/93/77/533859377.db2.gz	WBEOTJWTLGEJAH-UHFFFAOYSA-N	0	0	286.375	4.172	20	30		CIEDRN
Cc1c(N[C@@H]2CCC[C@@H](C#N)C2)cccc1-c1ncco1	ZINC000334551726	533925950	/nfs/dbraw/zinc/92/59/50/533925950.db2.gz	UYDPLOINDBKTEB-ZIAGYGMSSA-N	0	0	281.359	4.144	20	30		CIEDRN
C[C@@H](S[C@@H](C)c1ccc(C#N)cc1)c1nc(C2CC2)no1	ZINC000118444185	534001529	/nfs/dbraw/zinc/00/15/29/534001529.db2.gz	FBLGMCPJWMNBLT-WDEREUQCSA-N	0	0	299.399	4.374	20	30		CIEDRN
C[C@@H]1CCN(c2cccc(F)c2C#N)[C@H](c2ccco2)C1	ZINC000301430784	534059083	/nfs/dbraw/zinc/05/90/83/534059083.db2.gz	IPLUEWRNPOJJPV-WBMJQRKESA-N	0	0	284.334	4.268	20	30		CIEDRN
C[C@@H](c1cccc(C(F)(F)F)c1)N(C)CC1(C#N)CC1	ZINC000347450856	534083874	/nfs/dbraw/zinc/08/38/74/534083874.db2.gz	BAUUBNWWOLWGOQ-NSHDSACASA-N	0	0	282.309	4.002	20	30		CIEDRN
Cc1ccc(CSc2c(C#N)cccc2C#N)cc1C	ZINC000302901488	534108202	/nfs/dbraw/zinc/10/82/02/534108202.db2.gz	TVOOUZQVCKECCW-UHFFFAOYSA-N	0	0	278.380	4.339	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)Nc1ccc2occ(C)c2c1)OCC	ZINC000480053251	517317574	/nfs/dbraw/zinc/31/75/74/517317574.db2.gz	DTXUHOAUOMXMGV-MRXNPFEDSA-N	0	0	287.359	4.051	20	30		CIEDRN
CC(C)Sc1ccccc1NC(=O)c1ccc(C#N)cc1	ZINC000122137942	517456480	/nfs/dbraw/zinc/45/64/80/517456480.db2.gz	UTPAOUBFWFFHCG-UHFFFAOYSA-N	0	0	296.395	4.311	20	30		CIEDRN
CC[C@@H](C)C[C@@H](C)Nc1nc(C(F)(F)F)ccc1C#N	ZINC000090795424	517757428	/nfs/dbraw/zinc/75/74/28/517757428.db2.gz	WZGFSFTUMJAFEQ-NXEZZACHSA-N	0	0	285.313	4.209	20	30		CIEDRN
Cc1noc(C)c1C(C)(C)C(=O)NC1CCC2(CC2)CC1	ZINC000330284126	534323515	/nfs/dbraw/zinc/32/35/15/534323515.db2.gz	XBNVIJJIYSNRBL-UHFFFAOYSA-N	0	0	290.407	4.248	20	30		CIEDRN
O=C(C[C@@H]1C=CCCC1)Nc1n[nH]c2cc(F)ccc21	ZINC000330011733	534339398	/nfs/dbraw/zinc/33/93/98/534339398.db2.gz	JJXODEFGELAFII-SNVBAGLBSA-N	0	0	273.311	4.036	20	30		CIEDRN
C=CCC[C@H](C(=O)N(C)c1ncccc1C)c1ccccc1	ZINC000279665948	518721880	/nfs/dbraw/zinc/72/18/80/518721880.db2.gz	LFGKCNCUDKZJFG-KRWDZBQOSA-N	0	0	294.398	4.103	20	30		CIEDRN
Cc1noc(C2CC2)c1NC(=O)Cc1ccsc1C	ZINC000329974406	534385731	/nfs/dbraw/zinc/38/57/31/534385731.db2.gz	ZCRQLCPUHWYYJH-UHFFFAOYSA-N	0	0	276.361	4.061	20	30		CIEDRN
CC(C)(C)c1cnc(CNc2ccc(Cl)c(C#N)c2)o1	ZINC000085269726	519073313	/nfs/dbraw/zinc/07/33/13/519073313.db2.gz	HBQAVSXCJRANDA-UHFFFAOYSA-N	0	0	289.766	4.109	20	30		CIEDRN
CC(C)(C)c1cnc(COc2ccc(C#N)c(Cl)c2)o1	ZINC000276120191	519074484	/nfs/dbraw/zinc/07/44/84/519074484.db2.gz	YRYXWWFLCHOLPH-UHFFFAOYSA-N	0	0	290.750	4.076	20	30		CIEDRN
CC(C)(C)n1cc(C#N)cc1NC(=O)CCC1CCCC1	ZINC000339951423	519145672	/nfs/dbraw/zinc/14/56/72/519145672.db2.gz	UZMMXJFMIRCJRR-UHFFFAOYSA-N	0	0	287.407	4.024	20	30		CIEDRN
CC(C)CN(CCC#N)C(=O)c1ccc(Cl)c(Cl)c1	ZINC000048151504	519714746	/nfs/dbraw/zinc/71/47/46/519714746.db2.gz	JLFSAHAQAHDBRI-UHFFFAOYSA-N	0	0	299.201	4.005	20	30		CIEDRN
CC(C)[C@H](c1ccccc1)N(C)C(=O)c1cccc(C#N)c1	ZINC000112586515	519824165	/nfs/dbraw/zinc/82/41/65/519824165.db2.gz	TXNPMASRTNMIPO-GOSISDBHSA-N	0	0	292.382	4.028	20	30		CIEDRN
CC(C)c1nnc(CSc2cccc(Cl)c2C#N)o1	ZINC000357062596	519888728	/nfs/dbraw/zinc/88/87/28/519888728.db2.gz	FVRHXJWPHPYLNU-UHFFFAOYSA-N	0	0	293.779	4.010	20	30		CIEDRN
Cc1cnc(-c2cccc(N[C@H]3CCC[C@@H](C#N)C3)c2)o1	ZINC000336524319	534517668	/nfs/dbraw/zinc/51/76/68/534517668.db2.gz	FNOVRVLABZGHPG-HIFRSBDPSA-N	0	0	281.359	4.144	20	30		CIEDRN
Cc1cnc(-c2cccc(N[C@@H]3CCC[C@H](C#N)C3)c2)o1	ZINC000336524318	534518032	/nfs/dbraw/zinc/51/80/32/534518032.db2.gz	FNOVRVLABZGHPG-DZGCQCFKSA-N	0	0	281.359	4.144	20	30		CIEDRN
Cc1cnc(-c2cccc(N[C@H]3CCC[C@H](C#N)C3)c2)o1	ZINC000336524321	534518118	/nfs/dbraw/zinc/51/81/18/534518118.db2.gz	FNOVRVLABZGHPG-ZFWWWQNUSA-N	0	0	281.359	4.144	20	30		CIEDRN
CCN(Cc1nc(C)sc1C)[C@H](C)c1ccc(C#N)cc1	ZINC000336837143	521448138	/nfs/dbraw/zinc/44/81/38/521448138.db2.gz	NGCGBCGFSMBZDP-GFCCVEGCSA-N	0	0	299.443	4.215	20	30		CIEDRN
CCN(Cc1nc(C)sc1C)[C@@H](C)c1ccc(C#N)cc1	ZINC000336837144	521449549	/nfs/dbraw/zinc/44/95/49/521449549.db2.gz	NGCGBCGFSMBZDP-LBPRGKRZSA-N	0	0	299.443	4.215	20	30		CIEDRN
CCSCc1cccc(NCc2ccc(C#N)o2)c1	ZINC000151554277	521718779	/nfs/dbraw/zinc/71/87/79/521718779.db2.gz	MCUSTOFAMRBJDX-UHFFFAOYSA-N	0	0	272.373	4.016	20	30		CIEDRN
N#CCCCCSCc1ccc(Cl)c(F)c1	ZINC000190861634	534606012	/nfs/dbraw/zinc/60/60/12/534606012.db2.gz	YTESOMIHWQQNLA-UHFFFAOYSA-N	0	0	257.761	4.406	20	30		CIEDRN
CCc1nc(CSCc2cccc(C#N)c2F)cs1	ZINC000340858567	522369577	/nfs/dbraw/zinc/36/95/77/522369577.db2.gz	YBBDPWHZEYPSFE-UHFFFAOYSA-N	0	0	292.404	4.150	20	30		CIEDRN
CC[C@H](NCc1nc(C(C)C)cs1)c1ccc(C#N)cc1	ZINC000278847995	522667315	/nfs/dbraw/zinc/66/73/15/522667315.db2.gz	VJZNGCKBZRUWKD-HNNXBMFYSA-N	0	0	299.443	4.379	20	30		CIEDRN
CC[C@@H](NCc1nc(C(C)C)cs1)c1ccc(C#N)cc1	ZINC000278847997	522893007	/nfs/dbraw/zinc/89/30/07/522893007.db2.gz	VJZNGCKBZRUWKD-OAHLLOKOSA-N	0	0	299.443	4.379	20	30		CIEDRN
N#CC[C@@H](Cc1nc(-c2ccsc2)no1)c1ccccc1	ZINC000347103536	534712847	/nfs/dbraw/zinc/71/28/47/534712847.db2.gz	JLNUOIGLVWOAJI-ZDUSSCGKSA-N	0	0	295.367	4.038	20	30		CIEDRN
O=C(NCc1cc(-c2ccccc2)on1)[C@@H]1CC12CCCC2	ZINC000329271168	534755438	/nfs/dbraw/zinc/75/54/38/534755438.db2.gz	HKMOEULTBCBJIF-HNNXBMFYSA-N	0	0	296.370	4.378	20	30		CIEDRN
Cc1cc(C(=O)Nc2sc(C)c(C)c2C#N)sc1C	ZINC000339677959	524187922	/nfs/dbraw/zinc/18/79/22/524187922.db2.gz	JEZOMVNJFRRBDD-UHFFFAOYSA-N	0	0	290.413	4.167	20	30		CIEDRN
N#Cc1ccc(Cl)cc1NCc1cc2ccccc2[nH]1	ZINC000301287888	534784486	/nfs/dbraw/zinc/78/44/86/534784486.db2.gz	RQZHTVIDEIQOPN-UHFFFAOYSA-N	0	0	281.746	4.305	20	30		CIEDRN
N#Cc1ccc(N2CC[C@@H](CSc3ccccc3)C2)cc1	ZINC000301417014	534792276	/nfs/dbraw/zinc/79/22/76/534792276.db2.gz	BFAIRJMOFPPKHV-MRXNPFEDSA-N	0	0	294.423	4.177	20	30		CIEDRN
C[C@H](Cn1cc(C#N)c(=O)c2ccccc21)C1CCCCC1	ZINC000292748048	524770991	/nfs/dbraw/zinc/77/09/91/524770991.db2.gz	VJXZYQJNRUDBQH-CQSZACIVSA-N	0	0	294.398	4.090	20	30		CIEDRN
Cc1cc(Cl)c2ncc(C#N)c(NCc3ccco3)c2c1	ZINC000338399976	524851929	/nfs/dbraw/zinc/85/19/29/524851929.db2.gz	PDUYKFQEDVZYIN-UHFFFAOYSA-N	0	0	297.745	4.273	20	30		CIEDRN
N#Cc1ccnc(N2CCC[C@@H]2c2cccs2)c1Cl	ZINC000336297522	534822865	/nfs/dbraw/zinc/82/28/65/534822865.db2.gz	PRZXIHUPIHUEOG-LLVKDONJSA-N	0	0	289.791	4.010	20	30		CIEDRN
Cc1cc([C@@H](C)Nc2cc(C#N)cc(C)n2)c(C)s1	ZINC000161001707	525477210	/nfs/dbraw/zinc/47/72/10/525477210.db2.gz	LNHPIOMYZDABRK-LLVKDONJSA-N	0	0	271.389	4.113	20	30		CIEDRN
C[C@@H](Nc1cc(C#N)ccn1)c1cccc(C(F)(F)F)c1	ZINC000339968834	525697193	/nfs/dbraw/zinc/69/71/93/525697193.db2.gz	HTHRZVWALWTSAO-SNVBAGLBSA-N	0	0	291.276	4.145	20	30		CIEDRN
Cc1ccc(-c2ncco2)cc1NCc1ccc(C#N)cc1	ZINC000157153875	525837539	/nfs/dbraw/zinc/83/75/39/525837539.db2.gz	ZDRHWEGEZVUSNU-UHFFFAOYSA-N	0	0	289.338	4.134	20	30		CIEDRN
C[C@@H](Sc1ccc(C#N)cn1)c1ncc(C(C)(C)C)o1	ZINC000267103397	525986373	/nfs/dbraw/zinc/98/63/73/525986373.db2.gz	ZXTMBNUKYSQJIB-SNVBAGLBSA-N	0	0	287.388	4.092	20	30		CIEDRN
C[C@@H](Sc1ccc(C#N)c(C(F)(F)F)c1)C(=O)C1CC1	ZINC000280989570	525987251	/nfs/dbraw/zinc/98/72/51/525987251.db2.gz	MLVDLPRDXSUGOR-MRVPVSSYSA-N	0	0	299.317	4.037	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N1CCC[C@@H]1C1CCCC1	ZINC000058451849	525999837	/nfs/dbraw/zinc/99/98/37/525999837.db2.gz	AHDPFGDOMXTHDU-QGZVFWFLSA-N	0	0	297.402	4.053	20	30		CIEDRN
C[C@H](Sc1nnc(C(C)(C)C)o1)c1ccc(C#N)cc1	ZINC000118175888	526010000	/nfs/dbraw/zinc/01/00/00/526010000.db2.gz	MWZUUKDLXJPKLD-JTQLQIEISA-N	0	0	287.388	4.092	20	30		CIEDRN
CC#CCCCC(=O)N1CCCCC[C@@H]1c1ccc(C)o1	ZINC000185866231	526292043	/nfs/dbraw/zinc/29/20/43/526292043.db2.gz	RUUXJSGDSIAZGF-MRXNPFEDSA-N	0	0	287.403	4.225	20	30		CIEDRN
CC#CCCCC(=O)N[C@H]1CCCc2sc(Cl)cc21	ZINC000344611640	526302144	/nfs/dbraw/zinc/30/21/44/526302144.db2.gz	VRCDKQXBWYALRC-LBPRGKRZSA-N	0	0	295.835	4.089	20	30		CIEDRN
C=CCN(CCc1ccco1)Cc1csc(C(C)C)n1	ZINC000352700253	526326532	/nfs/dbraw/zinc/32/65/32/526326532.db2.gz	BDLFMKCXSPVPFE-UHFFFAOYSA-N	0	0	290.432	4.090	20	30		CIEDRN
Cc1csc(C2(N[C@@H](C)c3ccc(C#N)cc3)CCC2)n1	ZINC000266427561	526328611	/nfs/dbraw/zinc/32/86/11/526328611.db2.gz	CEVOKILFEIZXJM-ZDUSSCGKSA-N	0	0	297.427	4.053	20	30		CIEDRN
Cc1nnc(Oc2cccc(C(C)(C)C)c2)c(C#N)c1C	ZINC000040217673	526376584	/nfs/dbraw/zinc/37/65/84/526376584.db2.gz	KZJVUNNKFGFEJF-UHFFFAOYSA-N	0	0	281.359	4.055	20	30		CIEDRN
C=CCN1CCC[C@H]1c1nc(C2CCCCC2)co1	ZINC000370207279	526456388	/nfs/dbraw/zinc/45/63/88/526456388.db2.gz	IVPBFIQLTVDXKN-HNNXBMFYSA-N	0	0	260.381	4.045	20	30		CIEDRN
C=CCN1CCC[C@@H]1c1nc(C2CCCCC2)co1	ZINC000370207280	526457021	/nfs/dbraw/zinc/45/70/21/526457021.db2.gz	IVPBFIQLTVDXKN-OAHLLOKOSA-N	0	0	260.381	4.045	20	30		CIEDRN
Cc1cscc1NC1CCN(c2ccc(C#N)cc2)CC1	ZINC000286279293	526475157	/nfs/dbraw/zinc/47/51/57/526475157.db2.gz	VYHADDGLQGFHJB-UHFFFAOYSA-N	0	0	297.427	4.009	20	30		CIEDRN
N#Cc1c(F)cccc1N[C@H](c1ccccc1)C1CC1	ZINC000041075436	526524363	/nfs/dbraw/zinc/52/43/63/526524363.db2.gz	IMYZNBWJIQMPGT-QGZVFWFLSA-N	0	0	266.319	4.261	20	30		CIEDRN
N#Cc1ccc(CNc2cccc(C3CCC3)c2)o1	ZINC000291173958	526628411	/nfs/dbraw/zinc/62/84/11/526628411.db2.gz	DWYXFQKRGPDFKS-UHFFFAOYSA-N	0	0	252.317	4.031	20	30		CIEDRN
N#Cc1ccc(SCOC2CCC2)cc1C(F)(F)F	ZINC000289665280	526686536	/nfs/dbraw/zinc/68/65/36/526686536.db2.gz	OSGVTRYMBJMMQD-UHFFFAOYSA-N	0	0	287.306	4.196	20	30		CIEDRN
N#Cc1ccc(SCC(=O)c2c[nH]c3ccccc23)cc1	ZINC000340890749	526686891	/nfs/dbraw/zinc/68/68/91/526686891.db2.gz	HLXIGENNZWMERY-UHFFFAOYSA-N	0	0	292.363	4.015	20	30		CIEDRN
Cc1nc(C)c(CSCc2ccc(C#N)cc2)s1	ZINC000266326855	526728326	/nfs/dbraw/zinc/72/83/26/526728326.db2.gz	IUAAYPSEYZVRCJ-UHFFFAOYSA-N	0	0	274.414	4.065	20	30		CIEDRN
CC(C)(C)[C@](C)(C#N)NC(=O)[C@@H]1CCC[C@H]2CCCC[C@H]21	ZINC000332655987	526742684	/nfs/dbraw/zinc/74/26/84/526742684.db2.gz	AKFJZCSIIVBRLD-ADAWSYLGSA-N	0	0	290.451	4.037	20	30		CIEDRN
Cc1oc(C#N)cc1C(=O)N(C(C)C)[C@@H](C)c1ccccc1	ZINC000297966455	526754485	/nfs/dbraw/zinc/75/44/85/526754485.db2.gz	VOPHNYAPHGUBMQ-ZDUSSCGKSA-N	0	0	296.370	4.072	20	30		CIEDRN
N#Cc1sc(N2CCC[C@@H]2c2ccsc2)nc1Cl	ZINC000286076022	526800232	/nfs/dbraw/zinc/80/02/32/526800232.db2.gz	JLJZFEBTMCYUKN-SECBINFHSA-N	0	0	295.820	4.071	20	30		CIEDRN
C=C(C)[C@H]1OCC[C@@H]1c1nc(C2CCC(C)(C)CC2)no1	ZINC000347497572	526835710	/nfs/dbraw/zinc/83/57/10/526835710.db2.gz	HLUOZTIJHDFPHD-UONOGXRCSA-N	0	0	290.407	4.202	20	30		CIEDRN
C=C1CCN(Cc2cnc(-c3ccsc3)s2)CC1	ZINC000353330507	526904231	/nfs/dbraw/zinc/90/42/31/526904231.db2.gz	PYSDKSUQRMRQRI-UHFFFAOYSA-N	0	0	276.430	4.024	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc2nc(C)sc2c1	ZINC000343838204	527034264	/nfs/dbraw/zinc/03/42/64/527034264.db2.gz	JSYWAYZRZYZFTE-UHFFFAOYSA-N	0	0	286.400	4.312	20	30		CIEDRN
C=CCCCN(C)C(=O)c1ccc(C2=CCCC2)cc1	ZINC000354469513	527190299	/nfs/dbraw/zinc/19/02/99/527190299.db2.gz	XGHXGHIGAANMOT-UHFFFAOYSA-N	0	0	269.388	4.292	20	30		CIEDRN
C=CCCCN(C)C(=O)c1coc2ccc(CC)cc21	ZINC000353265651	527191138	/nfs/dbraw/zinc/19/11/38/527191138.db2.gz	KDISJKSEMCLUQH-UHFFFAOYSA-N	0	0	271.360	4.033	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(N2CCC[C@@H](C(C)C)CC2)c1	ZINC000302091538	527223352	/nfs/dbraw/zinc/22/33/52/527223352.db2.gz	HEKGTGUPPXWWQG-OAHLLOKOSA-N	0	0	284.403	4.023	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(NC[C@@H](C)Cc2cccs2)c1	ZINC000302128195	527225505	/nfs/dbraw/zinc/22/55/05/527225505.db2.gz	XCHHKIVLOVEYCV-LBPRGKRZSA-N	0	0	298.411	4.113	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(NC[C@H](C)c2ccc(C)cc2)c1	ZINC000302095186	527226751	/nfs/dbraw/zinc/22/67/51/527226751.db2.gz	ITYIGDJQRJRBRF-AWEZNQCLSA-N	0	0	292.382	4.285	20	30		CIEDRN
C=CCC[C@@H](NC(=O)Nc1cc(C)ccn1)c1ccccc1	ZINC000345114007	527443020	/nfs/dbraw/zinc/44/30/20/527443020.db2.gz	NYEQATMFUGREGO-MRXNPFEDSA-N	0	0	295.386	4.219	20	30		CIEDRN
C=CCC[C@@H](NCc1csc(CC)n1)c1ccco1	ZINC000356084445	527449089	/nfs/dbraw/zinc/44/90/89/527449089.db2.gz	CKIFHJCGCPEALE-CYBMUJFWSA-N	0	0	276.405	4.096	20	30		CIEDRN
C=CCC[C@@H](Nc1cccc(NC(C)=O)c1)c1ccco1	ZINC000353626014	527451169	/nfs/dbraw/zinc/45/11/69/527451169.db2.gz	WWEWAQHANPHTLV-MRXNPFEDSA-N	0	0	284.359	4.357	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1ccc(C2=CCCC2)cc1	ZINC000356046607	527455072	/nfs/dbraw/zinc/45/50/72/527455072.db2.gz	BGMQTOSLKDVMAJ-GOSISDBHSA-N	0	0	281.399	4.435	20	30		CIEDRN
O=C(/C=C/c1ccc2ncccc2c1)c1ccccc1	ZINC000068301158	527621798	/nfs/dbraw/zinc/62/17/98/527621798.db2.gz	TUKWQOGFFWSECY-PKNBQFBNSA-N	0	0	259.308	4.131	20	30		CIEDRN
CC1(C)C[C@]1(C#N)NC(=O)[C@@H]1CCC[C@@H]2CCCC[C@H]12	ZINC000330150444	527769149	/nfs/dbraw/zinc/76/91/49/527769149.db2.gz	KTXZSKULPHKXSH-SZOQZIPDSA-N	0	0	274.408	4.242	20	30		CIEDRN
CC(C)CCOc1cccc(N[C@H]2CC[C@H](C#N)C2)c1	ZINC000442851448	527787387	/nfs/dbraw/zinc/78/73/87/527787387.db2.gz	DVVZXRJTJLYDSO-HOCLYGCPSA-N	0	0	272.392	4.216	20	30		CIEDRN
CC(C)[C@]1(C)C[C@H]1C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000352173756	527979154	/nfs/dbraw/zinc/97/91/54/527979154.db2.gz	FTECBWPJGHHBGG-SCTDSRPQSA-N	0	0	298.430	4.220	20	30		CIEDRN
CC(C)COc1cccc(N[C@H]2CCC[C@H](C#N)C2)c1	ZINC000193079578	528178817	/nfs/dbraw/zinc/17/88/17/528178817.db2.gz	QICVPJKOIIGBBZ-GJZGRUSLSA-N	0	0	272.392	4.216	20	30		CIEDRN
CC(C)COc1cccc(N[C@@H]2CCC[C@@H](C#N)C2)c1	ZINC000193079592	528178983	/nfs/dbraw/zinc/17/89/83/528178983.db2.gz	QICVPJKOIIGBBZ-HUUCEWRRSA-N	0	0	272.392	4.216	20	30		CIEDRN
CC1CCC(CNC(=O)C[C@@H](CC#N)c2ccccc2)CC1	ZINC000354933608	528180392	/nfs/dbraw/zinc/18/03/92/528180392.db2.gz	WTQSXHARDZCXJN-LEOMRAHMSA-N	0	0	298.430	4.016	20	30		CIEDRN
CC(C)C[C@@H](C)C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000352217422	528245966	/nfs/dbraw/zinc/24/59/66/528245966.db2.gz	JQXUBJSOBVWKRB-WBVHZDCISA-N	0	0	286.419	4.220	20	30		CIEDRN
CCN(CCC#N)C(=O)C[C@H]1C[C@H](C(C)C)c2ccccc21	ZINC000345813601	528367836	/nfs/dbraw/zinc/36/78/36/528367836.db2.gz	IOAKLBLTMSIHSY-CRAIPNDOSA-N	0	0	298.430	4.066	20	30		CIEDRN
CCC(C)(C)C1CCC2(C[C@H]2C(=O)N[C@@H](C)CC#N)CC1	ZINC000352102799	528492828	/nfs/dbraw/zinc/49/28/28/528492828.db2.gz	SJKQOMRTVREUCY-CQDIZWNASA-N	0	0	290.451	4.037	20	30		CIEDRN
CCC(C)(C)CC(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000352179783	528496549	/nfs/dbraw/zinc/49/65/49/528496549.db2.gz	BWYXFOCBSNMCNJ-INIZCTEOSA-N	0	0	286.419	4.364	20	30		CIEDRN
CC(C)C[C@H](Nc1cccc(C#N)n1)c1cccs1	ZINC000301849198	528574715	/nfs/dbraw/zinc/57/47/15/528574715.db2.gz	OLXIGQWMJLFJDM-ZDUSSCGKSA-N	0	0	271.389	4.214	20	30		CIEDRN
CC(C)[C@@H]1CCC[C@H](NC(=O)Cc2ccc3n[nH]cc3c2)C1	ZINC000330031357	528683647	/nfs/dbraw/zinc/68/36/47/528683647.db2.gz	TVEVXCSSLOLOKM-ZBFHGGJFSA-N	0	0	299.418	4.277	20	30		CIEDRN
CC1(C#N)CCC(Nc2cccc(-c3cnco3)c2)CC1	ZINC000336212093	528834248	/nfs/dbraw/zinc/83/42/48/528834248.db2.gz	ZJDQWJBSNUXKGO-UHFFFAOYSA-N	0	0	281.359	4.226	20	30		CIEDRN
CC1(C#N)CCN(c2ccc3c(Cl)cccc3n2)CC1	ZINC000336458652	528840999	/nfs/dbraw/zinc/84/09/99/528840999.db2.gz	OQIPKHJOXXNOFH-UHFFFAOYSA-N	0	0	285.778	4.018	20	30		CIEDRN
CC1(C)CCC(NC(=O)Cc2ccc3c[nH]nc3c2)CC1	ZINC000329272886	528893743	/nfs/dbraw/zinc/89/37/43/528893743.db2.gz	ITNFWFACWCLIGH-UHFFFAOYSA-N	0	0	285.391	4.031	20	30		CIEDRN
CC1(C)CCC(CNC(=O)Cc2ccc3n[nH]cc3c2)CC1	ZINC000330019755	528899871	/nfs/dbraw/zinc/89/98/71/528899871.db2.gz	VPFDMVKJLQPKBN-UHFFFAOYSA-N	0	0	299.418	4.278	20	30		CIEDRN
CC(C)[C@H](Nc1cccc(C#N)n1)c1ccc(F)cc1F	ZINC000301658782	529127186	/nfs/dbraw/zinc/12/71/86/529127186.db2.gz	WKKGDTCJNAHPBA-INIZCTEOSA-N	0	0	287.313	4.041	20	30		CIEDRN
CCSCC[C@H](C)N(C)c1ccc2cc(C#N)ccc2n1	ZINC000301972031	529191579	/nfs/dbraw/zinc/19/15/79/529191579.db2.gz	HCSINSVNYYRXPW-ZDUSSCGKSA-N	0	0	299.443	4.074	20	30		CIEDRN
CC[C@@H](Nc1ccc(Cl)c(C#N)n1)c1cccs1	ZINC000301588142	529209513	/nfs/dbraw/zinc/20/95/13/529209513.db2.gz	WTVDBKUMQPCYFL-SNVBAGLBSA-N	0	0	277.780	4.231	20	30		CIEDRN
CC[C@@H](Nc1ccc(C#N)cc1)c1ccc(F)cc1F	ZINC000301386817	529209775	/nfs/dbraw/zinc/20/97/75/529209775.db2.gz	WFVXLKUTINIREN-MRXNPFEDSA-N	0	0	272.298	4.400	20	30		CIEDRN
CC[C@H]1CCCC[C@H]1c1noc(C2(C#N)CCCC2)n1	ZINC000331590105	529212003	/nfs/dbraw/zinc/21/20/03/529212003.db2.gz	OPPALCWMRNFBBZ-QWHCGFSZSA-N	0	0	273.380	4.089	20	30		CIEDRN
CCS[C@H]1CCCC[C@@H]1Nc1ccc(Cl)c(C#N)n1	ZINC000301526522	529227130	/nfs/dbraw/zinc/22/71/30/529227130.db2.gz	GEVIFZKWGBTJGP-AAEUAGOBSA-N	0	0	295.839	4.083	20	30		CIEDRN
CC[C@@H]1CCCC[C@H]1c1noc(C2(C#N)CCCC2)n1	ZINC000331590099	529291220	/nfs/dbraw/zinc/29/12/20/529291220.db2.gz	OPPALCWMRNFBBZ-CHWSQXEVSA-N	0	0	273.380	4.089	20	30		CIEDRN
CC[C@H](CC#N)Nc1cc(C(C)(C)C)nc(C(C)(C)C)n1	ZINC000302134117	529301205	/nfs/dbraw/zinc/30/12/05/529301205.db2.gz	CREKYZBSYPQSMC-GFCCVEGCSA-N	0	0	288.439	4.176	20	30		CIEDRN
C[C@@H](Nc1ccc(C#N)cn1)c1ccccc1C(F)(F)F	ZINC000057142086	570387813	/nfs/dbraw/zinc/38/78/13/570387813.db2.gz	ZRBSTRQDVKYXTG-SNVBAGLBSA-N	0	0	291.276	4.145	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(-c2ccccc2OC(F)F)no1	ZINC000573285717	334924272	/nfs/dbraw/zinc/92/42/72/334924272.db2.gz	WDRCFNLJGLUQCV-OAHLLOKOSA-N	0	0	294.301	4.192	20	30		CIEDRN
CCc1[nH]nc(NC(=O)c2ccc(C3CCC3)cc2)c1C	ZINC000330133766	529469721	/nfs/dbraw/zinc/46/97/21/529469721.db2.gz	RIPDGJFXCYDXPG-UHFFFAOYSA-N	0	0	283.375	4.184	20	30		CIEDRN
CC[C@@H](CNc1cc(C(C)=O)ccc1C#N)c1ccccc1	ZINC000302113236	529496244	/nfs/dbraw/zinc/49/62/44/529496244.db2.gz	QMAVBJKNRVEVFQ-HNNXBMFYSA-N	0	0	292.382	4.367	20	30		CIEDRN
CC[C@H](NC(=O)C[C@@H]1CCCCNC1=O)c1cccs1	ZINC000329247545	529579429	/nfs/dbraw/zinc/57/94/29/529579429.db2.gz	RWAOYJCWYSKZFS-RYUDHWBXSA-N	0	0	294.420	4.302	20	30		CIEDRN
CCc1ccccc1NC(=O)c1cc(C#N)ccc1Cl	ZINC000334814025	529600089	/nfs/dbraw/zinc/60/00/89/529600089.db2.gz	ZNCKOIJIEIPPNA-UHFFFAOYSA-N	0	0	284.746	4.026	20	30		CIEDRN
CCc1ccc(CNc2ccc3cc(C#N)ccc3n2)s1	ZINC000301972143	529659063	/nfs/dbraw/zinc/65/90/63/529659063.db2.gz	HIIMRVKEOKBYPM-UHFFFAOYSA-N	0	0	293.395	4.342	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H](C)Oc2ccccc2)n1	ZINC000573510800	334943705	/nfs/dbraw/zinc/94/37/05/334943705.db2.gz	XVEGBWSMJUVMPW-GFCCVEGCSA-N	0	0	272.348	4.063	20	30		CIEDRN
Cc1cccnc1C(C)(C)CNc1ccc(Cl)cc1C#N	ZINC000573651825	334954857	/nfs/dbraw/zinc/95/48/57/334954857.db2.gz	LNRKCBMHOYDVBQ-UHFFFAOYSA-N	0	0	299.805	4.305	20	30		CIEDRN
CCc1nc(CSc2cccc(F)c2C#N)cs1	ZINC000573709196	334959930	/nfs/dbraw/zinc/95/99/30/334959930.db2.gz	WZKYMEDEYZLRJN-UHFFFAOYSA-N	0	0	278.377	4.009	20	30		CIEDRN
C=CCN(CC=C)C(=O)[C@@H](C)Sc1ccc(Cl)cc1	ZINC000098067317	185680905	/nfs/dbraw/zinc/68/09/05/185680905.db2.gz	LBUWBQYCZXUGCQ-GFCCVEGCSA-N	0	0	295.835	4.021	20	30		CIEDRN
CCCCCCCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000100168491	185707190	/nfs/dbraw/zinc/70/71/90/185707190.db2.gz	WTUMZYAYCSUVLR-UHFFFAOYSA-N	0	0	282.315	4.033	20	30		CIEDRN
CN(Cc1ccc(C#N)cc1)c1cccc(C(F)F)c1C#N	ZINC000574526601	335026923	/nfs/dbraw/zinc/02/69/23/335026923.db2.gz	VJUNGRHDYJZUMT-UHFFFAOYSA-N	0	0	297.308	4.004	20	30		CIEDRN
CCc1ccc(CN(CCC#N)CCC(C)C)s1	ZINC000574829757	335051289	/nfs/dbraw/zinc/05/12/89/335051289.db2.gz	RBHVVWOZHZCHAD-UHFFFAOYSA-N	0	0	264.438	4.072	20	30		CIEDRN
CO[C@H](C)c1cccc(Nc2cccc(F)c2C#N)c1	ZINC000301140623	533117795	/nfs/dbraw/zinc/11/77/95/533117795.db2.gz	FHTBHQHHPNDOGW-LLVKDONJSA-N	0	0	270.307	4.148	20	30		CIEDRN
CC(C)c1nc(CSCCC(C)(C)C#N)cs1	ZINC000575019680	335056220	/nfs/dbraw/zinc/05/62/20/335056220.db2.gz	QQUFFBHDQGOYFR-UHFFFAOYSA-N	0	0	268.451	4.440	20	30		CIEDRN
N#CCCCSCc1csc(-c2cccs2)n1	ZINC000190888496	262187030	/nfs/dbraw/zinc/18/70/30/262187030.db2.gz	RLURKRQEQXEJFE-UHFFFAOYSA-N	0	0	280.443	4.409	20	30		CIEDRN
N#CCCCSCCOc1ccccc1C(F)(F)F	ZINC000190930532	262187228	/nfs/dbraw/zinc/18/72/28/262187228.db2.gz	UITNARUDIWVPFS-UHFFFAOYSA-N	0	0	289.322	4.121	20	30		CIEDRN
N#CCCCSCc1csc(-c2ccc(F)cc2)n1	ZINC000190892738	262186966	/nfs/dbraw/zinc/18/69/66/262186966.db2.gz	YQILXSZBYUXOPO-UHFFFAOYSA-N	0	0	292.404	4.486	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1c(C)noc1-c1ccccc1	ZINC000186726982	260010132	/nfs/dbraw/zinc/01/01/32/260010132.db2.gz	HYBPYEJDJAXHRF-LBPRGKRZSA-N	0	0	284.359	4.191	20	30		CIEDRN
C#CCCCCC(=O)Nc1cccnc1-c1csc(C)c1	ZINC000186902379	260023344	/nfs/dbraw/zinc/02/33/44/260023344.db2.gz	MADFHWLZVSRDIO-UHFFFAOYSA-N	0	0	298.411	4.251	20	30		CIEDRN
C[C@@H](Nc1ccc(C#N)cc1C(F)(F)F)c1ccccn1	ZINC000036973642	260061034	/nfs/dbraw/zinc/06/10/34/260061034.db2.gz	VRHOEVHZHBCICC-SNVBAGLBSA-N	0	0	291.276	4.145	20	30		CIEDRN
C[C@H](CC#N)Nc1nc(-c2cccs2)nc2ccccc21	ZINC000171365993	335063465	/nfs/dbraw/zinc/06/34/65/335063465.db2.gz	ADTZHKLFEZMWHD-LLVKDONJSA-N	0	0	294.383	4.072	20	30		CIEDRN
CSCCCS[C@@H](C)c1cccc(C#N)c1	ZINC000190899161	533574493	/nfs/dbraw/zinc/57/44/93/533574493.db2.gz	LFPJMIGHXJLGMS-NSHDSACASA-N	0	0	251.420	4.106	20	30		CIEDRN
Cc1[nH]nc(-c2ccccc2)c1NC(=O)[C@H]1C[C@H]1C1CC1	ZINC000330139550	533656760	/nfs/dbraw/zinc/65/67/60/533656760.db2.gz	WJHZCFCAMJGCHZ-KBPBESRZSA-N	0	0	281.359	4.019	20	30		CIEDRN
C[C@H](SCCCOc1cccc(C#N)c1)c1cccnc1	ZINC000341933571	130143053	/nfs/dbraw/zinc/14/30/53/130143053.db2.gz	XMLMDANRUAXEPJ-AWEZNQCLSA-N	0	0	298.411	4.217	20	30		CIEDRN
O=C(/C=C\c1cccc(F)c1)c1ccc(Cl)cc1	ZINC000213958189	130755969	/nfs/dbraw/zinc/75/59/69/130755969.db2.gz	UJCRXYAAJJMQFJ-WTKPLQERSA-N	0	0	260.695	4.375	20	30		CIEDRN
C=CCCC(=O)N[C@H](C)c1cc(F)c(Cl)cc1Cl	ZINC000171422554	335065500	/nfs/dbraw/zinc/06/55/00/335065500.db2.gz	GHOALAWNHCUPNX-MRVPVSSYSA-N	0	0	290.165	4.276	20	30		CIEDRN
N#CCOc1ccc(C(=O)/C=C/c2ccc(Cl)cc2)cc1	ZINC000005428956	170098612	/nfs/dbraw/zinc/09/86/12/170098612.db2.gz	QOUGWVGHMBVRHX-XCVCLJGOSA-N	0	0	297.741	4.138	20	30		CIEDRN
CCCC[C@H](CC)C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000005713511	170132101	/nfs/dbraw/zinc/13/21/01/170132101.db2.gz	NDTGYSYIHAEHKA-NSHDSACASA-N	0	0	278.783	4.367	20	30		CIEDRN
N#Cc1ccc(NC(=O)c2cc(Cl)ccc2Cl)cc1	ZINC000005714825	170132471	/nfs/dbraw/zinc/13/24/71/170132471.db2.gz	FRMNQXJNRSUHGJ-UHFFFAOYSA-N	0	0	291.137	4.117	20	30		CIEDRN
CC(=O)Nc1cccc(C(=O)/C=C/c2ccccc2Cl)c1	ZINC000006341106	170194063	/nfs/dbraw/zinc/19/40/63/170194063.db2.gz	BMYPGAAKIYVENY-MDZDMXLPSA-N	0	0	299.757	4.195	20	30		CIEDRN
N#Cc1cccc(OCc2csc(-c3ccsc3)n2)c1	ZINC000007765695	170301429	/nfs/dbraw/zinc/30/14/29/170301429.db2.gz	OHZFMQDDLOMMIB-UHFFFAOYSA-N	0	0	298.392	4.322	20	30		CIEDRN
C=CCNc1nc(-c2cc(C)ccc2C)c(C)s1	ZINC000007843385	170304551	/nfs/dbraw/zinc/30/45/51/170304551.db2.gz	ABVRXPJALCOTHB-UHFFFAOYSA-N	0	0	258.390	4.333	20	30		CIEDRN
N#Cc1c(F)cccc1Oc1ccc([N+](=O)[O-])cc1Cl	ZINC000007906704	170307353	/nfs/dbraw/zinc/30/73/53/170307353.db2.gz	UMDLLVWDXAUXNP-UHFFFAOYSA-N	0	0	292.653	4.051	20	30		CIEDRN
CC[C@H](C)[C@@H](C(=O)Nc1ccc(C#N)cc1)c1ccccc1	ZINC000014908344	170648327	/nfs/dbraw/zinc/64/83/27/170648327.db2.gz	RCUSTUHAOYMIJM-KBXCAEBGSA-N	0	0	292.382	4.327	20	30		CIEDRN
CC(C)(C#N)CCCC[S@@](=O)c1cccc(Cl)c1	ZINC000232526243	262497106	/nfs/dbraw/zinc/49/71/06/262497106.db2.gz	MKSJNCFOJHUIFX-GOSISDBHSA-N	0	0	283.824	4.168	20	30		CIEDRN
C[C@H](Nc1ccc(C#N)cn1)c1ccc(Cl)cc1Cl	ZINC000019814389	170880222	/nfs/dbraw/zinc/88/02/22/170880222.db2.gz	GODOTQDOJFZRLK-VIFPVBQESA-N	0	0	292.169	4.433	20	30		CIEDRN
Cc1ccc(N[C@H](C)c2ccc(C#N)cc2)cc1F	ZINC000019955846	170941389	/nfs/dbraw/zinc/94/13/89/170941389.db2.gz	HHQUQPUWPMGMNR-GFCCVEGCSA-N	0	0	254.308	4.179	20	30		CIEDRN
N#Cc1ccccc1CNc1ccccc1OC(F)(F)F	ZINC000020048306	170978447	/nfs/dbraw/zinc/97/84/47/170978447.db2.gz	GIWVKQKIIZMFRE-UHFFFAOYSA-N	0	0	292.260	4.069	20	30		CIEDRN
C[C@H](Nc1ccccc1OC(F)F)c1ccc(C#N)cc1	ZINC000020096299	170995710	/nfs/dbraw/zinc/99/57/10/170995710.db2.gz	GLUZHNBOIOEBRW-NSHDSACASA-N	0	0	288.297	4.333	20	30		CIEDRN
N#Cc1ccccc1COc1ccc(C(F)(F)F)cc1	ZINC000020298125	171137980	/nfs/dbraw/zinc/13/79/80/171137980.db2.gz	SMYKBVHHCBJGLD-UHFFFAOYSA-N	0	0	277.245	4.156	20	30		CIEDRN
Cc1ccc(NCc2cccc(C#N)c2)c(Cl)c1	ZINC000020361046	171159340	/nfs/dbraw/zinc/15/93/40/171159340.db2.gz	LSOGGMBOTTWIIL-UHFFFAOYSA-N	0	0	256.736	4.132	20	30		CIEDRN
N#Cc1ccc(-c2csc(-c3ccc(F)cc3)n2)cc1	ZINC000021474084	171304146	/nfs/dbraw/zinc/30/41/46/171304146.db2.gz	KIHHKJADSNPSPP-UHFFFAOYSA-N	0	0	280.327	4.488	20	30		CIEDRN
N#Cc1ccc(F)c(COc2ccccc2C(F)(F)F)c1	ZINC000021509195	171309176	/nfs/dbraw/zinc/30/91/76/171309176.db2.gz	HHHNIQLVHGVGQX-UHFFFAOYSA-N	0	0	295.235	4.295	20	30		CIEDRN
Cc1cc(C)c(CNc2cccc(C#N)c2)c(C)c1	ZINC000021806146	171327492	/nfs/dbraw/zinc/32/74/92/171327492.db2.gz	ZRSWEIYACHWXTC-UHFFFAOYSA-N	0	0	250.345	4.096	20	30		CIEDRN
C[C@@H](NCc1cc(C#N)ccc1F)c1ccccc1Cl	ZINC000022515452	171389709	/nfs/dbraw/zinc/38/97/09/171389709.db2.gz	OVZIBJMVLKOUPJ-LLVKDONJSA-N	0	0	288.753	4.202	20	30		CIEDRN
O=C(/C=C\c1ccc(F)cc1)c1cccc(Cl)c1	ZINC000033472194	171805048	/nfs/dbraw/zinc/80/50/48/171805048.db2.gz	AUWSWIHGQVJIKX-TWGQIWQCSA-N	0	0	260.695	4.375	20	30		CIEDRN
CCOc1ccc(CNc2ccc(Cl)c(C#N)c2)cc1	ZINC000035224497	172068723	/nfs/dbraw/zinc/06/87/23/172068723.db2.gz	ZADLFOHPBBVUAC-UHFFFAOYSA-N	0	0	286.762	4.222	20	30		CIEDRN
Cc1ccc(Cl)c(OCc2cc(C#N)ccc2F)c1	ZINC000036668834	172647538	/nfs/dbraw/zinc/64/75/38/172647538.db2.gz	SSLGBXWPJGXNTC-UHFFFAOYSA-N	0	0	275.710	4.238	20	30		CIEDRN
Cc1ccc(CNc2cc(Cl)ccc2C#N)cc1	ZINC000036954253	172826306	/nfs/dbraw/zinc/82/63/06/172826306.db2.gz	AWJRLDPUALXNFP-UHFFFAOYSA-N	0	0	256.736	4.132	20	30		CIEDRN
Cc1ccccc1CNc1ccc(C#N)c(Cl)c1	ZINC000036963042	172832376	/nfs/dbraw/zinc/83/23/76/172832376.db2.gz	ZNFWKSMJBQRISX-UHFFFAOYSA-N	0	0	256.736	4.132	20	30		CIEDRN
CCCCCCNc1cccc(OCCCC#N)c1	ZINC000037777416	173708621	/nfs/dbraw/zinc/70/86/21/173708621.db2.gz	CNNFLFMYYPWMRK-UHFFFAOYSA-N	0	0	260.381	4.361	20	30		CIEDRN
C[C@@H](Cc1cccs1)Nc1ccc(C#N)c(Cl)c1	ZINC000071271111	176104425	/nfs/dbraw/zinc/10/44/25/176104425.db2.gz	LLZFRIXCUUWGOZ-JTQLQIEISA-N	0	0	276.792	4.316	20	30		CIEDRN
N#Cc1c(F)cccc1Nc1cccc(C(F)(F)F)c1	ZINC000071630749	176236592	/nfs/dbraw/zinc/23/65/92/176236592.db2.gz	PBOHCQQIKHHBIG-UHFFFAOYSA-N	0	0	280.224	4.460	20	30		CIEDRN
N#Cc1cccc(OCc2ccc(Cl)c3cccnc23)c1	ZINC000071898217	176293005	/nfs/dbraw/zinc/29/30/05/176293005.db2.gz	UEJCMXWEPTYULC-UHFFFAOYSA-N	0	0	294.741	4.339	20	30		CIEDRN
N#Cc1ccc(Nc2nc(-c3ccccc3)cs2)cc1	ZINC000072138111	176322606	/nfs/dbraw/zinc/32/26/06/176322606.db2.gz	SNHRSWWXSIZMNX-UHFFFAOYSA-N	0	0	277.352	4.425	20	30		CIEDRN
CC(C)CC[C@H](NC(=O)c1ccc(C#N)cc1)C(C)(C)C	ZINC000078733035	177378723	/nfs/dbraw/zinc/37/87/23/177378723.db2.gz	HQSCTGSKMNBBCW-INIZCTEOSA-N	0	0	286.419	4.139	20	30		CIEDRN
Cc1cccc(N[C@H](C)c2ccc(OCC#N)cc2)c1C	ZINC000037215585	260075355	/nfs/dbraw/zinc/07/53/55/260075355.db2.gz	PWKYXRVBUXXZIZ-OAHLLOKOSA-N	0	0	280.371	4.379	20	30		CIEDRN
N#Cc1ccc(CSCC[C@H]2CCCO2)c(Cl)c1	ZINC000344857196	225181314	/nfs/dbraw/zinc/18/13/14/225181314.db2.gz	FTKYPRZPXNQRLD-CYBMUJFWSA-N	0	0	281.808	4.014	20	30		CIEDRN
CC[C@@H](C)[C@H](C)C(=O)Nc1ccc(Cl)cc1CC#N	ZINC000410961742	262674325	/nfs/dbraw/zinc/67/43/25/262674325.db2.gz	BECDQLCMCNFKMV-MNOVXSKESA-N	0	0	278.783	4.027	20	30		CIEDRN
Cc1cccc(CS[C@@H](C)c2ccc(C#N)cc2)n1	ZINC000346569291	225826965	/nfs/dbraw/zinc/82/69/65/225826965.db2.gz	RIHPFOXUKUQADY-ZDUSSCGKSA-N	0	0	268.385	4.256	20	30		CIEDRN
N#CCCN(CCC1CCCCCC1)Cc1ccccn1	ZINC000347783019	226375361	/nfs/dbraw/zinc/37/53/61/226375361.db2.gz	JOJLWCVLTUFIPE-UHFFFAOYSA-N	0	0	285.435	4.158	20	30		CIEDRN
Cc1cc(Cl)ccc1NC(=O)NCC(C)(C)CCC#N	ZINC000348151891	226420132	/nfs/dbraw/zinc/42/01/32/226420132.db2.gz	GBBVERIQFZZKLN-UHFFFAOYSA-N	0	0	293.798	4.100	20	30		CIEDRN
N#CC1(CSc2ccnc3ccccc32)CCC1	ZINC000336269857	226840448	/nfs/dbraw/zinc/84/04/48/226840448.db2.gz	UYBGYWDUFKISMI-UHFFFAOYSA-N	0	0	254.358	4.021	20	30		CIEDRN
Cc1c(C#N)cccc1NCc1ccc2ncccc2c1	ZINC000354744264	227087737	/nfs/dbraw/zinc/08/77/37/227087737.db2.gz	CGUIYNUYIYCECF-UHFFFAOYSA-N	0	0	273.339	4.027	20	30		CIEDRN
Cc1nc(CCNC(=O)CC2CCC(C)CC2)c(C)o1	ZINC000329020382	227260915	/nfs/dbraw/zinc/26/09/15/227260915.db2.gz	LSANTPFKKAQRAN-UHFFFAOYSA-N	0	0	278.396	4.007	20	30		CIEDRN
Cc1nnc(NC(=O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)s1	ZINC000329037110	227266501	/nfs/dbraw/zinc/26/65/01/227266501.db2.gz	ZFBSUPSFCJHDAY-GRYCIOLGSA-N	0	0	279.409	4.041	20	30		CIEDRN
N#Cc1cccc(C2(C(=O)N[C@H]3CC34CCCCC4)CC2)c1	ZINC000329094281	227293599	/nfs/dbraw/zinc/29/35/99/227293599.db2.gz	AWTQDHRHWYTLOH-INIZCTEOSA-N	0	0	294.398	4.269	20	30		CIEDRN
N#C[C@@H](C(=O)c1ccc(C2=CCCC2)cc1)c1ccccn1	ZINC000355093382	227392352	/nfs/dbraw/zinc/39/23/52/227392352.db2.gz	DRLWPRJRHOMRRI-QGZVFWFLSA-N	0	0	288.350	4.139	20	30		CIEDRN
N#C[C@@H]1CCC[C@@H]1NC(=O)[C@@H]1CCC[C@@H]2CCCC[C@H]12	ZINC000329160023	227333746	/nfs/dbraw/zinc/33/37/46/227333746.db2.gz	FAXATVHJNCZDLH-GVRJEKJASA-N	0	0	274.408	4.242	20	30		CIEDRN
O=C(N[C@@H]1CCCCC12CCCC2)c1ncoc1C1CC1	ZINC000329170561	227336964	/nfs/dbraw/zinc/33/69/64/227336964.db2.gz	KAXJILGUDWUNGI-CYBMUJFWSA-N	0	0	288.391	4.360	20	30		CIEDRN
Cc1ccccc1[C@@H]1CCCN1c1ccc(C#N)cc1	ZINC000301096804	227445830	/nfs/dbraw/zinc/44/58/30/227445830.db2.gz	PDRXBAAHESNCDB-SFHVURJKSA-N	0	0	262.356	4.208	20	30		CIEDRN
N#Cc1cc(F)ccc1NCc1ccccc1OCC1CC1	ZINC000301401645	227529174	/nfs/dbraw/zinc/52/91/74/227529174.db2.gz	QMLNNZDXECODOX-UHFFFAOYSA-N	0	0	296.345	4.098	20	30		CIEDRN
C[C@H]1CCN(c2ccc(C#N)cc2)[C@H](c2ccco2)C1	ZINC000301415084	227532397	/nfs/dbraw/zinc/53/23/97/227532397.db2.gz	BUHAOJMLKVDVDQ-BBRMVZONSA-N	0	0	266.344	4.129	20	30		CIEDRN
Cc1cccc2c(Oc3ccc(C#N)cc3Cl)ncnc12	ZINC000301681557	227640050	/nfs/dbraw/zinc/64/00/50/227640050.db2.gz	SBQIYMMXVDEHJD-UHFFFAOYSA-N	0	0	295.729	4.256	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)c1coc2cc(F)ccc12	ZINC000355368770	227688242	/nfs/dbraw/zinc/68/82/42/227688242.db2.gz	LOWULLHTLRHWQB-UHFFFAOYSA-N	0	0	294.285	4.004	20	30		CIEDRN
N#Cc1cccc(N2CCC[C@@H]2c2cccc3ccccc32)n1	ZINC000301817437	227691372	/nfs/dbraw/zinc/69/13/72/227691372.db2.gz	FEUBOJZBHFKLGI-LJQANCHMSA-N	0	0	299.377	4.448	20	30		CIEDRN
Cc1ccc([C@@H]2[C@H](C)CCCN2c2cccc(C#N)n2)cc1	ZINC000301874679	227713332	/nfs/dbraw/zinc/71/33/32/227713332.db2.gz	XUQHASNHYJSQLW-BEFAXECRSA-N	0	0	291.398	4.239	20	30		CIEDRN
Cc1csc([C@@H](C)CNc2ccc(Cl)cc2C#N)n1	ZINC000302123854	227796183	/nfs/dbraw/zinc/79/61/83/227796183.db2.gz	HMCIXVPZPHXUIJ-VIFPVBQESA-N	0	0	291.807	4.192	20	30		CIEDRN
N#Cc1ccc(C(F)(F)F)c(NCc2cccc(F)c2)c1	ZINC000302234876	227830374	/nfs/dbraw/zinc/83/03/74/227830374.db2.gz	HDZHENRQJFKVLD-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
N#Cc1cccc(Oc2ccc(NC(=O)C3=CCC3)cc2)c1	ZINC000355504622	227860134	/nfs/dbraw/zinc/86/01/34/227860134.db2.gz	JWLOIAGTGCOAIR-UHFFFAOYSA-N	0	0	290.322	4.009	20	30		CIEDRN
Cc1ccc(N[C@@H](c2ccc(Cl)cc2)C2CC2)nc1C#N	ZINC000302720580	227880047	/nfs/dbraw/zinc/88/00/47/227880047.db2.gz	PBVQMUVBUOFHSQ-QGZVFWFLSA-N	0	0	297.789	4.478	20	30		CIEDRN
Cc1ccc(N[C@@H](C)c2c(C)cccc2C)nc1C#N	ZINC000302746359	227883033	/nfs/dbraw/zinc/88/30/33/227883033.db2.gz	FMCWCEPHEWINDK-AWEZNQCLSA-N	0	0	265.360	4.052	20	30		CIEDRN
Cc1cccc(C)c1[C@@H](C)Nc1c(C#N)cccc1C#N	ZINC000302879915	227896126	/nfs/dbraw/zinc/89/61/26/227896126.db2.gz	HYJQEHMJGPKHBD-CQSZACIVSA-N	0	0	275.355	4.220	20	30		CIEDRN
Cc1ncc(NC(=O)[C@@H](C)c2ccsc2)c(C2CC2)n1	ZINC000329793622	227950309	/nfs/dbraw/zinc/95/03/09/227950309.db2.gz	BGERSDIZYBLJOK-VIFPVBQESA-N	0	0	287.388	4.116	20	30		CIEDRN
Cc1nc2cc(NC(=O)[C@H]3CC34CCCC4)ccc2o1	ZINC000329965350	228000194	/nfs/dbraw/zinc/00/01/94/228000194.db2.gz	RASAKXJDAWRQFH-GFCCVEGCSA-N	0	0	270.332	4.305	20	30		CIEDRN
C[C@H](NC(=O)[C@@H]1CC12CCCC2)c1nc2ccccc2[nH]1	ZINC000329995215	228010036	/nfs/dbraw/zinc/01/00/36/228010036.db2.gz	MZUWMKCTRQPKEK-RYUDHWBXSA-N	0	0	283.375	4.161	20	30		CIEDRN
O=C(NCC[C@@H]1C(=O)Nc2ccccc21)[C@@H]1CC12CCCC2	ZINC000329998646	228011648	/nfs/dbraw/zinc/01/16/48/228011648.db2.gz	SRVKCKBPHJLADN-KBPBESRZSA-N	0	0	298.386	4.299	20	30		CIEDRN
Cc1coc2ccc(NC(=O)[C@@H]3CCO[C@@H](C)C3)cc12	ZINC000330047572	228026382	/nfs/dbraw/zinc/02/63/82/228026382.db2.gz	HUCJIQASPNZOCG-NWDGAFQWSA-N	0	0	273.332	4.144	20	30		CIEDRN
Cc1cc(CN(CCC#N)CC(C)(C)C)c(C)s1	ZINC000353422026	228099801	/nfs/dbraw/zinc/09/98/01/228099801.db2.gz	NEARHHSMLFCWGE-UHFFFAOYSA-N	0	0	264.438	4.127	20	30		CIEDRN
Cc1ccc([C@@H](C)Nc2ccc(F)cc2C#N)s1	ZINC000113317479	228041894	/nfs/dbraw/zinc/04/18/94/228041894.db2.gz	DSKRJHLNQODVMR-SNVBAGLBSA-N	0	0	260.337	4.240	20	30		CIEDRN
Cc1nc(C2(NC(=O)CCC3CCC3)CCCCC2)no1	ZINC000330184179	228059175	/nfs/dbraw/zinc/05/91/75/228059175.db2.gz	QLEWRAMDEZDRAA-UHFFFAOYSA-N	0	0	291.395	4.074	20	30		CIEDRN
N#CC1(C(=O)N[C@@H]2CCC[C@H](c3ccccc3)C2)CCC1	ZINC000330202527	228064572	/nfs/dbraw/zinc/06/45/72/228064572.db2.gz	ZKVOUVREBGECFJ-JKSUJKDBSA-N	0	0	282.387	4.363	20	30		CIEDRN
N#Cc1ccnc(SCc2cccc(C(F)F)c2)c1	ZINC000356035408	228095033	/nfs/dbraw/zinc/09/50/33/228095033.db2.gz	AYDMEKZRBJYFEB-UHFFFAOYSA-N	0	0	276.311	4.183	20	30		CIEDRN
C[C@H]1CCCCCN1C(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000332365547	228156840	/nfs/dbraw/zinc/15/68/40/228156840.db2.gz	XNUJDNHALTYVNN-RDJZCZTQSA-N	0	0	299.418	4.006	20	30		CIEDRN
Cc1ccc(F)c(NC(=O)C[C@@H](CC#N)c2ccccc2)c1	ZINC000353879245	228162203	/nfs/dbraw/zinc/16/22/03/228162203.db2.gz	TXMIOWCYOPUWJO-OAHLLOKOSA-N	0	0	296.345	4.160	20	30		CIEDRN
Cc1cc(C#N)cc(NC(=O)N2CCCC23CCCCC3)c1	ZINC000333715328	228211207	/nfs/dbraw/zinc/21/12/07/228211207.db2.gz	UJCVJIMKCMRGKT-UHFFFAOYSA-N	0	0	297.402	4.197	20	30		CIEDRN
N#Cc1cccc(C(=O)Nc2csc3ccccc23)c1	ZINC000352207033	228199072	/nfs/dbraw/zinc/19/90/72/228199072.db2.gz	SCICFUCLJKJDJD-UHFFFAOYSA-N	0	0	278.336	4.025	20	30		CIEDRN
N#CCCC[C@H](NC(=O)CC1=CCCCC1)c1ccccc1	ZINC000352215744	228200472	/nfs/dbraw/zinc/20/04/72/228200472.db2.gz	GEDPBIZFMXWSCU-SFHVURJKSA-N	0	0	296.414	4.428	20	30		CIEDRN
Cc1oc2ccc(NC(=O)N(C)CC(C)(C)C#N)cc2c1C	ZINC000336174330	228203502	/nfs/dbraw/zinc/20/35/02/228203502.db2.gz	FKQOVBSMWLTBBF-UHFFFAOYSA-N	0	0	299.374	4.063	20	30		CIEDRN
N#C[C@]1(c2nc(-c3cccc(Cl)c3)no2)CC12CCCC2	ZINC000333862570	228217530	/nfs/dbraw/zinc/21/75/30/228217530.db2.gz	SAHRBLFTLPQZJM-INIZCTEOSA-N	0	0	299.761	4.115	20	30		CIEDRN
Cc1cc(C)cc(-c2noc([C@@]3(C#N)CC34CCCC4)n2)c1	ZINC000333885400	228218904	/nfs/dbraw/zinc/21/89/04/228218904.db2.gz	XKEPKAVNBGDQRE-SFHVURJKSA-N	0	0	293.370	4.079	20	30		CIEDRN
C=C(C)CN(C)C(=O)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1	ZINC000180388202	260100081	/nfs/dbraw/zinc/10/00/81/260100081.db2.gz	IRWKHBVZTFDARB-ZIAGYGMSSA-N	0	0	298.213	4.131	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1ccccc1C(C)(C)C	ZINC000116997137	260020086	/nfs/dbraw/zinc/02/00/86/260020086.db2.gz	HXMZXBMSSJPFIC-GFCCVEGCSA-N	0	0	260.381	4.070	20	30		CIEDRN
CC[C@H](C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1	ZINC000519977542	260037850	/nfs/dbraw/zinc/03/78/50/260037850.db2.gz	XQZDGPZHFJRCSF-ZDUSSCGKSA-N	0	0	294.354	4.335	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@H](C)c1cc2ccccc2s1	ZINC000182756882	260055208	/nfs/dbraw/zinc/05/52/08/260055208.db2.gz	IQGDRMHLQDWCAI-GFCCVEGCSA-N	0	0	288.416	4.180	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C)n1C	ZINC000188065673	260070528	/nfs/dbraw/zinc/07/05/28/260070528.db2.gz	PZQMYQXIKUNXON-UHFFFAOYSA-N	0	0	296.414	4.438	20	30		CIEDRN
N#Cc1c(N[C@@H]2CCC[C@@H]3C[C@@H]32)cccc1C(F)F	ZINC000521370290	260088890	/nfs/dbraw/zinc/08/88/90/260088890.db2.gz	PCJRMJWANYHLNO-SUZMYJTESA-N	0	0	262.303	4.096	20	30		CIEDRN
N#CC[C@H](CC(=O)N1CCCC12CCCC2)c1ccccc1	ZINC000370596078	260089378	/nfs/dbraw/zinc/08/93/78/260089378.db2.gz	CLMHPNRZOPDUIU-QGZVFWFLSA-N	0	0	296.414	4.009	20	30		CIEDRN
Cc1ccc([N+](=O)[O-])cc1[C@H](C)Sc1cc(C#N)ccn1	ZINC000180035908	260090092	/nfs/dbraw/zinc/09/00/92/260090092.db2.gz	UQUHNCLIPSKWGZ-NSHDSACASA-N	0	0	299.355	4.023	20	30		CIEDRN
Cc1cc(Cl)c(C(=O)Nc2ccc(C#N)cc2)cc1C	ZINC000180217024	260095710	/nfs/dbraw/zinc/09/57/10/260095710.db2.gz	KJJAIJSNYNZNDX-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
CC1(C(=O)Nc2ccc(CC#N)cc2)CCCCCC1	ZINC000180337054	260098262	/nfs/dbraw/zinc/09/82/62/260098262.db2.gz	QNKWMASWTANNEC-UHFFFAOYSA-N	0	0	270.376	4.052	20	30		CIEDRN
CC(C)(C)C[C@H](NCc1ccc(C#N)cc1)C(F)(F)F	ZINC000180366342	260099511	/nfs/dbraw/zinc/09/95/11/260099511.db2.gz	NRGQRDBRNSPSRG-ZDUSSCGKSA-N	0	0	284.325	4.015	20	30		CIEDRN
C=C(C)CN(C)C(=O)CCCCCO[C@@H]1CCC[C@H](C)C1	ZINC000180438766	260101985	/nfs/dbraw/zinc/10/19/85/260101985.db2.gz	RHUBDEBGCOWBMN-DLBZAZTESA-N	0	0	295.467	4.177	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1sccc1-c1ccc(C)cc1	ZINC000180418219	260102826	/nfs/dbraw/zinc/10/28/26/260102826.db2.gz	STYSCBBILRZXAS-UHFFFAOYSA-N	0	0	285.412	4.372	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1sccc1-c1ccccc1	ZINC000180455619	260102876	/nfs/dbraw/zinc/10/28/76/260102876.db2.gz	YCKIIYIPEJAMKH-UHFFFAOYSA-N	0	0	271.385	4.063	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1cc2ccccc2c2cccnc12	ZINC000180472224	260103535	/nfs/dbraw/zinc/10/35/35/260103535.db2.gz	XIGKPSSYNZFHJP-UHFFFAOYSA-N	0	0	290.366	4.036	20	30		CIEDRN
N#Cc1ccc(Cl)cc1NC[C@H]1CCC(F)(F)C1	ZINC000305899416	260104348	/nfs/dbraw/zinc/10/43/48/260104348.db2.gz	PQIYCPNWOVLURN-VIFPVBQESA-N	0	0	270.710	4.059	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cc(C(C)=O)ccc1Cl	ZINC000297544007	260128600	/nfs/dbraw/zinc/12/86/00/260128600.db2.gz	AHGCPJDCBXVROH-UHFFFAOYSA-N	0	0	279.767	4.083	20	30		CIEDRN
CC(C)(C#N)CCCNc1ccccc1C(F)(F)F	ZINC000087596974	260191659	/nfs/dbraw/zinc/19/16/59/260191659.db2.gz	XSMUYJXRCXVHGM-UHFFFAOYSA-N	0	0	270.298	4.447	20	30		CIEDRN
CC(C)(C#N)CCCOc1ccc(Br)cc1	ZINC000087598971	260191662	/nfs/dbraw/zinc/19/16/62/260191662.db2.gz	JAVVPHCWSNFMHV-UHFFFAOYSA-N	0	0	282.181	4.158	20	30		CIEDRN
COc1cc(Cl)c(C)cc1NCCCC(C)(C)C#N	ZINC000087596973	260191881	/nfs/dbraw/zinc/19/18/81/260191881.db2.gz	FKMNLHFGQBJHRX-UHFFFAOYSA-N	0	0	280.799	4.399	20	30		CIEDRN
CC(C)(C#N)CCCOc1cccc2c1OC(C)(C)C2	ZINC000087608920	260192168	/nfs/dbraw/zinc/19/21/68/260192168.db2.gz	KGYBZQDGJPWASW-UHFFFAOYSA-N	0	0	273.376	4.109	20	30		CIEDRN
C[C@H]1Cc2ccccc2N(CCCC(C)(C)C#N)C1	ZINC000087608740	260192365	/nfs/dbraw/zinc/19/23/65/260192365.db2.gz	FQRXNGWMAJXNOT-AWEZNQCLSA-N	0	0	256.393	4.015	20	30		CIEDRN
CCc1cccc(C)c1NCc1ccc(OC)c(C#N)c1	ZINC000087823771	260218431	/nfs/dbraw/zinc/21/84/31/260218431.db2.gz	BFICLYHMGMTHPW-UHFFFAOYSA-N	0	0	280.371	4.050	20	30		CIEDRN
N#Cc1ccc(OC[C@H]2CCCC(F)(F)C2)cc1Cl	ZINC000311161170	260239354	/nfs/dbraw/zinc/23/93/54/260239354.db2.gz	LHSCGFDLOLGNDL-JTQLQIEISA-N	0	0	285.721	4.416	20	30		CIEDRN
C=CCC[C@@H](C(=O)Nc1ccncc1C)c1ccccc1	ZINC000187726527	260253854	/nfs/dbraw/zinc/25/38/54/260253854.db2.gz	CYCHZBXQRHMWBK-MRXNPFEDSA-N	0	0	280.371	4.079	20	30		CIEDRN
CC[C@H](c1nnc(SCCCC#N)o1)c1ccccc1	ZINC000067953992	260254148	/nfs/dbraw/zinc/25/41/48/260254148.db2.gz	QZLXNSOUPVEQJY-ZDUSSCGKSA-N	0	0	287.388	4.007	20	30		CIEDRN
Cc1cc(C#N)cc(C)c1OCCCOc1ccccc1	ZINC000088154671	260278402	/nfs/dbraw/zinc/27/84/02/260278402.db2.gz	HCAPONRQIMRUGT-UHFFFAOYSA-N	0	0	281.355	4.023	20	30		CIEDRN
CC(C)(C)CCC(=O)Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000313341237	260286018	/nfs/dbraw/zinc/28/60/18/260286018.db2.gz	VPGIQQZPSDAYMY-UHFFFAOYSA-N	0	0	298.308	4.342	20	30		CIEDRN
CSCC1CCC(Nc2cccc(CC#N)c2)CC1	ZINC000313412985	260291870	/nfs/dbraw/zinc/29/18/70/260291870.db2.gz	UNOGNMIFAVRJOY-UHFFFAOYSA-N	0	0	274.433	4.086	20	30		CIEDRN
N#CCc1cccc(NC2CC(c3ccc(F)cc3)C2)c1	ZINC000313428581	260293051	/nfs/dbraw/zinc/29/30/51/260293051.db2.gz	OQJRSLTVNNWUMN-UHFFFAOYSA-N	0	0	280.346	4.250	20	30		CIEDRN
C[C@H](CCNc1cccc(CC#N)c1)c1ccccc1	ZINC000313437204	260293481	/nfs/dbraw/zinc/29/34/81/260293481.db2.gz	NGCCMALWEBGCHQ-OAHLLOKOSA-N	0	0	264.372	4.358	20	30		CIEDRN
Cc1ccc(C(=O)/C=C/c2cnc(C(C)(C)C)s2)o1	ZINC000078162178	260299593	/nfs/dbraw/zinc/29/95/93/260299593.db2.gz	KKJPMZSBZBMUDM-VOTSOKGWSA-N	0	0	275.373	4.238	20	30		CIEDRN
CC(C)(C)c1csc(COc2cc(F)cc(C#N)c2)n1	ZINC000313504000	260299971	/nfs/dbraw/zinc/29/99/71/260299971.db2.gz	KWKQWQDDEWIBTA-UHFFFAOYSA-N	0	0	290.363	4.030	20	30		CIEDRN
C=C1CCN(C(=O)CCSc2ccc(Cl)cc2)CC1	ZINC000517806261	260308811	/nfs/dbraw/zinc/30/88/11/260308811.db2.gz	XXIUDMYTGQFPAT-UHFFFAOYSA-N	0	0	295.835	4.001	20	30		CIEDRN
N#Cc1ccc(CNc2ccc3c4c(cccc42)CC3)cc1	ZINC000517967051	260330401	/nfs/dbraw/zinc/33/04/01/260330401.db2.gz	ACNHMIFLCNORGG-UHFFFAOYSA-N	0	0	284.362	4.422	20	30		CIEDRN
C=CCN(Cc1ccc(OC)cc1)C(=O)CC1=CCCCC1	ZINC000518030493	260337249	/nfs/dbraw/zinc/33/72/49/260337249.db2.gz	WSHUGVGDLABSEF-UHFFFAOYSA-N	0	0	299.414	4.100	20	30		CIEDRN
N#Cc1cccc(N[C@@H]2CCCc3sccc32)c1[N+](=O)[O-]	ZINC000125905693	260344757	/nfs/dbraw/zinc/34/47/57/260344757.db2.gz	QCMIEHSSWJOTGH-GFCCVEGCSA-N	0	0	299.355	4.017	20	30		CIEDRN
C=CCN1C(=O)c2ccccc2N[C@@H]1c1cccc(C)c1C	ZINC000518216733	260356897	/nfs/dbraw/zinc/35/68/97/260356897.db2.gz	NKRDNDUNQKISPD-SFHVURJKSA-N	0	0	292.382	4.056	20	30		CIEDRN
Cc1cccc(Cl)c1NCc1ccc(C#N)cc1	ZINC000090524539	260366559	/nfs/dbraw/zinc/36/65/59/260366559.db2.gz	QHRRADJTDRZZJI-UHFFFAOYSA-N	0	0	256.736	4.132	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)/C=C/C=C\C	ZINC000211846819	260370155	/nfs/dbraw/zinc/37/01/55/260370155.db2.gz	HERAGPWTAVPHCN-AIJKMKQJSA-N	0	0	281.808	4.048	20	30		CIEDRN
CC(C)(CCC#N)CNc1cccc(C(F)F)c1	ZINC000128482047	260374547	/nfs/dbraw/zinc/37/45/47/260374547.db2.gz	HCGVMHKZGYDAFD-UHFFFAOYSA-N	0	0	252.308	4.366	20	30		CIEDRN
C=CCOCc1nc(-c2ccc(-c3ccccc3)cc2)no1	ZINC000518335380	260379160	/nfs/dbraw/zinc/37/91/60/260379160.db2.gz	FGNDEJXYIFACRS-UHFFFAOYSA-N	0	0	292.338	4.106	20	30		CIEDRN
C[C@@H](CC#N)N(C)C(=O)Nc1cccc(-c2cccs2)c1	ZINC000086285003	260388166	/nfs/dbraw/zinc/38/81/66/260388166.db2.gz	SYOHPNWSQMAQNR-LBPRGKRZSA-N	0	0	299.399	4.181	20	30		CIEDRN
C=CC1CCN(C(=O)Cc2coc3c2ccc(C)c3C)CC1	ZINC000518378438	260391638	/nfs/dbraw/zinc/39/16/38/260391638.db2.gz	RLNJMFKXJIPUTI-UHFFFAOYSA-N	0	0	297.398	4.017	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@@H]1CC[C@H]2CCCC[C@@H]2C1	ZINC000410123907	260462758	/nfs/dbraw/zinc/46/27/58/260462758.db2.gz	IJJRSOOUXGHTNJ-FPCVCCKLSA-N	0	0	263.425	4.064	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)[C@H](C)c1cc2ccccc2o1	ZINC000410125186	260463218	/nfs/dbraw/zinc/46/32/18/260463218.db2.gz	WUIOAXRZGRVIGA-TZMCWYRMSA-N	0	0	271.360	4.007	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1cccc(OCC)c1	ZINC000410343805	260487425	/nfs/dbraw/zinc/48/74/25/260487425.db2.gz	FXJIGOBWDVMHNM-UHFFFAOYSA-N	0	0	295.382	4.456	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)[C@H](C)C(C)(C)C	ZINC000410369387	260490493	/nfs/dbraw/zinc/49/04/93/260490493.db2.gz	DYBOPTOHUWELBV-ZDUSSCGKSA-N	0	0	259.393	4.426	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1cscc1C	ZINC000410375525	260493047	/nfs/dbraw/zinc/49/30/47/260493047.db2.gz	QALJMBOOGZGRNZ-UHFFFAOYSA-N	0	0	271.385	4.427	20	30		CIEDRN
Cc1c(Cl)cccc1NCc1cc(C#N)cs1	ZINC000093684923	260522987	/nfs/dbraw/zinc/52/29/87/260522987.db2.gz	RGCQUPOSLWGNGA-UHFFFAOYSA-N	0	0	262.765	4.194	20	30		CIEDRN
CC(C)c1ccccc1NCc1cc(C#N)cs1	ZINC000093684973	260523504	/nfs/dbraw/zinc/52/35/04/260523504.db2.gz	HGIYJTYKTWGDMD-UHFFFAOYSA-N	0	0	256.374	4.355	20	30		CIEDRN
C#CCCCCNC(=O)Nc1c(C)cccc1C(C)C	ZINC000150755059	260583133	/nfs/dbraw/zinc/58/31/33/260583133.db2.gz	YIAXFZSHIJTIRH-UHFFFAOYSA-N	0	0	272.392	4.043	20	30		CIEDRN
Cc1ccc(C#N)cc1NCc1ccc2ncccc2c1	ZINC000050430390	260689886	/nfs/dbraw/zinc/68/98/86/260689886.db2.gz	PRZAFPDUKIDHBI-UHFFFAOYSA-N	0	0	273.339	4.027	20	30		CIEDRN
C=CCC[C@H](C(=O)Nc1cc(C)ccc1O)c1ccccc1	ZINC000427635859	260794530	/nfs/dbraw/zinc/79/45/30/260794530.db2.gz	HLVSSZPPBAUGIM-INIZCTEOSA-N	0	0	295.382	4.389	20	30		CIEDRN
CC[C@H](C#N)Sc1nnc([C@@H](CC)c2ccccc2)o1	ZINC000127649534	260802758	/nfs/dbraw/zinc/80/27/58/260802758.db2.gz	DBOWSFRFRBIRBI-OLZOCXBDSA-N	0	0	287.388	4.006	20	30		CIEDRN
Oc1ccc(SCC#Cc2cccc(Cl)c2)cc1	ZINC000448107241	260839607	/nfs/dbraw/zinc/83/96/07/260839607.db2.gz	FWYZSPPTFSFNEU-UHFFFAOYSA-N	0	0	274.772	4.189	20	30		CIEDRN
N#Cc1ccc(-c2nc3cc(F)ccc3s2)c(F)c1	ZINC000448110912	260841837	/nfs/dbraw/zinc/84/18/37/260841837.db2.gz	VSRZBCMBDSFRKP-UHFFFAOYSA-N	0	0	272.279	4.113	20	30		CIEDRN
CC(C)(C)c1cnc(SCCC(C)(C)C#N)o1	ZINC000130120028	260849437	/nfs/dbraw/zinc/84/94/37/260849437.db2.gz	YTEIYSSTVKLQGC-UHFFFAOYSA-N	0	0	252.383	4.004	20	30		CIEDRN
CC(C)(C#N)CCCCN1CCCc2cccc(F)c21	ZINC000444642241	261056062	/nfs/dbraw/zinc/05/60/62/261056062.db2.gz	SNVFMXIQEDNAJZ-UHFFFAOYSA-N	0	0	274.383	4.298	20	30		CIEDRN
C[C@@H](Nc1ccn(CCC#N)n1)c1ccc(C(C)(C)C)cc1	ZINC000152769989	261069330	/nfs/dbraw/zinc/06/93/30/261069330.db2.gz	YGLISLLGGLICEH-CQSZACIVSA-N	0	0	296.418	4.267	20	30		CIEDRN
CC[C@@H](C)c1ccc(OC[C@H](C#N)CCC#N)cc1	ZINC000153052363	261072829	/nfs/dbraw/zinc/07/28/29/261072829.db2.gz	SPPFDCZUDYIDND-KGLIPLIRSA-N	0	0	256.349	4.022	20	30		CIEDRN
Cc1ccc(C(=O)N[C@@H](CCC#N)c2ccccc2)c(C)c1	ZINC000153286568	261076239	/nfs/dbraw/zinc/07/62/39/261076239.db2.gz	DKOGHRNTQPMYAN-SFHVURJKSA-N	0	0	292.382	4.078	20	30		CIEDRN
C[C@@H](N[C@@H](C)c1cccnc1Cl)c1ccc(C#N)cc1	ZINC000154325773	261090213	/nfs/dbraw/zinc/09/02/13/261090213.db2.gz	CXUYRMGTVWSINU-NEPJUHHUSA-N	0	0	285.778	4.018	20	30		CIEDRN
CC(C)(C#N)CCCNc1cc(F)ccc1OC(F)F	ZINC000154385511	261091270	/nfs/dbraw/zinc/09/12/70/261091270.db2.gz	NULJXCJIOVDAEB-UHFFFAOYSA-N	0	0	286.297	4.169	20	30		CIEDRN
C[C@H]1CSC(SCc2ccccc2C(C)(C)C#N)=N1	ZINC000155747476	261106666	/nfs/dbraw/zinc/10/66/66/261106666.db2.gz	RFDGQEIPOWLARN-NSHDSACASA-N	0	0	290.457	4.212	20	30		CIEDRN
CC[C@@H](CC#N)NC(=O)Nc1ccccc1SC(C)C	ZINC000156207426	261117027	/nfs/dbraw/zinc/11/70/27/261117027.db2.gz	PDACBAZCGUFYEZ-LBPRGKRZSA-N	0	0	291.420	4.001	20	30		CIEDRN
CC[C@@H]1CCCCCN1C(=O)Nc1cc(C#N)ccc1C	ZINC000172443612	261155484	/nfs/dbraw/zinc/15/54/84/261155484.db2.gz	WXIUKWQAQCUUFO-OAHLLOKOSA-N	0	0	285.391	4.053	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1ccc(OC(C)(C)C)cc1	ZINC000173677046	261167020	/nfs/dbraw/zinc/16/70/20/261167020.db2.gz	VEUOQVHYLGRHOZ-UHFFFAOYSA-N	0	0	290.407	4.294	20	30		CIEDRN
N#Cc1ccccc1S[C@H](C#N)C1CCCCC1	ZINC000173712262	261168705	/nfs/dbraw/zinc/16/87/05/261168705.db2.gz	OBYFXJMFWLITEH-OAHLLOKOSA-N	0	0	256.374	4.123	20	30		CIEDRN
C[C@H](Nc1ccc2c(c1)CCCO2)c1ccc(C#N)cc1	ZINC000174035362	261175876	/nfs/dbraw/zinc/17/58/76/261175876.db2.gz	GXEQSRKVXMKVIY-ZDUSSCGKSA-N	0	0	278.355	4.056	20	30		CIEDRN
CC(C)Oc1cccc([C@@H](C)NCc2ccccc2C#N)c1	ZINC000160145361	261206133	/nfs/dbraw/zinc/20/61/33/261206133.db2.gz	FINSCSHQPUCRJE-OAHLLOKOSA-N	0	0	294.398	4.196	20	30		CIEDRN
CC(C)c1cccc(C(C)C)c1NC(=O)c1ccc(C#N)[nH]1	ZINC000160160281	261206945	/nfs/dbraw/zinc/20/69/45/261206945.db2.gz	RNTJVQPAXCSSOQ-UHFFFAOYSA-N	0	0	295.386	4.385	20	30		CIEDRN
CCC[C@H](C(=O)Nc1ccc(C#N)c(F)c1)c1ccccc1	ZINC000464642158	261207065	/nfs/dbraw/zinc/20/70/65/261207065.db2.gz	GWRDJVNOLBSYCM-INIZCTEOSA-N	0	0	296.345	4.220	20	30		CIEDRN
CN(C(=O)C1(C#N)CCC1)c1ccc(-c2ccccc2)cc1	ZINC000525715195	261207612	/nfs/dbraw/zinc/20/76/12/261207612.db2.gz	FPOAQTDSECQVOW-UHFFFAOYSA-N	0	0	290.366	4.010	20	30		CIEDRN
C[C@H](SCCCCC#N)c1ccc(F)cc1F	ZINC000161593201	261253053	/nfs/dbraw/zinc/25/30/53/261253053.db2.gz	QQSGRQWGUJQLTE-JTQLQIEISA-N	0	0	255.333	4.453	20	30		CIEDRN
CC(C)(C)c1csc(CSCCCCC#N)n1	ZINC000161937690	261263723	/nfs/dbraw/zinc/26/37/23/261263723.db2.gz	AMAKSDJUSLCSPP-UHFFFAOYSA-N	0	0	268.451	4.368	20	30		CIEDRN
C[C@@H](C#N)Oc1ccccc1N[C@@H](C)CCc1ccco1	ZINC000162276214	261275674	/nfs/dbraw/zinc/27/56/74/261275674.db2.gz	AQGOBMKYCXROFD-KBPBESRZSA-N	0	0	284.359	4.004	20	30		CIEDRN
CCC(CC)CN(CCC#N)C(=O)Nc1ccc(C)cc1	ZINC000176338141	261277165	/nfs/dbraw/zinc/27/71/65/261277165.db2.gz	ZDERLEFEWPYZDB-UHFFFAOYSA-N	0	0	287.407	4.179	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N1CCC[C@@H]1c1cccc(C)c1C	ZINC000176860606	261311766	/nfs/dbraw/zinc/31/17/66/261311766.db2.gz	UXMWODJZSNCFNB-RHSMWYFYSA-N	0	0	286.419	4.115	20	30		CIEDRN
CCCOc1ccccc1NCc1ccc(F)c(C#N)c1	ZINC000176960426	261321170	/nfs/dbraw/zinc/32/11/70/261321170.db2.gz	CHTWVXZJHFXTMC-UHFFFAOYSA-N	0	0	284.334	4.098	20	30		CIEDRN
CN(C(=O)c1cc(C#N)cs1)c1cccc2ccccc21	ZINC000176982402	261325473	/nfs/dbraw/zinc/32/54/73/261325473.db2.gz	NHEWMNTUWCIZIP-UHFFFAOYSA-N	0	0	292.363	4.050	20	30		CIEDRN
N#Cc1ccc(Oc2ccc(Cc3ccccc3)cc2)nc1	ZINC000301106304	261329736	/nfs/dbraw/zinc/32/97/36/261329736.db2.gz	LLOYPZKDIYQJPL-UHFFFAOYSA-N	0	0	286.334	4.336	20	30		CIEDRN
C=CC1CCN(C(=O)CCCc2cc(C)sc2C)CC1	ZINC000177253516	261340849	/nfs/dbraw/zinc/34/08/49/261340849.db2.gz	RCOWAARRPCUBIF-UHFFFAOYSA-N	0	0	291.460	4.112	20	30		CIEDRN
Cc1ccc(C(=O)Nc2cccc(C#N)c2C)cc1Cl	ZINC000178390124	261388876	/nfs/dbraw/zinc/38/88/76/261388876.db2.gz	CBWAPDFYDIPBGC-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)N(CC(C)C)CC(C)C	ZINC000178577876	261398149	/nfs/dbraw/zinc/39/81/49/261398149.db2.gz	QFTOAGLMTHOWBL-UHFFFAOYSA-N	0	0	287.407	4.013	20	30		CIEDRN
CCN(C(=O)C(C)=C1CCCC1)[C@H](C)c1ccc(C#N)cc1	ZINC000176576876	261659117	/nfs/dbraw/zinc/65/91/17/261659117.db2.gz	CTWOYFRNYTZUGA-OAHLLOKOSA-N	0	0	296.414	4.358	20	30		CIEDRN
CC[C@H](c1ccccc1)[S@](=O)CCCC(C)(C)C#N	ZINC000178109353	261725989	/nfs/dbraw/zinc/72/59/89/261725989.db2.gz	RPOGFJGJGLASQW-DNVCBOLYSA-N	0	0	277.433	4.216	20	30		CIEDRN
C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@@H](C)C1CC1	ZINC000178484261	261745295	/nfs/dbraw/zinc/74/52/95/261745295.db2.gz	TYTPXZSRIGIPFI-RYUDHWBXSA-N	0	0	288.416	4.065	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CCC2(CCCCC2)CC1	ZINC000187962952	261812096	/nfs/dbraw/zinc/81/20/96/261812096.db2.gz	STIXKSKQBJMGBX-MRXNPFEDSA-N	0	0	263.425	4.162	20	30		CIEDRN
N#Cc1ccc(S[C@@H]2CCCCC2=O)cc1C(F)(F)F	ZINC000181056471	261883381	/nfs/dbraw/zinc/88/33/81/261883381.db2.gz	DMWQVXCKGKUXNC-CYBMUJFWSA-N	0	0	299.317	4.181	20	30		CIEDRN
C[C@H]1CCCN(C(=O)c2cc(C#N)cs2)c2ccccc21	ZINC000183167748	261965364	/nfs/dbraw/zinc/96/53/64/261965364.db2.gz	NCONQYRXJXKXAB-LBPRGKRZSA-N	0	0	296.395	4.164	20	30		CIEDRN
C=CCCCSc1nc2ccccc2c(=O)n1C(C)C	ZINC000522746804	261982568	/nfs/dbraw/zinc/98/25/68/261982568.db2.gz	VMOHTHBNKMXQMI-UHFFFAOYSA-N	0	0	288.416	4.036	20	30		CIEDRN
Cc1coc2ccc(NC(=O)C3(C#N)CCCCC3)cc12	ZINC000185785187	262070321	/nfs/dbraw/zinc/07/03/21/262070321.db2.gz	BVFZUPVCPWNUHB-UHFFFAOYSA-N	0	0	282.343	4.154	20	30		CIEDRN
C[C@@H]1CCCCN(C(=O)Nc2ccc(C(C)(C)C#N)cc2)C1	ZINC000186088907	262078860	/nfs/dbraw/zinc/07/88/60/262078860.db2.gz	MRRFLPJTZOKCQU-CQSZACIVSA-N	0	0	299.418	4.142	20	30		CIEDRN
C=C(C)CSCc1ccc(OC(F)F)c(OC)c1	ZINC000497233108	262116853	/nfs/dbraw/zinc/11/68/53/262116853.db2.gz	WOGJPTBUSMURNW-UHFFFAOYSA-N	0	0	274.332	4.106	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)CCCc1cccs1	ZINC000187513622	262138328	/nfs/dbraw/zinc/13/83/28/262138328.db2.gz	HPDMWHYJTZCWDF-UHFFFAOYSA-N	0	0	292.448	4.002	20	30		CIEDRN
C[C@@H](NC[C@@H](C#N)CCC#N)c1cc(Cl)ccc1Cl	ZINC000187526865	262139956	/nfs/dbraw/zinc/13/99/56/262139956.db2.gz	VOOJAKLNIXFCBE-GHMZBOCLSA-N	0	0	296.201	4.088	20	30		CIEDRN
CC#CCCCC(=O)N1CCC[C@H]1c1ccc(C)c(C)c1	ZINC000364078732	262141568	/nfs/dbraw/zinc/14/15/68/262141568.db2.gz	IOIVTXGSTXXOPJ-SFHVURJKSA-N	0	0	283.415	4.161	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@H](CC(C)C)c1cccs1	ZINC000497363519	262147053	/nfs/dbraw/zinc/14/70/53/262147053.db2.gz	GBSCPYSUNTZFKQ-CYBMUJFWSA-N	0	0	280.437	4.053	20	30		CIEDRN
C[C@@H](CCC#N)Sc1ncc(C(C)(C)C)s1	ZINC000188325224	262153876	/nfs/dbraw/zinc/15/38/76/262153876.db2.gz	FAXWUSPETLWASP-VIFPVBQESA-N	0	0	254.424	4.225	20	30		CIEDRN
CN(CC(C)(C)C#N)C(=O)c1ccc(C2CCCCC2)cc1	ZINC000497426522	262158640	/nfs/dbraw/zinc/15/86/40/262158640.db2.gz	DBAWJKLEXHKKNM-UHFFFAOYSA-N	0	0	298.430	4.356	20	30		CIEDRN
C/C=C\c1ccc(NC(=O)NCC2CCC(C#N)CC2)cc1	ZINC000497442057	262161256	/nfs/dbraw/zinc/16/12/56/262161256.db2.gz	NRCYADDUZWJEES-IHWYPQMZSA-N	0	0	297.402	4.171	20	30		CIEDRN
C/C=C(/CC)C(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1	ZINC000189112030	262167845	/nfs/dbraw/zinc/16/78/45/262167845.db2.gz	DKYGZGIXYHPJLX-ZCMXANCESA-N	0	0	297.185	4.031	20	30		CIEDRN
N#Cc1ccc(Sc2ccc(C(F)(F)F)cn2)cc1	ZINC000019867953	262171775	/nfs/dbraw/zinc/17/17/75/262171775.db2.gz	BACSGJPRLXREDQ-UHFFFAOYSA-N	0	0	280.274	4.123	20	30		CIEDRN
CN(Cc1ccc(F)cc1Cl)c1cccc(F)c1C#N	ZINC000501271129	262182946	/nfs/dbraw/zinc/18/29/46/262182946.db2.gz	ABAHIWVJLPJMPQ-UHFFFAOYSA-N	0	0	292.716	4.126	20	30		CIEDRN
Cc1nc(SCc2ccccc2Cl)ccc1C#N	ZINC000310952442	262184426	/nfs/dbraw/zinc/18/44/26/262184426.db2.gz	ZKUJHDXLDFBFQZ-UHFFFAOYSA-N	0	0	274.776	4.207	20	30		CIEDRN
C=CCn1cccc1C(=O)Nc1cccc(O[C@H](C)CC)c1	ZINC000497659877	262185939	/nfs/dbraw/zinc/18/59/39/262185939.db2.gz	HDIJTWXMGMGZMF-CQSZACIVSA-N	0	0	298.386	4.104	20	30		CIEDRN
Cc1ccc(SCc2cccc(C#N)c2)c(C)c1	ZINC000020021045	262186191	/nfs/dbraw/zinc/18/61/91/262186191.db2.gz	JCVFYAFUNGZWJU-UHFFFAOYSA-N	0	0	253.370	4.467	20	30		CIEDRN
C[C@H](Sc1ccc(C#N)cn1)c1cccc(Cl)c1	ZINC000497682692	262189255	/nfs/dbraw/zinc/18/92/55/262189255.db2.gz	AEZVDHMWCOOANK-JTQLQIEISA-N	0	0	274.776	4.460	20	30		CIEDRN
C[C@H](Sc1ccc(C#N)cn1)c1ccc(F)c(F)c1	ZINC000497682917	262189277	/nfs/dbraw/zinc/18/92/77/262189277.db2.gz	GQUASNOXCFGWIJ-VIFPVBQESA-N	0	0	276.311	4.085	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H](C)CC#N	ZINC000191489251	262192729	/nfs/dbraw/zinc/19/27/29/262192729.db2.gz	SLRKVPZEVYTSQF-CQSZACIVSA-N	0	0	299.418	4.304	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)CCc1ccc(C)cc1	ZINC000497799003	262211103	/nfs/dbraw/zinc/21/11/03/262211103.db2.gz	POEDFFMHCAWFPM-UHFFFAOYSA-N	0	0	293.410	4.142	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)c1cc(C)cc(C)c1	ZINC000497817476	262212637	/nfs/dbraw/zinc/21/26/37/262212637.db2.gz	KEGYPKFVRQFTPR-UHFFFAOYSA-N	0	0	279.383	4.132	20	30		CIEDRN
CCCC(=O)Nc1cccc(N[C@H]2CCC[C@@H](C#N)C2)c1C	ZINC000193087264	262215860	/nfs/dbraw/zinc/21/58/60/262215860.db2.gz	VZYHMHIYXHRCGG-CABCVRRESA-N	0	0	299.418	4.228	20	30		CIEDRN
N#C[C@@H]1CCC[C@H](Nc2cccc(COCC3CC3)c2)C1	ZINC000193088219	262216028	/nfs/dbraw/zinc/21/60/28/262216028.db2.gz	WJWVHBAGHHZFEG-WBVHZDCISA-N	0	0	284.403	4.107	20	30		CIEDRN
N#C[C@H]1CCC[C@H](Nc2cccc(COCC3CC3)c2)C1	ZINC000193088187	262216152	/nfs/dbraw/zinc/21/61/52/262216152.db2.gz	WJWVHBAGHHZFEG-RDJZCZTQSA-N	0	0	284.403	4.107	20	30		CIEDRN
COc1cc(NCCCC(C)(C)C#N)ccc1Cl	ZINC000193313140	262220653	/nfs/dbraw/zinc/22/06/53/262220653.db2.gz	AXWYOGQMXFMKQZ-UHFFFAOYSA-N	0	0	266.772	4.090	20	30		CIEDRN
C=CCN(CC=C)C(=O)[C@H]1C[C@H]1c1cccc2ccccc21	ZINC000502885581	262233383	/nfs/dbraw/zinc/23/33/83/262233383.db2.gz	AFWMVWVPNRMEKQ-OALUTQOASA-N	0	0	291.394	4.144	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@@H](OC(C)C)c1ccccc1	ZINC000497938941	262235985	/nfs/dbraw/zinc/23/59/85/262235985.db2.gz	SOGWNZLZWJBYJN-RDJZCZTQSA-N	0	0	289.419	4.014	20	30		CIEDRN
N#C[C@H]1CCC[C@H](Nc2ccc(C3CCC3)cc2)C1	ZINC000494475898	262272874	/nfs/dbraw/zinc/27/28/74/262272874.db2.gz	NGPWJDQGYGZRNC-GUYCJALGSA-N	0	0	254.377	4.448	20	30		CIEDRN
COc1ccccc1[C@@H](C)Sc1ccc(C#N)c(C)n1	ZINC000488054303	262280068	/nfs/dbraw/zinc/28/00/68/262280068.db2.gz	GODGKSFTUCWKBX-GFCCVEGCSA-N	0	0	284.384	4.124	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)c1cccc(SC)c1	ZINC000410559298	262290486	/nfs/dbraw/zinc/29/04/86/262290486.db2.gz	RCLUFICCWOMXKR-UHFFFAOYSA-N	0	0	290.432	4.001	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cccc(CC(F)(F)F)c1	ZINC000188465170	262298567	/nfs/dbraw/zinc/29/85/67/262298567.db2.gz	PWDLMJZQUYNJFY-AWEZNQCLSA-N	0	0	285.309	4.332	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cccc(Oc2ccccn2)c1	ZINC000188471984	262299059	/nfs/dbraw/zinc/29/90/59/262299059.db2.gz	HSIAAELDTQPUNH-SFHVURJKSA-N	0	0	296.370	4.415	20	30		CIEDRN
Cc1ccc(Br)cc1N[C@H]1CCC[C@@H](C#N)C1	ZINC000463285974	262305281	/nfs/dbraw/zinc/30/52/81/262305281.db2.gz	ZFRLEKDKLVUOOR-YPMHNXCESA-N	0	0	293.208	4.252	20	30		CIEDRN
N#CCCCCSCc1ccc(F)cc1Cl	ZINC000161033609	262307525	/nfs/dbraw/zinc/30/75/25/262307525.db2.gz	HQHNRFVQQIBHRF-UHFFFAOYSA-N	0	0	257.761	4.406	20	30		CIEDRN
N#CCCCCSCc1cc(-c2ccccc2)on1	ZINC000161199484	262312813	/nfs/dbraw/zinc/31/28/13/262312813.db2.gz	JRNDDZCCLZJCJW-UHFFFAOYSA-N	0	0	272.373	4.269	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC)[C@H](C)Cc1ccsc1	ZINC000186337819	262313811	/nfs/dbraw/zinc/31/38/11/262313811.db2.gz	PNNFMSVZSQUYPB-CQSZACIVSA-N	0	0	291.460	4.296	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CCC(C)(c2ccccc2)CC1	ZINC000188544592	262314738	/nfs/dbraw/zinc/31/47/38/262314738.db2.gz	BXCPTXUATHZXTP-SFHVURJKSA-N	0	0	285.431	4.169	20	30		CIEDRN
CCCC[C@@H](CCC)NC(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000462201865	262318159	/nfs/dbraw/zinc/31/81/59/262318159.db2.gz	FDSFUBWYMXXADF-WMLDXEAASA-N	0	0	286.419	4.137	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CC[C@H](c2cc(C)cc(C)c2)C1	ZINC000188581670	262319137	/nfs/dbraw/zinc/31/91/37/262319137.db2.gz	GKBUQBWGMJHDME-QFBILLFUSA-N	0	0	285.431	4.222	20	30		CIEDRN
CC[C@H](C)[C@H]1CCCCN1C(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000462211196	262324950	/nfs/dbraw/zinc/32/49/50/262324950.db2.gz	SALQIUUYZULRQN-RLFYNMQTSA-N	0	0	298.430	4.089	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2cccc(C(C)(F)F)c2)CC1	ZINC000186968263	262331527	/nfs/dbraw/zinc/33/15/27/262331527.db2.gz	ZJLMKXDWKOIYSJ-UHFFFAOYSA-N	0	0	294.345	4.228	20	30		CIEDRN
N#Cc1cc(F)ccc1CSCc1cccc(F)c1F	ZINC000488537463	262332182	/nfs/dbraw/zinc/33/21/82/262332182.db2.gz	AACSAXBWSDIVTF-UHFFFAOYSA-N	0	0	293.313	4.409	20	30		CIEDRN
C=CCCCSCc1nc(-c2cccc(C)c2)no1	ZINC000522758197	262338804	/nfs/dbraw/zinc/33/88/04/262338804.db2.gz	LCNYJQQJYSTMJS-UHFFFAOYSA-N	0	0	274.389	4.244	20	30		CIEDRN
Cc1cccc([C@H]2CCCCCN2C(=O)CC(C)(C)C#N)c1	ZINC000365491544	262367193	/nfs/dbraw/zinc/36/71/93/262367193.db2.gz	OHZAEMBJKABBSO-QGZVFWFLSA-N	0	0	298.430	4.379	20	30		CIEDRN
Cc1cc(Cl)ccc1C(=O)N(CCC#N)CCC(C)C	ZINC000163135917	262393083	/nfs/dbraw/zinc/39/30/83/262393083.db2.gz	CTDTTZIWELGXJH-UHFFFAOYSA-N	0	0	292.810	4.050	20	30		CIEDRN
N#Cc1ccc(N[C@H]2CCCc3sccc32)c(F)c1	ZINC000061364264	262396158	/nfs/dbraw/zinc/39/61/58/262396158.db2.gz	MDWXORRTPYRSRM-ZDUSSCGKSA-N	0	0	272.348	4.248	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@@H](C)CCCc1ccccc1	ZINC000488812000	262396660	/nfs/dbraw/zinc/39/66/60/262396660.db2.gz	CSTJOGWNWDKIHA-FUHWJXTLSA-N	0	0	285.431	4.213	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)[C@H](C)CCCc1ccccc1	ZINC000488811999	262396806	/nfs/dbraw/zinc/39/68/06/262396806.db2.gz	CSTJOGWNWDKIHA-AEFFLSMTSA-N	0	0	285.431	4.213	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1[nH]c2ccc(F)cc2c1Cl	ZINC000337086184	262420654	/nfs/dbraw/zinc/42/06/54/262420654.db2.gz	DWFIAXYZQJEDMB-SNVBAGLBSA-N	0	0	294.757	4.045	20	30		CIEDRN
N#Cc1ccsc1C(=O)Nc1cccc2ccsc21	ZINC000337442845	262451783	/nfs/dbraw/zinc/45/17/83/262451783.db2.gz	KHYPFVRTTCGJAI-UHFFFAOYSA-N	0	0	284.365	4.087	20	30		CIEDRN
C[C@H](C#N)CN(Cc1c(Cl)ccc2cccnc21)C1CC1	ZINC000338357305	262527623	/nfs/dbraw/zinc/52/76/23/262527623.db2.gz	ZENAASCLSIRCAS-GFCCVEGCSA-N	0	0	299.805	4.012	20	30		CIEDRN
Cc1cc(Cl)c2ncc(C#N)c(NCCCCC#N)c2c1	ZINC000338488071	262540272	/nfs/dbraw/zinc/54/02/72/262540272.db2.gz	UPDZQJRDVILIIB-UHFFFAOYSA-N	0	0	298.777	4.174	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(C#N)cc2Cl)CCCC1	ZINC000410586293	262626692	/nfs/dbraw/zinc/62/66/92/262626692.db2.gz	FDHMDEMAKGLPLJ-UHFFFAOYSA-N	0	0	288.778	4.287	20	30		CIEDRN
C=CCC(C)(C)C(=O)N(C)[C@@H](CC)c1cccc(OC)c1	ZINC000410869042	262670324	/nfs/dbraw/zinc/67/03/24/262670324.db2.gz	LCLPGQYZXKTLPV-INIZCTEOSA-N	0	0	289.419	4.207	20	30		CIEDRN
CCCC(=O)Nc1sc2c(c1C#N)C[C@H](C)C[C@@H]2C	ZINC000410969340	262674152	/nfs/dbraw/zinc/67/41/52/262674152.db2.gz	FLMRUBZYWMGZLH-ZJUUUORDSA-N	0	0	276.405	4.044	20	30		CIEDRN
CC(C)(C)c1cc(C#N)c(NC(=O)[C@@H]2CC=CCC2)s1	ZINC000411005573	262674786	/nfs/dbraw/zinc/67/47/86/262674786.db2.gz	HARPXAJQQHAAOI-LLVKDONJSA-N	0	0	288.416	4.212	20	30		CIEDRN
C[C@H](CCC#N)N(C)Cc1c(Cl)cccc1Cl	ZINC000411203994	262684329	/nfs/dbraw/zinc/68/43/29/262684329.db2.gz	UBHYZRDJUUOZOF-SNVBAGLBSA-N	0	0	271.191	4.117	20	30		CIEDRN
C[C@H]1C[C@@H]1N(CCCC1(C#N)CCOCC1)c1ccccc1	ZINC000411929824	262710188	/nfs/dbraw/zinc/71/01/88/262710188.db2.gz	YFPICDXLFUIIMF-WMZOPIPTSA-N	0	0	298.430	4.002	20	30		CIEDRN
C=CCC1(C(=O)N2CC(c3cccc(Cl)c3)C2)CCC1	ZINC000412384463	262730207	/nfs/dbraw/zinc/73/02/07/262730207.db2.gz	AZVJNLMDDRZYBE-UHFFFAOYSA-N	0	0	289.806	4.012	20	30		CIEDRN
C=CC[C@H](Cc1ccccc1)NC(=O)[C@H](C)c1cccs1	ZINC000412846884	262745089	/nfs/dbraw/zinc/74/50/89/262745089.db2.gz	XLZDARZIFQACFP-GDBMZVCRSA-N	0	0	299.439	4.155	20	30		CIEDRN
CC1(C)CC[C@H](Sc2ccc(C#N)cc2Cl)C1=O	ZINC000412995159	262751106	/nfs/dbraw/zinc/75/11/06/262751106.db2.gz	CAUNWRJLAKDFEJ-LBPRGKRZSA-N	0	0	279.792	4.061	20	30		CIEDRN
COc1ccccc1-c1nc2cccc(C)c2c(C)c1C#N	ZINC000435946709	262754474	/nfs/dbraw/zinc/75/44/74/262754474.db2.gz	ZNKCZBFYNLGVQG-UHFFFAOYSA-N	0	0	288.350	4.399	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)NC[C@H](CC)CC(F)(F)F	ZINC000413447962	262764788	/nfs/dbraw/zinc/76/47/88/262764788.db2.gz	YLBPMRCWRCNOCD-NWDGAFQWSA-N	0	0	294.361	4.009	20	30		CIEDRN
C[C@H](c1nc2ccccc2s1)N(C)CCC(C)(C)C#N	ZINC000271999054	263001099	/nfs/dbraw/zinc/00/10/99/263001099.db2.gz	GYUJOTLDUHDADR-GFCCVEGCSA-N	0	0	287.432	4.229	20	30		CIEDRN
CC1(C#N)CCN(c2ccnc3ccc(Cl)cc32)CC1	ZINC000272395919	263003833	/nfs/dbraw/zinc/00/38/33/263003833.db2.gz	AGRUCLYYNLCQLU-UHFFFAOYSA-N	0	0	285.778	4.018	20	30		CIEDRN
CC(C)(C#N)CCSCc1csc(C2CC2)n1	ZINC000276609340	263037496	/nfs/dbraw/zinc/03/74/96/263037496.db2.gz	LMSMYCLSDMUAOH-UHFFFAOYSA-N	0	0	266.435	4.194	20	30		CIEDRN
Cc1ccc(Cl)cc1-c1noc(C2(C#N)CCCC2)n1	ZINC000273948759	263020720	/nfs/dbraw/zinc/02/07/20/263020720.db2.gz	SSXNJGSMKCKEFV-UHFFFAOYSA-N	0	0	287.750	4.034	20	30		CIEDRN
N#Cc1cccc(/C=C/c2nc([C@@H]3CCCCS3)no2)c1	ZINC000274172918	263021630	/nfs/dbraw/zinc/02/16/30/263021630.db2.gz	YWQMKKQKRWWREK-NPQIQWPPSA-N	0	0	297.383	4.070	20	30		CIEDRN
N#C[C@@H]1CCC[C@@H](Nc2ccc(N3CCCCC3)cc2)C1	ZINC000274220702	263022046	/nfs/dbraw/zinc/02/20/46/263022046.db2.gz	PQSRWTBYLBJLAW-NVXWUHKLSA-N	0	0	283.419	4.171	20	30		CIEDRN
C[C@@H](CCC(=O)N[C@](C)(C#N)C(C)(C)C)c1ccccc1	ZINC000274321110	263023213	/nfs/dbraw/zinc/02/32/13/263023213.db2.gz	KIRYNUPAFZPTSH-KBXCAEBGSA-N	0	0	286.419	4.015	20	30		CIEDRN
CCOc1ccccc1OCCSCCC(C)(C)C#N	ZINC000276589544	263037369	/nfs/dbraw/zinc/03/73/69/263037369.db2.gz	IHIGYPXFKZLDOK-UHFFFAOYSA-N	0	0	293.432	4.137	20	30		CIEDRN
CCCCCCC[C@H](CC(=O)[O-])[NH2+]Cc1ccc(F)cc1	ZINC000277482086	263041536	/nfs/dbraw/zinc/04/15/36/263041536.db2.gz	WQTOYLFUYQATCQ-MRXNPFEDSA-N	0	0	295.398	4.119	20	30		CIEDRN
c1sc(CON=C2CCC2)nc1C1CCCCC1	ZINC000277666280	263042854	/nfs/dbraw/zinc/04/28/54/263042854.db2.gz	SDZQBHYICZPMPH-UHFFFAOYSA-N	0	0	264.394	4.247	20	30		CIEDRN
Cc1nc(CSCCCCC(C)(C)C#N)cs1	ZINC000278044262	263045233	/nfs/dbraw/zinc/04/52/33/263045233.db2.gz	XUNBKBZGZWYROT-UHFFFAOYSA-N	0	0	268.451	4.405	20	30		CIEDRN
CC(C)(C#N)CC(=O)N1CCCCC[C@@H]1c1ccccc1	ZINC000278216691	263045762	/nfs/dbraw/zinc/04/57/62/263045762.db2.gz	HPAJAJUBMAXRIF-MRXNPFEDSA-N	0	0	284.403	4.070	20	30		CIEDRN
C[C@H](OC(=O)CC(C)(C)C#N)c1ccc(C(F)(F)F)cc1	ZINC000278285860	263046561	/nfs/dbraw/zinc/04/65/61/263046561.db2.gz	CBGWZVOSUNLBAN-JTQLQIEISA-N	0	0	299.292	4.249	20	30		CIEDRN
Cc1ccc([C@@H]2[C@H](C)CCCN2C(=O)CC(C)(C)C#N)cc1	ZINC000278346311	263047061	/nfs/dbraw/zinc/04/70/61/263047061.db2.gz	MNWMVXQXDRETKZ-QAPCUYQASA-N	0	0	298.430	4.235	20	30		CIEDRN
Cc1ccc([C@H]2[C@@H](C)CCCN2C(=O)CC(C)(C)C#N)cc1	ZINC000278346307	263047094	/nfs/dbraw/zinc/04/70/94/263047094.db2.gz	MNWMVXQXDRETKZ-MAUKXSAKSA-N	0	0	298.430	4.235	20	30		CIEDRN
CSc1ccc(C)c(N[C@@H]2CCC[C@@H](C#N)C2)c1	ZINC000278369480	263047594	/nfs/dbraw/zinc/04/75/94/263047594.db2.gz	CDMTVTWLHKSRJB-CHWSQXEVSA-N	0	0	260.406	4.211	20	30		CIEDRN
CC(C)(C#N)CC(=O)Nc1cc(C(F)F)ccc1Cl	ZINC000278814056	263051120	/nfs/dbraw/zinc/05/11/20/263051120.db2.gz	SJPSHQFHUNXVJF-UHFFFAOYSA-N	0	0	286.709	4.156	20	30		CIEDRN
CSc1ccc(CSC[C@@H](C#N)CCC#N)cc1	ZINC000280228851	263059886	/nfs/dbraw/zinc/05/98/86/263059886.db2.gz	HCKFJVBNWDXWJI-CYBMUJFWSA-N	0	0	276.430	4.085	20	30		CIEDRN
CC(C)CC1(C(=O)Nc2ccc(C#N)cc2Cl)CCC1	ZINC000430367118	263061709	/nfs/dbraw/zinc/06/17/09/263061709.db2.gz	LEMVDELIGQJSFW-UHFFFAOYSA-N	0	0	290.794	4.367	20	30		CIEDRN
CC(C)(C)[C@@H]1CCCN1C(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000280500259	263062424	/nfs/dbraw/zinc/06/24/24/263062424.db2.gz	KXRIDYRKOSYVBH-INIZCTEOSA-N	0	0	298.430	4.138	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)c2ccoc2C2CC2)cc1	ZINC000281239863	263067602	/nfs/dbraw/zinc/06/76/02/263067602.db2.gz	POOZCURKJYHFNB-UHFFFAOYSA-N	0	0	294.354	4.210	20	30		CIEDRN
C[C@@H]1CCN(CCCC2(C#N)CCOCC2)c2ccccc21	ZINC000282140622	263074779	/nfs/dbraw/zinc/07/47/79/263074779.db2.gz	ZKQRQMWPJZELEL-MRXNPFEDSA-N	0	0	298.430	4.101	20	30		CIEDRN
N#CC1(c2nc([C@@H]3C[C@H]3c3ccccc3)no2)CCCCC1	ZINC000282572620	263077412	/nfs/dbraw/zinc/07/74/12/263077412.db2.gz	YYMLDBMJWVPKTN-LSDHHAIUSA-N	0	0	293.370	4.066	20	30		CIEDRN
C[C@H](C1CCCCC1)N(C)C(=O)Nc1ccc(CC#N)cc1	ZINC000282608215	263077728	/nfs/dbraw/zinc/07/77/28/263077728.db2.gz	ZRMIVEJERWCROF-CQSZACIVSA-N	0	0	299.418	4.185	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)Nc1ccc(OC(C)C)c(Cl)c1	ZINC000284986690	263088835	/nfs/dbraw/zinc/08/88/35/263088835.db2.gz	CCZVQMOLKSINPE-OAHLLOKOSA-N	0	0	294.782	4.006	20	30		CIEDRN
Cc1ncsc1CCSCCCC(C)(C)C#N	ZINC000285199305	263091274	/nfs/dbraw/zinc/09/12/74/263091274.db2.gz	WBEYGGJYMWYDND-UHFFFAOYSA-N	0	0	268.451	4.057	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)Nc1cccc(-c2cccs2)c1	ZINC000285286093	263091857	/nfs/dbraw/zinc/09/18/57/263091857.db2.gz	AWTOUWFCQOKIJR-INIZCTEOSA-N	0	0	284.384	4.293	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)Nc1ccc(SC(C)(C)C)cc1	ZINC000285823268	263095809	/nfs/dbraw/zinc/09/58/09/263095809.db2.gz	ZYPZVPBAQVUEDQ-MRXNPFEDSA-N	0	0	290.432	4.456	20	30		CIEDRN
CCCCCCCC(=O)NC(C)(C)c1c(C)noc1C	ZINC000286357380	263098224	/nfs/dbraw/zinc/09/82/24/263098224.db2.gz	BUGVSYQAERMXME-UHFFFAOYSA-N	0	0	280.412	4.003	20	30		CIEDRN
CC(C)(C#N)CCNc1cccc(C(C)(F)F)c1	ZINC000288777434	263105918	/nfs/dbraw/zinc/10/59/18/263105918.db2.gz	VVUWGLMELRCMBE-UHFFFAOYSA-N	0	0	252.308	4.150	20	30		CIEDRN
CC(C)(C)c1ccc(-c2noc(CC(C)(C)C#N)n2)cc1	ZINC000288992620	263106967	/nfs/dbraw/zinc/10/69/67/263106967.db2.gz	CTPFWDIQMCIWJK-UHFFFAOYSA-N	0	0	283.375	4.126	20	30		CIEDRN
CC(C)(C#N)CCSCC(=O)c1c[nH]c2ccccc21	ZINC000289361941	263109456	/nfs/dbraw/zinc/10/94/56/263109456.db2.gz	IKIPDPDYZYYIAV-UHFFFAOYSA-N	0	0	286.400	4.024	20	30		CIEDRN
Cc1c(CSCCC(C)(C)C#N)cccc1[N+](=O)[O-]	ZINC000289454152	263110354	/nfs/dbraw/zinc/11/03/54/263110354.db2.gz	UFSJWNWKFWDEAP-UHFFFAOYSA-N	0	0	278.377	4.076	20	30		CIEDRN
Cc1nn(C(C)C)cc1/C=C1\C(=O)c2ccccc2[C@H]1C	ZINC000290002303	263113930	/nfs/dbraw/zinc/11/39/30/263113930.db2.gz	VFZNOWLNWOUTMF-AXIYWZQUSA-N	0	0	280.371	4.156	20	30		CIEDRN
Cc1ncsc1CNc1ccccc1SCCC#N	ZINC000290496200	263117341	/nfs/dbraw/zinc/11/73/41/263117341.db2.gz	KASSRKGISUMXQF-UHFFFAOYSA-N	0	0	289.429	4.069	20	30		CIEDRN
CCCC[C@H](C)N(C)C(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000290955551	263119352	/nfs/dbraw/zinc/11/93/52/263119352.db2.gz	NAOPSFRRLSSSSN-AWEZNQCLSA-N	0	0	286.419	4.138	20	30		CIEDRN
Cc1ccccc1[C@H](c1noc(CCCC#N)n1)C(C)C	ZINC000291038824	263119581	/nfs/dbraw/zinc/11/95/81/263119581.db2.gz	GCRQUWAKJHPXKG-MRXNPFEDSA-N	0	0	283.375	4.012	20	30		CIEDRN
Cc1ccc([C@@H](c2noc(CCCC#N)n2)C(C)C)cc1	ZINC000291077874	263119853	/nfs/dbraw/zinc/11/98/53/263119853.db2.gz	MWBBGNLTWKYCFU-INIZCTEOSA-N	0	0	283.375	4.012	20	30		CIEDRN
N#CCCCC(=O)Nc1ccccc1SC1CCCC1	ZINC000291265835	263121073	/nfs/dbraw/zinc/12/10/73/263121073.db2.gz	PBPFZVOGQZNMNW-UHFFFAOYSA-N	0	0	288.416	4.354	20	30		CIEDRN
C[C@@H](c1ccccc1Cl)N(C(=O)CCCC#N)C1CC1	ZINC000291800605	263125696	/nfs/dbraw/zinc/12/56/96/263125696.db2.gz	NCJYMOSQFVGHQF-LBPRGKRZSA-N	0	0	290.794	4.086	20	30		CIEDRN
Cc1c2ccccc2oc1[C@@H](NC(=O)CCCC#N)C(C)C	ZINC000291851557	263126057	/nfs/dbraw/zinc/12/60/57/263126057.db2.gz	CJPSABHUJHODOV-KRWDZBQOSA-N	0	0	298.386	4.248	20	30		CIEDRN
N#CCCCC(=O)N[C@@H](CC1CCCC1)c1ccccc1	ZINC000291876534	263126219	/nfs/dbraw/zinc/12/62/19/263126219.db2.gz	IPEIHYMRWGHBKR-KRWDZBQOSA-N	0	0	284.403	4.118	20	30		CIEDRN
CCCCCCCC(=O)N1CC(C)(C)[C@H]1c1ccncc1	ZINC000294120484	263156314	/nfs/dbraw/zinc/15/63/14/263156314.db2.gz	ZEEOIZZWLJKHME-QGZVFWFLSA-N	0	0	288.435	4.352	20	30		CIEDRN
Cc1ccc(NC(=O)[C@@]2(C#N)CC23CCCC3)c(Cl)c1	ZINC000294315412	263159573	/nfs/dbraw/zinc/15/95/73/263159573.db2.gz	YYKRVFJAOCZYBN-INIZCTEOSA-N	0	0	288.778	4.061	20	30		CIEDRN
N#C[C@@H]1CC[C@@H](Sc2nc3cc(Cl)ccc3o2)C1	ZINC000295023405	263171215	/nfs/dbraw/zinc/17/12/15/263171215.db2.gz	USCXBYSLPGDGON-PSASIEDQSA-N	0	0	278.764	4.266	20	30		CIEDRN
Cc1cccc2cc(C(=O)N[C@H]3CC[C@@H](CC#N)C3)sc21	ZINC000295495808	263178740	/nfs/dbraw/zinc/17/87/40/263178740.db2.gz	FSHXOUVVJRBRJU-JSGCOSHPSA-N	0	0	298.411	4.022	20	30		CIEDRN
CC[C@@](C)(C#N)c1nc(Cc2cc3ccccc3s2)no1	ZINC000296421098	263191418	/nfs/dbraw/zinc/19/14/18/263191418.db2.gz	LLXQZSDGPLWQBS-INIZCTEOSA-N	0	0	297.383	4.066	20	30		CIEDRN
Cc1cccc(C(C)C)c1NC(=O)N[C@H]1CC[C@@H](CC#N)C1	ZINC000297531760	263206034	/nfs/dbraw/zinc/20/60/34/263206034.db2.gz	SYWQAGWRRXKGEJ-GJZGRUSLSA-N	0	0	299.418	4.322	20	30		CIEDRN
CCCCCCCC(=O)N1CCC[C@@H]1c1cccn1C	ZINC000298203517	263216045	/nfs/dbraw/zinc/21/60/45/263216045.db2.gz	ZIAKNUINEURFPO-MRXNPFEDSA-N	0	0	276.424	4.049	20	30		CIEDRN
CCC[C@H](C)N(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000298479670	263220368	/nfs/dbraw/zinc/22/03/68/263220368.db2.gz	FNSKWIACKFVTCL-ZDUSSCGKSA-N	0	0	287.407	4.140	20	30		CIEDRN
C[C@H](CCC#N)[NH2+][C@H](C)c1ccc(-c2cccnc2)cc1	ZINC000299007772	263228898	/nfs/dbraw/zinc/22/88/98/263228898.db2.gz	QPIWMXNIRXYIHY-HUUCEWRRSA-N	0	0	279.387	4.091	20	30		CIEDRN
CC[C@H](C)Sc1ccc(NC(=O)C(C)(C)C#N)c(C)c1	ZINC000299466015	263243003	/nfs/dbraw/zinc/24/30/03/263243003.db2.gz	FHSMCVRGXRLQFX-LBPRGKRZSA-N	0	0	290.432	4.374	20	30		CIEDRN
N#CCCCCSCc1cc(F)ccc1Cl	ZINC000187548743	263262161	/nfs/dbraw/zinc/26/21/61/263262161.db2.gz	LEXOWPNDZRMLHS-UHFFFAOYSA-N	0	0	257.761	4.406	20	30		CIEDRN
CC(F)(F)c1cccc(NCc2cc(C#N)ccc2F)c1	ZINC000187589305	263263254	/nfs/dbraw/zinc/26/32/54/263263254.db2.gz	KJSMANBFCMDRHT-UHFFFAOYSA-N	0	0	290.288	4.421	20	30		CIEDRN
C#CCCCCC(=O)N(C)[C@@H](C)c1ccccc1Cl	ZINC000119566904	263275196	/nfs/dbraw/zinc/27/51/96/263275196.db2.gz	FXLOVZRNGVKOBS-ZDUSSCGKSA-N	0	0	277.795	4.053	20	30		CIEDRN
C#Cc1cccc(NC(=O)N([C@H](C)c2ccco2)C2CC2)c1	ZINC000119996402	263280921	/nfs/dbraw/zinc/28/09/21/263280921.db2.gz	KRZSVJUVPPJIFZ-CYBMUJFWSA-N	0	0	294.354	4.018	20	30		CIEDRN
C#CCCCCC(=O)Nc1cc(-c2nc(C)co2)ccc1C	ZINC000120004161	263281054	/nfs/dbraw/zinc/28/10/54/263281054.db2.gz	PKKHNXXISKREAC-UHFFFAOYSA-N	0	0	296.370	4.091	20	30		CIEDRN
C#CCCCCC(=O)N(C)[C@H](c1ccccc1)C(C)C	ZINC000120141941	263281223	/nfs/dbraw/zinc/28/12/23/263281223.db2.gz	HEEIZIKDULBGAH-SFHVURJKSA-N	0	0	271.404	4.036	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@@H]1c1cccs1	ZINC000121311056	263291589	/nfs/dbraw/zinc/29/15/89/263291589.db2.gz	HMJVKMAXADXXMU-CQSZACIVSA-N	0	0	275.417	4.180	20	30		CIEDRN
C=CCOc1ccc(C(=O)Nc2ccsc2Cl)cc1	ZINC000187897394	263294245	/nfs/dbraw/zinc/29/42/45/263294245.db2.gz	HLOGZTNOIVOHOP-UHFFFAOYSA-N	0	0	293.775	4.219	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@H]1c1ccccc1	ZINC000121699673	263297857	/nfs/dbraw/zinc/29/78/57/263297857.db2.gz	KDKKURDWIMAUJJ-KRWDZBQOSA-N	0	0	269.388	4.119	20	30		CIEDRN
CC(C)(C#N)CCSCc1cc2ccccc2[nH]c1=O	ZINC000341905252	263364654	/nfs/dbraw/zinc/36/46/54/263364654.db2.gz	VUUSAHBRQWWFRJ-UHFFFAOYSA-N	0	0	286.400	4.113	20	30		CIEDRN
C=CCCS[C@@H](C)c1nccn1-c1ccccc1	ZINC000341924710	263366381	/nfs/dbraw/zinc/36/63/81/263366381.db2.gz	LQTYKSDSGXFOIV-ZDUSSCGKSA-N	0	0	258.390	4.243	20	30		CIEDRN
Cc1cc(C#N)cc(N[C@H]2CC[C@@H](c3ccccc3F)C2)n1	ZINC000343034637	263573159	/nfs/dbraw/zinc/57/31/59/263573159.db2.gz	ORYZMQBQGXFHGX-CABCVRRESA-N	0	0	295.361	4.149	20	30		CIEDRN
CC(=O)c1ccc(Cl)cc1OCCCC(C)(C)C#N	ZINC000416914006	263763546	/nfs/dbraw/zinc/76/35/46/263763546.db2.gz	FIERMGFVKLHABY-UHFFFAOYSA-N	0	0	279.767	4.251	20	30		CIEDRN
CC(C)(C)[C@H]1CCC[C@@H]1NC(=O)Nc1cccc(CC#N)c1	ZINC000417214927	263788925	/nfs/dbraw/zinc/78/89/25/263788925.db2.gz	VZNJIIKRHHKNKE-HOTGVXAUSA-N	0	0	299.418	4.089	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1ccc(Cl)c(SC)c1	ZINC000417281535	263793196	/nfs/dbraw/zinc/79/31/96/263793196.db2.gz	RZPJMNUCTDKCTD-UHFFFAOYSA-N	0	0	284.812	4.102	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@H]1C[C@H](c2cccc(Cl)c2)C1	ZINC000424847310	263819808	/nfs/dbraw/zinc/81/98/08/263819808.db2.gz	YLYKFLYOVVKHIL-CTYIDZIISA-N	0	0	291.822	4.305	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N1CC[C@H](c2cccc(Cl)c2)C1	ZINC000424850295	263821256	/nfs/dbraw/zinc/82/12/56/263821256.db2.gz	QHYXRWLHZVOSQI-AWEZNQCLSA-N	0	0	291.822	4.258	20	30		CIEDRN
C[C@H](CC1CCCC1)C(=O)N[C@@H]1CCC(=O)NC12CCC2	ZINC000328737664	263851002	/nfs/dbraw/zinc/85/10/02/263851002.db2.gz	KIPLKVFTOHWSKB-TZMCWYRMSA-N	0	0	292.423	4.201	20	30		CIEDRN
Cc1nc(CCNC(=O)CCC2CCCCC2)c(C)o1	ZINC000328824949	263869057	/nfs/dbraw/zinc/86/90/57/263869057.db2.gz	HGGZOCYMMBWFLQ-UHFFFAOYSA-N	0	0	278.396	4.151	20	30		CIEDRN
CC(C)CC[C@@H]1CCC[C@@H]1NC(=O)[C@H]1CCCC(=O)N1	ZINC000328826361	263869712	/nfs/dbraw/zinc/86/97/12/263869712.db2.gz	STAZSIFLHYTLRB-MELADBBJSA-N	0	0	280.412	4.057	20	30		CIEDRN
CC1(C)c2ccc(C(=O)NC[C@@H]3CC=CCC3)cc2NC1=O	ZINC000328801088	263873976	/nfs/dbraw/zinc/87/39/76/263873976.db2.gz	ZBAZCLPZKVJKSV-GFCCVEGCSA-N	0	0	298.386	4.227	20	30		CIEDRN
C[C@@H]1CC[C@H](NC(=O)Nc2scnc2C2CC2)[C@H](C)C1	ZINC000328946204	263896407	/nfs/dbraw/zinc/89/64/07/263896407.db2.gz	VIQSYROPRFGJFV-FOGDFJRCSA-N	0	0	293.436	4.171	20	30		CIEDRN
CC(=O)c1c(C)[nH]c(C(=O)NC[C@H](C)C(C)C)c1C(C)C	ZINC000330386580	263924138	/nfs/dbraw/zinc/92/41/38/263924138.db2.gz	AKDXSZUKVNMLKQ-NSHDSACASA-N	0	0	292.423	4.246	20	30		CIEDRN
CCCc1nc(C)c(C(=O)N[C@](C)(C#N)CC(C)C)s1	ZINC000330478110	263946697	/nfs/dbraw/zinc/94/66/97/263946697.db2.gz	KAXKOLKHADCYOH-HNNXBMFYSA-N	0	0	293.436	4.037	20	30		CIEDRN
Cc1ccc(C(C)(C)NC(=O)c2occc2C(C)C)cn1	ZINC000330536893	263970565	/nfs/dbraw/zinc/97/05/65/263970565.db2.gz	PLJGIUVOFWWORY-UHFFFAOYSA-N	0	0	286.375	4.346	20	30		CIEDRN
CC(C)c1ccoc1C(=O)NC[C@@]1(O)CCCC(C)(C)C1	ZINC000330622269	263997503	/nfs/dbraw/zinc/99/75/03/263997503.db2.gz	NNQJEFDNJKWANU-QGZVFWFLSA-N	0	0	293.407	4.039	20	30		CIEDRN
CC1=C(C(=O)NCc2ccc(OC(C)(C)C)nc2)CCC1	ZINC000330701104	264016580	/nfs/dbraw/zinc/01/65/80/264016580.db2.gz	HFDIWWYKXCLEPS-UHFFFAOYSA-N	0	0	288.391	4.216	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1c(C)cc(C)cc1C	ZINC000125706547	264027681	/nfs/dbraw/zinc/02/76/81/264027681.db2.gz	NCIWXAYYNVQKCT-UHFFFAOYSA-N	0	0	257.377	4.319	20	30		CIEDRN
CC(C)c1ncncc1C(=O)N[C@H](C)CCC(C)(C)C	ZINC000330801270	264041919	/nfs/dbraw/zinc/04/19/19/264041919.db2.gz	GTTJGDSHKWOKMG-GFCCVEGCSA-N	0	0	277.412	4.119	20	30		CIEDRN
CC[C@H](NC(=O)N[C@@H](c1ncccc1C)C(C)C)C(C)C	ZINC000330807165	264043638	/nfs/dbraw/zinc/04/36/38/264043638.db2.gz	MSUITLACFCPDQD-LSDHHAIUSA-N	0	0	291.439	4.025	20	30		CIEDRN
CCO[C@@H](C)c1ncc(C(=O)NCC2CCCCC2)s1	ZINC000330906630	264074509	/nfs/dbraw/zinc/07/45/09/264074509.db2.gz	DQQUREANLGOARB-NSHDSACASA-N	0	0	296.436	4.126	20	30		CIEDRN
CC(C)(C)c1cc(C(=O)NC(C)(C)c2ccccc2)no1	ZINC000330891493	264076637	/nfs/dbraw/zinc/07/66/37/264076637.db2.gz	XCSKIVFBEZYGOM-UHFFFAOYSA-N	0	0	286.375	4.212	20	30		CIEDRN
CC[C@H](NC(=O)N[C@@H]1CCCC[C@H]1CC)c1ccncc1	ZINC000330939068	264082979	/nfs/dbraw/zinc/08/29/79/264082979.db2.gz	WHGXGIBEJLVLLL-VNQPRFMTSA-N	0	0	289.423	4.005	20	30		CIEDRN
CC[C@H](C)[C@H](C)NC(=O)c1ccc(Cl)c(N)c1Cl	ZINC000330948651	264085417	/nfs/dbraw/zinc/08/54/17/264085417.db2.gz	IXHFNYVNLBLMAX-YUMQZZPRSA-N	0	0	289.206	4.315	20	30		CIEDRN
CC[C@H](C)[C@@H](C)NC(=O)c1ccc(Cl)c(N)c1Cl	ZINC000330948638	264085718	/nfs/dbraw/zinc/08/57/18/264085718.db2.gz	IXHFNYVNLBLMAX-JGVFFNPUSA-N	0	0	289.206	4.315	20	30		CIEDRN
CCCC(C)(C)NC(=O)c1ccc(Cl)c(N)c1Cl	ZINC000330953577	264086696	/nfs/dbraw/zinc/08/66/96/264086696.db2.gz	LRZQAULHQYOVIR-UHFFFAOYSA-N	0	0	289.206	4.459	20	30		CIEDRN
C[C@@H]1CCC[C@H](NC(=O)C[C@@H](CC#N)c2ccccc2)[C@@H]1C	ZINC000331029569	264100339	/nfs/dbraw/zinc/10/03/39/264100339.db2.gz	RVAGOAPOLPHCGN-AHCXZYCDSA-N	0	0	298.430	4.015	20	30		CIEDRN
CCC1(CC)CCC(NC(=O)c2c[nH]c(=O)cc2C)CC1	ZINC000331043954	264107867	/nfs/dbraw/zinc/10/78/67/264107867.db2.gz	FLRASHGCYYPHFJ-UHFFFAOYSA-N	0	0	290.407	4.149	20	30		CIEDRN
CC[C@@H]1CCC[C@@H]1NC(=O)c1oc(CC(C)C)nc1C	ZINC000331057988	264109247	/nfs/dbraw/zinc/10/92/47/264109247.db2.gz	MDXOVWYUQYBZSG-OLZOCXBDSA-N	0	0	278.396	4.065	20	30		CIEDRN
CC[C@H](C)n1ncc(NC(=O)N[C@@H]2CCC[C@@H](C)C2)c1C	ZINC000331113760	264128102	/nfs/dbraw/zinc/12/81/02/264128102.db2.gz	JKVFGYXIFHJJFT-MBNYWOFBSA-N	0	0	292.427	4.067	20	30		CIEDRN
CC[C@H](C)n1ncc(NC(=O)N[C@H]2CC[C@H](C)CC2)c1C	ZINC000331120792	264130352	/nfs/dbraw/zinc/13/03/52/264130352.db2.gz	LZLPVWYRRLFJGJ-OBJOEFQTSA-N	0	0	292.427	4.067	20	30		CIEDRN
CC[C@@H](C)n1ncc(NC(=O)NCC(C)(C)C(C)C)c1C	ZINC000331122903	264130921	/nfs/dbraw/zinc/13/09/21/264130921.db2.gz	MSKAYGOZLZGKJZ-GFCCVEGCSA-N	0	0	294.443	4.171	20	30		CIEDRN
CC[C@@H](C)n1ncc(NC(=O)NC2(C)CCCCC2)c1C	ZINC000331149478	264138443	/nfs/dbraw/zinc/13/84/43/264138443.db2.gz	TYFOXXYHAFTTGM-GFCCVEGCSA-N	0	0	292.427	4.020	20	30		CIEDRN
Cc1nc(C(=O)N[C@H](C)c2ccc(C(C)C)cc2)c(C)o1	ZINC000331162483	264143164	/nfs/dbraw/zinc/14/31/64/264143164.db2.gz	GKRGVMIBXSROIH-LLVKDONJSA-N	0	0	286.375	4.481	20	30		CIEDRN
Cc1ccc(C(=O)N[C@](C)(C#N)CC(C)C)c(Cl)c1	ZINC000331181052	264155160	/nfs/dbraw/zinc/15/51/60/264155160.db2.gz	HTNVYEWFOHLSNP-HNNXBMFYSA-N	0	0	278.783	4.281	20	30		CIEDRN
Cc1cc(C)nc(NC(=O)c2cnc(C(C)(C)C)s2)c1	ZINC000331235335	264174684	/nfs/dbraw/zinc/17/46/84/264174684.db2.gz	KZMNALXLWWSCRT-UHFFFAOYSA-N	0	0	289.404	4.089	20	30		CIEDRN
Cc1oc(C#N)cc1C(=O)NCC[C@H](C)CC(C)(C)C	ZINC000331241838	264177190	/nfs/dbraw/zinc/17/71/90/264177190.db2.gz	OYVHVCQTVNKRPQ-NSHDSACASA-N	0	0	276.380	4.227	20	30		CIEDRN
CCOCc1ccc(NC(=O)N[C@@H]2CCCC[C@@H]2C)cc1	ZINC000331243370	264178117	/nfs/dbraw/zinc/17/81/17/264178117.db2.gz	KVPVEKCQLQLMLS-XJKSGUPXSA-N	0	0	290.407	4.128	20	30		CIEDRN
CC[C@H](C)[C@H](C)NC(=O)Nc1cc2[nH]ccc2cc1C	ZINC000331296709	264197737	/nfs/dbraw/zinc/19/77/37/264197737.db2.gz	OATWJSWCEJNGKG-JQWIXIFHSA-N	0	0	273.380	4.237	20	30		CIEDRN
Cc1ccc(C2CC2)c(C(=O)Nc2cccc(CC#N)c2)c1	ZINC000424863753	264238567	/nfs/dbraw/zinc/23/85/67/264238567.db2.gz	JMHIYOXQMBVRBR-UHFFFAOYSA-N	0	0	290.366	4.191	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1ccc2nc(C)ccc2c1	ZINC000343260793	264243326	/nfs/dbraw/zinc/24/33/26/264243326.db2.gz	QXWZEJUFKKDION-CYBMUJFWSA-N	0	0	282.387	4.018	20	30		CIEDRN
C=CCCC(=O)N1CCCC[C@H]1c1ccc(C)cc1	ZINC000126995708	264244569	/nfs/dbraw/zinc/24/45/69/264244569.db2.gz	RRFAPOKWMFSYFS-INIZCTEOSA-N	0	0	257.377	4.015	20	30		CIEDRN
C=CCCC(=O)N1CCCC[C@@H]1c1ccc(C)cc1	ZINC000126995946	264244584	/nfs/dbraw/zinc/24/45/84/264244584.db2.gz	RRFAPOKWMFSYFS-MRXNPFEDSA-N	0	0	257.377	4.015	20	30		CIEDRN
CC1(NC(=O)N[C@H](CCC#N)c2ccccc2)CCCCC1	ZINC000160525787	264250253	/nfs/dbraw/zinc/25/02/53/264250253.db2.gz	QOPXZRYFPUBWGV-MRXNPFEDSA-N	0	0	299.418	4.053	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cccc2ccc(O)cc21	ZINC000188955627	264259444	/nfs/dbraw/zinc/25/94/44/264259444.db2.gz	RJPPWXMLSHLBHS-QGZVFWFLSA-N	0	0	269.344	4.086	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1cc(OCC)ccc1OCC	ZINC000425397591	264276994	/nfs/dbraw/zinc/27/69/94/264276994.db2.gz	ASNYQICDYGUYBW-UHFFFAOYSA-N	0	0	291.391	4.025	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1ccsc1Cl	ZINC000189431680	264297777	/nfs/dbraw/zinc/29/77/77/264297777.db2.gz	WDRGZWYGDIIJLX-SECBINFHSA-N	0	0	272.801	4.268	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CCC[C@H]1C1CCC1)c1ccccc1	ZINC000128695072	264299381	/nfs/dbraw/zinc/29/93/81/264299381.db2.gz	LJBKIIRJEYAYGH-YJBOKZPZSA-N	0	0	283.415	4.137	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccc(C)c(-c2ncco2)c1	ZINC000161906694	264301894	/nfs/dbraw/zinc/30/18/94/264301894.db2.gz	QUACEUYHDNJRNK-UHFFFAOYSA-N	0	0	299.374	4.080	20	30		CIEDRN
C=C(C)COc1cccc(NCc2cnc(C)s2)c1	ZINC000129271220	264319251	/nfs/dbraw/zinc/31/92/51/264319251.db2.gz	HVSXEKZLNDGDGD-UHFFFAOYSA-N	0	0	274.389	4.019	20	30		CIEDRN
C[C@H](Oc1ccc2c(c1)CCCC2=O)c1cccc(C#N)c1	ZINC000189841372	264334536	/nfs/dbraw/zinc/33/45/36/264334536.db2.gz	YIQSNFCFDVFOTO-ZDUSSCGKSA-N	0	0	291.350	4.217	20	30		CIEDRN
C[C@H](Sc1cccc(C#N)c1)c1cccc(C#N)c1	ZINC000189855311	264335759	/nfs/dbraw/zinc/33/57/59/264335759.db2.gz	QCKIQWAGRJNJQL-LBPRGKRZSA-N	0	0	264.353	4.283	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1cccc(SCC)c1	ZINC000077493151	264356160	/nfs/dbraw/zinc/35/61/60/264356160.db2.gz	DMRTZEOMFGAOBN-UHFFFAOYSA-N	0	0	278.421	4.229	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc2[nH]c(C)cc2c1	ZINC000190340531	264357825	/nfs/dbraw/zinc/35/78/25/264357825.db2.gz	GQDRGRUYKIQQIF-MRXNPFEDSA-N	0	0	256.349	4.017	20	30		CIEDRN
C=C[C@@H](CC(=O)N(C)[C@H](C)c1ccco1)c1ccccc1	ZINC000131362103	264369892	/nfs/dbraw/zinc/36/98/92/264369892.db2.gz	ZARBSVULEUCTPU-CABCVRRESA-N	0	0	283.371	4.159	20	30		CIEDRN
C=CCC[C@H](NCc1nc(CCCC)no1)c1ccccc1	ZINC000180034605	264389913	/nfs/dbraw/zinc/38/99/13/264389913.db2.gz	AJPJIUILXIGTJH-INIZCTEOSA-N	0	0	299.418	4.209	20	30		CIEDRN
C=CCC[C@H](NCc1nc(CC(C)C)no1)c1ccccc1	ZINC000180043218	264394482	/nfs/dbraw/zinc/39/44/82/264394482.db2.gz	LSYSSZCLBLXTMK-INIZCTEOSA-N	0	0	299.418	4.065	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(-c2cnc(C)o2)cc1	ZINC000190047706	264394938	/nfs/dbraw/zinc/39/49/38/264394938.db2.gz	VJAIQDVJIWGHFF-KRWDZBQOSA-N	0	0	284.359	4.191	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)c1cccn1C1CCCC1	ZINC000181143114	264439788	/nfs/dbraw/zinc/43/97/88/264439788.db2.gz	AJBXJUJGNIBYLH-UHFFFAOYSA-N	0	0	293.370	4.036	20	30		CIEDRN
C=CCC[C@@H](C(=O)Nc1ccn(C(C)C)n1)c1ccccc1	ZINC000280364281	264446151	/nfs/dbraw/zinc/44/61/51/264446151.db2.gz	DBCWUNJFBJPKJU-MRXNPFEDSA-N	0	0	297.402	4.153	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1C[C@H](c2ccccc2)C[C@@H]1C	ZINC000133850812	264471902	/nfs/dbraw/zinc/47/19/02/264471902.db2.gz	IDRDYYZTFITIKG-MAUKXSAKSA-N	0	0	283.415	4.159	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(Cc1cccs1)C(C)C	ZINC000281213497	264477130	/nfs/dbraw/zinc/47/71/30/264477130.db2.gz	CPLRQTDMTGBYMI-CYBMUJFWSA-N	0	0	280.437	4.023	20	30		CIEDRN
CC(C)(C)C[C@@H]1CCCN1C(=O)Nc1ccc(CC#N)cc1	ZINC000061748173	264550743	/nfs/dbraw/zinc/55/07/43/264550743.db2.gz	PINRLQSFLNXFBV-INIZCTEOSA-N	0	0	299.418	4.185	20	30		CIEDRN
C=CCCCC(=O)N1C[C@H](c2ccccc2)[C@@H]2CCC[C@H]21	ZINC000286232491	264571180	/nfs/dbraw/zinc/57/11/80/264571180.db2.gz	UEJQYGOFOIIRAS-RCCFBDPRSA-N	0	0	283.415	4.137	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC(C)(C)[C@@H]1c1cccs1	ZINC000288221845	264674152	/nfs/dbraw/zinc/67/41/52/264674152.db2.gz	DYWGKIVKGOTSAJ-HNNXBMFYSA-N	0	0	289.444	4.426	20	30		CIEDRN
C=CCNc1nc(-c2cccc(Cl)c2)c(C)s1	ZINC000022459444	264781614	/nfs/dbraw/zinc/78/16/14/264781614.db2.gz	HTSBLLXHTPKENO-UHFFFAOYSA-N	0	0	264.781	4.370	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC2(CCC2)[C@@H]1c1ccccc1	ZINC000293853807	264982724	/nfs/dbraw/zinc/98/27/24/264982724.db2.gz	GAZMVGDOJWIYHT-RDJZCZTQSA-N	0	0	283.415	4.343	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H]1c1cccc(F)c1	ZINC000185236537	265010875	/nfs/dbraw/zinc/01/08/75/265010875.db2.gz	KLCUUOZAQSPYJJ-CZUORRHYSA-N	0	0	275.367	4.092	20	30		CIEDRN
C=CC(C)(C)C(=O)Nc1cccc(-c2nc(C)c(C)o2)c1	ZINC000294368375	265013972	/nfs/dbraw/zinc/01/39/72/265013972.db2.gz	HJLHQHVIRCVTHX-UHFFFAOYSA-N	0	0	284.359	4.109	20	30		CIEDRN
Cc1cc(C)cc(CSc2nc(C)ccc2C#N)c1	ZINC000094718349	265250034	/nfs/dbraw/zinc/25/00/34/265250034.db2.gz	DFEQXIXUPFIRCA-UHFFFAOYSA-N	0	0	268.385	4.171	20	30		CIEDRN
Cc1cscc1CNc1cc(Cl)ccc1C#N	ZINC000094878114	265268630	/nfs/dbraw/zinc/26/86/30/265268630.db2.gz	VYCXTIAUBHTNJT-UHFFFAOYSA-N	0	0	262.765	4.194	20	30		CIEDRN
C=CCC[C@H](Nc1cccc(CCCO)c1)c1ccco1	ZINC000519124966	265325125	/nfs/dbraw/zinc/32/51/25/265325125.db2.gz	PJCUMERSVZRFJG-KRWDZBQOSA-N	0	0	285.387	4.324	20	30		CIEDRN
C=CCNC(=O)Nc1cc(Cl)ccc1SC(C)C	ZINC000519198937	265363012	/nfs/dbraw/zinc/36/30/12/265363012.db2.gz	DMAOOQBCZKNDLD-UHFFFAOYSA-N	0	0	284.812	4.148	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1c(F)cccc1Cl	ZINC000514600184	266013399	/nfs/dbraw/zinc/01/33/99/266013399.db2.gz	MTHXIBZXZKAWGI-SNVBAGLBSA-N	0	0	284.762	4.345	20	30		CIEDRN
C[C@@H](Nc1ncccc1C#N)c1cc2cccc(F)c2o1	ZINC000353056295	266026346	/nfs/dbraw/zinc/02/63/46/266026346.db2.gz	QIQIBEXCMARGGC-SNVBAGLBSA-N	0	0	281.290	4.012	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1coc(CC)n1	ZINC000356165931	266061193	/nfs/dbraw/zinc/06/11/93/266061193.db2.gz	IRZNBDJDQMENLT-UHFFFAOYSA-N	0	0	298.386	4.341	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCSC1	ZINC000356221438	266075353	/nfs/dbraw/zinc/07/53/53/266075353.db2.gz	QWKAHXNUGYEDRO-AWEZNQCLSA-N	0	0	289.444	4.230	20	30		CIEDRN
CC[C@@]1(C)CCCN(C(=O)C[C@@H](CC#N)c2ccccc2)C1	ZINC000356248057	266080481	/nfs/dbraw/zinc/08/04/81/266080481.db2.gz	NUSOAZUJYXMUQE-MJGOQNOKSA-N	0	0	298.430	4.113	20	30		CIEDRN
C[C@H]1CC[C@@H](C(=O)Nc2ncc3c(n2)CCC(C)(C)C3)C1	ZINC000330168842	533686958	/nfs/dbraw/zinc/68/69/58/533686958.db2.gz	BCUVEWCFDNZCSH-NWDGAFQWSA-N	0	0	287.407	4.016	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)c1coc2cc(F)ccc12	ZINC000356513459	266128568	/nfs/dbraw/zinc/12/85/68/266128568.db2.gz	YZILQWRAYYJQIA-UHFFFAOYSA-N	0	0	294.285	4.004	20	30		CIEDRN
C[C@@H]1CC[C@H](NC(=O)C[C@H](CC#N)c2ccccc2)C[C@@H]1C	ZINC000356817079	266179784	/nfs/dbraw/zinc/17/97/84/266179784.db2.gz	RCPXRAPGYPYTPP-FZCLSBEQSA-N	0	0	298.430	4.015	20	30		CIEDRN
CCc1cccnc1[C@@H](C)N[C@H](CCC#N)c1ccccc1	ZINC000356873561	266199861	/nfs/dbraw/zinc/19/98/61/266199861.db2.gz	PPEAODYFNUTFMK-CRAIPNDOSA-N	0	0	293.414	4.340	20	30		CIEDRN
CCc1cccnc1[C@@H](C)N[C@@H](CCC#N)c1ccccc1	ZINC000356873564	266200268	/nfs/dbraw/zinc/20/02/68/266200268.db2.gz	PPEAODYFNUTFMK-QAPCUYQASA-N	0	0	293.414	4.340	20	30		CIEDRN
Cc1noc(-c2ccc(Sc3ccccc3C#N)cc2)n1	ZINC000356959372	266218729	/nfs/dbraw/zinc/21/87/29/266218729.db2.gz	JOSYNCBYWGIGHZ-UHFFFAOYSA-N	0	0	293.351	4.068	20	30		CIEDRN
N#Cc1ccccc1SCc1ccc(-n2cccn2)cc1	ZINC000357471259	266303783	/nfs/dbraw/zinc/30/37/83/266303783.db2.gz	OCMKIRABUIXWQX-UHFFFAOYSA-N	0	0	291.379	4.036	20	30		CIEDRN
Cc1ccnc(NCc2ccc3sccc3c2)c1C#N	ZINC000357589778	266332318	/nfs/dbraw/zinc/33/23/18/266332318.db2.gz	CPIVUQQZUVXTTN-UHFFFAOYSA-N	0	0	279.368	4.089	20	30		CIEDRN
N#Cc1cccc(C#N)c1N[C@@H]1CCc2sc(Cl)cc21	ZINC000357601914	266334002	/nfs/dbraw/zinc/33/40/02/266334002.db2.gz	LQCBSPIQPVQPBX-GFCCVEGCSA-N	0	0	299.786	4.244	20	30		CIEDRN
Cc1nsc(N[C@@H]2CCc3sc(Cl)cc32)c1C#N	ZINC000357607778	266334890	/nfs/dbraw/zinc/33/48/90/266334890.db2.gz	QIXMXYRKIZNXTB-SECBINFHSA-N	0	0	295.820	4.138	20	30		CIEDRN
CC[C@@H](C)n1ncc(N[C@@H](C)c2cccc(C#N)c2)c1C	ZINC000357842119	266375514	/nfs/dbraw/zinc/37/55/14/266375514.db2.gz	AMAINEFIEVJHBC-OLZOCXBDSA-N	0	0	282.391	4.207	20	30		CIEDRN
CC[C@@H](C)n1ncc(N[C@H](C)c2cccc(C#N)c2)c1C	ZINC000357842118	266375956	/nfs/dbraw/zinc/37/59/56/266375956.db2.gz	AMAINEFIEVJHBC-CHWSQXEVSA-N	0	0	282.391	4.207	20	30		CIEDRN
Cc1ccc(-c2nc(CSCCCC#N)co2)cc1	ZINC000359058455	266528753	/nfs/dbraw/zinc/52/87/53/266528753.db2.gz	UEDXACWDGVZRRZ-UHFFFAOYSA-N	0	0	272.373	4.187	20	30		CIEDRN
N#Cc1ccc(NCC2(C(F)F)CC2)cc1C(F)(F)F	ZINC000359833662	266644001	/nfs/dbraw/zinc/64/40/01/266644001.db2.gz	RMDGQTABILJSEF-UHFFFAOYSA-N	0	0	290.235	4.034	20	30		CIEDRN
C=CCCCCCN(C)c1ncnc2cc(F)c(F)cc21	ZINC000361042445	266772594	/nfs/dbraw/zinc/77/25/94/266772594.db2.gz	BDDWTNSUEWAHTL-UHFFFAOYSA-N	0	0	291.345	4.091	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N(C)[C@@H](C)C(C)C	ZINC000362537449	267004392	/nfs/dbraw/zinc/00/43/92/267004392.db2.gz	JMXVIWOUQBJHAR-ZDUSSCGKSA-N	0	0	277.433	4.081	20	30		CIEDRN
C[C@H]1CC(C)(C)N(C(=O)CC(C)(C)C#N)c2ccccc21	ZINC000362737498	267040458	/nfs/dbraw/zinc/04/04/58/267040458.db2.gz	QDFZXORYBZXTCD-ZDUSSCGKSA-N	0	0	284.403	4.245	20	30		CIEDRN
C=CCSc1ccccc1C(=O)Nc1ccc(C)nc1C	ZINC000362816642	267050081	/nfs/dbraw/zinc/05/00/81/267050081.db2.gz	DBVUUDRQYMSYRT-UHFFFAOYSA-N	0	0	298.411	4.229	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N1CCC[C@H](C)[C@@H]1C	ZINC000362816762	267050512	/nfs/dbraw/zinc/05/05/12/267050512.db2.gz	FDOHAXXAXSSIHW-KBPBESRZSA-N	0	0	289.444	4.225	20	30		CIEDRN
CC(C)c1nc(CNc2ccc(C#N)cc2Cl)cs1	ZINC000362869951	267055614	/nfs/dbraw/zinc/05/56/14/267055614.db2.gz	XDKHVSHTMYYORY-UHFFFAOYSA-N	0	0	291.807	4.404	20	30		CIEDRN
CCCCCCCCC(=O)N1CCC([C@@H]2CCOC2)CC1	ZINC000368245055	267155800	/nfs/dbraw/zinc/15/58/00/267155800.db2.gz	PFAHLXKHXSTTFJ-QGZVFWFLSA-N	0	0	295.467	4.012	20	30		CIEDRN
CCCCCCCCC(=O)N1CCC([C@H]2CCOC2)CC1	ZINC000368245054	267155821	/nfs/dbraw/zinc/15/58/21/267155821.db2.gz	PFAHLXKHXSTTFJ-KRWDZBQOSA-N	0	0	295.467	4.012	20	30		CIEDRN
C=CC[C@H](C)NC(=O)c1sc2ccc(F)cc2c1C	ZINC000116849582	267183686	/nfs/dbraw/zinc/18/36/86/267183686.db2.gz	SFCHKYNJXGEKBK-VIFPVBQESA-N	0	0	277.364	4.043	20	30		CIEDRN
Cc1nc(S[C@@H](C)c2ccc(C#N)cc2)oc1C	ZINC000118174928	267240832	/nfs/dbraw/zinc/24/08/32/267240832.db2.gz	BSTBSCLGTNWULF-NSHDSACASA-N	0	0	258.346	4.016	20	30		CIEDRN
CCCCCCCC(=O)N1CCC[C@H](C[C@@H]2CCOC2)C1	ZINC000369841464	267270934	/nfs/dbraw/zinc/27/09/34/267270934.db2.gz	QMFMCCRKVJDSPB-SJORKVTESA-N	0	0	295.467	4.012	20	30		CIEDRN
CCCCCCCC(=O)N1CCC[C@H](C[C@H]2CCOC2)C1	ZINC000369841462	267271727	/nfs/dbraw/zinc/27/17/27/267271727.db2.gz	QMFMCCRKVJDSPB-IAGOWNOFSA-N	0	0	295.467	4.012	20	30		CIEDRN
CC(C)(C#N)c1ccc(C(=O)N2CCCC23CCCC3)cc1	ZINC000370598874	267331644	/nfs/dbraw/zinc/33/16/44/267331644.db2.gz	UPAIZAREQSTDFP-UHFFFAOYSA-N	0	0	296.414	4.037	20	30		CIEDRN
C=CCC[C@@H](CC)Nc1ccc(F)cc1-c1nnc(C)o1	ZINC000376134672	267942771	/nfs/dbraw/zinc/94/27/71/267942771.db2.gz	RHBZKESZVWKXAK-CYBMUJFWSA-N	0	0	289.354	4.341	20	30		CIEDRN
CCCCCCCCCCC(=O)N1CC([C@H]2CCOC2)C1	ZINC000377013483	268040004	/nfs/dbraw/zinc/04/00/04/268040004.db2.gz	OLPNDYSAXVULDW-INIZCTEOSA-N	0	0	295.467	4.012	20	30		CIEDRN
C=C(C)CCc1noc(/C(F)=C/C2CCCCC2)n1	ZINC000575237175	335086853	/nfs/dbraw/zinc/08/68/53/335086853.db2.gz	DAKWTHAFISDNQL-RAXLEYEMSA-N	0	0	264.344	4.469	20	30		CIEDRN
C[C@H](CC(=O)NCC(C)(C)CCC#N)C1CCCCC1	ZINC000570876227	327629862	/nfs/dbraw/zinc/62/98/62/327629862.db2.gz	UBGRZZTUVNIAPY-CQSZACIVSA-N	0	0	278.440	4.039	20	30		CIEDRN
COc1cccc(F)c1[C@@H](C)N[C@H](C)c1ccc(C#N)cc1	ZINC000174222646	327639769	/nfs/dbraw/zinc/63/97/69/327639769.db2.gz	OAKOLMGUWNKJJF-CHWSQXEVSA-N	0	0	298.361	4.118	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1cccc(OCC)c1)c1ccccc1	ZINC000533904909	327650461	/nfs/dbraw/zinc/65/04/61/327650461.db2.gz	PYDUFSFBRMIPEC-OAHLLOKOSA-N	0	0	295.382	4.384	20	30		CIEDRN
CC1(C)CCC[C@H](c2noc(-c3cccc(CC#N)c3)n2)C1	ZINC000533908411	327661195	/nfs/dbraw/zinc/66/11/95/327661195.db2.gz	FFUXFYDUJIAGAD-HNNXBMFYSA-N	0	0	295.386	4.486	20	30		CIEDRN
CCN(C(=O)N[C@@H](CCC#N)c1ccccc1)C1CCCC1	ZINC000160543926	327664255	/nfs/dbraw/zinc/66/42/55/327664255.db2.gz	SQFLHVKHCLORMG-KRWDZBQOSA-N	0	0	299.418	4.006	20	30		CIEDRN
CCCCc1ccc(NC(=O)Cc2cccc(C#N)c2)cc1	ZINC000531147651	327670642	/nfs/dbraw/zinc/67/06/42/327670642.db2.gz	QYCHJMYRGAZFAS-UHFFFAOYSA-N	0	0	292.382	4.082	20	30		CIEDRN
C[C@H](SCCCCC#N)c1nc(-c2ccccc2)no1	ZINC000161956742	327688099	/nfs/dbraw/zinc/68/80/99/327688099.db2.gz	SCGLEGHSXOWVBU-LBPRGKRZSA-N	0	0	287.388	4.225	20	30		CIEDRN
CC(C)CC1(C)CCN(C(=O)c2cccc(CC#N)c2)CC1	ZINC000580139972	327707419	/nfs/dbraw/zinc/70/74/19/327707419.db2.gz	WISKSZFIYFUXEF-UHFFFAOYSA-N	0	0	298.430	4.041	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N(CCC)Cc1ccccc1	ZINC000538285419	327813887	/nfs/dbraw/zinc/81/38/87/327813887.db2.gz	DGSUPZDKRQSIAE-INIZCTEOSA-N	0	0	288.435	4.353	20	30		CIEDRN
CCCCN(C(=O)c1ccc(C2(C#N)CC2)cc1)[C@H](C)CC	ZINC000182868348	327815949	/nfs/dbraw/zinc/81/59/49/327815949.db2.gz	ZJXSCMCJNIBWQK-OAHLLOKOSA-N	0	0	298.430	4.283	20	30		CIEDRN
CCCCCCCCC(=O)NC[C@H](C)c1nccs1	ZINC000183539042	327820487	/nfs/dbraw/zinc/82/04/87/327820487.db2.gz	KAOOZBMWIGYQAJ-ZDUSSCGKSA-N	0	0	282.453	4.113	20	30		CIEDRN
C=CCC(F)(F)c1nc(Cc2ccc(C(C)C)cc2)no1	ZINC000582053227	327822319	/nfs/dbraw/zinc/82/23/19/327822319.db2.gz	RQEHNHPJAUICFP-UHFFFAOYSA-N	0	0	292.329	4.452	20	30		CIEDRN
Cc1ccc(NC(=O)C(C)C)cc1N[C@@H]1CCC[C@@H](C#N)C1	ZINC000185722436	327843070	/nfs/dbraw/zinc/84/30/70/327843070.db2.gz	LCQCPHUPYHLICJ-HUUCEWRRSA-N	0	0	299.418	4.084	20	30		CIEDRN
N#C[C@@H]1CCC[C@H](Nc2ccccc2OCC(F)(F)F)C1	ZINC000185736798	327843561	/nfs/dbraw/zinc/84/35/61/327843561.db2.gz	MQXLHZOCTWQGPN-NEPJUHHUSA-N	0	0	298.308	4.122	20	30		CIEDRN
Cc1nc(-c2cccc(N[C@H]3CCC[C@H](C#N)C3)c2)oc1C	ZINC000185741108	327843898	/nfs/dbraw/zinc/84/38/98/327843898.db2.gz	VUDWEJYJDKXCKB-HOCLYGCPSA-N	0	0	295.386	4.453	20	30		CIEDRN
N#C[C@H]1CCC[C@H](Nc2cccc(SC(F)F)c2)C1	ZINC000185745746	327843911	/nfs/dbraw/zinc/84/39/11/327843911.db2.gz	OCWXPSCZOWJHRW-QWRGUYRKSA-N	0	0	282.359	4.496	20	30		CIEDRN
N#C[C@H]1CCC[C@H](Nc2cccc(C(F)F)c2)C1	ZINC000185745199	327843918	/nfs/dbraw/zinc/84/39/18/327843918.db2.gz	QDJUVIQDBGBESP-JQWIXIFHSA-N	0	0	250.292	4.118	20	30		CIEDRN
N#C[C@H]1CCC[C@@H](Nc2ccc3nc(C4CC4)oc3c2)C1	ZINC000185861044	327848529	/nfs/dbraw/zinc/84/85/29/327848529.db2.gz	JTHPNZCALSJLAZ-WCQYABFASA-N	0	0	281.359	4.199	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H]1CCC(C)C	ZINC000185889218	327849811	/nfs/dbraw/zinc/84/98/11/327849811.db2.gz	QPLVCHWTXSGPKX-LSDHHAIUSA-N	0	0	251.414	4.016	20	30		CIEDRN
CC[C@H](C(=O)N[C@](C)(C#N)C1CCCCC1)c1ccccc1	ZINC000582096607	327850775	/nfs/dbraw/zinc/85/07/75/327850775.db2.gz	JJPGXGFXHGCKQL-PKOBYXMFSA-N	0	0	298.430	4.159	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC(c2ccc(F)cc2)CC1	ZINC000364080401	327858064	/nfs/dbraw/zinc/85/80/64/327858064.db2.gz	OFSAVOGZBCYKKI-CQSZACIVSA-N	0	0	289.394	4.134	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1ccc(/C=C/C)cc1	ZINC000497366239	327861747	/nfs/dbraw/zinc/86/17/47/327861747.db2.gz	LRNIZNPIOYJVLV-BTKRWWFXSA-N	0	0	258.365	4.196	20	30		CIEDRN
Cc1sc2ncnc(Sc3ccc(C#N)cc3)c2c1C	ZINC000497646791	327871331	/nfs/dbraw/zinc/87/13/31/327871331.db2.gz	CAZLDRCEJZFBQO-UHFFFAOYSA-N	0	0	297.408	4.331	20	30		CIEDRN
CCCCc1ccc(NC(=O)c2sccc2C#N)cc1	ZINC000497988840	327884570	/nfs/dbraw/zinc/88/45/70/327884570.db2.gz	DNGRMCMXGUEYLZ-UHFFFAOYSA-N	0	0	284.384	4.215	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1c[nH]cc1-c1ccc(C)s1	ZINC000188203292	327912412	/nfs/dbraw/zinc/91/24/12/327912412.db2.gz	DLCWQONOPRFMMK-UHFFFAOYSA-N	0	0	288.416	4.090	20	30		CIEDRN
N#Cc1ccc(NCc2csc(-c3cccs3)n2)cc1	ZINC000171257585	327934204	/nfs/dbraw/zinc/93/42/04/327934204.db2.gz	IDCRYMGYMIRUOW-UHFFFAOYSA-N	0	0	297.408	4.355	20	30		CIEDRN
Cc1ccc(CN(C)c2cc(C#N)c3ccccc3n2)cc1	ZINC000319778701	327935325	/nfs/dbraw/zinc/93/53/25/327935325.db2.gz	AEMVHJZDGFUWET-UHFFFAOYSA-N	0	0	287.366	4.051	20	30		CIEDRN
Cc1cccc(C(C)C)c1NC(=O)N(C[C@@H](C)C#N)C1CC1	ZINC000338186491	327970103	/nfs/dbraw/zinc/97/01/03/327970103.db2.gz	RLWCXKHMPYAUSF-ZDUSSCGKSA-N	0	0	299.418	4.274	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@@H]1c1ccc(Cl)cc1	ZINC000366100887	327986491	/nfs/dbraw/zinc/98/64/91/327986491.db2.gz	BBDJLWOQZILTRZ-MRXNPFEDSA-N	0	0	289.806	4.382	20	30		CIEDRN
Cc1csc(SCCCCC(C)(C)C#N)n1	ZINC000235792972	327994234	/nfs/dbraw/zinc/99/42/34/327994234.db2.gz	OWPWHSBGQHTJMT-UHFFFAOYSA-N	0	0	254.424	4.264	20	30		CIEDRN
C=C[C@H](CC(=O)NCC1(CC(C)C)CC1)c1ccccc1	ZINC000533990402	328032079	/nfs/dbraw/zinc/03/20/79/328032079.db2.gz	NEMJDXJHBVJSKP-MRXNPFEDSA-N	0	0	285.431	4.289	20	30		CIEDRN
CCC(CC)[C@@H](C)C(=O)N[C@H](C#N)c1ccc(Cl)cc1	ZINC000534168242	328037529	/nfs/dbraw/zinc/03/75/29/328037529.db2.gz	ZKLIQHJCUURNFU-IAQYHMDHSA-N	0	0	292.810	4.093	20	30		CIEDRN
Cc1cn(Cc2c(Cl)cccc2Cl)cc1C#N	ZINC000531832906	328041077	/nfs/dbraw/zinc/04/10/77/328041077.db2.gz	JNHIGLLOYDQVPC-UHFFFAOYSA-N	0	0	265.143	4.023	20	30		CIEDRN
C=CC1CCN(C(=O)c2cc(Cl)ccc2Cl)CC1	ZINC000110360733	328046565	/nfs/dbraw/zinc/04/65/65/328046565.db2.gz	CMUQHHKFXGVYLH-UHFFFAOYSA-N	0	0	284.186	4.032	20	30		CIEDRN
C=CC1CCN(C(=O)c2ccc(Cl)c(Cl)c2)CC1	ZINC000110360693	328046837	/nfs/dbraw/zinc/04/68/37/328046837.db2.gz	CJMDFMSUDPDBGC-UHFFFAOYSA-N	0	0	284.186	4.032	20	30		CIEDRN
C=CC1CCN(C(=O)CCCc2ccc(Cl)cc2)CC1	ZINC000110366830	328048944	/nfs/dbraw/zinc/04/89/44/328048944.db2.gz	WYTQNMSHUWULIW-UHFFFAOYSA-N	0	0	291.822	4.087	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)c1cc2sccc2s1	ZINC000110387601	328050007	/nfs/dbraw/zinc/05/00/07/328050007.db2.gz	GTTIJYHWCOHZCQ-UHFFFAOYSA-N	0	0	298.392	4.395	20	30		CIEDRN
Cc1c(NCc2cccc(C#N)c2)cccc1C(F)(F)F	ZINC000531858761	328051083	/nfs/dbraw/zinc/05/10/83/328051083.db2.gz	UGEBGJOPWJYETB-UHFFFAOYSA-N	0	0	290.288	4.498	20	30		CIEDRN
CCC(CC)(CCO)CNc1cccc(C(F)F)c1C#N	ZINC000563420827	328063803	/nfs/dbraw/zinc/06/38/03/328063803.db2.gz	AHMXSMZEOCRFDB-UHFFFAOYSA-N	0	0	296.361	4.097	20	30		CIEDRN
C[C@]1(CNc2cccc(C(F)F)c2C#N)CCCS1	ZINC000563426498	328066012	/nfs/dbraw/zinc/06/60/12/328066012.db2.gz	NHNDENDZIKKXAD-CQSZACIVSA-N	0	0	282.359	4.193	20	30		CIEDRN
CC[C@@](C)(C#N)c1nc([C@H](c2ccccc2C)C(C)C)no1	ZINC000563479253	328068722	/nfs/dbraw/zinc/06/87/22/328068722.db2.gz	CWRLWCCDMMTPLK-YJBOKZPZSA-N	0	0	297.402	4.357	20	30		CIEDRN
C=CCCCCSCC(=O)Nc1ccccc1C	ZINC000563622569	328077941	/nfs/dbraw/zinc/07/79/41/328077941.db2.gz	TUEGHNSXXSVWJQ-UHFFFAOYSA-N	0	0	263.406	4.023	20	30		CIEDRN
CC1(C)CCCC[C@H]1CC(=O)Nc1sccc1C#N	ZINC000154035019	328080469	/nfs/dbraw/zinc/08/04/69/328080469.db2.gz	HIHFXKZIFDIURT-LBPRGKRZSA-N	0	0	276.405	4.165	20	30		CIEDRN
Cc1csc(NC(=O)C[C@@H]2CCCC[C@@H]2C)c1C#N	ZINC000563649278	328081122	/nfs/dbraw/zinc/08/11/22/328081122.db2.gz	ILQMZAQXXGLXPR-JQWIXIFHSA-N	0	0	276.405	4.083	20	30		CIEDRN
CC(C)(CC#N)CSc1nc(-c2ccccc2)co1	ZINC000571179267	328090881	/nfs/dbraw/zinc/09/08/81/328090881.db2.gz	KBCJPOAJRIBIBI-UHFFFAOYSA-N	0	0	272.373	4.374	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(-c2cc(C)cc(F)c2)no1	ZINC000571191556	328091062	/nfs/dbraw/zinc/09/10/62/328091062.db2.gz	YTIXRBIDRURLCB-OAHLLOKOSA-N	0	0	260.312	4.038	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC(c2ccc(Cl)cc2)C1	ZINC000412393672	328109629	/nfs/dbraw/zinc/10/96/29/328109629.db2.gz	DSRLTTFPCRINOX-UHFFFAOYSA-N	0	0	289.806	4.034	20	30		CIEDRN
C=CCC[C@@H](NC(=O)c1cc(Cl)c[nH]1)c1ccccc1	ZINC000435392536	328116621	/nfs/dbraw/zinc/11/66/21/328116621.db2.gz	BFMKKJMIAOGYOK-CQSZACIVSA-N	0	0	288.778	4.105	20	30		CIEDRN
CC(C)(C#N)CCCNc1ccc(-c2ccccn2)cc1	ZINC000571370677	328117399	/nfs/dbraw/zinc/11/73/99/328117399.db2.gz	NAWOFFDDTWAUIP-UHFFFAOYSA-N	0	0	279.387	4.490	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)NCCc1ccc(C)o1	ZINC000571384728	328117548	/nfs/dbraw/zinc/11/75/48/328117548.db2.gz	RCFOWCHJBAIXNW-UHFFFAOYSA-N	0	0	298.386	4.071	20	30		CIEDRN
C=CCC(C)(C)c1noc(C(F)(F)c2ccc(C)cc2)n1	ZINC000571389392	328118480	/nfs/dbraw/zinc/11/84/80/328118480.db2.gz	KGSLXAOAKQFVQS-UHFFFAOYSA-N	0	0	292.329	4.372	20	30		CIEDRN
Cc1cccc(OCCSCCCC(C)(C)C#N)c1	ZINC000161021760	328118844	/nfs/dbraw/zinc/11/88/44/328118844.db2.gz	GOYLJKMMMHEIDH-UHFFFAOYSA-N	0	0	277.433	4.437	20	30		CIEDRN
C=CCC[C@@H](Nc1ccc([C@H]2CCOC2)cc1)C1CC1	ZINC000571543811	328132914	/nfs/dbraw/zinc/13/29/14/328132914.db2.gz	ZUORZEMLFRNSDI-FUHWJXTLSA-N	0	0	271.404	4.347	20	30		CIEDRN
C[C@H](SCCC#N)c1nc(-c2ccc(Cl)cc2)no1	ZINC000413011833	328139784	/nfs/dbraw/zinc/13/97/84/328139784.db2.gz	JWUDDOWUNMDEJW-VIFPVBQESA-N	0	0	293.779	4.098	20	30		CIEDRN
N#Cc1cnc(Nc2cccc(NC3CCCC3)c2)c(F)c1	ZINC000413149189	328141575	/nfs/dbraw/zinc/14/15/75/328141575.db2.gz	RGWCRVUEDHYSFW-UHFFFAOYSA-N	0	0	296.349	4.190	20	30		CIEDRN
CC/C=C(\C)C(=O)N[C@H](C#N)c1c(Cl)cccc1Cl	ZINC000264367141	328159081	/nfs/dbraw/zinc/15/90/81/328159081.db2.gz	UBMIMFGMGLHPMT-BIPYJSMBSA-N	0	0	297.185	4.031	20	30		CIEDRN
CC/C=C(\C)C(=O)Nc1ccccc1S[C@H](C)CC#N	ZINC000264505929	328159802	/nfs/dbraw/zinc/15/98/02/328159802.db2.gz	QDBUASCBSHRNJY-BWODNOAJSA-N	0	0	288.416	4.376	20	30		CIEDRN
CC(C)(C#N)CCSc1cccc2cccnc21	ZINC000266256218	328168705	/nfs/dbraw/zinc/16/87/05/328168705.db2.gz	RYEYATKKBGBOJV-UHFFFAOYSA-N	0	0	256.374	4.267	20	30		CIEDRN
COc1cc(NCC(C)(C)CCC#N)c(Cl)c(OC)c1	ZINC000414482326	328185706	/nfs/dbraw/zinc/18/57/06/328185706.db2.gz	GHFFJZRRAHFCED-UHFFFAOYSA-N	0	0	296.798	4.099	20	30		CIEDRN
C[C@H](CCCC(F)(F)F)Nc1ccc(F)cc1C#N	ZINC000163479366	328193871	/nfs/dbraw/zinc/19/38/71/328193871.db2.gz	OTYZBDJTOMIORX-SECBINFHSA-N	0	0	274.261	4.230	20	30		CIEDRN
CC1(C#N)CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000272506337	328200005	/nfs/dbraw/zinc/20/00/05/328200005.db2.gz	IEXRCVNIAKHQJJ-UHFFFAOYSA-N	0	0	283.202	4.119	20	30		CIEDRN
C=CCC[C@H](NC(=O)N1CC2(C1)CCCC2)c1ccccc1	ZINC000430345512	328228203	/nfs/dbraw/zinc/22/82/03/328228203.db2.gz	RRLZVHXVAOXOAZ-KRWDZBQOSA-N	0	0	298.430	4.280	20	30		CIEDRN
N#C[C@H]1CC[C@H](Sc2ncc(-c3ccc(F)cc3)o2)C1	ZINC000278696222	328229765	/nfs/dbraw/zinc/22/97/65/328229765.db2.gz	ZVSVAAKMPHJRNZ-GWCFXTLKSA-N	0	0	288.347	4.265	20	30		CIEDRN
Cc1csc([C@@H]([NH2+]CCCCC(C)(C)C#N)C2CC2)n1	ZINC000278899913	328231992	/nfs/dbraw/zinc/23/19/92/328231992.db2.gz	VEKCKTMBJOSKNU-AWEZNQCLSA-N	0	0	291.464	4.212	20	30		CIEDRN
N#CC1(CCCNc2ccc3ccccc3c2)CCOCC1	ZINC000280907855	328237109	/nfs/dbraw/zinc/23/71/09/328237109.db2.gz	CBXSWBNKKDSTIM-UHFFFAOYSA-N	0	0	294.398	4.352	20	30		CIEDRN
CCCc1occc1C(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000281653521	328240967	/nfs/dbraw/zinc/24/09/67/328240967.db2.gz	WJLIULCQQMZDDC-INIZCTEOSA-N	0	0	296.370	4.007	20	30		CIEDRN
CC(C)(C#N)CCNc1ccc(Oc2ccccn2)cc1	ZINC000288764565	328253656	/nfs/dbraw/zinc/25/36/56/328253656.db2.gz	SYTJXAPXFSKQFM-UHFFFAOYSA-N	0	0	281.359	4.226	20	30		CIEDRN
CCSc1cccc(-c2noc([C@](C)(C#N)CC)n2)c1	ZINC000292943948	328274162	/nfs/dbraw/zinc/27/41/62/328274162.db2.gz	GSYBUXYCXDIOHY-HNNXBMFYSA-N	0	0	287.388	4.040	20	30		CIEDRN
Cc1cc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)no1	ZINC000340443190	328277948	/nfs/dbraw/zinc/27/79/48/328277948.db2.gz	FMAXQLCSQWRBOD-ZBFHGGJFSA-N	0	0	283.375	4.069	20	30		CIEDRN
Cc1cc([C@H](C)N[C@H](CCCC#N)c2ccccc2)no1	ZINC000340443178	328277984	/nfs/dbraw/zinc/27/79/84/328277984.db2.gz	FMAXQLCSQWRBOD-GOEBONIOSA-N	0	0	283.375	4.069	20	30		CIEDRN
CC(C)C[C@]1(C)CCCN1C(=O)Nc1ccc(CC#N)cc1	ZINC000296200960	328289466	/nfs/dbraw/zinc/28/94/66/328289466.db2.gz	DNLQMRJPVYSREO-SFHVURJKSA-N	0	0	299.418	4.185	20	30		CIEDRN
CC(C)c1cccc(-c2ccc(C(=O)N(C)[C@@H](C)C#N)o2)c1	ZINC000297775988	328294427	/nfs/dbraw/zinc/29/44/27/328294427.db2.gz	IRRZMMHDCJWKSR-ZDUSSCGKSA-N	0	0	296.370	4.054	20	30		CIEDRN
Cc1nc(Oc2ccc(Cl)c(F)c2)c(Cl)cc1C#N	ZINC000388775115	328301445	/nfs/dbraw/zinc/30/14/45/328301445.db2.gz	PQSYLRZIVJFCSJ-UHFFFAOYSA-N	0	0	297.116	4.500	20	30		CIEDRN
CC[C@H](C#N)NC(=O)c1cc(-c2ccccc2)ccc1Cl	ZINC000110678926	328308959	/nfs/dbraw/zinc/30/89/59/328308959.db2.gz	YGUILQREUOVUNQ-CQSZACIVSA-N	0	0	298.773	4.039	20	30		CIEDRN
CC(C)C[C@](C)(C#N)NC(=O)CC[C@H](C)c1ccccc1	ZINC000534597814	328314343	/nfs/dbraw/zinc/31/43/43/328314343.db2.gz	TXMVVQZKKJELMX-MAUKXSAKSA-N	0	0	286.419	4.015	20	30		CIEDRN
Cc1ccc(CN(Cc2ccccc2C#N)C2CC2)cc1C	ZINC000302949346	328321666	/nfs/dbraw/zinc/32/16/66/328321666.db2.gz	JSLRGYSNKPKKFT-UHFFFAOYSA-N	0	0	290.410	4.340	20	30		CIEDRN
N#Cc1ccc(-c2csc(-c3ccccc3O)n2)cc1	ZINC000048785651	328322300	/nfs/dbraw/zinc/32/23/00/328322300.db2.gz	XNPYQRUENWUSIX-UHFFFAOYSA-N	0	0	278.336	4.054	20	30		CIEDRN
Cc1ccc(C)c(C(=O)Nc2ccc(Cl)c(C#N)c2)c1	ZINC000048824374	328324782	/nfs/dbraw/zinc/32/47/82/328324782.db2.gz	HPLQZAQEJJSUMU-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
Cc1ccc(C(=O)Nc2ccc(Cl)c(C#N)c2)cc1C	ZINC000048824251	328324830	/nfs/dbraw/zinc/32/48/30/328324830.db2.gz	VGLUDBKEAQGDKR-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
C=C[C@@H](Cc1nc(-c2ccsc2)no1)c1ccccc1	ZINC000534668765	328346458	/nfs/dbraw/zinc/34/64/58/328346458.db2.gz	IZDDSAYPUOCBSA-LBPRGKRZSA-N	0	0	282.368	4.310	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CCC[C@@H]1C(C)(C)C)c1ccccc1	ZINC000534671089	328347530	/nfs/dbraw/zinc/34/75/30/328347530.db2.gz	GZOWPHOPTJUEDV-DOTOQJQBSA-N	0	0	285.431	4.383	20	30		CIEDRN
C[C@@H](CCC1CCCCC1)NC(=O)c1ccc(CC#N)cc1	ZINC000534677986	328352580	/nfs/dbraw/zinc/35/25/80/328352580.db2.gz	DPMRJFVBEWWZQM-HNNXBMFYSA-N	0	0	298.430	4.231	20	30		CIEDRN
C=CC1CCN(C(=O)N[C@H](C)c2ccc(Cl)cc2)CC1	ZINC000111435577	328355279	/nfs/dbraw/zinc/35/52/79/328355279.db2.gz	BZXKXHIPEWKVOM-GFCCVEGCSA-N	0	0	292.810	4.009	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CCC[C@H](CCC)C1)c1ccccc1	ZINC000534720977	328359103	/nfs/dbraw/zinc/35/91/03/328359103.db2.gz	GTERPVIXJDXNPB-IRXDYDNUSA-N	0	0	285.431	4.385	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)[C@@H]1CCC[C@@H](C)C1	ZINC000303805373	328357104	/nfs/dbraw/zinc/35/71/04/328357104.db2.gz	AVOKPNLSOPLRBR-HUUCEWRRSA-N	0	0	289.394	4.167	20	30		CIEDRN
C=CCN(CCc1ccccc1)C(=O)[C@@H]1CCC[C@@H](C)C1	ZINC000303810424	328357443	/nfs/dbraw/zinc/35/74/43/328357443.db2.gz	BXERQXDWQIEXAI-SJLPKXTDSA-N	0	0	285.431	4.070	20	30		CIEDRN
C[C@H]1CCC[C@](C#N)(NC(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000303680860	328357532	/nfs/dbraw/zinc/35/75/32/328357532.db2.gz	RUPMHHVDJUZHEJ-LIRRHRJNSA-N	0	0	298.430	4.186	20	30		CIEDRN
CC(C)[C@H](Cc1ccccc1)C(=O)Nc1cccc(C#N)c1	ZINC000303746039	328357993	/nfs/dbraw/zinc/35/79/93/328357993.db2.gz	ALZCQGJYTTVAFD-SFHVURJKSA-N	0	0	292.382	4.012	20	30		CIEDRN
C=CCn1c2ccccc2nc1SCCOC(C)(C)C	ZINC000049517108	328367084	/nfs/dbraw/zinc/36/70/84/328367084.db2.gz	WKSAWUMZICSGSX-UHFFFAOYSA-N	0	0	290.432	4.130	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)c1sccc1C1CC1	ZINC000049520652	328368714	/nfs/dbraw/zinc/36/87/14/328368714.db2.gz	FCNRMDSBLBZGEM-UHFFFAOYSA-N	0	0	282.368	4.058	20	30		CIEDRN
N#Cc1ccc(NCc2cc(F)ccc2F)c(Cl)c1	ZINC000111615973	328370510	/nfs/dbraw/zinc/37/05/10/328370510.db2.gz	QPMRWZGFGQSARE-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
CC[C@@H](C)n1ncc(Nc2cccc(F)c2C#N)c1C1CC1	ZINC000534979677	328372990	/nfs/dbraw/zinc/37/29/90/328372990.db2.gz	ACVONHZJVIMCDT-LLVKDONJSA-N	0	0	298.365	4.486	20	30		CIEDRN
CC(C)C[C@@H](Nc1cccc(C#N)n1)c1ccccc1	ZINC000535134512	328391232	/nfs/dbraw/zinc/39/12/32/328391232.db2.gz	ONKNNQIAPLQJKG-MRXNPFEDSA-N	0	0	265.360	4.153	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cn(C)c3ccc(F)cc23)n1	ZINC000340812167	328401104	/nfs/dbraw/zinc/40/11/04/328401104.db2.gz	ZMQCPDPUNVMQNO-UHFFFAOYSA-N	0	0	299.349	4.221	20	30		CIEDRN
C=CCCC[C@@H](C)Sc1nnc(C2CC2)n1C1CC1	ZINC000341518911	328411604	/nfs/dbraw/zinc/41/16/04/328411604.db2.gz	AMUJKNNABRZUJG-LLVKDONJSA-N	0	0	277.437	4.327	20	30		CIEDRN
CC[C@@H](C)N(C(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1)[C@H](C)CC	ZINC000415406188	328427250	/nfs/dbraw/zinc/42/72/50/328427250.db2.gz	WZJCZIRAGSBTHB-KJWYOANISA-N	0	0	298.430	4.087	20	30		CIEDRN
CCC[C@@H](CC)Nc1c(C#N)cnc2ccccc21	ZINC000050405607	328438359	/nfs/dbraw/zinc/43/83/59/328438359.db2.gz	LYKWNIPGDFRXRS-CYBMUJFWSA-N	0	0	253.349	4.097	20	30		CIEDRN
CCc1ccc(CNc2cc(C#N)ccc2C)s1	ZINC000050430386	328439539	/nfs/dbraw/zinc/43/95/39/328439539.db2.gz	BCMDSTCVCWFIKL-UHFFFAOYSA-N	0	0	256.374	4.103	20	30		CIEDRN
Cc1cc(C)cc(CSc2ccc(C#N)cc2)c1	ZINC000112749827	328448601	/nfs/dbraw/zinc/44/86/01/328448601.db2.gz	DYYRXFIWEKIOOX-UHFFFAOYSA-N	0	0	253.370	4.467	20	30		CIEDRN
C=C[C@@H](CC(=O)N(C)Cc1ccc(C)cc1)c1ccccc1	ZINC000535459223	328453252	/nfs/dbraw/zinc/45/32/52/328453252.db2.gz	KRTJZZVKEQVZSG-SFHVURJKSA-N	0	0	293.410	4.313	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@H]1c1ccsc1	ZINC000123636314	328454244	/nfs/dbraw/zinc/45/42/44/328454244.db2.gz	ZSLWPMUDZITAKP-HNNXBMFYSA-N	0	0	275.417	4.180	20	30		CIEDRN
CC(C)c1ccoc1C(=O)NC(C)(C)c1nccs1	ZINC000330506041	328462521	/nfs/dbraw/zinc/46/25/21/328462521.db2.gz	GVFCCMKYBYMASQ-UHFFFAOYSA-N	0	0	278.377	4.099	20	30		CIEDRN
C=CCC[C@H](Nc1ccc(C)c(NC(C)=O)c1)C1CC1	ZINC000182964880	328515137	/nfs/dbraw/zinc/51/51/37/328515137.db2.gz	FZDVCZUSBHVMEI-INIZCTEOSA-N	0	0	272.392	4.110	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1ccc(SC)cn1)c1ccccc1	ZINC000135002701	328519335	/nfs/dbraw/zinc/51/93/35/328519335.db2.gz	KYCKZYQVLQBWLX-ZDUSSCGKSA-N	0	0	298.411	4.102	20	30		CIEDRN
C=CCC1(c2nc([C@@H](OCC)c3ccccc3)no2)CCC1	ZINC000563843104	328524018	/nfs/dbraw/zinc/52/40/18/328524018.db2.gz	SEWMKQLUCBWIOB-HNNXBMFYSA-N	0	0	298.386	4.193	20	30		CIEDRN
CC(C)[C@@H](CC1CCCCC1)C(=O)NCCCCC#N	ZINC000172072027	335093463	/nfs/dbraw/zinc/09/34/63/335093463.db2.gz	ZIRSMHQGSASJMZ-MRXNPFEDSA-N	0	0	278.440	4.039	20	30		CIEDRN
C=CCCCC(=O)N1CC2(CCC2)[C@H]1c1ccccc1	ZINC000294353818	328548843	/nfs/dbraw/zinc/54/88/43/328548843.db2.gz	XNVAAGMKJIOPQD-QGZVFWFLSA-N	0	0	269.388	4.097	20	30		CIEDRN
C=C(CC)CS[C@@H](C)C(=O)N[C@@H](C)c1ccc(F)cc1	ZINC000537993610	326822974	/nfs/dbraw/zinc/82/29/74/326822974.db2.gz	ORBDNTJQYXYXGL-STQMWFEESA-N	0	0	295.423	4.091	20	30		CIEDRN
COc1ccc(CSCc2cccc(F)c2)cc1C#N	ZINC000533468607	326837199	/nfs/dbraw/zinc/83/71/99/326837199.db2.gz	WDGOMQBKLCJJBM-UHFFFAOYSA-N	0	0	287.359	4.139	20	30		CIEDRN
N#Cc1ccc(NC2CCCCC2)cc1C(F)(F)F	ZINC000037306337	326844495	/nfs/dbraw/zinc/84/44/95/326844495.db2.gz	VTNYGUWGWXEUNT-UHFFFAOYSA-N	0	0	268.282	4.322	20	30		CIEDRN
N#CCCCOc1cccc(NC[C@H]2CC=CCC2)c1	ZINC000037777497	326861655	/nfs/dbraw/zinc/86/16/55/326861655.db2.gz	GDQHFBCDXDZGBF-HNNXBMFYSA-N	0	0	270.376	4.137	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(Br)cc1C(C)C	ZINC000089876463	326896633	/nfs/dbraw/zinc/89/66/33/326896633.db2.gz	MQQBIFMHXPRAFN-UHFFFAOYSA-N	0	0	296.208	4.477	20	30		CIEDRN
Cc1nc(Cn2ccc(C#N)c2)oc1-c1ccc(Cl)cc1	ZINC000533676840	326900341	/nfs/dbraw/zinc/90/03/41/326900341.db2.gz	XZDMMHAIVOBYJJ-UHFFFAOYSA-N	0	0	297.745	4.025	20	30		CIEDRN
C=C(C)CCSc1nc(-c2ccccc2)c(C)c(=O)[nH]1	ZINC000506378512	332771571	/nfs/dbraw/zinc/77/15/71/332771571.db2.gz	BTJYBUSWQKZCCD-UHFFFAOYSA-N	0	0	286.400	4.216	20	30		CIEDRN
CCOC1CC(CSc2cccc(Cl)c2C#N)C1	ZINC000506383398	332771610	/nfs/dbraw/zinc/77/16/10/332771610.db2.gz	UDSRJMQRUOZYRM-UHFFFAOYSA-N	0	0	281.808	4.119	20	30		CIEDRN
C=CCC(C)(C)c1noc(/C=C/c2ccc(F)cc2)n1	ZINC000556364493	326923303	/nfs/dbraw/zinc/92/33/03/326923303.db2.gz	FOFLPLVNVYQJCM-JXMROGBWSA-N	0	0	272.323	4.233	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cccc3ccc(C)nc32)n1	ZINC000556361875	326923544	/nfs/dbraw/zinc/92/35/44/326923544.db2.gz	KIGMBLUTYURCOV-UHFFFAOYSA-N	0	0	293.370	4.447	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cc(C)cc(F)c2)n1	ZINC000556362356	326923853	/nfs/dbraw/zinc/92/38/53/326923853.db2.gz	NJUXXESGDGNCLI-UHFFFAOYSA-N	0	0	260.312	4.038	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)N(c1cccc(C)c1)C(C)C)OCC	ZINC000533762084	326929448	/nfs/dbraw/zinc/92/94/48/326929448.db2.gz	ZDUAYYWCNGREPG-QGZVFWFLSA-N	0	0	289.419	4.108	20	30		CIEDRN
C=CCCCC(=O)N[C@H](c1ccc(F)c(C)c1)C1CC1	ZINC000536281787	326934752	/nfs/dbraw/zinc/93/47/52/326934752.db2.gz	SVNQOVFAJFURSW-KRWDZBQOSA-N	0	0	275.367	4.058	20	30		CIEDRN
Cc1ccc(C(=O)COc2ccc(C#N)cc2Cl)c(C)c1	ZINC000007857022	326938887	/nfs/dbraw/zinc/93/88/87/326938887.db2.gz	XTUSPIJOMKHARI-UHFFFAOYSA-N	0	0	299.757	4.090	20	30		CIEDRN
COc1cc(Cl)c(C)cc1NCCC(C)(C)C#N	ZINC000087590865	326942311	/nfs/dbraw/zinc/94/23/11/326942311.db2.gz	FTSTZSNVHXBRAM-UHFFFAOYSA-N	0	0	266.772	4.009	20	30		CIEDRN
CCc1cc(OCCC(C)(C)C#N)ccc1Cl	ZINC000087596073	326943424	/nfs/dbraw/zinc/94/34/24/326943424.db2.gz	AEPOUHOOUIFXRK-UHFFFAOYSA-N	0	0	251.757	4.221	20	30		CIEDRN
Cc1c2cc(C#N)ccc2sc1C(=O)N1[C@H](C)CC[C@H]1C	ZINC000556623771	326954659	/nfs/dbraw/zinc/95/46/59/326954659.db2.gz	QFWOJXHOIWLUHS-GHMZBOCLSA-N	0	0	298.411	4.094	20	30		CIEDRN
C=C(C)CCc1noc(-c2cc(-c3cccc(F)c3)no2)n1	ZINC000556805756	326966332	/nfs/dbraw/zinc/96/63/32/326966332.db2.gz	NMAOUODJVZGWJR-UHFFFAOYSA-N	0	0	299.305	4.039	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@@H]1CCC[C@@H]2CCCC[C@H]12	ZINC000557034832	326990118	/nfs/dbraw/zinc/99/01/18/326990118.db2.gz	VXLPYYOHCXILME-YHUYYLMFSA-N	0	0	263.425	4.064	20	30		CIEDRN
C=CCCC(=O)N1CCC(Cc2ccc(C)c(C)c2)CC1	ZINC000557295988	327000576	/nfs/dbraw/zinc/00/05/76/327000576.db2.gz	LJMXFHQXTSCWSI-UHFFFAOYSA-N	0	0	285.431	4.051	20	30		CIEDRN
CCC1(CNC(=O)c2sc3ccc(C#N)cc3c2C)CC1	ZINC000557361594	327003000	/nfs/dbraw/zinc/00/30/00/327003000.db2.gz	JHOCWLYHEZPJEF-UHFFFAOYSA-N	0	0	298.411	4.001	20	30		CIEDRN
C=CCCCC(=O)N(Cc1ccccc1Cl)CC1CC1	ZINC000557469324	327007224	/nfs/dbraw/zinc/00/72/24/327007224.db2.gz	OBUYCOFAFCIDKP-UHFFFAOYSA-N	0	0	291.822	4.435	20	30		CIEDRN
N#Cc1ccc(SCC2CCCCC2)cc1[N+](=O)[O-]	ZINC000557547809	327012645	/nfs/dbraw/zinc/01/26/45/327012645.db2.gz	UVTYVPMZRAEYAC-UHFFFAOYSA-N	0	0	276.361	4.139	20	30		CIEDRN
CCCN(c1nc(C)cc(C#N)n1)[C@@H](CC)c1ccccc1	ZINC000557556855	327013040	/nfs/dbraw/zinc/01/30/40/327013040.db2.gz	RKEYZRFURVLWHJ-KRWDZBQOSA-N	0	0	294.402	4.024	20	30		CIEDRN
Cc1cccc([C@@H]2CCCCN2c2ccnc(C#N)c2)c1C	ZINC000557578506	327014255	/nfs/dbraw/zinc/01/42/55/327014255.db2.gz	JICKUSGAMHGBNF-IBGZPJMESA-N	0	0	291.398	4.302	20	30		CIEDRN
C=CCOc1ccc(CNc2ncc(Cl)cc2F)cc1	ZINC000557697675	327021426	/nfs/dbraw/zinc/02/14/26/327021426.db2.gz	JEWZFCRDTCAOHA-UHFFFAOYSA-N	0	0	292.741	4.051	20	30		CIEDRN
COc1ccc(CNc2ccc(C)cc2Cl)cc1C#N	ZINC000087822820	327022622	/nfs/dbraw/zinc/02/26/22/327022622.db2.gz	FDEHWABHMDJALV-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
COc1ccc(CNc2cccc(C(C)C)c2)cc1C#N	ZINC000087822581	327022635	/nfs/dbraw/zinc/02/26/35/327022635.db2.gz	GLHXYRYDGNOCCK-UHFFFAOYSA-N	0	0	280.371	4.302	20	30		CIEDRN
COc1ccc(CNc2cccc(Cl)c2C)cc1C#N	ZINC000087822284	327022720	/nfs/dbraw/zinc/02/27/20/327022720.db2.gz	LIQCONAACJMQKE-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
COc1ccc(CSCc2ccccc2)cc1C#N	ZINC000087833684	327025500	/nfs/dbraw/zinc/02/55/00/327025500.db2.gz	QSZWPBWRMRTIEQ-UHFFFAOYSA-N	0	0	269.369	4.000	20	30		CIEDRN
C[C@@H]1C[C@H](c2ccccc2)N(c2nccc(C#N)c2Cl)C1	ZINC000557763083	327025536	/nfs/dbraw/zinc/02/55/36/327025536.db2.gz	PMUNUCWQPBNLKP-IUODEOHRSA-N	0	0	297.789	4.194	20	30		CIEDRN
CC(C)(CCC#N)CNC(=O)C[C@@H]1CCCCC1(C)C	ZINC000557984601	327038798	/nfs/dbraw/zinc/03/87/98/327038798.db2.gz	VEEGTQWMGGKGCB-AWEZNQCLSA-N	0	0	278.440	4.039	20	30		CIEDRN
CCC[C@@H](C(=O)NCC(C)(C)CCC#N)c1ccccc1	ZINC000557984629	327038931	/nfs/dbraw/zinc/03/89/31/327038931.db2.gz	VYSGAUGNRSHTIV-MRXNPFEDSA-N	0	0	286.419	4.016	20	30		CIEDRN
CC(C)(CCNC(=O)C[C@@H](CC#N)c1ccccc1)C1CC1	ZINC000557987589	327039280	/nfs/dbraw/zinc/03/92/80/327039280.db2.gz	IUFHXBWODKNNGN-MRXNPFEDSA-N	0	0	298.430	4.016	20	30		CIEDRN
CC(C)=CCSc1nc(C(F)(F)F)ccc1C#N	ZINC000558015764	327041265	/nfs/dbraw/zinc/04/12/65/327041265.db2.gz	ZCQKNSFRZLVDIR-UHFFFAOYSA-N	0	0	272.295	4.030	20	30		CIEDRN
C[C@@H](Nc1ccc(F)cc1)c1ccc(C#N)c(F)c1	ZINC000558030623	327043369	/nfs/dbraw/zinc/04/33/69/327043369.db2.gz	IYHNBXJFLPHTSH-SNVBAGLBSA-N	0	0	258.271	4.010	20	30		CIEDRN
Cc1cccc2c1ccnc2N1CCC(CCC#N)CC1	ZINC000584169832	327056048	/nfs/dbraw/zinc/05/60/48/327056048.db2.gz	OXLNKCIZWANETO-UHFFFAOYSA-N	0	0	279.387	4.063	20	30		CIEDRN
C=CCCCN(C)C(=O)CCSc1cccc(Cl)c1	ZINC000558122984	327074363	/nfs/dbraw/zinc/07/43/63/327074363.db2.gz	PHOWOACCTHCPKH-UHFFFAOYSA-N	0	0	297.851	4.247	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(-c2ccc(OCC)c(F)c2)no1	ZINC000558385499	327089958	/nfs/dbraw/zinc/08/99/58/327089958.db2.gz	COLZHTGYYQKYIN-MRXNPFEDSA-N	0	0	290.338	4.128	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1cscc1-c1ccccc1	ZINC000558467047	327096557	/nfs/dbraw/zinc/09/65/57/327096557.db2.gz	SEMUHKKHIIIHTO-UHFFFAOYSA-N	0	0	285.412	4.453	20	30		CIEDRN
C=CCC[C@@H](C(=O)Nc1scnc1C)c1ccccc1	ZINC000558564078	327105446	/nfs/dbraw/zinc/10/54/46/327105446.db2.gz	BRYHZUZXABVLGH-CQSZACIVSA-N	0	0	286.400	4.140	20	30		CIEDRN
N#Cc1cccc(NCCOc2ccc3ccccc3c2)c1	ZINC000506921045	332782120	/nfs/dbraw/zinc/78/21/20/332782120.db2.gz	FVJVNCXSNVWZPS-UHFFFAOYSA-N	0	0	288.350	4.202	20	30		CIEDRN
C=CCCC1(C(=O)N[C@H]2CCc3sc(Cl)cc32)CC1	ZINC000558578941	327107527	/nfs/dbraw/zinc/10/75/27/327107527.db2.gz	LIWCSTFLMRPJLM-NSHDSACASA-N	0	0	295.835	4.251	20	30		CIEDRN
N#CCCCSc1ncc(C(F)(F)F)cc1Cl	ZINC000072205525	327110061	/nfs/dbraw/zinc/11/00/61/327110061.db2.gz	NKPHTIDQTLKPQS-UHFFFAOYSA-N	0	0	280.702	4.150	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)C[C@H](C)n2cccc2)CCCC1(C)C	ZINC000558694707	327115078	/nfs/dbraw/zinc/11/50/78/327115078.db2.gz	JIZPOWZEMBDNLT-HOTGVXAUSA-N	0	0	288.435	4.033	20	30		CIEDRN
C[C@@H](CC(C)(C)C)C(=O)N[C@](C)(C#N)C1CCCCC1	ZINC000558717328	327116641	/nfs/dbraw/zinc/11/66/41/327116641.db2.gz	NDGAJGZKSQFUFV-SUMWQHHRSA-N	0	0	278.440	4.037	20	30		CIEDRN
C[C@H](Nc1ccn(CCC#N)n1)c1ccc2ccccc2c1	ZINC000152783499	327117763	/nfs/dbraw/zinc/11/77/63/327117763.db2.gz	RDTDOWJAJCNJRB-AWEZNQCLSA-N	0	0	290.370	4.123	20	30		CIEDRN
C=CCCC1(C(=O)NCC2CC(c3ccccc3)C2)CC1	ZINC000558825144	327123096	/nfs/dbraw/zinc/12/30/96/327123096.db2.gz	OOVZSVVXUPWHNM-UHFFFAOYSA-N	0	0	283.415	4.043	20	30		CIEDRN
C=C[C@H](Cc1nc(-c2ccoc2C)no1)c1ccccc1	ZINC000564455622	327131758	/nfs/dbraw/zinc/13/17/58/327131758.db2.gz	AJRQKPCAFIEWCO-CYBMUJFWSA-N	0	0	280.327	4.150	20	30		CIEDRN
Cc1cccc2c1[C@H](C)C[C@H]2CC(=O)N(CCC#N)C(C)C	ZINC000559043033	327138978	/nfs/dbraw/zinc/13/89/78/327138978.db2.gz	CLOXBFMVTNQIJD-CVEARBPZSA-N	0	0	298.430	4.127	20	30		CIEDRN
N#CCc1ccccc1NC(=O)CCCC1CCCCC1	ZINC000559248458	327150056	/nfs/dbraw/zinc/15/00/56/327150056.db2.gz	CLIDXOJPSPKUDB-UHFFFAOYSA-N	0	0	284.403	4.442	20	30		CIEDRN
N#Cc1ccc(N2CCC(Cc3ccc(F)cc3)CC2)cc1	ZINC000507033891	332784721	/nfs/dbraw/zinc/78/47/21/332784721.db2.gz	HOUBNKMQJPDKKI-UHFFFAOYSA-N	0	0	294.373	4.156	20	30		CIEDRN
CC[C@H](C)C[C@H](C)NC(=O)Nc1ccc(C#N)cc1Cl	ZINC000426137384	327164297	/nfs/dbraw/zinc/16/42/97/327164297.db2.gz	GTPVXENRDBTNCN-QWRGUYRKSA-N	0	0	293.798	4.158	20	30		CIEDRN
C=CCCc1ccccc1NCC(=O)Nc1ccccc1C	ZINC000409835213	327165389	/nfs/dbraw/zinc/16/53/89/327165389.db2.gz	HWLPSBBYSMEMBY-UHFFFAOYSA-N	0	0	294.398	4.164	20	30		CIEDRN
C=CCCc1ccccc1NCc1cc(C#N)ccc1F	ZINC000409842219	327165898	/nfs/dbraw/zinc/16/58/98/327165898.db2.gz	CPYJFYRLJQVBFU-UHFFFAOYSA-N	0	0	280.346	4.428	20	30		CIEDRN
Cc1cc(C#N)cc(C)c1OCc1ccc2ncccc2c1	ZINC000316606089	327176170	/nfs/dbraw/zinc/17/61/70/327176170.db2.gz	QALBFSOZNSNPTK-UHFFFAOYSA-N	0	0	288.350	4.302	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@H](C)CCCc1ccccc1	ZINC000410128230	327179788	/nfs/dbraw/zinc/17/97/88/327179788.db2.gz	QYBFBYGZYRNSSY-WBVHZDCISA-N	0	0	273.420	4.116	20	30		CIEDRN
C=CCC1(C(=O)N[C@H]2C[C@H](c3ccccc3C)C2)CCC1	ZINC000410152510	327181098	/nfs/dbraw/zinc/18/10/98/327181098.db2.gz	XRUBYQFHJHGHKM-WKILWMFISA-N	0	0	283.415	4.104	20	30		CIEDRN
C=C(C)CCSCCCOc1cccc(C#N)c1	ZINC000507103821	332786774	/nfs/dbraw/zinc/78/67/74/332786774.db2.gz	PHXOTRRGGMCSDF-UHFFFAOYSA-N	0	0	261.390	4.027	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1cccc(C)c1	ZINC000410352894	327187530	/nfs/dbraw/zinc/18/75/30/327187530.db2.gz	JOWHMJHWKJDKRB-UHFFFAOYSA-N	0	0	265.356	4.366	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)COc1ccc(C)cc1	ZINC000410352837	327187551	/nfs/dbraw/zinc/18/75/51/327187551.db2.gz	KWHGUXYASYZNGP-UHFFFAOYSA-N	0	0	295.382	4.131	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1cccnc1C1CC1	ZINC000410344766	327187571	/nfs/dbraw/zinc/18/75/71/327187571.db2.gz	LSYADGVKNPFZQM-UHFFFAOYSA-N	0	0	292.382	4.330	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1cc(C(C)C)no1	ZINC000410353494	327187839	/nfs/dbraw/zinc/18/78/39/327187839.db2.gz	LWAAIIWKJPWULH-UHFFFAOYSA-N	0	0	284.359	4.169	20	30		CIEDRN
N#CC1(CCSC[C@H]2CCCOC2)CCCCC1	ZINC000569559837	327197535	/nfs/dbraw/zinc/19/75/35/327197535.db2.gz	PDEHVYKSKJKREK-AWEZNQCLSA-N	0	0	267.438	4.010	20	30		CIEDRN
Cc1nc(SCC(C)(C)CC#N)n(CC(C)C)c1C	ZINC000572618113	327200995	/nfs/dbraw/zinc/20/09/95/327200995.db2.gz	RSXKIYZINPMMOX-UHFFFAOYSA-N	0	0	279.453	4.188	20	30		CIEDRN
C=C(C)CCSCc1cn2cc(Cl)ccc2n1	ZINC000507117360	332788094	/nfs/dbraw/zinc/78/80/94/332788094.db2.gz	QNZGYQWLMOIWPY-UHFFFAOYSA-N	0	0	266.797	4.187	20	30		CIEDRN
C=C(C)CN(C)C(=O)Nc1cccc(-c2cccs2)c1	ZINC000181673299	327212609	/nfs/dbraw/zinc/21/26/09/327212609.db2.gz	RYSIVVKMKMWDSC-UHFFFAOYSA-N	0	0	286.400	4.455	20	30		CIEDRN
CCSCCCNc1cccc(C(F)F)c1C#N	ZINC000584302158	327230324	/nfs/dbraw/zinc/23/03/24/327230324.db2.gz	UQMJTOYNFZNJFK-UHFFFAOYSA-N	0	0	270.348	4.051	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)C[C@@H]1CCCC[C@H]1C	ZINC000531070094	327238882	/nfs/dbraw/zinc/23/88/82/327238882.db2.gz	HFEOPVQSZCRMLM-DOMZBBRYSA-N	0	0	270.376	4.022	20	30		CIEDRN
N#CCc1ccccc1NC(=O)c1ccc2sccc2c1	ZINC000569613647	327244184	/nfs/dbraw/zinc/24/41/84/327244184.db2.gz	DBFYXNBRAPYLOJ-UHFFFAOYSA-N	0	0	292.363	4.220	20	30		CIEDRN
C=CCCCCSCC(=O)Nc1ccccc1Cl	ZINC000573701692	327252714	/nfs/dbraw/zinc/25/27/14/327252714.db2.gz	AIELBACZRZGPAU-UHFFFAOYSA-N	0	0	283.824	4.368	20	30		CIEDRN
Cc1cccc(OCCSc2ccc(C#N)cc2)c1	ZINC000108040971	327252916	/nfs/dbraw/zinc/25/29/16/327252916.db2.gz	WILPDFMMLNIJNK-UHFFFAOYSA-N	0	0	269.369	4.038	20	30		CIEDRN
CC[C@H](CC(=O)N[C@@](C)(C#N)CC(C)C)c1ccccc1	ZINC000559575466	327254196	/nfs/dbraw/zinc/25/41/96/327254196.db2.gz	UYWPTPFAVUYJJN-CRAIPNDOSA-N	0	0	286.419	4.015	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cccc(Oc2ccncc2)c1	ZINC000559756244	327260069	/nfs/dbraw/zinc/26/00/69/327260069.db2.gz	TYBOQOORTSJSOU-UHFFFAOYSA-N	0	0	296.370	4.415	20	30		CIEDRN
C=C(C)CSCc1ccc(SC)c(OC)c1	ZINC000531109734	327264787	/nfs/dbraw/zinc/26/47/87/327264787.db2.gz	MRSSEWDAKRVLFT-UHFFFAOYSA-N	0	0	254.420	4.226	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1C[C@@H](c2ccccc2C)C[C@H]1C	ZINC000559926521	327271662	/nfs/dbraw/zinc/27/16/62/327271662.db2.gz	ACWOJSCYYMBRPI-CVEARBPZSA-N	0	0	285.431	4.302	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H]1C[C@@H]1c1c(F)cccc1Cl	ZINC000559963557	327274245	/nfs/dbraw/zinc/27/42/45/327274245.db2.gz	OOUBCSRNNDDFDS-GWCFXTLKSA-N	0	0	295.785	4.054	20	30		CIEDRN
C=CCC(C)(C)c1noc(/C=C\c2cccc([N+](=O)[O-])c2)n1	ZINC000560021717	327277946	/nfs/dbraw/zinc/27/79/46/327277946.db2.gz	HNJNOOBIYFEDFU-HJWRWDBZSA-N	0	0	299.330	4.002	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H]2CC[C@@H](C(F)(F)F)C2)n1	ZINC000560024002	327278251	/nfs/dbraw/zinc/27/82/51/327278251.db2.gz	RMCWRSMYPIYMAZ-VHSXEESVSA-N	0	0	288.313	4.369	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cc3cc(OC)ccc3[nH]2)n1	ZINC000560028002	327278467	/nfs/dbraw/zinc/27/84/67/327278467.db2.gz	ICWPQBUCWBCDEQ-UHFFFAOYSA-N	0	0	297.358	4.080	20	30		CIEDRN
C=CCC(C)(C)c1noc(CCc2ccc3[nH]ccc3c2)n1	ZINC000560026148	327278469	/nfs/dbraw/zinc/27/84/69/327278469.db2.gz	FQRMCCLUJXNHRY-UHFFFAOYSA-N	0	0	295.386	4.190	20	30		CIEDRN
C=CCC(C)(C)c1noc(CSCCC(C)C)n1	ZINC000560029358	327279591	/nfs/dbraw/zinc/27/95/91/327279591.db2.gz	VGHBNWKNPRGCRA-UHFFFAOYSA-N	0	0	268.426	4.203	20	30		CIEDRN
CC[C@H](CC(=O)N1CCC(CCC#N)CC1)c1ccccc1	ZINC000566276132	327282214	/nfs/dbraw/zinc/28/22/14/327282214.db2.gz	VIGWNJADBKVOOS-QGZVFWFLSA-N	0	0	298.430	4.113	20	30		CIEDRN
CC(C)CN(CCC#N)[C@H](C)c1ccccc1Cl	ZINC000560180083	327288806	/nfs/dbraw/zinc/28/88/06/327288806.db2.gz	ZFQBYXKQNOHQFH-CYBMUJFWSA-N	0	0	264.800	4.273	20	30		CIEDRN
C=C(C)CCc1noc([C@H](C)Oc2ccc3c(c2)CCC3)n1	ZINC000560456626	327309384	/nfs/dbraw/zinc/30/93/84/327309384.db2.gz	XVDLDISKGYGILW-ZDUSSCGKSA-N	0	0	298.386	4.207	20	30		CIEDRN
CC[C@H](C)CCC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1	ZINC000560549617	327323579	/nfs/dbraw/zinc/32/35/79/327323579.db2.gz	RJPBYRWKTILNNC-CGTJXYLNSA-N	0	0	298.430	4.111	20	30		CIEDRN
N#Cc1ccc(CN2CC[C@H]2c2ccc(Cl)cc2)s1	ZINC000560586705	327328236	/nfs/dbraw/zinc/32/82/36/327328236.db2.gz	CWQWPLAPFQAMCA-HNNXBMFYSA-N	0	0	288.803	4.220	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc(-c2ncco2)cc1C	ZINC000560690653	327336951	/nfs/dbraw/zinc/33/69/51/327336951.db2.gz	VGLRXTJDRGTATE-UHFFFAOYSA-N	0	0	296.370	4.357	20	30		CIEDRN
C=CCCCCCNC(=O)Nc1ccccc1C(F)F	ZINC000569618621	327337574	/nfs/dbraw/zinc/33/75/74/327337574.db2.gz	JVADVCCJKLKBOA-UHFFFAOYSA-N	0	0	282.334	4.492	20	30		CIEDRN
COc1ccc(C)cc1CSCc1cccc(C#N)c1	ZINC000560834683	327345955	/nfs/dbraw/zinc/34/59/55/327345955.db2.gz	UVYZKEFPBDYGJA-UHFFFAOYSA-N	0	0	283.396	4.309	20	30		CIEDRN
C=C(C)CCNc1ccc(C)c(NC(=O)C(C)(C)C)c1	ZINC000569619637	327354631	/nfs/dbraw/zinc/35/46/31/327354631.db2.gz	SKDUCCXGBROBMX-UHFFFAOYSA-N	0	0	274.408	4.358	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)c1sccc1SC	ZINC000121720941	327356080	/nfs/dbraw/zinc/35/60/80/327356080.db2.gz	BOUPJPALVDTQIV-UHFFFAOYSA-N	0	0	296.461	4.062	20	30		CIEDRN
Cc1ccc(C#N)c(S[C@H](C)c2ccc(F)cc2)n1	ZINC000561158557	327370324	/nfs/dbraw/zinc/37/03/24/327370324.db2.gz	GFDLPZCSQLIKFB-LLVKDONJSA-N	0	0	272.348	4.254	20	30		CIEDRN
C=CC1CCN(C(=O)c2cc3c(s2)CCCCC3)CC1	ZINC000561348313	327387911	/nfs/dbraw/zinc/38/79/11/327387911.db2.gz	NEDWABASMKWAST-UHFFFAOYSA-N	0	0	289.444	4.055	20	30		CIEDRN
N#Cc1c(F)cccc1CNc1cccc(Cl)c1F	ZINC000427527866	327391110	/nfs/dbraw/zinc/39/11/10/327391110.db2.gz	MPXFNCYIYYPGCP-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC(C)C)c1ccccc1	ZINC000561467204	327397214	/nfs/dbraw/zinc/39/72/14/327397214.db2.gz	DCXXHHOFMIOUSY-HNNXBMFYSA-N	0	0	259.393	4.278	20	30		CIEDRN
C=CCC(CC=C)C(=O)NC[C@@H](C)Sc1ccccc1	ZINC000150984888	327404912	/nfs/dbraw/zinc/40/49/12/327404912.db2.gz	KBWCSHSQVWZKLF-CQSZACIVSA-N	0	0	289.444	4.052	20	30		CIEDRN
CC(C)(C)c1ccc(C(=O)NCC(C)(C)CCC#N)s1	ZINC000561709574	327412288	/nfs/dbraw/zinc/41/22/88/327412288.db2.gz	BYQDVHMSMZEZEH-UHFFFAOYSA-N	0	0	292.448	4.105	20	30		CIEDRN
C=CC(C)(C)C(=O)N(C)Cc1cc(Cl)cc(Cl)c1	ZINC000448738641	327415115	/nfs/dbraw/zinc/41/51/15/327415115.db2.gz	PSKBINLGFBUULJ-UHFFFAOYSA-N	0	0	286.202	4.164	20	30		CIEDRN
CCCCCCCC(=O)N1CCC[C@H]1c1c(C)n[nH]c1C	ZINC000156877545	327417464	/nfs/dbraw/zinc/41/74/64/327417464.db2.gz	QISWOJXWZUUDDK-HNNXBMFYSA-N	0	0	291.439	4.051	20	30		CIEDRN
C=CCCC1(c2nc(-c3ccc(F)cc3C)no2)CC1	ZINC000561887968	327428580	/nfs/dbraw/zinc/42/85/80/327428580.db2.gz	FCKMWTXNCUHBFR-UHFFFAOYSA-N	0	0	272.323	4.182	20	30		CIEDRN
N#CCCC1CCN(C(=O)c2ccc3sccc3c2)CC1	ZINC000335384587	327469449	/nfs/dbraw/zinc/46/94/49/327469449.db2.gz	KRPNNUDTYVCDOQ-UHFFFAOYSA-N	0	0	298.411	4.057	20	30		CIEDRN
N#CC1CCN([C@H]2CCc3c2cc(Cl)cc3Cl)CC1	ZINC000151589096	327480272	/nfs/dbraw/zinc/48/02/72/327480272.db2.gz	NJKXMEQINKRAIC-HNNXBMFYSA-N	0	0	295.213	4.216	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1[C@H](C)C[C@H](c2ccccc2)[C@H]1C	ZINC000248635457	327507747	/nfs/dbraw/zinc/50/77/47/327507747.db2.gz	UEKXAQMZJYLUNL-LHHMISFZSA-N	0	0	285.431	4.382	20	30		CIEDRN
C=CCCCCNc1cc(NC(C)=O)ccc1Cl	ZINC000562772255	327513661	/nfs/dbraw/zinc/51/36/61/327513661.db2.gz	OWLTUPGZXHLJPH-UHFFFAOYSA-N	0	0	266.772	4.067	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)c1cc(C)c(CC)o1	ZINC000159611242	327546473	/nfs/dbraw/zinc/54/64/73/327546473.db2.gz	CCJHJYJCKJVYAY-UHFFFAOYSA-N	0	0	289.400	4.040	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cc(C)c(F)cc1Cl	ZINC000569850157	327551851	/nfs/dbraw/zinc/55/18/51/327551851.db2.gz	NIQUNVQOLNFBHI-CQSZACIVSA-N	0	0	269.747	4.328	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H](Cc2ccc(C)cc2)C1	ZINC000569900074	327554695	/nfs/dbraw/zinc/55/46/95/327554695.db2.gz	OPUSZPPULZYQOF-AZUAARDMSA-N	0	0	299.458	4.378	20	30		CIEDRN
Cc1nsc(Sc2cccc(Cl)c2)c1C#N	ZINC000569959491	327558177	/nfs/dbraw/zinc/55/81/77/327558177.db2.gz	VPSMCCDWEAIGSP-UHFFFAOYSA-N	0	0	266.778	4.128	20	30		CIEDRN
CC(C)N(CCC#N)C(=O)c1ccc(C2=CCCC2)cc1	ZINC000569980775	327559939	/nfs/dbraw/zinc/55/99/39/327559939.db2.gz	UDAUDBRXLHGULQ-UHFFFAOYSA-N	0	0	282.387	4.018	20	30		CIEDRN
CC(C)c1nc([C@H](C)NCc2ccc(CC#N)cc2)cs1	ZINC000570024028	327563112	/nfs/dbraw/zinc/56/31/12/327563112.db2.gz	GGJKTMPQJDFICO-ZDUSSCGKSA-N	0	0	299.443	4.183	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2ccc(OC)c(C)c2)no1	ZINC000570483532	327594497	/nfs/dbraw/zinc/59/44/97/327594497.db2.gz	VOTBKLFCNZLFFA-LBPRGKRZSA-N	0	0	272.348	4.123	20	30		CIEDRN
Cc1ccnc(N[C@@H]2CCc3sc(Cl)cc32)c1C#N	ZINC000570560667	327600224	/nfs/dbraw/zinc/60/02/24/327600224.db2.gz	GZBQAXZWHTYKOQ-LLVKDONJSA-N	0	0	289.791	4.076	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1ccccc1CC#N)c1ccccc1	ZINC000570651922	327608708	/nfs/dbraw/zinc/60/87/08/327608708.db2.gz	QXIMYWZUAWGCPG-HNNXBMFYSA-N	0	0	290.366	4.051	20	30		CIEDRN
Cc1ccccc1NC(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000113539786	328622972	/nfs/dbraw/zinc/62/29/72/328622972.db2.gz	ZDXXHPHWKFSPQL-UHFFFAOYSA-N	0	0	293.370	4.440	20	30		CIEDRN
N#Cc1cc(NC(=O)c2cc3ccccc3s2)ccc1F	ZINC000051637471	328626552	/nfs/dbraw/zinc/62/65/52/328626552.db2.gz	INCZBYZNEZMRDH-UHFFFAOYSA-N	0	0	296.326	4.164	20	30		CIEDRN
C=CC[C@H]1N(C(=O)C2CC(C)(C)C2)CCCC1(C)C	ZINC000582196949	328629272	/nfs/dbraw/zinc/62/92/72/328629272.db2.gz	CIICSRAOXODDDV-CQSZACIVSA-N	0	0	263.425	4.016	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1cc2sccc2s1	ZINC000519037383	328640791	/nfs/dbraw/zinc/64/07/91/328640791.db2.gz	KGOAWGCNEUSRLF-VIFPVBQESA-N	0	0	265.403	4.047	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)Nc1cccc(C(C)C)c1)OCC	ZINC000535906821	328647160	/nfs/dbraw/zinc/64/71/60/328647160.db2.gz	RYTLOGGCBIKUFS-MRXNPFEDSA-N	0	0	275.392	4.120	20	30		CIEDRN
C=CCCO[C@H](C)c1nc([C@H]2CCCC(C)(C)C2)no1	ZINC000535961279	328650342	/nfs/dbraw/zinc/65/03/42/328650342.db2.gz	YROWWZQCDAKYHB-OLZOCXBDSA-N	0	0	278.396	4.407	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1ccc(F)cc1)c1ccccc1	ZINC000536084997	328655572	/nfs/dbraw/zinc/65/55/72/328655572.db2.gz	LZUVYEYBRNNLFN-CYBMUJFWSA-N	0	0	269.319	4.124	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CCCc2ccccc21)c1ccccc1	ZINC000536084692	328655614	/nfs/dbraw/zinc/65/56/14/328655614.db2.gz	INMDHODBBQWWBE-INIZCTEOSA-N	0	0	291.394	4.326	20	30		CIEDRN
CC(C)C[C@@](C)(C#N)NC(=O)CC1CCC(C)(C)CC1	ZINC000536080585	328656159	/nfs/dbraw/zinc/65/61/59/328656159.db2.gz	JLQYCFJQLIDGDF-KRWDZBQOSA-N	0	0	278.440	4.037	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1ccc(SC)nc1)c1ccccc1	ZINC000536132088	328657636	/nfs/dbraw/zinc/65/76/36/328657636.db2.gz	QPBABBXAHMTTNQ-CYBMUJFWSA-N	0	0	298.411	4.102	20	30		CIEDRN
C=C[C@@H](CC(=O)N[C@H](CC)C(C)(C)C)c1ccccc1	ZINC000536189370	328661394	/nfs/dbraw/zinc/66/13/94/328661394.db2.gz	YPRFFOKYXOFQDZ-GOEBONIOSA-N	0	0	273.420	4.287	20	30		CIEDRN
CC(C)(C)CNc1ccc(C#N)c(C(F)(F)F)c1	ZINC000034396102	328661888	/nfs/dbraw/zinc/66/18/88/328661888.db2.gz	VVLDRTJYBABIAO-UHFFFAOYSA-N	0	0	256.271	4.035	20	30		CIEDRN
N#Cc1cc(Cl)ccc1NCc1cccc(Cl)c1	ZINC000053158087	328663629	/nfs/dbraw/zinc/66/36/29/328663629.db2.gz	RQHSPDWGYISAQE-UHFFFAOYSA-N	0	0	277.154	4.477	20	30		CIEDRN
C=C1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000519443846	328673671	/nfs/dbraw/zinc/67/36/71/328673671.db2.gz	HPDWAKLTJBGXNM-UHFFFAOYSA-N	0	0	256.176	4.145	20	30		CIEDRN
Cc1cc(C)cc(OCCCOc2ccccc2C#N)c1	ZINC000034652291	328684187	/nfs/dbraw/zinc/68/41/87/328684187.db2.gz	XDDCTBNXVVFTNA-UHFFFAOYSA-N	0	0	281.355	4.023	20	30		CIEDRN
N#Cc1ccc(COc2ccc(-c3ccccc3)nc2)cc1	ZINC000536731351	328685420	/nfs/dbraw/zinc/68/54/20/328685420.db2.gz	KPZYOVIPRLIWGG-UHFFFAOYSA-N	0	0	286.334	4.199	20	30		CIEDRN
N#Cc1cccc(OCCCOc2cccc(Cl)c2)c1	ZINC000034674990	328685468	/nfs/dbraw/zinc/68/54/68/328685468.db2.gz	SXPPEBKNSLTDKE-UHFFFAOYSA-N	0	0	287.746	4.060	20	30		CIEDRN
Cc1cccc(C)c1OCCCOc1ccccc1C#N	ZINC000034674933	328685578	/nfs/dbraw/zinc/68/55/78/328685578.db2.gz	ZOTLWOGRYMDZLJ-UHFFFAOYSA-N	0	0	281.355	4.023	20	30		CIEDRN
CCOc1cc(C#N)ccc1OCc1ccc(Cl)s1	ZINC000042273594	328764098	/nfs/dbraw/zinc/76/40/98/328764098.db2.gz	DRHKVQKBWVRFFU-UHFFFAOYSA-N	0	0	293.775	4.251	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)[C@H]2CC23CCCCC3)cc1	ZINC000532423022	328776627	/nfs/dbraw/zinc/77/66/27/328776627.db2.gz	WPOQTRHVTSMXTA-MRXNPFEDSA-N	0	0	296.414	4.397	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)c1cc(C)c(C)o1	ZINC000532628237	328794898	/nfs/dbraw/zinc/79/48/98/328794898.db2.gz	DOPQYRODFXPGDY-UHFFFAOYSA-N	0	0	275.392	4.105	20	30		CIEDRN
N#Cc1ccc(N2CCC[C@H]2c2cccc3ccccc32)nc1	ZINC000301117786	328826526	/nfs/dbraw/zinc/82/65/26/328826526.db2.gz	WEHMBRSQFMGXFQ-IBGZPJMESA-N	0	0	299.377	4.448	20	30		CIEDRN
N#Cc1cc(N2CCCc3ccccc3C2)c2ccccc2n1	ZINC000301397817	328827669	/nfs/dbraw/zinc/82/76/69/328827669.db2.gz	NZGAKYVZVZETDV-UHFFFAOYSA-N	0	0	299.377	4.059	20	30		CIEDRN
CCC(CC)N(C(=O)Nc1cccc(C#N)c1C)C1CC1	ZINC000532884650	328840549	/nfs/dbraw/zinc/84/05/49/328840549.db2.gz	IBHMEUQBUYQTPV-UHFFFAOYSA-N	0	0	285.391	4.052	20	30		CIEDRN
C=C(C)CCSCCCc1nc(-c2ccccc2)no1	ZINC000507819207	332826158	/nfs/dbraw/zinc/82/61/58/332826158.db2.gz	RYWUJISKVZKWPH-UHFFFAOYSA-N	0	0	288.416	4.369	20	30		CIEDRN
C=C(C)CCSCC(=O)N[C@@H](CCC)c1ccccc1	ZINC000507860605	332828139	/nfs/dbraw/zinc/82/81/39/332828139.db2.gz	NJODCMABBGCZLW-INIZCTEOSA-N	0	0	291.460	4.343	20	30		CIEDRN
C=C(C)CCS[C@@H](C)C(=O)Nc1ccc(Cl)cc1	ZINC000507860051	332828165	/nfs/dbraw/zinc/82/81/65/332828165.db2.gz	NUWKFOZDMGEQNY-NSHDSACASA-N	0	0	283.824	4.366	20	30		CIEDRN
C=C(C)CCS[C@@H](C)C(=O)Nc1ccccc1CC	ZINC000507863051	332828287	/nfs/dbraw/zinc/82/82/87/332828287.db2.gz	XFOTWEALIHQYMY-ZDUSSCGKSA-N	0	0	277.433	4.275	20	30		CIEDRN
N#CCc1ccc(NC(=O)[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)cc1	ZINC000389669899	328948979	/nfs/dbraw/zinc/94/89/79/328948979.db2.gz	WIDYYTHBEOXZDK-GVDBMIGSSA-N	0	0	296.414	4.298	20	30		CIEDRN
Cc1cc(NC(=O)c2cccc(C#N)c2)cc(C)c1Cl	ZINC000508054946	332832784	/nfs/dbraw/zinc/83/27/84/332832784.db2.gz	PVKRICUYGCVVMV-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
C=C[C@H](CC(=O)N1C[C@H]2CCCCC[C@@H]21)c1ccccc1	ZINC000372587363	328966182	/nfs/dbraw/zinc/96/61/82/328966182.db2.gz	MOCDCKHGHNISNV-NXHRZFHOSA-N	0	0	283.415	4.137	20	30		CIEDRN
C[C@@H](CCOCc1ccccc1)Nc1cccc(F)c1C#N	ZINC000390190447	328966221	/nfs/dbraw/zinc/96/62/21/328966221.db2.gz	NDYXVALNPAOSOJ-AWEZNQCLSA-N	0	0	298.361	4.105	20	30		CIEDRN
C=C[C@H](CC(=O)N1C[C@@H]2CCCCC[C@@H]21)c1ccccc1	ZINC000372587361	328966229	/nfs/dbraw/zinc/96/62/29/328966229.db2.gz	MOCDCKHGHNISNV-NJAFHUGGSA-N	0	0	283.415	4.137	20	30		CIEDRN
C=CC[C@H]1N(C(=O)CC(C)(C)C2CC2)CCCC1(C)C	ZINC000508074040	332833494	/nfs/dbraw/zinc/83/34/94/332833494.db2.gz	NKUUWBHRLOBHMX-OAHLLOKOSA-N	0	0	277.452	4.406	20	30		CIEDRN
CC1(C)CCCC[C@H]1CC(=O)N(CC#N)c1ccccc1	ZINC000508120147	332834040	/nfs/dbraw/zinc/83/40/40/332834040.db2.gz	JYZYCSDQRBWIJM-HNNXBMFYSA-N	0	0	284.403	4.150	20	30		CIEDRN
N#Cc1c(F)cccc1SC[C@@H]1CCCC1(F)F	ZINC000582371061	328973976	/nfs/dbraw/zinc/97/39/76/328973976.db2.gz	KIJCDHMMFKTAAH-VIFPVBQESA-N	0	0	271.307	4.225	20	30		CIEDRN
N#CC[C@@H]1C[C@H]2[C@@H](CCC[C@H]2Nc2ccsc2Cl)O1	ZINC000377393930	329013958	/nfs/dbraw/zinc/01/39/58/329013958.db2.gz	VDMBJJDBRHBBIF-PRULPYPASA-N	0	0	296.823	4.053	20	30		CIEDRN
C=CCCC(=O)N1Cc2ccccc2-c2ccccc2C1	ZINC000377518906	329017531	/nfs/dbraw/zinc/01/75/31/329017531.db2.gz	JPAQCGMASTWKPW-UHFFFAOYSA-N	0	0	277.367	4.162	20	30		CIEDRN
C=CCCC(=O)N(CC)Cc1cccc(-c2ccncc2)c1	ZINC000377857587	329032002	/nfs/dbraw/zinc/03/20/02/329032002.db2.gz	WJOAAYWSORSYBS-UHFFFAOYSA-N	0	0	294.398	4.063	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@H]1c1ccccc1OC	ZINC000378103547	329040001	/nfs/dbraw/zinc/04/00/01/329040001.db2.gz	NQZXUTSRDFXYLY-KRWDZBQOSA-N	0	0	299.414	4.127	20	30		CIEDRN
CCCC[C@H](CC)CC(=O)NCC1CCC(C#N)CC1	ZINC000508363099	332837597	/nfs/dbraw/zinc/83/75/97/332837597.db2.gz	QDXHZUDKCSSQCF-FHERZECASA-N	0	0	278.440	4.039	20	30		CIEDRN
C[C@H](Nc1cccc(OCCCC#N)c1)c1cccc(O)c1	ZINC000193905567	329062114	/nfs/dbraw/zinc/06/21/14/329062114.db2.gz	NBMPOYBLVBUBRS-AWEZNQCLSA-N	0	0	296.370	4.248	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N(C)Cc1csc2ccccc12	ZINC000172077732	329082774	/nfs/dbraw/zinc/08/27/74/329082774.db2.gz	URHDYJHDEYPEHG-GFCCVEGCSA-N	0	0	288.416	4.007	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Nc1ccc2cc[nH]c2c1	ZINC000194273080	329084167	/nfs/dbraw/zinc/08/41/67/329084167.db2.gz	HPNPLUALBWDWDX-UHFFFAOYSA-N	0	0	285.391	4.378	20	30		CIEDRN
N#Cc1c(F)cccc1S[C@@H](C#N)C1CCCCC1	ZINC000583704853	329086403	/nfs/dbraw/zinc/08/64/03/329086403.db2.gz	UFJAALWISUEPIC-HNNXBMFYSA-N	0	0	274.364	4.262	20	30		CIEDRN
CC(C)(C#N)N1CCC(c2c(Cl)cccc2Cl)CC1	ZINC000582629336	329119573	/nfs/dbraw/zinc/11/95/73/329119573.db2.gz	DVULDFFYEBJMBK-UHFFFAOYSA-N	0	0	297.229	4.475	20	30		CIEDRN
C=C(C)CCc1noc([C@@H]2C[C@H]2c2cccc(F)c2F)n1	ZINC000508595743	332842720	/nfs/dbraw/zinc/84/27/20/332842720.db2.gz	PLTIPXKSKJHFHS-NWDGAFQWSA-N	0	0	290.313	4.128	20	30		CIEDRN
C=C(C)CCc1noc(C[C@H](C)c2ccc(F)cc2F)n1	ZINC000508596099	332842760	/nfs/dbraw/zinc/84/27/60/332842760.db2.gz	QWRWIZMLUHZKHC-NSHDSACASA-N	0	0	292.329	4.203	20	30		CIEDRN
CCOc1cc(N[C@@H](C)c2cccc(C#N)c2)ccc1C	ZINC000582740522	329134576	/nfs/dbraw/zinc/13/45/76/329134576.db2.gz	PJWYGLNADIELNV-AWEZNQCLSA-N	0	0	280.371	4.439	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)c1cc(C)cc(F)c1	ZINC000173245440	329144035	/nfs/dbraw/zinc/14/40/35/329144035.db2.gz	BGZNHVQLPWGFDW-UHFFFAOYSA-N	0	0	289.375	4.024	20	30		CIEDRN
C=CCCC(=O)N1Cc2ccccc2C[C@H]1c1ccccc1	ZINC000174657261	329160405	/nfs/dbraw/zinc/16/04/05/329160405.db2.gz	JQBUGBSQMULJEA-IBGZPJMESA-N	0	0	291.394	4.279	20	30		CIEDRN
C=C(C)CCc1noc(Cc2cn(CC)c3ccccc23)n1	ZINC000508615996	332844327	/nfs/dbraw/zinc/84/43/27/332844327.db2.gz	ARODFNWJZYJHEO-UHFFFAOYSA-N	0	0	295.386	4.144	20	30		CIEDRN
C=CCCCC(=O)N1CCC(c2c[nH]c3ccccc32)CC1	ZINC000175173142	329165848	/nfs/dbraw/zinc/16/58/48/329165848.db2.gz	SNZNDYRLLLUFST-UHFFFAOYSA-N	0	0	296.414	4.230	20	30		CIEDRN
C=CCCCC(=O)N1C[C@H](C)C[C@H]1c1cccc(F)c1	ZINC000175964727	329170929	/nfs/dbraw/zinc/17/09/29/329170929.db2.gz	KVNCDOUMSNMQML-CJNGLKHVSA-N	0	0	275.367	4.092	20	30		CIEDRN
C=CCCCC(=O)N1C[C@@H](C)C[C@@H]1c1ccccc1F	ZINC000176008033	329173126	/nfs/dbraw/zinc/17/31/26/329173126.db2.gz	MJSIKFPYMIRFRD-XJKSGUPXSA-N	0	0	275.367	4.092	20	30		CIEDRN
C=C(C)CCc1noc(/C=C(\C)c2ccccc2)n1	ZINC000508632897	332845149	/nfs/dbraw/zinc/84/51/49/332845149.db2.gz	ASCCXQFYKWZLAW-ACCUITESSA-N	0	0	254.333	4.139	20	30		CIEDRN
C=CCc1ccccc1OCc1csc([C@@H](C)OC)n1	ZINC000177541407	329184907	/nfs/dbraw/zinc/18/49/07/329184907.db2.gz	ACARFAJNGKTMIR-GFCCVEGCSA-N	0	0	289.400	4.158	20	30		CIEDRN
C=CCCCSCc1csc([C@@H](C)OC)n1	ZINC000177851967	329186919	/nfs/dbraw/zinc/18/69/19/329186919.db2.gz	KDKXCJUBQKOFQY-SNVBAGLBSA-N	0	0	257.424	4.050	20	30		CIEDRN
C=CCCCSCc1csc([C@H](C)OC)n1	ZINC000177851957	329187116	/nfs/dbraw/zinc/18/71/16/329187116.db2.gz	KDKXCJUBQKOFQY-JTQLQIEISA-N	0	0	257.424	4.050	20	30		CIEDRN
C#CCCCCC(=O)N1CCC[C@@H]1c1ccc(Cl)cc1	ZINC000179721918	329207502	/nfs/dbraw/zinc/20/75/02/329207502.db2.gz	QAEZWDFPQNUGPY-MRXNPFEDSA-N	0	0	289.806	4.197	20	30		CIEDRN
Cc1cc(NC(=O)Cc2ccc(C#N)cc2)cc(C)c1Cl	ZINC000508666347	332846617	/nfs/dbraw/zinc/84/66/17/332846617.db2.gz	ZOBLMPNAXNUYCA-UHFFFAOYSA-N	0	0	298.773	4.010	20	30		CIEDRN
C=C(C)CCc1noc([C@H](c2ccccc2)C2CC2)n1	ZINC000508666716	332846666	/nfs/dbraw/zinc/84/66/66/332846666.db2.gz	PXRLZTWWKNBROI-MRXNPFEDSA-N	0	0	268.360	4.120	20	30		CIEDRN
C=C(C)CCc1noc(-c2ccc(F)c(SC)c2)n1	ZINC000508665508	332846675	/nfs/dbraw/zinc/84/66/75/332846675.db2.gz	MFZBHASOVQIXIU-UHFFFAOYSA-N	0	0	278.352	4.106	20	30		CIEDRN
C#CCCCCC(=O)N(C)[C@@H](C)c1ccc(Cl)cc1	ZINC000179721642	329211576	/nfs/dbraw/zinc/21/15/76/329211576.db2.gz	PZYYWYIMFYHGRT-ZDUSSCGKSA-N	0	0	277.795	4.053	20	30		CIEDRN
C[C@@H](SCc1ccc(CO)cc1)c1ccc(C#N)cc1	ZINC000180707092	329222399	/nfs/dbraw/zinc/22/23/99/329222399.db2.gz	UDYIOJLSMNLUBY-CYBMUJFWSA-N	0	0	283.396	4.045	20	30		CIEDRN
C=C(C)CCc1noc(-c2cc(-c3ccc(F)cc3)on2)n1	ZINC000508682744	332847320	/nfs/dbraw/zinc/84/73/20/332847320.db2.gz	XADJVIPUCIIAGW-UHFFFAOYSA-N	0	0	299.305	4.039	20	30		CIEDRN
N#C[C@@H]1CCC[C@H]1N[C@@H]1CCc2c1cc(Cl)cc2Cl	ZINC000459459730	329257305	/nfs/dbraw/zinc/25/73/05/329257305.db2.gz	HYRUBUNYZNGFOA-TZTCFGBESA-N	0	0	295.213	4.263	20	30		CIEDRN
Cc1oc2ccc(NC(=O)c3cc(C#N)cs3)cc2c1C	ZINC000185404041	329272418	/nfs/dbraw/zinc/27/24/18/329272418.db2.gz	KTSLJIDHFPHWCD-UHFFFAOYSA-N	0	0	296.351	4.235	20	30		CIEDRN
CC#CCCCc1nc(-c2ccccc2OCC(C)C)no1	ZINC000584376484	329306730	/nfs/dbraw/zinc/30/67/30/329306730.db2.gz	RYFCNDBPKNUAAP-UHFFFAOYSA-N	0	0	298.386	4.117	20	30		CIEDRN
CC1(C)CCC(Cn2cc(C#N)c(=O)c3ccccc32)CC1	ZINC000185691040	329329103	/nfs/dbraw/zinc/32/91/03/329329103.db2.gz	MJEOMZVXWDPENQ-UHFFFAOYSA-N	0	0	294.398	4.090	20	30		CIEDRN
C=C(C)CCN(Cc1cccs1)CC(F)(F)F	ZINC000508990138	332854114	/nfs/dbraw/zinc/85/41/14/332854114.db2.gz	DVGWLNPWUSPUTG-UHFFFAOYSA-N	0	0	263.328	4.079	20	30		CIEDRN
CCc1ccc(NC(=O)c2ccc(C#N)cc2)cc1Cl	ZINC000514675238	329356878	/nfs/dbraw/zinc/35/68/78/329356878.db2.gz	DFHNYKPTZORIHB-UHFFFAOYSA-N	0	0	284.746	4.026	20	30		CIEDRN
C=CCCSC[C@@H](OC)c1ccc(Cl)cc1	ZINC000509003900	332855083	/nfs/dbraw/zinc/85/50/83/332855083.db2.gz	ZFMPETMUXJIVRI-CYBMUJFWSA-N	0	0	256.798	4.337	20	30		CIEDRN
C=CCC1(C(=O)N(CC)Cc2ccccc2C)CCC1	ZINC000188170780	329365167	/nfs/dbraw/zinc/36/51/67/329365167.db2.gz	IMAPNVUQHMMEFG-UHFFFAOYSA-N	0	0	271.404	4.090	20	30		CIEDRN
C=CCC[C@H](C(=O)N[C@H](C)c1ccccn1)c1ccccc1	ZINC000188872744	329372886	/nfs/dbraw/zinc/37/28/86/329372886.db2.gz	CKQBMODCIDDJEO-WBVHZDCISA-N	0	0	294.398	4.009	20	30		CIEDRN
C=CCC1(C(=O)Nc2cccc3ccc(O)cc32)CCC1	ZINC000189633353	329384860	/nfs/dbraw/zinc/38/48/60/329384860.db2.gz	OOVZOISMAATNNT-UHFFFAOYSA-N	0	0	281.355	4.230	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)C1CC=CC1	ZINC000189878224	329388863	/nfs/dbraw/zinc/38/88/63/329388863.db2.gz	KYACDLHVKDCBIN-UHFFFAOYSA-N	0	0	269.388	4.443	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1cnn(CC)c1	ZINC000189894744	329388911	/nfs/dbraw/zinc/38/89/11/329388911.db2.gz	MCAYWQUQSFYDFJ-UHFFFAOYSA-N	0	0	297.402	4.007	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)CC[C@@H](C)OC	ZINC000189896396	329388970	/nfs/dbraw/zinc/38/89/70/329388970.db2.gz	IELMZDCHMUSTAW-CQSZACIVSA-N	0	0	289.419	4.292	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@@H](c1ccc(CC)cc1)C(C)C	ZINC000498128057	329392130	/nfs/dbraw/zinc/39/21/30/329392130.db2.gz	SEHBFWCXYKEUCG-QGZVFWFLSA-N	0	0	288.435	4.164	20	30		CIEDRN
C=CCC1(C(=O)N2CC=C(c3ccccc3F)CC2)CCC1	ZINC000190312631	329394758	/nfs/dbraw/zinc/39/47/58/329394758.db2.gz	IGGRRVBYEQCLOO-UHFFFAOYSA-N	0	0	299.389	4.188	20	30		CIEDRN
C=CCC1(C(=O)N2CC=C(c3ccccc3)CC2)CCC1	ZINC000190518184	329398879	/nfs/dbraw/zinc/39/88/79/329398879.db2.gz	LTYWATQYGPVQEI-UHFFFAOYSA-N	0	0	281.399	4.049	20	30		CIEDRN
N#CCCCSCc1csc(-c2ccsc2)n1	ZINC000190927307	329403254	/nfs/dbraw/zinc/40/32/54/329403254.db2.gz	VYQBRNGXXDFQDZ-UHFFFAOYSA-N	0	0	280.443	4.409	20	30		CIEDRN
C=CCC1(C(=O)Nc2cc(Cl)ccc2OC)CCC1	ZINC000191831402	329424102	/nfs/dbraw/zinc/42/41/02/329424102.db2.gz	VDUSSTMETMLSBX-UHFFFAOYSA-N	0	0	279.767	4.034	20	30		CIEDRN
CC(C)(C)c1cccc(Oc2ccncc2C#N)c1	ZINC000399440832	329445629	/nfs/dbraw/zinc/44/56/29/329445629.db2.gz	LXLFGTKKFQFQLN-UHFFFAOYSA-N	0	0	252.317	4.043	20	30		CIEDRN
Cc1c(Cl)cccc1NCc1ccc(CC#N)cc1	ZINC000398980630	329447000	/nfs/dbraw/zinc/44/70/00/329447000.db2.gz	DLHQUTYOGDTRCP-UHFFFAOYSA-N	0	0	270.763	4.327	20	30		CIEDRN
Cc1ccc(Cl)c(NCc2ccc(CC#N)cc2)c1	ZINC000399034520	329447835	/nfs/dbraw/zinc/44/78/35/329447835.db2.gz	NHIWYKLSQHREQR-UHFFFAOYSA-N	0	0	270.763	4.327	20	30		CIEDRN
Cc1ccccc1SCc1ccc(CC#N)cc1	ZINC000399127777	329448550	/nfs/dbraw/zinc/44/85/50/329448550.db2.gz	LKNPSJKUVVGFOQ-UHFFFAOYSA-N	0	0	253.370	4.353	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H]1CCCc2ccc(C)cc21	ZINC000583744381	329471722	/nfs/dbraw/zinc/47/17/22/329471722.db2.gz	FMJVOMLYZROWTC-GOSISDBHSA-N	0	0	283.415	4.257	20	30		CIEDRN
CC[C@H](C#N)NC(=O)CC1CCC(C(C)(C)CC)CC1	ZINC000509272409	332862877	/nfs/dbraw/zinc/86/28/77/332862877.db2.gz	YCQNXLUUFLCCDO-YMAMQOFZSA-N	0	0	278.440	4.037	20	30		CIEDRN
CC(C)(C)SCCNc1ccc(C#N)c(Cl)c1	ZINC000301299504	329534292	/nfs/dbraw/zinc/53/42/92/329534292.db2.gz	ZEOINTINNXVMDW-UHFFFAOYSA-N	0	0	268.813	4.155	20	30		CIEDRN
CCCCCCCC(=O)N1CCC(C2CCOCC2)CC1	ZINC000124464434	329570581	/nfs/dbraw/zinc/57/05/81/329570581.db2.gz	ITZMVCVWHMKPNU-UHFFFAOYSA-N	0	0	295.467	4.012	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(Cl)cc1COC	ZINC000425629947	329573924	/nfs/dbraw/zinc/57/39/24/329573924.db2.gz	FWLIUBYKNVRLNM-HNNXBMFYSA-N	0	0	281.783	4.027	20	30		CIEDRN
Cc1csc(-c2cccc(NCc3ccc(C#N)o3)c2)n1	ZINC000125803642	329587439	/nfs/dbraw/zinc/58/74/39/329587439.db2.gz	OGPMOGCVWAQPBJ-UHFFFAOYSA-N	0	0	295.367	4.195	20	30		CIEDRN
CCCC1(C(=O)N(C)[C@H](C)c2cccc(C#N)c2)CCC1	ZINC000425638475	329590822	/nfs/dbraw/zinc/59/08/22/329590822.db2.gz	NKZNQOMXWMKFOZ-CQSZACIVSA-N	0	0	284.403	4.048	20	30		CIEDRN
N#CC1(CCn2cnc3cc(F)c(F)cc32)CCCCC1	ZINC000418830997	329592539	/nfs/dbraw/zinc/59/25/39/329592539.db2.gz	OQXMWRSVRDEAFR-UHFFFAOYSA-N	0	0	289.329	4.179	20	30		CIEDRN
C[C@H](c1cccc(C#N)c1)N(C)C(=O)C1=CCC(C)(C)CC1	ZINC000425107240	329595034	/nfs/dbraw/zinc/59/50/34/329595034.db2.gz	JACMYMNJBSYMMJ-CQSZACIVSA-N	0	0	296.414	4.214	20	30		CIEDRN
C[C@@H](c1cccc(C#N)c1)N(C)C(=O)[C@H]1CC[C@@H](C)[C@H](C)C1	ZINC000425108180	329595221	/nfs/dbraw/zinc/59/52/21/329595221.db2.gz	KMWSKQDYMNKIDP-BSXFFOKHSA-N	0	0	298.430	4.150	20	30		CIEDRN
CC(C)C[C@@H](C)CC(=O)N(C)[C@H](C)c1cccc(C#N)c1	ZINC000425137412	329606977	/nfs/dbraw/zinc/60/69/77/329606977.db2.gz	XPVUIOZWXWYAAR-HUUCEWRRSA-N	0	0	286.419	4.150	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](c2ccccc2)C[C@@H]1C	ZINC000424824399	329621975	/nfs/dbraw/zinc/62/19/75/329621975.db2.gz	CEUVPDFIWJKIPJ-DOTOQJQBSA-N	0	0	285.431	4.383	20	30		CIEDRN
C=CCOc1ccccc1C(=O)N(CC)CC(CC)CC	ZINC000509416970	332869028	/nfs/dbraw/zinc/86/90/28/332869028.db2.gz	ONHIJKPKVFAYGD-UHFFFAOYSA-N	0	0	289.419	4.150	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)C2=CCCCC2)c1	ZINC000527107598	329696235	/nfs/dbraw/zinc/69/62/35/329696235.db2.gz	FPOMDBPAZWVQNU-UHFFFAOYSA-N	0	0	271.360	4.080	20	30		CIEDRN
Cc1ccccc1N(C(=O)c1cccc(C#N)c1C)C(C)C	ZINC000509524481	332872436	/nfs/dbraw/zinc/87/24/36/332872436.db2.gz	MDNVWHALDWOOCJ-UHFFFAOYSA-N	0	0	292.382	4.230	20	30		CIEDRN
CCc1ccc([C@H]2C[C@H](C)CCN2c2ccc(C#N)nc2)o1	ZINC000509540271	332873022	/nfs/dbraw/zinc/87/30/22/332873022.db2.gz	MLTRKNUGBQIBNV-CXAGYDPISA-N	0	0	295.386	4.086	20	30		CIEDRN
C[C@H](NCc1ccc(F)cc1C#N)c1ccc(C2CC2)cc1	ZINC000419361729	329719977	/nfs/dbraw/zinc/71/99/77/329719977.db2.gz	UFHXBNIJOAPUQX-ZDUSSCGKSA-N	0	0	294.373	4.426	20	30		CIEDRN
N#CC1(CSCc2csc(-c3ccco3)n2)CCC1	ZINC000419371665	329721268	/nfs/dbraw/zinc/72/12/68/329721268.db2.gz	JHPIKRVYINYYMG-UHFFFAOYSA-N	0	0	290.413	4.330	20	30		CIEDRN
C=CCCS[C@@H](C)c1nnc(-c2ccc(C)cc2)o1	ZINC000419411810	329724596	/nfs/dbraw/zinc/72/45/96/329724596.db2.gz	BVXMCIOYMOASIS-LBPRGKRZSA-N	0	0	274.389	4.415	20	30		CIEDRN
C=CCCS[C@H](C)c1nnc(-c2ccc(C)cc2)o1	ZINC000419411809	329724678	/nfs/dbraw/zinc/72/46/78/329724678.db2.gz	BVXMCIOYMOASIS-GFCCVEGCSA-N	0	0	274.389	4.415	20	30		CIEDRN
C=CCOCCSCc1coc(-c2ccc(C)cc2)n1	ZINC000419378708	329725908	/nfs/dbraw/zinc/72/59/08/329725908.db2.gz	DQZYJBQEJRYTHO-UHFFFAOYSA-N	0	0	289.400	4.086	20	30		CIEDRN
C[C@H](SCC1(C#N)CCC1)c1cccc(C#N)c1	ZINC000419466624	329726798	/nfs/dbraw/zinc/72/67/98/329726798.db2.gz	REZFKNOXLKCAPV-LBPRGKRZSA-N	0	0	256.374	4.046	20	30		CIEDRN
C=CCOCCCSCCC1(C#N)CCCCC1	ZINC000419468104	329726911	/nfs/dbraw/zinc/72/69/11/329726911.db2.gz	ARPBOBGAZJZWHU-UHFFFAOYSA-N	0	0	267.438	4.176	20	30		CIEDRN
CO[C@H](CSCC1(C#N)CCC1)c1ccc(Cl)cc1	ZINC000419470760	329727086	/nfs/dbraw/zinc/72/70/86/329727086.db2.gz	BAYDJLQWDXPKBD-CQSZACIVSA-N	0	0	295.835	4.455	20	30		CIEDRN
Cc1ccccc1CCCSCc1nc(C#N)cs1	ZINC000419431346	329728669	/nfs/dbraw/zinc/72/86/69/329728669.db2.gz	WHBKTHSMNQFFLK-UHFFFAOYSA-N	0	0	288.441	4.189	20	30		CIEDRN
CCc1ccccc1CSCc1nc(C#N)cs1	ZINC000419459874	329731671	/nfs/dbraw/zinc/73/16/71/329731671.db2.gz	HKYGCJRHRXQJAW-UHFFFAOYSA-N	0	0	274.414	4.011	20	30		CIEDRN
COc1cc(CSCCCCC#N)ccc1Cl	ZINC000419588922	329741855	/nfs/dbraw/zinc/74/18/55/329741855.db2.gz	RKKHOBNXERFOEC-UHFFFAOYSA-N	0	0	269.797	4.276	20	30		CIEDRN
N#CC1(CSCc2ncccc2C(F)(F)F)CCC1	ZINC000419506187	329733391	/nfs/dbraw/zinc/73/33/91/329733391.db2.gz	WLWLQDLGGDRRFV-UHFFFAOYSA-N	0	0	286.322	4.027	20	30		CIEDRN
CC(C)(C#N)CCSC1CC(OCc2ccccc2)C1	ZINC000419476779	329735766	/nfs/dbraw/zinc/73/57/66/329735766.db2.gz	OYGGUECUXYGSRX-UHFFFAOYSA-N	0	0	289.444	4.407	20	30		CIEDRN
COC(=O)c1ccc(CSCCCCC#N)cc1Cl	ZINC000419492044	329737347	/nfs/dbraw/zinc/73/73/47/329737347.db2.gz	AFFMBKZVXXSYHE-UHFFFAOYSA-N	0	0	297.807	4.054	20	30		CIEDRN
C[C@H](SCC1(C#N)CC1)c1ccc2c(c1)CCC2	ZINC000419580065	329741127	/nfs/dbraw/zinc/74/11/27/329741127.db2.gz	AOWIZDKIIZSFDO-LBPRGKRZSA-N	0	0	257.402	4.273	20	30		CIEDRN
CCn1c2ccc(C#N)cc2nc1-c1ccc(Cl)cc1	ZINC000086635539	332876291	/nfs/dbraw/zinc/87/62/91/332876291.db2.gz	POEHHDGIBCKLTA-UHFFFAOYSA-N	0	0	281.746	4.248	20	30		CIEDRN
C[C@@H](Sc1cccc([N+](=O)[O-])c1)c1ccc(C#N)cc1	ZINC000509651804	332876687	/nfs/dbraw/zinc/87/66/87/332876687.db2.gz	UXBIGSRZNMFOAC-LLVKDONJSA-N	0	0	284.340	4.320	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N[C@H](CC(F)F)c1ccccc1	ZINC000420873351	329785769	/nfs/dbraw/zinc/78/57/69/329785769.db2.gz	XJOMJDQQNILBPA-UONOGXRCSA-N	0	0	296.361	4.037	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)[C@@H]1CC[C@@H]2C[C@@H]2C1	ZINC000421528259	329842796	/nfs/dbraw/zinc/84/27/96/329842796.db2.gz	AMNPGLWNTIIOGN-KZNAEPCWSA-N	0	0	283.415	4.028	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CC[C@@H](C2CCCC2)C1)c1ccccc1	ZINC000421644923	329861441	/nfs/dbraw/zinc/86/14/41/329861441.db2.gz	GFBSRGLNYMKSCV-QFBILLFUSA-N	0	0	297.442	4.385	20	30		CIEDRN
C=CCN(CC=C)C(=O)CCc1ccc(C(C)(C)C)cc1	ZINC000302691110	332881677	/nfs/dbraw/zinc/88/16/77/332881677.db2.gz	SGKULBAPPVLSTR-UHFFFAOYSA-N	0	0	285.431	4.117	20	30		CIEDRN
CCCC(CCC)C(=O)Nc1sc(C)c(C)c1C#N	ZINC000509821916	332882728	/nfs/dbraw/zinc/88/27/28/332882728.db2.gz	RNWKLFQUBIKGGL-UHFFFAOYSA-N	0	0	278.421	4.392	20	30		CIEDRN
Cc1cccc(C)c1NC(=O)N[C@@H](C)c1ccc(C#N)cc1	ZINC000075994990	329888921	/nfs/dbraw/zinc/88/89/21/329888921.db2.gz	BGYBRPQAJMBFLN-AWEZNQCLSA-N	0	0	293.370	4.058	20	30		CIEDRN
CC(C)[C@H]1CC[C@H](C(=O)N[C@@H](C)c2ccc(C#N)cc2)CC1	ZINC000509834584	332883391	/nfs/dbraw/zinc/88/33/91/332883391.db2.gz	KFVGJUJGIQDMTE-ZVZYQTTQSA-N	0	0	298.430	4.198	20	30		CIEDRN
CC[C@@](C)(C#N)c1nc(-c2ccc(Cl)c(Cl)c2)no1	ZINC000571919503	329931414	/nfs/dbraw/zinc/93/14/14/329931414.db2.gz	RCNXYNBVIKZRQF-ZDUSSCGKSA-N	0	0	296.157	4.235	20	30		CIEDRN
C=CCN(C)C(=O)C1(c2ccc(Cl)c(Cl)c2)CCC1	ZINC000161476931	329941119	/nfs/dbraw/zinc/94/11/19/329941119.db2.gz	MIWRKWYVXNOZEL-UHFFFAOYSA-N	0	0	298.213	4.060	20	30		CIEDRN
CC(C)[C@H]1CCC[C@H](NC(=O)Nc2ccc(CC#N)cc2)C1	ZINC000510018156	332888406	/nfs/dbraw/zinc/88/84/06/332888406.db2.gz	HBFPLJMJAWIFIB-RDJZCZTQSA-N	0	0	299.418	4.089	20	30		CIEDRN
CC(C)(C)c1cnc(S[C@H](C#N)c2ccccc2)o1	ZINC000572179870	329952568	/nfs/dbraw/zinc/95/25/68/329952568.db2.gz	GUBXBWQGFWCUPK-GFCCVEGCSA-N	0	0	272.373	4.329	20	30		CIEDRN
C=CCN(C)C(=O)c1ccc(-c2ccc(C)cc2)cc1F	ZINC000161856634	329957036	/nfs/dbraw/zinc/95/70/36/329957036.db2.gz	LUVAYTMKRJEVBU-UHFFFAOYSA-N	0	0	283.346	4.059	20	30		CIEDRN
C[C@H](CCC(=O)N[C@H](C#N)C1CCCCC1)c1ccccc1	ZINC000161918883	329959619	/nfs/dbraw/zinc/95/96/19/329959619.db2.gz	ADYOINNNUHMSIJ-CRAIPNDOSA-N	0	0	298.430	4.159	20	30		CIEDRN
Cc1oc(-c2cccs2)nc1CNc1cccc(C#N)c1	ZINC000078469082	329960752	/nfs/dbraw/zinc/96/07/52/329960752.db2.gz	BTFMOEDSHJAFRN-UHFFFAOYSA-N	0	0	295.367	4.195	20	30		CIEDRN
Cc1oc(-c2cccs2)nc1CNc1ccc(C#N)cc1	ZINC000078469062	329960755	/nfs/dbraw/zinc/96/07/55/329960755.db2.gz	AKXDVFPHQHHYJP-UHFFFAOYSA-N	0	0	295.367	4.195	20	30		CIEDRN
C=CCC[C@H](C(=O)NCC1(C2CC2)CC1)c1ccccc1	ZINC000188777557	329963131	/nfs/dbraw/zinc/96/31/31/329963131.db2.gz	BNMNFAIGSKSXAK-KRWDZBQOSA-N	0	0	283.415	4.043	20	30		CIEDRN
CN(C(=O)[C@@H]1CCC[C@H]2CCCC[C@H]21)c1ccccc1C#N	ZINC000564137449	330000464	/nfs/dbraw/zinc/00/04/64/330000464.db2.gz	IBDZZUGCYHXTLE-DJIMGWMZSA-N	0	0	296.414	4.128	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1cccc2cccnc21	ZINC000265747695	330063044	/nfs/dbraw/zinc/06/30/44/330063044.db2.gz	XQIGEPLODFLPJT-UHFFFAOYSA-N	0	0	282.387	4.053	20	30		CIEDRN
C=CCCCC(=O)N[C@H](C)c1nc2ccccc2n1C(C)C	ZINC000267156150	330064738	/nfs/dbraw/zinc/06/47/38/330064738.db2.gz	JMPZQSGJBVWKMV-CQSZACIVSA-N	0	0	299.418	4.151	20	30		CIEDRN
C=CCCCC(=O)N1CCCC[C@@H]1c1ccc(F)cc1	ZINC000267790308	330065084	/nfs/dbraw/zinc/06/50/84/330065084.db2.gz	YDVMEQGUKLVKCE-MRXNPFEDSA-N	0	0	275.367	4.236	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCCCC[C@H]1c1ccncc1	ZINC000268144465	330065469	/nfs/dbraw/zinc/06/54/69/330065469.db2.gz	ISPTZJFTWZMINR-SFHVURJKSA-N	0	0	298.430	4.294	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)[C@H](C)c1cccs1	ZINC000268196835	330065560	/nfs/dbraw/zinc/06/55/60/330065560.db2.gz	XUEYGTHYYOKSOB-GFCCVEGCSA-N	0	0	263.406	4.036	20	30		CIEDRN
Cc1cc(SCC(C)(C)CC#N)n(-c2ccccc2)n1	ZINC000572424921	330067798	/nfs/dbraw/zinc/06/77/98/330067798.db2.gz	XFQWWKJUEXNIFE-UHFFFAOYSA-N	0	0	285.416	4.213	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc2c(c1)C(=O)CCCC2	ZINC000421714221	330069708	/nfs/dbraw/zinc/06/97/08/330069708.db2.gz	IXTAEQFUMJRYAO-ZDUSSCGKSA-N	0	0	285.387	4.137	20	30		CIEDRN
C=CCC[C@H]([NH2+]Cc1ccc(COC)o1)c1ccccc1	ZINC000269357219	330069912	/nfs/dbraw/zinc/06/99/12/330069912.db2.gz	NGMGBODTCACDDH-SFHVURJKSA-N	0	0	285.387	4.223	20	30		CIEDRN
C=CCC[C@H](NC(=O)CCC(F)(F)F)c1ccccc1	ZINC000269403830	330070018	/nfs/dbraw/zinc/07/00/18/330070018.db2.gz	MKKDDGNSFYYTGQ-ZDUSSCGKSA-N	0	0	285.309	4.153	20	30		CIEDRN
CC(C)N(C(=O)c1ccc(C#N)cc1)[C@H](C)c1ccsc1	ZINC000421686474	330070513	/nfs/dbraw/zinc/07/05/13/330070513.db2.gz	BIWOEFUKONWCSD-CYBMUJFWSA-N	0	0	298.411	4.232	20	30		CIEDRN
C=C(C)[C@H](CC(=O)Nc1ccccc1C(C)C)OCC	ZINC000270068659	330073216	/nfs/dbraw/zinc/07/32/16/330073216.db2.gz	WWBYAHHUXAHUCY-INIZCTEOSA-N	0	0	275.392	4.120	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1scnc1CC)c1ccccc1	ZINC000270560158	330076368	/nfs/dbraw/zinc/07/63/68/330076368.db2.gz	STSOXMYSHUYBQA-LBPRGKRZSA-N	0	0	286.400	4.004	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)Nc1cc(SC)ccc1C)OCC	ZINC000271835778	330082497	/nfs/dbraw/zinc/08/24/97/330082497.db2.gz	HQUKCGVMWGNTNX-OAHLLOKOSA-N	0	0	293.432	4.027	20	30		CIEDRN
C=CCCO[C@H](C)c1nc([C@@H]2CCCC[C@@H]2C)no1	ZINC000273799050	330097657	/nfs/dbraw/zinc/09/76/57/330097657.db2.gz	HOHWHSNZHAQLGQ-YNEHKIRRSA-N	0	0	264.369	4.017	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(Cc1cccs1)C(C)C	ZINC000274295662	330104280	/nfs/dbraw/zinc/10/42/80/330104280.db2.gz	QKMWJFNKOVQYMP-ZDUSSCGKSA-N	0	0	265.422	4.087	20	30		CIEDRN
C#CCC(C)(C)C(=O)Nc1cc(C(F)F)ccc1Cl	ZINC000274340587	330105308	/nfs/dbraw/zinc/10/53/08/330105308.db2.gz	MEAZRPHKARIMBK-UHFFFAOYSA-N	0	0	285.721	4.266	20	30		CIEDRN
C=C(C)[C@@H](N[C@H](C)c1cscn1)c1ccc(F)c(F)c1	ZINC000274804148	330108168	/nfs/dbraw/zinc/10/81/68/330108168.db2.gz	WBLVFOZQVHFKRM-MEBBXXQBSA-N	0	0	294.370	4.389	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)Nc1cccc(C(C)(F)F)c1)OCC	ZINC000275626316	330110825	/nfs/dbraw/zinc/11/08/25/330110825.db2.gz	SBGLGIXLJUGXIC-CQSZACIVSA-N	0	0	297.345	4.108	20	30		CIEDRN
CC(C)Oc1ccccc1[C@@H](C)Nc1ncc(C#N)cc1F	ZINC000572462776	330111246	/nfs/dbraw/zinc/11/12/46/330111246.db2.gz	BOBGCYIEGBISJL-GFCCVEGCSA-N	0	0	299.349	4.053	20	30		CIEDRN
C=CCCN(C)C(=O)N[C@H](CC)c1ccc(Cl)s1	ZINC000276118673	330112258	/nfs/dbraw/zinc/11/22/58/330112258.db2.gz	FXTBHSYCEPBBEQ-SNVBAGLBSA-N	0	0	286.828	4.070	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)NC1CC(C)C1	ZINC000276366448	330112948	/nfs/dbraw/zinc/11/29/48/330112948.db2.gz	BTAGBDOEZHKFIK-UHFFFAOYSA-N	0	0	286.419	4.459	20	30		CIEDRN
C=CCCN(C)C(=O)c1ccc(C(F)(F)F)cc1Cl	ZINC000276333242	330113107	/nfs/dbraw/zinc/11/31/07/330113107.db2.gz	DZSTVEVFUVIIEJ-UHFFFAOYSA-N	0	0	291.700	4.007	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(C)n1	ZINC000276423854	330113670	/nfs/dbraw/zinc/11/36/70/330113670.db2.gz	HSKKDGBGQNVMFB-UHFFFAOYSA-N	0	0	294.398	4.494	20	30		CIEDRN
C#CCCCC(=O)N(C)[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000276982643	330114830	/nfs/dbraw/zinc/11/48/30/330114830.db2.gz	HHYDCGPUZODQTL-LBPRGKRZSA-N	0	0	297.320	4.028	20	30		CIEDRN
C#CCCCC(=O)N1CCC[C@@H]1c1cccc2ccccc21	ZINC000277170744	330115506	/nfs/dbraw/zinc/11/55/06/330115506.db2.gz	ZMJGIKDUSOMGTH-LJQANCHMSA-N	0	0	291.394	4.307	20	30		CIEDRN
CC#CC(=O)N[C@@H](c1cccs1)c1ccc(C(C)C)cc1	ZINC000277533389	330116446	/nfs/dbraw/zinc/11/64/46/330116446.db2.gz	UUSOQSSIVIEREP-GOSISDBHSA-N	0	0	297.423	4.100	20	30		CIEDRN
C=C(C)CN(CC)C(=O)C[C@H](C)c1c[nH]c2ccccc21	ZINC000278535449	330117135	/nfs/dbraw/zinc/11/71/35/330117135.db2.gz	MARZAQLWJJLVLG-AWEZNQCLSA-N	0	0	284.403	4.086	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)c1nc(Cl)cs1	ZINC000279097147	330121395	/nfs/dbraw/zinc/12/13/95/330121395.db2.gz	SSAOBARMHDQGDZ-UHFFFAOYSA-N	0	0	298.839	4.005	20	30		CIEDRN
C=CCCCNC(=O)Nc1ccccc1C(C)(C)C	ZINC000279168036	330121784	/nfs/dbraw/zinc/12/17/84/330121784.db2.gz	QKGYJKOUMSLNQO-UHFFFAOYSA-N	0	0	260.381	4.072	20	30		CIEDRN
N#Cc1c2c(sc1NC(=O)C1CCCCCC1)CCC2	ZINC000171024038	330125956	/nfs/dbraw/zinc/12/59/56/330125956.db2.gz	WFFOOOGYRCJCFW-UHFFFAOYSA-N	0	0	288.416	4.017	20	30		CIEDRN
C[C@H]1CC[C@H](C(=O)Nc2ccc(C(C)(C)C#N)cc2)CC1	ZINC000580435627	330133515	/nfs/dbraw/zinc/13/35/15/330133515.db2.gz	DVGZTCSHEVSBGN-HDJSIYSDSA-N	0	0	284.403	4.253	20	30		CIEDRN
Cc1sc(NC(=O)[C@@H](C)CC2CCCC2)c(C#N)c1C	ZINC000510201119	332897010	/nfs/dbraw/zinc/89/70/10/332897010.db2.gz	VQXCWYAFFMLKDA-JTQLQIEISA-N	0	0	290.432	4.392	20	30		CIEDRN
C=CCC[C@H](Nc1ccc2c(c1)CCN2)c1ccco1	ZINC000423211873	330177903	/nfs/dbraw/zinc/17/79/03/330177903.db2.gz	HNXCLSMSWBDASP-INIZCTEOSA-N	0	0	268.360	4.367	20	30		CIEDRN
CC[C@H](Nc1ccc2c(c1)CCN2)c1ccc(C#N)cc1	ZINC000423221166	330179324	/nfs/dbraw/zinc/17/93/24/330179324.db2.gz	WLVPRAGJAIRYLV-KRWDZBQOSA-N	0	0	277.371	4.089	20	30		CIEDRN
C=CCc1cccc(F)c1OCc1nnc(C(C)C)s1	ZINC000424098308	330229457	/nfs/dbraw/zinc/22/94/57/330229457.db2.gz	GVSDGNHBHMQSNW-UHFFFAOYSA-N	0	0	292.379	4.108	20	30		CIEDRN
N#CC1(CCCOc2cccc(C3CC3)c2)CCOCC1	ZINC000424099134	330231378	/nfs/dbraw/zinc/23/13/78/330231378.db2.gz	IGLPEFNBOGFBQD-UHFFFAOYSA-N	0	0	285.387	4.043	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)NCCc1ccc(C(C)C)cc1	ZINC000527194960	330233122	/nfs/dbraw/zinc/23/31/22/330233122.db2.gz	GSNLKDHKFGCJND-GOSISDBHSA-N	0	0	273.420	4.071	20	30		CIEDRN
C=CCCC1(C(=O)NCCc2ccc(C(C)C)cc2)CC1	ZINC000527507106	330255389	/nfs/dbraw/zinc/25/53/89/330255389.db2.gz	KSPMAHBGYBLICQ-UHFFFAOYSA-N	0	0	285.431	4.215	20	30		CIEDRN
CCC(C#N)(CC)C(=O)N[C@@H](C)c1cccc2ccccc21	ZINC000527689204	330271586	/nfs/dbraw/zinc/27/15/86/330271586.db2.gz	WKKIVAXRMNIWPH-AWEZNQCLSA-N	0	0	294.398	4.347	20	30		CIEDRN
CC(C)[C@@H](C)Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000036805593	330275591	/nfs/dbraw/zinc/27/55/91/330275591.db2.gz	FZDTWBNPGDXTKN-SECBINFHSA-N	0	0	256.271	4.033	20	30		CIEDRN
N#Cc1cccc(CNc2cccc(C3CCOCC3)c2)c1	ZINC000527799164	330284045	/nfs/dbraw/zinc/28/40/45/330284045.db2.gz	RXETUOTUMAZCNF-UHFFFAOYSA-N	0	0	292.382	4.064	20	30		CIEDRN
CC[C@H](Nc1cccc2c1OCC2)c1ccc(C#N)cc1	ZINC000527957351	330294744	/nfs/dbraw/zinc/29/47/44/330294744.db2.gz	ALCXSHNWGQHUCQ-INIZCTEOSA-N	0	0	278.355	4.056	20	30		CIEDRN
CO[C@H](CSCc1ccccc1C(C)(C)C#N)C1CC1	ZINC000424148465	330295110	/nfs/dbraw/zinc/29/51/10/330295110.db2.gz	FPAHEMMROSCMJS-MRXNPFEDSA-N	0	0	289.444	4.146	20	30		CIEDRN
CO[C@H](CSCCC1(C#N)CCCCC1)C1CC1	ZINC000424154601	330301925	/nfs/dbraw/zinc/30/19/25/330301925.db2.gz	OMDCBSMXGYSCDE-CQSZACIVSA-N	0	0	267.438	4.009	20	30		CIEDRN
CCC(C#N)(CC)C(=O)Nc1ncc(-c2ccccc2)s1	ZINC000528048077	330306062	/nfs/dbraw/zinc/30/60/62/330306062.db2.gz	IMVFOQOWHBAUPA-UHFFFAOYSA-N	0	0	299.399	4.079	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(C(C)(C)c2cc(C)ccn2)no1	ZINC000528262256	330317886	/nfs/dbraw/zinc/31/78/86/330317886.db2.gz	KRSUSMRRZTYJKF-ZDUSSCGKSA-N	0	0	285.391	4.169	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)c1oc2c(c1C)c(C)ccc2C	ZINC000116851245	330321652	/nfs/dbraw/zinc/32/16/52/330321652.db2.gz	YHSVDULVARJZPP-GFCCVEGCSA-N	0	0	271.360	4.052	20	30		CIEDRN
C=CC[C@H](C)NC(=O)c1oc2c(c1C)c(C)ccc2C	ZINC000116851243	330321701	/nfs/dbraw/zinc/32/17/01/330321701.db2.gz	YHSVDULVARJZPP-LBPRGKRZSA-N	0	0	271.360	4.052	20	30		CIEDRN
COCc1cccc(CSc2nc(C)cc(C)c2C#N)c1	ZINC000533009293	330324046	/nfs/dbraw/zinc/32/40/46/330324046.db2.gz	LAOZAWXWKKGPNH-UHFFFAOYSA-N	0	0	298.411	4.009	20	30		CIEDRN
N#Cc1cccc(-c2nc3cc(Cl)c(Cl)cc3[nH]2)c1	ZINC000106031966	330331103	/nfs/dbraw/zinc/33/11/03/330331103.db2.gz	FCTWKYMGUYPPDS-UHFFFAOYSA-N	0	0	288.137	4.408	20	30		CIEDRN
CCC(C#N)(CC)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000044764802	330332929	/nfs/dbraw/zinc/33/29/29/330332929.db2.gz	ZAVUFZAXVKNLGZ-UHFFFAOYSA-N	0	0	285.174	4.262	20	30		CIEDRN
CCC(C#N)(CC)C(=O)Nc1cccc(C(C)C)c1	ZINC000044765368	330332959	/nfs/dbraw/zinc/33/29/59/330332959.db2.gz	PMRCFNMYNVKXOO-UHFFFAOYSA-N	0	0	258.365	4.078	20	30		CIEDRN
CC(C)c1ccc(CNc2ccc(C#N)cc2F)cc1	ZINC000045046144	330337522	/nfs/dbraw/zinc/33/75/22/330337522.db2.gz	HGEASRWRBFKCBZ-UHFFFAOYSA-N	0	0	268.335	4.433	20	30		CIEDRN
C[C@H](Sc1ccc(C#N)cn1)c1ccccc1Cl	ZINC000045110444	330338764	/nfs/dbraw/zinc/33/87/64/330338764.db2.gz	HJVAYVXFDSIRKN-JTQLQIEISA-N	0	0	274.776	4.460	20	30		CIEDRN
C=C(C)C(C)(C)c1nc([C@@H](C)Oc2ccccc2)no1	ZINC000424352786	330345702	/nfs/dbraw/zinc/34/57/02/330345702.db2.gz	ZGODSQOOZLMTEF-GFCCVEGCSA-N	0	0	272.348	4.063	20	30		CIEDRN
C=C[C@@H]1OCCC[C@H]1c1nc([C@@H]2CCCC[C@@H]2CC)no1	ZINC000424356424	330346378	/nfs/dbraw/zinc/34/63/78/330346378.db2.gz	BKNKPIQLMNMTST-YJNKXOJESA-N	0	0	290.407	4.202	20	30		CIEDRN
C=C(C)C(C)(C)c1nc(C2(c3cccc(OC)c3)CC2)no1	ZINC000424366928	330347964	/nfs/dbraw/zinc/34/79/64/330347964.db2.gz	YRBZZCKYSUUMPJ-UHFFFAOYSA-N	0	0	298.386	4.012	20	30		CIEDRN
Cc1ccc(F)c(-c2noc(-c3ccc(C#N)cc3C)n2)c1	ZINC000445441314	330352620	/nfs/dbraw/zinc/35/26/20/330352620.db2.gz	GDYZWGOFXBNALK-UHFFFAOYSA-N	0	0	293.301	4.031	20	30		CIEDRN
C[C@@H](c1ccccc1Cl)N(C)Cc1ccc(C#N)cc1	ZINC000046527139	330353476	/nfs/dbraw/zinc/35/34/76/330353476.db2.gz	NIUHTMMGODTICN-ZDUSSCGKSA-N	0	0	284.790	4.405	20	30		CIEDRN
C=CCC[C@H](NC(=O)C[C@H](C)n1cccc1)c1ccccc1	ZINC000533261598	330355747	/nfs/dbraw/zinc/35/57/47/330355747.db2.gz	FPDHEDSZNPRJAL-WMZOPIPTSA-N	0	0	296.414	4.263	20	30		CIEDRN
C=C1CCN(Cc2nc3ccccc3c(C)c2Cl)CC1	ZINC000533280825	330356418	/nfs/dbraw/zinc/35/64/18/330356418.db2.gz	WQAWZIMYUREJMD-UHFFFAOYSA-N	0	0	286.806	4.349	20	30		CIEDRN
CSCc1cccc(NCc2ccc(C#N)cc2F)c1	ZINC000533309064	330356960	/nfs/dbraw/zinc/35/69/60/330356960.db2.gz	WBXQPSOHLRURHU-UHFFFAOYSA-N	0	0	286.375	4.172	20	30		CIEDRN
C=C(CC)CS[C@H](C)C(=O)N[C@@H](C)c1ccccc1C	ZINC000536881913	330360843	/nfs/dbraw/zinc/36/08/43/330360843.db2.gz	PJWAPYMPZYKRTQ-LSDHHAIUSA-N	0	0	291.460	4.260	20	30		CIEDRN
C=C(CC)CS[C@@H](C)C(=O)Nc1cc(C)ccc1C	ZINC000536882847	330360889	/nfs/dbraw/zinc/36/08/89/330360889.db2.gz	ZWQDGEDQKPHCQH-AWEZNQCLSA-N	0	0	277.433	4.330	20	30		CIEDRN
C=C(CC)CSCc1nc(Cc2ccccc2C)no1	ZINC000536882849	330360969	/nfs/dbraw/zinc/36/09/69/330360969.db2.gz	WSHSHMHDJAPDKK-UHFFFAOYSA-N	0	0	288.416	4.168	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N(C)[C@H](C)c1cc2ccccc2o1	ZINC000116971275	330362784	/nfs/dbraw/zinc/36/27/84/330362784.db2.gz	FLIPIJNGIVHCJG-QWHCGFSZSA-N	0	0	286.375	4.100	20	30		CIEDRN
CCCC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C	ZINC000056469583	330367941	/nfs/dbraw/zinc/36/79/41/330367941.db2.gz	YXXMFPRATYGWJJ-UHFFFAOYSA-N	0	0	294.354	4.398	20	30		CIEDRN
CC(C)CCC(=O)CSc1cccc(Cl)c1C#N	ZINC000543031090	330370209	/nfs/dbraw/zinc/37/02/09/330370209.db2.gz	ABAZKLVXFSWRGG-UHFFFAOYSA-N	0	0	281.808	4.309	20	30		CIEDRN
Cc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(C#N)s2)s1	ZINC000119259523	330371455	/nfs/dbraw/zinc/37/14/55/330371455.db2.gz	ACRHTOPXDPKKDO-AWEZNQCLSA-N	0	0	288.441	4.327	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@H](C)c1cc2ccccc2o1	ZINC000424543479	330372607	/nfs/dbraw/zinc/37/26/07/330372607.db2.gz	OLQUZKGYYDSMJQ-GFCCVEGCSA-N	0	0	271.360	4.212	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@H]1CCSc2c(F)cccc21	ZINC000424555405	330374753	/nfs/dbraw/zinc/37/47/53/330374753.db2.gz	FQGCWHUPUFXTNY-ZDUSSCGKSA-N	0	0	293.407	4.081	20	30		CIEDRN
Cc1cc(C(=O)N[C@@H](C)c2ccc(C#N)cc2)ccc1Cl	ZINC000119622407	330377610	/nfs/dbraw/zinc/37/76/10/330377610.db2.gz	VOFKPUUNGRPZHI-LBPRGKRZSA-N	0	0	298.773	4.011	20	30		CIEDRN
C[C@@H](C#N)N[C@H](Cc1ccccc1Cl)c1ccccc1	ZINC000119762875	330379597	/nfs/dbraw/zinc/37/95/97/330379597.db2.gz	UYIYTDPSQWVENQ-SUMWQHHRSA-N	0	0	284.790	4.125	20	30		CIEDRN
CCCOc1cc(C)ccc1NCc1ccc(C#N)s1	ZINC000119868385	330381092	/nfs/dbraw/zinc/38/10/92/330381092.db2.gz	ZLFOFRPMAXKDPW-UHFFFAOYSA-N	0	0	286.400	4.329	20	30		CIEDRN
C[C@H](c1ccccc1Cl)N(C)Cc1ccccc1C#N	ZINC000058000628	330381632	/nfs/dbraw/zinc/38/16/32/330381632.db2.gz	JZWCANMZPGKUBG-CYBMUJFWSA-N	0	0	284.790	4.405	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)[C@@H](C)c1ccccc1	ZINC000120490399	330388747	/nfs/dbraw/zinc/38/87/47/330388747.db2.gz	DJBRSHLSXFQRTG-HNNXBMFYSA-N	0	0	297.373	4.144	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc(F)cc1Cl	ZINC000120967057	330393766	/nfs/dbraw/zinc/39/37/66/330393766.db2.gz	CECBDNGCZXPZPN-UHFFFAOYSA-N	0	0	267.731	4.186	20	30		CIEDRN
C[C@H](c1ccccc1)N(C)C(=O)c1ccc(Cl)c(C#N)c1	ZINC000537167212	330410658	/nfs/dbraw/zinc/41/06/58/330410658.db2.gz	WIZHGEOBTHEZPP-GFCCVEGCSA-N	0	0	298.773	4.045	20	30		CIEDRN
Cc1ccc(C#N)cc1NCc1csc(C(C)(C)C)n1	ZINC000122487047	330424106	/nfs/dbraw/zinc/42/41/06/330424106.db2.gz	WEGVRFVCXGPLNT-UHFFFAOYSA-N	0	0	285.416	4.233	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@@H]1CCCC(C)(C)C1	ZINC000537237226	330430138	/nfs/dbraw/zinc/43/01/38/330430138.db2.gz	PUZXNIRBIHYIPH-UONOGXRCSA-N	0	0	251.414	4.064	20	30		CIEDRN
CC(C)(NCC1(C#N)CC1)c1ccc(Cl)c(Cl)c1	ZINC000537248612	330430428	/nfs/dbraw/zinc/43/04/28/330430428.db2.gz	MRHNTVXHGDFBPK-UHFFFAOYSA-N	0	0	283.202	4.122	20	30		CIEDRN
C=CCC[C@@H](Nc1ccc(NC(=O)C(C)C)cc1)C1CC1	ZINC000537406250	330434775	/nfs/dbraw/zinc/43/47/75/330434775.db2.gz	GFSUQOJTEGQMMI-QGZVFWFLSA-N	0	0	286.419	4.438	20	30		CIEDRN
N#CCCCOc1cccc(N[C@H]2CCC[C@H]2C2CC2)c1	ZINC000537428139	330436667	/nfs/dbraw/zinc/43/66/67/330436667.db2.gz	RGJCIRDVLIKBJW-ROUUACIJSA-N	0	0	284.403	4.360	20	30		CIEDRN
C=CCC[C@H](Nc1ccc(-n2ccnc2)c(F)c1)C1CC1	ZINC000537532397	330440375	/nfs/dbraw/zinc/44/03/75/330440375.db2.gz	RAGIDRDPQAREJT-INIZCTEOSA-N	0	0	285.366	4.168	20	30		CIEDRN
C=C(C)CCc1noc(-c2ccc(Cl)cc2OCC)n1	ZINC000514891408	330466784	/nfs/dbraw/zinc/46/67/84/330466784.db2.gz	WSKAUUXPDXDYKY-UHFFFAOYSA-N	0	0	292.766	4.297	20	30		CIEDRN
Cc1cc(C)c(C#N)c(NCc2cccc3ccccc32)n1	ZINC000315448693	330476287	/nfs/dbraw/zinc/47/62/87/330476287.db2.gz	OCWLZNSXEQLMHU-UHFFFAOYSA-N	0	0	287.366	4.335	20	30		CIEDRN
C[C@@H]1CCC[C@H]1Nc1ccc(C#N)cc1C(F)(F)F	ZINC000084219500	330484705	/nfs/dbraw/zinc/48/47/05/330484705.db2.gz	MEOIVEZYNXNBFB-BXKDBHETSA-N	0	0	268.282	4.178	20	30		CIEDRN
C=CCCC(=O)CSc1ccccc1Br	ZINC000085218761	330489499	/nfs/dbraw/zinc/48/94/99/330489499.db2.gz	JHBJTJWUBWFFMK-UHFFFAOYSA-N	0	0	285.206	4.077	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)C[C@H]1CCCC[C@@H]1C	ZINC000516382741	330492138	/nfs/dbraw/zinc/49/21/38/330492138.db2.gz	JVYNOPNEFGGVNP-LSDHHAIUSA-N	0	0	291.460	4.479	20	30		CIEDRN
Cc1ccc(C#N)cc1NCc1cnc(-c2ccco2)s1	ZINC000426143009	330500152	/nfs/dbraw/zinc/50/01/52/330500152.db2.gz	KQHGEHIDEUMVSW-UHFFFAOYSA-N	0	0	295.367	4.195	20	30		CIEDRN
N#Cc1ccc(NC(=O)NC2CCCCCC2)c(Cl)c1	ZINC000426143394	330500204	/nfs/dbraw/zinc/50/02/04/330500204.db2.gz	MRSNDUBORJMGLH-UHFFFAOYSA-N	0	0	291.782	4.056	20	30		CIEDRN
CCCN(CC(C)C)C(=O)Nc1ccc(C#N)cc1Cl	ZINC000426155615	330500483	/nfs/dbraw/zinc/50/04/83/330500483.db2.gz	ZCLXICWVDTUYRD-UHFFFAOYSA-N	0	0	293.798	4.112	20	30		CIEDRN
C=CCC(C)(C)c1nc([C@@H](C)c2cccs2)no1	ZINC000426410236	330507445	/nfs/dbraw/zinc/50/74/45/330507445.db2.gz	KWQOKYBLNXHFOP-JTQLQIEISA-N	0	0	262.378	4.137	20	30		CIEDRN
CCC[C@@H](NCc1cccc(F)c1C#N)c1ccccc1	ZINC000428307191	330519855	/nfs/dbraw/zinc/51/98/55/330519855.db2.gz	SKXXWKPICOIWMU-GOSISDBHSA-N	0	0	282.362	4.328	20	30		CIEDRN
C=CCC(C)(C)C(=O)NC[C@H](c1ccccc1)C(C)C	ZINC000429855164	330555871	/nfs/dbraw/zinc/55/58/71/330555871.db2.gz	BAXIRLQQBXLWFV-INIZCTEOSA-N	0	0	273.420	4.145	20	30		CIEDRN
N#C[C@H]1CC[C@H](Sc2ccc(Br)cc2)C1	ZINC000430089760	330559347	/nfs/dbraw/zinc/55/93/47/330559347.db2.gz	NWJDZNOWUNRBJP-CABZTGNLSA-N	0	0	282.206	4.233	20	30		CIEDRN
C=CCN(CCC#N)Cc1ccc(-c2ccc(F)cc2C)o1	ZINC000430111711	330561317	/nfs/dbraw/zinc/56/13/17/330561317.db2.gz	UCLPMJPNJXGSMX-UHFFFAOYSA-N	0	0	298.361	4.296	20	30		CIEDRN
N#CCCC[C@@H](Nc1ccc([N+](=O)[O-])cc1)c1ccccc1	ZINC000431513513	330586031	/nfs/dbraw/zinc/58/60/31/330586031.db2.gz	UTFKUOKYSFUPCT-QGZVFWFLSA-N	0	0	295.342	4.442	20	30		CIEDRN
N#CCCC[C@H](Nc1ccc([N+](=O)[O-])cc1)c1ccccc1	ZINC000431513512	330586042	/nfs/dbraw/zinc/58/60/42/330586042.db2.gz	UTFKUOKYSFUPCT-KRWDZBQOSA-N	0	0	295.342	4.442	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)C[C@@H]1CCC[C@H](C)C1	ZINC000431827672	330589280	/nfs/dbraw/zinc/58/92/80/330589280.db2.gz	HXKFVQJSUFUMIL-GXTWGEPZSA-N	0	0	270.376	4.022	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)c1ccc(C(C)C)cc1	ZINC000431848621	330589651	/nfs/dbraw/zinc/58/96/51/330589651.db2.gz	AITNUMYLLJEEQM-UHFFFAOYSA-N	0	0	278.355	4.242	20	30		CIEDRN
CCC[C@@H]1[C@@H](C)CCCN1C(=O)Nc1cccc(C#N)c1C	ZINC000431953832	330591026	/nfs/dbraw/zinc/59/10/26/330591026.db2.gz	VXQBBNIKBAQUJR-SUMWQHHRSA-N	0	0	299.418	4.299	20	30		CIEDRN
N#Cc1cccnc1Oc1ccc(C2CC2)cc1Cl	ZINC000432174110	330594454	/nfs/dbraw/zinc/59/44/54/330594454.db2.gz	CWGQPPOXELLPRK-UHFFFAOYSA-N	0	0	270.719	4.276	20	30		CIEDRN
CC[C@@H]1CCCC[C@@H]1N(C)C(=O)Nc1cccc(C#N)c1C	ZINC000432285403	330596717	/nfs/dbraw/zinc/59/67/17/330596717.db2.gz	ODCSGFPBONZDEC-PBHICJAKSA-N	0	0	299.418	4.299	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)N[C@H](C)CCCC(F)(F)F	ZINC000432349003	330597817	/nfs/dbraw/zinc/59/78/17/330597817.db2.gz	TZIDTACDOYXDHZ-LLVKDONJSA-N	0	0	294.361	4.009	20	30		CIEDRN
N#Cc1ccc(NCc2ccc(C(F)(F)F)s2)cc1	ZINC000432446938	330599374	/nfs/dbraw/zinc/59/93/74/330599374.db2.gz	NZTUGWXOAPOGIX-UHFFFAOYSA-N	0	0	282.290	4.251	20	30		CIEDRN
C=CCC(CC=C)c1nc(-c2ccc(C)cc2OC)no1	ZINC000432549883	330600365	/nfs/dbraw/zinc/60/03/65/330600365.db2.gz	OQSJIHODZBUJQQ-UHFFFAOYSA-N	0	0	284.359	4.289	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)N(C)[C@@H](C)c1ccccc1F	ZINC000432552156	330600475	/nfs/dbraw/zinc/60/04/75/330600475.db2.gz	CBWWMSJHRBCEFR-ZDUSSCGKSA-N	0	0	292.398	4.130	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)NCC(C)(C)C(C)(C)C	ZINC000432767545	330606273	/nfs/dbraw/zinc/60/62/73/330606273.db2.gz	KOYSDKAHNBDDRJ-UHFFFAOYSA-N	0	0	287.407	4.061	20	30		CIEDRN
N#Cc1ccc(N2CCC(F)(c3ccccc3)CC2)c(F)c1	ZINC000432834351	330608606	/nfs/dbraw/zinc/60/86/06/330608606.db2.gz	JBWXXPZIGKIBEN-UHFFFAOYSA-N	0	0	298.336	4.163	20	30		CIEDRN
CCN(C(=O)c1sccc1C1CC1)c1ccc(C#N)cc1	ZINC000432937819	330611126	/nfs/dbraw/zinc/61/11/26/330611126.db2.gz	MAAQMPQJWYOYON-UHFFFAOYSA-N	0	0	296.395	4.164	20	30		CIEDRN
CN(Cc1nc(C2CCCCC2)cs1)CC(C)(C)C#N	ZINC000433297808	330623227	/nfs/dbraw/zinc/62/32/27/330623227.db2.gz	MJWBQESCHXRFKO-UHFFFAOYSA-N	0	0	291.464	4.172	20	30		CIEDRN
Cc1cc(OCc2ncc(-c3ccccc3)o2)ccc1C#N	ZINC000434649588	330642421	/nfs/dbraw/zinc/64/24/21/330642421.db2.gz	AMEWFZSDQXILHU-UHFFFAOYSA-N	0	0	290.322	4.101	20	30		CIEDRN
Cc1cc(O[C@@H](C)c2ncc(C(C)(C)C)o2)ccc1C#N	ZINC000434745798	330644128	/nfs/dbraw/zinc/64/41/28/330644128.db2.gz	LGDCHRSNJGTBGJ-LBPRGKRZSA-N	0	0	284.359	4.292	20	30		CIEDRN
C=CCC[C@@H](NC(=O)N1CCCC[C@@H]1C)c1ccccc1	ZINC000435112018	330649408	/nfs/dbraw/zinc/64/94/08/330649408.db2.gz	UZCVGUIHCQDUBA-DOTOQJQBSA-N	0	0	286.419	4.278	20	30		CIEDRN
C=CCC[C@H](NC(=O)[C@H](C)OCCCC)c1ccccc1	ZINC000435275334	330652248	/nfs/dbraw/zinc/65/22/48/330652248.db2.gz	QTBPQIJHTHFPTO-RDJZCZTQSA-N	0	0	289.419	4.015	20	30		CIEDRN
C=CCC[C@H](Nc1cc(C)nc(COC)n1)c1ccccc1	ZINC000154571974	330660847	/nfs/dbraw/zinc/66/08/47/330660847.db2.gz	QKPPIFYUQVUHJU-INIZCTEOSA-N	0	0	297.402	4.051	20	30		CIEDRN
C=CCC[C@@H](NC(=O)NC(C)(C)CC)c1ccccc1	ZINC000435758908	330662236	/nfs/dbraw/zinc/66/22/36/330662236.db2.gz	FUMMIDOHFWBUFZ-OAHLLOKOSA-N	0	0	274.408	4.182	20	30		CIEDRN
CC[C@H](C#N)N[C@H](C)c1ccc(-c2csc(C)n2)cc1	ZINC000435931931	330665882	/nfs/dbraw/zinc/66/58/82/330665882.db2.gz	ANFXTECGEFGCDB-IAQYHMDHSA-N	0	0	285.416	4.071	20	30		CIEDRN
CC[C@@H](C#N)Sc1nnc(-c2ccc3ccccc3c2)o1	ZINC000436052366	330668105	/nfs/dbraw/zinc/66/81/05/330668105.db2.gz	PEAYLXRRUXXSQM-AWEZNQCLSA-N	0	0	295.367	4.284	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)Nc2cccc(C#N)c2)CCCC1(C)C	ZINC000436105858	330669063	/nfs/dbraw/zinc/66/90/63/330669063.db2.gz	XVZJKLCAGCVLCF-INIZCTEOSA-N	0	0	297.402	4.157	20	30		CIEDRN
CC(C)(C#N)CCCCOc1cccc(C(F)(F)F)n1	ZINC000436185043	330670311	/nfs/dbraw/zinc/67/03/11/330670311.db2.gz	FSTPBAOSKSLQIY-UHFFFAOYSA-N	0	0	286.297	4.199	20	30		CIEDRN
Cc1nc(C(C)C)oc1COc1ccc(C#N)c(Cl)c1	ZINC000436474489	330678298	/nfs/dbraw/zinc/67/82/98/330678298.db2.gz	JPHMJEQLEHPIFY-UHFFFAOYSA-N	0	0	290.750	4.211	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)[C@H](C)CC2CCCC2)s1	ZINC000510502404	332905473	/nfs/dbraw/zinc/90/54/73/332905473.db2.gz	PHFHKXZOOSLWHV-LLVKDONJSA-N	0	0	290.432	4.337	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccc2ccn(CCC)c2c1	ZINC000438295836	330720927	/nfs/dbraw/zinc/72/09/27/330720927.db2.gz	RTNPNOVMNPQFNZ-UHFFFAOYSA-N	0	0	299.418	4.481	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1cccc(CSCC)c1	ZINC000438381126	330723552	/nfs/dbraw/zinc/72/35/52/330723552.db2.gz	SORSLONKDXAPQT-UHFFFAOYSA-N	0	0	292.448	4.370	20	30		CIEDRN
Cc1cc2[nH]c(CNc3ccc(C#N)cc3)cc2c(C)c1	ZINC000438844723	330729904	/nfs/dbraw/zinc/72/99/04/330729904.db2.gz	XDMXEXFGKRKCFU-UHFFFAOYSA-N	0	0	275.355	4.269	20	30		CIEDRN
Cc1nc(CSCc2ccc(C#N)cc2Cl)cs1	ZINC000438879322	330730512	/nfs/dbraw/zinc/73/05/12/330730512.db2.gz	PWWRQALICACYPB-UHFFFAOYSA-N	0	0	294.832	4.410	20	30		CIEDRN
N#Cc1ccc(Cn2ccc(-c3ccccc3)n2)c(Cl)c1	ZINC000438922157	330730939	/nfs/dbraw/zinc/73/09/39/330730939.db2.gz	XZGUWFPMYJZSKI-UHFFFAOYSA-N	0	0	293.757	4.123	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)[C@H]2CC[C@H](CC)CC2)s1	ZINC000439104480	330733858	/nfs/dbraw/zinc/73/38/58/330733858.db2.gz	DJISWMVFCJFDJI-HAQNSBGRSA-N	0	0	290.432	4.337	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1c(C)cccc1SC	ZINC000439389130	330737685	/nfs/dbraw/zinc/73/76/85/330737685.db2.gz	REVMUAAHHCETLW-GFCCVEGCSA-N	0	0	278.421	4.193	20	30		CIEDRN
C=CCC[C@H](NC(=O)Nc1cncc(F)c1)c1ccccc1	ZINC000439646713	330741529	/nfs/dbraw/zinc/74/15/29/330741529.db2.gz	MOQYGFUEHOARLZ-INIZCTEOSA-N	0	0	299.349	4.050	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@@]2(CCCc3ccccc32)C1	ZINC000440007122	330745617	/nfs/dbraw/zinc/74/56/17/330745617.db2.gz	KZIQWBQEIHMNPI-FQEVSTJZSA-N	0	0	297.442	4.239	20	30		CIEDRN
C[C@@H](CC(=O)N(C)c1ccc(C#N)cc1)C1CCCCC1	ZINC000440047665	330745811	/nfs/dbraw/zinc/74/58/11/330745811.db2.gz	BVVGZDSRIYWIMW-AWEZNQCLSA-N	0	0	284.403	4.128	20	30		CIEDRN
Cc1ccc2c(C)cc(NCC3CCC(C#N)CC3)nc2c1	ZINC000440636773	330753193	/nfs/dbraw/zinc/75/31/93/330753193.db2.gz	MPRSXHCLTVQDOJ-UHFFFAOYSA-N	0	0	293.414	4.015	20	30		CIEDRN
Cc1cnc([C@H](C)CNc2cccc(Cl)c2C#N)s1	ZINC000450441180	330770417	/nfs/dbraw/zinc/77/04/17/330770417.db2.gz	PLTQIDBNXMVENM-SECBINFHSA-N	0	0	291.807	4.192	20	30		CIEDRN
CC[C@H](F)CNc1ccccc1SC[C@@H](C)C#N	ZINC000442116286	330774267	/nfs/dbraw/zinc/77/42/67/330774267.db2.gz	AXNAEQNVPZWHTF-RYUDHWBXSA-N	0	0	266.385	4.098	20	30		CIEDRN
N#C[C@H]1CC[C@@H](Nc2ccc(CCC(F)(F)F)cc2)C1	ZINC000442867114	330788607	/nfs/dbraw/zinc/78/86/07/330788607.db2.gz	XUFAXMABCBNLQX-GXTWGEPZSA-N	0	0	282.309	4.286	20	30		CIEDRN
N#C[C@H]1CC[C@H](NC2(c3c(Cl)cccc3Cl)CC2)C1	ZINC000442875743	330789580	/nfs/dbraw/zinc/78/95/80/330789580.db2.gz	OSOGSLMTUSOWEV-QWRGUYRKSA-N	0	0	295.213	4.264	20	30		CIEDRN
C[C@@H](Sc1ccc(C#N)cc1)c1cccc(C#N)c1	ZINC000442913547	330791485	/nfs/dbraw/zinc/79/14/85/330791485.db2.gz	QUKKCUVUYVTBCK-GFCCVEGCSA-N	0	0	264.353	4.283	20	30		CIEDRN
COc1cc(C)nc(CS[C@@H](C)c2cccc(C#N)c2)c1	ZINC000443130084	330795543	/nfs/dbraw/zinc/79/55/43/330795543.db2.gz	IJAPAODVZBXYMB-ZDUSSCGKSA-N	0	0	298.411	4.265	20	30		CIEDRN
Cc1noc(C)c1CCS[C@H](C)c1cccc(C#N)c1	ZINC000443142041	330795721	/nfs/dbraw/zinc/79/57/21/330795721.db2.gz	OCRQAGQMFXQQFP-CYBMUJFWSA-N	0	0	286.400	4.200	20	30		CIEDRN
N#Cc1nc(Sc2ccccc2)ccc1C(F)(F)F	ZINC000443405422	330798985	/nfs/dbraw/zinc/79/89/85/330798985.db2.gz	JFVSPSLAVDZBCK-UHFFFAOYSA-N	0	0	280.274	4.123	20	30		CIEDRN
C=CCN(Cc1nc(C)sc1C)Cc1ccccc1F	ZINC000443628892	330803526	/nfs/dbraw/zinc/80/35/26/330803526.db2.gz	SGMIRQGJEKIAAX-UHFFFAOYSA-N	0	0	290.407	4.087	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc2[nH]ccc2cc1C	ZINC000444446705	330812731	/nfs/dbraw/zinc/81/27/31/330812731.db2.gz	GVJLXUBQMNTRCR-LBPRGKRZSA-N	0	0	256.349	4.017	20	30		CIEDRN
CN(CCCCC(C)(C)C#N)c1c(F)cccc1F	ZINC000444639978	330816012	/nfs/dbraw/zinc/81/60/12/330816012.db2.gz	OINVWHLRDCCYIC-UHFFFAOYSA-N	0	0	266.335	4.121	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1cc2[nH]ccc2cc1C	ZINC000444970941	330827800	/nfs/dbraw/zinc/82/78/00/330827800.db2.gz	WDQCOQHIVVIZFK-CYBMUJFWSA-N	0	0	285.391	4.343	20	30		CIEDRN
N#CC1(c2nc(-c3ccc(Cl)s3)no2)CCCCC1	ZINC000445563368	330831578	/nfs/dbraw/zinc/83/15/78/330831578.db2.gz	BRJBTDMBUUGVNA-UHFFFAOYSA-N	0	0	293.779	4.177	20	30		CIEDRN
N#CCCN1Cc2cc(Cl)ccc2C[C@H]1c1ccccc1	ZINC000446710890	330852132	/nfs/dbraw/zinc/85/21/32/330852132.db2.gz	IQHIKCZIEWVVCP-SFHVURJKSA-N	0	0	296.801	4.353	20	30		CIEDRN
C=CC[C@H](C)[C@H](C)Nc1cnn(C2CCCC2)c1C	ZINC000446902306	330857488	/nfs/dbraw/zinc/85/74/88/330857488.db2.gz	KWQCWKKHKDBJFP-STQMWFEESA-N	0	0	261.413	4.319	20	30		CIEDRN
Cc1cc(COc2c(F)c(F)cc(F)c2F)ccc1C#N	ZINC000447309219	330864202	/nfs/dbraw/zinc/86/42/02/330864202.db2.gz	LSVRUYQOWFQCBU-UHFFFAOYSA-N	0	0	295.235	4.002	20	30		CIEDRN
C=CCC[C@@H](NC(=O)N1C[C@@H]2CCC[C@@H]2C1)c1ccccc1	ZINC000160406369	330865020	/nfs/dbraw/zinc/86/50/20/330865020.db2.gz	AFPVXTJVWAGDTO-FGTMMUONSA-N	0	0	298.430	4.135	20	30		CIEDRN
N#CC1(CN(c2ccsc2)C2CCCCC2)CC1	ZINC000447380106	330865807	/nfs/dbraw/zinc/86/58/07/330865807.db2.gz	CTPREKPNRXNIAZ-UHFFFAOYSA-N	0	0	260.406	4.191	20	30		CIEDRN
C=CCC[C@@H](NC(=O)N(C)Cc1ccco1)c1ccccc1	ZINC000160491340	330866778	/nfs/dbraw/zinc/86/67/78/330866778.db2.gz	OZDLWPUPTUEWFT-QGZVFWFLSA-N	0	0	298.386	4.129	20	30		CIEDRN
C=CCC[C@@H](NC(=O)N1CCC2(CCC2)C1)c1ccccc1	ZINC000160521265	330866913	/nfs/dbraw/zinc/86/69/13/330866913.db2.gz	ZZKKBARKFPKCMM-QGZVFWFLSA-N	0	0	298.430	4.280	20	30		CIEDRN
C=CCC[C@H](Nc1cnn(C2CCCC2)c1C)C1CC1	ZINC000447571970	330870567	/nfs/dbraw/zinc/87/05/67/330870567.db2.gz	LZSHUFYJBLYEFH-INIZCTEOSA-N	0	0	273.424	4.463	20	30		CIEDRN
CC[C@H](Nc1ccc(NC(C)=O)cc1)c1ccc(C#N)cc1	ZINC000447591315	330872247	/nfs/dbraw/zinc/87/22/47/330872247.db2.gz	CPZPUDRROZAKFV-SFHVURJKSA-N	0	0	293.370	4.080	20	30		CIEDRN
CC[C@@H](N[C@@H](C(C)C)C(F)(F)F)c1ccc(C#N)cc1	ZINC000447599966	330872931	/nfs/dbraw/zinc/87/29/31/330872931.db2.gz	LCZFYABOWKSNPP-KGLIPLIRSA-N	0	0	284.325	4.186	20	30		CIEDRN
Cc1cccc(OCCCC(C)(C)C#N)c1Cl	ZINC000447783898	330876585	/nfs/dbraw/zinc/87/65/85/330876585.db2.gz	WJMHLHZMUBXDCJ-UHFFFAOYSA-N	0	0	251.757	4.357	20	30		CIEDRN
N#Cc1ccc(COc2cccc(-c3nccs3)c2)cc1	ZINC000447791685	330876775	/nfs/dbraw/zinc/87/67/75/330876775.db2.gz	MKIBZWVKCUCSSB-UHFFFAOYSA-N	0	0	292.363	4.261	20	30		CIEDRN
CCN(C(=O)CCCC(C)C)[C@H](C)c1ccc(C#N)cc1	ZINC000448777534	330883504	/nfs/dbraw/zinc/88/35/04/330883504.db2.gz	MUDTZCUPQCELNY-OAHLLOKOSA-N	0	0	286.419	4.294	20	30		CIEDRN
CC[C@@H]1C[C@H]1C(=O)Nc1ccccc1S[C@@H](C)CC#N	ZINC000448943708	330889151	/nfs/dbraw/zinc/88/91/51/330889151.db2.gz	PBHXRRIFUYNQIM-YNEHKIRRSA-N	0	0	288.416	4.065	20	30		CIEDRN
Cc1ccc(NC2CCC(C)(C#N)CC2)cc1OC(F)F	ZINC000449040690	330894602	/nfs/dbraw/zinc/89/46/02/330894602.db2.gz	JESUVINUMFLGOB-UHFFFAOYSA-N	0	0	294.345	4.481	20	30		CIEDRN
CSc1cccc(NC2CCC(C)(C#N)CC2)c1	ZINC000449039963	330894662	/nfs/dbraw/zinc/89/46/62/330894662.db2.gz	FUJFDFNTWSIAHI-UHFFFAOYSA-N	0	0	260.406	4.293	20	30		CIEDRN
C=CCC1(C(=O)N[C@H](C)c2ccccc2)CCCC1	ZINC000449040743	330894702	/nfs/dbraw/zinc/89/47/02/330894702.db2.gz	JRRPHWFJCPNNGD-CQSZACIVSA-N	0	0	257.377	4.000	20	30		CIEDRN
C=CCCCC[C@@H](C)Nc1cccc(NC(C)=O)c1	ZINC000449041907	330894820	/nfs/dbraw/zinc/89/48/20/330894820.db2.gz	PDHSCFMVPWBXRL-CYBMUJFWSA-N	0	0	260.381	4.192	20	30		CIEDRN
C=CCCCC[C@H](C)Nc1ccc(NC(C)=O)c(OC)c1	ZINC000449044674	330895010	/nfs/dbraw/zinc/89/50/10/330895010.db2.gz	BMXWWSGKIORQRD-ZDUSSCGKSA-N	0	0	290.407	4.200	20	30		CIEDRN
CC1(C#N)CCC(Nc2ccc(F)cc2OC(F)F)CC1	ZINC000449053378	330895589	/nfs/dbraw/zinc/89/55/89/330895589.db2.gz	AMASSUXKQWPCFG-UHFFFAOYSA-N	0	0	298.308	4.311	20	30		CIEDRN
COCCC1(CNc2cccc(CC#N)c2)CCCCC1	ZINC000449704107	330945126	/nfs/dbraw/zinc/94/51/26/330945126.db2.gz	VIFVLBCNWFDHFG-UHFFFAOYSA-N	0	0	286.419	4.152	20	30		CIEDRN
C[C@@H](CNc1cccc(CC#N)c1)Cc1ccccc1	ZINC000449705216	330945254	/nfs/dbraw/zinc/94/52/54/330945254.db2.gz	XEWXDQDIDUNSMU-OAHLLOKOSA-N	0	0	264.372	4.043	20	30		CIEDRN
C=CCC1(C(=O)N[C@H](C)c2cccc(O)c2)CCCCC1	ZINC000449838598	330951765	/nfs/dbraw/zinc/95/17/65/330951765.db2.gz	GXWYKKMOSDUGFM-CQSZACIVSA-N	0	0	287.403	4.096	20	30		CIEDRN
C=CCC1(C(=O)N[C@H](CC)c2nc(C)cs2)CCCC1	ZINC000449841757	330951802	/nfs/dbraw/zinc/95/18/02/330951802.db2.gz	AZDMCMXBZCCXKS-CYBMUJFWSA-N	0	0	292.448	4.155	20	30		CIEDRN
C=CC[C@H](C)NC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000449888427	330953610	/nfs/dbraw/zinc/95/36/10/330953610.db2.gz	NNTYUUQLBCNJDA-JKOKRWQUSA-N	0	0	295.785	4.054	20	30		CIEDRN
C=CCCCN(C)C(=O)C1(Cc2cccc(Cl)c2)CC1	ZINC000449961383	330956619	/nfs/dbraw/zinc/95/66/19/330956619.db2.gz	QAIHZXHGYCSIMN-UHFFFAOYSA-N	0	0	291.822	4.087	20	30		CIEDRN
CC(C)CCCC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1	ZINC000450004648	330958180	/nfs/dbraw/zinc/95/81/80/330958180.db2.gz	RXEQWBKKDNMTIF-ROUUACIJSA-N	0	0	298.430	4.111	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@@H]1CC2(CCCC2)Oc2ccccc21	ZINC000450141916	330963387	/nfs/dbraw/zinc/96/33/87/330963387.db2.gz	BIIIXNYLGIDKQP-OAHLLOKOSA-N	0	0	299.414	4.151	20	30		CIEDRN
C=CC(C)(C)C(=O)N1CCc2c(Cl)cc(Cl)cc2C1	ZINC000450153552	330963793	/nfs/dbraw/zinc/96/37/93/330963793.db2.gz	WIRFOGFKSDWENV-UHFFFAOYSA-N	0	0	298.213	4.090	20	30		CIEDRN
C[C@@H]1CC[C@H](C(=O)N[C@@H](CCC#N)c2ccccc2)C[C@H]1C	ZINC000450192664	330965222	/nfs/dbraw/zinc/96/52/22/330965222.db2.gz	KQDUSNXMPFGIGU-LMSBXDPUSA-N	0	0	298.430	4.220	20	30		CIEDRN
C=CCC1(C(=O)N2CCc3ccsc3C2)CCCCC1	ZINC000450285224	330970789	/nfs/dbraw/zinc/97/07/89/330970789.db2.gz	IQPJZJACVHAVOI-UHFFFAOYSA-N	0	0	289.444	4.159	20	30		CIEDRN
CC(C)(NCC1(C#N)CCC1)c1cccc(C(F)(F)F)c1	ZINC000450345692	330973833	/nfs/dbraw/zinc/97/38/33/330973833.db2.gz	GIKWXVMDOVZNBC-UHFFFAOYSA-N	0	0	296.336	4.224	20	30		CIEDRN
CC(C)(C)[C@H]1C[C@@H](Nc2cccc(Cl)c2C#N)CCO1	ZINC000450408192	330977029	/nfs/dbraw/zinc/97/70/29/330977029.db2.gz	JBPOLPSZSSJIHC-XHDPSFHLSA-N	0	0	292.810	4.217	20	30		CIEDRN
C=CCC1(C(=O)Nc2scnc2C2CC2)CCCC1	ZINC000450487499	330983381	/nfs/dbraw/zinc/98/33/81/330983381.db2.gz	MZXFJLLRRWWXRR-UHFFFAOYSA-N	0	0	276.405	4.096	20	30		CIEDRN
N#CC1(COc2cc(Cl)cc(Cl)c2)CCC1	ZINC000450608799	330989096	/nfs/dbraw/zinc/98/90/96/330989096.db2.gz	CQUSLGSFQUFEPW-UHFFFAOYSA-N	0	0	256.132	4.066	20	30		CIEDRN
C=CCn1c2ccccc2nc1SCC1(C#N)CCC1	ZINC000450612832	330989267	/nfs/dbraw/zinc/98/92/67/330989267.db2.gz	SDVDAYUIKIDYIN-UHFFFAOYSA-N	0	0	283.400	4.008	20	30		CIEDRN
C[C@H](CCCC(F)(F)F)Nc1ccc(C#N)cc1	ZINC000163204918	330999616	/nfs/dbraw/zinc/99/96/16/330999616.db2.gz	UVGZWNWBNLJTTH-SNVBAGLBSA-N	0	0	256.271	4.091	20	30		CIEDRN
N#CC1(CSCc2cccc(Cl)c2)CCC1	ZINC000450819154	331000983	/nfs/dbraw/zinc/00/09/83/331000983.db2.gz	KKOIYIZGZLZHBA-UHFFFAOYSA-N	0	0	251.782	4.267	20	30		CIEDRN
N#Cc1ccc(SC[C@@H]2CCCC2(F)F)c(F)c1	ZINC000450850248	331002697	/nfs/dbraw/zinc/00/26/97/331002697.db2.gz	WTPAIJFUGZHPNB-JTQLQIEISA-N	0	0	271.307	4.225	20	30		CIEDRN
N#Cc1ccccc1SC[C@H]1CCC(F)(F)C1	ZINC000450860240	331003302	/nfs/dbraw/zinc/00/33/02/331003302.db2.gz	NAKDLTFCINTUKG-JTQLQIEISA-N	0	0	253.317	4.086	20	30		CIEDRN
N#CC1(CSCc2cccc(OC(F)F)c2)CCC1	ZINC000450862086	331003522	/nfs/dbraw/zinc/00/35/22/331003522.db2.gz	QHLIMCMIFJTHTO-UHFFFAOYSA-N	0	0	283.343	4.215	20	30		CIEDRN
CC(=O)c1ccc2cc(OCC3(C#N)CCC3)ccc2c1	ZINC000450860696	331003524	/nfs/dbraw/zinc/00/35/24/331003524.db2.gz	OCORTHSEVGLEGS-UHFFFAOYSA-N	0	0	279.339	4.115	20	30		CIEDRN
N#Cc1c(Cl)cccc1SCC1CC(F)(F)C1	ZINC000450906686	331006360	/nfs/dbraw/zinc/00/63/60/331006360.db2.gz	PXAIYKMAEYFOCS-UHFFFAOYSA-N	0	0	273.735	4.349	20	30		CIEDRN
N#C[C@H]1CC[C@@H](SCc2ccccc2Cl)C1	ZINC000450912323	331006794	/nfs/dbraw/zinc/00/67/94/331006794.db2.gz	GSSHWKFIVPJBPI-CMPLNLGQSA-N	0	0	251.782	4.265	20	30		CIEDRN
Cc1ccnc(N2CCC[C@@H]2c2ccc(F)cc2C)c1C#N	ZINC000450916455	331007164	/nfs/dbraw/zinc/00/71/64/331007164.db2.gz	VOPBKDZFTTWXTH-QGZVFWFLSA-N	0	0	295.361	4.051	20	30		CIEDRN
C[C@@H](CCCC(F)(F)F)Nc1cccc(F)c1C#N	ZINC000163254650	331010382	/nfs/dbraw/zinc/01/03/82/331010382.db2.gz	PSVGPVFDLDQBJS-VIFPVBQESA-N	0	0	274.261	4.230	20	30		CIEDRN
N#CCSCCCSC1CCC(C(F)(F)F)CC1	ZINC000451039197	331013021	/nfs/dbraw/zinc/01/30/21/331013021.db2.gz	XVPUASUGEPHQAK-UHFFFAOYSA-N	0	0	297.411	4.488	20	30		CIEDRN
CC(C)(C#N)CCCCSc1ncccc1F	ZINC000451054950	331013778	/nfs/dbraw/zinc/01/37/78/331013778.db2.gz	MJPVGPWUJAUXPD-UHFFFAOYSA-N	0	0	252.358	4.033	20	30		CIEDRN
C=CCCN(C)C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000451061538	331014208	/nfs/dbraw/zinc/01/42/08/331014208.db2.gz	LLFBROFZZRCLNN-JSGCOSHPSA-N	0	0	295.785	4.007	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)C[C@@H]2CC[C@H]3C[C@H]32)CCCC1(C)C	ZINC000451218071	331020978	/nfs/dbraw/zinc/02/09/78/331020978.db2.gz	QUKFKSALQJMUKO-JONQDZQNSA-N	0	0	275.436	4.016	20	30		CIEDRN
N#Cc1cccc(CN2CC3(CCC3)[C@H]2c2ccco2)c1F	ZINC000451865195	331045458	/nfs/dbraw/zinc/04/54/58/331045458.db2.gz	XOIXHQTWGTYEDR-QGZVFWFLSA-N	0	0	296.345	4.018	20	30		CIEDRN
Cc1cc(F)ccc1[C@@H]1CCC[N@@H+]1CCC(C)(C)C#N	ZINC000451995290	331049680	/nfs/dbraw/zinc/04/96/80/331049680.db2.gz	QXDIKOCYPXMPJT-INIZCTEOSA-N	0	0	274.383	4.211	20	30		CIEDRN
C=CCC1(C(=O)N(C)C2CCC(F)(F)CC2)CCCC1	ZINC000452119164	331055062	/nfs/dbraw/zinc/05/50/62/331055062.db2.gz	KUBCLQPVFKTRCC-UHFFFAOYSA-N	0	0	285.378	4.159	20	30		CIEDRN
CC(C)CCCC(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000452137690	331055560	/nfs/dbraw/zinc/05/55/60/331055560.db2.gz	GDGRQWKCVDKUSA-QGZVFWFLSA-N	0	0	286.419	4.364	20	30		CIEDRN
C=CCC1(C(=O)NC[C@@H]2C[C@H]2c2ccccc2)CCCC1	ZINC000452145348	331055931	/nfs/dbraw/zinc/05/59/31/331055931.db2.gz	UTBGADNDCMYPHH-IRXDYDNUSA-N	0	0	283.415	4.043	20	30		CIEDRN
Cc1ccc(NC(=O)N[C@H](CCC#N)c2ccccc2)s1	ZINC000163564215	331057269	/nfs/dbraw/zinc/05/72/69/331057269.db2.gz	IBXGYBBSNWOPAS-CQSZACIVSA-N	0	0	299.399	4.223	20	30		CIEDRN
C=CCC1(C(=O)NC2CCC(CSC)CC2)CCCC1	ZINC000452482151	331066118	/nfs/dbraw/zinc/06/61/18/331066118.db2.gz	PDJCHXJYKZIPJB-UHFFFAOYSA-N	0	0	295.492	4.161	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@@]1(C)CC(C)C	ZINC000452511332	331067008	/nfs/dbraw/zinc/06/70/08/331067008.db2.gz	OCOAFAYLIXFQNQ-KRWDZBQOSA-N	0	0	263.425	4.182	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@]1(C)CC(C)C	ZINC000452511333	331067035	/nfs/dbraw/zinc/06/70/35/331067035.db2.gz	OCOAFAYLIXFQNQ-QGZVFWFLSA-N	0	0	263.425	4.182	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@]1(C)CC(C)C	ZINC000452513369	331067089	/nfs/dbraw/zinc/06/70/89/331067089.db2.gz	REWBKQRNAHSNBW-HOCLYGCPSA-N	0	0	251.414	4.016	20	30		CIEDRN
CC(C)C[C@@]1(C)CCCN1C(=O)[C@H](C)c1cccc(C#N)c1	ZINC000452514363	331067110	/nfs/dbraw/zinc/06/71/10/331067110.db2.gz	SQHMRYRTNSWQNW-DNVCBOLYSA-N	0	0	298.430	4.089	20	30		CIEDRN
CC(C)=CCC[C@@H](C)NC(=O)c1cc(C#N)ccc1Cl	ZINC000452540021	331067931	/nfs/dbraw/zinc/06/79/31/331067931.db2.gz	IJRBGBIYPWNXCC-GFCCVEGCSA-N	0	0	290.794	4.076	20	30		CIEDRN
C[C@@H](CC(=O)Nc1ccc(CC#N)cc1Cl)C(C)(C)C	ZINC000452642529	331070861	/nfs/dbraw/zinc/07/08/61/331070861.db2.gz	HWMAEDRIEMAQII-NSHDSACASA-N	0	0	292.810	4.417	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452643892	331070869	/nfs/dbraw/zinc/07/08/69/331070869.db2.gz	KQLCKKIENBWOHW-UHFFFAOYSA-N	0	0	288.778	4.113	20	30		CIEDRN
N#CCc1ccc(NC(=O)CC2=CCCCC2)c(Cl)c1	ZINC000452645482	331070979	/nfs/dbraw/zinc/07/09/79/331070979.db2.gz	NCKGNYFLZKIHOK-UHFFFAOYSA-N	0	0	288.778	4.235	20	30		CIEDRN
CC1(C)CCC[C@@H]1C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452655661	331071280	/nfs/dbraw/zinc/07/12/80/331071280.db2.gz	SJARPZHYYGITGB-GFCCVEGCSA-N	0	0	290.794	4.171	20	30		CIEDRN
CCC[C@H](NC(=O)c1ccc(C2(C#N)CC2)cc1)C(C)(C)C	ZINC000452667703	331071762	/nfs/dbraw/zinc/07/17/62/331071762.db2.gz	HJSXEAIWQFSBNJ-INIZCTEOSA-N	0	0	298.430	4.186	20	30		CIEDRN
CCC[C@@H](NC(=O)c1cc(C#N)ccc1Cl)C(C)(C)C	ZINC000452681046	331072128	/nfs/dbraw/zinc/07/21/28/331072128.db2.gz	YPZYVRDOLNLVTD-CQSZACIVSA-N	0	0	292.810	4.156	20	30		CIEDRN
C=C(C)CCNC(=O)C[C@H](C)c1ccccc1C(F)(F)F	ZINC000452721254	331073796	/nfs/dbraw/zinc/07/37/96/331073796.db2.gz	ZKAVTCDHIYPZNY-LBPRGKRZSA-N	0	0	299.336	4.281	20	30		CIEDRN
CC(C)(C#N)c1ccc(C(=O)NCC(C)(C)C2CCC2)cc1	ZINC000452785012	331077782	/nfs/dbraw/zinc/07/77/82/331077782.db2.gz	MBYUCDVHEHXMTQ-UHFFFAOYSA-N	0	0	298.430	4.044	20	30		CIEDRN
C=C[C@](C)(CCOC)C(=O)Nc1cc(C)c(C)cc1Cl	ZINC000452908138	331080291	/nfs/dbraw/zinc/08/02/91/331080291.db2.gz	YODYFPZYPLOEJT-MRXNPFEDSA-N	0	0	295.810	4.124	20	30		CIEDRN
C=CCC1(c2nc(-c3ccccc3OC)no2)CCCC1	ZINC000453021469	331083777	/nfs/dbraw/zinc/08/37/77/331083777.db2.gz	MLVCIUUSOAKCMV-UHFFFAOYSA-N	0	0	284.359	4.133	20	30		CIEDRN
C=CCCc1ccccc1NCc1nnc(C2CC2)s1	ZINC000453134822	331092741	/nfs/dbraw/zinc/09/27/41/331092741.db2.gz	XUWUNNKQBVCIBZ-UHFFFAOYSA-N	0	0	285.416	4.146	20	30		CIEDRN
Cc1nc(C(C)C)ccc1CNc1cccc(CC#N)c1	ZINC000453149262	331094398	/nfs/dbraw/zinc/09/43/98/331094398.db2.gz	QIJQBBNEZVROMM-UHFFFAOYSA-N	0	0	279.387	4.192	20	30		CIEDRN
CC(C)C(=O)c1ccc(NCc2ccc(CC#N)cc2)cc1	ZINC000453161895	331095866	/nfs/dbraw/zinc/09/58/66/331095866.db2.gz	RAINXUZYWSXDTJ-UHFFFAOYSA-N	0	0	292.382	4.203	20	30		CIEDRN
N#CCCCOc1cccc(N[C@@H](C2CC2)C2CCC2)c1	ZINC000453161953	331095870	/nfs/dbraw/zinc/09/58/70/331095870.db2.gz	KKRBZLOWIUHATR-GOSISDBHSA-N	0	0	284.403	4.360	20	30		CIEDRN
C=CC(C)(C)c1nc([C@H](F)c2ccc(Cl)cc2)no1	ZINC000453184579	331098371	/nfs/dbraw/zinc/09/83/71/331098371.db2.gz	POZBRPFQODWNDT-LLVKDONJSA-N	0	0	280.730	4.246	20	30		CIEDRN
C=CCCc1noc([C@@H](CC)Oc2ccccc2C)n1	ZINC000453222716	331103190	/nfs/dbraw/zinc/10/31/90/331103190.db2.gz	ALFGUQTWFULOEF-CYBMUJFWSA-N	0	0	272.348	4.027	20	30		CIEDRN
C=CCCc1noc(-c2ccc(CCC(F)(F)F)cc2)n1	ZINC000453223813	331103540	/nfs/dbraw/zinc/10/35/40/331103540.db2.gz	BFGZCPLGSUMWOF-UHFFFAOYSA-N	0	0	296.292	4.350	20	30		CIEDRN
C=CCC(CC=C)c1nc(C2(OC)CCCCC2)no1	ZINC000453231033	331104422	/nfs/dbraw/zinc/10/44/22/331104422.db2.gz	GMFHIKJQCUXFDP-UHFFFAOYSA-N	0	0	276.380	4.111	20	30		CIEDRN
C=CCCc1noc([C@H]2C[C@H]2c2c(F)cccc2Cl)n1	ZINC000453233294	331104910	/nfs/dbraw/zinc/10/49/10/331104910.db2.gz	JWYWYBDGEGNQDT-ZJUUUORDSA-N	0	0	292.741	4.252	20	30		CIEDRN
C=CCCc1noc(/C=C/c2cnc(C(C)(C)C)s2)n1	ZINC000453236278	331105100	/nfs/dbraw/zinc/10/51/00/331105100.db2.gz	NFSNSDMLFNVLFZ-CMDGGOBGSA-N	0	0	289.404	4.113	20	30		CIEDRN
C=CCCc1noc([C@@H](C)Oc2cc(C)ccc2Cl)n1	ZINC000453244450	331106749	/nfs/dbraw/zinc/10/67/49/331106749.db2.gz	DUHFCBSBZJKWPS-LLVKDONJSA-N	0	0	292.766	4.290	20	30		CIEDRN
CC[C@H](CSC)Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000163800389	331108446	/nfs/dbraw/zinc/10/84/46/331108446.db2.gz	MZDHJMHCEXGAOL-SNVBAGLBSA-N	0	0	288.338	4.131	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2cccc([N+](=O)[O-])c2C)no1	ZINC000453265796	331109113	/nfs/dbraw/zinc/10/91/13/331109113.db2.gz	WTVOYBVDLXIZRS-JTQLQIEISA-N	0	0	287.319	4.023	20	30		CIEDRN
C=CCCOCCCCc1nc(C(C)(C)C2CCC2)no1	ZINC000453275739	331110128	/nfs/dbraw/zinc/11/01/28/331110128.db2.gz	ZATKIHDCTBOXGL-UHFFFAOYSA-N	0	0	292.423	4.063	20	30		CIEDRN
C=CCC1(c2nc(CC3CC(F)(F)C3)no2)CCCC1	ZINC000453366610	331123535	/nfs/dbraw/zinc/12/35/35/331123535.db2.gz	RQYMUSRWSVUKHM-UHFFFAOYSA-N	0	0	282.334	4.045	20	30		CIEDRN
C[C@H](CCC#N)Sc1nc(-c2ccccc2)co1	ZINC000195108753	331137908	/nfs/dbraw/zinc/13/79/08/331137908.db2.gz	YMKFNYYRFNVEFQ-LLVKDONJSA-N	0	0	258.346	4.126	20	30		CIEDRN
C=CC(C)(C)CNC(=O)Nc1ccccc1C(C)C	ZINC000454167694	331140555	/nfs/dbraw/zinc/14/05/55/331140555.db2.gz	NZTLFPGACSHPKK-UHFFFAOYSA-N	0	0	260.381	4.144	20	30		CIEDRN
CC(C)=CCC[C@H](C)NC(=O)N[C@H](C)c1ccc(C#N)cc1	ZINC000454353347	331144792	/nfs/dbraw/zinc/14/47/92/331144792.db2.gz	XIAZZTTXBWWRJH-LSDHHAIUSA-N	0	0	299.418	4.053	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)C1=CC[C@H](C)CC1	ZINC000454426607	331145859	/nfs/dbraw/zinc/14/58/59/331145859.db2.gz	FOHNKTFHAUROFU-ZDUSSCGKSA-N	0	0	275.417	4.009	20	30		CIEDRN
C[C@H]1CC=C(C(=O)Nc2ccc(C(C)(C)C#N)cc2)CC1	ZINC000454626356	331150129	/nfs/dbraw/zinc/15/01/29/331150129.db2.gz	WDSLEHHXYOXWKG-ZDUSSCGKSA-N	0	0	282.387	4.173	20	30		CIEDRN
C=C(CC)CNC(=O)Nc1cc(-c2nc(C)co2)ccc1C	ZINC000454962438	331157796	/nfs/dbraw/zinc/15/77/96/331157796.db2.gz	NIHUXHBPYYDXSS-UHFFFAOYSA-N	0	0	299.374	4.046	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)N1CC[C@@H](CC(C)(C)C)C1	ZINC000455000432	331158509	/nfs/dbraw/zinc/15/85/09/331158509.db2.gz	NCOJZBYYXKBPNE-AWEZNQCLSA-N	0	0	299.418	4.157	20	30		CIEDRN
CCc1ccc(NC(=O)N[C@H]2CC[C@@H](CC#N)C2)cc1CC	ZINC000455054290	331159719	/nfs/dbraw/zinc/15/97/19/331159719.db2.gz	BQLOJPXINSGATM-BBRMVZONSA-N	0	0	299.418	4.015	20	30		CIEDRN
C=C(C)CCNC(=O)Nc1cccc(C(F)F)c1Cl	ZINC000455145102	331161665	/nfs/dbraw/zinc/16/16/65/331161665.db2.gz	KMVNTFQCIFMPRM-UHFFFAOYSA-N	0	0	288.725	4.365	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)Nc1c(C)cccc1Cl	ZINC000455169021	331162088	/nfs/dbraw/zinc/16/20/88/331162088.db2.gz	ZKBMRUDDFICJSX-UHFFFAOYSA-N	0	0	280.799	4.372	20	30		CIEDRN
C=C(C)CCNC(=O)N(C)[C@H](C)c1cc2ccccc2o1	ZINC000455306990	331165013	/nfs/dbraw/zinc/16/50/13/331165013.db2.gz	HLSXJXMDTFTXLO-CYBMUJFWSA-N	0	0	286.375	4.101	20	30		CIEDRN
C=CC(C)(C)CNC(=O)N1CCC[C@@H]1c1cccc(C)c1	ZINC000455363901	331167100	/nfs/dbraw/zinc/16/71/00/331167100.db2.gz	ICRJHQLIZBKIDS-MRXNPFEDSA-N	0	0	286.419	4.054	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CC(C(C)(C)C)C1	ZINC000455388945	331168445	/nfs/dbraw/zinc/16/84/45/331168445.db2.gz	VQJSMFGANLJYFY-UHFFFAOYSA-N	0	0	286.419	4.315	20	30		CIEDRN
C=CCCCCCOc1ccccc1NC(=O)C1CC1	ZINC000195392348	331171112	/nfs/dbraw/zinc/17/11/12/331171112.db2.gz	ZQSSSWBWQRKLQX-UHFFFAOYSA-N	0	0	273.376	4.160	20	30		CIEDRN
C=C(CC)CNC(=O)N(C)[C@H](C)c1ccccc1Cl	ZINC000455523124	331171874	/nfs/dbraw/zinc/17/18/74/331171874.db2.gz	NERCPZYJJSWKPE-GFCCVEGCSA-N	0	0	280.799	4.009	20	30		CIEDRN
C=C(CC)CNC(=O)N(C)[C@H](C)c1cccc(Cl)c1	ZINC000455527708	331172261	/nfs/dbraw/zinc/17/22/61/331172261.db2.gz	VUFUPHMRHVIIOL-GFCCVEGCSA-N	0	0	280.799	4.009	20	30		CIEDRN
C=CC[C@H](C)NC(=O)c1ccc([C@@H](C)C(F)(F)F)cc1	ZINC000455680035	331175370	/nfs/dbraw/zinc/17/53/70/331175370.db2.gz	CRYVVCUBUYUCLE-WDEREUQCSA-N	0	0	285.309	4.047	20	30		CIEDRN
CCCCN(CC)C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000455754040	331177173	/nfs/dbraw/zinc/17/71/73/331177173.db2.gz	PZMJXXHDDVMYBQ-UHFFFAOYSA-N	0	0	293.798	4.060	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1ccccc1C(C)(F)F	ZINC000455773085	331177466	/nfs/dbraw/zinc/17/74/66/331177466.db2.gz	OSJDNWCMVPUCLG-NSHDSACASA-N	0	0	282.334	4.275	20	30		CIEDRN
CCC[C@@H](C)[C@H]1CCCN1C(=O)Nc1cccc(CC#N)c1	ZINC000455899641	331179907	/nfs/dbraw/zinc/17/99/07/331179907.db2.gz	BAOKRPUUUZYGEP-RHSMWYFYSA-N	0	0	299.418	4.185	20	30		CIEDRN
CC[C@@H]1CCCC[C@H]1N(C)C(=O)Nc1cccc(CC#N)c1	ZINC000455914620	331180937	/nfs/dbraw/zinc/18/09/37/331180937.db2.gz	GWLFFFCNYXHKGJ-NVXWUHKLSA-N	0	0	299.418	4.185	20	30		CIEDRN
C=CCN(C(=O)c1ccc([C@H](C)C(F)(F)F)cc1)C1CC1	ZINC000455994462	331182063	/nfs/dbraw/zinc/18/20/63/331182063.db2.gz	MMVDOPZCFGDZPD-NSHDSACASA-N	0	0	297.320	4.143	20	30		CIEDRN
Cc1cc(C#N)cc(NC(=O)N(C)[C@H](C)c2cccs2)c1	ZINC000456001962	331182250	/nfs/dbraw/zinc/18/22/50/331182250.db2.gz	MPQFQDDIYFEUKL-GFCCVEGCSA-N	0	0	299.399	4.153	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cc(OCC)ccc1Cl	ZINC000456043061	331183147	/nfs/dbraw/zinc/18/31/47/331183147.db2.gz	JBBFWWLTPBXZLU-LLVKDONJSA-N	0	0	281.783	4.280	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cc(OCC)ccc1Cl	ZINC000456042192	331183173	/nfs/dbraw/zinc/18/31/73/331183173.db2.gz	IFYFSNHRKUJWDN-OAHLLOKOSA-N	0	0	281.783	4.280	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC1CC1)c1ccc(OC)cc1	ZINC000456181877	331186206	/nfs/dbraw/zinc/18/62/06/331186206.db2.gz	SDKRTZXXHNZUJN-AWEZNQCLSA-N	0	0	287.403	4.041	20	30		CIEDRN
C=CCC1(NC(=O)CCCC[C@H](C)C(C)=O)CCCCC1	ZINC000456359975	331190826	/nfs/dbraw/zinc/19/08/26/331190826.db2.gz	CURITDKWXURIRQ-HNNXBMFYSA-N	0	0	293.451	4.167	20	30		CIEDRN
C=CCC1(NC(=O)c2cc[nH]c2C2CCC2)CCCCC1	ZINC000456375083	331191618	/nfs/dbraw/zinc/19/16/18/331191618.db2.gz	XSFIFUPXSLPLLM-UHFFFAOYSA-N	0	0	286.419	4.291	20	30		CIEDRN
C=CCC1(NC(=O)CCc2ccsc2)CCCCC1	ZINC000456387648	331191940	/nfs/dbraw/zinc/19/19/40/331191940.db2.gz	VILORFMGDGPAMA-UHFFFAOYSA-N	0	0	277.433	4.076	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC2(CCC2)[C@@H]1c1ccco1	ZINC000456570639	331195623	/nfs/dbraw/zinc/19/56/23/331195623.db2.gz	QVSVFZVDPYVSNG-INIZCTEOSA-N	0	0	285.387	4.102	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC2(CCC2)[C@H]1c1ccco1	ZINC000456570645	331195631	/nfs/dbraw/zinc/19/56/31/331195631.db2.gz	QVSVFZVDPYVSNG-MRXNPFEDSA-N	0	0	285.387	4.102	20	30		CIEDRN
CC1(CC(=O)Nc2cccc(CC#N)c2)CCCCC1	ZINC000456749603	331199988	/nfs/dbraw/zinc/19/99/88/331199988.db2.gz	LAVCRCCRHJFHGU-UHFFFAOYSA-N	0	0	270.376	4.052	20	30		CIEDRN
C[C@H](CCC(C)(C)C)C(=O)Nc1cccc(CC#N)c1	ZINC000456760521	331200786	/nfs/dbraw/zinc/20/07/86/331200786.db2.gz	WWXPZFUSHVVMKR-CYBMUJFWSA-N	0	0	272.392	4.154	20	30		CIEDRN
C=C(CC)CNC(=O)[C@@H]1C[C@H]1c1cccc2ccccc21	ZINC000456831945	331206733	/nfs/dbraw/zinc/20/67/33/331206733.db2.gz	VPTQIYBSJCDQBT-ZWKOTPCHSA-N	0	0	279.383	4.026	20	30		CIEDRN
C=C(CC)CNC(=O)c1ccc([C@H](C)C(F)(F)F)cc1	ZINC000456833245	331206882	/nfs/dbraw/zinc/20/68/82/331206882.db2.gz	ZJTCQPIQSXXJSZ-NSHDSACASA-N	0	0	285.309	4.048	20	30		CIEDRN
C=CCCC1(C(=O)N(C)Cc2ccc(C)c(C)c2)CC1	ZINC000456947947	331208992	/nfs/dbraw/zinc/20/89/92/331208992.db2.gz	HWXJDJUYNLIFKE-UHFFFAOYSA-N	0	0	271.404	4.008	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@](C)(Cc1ccccc1)C1CC1	ZINC000457052106	331210970	/nfs/dbraw/zinc/21/09/70/331210970.db2.gz	SUGDMONFXRKPBN-BEFAXECRSA-N	0	0	285.431	4.116	20	30		CIEDRN
C[C@@H]1CCCC[C@@]1(C)NC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000457238427	331216886	/nfs/dbraw/zinc/21/68/86/331216886.db2.gz	CVSYTKAPCMPMJB-SZVBFZGTSA-N	0	0	298.430	4.159	20	30		CIEDRN
C=C[C@@H](CC(=O)N[C@H](C1CC1)C1CCC1)c1ccccc1	ZINC000457238056	331216906	/nfs/dbraw/zinc/21/69/06/331216906.db2.gz	JOLAKZFINRQWAB-LIRRHRJNSA-N	0	0	283.415	4.041	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@@H](C1CC1)C1CCC1)c1ccccc1	ZINC000457246927	331217185	/nfs/dbraw/zinc/21/71/85/331217185.db2.gz	OGBSOZYKQHLWAF-QZTJIDSGSA-N	0	0	283.415	4.041	20	30		CIEDRN
C[C@H](CC(F)(F)F)C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000457431113	331222730	/nfs/dbraw/zinc/22/27/30/331222730.db2.gz	YKMBGRZBBJOMML-SNVBAGLBSA-N	0	0	298.308	4.015	20	30		CIEDRN
C[C@@H](C(=O)Nc1ccccc1SCCC#N)C1CCC1	ZINC000457555685	331226774	/nfs/dbraw/zinc/22/67/74/331226774.db2.gz	UDBPFIYXCMFLKD-GFCCVEGCSA-N	0	0	288.416	4.067	20	30		CIEDRN
C=CCC[C@H](NC(=O)c1[nH]ccc1C1CC1)c1ccccc1	ZINC000457672768	331230810	/nfs/dbraw/zinc/23/08/10/331230810.db2.gz	LNRUZRYXNAVUQA-KRWDZBQOSA-N	0	0	294.398	4.329	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)[C@H](C)CC(F)(F)F	ZINC000457775791	331233999	/nfs/dbraw/zinc/23/39/99/331233999.db2.gz	LAYZLJUNSUXGAJ-LLVKDONJSA-N	0	0	285.309	4.332	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)[C@@H](C)CC(F)(F)F	ZINC000457775792	331234052	/nfs/dbraw/zinc/23/40/52/331234052.db2.gz	LAYZLJUNSUXGAJ-NSHDSACASA-N	0	0	285.309	4.332	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1ccc(OC(C)C)cc1Cl	ZINC000457778181	331234115	/nfs/dbraw/zinc/23/41/15/331234115.db2.gz	CWUWCPBILVEGBP-LBPRGKRZSA-N	0	0	295.810	4.212	20	30		CIEDRN
C=CCC1(NC(=O)[C@H](CC)CC(F)F)CCCCC1	ZINC000457880036	331236907	/nfs/dbraw/zinc/23/69/07/331236907.db2.gz	QELOJCJLBIHTGH-GFCCVEGCSA-N	0	0	273.367	4.063	20	30		CIEDRN
C=CCCCC(=O)N(C)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000458085813	331242432	/nfs/dbraw/zinc/24/24/32/331242432.db2.gz	KCYXTNVCQMBIMQ-SJORKVTESA-N	0	0	271.404	4.137	20	30		CIEDRN
C=CCC1(C(=O)N2Cc3cccc(F)c3C2)CCCCC1	ZINC000458136130	331243659	/nfs/dbraw/zinc/24/36/59/331243659.db2.gz	UVZOFCXNDJQJMM-UHFFFAOYSA-N	0	0	287.378	4.195	20	30		CIEDRN
C=CCC[C@H](C(=O)N[C@H]1CCC[C@@H]2C[C@@H]21)c1ccccc1	ZINC000458307290	331247975	/nfs/dbraw/zinc/24/79/75/331247975.db2.gz	UGXCEJAPUCWSPZ-OWSLCNJRSA-N	0	0	283.415	4.041	20	30		CIEDRN
C[C@@H]1CCCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000458807665	331260398	/nfs/dbraw/zinc/26/03/98/331260398.db2.gz	XWUOCWDBIPBYNA-WBVHZDCISA-N	0	0	299.418	4.006	20	30		CIEDRN
C=CC(C)(C)CNC(=O)N1CCCCC[C@H]1c1ccco1	ZINC000458992258	331264777	/nfs/dbraw/zinc/26/47/77/331264777.db2.gz	VKIFINLUEPQSJE-AWEZNQCLSA-N	0	0	290.407	4.119	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)NC/C=C\CC	ZINC000458991692	331264816	/nfs/dbraw/zinc/26/48/16/331264816.db2.gz	ZIJPILLCMKPVPJ-WAYWQWQTSA-N	0	0	298.839	4.065	20	30		CIEDRN
C=CCC[C@@H](C)Nc1cc(-c2ccnn2C)ccc1C	ZINC000467409717	331276265	/nfs/dbraw/zinc/27/62/65/331276265.db2.gz	ZVOVCABYCQASIE-CQSZACIVSA-N	0	0	269.392	4.162	20	30		CIEDRN
Cc1sc(NC(=O)[C@H]2CCCCC2(F)F)c(C#N)c1C	ZINC000459843485	331302511	/nfs/dbraw/zinc/30/25/11/331302511.db2.gz	HCKXWHIWJUBBSD-LLVKDONJSA-N	0	0	298.358	4.001	20	30		CIEDRN
Cc1sc(NC(=O)[C@@H]2CCCCC2(F)F)c(C#N)c1C	ZINC000459843486	331302557	/nfs/dbraw/zinc/30/25/57/331302557.db2.gz	HCKXWHIWJUBBSD-NSHDSACASA-N	0	0	298.358	4.001	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)C1(CC=C)CCCC1	ZINC000459883711	331302880	/nfs/dbraw/zinc/30/28/80/331302880.db2.gz	VEFHYGREIXHWBZ-UHFFFAOYSA-N	0	0	289.444	4.399	20	30		CIEDRN
C=CCC1(C(=O)N(C)[C@H](C)c2ccccc2)CCCC1	ZINC000459879132	331302905	/nfs/dbraw/zinc/30/29/05/331302905.db2.gz	BMDCRPMSEWROOD-OAHLLOKOSA-N	0	0	271.404	4.343	20	30		CIEDRN
C=CCN(C(=O)c1ccc(C(C)C)nc1C)c1ccccc1	ZINC000459934125	331303614	/nfs/dbraw/zinc/30/36/14/331303614.db2.gz	RYPPWIHYGPNACY-UHFFFAOYSA-N	0	0	294.398	4.346	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)C(C)(C)C(C)(F)F	ZINC000460017319	331304428	/nfs/dbraw/zinc/30/44/28/331304428.db2.gz	GJRYBNWOQKXRBJ-UHFFFAOYSA-N	0	0	299.336	4.022	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccccc2COC)CCCCC1	ZINC000460028320	331304585	/nfs/dbraw/zinc/30/45/85/331304585.db2.gz	UADNWGRMQIOLDN-UHFFFAOYSA-N	0	0	287.403	4.298	20	30		CIEDRN
C=CCN(Cc1cccc(C#N)c1)C(=O)C(C)(C)C(C)(C)C	ZINC000460056012	331304870	/nfs/dbraw/zinc/30/48/70/331304870.db2.gz	GMPHAMRFOGLSSM-UHFFFAOYSA-N	0	0	298.430	4.145	20	30		CIEDRN
CCC[C@@H](CC(C)C)C(=O)N(CC#N)c1ccccc1	ZINC000460064116	331304893	/nfs/dbraw/zinc/30/48/93/331304893.db2.gz	OMWOMRNUWOKZSJ-HNNXBMFYSA-N	0	0	272.392	4.006	20	30		CIEDRN
CC(C)(CCC#N)CNc1ccc(F)c(Br)c1	ZINC000164833543	331305372	/nfs/dbraw/zinc/30/53/72/331305372.db2.gz	QLOGEXLAULPGNE-UHFFFAOYSA-N	0	0	299.187	4.330	20	30		CIEDRN
CC(C)(CCC#N)CNc1ccc(Br)c(F)c1	ZINC000167556389	331308450	/nfs/dbraw/zinc/30/84/50/331308450.db2.gz	ILMRCOVOFFHAPS-UHFFFAOYSA-N	0	0	299.187	4.330	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@@H](CC)c1ccc(F)cc1	ZINC000461092470	331311218	/nfs/dbraw/zinc/31/12/18/331311218.db2.gz	GPSXNNFKCDXGJW-BBRMVZONSA-N	0	0	277.383	4.180	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)C1(CC)CCCCC1	ZINC000461094699	331311429	/nfs/dbraw/zinc/31/14/29/331311429.db2.gz	MZGHSRUPOPGXEI-AWEZNQCLSA-N	0	0	251.414	4.208	20	30		CIEDRN
C[C@@H]1C[C@@H](C)CN(c2c(C#N)cnc3ccc(Cl)cc32)C1	ZINC000461467322	331313584	/nfs/dbraw/zinc/31/35/84/331313584.db2.gz	ZNOTUIICBLWYHL-VXGBXAGGSA-N	0	0	299.805	4.242	20	30		CIEDRN
Cc1nc(N[C@@H](c2ccccc2)C2CC2)c(Cl)cc1C#N	ZINC000461738316	331314233	/nfs/dbraw/zinc/31/42/33/331314233.db2.gz	ZBYGYHIARQYSKI-INIZCTEOSA-N	0	0	297.789	4.478	20	30		CIEDRN
CSc1cccc(NC(=O)[C@H](C)c2cccc(C#N)c2)c1	ZINC000461743373	331314364	/nfs/dbraw/zinc/31/43/64/331314364.db2.gz	WAXVVEBPKXDDPZ-GFCCVEGCSA-N	0	0	296.395	4.022	20	30		CIEDRN
CC(C)c1ccccc1NC(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000461776672	331314595	/nfs/dbraw/zinc/31/45/95/331314595.db2.gz	MWGUKYRQSCTIFW-AWEZNQCLSA-N	0	0	292.382	4.424	20	30		CIEDRN
C[C@@H](C(=O)N(C)CCC1CCCCC1)c1cccc(C#N)c1	ZINC000462025362	331316757	/nfs/dbraw/zinc/31/67/57/331316757.db2.gz	PUSGADYUHTVYLT-OAHLLOKOSA-N	0	0	298.430	4.091	20	30		CIEDRN
CCCC[C@@H]1CCC[C@H]1NC(=O)[C@H](C)c1cccc(C#N)c1	ZINC000462021379	331316762	/nfs/dbraw/zinc/31/67/62/331316762.db2.gz	VNSKNEJOCDWOTC-QGPMSJSTSA-N	0	0	298.430	4.137	20	30		CIEDRN
CC(C)c1ccc([C@H](NC(=O)CCCC#N)C(C)C)cc1	ZINC000462150152	331317989	/nfs/dbraw/zinc/31/79/89/331317989.db2.gz	IGNRXZKGIWTHCP-GOSISDBHSA-N	0	0	286.419	4.317	20	30		CIEDRN
CC(C)c1ccccc1NCCOc1cccc(C#N)c1	ZINC000462211390	331318461	/nfs/dbraw/zinc/31/84/61/331318461.db2.gz	PDWSLVSTXKDFOF-UHFFFAOYSA-N	0	0	280.371	4.173	20	30		CIEDRN
N#Cc1cccc(NCCCOc2cccc(Cl)c2)c1	ZINC000462213711	331318474	/nfs/dbraw/zinc/31/84/74/331318474.db2.gz	VQJLZJRNGKGBGL-UHFFFAOYSA-N	0	0	286.762	4.093	20	30		CIEDRN
Cc1ccc(Cl)cc1NCCOc1cccc(C#N)c1	ZINC000462216390	331318612	/nfs/dbraw/zinc/31/86/12/331318612.db2.gz	XCODUQVBXCUOOY-UHFFFAOYSA-N	0	0	286.762	4.011	20	30		CIEDRN
Cc1cc(Cl)ccc1NC(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000462286702	331318930	/nfs/dbraw/zinc/31/89/30/331318930.db2.gz	DXAHTSZLSDFCGV-LBPRGKRZSA-N	0	0	298.773	4.262	20	30		CIEDRN
CC#CCCOc1ccc([N+](=O)[O-])cc1-c1cccs1	ZINC000462376466	331320894	/nfs/dbraw/zinc/32/08/94/331320894.db2.gz	JVXLWSRMNDKEMK-UHFFFAOYSA-N	0	0	287.340	4.116	20	30		CIEDRN
Cc1ccccc1C[C@@H](C)Nc1ccc(F)cc1C#N	ZINC000462378207	331320990	/nfs/dbraw/zinc/32/09/90/331320990.db2.gz	FGZGODAUORUSIH-CYBMUJFWSA-N	0	0	268.335	4.049	20	30		CIEDRN
Cc1ccccc1C[C@H](C)Nc1ccc(F)cc1C#N	ZINC000462378208	331320997	/nfs/dbraw/zinc/32/09/97/331320997.db2.gz	FGZGODAUORUSIH-ZDUSSCGKSA-N	0	0	268.335	4.049	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)[C@@H]1C[C@H]1CCC	ZINC000462387222	331321157	/nfs/dbraw/zinc/32/11/57/331321157.db2.gz	IYFSJTPFIXTOAE-HUUCEWRRSA-N	0	0	257.377	4.180	20	30		CIEDRN
C=CCNC(=O)N[C@H](C)c1ccc(Cl)c2ccccc21	ZINC000462507094	331322936	/nfs/dbraw/zinc/32/29/36/331322936.db2.gz	CNTOPOUCMCUFBG-LLVKDONJSA-N	0	0	288.778	4.039	20	30		CIEDRN
C=CCCC(=O)N[C@H]1c2ccccc2CC[C@H]1C(C)C	ZINC000462589803	331323648	/nfs/dbraw/zinc/32/36/48/331323648.db2.gz	GQNFSSWVRIGGCG-MAUKXSAKSA-N	0	0	271.404	4.029	20	30		CIEDRN
Cc1cc(C#N)cc(C)c1OCc1cc(-c2ccco2)on1	ZINC000462643276	331324550	/nfs/dbraw/zinc/32/45/50/331324550.db2.gz	RFQCBKNFOFMHJA-UHFFFAOYSA-N	0	0	294.310	4.002	20	30		CIEDRN
C=CCOc1ccc(OCc2cccc(F)c2F)cc1	ZINC000462674479	331325008	/nfs/dbraw/zinc/32/50/08/331325008.db2.gz	HKGOWTKMTBEIJQ-UHFFFAOYSA-N	0	0	276.282	4.109	20	30		CIEDRN
CC#CCCCC(=O)Nc1cccc(C2CCC2)c1	ZINC000462724569	331325621	/nfs/dbraw/zinc/32/56/21/331325621.db2.gz	JDESJNVDDVNYBP-UHFFFAOYSA-N	0	0	255.361	4.086	20	30		CIEDRN
COc1ccc(C#N)cc1N[C@H](C)CCc1ccsc1	ZINC000462792738	331329330	/nfs/dbraw/zinc/32/93/30/331329330.db2.gz	QMGFJLBTMCIKTC-GFCCVEGCSA-N	0	0	286.400	4.062	20	30		CIEDRN
N#Cc1cccc(Cl)c1N1CC[C@H](c2ccccc2)C1	ZINC000462803947	331329679	/nfs/dbraw/zinc/32/96/79/331329679.db2.gz	BGVNVVTWSSQVAK-HNNXBMFYSA-N	0	0	282.774	4.206	20	30		CIEDRN
CC(C)(C)C[C@H]1CCCN1c1ccc(F)cc1C#N	ZINC000462813195	331330512	/nfs/dbraw/zinc/33/05/12/331330512.db2.gz	QOVCKEKJFIPHIY-CQSZACIVSA-N	0	0	260.356	4.102	20	30		CIEDRN
Cc1cccc2[nH]cc(CCNc3ccc(F)cc3C#N)c21	ZINC000462829014	331331596	/nfs/dbraw/zinc/33/15/96/331331596.db2.gz	VJTIXDDHROEADK-UHFFFAOYSA-N	0	0	293.345	4.142	20	30		CIEDRN
N#Cc1cccc(Cl)c1NCCc1cccc(F)c1F	ZINC000462830425	331331856	/nfs/dbraw/zinc/33/18/56/331331856.db2.gz	CSAMHTDTHXFQRP-UHFFFAOYSA-N	0	0	292.716	4.144	20	30		CIEDRN
N#Cc1cc(F)ccc1NCCc1cc2ccccc2o1	ZINC000462851594	331332658	/nfs/dbraw/zinc/33/26/58/331332658.db2.gz	CVDNXSPEGCNURZ-UHFFFAOYSA-N	0	0	280.302	4.098	20	30		CIEDRN
N#Cc1cc(F)ccc1N[C@H](Cc1ccccc1)C1CC1	ZINC000462864006	331332990	/nfs/dbraw/zinc/33/29/90/331332990.db2.gz	SEOTZWMVLTUIPW-GOSISDBHSA-N	0	0	280.346	4.131	20	30		CIEDRN
N#Cc1ccc(N2CC[C@@H](Cc3ccccc3)C2)cc1Cl	ZINC000462867123	331333181	/nfs/dbraw/zinc/33/31/81/331333181.db2.gz	FKFWIKLGSYAXMR-HNNXBMFYSA-N	0	0	296.801	4.281	20	30		CIEDRN
COc1ccc([C@@H](C)CCNc2ccc(F)cc2C#N)cc1	ZINC000462881067	331333811	/nfs/dbraw/zinc/33/38/11/331333811.db2.gz	KBLAAVYFDUBBER-ZDUSSCGKSA-N	0	0	298.361	4.312	20	30		CIEDRN
CC[C@H](C)[C@H](Nc1ccc(C#N)cn1)c1ccc(Cl)cc1	ZINC000462890977	331334067	/nfs/dbraw/zinc/33/40/67/331334067.db2.gz	PGWRCGXNHXRGFO-SJCJKPOMSA-N	0	0	299.805	4.228	20	30		CIEDRN
C[C@@H]1CN(c2ccc(F)cc2C#N)CC[C@H]1c1ccccc1	ZINC000462893998	331334237	/nfs/dbraw/zinc/33/42/37/331334237.db2.gz	HTIUHJFYKLDZHL-RDTXWAMCSA-N	0	0	294.373	4.327	20	30		CIEDRN
CCC(CC)c1cc(CNc2nc(C)cc(C)c2C#N)on1	ZINC000462896966	331334307	/nfs/dbraw/zinc/33/43/07/331334307.db2.gz	WEKMIUNJUGJRJW-UHFFFAOYSA-N	0	0	298.390	4.074	20	30		CIEDRN
N#Cc1c(F)cccc1N[C@@H]1CC[C@H]2CCC[C@@H]2C1	ZINC000462902733	331334450	/nfs/dbraw/zinc/33/44/50/331334450.db2.gz	PNCMJUOIFAETNH-JHJVBQTASA-N	0	0	258.340	4.078	20	30		CIEDRN
C[C@@H](CNc1ccc(C#N)cc1F)Cc1cccs1	ZINC000462911557	331334833	/nfs/dbraw/zinc/33/48/33/331334833.db2.gz	OGAZYDZUCWICNQ-LLVKDONJSA-N	0	0	274.364	4.050	20	30		CIEDRN
C=CCOc1ccc(Oc2nc3cc(C)ccc3o2)cc1	ZINC000462950273	331335745	/nfs/dbraw/zinc/33/57/45/331335745.db2.gz	ZUFVUPSSGPQJML-UHFFFAOYSA-N	0	0	281.311	4.493	20	30		CIEDRN
Cc1cscc1-c1noc([C@@H](C)c2cccc(C#N)c2)n1	ZINC000463048950	331338642	/nfs/dbraw/zinc/33/86/42/331338642.db2.gz	PDKZBPLJEAXDBJ-NSHDSACASA-N	0	0	295.367	4.130	20	30		CIEDRN
C[C@@H](c1nc([C@H]2CCCC[C@@H]2C)no1)c1cccc(C#N)c1	ZINC000463052259	331338714	/nfs/dbraw/zinc/33/87/14/331338714.db2.gz	FAMCCPGBMCNVOY-ZENOOKHLSA-N	0	0	295.386	4.387	20	30		CIEDRN
CC(C)(C)[C@@](C)(C#N)NC(=O)c1cccc(C2CCC2)c1	ZINC000463054297	331338784	/nfs/dbraw/zinc/33/87/84/331338784.db2.gz	QNFUFNCIJYVBEA-GOSISDBHSA-N	0	0	284.403	4.012	20	30		CIEDRN
Cc1ccsc1-c1noc([C@@H](C)c2cccc(C#N)c2)n1	ZINC000463058740	331339026	/nfs/dbraw/zinc/33/90/26/331339026.db2.gz	VQPROJNQHVEKFS-NSHDSACASA-N	0	0	295.367	4.130	20	30		CIEDRN
Cc1ccc2sc(C(=O)Nc3ccc(C#N)cc3)cc2c1	ZINC000463069430	331339195	/nfs/dbraw/zinc/33/91/95/331339195.db2.gz	WBTMGAGNQOCTDL-UHFFFAOYSA-N	0	0	292.363	4.334	20	30		CIEDRN
N#C[C@@H]1CCC[C@@H](Nc2cc(Cl)cc(Cl)c2)C1	ZINC000463234836	331343356	/nfs/dbraw/zinc/34/33/56/331343356.db2.gz	BDGZQBCQFGPTBH-BXKDBHETSA-N	0	0	269.175	4.488	20	30		CIEDRN
N#C[C@H]1CCC[C@@H](Nc2cc(Cl)cc(Cl)c2)C1	ZINC000463234839	331343449	/nfs/dbraw/zinc/34/34/49/331343449.db2.gz	BDGZQBCQFGPTBH-JOYOIKCWSA-N	0	0	269.175	4.488	20	30		CIEDRN
C=CCNC(=O)c1ccc(-c2ccc(C(C)(C)C)cc2)o1	ZINC000463243175	331343918	/nfs/dbraw/zinc/34/39/18/331343918.db2.gz	QLAOKSSIUJHPFY-UHFFFAOYSA-N	0	0	283.371	4.160	20	30		CIEDRN
C=CCN(CC=C)C(=O)C(C)(C)CCCc1ccccc1	ZINC000463256235	331344479	/nfs/dbraw/zinc/34/44/79/331344479.db2.gz	DGZXYSBQCNWFRJ-UHFFFAOYSA-N	0	0	285.431	4.236	20	30		CIEDRN
C=CCN(CC=C)C(=O)C1(c2cccc(C)c2)CCCC1	ZINC000463266091	331344721	/nfs/dbraw/zinc/34/47/21/331344721.db2.gz	MDAWTGGEHAACOY-UHFFFAOYSA-N	0	0	283.415	4.007	20	30		CIEDRN
C=CCN(CC=C)C(=O)C1(c2ccccc2C)CCCC1	ZINC000463269867	331344865	/nfs/dbraw/zinc/34/48/65/331344865.db2.gz	ZPFUNAZCVKBQJD-UHFFFAOYSA-N	0	0	283.415	4.007	20	30		CIEDRN
CCCCN(C(=O)[C@H](C)c1cccc(C#N)c1)[C@@H](C)CC	ZINC000463343046	331346299	/nfs/dbraw/zinc/34/62/99/331346299.db2.gz	AHTMDBBXYUBPHX-LSDHHAIUSA-N	0	0	286.419	4.089	20	30		CIEDRN
CC(C)(C#N)CCCCN1CCn2c(cc3ccccc32)C1	ZINC000463342952	331346314	/nfs/dbraw/zinc/34/63/14/331346314.db2.gz	KJRLOXHWZXETDW-UHFFFAOYSA-N	0	0	295.430	4.177	20	30		CIEDRN
CCN(C(=O)[C@@H](C)c1cccc(C#N)c1)c1cccc(C)c1	ZINC000463395069	331347131	/nfs/dbraw/zinc/34/71/31/331347131.db2.gz	RCKQGXXRDARYMP-HNNXBMFYSA-N	0	0	292.382	4.023	20	30		CIEDRN
CCN(CC(C)(C)C)C(=O)Nc1ccc(C#N)cc1Cl	ZINC000463754279	331351611	/nfs/dbraw/zinc/35/16/11/331351611.db2.gz	GKMCYNJMQLWWIO-UHFFFAOYSA-N	0	0	293.798	4.112	20	30		CIEDRN
C=CCCCN(C)C(=O)CCc1cccc(C(F)(F)F)c1	ZINC000463767150	331351730	/nfs/dbraw/zinc/35/17/30/331351730.db2.gz	HCTCAOSIWCPECT-UHFFFAOYSA-N	0	0	299.336	4.063	20	30		CIEDRN
C[C@@H](CC(=O)N[C@@](C)(C#N)C(C)(C)C)C1CCCCC1	ZINC000464158769	331357235	/nfs/dbraw/zinc/35/72/35/331357235.db2.gz	PNFQOTZCWZCIQS-GUYCJALGSA-N	0	0	278.440	4.037	20	30		CIEDRN
C[C@@H](CC(=O)N[C@](C)(C#N)C(C)(C)C)C1CCCCC1	ZINC000464158770	331357308	/nfs/dbraw/zinc/35/73/08/331357308.db2.gz	PNFQOTZCWZCIQS-SUMWQHHRSA-N	0	0	278.440	4.037	20	30		CIEDRN
CCCC[C@H](CC)C(=O)NC(C#N)(CCC)CCC	ZINC000464267183	331358996	/nfs/dbraw/zinc/35/89/96/331358996.db2.gz	PLHYWEPTHINOQE-AWEZNQCLSA-N	0	0	266.429	4.182	20	30		CIEDRN
Cc1cc(Cl)c2ccccc2c1NC(=O)CCCC#N	ZINC000464394612	331360200	/nfs/dbraw/zinc/36/02/00/331360200.db2.gz	ZBRZAMWURIOAAR-UHFFFAOYSA-N	0	0	286.762	4.434	20	30		CIEDRN
CC#CCCCC(=O)N[C@H]1CCCC[C@H]1Cc1ccccc1	ZINC000464435131	331360449	/nfs/dbraw/zinc/36/04/49/331360449.db2.gz	BWWPRQPGAHGIKT-OALUTQOASA-N	0	0	297.442	4.098	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](c1ccccc1)C1CCC1	ZINC000464435860	331360481	/nfs/dbraw/zinc/36/04/81/331360481.db2.gz	ADUSAOSAPBQIJL-PBHICJAKSA-N	0	0	271.404	4.246	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCCCCCc1ccccc1	ZINC000464436125	331360524	/nfs/dbraw/zinc/36/05/24/331360524.db2.gz	IQMWVDHWICMAML-MRXNPFEDSA-N	0	0	273.420	4.118	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(C)c(OCC(F)F)c1	ZINC000464438188	331360530	/nfs/dbraw/zinc/36/05/30/331360530.db2.gz	PRMCHCLEKGDCBB-LBPRGKRZSA-N	0	0	297.345	4.180	20	30		CIEDRN
CC#CCCCC(=O)Nc1cc(Cl)ccc1OCCC	ZINC000464439079	331360621	/nfs/dbraw/zinc/36/06/21/331360621.db2.gz	DKCMLMYRGSNKED-UHFFFAOYSA-N	0	0	293.794	4.261	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCC(C)(C)c1ccccc1Cl	ZINC000464437328	331360622	/nfs/dbraw/zinc/36/06/22/331360622.db2.gz	NYQBZVIDEFGOMT-ZDUSSCGKSA-N	0	0	293.838	4.336	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](CC)c1ccccc1OCC	ZINC000464440429	331360724	/nfs/dbraw/zinc/36/07/24/331360724.db2.gz	JIZOBLFDYWXXHY-GOEBONIOSA-N	0	0	289.419	4.255	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccc2c3c(cccc31)CC2	ZINC000464443416	331360762	/nfs/dbraw/zinc/36/07/62/331360762.db2.gz	GWIOJDWASVVEMA-UHFFFAOYSA-N	0	0	277.367	4.071	20	30		CIEDRN
C=CCC[C@H](C(=O)N(C)[C@@H]1CC[C@H](C)C1)c1ccccc1	ZINC000464477804	331361182	/nfs/dbraw/zinc/36/11/82/331361182.db2.gz	CMHMKWCKDDRXAE-JQHSSLGASA-N	0	0	285.431	4.383	20	30		CIEDRN
C=CCC[C@H](C(=O)N(C)[C@@H]1CC[C@@H](C)C1)c1ccccc1	ZINC000464477806	331361267	/nfs/dbraw/zinc/36/12/67/331361267.db2.gz	CMHMKWCKDDRXAE-NXHRZFHOSA-N	0	0	285.431	4.383	20	30		CIEDRN
C=CC[C@@H](C(=O)N(C)[C@@H]1CCC(C)(C)C1)c1ccccc1	ZINC000464491570	331361442	/nfs/dbraw/zinc/36/14/42/331361442.db2.gz	YNFSWPPGASBSPM-IAGOWNOFSA-N	0	0	285.431	4.383	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NC(c1ccccc1)c1ccccc1	ZINC000464527177	331361821	/nfs/dbraw/zinc/36/18/21/331361821.db2.gz	PRURYMNUSIVOOX-INIZCTEOSA-N	0	0	293.410	4.495	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1nc2c(cccc2C)s1	ZINC000464554505	331361884	/nfs/dbraw/zinc/36/18/84/331361884.db2.gz	MJNMXRRHPMZRKI-NSHDSACASA-N	0	0	274.389	4.146	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@@H](C)c1ccc(C)cc1C	ZINC000464528877	331361903	/nfs/dbraw/zinc/36/19/03/331361903.db2.gz	UQIYRBYPENIAGQ-CVEARBPZSA-N	0	0	273.420	4.425	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC)c1cccc(Cl)c1	ZINC000464535467	331361976	/nfs/dbraw/zinc/36/19/76/331361976.db2.gz	DOKOSFAENKSRFP-GFCCVEGCSA-N	0	0	265.784	4.295	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCCSc1ccc(Cl)cc1	ZINC000464536506	331362004	/nfs/dbraw/zinc/36/20/04/331362004.db2.gz	SZMUSVPZFDBZOI-LBPRGKRZSA-N	0	0	297.851	4.151	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](c1ccc(C)cc1)C1CC1	ZINC000464537920	331362022	/nfs/dbraw/zinc/36/20/22/331362022.db2.gz	HTEZFJADIWCDDT-WMLDXEAASA-N	0	0	271.404	4.165	20	30		CIEDRN
CC#CCCCC(=O)N(CC)[C@H](CC)c1ccccc1	ZINC000464548558	331362344	/nfs/dbraw/zinc/36/23/44/331362344.db2.gz	KYFJYFNXTZOTBD-QGZVFWFLSA-N	0	0	271.404	4.180	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(Cc1ccccc1C)C1CC1	ZINC000464554068	331362426	/nfs/dbraw/zinc/36/24/26/331362426.db2.gz	YAOCIGXKFSEAQX-OAHLLOKOSA-N	0	0	271.404	4.088	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCc1csc2ccccc12	ZINC000464556635	331362514	/nfs/dbraw/zinc/36/25/14/331362514.db2.gz	SNSBVVZBPAUQIN-LBPRGKRZSA-N	0	0	273.401	4.120	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(Cc1ccccc1F)CC(C)C	ZINC000464567854	331362883	/nfs/dbraw/zinc/36/28/83/331362883.db2.gz	FXPWJMHTHXGABJ-OAHLLOKOSA-N	0	0	291.410	4.413	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NC[C@H](c1ccccc1)C(C)C	ZINC000464571784	331362894	/nfs/dbraw/zinc/36/28/94/331362894.db2.gz	SZIKFYJWRDCGDV-RDJZCZTQSA-N	0	0	273.420	4.145	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NC[C@@H](c1ccccc1)C(C)C	ZINC000464571779	331362937	/nfs/dbraw/zinc/36/29/37/331362937.db2.gz	SZIKFYJWRDCGDV-DOTOQJQBSA-N	0	0	273.420	4.145	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC(C)C)c1ccc(OC)cc1	ZINC000464570525	331362945	/nfs/dbraw/zinc/36/29/45/331362945.db2.gz	OSYOYQPADZFRJT-HNNXBMFYSA-N	0	0	289.419	4.287	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)C1CCC(CC)CC1	ZINC000464572249	331362968	/nfs/dbraw/zinc/36/29/68/331362968.db2.gz	RYXAJMUCHPOMCP-NFOMZHRRSA-N	0	0	251.414	4.016	20	30		CIEDRN
CC#CCCCC(=O)N[C@H]1CCC(C)(C)c2ccccc21	ZINC000464644828	331364110	/nfs/dbraw/zinc/36/41/10/331364110.db2.gz	CQIIYLPYTBFDRA-KRWDZBQOSA-N	0	0	283.415	4.109	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CCCC[C@H]1c1ccccc1	ZINC000464650695	331364207	/nfs/dbraw/zinc/36/42/07/331364207.db2.gz	AKVGNDARWVOESF-RYQLBKOJSA-N	0	0	285.431	4.431	20	30		CIEDRN
C=C[C@@H](C)NC(=O)N[C@@H](c1ccc(Cl)cc1)C1CCC1	ZINC000464755773	331366273	/nfs/dbraw/zinc/36/62/73/331366273.db2.gz	JPLZADKIEVCKTJ-IAQYHMDHSA-N	0	0	292.810	4.055	20	30		CIEDRN
C=C[C@H](C)NC(=O)N[C@H](C)c1ccc(SC(C)C)cc1	ZINC000464756511	331366287	/nfs/dbraw/zinc/36/62/87/331366287.db2.gz	RFGSUZJDWRUSCB-QWHCGFSZSA-N	0	0	292.448	4.122	20	30		CIEDRN
C=C[C@H](C)NC(=O)C[C@H](Cc1ccccc1)c1ccccc1	ZINC000465101941	331378332	/nfs/dbraw/zinc/37/83/32/331378332.db2.gz	IJWMJELVMKNWOY-LPHOPBHVSA-N	0	0	293.410	4.094	20	30		CIEDRN
C=C[C@H](C)NC(=O)c1ccc(-c2ccc(C)cc2)cc1F	ZINC000465112979	331378745	/nfs/dbraw/zinc/37/87/45/331378745.db2.gz	QRDLMSQOZRJUOM-ZDUSSCGKSA-N	0	0	283.346	4.105	20	30		CIEDRN
C=C[C@H](C)NC(=O)CC1CCC(c2ccccc2)CC1	ZINC000465117024	331378941	/nfs/dbraw/zinc/37/89/41/331378941.db2.gz	SUGLBHFXTDSSCJ-UQPPLGOBSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=C[C@H](C)NC(=O)Nc1ccc(SC2CCCC2)cc1	ZINC000465154375	331379709	/nfs/dbraw/zinc/37/97/09/331379709.db2.gz	AQURADMCZOAOQN-LBPRGKRZSA-N	0	0	290.432	4.417	20	30		CIEDRN
C=C[C@@H](C)NC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000465175585	331380243	/nfs/dbraw/zinc/38/02/43/331380243.db2.gz	BQQZOYYQBUGIPV-CYBMUJFWSA-N	0	0	282.343	4.175	20	30		CIEDRN
C=C[C@H](C)NC(=O)Nc1ccc(C(F)(F)F)cc1Cl	ZINC000465259450	331380802	/nfs/dbraw/zinc/38/08/02/331380802.db2.gz	PDULNMADGSESST-ZETCQYMHSA-N	0	0	292.688	4.055	20	30		CIEDRN
C=CCCCC(=O)Nc1nc2c(ccc(F)c2C)s1	ZINC000465266751	331380924	/nfs/dbraw/zinc/38/09/24/331380924.db2.gz	OLXGOVPPFSLQMY-UHFFFAOYSA-N	0	0	278.352	4.039	20	30		CIEDRN
CCc1c(C)sc(NC(=O)C2(CC)CCCC2)c1C#N	ZINC000465458027	331384019	/nfs/dbraw/zinc/38/40/19/331384019.db2.gz	KEXJFVZQMISIRD-UHFFFAOYSA-N	0	0	290.432	4.400	20	30		CIEDRN
C=CCCCCCN(C)C(=O)N[C@H](C)C[C@@H](C)CC	ZINC000466175273	331389870	/nfs/dbraw/zinc/38/98/70/331389870.db2.gz	YNZJPEDMWQDNSF-LSDHHAIUSA-N	0	0	268.445	4.199	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)N[C@@H](C)C[C@@H](C)CC	ZINC000466166815	331390319	/nfs/dbraw/zinc/39/03/19/331390319.db2.gz	OCPDDZKEIHXJHJ-KBPBESRZSA-N	0	0	294.464	4.270	20	30		CIEDRN
CC[C@H](C)C[C@H](C)NC(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000466166991	331390343	/nfs/dbraw/zinc/39/03/43/331390343.db2.gz	MSLACAVDLKJQSU-QWRGUYRKSA-N	0	0	293.798	4.158	20	30		CIEDRN
C[C@H]1CCC[C@](C#N)(NC(=O)c2cccc3ccsc32)C1	ZINC000466234777	331391362	/nfs/dbraw/zinc/39/13/62/331391362.db2.gz	HIAUISNVURDGBM-SJCJKPOMSA-N	0	0	298.411	4.104	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCc2ccc(C(C)(C)C)cc2C1	ZINC000466256662	331391760	/nfs/dbraw/zinc/39/17/60/331391760.db2.gz	RHBMOPMSJWLQSV-OAHLLOKOSA-N	0	0	299.458	4.471	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](c1cccc(C)c1)C(F)(F)F	ZINC000466261419	331391773	/nfs/dbraw/zinc/39/17/73/331391773.db2.gz	SVKWKPMDZULZCW-OCCSQVGLSA-N	0	0	299.336	4.317	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](c1cccc(C)c1)C(F)(F)F	ZINC000466261408	331391774	/nfs/dbraw/zinc/39/17/74/331391774.db2.gz	SVKWKPMDZULZCW-GXTWGEPZSA-N	0	0	299.336	4.317	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(F)c(OC(C)C)c(F)c1	ZINC000466262125	331391823	/nfs/dbraw/zinc/39/18/23/331391823.db2.gz	RHXYINVPNCGULR-NSHDSACASA-N	0	0	297.345	4.293	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Cc1c(C)oc2ccccc21	ZINC000466267988	331391891	/nfs/dbraw/zinc/39/18/91/331391891.db2.gz	YWBANNVHUNPYEH-CYBMUJFWSA-N	0	0	285.387	4.145	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CC[C@@H](C)C2(CCCCC2)C1	ZINC000466314257	331392567	/nfs/dbraw/zinc/39/25/67/331392567.db2.gz	MKTPWIAEMKUELI-HZPDHXFCSA-N	0	0	277.452	4.408	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(C)[C@@H](CC)Cc1ccccc1	ZINC000466367054	331393613	/nfs/dbraw/zinc/39/36/13/331393613.db2.gz	OVACJWDQFVUSQI-SJORKVTESA-N	0	0	288.435	4.004	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N1CCC[C@@H]1c1ccc(F)cc1	ZINC000466385019	331394240	/nfs/dbraw/zinc/39/42/40/331394240.db2.gz	YLSYANWQVUQGMQ-HZPDHXFCSA-N	0	0	290.382	4.027	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(Cc1ccco1)C1CCCC1	ZINC000466386528	331394311	/nfs/dbraw/zinc/39/43/11/331394311.db2.gz	PUHNZOWEPYXXPV-AWEZNQCLSA-N	0	0	290.407	4.089	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1ccccc1C(C)(C)C	ZINC000466385762	331394362	/nfs/dbraw/zinc/39/43/62/331394362.db2.gz	JOKZVGIUJDYLFR-ZDUSSCGKSA-N	0	0	274.408	4.460	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1ccc(OCC)c(Cl)c1	ZINC000466386549	331394397	/nfs/dbraw/zinc/39/43/97/331394397.db2.gz	QCDKCRLBSPGLBI-LLVKDONJSA-N	0	0	296.798	4.215	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1ccccc1CCC	ZINC000466385748	331394399	/nfs/dbraw/zinc/39/43/99/331394399.db2.gz	JKEHXOGPLLYKPH-CQSZACIVSA-N	0	0	260.381	4.115	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(C)[C@@H](C)c1ccc(C)cc1C	ZINC000466389934	331394414	/nfs/dbraw/zinc/39/44/14/331394414.db2.gz	RZGCFQRPGNTIOI-JKSUJKDBSA-N	0	0	288.435	4.361	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1ccc2c(c1)Cc1ccccc1-2	ZINC000466391466	331394558	/nfs/dbraw/zinc/39/45/58/331394558.db2.gz	LSKRKSGRPOSGON-UHFFFAOYSA-N	0	0	292.382	4.298	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(C)[C@@H](C)c1cc(C)ccc1C	ZINC000466410028	331395616	/nfs/dbraw/zinc/39/56/16/331395616.db2.gz	PNWPKTDLTQRJLD-HOTGVXAUSA-N	0	0	288.435	4.361	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)[C@@H]1C[C@]1(C)CC	ZINC000466414482	331395791	/nfs/dbraw/zinc/39/57/91/331395791.db2.gz	JYOXKBBNIDKMGH-WFASDCNBSA-N	0	0	297.851	4.352	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cc(C)c(C)c2ncccc12	ZINC000466415846	331395876	/nfs/dbraw/zinc/39/58/76/331395876.db2.gz	HWSUYKRJYAEAIV-CYBMUJFWSA-N	0	0	282.387	4.392	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC1CC1)C1CCCCC1	ZINC000466416640	331395886	/nfs/dbraw/zinc/39/58/86/331395886.db2.gz	LUJGKYMTYUHHHJ-AWEZNQCLSA-N	0	0	263.425	4.160	20	30		CIEDRN
CC#CCCCC(=O)N[C@H](c1ccccc1C)C(C)C	ZINC000466415260	331395966	/nfs/dbraw/zinc/39/59/66/331395966.db2.gz	FHPHJPKKOQIZEX-SFHVURJKSA-N	0	0	271.404	4.002	20	30		CIEDRN
CC#CCCCC(=O)N1CCCc2ccc(Cl)c(C)c21	ZINC000466421095	331396180	/nfs/dbraw/zinc/39/61/80/331396180.db2.gz	BTPQCRVLEZXHNR-UHFFFAOYSA-N	0	0	289.806	4.121	20	30		CIEDRN
CC#CCCCC(=O)N[C@H](CCC)c1ccc(F)cc1F	ZINC000466426488	331396592	/nfs/dbraw/zinc/39/65/92/331396592.db2.gz	RCWALGTVUTZJTD-MRXNPFEDSA-N	0	0	293.357	4.116	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H](CCC)c1ccc(F)cc1F	ZINC000466426487	331396667	/nfs/dbraw/zinc/39/66/67/331396667.db2.gz	RCWALGTVUTZJTD-INIZCTEOSA-N	0	0	293.357	4.116	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](c2ccc(Cl)cc2)C1	ZINC000466433121	331397028	/nfs/dbraw/zinc/39/70/28/331397028.db2.gz	ADEMKSYFNFFTFB-HIFRSBDPSA-N	0	0	291.822	4.258	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](c1ccccc1C)C1CC1	ZINC000466433687	331397035	/nfs/dbraw/zinc/39/70/35/331397035.db2.gz	FLVXMDZPMBYRBA-PBHICJAKSA-N	0	0	271.404	4.165	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NC[C@H]1CCC[C@@H](C(F)(F)F)C1	ZINC000466437436	331397140	/nfs/dbraw/zinc/39/71/40/331397140.db2.gz	BVDVMGNYNLDOKD-RWMBFGLXSA-N	0	0	291.357	4.074	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](C)Sc2ccccc21	ZINC000466440982	331397215	/nfs/dbraw/zinc/39/72/15/331397215.db2.gz	HPYRRMDYMCYLDT-CHWSQXEVSA-N	0	0	275.417	4.116	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H]1CCC[C@H]1Cc1ccccc1	ZINC000466444662	331397376	/nfs/dbraw/zinc/39/73/76/331397376.db2.gz	YJMLNPBCKFQQFN-SZMVWBNQSA-N	0	0	285.431	4.116	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NC[C@@H]1CCCC[C@@H]1C(F)(F)F	ZINC000466527847	331399049	/nfs/dbraw/zinc/39/90/49/331399049.db2.gz	FUJFWIZGIVCIID-AVGNSLFASA-N	0	0	291.357	4.074	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)[C@H](Sc1ccccc1)C(C)C	ZINC000466528019	331399050	/nfs/dbraw/zinc/39/90/50/331399050.db2.gz	GPCPGEWMQJDRME-GDBMZVCRSA-N	0	0	291.460	4.274	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)C(C)(C)c1ccccc1Cl	ZINC000466526190	331399129	/nfs/dbraw/zinc/39/91/29/331399129.db2.gz	CFRCUHYBWXYOLX-GFCCVEGCSA-N	0	0	279.811	4.089	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)[C@@H](c1ccc(F)cc1)C(C)C	ZINC000466534296	331399238	/nfs/dbraw/zinc/39/92/38/331399238.db2.gz	OOWAIPYXDYAPSV-HZPDHXFCSA-N	0	0	277.383	4.036	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)CCOc1ccc2ccccc2c1	ZINC000466535218	331399407	/nfs/dbraw/zinc/39/94/07/331399407.db2.gz	XOHBQAFFVIJNIF-KRWDZBQOSA-N	0	0	297.398	4.080	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Cc1coc2cc(C)c(C)cc12	ZINC000466540341	331399471	/nfs/dbraw/zinc/39/94/71/331399471.db2.gz	FEEYFAAYEFTTNR-OAHLLOKOSA-N	0	0	285.387	4.063	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@H](CC)CC1CCCC1	ZINC000466540246	331399531	/nfs/dbraw/zinc/39/95/31/331399531.db2.gz	JWEBTWKJDAALAT-CABCVRRESA-N	0	0	251.414	4.064	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)C(C)(C)c1cccc(Cl)c1F	ZINC000466546193	331399680	/nfs/dbraw/zinc/39/96/80/331399680.db2.gz	WBXYPIXCYDRBKX-LLVKDONJSA-N	0	0	297.801	4.228	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)C1(Cc2ccccc2Cl)CC1	ZINC000466545534	331399723	/nfs/dbraw/zinc/39/97/23/331399723.db2.gz	RMRILGVIDVDLGH-CQSZACIVSA-N	0	0	291.822	4.134	20	30		CIEDRN
C=CCCN(C)C(=O)c1ccc(C2CCCCC2)cc1	ZINC000466645853	331401574	/nfs/dbraw/zinc/40/15/74/331401574.db2.gz	AOIIHUSTINYDEV-UHFFFAOYSA-N	0	0	271.404	4.382	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H]1Cc1ccccc1C	ZINC000466662105	331401938	/nfs/dbraw/zinc/40/19/38/331401938.db2.gz	UWYYFMCSAKPBGZ-SJLPKXTDSA-N	0	0	285.431	4.131	20	30		CIEDRN
C[C@H]1CCC[C@@H]1CNC(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000466700785	331402554	/nfs/dbraw/zinc/40/25/54/331402554.db2.gz	VVSMCBBFPRHPHL-UONOGXRCSA-N	0	0	299.418	4.045	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCCc2cc(F)cc(C)c21	ZINC000466863869	331406690	/nfs/dbraw/zinc/40/66/90/331406690.db2.gz	QMTIEPRUPMJCED-CYBMUJFWSA-N	0	0	275.367	4.016	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@]1(CCC)C(F)(F)F	ZINC000466874171	331406955	/nfs/dbraw/zinc/40/69/55/331406955.db2.gz	NQGZGKIHXWIFGO-TZMCWYRMSA-N	0	0	291.357	4.312	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCc1ccc(C(F)(F)F)cc1C	ZINC000467025263	331410571	/nfs/dbraw/zinc/41/05/71/331410571.db2.gz	SDQZFYWVKWUARF-LBPRGKRZSA-N	0	0	299.336	4.232	20	30		CIEDRN
CCC(C)(C)CC(=O)Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000467097210	331411139	/nfs/dbraw/zinc/41/11/39/331411139.db2.gz	NQPZIYKHLAXIMW-UHFFFAOYSA-N	0	0	298.308	4.342	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(OCC)cc2C)CC1	ZINC000467103436	331411140	/nfs/dbraw/zinc/41/11/40/331411140.db2.gz	UJTGHDQKWLPKRX-UHFFFAOYSA-N	0	0	273.376	4.079	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H]1CCC(C)(C)C[C@@H]1C	ZINC000467371530	331416653	/nfs/dbraw/zinc/41/66/53/331416653.db2.gz	VKILCMORZDQAPT-DZGCQCFKSA-N	0	0	263.425	4.086	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N(C)Cc1c(F)cccc1Cl	ZINC000467427715	331418670	/nfs/dbraw/zinc/41/86/70/331418670.db2.gz	MVTBPQDEYIJPID-OAHLLOKOSA-N	0	0	283.774	4.040	20	30		CIEDRN
Cc1cccnc1[C@@H]1CCC[C@@H](Nc2cccc(C#N)c2)C1	ZINC000467429172	331418699	/nfs/dbraw/zinc/41/86/99/331418699.db2.gz	KVIHLFTXGBBPKX-SJLPKXTDSA-N	0	0	291.398	4.400	20	30		CIEDRN
C=C(C)CN(CC)C(=O)[C@@H]1CCC[C@H]2CCCC[C@@H]21	ZINC000505356652	331422845	/nfs/dbraw/zinc/42/28/45/331422845.db2.gz	YWYQYYHOBWFRLK-OWCLPIDISA-N	0	0	263.425	4.018	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1occc1-c1ccccc1	ZINC000467688370	331423145	/nfs/dbraw/zinc/42/31/45/331423145.db2.gz	LKXLQMIIBXXHKO-CQSZACIVSA-N	0	0	269.344	4.031	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1ccc2c3c(cccc31)CC2	ZINC000467682231	331423191	/nfs/dbraw/zinc/42/31/91/331423191.db2.gz	WQDTZPVEVLVSPQ-OAHLLOKOSA-N	0	0	279.383	4.023	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H](C)CCCC(C)C	ZINC000467733684	331423354	/nfs/dbraw/zinc/42/33/54/331423354.db2.gz	YJIMQGSJFWWKCH-AWEZNQCLSA-N	0	0	251.414	4.086	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H](c1ccc(C)cc1)C1CC1	ZINC000467748230	331423747	/nfs/dbraw/zinc/42/37/47/331423747.db2.gz	VHCQFQORTJLCAB-GOSISDBHSA-N	0	0	283.415	4.331	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cc(F)ccc1NC(C)C	ZINC000467757636	331423895	/nfs/dbraw/zinc/42/38/95/331423895.db2.gz	IIHJURIUDPEKJX-GFCCVEGCSA-N	0	0	278.371	4.187	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)[C@H](C)c1c(F)cccc1F	ZINC000467819098	331424344	/nfs/dbraw/zinc/42/43/44/331424344.db2.gz	LCJOJWGZLWCCPS-GFCCVEGCSA-N	0	0	293.357	4.253	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccsc1	ZINC000467942279	331425993	/nfs/dbraw/zinc/42/59/93/331425993.db2.gz	ICLCMWQTTKMIMQ-UHFFFAOYSA-N	0	0	286.400	4.358	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@@H]1CC(C)(C)c2ccccc21	ZINC000467987061	331426358	/nfs/dbraw/zinc/42/63/58/331426358.db2.gz	YMXPZMNSOWEYKW-QAPCUYQASA-N	0	0	271.404	4.128	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cc(SC)ccc1C	ZINC000467990290	331426383	/nfs/dbraw/zinc/42/63/83/331426383.db2.gz	KIDFEHXGQPZYRI-OAHLLOKOSA-N	0	0	263.406	4.258	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H](CC)c1ccc(F)cc1F	ZINC000467997550	331426476	/nfs/dbraw/zinc/42/64/76/331426476.db2.gz	CVGQBBMLPOYESU-GOEBONIOSA-N	0	0	281.346	4.134	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cccc(-c2ncc(C)o2)c1	ZINC000468005103	331426527	/nfs/dbraw/zinc/42/65/27/331426527.db2.gz	OGNDEYQDLBIRAW-QGZVFWFLSA-N	0	0	284.359	4.191	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H](C)C(C)(C)c1ccccc1	ZINC000468006979	331426607	/nfs/dbraw/zinc/42/66/07/331426607.db2.gz	SUXMJJDPXZUXAO-KBXCAEBGSA-N	0	0	273.420	4.071	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)NCc1ccc2ccccc2c1	ZINC000468013472	331426639	/nfs/dbraw/zinc/42/66/39/331426639.db2.gz	HASWTOXHGQMWKX-SFHVURJKSA-N	0	0	267.372	4.058	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)NCCc1cccc2ccccc21	ZINC000468032432	331427046	/nfs/dbraw/zinc/42/70/46/331427046.db2.gz	XCWJAOCOFACUEJ-IBGZPJMESA-N	0	0	281.399	4.101	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H](C)c1ccccc1C(F)(F)F	ZINC000468031599	331427094	/nfs/dbraw/zinc/42/70/94/331427094.db2.gz	RDBRPCNUUVAYIS-IAQYHMDHSA-N	0	0	299.336	4.485	20	30		CIEDRN
CC#CCCCC(=O)N(C)[C@@H](c1ccc(F)cc1)C(C)C	ZINC000468126648	331429068	/nfs/dbraw/zinc/42/90/68/331429068.db2.gz	LQSYTNQWZFCSDQ-GOSISDBHSA-N	0	0	289.394	4.175	20	30		CIEDRN
C=CCCCNC(=O)C1(c2cccc(Cl)c2)CCCC1	ZINC000468372229	331432968	/nfs/dbraw/zinc/43/29/68/331432968.db2.gz	KALPAUFMWPTXHI-UHFFFAOYSA-N	0	0	291.822	4.234	20	30		CIEDRN
C=CCCCNC(=O)C1c2ccccc2Oc2ccccc21	ZINC000468367776	331433010	/nfs/dbraw/zinc/43/30/10/331433010.db2.gz	KPOJXQVMKVDCTG-UHFFFAOYSA-N	0	0	293.366	4.007	20	30		CIEDRN
C=CCCCNC(=O)c1cccc(N[C@@H](C)C(C)C)c1C	ZINC000468389886	331433481	/nfs/dbraw/zinc/43/34/81/331433481.db2.gz	NORLTPWYTFRKTI-HNNXBMFYSA-N	0	0	288.435	4.147	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCCc2cccc(C)c21	ZINC000468545709	331436659	/nfs/dbraw/zinc/43/66/59/331436659.db2.gz	ZVMIQYIGQLGYNS-UHFFFAOYSA-N	0	0	269.388	4.043	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1c2ccccc2CC[C@H]1C	ZINC000468544800	331436688	/nfs/dbraw/zinc/43/66/88/331436688.db2.gz	UCGLFDIVQRCJAY-CQSZACIVSA-N	0	0	269.388	4.123	20	30		CIEDRN
COC(C)(C)CCSCc1ccc(Cl)cc1C#N	ZINC000468637041	331437992	/nfs/dbraw/zinc/43/79/92/331437992.db2.gz	CZFGPZYHVQUPDF-UHFFFAOYSA-N	0	0	283.824	4.260	20	30		CIEDRN
COc1cccc([C@@H](C)Sc2cccc(C#N)c2)c1	ZINC000468654660	331438364	/nfs/dbraw/zinc/43/83/64/331438364.db2.gz	AFHIYTXMCBDOPR-GFCCVEGCSA-N	0	0	269.369	4.420	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCCc2c(C)ccc(F)c21	ZINC000468720579	331438921	/nfs/dbraw/zinc/43/89/21/331438921.db2.gz	SFVNDRRIVUIKJK-UHFFFAOYSA-N	0	0	287.378	4.182	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCCc2c(F)ccc(C)c21	ZINC000468718414	331438958	/nfs/dbraw/zinc/43/89/58/331438958.db2.gz	WWRSDKWVKKRBEJ-UHFFFAOYSA-N	0	0	287.378	4.182	20	30		CIEDRN
COc1ccccc1CSCc1cc(F)ccc1C#N	ZINC000468892270	331441878	/nfs/dbraw/zinc/44/18/78/331441878.db2.gz	GIAYHVDMWBUDJF-UHFFFAOYSA-N	0	0	287.359	4.139	20	30		CIEDRN
CCC(CC)CC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1	ZINC000468909170	331442221	/nfs/dbraw/zinc/44/22/21/331442221.db2.gz	KWLNRJBPFQDJSV-MSOLQXFVSA-N	0	0	298.430	4.111	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)C[C@@H]1CC[C@H](C)C1	ZINC000469068059	331445177	/nfs/dbraw/zinc/44/51/77/331445177.db2.gz	VBFHSHGXOZNQMD-DOTOQJQBSA-N	0	0	271.404	4.028	20	30		CIEDRN
C=C(C)CN(C)C(=O)NC1CCC2(CCCCC2)CC1	ZINC000469101464	331445798	/nfs/dbraw/zinc/44/57/98/331445798.db2.gz	SICKBZLCYQTKMR-UHFFFAOYSA-N	0	0	278.440	4.097	20	30		CIEDRN
CCc1c(C)sc(NC(=O)C[C@H]2CC[C@@H](C)C2)c1C#N	ZINC000469476504	331452394	/nfs/dbraw/zinc/45/23/94/331452394.db2.gz	QPOYEKURASYQRN-PWSUYJOCSA-N	0	0	290.432	4.255	20	30		CIEDRN
CC(C)c1ccccc1NC(=O)c1ccc(F)c(C#N)c1	ZINC000469513519	331453547	/nfs/dbraw/zinc/45/35/47/331453547.db2.gz	JEDZYVSSYAZDKP-UHFFFAOYSA-N	0	0	282.318	4.073	20	30		CIEDRN
Cc1ccccc1[C@H](NC(=O)CC(C)(C)C#N)C(C)(C)C	ZINC000469530122	331453683	/nfs/dbraw/zinc/45/36/83/331453683.db2.gz	ZOAVYOASEVXHHC-INIZCTEOSA-N	0	0	286.419	4.138	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1ccc(Cl)cc1OCC	ZINC000469621024	331455246	/nfs/dbraw/zinc/45/52/46/331455246.db2.gz	LBFKPOTWLCJCIF-UHFFFAOYSA-N	0	0	296.798	4.169	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)Nc1cc(C)ccn1	ZINC000469901817	331464295	/nfs/dbraw/zinc/46/42/95/331464295.db2.gz	SHKCOATTZHQFDJ-UHFFFAOYSA-N	0	0	295.386	4.000	20	30		CIEDRN
CCN(CC#N)[C@H](C)c1ccc(-c2cccc(OC)c2)cc1	ZINC000470152784	331472736	/nfs/dbraw/zinc/47/27/36/331472736.db2.gz	OQMRJKGYRFNZTJ-OAHLLOKOSA-N	0	0	294.398	4.269	20	30		CIEDRN
CC(C)(C)C1CCC(C#N)(NC(=O)CCC2CCC2)CC1	ZINC000470187873	331474689	/nfs/dbraw/zinc/47/46/89/331474689.db2.gz	KMZOAUUXGNRQPJ-UHFFFAOYSA-N	0	0	290.451	4.182	20	30		CIEDRN
C=CCCC(=O)N[C@H](CC(C)C)c1ccccc1OCC	ZINC000470249171	331476548	/nfs/dbraw/zinc/47/65/48/331476548.db2.gz	WLHXZFFQAGBMOX-MRXNPFEDSA-N	0	0	289.419	4.255	20	30		CIEDRN
N#Cc1cnccc1/C=C/c1ccc(Cl)cc1Cl	ZINC000470278463	331477574	/nfs/dbraw/zinc/47/75/74/331477574.db2.gz	FIQOVUPJGMQVIU-OWOJBTEDSA-N	0	0	275.138	4.430	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)[C@H]2C[C@@]2(C)CC)CCCC1(C)C	ZINC000470277386	331477575	/nfs/dbraw/zinc/47/75/75/331477575.db2.gz	AJUPDDXTXUHAMV-JKIFEVAISA-N	0	0	263.425	4.016	20	30		CIEDRN
N#Cc1cnccc1/C=C\c1cccc(OC2CCCC2)c1	ZINC000470283745	331477857	/nfs/dbraw/zinc/47/78/57/331477857.db2.gz	FKSCKJLBAGHFCN-HJWRWDBZSA-N	0	0	290.366	4.445	20	30		CIEDRN
C=CC[C@H]1N(C(=O)[C@H](C)c2ccsc2)CCCC1(C)C	ZINC000470284811	331477869	/nfs/dbraw/zinc/47/78/69/331477869.db2.gz	ISTRGQFGQWIXBG-UKRRQHHQSA-N	0	0	291.460	4.445	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)c2cc3ccccc3[nH]2)CCCC1(C)C	ZINC000470297673	331478498	/nfs/dbraw/zinc/47/84/98/331478498.db2.gz	NGSLWIVWFCOKQD-KRWDZBQOSA-N	0	0	296.414	4.375	20	30		CIEDRN
C=CC[C@@H](C(=O)NCc1cscc1C)c1ccccc1	ZINC000470447727	331482775	/nfs/dbraw/zinc/48/27/75/331482775.db2.gz	DNIVHMHPFRARJM-MRXNPFEDSA-N	0	0	285.412	4.033	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)Cc1ccc(C)s1	ZINC000470636978	331486552	/nfs/dbraw/zinc/48/65/52/331486552.db2.gz	PCJYRVDXEBGUGA-UHFFFAOYSA-N	0	0	299.439	4.204	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)Cc1ccsc1C	ZINC000470644863	331486775	/nfs/dbraw/zinc/48/67/75/331486775.db2.gz	ROUJKWRPTLHHRK-UHFFFAOYSA-N	0	0	299.439	4.204	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)c1ccc(C)cc1	ZINC000470642397	331486780	/nfs/dbraw/zinc/48/67/80/331486780.db2.gz	ATFRRTZPYVFSSD-UHFFFAOYSA-N	0	0	279.383	4.214	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)[C@@H](C)[C@@H](C)CC	ZINC000470650012	331486866	/nfs/dbraw/zinc/48/68/66/331486866.db2.gz	ZGQXYHVGPSTBSG-HOTGVXAUSA-N	0	0	273.420	4.274	20	30		CIEDRN
CCO[C@@H](CCNc1c(Cl)cccc1C#N)C(C)C	ZINC000470869641	331493149	/nfs/dbraw/zinc/49/31/49/331493149.db2.gz	IBPVCERMJUSHQV-AWEZNQCLSA-N	0	0	280.799	4.075	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)CC1(C)CCCCC1	ZINC000471171619	331503293	/nfs/dbraw/zinc/50/32/93/331503293.db2.gz	AJTYMIWHVULTIT-UHFFFAOYSA-N	0	0	278.440	4.278	20	30		CIEDRN
C=CCCN(C)C(=O)c1cccc(NCC(C)(C)C)c1C	ZINC000471358868	331507328	/nfs/dbraw/zinc/50/73/28/331507328.db2.gz	SOTCNIBQHCHTRC-UHFFFAOYSA-N	0	0	288.435	4.101	20	30		CIEDRN
C=CCCCCNC(=O)c1cc(SC)ccc1Cl	ZINC000471670030	331514555	/nfs/dbraw/zinc/51/45/55/331514555.db2.gz	YKIOIOJBTADMFN-UHFFFAOYSA-N	0	0	283.824	4.148	20	30		CIEDRN
C=CCCCCNC(=O)C[C@@H](c1ccccc1)C(F)(F)F	ZINC000471683027	331515487	/nfs/dbraw/zinc/51/54/87/331515487.db2.gz	PAYDJBMSKLUKEW-AWEZNQCLSA-N	0	0	299.336	4.195	20	30		CIEDRN
C=CCCCCNC(=O)CCC(C)(C)c1ccccc1	ZINC000471699210	331516349	/nfs/dbraw/zinc/51/63/49/331516349.db2.gz	VPLPEZNKIMWMHP-UHFFFAOYSA-N	0	0	273.420	4.217	20	30		CIEDRN
CSc1cccc(C)c1NCCOc1ccc(C#N)cc1	ZINC000471960703	331524835	/nfs/dbraw/zinc/52/48/35/331524835.db2.gz	KJDYTKJSJOOTPO-UHFFFAOYSA-N	0	0	298.411	4.080	20	30		CIEDRN
Cc1ccc2[nH]c(CNc3ccc(CC#N)cc3)cc2c1C	ZINC000472058555	331527833	/nfs/dbraw/zinc/52/78/33/331527833.db2.gz	QFIZIKXBZQWASL-UHFFFAOYSA-N	0	0	289.382	4.463	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](C)CSc1ccc(C)cc1	ZINC000472250003	331533668	/nfs/dbraw/zinc/53/36/68/331533668.db2.gz	GMVDRGREWJTDQN-HUUCEWRRSA-N	0	0	291.460	4.194	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC)c1ccc2[nH]ccc2c1	ZINC000472303331	331535252	/nfs/dbraw/zinc/53/52/52/331535252.db2.gz	ZSKIBIYGLWKMBC-UHFFFAOYSA-N	0	0	282.387	4.289	20	30		CIEDRN
C=CCCCCNC(=O)N1CCC[C@@H]1c1cccc(F)c1	ZINC000472830461	331543905	/nfs/dbraw/zinc/54/39/05/331543905.db2.gz	JGCUTGBBDBQECL-MRXNPFEDSA-N	0	0	290.382	4.029	20	30		CIEDRN
C=CCCCCNC(=O)N(CCC)CCc1cccs1	ZINC000472849646	331544499	/nfs/dbraw/zinc/54/44/99/331544499.db2.gz	LSADQIURRFARQV-UHFFFAOYSA-N	0	0	294.464	4.069	20	30		CIEDRN
C=CCCCCNC(=O)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000472854384	331544783	/nfs/dbraw/zinc/54/47/83/331544783.db2.gz	SCFMZGVLRFBHLM-HWOXTHGCSA-N	0	0	298.430	4.230	20	30		CIEDRN
C=CCCCCNC(=O)N1CCC[C@H]1c1cccc(C)c1	ZINC000472866088	331544971	/nfs/dbraw/zinc/54/49/71/331544971.db2.gz	QURQLVXXHYDWQD-KRWDZBQOSA-N	0	0	286.419	4.198	20	30		CIEDRN
CC1(C)CCCN(Cc2ccccc2C(F)(F)F)[C@@H]1C#N	ZINC000510754028	332915597	/nfs/dbraw/zinc/91/55/97/332915597.db2.gz	VMBFNOJMQDBPHG-CQSZACIVSA-N	0	0	296.336	4.220	20	30		CIEDRN
Cc1ccc2[nH]c(CN(CC#N)C3CCCC3)cc2c1C	ZINC000473134237	331548327	/nfs/dbraw/zinc/54/83/27/331548327.db2.gz	WTBFCBJPUPYXPP-UHFFFAOYSA-N	0	0	281.403	4.053	20	30		CIEDRN
CCC[C@]1(C)CCCN(C(=O)Nc2cc(C#N)ccc2C)C1	ZINC000473364088	331550682	/nfs/dbraw/zinc/55/06/82/331550682.db2.gz	ZDURWDXRUGBIDC-GOSISDBHSA-N	0	0	299.418	4.301	20	30		CIEDRN
CCC(CC)[C@@H](c1ccc(Cl)cc1)N(C)C(=O)CC#N	ZINC000473468494	331551987	/nfs/dbraw/zinc/55/19/87/331551987.db2.gz	FKMJUPJCJBDKQD-INIZCTEOSA-N	0	0	292.810	4.189	20	30		CIEDRN
C=CCCCCNC(=O)Nc1c(C)cc(C)cc1C	ZINC000473501131	331552117	/nfs/dbraw/zinc/55/21/17/331552117.db2.gz	ANPAVLYNLLNMBE-UHFFFAOYSA-N	0	0	260.381	4.090	20	30		CIEDRN
CC(C)(C)OCCCCNc1ccc(C#N)cc1Cl	ZINC000473667658	331554803	/nfs/dbraw/zinc/55/48/03/331554803.db2.gz	UIHXJIFYLCNMNS-UHFFFAOYSA-N	0	0	280.799	4.219	20	30		CIEDRN
C=CCCCCNC(=O)Nc1ccc(C(C)=O)c(Cl)c1	ZINC000473761992	331556333	/nfs/dbraw/zinc/55/63/33/331556333.db2.gz	GYPMLYWCRSRMDV-UHFFFAOYSA-N	0	0	294.782	4.020	20	30		CIEDRN
CC(C)(C)OCCCCSCc1ccccc1C#N	ZINC000473791975	331557996	/nfs/dbraw/zinc/55/79/96/331557996.db2.gz	KQNDWFIVOJQJHK-UHFFFAOYSA-N	0	0	277.433	4.387	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@](C)(CCC)C1	ZINC000473895625	331559740	/nfs/dbraw/zinc/55/97/40/331559740.db2.gz	POUVQKUKBPMQSY-CVEARBPZSA-N	0	0	251.414	4.018	20	30		CIEDRN
C=CCCCCNC(=O)N1CCCCC[C@H]1c1ccco1	ZINC000474090061	331569477	/nfs/dbraw/zinc/56/94/77/331569477.db2.gz	RCVYXAFOIOQVJX-HNNXBMFYSA-N	0	0	290.407	4.263	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cnn(CC(C)C)c1C(C)C	ZINC000474156083	331573641	/nfs/dbraw/zinc/57/36/41/331573641.db2.gz	YDDCHKDDTNPLLK-KRWDZBQOSA-N	0	0	291.439	4.203	20	30		CIEDRN
CCN(C(=O)[C@@H]1CC12CCCC2)[C@H](C)c1ccc(C#N)cc1	ZINC000474362065	331581963	/nfs/dbraw/zinc/58/19/63/331581963.db2.gz	LXQXLYFXWPSILD-PBHICJAKSA-N	0	0	296.414	4.048	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)[C@@H]2CC23CCCC3)c1	ZINC000474404200	331584624	/nfs/dbraw/zinc/58/46/24/331584624.db2.gz	UXVMPKKQXBKLJD-INIZCTEOSA-N	0	0	285.387	4.160	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(C)c3ncccc23)CC1	ZINC000474593997	331590903	/nfs/dbraw/zinc/59/09/03/331590903.db2.gz	LVIMBEOZELJAMW-UHFFFAOYSA-N	0	0	280.371	4.228	20	30		CIEDRN
C=CCOc1ccccc1C(=O)N1CCCC2(CCCC2)C1	ZINC000474618065	331592072	/nfs/dbraw/zinc/59/20/72/331592072.db2.gz	NQUDBSUFUMHWQV-UHFFFAOYSA-N	0	0	299.414	4.048	20	30		CIEDRN
CC[C@H]1CCCC[C@H]1NC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000474784328	331598054	/nfs/dbraw/zinc/59/80/54/331598054.db2.gz	KNFFCODEJFUWBV-WMLDXEAASA-N	0	0	298.430	4.186	20	30		CIEDRN
N#Cc1ccc(Cl)cc1Oc1nc2ccccc2o1	ZINC000474789152	331598097	/nfs/dbraw/zinc/59/80/97/331598097.db2.gz	DLCJTEHGWHOQBG-UHFFFAOYSA-N	0	0	270.675	4.145	20	30		CIEDRN
CC[C@@H]1CCCC[C@@H]1NC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000474785903	331598145	/nfs/dbraw/zinc/59/81/45/331598145.db2.gz	WBCWEBJSEMCDSL-NXHRZFHOSA-N	0	0	298.430	4.159	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCc2c(cccc2C(C)C)C1	ZINC000475041361	331610543	/nfs/dbraw/zinc/61/05/43/331610543.db2.gz	FOJUPSUPAASUHT-UHFFFAOYSA-N	0	0	297.442	4.463	20	30		CIEDRN
C=CCC[C@H](CC)Nc1cccc(-n2cc(C)[nH]c2=O)c1	ZINC000475510915	331634652	/nfs/dbraw/zinc/63/46/52/331634652.db2.gz	KEIPQWLJTAPRGE-AWEZNQCLSA-N	0	0	285.391	4.043	20	30		CIEDRN
C=CCCC1(C(=O)NCC(C)(C)c2ccc(C)cc2)CC1	ZINC000475597897	331639170	/nfs/dbraw/zinc/63/91/70/331639170.db2.gz	YWJTVNMUOCFPDV-UHFFFAOYSA-N	0	0	285.431	4.135	20	30		CIEDRN
C[C@H](CNc1ccc(C#N)cc1C(F)(F)F)C(F)(F)F	ZINC000475733101	331643834	/nfs/dbraw/zinc/64/38/34/331643834.db2.gz	JPIKDRBUWKLBTP-SSDOTTSWSA-N	0	0	296.214	4.187	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)C[C@@H]1CCC[C@@H](C)C1	ZINC000475742468	331644562	/nfs/dbraw/zinc/64/45/62/331644562.db2.gz	QMOJJYKDSFUZOQ-HUUCEWRRSA-N	0	0	278.440	4.182	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)[C@H](C)CC1CCCC1	ZINC000475743682	331644585	/nfs/dbraw/zinc/64/45/85/331644585.db2.gz	JVLNVPDZUSTHKX-CQSZACIVSA-N	0	0	278.440	4.182	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000475814196	331645528	/nfs/dbraw/zinc/64/55/28/331645528.db2.gz	LONFTSQVSXSLGB-OFAUBZDOSA-N	0	0	283.415	4.293	20	30		CIEDRN
CCCC1CCC(NC(=O)Nc2ccc(CC#N)cc2)CC1	ZINC000510945209	332921388	/nfs/dbraw/zinc/92/13/88/332921388.db2.gz	IBIBRIIAHDSCPB-UHFFFAOYSA-N	0	0	299.418	4.233	20	30		CIEDRN
C=CCOCCCSCc1ccccc1Cl	ZINC000475883632	331647510	/nfs/dbraw/zinc/64/75/10/331647510.db2.gz	SMSONDBCRDBLLO-UHFFFAOYSA-N	0	0	256.798	4.166	20	30		CIEDRN
C[C@@H]1CCC[C@H](C)[C@H]1NC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000476044001	331651854	/nfs/dbraw/zinc/65/18/54/331651854.db2.gz	NOOKPHQLSMVVRG-HALDLXJZSA-N	0	0	298.430	4.042	20	30		CIEDRN
C[C@@H]1CCC[C@@H](C)C1NC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000476044003	331651911	/nfs/dbraw/zinc/65/19/11/331651911.db2.gz	NOOKPHQLSMVVRG-ZIAGYGMSSA-N	0	0	298.430	4.042	20	30		CIEDRN
C=CCCC1(C(=O)N2C[C@H](c3ccccc3)C[C@@H]2C)CC1	ZINC000476044541	331652016	/nfs/dbraw/zinc/65/20/16/331652016.db2.gz	OJKPMKCLAAXBFH-DOTOQJQBSA-N	0	0	283.415	4.137	20	30		CIEDRN
CC[C@@]1(C)CCCN(C(=O)c2ccc(C(C)(C)C#N)cc2)C1	ZINC000476202781	331657216	/nfs/dbraw/zinc/65/72/16/331657216.db2.gz	SBNKSHATEBVBHC-IBGZPJMESA-N	0	0	298.430	4.140	20	30		CIEDRN
C=CCCC1(C(=O)N[C@H](C)c2c(F)cccc2Cl)CC1	ZINC000476252302	331658584	/nfs/dbraw/zinc/65/85/84/331658584.db2.gz	VECQAHDKNONFHQ-LLVKDONJSA-N	0	0	295.785	4.403	20	30		CIEDRN
CC(C)CC1(CNC(=O)c2ccc(C(C)(C)C#N)cc2)CC1	ZINC000476281806	331659825	/nfs/dbraw/zinc/65/98/25/331659825.db2.gz	YYTGRWOQQWXKBY-UHFFFAOYSA-N	0	0	298.430	4.044	20	30		CIEDRN
C=CCC[C@H](NC(=O)[C@H]1C[C@@H]1C(C)C)c1ccccc1	ZINC000476283374	331659856	/nfs/dbraw/zinc/65/98/56/331659856.db2.gz	HECIMZPRCPQQBI-IKGGRYGDSA-N	0	0	271.404	4.102	20	30		CIEDRN
C=CCCCCNC(=O)C(C)(C)c1cccc(Cl)c1F	ZINC000476304165	331660676	/nfs/dbraw/zinc/66/06/76/331660676.db2.gz	MNWYBZDYSZNSOW-UHFFFAOYSA-N	0	0	297.801	4.229	20	30		CIEDRN
C=CCCC1(C(=O)N2C[C@H](c3ccccc3)C(C)(C)C2)CC1	ZINC000476426114	331663893	/nfs/dbraw/zinc/66/38/93/331663893.db2.gz	XBKBHXSKDGGMDX-QGZVFWFLSA-N	0	0	297.442	4.385	20	30		CIEDRN
N#Cc1cccnc1N[C@@H]1CCCC[C@H]1Cc1ccccc1	ZINC000476493560	331665150	/nfs/dbraw/zinc/66/51/50/331665150.db2.gz	LKEBGWPGRZHTHG-FUHWJXTLSA-N	0	0	291.398	4.167	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1c(C)c(F)ccc1Cl	ZINC000476551875	331666433	/nfs/dbraw/zinc/66/64/33/331666433.db2.gz	ZEIDODJJGRPRGQ-SNVBAGLBSA-N	0	0	283.774	4.262	20	30		CIEDRN
C=CCCC1(C(=O)NCc2cccc(C(C)C)c2)CC1	ZINC000476758491	331669607	/nfs/dbraw/zinc/66/96/07/331669607.db2.gz	JKPPOEAGVRLSCE-UHFFFAOYSA-N	0	0	271.404	4.173	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cccc(C(C)(F)F)c2)CC1	ZINC000476884812	331670437	/nfs/dbraw/zinc/67/04/37/331670437.db2.gz	SCSDIPWQCGYWJT-UHFFFAOYSA-N	0	0	279.330	4.483	20	30		CIEDRN
CC1(C)CCC[C@H](NC(=O)C[C@@H](CC#N)c2ccccc2)C1	ZINC000476927702	331671353	/nfs/dbraw/zinc/67/13/53/331671353.db2.gz	XHGJWCGZNZNVRU-SJORKVTESA-N	0	0	298.430	4.159	20	30		CIEDRN
C=C(C)CS[C@H](C)C(=O)N[C@@H](C)c1ccc(Cl)cc1	ZINC000477009841	331672624	/nfs/dbraw/zinc/67/26/24/331672624.db2.gz	LLKZPGUDYRXCMY-NWDGAFQWSA-N	0	0	297.851	4.215	20	30		CIEDRN
C=C(C)CS[C@H](C)C(=O)N[C@H](C)c1ccc(Cl)cc1	ZINC000477009844	331672629	/nfs/dbraw/zinc/67/26/29/331672629.db2.gz	LLKZPGUDYRXCMY-VXGBXAGGSA-N	0	0	297.851	4.215	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N(CC)C[C@@H](CC)c1ccccc1	ZINC000477037823	331673659	/nfs/dbraw/zinc/67/36/59/331673659.db2.gz	XBXFVNBXWQELNO-HZPDHXFCSA-N	0	0	288.435	4.176	20	30		CIEDRN
C=CCC1(C(=O)N2CCC(CCC(C)C)CC2)CCC1	ZINC000477828599	331690841	/nfs/dbraw/zinc/69/08/41/331690841.db2.gz	SPSUIQFTRYRICW-UHFFFAOYSA-N	0	0	277.452	4.408	20	30		CIEDRN
C[C@@H](SCc1ccc2c(c1)OCO2)c1ccc(C#N)cc1	ZINC000478758549	331713561	/nfs/dbraw/zinc/71/35/61/331713561.db2.gz	KZKOFOFILLXSMU-GFCCVEGCSA-N	0	0	297.379	4.281	20	30		CIEDRN
CC(C)Oc1ccc(O[C@@H](C)c2cccc(C#N)c2)cc1	ZINC000478779728	331713788	/nfs/dbraw/zinc/71/37/88/331713788.db2.gz	KLMNCPKGCGQFMG-AWEZNQCLSA-N	0	0	281.355	4.485	20	30		CIEDRN
CC(=O)c1ccc(C)cc1OCc1ccc(Cl)cc1C#N	ZINC000478937695	331717399	/nfs/dbraw/zinc/71/73/99/331717399.db2.gz	OCMZJRUHBOJODP-UHFFFAOYSA-N	0	0	299.757	4.302	20	30		CIEDRN
C=CCC1(C(=O)NCC(C)(C)Cc2ccccc2)CCC1	ZINC000479097868	331720293	/nfs/dbraw/zinc/72/02/93/331720293.db2.gz	OUVCJGYLRGQFCP-UHFFFAOYSA-N	0	0	285.431	4.118	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1ccc(-c2ccc(CC)cc2)o1	ZINC000479254981	331723009	/nfs/dbraw/zinc/72/30/09/331723009.db2.gz	XBJFLUFLZVRWHT-UHFFFAOYSA-N	0	0	283.371	4.157	20	30		CIEDRN
C=C(C)CN(C)C(=O)C1(c2cccc(F)c2)CCCCC1	ZINC000479273436	331723229	/nfs/dbraw/zinc/72/32/29/331723229.db2.gz	CZCKMHQOZMDJFO-UHFFFAOYSA-N	0	0	289.394	4.062	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1ccccc1CCc1ccccc1	ZINC000479313318	331724511	/nfs/dbraw/zinc/72/45/11/331724511.db2.gz	USTKIWWCVRDUMP-UHFFFAOYSA-N	0	0	293.410	4.120	20	30		CIEDRN
CC(C)Oc1cc(F)ccc1OCc1ccc(C#N)cc1	ZINC000479420571	331728477	/nfs/dbraw/zinc/72/84/77/331728477.db2.gz	XJLCPCNGCZXQPL-UHFFFAOYSA-N	0	0	285.318	4.064	20	30		CIEDRN
CC(C)Oc1cc(F)ccc1OCc1ccccc1C#N	ZINC000479427263	331728862	/nfs/dbraw/zinc/72/88/62/331728862.db2.gz	SNQHCNFYRDIJDP-UHFFFAOYSA-N	0	0	285.318	4.064	20	30		CIEDRN
CC[C@H]1CC[C@H](NC(=O)c2ccc(C(C)(C)C#N)cc2)CC1	ZINC000479443114	331729955	/nfs/dbraw/zinc/72/99/55/331729955.db2.gz	FWMVLZKQNBEJDX-CZIWCDLHSA-N	0	0	298.430	4.186	20	30		CIEDRN
CSc1ccc(C)c(NCc2ccc(C#N)c(F)c2)c1	ZINC000479480761	331732503	/nfs/dbraw/zinc/73/25/03/331732503.db2.gz	PKYSMKKKNOBZNA-UHFFFAOYSA-N	0	0	286.375	4.340	20	30		CIEDRN
C=CCN(CC=C)Cc1csc(-c2ccccc2F)n1	ZINC000479576915	331738539	/nfs/dbraw/zinc/73/85/39/331738539.db2.gz	HIVJUNOAGNIAHJ-UHFFFAOYSA-N	0	0	288.391	4.123	20	30		CIEDRN
C=CCCCC(=O)N(CC)[C@@H](C)c1ccc(F)cc1	ZINC000479603449	331740129	/nfs/dbraw/zinc/74/01/29/331740129.db2.gz	JFOGSGMNKVMUEB-ZDUSSCGKSA-N	0	0	263.356	4.092	20	30		CIEDRN
C[C@@H](S[C@@H](C)C(=O)OC(C)(C)C)c1cccc(C#N)c1	ZINC000479721736	331744448	/nfs/dbraw/zinc/74/44/48/331744448.db2.gz	QXECQXNFZUVXPW-NEPJUHHUSA-N	0	0	291.416	4.083	20	30		CIEDRN
C=CCOc1cccc(NC(=O)c2ccoc2C(C)C)c1	ZINC000479792834	331746035	/nfs/dbraw/zinc/74/60/35/331746035.db2.gz	ABUTUFAUSJECRG-UHFFFAOYSA-N	0	0	285.343	4.220	20	30		CIEDRN
CCC[C@@H](CC)[S@@](=O)CCCCC(C)(C)C#N	ZINC000479886695	331750965	/nfs/dbraw/zinc/75/09/65/331750965.db2.gz	QMPCIPYMDIMMJJ-DYVFJYSZSA-N	0	0	257.443	4.034	20	30		CIEDRN
Cc1cccc2nc(Oc3ccc(C#N)cc3F)sc21	ZINC000480086017	331757584	/nfs/dbraw/zinc/75/75/84/331757584.db2.gz	VYBKVCDVVNVRHO-UHFFFAOYSA-N	0	0	284.315	4.408	20	30		CIEDRN
C=CCCCSCCC(=O)Nc1ccccc1OCC	ZINC000480384677	331770972	/nfs/dbraw/zinc/77/09/72/331770972.db2.gz	DLGZGSCOTDPWJC-UHFFFAOYSA-N	0	0	293.432	4.113	20	30		CIEDRN
C=CCC1(C(=O)N[C@H]2CC[C@@H](Cc3ccccc3)C2)CCC1	ZINC000480531123	331776160	/nfs/dbraw/zinc/77/61/60/331776160.db2.gz	SBYYZLBAWQEOMK-ROUUACIJSA-N	0	0	297.442	4.260	20	30		CIEDRN
C=CCCCC(=O)N(C)c1cc(Cl)cc(Cl)c1	ZINC000480847641	331789751	/nfs/dbraw/zinc/78/97/51/331789751.db2.gz	WGUOLPDGFMLEBM-UHFFFAOYSA-N	0	0	272.175	4.313	20	30		CIEDRN
CCC[C@@H](CC)Sc1ccc([N+](=O)[O-])cc1C#N	ZINC000480843481	331789771	/nfs/dbraw/zinc/78/97/71/331789771.db2.gz	MSYDTYANCXJEIW-GFCCVEGCSA-N	0	0	264.350	4.137	20	30		CIEDRN
C=CCCCC(=O)N(C1CC1)[C@H]1CCCc2ccccc21	ZINC000480891592	331790777	/nfs/dbraw/zinc/79/07/77/331790777.db2.gz	WJTUHUGWXKEURI-SFHVURJKSA-N	0	0	283.415	4.411	20	30		CIEDRN
Cc1c(C#N)cccc1-c1nc(-c2ccc(Cl)cc2)no1	ZINC000511171501	332929060	/nfs/dbraw/zinc/92/90/60/332929060.db2.gz	RQVKRLGQKKUAOC-UHFFFAOYSA-N	0	0	295.729	4.237	20	30		CIEDRN
CC(C)(NCc1ccc(Cl)cc1C#N)c1cccs1	ZINC000481009464	331794574	/nfs/dbraw/zinc/79/45/74/331794574.db2.gz	BGXKVKMJXHJDRS-UHFFFAOYSA-N	0	0	290.819	4.298	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1csc2cc(C)ccc21	ZINC000481132312	331798873	/nfs/dbraw/zinc/79/88/73/331798873.db2.gz	APTWJMWRQLLOIA-ZDUSSCGKSA-N	0	0	285.412	4.390	20	30		CIEDRN
C=CCn1c(SCC2CCC2)nnc1-c1ccccc1C	ZINC000481374115	331805227	/nfs/dbraw/zinc/80/52/27/331805227.db2.gz	OKFVSCIVTQQZHN-UHFFFAOYSA-N	0	0	299.443	4.332	20	30		CIEDRN
CCC(CC)N(CC(C)C)C(=O)Nc1cccc(C#N)c1	ZINC000481749897	331815041	/nfs/dbraw/zinc/81/50/41/331815041.db2.gz	YDZWRWIGJGDNSX-UHFFFAOYSA-N	0	0	287.407	4.237	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)CCC(C)C	ZINC000303442893	332930761	/nfs/dbraw/zinc/93/07/61/332930761.db2.gz	IAWYFVJEQCCSTM-UHFFFAOYSA-N	0	0	251.414	4.018	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)C1(C#N)CCCCC1	ZINC000482910763	331852134	/nfs/dbraw/zinc/85/21/34/331852134.db2.gz	KFABBHQGUIBQCE-UHFFFAOYSA-N	0	0	288.435	4.055	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)C(C)(C)CC	ZINC000482935823	331852510	/nfs/dbraw/zinc/85/25/10/331852510.db2.gz	MTDBJLVZTSINKS-UHFFFAOYSA-N	0	0	251.414	4.018	20	30		CIEDRN
CC[C@@H]1CCCC[C@@H]1C(=O)Nc1sc(C)c(C)c1C#N	ZINC000483075481	331857110	/nfs/dbraw/zinc/85/71/10/331857110.db2.gz	PIZKVHCZUOYESO-OLZOCXBDSA-N	0	0	290.432	4.392	20	30		CIEDRN
C=CCCC1(C(=O)N2CC[C@@H](C)c3ccccc32)CC1	ZINC000483295155	331867825	/nfs/dbraw/zinc/86/78/25/331867825.db2.gz	PJYXBLHGGUXNNE-CQSZACIVSA-N	0	0	269.388	4.273	20	30		CIEDRN
CC[C@H](C)CN(CC)C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000483821528	331885463	/nfs/dbraw/zinc/88/54/63/331885463.db2.gz	NCRFTLGWTWZFAX-NSHDSACASA-N	0	0	293.798	4.112	20	30		CIEDRN
CCCN(C(=O)C[C@H](CC#N)c1ccccc1)C(C)(C)C	ZINC000483828708	331885481	/nfs/dbraw/zinc/88/54/81/331885481.db2.gz	ANUHVPDNOWLPEE-INIZCTEOSA-N	0	0	286.419	4.111	20	30		CIEDRN
CC[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(C#N)cc1Cl	ZINC000483874253	331888335	/nfs/dbraw/zinc/88/83/35/331888335.db2.gz	VBAVWPMSUYCCGG-OLZOCXBDSA-N	0	0	290.794	4.367	20	30		CIEDRN
CCC[C@](C)(CC)C(=O)N[C@@H](C#N)c1ccccc1Cl	ZINC000483986745	331891060	/nfs/dbraw/zinc/89/10/60/331891060.db2.gz	XDPLCQWGZSRFKR-HOCLYGCPSA-N	0	0	292.810	4.237	20	30		CIEDRN
C=CCC1(C(=O)Nc2cc(-c3ccccc3)ns2)CCC1	ZINC000484346380	331897314	/nfs/dbraw/zinc/89/73/14/331897314.db2.gz	ZOUKFXJMYBPBRM-UHFFFAOYSA-N	0	0	298.411	4.495	20	30		CIEDRN
CC(C)c1ccc([C@@H](C)CC(=O)N[C@]2(C#N)CC2(C)C)cc1	ZINC000484916892	331907211	/nfs/dbraw/zinc/90/72/11/331907211.db2.gz	GIVBLVWAUJCNES-LIRRHRJNSA-N	0	0	298.430	4.112	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(c1ccccc1OC)C(C)C	ZINC000484909415	331907229	/nfs/dbraw/zinc/90/72/29/331907229.db2.gz	NADUDVKRXHCESV-CQSZACIVSA-N	0	0	275.392	4.039	20	30		CIEDRN
N#CCc1ccc(NCCc2cccc(Cl)c2)cc1	ZINC000485224472	331910804	/nfs/dbraw/zinc/91/08/04/331910804.db2.gz	ZZHMFZQAORUVOR-UHFFFAOYSA-N	0	0	270.763	4.061	20	30		CIEDRN
C=CCCC(=O)N1C[C@H](c2ccccc2)[C@@H]2CCCC[C@H]21	ZINC000485560833	331916736	/nfs/dbraw/zinc/91/67/36/331916736.db2.gz	RBRMLLNKYSGRNW-RCCFBDPRSA-N	0	0	283.415	4.137	20	30		CIEDRN
C[C@@H]1C[C@@H](CSCCCCC(C)(C)C#N)CCO1	ZINC000485575773	331917636	/nfs/dbraw/zinc/91/76/36/331917636.db2.gz	YAPGPYMEHMKGDH-KGLIPLIRSA-N	0	0	269.454	4.255	20	30		CIEDRN
N#Cc1cccnc1/C=C/c1csc(-c2ccsc2)n1	ZINC000485977492	331928441	/nfs/dbraw/zinc/92/84/41/331928441.db2.gz	APIRDWJELLMFEG-ONEGZZNKSA-N	0	0	295.392	4.309	20	30		CIEDRN
Cc1ccc([C@@H]2CCCN2c2ccc(Cl)c(C#N)n2)cc1	ZINC000486163706	331932677	/nfs/dbraw/zinc/93/26/77/331932677.db2.gz	JKJRMEXXYBLKHO-INIZCTEOSA-N	0	0	297.789	4.257	20	30		CIEDRN
CC(C)COc1ccccc1NCc1cc(C#N)ccc1F	ZINC000486166009	331932691	/nfs/dbraw/zinc/93/26/91/331932691.db2.gz	OPDCDMAMULXOMN-UHFFFAOYSA-N	0	0	298.361	4.344	20	30		CIEDRN
Cc1cc(OCc2ccc(C#N)cc2F)c2ccccc2n1	ZINC000486207666	331933327	/nfs/dbraw/zinc/93/33/27/331933327.db2.gz	XPWXLYHWLQXKMI-UHFFFAOYSA-N	0	0	292.313	4.133	20	30		CIEDRN
N#Cc1ccc(N2CCC[C@@H]2c2ccc(F)cc2)c(F)c1	ZINC000486449773	331937531	/nfs/dbraw/zinc/93/75/31/331937531.db2.gz	URZLUYYIURVWDX-MRXNPFEDSA-N	0	0	284.309	4.178	20	30		CIEDRN
CC#CCCCC(=O)N(CC(C)(C)C)c1ccccc1	ZINC000486602163	331940376	/nfs/dbraw/zinc/94/03/76/331940376.db2.gz	KAYHIMFGWAHVBZ-UHFFFAOYSA-N	0	0	271.404	4.259	20	30		CIEDRN
CCCN(CC1CCCCC1)C(=O)c1ccc(C#N)s1	ZINC000486670912	331941349	/nfs/dbraw/zinc/94/13/49/331941349.db2.gz	GUXUTKRVVSMFHW-UHFFFAOYSA-N	0	0	290.432	4.052	20	30		CIEDRN
N#Cc1ccc(OCc2cc3ccccc3o2)c(F)c1	ZINC000486682614	331941558	/nfs/dbraw/zinc/94/15/58/331941558.db2.gz	MWKNBDQNDKUOJT-UHFFFAOYSA-N	0	0	267.259	4.023	20	30		CIEDRN
Cc1ccc(OCc2ccccc2C(C)(C)C#N)cc1	ZINC000486881927	331948199	/nfs/dbraw/zinc/94/81/99/331948199.db2.gz	FAJIGDNEAFHEBF-UHFFFAOYSA-N	0	0	265.356	4.375	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)[C@@H](c1cccc(Cl)c1)C(C)C	ZINC000487016915	331954787	/nfs/dbraw/zinc/95/47/87/331954787.db2.gz	QEARDTBJABWRFL-IUODEOHRSA-N	0	0	279.811	4.160	20	30		CIEDRN
C=CC[C@H](C)NC(=O)[C@@H](c1cccc(Cl)c1)C(C)C	ZINC000487016916	331954793	/nfs/dbraw/zinc/95/47/93/331954793.db2.gz	QEARDTBJABWRFL-SWLSCSKDSA-N	0	0	279.811	4.160	20	30		CIEDRN
CC(C)(C)[C@H]1C[C@H](Nc2ccc(Cl)cc2C#N)CCO1	ZINC000487114211	331956544	/nfs/dbraw/zinc/95/65/44/331956544.db2.gz	YKJPMXQACBNUTB-UKRRQHHQSA-N	0	0	292.810	4.217	20	30		CIEDRN
CC(C)(C)c1ccccc1NC(=O)c1ccc(C#N)s1	ZINC000487224809	331960018	/nfs/dbraw/zinc/96/00/18/331960018.db2.gz	VPAADBWFLMLNOJ-UHFFFAOYSA-N	0	0	284.384	4.170	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](C)CC1CCCCC1	ZINC000487286442	331963195	/nfs/dbraw/zinc/96/31/95/331963195.db2.gz	YRURVMBXODAGFA-KBPBESRZSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=CC1CCN(C(=O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)CC1	ZINC000511654644	332938565	/nfs/dbraw/zinc/93/85/65/332938565.db2.gz	DYNORPNIIBSWAH-IXDOHACOSA-N	0	0	275.436	4.018	20	30		CIEDRN
CC(C)(C)C(=O)c1ccc(NCc2cccc(C#N)c2)cc1	ZINC000487369146	331967870	/nfs/dbraw/zinc/96/78/70/331967870.db2.gz	SUPDVWNNPIEKGR-UHFFFAOYSA-N	0	0	292.382	4.399	20	30		CIEDRN
C=CCC[C@H](C(=O)N(C)Cc1cccs1)c1ccccc1	ZINC000487568904	331975359	/nfs/dbraw/zinc/97/53/59/331975359.db2.gz	ZLZAHQQUDKRBPQ-KRWDZBQOSA-N	0	0	299.439	4.457	20	30		CIEDRN
C=CCC[C@@H](C(=O)NC1CCCCC1)c1ccccc1	ZINC000487582789	331976288	/nfs/dbraw/zinc/97/62/88/331976288.db2.gz	JEECDFDXFWWIHV-QGZVFWFLSA-N	0	0	271.404	4.185	20	30		CIEDRN
C=CCC[C@@H](C(=O)N1CCCCCC1)c1ccccc1	ZINC000487638706	331977870	/nfs/dbraw/zinc/97/78/70/331977870.db2.gz	UYTSINYNCVMBAV-QGZVFWFLSA-N	0	0	271.404	4.139	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N1CCC[C@@H]1CCC1CCCC1	ZINC000487683432	331978776	/nfs/dbraw/zinc/97/87/76/331978776.db2.gz	DOESCFIFFDQYRW-GOEBONIOSA-N	0	0	278.440	4.095	20	30		CIEDRN
N#Cc1ccsc1C(=O)Nc1ccc(C2CCC2)cc1	ZINC000487719845	331979637	/nfs/dbraw/zinc/97/96/37/331979637.db2.gz	VZMJBLUQCAAZID-UHFFFAOYSA-N	0	0	282.368	4.140	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@@H](C)CCc1ccco1)c1ccccc1	ZINC000487787739	331981416	/nfs/dbraw/zinc/98/14/16/331981416.db2.gz	QVIPDCBEMABYCN-MAUKXSAKSA-N	0	0	297.398	4.077	20	30		CIEDRN
C=CC[C@H](C(=O)NCc1ccc(F)c(C)c1)c1ccccc1	ZINC000487786035	331981448	/nfs/dbraw/zinc/98/14/48/331981448.db2.gz	RILJOBMFCBWVBM-KRWDZBQOSA-N	0	0	297.373	4.110	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H]1C[C@H]1c1ccc2ccccc2c1	ZINC000511683391	332939477	/nfs/dbraw/zinc/93/94/77/332939477.db2.gz	SPDKUYDGQSDFOG-ZWKOTPCHSA-N	0	0	293.410	4.414	20	30		CIEDRN
Cc1ccc2c(c1)CC[C@H]2Nc1cccc(F)c1C#N	ZINC000511695612	332939806	/nfs/dbraw/zinc/93/98/06/332939806.db2.gz	OTAPHUDMMVIXHZ-QGZVFWFLSA-N	0	0	266.319	4.105	20	30		CIEDRN
Cc1nc(S[C@@H](C)c2ccc(F)cc2)ccc1C#N	ZINC000488053321	331988351	/nfs/dbraw/zinc/98/83/51/331988351.db2.gz	DSBFYAUXVQOTJP-NSHDSACASA-N	0	0	272.348	4.254	20	30		CIEDRN
Cc1ccc([C@@H]2CCCN2c2ccc(C#N)c(C)n2)cc1C	ZINC000488097965	331989930	/nfs/dbraw/zinc/98/99/30/331989930.db2.gz	OPZYVFRTVDCRNJ-SFHVURJKSA-N	0	0	291.398	4.220	20	30		CIEDRN
N#Cc1c(F)cccc1COc1cc(Cl)ccc1F	ZINC000488228541	331994952	/nfs/dbraw/zinc/99/49/52/331994952.db2.gz	GHNIPMAKEBHQEQ-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
COc1ccccc1CSCc1cccc(F)c1C#N	ZINC000488253464	331996271	/nfs/dbraw/zinc/99/62/71/331996271.db2.gz	TUDPPOWMWGQOBP-UHFFFAOYSA-N	0	0	287.359	4.139	20	30		CIEDRN
N#Cc1ccc(C(=O)N2CCC[C@@H]2CCC2CCCC2)cc1	ZINC000488289715	331997608	/nfs/dbraw/zinc/99/76/08/331997608.db2.gz	AZOHNWRDJZUCDY-GOSISDBHSA-N	0	0	296.414	4.133	20	30		CIEDRN
C=CC[C@H](C(=O)NCCc1cccc(C)c1)c1ccccc1	ZINC000488336094	332000471	/nfs/dbraw/zinc/00/04/71/332000471.db2.gz	ZECUMOWSWKQYMO-IBGZPJMESA-N	0	0	293.410	4.014	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1ccc(Cl)c(F)c1	ZINC000488363458	332002155	/nfs/dbraw/zinc/00/21/55/332002155.db2.gz	GLWMEACEGNDYNV-NSHDSACASA-N	0	0	282.746	4.052	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@H]1C[C@H]1c1ccccc1)c1ccccc1	ZINC000488373976	332002770	/nfs/dbraw/zinc/00/27/70/332002770.db2.gz	XPZXRFQCNLRHKZ-FHWLQOOXSA-N	0	0	291.394	4.019	20	30		CIEDRN
C=CCC[C@@H](C(=O)N1CCC(C=C)CC1)c1ccccc1	ZINC000488390638	332003642	/nfs/dbraw/zinc/00/36/42/332003642.db2.gz	NXDLUFWSEVAXSA-GOSISDBHSA-N	0	0	283.415	4.161	20	30		CIEDRN
CC(C)c1ccc(/C=C\CC(=O)NC2(C#N)CCCC2)cc1	ZINC000488395971	332003718	/nfs/dbraw/zinc/00/37/18/332003718.db2.gz	YYEUHHZSSGQFOM-WAYWQWQTSA-N	0	0	296.414	4.166	20	30		CIEDRN
Cc1cccc2c1[C@H](C)C[C@@H]2CC(=O)N[C@@](C)(C#N)C(C)C	ZINC000488396719	332003755	/nfs/dbraw/zinc/00/37/55/332003755.db2.gz	YPJVSQYPXPJWLS-CLCXKQKWSA-N	0	0	298.430	4.030	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(C)c(OC(C)C)c1	ZINC000488393693	332003769	/nfs/dbraw/zinc/00/37/69/332003769.db2.gz	DUEFSHBAPBXUCC-UHFFFAOYSA-N	0	0	261.365	4.077	20	30		CIEDRN
N#Cc1ccc(NCC2CC(F)(F)C2)c(C(F)(F)F)c1	ZINC000488448612	332010111	/nfs/dbraw/zinc/01/01/11/332010111.db2.gz	NEMOAAIUPZCYKE-UHFFFAOYSA-N	0	0	290.235	4.034	20	30		CIEDRN
N#Cc1cnc(NC[C@H]2CCCCC(F)(F)C2)c(Cl)c1	ZINC000488486550	332013252	/nfs/dbraw/zinc/01/32/52/332013252.db2.gz	XXAZQAJNUBPXAH-JTQLQIEISA-N	0	0	299.752	4.234	20	30		CIEDRN
N#Cc1cc(F)ccc1CSCc1cccc(F)c1	ZINC000488538485	332016141	/nfs/dbraw/zinc/01/61/41/332016141.db2.gz	FCTIWVGMALZYIC-UHFFFAOYSA-N	0	0	275.323	4.270	20	30		CIEDRN
C=CCC[C@@H](C(=O)N(C)[C@@H](C)CCC)c1ccccc1	ZINC000488623424	332020430	/nfs/dbraw/zinc/02/04/30/332020430.db2.gz	DGJWXLVFLSWBGA-DOTOQJQBSA-N	0	0	273.420	4.383	20	30		CIEDRN
CC(C)CN(C(=O)C[C@@H]1C=CCCC1)c1ccc(C#N)cc1	ZINC000488636935	332020603	/nfs/dbraw/zinc/02/06/03/332020603.db2.gz	BAVLSTRQYQRZHZ-MRXNPFEDSA-N	0	0	296.414	4.294	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1ccc2ccoc2c1	ZINC000488672010	332021308	/nfs/dbraw/zinc/02/13/08/332021308.db2.gz	INABFCSRUCTBNB-AWEZNQCLSA-N	0	0	270.332	4.005	20	30		CIEDRN
C=CCC[C@@H](C(=O)NCc1sccc1C)c1ccccc1	ZINC000488693784	332021860	/nfs/dbraw/zinc/02/18/60/332021860.db2.gz	NIRQUVJSZYQVMF-MRXNPFEDSA-N	0	0	299.439	4.423	20	30		CIEDRN
Cc1ccc2c(c1)[C@H](Nc1nccc(C)c1C#N)CCC2	ZINC000488732888	332023118	/nfs/dbraw/zinc/02/31/18/332023118.db2.gz	OCTIHLSRGSBNRS-QGZVFWFLSA-N	0	0	277.371	4.060	20	30		CIEDRN
C=CCn1cccc1C(=O)N1CCCCC[C@H]1c1ccco1	ZINC000488772208	332025008	/nfs/dbraw/zinc/02/50/08/332025008.db2.gz	TVRLFHDCQMNBID-HNNXBMFYSA-N	0	0	298.386	4.025	20	30		CIEDRN
C=C(C)CN(C)C(=O)C[C@H]1C[C@@H](C)c2c1cccc2C	ZINC000488782561	332025509	/nfs/dbraw/zinc/02/55/09/332025509.db2.gz	LJXINDBWYZUWSR-HUUCEWRRSA-N	0	0	271.404	4.010	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)C[C@H]1CCCC(C)(C)C1	ZINC000488812970	332026713	/nfs/dbraw/zinc/02/67/13/332026713.db2.gz	GDLMYHWHPVGLDR-CABCVRRESA-N	0	0	263.425	4.160	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)[C@H](C)CCC(C)(C)C	ZINC000488817032	332027062	/nfs/dbraw/zinc/02/70/62/332027062.db2.gz	DIEXMNRRFBHHCK-KGLIPLIRSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)C[C@H](C)c1ccc(F)cc1F	ZINC000488822181	332027489	/nfs/dbraw/zinc/02/74/89/332027489.db2.gz	WCTPUNRHQDHXKN-JSGCOSHPSA-N	0	0	293.357	4.026	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1cccc(Cl)c1Cl	ZINC000488822923	332027573	/nfs/dbraw/zinc/02/75/73/332027573.db2.gz	XGMHMHYHMMCSSY-SNVBAGLBSA-N	0	0	284.186	4.174	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)CCCc1cc(C)sc1C	ZINC000488831819	332028019	/nfs/dbraw/zinc/02/80/19/332028019.db2.gz	SZDVSVAJPDULEI-INIZCTEOSA-N	0	0	291.460	4.255	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1	ZINC000488834539	332028177	/nfs/dbraw/zinc/02/81/77/332028177.db2.gz	XODFFYLDHQWJKQ-QJPTWQEYSA-N	0	0	295.835	4.072	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)CCCC1CCCCC1	ZINC000488835443	332028255	/nfs/dbraw/zinc/02/82/55/332028255.db2.gz	INQPYPKBXVZKQO-MRXNPFEDSA-N	0	0	263.425	4.304	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)C[C@@H](c1ccccc1)C(C)C	ZINC000488855513	332029708	/nfs/dbraw/zinc/02/97/08/332029708.db2.gz	ANAZIXPMIAJYMR-QZTJIDSGSA-N	0	0	285.431	4.383	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@@H](C)CC1CCCCC1	ZINC000488869226	332030432	/nfs/dbraw/zinc/03/04/32/332030432.db2.gz	AKQMZQQCLOHUHQ-GOEBONIOSA-N	0	0	263.425	4.160	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@@H](C)Sc1ccc(C)cc1	ZINC000488872419	332030682	/nfs/dbraw/zinc/03/06/82/332030682.db2.gz	AFEYSLKJQWYXTD-HUUCEWRRSA-N	0	0	289.444	4.043	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1ccc2sccc2c1	ZINC000488875525	332031065	/nfs/dbraw/zinc/03/10/65/332031065.db2.gz	GTVVLGABGZUFBZ-AWEZNQCLSA-N	0	0	271.385	4.082	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1ccc(OC(C)(C)C)cc1	ZINC000488878223	332031330	/nfs/dbraw/zinc/03/13/30/332031330.db2.gz	LJYQJGAUAUFQCB-OAHLLOKOSA-N	0	0	287.403	4.045	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)CC[C@H](C)c1ccccc1	ZINC000488883502	332031858	/nfs/dbraw/zinc/03/18/58/332031858.db2.gz	WMRSSUBJDHQIOL-DOTOQJQBSA-N	0	0	271.404	4.137	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1cc(F)cc(Cl)c1	ZINC000488899802	332032812	/nfs/dbraw/zinc/03/28/12/332032812.db2.gz	IJKPXZMPDCUFEA-ZDUSSCGKSA-N	0	0	282.746	4.052	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@@H]1CCc2ccc(C(C)C)cc21	ZINC000488914387	332033584	/nfs/dbraw/zinc/03/35/84/332033584.db2.gz	JJSWPZTVNAATLF-CXAGYDPISA-N	0	0	286.419	4.061	20	30		CIEDRN
C=CCCCCCN(C)C(=O)CC1CC(OC(C)(C)C)C1	ZINC000488929533	332034262	/nfs/dbraw/zinc/03/42/62/332034262.db2.gz	DCQDAAFDMLSXGK-UHFFFAOYSA-N	0	0	295.467	4.175	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1cc(C)ccc1Cl	ZINC000488956235	332035217	/nfs/dbraw/zinc/03/52/17/332035217.db2.gz	PFMSNUKWBXHPKY-LBPRGKRZSA-N	0	0	278.783	4.221	20	30		CIEDRN
C=CCCCN(C)C(=O)C[C@@H]1C[C@H](C)c2c1cccc2C	ZINC000488960532	332035665	/nfs/dbraw/zinc/03/56/65/332035665.db2.gz	LOORPGMCMPSKTE-HOTGVXAUSA-N	0	0	285.431	4.401	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@H](C)C[C@H](C)CC)c1ccccc1	ZINC000488982004	332036459	/nfs/dbraw/zinc/03/64/59/332036459.db2.gz	NGNUFQHTAVYNDC-INMHGKMJSA-N	0	0	273.420	4.287	20	30		CIEDRN
C=CCC[C@H](C(=O)N(CC1CC1)CC1CC1)c1ccccc1	ZINC000489035159	332038709	/nfs/dbraw/zinc/03/87/09/332038709.db2.gz	CLKYYUGBTFCYJH-IBGZPJMESA-N	0	0	297.442	4.385	20	30		CIEDRN
C=C[C@@H]1CCCCN1Cc1coc(-c2ccc(F)cc2)n1	ZINC000489391418	332049605	/nfs/dbraw/zinc/04/96/05/332049605.db2.gz	AFPBLEUPIDGCJO-MRXNPFEDSA-N	0	0	286.350	4.021	20	30		CIEDRN
N#Cc1cc(F)c(N2CCC[C@@]3(CC=CCC3)C2)c(F)c1	ZINC000303604412	332941607	/nfs/dbraw/zinc/94/16/07/332941607.db2.gz	VOQGEIONLYXIJA-KRWDZBQOSA-N	0	0	288.341	4.163	20	30		CIEDRN
C=C[C@H]1CCCCN1Cc1csc(-c2cccs2)n1	ZINC000489488380	332056098	/nfs/dbraw/zinc/05/60/98/332056098.db2.gz	YCVDHITUQFREBJ-ZDUSSCGKSA-N	0	0	290.457	4.412	20	30		CIEDRN
C=C[C@H]1CCCCN1Cc1nc(-c2ccccc2)cs1	ZINC000489495966	332056684	/nfs/dbraw/zinc/05/66/84/332056684.db2.gz	KCEDFMKRLUKOMT-HNNXBMFYSA-N	0	0	284.428	4.351	20	30		CIEDRN
C=CCC(CC=C)C(=O)NCc1cc2ccccc2s1	ZINC000489566989	332059750	/nfs/dbraw/zinc/05/97/50/332059750.db2.gz	ODZMCKCABXSVKU-UHFFFAOYSA-N	0	0	285.412	4.286	20	30		CIEDRN
C=CCCN(C)C(=O)C[C@@H]1C[C@@H](C)c2c1cccc2C	ZINC000489573981	332060005	/nfs/dbraw/zinc/06/00/05/332060005.db2.gz	RJDAGOYBUNEEBZ-CABCVRRESA-N	0	0	271.404	4.010	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)NCc1cc2ccccc2s1	ZINC000489596899	332060780	/nfs/dbraw/zinc/06/07/80/332060780.db2.gz	LEEOQKPMJDJRCM-MRXNPFEDSA-N	0	0	273.401	4.120	20	30		CIEDRN
C=CCC[C@H](C(=O)N(C)[C@@H](C)C1CCC1)c1ccccc1	ZINC000489615766	332061669	/nfs/dbraw/zinc/06/16/69/332061669.db2.gz	GFLBBQYSXKELSA-YJBOKZPZSA-N	0	0	285.431	4.383	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H]1CCC[C@@H](c2ccccc2)C1	ZINC000489638097	332062522	/nfs/dbraw/zinc/06/25/22/332062522.db2.gz	VPXUKSSQMCGWRC-QZTJIDSGSA-N	0	0	283.415	4.023	20	30		CIEDRN
C=CCCCC(=O)N[C@@H]1CCC[C@H](c2ccccc2)C1	ZINC000489658286	332063330	/nfs/dbraw/zinc/06/33/30/332063330.db2.gz	BXGVMCLRSMKXRK-DLBZAZTESA-N	0	0	271.404	4.185	20	30		CIEDRN
C=CC[C@@H](C(=O)NCC1(CCC)CC1)c1ccccc1	ZINC000489688137	332064897	/nfs/dbraw/zinc/06/48/97/332064897.db2.gz	QKUAUWVBYCIXGZ-MRXNPFEDSA-N	0	0	271.404	4.043	20	30		CIEDRN
C=CC[C@@H](C(=O)N1CCc2cccc(F)c21)c1ccccc1	ZINC000489739624	332066467	/nfs/dbraw/zinc/06/64/67/332066467.db2.gz	OPJKXSPBRIGKSG-MRXNPFEDSA-N	0	0	295.357	4.075	20	30		CIEDRN
C=CCC[C@@H](C(=O)Nc1cnc(C)s1)c1ccccc1	ZINC000489744266	332066644	/nfs/dbraw/zinc/06/66/44/332066644.db2.gz	WUNNZASQHFBOGH-CQSZACIVSA-N	0	0	286.400	4.140	20	30		CIEDRN
C=CCC[C@@H](C(=O)NCCC1=CCCC1)c1ccccc1	ZINC000489757951	332066992	/nfs/dbraw/zinc/06/69/92/332066992.db2.gz	YBRGBMUUKBZXEN-GOSISDBHSA-N	0	0	283.415	4.353	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@H]1C[C@H]1c1ccccc1Cl	ZINC000489761765	332067267	/nfs/dbraw/zinc/06/72/67/332067267.db2.gz	BPCWAGPHNJVTCR-KBPBESRZSA-N	0	0	291.822	4.162	20	30		CIEDRN
C=CCN(C)C(=O)Nc1cc(Cl)ccc1C(F)(F)F	ZINC000489863592	332070961	/nfs/dbraw/zinc/07/09/61/332070961.db2.gz	ZVXZKSDSZJISTQ-UHFFFAOYSA-N	0	0	292.688	4.009	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1ccc(SC2CC2)cc1	ZINC000489939836	332073302	/nfs/dbraw/zinc/07/33/02/332073302.db2.gz	FFVYJEVEPPDSTQ-UHFFFAOYSA-N	0	0	289.444	4.273	20	30		CIEDRN
CCC[C@H](C(=O)N(C)c1cc(Cl)ccc1C#N)C(C)C	ZINC000489956933	332074265	/nfs/dbraw/zinc/07/42/65/332074265.db2.gz	NBUCUZRLUXUEQG-AWEZNQCLSA-N	0	0	292.810	4.247	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)CCCc1ccc(F)c(F)c1	ZINC000489968199	332075003	/nfs/dbraw/zinc/07/50/03/332075003.db2.gz	VUBHUNPOPQGQBK-UHFFFAOYSA-N	0	0	295.373	4.006	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)CC/C=C\c1ccccc1	ZINC000490007361	332076290	/nfs/dbraw/zinc/07/62/90/332076290.db2.gz	VSGLRSAUQFCGPR-WQLSENKSSA-N	0	0	271.404	4.199	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)C/C=C\c1ccc(C)cc1	ZINC000490035171	332077600	/nfs/dbraw/zinc/07/76/00/332077600.db2.gz	VWUXRSBANYCOEJ-SREVYHEPSA-N	0	0	271.404	4.117	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1	ZINC000490055329	332079119	/nfs/dbraw/zinc/07/91/19/332079119.db2.gz	BNCWJVLNJFOPLP-NWDGAFQWSA-N	0	0	291.357	4.074	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1scnc1C1CCCC1	ZINC000490063103	332079602	/nfs/dbraw/zinc/07/96/02/332079602.db2.gz	WTWNTFZTFZKWTQ-UHFFFAOYSA-N	0	0	292.448	4.133	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)CCCc1cc(F)ccc1F	ZINC000490063064	332079654	/nfs/dbraw/zinc/07/96/54/332079654.db2.gz	WJONKUGNAKGILG-UHFFFAOYSA-N	0	0	295.373	4.006	20	30		CIEDRN
C=C(C)CNC(=O)C[C@H](Cc1ccccc1)c1ccccc1	ZINC000490070018	332079891	/nfs/dbraw/zinc/07/98/91/332079891.db2.gz	GIIBNBHXNYVBKW-IBGZPJMESA-N	0	0	293.410	4.095	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1cc(Cl)ccc1Cl	ZINC000490083661	332080904	/nfs/dbraw/zinc/08/09/04/332080904.db2.gz	BNKFIXXVDMSWSV-UHFFFAOYSA-N	0	0	286.202	4.326	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@H](CC)c1ccc(F)cc1	ZINC000490092536	332081011	/nfs/dbraw/zinc/08/10/11/332081011.db2.gz	WJYCNMHCMKZQNV-OAHLLOKOSA-N	0	0	277.383	4.038	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)C1CCC(C(F)(F)F)CC1	ZINC000490105256	332081698	/nfs/dbraw/zinc/08/16/98/332081698.db2.gz	XGRXRBKHVOSMQN-UHFFFAOYSA-N	0	0	291.357	4.074	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)c1ccc(CCC)cc1	ZINC000490196390	332084155	/nfs/dbraw/zinc/08/41/55/332084155.db2.gz	HXPKNIZDNNYIFQ-UHFFFAOYSA-N	0	0	297.398	4.103	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)C1CCC(C)(C)CC1	ZINC000490211335	332084576	/nfs/dbraw/zinc/08/45/76/332084576.db2.gz	FYGRBENCQGMRMY-UHFFFAOYSA-N	0	0	289.419	4.053	20	30		CIEDRN
C=CCC[C@@H](C(=O)N[C@@H](C)CCC1CC1)c1ccccc1	ZINC000490239164	332085059	/nfs/dbraw/zinc/08/50/59/332085059.db2.gz	DTLQBOHUKVYJRJ-MAUKXSAKSA-N	0	0	285.431	4.431	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)C[C@H](C)c1ccccc1	ZINC000490312751	332086496	/nfs/dbraw/zinc/08/64/96/332086496.db2.gz	HWEPPJMZALBVKY-INIZCTEOSA-N	0	0	297.398	4.031	20	30		CIEDRN
CC(C)(C#N)CCCNc1ccc(F)c(C2CC2)c1	ZINC000490404547	332088585	/nfs/dbraw/zinc/08/85/85/332088585.db2.gz	VLOJJHMUDVHNIU-UHFFFAOYSA-N	0	0	260.356	4.445	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1ccc(-c2ccco2)cc1F	ZINC000490501838	332090128	/nfs/dbraw/zinc/09/01/28/332090128.db2.gz	VHWXOEIZINZAAJ-NSHDSACASA-N	0	0	288.322	4.172	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(Cl)c2ccncc12	ZINC000490641461	332099051	/nfs/dbraw/zinc/09/90/51/332099051.db2.gz	ABVYIPCAGGVATM-UHFFFAOYSA-N	0	0	274.751	4.183	20	30		CIEDRN
C=C[C@@H](CC(=O)N(C)C1(C)CCCC1)c1ccccc1	ZINC000490679165	332103218	/nfs/dbraw/zinc/10/32/18/332103218.db2.gz	CRQOLEWOMZGPND-HNNXBMFYSA-N	0	0	271.404	4.137	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccc(Cl)c2ccncc12	ZINC000490713272	332107304	/nfs/dbraw/zinc/10/73/04/332107304.db2.gz	RIYIQJDIABNFHI-UHFFFAOYSA-N	0	0	286.762	4.020	20	30		CIEDRN
C[C@@H](NC(=O)C1(C#N)CCCCC1)[C@H](C)C1CCCCC1	ZINC000490887268	332124941	/nfs/dbraw/zinc/12/49/41/332124941.db2.gz	LOTPPWPAHKZNRG-LSDHHAIUSA-N	0	0	290.451	4.182	20	30		CIEDRN
Cc1nnc(SCCCC2CCCC2)c(C#N)c1C	ZINC000511881214	332946611	/nfs/dbraw/zinc/94/66/11/332946611.db2.gz	UNKYUXAPOLJURM-UHFFFAOYSA-N	0	0	275.421	4.028	20	30		CIEDRN
CC#CCN(C)[C@H](C)c1ncc(-c2ccc(Cl)cc2)o1	ZINC000575334876	335095478	/nfs/dbraw/zinc/09/54/78/335095478.db2.gz	BOCZVPSDICLKGV-GFCCVEGCSA-N	0	0	288.778	4.011	20	30		CIEDRN
C#C[C@H](C)N(C)C(=O)Nc1cc(-c2ccc(C)o2)ccc1C	ZINC000491507130	332225350	/nfs/dbraw/zinc/22/53/50/332225350.db2.gz	UCNMRXVAGFOSHS-ZDUSSCGKSA-N	0	0	296.370	4.049	20	30		CIEDRN
CSc1cccc(NC(=O)Nc2cc(C#N)ccc2C)c1	ZINC000172220437	335098034	/nfs/dbraw/zinc/09/80/34/335098034.db2.gz	DWDGZFRVPROVGN-UHFFFAOYSA-N	0	0	297.383	4.233	20	30		CIEDRN
CC(C)[C@@H]1CCCC[C@H]1NC(=O)Nc1ccc(CC#N)cc1	ZINC000491836006	332371359	/nfs/dbraw/zinc/37/13/59/332371359.db2.gz	VLRKBMFKBSCWNR-DLBZAZTESA-N	0	0	299.418	4.089	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)/C=C\c1cnccc1C	ZINC000492889382	332417376	/nfs/dbraw/zinc/41/73/76/332417376.db2.gz	CRFSRJDHCAENOJ-KHPPLWFESA-N	0	0	292.382	4.161	20	30		CIEDRN
C[C@@H](c1cccc(C#N)c1)N(C)C(=O)/C=C\C1CCCCC1	ZINC000493167548	332429111	/nfs/dbraw/zinc/42/91/11/332429111.db2.gz	PVQCATUQURXHKP-SSCKCOOKSA-N	0	0	296.414	4.214	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)c1ccc(Cl)s1	ZINC000493175035	332429428	/nfs/dbraw/zinc/42/94/28/332429428.db2.gz	FGDVIJJNDSSEKD-UHFFFAOYSA-N	0	0	297.832	4.291	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)/C=C\c1scnc1C	ZINC000493342343	332436127	/nfs/dbraw/zinc/43/61/27/332436127.db2.gz	XTJRRSAXEVFFIZ-KHPPLWFESA-N	0	0	298.411	4.222	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)/C=C\c1ncccc1C	ZINC000493653988	332448720	/nfs/dbraw/zinc/44/87/20/332448720.db2.gz	ZEVAGCXQFLNXQL-SEYXRHQNSA-N	0	0	292.382	4.161	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)C[C@@H]1CCC[C@@H](C)C1	ZINC000493765473	332453251	/nfs/dbraw/zinc/45/32/51/332453251.db2.gz	SITBVMGXVCWVGD-HUUCEWRRSA-N	0	0	291.460	4.479	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(Oc2ccccc2)c(C#N)c1	ZINC000493942406	332458732	/nfs/dbraw/zinc/45/87/32/332458732.db2.gz	AIABEAXJXCBDAJ-UHFFFAOYSA-N	0	0	292.338	4.255	20	30		CIEDRN
CC(C)C[C@@H]1CCCCCN1C(=O)c1cccc(CC#N)c1	ZINC000172571642	335109558	/nfs/dbraw/zinc/10/95/58/335109558.db2.gz	ZRKNKDHBFTWCGV-SFHVURJKSA-N	0	0	298.430	4.184	20	30		CIEDRN
N#Cc1ccc(NC(=O)CC2=CCCCC2)c(Cl)c1	ZINC000494584609	332478746	/nfs/dbraw/zinc/47/87/46/332478746.db2.gz	WFVUDHLLKIUINL-UHFFFAOYSA-N	0	0	274.751	4.041	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N[C@@H](C)CCCC(F)(F)F	ZINC000494793160	332485807	/nfs/dbraw/zinc/48/58/07/332485807.db2.gz	IMBMDULJKXMQGI-RYUDHWBXSA-N	0	0	294.361	4.152	20	30		CIEDRN
C=CCCCCNC(=O)N(C)C/C(C)=C\c1ccccc1	ZINC000494816871	332486613	/nfs/dbraw/zinc/48/66/13/332486613.db2.gz	ARDWIAXLTOCOPC-PEZBUJJGSA-N	0	0	286.419	4.088	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N(C)Cc1cccc2[nH]ccc21	ZINC000494815645	332486651	/nfs/dbraw/zinc/48/66/51/332486651.db2.gz	JPBYIHZTCYUCFL-AWEZNQCLSA-N	0	0	299.418	4.054	20	30		CIEDRN
C=CC[C@@H](C(=O)N(C)CC1CCCCC1)c1ccccc1	ZINC000494999834	332498903	/nfs/dbraw/zinc/49/89/03/332498903.db2.gz	VWTMHQIOOVOKTP-GOSISDBHSA-N	0	0	285.431	4.385	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1cccc(F)c1Cl	ZINC000495012031	332499803	/nfs/dbraw/zinc/49/98/03/332499803.db2.gz	YMDPUBHJFBUVLR-SNVBAGLBSA-N	0	0	282.746	4.052	20	30		CIEDRN
C=CCN(C)C(=O)Nc1cccc(-c2ccccc2)c1	ZINC000495559503	332522875	/nfs/dbraw/zinc/52/28/75/332522875.db2.gz	CFTHIPPJIQOGHH-UHFFFAOYSA-N	0	0	266.344	4.003	20	30		CIEDRN
CC(C)(C)OC(=O)NCCCCC=NOC1CCCCC1	ZINC000495873149	332532413	/nfs/dbraw/zinc/53/24/13/332532413.db2.gz	GGCWJWWQAUGURP-UHFFFAOYSA-N	0	0	298.427	4.017	20	30		CIEDRN
Cc1cc(N2CCC[C@@H]2c2ccccc2Cl)cc(C#N)n1	ZINC000553276454	334373179	/nfs/dbraw/zinc/37/31/79/334373179.db2.gz	BKJIAOUFQZQNOR-QGZVFWFLSA-N	0	0	297.789	4.257	20	30		CIEDRN
C=CCCCN(C)C(=O)c1sc2cc(F)ccc2c1C	ZINC000498634847	332570839	/nfs/dbraw/zinc/57/08/39/332570839.db2.gz	CFUYWRCTHPAJLO-UHFFFAOYSA-N	0	0	291.391	4.387	20	30		CIEDRN
CC(C)[C@@H](NC(=O)CC(C)(C)C#N)c1ccccc1Cl	ZINC000498870784	332574551	/nfs/dbraw/zinc/57/45/51/332574551.db2.gz	GYHGQLCLAQFJIU-OAHLLOKOSA-N	0	0	292.810	4.093	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CCCc2cc(Cl)ccc21	ZINC000500202363	332602570	/nfs/dbraw/zinc/60/25/70/332602570.db2.gz	ZDWMEUOJHHFJIG-INIZCTEOSA-N	0	0	277.795	4.222	20	30		CIEDRN
C=CCC[C@H](NC(=O)c1ccc(C)c(O)c1)c1ccccc1	ZINC000500291616	332604376	/nfs/dbraw/zinc/60/43/76/332604376.db2.gz	XALHZKLXWOTJQS-KRWDZBQOSA-N	0	0	295.382	4.138	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCCc1c(C)oc2ccccc21	ZINC000500380668	332605821	/nfs/dbraw/zinc/60/58/21/332605821.db2.gz	LGOLVLIXOKWITH-UHFFFAOYSA-N	0	0	285.387	4.002	20	30		CIEDRN
CC(C)(C#N)CC(=O)Nc1ccc(CCC(F)(F)F)cc1	ZINC000500396797	332606827	/nfs/dbraw/zinc/60/68/27/332606827.db2.gz	WCVFKXVPZIVOAO-UHFFFAOYSA-N	0	0	298.308	4.060	20	30		CIEDRN
C=CCCc1ccccc1NCc1ccc(OC)c(O)c1	ZINC000500446706	332609383	/nfs/dbraw/zinc/60/93/83/332609383.db2.gz	NIDPZOKZXRZMPO-UHFFFAOYSA-N	0	0	283.371	4.132	20	30		CIEDRN
C[C@H]1C[C@]1(NCc1ccccc1C#N)c1ccc(Cl)cc1	ZINC000500454522	332609819	/nfs/dbraw/zinc/60/98/19/332609819.db2.gz	YGDIDRVBPLBKEA-SCLBCKFNSA-N	0	0	296.801	4.237	20	30		CIEDRN
C=CCOc1cccc(NC(=O)c2cc(C)cc(C)c2)c1	ZINC000501155805	332627707	/nfs/dbraw/zinc/62/77/07/332627707.db2.gz	MHANADDOTPDJKO-UHFFFAOYSA-N	0	0	281.355	4.121	20	30		CIEDRN
C=CCOc1cccc(NC(=O)[C@H](CC)c2ccccc2)c1	ZINC000501184393	332628222	/nfs/dbraw/zinc/62/82/22/332628222.db2.gz	IEQYMNKAGGHRCP-GOSISDBHSA-N	0	0	295.382	4.384	20	30		CIEDRN
N#Cc1cnc(NCc2cccc3ccccc32)c(Cl)c1	ZINC000501243498	332629118	/nfs/dbraw/zinc/62/91/18/332629118.db2.gz	HISDOXPHDUNUMY-UHFFFAOYSA-N	0	0	293.757	4.372	20	30		CIEDRN
N#CC1(CN2CCc3cc(-c4ccccc4)ccc32)CC1	ZINC000501531404	332634961	/nfs/dbraw/zinc/63/49/61/332634961.db2.gz	ZHHUQUYNMNXPAQ-UHFFFAOYSA-N	0	0	274.367	4.020	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1nc2ccccc2s1	ZINC000501725757	332639520	/nfs/dbraw/zinc/63/95/20/332639520.db2.gz	RITLEMSVORBWDA-UHFFFAOYSA-N	0	0	288.416	4.115	20	30		CIEDRN
CN(Cc1ccc(C#N)cc1)C(=O)CC1CCC(C)(C)CC1	ZINC000502308237	332653356	/nfs/dbraw/zinc/65/33/56/332653356.db2.gz	HDXFLUFMUHLJLI-UHFFFAOYSA-N	0	0	298.430	4.123	20	30		CIEDRN
C[C@@H](CCNC(=O)NCC(C)(C)CCC#N)CC(C)(C)C	ZINC000502364268	332654764	/nfs/dbraw/zinc/65/47/64/332654764.db2.gz	GTNAEPQLNCFUEA-AWEZNQCLSA-N	0	0	295.471	4.078	20	30		CIEDRN
CC(C)c1ccc2c(c1)[C@H](NC(=O)CC(C)(C)C#N)CCC2	ZINC000502861383	332674453	/nfs/dbraw/zinc/67/44/53/332674453.db2.gz	KKFLNLGRRSHHDB-QGZVFWFLSA-N	0	0	298.430	4.243	20	30		CIEDRN
N#Cc1cccc(-c2nc3ccc(F)cc3n2C2CC2)c1	ZINC000154938567	334708427	/nfs/dbraw/zinc/70/84/27/334708427.db2.gz	LPQTWRSFJWGTBE-UHFFFAOYSA-N	0	0	277.302	4.049	20	30		CIEDRN
CN(C(=O)C1(C#N)CCCC1)C1CCC(C(C)(C)C)CC1	ZINC000502939413	332676619	/nfs/dbraw/zinc/67/66/19/332676619.db2.gz	MDZISWZEXBANQA-UHFFFAOYSA-N	0	0	290.451	4.134	20	30		CIEDRN
C=CCCCNC(=O)N1C[C@H](C)CC[C@H]1c1ccccc1	ZINC000503394504	332688485	/nfs/dbraw/zinc/68/84/85/332688485.db2.gz	IKQXRPQEZGFVLA-WBVHZDCISA-N	0	0	286.419	4.135	20	30		CIEDRN
N#CCCCOc1cccc(-c2nc3c(cccc3F)[nH]2)c1	ZINC000154763077	334704400	/nfs/dbraw/zinc/70/44/00/334704400.db2.gz	WPBTYDNWDQXNIM-UHFFFAOYSA-N	0	0	295.317	4.052	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)c1ccccc1Cl	ZINC000503803924	332696337	/nfs/dbraw/zinc/69/63/37/332696337.db2.gz	FGIWECBENSDFDT-UHFFFAOYSA-N	0	0	285.774	4.168	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000504207914	332706139	/nfs/dbraw/zinc/70/61/39/332706139.db2.gz	OKKHJRBMLAFGKO-UHFFFAOYSA-N	0	0	267.319	4.339	20	30		CIEDRN
CCOc1c(Cl)cccc1/C=C/c1ccncc1C#N	ZINC000504711232	332719236	/nfs/dbraw/zinc/71/92/36/332719236.db2.gz	HNQMTXIAYIGCTP-VOTSOKGWSA-N	0	0	284.746	4.176	20	30		CIEDRN
CC1(C)CCc2cc(/C=C/c3ccncc3C#N)ccc2O1	ZINC000504731750	332719646	/nfs/dbraw/zinc/71/96/46/332719646.db2.gz	QEUZJJAOFCPGRE-HWKANZROSA-N	0	0	290.366	4.227	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1C[C@H](C)C[C@@H](C)C1	ZINC000505001003	332727572	/nfs/dbraw/zinc/72/75/72/332727572.db2.gz	MYZSSLIBMKYIGK-HUUCEWRRSA-N	0	0	286.419	4.315	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N[C@H]1C=CCCC1	ZINC000505011207	332727672	/nfs/dbraw/zinc/72/76/72/332727672.db2.gz	RQVWLZOITKPRCL-HNNXBMFYSA-N	0	0	270.376	4.035	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)NCC1CCCC1	ZINC000505017410	332727953	/nfs/dbraw/zinc/72/79/53/332727953.db2.gz	VOLUNLJCJZMHNP-UHFFFAOYSA-N	0	0	272.392	4.117	20	30		CIEDRN
Cc1ccc(-c2noc(/C=C/c3ccccc3C#N)n2)cc1	ZINC000505037633	332728830	/nfs/dbraw/zinc/72/88/30/332728830.db2.gz	DURQOYJGAKDNFJ-ZHACJKMWSA-N	0	0	287.322	4.087	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)NCCC=C(C)C	ZINC000505058556	332729537	/nfs/dbraw/zinc/72/95/37/332729537.db2.gz	XBMFRKGWSXYGGE-UHFFFAOYSA-N	0	0	272.392	4.283	20	30		CIEDRN
CCCCC1CCC(C(=O)N(CCC#N)CC2CC2)CC1	ZINC000505179608	332733021	/nfs/dbraw/zinc/73/30/21/332733021.db2.gz	KHTKHUVNLKPCCB-UHFFFAOYSA-N	0	0	290.451	4.135	20	30		CIEDRN
C=C(C)CCOc1cccc(NC(=O)c2cccs2)c1	ZINC000505527677	332743053	/nfs/dbraw/zinc/74/30/53/332743053.db2.gz	VPPDVACYXDXVMJ-UHFFFAOYSA-N	0	0	287.384	4.345	20	30		CIEDRN
C=C(C)CCSc1nnc(CCCc2ccccc2)o1	ZINC000505563356	332744205	/nfs/dbraw/zinc/74/42/05/332744205.db2.gz	DSMXTHPPESLQPZ-UHFFFAOYSA-N	0	0	288.416	4.303	20	30		CIEDRN
CCCC[C@H](CC)C(=O)N[C@@H](C#N)c1ccccc1Cl	ZINC000505661881	332748458	/nfs/dbraw/zinc/74/84/58/332748458.db2.gz	OPPOOMLQHOGMRP-WFASDCNBSA-N	0	0	292.810	4.237	20	30		CIEDRN
CC[C@H](CC(=O)N[C@H](C#N)c1ccc(Cl)cc1)C(C)C	ZINC000505790248	332752889	/nfs/dbraw/zinc/75/28/89/332752889.db2.gz	LNWBBGGGDFBPGP-IUODEOHRSA-N	0	0	292.810	4.093	20	30		CIEDRN
C=C(C)CN[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F	ZINC000505841512	332754194	/nfs/dbraw/zinc/75/41/94/332754194.db2.gz	WHVQILULOXMJSS-NSHDSACASA-N	0	0	297.242	4.475	20	30		CIEDRN
N#CCc1ccc(NC(=O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)cc1	ZINC000506010178	332759257	/nfs/dbraw/zinc/75/92/57/332759257.db2.gz	PZOXPLJXBHQOJK-BPQIPLTHSA-N	0	0	296.414	4.298	20	30		CIEDRN
N#CCc1ccc(NC(=O)[C@@H]2CCC[C@@H]3CCCC[C@@H]23)cc1	ZINC000506010179	332759333	/nfs/dbraw/zinc/75/93/33/332759333.db2.gz	PZOXPLJXBHQOJK-CGTJXYLNSA-N	0	0	296.414	4.298	20	30		CIEDRN
C=CCN(Cc1ccc(F)c(Cl)c1)CC(F)(F)F	ZINC000511974712	332949282	/nfs/dbraw/zinc/94/92/82/332949282.db2.gz	TWTONJSZKJRXLZ-UHFFFAOYSA-N	0	0	281.680	4.029	20	30		CIEDRN
N#CCN(Cc1ccc(-c2ccc(F)cc2)s1)C1CC1	ZINC000511974896	332949483	/nfs/dbraw/zinc/94/94/83/332949483.db2.gz	WUMKQSZVHSWUDB-UHFFFAOYSA-N	0	0	286.375	4.042	20	30		CIEDRN
Cc1cscc1N[C@@H](C)c1ccc(C#N)cc1F	ZINC000512289555	332961405	/nfs/dbraw/zinc/96/14/05/332961405.db2.gz	SYCZNBSOMJRSLG-JTQLQIEISA-N	0	0	260.337	4.240	20	30		CIEDRN
Cc1c(F)cccc1N[C@H](C)c1ccc(C#N)cc1F	ZINC000512284418	332961541	/nfs/dbraw/zinc/96/15/41/332961541.db2.gz	YLMUAWZNEXEEOZ-LLVKDONJSA-N	0	0	272.298	4.318	20	30		CIEDRN
Cc1cccc(N[C@H](C)c2ccc(C#N)cc2F)c1F	ZINC000512289087	332961776	/nfs/dbraw/zinc/96/17/76/332961776.db2.gz	QNCANYAPEWJJMQ-LLVKDONJSA-N	0	0	272.298	4.318	20	30		CIEDRN
Cc1cccc(N[C@H](C)c2ccc(C#N)cc2F)c1C	ZINC000512653886	332978068	/nfs/dbraw/zinc/97/80/68/332978068.db2.gz	HROHMWJXNIDTES-CYBMUJFWSA-N	0	0	268.335	4.487	20	30		CIEDRN
C[C@H](NCc1ccccc1Cl)c1ccc(C#N)cc1F	ZINC000512662154	332978513	/nfs/dbraw/zinc/97/85/13/332978513.db2.gz	VVUKIDHVOKLVKI-NSHDSACASA-N	0	0	288.753	4.202	20	30		CIEDRN
C=C(CNC(=O)N1CC=C(C(C)(C)C)CC1)c1ccccc1	ZINC000512682366	332979903	/nfs/dbraw/zinc/97/99/03/332979903.db2.gz	VVSQOAUSPFPWQL-UHFFFAOYSA-N	0	0	298.430	4.088	20	30		CIEDRN
CCN(C(=O)C[C@@H](C)c1ccccc1)c1ccc(C#N)cc1	ZINC000174077898	332990411	/nfs/dbraw/zinc/99/04/11/332990411.db2.gz	OHLNIIWCHFNTAZ-OAHLLOKOSA-N	0	0	292.382	4.105	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)NCCC2(F)CCC2)CCCC1(C)C	ZINC000512878729	332991438	/nfs/dbraw/zinc/99/14/38/332991438.db2.gz	USCZKQDNZLQQCJ-AWEZNQCLSA-N	0	0	296.430	4.045	20	30		CIEDRN
CCCCCc1nc(-c2ccc(C#N)cc2)cs1	ZINC000512900173	332992836	/nfs/dbraw/zinc/99/28/36/332992836.db2.gz	BZPADRRDWWTGAD-UHFFFAOYSA-N	0	0	256.374	4.414	20	30		CIEDRN
N#Cc1cc(F)ccc1N[C@@H](c1ccccc1)[C@@H]1CCCO1	ZINC000174721814	333006306	/nfs/dbraw/zinc/00/63/06/333006306.db2.gz	GMINFCRXAXAGOK-ROUUACIJSA-N	0	0	296.345	4.030	20	30		CIEDRN
N#Cc1cccc(-c2csc(NCc3ccccc3)n2)c1	ZINC000307213559	333013001	/nfs/dbraw/zinc/01/30/01/333013001.db2.gz	YCVHSMJTVSKTIH-UHFFFAOYSA-N	0	0	291.379	4.294	20	30		CIEDRN
CC(C)(C#N)CCCNc1ccc2c(c1)CCCC2	ZINC000404530430	333013305	/nfs/dbraw/zinc/01/33/05/333013305.db2.gz	WNGQVUBEYQNYFL-UHFFFAOYSA-N	0	0	256.393	4.307	20	30		CIEDRN
C=CCCCC(=O)N[C@H](CC(C)C)c1nc2ccccc2[nH]1	ZINC000175137474	333015349	/nfs/dbraw/zinc/01/53/49/333015349.db2.gz	GHVGUQGJVCPLJR-MRXNPFEDSA-N	0	0	299.418	4.123	20	30		CIEDRN
CC(C)C[C@@H]1CCN(c2cc(Cl)ccc2C#N)C1	ZINC000307769398	333016243	/nfs/dbraw/zinc/01/62/43/333016243.db2.gz	CVHYEQDJRYIKIJ-LBPRGKRZSA-N	0	0	262.784	4.084	20	30		CIEDRN
CC(C)C[C@H]1CCN(c2ccc(C#N)c(Cl)c2)C1	ZINC000307772439	333016478	/nfs/dbraw/zinc/01/64/78/333016478.db2.gz	IGPPXCYDHNQSKV-GFCCVEGCSA-N	0	0	262.784	4.084	20	30		CIEDRN
C=CCCCC(=O)N(CC)Cc1cccc(Cl)c1	ZINC000175243263	333018463	/nfs/dbraw/zinc/01/84/63/333018463.db2.gz	SKSJRLQNDWWLMS-UHFFFAOYSA-N	0	0	265.784	4.045	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000175252100	333018496	/nfs/dbraw/zinc/01/84/96/333018496.db2.gz	WGBXVVQZXUZTFQ-NSHDSACASA-N	0	0	285.309	4.239	20	30		CIEDRN
CC[C@H](CC1CCCC1)C(=O)N(CCC#N)CCC(C)C	ZINC000513441642	333019468	/nfs/dbraw/zinc/01/94/68/333019468.db2.gz	DFZHAABFEFDBCC-QGZVFWFLSA-N	0	0	292.467	4.381	20	30		CIEDRN
C=CCCCC(=O)N(Cc1ccc([C@@H]2C[C@@H]2C)o1)C1CC1	ZINC000175276030	333019572	/nfs/dbraw/zinc/01/95/72/333019572.db2.gz	ZDDGNTXNUCLKIL-XJKSGUPXSA-N	0	0	287.403	4.250	20	30		CIEDRN
N#Cc1ccc(CNc2ccc3c(c2)CCCC3)s1	ZINC000404681905	333021753	/nfs/dbraw/zinc/02/17/53/333021753.db2.gz	DGAISFGBWHHXSO-UHFFFAOYSA-N	0	0	268.385	4.111	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](C)c1cccc(OC(C)C)c1	ZINC000175329933	333021767	/nfs/dbraw/zinc/02/17/67/333021767.db2.gz	HVXKSLUVULQRDU-AWEZNQCLSA-N	0	0	275.392	4.007	20	30		CIEDRN
N#Cc1ccc(CSCc2ccccc2)cc1F	ZINC000404712869	333023678	/nfs/dbraw/zinc/02/36/78/333023678.db2.gz	BGUJQXDHNLWSEK-UHFFFAOYSA-N	0	0	257.333	4.131	20	30		CIEDRN
C=CCN(CC=C)C(=O)Nc1cccc(O[C@@H](C)CC)c1	ZINC000513568046	333025251	/nfs/dbraw/zinc/02/52/51/333025251.db2.gz	JYOAELPKGHNJCD-AWEZNQCLSA-N	0	0	288.391	4.070	20	30		CIEDRN
Cc1ccc(Cl)c(Oc2ncc(C#N)cc2Cl)c1	ZINC000513616119	333026650	/nfs/dbraw/zinc/02/66/50/333026650.db2.gz	XPVZADVWSBNNQD-UHFFFAOYSA-N	0	0	279.126	4.361	20	30		CIEDRN
Cc1ccccc1[C@@H]1CCCN1c1ncc(C#N)cc1Cl	ZINC000513615647	333026718	/nfs/dbraw/zinc/02/67/18/333026718.db2.gz	SSMUNAOPSOKDCI-INIZCTEOSA-N	0	0	297.789	4.257	20	30		CIEDRN
C=CCCCC(=O)Nc1ccccc1C(F)(F)F	ZINC000175587092	333026886	/nfs/dbraw/zinc/02/68/86/333026886.db2.gz	XTJZWLNUGGPNKI-UHFFFAOYSA-N	0	0	257.255	4.000	20	30		CIEDRN
C=CCCCC(=O)Nc1cc(Cl)ccc1Cl	ZINC000175586892	333026923	/nfs/dbraw/zinc/02/69/23/333026923.db2.gz	QAXPIOIQWQOQTF-UHFFFAOYSA-N	0	0	258.148	4.288	20	30		CIEDRN
Cc1ccc([C@@H](C)N(C)c2ncc(C#N)cc2Cl)c(C)c1	ZINC000513618492	333027022	/nfs/dbraw/zinc/02/70/22/333027022.db2.gz	GSLHIJQOYGWPRN-CYBMUJFWSA-N	0	0	299.805	4.421	20	30		CIEDRN
N#Cc1cnc(Oc2ccc(Cl)cc2)c(Cl)c1	ZINC000513618209	333027164	/nfs/dbraw/zinc/02/71/64/333027164.db2.gz	DOUAYXSFTXDUAC-UHFFFAOYSA-N	0	0	265.099	4.052	20	30		CIEDRN
Cc1ccc(Sc2ncc(C#N)cc2Cl)cc1C	ZINC000513624419	333027357	/nfs/dbraw/zinc/02/73/57/333027357.db2.gz	KGRREDFPUSPNHM-UHFFFAOYSA-N	0	0	274.776	4.375	20	30		CIEDRN
Cc1ccc(C)c(Sc2ncc(C#N)cc2Cl)c1	ZINC000513626585	333027561	/nfs/dbraw/zinc/02/75/61/333027561.db2.gz	ZRYUKMCHQWVIHB-UHFFFAOYSA-N	0	0	274.776	4.375	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1Cc2cc(C)ccc2CC1(C)C	ZINC000513628705	333027613	/nfs/dbraw/zinc/02/76/13/333027613.db2.gz	BTEOTMLBQFDMPF-OAHLLOKOSA-N	0	0	285.431	4.261	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1Cc2cc(C)ccc2CC1(C)C	ZINC000513630180	333027674	/nfs/dbraw/zinc/02/76/74/333027674.db2.gz	LVAATUDWKDRJEG-UHFFFAOYSA-N	0	0	297.442	4.427	20	30		CIEDRN
N#Cc1cnc(Oc2cccc(C(F)(F)F)c2)c(Cl)c1	ZINC000513635237	333028306	/nfs/dbraw/zinc/02/83/06/333028306.db2.gz	KXLMDWOGMDHSDD-UHFFFAOYSA-N	0	0	298.651	4.418	20	30		CIEDRN
CCCOc1cccc(Nc2ncc(C#N)cc2Cl)c1	ZINC000513651269	333029204	/nfs/dbraw/zinc/02/92/04/333029204.db2.gz	YAKBAAZQQADYMZ-UHFFFAOYSA-N	0	0	287.750	4.139	20	30		CIEDRN
C=CCCC(=O)N(C)[C@H](C)[C@H](C)c1ccc(Cl)cc1	ZINC000175705686	333029807	/nfs/dbraw/zinc/02/98/07/333029807.db2.gz	HNULXPNOHBNFND-QWHCGFSZSA-N	0	0	279.811	4.257	20	30		CIEDRN
C=CCC[C@H]([NH2+]CCOc1ccccc1F)c1ccco1	ZINC000513671614	333031257	/nfs/dbraw/zinc/03/12/57/333031257.db2.gz	DGEQYKCILQOSQY-HNNXBMFYSA-N	0	0	289.350	4.095	20	30		CIEDRN
CCCCCN(C(=O)Nc1cc(C#N)ccc1C)C(C)C	ZINC000175747813	333031673	/nfs/dbraw/zinc/03/16/73/333031673.db2.gz	QPVYFGZKEYULRI-UHFFFAOYSA-N	0	0	287.407	4.299	20	30		CIEDRN
CCN(C(=O)[C@H]1CCC(C)(C)C1)[C@@H](C)c1ccc(C#N)cc1	ZINC000513709329	333034325	/nfs/dbraw/zinc/03/43/25/333034325.db2.gz	FWRFDLXCIDHMCB-YOEHRIQHSA-N	0	0	298.430	4.294	20	30		CIEDRN
Cc1ccc(Nc2cccc(F)c2C#N)cc1OC(F)F	ZINC000513749533	333037382	/nfs/dbraw/zinc/03/73/82/333037382.db2.gz	SXEHQZKHKATXQF-UHFFFAOYSA-N	0	0	292.260	4.351	20	30		CIEDRN
C=CCCCN(C)C(=O)CCC(C)(C)c1ccccc1	ZINC000513929419	333052392	/nfs/dbraw/zinc/05/23/92/333052392.db2.gz	HCVROSCSAFDDMD-UHFFFAOYSA-N	0	0	273.420	4.169	20	30		CIEDRN
N#Cc1cccc(SCc2cccc3cccnc32)c1	ZINC000177109546	333053725	/nfs/dbraw/zinc/05/37/25/333053725.db2.gz	PDPDYLRKZQJSKW-UHFFFAOYSA-N	0	0	276.364	4.399	20	30		CIEDRN
N#Cc1cccc(SCC(=O)c2ccc(Cl)s2)c1	ZINC000177355706	333058003	/nfs/dbraw/zinc/05/80/03/333058003.db2.gz	RRMQYLSAIRZWSB-UHFFFAOYSA-N	0	0	293.800	4.248	20	30		CIEDRN
C=CCCCC(=O)Nc1ccccc1OC1CCCC1	ZINC000177549822	333060338	/nfs/dbraw/zinc/06/03/38/333060338.db2.gz	NTIOQUCOUDHBKD-UHFFFAOYSA-N	0	0	273.376	4.303	20	30		CIEDRN
C=CCCC(=O)NC[C@@H](Cc1ccccc1)c1ccccc1	ZINC000177615302	333060915	/nfs/dbraw/zinc/06/09/15/333060915.db2.gz	IYLZPWSXQAHBQK-LJQANCHMSA-N	0	0	293.410	4.095	20	30		CIEDRN
C=C(C)CS[C@H](C)C(=O)Nc1cc(Cl)ccc1F	ZINC000177867124	333064575	/nfs/dbraw/zinc/06/45/75/333064575.db2.gz	MRTNPYAGLVYIFC-SECBINFHSA-N	0	0	287.787	4.115	20	30		CIEDRN
C=C(C)CS[C@H](C)C(=O)Nc1ccc(SC)cc1	ZINC000177870106	333064699	/nfs/dbraw/zinc/06/46/99/333064699.db2.gz	VIGWDALPBJRCBA-LLVKDONJSA-N	0	0	281.446	4.045	20	30		CIEDRN
C=CCCCC(=O)N1CCS[C@@H](C)[C@H]1c1ccccc1	ZINC000177869431	333064761	/nfs/dbraw/zinc/06/47/61/333064761.db2.gz	FDDQEEAYSYNBKV-YOEHRIQHSA-N	0	0	289.444	4.048	20	30		CIEDRN
C=CCCCC(=O)N1CCS[C@H](C)[C@@H]1c1ccccc1	ZINC000177869397	333064835	/nfs/dbraw/zinc/06/48/35/333064835.db2.gz	FDDQEEAYSYNBKV-RHSMWYFYSA-N	0	0	289.444	4.048	20	30		CIEDRN
CCC[C@@H](C)[C@@H]1CCCN1C(=O)Nc1cc(C#N)ccc1C	ZINC000178141120	333068345	/nfs/dbraw/zinc/06/83/45/333068345.db2.gz	QIKKYXMPAZJDQM-PBHICJAKSA-N	0	0	299.418	4.299	20	30		CIEDRN
C[C@@H](Sc1ccccc1C#N)c1cccc([N+](=O)[O-])c1	ZINC000172682584	335119105	/nfs/dbraw/zinc/11/91/05/335119105.db2.gz	KQLLEZVRRSXURI-LLVKDONJSA-N	0	0	284.340	4.320	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc([C@H](C)c2c(F)cccc2F)no1	ZINC000516812708	333082972	/nfs/dbraw/zinc/08/29/72/333082972.db2.gz	WMARJLNAEHFDTP-HWPZZCPQSA-N	0	0	292.329	4.353	20	30		CIEDRN
CCC[C@@H](Nc1ccc(C#N)c([N+](=O)[O-])c1)c1ccccc1	ZINC000516823774	333083419	/nfs/dbraw/zinc/08/34/19/333083419.db2.gz	BTHKGWWGVYLECQ-MRXNPFEDSA-N	0	0	295.342	4.420	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)[C@H](C#N)c1ccc(CC)cc1	ZINC000517387961	333098535	/nfs/dbraw/zinc/09/85/35/333098535.db2.gz	QTJUKYIGNIFTIT-GOSISDBHSA-N	0	0	296.414	4.040	20	30		CIEDRN
C=CCOc1cccc(C[NH2+]Cc2ccc([C@@H]3C[C@H]3C)o2)c1	ZINC000517543052	333101792	/nfs/dbraw/zinc/10/17/92/333101792.db2.gz	MZYRXYUCJVMMBR-RDTXWAMCSA-N	0	0	297.398	4.258	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)[C@@H](C)c1cccc(F)c1	ZINC000172764707	335121090	/nfs/dbraw/zinc/12/10/90/335121090.db2.gz	FKJAOBLIYLZENC-HNNXBMFYSA-N	0	0	297.373	4.144	20	30		CIEDRN
C=CCN(CC=C)C(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1	ZINC000520861735	333107038	/nfs/dbraw/zinc/10/70/38/333107038.db2.gz	BJCRICXUHLGPBB-RTBURBONSA-N	0	0	291.394	4.144	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)C[C@@H]2CCCC[C@@H]2C)s1	ZINC000521249871	333116237	/nfs/dbraw/zinc/11/62/37/333116237.db2.gz	FOYSJHYCXLMZOL-RYUDHWBXSA-N	0	0	290.432	4.337	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc2[nH]c(C)cc2c1	ZINC000184232152	333125730	/nfs/dbraw/zinc/12/57/30/333125730.db2.gz	DGAIKOFKTJJIPR-LLVKDONJSA-N	0	0	256.349	4.017	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)NCc1ccc(C(F)F)cc1	ZINC000184280630	333126459	/nfs/dbraw/zinc/12/64/59/333126459.db2.gz	FEQZAFGHLVSFKK-GFCCVEGCSA-N	0	0	296.361	4.168	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)NCc1ccc(C(F)F)cc1	ZINC000184280609	333126509	/nfs/dbraw/zinc/12/65/09/333126509.db2.gz	FEQZAFGHLVSFKK-LBPRGKRZSA-N	0	0	296.361	4.168	20	30		CIEDRN
C=CCCCCS[C@H](C)c1nc(C(C)C)no1	ZINC000575854512	335123874	/nfs/dbraw/zinc/12/38/74/335123874.db2.gz	RCYYYHDDCJEETD-LLVKDONJSA-N	0	0	254.399	4.344	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000184869376	333132825	/nfs/dbraw/zinc/13/28/25/333132825.db2.gz	GFWYHKROIITJPR-INIZCTEOSA-N	0	0	285.431	4.070	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000184910471	333133299	/nfs/dbraw/zinc/13/32/99/333133299.db2.gz	BANZUERUARKJRD-RYUDHWBXSA-N	0	0	299.336	4.485	20	30		CIEDRN
CC#CCCCC(=O)N1CCC(CCc2ccccc2)CC1	ZINC000184940038	333133449	/nfs/dbraw/zinc/13/34/49/333133449.db2.gz	JBIDHMNCSSPGBS-UHFFFAOYSA-N	0	0	297.442	4.051	20	30		CIEDRN
CC#CCCCC(=O)N(C)[C@@H](C)c1cc2ccccc2o1	ZINC000185020573	333134612	/nfs/dbraw/zinc/13/46/12/333134612.db2.gz	KEFALXNBUTZDNN-AWEZNQCLSA-N	0	0	283.371	4.146	20	30		CIEDRN
CC#CCCCC(=O)N[C@H](CC)c1ccc(Cl)cc1	ZINC000185026237	333134634	/nfs/dbraw/zinc/13/46/34/333134634.db2.gz	BJANLEYNHMIIKH-OAHLLOKOSA-N	0	0	277.795	4.101	20	30		CIEDRN
CC#CCCCC(=O)N[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000185086008	333135465	/nfs/dbraw/zinc/13/54/65/333135465.db2.gz	TXAXBUHLBINESW-GFCCVEGCSA-N	0	0	297.320	4.076	20	30		CIEDRN
CC/C=C/CCNc1ccccc1SCCC#N	ZINC000185109722	333135628	/nfs/dbraw/zinc/13/56/28/333135628.db2.gz	MXNVNLRBGQXTEN-ONEGZZNKSA-N	0	0	260.406	4.461	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)Cc1cccc2ccccc21	ZINC000185197593	333136657	/nfs/dbraw/zinc/13/66/57/333136657.db2.gz	GFRPUPAYYDGBHK-OAHLLOKOSA-N	0	0	281.399	4.401	20	30		CIEDRN
CC#CCCCC(=O)N1CCCCC[C@H]1c1ccccc1	ZINC000185218973	333136783	/nfs/dbraw/zinc/13/67/83/333136783.db2.gz	XGUUMJLNPYQCDY-SFHVURJKSA-N	0	0	283.415	4.324	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@H](C)c1cc(F)ccc1F	ZINC000185210493	333136786	/nfs/dbraw/zinc/13/67/86/333136786.db2.gz	OTBSDOQHCPUVTM-NWDGAFQWSA-N	0	0	281.346	4.087	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cccc(COC(C)C)c1	ZINC000185272154	333137972	/nfs/dbraw/zinc/13/79/72/333137972.db2.gz	BXDBOZIRFZYDKQ-CQSZACIVSA-N	0	0	275.392	4.152	20	30		CIEDRN
CC#CCCCC(=O)N[C@H](C)CC(C)(C)c1ccccc1	ZINC000185289070	333138081	/nfs/dbraw/zinc/13/80/81/333138081.db2.gz	MVJMAXKYPNTZAB-MRXNPFEDSA-N	0	0	285.431	4.053	20	30		CIEDRN
CC#CCCCC(=O)N1CCC[C@@H]1[C@@H](CC)c1ccccc1	ZINC000185335464	333139065	/nfs/dbraw/zinc/13/90/65/333139065.db2.gz	STLHFCVOVHDBJF-RBUKOAKNSA-N	0	0	297.442	4.365	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C1CC1)[C@@H]1CCc2ccccc21	ZINC000185443935	333140916	/nfs/dbraw/zinc/14/09/16/333140916.db2.gz	KRUCRCLNDKCMJJ-KBXCAEBGSA-N	0	0	283.415	4.267	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](C)c1nc(C(C)(C)C)cs1	ZINC000185492822	333141877	/nfs/dbraw/zinc/14/18/77/333141877.db2.gz	PGOUSZIHONQDSR-VXGBXAGGSA-N	0	0	294.464	4.220	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc2cnn(C(C)C)c2c1	ZINC000185550461	333143649	/nfs/dbraw/zinc/14/36/49/333143649.db2.gz	PSXMVNJTDJBRLH-ZDUSSCGKSA-N	0	0	285.391	4.158	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H]1Cc1ccc(C)cc1	ZINC000185556488	333143714	/nfs/dbraw/zinc/14/37/14/333143714.db2.gz	BMCRWPAXSVHYSH-FUHWJXTLSA-N	0	0	285.431	4.131	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@](C)(c2ccccc2)C1	ZINC000185557383	333143781	/nfs/dbraw/zinc/14/37/81/333143781.db2.gz	PFNDCHFEBRPJBR-APWZRJJASA-N	0	0	285.431	4.169	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](C)c1cccc(C)c1C	ZINC000185583329	333144224	/nfs/dbraw/zinc/14/42/24/333144224.db2.gz	MVXSTDXVIVDLPF-DZGCQCFKSA-N	0	0	259.393	4.083	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](CC)c1cc(F)ccc1F	ZINC000185648384	333146012	/nfs/dbraw/zinc/14/60/12/333146012.db2.gz	GRMDJZYKOFPCGA-IAQYHMDHSA-N	0	0	281.346	4.134	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@@H](c1ccccc1)C(F)(F)F	ZINC000185680599	333146620	/nfs/dbraw/zinc/14/66/20/333146620.db2.gz	ZHINTVMXVGJKPE-JSGCOSHPSA-N	0	0	299.336	4.351	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC(C)(C)C)CC(F)(F)F	ZINC000185699193	333146821	/nfs/dbraw/zinc/14/68/21/333146821.db2.gz	XWAYJGHKBLRGDV-LLVKDONJSA-N	0	0	279.346	4.026	20	30		CIEDRN
N#C[C@@H]1CCC[C@H](Nc2ccc(CC(F)(F)F)cc2)C1	ZINC000185730462	333147418	/nfs/dbraw/zinc/14/74/18/333147418.db2.gz	QTRUMLLBBBQWQC-OCCSQVGLSA-N	0	0	282.309	4.286	20	30		CIEDRN
CC(C)COc1ccccc1N[C@H]1CCC[C@H](C#N)C1	ZINC000185738319	333147649	/nfs/dbraw/zinc/14/76/49/333147649.db2.gz	BGRKMHNPBLOQAY-GJZGRUSLSA-N	0	0	272.392	4.216	20	30		CIEDRN
CCSc1cccc(N[C@@H]2CCC[C@@H](C#N)C2)c1	ZINC000185747625	333147815	/nfs/dbraw/zinc/14/78/15/333147815.db2.gz	ZMWZWCHNIYLLCS-CHWSQXEVSA-N	0	0	260.406	4.293	20	30		CIEDRN
CC(C)Oc1ccc(F)cc1N[C@H]1CCC[C@H](C#N)C1	ZINC000185745660	333147823	/nfs/dbraw/zinc/14/78/23/333147823.db2.gz	HOQRUBLCQZEXHE-JSGCOSHPSA-N	0	0	276.355	4.107	20	30		CIEDRN
CCSc1cccc(N[C@@H]2CCC[C@H](C#N)C2)c1	ZINC000185747585	333147883	/nfs/dbraw/zinc/14/78/83/333147883.db2.gz	ZMWZWCHNIYLLCS-QWHCGFSZSA-N	0	0	260.406	4.293	20	30		CIEDRN
N#Cc1cccc(OCc2ccc(C(F)F)cc2)c1	ZINC000185780361	333148706	/nfs/dbraw/zinc/14/87/06/333148706.db2.gz	ZUEDDEZLGBZQND-UHFFFAOYSA-N	0	0	259.255	4.075	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccccc1OC(C)(C)C	ZINC000185810648	333149350	/nfs/dbraw/zinc/14/93/50/333149350.db2.gz	JBGKINOWOPEQPL-ZDUSSCGKSA-N	0	0	275.392	4.405	20	30		CIEDRN
Cc1cc2cccnc2c(N[C@H]2CCC[C@@H](C#N)C2)c1	ZINC000185871634	333150787	/nfs/dbraw/zinc/15/07/87/333150787.db2.gz	GRZLYKQGYWQBLX-HIFRSBDPSA-N	0	0	265.360	4.038	20	30		CIEDRN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)C[C@@H]1CCC[C@H]1C	ZINC000185906655	333151683	/nfs/dbraw/zinc/15/16/83/333151683.db2.gz	UNINOYVSAYBZGE-QAPCUYQASA-N	0	0	298.430	4.122	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)c1ccc(F)c(Cl)c1	ZINC000186010638	333153343	/nfs/dbraw/zinc/15/33/43/333153343.db2.gz	PPEMQSIPAHCFSL-SNVBAGLBSA-N	0	0	269.747	4.044	20	30		CIEDRN
C=C(C)[C@@H](NC(=O)C[C@@H]1C=CCC1)c1ccc(F)c(F)c1	ZINC000186044615	333154107	/nfs/dbraw/zinc/15/41/07/333154107.db2.gz	BEUQTLBINMUDBW-SJKOYZFVSA-N	0	0	291.341	4.055	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NC1(c2ccc(F)cc2F)CCC1	ZINC000186105498	333155105	/nfs/dbraw/zinc/15/51/05/333155105.db2.gz	JIOPIOYDOFSTKL-GFCCVEGCSA-N	0	0	293.357	4.063	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(C(C)=O)c(Cl)c1	ZINC000186136805	333155544	/nfs/dbraw/zinc/15/55/44/333155544.db2.gz	BXXSYSCSTFFTNM-JTQLQIEISA-N	0	0	279.767	4.083	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1ccc(CC#N)cc1)c1ccccc1	ZINC000186255347	333157329	/nfs/dbraw/zinc/15/73/29/333157329.db2.gz	ZPVURMQQDCLIQV-SFHVURJKSA-N	0	0	290.366	4.051	20	30		CIEDRN
N#Cc1cc(Cl)ccc1CSc1ccccc1O	ZINC000186601338	333163521	/nfs/dbraw/zinc/16/35/21/333163521.db2.gz	KPQIQADHMBOLLH-UHFFFAOYSA-N	0	0	275.760	4.210	20	30		CIEDRN
C=CCC[C@H](C(=O)NCCc1ccsc1)c1ccccc1	ZINC000186611457	333163544	/nfs/dbraw/zinc/16/35/44/333163544.db2.gz	VXKNWYHVCHOWFN-KRWDZBQOSA-N	0	0	299.439	4.157	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@@H](C)Cc1cccs1)c1ccccc1	ZINC000186628960	333163893	/nfs/dbraw/zinc/16/38/93/333163893.db2.gz	HFZVUQKTINJNEI-YOEHRIQHSA-N	0	0	299.439	4.155	20	30		CIEDRN
Cc1c(Br)cccc1NCC(C)(C)CCC#N	ZINC000220266363	333164633	/nfs/dbraw/zinc/16/46/33/333164633.db2.gz	ANZRWYNREXZGFF-UHFFFAOYSA-N	0	0	295.224	4.499	20	30		CIEDRN
C=CCC[C@@H](C(=O)N(C)C1CCCC1)c1ccccc1	ZINC000186734589	333164758	/nfs/dbraw/zinc/16/47/58/333164758.db2.gz	TXOHFGWFGRGLAE-QGZVFWFLSA-N	0	0	271.404	4.137	20	30		CIEDRN
C[C@@H]1CCC[C@H]1CC(=O)N(C)c1cc(Cl)ccc1C#N	ZINC000186841551	333165559	/nfs/dbraw/zinc/16/55/59/333165559.db2.gz	USKLAAZYJXXISO-NEPJUHHUSA-N	0	0	290.794	4.001	20	30		CIEDRN
C=CCCC(=O)N[C@H](C)c1cc(Cl)ccc1Cl	ZINC000187168000	333168483	/nfs/dbraw/zinc/16/84/83/333168483.db2.gz	NANFDGZVIFSICN-SECBINFHSA-N	0	0	272.175	4.137	20	30		CIEDRN
CC[C@H](CN(CC)C(=O)C1(C#N)CCCC1)c1ccccc1	ZINC000187405356	333170628	/nfs/dbraw/zinc/17/06/28/333170628.db2.gz	RFTRIIDTNCELCK-MRXNPFEDSA-N	0	0	298.430	4.113	20	30		CIEDRN
CC(F)(F)c1cccc(NCc2ccccc2C#N)c1	ZINC000187586725	333172508	/nfs/dbraw/zinc/17/25/08/333172508.db2.gz	ZCQOHTYNBBJOLX-UHFFFAOYSA-N	0	0	272.298	4.282	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1ccc2c(c1)COC2)c1ccccc1	ZINC000188935205	333176572	/nfs/dbraw/zinc/17/65/72/333176572.db2.gz	NJRROJCYFYARNF-SFHVURJKSA-N	0	0	293.366	4.015	20	30		CIEDRN
CC[C@H]1CCCN(c2ccc(C#N)cc2C(F)(F)F)C1	ZINC000521531580	333177140	/nfs/dbraw/zinc/17/71/40/333177140.db2.gz	FNSLEGCAZSCVGY-NSHDSACASA-N	0	0	282.309	4.203	20	30		CIEDRN
CC[C@@H]1CCCN(c2ccc(C#N)cc2C(F)(F)F)C1	ZINC000521531579	333177194	/nfs/dbraw/zinc/17/71/94/333177194.db2.gz	FNSLEGCAZSCVGY-LLVKDONJSA-N	0	0	282.309	4.203	20	30		CIEDRN
N#Cc1ccc(F)c(CSCCOc2ccccc2)c1	ZINC000521557769	333178589	/nfs/dbraw/zinc/17/85/89/333178589.db2.gz	AVCJIGMOSWTQDB-UHFFFAOYSA-N	0	0	287.359	4.010	20	30		CIEDRN
CCC1(CC)CCCN(C(=O)c2cccc(CC#N)c2)CC1	ZINC000189134119	333181792	/nfs/dbraw/zinc/18/17/92/333181792.db2.gz	BDZKWSZHLKQERO-UHFFFAOYSA-N	0	0	298.430	4.185	20	30		CIEDRN
C=CCCCC(=O)NC[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000189138931	333181971	/nfs/dbraw/zinc/18/19/71/333181971.db2.gz	ZZBCVQZKLSGXLP-LBPRGKRZSA-N	0	0	299.336	4.281	20	30		CIEDRN
C=CCN(C(=O)[C@H](CC1CCCC1)C(C)C)C1CC1	ZINC000521687213	333183814	/nfs/dbraw/zinc/18/38/14/333183814.db2.gz	PFKYTZQOZNPNEZ-MRXNPFEDSA-N	0	0	263.425	4.016	20	30		CIEDRN
CN(Cc1c(F)cccc1Cl)c1ccc(C#N)cc1F	ZINC000521707498	333184242	/nfs/dbraw/zinc/18/42/42/333184242.db2.gz	ZIVAUQGNERXIMU-UHFFFAOYSA-N	0	0	292.716	4.126	20	30		CIEDRN
CC(C)C[C@H](C)CC(=O)Nc1cc(C#N)cn1C(C)(C)C	ZINC000521716600	333184726	/nfs/dbraw/zinc/18/47/26/333184726.db2.gz	HEGLTNQIQBIZEW-ZDUSSCGKSA-N	0	0	289.423	4.126	20	30		CIEDRN
C=CCOc1cccc(CNc2cnn([C@@H](C)C3CC3)c2)c1	ZINC000189257044	333188237	/nfs/dbraw/zinc/18/82/37/333188237.db2.gz	UHVMHUHQBAWNNI-AWEZNQCLSA-N	0	0	297.402	4.031	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1csc(Cl)c1	ZINC000189318662	333190360	/nfs/dbraw/zinc/19/03/60/333190360.db2.gz	ALEPSIUCFGOZBL-UHFFFAOYSA-N	0	0	271.813	4.220	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1ccc(C(C)=O)cc1)c1ccccc1	ZINC000189360574	333190842	/nfs/dbraw/zinc/19/08/42/333190842.db2.gz	GQSSCLLUFQUFHD-SFHVURJKSA-N	0	0	293.366	4.188	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1ccccc1C)c1ccccc1	ZINC000189371773	333191287	/nfs/dbraw/zinc/19/12/87/333191287.db2.gz	YJAZAXPIGLJTQG-INIZCTEOSA-N	0	0	265.356	4.293	20	30		CIEDRN
C[C@H](NCc1ccc(C#N)o1)c1cc(Cl)ccc1Cl	ZINC000189468863	333193189	/nfs/dbraw/zinc/19/31/89/333193189.db2.gz	CTAZRUODNBFYLQ-VIFPVBQESA-N	0	0	295.169	4.309	20	30		CIEDRN
C[C@@H](CC#N)Sc1ccccc1NCC[C@@H]1CCCO1	ZINC000189646489	333197229	/nfs/dbraw/zinc/19/72/29/333197229.db2.gz	DNENFSUNLXONJW-KBPBESRZSA-N	0	0	290.432	4.062	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)c1ccc(C)c(Cl)c1	ZINC000189916484	333200572	/nfs/dbraw/zinc/20/05/72/333200572.db2.gz	ZAQGPUYZQMIPKO-UHFFFAOYSA-N	0	0	292.810	4.193	20	30		CIEDRN
CCC(=O)c1ccc(O[C@H](C)c2cccc(C#N)c2)cc1	ZINC000190088006	333203031	/nfs/dbraw/zinc/20/30/31/333203031.db2.gz	WUFBYJVVMNQKII-CYBMUJFWSA-N	0	0	279.339	4.291	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@@H](C)c1ccc(OC(F)F)cc1	ZINC000190071921	333203054	/nfs/dbraw/zinc/20/30/54/333203054.db2.gz	ZFDZGAJNTYKPQZ-ZBEGNZNMSA-N	0	0	297.345	4.068	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@H](C)c1cc(C)sc1C	ZINC000190325863	333205385	/nfs/dbraw/zinc/20/53/85/333205385.db2.gz	CDHZIYZPQDOVND-ABAIWWIYSA-N	0	0	265.422	4.144	20	30		CIEDRN
CSc1cccc(C)c1NCc1ccc(C#N)c(F)c1	ZINC000190402627	333206348	/nfs/dbraw/zinc/20/63/48/333206348.db2.gz	FWDSMPMALXEBBY-UHFFFAOYSA-N	0	0	286.375	4.340	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H](C)c2cccc(OCC)c2)CCC1	ZINC000190485681	333207520	/nfs/dbraw/zinc/20/75/20/333207520.db2.gz	AYKIZJYKIWXYIZ-AWEZNQCLSA-N	0	0	287.403	4.009	20	30		CIEDRN
N#Cc1ccc(C(=O)N2CCCC3(CCCCC3)CC2)cc1	ZINC000190677644	333209467	/nfs/dbraw/zinc/20/94/67/333209467.db2.gz	WZHAAOCFGAMIHG-UHFFFAOYSA-N	0	0	296.414	4.135	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CC[C@@H](C(F)(F)F)C(C)(C)C1	ZINC000190735924	333210173	/nfs/dbraw/zinc/21/01/73/333210173.db2.gz	VBXVBSYFWUSZPM-VXGBXAGGSA-N	0	0	291.357	4.026	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](C(F)(F)F)C(C)(C)C1	ZINC000190735875	333210205	/nfs/dbraw/zinc/21/02/05/333210205.db2.gz	VBXVBSYFWUSZPM-RYUDHWBXSA-N	0	0	291.357	4.026	20	30		CIEDRN
N#Cc1cccc(CNc2ccc(F)c(Cl)c2)c1F	ZINC000223726811	333211481	/nfs/dbraw/zinc/21/14/81/333211481.db2.gz	UVRLAAYPQPCXPI-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
N#Cc1cccc(CNc2cccc(C(F)(F)F)c2)c1F	ZINC000223726189	333211530	/nfs/dbraw/zinc/21/15/30/333211530.db2.gz	COJNSPDYURXJBS-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
Cc1ccc(NCc2cccc(C#N)c2F)cc1Cl	ZINC000223729298	333211554	/nfs/dbraw/zinc/21/15/54/333211554.db2.gz	XSFLDISNZGNRGT-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
Cc1ccc(NCc2cccc(C#N)c2F)c(Cl)c1	ZINC000223726551	333211647	/nfs/dbraw/zinc/21/16/47/333211647.db2.gz	PMPSDNGSWQJUIH-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
N#CCCCSCCOc1ccc(Cl)cc1Cl	ZINC000190871935	333211808	/nfs/dbraw/zinc/21/18/08/333211808.db2.gz	KTPKXXILXFCSPU-UHFFFAOYSA-N	0	0	290.215	4.409	20	30		CIEDRN
CC(C)OCCCS[C@@H](C)c1cccc(C#N)c1	ZINC000191024745	333213699	/nfs/dbraw/zinc/21/36/99/333213699.db2.gz	VQYPBCFYTAKAFV-ZDUSSCGKSA-N	0	0	263.406	4.168	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(C(C)=O)c(Cl)c1	ZINC000191232094	333217101	/nfs/dbraw/zinc/21/71/01/333217101.db2.gz	AENOSWZFMIGFQM-OAHLLOKOSA-N	0	0	279.767	4.083	20	30		CIEDRN
CC(C)(C#N)CCCN1CCC=Cc2ccccc21	ZINC000191291729	333217854	/nfs/dbraw/zinc/21/78/54/333217854.db2.gz	LWNFQRSBJNDDNG-UHFFFAOYSA-N	0	0	254.377	4.240	20	30		CIEDRN
C=CCC1(C(=O)N2CCCC3(CCCCC3)C2)CCC1	ZINC000191615991	333222564	/nfs/dbraw/zinc/22/25/64/333222564.db2.gz	NDXUJWHOUWWSBA-UHFFFAOYSA-N	0	0	275.436	4.306	20	30		CIEDRN
Cc1cc(C#N)ccc1C(=O)N1CC[C@H](C(C)(C)C)C[C@@H]1C	ZINC000521934975	333224013	/nfs/dbraw/zinc/22/40/13/333224013.db2.gz	KFPZSZCPHSXSBJ-HOCLYGCPSA-N	0	0	298.430	4.154	20	30		CIEDRN
N#Cc1ccccc1NC(=O)c1ccc(C2CCC2)cc1	ZINC000191836223	333226005	/nfs/dbraw/zinc/22/60/05/333226005.db2.gz	UJIGMJHASKAMRB-UHFFFAOYSA-N	0	0	276.339	4.078	20	30		CIEDRN
C=CCC1(C(=O)NCc2oc3ccccc3c2C)CCC1	ZINC000191836087	333226011	/nfs/dbraw/zinc/22/60/11/333226011.db2.gz	SXRRLLJTFIMQFM-UHFFFAOYSA-N	0	0	283.371	4.104	20	30		CIEDRN
C=CCC1(C(=O)N2C[C@@H](c3ccccc3)C[C@H]2C)CCC1	ZINC000191841463	333226413	/nfs/dbraw/zinc/22/64/13/333226413.db2.gz	XCWNJQXMXWPVLF-WBVHZDCISA-N	0	0	283.415	4.137	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccccc2OCC2CC2)CCC1	ZINC000191906463	333227317	/nfs/dbraw/zinc/22/73/17/333227317.db2.gz	OTOWXWCPMTUGEF-UHFFFAOYSA-N	0	0	285.387	4.160	20	30		CIEDRN
CCc1nc(C)c([C@@H](C)N(C)CC#Cc2ccccc2)s1	ZINC000192039234	333228726	/nfs/dbraw/zinc/22/87/26/333228726.db2.gz	UEFYNMPJEGFASO-OAHLLOKOSA-N	0	0	298.455	4.058	20	30		CIEDRN
CC(C)c1ccccc1OCCNc1ccc(C#N)cc1	ZINC000521969212	333228777	/nfs/dbraw/zinc/22/87/77/333228777.db2.gz	GGUHTFBGEAVQCY-UHFFFAOYSA-N	0	0	280.371	4.173	20	30		CIEDRN
N#Cc1ccc(OCc2ccc(C(F)(F)F)cc2)c(F)c1	ZINC000225240030	333234139	/nfs/dbraw/zinc/23/41/39/333234139.db2.gz	PAHRWKLVCFNQIB-UHFFFAOYSA-N	0	0	295.235	4.295	20	30		CIEDRN
CCc1ccc(CNc2c(F)cc(C#N)cc2F)s1	ZINC000225545724	333236931	/nfs/dbraw/zinc/23/69/31/333236931.db2.gz	DLXWAXMFTUQJSA-UHFFFAOYSA-N	0	0	278.327	4.072	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2cc(Cl)cc(Cl)c2)CC1	ZINC000522071905	333238369	/nfs/dbraw/zinc/23/83/69/333238369.db2.gz	MEYGHQGVASKOIU-UHFFFAOYSA-N	0	0	299.201	4.423	20	30		CIEDRN
CCc1ccc(CNc2cccc(Cl)c2C#N)s1	ZINC000225720299	333239602	/nfs/dbraw/zinc/23/96/02/333239602.db2.gz	FPFASAJYYXTZCI-UHFFFAOYSA-N	0	0	276.792	4.448	20	30		CIEDRN
C=CCN(CC=C)C(=O)Nc1ccc2c3c(cccc31)CC2	ZINC000192880148	333240333	/nfs/dbraw/zinc/24/03/33/333240333.db2.gz	YYIUACRXAQGKLM-UHFFFAOYSA-N	0	0	292.382	4.144	20	30		CIEDRN
C=CCCCCCOc1ccc(C(C)=O)c(F)c1	ZINC000225807672	333240972	/nfs/dbraw/zinc/24/09/72/333240972.db2.gz	AFBYPXLCYWMEIY-UHFFFAOYSA-N	0	0	250.313	4.154	20	30		CIEDRN
C[C@@H](C#N)N[C@@H](CCCc1ccccc1)c1ccccc1	ZINC000193087614	333242579	/nfs/dbraw/zinc/24/25/79/333242579.db2.gz	ZMMPAEYSKONKBP-LPHOPBHVSA-N	0	0	278.399	4.252	20	30		CIEDRN
N#CCN(C(=O)c1csc2ccccc12)c1ccccc1	ZINC000195121228	333246172	/nfs/dbraw/zinc/24/61/72/333246172.db2.gz	DKZAKUXAOHKIHS-UHFFFAOYSA-N	0	0	292.363	4.072	20	30		CIEDRN
N#CC1(C(=O)Nc2cccc(C(F)F)c2)CCCCC1	ZINC000195420717	333252672	/nfs/dbraw/zinc/25/26/72/333252672.db2.gz	QXKNUCNQONBYSF-UHFFFAOYSA-N	0	0	278.302	4.037	20	30		CIEDRN
C=CCN(CC=C)C(=O)Nc1ccc(O[C@@H](C)CC)cc1	ZINC000193693602	333255664	/nfs/dbraw/zinc/25/56/64/333255664.db2.gz	AQKQZPAJSMPUHB-AWEZNQCLSA-N	0	0	288.391	4.070	20	30		CIEDRN
CCc1ccsc1C(=O)Nc1ccc(C#N)cc1Cl	ZINC000226348478	333257829	/nfs/dbraw/zinc/25/78/29/333257829.db2.gz	GNHIISAXLGTXFD-UHFFFAOYSA-N	0	0	290.775	4.088	20	30		CIEDRN
CC(C)(C)CNc1c(C#N)cnc2c(F)ccc(Cl)c21	ZINC000195640540	333258685	/nfs/dbraw/zinc/25/86/85/333258685.db2.gz	YGQIONRGCMLZRT-UHFFFAOYSA-N	0	0	291.757	4.357	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)N[C@@H](CC)CCC	ZINC000195727538	333262033	/nfs/dbraw/zinc/26/20/33/333262033.db2.gz	BDRLEIIBPCEKRL-HNNXBMFYSA-N	0	0	292.398	4.102	20	30		CIEDRN
C=CCC[C@@H](C)Nc1ccc(C)c(C(=O)N(C)C(C)C)c1	ZINC000194238960	333268004	/nfs/dbraw/zinc/26/80/04/333268004.db2.gz	HHPUQECCWIKJEP-OAHLLOKOSA-N	0	0	288.435	4.242	20	30		CIEDRN
CC(=O)c1ccc(O[C@H](C)c2ccc(C#N)cc2)c(F)c1	ZINC000194643853	333274377	/nfs/dbraw/zinc/27/43/77/333274377.db2.gz	QTHQPZLEFUVKNY-GFCCVEGCSA-N	0	0	283.302	4.040	20	30		CIEDRN
CCC(CC)n1ccc(COc2cc(C#N)ccc2C)n1	ZINC000227061395	333275473	/nfs/dbraw/zinc/27/54/73/333275473.db2.gz	BVVZPLWXLGSAKT-UHFFFAOYSA-N	0	0	283.375	4.003	20	30		CIEDRN
C[C@@H]1CCC[C@H](CNc2nc(C(F)(F)F)ccc2C#N)C1	ZINC000227115619	333276502	/nfs/dbraw/zinc/27/65/02/333276502.db2.gz	RKPYEVYDTCNYLO-MNOVXSKESA-N	0	0	297.324	4.210	20	30		CIEDRN
C[C@H]1CCC[C@@H](CNc2nc(C(F)(F)F)ccc2C#N)C1	ZINC000227115615	333276535	/nfs/dbraw/zinc/27/65/35/333276535.db2.gz	RKPYEVYDTCNYLO-WDEREUQCSA-N	0	0	297.324	4.210	20	30		CIEDRN
C[C@@H]1CC[C@H](Nc2nc(C(F)(F)F)ccc2C#N)[C@@H](C)C1	ZINC000227116708	333276674	/nfs/dbraw/zinc/27/66/74/333276674.db2.gz	BGFRTCKAIMFYEN-SCVCMEIPSA-N	0	0	297.324	4.209	20	30		CIEDRN
C=CCSCc1csc(Cc2ccccc2)n1	ZINC000522283057	333278977	/nfs/dbraw/zinc/27/89/77/333278977.db2.gz	VLSXCQNQBJQIDY-UHFFFAOYSA-N	0	0	261.415	4.153	20	30		CIEDRN
CC1(C#N)CCN(Cc2cc(Cl)ccc2Cl)CC1	ZINC000227353600	333281400	/nfs/dbraw/zinc/28/14/00/333281400.db2.gz	MVHZHHOBCSCQFK-UHFFFAOYSA-N	0	0	283.202	4.119	20	30		CIEDRN
CS[C@H]1CCC[C@H](Nc2ccc(Cl)cc2C#N)C1	ZINC000227358047	333281674	/nfs/dbraw/zinc/28/16/74/333281674.db2.gz	UGQABLPTUVILGM-STQMWFEESA-N	0	0	280.824	4.298	20	30		CIEDRN
C[C@H](CCC1CCCCC1)NC(=O)c1ccc(C#N)cc1	ZINC000522316206	333282376	/nfs/dbraw/zinc/28/23/76/333282376.db2.gz	ICMKDHZMYDEZOU-CQSZACIVSA-N	0	0	284.403	4.037	20	30		CIEDRN
COC(=O)c1ccc(S[C@H](C#N)C2CCCCC2)cc1	ZINC000522333390	333282885	/nfs/dbraw/zinc/28/28/85/333282885.db2.gz	UORBXQNZFFOBKB-OAHLLOKOSA-N	0	0	289.400	4.038	20	30		CIEDRN
C[C@@H](C(=O)Nc1sc2c(c1C#N)CCCC2)C(C)(C)C	ZINC000522334780	333283054	/nfs/dbraw/zinc/28/30/54/333283054.db2.gz	OOVJIFLZHYQXQV-JTQLQIEISA-N	0	0	290.432	4.119	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)[C@@H](C)C(C)(C)C)c1	ZINC000522335042	333283146	/nfs/dbraw/zinc/28/31/46/333283146.db2.gz	ZRGROEKXWKOGOK-CYBMUJFWSA-N	0	0	275.392	4.262	20	30		CIEDRN
N#Cc1cc(NCc2cc(F)cc(F)c2)ccc1Cl	ZINC000227555312	333285421	/nfs/dbraw/zinc/28/54/21/333285421.db2.gz	PMULBXNSFHIXSJ-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
CS[C@H]1CCC[C@@H](Nc2cc(C#N)c3ccccc3n2)C1	ZINC000227652636	333287307	/nfs/dbraw/zinc/28/73/07/333287307.db2.gz	VWIKWCXBMCBWKE-KGLIPLIRSA-N	0	0	297.427	4.193	20	30		CIEDRN
C=CCCC(=O)N(C)[C@H](C)c1ccc(Cl)c(Cl)c1	ZINC000522473212	333287685	/nfs/dbraw/zinc/28/76/85/333287685.db2.gz	IAKPWPINRZFZKW-SNVBAGLBSA-N	0	0	286.202	4.479	20	30		CIEDRN
Cc1cc(C#N)ccc1-c1nc(-c2ccc(Cl)cc2)no1	ZINC000227793630	333288499	/nfs/dbraw/zinc/28/84/99/333288499.db2.gz	POWNZYNIDFIZFH-UHFFFAOYSA-N	0	0	295.729	4.237	20	30		CIEDRN
C=CCCC(=O)N[C@@H](c1cccs1)C(CC)CC	ZINC000522569995	333290649	/nfs/dbraw/zinc/29/06/49/333290649.db2.gz	CEKUWQZHDUHTHW-OAHLLOKOSA-N	0	0	265.422	4.308	20	30		CIEDRN
C=CC[C@H](C)NC(=O)C1CCC(CCCC)CC1	ZINC000522636731	333293825	/nfs/dbraw/zinc/29/38/25/333293825.db2.gz	NNCLUXPJGKBADK-NFOMZHRRSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)c1sccc1-c1ccc(C)cc1	ZINC000522643377	333294433	/nfs/dbraw/zinc/29/44/33/333294433.db2.gz	UJMDABPXTWLBPI-CYBMUJFWSA-N	0	0	285.412	4.418	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)c1ccccc1Nc1ccccc1	ZINC000522644611	333294646	/nfs/dbraw/zinc/29/46/46/333294646.db2.gz	BZKGFBAXFSXCMA-CQSZACIVSA-N	0	0	280.371	4.125	20	30		CIEDRN
CCCC[C@H](CC)CC(=O)N(C)c1cccc(C#N)c1	ZINC000522666758	333295803	/nfs/dbraw/zinc/29/58/03/333295803.db2.gz	ZIQXMHRWFQZVOD-AWEZNQCLSA-N	0	0	272.392	4.128	20	30		CIEDRN
C=CCCCN(C)C(=O)c1ccc(Cl)cc1Cl	ZINC000522940199	333300784	/nfs/dbraw/zinc/30/07/84/333300784.db2.gz	ZFGZNIDKIKLUPP-UHFFFAOYSA-N	0	0	272.175	4.032	20	30		CIEDRN
CSCCCCCNc1c(C#N)cnc2ccccc21	ZINC000229570367	333306466	/nfs/dbraw/zinc/30/64/66/333306466.db2.gz	CNNAHIAPGFUFAA-UHFFFAOYSA-N	0	0	285.416	4.052	20	30		CIEDRN
CC(C)(CCC#N)CNc1ccc(C#N)cc1C(F)(F)F	ZINC000229678315	333307519	/nfs/dbraw/zinc/30/75/19/333307519.db2.gz	XEHHIJLILFHQQM-UHFFFAOYSA-N	0	0	295.308	4.319	20	30		CIEDRN
Cc1c(Cl)cccc1NCc1ccc(F)c(C#N)c1	ZINC000229721215	333308508	/nfs/dbraw/zinc/30/85/08/333308508.db2.gz	IHPWCVSNCOUFLB-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
N#Cc1cc(CSCc2ccccc2)ccc1F	ZINC000229721357	333308547	/nfs/dbraw/zinc/30/85/47/333308547.db2.gz	DWJLWAYEURGULB-UHFFFAOYSA-N	0	0	257.333	4.131	20	30		CIEDRN
N#Cc1cc(CSc2ccc(F)cc2)ccc1F	ZINC000229753094	333309157	/nfs/dbraw/zinc/30/91/57/333309157.db2.gz	SFMJUZHPRIZDBT-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
N#Cc1cc(CSc2cccc(F)c2)ccc1F	ZINC000229754521	333309466	/nfs/dbraw/zinc/30/94/66/333309466.db2.gz	MREDTKHZNYMSQH-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
CCc1ccc([C@H](C)CC(=O)N(CC#N)C2CCCC2)cc1	ZINC000523137299	333310294	/nfs/dbraw/zinc/31/02/94/333310294.db2.gz	RQAIYSIFBHQUSV-OAHLLOKOSA-N	0	0	298.430	4.037	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(C)cc1OCc1ccccc1	ZINC000523273390	333313528	/nfs/dbraw/zinc/31/35/28/333313528.db2.gz	GKNHXQMGLANQLJ-UHFFFAOYSA-N	0	0	295.382	4.479	20	30		CIEDRN
C=CCCC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C(C)C	ZINC000523269688	333313601	/nfs/dbraw/zinc/31/36/01/333313601.db2.gz	KXCQMLQHAIGWAT-OAHLLOKOSA-N	0	0	299.336	4.485	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(OCCCC)cc1C	ZINC000523272276	333313631	/nfs/dbraw/zinc/31/36/31/333313631.db2.gz	MRNWXHNZTPSKGP-UHFFFAOYSA-N	0	0	261.365	4.079	20	30		CIEDRN
C=CCCC(=O)N1CC=C(c2cccc3ccccc32)CC1	ZINC000523285086	333314587	/nfs/dbraw/zinc/31/45/87/333314587.db2.gz	WMOAYBHBYYRESS-UHFFFAOYSA-N	0	0	291.394	4.422	20	30		CIEDRN
C=CCC(F)(F)c1nc([C@@H](C)c2ccc(C)cc2)no1	ZINC000564194508	333315508	/nfs/dbraw/zinc/31/55/08/333315508.db2.gz	XSLIDIGXLUAEHB-NSHDSACASA-N	0	0	278.302	4.198	20	30		CIEDRN
Cc1ccc(Cl)c(NCc2ccc(F)c(C#N)c2)c1	ZINC000230213124	333315957	/nfs/dbraw/zinc/31/59/57/333315957.db2.gz	NMBHZXWNMBIMCP-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
C[C@@H](Nc1cccc(F)c1C#N)c1cccc(F)c1F	ZINC000231631888	333326309	/nfs/dbraw/zinc/32/63/09/333326309.db2.gz	UHHVXXWBQGYFCI-SECBINFHSA-N	0	0	276.261	4.149	20	30		CIEDRN
C[C@H](Nc1ccc(C#N)cc1F)c1cccc(F)c1F	ZINC000231631883	333326348	/nfs/dbraw/zinc/32/63/48/333326348.db2.gz	DZIOECWDZNETOD-VIFPVBQESA-N	0	0	276.261	4.149	20	30		CIEDRN
N#CCN(CCc1ccc2ccccc2c1)C1CCCC1	ZINC000523442304	333326997	/nfs/dbraw/zinc/32/69/97/333326997.db2.gz	VMRZGXCFKWXAMP-UHFFFAOYSA-N	0	0	278.399	4.150	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1sc(CCC)nc1C	ZINC000523510205	333331317	/nfs/dbraw/zinc/33/13/17/333331317.db2.gz	XIGPFRHBHLURHO-UHFFFAOYSA-N	0	0	294.464	4.222	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@H](C)Cc1cccc(F)c1	ZINC000523511698	333331516	/nfs/dbraw/zinc/33/15/16/333331516.db2.gz	UMXHEJZGBVTASA-OAHLLOKOSA-N	0	0	291.410	4.209	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@@H](SC)c1ccccc1	ZINC000523512822	333331678	/nfs/dbraw/zinc/33/16/78/333331678.db2.gz	UAXDSUMKOUFSOI-INIZCTEOSA-N	0	0	291.460	4.296	20	30		CIEDRN
C=CCCSCC(=O)Nc1cccc(C(C)C)c1	ZINC000523520571	333331963	/nfs/dbraw/zinc/33/19/63/333331963.db2.gz	YKGHEXIYKMAYCV-UHFFFAOYSA-N	0	0	263.406	4.058	20	30		CIEDRN
C=CCCS[C@H](C)C(=O)N[C@@H](C)c1ccc(CC)cc1	ZINC000523522770	333332133	/nfs/dbraw/zinc/33/21/33/333332133.db2.gz	ANRWVXPLVWLSLA-UONOGXRCSA-N	0	0	291.460	4.124	20	30		CIEDRN
C=CCCS[C@@H](C)C(=O)N[C@H](C)c1ccc(CC)cc1	ZINC000523522769	333332190	/nfs/dbraw/zinc/33/21/90/333332190.db2.gz	ANRWVXPLVWLSLA-KGLIPLIRSA-N	0	0	291.460	4.124	20	30		CIEDRN
C=CCCCCCN(C)Cc1nccn1Cc1ccccc1	ZINC000523552109	333332848	/nfs/dbraw/zinc/33/28/48/333332848.db2.gz	ODISCURKHYZVOK-UHFFFAOYSA-N	0	0	297.446	4.110	20	30		CIEDRN
C=C[C@@H](Cc1nc(-c2ccc(C)o2)no1)c1ccccc1	ZINC000575946830	335134500	/nfs/dbraw/zinc/13/45/00/335134500.db2.gz	IQHXXHGSCJHQGX-ZDUSSCGKSA-N	0	0	280.327	4.150	20	30		CIEDRN
C=C[C@H](Cc1nc(-c2ccc(C)o2)no1)c1ccccc1	ZINC000575946827	335134505	/nfs/dbraw/zinc/13/45/05/335134505.db2.gz	IQHXXHGSCJHQGX-CYBMUJFWSA-N	0	0	280.327	4.150	20	30		CIEDRN
C[C@@H](CC(=O)Nc1cccc(C#N)c1)C1CCCCC1	ZINC000303102466	333337708	/nfs/dbraw/zinc/33/77/08/333337708.db2.gz	IHAPOIKSDKXVOK-ZDUSSCGKSA-N	0	0	270.376	4.103	20	30		CIEDRN
N#Cc1ccc(Sc2cccc(Cl)c2)c([N+](=O)[O-])c1	ZINC000303120248	333337756	/nfs/dbraw/zinc/33/77/56/333337756.db2.gz	IFJIRBPEHLSJHJ-UHFFFAOYSA-N	0	0	290.731	4.271	20	30		CIEDRN
C=CCCCCCOc1ccc(C(C)=O)cc1F	ZINC000232566970	333338806	/nfs/dbraw/zinc/33/88/06/333338806.db2.gz	NCMPSUXIJUWQRS-UHFFFAOYSA-N	0	0	250.313	4.154	20	30		CIEDRN
N#Cc1cccc(Cl)c1NCCCOC1CCCCC1	ZINC000303454605	333342447	/nfs/dbraw/zinc/34/24/47/333342447.db2.gz	KJUQYDSIRXUFRO-UHFFFAOYSA-N	0	0	292.810	4.363	20	30		CIEDRN
CC[C@@H](Sc1ccccc1)C(=O)Nc1cccc(C#N)c1	ZINC000303459811	333342489	/nfs/dbraw/zinc/34/24/89/333342489.db2.gz	LMERDTIIPQVTBO-MRXNPFEDSA-N	0	0	296.395	4.068	20	30		CIEDRN
N#Cc1ccc(NCc2cc3c(s2)CCCC3)c(F)c1	ZINC000523746207	333343459	/nfs/dbraw/zinc/34/34/59/333343459.db2.gz	KDZBXLRBFZAEPF-UHFFFAOYSA-N	0	0	286.375	4.250	20	30		CIEDRN
N#Cc1ccc(N2CCC[C@@]3(CC=CCC3)C2)c(F)c1	ZINC000303553506	333343717	/nfs/dbraw/zinc/34/37/17/333343717.db2.gz	JZNLGZWLDWYQRO-KRWDZBQOSA-N	0	0	270.351	4.024	20	30		CIEDRN
N#Cc1ccc(N2CCC[C@]3(CC=CCC3)C2)c(F)c1	ZINC000303553508	333343760	/nfs/dbraw/zinc/34/37/60/333343760.db2.gz	JZNLGZWLDWYQRO-QGZVFWFLSA-N	0	0	270.351	4.024	20	30		CIEDRN
CCC(=O)c1ccc(OCCCCC(C)(C)C#N)cc1	ZINC000232876428	333344590	/nfs/dbraw/zinc/34/45/90/333344590.db2.gz	LFTGRPJSJZULFH-UHFFFAOYSA-N	0	0	273.376	4.378	20	30		CIEDRN
Cc1ccccc1[C@H]1C[C@H](C)N(c2ccc(C#N)cc2F)C1	ZINC000303768398	333346114	/nfs/dbraw/zinc/34/61/14/333346114.db2.gz	IYRLNIXQAPHEDP-HOCLYGCPSA-N	0	0	294.373	4.388	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)c1cccc(Oc2ccccc2)c1	ZINC000523968416	333350272	/nfs/dbraw/zinc/35/02/72/333350272.db2.gz	SFGLBAQRHPTDRL-CQSZACIVSA-N	0	0	281.355	4.173	20	30		CIEDRN
CC(C)c1ccc(C(=O)N[C@]2(C#N)CCC[C@H](C)C2)cc1	ZINC000523969538	333350290	/nfs/dbraw/zinc/35/02/90/333350290.db2.gz	UTJRFJOQKPXTGA-KBXCAEBGSA-N	0	0	284.403	4.012	20	30		CIEDRN
C=CC[C@H](C)NC(=O)c1cc(C(C)C)nc2ccccc21	ZINC000523963093	333350323	/nfs/dbraw/zinc/35/03/23/333350323.db2.gz	XIBLNWCKJWLQCZ-ZDUSSCGKSA-N	0	0	282.387	4.053	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)c1cc(C(C)C)nc2ccccc21	ZINC000523963092	333350351	/nfs/dbraw/zinc/35/03/51/333350351.db2.gz	XIBLNWCKJWLQCZ-CYBMUJFWSA-N	0	0	282.387	4.053	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)[C@H](CCC)CC1CCCCC1	ZINC000523967369	333350357	/nfs/dbraw/zinc/35/03/57/333350357.db2.gz	LUJXTQLLLFAYNU-GDBMZVCRSA-N	0	0	265.441	4.454	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1cccc(OCC(C)C)c1	ZINC000524075058	333352941	/nfs/dbraw/zinc/35/29/41/333352941.db2.gz	GVCZXDXCGCTXKD-UHFFFAOYSA-N	0	0	290.407	4.151	20	30		CIEDRN
C=CC[C@H](C)NC(=O)[C@H](CC)CC1CCCCC1	ZINC000524194712	333355994	/nfs/dbraw/zinc/35/59/94/333355994.db2.gz	ITGKYTFJIBLWGZ-DZGCQCFKSA-N	0	0	251.414	4.064	20	30		CIEDRN
CCCC[C@@H](CC)CC(=O)Nc1ccc(CC#N)cc1	ZINC000524208905	333356398	/nfs/dbraw/zinc/35/63/98/333356398.db2.gz	QTBWWASGOJTOIE-CQSZACIVSA-N	0	0	272.392	4.298	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1ccc(OC2CCCC2)cc1	ZINC000524207408	333356429	/nfs/dbraw/zinc/35/64/29/333356429.db2.gz	DBHRMIZMWXPBQI-ZDUSSCGKSA-N	0	0	288.391	4.094	20	30		CIEDRN
C[C@@H](CCc1ccccc1)Nc1nccc(C#N)c1Cl	ZINC000235108595	333365907	/nfs/dbraw/zinc/36/59/07/333365907.db2.gz	OTISYJWEJGAQLZ-LBPRGKRZSA-N	0	0	285.778	4.040	20	30		CIEDRN
C[C@@H](Nc1nccc(C#N)c1Cl)c1cccc(Cl)c1	ZINC000235285662	333367325	/nfs/dbraw/zinc/36/73/25/333367325.db2.gz	VLAAFZLARWHMJW-SECBINFHSA-N	0	0	292.169	4.433	20	30		CIEDRN
C[C@H](Nc1nccc(C#N)c1Cl)c1ccc(Cl)s1	ZINC000235538830	333370562	/nfs/dbraw/zinc/37/05/62/333370562.db2.gz	DKEAJQKPVZIPQI-ZETCQYMHSA-N	0	0	298.198	4.495	20	30		CIEDRN
C=CCOc1ccc(CNc2cccc3cccnc32)cc1	ZINC000236684761	333374533	/nfs/dbraw/zinc/37/45/33/333374533.db2.gz	NOPNDKWGZNOLIB-UHFFFAOYSA-N	0	0	290.366	4.412	20	30		CIEDRN
N#CCCOCCSc1cc(Cl)ccc1Cl	ZINC000338526576	335137010	/nfs/dbraw/zinc/13/70/10/335137010.db2.gz	PZAMUZOHQNGEIC-UHFFFAOYSA-N	0	0	276.188	4.016	20	30		CIEDRN
N#Cc1cccc(NCc2cnc(-c3ccccc3)s2)c1	ZINC000237849354	333381909	/nfs/dbraw/zinc/38/19/09/333381909.db2.gz	OGMBEOFNXJHBOW-UHFFFAOYSA-N	0	0	291.379	4.294	20	30		CIEDRN
C[C@H](CCc1ccco1)Nc1cc(C#N)c2ccccc2n1	ZINC000315682761	333382839	/nfs/dbraw/zinc/38/28/39/333382839.db2.gz	MBOHOQLBTFSVMN-CYBMUJFWSA-N	0	0	291.354	4.133	20	30		CIEDRN
C=CCCCCCN(C)C(=O)N[C@H](C)CCC(C)C	ZINC000524799954	333388593	/nfs/dbraw/zinc/38/85/93/333388593.db2.gz	YOKCGTJJMYIGHG-OAHLLOKOSA-N	0	0	268.445	4.199	20	30		CIEDRN
Cc1cccc(C)c1C(=O)Nc1ccc(Cl)c(C#N)c1	ZINC000524812632	333389423	/nfs/dbraw/zinc/38/94/23/333389423.db2.gz	CHBJXVIEJVKCJG-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)NC[C@@H](C)C(C)C)c1	ZINC000524832548	333389764	/nfs/dbraw/zinc/38/97/64/333389764.db2.gz	YYIIMRTVXAPBOA-CQSZACIVSA-N	0	0	290.407	4.055	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@@H]1CCC[C@H](C)C1	ZINC000524983873	333394734	/nfs/dbraw/zinc/39/47/34/333394734.db2.gz	FMCMOKYZBMZVMF-LSDHHAIUSA-N	0	0	251.414	4.018	20	30		CIEDRN
N#Cc1ccc(CSc2ccc(C#N)cc2F)c(F)c1	ZINC000524987800	333395022	/nfs/dbraw/zinc/39/50/22/333395022.db2.gz	LTSKDLRLSQJDPC-UHFFFAOYSA-N	0	0	286.306	4.000	20	30		CIEDRN
N#Cc1ccccc1SCCCc1ccccc1	ZINC000525083428	333398350	/nfs/dbraw/zinc/39/83/50/333398350.db2.gz	QSXWXNNWELBJFY-UHFFFAOYSA-N	0	0	253.370	4.283	20	30		CIEDRN
N#Cc1cc2c(nc1NCc1ccc3ccccc3c1)CCC2	ZINC000525194702	333403074	/nfs/dbraw/zinc/40/30/74/333403074.db2.gz	HLDDAZYXSMTSBO-UHFFFAOYSA-N	0	0	299.377	4.207	20	30		CIEDRN
C=CC1CCN(C(=O)[C@H](CC(C)C)c2ccccc2)CC1	ZINC000525336121	333409514	/nfs/dbraw/zinc/40/95/14/333409514.db2.gz	NDXOVHUZQVCQOE-GOSISDBHSA-N	0	0	285.431	4.241	20	30		CIEDRN
C=CC1CCN(C(=O)c2cc3cscc3s2)CC1	ZINC000528518069	333443890	/nfs/dbraw/zinc/44/38/90/333443890.db2.gz	FSSPJGXPVQQXEJ-UHFFFAOYSA-N	0	0	277.414	4.001	20	30		CIEDRN
C[C@@H](Nc1ccc(CC#N)cc1)c1ccc(F)cc1F	ZINC000037071335	333472293	/nfs/dbraw/zinc/47/22/93/333472293.db2.gz	VJJAWDIWKKAZNT-LLVKDONJSA-N	0	0	272.298	4.204	20	30		CIEDRN
CCC(C#N)(CC)C(=O)N[C@@H]1CCC[C@@H](c2ccccc2)C1	ZINC000529163078	333475379	/nfs/dbraw/zinc/47/53/79/333475379.db2.gz	CYNACXXRVQGJOD-IAGOWNOFSA-N	0	0	298.430	4.159	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1sc2ncccc2c1Cl	ZINC000529252242	333479732	/nfs/dbraw/zinc/47/97/32/333479732.db2.gz	FLOQRYFCJQFGQM-VIFPVBQESA-N	0	0	294.807	4.034	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1cc2c(cc1Cl)CCC2	ZINC000529289265	333481979	/nfs/dbraw/zinc/48/19/79/333481979.db2.gz	OFSZNBDAJJRQFX-UHFFFAOYSA-N	0	0	292.810	4.259	20	30		CIEDRN
CSc1ccc(N[C@H](C)c2cccc(C#N)c2)cc1	ZINC000037197712	333512435	/nfs/dbraw/zinc/51/24/35/333512435.db2.gz	XTJKWMQUSCHZKR-GFCCVEGCSA-N	0	0	268.385	4.453	20	30		CIEDRN
Cc1cc(C)cc(N[C@@H](C)c2cccc(C#N)c2)c1	ZINC000037212560	333514879	/nfs/dbraw/zinc/51/48/79/333514879.db2.gz	ZSVXHWUXIWDKIH-AWEZNQCLSA-N	0	0	250.345	4.348	20	30		CIEDRN
COc1ccc([C@@H](C)Nc2ccc(C#N)c(Cl)c2)cc1	ZINC000037393279	333532513	/nfs/dbraw/zinc/53/25/13/333532513.db2.gz	AVRAZRGOFOJUKF-LLVKDONJSA-N	0	0	286.762	4.393	20	30		CIEDRN
N#Cc1ccc(N2CCC3(CCCC3)CC2)cc1Cl	ZINC000062959428	333555390	/nfs/dbraw/zinc/55/53/90/333555390.db2.gz	JVODUNKIGVFOET-UHFFFAOYSA-N	0	0	274.795	4.372	20	30		CIEDRN
C=C(CC)CSCc1nc(-c2ccc(F)c(F)c2)no1	ZINC000537993193	333569698	/nfs/dbraw/zinc/56/96/98/333569698.db2.gz	IVTIVZFWILLZGT-UHFFFAOYSA-N	0	0	296.342	4.214	20	30		CIEDRN
C=C(CC)CNc1ccccc1SC[C@H](C)C#N	ZINC000537994682	333570006	/nfs/dbraw/zinc/57/00/06/333570006.db2.gz	GFTLPWBZFTXKKU-CYBMUJFWSA-N	0	0	260.406	4.316	20	30		CIEDRN
C=C(CC)CSc1nnc(-c2ccc(Cl)cc2)n1C	ZINC000538016929	333571025	/nfs/dbraw/zinc/57/10/25/333571025.db2.gz	ZFAZHLUSNJOPSP-UHFFFAOYSA-N	0	0	293.823	4.194	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)COc1ccccc1C(C)C	ZINC000538325846	333585332	/nfs/dbraw/zinc/58/53/32/333585332.db2.gz	GXNXFZQJBPVMMV-HNNXBMFYSA-N	0	0	289.419	4.050	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1oc2ccccc2c1C	ZINC000538332906	333585453	/nfs/dbraw/zinc/58/54/53/333585453.db2.gz	RQRONQAAGIOGSH-GFCCVEGCSA-N	0	0	271.360	4.216	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)CC/C=C/c1ccccc1	ZINC000538326158	333585502	/nfs/dbraw/zinc/58/55/02/333585502.db2.gz	NKLOFPMDIJCZOQ-IDJPSDCMSA-N	0	0	271.404	4.341	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1c(C)cc(C)cc1C	ZINC000538333346	333585759	/nfs/dbraw/zinc/58/57/59/333585759.db2.gz	ZJHFYOUJOXBKQE-HNNXBMFYSA-N	0	0	259.393	4.086	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)NC(C)(C)c1cccs1	ZINC000538368080	333587350	/nfs/dbraw/zinc/58/73/50/333587350.db2.gz	WHTWKLKEEWTRCW-LBPRGKRZSA-N	0	0	280.437	4.027	20	30		CIEDRN
CSc1ccc(C)c(NCCOc2cccc(C#N)c2)c1	ZINC000538415430	333589751	/nfs/dbraw/zinc/58/97/51/333589751.db2.gz	HZQMNDSQPQPEFM-UHFFFAOYSA-N	0	0	298.411	4.080	20	30		CIEDRN
C=CCCS[C@@H](C)c1cc([N+](=O)[O-])ccc1C	ZINC000538703997	333612587	/nfs/dbraw/zinc/61/25/87/333612587.db2.gz	VPMLRUWQGMGOQT-NSHDSACASA-N	0	0	251.351	4.274	20	30		CIEDRN
C=C(C)CSCc1csc(-c2ccccn2)n1	ZINC000126904978	333613757	/nfs/dbraw/zinc/61/37/57/333613757.db2.gz	PGRCOYSSMJJYAD-UHFFFAOYSA-N	0	0	262.403	4.014	20	30		CIEDRN
C/C=C/C=C/C(=O)Nc1ccccc1S[C@H](C)CC#N	ZINC000066800833	333629228	/nfs/dbraw/zinc/62/92/28/333629228.db2.gz	XFTZVJQKOPOFMA-CNKIBNQGSA-N	0	0	286.400	4.152	20	30		CIEDRN
C=C(CC)Cn1cnc2scc(-c3ccccc3)c2c1=O	ZINC000539101753	333658080	/nfs/dbraw/zinc/65/80/80/333658080.db2.gz	MSJCLSKJTJIWNN-UHFFFAOYSA-N	0	0	296.395	4.091	20	30		CIEDRN
C=C(CC)CSc1nnc(-c2cccs2)n1C1CC1	ZINC000539111355	333659047	/nfs/dbraw/zinc/65/90/47/333659047.db2.gz	AJYRYNRLCRQXHM-UHFFFAOYSA-N	0	0	291.445	4.400	20	30		CIEDRN
C=C(CC)CSc1nnc(-c2ccccc2)n1CC	ZINC000539112806	333659076	/nfs/dbraw/zinc/65/90/76/333659076.db2.gz	HXTLIVKKGALKRV-UHFFFAOYSA-N	0	0	273.405	4.023	20	30		CIEDRN
CCN(C(=O)C1=C(C)CCC1)c1ccc(C#N)c(Cl)c1	ZINC000539172771	333660211	/nfs/dbraw/zinc/66/02/11/333660211.db2.gz	LUHWGCNNKNUIQL-UHFFFAOYSA-N	0	0	288.778	4.065	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1ccc(C)c(OC)c1C	ZINC000539443480	333671728	/nfs/dbraw/zinc/67/17/28/333671728.db2.gz	VICOXKDNEVBSHK-ZDUSSCGKSA-N	0	0	290.407	4.178	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1cc(C)n(C(CC)CC)n1	ZINC000539540607	333677231	/nfs/dbraw/zinc/67/72/31/333677231.db2.gz	QAFYTHUCVHNFIW-CYBMUJFWSA-N	0	0	291.439	4.027	20	30		CIEDRN
C=CCCSc1nnc(-c2ccccc2F)n1C1CC1	ZINC000128522115	333681350	/nfs/dbraw/zinc/68/13/50/333681350.db2.gz	INNJLMYCCVIXLD-UHFFFAOYSA-N	0	0	289.379	4.087	20	30		CIEDRN
CC(C)CCCSCCC(=O)Nc1cccc(C#N)c1	ZINC000539615803	333681556	/nfs/dbraw/zinc/68/15/56/333681556.db2.gz	KNATXTMBTUGAJK-UHFFFAOYSA-N	0	0	290.432	4.056	20	30		CIEDRN
Cc1cc(C(=O)N(CCC#N)CCC(C)C)ccc1Cl	ZINC000128560134	333686315	/nfs/dbraw/zinc/68/63/15/333686315.db2.gz	CXFSZJXZEKWGTG-UHFFFAOYSA-N	0	0	292.810	4.050	20	30		CIEDRN
N#CC1(COc2ccc(Cl)c(C(F)(F)F)c2)CC1	ZINC000539761120	333689591	/nfs/dbraw/zinc/68/95/91/333689591.db2.gz	KSYPPFRWOFAGCZ-UHFFFAOYSA-N	0	0	275.657	4.041	20	30		CIEDRN
C=C(CC)CSCC(=O)Nc1ccc(F)c(Cl)c1	ZINC000540193351	333720087	/nfs/dbraw/zinc/72/00/87/333720087.db2.gz	QNMIDJXFEPLQJD-UHFFFAOYSA-N	0	0	287.787	4.117	20	30		CIEDRN
C=C(CC)CSCc1nc(C(F)(F)F)cs1	ZINC000540193361	333720128	/nfs/dbraw/zinc/72/01/28/333720128.db2.gz	FZHWSRPJUZWOFC-UHFFFAOYSA-N	0	0	267.341	4.361	20	30		CIEDRN
C=C(CC)COc1ccccc1C(=O)Nc1ccccc1	ZINC000540201090	333720918	/nfs/dbraw/zinc/72/09/18/333720918.db2.gz	IISCOYUCWBYUFP-UHFFFAOYSA-N	0	0	281.355	4.284	20	30		CIEDRN
COc1ccc(CNc2cc(SC)ccc2C)cc1C#N	ZINC000540503239	333732715	/nfs/dbraw/zinc/73/27/15/333732715.db2.gz	VQRVVBITTIUGST-UHFFFAOYSA-N	0	0	298.411	4.209	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@@H]1CCCC[C@H]1C(F)(F)F	ZINC000540531487	333733973	/nfs/dbraw/zinc/73/39/73/333733973.db2.gz	DTMRMTWCDSKNMH-YNEHKIRRSA-N	0	0	291.357	4.216	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1cc(C)nc2ccccc21	ZINC000540526659	333733975	/nfs/dbraw/zinc/73/39/75/333733975.db2.gz	SPXIZNHRIGLNDY-CYBMUJFWSA-N	0	0	282.387	4.018	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)CCc1ccnc2ccccc12	ZINC000540534545	333734271	/nfs/dbraw/zinc/73/42/71/333734271.db2.gz	ABCLBURXMQQAFU-HNNXBMFYSA-N	0	0	296.414	4.028	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@@H](C)CSc1ccccc1	ZINC000540532336	333734279	/nfs/dbraw/zinc/73/42/79/333734279.db2.gz	OVPLEVLLPWYGEI-GJZGRUSLSA-N	0	0	291.460	4.276	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1ccc(OC2CCC2)cc1	ZINC000540539711	333734413	/nfs/dbraw/zinc/73/44/13/333734413.db2.gz	PLXVQFYENAEFAJ-CQSZACIVSA-N	0	0	287.403	4.093	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)C[C@H](CC)c1ccccc1	ZINC000540540164	333734712	/nfs/dbraw/zinc/73/47/12/333734712.db2.gz	SLRNZORMNMNKLA-CVEARBPZSA-N	0	0	273.420	4.431	20	30		CIEDRN
Cc1ccc(N[C@@H](C)c2ccc(C#N)c(F)c2)cc1F	ZINC000540710170	333743235	/nfs/dbraw/zinc/74/32/35/333743235.db2.gz	JVKJIWKZULYHLI-NSHDSACASA-N	0	0	272.298	4.318	20	30		CIEDRN
C=CCCN[C@@H](c1ccccc1OC(F)F)C(F)(F)F	ZINC000540915663	333753258	/nfs/dbraw/zinc/75/32/58/333753258.db2.gz	LIKIQDCXTMZYAT-NSHDSACASA-N	0	0	295.251	4.057	20	30		CIEDRN
C=CCCN[C@H](c1ccccc1OC(F)F)C(F)(F)F	ZINC000540915658	333753288	/nfs/dbraw/zinc/75/32/88/333753288.db2.gz	LIKIQDCXTMZYAT-LLVKDONJSA-N	0	0	295.251	4.057	20	30		CIEDRN
CCCC[C@@H](Sc1cccc(Cl)c1C#N)C(=O)OC	ZINC000541171769	333763658	/nfs/dbraw/zinc/76/36/58/333763658.db2.gz	DXGRZAAWUMDMQB-CYBMUJFWSA-N	0	0	297.807	4.036	20	30		CIEDRN
N#Cc1ccc(N[C@@H]2CCc3sc(Cl)cc32)cc1	ZINC000129462391	333765895	/nfs/dbraw/zinc/76/58/95/333765895.db2.gz	MOJGSIGDXSKDMQ-GFCCVEGCSA-N	0	0	274.776	4.373	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1ccc(C)c(C)c1Cl	ZINC000541239279	333767023	/nfs/dbraw/zinc/76/70/23/333767023.db2.gz	BZRULEJIWFPZAD-LBPRGKRZSA-N	0	0	279.811	4.431	20	30		CIEDRN
CC(C)Oc1cccc(OCc2ccc(CC#N)cc2)c1	ZINC000541290771	333770613	/nfs/dbraw/zinc/77/06/13/333770613.db2.gz	NZMNYJOCWRFJGI-UHFFFAOYSA-N	0	0	281.355	4.119	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CC[C@H](C(C)(C)C)C1)c1ccccc1	ZINC000541318528	333771650	/nfs/dbraw/zinc/77/16/50/333771650.db2.gz	BNZUMTZZBDDHAF-RDJZCZTQSA-N	0	0	285.431	4.241	20	30		CIEDRN
CC(=O)c1ccc(C#N)cc1N(C)C[C@@H](C)c1ccccc1	ZINC000541577398	333781528	/nfs/dbraw/zinc/78/15/28/333781528.db2.gz	UZJLOIPZZUCHTP-CQSZACIVSA-N	0	0	292.382	4.001	20	30		CIEDRN
CCC(CC)N(C(=O)c1ccc(Cl)c(C#N)c1)C1CC1	ZINC000541609717	333783988	/nfs/dbraw/zinc/78/39/88/333783988.db2.gz	DWEMBOWXEUPLQK-UHFFFAOYSA-N	0	0	290.794	4.005	20	30		CIEDRN
C=CCOc1ccccc1CNCc1ccc([C@H]2C[C@@H]2C)o1	ZINC000069752713	333786903	/nfs/dbraw/zinc/78/69/03/333786903.db2.gz	JERCOBICDFPNQX-YOEHRIQHSA-N	0	0	297.398	4.258	20	30		CIEDRN
C=CCC[C@@H](C)Nc1ccccc1OC[C@H]1CCCCO1	ZINC000541774712	333791992	/nfs/dbraw/zinc/79/19/92/333791992.db2.gz	YVBGMEOKOBASIZ-HZPDHXFCSA-N	0	0	289.419	4.401	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N[C@H](C)c1cc2ccccc2o1	ZINC000541782365	333792718	/nfs/dbraw/zinc/79/27/18/333792718.db2.gz	VDENTFSUEMLHFY-OCCSQVGLSA-N	0	0	286.375	4.148	20	30		CIEDRN
N#Cc1ccc(F)cc1CSc1nc2ccccc2o1	ZINC000129975855	333802850	/nfs/dbraw/zinc/80/28/50/333802850.db2.gz	OHDNPJWNVGJOBY-UHFFFAOYSA-N	0	0	284.315	4.131	20	30		CIEDRN
C=CCCSCc1ccc([N+](=O)[O-])cc1Cl	ZINC000542004334	333806101	/nfs/dbraw/zinc/80/61/01/333806101.db2.gz	FKSQYDYIJBHUFI-UHFFFAOYSA-N	0	0	257.742	4.058	20	30		CIEDRN
N#Cc1c(Cl)cccc1SCC(=O)C1CCCCC1	ZINC000542101613	333809802	/nfs/dbraw/zinc/80/98/02/333809802.db2.gz	FDKHXLVWDWNTIE-UHFFFAOYSA-N	0	0	293.819	4.453	20	30		CIEDRN
CCCCOc1cccc(NCc2cccc(C#N)c2F)c1	ZINC000542237104	333817826	/nfs/dbraw/zinc/81/78/26/333817826.db2.gz	MPAKLGLLYNEMCF-UHFFFAOYSA-N	0	0	298.361	4.488	20	30		CIEDRN
C=C(C)COc1cccc(NCc2ncc(CC)s2)c1	ZINC000542311164	333821073	/nfs/dbraw/zinc/82/10/73/333821073.db2.gz	MCGYFUZSQIUDEA-UHFFFAOYSA-N	0	0	288.416	4.273	20	30		CIEDRN
CC[C@@H](SCC1(C#N)CC1)c1ccc(F)cc1F	ZINC000542736641	333838739	/nfs/dbraw/zinc/83/87/39/333838739.db2.gz	ZFTNXTHOTNBHAW-CYBMUJFWSA-N	0	0	267.344	4.453	20	30		CIEDRN
N#Cc1ccc(F)cc1CSc1ncccc1Cl	ZINC000130446627	333842729	/nfs/dbraw/zinc/84/27/29/333842729.db2.gz	DQVTXIYDHWUFEF-UHFFFAOYSA-N	0	0	278.739	4.038	20	30		CIEDRN
C=C[C@H](CC(=O)N(CCC#N)CC(C)(C)C)c1ccccc1	ZINC000130532140	333850405	/nfs/dbraw/zinc/85/04/05/333850405.db2.gz	HQYNLUKESMYUHS-MRXNPFEDSA-N	0	0	298.430	4.135	20	30		CIEDRN
Cc1c(Cl)cnc(N[C@@H](C)Cc2cccs2)c1C#N	ZINC000543138989	333860105	/nfs/dbraw/zinc/86/01/05/333860105.db2.gz	SBMISLINUUIACS-VIFPVBQESA-N	0	0	291.807	4.020	20	30		CIEDRN
Cc1cc(C)cc([C@@H](C)Nc2nccc(C)c2C#N)c1	ZINC000543205874	333864295	/nfs/dbraw/zinc/86/42/95/333864295.db2.gz	CPQMQZPUMWNXIN-CQSZACIVSA-N	0	0	265.360	4.052	20	30		CIEDRN
C=CCN(C(=O)[C@@H](c1cccc(Cl)c1)C(C)C)C1CC1	ZINC000543455111	333876146	/nfs/dbraw/zinc/87/61/46/333876146.db2.gz	QWYXNLSCPMSNAU-MRXNPFEDSA-N	0	0	291.822	4.257	20	30		CIEDRN
N#CCN[C@@H]1CCCCC[C@H]1c1ccccc1C(F)(F)F	ZINC000543458672	333876273	/nfs/dbraw/zinc/87/62/73/333876273.db2.gz	JHBXCSIOSSMJBI-DZGCQCFKSA-N	0	0	296.336	4.235	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)[C@H](C)CCC(C)(C)C	ZINC000543461653	333876670	/nfs/dbraw/zinc/87/66/70/333876670.db2.gz	QALSZRSMPYLFLC-OAHLLOKOSA-N	0	0	291.435	4.299	20	30		CIEDRN
C[C@@H]1CCN(Cc2cccc(C#N)c2)c2ccccc2S1	ZINC000071805727	333879479	/nfs/dbraw/zinc/87/94/79/333879479.db2.gz	AUFHNRSQHPBJLA-CQSZACIVSA-N	0	0	294.423	4.449	20	30		CIEDRN
CCN(C(=O)CC1CCCCC1)[C@@H](C)c1ccc(C#N)cc1	ZINC000071868131	333888327	/nfs/dbraw/zinc/88/83/27/333888327.db2.gz	WQGMHTSGWJKTJL-HNNXBMFYSA-N	0	0	298.430	4.438	20	30		CIEDRN
Cc1cc(-c2ccc(C#N)cc2)nc2cc(F)ccc12	ZINC000544046420	333912240	/nfs/dbraw/zinc/91/22/40/333912240.db2.gz	WZCUMDSHMKZEBG-UHFFFAOYSA-N	0	0	262.287	4.221	20	30		CIEDRN
C[C@H](C#N)CN(C)c1nc(-c2ccccc2Cl)cs1	ZINC000544066033	333913847	/nfs/dbraw/zinc/91/38/47/333913847.db2.gz	HURWKRUBEGPLEQ-SNVBAGLBSA-N	0	0	291.807	4.059	20	30		CIEDRN
C=CCC[C@H](C)N[C@@H](CCc1ccccc1)C(F)(F)F	ZINC000544573256	333936987	/nfs/dbraw/zinc/93/69/87/333936987.db2.gz	UUAWVXMYOWNTDC-ZFWWWQNUSA-N	0	0	285.353	4.494	20	30		CIEDRN
CC(C)C[C@@](C)(C#N)NC(=O)c1cccc(C2CCC2)c1	ZINC000544616663	333941014	/nfs/dbraw/zinc/94/10/14/333941014.db2.gz	BNLHTIBSKJCBOF-SFHVURJKSA-N	0	0	284.403	4.012	20	30		CIEDRN
CC[C@@H](CC(F)(F)F)Nc1ccc(C#N)c(Cl)c1	ZINC000544846776	333949073	/nfs/dbraw/zinc/94/90/73/333949073.db2.gz	JXIYLDGTZJZFNT-VIFPVBQESA-N	0	0	276.689	4.355	20	30		CIEDRN
C=CCCO[C@@H](C)c1nc([C@@H]2CCCc3ccccc32)no1	ZINC000544979457	333956300	/nfs/dbraw/zinc/95/63/00/333956300.db2.gz	TYGULTQQJFSGRZ-XJKSGUPXSA-N	0	0	298.386	4.192	20	30		CIEDRN
CCC[C@H](CC1CCCCC1)C(=O)N[C@@H](CC)CC#N	ZINC000545174719	333965842	/nfs/dbraw/zinc/96/58/42/333965842.db2.gz	PIWFQLDWGUOITI-CVEARBPZSA-N	0	0	278.440	4.182	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCc1c(Cl)cccc1Cl	ZINC000545216675	333970014	/nfs/dbraw/zinc/97/00/14/333970014.db2.gz	LGVFAALMNFUGGR-JTQLQIEISA-N	0	0	286.202	4.212	20	30		CIEDRN
CC1(C)CCC(c2noc(Cc3cccc(C#N)c3)n2)CC1	ZINC000564287029	333971707	/nfs/dbraw/zinc/97/17/07/333971707.db2.gz	TWQZQQGPDSJZHZ-UHFFFAOYSA-N	0	0	295.386	4.216	20	30		CIEDRN
C=CCCc1nc(-c2ccc3ccccc3c2)no1	ZINC000564289677	333979330	/nfs/dbraw/zinc/97/93/30/333979330.db2.gz	BUIVAFAPGIRDHQ-UHFFFAOYSA-N	0	0	250.301	4.008	20	30		CIEDRN
N#Cc1cccc(CNc2cccc(CC(F)(F)F)c2)c1	ZINC000174899115	335168953	/nfs/dbraw/zinc/16/89/53/335168953.db2.gz	GNWZLEYAJYLPJL-UHFFFAOYSA-N	0	0	290.288	4.275	20	30		CIEDRN
N#Cc1ccc(-c2nc(CCC3CCCCC3)no2)cc1	ZINC000545632485	333992442	/nfs/dbraw/zinc/99/24/42/333992442.db2.gz	ZWNNMVBZFRVHJH-UHFFFAOYSA-N	0	0	281.359	4.121	20	30		CIEDRN
C[C@H](Oc1ccc(C#N)cc1)c1nc([C@@H](C)C(C)(C)C)no1	ZINC000545727110	333997121	/nfs/dbraw/zinc/99/71/21/333997121.db2.gz	JKTYFZMHQSHMIR-NEPJUHHUSA-N	0	0	299.374	4.231	20	30		CIEDRN
C/C(=C\c1cccc(C(F)(F)F)c1)CN(C)[C@H](C)CC#N	ZINC000564294862	334002779	/nfs/dbraw/zinc/00/27/79/334002779.db2.gz	LBLDZHQONRXPKK-CNELAYHGSA-N	0	0	296.336	4.343	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H]1CCC[C@@H]1c1ccccc1	ZINC000132773547	334005315	/nfs/dbraw/zinc/00/53/15/334005315.db2.gz	KLDSMTAXJOMKEZ-MSOLQXFVSA-N	0	0	283.415	4.207	20	30		CIEDRN
C[C@H](CC1CCCCC1)C(=O)Nc1ccccc1C#N	ZINC000074396852	334005320	/nfs/dbraw/zinc/00/53/20/334005320.db2.gz	WLXZELQWKAKKSF-CYBMUJFWSA-N	0	0	270.376	4.103	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)N[C@H]1CCC[C@@H]1CC	ZINC000132860126	334008219	/nfs/dbraw/zinc/00/82/19/334008219.db2.gz	WEYWMODOJFDSFO-ZFWWWQNUSA-N	0	0	292.448	4.024	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(C)[C@@H]1CCCc2ccccc21	ZINC000545957903	334009141	/nfs/dbraw/zinc/00/91/41/334009141.db2.gz	UTEBMXHPMNOIRT-NVXWUHKLSA-N	0	0	286.419	4.060	20	30		CIEDRN
CC(C)c1ccc(Cc2noc(C3(C#N)CCCC3)n2)cc1	ZINC000546322778	334027668	/nfs/dbraw/zinc/02/76/68/334027668.db2.gz	SXIIYXFBGAXOHG-UHFFFAOYSA-N	0	0	295.386	4.119	20	30		CIEDRN
N#CCc1ccc(-c2nc(CCC3CCCCC3)no2)cc1	ZINC000546339513	334028262	/nfs/dbraw/zinc/02/82/62/334028262.db2.gz	OCWSYSZXZQSRDH-UHFFFAOYSA-N	0	0	295.386	4.316	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@]1(C)CCCc2ccccc21	ZINC000546526461	334037258	/nfs/dbraw/zinc/03/72/58/334037258.db2.gz	JDXQHRUVOPPOPL-IBGZPJMESA-N	0	0	283.415	4.123	20	30		CIEDRN
C=CCCO[C@@H](C)c1nc([C@@H](C)c2ccccc2C)no1	ZINC000546546513	334038235	/nfs/dbraw/zinc/03/82/35/334038235.db2.gz	VHFKIKYHYARPIS-KBPBESRZSA-N	0	0	286.375	4.184	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](c1ccccc1)C(F)(F)F	ZINC000546630419	334042003	/nfs/dbraw/zinc/04/20/03/334042003.db2.gz	QTTZRNKFPFLTSJ-DGCLKSJQSA-N	0	0	285.309	4.009	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCc1cccc(Cl)c1Cl	ZINC000546630697	334042110	/nfs/dbraw/zinc/04/21/10/334042110.db2.gz	QERSISGCKPZXBG-JTQLQIEISA-N	0	0	286.202	4.212	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@H]1Cc1ccc(C)cc1	ZINC000133491728	334042862	/nfs/dbraw/zinc/04/28/62/334042862.db2.gz	XTJAEWYARRZGQE-IBGZPJMESA-N	0	0	297.442	4.297	20	30		CIEDRN
C[C@@H]1CCC[C@H](c2noc(-c3cccc(CC#N)c3)n2)C1	ZINC000547052027	334064016	/nfs/dbraw/zinc/06/40/16/334064016.db2.gz	CTGFYWPZTILYKK-OCCSQVGLSA-N	0	0	281.359	4.096	20	30		CIEDRN
C=CCCCc1nc(Cc2c[nH]c3c2cccc3CC)no1	ZINC000547111841	334067277	/nfs/dbraw/zinc/06/72/77/334067277.db2.gz	VFZYJEROURJMRN-UHFFFAOYSA-N	0	0	295.386	4.213	20	30		CIEDRN
CCCCOc1cccc(NCc2cccc(C#N)c2)c1	ZINC000236718224	334067634	/nfs/dbraw/zinc/06/76/34/334067634.db2.gz	VFWCALFUOGAYFM-UHFFFAOYSA-N	0	0	280.371	4.349	20	30		CIEDRN
C=CCC[C@@H](NC(=O)C[C@H]1C=CCC1)c1ccccc1	ZINC000133942709	334073951	/nfs/dbraw/zinc/07/39/51/334073951.db2.gz	HDFYCDMOPINADQ-DOTOQJQBSA-N	0	0	269.388	4.166	20	30		CIEDRN
C=CCC[C@@H](NC(=O)[C@@H]1CC=CCC1)c1ccccc1	ZINC000133948527	334074366	/nfs/dbraw/zinc/07/43/66/334074366.db2.gz	WBIODYUPGOZWSH-IAGOWNOFSA-N	0	0	269.388	4.166	20	30		CIEDRN
CCC1(CNC(=O)Nc2ccc(CC#N)cc2)CCCCC1	ZINC000547275940	334075600	/nfs/dbraw/zinc/07/56/00/334075600.db2.gz	BNLOOJUCUDZOTR-UHFFFAOYSA-N	0	0	299.418	4.235	20	30		CIEDRN
CC[C@@H](CC#N)NCc1ccc(-c2ccc(Cl)cc2)o1	ZINC000547285401	334075983	/nfs/dbraw/zinc/07/59/83/334075983.db2.gz	SZWFXSKCOFGBLU-AWEZNQCLSA-N	0	0	288.778	4.382	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(Cl)c2cccnc12	ZINC000547341024	334081348	/nfs/dbraw/zinc/08/13/48/334081348.db2.gz	ZNUSUUQTZWICDR-LLVKDONJSA-N	0	0	288.778	4.429	20	30		CIEDRN
CC[C@@H](CC#N)NC(=O)Nc1ccccc1CCC(C)C	ZINC000547465321	334090441	/nfs/dbraw/zinc/09/04/41/334090441.db2.gz	AUNRDPQIJYENCS-HNNXBMFYSA-N	0	0	287.407	4.089	20	30		CIEDRN
CC[C@H](CC#N)NC(=O)Nc1ccccc1CCC(C)C	ZINC000547465322	334090633	/nfs/dbraw/zinc/09/06/33/334090633.db2.gz	AUNRDPQIJYENCS-OAHLLOKOSA-N	0	0	287.407	4.089	20	30		CIEDRN
C=CCCCN(C)C(=O)N[C@H](C)c1ccc(Cl)cc1	ZINC000076939892	334091684	/nfs/dbraw/zinc/09/16/84/334091684.db2.gz	GXNOGHXECBAEPI-GFCCVEGCSA-N	0	0	280.799	4.009	20	30		CIEDRN
Cc1cc(NCc2ccc(C#N)cc2)ccc1C(F)(F)F	ZINC000237752714	334096914	/nfs/dbraw/zinc/09/69/14/334096914.db2.gz	NKGVPAQQCOFFNM-UHFFFAOYSA-N	0	0	290.288	4.498	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@H](C)c1ccc(F)cc1Cl	ZINC000077621906	334109995	/nfs/dbraw/zinc/10/99/95/334109995.db2.gz	KQAGVHMTNBQRHU-LLVKDONJSA-N	0	0	298.789	4.148	20	30		CIEDRN
N#Cc1cnccc1Sc1c(Cl)cccc1Cl	ZINC000547824931	334123272	/nfs/dbraw/zinc/12/32/72/334123272.db2.gz	QCGATLAVVNMUGE-UHFFFAOYSA-N	0	0	281.167	4.411	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@@H]1CCSc2ccc(F)cc21	ZINC000135501598	334131983	/nfs/dbraw/zinc/13/19/83/334131983.db2.gz	IPEPPCRHDDBCEY-CJNGLKHVSA-N	0	0	293.407	4.081	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)N[C@H]1CCCC1(C)C	ZINC000078366213	334132186	/nfs/dbraw/zinc/13/21/86/334132186.db2.gz	INRXZZUZEPBZIZ-AWEZNQCLSA-N	0	0	292.448	4.024	20	30		CIEDRN
N#CCCCC[S@](=O)C(c1ccccc1)c1ccccc1	ZINC000078700287	334139066	/nfs/dbraw/zinc/13/90/66/334139066.db2.gz	BLXPWQCTAVRLRN-OAQYLSRUSA-N	0	0	297.423	4.219	20	30		CIEDRN
C[C@@H]1CC[C@H](Nc2nc(C(F)(F)F)ccc2C#N)[C@H](C)C1	ZINC000078836187	334141168	/nfs/dbraw/zinc/14/11/68/334141168.db2.gz	BGFRTCKAIMFYEN-FOGDFJRCSA-N	0	0	297.324	4.209	20	30		CIEDRN
C[C@H](Sc1ccncc1C#N)c1ccc(Cl)cc1	ZINC000548152376	334143182	/nfs/dbraw/zinc/14/31/82/334143182.db2.gz	HLVMIHUORNMHGV-JTQLQIEISA-N	0	0	274.776	4.460	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Nc1cccc2cc[nH]c21	ZINC000548177713	334145240	/nfs/dbraw/zinc/14/52/40/334145240.db2.gz	IRNSUEQTWPICSJ-UHFFFAOYSA-N	0	0	285.391	4.378	20	30		CIEDRN
Cc1cscc1C([O-])=C(C#N)c1nc(C(C)C)cs1	ZINC000079172688	334149276	/nfs/dbraw/zinc/14/92/76/334149276.db2.gz	MLJQDBHUDAVLAV-JTQLQIEISA-N	0	0	290.413	4.127	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)c2ccc(C)c(C)c2)s1	ZINC000079263095	334151075	/nfs/dbraw/zinc/15/10/75/334151075.db2.gz	XSHCFUQZDYCWPH-UHFFFAOYSA-N	0	0	284.384	4.051	20	30		CIEDRN
Cc1ccc(NC(=O)c2cccc(SCC#N)c2)c(C)c1	ZINC000079380249	334152962	/nfs/dbraw/zinc/15/29/62/334152962.db2.gz	GDMDZFROHDIVJF-UHFFFAOYSA-N	0	0	296.395	4.171	20	30		CIEDRN
Cc1ccc(CCCC(=O)Nc2ccc(CC#N)cc2)s1	ZINC000079387597	334153078	/nfs/dbraw/zinc/15/30/78/334153078.db2.gz	JJYYRWPZAYBXJU-UHFFFAOYSA-N	0	0	298.411	4.084	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)N[C@@H]1CCC[C@@H](C)C1	ZINC000079517349	334156121	/nfs/dbraw/zinc/15/61/21/334156121.db2.gz	UKWOXWDSNRSDBZ-ZIAGYGMSSA-N	0	0	292.448	4.024	20	30		CIEDRN
C[C@@H](CCc1ccc(F)cc1)Nc1ccc(CC#N)cc1	ZINC000136953342	334165821	/nfs/dbraw/zinc/16/58/21/334165821.db2.gz	GOJNMLIXFKQRCG-AWEZNQCLSA-N	0	0	282.362	4.325	20	30		CIEDRN
Cc1cc(F)ccc1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000137226985	334171930	/nfs/dbraw/zinc/17/19/30/334171930.db2.gz	SQRGQWJXAIFJPU-UHFFFAOYSA-N	0	0	296.345	4.188	20	30		CIEDRN
COC[C@@H](C)Nc1ccc(Oc2ccc(C#N)cc2)cc1C	ZINC000080466665	334171955	/nfs/dbraw/zinc/17/19/55/334171955.db2.gz	IXSKDYCRJXEFJN-CQSZACIVSA-N	0	0	296.370	4.106	20	30		CIEDRN
Cc1cccc(Cl)c1NC(=O)/C=C/c1cccc(C#N)c1	ZINC000080823398	334173779	/nfs/dbraw/zinc/17/37/79/334173779.db2.gz	LCZSIZOFGAIZLH-CMDGGOBGSA-N	0	0	296.757	4.172	20	30		CIEDRN
C=CCN(CC(F)(F)F)C(=O)CC[C@@H](C)c1ccccc1	ZINC000137898345	334182047	/nfs/dbraw/zinc/18/20/47/334182047.db2.gz	DJSTVBLSEUADOP-CYBMUJFWSA-N	0	0	299.336	4.147	20	30		CIEDRN
CO[C@@H](CSc1ccc(C#N)cc1F)c1ccccc1	ZINC000549223071	334187867	/nfs/dbraw/zinc/18/78/67/334187867.db2.gz	CMXYFPBFNKNQON-HNNXBMFYSA-N	0	0	287.359	4.177	20	30		CIEDRN
Cc1nc(C(C)C)ccc1COc1ccc(C#N)cc1F	ZINC000549369567	334191539	/nfs/dbraw/zinc/19/15/39/334191539.db2.gz	GUIOYXNPVCCCQI-UHFFFAOYSA-N	0	0	284.334	4.103	20	30		CIEDRN
Cc1cnccc1SCC#Cc1ccc(Cl)cc1	ZINC000549423070	334193434	/nfs/dbraw/zinc/19/34/34/334193434.db2.gz	ASJLRNJDEBBKTM-UHFFFAOYSA-N	0	0	273.788	4.187	20	30		CIEDRN
Cc1nc(Oc2ccc(C#N)c3ccccc23)ccc1C#N	ZINC000549706459	334202403	/nfs/dbraw/zinc/20/24/03/334202403.db2.gz	VJCNYDKQWGFWMS-UHFFFAOYSA-N	0	0	285.306	4.079	20	30		CIEDRN
CC(C)CN(C(=O)CC(C)(C)C1CC1)c1ccc(C#N)cc1	ZINC000550228269	334216710	/nfs/dbraw/zinc/21/67/10/334216710.db2.gz	PYCBYOVVQOSAGF-UHFFFAOYSA-N	0	0	298.430	4.374	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H](C)C(C)(C)c1ccccc1	ZINC000550247371	334217246	/nfs/dbraw/zinc/21/72/46/334217246.db2.gz	HGTPALPKJYWSSX-CQSZACIVSA-N	0	0	273.420	4.071	20	30		CIEDRN
C[C@](C#N)(NC(=O)CCCC1CCCC1)C1CCCCC1	ZINC000550350857	334220704	/nfs/dbraw/zinc/22/07/04/334220704.db2.gz	FXGOJAKFQSYJIF-GOSISDBHSA-N	0	0	290.451	4.326	20	30		CIEDRN
CC[C@@H](CC(=O)N[C@@](C)(C#N)C1CCCCC1)C(C)C	ZINC000550351467	334220736	/nfs/dbraw/zinc/22/07/36/334220736.db2.gz	LLCVIFXHSGXLMT-YOEHRIQHSA-N	0	0	278.440	4.037	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CCC[C@H](c2ccccc2)CC1	ZINC000550547637	334224222	/nfs/dbraw/zinc/22/42/22/334224222.db2.gz	HEPXWCVOWDCPNV-KRWDZBQOSA-N	0	0	285.431	4.385	20	30		CIEDRN
C=CCC(F)(F)c1nc(-c2cccc(OC(C)C)c2)no1	ZINC000550983121	334235389	/nfs/dbraw/zinc/23/53/89/334235389.db2.gz	KIJILFGWKJEAAL-UHFFFAOYSA-N	0	0	294.301	4.192	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H]2CCC(=O)[C@H](C)C2(C)C)n1	ZINC000551110482	334238826	/nfs/dbraw/zinc/23/88/26/334238826.db2.gz	WKGRSOSQPSUYOD-NWDGAFQWSA-N	0	0	290.407	4.032	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H]2C[C@@H]2c2ccc(F)cc2)n1	ZINC000551136921	334239197	/nfs/dbraw/zinc/23/91/97/334239197.db2.gz	RSSXCTAJGHCZDJ-ZIAGYGMSSA-N	0	0	286.350	4.334	20	30		CIEDRN
Cc1cccc(N(C(=O)c2ccc(F)c(C#N)c2)C(C)C)c1	ZINC000551132960	334239264	/nfs/dbraw/zinc/23/92/64/334239264.db2.gz	SUMUBVYCBUYTKZ-UHFFFAOYSA-N	0	0	296.345	4.061	20	30		CIEDRN
C=CCC(C)(C)c1noc(/C=C\c2ccccc2[N+](=O)[O-])n1	ZINC000551139769	334239282	/nfs/dbraw/zinc/23/92/82/334239282.db2.gz	LMEUUGPMFFRINQ-KTKRTIGZSA-N	0	0	299.330	4.002	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H](C)Oc2ccc(F)cc2)n1	ZINC000551138113	334239286	/nfs/dbraw/zinc/23/92/86/334239286.db2.gz	LBBLVWCLCPTKLQ-NSHDSACASA-N	0	0	290.338	4.202	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H]2C[C@H]2c2ccc(F)cc2)n1	ZINC000551136920	334239294	/nfs/dbraw/zinc/23/92/94/334239294.db2.gz	RSSXCTAJGHCZDJ-UONOGXRCSA-N	0	0	286.350	4.334	20	30		CIEDRN
C=CCC(C)(C)c1noc(COc2ccccc2CC)n1	ZINC000551144267	334239377	/nfs/dbraw/zinc/23/93/77/334239377.db2.gz	QUDSMPKHSJFYBC-UHFFFAOYSA-N	0	0	286.375	4.065	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cccc(CC(F)(F)F)c1	ZINC000551195843	334240539	/nfs/dbraw/zinc/24/05/39/334240539.db2.gz	NWPWSPGODYRFQL-UHFFFAOYSA-N	0	0	285.309	4.332	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H](CC)Cc1ccc(Cl)cc1	ZINC000551208452	334240791	/nfs/dbraw/zinc/24/07/91/334240791.db2.gz	KPJQWYUUTJPZHC-HNNXBMFYSA-N	0	0	293.838	4.380	20	30		CIEDRN
CCC(CC)[C@H](C)C(=O)N[C@](C)(C#N)C1CCCCC1	ZINC000551305112	334245094	/nfs/dbraw/zinc/24/50/94/334245094.db2.gz	AYLBZJKYXSHLND-SUMWQHHRSA-N	0	0	278.440	4.037	20	30		CIEDRN
CC1(C)CCC[C@H](CC(=O)N(C2CC2)C2(C#N)CCC2)C1	ZINC000551309378	334246359	/nfs/dbraw/zinc/24/63/59/334246359.db2.gz	VIDXTLFQVZNNHB-CQSZACIVSA-N	0	0	288.435	4.030	20	30		CIEDRN
C=C(C)CCc1noc(-c2ccc3cc(C)ccc3n2)n1	ZINC000551439427	334250571	/nfs/dbraw/zinc/25/05/71/334250571.db2.gz	JRNIIFHNTFGUHV-UHFFFAOYSA-N	0	0	279.343	4.102	20	30		CIEDRN
C=CCC(F)(F)c1nc(-c2ccc(Cl)cc2F)no1	ZINC000551465722	334251190	/nfs/dbraw/zinc/25/11/90/334251190.db2.gz	LIBSXWHQROTPTC-UHFFFAOYSA-N	0	0	288.656	4.197	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H](C)c2cccc(F)c2)n1	ZINC000551469559	334251262	/nfs/dbraw/zinc/25/12/62/334251262.db2.gz	DRNDNNUNWYCZPM-NSHDSACASA-N	0	0	274.339	4.214	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H](C)Sc2ccccn2)n1	ZINC000551491027	334251533	/nfs/dbraw/zinc/25/15/33/334251533.db2.gz	YZXQYHBLGPXWCU-LLVKDONJSA-N	0	0	289.404	4.172	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cccc3cc[nH]c32)n1	ZINC000551493672	334251552	/nfs/dbraw/zinc/25/15/52/334251552.db2.gz	IHNFSWJRWHQMNL-UHFFFAOYSA-N	0	0	267.332	4.072	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H]2Cc3ccccc3S2)n1	ZINC000551492458	334251589	/nfs/dbraw/zinc/25/15/89/334251589.db2.gz	QSFADBFPFGTFAY-ZDUSSCGKSA-N	0	0	286.400	4.313	20	30		CIEDRN
C=CCNC(=O)N(CC(C)C)[C@@H](C)c1ccccc1Cl	ZINC000551587917	334255374	/nfs/dbraw/zinc/25/53/74/334255374.db2.gz	JXVIWBGYDXOQLG-ZDUSSCGKSA-N	0	0	294.826	4.255	20	30		CIEDRN
Cc1ccc(-c2ncc(CN(C)CC(C)(C)C#N)s2)cc1	ZINC000552085871	334287469	/nfs/dbraw/zinc/28/74/69/334287469.db2.gz	PDYKNBAIJKTSOI-UHFFFAOYSA-N	0	0	299.443	4.100	20	30		CIEDRN
C=CCC[C@H](CCC)Nc1ccc(F)c(NC(=O)NC)c1	ZINC000552087983	334287905	/nfs/dbraw/zinc/28/79/05/334287905.db2.gz	YCCCMWGFJALGLC-LBPRGKRZSA-N	0	0	293.386	4.124	20	30		CIEDRN
CCC[C@@H](C(=O)Nc1cc(C#N)ccc1NCC)C(C)C	ZINC000552349509	334319577	/nfs/dbraw/zinc/31/95/77/334319577.db2.gz	DPMVRBWVVHAKQL-CQSZACIVSA-N	0	0	287.407	4.001	20	30		CIEDRN
CCNc1ccc(C#N)cc1NC(=O)[C@H](C)C(CC)CC	ZINC000552355092	334319750	/nfs/dbraw/zinc/31/97/50/334319750.db2.gz	YFTIBNQARACHER-GFCCVEGCSA-N	0	0	287.407	4.001	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1C[C@@H](c2ccccc2C)C[C@H]1C	ZINC000249032055	334325090	/nfs/dbraw/zinc/32/50/90/334325090.db2.gz	BKCNCMGWIUFQEM-JTDSTZFVSA-N	0	0	285.431	4.302	20	30		CIEDRN
CCN(C(=O)C[C@@H]1CCC[C@H]1C)[C@H](C)c1ccc(C#N)cc1	ZINC000249043895	334325525	/nfs/dbraw/zinc/32/55/25/334325525.db2.gz	VNZSHZFGCFDHSM-RKVPGOIHSA-N	0	0	298.430	4.294	20	30		CIEDRN
CNc1ccc(C#N)cc1NC(=O)c1ccc(C(C)C)s1	ZINC000552575564	334336677	/nfs/dbraw/zinc/33/66/77/334336677.db2.gz	FCYVGTLZJRFGSB-UHFFFAOYSA-N	0	0	299.399	4.037	20	30		CIEDRN
CNc1ccc(C#N)cc1NC(=O)[C@H](C)CCC(C)(C)C	ZINC000552575779	334336969	/nfs/dbraw/zinc/33/69/69/334336969.db2.gz	LGPMDSRPTZQBTO-GFCCVEGCSA-N	0	0	287.407	4.001	20	30		CIEDRN
CNc1ccc(C#N)cc1NC(=O)[C@@H](C)CCC(C)(C)C	ZINC000552575781	334337027	/nfs/dbraw/zinc/33/70/27/334337027.db2.gz	LGPMDSRPTZQBTO-LBPRGKRZSA-N	0	0	287.407	4.001	20	30		CIEDRN
CC[C@@H](CC1CCCC1)C(=O)Nc1cc(C#N)ccc1NC	ZINC000552587485	334338029	/nfs/dbraw/zinc/33/80/29/334338029.db2.gz	NGPMYOZTWUASIB-HNNXBMFYSA-N	0	0	299.418	4.145	20	30		CIEDRN
Cc1cc(C#N)ccc1OCc1ncc(-c2ccccc2)o1	ZINC000089126545	334342787	/nfs/dbraw/zinc/34/27/87/334342787.db2.gz	ZUCODAGHPDURFB-UHFFFAOYSA-N	0	0	290.322	4.101	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CC2(CCC2)[C@@H]1C(C)C)c1ccccc1	ZINC000552723610	334343437	/nfs/dbraw/zinc/34/34/37/334343437.db2.gz	QKOGIXCTCQFZKQ-LPHOPBHVSA-N	0	0	297.442	4.383	20	30		CIEDRN
C=C[C@H](CC(=O)N1CC2(CCC2)[C@H]1C(C)C)c1ccccc1	ZINC000552723612	334343495	/nfs/dbraw/zinc/34/34/95/334343495.db2.gz	QKOGIXCTCQFZKQ-VQIMIIECSA-N	0	0	297.442	4.383	20	30		CIEDRN
C=C[C@H](CC(=O)N1CC2(CCC2)[C@@H]1C(C)C)c1ccccc1	ZINC000552723609	334343536	/nfs/dbraw/zinc/34/35/36/334343536.db2.gz	QKOGIXCTCQFZKQ-APWZRJJASA-N	0	0	297.442	4.383	20	30		CIEDRN
N#Cc1ccnc(N2CCC[C@H]2C2CCCCC2)c1Cl	ZINC000552953478	334352728	/nfs/dbraw/zinc/35/27/28/334352728.db2.gz	QTWUCIPKDATBQV-AWEZNQCLSA-N	0	0	289.810	4.156	20	30		CIEDRN
Cc1ccccc1C1CC[NH+](Cc2ccccc2C#N)CC1	ZINC000553055091	334359265	/nfs/dbraw/zinc/35/92/65/334359265.db2.gz	QIQKRPMGUKSIDG-UHFFFAOYSA-N	0	0	290.410	4.246	20	30		CIEDRN
CC(C)Oc1ccc(Oc2nccc(C#N)c2Cl)cc1	ZINC000553107287	334361941	/nfs/dbraw/zinc/36/19/41/334361941.db2.gz	ONCYMPGDBDSHAI-UHFFFAOYSA-N	0	0	288.734	4.186	20	30		CIEDRN
Cc1nsc(N[C@H](C)c2cccc(C)c2C)c1C#N	ZINC000553107203	334361943	/nfs/dbraw/zinc/36/19/43/334361943.db2.gz	MFTCXSIYCKFAIQ-LLVKDONJSA-N	0	0	271.389	4.113	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N([C@@H](C)c1ccccc1)C1CC1	ZINC000553139282	334364475	/nfs/dbraw/zinc/36/44/75/334364475.db2.gz	IHKRDICCRLGMFB-GJZGRUSLSA-N	0	0	271.404	4.341	20	30		CIEDRN
C[C@@H]1CCN(c2nccc(C#N)c2Cl)[C@H]2CCCC[C@H]12	ZINC000553152220	334365305	/nfs/dbraw/zinc/36/53/05/334365305.db2.gz	GNDIAPAVAHOJHC-BNOWGMLFSA-N	0	0	289.810	4.012	20	30		CIEDRN
CC(C)(C#N)CCCNc1c(F)cc(Cl)cc1F	ZINC000091552394	334380346	/nfs/dbraw/zinc/38/03/46/334380346.db2.gz	NDOZGXPVZKRDHA-UHFFFAOYSA-N	0	0	272.726	4.360	20	30		CIEDRN
C[C@@H](Nc1cc(C#N)ccn1)c1cc2ccccc2s1	ZINC000553407874	334383043	/nfs/dbraw/zinc/38/30/43/334383043.db2.gz	CZTIYUGYHPGUAY-LLVKDONJSA-N	0	0	279.368	4.341	20	30		CIEDRN
C[C@H]1C[C@H](Nc2nc(C(F)(F)F)ccc2C#N)C[C@@H](C)C1	ZINC000252660640	334384261	/nfs/dbraw/zinc/38/42/61/334384261.db2.gz	BKIMGHCFLFEOBH-IAZYJMLFSA-N	0	0	297.324	4.209	20	30		CIEDRN
C[C@H](Nc1cc(C#N)ccn1)c1cccc(Cl)c1Cl	ZINC000553433464	334384889	/nfs/dbraw/zinc/38/48/89/334384889.db2.gz	CEKQRFYUZKHTMN-VIFPVBQESA-N	0	0	292.169	4.433	20	30		CIEDRN
C=CC[C@H](C)NC(=O)CCCCCO[C@H]1CCC[C@@H](C)C1	ZINC000163005407	334390793	/nfs/dbraw/zinc/39/07/93/334390793.db2.gz	KDLBDBXNYSMSKW-IKGGRYGDSA-N	0	0	295.467	4.223	20	30		CIEDRN
N#Cc1ccc(NCCCCc2ccc(Cl)s2)cn1	ZINC000553589603	334392873	/nfs/dbraw/zinc/39/28/73/334392873.db2.gz	NUYNZYFOXRDVNY-UHFFFAOYSA-N	0	0	291.807	4.103	20	30		CIEDRN
C=CCC[C@@H](C(=O)NCCC1(F)CCC1)c1ccccc1	ZINC000553726427	334397052	/nfs/dbraw/zinc/39/70/52/334397052.db2.gz	IERIJQXAMUAMEN-MRXNPFEDSA-N	0	0	289.394	4.135	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1C[C@@H](C)C[C@@H]1c1ccccc1	ZINC000553792449	334398950	/nfs/dbraw/zinc/39/89/50/334398950.db2.gz	MSQWUJPVFISCFK-BHYGNILZSA-N	0	0	286.419	4.134	20	30		CIEDRN
CC(C)(C)c1ccc(C(=O)NCC(C)(C)CCC#N)cc1	ZINC000554079420	334409794	/nfs/dbraw/zinc/40/97/94/334409794.db2.gz	WFBQZDOHWAUCSU-UHFFFAOYSA-N	0	0	286.419	4.044	20	30		CIEDRN
C=CCCC1(C(=O)NC[C@@H](c2ccccc2)C2CC2)CC1	ZINC000554118994	334413489	/nfs/dbraw/zinc/41/34/89/334413489.db2.gz	UZEZGOITFNEWCC-KRWDZBQOSA-N	0	0	283.415	4.043	20	30		CIEDRN
C=CCCC1(C(=O)NC[C@H](c2ccccc2)C2CC2)CC1	ZINC000554118995	334413550	/nfs/dbraw/zinc/41/35/50/334413550.db2.gz	UZEZGOITFNEWCC-QGZVFWFLSA-N	0	0	283.415	4.043	20	30		CIEDRN
C[C@H](c1noc(C[C@@H](CC#N)c2ccccc2)n1)C(C)(C)C	ZINC000554807672	334453722	/nfs/dbraw/zinc/45/37/22/334453722.db2.gz	NALLISNLUGFVFV-UKRRQHHQSA-N	0	0	297.402	4.459	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2ccc(Cl)cc2OC)no1	ZINC000554828425	334454748	/nfs/dbraw/zinc/45/47/48/334454748.db2.gz	ULXHTTZLHABMLQ-SNVBAGLBSA-N	0	0	292.766	4.468	20	30		CIEDRN
C=CCCN[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F	ZINC000555007170	334464821	/nfs/dbraw/zinc/46/48/21/334464821.db2.gz	UKKMKSMLTRJCAJ-LLVKDONJSA-N	0	0	281.680	4.248	20	30		CIEDRN
N#Cc1ccc(SCc2cccc(F)c2Cl)nc1	ZINC000555016904	334465317	/nfs/dbraw/zinc/46/53/17/334465317.db2.gz	SFINYMINWWZOJN-UHFFFAOYSA-N	0	0	278.739	4.038	20	30		CIEDRN
CC[C@@H]1CCCN1C(=O)c1sc2ccc(C#N)cc2c1C	ZINC000555801005	334489471	/nfs/dbraw/zinc/48/94/71/334489471.db2.gz	GZKXRSZUWKHMBH-CYBMUJFWSA-N	0	0	298.411	4.096	20	30		CIEDRN
C=CCCCCCN(C)C(=O)CC1CC(C)(C)C1	ZINC000556292895	334507109	/nfs/dbraw/zinc/50/71/09/334507109.db2.gz	LBFXZYLPWJCSEJ-UHFFFAOYSA-N	0	0	251.414	4.018	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1ccc2nccc(C)c2c1	ZINC000565261562	334548833	/nfs/dbraw/zinc/54/88/33/334548833.db2.gz	BGODROFCVMYTSJ-CQSZACIVSA-N	0	0	282.387	4.018	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cccc(F)c1Cl	ZINC000565271449	334549085	/nfs/dbraw/zinc/54/90/85/334549085.db2.gz	TWZVAUAGMOENKW-UHFFFAOYSA-N	0	0	267.731	4.186	20	30		CIEDRN
N#CCC[C@H](NC(=O)c1ccc(Cl)cc1)c1ccccc1	ZINC000153123037	334559470	/nfs/dbraw/zinc/55/94/70/334559470.db2.gz	HPYFLBTZAIUADU-INIZCTEOSA-N	0	0	298.773	4.115	20	30		CIEDRN
N#Cc1ccnc(N[C@H](Cc2ccccc2)c2ccccc2)c1	ZINC000565615653	334580231	/nfs/dbraw/zinc/58/02/31/334580231.db2.gz	MQWOVGUJTVSCHB-LJQANCHMSA-N	0	0	299.377	4.349	20	30		CIEDRN
CC(C)CC(CC(C)C)C(=O)N1CCC(CCC#N)CC1	ZINC000566275704	334640154	/nfs/dbraw/zinc/64/01/54/334640154.db2.gz	RHZVIKUQBVYKJN-UHFFFAOYSA-N	0	0	292.467	4.237	20	30		CIEDRN
C=CCCCCCNC(=O)c1scc(C)c1Cl	ZINC000566419970	334647356	/nfs/dbraw/zinc/64/73/56/334647356.db2.gz	FRKJEOWURZFMAZ-UHFFFAOYSA-N	0	0	271.813	4.186	20	30		CIEDRN
COc1cc(F)c(F)cc1N[C@H](C)c1ccc(C#N)cc1	ZINC000566590999	334656861	/nfs/dbraw/zinc/65/68/61/334656861.db2.gz	LKCVSGJMUZNHIK-SNVBAGLBSA-N	0	0	288.297	4.018	20	30		CIEDRN
C=CCCCCS(=O)(=O)[C@@H](CC)c1ccc(F)cc1	ZINC000566607959	334657187	/nfs/dbraw/zinc/65/71/87/334657187.db2.gz	KYONEWOBFJFTJT-HNNXBMFYSA-N	0	0	284.396	4.048	20	30		CIEDRN
CC(C)(C#N)CCCNc1ccc(F)cc1OCC1CC1	ZINC000154101293	334688325	/nfs/dbraw/zinc/68/83/25/334688325.db2.gz	ZQPZUQYTLZPPGF-UHFFFAOYSA-N	0	0	290.382	4.356	20	30		CIEDRN
C=C[C@H](C)NC(=O)[C@@H](Sc1ccccc1)c1ccccc1	ZINC000155510450	334722717	/nfs/dbraw/zinc/72/27/17/334722717.db2.gz	NPQMUCLPCDAXBM-YOEHRIQHSA-N	0	0	297.423	4.211	20	30		CIEDRN
C=C(C)CNC(=O)N(C)Cc1ccccc1-c1ccccc1	ZINC000156758943	334749323	/nfs/dbraw/zinc/74/93/23/334749323.db2.gz	RUVUULVIDDHAHP-UHFFFAOYSA-N	0	0	294.398	4.071	20	30		CIEDRN
N#Cc1ccc(CNCc2cc(Cl)sc2Cl)cc1	ZINC000312609779	334750664	/nfs/dbraw/zinc/75/06/64/334750664.db2.gz	UXLISSRHAWNNQL-UHFFFAOYSA-N	0	0	297.210	4.216	20	30		CIEDRN
C=C(C)CN(CC)C(=O)C[C@H](CC)c1ccc(OC)cc1	ZINC000157176332	334762336	/nfs/dbraw/zinc/76/23/36/334762336.db2.gz	MELFFLHRGCTJPJ-HNNXBMFYSA-N	0	0	289.419	4.004	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1ccc(Cl)cn1)c1ccccc1	ZINC000157347586	334768121	/nfs/dbraw/zinc/76/81/21/334768121.db2.gz	IYHUZRMAKNGSFZ-LBPRGKRZSA-N	0	0	286.762	4.033	20	30		CIEDRN
CC[C@H](C(=O)Nc1ccc(CC#N)cc1)c1ccc(F)cc1	ZINC000157479533	334772368	/nfs/dbraw/zinc/77/23/68/334772368.db2.gz	SLKWQXXBXZRKTP-KRWDZBQOSA-N	0	0	296.345	4.024	20	30		CIEDRN
C[C@H]1CC[C@H](C(=O)Nc2ccc(Cl)cc2CC#N)CC1	ZINC000567992968	334782314	/nfs/dbraw/zinc/78/23/14/334782314.db2.gz	CMZMGFGZYUEZBO-HAQNSBGRSA-N	0	0	290.794	4.171	20	30		CIEDRN
C=CCCC(=O)Nc1cccc(-c2nccn2CCCC)c1	ZINC000157916383	334787216	/nfs/dbraw/zinc/78/72/16/334787216.db2.gz	WXIHJIMNCRBGDR-UHFFFAOYSA-N	0	0	297.402	4.255	20	30		CIEDRN
CCOc1ccc(O[C@H](C)c2ccc(C#N)cc2)cc1	ZINC000568134583	334795241	/nfs/dbraw/zinc/79/52/41/334795241.db2.gz	FMFWHIZAHDGASX-CYBMUJFWSA-N	0	0	267.328	4.097	20	30		CIEDRN
CC1(C(=O)Nc2ccc(CC#N)cc2Cl)CCCCC1	ZINC000568483759	334826902	/nfs/dbraw/zinc/82/69/02/334826902.db2.gz	UHRVRWQAGSVTTL-UHFFFAOYSA-N	0	0	290.794	4.315	20	30		CIEDRN
C=C[C@@](C)(CCOC)c1nc(C2CCC(C)(C)CC2)no1	ZINC000569036389	334852373	/nfs/dbraw/zinc/85/23/73/334852373.db2.gz	BOZHYGFQYSMISU-KRWDZBQOSA-N	0	0	292.423	4.234	20	30		CIEDRN
C[C@@H](N[C@@H]1CCc2ccc(C#N)cc21)c1c(F)cccc1F	ZINC000569222652	334861903	/nfs/dbraw/zinc/86/19/03/334861903.db2.gz	MHHFSZYCEXLASK-PIGZYNQJSA-N	0	0	298.336	4.175	20	30		CIEDRN
CC[C@H]1CCCN(c2cccc(C(F)F)c2C#N)C1	ZINC000569279642	334865385	/nfs/dbraw/zinc/86/53/85/334865385.db2.gz	UQDSROBQTWXNOL-NSHDSACASA-N	0	0	264.319	4.122	20	30		CIEDRN
C=CCCCN(C)C(=O)NCc1ccc2sccc2c1	ZINC000572928858	334891729	/nfs/dbraw/zinc/89/17/29/334891729.db2.gz	PAIIFAGJRVURQK-UHFFFAOYSA-N	0	0	288.416	4.009	20	30		CIEDRN
C[C@@H](C(=O)Nc1sccc1C#N)c1ccc(Cl)s1	ZINC000175524423	335187323	/nfs/dbraw/zinc/18/73/23/335187323.db2.gz	QDHZSUJMHXDUDJ-SSDOTTSWSA-N	0	0	296.804	4.077	20	30		CIEDRN
N#CCc1cccc(NC(=O)c2cccc(C3CCC3)c2)c1	ZINC000576597590	335224808	/nfs/dbraw/zinc/22/48/08/335224808.db2.gz	CPNAMFASRCZGBP-UHFFFAOYSA-N	0	0	290.366	4.272	20	30		CIEDRN
N#Cc1ccccc1SC[C@H]1CCC2(CCCC2)O1	ZINC000576683841	335234175	/nfs/dbraw/zinc/23/41/75/335234175.db2.gz	GHCBWTVMIWEMJR-CQSZACIVSA-N	0	0	273.401	4.142	20	30		CIEDRN
N#Cc1c(Cl)cccc1SCCCCCF	ZINC000576892660	335261705	/nfs/dbraw/zinc/26/17/05/335261705.db2.gz	SZPAYQJPZFZLCW-UHFFFAOYSA-N	0	0	257.761	4.444	20	30		CIEDRN
CC[C@H](SCc1ccc(C#N)cn1)c1ccccc1	ZINC000576836850	335254163	/nfs/dbraw/zinc/25/41/63/335254163.db2.gz	GAHPSSPFXAFAFG-INIZCTEOSA-N	0	0	268.385	4.338	20	30		CIEDRN
CC#CCCCC(=O)N1CCC[C@H](c2ccc(CC)cc2)C1	ZINC000580562091	335282141	/nfs/dbraw/zinc/28/21/41/335282141.db2.gz	LYYYAKIPLJWYKY-IBGZPJMESA-N	0	0	297.442	4.149	20	30		CIEDRN
CC(C)c1ccc([C@H](Nc2cc(C#N)ncn2)C(C)C)cc1	ZINC000577044327	335288782	/nfs/dbraw/zinc/28/87/82/335288782.db2.gz	ACCSMRCPVWPWIS-GOSISDBHSA-N	0	0	294.402	4.281	20	30		CIEDRN
Cc1cc(NCc2cc(C#N)ccc2F)c(Cl)cc1F	ZINC000380005841	335291756	/nfs/dbraw/zinc/29/17/56/335291756.db2.gz	BYLJVNBBGXNSNF-UHFFFAOYSA-N	0	0	292.716	4.410	20	30		CIEDRN
C=CCCCNc1ccccc1OC[C@H]1CCCCO1	ZINC000577149622	335309267	/nfs/dbraw/zinc/30/92/67/335309267.db2.gz	HULRRLCONHBJLZ-OAHLLOKOSA-N	0	0	275.392	4.013	20	30		CIEDRN
CCc1ccc([C@H](C#N)NC(=O)[C@H](C)CC2CCCC2)cc1	ZINC000577300612	335337159	/nfs/dbraw/zinc/33/71/59/335337159.db2.gz	IVLVFTSZWAIIBN-KDOFPFPSSA-N	0	0	298.430	4.146	20	30		CIEDRN
C=CCN(Cc1ccccc1)Cc1ccc(F)cc1F	ZINC000577501815	335360386	/nfs/dbraw/zinc/36/03/86/335360386.db2.gz	MBDRSMYYXFALON-UHFFFAOYSA-N	0	0	273.326	4.153	20	30		CIEDRN
Cc1ccc(NCc2cc(C#N)cs2)cc1OC(F)F	ZINC000177702103	335379944	/nfs/dbraw/zinc/37/99/44/335379944.db2.gz	KLWUVEJLUIXESE-UHFFFAOYSA-N	0	0	294.326	4.142	20	30		CIEDRN
CCOc1ccccc1[C@H](CC)NCc1ccccc1C#N	ZINC000179082053	335472627	/nfs/dbraw/zinc/47/26/27/335472627.db2.gz	BWCZXUBWFPMNOU-SFHVURJKSA-N	0	0	294.398	4.198	20	30		CIEDRN
C=C[C@H](Cc1nc(C2CCCC2)no1)c1ccccc1	ZINC000179599754	335503053	/nfs/dbraw/zinc/50/30/53/335503053.db2.gz	MZXIMDMQIPBZAX-CYBMUJFWSA-N	0	0	268.360	4.240	20	30		CIEDRN
N#CCCCCSCc1ncc(Cl)cc1Cl	ZINC000180534426	335604274	/nfs/dbraw/zinc/60/42/74/335604274.db2.gz	LMPKKDBVYLTITC-UHFFFAOYSA-N	0	0	275.204	4.315	20	30		CIEDRN
Cc1csc(NC(=O)c2oc3ccccc3c2C)c1C#N	ZINC000578363968	335620608	/nfs/dbraw/zinc/62/06/08/335620608.db2.gz	AREZYAHSPXNRNM-UHFFFAOYSA-N	0	0	296.351	4.235	20	30		CIEDRN
C=C[C@](C)(CCOC)c1nc([C@H]2CCCC(C)(C)C2)no1	ZINC000578367732	335621215	/nfs/dbraw/zinc/62/12/15/335621215.db2.gz	JTBFEHRFBDOZLY-SUMWQHHRSA-N	0	0	292.423	4.234	20	30		CIEDRN
C=C(C)CCc1noc(C[C@H](C)c2c[nH]c3ccccc32)n1	ZINC000578400523	335627562	/nfs/dbraw/zinc/62/75/62/335627562.db2.gz	FZBZRHUKTOXBMA-ZDUSSCGKSA-N	0	0	295.386	4.406	20	30		CIEDRN
Cc1ccc(C#N)c(SC[C@@H](C)c2ccccc2)n1	ZINC000578747826	335669531	/nfs/dbraw/zinc/66/95/31/335669531.db2.gz	SEISDDRTNYNRSO-GFCCVEGCSA-N	0	0	268.385	4.158	20	30		CIEDRN
C/C=C\c1ccc(NC(=O)N2CCC(CCC#N)CC2)cc1	ZINC000578767500	335672805	/nfs/dbraw/zinc/67/28/05/335672805.db2.gz	NQBMRJJUBTYTPG-RQOWECAXSA-N	0	0	297.402	4.267	20	30		CIEDRN
CC[C@@H]1CCCCCN1C(=O)c1ccc(C2(C#N)CC2)cc1	ZINC000181035188	335748390	/nfs/dbraw/zinc/74/83/90/335748390.db2.gz	ABHLFEVGONIYNZ-QGZVFWFLSA-N	0	0	296.414	4.037	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N(C)[C@H]1CC[C@@H](SCC)C1	ZINC000181097822	335750335	/nfs/dbraw/zinc/75/03/35/335750335.db2.gz	WYTODTSSFLHDKT-SOUVJXGZSA-N	0	0	298.496	4.047	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N(C)[C@H](C)c1ccccc1	ZINC000181396829	335760477	/nfs/dbraw/zinc/76/04/77/335760477.db2.gz	INDKGMOMNIWCER-LSDHHAIUSA-N	0	0	274.408	4.134	20	30		CIEDRN
CC[C@@H](CC(=O)N(CCC#N)c1ccc(F)cc1)C(C)C	ZINC000579510131	335778084	/nfs/dbraw/zinc/77/80/84/335778084.db2.gz	VXZUTOCYEMVKEC-AWEZNQCLSA-N	0	0	290.382	4.145	20	30		CIEDRN
Cc1cnc([C@@H](N[C@H](C)c2cccc(C#N)c2)C2CC2)s1	ZINC000181820675	335786616	/nfs/dbraw/zinc/78/66/16/335786616.db2.gz	OAJFLNXHNWRZCN-WBMJQRKESA-N	0	0	297.427	4.125	20	30		CIEDRN
Cc1ccc(-c2nnc(SCC3(C#N)CCC3)o2)cc1C	ZINC000579554863	335799555	/nfs/dbraw/zinc/79/95/55/335799555.db2.gz	JAERZQAXGFLRBH-UHFFFAOYSA-N	0	0	299.399	4.139	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1cccc(C(F)F)c1	ZINC000182622807	335831384	/nfs/dbraw/zinc/83/13/84/335831384.db2.gz	NADFVFMLDJXIAM-LLVKDONJSA-N	0	0	267.319	4.099	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)C[C@H](C)c1ccccc1OC	ZINC000182632120	335832160	/nfs/dbraw/zinc/83/21/60/335832160.db2.gz	SGTAVZSCKKYMIZ-GJZGRUSLSA-N	0	0	289.419	4.050	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)[C@H](CC)c1ccccc1	ZINC000182636486	335832617	/nfs/dbraw/zinc/83/26/17/335832617.db2.gz	IIIHVNGRTBUERJ-GDBMZVCRSA-N	0	0	259.393	4.041	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)CCc1c[nH]c2ccc(C)cc12	ZINC000182650885	335834128	/nfs/dbraw/zinc/83/41/28/335834128.db2.gz	VKAXQDAJYJFGGI-HNNXBMFYSA-N	0	0	298.430	4.270	20	30		CIEDRN
CO[C@H](C)c1cccc(N[C@@H](C)c2cccc(C#N)c2)c1	ZINC000183094462	335862614	/nfs/dbraw/zinc/86/26/14/335862614.db2.gz	PETAXLVREQLXKU-UONOGXRCSA-N	0	0	280.371	4.439	20	30		CIEDRN
N#CCc1ccc(NC(=O)NCCC2=CCCCCC2)cc1	ZINC000184841952	335936089	/nfs/dbraw/zinc/93/60/89/335936089.db2.gz	YZMUWZYPFSBWSD-UHFFFAOYSA-N	0	0	297.402	4.155	20	30		CIEDRN
CC(C)(C#N)c1ccccc1CSc1cccc(O)c1	ZINC000185655008	335954875	/nfs/dbraw/zinc/95/48/75/335954875.db2.gz	JJLWRFGPAVXENS-UHFFFAOYSA-N	0	0	283.396	4.486	20	30		CIEDRN
CCc1cc(NCc2ccc(C#N)cc2F)ccc1C	ZINC000380469768	335988831	/nfs/dbraw/zinc/98/88/31/335988831.db2.gz	SYTLWKYXFYFKBD-UHFFFAOYSA-N	0	0	268.335	4.180	20	30		CIEDRN
Cc1cc(Cl)c(C(C)C)cc1Oc1ncncc1C#N	ZINC000380612140	336006902	/nfs/dbraw/zinc/00/69/02/336006902.db2.gz	QBVNYKJBFQUTIO-UHFFFAOYSA-N	0	0	287.750	4.226	20	30		CIEDRN
C[C@@H](CCOc1cc(F)cc(C#N)c1)OCc1ccccc1	ZINC000581092904	336007481	/nfs/dbraw/zinc/00/74/81/336007481.db2.gz	DBRDRLDLCHSHCN-AWEZNQCLSA-N	0	0	299.345	4.072	20	30		CIEDRN
C=CCS[C@@H](C)C(=O)Nc1ccccc1[C@@H](C)CC	ZINC000581153843	336016447	/nfs/dbraw/zinc/01/64/47/336016447.db2.gz	MMTGIKYCCNHLEL-STQMWFEESA-N	0	0	277.433	4.446	20	30		CIEDRN
C=CCS[C@@H](C)C(=O)Nc1ccccc1[C@H](C)CC	ZINC000581153841	336016470	/nfs/dbraw/zinc/01/64/70/336016470.db2.gz	MMTGIKYCCNHLEL-OLZOCXBDSA-N	0	0	277.433	4.446	20	30		CIEDRN
C=CCC1(c2nc(-c3ccc(OC)c(C)c3)no2)CCC1	ZINC000581335803	336051781	/nfs/dbraw/zinc/05/17/81/336051781.db2.gz	FGNVSHTYGBBGSB-UHFFFAOYSA-N	0	0	284.359	4.051	20	30		CIEDRN
Cc1cccc(NCc2ccc(C#N)cc2F)c1Cl	ZINC000381786836	336073171	/nfs/dbraw/zinc/07/31/71/336073171.db2.gz	GDAUWEBEYUWROU-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
Cc1cc(NCc2ccc(C#N)cc2)c(Cl)cc1F	ZINC000382174898	336083789	/nfs/dbraw/zinc/08/37/89/336083789.db2.gz	KNFJUPGYBMXJPS-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
Cc1nc(N(C)[C@@H](C)c2ccccc2)c(Cl)cc1C#N	ZINC000383628441	336115748	/nfs/dbraw/zinc/11/57/48/336115748.db2.gz	JOVYJASZXNIJPN-LBPRGKRZSA-N	0	0	285.778	4.113	20	30		CIEDRN
N#CCCC1CCN(c2ccc3c(Cl)cccc3n2)CC1	ZINC000581664455	336120493	/nfs/dbraw/zinc/12/04/93/336120493.db2.gz	OTHGFBUUKOAWCJ-UHFFFAOYSA-N	0	0	299.805	4.408	20	30		CIEDRN
Cc1cccc(CNc2cccc(OCCCC#N)c2)c1F	ZINC000384578810	336126402	/nfs/dbraw/zinc/12/64/02/336126402.db2.gz	WOYYMHQNSDQWGG-UHFFFAOYSA-N	0	0	298.361	4.429	20	30		CIEDRN
Cc1cc(C#N)ccc1-c1nc([C@H]2CCCC[C@H]2C)no1	ZINC000384959278	336135131	/nfs/dbraw/zinc/13/51/31/336135131.db2.gz	HCPCIUOILVOGFC-RISCZKNCSA-N	0	0	281.359	4.210	20	30		CIEDRN
CCc1ccc(NCc2cc(C#N)ccc2OC)cc1C	ZINC000385130331	336139805	/nfs/dbraw/zinc/13/98/05/336139805.db2.gz	YBLPSLHZTNXFOW-UHFFFAOYSA-N	0	0	280.371	4.050	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1cccc(C)c1Cl	ZINC000581919956	336166322	/nfs/dbraw/zinc/16/63/22/336166322.db2.gz	NZLGBBZJXBBZLM-LBPRGKRZSA-N	0	0	278.783	4.221	20	30		CIEDRN
CCC(C#N)(CC)C(=O)Nc1cccc2ccsc21	ZINC000386319499	336170556	/nfs/dbraw/zinc/17/05/56/336170556.db2.gz	CMHGVAMXGZNBQT-UHFFFAOYSA-N	0	0	272.373	4.170	20	30		CIEDRN
C[C@H](CC1CCCCC1)NC(=O)[C@@H]1C[C@H](C)CC(=O)N1	ZINC000329013287	533775900	/nfs/dbraw/zinc/77/59/00/533775900.db2.gz	PGRWXMFTCRBOHV-SCRDCRAPSA-N	0	0	280.412	4.057	20	30		CIEDRN
C[C@@H]1CCC[C@H]1CC(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000352197950	533886887	/nfs/dbraw/zinc/88/68/87/533886887.db2.gz	HICHURONLHONDJ-NJAFHUGGSA-N	0	0	298.430	4.364	20	30		CIEDRN
CS[C@@H]1CCC[C@H](Nc2ncc(Cl)c(C)c2C#N)C1	ZINC000343524472	533961125	/nfs/dbraw/zinc/96/11/25/533961125.db2.gz	HISXIAWSAHJELN-WDEREUQCSA-N	0	0	295.839	4.001	20	30		CIEDRN
C[C@@H]1CCN(c2ccc(F)cc2C#N)[C@H](c2ccco2)C1	ZINC000302022652	534057971	/nfs/dbraw/zinc/05/79/71/534057971.db2.gz	GIFMZDIUTGGFFL-WBMJQRKESA-N	0	0	284.334	4.268	20	30		CIEDRN
C[C@@H]1CC[C@@H](C(=O)Nc2nc(C3CCOCC3)cs2)C1	ZINC000329211255	534141159	/nfs/dbraw/zinc/14/11/59/534141159.db2.gz	GXPHGEPXBDRNRE-ZYHUDNBSSA-N	0	0	294.420	4.061	20	30		CIEDRN
C[C@@H]1CC[C@H](CC(=O)N[C@H](CCCC#N)c2ccccc2)C1	ZINC000352192484	534232433	/nfs/dbraw/zinc/23/24/33/534232433.db2.gz	MNFORDHFGKLMDL-SOLBZPMBSA-N	0	0	298.430	4.364	20	30		CIEDRN
C=CCCCC(=O)N1CCCC(CC)(CC)CC1	ZINC000470653778	517320882	/nfs/dbraw/zinc/32/08/82/517320882.db2.gz	KSZREXNNXMVOAE-UHFFFAOYSA-N	0	0	251.414	4.162	20	30		CIEDRN
C[C@H](C#N)CN(C(=O)Nc1csc2ccccc12)C1CC1	ZINC000352835326	534287767	/nfs/dbraw/zinc/28/77/67/534287767.db2.gz	XOAAVHRZBNXKJZ-LLVKDONJSA-N	0	0	299.399	4.057	20	30		CIEDRN
C#Cc1cccc(NCc2cccc(OCCC)c2)c1	ZINC000038038245	518367284	/nfs/dbraw/zinc/36/72/84/518367284.db2.gz	HWUPIRGIJMVMNV-UHFFFAOYSA-N	0	0	265.356	4.069	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1cc(Cl)ccc1Cl	ZINC000069527567	518596155	/nfs/dbraw/zinc/59/61/55/518596155.db2.gz	MXCZPCZCDUWLRT-UHFFFAOYSA-N	0	0	287.190	4.423	20	30		CIEDRN
C=CCCCNC(=O)Nc1cc(C(F)F)ccc1Cl	ZINC000279641139	518702421	/nfs/dbraw/zinc/70/24/21/518702421.db2.gz	VTBDFHCUKISRGN-UHFFFAOYSA-N	0	0	288.725	4.365	20	30		CIEDRN
Cc1nc(CSc2cccc(Cl)c2C#N)oc1C	ZINC000336140964	534402221	/nfs/dbraw/zinc/40/22/21/534402221.db2.gz	XNBRNAUPCRICTF-UHFFFAOYSA-N	0	0	278.764	4.109	20	30		CIEDRN
C=CC[C@H](C)[C@H](C)Nc1cccc(NC(=O)N(C)C)c1C	ZINC000279749161	519110618	/nfs/dbraw/zinc/11/06/18/519110618.db2.gz	YMHJCBRGLMAKBV-JSGCOSHPSA-N	0	0	289.423	4.101	20	30		CIEDRN
Cc1ccnc(N[C@@H]2CCc3c2cccc3Cl)c1C#N	ZINC000343448553	534405473	/nfs/dbraw/zinc/40/54/73/534405473.db2.gz	ZWKMOBLTOHGDMY-OAHLLOKOSA-N	0	0	283.762	4.015	20	30		CIEDRN
Cc1nc(NC(=O)[C@H]2CCC(C)(C)C2)nc2c1CCCC2	ZINC000329619692	534451591	/nfs/dbraw/zinc/45/15/91/534451591.db2.gz	MJJRYKVTVDWIBA-LBPRGKRZSA-N	0	0	287.407	4.078	20	30		CIEDRN
CCN(C(=O)Nc1ccc(C#N)cc1Cl)C1CCCC1	ZINC000269132744	519994846	/nfs/dbraw/zinc/99/48/46/519994846.db2.gz	LVVYXZVFABVTJC-UHFFFAOYSA-N	0	0	291.782	4.008	20	30		CIEDRN
Cc1cnc(-c2cccc(N[C@@H]3CCC[C@@H](C#N)C3)c2)o1	ZINC000336524320	534517627	/nfs/dbraw/zinc/51/76/27/534517627.db2.gz	FNOVRVLABZGHPG-UKRRQHHQSA-N	0	0	281.359	4.144	20	30		CIEDRN
CCC[C@H](C)C(=O)N(Cc1ccco1)c1ccccc1C#N	ZINC000264940104	520992688	/nfs/dbraw/zinc/99/26/88/520992688.db2.gz	YWHDDEUWFRQANQ-AWEZNQCLSA-N	0	0	296.370	4.121	20	30		CIEDRN
Cc1oc(-c2cccs2)nc1CSCC1(C#N)CC1	ZINC000344477977	534532352	/nfs/dbraw/zinc/53/23/52/534532352.db2.gz	BMLJTZMCKLGDMT-UHFFFAOYSA-N	0	0	290.413	4.249	20	30		CIEDRN
CCN(Cc1cccnc1Cl)[C@H](C)c1ccc(C#N)cc1	ZINC000263806005	521398305	/nfs/dbraw/zinc/39/83/05/521398305.db2.gz	RTLJQXDVPLPEJX-CYBMUJFWSA-N	0	0	299.805	4.190	20	30		CIEDRN
COc1cc(C#N)ccc1OCc1c(C)cc(C)cc1C	ZINC000049899111	522044900	/nfs/dbraw/zinc/04/49/00/522044900.db2.gz	RMRWJIDFGZBNQI-UHFFFAOYSA-N	0	0	281.355	4.071	20	30		CIEDRN
Cc1sc(CNc2ccc(C#N)cc2F)nc1C(C)C	ZINC000347172250	534607246	/nfs/dbraw/zinc/60/72/46/534607246.db2.gz	RFEYIQOFFFBPID-UHFFFAOYSA-N	0	0	289.379	4.198	20	30		CIEDRN
Cc1cccc(C(=O)N[C@@H](CCCC#N)c2ccccc2)c1	ZINC000352176094	534616763	/nfs/dbraw/zinc/61/67/63/534616763.db2.gz	ZUZADQNTGXUQBM-SFHVURJKSA-N	0	0	292.382	4.160	20	30		CIEDRN
CCc1nc([C@H](C)N[C@@H](CC)c2ccc(C#N)cc2)cs1	ZINC000278827134	522454460	/nfs/dbraw/zinc/45/44/60/522454460.db2.gz	SYBYSWYCHAJTJG-WFASDCNBSA-N	0	0	299.443	4.379	20	30		CIEDRN
CC[C@H](NCc1nc(C2CC2)cs1)c1ccc(C#N)cc1	ZINC000278898672	522671034	/nfs/dbraw/zinc/67/10/34/522671034.db2.gz	ZFOWNXFMCBIFQB-HNNXBMFYSA-N	0	0	297.427	4.133	20	30		CIEDRN
Cc1cnc([C@H](Nc2ccc(C#N)cc2F)C2CC2)s1	ZINC000301596877	534663633	/nfs/dbraw/zinc/66/36/33/534663633.db2.gz	SNFKKHCMPKONTF-CQSZACIVSA-N	0	0	287.363	4.026	20	30		CIEDRN
Cc1cccc(CNc2ccc3cc(C#N)ccc3n2)c1	ZINC000301971726	534717229	/nfs/dbraw/zinc/71/72/29/534717229.db2.gz	GMSLPDVUJCWBBS-UHFFFAOYSA-N	0	0	273.339	4.027	20	30		CIEDRN
CC[C@H](C(=O)Nc1scc(C)c1C#N)c1ccccc1	ZINC000291937682	523805650	/nfs/dbraw/zinc/80/56/50/523805650.db2.gz	BQDDSJYIWTXVFB-ZDUSSCGKSA-N	0	0	284.384	4.061	20	30		CIEDRN
O=C(NCc1cc(-c2ccccc2)no1)[C@H]1CC12CCCC2	ZINC000329962787	534756210	/nfs/dbraw/zinc/75/62/10/534756210.db2.gz	PLHJODAMIZDLGI-OAHLLOKOSA-N	0	0	296.370	4.378	20	30		CIEDRN
Cc1csc(CCCNc2ccc(C#N)c(Cl)c2)n1	ZINC000301239873	534803714	/nfs/dbraw/zinc/80/37/14/534803714.db2.gz	LYJJQTPZBKTWQP-UHFFFAOYSA-N	0	0	291.807	4.021	20	30		CIEDRN
Cc1cc([C@H](C)Nc2cc(C#N)cc(C)n2)c(C)s1	ZINC000161001595	525532366	/nfs/dbraw/zinc/53/23/66/525532366.db2.gz	LNHPIOMYZDABRK-NSHDSACASA-N	0	0	271.389	4.113	20	30		CIEDRN
Cc1c(C#N)cccc1C(=O)N(C1CC1)C1CCC(C)CC1	ZINC000337908210	525534092	/nfs/dbraw/zinc/53/40/92/525534092.db2.gz	WFZBJMIIYAAOQZ-UHFFFAOYSA-N	0	0	296.414	4.050	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)N1C[C@H]2CCCCCC[C@@H]21	ZINC000366545694	525549047	/nfs/dbraw/zinc/54/90/47/525549047.db2.gz	KLSCPONDTCXZLV-WBVHZDCISA-N	0	0	297.402	4.053	20	30		CIEDRN
C[C@H](Nc1ccnc(C#N)c1)c1ccc(Cl)cc1Cl	ZINC000061811550	525672467	/nfs/dbraw/zinc/67/24/67/525672467.db2.gz	FDDHUHXTXCITDP-VIFPVBQESA-N	0	0	292.169	4.433	20	30		CIEDRN
C[C@@H](Nc1cc(C2CC2)ccn1)c1ccc(C#N)cc1	ZINC000290037680	525696711	/nfs/dbraw/zinc/69/67/11/525696711.db2.gz	DFTRXXGRXPFYSJ-GFCCVEGCSA-N	0	0	263.344	4.004	20	30		CIEDRN
Cc1ccc(-c2ncco2)cc1NCc1ccccc1C#N	ZINC000157136541	525836834	/nfs/dbraw/zinc/83/68/34/525836834.db2.gz	ODWISRNRGDQMHP-UHFFFAOYSA-N	0	0	289.338	4.134	20	30		CIEDRN
Cc1ccc(C#N)c(NC2CC(c3ccccc3Cl)C2)n1	ZINC000338830714	525992143	/nfs/dbraw/zinc/99/21/43/525992143.db2.gz	ZSDGBHKOIFBROX-UHFFFAOYSA-N	0	0	297.789	4.273	20	30		CIEDRN
Cc1cnccc1S[C@H](C)c1cccc(C#N)c1	ZINC000338622075	526245684	/nfs/dbraw/zinc/24/56/84/526245684.db2.gz	ASRMKHGFGCJVRU-GFCCVEGCSA-N	0	0	254.358	4.115	20	30		CIEDRN
C/C=C\c1ccc(NC(=O)NCC(C)(C)CCC#N)cc1	ZINC000353290802	526341113	/nfs/dbraw/zinc/34/11/13/526341113.db2.gz	SSBUGDVGFUUBGT-XQRVVYSFSA-N	0	0	285.391	4.171	20	30		CIEDRN
C=C(C)CCSCC(=O)Nc1c(C)cccc1CC	ZINC000350750848	526460247	/nfs/dbraw/zinc/46/02/47/526460247.db2.gz	ZTNWKCXEXSZUAH-UHFFFAOYSA-N	0	0	277.433	4.195	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1ccc(CCSC)cc1	ZINC000105034680	526533410	/nfs/dbraw/zinc/53/34/10/526533410.db2.gz	RPQXMKHZFKADNP-UHFFFAOYSA-N	0	0	292.448	4.022	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1ccccc1C(C)C	ZINC000033756685	526533491	/nfs/dbraw/zinc/53/34/91/526533491.db2.gz	WRTPXLCUGRNQRC-UHFFFAOYSA-N	0	0	260.381	4.240	20	30		CIEDRN
Cc1noc(C)c1[C@@H](C)CNc1cc(Cl)ccc1C#N	ZINC000129529387	526565897	/nfs/dbraw/zinc/56/58/97/526565897.db2.gz	XCOXUSZNLVPLOK-VIFPVBQESA-N	0	0	289.766	4.032	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)c1cc(C)oc1C	ZINC000347866702	526566795	/nfs/dbraw/zinc/56/67/95/526566795.db2.gz	AXJYPVVNFMXQMF-UHFFFAOYSA-N	0	0	283.371	4.115	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)c1ccoc1Cl	ZINC000347879929	526568448	/nfs/dbraw/zinc/56/84/48/526568448.db2.gz	KTAVPPWZXOJOER-UHFFFAOYSA-N	0	0	289.762	4.152	20	30		CIEDRN
N#Cc1ccc(CNc2ccc3oc(C4CC4)nc3c2)s1	ZINC000156642732	526628102	/nfs/dbraw/zinc/62/81/02/526628102.db2.gz	PCUQNHZEUUAKJN-UHFFFAOYSA-N	0	0	295.367	4.250	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(COC(C)C)cc1	ZINC000185265207	526703374	/nfs/dbraw/zinc/70/33/74/526703374.db2.gz	MRDYSPIJJOZOLB-CQSZACIVSA-N	0	0	275.392	4.152	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC)[C@H](C)c1ccc(C#N)cc1	ZINC000185243885	526705238	/nfs/dbraw/zinc/70/52/38/526705238.db2.gz	QAGBHQIVMOEDOY-LSDHHAIUSA-N	0	0	284.403	4.070	20	30		CIEDRN
CC(C)(C)[C@H](Nc1ccc(C#N)cn1)c1ccc(F)cc1	ZINC000301565181	526711299	/nfs/dbraw/zinc/71/12/99/526711299.db2.gz	LURZIUFWPYXWFQ-MRXNPFEDSA-N	0	0	283.350	4.292	20	30		CIEDRN
CC(C)(C)[C@H](Nc1cccc(C#N)n1)c1ccc(F)cc1	ZINC000301819025	526711859	/nfs/dbraw/zinc/71/18/59/526711859.db2.gz	FTFYJUMUNFPUQI-MRXNPFEDSA-N	0	0	283.350	4.292	20	30		CIEDRN
Cc1nc(C)c(CSCc2cccc(C#N)c2F)s1	ZINC000340854049	526727713	/nfs/dbraw/zinc/72/77/13/526727713.db2.gz	ILFMBOYCJWCXIM-UHFFFAOYSA-N	0	0	292.404	4.204	20	30		CIEDRN
Cc1sc(NC(=O)[C@H]2CCC[C@H](C)C2)c(C#N)c1C	ZINC000356602694	526882795	/nfs/dbraw/zinc/88/27/95/526882795.db2.gz	YPSMGZSBSOYLRM-CABZTGNLSA-N	0	0	276.405	4.001	20	30		CIEDRN
CC(C)(CC(=O)N[C@H](CCCC#N)c1ccccc1)C1CC1	ZINC000352180987	526970142	/nfs/dbraw/zinc/97/01/42/526970142.db2.gz	XDNGGAQMWNFNMR-QGZVFWFLSA-N	0	0	298.430	4.364	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1oc2ccc(F)cc2c1C	ZINC000352536084	527018968	/nfs/dbraw/zinc/01/89/68/527018968.db2.gz	ZCBGQFVAANPRNP-UHFFFAOYSA-N	0	0	289.350	4.212	20	30		CIEDRN
C=CCCC1(C(=O)N[C@H]2CCSc3ccccc32)CC1	ZINC000353676145	527095360	/nfs/dbraw/zinc/09/53/60/527095360.db2.gz	NINRDPQCHOEJPZ-AWEZNQCLSA-N	0	0	287.428	4.086	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@H](CCC)c1ccc(F)cc1F	ZINC000344098979	527133377	/nfs/dbraw/zinc/13/33/77/527133377.db2.gz	XZIKGOXDZHHJGR-XHDPSFHLSA-N	0	0	296.361	4.070	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(N2CCC[C@H](C(C)C)CC2)c1	ZINC000302091537	527223503	/nfs/dbraw/zinc/22/35/03/527223503.db2.gz	HEKGTGUPPXWWQG-HNNXBMFYSA-N	0	0	284.403	4.023	20	30		CIEDRN
C=CCCCSCC(=O)N[C@H](CCC)c1ccccc1	ZINC000344599207	527247850	/nfs/dbraw/zinc/24/78/50/527247850.db2.gz	DUXRJSIVGYXALK-MRXNPFEDSA-N	0	0	291.460	4.343	20	30		CIEDRN
CC(C)(c1noc(C2(C#N)CCCC2)n1)C1=CCCCC1	ZINC000333071690	527382220	/nfs/dbraw/zinc/38/22/20/527382220.db2.gz	CQPFCXCGVFEWAS-UHFFFAOYSA-N	0	0	285.391	4.183	20	30		CIEDRN
CC(C)(C#N)CC(=O)N1CC2(CCCC2)[C@@H]1c1ccccc1	ZINC000334757068	527453055	/nfs/dbraw/zinc/45/30/55/527453055.db2.gz	PNOMOBDDXNTIDO-KRWDZBQOSA-N	0	0	296.414	4.070	20	30		CIEDRN
C=CCC[C@H](NC(=O)Nc1cc(C)ccn1)c1ccccc1	ZINC000345114005	527479145	/nfs/dbraw/zinc/47/91/45/527479145.db2.gz	NYEQATMFUGREGO-INIZCTEOSA-N	0	0	295.386	4.219	20	30		CIEDRN
C=CCC[C@H](NCc1nnc(C(C)C)s1)c1ccco1	ZINC000353529627	527486333	/nfs/dbraw/zinc/48/63/33/527486333.db2.gz	JSDUJQHKUKNIOF-LBPRGKRZSA-N	0	0	291.420	4.052	20	30		CIEDRN
Cc1ncsc1CS[C@@H](C)c1ccc(C#N)cc1	ZINC000290801298	527515282	/nfs/dbraw/zinc/51/52/82/527515282.db2.gz	PSOMNIPCWSYSFX-NSHDSACASA-N	0	0	274.414	4.318	20	30		CIEDRN
C=C[C@H](Cc1nc(C2CC(F)(F)C2)no1)c1ccccc1	ZINC000296241369	527595140	/nfs/dbraw/zinc/59/51/40/527595140.db2.gz	AWDDVDBVQVKPKQ-LLVKDONJSA-N	0	0	290.313	4.095	20	30		CIEDRN
CC(C)C1CCC(CNC(=O)c2ncoc2C2CC2)CC1	ZINC000329009217	527629505	/nfs/dbraw/zinc/62/95/05/527629505.db2.gz	ZDCSWQSMMZDBQC-UHFFFAOYSA-N	0	0	290.407	4.319	20	30		CIEDRN
CC(C)(C)C[C@H]1CCCN1c1ccc(Cl)c(C#N)n1	ZINC000301395634	527703815	/nfs/dbraw/zinc/70/38/15/527703815.db2.gz	FKEBURFCTITGOQ-LLVKDONJSA-N	0	0	277.799	4.012	20	30		CIEDRN
CC(C)CCN(CCC#N)Cc1ccc([C@@H]2C[C@@H]2C)o1	ZINC000353416775	527716378	/nfs/dbraw/zinc/71/63/78/527716378.db2.gz	QDIGCNYUOIJNNI-GOEBONIOSA-N	0	0	274.408	4.165	20	30		CIEDRN
CC(C)CC[C@@H](NC(=O)[C@@H](C)C#N)c1ccc(Cl)cc1	ZINC000347085536	527806408	/nfs/dbraw/zinc/80/64/08/527806408.db2.gz	ZSHQSZBBOIUUBQ-SWLSCSKDSA-N	0	0	292.810	4.093	20	30		CIEDRN
CC(C)CC[C@H](NC(=O)[C@@H](C)C#N)c1ccc(Cl)cc1	ZINC000347085537	527846113	/nfs/dbraw/zinc/84/61/13/527846113.db2.gz	ZSHQSZBBOIUUBQ-WFASDCNBSA-N	0	0	292.810	4.093	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)c1ccc(C)cc1Cl	ZINC000191663624	527970090	/nfs/dbraw/zinc/97/00/90/527970090.db2.gz	CXBDOPPMQKZUPK-UHFFFAOYSA-N	0	0	292.810	4.241	20	30		CIEDRN
CC(C)OCc1cccc(N[C@@H]2CCC[C@H](C#N)C2)c1	ZINC000193086281	528041182	/nfs/dbraw/zinc/04/11/82/528041182.db2.gz	GNKYIPXVQIDPIQ-GOEBONIOSA-N	0	0	272.392	4.106	20	30		CIEDRN
CC(C)OCc1cccc(Nc2c(C#N)cccc2C#N)c1	ZINC000302910713	528041315	/nfs/dbraw/zinc/04/13/15/528041315.db2.gz	ZFDUFSVFLQJGOG-UHFFFAOYSA-N	0	0	291.354	4.099	20	30		CIEDRN
CC(C)c1noc([C@H](C)Sc2ccc(C#N)cc2F)n1	ZINC000356034641	528511096	/nfs/dbraw/zinc/51/10/96/528511096.db2.gz	BMMPMASJKWJZJI-VIFPVBQESA-N	0	0	291.351	4.057	20	30		CIEDRN
CC(C)[C@@H]1CCC[C@H](NC(=O)C[C@H]2CCCC(=O)N2)CC1	ZINC000329675621	528683034	/nfs/dbraw/zinc/68/30/34/528683034.db2.gz	VTEMJJZQRKHGQL-QLFBSQMISA-N	0	0	294.439	4.447	20	30		CIEDRN
CC1(C#N)CCC(Nc2ccc([C@H]3CCOC3)cc2)CC1	ZINC000336217785	528833256	/nfs/dbraw/zinc/83/32/56/528833256.db2.gz	PSZRRZYVSIGPBJ-ZLPCBKJTSA-N	0	0	284.403	4.075	20	30		CIEDRN
CC1(C)CCCC[C@H]1CC(=O)NCc1noc(C2CC2)n1	ZINC000329008929	528919916	/nfs/dbraw/zinc/91/99/16/528919916.db2.gz	ZARXXLAPCUBZAN-LBPRGKRZSA-N	0	0	291.395	4.010	20	30		CIEDRN
CC1(C)CCC[C@@H](CC(=O)NCc2noc(C3CC3)n2)C1	ZINC000329006405	528954231	/nfs/dbraw/zinc/95/42/31/528954231.db2.gz	XTXAQQGMVOKQFP-NSHDSACASA-N	0	0	291.395	4.010	20	30		CIEDRN
CCC[C@@H](NC(=O)[C@H](C)C#N)c1ccc(Cl)c(Cl)c1	ZINC000347029251	528987548	/nfs/dbraw/zinc/98/75/48/528987548.db2.gz	AJTOFHMSCNJGPN-NOZJJQNGSA-N	0	0	299.201	4.110	20	30		CIEDRN
CCC[C@@H](Nc1cccc(C#N)n1)c1ccc(F)cc1F	ZINC000301665727	529022423	/nfs/dbraw/zinc/02/24/23/529022423.db2.gz	ZZNRGORSKAEORM-OAHLLOKOSA-N	0	0	287.313	4.185	20	30		CIEDRN
CCS[C@@H]1CCC[C@H](Nc2ccc(C#N)cc2)C1	ZINC000301517455	529216690	/nfs/dbraw/zinc/21/66/90/529216690.db2.gz	FTOJKYOTVSYCPD-LSDHHAIUSA-N	0	0	260.406	4.034	20	30		CIEDRN
CCSc1ccc([C@H](C)Nc2ccc(C#N)cn2)cc1	ZINC000301179351	529247957	/nfs/dbraw/zinc/24/79/57/529247957.db2.gz	HDDJKAFFPUARHF-LBPRGKRZSA-N	0	0	283.400	4.238	20	30		CIEDRN
CC[C@H]1CC[C@H](C(=O)Nc2ccc3occ(C)c3c2)O1	ZINC000330068719	529253059	/nfs/dbraw/zinc/25/30/59/529253059.db2.gz	VRFRMYJOMUFKJP-SWLSCSKDSA-N	0	0	273.332	4.287	20	30		CIEDRN
CC[C@@H](c1nnc(SCC2(C#N)CC2)o1)c1ccccc1	ZINC000349157581	529261288	/nfs/dbraw/zinc/26/12/88/529261288.db2.gz	HKHHBAYAEYNSOF-CYBMUJFWSA-N	0	0	299.399	4.007	20	30		CIEDRN
CC[C@@H](C)CCC(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000352206852	529310415	/nfs/dbraw/zinc/31/04/15/529310415.db2.gz	PPOBEOLRJZPBAG-NVXWUHKLSA-N	0	0	286.419	4.364	20	30		CIEDRN
C[C@@H](CC1CCCC1)C(=O)N[C@@](C)(C#N)C1CCCCC1	ZINC000573344049	334929970	/nfs/dbraw/zinc/92/99/70/334929970.db2.gz	HEODCMWYEHTJJA-KSSFIOAISA-N	0	0	290.451	4.182	20	30		CIEDRN
O=C(/C=C\c1ccccc1F)c1ccc(Cl)cc1	ZINC000096991553	185149201	/nfs/dbraw/zinc/14/92/01/185149201.db2.gz	UVDHXQBYZSKOPE-YFHOEESVSA-N	0	0	260.695	4.375	20	30		CIEDRN
CC[C@@]1(C)C[C@@H]1C(=O)Nc1cc(C#N)ccc1NC1CC1	ZINC000329078743	529536007	/nfs/dbraw/zinc/53/60/07/529536007.db2.gz	BRPBRBRGOPHRLM-DYVFJYSZSA-N	0	0	283.375	4.157	20	30		CIEDRN
CCc1cc2c(ncnc2Oc2ccc(C#N)cc2C)s1	ZINC000301138126	529574078	/nfs/dbraw/zinc/57/40/78/529574078.db2.gz	DZEDORBTFONGFJ-UHFFFAOYSA-N	0	0	295.367	4.226	20	30		CIEDRN
CCCCCCCCC(=O)N1CCC[C@@H]1c1ccncc1	ZINC000127846975	187336525	/nfs/dbraw/zinc/33/65/25/187336525.db2.gz	MRRMZTZXXYOCCY-QGZVFWFLSA-N	0	0	288.435	4.496	20	30		CIEDRN
CCc1cccc(C)c1NCc1ccc(F)c(C#N)c1	ZINC000083510124	178535726	/nfs/dbraw/zinc/53/57/26/178535726.db2.gz	XKPCFSAPNUGMGS-UHFFFAOYSA-N	0	0	268.335	4.180	20	30		CIEDRN
CCc1ccc([C@@H]2C[C@@H](C)CCN2c2ccc(C#N)cn2)o1	ZINC000301412822	529718011	/nfs/dbraw/zinc/71/80/11/529718011.db2.gz	APXPXZREYTXZBT-BBRMVZONSA-N	0	0	295.386	4.086	20	30		CIEDRN
Cc1csc(NC(=O)c2ccc3c(c2)CCC=C3)c1C#N	ZINC000573600397	334950597	/nfs/dbraw/zinc/95/05/97/334950597.db2.gz	AAYDHVNKAVTWBX-UHFFFAOYSA-N	0	0	294.379	4.140	20	30		CIEDRN
CC(=O)Nc1ccc(SCCCC(C)(C)C#N)cc1	ZINC000087609109	260215438	/nfs/dbraw/zinc/21/54/38/260215438.db2.gz	NRSHROGDFCPGOR-UHFFFAOYSA-N	0	0	276.405	4.067	20	30		CIEDRN
CC(C)(C)CN(CCC#N)Cc1ncc(C(C)(C)C)s1	ZINC000448333866	261117705	/nfs/dbraw/zinc/11/77/05/261117705.db2.gz	DTJHHUWALOFBTN-UHFFFAOYSA-N	0	0	293.480	4.202	20	30		CIEDRN
CCC(CC)CN(CCC#N)C(=O)c1cccc(Cl)c1	ZINC000104542648	261296481	/nfs/dbraw/zinc/29/64/81/261296481.db2.gz	ACFVTIAPQDTCGL-UHFFFAOYSA-N	0	0	292.810	4.132	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc([C@H](C)Oc2ccccc2)no1	ZINC000574433699	335019229	/nfs/dbraw/zinc/01/92/29/335019229.db2.gz	MJLNPNUQMUBJKS-OLZOCXBDSA-N	0	0	272.348	4.279	20	30		CIEDRN
CC[C@H](c1ccccc1)[S@@](=O)CCCC(C)(C)C#N	ZINC000178109330	261726013	/nfs/dbraw/zinc/72/60/13/261726013.db2.gz	RPOGFJGJGLASQW-BEFAXECRSA-N	0	0	277.433	4.216	20	30		CIEDRN
CCc1ccc([C@H](C#N)NC(=O)C[C@H](CC)C(C)C)cc1	ZINC000574721939	335042571	/nfs/dbraw/zinc/04/25/71/335042571.db2.gz	QHAWXPFMSUXMPX-RDJZCZTQSA-N	0	0	286.419	4.002	20	30		CIEDRN
CCc1ccc([C@H](C#N)NC(=O)C[C@@H](CC)C(C)C)cc1	ZINC000574721943	335042588	/nfs/dbraw/zinc/04/25/88/335042588.db2.gz	QHAWXPFMSUXMPX-WBVHZDCISA-N	0	0	286.419	4.002	20	30		CIEDRN
C=CCCCCCNC(=O)CCc1ccc2ccccc2n1	ZINC000574768705	335046380	/nfs/dbraw/zinc/04/63/80/335046380.db2.gz	LUMOJAKYRNHKQX-UHFFFAOYSA-N	0	0	296.414	4.030	20	30		CIEDRN
C=CC[C@@H](C(=O)N1CC2(CCC2)[C@H]1C(C)C)c1ccccc1	ZINC000574779875	335047001	/nfs/dbraw/zinc/04/70/01/335047001.db2.gz	AQDBGKWQDPRJMC-QZTJIDSGSA-N	0	0	297.442	4.383	20	30		CIEDRN
C=CC[C@H](C(=O)N1CC2(CCC2)[C@H]1C(C)C)c1ccccc1	ZINC000574779879	335047042	/nfs/dbraw/zinc/04/70/42/335047042.db2.gz	AQDBGKWQDPRJMC-ZWKOTPCHSA-N	0	0	297.442	4.383	20	30		CIEDRN
COc1ccccc1[C@H]1CCCN1c1ccc(C#N)cc1F	ZINC000301563074	533024638	/nfs/dbraw/zinc/02/46/38/533024638.db2.gz	VGZDKXJBLMNRRM-MRXNPFEDSA-N	0	0	296.345	4.047	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)c1ccc(Cl)cc1F	ZINC000187516509	262139010	/nfs/dbraw/zinc/13/90/10/262139010.db2.gz	IUAATRBTULKCIE-UHFFFAOYSA-N	0	0	296.773	4.024	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1c(C)noc1-c1ccccc1	ZINC000186727001	260010136	/nfs/dbraw/zinc/01/01/36/260010136.db2.gz	HYBPYEJDJAXHRF-GFCCVEGCSA-N	0	0	284.359	4.191	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@@H](C)c1ccccc1)c1ccccc1	ZINC000187702233	260028416	/nfs/dbraw/zinc/02/84/16/260028416.db2.gz	OZTVAZNZWCXICE-YJBOKZPZSA-N	0	0	279.383	4.224	20	30		CIEDRN
CC1(C#N)CCN(Cc2ccc(Cl)cc2Cl)CC1	ZINC000227352063	262388694	/nfs/dbraw/zinc/38/86/94/262388694.db2.gz	QJMDYKLFVCXLNR-UHFFFAOYSA-N	0	0	283.202	4.119	20	30		CIEDRN
C[C@H](c1ccc(F)cc1)N(C)Cc1ccc(F)cc1C#N	ZINC000171374930	335063867	/nfs/dbraw/zinc/06/38/67/335063867.db2.gz	HEVUVHZOPJRKAO-GFCCVEGCSA-N	0	0	286.325	4.029	20	30		CIEDRN
Cc1[nH]nc(-c2ccccc2)c1NC(=O)C1CC(C)(C)C1	ZINC000330186604	533653574	/nfs/dbraw/zinc/65/35/74/533653574.db2.gz	SEBNSAOSNJPARY-UHFFFAOYSA-N	0	0	283.375	4.409	20	30		CIEDRN
C[C@H](c1ccc(Cl)cc1)N(C)C(=O)c1ccc(C#N)cc1	ZINC000031331952	130124452	/nfs/dbraw/zinc/12/44/52/130124452.db2.gz	BDUSMHDXVKOFGG-GFCCVEGCSA-N	0	0	298.773	4.045	20	30		CIEDRN
C=CCOc1ccccc1-c1nc(-c2cc(C)oc2C)no1	ZINC000575112074	335066654	/nfs/dbraw/zinc/06/66/54/335066654.db2.gz	ANJAEAKDSPARAY-UHFFFAOYSA-N	0	0	296.326	4.178	20	30		CIEDRN
C=CCOc1ccccc1CNCc1ccccc1Cl	ZINC000006303919	170189464	/nfs/dbraw/zinc/18/94/64/170189464.db2.gz	BSRPMJFWFGILBC-UHFFFAOYSA-N	0	0	287.790	4.195	20	30		CIEDRN
C=CCN(CC=C)C(=S)Nc1ccc(CCCC)cc1	ZINC000006629215	170220221	/nfs/dbraw/zinc/22/02/21/170220221.db2.gz	QYGREJGZWYLZNF-UHFFFAOYSA-N	0	0	288.460	4.400	20	30		CIEDRN
C=CCNc1nc(-c2ccc(OC)c(Cl)c2)cs1	ZINC000007643569	170295470	/nfs/dbraw/zinc/29/54/70/170295470.db2.gz	BYYVOPIKIIIWER-UHFFFAOYSA-N	0	0	280.780	4.070	20	30		CIEDRN
CCCCc1ccc(NC(=O)c2cccc(C#N)c2)cc1	ZINC000007842602	170304395	/nfs/dbraw/zinc/30/43/95/170304395.db2.gz	KBDMQMAONLQZJV-UHFFFAOYSA-N	0	0	278.355	4.153	20	30		CIEDRN
CC(C)Sc1ccc(C(=O)Nc2ccccc2C#N)cc1	ZINC000009620373	170383115	/nfs/dbraw/zinc/38/31/15/170383115.db2.gz	QJRLZKHIHDHEHY-UHFFFAOYSA-N	0	0	296.395	4.311	20	30		CIEDRN
Cc1cc(C)cc(C(=O)Nc2ccc(C#N)c(Cl)c2)c1	ZINC000015540366	170669817	/nfs/dbraw/zinc/66/98/17/170669817.db2.gz	XKHBWNLRHNVCBM-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
N#Cc1ccc(CSCc2ccccc2)c(F)c1	ZINC000019847552	170896752	/nfs/dbraw/zinc/89/67/52/170896752.db2.gz	QCMYJNYPVALCKV-UHFFFAOYSA-N	0	0	257.333	4.131	20	30		CIEDRN
CCc1cccc(N[C@H](C)c2ccc(C#N)cc2)c1	ZINC000019962148	170944156	/nfs/dbraw/zinc/94/41/56/170944156.db2.gz	WRMKCGQFFWIGRV-CYBMUJFWSA-N	0	0	250.345	4.294	20	30		CIEDRN
CC(C)c1cccc(NCc2cccc(C#N)c2)c1	ZINC000020136494	171024066	/nfs/dbraw/zinc/02/40/66/171024066.db2.gz	HVHFFORDQOOXIG-UHFFFAOYSA-N	0	0	250.345	4.294	20	30		CIEDRN
CCCOc1ccc(Oc2ccc(C#N)cc2)cc1	ZINC000020473920	171218140	/nfs/dbraw/zinc/21/81/40/171218140.db2.gz	TVHGEHJGARBGBH-UHFFFAOYSA-N	0	0	253.301	4.139	20	30		CIEDRN
N#Cc1ccccc1COc1cccc(C(F)(F)F)c1	ZINC000020548026	171245262	/nfs/dbraw/zinc/24/52/62/171245262.db2.gz	HMNBNZIFBICCEJ-UHFFFAOYSA-N	0	0	277.245	4.156	20	30		CIEDRN
N#Cc1cccc(CSc2ccc3c(c2)OCCCO3)c1	ZINC000021465702	171304245	/nfs/dbraw/zinc/30/42/45/171304245.db2.gz	WNKRIPIZVROFDD-UHFFFAOYSA-N	0	0	297.379	4.012	20	30		CIEDRN
C[C@H](Nc1cccc(F)c1C#N)c1ccc(F)cc1F	ZINC000026227148	171476182	/nfs/dbraw/zinc/47/61/82/171476182.db2.gz	WXJDWKVRDXAPRZ-VIFPVBQESA-N	0	0	276.261	4.149	20	30		CIEDRN
O=C1c2ccccc2C/C1=C\c1ccc(N2CCCC2)cc1	ZINC000031643689	171641649	/nfs/dbraw/zinc/64/16/49/171641649.db2.gz	XJKDJUQOHYKBES-GHRIWEEISA-N	0	0	289.378	4.109	20	30		CIEDRN
N#Cc1ccc(OCCCOc2ccc(Cl)cc2)cc1	ZINC000034652306	171847725	/nfs/dbraw/zinc/84/77/25/171847725.db2.gz	FOLDBSOXIFVPCM-UHFFFAOYSA-N	0	0	287.746	4.060	20	30		CIEDRN
COc1ccc(C)cc1CNc1ccc(Cl)c(C#N)c1	ZINC000035224500	172068881	/nfs/dbraw/zinc/06/88/81/172068881.db2.gz	NBXXGHVBPHTEID-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
C[C@@H](Nc1ccc(C(F)(F)F)cc1C#N)c1ccccn1	ZINC000035695164	172363575	/nfs/dbraw/zinc/36/35/75/172363575.db2.gz	GBPGSHDLDJRWND-SNVBAGLBSA-N	0	0	291.276	4.145	20	30		CIEDRN
N#Cc1ccc(CSc2ccc(N)cc2Cl)c(F)c1	ZINC000037205073	173027353	/nfs/dbraw/zinc/02/73/53/173027353.db2.gz	MYBSUYHOFHLRPU-UHFFFAOYSA-N	0	0	292.766	4.225	20	30		CIEDRN
C=CCn1c(S[C@@H](C)CC)nnc1-c1ccccc1	ZINC000039758212	174172096	/nfs/dbraw/zinc/17/20/96/174172096.db2.gz	KMKAMYSWZWFCFC-LBPRGKRZSA-N	0	0	273.405	4.022	20	30		CIEDRN
N#CC1(C(=O)Nc2cc(Cl)ccc2Cl)CCCCC1	ZINC000044385100	175169623	/nfs/dbraw/zinc/16/96/23/175169623.db2.gz	TUHMRJSFYCCMDQ-UHFFFAOYSA-N	0	0	297.185	4.406	20	30		CIEDRN
N#Cc1c(F)cccc1Nc1ccc(C(F)(F)F)cc1	ZINC000071630750	176236565	/nfs/dbraw/zinc/23/65/65/176236565.db2.gz	GWMAMQCSXMOPEH-UHFFFAOYSA-N	0	0	280.224	4.460	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)c2ccc(F)c(C)c2)c1	ZINC000078415427	177339381	/nfs/dbraw/zinc/33/93/81/177339381.db2.gz	WIKAPTKJMUDHFX-UHFFFAOYSA-N	0	0	299.345	4.341	20	30		CIEDRN
C[C@@H]1CCCN(c2ccc(C#N)c(C(F)(F)F)c2)CC1	ZINC000078535512	177351277	/nfs/dbraw/zinc/35/12/77/177351277.db2.gz	LEJCDNSQSURREW-LLVKDONJSA-N	0	0	282.309	4.203	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1cc[nH]c1C	ZINC000188068781	260070839	/nfs/dbraw/zinc/07/08/39/260070839.db2.gz	CEPVTIATRFSNIL-UHFFFAOYSA-N	0	0	282.387	4.427	20	30		CIEDRN
N#CC1(C(=O)N[C@@H]2CC=C(c3ccc(F)cc3)CC2)CCC1	ZINC000329245521	227378364	/nfs/dbraw/zinc/37/83/64/227378364.db2.gz	QOYBEMWVUWVLBB-MRXNPFEDSA-N	0	0	298.361	4.412	20	30		CIEDRN
N#C[C@H]1CC[C@H](Nc2ccc3nc(C(F)F)sc3c2)C1	ZINC000334583065	225017533	/nfs/dbraw/zinc/01/75/33/225017533.db2.gz	RDIAXRAXKDLORY-IUCAKERBSA-N	0	0	293.342	4.338	20	30		CIEDRN
Cc1oc(-c2ccsc2)nc1CSCC1(C#N)CC1	ZINC000344469952	225068468	/nfs/dbraw/zinc/06/84/68/225068468.db2.gz	UNCFIVIJVGKSMY-UHFFFAOYSA-N	0	0	290.413	4.249	20	30		CIEDRN
N#Cc1c(Cl)cccc1SCc1ccc(F)cn1	ZINC000344639704	225111035	/nfs/dbraw/zinc/11/10/35/225111035.db2.gz	HAJUYMXRJYFKTL-UHFFFAOYSA-N	0	0	278.739	4.038	20	30		CIEDRN
Cc1csc(NC(=O)C2CCC(C)(C)CC2)c1C#N	ZINC000344897235	225193725	/nfs/dbraw/zinc/19/37/25/225193725.db2.gz	ODRPKRLUGVLBLW-UHFFFAOYSA-N	0	0	276.405	4.083	20	30		CIEDRN
C[C@H](N[C@@H]1CCCCc2cc(C#N)ccc21)c1nccs1	ZINC000334835255	225328886	/nfs/dbraw/zinc/32/88/86/225328886.db2.gz	JEEVRRQLSUSGHQ-BLLLJJGKSA-N	0	0	297.427	4.133	20	30		CIEDRN
Cc1ccc(NC(=O)N(C)[C@H](C)c2cccc(C#N)c2)s1	ZINC000335297335	226237823	/nfs/dbraw/zinc/23/78/23/226237823.db2.gz	BVASLPFIQXRHDT-GFCCVEGCSA-N	0	0	299.399	4.153	20	30		CIEDRN
CO[C@H](C)c1cccc(N[C@H]2CCc3ccc(C#N)cc32)c1	ZINC000575168564	335074687	/nfs/dbraw/zinc/07/46/87/335074687.db2.gz	VVHWHOLPIPRRER-YJYMSZOUSA-N	0	0	292.382	4.365	20	30		CIEDRN
N#C[C@H]1CC[C@@H](Sc2ccnc3ccccc32)C1	ZINC000336269877	226840823	/nfs/dbraw/zinc/84/08/23/226840823.db2.gz	XFQPZECTQKYEBU-NWDGAFQWSA-N	0	0	254.358	4.019	20	30		CIEDRN
N#Cc1csc(CN[C@H](CC2CCC2)c2ccccc2)n1	ZINC000352797713	227234927	/nfs/dbraw/zinc/23/49/27/227234927.db2.gz	NAEYVIDSPDTYPW-MRXNPFEDSA-N	0	0	297.427	4.036	20	30		CIEDRN
Cc1nc(CCNC(=O)C2(CC(C)C)CCCC2)c(C)o1	ZINC000329018264	227259545	/nfs/dbraw/zinc/25/95/45/227259545.db2.gz	KXCVZAGLSVXICI-UHFFFAOYSA-N	0	0	292.423	4.397	20	30		CIEDRN
Cc1ccccc1[C@H]1CCCN1c1ccc(C#N)cc1	ZINC000301096803	227447095	/nfs/dbraw/zinc/44/70/95/227447095.db2.gz	PDRXBAAHESNCDB-GOSISDBHSA-N	0	0	262.356	4.208	20	30		CIEDRN
C[C@@H](Nc1cccc(C#N)n1)c1cccc(Cl)c1Cl	ZINC000301257663	227489915	/nfs/dbraw/zinc/48/99/15/227489915.db2.gz	DYFCOXXYZQHHEI-SECBINFHSA-N	0	0	292.169	4.433	20	30		CIEDRN
C[C@H]1C[C@H](c2ccc(F)cc2)CN1c1ccc(C#N)cc1	ZINC000301339164	227515369	/nfs/dbraw/zinc/51/53/69/227515369.db2.gz	PKYNQRZJXRBBSX-BBRMVZONSA-N	0	0	280.346	4.080	20	30		CIEDRN
N#Cc1ccc2nc(N3CCC[C@@H]3c3ccccc3)ccc2c1	ZINC000301839698	227701461	/nfs/dbraw/zinc/70/14/61/227701461.db2.gz	ZTWUSGCCNWKZOL-LJQANCHMSA-N	0	0	299.377	4.448	20	30		CIEDRN
C[C@@H]1CCCc2ccccc2[C@H]1Nc1ncccc1C#N	ZINC000302183802	227814443	/nfs/dbraw/zinc/81/44/43/227814443.db2.gz	SELPBAGXHRPGOB-DYVFJYSZSA-N	0	0	277.371	4.079	20	30		CIEDRN
Cc1c(CNc2ccc(C)c(C#N)n2)oc2ccc(F)cc12	ZINC000302613399	227870296	/nfs/dbraw/zinc/87/02/96/227870296.db2.gz	FKNRKQWWYUICKA-UHFFFAOYSA-N	0	0	295.317	4.068	20	30		CIEDRN
Cc1noc(C)c1[C@H](C)CC(=O)NC1CCC2(CC2)CC1	ZINC000329967192	228001463	/nfs/dbraw/zinc/00/14/63/228001463.db2.gz	VIGCFWVFQCEHKM-LLVKDONJSA-N	0	0	290.407	4.464	20	30		CIEDRN
CCc1nnc(C)cc1C(=O)N[C@H](C)CC1CCCCC1	ZINC000329971321	228002536	/nfs/dbraw/zinc/00/25/36/228002536.db2.gz	XRGVXUJJSJOXQE-GFCCVEGCSA-N	0	0	289.423	4.011	20	30		CIEDRN
Cc1nc(CC2CC2)oc1C(=O)NC1CCC(C)(C)CC1	ZINC000330012803	228016392	/nfs/dbraw/zinc/01/63/92/228016392.db2.gz	LDPBBQQDASTQSW-UHFFFAOYSA-N	0	0	290.407	4.209	20	30		CIEDRN
O=C(Nc1ccc2nc(C3CC3)oc2c1)C1CCC(=O)CC1	ZINC000330301630	228121554	/nfs/dbraw/zinc/12/15/54/228121554.db2.gz	NXZMLONOGJTRHG-UHFFFAOYSA-N	0	0	298.342	4.053	20	30		CIEDRN
Cc1ccc(-c2cccnc2)cc1NC(=O)[C@@H]1CC[C@@H](C)O1	ZINC000330086145	228035667	/nfs/dbraw/zinc/03/56/67/228035667.db2.gz	LZJZILKDZVUWMH-DYVFJYSZSA-N	0	0	296.370	4.213	20	30		CIEDRN
Cc1cc(NC(=O)c2ccc(C#N)s2)ccc1C1CC1	ZINC000355893885	228038918	/nfs/dbraw/zinc/03/89/18/228038918.db2.gz	PIGJMABOHMWLHE-UHFFFAOYSA-N	0	0	282.368	4.058	20	30		CIEDRN
Cc1coc2ccc(NC(=O)[C@@H]3CCC(=O)[C@@H](C)C3)cc12	ZINC000330116495	228042307	/nfs/dbraw/zinc/04/23/07/228042307.db2.gz	VNKMGRYTGVGIEP-CMPLNLGQSA-N	0	0	285.343	4.335	20	30		CIEDRN
Cc1nc2cc(Cl)c(NC(=O)[C@H]3CCCO3)cc2s1	ZINC000330130489	228046071	/nfs/dbraw/zinc/04/60/71/228046071.db2.gz	PBWNFRUJGUXHPO-LLVKDONJSA-N	0	0	296.779	4.025	20	30		CIEDRN
N#CCCCN(Cc1c(Cl)cccc1Cl)C1CC1	ZINC000353199548	228068219	/nfs/dbraw/zinc/06/82/19/228068219.db2.gz	GJODPJBAZGHACQ-UHFFFAOYSA-N	0	0	283.202	4.262	20	30		CIEDRN
Cc1cccc2cc(C(=O)NC3(C#N)CCCCC3)sc21	ZINC000332195669	228151984	/nfs/dbraw/zinc/15/19/84/228151984.db2.gz	RJMNWGCXNBVTCT-UHFFFAOYSA-N	0	0	298.411	4.166	20	30		CIEDRN
C[C@@H]1CCCCCN1C(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000332365548	228156936	/nfs/dbraw/zinc/15/69/36/228156936.db2.gz	XNUJDNHALTYVNN-WBVHZDCISA-N	0	0	299.418	4.006	20	30		CIEDRN
N#CCC1CCN(C(=O)Nc2ccc(C3CCC3)cc2)CC1	ZINC000336092958	228186727	/nfs/dbraw/zinc/18/67/27/228186727.db2.gz	WXUADAQYAXLFMC-UHFFFAOYSA-N	0	0	297.402	4.112	20	30		CIEDRN
N#Cc1ccsc1C(=O)Nc1csc2ccccc12	ZINC000352192102	228195059	/nfs/dbraw/zinc/19/50/59/228195059.db2.gz	JHXKDKBJVKXNQT-UHFFFAOYSA-N	0	0	284.365	4.087	20	30		CIEDRN
Cc1ccccc1C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000352205293	228198051	/nfs/dbraw/zinc/19/80/51/228198051.db2.gz	DOGSUHSLQOQUJK-SFHVURJKSA-N	0	0	292.382	4.160	20	30		CIEDRN
N#CCCC[C@@H](NC(=O)[C@@H]1CC12CCCC2)c1ccccc1	ZINC000352207156	228199185	/nfs/dbraw/zinc/19/91/85/228199185.db2.gz	ULPXLUQSPXMQRF-DLBZAZTESA-N	0	0	296.414	4.118	20	30		CIEDRN
N#CCCC[C@H](NC(=O)[C@@H]1CC12CCCC2)c1ccccc1	ZINC000352207158	228199216	/nfs/dbraw/zinc/19/92/16/228199216.db2.gz	ULPXLUQSPXMQRF-IRXDYDNUSA-N	0	0	296.414	4.118	20	30		CIEDRN
N#CCCC[C@H](NC(=O)C[C@H]1C=CCCC1)c1ccccc1	ZINC000352216376	228200529	/nfs/dbraw/zinc/20/05/29/228200529.db2.gz	HKKXTIVIBUETIN-WMZOPIPTSA-N	0	0	296.414	4.284	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@@H](CC)c1cccc(Cl)c1	ZINC000180646897	260107869	/nfs/dbraw/zinc/10/78/69/260107869.db2.gz	TVHGSNFNRUDULE-AWEZNQCLSA-N	0	0	280.799	4.009	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N(C)[C@@H](C)c1ccc(Cl)cc1	ZINC000116973654	260019472	/nfs/dbraw/zinc/01/94/72/260019472.db2.gz	OBMPJBUHTNRDLT-NEPJUHHUSA-N	0	0	280.799	4.007	20	30		CIEDRN
C=C(C)CCc1noc([C@@H](C)c2cn(C)c3ccccc23)n1	ZINC000517201639	260045659	/nfs/dbraw/zinc/04/56/59/260045659.db2.gz	CZMDUXNJPRNXFA-ZDUSSCGKSA-N	0	0	295.386	4.222	20	30		CIEDRN
C/C(=C\c1ccccc1)CN(CCC#N)Cc1ccco1	ZINC000179542347	260053712	/nfs/dbraw/zinc/05/37/12/260053712.db2.gz	VIYSEJIUIARBGM-DTQAZKPQSA-N	0	0	280.371	4.099	20	30		CIEDRN
CCCCCCCC(=O)N1CCC[C@H]1c1cc(C)on1	ZINC000363332395	260058904	/nfs/dbraw/zinc/05/89/04/260058904.db2.gz	XNHQPQXQBDULST-HNNXBMFYSA-N	0	0	278.396	4.007	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1cc(CC)[nH]n1	ZINC000188061048	260070706	/nfs/dbraw/zinc/07/07/06/260070706.db2.gz	ZZIUWZMHJVGPQY-UHFFFAOYSA-N	0	0	297.402	4.076	20	30		CIEDRN
C[C@H](Nc1cccc(OCCCC#N)c1)C(C)(C)C	ZINC000179821260	260076269	/nfs/dbraw/zinc/07/62/69/260076269.db2.gz	NQNMFLCRDAGZOA-ZDUSSCGKSA-N	0	0	260.381	4.216	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cc2c(cc1Cl)CCC2=O	ZINC000298101441	260144338	/nfs/dbraw/zinc/14/43/38/260144338.db2.gz	URGJJTIJUJXQGP-UHFFFAOYSA-N	0	0	291.778	4.010	20	30		CIEDRN
Cc1cc([C@H](C)Nc2ccc(C#N)cc2)c(C)s1	ZINC000019991189	260148482	/nfs/dbraw/zinc/14/84/82/260148482.db2.gz	PDCDPZNFJDRQKE-NSHDSACASA-N	0	0	256.374	4.410	20	30		CIEDRN
N#CCOc1cccc(N[C@H]2CCC[C@@H](C(F)(F)F)C2)c1	ZINC000069380284	260149909	/nfs/dbraw/zinc/14/99/09/260149909.db2.gz	HCPSACWXAIIBRL-NEPJUHHUSA-N	0	0	298.308	4.122	20	30		CIEDRN
N#CCOc1cccc(N[C@@H]2CCC[C@H](C(F)(F)F)C2)c1	ZINC000069380266	260150101	/nfs/dbraw/zinc/15/01/01/260150101.db2.gz	HCPSACWXAIIBRL-NWDGAFQWSA-N	0	0	298.308	4.122	20	30		CIEDRN
CCN(c1nc(C(F)(F)F)ccc1C#N)C1CCCCC1	ZINC000078832375	260169529	/nfs/dbraw/zinc/16/95/29/260169529.db2.gz	RDRXTAFWYNZNGQ-UHFFFAOYSA-N	0	0	297.324	4.131	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)N1CC=C(C(C)(C)C)CC1	ZINC000408006665	260170424	/nfs/dbraw/zinc/17/04/24/260170424.db2.gz	BXBRBNCIPYAABG-UHFFFAOYSA-N	0	0	297.402	4.077	20	30		CIEDRN
Cc1ccc(C(C)C)cc1Oc1cccc(C#N)n1	ZINC000081621468	260183674	/nfs/dbraw/zinc/18/36/74/260183674.db2.gz	YDKGLCDLXVHJAK-UHFFFAOYSA-N	0	0	252.317	4.177	20	30		CIEDRN
CC(C)(C#N)CCCOc1cccc(Br)c1	ZINC000087598973	260191688	/nfs/dbraw/zinc/19/16/88/260191688.db2.gz	JCQWGTBBFVWHLS-UHFFFAOYSA-N	0	0	282.181	4.158	20	30		CIEDRN
Cc1ccc(Cl)cc1NCCCC(C)(C)C#N	ZINC000087596921	260191810	/nfs/dbraw/zinc/19/18/10/260191810.db2.gz	BSIGUEJHAXVHQL-UHFFFAOYSA-N	0	0	250.773	4.390	20	30		CIEDRN
CC(C)(C#N)CCCSc1ccc(F)c(F)c1	ZINC000087609120	260192235	/nfs/dbraw/zinc/19/22/35/260192235.db2.gz	HDMZUNKIBVMGKR-UHFFFAOYSA-N	0	0	255.333	4.387	20	30		CIEDRN
CC(C)(C#N)CCCSc1ccc(F)cc1F	ZINC000087609123	260192302	/nfs/dbraw/zinc/19/23/02/260192302.db2.gz	CFPLXWQTANQCKO-UHFFFAOYSA-N	0	0	255.333	4.387	20	30		CIEDRN
CC(C)(C#N)CCC[S@](=O)c1ccc2ccccc2c1	ZINC000087611250	260216088	/nfs/dbraw/zinc/21/60/88/260216088.db2.gz	LXDWMDPRQXTJGM-HXUWFJFHSA-N	0	0	285.412	4.277	20	30		CIEDRN
CC(C)c1ccc([S@](=O)CCCC(C)(C)C#N)cc1	ZINC000087611208	260216201	/nfs/dbraw/zinc/21/62/01/260216201.db2.gz	URWXAVZULANHIZ-IBGZPJMESA-N	0	0	277.433	4.248	20	30		CIEDRN
C[C@@H](NC(=O)C1(C#N)CCCCC1)c1cc2ccccc2o1	ZINC000057384375	260224069	/nfs/dbraw/zinc/22/40/69/260224069.db2.gz	GFSRWBVQFLVEQY-CYBMUJFWSA-N	0	0	296.370	4.084	20	30		CIEDRN
COC[C@H](Nc1ccc(C#N)c(Cl)c1)c1ccccc1	ZINC000091981560	260267453	/nfs/dbraw/zinc/26/74/53/260267453.db2.gz	YLKBAMYPCSZLPJ-INIZCTEOSA-N	0	0	286.762	4.011	20	30		CIEDRN
CC1(C)Cc2cc(CNc3cccc(CC#N)c3)ccc2O1	ZINC000313414872	260292173	/nfs/dbraw/zinc/29/21/73/260292173.db2.gz	ZUZYQWVHKKNKSY-UHFFFAOYSA-N	0	0	292.382	4.078	20	30		CIEDRN
CC[C@H](Cc1ccccc1)Nc1cccc(CC#N)c1	ZINC000313441782	260294531	/nfs/dbraw/zinc/29/45/31/260294531.db2.gz	VJBOVWIUTROJJU-QGZVFWFLSA-N	0	0	264.372	4.186	20	30		CIEDRN
COc1ccc(CC[C@H](C)Nc2cccc(CC#N)c2)cc1	ZINC000313477049	260297645	/nfs/dbraw/zinc/29/76/45/260297645.db2.gz	KRHKWCABSYCBPW-HNNXBMFYSA-N	0	0	294.398	4.194	20	30		CIEDRN
N#CCc1cccc(NC2CC(c3ccccc3)C2)c1	ZINC000313477541	260297709	/nfs/dbraw/zinc/29/77/09/260297709.db2.gz	KZYACXKMERYEOT-UHFFFAOYSA-N	0	0	262.356	4.111	20	30		CIEDRN
CC(C)(C)CCC(=O)Nc1ccccc1SCCC#N	ZINC000078118339	260299686	/nfs/dbraw/zinc/29/96/86/260299686.db2.gz	FDBUKCILFGQEGH-UHFFFAOYSA-N	0	0	290.432	4.457	20	30		CIEDRN
Cc1cccc(C)c1NC(=O)N(CCC#N)CCC(C)C	ZINC000078460338	260300269	/nfs/dbraw/zinc/30/02/69/260300269.db2.gz	PNVNVXHSUYCUAX-UHFFFAOYSA-N	0	0	287.407	4.097	20	30		CIEDRN
C[C@@H](CC#N)Sc1ccccc1NC(=O)CC1CCC1	ZINC000080172200	260312025	/nfs/dbraw/zinc/31/20/25/260312025.db2.gz	HASDVTJKUWTLRD-LBPRGKRZSA-N	0	0	288.416	4.210	20	30		CIEDRN
C=CCN(C(=O)c1ccc(CCC)cc1)c1ccccc1	ZINC000517905816	260315731	/nfs/dbraw/zinc/31/57/31/260315731.db2.gz	IEDCZIHCBBOXJP-UHFFFAOYSA-N	0	0	279.383	4.472	20	30		CIEDRN
N#Cc1cc(F)ccc1NCc1ccc(C2CC2)cc1	ZINC000126244176	260346332	/nfs/dbraw/zinc/34/63/32/260346332.db2.gz	MBONCQLLOCQABT-UHFFFAOYSA-N	0	0	266.319	4.187	20	30		CIEDRN
Cc1oc2ccccc2c1CNc1ccc(F)cc1C#N	ZINC000126330628	260350575	/nfs/dbraw/zinc/35/05/75/260350575.db2.gz	IDTSCVXKPHKXSF-UHFFFAOYSA-N	0	0	280.302	4.364	20	30		CIEDRN
CSC(C)(C)CNc1ccc(C(F)(F)F)c(C#N)c1	ZINC000128028130	260371464	/nfs/dbraw/zinc/37/14/64/260371464.db2.gz	KLSZJOUDCXHABS-UHFFFAOYSA-N	0	0	288.338	4.131	20	30		CIEDRN
CC(=O)c1ccc(C#N)cc1N(C)Cc1ccc(Cl)cc1	ZINC000130588815	260397342	/nfs/dbraw/zinc/39/73/42/260397342.db2.gz	RJRHCRFKMRRKNY-UHFFFAOYSA-N	0	0	298.773	4.051	20	30		CIEDRN
C=C1CCN(C(=O)c2ccc(Cl)c(CCC)c2)CC1	ZINC000409529500	260416193	/nfs/dbraw/zinc/41/61/93/260416193.db2.gz	MVGQLZUNERSXKL-UHFFFAOYSA-N	0	0	277.795	4.085	20	30		CIEDRN
C=CCC(C)(C)c1nc(Cc2cccc(Cl)c2)no1	ZINC000426330286	260431670	/nfs/dbraw/zinc/43/16/70/260431670.db2.gz	LQAIIHFVQIOJRE-UHFFFAOYSA-N	0	0	276.767	4.168	20	30		CIEDRN
CC(C)COCCSCc1ccc(C#N)cc1Cl	ZINC000409849265	260434156	/nfs/dbraw/zinc/43/41/56/260434156.db2.gz	HCQLTOLYYQLEDW-UHFFFAOYSA-N	0	0	283.824	4.117	20	30		CIEDRN
Cc1nc(C(C)C)ccc1COc1cccc(F)c1C#N	ZINC000518569730	260455739	/nfs/dbraw/zinc/45/57/39/260455739.db2.gz	JDMSGZHJXVTLTB-UHFFFAOYSA-N	0	0	284.334	4.103	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)C[C@H](CC)c1ccccc1	ZINC000410116426	260462097	/nfs/dbraw/zinc/46/20/97/260462097.db2.gz	JRVNWZCMOKTWBM-HOCLYGCPSA-N	0	0	259.393	4.041	20	30		CIEDRN
CC(C)n1cc([C@@H](C)N[C@@H](CCC#N)c2ccccc2)cn1	ZINC000090665975	260465392	/nfs/dbraw/zinc/46/53/92/260465392.db2.gz	YEQRBTUGDACRRO-QAPCUYQASA-N	0	0	296.418	4.160	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1ccc(C(C)=O)cc1	ZINC000410374927	260492446	/nfs/dbraw/zinc/49/24/46/260492446.db2.gz	NUAXEEDCKCFVHD-UHFFFAOYSA-N	0	0	293.366	4.260	20	30		CIEDRN
N#Cc1cc2c(nc1S[C@@H]1C=CCCC1)CCCC2	ZINC000518686125	260494792	/nfs/dbraw/zinc/49/47/92/260494792.db2.gz	UAILOVOHUQHLSO-CQSZACIVSA-N	0	0	270.401	4.033	20	30		CIEDRN
COc1ccc(CC[C@H](C)Nc2ccc(F)cc2C#N)cc1	ZINC000317709272	260494967	/nfs/dbraw/zinc/49/49/67/260494967.db2.gz	JZZUMIVWQNFJNB-ZDUSSCGKSA-N	0	0	298.361	4.139	20	30		CIEDRN
C=CCN1CCC[C@H]1c1nc(-c2ccc(Cl)cc2)c[nH]1	ZINC000426995683	260548404	/nfs/dbraw/zinc/54/84/04/260548404.db2.gz	SMPDHXLTELGSRH-HNNXBMFYSA-N	0	0	287.794	4.053	20	30		CIEDRN
C=C(C)CN(C)[C@@H](C)C(=O)Nc1ccccc1[C@H](C)CC	ZINC000181289149	260577702	/nfs/dbraw/zinc/57/77/02/260577702.db2.gz	GAAOGPISMMLHIE-CABCVRRESA-N	0	0	288.435	4.035	20	30		CIEDRN
C=CCn1c(SCCCC)nnc1-c1ccccc1F	ZINC000215787077	260597956	/nfs/dbraw/zinc/59/79/56/260597956.db2.gz	SJUDVPMDZMWMDT-UHFFFAOYSA-N	0	0	291.395	4.162	20	30		CIEDRN
Cc1occc1CN(C)c1ccc(C#N)c(C(F)(F)F)c1	ZINC000048913397	260657731	/nfs/dbraw/zinc/65/77/31/260657731.db2.gz	KMFMFVUHAXWCAR-UHFFFAOYSA-N	0	0	294.276	4.115	20	30		CIEDRN
CC(=O)Nc1ccc(S[C@H](C#N)C2CCCCC2)cc1	ZINC000115185702	260674652	/nfs/dbraw/zinc/67/46/52/260674652.db2.gz	LRNSWUDXYSRCGY-MRXNPFEDSA-N	0	0	288.416	4.210	20	30		CIEDRN
C=CC[C@@H](C(=O)NCCc1ccc(C)cc1)c1ccccc1	ZINC000427457911	260741065	/nfs/dbraw/zinc/74/10/65/260741065.db2.gz	WAPGURWAPDOPOA-LJQANCHMSA-N	0	0	293.410	4.014	20	30		CIEDRN
C=CCC(C)(C)c1nc(Cc2ccc(F)cc2Cl)no1	ZINC000426433482	260779301	/nfs/dbraw/zinc/77/93/01/260779301.db2.gz	PWWUICODGPVYTE-UHFFFAOYSA-N	0	0	294.757	4.307	20	30		CIEDRN
C=CCC(C)(C)c1nc(-c2ccccc2COCC)no1	ZINC000426447983	260781389	/nfs/dbraw/zinc/78/13/89/260781389.db2.gz	DIRJCWUMCVHZFZ-UHFFFAOYSA-N	0	0	286.375	4.127	20	30		CIEDRN
C[C@H](C(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1	ZINC000126812850	260786595	/nfs/dbraw/zinc/78/65/95/260786595.db2.gz	SNJHMVPOYJOAGX-AWEZNQCLSA-N	0	0	292.382	4.230	20	30		CIEDRN
C=CCCCCNC(=O)c1c[nH]cc1-c1ccc(C)s1	ZINC000427821944	260847351	/nfs/dbraw/zinc/84/73/51/260847351.db2.gz	YDJUFGHWVYJWGP-UHFFFAOYSA-N	0	0	288.416	4.138	20	30		CIEDRN
N#Cc1ccc(NCc2ccc(C3CC3)cc2)c(F)c1	ZINC000168249056	260872147	/nfs/dbraw/zinc/87/21/47/260872147.db2.gz	DODPNEJZQUATTD-UHFFFAOYSA-N	0	0	266.319	4.187	20	30		CIEDRN
C=C(C)CN(C)C(=O)Nc1ccc2ccn(CCC)c2c1	ZINC000181739306	260926903	/nfs/dbraw/zinc/92/69/03/260926903.db2.gz	FGROGGBSMGFAAH-UHFFFAOYSA-N	0	0	285.391	4.091	20	30		CIEDRN
CC(C)(C#N)c1ccccc1CSc1ccncc1	ZINC000159916315	260933999	/nfs/dbraw/zinc/93/39/99/260933999.db2.gz	KXQPKGITLRKMTL-UHFFFAOYSA-N	0	0	268.385	4.175	20	30		CIEDRN
Cc1ccccc1-c1cc(NCC(C)(C)CCC#N)n(C)n1	ZINC000153380106	261077697	/nfs/dbraw/zinc/07/76/97/261077697.db2.gz	GZUKFVRODZDGDN-UHFFFAOYSA-N	0	0	296.418	4.137	20	30		CIEDRN
N#CCC[C@@H](NC(=O)CCC1CCCC1)c1ccccc1	ZINC000153500851	261079426	/nfs/dbraw/zinc/07/94/26/261079426.db2.gz	GSHGEYKMHHZVFL-QGZVFWFLSA-N	0	0	284.403	4.118	20	30		CIEDRN
C/C=C(\C=C\C(=O)N[C@@H](CCC#N)c1ccccc1)CC	ZINC000153585092	261080968	/nfs/dbraw/zinc/08/09/68/261080968.db2.gz	NIBPBYQGIXTNPJ-CFKRKBMPSA-N	0	0	282.387	4.060	20	30		CIEDRN
C[C@@H](N[C@@H](C)c1ccc(C#N)cc1)c1cccnc1Cl	ZINC000154325886	261090338	/nfs/dbraw/zinc/09/03/38/261090338.db2.gz	CXUYRMGTVWSINU-NWDGAFQWSA-N	0	0	285.778	4.018	20	30		CIEDRN
N#Cc1ccc(CNc2ccc(-c3nccs3)cc2)s1	ZINC000156169161	261115010	/nfs/dbraw/zinc/11/50/10/261115010.db2.gz	WISXQTISMVCYKU-UHFFFAOYSA-N	0	0	297.408	4.355	20	30		CIEDRN
C=CC(C)(C)C(=O)N1CCC(=Cc2cccc(F)c2)CC1	ZINC000448728195	261119960	/nfs/dbraw/zinc/11/99/60/261119960.db2.gz	DJNUKWSBXVVYKP-UHFFFAOYSA-N	0	0	287.378	4.044	20	30		CIEDRN
CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccsc1	ZINC000157482616	261147034	/nfs/dbraw/zinc/14/70/34/261147034.db2.gz	VGJXERPHQRXNCR-UHFFFAOYSA-N	0	0	299.399	4.064	20	30		CIEDRN
C[C@H](Nc1ccc(Cl)cc1C#N)c1ccc(C#N)cc1	ZINC000052857246	261148218	/nfs/dbraw/zinc/14/82/18/261148218.db2.gz	QDAPIVVZDRLIHR-NSHDSACASA-N	0	0	281.746	4.256	20	30		CIEDRN
C[C@@H](Nc1ccc2ncsc2c1)c1ccc(C#N)cc1	ZINC000173920381	261173338	/nfs/dbraw/zinc/17/33/38/261173338.db2.gz	GXOJUVKIKJGMPP-LLVKDONJSA-N	0	0	279.368	4.341	20	30		CIEDRN
C[C@@H](Nc1ccc2c(c1)CCCO2)c1ccc(C#N)cc1	ZINC000174035374	261175798	/nfs/dbraw/zinc/17/57/98/261175798.db2.gz	GXEQSRKVXMKVIY-CYBMUJFWSA-N	0	0	278.355	4.056	20	30		CIEDRN
CCCCCN(C(=O)Nc1ccc(CC#N)cc1)C(C)C	ZINC000174715654	261194078	/nfs/dbraw/zinc/19/40/78/261194078.db2.gz	PRHYTOATECGUHN-UHFFFAOYSA-N	0	0	287.407	4.185	20	30		CIEDRN
CC[C@@H]1CCCCN1C(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000160730039	261224115	/nfs/dbraw/zinc/22/41/15/261224115.db2.gz	YXRHVRISDQJALZ-SJORKVTESA-N	0	0	299.418	4.006	20	30		CIEDRN
N#CCCCCSCc1ccc(OC(F)F)cc1	ZINC000161584676	261252481	/nfs/dbraw/zinc/25/24/81/261252481.db2.gz	VUUPTGGLHNTASD-UHFFFAOYSA-N	0	0	271.332	4.215	20	30		CIEDRN
COC(=O)c1ccc(CSCCCC(C)(C)C#N)s1	ZINC000161943555	261264419	/nfs/dbraw/zinc/26/44/19/261264419.db2.gz	UYVAAOGXXMVEDC-UHFFFAOYSA-N	0	0	297.445	4.098	20	30		CIEDRN
CCc1ccc(C(=O)N(C)c2cc(Cl)ccc2C#N)cc1	ZINC000176426241	261284948	/nfs/dbraw/zinc/28/49/48/261284948.db2.gz	AOXQCSHENSPDAD-UHFFFAOYSA-N	0	0	298.773	4.051	20	30		CIEDRN
Cc1cc(C)cc(C(=O)N(C)c2cc(Cl)ccc2C#N)c1	ZINC000176428302	261284960	/nfs/dbraw/zinc/28/49/60/261284960.db2.gz	JVZCGTQUNWDTIF-UHFFFAOYSA-N	0	0	298.773	4.105	20	30		CIEDRN
Cc1cc([C@@H](C)Nc2nc3c(cc2C#N)CCCC3)c(C)o1	ZINC000301127440	261330429	/nfs/dbraw/zinc/33/04/29/261330429.db2.gz	QWSUVBKZRYQHOO-GFCCVEGCSA-N	0	0	295.386	4.215	20	30		CIEDRN
C[C@H](Sc1cccc(C#N)c1)c1cccc([N+](=O)[O-])c1	ZINC000177109109	261332218	/nfs/dbraw/zinc/33/22/18/261332218.db2.gz	MHDHVJHPGDPNMY-NSHDSACASA-N	0	0	284.340	4.320	20	30		CIEDRN
CO[C@H](CNc1cc(Cl)ccc1C#N)c1ccccc1	ZINC000301353639	261332774	/nfs/dbraw/zinc/33/27/74/261332774.db2.gz	JSKOBLJKKYDJQS-MRXNPFEDSA-N	0	0	286.762	4.011	20	30		CIEDRN
Cc1cnn(CCCCCSc2cccc(C#N)c2)c1	ZINC000177103160	261333572	/nfs/dbraw/zinc/33/35/72/261333572.db2.gz	RJHPUIFMTWBIAU-UHFFFAOYSA-N	0	0	285.416	4.026	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(C)[C@@H](c1ccccc1)C(C)C	ZINC000466367599	261395449	/nfs/dbraw/zinc/39/54/49/261395449.db2.gz	XBKABZUXUOIAIH-IAGOWNOFSA-N	0	0	288.435	4.380	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(C)[C@H](c1ccccc1)C(C)C	ZINC000466367601	261395720	/nfs/dbraw/zinc/39/57/20/261395720.db2.gz	XBKABZUXUOIAIH-SJORKVTESA-N	0	0	288.435	4.380	20	30		CIEDRN
CC[C@H](NC(=O)Nc1cccc(C#N)c1C)c1cccs1	ZINC000178578017	261398686	/nfs/dbraw/zinc/39/86/86/261398686.db2.gz	GKLHDSUAVFXCJH-ZDUSSCGKSA-N	0	0	299.399	4.201	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N1CCC[C@@H]1c1ccc(C)s1	ZINC000466397550	261401917	/nfs/dbraw/zinc/40/19/17/261401917.db2.gz	FYWXNSZROQSYIT-ZIAGYGMSSA-N	0	0	292.448	4.258	20	30		CIEDRN
C[C@@H]1CCCN(C(=O)Nc2ccc(C(C)(C)C#N)cc2)[C@@H]1C	ZINC000179794710	261418667	/nfs/dbraw/zinc/41/86/67/261418667.db2.gz	JTYVXSACSMPHCW-ZIAGYGMSSA-N	0	0	299.418	4.140	20	30		CIEDRN
C[C@H](N(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1)C1(C)CC1	ZINC000175917300	261629809	/nfs/dbraw/zinc/62/98/09/261629809.db2.gz	JJTIWKOBVWZTGJ-ZDUSSCGKSA-N	0	0	299.418	4.140	20	30		CIEDRN
CCc1cc(NCc2ccc(C#N)c(OC)c2)ccc1C	ZINC000314566457	261762056	/nfs/dbraw/zinc/76/20/56/261762056.db2.gz	KTXFYOZZCSPZFT-UHFFFAOYSA-N	0	0	280.371	4.050	20	30		CIEDRN
C[C@H](C#N)Oc1ccccc1N[C@@H](C)CSC(C)(C)C	ZINC000180206760	261847084	/nfs/dbraw/zinc/84/70/84/261847084.db2.gz	KSXTUGCVIZASJB-QWHCGFSZSA-N	0	0	292.448	4.310	20	30		CIEDRN
Cc1ccc(N[C@H]2CCC[C@@H](C#N)C2)cc1OC(F)F	ZINC000185729784	262068789	/nfs/dbraw/zinc/06/87/89/262068789.db2.gz	SSBHVWPYLZQFKS-NEPJUHHUSA-N	0	0	280.318	4.091	20	30		CIEDRN
CC(C)c1ccc(NC(=O)N[C@H](C)CC#N)c(C(C)C)c1	ZINC000186061395	262077427	/nfs/dbraw/zinc/07/74/27/262077427.db2.gz	RKWZEYIOXFQOGJ-CYBMUJFWSA-N	0	0	287.407	4.357	20	30		CIEDRN
Cc1c2ccccc2n(C)c1CNc1ccc(F)c(C#N)c1	ZINC000318845372	262079390	/nfs/dbraw/zinc/07/93/90/262079390.db2.gz	VRIJJZKXCVNPGP-UHFFFAOYSA-N	0	0	293.345	4.110	20	30		CIEDRN
Cc1cc(COc2cc(C#N)ccc2C)c2ccccc2n1	ZINC000318956625	262136509	/nfs/dbraw/zinc/13/65/09/262136509.db2.gz	JURKJIJRVNDTRJ-UHFFFAOYSA-N	0	0	288.350	4.302	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](c1ccccn1)C1CCCC1	ZINC000364071798	262136589	/nfs/dbraw/zinc/13/65/89/262136589.db2.gz	CTZJCWWENUNWRD-WMLDXEAASA-N	0	0	286.419	4.031	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)c1cc(Cl)ccc1F	ZINC000187521534	262139043	/nfs/dbraw/zinc/13/90/43/262139043.db2.gz	XWROQGRBBZQDKG-UHFFFAOYSA-N	0	0	296.773	4.024	20	30		CIEDRN
CCCOc1ccccc1OCc1ccc(C#N)cc1F	ZINC000019804995	262160062	/nfs/dbraw/zinc/16/00/62/262160062.db2.gz	DVUOZWSMXPMQFA-UHFFFAOYSA-N	0	0	285.318	4.065	20	30		CIEDRN
CC(C)c1ccc([C@@H]2CCCCN2C(=O)[C@H](C)C#N)cc1	ZINC000497474981	262166965	/nfs/dbraw/zinc/16/69/65/262166965.db2.gz	WACGPCYHVKKFNZ-PBHICJAKSA-N	0	0	284.403	4.023	20	30		CIEDRN
C=C(C)CN(CC)C(=O)CSc1ccc(C(C)C)cc1	ZINC000497490971	262169728	/nfs/dbraw/zinc/16/97/28/262169728.db2.gz	ZAHAAEHIQJUURZ-UHFFFAOYSA-N	0	0	291.460	4.327	20	30		CIEDRN
C=CCOc1ccc(CNc2cc(F)cc(F)c2)cc1	ZINC000019230962	262174202	/nfs/dbraw/zinc/17/42/02/262174202.db2.gz	WSNOZXFWDYWYPG-UHFFFAOYSA-N	0	0	275.298	4.142	20	30		CIEDRN
CC(C)[C@H](C)C(=O)Nc1sc2c(c1C#N)CCCCC2	ZINC000497539484	262174683	/nfs/dbraw/zinc/17/46/83/262174683.db2.gz	XMKGUURXBYANRJ-NSHDSACASA-N	0	0	290.432	4.119	20	30		CIEDRN
C=CCC1(C(=O)N2C[C@@H](c3ccsc3)C[C@H]2C)CCC1	ZINC000364202698	262183529	/nfs/dbraw/zinc/18/35/29/262183529.db2.gz	USDJEPWESBNHMK-HIFRSBDPSA-N	0	0	289.444	4.199	20	30		CIEDRN
N#CCCCSCc1csc(-c2ccccc2F)n1	ZINC000190934292	262187274	/nfs/dbraw/zinc/18/72/74/262187274.db2.gz	NIVQLUQSAYZZMM-UHFFFAOYSA-N	0	0	292.404	4.486	20	30		CIEDRN
C[C@@H](Sc1ccc(C#N)cn1)c1cccc(Cl)c1	ZINC000497682693	262189457	/nfs/dbraw/zinc/18/94/57/262189457.db2.gz	AEZVDHMWCOOANK-SNVBAGLBSA-N	0	0	274.776	4.460	20	30		CIEDRN
CC(C)(C)c1cnc(CSc2ccc(C#N)cc2)o1	ZINC000497686080	262190089	/nfs/dbraw/zinc/19/00/89/262190089.db2.gz	IOGHFUADNFOLIA-UHFFFAOYSA-N	0	0	272.373	4.136	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@@H](c1cccc(C)c1)C(C)(C)C	ZINC000497807506	262212229	/nfs/dbraw/zinc/21/22/29/262212229.db2.gz	BNMHQRHTLDPSNG-INIZCTEOSA-N	0	0	288.435	4.300	20	30		CIEDRN
CC(C)n1ncc2ccc(N[C@H]3CCC[C@@H](C#N)C3)cc21	ZINC000193207049	262217845	/nfs/dbraw/zinc/21/78/45/262217845.db2.gz	MACABQRACSGRDW-HIFRSBDPSA-N	0	0	282.391	4.111	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@H](c3ccccc3)[C@H](C)C2)CCC1	ZINC000188165690	262224129	/nfs/dbraw/zinc/22/41/29/262224129.db2.gz	IXSBSVCNLWQAEY-AEFFLSMTSA-N	0	0	297.442	4.385	20	30		CIEDRN
CCCC[C@H](C)C(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1	ZINC000502994089	262235463	/nfs/dbraw/zinc/23/54/63/262235463.db2.gz	AAAKUXCUHGKIBU-SZMVWBNQSA-N	0	0	298.430	4.111	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1ccc(C(C)(F)F)cc1	ZINC000497944160	262237107	/nfs/dbraw/zinc/23/71/07/262237107.db2.gz	KXPRTPQQZSEURL-GFCCVEGCSA-N	0	0	281.346	4.273	20	30		CIEDRN
N#C[C@@H]1CCC[C@H](Nc2csc3ccccc23)C1	ZINC000463237307	262279744	/nfs/dbraw/zinc/27/97/44/262279744.db2.gz	MCWNPNVJVNVUDX-NEPJUHHUSA-N	0	0	256.374	4.396	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](C)c1ccc(F)cc1Cl	ZINC000185614369	262306404	/nfs/dbraw/zinc/30/64/04/262306404.db2.gz	KIKYRQCSSLAMRC-WDEREUQCSA-N	0	0	283.774	4.259	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(OC)c(OC(C)C)c1	ZINC000188585233	262320783	/nfs/dbraw/zinc/32/07/83/262320783.db2.gz	GGBZKXIZOBZDOQ-QGZVFWFLSA-N	0	0	291.391	4.023	20	30		CIEDRN
CC[C@H](C)[C@@H]1CCCCN1C(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000462211185	262324893	/nfs/dbraw/zinc/32/48/93/262324893.db2.gz	SALQIUUYZULRQN-MPGHIAIKSA-N	0	0	298.430	4.089	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC(CC)(CC)CC1	ZINC000188619017	262327108	/nfs/dbraw/zinc/32/71/08/262327108.db2.gz	FABNTPOYNRLUDM-CQSZACIVSA-N	0	0	251.414	4.018	20	30		CIEDRN
C=C(C)CCc1noc(/C=C(/C)c2ccc(F)cc2)n1	ZINC000508631356	262333406	/nfs/dbraw/zinc/33/34/06/262333406.db2.gz	JWGRENDVLZAILT-BENRWUELSA-N	0	0	272.323	4.278	20	30		CIEDRN
C=CCCCSCC(=O)Nc1ccc(C)c(Cl)c1	ZINC000522757318	262338488	/nfs/dbraw/zinc/33/84/88/262338488.db2.gz	ZGHGZMPUASHUKO-UHFFFAOYSA-N	0	0	283.824	4.286	20	30		CIEDRN
N#C[C@@H]1CC[C@@H](Nc2cc(Cl)cc(Cl)c2)C1	ZINC000390776570	262345514	/nfs/dbraw/zinc/34/55/14/262345514.db2.gz	FYCGPQGZWSJZDT-LDYMZIIASA-N	0	0	255.148	4.098	20	30		CIEDRN
N#Cc1ccc(N[C@H]2CCOC3(CCCC3)C2)cc1Cl	ZINC000094367257	262349550	/nfs/dbraw/zinc/34/95/50/262349550.db2.gz	CQHZEDIHHXYDMS-AWEZNQCLSA-N	0	0	290.794	4.115	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1cc(SC)ccc1C	ZINC000488573074	262377604	/nfs/dbraw/zinc/37/76/04/262377604.db2.gz	MCVZWIWYXKTUOQ-ZDUSSCGKSA-N	0	0	290.432	4.289	20	30		CIEDRN
N#Cc1ccc(NCc2ccc(C(F)(F)F)cc2)c(F)c1	ZINC000060941492	262391543	/nfs/dbraw/zinc/39/15/43/262391543.db2.gz	CYGWGTZGFOHCNU-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
N#Cc1cc([N+](=O)[O-])ccc1N[C@@H]1CCCc2sccc21	ZINC000061327740	262393979	/nfs/dbraw/zinc/39/39/79/262393979.db2.gz	HYFVZHMQNHPOGI-CQSZACIVSA-N	0	0	299.355	4.017	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)C[C@@H](C)c1ccccc1C	ZINC000488875470	262404232	/nfs/dbraw/zinc/40/42/32/262404232.db2.gz	DYAAJBBULUQJCP-HZPDHXFCSA-N	0	0	271.404	4.056	20	30		CIEDRN
CC1(C)CCC(CC(=O)N(CC#N)c2ccccc2)CC1	ZINC000337726425	262468906	/nfs/dbraw/zinc/46/89/06/262468906.db2.gz	AMBGNBIXJVFUHG-UHFFFAOYSA-N	0	0	284.403	4.150	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)[C@@]1(C)CC=CCC1	ZINC000410828050	262666540	/nfs/dbraw/zinc/66/65/40/262666540.db2.gz	VZWSKDFSODEZER-SFHVURJKSA-N	0	0	269.388	4.490	20	30		CIEDRN
CC(C)(C)[C@@H](C#N)NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000410873566	262670472	/nfs/dbraw/zinc/67/04/72/262670472.db2.gz	DFNOXWMYULFMPB-BRWVUGGUSA-N	0	0	298.430	4.015	20	30		CIEDRN
CC[C@@H]1CCC[C@@H]1C(=O)Nc1ccc(Cl)cc1CC#N	ZINC000410968683	262674151	/nfs/dbraw/zinc/67/41/51/262674151.db2.gz	OAIRBLLEULWVSY-RISCZKNCSA-N	0	0	290.794	4.171	20	30		CIEDRN
C[C@H]1c2c(C#N)c(NC(=O)C3CCC3)sc2CC[C@@H]1C	ZINC000410983089	262674634	/nfs/dbraw/zinc/67/46/34/262674634.db2.gz	IYCBAQPVSQXBDV-VHSXEESVSA-N	0	0	288.416	4.044	20	30		CIEDRN
CC(C)(C)CC(=O)Nc1sc(C(C)(C)C)cc1C#N	ZINC000411007421	262675181	/nfs/dbraw/zinc/67/51/81/262675181.db2.gz	NLNNOOKXIPKMAO-UHFFFAOYSA-N	0	0	278.421	4.292	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1sc(C(C)(C)C)cc1C#N	ZINC000411008151	262675298	/nfs/dbraw/zinc/67/52/98/262675298.db2.gz	RVZWBZGYKGYNEA-LLVKDONJSA-N	0	0	290.432	4.458	20	30		CIEDRN
CCCc1nc(C)c(CSc2ccc(C#N)cc2F)o1	ZINC000450843199	262689705	/nfs/dbraw/zinc/68/97/05/262689705.db2.gz	DNCOYXURATUTFO-UHFFFAOYSA-N	0	0	290.363	4.239	20	30		CIEDRN
C=CCC[C@@H](NC(=O)[C@@H](C)CC(F)F)c1ccccc1	ZINC000412195941	262724157	/nfs/dbraw/zinc/72/41/57/262724157.db2.gz	JYCUQLIQPIPQFZ-GXTWGEPZSA-N	0	0	281.346	4.101	20	30		CIEDRN
C[C@H](CCC#N)Sc1nc(-c2ccc(F)cc2)c[nH]1	ZINC000412988822	262750408	/nfs/dbraw/zinc/75/04/08/262750408.db2.gz	MEEWFWTVQRJSMK-SNVBAGLBSA-N	0	0	275.352	4.000	20	30		CIEDRN
CN(CCC1CCCCC1)C(=O)Nc1ccc(CC#N)cc1	ZINC000263682765	262851843	/nfs/dbraw/zinc/85/18/43/262851843.db2.gz	JSAFATBMZNQZQJ-UHFFFAOYSA-N	0	0	299.418	4.187	20	30		CIEDRN
CCCCCCCC(=O)N(C)[C@H](CC)c1ccncc1	ZINC000265630889	262910159	/nfs/dbraw/zinc/91/01/59/262910159.db2.gz	QHJAPJRYRUSOCH-MRXNPFEDSA-N	0	0	276.424	4.352	20	30		CIEDRN
C[C@H]1CC/C(=C\C(=O)Nc2cccc(OCCCC#N)c2)C1	ZINC000267850577	262942414	/nfs/dbraw/zinc/94/24/14/262942414.db2.gz	LCNSHGVKQMSXAH-YEQVNJDRSA-N	0	0	298.386	4.054	20	30		CIEDRN
CN(C(=O)Nc1ccc(C#N)cc1Cl)C1CCCCC1	ZINC000269116079	262965993	/nfs/dbraw/zinc/96/59/93/262965993.db2.gz	IRNVTLASWSVZFT-UHFFFAOYSA-N	0	0	291.782	4.008	20	30		CIEDRN
CC1(C#N)CCN(c2ccnc3cc(Cl)ccc32)CC1	ZINC000272432198	263004275	/nfs/dbraw/zinc/00/42/75/263004275.db2.gz	GUDJCIHBDDDKFN-UHFFFAOYSA-N	0	0	285.778	4.018	20	30		CIEDRN
Cc1cccc(C)c1CNc1ccccc1O[C@@H](C)C#N	ZINC000272428366	263004293	/nfs/dbraw/zinc/00/42/93/263004293.db2.gz	JBYLGOHVXCHXRZ-HNNXBMFYSA-N	0	0	280.371	4.206	20	30		CIEDRN
Cc1c(Cl)ccc2ccc(N3CCC(C)(C#N)CC3)nc12	ZINC000272445954	263004573	/nfs/dbraw/zinc/00/45/73/263004573.db2.gz	JDJCRFTZMZLAOX-UHFFFAOYSA-N	0	0	299.805	4.327	20	30		CIEDRN
CCC(CC)c1noc(/C=C/c2ccc(OCC#N)cc2)n1	ZINC000273873292	263020152	/nfs/dbraw/zinc/02/01/52/263020152.db2.gz	NSHGRMUKSDEOAC-JXMROGBWSA-N	0	0	297.358	4.046	20	30		CIEDRN
CC(C)(C)[C@@](C)(C#N)NC(=O)c1ccc(-c2ccccc2)o1	ZINC000274312407	263022914	/nfs/dbraw/zinc/02/29/14/263022914.db2.gz	IPQNGLJTUFESAI-GOSISDBHSA-N	0	0	296.370	4.005	20	30		CIEDRN
CCCN(C(=O)CC#N)[C@@H](C)c1ccc(Cl)c(Cl)c1	ZINC000274711395	263029510	/nfs/dbraw/zinc/02/95/10/263029510.db2.gz	LLXKIPNFCSQCOQ-JTQLQIEISA-N	0	0	299.201	4.207	20	30		CIEDRN
Fc1cccc(F)c1-c1csc(CON=C2CCC2)n1	ZINC000274807372	263030431	/nfs/dbraw/zinc/03/04/31/263030431.db2.gz	QBRBURUJXHGMTA-UHFFFAOYSA-N	0	0	294.326	4.145	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)c1scc(C)c1Cl	ZINC000276783521	263038182	/nfs/dbraw/zinc/03/81/82/263038182.db2.gz	RJMQKIADBAWBBX-UHFFFAOYSA-N	0	0	298.839	4.302	20	30		CIEDRN
CCCCCCC[C@H](CC(=O)[O-])[NH2+]Cc1ccsc1	ZINC000277157483	263040003	/nfs/dbraw/zinc/04/00/03/263040003.db2.gz	DCEJHSOIKSJUDE-CQSZACIVSA-N	0	0	283.437	4.042	20	30		CIEDRN
CCCCCCC[C@@H](CC(=O)[O-])[NH2+]Cc1ccc(F)cc1	ZINC000277482071	263041455	/nfs/dbraw/zinc/04/14/55/263041455.db2.gz	WQTOYLFUYQATCQ-INIZCTEOSA-N	0	0	295.398	4.119	20	30		CIEDRN
CC(C)(C#N)CCCCSCc1ccc(CO)cc1	ZINC000278020021	263045205	/nfs/dbraw/zinc/04/52/05/263045205.db2.gz	WATVGMSAYOGKDN-UHFFFAOYSA-N	0	0	277.433	4.132	20	30		CIEDRN
Cn1c2ccc(Cl)cc2nc1S[C@H]1CC[C@@H](C#N)C1	ZINC000278658137	263049494	/nfs/dbraw/zinc/04/94/94/263049494.db2.gz	WUUKSIKIQCHUKQ-KOLCDFICSA-N	0	0	291.807	4.011	20	30		CIEDRN
C[C@H](NC(=O)CC(C)(C)C#N)c1cc(Cl)ccc1Cl	ZINC000278752632	263050624	/nfs/dbraw/zinc/05/06/24/263050624.db2.gz	JNZFUODLIGHQIA-VIFPVBQESA-N	0	0	299.201	4.110	20	30		CIEDRN
CCC[C@](C)(CC)C(=O)Nc1ccccc1O[C@@H](C)C#N	ZINC000280448331	263061712	/nfs/dbraw/zinc/06/17/12/263061712.db2.gz	VXZTVRDWGZUPSI-GUYCJALGSA-N	0	0	288.391	4.132	20	30		CIEDRN
C=CCOc1ccc(CNc2ccc3c(c2)CCCN3)cc1	ZINC000414847283	263063816	/nfs/dbraw/zinc/06/38/16/263063816.db2.gz	IPMICQWHWZYBFM-UHFFFAOYSA-N	0	0	294.398	4.222	20	30		CIEDRN
Cc1ccc(C(=O)/C=C/c2ncc(C(C)(C)C)s2)o1	ZINC000280692186	263063922	/nfs/dbraw/zinc/06/39/22/263063922.db2.gz	RJEGMSJYXKITJF-SOFGYWHQSA-N	0	0	275.373	4.238	20	30		CIEDRN
N#CC1(CCCNc2cccc3c2CCCC3)CCOCC1	ZINC000280913894	263065085	/nfs/dbraw/zinc/06/50/85/263065085.db2.gz	CPXKKHRWGNMTKW-UHFFFAOYSA-N	0	0	298.430	4.078	20	30		CIEDRN
N#CC1(CCCNc2ccc(C3CCC3)cc2)CCOCC1	ZINC000280968615	263065514	/nfs/dbraw/zinc/06/55/14/263065514.db2.gz	HPXHYWUJDFMFKW-UHFFFAOYSA-N	0	0	298.430	4.467	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)c2cc(C)oc2C)c1	ZINC000340086446	263067586	/nfs/dbraw/zinc/06/75/86/263067586.db2.gz	XEAROSDRBDUVHJ-UHFFFAOYSA-N	0	0	285.343	4.104	20	30		CIEDRN
Cc1cccc(Cl)c1OCCCC1(C#N)CCOCC1	ZINC000281308522	263068041	/nfs/dbraw/zinc/06/80/41/263068041.db2.gz	KJXRIEJWGKWBEO-UHFFFAOYSA-N	0	0	293.794	4.128	20	30		CIEDRN
Cc1cc(C)c(NC(=O)NCC2CCC(C#N)CC2)c(C)c1	ZINC000281820007	263072038	/nfs/dbraw/zinc/07/20/38/263072038.db2.gz	LPSKLLOMVQWMLG-UHFFFAOYSA-N	0	0	299.418	4.063	20	30		CIEDRN
C[C@H]1CCN(CCCC2(C#N)CCOCC2)c2ccccc21	ZINC000282140615	263074695	/nfs/dbraw/zinc/07/46/95/263074695.db2.gz	ZKQRQMWPJZELEL-INIZCTEOSA-N	0	0	298.430	4.101	20	30		CIEDRN
N#CCCCOc1cccc(N[C@H]2CCC23CCC3)c1	ZINC000282874346	263079294	/nfs/dbraw/zinc/07/92/94/263079294.db2.gz	VJHIAXFBXQOAPR-INIZCTEOSA-N	0	0	270.376	4.114	20	30		CIEDRN
C[C@@H](CC#N)Sc1ccccc1NCCCCF	ZINC000285244018	263091552	/nfs/dbraw/zinc/09/15/52/263091552.db2.gz	RHGXPDSLSVUBAV-LBPRGKRZSA-N	0	0	266.385	4.242	20	30		CIEDRN
CC(C)c1[nH]ccc1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000285478108	263093083	/nfs/dbraw/zinc/09/30/83/263093083.db2.gz	OFLKBILGNGVGBK-UHFFFAOYSA-N	0	0	295.386	4.192	20	30		CIEDRN
C[C@H](CC#N)Sc1ccccc1NCCC(C)(C)C#N	ZINC000288631090	263105374	/nfs/dbraw/zinc/10/53/74/263105374.db2.gz	BAFYFBZOODWEBK-CYBMUJFWSA-N	0	0	287.432	4.433	20	30		CIEDRN
CCCC(=O)Nc1cccc(NCCC(C)(C)C#N)c1C	ZINC000288743921	263105842	/nfs/dbraw/zinc/10/58/42/263105842.db2.gz	PNHXESJZXAKGHT-UHFFFAOYSA-N	0	0	287.407	4.085	20	30		CIEDRN
CCCOc1ccc(Cl)cc1NC(=O)[C@@](C)(C#N)CC	ZINC000288999613	263106958	/nfs/dbraw/zinc/10/69/58/263106958.db2.gz	ZDQLBBQFUJFVON-OAHLLOKOSA-N	0	0	294.782	4.007	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2ccnc(C(F)(F)F)c2)no1	ZINC000289093192	263107441	/nfs/dbraw/zinc/10/74/41/263107441.db2.gz	LMFOFAGVTAHCBY-VIFPVBQESA-N	0	0	297.280	4.220	20	30		CIEDRN
Cc1cccc([C@@H](c2noc(CC(C)(C)C#N)n2)C(C)C)c1	ZINC000289069829	263107456	/nfs/dbraw/zinc/10/74/56/263107456.db2.gz	ITYXOBWNIKUTAT-INIZCTEOSA-N	0	0	297.402	4.258	20	30		CIEDRN
CCSc1ccc(Cl)cc1NC(=O)[C@](C)(C#N)CC	ZINC000289315711	263109002	/nfs/dbraw/zinc/10/90/02/263109002.db2.gz	AZFKSPFDWCTWPU-AWEZNQCLSA-N	0	0	296.823	4.330	20	30		CIEDRN
C=CCCCCNC(=O)C[C@@H](CC)c1ccc(OC)cc1	ZINC000471670341	263109896	/nfs/dbraw/zinc/10/98/96/263109896.db2.gz	FTSVEJGOSFNOKN-OAHLLOKOSA-N	0	0	289.419	4.051	20	30		CIEDRN
Cc1nn(C(C)C)cc1/C=C1\C(=O)c2ccccc2[C@@H]1C	ZINC000290002306	263113937	/nfs/dbraw/zinc/11/39/37/263113937.db2.gz	VFZNOWLNWOUTMF-CHROMADKSA-N	0	0	280.371	4.156	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)c1cc(C(C)C)oc1C	ZINC000290049501	263114305	/nfs/dbraw/zinc/11/43/05/263114305.db2.gz	VCUSEYLRKRJCND-UHFFFAOYSA-N	0	0	290.407	4.256	20	30		CIEDRN
N#CCCCC(=O)Oc1c(Cl)cc(Cl)cc1Cl	ZINC000291135722	263120502	/nfs/dbraw/zinc/12/05/02/263120502.db2.gz	XATXUTTXKILJNK-UHFFFAOYSA-N	0	0	292.549	4.246	20	30		CIEDRN
Cc1ccc(N(Cc2cccs2)C(=O)CCCC#N)cc1	ZINC000291351425	263121495	/nfs/dbraw/zinc/12/14/95/263121495.db2.gz	XXFXWAVPNZMGNI-UHFFFAOYSA-N	0	0	298.411	4.284	20	30		CIEDRN
CC(C)(C)[C@@H](C#N)NC(=O)c1sccc1-c1ccccc1	ZINC000291508403	263123748	/nfs/dbraw/zinc/12/37/48/263123748.db2.gz	WEWMSQNSXNYJQO-CQSZACIVSA-N	0	0	298.411	4.083	20	30		CIEDRN
C=CCN(CCC#N)Cc1csc(-c2ccc(C)cc2)n1	ZINC000292248563	263129947	/nfs/dbraw/zinc/12/99/47/263129947.db2.gz	QSAXDMHUCDCLHZ-UHFFFAOYSA-N	0	0	297.427	4.020	20	30		CIEDRN
CC(C)c1nc2ccc(NC(=O)CCCC#N)cc2s1	ZINC000292304006	263130712	/nfs/dbraw/zinc/13/07/12/263130712.db2.gz	LHUYBPVOJJHWSB-UHFFFAOYSA-N	0	0	287.388	4.052	20	30		CIEDRN
C=C(C)CCNC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl	ZINC000452725304	263137743	/nfs/dbraw/zinc/13/77/43/263137743.db2.gz	SIFVHYHBAGLKKS-OLZOCXBDSA-N	0	0	298.213	4.179	20	30		CIEDRN
CCN(CCC#N)Cc1ccc([C@@H](C)C(F)(F)F)cc1	ZINC000294958245	263169872	/nfs/dbraw/zinc/16/98/72/263169872.db2.gz	KUHRRIBNMPWZRW-GFCCVEGCSA-N	0	0	284.325	4.088	20	30		CIEDRN
Cc1ccc2sc(C(=O)N[C@H]3CC[C@@H](CC#N)C3)cc2c1	ZINC000295627655	263180478	/nfs/dbraw/zinc/18/04/78/263180478.db2.gz	WSIWGDQTDNCTNR-JSGCOSHPSA-N	0	0	298.411	4.022	20	30		CIEDRN
Cc1ccc(Cl)c(NC(=O)[C@@]2(C#N)CC23CCCC3)c1	ZINC000295617498	263180506	/nfs/dbraw/zinc/18/05/06/263180506.db2.gz	ZJHKLHHMWKOALK-INIZCTEOSA-N	0	0	288.778	4.061	20	30		CIEDRN
N#CCC[C@@H](C#N)COc1ccc(C2CC2)cc1Cl	ZINC000295879480	263183297	/nfs/dbraw/zinc/18/32/97/263183297.db2.gz	FTHILKHOOFFRQH-NSHDSACASA-N	0	0	274.751	4.040	20	30		CIEDRN
CCCCCCCC(=O)Oc1ccc(-c2nnco2)cc1	ZINC000298178723	263215998	/nfs/dbraw/zinc/21/59/98/263215998.db2.gz	AGWFHKXCWKXHLP-UHFFFAOYSA-N	0	0	288.347	4.003	20	30		CIEDRN
C=C[C@](C)(CCOC)C(=O)Nc1cccc2ccccc21	ZINC000187745734	263268020	/nfs/dbraw/zinc/26/80/20/263268020.db2.gz	MSIUCCDIWZCSQG-GOSISDBHSA-N	0	0	283.371	4.007	20	30		CIEDRN
Cc1cc(N[C@H](CCC#N)c2ccccc2)nc(C(C)C)n1	ZINC000164307986	263276614	/nfs/dbraw/zinc/27/66/14/263276614.db2.gz	JZTKABSDMTXZMH-MRXNPFEDSA-N	0	0	294.402	4.365	20	30		CIEDRN
N#CCC[C@@H](Nc1ccc(F)cc1C#N)c1ccccc1	ZINC000164310589	263278007	/nfs/dbraw/zinc/27/80/07/263278007.db2.gz	OPKMNFXWMVCNQQ-MRXNPFEDSA-N	0	0	279.318	4.154	20	30		CIEDRN
C#CCCCCC(=O)Nc1ccc(C)c(-c2nc(C)co2)c1	ZINC000120017162	263281161	/nfs/dbraw/zinc/28/11/61/263281161.db2.gz	NBTODBSFXBEIQZ-UHFFFAOYSA-N	0	0	296.370	4.091	20	30		CIEDRN
N#CCC[C@@H](Nc1cccc(F)c1[N+](=O)[O-])c1ccccc1	ZINC000164338479	263285413	/nfs/dbraw/zinc/28/54/13/263285413.db2.gz	FPIFUWNINIIIJC-CQSZACIVSA-N	0	0	299.305	4.191	20	30		CIEDRN
N#CCC[C@H](Nc1cccc(F)c1C#N)c1ccccc1	ZINC000164345224	263286990	/nfs/dbraw/zinc/28/69/90/263286990.db2.gz	DBESRXBFDXHKCO-INIZCTEOSA-N	0	0	279.318	4.154	20	30		CIEDRN
N#CCC[C@@H](Nc1ccc(Cl)c(C#N)n1)c1ccccc1	ZINC000164353561	263288940	/nfs/dbraw/zinc/28/89/40/263288940.db2.gz	MYUPGBWBKVCQTK-CQSZACIVSA-N	0	0	296.761	4.064	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@@H]1c1ccc(OC)cc1	ZINC000121562295	263296993	/nfs/dbraw/zinc/29/69/93/263296993.db2.gz	RPJZBARFNNAKNT-GOSISDBHSA-N	0	0	299.414	4.127	20	30		CIEDRN
C=CCCC(=O)N(C)c1ccc(OCc2ccccc2)cc1	ZINC000187915181	263299903	/nfs/dbraw/zinc/29/99/03/263299903.db2.gz	NXQDJMFSOWZXHC-UHFFFAOYSA-N	0	0	295.382	4.195	20	30		CIEDRN
C#CCCCCC(=O)N(Cc1ccccc1)C(C)(C)C	ZINC000122198953	263300716	/nfs/dbraw/zinc/30/07/16/263300716.db2.gz	KQNPWLRQVBJLDM-UHFFFAOYSA-N	0	0	271.404	4.007	20	30		CIEDRN
CC(C)(C)CN(CCC#N)Cc1ccc(Cl)s1	ZINC000171939611	335085820	/nfs/dbraw/zinc/08/58/20/335085820.db2.gz	ZPDFWHAYOKCINX-UHFFFAOYSA-N	0	0	270.829	4.163	20	30		CIEDRN
C=CCC[C@@H](NC(=O)[C@@H]1CCCCS1)c1ccccc1	ZINC000341230685	263328396	/nfs/dbraw/zinc/32/83/96/263328396.db2.gz	TXPSMNPKDBXCMZ-CVEARBPZSA-N	0	0	289.444	4.096	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N[C@H](CC)c1cc(F)ccc1F	ZINC000341455134	263336567	/nfs/dbraw/zinc/33/65/67/263336567.db2.gz	DKEMPKLHHGUAMZ-IUODEOHRSA-N	0	0	296.361	4.070	20	30		CIEDRN
N#CCCCCNc1c(Cl)cc(Cl)cc1[N+](=O)[O-]	ZINC000341989374	263381169	/nfs/dbraw/zinc/38/11/69/263381169.db2.gz	WEFWSRQQPWFUOI-UHFFFAOYSA-N	0	0	288.134	4.007	20	30		CIEDRN
Cc1cc(C#N)cc(C)c1OCc1nc(C2CC2)cs1	ZINC000342513587	263445091	/nfs/dbraw/zinc/44/50/91/263445091.db2.gz	RINBLEWSGOBWRR-UHFFFAOYSA-N	0	0	284.384	4.088	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1c(OC)cccc1SC	ZINC000416119921	263675673	/nfs/dbraw/zinc/67/56/73/263675673.db2.gz	GBYLOISPALXYJN-UHFFFAOYSA-N	0	0	291.416	4.124	20	30		CIEDRN
C=CCC[C@H](NC(=O)[C@H](C)C(C)(F)F)c1ccccc1	ZINC000343213783	263744720	/nfs/dbraw/zinc/74/47/20/263744720.db2.gz	XXWCCDWFSZLEDX-JSGCOSHPSA-N	0	0	281.346	4.101	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NCc1nc(C#N)cs1	ZINC000417036483	263777994	/nfs/dbraw/zinc/77/79/94/263777994.db2.gz	UNHYTCIRGYXEQK-UHFFFAOYSA-N	0	0	297.427	4.479	20	30		CIEDRN
Cc1c(F)c(F)ccc1NCCCC(C)(C)C#N	ZINC000417065925	263779773	/nfs/dbraw/zinc/77/97/73/263779773.db2.gz	BRMTZFRTOYUNIY-UHFFFAOYSA-N	0	0	252.308	4.015	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2ccc(C)cc2SC)CC1	ZINC000417234461	263790443	/nfs/dbraw/zinc/79/04/43/263790443.db2.gz	PUXHQRKWXLQGDQ-UHFFFAOYSA-N	0	0	290.432	4.147	20	30		CIEDRN
C=C(C)CN(C)C(=O)Nc1ccc(Cl)c(SC)c1	ZINC000417284444	263793292	/nfs/dbraw/zinc/79/32/92/263793292.db2.gz	ZWSTZKFMVLZABS-UHFFFAOYSA-N	0	0	284.812	4.102	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1oc2ccc(F)cc2c1C	ZINC000343246890	263867249	/nfs/dbraw/zinc/86/72/49/263867249.db2.gz	IXBGMDYEESWKTG-NSHDSACASA-N	0	0	289.350	4.355	20	30		CIEDRN
O=C(NC1(c2ccccc2)CCCC1)c1ncoc1C1CC1	ZINC000328893288	263889585	/nfs/dbraw/zinc/88/95/85/263889585.db2.gz	UXPANDSSNHTQJB-UHFFFAOYSA-N	0	0	296.370	4.326	20	30		CIEDRN
CC(C)(CNC(=O)c1ncoc1C1CC1)C1CCCCC1	ZINC000328936232	263893687	/nfs/dbraw/zinc/89/36/87/263893687.db2.gz	JLTQOTVMQDSLSF-UHFFFAOYSA-N	0	0	290.407	4.463	20	30		CIEDRN
C[C@@H](NC(=O)Nc1scnc1C1CC1)C1CCCCC1	ZINC000328906835	263899047	/nfs/dbraw/zinc/89/90/47/263899047.db2.gz	BRMGMHJXTVYCLB-SNVBAGLBSA-N	0	0	293.436	4.315	20	30		CIEDRN
CC[C@@H]1CCCC[C@@H]1NC(=O)Nc1scnc1C1CC1	ZINC000328910507	263899668	/nfs/dbraw/zinc/89/96/68/263899668.db2.gz	FQUFEAJVQURZAH-PWSUYJOCSA-N	0	0	293.436	4.315	20	30		CIEDRN
Cc1ccc(C(=O)Nc2ccc(C(C)(C)C)cc2O)c(C)n1	ZINC000330409127	263930945	/nfs/dbraw/zinc/93/09/45/263930945.db2.gz	SHFTZGLENXTXHR-UHFFFAOYSA-N	0	0	298.386	4.338	20	30		CIEDRN
Cc1cnc([C@@H](C)NC(=O)c2cc(C)n(C(C)C)c2C)o1	ZINC000330704890	264018541	/nfs/dbraw/zinc/01/85/41/264018541.db2.gz	KFSAOAXKHZUKNH-GFCCVEGCSA-N	0	0	289.379	4.048	20	30		CIEDRN
Cc1cnc([C@H](C)NC(=O)c2sccc2C(C)C)o1	ZINC000330703723	264018586	/nfs/dbraw/zinc/01/85/86/264018586.db2.gz	JHNLMBDNBDKFLG-JTQLQIEISA-N	0	0	278.377	4.234	20	30		CIEDRN
Cc1cnc([C@H](C)NC(=O)c2cc(C)n(C(C)C)c2C)o1	ZINC000330704896	264018852	/nfs/dbraw/zinc/01/88/52/264018852.db2.gz	KFSAOAXKHZUKNH-LBPRGKRZSA-N	0	0	289.379	4.048	20	30		CIEDRN
CC(C)C[C@@](C)(C#N)NC(=O)c1cc(Cl)ccc1F	ZINC000330752111	264028831	/nfs/dbraw/zinc/02/88/31/264028831.db2.gz	CGIZYBRBIPZYQZ-AWEZNQCLSA-N	0	0	282.746	4.112	20	30		CIEDRN
CC(C)(C)c1ccc(NC(=O)N[C@@H]2CCC[C@@H]2C#N)cc1	ZINC000330777376	264035010	/nfs/dbraw/zinc/03/50/10/264035010.db2.gz	UMXGNBOHFWTYMT-IUODEOHRSA-N	0	0	285.391	4.002	20	30		CIEDRN
CCc1noc(C)c1C(=O)NCCCC1CCCCC1	ZINC000330782182	264052823	/nfs/dbraw/zinc/05/28/23/264052823.db2.gz	GSNYKMLJHJUMGX-UHFFFAOYSA-N	0	0	278.396	4.211	20	30		CIEDRN
CC(C)(C)CCC(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000330852732	264068694	/nfs/dbraw/zinc/06/86/94/264068694.db2.gz	MHUHNXPXNIPUJK-UHFFFAOYSA-N	0	0	272.392	4.253	20	30		CIEDRN
CCO[C@@H](C)c1ncc(C(=O)NC2(C)CCCCC2)s1	ZINC000330907195	264074807	/nfs/dbraw/zinc/07/48/07/264074807.db2.gz	FDQPQOKFNHWNKN-NSHDSACASA-N	0	0	296.436	4.268	20	30		CIEDRN
CC(C)(C)CC(C)(C)NC(=O)c1c[nH]c2cccnc12	ZINC000330945610	264084992	/nfs/dbraw/zinc/08/49/92/264084992.db2.gz	HBFFBUZYIOHFSB-UHFFFAOYSA-N	0	0	273.380	4.082	20	30		CIEDRN
COC(=O)c1cc(NC(=O)C2=CCCCC2)c(C)cc1C	ZINC000330955060	264087217	/nfs/dbraw/zinc/08/72/17/264087217.db2.gz	BAFQDCBLENUDTA-UHFFFAOYSA-N	0	0	287.359	4.178	20	30		CIEDRN
CCO[C@H](C)c1ncc(C(=O)NCC2(C)CCCC2)s1	ZINC000330922213	264093812	/nfs/dbraw/zinc/09/38/12/264093812.db2.gz	RLKYROWRXFRWHB-LLVKDONJSA-N	0	0	296.436	4.126	20	30		CIEDRN
CCO[C@@H](C)c1ncc(C(=O)NCC2(C)CCCC2)s1	ZINC000330922215	264094142	/nfs/dbraw/zinc/09/41/42/264094142.db2.gz	RLKYROWRXFRWHB-NSHDSACASA-N	0	0	296.436	4.126	20	30		CIEDRN
Cc1nc([C@@H](C)NC(=O)NC(C)(C)CC(C)(C)C)cs1	ZINC000330975044	264101022	/nfs/dbraw/zinc/10/10/22/264101022.db2.gz	JIYLKBROGUYGSA-SNVBAGLBSA-N	0	0	297.468	4.231	20	30		CIEDRN
CCc1noc(C)c1C(=O)NCC(C)(C)C1=CCCCC1	ZINC000331058455	264109379	/nfs/dbraw/zinc/10/93/79/264109379.db2.gz	MIUZDJCYLSTATD-UHFFFAOYSA-N	0	0	290.407	4.377	20	30		CIEDRN
C[C@@H]1CC[C@H](NC(=O)C[C@H](CC#N)c2ccccc2)[C@@H](C)C1	ZINC000331066856	264112283	/nfs/dbraw/zinc/11/22/83/264112283.db2.gz	QICKXHQZORYKBQ-FZCLSBEQSA-N	0	0	298.430	4.015	20	30		CIEDRN
CO[C@@H](C)c1nc(C)c(C(=O)NCC2CCCCC2)s1	ZINC000331094369	264120779	/nfs/dbraw/zinc/12/07/79/264120779.db2.gz	AGTDYIJNKPXBBR-NSHDSACASA-N	0	0	296.436	4.044	20	30		CIEDRN
Cc1csc(C(=O)N[C@](C)(C#N)CC(C)C)c1Cl	ZINC000331091904	264133968	/nfs/dbraw/zinc/13/39/68/264133968.db2.gz	XEGSOHORECQSNX-ZDUSSCGKSA-N	0	0	284.812	4.343	20	30		CIEDRN
Cc1nc(C(=O)N[C@@H](C)c2ccc(C(C)C)cc2)c(C)o1	ZINC000331162485	264143427	/nfs/dbraw/zinc/14/34/27/264143427.db2.gz	GKRGVMIBXSROIH-NSHDSACASA-N	0	0	286.375	4.481	20	30		CIEDRN
Cc1cc(C)c(NC(=O)N[C@H](C)c2ccccc2C)c(C)n1	ZINC000331240256	264176381	/nfs/dbraw/zinc/17/63/81/264176381.db2.gz	PDHOTXXGEDKJQF-CQSZACIVSA-N	0	0	297.402	4.402	20	30		CIEDRN
Cc1cc(NC(=O)c2ccc(C(C)C)cn2)c(C)c(C)c1O	ZINC000331246426	264179182	/nfs/dbraw/zinc/17/91/82/264179182.db2.gz	VEYPXAXQKUHGJW-UHFFFAOYSA-N	0	0	298.386	4.472	20	30		CIEDRN
CC(C)(C)CC(C)(C)NC(=O)c1cnc2[nH]ccc2c1	ZINC000331314984	264187812	/nfs/dbraw/zinc/18/78/12/264187812.db2.gz	ILDBFMCWWBNDIK-UHFFFAOYSA-N	0	0	273.380	4.034	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC)[C@@H](C)c1ccc(C#N)cc1	ZINC000126173999	264211258	/nfs/dbraw/zinc/21/12/58/264211258.db2.gz	WIADIGBJCHPHIF-HNNXBMFYSA-N	0	0	296.414	4.236	20	30		CIEDRN
CCCc1csc(CN(C)[C@H](C)c2cccc(C#N)c2)n1	ZINC000425366161	264211989	/nfs/dbraw/zinc/21/19/89/264211989.db2.gz	OJTFEZXVUVIAEF-CYBMUJFWSA-N	0	0	299.443	4.160	20	30		CIEDRN
C=CCC1(CNC(=O)[C@@H]2CCCC(F)(F)C2)CCCC1	ZINC000456505653	264225873	/nfs/dbraw/zinc/22/58/73/264225873.db2.gz	LYVRMPLKDPGEQV-CYBMUJFWSA-N	0	0	285.378	4.065	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N1CC2(CCCC2)[C@@H]1C(C)C	ZINC000424867114	264240158	/nfs/dbraw/zinc/24/01/58/264240158.db2.gz	PZJAHGQJTQCMEX-AWEZNQCLSA-N	0	0	263.425	4.016	20	30		CIEDRN
Cc1ccc(C2CC2)c(C(=O)Nc2cc(C)cc(C#N)c2)c1	ZINC000424865182	264240355	/nfs/dbraw/zinc/24/03/55/264240355.db2.gz	MGAYOLHYVHVVIB-UHFFFAOYSA-N	0	0	290.366	4.305	20	30		CIEDRN
Cc1sc(NC(=O)[C@H]2CCCC[C@H]2C)c(C#N)c1C	ZINC000425404551	264283228	/nfs/dbraw/zinc/28/32/28/264283228.db2.gz	WTHJSXQYQXLFOT-SKDRFNHKSA-N	0	0	276.405	4.001	20	30		CIEDRN
C=CCN(C)C(=O)Nc1cc(Cl)ccc1SCC	ZINC000157341026	264322338	/nfs/dbraw/zinc/32/23/38/264322338.db2.gz	VVCKPPPNBDAFGV-UHFFFAOYSA-N	0	0	284.812	4.102	20	30		CIEDRN
C[C@H](Sc1nncc2ccccc21)c1cccc(C#N)c1	ZINC000189831339	264328951	/nfs/dbraw/zinc/32/89/51/264328951.db2.gz	LTYPJEGIECNRAO-LBPRGKRZSA-N	0	0	291.379	4.355	20	30		CIEDRN
CC(C)(CCC#N)CNc1ccc(Br)cc1	ZINC000157368885	264333479	/nfs/dbraw/zinc/33/34/79/264333479.db2.gz	LSADOVYPPNYDQJ-UHFFFAOYSA-N	0	0	281.197	4.191	20	30		CIEDRN
CSc1ccccc1NCc1ccc(C#N)c(F)c1	ZINC000190321222	264357395	/nfs/dbraw/zinc/35/73/95/264357395.db2.gz	MHYBOJLDOXXBSO-UHFFFAOYSA-N	0	0	272.348	4.031	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc2[nH]c(C)cc2c1	ZINC000190340550	264358130	/nfs/dbraw/zinc/35/81/30/264358130.db2.gz	GQDRGRUYKIQQIF-INIZCTEOSA-N	0	0	256.349	4.017	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N1CCC[C@@H]1CC(C)(C)C	ZINC000130647600	264361725	/nfs/dbraw/zinc/36/17/25/264361725.db2.gz	ZPOOKXHHLALNGN-OAHLLOKOSA-N	0	0	299.418	4.299	20	30		CIEDRN
C=C[C@H](CC(=O)N(C)[C@H](C)c1ccco1)c1ccccc1	ZINC000131361673	264369882	/nfs/dbraw/zinc/36/98/82/264369882.db2.gz	ZARBSVULEUCTPU-HUUCEWRRSA-N	0	0	283.371	4.159	20	30		CIEDRN
C=CCC[C@@H](NCc1noc(C(C)(C)C)n1)c1ccccc1	ZINC000180047848	264394519	/nfs/dbraw/zinc/39/45/19/264394519.db2.gz	KDTNHPQKEBVWKM-OAHLLOKOSA-N	0	0	299.418	4.164	20	30		CIEDRN
N#Cc1c(F)cccc1Sc1ccc(F)c(F)c1	ZINC000057680780	264414057	/nfs/dbraw/zinc/41/40/57/264414057.db2.gz	BUQRTNLRBVHXLM-UHFFFAOYSA-N	0	0	265.259	4.127	20	30		CIEDRN
C=CCCO[C@H](C)C(=O)Nc1c(CC)cc(C)cc1CC	ZINC000281071181	264464558	/nfs/dbraw/zinc/46/45/58/264464558.db2.gz	AXMCCNMWINOSIS-CQSZACIVSA-N	0	0	289.419	4.040	20	30		CIEDRN
C=CCC[C@@H](NCc1ncc(CC)s1)c1ccco1	ZINC000286227464	264570578	/nfs/dbraw/zinc/57/05/78/264570578.db2.gz	SSJPGYZPEUNCNO-CYBMUJFWSA-N	0	0	276.405	4.096	20	30		CIEDRN
CC[C@@H](CC#N)NC(=O)C1(c2cccc(C)c2)CCCCC1	ZINC000183910822	264645802	/nfs/dbraw/zinc/64/58/02/264645802.db2.gz	YTXHSTASOHOPQY-KRWDZBQOSA-N	0	0	298.430	4.005	20	30		CIEDRN
C=CCS[C@@H](C)C(=O)Nc1c(C)cccc1C(C)C	ZINC000289357859	264693506	/nfs/dbraw/zinc/69/35/06/264693506.db2.gz	HVEXIOUQEQOYFI-ZDUSSCGKSA-N	0	0	277.433	4.365	20	30		CIEDRN
C=CCCCCCNc1ccc(C)c(NC(C)=O)c1	ZINC000195447802	264995351	/nfs/dbraw/zinc/99/53/51/264995351.db2.gz	GYOOEVHJENPYBS-UHFFFAOYSA-N	0	0	260.381	4.112	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H]1c1ccccc1C	ZINC000185231252	265010745	/nfs/dbraw/zinc/01/07/45/265010745.db2.gz	MHMWHKUIYNZMOK-NVXWUHKLSA-N	0	0	271.404	4.261	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@H]1c1cccc(F)c1	ZINC000185236570	265011319	/nfs/dbraw/zinc/01/13/19/265011319.db2.gz	KLCUUOZAQSPYJJ-CJNGLKHVSA-N	0	0	275.367	4.092	20	30		CIEDRN
N#CCCCNC(=O)Nc1ccc2c(c1)oc1ccccc12	ZINC000344940149	265069462	/nfs/dbraw/zinc/06/94/62/265069462.db2.gz	IKMCIQHBGGPCNX-UHFFFAOYSA-N	0	0	293.326	4.011	20	30		CIEDRN
N#Cc1ccccc1CNc1cccc(OC2CCCC2)c1	ZINC000514527879	265173525	/nfs/dbraw/zinc/17/35/25/265173525.db2.gz	CUFQUFQTGRAXLM-UHFFFAOYSA-N	0	0	292.382	4.492	20	30		CIEDRN
N#Cc1csc(CNc2ccc(Cl)c(F)c2)c1	ZINC000093686505	265188273	/nfs/dbraw/zinc/18/82/73/265188273.db2.gz	FAPPYXYFHLAAOT-UHFFFAOYSA-N	0	0	266.728	4.024	20	30		CIEDRN
N#Cc1ccc(Sc2ccccc2Cl)cc1[N+](=O)[O-]	ZINC000094593674	265245536	/nfs/dbraw/zinc/24/55/36/265245536.db2.gz	WOJIZXXKWYUCKN-UHFFFAOYSA-N	0	0	290.731	4.271	20	30		CIEDRN
N#Cc1ccc(Sc2ccc(Cl)cc2)cc1[N+](=O)[O-]	ZINC000094593663	265245594	/nfs/dbraw/zinc/24/55/94/265245594.db2.gz	PIDCQNMRJJKLMX-UHFFFAOYSA-N	0	0	290.731	4.271	20	30		CIEDRN
Cc1ccc(Sc2ccc(C#N)c([N+](=O)[O-])c2)cc1C	ZINC000094593682	265245706	/nfs/dbraw/zinc/24/57/06/265245706.db2.gz	SOEJJIBYPJFVBA-UHFFFAOYSA-N	0	0	284.340	4.235	20	30		CIEDRN
C=CCN(CC=C)C(=O)N[C@@H](c1ccccc1)C1CCCC1	ZINC000519259605	265379302	/nfs/dbraw/zinc/37/93/02/265379302.db2.gz	XUIIAHVOTMSIFG-SFHVURJKSA-N	0	0	298.430	4.302	20	30		CIEDRN
CCc1c(C)sc(NC(=O)[C@H]2CCC[C@H](C)C2)c1C#N	ZINC000519733551	265570468	/nfs/dbraw/zinc/57/04/68/265570468.db2.gz	ONUMCZIJZLECML-JQWIXIFHSA-N	0	0	290.432	4.255	20	30		CIEDRN
CSc1ccc(CN(CCC#N)CCC(C)C)s1	ZINC000356196571	266069742	/nfs/dbraw/zinc/06/97/42/266069742.db2.gz	SFYPQXCBRBLCTM-UHFFFAOYSA-N	0	0	282.478	4.232	20	30		CIEDRN
C=CCCC1(C(=O)N[C@H]2CC[C@@H](C)c3ccccc32)CC1	ZINC000356569257	266138332	/nfs/dbraw/zinc/13/83/32/266138332.db2.gz	SXFYAVYIHOHDGU-PBHICJAKSA-N	0	0	283.415	4.488	20	30		CIEDRN
C=CCCC1(C(=O)N[C@@H]2CCCc3cc(F)ccc32)CC1	ZINC000356641570	266152837	/nfs/dbraw/zinc/15/28/37/266152837.db2.gz	YZJXVWSDSCAILA-MRXNPFEDSA-N	0	0	287.378	4.066	20	30		CIEDRN
C[C@@H](Sc1ccccc1)c1ccc(NC(=O)CC#N)cc1	ZINC000356935554	266214292	/nfs/dbraw/zinc/21/42/92/266214292.db2.gz	NKPADUHKCLOOMH-CYBMUJFWSA-N	0	0	296.395	4.392	20	30		CIEDRN
CCc1noc([C@H](C)Sc2cccc(Cl)c2C#N)n1	ZINC000357058696	266239712	/nfs/dbraw/zinc/23/97/12/266239712.db2.gz	RVVBUFRWEYGAPH-QMMMGPOBSA-N	0	0	293.779	4.010	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NCc1ncnn1CCC	ZINC000357190446	266263036	/nfs/dbraw/zinc/26/30/36/266263036.db2.gz	OVDVYEPVRRZNRN-UHFFFAOYSA-N	0	0	298.434	4.152	20	30		CIEDRN
C=CCCC1(C(=O)N[C@H]2CCCc3ccc(F)cc32)CC1	ZINC000357485134	266306912	/nfs/dbraw/zinc/30/69/12/266306912.db2.gz	WHPNPJGFRONTJR-INIZCTEOSA-N	0	0	287.378	4.066	20	30		CIEDRN
N#Cc1ccccc1SCC(=O)c1c[nH]c2ccccc12	ZINC000357504510	266310674	/nfs/dbraw/zinc/31/06/74/266310674.db2.gz	PZECQTVEIRSNBQ-UHFFFAOYSA-N	0	0	292.363	4.015	20	30		CIEDRN
CC[C@H](C)n1ncc(N[C@H](C)c2ccc(C#N)cc2)c1C	ZINC000357842072	266375266	/nfs/dbraw/zinc/37/52/66/266375266.db2.gz	AEMMJTXOVMJDTQ-QWHCGFSZSA-N	0	0	282.391	4.207	20	30		CIEDRN
Cc1ccc(CSCCCC#N)cc1Br	ZINC000359060300	266529208	/nfs/dbraw/zinc/52/92/08/266529208.db2.gz	CGFWZOMOUPNTOM-UHFFFAOYSA-N	0	0	284.222	4.295	20	30		CIEDRN
CC(C)Cc1ccc([C@@H](NC(=O)CCCC#N)C2CC2)cc1	ZINC000360150985	266686753	/nfs/dbraw/zinc/68/67/53/266686753.db2.gz	NSFLTDMECBXFKR-LJQANCHMSA-N	0	0	298.430	4.146	20	30		CIEDRN
N#CCCCC(=O)N1CCC[C@H]1CCC1CCCCC1	ZINC000360375526	266711252	/nfs/dbraw/zinc/71/12/52/266711252.db2.gz	KNBDAMCORONNQK-INIZCTEOSA-N	0	0	276.424	4.032	20	30		CIEDRN
C[C@@H](Sc1cccc(Cl)c1C#N)c1cccnc1	ZINC000360937298	266758367	/nfs/dbraw/zinc/75/83/67/266758367.db2.gz	ZCHOZHUNXGCIDS-SNVBAGLBSA-N	0	0	274.776	4.460	20	30		CIEDRN
CCC(CC)[C@H](NC(=O)CCCC#N)c1cccs1	ZINC000361603352	266857546	/nfs/dbraw/zinc/85/75/46/266857546.db2.gz	WHICZDLQXXAICS-HNNXBMFYSA-N	0	0	278.421	4.035	20	30		CIEDRN
CCS[C@@H]1CCC[C@@H](Nc2nc(C)cc(C)c2C#N)C1	ZINC000362136577	266933182	/nfs/dbraw/zinc/93/31/82/266933182.db2.gz	FVPWLZCTFCZYLS-ZIAGYGMSSA-N	0	0	289.448	4.046	20	30		CIEDRN
C=CCN(CC(F)(F)F)C(=O)c1cccc2ccsc21	ZINC000362150948	266933711	/nfs/dbraw/zinc/93/37/11/266933711.db2.gz	HUOUNVKCXQIKBT-UHFFFAOYSA-N	0	0	299.317	4.092	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N(C)[C@H](C)C(C)C	ZINC000362537448	267004424	/nfs/dbraw/zinc/00/44/24/267004424.db2.gz	JMXVIWOUQBJHAR-CYBMUJFWSA-N	0	0	277.433	4.081	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N1CCC(C=C)CC1	ZINC000362754207	267042507	/nfs/dbraw/zinc/04/25/07/267042507.db2.gz	XMUHELBWHDFIKH-UHFFFAOYSA-N	0	0	287.428	4.003	20	30		CIEDRN
CCCC(C)(C)CC(=O)N[C@H](CCC#N)c1ccccc1	ZINC000362778671	267044279	/nfs/dbraw/zinc/04/42/79/267044279.db2.gz	BHPKMFCUCSAZQL-MRXNPFEDSA-N	0	0	286.419	4.364	20	30		CIEDRN
CCCCCCCCC(=O)N1CCCC[C@H]1c1cc[nH]n1	ZINC000367654496	267106493	/nfs/dbraw/zinc/10/64/93/267106493.db2.gz	ALCJIDDGAPGGCC-INIZCTEOSA-N	0	0	291.439	4.214	20	30		CIEDRN
C=CCCCC(=O)N1CCC(=Cc2ccccc2)CC1	ZINC000370135206	267294505	/nfs/dbraw/zinc/29/45/05/267294505.db2.gz	DGVIJSQCEWRCCW-UHFFFAOYSA-N	0	0	269.388	4.049	20	30		CIEDRN
C=CCCC(=O)N(C1CC1)[C@H]1CCOc2cc(C)c(C)cc21	ZINC000370190392	267298307	/nfs/dbraw/zinc/29/83/07/267298307.db2.gz	GAMYDRVNBXLHJO-KRWDZBQOSA-N	0	0	299.414	4.084	20	30		CIEDRN
N#CCCCCSCc1ccc(Br)cc1	ZINC000119279960	267314554	/nfs/dbraw/zinc/31/45/54/267314554.db2.gz	ASVPHHXVAGRZIS-UHFFFAOYSA-N	0	0	284.222	4.376	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1C[C@H](c2ccsc2)C[C@@H]1C	ZINC000370450916	267319567	/nfs/dbraw/zinc/31/95/67/267319567.db2.gz	XOTDTGBUNWNEJJ-XJKSGUPXSA-N	0	0	289.444	4.221	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1C[C@H](c2ccsc2)C[C@H]1C	ZINC000370450915	267319954	/nfs/dbraw/zinc/31/99/54/267319954.db2.gz	XOTDTGBUNWNEJJ-CZUORRHYSA-N	0	0	289.444	4.221	20	30		CIEDRN
Cc1cc(F)ccc1-c1ccc(CNCC2(C#N)CCC2)o1	ZINC000418141016	267361771	/nfs/dbraw/zinc/36/17/71/267361771.db2.gz	KJNQNMKMJUUOOT-UHFFFAOYSA-N	0	0	298.361	4.178	20	30		CIEDRN
C=CCN(CC)C(=O)Nc1cc(-c2ccccc2)cnc1C	ZINC000376628744	268003440	/nfs/dbraw/zinc/00/34/40/268003440.db2.gz	OVXBTMMCRWCIAR-UHFFFAOYSA-N	0	0	295.386	4.097	20	30		CIEDRN
CC#CCCCC(=O)N1CCC[C@@H]1c1cc(C)cc(C)c1	ZINC000376954612	268033959	/nfs/dbraw/zinc/03/39/59/268033959.db2.gz	LRQNMXIVSREFIK-GOSISDBHSA-N	0	0	283.415	4.161	20	30		CIEDRN
CCN(CCC#N)[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000123309673	268035262	/nfs/dbraw/zinc/03/52/62/268035262.db2.gz	IZQAGSLVYVNBRU-LLVKDONJSA-N	0	0	270.298	4.002	20	30		CIEDRN
N#Cc1ccc(/C=C/c2cc(C(F)(F)F)ccc2F)nc1	ZINC000172000479	335088169	/nfs/dbraw/zinc/08/81/69/335088169.db2.gz	HLDXYIPAKLHRHW-GORDUTHDSA-N	0	0	292.235	4.282	20	30		CIEDRN
N#Cc1ccnc(SCc2c(F)cccc2F)c1Cl	ZINC000574969136	327673571	/nfs/dbraw/zinc/67/35/71/327673571.db2.gz	NHLRQCAFBPQXOA-UHFFFAOYSA-N	0	0	296.729	4.177	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc([C@H]2CCN(C)c3ccccc32)no1	ZINC000565269697	327731933	/nfs/dbraw/zinc/73/19/33/327731933.db2.gz	LNDJGQIGHLQDQS-ZFWWWQNUSA-N	0	0	297.402	4.111	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccc2c(ccn2CCC)c1	ZINC000466418132	327737488	/nfs/dbraw/zinc/73/74/88/327737488.db2.gz	VJFQYPSKTUBIRV-UHFFFAOYSA-N	0	0	282.387	4.183	20	30		CIEDRN
Cc1nsc(N2CCC[C@H](c3ccccc3)CC2)c1C#N	ZINC000580703206	327745864	/nfs/dbraw/zinc/74/58/64/327745864.db2.gz	JTBLHLXICYVEPL-HNNXBMFYSA-N	0	0	297.427	4.097	20	30		CIEDRN
Cc1cc(C(=O)Nc2ccccc2CC#N)c(C)n1C(C)C	ZINC000580298985	327772138	/nfs/dbraw/zinc/77/21/38/327772138.db2.gz	QKFVXGOFYIVTQE-UHFFFAOYSA-N	0	0	295.386	4.004	20	30		CIEDRN
N#Cc1cc(F)ccc1NCc1ccc(C(F)(F)F)cc1	ZINC000113317695	327786236	/nfs/dbraw/zinc/78/62/36/327786236.db2.gz	LFFMLFBCIHETJX-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
Cc1ccc([C@H](C)Nc2ccc(F)cc2C#N)cc1	ZINC000113317555	327786245	/nfs/dbraw/zinc/78/62/45/327786245.db2.gz	UVGPJECFOLDNLY-LBPRGKRZSA-N	0	0	254.308	4.179	20	30		CIEDRN
CC(C)(C#N)CCCSc1nc2cc(Cl)cnc2[nH]1	ZINC000177154041	327788086	/nfs/dbraw/zinc/78/80/86/327788086.db2.gz	UFJKBZMGTRAXBE-UHFFFAOYSA-N	0	0	294.811	4.033	20	30		CIEDRN
C=C(C)[C@H]1OCC[C@H]1c1nc(-c2ccc(C(C)C)cc2)no1	ZINC000582027692	327810507	/nfs/dbraw/zinc/81/05/07/327810507.db2.gz	GZLXLHYOOBYUSH-HZPDHXFCSA-N	0	0	298.386	4.309	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)[C@H]2CCC(C)=C(C)C2)s1	ZINC000580330004	327835583	/nfs/dbraw/zinc/83/55/83/327835583.db2.gz	UPQUKPBFRFIKFY-LBPRGKRZSA-N	0	0	288.416	4.257	20	30		CIEDRN
N#C[C@@H]1CCC[C@H](Nc2ccc3nc(C4CC4)oc3c2)C1	ZINC000185861102	327848482	/nfs/dbraw/zinc/84/84/82/327848482.db2.gz	JTHPNZCALSJLAZ-YPMHNXCESA-N	0	0	281.359	4.199	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)C[C@H](C)c1cccc(F)c1	ZINC000540525453	327889243	/nfs/dbraw/zinc/88/92/43/327889243.db2.gz	NVQJSCYAKPDWKN-UONOGXRCSA-N	0	0	277.383	4.180	20	30		CIEDRN
Cc1ccc(Sc2ccc(C#N)cc2[N+](=O)[O-])c(C)c1	ZINC000020667510	327929236	/nfs/dbraw/zinc/92/92/36/327929236.db2.gz	GARLIUZABGPBNP-UHFFFAOYSA-N	0	0	284.340	4.235	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)[C@H](C)c1cc2ccccc2o1	ZINC000538333173	327943108	/nfs/dbraw/zinc/94/31/08/327943108.db2.gz	WXKNUEWWFYFPQC-ZIAGYGMSSA-N	0	0	285.387	4.397	20	30		CIEDRN
N#CCc1ccc(COc2cnc3ccc(F)cc3c2)cc1	ZINC000337938928	327962800	/nfs/dbraw/zinc/96/28/00/327962800.db2.gz	VYUMZCNBLUCGCC-UHFFFAOYSA-N	0	0	292.313	4.019	20	30		CIEDRN
Cc1cc(C#N)cc(NC(c2ccccc2)c2ccccc2)n1	ZINC000391464086	328003208	/nfs/dbraw/zinc/00/32/08/328003208.db2.gz	HGVIZFDFVIFCIH-UHFFFAOYSA-N	0	0	299.377	4.463	20	30		CIEDRN
CC(C)Nc1cccc(Oc2ccc(C#N)cc2)c1	ZINC000531522084	328013825	/nfs/dbraw/zinc/01/38/25/328013825.db2.gz	AEAKNXIDSVVJFW-UHFFFAOYSA-N	0	0	252.317	4.171	20	30		CIEDRN
N#Cc1ccc(F)cc1CSc1c(F)cc(F)cc1F	ZINC000531582682	328016686	/nfs/dbraw/zinc/01/66/86/328016686.db2.gz	QGQILRLCUQVDCR-UHFFFAOYSA-N	0	0	297.276	4.407	20	30		CIEDRN
Cc1cccc(SCCOc2cccc(C#N)c2)c1	ZINC000040696104	328017301	/nfs/dbraw/zinc/01/73/01/328017301.db2.gz	ORCJKGGURYBFEV-UHFFFAOYSA-N	0	0	269.369	4.038	20	30		CIEDRN
CC[C@@H](CC1CCCCC1)C(=O)Nc1cc(CC#N)ccn1	ZINC000531671013	328022467	/nfs/dbraw/zinc/02/24/67/328022467.db2.gz	RYPADFAGYRSHDY-INIZCTEOSA-N	0	0	299.418	4.083	20	30		CIEDRN
C=CCCc1csc(-c2ccc(OCC)c(OC)c2)n1	ZINC000534143650	328036634	/nfs/dbraw/zinc/03/66/34/328036634.db2.gz	DJBCIYYUTMZBAP-UHFFFAOYSA-N	0	0	289.400	4.336	20	30		CIEDRN
C=CCN(C(=O)c1cc(F)cc(Cl)c1)c1ccccc1	ZINC000531801617	328036978	/nfs/dbraw/zinc/03/69/78/328036978.db2.gz	FGUISVMDXPZPGX-UHFFFAOYSA-N	0	0	289.737	4.312	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1cccc(OCC=C)c1	ZINC000538348767	328037339	/nfs/dbraw/zinc/03/73/39/328037339.db2.gz	WJZTURNRDCHAPR-CQSZACIVSA-N	0	0	288.391	4.118	20	30		CIEDRN
CCC(CC)[C@@H](C)C(=O)N[C@@H](C#N)c1ccc(Cl)cc1	ZINC000534168236	328037628	/nfs/dbraw/zinc/03/76/28/328037628.db2.gz	ZKLIQHJCUURNFU-ABAIWWIYSA-N	0	0	292.810	4.093	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1cccc2c3c([nH]c21)CCCC3	ZINC000110165254	328040721	/nfs/dbraw/zinc/04/07/21/328040721.db2.gz	ZPJOCRMZEUIJNI-UHFFFAOYSA-N	0	0	296.414	4.085	20	30		CIEDRN
C=CC1CCN(C(=O)c2cc(Cl)cc(Cl)c2)CC1	ZINC000110365098	328048862	/nfs/dbraw/zinc/04/88/62/328048862.db2.gz	GLOOLAICWYCJQF-UHFFFAOYSA-N	0	0	284.186	4.032	20	30		CIEDRN
C=CC1CCN(C(=O)c2cccc(Cl)c2Cl)CC1	ZINC000110369947	328049332	/nfs/dbraw/zinc/04/93/32/328049332.db2.gz	UJJWJRHBHMNPHJ-UHFFFAOYSA-N	0	0	284.186	4.032	20	30		CIEDRN
CC(C)N(CCC#N)Cc1ccc(-c2ccc(F)cc2)o1	ZINC000534342052	328049977	/nfs/dbraw/zinc/04/99/77/328049977.db2.gz	AASUOLIGWJSMFH-UHFFFAOYSA-N	0	0	286.350	4.210	20	30		CIEDRN
CC1=C(C(=O)Nc2ccccc2CC#N)CCC(C)(C)C1	ZINC000563398315	328062024	/nfs/dbraw/zinc/06/20/24/328062024.db2.gz	KJWIJUFQZBSSLO-UHFFFAOYSA-N	0	0	282.387	4.218	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1ccccc1N(C)C)c1ccccc1	ZINC000152128836	328071305	/nfs/dbraw/zinc/07/13/05/328071305.db2.gz	VSHNIQLBSRRVKT-HNNXBMFYSA-N	0	0	294.398	4.051	20	30		CIEDRN
CCC(CC)N(C(=O)Nc1scc(C)c1C#N)C1CC1	ZINC000563544868	328072512	/nfs/dbraw/zinc/07/25/12/328072512.db2.gz	FGLXUESVBYNMLH-UHFFFAOYSA-N	0	0	291.420	4.113	20	30		CIEDRN
CCc1c(C)sc(NC(=O)CC2(C)CCCC2)c1C#N	ZINC000563566485	328074121	/nfs/dbraw/zinc/07/41/21/328074121.db2.gz	UNLIXOVOJWOKKM-UHFFFAOYSA-N	0	0	290.432	4.400	20	30		CIEDRN
N#Cc1cc(CN2CCC[C@H]2c2ccsc2)ccc1F	ZINC000160854718	328089190	/nfs/dbraw/zinc/08/91/90/328089190.db2.gz	WKVBDYQKUYLYRP-INIZCTEOSA-N	0	0	286.375	4.096	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)CCCc1ccc(SC)cc1	ZINC000571286027	328097833	/nfs/dbraw/zinc/09/78/33/328097833.db2.gz	HXVOTYWQMRVRGS-OAHLLOKOSA-N	0	0	291.460	4.202	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@H]1CC[C@@H](c2ccc(Cl)cc2)C1	ZINC000412582121	328112683	/nfs/dbraw/zinc/11/26/83/328112683.db2.gz	APJGVDGEEQYCFG-HIFRSBDPSA-N	0	0	291.822	4.305	20	30		CIEDRN
CC(C)(C#N)CCCSCc1cccc(F)c1	ZINC000161046071	328121494	/nfs/dbraw/zinc/12/14/94/328121494.db2.gz	KJRGAKGYKYYMIN-UHFFFAOYSA-N	0	0	251.370	4.389	20	30		CIEDRN
C=C(C)[C@H](Cc1nc(C2CCC(C)(C)CC2)no1)OCC	ZINC000571447376	328122727	/nfs/dbraw/zinc/12/27/27/328122727.db2.gz	XUQHPCQVMQUSHZ-AWEZNQCLSA-N	0	0	292.423	4.277	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@H]1CCCc2ccc(C)cc21	ZINC000571476409	328124299	/nfs/dbraw/zinc/12/42/99/328124299.db2.gz	VWHNOIKPAAVKCP-WMZOPIPTSA-N	0	0	271.404	4.091	20	30		CIEDRN
C=CCCC(=O)N1CC[C@H](CC(C)(C)C)C1(C)C	ZINC000412826405	328126855	/nfs/dbraw/zinc/12/68/55/328126855.db2.gz	QRIBDAUXLHBJHB-CYBMUJFWSA-N	0	0	251.414	4.016	20	30		CIEDRN
C/C=C/c1ccc(NCc2ccc(CC#N)cc2)cc1	ZINC000571560190	328133972	/nfs/dbraw/zinc/13/39/72/328133972.db2.gz	GNHXNNGZPVAKKZ-NSCUHMNNSA-N	0	0	262.356	4.398	20	30		CIEDRN
C=CCC[C@H](C(=O)N[C@@H]1C[C@H]1c1ccco1)c1ccccc1	ZINC000412943823	328131269	/nfs/dbraw/zinc/13/12/69/328131269.db2.gz	MXFQRCCLKIUOQA-GVDBMIGSSA-N	0	0	295.382	4.002	20	30		CIEDRN
C[C@@H](CSCCC#N)c1ccc(C(F)(F)F)cc1	ZINC000413015553	328140402	/nfs/dbraw/zinc/14/04/02/328140402.db2.gz	TWAXIOHEHVFTIF-JTQLQIEISA-N	0	0	273.323	4.456	20	30		CIEDRN
CC(C)(C#N)CCCSCc1ccc(-n2cccn2)cc1	ZINC000161153362	328137703	/nfs/dbraw/zinc/13/77/03/328137703.db2.gz	HGIVYQHZZCBJQF-UHFFFAOYSA-N	0	0	299.443	4.435	20	30		CIEDRN
N#CCCSCCOc1c(Cl)cccc1Cl	ZINC000413013225	328139757	/nfs/dbraw/zinc/13/97/57/328139757.db2.gz	NLTJTDUEULVMMM-UHFFFAOYSA-N	0	0	276.188	4.019	20	30		CIEDRN
C[C@@H](SCCC#N)c1nc(-c2ccc(Cl)cc2)no1	ZINC000413011832	328139861	/nfs/dbraw/zinc/13/98/61/328139861.db2.gz	JWUDDOWUNMDEJW-SECBINFHSA-N	0	0	293.779	4.098	20	30		CIEDRN
CC(C)(C)c1ccncc1CNc1ccc(C#N)cc1F	ZINC000413524273	328148386	/nfs/dbraw/zinc/14/83/86/328148386.db2.gz	ZYISHGRHXZJGKN-UHFFFAOYSA-N	0	0	283.350	4.002	20	30		CIEDRN
C=CC[C@@H](Cc1ccccc1)Nc1nccc(C(F)F)n1	ZINC000413570138	328149325	/nfs/dbraw/zinc/14/93/25/328149325.db2.gz	FXYYWMVQJXBPCT-ZDUSSCGKSA-N	0	0	289.329	4.014	20	30		CIEDRN
Cc1cccc(C[S@@](=O)CCC2(C#N)CCCCC2)c1	ZINC000414266949	328153955	/nfs/dbraw/zinc/15/39/55/328153955.db2.gz	MQGSFZSQWZSUAX-FQEVSTJZSA-N	0	0	289.444	4.108	20	30		CIEDRN
CC(C)CCC(=O)Nc1ccccc1SC[C@H](C)C#N	ZINC000264502803	328159601	/nfs/dbraw/zinc/15/96/01/328159601.db2.gz	GUQAFVQKKFPSBX-CYBMUJFWSA-N	0	0	290.432	4.313	20	30		CIEDRN
CC/C=C(\C)C(=O)N[C@@H](C#N)c1c(Cl)cccc1Cl	ZINC000264367144	328159076	/nfs/dbraw/zinc/15/90/76/328159076.db2.gz	UBMIMFGMGLHPMT-LHXVZLOVSA-N	0	0	297.185	4.031	20	30		CIEDRN
C[C@H](ON=C1CCC1)c1nc(-c2ccc(Cl)cc2)no1	ZINC000266612537	328169726	/nfs/dbraw/zinc/16/97/26/328169726.db2.gz	IFXHXKXICOWAHA-VIFPVBQESA-N	0	0	291.738	4.008	20	30		CIEDRN
CC(C)CCN(CCC#N)Cc1csc(C(C)C)n1	ZINC000173548568	329148743	/nfs/dbraw/zinc/14/87/43/329148743.db2.gz	SUHUJFWFDJHQPI-UHFFFAOYSA-N	0	0	279.453	4.028	20	30		CIEDRN
CC(C)(C)[C@](C)(C#N)NC(=O)c1cccc(-c2ccoc2)c1	ZINC000274383622	328210809	/nfs/dbraw/zinc/21/08/09/328210809.db2.gz	YZYHFSMZVQFPQI-SFHVURJKSA-N	0	0	296.370	4.005	20	30		CIEDRN
C=CCCCC(=O)Nc1cccc(CCC(F)(F)F)c1	ZINC000176964590	329179788	/nfs/dbraw/zinc/17/97/88/329179788.db2.gz	RQVCXIBTEFEVSB-UHFFFAOYSA-N	0	0	285.309	4.476	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(CCC(F)(F)F)cc1	ZINC000177430649	329183827	/nfs/dbraw/zinc/18/38/27/329183827.db2.gz	PZHQJNQKVGGVJU-UHFFFAOYSA-N	0	0	285.309	4.476	20	30		CIEDRN
CCc1ccc(NCc2ccc(C#N)cc2F)cc1C	ZINC000380498007	328225288	/nfs/dbraw/zinc/22/52/88/328225288.db2.gz	ZFMRJCGIEHBVLC-UHFFFAOYSA-N	0	0	268.335	4.180	20	30		CIEDRN
Cc1cccc(CSCCCC2(C#N)CCOCC2)c1	ZINC000281705581	328241202	/nfs/dbraw/zinc/24/12/02/328241202.db2.gz	CBAMOKHLNFRTLS-UHFFFAOYSA-N	0	0	289.444	4.329	20	30		CIEDRN
C=CCCCCNC(=O)C[C@H](CC)c1ccc(OC)cc1	ZINC000471670340	328253761	/nfs/dbraw/zinc/25/37/61/328253761.db2.gz	FTSVEJGOSFNOKN-HNNXBMFYSA-N	0	0	289.419	4.051	20	30		CIEDRN
C[C@H](Nc1cccc(OCCCC#N)c1)c1ccncc1F	ZINC000340319728	328255374	/nfs/dbraw/zinc/25/53/74/328255374.db2.gz	ROFTZGBVKAPNNL-ZDUSSCGKSA-N	0	0	299.349	4.076	20	30		CIEDRN
CC(C)(C)c1ccc([C@@H]2CCCN2C(=O)CCCC#N)cc1	ZINC000292511635	328270890	/nfs/dbraw/zinc/27/08/90/328270890.db2.gz	GISMRGAWHOURMN-KRWDZBQOSA-N	0	0	298.430	4.341	20	30		CIEDRN
Cc1cccc2nc(N[C@H]3CC[C@@H](CC#N)C3)sc21	ZINC000294915526	328283891	/nfs/dbraw/zinc/28/38/91/328283891.db2.gz	GEEDLVFXBIPCOR-RYUDHWBXSA-N	0	0	271.389	4.099	20	30		CIEDRN
C[C@H](CC#N)N(C)Cc1ccc([C@H](C)C(F)(F)F)cc1	ZINC000296889466	328292568	/nfs/dbraw/zinc/29/25/68/328292568.db2.gz	XWJPUNNBXJACBF-NEPJUHHUSA-N	0	0	284.325	4.086	20	30		CIEDRN
CC(C)[C@H]1CCCN1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000299235257	328297969	/nfs/dbraw/zinc/29/79/69/328297969.db2.gz	JUOHINXOZZBEAL-MRXNPFEDSA-N	0	0	299.418	4.140	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)C[C@H]1CCCC[C@H]1C	ZINC000531896257	328305408	/nfs/dbraw/zinc/30/54/08/328305408.db2.gz	SPIBIQKBESHOMV-HUUCEWRRSA-N	0	0	278.440	4.182	20	30		CIEDRN
N#Cc1ccc(SCc2nc3ccccc3s2)cc1	ZINC000048512197	328309229	/nfs/dbraw/zinc/30/92/29/328309229.db2.gz	WYAMFBOFEVYNAQ-UHFFFAOYSA-N	0	0	282.393	4.460	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(Nc2nc(C)cs2)cc1	ZINC000110789021	328319065	/nfs/dbraw/zinc/31/90/65/328319065.db2.gz	WIQLZHPYWACWPI-UHFFFAOYSA-N	0	0	287.388	4.100	20	30		CIEDRN
N#Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1Cl	ZINC000048824346	328324749	/nfs/dbraw/zinc/32/47/49/328324749.db2.gz	JDZAEDRYAIXKAL-UHFFFAOYSA-N	0	0	291.137	4.117	20	30		CIEDRN
CC(C)n1c2cc(F)ccc2nc1-c1ccc(C#N)cc1F	ZINC000534630414	328328471	/nfs/dbraw/zinc/32/84/71/328328471.db2.gz	WAGLBCQMPOEMKK-UHFFFAOYSA-N	0	0	297.308	4.434	20	30		CIEDRN
CCOc1ccc(C#N)cc1NCc1ccccc1Cl	ZINC000049066584	328330497	/nfs/dbraw/zinc/33/04/97/328330497.db2.gz	FDZQNSJQCGLEFJ-UHFFFAOYSA-N	0	0	286.762	4.222	20	30		CIEDRN
C=C[C@H](CC(=O)N1CCC[C@@H]1C(C)(C)C)c1ccccc1	ZINC000534671090	328347553	/nfs/dbraw/zinc/34/75/53/328347553.db2.gz	GZOWPHOPTJUEDV-NVXWUHKLSA-N	0	0	285.431	4.383	20	30		CIEDRN
C=C[C@H](CC(=O)N1CCC[C@H]1C(C)(C)C)c1ccccc1	ZINC000534671092	328347590	/nfs/dbraw/zinc/34/75/90/328347590.db2.gz	GZOWPHOPTJUEDV-WBVHZDCISA-N	0	0	285.431	4.383	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CCC(C)(CC)CC1)c1ccccc1	ZINC000534696413	328356844	/nfs/dbraw/zinc/35/68/44/328356844.db2.gz	OEYUAGYDQCNZRY-INIZCTEOSA-N	0	0	285.431	4.385	20	30		CIEDRN
C=CCCNc1ccccc1N(C)Cc1ccccc1	ZINC000303810572	328357438	/nfs/dbraw/zinc/35/74/38/328357438.db2.gz	IHGQQUPYRXOMGZ-UHFFFAOYSA-N	0	0	266.388	4.311	20	30		CIEDRN
C[C@@H]1CCC[C@@](C#N)(NC(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000303680855	328357751	/nfs/dbraw/zinc/35/77/51/328357751.db2.gz	RUPMHHVDJUZHEJ-AUUYWEPGSA-N	0	0	298.430	4.186	20	30		CIEDRN
CCc1ccc([C@H]2C[C@@H](C)CCN2c2cccc(C#N)n2)o1	ZINC000534881395	328366695	/nfs/dbraw/zinc/36/66/95/328366695.db2.gz	DTBFFKCEQIOXGX-XJKSGUPXSA-N	0	0	295.386	4.086	20	30		CIEDRN
N#Cc1nnc2ccccc2c1Oc1ccc(Cl)c(F)c1	ZINC000534883050	328366897	/nfs/dbraw/zinc/36/68/97/328366897.db2.gz	UCXOVNKLSUUWQB-UHFFFAOYSA-N	0	0	299.692	4.086	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)[C@H](C)C(CC)CC	ZINC000534883619	328366907	/nfs/dbraw/zinc/36/69/07/328366907.db2.gz	DADNXNKDUHWXNA-CYBMUJFWSA-N	0	0	266.429	4.037	20	30		CIEDRN
CC[C@@](C)(C#N)NC(=O)C/C=C\c1ccc(C(C)C)cc1	ZINC000535010942	328376594	/nfs/dbraw/zinc/37/65/94/328376594.db2.gz	IMLIVRQKDYDCDU-MJRGOJFPSA-N	0	0	284.403	4.022	20	30		CIEDRN
C=CC1CCN(C(=O)N[C@@H](C)c2cc3ccccc3o2)CC1	ZINC000111805668	328379324	/nfs/dbraw/zinc/37/93/24/328379324.db2.gz	BKWOBYHWYWIUMW-ZDUSSCGKSA-N	0	0	298.386	4.101	20	30		CIEDRN
Cc1ccccc1CSCc1cc(C#N)ccc1F	ZINC000049956387	328379783	/nfs/dbraw/zinc/37/97/83/328379783.db2.gz	HPIQARHKHWGTFP-UHFFFAOYSA-N	0	0	271.360	4.439	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2ccc(Br)o2)no1	ZINC000546638617	328394009	/nfs/dbraw/zinc/39/40/09/328394009.db2.gz	HVFHXSRAOPDQKV-QMMMGPOBSA-N	0	0	297.152	4.162	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)C[C@H]1C[C@@H]1c1ccccc1	ZINC000341678524	328414006	/nfs/dbraw/zinc/41/40/06/328414006.db2.gz	QDBASCRKVIZESL-IAGOWNOFSA-N	0	0	298.430	4.111	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(F)c(C3CC3)c2)CC1	ZINC000342138943	328417462	/nfs/dbraw/zinc/41/74/62/328417462.db2.gz	HHZQRCIGFLGVNV-UHFFFAOYSA-N	0	0	273.351	4.388	20	30		CIEDRN
CN(C(=O)c1cccc(CC#N)c1)[C@@H]1CCC[C@@H]1C(C)(C)C	ZINC000416282567	328434157	/nfs/dbraw/zinc/43/41/57/328434157.db2.gz	CRGKGRWRNCPVBK-DLBZAZTESA-N	0	0	298.430	4.039	20	30		CIEDRN
C=C[C@H](CC(=O)N(C)c1cccc(C)c1)c1ccccc1	ZINC000535344384	328443502	/nfs/dbraw/zinc/44/35/02/328443502.db2.gz	JIVWLEUKGYVOMI-MRXNPFEDSA-N	0	0	279.383	4.318	20	30		CIEDRN
C[C@@H](CCc1ccccc1)Nc1ccc(F)cc1C#N	ZINC000113317572	328603223	/nfs/dbraw/zinc/60/32/23/328603223.db2.gz	FTAACPJEFMWEQV-ZDUSSCGKSA-N	0	0	268.335	4.131	20	30		CIEDRN
CC[C@@H](Cc1ccccc1)Nc1ccc(C#N)cc1F	ZINC000112466118	328439843	/nfs/dbraw/zinc/43/98/43/328439843.db2.gz	SQPZRTITRQDYIT-HNNXBMFYSA-N	0	0	268.335	4.131	20	30		CIEDRN
C=CCCCSc1nnc(C)n1[C@H]1CCC[C@H](C)C1	ZINC000535333100	328440412	/nfs/dbraw/zinc/44/04/12/328440412.db2.gz	MEHJMMKBJUAZGO-JSGCOSHPSA-N	0	0	279.453	4.396	20	30		CIEDRN
C=C[C@H](CC(=O)N1CCc2cccc(F)c21)c1ccccc1	ZINC000535380029	328447873	/nfs/dbraw/zinc/44/78/73/328447873.db2.gz	QQSYWYWWXUVDTO-CQSZACIVSA-N	0	0	295.357	4.075	20	30		CIEDRN
C=CCOc1ccccc1C(=O)N1CC=C(C(C)(C)C)CC1	ZINC000535466336	328453662	/nfs/dbraw/zinc/45/36/62/328453662.db2.gz	QUPXLIPWECJPAM-UHFFFAOYSA-N	0	0	299.414	4.070	20	30		CIEDRN
C[C@@H]1CC(=O)N[C@H](C(=O)N[C@@H]2CCCC[C@H]2C(C)(C)C)C1	ZINC000328792564	328458558	/nfs/dbraw/zinc/45/85/58/328458558.db2.gz	ZUNNNFWIUCKGLF-DGAVXFQQSA-N	0	0	294.439	4.303	20	30		CIEDRN
Cc1cnc([C@H](C)NC(=O)c2cc(C(C)C)oc2C)o1	ZINC000330607560	328463365	/nfs/dbraw/zinc/46/33/65/328463365.db2.gz	PIQNPACTYNRYAM-JTQLQIEISA-N	0	0	276.336	4.074	20	30		CIEDRN
Cc1nnc(SCCCCC#N)n1[C@H]1CCC[C@H](C)C1	ZINC000127861855	328481543	/nfs/dbraw/zinc/48/15/43/328481543.db2.gz	HAZPXJOCPKEIKF-JSGCOSHPSA-N	0	0	292.452	4.124	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1cc(-c2ncco2)ccc1C	ZINC000281281058	328498235	/nfs/dbraw/zinc/49/82/35/328498235.db2.gz	BWBGUDWXGMHAFF-AWEZNQCLSA-N	0	0	299.374	4.126	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)N(CC)CC	ZINC000191437118	328510967	/nfs/dbraw/zinc/51/09/67/328510967.db2.gz	PGGZDUONFGPPMD-UHFFFAOYSA-N	0	0	274.408	4.412	20	30		CIEDRN
C[C@H](c1ccc(C#N)cc1)N1C[C@H](C)c2ccccc21	ZINC000563774131	328512651	/nfs/dbraw/zinc/51/26/51/328512651.db2.gz	ODCJVNITRPLGMA-UONOGXRCSA-N	0	0	262.356	4.243	20	30		CIEDRN
CC(C)(C)CCCCC(=O)N[C@@](C)(C#N)C(C)(C)C	ZINC000563837134	328522883	/nfs/dbraw/zinc/52/28/83/328522883.db2.gz	WOAQBWOCZKZRTF-INIZCTEOSA-N	0	0	266.429	4.037	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CCC(c2ccsc2)CC1	ZINC000292447767	328537514	/nfs/dbraw/zinc/53/75/14/328537514.db2.gz	NKACHISDCYGERC-UHFFFAOYSA-N	0	0	277.433	4.056	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](C)c1ccc(OC(F)F)cc1	ZINC000184974431	328543526	/nfs/dbraw/zinc/54/35/26/328543526.db2.gz	DGLSZIRUXIZZNN-VXGBXAGGSA-N	0	0	297.345	4.068	20	30		CIEDRN
C=CCC(F)(F)C(=O)Nc1ccccc1OC(C)(C)C	ZINC000294310066	328548630	/nfs/dbraw/zinc/54/86/30/328548630.db2.gz	NVUFQDQPWHOPFO-UHFFFAOYSA-N	0	0	283.318	4.014	20	30		CIEDRN
N#Cc1cccc(OCCCSc2cccs2)c1	ZINC000037143721	328590150	/nfs/dbraw/zinc/59/01/50/328590150.db2.gz	HCQWNXXLXGWIEP-UHFFFAOYSA-N	0	0	275.398	4.181	20	30		CIEDRN
CC[C@H](C#N)NC(=O)c1ccc(-c2cccc(C(C)C)c2)o1	ZINC000179835906	326842571	/nfs/dbraw/zinc/84/25/71/326842571.db2.gz	TVGLMDHWQVZEKY-OAHLLOKOSA-N	0	0	296.370	4.102	20	30		CIEDRN
C=CCN(C(=O)[C@@H]1C[C@@H]1c1sccc1C)c1ccccc1	ZINC000533509862	326845329	/nfs/dbraw/zinc/84/53/29/326845329.db2.gz	KEUZTBREEBVUSJ-JKSUJKDBSA-N	0	0	297.423	4.379	20	30		CIEDRN
Cc1cccc(OCCSCc2ccc(C#N)cc2)c1	ZINC000057683780	326868307	/nfs/dbraw/zinc/86/83/07/326868307.db2.gz	MJHCICVOTQFAQJ-UHFFFAOYSA-N	0	0	283.396	4.179	20	30		CIEDRN
CC(C)N(CCC#N)Cc1cc(Cl)ccc1Cl	ZINC000087759874	326881671	/nfs/dbraw/zinc/88/16/71/326881671.db2.gz	ZKJKCFQSSWJNSS-UHFFFAOYSA-N	0	0	271.191	4.117	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1cccnc1-c1ccccc1	ZINC000533664538	326899668	/nfs/dbraw/zinc/89/96/68/326899668.db2.gz	JZZPJQLOSUPVEE-UHFFFAOYSA-N	0	0	295.386	4.179	20	30		CIEDRN
CC[C@@H]1CCCCN1C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000075997329	326922194	/nfs/dbraw/zinc/92/21/94/326922194.db2.gz	YVEHEOKJNDMEMW-CYBMUJFWSA-N	0	0	291.782	4.008	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ccc3c(c2)CCCC3=O)n1	ZINC000556360271	326922698	/nfs/dbraw/zinc/92/26/98/326922698.db2.gz	FHZHXCTUNOEJGV-UHFFFAOYSA-N	0	0	296.370	4.109	20	30		CIEDRN
C=C(C)CCSc1nnc(C)n1[C@H]1CCC[C@H](C)C1	ZINC000506420183	332772700	/nfs/dbraw/zinc/77/27/00/332772700.db2.gz	DBBCXLUYCGJZNR-JSGCOSHPSA-N	0	0	279.453	4.396	20	30		CIEDRN
CC[C@H](C)[C@@H]1CCCCN1c1nccc(C#N)c1Cl	ZINC000553184687	326930393	/nfs/dbraw/zinc/93/03/93/326930393.db2.gz	JMOAZBFWRMPEHN-AAEUAGOBSA-N	0	0	277.799	4.012	20	30		CIEDRN
N#C[C@H](Sc1ncnc2ccsc21)C1CCCCC1	ZINC000115186734	326933233	/nfs/dbraw/zinc/93/32/33/326933233.db2.gz	SONJZKUTOJIKRS-LBPRGKRZSA-N	0	0	289.429	4.256	20	30		CIEDRN
C=CCC(C)(C)C(=O)N(C)[C@@H]1CCCc2ccccc21	ZINC000556792951	326964654	/nfs/dbraw/zinc/96/46/54/326964654.db2.gz	YPAIYIZYPGBZDS-MRXNPFEDSA-N	0	0	271.404	4.125	20	30		CIEDRN
C=C(C)CCc1noc([C@@H](CC)Cc2ccccc2)n1	ZINC000556805438	326966333	/nfs/dbraw/zinc/96/63/33/326966333.db2.gz	ZGXANHCKRYAAJV-HNNXBMFYSA-N	0	0	270.376	4.315	20	30		CIEDRN
CN(C(=O)[C@@H]1CCC[C@@H]2CCCC[C@H]12)c1cccc(C#N)c1	ZINC000556810058	326967441	/nfs/dbraw/zinc/96/74/41/326967441.db2.gz	JZFGTCCHJRCXBM-RYQLBKOJSA-N	0	0	296.414	4.128	20	30		CIEDRN
N#Cc1ccsc1NC(=O)/C=C\c1cc2ccccc2o1	ZINC000255472059	326980923	/nfs/dbraw/zinc/98/09/23/326980923.db2.gz	WPAWEUQJDSOQQY-WAYWQWQTSA-N	0	0	294.335	4.018	20	30		CIEDRN
C[C@H](CC(C)(C)C)C(=O)Nc1cc(C#N)ccc1NC1CC1	ZINC000557065655	326991659	/nfs/dbraw/zinc/99/16/59/326991659.db2.gz	ZGQWNSFIHKCABZ-GFCCVEGCSA-N	0	0	299.418	4.143	20	30		CIEDRN
N#CCC[C@@H](C#N)COc1ccc(-c2ccccc2)cc1	ZINC000557279409	327000493	/nfs/dbraw/zinc/00/04/93/327000493.db2.gz	GWYZHXHSLOAFID-HNNXBMFYSA-N	0	0	276.339	4.176	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(C[C@H](C)c2ccccc2)no1	ZINC000564610451	327001241	/nfs/dbraw/zinc/00/12/41/327001241.db2.gz	OWFDMPIVMPUHSS-SUMWQHHRSA-N	0	0	270.376	4.270	20	30		CIEDRN
N#Cc1csc(/C=C\c2ccc3ccccc3n2)c1	ZINC000255726690	327008614	/nfs/dbraw/zinc/00/86/14/327008614.db2.gz	PUZWKKUVFIYNMF-FPLPWBNLSA-N	0	0	262.337	4.338	20	30		CIEDRN
Cc1cccc([C@@H](Nc2nc(C)cc(C#N)n2)C(C)(C)C)c1	ZINC000557604361	327015702	/nfs/dbraw/zinc/01/57/02/327015702.db2.gz	FTZMEHFJSUWSSG-MRXNPFEDSA-N	0	0	294.402	4.164	20	30		CIEDRN
COc1ccc(CNc2ccccc2C(C)C)cc1C#N	ZINC000087822295	327022817	/nfs/dbraw/zinc/02/28/17/327022817.db2.gz	BTXZJVPNOCIZJU-UHFFFAOYSA-N	0	0	280.371	4.302	20	30		CIEDRN
C[C@H]1C[C@@H](c2ccccc2)N(c2ccc(Cl)c(C#N)n2)C1	ZINC000557764313	327025786	/nfs/dbraw/zinc/02/57/86/327025786.db2.gz	OHQPMOUKWPSNNZ-LRDDRELGSA-N	0	0	297.789	4.194	20	30		CIEDRN
CSc1ccc2ncnc(Oc3ccccc3C#N)c2c1	ZINC000558005329	327040009	/nfs/dbraw/zinc/04/00/09/327040009.db2.gz	DCSFWMOYXYZFSI-UHFFFAOYSA-N	0	0	293.351	4.016	20	30		CIEDRN
Cc1c2cccc(C)c2oc1C(=O)NC1(C#N)CCCCC1	ZINC000065044440	327053167	/nfs/dbraw/zinc/05/31/67/327053167.db2.gz	LSTFJEIYYSNVBE-UHFFFAOYSA-N	0	0	296.370	4.006	20	30		CIEDRN
C=CCc1ccccc1OCc1csc(CCC)n1	ZINC000506770698	332779561	/nfs/dbraw/zinc/77/95/61/332779561.db2.gz	REOKQAXAQVBMDI-UHFFFAOYSA-N	0	0	273.401	4.403	20	30		CIEDRN
C[C@H](c1ccc(C(C)(C)C)cc1)N(C)C[C@H](C)C#N	ZINC000558087825	327067573	/nfs/dbraw/zinc/06/75/73/327067573.db2.gz	LGJIXPCUCPRYCP-ZIAGYGMSSA-N	0	0	258.409	4.137	20	30		CIEDRN
C[C@@H](C#N)CN(C)[C@H](C)c1ccc(C(C)(C)C)cc1	ZINC000558087824	327067654	/nfs/dbraw/zinc/06/76/54/327067654.db2.gz	LGJIXPCUCPRYCP-UONOGXRCSA-N	0	0	258.409	4.137	20	30		CIEDRN
CC1(C)CCCC[C@H]1CC(=O)Nc1ccccc1C#N	ZINC000506841590	332780921	/nfs/dbraw/zinc/78/09/21/332780921.db2.gz	YDBLDMZBAJZKHN-AWEZNQCLSA-N	0	0	270.376	4.103	20	30		CIEDRN
C=CCN(CC=C)C(=O)c1ccc(C2CCCC2)cc1	ZINC000558542723	327103482	/nfs/dbraw/zinc/10/34/82/327103482.db2.gz	URJUFMQDFIVDNO-UHFFFAOYSA-N	0	0	269.388	4.158	20	30		CIEDRN
N#Cc1ccc(SCCCc2ccccc2)cc1[N+](=O)[O-]	ZINC000558596484	327107979	/nfs/dbraw/zinc/10/79/79/327107979.db2.gz	QDIHDHXSTJSHQX-UHFFFAOYSA-N	0	0	298.367	4.191	20	30		CIEDRN
CC(C)CCn1ncc(Nc2cccc(C#N)n2)c1C(C)C	ZINC000558600387	327108209	/nfs/dbraw/zinc/10/82/09/327108209.db2.gz	YFVMMIMUTHQEDL-UHFFFAOYSA-N	0	0	297.406	4.063	20	30		CIEDRN
C=CCn1c(S[C@@H]2CC[C@@H](C)C2)nnc1-c1ccco1	ZINC000558829672	327123659	/nfs/dbraw/zinc/12/36/59/327123659.db2.gz	ZDAWGRRZGJHEHJ-VXGBXAGGSA-N	0	0	289.404	4.005	20	30		CIEDRN
N#CCc1cccc(N[C@H]2CCC[C@H](C3CC3)C2)c1	ZINC000313421933	327128924	/nfs/dbraw/zinc/12/89/24/327128924.db2.gz	DCSWCMCBTSSZAK-RDJZCZTQSA-N	0	0	254.377	4.133	20	30		CIEDRN
C[C@@H]1C[C@@H]1c1ccc(CNc2cccc(CC#N)c2)o1	ZINC000313448095	327131404	/nfs/dbraw/zinc/13/14/04/327131404.db2.gz	MRPWKRXDKGOWJQ-WBMJQRKESA-N	0	0	266.344	4.081	20	30		CIEDRN
CCCc1nsc(Oc2ccc(C#N)c3ccccc23)n1	ZINC000559008506	327137836	/nfs/dbraw/zinc/13/78/36/327137836.db2.gz	BDDMFUHZZJNVSH-UHFFFAOYSA-N	0	0	295.367	4.308	20	30		CIEDRN
C=CCC[C@H](C(=O)N[C@@H]1CCC[C@H]1C)c1ccccc1	ZINC000409658814	327163058	/nfs/dbraw/zinc/16/30/58/327163058.db2.gz	ZKAIJGBASZZUSR-HYVNUMGLSA-N	0	0	271.404	4.041	20	30		CIEDRN
Cc1ccc(F)cc1Oc1ccc(C(F)(F)F)c(C#N)n1	ZINC000409661931	327163271	/nfs/dbraw/zinc/16/32/71/327163271.db2.gz	OFOHCATYRPYENM-UHFFFAOYSA-N	0	0	296.223	4.212	20	30		CIEDRN
C=CCCc1ccccc1NCc1ncc(C2CC2)o1	ZINC000409842189	327165728	/nfs/dbraw/zinc/16/57/28/327165728.db2.gz	CJJXRHTZTHBZGN-UHFFFAOYSA-N	0	0	268.360	4.283	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)c1cccc(C2CCC2)c1	ZINC000409846273	327165928	/nfs/dbraw/zinc/16/59/28/327165928.db2.gz	DTKHPMYDTNVMBQ-UHFFFAOYSA-N	0	0	290.366	4.387	20	30		CIEDRN
C=CCCc1ccccc1NCc1cc(C#N)ccc1OC	ZINC000409846168	327166095	/nfs/dbraw/zinc/16/60/95/327166095.db2.gz	UNOHRJXBOJASRH-UHFFFAOYSA-N	0	0	292.382	4.298	20	30		CIEDRN
C=CCCc1ccccc1NCc1nc(C2CCCC2)no1	ZINC000409865595	327166363	/nfs/dbraw/zinc/16/63/63/327166363.db2.gz	SRZRKQSHLAPFOI-UHFFFAOYSA-N	0	0	297.402	4.458	20	30		CIEDRN
C[C@@H]1CCCCCN1C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000408166972	327176962	/nfs/dbraw/zinc/17/69/62/327176962.db2.gz	BLPBWSMUGSHHTJ-LLVKDONJSA-N	0	0	291.782	4.008	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@H]1C[C@H]1c1c(F)cccc1Cl	ZINC000410130704	327180133	/nfs/dbraw/zinc/18/01/33/327180133.db2.gz	NHEYJEDZSRLHLY-TUAOUCFPSA-N	0	0	295.785	4.054	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1coc2cc(C)c(C)cc21	ZINC000410131032	327180189	/nfs/dbraw/zinc/18/01/89/327180189.db2.gz	PATHXRNWNVCPNS-CYBMUJFWSA-N	0	0	271.360	4.134	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@H](C)CSc1ccc(F)cc1	ZINC000410131340	327180230	/nfs/dbraw/zinc/18/02/30/327180230.db2.gz	QZMPDXXMRUROLX-OCCSQVGLSA-N	0	0	295.423	4.025	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)C[C@H](OCC)C(=C)C	ZINC000410344906	327187463	/nfs/dbraw/zinc/18/74/63/327187463.db2.gz	NFYNBDPJUXBIMB-KRWDZBQOSA-N	0	0	287.403	4.115	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1ccc(OC)cc1	ZINC000410345057	327187469	/nfs/dbraw/zinc/18/74/69/327187469.db2.gz	NWJLPGABQDHSIS-UHFFFAOYSA-N	0	0	281.355	4.066	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)C1=CCCCC1	ZINC000410353329	327187492	/nfs/dbraw/zinc/18/74/92/327187492.db2.gz	RMNFKXLKMMMQLK-UHFFFAOYSA-N	0	0	255.361	4.244	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)C1(SC)CCC1	ZINC000410345568	327187590	/nfs/dbraw/zinc/18/75/90/327187590.db2.gz	QYRDWWGOZWXIOG-UHFFFAOYSA-N	0	0	275.417	4.029	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)CC[C@@H](C)SC	ZINC000410345827	327187594	/nfs/dbraw/zinc/18/75/94/327187594.db2.gz	RMFVFDJFHOXBKH-CYBMUJFWSA-N	0	0	277.433	4.275	20	30		CIEDRN
COc1ccc(Cl)cc1NCC(C)(C)CCC#N	ZINC000092142097	327188613	/nfs/dbraw/zinc/18/86/13/327188613.db2.gz	FLASPNZBDCCOSW-UHFFFAOYSA-N	0	0	266.772	4.090	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1ccc(F)c(F)c1	ZINC000410387100	327190690	/nfs/dbraw/zinc/19/06/90/327190690.db2.gz	VLEBTVKQNRUJMT-UHFFFAOYSA-N	0	0	287.309	4.336	20	30		CIEDRN
CCC(CC)[C@H](C)C(=O)Nc1ccc(C#N)cc1Cl	ZINC000536402259	327235891	/nfs/dbraw/zinc/23/58/91/327235891.db2.gz	YWBAZDCYVRAFNZ-JTQLQIEISA-N	0	0	278.783	4.222	20	30		CIEDRN
CC[C@H](CC(=O)N[C@](C)(C#N)CC(C)C)c1ccccc1	ZINC000559575468	327254127	/nfs/dbraw/zinc/25/41/27/327254127.db2.gz	UYWPTPFAVUYJJN-QAPCUYQASA-N	0	0	286.419	4.015	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cccc(N(C)C(C)C)c1	ZINC000559705137	327258223	/nfs/dbraw/zinc/25/82/23/327258223.db2.gz	YHQRMFKOKYFROV-UHFFFAOYSA-N	0	0	274.408	4.072	20	30		CIEDRN
CC(C)(C)[C@H]1CCCC[C@@H]1NC(=O)c1ccc(CC#N)cc1	ZINC000533888783	327266902	/nfs/dbraw/zinc/26/69/02/327266902.db2.gz	JKVUQULFEQPYCL-IRXDYDNUSA-N	0	0	298.430	4.087	20	30		CIEDRN
C=CCC(F)(F)c1nc(-c2ccccc2Cl)no1	ZINC000559924954	327271666	/nfs/dbraw/zinc/27/16/66/327271666.db2.gz	QVIMUFUWMVFFFK-UHFFFAOYSA-N	0	0	270.666	4.058	20	30		CIEDRN
C=CCC(C)(C)c1noc(COC/C=C\c2ccccc2)n1	ZINC000560022075	327277943	/nfs/dbraw/zinc/27/79/43/327277943.db2.gz	QSIQXHGGNYEFLV-FLIBITNWSA-N	0	0	298.386	4.153	20	30		CIEDRN
C=Cc1ccc(C(=O)Nc2sc(C)c(CC)c2C#N)cc1	ZINC000560021105	327277964	/nfs/dbraw/zinc/27/79/64/327277964.db2.gz	ZDKDRHRHJGGTRH-UHFFFAOYSA-N	0	0	296.395	4.386	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H](C)Oc2ccccc2F)n1	ZINC000560025182	327278117	/nfs/dbraw/zinc/27/81/17/327278117.db2.gz	OTPFHDHXKWASPW-NSHDSACASA-N	0	0	290.338	4.202	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H](F)Cc2ccccc2)n1	ZINC000560024072	327278127	/nfs/dbraw/zinc/27/81/27/327278127.db2.gz	HTPVYYLBDHLKKS-ZDUSSCGKSA-N	0	0	274.339	4.177	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cc(F)c(F)c(F)c2)n1	ZINC000560027204	327278374	/nfs/dbraw/zinc/27/83/74/327278374.db2.gz	KFXGAIKYMYDHPJ-UHFFFAOYSA-N	0	0	282.265	4.008	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N(C)[C@@H]1CCCc2ccccc21	ZINC000560033334	327278935	/nfs/dbraw/zinc/27/89/35/327278935.db2.gz	APVOLCNDWLBHII-SJLPKXTDSA-N	0	0	271.404	4.125	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N(C)[C@H]1CCCc2ccccc21	ZINC000560033335	327278971	/nfs/dbraw/zinc/27/89/71/327278971.db2.gz	APVOLCNDWLBHII-WMZOPIPTSA-N	0	0	271.404	4.125	20	30		CIEDRN
C=CCC(C)(C)c1noc(/C=C/c2ccc3c(c2)CCO3)n1	ZINC000560029989	327279006	/nfs/dbraw/zinc/27/90/06/327279006.db2.gz	ZTEBYGXMMXKPIN-SOFGYWHQSA-N	0	0	296.370	4.029	20	30		CIEDRN
C=CCCCNC(=O)N1CCC[C@@H]1c1cccc(Cl)c1	ZINC000448034260	327283072	/nfs/dbraw/zinc/28/30/72/327283072.db2.gz	GZKWGLBLKRYQEX-OAHLLOKOSA-N	0	0	292.810	4.153	20	30		CIEDRN
CCc1ccc(CC)c(NC(=O)c2ccc(F)c(C#N)c2)c1	ZINC000560090182	327283529	/nfs/dbraw/zinc/28/35/29/327283529.db2.gz	NLQFJEKXNURMGW-UHFFFAOYSA-N	0	0	296.345	4.074	20	30		CIEDRN
C[C@H](CC1CCCCC1)C(=O)N(C1CC1)C1(C#N)CCC1	ZINC000560115994	327284796	/nfs/dbraw/zinc/28/47/96/327284796.db2.gz	GYQDWWBQOASZMP-CQSZACIVSA-N	0	0	288.435	4.030	20	30		CIEDRN
C=Cc1ccc(C(=O)Nc2ccc(C#N)cc2Cl)cc1	ZINC000560110421	327284939	/nfs/dbraw/zinc/28/49/39/327284939.db2.gz	HDRSVDCIBBTLRT-UHFFFAOYSA-N	0	0	282.730	4.107	20	30		CIEDRN
C=CCCCC(=O)NCCCCc1ccc(Cl)s1	ZINC000560133506	327285470	/nfs/dbraw/zinc/28/54/70/327285470.db2.gz	IQCLUAVUBMRSLU-UHFFFAOYSA-N	0	0	285.840	4.197	20	30		CIEDRN
N#Cc1ccc(CSc2ccc(F)cc2F)cc1	ZINC000036961407	327285920	/nfs/dbraw/zinc/28/59/20/327285920.db2.gz	RNNJLMKDJOSJFZ-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
CC1(C)CN(c2cccc(F)c2C#N)[C@@H]1c1cccs1	ZINC000564491423	327291781	/nfs/dbraw/zinc/29/17/81/327291781.db2.gz	HELNBQLGIBSCBE-OAHLLOKOSA-N	0	0	286.375	4.346	20	30		CIEDRN
CC1(C)CN(c2cccc(F)c2C#N)[C@H]1c1cccs1	ZINC000564491417	327291854	/nfs/dbraw/zinc/29/18/54/327291854.db2.gz	HELNBQLGIBSCBE-HNNXBMFYSA-N	0	0	286.375	4.346	20	30		CIEDRN
Cc1ccc(Oc2nnc(C)c(C)c2C#N)c(Cl)c1C	ZINC000560248864	327293630	/nfs/dbraw/zinc/29/36/30/327293630.db2.gz	FOAICKSJXTWAPE-UHFFFAOYSA-N	0	0	287.750	4.028	20	30		CIEDRN
CCCCCCCC(=O)N(CC)[C@@H](C)c1cccnc1	ZINC000115224890	327299705	/nfs/dbraw/zinc/29/97/05/327299705.db2.gz	VBOPROFQROMFFH-HNNXBMFYSA-N	0	0	276.424	4.352	20	30		CIEDRN
C=CCCCNC(=O)N(C)[C@@H](C)c1cc2ccccc2o1	ZINC000448036172	327300831	/nfs/dbraw/zinc/30/08/31/327300831.db2.gz	WDJNABWFJJXLBK-ZDUSSCGKSA-N	0	0	286.375	4.101	20	30		CIEDRN
CC(C)(C)C[C@@H](Nc1cc(C#N)ncn1)c1ccc(F)cc1	ZINC000583359450	327318612	/nfs/dbraw/zinc/31/86/12/327318612.db2.gz	UMKAIICGUSERFJ-OAHLLOKOSA-N	0	0	298.365	4.077	20	30		CIEDRN
CC[C@H](C)CCC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1	ZINC000560549643	327323576	/nfs/dbraw/zinc/32/35/76/327323576.db2.gz	RJPBYRWKTILNNC-SZMVWBNQSA-N	0	0	298.430	4.111	20	30		CIEDRN
N#Cc1ccc(CN2CC[C@@H]2c2ccc(Cl)cc2)s1	ZINC000560586708	327328438	/nfs/dbraw/zinc/32/84/38/327328438.db2.gz	CWQWPLAPFQAMCA-OAHLLOKOSA-N	0	0	288.803	4.220	20	30		CIEDRN
C=C(C)[C@H](NC(=O)C1CC(C)(C)C1)c1ccc(F)c(F)c1	ZINC000560642554	327333534	/nfs/dbraw/zinc/33/35/34/327333534.db2.gz	QTCYVVOBGCBLOB-HNNXBMFYSA-N	0	0	293.357	4.134	20	30		CIEDRN
Cc1cccc2c1CC[C@H]2Nc1ccc(C#N)cc1F	ZINC000560678897	327335617	/nfs/dbraw/zinc/33/56/17/327335617.db2.gz	QPTBUOFRQPLAIZ-MRXNPFEDSA-N	0	0	266.319	4.105	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H]1CCc2sc(Cl)cc21	ZINC000560770331	327342267	/nfs/dbraw/zinc/34/22/67/327342267.db2.gz	QDPXGJMVJYNIPQ-JTQLQIEISA-N	0	0	283.824	4.107	20	30		CIEDRN
C[C@H]1C[C@@H]1c1ccc(CNc2ccc(F)cc2C#N)o1	ZINC000097635460	327345296	/nfs/dbraw/zinc/34/52/96/327345296.db2.gz	CWFNPLXRKCUEKL-HZMBPMFUSA-N	0	0	270.307	4.026	20	30		CIEDRN
CCCC[C@H](CC)CC(=O)NC1(c2cccc(C#N)c2)CC1	ZINC000560843837	327347596	/nfs/dbraw/zinc/34/75/96/327347596.db2.gz	LJYRLKFAQCVLBG-HNNXBMFYSA-N	0	0	298.430	4.270	20	30		CIEDRN
C=CCN(C(=O)N[C@@H](CC)c1cccc(Cl)c1)C1CC1	ZINC000560855530	327348013	/nfs/dbraw/zinc/34/80/13/327348013.db2.gz	PQGASAJORCGYIL-HNNXBMFYSA-N	0	0	292.810	4.151	20	30		CIEDRN
Cc1csc(NC(=O)[C@@]2(C)C[C@@H]2c2ccccc2)c1C#N	ZINC000561020460	327358318	/nfs/dbraw/zinc/35/83/18/327358318.db2.gz	OMIFYDAMVMQMMB-PBHICJAKSA-N	0	0	296.395	4.061	20	30		CIEDRN
Cc1nsc(NCc2ccc(-c3ccccc3)o2)c1C#N	ZINC000561128740	327368204	/nfs/dbraw/zinc/36/82/04/327368204.db2.gz	DSJSCOMMRIDEAZ-UHFFFAOYSA-N	0	0	295.367	4.195	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)CC2(C)CCCC2)cc1	ZINC000583447821	327371958	/nfs/dbraw/zinc/37/19/58/327371958.db2.gz	GJRKROLISHPPTL-UHFFFAOYSA-N	0	0	284.403	4.397	20	30		CIEDRN
C[C@@H]1C[C@@H](CCNc2cccc(C(F)F)c2C#N)CCO1	ZINC000583451040	327373941	/nfs/dbraw/zinc/37/39/41/327373941.db2.gz	IXAHGADRZRJRMU-NEPJUHHUSA-N	0	0	294.345	4.113	20	30		CIEDRN
CCCOc1ccccc1NCc1cccc(F)c1C#N	ZINC000427425012	327374675	/nfs/dbraw/zinc/37/46/75/327374675.db2.gz	SLJUKONWWITMAA-UHFFFAOYSA-N	0	0	284.334	4.098	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccccc1OCC1CC1	ZINC000150833118	327386579	/nfs/dbraw/zinc/38/65/79/327386579.db2.gz	OYTKIDXMUVTDJH-UHFFFAOYSA-N	0	0	285.387	4.182	20	30		CIEDRN
N#Cc1cccc(NCCCCc2ccc(Cl)s2)n1	ZINC000561345679	327387907	/nfs/dbraw/zinc/38/79/07/327387907.db2.gz	GEGPELXXLUWVSJ-UHFFFAOYSA-N	0	0	291.807	4.103	20	30		CIEDRN
C=CCn1c(SCCCC(C)(C)C)nnc1C1CC1	ZINC000561350617	327388251	/nfs/dbraw/zinc/38/82/51/327388251.db2.gz	ZSIMQYOMCXKOSE-UHFFFAOYSA-N	0	0	279.453	4.260	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc(CC(F)(F)F)cc1	ZINC000150849650	327389333	/nfs/dbraw/zinc/38/93/33/327389333.db2.gz	TVVFERFMMOEHQF-UHFFFAOYSA-N	0	0	297.320	4.498	20	30		CIEDRN
CCC[C@@H](CC1CCCCC1)C(=O)NCCCCC#N	ZINC000172004170	327406281	/nfs/dbraw/zinc/40/62/81/327406281.db2.gz	VNJLNHHENQJQAZ-INIZCTEOSA-N	0	0	278.440	4.183	20	30		CIEDRN
C=C(C)CCc1noc(/C=C/c2cc(F)c(F)c(F)c2)n1	ZINC000561930321	327430903	/nfs/dbraw/zinc/43/09/03/327430903.db2.gz	VVXGFIATNOLSRB-GQCTYLIASA-N	0	0	294.276	4.166	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@@H](c2ccc(CC)cc2)C1	ZINC000562114798	327450894	/nfs/dbraw/zinc/45/08/94/327450894.db2.gz	CJFOVYWXJJUCNJ-LJQANCHMSA-N	0	0	297.442	4.333	20	30		CIEDRN
CCC(C)(C)C1CCC(NC(=O)CC(C)(C)C#N)CC1	ZINC000562186925	327454793	/nfs/dbraw/zinc/45/47/93/327454793.db2.gz	DNRKGHDOKBPTGK-UHFFFAOYSA-N	0	0	278.440	4.037	20	30		CIEDRN
Cc1cc(NCc2cc(C#N)cs2)c2cccnc2c1C	ZINC000151894423	327520876	/nfs/dbraw/zinc/52/08/76/327520876.db2.gz	YCYFDSRAEOZNBG-UHFFFAOYSA-N	0	0	293.395	4.397	20	30		CIEDRN
Cc1nc(SCC#Cc2cccc(Cl)c2)oc1C	ZINC000159544552	327533249	/nfs/dbraw/zinc/53/32/49/327533249.db2.gz	JSSBEEYKMYLATA-UHFFFAOYSA-N	0	0	277.776	4.089	20	30		CIEDRN
CC(C)[C@](C)(C#N)NC(=O)c1ccc(C2CCCC2)cc1	ZINC000569703389	327538182	/nfs/dbraw/zinc/53/81/82/327538182.db2.gz	XWSCPHAPRYUGKU-SFHVURJKSA-N	0	0	284.403	4.012	20	30		CIEDRN
CC(C)c1ccccc1N(C)C(=O)C1(C#N)CCCCC1	ZINC000570082676	327568482	/nfs/dbraw/zinc/56/84/82/327568482.db2.gz	OMVRHBOTSYCQOJ-UHFFFAOYSA-N	0	0	284.403	4.247	20	30		CIEDRN
CC[C@@H]1CCCC[C@@H]1c1noc(Cc2ccc(C#N)cc2)n1	ZINC000570112034	327570366	/nfs/dbraw/zinc/57/03/66/327570366.db2.gz	HUPBMAJEKKNLOU-CVEARBPZSA-N	0	0	295.386	4.216	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(Cl)cc1OC(F)F	ZINC000186002486	327610016	/nfs/dbraw/zinc/61/00/16/327610016.db2.gz	XLYGMTCYBYDBHY-UHFFFAOYSA-N	0	0	289.709	4.236	20	30		CIEDRN
C=C1CCN(Cc2csc(-c3ccccc3F)n2)CC1	ZINC000583581411	328621272	/nfs/dbraw/zinc/62/12/72/328621272.db2.gz	MPROKCPIPVDEHU-UHFFFAOYSA-N	0	0	288.391	4.101	20	30		CIEDRN
Nc1ccc(SCC#Cc2ccccc2)c(Cl)c1	ZINC000051814540	328635310	/nfs/dbraw/zinc/63/53/10/328635310.db2.gz	UVJHEMLLTUOBSC-UHFFFAOYSA-N	0	0	273.788	4.066	20	30		CIEDRN
Cc1cccc(Cl)c1OCc1cccc(C#N)c1	ZINC000536116322	328656956	/nfs/dbraw/zinc/65/69/56/328656956.db2.gz	FLFDCFKKFNOCCR-UHFFFAOYSA-N	0	0	257.720	4.099	20	30		CIEDRN
Cc1ccc(C)c(OCCCOc2ccccc2C#N)c1	ZINC000034652293	328684318	/nfs/dbraw/zinc/68/43/18/328684318.db2.gz	CBJOHVAUIHFANX-UHFFFAOYSA-N	0	0	281.355	4.023	20	30		CIEDRN
Cc1ccc(OCCCOc2cccc(C#N)c2)cc1C	ZINC000034653042	328684353	/nfs/dbraw/zinc/68/43/53/328684353.db2.gz	IQOKWFNLEULDSC-UHFFFAOYSA-N	0	0	281.355	4.023	20	30		CIEDRN
C=CCN(C(=O)N[C@H](C)c1cccc2ccccc21)C1CC1	ZINC000536747604	328687677	/nfs/dbraw/zinc/68/76/77/328687677.db2.gz	FGHFXSQYXGJISG-CQSZACIVSA-N	0	0	294.398	4.261	20	30		CIEDRN
C=C(C)CSCc1coc(-c2c(F)cccc2F)n1	ZINC000507614349	332816971	/nfs/dbraw/zinc/81/69/71/332816971.db2.gz	HNIWRYFNUQQWKA-UHFFFAOYSA-N	0	0	281.327	4.429	20	30		CIEDRN
N#Cc1ccc(F)c(CNc2ccc(Cl)cc2F)c1	ZINC000042336096	328763681	/nfs/dbraw/zinc/76/36/81/328763681.db2.gz	AEQWVLLIAPRHDY-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C=CCC[C@@H](NC(=O)N(C)C[C@@H](C)CC)c1ccccc1	ZINC000532495173	328782341	/nfs/dbraw/zinc/78/23/41/328782341.db2.gz	VQBHZLWWONYDHZ-DOTOQJQBSA-N	0	0	288.435	4.381	20	30		CIEDRN
Cc1c(F)cccc1N[C@@H](C)c1ccc(C#N)cc1	ZINC000043319468	328786587	/nfs/dbraw/zinc/78/65/87/328786587.db2.gz	VBKATRURPLQJMU-LBPRGKRZSA-N	0	0	254.308	4.179	20	30		CIEDRN
C=CCCSc1nnc(-c2ccc(C)cc2)n1CC=C	ZINC000532628555	328798131	/nfs/dbraw/zinc/79/81/31/328798131.db2.gz	MXNHNEUWYUKTHR-UHFFFAOYSA-N	0	0	285.416	4.108	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)C[C@@H]1CCCC[C@@H]1C	ZINC000532737101	328807752	/nfs/dbraw/zinc/80/77/52/328807752.db2.gz	GEXQCVWXCWCPNB-JSGCOSHPSA-N	0	0	270.376	4.022	20	30		CIEDRN
C[C@@H](C#N)CN(Cc1c(Cl)cccc1Cl)C1CC1	ZINC000532819104	328812298	/nfs/dbraw/zinc/81/22/98/328812298.db2.gz	XHHSOJMJFBLLKN-JTQLQIEISA-N	0	0	283.202	4.117	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cccc(CSC)c1	ZINC000526947298	328816528	/nfs/dbraw/zinc/81/65/28/328816528.db2.gz	VGBYXWRNZJSPFK-HNNXBMFYSA-N	0	0	263.406	4.090	20	30		CIEDRN
C=CCN(Cc1ccc(C(F)F)cc1)CC(F)(F)F	ZINC000526970258	328818016	/nfs/dbraw/zinc/81/80/16/328818016.db2.gz	NCARFXUMFHOONM-UHFFFAOYSA-N	0	0	279.252	4.175	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cccc(CSC)c2)CC1	ZINC000526996385	328820047	/nfs/dbraw/zinc/82/00/47/328820047.db2.gz	ZUHKPKUVKNDSAU-UHFFFAOYSA-N	0	0	275.417	4.235	20	30		CIEDRN
N#Cc1cc(N[C@@H](c2ccccc2)C2CC2)ccc1[N+](=O)[O-]	ZINC000302156471	328830873	/nfs/dbraw/zinc/83/08/73/328830873.db2.gz	FGHPPWBEOKQHDP-KRWDZBQOSA-N	0	0	293.326	4.030	20	30		CIEDRN
CC[C@@H](CC#N)Nc1cnc2cc(Cl)c(Cl)cc2n1	ZINC000302180991	328831602	/nfs/dbraw/zinc/83/16/02/328831602.db2.gz	YLWHXZWOFFAZLU-QMMMGPOBSA-N	0	0	295.173	4.041	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@H](C)c1ccccc1SC	ZINC000507797441	332824432	/nfs/dbraw/zinc/82/44/32/332824432.db2.gz	ZBWPRVVXAJWCCX-CYBMUJFWSA-N	0	0	292.448	4.077	20	30		CIEDRN
C=C(C)CCS[C@@H](C)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000507802674	332824721	/nfs/dbraw/zinc/82/47/21/332824721.db2.gz	WELBGFVWLPDZKC-KBPBESRZSA-N	0	0	289.444	4.052	20	30		CIEDRN
C=C(C)CCSCC(=O)Nc1ccc(C)cc1Cl	ZINC000507805349	332824857	/nfs/dbraw/zinc/82/48/57/332824857.db2.gz	UZEGPLNNRSZQLM-UHFFFAOYSA-N	0	0	283.824	4.286	20	30		CIEDRN
C=C(C)COc1cccc(NCc2cccc(OCC)n2)c1	ZINC000532887021	328846640	/nfs/dbraw/zinc/84/66/40/328846640.db2.gz	BSNCXVLZZAFDOW-UHFFFAOYSA-N	0	0	298.386	4.047	20	30		CIEDRN
C=C(C)CCS[C@@H](C)C(=O)Nc1cccc(C)c1C	ZINC000507819662	332826149	/nfs/dbraw/zinc/82/61/49/332826149.db2.gz	RWNHGPDVDBFDGE-AWEZNQCLSA-N	0	0	277.433	4.330	20	30		CIEDRN
C=C(C)CCS[C@@H](C)C(=O)Nc1cc(C)cc(C)c1	ZINC000507817511	332826170	/nfs/dbraw/zinc/82/61/70/332826170.db2.gz	APKPUSPFYGIYHP-AWEZNQCLSA-N	0	0	277.433	4.330	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cc(CSCC)ccn2)CC1	ZINC000356618684	328863085	/nfs/dbraw/zinc/86/30/85/328863085.db2.gz	GQYCQDBKWSMEEH-UHFFFAOYSA-N	0	0	290.432	4.020	20	30		CIEDRN
C=C(C)CCSCc1nnc(-c2ccc(C)cc2)o1	ZINC000507833120	332826986	/nfs/dbraw/zinc/82/69/86/332826986.db2.gz	JZWPWKROOUYYDK-UHFFFAOYSA-N	0	0	274.389	4.244	20	30		CIEDRN
N#Cc1ccc(F)cc1CSCc1ncc(Cl)s1	ZINC000358660712	328889879	/nfs/dbraw/zinc/88/98/79/328889879.db2.gz	LYWMZRJZCANMND-UHFFFAOYSA-N	0	0	298.795	4.241	20	30		CIEDRN
C=C(C)CCS[C@H](C)C(=O)Nc1ccc(Cl)cc1	ZINC000507860050	332828149	/nfs/dbraw/zinc/82/81/49/332828149.db2.gz	NUWKFOZDMGEQNY-LLVKDONJSA-N	0	0	283.824	4.366	20	30		CIEDRN
C[C@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)CCCC#N	ZINC000359986574	328900915	/nfs/dbraw/zinc/90/09/15/328900915.db2.gz	SEKNMCNQMRXDQK-SNVBAGLBSA-N	0	0	299.201	4.207	20	30		CIEDRN
N#Cc1ccccc1NC(=O)c1ccc(F)c2ccccc12	ZINC000389543998	328944277	/nfs/dbraw/zinc/94/42/77/328944277.db2.gz	MIYILDVGHSOCJP-UHFFFAOYSA-N	0	0	290.297	4.103	20	30		CIEDRN
C[C@H](CCOCc1ccccc1)Nc1cccc(F)c1C#N	ZINC000390190448	328966180	/nfs/dbraw/zinc/96/61/80/328966180.db2.gz	NDYXVALNPAOSOJ-CQSZACIVSA-N	0	0	298.361	4.105	20	30		CIEDRN
C=CCCC(=O)N1CCC(F)(c2cccc(Cl)c2)CC1	ZINC000375997988	329006152	/nfs/dbraw/zinc/00/61/52/329006152.db2.gz	DORKLTHSZJKTMG-UHFFFAOYSA-N	0	0	295.785	4.093	20	30		CIEDRN
C=CCCC(=O)N(C)[C@@H](C)c1cccc(-c2ccncc2)c1	ZINC000377814367	329030308	/nfs/dbraw/zinc/03/03/08/329030308.db2.gz	NNNQHALMMOKLPA-HNNXBMFYSA-N	0	0	294.398	4.234	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@H](c2ccc(C)cc2)C1	ZINC000378647479	329058028	/nfs/dbraw/zinc/05/80/28/329058028.db2.gz	IYUHDIRFGZXAHT-SFHVURJKSA-N	0	0	283.415	4.079	20	30		CIEDRN
C[C@@H](Nc1cccc(-c2cnco2)c1)c1cccc(C#N)c1	ZINC000193911023	329063606	/nfs/dbraw/zinc/06/36/06/329063606.db2.gz	UICIFJYROZOOEW-CYBMUJFWSA-N	0	0	289.338	4.386	20	30		CIEDRN
C[C@H](Nc1cccc(-c2cnco2)c1)c1cccc(C#N)c1	ZINC000193911007	329063834	/nfs/dbraw/zinc/06/38/34/329063834.db2.gz	UICIFJYROZOOEW-ZDUSSCGKSA-N	0	0	289.338	4.386	20	30		CIEDRN
CC(C)[C@H](CC(=O)NC1(C#N)CCCCC1)c1ccccc1	ZINC000171296065	329073698	/nfs/dbraw/zinc/07/36/98/329073698.db2.gz	ABOIEFPTYJVEOW-KRWDZBQOSA-N	0	0	298.430	4.159	20	30		CIEDRN
COc1ccc([C@@H](Nc2nccc(C)c2C#N)C(C)C)cc1	ZINC000582568607	329109316	/nfs/dbraw/zinc/10/93/16/329109316.db2.gz	BKFSUMXEUTYBHD-KRWDZBQOSA-N	0	0	295.386	4.080	20	30		CIEDRN
C=C(C)CCc1noc([C@@H](C)c2cccc(Cl)c2)n1	ZINC000508595375	332842788	/nfs/dbraw/zinc/84/27/88/332842788.db2.gz	MTYIVDKCQIIBNK-NSHDSACASA-N	0	0	276.767	4.384	20	30		CIEDRN
C=C(C)CCc1noc([C@H](C)Cc2ccccc2F)n1	ZINC000508598604	332843256	/nfs/dbraw/zinc/84/32/56/332843256.db2.gz	HXJGIOYNTJKLFX-GFCCVEGCSA-N	0	0	274.339	4.064	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@H]1c1ccccc1Cl	ZINC000175373561	329164538	/nfs/dbraw/zinc/16/45/38/329164538.db2.gz	SDPJFBGNPHGXGI-HNNXBMFYSA-N	0	0	277.795	4.360	20	30		CIEDRN
C=CCCCC(=O)N1C[C@H](C)C[C@@H]1c1cccc(F)c1	ZINC000175964690	329170879	/nfs/dbraw/zinc/17/08/79/329170879.db2.gz	KVNCDOUMSNMQML-CZUORRHYSA-N	0	0	275.367	4.092	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)c1cscc1C	ZINC000176112395	329173936	/nfs/dbraw/zinc/17/39/36/329173936.db2.gz	GXUQBTKOBPTFBT-UHFFFAOYSA-N	0	0	289.375	4.024	20	30		CIEDRN
Cc1ccccc1[C@@H](C)CC(=O)N[C@H](C#N)C1CCCCC1	ZINC000176597020	329177103	/nfs/dbraw/zinc/17/71/03/329177103.db2.gz	QKJKNWSVNAMSRM-MAUKXSAKSA-N	0	0	298.430	4.077	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)N[C@@H]2CCCC2(C)C)cc1	ZINC000176853017	329179269	/nfs/dbraw/zinc/17/92/69/329179269.db2.gz	XPYQXRKUFLQMBJ-OAHLLOKOSA-N	0	0	299.418	4.188	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1ccc2nc(C3CC3)oc2c1	ZINC000177189485	329180568	/nfs/dbraw/zinc/18/05/68/329180568.db2.gz	FVNZJCRHULZJNI-UHFFFAOYSA-N	0	0	299.374	4.135	20	30		CIEDRN
C[C@H](c1ccc(Cl)cc1)[S@@](=O)CCCC(C)(C)C#N	ZINC000177112660	329181053	/nfs/dbraw/zinc/18/10/53/329181053.db2.gz	TXHSYTWFNYSDLE-BLVKFPJESA-N	0	0	297.851	4.480	20	30		CIEDRN
C[C@@H](c1ccc(Cl)cc1)[S@](=O)CCCC(C)(C)C#N	ZINC000177112678	329181133	/nfs/dbraw/zinc/18/11/33/329181133.db2.gz	TXHSYTWFNYSDLE-HXPMCKFVSA-N	0	0	297.851	4.480	20	30		CIEDRN
C[C@H](c1ccc(Cl)cc1)[S@](=O)CCCC(C)(C)C#N	ZINC000177112696	329181168	/nfs/dbraw/zinc/18/11/68/329181168.db2.gz	TXHSYTWFNYSDLE-CWTRNNRKSA-N	0	0	297.851	4.480	20	30		CIEDRN
C=CCCCC(=O)N(C)[C@@H](C)c1nc2ccccc2s1	ZINC000177475999	329183715	/nfs/dbraw/zinc/18/37/15/329183715.db2.gz	SXYCRKWRIIURNK-LBPRGKRZSA-N	0	0	288.416	4.172	20	30		CIEDRN
C=CCCCC(=O)Nc1ccccc1CC(F)(F)F	ZINC000177895319	329187113	/nfs/dbraw/zinc/18/71/13/329187113.db2.gz	HBTGXOMROZTDAH-UHFFFAOYSA-N	0	0	271.282	4.086	20	30		CIEDRN
C=CCCCC(=O)Nc1cnn(-c2cc(C)ccc2C)c1C	ZINC000178667672	329201012	/nfs/dbraw/zinc/20/10/12/329201012.db2.gz	MHMJRWTZRRRVMM-UHFFFAOYSA-N	0	0	297.402	4.092	20	30		CIEDRN
C#CCCCCC(=O)N1CCC[C@H]1c1ccc(Cl)cc1	ZINC000179721937	329207693	/nfs/dbraw/zinc/20/76/93/329207693.db2.gz	QAEZWDFPQNUGPY-INIZCTEOSA-N	0	0	289.806	4.197	20	30		CIEDRN
C#CCCCCC(=O)N[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000179731497	329207862	/nfs/dbraw/zinc/20/78/62/329207862.db2.gz	ZFLWMZAGVUQHQV-GFCCVEGCSA-N	0	0	297.320	4.076	20	30		CIEDRN
C=C(C)CCc1noc(Cc2cccc(C(F)(F)F)c2)n1	ZINC000508663073	332846607	/nfs/dbraw/zinc/84/66/07/332846607.db2.gz	FODZZIPTNNEHQG-UHFFFAOYSA-N	0	0	296.292	4.188	20	30		CIEDRN
C=C(C)CCc1noc(CCCc2c[nH]c3ccccc23)n1	ZINC000508671457	332846864	/nfs/dbraw/zinc/84/68/64/332846864.db2.gz	MGKJUCYLWZMCOE-UHFFFAOYSA-N	0	0	295.386	4.235	20	30		CIEDRN
C=C(C)CCc1noc([C@H]2CCCc3sccc32)n1	ZINC000508685085	332847252	/nfs/dbraw/zinc/84/72/52/332847252.db2.gz	FDZROARZQLWUTK-LBPRGKRZSA-N	0	0	274.389	4.108	20	30		CIEDRN
C=C(C)CCc1noc(CC[C@@H](C)c2ccccc2)n1	ZINC000508682418	332847278	/nfs/dbraw/zinc/84/72/78/332847278.db2.gz	WGXIGFGTBHCXOV-CQSZACIVSA-N	0	0	270.376	4.315	20	30		CIEDRN
C=C(C)CCc1noc([C@@H]2C[C@@]23CCCc2ccccc23)n1	ZINC000508687214	332847562	/nfs/dbraw/zinc/84/75/62/332847562.db2.gz	RCPAKVSCEVHDNT-QFBILLFUSA-N	0	0	294.398	4.340	20	30		CIEDRN
C=C(C)CCc1noc([C@@H](C)c2c(F)cccc2F)n1	ZINC000508688430	332847655	/nfs/dbraw/zinc/84/76/55/332847655.db2.gz	WYKONNACBIYUKU-JTQLQIEISA-N	0	0	278.302	4.008	20	30		CIEDRN
N#CCCCCNc1cnc2cc(Cl)c(Cl)cc2n1	ZINC000181561258	329234516	/nfs/dbraw/zinc/23/45/16/329234516.db2.gz	RPRQAPJHFZNZER-UHFFFAOYSA-N	0	0	295.173	4.042	20	30		CIEDRN
CC[C@@H](CC#N)NCc1ccc(-c2c(F)cccc2F)o1	ZINC000184094634	329256180	/nfs/dbraw/zinc/25/61/80/329256180.db2.gz	HTFSURQICPBVNC-NSHDSACASA-N	0	0	290.313	4.007	20	30		CIEDRN
CC[C@H](CC#N)NCc1cc(C(F)(F)F)ccc1Cl	ZINC000184090517	329256274	/nfs/dbraw/zinc/25/62/74/329256274.db2.gz	UMOBZFQMXKVHFB-LLVKDONJSA-N	0	0	290.716	4.141	20	30		CIEDRN
CC[C@@H](CC#N)NCc1cc(C(F)(F)F)ccc1Cl	ZINC000184090500	329256255	/nfs/dbraw/zinc/25/62/55/329256255.db2.gz	UMOBZFQMXKVHFB-NSHDSACASA-N	0	0	290.716	4.141	20	30		CIEDRN
Cc1csc(C(C#N)=C([O-])c2ccc(C(C)C)s2)n1	ZINC000184547916	329259678	/nfs/dbraw/zinc/25/96/78/329259678.db2.gz	IYYDHMJKLGGVGB-SNVBAGLBSA-N	0	0	290.413	4.127	20	30		CIEDRN
CSc1cccc(N(C)CC(C)(C)CCC#N)c1	ZINC000184750158	329261071	/nfs/dbraw/zinc/26/10/71/329261071.db2.gz	KASIKPQPFBRYQW-UHFFFAOYSA-N	0	0	262.422	4.175	20	30		CIEDRN
N#Cc1cc(Cl)ccc1CSCc1nccs1	ZINC000184831456	329263186	/nfs/dbraw/zinc/26/31/86/329263186.db2.gz	FVBCQGPZUTXASO-UHFFFAOYSA-N	0	0	280.805	4.102	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H]1CCSc2c(F)cccc21	ZINC000185076503	329267866	/nfs/dbraw/zinc/26/78/66/329267866.db2.gz	QFDIKRJZOSTRLX-FZMZJTMJSA-N	0	0	293.407	4.081	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCc1oc2ccc(F)cc2c1C	ZINC000185271315	329269865	/nfs/dbraw/zinc/26/98/65/329269865.db2.gz	AXLAZKFOIPZNCB-NSHDSACASA-N	0	0	289.350	4.099	20	30		CIEDRN
CC1(C#N)CCN(Cc2c(Cl)cccc2Cl)CC1	ZINC000227351714	329272245	/nfs/dbraw/zinc/27/22/45/329272245.db2.gz	HIKQHTRVDHJHGB-UHFFFAOYSA-N	0	0	283.202	4.119	20	30		CIEDRN
C=CCCc1nc(C(C)(C)c2ccc(Cl)cc2)no1	ZINC000582931467	329286525	/nfs/dbraw/zinc/28/65/25/329286525.db2.gz	WEDLIRQUNJNTML-UHFFFAOYSA-N	0	0	276.767	4.168	20	30		CIEDRN
N#Cc1csc(CNc2cccc3ccsc32)c1	ZINC000395401300	329289215	/nfs/dbraw/zinc/28/92/15/329289215.db2.gz	ANQRSNAETJTWAF-UHFFFAOYSA-N	0	0	270.382	4.447	20	30		CIEDRN
N#Cc1ccc(C(F)(F)F)nc1N[C@@H]1CC12CCCCC2	ZINC000395654298	329293920	/nfs/dbraw/zinc/29/39/20/329293920.db2.gz	UPJNGHCEFNSXSE-GFCCVEGCSA-N	0	0	295.308	4.107	20	30		CIEDRN
N#Cc1ccc(CNc2ccc(-c3ccccn3)cc2)cc1	ZINC000583056371	329304918	/nfs/dbraw/zinc/30/49/18/329304918.db2.gz	KBLQZHHGVPBACE-UHFFFAOYSA-N	0	0	285.350	4.232	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1C[C@@H](c2ccc(C)cc2)C[C@@H]1C	ZINC000508895913	332852192	/nfs/dbraw/zinc/85/21/92/332852192.db2.gz	YHWIHGWJXYIZAD-RDJZCZTQSA-N	0	0	285.431	4.302	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1ccc2c(c1)CCCC2=O	ZINC000583158988	329324675	/nfs/dbraw/zinc/32/46/75/329324675.db2.gz	SVYNRFAICGENKV-UHFFFAOYSA-N	0	0	299.414	4.024	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc2[nH]c(C(F)F)nc2c1	ZINC000189036055	329374822	/nfs/dbraw/zinc/37/48/22/329374822.db2.gz	CYBSFVOVSHHCDP-HNNXBMFYSA-N	0	0	293.317	4.041	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc3nc(C4CC4)oc3c2)CCC1	ZINC000189028733	329375106	/nfs/dbraw/zinc/37/51/06/329375106.db2.gz	IPODFJGUCDPBAN-UHFFFAOYSA-N	0	0	296.370	4.390	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)Cc1cncc(C)c1	ZINC000189754902	329385572	/nfs/dbraw/zinc/38/55/72/329385572.db2.gz	RPGIZZMVFJCXDJ-UHFFFAOYSA-N	0	0	292.835	4.293	20	30		CIEDRN
C=CCC1(C(=O)Nc2cccc(-c3ncco3)c2)CCC1	ZINC000189750364	329385577	/nfs/dbraw/zinc/38/55/77/329385577.db2.gz	UJSGPZDOJBIEDU-UHFFFAOYSA-N	0	0	282.343	4.027	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)SC	ZINC000189888140	329388748	/nfs/dbraw/zinc/38/87/48/329388748.db2.gz	SXCNZUFKUXQHKM-LBPRGKRZSA-N	0	0	277.433	4.229	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)CCOC(C)C	ZINC000189910514	329389894	/nfs/dbraw/zinc/38/98/94/329389894.db2.gz	WUSPLFOCQTZWBA-UHFFFAOYSA-N	0	0	289.419	4.292	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1ccco1	ZINC000189903280	329390060	/nfs/dbraw/zinc/39/00/60/329390060.db2.gz	ZGQACCPDLKTADE-UHFFFAOYSA-N	0	0	269.344	4.384	20	30		CIEDRN
Cc1ccc(Cl)cc1NC(=O)c1cccc(C#N)c1C	ZINC000509036657	332856939	/nfs/dbraw/zinc/85/69/39/332856939.db2.gz	XAVQWYIEKCNJPK-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
C=CCC1(C(=O)N(C)Cc2ccccc2Cl)CCC1	ZINC000190559673	329399176	/nfs/dbraw/zinc/39/91/76/329399176.db2.gz	GQQIXWSTAOMOFK-UHFFFAOYSA-N	0	0	277.795	4.045	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NCc1nc(C2CC2)no1	ZINC000190912324	329402893	/nfs/dbraw/zinc/40/28/93/329402893.db2.gz	CCFVKBINODAAMO-UHFFFAOYSA-N	0	0	297.402	4.411	20	30		CIEDRN
N#Cc1cccc(SC[C@H]2CCCC(F)(F)C2)c1	ZINC000509074209	332858352	/nfs/dbraw/zinc/85/83/52/332858352.db2.gz	HRVZCVDLIIFIGL-LBPRGKRZSA-N	0	0	267.344	4.476	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)c1ccc(C2CCC2)cc1	ZINC000191954259	329422839	/nfs/dbraw/zinc/42/28/39/329422839.db2.gz	NTHWDCUEOFUFAA-UHFFFAOYSA-N	0	0	298.430	4.499	20	30		CIEDRN
Cc1ccc(SCc2ccc(CC#N)cc2)cc1	ZINC000398999355	329447190	/nfs/dbraw/zinc/44/71/90/329447190.db2.gz	AXZPWINBJLFRBT-UHFFFAOYSA-N	0	0	253.370	4.353	20	30		CIEDRN
CC(C)(C)c1cnc(SCC(C)(C)CC#N)o1	ZINC000584422143	329466515	/nfs/dbraw/zinc/46/65/15/329466515.db2.gz	NSYWTNMGFJXUEE-UHFFFAOYSA-N	0	0	252.383	4.004	20	30		CIEDRN
C=CCCCNc1ccccc1O[C@H](C)C(F)(F)F	ZINC000583777981	329476864	/nfs/dbraw/zinc/47/68/64/329476864.db2.gz	XHQFJYCRAMVQQN-LLVKDONJSA-N	0	0	273.298	4.394	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1cc(CC)c(CCC)s1	ZINC000301993671	332864451	/nfs/dbraw/zinc/86/44/51/332864451.db2.gz	BZXDEKVNVXUUBV-UHFFFAOYSA-N	0	0	279.449	4.301	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(Cl)cc2COC)CC1	ZINC000425631446	329574474	/nfs/dbraw/zinc/57/44/74/329574474.db2.gz	IRASSWUURLCFHR-UHFFFAOYSA-N	0	0	293.794	4.171	20	30		CIEDRN
CCCC(C)(C)CC(=O)N(C)[C@H](C)c1cccc(C#N)c1	ZINC000425113650	329596600	/nfs/dbraw/zinc/59/66/00/329596600.db2.gz	RERZNJWHHVRGCB-CQSZACIVSA-N	0	0	286.419	4.294	20	30		CIEDRN
C[C@@H](c1cccc(C#N)c1)N(C)C(=O)[C@@H]1CC12CCCCC2	ZINC000425119908	329597641	/nfs/dbraw/zinc/59/76/41/329597641.db2.gz	AJBMOBJXPIIBBZ-YOEHRIQHSA-N	0	0	296.414	4.048	20	30		CIEDRN
CC(C)C[C@@H](C)CC(=O)N(C)[C@@H](C)c1cccc(C#N)c1	ZINC000425137408	329606989	/nfs/dbraw/zinc/60/69/89/329606989.db2.gz	XPVUIOZWXWYAAR-CABCVRRESA-N	0	0	286.419	4.150	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N(C)C/C(C)=C/c1ccccc1	ZINC000424796936	329613319	/nfs/dbraw/zinc/61/33/19/329613319.db2.gz	DNUQBKZCNBPTNX-NTCAYCPXSA-N	0	0	271.404	4.151	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@@H]1CC[C@H](c2cccc(F)c2)C1	ZINC000424814958	329615504	/nfs/dbraw/zinc/61/55/04/329615504.db2.gz	VHZSDTWVHDTAQY-GOEBONIOSA-N	0	0	289.394	4.180	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccccc1C(F)F	ZINC000425692099	329629995	/nfs/dbraw/zinc/62/99/95/329629995.db2.gz	LGJHVEFUVNSKKO-UHFFFAOYSA-N	0	0	268.307	4.054	20	30		CIEDRN
CCC(C)(C)c1ccc(NC(=O)N[C@@H]2CC[C@H](C#N)C2)cc1	ZINC000425685826	329631032	/nfs/dbraw/zinc/63/10/32/329631032.db2.gz	UPSKZLDNBMVPMA-XJKSGUPXSA-N	0	0	299.418	4.188	20	30		CIEDRN
Cc1ccc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1F	ZINC000025439010	329682636	/nfs/dbraw/zinc/68/26/36/329682636.db2.gz	TZDUWAKRKGNFPH-UHFFFAOYSA-N	0	0	296.345	4.188	20	30		CIEDRN
N#Cc1ccc(SCc2cccc(C(F)(F)F)c2)nc1	ZINC000498156675	329684859	/nfs/dbraw/zinc/68/48/59/329684859.db2.gz	KXGZKWSKHCSREM-UHFFFAOYSA-N	0	0	294.301	4.264	20	30		CIEDRN
N#CC1(CCOc2ccc3[nH]ccc3c2)CCCCC1	ZINC000418955139	329702017	/nfs/dbraw/zinc/70/20/17/329702017.db2.gz	UOYJVHAEBMQJEB-UHFFFAOYSA-N	0	0	268.360	4.411	20	30		CIEDRN
C[C@@H](Nc1cc(C#N)ccn1)c1ccc(C2CC2)cc1	ZINC000419010613	329705661	/nfs/dbraw/zinc/70/56/61/329705661.db2.gz	YDTMGELFMUOIGW-GFCCVEGCSA-N	0	0	263.344	4.004	20	30		CIEDRN
CCCc1nc(CSCC2(C#N)CCC2)cs1	ZINC000419384426	329726237	/nfs/dbraw/zinc/72/62/37/329726237.db2.gz	MOZMSHPAXHVPEN-UHFFFAOYSA-N	0	0	266.435	4.023	20	30		CIEDRN
C=CCS[C@@H](C)c1nnc(-c2ccc(C)c(C)c2)o1	ZINC000419411627	329724681	/nfs/dbraw/zinc/72/46/81/329724681.db2.gz	QDPNAQICPIIEKI-LBPRGKRZSA-N	0	0	274.389	4.334	20	30		CIEDRN
N#CC1(CCSCC2CCOCC2)CCCCC1	ZINC000419414974	329725084	/nfs/dbraw/zinc/72/50/84/329725084.db2.gz	FMPAKGAZWYDPIK-UHFFFAOYSA-N	0	0	267.438	4.010	20	30		CIEDRN
C=C(C)CS[C@@H](C)c1nnc(-c2ccc(C)cc2)o1	ZINC000419414883	329725125	/nfs/dbraw/zinc/72/51/25/329725125.db2.gz	HHRGFJSDFYXXOL-LBPRGKRZSA-N	0	0	274.389	4.415	20	30		CIEDRN
C[C@H](SCCOCC1CCC1)c1ccc(C#N)cc1	ZINC000419428986	329728365	/nfs/dbraw/zinc/72/83/65/329728365.db2.gz	UFBSPDCJPGOPPO-ZDUSSCGKSA-N	0	0	275.417	4.169	20	30		CIEDRN
N#CC1(CSCc2cc3ccccc3o2)CCC1	ZINC000419433590	329728564	/nfs/dbraw/zinc/72/85/64/329728564.db2.gz	IENBYQFQDULKGQ-UHFFFAOYSA-N	0	0	257.358	4.360	20	30		CIEDRN
Cc1ccccc1[C@@H](C)SCc1nc(C#N)cs1	ZINC000419444889	329729751	/nfs/dbraw/zinc/72/97/51/329729751.db2.gz	UHUZUMWWLFSGFR-LLVKDONJSA-N	0	0	274.414	4.318	20	30		CIEDRN
N#CC1(CCSCC[C@@H]2CCCO2)CCCCC1	ZINC000419461091	329731538	/nfs/dbraw/zinc/73/15/38/329731538.db2.gz	HCSBVIVRYPUKAT-AWEZNQCLSA-N	0	0	267.438	4.153	20	30		CIEDRN
CC(C)c1ccc([C@H](C)SCc2ncc(C#N)cn2)cc1	ZINC000419461463	329731678	/nfs/dbraw/zinc/73/16/78/329731678.db2.gz	KQQNXYDBCJKBRK-ZDUSSCGKSA-N	0	0	297.427	4.466	20	30		CIEDRN
Cc1cnc([C@H](C)SCCC2(C#N)CCCCC2)cn1	ZINC000419500405	329732591	/nfs/dbraw/zinc/73/25/91/329732591.db2.gz	ZVXQBBMNIAVJJL-AWEZNQCLSA-N	0	0	289.448	4.443	20	30		CIEDRN
CC(=O)c1cccc(CSCCCC(C)(C)C#N)c1	ZINC000419513321	329734183	/nfs/dbraw/zinc/73/41/83/329734183.db2.gz	ZENNARSSCQVOIH-UHFFFAOYSA-N	0	0	275.417	4.452	20	30		CIEDRN
N#CC1(CSCc2sccc2Cl)CCC1	ZINC000419590772	329741704	/nfs/dbraw/zinc/74/17/04/329741704.db2.gz	KLHNSHVAJSJJBX-UHFFFAOYSA-N	0	0	257.811	4.329	20	30		CIEDRN
CC(C)(C#N)CCCSCCOCC1CCCC1	ZINC000419597298	329742321	/nfs/dbraw/zinc/74/23/21/329742321.db2.gz	GNZYCZOCCPNMOC-UHFFFAOYSA-N	0	0	269.454	4.256	20	30		CIEDRN
CC(C)CSCCCSCc1nc(C#N)cs1	ZINC000419656507	329743904	/nfs/dbraw/zinc/74/39/04/329743904.db2.gz	XBDTXQWPBCRNQB-UHFFFAOYSA-N	0	0	286.491	4.027	20	30		CIEDRN
Cc1c(C#N)c(C#N)ccc1NC(=O)CC1(C)CCCCC1	ZINC000421553308	329845494	/nfs/dbraw/zinc/84/54/94/329845494.db2.gz	DOYHTXMZAQYYQF-UHFFFAOYSA-N	0	0	295.386	4.037	20	30		CIEDRN
C[C@@H](Oc1cc(F)ccc1Cl)c1cccc(C#N)c1	ZINC000509747976	332880746	/nfs/dbraw/zinc/88/07/46/332880746.db2.gz	YOHHQIMEBITAIQ-SNVBAGLBSA-N	0	0	275.710	4.491	20	30		CIEDRN
Cc1ccc(Cl)cc1C(=O)N[C@H](C)c1ccc(C#N)cc1	ZINC000509838515	332883827	/nfs/dbraw/zinc/88/38/27/332883827.db2.gz	VYSOUCXATBZHQK-GFCCVEGCSA-N	0	0	298.773	4.011	20	30		CIEDRN
Cc1csc(NC(=O)c2ccc(C3CCC3)cc2)c1C#N	ZINC000571719622	329912422	/nfs/dbraw/zinc/91/24/22/329912422.db2.gz	UWFPMIMKCMDHPO-UHFFFAOYSA-N	0	0	296.395	4.448	20	30		CIEDRN
CC#CCCCc1nc(C2CCC(C)(C)CC2)no1	ZINC000571841791	329924297	/nfs/dbraw/zinc/92/42/97/329924297.db2.gz	YFONBJXCJMSWAN-UHFFFAOYSA-N	0	0	260.381	4.099	20	30		CIEDRN
Cc1ccc(OCCCSCCCCC#N)cc1C	ZINC000161376245	329929212	/nfs/dbraw/zinc/92/92/12/329929212.db2.gz	ZWWLSGMXPZNHDM-UHFFFAOYSA-N	0	0	277.433	4.499	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)C1(Cc2cccs2)CCCCC1	ZINC000571932615	329930339	/nfs/dbraw/zinc/93/03/39/329930339.db2.gz	ZFIRJLXINGSYFJ-CQSZACIVSA-N	0	0	291.460	4.322	20	30		CIEDRN
CCSc1nnc(S[C@H](C#N)c2ccccc2)s1	ZINC000571939774	329932449	/nfs/dbraw/zinc/93/24/49/329932449.db2.gz	PEGFJVAUKZLYMH-SNVBAGLBSA-N	0	0	293.442	4.007	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)CCCc1ccccc1Cl	ZINC000572084712	329943053	/nfs/dbraw/zinc/94/30/53/329943053.db2.gz	ADZIRCZAPLAGNH-OAHLLOKOSA-N	0	0	291.822	4.230	20	30		CIEDRN
N#CCCCCSCCc1c(F)cccc1Cl	ZINC000161907628	329959126	/nfs/dbraw/zinc/95/91/26/329959126.db2.gz	FXVILGBLQKAZOW-UHFFFAOYSA-N	0	0	271.788	4.449	20	30		CIEDRN
C=CCC1(C(=O)Nc2cccc(C3CCC3)c2)CCOCC1	ZINC000424827177	329964653	/nfs/dbraw/zinc/96/46/53/329964653.db2.gz	HTVZLJVNLZXKPX-UHFFFAOYSA-N	0	0	299.414	4.266	20	30		CIEDRN
C=CCN(C(=O)C[C@@H](C)Cc1ccc(Cl)cc1)C1CC1	ZINC000536820083	329968396	/nfs/dbraw/zinc/96/83/96/329968396.db2.gz	HFAROGRPKLMFHO-ZDUSSCGKSA-N	0	0	291.822	4.086	20	30		CIEDRN
Cc1nsc(N[C@H](c2ccccc2C)C2CC2)c1C#N	ZINC000572316959	329976132	/nfs/dbraw/zinc/97/61/32/329976132.db2.gz	GRVUGQDKBLPOPQ-HNNXBMFYSA-N	0	0	283.400	4.195	20	30		CIEDRN
CC[C@@](C)(C#N)NC(=O)c1ccc(C2CCCCC2)cc1	ZINC000162125786	329976324	/nfs/dbraw/zinc/97/63/24/329976324.db2.gz	LBPBBGCJUPYFJL-SFHVURJKSA-N	0	0	284.403	4.156	20	30		CIEDRN
C[C@@H](CC1CCCCC1)C(=O)Nc1ccc(C#N)cc1	ZINC000510096087	332892078	/nfs/dbraw/zinc/89/20/78/332892078.db2.gz	WRNDAOWMCMNMAZ-ZDUSSCGKSA-N	0	0	270.376	4.103	20	30		CIEDRN
C=C1CCN([C@H](C)c2nc3ccccc3n2C(F)F)CC1	ZINC000264421579	330061093	/nfs/dbraw/zinc/06/10/93/330061093.db2.gz	ABRWMPPLBOGQKJ-GFCCVEGCSA-N	0	0	291.345	4.144	20	30		CIEDRN
C=C1CCN(C(=O)[C@@H]2C[C@H]2c2cccc3ccccc32)CC1	ZINC000264440423	330061439	/nfs/dbraw/zinc/06/14/39/330061439.db2.gz	BRUFLYUJPQZYLH-RBUKOAKNSA-N	0	0	291.394	4.122	20	30		CIEDRN
C=CCCSc1nnc(C[C@@H](C)c2ccccc2)o1	ZINC000265689979	330062921	/nfs/dbraw/zinc/06/29/21/330062921.db2.gz	FZVCTYMTFZYAIC-GFCCVEGCSA-N	0	0	274.389	4.084	20	30		CIEDRN
C=C1CCN(C(=O)C2CCC(c3ccccc3)CC2)CC1	ZINC000266391148	330063830	/nfs/dbraw/zinc/06/38/30/330063830.db2.gz	VZVNPLGDEJPDHH-UHFFFAOYSA-N	0	0	283.415	4.139	20	30		CIEDRN
C=CCCCC(=O)N1CC[C@@H](c2ccc(Cl)cc2)C1	ZINC000267179237	330064815	/nfs/dbraw/zinc/06/48/15/330064815.db2.gz	NKTVIUVENMIRKE-CQSZACIVSA-N	0	0	277.795	4.012	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](C)c1nc2ccccc2n1C(C)C	ZINC000267156149	330064816	/nfs/dbraw/zinc/06/48/16/330064816.db2.gz	JMPZQSGJBVWKMV-AWEZNQCLSA-N	0	0	299.418	4.151	20	30		CIEDRN
C=CCCCC(=O)N1CCC(=Cc2cccc(OC)c2)CC1	ZINC000268468512	330065963	/nfs/dbraw/zinc/06/59/63/330065963.db2.gz	MBXPFPSRPRBATL-UHFFFAOYSA-N	0	0	299.414	4.057	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1cc(C(F)F)ccc1Cl	ZINC000269088001	330067327	/nfs/dbraw/zinc/06/73/27/330067327.db2.gz	BFNUZTZZZCEBBF-QMMMGPOBSA-N	0	0	288.725	4.364	20	30		CIEDRN
C=CCCC(=O)Nc1cc(C(F)F)ccc1Cl	ZINC000269258678	330068169	/nfs/dbraw/zinc/06/81/69/330068169.db2.gz	YRZZYOKRDZRNRW-UHFFFAOYSA-N	0	0	259.683	4.182	20	30		CIEDRN
N#CCSc1cccc(-c2nc(C3CCCC3)no2)c1	ZINC000079942469	330072323	/nfs/dbraw/zinc/07/23/23/330072323.db2.gz	BCGNAMRWPWLNHD-UHFFFAOYSA-N	0	0	285.372	4.010	20	30		CIEDRN
C=C(C)[C@H](Cc1nc(-c2cc3ccccc3o2)no1)OCC	ZINC000270033682	330073190	/nfs/dbraw/zinc/07/31/90/330073190.db2.gz	MFLZBGNAXKWYHA-AWEZNQCLSA-N	0	0	298.342	4.007	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)Nc1cccc(SC)c1C)OCC	ZINC000271616478	330081673	/nfs/dbraw/zinc/08/16/73/330081673.db2.gz	AOWVHDHIYHOTMH-CQSZACIVSA-N	0	0	293.432	4.027	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cc(C)c(F)cc1Cl	ZINC000572440636	330082890	/nfs/dbraw/zinc/08/28/90/330082890.db2.gz	FRTVLJDJODOXEL-UHFFFAOYSA-N	0	0	281.758	4.494	20	30		CIEDRN
C[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccncc1Cl	ZINC000421833836	330091540	/nfs/dbraw/zinc/09/15/40/330091540.db2.gz	JNYCRNSOJHGWPB-CXAGYDPISA-N	0	0	299.805	4.431	20	30		CIEDRN
C=CCCO[C@H](C)c1nc(C2(c3ccccc3)CCC2)no1	ZINC000273993740	330100871	/nfs/dbraw/zinc/10/08/71/330100871.db2.gz	LUNCAYVXNJZACC-CQSZACIVSA-N	0	0	298.386	4.193	20	30		CIEDRN
C=CCCO[C@@H](C)c1nc(C2(c3ccccc3)CCC2)no1	ZINC000273993739	330101270	/nfs/dbraw/zinc/10/12/70/330101270.db2.gz	LUNCAYVXNJZACC-AWEZNQCLSA-N	0	0	298.386	4.193	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Nc1c(C)cccc1F	ZINC000274112230	330103490	/nfs/dbraw/zinc/10/34/90/330103490.db2.gz	LRZCDZBXHSVJEU-UHFFFAOYSA-N	0	0	278.371	4.344	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCCCC[C@@H]1c1cccn1C	ZINC000274297097	330104173	/nfs/dbraw/zinc/10/41/73/330104173.db2.gz	RJMCGLVZMLWYMN-DOTOQJQBSA-N	0	0	288.435	4.071	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H]1c1ccsc1	ZINC000274278085	330104195	/nfs/dbraw/zinc/10/41/95/330104195.db2.gz	JLEXBSGJKPQNKO-GXTWGEPZSA-N	0	0	263.406	4.014	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cc(-c2ncco2)ccc1C	ZINC000274349602	330105343	/nfs/dbraw/zinc/10/53/43/330105343.db2.gz	OUIXATWZZQUEFA-CYBMUJFWSA-N	0	0	284.359	4.191	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCCCC[C@H]1c1ccncc1	ZINC000274309744	330105356	/nfs/dbraw/zinc/10/53/56/330105356.db2.gz	WTIQAKZKPVUIPM-WBVHZDCISA-N	0	0	286.419	4.128	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCCCC[C@H]1c1ccncc1	ZINC000274309740	330105529	/nfs/dbraw/zinc/10/55/29/330105529.db2.gz	WTIQAKZKPVUIPM-RDJZCZTQSA-N	0	0	286.419	4.128	20	30		CIEDRN
C=CCCCCNC(=O)Nc1cc(-c2ncco2)ccc1C	ZINC000274808050	330107988	/nfs/dbraw/zinc/10/79/88/330107988.db2.gz	MCARZBMSQFSANN-UHFFFAOYSA-N	0	0	299.374	4.128	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H]1C[C@@H]1C	ZINC000276441972	330113513	/nfs/dbraw/zinc/11/35/13/330113513.db2.gz	RSTCXYZUCSRHME-DZGCQCFKSA-N	0	0	286.419	4.316	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1ncoc1CC	ZINC000276429164	330113539	/nfs/dbraw/zinc/11/35/39/330113539.db2.gz	IOOLEHOUGNOUGL-UHFFFAOYSA-N	0	0	298.386	4.341	20	30		CIEDRN
C=CCCN(C)C(=O)c1ccc(Cl)c(C(F)(F)F)c1	ZINC000276447501	330113572	/nfs/dbraw/zinc/11/35/72/330113572.db2.gz	UHBLMBMJIJTCQW-UHFFFAOYSA-N	0	0	291.700	4.007	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@H](c3cccc(C)c3)C2)CCC1	ZINC000276569868	330114078	/nfs/dbraw/zinc/11/40/78/330114078.db2.gz	AOQLASIVPOMJKB-KRWDZBQOSA-N	0	0	283.415	4.057	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCCS1	ZINC000276510054	330114080	/nfs/dbraw/zinc/11/40/80/330114080.db2.gz	ZCZUTXVVQLHXON-HNNXBMFYSA-N	0	0	289.444	4.373	20	30		CIEDRN
C#CC[C@H]([NH2+][C@H](C)c1cnn(C(C)C)c1C)c1ccccc1	ZINC000276556278	330114266	/nfs/dbraw/zinc/11/42/66/330114266.db2.gz	RDGCEBOAKZUOJE-BEFAXECRSA-N	0	0	295.430	4.188	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000276961938	330114954	/nfs/dbraw/zinc/11/49/54/330114954.db2.gz	RZAZUQKCXXBCQA-UKRRQHHQSA-N	0	0	299.336	4.051	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)c2csc(Cl)n2)CCCC1(C)C	ZINC000278522978	330117485	/nfs/dbraw/zinc/11/74/85/330117485.db2.gz	SOWVMKLTLPXEMJ-NSHDSACASA-N	0	0	298.839	4.003	20	30		CIEDRN
C=CCCCN(C)C(=O)c1sc(C2CCCC2)nc1C	ZINC000080388371	330129905	/nfs/dbraw/zinc/12/99/05/330129905.db2.gz	MNNMMPIYHBYPID-UHFFFAOYSA-N	0	0	292.448	4.147	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)C1=CCCCC1	ZINC000527180903	330230971	/nfs/dbraw/zinc/23/09/71/330230971.db2.gz	OVECANYBTXFSQW-UHFFFAOYSA-N	0	0	269.388	4.092	20	30		CIEDRN
C[C@H](NC(=O)C1(C#N)CC(C)C1)c1cc2ccccc2s1	ZINC000527200919	330235780	/nfs/dbraw/zinc/23/57/80/330235780.db2.gz	XTTMGRQIALQLNO-JKGQDXBKSA-N	0	0	298.411	4.018	20	30		CIEDRN
N#Cc1ccc(CSc2cc(F)ccc2F)cc1	ZINC000035121669	330242394	/nfs/dbraw/zinc/24/23/94/330242394.db2.gz	HTPWTQDOPOMVEM-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
CCSCc1ccc(C(=O)Nc2ccc(C#N)cc2)cc1	ZINC000054856382	330249449	/nfs/dbraw/zinc/24/94/49/330249449.db2.gz	PNVBMCMZTZDQTK-UHFFFAOYSA-N	0	0	296.395	4.064	20	30		CIEDRN
CC(C)c1ccc(CNc2cccc(F)c2C#N)cc1	ZINC000036138637	330249601	/nfs/dbraw/zinc/24/96/01/330249601.db2.gz	OLKRJCFQIXPBES-UHFFFAOYSA-N	0	0	268.335	4.433	20	30		CIEDRN
N#CC1(c2ccccc2-c2ccc(OC3CC3)cc2)CC1	ZINC000527587085	330264479	/nfs/dbraw/zinc/26/44/79/330264479.db2.gz	DMRRQGSXUAUZMA-UHFFFAOYSA-N	0	0	275.351	4.450	20	30		CIEDRN
COCc1ccc(NCc2ccc([C@@H]3C[C@H]3C)o2)cc1C#N	ZINC000527762165	330281381	/nfs/dbraw/zinc/28/13/81/330281381.db2.gz	GUBHMGVQLMNQOA-SJKOYZFVSA-N	0	0	296.370	4.033	20	30		CIEDRN
N#Cc1ccc(CNc2cccc(C3CCOCC3)c2)cc1	ZINC000527799869	330284195	/nfs/dbraw/zinc/28/41/95/330284195.db2.gz	VOJFPZQGLZTYIN-UHFFFAOYSA-N	0	0	292.382	4.064	20	30		CIEDRN
CC1(C)CCc2cccc(NCc3cc(C#N)cs3)c2O1	ZINC000527811814	330284862	/nfs/dbraw/zinc/28/48/62/330284862.db2.gz	JKXRGFGTUSMOBY-UHFFFAOYSA-N	0	0	298.411	4.335	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)[C@H]2CCCC23CC3)cc1	ZINC000527869026	330285928	/nfs/dbraw/zinc/28/59/28/330285928.db2.gz	MZOSHNJRDULZCO-OAHLLOKOSA-N	0	0	282.387	4.007	20	30		CIEDRN
CCC(C#N)(CC)C(=O)N(C)Cc1cccc2ccccc21	ZINC000527836198	330287179	/nfs/dbraw/zinc/28/71/79/330287179.db2.gz	DPXOUYVWVDKSSA-UHFFFAOYSA-N	0	0	294.398	4.128	20	30		CIEDRN
COc1c(C)cc(Cl)cc1N[C@@H]1CCC[C@H](C#N)C1	ZINC000527973606	330301875	/nfs/dbraw/zinc/30/18/75/330301875.db2.gz	JXBMYNSBBPHGPA-WCQYABFASA-N	0	0	278.783	4.151	20	30		CIEDRN
CCC[C@@H](CNc1cccc(C(F)F)c1C#N)OCC	ZINC000528087319	330307415	/nfs/dbraw/zinc/30/74/15/330307415.db2.gz	UTPGDBBVKOCLMJ-NSHDSACASA-N	0	0	282.334	4.113	20	30		CIEDRN
CCC(C#N)(CC)c1nc(-c2cccc(OC(C)C)c2)no1	ZINC000528112683	330308506	/nfs/dbraw/zinc/30/85/06/330308506.db2.gz	DIGKLHCLFZDWFD-UHFFFAOYSA-N	0	0	299.374	4.105	20	30		CIEDRN
C=CC[C@H](C)NC(=O)CCc1ccc(Cl)c(Cl)c1	ZINC000116853716	330322691	/nfs/dbraw/zinc/32/26/91/330322691.db2.gz	QOZWSNSRVDKRPX-JTQLQIEISA-N	0	0	286.202	4.007	20	30		CIEDRN
C=CC[C@H](C)NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000116860586	330323098	/nfs/dbraw/zinc/32/30/98/330323098.db2.gz	UFPVLPBISGLAGP-WCQGTBRESA-N	0	0	298.213	4.178	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@@H](c1ccccc1)C1CCC1	ZINC000105249327	330323151	/nfs/dbraw/zinc/32/31/51/330323151.db2.gz	DOEDINDXDVMBLZ-KRWDZBQOSA-N	0	0	286.419	4.135	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)CCc1ccc(Cl)cc1Cl	ZINC000116860507	330323176	/nfs/dbraw/zinc/32/31/76/330323176.db2.gz	WHPWMXAJWGLIFO-SNVBAGLBSA-N	0	0	286.202	4.007	20	30		CIEDRN
N#Cc1c(Cl)cccc1SCC[C@@H]1CCCCO1	ZINC000580484939	330325912	/nfs/dbraw/zinc/32/59/12/330325912.db2.gz	GRIRZWWTHFCBPW-NSHDSACASA-N	0	0	281.808	4.263	20	30		CIEDRN
C=C(C)C(C)(C)c1nc([C@H](C)c2cccs2)no1	ZINC000424344221	330344517	/nfs/dbraw/zinc/34/45/17/330344517.db2.gz	BOGMKOFUZUNJBT-SNVBAGLBSA-N	0	0	262.378	4.137	20	30		CIEDRN
C=C(C)C(C)(C)c1nc(-c2cccc(C(F)(F)F)n2)no1	ZINC000424350220	330345226	/nfs/dbraw/zinc/34/52/26/330345226.db2.gz	SWOIPOAZFBAOSA-UHFFFAOYSA-N	0	0	297.280	4.004	20	30		CIEDRN
C=C(C)C(C)(C)c1nc(C2(c3ccccc3F)CC2)no1	ZINC000424363740	330347639	/nfs/dbraw/zinc/34/76/39/330347639.db2.gz	PDYSFCJYQKDSHK-UHFFFAOYSA-N	0	0	286.350	4.142	20	30		CIEDRN
C=C[C@@H]1OCCC[C@H]1c1nc(C2CCC(C)(C)CC2)no1	ZINC000424366586	330347925	/nfs/dbraw/zinc/34/79/25/330347925.db2.gz	XZDQDCXFGGBSQG-KGLIPLIRSA-N	0	0	290.407	4.202	20	30		CIEDRN
C=CCCSCc1ccc(Br)cc1C#N	ZINC000580491366	330348588	/nfs/dbraw/zinc/34/85/88/330348588.db2.gz	LDOLANVZRGHXMQ-UHFFFAOYSA-N	0	0	282.206	4.130	20	30		CIEDRN
C[C@H](C#N)CN(Cc1ccc(Cl)cc1Cl)C1CC1	ZINC000533137686	330350465	/nfs/dbraw/zinc/35/04/65/330350465.db2.gz	YWGUYWIDCHWGKF-SNVBAGLBSA-N	0	0	283.202	4.117	20	30		CIEDRN
N#Cc1ccncc1NCC(c1ccccc1)c1ccccc1	ZINC000533151183	330351229	/nfs/dbraw/zinc/35/12/29/330351229.db2.gz	BLPFJNYBKGXWQR-UHFFFAOYSA-N	0	0	299.377	4.197	20	30		CIEDRN
N#Cc1ccc(-c2nc3cc(C(F)(F)F)ccc3[nH]2)cc1	ZINC000107793480	330351263	/nfs/dbraw/zinc/35/12/63/330351263.db2.gz	PGNXRUNAYYLTCX-UHFFFAOYSA-N	0	0	287.244	4.120	20	30		CIEDRN
C[C@H](c1ccccc1Cl)N(C)Cc1ccc(C#N)cc1	ZINC000046527141	330353528	/nfs/dbraw/zinc/35/35/28/330353528.db2.gz	NIUHTMMGODTICN-CYBMUJFWSA-N	0	0	284.790	4.405	20	30		CIEDRN
Cc1cccc(N(CCCC#N)Cc2ccccc2)c1	ZINC000533237493	330354536	/nfs/dbraw/zinc/35/45/36/330354536.db2.gz	CUAVJQNHGARDJM-UHFFFAOYSA-N	0	0	264.372	4.305	20	30		CIEDRN
Cc1cn(Cc2csc(C3CCCCC3)n2)cc1C#N	ZINC000533228370	330354687	/nfs/dbraw/zinc/35/46/87/330354687.db2.gz	WYDMUVUGBLUEIS-UHFFFAOYSA-N	0	0	285.416	4.221	20	30		CIEDRN
C=CCN(C(=O)C[C@H](CC)c1ccc(C)cc1)C1CC1	ZINC000536881367	330360771	/nfs/dbraw/zinc/36/07/71/330360771.db2.gz	HHLDXSFFQUZBAA-HNNXBMFYSA-N	0	0	271.404	4.056	20	30		CIEDRN
C=C(CC)CSCC(=O)Nc1c(C)cccc1Cl	ZINC000536881932	330360859	/nfs/dbraw/zinc/36/08/59/330360859.db2.gz	PQTPVARXQHGMCW-UHFFFAOYSA-N	0	0	283.824	4.286	20	30		CIEDRN
C=C(CC)CS[C@@H](C)C(=O)Nc1cc(C)ccc1OC	ZINC000536882898	330361097	/nfs/dbraw/zinc/36/10/97/330361097.db2.gz	XNPUSNGUDIFNMC-ZDUSSCGKSA-N	0	0	293.432	4.030	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N(C)[C@H](C)c1cc2ccccc2o1	ZINC000116971278	330362777	/nfs/dbraw/zinc/36/27/77/330362777.db2.gz	FLIPIJNGIVHCJG-CHWSQXEVSA-N	0	0	286.375	4.100	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N(C)[C@H](C)c1ccccc1Cl	ZINC000116972641	330362877	/nfs/dbraw/zinc/36/28/77/330362877.db2.gz	IQUPTLVQNIABAH-NWDGAFQWSA-N	0	0	280.799	4.007	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N(C)[C@H](C)c1ccccc1Cl	ZINC000116972643	330362888	/nfs/dbraw/zinc/36/28/88/330362888.db2.gz	IQUPTLVQNIABAH-VXGBXAGGSA-N	0	0	280.799	4.007	20	30		CIEDRN
C=C(CC)C[N@@H+]1CCCC[C@H]1c1nc2ccccc2o1	ZINC000536902806	330363735	/nfs/dbraw/zinc/36/37/35/330363735.db2.gz	AASVHOALWSKVJC-HNNXBMFYSA-N	0	0	270.376	4.321	20	30		CIEDRN
C=CCn1c(Cc2ccccc2)nnc1SCC(=C)CC	ZINC000536903422	330363756	/nfs/dbraw/zinc/36/37/56/330363756.db2.gz	DAKDUFMPXPAULX-UHFFFAOYSA-N	0	0	299.443	4.113	20	30		CIEDRN
C=CCCC(=O)N1CCCCC[C@@H]1c1cccc(C)c1	ZINC000117730458	330366492	/nfs/dbraw/zinc/36/64/92/330366492.db2.gz	SCIPSXOJGZSMBX-QGZVFWFLSA-N	0	0	271.404	4.405	20	30		CIEDRN
C=CCCCS[C@H](C)C(=O)Nc1ccc(C)cc1C	ZINC000117944538	330366644	/nfs/dbraw/zinc/36/66/44/330366644.db2.gz	SDQNGTUEFQEAPJ-CQSZACIVSA-N	0	0	277.433	4.330	20	30		CIEDRN
C=CCCCS[C@H](C)C(=O)Nc1ccc(C)cc1F	ZINC000117944987	330366679	/nfs/dbraw/zinc/36/66/79/330366679.db2.gz	PPXLQEFJDUTRPG-GFCCVEGCSA-N	0	0	281.396	4.161	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1cccc(F)c1F)c1ccccc1	ZINC000119326719	330372908	/nfs/dbraw/zinc/37/29/08/330372908.db2.gz	MOBYXPYOHDUHPN-GFCCVEGCSA-N	0	0	287.309	4.263	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1ccc(-c2cnc(C)o2)cc1	ZINC000424556600	330374957	/nfs/dbraw/zinc/37/49/57/330374957.db2.gz	GQSUPWNOYLJOFA-UHFFFAOYSA-N	0	0	284.359	4.191	20	30		CIEDRN
N#Cc1cccc(SCCCCC(F)(F)F)c1	ZINC000119696936	330378808	/nfs/dbraw/zinc/37/88/08/330378808.db2.gz	LVCBBSAIWIPOKQ-UHFFFAOYSA-N	0	0	259.296	4.383	20	30		CIEDRN
CC1(C)Cc2cccc(Oc3cccc(F)c3C#N)c2O1	ZINC000057797013	330379758	/nfs/dbraw/zinc/37/97/58/330379758.db2.gz	QMCFOSPEMQBWJR-UHFFFAOYSA-N	0	0	283.302	4.203	20	30		CIEDRN
CC[C@H]1CCC[C@H]1NC(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000119922017	330380277	/nfs/dbraw/zinc/38/02/77/330380277.db2.gz	DYDFCJAZSXBEHX-XJKSGUPXSA-N	0	0	299.418	4.188	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@@H]1CCCC[C@H]1C	ZINC000424569808	330380635	/nfs/dbraw/zinc/38/06/35/330380635.db2.gz	VMOSWTBLMOTKIF-UKRRQHHQSA-N	0	0	277.433	4.089	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@H]1CCCC[C@H]1C	ZINC000424569807	330380718	/nfs/dbraw/zinc/38/07/18/330380718.db2.gz	VMOSWTBLMOTKIF-HIFRSBDPSA-N	0	0	277.433	4.089	20	30		CIEDRN
CN(Cc1cccc(C(F)(F)F)c1)c1ccc(C#N)cc1	ZINC000058003101	330381647	/nfs/dbraw/zinc/38/16/47/330381647.db2.gz	UPIRJENIFNWSNR-UHFFFAOYSA-N	0	0	290.288	4.213	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1cc(-c2ncco2)ccc1C	ZINC000089316059	330383388	/nfs/dbraw/zinc/38/33/88/330383388.db2.gz	JREFQKWQWKHSSE-UHFFFAOYSA-N	0	0	299.374	4.080	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1ccc2oc(C3CC3)nc2c1	ZINC000424580231	330386321	/nfs/dbraw/zinc/38/63/21/330386321.db2.gz	DLTJSCFVQUGFLU-UHFFFAOYSA-N	0	0	284.359	4.246	20	30		CIEDRN
C=CCCC[C@@H](C)N(C)Cc1csc([C@@H](C)OCC)n1	ZINC000537048595	330394834	/nfs/dbraw/zinc/39/48/34/330394834.db2.gz	RDDMFFITWRDRDC-ZIAGYGMSSA-N	0	0	296.480	4.417	20	30		CIEDRN
C=CCC(CC=C)C(=O)NCc1cccc(C(F)(F)F)c1	ZINC000121139447	330395545	/nfs/dbraw/zinc/39/55/45/330395545.db2.gz	AMORAMWWHWFMBA-UHFFFAOYSA-N	0	0	297.320	4.090	20	30		CIEDRN
N#Cc1ccc(N2CCC(Cc3ccccc3)CC2)c(F)c1	ZINC000059260007	330397832	/nfs/dbraw/zinc/39/78/32/330397832.db2.gz	VRJBUVPCYQMIEW-UHFFFAOYSA-N	0	0	294.373	4.156	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H](C)c1ccc(Cl)cc1	ZINC000121273964	330399209	/nfs/dbraw/zinc/39/92/09/330399209.db2.gz	SBWHDSWGLFVURF-LBPRGKRZSA-N	0	0	277.795	4.286	20	30		CIEDRN
C=C[C@@H](CC(=O)N[C@H](C)c1ccccc1)c1ccccc1	ZINC000121403975	330400046	/nfs/dbraw/zinc/40/00/46/330400046.db2.gz	GBVSSCGEAXXJQM-CVEARBPZSA-N	0	0	279.383	4.224	20	30		CIEDRN
C=CCCOCCCCC(=O)Nc1cccc(C)c1C	ZINC000537164175	330409565	/nfs/dbraw/zinc/40/95/65/330409565.db2.gz	GODCGEABUKJWEZ-UHFFFAOYSA-N	0	0	275.392	4.005	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1cccc(COC(C)C)c1	ZINC000424608304	330414176	/nfs/dbraw/zinc/41/41/76/330414176.db2.gz	AUGQUELAJSWSOL-UHFFFAOYSA-N	0	0	275.392	4.152	20	30		CIEDRN
Cc1cc(C)c(NCc2cc(C#N)cs2)c(C)c1	ZINC000093687198	330424480	/nfs/dbraw/zinc/42/44/80/330424480.db2.gz	OLMSKEDLNQIMBU-UHFFFAOYSA-N	0	0	256.374	4.157	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)C[C@H](C)Cc1cccc(F)c1	ZINC000537226507	330429433	/nfs/dbraw/zinc/42/94/33/330429433.db2.gz	YPAFIDOIHHVABD-HUUCEWRRSA-N	0	0	291.410	4.255	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)C[C@@H](C)Cc1cccc(F)c1	ZINC000537226506	330429485	/nfs/dbraw/zinc/42/94/85/330429485.db2.gz	YPAFIDOIHHVABD-GJZGRUSLSA-N	0	0	291.410	4.255	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@H]1CCSc2ccccc21	ZINC000537229069	330429510	/nfs/dbraw/zinc/42/95/10/330429510.db2.gz	FNWFOARSYZXWAX-ZFWWWQNUSA-N	0	0	289.444	4.127	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)COc1cccc2ccccc21	ZINC000537240062	330430202	/nfs/dbraw/zinc/43/02/02/330430202.db2.gz	WXPHZLYLWKDLOS-OAHLLOKOSA-N	0	0	297.398	4.080	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)NC[C@H]1CCC[C@@H](C(F)(F)F)C1	ZINC000424708313	330451927	/nfs/dbraw/zinc/45/19/27/330451927.db2.gz	DVQIVQSLYXFRLW-NWDGAFQWSA-N	0	0	291.357	4.074	20	30		CIEDRN
Cc1nc(COc2cc(C)c(C#N)c(C)c2C)sc1C	ZINC000312327700	330462614	/nfs/dbraw/zinc/46/26/14/330462614.db2.gz	YZIJNOYLRNGOOZ-UHFFFAOYSA-N	0	0	286.400	4.136	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(COc2ccc(Cl)cc2)no1	ZINC000514816680	330465112	/nfs/dbraw/zinc/46/51/12/330465112.db2.gz	LSHRFZHHYGRFQX-HNNXBMFYSA-N	0	0	292.766	4.156	20	30		CIEDRN
CCC(=O)c1cc(Cl)ccc1OCc1ccccc1C#N	ZINC000514993958	330468523	/nfs/dbraw/zinc/46/85/23/330468523.db2.gz	NOKCEJLPGFBNNK-UHFFFAOYSA-N	0	0	299.757	4.383	20	30		CIEDRN
CC(C)(C)[C@H](NCCCCC(C)(C)C#N)C(F)(F)F	ZINC000515034081	330469273	/nfs/dbraw/zinc/46/92/73/330469273.db2.gz	CDSWOSRKDAPNTC-NSHDSACASA-N	0	0	278.362	4.273	20	30		CIEDRN
CC(C)c1ccc(/C=C\c2ccc(C#N)cn2)cc1[N+](=O)[O-]	ZINC000515420753	330477051	/nfs/dbraw/zinc/47/70/51/330477051.db2.gz	ZTDZPCCDZPDSLA-UTCJRWHESA-N	0	0	293.326	4.155	20	30		CIEDRN
C[C@@H]1CCC[C@H](CC(=O)N[C@@](C)(C#N)C2CCCCC2)C1	ZINC000515482750	330478343	/nfs/dbraw/zinc/47/83/43/330478343.db2.gz	PQOTUPADQLEQPF-VKJFTORMSA-N	0	0	290.451	4.182	20	30		CIEDRN
C[C@H](CNc1cccc(C(F)F)c1C#N)CC(F)(F)F	ZINC000515671212	330480900	/nfs/dbraw/zinc/48/09/00/330480900.db2.gz	AVHPLECEVKNAST-QMMMGPOBSA-N	0	0	292.251	4.496	20	30		CIEDRN
CC(C)(C#N)CCNc1ccc(Cl)c(Cl)c1	ZINC000083637798	330481495	/nfs/dbraw/zinc/48/14/95/330481495.db2.gz	WPMFXOZUZMVCMQ-UHFFFAOYSA-N	0	0	257.164	4.345	20	30		CIEDRN
C=CC[C@H](C)NC(=O)[C@@H](C)c1ccc2ccccc2c1	ZINC000084604751	330486957	/nfs/dbraw/zinc/48/69/57/330486957.db2.gz	CWJLMQYFVIUSEI-KBPBESRZSA-N	0	0	267.372	4.024	20	30		CIEDRN
N#Cc1cccc(N[C@H]2CCC[C@H](C(F)(F)F)C2)c1	ZINC000085127903	330489060	/nfs/dbraw/zinc/48/90/60/330489060.db2.gz	YKONNZXBDSMMNH-AAEUAGOBSA-N	0	0	268.282	4.091	20	30		CIEDRN
C=CCC[C@H](NC(=O)N(C)[C@H]1CC1(C)C)c1ccccc1	ZINC000425915476	330498581	/nfs/dbraw/zinc/49/85/81/330498581.db2.gz	AJBWASSZWHYEMJ-HOTGVXAUSA-N	0	0	286.419	4.134	20	30		CIEDRN
CC(C)CC[C@@H](C)NC(=O)Nc1ccc(C#N)cc1Cl	ZINC000426138947	330500128	/nfs/dbraw/zinc/50/01/28/330500128.db2.gz	LUMDQBCHFOUIEY-LLVKDONJSA-N	0	0	293.798	4.158	20	30		CIEDRN
C=CCC(C)(C)c1nc(Cc2c[nH]c3cc(F)ccc23)no1	ZINC000426427410	330508764	/nfs/dbraw/zinc/50/87/64/330508764.db2.gz	NKGVYANPJHDQDY-UHFFFAOYSA-N	0	0	299.349	4.135	20	30		CIEDRN
C=CCC(C)(C)c1nc([C@@H](OCC)c2ccccc2)no1	ZINC000426622779	330513219	/nfs/dbraw/zinc/51/32/19/330513219.db2.gz	JSODNKSAMZLUDP-AWEZNQCLSA-N	0	0	286.375	4.049	20	30		CIEDRN
C=CC[C@@H](C)[C@H](C)Nc1ccc(C(=O)N(CC)CC)cc1	ZINC000428437135	330523246	/nfs/dbraw/zinc/52/32/46/330523246.db2.gz	KMPXYDUTLBYKOX-CABCVRRESA-N	0	0	288.435	4.181	20	30		CIEDRN
C=CCC[C@H](C(=O)N1CC2(C1)CCCC2)c1ccccc1	ZINC000428451183	330524107	/nfs/dbraw/zinc/52/41/07/330524107.db2.gz	YYPYIKDURCIKMD-KRWDZBQOSA-N	0	0	283.415	4.139	20	30		CIEDRN
C=C(C)CNC(=O)Nc1ccccc1-c1ccccc1	ZINC000429215864	330540111	/nfs/dbraw/zinc/54/01/11/330540111.db2.gz	RDYRDZRKKJRAPF-UHFFFAOYSA-N	0	0	266.344	4.051	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc(O[C@H](C)CC)cc1	ZINC000429817577	330555422	/nfs/dbraw/zinc/55/54/22/330555422.db2.gz	NKVXYXWJWQONEF-CYBMUJFWSA-N	0	0	275.392	4.405	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCC1(c2ccccc2)CCCC1	ZINC000429844325	330555713	/nfs/dbraw/zinc/55/57/13/330555713.db2.gz	AAKXBAHLOHTCQW-UHFFFAOYSA-N	0	0	285.431	4.217	20	30		CIEDRN
Cc1c2cc(C#N)ccc2sc1C(=O)N1CCCCCC1	ZINC000429922047	330556460	/nfs/dbraw/zinc/55/64/60/330556460.db2.gz	HTGUVABFOMZYEN-UHFFFAOYSA-N	0	0	298.411	4.098	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000429919337	330556494	/nfs/dbraw/zinc/55/64/94/330556494.db2.gz	QTEOQYAIQYXQEJ-UHFFFAOYSA-N	0	0	255.720	4.020	20	30		CIEDRN
C=CCN(C)C(=O)N[C@@H](CC(C)(C)C)c1ccc(F)cc1	ZINC000429967601	330556805	/nfs/dbraw/zinc/55/68/05/330556805.db2.gz	SKVLRKSAULEXNP-HNNXBMFYSA-N	0	0	292.398	4.130	20	30		CIEDRN
C=CCN(CCC#N)Cc1ccc(F)c(Cl)c1Cl	ZINC000430109064	330560982	/nfs/dbraw/zinc/56/09/82/330560982.db2.gz	WNJDEBCMCJRKNQ-UHFFFAOYSA-N	0	0	287.165	4.034	20	30		CIEDRN
C=C[C@H](C)NC(=O)NCc1ccc(-c2ccccc2)c(C)c1	ZINC000430160634	330562656	/nfs/dbraw/zinc/56/26/56/330562656.db2.gz	BCVLNYPGLDRUFY-HNNXBMFYSA-N	0	0	294.398	4.036	20	30		CIEDRN
Cc1cc(C)c(C#N)c(N[C@H]2C[C@H](c3ccc(F)cc3)C2)n1	ZINC000431511070	330586043	/nfs/dbraw/zinc/58/60/43/330586043.db2.gz	JLXQYCFMWWRQBM-KOMQPUFPSA-N	0	0	295.361	4.067	20	30		CIEDRN
CN(C(=O)N[C@H](CCCC#N)c1ccccc1)C1CCCC1	ZINC000431623853	330587153	/nfs/dbraw/zinc/58/71/53/330587153.db2.gz	JXEKJAFGBUUPCX-QGZVFWFLSA-N	0	0	299.418	4.006	20	30		CIEDRN
C=CCCCN(C)C(=O)c1c(Cl)cc(F)cc1Cl	ZINC000431838334	330589399	/nfs/dbraw/zinc/58/93/99/330589399.db2.gz	RGRCQDFNWJXZRG-UHFFFAOYSA-N	0	0	290.165	4.171	20	30		CIEDRN
CC(F)(F)c1ccc(CNc2cccc(F)c2C#N)cc1	ZINC000432132567	330593558	/nfs/dbraw/zinc/59/35/58/330593558.db2.gz	DSLFKGNZUYXVLH-UHFFFAOYSA-N	0	0	290.288	4.421	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)Nc1cccc(SC)c1	ZINC000432482727	330599667	/nfs/dbraw/zinc/59/96/67/330599667.db2.gz	IMZOEVHNLJLJOV-UHFFFAOYSA-N	0	0	278.421	4.132	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)N[C@H](CC)c1cccs1	ZINC000432551819	330600483	/nfs/dbraw/zinc/60/04/83/330600483.db2.gz	ATVMREKDPWAWDU-GFCCVEGCSA-N	0	0	280.437	4.101	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)N(C)Cc1cc(C)cc(C)c1	ZINC000432556280	330600551	/nfs/dbraw/zinc/60/05/51/330600551.db2.gz	IVOSWTSSHRDHGH-UHFFFAOYSA-N	0	0	288.435	4.047	20	30		CIEDRN
C=CCN(C(=O)c1sccc1C1CC1)c1ccccc1	ZINC000432712943	330604004	/nfs/dbraw/zinc/60/40/04/330604004.db2.gz	CFXWQPCBJXFMCG-UHFFFAOYSA-N	0	0	283.396	4.458	20	30		CIEDRN
N#CCN(Cc1ccc(C(F)(F)F)s1)C1CCCC1	ZINC000432754370	330606093	/nfs/dbraw/zinc/60/60/93/330606093.db2.gz	ZBWHQCQKTZQRBD-UHFFFAOYSA-N	0	0	288.338	4.035	20	30		CIEDRN
CCc1ccccc1C(=O)N(C)c1cc(Cl)ccc1C#N	ZINC000151695423	330620219	/nfs/dbraw/zinc/62/02/19/330620219.db2.gz	OBGKLLDTKXUGGC-UHFFFAOYSA-N	0	0	298.773	4.051	20	30		CIEDRN
CCCC[C@H](CC)CC(=O)N1CCCC(C)(C)[C@@H]1C#N	ZINC000434032591	330634652	/nfs/dbraw/zinc/63/46/52/330634652.db2.gz	RHQOEMMNOURERR-GJZGRUSLSA-N	0	0	278.440	4.134	20	30		CIEDRN
Cc1cc(OCc2ncc(-c3cccs3)o2)ccc1C#N	ZINC000434643356	330642236	/nfs/dbraw/zinc/64/22/36/330642236.db2.gz	BGGHWFGYCOCMSQ-UHFFFAOYSA-N	0	0	296.351	4.162	20	30		CIEDRN
Cc1cc(OCc2cc(-c3cccs3)on2)ccc1C#N	ZINC000434651678	330642434	/nfs/dbraw/zinc/64/24/34/330642434.db2.gz	XHAJKHPNRBGDBK-UHFFFAOYSA-N	0	0	296.351	4.162	20	30		CIEDRN
N#Cc1cccc(SCc2cccc(F)c2F)c1	ZINC000435026877	330648199	/nfs/dbraw/zinc/64/81/99/330648199.db2.gz	NXXHEHZKRYCZEK-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
C=C(C)CN(C)C(=O)Nc1c(CC)cc(C)cc1CC	ZINC000435194988	330650711	/nfs/dbraw/zinc/65/07/11/330650711.db2.gz	WRFMGAJNYGEUHF-UHFFFAOYSA-N	0	0	274.408	4.160	20	30		CIEDRN
C=CCC[C@H](NC(=O)[C@H]1[C@@H]2CCCC[C@@H]21)c1ccccc1	ZINC000435296882	330652558	/nfs/dbraw/zinc/65/25/58/330652558.db2.gz	GOQXEYSFRQWEFJ-XWTMOSNGSA-N	0	0	283.415	4.246	20	30		CIEDRN
CCC(CC)(CC)[S@](=O)CCCCC(C)(C)C#N	ZINC000435434270	330654233	/nfs/dbraw/zinc/65/42/33/330654233.db2.gz	XCYFFJYOLNGKBL-GOSISDBHSA-N	0	0	271.470	4.424	20	30		CIEDRN
N#Cc1ccc(N[C@H]2C[C@H](c3cccc(F)c3)C2)cc1	ZINC000435597769	330658496	/nfs/dbraw/zinc/65/84/96/330658496.db2.gz	KWZZTQIYYMAXHL-CZIWCDLHSA-N	0	0	266.319	4.055	20	30		CIEDRN
Cc1ccc([C@H]2CCCN2c2c(C#N)cccc2C#N)s1	ZINC000436383790	330676324	/nfs/dbraw/zinc/67/63/24/330676324.db2.gz	COQMJEMWPLISJK-OAHLLOKOSA-N	0	0	293.395	4.141	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@@H](C)c1cccc2ccccc21	ZINC000448581598	330688028	/nfs/dbraw/zinc/68/80/28/330688028.db2.gz	KYUUXFRENSBFFQ-ZDUSSCGKSA-N	0	0	267.372	4.229	20	30		CIEDRN
Cc1c2ccccc2oc1[C@@H](C)Nc1nccc(C)c1C#N	ZINC000436904972	330688239	/nfs/dbraw/zinc/68/82/39/330688239.db2.gz	RNKHJHKXDBNHII-CYBMUJFWSA-N	0	0	291.354	4.489	20	30		CIEDRN
C=CCCCSCc1ccn(-c2ccc(F)cc2)n1	ZINC000437265946	330696448	/nfs/dbraw/zinc/69/64/48/330696448.db2.gz	DEGXVSJAXLKWBA-UHFFFAOYSA-N	0	0	276.380	4.211	20	30		CIEDRN
C=CCc1cc(C)cc(OC)c1OCc1csc(C)n1	ZINC000438311461	330721472	/nfs/dbraw/zinc/72/14/72/330721472.db2.gz	JLNPFMFKRAECTQ-UHFFFAOYSA-N	0	0	289.400	4.076	20	30		CIEDRN
CSc1ccc(CNc2ccc(CC#N)cc2)s1	ZINC000438830190	330729671	/nfs/dbraw/zinc/72/96/71/330729671.db2.gz	MZWBIQBPDSJYKF-UHFFFAOYSA-N	0	0	274.414	4.148	20	30		CIEDRN
C[C@H](CSCc1ccc(F)cc1C#N)C(F)(F)F	ZINC000439022109	330732562	/nfs/dbraw/zinc/73/25/62/330732562.db2.gz	DWNQKAOETPRZNQ-MRVPVSSYSA-N	0	0	277.286	4.129	20	30		CIEDRN
C[C@@H](CSCc1cc(F)ccc1C#N)C(F)(F)F	ZINC000439031335	330732795	/nfs/dbraw/zinc/73/27/95/330732795.db2.gz	ZJQVDIOPBHEGFN-QMMMGPOBSA-N	0	0	277.286	4.129	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1ccc(-c2ccc[nH]2)cc1	ZINC000439381267	330737633	/nfs/dbraw/zinc/73/76/33/330737633.db2.gz	CDYGXINJJMYCLH-CQSZACIVSA-N	0	0	283.375	4.158	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1c(C)c(C)ccc1Cl	ZINC000439409791	330737919	/nfs/dbraw/zinc/73/79/19/330737919.db2.gz	NHHPCIGAGQDQGI-GFCCVEGCSA-N	0	0	280.799	4.433	20	30		CIEDRN
C=CCCC(=O)N[C@@H](c1ccc(C(F)(F)F)cc1)C(C)C	ZINC000439655916	330741695	/nfs/dbraw/zinc/74/16/95/330741695.db2.gz	PINDBANUHDWJSA-OAHLLOKOSA-N	0	0	299.336	4.485	20	30		CIEDRN
C=CCCC(=O)N[C@H](c1ccc(C(F)(F)F)cc1)C(C)C	ZINC000439655915	330741698	/nfs/dbraw/zinc/74/16/98/330741698.db2.gz	PINDBANUHDWJSA-HNNXBMFYSA-N	0	0	299.336	4.485	20	30		CIEDRN
N#CCC[C@H](NC(=O)[C@@H]1CC12CCCCC2)c1ccccc1	ZINC000439673766	330741919	/nfs/dbraw/zinc/74/19/19/330741919.db2.gz	OJGBKTIAUCUZOA-IRXDYDNUSA-N	0	0	296.414	4.118	20	30		CIEDRN
C[C@@H](Sc1ccccc1C#N)c1ccccc1[N+](=O)[O-]	ZINC000439693643	330742069	/nfs/dbraw/zinc/74/20/69/330742069.db2.gz	NFPIHOCPARTNSU-LLVKDONJSA-N	0	0	284.340	4.320	20	30		CIEDRN
C=CC1CCN(C(=O)[C@H](C)c2ccc3ccccc3c2)CC1	ZINC000439725771	330742371	/nfs/dbraw/zinc/74/23/71/330742371.db2.gz	FVBHSFDQKQVNKV-OAHLLOKOSA-N	0	0	293.410	4.368	20	30		CIEDRN
CCCc1cc(C(=O)N(C)c2ccc(C#N)cc2)sc1C	ZINC000439936074	330744881	/nfs/dbraw/zinc/74/48/81/330744881.db2.gz	OJYKVXKCYKESFZ-UHFFFAOYSA-N	0	0	298.411	4.157	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1cc(Cl)c(Cl)cc1F	ZINC000439978572	330745340	/nfs/dbraw/zinc/74/53/40/330745340.db2.gz	LRIXZCLOIOQJDS-SSDOTTSWSA-N	0	0	291.153	4.219	20	30		CIEDRN
CC[C@@H](F)CSc1nc(C)cc(C(F)(F)F)c1C#N	ZINC000440581649	330751223	/nfs/dbraw/zinc/75/12/23/330751223.db2.gz	WUZREPAHQARPQB-MRVPVSSYSA-N	0	0	292.301	4.121	20	30		CIEDRN
Cc1cc(N2CCCC2)ccc1NCc1ccc(C#N)s1	ZINC000157426563	330775428	/nfs/dbraw/zinc/77/54/28/330775428.db2.gz	CBTHOYGOSIJJRP-UHFFFAOYSA-N	0	0	297.427	4.141	20	30		CIEDRN
CC(C)c1ccccc1NCc1ccc(C#N)s1	ZINC000157467480	330776134	/nfs/dbraw/zinc/77/61/34/330776134.db2.gz	LLLMERWGCHWDBW-UHFFFAOYSA-N	0	0	256.374	4.355	20	30		CIEDRN
Cc1ccc(NCc2ccc(C#N)o2)cc1C(F)(F)F	ZINC000157487406	330776312	/nfs/dbraw/zinc/77/63/12/330776312.db2.gz	GQYASXPJPNRNHB-UHFFFAOYSA-N	0	0	280.249	4.091	20	30		CIEDRN
CC[C@@H](F)CSCc1ccccc1C(C)(C)C#N	ZINC000442560492	330777039	/nfs/dbraw/zinc/77/70/39/330777039.db2.gz	WQWBOBLTKOPNMC-CYBMUJFWSA-N	0	0	265.397	4.469	20	30		CIEDRN
Cc1ccc(NCC(C)(C)CCC#N)cc1Br	ZINC000157498732	330777113	/nfs/dbraw/zinc/77/71/13/330777113.db2.gz	CZEUUMLMWFOAJO-UHFFFAOYSA-N	0	0	295.224	4.499	20	30		CIEDRN
CC1CCN(c2cccc(N[C@@H]3CC[C@@H](C#N)C3)c2)CC1	ZINC000442855816	330787398	/nfs/dbraw/zinc/78/73/98/330787398.db2.gz	KQUHUFFTXOUINK-NVXWUHKLSA-N	0	0	283.419	4.027	20	30		CIEDRN
N#Cc1cccc(CNc2ccc3ccoc3c2)c1F	ZINC000442877019	330789894	/nfs/dbraw/zinc/78/98/94/330789894.db2.gz	QOBKJUFHOWCIAX-UHFFFAOYSA-N	0	0	266.275	4.056	20	30		CIEDRN
Cc1cnc([C@H](C)S[C@H](C)c2cccc(C#N)c2)o1	ZINC000443138637	330795611	/nfs/dbraw/zinc/79/56/11/330795611.db2.gz	XJUUXPJVQJHDBH-NEPJUHHUSA-N	0	0	272.373	4.410	20	30		CIEDRN
C=CC[C@H]1N(C(=O)c2cccc(C(C)=O)c2)CCCC1(C)C	ZINC000443866869	330806889	/nfs/dbraw/zinc/80/68/89/330806889.db2.gz	HJLYOLDVHFYEKT-QGZVFWFLSA-N	0	0	299.414	4.096	20	30		CIEDRN
Cc1cc(CNc2cnccc2OC(C)(C)C)ccc1C#N	ZINC000443998731	330808936	/nfs/dbraw/zinc/80/89/36/330808936.db2.gz	RGUDKQSDYYOSOA-UHFFFAOYSA-N	0	0	295.386	4.051	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cc2[nH]ccc2cc1C	ZINC000444446704	330812703	/nfs/dbraw/zinc/81/27/03/330812703.db2.gz	GVJLXUBQMNTRCR-GFCCVEGCSA-N	0	0	256.349	4.017	20	30		CIEDRN
CCN(Cc1nc(C2CCCCC2)cs1)C[C@H](C)C#N	ZINC000444618400	330815349	/nfs/dbraw/zinc/81/53/49/330815349.db2.gz	HSVMTRQZWQMDJX-CYBMUJFWSA-N	0	0	291.464	4.172	20	30		CIEDRN
CCN(CCCCC(C)(C)C#N)c1cccc(OC)c1	ZINC000444645842	330816365	/nfs/dbraw/zinc/81/63/65/330816365.db2.gz	IAOSXIRESAYSDU-UHFFFAOYSA-N	0	0	274.408	4.242	20	30		CIEDRN
CC(C)N(C)c1ccccc1CNc1cccc(F)c1C#N	ZINC000445609796	330832874	/nfs/dbraw/zinc/83/28/74/330832874.db2.gz	JAXZQSIIDVPUOO-UHFFFAOYSA-N	0	0	297.377	4.154	20	30		CIEDRN
Cc1cscc1-c1noc(/C=C/c2ccccc2C#N)n1	ZINC000445626311	330833245	/nfs/dbraw/zinc/83/32/45/330833245.db2.gz	HHLNFENKUBEGAM-VOTSOKGWSA-N	0	0	293.351	4.149	20	30		CIEDRN
C=CCCO[C@@H](C)c1nc(-c2cc3cc(C)ccc3o2)no1	ZINC000445748703	330835434	/nfs/dbraw/zinc/83/54/34/330835434.db2.gz	JTIZBQHDQFIPHO-LBPRGKRZSA-N	0	0	298.342	4.445	20	30		CIEDRN
C=CCCc1csc(-c2ccc(OC(C)C)nc2)n1	ZINC000446143181	330845315	/nfs/dbraw/zinc/84/53/15/330845315.db2.gz	CEYUQAMIXYJEGW-UHFFFAOYSA-N	0	0	274.389	4.111	20	30		CIEDRN
COc1cc(Cl)c(Cl)cc1N[C@H]1CCC[C@@H](C#N)C1	ZINC000446800238	330854563	/nfs/dbraw/zinc/85/45/63/330854563.db2.gz	VCNYRMHDVOVDMZ-ZJUUUORDSA-N	0	0	299.201	4.496	20	30		CIEDRN
COc1cc(CNc2ccc(Cl)c(C#N)c2)ccc1C	ZINC000446904516	330857566	/nfs/dbraw/zinc/85/75/66/330857566.db2.gz	MEIMZJNKEQOEKU-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
COc1cc(C)cc(N[C@@H](C#N)C2CCCCC2)c1C	ZINC000447177918	330862508	/nfs/dbraw/zinc/86/25/08/330862508.db2.gz	WQMUFEZMKUIBRL-INIZCTEOSA-N	0	0	272.392	4.196	20	30		CIEDRN
C=CCCCCCSc1nnc(SCC)s1	ZINC000447286366	330863480	/nfs/dbraw/zinc/86/34/80/330863480.db2.gz	FQXVIEGWJMLCLZ-UHFFFAOYSA-N	0	0	274.480	4.489	20	30		CIEDRN
C=CCCCCCOc1cccc(Oc2ncccn2)c1	ZINC000447326056	330864849	/nfs/dbraw/zinc/86/48/49/330864849.db2.gz	RWFZHBPAIITCCQ-UHFFFAOYSA-N	0	0	284.359	4.394	20	30		CIEDRN
C=CCCCNC(=O)Nc1cc(C(F)(F)F)ccc1C	ZINC000448000057	330882632	/nfs/dbraw/zinc/88/26/32/330882632.db2.gz	OKEYDCDAVLXBFU-UHFFFAOYSA-N	0	0	286.297	4.102	20	30		CIEDRN
C=CC(C)(C)C(=O)Nc1ccc(-c2nc(C)cs2)cc1	ZINC000448858323	330886083	/nfs/dbraw/zinc/88/60/83/330886083.db2.gz	ARHBRIOOYHFXDI-UHFFFAOYSA-N	0	0	286.400	4.269	20	30		CIEDRN
C=CC1CCN(C(=O)c2ccc(C(F)(F)F)cc2C)CC1	ZINC000448958409	330889588	/nfs/dbraw/zinc/88/95/88/330889588.db2.gz	XFRZGIYMMIJPDY-UHFFFAOYSA-N	0	0	297.320	4.052	20	30		CIEDRN
COc1cc2ccccc2cc1CN(CC#N)C1CCCC1	ZINC000449032809	330894096	/nfs/dbraw/zinc/89/40/96/330894096.db2.gz	ZJSPOKNMKOMNDF-UHFFFAOYSA-N	0	0	294.398	4.117	20	30		CIEDRN
COc1ccc(Cl)cc1NC1CCC(C)(C#N)CC1	ZINC000449047590	330895181	/nfs/dbraw/zinc/89/51/81/330895181.db2.gz	RHQMZPTZDUXFFP-UHFFFAOYSA-N	0	0	278.783	4.233	20	30		CIEDRN
Cc1cc2ccccc2c(N[C@@H]2CC[C@H](C#N)C2)c1	ZINC000449411967	330923383	/nfs/dbraw/zinc/92/33/83/330923383.db2.gz	LCJIQATVGJQBFG-DZGCQCFKSA-N	0	0	250.345	4.252	20	30		CIEDRN
N#CCc1cccc(N[C@H]2CCC[C@H](c3cccnc3)C2)c1	ZINC000449695427	330944275	/nfs/dbraw/zinc/94/42/75/330944275.db2.gz	IHZRCACNWKDOMP-LPHOPBHVSA-N	0	0	291.398	4.286	20	30		CIEDRN
C[C@@H]1[C@H](Nc2cccc(CC#N)c2)C[C@@H]1c1ccccc1	ZINC000449701728	330944913	/nfs/dbraw/zinc/94/49/13/330944913.db2.gz	RJBCABZCPFJWHJ-ZOCIIQOWSA-N	0	0	276.383	4.357	20	30		CIEDRN
C=CCC1(C(=O)N[C@H]2CCCOc3ccccc32)CCCC1	ZINC000449826269	330951325	/nfs/dbraw/zinc/95/13/25/330951325.db2.gz	RKCZFICDVREXLC-INIZCTEOSA-N	0	0	299.414	4.153	20	30		CIEDRN
C=CCC1(C(=O)N2CCCc3ccccc3C2)CCCC1	ZINC000449847992	330952136	/nfs/dbraw/zinc/95/21/36/330952136.db2.gz	HUBZMGJSEILZPH-UHFFFAOYSA-N	0	0	283.415	4.098	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@@H](CC(C)C)C2)CCCC1	ZINC000450008233	330958420	/nfs/dbraw/zinc/95/84/20/330958420.db2.gz	BULTXSVEQLUOKE-HNNXBMFYSA-N	0	0	263.425	4.018	20	30		CIEDRN
C=CCC1(C(=O)N2CCS[C@@H]3CCCC[C@@H]32)CCCC1	ZINC000450126729	330962852	/nfs/dbraw/zinc/96/28/52/330962852.db2.gz	OFWFSTABCVEZQZ-LSDHHAIUSA-N	0	0	293.476	4.010	20	30		CIEDRN
CCOc1ccccc1OCc1ccc(C#N)cc1Cl	ZINC000162966296	330971385	/nfs/dbraw/zinc/97/13/85/330971385.db2.gz	KKEDJZLPZJSXRP-UHFFFAOYSA-N	0	0	287.746	4.189	20	30		CIEDRN
CC(C)(C)[C@@H]1C[C@@H](Nc2cccc(Cl)c2C#N)CCO1	ZINC000450408191	330977050	/nfs/dbraw/zinc/97/70/50/330977050.db2.gz	JBPOLPSZSSJIHC-NHYWBVRUSA-N	0	0	292.810	4.217	20	30		CIEDRN
N#C[C@@H]1CC[C@H](Sc2nc3ccc(Cl)cc3o2)C1	ZINC000450589636	330988168	/nfs/dbraw/zinc/98/81/68/330988168.db2.gz	DMFJCHGAVRYWJL-SCZZXKLOSA-N	0	0	278.764	4.266	20	30		CIEDRN
N#CC1(CSCc2ccc(Br)cc2)CCC1	ZINC000450678651	330993104	/nfs/dbraw/zinc/99/31/04/330993104.db2.gz	IEVCRWKNDVVSNT-UHFFFAOYSA-N	0	0	296.233	4.376	20	30		CIEDRN
N#CC1(CSc2nc3ccccc3n2C(F)F)CCC1	ZINC000450758671	330998474	/nfs/dbraw/zinc/99/84/74/330998474.db2.gz	MDYAEMYMOOOOIH-UHFFFAOYSA-N	0	0	293.342	4.217	20	30		CIEDRN
N#C[C@H]1CC[C@H](SCc2cccc(OC(F)F)c2)C1	ZINC000450863729	331003655	/nfs/dbraw/zinc/00/36/55/331003655.db2.gz	SONIGGUJFLLCCE-GWCFXTLKSA-N	0	0	283.343	4.213	20	30		CIEDRN
CC(C)(C)c1cc(COc2cc(Cl)ccc2C#N)no1	ZINC000450872739	331003998	/nfs/dbraw/zinc/00/39/98/331003998.db2.gz	OOOMILBIOPKAHV-UHFFFAOYSA-N	0	0	290.750	4.076	20	30		CIEDRN
N#Cc1ccc(SCC2(C#N)CCC2)cc1C(F)(F)F	ZINC000450913783	331006865	/nfs/dbraw/zinc/00/68/65/331006865.db2.gz	ZKFWVUFQYUEKLK-UHFFFAOYSA-N	0	0	296.317	4.363	20	30		CIEDRN
Cc1cc(N2CCC[C@@H]2c2ccc(F)cc2C)cc(C#N)n1	ZINC000450915556	331006978	/nfs/dbraw/zinc/00/69/78/331006978.db2.gz	SSUZMSXBUORJJV-GOSISDBHSA-N	0	0	295.361	4.051	20	30		CIEDRN
Cc1ccc(N2CCC[C@H]2c2ccc(F)cc2C)nc1C#N	ZINC000450915843	331007101	/nfs/dbraw/zinc/00/71/01/331007101.db2.gz	TWVUBIDVZZOGSU-KRWDZBQOSA-N	0	0	295.361	4.051	20	30		CIEDRN
C=CCC1(C(=O)N[C@H](C)c2ccc(Cl)cn2)CCCC1	ZINC000450965357	331009108	/nfs/dbraw/zinc/00/91/08/331009108.db2.gz	XBMFAANHIDIVOZ-GFCCVEGCSA-N	0	0	292.810	4.049	20	30		CIEDRN
C=CCCN(C)C(=O)C(C)(C)c1cccc2ccccc21	ZINC000451063753	331014410	/nfs/dbraw/zinc/01/44/10/331014410.db2.gz	QSBOITZXROLFKG-UHFFFAOYSA-N	0	0	281.399	4.152	20	30		CIEDRN
C=CCCN(C)C(=O)c1c(Cl)cc(Cl)cc1Cl	ZINC000451256728	331022295	/nfs/dbraw/zinc/02/22/95/331022295.db2.gz	ALKMIISRPPNULK-UHFFFAOYSA-N	0	0	292.593	4.295	20	30		CIEDRN
C=CCCCNC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000451298097	331023729	/nfs/dbraw/zinc/02/37/29/331023729.db2.gz	VKXYLZOPVZWWGX-TZMCWYRMSA-N	0	0	295.785	4.055	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc3cc[nH]c3c2)CCCC1	ZINC000451301906	331023764	/nfs/dbraw/zinc/02/37/64/331023764.db2.gz	YIBDLAWKYWIYGC-UHFFFAOYSA-N	0	0	268.360	4.243	20	30		CIEDRN
C=CCC1(C(=O)N2CCCC3(CCC3)C2)CCCCC1	ZINC000451324192	331024527	/nfs/dbraw/zinc/02/45/27/331024527.db2.gz	XEOPTDCCZVQDAU-UHFFFAOYSA-N	0	0	275.436	4.306	20	30		CIEDRN
CN(CCCCNc1ccc(C#N)cc1F)c1ccccc1	ZINC000303120746	332907717	/nfs/dbraw/zinc/90/77/17/332907717.db2.gz	MITQCNUFNFFNPJ-UHFFFAOYSA-N	0	0	297.377	4.026	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)CCCc1ncc(C)o1	ZINC000451460012	331030387	/nfs/dbraw/zinc/03/03/87/331030387.db2.gz	QZWCFAPLAJXMHR-UHFFFAOYSA-N	0	0	298.386	4.063	20	30		CIEDRN
C=CC(C)(C)C(=O)Nc1cc2sc(C)nc2cc1Cl	ZINC000451594919	331035384	/nfs/dbraw/zinc/03/53/84/331035384.db2.gz	ROXVDBRFIIGKMA-UHFFFAOYSA-N	0	0	294.807	4.409	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000451627843	331037398	/nfs/dbraw/zinc/03/73/98/331037398.db2.gz	ZGUJVUDWYAXTCA-YESZJQIVSA-N	0	0	271.404	4.041	20	30		CIEDRN
N#CCCCCN(c1ccc(Br)cc1)C1CC1	ZINC000451674068	331038520	/nfs/dbraw/zinc/03/85/20/331038520.db2.gz	XMMHVDNYKYHARS-UHFFFAOYSA-N	0	0	293.208	4.112	20	30		CIEDRN
N#Cc1cc(F)ccc1CN1CC2(CCC2)[C@@H]1c1ccco1	ZINC000451845767	331044600	/nfs/dbraw/zinc/04/46/00/331044600.db2.gz	VLLOBPPOQQQOIL-KRWDZBQOSA-N	0	0	296.345	4.018	20	30		CIEDRN
N#Cc1cccc(CN2CC3(CCC3)[C@@H]2c2ccco2)c1F	ZINC000451865194	331045430	/nfs/dbraw/zinc/04/54/30/331045430.db2.gz	XOIXHQTWGTYEDR-KRWDZBQOSA-N	0	0	296.345	4.018	20	30		CIEDRN
Cc1cccc(NC(=O)N[C@H](CCC#N)c2ccccc2)c1	ZINC000163551076	331054942	/nfs/dbraw/zinc/05/49/42/331054942.db2.gz	MUXHOFQDMXTHJA-QGZVFWFLSA-N	0	0	293.370	4.162	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](C)c1cccc(C2CC2)c1	ZINC000452196059	331058073	/nfs/dbraw/zinc/05/80/73/331058073.db2.gz	QWXBMCWZFQGGPT-ZDUSSCGKSA-N	0	0	257.377	4.098	20	30		CIEDRN
C=CCSc1ccccc1C(=O)NCCCC(C)(F)F	ZINC000452203961	331058414	/nfs/dbraw/zinc/05/84/14/331058414.db2.gz	WAUFFCVAXDHKLG-UHFFFAOYSA-N	0	0	299.386	4.130	20	30		CIEDRN
C=CCSc1ccccc1C(=O)NCC1=CCCCC1	ZINC000452290551	331061083	/nfs/dbraw/zinc/06/10/83/331061083.db2.gz	IEVVMZQCNPTORM-UHFFFAOYSA-N	0	0	287.428	4.195	20	30		CIEDRN
CC[C@@H]1CCC[C@H]1CNC(=O)C[C@H](CC#N)c1ccccc1	ZINC000452526918	331067591	/nfs/dbraw/zinc/06/75/91/331067591.db2.gz	KYWMCMNQUOAIOW-NJAFHUGGSA-N	0	0	298.430	4.016	20	30		CIEDRN
CC(C)=CCC[C@H](C)NC(=O)C[C@H](CC#N)c1ccccc1	ZINC000452540303	331067891	/nfs/dbraw/zinc/06/78/91/331067891.db2.gz	JDUPXAABGDCAOS-WMZOPIPTSA-N	0	0	298.430	4.325	20	30		CIEDRN
CC(C)=CCC[C@@H](C)NC(=O)C[C@H](CC#N)c1ccccc1	ZINC000452540300	331067933	/nfs/dbraw/zinc/06/79/33/331067933.db2.gz	JDUPXAABGDCAOS-AEFFLSMTSA-N	0	0	298.430	4.325	20	30		CIEDRN
C[C@@H]1C[C@H](CC(=O)N[C@H]2CC[C@@H](CC#N)C2)CC(C)(C)C1	ZINC000452560351	331068938	/nfs/dbraw/zinc/06/89/38/331068938.db2.gz	CPRDMNAHYFNIAQ-QXSJWSMHSA-N	0	0	290.451	4.037	20	30		CIEDRN
C[C@H]1CCC[C@H]1CC(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452642969	331070825	/nfs/dbraw/zinc/07/08/25/331070825.db2.gz	IEIUDGVFXMDCSL-AAEUAGOBSA-N	0	0	290.794	4.171	20	30		CIEDRN
C[C@@H]1CC[C@@H](CC(=O)Nc2ccc(CC#N)cc2Cl)C1	ZINC000452642207	331070884	/nfs/dbraw/zinc/07/08/84/331070884.db2.gz	GKSOQMPZRXDZAP-DGCLKSJQSA-N	0	0	290.794	4.171	20	30		CIEDRN
CC[C@@H]1CCC[C@@H]1C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452653252	331071226	/nfs/dbraw/zinc/07/12/26/331071226.db2.gz	ZHVRQBHAMOKDSY-OLZOCXBDSA-N	0	0	290.794	4.171	20	30		CIEDRN
C=C(C)CCNC(=O)c1cc(Cl)ccc1SCC	ZINC000452716288	331072961	/nfs/dbraw/zinc/07/29/61/331072961.db2.gz	GZZOZYUENJVKPR-UHFFFAOYSA-N	0	0	283.824	4.148	20	30		CIEDRN
C=C(C)CCNC(=O)c1ccc(Cl)cc1SCC	ZINC000452718736	331073429	/nfs/dbraw/zinc/07/34/29/331073429.db2.gz	QTPUCBOTJSPION-UHFFFAOYSA-N	0	0	283.824	4.148	20	30		CIEDRN
C=C(C)CCNC(=O)[C@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000452722207	331073888	/nfs/dbraw/zinc/07/38/88/331073888.db2.gz	JMZCHPODHYEOHY-NEPJUHHUSA-N	0	0	298.213	4.179	20	30		CIEDRN
C=C(C)CCNC(=O)[C@@H]1C[C@H]1c1cccc2ccccc21	ZINC000452722583	331074006	/nfs/dbraw/zinc/07/40/06/331074006.db2.gz	KNMMDMGRJNVYHF-ZWKOTPCHSA-N	0	0	279.383	4.026	20	30		CIEDRN
C=CC(C)(C)CNC(=O)c1ccccc1CCC(F)(F)F	ZINC000452777939	331076979	/nfs/dbraw/zinc/07/69/79/331076979.db2.gz	WKWIUQFRSJHGSF-UHFFFAOYSA-N	0	0	299.336	4.124	20	30		CIEDRN
C=C[C@@H](CC(=O)NC1(CC)CCCC1)c1ccccc1	ZINC000452974767	331082347	/nfs/dbraw/zinc/08/23/47/331082347.db2.gz	LWENJZJMBJKWRE-HNNXBMFYSA-N	0	0	271.404	4.185	20	30		CIEDRN
CCSCCNc1ccccc1SC[C@H](C)C#N	ZINC000453081449	331087263	/nfs/dbraw/zinc/08/72/63/331087263.db2.gz	FYVYQWRRKFGZOC-GFCCVEGCSA-N	0	0	280.462	4.103	20	30		CIEDRN
CC(C)(C#N)CCCNc1ccc(CC#N)cc1Cl	ZINC000453120091	331091169	/nfs/dbraw/zinc/09/11/69/331091169.db2.gz	CJGKZDHAYYNKDZ-UHFFFAOYSA-N	0	0	275.783	4.148	20	30		CIEDRN
CC(C)CCc1nc(CNc2cccc(CC#N)c2)cs1	ZINC000453150318	331094498	/nfs/dbraw/zinc/09/44/98/331094498.db2.gz	SSOXPYQXCKMTIB-UHFFFAOYSA-N	0	0	299.443	4.410	20	30		CIEDRN
CC[C@H](Nc1cccc(OCCCC#N)c1)c1ccncc1	ZINC000453162285	331095793	/nfs/dbraw/zinc/09/57/93/331095793.db2.gz	KRWIXGPZZCRXJT-SFHVURJKSA-N	0	0	295.386	4.327	20	30		CIEDRN
C=CCC1(c2nc(C(CC)(CC)OC)no2)CCCC1	ZINC000453183692	331098424	/nfs/dbraw/zinc/09/84/24/331098424.db2.gz	FZLDYBXATKMWKL-UHFFFAOYSA-N	0	0	278.396	4.119	20	30		CIEDRN
C=CCC(CC=C)c1nc([C@@H](Cc2ccccc2)OC)no1	ZINC000453212712	331102064	/nfs/dbraw/zinc/10/20/64/331102064.db2.gz	CQJKBEQUNNAUNX-MRXNPFEDSA-N	0	0	298.386	4.236	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc([C@H]2CSc3ccccc32)no1	ZINC000453231375	331104545	/nfs/dbraw/zinc/10/45/45/331104545.db2.gz	VMWWUCGHPSPOFJ-YPMHNXCESA-N	0	0	286.400	4.377	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc([C@H](Cc2ccccc2)OC)no1	ZINC000453236098	331105106	/nfs/dbraw/zinc/10/51/06/331105106.db2.gz	UIIHAHZENXLRCQ-ZFWWWQNUSA-N	0	0	286.375	4.070	20	30		CIEDRN
C=CCCc1noc([C@@H]2C[C@H]2c2ccccc2CC)n1	ZINC000453240988	331106070	/nfs/dbraw/zinc/10/60/70/331106070.db2.gz	VANAWANADOCXCL-LSDHHAIUSA-N	0	0	268.360	4.022	20	30		CIEDRN
C=CCCc1noc([C@@H]2C[C@@H]2c2ccc([C@H]3C[C@H]3C)o2)n1	ZINC000453250695	331107683	/nfs/dbraw/zinc/10/76/83/331107683.db2.gz	YQPHMJKILZVBTD-MROQNXINSA-N	0	0	284.359	4.176	20	30		CIEDRN
CC[C@H](Nc1ccccc1OCCF)c1ccc(C#N)cc1	ZINC000453253192	331107839	/nfs/dbraw/zinc/10/78/39/331107839.db2.gz	JSCLDSQOWLGSLS-INIZCTEOSA-N	0	0	298.361	4.470	20	30		CIEDRN
CCCn1ncc(N[C@H](C)c2cccc(C#N)c2)c1C1CC1	ZINC000453274730	331109879	/nfs/dbraw/zinc/10/98/79/331109879.db2.gz	ASDPBJXFRRQZKV-CYBMUJFWSA-N	0	0	294.402	4.215	20	30		CIEDRN
CCCn1ncc(N[C@@H](C)c2cccc(C#N)c2)c1C1CC1	ZINC000453274731	331109975	/nfs/dbraw/zinc/10/99/75/331109975.db2.gz	ASDPBJXFRRQZKV-ZDUSSCGKSA-N	0	0	294.402	4.215	20	30		CIEDRN
N#C[C@H]1CC[C@@H](Nc2cc(Cl)cc(Br)c2)C1	ZINC000453407159	331129503	/nfs/dbraw/zinc/12/95/03/331129503.db2.gz	DIWNZASMTDJMDP-GZMMTYOYSA-N	0	0	299.599	4.207	20	30		CIEDRN
C=CCC1(NC(=O)Nc2ccc(CC#N)cc2)CCCCC1	ZINC000454346635	331144577	/nfs/dbraw/zinc/14/45/77/331144577.db2.gz	QYQLFBPLDHYSMK-UHFFFAOYSA-N	0	0	297.402	4.153	20	30		CIEDRN
CC(C)=CCC[C@@H](C)NC(=O)N[C@H](C)c1ccc(C#N)cc1	ZINC000454353345	331144795	/nfs/dbraw/zinc/14/47/95/331144795.db2.gz	XIAZZTTXBWWRJH-HUUCEWRRSA-N	0	0	299.418	4.053	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N1CC[C@H](CC(C)(C)C)C1	ZINC000454649426	331150441	/nfs/dbraw/zinc/15/04/41/331150441.db2.gz	SVPKMWITDFOALL-OAHLLOKOSA-N	0	0	299.418	4.157	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)N1C[C@H](C(C)C)[C@H]1C(C)C	ZINC000455004461	331158653	/nfs/dbraw/zinc/15/86/53/331158653.db2.gz	RPGFOUPCLLPOMZ-NVXWUHKLSA-N	0	0	299.418	4.011	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)Nc1cccc(-c2ncco2)c1	ZINC000455026576	331159281	/nfs/dbraw/zinc/15/92/81/331159281.db2.gz	ZFHNYXFUOUYCOA-UHFFFAOYSA-N	0	0	299.374	4.065	20	30		CIEDRN
C=CC(C)(C)CNC(=O)Nc1cccc(SC)c1C	ZINC000455069469	331160121	/nfs/dbraw/zinc/16/01/21/331160121.db2.gz	WLLZVPHWBUIMOT-UHFFFAOYSA-N	0	0	278.421	4.051	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)NCC[C@@H](C)F	ZINC000455245896	331163193	/nfs/dbraw/zinc/16/31/93/331163193.db2.gz	MBGXWNNPMSDFPR-CYBMUJFWSA-N	0	0	292.398	4.408	20	30		CIEDRN
C=C(C)CCNC(=O)N1CCC[C@H]1c1cccc(Cl)c1	ZINC000455312535	331165586	/nfs/dbraw/zinc/16/55/86/331165586.db2.gz	PEJPTVRKNWWQFO-HNNXBMFYSA-N	0	0	292.810	4.153	20	30		CIEDRN
C=CCC1(CNC(=O)N(C)Cc2cccs2)CCCC1	ZINC000455481601	331170734	/nfs/dbraw/zinc/17/07/34/331170734.db2.gz	RVQZIAYVDIQSHT-UHFFFAOYSA-N	0	0	292.448	4.026	20	30		CIEDRN
C=CCCCCCSc1nnc(C2CC2)n1C1CC1	ZINC000195431211	331173313	/nfs/dbraw/zinc/17/33/13/331173313.db2.gz	UQDWXXHMMRGDDL-UHFFFAOYSA-N	0	0	277.437	4.329	20	30		CIEDRN
C=CCCCCCNc1ccccc1CN(CC)C(C)=O	ZINC000195447693	331174777	/nfs/dbraw/zinc/17/47/77/331174777.db2.gz	IGEZHGOPGBPNGY-UHFFFAOYSA-N	0	0	288.435	4.213	20	30		CIEDRN
COc1cc(C#N)ccc1OCc1ccc2ccccc2c1	ZINC000195596314	331178228	/nfs/dbraw/zinc/17/82/28/331178228.db2.gz	XYQHWDZBXIFIHD-UHFFFAOYSA-N	0	0	289.334	4.299	20	30		CIEDRN
CC[C@H](C)[C@H]1CCCCN1C(=O)Nc1cccc(CC#N)c1	ZINC000455909408	331180514	/nfs/dbraw/zinc/18/05/14/331180514.db2.gz	BKYGBHMOTUQATG-WMLDXEAASA-N	0	0	299.418	4.185	20	30		CIEDRN
CC(C)CC[C@H]1CCCN1C(=O)Nc1cccc(CC#N)c1	ZINC000455911615	331180683	/nfs/dbraw/zinc/18/06/83/331180683.db2.gz	WJMUXATVQHMONL-QGZVFWFLSA-N	0	0	299.418	4.185	20	30		CIEDRN
CCCC[C@H](NC(=O)Nc1cccc(CC#N)c1)C1CCC1	ZINC000455918899	331181008	/nfs/dbraw/zinc/18/10/08/331181008.db2.gz	LUTQUPSIYGQBSI-KRWDZBQOSA-N	0	0	299.418	4.233	20	30		CIEDRN
CCCCCN(C(=O)Nc1cccc(CC#N)c1)C(C)C	ZINC000455919040	331181060	/nfs/dbraw/zinc/18/10/60/331181060.db2.gz	MDGVNEMHVZTPEC-UHFFFAOYSA-N	0	0	287.407	4.185	20	30		CIEDRN
CC(C)CCC[C@H](C)NC(=O)Nc1cccc(CC#N)c1	ZINC000455921452	331181105	/nfs/dbraw/zinc/18/11/05/331181105.db2.gz	OVDOAYXSLAFQQK-AWEZNQCLSA-N	0	0	287.407	4.089	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1ccc2cnccc2c1	ZINC000455980737	331181726	/nfs/dbraw/zinc/18/17/26/331181726.db2.gz	HKLRAEHOGRDLBH-ZDUSSCGKSA-N	0	0	283.375	4.101	20	30		CIEDRN
Cc1cc(C#N)cc(NC(=O)N(C)[C@@H](C)c2cccs2)c1	ZINC000456001963	331182237	/nfs/dbraw/zinc/18/22/37/331182237.db2.gz	MPQFQDDIYFEUKL-LBPRGKRZSA-N	0	0	299.399	4.153	20	30		CIEDRN
C=CCCN(C)C(=O)c1ccc([C@H](C)C(F)(F)F)cc1	ZINC000456030278	331182835	/nfs/dbraw/zinc/18/28/35/331182835.db2.gz	RLYIMKITSKLQLG-NSHDSACASA-N	0	0	285.309	4.001	20	30		CIEDRN
C[C@H]1CC=C(C(=O)N[C@@H](CCCC#N)c2ccccc2)CC1	ZINC000456077212	331183981	/nfs/dbraw/zinc/18/39/81/331183981.db2.gz	ZBHMGIVMBLUPEQ-YJBOKZPZSA-N	0	0	296.414	4.284	20	30		CIEDRN
C=CCC1(NC(=O)c2ccoc2C2CC2)CCCCC1	ZINC000456366304	331191220	/nfs/dbraw/zinc/19/12/20/331191220.db2.gz	MCGQAQCPBXODHA-UHFFFAOYSA-N	0	0	273.376	4.166	20	30		CIEDRN
C=CC(C)(C)C(=O)Nc1ccc(CSCC)cc1	ZINC000456496747	331194291	/nfs/dbraw/zinc/19/42/91/331194291.db2.gz	PRTNKRAKZDVXIX-UHFFFAOYSA-N	0	0	263.406	4.090	20	30		CIEDRN
C=CCC1(CNC(=O)c2scnc2C(C)C)CCCC1	ZINC000456511816	331194820	/nfs/dbraw/zinc/19/48/20/331194820.db2.gz	UFGLOZSFJREAHM-UHFFFAOYSA-N	0	0	292.448	4.133	20	30		CIEDRN
CC[C@H](NC(=O)C[C@@H](CC#N)c1ccccc1)C1CCCC1	ZINC000456656053	331198424	/nfs/dbraw/zinc/19/84/24/331198424.db2.gz	IVQBDMIMWZUTBL-MSOLQXFVSA-N	0	0	298.430	4.159	20	30		CIEDRN
CC[C@H](NC(=O)c1ccc(C(C)(C)C#N)cc1)C1CCCC1	ZINC000456659280	331198429	/nfs/dbraw/zinc/19/84/29/331198429.db2.gz	LXDRFDRRCNACBK-KRWDZBQOSA-N	0	0	298.430	4.186	20	30		CIEDRN
CC[C@@H](NC(=O)C[C@H](CC#N)c1ccccc1)C1CCCC1	ZINC000456656319	331198492	/nfs/dbraw/zinc/19/84/92/331198492.db2.gz	IVQBDMIMWZUTBL-ZWKOTPCHSA-N	0	0	298.430	4.159	20	30		CIEDRN
CC[C@@H](NC(=O)C[C@@H](CC#N)c1ccccc1)C1CCCC1	ZINC000456656317	331198493	/nfs/dbraw/zinc/19/84/93/331198493.db2.gz	IVQBDMIMWZUTBL-QZTJIDSGSA-N	0	0	298.430	4.159	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)NC[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000456761351	331200911	/nfs/dbraw/zinc/20/09/11/331200911.db2.gz	JNVLALSDVBBXMX-YQVWRLOYSA-N	0	0	298.430	4.016	20	30		CIEDRN
CC(C)c1ccc(C(=O)Nc2cccc(CC#N)c2)s1	ZINC000456761541	331200928	/nfs/dbraw/zinc/20/09/28/331200928.db2.gz	XWQPRFVROPLOIH-UHFFFAOYSA-N	0	0	284.384	4.190	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)NC[C@@H]1CCCC[C@H]1c1ccccc1	ZINC000456761349	331200953	/nfs/dbraw/zinc/20/09/53/331200953.db2.gz	JNVLALSDVBBXMX-JENIJYKNSA-N	0	0	298.430	4.016	20	30		CIEDRN
C=C(CC)CNC(=O)CCC[C@@H](C)c1cccc(OC)c1	ZINC000456815725	331205487	/nfs/dbraw/zinc/20/54/87/331205487.db2.gz	ZBZBOICBBOODPW-OAHLLOKOSA-N	0	0	289.419	4.051	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H]1c1ccc(F)cc1F	ZINC000456854693	331207548	/nfs/dbraw/zinc/20/75/48/331207548.db2.gz	YUIMMYFKYNIFDE-MLGOLLRUSA-N	0	0	293.357	4.231	20	30		CIEDRN
Cc1oc(C(C)C)cc1C(=O)Nc1cc(C)cc(C#N)c1	ZINC000456967942	331209234	/nfs/dbraw/zinc/20/92/34/331209234.db2.gz	PCUAEHOKIOVELC-UHFFFAOYSA-N	0	0	282.343	4.144	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)[C@H](C)C1CCC1	ZINC000457381591	331220560	/nfs/dbraw/zinc/22/05/60/331220560.db2.gz	HODSSNCHLVAOKH-LLVKDONJSA-N	0	0	297.851	4.352	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)c2[nH]ccc2C2CC2)CCCC1(C)C	ZINC000457763661	331233583	/nfs/dbraw/zinc/23/35/83/331233583.db2.gz	NIOJVLVDGRITPC-HNNXBMFYSA-N	0	0	286.419	4.099	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1[nH]ccc1C1CC1	ZINC000457783971	331234304	/nfs/dbraw/zinc/23/43/04/331234304.db2.gz	XRCWQQHOORBIQX-UHFFFAOYSA-N	0	0	280.371	4.263	20	30		CIEDRN
C=CCCCN(C)C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000458795672	331260018	/nfs/dbraw/zinc/26/00/18/331260018.db2.gz	CVCQLZZUFFJJAI-KRWDZBQOSA-N	0	0	299.418	4.029	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)N[C@@]2(C)CC=CCC2)cc1	ZINC000459342342	331277063	/nfs/dbraw/zinc/27/70/63/331277063.db2.gz	KNWWDZSFMYBSMI-SFHVURJKSA-N	0	0	297.402	4.108	20	30		CIEDRN
C[C@H](c1ccc(CN[C@H]2CCC[C@@H]2C#N)cc1)C(F)(F)F	ZINC000459451614	331281791	/nfs/dbraw/zinc/28/17/91/331281791.db2.gz	BDZQSYACZFUYQR-DFBGVHRSSA-N	0	0	296.336	4.134	20	30		CIEDRN
N#C[C@@H]1CCC[C@@H]1NCc1ccc(-c2cccs2)cc1	ZINC000459482798	331284243	/nfs/dbraw/zinc/28/42/43/331284243.db2.gz	RNRSMDLPLOFJAE-HOTGVXAUSA-N	0	0	282.412	4.197	20	30		CIEDRN
N#CCC[C@H](C#N)CN1CC2(CCCC2)[C@@H]1c1ccccc1	ZINC000459576958	331288998	/nfs/dbraw/zinc/28/89/98/331288998.db2.gz	VNWZXNHQJZJPDQ-AEFFLSMTSA-N	0	0	293.414	4.047	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(F)c(F)c2F)CCCC1	ZINC000459838017	331302421	/nfs/dbraw/zinc/30/24/21/331302421.db2.gz	RTXCAHXONHOVJF-UHFFFAOYSA-N	0	0	283.293	4.179	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)C1(C2CCC2)CCC1	ZINC000459883248	331302952	/nfs/dbraw/zinc/30/29/52/331302952.db2.gz	UNHKTXGPTMTALQ-UHFFFAOYSA-N	0	0	289.444	4.233	20	30		CIEDRN
C=CCN(C(=O)c1ccn(C(C)C)c1C)c1ccccc1	ZINC000459931180	331303602	/nfs/dbraw/zinc/30/36/02/331303602.db2.gz	MLSODGMONNXSMW-UHFFFAOYSA-N	0	0	282.387	4.210	20	30		CIEDRN
CC(C)CCN(C(=O)c1cscc1C#N)C1CCCC1	ZINC000459971239	331303868	/nfs/dbraw/zinc/30/38/68/331303868.db2.gz	QUPZIQUKKLUEMZ-UHFFFAOYSA-N	0	0	290.432	4.051	20	30		CIEDRN
C[C@@H]1CCN(C(=O)[C@]2(C#N)CC23CCCC3)c2ccccc21	ZINC000459988491	331304085	/nfs/dbraw/zinc/30/40/85/331304085.db2.gz	IZVUFEPINOJZSZ-AUUYWEPGSA-N	0	0	294.398	4.001	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cc(Br)ccc1C	ZINC000460009385	331304306	/nfs/dbraw/zinc/30/43/06/331304306.db2.gz	NYHCGNYCPXUIFT-UHFFFAOYSA-N	0	0	296.208	4.298	20	30		CIEDRN
C=CCC1(C(=O)Nc2cccc(Cl)c2OC)CCCC1	ZINC000460041215	331304605	/nfs/dbraw/zinc/30/46/05/331304605.db2.gz	MXSWDOACJHWOOF-UHFFFAOYSA-N	0	0	293.794	4.424	20	30		CIEDRN
C=CC(C)(C)C(=O)Nc1cc(Cl)ccc1SC	ZINC000460048700	331304757	/nfs/dbraw/zinc/30/47/57/331304757.db2.gz	IIWFXDVCMOTXCP-UHFFFAOYSA-N	0	0	269.797	4.213	20	30		CIEDRN
C=CCC1(C(=O)Nc2cc(C#N)ccc2OC)CCCCC1	ZINC000460073236	331305066	/nfs/dbraw/zinc/30/50/66/331305066.db2.gz	GYDFWJUOTSUSAP-UHFFFAOYSA-N	0	0	298.386	4.032	20	30		CIEDRN
CC1(C)CCC[C@@H](CC(=O)Nc2sccc2C#N)C1	ZINC000164836719	331305370	/nfs/dbraw/zinc/30/53/70/331305370.db2.gz	HMVBJPLDTWZPDU-NSHDSACASA-N	0	0	276.405	4.165	20	30		CIEDRN
CC(C)(C#N)CCCOc1cccc(Cl)c1F	ZINC000167126462	331308022	/nfs/dbraw/zinc/30/80/22/331308022.db2.gz	RSMYJBOBIWRUAS-UHFFFAOYSA-N	0	0	255.720	4.188	20	30		CIEDRN
C=CCCS[C@@H](C)C(=O)Nc1ccc(Cl)cc1C	ZINC000461247183	331312125	/nfs/dbraw/zinc/31/21/25/331312125.db2.gz	QJYBOXPISCZXEJ-NSHDSACASA-N	0	0	283.824	4.285	20	30		CIEDRN
C=CCCC(=O)N(c1ccccc1F)C1CCCC1	ZINC000461550526	331313873	/nfs/dbraw/zinc/31/38/73/331313873.db2.gz	VGGOGJOCCGSREP-UHFFFAOYSA-N	0	0	261.340	4.068	20	30		CIEDRN
CCCCCN(C(=O)N[C@@H]1CCC[C@H]1C#N)[C@@H](C)CCC	ZINC000461961662	331316263	/nfs/dbraw/zinc/31/62/63/331316263.db2.gz	BHURGMDTQDTHCI-HRCADAONSA-N	0	0	293.455	4.069	20	30		CIEDRN
CCCCCN(C(=O)N[C@@H]1CCC[C@H]1C#N)[C@H](C)CCC	ZINC000461961663	331316351	/nfs/dbraw/zinc/31/63/51/331316351.db2.gz	BHURGMDTQDTHCI-OWCLPIDISA-N	0	0	293.455	4.069	20	30		CIEDRN
Cc1nc(N2C[C@H](C)[C@@H]2c2ccccc2)c(Cl)cc1C#N	ZINC000461966785	331316374	/nfs/dbraw/zinc/31/63/74/331316374.db2.gz	PBEPZLSLAQXMKY-MEDUHNTESA-N	0	0	297.789	4.113	20	30		CIEDRN
CC(C)c1ccc([C@@H](NC(=O)CCCC#N)C(C)C)cc1	ZINC000462150153	331317977	/nfs/dbraw/zinc/31/79/77/331317977.db2.gz	IGNRXZKGIWTHCP-SFHVURJKSA-N	0	0	286.419	4.317	20	30		CIEDRN
CCC[C@@]1(C)CCCN(C(=O)[C@@H](C)c2cccc(C#N)c2)C1	ZINC000462194235	331318162	/nfs/dbraw/zinc/31/81/62/331318162.db2.gz	ZUNHDJWDBUMLAY-KXBFYZLASA-N	0	0	298.430	4.091	20	30		CIEDRN
CCC[C@@H]1[C@H](C)CCCN1C(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000462215348	331318547	/nfs/dbraw/zinc/31/85/47/331318547.db2.gz	VZXWLXIZFYDLPS-RVKKMQEKSA-N	0	0	298.430	4.089	20	30		CIEDRN
CCC[C@@H]1[C@@H](C)CCCN1C(=O)[C@H](C)c1cccc(C#N)c1	ZINC000462215345	331318554	/nfs/dbraw/zinc/31/85/54/331318554.db2.gz	VZXWLXIZFYDLPS-HDMKZQKVSA-N	0	0	298.430	4.089	20	30		CIEDRN
N#Cc1ccc(NCCCOc2cccc(Cl)c2)cc1	ZINC000462227278	331318651	/nfs/dbraw/zinc/31/86/51/331318651.db2.gz	YZMSSGPQWATMBA-UHFFFAOYSA-N	0	0	286.762	4.093	20	30		CIEDRN
Cc1ccc(NC(=O)[C@@H](C)c2cccc(C#N)c2)c(Cl)c1	ZINC000462300044	331318966	/nfs/dbraw/zinc/31/89/66/331318966.db2.gz	RMUPKOVJHAHMCP-LBPRGKRZSA-N	0	0	298.773	4.262	20	30		CIEDRN
C[C@H](C(=O)N(C)[C@@H](C)C1CCCCC1)c1cccc(C#N)c1	ZINC000462340274	331320132	/nfs/dbraw/zinc/32/01/32/331320132.db2.gz	LLQUHPPILBHXFT-GJZGRUSLSA-N	0	0	298.430	4.089	20	30		CIEDRN
COc1cc(CNc2c(Cl)cccc2C#N)ccc1C	ZINC000462367070	331320668	/nfs/dbraw/zinc/32/06/68/331320668.db2.gz	BXKTXIJJDYCCCE-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
N#Cc1cccc(Cl)c1NCc1ccc(F)c(F)c1	ZINC000462368433	331320674	/nfs/dbraw/zinc/32/06/74/331320674.db2.gz	IPLZERSLAFJUGD-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
N#Cc1cc(F)ccc1NCCc1ccccc1Cl	ZINC000462377594	331320859	/nfs/dbraw/zinc/32/08/59/331320859.db2.gz	PJMUTKVFJCKZFN-UHFFFAOYSA-N	0	0	274.726	4.005	20	30		CIEDRN
N#Cc1cc(F)ccc1N[C@@H]1CCc2c1cccc2Cl	ZINC000462376412	331320868	/nfs/dbraw/zinc/32/08/68/331320868.db2.gz	JTLMDUCGPKVNRK-MRXNPFEDSA-N	0	0	286.737	4.450	20	30		CIEDRN
C[C@@H](C(=O)N(C)[C@H](C)C1CCCCC1)c1cccc(C#N)c1	ZINC000462396909	331321274	/nfs/dbraw/zinc/32/12/74/331321274.db2.gz	LLQUHPPILBHXFT-HUUCEWRRSA-N	0	0	298.430	4.089	20	30		CIEDRN
N#Cc1cccc(Cl)c1NCc1ccc(F)cc1F	ZINC000462389789	331321318	/nfs/dbraw/zinc/32/13/18/331321318.db2.gz	OEQRCDUKQIJKBR-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
CCC1(CC)CCN(C(=O)[C@@H](C)c2cccc(C#N)c2)CC1	ZINC000462482295	331322582	/nfs/dbraw/zinc/32/25/82/331322582.db2.gz	FNIKDKFRALBDQL-HNNXBMFYSA-N	0	0	298.430	4.091	20	30		CIEDRN
CCC1(CC)CCN(C(=O)[C@H](C)c2cccc(C#N)c2)CC1	ZINC000462482296	331322589	/nfs/dbraw/zinc/32/25/89/331322589.db2.gz	FNIKDKFRALBDQL-OAHLLOKOSA-N	0	0	298.430	4.091	20	30		CIEDRN
Cc1ccc(Cl)cc1OCc1ccc(F)cc1C#N	ZINC000462651701	331324637	/nfs/dbraw/zinc/32/46/37/331324637.db2.gz	ACZXPWRQGJEFGD-UHFFFAOYSA-N	0	0	275.710	4.238	20	30		CIEDRN
CC(C)(C)C[C@@H]1CCCN1c1c(F)cc(C#N)cc1F	ZINC000462803529	331329839	/nfs/dbraw/zinc/32/98/39/331329839.db2.gz	KFJIMFDUVDRGMI-LBPRGKRZSA-N	0	0	278.346	4.241	20	30		CIEDRN
C[C@H](c1nc([C@@H]2CCC[C@@H](C)C2)no1)c1cccc(C#N)c1	ZINC000462830069	331331928	/nfs/dbraw/zinc/33/19/28/331331928.db2.gz	STICURVVMPTUDN-DVOMOZLQSA-N	0	0	295.386	4.387	20	30		CIEDRN
N#Cc1cc(F)ccc1NCC1(Sc2ccccc2)CC1	ZINC000462832369	331331954	/nfs/dbraw/zinc/33/19/54/331331954.db2.gz	GDBAHNGSRCHDTJ-UHFFFAOYSA-N	0	0	298.386	4.434	20	30		CIEDRN
Cc1cccc2c(CCNc3ccc(C#N)cc3F)c[nH]c21	ZINC000462867872	331333209	/nfs/dbraw/zinc/33/32/09/331333209.db2.gz	NDCYYTTUMQJBJC-UHFFFAOYSA-N	0	0	293.345	4.142	20	30		CIEDRN
CS[C@@H]1CCC[C@@H](Nc2c(Cl)cccc2C#N)C1	ZINC000462868842	331333355	/nfs/dbraw/zinc/33/33/55/331333355.db2.gz	STDINNJWZAKSLM-VXGBXAGGSA-N	0	0	280.824	4.298	20	30		CIEDRN
CCC[C@@H](CCc1ccccc1)Nc1ncccc1C#N	ZINC000462878284	331333777	/nfs/dbraw/zinc/33/37/77/331333777.db2.gz	LIDKSENSLKTZSF-KRWDZBQOSA-N	0	0	279.387	4.167	20	30		CIEDRN
CCC[C@H](CCc1ccccc1)Nc1ncccc1C#N	ZINC000462878285	331333863	/nfs/dbraw/zinc/33/38/63/331333863.db2.gz	LIDKSENSLKTZSF-QGZVFWFLSA-N	0	0	279.387	4.167	20	30		CIEDRN
N#Cc1c(F)cccc1N[C@@H]1CC[C@H]2CCC[C@H]2C1	ZINC000462902732	331334383	/nfs/dbraw/zinc/33/43/83/331334383.db2.gz	PNCMJUOIFAETNH-FRRDWIJNSA-N	0	0	258.340	4.078	20	30		CIEDRN
N#Cc1ccc(N[C@@H]2CC[C@H]3CCC[C@H]3C2)c(F)c1	ZINC000462900665	331334411	/nfs/dbraw/zinc/33/44/11/331334411.db2.gz	DCUYSJCAZWOCJI-HZSPNIEDSA-N	0	0	258.340	4.078	20	30		CIEDRN
N#Cc1cc(F)ccc1N[C@@H]1CC[C@@H]2CCC[C@H]2C1	ZINC000462911607	331334883	/nfs/dbraw/zinc/33/48/83/331334883.db2.gz	LDPGWOOCFYSUIT-SLEUVZQESA-N	0	0	258.340	4.078	20	30		CIEDRN
N#Cc1cc(F)ccc1N[C@@H]1CC[C@H]2CCC[C@H]2C1	ZINC000462911609	331334955	/nfs/dbraw/zinc/33/49/55/331334955.db2.gz	LDPGWOOCFYSUIT-TYNCELHUSA-N	0	0	258.340	4.078	20	30		CIEDRN
Cc1cccc(CNc2c(Cl)cccc2C#N)c1	ZINC000462918495	331335125	/nfs/dbraw/zinc/33/51/25/331335125.db2.gz	IIKQKXVBZVGJPP-UHFFFAOYSA-N	0	0	256.736	4.132	20	30		CIEDRN
CC[C@]1(C)CCCN(c2cc(C#N)c3ccccc3n2)C1	ZINC000462945160	331335642	/nfs/dbraw/zinc/33/56/42/331335642.db2.gz	HIUSRORCUOXMNM-GOSISDBHSA-N	0	0	279.387	4.123	20	30		CIEDRN
C[C@@H](CNc1ccc(C#N)cc1)Oc1ccc(Cl)cc1	ZINC000462951781	331335831	/nfs/dbraw/zinc/33/58/31/331335831.db2.gz	HSXBEOZXZGKDNR-LBPRGKRZSA-N	0	0	286.762	4.091	20	30		CIEDRN
CCC[C@]1(C)CCCN(c2ccc(Cl)c(C#N)n2)C1	ZINC000463068295	331339182	/nfs/dbraw/zinc/33/91/82/331339182.db2.gz	KDMWOUYZJHVGJY-OAHLLOKOSA-N	0	0	277.799	4.013	20	30		CIEDRN
Cc1ccc([C@H]2CCC[C@H]2N(C)c2ncccc2C#N)cc1	ZINC000463070483	331339347	/nfs/dbraw/zinc/33/93/47/331339347.db2.gz	NYTBROFUTLNHLR-QZTJIDSGSA-N	0	0	291.398	4.034	20	30		CIEDRN
Cc1ccc(CC[C@@H](C)Nc2cccc(F)c2C#N)o1	ZINC000463078375	331339770	/nfs/dbraw/zinc/33/97/70/331339770.db2.gz	XBRMAIIVSIBQAI-LLVKDONJSA-N	0	0	272.323	4.032	20	30		CIEDRN
C[C@@H](CNc1cccc(F)c1C#N)Sc1ccccc1	ZINC000463081022	331339811	/nfs/dbraw/zinc/33/98/11/331339811.db2.gz	HRJDAKCKVQHQMR-LBPRGKRZSA-N	0	0	286.375	4.290	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N(CCC)CC1CC1	ZINC000463254156	331344524	/nfs/dbraw/zinc/34/45/24/331344524.db2.gz	BXBMHHFTSOHKGC-UHFFFAOYSA-N	0	0	289.444	4.227	20	30		CIEDRN
C=CCN(C(=O)N[C@@H]1c2ccccc2CCC[C@@H]1C)C1CC1	ZINC000463284064	331345163	/nfs/dbraw/zinc/34/51/63/331345163.db2.gz	GQVFTUYGBPJILW-KSSFIOAISA-N	0	0	298.430	4.060	20	30		CIEDRN
CCSCc1cccc(N[C@H]2CCC[C@@H](C#N)C2)c1	ZINC000463291886	331345402	/nfs/dbraw/zinc/34/54/02/331345402.db2.gz	PZBJMFYVGDPEQT-HIFRSBDPSA-N	0	0	274.433	4.434	20	30		CIEDRN
Cc1cc(F)cc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)c1	ZINC000463410331	331347162	/nfs/dbraw/zinc/34/71/62/331347162.db2.gz	AVUDQTCELJEZDP-UHFFFAOYSA-N	0	0	296.345	4.188	20	30		CIEDRN
CC(C)N(C(=O)[C@H](C)c1cccc(C#N)c1)c1ccccc1	ZINC000463457003	331347981	/nfs/dbraw/zinc/34/79/81/331347981.db2.gz	JHNMVUXSOJRGMF-OAHLLOKOSA-N	0	0	292.382	4.103	20	30		CIEDRN
CCCC[C@H](CC)C(=O)Nc1sc(CC)cc1C#N	ZINC000463457873	331348080	/nfs/dbraw/zinc/34/80/80/331348080.db2.gz	LVNYJRSJXKKXRF-NSHDSACASA-N	0	0	278.421	4.337	20	30		CIEDRN
C=CCCCN(C)C(=O)N[C@H]1CCCCC12CCCC2	ZINC000463543273	331349280	/nfs/dbraw/zinc/34/92/80/331349280.db2.gz	KQPMZIDILVJJTF-HNNXBMFYSA-N	0	0	278.440	4.097	20	30		CIEDRN
CC[C@@H](C(=O)N(CC)c1ccc(C#N)cc1)c1ccccc1	ZINC000463960639	331354683	/nfs/dbraw/zinc/35/46/83/331354683.db2.gz	WXZVPRNASCOFCL-GOSISDBHSA-N	0	0	292.382	4.105	20	30		CIEDRN
CC(C)C[C@](C)(C#N)NC(=O)c1ccc(C2CCCC2)cc1	ZINC000464137943	331357068	/nfs/dbraw/zinc/35/70/68/331357068.db2.gz	OLNLHKQFNXSYMI-LJQANCHMSA-N	0	0	298.430	4.402	20	30		CIEDRN
CC(C)(C)[C@@](C)(C#N)NC(=O)C[C@@H]1CCCC(C)(C)C1	ZINC000464165603	331357147	/nfs/dbraw/zinc/35/71/47/331357147.db2.gz	FVNWGJKHRNBKOC-SUMWQHHRSA-N	0	0	278.440	4.037	20	30		CIEDRN
CC(C)(C)[C@](C)(C#N)NC(=O)CCCC1CCCCC1	ZINC000464166853	331357410	/nfs/dbraw/zinc/35/74/10/331357410.db2.gz	IULGMDUUZGLJBN-KRWDZBQOSA-N	0	0	278.440	4.182	20	30		CIEDRN
Cc1ccc(C(=O)N[C@@](C)(C#N)C(C)(C)C)c(Cl)c1C	ZINC000464168591	331357445	/nfs/dbraw/zinc/35/74/45/331357445.db2.gz	HPTQBKNHQWXXPS-INIZCTEOSA-N	0	0	292.810	4.015	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](c1ccccc1)C1CCC1	ZINC000464435862	331360453	/nfs/dbraw/zinc/36/04/53/331360453.db2.gz	ADUSAOSAPBQIJL-WMLDXEAASA-N	0	0	271.404	4.246	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](CC(F)(F)F)c1ccccc1	ZINC000464435169	331360516	/nfs/dbraw/zinc/36/05/16/331360516.db2.gz	CLOAIANIUPXCDI-OCCSQVGLSA-N	0	0	299.336	4.399	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](CC)c1ccccc1OCC	ZINC000464440430	331360638	/nfs/dbraw/zinc/36/06/38/331360638.db2.gz	JIZOBLFDYWXXHY-HOCLYGCPSA-N	0	0	289.419	4.255	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NC(C)(C)Cc1ccccc1Cl	ZINC000464442072	331360797	/nfs/dbraw/zinc/36/07/97/331360797.db2.gz	MUMHEERKGVGKKB-ZDUSSCGKSA-N	0	0	293.838	4.380	20	30		CIEDRN
CC[C@@H](C(=O)N(CCC#N)C(C)(C)CC)c1ccccc1	ZINC000464463051	331361124	/nfs/dbraw/zinc/36/11/24/331361124.db2.gz	TZNATHCWYNBUDW-MRXNPFEDSA-N	0	0	286.419	4.111	20	30		CIEDRN
C=CC[C@H](C(=O)N(C)[C@H]1CCC(C)(C)C1)c1ccccc1	ZINC000464491571	331361470	/nfs/dbraw/zinc/36/14/70/331361470.db2.gz	YNFSWPPGASBSPM-IRXDYDNUSA-N	0	0	285.431	4.383	20	30		CIEDRN
CC#CCCCC(=O)Nc1cccc(OC2CCCC2)c1	ZINC000464531468	331361879	/nfs/dbraw/zinc/36/18/79/331361879.db2.gz	ADJOQTZFHJKGOC-UHFFFAOYSA-N	0	0	285.387	4.140	20	30		CIEDRN
CC#CCCCC(=O)N(CCC)[C@H]1CCc2ccccc21	ZINC000464533582	331361985	/nfs/dbraw/zinc/36/19/85/331361985.db2.gz	HHWVYRWSDVYIKR-SFHVURJKSA-N	0	0	283.415	4.106	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCCCSc1ccc(F)cc1	ZINC000464541700	331362106	/nfs/dbraw/zinc/36/21/06/331362106.db2.gz	VWTMCKWHOXWHTG-ZDUSSCGKSA-N	0	0	295.423	4.026	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCc1cccc(OCCCC)c1	ZINC000464551798	331362369	/nfs/dbraw/zinc/36/23/69/331362369.db2.gz	JQDUAZFHWCTUMW-OAHLLOKOSA-N	0	0	289.419	4.084	20	30		CIEDRN
CC#CCCCC(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000464555375	331362413	/nfs/dbraw/zinc/36/24/13/331362413.db2.gz	YURJCPFNEMJSPJ-UHFFFAOYSA-N	0	0	270.159	4.126	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NC1CCC(c2ccccc2)CC1	ZINC000464554613	331362444	/nfs/dbraw/zinc/36/24/44/331362444.db2.gz	NEJXAYSRZHMQCY-FAEJEUNOSA-N	0	0	285.431	4.431	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC)c1cccc(C)c1C	ZINC000464564509	331362727	/nfs/dbraw/zinc/36/27/27/331362727.db2.gz	DLSPKOLFBYGZOO-AWEZNQCLSA-N	0	0	259.393	4.259	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CC[C@@H](C)c2ccccc21	ZINC000464569386	331362835	/nfs/dbraw/zinc/36/28/35/331362835.db2.gz	ITSFGLBMZVSMIS-ZIAGYGMSSA-N	0	0	257.377	4.129	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](C)c2ccccc21	ZINC000464569383	331362882	/nfs/dbraw/zinc/36/28/82/331362882.db2.gz	ITSFGLBMZVSMIS-KBPBESRZSA-N	0	0	257.377	4.129	20	30		CIEDRN
Cc1ccc(/C=C/CC(=O)Nc2ccc(C#N)c(F)c2)cc1	ZINC000464635300	331363979	/nfs/dbraw/zinc/36/39/79/331363979.db2.gz	CVSKUJNLIRJHHA-NSCUHMNNSA-N	0	0	294.329	4.048	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccc2nc(C3CC3)sc2c1	ZINC000464647445	331364083	/nfs/dbraw/zinc/36/40/83/331364083.db2.gz	APCOLWSUMIZGRR-UHFFFAOYSA-N	0	0	298.411	4.306	20	30		CIEDRN
CC(C)[C@H](C(=O)Nc1ccc(C#N)c(F)c1)c1ccccc1	ZINC000464647616	331364143	/nfs/dbraw/zinc/36/41/43/331364143.db2.gz	FMUOUGWBNWXGMT-KRWDZBQOSA-N	0	0	296.345	4.076	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(-c2ccccc2)cn1	ZINC000464646502	331364147	/nfs/dbraw/zinc/36/41/47/331364147.db2.gz	HQBRHKVPFQNBFI-AWEZNQCLSA-N	0	0	280.371	4.289	20	30		CIEDRN
C[C@@H](CCC(=O)Nc1ccc(C#N)c(F)c1)c1ccccc1	ZINC000464650382	331364229	/nfs/dbraw/zinc/36/42/29/331364229.db2.gz	SHTMADWMFVFGNV-ZDUSSCGKSA-N	0	0	296.345	4.220	20	30		CIEDRN
Cc1ccccc1[C@@H](C)CC(=O)Nc1ccc(C#N)c(F)c1	ZINC000464655193	331364329	/nfs/dbraw/zinc/36/43/29/331364329.db2.gz	NFIUVKNUYJOIAO-ZDUSSCGKSA-N	0	0	296.345	4.138	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000464653546	331364380	/nfs/dbraw/zinc/36/43/80/331364380.db2.gz	SPOVBWLQFGQDCB-QZTJIDSGSA-N	0	0	283.415	4.023	20	30		CIEDRN
CC(C)(C)[C@H](C#N)NC(=O)c1cscc1-c1ccccc1	ZINC000464714506	331365142	/nfs/dbraw/zinc/36/51/42/331365142.db2.gz	UONKZODCIZVWOT-HNNXBMFYSA-N	0	0	298.411	4.083	20	30		CIEDRN
N#CCN(C1CC1)[C@H]1CCCC[C@@H]1C1CCCCC1	ZINC000464728968	331365379	/nfs/dbraw/zinc/36/53/79/331365379.db2.gz	HPGHQSJITFDSAW-SJORKVTESA-N	0	0	260.425	4.113	20	30		CIEDRN
C=C[C@@H](C)NC(=O)N(CCC)[C@H](CC)c1ccccc1	ZINC000464760132	331366516	/nfs/dbraw/zinc/36/65/16/331366516.db2.gz	CJZQPZCLAQUMKJ-GDBMZVCRSA-N	0	0	274.408	4.134	20	30		CIEDRN
C=C[C@@H](C)NC(=O)N(CCC)[C@@H](CC)c1ccccc1	ZINC000464760135	331366547	/nfs/dbraw/zinc/36/65/47/331366547.db2.gz	CJZQPZCLAQUMKJ-ZBFHGGJFSA-N	0	0	274.408	4.134	20	30		CIEDRN
CC(C)(C#N)CCCN1CCc2c1cccc2Cl	ZINC000464818304	331369550	/nfs/dbraw/zinc/36/95/50/331369550.db2.gz	LIILZOOSYICYRN-UHFFFAOYSA-N	0	0	262.784	4.032	20	30		CIEDRN
C[C@H]1CCN(Cc2ccc(F)cc2C#N)[C@H](c2ccco2)C1	ZINC000464854818	331371260	/nfs/dbraw/zinc/37/12/60/331371260.db2.gz	RBRIMZBZFLMERM-GUYCJALGSA-N	0	0	298.361	4.264	20	30		CIEDRN
C=CCCC(=O)N1CCc2cc(-c3cccc(F)c3)ccc21	ZINC000464880268	331372591	/nfs/dbraw/zinc/37/25/91/331372591.db2.gz	VORAENNMUDTNJW-UHFFFAOYSA-N	0	0	295.357	4.348	20	30		CIEDRN
CCC[C@H](C)CC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1	ZINC000464952488	331374342	/nfs/dbraw/zinc/37/43/42/331374342.db2.gz	OBWLNWOOZOKDSR-JQHSSLGASA-N	0	0	298.430	4.111	20	30		CIEDRN
C=CCCCC(=O)NCc1ccc(C)cc1O[C@H](C)CC	ZINC000464992553	331375389	/nfs/dbraw/zinc/37/53/89/331375389.db2.gz	HKIKOAODCMVXJO-OAHLLOKOSA-N	0	0	289.419	4.145	20	30		CIEDRN
C=C[C@H](C)NC(=O)C1(c2ccc(Cl)c(Cl)c2)CCC1	ZINC000465110146	331378581	/nfs/dbraw/zinc/37/85/81/331378581.db2.gz	FOTIGKSDKXUYJM-JTQLQIEISA-N	0	0	298.213	4.106	20	30		CIEDRN
C=C[C@H](C)NC(=O)c1oc2c(ccc3ccccc23)c1C	ZINC000465147131	331379646	/nfs/dbraw/zinc/37/96/46/331379646.db2.gz	FBGQPAZRSUMXQK-NSHDSACASA-N	0	0	279.339	4.199	20	30		CIEDRN
C=C[C@@H](C)NC(=O)Nc1cccc(CSC(C)C)c1C	ZINC000465251171	331380788	/nfs/dbraw/zinc/38/07/88/331380788.db2.gz	IONYBRAERUMUAX-GFCCVEGCSA-N	0	0	292.448	4.333	20	30		CIEDRN
C=C[C@@H](C)NC(=O)Nc1ccc2nc(C(C)C)sc2c1	ZINC000465250428	331380792	/nfs/dbraw/zinc/38/07/92/331380792.db2.gz	FXUKWGVSGAPXLJ-SNVBAGLBSA-N	0	0	289.404	4.116	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@H](CCC)CCc1ccccc1	ZINC000466052252	331389017	/nfs/dbraw/zinc/38/90/17/331389017.db2.gz	ATECAZRVZIUFLM-NVXWUHKLSA-N	0	0	288.435	4.052	20	30		CIEDRN
CC[C@H](C)C[C@@H](C)NC(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000466166993	331390392	/nfs/dbraw/zinc/39/03/92/331390392.db2.gz	MSLACAVDLKJQSU-WDEREUQCSA-N	0	0	293.798	4.158	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000466238890	331391423	/nfs/dbraw/zinc/39/14/23/331391423.db2.gz	BHVWFLLITAZDGA-LSDHHAIUSA-N	0	0	259.393	4.083	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1[C@H](C)Cc2cc(F)ccc2[C@@H]1C	ZINC000466242938	331391521	/nfs/dbraw/zinc/39/15/21/331391521.db2.gz	FVCLUHVNUGQMQK-MJBXVCDLSA-N	0	0	289.394	4.262	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H]1c2ccccc2CC[C@H]1C	ZINC000466245379	331391583	/nfs/dbraw/zinc/39/15/83/331391583.db2.gz	IBIFCPVOKLFTQX-JKIFEVAISA-N	0	0	271.404	4.029	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1csc2ccccc12	ZINC000466248724	331391649	/nfs/dbraw/zinc/39/16/49/331391649.db2.gz	LWKRXBUHHSGYOA-LLVKDONJSA-N	0	0	259.374	4.442	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCc1cc(Cl)sc1Cl	ZINC000466260656	331391836	/nfs/dbraw/zinc/39/18/36/331391836.db2.gz	WLJROWGQFBXUIL-MRVPVSSYSA-N	0	0	292.231	4.273	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(Cc1ccccc1)[C@@H](C)CC	ZINC000466321187	331392757	/nfs/dbraw/zinc/39/27/57/331392757.db2.gz	UGTNLJBJZINCEH-DOTOQJQBSA-N	0	0	288.435	4.351	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N1CCCC2(CCCCC2)C1	ZINC000466323426	331392798	/nfs/dbraw/zinc/39/27/98/331392798.db2.gz	WOPZPJTXRGOFCK-OAHLLOKOSA-N	0	0	278.440	4.097	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N(C)Cc1ccc(C(C)C)cc1	ZINC000466361207	331393409	/nfs/dbraw/zinc/39/34/09/331393409.db2.gz	QWMZSWYGXSLWCF-SFHVURJKSA-N	0	0	273.420	4.371	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000466362687	331393457	/nfs/dbraw/zinc/39/34/57/331393457.db2.gz	PXOCLZXPEXYZHM-HXUWFJFHSA-N	0	0	299.458	4.460	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(C)Cc1ccc2ccccc2c1	ZINC000466366473	331393475	/nfs/dbraw/zinc/39/34/75/331393475.db2.gz	HZVQKZSPINHDAG-GOSISDBHSA-N	0	0	296.414	4.336	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CC[C@@H](C)C[C@H]1c1ccco1	ZINC000466367619	331393583	/nfs/dbraw/zinc/39/35/83/331393583.db2.gz	XJNGIANRWJFGMT-ILXRZTDVSA-N	0	0	290.407	4.117	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CCC2(CCCCC2)CC1	ZINC000466366703	331393622	/nfs/dbraw/zinc/39/36/22/331393622.db2.gz	KTQDXXZLHGBWCH-HNNXBMFYSA-N	0	0	278.440	4.097	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1cccc(COC(C)C)c1	ZINC000466377506	331393894	/nfs/dbraw/zinc/39/38/94/331393894.db2.gz	FHUHLWAFZVINEJ-HNNXBMFYSA-N	0	0	290.407	4.088	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000466377528	331393933	/nfs/dbraw/zinc/39/39/33/331393933.db2.gz	ULROPJFLBCUBHQ-OYTYHKKUSA-N	0	0	298.430	4.229	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(C)CCCCc1ccccc1	ZINC000466385253	331394204	/nfs/dbraw/zinc/39/42/04/331394204.db2.gz	CBLKLKGKZZNROG-KRWDZBQOSA-N	0	0	288.435	4.005	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CCCC(C)(C)[C@@H]1CC=C	ZINC000466384408	331394241	/nfs/dbraw/zinc/39/42/41/331394241.db2.gz	XBVPYVXYRGYBHS-GJZGRUSLSA-N	0	0	278.440	4.117	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N1CCC[C@@H]1c1ccc(C)cc1	ZINC000466388631	331394425	/nfs/dbraw/zinc/39/44/25/331394425.db2.gz	ZOGXPWGUMQQUFE-IAGOWNOFSA-N	0	0	286.419	4.196	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N1CCC[C@H]1c1ccc(C)cc1	ZINC000466388633	331394460	/nfs/dbraw/zinc/39/44/60/331394460.db2.gz	ZOGXPWGUMQQUFE-SJORKVTESA-N	0	0	286.419	4.196	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CCC[C@@H]1c1ccc(C)cc1	ZINC000466388630	331394469	/nfs/dbraw/zinc/39/44/69/331394469.db2.gz	ZOGXPWGUMQQUFE-DLBZAZTESA-N	0	0	286.419	4.196	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(CC(C)C)CC(C)(C)C	ZINC000466395908	331394796	/nfs/dbraw/zinc/39/47/96/331394796.db2.gz	MBJQDOBQGLVBNM-CQSZACIVSA-N	0	0	268.445	4.055	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1ccccc1Cc1ccccc1	ZINC000466400440	331394974	/nfs/dbraw/zinc/39/49/74/331394974.db2.gz	UIHCLQOMFYSJFQ-UHFFFAOYSA-N	0	0	294.398	4.317	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(CC)[C@@H](C)Cc1ccsc1	ZINC000466401518	331395113	/nfs/dbraw/zinc/39/51/13/331395113.db2.gz	ZRQUFZVKWKBXQO-DZGCQCFKSA-N	0	0	294.464	4.065	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC(C)(C)CC(C)(C)C1	ZINC000466403588	331395198	/nfs/dbraw/zinc/39/51/98/331395198.db2.gz	HUDLXKOHQFBQHE-UHFFFAOYSA-N	0	0	263.425	4.040	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1ccc(C(C)C)cc1	ZINC000466407372	331395464	/nfs/dbraw/zinc/39/54/64/331395464.db2.gz	OVSJTVAOUYBQRK-AWEZNQCLSA-N	0	0	260.381	4.286	20	30		CIEDRN
CC[C@H](C#N)Nc1cc(Cl)ccc1OCC1CCC1	ZINC000466409973	331395650	/nfs/dbraw/zinc/39/56/50/331395650.db2.gz	NXFLHGXMTMFUDX-CYBMUJFWSA-N	0	0	278.783	4.233	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCCC[C@@H]1[C@@H](C)CC	ZINC000466418684	331396057	/nfs/dbraw/zinc/39/60/57/331396057.db2.gz	ZSKGULQSJSDJET-SOUVJXGZSA-N	0	0	251.414	4.016	20	30		CIEDRN
CC#CCCCC(=O)NC1(c2cccc(C)c2)CCCC1	ZINC000466418521	331396069	/nfs/dbraw/zinc/39/60/69/331396069.db2.gz	YLCSIJKNQNJTAI-UHFFFAOYSA-N	0	0	283.415	4.074	20	30		CIEDRN
CC#CCCCC(=O)N1CC(C)(C)Sc2ccccc21	ZINC000466420396	331396192	/nfs/dbraw/zinc/39/61/92/331396192.db2.gz	AGXADKQZYXWJKB-UHFFFAOYSA-N	0	0	287.428	4.098	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](c1ccc(F)cc1F)C(C)C	ZINC000466424605	331396502	/nfs/dbraw/zinc/39/65/02/331396502.db2.gz	IYTJOCUOGKLVDU-BLLLJJGKSA-N	0	0	295.373	4.380	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CCC[C@H]1c1ccccc1	ZINC000466425754	331396632	/nfs/dbraw/zinc/39/66/32/331396632.db2.gz	MZUDUONHOQHTSY-BHYGNILZSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](Cc2ccccc2)[C@@H]1C	ZINC000466427229	331396738	/nfs/dbraw/zinc/39/67/38/331396738.db2.gz	WPKQTJQUJCHFHC-XYJFISCASA-N	0	0	285.431	4.068	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](c1ccccc1C)C1CC1	ZINC000466433689	331397019	/nfs/dbraw/zinc/39/70/19/331397019.db2.gz	FLVXMDZPMBYRBA-WMLDXEAASA-N	0	0	271.404	4.165	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCc1ccc(C)cc1OCCC	ZINC000466433740	331397042	/nfs/dbraw/zinc/39/70/42/331397042.db2.gz	KDZCRCDSOMDRME-HNNXBMFYSA-N	0	0	289.419	4.002	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cccc(CSCC)c1	ZINC000466438713	331397085	/nfs/dbraw/zinc/39/70/85/331397085.db2.gz	OOOMVLXENCPPDO-CYBMUJFWSA-N	0	0	277.433	4.481	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H](CC)c1ccc(Cl)s1	ZINC000466437806	331397091	/nfs/dbraw/zinc/39/70/91/331397091.db2.gz	DYMQVTDQSZYBJD-NSHDSACASA-N	0	0	283.824	4.162	20	30		CIEDRN
CC#CCCCC(=O)N[C@H](CC)c1ccc(Cl)s1	ZINC000466437805	331397097	/nfs/dbraw/zinc/39/70/97/331397097.db2.gz	DYMQVTDQSZYBJD-LLVKDONJSA-N	0	0	283.824	4.162	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)C1CCC(C)(C)CC1	ZINC000466439223	331397102	/nfs/dbraw/zinc/39/71/02/331397102.db2.gz	VLZLQVNBDBPXMB-ZDUSSCGKSA-N	0	0	251.414	4.016	20	30		CIEDRN
CC#CCCCC(=O)Nc1cccc(CSCC)c1	ZINC000466437614	331397175	/nfs/dbraw/zinc/39/71/75/331397175.db2.gz	CMTKNKWGHUDQAU-UHFFFAOYSA-N	0	0	275.417	4.072	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@@H]1CCCC[C@H]1CC	ZINC000466441443	331397198	/nfs/dbraw/zinc/39/71/98/331397198.db2.gz	NTHLZMDWPIYPNH-RRFJBIMHSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](C1CCCCC1)C(F)(F)F	ZINC000466440580	331397248	/nfs/dbraw/zinc/39/72/48/331397248.db2.gz	DFHPMGBHFJKJHU-AAEUAGOBSA-N	0	0	291.357	4.216	20	30		CIEDRN
C=CCCCC(=O)Nc1ccccc1NC(C)(C)C	ZINC000466445734	331397355	/nfs/dbraw/zinc/39/73/55/331397355.db2.gz	JKEXYNQZMLWANZ-UHFFFAOYSA-N	0	0	260.381	4.192	20	30		CIEDRN
C=C[C@H](CC(=O)N(CC)c1ncccc1C)c1ccccc1	ZINC000466516595	331398921	/nfs/dbraw/zinc/39/89/21/331398921.db2.gz	GPCXNMYDCMGQMG-MRXNPFEDSA-N	0	0	294.398	4.103	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)C(C)(C)c1ccccc1Cl	ZINC000466526198	331399107	/nfs/dbraw/zinc/39/91/07/331399107.db2.gz	CFRCUHYBWXYOLX-LBPRGKRZSA-N	0	0	279.811	4.089	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)C(C)(C)c1ccc(Cl)cc1	ZINC000466531705	331399152	/nfs/dbraw/zinc/39/91/52/331399152.db2.gz	ZDOKVBLKQXVHEO-CQSZACIVSA-N	0	0	279.811	4.089	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)C1(Cc2cccc(F)c2)CCC1	ZINC000466535322	331399419	/nfs/dbraw/zinc/39/94/19/331399419.db2.gz	YJYIJDGNHNKXKM-MRXNPFEDSA-N	0	0	289.394	4.009	20	30		CIEDRN
C=CCCN(C)C(=O)C1(c2c(Cl)cccc2Cl)CC1	ZINC000466638267	331401280	/nfs/dbraw/zinc/40/12/80/331401280.db2.gz	YWOGGNOMQPTDGJ-UHFFFAOYSA-N	0	0	298.213	4.060	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](c1ccc(F)c(C)c1)C1CC1	ZINC000466642379	331401401	/nfs/dbraw/zinc/40/14/01/331401401.db2.gz	SRWGXAZETNSMRM-CXAGYDPISA-N	0	0	289.394	4.304	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](CCCC)C1CCC1	ZINC000466651599	331401688	/nfs/dbraw/zinc/40/16/88/331401688.db2.gz	ORVXHTAIWKINCO-HIFRSBDPSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H](C(C)(C)C)CC1	ZINC000466662661	331402047	/nfs/dbraw/zinc/40/20/47/331402047.db2.gz	ZLQXLMOVIVMATE-GJZGRUSLSA-N	0	0	265.441	4.264	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](C)Oc2ccc(Cl)cc21	ZINC000466858140	331406520	/nfs/dbraw/zinc/40/65/20/331406520.db2.gz	GIEOZDYSVFBKTA-NWDGAFQWSA-N	0	0	293.794	4.056	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(c1ccccc1C)C(C)C	ZINC000466861177	331406623	/nfs/dbraw/zinc/40/66/23/331406623.db2.gz	BCZZDLYLZPBSKY-HNNXBMFYSA-N	0	0	259.393	4.339	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000466863252	331406635	/nfs/dbraw/zinc/40/66/35/331406635.db2.gz	NCGYYBIWSDDUCU-SNVBAGLBSA-N	0	0	296.292	4.118	20	30		CIEDRN
CC#CCCCC(=O)N(C)[C@H]1CCC[C@@H]1c1ccc(C)cc1	ZINC000466862977	331406702	/nfs/dbraw/zinc/40/67/02/331406702.db2.gz	XNQRQYFDCZOLNJ-MOPGFXCFSA-N	0	0	297.442	4.283	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCCc2c(Cl)ccc(F)c21	ZINC000466868103	331406842	/nfs/dbraw/zinc/40/68/42/331406842.db2.gz	OHXDYHJHPTVMJK-LLVKDONJSA-N	0	0	295.785	4.361	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCCC[C@H]1CCC(C)C	ZINC000466874010	331406916	/nfs/dbraw/zinc/40/69/16/331406916.db2.gz	MUGHLZHUWISFFD-CVEARBPZSA-N	0	0	265.441	4.406	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(-c2ccc[nH]2)cc1	ZINC000466872746	331406923	/nfs/dbraw/zinc/40/69/23/331406923.db2.gz	YHJNLVZMFSACOH-CYBMUJFWSA-N	0	0	268.360	4.223	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1nc2c(ccc(F)c2F)s1	ZINC000466879159	331407042	/nfs/dbraw/zinc/40/70/42/331407042.db2.gz	XTRQWGJEKUOPIO-QMMMGPOBSA-N	0	0	296.342	4.115	20	30		CIEDRN
C=CCCN(C)C(=O)N[C@H](c1ccc(Cl)cc1)C1CC1	ZINC000466921775	331408256	/nfs/dbraw/zinc/40/82/56/331408256.db2.gz	OVJSQXHXBPZQKP-HNNXBMFYSA-N	0	0	292.810	4.009	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cnn(-c2ccc(C)cc2C)c1	ZINC000467116006	331411277	/nfs/dbraw/zinc/41/12/77/331411277.db2.gz	KCXJJVMAOBXXJK-OAHLLOKOSA-N	0	0	297.402	4.030	20	30		CIEDRN
C=C(CC)CSCc1nnc(-c2ccccc2)s1	ZINC000467311183	331414765	/nfs/dbraw/zinc/41/47/65/331414765.db2.gz	NDDMAKCACODATH-UHFFFAOYSA-N	0	0	276.430	4.405	20	30		CIEDRN
C=CCC(CC=C)C(=O)NC[C@@H](CC)c1ccccc1	ZINC000467319550	331414973	/nfs/dbraw/zinc/41/49/73/331414973.db2.gz	JOPYWISQNYUARM-OAHLLOKOSA-N	0	0	271.404	4.065	20	30		CIEDRN
C=CCC(CC=C)C(=O)NCc1oc2ccccc2c1C	ZINC000467353144	331415901	/nfs/dbraw/zinc/41/59/01/331415901.db2.gz	JXPVIKVOCMEYJI-UHFFFAOYSA-N	0	0	283.371	4.126	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N(C)Cc1c(F)cccc1Cl	ZINC000467427714	331418698	/nfs/dbraw/zinc/41/86/98/331418698.db2.gz	MVTBPQDEYIJPID-HNNXBMFYSA-N	0	0	283.774	4.040	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1ccc2c3c(cccc31)CC2	ZINC000467682230	331423195	/nfs/dbraw/zinc/42/31/95/331423195.db2.gz	WQDTZPVEVLVSPQ-HNNXBMFYSA-N	0	0	279.383	4.023	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc(Cl)c(F)c1	ZINC000467828057	331424388	/nfs/dbraw/zinc/42/43/88/331424388.db2.gz	HZHNRJZRVUKNSR-UHFFFAOYSA-N	0	0	267.731	4.186	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc(OC(C)C)cc1	ZINC000467827889	331424392	/nfs/dbraw/zinc/42/43/92/331424392.db2.gz	GCHVMQOBMSCNPV-UHFFFAOYSA-N	0	0	273.376	4.181	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)NCC(C)(C)C1=CCCCC1	ZINC000467885586	331425170	/nfs/dbraw/zinc/42/51/70/331425170.db2.gz	FRFXIFUYWCPHNV-KRWDZBQOSA-N	0	0	263.425	4.232	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)NCCc1csc2ccccc12	ZINC000467943261	331425945	/nfs/dbraw/zinc/42/59/45/331425945.db2.gz	NTEUJDCKGJBMER-QGZVFWFLSA-N	0	0	287.428	4.162	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)NCCc1csc2ccccc12	ZINC000467943260	331425955	/nfs/dbraw/zinc/42/59/55/331425955.db2.gz	NTEUJDCKGJBMER-KRWDZBQOSA-N	0	0	287.428	4.162	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)NCc1ccc(C)cc1OCCC	ZINC000467968316	331426154	/nfs/dbraw/zinc/42/61/54/331426154.db2.gz	HXWPEZQXXFDQDL-SFHVURJKSA-N	0	0	289.419	4.002	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H]1CC(C)(C)c2ccccc21	ZINC000467987059	331426307	/nfs/dbraw/zinc/42/63/07/331426307.db2.gz	YMXPZMNSOWEYKW-CRAIPNDOSA-N	0	0	271.404	4.128	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(C)c(OC(F)F)c1	ZINC000468002635	331426533	/nfs/dbraw/zinc/42/65/33/331426533.db2.gz	YGJARXYHJWVJFH-HNNXBMFYSA-N	0	0	283.318	4.137	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(OC(C)(C)C)cc1	ZINC000468000921	331426574	/nfs/dbraw/zinc/42/65/74/331426574.db2.gz	ALSQORXEXCCLBS-QGZVFWFLSA-N	0	0	275.392	4.405	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H]1Cc1ccc(C)cc1	ZINC000468004519	331426584	/nfs/dbraw/zinc/42/65/84/331426584.db2.gz	MEXJIOZQYNEUNE-MJGOQNOKSA-N	0	0	285.431	4.131	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)NCCCCCOC1CCCCC1	ZINC000468011343	331426674	/nfs/dbraw/zinc/42/66/74/331426674.db2.gz	IHCSEWJRFUMECS-GOSISDBHSA-N	0	0	295.467	4.225	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](c1ccc(F)cc1F)C(C)C	ZINC000468343043	331432644	/nfs/dbraw/zinc/43/26/44/331432644.db2.gz	WYOZMNHTSMHEGX-MRXNPFEDSA-N	0	0	281.346	4.134	20	30		CIEDRN
C=CCCCNC(=O)c1oc2ccc(Cl)cc2c1C	ZINC000468365982	331432833	/nfs/dbraw/zinc/43/28/33/331432833.db2.gz	BHHJMPLNZCZLHP-UHFFFAOYSA-N	0	0	277.751	4.091	20	30		CIEDRN
C=CCCCNC(=O)[C@H]1C[C@H]1c1cccc2ccccc21	ZINC000468362148	331432917	/nfs/dbraw/zinc/43/29/17/331432917.db2.gz	NWCDUAMUMZBDQM-ROUUACIJSA-N	0	0	279.383	4.026	20	30		CIEDRN
C=CCCCNC(=O)C[C@@H]1C[C@@H](C)c2c1cccc2C	ZINC000468374629	331433061	/nfs/dbraw/zinc/43/30/61/331433061.db2.gz	XRHWFALQXFPYSH-CABCVRRESA-N	0	0	271.404	4.058	20	30		CIEDRN
C=CCCCNC(=O)CCC[C@H](C)c1cccc(OC)c1	ZINC000468375511	331433076	/nfs/dbraw/zinc/43/30/76/331433076.db2.gz	ZGNLSKRORZULTJ-HNNXBMFYSA-N	0	0	289.419	4.051	20	30		CIEDRN
C=CCCCNC(=O)C[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000468389570	331433479	/nfs/dbraw/zinc/43/34/79/331433479.db2.gz	IXTWKKAIODFGKP-GFCCVEGCSA-N	0	0	299.336	4.281	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC(F)(F)F)[C@H](C)C(C)C	ZINC000468712837	331439008	/nfs/dbraw/zinc/43/90/08/331439008.db2.gz	AJPSNISVQKDOLX-GFCCVEGCSA-N	0	0	291.357	4.190	20	30		CIEDRN
C=CCCCC(=O)N(CC)[C@H](CC)Cc1ccccc1	ZINC000469455738	331452002	/nfs/dbraw/zinc/45/20/02/331452002.db2.gz	YIMNCQADDDZHRQ-QGZVFWFLSA-N	0	0	273.420	4.213	20	30		CIEDRN
C=CCCCCCN(C)C(=O)C[C@H]1CCC[C@H]1C	ZINC000469812516	331461704	/nfs/dbraw/zinc/46/17/04/331461704.db2.gz	YWJMFRMTNUXODF-HUUCEWRRSA-N	0	0	251.414	4.018	20	30		CIEDRN
C=CCN(C)C(=O)C1(c2c(Cl)cccc2Cl)CCC1	ZINC000469823168	331462175	/nfs/dbraw/zinc/46/21/75/331462175.db2.gz	UPQSEBORMFYHJF-UHFFFAOYSA-N	0	0	298.213	4.060	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)Cc1cc(C)ccc1C	ZINC000469851350	331462788	/nfs/dbraw/zinc/46/27/88/331462788.db2.gz	KNNHGDQPXGRKAR-UHFFFAOYSA-N	0	0	271.404	4.030	20	30		CIEDRN
C=CCCCC(=O)NCC(C)(C)c1cccc(Cl)c1F	ZINC000469879769	331463796	/nfs/dbraw/zinc/46/37/96/331463796.db2.gz	OEWPPQYGTXTRAG-UHFFFAOYSA-N	0	0	297.801	4.229	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N(C)Cc1cc(Cl)ccc1F	ZINC000470113654	331471335	/nfs/dbraw/zinc/47/13/35/331471335.db2.gz	ZYRXZWXHPMMRRA-OAHLLOKOSA-N	0	0	283.774	4.040	20	30		CIEDRN
C=CC[C@H]1N(C(=O)c2cccc(F)c2F)CCCC1(C)C	ZINC000470267814	331477185	/nfs/dbraw/zinc/47/71/85/331477185.db2.gz	UFUVYLRDLDHEAS-CQSZACIVSA-N	0	0	293.357	4.172	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)CCc2cccs2)CCCC1(C)C	ZINC000470279203	331477605	/nfs/dbraw/zinc/47/76/05/331477605.db2.gz	JNDAJFGGFMWTRI-HNNXBMFYSA-N	0	0	291.460	4.274	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)[C@H](C)CCC)CCCC1(C)C	ZINC000470282417	331477687	/nfs/dbraw/zinc/47/76/87/331477687.db2.gz	IBGLVCZKKMTYTI-KGLIPLIRSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)[C@@H](C)c2ccsc2)CCCC1(C)C	ZINC000470284812	331477858	/nfs/dbraw/zinc/47/78/58/331477858.db2.gz	ISTRGQFGQWIXBG-ZFWWWQNUSA-N	0	0	291.460	4.445	20	30		CIEDRN
C=CC[C@H]1N(C(=O)C[C@H]2C=CCCC2)CCCC1(C)C	ZINC000470293502	331478136	/nfs/dbraw/zinc/47/81/36/331478136.db2.gz	REBCVEPGEUWKBH-JKSUJKDBSA-N	0	0	275.436	4.326	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)c2ccc3[nH]ccc3c2)CCCC1(C)C	ZINC000470288988	331478154	/nfs/dbraw/zinc/47/81/54/331478154.db2.gz	QYUBDDMFSAYGHN-KRWDZBQOSA-N	0	0	296.414	4.375	20	30		CIEDRN
N#Cc1cnccc1/C=C\c1ccccc1OC(F)(F)F	ZINC000470287382	331478160	/nfs/dbraw/zinc/47/81/60/331478160.db2.gz	PSCNLDUTOHEMDH-WAYWQWQTSA-N	0	0	290.244	4.022	20	30		CIEDRN
C=CC[C@H]1N(C(=O)CC[C@H](C)SC)CCCC1(C)C	ZINC000470290716	331478280	/nfs/dbraw/zinc/47/82/80/331478280.db2.gz	WSKGHRGPSTYYKR-UONOGXRCSA-N	0	0	283.481	4.111	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)C[C@@H](OCC)C(C)C)CCCC1(C)C	ZINC000470292753	331478389	/nfs/dbraw/zinc/47/83/89/331478389.db2.gz	LBAWHIMFCJHUDJ-CVEARBPZSA-N	0	0	295.467	4.031	20	30		CIEDRN
C=CCCCC(=O)N1C[C@@H](C(C)C)c2ccccc21	ZINC000470390431	331481270	/nfs/dbraw/zinc/48/12/70/331481270.db2.gz	RMZBAHCDTYMWGB-HNNXBMFYSA-N	0	0	257.377	4.129	20	30		CIEDRN
C=C[C@H](CC(=O)NCc1cscc1C)c1ccccc1	ZINC000470434006	331482132	/nfs/dbraw/zinc/48/21/32/331482132.db2.gz	DWXCYNXMWFWUKS-CQSZACIVSA-N	0	0	285.412	4.033	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1C[C@H](c2ccc(C)cc2)C[C@@H]1C	ZINC000470573619	331485683	/nfs/dbraw/zinc/48/56/83/331485683.db2.gz	KJDASCNEBZIGAH-QFBILLFUSA-N	0	0	297.442	4.468	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)[C@@H]1C[C@]1(C)CC	ZINC000470647137	331486700	/nfs/dbraw/zinc/48/67/00/331486700.db2.gz	QYMHMNLCJJVXJE-WMZOPIPTSA-N	0	0	271.404	4.028	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)Cc1ccccc1SC	ZINC000471303107	331506108	/nfs/dbraw/zinc/50/61/08/331506108.db2.gz	GCAOZJMNNHLWRG-UHFFFAOYSA-N	0	0	289.444	4.135	20	30		CIEDRN
CCSc1cccc(/C=C\c2ccc(C#N)cn2)c1	ZINC000471454655	331508997	/nfs/dbraw/zinc/50/89/97/331508997.db2.gz	GOTBJBNWHGZKFN-VURMDHGXSA-N	0	0	266.369	4.236	20	30		CIEDRN
CCN(Cc1cc(C#N)cs1)c1ccc2[nH]ccc2c1	ZINC000471808138	331521348	/nfs/dbraw/zinc/52/13/48/331521348.db2.gz	FVIRPIMHHLZBOV-UHFFFAOYSA-N	0	0	281.384	4.128	20	30		CIEDRN
Cc1cc2c(ccc(OCc3ccc(C#N)cc3F)c2F)[nH]1	ZINC000471859546	331522591	/nfs/dbraw/zinc/52/25/91/331522591.db2.gz	VXHFGMYMWXJVLQ-UHFFFAOYSA-N	0	0	298.292	4.205	20	30		CIEDRN
C[C@H]1CN(CCCC(C)(C)C#N)c2cc(Cl)ccc2O1	ZINC000472231326	331532537	/nfs/dbraw/zinc/53/25/37/331532537.db2.gz	PVDFRTPWRKNTOR-LBPRGKRZSA-N	0	0	292.810	4.257	20	30		CIEDRN
Cc1cc2occ(C(=O)N[C@@](C)(C#N)CC(C)C)c2cc1C	ZINC000472387981	331536351	/nfs/dbraw/zinc/53/63/51/331536351.db2.gz	XSMUZDHQCPWWED-GOSISDBHSA-N	0	0	298.386	4.108	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1cc(C)oc1C(F)(F)F	ZINC000472397440	331536362	/nfs/dbraw/zinc/53/63/62/331536362.db2.gz	NPAAMMBEQPYECV-VIFPVBQESA-N	0	0	289.297	4.081	20	30		CIEDRN
C=C[C@@H](C)NC(=O)c1ccc(O[C@H](C)c2ccccc2)cc1	ZINC000472548305	331538078	/nfs/dbraw/zinc/53/80/78/331538078.db2.gz	NFUVQEHSKKQSJK-HUUCEWRRSA-N	0	0	295.382	4.131	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H](Cc2ccccc2)C1	ZINC000473580705	331553985	/nfs/dbraw/zinc/55/39/85/331553985.db2.gz	CZPPOFVHSZSTPP-HKUYNNGSSA-N	0	0	285.431	4.070	20	30		CIEDRN
C=CCCCCNC(=O)Nc1cc(C)ccc1Cl	ZINC000473717169	331556045	/nfs/dbraw/zinc/55/60/45/331556045.db2.gz	XETCBFLJGSYMNS-UHFFFAOYSA-N	0	0	266.772	4.126	20	30		CIEDRN
CC(C)(C)OCCCCOc1ccc(C#N)cc1Cl	ZINC000473796280	331557941	/nfs/dbraw/zinc/55/79/41/331557941.db2.gz	XFFHTBSXKMBSBB-UHFFFAOYSA-N	0	0	281.783	4.186	20	30		CIEDRN
C=CCCCCNC(=O)N(Cc1ccccc1)[C@@H](C)CC	ZINC000474070733	331567801	/nfs/dbraw/zinc/56/78/01/331567801.db2.gz	BPHLKJUXNWYOGW-INIZCTEOSA-N	0	0	288.435	4.353	20	30		CIEDRN
Cc1cccc(NC(=O)C[C@H](CC#N)c2ccccc2)c1C	ZINC000474077435	331568363	/nfs/dbraw/zinc/56/83/63/331568363.db2.gz	CGKZNYGDJJURHD-KRWDZBQOSA-N	0	0	292.382	4.330	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(C)cc2Cl)CC1	ZINC000474084297	331568896	/nfs/dbraw/zinc/56/88/96/331568896.db2.gz	YKTVTGZQIMPCLP-UHFFFAOYSA-N	0	0	263.768	4.333	20	30		CIEDRN
Cc1cc(C)cc(NC(=O)C[C@@H](CC#N)c2ccccc2)c1	ZINC000474088951	331569548	/nfs/dbraw/zinc/56/95/48/331569548.db2.gz	PGANTSJQVWNAFD-QGZVFWFLSA-N	0	0	292.382	4.330	20	30		CIEDRN
Cc1cccc(NC(=O)c2ccc(C(C)(C)C#N)cc2)c1	ZINC000474098039	331570401	/nfs/dbraw/zinc/57/04/01/331570401.db2.gz	VANDIUXBIMYLIP-UHFFFAOYSA-N	0	0	278.355	4.049	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cnn(CC(C)C)c1C(C)C	ZINC000474156084	331573880	/nfs/dbraw/zinc/57/38/80/331573880.db2.gz	YDDCHKDDTNPLLK-QGZVFWFLSA-N	0	0	291.439	4.203	20	30		CIEDRN
C=CCCC1(C(=O)N[C@H](C)c2ccccc2Cl)CC1	ZINC000474213194	331575527	/nfs/dbraw/zinc/57/55/27/331575527.db2.gz	IQOZHIGSYHLQPM-GFCCVEGCSA-N	0	0	277.795	4.264	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H]1CC[C@H](Cc2ccccc2)C1	ZINC000474327683	331580345	/nfs/dbraw/zinc/58/03/45/331580345.db2.gz	JMULCSRROBUNBJ-JQHSSLGASA-N	0	0	285.431	4.116	20	30		CIEDRN
C=CCCC1(C(=O)N(CC)Cc2ccc(Cl)cc2)CC1	ZINC000474694885	331594607	/nfs/dbraw/zinc/59/46/07/331594607.db2.gz	XQTDJMFNMKWNTB-UHFFFAOYSA-N	0	0	291.822	4.435	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)c1cc2[nH]ccc2s1	ZINC000474771767	331597494	/nfs/dbraw/zinc/59/74/94/331597494.db2.gz	CGYXYUZMUPFBMP-UHFFFAOYSA-N	0	0	296.395	4.058	20	30		CIEDRN
C=CCCC1(C(=O)NC[C@@H](c2ccccc2)C(C)C)CC1	ZINC000474784832	331598056	/nfs/dbraw/zinc/59/80/56/331598056.db2.gz	UFUUZVJZITYNHR-QGZVFWFLSA-N	0	0	285.431	4.289	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(OC(F)F)c(F)c2)CC1	ZINC000474954453	331606438	/nfs/dbraw/zinc/60/64/38/331606438.db2.gz	NYGOOTKTZRSMDP-UHFFFAOYSA-N	0	0	299.292	4.112	20	30		CIEDRN
C=C[C@H](CC(=O)N1C[C@H](C)C[C@@H](C)[C@@H]1C)c1ccccc1	ZINC000474979420	331607982	/nfs/dbraw/zinc/60/79/82/331607982.db2.gz	XQNXQWMVROZVQM-WCXIOVBPSA-N	0	0	285.431	4.239	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(COC(C)C)cc2)CC1	ZINC000475165275	331616699	/nfs/dbraw/zinc/61/66/99/331616699.db2.gz	QOBFLNYBOSFHLJ-UHFFFAOYSA-N	0	0	287.403	4.297	20	30		CIEDRN
CC(C)(C)Oc1cc(F)ccc1NCc1ccccc1C#N	ZINC000498363107	331621729	/nfs/dbraw/zinc/62/17/29/331621729.db2.gz	IXZXHGKPDJMNOH-UHFFFAOYSA-N	0	0	298.361	4.487	20	30		CIEDRN
C=CCN(Cc1cccc(C#N)c1)C(=O)[C@H](C)CC(C)(C)C	ZINC000475338400	331627313	/nfs/dbraw/zinc/62/73/13/331627313.db2.gz	TWFXSLLNQZTFRN-OAHLLOKOSA-N	0	0	298.430	4.145	20	30		CIEDRN
CC[C@@H]1CCCC[C@H]1C(=O)Nc1cc(C#N)ccc1C	ZINC000475383547	331630312	/nfs/dbraw/zinc/63/03/12/331630312.db2.gz	MRAUUPOFURLZSL-HUUCEWRRSA-N	0	0	270.376	4.022	20	30		CIEDRN
CC(C)C[C@H]1CCCN1C(=O)C[C@@H](CC#N)c1ccccc1	ZINC000475460474	331632198	/nfs/dbraw/zinc/63/21/98/331632198.db2.gz	GPBHRYALWMRPFB-QZTJIDSGSA-N	0	0	298.430	4.111	20	30		CIEDRN
C=CCCC1(C(=O)Nc2nc3ccccc3n2CCC)CC1	ZINC000475527934	331635724	/nfs/dbraw/zinc/63/57/24/331635724.db2.gz	IRFPVKGINRNZPJ-UHFFFAOYSA-N	0	0	297.402	4.131	20	30		CIEDRN
C=CCC[C@H](C)Nc1ccc(NC(=O)c2ccccc2)cn1	ZINC000475553432	331636682	/nfs/dbraw/zinc/63/66/82/331636682.db2.gz	PBHQHGVWBVLGFJ-AWEZNQCLSA-N	0	0	295.386	4.101	20	30		CIEDRN
C=CCCC1(C(=O)N2CCC(c3ccccc3C)CC2)CC1	ZINC000475657010	331640557	/nfs/dbraw/zinc/64/05/57/331640557.db2.gz	RSCYQTDKEWIPNG-UHFFFAOYSA-N	0	0	297.442	4.447	20	30		CIEDRN
C=CCCCC(=O)N(CCc1ccccc1)C1CCCC1	ZINC000475664731	331640669	/nfs/dbraw/zinc/64/06/69/331640669.db2.gz	QAYPYYSSFTYEGS-UHFFFAOYSA-N	0	0	285.431	4.357	20	30		CIEDRN
C=CCCC1(C(=O)N[C@@H]2CCC[C@@H](C(C)C)C2)CC1	ZINC000475662329	331640689	/nfs/dbraw/zinc/64/06/89/331640689.db2.gz	REIHEZCHVCXFEG-HUUCEWRRSA-N	0	0	263.425	4.064	20	30		CIEDRN
C=C(C)[C@H](NC(=O)[C@@H]1C[C@@]1(C)CC)c1ccc(F)c(F)c1	ZINC000475661217	331640750	/nfs/dbraw/zinc/64/07/50/331640750.db2.gz	LQUMMJSJCIHKEI-YLQAJVPDSA-N	0	0	293.357	4.134	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)C[C@@H](CC)C(C)C	ZINC000475736095	331643946	/nfs/dbraw/zinc/64/39/46/331643946.db2.gz	XJSBHUJXHYXJCM-CQSZACIVSA-N	0	0	266.429	4.037	20	30		CIEDRN
Cc1cc(C)cc(-n2ccnc2SCCCCC#N)c1	ZINC000475749236	331644819	/nfs/dbraw/zinc/64/48/19/331644819.db2.gz	MRULXLIBVKPGBJ-UHFFFAOYSA-N	0	0	285.416	4.275	20	30		CIEDRN
CCCC[C@H](S[C@@H](C)c1cccc(C#N)c1)C(=O)OC	ZINC000475884228	331647610	/nfs/dbraw/zinc/64/76/10/331647610.db2.gz	VZSCNKKSKNVWGT-WFASDCNBSA-N	0	0	291.416	4.084	20	30		CIEDRN
C=CCCCCCN(C)C(=O)C[C@H](CC#N)c1ccccc1	ZINC000476089968	331654778	/nfs/dbraw/zinc/65/47/78/331654778.db2.gz	KGWGZPCLKJENQU-SFHVURJKSA-N	0	0	298.430	4.279	20	30		CIEDRN
C=C(C)CS[C@@H](C)c1nc(-c2ccccc2C)no1	ZINC000476119246	331655671	/nfs/dbraw/zinc/65/56/71/331655671.db2.gz	GZPDCKCBEPHAHZ-LBPRGKRZSA-N	0	0	274.389	4.415	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1[C@H](C)C1(F)F	ZINC000476141321	331656032	/nfs/dbraw/zinc/65/60/32/331656032.db2.gz	JHFYSPQPWDSBLY-SMDDNHRTSA-N	0	0	293.357	4.378	20	30		CIEDRN
C[C@@H](NC(=O)c1ccc(C(C)(C)C#N)cc1)C1CCCCC1	ZINC000476146608	331656083	/nfs/dbraw/zinc/65/60/83/331656083.db2.gz	KPFJZFMGEWKVMC-CQSZACIVSA-N	0	0	298.430	4.186	20	30		CIEDRN
C=CCCC1(C(=O)N[C@H](C)[C@@H](C)c2ccccc2)CC1	ZINC000476225062	331657576	/nfs/dbraw/zinc/65/75/76/331657576.db2.gz	DVOZEYZRWJRDDB-HUUCEWRRSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CCCC1(C(=O)N2CCC[C@@H](CC(C)C)C2)CC1	ZINC000476336722	331661874	/nfs/dbraw/zinc/66/18/74/331661874.db2.gz	WBXDKGVRHZISBV-HNNXBMFYSA-N	0	0	263.425	4.018	20	30		CIEDRN
C[C@@H](C#N)CN(C(=O)CC(C)(C)C1CCCCC1)C1CC1	ZINC000476471761	331664657	/nfs/dbraw/zinc/66/46/57/331664657.db2.gz	NZFZCNSKLUQDCF-AWEZNQCLSA-N	0	0	290.451	4.134	20	30		CIEDRN
C=CCCC1(C(=O)N2CC[C@H](c3cc(C)cc(C)c3)C2)CC1	ZINC000476655074	331667877	/nfs/dbraw/zinc/66/78/77/331667877.db2.gz	DSOPAVFCWFEUEC-KRWDZBQOSA-N	0	0	297.442	4.366	20	30		CIEDRN
C=CCCC1(C(=O)NCc2ccc(Cl)c(C)c2)CC1	ZINC000476706574	331669054	/nfs/dbraw/zinc/66/90/54/331669054.db2.gz	XPCJOLMFKBJYKS-UHFFFAOYSA-N	0	0	277.795	4.011	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cccc(C(C)(C)C)c2O)CC1	ZINC000476793022	331669977	/nfs/dbraw/zinc/66/99/77/331669977.db2.gz	CXGWQKYEULWORB-UHFFFAOYSA-N	0	0	287.403	4.375	20	30		CIEDRN
C=CCC[C@H](Nc1cnn([C@@H](C)CC)c1C)C1CC1	ZINC000477920441	331693862	/nfs/dbraw/zinc/69/38/62/331693862.db2.gz	YTLJVGBYLLWEJG-WFASDCNBSA-N	0	0	261.413	4.319	20	30		CIEDRN
C=CCC1(C(=O)NCc2ccccc2C(F)(F)F)CCC1	ZINC000478076846	331697131	/nfs/dbraw/zinc/69/71/31/331697131.db2.gz	JOZQFUVDXLDBRK-UHFFFAOYSA-N	0	0	297.320	4.068	20	30		CIEDRN
C=CCC1(C(=O)N(CC)Cc2ccccc2Cl)CCC1	ZINC000478077011	331697163	/nfs/dbraw/zinc/69/71/63/331697163.db2.gz	OCMLVNLSOILAKH-UHFFFAOYSA-N	0	0	291.822	4.435	20	30		CIEDRN
C=CCC[C@@H](C(=O)N(CC)CC1CCC1)c1ccccc1	ZINC000478284939	331702795	/nfs/dbraw/zinc/70/27/95/331702795.db2.gz	SQQUELXSWVAIMW-GOSISDBHSA-N	0	0	285.431	4.385	20	30		CIEDRN
C=CCCC(=O)N1CCC(CC)(Cc2ccccc2)CC1	ZINC000478330826	331704279	/nfs/dbraw/zinc/70/42/79/331704279.db2.gz	XMAAUHUEILOSRH-UHFFFAOYSA-N	0	0	285.431	4.214	20	30		CIEDRN
Cc1cc(NCc2ccc(Cl)cc2C#N)ccc1F	ZINC000478358206	331704542	/nfs/dbraw/zinc/70/45/42/331704542.db2.gz	CEKYFRJBEVDZHX-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
Cc1cc(C)cc(NCc2ccc(Cl)cc2C#N)c1	ZINC000478376482	331704967	/nfs/dbraw/zinc/70/49/67/331704967.db2.gz	KIMZDYPNYHULKM-UHFFFAOYSA-N	0	0	270.763	4.441	20	30		CIEDRN
C=CCC1(C(=O)NCc2csc3ccccc23)CCC1	ZINC000478678125	331711634	/nfs/dbraw/zinc/71/16/34/331711634.db2.gz	UELKCJKALQLNFN-UHFFFAOYSA-N	0	0	285.412	4.264	20	30		CIEDRN
C=CCOCCCSCc1ccc(SC)cc1	ZINC000478743912	331713116	/nfs/dbraw/zinc/71/31/16/331713116.db2.gz	UJXNXFQHRGFWMN-UHFFFAOYSA-N	0	0	268.447	4.234	20	30		CIEDRN
N#C[C@@H](SCc1ccc2c(c1)OCO2)C1CCCCC1	ZINC000478754998	331713477	/nfs/dbraw/zinc/71/34/77/331713477.db2.gz	IXNGZCWNOYXHNN-MRXNPFEDSA-N	0	0	289.400	4.121	20	30		CIEDRN
Cc1ccc(O[C@@H](C)c2cccc(C#N)c2)cc1F	ZINC000478836464	331715409	/nfs/dbraw/zinc/71/54/09/331715409.db2.gz	KXMOVXFVAIWQID-LBPRGKRZSA-N	0	0	255.292	4.146	20	30		CIEDRN
N#Cc1cc(Cl)ccc1COc1cc(F)ccc1F	ZINC000478943603	331718042	/nfs/dbraw/zinc/71/80/42/331718042.db2.gz	KAHGCDBZWUETGB-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc2occ(C)c2c1	ZINC000479047707	331719318	/nfs/dbraw/zinc/71/93/18/331719318.db2.gz	AEEDYRCFTSBCPA-NSHDSACASA-N	0	0	257.333	4.282	20	30		CIEDRN
C/C=C/c1ccc(OCc2ccc(C#N)c(F)c2)c(OC)c1	ZINC000479413089	331727674	/nfs/dbraw/zinc/72/76/74/331727674.db2.gz	CZPJISFXMMADNK-ONEGZZNKSA-N	0	0	297.329	4.318	20	30		CIEDRN
C=CCCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000479513168	331734014	/nfs/dbraw/zinc/73/40/14/331734014.db2.gz	MKNBQXBLBDPJND-UHFFFAOYSA-N	0	0	257.255	4.000	20	30		CIEDRN
N#Cc1ccc(CSCc2ccccc2F)cc1F	ZINC000479514871	331734257	/nfs/dbraw/zinc/73/42/57/331734257.db2.gz	XIZJAYJLBHCJSX-UHFFFAOYSA-N	0	0	275.323	4.270	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(O[C@@H](C)CC)cc1	ZINC000479542584	331736109	/nfs/dbraw/zinc/73/61/09/331736109.db2.gz	KKWCKTURUWVMNC-ZDUSSCGKSA-N	0	0	261.365	4.159	20	30		CIEDRN
C=CCCCC(=O)NCC(C)(C)c1ccc(Cl)cc1	ZINC000479565782	331737649	/nfs/dbraw/zinc/73/76/49/331737649.db2.gz	BIDAWVCWQUPDNR-UHFFFAOYSA-N	0	0	279.811	4.090	20	30		CIEDRN
C=CCCCC(=O)N[C@H](c1nc2ccccc2[nH]1)[C@H](C)CC	ZINC000479579653	331738678	/nfs/dbraw/zinc/73/86/78/331738678.db2.gz	OTICVUGRQWZPDF-DYVFJYSZSA-N	0	0	299.418	4.123	20	30		CIEDRN
C=CCC1(C(=O)N[C@H]2CCc3c2cccc3Cl)CCC1	ZINC000479663856	331742547	/nfs/dbraw/zinc/74/25/47/331742547.db2.gz	SWQWDZGFACLUFX-HNNXBMFYSA-N	0	0	289.806	4.190	20	30		CIEDRN
C=CCCC(=O)Nc1cc(Cl)ccc1NCCC	ZINC000479704894	331744081	/nfs/dbraw/zinc/74/40/81/331744081.db2.gz	MCOAWZAVQQXVGB-UHFFFAOYSA-N	0	0	266.772	4.067	20	30		CIEDRN
C=CCC[C@@H](NC(=O)N1CC[C@H](C2CC2)C1)c1ccccc1	ZINC000479950182	331752239	/nfs/dbraw/zinc/75/22/39/331752239.db2.gz	NAJKHSKDTCSIRF-ZWKOTPCHSA-N	0	0	298.430	4.135	20	30		CIEDRN
C=CC1CCN(C(=O)c2csc3cc(C)ccc32)CC1	ZINC000480005410	331753744	/nfs/dbraw/zinc/75/37/44/331753744.db2.gz	HPQYPQVWLRGABE-UHFFFAOYSA-N	0	0	285.412	4.248	20	30		CIEDRN
C=CCCCC(=O)N[C@H](CC(C)C)c1ccccc1OC	ZINC000480009499	331754126	/nfs/dbraw/zinc/75/41/26/331754126.db2.gz	BZVXPAYICKEOAY-MRXNPFEDSA-N	0	0	289.419	4.255	20	30		CIEDRN
CC[C@H](C)CC(=O)N[C@@H](C#N)c1ccc(C(C)(C)C)cc1	ZINC000480082584	331757187	/nfs/dbraw/zinc/75/71/87/331757187.db2.gz	NPXPNUXLVFIJDL-BBRMVZONSA-N	0	0	286.419	4.101	20	30		CIEDRN
CC[C@@H](C)CC(=O)N[C@H](C#N)c1c(Cl)cccc1Cl	ZINC000480178032	331761870	/nfs/dbraw/zinc/76/18/70/331761870.db2.gz	HFCDZTZWSQFXOZ-BXKDBHETSA-N	0	0	299.201	4.110	20	30		CIEDRN
C[C@@H](CC#N)NC(=O)c1ccc2c(c1)C(C)(C)CCC2(C)C	ZINC000480509399	331775179	/nfs/dbraw/zinc/77/51/79/331775179.db2.gz	JBPWKEUQLCKDBX-ZDUSSCGKSA-N	0	0	298.430	4.068	20	30		CIEDRN
C=C1CCN([C@H](C)c2cccc(Cl)c2F)CC1	ZINC000480779437	331788153	/nfs/dbraw/zinc/78/81/53/331788153.db2.gz	KSQWKZRMKVQBCV-LLVKDONJSA-N	0	0	253.748	4.192	20	30		CIEDRN
CSc1ccc(CSc2c(C#N)cccc2C#N)cc1	ZINC000480833066	331789501	/nfs/dbraw/zinc/78/95/01/331789501.db2.gz	YEBYRJOYVFAOTP-UHFFFAOYSA-N	0	0	296.420	4.444	20	30		CIEDRN
C=CCCCC(=O)Nc1ccnc(Oc2ccccc2)c1	ZINC000480853087	331789849	/nfs/dbraw/zinc/78/98/49/331789849.db2.gz	AEQVEYKSCLLUPM-UHFFFAOYSA-N	0	0	282.343	4.169	20	30		CIEDRN
CC(C)(C)CCCCNC(=O)c1cc(C#N)ccc1Cl	ZINC000511193083	332929274	/nfs/dbraw/zinc/92/92/74/332929274.db2.gz	SDPSMQAZCMGXLB-UHFFFAOYSA-N	0	0	292.810	4.158	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1ccc2oc(C)c(C)c2c1	ZINC000481636947	331810746	/nfs/dbraw/zinc/81/07/46/331810746.db2.gz	XICPQPICSLSYAD-SNVBAGLBSA-N	0	0	272.348	4.136	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cnn(CCCC)c1C(C)C	ZINC000482730660	331844966	/nfs/dbraw/zinc/84/49/66/331844966.db2.gz	CYZXQVZTGCQSMZ-KRWDZBQOSA-N	0	0	291.439	4.347	20	30		CIEDRN
CCCN(CC#N)Cc1ccc(OCc2ccccc2)cc1	ZINC000511471506	332932420	/nfs/dbraw/zinc/93/24/20/332932420.db2.gz	JDVILNHLHIVGIS-UHFFFAOYSA-N	0	0	294.398	4.001	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)CCc1ccsc1	ZINC000303460017	332931506	/nfs/dbraw/zinc/93/15/06/332931506.db2.gz	NUMIIPFFGBZWRM-UHFFFAOYSA-N	0	0	291.460	4.276	20	30		CIEDRN
N#Cc1cc(F)ccc1CSc1ccc2c(c1)CCC2	ZINC000483062380	331856838	/nfs/dbraw/zinc/85/68/38/331856838.db2.gz	QWGDRQQLZMVAKO-UHFFFAOYSA-N	0	0	283.371	4.478	20	30		CIEDRN
Cc1ccccc1CSCc1ccc(F)cc1C#N	ZINC000483243284	331864422	/nfs/dbraw/zinc/86/44/22/331864422.db2.gz	SMEWRSKVVMSEDQ-UHFFFAOYSA-N	0	0	271.360	4.439	20	30		CIEDRN
C=C(C)[C@H](NC(=O)N(CC)CCC)c1ccc(F)c(F)c1	ZINC000483288025	331867277	/nfs/dbraw/zinc/86/72/77/331867277.db2.gz	ZXIDJMBFAWSYPG-HNNXBMFYSA-N	0	0	296.361	4.024	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)[C@@H]2CCCC[C@H]2CC)s1	ZINC000483345336	331870456	/nfs/dbraw/zinc/87/04/56/331870456.db2.gz	SCWLYSXLYVXBSJ-BXUZGUMPSA-N	0	0	290.432	4.337	20	30		CIEDRN
N#Cc1ccc(CN2CC3(CCC3)c3ccccc32)s1	ZINC000483636392	331880315	/nfs/dbraw/zinc/88/03/15/331880315.db2.gz	MYJFHWVEFOZGRS-UHFFFAOYSA-N	0	0	280.396	4.062	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@H](c1ccc(Cl)cc1)C(C)C	ZINC000483970220	331890322	/nfs/dbraw/zinc/89/03/22/331890322.db2.gz	GCMBZMULQFZEKT-HNNXBMFYSA-N	0	0	294.826	4.255	20	30		CIEDRN
Cc1cc(C(=O)N[C@](C)(C#N)C(C)(C)C)c(C)cc1Cl	ZINC000483986662	331890842	/nfs/dbraw/zinc/89/08/42/331890842.db2.gz	WLQBQGVWEXRDGG-MRXNPFEDSA-N	0	0	292.810	4.015	20	30		CIEDRN
C[C@@H](CC(C)(C)C)C(=O)Nc1cc(C#N)cn1C(C)(C)C	ZINC000484064193	331892082	/nfs/dbraw/zinc/89/20/82/331892082.db2.gz	GFYIBRXJIIVCKD-LBPRGKRZSA-N	0	0	289.423	4.126	20	30		CIEDRN
CC[C@@H]1CCCC[C@H]1C(=O)N(CCC#N)C(C)(C)CC	ZINC000484122774	331892889	/nfs/dbraw/zinc/89/28/89/331892889.db2.gz	JBBOGWDVUIKGJW-HUUCEWRRSA-N	0	0	278.440	4.134	20	30		CIEDRN
C=CCN(C(=O)c1cc(CC)c(C)s1)c1ccccc1	ZINC000484226026	331894439	/nfs/dbraw/zinc/89/44/39/331894439.db2.gz	YYMQVGNVWQUTAK-UHFFFAOYSA-N	0	0	285.412	4.452	20	30		CIEDRN
CCN(CC#N)Cc1ccc(-c2ccc(C)cc2)s1	ZINC000511509237	332933785	/nfs/dbraw/zinc/93/37/85/332933785.db2.gz	VTOQWUWZMYHJAA-UHFFFAOYSA-N	0	0	270.401	4.069	20	30		CIEDRN
CC(C)c1ccc([C@@H](C)CC(=O)N[C@@]2(C#N)CC2(C)C)cc1	ZINC000484916890	331907353	/nfs/dbraw/zinc/90/73/53/331907353.db2.gz	GIVBLVWAUJCNES-IFXJQAMLSA-N	0	0	298.430	4.112	20	30		CIEDRN
N#Cc1cc(C(=O)Nc2cccc(C3CCC3)c2)ccc1F	ZINC000485134221	331909846	/nfs/dbraw/zinc/90/98/46/331909846.db2.gz	FRCAFYWCJBEYSC-UHFFFAOYSA-N	0	0	294.329	4.217	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N[C@H]1CCCC[C@H]1C	ZINC000485481467	331915205	/nfs/dbraw/zinc/91/52/05/331915205.db2.gz	UGSCTQBDEOMUOU-HIFRSBDPSA-N	0	0	289.444	4.273	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccccc2OCC(C)C)CCC1	ZINC000485577892	331917631	/nfs/dbraw/zinc/91/76/31/331917631.db2.gz	JMRAQPVBNOSVBK-UHFFFAOYSA-N	0	0	287.403	4.406	20	30		CIEDRN
C=CCCCC(=O)Nc1cc(C)cc(Br)c1	ZINC000485634519	331919267	/nfs/dbraw/zinc/91/92/67/331919267.db2.gz	DEJJMSKKCTUHGN-UHFFFAOYSA-N	0	0	282.181	4.052	20	30		CIEDRN
C=CCC1(C(=O)N2CCC[C@H]2/C=C/c2ccccc2)CCC1	ZINC000485658077	331919790	/nfs/dbraw/zinc/91/97/90/331919790.db2.gz	RFCQPIGXJVKNML-DXRVJIQQSA-N	0	0	295.426	4.437	20	30		CIEDRN
C=CCCCC(=O)Nc1c2ccccc2nc(C)c1C(C)C	ZINC000485662810	331919945	/nfs/dbraw/zinc/91/99/45/331919945.db2.gz	FIZOUKKDFUWIMF-UHFFFAOYSA-N	0	0	296.414	4.383	20	30		CIEDRN
Cc1ccc(/C=C/c2ncccc2C#N)c(Br)c1	ZINC000485979166	331928386	/nfs/dbraw/zinc/92/83/86/331928386.db2.gz	DKLFEJPPURNGDZ-VOTSOKGWSA-N	0	0	299.171	4.195	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N[C@H](CC)CCC	ZINC000486064154	331930524	/nfs/dbraw/zinc/93/05/24/331930524.db2.gz	QBDFREIBLKHNGK-CYBMUJFWSA-N	0	0	277.433	4.273	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N[C@H](C)[C@H](C)CC	ZINC000486250579	331933940	/nfs/dbraw/zinc/93/39/40/331933940.db2.gz	GSWNVFSWIQJMGD-CHWSQXEVSA-N	0	0	277.433	4.129	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1ccc(F)cc1Cl	ZINC000486752950	331943725	/nfs/dbraw/zinc/94/37/25/331943725.db2.gz	KVCZCTMSPIQVDT-LLVKDONJSA-N	0	0	282.746	4.052	20	30		CIEDRN
C=C(C)CS[C@H](C)C(=O)N1c2ccccc2CC[C@H]1C	ZINC000486772034	331944177	/nfs/dbraw/zinc/94/41/77/331944177.db2.gz	SWJVPICJVJAOOV-ZIAGYGMSSA-N	0	0	289.444	4.052	20	30		CIEDRN
C=C(C)CS[C@@H](C)C(=O)N1c2ccccc2CC[C@H]1C	ZINC000486772028	331944249	/nfs/dbraw/zinc/94/42/49/331944249.db2.gz	SWJVPICJVJAOOV-KGLIPLIRSA-N	0	0	289.444	4.052	20	30		CIEDRN
C[C@@H](Nc1ncc(C#N)cc1Cl)c1ccccc1Cl	ZINC000486795482	331945326	/nfs/dbraw/zinc/94/53/26/331945326.db2.gz	DCLHNPSOJKAMKT-SECBINFHSA-N	0	0	292.169	4.433	20	30		CIEDRN
CCC[C@@H](C)[C@@H]1CCCN1c1ncc(C#N)cc1Cl	ZINC000486916419	331949284	/nfs/dbraw/zinc/94/92/84/331949284.db2.gz	WGMKGDYSLYYJKO-RISCZKNCSA-N	0	0	277.799	4.012	20	30		CIEDRN
N#Cc1ccc(N2CCC[C@@H]2c2ccsc2)c(F)c1	ZINC000486933503	331950325	/nfs/dbraw/zinc/95/03/25/331950325.db2.gz	FRZJMHFLXOXIEY-CQSZACIVSA-N	0	0	272.348	4.100	20	30		CIEDRN
N#Cc1nc(Oc2ccccc2OC(F)F)ccc1Cl	ZINC000486968723	331952922	/nfs/dbraw/zinc/95/29/22/331952922.db2.gz	OOFJWOFMZBNAIY-UHFFFAOYSA-N	0	0	296.660	4.000	20	30		CIEDRN
CC(C)(C)[C@H]1C[C@H](Nc2ccc(C#N)c(Cl)c2)CCO1	ZINC000487062480	331955795	/nfs/dbraw/zinc/95/57/95/331955795.db2.gz	QHVMVRRXBUJAJR-UKRRQHHQSA-N	0	0	292.810	4.217	20	30		CIEDRN
C=CC1CCN(C(=O)[C@@H]2CCC[C@H]3CCCC[C@H]32)CC1	ZINC000511654642	332938491	/nfs/dbraw/zinc/93/84/91/332938491.db2.gz	DYNORPNIIBSWAH-BRWVUGGUSA-N	0	0	275.436	4.018	20	30		CIEDRN
C=CC[C@H](C(=O)NCCC1=CCCCC1)c1ccccc1	ZINC000487588071	331976424	/nfs/dbraw/zinc/97/64/24/331976424.db2.gz	QETWHCQFQUKSFY-SFHVURJKSA-N	0	0	283.415	4.353	20	30		CIEDRN
N#Cc1ccc(NC[C@H]2SCCc3ccccc32)c(F)c1	ZINC000487663003	331978484	/nfs/dbraw/zinc/97/84/84/331978484.db2.gz	GIQNMBIOAZMLHY-QGZVFWFLSA-N	0	0	298.386	4.140	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@H]1CCC[C@@H](C)C1)c1ccccc1	ZINC000487685802	331978995	/nfs/dbraw/zinc/97/89/95/331978995.db2.gz	IKQCJMBLYWUGJK-PVAVHDDUSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@@H]1CCC[C@@H](C)C1)c1ccccc1	ZINC000487685801	331979034	/nfs/dbraw/zinc/97/90/34/331979034.db2.gz	IKQCJMBLYWUGJK-OIISXLGYSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CC[C@H](C(=O)N(C)[C@H]1CCC[C@H](C)C1)c1ccccc1	ZINC000487703234	331979304	/nfs/dbraw/zinc/97/93/04/331979304.db2.gz	JBPIPPDKLZGKLV-SZMVWBNQSA-N	0	0	285.431	4.383	20	30		CIEDRN
Cc1nc(N2CC[C@H](c3ccccc3)C[C@H]2C)ccc1C#N	ZINC000487722281	331979635	/nfs/dbraw/zinc/97/96/35/331979635.db2.gz	QAHNGFTWYUZRJT-PBHICJAKSA-N	0	0	291.398	4.034	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1ccccc1OC(C)C	ZINC000487886064	331983226	/nfs/dbraw/zinc/98/32/26/331983226.db2.gz	VUAODZUQMGYRCI-AWEZNQCLSA-N	0	0	288.391	4.046	20	30		CIEDRN
CC(C)c1cccc(OCc2ccc(F)cc2C#N)c1	ZINC000487942688	331985168	/nfs/dbraw/zinc/98/51/68/331985168.db2.gz	HIAOQHPTVXGJDE-UHFFFAOYSA-N	0	0	269.319	4.400	20	30		CIEDRN
Cc1nc(N2CCC[C@@H](c3ccccc3)CC2)ccc1C#N	ZINC000488080133	331989577	/nfs/dbraw/zinc/98/95/77/331989577.db2.gz	AGZUKXLFCAGIEX-QGZVFWFLSA-N	0	0	291.398	4.036	20	30		CIEDRN
Cc1cccc([C@@H]2CCCN2c2ccc(C#N)c(C)n2)c1C	ZINC000488101901	331990088	/nfs/dbraw/zinc/99/00/88/331990088.db2.gz	OXHZJOFCLHYHTL-SFHVURJKSA-N	0	0	291.398	4.220	20	30		CIEDRN
N#Cc1c(F)cccc1CSc1ncccc1Cl	ZINC000488229285	331994844	/nfs/dbraw/zinc/99/48/44/331994844.db2.gz	ZYKWDSYKSKMLBQ-UHFFFAOYSA-N	0	0	278.739	4.038	20	30		CIEDRN
Cc1ccc(OC(F)F)c(COc2ccccc2C#N)c1	ZINC000488252141	331996011	/nfs/dbraw/zinc/99/60/11/331996011.db2.gz	JEYFKWHNIBJDCP-UHFFFAOYSA-N	0	0	289.281	4.047	20	30		CIEDRN
CC(C)O[C@H](COc1ccccc1C#N)c1ccccc1	ZINC000488253389	331996015	/nfs/dbraw/zinc/99/60/15/331996015.db2.gz	LJOFEZIIOISTAV-GOSISDBHSA-N	0	0	281.355	4.103	20	30		CIEDRN
N#Cc1c(F)cccc1CSc1cccc(F)c1	ZINC000488258368	331996334	/nfs/dbraw/zinc/99/63/34/331996334.db2.gz	ASANHAMORXXYCN-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
C=CCCC(=O)N1CCC[C@@H]1CCC1CCCCC1	ZINC000488313992	331999028	/nfs/dbraw/zinc/99/90/28/331999028.db2.gz	NUGJHYVGNINDRU-MRXNPFEDSA-N	0	0	263.425	4.304	20	30		CIEDRN
C=CCC[C@H](C(=O)N1CCC(C=C)CC1)c1ccccc1	ZINC000488390640	332003673	/nfs/dbraw/zinc/00/36/73/332003673.db2.gz	NXDLUFWSEVAXSA-SFHVURJKSA-N	0	0	283.415	4.161	20	30		CIEDRN
N#Cc1ccc(NC[C@H]2CCCCC(F)(F)C2)cc1	ZINC000488427162	332007089	/nfs/dbraw/zinc/00/70/89/332007089.db2.gz	FQWXTDJQOWSOKZ-ZDUSSCGKSA-N	0	0	264.319	4.186	20	30		CIEDRN
CC(C)c1ccc(/C=C\CC(=O)N[C@](C)(C#N)C(C)C)cc1	ZINC000488463414	332011652	/nfs/dbraw/zinc/01/16/52/332011652.db2.gz	ZVUOCVSLAITYOB-LIXSYLKWSA-N	0	0	298.430	4.268	20	30		CIEDRN
Cc1c(C#N)cccc1NCc1cc2ccc(F)cc2[nH]1	ZINC000488498997	332013893	/nfs/dbraw/zinc/01/38/93/332013893.db2.gz	BDVHGGNZBMIYOB-UHFFFAOYSA-N	0	0	279.318	4.099	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1cc(CC)ccc1CC	ZINC000488508023	332014583	/nfs/dbraw/zinc/01/45/83/332014583.db2.gz	SENAIVFMGLKGDK-MRXNPFEDSA-N	0	0	286.419	4.384	20	30		CIEDRN
C=CCC[C@H](C(=O)N(C)[C@H](C)CCC)c1ccccc1	ZINC000488623428	332020317	/nfs/dbraw/zinc/02/03/17/332020317.db2.gz	DGJWXLVFLSWBGA-WBVHZDCISA-N	0	0	273.420	4.383	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1c(C)cccc1SC	ZINC000488656967	332021056	/nfs/dbraw/zinc/02/10/56/332021056.db2.gz	LSVKIODLBVJKRH-ZDUSSCGKSA-N	0	0	290.432	4.289	20	30		CIEDRN
C=CC[C@@H](C(=O)NCc1ccc(CC)s1)c1ccccc1	ZINC000488675199	332021251	/nfs/dbraw/zinc/02/12/51/332021251.db2.gz	MMDMDYDAFMBXGK-QGZVFWFLSA-N	0	0	299.439	4.287	20	30		CIEDRN
C=CCC[C@@H](C(=O)N(CCC)CC(F)F)c1ccccc1	ZINC000488712965	332022406	/nfs/dbraw/zinc/02/24/06/332022406.db2.gz	KPGXDZMBUKVEIZ-OAHLLOKOSA-N	0	0	295.373	4.240	20	30		CIEDRN
C=CCC[C@H](C(=O)NC[C@H]1CC=CCC1)c1ccccc1	ZINC000488719632	332022684	/nfs/dbraw/zinc/02/26/84/332022684.db2.gz	XISPQVZOZVDJJY-WMZOPIPTSA-N	0	0	283.415	4.209	20	30		CIEDRN
C=CCC[C@H](C(=O)NC[C@@H]1CC=CCC1)c1ccccc1	ZINC000488719628	332022702	/nfs/dbraw/zinc/02/27/02/332022702.db2.gz	XISPQVZOZVDJJY-AEFFLSMTSA-N	0	0	283.415	4.209	20	30		CIEDRN
C=CCn1cccc1C(=O)Nc1ccc(OC(C)C)c(C)c1	ZINC000488763014	332024531	/nfs/dbraw/zinc/02/45/31/332024531.db2.gz	DZBWMMZGXHHQEA-UHFFFAOYSA-N	0	0	298.386	4.022	20	30		CIEDRN
C=CCCC[C@H](C)Sc1ccc(C(F)(F)F)nn1	ZINC000488785575	332025625	/nfs/dbraw/zinc/02/56/25/332025625.db2.gz	SILUWSCAKGOXCX-VIFPVBQESA-N	0	0	276.327	4.332	20	30		CIEDRN
C=C(CC)CSc1nc(C(F)(F)F)ccc1C#N	ZINC000488788363	332025726	/nfs/dbraw/zinc/02/57/26/332025726.db2.gz	SOQSNKCKQIDETJ-UHFFFAOYSA-N	0	0	272.295	4.030	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Cc1c(C)cccc1Cl	ZINC000488798772	332026150	/nfs/dbraw/zinc/02/61/50/332026150.db2.gz	JTKNGQUQRPCXHY-CYBMUJFWSA-N	0	0	279.811	4.052	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1ccc(C2CCC2)cc1	ZINC000488811493	332026633	/nfs/dbraw/zinc/02/66/33/332026633.db2.gz	BURCQQPDQBTBHG-KRWDZBQOSA-N	0	0	269.388	4.135	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1ccc(SC2CC2)cc1	ZINC000488817348	332027057	/nfs/dbraw/zinc/02/70/57/332027057.db2.gz	ODPCRQQHQADEIZ-AWEZNQCLSA-N	0	0	287.428	4.122	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)CCCc1cc(C)sc1C	ZINC000488831821	332028098	/nfs/dbraw/zinc/02/80/98/332028098.db2.gz	SZDVSVAJPDULEI-MRXNPFEDSA-N	0	0	291.460	4.255	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)CCCc1c[nH]c2ccccc12	ZINC000488843509	332028794	/nfs/dbraw/zinc/02/87/94/332028794.db2.gz	UJLFLMRBWAWAFJ-MRXNPFEDSA-N	0	0	296.414	4.058	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1cc2c(s1)CCCCC2	ZINC000488843644	332028805	/nfs/dbraw/zinc/02/88/05/332028805.db2.gz	VQRBWOUESQRQEG-CQSZACIVSA-N	0	0	289.444	4.198	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1cc2c(s1)CCCCC2	ZINC000488843643	332028867	/nfs/dbraw/zinc/02/88/67/332028867.db2.gz	VQRBWOUESQRQEG-AWEZNQCLSA-N	0	0	289.444	4.198	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)CCCc1ccc(Cl)cc1	ZINC000488848160	332029182	/nfs/dbraw/zinc/02/91/82/332029182.db2.gz	BTVJOTKXCHBQEZ-INIZCTEOSA-N	0	0	291.822	4.230	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)CCCc1ccc(Cl)cc1	ZINC000488848161	332029321	/nfs/dbraw/zinc/02/93/21/332029321.db2.gz	BTVJOTKXCHBQEZ-MRXNPFEDSA-N	0	0	291.822	4.230	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)CC(C)(C)c1ccc(C)cc1	ZINC000488847800	332029351	/nfs/dbraw/zinc/02/93/51/332029351.db2.gz	ACQGOWYQDBZEAS-QGZVFWFLSA-N	0	0	285.431	4.230	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)C[C@H]1CCCc2ccccc21	ZINC000488855326	332029606	/nfs/dbraw/zinc/02/96/06/332029606.db2.gz	ABRDLAYRKBZZEJ-SJORKVTESA-N	0	0	283.415	4.064	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)C[C@H]1CCCc2ccccc21	ZINC000488855322	332029637	/nfs/dbraw/zinc/02/96/37/332029637.db2.gz	ABRDLAYRKBZZEJ-IAGOWNOFSA-N	0	0	283.415	4.064	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1cccc2ccccc21	ZINC000488863509	332030045	/nfs/dbraw/zinc/03/00/45/332030045.db2.gz	XWSZHWOENWGURW-HNNXBMFYSA-N	0	0	265.356	4.021	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Cc1cc(Cl)ccc1Cl	ZINC000488861662	332030157	/nfs/dbraw/zinc/03/01/57/332030157.db2.gz	RBZWYWTXRLZPQU-CYBMUJFWSA-N	0	0	298.213	4.103	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)C[C@@H](C)C1CCCCC1	ZINC000488868383	332030207	/nfs/dbraw/zinc/03/02/07/332030207.db2.gz	JQVOOEQQTRLBIY-GDBMZVCRSA-N	0	0	263.425	4.160	20	30		CIEDRN
C=CC[C@H](C(=O)N1CCCCC[C@@H]1C)c1ccccc1	ZINC000488866073	332030214	/nfs/dbraw/zinc/03/02/14/332030214.db2.gz	VZSGSQAOGWWODS-RDJZCZTQSA-N	0	0	271.404	4.137	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@H](C)CC1CCCCC1	ZINC000488869224	332030570	/nfs/dbraw/zinc/03/05/70/332030570.db2.gz	AKQMZQQCLOHUHQ-GDBMZVCRSA-N	0	0	263.425	4.160	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)[C@@H](C)c1cccc(Cl)c1	ZINC000488878273	332031315	/nfs/dbraw/zinc/03/13/15/332031315.db2.gz	IJQSTRPYHWWERO-WFASDCNBSA-N	0	0	277.795	4.011	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)[C@H](C)c1ccc(Cl)s1	ZINC000488878807	332031341	/nfs/dbraw/zinc/03/13/41/332031341.db2.gz	NEDYQNWUPSBWPP-MNOVXSKESA-N	0	0	283.824	4.072	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)[C@@H](C)c1cc2ccccc2o1	ZINC000488878008	332031366	/nfs/dbraw/zinc/03/13/66/332031366.db2.gz	JDIFWIFXJLOGQG-ZFWWWQNUSA-N	0	0	283.371	4.103	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@H](C)c1ccc(Cl)s1	ZINC000488878806	332031403	/nfs/dbraw/zinc/03/14/03/332031403.db2.gz	NEDYQNWUPSBWPP-GHMZBOCLSA-N	0	0	283.824	4.072	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)[C@H](C)Cc1ccccc1Cl	ZINC000488879922	332031624	/nfs/dbraw/zinc/03/16/24/332031624.db2.gz	POWQFSHQTPHBEX-HIFRSBDPSA-N	0	0	291.822	4.086	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)[C@@H](C)c1ccc(Cl)s1	ZINC000488878808	332031681	/nfs/dbraw/zinc/03/16/81/332031681.db2.gz	NEDYQNWUPSBWPP-QWRGUYRKSA-N	0	0	283.824	4.072	20	30		CIEDRN
C=CCC[C@H](C(=O)NC[C@@H](C)C(C)C)c1ccccc1	ZINC000489006992	332037325	/nfs/dbraw/zinc/03/73/25/332037325.db2.gz	FQNBKZBOKSYMPS-WBVHZDCISA-N	0	0	273.420	4.145	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCc1cc2ccccc2s1	ZINC000489570562	332059700	/nfs/dbraw/zinc/05/97/00/332059700.db2.gz	VZXJESTZOJBPQD-GFCCVEGCSA-N	0	0	273.401	4.120	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H]1CCC[C@@H](c2ccccc2)C1	ZINC000489642903	332062671	/nfs/dbraw/zinc/06/26/71/332062671.db2.gz	RPOIEFPNYLMSLA-ZHALLVOQSA-N	0	0	285.431	4.431	20	30		CIEDRN
C=CC[C@@H](C(=O)NCC12CCC(CC1)C2)c1ccccc1	ZINC000489663575	332063600	/nfs/dbraw/zinc/06/36/00/332063600.db2.gz	WJMOOVKNWCXERA-URSIVYNOSA-N	0	0	283.415	4.043	20	30		CIEDRN
C=CC[C@@H](C(=O)N1Cc2ccccc2[C@@H]1C)c1ccccc1	ZINC000489683285	332064637	/nfs/dbraw/zinc/06/46/37/332064637.db2.gz	QQGKCPCXLRUIPB-HNAYVOBHSA-N	0	0	291.394	4.450	20	30		CIEDRN
C=CCN(CC=C)C(=O)c1ccc(OCCCCC)cc1	ZINC000489683078	332064704	/nfs/dbraw/zinc/06/47/04/332064704.db2.gz	IZUNNNNKKTYZBC-UHFFFAOYSA-N	0	0	287.403	4.070	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@H]1C[C@@H]1c1ccccc1Cl	ZINC000489761767	332067275	/nfs/dbraw/zinc/06/72/75/332067275.db2.gz	BPCWAGPHNJVTCR-KGLIPLIRSA-N	0	0	291.822	4.162	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)C1(c2cc(C)cc(C)c2)CC1	ZINC000489773042	332067362	/nfs/dbraw/zinc/06/73/62/332067362.db2.gz	VPGDBGCBVRNCCC-UHFFFAOYSA-N	0	0	285.431	4.054	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@@H](C)c1ccc(Cl)s1	ZINC000489824178	332068998	/nfs/dbraw/zinc/06/89/98/332068998.db2.gz	IVIUOBFTMPZHLD-JTQLQIEISA-N	0	0	285.840	4.224	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)CCSc1ccccc1F	ZINC000489862847	332070759	/nfs/dbraw/zinc/07/07/59/332070759.db2.gz	YSHXPXNEEWBPEU-UHFFFAOYSA-N	0	0	295.423	4.026	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1ccc(-c2cccs2)o1	ZINC000489879386	332071218	/nfs/dbraw/zinc/07/12/18/332071218.db2.gz	BLVQNQSPKYUDGS-UHFFFAOYSA-N	0	0	289.400	4.340	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)C[C@H](C=C)c1ccccc1	ZINC000489887676	332071794	/nfs/dbraw/zinc/07/17/94/332071794.db2.gz	RTWQIGHRCUWHPU-HNNXBMFYSA-N	0	0	271.404	4.065	20	30		CIEDRN
CCC[C@H](C(=O)NC(C#N)(CCC)CCC)C(C)C	ZINC000489960664	332074299	/nfs/dbraw/zinc/07/42/99/332074299.db2.gz	WFLBNPSCAIRZBB-AWEZNQCLSA-N	0	0	266.429	4.037	20	30		CIEDRN
C=CCn1cccc1C(=O)N(Cc1ccccc1)[C@@H](C)CC	ZINC000490022979	332076999	/nfs/dbraw/zinc/07/69/99/332076999.db2.gz	CZAXJHPRXYVDQF-INIZCTEOSA-N	0	0	296.414	4.115	20	30		CIEDRN
C=C(C)CNC(=O)c1cc(-c2ccc(F)cc2)c(C)s1	ZINC000490030724	332077618	/nfs/dbraw/zinc/07/76/18/332077618.db2.gz	HIKRDSJLVVSCSU-UHFFFAOYSA-N	0	0	289.375	4.169	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)CCCc1ccc(C)cc1	ZINC000490040010	332078037	/nfs/dbraw/zinc/07/80/37/332078037.db2.gz	OPUSHAKRLZBCAJ-UHFFFAOYSA-N	0	0	273.420	4.036	20	30		CIEDRN
C=CCN(C)C(=O)C[C@H](Cc1ccccc1)c1ccccc1	ZINC000490045112	332078369	/nfs/dbraw/zinc/07/83/69/332078369.db2.gz	NCWRWYKSILCCQI-IBGZPJMESA-N	0	0	293.410	4.047	20	30		CIEDRN
C=CCCCCNC(=O)[C@H](CCC=C)c1ccccc1	ZINC000490181683	332083680	/nfs/dbraw/zinc/08/36/80/332083680.db2.gz	RAPAQHGZBCPRKU-QGZVFWFLSA-N	0	0	271.404	4.209	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)CC1(C)CCCCC1	ZINC000490196391	332084193	/nfs/dbraw/zinc/08/41/93/332084193.db2.gz	HXRQCRSOFLVTMW-UHFFFAOYSA-N	0	0	289.419	4.197	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@@H](CC)CC(F)(F)F)c1ccccc1	ZINC000490220593	332084794	/nfs/dbraw/zinc/08/47/94/332084794.db2.gz	BWQNCWNSTZNXRP-KBPBESRZSA-N	0	0	299.336	4.194	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1ccc(OCCC(C)C)cc1	ZINC000490225814	332084873	/nfs/dbraw/zinc/08/48/73/332084873.db2.gz	VIVHPKPHXDSLLP-UHFFFAOYSA-N	0	0	289.419	4.150	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@H](CC)CC(F)(F)F)c1ccccc1	ZINC000490220596	332084928	/nfs/dbraw/zinc/08/49/28/332084928.db2.gz	BWQNCWNSTZNXRP-ZIAGYGMSSA-N	0	0	299.336	4.194	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)[C@@H]1CCCC(C)(C)C1	ZINC000490219972	332084931	/nfs/dbraw/zinc/08/49/31/332084931.db2.gz	ZTBYCQRKVONFQK-OAHLLOKOSA-N	0	0	289.419	4.053	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)CC1CCC(C)CC1	ZINC000490238777	332085004	/nfs/dbraw/zinc/08/50/04/332085004.db2.gz	DYMHMXUIGXYABH-UHFFFAOYSA-N	0	0	289.419	4.053	20	30		CIEDRN
C=CCC[C@@H](C(=O)N(CC)CCC1CC1)c1ccccc1	ZINC000490236727	332085038	/nfs/dbraw/zinc/08/50/38/332085038.db2.gz	DVRPKQIOOLFSJA-GOSISDBHSA-N	0	0	285.431	4.385	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)C[C@H]1CCC[C@@H](C)C1	ZINC000490279346	332085923	/nfs/dbraw/zinc/08/59/23/332085923.db2.gz	ZQPHIWUJWLCFFV-CVEARBPZSA-N	0	0	289.419	4.053	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)CCC1CCCCC1	ZINC000490285683	332085934	/nfs/dbraw/zinc/08/59/34/332085934.db2.gz	IYHHIUZERLZBLL-UHFFFAOYSA-N	0	0	289.419	4.197	20	30		CIEDRN
N#Cc1cc(NC(=O)C2CCC2)ccc1Oc1ccccc1	ZINC000490481830	332090114	/nfs/dbraw/zinc/09/01/14/332090114.db2.gz	ZRCSWAIVYVDHLD-UHFFFAOYSA-N	0	0	292.338	4.089	20	30		CIEDRN
C=CCN(C(=O)Nc1ccc(CC)c(Cl)c1)C1CC1	ZINC000490856995	332121404	/nfs/dbraw/zinc/12/14/04/332121404.db2.gz	SESAKSGDRMJACI-UHFFFAOYSA-N	0	0	278.783	4.085	20	30		CIEDRN
Cc1cc(C)c(NC(=O)/C=C\c2ccc(C#N)cc2)c(C)c1	ZINC000490918958	332129217	/nfs/dbraw/zinc/12/92/17/332129217.db2.gz	FXNQPAUWINGANC-HJWRWDBZSA-N	0	0	290.366	4.135	20	30		CIEDRN
C=CCN(CC#Cc1ccccc1Cl)CCc1ccco1	ZINC000491327254	332191198	/nfs/dbraw/zinc/19/11/98/332191198.db2.gz	AAOUDGVPOHQXOM-UHFFFAOYSA-N	0	0	299.801	4.015	20	30		CIEDRN
N#Cc1ccc(/C=C/C(=O)Nc2cccc(C(F)F)c2)cc1	ZINC000491380182	332200838	/nfs/dbraw/zinc/20/08/38/332200838.db2.gz	CRUOWMKUGLAHJB-CMDGGOBGSA-N	0	0	298.292	4.148	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@@H](C)c1cc2ccccc2s1	ZINC000172135486	335095795	/nfs/dbraw/zinc/09/57/95/335095795.db2.gz	XEOWVFZLBPZGBN-RYUDHWBXSA-N	0	0	288.416	4.226	20	30		CIEDRN
C=CCCC(=O)Nc1nc2c(s1)c(Cl)ccc2C	ZINC000575347116	335096047	/nfs/dbraw/zinc/09/60/47/335096047.db2.gz	KTPBBWGAXZOSCJ-UHFFFAOYSA-N	0	0	280.780	4.163	20	30		CIEDRN
Cc1cccc(NC(=O)Nc2cc(C#N)ccc2C)c1C	ZINC000172220374	335097981	/nfs/dbraw/zinc/09/79/81/335097981.db2.gz	DWHGSESYORSLNI-UHFFFAOYSA-N	0	0	279.343	4.128	20	30		CIEDRN
CC#CCCCc1nc([C@H]2CCCC(C)(C)C2)no1	ZINC000575366813	335098187	/nfs/dbraw/zinc/09/81/87/335098187.db2.gz	IVCNFBFWOUONEK-ZDUSSCGKSA-N	0	0	260.381	4.099	20	30		CIEDRN
C=CCCCCCN(C)C(=O)N[C@@H](C)Cc1cccs1	ZINC000172369376	335103342	/nfs/dbraw/zinc/10/33/42/335103342.db2.gz	PLUWSHZNDKANKC-AWEZNQCLSA-N	0	0	294.464	4.067	20	30		CIEDRN
CCN(C(=O)/C=C\C1CCCC1)[C@@H](C)c1ccc(C#N)cc1	ZINC000493373701	332437573	/nfs/dbraw/zinc/43/75/73/332437573.db2.gz	VNLMTJADUXOZPV-WVUXNXBLSA-N	0	0	296.414	4.214	20	30		CIEDRN
CC#CCCCc1nc(-c2oc3ccccc3c2C)no1	ZINC000575556687	335106914	/nfs/dbraw/zinc/10/69/14/335106914.db2.gz	OMYJSDRUYALRON-UHFFFAOYSA-N	0	0	280.327	4.137	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)N[C@H](c1ccccc1)C(C)C	ZINC000494214696	332466909	/nfs/dbraw/zinc/46/69/09/332466909.db2.gz	CHHZNIJRLIUESP-IRXDYDNUSA-N	0	0	286.419	4.134	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H]1CCc2ccc(C(C)C)cc21	ZINC000494225625	332467441	/nfs/dbraw/zinc/46/74/41/332467441.db2.gz	BKYYWYSZSQHSAP-GOSISDBHSA-N	0	0	283.415	4.107	20	30		CIEDRN
C=CCCCC(=O)Nc1cc(OC)c(C(C)C)c(OC)c1	ZINC000494485288	332475361	/nfs/dbraw/zinc/47/53/61/332475361.db2.gz	KMTWUCOLMLTYBJ-UHFFFAOYSA-N	0	0	291.391	4.122	20	30		CIEDRN
C=CCC[C@H](CCC)Nc1ccc2ccc(=O)n(C)c2c1	ZINC000494512162	332476637	/nfs/dbraw/zinc/47/66/37/332476637.db2.gz	IGUHKIQMTRAHBB-HNNXBMFYSA-N	0	0	284.403	4.085	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)C/C(C)=C\c1ccccc1	ZINC000494862740	332488741	/nfs/dbraw/zinc/48/87/41/332488741.db2.gz	DNLKPWRKMRURRD-RTYFKUQISA-N	0	0	271.404	4.151	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)N[C@@H](c1ccccc1)C1CCC1	ZINC000494906528	332490543	/nfs/dbraw/zinc/49/05/43/332490543.db2.gz	FILRJRPSTHGYLK-ROUUACIJSA-N	0	0	298.430	4.278	20	30		CIEDRN
C=CC[C@@H](C)[C@H](C)Nc1cnn(CC(C)C)c1C(F)F	ZINC000495146447	332508447	/nfs/dbraw/zinc/50/84/47/332508447.db2.gz	FEFQCKUDQSUURK-NEPJUHHUSA-N	0	0	285.382	4.489	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)N[C@@H](C)c1cccc(C)c1C	ZINC000495198804	332511497	/nfs/dbraw/zinc/51/14/97/332511497.db2.gz	ALZIFNRGQPHWSX-JKSUJKDBSA-N	0	0	286.419	4.115	20	30		CIEDRN
CC(C)(CCC#N)CNC(=O)[C@@H]1CCC[C@H]2CCCC[C@@H]21	ZINC000553755888	334397813	/nfs/dbraw/zinc/39/78/13/334397813.db2.gz	MXHZXOCJYOGCQA-OWCLPIDISA-N	0	0	290.451	4.039	20	30		CIEDRN
C=CCCCC(=O)N1CC[C@H](c2cccc(Cl)c2)C1	ZINC000497028937	332567921	/nfs/dbraw/zinc/56/79/21/332567921.db2.gz	BOCXOHSVVNMPIW-AWEZNQCLSA-N	0	0	277.795	4.012	20	30		CIEDRN
C[C@@H](c1ccccc1)N(CC1CCC1)C(=O)CC(C)(C)C#N	ZINC000498925231	332575699	/nfs/dbraw/zinc/57/56/99/332575699.db2.gz	ADITUSWTBGPQON-HNNXBMFYSA-N	0	0	298.430	4.316	20	30		CIEDRN
C=CCOc1cccc(NC(=O)c2coc3ccccc23)c1	ZINC000499088823	332578824	/nfs/dbraw/zinc/57/88/24/332578824.db2.gz	XLONOJHCFAYYTB-UHFFFAOYSA-N	0	0	293.322	4.250	20	30		CIEDRN
COc1cc(C#N)ccc1CSc1cc(F)ccc1F	ZINC000499316403	332584119	/nfs/dbraw/zinc/58/41/19/332584119.db2.gz	LGCDRBGLRJBFAW-UHFFFAOYSA-N	0	0	291.322	4.137	20	30		CIEDRN
CCC[C@H](CC1CCCCC1)C(=O)N(CC)C[C@H](C)C#N	ZINC000499395129	332585322	/nfs/dbraw/zinc/58/53/22/332585322.db2.gz	XDTOXCZIQVUFHC-NVXWUHKLSA-N	0	0	292.467	4.381	20	30		CIEDRN
Cc1ccnc(NC[C@H]2CCC[C@H](C(F)(F)F)C2)c1C#N	ZINC000554732971	334449705	/nfs/dbraw/zinc/44/97/05/334449705.db2.gz	WDOJMHPWHHKRNJ-RYUDHWBXSA-N	0	0	297.324	4.042	20	30		CIEDRN
N#Cc1cccc(N[C@@H]2CCC[C@@H](c3cccnc3)C2)c1	ZINC000500393023	332606300	/nfs/dbraw/zinc/60/63/00/332606300.db2.gz	AAUZFGBJRBXCFI-CRAIPNDOSA-N	0	0	277.371	4.092	20	30		CIEDRN
C=CCCc1ccccc1NCc1cc(O)cc(F)c1	ZINC000500449715	332609744	/nfs/dbraw/zinc/60/97/44/332609744.db2.gz	XCYMGTHCHFZRTH-UHFFFAOYSA-N	0	0	271.335	4.262	20	30		CIEDRN
C[C@@H]1C[C@@]1(NCc1ccccc1C#N)c1ccc(Cl)cc1	ZINC000500454520	332610064	/nfs/dbraw/zinc/61/00/64/332610064.db2.gz	YGDIDRVBPLBKEA-ACJLOTCBSA-N	0	0	296.801	4.237	20	30		CIEDRN
Cc1c(C#N)cccc1NCc1ccccc1OC(F)F	ZINC000500758479	332617989	/nfs/dbraw/zinc/61/79/89/332617989.db2.gz	ZVFMJSMYZJDZPC-UHFFFAOYSA-N	0	0	288.297	4.080	20	30		CIEDRN
CCSc1ccccc1OCc1ccc(C#N)cc1OC	ZINC000500873321	332620900	/nfs/dbraw/zinc/62/09/00/332620900.db2.gz	BZCIMWOBRIPOFW-UHFFFAOYSA-N	0	0	299.395	4.258	20	30		CIEDRN
Cc1ccc(C#N)cc1NCc1cccc(OC(F)F)c1	ZINC000501001534	332623701	/nfs/dbraw/zinc/62/37/01/332623701.db2.gz	LBQVTKHKRMWZNR-UHFFFAOYSA-N	0	0	288.297	4.080	20	30		CIEDRN
C=CCOc1cccc(NC(=O)[C@@H](C)SCCCC)c1	ZINC000501141894	332627472	/nfs/dbraw/zinc/62/74/72/332627472.db2.gz	VZKZMCQMCYUCIW-CYBMUJFWSA-N	0	0	293.432	4.112	20	30		CIEDRN
Cc1cc(C)cc([C@@H](C)Nc2ncc(C#N)cc2Cl)c1	ZINC000501170583	332627922	/nfs/dbraw/zinc/62/79/22/332627922.db2.gz	CEJWRSVNUQOJJA-GFCCVEGCSA-N	0	0	285.778	4.397	20	30		CIEDRN
CCN(CCC#N)[C@H](C)c1cc(Cl)ccc1Cl	ZINC000154854119	334705861	/nfs/dbraw/zinc/70/58/61/334705861.db2.gz	RIMYXMKZEKYQTJ-SNVBAGLBSA-N	0	0	271.191	4.290	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)Cc1cccc(CC)c1	ZINC000501274178	332629811	/nfs/dbraw/zinc/62/98/11/332629811.db2.gz	RSZYCARKXJUETN-UHFFFAOYSA-N	0	0	299.439	4.068	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](c1ccc(F)cc1)C(C)C	ZINC000501655812	332637996	/nfs/dbraw/zinc/63/79/96/332637996.db2.gz	LEKIRNZWZLFEHI-XJKSGUPXSA-N	0	0	277.383	4.241	20	30		CIEDRN
C=CCCc1ccccc1N[C@H]1CCO[C@@H](C(C)C)C1	ZINC000502308234	332653215	/nfs/dbraw/zinc/65/32/15/332653215.db2.gz	HDCXKLHJULNNLX-FUHWJXTLSA-N	0	0	273.420	4.421	20	30		CIEDRN
C=CCCc1ccccc1N[C@H]1CCC[C@H](C#N)C1	ZINC000502310088	332653226	/nfs/dbraw/zinc/65/32/26/332653226.db2.gz	OCWYCWIWASOGAR-HOCLYGCPSA-N	0	0	254.377	4.299	20	30		CIEDRN
C=CCCc1ccccc1N[C@@H](C)C1CCOCC1	ZINC000502365663	332655032	/nfs/dbraw/zinc/65/50/32/332655032.db2.gz	LRPZYFDRDMNWBE-AWEZNQCLSA-N	0	0	259.393	4.032	20	30		CIEDRN
N#Cc1ccc(CSCc2c(F)cccc2F)cc1	ZINC000502392083	332656217	/nfs/dbraw/zinc/65/62/17/332656217.db2.gz	MMFCINFKNJCZMD-UHFFFAOYSA-N	0	0	275.323	4.270	20	30		CIEDRN
CC(C)C[C@](C)(C#N)NC(=O)c1cc(Cl)cc(Cl)c1	ZINC000502424703	332658527	/nfs/dbraw/zinc/65/85/27/332658527.db2.gz	LUBWZLSVKOKASM-CQSZACIVSA-N	0	0	299.201	4.052	20	30		CIEDRN
Cc1sc(NC(=O)C2C[C@@H](C)C[C@H](C)C2)c(C#N)c1C	ZINC000502501702	332663749	/nfs/dbraw/zinc/66/37/49/332663749.db2.gz	MTQNBIZAPXJNHI-UWVGGRQHSA-N	0	0	290.432	4.247	20	30		CIEDRN
C[C@H]1C[C@H](C(=O)Nc2ccc(C(C)(C)C#N)cc2)C[C@@H](C)C1	ZINC000502792016	332673046	/nfs/dbraw/zinc/67/30/46/332673046.db2.gz	CPOUELGGFOLVLQ-FICVDOATSA-N	0	0	298.430	4.499	20	30		CIEDRN
CCCC[C@@H](C)C(=O)N(CC)[C@@H](C)c1ccc(C#N)cc1	ZINC000503132199	332682171	/nfs/dbraw/zinc/68/21/71/332682171.db2.gz	POKQJLJPJOHNFX-CABCVRRESA-N	0	0	286.419	4.294	20	30		CIEDRN
C=CCN(CCc1ccccc1)C(=O)[C@H](C)CCCC	ZINC000503465792	332690295	/nfs/dbraw/zinc/69/02/95/332690295.db2.gz	VUIRATPGRBPZGG-MRXNPFEDSA-N	0	0	273.420	4.070	20	30		CIEDRN
CCOc1ccc(C#N)cc1NC(=O)CCCC(C)(C)C	ZINC000504310764	332707979	/nfs/dbraw/zinc/70/79/79/332707979.db2.gz	AGFXZPQUZVSPEH-UHFFFAOYSA-N	0	0	288.391	4.112	20	30		CIEDRN
Cc1sc(NC(=O)CCc2ccccc2C)c(C#N)c1C	ZINC000504415273	332711220	/nfs/dbraw/zinc/71/12/20/332711220.db2.gz	IJNYYPRUKDJWQS-UHFFFAOYSA-N	0	0	298.411	4.116	20	30		CIEDRN
CCn1c2ccc(C#N)cc2nc1-c1ccc2occc2c1	ZINC000504486551	332713106	/nfs/dbraw/zinc/71/31/06/332713106.db2.gz	BCZZYERZBVPSHJ-UHFFFAOYSA-N	0	0	287.322	4.341	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H]1CC[C@@H](Cc2ccccc2)C1	ZINC000504600420	332716406	/nfs/dbraw/zinc/71/64/06/332716406.db2.gz	AFFOXAFJHJWDSW-IRXDYDNUSA-N	0	0	285.431	4.116	20	30		CIEDRN
N#Cc1cnccc1/C=C/c1cc(F)cc(C(F)(F)F)c1	ZINC000504732807	332719675	/nfs/dbraw/zinc/71/96/75/332719675.db2.gz	SCBPLEWRZUKZKS-OWOJBTEDSA-N	0	0	292.235	4.282	20	30		CIEDRN
Cc1ccccc1-c1noc(/C=C\c2cccc(C#N)c2)n1	ZINC000504975261	332726910	/nfs/dbraw/zinc/72/69/10/332726910.db2.gz	PMTXVVVTTFMVPU-KTKRTIGZSA-N	0	0	287.322	4.087	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N[C@@H](C)CC1CC1	ZINC000505005265	332727553	/nfs/dbraw/zinc/72/75/53/332727553.db2.gz	JRZSIMLJBWTDEE-ZDUSSCGKSA-N	0	0	272.392	4.115	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CC[C@H](C)[C@H](C)C1	ZINC000505011113	332727769	/nfs/dbraw/zinc/72/77/69/332727769.db2.gz	QHGOXLCJAMBCEM-LSDHHAIUSA-N	0	0	286.419	4.315	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)NCc1ccccc1F	ZINC000505030089	332728523	/nfs/dbraw/zinc/72/85/23/332728523.db2.gz	SHNAIXRCNZBGCN-UHFFFAOYSA-N	0	0	298.361	4.266	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CCC[C@H](CC)C1	ZINC000505045685	332728920	/nfs/dbraw/zinc/72/89/20/332728920.db2.gz	KJPPBZUZOJPFDY-HNNXBMFYSA-N	0	0	286.419	4.459	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cnn(-c2ccc(C)cc2C)c1	ZINC000505175161	332733057	/nfs/dbraw/zinc/73/30/57/332733057.db2.gz	SGUKJJKTQOAIHD-UHFFFAOYSA-N	0	0	297.402	4.030	20	30		CIEDRN
CC(C)[C@H]1CCc2ccccc2[C@@H]1NC(=O)CC(C)(C)C#N	ZINC000505275496	332735666	/nfs/dbraw/zinc/73/56/66/332735666.db2.gz	TYXFVXAOOZIPFX-CRAIPNDOSA-N	0	0	298.430	4.002	20	30		CIEDRN
C=C[C@@H](C)NC(=O)C(C)(C)c1ccc(-c2ccccc2)cc1	ZINC000505598624	332745983	/nfs/dbraw/zinc/74/59/83/332745983.db2.gz	DSZBSNIBNWTVEL-OAHLLOKOSA-N	0	0	293.410	4.322	20	30		CIEDRN
C[C@H](CC(=O)N[C@H](C#N)c1ccccc1Cl)C(C)(C)C	ZINC000505684836	332749057	/nfs/dbraw/zinc/74/90/57/332749057.db2.gz	RUKHWGPGKJOURC-BXUZGUMPSA-N	0	0	292.810	4.093	20	30		CIEDRN
CC[C@]1(C)C[C@H]1C(=O)N[C@@H](C#N)c1ccc(C(C)(C)C)cc1	ZINC000505810257	332753241	/nfs/dbraw/zinc/75/32/41/332753241.db2.gz	YAJHGPUAMWTGNR-TXPKVOOTSA-N	0	0	298.430	4.101	20	30		CIEDRN
CC(C)CCC(=O)N[C@H](C#N)c1ccc(C(C)(C)C)cc1	ZINC000505831030	332754036	/nfs/dbraw/zinc/75/40/36/332754036.db2.gz	FUBNNLRVVQXMRC-MRXNPFEDSA-N	0	0	286.419	4.101	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)c1sccc1Cl	ZINC000505928479	332757997	/nfs/dbraw/zinc/75/79/97/332757997.db2.gz	OQJFWKLCPNSRDT-UHFFFAOYSA-N	0	0	297.832	4.291	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H](C)c1cc2cccc(F)c2o1	ZINC000505981583	332758772	/nfs/dbraw/zinc/75/87/72/332758772.db2.gz	LTUPELRUYLYDRY-LLVKDONJSA-N	0	0	289.350	4.351	20	30		CIEDRN
CCCc1ccccc1NCCOc1ccc(C#N)cc1	ZINC000506094830	332761916	/nfs/dbraw/zinc/76/19/16/332761916.db2.gz	RHFSPSFQUZHFAF-UHFFFAOYSA-N	0	0	280.371	4.002	20	30		CIEDRN
CC#CCSc1nnc(-c2cccc3ccccc32)o1	ZINC000172926616	332953989	/nfs/dbraw/zinc/95/39/89/332953989.db2.gz	LSJQZJCFQCUKQO-UHFFFAOYSA-N	0	0	280.352	4.005	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H](C)c1ccc(SC)cc1	ZINC000512164017	332955882	/nfs/dbraw/zinc/95/58/82/332955882.db2.gz	BDJPEHKFCROYHR-LBPRGKRZSA-N	0	0	277.433	4.188	20	30		CIEDRN
C[C@@H](NC1(c2ccccc2F)CC1)c1ccc(C#N)cc1F	ZINC000512279740	332961167	/nfs/dbraw/zinc/96/11/67/332961167.db2.gz	GXROQFLEGJWYDR-GFCCVEGCSA-N	0	0	298.336	4.176	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(OC(F)F)cc2F)CC1	ZINC000512489396	332970444	/nfs/dbraw/zinc/97/04/44/332970444.db2.gz	GAQGXPPVWDMCJZ-UHFFFAOYSA-N	0	0	299.292	4.112	20	30		CIEDRN
C=CCCC(=O)Nc1cccc(COc2ccccc2)c1C	ZINC000173625891	332976004	/nfs/dbraw/zinc/97/60/04/332976004.db2.gz	MIOHJCBLSOFTIL-UHFFFAOYSA-N	0	0	295.382	4.479	20	30		CIEDRN
C=C(CNC(=O)N(C)[C@H](C)c1ccccc1)c1ccccc1	ZINC000512661946	332978596	/nfs/dbraw/zinc/97/85/96/332978596.db2.gz	UZHKMUYHDPIJSP-MRXNPFEDSA-N	0	0	294.398	4.102	20	30		CIEDRN
CCc1ccc(N[C@@H](C)c2ccc(C#N)cc2F)cc1	ZINC000512668443	332979437	/nfs/dbraw/zinc/97/94/37/332979437.db2.gz	UYQKZQJOVWNSKK-LBPRGKRZSA-N	0	0	268.335	4.433	20	30		CIEDRN
N#Cc1ccc(CNc2cccc(C(F)(F)F)c2)cc1F	ZINC000404080405	332984901	/nfs/dbraw/zinc/98/49/01/332984901.db2.gz	RYQJVUACELXGPF-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
N#CCSCCCSCc1ccc(Cl)cc1	ZINC000174003076	332988500	/nfs/dbraw/zinc/98/85/00/332988500.db2.gz	JIRWIDNDTZRSHS-UHFFFAOYSA-N	0	0	271.838	4.220	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)NCCC1(F)CCC1	ZINC000512868168	332990583	/nfs/dbraw/zinc/99/05/83/332990583.db2.gz	YVJMGXBIEDLDHE-UHFFFAOYSA-N	0	0	296.430	4.047	20	30		CIEDRN
C=CCCCCNC(=O)N1CC[C@H]1c1ccc(Cl)cc1	ZINC000575811273	335117819	/nfs/dbraw/zinc/11/78/19/335117819.db2.gz	YMTOERPRBPXEDS-HNNXBMFYSA-N	0	0	292.810	4.153	20	30		CIEDRN
C=CCOc1cccc(CNc2cc(C)cc(C)c2)c1	ZINC000512939289	332994940	/nfs/dbraw/zinc/99/49/40/332994940.db2.gz	JEHURDZGQQUBFC-UHFFFAOYSA-N	0	0	267.372	4.480	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1cc(C(F)(F)F)ccc1C	ZINC000174913318	333010631	/nfs/dbraw/zinc/01/06/31/333010631.db2.gz	ZXAFCMMAKIYAIR-JTQLQIEISA-N	0	0	286.297	4.100	20	30		CIEDRN
CC[C@@H]1CCCCCN1C(=O)c1cc(C#N)ccc1Cl	ZINC000513281225	333012064	/nfs/dbraw/zinc/01/20/64/333012064.db2.gz	LVKUQRRVEMHFKQ-CYBMUJFWSA-N	0	0	290.794	4.006	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc2c(c1)OC1(CCCC1)O2	ZINC000175162749	333016072	/nfs/dbraw/zinc/01/60/72/333016072.db2.gz	MWNCLNLZGHEGAW-UHFFFAOYSA-N	0	0	287.359	4.023	20	30		CIEDRN
C=CCCCN(C)C(=O)[C@@H]1CCC[C@@H]2CCCC[C@H]12	ZINC000513377024	333016207	/nfs/dbraw/zinc/01/62/07/333016207.db2.gz	RHOJRHYGUSGJBU-HRCADAONSA-N	0	0	263.425	4.018	20	30		CIEDRN
C=CCCCC(=O)N(C)[C@H](C)c1cc2ccccc2o1	ZINC000175221905	333017623	/nfs/dbraw/zinc/01/76/23/333017623.db2.gz	GDTBAWZRNXNQHK-CYBMUJFWSA-N	0	0	271.360	4.309	20	30		CIEDRN
C=CCCCC(=O)N(CC)Cc1ccccc1Cl	ZINC000175243364	333018378	/nfs/dbraw/zinc/01/83/78/333018378.db2.gz	IJYRYSQGAHOPIV-UHFFFAOYSA-N	0	0	265.784	4.045	20	30		CIEDRN
Cc1ccccc1C1CC[NH+](Cc2ccc(C#N)cc2)CC1	ZINC000513497250	333022995	/nfs/dbraw/zinc/02/29/95/333022995.db2.gz	UEHYSAJJOXRMNI-UHFFFAOYSA-N	0	0	290.410	4.246	20	30		CIEDRN
C=C1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1	ZINC000513496872	333023065	/nfs/dbraw/zinc/02/30/65/333023065.db2.gz	MMJCKLORZAKKDV-UHFFFAOYSA-N	0	0	298.342	4.007	20	30		CIEDRN
N#Cc1ccc(NC(=O)c2cccc3ccccc32)cc1F	ZINC000308124611	333025122	/nfs/dbraw/zinc/02/51/22/333025122.db2.gz	UHMXARDQCXYWDS-UHFFFAOYSA-N	0	0	290.297	4.103	20	30		CIEDRN
C=CCSCc1ccc(Br)cc1F	ZINC000308195050	333026038	/nfs/dbraw/zinc/02/60/38/333026038.db2.gz	QKQCKXRYPQRBIV-UHFFFAOYSA-N	0	0	261.159	4.007	20	30		CIEDRN
Cc1ccc([C@H]2CCCN2c2ncc(C#N)cc2Cl)cc1	ZINC000513602148	333026268	/nfs/dbraw/zinc/02/62/68/333026268.db2.gz	CXJFIOGCBCECJJ-MRXNPFEDSA-N	0	0	297.789	4.257	20	30		CIEDRN
C=CCCCC(=O)N[C@H](C)c1ccc(SCC)cc1	ZINC000175568480	333026927	/nfs/dbraw/zinc/02/69/27/333026927.db2.gz	ASHNUGOGWVSDKB-CYBMUJFWSA-N	0	0	277.433	4.332	20	30		CIEDRN
CC(C)[C@@H](Nc1ncc(C#N)cc1Cl)c1ccccc1	ZINC000513621685	333027298	/nfs/dbraw/zinc/02/72/98/333027298.db2.gz	YFBLSYBCAJQQRX-OAHLLOKOSA-N	0	0	285.778	4.416	20	30		CIEDRN
N#Cc1cnc(Sc2ccccc2Cl)c(Cl)c1	ZINC000513634510	333028026	/nfs/dbraw/zinc/02/80/26/333028026.db2.gz	BXLCRQWJFXYAQP-UHFFFAOYSA-N	0	0	281.167	4.411	20	30		CIEDRN
N#Cc1cnc(SCC2CCCCC2)c(Cl)c1	ZINC000513635568	333028149	/nfs/dbraw/zinc/02/81/49/333028149.db2.gz	PBJFHIUCTKNXTM-UHFFFAOYSA-N	0	0	266.797	4.279	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](c1ccccc1)C1CCC1	ZINC000175706022	333029884	/nfs/dbraw/zinc/02/98/84/333029884.db2.gz	NLRNRUUEIMIXKE-KRWDZBQOSA-N	0	0	257.377	4.000	20	30		CIEDRN
C=CCCCC(=O)N1C[C@H](c2ccccc2C)C[C@@H]1C	ZINC000175725639	333031016	/nfs/dbraw/zinc/03/10/16/333031016.db2.gz	FILTYLXSXPUZIE-JKSUJKDBSA-N	0	0	271.404	4.056	20	30		CIEDRN
C=CCC[C@@H]([NH2+]CCOc1ccccc1F)c1ccco1	ZINC000513671615	333031327	/nfs/dbraw/zinc/03/13/27/333031327.db2.gz	DGEQYKCILQOSQY-OAHLLOKOSA-N	0	0	289.350	4.095	20	30		CIEDRN
C=CCOc1ccccc1CN(CCC#N)CC(C)(C)C	ZINC000513716440	333035012	/nfs/dbraw/zinc/03/50/12/333035012.db2.gz	BXCJBYQRMWALKT-UHFFFAOYSA-N	0	0	286.419	4.013	20	30		CIEDRN
CCC(CC)CN(CCC#N)Cc1cccc(F)c1F	ZINC000513717221	333035116	/nfs/dbraw/zinc/03/51/16/333035116.db2.gz	MVPGYMRXPNECAZ-UHFFFAOYSA-N	0	0	280.362	4.117	20	30		CIEDRN
CCc1ccc(-c2ccc(CN(C)[C@H](C)CC#N)o2)cc1	ZINC000513716958	333035183	/nfs/dbraw/zinc/03/51/83/333035183.db2.gz	KEBDLZUGNZVGQT-CQSZACIVSA-N	0	0	282.387	4.243	20	30		CIEDRN
CC(C)CCN(CCC#N)Cc1ccc(Cl)cc1	ZINC000513750245	333037601	/nfs/dbraw/zinc/03/76/01/333037601.db2.gz	DNQAURNFUYWCEZ-UHFFFAOYSA-N	0	0	264.800	4.102	20	30		CIEDRN
C[C@@H](Cc1ccccc1Cl)C(=O)Nc1ccc(C#N)cc1	ZINC000513806927	333040257	/nfs/dbraw/zinc/04/02/57/333040257.db2.gz	RQABEWSBIWBZFC-LBPRGKRZSA-N	0	0	298.773	4.029	20	30		CIEDRN
C[C@H](SCc1ccc([N+](=O)[O-])cc1)c1ccc(C#N)cc1	ZINC000513813640	333040685	/nfs/dbraw/zinc/04/06/85/333040685.db2.gz	ILMRMDSBOAOFEO-LBPRGKRZSA-N	0	0	298.367	4.461	20	30		CIEDRN
CCCC(CCC)[S@@](=O)CCCC(C)(C)C#N	ZINC000177109169	333053551	/nfs/dbraw/zinc/05/35/51/333053551.db2.gz	SGVPVQTZPRSELB-KRWDZBQOSA-N	0	0	257.443	4.034	20	30		CIEDRN
CCn1c2ccccc2nc1SCCCC(C)(C)C#N	ZINC000177143962	333054007	/nfs/dbraw/zinc/05/40/07/333054007.db2.gz	JRHYSCSTFBPTRS-UHFFFAOYSA-N	0	0	287.432	4.478	20	30		CIEDRN
N#Cc1ccc(NC[C@@H]2CCC(F)(F)C2)cc1Cl	ZINC000310408143	333058269	/nfs/dbraw/zinc/05/82/69/333058269.db2.gz	HHOCITJJXQPWDN-SECBINFHSA-N	0	0	270.710	4.059	20	30		CIEDRN
CC(C)CC[C@H]1CCCCN1C(=O)c1cccc(CC#N)c1	ZINC000177500372	333059736	/nfs/dbraw/zinc/05/97/36/333059736.db2.gz	VLUOAFAGBOQMAK-GOSISDBHSA-N	0	0	298.430	4.184	20	30		CIEDRN
Cc1c(CSc2ccccc2C#N)cccc1[N+](=O)[O-]	ZINC000172681467	335118770	/nfs/dbraw/zinc/11/87/70/335118770.db2.gz	NLIRTPIWIIOCJA-UHFFFAOYSA-N	0	0	284.340	4.067	20	30		CIEDRN
Cc1nc(CSCc2cc(F)ccc2C#N)sc1C	ZINC000177684602	333061861	/nfs/dbraw/zinc/06/18/61/333061861.db2.gz	BPBKGFSBFRTIFF-UHFFFAOYSA-N	0	0	292.404	4.204	20	30		CIEDRN
C=C(C)CS[C@H](C)C(=O)Nc1c(CC)cccc1CC	ZINC000177864657	333064425	/nfs/dbraw/zinc/06/44/25/333064425.db2.gz	ASBOCHGMDHDAAU-CYBMUJFWSA-N	0	0	291.460	4.448	20	30		CIEDRN
C/C=C(/C=C/C(=O)N(CC)[C@H](C)c1ccc(C#N)cc1)CC	ZINC000178160212	333068722	/nfs/dbraw/zinc/06/87/22/333068722.db2.gz	SIBZLIGJJBNQBM-PSGZBTNBSA-N	0	0	296.414	4.380	20	30		CIEDRN
CCCOc1ccccc1NCc1cc(C#N)ccc1F	ZINC000178230473	333069772	/nfs/dbraw/zinc/06/97/72/333069772.db2.gz	XBVJAEFBTCPEJK-UHFFFAOYSA-N	0	0	284.334	4.098	20	30		CIEDRN
CC(C)CCNc1ccccc1SC[C@@H](C)C#N	ZINC000178387221	333071943	/nfs/dbraw/zinc/07/19/43/333071943.db2.gz	OOHRVFQTJJXGIW-ZDUSSCGKSA-N	0	0	262.422	4.396	20	30		CIEDRN
Cc1nc(N(C)[C@H](C)c2cccs2)c(Cl)cc1C#N	ZINC000311763302	333072185	/nfs/dbraw/zinc/07/21/85/333072185.db2.gz	WPQBIUNXENVHMD-SNVBAGLBSA-N	0	0	291.807	4.174	20	30		CIEDRN
C[C@@H](C(=O)Nc1sc(-c2ccccc2)cc1C#N)C1CC1	ZINC000178440575	333072903	/nfs/dbraw/zinc/07/29/03/333072903.db2.gz	RIDZYUSJDLQJLG-LLVKDONJSA-N	0	0	296.395	4.271	20	30		CIEDRN
C[C@@H]1C[C@@H](C(C)(C)C)CCN1C(=O)c1ccc(CC#N)cc1	ZINC000516677139	333080305	/nfs/dbraw/zinc/08/03/05/333080305.db2.gz	NDDLCKFARPOFBP-PBHICJAKSA-N	0	0	298.430	4.039	20	30		CIEDRN
C[C@H]1CCCC[C@@H]1OCCSc1ccc(C#N)cc1	ZINC000516788000	333082687	/nfs/dbraw/zinc/08/26/87/333082687.db2.gz	WUILLUCYMRTQEC-BBRMVZONSA-N	0	0	275.417	4.246	20	30		CIEDRN
CCCCOc1cccc(NCc2ccc(C#N)cc2F)c1	ZINC000516819013	333083185	/nfs/dbraw/zinc/08/31/85/333083185.db2.gz	GWGMMCUTAOBZGI-UHFFFAOYSA-N	0	0	298.361	4.488	20	30		CIEDRN
Cc1cc(F)ccc1C[S@@](=O)CCCCC(C)(C)C#N	ZINC000516842802	333083949	/nfs/dbraw/zinc/08/39/49/333083949.db2.gz	JWXREBWWQJELKC-FQEVSTJZSA-N	0	0	295.423	4.103	20	30		CIEDRN
CC(C)(C)CCCCC(=O)N1CCC(CCC#N)CC1	ZINC000516972418	333088508	/nfs/dbraw/zinc/08/85/08/333088508.db2.gz	DEXLUUKPUFSVOB-UHFFFAOYSA-N	0	0	278.440	4.135	20	30		CIEDRN
C=C(CC)CS[C@@H](C)C(=O)NCCC1=CCCCC1	ZINC000516992837	333089166	/nfs/dbraw/zinc/08/91/66/333089166.db2.gz	KBBHHEUQAFGDGA-AWEZNQCLSA-N	0	0	281.465	4.081	20	30		CIEDRN
CC(C)Sc1ccc([C@H](C)Nc2cc(C#N)ncn2)cc1	ZINC000517007772	333089574	/nfs/dbraw/zinc/08/95/74/333089574.db2.gz	GUKHAUGVOWAHKI-LBPRGKRZSA-N	0	0	298.415	4.022	20	30		CIEDRN
CC[C@H](C)Oc1ccc(-c2noc([C@](C)(C#N)CC)n2)cc1	ZINC000517201567	333094458	/nfs/dbraw/zinc/09/44/58/333094458.db2.gz	ONONEROLZKISFL-SJCJKPOMSA-N	0	0	299.374	4.105	20	30		CIEDRN
N#Cc1ccc(-c2nc3cc(F)ccc3n2C2CC2)c(F)c1	ZINC000517215829	333094966	/nfs/dbraw/zinc/09/49/66/333094966.db2.gz	WSZTXPOJDIIMAM-UHFFFAOYSA-N	0	0	295.292	4.188	20	30		CIEDRN
Cc1cc(C)c(C)c(Oc2ccc([N+](=O)[O-])cc2C#N)c1	ZINC000007606920	333096728	/nfs/dbraw/zinc/09/67/28/333096728.db2.gz	SPPVDKFNBIQUBS-UHFFFAOYSA-N	0	0	282.299	4.184	20	30		CIEDRN
C/C=C/c1ccc(NCCCC2(C#N)CCOCC2)cc1	ZINC000517347744	333097696	/nfs/dbraw/zinc/09/76/96/333097696.db2.gz	DCLCJUZHXBXTTJ-DUXPYHPUSA-N	0	0	284.403	4.232	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)[C@H](C)c1cccc(F)c1	ZINC000172764767	335121144	/nfs/dbraw/zinc/12/11/44/335121144.db2.gz	FKJAOBLIYLZENC-OAHLLOKOSA-N	0	0	297.373	4.144	20	30		CIEDRN
C=C1CCN(C(=O)c2ccc3c(c2)Cc2ccccc2-3)CC1	ZINC000520868082	333107120	/nfs/dbraw/zinc/10/71/20/333107120.db2.gz	KDIAPTDIZSRSPB-UHFFFAOYSA-N	0	0	289.378	4.050	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1c(F)cccc1OC)c1ccccc1	ZINC000184441248	333128706	/nfs/dbraw/zinc/12/87/06/333128706.db2.gz	VFOXRKVBAXTOOQ-CYBMUJFWSA-N	0	0	299.345	4.133	20	30		CIEDRN
COc1cccc(F)c1NCc1ccccc1C(C)(C)C#N	ZINC000184545546	333129873	/nfs/dbraw/zinc/12/98/73/333129873.db2.gz	UZSMTIITCCRWBW-UHFFFAOYSA-N	0	0	298.361	4.248	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(Cl)cc1F	ZINC000184881652	333132877	/nfs/dbraw/zinc/13/28/77/333132877.db2.gz	QZLVXJUIWQQYHJ-SECBINFHSA-N	0	0	255.720	4.020	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)CCCC#CC	ZINC000184956548	333133693	/nfs/dbraw/zinc/13/36/93/333133693.db2.gz	YUKSYOYMVSWBBO-UHFFFAOYSA-N	0	0	295.835	4.110	20	30		CIEDRN
Cc1cc2c(ccc(OCc3cccc(C#N)c3)c2F)[nH]1	ZINC000184966910	333133822	/nfs/dbraw/zinc/13/38/22/333133822.db2.gz	GARNHFYPBKEHNJ-UHFFFAOYSA-N	0	0	280.302	4.066	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCc1ccc2cc(OC)ccc2c1	ZINC000184986028	333134120	/nfs/dbraw/zinc/13/41/20/333134120.db2.gz	COELUDWYIIUJDP-AWEZNQCLSA-N	0	0	297.398	4.067	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCCSc2ccccc21	ZINC000185005771	333134456	/nfs/dbraw/zinc/13/44/56/333134456.db2.gz	PIIZVNZAXLWQFX-CYBMUJFWSA-N	0	0	275.417	4.118	20	30		CIEDRN
CC/C=C/CCNc1cccc(OCCCC#N)c1	ZINC000185081368	333135219	/nfs/dbraw/zinc/13/52/19/333135219.db2.gz	KBOKUIMQKQAEKT-ONEGZZNKSA-N	0	0	258.365	4.137	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](C)c1ccc(OC(C)C)cc1	ZINC000185172866	333136366	/nfs/dbraw/zinc/13/63/66/333136366.db2.gz	FMCPRVKCTHGDKO-LSDHHAIUSA-N	0	0	289.419	4.253	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H]1CCc1ccccc1	ZINC000185216097	333136758	/nfs/dbraw/zinc/13/67/58/333136758.db2.gz	BVBXVHBFUFHJHG-FUHWJXTLSA-N	0	0	285.431	4.213	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@@H](C)c1cc(F)ccc1F	ZINC000185210470	333136885	/nfs/dbraw/zinc/13/68/85/333136885.db2.gz	OTBSDOQHCPUVTM-NEPJUHHUSA-N	0	0	281.346	4.087	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@@H](C)c1ccc(C)cc1	ZINC000185227607	333136930	/nfs/dbraw/zinc/13/69/30/333136930.db2.gz	HJPMMIHHGLJZOZ-CABCVRRESA-N	0	0	259.393	4.117	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@@H](C)c1cccc(Cl)c1	ZINC000185223505	333137086	/nfs/dbraw/zinc/13/70/86/333137086.db2.gz	HHNRIRNKDDFKJN-OLZOCXBDSA-N	0	0	279.811	4.462	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc2oc(C3CC3)nc2c1	ZINC000185303688	333138434	/nfs/dbraw/zinc/13/84/34/333138434.db2.gz	DCJDIRYTQCGLAO-NSHDSACASA-N	0	0	284.359	4.246	20	30		CIEDRN
CC#CCCCC(=O)N1CCC[C@@H]1[C@H](CC)c1ccccc1	ZINC000185335478	333138869	/nfs/dbraw/zinc/13/88/69/333138869.db2.gz	STLHFCVOVHDBJF-RTBURBONSA-N	0	0	297.442	4.365	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCC1(c2ccc(Cl)cc2)CC1	ZINC000185438753	333140756	/nfs/dbraw/zinc/14/07/56/333140756.db2.gz	DCNWGDBQJHEVGW-ZDUSSCGKSA-N	0	0	291.822	4.090	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C1CC1)[C@H]1CCc2ccccc21	ZINC000185443976	333140835	/nfs/dbraw/zinc/14/08/35/333140835.db2.gz	KRUCRCLNDKCMJJ-KSSFIOAISA-N	0	0	283.415	4.267	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(Oc2ccncc2)cc1	ZINC000185559211	333143825	/nfs/dbraw/zinc/14/38/25/333143825.db2.gz	ZGYBYVFRCAJRRK-AWEZNQCLSA-N	0	0	296.370	4.415	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccc(-c2nc(C)cs2)cc1	ZINC000185605225	333144623	/nfs/dbraw/zinc/14/46/23/333144623.db2.gz	BCIMTVZYYMVFJO-UHFFFAOYSA-N	0	0	298.411	4.251	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(C(F)(F)F)ccc1F	ZINC000185659386	333146239	/nfs/dbraw/zinc/14/62/39/333146239.db2.gz	KBKVNNZDMZLHKR-VIFPVBQESA-N	0	0	289.272	4.385	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](c2ccccc2)[C@@H](C)C1	ZINC000185680189	333146705	/nfs/dbraw/zinc/14/67/05/333146705.db2.gz	INGOZRJBQVTQNC-BQFCYCMXSA-N	0	0	285.431	4.241	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC(F)(F)F)[C@@H](C)C(C)C	ZINC000185704832	333146798	/nfs/dbraw/zinc/14/67/98/333146798.db2.gz	WVSPQNVTHJJCPY-NEPJUHHUSA-N	0	0	279.346	4.024	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cccc(CC(F)(F)F)c1	ZINC000185709980	333146998	/nfs/dbraw/zinc/14/69/98/333146998.db2.gz	AAZMAEVIUYZSML-LLVKDONJSA-N	0	0	285.309	4.332	20	30		CIEDRN
Cc1cc(N2CCCC2)ccc1N[C@H]1CCC[C@@H](C#N)C1	ZINC000185722279	333147184	/nfs/dbraw/zinc/14/71/84/333147184.db2.gz	UUQKZPLNCSKGRM-CVEARBPZSA-N	0	0	283.419	4.090	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](C)c1c(F)cccc1Cl	ZINC000185766150	333148252	/nfs/dbraw/zinc/14/82/52/333148252.db2.gz	JIFSPTCOKIMZKR-MNOVXSKESA-N	0	0	283.774	4.259	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccccc1SC(C)C	ZINC000185859633	333150226	/nfs/dbraw/zinc/15/02/26/333150226.db2.gz	KAIOENOKCVROKC-UHFFFAOYSA-N	0	0	275.417	4.319	20	30		CIEDRN
Cc1cc2cccnc2c(N[C@@H]2CCC[C@H](C#N)C2)c1	ZINC000185871578	333150776	/nfs/dbraw/zinc/15/07/76/333150776.db2.gz	GRZLYKQGYWQBLX-DZGCQCFKSA-N	0	0	265.360	4.038	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)Cc1cccc(OC(C)C)c1	ZINC000185944928	333152233	/nfs/dbraw/zinc/15/22/33/333152233.db2.gz	AHFSORKNXFXLNO-OAHLLOKOSA-N	0	0	289.419	4.035	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1ccc(C)cc1F)c1ccccc1	ZINC000186024101	333153577	/nfs/dbraw/zinc/15/35/77/333153577.db2.gz	KHVSBDUZGFBNKG-HNNXBMFYSA-N	0	0	283.346	4.433	20	30		CIEDRN
C=C(C)[C@@H](NC(=O)CC(C)(C)C)c1ccc(F)c(F)c1	ZINC000186034605	333153759	/nfs/dbraw/zinc/15/37/59/333153759.db2.gz	DLEXURHAODHAAH-OAHLLOKOSA-N	0	0	281.346	4.134	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](C(=C)C)c1ccc(F)c(F)c1	ZINC000186034019	333153787	/nfs/dbraw/zinc/15/37/87/333153787.db2.gz	OHRKSSMGYOSDTP-WBMJQRKESA-N	0	0	293.357	4.301	20	30		CIEDRN
C=C(C)[C@H](NC(=O)CC(C)(C)C)c1ccc(F)c(F)c1	ZINC000186034587	333153799	/nfs/dbraw/zinc/15/37/99/333153799.db2.gz	DLEXURHAODHAAH-HNNXBMFYSA-N	0	0	281.346	4.134	20	30		CIEDRN
C=C(C)[C@H](NC(=O)C[C@H]1C=CCC1)c1ccc(F)c(F)c1	ZINC000186044554	333153902	/nfs/dbraw/zinc/15/39/02/333153902.db2.gz	BEUQTLBINMUDBW-SJCJKPOMSA-N	0	0	291.341	4.055	20	30		CIEDRN
C=C(C)[C@H](NC(=O)c1ccsc1)c1ccc(F)c(F)c1	ZINC000186044422	333154115	/nfs/dbraw/zinc/15/41/15/333154115.db2.gz	OKEQVYXACGPTFY-AWEZNQCLSA-N	0	0	293.338	4.074	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(C)ccc1Br	ZINC000186103486	333154977	/nfs/dbraw/zinc/15/49/77/333154977.db2.gz	PUMRJYCVPNGAKM-NSHDSACASA-N	0	0	296.208	4.298	20	30		CIEDRN
CC#CCCCC(=O)Nc1sc(-c2ccccc2)nc1C	ZINC000186138945	333155802	/nfs/dbraw/zinc/15/58/02/333155802.db2.gz	MLILXJDYMDGOHJ-UHFFFAOYSA-N	0	0	298.411	4.251	20	30		CIEDRN
C=CCC[C@@H](C(=O)NCCc1cccs1)c1ccccc1	ZINC000186204172	333156694	/nfs/dbraw/zinc/15/66/94/333156694.db2.gz	HFMAMTWYEXEFCS-QGZVFWFLSA-N	0	0	299.439	4.157	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1ccc(Cl)cn1)c1ccccc1	ZINC000186221068	333156855	/nfs/dbraw/zinc/15/68/55/333156855.db2.gz	FZFKRMFNSDCEJO-AWEZNQCLSA-N	0	0	286.762	4.033	20	30		CIEDRN
C=CCC[C@H](C(=O)Nc1cc(C)ccn1)c1ccccc1	ZINC000186220154	333156882	/nfs/dbraw/zinc/15/68/82/333156882.db2.gz	BYBVJRMCZOZETI-INIZCTEOSA-N	0	0	280.371	4.079	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1ccc(CC#N)cc1)c1ccccc1	ZINC000186255362	333157346	/nfs/dbraw/zinc/15/73/46/333157346.db2.gz	ZPVURMQQDCLIQV-GOSISDBHSA-N	0	0	290.366	4.051	20	30		CIEDRN
C=CCOc1ccccc1C(=O)N(C)[C@H](C)c1ccccc1	ZINC000219907760	333159111	/nfs/dbraw/zinc/15/91/11/333159111.db2.gz	SCPVVGYXBUXVFS-OAHLLOKOSA-N	0	0	295.382	4.085	20	30		CIEDRN
CC(C)[C@@]1(C)C[C@@H]1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000186463686	333161315	/nfs/dbraw/zinc/16/13/15/333161315.db2.gz	WZIBHRYCNRYDRK-CRAIPNDOSA-N	0	0	284.403	4.108	20	30		CIEDRN
N#Cc1cc(Cl)ccc1CSc1ccc(O)cc1	ZINC000186592154	333163250	/nfs/dbraw/zinc/16/32/50/333163250.db2.gz	GKTPZBBUVJAUTF-UHFFFAOYSA-N	0	0	275.760	4.210	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1cc(F)c(OC)cc1C	ZINC000186767055	333165080	/nfs/dbraw/zinc/16/50/80/333165080.db2.gz	PSXDKRFINPEFAY-GFCCVEGCSA-N	0	0	294.370	4.009	20	30		CIEDRN
C=CC[C@@H](C(=O)N(C)CCc1ccccc1)c1ccccc1	ZINC000186841034	333165498	/nfs/dbraw/zinc/16/54/98/333165498.db2.gz	DDLWCWNCYNDDAC-LJQANCHMSA-N	0	0	293.410	4.047	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1ccc(C)cc1OC)c1ccccc1	ZINC000186978645	333167059	/nfs/dbraw/zinc/16/70/59/333167059.db2.gz	AJGPLJJZCQODBK-MRXNPFEDSA-N	0	0	295.382	4.302	20	30		CIEDRN
Cc1ccc(C(=O)COc2ccc(C#N)c(Cl)c2)c(C)c1	ZINC000220987966	333171790	/nfs/dbraw/zinc/17/17/90/333171790.db2.gz	SPEHMYNOJVKUTQ-UHFFFAOYSA-N	0	0	299.757	4.090	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)C[C@H](C)c1ccccc1	ZINC000187528824	333172174	/nfs/dbraw/zinc/17/21/74/333172174.db2.gz	LIQDUYIXLHNWDR-HNNXBMFYSA-N	0	0	286.419	4.111	20	30		CIEDRN
CCC1(CC)CCCN(C(=O)c2sccc2C#N)CC1	ZINC000189130681	333181821	/nfs/dbraw/zinc/18/18/21/333181821.db2.gz	ZWXGZEUPQRVZSV-UHFFFAOYSA-N	0	0	290.432	4.052	20	30		CIEDRN
C=CCN(C(=O)[C@@H](CC1CCCC1)C(C)C)C1CC1	ZINC000521687212	333183905	/nfs/dbraw/zinc/18/39/05/333183905.db2.gz	PFKYTZQOZNPNEZ-INIZCTEOSA-N	0	0	263.425	4.016	20	30		CIEDRN
CCN(C[C@H](C)C#N)C(=O)c1ccc(C(C)C)c(Cl)c1	ZINC000189208153	333185080	/nfs/dbraw/zinc/18/50/80/333185080.db2.gz	PLJZMDWLBNWRDV-GFCCVEGCSA-N	0	0	292.810	4.085	20	30		CIEDRN
N#Cc1cccnc1NCC1CCC(c2ccccc2)CC1	ZINC000521727516	333185327	/nfs/dbraw/zinc/18/53/27/333185327.db2.gz	WIZUJCFMNWMAJV-UHFFFAOYSA-N	0	0	291.398	4.339	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1ccccc1C)c1ccccc1	ZINC000189371793	333191120	/nfs/dbraw/zinc/19/11/20/333191120.db2.gz	YJAZAXPIGLJTQG-MRXNPFEDSA-N	0	0	265.356	4.293	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1ccccc1F)c1ccccc1	ZINC000189405671	333192225	/nfs/dbraw/zinc/19/22/25/333192225.db2.gz	KHIYYSZDRYQFER-AWEZNQCLSA-N	0	0	269.319	4.124	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cccc(Cl)c1C	ZINC000189758931	333198718	/nfs/dbraw/zinc/19/87/18/333198718.db2.gz	DEBLPPGYRRTTAO-CQSZACIVSA-N	0	0	251.757	4.189	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H](C)c1cccc(Cl)c1	ZINC000189859930	333199782	/nfs/dbraw/zinc/19/97/82/333199782.db2.gz	DCNSHFWAYAJSPQ-IAQYHMDHSA-N	0	0	265.784	4.120	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)c1cccc(C)c1Cl	ZINC000189907883	333200304	/nfs/dbraw/zinc/20/03/04/333200304.db2.gz	NMIJQWISJATFQZ-UHFFFAOYSA-N	0	0	292.810	4.193	20	30		CIEDRN
C=CCC1(C(=O)N[C@H](CC(C)(C)C)C(F)(F)F)CCC1	ZINC000190060212	333202841	/nfs/dbraw/zinc/20/28/41/333202841.db2.gz	CJLYJTGTEVSLHH-LLVKDONJSA-N	0	0	291.357	4.216	20	30		CIEDRN
CCC(=O)c1ccc(O[C@@H](C)c2cccc(C#N)c2)cc1	ZINC000190087987	333202954	/nfs/dbraw/zinc/20/29/54/333202954.db2.gz	WUFBYJVVMNQKII-ZDUSSCGKSA-N	0	0	279.339	4.291	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC=Cc2ccccc21	ZINC000190135048	333203546	/nfs/dbraw/zinc/20/35/46/333203546.db2.gz	JMXAKNVQWLLCQZ-CQSZACIVSA-N	0	0	255.361	4.039	20	30		CIEDRN
CC[N@H+](Cc1c[nH]c2ccccc12)Cc1ccccc1C#N	ZINC000190488876	333207439	/nfs/dbraw/zinc/20/74/39/333207439.db2.gz	GLIQMYYAOHHMFH-UHFFFAOYSA-N	0	0	289.382	4.062	20	30		CIEDRN
N#Cc1cccc(CNc2cccc(Cl)c2F)c1F	ZINC000223728775	333211510	/nfs/dbraw/zinc/21/15/10/333211510.db2.gz	VTJJVMBFZWLUHU-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C=CCSCCCc1nc(-c2ccc(C)c(F)c2)no1	ZINC000190946526	333212523	/nfs/dbraw/zinc/21/25/23/333212523.db2.gz	FQZRSYSZXOXJOO-UHFFFAOYSA-N	0	0	292.379	4.036	20	30		CIEDRN
Cc1ncsc1CCS[C@H](C)c1ccc(C#N)cc1	ZINC000190949289	333212524	/nfs/dbraw/zinc/21/25/24/333212524.db2.gz	AQDLSCQNAORBOD-GFCCVEGCSA-N	0	0	288.441	4.360	20	30		CIEDRN
N#Cc1ccc(CSc2ncccc2Cl)cc1F	ZINC000191006043	333213207	/nfs/dbraw/zinc/21/32/07/333213207.db2.gz	FXFGWLUWZLWHDB-UHFFFAOYSA-N	0	0	278.739	4.038	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(C(C)=O)c(Cl)c1	ZINC000191232110	333217039	/nfs/dbraw/zinc/21/70/39/333217039.db2.gz	AENOSWZFMIGFQM-HNNXBMFYSA-N	0	0	279.767	4.083	20	30		CIEDRN
C=CCC1(C(=O)N2CCC(c3ccccc3C)CC2)CCC1	ZINC000191398257	333219212	/nfs/dbraw/zinc/21/92/12/333219212.db2.gz	AKHVQXFNXJOBFD-UHFFFAOYSA-N	0	0	297.442	4.447	20	30		CIEDRN
N#Cc1ccc(N2CC3C[C@@H]4CC2C[C@H](C3)C4)cc1Cl	ZINC000521936232	333224244	/nfs/dbraw/zinc/22/42/44/333224244.db2.gz	XMLBUYRPGBGCFM-ZAQWFSBCSA-N	0	0	286.806	4.227	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N(C)[C@@H](CC)c1ccccc1OC	ZINC000521940249	333224511	/nfs/dbraw/zinc/22/45/11/333224511.db2.gz	CZELHTRTQVBLIG-YJBOKZPZSA-N	0	0	289.419	4.207	20	30		CIEDRN
C=CCN(C(=O)c1csc(Cl)c1)c1ccccc1	ZINC000191824261	333225791	/nfs/dbraw/zinc/22/57/91/333225791.db2.gz	ZEUGPHWCKWFYMX-UHFFFAOYSA-N	0	0	277.776	4.234	20	30		CIEDRN
C=CCC1(C(=O)N2CCC[C@@H](C(C)C)CC2)CCC1	ZINC000191832742	333226178	/nfs/dbraw/zinc/22/61/78/333226178.db2.gz	VGRYRDSYOOUYID-OAHLLOKOSA-N	0	0	263.425	4.018	20	30		CIEDRN
N#Cc1ccc(OCc2cccc(C(F)(F)F)c2)c(F)c1	ZINC000225239868	333234125	/nfs/dbraw/zinc/23/41/25/333234125.db2.gz	DYBKGPNQKQGVKF-UHFFFAOYSA-N	0	0	295.235	4.295	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)c2ccoc2Cl)c1	ZINC000192303461	333234179	/nfs/dbraw/zinc/23/41/79/333234179.db2.gz	KACOVYZAHRQLQY-UHFFFAOYSA-N	0	0	291.734	4.140	20	30		CIEDRN
N#Cc1ccc(CSCc2cc(-c3ccco3)on2)cc1	ZINC000193081035	333242314	/nfs/dbraw/zinc/24/23/14/333242314.db2.gz	CBLPBUNHVGAFJY-UHFFFAOYSA-N	0	0	296.351	4.240	20	30		CIEDRN
CCS[C@@H]1CCC[C@H]1Nc1cc(C#N)c2ccccc2n1	ZINC000226126340	333251011	/nfs/dbraw/zinc/25/10/11/333251011.db2.gz	XKIHXTMDJUTUKV-HZPDHXFCSA-N	0	0	297.427	4.193	20	30		CIEDRN
C=CCSc1ncc(C(F)(F)F)cc1Cl	ZINC000195536067	333255070	/nfs/dbraw/zinc/25/50/70/333255070.db2.gz	MOCCXTNBRRUTPT-UHFFFAOYSA-N	0	0	253.676	4.032	20	30		CIEDRN
N#Cc1ccccc1OCCSCc1ccccc1F	ZINC000195594902	333256588	/nfs/dbraw/zinc/25/65/88/333256588.db2.gz	FEKFSXZXFPSNTM-UHFFFAOYSA-N	0	0	287.359	4.010	20	30		CIEDRN
C[C@H]1CCCC[C@H]1OCCNc1ccc(C#N)c(Cl)c1	ZINC000195708351	333261259	/nfs/dbraw/zinc/26/12/59/333261259.db2.gz	UQPAJKIQIHJVJV-BLLLJJGKSA-N	0	0	292.810	4.219	20	30		CIEDRN
CC1(C)CCCC[C@H]1C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000194391446	333270361	/nfs/dbraw/zinc/27/03/61/333270361.db2.gz	BLPPINGQLQHYSN-DLBZAZTESA-N	0	0	298.430	4.364	20	30		CIEDRN
C[C@H](c1cccc(C#N)c1)N(C)C(=O)C[C@H]1CCCC[C@H]1C	ZINC000575917646	335130747	/nfs/dbraw/zinc/13/07/47/335130747.db2.gz	FQBPERPANPATLD-BFYDXBDKSA-N	0	0	298.430	4.294	20	30		CIEDRN
CC(=O)c1ccc(O[C@H](C)c2ccc(C#N)cc2)cc1F	ZINC000194644161	333274430	/nfs/dbraw/zinc/27/44/30/333274430.db2.gz	CUTSFBBOZYKEDY-GFCCVEGCSA-N	0	0	283.302	4.040	20	30		CIEDRN
N#CCN(C(=O)c1cc2ccccc2s1)c1ccccc1	ZINC000194664404	333275074	/nfs/dbraw/zinc/27/50/74/333275074.db2.gz	ZZPUCJZMBIJHHH-UHFFFAOYSA-N	0	0	292.363	4.072	20	30		CIEDRN
C[C@@H](Oc1ccc(C#N)c(Cl)c1)c1cccc(C#N)c1	ZINC000194706621	333275958	/nfs/dbraw/zinc/27/59/58/333275958.db2.gz	BBYDSWWSNZHTLF-LLVKDONJSA-N	0	0	282.730	4.223	20	30		CIEDRN
C=CCSCc1coc(-c2cccc(Cl)c2)n1	ZINC000522282978	333278848	/nfs/dbraw/zinc/27/88/48/333278848.db2.gz	KTARXRXKULPQKF-UHFFFAOYSA-N	0	0	265.765	4.414	20	30		CIEDRN
C[C@H](CCC1CCCCC1)Nc1ncccc1C#N	ZINC000522405837	333286537	/nfs/dbraw/zinc/28/65/37/333286537.db2.gz	HHMODIBOBBTHPT-CYBMUJFWSA-N	0	0	257.381	4.114	20	30		CIEDRN
C[C@@H]1C[C@H](c2ccccc2)CN1c1c(F)cc(C#N)cc1F	ZINC000522405281	333286581	/nfs/dbraw/zinc/28/65/81/333286581.db2.gz	ZNXUHMNBBUCUJH-DOMZBBRYSA-N	0	0	298.336	4.219	20	30		CIEDRN
C=CCCC(=O)N(Cc1ccc(C(F)(F)F)cc1)C1CC1	ZINC000522472212	333287665	/nfs/dbraw/zinc/28/76/65/333287665.db2.gz	GONVVNFORPLEIK-UHFFFAOYSA-N	0	0	297.320	4.163	20	30		CIEDRN
CC(C)[C@@H](CC1CCCC1)C(=O)NCc1cccc(C#N)c1	ZINC000522510351	333288676	/nfs/dbraw/zinc/28/86/76/333288676.db2.gz	QFTHTGKSWSOKIY-GOSISDBHSA-N	0	0	298.430	4.027	20	30		CIEDRN
Cc1cccc(N(C(=O)c2cccc(CC#N)c2)C(C)C)c1	ZINC000522576066	333290650	/nfs/dbraw/zinc/29/06/50/333290650.db2.gz	FFXOXJBSWRJJJF-UHFFFAOYSA-N	0	0	292.382	4.116	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@@H](c1ccc(Cl)cc1)C(C)C	ZINC000522576131	333290655	/nfs/dbraw/zinc/29/06/55/333290655.db2.gz	TVDLBWCESUOAPG-SWLSCSKDSA-N	0	0	294.826	4.301	20	30		CIEDRN
C=CC[C@H](C)NC(=O)C1(c2cccc(F)c2)CCCCC1	ZINC000522645347	333294624	/nfs/dbraw/zinc/29/46/24/333294624.db2.gz	PKJRFWBDFLNFHT-AWEZNQCLSA-N	0	0	289.394	4.108	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000522661796	333295492	/nfs/dbraw/zinc/29/54/92/333295492.db2.gz	OFCUGBZYISRNJI-QMMMGPOBSA-N	0	0	273.163	4.080	20	30		CIEDRN
N#Cc1cccc(NCC2(c3ccc(F)cc3)CCCC2)n1	ZINC000522935810	333300402	/nfs/dbraw/zinc/30/04/02/333300402.db2.gz	NEWZRJXRGRLAQQ-UHFFFAOYSA-N	0	0	295.361	4.016	20	30		CIEDRN
C=CCCCN(C)C(=O)[C@H](CC)CC1CCCCC1	ZINC000522947396	333300703	/nfs/dbraw/zinc/30/07/03/333300703.db2.gz	AQYHEFPYWGHXIO-MRXNPFEDSA-N	0	0	265.441	4.408	20	30		CIEDRN
N#Cc1cc(CNc2cccc3c2CCCC3)ccc1F	ZINC000229721323	333308608	/nfs/dbraw/zinc/30/86/08/333308608.db2.gz	LFRRFCZXQGCWPI-UHFFFAOYSA-N	0	0	280.346	4.188	20	30		CIEDRN
CCn1cc(N(CCCCC(C)(C)C#N)CC(C)C)cn1	ZINC000575932327	335132917	/nfs/dbraw/zinc/13/29/17/335132917.db2.gz	IMJFNQDZDUKAIK-UHFFFAOYSA-N	0	0	290.455	4.085	20	30		CIEDRN
N#Cc1ccc(F)cc1CSc1ccc(F)c(F)c1	ZINC000229949694	333312075	/nfs/dbraw/zinc/31/20/75/333312075.db2.gz	IEFPQHFEDVFKII-UHFFFAOYSA-N	0	0	279.286	4.268	20	30		CIEDRN
CC(C)N(Cc1ccccc1)Cc1cc(F)ccc1C#N	ZINC000229956830	333312095	/nfs/dbraw/zinc/31/20/95/333312095.db2.gz	VWGNFOYOZRESBR-UHFFFAOYSA-N	0	0	282.362	4.108	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000523229595	333313082	/nfs/dbraw/zinc/31/30/82/333313082.db2.gz	SOBKOBWKEYVFEC-UHFFFAOYSA-N	0	0	277.673	4.264	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(-c2nc3ccccc3o2)cc1	ZINC000523228079	333313147	/nfs/dbraw/zinc/31/31/47/333313147.db2.gz	FXRFANCCOJLBPT-UHFFFAOYSA-N	0	0	292.338	4.400	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000523286705	333314551	/nfs/dbraw/zinc/31/45/51/333314551.db2.gz	JFJZXNQSCSKJPV-UHFFFAOYSA-N	0	0	267.328	4.384	20	30		CIEDRN
N#CCCn1c2ccccc2nc1-c1c(F)cccc1Cl	ZINC000523388337	333325237	/nfs/dbraw/zinc/32/52/37/333325237.db2.gz	GTXGBJUVLBSJBC-UHFFFAOYSA-N	0	0	299.736	4.409	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)N[C@H](C)[C@@H](C)CC)c1	ZINC000523420935	333326154	/nfs/dbraw/zinc/32/61/54/333326154.db2.gz	IAVCALZIELWLTL-UONOGXRCSA-N	0	0	290.407	4.198	20	30		CIEDRN
Cc1cc(C#N)nc(Sc2cc(Cl)ccc2Cl)n1	ZINC000231936775	333332158	/nfs/dbraw/zinc/33/21/58/333332158.db2.gz	NQWJOOJSXREOSV-UHFFFAOYSA-N	0	0	296.182	4.115	20	30		CIEDRN
C=CCCS[C@@H](C)C(=O)Nc1cc(Cl)ccc1F	ZINC000523522099	333332207	/nfs/dbraw/zinc/33/22/07/333332207.db2.gz	VVFHRPSQGNZCOK-VIFPVBQESA-N	0	0	287.787	4.115	20	30		CIEDRN
C=CCNC(=O)N[C@@H](CC1CCCCC1)c1ccccc1	ZINC000523539349	333332442	/nfs/dbraw/zinc/33/24/42/333332442.db2.gz	VDTYDMXGSQGOFP-KRWDZBQOSA-N	0	0	286.419	4.183	20	30		CIEDRN
CC(=O)c1cc(F)ccc1OCCCCC(C)(C)C#N	ZINC000232465417	333336983	/nfs/dbraw/zinc/33/69/83/333336983.db2.gz	HKNHTDGOFAQFDJ-UHFFFAOYSA-N	0	0	277.339	4.127	20	30		CIEDRN
C=CCN(CC=C)C(=O)NC1CCC(CCCC)CC1	ZINC000303050914	333337195	/nfs/dbraw/zinc/33/71/95/333337195.db2.gz	VEDIYBVZJZICNA-UHFFFAOYSA-N	0	0	278.440	4.119	20	30		CIEDRN
CC(C)(C#N)CCCC[S@@](=O)c1ccc2c(c1)CCC2	ZINC000232526316	333337960	/nfs/dbraw/zinc/33/79/60/333337960.db2.gz	ZUGVHBZPYPPLAG-HXUWFJFHSA-N	0	0	289.444	4.003	20	30		CIEDRN
C=CCCC(=O)NCC1(c2ccc(C(C)(C)C)cc2)CCC1	ZINC000303139960	333337969	/nfs/dbraw/zinc/33/79/69/333337969.db2.gz	LUUKQBMOVWRDTC-UHFFFAOYSA-N	0	0	299.458	4.488	20	30		CIEDRN
CC(C)(C#N)CCCCn1cc(-c2ccccc2)cn1	ZINC000232528740	333338139	/nfs/dbraw/zinc/33/81/39/333338139.db2.gz	BMPIXGOTFKOJDH-UHFFFAOYSA-N	0	0	267.376	4.270	20	30		CIEDRN
CC(=O)c1ccc(OCCCCC(C)(C)C#N)cc1F	ZINC000232566639	333338789	/nfs/dbraw/zinc/33/87/89/333338789.db2.gz	KVHZADLTHXCDOY-UHFFFAOYSA-N	0	0	277.339	4.127	20	30		CIEDRN
CC[C@H](CC(=O)Nc1ccc(Cl)c(C#N)c1)C(C)C	ZINC000303273836	333339573	/nfs/dbraw/zinc/33/95/73/333339573.db2.gz	KJZMTIBQABOUDT-LLVKDONJSA-N	0	0	278.783	4.222	20	30		CIEDRN
COc1c(C)ccc(N[C@H](C#N)C2CCCCC2)c1C	ZINC000523740540	333343000	/nfs/dbraw/zinc/34/30/00/333343000.db2.gz	RHKYUFCRKVZLOS-MRXNPFEDSA-N	0	0	272.392	4.196	20	30		CIEDRN
CC1(C)CCC(c2noc(-c3cccc(C#N)c3)n2)CC1	ZINC000232838110	333344162	/nfs/dbraw/zinc/34/41/62/333344162.db2.gz	NPLJJEXLIQIHBD-UHFFFAOYSA-N	0	0	281.359	4.292	20	30		CIEDRN
C=CCCCN(C)C(=O)c1cc(CC)c(CCC)s1	ZINC000303833253	333347031	/nfs/dbraw/zinc/34/70/31/333347031.db2.gz	KVKQXIRJYAALSM-UHFFFAOYSA-N	0	0	279.449	4.301	20	30		CIEDRN
C=C(C)CN(CC)C(=O)[C@@H](C)Sc1cccc(Cl)c1	ZINC000523869757	333348790	/nfs/dbraw/zinc/34/87/90/333348790.db2.gz	DLHLKYWPBMPEJE-GFCCVEGCSA-N	0	0	297.851	4.245	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N(CCC)[C@@H]1CCc2ccccc21	ZINC000523948912	333349857	/nfs/dbraw/zinc/34/98/57/333349857.db2.gz	CJBIODUOGJKFSB-WMLDXEAASA-N	0	0	286.419	4.060	20	30		CIEDRN
C=CC[C@H](C)NC(=O)c1ccccc1Oc1ccccc1	ZINC000523966460	333350277	/nfs/dbraw/zinc/35/02/77/333350277.db2.gz	VZVCGVTTWQHCBG-AWEZNQCLSA-N	0	0	281.355	4.173	20	30		CIEDRN
CC(C)c1ccc(C(=O)N[C@@]2(C#N)CCC[C@H](C)C2)cc1	ZINC000523969540	333350375	/nfs/dbraw/zinc/35/03/75/333350375.db2.gz	UTJRFJOQKPXTGA-KSSFIOAISA-N	0	0	284.403	4.012	20	30		CIEDRN
CCCOc1ccc(Nc2nccc(C#N)c2Cl)cc1	ZINC000233250229	333350520	/nfs/dbraw/zinc/35/05/20/333350520.db2.gz	KEDSQGJQGXYBRO-UHFFFAOYSA-N	0	0	287.750	4.139	20	30		CIEDRN
C=CCCCSc1nc(C2CC2)nn1-c1ccccc1	ZINC000524222121	333356611	/nfs/dbraw/zinc/35/66/11/333356611.db2.gz	FFUFGUIESOXPTG-UHFFFAOYSA-N	0	0	285.416	4.203	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)Cc1cccc(Cl)c1	ZINC000524244375	333357679	/nfs/dbraw/zinc/35/76/79/333357679.db2.gz	XHCGQRTXHRIMRH-UHFFFAOYSA-N	0	0	299.801	4.097	20	30		CIEDRN
C=CCN(C(=O)Cc1cc(C)ccc1C)c1ccccc1	ZINC000524422594	333361793	/nfs/dbraw/zinc/36/17/93/333361793.db2.gz	WSVBGLQDRVXIQX-UHFFFAOYSA-N	0	0	279.383	4.065	20	30		CIEDRN
COc1cc(CNc2ccc(C)c(Cl)c2)ccc1C#N	ZINC000234902924	333362947	/nfs/dbraw/zinc/36/29/47/333362947.db2.gz	RGIHVFQMUXVZEX-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
C=CCN(CC=C)C(=O)N[C@@H](CCC)C1CCCCC1	ZINC000524530697	333364922	/nfs/dbraw/zinc/36/49/22/333364922.db2.gz	AEMACEHPKVBRNU-INIZCTEOSA-N	0	0	278.440	4.119	20	30		CIEDRN
Cc1ccc(C[C@H](C)Nc2nccc(C#N)c2Cl)s1	ZINC000235185694	333366296	/nfs/dbraw/zinc/36/62/96/333366296.db2.gz	LNJOZDUXZBKJNI-VIFPVBQESA-N	0	0	291.807	4.020	20	30		CIEDRN
Cc1ccc(C)c([C@@H](C)[N@H+](C)Cc2ccccc2C#N)c1	ZINC000524594232	333367770	/nfs/dbraw/zinc/36/77/70/333367770.db2.gz	IRTJXADGRGETQY-MRXNPFEDSA-N	0	0	278.399	4.368	20	30		CIEDRN
Cc1ccc(C)c([S@@](=O)CCCCC(C)(C)C#N)c1	ZINC000235773591	333372017	/nfs/dbraw/zinc/37/20/17/333372017.db2.gz	ODIDTQIPRZTPHY-IBGZPJMESA-N	0	0	277.433	4.131	20	30		CIEDRN
Cc1cc(C)c(C)c(Oc2nccc(C#N)c2Cl)c1	ZINC000235816872	333372145	/nfs/dbraw/zinc/37/21/45/333372145.db2.gz	ZNJWRGAUEFRNBS-UHFFFAOYSA-N	0	0	272.735	4.324	20	30		CIEDRN
Cc1ccc(Cl)cc1Oc1nccc(C#N)c1Cl	ZINC000235777842	333372159	/nfs/dbraw/zinc/37/21/59/333372159.db2.gz	HSEUMZIXDHCPPY-UHFFFAOYSA-N	0	0	279.126	4.361	20	30		CIEDRN
Cc1cccc(CN(C)c2cc(C#N)c3ccccc3n2)c1	ZINC000315996083	333384769	/nfs/dbraw/zinc/38/47/69/333384769.db2.gz	PYHMLQNPWOVNSI-UHFFFAOYSA-N	0	0	287.366	4.051	20	30		CIEDRN
C=CCCC(=O)Nc1nc2ccccc2n1C1CCCC1	ZINC000524841434	333390070	/nfs/dbraw/zinc/39/00/70/333390070.db2.gz	XANAZJYNAOFWBA-UHFFFAOYSA-N	0	0	283.375	4.056	20	30		CIEDRN
Cc1ccc(C)c(Sc2c(C#N)nnc3ccccc32)c1	ZINC000524841574	333390086	/nfs/dbraw/zinc/39/00/86/333390086.db2.gz	BCEBOLSLZFOWCK-UHFFFAOYSA-N	0	0	291.379	4.270	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Cc1c[nH]c2c1cccc2C	ZINC000524959848	333394143	/nfs/dbraw/zinc/39/41/43/333394143.db2.gz	JNYZHKXFMCVRDT-UHFFFAOYSA-N	0	0	298.430	4.224	20	30		CIEDRN
N#Cc1ccc(SCc2ccccc2F)c(F)c1	ZINC000524987583	333394998	/nfs/dbraw/zinc/39/49/98/333394998.db2.gz	NZBRVVWODBYAAD-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
COc1ccc(C)cc1CSc1ccc(C#N)cc1F	ZINC000524987958	333395004	/nfs/dbraw/zinc/39/50/04/333395004.db2.gz	AZMNMPIXGNIKRA-UHFFFAOYSA-N	0	0	287.359	4.307	20	30		CIEDRN
C=CC1CCN(C(=O)[C@@H](CC(C)C)c2ccccc2)CC1	ZINC000525336122	333409485	/nfs/dbraw/zinc/40/94/85/333409485.db2.gz	NDXOVHUZQVCQOE-SFHVURJKSA-N	0	0	285.431	4.241	20	30		CIEDRN
C=CCCNc1cc(C(F)(F)F)ccc1N1CCCC1	ZINC000525366170	333410540	/nfs/dbraw/zinc/41/05/40/333410540.db2.gz	ZVWXPVZLHAYWMQ-UHFFFAOYSA-N	0	0	284.325	4.294	20	30		CIEDRN
CC(C)(C)CCCNC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000526005636	333418573	/nfs/dbraw/zinc/41/85/73/333418573.db2.gz	AIJOAZCZHPOULT-MRXNPFEDSA-N	0	0	286.419	4.016	20	30		CIEDRN
C=CCN(CC=C)C(=O)C1CCC(CCCC)CC1	ZINC000075244807	333422898	/nfs/dbraw/zinc/42/28/98/333422898.db2.gz	PQPHILYHYSRBSP-UHFFFAOYSA-N	0	0	263.425	4.184	20	30		CIEDRN
C=CCN(C(=O)N[C@H](c1ccccc1C)C(C)C)C1CC1	ZINC000537912682	333429808	/nfs/dbraw/zinc/42/98/08/333429808.db2.gz	XACJLHMWIMNRCO-KRWDZBQOSA-N	0	0	286.419	4.052	20	30		CIEDRN
CC(C)CCNc1ccc(C#N)cc1C(F)(F)F	ZINC000036973636	333445671	/nfs/dbraw/zinc/44/56/71/333445671.db2.gz	GCVHEMUGXDUBCT-UHFFFAOYSA-N	0	0	256.271	4.035	20	30		CIEDRN
Cc1ccsc1CNc1ccc(Cl)c(C#N)c1	ZINC000036972987	333445677	/nfs/dbraw/zinc/44/56/77/333445677.db2.gz	SVAZOFUEJWKTMC-UHFFFAOYSA-N	0	0	262.765	4.194	20	30		CIEDRN
CCCc1ccccc1NCc1cccc(C#N)c1	ZINC000036974351	333447807	/nfs/dbraw/zinc/44/78/07/333447807.db2.gz	UAHPOWDSIHWIMZ-UHFFFAOYSA-N	0	0	250.345	4.123	20	30		CIEDRN
CCC(C#N)(CC)C(=O)N1C[C@H](c2ccccc2C)C[C@H]1C	ZINC000528613646	333449375	/nfs/dbraw/zinc/44/93/75/333449375.db2.gz	USISKXKIOYUSOH-HZPDHXFCSA-N	0	0	298.430	4.029	20	30		CIEDRN
CCC(C#N)(CC)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000529118540	333472772	/nfs/dbraw/zinc/47/27/72/333472772.db2.gz	GNJCTIMBHNFDKE-UHFFFAOYSA-N	0	0	280.318	4.067	20	30		CIEDRN
Cc1ccccc1OCCCSCCC(C)(C)C#N	ZINC000576022068	335142658	/nfs/dbraw/zinc/14/26/58/335142658.db2.gz	SCALVJAFKCBBSJ-UHFFFAOYSA-N	0	0	277.433	4.437	20	30		CIEDRN
CCC(C#N)(CC)C(=O)N1C[C@@H](c2ccc(C)cc2)C[C@H]1C	ZINC000529203735	333477023	/nfs/dbraw/zinc/47/70/23/333477023.db2.gz	TZNUUXJMSDYGFT-WBVHZDCISA-N	0	0	298.430	4.029	20	30		CIEDRN
CCC(C#N)(CC)C(=O)NC[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000529440687	333487217	/nfs/dbraw/zinc/48/72/17/333487217.db2.gz	DOXJJCJKYDXVDO-DLBZAZTESA-N	0	0	298.430	4.016	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cc(OC)c(O)c2ccccc12	ZINC000529549510	333496698	/nfs/dbraw/zinc/49/66/98/333496698.db2.gz	YPJYMGCHTNLXOD-GOSISDBHSA-N	0	0	299.370	4.095	20	30		CIEDRN
N#Cc1cccc(OCCSc2ccc(F)c(F)c2)c1	ZINC000037143755	333500853	/nfs/dbraw/zinc/50/08/53/333500853.db2.gz	JRQHLVSQWLFSBA-UHFFFAOYSA-N	0	0	291.322	4.008	20	30		CIEDRN
C=CCOc1ccccc1CNc1ccc2c(c1)CCC2	ZINC000037200531	333512860	/nfs/dbraw/zinc/51/28/60/333512860.db2.gz	BFZJXHVFIHTLNA-UHFFFAOYSA-N	0	0	279.383	4.352	20	30		CIEDRN
C=CCOc1ccccc1CNc1ccc(F)c(F)c1	ZINC000037201624	333512967	/nfs/dbraw/zinc/51/29/67/333512967.db2.gz	CYNNBTVHJYGYFK-UHFFFAOYSA-N	0	0	275.298	4.142	20	30		CIEDRN
N#CC1(CC(=O)Nc2ccc3occc3c2)CCCCC1	ZINC000530002354	333517121	/nfs/dbraw/zinc/51/71/21/333517121.db2.gz	CPILGLWBQHGUQJ-UHFFFAOYSA-N	0	0	282.343	4.235	20	30		CIEDRN
CC1(C)COc2cc(NCc3ccc(CC#N)cc3)ccc21	ZINC000530117198	333523672	/nfs/dbraw/zinc/52/36/72/333523672.db2.gz	VYXGSTMFOLUOJG-UHFFFAOYSA-N	0	0	292.382	4.035	20	30		CIEDRN
C[C@@H]1C[C@H](C)CN(c2ccc(C#N)c(C(F)(F)F)c2)C1	ZINC000037306401	333531846	/nfs/dbraw/zinc/53/18/46/333531846.db2.gz	OOHYGRHZSZVZSZ-PHIMTYICSA-N	0	0	282.309	4.059	20	30		CIEDRN
C=CCOc1ccccc1CN[C@@H](C)c1ccccc1F	ZINC000037493837	333533787	/nfs/dbraw/zinc/53/37/87/333533787.db2.gz	IZRGJDNGDJWJEB-AWEZNQCLSA-N	0	0	285.362	4.241	20	30		CIEDRN
C[C@@H](N[C@@H](C)c1cccc(C#N)c1)c1c(F)cccc1F	ZINC000037771858	333538721	/nfs/dbraw/zinc/53/87/21/333538721.db2.gz	IRVLLZWORMNPQU-NWDGAFQWSA-N	0	0	286.325	4.248	20	30		CIEDRN
C=CCOc1cccc(NC(=O)N2[C@H](CC)CC[C@@H]2C)c1	ZINC000537928834	333547683	/nfs/dbraw/zinc/54/76/83/333547683.db2.gz	IBGSHTFSBUJLRB-DZGCQCFKSA-N	0	0	288.391	4.046	20	30		CIEDRN
C=C(CC)CS[C@@H](C)C(=O)Nc1cccc(C)c1C	ZINC000537993654	333569916	/nfs/dbraw/zinc/56/99/16/333569916.db2.gz	PMMLDCXZXLENSQ-AWEZNQCLSA-N	0	0	277.433	4.330	20	30		CIEDRN
C=C(CC)CNc1cc(NC(=O)C(C)(C)C)ccc1C	ZINC000537996047	333569929	/nfs/dbraw/zinc/56/99/29/333569929.db2.gz	VPLNYNDNEZLWSX-UHFFFAOYSA-N	0	0	274.408	4.358	20	30		CIEDRN
C=CCn1c(SCC(=C)CC)nnc1-c1ccccc1	ZINC000538013642	333571032	/nfs/dbraw/zinc/57/10/32/333571032.db2.gz	CFSSPEIKQDDDQO-UHFFFAOYSA-N	0	0	285.416	4.189	20	30		CIEDRN
C=C(CC)CSc1nnc(C)n1[C@@H]1CCC[C@@H](C)C1	ZINC000538012184	333571104	/nfs/dbraw/zinc/57/11/04/333571104.db2.gz	NAUVSQXOKPMOSK-TZMCWYRMSA-N	0	0	279.453	4.396	20	30		CIEDRN
C=CCCC[C@H](C)Sc1nnc(-c2ccccc2)n1C	ZINC000538170795	333577690	/nfs/dbraw/zinc/57/76/90/333577690.db2.gz	JYJNESZWXUVRMP-ZDUSSCGKSA-N	0	0	287.432	4.319	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N[C@H](C)c1cccc(F)c1F	ZINC000538287860	333583153	/nfs/dbraw/zinc/58/31/53/333583153.db2.gz	SGCFLJLFUCCDBV-NWDGAFQWSA-N	0	0	296.361	4.070	20	30		CIEDRN
C=CCCOCCCCC(=O)N[C@@H]1CCCC[C@@H]1C(C)C	ZINC000538295002	333583660	/nfs/dbraw/zinc/58/36/60/333583660.db2.gz	ZUDKYMDYKBQIEV-IAGOWNOFSA-N	0	0	295.467	4.080	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N(CC)C1CCCCC1	ZINC000538362609	333587155	/nfs/dbraw/zinc/58/71/55/333587155.db2.gz	RZBUAGQORCAFSK-CQSZACIVSA-N	0	0	266.429	4.095	20	30		CIEDRN
N#CC1(CS[C@H]2CCc3c2cccc3Cl)CC1	ZINC000538418562	333591209	/nfs/dbraw/zinc/59/12/09/333591209.db2.gz	LHQZRYTWDKYXMI-ZDUSSCGKSA-N	0	0	263.793	4.364	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)[C@@H]2CC[C@H](C)C2)c1	ZINC000538442187	333592659	/nfs/dbraw/zinc/59/26/59/333592659.db2.gz	GONYTXOITVEJTC-UONOGXRCSA-N	0	0	273.376	4.016	20	30		CIEDRN
Cc1cc(Cl)cc(C(=O)Nc2cc(C#N)ccc2C)c1	ZINC000126917858	333613851	/nfs/dbraw/zinc/61/38/51/333613851.db2.gz	KFSXCCOBJNFQKL-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1ccc(OC)cc1C)c1ccccc1	ZINC000126993784	333615023	/nfs/dbraw/zinc/61/50/23/333615023.db2.gz	SMBQCSUVEMCIGR-OAHLLOKOSA-N	0	0	295.382	4.302	20	30		CIEDRN
C=C[C@@H](C)NC(=O)c1cc(SC)c(Cl)cc1Cl	ZINC000127307457	333626088	/nfs/dbraw/zinc/62/60/88/333626088.db2.gz	OAQBRXKLJUGNPE-SSDOTTSWSA-N	0	0	290.215	4.020	20	30		CIEDRN
CC[C@H](C#N)Sc1nc2cc(Cl)cc(C)c2o1	ZINC000127742555	333635054	/nfs/dbraw/zinc/63/50/54/333635054.db2.gz	AXQSQWIZNMZYEM-SECBINFHSA-N	0	0	266.753	4.184	20	30		CIEDRN
C=C(CC)CS[C@@H](C)C(=O)Nc1cccc(SC)c1	ZINC000539094604	333657734	/nfs/dbraw/zinc/65/77/34/333657734.db2.gz	XAKNTQZQDBXBJD-LBPRGKRZSA-N	0	0	295.473	4.435	20	30		CIEDRN
C=C(CC)CNc1ccccc1NC(=O)C[C@H]1C=CCC1	ZINC000539095607	333657835	/nfs/dbraw/zinc/65/78/35/333657835.db2.gz	FVLZIOHVVZREJI-HNNXBMFYSA-N	0	0	284.403	4.360	20	30		CIEDRN
C=C(CC)CSc1nnc(SCCCC)s1	ZINC000539113215	333659007	/nfs/dbraw/zinc/65/90/07/333659007.db2.gz	YSYVENQBYSHPCH-UHFFFAOYSA-N	0	0	274.480	4.489	20	30		CIEDRN
C=C(CC)CSc1nnc(-c2ccccc2OCC)o1	ZINC000539112110	333659089	/nfs/dbraw/zinc/65/90/89/333659089.db2.gz	BBMMUYWXJJXWHJ-UHFFFAOYSA-N	0	0	290.388	4.194	20	30		CIEDRN
C=CCCOCCCCC(=O)N1CCC[C@@H]1C(C)(C)CC	ZINC000539383747	333668512	/nfs/dbraw/zinc/66/85/12/333668512.db2.gz	XTSYMYGFBCSHHB-MRXNPFEDSA-N	0	0	295.467	4.177	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N1CCc2ccccc2[C@@H]1C	ZINC000539388143	333668567	/nfs/dbraw/zinc/66/85/67/333668567.db2.gz	PQZJFMPOKIGSSH-GJZGRUSLSA-N	0	0	286.419	4.060	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N1C[C@@H](C)[C@@H]1c1ccccc1	ZINC000539391084	333668687	/nfs/dbraw/zinc/66/86/87/333668687.db2.gz	YUODNGISHCQTJB-HLLBOEOZSA-N	0	0	286.419	4.134	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)CCc1cc2ccccc2o1	ZINC000539435540	333671239	/nfs/dbraw/zinc/67/12/39/333671239.db2.gz	FVXCXGCCJQQFFZ-CQSZACIVSA-N	0	0	285.387	4.226	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)CCc1cc2ccccc2o1	ZINC000539435538	333671261	/nfs/dbraw/zinc/67/12/61/333671261.db2.gz	FVXCXGCCJQQFFZ-AWEZNQCLSA-N	0	0	285.387	4.226	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)NCc1ccc(-c2ccccc2)o1	ZINC000539739009	333688504	/nfs/dbraw/zinc/68/85/04/333688504.db2.gz	OSCVUHPNLYUPQI-OAHLLOKOSA-N	0	0	298.386	4.101	20	30		CIEDRN
CC(C)(C#N)CCOc1ccc(C(=O)c2ccccc2)cc1	ZINC000539740539	333688872	/nfs/dbraw/zinc/68/88/72/333688872.db2.gz	CFCTUFCEVXALLK-UHFFFAOYSA-N	0	0	293.366	4.236	20	30		CIEDRN
C=CCCSc1nnc(-c2ccc(Cl)cc2)o1	ZINC000128613822	333691279	/nfs/dbraw/zinc/69/12/79/333691279.db2.gz	NUNLTCKAHSNFNQ-UHFFFAOYSA-N	0	0	266.753	4.058	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(Cc2cccc(C)c2)no1	ZINC000564222433	333691293	/nfs/dbraw/zinc/69/12/93/333691293.db2.gz	ZBGXMCQFYGBUOC-CYBMUJFWSA-N	0	0	256.349	4.039	20	30		CIEDRN
CCC[C@@H](C#N)NC(=O)[C@H](CC1CCCCC1)C(C)C	ZINC000539929290	333703304	/nfs/dbraw/zinc/70/33/04/333703304.db2.gz	UHCUIVUYWRNSBU-JKSUJKDBSA-N	0	0	278.440	4.037	20	30		CIEDRN
CCC[C@@H](C#N)NC(=O)C1(c2cccc(C)c2)CCCCC1	ZINC000539927698	333703319	/nfs/dbraw/zinc/70/33/19/333703319.db2.gz	RGEUAXFIPWFFPM-KRWDZBQOSA-N	0	0	298.430	4.005	20	30		CIEDRN
C=C(CC)CNc1ccccc1NC(=O)c1cccs1	ZINC000540193874	333720245	/nfs/dbraw/zinc/72/02/45/333720245.db2.gz	JHMDBUCZDOSPTN-UHFFFAOYSA-N	0	0	286.400	4.379	20	30		CIEDRN
C=C(CC)CNc1ccccc1C(=O)N(CCC)C(C)C	ZINC000540195138	333720269	/nfs/dbraw/zinc/72/02/69/333720269.db2.gz	QAACVRMADXZTAB-UHFFFAOYSA-N	0	0	288.435	4.325	20	30		CIEDRN
C=C(CC)CS[C@@H](C)C(=O)Nc1ccccc1C	ZINC000540193966	333720315	/nfs/dbraw/zinc/72/03/15/333720315.db2.gz	FXKAJJBHKPOXFI-ZDUSSCGKSA-N	0	0	263.406	4.021	20	30		CIEDRN
C=C(CC)CSc1nnc(-c2c[nH]c3ccccc32)o1	ZINC000540215974	333721543	/nfs/dbraw/zinc/72/15/43/333721543.db2.gz	MMMJSCMGALVXEI-UHFFFAOYSA-N	0	0	285.372	4.276	20	30		CIEDRN
N#Cc1cccc(CSCc2ccccc2F)c1F	ZINC000540344983	333726270	/nfs/dbraw/zinc/72/62/70/333726270.db2.gz	AJIIQLRLZHVHBG-UHFFFAOYSA-N	0	0	275.323	4.270	20	30		CIEDRN
CSc1cccc(NC(=O)Nc2cccc(C#N)c2)c1C	ZINC000540340667	333726425	/nfs/dbraw/zinc/72/64/25/333726425.db2.gz	PWINULZDDRHFLU-UHFFFAOYSA-N	0	0	297.383	4.233	20	30		CIEDRN
N#Cc1ccc(Sc2ncncc2-c2ccccc2)cc1	ZINC000540349430	333726538	/nfs/dbraw/zinc/72/65/38/333726538.db2.gz	OYOOSWYCRGAXAI-UHFFFAOYSA-N	0	0	289.363	4.166	20	30		CIEDRN
CSc1cccc(NC(=O)c2ccc(CC#N)cc2)c1C	ZINC000540446229	333730431	/nfs/dbraw/zinc/73/04/31/333730431.db2.gz	QICXDBCAPABZSA-UHFFFAOYSA-N	0	0	296.395	4.035	20	30		CIEDRN
C=CCC[C@@H](NCc1ncc(CC)o1)c1ccccc1	ZINC000540456490	333730758	/nfs/dbraw/zinc/73/07/58/333730758.db2.gz	UZWBNRFEENBISA-MRXNPFEDSA-N	0	0	270.376	4.034	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@@]1(C)CCc2ccccc2C1	ZINC000540526484	333733958	/nfs/dbraw/zinc/73/39/58/333733958.db2.gz	MUDGANONCYFHKU-KXBFYZLASA-N	0	0	285.431	4.043	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)CCCc1ccc(C)s1	ZINC000540524924	333733964	/nfs/dbraw/zinc/73/39/64/333733964.db2.gz	CYPKYTOMKNIBDG-CYBMUJFWSA-N	0	0	279.449	4.240	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1ccc(Cl)cc1C	ZINC000540532524	333734131	/nfs/dbraw/zinc/73/41/31/333734131.db2.gz	QLDDVAVPYBCSGQ-GFCCVEGCSA-N	0	0	265.784	4.123	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)CCSc1ccccc1F	ZINC000540532840	333734266	/nfs/dbraw/zinc/73/42/66/333734266.db2.gz	SJIXGFGEHQPGKN-CYBMUJFWSA-N	0	0	295.423	4.169	20	30		CIEDRN
C[C@H](NCC1(C#N)CC1)c1ccccc1Oc1ccccc1	ZINC000540591197	333736350	/nfs/dbraw/zinc/73/63/50/333736350.db2.gz	FXKUDNMWGYFRHB-HNNXBMFYSA-N	0	0	292.382	4.433	20	30		CIEDRN
C[C@@H](NCC1(C#N)CC1)c1ccccc1Oc1ccccc1	ZINC000540591198	333736379	/nfs/dbraw/zinc/73/63/79/333736379.db2.gz	FXKUDNMWGYFRHB-OAHLLOKOSA-N	0	0	292.382	4.433	20	30		CIEDRN
CC(=O)c1c(C)cc(C)c(CSCC2(C#N)CC2)c1C	ZINC000540618408	333738608	/nfs/dbraw/zinc/73/86/08/333738608.db2.gz	OUORKBBXOVJWSS-UHFFFAOYSA-N	0	0	287.428	4.351	20	30		CIEDRN
N#CC1(CSCCCOc2cccc(Cl)c2)CC1	ZINC000540619347	333738609	/nfs/dbraw/zinc/73/86/09/333738609.db2.gz	YJUCNVTVSVYTHM-UHFFFAOYSA-N	0	0	281.808	4.146	20	30		CIEDRN
CCN(C(=O)[C@@H]1CC[C@@H](C)C1)c1ccc(C#N)c(Cl)c1	ZINC000540658325	333740666	/nfs/dbraw/zinc/74/06/66/333740666.db2.gz	RFBXKHCIKZBPSZ-VXGBXAGGSA-N	0	0	290.794	4.001	20	30		CIEDRN
CC(C)C[C@@H]1C[C@@H](Nc2cc(Cl)ccc2C#N)CCO1	ZINC000540709116	333743009	/nfs/dbraw/zinc/74/30/09/333743009.db2.gz	KSHBMWXWGUXZQD-LSDHHAIUSA-N	0	0	292.810	4.217	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N[C@H](C)c1cc(C)sc1C	ZINC000540768539	333746337	/nfs/dbraw/zinc/74/63/37/333746337.db2.gz	PNMCWBHGFOYIJL-DGCLKSJQSA-N	0	0	280.437	4.080	20	30		CIEDRN
COc1ccc(C#N)cc1CNc1cc(Cl)ccc1C	ZINC000129245429	333753979	/nfs/dbraw/zinc/75/39/79/333753979.db2.gz	BXCDOIXMROTSRN-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
C=C(C)COc1cccc(NCc2ccc(C#N)s2)c1	ZINC000129267725	333754394	/nfs/dbraw/zinc/75/43/94/333754394.db2.gz	VGVSJTCJPCZPTI-UHFFFAOYSA-N	0	0	284.384	4.187	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(C(F)(F)c2ccc(F)cc2)no1	ZINC000564242226	333765147	/nfs/dbraw/zinc/76/51/47/333765147.db2.gz	DPFGYSUALSQMBB-JTQLQIEISA-N	0	0	296.292	4.419	20	30		CIEDRN
C=C[C@H](CC(=O)N1CC[C@H](C(C)(C)C)C1)c1ccccc1	ZINC000541318529	333771708	/nfs/dbraw/zinc/77/17/08/333771708.db2.gz	BNZUMTZZBDDHAF-WBVHZDCISA-N	0	0	285.431	4.241	20	30		CIEDRN
CC(=O)c1ccc(C#N)cc1N(C)C[C@H](C)c1ccccc1	ZINC000541577397	333781602	/nfs/dbraw/zinc/78/16/02/333781602.db2.gz	UZJLOIPZZUCHTP-AWEZNQCLSA-N	0	0	292.382	4.001	20	30		CIEDRN
C=CCNC(=O)c1cc(Cl)ccc1SCCCC	ZINC000541702711	333787495	/nfs/dbraw/zinc/78/74/95/333787495.db2.gz	JZPMLRNIFXKWEP-UHFFFAOYSA-N	0	0	283.824	4.148	20	30		CIEDRN
N#Cc1cccc(-c2nc3c(cccc3F)n2C2CC2)c1	ZINC000069836286	333793692	/nfs/dbraw/zinc/79/36/92/333793692.db2.gz	HFCOAFQXAWRZRC-UHFFFAOYSA-N	0	0	277.302	4.049	20	30		CIEDRN
C=CCCC(=O)N1CCCCC[C@@H]1/C=C/c1cccs1	ZINC000542181612	333813810	/nfs/dbraw/zinc/81/38/10/333813810.db2.gz	QEQOKKRSMGLLEO-AYJWMTRPSA-N	0	0	289.444	4.499	20	30		CIEDRN
Cc1c(Cl)cnc(N2[C@H](C)C[C@H]3CCCC[C@@H]32)c1C#N	ZINC000542205918	333815542	/nfs/dbraw/zinc/81/55/42/333815542.db2.gz	BITWTPONDLRXIS-HCKVZZMMSA-N	0	0	289.810	4.073	20	30		CIEDRN
C=C[C@H](CC(=O)N1CC[C@]2(CC[C@H](C)C2)C1)c1ccccc1	ZINC000542871098	333846592	/nfs/dbraw/zinc/84/65/92/333846592.db2.gz	SUKHBJNQXHFTET-QKLQHJQFSA-N	0	0	297.442	4.385	20	30		CIEDRN
Cc1ccc(C(=O)Nc2ccc(C#N)cc2)c(Cl)c1C	ZINC000543041292	333853604	/nfs/dbraw/zinc/85/36/04/333853604.db2.gz	NPEXHHQNQHCADX-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
C=CCC[C@@H](C)Nc1ccc(NC(=O)C(C)C)cc1	ZINC000130594148	333855750	/nfs/dbraw/zinc/85/57/50/333855750.db2.gz	MVTHVDQRDIPCOB-CYBMUJFWSA-N	0	0	260.381	4.048	20	30		CIEDRN
CCS[C@@H]1CCC[C@@H]1Nc1ncc(Cl)c(C)c1C#N	ZINC000543137149	333859882	/nfs/dbraw/zinc/85/98/82/333859882.db2.gz	PJZNTMMAWYCHSK-QWHCGFSZSA-N	0	0	295.839	4.001	20	30		CIEDRN
CCS[C@H]1CCC[C@@H]1Nc1ncc(Cl)c(C)c1C#N	ZINC000543137150	333859974	/nfs/dbraw/zinc/85/99/74/333859974.db2.gz	PJZNTMMAWYCHSK-STQMWFEESA-N	0	0	295.839	4.001	20	30		CIEDRN
N#CCc1ccc(CSCc2cc(F)ccc2F)cc1	ZINC000544081244	333914975	/nfs/dbraw/zinc/91/49/75/333914975.db2.gz	IIOCVXNENQIRKF-UHFFFAOYSA-N	0	0	289.350	4.464	20	30		CIEDRN
CCCOc1cc(C)ccc1NCc1cccc(C#N)c1F	ZINC000544099620	333916193	/nfs/dbraw/zinc/91/61/93/333916193.db2.gz	UHWCXMWHQZNPFN-UHFFFAOYSA-N	0	0	298.361	4.407	20	30		CIEDRN
Cc1ccnc(N(C)[C@@H](C)c2cc3ccccc3o2)c1C#N	ZINC000544145255	333918861	/nfs/dbraw/zinc/91/88/61/333918861.db2.gz	IVIAHMXJJPNYEY-ZDUSSCGKSA-N	0	0	291.354	4.205	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N[C@@H](C)c1c(C)cccc1C	ZINC000544435185	333931296	/nfs/dbraw/zinc/93/12/96/333931296.db2.gz	LCYCDIYENYHALI-LSDHHAIUSA-N	0	0	274.408	4.018	20	30		CIEDRN
CCC(CC)c1noc(-c2ccc(C3(C#N)CC3)cc2)n1	ZINC000544532648	333934721	/nfs/dbraw/zinc/93/47/21/333934721.db2.gz	NZSIDCOBYYVWBX-UHFFFAOYSA-N	0	0	281.359	4.195	20	30		CIEDRN
C=CCCCCNC(=O)N[C@H](C)c1ccc(SC)cc1	ZINC000544604659	333939501	/nfs/dbraw/zinc/93/95/01/333939501.db2.gz	HIVIRRQDYPFXNZ-CYBMUJFWSA-N	0	0	292.448	4.125	20	30		CIEDRN
CC[C@@H](CC#N)NC(=O)[C@@H](CC1CCCCC1)C(C)C	ZINC000545156783	333965122	/nfs/dbraw/zinc/96/51/22/333965122.db2.gz	GLROYEYENDUEMB-HOTGVXAUSA-N	0	0	278.440	4.037	20	30		CIEDRN
C=CCCCc1nc(Cc2cccc(C(F)(F)F)c2)no1	ZINC000545553775	333988192	/nfs/dbraw/zinc/98/81/92/333988192.db2.gz	PCMCXBGBSZEPIF-UHFFFAOYSA-N	0	0	296.292	4.188	20	30		CIEDRN
C[C@@H]1CCCC[C@@H]1c1noc(C2(C#N)CCCCC2)n1	ZINC000545691760	333995172	/nfs/dbraw/zinc/99/51/72/333995172.db2.gz	SBNFEYVUPROSAS-OLZOCXBDSA-N	0	0	273.380	4.089	20	30		CIEDRN
CC[C@@H](CC#N)NC(=O)C/C=C\c1ccc(C(C)C)cc1	ZINC000545880715	334003734	/nfs/dbraw/zinc/00/37/34/334003734.db2.gz	UKNKOVLGRSKWBM-OSJSJHBBSA-N	0	0	284.403	4.022	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H]1CCC[C@H]1c1ccccc1	ZINC000132773916	334005351	/nfs/dbraw/zinc/00/53/51/334005351.db2.gz	KLDSMTAXJOMKEZ-ROUUACIJSA-N	0	0	283.415	4.207	20	30		CIEDRN
CC[C@H](CC1CCCC1)C(=O)N(C)Cc1cccc(C#N)c1	ZINC000074435936	334005875	/nfs/dbraw/zinc/00/58/75/334005875.db2.gz	QMRRPTCEHKEQQZ-GOSISDBHSA-N	0	0	298.430	4.123	20	30		CIEDRN
Cc1cccc(C)c1[C@@H](C)NCc1ccc(F)cc1C#N	ZINC000546227798	334020812	/nfs/dbraw/zinc/02/08/12/334020812.db2.gz	APTJKOCLFCLLRF-CQSZACIVSA-N	0	0	282.362	4.165	20	30		CIEDRN
Cc1cccc(-c2noc(/C=C\c3cccc(C#N)c3)n2)c1	ZINC000546231797	334021428	/nfs/dbraw/zinc/02/14/28/334021428.db2.gz	QMRXJMJVLQEJEI-HJWRWDBZSA-N	0	0	287.322	4.087	20	30		CIEDRN
C=CCC(CC=C)c1nc(-c2ccc(C)c([N+](=O)[O-])c2)no1	ZINC000546284423	334025030	/nfs/dbraw/zinc/02/50/30/334025030.db2.gz	MJNROSAMVNSMCW-UHFFFAOYSA-N	0	0	299.330	4.189	20	30		CIEDRN
Cc1cc(C)cc(Cc2noc(C3(C#N)CCCCC3)n2)c1	ZINC000546289903	334025603	/nfs/dbraw/zinc/02/56/03/334025603.db2.gz	IJDJPMQLKZUPTL-UHFFFAOYSA-N	0	0	295.386	4.003	20	30		CIEDRN
C=CCCCc1nc(-c2ccccc2COC(C)C)no1	ZINC000546351930	334028871	/nfs/dbraw/zinc/02/88/71/334028871.db2.gz	KRLHMOTVWKMMJT-UHFFFAOYSA-N	0	0	286.375	4.170	20	30		CIEDRN
C=CCCOCCCCc1nc([C@@H]2CCC[C@H](C)C2)no1	ZINC000546358428	334029153	/nfs/dbraw/zinc/02/91/53/334029153.db2.gz	WGDQJZZDHWGKBW-LSDHHAIUSA-N	0	0	292.423	4.279	20	30		CIEDRN
Cc1ccc(Cl)cc1-c1noc(-c2ccc(C#N)cc2)n1	ZINC000546396051	334030705	/nfs/dbraw/zinc/03/07/05/334030705.db2.gz	RERCSNCRFQOJAN-UHFFFAOYSA-N	0	0	295.729	4.237	20	30		CIEDRN
C=CCC(CC=C)c1nc(-c2ccc(F)c(OC)c2)no1	ZINC000546405830	334031070	/nfs/dbraw/zinc/03/10/70/334031070.db2.gz	KVBCGMRTIUYYKP-UHFFFAOYSA-N	0	0	288.322	4.120	20	30		CIEDRN
CC(C)(C#N)c1ccccc1COc1ccccc1F	ZINC000133782380	334056546	/nfs/dbraw/zinc/05/65/46/334056546.db2.gz	CQQXKAQSJHELSO-UHFFFAOYSA-N	0	0	269.319	4.206	20	30		CIEDRN
Cc1cccc(-c2noc(/C=C\c3ccc(C#N)cc3)n2)c1	ZINC000546939053	334056986	/nfs/dbraw/zinc/05/69/86/334056986.db2.gz	LDWVEIXMNXNNMC-KTKRTIGZSA-N	0	0	287.322	4.087	20	30		CIEDRN
C=CCCc1nc(Cc2ccc(Cl)c(Cl)c2)no1	ZINC000546946036	334057248	/nfs/dbraw/zinc/05/72/48/334057248.db2.gz	TUSNFCKMOXAQNU-UHFFFAOYSA-N	0	0	283.158	4.086	20	30		CIEDRN
CN(C(=O)Nc1ccc(C#N)c(Cl)c1)C1CCCCC1	ZINC000075997326	334064905	/nfs/dbraw/zinc/06/49/05/334064905.db2.gz	NDUFTYVOJIQPDW-UHFFFAOYSA-N	0	0	291.782	4.008	20	30		CIEDRN
C=CCC(CC=C)c1nc([C@@H]2CCOc3ccccc32)no1	ZINC000547102050	334066674	/nfs/dbraw/zinc/06/66/74/334066674.db2.gz	ZWSVBQYKNYZBGN-OAHLLOKOSA-N	0	0	296.370	4.220	20	30		CIEDRN
C=CCN(CC=C)C(=O)Nc1ncc(-c2ccccc2)s1	ZINC000076059250	334069473	/nfs/dbraw/zinc/06/94/73/334069473.db2.gz	DNOQHJQQJRTODW-UHFFFAOYSA-N	0	0	299.399	4.016	20	30		CIEDRN
C=CCC[C@@H](NC(=O)C[C@@H]1C=CCC1)c1ccccc1	ZINC000133943027	334073925	/nfs/dbraw/zinc/07/39/25/334073925.db2.gz	HDFYCDMOPINADQ-NVXWUHKLSA-N	0	0	269.388	4.166	20	30		CIEDRN
CCc1ccc(-c2ccc(CN[C@@H](CC)CC#N)o2)cc1	ZINC000547284364	334075945	/nfs/dbraw/zinc/07/59/45/334075945.db2.gz	WYXBXUNVHTZYTO-INIZCTEOSA-N	0	0	282.387	4.291	20	30		CIEDRN
CCc1ccc(-c2ccc(CN[C@H](CC)CC#N)o2)cc1	ZINC000547284365	334076001	/nfs/dbraw/zinc/07/60/01/334076001.db2.gz	WYXBXUNVHTZYTO-MRXNPFEDSA-N	0	0	282.387	4.291	20	30		CIEDRN
C=CCC[C@@H](NC(=O)Cc1ccsc1)c1ccccc1	ZINC000133985526	334076592	/nfs/dbraw/zinc/07/65/92/334076592.db2.gz	LLYUCWVJCYFBMY-MRXNPFEDSA-N	0	0	285.412	4.114	20	30		CIEDRN
CCn1c2ccccc2c2cc(CNC[C@H](C)C#N)ccc21	ZINC000237228657	334084414	/nfs/dbraw/zinc/08/44/14/334084414.db2.gz	VZKFXMRNYLFZSW-CQSZACIVSA-N	0	0	291.398	4.064	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc(O)c(C(F)(F)F)c1	ZINC000134220706	334084749	/nfs/dbraw/zinc/08/47/49/334084749.db2.gz	PBYKTFVEMNRFGP-UHFFFAOYSA-N	0	0	299.292	4.118	20	30		CIEDRN
C[C@H](CCc1ccco1)Nc1cccc(OCCCC#N)c1	ZINC000237533528	334090449	/nfs/dbraw/zinc/09/04/49/334090449.db2.gz	PEPHASIHNZKFFA-OAHLLOKOSA-N	0	0	298.386	4.395	20	30		CIEDRN
CCC(CC)CN(CCC#N)C(=O)C1=CCCCCC1	ZINC000547520986	334097613	/nfs/dbraw/zinc/09/76/13/334097613.db2.gz	YOMFTZBQTAQGBV-UHFFFAOYSA-N	0	0	276.424	4.055	20	30		CIEDRN
C=CCOc1ccccc1CNc1cccc2cc[nH]c21	ZINC000547533057	334099333	/nfs/dbraw/zinc/09/93/33/334099333.db2.gz	KZMNJPYOBNQOIO-UHFFFAOYSA-N	0	0	278.355	4.345	20	30		CIEDRN
C=CCCNc1ccc(C(=O)NC(C)(C)CC)c(Cl)c1	ZINC000077245361	334099706	/nfs/dbraw/zinc/09/97/06/334099706.db2.gz	VPDDSKPSDKKPKU-UHFFFAOYSA-N	0	0	294.826	4.246	20	30		CIEDRN
CCC(=O)c1cccc(N[C@H](C)c2ccc(C#N)cc2)c1	ZINC000135070250	334114506	/nfs/dbraw/zinc/11/45/06/334114506.db2.gz	GGFVUZOPDNDWOM-CYBMUJFWSA-N	0	0	278.355	4.324	20	30		CIEDRN
CC(C)[C@@H]([NH2+]Cc1ccc(C#N)o1)c1ccc(Cl)cc1	ZINC000135137749	334117283	/nfs/dbraw/zinc/11/72/83/334117283.db2.gz	USJOOIFRNCWVBN-MRXNPFEDSA-N	0	0	288.778	4.292	20	30		CIEDRN
CC[C@](C)(NCc1ccc(Cl)cc1C#N)C(F)(F)F	ZINC000547833820	334125146	/nfs/dbraw/zinc/12/51/46/334125146.db2.gz	VWLQONLKZKMYOZ-LBPRGKRZSA-N	0	0	290.716	4.032	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(OC2CCCC2)c(F)c1	ZINC000078232362	334128826	/nfs/dbraw/zinc/12/88/26/334128826.db2.gz	TXTJRTFSSLRZBB-UHFFFAOYSA-N	0	0	277.339	4.052	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@@H](C)Cc1ccsc1)c1ccccc1	ZINC000547953920	334131191	/nfs/dbraw/zinc/13/11/91/334131191.db2.gz	CQXYRUPNSNVCJP-YOEHRIQHSA-N	0	0	299.439	4.155	20	30		CIEDRN
Cc1ccc(NC(=O)N(CCC#N)CCC(C)C)cc1C	ZINC000078438893	334133639	/nfs/dbraw/zinc/13/36/39/334133639.db2.gz	YOYXNLRALNLVGR-UHFFFAOYSA-N	0	0	287.407	4.097	20	30		CIEDRN
C=CCCC(=O)NCc1ccccc1Sc1ccccc1	ZINC000078554768	334136104	/nfs/dbraw/zinc/13/61/04/334136104.db2.gz	CUGINNLADMCZDX-UHFFFAOYSA-N	0	0	297.423	4.420	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1ccc(SC)nc1)c1ccccc1	ZINC000548280054	334148392	/nfs/dbraw/zinc/14/83/92/334148392.db2.gz	FMCJRHRKNRXGBU-OAHLLOKOSA-N	0	0	298.411	4.102	20	30		CIEDRN
CCC(CC)N(C(=O)c1ccc(C#N)c(Cl)c1)C1CC1	ZINC000548281508	334148726	/nfs/dbraw/zinc/14/87/26/334148726.db2.gz	FYQTZBVBANSMMF-UHFFFAOYSA-N	0	0	290.794	4.005	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@H](C)c1cccc(Cl)c1	ZINC000079217317	334150277	/nfs/dbraw/zinc/15/02/77/334150277.db2.gz	VNHDILRCSLZOAA-GFCCVEGCSA-N	0	0	280.799	4.009	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)CCc2cccc(C)c2)s1	ZINC000079263367	334151068	/nfs/dbraw/zinc/15/10/68/334151068.db2.gz	DVKHFBIXGZUMDW-UHFFFAOYSA-N	0	0	298.411	4.062	20	30		CIEDRN
N#CCc1ccc(NC(=O)CCCC2CCCC2)cc1	ZINC000079319372	334151522	/nfs/dbraw/zinc/15/15/22/334151522.db2.gz	MMZJTSUXQKSRQS-UHFFFAOYSA-N	0	0	270.376	4.052	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)N[C@@H]1CCC[C@H](C)C1	ZINC000079517352	334156186	/nfs/dbraw/zinc/15/61/86/334156186.db2.gz	UKWOXWDSNRSDBZ-UONOGXRCSA-N	0	0	292.448	4.024	20	30		CIEDRN
CN(Cc1ccccc1-c1ccccc1)c1ccncc1C#N	ZINC000548480480	334159501	/nfs/dbraw/zinc/15/95/01/334159501.db2.gz	KHMQMEGKVLOHBF-UHFFFAOYSA-N	0	0	299.377	4.257	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1cccc2cc[nH]c21)c1ccccc1	ZINC000548616367	334163892	/nfs/dbraw/zinc/16/38/92/334163892.db2.gz	YKRBUBIVDUPPIN-MRXNPFEDSA-N	0	0	290.366	4.466	20	30		CIEDRN
CC1CC(C#N)(C(=O)N[C@H]2CCC[C@@H](C(C)(C)C)CC2)C1	ZINC000548708587	334166724	/nfs/dbraw/zinc/16/67/24/334166724.db2.gz	SLAKXPVOVLHRIM-DGSCNEQVSA-N	0	0	290.451	4.037	20	30		CIEDRN
CC1CC(C#N)(C(=O)N[C@@H]2CCC[C@@H](C(C)(C)C)CC2)C1	ZINC000548708589	334166764	/nfs/dbraw/zinc/16/67/64/334166764.db2.gz	SLAKXPVOVLHRIM-NWPKHEMWSA-N	0	0	290.451	4.037	20	30		CIEDRN
C=CCN(CC=C)C(=O)N[C@H](C)c1ccc2c(c1)CCCC2	ZINC000243937339	334172261	/nfs/dbraw/zinc/17/22/61/334172261.db2.gz	RVMZFRHRGCNONH-OAHLLOKOSA-N	0	0	298.430	4.010	20	30		CIEDRN
C[C@H]1CC(CCNc2ccc(C#N)c(Cl)c2)C[C@H](C)O1	ZINC000548987940	334182005	/nfs/dbraw/zinc/18/20/05/334182005.db2.gz	VZLOYJBEPQMBNK-RYUDHWBXSA-N	0	0	292.810	4.217	20	30		CIEDRN
C=CCCN[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F	ZINC000549064608	334184236	/nfs/dbraw/zinc/18/42/36/334184236.db2.gz	UKLXIADYWPZLBM-NSHDSACASA-N	0	0	297.242	4.475	20	30		CIEDRN
C=CCCC(=O)N1CCCC[C@H]1c1cccc(C)c1C	ZINC000081323377	334185253	/nfs/dbraw/zinc/18/52/53/334185253.db2.gz	VPXZIPMFILAPDD-KRWDZBQOSA-N	0	0	271.404	4.323	20	30		CIEDRN
CO[C@H](CSc1ccc(C#N)cc1F)c1ccccc1	ZINC000549223081	334187862	/nfs/dbraw/zinc/18/78/62/334187862.db2.gz	CMXYFPBFNKNQON-OAHLLOKOSA-N	0	0	287.359	4.177	20	30		CIEDRN
N#CCN[C@H](c1cccc(C(F)(F)F)c1)C1CCCCC1	ZINC000549407575	334192920	/nfs/dbraw/zinc/19/29/20/334192920.db2.gz	YFFVINRYFJFDRY-HNNXBMFYSA-N	0	0	296.336	4.440	20	30		CIEDRN
C=CCCOc1cc(Cl)c(Cl)cc1C(C)=O	ZINC000549514523	334195939	/nfs/dbraw/zinc/19/59/39/334195939.db2.gz	PUSALNNXAOWKIC-UHFFFAOYSA-N	0	0	259.132	4.151	20	30		CIEDRN
CCN(C(=O)CC(C)(C)C1CC1)[C@H](C)c1ccc(C#N)cc1	ZINC000549560334	334197995	/nfs/dbraw/zinc/19/79/95/334197995.db2.gz	POVCXYIWGBFVQO-CQSZACIVSA-N	0	0	298.430	4.294	20	30		CIEDRN
N#CCc1ccc(N[C@H]2CCC[C@H](C3CC3)C2)cc1	ZINC000081633378	334201134	/nfs/dbraw/zinc/20/11/34/334201134.db2.gz	ALYGSPBSECYYFS-RDJZCZTQSA-N	0	0	254.377	4.133	20	30		CIEDRN
CCc1nc(C(C)C)ccc1CN1CCCC(C)(C)[C@@H]1C#N	ZINC000549999130	334210976	/nfs/dbraw/zinc/21/09/76/334210976.db2.gz	RRVCJBCGZGAOOG-SFHVURJKSA-N	0	0	299.462	4.282	20	30		CIEDRN
C=CCC(C)(C)C(=O)N(C)CCc1cccc2ccccc21	ZINC000550010471	334211384	/nfs/dbraw/zinc/21/13/84/334211384.db2.gz	FLJCBCQTGLOESJ-UHFFFAOYSA-N	0	0	295.426	4.443	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CCC[C@H](Cc2ccccc2)C1	ZINC000550382297	334221415	/nfs/dbraw/zinc/22/14/15/334221415.db2.gz	ZNGKUTIQBATMLE-QGZVFWFLSA-N	0	0	285.431	4.070	20	30		CIEDRN
CCOc1cc(Cl)ccc1NCc1cc(C#N)cs1	ZINC000152662842	334229638	/nfs/dbraw/zinc/22/96/38/334229638.db2.gz	GKTZICYKOTYCLL-UHFFFAOYSA-N	0	0	292.791	4.284	20	30		CIEDRN
N#CCc1ccc(CSCCCCCF)cc1	ZINC000551004040	334235885	/nfs/dbraw/zinc/23/58/85/334235885.db2.gz	RVPNWUSHQQQPOM-UHFFFAOYSA-N	0	0	251.370	4.126	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)c1sccc1F	ZINC000551035352	334236753	/nfs/dbraw/zinc/23/67/53/334236753.db2.gz	WRJRCAPSDHZFFQ-UHFFFAOYSA-N	0	0	281.396	4.096	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ccc(C)c(F)c2)n1	ZINC000551137248	334239222	/nfs/dbraw/zinc/23/92/22/334239222.db2.gz	WCNXYJSRFFAPDJ-UHFFFAOYSA-N	0	0	260.312	4.038	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H]2Cc3cc(C)c(C)cc3O2)n1	ZINC000551138331	334239240	/nfs/dbraw/zinc/23/92/40/334239240.db2.gz	RKEIREGYFGEGIZ-HNNXBMFYSA-N	0	0	298.386	4.216	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cc(-c3ccccc3)on2)n1	ZINC000551134755	334239268	/nfs/dbraw/zinc/23/92/68/334239268.db2.gz	GTJOKEWQJIPIOM-UHFFFAOYSA-N	0	0	295.342	4.245	20	30		CIEDRN
CCC(CC)[C@H](C)C(=O)N(CCC#N)c1ccc(F)cc1	ZINC000551321712	334246949	/nfs/dbraw/zinc/24/69/49/334246949.db2.gz	FHRNFUJNORETDX-ZDUSSCGKSA-N	0	0	290.382	4.145	20	30		CIEDRN
C=CCC(F)(F)c1nc(-c2cccc(Cl)c2)no1	ZINC000551331831	334247254	/nfs/dbraw/zinc/24/72/54/334247254.db2.gz	CAITYMJBYVLZLV-UHFFFAOYSA-N	0	0	270.666	4.058	20	30		CIEDRN
C=CCC(C)(C)c1noc(CCc2cccc(C)c2)n1	ZINC000551469768	334251178	/nfs/dbraw/zinc/25/11/78/334251178.db2.gz	GZVURLMAMUIELR-UHFFFAOYSA-N	0	0	270.376	4.017	20	30		CIEDRN
CCc1c(C)sc(NC(=O)[C@@H]2CC=CC[C@H]2C)c1C#N	ZINC000551485889	334251383	/nfs/dbraw/zinc/25/13/83/334251383.db2.gz	QEGYGWLAOBCXMI-ZWNOBZJWSA-N	0	0	288.416	4.031	20	30		CIEDRN
C=CCC(C)(C)c1noc(CO[C@H]2CCCC[C@H]2CC)n1	ZINC000551491757	334251534	/nfs/dbraw/zinc/25/15/34/334251534.db2.gz	HNDFETAYXGKIQS-KGLIPLIRSA-N	0	0	292.423	4.409	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H](C)Sc2ccccn2)n1	ZINC000551491028	334251541	/nfs/dbraw/zinc/25/15/41/334251541.db2.gz	YZXQYHBLGPXWCU-NSHDSACASA-N	0	0	289.404	4.172	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H](C)c2ccccc2)n1	ZINC000551493717	334251566	/nfs/dbraw/zinc/25/15/66/334251566.db2.gz	KALSMZKPDQKZPB-LBPRGKRZSA-N	0	0	256.349	4.075	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CCC[C@@](C)(CCC)C1	ZINC000551599374	334255709	/nfs/dbraw/zinc/25/57/09/334255709.db2.gz	OXCFZXXSCNWERV-MRXNPFEDSA-N	0	0	251.414	4.018	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CCC[C@](C)(CCC)C1	ZINC000551599373	334255730	/nfs/dbraw/zinc/25/57/30/334255730.db2.gz	OXCFZXXSCNWERV-INIZCTEOSA-N	0	0	251.414	4.018	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1coc2ccc(CC)cc21	ZINC000552230822	334306256	/nfs/dbraw/zinc/30/62/56/334306256.db2.gz	BNHSZOGOJARFLC-CYBMUJFWSA-N	0	0	271.360	4.080	20	30		CIEDRN
CN(Cc1ccc(-c2ccccc2F)o1)CC(C)(C)C#N	ZINC000552316583	334316293	/nfs/dbraw/zinc/31/62/93/334316293.db2.gz	GHFCYWMLUCJSFW-UHFFFAOYSA-N	0	0	286.350	4.067	20	30		CIEDRN
CCC(C)(C)c1ccc(NC(=O)[C@@](C)(C#N)CC)cc1	ZINC000552541924	334334569	/nfs/dbraw/zinc/33/45/69/334334569.db2.gz	OIQCNCKFNUZLHW-QGZVFWFLSA-N	0	0	272.392	4.253	20	30		CIEDRN
C=C(CC)CSc1ncnc2sc(C)cc21	ZINC000552625678	334340254	/nfs/dbraw/zinc/34/02/54/334340254.db2.gz	MOJQACUMYRAKNY-UHFFFAOYSA-N	0	0	250.392	4.058	20	30		CIEDRN
C=CCN(CCC#N)C(=O)C/C=C\c1ccc(C(C)C)cc1	ZINC000552754947	334344141	/nfs/dbraw/zinc/34/41/41/334344141.db2.gz	PZWNBRKJSDXTST-ALCCZGGFSA-N	0	0	296.414	4.142	20	30		CIEDRN
C=C(C)CSCc1coc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000089604041	334347487	/nfs/dbraw/zinc/34/74/87/334347487.db2.gz	DUCGVAJOJAGYHW-UHFFFAOYSA-N	0	0	290.344	4.059	20	30		CIEDRN
N#Cc1ccc(NC(=O)c2cccc(-c3ccoc3)c2)cc1	ZINC000089718441	334349052	/nfs/dbraw/zinc/34/90/52/334349052.db2.gz	UFGGUOXUJBOVEX-UHFFFAOYSA-N	0	0	288.306	4.071	20	30		CIEDRN
Cc1cc(C#N)nc(N[C@@H](CC(C)(C)C)c2ccccc2)n1	ZINC000553080708	334360302	/nfs/dbraw/zinc/36/03/02/334360302.db2.gz	WWQKRSPGYXXXHE-INIZCTEOSA-N	0	0	294.402	4.246	20	30		CIEDRN
Cc1nsc(N2C[C@H](c3ccccc3C)C[C@@H]2C)c1C#N	ZINC000553102315	334361651	/nfs/dbraw/zinc/36/16/51/334361651.db2.gz	KIKJKISWTRYRDF-GXTWGEPZSA-N	0	0	297.427	4.014	20	30		CIEDRN
Cc1nsc(N[C@@H](C)c2cccc(C)c2C)c1C#N	ZINC000553107204	334361960	/nfs/dbraw/zinc/36/19/60/334361960.db2.gz	MFTCXSIYCKFAIQ-NSHDSACASA-N	0	0	271.389	4.113	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N([C@H](C)c1ccccc1)C1CC1	ZINC000553139284	334364382	/nfs/dbraw/zinc/36/43/82/334364382.db2.gz	IHKRDICCRLGMFB-LSDHHAIUSA-N	0	0	271.404	4.341	20	30		CIEDRN
C[C@@H]1CCN(c2nccc(C#N)c2Cl)[C@@H]2CCCC[C@H]12	ZINC000553152222	334365335	/nfs/dbraw/zinc/36/53/35/334365335.db2.gz	GNDIAPAVAHOJHC-MRVWCRGKSA-N	0	0	289.810	4.012	20	30		CIEDRN
Cc1nsc(N[C@@H]2CC(C)(C)c3ccccc32)c1C#N	ZINC000553169900	334366391	/nfs/dbraw/zinc/36/63/91/334366391.db2.gz	HMZUUCGVWSTIPJ-CQSZACIVSA-N	0	0	283.400	4.158	20	30		CIEDRN
CCCCC(=O)NCc1ccc(-c2ccccc2C#N)cc1	ZINC000091101210	334372200	/nfs/dbraw/zinc/37/22/00/334372200.db2.gz	IAKLZPBCQKPVSE-UHFFFAOYSA-N	0	0	292.382	4.032	20	30		CIEDRN
CC[C@H](Nc1cc(C#N)ccn1)c1cccc(Cl)c1	ZINC000553397123	334382539	/nfs/dbraw/zinc/38/25/39/334382539.db2.gz	PBXYNGRCEKACQX-AWEZNQCLSA-N	0	0	271.751	4.170	20	30		CIEDRN
C[C@@H]1CCC[C@@H](Nc2nc(C(F)(F)F)ccc2C#N)[C@H]1C	ZINC000252674860	334385149	/nfs/dbraw/zinc/38/51/49/334385149.db2.gz	UXJNRGKTTWXWPX-JFGNBEQYSA-N	0	0	297.324	4.209	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H]1CCCc2sc(Cl)cc21	ZINC000553490377	334388128	/nfs/dbraw/zinc/38/81/28/334388128.db2.gz	JUJBAKUGFLKKCD-NSHDSACASA-N	0	0	297.851	4.497	20	30		CIEDRN
C=CCC[C@H](Nc1ccnc2c1cnn2C)c1ccccc1	ZINC000553510269	334389162	/nfs/dbraw/zinc/38/91/62/334389162.db2.gz	ZRSSIPMKSMWTSJ-INIZCTEOSA-N	0	0	292.386	4.088	20	30		CIEDRN
C=CCC[C@@H](Nc1ccnc2c1cnn2C)c1ccccc1	ZINC000553510270	334389244	/nfs/dbraw/zinc/38/92/44/334389244.db2.gz	ZRSSIPMKSMWTSJ-MRXNPFEDSA-N	0	0	292.386	4.088	20	30		CIEDRN
C=C[C@@H](CC(=O)NC(C1CCC1)C1CCC1)c1ccccc1	ZINC000553625325	334393584	/nfs/dbraw/zinc/39/35/84/334393584.db2.gz	KWLNJLSPWDCCBO-HNNXBMFYSA-N	0	0	297.442	4.431	20	30		CIEDRN
C=CCCCC(=O)NCC(C)(C)c1ccc(C)cc1C	ZINC000553640035	334394260	/nfs/dbraw/zinc/39/42/60/334394260.db2.gz	LYVXNKUBDFQDOZ-UHFFFAOYSA-N	0	0	273.420	4.054	20	30		CIEDRN
Cc1ccnc(N2C[C@H](C)CC[C@@H]2c2ccccc2)c1C#N	ZINC000553675583	334395440	/nfs/dbraw/zinc/39/54/40/334395440.db2.gz	ZPTZZYDCSCAOMM-RDTXWAMCSA-N	0	0	291.398	4.239	20	30		CIEDRN
CC(C)Oc1ccc(F)cc1NCC(C)(C)CCC#N	ZINC000092161753	334398779	/nfs/dbraw/zinc/39/87/79/334398779.db2.gz	UHWIVDUGKKVWTC-UHFFFAOYSA-N	0	0	278.371	4.355	20	30		CIEDRN
C[C@@H]1C[C@@H](C(C)(C)C)CCN1C(=O)Nc1ccc(C#N)cc1	ZINC000554055738	334408133	/nfs/dbraw/zinc/40/81/33/334408133.db2.gz	GSDFQHCPBHZRMZ-HIFRSBDPSA-N	0	0	299.418	4.237	20	30		CIEDRN
Cc1nc(-c2ccc(OCCC(C)(C)C#N)cc2)cs1	ZINC000554446964	334430390	/nfs/dbraw/zinc/43/03/90/334430390.db2.gz	FLDLRPZOJGEVJY-UHFFFAOYSA-N	0	0	286.400	4.437	20	30		CIEDRN
C[C@H](CCC(=O)Nc1ccccc1CC#N)c1ccccc1	ZINC000554750500	334451195	/nfs/dbraw/zinc/45/11/95/334451195.db2.gz	MYSUYMURHFNQFN-OAHLLOKOSA-N	0	0	292.382	4.275	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)CC(C)(C)C1CC1	ZINC000555283762	334473669	/nfs/dbraw/zinc/47/36/69/334473669.db2.gz	ABJKTFZRYIGMBJ-UHFFFAOYSA-N	0	0	271.404	4.028	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CC2(CCC2)c2c1cccc2F	ZINC000555731007	334488628	/nfs/dbraw/zinc/48/86/28/334488628.db2.gz	JRILFSFHLLACGV-UHFFFAOYSA-N	0	0	287.378	4.196	20	30		CIEDRN
Cc1c2cc(C#N)ccc2sc1C(=O)Nc1ccsc1	ZINC000556218539	334500598	/nfs/dbraw/zinc/50/05/98/334500598.db2.gz	XJRBCBGVTSFHEJ-UHFFFAOYSA-N	0	0	298.392	4.395	20	30		CIEDRN
N#CCC[C@@H](C#N)COc1ccc(Oc2ccccc2)cc1	ZINC000152849231	334519203	/nfs/dbraw/zinc/51/92/03/334519203.db2.gz	IRFBJULEXSVMIK-HNNXBMFYSA-N	0	0	292.338	4.301	20	30		CIEDRN
CC(C)(C#N)CCSCCc1ccc(F)c(F)c1	ZINC000564752312	334519261	/nfs/dbraw/zinc/51/92/61/334519261.db2.gz	KMDYWHVCDMKVPL-UHFFFAOYSA-N	0	0	269.360	4.180	20	30		CIEDRN
CC[C@H]1CCCC[C@H]1C(=O)Nc1scc(C)c1C#N	ZINC000565328554	334553204	/nfs/dbraw/zinc/55/32/04/334553204.db2.gz	GFKIARUQTFQYED-NWDGAFQWSA-N	0	0	276.405	4.083	20	30		CIEDRN
CC(C)(CC#N)CSc1nc2ccccc2n1C(F)F	ZINC000565434287	334563662	/nfs/dbraw/zinc/56/36/62/334563662.db2.gz	YCWFDZQOWQRREW-UHFFFAOYSA-N	0	0	295.358	4.463	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)c1ccc(OC)c(Cl)c1	ZINC000153203532	334570406	/nfs/dbraw/zinc/57/04/06/334570406.db2.gz	KBYBZYOEQFPKMR-UHFFFAOYSA-N	0	0	293.794	4.080	20	30		CIEDRN
C=CCCCC(=O)N1CCC(C)(CC(C)C)CC1	ZINC000565699254	334588459	/nfs/dbraw/zinc/58/84/59/334588459.db2.gz	AWUBGTUQODESMY-UHFFFAOYSA-N	0	0	251.414	4.018	20	30		CIEDRN
N#CCc1cc(Cl)ccc1NC(=O)C1=CCCCCC1	ZINC000565819671	334599693	/nfs/dbraw/zinc/59/96/93/334599693.db2.gz	VSSBRWDVIPLZGV-UHFFFAOYSA-N	0	0	288.778	4.235	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc([C@@H](C)c2cccs2)no1	ZINC000566940178	334670385	/nfs/dbraw/zinc/67/03/85/334670385.db2.gz	SHTHUCDSPJAPBU-HZMBPMFUSA-N	0	0	262.378	4.137	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@H](CC)c1cccc(OC)c1	ZINC000567016737	334673391	/nfs/dbraw/zinc/67/33/91/334673391.db2.gz	FWTDCVFGOVIDAT-RHSMWYFYSA-N	0	0	289.419	4.207	20	30		CIEDRN
N#Cc1cnc2c(Cl)cccc2c1N[C@@H]1CC[C@H](F)C1	ZINC000567264152	334699361	/nfs/dbraw/zinc/69/93/61/334699361.db2.gz	KNJMYANCICSVQN-WDEREUQCSA-N	0	0	289.741	4.062	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H](C)c2ccccc2)n1	ZINC000567365109	334709157	/nfs/dbraw/zinc/70/91/57/334709157.db2.gz	KALSMZKPDQKZPB-GFCCVEGCSA-N	0	0	256.349	4.075	20	30		CIEDRN
C=CCN(C)C(=O)N[C@@H](c1ccc(Cl)cc1F)C(C)C	ZINC000155868942	334730878	/nfs/dbraw/zinc/73/08/78/334730878.db2.gz	CZROFIUXOCCMRM-CQSZACIVSA-N	0	0	298.789	4.004	20	30		CIEDRN
Cc1cccnc1C(C)(C)CNc1ccc(C#N)c(Cl)c1	ZINC000567553530	334732290	/nfs/dbraw/zinc/73/22/90/334732290.db2.gz	ZMIQANMXQKYEMB-UHFFFAOYSA-N	0	0	299.805	4.305	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@@H]1[C@H](C)CCC	ZINC000155970420	334732742	/nfs/dbraw/zinc/73/27/42/334732742.db2.gz	KMLIURJEXNCSDX-GDBMZVCRSA-N	0	0	263.425	4.182	20	30		CIEDRN
C[C@@H](Cc1ccccc1Cl)C(=O)Nc1ccccc1C#N	ZINC000156152308	334735685	/nfs/dbraw/zinc/73/56/85/334735685.db2.gz	JDHUMTNQHJQOAY-LBPRGKRZSA-N	0	0	298.773	4.029	20	30		CIEDRN
CCC[C@@H](C(=O)N[C@@H](CCC#N)c1ccccc1)C(C)C	ZINC000156195383	334736336	/nfs/dbraw/zinc/73/63/36/334736336.db2.gz	GPXQQOLGKQNWKA-SJORKVTESA-N	0	0	286.419	4.220	20	30		CIEDRN
CCN(C(=O)CCC(C)C)c1ccc(C#N)c(Cl)c1	ZINC000156536282	334743785	/nfs/dbraw/zinc/74/37/85/334743785.db2.gz	OBOGASIJTAFQKO-UHFFFAOYSA-N	0	0	278.783	4.001	20	30		CIEDRN
CC[C@@H](C)CNc1ccccc1Oc1ncccc1C#N	ZINC000156986156	334755644	/nfs/dbraw/zinc/75/56/44/334755644.db2.gz	BOIKMXAROXRGPE-CYBMUJFWSA-N	0	0	281.359	4.204	20	30		CIEDRN
CC(C)C[C@H](C)CC(=O)Nc1cc(C#N)c2ccccc2n1	ZINC000567788247	334760828	/nfs/dbraw/zinc/76/08/28/334760828.db2.gz	ZYFNARWRYSJAMX-ZDUSSCGKSA-N	0	0	295.386	4.117	20	30		CIEDRN
CCc1cc(NCCCC2(C#N)CCOCC2)ccc1C	ZINC000568065249	334789141	/nfs/dbraw/zinc/78/91/41/334789141.db2.gz	HTPVVRRBLBJSTE-UHFFFAOYSA-N	0	0	286.419	4.070	20	30		CIEDRN
C=CCCCCCNC(=O)C[C@@H](C)c1ccccc1OC	ZINC000568171607	334799857	/nfs/dbraw/zinc/79/98/57/334799857.db2.gz	RBQDHZUKLSWLJC-OAHLLOKOSA-N	0	0	289.419	4.051	20	30		CIEDRN
COc1ccc(C)cc1CSCCC(C)(C)C#N	ZINC000158856374	334815237	/nfs/dbraw/zinc/81/52/37/334815237.db2.gz	JULHJTQIAZXUOB-UHFFFAOYSA-N	0	0	263.406	4.177	20	30		CIEDRN
CCN(C[C@H](C)C#N)C(=O)[C@H](CC1CCCCC1)C(C)C	ZINC000569160843	334858768	/nfs/dbraw/zinc/85/87/68/334858768.db2.gz	ASPUFMRBIZQZBO-NVXWUHKLSA-N	0	0	292.467	4.237	20	30		CIEDRN
C=CCCC(=O)N(c1cccc(C(F)(F)F)c1)C(C)C	ZINC000159283466	334860656	/nfs/dbraw/zinc/86/06/56/334860656.db2.gz	JJIKNGJYRYCXBC-UHFFFAOYSA-N	0	0	285.309	4.413	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2ccccc2COCC)no1	ZINC000576312049	335188153	/nfs/dbraw/zinc/18/81/53/335188153.db2.gz	GOOIQIKDPUFUJJ-ZDUSSCGKSA-N	0	0	286.375	4.343	20	30		CIEDRN
C=CCOc1ccc(CNc2cnoc2CC)cc1Cl	ZINC000576328876	335190087	/nfs/dbraw/zinc/19/00/87/335190087.db2.gz	XSNIWNHXYLCXPW-UHFFFAOYSA-N	0	0	292.766	4.067	20	30		CIEDRN
N#C[C@@H](C(=O)c1ccc(C2CCCC2)cc1)c1ccccn1	ZINC000576509380	335212620	/nfs/dbraw/zinc/21/26/20/335212620.db2.gz	AZKOAYMCOASAEL-QGZVFWFLSA-N	0	0	290.366	4.229	20	30		CIEDRN
N#Cc1ccc(COc2ccc(C(F)(F)F)cc2F)cc1	ZINC000576552443	335217923	/nfs/dbraw/zinc/21/79/23/335217923.db2.gz	BTHUSWXUHUQPGG-UHFFFAOYSA-N	0	0	295.235	4.295	20	30		CIEDRN
C=C(C)CCc1noc(-c2ncoc2-c2ccc(F)cc2)n1	ZINC000576551273	335218191	/nfs/dbraw/zinc/21/81/91/335218191.db2.gz	PVKKUVGDEAIOSE-UHFFFAOYSA-N	0	0	299.305	4.039	20	30		CIEDRN
C=C(C)CCSCC/C=C\c1cncc(OC)c1	ZINC000576637135	335228738	/nfs/dbraw/zinc/22/87/38/335228738.db2.gz	POEMGSJEDNBDKW-XQRVVYSFSA-N	0	0	263.406	4.193	20	30		CIEDRN
C=C(C)CCNc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000576859070	335256460	/nfs/dbraw/zinc/25/64/60/335256460.db2.gz	LPIJFXJWNSKCOA-UHFFFAOYSA-N	0	0	280.371	4.317	20	30		CIEDRN
CC(C)=CCC[C@@H](C)CC(=O)NC1(C#N)CCCCC1	ZINC000576875740	335258670	/nfs/dbraw/zinc/25/86/70/335258670.db2.gz	IEKVOLALKFYCSN-OAHLLOKOSA-N	0	0	276.424	4.102	20	30		CIEDRN
C[C@@H](CC(=O)N1CCC(CCC#N)CC1)C1CCCCC1	ZINC000576877346	335259198	/nfs/dbraw/zinc/25/91/98/335259198.db2.gz	VEMHRYIFGCBKHN-HNNXBMFYSA-N	0	0	290.451	4.135	20	30		CIEDRN
Cc1nc(CSCc2ccc(C#N)cc2F)sc1C	ZINC000176415274	335272869	/nfs/dbraw/zinc/27/28/69/335272869.db2.gz	WXRWCCIYAQMQMJ-UHFFFAOYSA-N	0	0	292.404	4.204	20	30		CIEDRN
C[C@H]1CC[C@H](Nc2ccc(Oc3ccnc(C#N)c3)cc2)C1	ZINC000576991298	335274625	/nfs/dbraw/zinc/27/46/25/335274625.db2.gz	VTQRQZUWMPJYLJ-ZFWWWQNUSA-N	0	0	293.370	4.346	20	30		CIEDRN
C[C@@H]1CC[C@H](Nc2ccc(Oc3ccnc(C#N)c3)cc2)C1	ZINC000576991293	335274742	/nfs/dbraw/zinc/27/47/42/335274742.db2.gz	VTQRQZUWMPJYLJ-HIFRSBDPSA-N	0	0	293.370	4.346	20	30		CIEDRN
C[C@@H]1CC[C@@H](Nc2ccc(Oc3ccnc(C#N)c3)cc2)C1	ZINC000576991295	335274827	/nfs/dbraw/zinc/27/48/27/335274827.db2.gz	VTQRQZUWMPJYLJ-UKRRQHHQSA-N	0	0	293.370	4.346	20	30		CIEDRN
Cc1ccc(CSc2ccc(C#N)c([N+](=O)[O-])c2)cc1C	ZINC000577032773	335285566	/nfs/dbraw/zinc/28/55/66/335285566.db2.gz	VBFMITGWOXVHNF-UHFFFAOYSA-N	0	0	298.367	4.376	20	30		CIEDRN
CC(C)c1ccc([C@@H](Nc2cc(C#N)ncn2)C(C)C)cc1	ZINC000577044330	335288745	/nfs/dbraw/zinc/28/87/45/335288745.db2.gz	ACCSMRCPVWPWIS-SFHVURJKSA-N	0	0	294.402	4.281	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)C1CC2(CCC2)C1	ZINC000577110268	335301832	/nfs/dbraw/zinc/30/18/32/335301832.db2.gz	LIQNUCJXNGHEFY-UHFFFAOYSA-N	0	0	283.415	4.172	20	30		CIEDRN
C[C@@H](NCc1ccc(C#N)s1)c1c(F)cccc1Cl	ZINC000176981591	335351231	/nfs/dbraw/zinc/35/12/31/335351231.db2.gz	QSYFYLNRQAOTQW-SECBINFHSA-N	0	0	294.782	4.263	20	30		CIEDRN
N#Cc1cnccc1Oc1ccc(C2CC2)cc1Cl	ZINC000577929963	335422420	/nfs/dbraw/zinc/42/24/20/335422420.db2.gz	DAFBXAHQXFZJBL-UHFFFAOYSA-N	0	0	270.719	4.276	20	30		CIEDRN
C=C[C@H](CC(=O)N([C@H](C)C1CC1)C1CC1)c1ccccc1	ZINC000178910599	335460359	/nfs/dbraw/zinc/46/03/59/335460359.db2.gz	LKTXGJNOTIEFSS-HUUCEWRRSA-N	0	0	283.415	4.136	20	30		CIEDRN
C=CCCCC(=O)Nc1cccnc1-c1ccccc1	ZINC000179367175	335489647	/nfs/dbraw/zinc/48/96/47/335489647.db2.gz	VMXPZZMZMUDIOX-UHFFFAOYSA-N	0	0	266.344	4.043	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@@H]1C[C@H]1c1ccccc1Cl	ZINC000578123854	335506554	/nfs/dbraw/zinc/50/65/54/335506554.db2.gz	SILVABWVCNJFLL-AEGPPILISA-N	0	0	291.822	4.305	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)C/C=C/c1cccc(F)c1	ZINC000179798775	335519727	/nfs/dbraw/zinc/51/97/27/335519727.db2.gz	GHJZVYYICVTOGP-RNVIBTMRSA-N	0	0	275.367	4.090	20	30		CIEDRN
CC#CCCCC(=O)N(CCCC)C1CCCCC1	ZINC000578161616	335537418	/nfs/dbraw/zinc/53/74/18/335537418.db2.gz	SFZNVWFVHTXLRR-UHFFFAOYSA-N	0	0	263.425	4.141	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000180970712	335631753	/nfs/dbraw/zinc/63/17/53/335631753.db2.gz	DBZBNBKEVQQQIU-WBVHZDCISA-N	0	0	299.418	4.075	20	30		CIEDRN
C/C=C/c1ccc(NC(=O)N2CCC(CCC#N)CC2)cc1	ZINC000578767499	335672851	/nfs/dbraw/zinc/67/28/51/335672851.db2.gz	NQBMRJJUBTYTPG-DUXPYHPUSA-N	0	0	297.402	4.267	20	30		CIEDRN
C=CCCC(=O)N(C)[C@H](C)Cc1ccccc1C(F)(F)F	ZINC000579389531	335743948	/nfs/dbraw/zinc/74/39/48/335743948.db2.gz	VBPIOPYTNNMWLL-GFCCVEGCSA-N	0	0	299.336	4.061	20	30		CIEDRN
C=C(C)CS[C@@H](C)C(=O)Nc1ccc(C)cc1Cl	ZINC000579459171	335761946	/nfs/dbraw/zinc/76/19/46/335761946.db2.gz	CHQAGSQXIONTCV-NSHDSACASA-N	0	0	283.824	4.285	20	30		CIEDRN
Cc1cnc([C@H](N[C@H](C)c2cccc(C#N)c2)C2CC2)s1	ZINC000181820654	335786814	/nfs/dbraw/zinc/78/68/14/335786814.db2.gz	OAJFLNXHNWRZCN-MLGOLLRUSA-N	0	0	297.427	4.125	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1c(C)cccc1C	ZINC000182773024	335841810	/nfs/dbraw/zinc/84/18/10/335841810.db2.gz	LPSKIKJPXFFCDT-CQSZACIVSA-N	0	0	260.381	4.170	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@H](c2cc(C)cc(C)c2)C1	ZINC000183754054	335904537	/nfs/dbraw/zinc/90/45/37/335904537.db2.gz	AXHYWTKGKMSYLY-SFHVURJKSA-N	0	0	297.442	4.388	20	30		CIEDRN
CC(C)c1ccc(C(=O)N(C)c2cccc(C#N)c2)s1	ZINC000185731296	335956093	/nfs/dbraw/zinc/95/60/93/335956093.db2.gz	SOCSYSAHEKQICA-UHFFFAOYSA-N	0	0	284.384	4.020	20	30		CIEDRN
C=CCN(CC(F)(F)F)C(=O)c1ccc(C(C)C)s1	ZINC000185718602	335956104	/nfs/dbraw/zinc/95/61/04/335956104.db2.gz	QMQWGZFUMXAZLG-UHFFFAOYSA-N	0	0	291.338	4.062	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)c2sccc2F)c1	ZINC000580729342	335960724	/nfs/dbraw/zinc/96/07/24/335960724.db2.gz	ORVQHJUXXGTWIW-UHFFFAOYSA-N	0	0	291.347	4.094	20	30		CIEDRN
N#CC1(CCOc2ccccc2-n2ccnc2)CCCCC1	ZINC000581061618	336001908	/nfs/dbraw/zinc/00/19/08/336001908.db2.gz	CIZYJKRCLSROMG-UHFFFAOYSA-N	0	0	295.386	4.115	20	30		CIEDRN
Cc1nc(N2CCC[C@@H]3CCCC[C@H]32)c(Cl)cc1C#N	ZINC000380605547	336004315	/nfs/dbraw/zinc/00/43/15/336004315.db2.gz	CVPSXPZDGHGOBF-SWLSCSKDSA-N	0	0	289.810	4.074	20	30		CIEDRN
C=CCCCCCNc1cccc(NC(C)=O)c1C	ZINC000195447530	336053872	/nfs/dbraw/zinc/05/38/72/336053872.db2.gz	QHROUWHUIOEUDA-UHFFFAOYSA-N	0	0	260.381	4.112	20	30		CIEDRN
N#Cc1ccc(NC[C@H]2CCCCC2(F)F)cc1Cl	ZINC000381457934	336064636	/nfs/dbraw/zinc/06/46/36/336064636.db2.gz	AAPQJSDKBMVETL-LLVKDONJSA-N	0	0	284.737	4.449	20	30		CIEDRN
N#Cc1ccc(Cl)cc1OC[C@H]1CCCCC1(F)F	ZINC000382186923	336084155	/nfs/dbraw/zinc/08/41/55/336084155.db2.gz	QXGKWPCBJNARAX-LLVKDONJSA-N	0	0	285.721	4.416	20	30		CIEDRN
N#CCCC1CCN(C(=O)c2cccc(C3CCC3)c2)CC1	ZINC000581550313	336101000	/nfs/dbraw/zinc/10/10/00/336101000.db2.gz	VQPVVNIJLGRALX-UHFFFAOYSA-N	0	0	296.414	4.110	20	30		CIEDRN
Cc1ccccc1-c1cccc(CNCC2(C#N)CC2)c1	ZINC000581585001	336106893	/nfs/dbraw/zinc/10/68/93/336106893.db2.gz	VUNAMVRTDDCSCU-UHFFFAOYSA-N	0	0	276.383	4.055	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)[C@H](CC)OCC	ZINC000581772937	336145449	/nfs/dbraw/zinc/14/54/49/336145449.db2.gz	UQGJWXIVQTWZGO-INIZCTEOSA-N	0	0	289.419	4.292	20	30		CIEDRN
Cc1nc(Oc2cc(Cl)ccc2Cl)ccc1C#N	ZINC000385480930	336148696	/nfs/dbraw/zinc/14/86/96/336148696.db2.gz	FXHUYQDWSIJEKG-UHFFFAOYSA-N	0	0	279.126	4.361	20	30		CIEDRN
CC(C)c1ccc([C@H]2CCCN2c2cc(C#N)ccn2)cc1	ZINC000581901391	336163523	/nfs/dbraw/zinc/16/35/23/336163523.db2.gz	ROCPUYZDWXGILZ-GOSISDBHSA-N	0	0	291.398	4.418	20	30		CIEDRN
N#Cc1ccc(CNc2cccc3ccsc32)cc1	ZINC000386338007	336171255	/nfs/dbraw/zinc/17/12/55/336171255.db2.gz	RFHNILFLINQKHV-UHFFFAOYSA-N	0	0	264.353	4.385	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)[C@H]2CC3CCC2CC3)cc1	ZINC000582017723	336192932	/nfs/dbraw/zinc/19/29/32/336192932.db2.gz	ZNLOHRJPFCNSFQ-KVULBXGLSA-N	0	0	296.414	4.253	20	30		CIEDRN
C[C@H](CC1CCCCC1)NC(=O)Cc1ccc2n[nH]cc2c1	ZINC000330095483	533774143	/nfs/dbraw/zinc/77/41/43/533774143.db2.gz	VOIQBJCTRVHGHT-CYBMUJFWSA-N	0	0	299.418	4.421	20	30		CIEDRN
COc1cccc2c1CC[C@H]2Nc1ccc(C#N)c(Cl)c1	ZINC000301641746	533874651	/nfs/dbraw/zinc/87/46/51/533874651.db2.gz	MKOYFMDFOFXLRN-MRXNPFEDSA-N	0	0	298.773	4.320	20	30		CIEDRN
Cc1c2ccccc2oc1[C@@H](C)NC(=O)C[C@@H]1CCOC1	ZINC000330033849	533978824	/nfs/dbraw/zinc/97/88/24/533978824.db2.gz	ANVAJAOYGTYNNX-OLZOCXBDSA-N	0	0	287.359	4.185	20	30		CIEDRN
C[C@@H](SCc1ccc(F)cn1)c1ccc(C#N)cc1	ZINC000344788113	533998115	/nfs/dbraw/zinc/99/81/15/533998115.db2.gz	DJNQRCUFUHBPRX-LLVKDONJSA-N	0	0	272.348	4.087	20	30		CIEDRN
C[C@H](Nc1ccc(C#N)nc1)c1cccc2ccccc21	ZINC000301499753	534020383	/nfs/dbraw/zinc/02/03/83/534020383.db2.gz	AFAHLOSKNVHTRL-ZDUSSCGKSA-N	0	0	273.339	4.280	20	30		CIEDRN
Cc1ccc(-c2ncc[nH]2)cc1NC(=O)[C@H]1C[C@H]1C1CC1	ZINC000330050162	534218970	/nfs/dbraw/zinc/21/89/70/534218970.db2.gz	KGCQHGLYAXMDHV-KBPBESRZSA-N	0	0	281.359	4.019	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)CCc1ccc(C)cc1C	ZINC000540535341	517324889	/nfs/dbraw/zinc/32/48/89/517324889.db2.gz	HRBFRCVLKGYJBD-MRXNPFEDSA-N	0	0	273.420	4.097	20	30		CIEDRN
C=CCCC1(C(=O)N2CCC(CCC(C)C)CC2)CC1	ZINC000476339077	517320912	/nfs/dbraw/zinc/32/09/12/517320912.db2.gz	ZRTPNPYFZSWUIM-UHFFFAOYSA-N	0	0	277.452	4.408	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H](C)c2nc(C)cs2)CCCCC1	ZINC000448885558	517323761	/nfs/dbraw/zinc/32/37/61/517323761.db2.gz	MMTHGCCMVXPGNI-ZDUSSCGKSA-N	0	0	292.448	4.155	20	30		CIEDRN
C=CCN(C(=O)c1ccc(Cl)cc1C)c1ccccc1	ZINC000532690032	517330641	/nfs/dbraw/zinc/33/06/41/517330641.db2.gz	SBUDFXPASCFGGJ-UHFFFAOYSA-N	0	0	285.774	4.481	20	30		CIEDRN
Cc1noc(C)c1C(C)(C)NC(=O)[C@@H]1CC12CCCC2	ZINC000329176743	534323493	/nfs/dbraw/zinc/32/34/93/534323493.db2.gz	CAUQIWNKIMFKIZ-LBPRGKRZSA-N	0	0	276.380	4.063	20	30		CIEDRN
O=C(Nc1nnc(-c2ccccc2)s1)[C@H]1CC12CCCC2	ZINC000329999862	534334641	/nfs/dbraw/zinc/33/46/41/534334641.db2.gz	VLYBVNPCGJBOOU-GFCCVEGCSA-N	0	0	299.399	4.373	20	30		CIEDRN
CC(C)c1cc(NCc2ccc(F)c(C#N)c2Cl)no1	ZINC000278423240	519833445	/nfs/dbraw/zinc/83/34/45/519833445.db2.gz	GFRUVXUPHMQVBM-UHFFFAOYSA-N	0	0	293.729	4.074	20	30		CIEDRN
CCC[C@@H](NC(=O)Nc1ccc(C#N)cc1)c1ccccc1	ZINC000338313546	520743577	/nfs/dbraw/zinc/74/35/77/520743577.db2.gz	GNNLXMHRRJAKKR-QGZVFWFLSA-N	0	0	293.370	4.221	20	30		CIEDRN
CCCC[C@@H](C)C(=O)N1CC=C(c2ccc(C#N)cc2)CC1	ZINC000374415722	520986426	/nfs/dbraw/zinc/98/64/26/520986426.db2.gz	OKTDQZRMSGZILJ-OAHLLOKOSA-N	0	0	296.414	4.000	20	30		CIEDRN
Cc1oc2ccc(NC(=O)[C@]3(C)CCCOC3)cc2c1C	ZINC000330066579	534550240	/nfs/dbraw/zinc/55/02/40/534550240.db2.gz	SZMGDNRPGYWTCN-QGZVFWFLSA-N	0	0	287.359	4.454	20	30		CIEDRN
CCN(Cc1cccnc1Cl)[C@@H](C)c1ccc(C#N)cc1	ZINC000263806039	521398816	/nfs/dbraw/zinc/39/88/16/521398816.db2.gz	RTLJQXDVPLPEJX-ZDUSSCGKSA-N	0	0	299.805	4.190	20	30		CIEDRN
N#CCCCNc1ncnc2sc(-c3ccccc3)cc21	ZINC000343588263	534614791	/nfs/dbraw/zinc/61/47/91/534614791.db2.gz	FRRQYWGPBKJSRM-UHFFFAOYSA-N	0	0	294.383	4.074	20	30		CIEDRN
Cc1nc2cc(NC3CCC(C)(C#N)CC3)ccc2o1	ZINC000336208387	534644299	/nfs/dbraw/zinc/64/42/99/534644299.db2.gz	GRLWNEBEAFSUPH-UHFFFAOYSA-N	0	0	269.348	4.021	20	30		CIEDRN
Cc1cnc([C@H](C)Sc2ccc(C#N)cc2Cl)cn1	ZINC000336547552	534661559	/nfs/dbraw/zinc/66/15/59/534661559.db2.gz	LBXDJJXELYSSFV-JTQLQIEISA-N	0	0	289.791	4.163	20	30		CIEDRN
Cc1cnc([C@H](Nc2cccc(F)c2C#N)C2CC2)s1	ZINC000301374863	534664449	/nfs/dbraw/zinc/66/44/49/534664449.db2.gz	VIYPKNXGBNNSCL-CQSZACIVSA-N	0	0	287.363	4.026	20	30		CIEDRN
CCc1noc([C@@H](C)S[C@H](C)c2cccc(C#N)c2)n1	ZINC000190906329	522911190	/nfs/dbraw/zinc/91/11/90/522911190.db2.gz	ZFBZDKLTXSBRAS-GHMZBOCLSA-N	0	0	287.388	4.059	20	30		CIEDRN
CCc1noc([C@H](C)S[C@H](C)c2cccc(C#N)c2)n1	ZINC000190906344	522917451	/nfs/dbraw/zinc/91/74/51/522917451.db2.gz	ZFBZDKLTXSBRAS-MNOVXSKESA-N	0	0	287.388	4.059	20	30		CIEDRN
CC[C@@H](Nc1ccc(OC)c(OC)c1)c1ccc(C#N)cc1	ZINC000278387681	522958532	/nfs/dbraw/zinc/95/85/32/522958532.db2.gz	DOPVTNGFYRJIFC-MRXNPFEDSA-N	0	0	296.370	4.139	20	30		CIEDRN
CC[C@@H](Nc1cccc(F)c1C#N)c1nc(C)cs1	ZINC000264244603	522960630	/nfs/dbraw/zinc/96/06/30/522960630.db2.gz	KCBWOPOABKRPTD-GFCCVEGCSA-N	0	0	275.352	4.026	20	30		CIEDRN
N#CCc1cccc(NC(=O)N2CCCC23CCCCC3)c1	ZINC000333058946	534731924	/nfs/dbraw/zinc/73/19/24/534731924.db2.gz	CXMZRUHQXNNBCN-UHFFFAOYSA-N	0	0	297.402	4.083	20	30		CIEDRN
CN(C(=O)CC1CCC(C)(C)CC1)c1ccccc1C#N	ZINC000337886283	523796139	/nfs/dbraw/zinc/79/61/39/523796139.db2.gz	WEWJHQCTABNYNH-UHFFFAOYSA-N	0	0	284.403	4.128	20	30		CIEDRN
CCc1cccc(CC)c1NC(=O)c1ccc(F)c(C#N)c1	ZINC000341013542	524069032	/nfs/dbraw/zinc/06/90/32/524069032.db2.gz	PIPOYIMTMLPAFS-UHFFFAOYSA-N	0	0	296.345	4.074	20	30		CIEDRN
C[C@H]1CCC[C@@H](CCn2cc(C#N)c(=O)c3ccccc32)C1	ZINC000338404539	524133111	/nfs/dbraw/zinc/13/31/11/524133111.db2.gz	AMIAXFBBHGRDFW-GJZGRUSLSA-N	0	0	294.398	4.090	20	30		CIEDRN
Cc1cccc(CNc2ccc(Cl)cc2C#N)c1	ZINC000052857220	524443496	/nfs/dbraw/zinc/44/34/96/524443496.db2.gz	OHMYFDOAKNWLPN-UHFFFAOYSA-N	0	0	256.736	4.132	20	30		CIEDRN
N#Cc1ccc(NC[C@@H]2CCCO[C@@H]2c2ccccc2)cc1	ZINC000301126353	534795406	/nfs/dbraw/zinc/79/54/06/534795406.db2.gz	QEQWYHRSMQPBER-PKOBYXMFSA-N	0	0	292.382	4.138	20	30		CIEDRN
N#Cc1ccc(SCc2noc(C3CCCCC3)n2)cc1	ZINC000332630927	534799093	/nfs/dbraw/zinc/79/90/93/534799093.db2.gz	DNMHREBDGQJKMK-UHFFFAOYSA-N	0	0	299.399	4.281	20	30		CIEDRN
C[C@H](Cc1ccsc1)Nc1cc(Cl)ccc1C#N	ZINC000062785396	524763645	/nfs/dbraw/zinc/76/36/45/524763645.db2.gz	BAMJZXVCSSAUMQ-SNVBAGLBSA-N	0	0	276.792	4.316	20	30		CIEDRN
N#Cc1cnccc1/C=C\c1ncc(-c2ccccc2)s1	ZINC000349105807	534827970	/nfs/dbraw/zinc/82/79/70/534827970.db2.gz	HLPOOWHIAMAUDQ-SREVYHEPSA-N	0	0	289.363	4.247	20	30		CIEDRN
Cc1ccccc1[C@H](CC(C)C)NC(=O)CC(C)(C)C#N	ZINC000353470456	534837090	/nfs/dbraw/zinc/83/70/90/534837090.db2.gz	KKCYUMYZLHMVPM-INIZCTEOSA-N	0	0	286.419	4.138	20	30		CIEDRN
C[C@]1(CNc2c(C#N)cccc2C#N)C[C@@H]1c1ccccc1	ZINC000338741193	525270173	/nfs/dbraw/zinc/27/01/73/525270173.db2.gz	NSVCENRTDVXGNH-IEBWSBKVSA-N	0	0	287.366	4.036	20	30		CIEDRN
Cc1ccccc1[C@H](C)N(C)C(=O)c1cccc(C#N)c1C	ZINC000337903612	525405918	/nfs/dbraw/zinc/40/59/18/525405918.db2.gz	SJJCEMBUIHQZSX-HNNXBMFYSA-N	0	0	292.382	4.008	20	30		CIEDRN
C[C@@H](Nc1ncc(C#N)cc1Cl)c1ccc(F)cc1F	ZINC000339244006	525727761	/nfs/dbraw/zinc/72/77/61/525727761.db2.gz	TYYFUDOHXLHEOJ-MRVPVSSYSA-N	0	0	293.704	4.058	20	30		CIEDRN
C[C@@]1(CNc2c(C#N)cccc2C#N)C[C@@H]1c1ccccc1	ZINC000338741196	525851188	/nfs/dbraw/zinc/85/11/88/525851188.db2.gz	NSVCENRTDVXGNH-MJGOQNOKSA-N	0	0	287.366	4.036	20	30		CIEDRN
Cc1ccc([C@H](C)Nc2c(F)cc(C#N)cc2F)s1	ZINC000111143742	525948514	/nfs/dbraw/zinc/94/85/14/525948514.db2.gz	QJYCPFVGLNTPBE-VIFPVBQESA-N	0	0	278.327	4.380	20	30		CIEDRN
C[C@H](SCc1nccn1C(F)F)c1ccc(C#N)cc1	ZINC000083633702	525983998	/nfs/dbraw/zinc/98/39/98/525983998.db2.gz	WLKMCGOEXDMUAZ-JTQLQIEISA-N	0	0	293.342	4.144	20	30		CIEDRN
Cc1cc(C#N)ccc1Oc1ncnc2cc(Cl)ccc21	ZINC000261391545	526193448	/nfs/dbraw/zinc/19/34/48/526193448.db2.gz	IKQSNMMQLDMKMJ-UHFFFAOYSA-N	0	0	295.729	4.256	20	30		CIEDRN
Cc1cnccc1S[C@@H](C)c1cccc(C#N)c1	ZINC000338622077	526245178	/nfs/dbraw/zinc/24/51/78/526245178.db2.gz	ASRMKHGFGCJVRU-LBPRGKRZSA-N	0	0	254.358	4.115	20	30		CIEDRN
Cc1csc(NC(=O)c2cccc(C(F)F)c2)c1C#N	ZINC000335142513	526393172	/nfs/dbraw/zinc/39/31/72/526393172.db2.gz	QTBQTRYKMKTXFC-UHFFFAOYSA-N	0	0	292.310	4.118	20	30		CIEDRN
N#Cc1c(F)cccc1NCc1ccc(Cl)cc1F	ZINC000157227425	526524897	/nfs/dbraw/zinc/52/48/97/526524897.db2.gz	QNBFWGHAUUFLKW-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
N#Cc1c(F)cccc1Oc1nc2ccccc2s1	ZINC000301867670	526526179	/nfs/dbraw/zinc/52/61/79/526526179.db2.gz	VVKIBATURJKFOI-UHFFFAOYSA-N	0	0	270.288	4.099	20	30		CIEDRN
N#Cc1cc(F)ccc1NCc1ccc(Cl)cc1F	ZINC000157228230	526562510	/nfs/dbraw/zinc/56/25/10/526562510.db2.gz	FKRPIRFLWHWZLU-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
Cc1noc(C)c1[C@@H](C)CNc1ccc(C#N)c(Cl)c1	ZINC000129586295	526565227	/nfs/dbraw/zinc/56/52/27/526565227.db2.gz	NIAZOFSIKNYZKW-VIFPVBQESA-N	0	0	289.766	4.032	20	30		CIEDRN
N#Cc1ccc(CNc2ccccc2N2CCCCCC2)o1	ZINC000127151026	526629270	/nfs/dbraw/zinc/62/92/70/526629270.db2.gz	FBHBXAOWZQLBKG-UHFFFAOYSA-N	0	0	295.386	4.144	20	30		CIEDRN
N#Cc1ccc(NCc2ccc(F)cc2F)c(Cl)c1	ZINC000062791171	526663626	/nfs/dbraw/zinc/66/36/26/526663626.db2.gz	PQIBNPGESJGZEX-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
N#Cc1ccc(NCc2cccc(-c3ccccn3)c2)cc1	ZINC000164223234	526664562	/nfs/dbraw/zinc/66/45/62/526664562.db2.gz	QMBLFZUEDDIWGR-UHFFFAOYSA-N	0	0	285.350	4.232	20	30		CIEDRN
N#Cc1ccc(N[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc1	ZINC000273323055	526668114	/nfs/dbraw/zinc/66/81/14/526668114.db2.gz	PREPDSXLTJZEFP-ZWKOTPCHSA-N	0	0	296.345	4.030	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCCCC[C@H]1c1ccco1	ZINC000185850462	526693853	/nfs/dbraw/zinc/69/38/53/526693853.db2.gz	WACNVAYPIUXNBE-CABCVRRESA-N	0	0	275.392	4.326	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1c(C)cccc1OC(F)F	ZINC000185590043	526713989	/nfs/dbraw/zinc/71/39/89/526713989.db2.gz	ZWCOUFVIMGLPEZ-NSHDSACASA-N	0	0	283.318	4.137	20	30		CIEDRN
N#Cc1cccc(NCc2cccc(C(F)F)c2)c1	ZINC000155964371	526724164	/nfs/dbraw/zinc/72/41/64/526724164.db2.gz	MPAGFTGPRZQPSL-UHFFFAOYSA-N	0	0	258.271	4.108	20	30		CIEDRN
N#Cc1cccc(Nc2ccc3nc(C4CC4)sc3c2)n1	ZINC000339220353	526724171	/nfs/dbraw/zinc/72/41/71/526724171.db2.gz	XUTOJDFKDQCHMC-UHFFFAOYSA-N	0	0	292.367	4.184	20	30		CIEDRN
N#Cc1cccc(SCc2ccc(C(F)(F)F)cn2)c1	ZINC000340694217	526732117	/nfs/dbraw/zinc/73/21/17/526732117.db2.gz	DRPDDUOVTFKGIU-UHFFFAOYSA-N	0	0	294.301	4.264	20	30		CIEDRN
N#Cc1nc(Sc2ccc(F)c(F)c2)ccc1Cl	ZINC000301495858	526788594	/nfs/dbraw/zinc/78/85/94/526788594.db2.gz	AVNBPKPLFISISS-UHFFFAOYSA-N	0	0	282.702	4.036	20	30		CIEDRN
C=CC(C)(C)C(=O)N1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2	ZINC000295926178	526943189	/nfs/dbraw/zinc/94/31/89/526943189.db2.gz	ICAAZQZZUUHVOE-BJWYYQGGSA-N	0	0	283.415	4.136	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@@H](CC1CCC1)c1ccccc1	ZINC000352153688	527025964	/nfs/dbraw/zinc/02/59/64/527025964.db2.gz	OOHMQZXTXJICBH-PBHICJAKSA-N	0	0	286.419	4.182	20	30		CIEDRN
C=CCCC1(C(=O)NC[C@@]2(C)C[C@@H]2c2ccccc2)CC1	ZINC000355002888	527088669	/nfs/dbraw/zinc/08/86/69/527088669.db2.gz	RSSODOQDCGHRTA-SJLPKXTDSA-N	0	0	283.415	4.043	20	30		CIEDRN
C=CCCC1(C(=O)N[C@@H](C)c2cc(C)sc2C)CC1	ZINC000354398078	527093447	/nfs/dbraw/zinc/09/34/47/527093447.db2.gz	YYCKAUCEJCNFCT-LBPRGKRZSA-N	0	0	277.433	4.289	20	30		CIEDRN
C=CCCCCNC(=O)c1[nH]c2ccc(F)cc2c1Cl	ZINC000354125096	527166049	/nfs/dbraw/zinc/16/60/49/527166049.db2.gz	QJSMDGBKFABQAG-UHFFFAOYSA-N	0	0	294.757	4.047	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(N(C)Cc2cccc(Cl)c2)c1	ZINC000302036882	527223609	/nfs/dbraw/zinc/22/36/09/527223609.db2.gz	PPHOGQMMVRLYAP-UHFFFAOYSA-N	0	0	298.773	4.051	20	30		CIEDRN
C=CC[C@H]1N(C(=O)c2ccc(C#N)cc2C)CCCC1(C)C	ZINC000347423039	527226741	/nfs/dbraw/zinc/22/67/41/527226741.db2.gz	GAMLIAVGALMLIU-QGZVFWFLSA-N	0	0	296.414	4.074	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](CCC)OC	ZINC000296085878	527259245	/nfs/dbraw/zinc/25/92/45/527259245.db2.gz	CTLKZSCXXGZSGI-MRXNPFEDSA-N	0	0	289.419	4.292	20	30		CIEDRN
C=CCC[C@@H](NC(=O)c1ccncc1CC)c1ccccc1	ZINC000348015511	527446245	/nfs/dbraw/zinc/44/62/45/527446245.db2.gz	MTWYLDRLSSBBCE-GOSISDBHSA-N	0	0	294.398	4.081	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1c(C)cc(C)cc1C	ZINC000334857049	527451506	/nfs/dbraw/zinc/45/15/06/527451506.db2.gz	JNDUAYCBZZISBT-OAHLLOKOSA-N	0	0	272.392	4.184	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N(C)c1ccc(OC(C)C)cc1	ZINC000191589253	527519040	/nfs/dbraw/zinc/51/90/40/527519040.db2.gz	RPGZJNUNBGYMLP-KRWDZBQOSA-N	0	0	275.392	4.039	20	30		CIEDRN
CC(C)CCN(CCC#N)Cc1ccc(OC(F)F)cc1	ZINC000353414583	527715036	/nfs/dbraw/zinc/71/50/36/527715036.db2.gz	BMYZCLPYXRIIJU-UHFFFAOYSA-N	0	0	296.361	4.050	20	30		CIEDRN
CC(C)CCN(CCC#N)Cc1cccc(OC(F)F)c1	ZINC000353417323	527716420	/nfs/dbraw/zinc/71/64/20/527716420.db2.gz	STFGRTNLUOECNU-UHFFFAOYSA-N	0	0	296.361	4.050	20	30		CIEDRN
CC(C)CC[C@H](NC(=O)[C@H](C)C#N)c1ccc(Cl)cc1	ZINC000347085534	527846395	/nfs/dbraw/zinc/84/63/95/527846395.db2.gz	ZSHQSZBBOIUUBQ-DOMZBBRYSA-N	0	0	292.810	4.093	20	30		CIEDRN
CC1(CCNC(=O)C2CCC(NC(=O)C3CC3)CC2)CC1	ZINC000330094693	527920316	/nfs/dbraw/zinc/92/03/16/527920316.db2.gz	UBOGHPWXOLQQDQ-UHFFFAOYSA-N	0	0	292.423	4.058	20	30		CIEDRN
CC1CCC(C)(NC(=O)Cc2ccc3c[nH]nc3c2)CC1	ZINC000330081578	528165360	/nfs/dbraw/zinc/16/53/60/528165360.db2.gz	KATZKJTXXHHDGC-UHFFFAOYSA-N	0	0	285.391	4.031	20	30		CIEDRN
CCC(C)(C)C1CCC2(C[C@H]2C(=O)NCCCC#N)CC1	ZINC000354612243	528492169	/nfs/dbraw/zinc/49/21/69/528492169.db2.gz	KROJPHPRDNEJGA-CSLYMUCUSA-N	0	0	290.451	4.039	20	30		CIEDRN
CCOc1ccc(N[C@@H](C)c2ccc(OCC#N)cc2)cc1	ZINC000192909993	528554984	/nfs/dbraw/zinc/55/49/84/528554984.db2.gz	NNURZWOJQNPGRE-AWEZNQCLSA-N	0	0	296.370	4.161	20	30		CIEDRN
CCC(CC)[C@H]1C[C@H](Nc2cccc(F)c2C#N)CCO1	ZINC000302043797	528873541	/nfs/dbraw/zinc/87/35/41/528873541.db2.gz	MHYGCJXGNKNUCO-CXAGYDPISA-N	0	0	290.382	4.093	20	30		CIEDRN
CC1(C)CC(C(=O)Nc2cccc([C@H]3CNC(=O)C3)c2)C1	ZINC000329176467	528882455	/nfs/dbraw/zinc/88/24/55/528882455.db2.gz	MLAVCBHCDJFDPC-GFCCVEGCSA-N	0	0	286.375	4.155	20	30		CIEDRN
CC1(C)CC(C(=O)Nc2cc(C#N)ccc2NC2CC2)C1	ZINC000329127853	528882695	/nfs/dbraw/zinc/88/26/95/528882695.db2.gz	VAJRRNHFXVPJTR-UHFFFAOYSA-N	0	0	283.375	4.157	20	30		CIEDRN
CC1(C)CC[C@H](C(=O)N[C@@H](CCCC#N)c2ccccc2)C1	ZINC000352218730	529036260	/nfs/dbraw/zinc/03/62/60/529036260.db2.gz	NPBCBWXYBUUQPK-IRXDYDNUSA-N	0	0	298.430	4.364	20	30		CIEDRN
CCSCC[C@@H](C)N(C)c1cc(C#N)nc2ccccc21	ZINC000301743563	529184657	/nfs/dbraw/zinc/18/46/57/529184657.db2.gz	MMKIWMUGKUIMEJ-CYBMUJFWSA-N	0	0	299.443	4.074	20	30		CIEDRN
CCSCC[C@H](C)Nc1cc(C#N)nc2ccccc21	ZINC000301756217	529195299	/nfs/dbraw/zinc/19/52/99/529195299.db2.gz	KXXHZEMZBZKXAD-LBPRGKRZSA-N	0	0	285.416	4.050	20	30		CIEDRN
CCSCC[C@H](C)Nc1ccc2cc(C#N)ccc2n1	ZINC000301972102	529195514	/nfs/dbraw/zinc/19/55/14/529195514.db2.gz	HGEXKAOTNPOYLR-LBPRGKRZSA-N	0	0	285.416	4.050	20	30		CIEDRN
CCSCc1ccccc1C(=O)Nc1cccc(C#N)c1	ZINC000344330044	529201556	/nfs/dbraw/zinc/20/15/56/529201556.db2.gz	YPKLMEGGYNERQY-UHFFFAOYSA-N	0	0	296.395	4.064	20	30		CIEDRN
N#Cc1ccc(NC[C@H]2CC[C@H](c3ccccc3)O2)c(F)c1	ZINC000573282222	334924251	/nfs/dbraw/zinc/92/42/51/334924251.db2.gz	VNTUJOGMLLYDJC-CRAIPNDOSA-N	0	0	296.345	4.030	20	30		CIEDRN
CC[C@@H](C)n1ncc(N[C@H]2CCc3ccc(C#N)cc32)c1C	ZINC000353619664	529444031	/nfs/dbraw/zinc/44/40/31/529444031.db2.gz	CXEGTVCPGGUYMG-PXAZEXFGSA-N	0	0	294.402	4.134	20	30		CIEDRN
CC[C@@]1(C)C[C@H]1C(=O)Nc1cc(C#N)ccc1NC1CC1	ZINC000329078744	529537546	/nfs/dbraw/zinc/53/75/46/529537546.db2.gz	BRPBRBRGOPHRLM-GUYCJALGSA-N	0	0	283.375	4.157	20	30		CIEDRN
CC[C@H](NC(=O)C[C@H]1CCCC(=O)N1)c1ccc(C)cc1	ZINC000329435343	529579226	/nfs/dbraw/zinc/57/92/26/529579226.db2.gz	ITPRRGVLEXGSKM-CABCVRRESA-N	0	0	288.391	4.302	20	30		CIEDRN
CC[C@@H](NC(=O)c1cccc(C#N)c1)c1cccc(Cl)c1	ZINC000344615394	529672446	/nfs/dbraw/zinc/67/24/46/529672446.db2.gz	HTVDCWAKTAYGQC-MRXNPFEDSA-N	0	0	298.773	4.093	20	30		CIEDRN
CCc1nc(C)c(C(=O)N[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)o1	ZINC000330313342	529717332	/nfs/dbraw/zinc/71/73/32/529717332.db2.gz	XDHDZCMIVSUFHY-BFHYXJOUSA-N	0	0	290.407	4.209	20	30		CIEDRN
CCc1nc([C@H](C)Nc2ccc(C#N)c(Cl)c2)cs1	ZINC000301250650	529746995	/nfs/dbraw/zinc/74/69/95/529746995.db2.gz	MKVSZLRQZTTYMU-VIFPVBQESA-N	0	0	291.807	4.404	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N[C@@H](C)c1ccc(F)cc1F	ZINC000573587275	334949663	/nfs/dbraw/zinc/94/96/63/334949663.db2.gz	AKXJFSMPUHPIGO-NEPJUHHUSA-N	0	0	296.361	4.070	20	30		CIEDRN
C=C(C)CCNc1ccccc1O[C@H](C)C(F)(F)F	ZINC000573839938	334970722	/nfs/dbraw/zinc/97/07/22/334970722.db2.gz	HHFZUBFFSNGPBQ-LLVKDONJSA-N	0	0	273.298	4.394	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cc(C)ccc2C)n1	ZINC000518228523	260359818	/nfs/dbraw/zinc/35/98/18/260359818.db2.gz	QOYXMKBPIPMZHN-UHFFFAOYSA-N	0	0	256.349	4.207	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)CC[C@H](C)SC	ZINC000410345828	260487855	/nfs/dbraw/zinc/48/78/55/260487855.db2.gz	RMFVFDJFHOXBKH-ZDUSSCGKSA-N	0	0	277.433	4.275	20	30		CIEDRN
N#Cc1cc(F)c(NCc2c(F)cccc2Cl)c(F)c1	ZINC000500491457	541326124	/nfs/dbraw/zinc/32/61/24/541326124.db2.gz	NNRNFQZPDIAAHN-UHFFFAOYSA-N	0	0	296.679	4.241	20	30		CIEDRN
C=CCCCC(=O)Nc1cc(C)c(F)cc1Cl	ZINC000574194223	334999637	/nfs/dbraw/zinc/99/96/37/334999637.db2.gz	WVMHEXFLIIYOCE-UHFFFAOYSA-N	0	0	255.720	4.082	20	30		CIEDRN
Cc1csc(CSCCCC(C)(C)C#N)n1	ZINC000161939604	261263490	/nfs/dbraw/zinc/26/34/90/261263490.db2.gz	GDVFBKYTRXPVKU-UHFFFAOYSA-N	0	0	254.424	4.015	20	30		CIEDRN
CN(Cc1ccccc1F)c1cccc(C(F)F)c1C#N	ZINC000574443796	335019990	/nfs/dbraw/zinc/01/99/90/335019990.db2.gz	OVGWUGBUGQMOAN-UHFFFAOYSA-N	0	0	290.288	4.271	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1ccc(OC(C)C)cc1C	ZINC000574452103	335020733	/nfs/dbraw/zinc/02/07/33/335020733.db2.gz	ZNABLDSFCUIBPQ-CQSZACIVSA-N	0	0	290.407	4.258	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(C)c(OC)cc1Cl	ZINC000574673375	335038558	/nfs/dbraw/zinc/03/85/58/335038558.db2.gz	LQNWQKWIMUUWIB-NSHDSACASA-N	0	0	281.783	4.198	20	30		CIEDRN
Cc1csc(NC(=O)c2ccc(C)c(Cl)c2)c1C#N	ZINC000574675214	335038879	/nfs/dbraw/zinc/03/88/79/335038879.db2.gz	KLBWTIZVSRSCBI-UHFFFAOYSA-N	0	0	290.775	4.142	20	30		CIEDRN
C=CCCC(=O)N1[C@H](C)CCC[C@@H]1c1ccccc1	ZINC000364177135	262180265	/nfs/dbraw/zinc/18/02/65/262180265.db2.gz	YBSCZRCDEDWTLG-GDBMZVCRSA-N	0	0	257.377	4.095	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1c(C)cccc1C(C)C	ZINC000116997095	260019569	/nfs/dbraw/zinc/01/95/69/260019569.db2.gz	RVWCLVYCBPYMKN-ZDUSSCGKSA-N	0	0	260.381	4.205	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC)[C@@H](C)Cc1ccsc1	ZINC000186337803	262313883	/nfs/dbraw/zinc/31/38/83/262313883.db2.gz	PNNFMSVZSQUYPB-AWEZNQCLSA-N	0	0	291.460	4.296	20	30		CIEDRN
C=CCCCSc1nnc(COc2ccc(C)cc2)o1	ZINC000117550943	260035763	/nfs/dbraw/zinc/03/57/63/260035763.db2.gz	QBAKLNZBOWQRPE-UHFFFAOYSA-N	0	0	290.388	4.015	20	30		CIEDRN
C=CCCCS[C@@H](C)C(=O)Nc1cccc(C)c1C	ZINC000522756901	262338570	/nfs/dbraw/zinc/33/85/70/262338570.db2.gz	MOELGYRYXCDECI-AWEZNQCLSA-N	0	0	277.433	4.330	20	30		CIEDRN
N#C[C@H]1CC[C@H](Nc2cc(Cl)cc(Cl)c2)C1	ZINC000390776567	262345073	/nfs/dbraw/zinc/34/50/73/262345073.db2.gz	FYCGPQGZWSJZDT-KWQFWETISA-N	0	0	255.148	4.098	20	30		CIEDRN
C[C@@H](Nc1ncccc1C#N)c1cc2ccccc2s1	ZINC000301213362	533566624	/nfs/dbraw/zinc/56/66/24/533566624.db2.gz	YNISJNOLFFQVIO-LLVKDONJSA-N	0	0	279.368	4.341	20	30		CIEDRN
N#Cc1ccc2c(c1)CCC[C@@H]2NCc1c(F)cccc1F	ZINC000341829339	130061454	/nfs/dbraw/zinc/06/14/54/130061454.db2.gz	UJPZHINRNNGOAI-SFHVURJKSA-N	0	0	298.336	4.004	20	30		CIEDRN
C[C@@H](SCCCOc1cccc(C#N)c1)c1cccnc1	ZINC000341933625	130143107	/nfs/dbraw/zinc/14/31/07/130143107.db2.gz	XMLMDANRUAXEPJ-CQSZACIVSA-N	0	0	298.411	4.217	20	30		CIEDRN
Cc1nc2sc(-c3ccccc3)cc2c(SCC#N)n1	ZINC000005212818	170076705	/nfs/dbraw/zinc/07/67/05/170076705.db2.gz	YQEZJAURGIUNOW-UHFFFAOYSA-N	0	0	297.408	4.282	20	30		CIEDRN
N#Cc1cc([N+](=O)[O-])ccc1Oc1ccc2ccccc2c1	ZINC000008147619	170321423	/nfs/dbraw/zinc/32/14/23/170321423.db2.gz	OYYCJCWUEKGWAD-UHFFFAOYSA-N	0	0	290.278	4.412	20	30		CIEDRN
N#Cc1ccc(F)c(CSc2ccc3c(c2)CCC3)c1	ZINC000011537081	170420032	/nfs/dbraw/zinc/42/00/32/170420032.db2.gz	MQLBZWBUNOFNNA-UHFFFAOYSA-N	0	0	283.371	4.478	20	30		CIEDRN
CC[C@H](C)[C@H](C(=O)Nc1ccc(C#N)cc1)c1ccccc1	ZINC000014908346	170648301	/nfs/dbraw/zinc/64/83/01/170648301.db2.gz	RCUSTUHAOYMIJM-KSSFIOAISA-N	0	0	292.382	4.327	20	30		CIEDRN
C[C@@H](Nc1cc(C#N)ccn1)c1ccc(Cl)cc1Cl	ZINC000019814381	170880438	/nfs/dbraw/zinc/88/04/38/170880438.db2.gz	NTJQJGYMPVVLRT-SECBINFHSA-N	0	0	292.169	4.433	20	30		CIEDRN
N#Cc1cccc(CNc2ccc(Cl)cc2Cl)c1	ZINC000019905535	170917625	/nfs/dbraw/zinc/91/76/25/170917625.db2.gz	TUXBRJNVYZAANH-UHFFFAOYSA-N	0	0	277.154	4.477	20	30		CIEDRN
C[C@H](Nc1ccc2c(c1)CCC2)c1ccc(C#N)cc1	ZINC000019913797	170923925	/nfs/dbraw/zinc/92/39/25/170923925.db2.gz	JQDHDZKOBSFNHD-ZDUSSCGKSA-N	0	0	262.356	4.220	20	30		CIEDRN
C[C@H](Nc1ccc(C#N)cc1)c1ccccc1OC(F)F	ZINC000019951240	170939751	/nfs/dbraw/zinc/93/97/51/170939751.db2.gz	KHQYOAUZBIBWNF-NSHDSACASA-N	0	0	288.297	4.333	20	30		CIEDRN
N#Cc1ccc(F)c(CNc2cccc3c2CCCC3)c1	ZINC000020043497	170976706	/nfs/dbraw/zinc/97/67/06/170976706.db2.gz	PCWVCVFOLBYGHR-UHFFFAOYSA-N	0	0	280.346	4.188	20	30		CIEDRN
C[C@@H](Nc1ccccc1OC(F)F)c1ccc(C#N)cc1	ZINC000020096297	170996096	/nfs/dbraw/zinc/99/60/96/170996096.db2.gz	GLUZHNBOIOEBRW-LLVKDONJSA-N	0	0	288.297	4.333	20	30		CIEDRN
Cc1cc(Oc2ncccc2C#N)cc(C)c1Cl	ZINC000020352312	171156259	/nfs/dbraw/zinc/15/62/59/171156259.db2.gz	QQHOKTDALVQBFP-UHFFFAOYSA-N	0	0	258.708	4.016	20	30		CIEDRN
N#Cc1ccc(CNc2ccc(F)cc2Cl)c(F)c1	ZINC000020362979	171161777	/nfs/dbraw/zinc/16/17/77/171161777.db2.gz	DJBWZURSERNGQE-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
Cc1cc(Cl)ccc1OCc1ccc(C#N)cc1	ZINC000020544909	171243075	/nfs/dbraw/zinc/24/30/75/171243075.db2.gz	WDEHPSLUXAMDGQ-UHFFFAOYSA-N	0	0	257.720	4.099	20	30		CIEDRN
N#Cc1cccc(NCc2c(Cl)cccc2Cl)c1	ZINC000020548727	171245723	/nfs/dbraw/zinc/24/57/23/171245723.db2.gz	ATKSGWUQWRGUOB-UHFFFAOYSA-N	0	0	277.154	4.477	20	30		CIEDRN
CCC(C)(C)c1ccc(Oc2ccc(C#N)cn2)cc1	ZINC000020549420	171246396	/nfs/dbraw/zinc/24/63/96/171246396.db2.gz	WGAFTZGUCIHZQL-UHFFFAOYSA-N	0	0	266.344	4.433	20	30		CIEDRN
Cc1cc(Cl)ccc1NCc1cccc(C#N)c1	ZINC000020566473	171254926	/nfs/dbraw/zinc/25/49/26/171254926.db2.gz	YFFZHJGIMONYQE-UHFFFAOYSA-N	0	0	256.736	4.132	20	30		CIEDRN
N#Cc1ccc(N[C@H](c2ccccc2)c2ccccn2)cc1	ZINC000020828563	171274912	/nfs/dbraw/zinc/27/49/12/171274912.db2.gz	QIPFOQZXSMBIQJ-LJQANCHMSA-N	0	0	285.350	4.155	20	30		CIEDRN
N#Cc1ccccc1NCc1ccc(Cl)c(Cl)c1	ZINC000021512302	171310986	/nfs/dbraw/zinc/31/09/86/171310986.db2.gz	GZHGWTYOZJSKDP-UHFFFAOYSA-N	0	0	277.154	4.477	20	30		CIEDRN
CC(C)c1cccc(OCc2ccc(C#N)cc2F)c1	ZINC000021792481	171324247	/nfs/dbraw/zinc/32/42/47/171324247.db2.gz	YTAGHGSMTNCUIM-UHFFFAOYSA-N	0	0	269.319	4.400	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)c2cccc(Cl)c2)cc1	ZINC000025438120	171458079	/nfs/dbraw/zinc/45/80/79/171458079.db2.gz	HEZQLUSNAJFDDW-UHFFFAOYSA-N	0	0	298.773	4.393	20	30		CIEDRN
C=CCNc1nc(-c2ccc(SC)cc2)cs1	ZINC000025665815	171463681	/nfs/dbraw/zinc/46/36/81/171463681.db2.gz	ZUNCDDDEFRITES-UHFFFAOYSA-N	0	0	262.403	4.130	20	30		CIEDRN
CCCc1sc(C(=O)Nc2ccc(C#N)cc2)cc1CC	ZINC000028312279	171556381	/nfs/dbraw/zinc/55/63/81/171556381.db2.gz	GTKUPKQPACQNDQ-UHFFFAOYSA-N	0	0	298.411	4.387	20	30		CIEDRN
C[C@H](Nc1ccc(C(F)(F)F)cc1C#N)c1ccccn1	ZINC000035695162	172363414	/nfs/dbraw/zinc/36/34/14/172363414.db2.gz	GBPGSHDLDJRWND-JTQLQIEISA-N	0	0	291.276	4.145	20	30		CIEDRN
N#Cc1cc(C(F)(F)F)ccc1NCc1cccs1	ZINC000036667106	172646369	/nfs/dbraw/zinc/64/63/69/172646369.db2.gz	PSMPQOAVUJAYJM-UHFFFAOYSA-N	0	0	282.290	4.251	20	30		CIEDRN
CC[C@@H](C)C[C@@H](CC)Nc1cccc(OCC#N)c1	ZINC000037069608	172931303	/nfs/dbraw/zinc/93/13/03/172931303.db2.gz	FEAFZRCJPNHUSE-ZIAGYGMSSA-N	0	0	260.381	4.216	20	30		CIEDRN
C[C@@H](Nc1ccc(CC#N)cc1)c1ccc(F)c(F)c1	ZINC000037071333	172932028	/nfs/dbraw/zinc/93/20/28/172932028.db2.gz	APIGRHYRZVGSFB-LLVKDONJSA-N	0	0	272.298	4.204	20	30		CIEDRN
C[C@H](Nc1ccc(C#N)c(Cl)c1)c1cccc(O)c1	ZINC000037393248	173173952	/nfs/dbraw/zinc/17/39/52/173173952.db2.gz	AOERAQMTBFSSFL-JTQLQIEISA-N	0	0	272.735	4.090	20	30		CIEDRN
CC(C)C[C@H](C)Nc1cccc(OCCCC#N)c1	ZINC000037777366	173708630	/nfs/dbraw/zinc/70/86/30/173708630.db2.gz	NJSIVCFJZWPUCU-AWEZNQCLSA-N	0	0	260.381	4.216	20	30		CIEDRN
CCCCc1ccc(NC(=O)C2(C#N)CCCC2)cc1	ZINC000044292933	175160497	/nfs/dbraw/zinc/16/04/97/175160497.db2.gz	KFSCTCGQPWRJEC-UHFFFAOYSA-N	0	0	270.376	4.052	20	30		CIEDRN
Cc1ccc([C@@H](C)Nc2ccc(C#N)cc2F)s1	ZINC000044386608	175170244	/nfs/dbraw/zinc/17/02/44/175170244.db2.gz	APUKORHQUYOPBF-SNVBAGLBSA-N	0	0	260.337	4.240	20	30		CIEDRN
C[C@@H](Nc1cccc(OCCCC#N)c1)C(C)(C)C	ZINC000179821273	260076311	/nfs/dbraw/zinc/07/63/11/260076311.db2.gz	NQNMFLCRDAGZOA-CYBMUJFWSA-N	0	0	260.381	4.216	20	30		CIEDRN
N#CC1(CSCc2csc(C3CCCC3)n2)CC1	ZINC000344473391	225068630	/nfs/dbraw/zinc/06/86/30/225068630.db2.gz	LLXCXFAPNJXOSI-UHFFFAOYSA-N	0	0	278.446	4.338	20	30		CIEDRN
Cc1ccc(-c2nc(CSCC3(C#N)CC3)cs2)o1	ZINC000344469781	225068795	/nfs/dbraw/zinc/06/87/95/225068795.db2.gz	SSRHQDBQKKJQKQ-UHFFFAOYSA-N	0	0	290.413	4.249	20	30		CIEDRN
N#CC1(CSCc2cccc(F)c2Cl)CC1	ZINC000344476426	225069986	/nfs/dbraw/zinc/06/99/86/225069986.db2.gz	YYYDAZVEYNTCMZ-UHFFFAOYSA-N	0	0	255.745	4.016	20	30		CIEDRN
Cc1c2cccc(C)c2oc1C(=O)NCC(C)(C)CCC#N	ZINC000346017480	225678436	/nfs/dbraw/zinc/67/84/36/225678436.db2.gz	SOPWAUCZRRVZFY-UHFFFAOYSA-N	0	0	298.386	4.109	20	30		CIEDRN
C[C@H](c1nc([C@H]2CCCCS2)no1)c1cccc(C#N)c1	ZINC000335157817	225701498	/nfs/dbraw/zinc/70/14/98/225701498.db2.gz	IQBXEASDZJRKES-SMDDNHRTSA-N	0	0	299.399	4.051	20	30		CIEDRN
N#CC[C@H](Cc1nc(-c2ccsc2)no1)c1ccccc1	ZINC000347103524	226050306	/nfs/dbraw/zinc/05/03/06/226050306.db2.gz	JLNUOIGLVWOAJI-CYBMUJFWSA-N	0	0	295.367	4.038	20	30		CIEDRN
N#Cc1cnccc1/C=C/c1csc(-c2cccs2)n1	ZINC000347425171	226153434	/nfs/dbraw/zinc/15/34/34/226153434.db2.gz	HIALRIZXLACZEM-ONEGZZNKSA-N	0	0	295.392	4.309	20	30		CIEDRN
CCC[C@H](C(=O)N[C@H](C#N)c1ccc(CC)cc1)C(C)C	ZINC000575160639	335073832	/nfs/dbraw/zinc/07/38/32/335073832.db2.gz	OERVIDKYVUJMJK-DLBZAZTESA-N	0	0	286.419	4.002	20	30		CIEDRN
N#Cc1cc(CNc2ccc(F)c(C3CC3)c2)ccc1F	ZINC000352617414	227116599	/nfs/dbraw/zinc/11/65/99/227116599.db2.gz	CJPJITJGWGCYRO-UHFFFAOYSA-N	0	0	284.309	4.326	20	30		CIEDRN
C[C@H](CCSc1cccnc1C#N)OCc1ccccc1	ZINC000575195802	335079540	/nfs/dbraw/zinc/07/95/40/335079540.db2.gz	WBAHQGNDAGDFLO-CQSZACIVSA-N	0	0	298.411	4.041	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc([C@@H](OCC)c2ccccc2)no1	ZINC000575217570	335082729	/nfs/dbraw/zinc/08/27/29/335082729.db2.gz	RWXJAXWFCKGZQI-YOEHRIQHSA-N	0	0	286.375	4.049	20	30		CIEDRN
C[C@@H]1CC(=O)CC[C@@H]1C(=O)Nc1ncc(C(C)(C)C)s1	ZINC000329000830	227252042	/nfs/dbraw/zinc/25/20/42/227252042.db2.gz	VUAKKEUIRSFZOK-KOLCDFICSA-N	0	0	294.420	4.034	20	30		CIEDRN
O=C(N[C@H]1CCCCNC1=O)[C@@H]1CCC[C@@H]2CCCC[C@@H]12	ZINC000329031805	227265240	/nfs/dbraw/zinc/26/52/40/227265240.db2.gz	XISKKFZKJUJDIF-YJNKXOJESA-N	0	0	292.423	4.058	20	30		CIEDRN
Cc1nc(CCNC(=O)[C@@H]2CCCC(C)(C)C2)c(C)o1	ZINC000329035519	227266466	/nfs/dbraw/zinc/26/64/66/227266466.db2.gz	RADDRWHZTPZYOT-CYBMUJFWSA-N	0	0	278.396	4.007	20	30		CIEDRN
C[C@H]1C[C@H](CC(=O)Nc2nncn2C2CC2)CC(C)(C)C1	ZINC000329127913	227316751	/nfs/dbraw/zinc/31/67/51/227316751.db2.gz	VCDHWKZLOSPBLH-NWDGAFQWSA-N	0	0	290.411	4.054	20	30		CIEDRN
O=C(N[C@@H]1CC[C@@H]2CCCC[C@H]2C1)c1c[nH]c2ncccc12	ZINC000329139833	227321577	/nfs/dbraw/zinc/32/15/77/227321577.db2.gz	JCHAEDGTQLDCGB-MELADBBJSA-N	0	0	297.402	4.226	20	30		CIEDRN
O=C(COc1cccc2ncccc21)NC1CCCCCC1	ZINC000329286898	227411688	/nfs/dbraw/zinc/41/16/88/227411688.db2.gz	HBIHVWPCVJTXET-UHFFFAOYSA-N	0	0	298.386	4.293	20	30		CIEDRN
N#Cc1cnc(N[C@H](c2ccccc2)C2CC2)c(Cl)c1	ZINC000301285670	227499809	/nfs/dbraw/zinc/49/98/09/227499809.db2.gz	OGDYNLPVRYBIMX-OAHLLOKOSA-N	0	0	283.762	4.170	20	30		CIEDRN
Cc1c2ccccc2oc1[C@H](C)Nc1ccc(C#N)nc1	ZINC000301547264	227580894	/nfs/dbraw/zinc/58/08/94/227580894.db2.gz	XCULZJLNYJVIKT-LBPRGKRZSA-N	0	0	277.327	4.181	20	30		CIEDRN
N#Cc1cccnc1N[C@@H](c1ccccc1F)C1CCCC1	ZINC000301549172	227582046	/nfs/dbraw/zinc/58/20/46/227582046.db2.gz	GBGNPEFXBFBIGY-QGZVFWFLSA-N	0	0	295.361	4.436	20	30		CIEDRN
Cc1ccccc1[C@H](Nc1cccc(C#N)n1)C(C)C	ZINC000301847740	227705470	/nfs/dbraw/zinc/70/54/70/227705470.db2.gz	NNUFKTLTQRFSFY-QGZVFWFLSA-N	0	0	265.360	4.071	20	30		CIEDRN
C[C@H]1C[C@@H](c2cccnc2)N(c2c(Cl)cccc2C#N)C1	ZINC000302140873	227801620	/nfs/dbraw/zinc/80/16/20/227801620.db2.gz	OWASTJWXJGRCFM-LRDDRELGSA-N	0	0	297.789	4.194	20	30		CIEDRN
N#Cc1cc(N2CCC[C@@H]2C2CCCCC2)ccc1[N+](=O)[O-]	ZINC000302181799	227813903	/nfs/dbraw/zinc/81/39/03/227813903.db2.gz	RBPHEXAZBCWSFU-MRXNPFEDSA-N	0	0	299.374	4.016	20	30		CIEDRN
N#Cc1cccc(C#N)c1N[C@@H]1CCc2cc(Cl)ccc21	ZINC000302431358	227849128	/nfs/dbraw/zinc/84/91/28/227849128.db2.gz	LGWYNJLABZMALA-MRXNPFEDSA-N	0	0	293.757	4.183	20	30		CIEDRN
C[C@@H]1C[C@H](C(=O)N[C@H]2CCCCC23CCCC3)CC(=O)N1	ZINC000329732761	227929726	/nfs/dbraw/zinc/92/97/26/227929726.db2.gz	JBENVQQEIQMTDQ-RDBSUJKOSA-N	0	0	292.423	4.201	20	30		CIEDRN
Cc1ccc(N[C@H](c2ccc(Cl)cc2)C2CC2)nc1C#N	ZINC000302720579	227880119	/nfs/dbraw/zinc/88/01/19/227880119.db2.gz	PBVQMUVBUOFHSQ-KRWDZBQOSA-N	0	0	297.789	4.478	20	30		CIEDRN
Cc1cc(C2CC2)nc(NC(=O)[C@@H]2CCCC2(C)C)n1	ZINC000329769969	227943345	/nfs/dbraw/zinc/94/33/45/227943345.db2.gz	IHSLYDIWJPQTTP-LBPRGKRZSA-N	0	0	273.380	4.077	20	30		CIEDRN
NC(=O)[C@@H]1CCC[C@H](C(=O)N[C@H]2CC23CCCCC3)C1	ZINC000329938505	227991754	/nfs/dbraw/zinc/99/17/54/227991754.db2.gz	FDKCIMHMKDNPQH-AGIUHOORSA-N	0	0	278.396	4.007	20	30		CIEDRN
Cc1nc(CC2CC2)oc1C(=O)NC1(C)CCC(C)CC1	ZINC000329988630	228007585	/nfs/dbraw/zinc/00/75/85/228007585.db2.gz	HIKDTLUGMOMIFI-UHFFFAOYSA-N	0	0	290.407	4.209	20	30		CIEDRN
N#CCCN(Cc1ccc(-c2ccccc2F)o1)CC1CC1	ZINC000353416189	228099271	/nfs/dbraw/zinc/09/92/71/228099271.db2.gz	LZDUOKZKCIKJTA-UHFFFAOYSA-N	0	0	298.361	4.211	20	30		CIEDRN
N#CCCN(Cc1cccc(Cl)c1Cl)CC1CC1	ZINC000353420856	228099914	/nfs/dbraw/zinc/09/99/14/228099914.db2.gz	VOJHTACLCOCNAK-UHFFFAOYSA-N	0	0	283.202	4.119	20	30		CIEDRN
O=C(Nc1cccc2ocnc21)C1CCC(F)(F)CC1	ZINC000330292430	228103515	/nfs/dbraw/zinc/10/35/15/228103515.db2.gz	HFJLSVDXDAQOFB-UHFFFAOYSA-N	0	0	280.274	4.241	20	30		CIEDRN
Cc1coc2ccc(NC(=O)[C@H]3CCC(=O)[C@@H](C)C3)cc12	ZINC000330116496	228042469	/nfs/dbraw/zinc/04/24/69/228042469.db2.gz	VNKMGRYTGVGIEP-JQWIXIFHSA-N	0	0	285.343	4.335	20	30		CIEDRN
Cc1noc(-c2ccccc2)c1NC(=O)NC1(C)CCCC1	ZINC000330122898	228043878	/nfs/dbraw/zinc/04/38/78/228043878.db2.gz	BYKFBWHVVBAFSZ-UHFFFAOYSA-N	0	0	299.374	4.118	20	30		CIEDRN
Cc1coc2ccc(NC(=O)[C@@H]3CCC(C)(C)O3)cc12	ZINC000330129093	228045539	/nfs/dbraw/zinc/04/55/39/228045539.db2.gz	JTUWEMXXIIYUQA-AWEZNQCLSA-N	0	0	273.332	4.287	20	30		CIEDRN
Cc1nc2cc(Cl)c(NC(=O)[C@@H]3CCCO3)cc2s1	ZINC000330156791	228052334	/nfs/dbraw/zinc/05/23/34/228052334.db2.gz	PBWNFRUJGUXHPO-NSHDSACASA-N	0	0	296.779	4.025	20	30		CIEDRN
Cc1ccc(NC(=O)C[C@@H](CC#N)c2ccccc2)cc1	ZINC000353306466	228082935	/nfs/dbraw/zinc/08/29/35/228082935.db2.gz	QBWMFPXFRRQMFQ-MRXNPFEDSA-N	0	0	278.355	4.021	20	30		CIEDRN
Cc1cc(C#N)cc(NC(=O)N2CCC[C@H]2C2CCCC2)c1	ZINC000332010119	228143336	/nfs/dbraw/zinc/14/33/36/228143336.db2.gz	SXTSPUSQCCAIIE-KRWDZBQOSA-N	0	0	297.402	4.053	20	30		CIEDRN
Cc1cc(C#N)cc(NC(=O)N2[C@H](C)C[C@H]3CCCC[C@@H]32)c1	ZINC000332304625	228154748	/nfs/dbraw/zinc/15/47/48/228154748.db2.gz	VYDVMRQAGPGSPV-UNEWFSDZSA-N	0	0	297.402	4.052	20	30		CIEDRN
C[C@@H]1CCCCCN1C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000332365545	228157198	/nfs/dbraw/zinc/15/71/98/228157198.db2.gz	XNUJDNHALTYVNN-NVXWUHKLSA-N	0	0	299.418	4.006	20	30		CIEDRN
Cc1ccc(NC(=O)c2cc(C#N)ccc2Cl)c(C)c1	ZINC000335940491	228168653	/nfs/dbraw/zinc/16/86/53/228168653.db2.gz	MKWKNUSIOJRUDW-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
N#Cc1cccnc1/C=C\c1nc(-c2ccccc2)cs1	ZINC000352019929	228174432	/nfs/dbraw/zinc/17/44/32/228174432.db2.gz	DGZAACOGBWWCNN-HJWRWDBZSA-N	0	0	289.363	4.247	20	30		CIEDRN
N#C[C@]1(C(=O)Nc2cccc(C3CCC3)c2)CC12CCCC2	ZINC000333113785	228190396	/nfs/dbraw/zinc/19/03/96/228190396.db2.gz	SRKYBPJEVLXFCG-IBGZPJMESA-N	0	0	294.398	4.367	20	30		CIEDRN
N#CCCC[C@H](NC(=O)C1CCCCC1)c1ccccc1	ZINC000352165088	228190686	/nfs/dbraw/zinc/19/06/86/228190686.db2.gz	BBCPYBCRIZBBFJ-KRWDZBQOSA-N	0	0	284.403	4.118	20	30		CIEDRN
N#CCCC[C@@H](NC(=O)C1=CCCCCC1)c1ccccc1	ZINC000352180077	228192445	/nfs/dbraw/zinc/19/24/45/228192445.db2.gz	HNCJYONIESEMSG-GOSISDBHSA-N	0	0	296.414	4.428	20	30		CIEDRN
Cc1ccc(Cl)c(NC(=O)c2cccc(C#N)c2)c1C	ZINC000336142733	228196646	/nfs/dbraw/zinc/19/66/46/228196646.db2.gz	GOYWGJNJSYKJKE-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
Cc1cc(C)c(C(=O)N[C@@H](CCCC#N)c2ccccc2)o1	ZINC000352226368	228201423	/nfs/dbraw/zinc/20/14/23/228201423.db2.gz	SARCDLFIHJZSNE-INIZCTEOSA-N	0	0	296.370	4.061	20	30		CIEDRN
N#Cc1cnc2c(F)cc(F)cc2c1NC[C@@H]1CC=CCC1	ZINC000352315053	228219657	/nfs/dbraw/zinc/21/96/57/228219657.db2.gz	MVCYZZXCTUFFEC-LLVKDONJSA-N	0	0	299.324	4.153	20	30		CIEDRN
C[C@@H]1CCC[C@@](C#N)(NC(=O)c2cccc3ccccc32)C1	ZINC000116806304	260005903	/nfs/dbraw/zinc/00/59/03/260005903.db2.gz	JWAIRWAXCIZMPF-AUUYWEPGSA-N	0	0	292.382	4.042	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1cccc(-c2nc(C)c(C)o2)c1	ZINC000117003143	260019449	/nfs/dbraw/zinc/01/94/49/260019449.db2.gz	LBYKREHZOXGTGX-NSHDSACASA-N	0	0	299.374	4.045	20	30		CIEDRN
C=CCCC(=O)N[C@@H](C)c1cc(Cl)ccc1Cl	ZINC000188264461	260075932	/nfs/dbraw/zinc/07/59/32/260075932.db2.gz	NANFDGZVIFSICN-VIFPVBQESA-N	0	0	272.175	4.137	20	30		CIEDRN
C[C@H](Nc1ccc(C#N)c(Cl)c1)c1ccc(N(C)C)cc1	ZINC000037253305	260078989	/nfs/dbraw/zinc/07/89/89/260078989.db2.gz	NIHVXAQJZPTWHR-LBPRGKRZSA-N	0	0	299.805	4.451	20	30		CIEDRN
Cc1cccc(NCc2cccc(F)c2C#N)c1Cl	ZINC000521387855	260093089	/nfs/dbraw/zinc/09/30/89/260093089.db2.gz	PVEAPULAODJREB-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
C=C(C)CN(C)C(=O)CCCCCO[C@@H]1CCC[C@@H](C)C1	ZINC000180438749	260101956	/nfs/dbraw/zinc/10/19/56/260101956.db2.gz	RHUBDEBGCOWBMN-IAGOWNOFSA-N	0	0	295.467	4.177	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1ccc(-c2ccc(F)cc2)s1	ZINC000180443164	260102204	/nfs/dbraw/zinc/10/22/04/260102204.db2.gz	BLYXSOXFCFOBII-UHFFFAOYSA-N	0	0	289.375	4.202	20	30		CIEDRN
CC#CCCCC(=O)Nc1onc(C2CCCCC2)c1C	ZINC000297830316	260135867	/nfs/dbraw/zinc/13/58/67/260135867.db2.gz	QNSWEXBSRIFYFH-UHFFFAOYSA-N	0	0	288.391	4.163	20	30		CIEDRN
CC#CCN(C)C(=O)Nc1c(CCC)cccc1C(C)C	ZINC000297830408	260135974	/nfs/dbraw/zinc/13/59/74/260135974.db2.gz	NHQUBSXGDIVMPZ-UHFFFAOYSA-N	0	0	286.419	4.250	20	30		CIEDRN
C[C@H](Nc1cccc(C#N)n1)c1ccc(Cl)cc1Cl	ZINC000081595222	260183945	/nfs/dbraw/zinc/18/39/45/260183945.db2.gz	AAOYJKQJHBKIRG-VIFPVBQESA-N	0	0	292.169	4.433	20	30		CIEDRN
Cc1cc(Br)ccc1OCCCC(C)(C)C#N	ZINC000087598993	260191760	/nfs/dbraw/zinc/19/17/60/260191760.db2.gz	IBRIXCBZVXGKAC-UHFFFAOYSA-N	0	0	296.208	4.466	20	30		CIEDRN
Cc1ccc(NC(=O)Nc2ccc(C#N)c(Cl)c2)cc1	ZINC000312732930	260194472	/nfs/dbraw/zinc/19/44/72/260194472.db2.gz	HPSFQMDCDXEKED-UHFFFAOYSA-N	0	0	285.734	4.164	20	30		CIEDRN
Cc1ccc(C#N)c(NCc2cc(Cl)sc2Cl)n1	ZINC000312785834	260202469	/nfs/dbraw/zinc/20/24/69/260202469.db2.gz	VEOYDPOSFBGXKA-UHFFFAOYSA-N	0	0	298.198	4.242	20	30		CIEDRN
CSc1ccc(Cl)cc1NC(=O)C1(C#N)CCCC1	ZINC000049140984	260203945	/nfs/dbraw/zinc/20/39/45/260203945.db2.gz	JAQVEIYSPUUEPA-UHFFFAOYSA-N	0	0	294.807	4.084	20	30		CIEDRN
CC1(C)CCCN(c2c(C#N)cnc3ccccc32)CC1	ZINC000087658085	260209234	/nfs/dbraw/zinc/20/92/34/260209234.db2.gz	IQZQJTFCJUAGHJ-UHFFFAOYSA-N	0	0	279.387	4.123	20	30		CIEDRN
N#Cc1ccc(SCCOc2ccc(F)cc2)c(F)c1	ZINC000525503674	260217579	/nfs/dbraw/zinc/21/75/79/260217579.db2.gz	PNWHANIHVKBZQC-UHFFFAOYSA-N	0	0	291.322	4.008	20	30		CIEDRN
Cc1ccc(CSc2ccc(C#N)cc2F)cc1	ZINC000525503590	260217594	/nfs/dbraw/zinc/21/75/94/260217594.db2.gz	GITANQKQLOJTEQ-UHFFFAOYSA-N	0	0	257.333	4.298	20	30		CIEDRN
N#Cc1ccc(NCc2cc(Cl)ccc2Cl)cc1	ZINC000087758577	260225549	/nfs/dbraw/zinc/22/55/49/260225549.db2.gz	LDXPQHNYQANJNR-UHFFFAOYSA-N	0	0	277.154	4.477	20	30		CIEDRN
C[C@@H](CC#N)Sc1ccccc1NCCC(F)(F)F	ZINC000354324848	260231185	/nfs/dbraw/zinc/23/11/85/260231185.db2.gz	CCEIXIYLLISIBM-JTQLQIEISA-N	0	0	288.338	4.445	20	30		CIEDRN
CCCCNC(=O)Nc1ccccc1S[C@H](C)CC#N	ZINC000066954491	260250172	/nfs/dbraw/zinc/25/01/72/260250172.db2.gz	UZECICJCNUCPTA-GFCCVEGCSA-N	0	0	291.420	4.002	20	30		CIEDRN
CCSCCCNc1ccc(C(F)(F)F)c(C#N)c1	ZINC000311475300	260250827	/nfs/dbraw/zinc/25/08/27/260250827.db2.gz	JCTLSMGNTGAEGI-UHFFFAOYSA-N	0	0	288.338	4.132	20	30		CIEDRN
C=CCCO[C@@H](C)C(=O)N(CC)c1cccc2ccccc21	ZINC000520000023	260266494	/nfs/dbraw/zinc/26/64/94/260266494.db2.gz	RQMMYTQATIAIIK-HNNXBMFYSA-N	0	0	297.398	4.174	20	30		CIEDRN
COc1cc(OC)c(NCC(C)(C)CCC#N)cc1Cl	ZINC000092108435	260267139	/nfs/dbraw/zinc/26/71/39/260267139.db2.gz	DCCBSEZZAGHIFN-UHFFFAOYSA-N	0	0	296.798	4.099	20	30		CIEDRN
CC(C)(CCC#N)CNc1ccccc1N1CCCC1	ZINC000092140451	260267818	/nfs/dbraw/zinc/26/78/18/260267818.db2.gz	XYVNFVRRCNHXFT-UHFFFAOYSA-N	0	0	271.408	4.029	20	30		CIEDRN
N#CCSCCCSC1=Nc2ccccc2CS1	ZINC000075075838	260289495	/nfs/dbraw/zinc/28/94/95/260289495.db2.gz	TZJRLOSFWUSBLI-UHFFFAOYSA-N	0	0	294.470	4.301	20	30		CIEDRN
C[C@@H](CCCC(F)(F)F)Nc1cccc(CC#N)c1	ZINC000313404943	260291503	/nfs/dbraw/zinc/29/15/03/260291503.db2.gz	AHIQKSYDDZXARZ-NSHDSACASA-N	0	0	270.298	4.286	20	30		CIEDRN
N#CCc1cccc(NC2CCC(C(F)(F)F)CC2)c1	ZINC000313432952	260292923	/nfs/dbraw/zinc/29/29/23/260292923.db2.gz	ZFOBFNDBMNKMNC-UHFFFAOYSA-N	0	0	282.309	4.286	20	30		CIEDRN
CC(C)Oc1cccc(CNc2cccc(CC#N)c2)c1	ZINC000313430448	260292924	/nfs/dbraw/zinc/29/29/24/260292924.db2.gz	UFSMYVRZJBGHOQ-UHFFFAOYSA-N	0	0	280.371	4.152	20	30		CIEDRN
N#CCc1cccc(NC(=O)CCC2CCCCC2)c1	ZINC000313444783	260294505	/nfs/dbraw/zinc/29/45/05/260294505.db2.gz	OEUMRWVJAZWWNF-UHFFFAOYSA-N	0	0	270.376	4.052	20	30		CIEDRN
CC(C)(C)CCC(=O)Nc1cccc(OCCCC#N)c1	ZINC000078080888	260299377	/nfs/dbraw/zinc/29/93/77/260299377.db2.gz	JDWOFJZJLGXBRL-UHFFFAOYSA-N	0	0	288.391	4.134	20	30		CIEDRN
Cc1cccc(NC(=O)N(CCC#N)CCC(C)C)c1C	ZINC000078438604	260300500	/nfs/dbraw/zinc/30/05/00/260300500.db2.gz	ANMDFDQSRFYWDX-UHFFFAOYSA-N	0	0	287.407	4.097	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(C[C@H](C)c2ccccc2)no1	ZINC000518006910	260333869	/nfs/dbraw/zinc/33/38/69/260333869.db2.gz	VDWFCQKEARZBKO-KBPBESRZSA-N	0	0	270.376	4.486	20	30		CIEDRN
CC(C)COc1ccc(/C=C/c2ccc(C#N)cn2)cc1	ZINC000518038133	260337201	/nfs/dbraw/zinc/33/72/01/260337201.db2.gz	DLFCWUZHBXOOEF-XVNBXDOJSA-N	0	0	278.355	4.158	20	30		CIEDRN
N#Cc1ccsc1NC(=O)c1cc2sccc2s1	ZINC000518171560	260347869	/nfs/dbraw/zinc/34/78/69/260347869.db2.gz	ZWOAUFXIIUCCKS-UHFFFAOYSA-N	0	0	290.394	4.148	20	30		CIEDRN
N#Cc1c(F)cccc1NCC1(Sc2ccccc2)CC1	ZINC000518319120	260376140	/nfs/dbraw/zinc/37/61/40/260376140.db2.gz	DOWHVOVEDRDYSR-UHFFFAOYSA-N	0	0	298.386	4.434	20	30		CIEDRN
C[C@H](O/N=C/c1cccs1)c1ncc(C(C)(C)C)o1	ZINC000089124518	260437177	/nfs/dbraw/zinc/43/71/77/260437177.db2.gz	HYLSYECNYMYVGF-MDKXCRPYSA-N	0	0	278.377	4.145	20	30		CIEDRN
COCCCCNc1cccc(Oc2ccc(C#N)cc2)c1	ZINC000089660179	260448386	/nfs/dbraw/zinc/44/83/86/260448386.db2.gz	CRAADZOADUZTQS-UHFFFAOYSA-N	0	0	296.370	4.189	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1cccc(C2CCC2)c1	ZINC000410126110	260463080	/nfs/dbraw/zinc/46/30/80/260463080.db2.gz	VJZZAWRIZPKWGN-INIZCTEOSA-N	0	0	257.377	4.039	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)[C@@H](C)Sc1ccccc1Cl	ZINC000410142526	260465437	/nfs/dbraw/zinc/46/54/37/260465437.db2.gz	MAUGVICXWQYBFS-VXGBXAGGSA-N	0	0	297.851	4.292	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1ccc(F)c(OC)c1	ZINC000410344038	260487330	/nfs/dbraw/zinc/48/73/30/260487330.db2.gz	JJVBTEXJLGKUDF-UHFFFAOYSA-N	0	0	299.345	4.205	20	30		CIEDRN
C[C@H](C#N)CSc1ccccc1NC(=O)c1ccccc1	ZINC000518660330	260490746	/nfs/dbraw/zinc/49/07/46/260490746.db2.gz	REANQLCXSBETBA-CYBMUJFWSA-N	0	0	296.395	4.191	20	30		CIEDRN
Cc1cc(C#N)cc(N[C@@H](C)c2ccccc2Cl)n1	ZINC000161002133	260565675	/nfs/dbraw/zinc/56/56/75/260565675.db2.gz	LNKCTAREPHXBHT-NSHDSACASA-N	0	0	271.751	4.088	20	30		CIEDRN
CC(C)[C@@H]1CCCN(C(=O)Nc2ccc(CC#N)cc2)CC1	ZINC000114806876	260673010	/nfs/dbraw/zinc/67/30/10/260673010.db2.gz	SGBICQKPAAVIMB-MRXNPFEDSA-N	0	0	299.418	4.043	20	30		CIEDRN
C[C@@H](NC[C@H](C#N)CCC#N)c1cccc(Cl)c1Cl	ZINC000117943013	260687711	/nfs/dbraw/zinc/68/77/11/260687711.db2.gz	FRPDEXFHOBDVNE-MNOVXSKESA-N	0	0	296.201	4.088	20	30		CIEDRN
Cc1c(NCCC(C)(C)C#N)cccc1-c1ncco1	ZINC000427421001	260732608	/nfs/dbraw/zinc/73/26/08/260732608.db2.gz	NHCOZAYIRZWXNA-UHFFFAOYSA-N	0	0	269.348	4.002	20	30		CIEDRN
CC(C)(C#N)CCSc1nc2ccccc2n1C(F)F	ZINC000123904108	260740292	/nfs/dbraw/zinc/74/02/92/260740292.db2.gz	GKZHHLABVCEUOY-UHFFFAOYSA-N	0	0	295.358	4.463	20	30		CIEDRN
Cc1nc2ccc(NCc3cccc(F)c3C#N)cc2s1	ZINC000427513434	260755812	/nfs/dbraw/zinc/75/58/12/260755812.db2.gz	GRKDOQCWTXUGAS-UHFFFAOYSA-N	0	0	297.358	4.228	20	30		CIEDRN
N#Cc1c(F)cccc1CNc1ccccc1C(F)(F)F	ZINC000427551584	260767575	/nfs/dbraw/zinc/76/75/75/260767575.db2.gz	XTWVKRAEBHYDRY-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
C[C@@H](CC#N)NC(=O)Nc1ccc2c(c1)oc1ccccc12	ZINC000156015111	260779245	/nfs/dbraw/zinc/77/92/45/260779245.db2.gz	FELBVFLUGXCBIU-NSHDSACASA-N	0	0	293.326	4.010	20	30		CIEDRN
N#Cc1c(F)cccc1CSCCCC1CCOCC1	ZINC000427682510	260808968	/nfs/dbraw/zinc/80/89/68/260808968.db2.gz	LDSMSDBKMVIFEE-UHFFFAOYSA-N	0	0	293.407	4.137	20	30		CIEDRN
C=CCCCNc1ccccc1S[C@H](C)CC#N	ZINC000157183847	260827768	/nfs/dbraw/zinc/82/77/68/260827768.db2.gz	YQQCJIJILMOWRX-CYBMUJFWSA-N	0	0	260.406	4.459	20	30		CIEDRN
N#Cc1ccc(/C=C\c2nc3ccccc3s2)c(F)c1	ZINC000448112303	260842877	/nfs/dbraw/zinc/84/28/77/260842877.db2.gz	CVCNKRBAJCBNSV-FPLPWBNLSA-N	0	0	280.327	4.477	20	30		CIEDRN
CC(C)(C)c1ccc(-c2noc(-c3ccc(C#N)o3)n2)cc1	ZINC000426588065	260872608	/nfs/dbraw/zinc/87/26/08/260872608.db2.gz	NPUDZBQETYOSIW-UHFFFAOYSA-N	0	0	293.326	4.166	20	30		CIEDRN
C=CCCC(=O)N1CC=C(c2c[nH]c3cc(C)ccc32)CC1	ZINC000363619326	260952551	/nfs/dbraw/zinc/95/25/51/260952551.db2.gz	CTWVDIOKSFSGDK-UHFFFAOYSA-N	0	0	294.398	4.058	20	30		CIEDRN
C[C@]1(C(=O)Nc2cccc(OCCCC#N)c2)CC=CCC1	ZINC000448732262	261065452	/nfs/dbraw/zinc/06/54/52/261065452.db2.gz	KOTBQFFPPVMNIT-SFHVURJKSA-N	0	0	298.386	4.054	20	30		CIEDRN
Cc1cc(C(=O)N[C@H](CCC#N)c2ccccc2)sc1C	ZINC000153200410	261074608	/nfs/dbraw/zinc/07/46/08/261074608.db2.gz	TYHGLFFLEGZPGK-OAHLLOKOSA-N	0	0	298.411	4.140	20	30		CIEDRN
Cc1ccc(C(=O)N[C@H](CCC#N)c2ccccc2)c(C)c1	ZINC000153286665	261076273	/nfs/dbraw/zinc/07/62/73/261076273.db2.gz	DKOGHRNTQPMYAN-GOSISDBHSA-N	0	0	292.382	4.078	20	30		CIEDRN
N#CCC[C@@H](C#N)COc1ccc2oc3c(c2c1)CCCC3	ZINC000153372684	261077846	/nfs/dbraw/zinc/07/78/46/261077846.db2.gz	XOOIICYZNBBYKZ-ZDUSSCGKSA-N	0	0	294.354	4.134	20	30		CIEDRN
Cc1ccnc(-c2ccc(NCCCC(C)(C)C#N)cc2)n1	ZINC000154003346	261086859	/nfs/dbraw/zinc/08/68/59/261086859.db2.gz	KGOUNJYRSJOWBO-UHFFFAOYSA-N	0	0	294.402	4.194	20	30		CIEDRN
Cc1ccoc1C(=O)Nc1cc(C(C)(C)C)sc1C#N	ZINC000154269440	261089613	/nfs/dbraw/zinc/08/96/13/261089613.db2.gz	ALJMJOIGJRDCAZ-UHFFFAOYSA-N	0	0	288.372	4.071	20	30		CIEDRN
C/C=C(\C=C\C(=O)Nc1cccc(OCCCC#N)c1)CC	ZINC000155533795	261103165	/nfs/dbraw/zinc/10/31/65/261103165.db2.gz	ZQANCIQXPBJYLJ-GIALXPLSSA-N	0	0	298.386	4.220	20	30		CIEDRN
CC[C@H](CC#N)NC(=O)Nc1cccc(-c2cccs2)c1	ZINC000155947628	261110649	/nfs/dbraw/zinc/11/06/49/261110649.db2.gz	JUTZGKNRZUTXQI-CYBMUJFWSA-N	0	0	299.399	4.229	20	30		CIEDRN
Cc1sc(CNc2ccc(F)cc2C#N)nc1C(C)C	ZINC000361034063	261151453	/nfs/dbraw/zinc/15/14/53/261151453.db2.gz	VTNFAVAGYCYFRN-UHFFFAOYSA-N	0	0	289.379	4.198	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccc(OC(C)(C)C)cc1	ZINC000173694990	261167894	/nfs/dbraw/zinc/16/78/94/261167894.db2.gz	OSCYYWDZJILZQH-UHFFFAOYSA-N	0	0	290.407	4.294	20	30		CIEDRN
Cc1cnn(CCCCCSc2ccccc2C#N)c1	ZINC000173717994	261168834	/nfs/dbraw/zinc/16/88/34/261168834.db2.gz	PJKFBQCMEBKZPU-UHFFFAOYSA-N	0	0	285.416	4.026	20	30		CIEDRN
N#Cc1ccc(CNC(c2ccccc2)c2ccccc2)o1	ZINC000174237531	261181960	/nfs/dbraw/zinc/18/19/60/261181960.db2.gz	YJONZUVAMJWMIO-UHFFFAOYSA-N	0	0	288.350	4.030	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](C)c1ccc(F)cc1Cl	ZINC000175718582	261242296	/nfs/dbraw/zinc/24/22/96/261242296.db2.gz	FZKDHGGKFXYPLZ-JTQLQIEISA-N	0	0	269.747	4.013	20	30		CIEDRN
C=CCCCC(=O)N[C@H](C)c1ccc(F)cc1Cl	ZINC000175718598	261242383	/nfs/dbraw/zinc/24/23/83/261242383.db2.gz	FZKDHGGKFXYPLZ-SNVBAGLBSA-N	0	0	269.747	4.013	20	30		CIEDRN
CC(C)(C#N)c1ccccc1CSCc1nccs1	ZINC000161844232	261261751	/nfs/dbraw/zinc/26/17/51/261261751.db2.gz	JMHKRAVPBINUAB-UHFFFAOYSA-N	0	0	288.441	4.378	20	30		CIEDRN
C[C@H](C#N)Oc1ccccc1N[C@@H](C)CCc1ccco1	ZINC000162276415	261275280	/nfs/dbraw/zinc/27/52/80/261275280.db2.gz	AQGOBMKYCXROFD-UONOGXRCSA-N	0	0	284.359	4.004	20	30		CIEDRN
CC(C)CCN(CCC#N)C(=O)Nc1cccc(Cl)c1	ZINC000176337071	261277316	/nfs/dbraw/zinc/27/73/16/261277316.db2.gz	ZRPGFBRFJBRZRE-UHFFFAOYSA-N	0	0	293.798	4.134	20	30		CIEDRN
Cc1ccc(C(=O)N(C)c2cc(Cl)ccc2C#N)cc1C	ZINC000176428610	261285203	/nfs/dbraw/zinc/28/52/03/261285203.db2.gz	OTXOKGJXJKGPNQ-UHFFFAOYSA-N	0	0	298.773	4.105	20	30		CIEDRN
Cc1sc2nc(C)nc(SCCCCC#N)c2c1C	ZINC000104395355	261293733	/nfs/dbraw/zinc/29/37/33/261293733.db2.gz	KUAAMVPEUOJVNU-UHFFFAOYSA-N	0	0	291.445	4.403	20	30		CIEDRN
C[C@@H](CC#N)Sc1ccccc1NCc1nccs1	ZINC000163155759	261307169	/nfs/dbraw/zinc/30/71/69/261307169.db2.gz	RGMGOTDVGXWOQP-NSHDSACASA-N	0	0	289.429	4.149	20	30		CIEDRN
C[C@H](C#N)CSc1ccccc1NCc1nccs1	ZINC000163152216	261307522	/nfs/dbraw/zinc/30/75/22/261307522.db2.gz	XJHNXMRXCJFKAZ-LLVKDONJSA-N	0	0	289.429	4.007	20	30		CIEDRN
CC(C)CC(C)(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000177116833	261332727	/nfs/dbraw/zinc/33/27/27/261332727.db2.gz	AEEMOQQTLRMQLI-UHFFFAOYSA-N	0	0	286.419	4.499	20	30		CIEDRN
CC(=O)c1ccc(C#N)cc1N1CCC2(CCCCC2)CC1	ZINC000302053027	261347328	/nfs/dbraw/zinc/34/73/28/261347328.db2.gz	PCMIHWRQRLFUQM-UHFFFAOYSA-N	0	0	296.414	4.312	20	30		CIEDRN
C[C@@H](NCc1ccc(C#N)cc1F)c1cc2ccccc2o1	ZINC000177861350	261371122	/nfs/dbraw/zinc/37/11/22/261371122.db2.gz	RYTWJIVKSUQYMI-GFCCVEGCSA-N	0	0	294.329	4.294	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)c1ccc2ccccc2c1	ZINC000178386019	261388068	/nfs/dbraw/zinc/38/80/68/261388068.db2.gz	BGEXSBQNXCIWLN-UHFFFAOYSA-N	0	0	286.334	4.272	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)CCc1ccc(Cl)cc1	ZINC000178373968	261388187	/nfs/dbraw/zinc/38/81/87/261388187.db2.gz	BORLJLZFCLNOLW-UHFFFAOYSA-N	0	0	298.773	4.091	20	30		CIEDRN
CCN(C(=O)Nc1cccc(C#N)c1C)C1CCCCC1	ZINC000178545488	261396371	/nfs/dbraw/zinc/39/63/71/261396371.db2.gz	NQPZWHRKRJLDMQ-UHFFFAOYSA-N	0	0	285.391	4.053	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)N1CCC(C(C)(C)C)CC1	ZINC000178567425	261398385	/nfs/dbraw/zinc/39/83/85/261398385.db2.gz	LWHJXLUKQRFDNS-UHFFFAOYSA-N	0	0	299.418	4.157	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)c1cccc2ccccc21	ZINC000178628922	261399944	/nfs/dbraw/zinc/39/99/44/261399944.db2.gz	DVGWXOXJVYNIAW-UHFFFAOYSA-N	0	0	286.334	4.272	20	30		CIEDRN
N#CCCCCSC1=Nc2ccccc2CS1	ZINC000171643875	261476023	/nfs/dbraw/zinc/47/60/23/261476023.db2.gz	AERYXFRUGJKHHY-UHFFFAOYSA-N	0	0	262.403	4.348	20	30		CIEDRN
C[C@H](Nc1ccnc(C(F)(F)F)c1)c1ccc(C#N)cc1	ZINC000313807664	261525487	/nfs/dbraw/zinc/52/54/87/261525487.db2.gz	VPXPPWROBXWMDM-JTQLQIEISA-N	0	0	291.276	4.145	20	30		CIEDRN
N#CCSCCCSc1ccc(Cl)cc1	ZINC000174002451	261553159	/nfs/dbraw/zinc/55/31/59/261553159.db2.gz	VHFGLLGNTNGWFT-UHFFFAOYSA-N	0	0	257.811	4.079	20	30		CIEDRN
C=C(C)CN(C)C(=O)Nc1cccc(C(F)(F)F)c1C	ZINC000181797828	261590051	/nfs/dbraw/zinc/59/00/51/261590051.db2.gz	FNSGQPZCFBYMBC-UHFFFAOYSA-N	0	0	286.297	4.054	20	30		CIEDRN
C=CCOc1ccccc1C(=O)N1CCC2(C1)CCCCC2	ZINC000460662476	261675156	/nfs/dbraw/zinc/67/51/56/261675156.db2.gz	GSOHLUPPHWQIFY-UHFFFAOYSA-N	0	0	299.414	4.048	20	30		CIEDRN
CC(C)(C#N)CCCSc1nnc(-c2cccs2)o1	ZINC000177190389	261691033	/nfs/dbraw/zinc/69/10/33/261691033.db2.gz	GAYXUIPVMZBMMC-UHFFFAOYSA-N	0	0	293.417	4.220	20	30		CIEDRN
CC[C@H](C(=O)Nc1ccccc1C#N)C1CCC(C)CC1	ZINC000460769256	261742265	/nfs/dbraw/zinc/74/22/65/261742265.db2.gz	HNJBGXRWVFKLAS-XUJLQICISA-N	0	0	284.403	4.349	20	30		CIEDRN
C=CC[C@H](C(=O)NC/C=C/c1ccccc1)c1ccccc1	ZINC000187976973	261816020	/nfs/dbraw/zinc/81/60/20/261816020.db2.gz	GOPJESOQGNWNPU-CWIMXHLESA-N	0	0	291.394	4.176	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CCC[C@H](c2ccccc2)CC1	ZINC000188092276	261845247	/nfs/dbraw/zinc/84/52/47/261845247.db2.gz	SYCNBJPZMHTFFG-PKOBYXMFSA-N	0	0	285.431	4.385	20	30		CIEDRN
CC[C@@H](C)[C@H](C)C(=O)Nc1ccccc1SCCC#N	ZINC000180320262	261854099	/nfs/dbraw/zinc/85/40/99/261854099.db2.gz	NQWCNDXQNCMFLL-OLZOCXBDSA-N	0	0	290.432	4.313	20	30		CIEDRN
CC(C)Nc1cc(F)ccc1NCCCC(C)(C)C#N	ZINC000180646243	261869107	/nfs/dbraw/zinc/86/91/07/261869107.db2.gz	IKNIEJRPFWQDII-UHFFFAOYSA-N	0	0	277.387	4.388	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@@H](C)c1cccc2ccccc21	ZINC000182216726	262047208	/nfs/dbraw/zinc/04/72/08/262047208.db2.gz	UALSHBKZGQNJML-AWEZNQCLSA-N	0	0	282.387	4.118	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000185277769	262048131	/nfs/dbraw/zinc/04/81/31/262048131.db2.gz	FRBAGFWHERIYFR-CYBMUJFWSA-N	0	0	270.376	4.029	20	30		CIEDRN
CC(C)C[C@H](C)C(=O)Nc1ccccc1SCCC#N	ZINC000185349045	262051879	/nfs/dbraw/zinc/05/18/79/262051879.db2.gz	QMXZJPSPXQDUQV-ZDUSSCGKSA-N	0	0	290.432	4.313	20	30		CIEDRN
C[C@H]([NH2+]CCCCC#N)c1ccc(Cl)c(Cl)c1[O-]	ZINC000185339537	262051887	/nfs/dbraw/zinc/05/18/87/262051887.db2.gz	RNARZCZMLDKRLQ-VIFPVBQESA-N	0	0	287.190	4.043	20	30		CIEDRN
Cc1ccc(CN(CCCC#N)c2ccc(F)cc2)o1	ZINC000108873449	262065875	/nfs/dbraw/zinc/06/58/75/262065875.db2.gz	XSTSCMZNOYBMER-UHFFFAOYSA-N	0	0	272.323	4.038	20	30		CIEDRN
CC[C@H]1[C@@H](C)CCN1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000186088224	262079393	/nfs/dbraw/zinc/07/93/93/262079393.db2.gz	KRGLQDYNKQRQEB-BBRMVZONSA-N	0	0	299.418	4.140	20	30		CIEDRN
Cc1c2ccccc2n(C)c1CNc1ccc(F)cc1C#N	ZINC000318846239	262079893	/nfs/dbraw/zinc/07/98/93/262079893.db2.gz	VXGCQLAYHXCTHC-UHFFFAOYSA-N	0	0	293.345	4.110	20	30		CIEDRN
N#CCCCOc1cccc(NC(=O)C[C@@H]2C=CCCC2)c1	ZINC000186937065	262117661	/nfs/dbraw/zinc/11/76/61/262117661.db2.gz	AZMSEIHSQPLYIL-OAHLLOKOSA-N	0	0	298.386	4.054	20	30		CIEDRN
Cc1[nH]c(SCCCCC#N)nc1-c1ccccc1	ZINC000187145612	262126078	/nfs/dbraw/zinc/12/60/78/262126078.db2.gz	IIGKLUVDWOZYHM-UHFFFAOYSA-N	0	0	271.389	4.171	20	30		CIEDRN
CC#CCCCC(=O)N1[C@H](C)CCC[C@H]1c1ccccc1	ZINC000364067127	262134705	/nfs/dbraw/zinc/13/47/05/262134705.db2.gz	OWDBDBWJNWEVEG-AEFFLSMTSA-N	0	0	283.415	4.322	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1C[C@H](c2cccs2)C[C@@H]1C	ZINC000364068471	262135260	/nfs/dbraw/zinc/13/52/60/262135260.db2.gz	SLTCNVLMZUUFFD-MELADBBJSA-N	0	0	277.433	4.055	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](c1ccccn1)C1CCCC1	ZINC000364071801	262136560	/nfs/dbraw/zinc/13/65/60/262136560.db2.gz	CTZJCWWENUNWRD-YOEHRIQHSA-N	0	0	286.419	4.031	20	30		CIEDRN
C[C@@H](CCC#N)Sc1nnc(-c2ccc(Cl)cc2)o1	ZINC000188225620	262152476	/nfs/dbraw/zinc/15/24/76/262152476.db2.gz	HTWIWSPQYKFSLO-VIFPVBQESA-N	0	0	293.779	4.174	20	30		CIEDRN
C/C=C(\CC)C(=O)Nc1ccccc1S[C@H](C)CC#N	ZINC000188787174	262160969	/nfs/dbraw/zinc/16/09/69/262160969.db2.gz	WQJCJOQHZGRCNB-NASADATOSA-N	0	0	288.416	4.376	20	30		CIEDRN
CC(C)[C@@H](C)C(=O)Nc1sc2c(c1C#N)CCCCC2	ZINC000497539483	262174691	/nfs/dbraw/zinc/17/46/91/262174691.db2.gz	XMKGUURXBYANRJ-LLVKDONJSA-N	0	0	290.432	4.119	20	30		CIEDRN
C/C(=C/c1ccccc1)CNc1ccc(CC#N)cc1	ZINC000497593330	262179204	/nfs/dbraw/zinc/17/92/04/262179204.db2.gz	ZWJQLDXFLFIKLI-SQFISAMPSA-N	0	0	262.356	4.268	20	30		CIEDRN
C=CCC1(C(=O)N2C[C@@H](c3ccsc3)C[C@@H]2C)CCC1	ZINC000364202700	262183502	/nfs/dbraw/zinc/18/35/02/262183502.db2.gz	USDJEPWESBNHMK-ZFWWWQNUSA-N	0	0	289.444	4.199	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](C)CC#N	ZINC000191489241	262192792	/nfs/dbraw/zinc/19/27/92/262192792.db2.gz	SLRKVPZEVYTSQF-AWEZNQCLSA-N	0	0	299.418	4.304	20	30		CIEDRN
Cc1ccc(F)cc1-c1noc(-c2ccc(C#N)cc2C)n1	ZINC000319383133	262207492	/nfs/dbraw/zinc/20/74/92/262207492.db2.gz	AKXWWMCBNDLOCJ-UHFFFAOYSA-N	0	0	293.301	4.031	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)C[C@H]1CCC[C@H](C)C1	ZINC000497796406	262210149	/nfs/dbraw/zinc/21/01/49/262210149.db2.gz	BAAITUGGSZJXDH-WMZOPIPTSA-N	0	0	285.431	4.418	20	30		CIEDRN
CC(C)OCc1ccc(N[C@@H]2CCC[C@H](C#N)C2)cc1	ZINC000193086976	262216006	/nfs/dbraw/zinc/21/60/06/262216006.db2.gz	RSQMQBNLTAZQAM-DOTOQJQBSA-N	0	0	272.392	4.106	20	30		CIEDRN
N#C[C@H]1CCC[C@@H](Nc2cccc(COCC3CC3)c2)C1	ZINC000193088176	262216083	/nfs/dbraw/zinc/21/60/83/262216083.db2.gz	WJWVHBAGHHZFEG-DOTOQJQBSA-N	0	0	284.403	4.107	20	30		CIEDRN
COc1cc(SC)ccc1NCCCC(C)(C)C#N	ZINC000193494203	262223164	/nfs/dbraw/zinc/22/31/64/262223164.db2.gz	RDEVFOMCJXDJHQ-UHFFFAOYSA-N	0	0	278.421	4.159	20	30		CIEDRN
C=CCN(CC=C)C(=O)CCc1ccc(Cl)cc1Cl	ZINC000497890056	262226470	/nfs/dbraw/zinc/22/64/70/262226470.db2.gz	NMKJNSARSLMIKV-UHFFFAOYSA-N	0	0	298.213	4.127	20	30		CIEDRN
C[C@@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2ccc(C#N)cc2)C1	ZINC000525783948	262233069	/nfs/dbraw/zinc/23/30/69/262233069.db2.gz	ZMHXDBIPMAOTMG-AUUYWEPGSA-N	0	0	294.373	4.280	20	30		CIEDRN
C[C@H]1C[C@H](c2cccc(F)c2)[N@H+](Cc2ccc(C#N)cc2)C1	ZINC000525783949	262233306	/nfs/dbraw/zinc/23/33/06/262233306.db2.gz	ZMHXDBIPMAOTMG-IFXJQAMLSA-N	0	0	294.373	4.280	20	30		CIEDRN
C[C@@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2ccc(C#N)cc2)C1	ZINC000525783950	262233317	/nfs/dbraw/zinc/23/33/17/262233317.db2.gz	ZMHXDBIPMAOTMG-KUHUBIRLSA-N	0	0	294.373	4.280	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1ccc(C(C)(F)F)cc1	ZINC000497944161	262237072	/nfs/dbraw/zinc/23/70/72/262237072.db2.gz	KXPRTPQQZSEURL-LBPRGKRZSA-N	0	0	281.346	4.273	20	30		CIEDRN
CCCN(CC1CCCCC1)C(=O)c1sccc1C#N	ZINC000497981269	262242932	/nfs/dbraw/zinc/24/29/32/262242932.db2.gz	NCFAEFUYTRQNBY-UHFFFAOYSA-N	0	0	290.432	4.052	20	30		CIEDRN
CC(C)CCN(C(=O)c1sccc1C#N)C1CCCC1	ZINC000497989652	262243513	/nfs/dbraw/zinc/24/35/13/262243513.db2.gz	JYJBQHVKFWDAJK-UHFFFAOYSA-N	0	0	290.432	4.051	20	30		CIEDRN
Cc1c(NCC(C)(C)CCC#N)cnn1C1CCCC1	ZINC000195456807	262251219	/nfs/dbraw/zinc/25/12/19/262251219.db2.gz	UXHNROCMELGJDZ-UHFFFAOYSA-N	0	0	274.412	4.049	20	30		CIEDRN
C=CC1CCN(C(=O)c2ccc(SC(C)C)cc2)CC1	ZINC000110364121	262257046	/nfs/dbraw/zinc/25/70/46/262257046.db2.gz	CRBGVEPLUYRECB-UHFFFAOYSA-N	0	0	289.444	4.225	20	30		CIEDRN
N#C[C@@H]1CCC[C@H](Nc2ccc(C3CCC3)cc2)C1	ZINC000494475897	262272943	/nfs/dbraw/zinc/27/29/43/262272943.db2.gz	NGPWJDQGYGZRNC-DYVFJYSZSA-N	0	0	254.377	4.448	20	30		CIEDRN
C[C@H](CCC#N)Sc1ccccc1Br	ZINC000188276180	262287946	/nfs/dbraw/zinc/28/79/46/262287946.db2.gz	FQACHCIRHHDFTH-SECBINFHSA-N	0	0	270.195	4.233	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)NCC1(Sc2ccccc2)CC1	ZINC000188373941	262292889	/nfs/dbraw/zinc/29/28/89/262292889.db2.gz	YIVQOUXTLZXTCG-INIZCTEOSA-N	0	0	289.444	4.030	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cccc(Oc2ccncc2)c1	ZINC000188391070	262293569	/nfs/dbraw/zinc/29/35/69/262293569.db2.gz	KXTUOXSUTFMEJL-GOSISDBHSA-N	0	0	296.370	4.415	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CCCC2(CCCCC2)C1	ZINC000188389348	262293785	/nfs/dbraw/zinc/29/37/85/262293785.db2.gz	GBUDIDHCCKCZQP-INIZCTEOSA-N	0	0	263.425	4.162	20	30		CIEDRN
N#C[C@@H]1CCC[C@@H](Nc2cccc3c2CCCC3)C1	ZINC000463295003	262308784	/nfs/dbraw/zinc/30/87/84/262308784.db2.gz	XGWRDYYOQZBKRY-UKRRQHHQSA-N	0	0	254.377	4.060	20	30		CIEDRN
N#CCCCCSCc1coc(-c2ccccc2)n1	ZINC000161198044	262313060	/nfs/dbraw/zinc/31/30/60/262313060.db2.gz	IODXYROLQOFPAQ-UHFFFAOYSA-N	0	0	272.373	4.269	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1ccc(F)c(C)c1)c1ccccc1	ZINC000488366027	262315414	/nfs/dbraw/zinc/31/54/14/262315414.db2.gz	KSFFUFNRAOIZMM-MRXNPFEDSA-N	0	0	283.346	4.433	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](c2cc(C)cc(C)c2)C1	ZINC000188581735	262319211	/nfs/dbraw/zinc/31/92/11/262319211.db2.gz	GKBUQBWGMJHDME-APWZRJJASA-N	0	0	285.431	4.222	20	30		CIEDRN
CC[C@@H]1CCCC[C@H]1N(C)C(=O)[C@H](C)c1cccc(C#N)c1	ZINC000462202385	262319517	/nfs/dbraw/zinc/31/95/17/262319517.db2.gz	WCYDMKZVGKAZDY-QGPMSJSTSA-N	0	0	298.430	4.089	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc2nc(C3CC3)oc2c1	ZINC000188619547	262327209	/nfs/dbraw/zinc/32/72/09/262327209.db2.gz	YLUYYAPRDAGERJ-QGZVFWFLSA-N	0	0	284.359	4.246	20	30		CIEDRN
N#Cc1cc(F)c(N[C@H]2CSc3ccccc32)c(F)c1	ZINC000522759047	262339084	/nfs/dbraw/zinc/33/90/84/262339084.db2.gz	AQRCAFABCSBOLG-ZDUSSCGKSA-N	0	0	288.322	4.095	20	30		CIEDRN
C=CCOc1ccc(CNc2cccc(CC)c2)cc1	ZINC000021010850	262373489	/nfs/dbraw/zinc/37/34/89/262373489.db2.gz	GJTGMIBBPSYRNI-UHFFFAOYSA-N	0	0	267.372	4.426	20	30		CIEDRN
CCC[C@H](C)[C@@H]1CCCN1C(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000462244158	262384347	/nfs/dbraw/zinc/38/43/47/262384347.db2.gz	DDCDQNTYVJUGEP-MPGHIAIKSA-N	0	0	298.430	4.089	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1ccc(OC(C)C)cc1Cl	ZINC000187242235	262395143	/nfs/dbraw/zinc/39/51/43/262395143.db2.gz	BCGOVQUACFAORK-NSHDSACASA-N	0	0	296.798	4.213	20	30		CIEDRN
CC(C)(C#N)CCCC[S@@](=O)c1ccc(Cl)cc1	ZINC000232526128	262497212	/nfs/dbraw/zinc/49/72/12/262497212.db2.gz	QOKFOQDKOXRVKK-GOSISDBHSA-N	0	0	283.824	4.168	20	30		CIEDRN
C=CCCC(=O)N(Cc1ccco1)c1ccc(F)cc1F	ZINC000338661503	262554767	/nfs/dbraw/zinc/55/47/67/262554767.db2.gz	IKBSLEYLWYKLET-UHFFFAOYSA-N	0	0	291.297	4.057	20	30		CIEDRN
C=CCCC(=O)N[C@H](CC(C)(C)C)c1ccccc1	ZINC000338661484	262554987	/nfs/dbraw/zinc/55/49/87/262554987.db2.gz	HRGCQEOQMKHECB-OAHLLOKOSA-N	0	0	259.393	4.246	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1cc2ccc(Cl)cc2[nH]1	ZINC000428037631	262605528	/nfs/dbraw/zinc/60/55/28/262605528.db2.gz	KNQAFRCTUPIIBC-ZDUSSCGKSA-N	0	0	288.778	4.002	20	30		CIEDRN
Cc1ccc(C(=O)Nc2scc(C(C)(C)C)c2C#N)o1	ZINC000410924815	262672679	/nfs/dbraw/zinc/67/26/79/262672679.db2.gz	FFHRGHVFTZIDGN-UHFFFAOYSA-N	0	0	288.372	4.071	20	30		CIEDRN
C=C(C)[C@H]1OCC[C@H]1C(=O)Nc1cc(C)cc2ccccc21	ZINC000411015757	262675110	/nfs/dbraw/zinc/67/51/10/262675110.db2.gz	GUZZRVJJLXUBKP-SJLPKXTDSA-N	0	0	295.382	4.068	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1ccc(C)c2ccccc12	ZINC000411199023	262683943	/nfs/dbraw/zinc/68/39/43/262683943.db2.gz	JVGPDDNOHWOKCL-UHFFFAOYSA-N	0	0	267.372	4.186	20	30		CIEDRN
CC(F)(F)CCSc1nc(C(F)(F)F)ccc1C#N	ZINC000450905680	262696617	/nfs/dbraw/zinc/69/66/17/262696617.db2.gz	HFKZRINUAZRHMI-UHFFFAOYSA-N	0	0	296.264	4.109	20	30		CIEDRN
C[C@@H](SCCC#N)c1ccc(C(F)(F)F)cc1	ZINC000413015723	262752815	/nfs/dbraw/zinc/75/28/15/262752815.db2.gz	UJOJIRXDSQISMU-SECBINFHSA-N	0	0	259.296	4.413	20	30		CIEDRN
CC(C)Oc1ccc([C@H](C)Nc2ncc(C#N)cc2F)cc1	ZINC000413059817	262754081	/nfs/dbraw/zinc/75/40/81/262754081.db2.gz	HLJVLCFIEMHAGE-LBPRGKRZSA-N	0	0	299.349	4.053	20	30		CIEDRN
N#Cc1cnc(N[C@H](c2ccc(F)cc2)C2CCC2)c(F)c1	ZINC000413123053	262755944	/nfs/dbraw/zinc/75/59/44/262755944.db2.gz	LQWAOOPEZDFQRA-INIZCTEOSA-N	0	0	299.324	4.185	20	30		CIEDRN
N#CC1(CC[S@@](=O)CC2CCCCC2)CCCCC1	ZINC000414270024	262833899	/nfs/dbraw/zinc/83/38/99/262833899.db2.gz	YIXLZWGBDRZILW-LJQANCHMSA-N	0	0	281.465	4.180	20	30		CIEDRN
Cc1cc(N[C@H](C)c2ccc(C(C)C)cc2)nn1CCC#N	ZINC000273008447	263010897	/nfs/dbraw/zinc/01/08/97/263010897.db2.gz	OHFYQSBRYFHALZ-OAHLLOKOSA-N	0	0	296.418	4.402	20	30		CIEDRN
CCCc1nc(CSCCC(C)(C)C#N)cs1	ZINC000276561894	263037302	/nfs/dbraw/zinc/03/73/02/263037302.db2.gz	CJUFTJRBGYFAPA-UHFFFAOYSA-N	0	0	268.451	4.269	20	30		CIEDRN
C[C@@H](SCCC(C)(C)C#N)c1ccc(C#N)cc1	ZINC000276660469	263037712	/nfs/dbraw/zinc/03/77/12/263037712.db2.gz	WTKCTZUBXHRKQW-GFCCVEGCSA-N	0	0	258.390	4.292	20	30		CIEDRN
CC(C)(C)[C@H]1C[C@@H](Nc2ccc(CC#N)cc2)CS1	ZINC000277097096	263039831	/nfs/dbraw/zinc/03/98/31/263039831.db2.gz	GUGWIWIAZXMAFD-HUUCEWRRSA-N	0	0	274.433	4.085	20	30		CIEDRN
CCCCCCC[C@@H](CC(=O)[O-])[NH2+]Cc1ccsc1	ZINC000277157479	263039895	/nfs/dbraw/zinc/03/98/95/263039895.db2.gz	DCEJHSOIKSJUDE-AWEZNQCLSA-N	0	0	283.437	4.042	20	30		CIEDRN
CCCCCCC[C@H](CC(=O)[O-])[NH2+]Cc1ccc(CC)o1	ZINC000277333074	263040626	/nfs/dbraw/zinc/04/06/26/263040626.db2.gz	OLSCZHRPLIMZJV-CQSZACIVSA-N	0	0	295.423	4.135	20	30		CIEDRN
CC(C)n1ccnc1SCCCCC(C)(C)C#N	ZINC000277810816	263043537	/nfs/dbraw/zinc/04/35/37/263043537.db2.gz	XFIZPONCOKFHTF-UHFFFAOYSA-N	0	0	265.426	4.276	20	30		CIEDRN
C[C@H](c1ccccc1)[S@@](=O)CCCCC(C)(C)C#N	ZINC000277850153	263043946	/nfs/dbraw/zinc/04/39/46/263043946.db2.gz	LISQPOKDWDNWBD-KUHUBIRLSA-N	0	0	277.433	4.216	20	30		CIEDRN
CC(C)(C#N)CC(=O)N1CCCCC[C@H]1c1ccccc1	ZINC000278216689	263045871	/nfs/dbraw/zinc/04/58/71/263045871.db2.gz	HPAJAJUBMAXRIF-INIZCTEOSA-N	0	0	284.403	4.070	20	30		CIEDRN
CCCCOc1ccc(NC(=O)CC(C)(C)C#N)c(C)c1	ZINC000278224488	263045882	/nfs/dbraw/zinc/04/58/82/263045882.db2.gz	ITWMVMJBIOBACP-UHFFFAOYSA-N	0	0	288.391	4.052	20	30		CIEDRN
C[C@@H](c1ccccc1F)[S@](=O)CCCCC(C)(C)C#N	ZINC000278365918	263047378	/nfs/dbraw/zinc/04/73/78/263047378.db2.gz	XMQREEUEIMKHJT-RNODOKPDSA-N	0	0	295.423	4.355	20	30		CIEDRN
CC(C)(C#N)CC(=O)N(c1ccsc1)C1CCCCC1	ZINC000278368220	263047456	/nfs/dbraw/zinc/04/74/56/263047456.db2.gz	JSLMHVOPFQCJDZ-UHFFFAOYSA-N	0	0	290.432	4.354	20	30		CIEDRN
Cc1sc2ncnc(S[C@H]3CC[C@@H](C#N)C3)c2c1C	ZINC000278566857	263049235	/nfs/dbraw/zinc/04/92/35/263049235.db2.gz	NEHWRIOVMAIOAH-MNOVXSKESA-N	0	0	289.429	4.093	20	30		CIEDRN
N#CC1(C(=O)Nc2ccc(-c3ccco3)cc2F)CCCC1	ZINC000278702441	263049934	/nfs/dbraw/zinc/04/99/34/263049934.db2.gz	QKVQAINTMKWKNK-UHFFFAOYSA-N	0	0	298.317	4.108	20	30		CIEDRN
CC1(C#N)CCN(CCc2cccc(Cl)c2Cl)CC1	ZINC000279675664	263056724	/nfs/dbraw/zinc/05/67/24/263056724.db2.gz	FXFKLMZWSONYEE-UHFFFAOYSA-N	0	0	297.229	4.162	20	30		CIEDRN
Cc1cc(C(=O)/C=C/c2ccnn2C(C)C)c(C)s1	ZINC000280063444	263058864	/nfs/dbraw/zinc/05/88/64/263058864.db2.gz	OZYMYRVJDDFRCX-AATRIKPKSA-N	0	0	274.389	4.038	20	30		CIEDRN
CCC[C@@](C)(CC)C(=O)Nc1ccccc1O[C@H](C)C#N	ZINC000280448329	263061612	/nfs/dbraw/zinc/06/16/12/263061612.db2.gz	VXZTVRDWGZUPSI-CXAGYDPISA-N	0	0	288.391	4.132	20	30		CIEDRN
N#CC1(CCCNc2cccc3ccccc32)CCOCC1	ZINC000281377110	263068427	/nfs/dbraw/zinc/06/84/27/263068427.db2.gz	YPPOWWKWWBTDRV-UHFFFAOYSA-N	0	0	294.398	4.352	20	30		CIEDRN
N#CC1(CCCN2CCC=Cc3ccccc32)CCOCC1	ZINC000281458280	263069278	/nfs/dbraw/zinc/06/92/78/263069278.db2.gz	VDYFKPPFDZHDNF-UHFFFAOYSA-N	0	0	296.414	4.010	20	30		CIEDRN
CCCC[C@H](C)C(=O)Nc1ccccc1SCCC#N	ZINC000281760485	263071594	/nfs/dbraw/zinc/07/15/94/263071594.db2.gz	CIVAXGSVYQXLCF-ZDUSSCGKSA-N	0	0	290.432	4.457	20	30		CIEDRN
CC(C)(C#N)CCOc1cccc(Oc2cccnc2)c1	ZINC000281933055	263073135	/nfs/dbraw/zinc/07/31/35/263073135.db2.gz	OWQDODLJXLYJCO-UHFFFAOYSA-N	0	0	282.343	4.193	20	30		CIEDRN
C=CCN(CCc1ccccc1)Cc1csc(C2CC2)n1	ZINC000340142131	263077144	/nfs/dbraw/zinc/07/71/44/263077144.db2.gz	CYQJMUPPQKDGBL-UHFFFAOYSA-N	0	0	298.455	4.251	20	30		CIEDRN
CO[C@@H](CSCCCC#N)c1ccc(Cl)cc1	ZINC000282742684	263078412	/nfs/dbraw/zinc/07/84/12/263078412.db2.gz	YCGDFLCMHUOGBP-ZDUSSCGKSA-N	0	0	269.797	4.064	20	30		CIEDRN
N#CCCCOc1cccc(N[C@@H]2CCC23CCC3)c1	ZINC000282874351	263079249	/nfs/dbraw/zinc/07/92/49/263079249.db2.gz	VJHIAXFBXQOAPR-MRXNPFEDSA-N	0	0	270.376	4.114	20	30		CIEDRN
CC(C)(C#N)CCCCOc1ccnc(C(F)(F)F)c1	ZINC000283794357	263084253	/nfs/dbraw/zinc/08/42/53/263084253.db2.gz	GDXOWRCGCWHCFC-UHFFFAOYSA-N	0	0	286.297	4.199	20	30		CIEDRN
CCC(C)(C)c1ccc(C[S@](=O)CCCCC#N)cc1	ZINC000285118937	263090329	/nfs/dbraw/zinc/09/03/29/263090329.db2.gz	NCECNGLTDLMJPP-HXUWFJFHSA-N	0	0	291.460	4.317	20	30		CIEDRN
CC(C)(C#N)CCCCOc1ccc2c(c1F)CCC2=O	ZINC000286574787	263098853	/nfs/dbraw/zinc/09/88/53/263098853.db2.gz	QWUDBSVJIZXWGX-UHFFFAOYSA-N	0	0	289.350	4.053	20	30		CIEDRN
C[C@@H](c1ccc(C(C)(C)C)cc1)[S@](=O)CCCC#N	ZINC000287108156	263100970	/nfs/dbraw/zinc/10/09/70/263100970.db2.gz	APHDPKSFOODACE-ORAYPTAESA-N	0	0	277.433	4.098	20	30		CIEDRN
Cc1cccc2cc(C(=O)N(CC#N)C3CCCC3)sc21	ZINC000288383444	263104050	/nfs/dbraw/zinc/10/40/50/263104050.db2.gz	GFZNNLBPHFUVGO-UHFFFAOYSA-N	0	0	298.411	4.118	20	30		CIEDRN
CC(C)(C#N)CCNc1ccccc1N1CCCCC1	ZINC000288682123	263105508	/nfs/dbraw/zinc/10/55/08/263105508.db2.gz	IXIVEDKTTJYWPT-UHFFFAOYSA-N	0	0	271.408	4.029	20	30		CIEDRN
Cc1ccc(-c2ncco2)cc1NCCC(C)(C)C#N	ZINC000288739709	263105683	/nfs/dbraw/zinc/10/56/83/263105683.db2.gz	OZBOTQYLAGZCON-UHFFFAOYSA-N	0	0	269.348	4.002	20	30		CIEDRN
CC(C)(C#N)CCNc1cccc(Oc2ccccn2)c1	ZINC000288722428	263105814	/nfs/dbraw/zinc/10/58/14/263105814.db2.gz	MJHIFIBBRZYRAC-UHFFFAOYSA-N	0	0	281.359	4.226	20	30		CIEDRN
CC[C@@](C)(C#N)c1nc(Cc2cccc3ccccc32)no1	ZINC000288877869	263106314	/nfs/dbraw/zinc/10/63/14/263106314.db2.gz	DBZVISOFQPJESF-SFHVURJKSA-N	0	0	291.354	4.005	20	30		CIEDRN
CCCCCCCC(=O)Nc1cccnc1C(F)(F)F	ZINC000289117705	263107490	/nfs/dbraw/zinc/10/74/90/263107490.db2.gz	MECACAGRKDHJDL-UHFFFAOYSA-N	0	0	288.313	4.399	20	30		CIEDRN
CC[C@@](C)(C#N)c1nc(-c2ccc(Cl)cc2Cl)no1	ZINC000289180254	263107986	/nfs/dbraw/zinc/10/79/86/263107986.db2.gz	WERRBKADURVMDZ-ZDUSSCGKSA-N	0	0	296.157	4.235	20	30		CIEDRN
C[C@H](SCCC(C)(C)C#N)c1cccc([N+](=O)[O-])c1	ZINC000289348626	263109304	/nfs/dbraw/zinc/10/93/04/263109304.db2.gz	GIKJERTZJWDHFI-NSHDSACASA-N	0	0	278.377	4.329	20	30		CIEDRN
CC(C)(C)c1cnc(CSCCC(C)(C)C#N)o1	ZINC000289411382	263110036	/nfs/dbraw/zinc/11/00/36/263110036.db2.gz	OOUQHOKHUIDSMS-UHFFFAOYSA-N	0	0	266.410	4.145	20	30		CIEDRN
CC1(C#N)CCN(C(=O)c2ccc(C3=CCCC3)cc2)CC1	ZINC000290394152	263116416	/nfs/dbraw/zinc/11/64/16/263116416.db2.gz	KYLBOARZEDEWHI-UHFFFAOYSA-N	0	0	294.398	4.020	20	30		CIEDRN
CCCC[C@@H](C)N(C)C(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000290955552	263119448	/nfs/dbraw/zinc/11/94/48/263119448.db2.gz	NAOPSFRRLSSSSN-CQSZACIVSA-N	0	0	286.419	4.138	20	30		CIEDRN
Cc1cccc(N(Cc2ccccc2)C(=O)CCCC#N)c1	ZINC000291278792	263121039	/nfs/dbraw/zinc/12/10/39/263121039.db2.gz	YPPLQCMPWVYNFH-UHFFFAOYSA-N	0	0	292.382	4.222	20	30		CIEDRN
N#CCCCC(=O)N1CCCC[C@@H]1CCCc1ccccc1	ZINC000291828975	263125857	/nfs/dbraw/zinc/12/58/57/263125857.db2.gz	DRROHIZSEMAVPS-GOSISDBHSA-N	0	0	298.430	4.084	20	30		CIEDRN
Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)CCCC#N	ZINC000291849477	263126032	/nfs/dbraw/zinc/12/60/32/263126032.db2.gz	GITDWYFYAYPVQW-OAHLLOKOSA-N	0	0	299.418	4.006	20	30		CIEDRN
N#CCCN(CC1CC1)C(=O)Nc1cccc(C2CCC2)c1	ZINC000292101954	263128452	/nfs/dbraw/zinc/12/84/52/263128452.db2.gz	RXZYBRWJVPWDHB-UHFFFAOYSA-N	0	0	297.402	4.112	20	30		CIEDRN
N#CCCCC(=O)N(Cc1ccc2ccccc2c1)C1CC1	ZINC000292329579	263131208	/nfs/dbraw/zinc/13/12/08/263131208.db2.gz	MYKNRMDOUOXBFP-UHFFFAOYSA-N	0	0	292.382	4.025	20	30		CIEDRN
N#C[C@@]1(C(=O)Nc2cccc(C(F)F)c2)CC12CCCC2	ZINC000294555034	263163524	/nfs/dbraw/zinc/16/35/24/263163524.db2.gz	MXADNIZPVCEHQA-MRXNPFEDSA-N	0	0	290.313	4.037	20	30		CIEDRN
CC(C)CCCC(=O)Nc1ccccc1SCCC#N	ZINC000294570736	263163886	/nfs/dbraw/zinc/16/38/86/263163886.db2.gz	JZCXLLQYJGJOPK-UHFFFAOYSA-N	0	0	290.432	4.457	20	30		CIEDRN
N#CC[C@@H]1CC[C@H](Nc2ccc(C#N)c(C(F)(F)F)c2)C1	ZINC000295038898	263171241	/nfs/dbraw/zinc/17/12/41/263171241.db2.gz	SOUQEUKQBDZYLL-JQWIXIFHSA-N	0	0	293.292	4.071	20	30		CIEDRN
CC[C@@H](C)[C@H](C(=O)N[C@H]1CC[C@@H](CC#N)C1)c1ccccc1	ZINC000295600051	263180064	/nfs/dbraw/zinc/18/00/64/263180064.db2.gz	SGPHMCNNKSFUGD-FZCLSBEQSA-N	0	0	298.430	4.015	20	30		CIEDRN
CC(C)[C@H](CC(=O)N[C@H]1CC[C@@H](CC#N)C1)c1ccccc1	ZINC000295598362	263180162	/nfs/dbraw/zinc/18/01/62/263180162.db2.gz	SBSHOHYZJSPYCH-SZMVWBNQSA-N	0	0	298.430	4.015	20	30		CIEDRN
CC(C)(C)Sc1ccc(NC(=O)CCCC#N)cc1F	ZINC000295601738	263180324	/nfs/dbraw/zinc/18/03/24/263180324.db2.gz	SNBRVKVLTAYXJW-UHFFFAOYSA-N	0	0	294.395	4.349	20	30		CIEDRN
CC(C)c1ccccc1NC(=O)N[C@H]1CC[C@@H](CC#N)C1	ZINC000296389505	263190977	/nfs/dbraw/zinc/19/09/77/263190977.db2.gz	SRXZRGFAQUEUBZ-KBPBESRZSA-N	0	0	285.391	4.014	20	30		CIEDRN
C[C@H](C#N)CSc1ccccc1NCC1CC(F)(F)C1	ZINC000297544529	263206373	/nfs/dbraw/zinc/20/63/73/263206373.db2.gz	FGTUYNGRCOMWBY-LLVKDONJSA-N	0	0	296.386	4.396	20	30		CIEDRN
C=CCC(F)(F)c1nc([C@H]2CCC[C@@H](C)C2)no1	ZINC000340594746	263215613	/nfs/dbraw/zinc/21/56/13/263215613.db2.gz	CLEORRAYGROSLK-ZJUUUORDSA-N	0	0	256.296	4.031	20	30		CIEDRN
C=CCC(F)(F)c1nc([C@H]2CCC[C@H](C)C2)no1	ZINC000340594744	263215657	/nfs/dbraw/zinc/21/56/57/263215657.db2.gz	CLEORRAYGROSLK-UWVGGRQHSA-N	0	0	256.296	4.031	20	30		CIEDRN
CC[C@H]([NH2+][C@H](C)CCC#N)c1ccc(Cl)s1	ZINC000299008376	263229034	/nfs/dbraw/zinc/22/90/34/263229034.db2.gz	QSPMUFKMCPEYKL-ZJUUUORDSA-N	0	0	256.802	4.134	20	30		CIEDRN
C=CCC[C@@H](Nc1cnn([C@@H](C)C2CC2)c1)C1CC1	ZINC000187624596	263264917	/nfs/dbraw/zinc/26/49/17/263264917.db2.gz	IEYGZSMWSWAOLS-BLLLJJGKSA-N	0	0	259.397	4.011	20	30		CIEDRN
C=CCC[C@H](Nc1cnn([C@@H](C)C2CC2)c1)C1CC1	ZINC000187624562	263265129	/nfs/dbraw/zinc/26/51/29/263265129.db2.gz	IEYGZSMWSWAOLS-LRDDRELGSA-N	0	0	259.397	4.011	20	30		CIEDRN
N#CCC[C@H](Nc1ccc([N+](=O)[O-])cc1F)c1ccccc1	ZINC000164294265	263270271	/nfs/dbraw/zinc/27/02/71/263270271.db2.gz	LSEOZJPMLIDTAZ-HNNXBMFYSA-N	0	0	299.305	4.191	20	30		CIEDRN
C[C@@H]1CC[C@@H](CC(=O)Nc2ccc(C(C)(C)C#N)cc2)C1	ZINC000119856385	263280305	/nfs/dbraw/zinc/28/03/05/263280305.db2.gz	RXUGVATYLYFIDH-ZIAGYGMSSA-N	0	0	284.403	4.253	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)[C@@H](C)c1ccc(F)cc1	ZINC000121618972	263297222	/nfs/dbraw/zinc/29/72/22/263297222.db2.gz	NHHKXSCDGUHHGZ-ZDUSSCGKSA-N	0	0	275.367	4.114	20	30		CIEDRN
C[C@H](NC(=O)C1(C#N)CCCC1)c1ccc(C(C)(C)C)cc1	ZINC000045413554	263301432	/nfs/dbraw/zinc/30/14/32/263301432.db2.gz	TYMRNBXRVQCUHC-AWEZNQCLSA-N	0	0	298.430	4.245	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)c1ccnc(C2CC2)c1	ZINC000341076087	263323536	/nfs/dbraw/zinc/32/35/36/263323536.db2.gz	WMORWUWYZOISFW-UHFFFAOYSA-N	0	0	298.430	4.168	20	30		CIEDRN
CC#CCCCC(=O)N[C@H](CC1CCC1)c1ccccc1	ZINC000341328461	263331253	/nfs/dbraw/zinc/33/12/53/263331253.db2.gz	FLYRMPFYFNQYNZ-GOSISDBHSA-N	0	0	283.415	4.228	20	30		CIEDRN
CC(C)(CCC#N)CNc1ccc(F)c(C2CC2)c1	ZINC000341509089	263340195	/nfs/dbraw/zinc/34/01/95/263340195.db2.gz	FZIAEFIMDCHOIC-UHFFFAOYSA-N	0	0	260.356	4.445	20	30		CIEDRN
CCC(CC)[C@@H](C)C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000341876891	263361593	/nfs/dbraw/zinc/36/15/93/263361593.db2.gz	PWUXGUGPTARVCV-RHSMWYFYSA-N	0	0	286.419	4.220	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@H](CC)c1cccc(Cl)c1	ZINC000342098813	263386869	/nfs/dbraw/zinc/38/68/69/263386869.db2.gz	GQBNSNWDECBQBM-SMDDNHRTSA-N	0	0	280.799	4.055	20	30		CIEDRN
Cc1ccc2oc(S[C@H](C)c3ccc(C#N)cc3)nc2n1	ZINC000342436769	263434136	/nfs/dbraw/zinc/43/41/36/263434136.db2.gz	RGQKNQVTMWULHG-LLVKDONJSA-N	0	0	295.367	4.256	20	30		CIEDRN
Cc1cccc(NC(=O)c2cc(C#N)ccc2Cl)c1C	ZINC000334298584	263548544	/nfs/dbraw/zinc/54/85/44/263548544.db2.gz	DXSGDOHTNDMYCB-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)Cc1cccc(C2CC2)c1	ZINC000415471377	263634187	/nfs/dbraw/zinc/63/41/87/263634187.db2.gz	QDOBTFMGUUIXHJ-UHFFFAOYSA-N	0	0	298.430	4.037	20	30		CIEDRN
N#Cc1ccc2c(c1)CCC[C@@H]2NC(=O)C1CCCCCC1	ZINC000416095233	263667928	/nfs/dbraw/zinc/66/79/28/263667928.db2.gz	GLONKFSYFCYCGD-SFHVURJKSA-N	0	0	296.414	4.022	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccccc1OCC(F)F	ZINC000123449052	263812404	/nfs/dbraw/zinc/81/24/04/263812404.db2.gz	LQBOPPMFMXKIHN-UHFFFAOYSA-N	0	0	295.329	4.037	20	30		CIEDRN
Cc1cscc1CNC(=O)c1coc(C2CCCC2)n1	ZINC000328662117	263834763	/nfs/dbraw/zinc/83/47/63/263834763.db2.gz	AJVSOEUEPVVGGD-UHFFFAOYSA-N	0	0	290.388	4.207	20	30		CIEDRN
C[C@H](NC(=O)CC1CCCCC1)C(=O)N[C@@H]1C=CCCC1	ZINC000328664840	263835414	/nfs/dbraw/zinc/83/54/14/263835414.db2.gz	BVNLSIOVQRUBFG-DZGCQCFKSA-N	0	0	292.423	4.367	20	30		CIEDRN
C[C@H](CC1CCCC1)C(=O)N[C@H]1CCC(=O)NC12CCC2	ZINC000328737663	263850957	/nfs/dbraw/zinc/85/09/57/263850957.db2.gz	KIPLKVFTOHWSKB-OCCSQVGLSA-N	0	0	292.423	4.201	20	30		CIEDRN
C[C@H]1CC(NC(=O)Nc2scnc2C2CC2)C[C@H](C)C1	ZINC000328914921	263901291	/nfs/dbraw/zinc/90/12/91/263901291.db2.gz	JFUUAHFSRATVIH-NXEZZACHSA-N	0	0	293.436	4.171	20	30		CIEDRN
Cc1ccc(Cl)cc1C(=O)N[C@](C)(C#N)CC(C)C	ZINC000330407275	263930894	/nfs/dbraw/zinc/93/08/94/263930894.db2.gz	ZMYOOWSBIBZRHP-HNNXBMFYSA-N	0	0	278.783	4.281	20	30		CIEDRN
CCC[C@@H](CC)NC(=O)Nc1ncc(C(F)(F)F)s1	ZINC000330424905	263936668	/nfs/dbraw/zinc/93/66/68/263936668.db2.gz	FVYWVKVBWUSUOV-SSDOTTSWSA-N	0	0	295.330	4.067	20	30		CIEDRN
Cc1nc([C@@H](C)NC(=O)c2occc2C(C)C)cs1	ZINC000330472452	263944727	/nfs/dbraw/zinc/94/47/27/263944727.db2.gz	AGZHNRZTIRSVAT-SECBINFHSA-N	0	0	278.377	4.234	20	30		CIEDRN
CC[C@@H](NC(=O)c1cc(C(C)C)oc1C)C1CCOCC1	ZINC000330599369	263982027	/nfs/dbraw/zinc/98/20/27/263982027.db2.gz	BZOVSMRDZOGQNH-OAHLLOKOSA-N	0	0	293.407	4.221	20	30		CIEDRN
C[C@H](NC(=O)c1ccoc1)c1nc(C(C)(C)C)cs1	ZINC000330639809	263984704	/nfs/dbraw/zinc/98/47/04/263984704.db2.gz	DRBCVXJKTRAZDE-VIFPVBQESA-N	0	0	278.377	4.099	20	30		CIEDRN
CCCCc1ccc(NC(=O)N[C@@H]2CCC[C@@H]2C#N)cc1	ZINC000330778381	264035458	/nfs/dbraw/zinc/03/54/58/264035458.db2.gz	VIXINPGECJZQMP-GDBMZVCRSA-N	0	0	285.391	4.047	20	30		CIEDRN
CCc1noc(C)c1C(=O)NC(C)(C)c1cccc(C)c1	ZINC000330801267	264041860	/nfs/dbraw/zinc/04/18/60/264041860.db2.gz	GTLDGMXPBXONFX-UHFFFAOYSA-N	0	0	286.375	4.094	20	30		CIEDRN
CCC(C)(C)NC(=O)Nc1ccnn1[C@@H](C)CC(C)C	ZINC000330887057	264063527	/nfs/dbraw/zinc/06/35/27/264063527.db2.gz	SJHYJBXSCFAKAY-LBPRGKRZSA-N	0	0	280.416	4.005	20	30		CIEDRN
Cc1nc(C)c(NC(=O)N[C@@H](C)c2ccc(C)cc2)s1	ZINC000330932967	264096458	/nfs/dbraw/zinc/09/64/58/264096458.db2.gz	BMIUIKLIWUWHPZ-JTQLQIEISA-N	0	0	289.404	4.155	20	30		CIEDRN
CCC1(CNC(=O)c2ccc([N+](=O)[O-])cc2F)CCCC1	ZINC000331003117	264105734	/nfs/dbraw/zinc/10/57/34/264105734.db2.gz	ORRWRPCUTQNHBH-UHFFFAOYSA-N	0	0	294.326	4.009	20	30		CIEDRN
CO[C@H](C)c1nc(C)c(C(=O)NCC2CCCCC2)s1	ZINC000331094168	264120774	/nfs/dbraw/zinc/12/07/74/264120774.db2.gz	AGTDYIJNKPXBBR-LLVKDONJSA-N	0	0	296.436	4.044	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cc(C#N)ccc1OC(C)C	ZINC000126149373	264122924	/nfs/dbraw/zinc/12/29/24/264122924.db2.gz	YPFFYKMEBAMSPL-UHFFFAOYSA-N	0	0	298.386	4.052	20	30		CIEDRN
CC(C)c1ccc([C@H](C)CC(=O)N[C@H]2CCC[C@H]2C#N)cc1	ZINC000331115106	264128719	/nfs/dbraw/zinc/12/87/19/264128719.db2.gz	VBHLATDFSHNMIA-JLSDUUJJSA-N	0	0	298.430	4.112	20	30		CIEDRN
CCc1ocnc1C(=O)N[C@H](C)[C@@H](C)C1CCCCC1	ZINC000331122306	264130774	/nfs/dbraw/zinc/13/07/74/264130774.db2.gz	XUROKLFCRUGBSD-VXGBXAGGSA-N	0	0	278.396	4.147	20	30		CIEDRN
Cc1csc([C@@H](C)NC(=O)c2ccoc2C(C)C)n1	ZINC000331090584	264133897	/nfs/dbraw/zinc/13/38/97/264133897.db2.gz	VFDXVBQIHKIDLS-SNVBAGLBSA-N	0	0	278.377	4.234	20	30		CIEDRN
Cc1cc(C)nc(NC(=O)c2scnc2C(C)(C)C)c1	ZINC000331230173	264152447	/nfs/dbraw/zinc/15/24/47/264152447.db2.gz	HMIIASUADHUUQH-UHFFFAOYSA-N	0	0	289.404	4.089	20	30		CIEDRN
CCc1ccc(NC(=O)NCC2CCC(C#N)CC2)cc1C	ZINC000331276427	264170533	/nfs/dbraw/zinc/17/05/33/264170533.db2.gz	QUHZMCLWMBWMEL-UHFFFAOYSA-N	0	0	299.418	4.213	20	30		CIEDRN
Cc1oc(C#N)cc1C(=O)NCCCC1CCCCC1	ZINC000331236721	264175055	/nfs/dbraw/zinc/17/50/55/264175055.db2.gz	UNNNRKWXBIYNDS-UHFFFAOYSA-N	0	0	274.364	4.125	20	30		CIEDRN
Cc1nc2cc(Cl)c(NC(=O)NCC(C)C)cc2s1	ZINC000331255607	264182678	/nfs/dbraw/zinc/18/26/78/264182678.db2.gz	YQQTWRFAASAIBM-UHFFFAOYSA-N	0	0	297.811	4.240	20	30		CIEDRN
CC(C)OCc1ccc(NC(=O)N[C@@H]2CC[C@@H](C)C2)cc1	ZINC000331310535	264186438	/nfs/dbraw/zinc/18/64/38/264186438.db2.gz	YUANZPJMJIGPBE-CZUORRHYSA-N	0	0	290.407	4.126	20	30		CIEDRN
CCC(C)(C)C1CCC(NC(=O)C(=O)c2ccc[nH]2)CC1	ZINC000331342035	264195497	/nfs/dbraw/zinc/19/54/97/264195497.db2.gz	SXZGMSQISKFDMG-UHFFFAOYSA-N	0	0	290.407	4.149	20	30		CIEDRN
CC[C@H](C)C[C@@H](C)NC(=O)Nc1c(C)cc(C)nc1C	ZINC000331344050	264195851	/nfs/dbraw/zinc/19/58/51/264195851.db2.gz	UMOLXFMLGTZXMA-CMPLNLGQSA-N	0	0	277.412	4.157	20	30		CIEDRN
COc1cc(C(=O)NC2(C)CCCCC2)cc(Cl)c1O	ZINC000331288897	264195929	/nfs/dbraw/zinc/19/59/29/264195929.db2.gz	VGANNNQILSDNJW-UHFFFAOYSA-N	0	0	297.782	4.082	20	30		CIEDRN
Cc1cccc(OC(F)F)c1NC(=O)N[C@@H]1CC[C@H](C)C1	ZINC000331288681	264196264	/nfs/dbraw/zinc/19/62/64/264196264.db2.gz	IOXRCVZLXGJKTM-GXSJLCMTSA-N	0	0	298.333	4.111	20	30		CIEDRN
CCCc1csc(CN(C)[C@@H](C)c2cccc(C#N)c2)n1	ZINC000425366162	264212360	/nfs/dbraw/zinc/21/23/60/264212360.db2.gz	OJTFEZXVUVIAEF-ZDUSSCGKSA-N	0	0	299.443	4.160	20	30		CIEDRN
Cc1cc(C[N@@H+](C)[C@H](C)c2cccc(C#N)c2)cc(C)c1O	ZINC000425367832	264213026	/nfs/dbraw/zinc/21/30/26/264213026.db2.gz	VCSAIWOEKVHANW-OAHLLOKOSA-N	0	0	294.398	4.074	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N1CC2(CCCC2)[C@H]1C(C)C	ZINC000424867115	264241268	/nfs/dbraw/zinc/24/12/68/264241268.db2.gz	PZJAHGQJTQCMEX-CQSZACIVSA-N	0	0	263.425	4.016	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N1CCC(C)(C(C)C)CC1	ZINC000188776409	264241991	/nfs/dbraw/zinc/24/19/91/264241991.db2.gz	PEZXFFYBEXVOSA-UHFFFAOYSA-N	0	0	299.418	4.157	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(Oc2cc(C)[nH]n2)cc1	ZINC000188733276	264243271	/nfs/dbraw/zinc/24/32/71/264243271.db2.gz	SWCRDFREOFAABF-QGZVFWFLSA-N	0	0	299.374	4.051	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1ccc2nc(C)ccc2c1	ZINC000343260794	264243497	/nfs/dbraw/zinc/24/34/97/264243497.db2.gz	QXWZEJUFKKDION-ZDUSSCGKSA-N	0	0	282.387	4.018	20	30		CIEDRN
CC(C)CCN(CCC#N)C(=O)Nc1ccsc1Cl	ZINC000189380798	264298410	/nfs/dbraw/zinc/29/84/10/264298410.db2.gz	LCDBIBIKWHVVMH-UHFFFAOYSA-N	0	0	299.827	4.195	20	30		CIEDRN
Cc1cc(C)c(C#N)c(S[C@@H](C)c2cccc(C#N)c2)n1	ZINC000189769367	264332903	/nfs/dbraw/zinc/33/29/03/264332903.db2.gz	YFSYMTQBBDHDDO-ZDUSSCGKSA-N	0	0	293.395	4.295	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1nccc2sccc21	ZINC000162732775	264334329	/nfs/dbraw/zinc/33/43/29/264334329.db2.gz	PEQWNHWWLQRYHV-UHFFFAOYSA-N	0	0	272.373	4.003	20	30		CIEDRN
C[C@@H](Sc1ccccc1C#N)c1cccc(C#N)c1	ZINC000189850340	264334403	/nfs/dbraw/zinc/33/44/03/264334403.db2.gz	ZOFBRPNCGPISQM-GFCCVEGCSA-N	0	0	264.353	4.283	20	30		CIEDRN
C[C@H](Sc1ccccc1O)c1cccc(C#N)c1	ZINC000189841468	264334482	/nfs/dbraw/zinc/33/44/82/264334482.db2.gz	IOKXLXIOAKRVAT-NSHDSACASA-N	0	0	255.342	4.117	20	30		CIEDRN
C[C@@H](Sc1ccccc1O)c1cccc(C#N)c1	ZINC000189841487	264334651	/nfs/dbraw/zinc/33/46/51/264334651.db2.gz	IOKXLXIOAKRVAT-LLVKDONJSA-N	0	0	255.342	4.117	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)NCc1ccc(OCCC)cc1C	ZINC000475888157	264338946	/nfs/dbraw/zinc/33/89/46/264338946.db2.gz	YPHDFPMAGINJLS-GOSISDBHSA-N	0	0	289.419	4.002	20	30		CIEDRN
C=CCCCN(C)C(=O)N[C@@H](C)c1cc(C)sc1C	ZINC000076946703	264350524	/nfs/dbraw/zinc/35/05/24/264350524.db2.gz	MLENCDSXOLSOBA-LBPRGKRZSA-N	0	0	280.437	4.034	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc3c(c2)CC(C)(C)O3)CC1	ZINC000476340287	264362372	/nfs/dbraw/zinc/36/23/72/264362372.db2.gz	ONWCSOFBSQTZAL-UHFFFAOYSA-N	0	0	285.387	4.085	20	30		CIEDRN
C=CCN(C(=O)C1CCC1)c1nc(-c2ccccc2)cs1	ZINC000057329434	264396433	/nfs/dbraw/zinc/39/64/33/264396433.db2.gz	LHPQVVZHOQLPHQ-UHFFFAOYSA-N	0	0	298.411	4.129	20	30		CIEDRN
CCCOCc1ccccc1CNc1ccc(C#N)cc1F	ZINC000060355834	264494130	/nfs/dbraw/zinc/49/41/30/264494130.db2.gz	YTPVICWZDYCYCD-UHFFFAOYSA-N	0	0	298.361	4.236	20	30		CIEDRN
C=C(C)CCSCc1nc([C@@H](C)SCC)no1	ZINC000284927852	264536060	/nfs/dbraw/zinc/53/60/60/264536060.db2.gz	BEIFAXHABQTBBS-SNVBAGLBSA-N	0	0	272.439	4.083	20	30		CIEDRN
CCC[C@H]1CCCCN1C(=O)Nc1cccc(C#N)c1C	ZINC000183276171	264543410	/nfs/dbraw/zinc/54/34/10/264543410.db2.gz	RLDKYNIIDPLARH-HNNXBMFYSA-N	0	0	285.391	4.053	20	30		CIEDRN
C=C(C)CCSCc1csc([C@H](C)OC)n1	ZINC000285157557	264549816	/nfs/dbraw/zinc/54/98/16/264549816.db2.gz	SEKUABXFNJWQJL-JTQLQIEISA-N	0	0	257.424	4.050	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(SC)cc2OC)CCC1	ZINC000192973417	264618685	/nfs/dbraw/zinc/61/86/85/264618685.db2.gz	DLZSVZVVKIQESU-UHFFFAOYSA-N	0	0	291.416	4.102	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc([C@@H]2CCC(F)(F)C2)no1	ZINC000289027480	264699346	/nfs/dbraw/zinc/69/93/46/264699346.db2.gz	FZOFZDUEACAJNQ-NXEZZACHSA-N	0	0	256.296	4.042	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(Oc2cc(C)[nH]n2)cc1	ZINC000184502243	264800884	/nfs/dbraw/zinc/80/08/84/264800884.db2.gz	UPMMHPJPUNQNND-GFCCVEGCSA-N	0	0	299.374	4.051	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)CC2=CCCCC2)cc1	ZINC000106612096	264931063	/nfs/dbraw/zinc/93/10/63/264931063.db2.gz	FRNNMGYMXWYHFF-UHFFFAOYSA-N	0	0	282.387	4.317	20	30		CIEDRN
C[C@@H](SCc1ccc(CO)cc1)c1cccc(C#N)c1	ZINC000190822640	264978594	/nfs/dbraw/zinc/97/85/94/264978594.db2.gz	DGOUYDIYFSALNW-CYBMUJFWSA-N	0	0	283.396	4.045	20	30		CIEDRN
CC(C)c1ccc(NCc2cc(C#N)cs2)cc1	ZINC000093492454	265183394	/nfs/dbraw/zinc/18/33/94/265183394.db2.gz	VOKYDOJBJUFTND-UHFFFAOYSA-N	0	0	256.374	4.355	20	30		CIEDRN
Cc1ccc(NCc2cc(C#N)cs2)cc1Cl	ZINC000093684863	265189993	/nfs/dbraw/zinc/18/99/93/265189993.db2.gz	YXHKXERKPJUYSE-UHFFFAOYSA-N	0	0	262.765	4.194	20	30		CIEDRN
Cc1cc(Oc2ccc(C#N)c([N+](=O)[O-])c2)ccc1Cl	ZINC000094593471	265244097	/nfs/dbraw/zinc/24/40/97/265244097.db2.gz	FIRXUHXEULBQIM-UHFFFAOYSA-N	0	0	288.690	4.221	20	30		CIEDRN
N#Cc1ccc(CSc2cccc(F)c2)c(F)c1	ZINC000094623175	265246164	/nfs/dbraw/zinc/24/61/64/265246164.db2.gz	BVGODTWWBUBCGU-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
N#CCc1ccc(NCc2ccc(C3CC3)cc2)cc1	ZINC000094518762	265247039	/nfs/dbraw/zinc/24/70/39/265247039.db2.gz	STIWBHLXDSLGPT-UHFFFAOYSA-N	0	0	262.356	4.242	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2cccc(NC(=O)CC)c2)no1	ZINC000518951934	265247146	/nfs/dbraw/zinc/24/71/46/265247146.db2.gz	FVDJJLRFPCIOAK-GFCCVEGCSA-N	0	0	299.374	4.155	20	30		CIEDRN
CC(C)(C#N)CCSCCCc1cccc(F)c1	ZINC000519220605	265366635	/nfs/dbraw/zinc/36/66/35/265366635.db2.gz	PFWCNSSSGZYOOY-UHFFFAOYSA-N	0	0	265.397	4.431	20	30		CIEDRN
C=CCn1c2ccccc2nc1SCc1conc1CC	ZINC000519761787	265583901	/nfs/dbraw/zinc/58/39/01/265583901.db2.gz	BIFKIJJEVYSYND-UHFFFAOYSA-N	0	0	299.399	4.065	20	30		CIEDRN
CCN(C(=O)[C@@H]1CCC(C)=C(C)C1)c1ccc(C#N)cc1	ZINC000516971591	266010108	/nfs/dbraw/zinc/01/01/08/266010108.db2.gz	FKFDVQCMQNRRAH-MRXNPFEDSA-N	0	0	282.387	4.048	20	30		CIEDRN
C[C@@H](Nc1cnccc1C#N)c1cc2cccc(F)c2o1	ZINC000353057696	266026559	/nfs/dbraw/zinc/02/65/59/266026559.db2.gz	PPXOOGYMGDBNHZ-SNVBAGLBSA-N	0	0	281.290	4.012	20	30		CIEDRN
N#Cc1ccc(SCc2ncoc2C2CC2)c(Cl)c1	ZINC000356162407	266059592	/nfs/dbraw/zinc/05/95/92/266059592.db2.gz	FHVQINFIPQDUOL-UHFFFAOYSA-N	0	0	290.775	4.369	20	30		CIEDRN
Cc1c(F)cccc1NC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000356208861	266071468	/nfs/dbraw/zinc/07/14/68/266071468.db2.gz	DAJPOADZIDUFFV-OAHLLOKOSA-N	0	0	296.345	4.160	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1ccncc1C	ZINC000356227545	266077256	/nfs/dbraw/zinc/07/72/56/266077256.db2.gz	ZFTVQJNVXFXGOB-UHFFFAOYSA-N	0	0	294.398	4.494	20	30		CIEDRN
C=CCCC1(C(=O)NCc2ccc(C)cc2SC)CC1	ZINC000356397357	266107469	/nfs/dbraw/zinc/10/74/69/266107469.db2.gz	PODGFXDONYGWPA-UHFFFAOYSA-N	0	0	289.444	4.080	20	30		CIEDRN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccsc1	ZINC000356548823	266135123	/nfs/dbraw/zinc/13/51/23/266135123.db2.gz	OBDLEWSGYJXEEA-UHFFFAOYSA-N	0	0	299.399	4.062	20	30		CIEDRN
CC(C)c1nc(CSc2cccc(Cl)c2C#N)no1	ZINC000357055631	266239411	/nfs/dbraw/zinc/23/94/11/266239411.db2.gz	LPHPUXCEGNLANX-UHFFFAOYSA-N	0	0	293.779	4.010	20	30		CIEDRN
N#Cc1cnccc1/C=C\c1cscc1C(F)(F)F	ZINC000357079584	266243002	/nfs/dbraw/zinc/24/30/02/266243002.db2.gz	TXKXXBIGMKXVSE-UPHRSURJSA-N	0	0	280.274	4.204	20	30		CIEDRN
Cc1ccc(C#N)c(NCc2ccc3sccc3c2)n1	ZINC000357603931	266334277	/nfs/dbraw/zinc/33/42/77/266334277.db2.gz	QKKQJFSAWCXSEV-UHFFFAOYSA-N	0	0	279.368	4.089	20	30		CIEDRN
C[C@H](Nc1cccnc1C#N)c1cc2cccc(F)c2o1	ZINC000357678806	266346052	/nfs/dbraw/zinc/34/60/52/266346052.db2.gz	FSFVDYZABKYOOE-JTQLQIEISA-N	0	0	281.290	4.012	20	30		CIEDRN
N#Cc1cc(F)c(NCc2coc3ccccc23)c(F)c1	ZINC000358205968	266438520	/nfs/dbraw/zinc/43/85/20/266438520.db2.gz	FBQVJQMXGPDPCG-UHFFFAOYSA-N	0	0	284.265	4.195	20	30		CIEDRN
C=C(CC)CSCc1cc2ccccc2[nH]c1=O	ZINC000358634770	266484133	/nfs/dbraw/zinc/48/41/33/266484133.db2.gz	LQLXEJQRSLSUMT-UHFFFAOYSA-N	0	0	259.374	4.140	20	30		CIEDRN
N#CCCCSCc1cc(-c2ccc(F)cc2)no1	ZINC000359038940	266526870	/nfs/dbraw/zinc/52/68/70/266526870.db2.gz	VQVRHRJUWLYAAF-UHFFFAOYSA-N	0	0	276.336	4.018	20	30		CIEDRN
C=CCOCCCSCc1ccc2ccccc2n1	ZINC000359131940	266539807	/nfs/dbraw/zinc/53/98/07/266539807.db2.gz	MWDYYCAARLXZEA-UHFFFAOYSA-N	0	0	273.401	4.061	20	30		CIEDRN
CCc1cnccc1[C@@H](C)NCc1ccc(Cl)cc1C#N	ZINC000360264808	266699756	/nfs/dbraw/zinc/69/97/56/266699756.db2.gz	GACAEXPRURGYHH-GFCCVEGCSA-N	0	0	299.805	4.020	20	30		CIEDRN
C#CCCCCC(=O)N1CCC[C@H]1c1cc(C)cc(C)c1	ZINC000360808400	266744538	/nfs/dbraw/zinc/74/45/38/266744538.db2.gz	BWRDSGCXUMQECN-SFHVURJKSA-N	0	0	283.415	4.161	20	30		CIEDRN
C[C@H](c1ccccc1)N(C(=O)CCCC#N)c1ccccc1	ZINC000361603073	266857601	/nfs/dbraw/zinc/85/76/01/266857601.db2.gz	VHSBLLXPASPISC-MRXNPFEDSA-N	0	0	292.382	4.475	20	30		CIEDRN
C=CCN(C(=O)c1cccc2c1ccn2CC(C)C)C1CC1	ZINC000362828163	267052351	/nfs/dbraw/zinc/05/23/51/267052351.db2.gz	WCBZGMGXZGECSD-UHFFFAOYSA-N	0	0	296.414	4.088	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H](c1ccccn1)C1CCCC1	ZINC000363155438	267077609	/nfs/dbraw/zinc/07/76/09/267077609.db2.gz	NSZDHTJTCJPRSB-SFHVURJKSA-N	0	0	298.430	4.198	20	30		CIEDRN
CCCCCCCC(=O)N1CCC([C@H]2CCCOC2)CC1	ZINC000367856344	267122714	/nfs/dbraw/zinc/12/27/14/267122714.db2.gz	UEKZJOPXCGGNSW-KRWDZBQOSA-N	0	0	295.467	4.012	20	30		CIEDRN
CCCCCCCCCCC(=O)N1CCC12CCOCC2	ZINC000368897359	267211849	/nfs/dbraw/zinc/21/18/49/267211849.db2.gz	YRGVGSCOWGNWLB-UHFFFAOYSA-N	0	0	295.467	4.299	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@@H]1c1ccc(C)s1	ZINC000370066827	267287885	/nfs/dbraw/zinc/28/78/85/267287885.db2.gz	KLLOMARFIYFXRO-CYBMUJFWSA-N	0	0	263.406	4.076	20	30		CIEDRN
CCCCCCCCCCC(=O)N1CCC2(CCO2)CC1	ZINC000374473985	267794166	/nfs/dbraw/zinc/79/41/66/267794166.db2.gz	YGVKROURDHMQHE-UHFFFAOYSA-N	0	0	295.467	4.299	20	30		CIEDRN
C=CCCC(=O)N1CCC([C@H](F)c2ccccc2F)CC1	ZINC000376025454	267932259	/nfs/dbraw/zinc/93/22/59/267932259.db2.gz	WMDMTHCGUNXXQM-KRWDZBQOSA-N	0	0	293.357	4.041	20	30		CIEDRN
C=CCN(CC)C(=O)Nc1cc(-c2cccnc2)ccc1C	ZINC000376603391	268000114	/nfs/dbraw/zinc/00/01/14/268000114.db2.gz	ZOYMALCCPWKWLB-UHFFFAOYSA-N	0	0	295.386	4.097	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1ccccc1CSCC	ZINC000448388117	327613654	/nfs/dbraw/zinc/61/36/54/327613654.db2.gz	PANVYIVCHTYLGZ-OAHLLOKOSA-N	0	0	289.444	4.120	20	30		CIEDRN
CCCCn1c(C)c(C)nc1SCC(C)(C)CC#N	ZINC000570739383	327615641	/nfs/dbraw/zinc/61/56/41/327615641.db2.gz	AFJQCOANTUDYDJ-UHFFFAOYSA-N	0	0	279.453	4.332	20	30		CIEDRN
Cc1ccc(C#N)c(N[C@H]2CCSc3c(F)cccc32)n1	ZINC000160558930	327621378	/nfs/dbraw/zinc/62/13/78/327621378.db2.gz	NZWSKZVXXVOSPL-AWEZNQCLSA-N	0	0	299.374	4.050	20	30		CIEDRN
Cc1csc(NC(=O)CCCC(C)(C)C)c1C#N	ZINC000570883626	327630403	/nfs/dbraw/zinc/63/04/03/327630403.db2.gz	UWRKFPSHBYPUFI-UHFFFAOYSA-N	0	0	264.394	4.083	20	30		CIEDRN
C=CCN(C(=O)c1cccc(F)c1OCC)c1ccccc1	ZINC000175109368	327657929	/nfs/dbraw/zinc/65/79/29/327657929.db2.gz	ZYANDGBSBYWVJK-UHFFFAOYSA-N	0	0	299.345	4.057	20	30		CIEDRN
N#Cc1ccc(N[C@@H]2CCO[C@@H](c3ccccc3)C2)c(F)c1	ZINC000160552783	327664722	/nfs/dbraw/zinc/66/47/22/327664722.db2.gz	DIVCYNYYODWWMZ-CRAIPNDOSA-N	0	0	296.345	4.030	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NCc1coc(C)n1	ZINC000580094304	327696772	/nfs/dbraw/zinc/69/67/72/327696772.db2.gz	NFRKYHFAXXHPBR-UHFFFAOYSA-N	0	0	270.376	4.447	20	30		CIEDRN
N#Cc1c(NCc2cccs2)cccc1C(F)F	ZINC000580132740	327706415	/nfs/dbraw/zinc/70/64/15/327706415.db2.gz	AOKNHTDSUDMZIP-UHFFFAOYSA-N	0	0	264.300	4.169	20	30		CIEDRN
CC(C)Oc1ccc(C#N)cc1NC(=O)C[C@H]1C=CCCC1	ZINC000187063381	327707704	/nfs/dbraw/zinc/70/77/04/327707704.db2.gz	OBOWUAFZJHFDNJ-AWEZNQCLSA-N	0	0	298.386	4.030	20	30		CIEDRN
C=C[C@@H](CC(=O)N[C@H]1CC12CCCCC2)c1ccccc1	ZINC000536533470	327709346	/nfs/dbraw/zinc/70/93/46/327709346.db2.gz	GENNLLNXNVMJSO-RDJZCZTQSA-N	0	0	283.415	4.185	20	30		CIEDRN
CCCC(C)(C)CC(=O)N[C@](C)(C#N)C1CCCCC1	ZINC000580144644	327709504	/nfs/dbraw/zinc/70/95/04/327709504.db2.gz	RIBSVAAXZSXDGU-QGZVFWFLSA-N	0	0	278.440	4.182	20	30		CIEDRN
C=C(C)[C@H](NCc1cccnc1C)c1ccc(F)c(F)c1	ZINC000187373420	327714025	/nfs/dbraw/zinc/71/40/25/327714025.db2.gz	VSJIQWLPDHHPFR-KRWDZBQOSA-N	0	0	288.341	4.075	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc([C@H]2CCN(C)c3ccccc32)no1	ZINC000565269683	327732135	/nfs/dbraw/zinc/73/21/35/327732135.db2.gz	LNDJGQIGHLQDQS-HIFRSBDPSA-N	0	0	297.402	4.111	20	30		CIEDRN
C=CCC[C@H](C(=O)Nc1cnn(C(C)C)c1)c1ccccc1	ZINC000580271038	327753771	/nfs/dbraw/zinc/75/37/71/327753771.db2.gz	KWBNSVLBWNAJRO-KRWDZBQOSA-N	0	0	297.402	4.153	20	30		CIEDRN
CC(C)N(C(=O)c1ccc(C2(C#N)CC2)cc1)C1CCCC1	ZINC000182737301	327814959	/nfs/dbraw/zinc/81/49/59/327814959.db2.gz	HEVFPYZZEFWBIA-UHFFFAOYSA-N	0	0	296.414	4.035	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCC1(c2ccc(Cl)cc2)CC1	ZINC000582076378	327833608	/nfs/dbraw/zinc/83/36/08/327833608.db2.gz	PODRHAZUFIDCQQ-UHFFFAOYSA-N	0	0	291.822	4.090	20	30		CIEDRN
C=C(C)CN(CC)C(=O)CS[C@@H](CC)c1ccccc1	ZINC000525737556	327839165	/nfs/dbraw/zinc/83/91/65/327839165.db2.gz	NHVKDJDPGYKOCC-INIZCTEOSA-N	0	0	291.460	4.296	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccc(/C=C\C)cc1	ZINC000497413929	327864077	/nfs/dbraw/zinc/86/40/77/327864077.db2.gz	CFEDIXVAURZTDW-YVMONPNESA-N	0	0	258.365	4.150	20	30		CIEDRN
Cc1ccc(CNc2cc(C#N)c3ccccc3n2)s1	ZINC000068770403	327871132	/nfs/dbraw/zinc/87/11/32/327871132.db2.gz	AMIQKCKBWCLKLQ-UHFFFAOYSA-N	0	0	279.368	4.089	20	30		CIEDRN
N#CCSc1nc2c(o1)c(Cl)cc(Cl)c2Cl	ZINC000582113633	327871136	/nfs/dbraw/zinc/87/11/36/327871136.db2.gz	LOZUUGKTXXCKLH-UHFFFAOYSA-N	0	0	293.562	4.404	20	30		CIEDRN
C/C=C(\CC)C(=O)Nc1ccccc1SC[C@H](C)C#N	ZINC000191571064	327873864	/nfs/dbraw/zinc/87/38/64/327873864.db2.gz	OLMABFOHFYLTJQ-NASADATOSA-N	0	0	288.416	4.233	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000388479065	327883371	/nfs/dbraw/zinc/88/33/71/327883371.db2.gz	JVRRKQGNDDUKQZ-SFHVURJKSA-N	0	0	294.354	4.357	20	30		CIEDRN
COc1ccc(CC[C@@H](C)Nc2ccc(C#N)cc2F)cc1	ZINC000388524391	327885352	/nfs/dbraw/zinc/88/53/52/327885352.db2.gz	QUXXVGLHUVQHQY-CYBMUJFWSA-N	0	0	298.361	4.139	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)[C@@H](C)CSc1ccccc1	ZINC000540532341	327889611	/nfs/dbraw/zinc/88/96/11/327889611.db2.gz	OVPLEVLLPWYGEI-LSDHHAIUSA-N	0	0	291.460	4.276	20	30		CIEDRN
C#CCCCC(=O)Nc1ccc(-c2ncc(C(C)C)o2)cc1	ZINC000368978088	327901555	/nfs/dbraw/zinc/90/15/55/327901555.db2.gz	OHYGBZGKEMXIMU-UHFFFAOYSA-N	0	0	296.370	4.207	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H](CC(C)(C)C)C(F)(F)F	ZINC000188573496	327917804	/nfs/dbraw/zinc/91/78/04/327917804.db2.gz	NVHAJWZWYLMFOS-ZWNOBZJWSA-N	0	0	279.346	4.072	20	30		CIEDRN
CC[C@H]1[C@@H](c2ccc(C)cc2)CCN1C(=O)CC(C)(C)C#N	ZINC000365991497	327976350	/nfs/dbraw/zinc/97/63/50/327976350.db2.gz	VGSFHMLVVYAUSB-SJORKVTESA-N	0	0	298.430	4.029	20	30		CIEDRN
CCOc1ccc([C@H](C)Nc2ccc(F)cc2C#N)cc1	ZINC000097635298	327990214	/nfs/dbraw/zinc/99/02/14/327990214.db2.gz	FQARMADYNYOZAX-LBPRGKRZSA-N	0	0	284.334	4.269	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@@H](c1ccccc1)C1CCCC1	ZINC000182414405	327994269	/nfs/dbraw/zinc/99/42/69/327994269.db2.gz	VEJYCAUTZBBILV-KRWDZBQOSA-N	0	0	286.419	4.135	20	30		CIEDRN
C[C@@H]1CCCN(C(=O)c2cscc2C#N)c2ccccc21	ZINC000410699255	328013051	/nfs/dbraw/zinc/01/30/51/328013051.db2.gz	GMUBGYBOCBHHGC-GFCCVEGCSA-N	0	0	296.395	4.164	20	30		CIEDRN
COc1ccc(CNc2ccc(Cl)cc2C#N)c(C)c1	ZINC000531705981	328026980	/nfs/dbraw/zinc/02/69/80/328026980.db2.gz	HFAFROUUFXJZQC-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CCC(CC)(CC)C1)c1ccccc1	ZINC000533987840	328031973	/nfs/dbraw/zinc/03/19/73/328031973.db2.gz	BOJCMVNHPIGMKW-INIZCTEOSA-N	0	0	285.431	4.385	20	30		CIEDRN
C=CCN[C@@H](c1ccc(OC)cc1)c1ccccc1Cl	ZINC000531791228	328034432	/nfs/dbraw/zinc/03/44/32/328034432.db2.gz	PDCRRBGQNYBVBI-KRWDZBQOSA-N	0	0	287.790	4.214	20	30		CIEDRN
C=CCCCN(C)C(=O)[C@@H]1CC[C@H]2CCCC[C@@H]2C1	ZINC000534396144	328050899	/nfs/dbraw/zinc/05/08/99/328050899.db2.gz	ITLBGGLWTIQACI-BZUAXINKSA-N	0	0	263.425	4.018	20	30		CIEDRN
C[C@H](Cc1cccc(Cl)c1)C(=O)Nc1cccc(C#N)c1	ZINC000534413956	328051626	/nfs/dbraw/zinc/05/16/26/328051626.db2.gz	RRKDUYKKSFONFQ-GFCCVEGCSA-N	0	0	298.773	4.029	20	30		CIEDRN
C[C@@H](Cc1cccc(Cl)c1)C(=O)Nc1cccc(C#N)c1	ZINC000534413957	328051777	/nfs/dbraw/zinc/05/17/77/328051777.db2.gz	RRKDUYKKSFONFQ-LBPRGKRZSA-N	0	0	298.773	4.029	20	30		CIEDRN
CC1(C)CCC[C@H](CC(=O)Nc2ccccc2C#N)C1	ZINC000534433669	328053519	/nfs/dbraw/zinc/05/35/19/328053519.db2.gz	KPCYMSPDJZSBBS-CYBMUJFWSA-N	0	0	270.376	4.103	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)CCCCSC	ZINC000152074254	328056684	/nfs/dbraw/zinc/05/66/84/328056684.db2.gz	PXXMTPSKFPEFBD-UHFFFAOYSA-N	0	0	283.481	4.115	20	30		CIEDRN
CCN(C(=O)c1ccc(C)c(Cl)c1)c1ccc(C#N)cc1	ZINC000152143680	328073632	/nfs/dbraw/zinc/07/36/32/328073632.db2.gz	CQBPWCSGQYHESR-UHFFFAOYSA-N	0	0	298.773	4.187	20	30		CIEDRN
C=C(C)CS[C@H](C)C(=O)Nc1ccccc1SC	ZINC000563567094	328074115	/nfs/dbraw/zinc/07/41/15/328074115.db2.gz	WOKIBNSDGDXEMQ-LLVKDONJSA-N	0	0	281.446	4.045	20	30		CIEDRN
CC[C@@H](Sc1ccccc1)C(=O)Nc1ccc(C#N)cc1	ZINC000303524378	328083444	/nfs/dbraw/zinc/08/34/44/328083444.db2.gz	VOGPPMDLHQNSFI-MRXNPFEDSA-N	0	0	296.395	4.068	20	30		CIEDRN
C=CCOc1cccc(NC(=O)c2occc2C(C)C)c1	ZINC000571182308	328091238	/nfs/dbraw/zinc/09/12/38/328091238.db2.gz	AFEZJMBEUGDANO-UHFFFAOYSA-N	0	0	285.343	4.220	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cc(Cl)c(Cl)cn1	ZINC000160904136	328093742	/nfs/dbraw/zinc/09/37/42/328093742.db2.gz	HWOSTCWMBSGXKP-UHFFFAOYSA-N	0	0	285.174	4.095	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCc1c(Cl)cccc1Cl	ZINC000571236012	328094411	/nfs/dbraw/zinc/09/44/11/328094411.db2.gz	FQPRNLWMYXJIQC-UHFFFAOYSA-N	0	0	286.202	4.212	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2ccc(OCC)c(F)c2)no1	ZINC000571245056	328095013	/nfs/dbraw/zinc/09/50/13/328095013.db2.gz	LNKZBFVGMIWTAQ-LLVKDONJSA-N	0	0	290.338	4.344	20	30		CIEDRN
C=CCC1(C(=O)N2CCC[C@H](C(C)C)C2)CCCC1	ZINC000450981479	328099274	/nfs/dbraw/zinc/09/92/74/328099274.db2.gz	QBBYBZPVPOIMPB-HNNXBMFYSA-N	0	0	263.425	4.018	20	30		CIEDRN
Cc1cccc([C@H]2CCCCN2c2cc(C#N)ccn2)c1C	ZINC000571410273	328120065	/nfs/dbraw/zinc/12/00/65/328120065.db2.gz	REKYQFJNZDEYIZ-GOSISDBHSA-N	0	0	291.398	4.302	20	30		CIEDRN
CCc1nocc1CSCc1ccc(Cl)cc1C#N	ZINC000571417465	328120640	/nfs/dbraw/zinc/12/06/40/328120640.db2.gz	MGRPASPUJHMXCM-UHFFFAOYSA-N	0	0	292.791	4.195	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)Nc1ccccc1C(C)(C)C)OCC	ZINC000534462073	328130228	/nfs/dbraw/zinc/13/02/28/328130228.db2.gz	DCNRYWKUXSNNPI-MRXNPFEDSA-N	0	0	289.419	4.294	20	30		CIEDRN
C[C@H]1Sc2ccccc2N(CCCCC#N)[C@H]1C	ZINC000161119940	328132803	/nfs/dbraw/zinc/13/28/03/328132803.db2.gz	ZTTHLGLRBQUXTK-QWHCGFSZSA-N	0	0	260.406	4.070	20	30		CIEDRN
C/C=C\c1ccc(NCc2ccc(CC#N)cc2)cc1	ZINC000571560187	328134148	/nfs/dbraw/zinc/13/41/48/328134148.db2.gz	GNHXNNGZPVAKKZ-IHWYPQMZSA-N	0	0	262.356	4.398	20	30		CIEDRN
Cc1cc(C)c(CNc2cccc(C(F)F)c2C#N)cn1	ZINC000571582086	328135362	/nfs/dbraw/zinc/13/53/62/328135362.db2.gz	YEVAXOWIXBHBRJ-UHFFFAOYSA-N	0	0	287.313	4.120	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1cc(F)ccc1Cl	ZINC000571615121	328138030	/nfs/dbraw/zinc/13/80/30/328138030.db2.gz	CXYPQEFPUAMOIJ-NSHDSACASA-N	0	0	282.746	4.052	20	30		CIEDRN
Cc1cccc(C(C)C)c1NC(=O)[C@H](C)SCCC#N	ZINC000413009517	328139259	/nfs/dbraw/zinc/13/92/59/328139259.db2.gz	CWUVZXIXVCMIBB-ZDUSSCGKSA-N	0	0	290.432	4.092	20	30		CIEDRN
C[C@H](SCCC#N)c1nnc(-c2cccc(Cl)c2)o1	ZINC000413011690	328139891	/nfs/dbraw/zinc/13/98/91/328139891.db2.gz	JMHBWQHRFRKYJT-VIFPVBQESA-N	0	0	293.779	4.098	20	30		CIEDRN
CC[C@@H](CC(C)C)C(=O)N(CCC#N)c1ccc(F)cc1	ZINC000571648846	328194861	/nfs/dbraw/zinc/19/48/61/328194861.db2.gz	ATXFLRWEAODZAE-AWEZNQCLSA-N	0	0	290.382	4.145	20	30		CIEDRN
CC(C)(C#N)CCCSCc1cnn(-c2ccccc2)c1	ZINC000161184017	328210815	/nfs/dbraw/zinc/21/08/15/328210815.db2.gz	UYCNGFKGLCXCDG-UHFFFAOYSA-N	0	0	299.443	4.435	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)N(C)C[C@H](C)C#N	ZINC000276410906	328218263	/nfs/dbraw/zinc/21/82/63/328218263.db2.gz	MEWZPYMZRMXOBR-CQSZACIVSA-N	0	0	299.418	4.162	20	30		CIEDRN
N#Cc1c(NC[C@H]2CCCSC2)cccc1C(F)F	ZINC000571657701	328221150	/nfs/dbraw/zinc/22/11/50/328221150.db2.gz	PVHOTVMZRPXWMG-SNVBAGLBSA-N	0	0	282.359	4.051	20	30		CIEDRN
CC(C)(C)c1cnc(S[C@H]2CC[C@H](C#N)C2)s1	ZINC000278538142	328226760	/nfs/dbraw/zinc/22/67/60/328226760.db2.gz	JKQWJSGMTZHZAH-UWVGGRQHSA-N	0	0	266.435	4.225	20	30		CIEDRN
Cc1ccc(-c2nnc(S[C@H]3CC[C@H](C#N)C3)o2)c(C)c1	ZINC000278594184	328227958	/nfs/dbraw/zinc/22/79/58/328227958.db2.gz	QGBDQGPXMACATO-STQMWFEESA-N	0	0	299.399	4.138	20	30		CIEDRN
Cc1ccc(-c2nnc(S[C@@H]3CC[C@@H](C#N)C3)o2)c(C)c1	ZINC000278594173	328227964	/nfs/dbraw/zinc/22/79/64/328227964.db2.gz	QGBDQGPXMACATO-CHWSQXEVSA-N	0	0	299.399	4.138	20	30		CIEDRN
C[C@@H](Nc1cc(C2CC2)ccn1)c1ccc(OCC#N)cc1	ZINC000289587394	328255648	/nfs/dbraw/zinc/25/56/48/328255648.db2.gz	ATWBWNPHQZXWKS-CYBMUJFWSA-N	0	0	293.370	4.034	20	30		CIEDRN
C[C@H](C#N)S[C@@H](C)c1cccc(Br)c1	ZINC000291548499	328264952	/nfs/dbraw/zinc/26/49/52/328264952.db2.gz	AOIBCJMPASVNLB-BDAKNGLRSA-N	0	0	270.195	4.155	20	30		CIEDRN
Cc1cc(C)cc([C@H](C)Nc2ccc(C#N)cc2F)c1	ZINC000113412377	328616098	/nfs/dbraw/zinc/61/60/98/328616098.db2.gz	SBQHWVCHHWHOSP-ZDUSSCGKSA-N	0	0	268.335	4.487	20	30		CIEDRN
Cc1nocc1/C=C/C(=O)c1ccc(C(C)C)cc1	ZINC000295782940	328287103	/nfs/dbraw/zinc/28/71/03/328287103.db2.gz	CQZJSQGHQIYTLK-CMDGGOBGSA-N	0	0	255.317	4.003	20	30		CIEDRN
CC(C)[C@@H]1CCCN1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000299235256	328297977	/nfs/dbraw/zinc/29/79/77/328297977.db2.gz	JUOHINXOZZBEAL-INIZCTEOSA-N	0	0	299.418	4.140	20	30		CIEDRN
C=C(C)CSc1nnc(SCCCC)s1	ZINC000048395939	328306614	/nfs/dbraw/zinc/30/66/14/328306614.db2.gz	ATACODRWHPKEMT-UHFFFAOYSA-N	0	0	260.453	4.099	20	30		CIEDRN
Cc1ccc(C)c(C(=O)CSc2ccc(C#N)cc2)c1	ZINC000048512162	328309204	/nfs/dbraw/zinc/30/92/04/328309204.db2.gz	FNQVPJBMKXMWLV-UHFFFAOYSA-N	0	0	281.380	4.150	20	30		CIEDRN
Cc1cccc(CSCc2cccc(C#N)c2)c1	ZINC000048521376	328309520	/nfs/dbraw/zinc/30/95/20/328309520.db2.gz	TUZJFPQQQRPWBY-UHFFFAOYSA-N	0	0	253.370	4.300	20	30		CIEDRN
CN(Cc1ccc(Cl)s1)c1ccc(F)cc1C#N	ZINC000111036202	328323429	/nfs/dbraw/zinc/32/34/29/328323429.db2.gz	RBBQNBBGEGAZKF-UHFFFAOYSA-N	0	0	280.755	4.049	20	30		CIEDRN
CC(C)C[C@](C)(C#N)NC(=O)C[C@H]1CCCCC1(C)C	ZINC000534595653	328319395	/nfs/dbraw/zinc/31/93/95/328319395.db2.gz	HGBNMUUGCBPTAF-RHSMWYFYSA-N	0	0	278.440	4.037	20	30		CIEDRN
N#Cc1ccc(NCCc2ccc(Cl)cc2)c(F)c1	ZINC000048765213	328319934	/nfs/dbraw/zinc/31/99/34/328319934.db2.gz	OBEFSAWMLFDGSN-UHFFFAOYSA-N	0	0	274.726	4.005	20	30		CIEDRN
C=C[C@@H](CC(=O)N[C@@H](C)CCC(C)C)c1ccccc1	ZINC000534604741	328321369	/nfs/dbraw/zinc/32/13/69/328321369.db2.gz	QKZSGYLAPYWEOU-HOTGVXAUSA-N	0	0	273.420	4.287	20	30		CIEDRN
Cc1cccc(C(=O)Nc2ccc(Cl)c(C#N)c2)c1C	ZINC000048824247	328324854	/nfs/dbraw/zinc/32/48/54/328324854.db2.gz	ZOEBJQWUCWSHID-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)NCC(CC)CC)c1	ZINC000303248702	328332870	/nfs/dbraw/zinc/33/28/70/328332870.db2.gz	MLEDAWFEQWAOJU-UHFFFAOYSA-N	0	0	290.407	4.199	20	30		CIEDRN
C=C[C@@H](CC(=O)N([C@H](C)C(C)C)C1CC1)c1ccccc1	ZINC000534646066	328333825	/nfs/dbraw/zinc/33/38/25/328333825.db2.gz	BECXTWUHKGKXCW-CVEARBPZSA-N	0	0	285.431	4.382	20	30		CIEDRN
C=C[C@H](CC(=O)N1CCCC(C)(C)CC1)c1ccccc1	ZINC000534671016	328347566	/nfs/dbraw/zinc/34/75/66/328347566.db2.gz	CKMPRRUPHATYEH-MRXNPFEDSA-N	0	0	285.431	4.385	20	30		CIEDRN
C=C[C@@H](CC(=O)NCCc1ccc(C)cc1)c1ccccc1	ZINC000534675527	328356032	/nfs/dbraw/zinc/35/60/32/328356032.db2.gz	DUXFISILWAMLHT-SFHVURJKSA-N	0	0	293.410	4.014	20	30		CIEDRN
C=C[C@H](CC(=O)N1CCC[C@H](CC)CC1)c1ccccc1	ZINC000534690811	328356345	/nfs/dbraw/zinc/35/63/45/328356345.db2.gz	KSHADEVJPHHKGW-DLBZAZTESA-N	0	0	285.431	4.385	20	30		CIEDRN
C=C[C@@H](CC(=O)NC(C)(C)c1ccccc1)c1ccccc1	ZINC000534743665	328359821	/nfs/dbraw/zinc/35/98/21/328359821.db2.gz	WNIBEHDNTFIUOE-INIZCTEOSA-N	0	0	293.410	4.398	20	30		CIEDRN
Cc1ccccc1[C@@H](C)CC(=O)Nc1ccc(F)c(C#N)c1	ZINC000303689747	328357745	/nfs/dbraw/zinc/35/77/45/328357745.db2.gz	MHYAYRSYZCRRSM-ZDUSSCGKSA-N	0	0	296.345	4.138	20	30		CIEDRN
CCc1cc(C(=O)Nc2cc(C#N)ccc2C)sc1C	ZINC000049524615	328368835	/nfs/dbraw/zinc/36/88/35/328368835.db2.gz	FLNWSGYVIPJJCD-UHFFFAOYSA-N	0	0	284.384	4.051	20	30		CIEDRN
C[C@@H](c1ccc(C#N)cc1)N1CCc2ccc(Cl)cc2C1	ZINC000534905003	328369563	/nfs/dbraw/zinc/36/95/63/328369563.db2.gz	ITLWEUALSSPQOW-ZDUSSCGKSA-N	0	0	296.801	4.331	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@H](C)c1oc2ccccc2c1C	ZINC000172062157	335092976	/nfs/dbraw/zinc/09/29/76/335092976.db2.gz	UUCJFEUOQHPOJL-WCQYABFASA-N	0	0	286.375	4.066	20	30		CIEDRN
C[C@@H]1C[C@@H]1c1ccc(CNc2ccc(C#N)cc2F)o1	ZINC000112012192	328381629	/nfs/dbraw/zinc/38/16/29/328381629.db2.gz	VKMHNFCZUZVXAM-MFKMUULPSA-N	0	0	270.307	4.026	20	30		CIEDRN
N#Cc1cccc(Nc2cccc(CCC(F)(F)F)c2)n1	ZINC000535130282	328389477	/nfs/dbraw/zinc/38/94/77/328389477.db2.gz	QKXVYVTYQZNASN-UHFFFAOYSA-N	0	0	291.276	4.192	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)c1csc2ccccc21	ZINC000050212912	328390128	/nfs/dbraw/zinc/39/01/28/328390128.db2.gz	AWJDDXJIGCOJEL-UHFFFAOYSA-N	0	0	292.363	4.334	20	30		CIEDRN
C=CC1CCN(C(=O)C[C@@H]2CCCC(C)(C)C2)CC1	ZINC000535175406	328392866	/nfs/dbraw/zinc/39/28/66/328392866.db2.gz	SAMRSPHWKXVOGH-HNNXBMFYSA-N	0	0	263.425	4.018	20	30		CIEDRN
N#CCN(C(=O)[C@@H]1CC[C@H]2CCCC[C@H]2C1)c1ccccc1	ZINC000535211076	328394726	/nfs/dbraw/zinc/39/47/26/328394726.db2.gz	OAXCPLDUYKXMHL-IXDOHACOSA-N	0	0	296.414	4.150	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)N(c1ccccc1C)C(C)C)OCC	ZINC000535212317	328394743	/nfs/dbraw/zinc/39/47/43/328394743.db2.gz	ZYZZPXGKDTWCCC-QGZVFWFLSA-N	0	0	289.419	4.108	20	30		CIEDRN
C=C(C)[C@H](CC(=O)N(c1ccccc1C)C(C)C)OCC	ZINC000535212312	328394836	/nfs/dbraw/zinc/39/48/36/328394836.db2.gz	ZYZZPXGKDTWCCC-KRWDZBQOSA-N	0	0	289.419	4.108	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2csc(C(C)C)n2)n1	ZINC000340804439	328400813	/nfs/dbraw/zinc/40/08/13/328400813.db2.gz	UBOQZBWIPZPVGT-UHFFFAOYSA-N	0	0	277.393	4.170	20	30		CIEDRN
N#CCC[C@H](C#N)CSCc1ccccc1C1CC1	ZINC000341498349	328411278	/nfs/dbraw/zinc/41/12/78/328411278.db2.gz	JEHPBNIMEOICFP-CYBMUJFWSA-N	0	0	270.401	4.241	20	30		CIEDRN
C=CCOc1ccc(CNc2cc(C#N)ccc2C)cc1	ZINC000050429688	328439543	/nfs/dbraw/zinc/43/95/43/328439543.db2.gz	VDMXIZZFZPMAMK-UHFFFAOYSA-N	0	0	278.355	4.044	20	30		CIEDRN
N#Cc1ccc(SCCC(F)(F)F)c(Cl)c1	ZINC000532068188	328443951	/nfs/dbraw/zinc/44/39/51/328443951.db2.gz	ZZJDYLXSIUGAAP-UHFFFAOYSA-N	0	0	265.687	4.256	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@@H](C)C[C@@H](C)CC)c1ccccc1	ZINC000535387250	328449236	/nfs/dbraw/zinc/44/92/36/328449236.db2.gz	JEFMILAJKYDDGF-HRCADAONSA-N	0	0	273.420	4.287	20	30		CIEDRN
C=CCCC(=O)N[C@H]1CCc2c1ccc(Cl)c2Cl	ZINC000113078143	328451919	/nfs/dbraw/zinc/45/19/19/328451919.db2.gz	DNZFRNLECOOKIV-LBPRGKRZSA-N	0	0	284.186	4.063	20	30		CIEDRN
C=CCC[C@@H](N[C@H]1COCc2ccccc21)c1ccco1	ZINC000417365579	328457499	/nfs/dbraw/zinc/45/74/99/328457499.db2.gz	NURTZFZJPZQXID-SJORKVTESA-N	0	0	283.371	4.148	20	30		CIEDRN
N#C[C@@H](NC(=O)c1cc(F)cc(Cl)c1)C1CCCCC1	ZINC000330588592	328463987	/nfs/dbraw/zinc/46/39/87/328463987.db2.gz	WVXUCLVISLRAFK-CQSZACIVSA-N	0	0	294.757	4.256	20	30		CIEDRN
N#Cc1ccc(OCc2csc(C3CC3)n2)cc1Cl	ZINC000190250955	328488701	/nfs/dbraw/zinc/48/87/01/328488701.db2.gz	KPBRPXOOFMFQNP-UHFFFAOYSA-N	0	0	290.775	4.125	20	30		CIEDRN
CC#CC(=O)N(C)[C@@H](c1ccc(Cl)cc1)C1CCCC1	ZINC000283816817	328516704	/nfs/dbraw/zinc/51/67/04/328516704.db2.gz	SIZMXMAHYQSCOA-QGZVFWFLSA-N	0	0	289.806	4.053	20	30		CIEDRN
N#CC1(CCSCCOCC2CC2)CCCCC1	ZINC000419413215	329724570	/nfs/dbraw/zinc/72/45/70/329724570.db2.gz	DEPIFBXIGGCZEN-UHFFFAOYSA-N	0	0	267.438	4.010	20	30		CIEDRN
Cc1ccccc1[C@H](C)CC(=O)N1CCC(CCC#N)CC1	ZINC000583936808	326801894	/nfs/dbraw/zinc/80/18/94/326801894.db2.gz	OMSQPYULSWIFLP-MRXNPFEDSA-N	0	0	298.430	4.031	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)N1CCCC[C@H]1CCC(C)C)OCC	ZINC000583948224	326804622	/nfs/dbraw/zinc/80/46/22/326804622.db2.gz	ZYMWOUPRTIHMRH-DLBZAZTESA-N	0	0	295.467	4.175	20	30		CIEDRN
C=C(CC)CSCc1noc(C2CCCCC2)n1	ZINC000537993342	326822772	/nfs/dbraw/zinc/82/27/72/326822772.db2.gz	SRJFGNQPFARQIU-UHFFFAOYSA-N	0	0	266.410	4.317	20	30		CIEDRN
CC[C@](C)(NCC#Cc1cccc(Cl)c1)C(F)(F)F	ZINC000533390161	326826356	/nfs/dbraw/zinc/82/63/56/326826356.db2.gz	UNQYFRKOMRWESJ-ZDUSSCGKSA-N	0	0	289.728	4.012	20	30		CIEDRN
N#CCCC1CCN(c2ncc(-c3ccccc3)s2)CC1	ZINC000583991367	326832332	/nfs/dbraw/zinc/83/23/32/326832332.db2.gz	HLSVFYWTJCVXDZ-UHFFFAOYSA-N	0	0	297.427	4.330	20	30		CIEDRN
Cc1ccc(C#N)c(N[C@H]2CC[C@H](c3ccc(F)cc3)C2)n1	ZINC000530537773	326854225	/nfs/dbraw/zinc/85/42/25/326854225.db2.gz	YNVKNNAFQDSKAT-YOEHRIQHSA-N	0	0	295.361	4.149	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N[C@@H](C)CCC(C)(C)C	ZINC000530603896	326881901	/nfs/dbraw/zinc/88/19/01/326881901.db2.gz	COWSGLRPRXDFLF-ZDUSSCGKSA-N	0	0	287.407	4.203	20	30		CIEDRN
Cc1ccc(C#N)cc1NCc1ccsc1Cl	ZINC000312553830	326901214	/nfs/dbraw/zinc/90/12/14/326901214.db2.gz	FMENOVSNRDIKTQ-UHFFFAOYSA-N	0	0	262.765	4.194	20	30		CIEDRN
CN(C(=O)C[C@H]1CCCC(C)(C)C1)c1cccc(C#N)c1	ZINC000533679302	326901366	/nfs/dbraw/zinc/90/13/66/326901366.db2.gz	JPTOEMXRWWOECM-CQSZACIVSA-N	0	0	284.403	4.128	20	30		CIEDRN
C=CCn1c(SCCC(=C)C)nnc1-c1ccccc1C	ZINC000506400777	332772185	/nfs/dbraw/zinc/77/21/85/332772185.db2.gz	DSKLMROMWXYLJT-UHFFFAOYSA-N	0	0	299.443	4.498	20	30		CIEDRN
Cc1csc(NC(=O)c2cc3ccccc3s2)c1C#N	ZINC000584078030	326919840	/nfs/dbraw/zinc/91/98/40/326919840.db2.gz	NYCIHDIFMFDYKR-UHFFFAOYSA-N	0	0	298.392	4.395	20	30		CIEDRN
N#C[C@@H](Sc1ncnc2ccsc21)C1CCCCC1	ZINC000115186736	326933349	/nfs/dbraw/zinc/93/33/49/326933349.db2.gz	SONJZKUTOJIKRS-GFCCVEGCSA-N	0	0	289.429	4.256	20	30		CIEDRN
C=C[C@@H](CC(=O)N[C@@](C)(CC)C(F)(F)F)c1ccccc1	ZINC000536285597	326934784	/nfs/dbraw/zinc/93/47/84/326934784.db2.gz	LSPZUINKZCQIMV-WFASDCNBSA-N	0	0	299.336	4.194	20	30		CIEDRN
C=CCCCC(=O)N1CCCC[C@@H]1CCc1ccccc1	ZINC000536315802	326936100	/nfs/dbraw/zinc/93/61/00/326936100.db2.gz	JHKPWYKUGUSCOO-GOSISDBHSA-N	0	0	285.431	4.357	20	30		CIEDRN
CC(C)(C#N)CCNc1cc(C(F)(F)F)ccc1F	ZINC000087592012	326942415	/nfs/dbraw/zinc/94/24/15/326942415.db2.gz	RYOQNGSFUBGZAJ-UHFFFAOYSA-N	0	0	274.261	4.196	20	30		CIEDRN
C/C=C/c1ccc(OCCCC(C)(C)C#N)c(OC)c1	ZINC000158118173	326944011	/nfs/dbraw/zinc/94/40/11/326944011.db2.gz	UPXWEIGPIAXPJN-FNORWQNLSA-N	0	0	273.376	4.437	20	30		CIEDRN
C=CCC[C@H](Nc1ccc2c(c1)ncn2C)c1ccco1	ZINC000556889921	326979274	/nfs/dbraw/zinc/97/92/74/326979274.db2.gz	KUFLZSGLMWZUBH-AWEZNQCLSA-N	0	0	281.359	4.286	20	30		CIEDRN
CCNc1ccc(C#N)cc1NC(=O)C[C@@H](C)CC(C)C	ZINC000556930902	326984364	/nfs/dbraw/zinc/98/43/64/326984364.db2.gz	URSDECQYXHJZAN-ZDUSSCGKSA-N	0	0	287.407	4.001	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1cc[nH]c1C1CC1	ZINC000557068206	326991801	/nfs/dbraw/zinc/99/18/01/326991801.db2.gz	SLMSAOBALKSJAS-UHFFFAOYSA-N	0	0	280.371	4.263	20	30		CIEDRN
C=C(C)CCc1noc([C@H]2[C@H](c3ccccc3)[C@@H]2C)n1	ZINC000557517268	327011074	/nfs/dbraw/zinc/01/10/74/327011074.db2.gz	JFNPBWAFDIROBY-VBNZEHGJSA-N	0	0	268.360	4.095	20	30		CIEDRN
N#Cc1cc(NCCCCc2ccc(Cl)s2)ccn1	ZINC000557685382	327020649	/nfs/dbraw/zinc/02/06/49/327020649.db2.gz	BSBHUUKTRXEWJO-UHFFFAOYSA-N	0	0	291.807	4.103	20	30		CIEDRN
C=CCC1(C(=O)NCc2cccc(SCC)c2)CCC1	ZINC000557730325	327023401	/nfs/dbraw/zinc/02/34/01/327023401.db2.gz	UUCPGXMCIUOYBP-UHFFFAOYSA-N	0	0	289.444	4.161	20	30		CIEDRN
COc1ccc(CSc2ccc(C)cc2)cc1C#N	ZINC000087833686	327025575	/nfs/dbraw/zinc/02/55/75/327025575.db2.gz	BXTYVUBERAPIJO-UHFFFAOYSA-N	0	0	269.369	4.168	20	30		CIEDRN
COc1ccc(CSc2cccc(C)c2)cc1C#N	ZINC000087833732	327025588	/nfs/dbraw/zinc/02/55/88/327025588.db2.gz	YOJLJPOBCLDNPW-UHFFFAOYSA-N	0	0	269.369	4.168	20	30		CIEDRN
C[C@@H]1C[C@H](c2ccccc2)N(c2ccc(Cl)c(C#N)n2)C1	ZINC000557764314	327025831	/nfs/dbraw/zinc/02/58/31/327025831.db2.gz	OHQPMOUKWPSNNZ-MLGOLLRUSA-N	0	0	297.789	4.194	20	30		CIEDRN
CCC[C@H](C(=O)NCC(C)(C)CCC#N)c1ccccc1	ZINC000557984628	327038932	/nfs/dbraw/zinc/03/89/32/327038932.db2.gz	VYSGAUGNRSHTIV-INIZCTEOSA-N	0	0	286.419	4.016	20	30		CIEDRN
C=C[C@@H](CC(=O)N(C1CCC1)C1CCC1)c1ccccc1	ZINC000558080742	327061745	/nfs/dbraw/zinc/06/17/45/327061745.db2.gz	QHNBIZLXMAXSAH-HNNXBMFYSA-N	0	0	283.415	4.280	20	30		CIEDRN
CC(C)[C@H]1C[C@@H](Nc2cccc(C(F)F)c2C#N)CCO1	ZINC000584182921	327062085	/nfs/dbraw/zinc/06/20/85/327062085.db2.gz	PDZOLQVEXBQVDU-XHDPSFHLSA-N	0	0	294.345	4.111	20	30		CIEDRN
CC(C)[C@H]1C[C@H](Nc2cccc(C(F)F)c2C#N)CCO1	ZINC000584182919	327062090	/nfs/dbraw/zinc/06/20/90/327062090.db2.gz	PDZOLQVEXBQVDU-IAQYHMDHSA-N	0	0	294.345	4.111	20	30		CIEDRN
CC1(C)CN(CC#Cc2ccccc2)[C@H]1c1cccs1	ZINC000558184390	327077536	/nfs/dbraw/zinc/07/75/36/327077536.db2.gz	RMWQSSZENQUWBB-KRWDZBQOSA-N	0	0	281.424	4.183	20	30		CIEDRN
N#Cc1ccc(NCCCSc2ccccc2)c(F)c1	ZINC000506831763	332780941	/nfs/dbraw/zinc/78/09/41/332780941.db2.gz	JTFWJKJCFOTUKD-UHFFFAOYSA-N	0	0	286.375	4.292	20	30		CIEDRN
C=CCn1c([C@@H](C)CC)nnc1N(C)[C@@H](C)c1ccccc1	ZINC000558452079	327095531	/nfs/dbraw/zinc/09/55/31/327095531.db2.gz	CSWQGMIDGGFZAE-GJZGRUSLSA-N	0	0	298.434	4.175	20	30		CIEDRN
Cc1cc(C(=O)N[C@@H](CCCC#N)c2ccccc2)oc1C	ZINC000558457902	327095685	/nfs/dbraw/zinc/09/56/85/327095685.db2.gz	PTNCSZRCNACZMJ-INIZCTEOSA-N	0	0	296.370	4.061	20	30		CIEDRN
CC(C)c1nc2ccc(NC[C@@H](C#N)CCC#N)cc2s1	ZINC000558506722	327099826	/nfs/dbraw/zinc/09/98/26/327099826.db2.gz	KDWPKKTUBUKPNX-GFCCVEGCSA-N	0	0	298.415	4.275	20	30		CIEDRN
COc1cc(C#N)ccc1OCCSc1ccccc1C	ZINC000558510343	327100015	/nfs/dbraw/zinc/10/00/15/327100015.db2.gz	ZQCDEILEVZWOPA-UHFFFAOYSA-N	0	0	299.395	4.046	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1cnc(CC)s1	ZINC000558591183	327107823	/nfs/dbraw/zinc/10/78/23/327107823.db2.gz	RBZFKYYREWDMKG-UHFFFAOYSA-N	0	0	286.400	4.076	20	30		CIEDRN
C=CCOCCSc1ccc(Cl)c(Cl)c1	ZINC000558846316	327126504	/nfs/dbraw/zinc/12/65/04/327126504.db2.gz	AFITVDGFEPAXOU-UHFFFAOYSA-N	0	0	263.189	4.288	20	30		CIEDRN
N#CCc1cccc(NC2CC(c3ccccc3F)C2)c1	ZINC000313426494	327129063	/nfs/dbraw/zinc/12/90/63/327129063.db2.gz	LMLNFEBTWIFKLY-UHFFFAOYSA-N	0	0	280.346	4.250	20	30		CIEDRN
CCOc1ccccc1CNc1cccc(Cl)c1C#N	ZINC000507007370	332783692	/nfs/dbraw/zinc/78/36/92/332783692.db2.gz	NANNAUIKXGMUPD-UHFFFAOYSA-N	0	0	286.762	4.222	20	30		CIEDRN
CC(C)c1ccc2ncc(C#N)c(N3CCC[C@@H]3CF)c2c1	ZINC000558983960	327137033	/nfs/dbraw/zinc/13/70/33/327137033.db2.gz	HODJWOKPRQGLKS-OAHLLOKOSA-N	0	0	297.377	4.168	20	30		CIEDRN
CC(=O)c1ccc(C#N)cc1N1CCC[C@@H](C(C)C)CC1	ZINC000131301245	327161500	/nfs/dbraw/zinc/16/15/00/327161500.db2.gz	DXXWZEPZLOJOJM-MRXNPFEDSA-N	0	0	284.403	4.023	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1ccoc1CCC	ZINC000409737389	327163858	/nfs/dbraw/zinc/16/38/58/327163858.db2.gz	RCTCFKFFFGWODG-UHFFFAOYSA-N	0	0	263.381	4.051	20	30		CIEDRN
C=CCCc1ccccc1NC[C@H]1CCO[C@H](C)C1	ZINC000409835728	327165358	/nfs/dbraw/zinc/16/53/58/327165358.db2.gz	KZXXDIODLYIUPA-CABCVRRESA-N	0	0	259.393	4.032	20	30		CIEDRN
C=CCCc1ccccc1NCc1cn(C)nc1C(F)F	ZINC000409852749	327166556	/nfs/dbraw/zinc/16/65/56/327166556.db2.gz	KPWSUHHDKFNWOI-UHFFFAOYSA-N	0	0	291.345	4.088	20	30		CIEDRN
CC(C)c1ccc2occ(C(=O)N[C@@H](C#N)C(C)(C)C)c2c1	ZINC000569372483	327167655	/nfs/dbraw/zinc/16/76/55/327167655.db2.gz	SJKDJPSAEWFTNY-INIZCTEOSA-N	0	0	298.386	4.224	20	30		CIEDRN
Cc1ccc(C(F)(F)F)cc1NCc1cccc(C#N)c1	ZINC000091477596	327170878	/nfs/dbraw/zinc/17/08/78/327170878.db2.gz	MXQXRLSEFDBSOZ-UHFFFAOYSA-N	0	0	290.288	4.498	20	30		CIEDRN
C[C@@H](Sc1cccc(F)c1C#N)c1ccc(C#N)cc1	ZINC000569429711	327175745	/nfs/dbraw/zinc/17/57/45/327175745.db2.gz	GUUCERSHKRRJAE-LLVKDONJSA-N	0	0	282.343	4.422	20	30		CIEDRN
CC(C)CC(C)(C)C(=O)N[C@H](C#N)c1ccc(Cl)cc1	ZINC000159391072	327176987	/nfs/dbraw/zinc/17/69/87/327176987.db2.gz	FHHCZUHNUHGYBU-CQSZACIVSA-N	0	0	292.810	4.093	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@@H](C)Sc1ccc(Cl)cc1	ZINC000410128670	327180021	/nfs/dbraw/zinc/18/00/21/327180021.db2.gz	UKULTSXZPYEQRR-YPMHNXCESA-N	0	0	297.851	4.292	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)C[C@@H](C)c1ccc(CC)cc1	ZINC000410129835	327180067	/nfs/dbraw/zinc/18/00/67/327180067.db2.gz	HGRJRJSNHRLHFK-RHSMWYFYSA-N	0	0	273.420	4.214	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@@H]1C[C@@H]1c1c(F)cccc1Cl	ZINC000410130702	327180094	/nfs/dbraw/zinc/18/00/94/327180094.db2.gz	NHEYJEDZSRLHLY-SDDRHHMPSA-N	0	0	295.785	4.054	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1cc(Cl)ccc1Cl	ZINC000410145958	327181371	/nfs/dbraw/zinc/18/13/71/327181371.db2.gz	QUZCNWRUQDJADK-JTQLQIEISA-N	0	0	272.175	4.078	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)C[C@@H](c1ccccc1)C(F)(F)F	ZINC000410146479	327181389	/nfs/dbraw/zinc/18/13/89/327181389.db2.gz	YKTKEBGGYKYURF-KGLIPLIRSA-N	0	0	299.336	4.194	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)C1CCC(c2ccccc2)CC1	ZINC000410146137	327181457	/nfs/dbraw/zinc/18/14/57/327181457.db2.gz	UDUXSDDLWMZWFG-ABHNRTSZSA-N	0	0	285.431	4.431	20	30		CIEDRN
CN(Cc1ccc(C#N)o1)Cc1cc(Cl)cc(Cl)c1	ZINC000091955888	327187855	/nfs/dbraw/zinc/18/78/55/327187855.db2.gz	GUVHHBOEFWHOBA-UHFFFAOYSA-N	0	0	295.169	4.090	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)CCCCSC	ZINC000410361002	327188073	/nfs/dbraw/zinc/18/80/73/327188073.db2.gz	CPDAPOOXDLXCPZ-UHFFFAOYSA-N	0	0	277.433	4.277	20	30		CIEDRN
CC(C)(CCC#N)CNc1ccc(F)cc1OC(F)F	ZINC000092174747	327189280	/nfs/dbraw/zinc/18/92/80/327189280.db2.gz	GKTMSWIDJQZQTI-UHFFFAOYSA-N	0	0	286.297	4.169	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)C(C1CC1)C1CC1	ZINC000410394701	327190021	/nfs/dbraw/zinc/19/00/21/327190021.db2.gz	ZZTSQGVZVAHBJQ-UHFFFAOYSA-N	0	0	269.388	4.180	20	30		CIEDRN
C=C(C)CCS[C@H](C)C(=O)N1CCCc2ccccc21	ZINC000507117157	332787898	/nfs/dbraw/zinc/78/78/98/332787898.db2.gz	UCOSQNHETLSIGO-CQSZACIVSA-N	0	0	289.444	4.054	20	30		CIEDRN
C=C(C)CN(C)C(=O)Nc1ccc(OCCCC)cc1C	ZINC000181633638	327211895	/nfs/dbraw/zinc/21/18/95/327211895.db2.gz	JWGBOAALGVNZEV-UHFFFAOYSA-N	0	0	290.407	4.214	20	30		CIEDRN
C=C(C)CN(C)C(=O)Nc1cc(Cl)ccc1SC	ZINC000181651856	327212309	/nfs/dbraw/zinc/21/23/09/327212309.db2.gz	WHEPBPWWSHKREQ-UHFFFAOYSA-N	0	0	284.812	4.102	20	30		CIEDRN
C=C[C@H](CC(=O)N(C)Cc1cccs1)c1ccccc1	ZINC000533884797	327238763	/nfs/dbraw/zinc/23/87/63/327238763.db2.gz	OVGFVJNNKQTNMO-CQSZACIVSA-N	0	0	285.412	4.066	20	30		CIEDRN
N#CCN(C(=O)CC/C=C\c1ccccc1)c1ccccc1	ZINC000255025778	327251010	/nfs/dbraw/zinc/25/10/10/327251010.db2.gz	CSGFARIAPLTGAZ-XFFZJAGNSA-N	0	0	290.366	4.037	20	30		CIEDRN
C=CCC(C)(C)C(=O)N(C)C/C(C)=C\c1ccccc1	ZINC000507143502	332790523	/nfs/dbraw/zinc/79/05/23/332790523.db2.gz	NBAKGMAJDMXUPH-SQFISAMPSA-N	0	0	271.404	4.151	20	30		CIEDRN
C[C@H](NCc1ccc(C#N)s1)c1ccc(F)cc1Cl	ZINC000176972364	327260341	/nfs/dbraw/zinc/26/03/41/327260341.db2.gz	FXYOCIFRCAIWPX-VIFPVBQESA-N	0	0	294.782	4.263	20	30		CIEDRN
C[C@H](c1ccccc1Cl)N(C)C(=O)c1cccc(C#N)c1	ZINC000043749838	327262744	/nfs/dbraw/zinc/26/27/44/327262744.db2.gz	PQLJDGONKQIZTC-GFCCVEGCSA-N	0	0	298.773	4.045	20	30		CIEDRN
CC1CC(C#N)(C(=O)N2C[C@H](C(C)(C)C)c3ccccc32)C1	ZINC000559840392	327264973	/nfs/dbraw/zinc/26/49/73/327264973.db2.gz	QBLXBOKZFQWMMU-BTUGKURYSA-N	0	0	296.414	4.103	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@@H]1CCC[C@H](C)C1)c1ccccc1	ZINC000533888773	327266790	/nfs/dbraw/zinc/26/67/90/327266790.db2.gz	IZGTWABEDKQHSW-ZMSDIMECSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CC[C@H](C)[C@H](C)Nc1ccc([C@@H]2CCOC2)cc1	ZINC000559896843	327269437	/nfs/dbraw/zinc/26/94/37/327269437.db2.gz	BNNRWGHYSDKTOC-OFQRWUPVSA-N	0	0	259.393	4.203	20	30		CIEDRN
C=CCC(F)(F)c1nc(CCC2CCCCC2)no1	ZINC000559943647	327272862	/nfs/dbraw/zinc/27/28/62/327272862.db2.gz	MYPGSQAUKAYZEA-UHFFFAOYSA-N	0	0	270.323	4.250	20	30		CIEDRN
N#Cc1ccc(F)c(CSCCCCCF)c1	ZINC000559955719	327273773	/nfs/dbraw/zinc/27/37/73/327273773.db2.gz	SODKWCCXNJSYTK-UHFFFAOYSA-N	0	0	255.333	4.070	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2sc(C(C)C)nc2C)n1	ZINC000560023302	327278101	/nfs/dbraw/zinc/27/81/01/327278101.db2.gz	AUQGHTVLLNPMNU-UHFFFAOYSA-N	0	0	291.420	4.479	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cc(F)ccc2Cl)n1	ZINC000560024505	327278176	/nfs/dbraw/zinc/27/81/76/327278176.db2.gz	MEQBLKDQCAVVCK-UHFFFAOYSA-N	0	0	280.730	4.383	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ccc3nccc(C)c3c2)n1	ZINC000560024532	327278229	/nfs/dbraw/zinc/27/82/29/327278229.db2.gz	MOFBYKGWOHMEEN-UHFFFAOYSA-N	0	0	293.370	4.447	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ccc(C3(C#N)CC3)cc2)n1	ZINC000560025894	327278410	/nfs/dbraw/zinc/27/84/10/327278410.db2.gz	UCBFIJMXCQXAPV-UHFFFAOYSA-N	0	0	293.370	4.145	20	30		CIEDRN
CC[C@@H](CC(=O)N1CCC(CCC#N)CC1)c1ccccc1	ZINC000566276131	327282160	/nfs/dbraw/zinc/28/21/60/327282160.db2.gz	VIGWNJADBKVOOS-KRWDZBQOSA-N	0	0	298.430	4.113	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1c(C)cnc2c(OC)cccc21	ZINC000560100721	327284316	/nfs/dbraw/zinc/28/43/16/327284316.db2.gz	LHZJVHOYNCGYSX-LBPRGKRZSA-N	0	0	298.386	4.093	20	30		CIEDRN
CCCC[C@H](CC)CC(=O)N(C1CC1)C1(C#N)CCC1	ZINC000560115875	327284801	/nfs/dbraw/zinc/28/48/01/327284801.db2.gz	CVULYIXYVLAZOB-AWEZNQCLSA-N	0	0	276.424	4.030	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CC[C@@H](Cc2ccccc2)[C@H]1C	ZINC000560135690	327286057	/nfs/dbraw/zinc/28/60/57/327286057.db2.gz	WZFOSXFJKDKFCZ-WBVHZDCISA-N	0	0	285.431	4.068	20	30		CIEDRN
CC[C@H](C)CCC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1	ZINC000560549634	327323482	/nfs/dbraw/zinc/32/34/82/327323482.db2.gz	RJPBYRWKTILNNC-JQHSSLGASA-N	0	0	298.430	4.111	20	30		CIEDRN
CCC[C@H]1CCCCN1C(=O)c1cc(C#N)ccc1Cl	ZINC000560639437	327332779	/nfs/dbraw/zinc/33/27/79/327332779.db2.gz	CPPRFLWWYKEJHS-ZDUSSCGKSA-N	0	0	290.794	4.006	20	30		CIEDRN
N#C[C@@H](Sc1ccc2n[nH]cc2c1)C1CCCCC1	ZINC000560813527	327344540	/nfs/dbraw/zinc/34/45/40/327344540.db2.gz	IRIDBIWMHLJRCY-OAHLLOKOSA-N	0	0	271.389	4.127	20	30		CIEDRN
CC(C)(C#N)c1ccc(-c2nc(-c3ccsc3)no2)cc1	ZINC000583407220	327347709	/nfs/dbraw/zinc/34/77/09/327347709.db2.gz	RVELNLVELRCQAY-UHFFFAOYSA-N	0	0	295.367	4.266	20	30		CIEDRN
C[C@@H](CSCc1cccc(C#N)c1F)C(F)(F)F	ZINC000561064049	327362699	/nfs/dbraw/zinc/36/26/99/327362699.db2.gz	VCACBZODPYWNRE-QMMMGPOBSA-N	0	0	277.286	4.129	20	30		CIEDRN
C=C(C)CSc1nc2c(c(-c3ccco3)c1C#N)CCC2	ZINC000561138671	327369012	/nfs/dbraw/zinc/36/90/12/327369012.db2.gz	UFAVAXMOIXSHDS-UHFFFAOYSA-N	0	0	296.395	4.370	20	30		CIEDRN
C=CCCCNc1ccc(-c2ccncc2)c(C)c1	ZINC000427429449	327375454	/nfs/dbraw/zinc/37/54/54/327375454.db2.gz	TXRUVUUSSJIZEW-UHFFFAOYSA-N	0	0	252.361	4.435	20	30		CIEDRN
C=CCCCCSCc1csc([C@H](C)OC)n1	ZINC000561256407	327380093	/nfs/dbraw/zinc/38/00/93/327380093.db2.gz	JEONHHXEWKHZCQ-NSHDSACASA-N	0	0	271.451	4.440	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc(C)c(OCC)c1	ZINC000574815419	327382172	/nfs/dbraw/zinc/38/21/72/327382172.db2.gz	ULCAYGAYXIHQMY-UHFFFAOYSA-N	0	0	273.376	4.101	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H]2CCC(=O)c3ccccc32)n1	ZINC000561284297	327382536	/nfs/dbraw/zinc/38/25/36/327382536.db2.gz	NSMPNITWCXBHPR-AWEZNQCLSA-N	0	0	296.370	4.032	20	30		CIEDRN
CSc1cccc(F)c1CNc1cccc(F)c1C#N	ZINC000561360153	327388510	/nfs/dbraw/zinc/38/85/10/327388510.db2.gz	TUMKGIVMOPUFES-UHFFFAOYSA-N	0	0	290.338	4.170	20	30		CIEDRN
CCCC[C@@H](C)N(CCCC)C(=O)c1sccc1C#N	ZINC000561369312	327389338	/nfs/dbraw/zinc/38/93/38/327389338.db2.gz	DZBZBJKXSZAVBU-CYBMUJFWSA-N	0	0	292.448	4.441	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)NCc1cccc(SCC)c1	ZINC000561410339	327393372	/nfs/dbraw/zinc/39/33/72/327393372.db2.gz	NXPWOZARBOULHL-MRXNPFEDSA-N	0	0	277.433	4.017	20	30		CIEDRN
C[C@H]1C[C@@H](c2ccccc2)N(c2ncc(C#N)cc2Cl)C1	ZINC000561447345	327395395	/nfs/dbraw/zinc/39/53/95/327395395.db2.gz	BKILDRQJWBJJSD-LRDDRELGSA-N	0	0	297.789	4.194	20	30		CIEDRN
CCOC(=O)CC(C)(C)CCSc1cccc(C#N)c1	ZINC000561455427	327396018	/nfs/dbraw/zinc/39/60/18/327396018.db2.gz	MYZRZPBHVUVQRW-UHFFFAOYSA-N	0	0	291.416	4.020	20	30		CIEDRN
C/C=C/c1ccc(NC(=O)c2ccc(CC#N)cc2)cc1	ZINC000561652393	327407620	/nfs/dbraw/zinc/40/76/20/327407620.db2.gz	QXYBSQWTTNKNNR-NSCUHMNNSA-N	0	0	276.339	4.038	20	30		CIEDRN
C=CCCC(=O)Nc1cccc(-c2ccccc2)c1	ZINC000561670195	327409458	/nfs/dbraw/zinc/40/94/58/327409458.db2.gz	IGYJKCGMMRHAPV-UHFFFAOYSA-N	0	0	251.329	4.258	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)CC1(C)CCCC1	ZINC000561679708	327410056	/nfs/dbraw/zinc/41/00/56/327410056.db2.gz	MTSRRWKPVYEQJC-UHFFFAOYSA-N	0	0	277.433	4.233	20	30		CIEDRN
N#Cc1ccc(CNc2cccc(CCC(F)(F)F)c2)o1	ZINC000151051191	327422278	/nfs/dbraw/zinc/42/22/78/327422278.db2.gz	WNLVPUPSIPIJIJ-UHFFFAOYSA-N	0	0	294.276	4.258	20	30		CIEDRN
C=CCN(C)C(=O)Nc1cccc(CSC(C)C)c1C	ZINC000157490354	327432959	/nfs/dbraw/zinc/43/29/59/327432959.db2.gz	SNCDAGBZRCDOIA-UHFFFAOYSA-N	0	0	292.448	4.286	20	30		CIEDRN
CC(C)(C)Oc1cccc(CSc2ccccc2C#N)n1	ZINC000507328036	332802623	/nfs/dbraw/zinc/80/26/23/332802623.db2.gz	FTGQTLOQVRXNLA-UHFFFAOYSA-N	0	0	298.411	4.423	20	30		CIEDRN
C[C@H](C#N)CSc1ccccc1NC/C=C/Cl	ZINC000131702566	327457100	/nfs/dbraw/zinc/45/71/00/327457100.db2.gz	HYFYJSNCDKNXLT-TZOMUSMUSA-N	0	0	266.797	4.103	20	30		CIEDRN
C=C(C)CNC(=O)C12CC3(C)CC(C)(CC(C)(C3)C1)C2	ZINC000427942757	327463805	/nfs/dbraw/zinc/46/38/05/327463805.db2.gz	KZMKUIKDCKKQKM-UHFFFAOYSA-N	0	0	275.436	4.065	20	30		CIEDRN
C=CCCCCNc1ccc(NC(C)=O)cc1Cl	ZINC000580039089	327475190	/nfs/dbraw/zinc/47/51/90/327475190.db2.gz	NEAZGZGSCSLMLT-UHFFFAOYSA-N	0	0	266.772	4.067	20	30		CIEDRN
CC[C@H]1CC[C@H](C(=O)N[C@](C)(C#N)C2CCCCC2)CC1	ZINC000562450303	327482107	/nfs/dbraw/zinc/48/21/07/327482107.db2.gz	RVIZNHXIHDUCIS-IIDMSEBBSA-N	0	0	290.451	4.182	20	30		CIEDRN
CCCc1ccc(C(=O)N(CC)c2ccc(C#N)cc2)cc1	ZINC000151834604	327511620	/nfs/dbraw/zinc/51/16/20/327511620.db2.gz	FHGBJBRCYVBVIU-UHFFFAOYSA-N	0	0	292.382	4.177	20	30		CIEDRN
CC[C@H](C(=O)Nc1cc(C#N)ccc1C)c1ccc(F)cc1	ZINC000159517149	327512368	/nfs/dbraw/zinc/51/23/68/327512368.db2.gz	GRJPDENBQFNOSY-INIZCTEOSA-N	0	0	296.345	4.138	20	30		CIEDRN
Cc1ccc(C#N)cc1NCCCCC(F)(F)F	ZINC000151847895	327513648	/nfs/dbraw/zinc/51/36/48/327513648.db2.gz	LQVWYUIHWOGFNL-UHFFFAOYSA-N	0	0	256.271	4.011	20	30		CIEDRN
N#CCC[C@@H](C#N)CNc1cccc(Oc2ccccc2)c1	ZINC000569757909	327545246	/nfs/dbraw/zinc/54/52/46/327545246.db2.gz	WIODKFGYZXBGQK-HNNXBMFYSA-N	0	0	291.354	4.334	20	30		CIEDRN
C=C[C@H](CC(=O)N1CCC(C)(C2CC2)CC1)c1ccccc1	ZINC000569864792	327552516	/nfs/dbraw/zinc/55/25/16/327552516.db2.gz	REZWHVREGAPSCM-MRXNPFEDSA-N	0	0	297.442	4.385	20	30		CIEDRN
Cc1c2cc(C#N)ccc2sc1-c1nc(C(C)C)no1	ZINC000569880779	327553767	/nfs/dbraw/zinc/55/37/67/327553767.db2.gz	BEWBBSLDBQHFFW-UHFFFAOYSA-N	0	0	283.356	4.255	20	30		CIEDRN
C=C(C)CCc1noc([C@@H]2C[C@H]2c2ccccc2CC)n1	ZINC000569887701	327554073	/nfs/dbraw/zinc/55/40/73/327554073.db2.gz	DVTFKUIPYZZWCL-JKSUJKDBSA-N	0	0	282.387	4.412	20	30		CIEDRN
CC[C@H]1CCCC[C@@H]1c1noc(Cc2ccc(C#N)cc2)n1	ZINC000570112035	327570438	/nfs/dbraw/zinc/57/04/38/327570438.db2.gz	HUPBMAJEKKNLOU-HOTGVXAUSA-N	0	0	295.386	4.216	20	30		CIEDRN
N#Cc1cccc(Cl)c1NCc1ccc2ccccc2n1	ZINC000570327332	327583667	/nfs/dbraw/zinc/58/36/67/327583667.db2.gz	LAFRCOWCYYUTPE-UHFFFAOYSA-N	0	0	293.757	4.372	20	30		CIEDRN
C=CCCCC(=O)N1CC[C@@H](C(C)(C)C)C[C@H]1C	ZINC000570545026	327599017	/nfs/dbraw/zinc/59/90/17/327599017.db2.gz	YCEGWTXEFHCNCO-ZIAGYGMSSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=CCc1cc(C)cc(OC)c1OCc1scnc1C	ZINC000570487803	327594863	/nfs/dbraw/zinc/59/48/63/327594863.db2.gz	WQHVMNJPNOJEIG-UHFFFAOYSA-N	0	0	289.400	4.076	20	30		CIEDRN
CC(C)c1ccc(/C=C/CC(=O)N(CCC#N)C(C)C)cc1	ZINC000535730088	328620832	/nfs/dbraw/zinc/62/08/32/328620832.db2.gz	TXDAXMHDHSBHPU-FNORWQNLSA-N	0	0	298.430	4.364	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1cc2sccc2s1	ZINC000519037376	328640829	/nfs/dbraw/zinc/64/08/29/328640829.db2.gz	KGOAWGCNEUSRLF-SECBINFHSA-N	0	0	265.403	4.047	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)N(CC)c1cccc(C)c1C)OCC	ZINC000535880336	328645330	/nfs/dbraw/zinc/64/53/30/328645330.db2.gz	RPYSEJCFYMKGEK-QGZVFWFLSA-N	0	0	289.419	4.028	20	30		CIEDRN
CSCc1cccc(NCc2ccc(C#N)c(C)c2)c1	ZINC000519804318	328696827	/nfs/dbraw/zinc/69/68/27/328696827.db2.gz	SJAYAAAOMZORNB-UHFFFAOYSA-N	0	0	282.412	4.342	20	30		CIEDRN
COc1ccc(CNc2cc(Cl)ccc2C#N)c(C)c1	ZINC000532217117	328708537	/nfs/dbraw/zinc/70/85/37/328708537.db2.gz	KUIZOWWYMJXGAU-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
CC(C)(CCC#N)CNC(=O)Nc1ccc(C2CCC2)cc1	ZINC000351695995	328730198	/nfs/dbraw/zinc/73/01/98/328730198.db2.gz	VNPWISJUEWEQGU-UHFFFAOYSA-N	0	0	299.418	4.406	20	30		CIEDRN
C[C@@H](NCc1ccc(F)cc1C#N)c1ccccc1Cl	ZINC000103138884	328766172	/nfs/dbraw/zinc/76/61/72/328766172.db2.gz	UYCHFIHHXCHZJQ-LLVKDONJSA-N	0	0	288.753	4.202	20	30		CIEDRN
COc1cc(N[C@H](C)c2cccc(C#N)c2)c(C)c(OC)c1	ZINC000507693113	332819268	/nfs/dbraw/zinc/81/92/68/332819268.db2.gz	JMTAGIMTPYHMJN-CYBMUJFWSA-N	0	0	296.370	4.057	20	30		CIEDRN
N#Cc1cccc(CNCc2c(Cl)cccc2Cl)c1	ZINC000037501706	328806462	/nfs/dbraw/zinc/80/64/62/328806462.db2.gz	MTNKFMQBJKTDFE-UHFFFAOYSA-N	0	0	291.181	4.155	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1ccc(O[C@@H](C)CC)cc1	ZINC000105017346	328814220	/nfs/dbraw/zinc/81/42/20/328814220.db2.gz	XRTOXEYKVWRRNS-AWEZNQCLSA-N	0	0	290.407	4.294	20	30		CIEDRN
COC(=O)c1ccc(S[C@@H](C)c2cccc(C#N)c2)cc1	ZINC000526946213	328816487	/nfs/dbraw/zinc/81/64/87/328816487.db2.gz	VSXUIWHNOZKDRO-LBPRGKRZSA-N	0	0	297.379	4.198	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@@H]1CCC(C)(C)C1	ZINC000514136547	328833468	/nfs/dbraw/zinc/83/34/68/328833468.db2.gz	RENQTSDCXYFGDT-CYBMUJFWSA-N	0	0	277.433	4.089	20	30		CIEDRN
C=CCCS[C@@H](C)C(=O)Nc1cccc2ccccc21	ZINC000514628244	328838954	/nfs/dbraw/zinc/83/89/54/328838954.db2.gz	DDWJQIFBZMEARP-ZDUSSCGKSA-N	0	0	285.412	4.476	20	30		CIEDRN
C=C(C)CCS[C@@H](C)C(=O)Nc1ccccc1Cl	ZINC000507819057	332826159	/nfs/dbraw/zinc/82/61/59/332826159.db2.gz	MMUURJBAYZZVJI-NSHDSACASA-N	0	0	283.824	4.366	20	30		CIEDRN
C=C(C)CCSCCCc1nc(-c2cccs2)no1	ZINC000507819358	332826262	/nfs/dbraw/zinc/82/62/62/332826262.db2.gz	SOCUVEIAKLXILC-UHFFFAOYSA-N	0	0	294.445	4.430	20	30		CIEDRN
C=C(C)CCS[C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000507833054	332826996	/nfs/dbraw/zinc/82/69/96/332826996.db2.gz	IQKYBWJXDQYOPH-LLVKDONJSA-N	0	0	251.351	4.355	20	30		CIEDRN
C=CCN(CC=C)C(=O)c1ccccc1NC1CCCCC1	ZINC000507861449	332828137	/nfs/dbraw/zinc/82/81/37/332828137.db2.gz	QIMVDIOHJJFZSU-UHFFFAOYSA-N	0	0	298.430	4.245	20	30		CIEDRN
N#Cc1ccccc1SCc1cncc(C(F)(F)F)c1	ZINC000359163222	328896192	/nfs/dbraw/zinc/89/61/92/328896192.db2.gz	NZDLZOSGHMDPNW-UHFFFAOYSA-N	0	0	294.301	4.264	20	30		CIEDRN
Cc1sc(NC(=O)[C@H]2CC[C@H](C)CC2)c(C#N)c1C	ZINC000582304549	328955452	/nfs/dbraw/zinc/95/54/52/328955452.db2.gz	TYCZYXVVNGUHKN-OTCDBFHCSA-N	0	0	276.405	4.001	20	30		CIEDRN
C=CCC(C)(C)c1noc(CCc2ccc(C)cc2)n1	ZINC000582316017	328960043	/nfs/dbraw/zinc/96/00/43/328960043.db2.gz	TZMTWXRNFSUMOQ-UHFFFAOYSA-N	0	0	270.376	4.017	20	30		CIEDRN
N#Cc1c(F)cccc1SC[C@H]1CCCC1(F)F	ZINC000582371060	328973965	/nfs/dbraw/zinc/97/39/65/328973965.db2.gz	KIJCDHMMFKTAAH-SECBINFHSA-N	0	0	271.307	4.225	20	30		CIEDRN
CCC(C)(C)c1ccc(C(=O)N(CCC#N)CC2CC2)cc1	ZINC000121799929	328988889	/nfs/dbraw/zinc/98/88/89/328988889.db2.gz	NIRJYKLBOGOWMO-UHFFFAOYSA-N	0	0	298.430	4.140	20	30		CIEDRN
Cc1ccc(C[C@H](C#N)Sc2ccccc2F)cc1	ZINC000508274060	332836235	/nfs/dbraw/zinc/83/62/35/332836235.db2.gz	BMCGGRVMQJLOPZ-CQSZACIVSA-N	0	0	271.360	4.361	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H](C)c1ccccc1SC	ZINC000508333802	332837213	/nfs/dbraw/zinc/83/72/13/332837213.db2.gz	XYFPRNUBQJITDQ-ZDUSSCGKSA-N	0	0	289.444	4.354	20	30		CIEDRN
C=CCCCNc1cccc2c1CN(c1nccs1)C2	ZINC000378267770	329044684	/nfs/dbraw/zinc/04/46/84/329044684.db2.gz	BXMWDMHBABPNKU-UHFFFAOYSA-N	0	0	285.416	4.041	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@H]1c1ccc(OC)c(C)c1	ZINC000378645398	329057928	/nfs/dbraw/zinc/05/79/28/329057928.db2.gz	FBVJVGUOUWLXCB-INIZCTEOSA-N	0	0	287.403	4.023	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@@H](c2ccc(C)cc2)C1	ZINC000378647478	329058034	/nfs/dbraw/zinc/05/80/34/329058034.db2.gz	IYUHDIRFGZXAHT-GOSISDBHSA-N	0	0	283.415	4.079	20	30		CIEDRN
C[C@@H](Nc1cccc(OCCCC#N)c1)c1cccc(O)c1	ZINC000193905580	329062018	/nfs/dbraw/zinc/06/20/18/329062018.db2.gz	NBMPOYBLVBUBRS-CQSZACIVSA-N	0	0	296.370	4.248	20	30		CIEDRN
C=C1CCN(C(=O)c2cccc(Nc3ccccc3)c2)CC1	ZINC000522820776	329066166	/nfs/dbraw/zinc/06/61/66/329066166.db2.gz	WRFGYXDGJSASIO-UHFFFAOYSA-N	0	0	292.382	4.222	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1ccc(C)c(C(C)=O)c1	ZINC000194175274	329066976	/nfs/dbraw/zinc/06/69/76/329066976.db2.gz	DAGXNUPCOXOQGC-UHFFFAOYSA-N	0	0	287.403	4.016	20	30		CIEDRN
CCCCCCCC(=O)N1CCC[C@H](c2nccs2)C1	ZINC000170891821	329069488	/nfs/dbraw/zinc/06/94/88/329069488.db2.gz	GBWHCBISHWSAAW-AWEZNQCLSA-N	0	0	294.464	4.210	20	30		CIEDRN
CCOc1cc(C#N)ccc1OCc1cc2ccccc2o1	ZINC000486929091	329075588	/nfs/dbraw/zinc/07/55/88/329075588.db2.gz	URLXVBFXEVYJEW-UHFFFAOYSA-N	0	0	293.322	4.282	20	30		CIEDRN
C=CCN(CC=C)C(=O)Nc1cccc(SCC)c1	ZINC000172216180	329081122	/nfs/dbraw/zinc/08/11/22/329081122.db2.gz	CTLBDAOUDZRJNL-UHFFFAOYSA-N	0	0	276.405	4.005	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CC[C@H]1c1ccc(Cl)cc1	ZINC000582684079	329128141	/nfs/dbraw/zinc/12/81/41/329128141.db2.gz	SOEWNHPLUKBXEC-GJZGRUSLSA-N	0	0	292.810	4.151	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1cccc(C(F)F)c1	ZINC000172465459	329135152	/nfs/dbraw/zinc/13/51/52/329135152.db2.gz	TYFUTUGHFGCAPS-UHFFFAOYSA-N	0	0	281.346	4.443	20	30		CIEDRN
N#Cc1c(F)cccc1SCc1ccc(F)cc1	ZINC000582763689	329155449	/nfs/dbraw/zinc/15/54/49/329155449.db2.gz	XEBGMMIEWCFBED-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
C=CCCCC(=O)Nc1cccc(COCc2ccco2)c1	ZINC000175357255	329164554	/nfs/dbraw/zinc/16/45/54/329164554.db2.gz	NTRXDCYSZQAIDL-UHFFFAOYSA-N	0	0	299.370	4.291	20	30		CIEDRN
C=CCCCC(=O)Nc1cccc(NC(=O)CCC)c1C	ZINC000175423521	329165494	/nfs/dbraw/zinc/16/54/94/329165494.db2.gz	VNCGMQLHBUSYFI-UHFFFAOYSA-N	0	0	288.391	4.028	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@@H]1c1ccc(Cl)cc1	ZINC000175236717	329166481	/nfs/dbraw/zinc/16/64/81/329166481.db2.gz	BFBXSUWCRLLXLK-OAHLLOKOSA-N	0	0	277.795	4.360	20	30		CIEDRN
C=CCCCC(=O)N(Cc1cccnc1)c1ccc(F)cc1	ZINC000175655801	329167663	/nfs/dbraw/zinc/16/76/63/329167663.db2.gz	RULJQKDEDDSENA-UHFFFAOYSA-N	0	0	298.361	4.110	20	30		CIEDRN
C=CCCCC(=O)N(c1nc(C)cs1)c1ccccc1	ZINC000175597779	329169088	/nfs/dbraw/zinc/16/90/88/329169088.db2.gz	IDVAMAKYPGGCAU-UHFFFAOYSA-N	0	0	286.400	4.473	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](CC)c1ccccc1OCC	ZINC000175509444	329169425	/nfs/dbraw/zinc/16/94/25/329169425.db2.gz	XRMBHNCRDZONNI-HNNXBMFYSA-N	0	0	275.392	4.009	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Nc1ccc(C)s1	ZINC000175865854	329171912	/nfs/dbraw/zinc/17/19/12/329171912.db2.gz	CVYHITAPUNROFC-UHFFFAOYSA-N	0	0	266.410	4.267	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](C)c1ccc(-c2cccnc2)cc1	ZINC000176494623	329175191	/nfs/dbraw/zinc/17/51/91/329175191.db2.gz	QTKDKHXLUXVHMQ-HNNXBMFYSA-N	0	0	294.398	4.282	20	30		CIEDRN
C=C(C)CCc1noc(-c2cnc(-c3ccccc3)s2)n1	ZINC000508630804	332844952	/nfs/dbraw/zinc/84/49/52/332844952.db2.gz	HMQCTVCWGRIIFW-UHFFFAOYSA-N	0	0	297.383	4.369	20	30		CIEDRN
Cc1ccccc1[C@H](C)CC(=O)N[C@@H](C#N)C1CCCCC1	ZINC000176597005	329177176	/nfs/dbraw/zinc/17/71/76/329177176.db2.gz	QKJKNWSVNAMSRM-QAPCUYQASA-N	0	0	298.430	4.077	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(-c2csc(C)n2)cc1	ZINC000177481069	329184693	/nfs/dbraw/zinc/18/46/93/329184693.db2.gz	PQXILGGXOREZQM-UHFFFAOYSA-N	0	0	286.400	4.413	20	30		CIEDRN
CO[C@@H](C)c1nc(CSc2ccccc2C#N)cs1	ZINC000177307224	329185949	/nfs/dbraw/zinc/18/59/49/329185949.db2.gz	BTCQAGLQIUJPMN-JTQLQIEISA-N	0	0	290.413	4.014	20	30		CIEDRN
C=C(C)CCc1noc(/C=C\c2cccc(C)c2)n1	ZINC000508645394	332845917	/nfs/dbraw/zinc/84/59/17/332845917.db2.gz	MRKDCCDNEHCETD-NTMALXAHSA-N	0	0	254.333	4.057	20	30		CIEDRN
C=C(C)CCc1noc(/C(C)=C\c2ccc(C)cc2)n1	ZINC000508671516	332846946	/nfs/dbraw/zinc/84/69/46/332846946.db2.gz	NCBUYRVUNPENNA-KAMYIIQDSA-N	0	0	268.360	4.447	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)Cc1ncc(C)s1	ZINC000180410270	329216005	/nfs/dbraw/zinc/21/60/05/329216005.db2.gz	QTTISVCDUYDDOK-UHFFFAOYSA-N	0	0	298.864	4.355	20	30		CIEDRN
C=C(C)CCc1noc(-c2cnn(C(CC)CC)c2C)n1	ZINC000508688040	332847490	/nfs/dbraw/zinc/84/74/90/332847490.db2.gz	VSQMROMUADRNBG-UHFFFAOYSA-N	0	0	288.395	4.111	20	30		CIEDRN
C=C(C)CCc1noc(/C(C)=C\c2ccc(F)cc2)n1	ZINC000508688018	332847696	/nfs/dbraw/zinc/84/76/96/332847696.db2.gz	VHLBQQQLCYCPET-BENRWUELSA-N	0	0	272.323	4.278	20	30		CIEDRN
CCCCCCCC(=O)N1C[C@@H](C)C[C@H]1c1cccnc1	ZINC000182163670	329240243	/nfs/dbraw/zinc/24/02/43/329240243.db2.gz	BDTAZFPBELKAAC-RDJZCZTQSA-N	0	0	288.435	4.352	20	30		CIEDRN
O=C(/C=C/c1cccc(-c2cccnc2)c1)c1ccncc1	ZINC000182244570	329241260	/nfs/dbraw/zinc/24/12/60/329241260.db2.gz	IFGNEPIPCMIMNP-VOTSOKGWSA-N	0	0	286.334	4.040	20	30		CIEDRN
Cc1ccc(CNc2ccccc2SCCC#N)c(C)n1	ZINC000184446372	329258183	/nfs/dbraw/zinc/25/81/83/329258183.db2.gz	JHVZJZHLSMUWIR-UHFFFAOYSA-N	0	0	297.427	4.316	20	30		CIEDRN
N#Cc1cnc2ccccc2c1N[C@H]1CCc2ccccc2C1	ZINC000321097613	329258934	/nfs/dbraw/zinc/25/89/34/329258934.db2.gz	LNVXAVFMPWNBIZ-KRWDZBQOSA-N	0	0	299.377	4.076	20	30		CIEDRN
Cc1nc(CSCc2ccc(Cl)cc2C#N)cs1	ZINC000184822059	329263274	/nfs/dbraw/zinc/26/32/74/329263274.db2.gz	CGOWQPVMVSMVKW-UHFFFAOYSA-N	0	0	294.832	4.410	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](c1ccco1)c1ccccc1	ZINC000185059423	329265268	/nfs/dbraw/zinc/26/52/68/329265268.db2.gz	OBRAYMWLQODAPZ-YOEHRIQHSA-N	0	0	283.371	4.088	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(CSCc2ccccc2)no1	ZINC000582931068	329286251	/nfs/dbraw/zinc/28/62/51/329286251.db2.gz	GDJDJFHXRGIKNO-MRXNPFEDSA-N	0	0	288.416	4.357	20	30		CIEDRN
Cc1ccc(C#N)cc1NCc1cc(C)c2ncccc2c1	ZINC000582967289	329295159	/nfs/dbraw/zinc/29/51/59/329295159.db2.gz	AOLUYHFLGYRJOY-UHFFFAOYSA-N	0	0	287.366	4.335	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2cccc(C)c2F)no1	ZINC000583109838	329312755	/nfs/dbraw/zinc/31/27/55/329312755.db2.gz	XLAHPYKUIOEKBQ-LLVKDONJSA-N	0	0	260.312	4.254	20	30		CIEDRN
CC#CCCCC(=O)N1CCCC[C@@H]1c1ccc(C)cc1	ZINC000185658692	329328591	/nfs/dbraw/zinc/32/85/91/329328591.db2.gz	GINUIXPFIRMIAS-GOSISDBHSA-N	0	0	283.415	4.242	20	30		CIEDRN
CCCCC1CCC(C(=O)N2CCC(CC#N)CC2)CC1	ZINC000397112395	329343549	/nfs/dbraw/zinc/34/35/49/329343549.db2.gz	DBAMTSRVXBXHKM-UHFFFAOYSA-N	0	0	290.451	4.135	20	30		CIEDRN
C=CCCCCSc1nnc(-c2ccccc2)o1	ZINC000583184841	329348943	/nfs/dbraw/zinc/34/89/43/329348943.db2.gz	OFIZWZAFNQCYBI-UHFFFAOYSA-N	0	0	260.362	4.185	20	30		CIEDRN
Cc1noc(C)c1-c1csc(Nc2ccc(C#N)cc2)n1	ZINC000187001755	329351258	/nfs/dbraw/zinc/35/12/58/329351258.db2.gz	WREYXWGBMUTPOE-UHFFFAOYSA-N	0	0	296.355	4.030	20	30		CIEDRN
Cc1cc([C@@H](C)NCc2ccc(Cl)cc2C#N)c(C)o1	ZINC000187496979	329358287	/nfs/dbraw/zinc/35/82/87/329358287.db2.gz	QVWNAIWOWDCWID-LLVKDONJSA-N	0	0	288.778	4.272	20	30		CIEDRN
C=CCC1(C(=O)N(C)Cc2cc3ccccc3o2)CCC1	ZINC000188699907	329371956	/nfs/dbraw/zinc/37/19/56/329371956.db2.gz	KGKNBWWFAUVHFU-UHFFFAOYSA-N	0	0	283.371	4.138	20	30		CIEDRN
C=CCC[C@H](NC(=O)c1coc(C)c1)c1ccccc1	ZINC000188822967	329373605	/nfs/dbraw/zinc/37/36/05/329373605.db2.gz	MJLHASPKMGFLDS-INIZCTEOSA-N	0	0	269.344	4.025	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)C1CCC1	ZINC000189897722	329388562	/nfs/dbraw/zinc/38/85/62/329388562.db2.gz	QVFBGDLWNPBLIW-UHFFFAOYSA-N	0	0	257.377	4.277	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C)nc1	ZINC000189899040	329388586	/nfs/dbraw/zinc/38/85/86/329388586.db2.gz	NEYCAXDCBAVWBR-UHFFFAOYSA-N	0	0	294.398	4.494	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CC=C(c2ccc(F)cc2)CC1	ZINC000189959864	329390065	/nfs/dbraw/zinc/39/00/65/329390065.db2.gz	RSNVNHKZDJZAGF-SFHVURJKSA-N	0	0	287.378	4.044	20	30		CIEDRN
Cc1c(C#N)cccc1C(=O)N[C@H](C)c1ccccc1Cl	ZINC000509035416	332856947	/nfs/dbraw/zinc/85/69/47/332856947.db2.gz	SGXCGJHQWNOLPM-GFCCVEGCSA-N	0	0	298.773	4.011	20	30		CIEDRN
CC(C)CCc1nc(CSCCCC#N)cs1	ZINC000190926515	329403216	/nfs/dbraw/zinc/40/32/16/329403216.db2.gz	YEUDRRDBJQQBOL-UHFFFAOYSA-N	0	0	268.451	4.269	20	30		CIEDRN
CC[C@H](SCCCC#N)c1ccc(F)cc1F	ZINC000190953606	329403530	/nfs/dbraw/zinc/40/35/30/329403530.db2.gz	SQQHHKPXZQOCRB-ZDUSSCGKSA-N	0	0	255.333	4.453	20	30		CIEDRN
CSc1ccc(OCc2ccc(CC#N)cc2)cc1	ZINC000398970283	329446904	/nfs/dbraw/zinc/44/69/04/329446904.db2.gz	VMJGWDXDNXTPDY-UHFFFAOYSA-N	0	0	269.369	4.054	20	30		CIEDRN
N#CCc1ccc(CNc2cc(F)cc(Cl)c2)cc1	ZINC000399027503	329447426	/nfs/dbraw/zinc/44/74/26/329447426.db2.gz	KGOAYTKHJUTLPS-UHFFFAOYSA-N	0	0	274.726	4.157	20	30		CIEDRN
N#CCc1ccc(CNc2ccc(Cl)cc2F)cc1	ZINC000399131354	329448496	/nfs/dbraw/zinc/44/84/96/329448496.db2.gz	XKZHLROYCFPZQT-UHFFFAOYSA-N	0	0	274.726	4.157	20	30		CIEDRN
N#CCc1ccc(CSc2cc(F)ccc2F)cc1	ZINC000399136523	329448770	/nfs/dbraw/zinc/44/87/70/329448770.db2.gz	QZHOSCKWTUFGRC-UHFFFAOYSA-N	0	0	275.323	4.323	20	30		CIEDRN
C=CCC[C@H](NC(=O)N(C)CC(C)(C)C)c1ccccc1	ZINC000509223701	332861760	/nfs/dbraw/zinc/86/17/60/332861760.db2.gz	LQCJIHNGBYAURT-INIZCTEOSA-N	0	0	288.435	4.381	20	30		CIEDRN
CCC[C@H](Nc1ccc(C#N)cc1[N+](=O)[O-])c1ccccc1	ZINC000301910665	332862358	/nfs/dbraw/zinc/86/23/58/332862358.db2.gz	YTWQXCHQXJTPQS-HNNXBMFYSA-N	0	0	295.342	4.420	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1cc2c(s1)CCCCCC2	ZINC000301998989	332864791	/nfs/dbraw/zinc/86/47/91/332864791.db2.gz	RECOLIQPNIAKNF-UHFFFAOYSA-N	0	0	291.460	4.445	20	30		CIEDRN
N#CCCCCSc1nnc(-c2ccc(Cl)cc2)o1	ZINC000124195498	329567794	/nfs/dbraw/zinc/56/77/94/329567794.db2.gz	ZDJFCNPFHOZYLE-UHFFFAOYSA-N	0	0	293.779	4.176	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(Cl)cc1COC	ZINC000425629948	329573860	/nfs/dbraw/zinc/57/38/60/329573860.db2.gz	FWLIUBYKNVRLNM-OAHLLOKOSA-N	0	0	281.783	4.027	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(C3CC3)c(C)c2)CCOCC1	ZINC000424783625	329587380	/nfs/dbraw/zinc/58/73/80/329587380.db2.gz	ZJGXTHRCJBSOQR-UHFFFAOYSA-N	0	0	299.414	4.184	20	30		CIEDRN
C[C@@H](c1cccc(C#N)c1)N(C)C(=O)CC1(C)CCCC1	ZINC000425105919	329593386	/nfs/dbraw/zinc/59/33/86/329593386.db2.gz	FQPSCYLJPBDXMV-AWEZNQCLSA-N	0	0	284.403	4.048	20	30		CIEDRN
CCC[C@@H](CC1CCCC1)C(=O)N1CCC(C)(C#N)CC1	ZINC000509371154	332866829	/nfs/dbraw/zinc/86/68/29/332866829.db2.gz	VMFRRGOQPRPNFL-INIZCTEOSA-N	0	0	290.451	4.135	20	30		CIEDRN
CCCC(C)(C)CC(=O)N(C)[C@@H](C)c1cccc(C#N)c1	ZINC000425113648	329596598	/nfs/dbraw/zinc/59/65/98/329596598.db2.gz	RERZNJWHHVRGCB-AWEZNQCLSA-N	0	0	286.419	4.294	20	30		CIEDRN
C[C@@H](c1cccc(C#N)c1)N(C)C(=O)C1CC(C(C)(C)C)C1	ZINC000425117335	329599456	/nfs/dbraw/zinc/59/94/56/329599456.db2.gz	WVZZQTXRXADQLE-IGEOTXOUSA-N	0	0	298.430	4.150	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N(CC)Cc1c[nH]c2ccccc12	ZINC000424801828	329611755	/nfs/dbraw/zinc/61/17/55/329611755.db2.gz	YCHDXPXTAHELSP-UHFFFAOYSA-N	0	0	284.403	4.119	20	30		CIEDRN
CSCCc1ccc(NCC(C)(C)CCC#N)cc1	ZINC000129056748	329614209	/nfs/dbraw/zinc/61/42/09/329614209.db2.gz	XAISUPRWAGVPLX-UHFFFAOYSA-N	0	0	276.449	4.334	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)[C@@H]1CCC[C@H](F)C1	ZINC000424805549	329616159	/nfs/dbraw/zinc/61/61/59/329616159.db2.gz	BGTJXRCBDNHQQR-SJORKVTESA-N	0	0	289.394	4.120	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)NCc1cccc(SCC)c1	ZINC000424821569	329621201	/nfs/dbraw/zinc/62/12/01/329621201.db2.gz	AMGZXAWGEKGKNN-UHFFFAOYSA-N	0	0	277.433	4.017	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N1CC[C@H](c2ccccc2)C[C@H]1C	ZINC000424824410	329622079	/nfs/dbraw/zinc/62/20/79/329622079.db2.gz	CEUVPDFIWJKIPJ-WBVHZDCISA-N	0	0	285.431	4.383	20	30		CIEDRN
CC[C@H](Nc1ncc2c(c1C#N)CCC2)c1cccs1	ZINC000425226205	329643803	/nfs/dbraw/zinc/64/38/03/329643803.db2.gz	HJNMNOWPDXBMPD-AWEZNQCLSA-N	0	0	283.400	4.067	20	30		CIEDRN
C=CC[C@H](C(=O)NCC1(C2CC2)CCC1)c1ccccc1	ZINC000188763032	329650101	/nfs/dbraw/zinc/65/01/01/329650101.db2.gz	VAICIRTYORASEW-KRWDZBQOSA-N	0	0	283.415	4.043	20	30		CIEDRN
N#Cc1cccc(S[C@H]2CCCc3ccccc32)n1	ZINC000152496289	329661129	/nfs/dbraw/zinc/66/11/29/329661129.db2.gz	AXPUJTHJTCAVLK-HNNXBMFYSA-N	0	0	266.369	4.123	20	30		CIEDRN
N#Cc1ccc2c(c1)CCC[C@H]2Nc1ccc(Cl)cn1	ZINC000419019776	329703883	/nfs/dbraw/zinc/70/38/83/329703883.db2.gz	VZEDGHYMHVSQMR-OAHLLOKOSA-N	0	0	283.762	4.096	20	30		CIEDRN
C[C@@H](Nc1ccc(C#N)nc1)c1ccc(C2CC2)cc1	ZINC000419006303	329705360	/nfs/dbraw/zinc/70/53/60/329705360.db2.gz	PVUGMCVCGRSMHM-GFCCVEGCSA-N	0	0	263.344	4.004	20	30		CIEDRN
CCc1ccc([C@@H]2C[C@@H](C)CCN2c2ccc(C#N)nc2)o1	ZINC000509540279	332872981	/nfs/dbraw/zinc/87/29/81/332872981.db2.gz	MLTRKNUGBQIBNV-GUYCJALGSA-N	0	0	295.386	4.086	20	30		CIEDRN
N#CC1(CSCc2ncc(-c3ccccc3)o2)CCC1	ZINC000419364698	329720350	/nfs/dbraw/zinc/72/03/50/329720350.db2.gz	PZKMDQVCYWLQQZ-UHFFFAOYSA-N	0	0	284.384	4.269	20	30		CIEDRN
C[C@@H](CCc1ccccc1)SCC1(C#N)CCC1	ZINC000419390766	329721939	/nfs/dbraw/zinc/72/19/39/329721939.db2.gz	MMEHXUVIJBDLRS-AWEZNQCLSA-N	0	0	259.418	4.435	20	30		CIEDRN
N#CC1(CSCc2ccc(OC(F)F)cc2)CCC1	ZINC000419390903	329722078	/nfs/dbraw/zinc/72/20/78/329722078.db2.gz	GSPYPNSZWTVVIR-UHFFFAOYSA-N	0	0	283.343	4.215	20	30		CIEDRN
C[C@H](SCC1(C#N)CCC1)c1ccc(F)cc1F	ZINC000419405351	329723885	/nfs/dbraw/zinc/72/38/85/329723885.db2.gz	UZSCQDBQQHQLDI-JTQLQIEISA-N	0	0	267.344	4.453	20	30		CIEDRN
C=CCS[C@H](C)c1nnc(-c2ccc(C)c(C)c2)o1	ZINC000419411620	329724721	/nfs/dbraw/zinc/72/47/21/329724721.db2.gz	QDPNAQICPIIEKI-GFCCVEGCSA-N	0	0	274.389	4.334	20	30		CIEDRN
N#CC1(CS[C@H]2CCc3ccc(F)cc32)CCC1	ZINC000419417391	329725318	/nfs/dbraw/zinc/72/53/18/329725318.db2.gz	JZFRLKMSKXOQRA-AWEZNQCLSA-N	0	0	261.365	4.240	20	30		CIEDRN
C=CCOCCSCc1nc(-c2ccccc2)oc1C	ZINC000419380591	329725749	/nfs/dbraw/zinc/72/57/49/329725749.db2.gz	UZORPJKXAYGPBQ-UHFFFAOYSA-N	0	0	289.400	4.086	20	30		CIEDRN
C[C@H](SCCc1cscn1)c1ccc(C#N)cc1	ZINC000419420605	329727307	/nfs/dbraw/zinc/72/73/07/329727307.db2.gz	JYAVZRNHXKXQMS-NSHDSACASA-N	0	0	274.414	4.052	20	30		CIEDRN
N#Cc1csc(CS[C@@H]2CCc3ccc(F)cc32)n1	ZINC000419425146	329727731	/nfs/dbraw/zinc/72/77/31/329727731.db2.gz	VFLJNDNEUPHPFJ-CYBMUJFWSA-N	0	0	290.388	4.075	20	30		CIEDRN
N#Cc1csc(CSCCCc2cccc(F)c2)n1	ZINC000419453544	329730654	/nfs/dbraw/zinc/73/06/54/329730654.db2.gz	JKKQFWNXGHGXNR-UHFFFAOYSA-N	0	0	292.404	4.020	20	30		CIEDRN
C[C@@H](SCCc1cscn1)c1cccc(C#N)c1	ZINC000419462057	329731855	/nfs/dbraw/zinc/73/18/55/329731855.db2.gz	IUORWHZMVNQPTQ-LLVKDONJSA-N	0	0	274.414	4.052	20	30		CIEDRN
COc1ccc(Cl)c(CSCC2(C#N)CCC2)c1	ZINC000419461754	329731884	/nfs/dbraw/zinc/73/18/84/329731884.db2.gz	IFXMUANFQRWXMH-UHFFFAOYSA-N	0	0	281.808	4.276	20	30		CIEDRN
N#Cc1csc(CSC[C@@H]2C[C@H]2c2ccccc2)n1	ZINC000419500225	329732434	/nfs/dbraw/zinc/73/24/34/329732434.db2.gz	ZGGVWSIUNBDENC-JSGCOSHPSA-N	0	0	286.425	4.052	20	30		CIEDRN
C=CCCCCCSCc1ccn(CC(F)(F)F)n1	ZINC000419500257	329732544	/nfs/dbraw/zinc/73/25/44/329732544.db2.gz	PXWPAHNGADTMEW-UHFFFAOYSA-N	0	0	292.370	4.425	20	30		CIEDRN
C=CCOCCS[C@H](C)c1ncc(-c2ccccc2)o1	ZINC000419507166	329733624	/nfs/dbraw/zinc/73/36/24/329733624.db2.gz	OBSFDEJECLWUMY-CYBMUJFWSA-N	0	0	289.400	4.338	20	30		CIEDRN
COCc1ccc(CSCc2ccc(CC#N)cc2)cc1	ZINC000419487093	329736623	/nfs/dbraw/zinc/73/66/23/329736623.db2.gz	YPSYJWBQULNCFH-UHFFFAOYSA-N	0	0	297.423	4.332	20	30		CIEDRN
N#CC1(CSCc2cncc(C(F)(F)F)c2)CCC1	ZINC000419492047	329737253	/nfs/dbraw/zinc/73/72/53/329737253.db2.gz	NPMSKLCRRSGUMU-UHFFFAOYSA-N	0	0	286.322	4.027	20	30		CIEDRN
N#CC1(CSCc2ccc([N+](=O)[O-])cc2Cl)CCC1	ZINC000419576521	329739821	/nfs/dbraw/zinc/73/98/21/329739821.db2.gz	GEGXQBPEOOZLKD-UHFFFAOYSA-N	0	0	296.779	4.175	20	30		CIEDRN
N#CC1(CSC2CC(OCc3ccccc3)C2)CCC1	ZINC000419578124	329741120	/nfs/dbraw/zinc/74/11/20/329741120.db2.gz	IJXCRUWMSARUBE-UHFFFAOYSA-N	0	0	287.428	4.161	20	30		CIEDRN
CC(C)(C)c1cc(CSCc2cccc(C#N)c2)no1	ZINC000419587980	329741865	/nfs/dbraw/zinc/74/18/65/329741865.db2.gz	IIHZVMFPLZYIBY-UHFFFAOYSA-N	0	0	286.400	4.277	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H]2C[C@@H]2c2ccccc2)n1	ZINC000420499627	329770291	/nfs/dbraw/zinc/77/02/91/329770291.db2.gz	DLAAQNPVYWZPHF-KGLIPLIRSA-N	0	0	268.360	4.194	20	30		CIEDRN
CC(C)Sc1ccc([C@@H](C)Nc2cncc(C#N)n2)cc1	ZINC000420587866	329778226	/nfs/dbraw/zinc/77/82/26/329778226.db2.gz	RDLXFXUTDSKKBL-GFCCVEGCSA-N	0	0	298.415	4.022	20	30		CIEDRN
C=CCCCCNC(=O)N[C@H](CC(F)F)c1ccccc1	ZINC000420844978	329786484	/nfs/dbraw/zinc/78/64/84/329786484.db2.gz	YBOVHZRTLJOSPP-CQSZACIVSA-N	0	0	296.361	4.038	20	30		CIEDRN
C=CCCc1ccccc1NCc1nn(C)c(C)c1Cl	ZINC000421359970	329822733	/nfs/dbraw/zinc/82/27/33/329822733.db2.gz	XZUHFJZOAJDSGK-UHFFFAOYSA-N	0	0	289.810	4.113	20	30		CIEDRN
C=CCN(Cc1ccccc1C(F)(F)F)CC(F)(F)F	ZINC000509698499	332879155	/nfs/dbraw/zinc/87/91/55/332879155.db2.gz	OJVZZRATCZZREH-UHFFFAOYSA-N	0	0	297.242	4.256	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CC12CC2	ZINC000421503823	329839905	/nfs/dbraw/zinc/83/99/05/329839905.db2.gz	JKYBZUWTPZRFAO-OAHLLOKOSA-N	0	0	269.388	4.277	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@@]1(C)Cc1ccc(F)cc1	ZINC000421619051	329856497	/nfs/dbraw/zinc/85/64/97/329856497.db2.gz	GANXMNSAZDNSEK-SFHVURJKSA-N	0	0	289.394	4.106	20	30		CIEDRN
Cc1cccc(C)c1NC(=O)N[C@H](C)c1ccc(C#N)cc1	ZINC000075994991	329888948	/nfs/dbraw/zinc/88/89/48/329888948.db2.gz	BGYBRPQAJMBFLN-CQSZACIVSA-N	0	0	293.370	4.058	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)c1sccc1F	ZINC000509855022	332884204	/nfs/dbraw/zinc/88/42/04/332884204.db2.gz	XLSYMBSCOCHJMA-UHFFFAOYSA-N	0	0	289.375	4.106	20	30		CIEDRN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@H]1CCC(C)(C)C1	ZINC000514152369	329923384	/nfs/dbraw/zinc/92/33/84/329923384.db2.gz	UTMYLJNIHRGUSC-KRWDZBQOSA-N	0	0	298.430	4.122	20	30		CIEDRN
CN(Cc1ccc(F)c(Cl)c1Cl)CC(C)(C)C#N	ZINC000572024617	329938497	/nfs/dbraw/zinc/93/84/97/329938497.db2.gz	PVAJJUZPLHJIFT-UHFFFAOYSA-N	0	0	289.181	4.114	20	30		CIEDRN
CC(C)(C#N)CC(=O)Nc1cccc(-c2ccccc2)c1	ZINC000572106820	329944994	/nfs/dbraw/zinc/94/49/94/329944994.db2.gz	OHHKZGPQJADFTE-UHFFFAOYSA-N	0	0	278.355	4.232	20	30		CIEDRN
C=CCN(C)C(=O)c1cc(-c2ccc(F)cc2)c(C)s1	ZINC000161552790	329944996	/nfs/dbraw/zinc/94/49/96/329944996.db2.gz	XJBVJTPEODWAOL-UHFFFAOYSA-N	0	0	289.375	4.121	20	30		CIEDRN
C=CCN(C)C(=O)c1ccc(CSc2ccccc2)cc1	ZINC000161737559	329953938	/nfs/dbraw/zinc/95/39/38/329953938.db2.gz	BWFLDEYGLHQUNZ-UHFFFAOYSA-N	0	0	297.423	4.237	20	30		CIEDRN
C=CCCCCCOc1ccc(-c2nncs2)cc1	ZINC000572207737	329955083	/nfs/dbraw/zinc/95/50/83/329955083.db2.gz	JWLXTHWZGLKEFD-UHFFFAOYSA-N	0	0	274.389	4.330	20	30		CIEDRN
C=CCN(C)C(=O)c1cccc(-c2ccccc2OCC)c1	ZINC000161956706	329961855	/nfs/dbraw/zinc/96/18/55/329961855.db2.gz	GUTYIZYJOWAOGD-UHFFFAOYSA-N	0	0	295.382	4.010	20	30		CIEDRN
C[C@@H](Nc1cccc2ccn(C)c21)c1cccc(C#N)c1	ZINC000188778915	329963193	/nfs/dbraw/zinc/96/31/93/329963193.db2.gz	LXGVROYVJFOTAI-CYBMUJFWSA-N	0	0	275.355	4.223	20	30		CIEDRN
C=CCN(C(=O)[C@@H](C)c1ccc(Cl)c(Cl)c1)C1CC1	ZINC000536821417	329968372	/nfs/dbraw/zinc/96/83/72/329968372.db2.gz	MMDIEBHJTSJAEY-JTQLQIEISA-N	0	0	298.213	4.274	20	30		CIEDRN
C=CCN(C(=O)c1cccc(Nc2ccccc2)c1)C1CC1	ZINC000536820054	329968445	/nfs/dbraw/zinc/96/84/45/329968445.db2.gz	GSHTVJCJRYHPKO-UHFFFAOYSA-N	0	0	292.382	4.221	20	30		CIEDRN
C=C(C)CSCc1cccc(C(=O)N2CCCCC2)c1	ZINC000079385693	330023906	/nfs/dbraw/zinc/02/39/06/330023906.db2.gz	OTWWHTLNZWHEKP-UHFFFAOYSA-N	0	0	289.444	4.122	20	30		CIEDRN
C=CCCC(=O)N(C)[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000263685097	330060148	/nfs/dbraw/zinc/06/01/48/330060148.db2.gz	PYNRCCWUMGVKGS-LLVKDONJSA-N	0	0	285.309	4.191	20	30		CIEDRN
C=C1CCN(C(=O)CCCCCc2cccs2)CC1	ZINC000264545684	330061712	/nfs/dbraw/zinc/06/17/12/330061712.db2.gz	UIUPPVCTWIFHPS-UHFFFAOYSA-N	0	0	277.433	4.030	20	30		CIEDRN
C=C1CCN(C(=O)[C@H]2C[C@@H]2c2ccc3ccccc3c2)CC1	ZINC000264580958	330061734	/nfs/dbraw/zinc/06/17/34/330061734.db2.gz	VGXGTNOQRMEXFO-MOPGFXCFSA-N	0	0	291.394	4.122	20	30		CIEDRN
C=CCCCC(=O)N1CCC(c2ccc(F)c(F)c2)CC1	ZINC000267168691	330064649	/nfs/dbraw/zinc/06/46/49/330064649.db2.gz	LNHMUQLFIJKJKC-UHFFFAOYSA-N	0	0	293.357	4.027	20	30		CIEDRN
Cc1ccccc1-c1noc(-c2ccc(C#N)c(Cl)c2)n1	ZINC000162540984	330066163	/nfs/dbraw/zinc/06/61/63/330066163.db2.gz	DTKRYXFAHNEFQP-UHFFFAOYSA-N	0	0	295.729	4.237	20	30		CIEDRN
CC(C)N(C(=O)c1cccc(C#N)c1)[C@H](C)c1ccsc1	ZINC000421694180	330067669	/nfs/dbraw/zinc/06/76/69/330067669.db2.gz	UMBGZYQIXRVEHO-CYBMUJFWSA-N	0	0	298.411	4.232	20	30		CIEDRN
CC#CCCCC(=O)N(C(C)C)[C@@H](C)c1ccsc1	ZINC000421686897	330070407	/nfs/dbraw/zinc/07/04/07/330070407.db2.gz	CVLHLADNLPJLOO-AWEZNQCLSA-N	0	0	277.433	4.240	20	30		CIEDRN
CCc1cc(Br)ccc1NCCC(C)(C)C#N	ZINC000148284467	330071902	/nfs/dbraw/zinc/07/19/02/330071902.db2.gz	PQOSIHSWEPATGF-UHFFFAOYSA-N	0	0	295.224	4.363	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@@H](C)CCc1ccco1)c1ccccc1	ZINC000270189405	330073563	/nfs/dbraw/zinc/07/35/63/330073563.db2.gz	BSAWODDISHLZGA-JKSUJKDBSA-N	0	0	297.398	4.077	20	30		CIEDRN
C#CC[C@H](NCc1csc(C(C)(C)C)n1)c1ccccc1	ZINC000270167281	330073692	/nfs/dbraw/zinc/07/36/92/330073692.db2.gz	GYUWQADOANDRBS-INIZCTEOSA-N	0	0	298.455	4.295	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1ccccc1CCC(F)(F)F	ZINC000270201338	330073939	/nfs/dbraw/zinc/07/39/39/330073939.db2.gz	CHZSTHXFNRJQPX-UHFFFAOYSA-N	0	0	299.336	4.220	20	30		CIEDRN
C=CCCCC(=O)N1CC[C@H](c2ccccc2)C1(C)C	ZINC000421721223	330074405	/nfs/dbraw/zinc/07/44/05/330074405.db2.gz	GVZUQSINVLQLOW-MRXNPFEDSA-N	0	0	271.404	4.137	20	30		CIEDRN
C#CCCCCC(=O)N[C@H](CC)c1ccc(Cl)s1	ZINC000271364818	330078775	/nfs/dbraw/zinc/07/87/75/330078775.db2.gz	KXSXWRNBNIPQKW-LLVKDONJSA-N	0	0	283.824	4.162	20	30		CIEDRN
C#CC[C@H](NCc1ccn(C(CC)CC)n1)c1ccccc1	ZINC000271737275	330081890	/nfs/dbraw/zinc/08/18/90/330081890.db2.gz	UMDZTBSXCDICKC-IBGZPJMESA-N	0	0	295.430	4.098	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1cc(SC)ccc1C	ZINC000271787796	330081927	/nfs/dbraw/zinc/08/19/27/330081927.db2.gz	CTHBBBKWXFVZFO-UHFFFAOYSA-N	0	0	278.421	4.147	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H]1c1ccc(F)cc1	ZINC000274264616	330104271	/nfs/dbraw/zinc/10/42/71/330104271.db2.gz	DQSZDKKRGRDKBC-XJKSGUPXSA-N	0	0	275.367	4.092	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCCCC[C@H]1c1cccn1C	ZINC000274297100	330104487	/nfs/dbraw/zinc/10/44/87/330104487.db2.gz	RJMCGLVZMLWYMN-RDJZCZTQSA-N	0	0	288.435	4.071	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1cc[nH]c1CCC	ZINC000421894425	330104610	/nfs/dbraw/zinc/10/46/10/330104610.db2.gz	UHMVQLQSMGTJIY-UHFFFAOYSA-N	0	0	282.387	4.338	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(-c2ncco2)ccc1C	ZINC000274349606	330105512	/nfs/dbraw/zinc/10/55/12/330105512.db2.gz	OUIXATWZZQUEFA-ZDUSSCGKSA-N	0	0	284.359	4.191	20	30		CIEDRN
C=C(C)[C@@H](N[C@@H](C)c1cncs1)c1ccc(F)c(F)c1	ZINC000274758164	330107515	/nfs/dbraw/zinc/10/75/15/330107515.db2.gz	JLAONUNAUVYPGY-ZUZCIYMTSA-N	0	0	294.370	4.389	20	30		CIEDRN
C=C(C)[C@H](NCc1scnc1C)c1ccc(F)c(F)c1	ZINC000274778642	330107603	/nfs/dbraw/zinc/10/76/03/330107603.db2.gz	KBPDDIOWRAMFMA-HNNXBMFYSA-N	0	0	294.370	4.137	20	30		CIEDRN
C=CCC[C@@H]([NH2+]C[C@@H](CCO)c1ccccc1)c1ccco1	ZINC000276479313	330113248	/nfs/dbraw/zinc/11/32/48/330113248.db2.gz	RIKXHRSBUNQKLA-QZTJIDSGSA-N	0	0	299.414	4.043	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cnn(CCC(C)C)c1CC	ZINC000277662877	330116646	/nfs/dbraw/zinc/11/66/46/330116646.db2.gz	WRTQFABTKWIXJN-CQSZACIVSA-N	0	0	291.439	4.032	20	30		CIEDRN
C=CC[C@H]1N(C(=O)c2csc(Cl)n2)CCCC1(C)C	ZINC000278522973	330117249	/nfs/dbraw/zinc/11/72/49/330117249.db2.gz	SOWVMKLTLPXEMJ-LLVKDONJSA-N	0	0	298.839	4.003	20	30		CIEDRN
C=CCCO[C@@H](C)c1nc(-c2ccc(Cl)s2)no1	ZINC000277807527	330118316	/nfs/dbraw/zinc/11/83/16/330118316.db2.gz	BDXFBHWRAHKWKO-QMMMGPOBSA-N	0	0	284.768	4.105	20	30		CIEDRN
C=C(C)[C@@H](Cc1nc(-c2coc3ccccc32)no1)OCC	ZINC000277898974	330118654	/nfs/dbraw/zinc/11/86/54/330118654.db2.gz	LCTRDGMUQJLDLS-OAHLLOKOSA-N	0	0	298.342	4.007	20	30		CIEDRN
C=CCCCC(=O)Nc1c(C)c(F)ccc1Cl	ZINC000279214184	330122257	/nfs/dbraw/zinc/12/22/57/330122257.db2.gz	MVQQFZWNQNFWLF-UHFFFAOYSA-N	0	0	255.720	4.082	20	30		CIEDRN
C#CC[C@@H](NCc1ncc(C(C)(C)C)s1)c1ccccc1	ZINC000279213065	330122270	/nfs/dbraw/zinc/12/22/70/330122270.db2.gz	WIUZYOKWAYWVRF-OAHLLOKOSA-N	0	0	298.455	4.295	20	30		CIEDRN
CCC(C)(C)c1ccc(C(=O)N(CC#N)C2CCCC2)cc1	ZINC000510238745	332898055	/nfs/dbraw/zinc/89/80/55/332898055.db2.gz	ASGGPSPFAHLWOY-UHFFFAOYSA-N	0	0	298.430	4.283	20	30		CIEDRN
C[C@H](CNc1cccc(Cl)c1C#N)CC(F)(F)F	ZINC000396903150	330229247	/nfs/dbraw/zinc/22/92/47/330229247.db2.gz	ZXYAOAHTUPMRMT-QMMMGPOBSA-N	0	0	276.689	4.212	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(Cc2ccccc2Cl)no1	ZINC000527487522	330250501	/nfs/dbraw/zinc/25/05/01/330250501.db2.gz	MHYYFLWSPWFBKJ-OAHLLOKOSA-N	0	0	276.767	4.168	20	30		CIEDRN
N#CCC1CCN(c2ccc3c(Cl)cccc3n2)CC1	ZINC000527490733	330251254	/nfs/dbraw/zinc/25/12/54/330251254.db2.gz	GUOOVKPMIRZTRT-UHFFFAOYSA-N	0	0	285.778	4.018	20	30		CIEDRN
C[C@@H](C#N)c1ccc(-c2ccc3c(c2)CCOC3)cc1	ZINC000527589834	330264790	/nfs/dbraw/zinc/26/47/90/330264790.db2.gz	KGFRKYPSCQGRSX-ZDUSSCGKSA-N	0	0	263.340	4.053	20	30		CIEDRN
CCC(C#N)(CC)C(=O)N[C@H](C)c1cccc2ccccc21	ZINC000527689205	330271694	/nfs/dbraw/zinc/27/16/94/330271694.db2.gz	WKKIVAXRMNIWPH-CQSZACIVSA-N	0	0	294.398	4.347	20	30		CIEDRN
CCC(F)(F)C(C)(C)CNc1cccc(CC#N)c1	ZINC000527716219	330276521	/nfs/dbraw/zinc/27/65/21/330276521.db2.gz	JHJXSHOGHDCBBM-UHFFFAOYSA-N	0	0	266.335	4.236	20	30		CIEDRN
N#Cc1csc(CNc2cccc(C3CCOCC3)c2)c1	ZINC000527796564	330283907	/nfs/dbraw/zinc/28/39/07/330283907.db2.gz	IWIPTAQUESYRRL-UHFFFAOYSA-N	0	0	298.411	4.126	20	30		CIEDRN
CC1(C)CCc2cccc(NCc3ccc(C#N)s3)c2O1	ZINC000527814453	330284913	/nfs/dbraw/zinc/28/49/13/330284913.db2.gz	VOPYLWFJMBVSBR-UHFFFAOYSA-N	0	0	298.411	4.335	20	30		CIEDRN
CCN(C(=O)C[C@H]1CCC[C@H](C)C1)c1ccc(C#N)cc1	ZINC000510380257	332901594	/nfs/dbraw/zinc/90/15/94/332901594.db2.gz	RBZIUJUEQYRNDR-HOCLYGCPSA-N	0	0	284.403	4.128	20	30		CIEDRN
CCC(C#N)(CC)C(=O)Nc1cccc(-c2nccs2)c1	ZINC000528059863	330306491	/nfs/dbraw/zinc/30/64/91/330306491.db2.gz	WNGJISCTLIQKBR-UHFFFAOYSA-N	0	0	299.399	4.079	20	30		CIEDRN
N#Cc1ccc(Sc2ccc(C(F)(F)F)cn2)c(F)c1	ZINC000036886960	330311921	/nfs/dbraw/zinc/31/19/21/330311921.db2.gz	ZZWHJNDAYMIZHZ-UHFFFAOYSA-N	0	0	298.264	4.262	20	30		CIEDRN
C=C(C)CCc1noc(C2(C)CCC(F)(F)CC2)n1	ZINC000528194054	330312509	/nfs/dbraw/zinc/31/25/09/330312509.db2.gz	XVWIAORNGVQBNC-UHFFFAOYSA-N	0	0	270.323	4.045	20	30		CIEDRN
CCC(F)(F)C(C)(C)CNc1ccc(C#N)cc1	ZINC000528182039	330314141	/nfs/dbraw/zinc/31/41/41/330314141.db2.gz	IDSWCQXVACTENI-UHFFFAOYSA-N	0	0	252.308	4.042	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)c1sc2cccc(F)c2c1C	ZINC000116856132	330322848	/nfs/dbraw/zinc/32/28/48/330322848.db2.gz	VXLBMUYPXBBHLB-SECBINFHSA-N	0	0	277.364	4.043	20	30		CIEDRN
C=CC[C@H](C)NC(=O)C(C)(C)c1cccc(C(F)(F)F)c1	ZINC000116856993	330322857	/nfs/dbraw/zinc/32/28/57/330322857.db2.gz	GYHKTRCMICYTGK-NSHDSACASA-N	0	0	299.336	4.064	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)C(C)(C)c1cccc(C(F)(F)F)c1	ZINC000116856995	330322924	/nfs/dbraw/zinc/32/29/24/330322924.db2.gz	GYHKTRCMICYTGK-LLVKDONJSA-N	0	0	299.336	4.064	20	30		CIEDRN
CN(CC#Cc1ccc(F)cc1)Cc1ccc(Cl)s1	ZINC000532984896	330323193	/nfs/dbraw/zinc/32/31/93/330323193.db2.gz	WWKMUEFMICAWIT-UHFFFAOYSA-N	0	0	293.794	4.024	20	30		CIEDRN
CC(C)n1c2ccccc2nc1-c1ccc(C#N)cc1F	ZINC000532988647	330323353	/nfs/dbraw/zinc/32/33/53/330323353.db2.gz	JRCAWQQLZNHMAE-UHFFFAOYSA-N	0	0	279.318	4.295	20	30		CIEDRN
N#Cc1ccc2[nH]c(-c3cccc(C(F)(F)F)c3)nc2c1	ZINC000105668430	330329393	/nfs/dbraw/zinc/32/93/93/330329393.db2.gz	QZNBBVYCNUDOKX-UHFFFAOYSA-N	0	0	287.244	4.120	20	30		CIEDRN
C=C(C)CN[C@@H](c1ccc(OC(F)F)cc1)C(F)(F)F	ZINC000510421882	332903214	/nfs/dbraw/zinc/90/32/14/332903214.db2.gz	YYOGWUJKXOKZKU-NSHDSACASA-N	0	0	295.251	4.057	20	30		CIEDRN
CCC(C#N)(CC)C(=O)Nc1ccc(C(C)(C)C)cc1	ZINC000044764718	330332879	/nfs/dbraw/zinc/33/28/79/330332879.db2.gz	LAXXJOMQTKTMSP-UHFFFAOYSA-N	0	0	272.392	4.253	20	30		CIEDRN
C=C(C)C(C)(C)c1nc(-c2ccc3cc[nH]c3c2)no1	ZINC000424338925	330343871	/nfs/dbraw/zinc/34/38/71/330343871.db2.gz	PDEZRKJAVNJDQG-UHFFFAOYSA-N	0	0	267.332	4.072	20	30		CIEDRN
CCCN(Cc1ccc(C#N)cc1)C(=O)CC1CCCCC1	ZINC000045403698	330344379	/nfs/dbraw/zinc/34/43/79/330344379.db2.gz	MCYDBIPQOMJPNY-UHFFFAOYSA-N	0	0	298.430	4.267	20	30		CIEDRN
C=C(C)C(C)(C)c1nc([C@H]2CCc3ccccc32)no1	ZINC000424344678	330344561	/nfs/dbraw/zinc/34/45/61/330344561.db2.gz	CZOZRLOPKOSYRS-AWEZNQCLSA-N	0	0	268.360	4.001	20	30		CIEDRN
C=CCC1(c2nc([C@@H](C)c3nccs3)no2)CCCC1	ZINC000424350103	330345242	/nfs/dbraw/zinc/34/52/42/330345242.db2.gz	ADJPINCSBPVDLN-LLVKDONJSA-N	0	0	289.404	4.066	20	30		CIEDRN
C=C(C)C(C)(C)c1nc([C@H](C)Oc2ccccc2)no1	ZINC000424352787	330345660	/nfs/dbraw/zinc/34/56/60/330345660.db2.gz	ZGODSQOOZLMTEF-LBPRGKRZSA-N	0	0	272.348	4.063	20	30		CIEDRN
C=C[C@@H]1OCCC[C@H]1c1nc([C@@H]2CCCC[C@H]2CC)no1	ZINC000424356422	330346437	/nfs/dbraw/zinc/34/64/37/330346437.db2.gz	BKNKPIQLMNMTST-TUVASFSCSA-N	0	0	290.407	4.202	20	30		CIEDRN
C=C(C)C(C)(C)c1nc([C@@H]2C[C@H]2c2ccccc2)no1	ZINC000424357095	330346538	/nfs/dbraw/zinc/34/65/38/330346538.db2.gz	DGCDEBDKLFHJON-UONOGXRCSA-N	0	0	268.360	4.194	20	30		CIEDRN
C=C(C)C(C)(C)c1nc(C2(c3ccccc3OC)CC2)no1	ZINC000424361019	330346927	/nfs/dbraw/zinc/34/69/27/330346927.db2.gz	KXFQGBJCPFATSU-UHFFFAOYSA-N	0	0	298.386	4.012	20	30		CIEDRN
C=C(C)C(C)(C)c1nc(C2(c3ccc(F)cc3)CC2)no1	ZINC000424365631	330347784	/nfs/dbraw/zinc/34/77/84/330347784.db2.gz	VBOJGGITTIOGGG-UHFFFAOYSA-N	0	0	286.350	4.142	20	30		CIEDRN
N#Cc1ccc2[nH]c(-c3cc(Cl)cc(Cl)c3)nc2c1	ZINC000108137173	330352160	/nfs/dbraw/zinc/35/21/60/330352160.db2.gz	HWJQWVXGSDQFJE-UHFFFAOYSA-N	0	0	288.137	4.408	20	30		CIEDRN
CCCC[C@@H](CC)C(=O)N[C@](C)(C#N)C1CCCCC1	ZINC000580499474	330354920	/nfs/dbraw/zinc/35/49/20/330354920.db2.gz	ONINQRRFMLDCNV-RHSMWYFYSA-N	0	0	278.440	4.182	20	30		CIEDRN
C=C(CC)CSCC(=O)Nc1cccc(SC)c1	ZINC000536880494	330358118	/nfs/dbraw/zinc/35/81/18/330358118.db2.gz	BZWRFBDUMLQPKH-UHFFFAOYSA-N	0	0	281.446	4.046	20	30		CIEDRN
C=C(CC)CSCCC(=O)Nc1cccc(F)c1C	ZINC000536882764	330360876	/nfs/dbraw/zinc/36/08/76/330360876.db2.gz	ZFYHCCPDKLOZRO-UHFFFAOYSA-N	0	0	281.396	4.162	20	30		CIEDRN
C=C(CC)CSc1nnc(CCCc2ccccc2)o1	ZINC000536899615	330364468	/nfs/dbraw/zinc/36/44/68/330364468.db2.gz	FAHYGHCRISJGHS-UHFFFAOYSA-N	0	0	288.416	4.303	20	30		CIEDRN
C=C(CC)CN(Cc1cccs1)CC(F)(F)F	ZINC000536927676	330365408	/nfs/dbraw/zinc/36/54/08/330365408.db2.gz	WZXHRXWTMBSDDH-UHFFFAOYSA-N	0	0	263.328	4.079	20	30		CIEDRN
C=CCCCSc1nnc(-c2cccs2)n1C1CC1	ZINC000117549096	330365888	/nfs/dbraw/zinc/36/58/88/330365888.db2.gz	PQPYBKMCOMGDSX-UHFFFAOYSA-N	0	0	291.445	4.400	20	30		CIEDRN
C=CCCCSc1nnc(Cc2ccccc2)n1CC=C	ZINC000117551067	330365984	/nfs/dbraw/zinc/36/59/84/330365984.db2.gz	XEFDUUSAJLSVIO-UHFFFAOYSA-N	0	0	299.443	4.113	20	30		CIEDRN
COc1c(Cl)cccc1N[C@@H](C)c1ccc(C#N)cc1	ZINC000118443212	330367219	/nfs/dbraw/zinc/36/72/19/330367219.db2.gz	AIENUHXVHAHJMI-NSHDSACASA-N	0	0	286.762	4.393	20	30		CIEDRN
CCCC[C@H](NC(=O)Nc1ccc(CC#N)cc1)C1CCC1	ZINC000119028759	330368958	/nfs/dbraw/zinc/36/89/58/330368958.db2.gz	RWMKXXWMQREXLP-KRWDZBQOSA-N	0	0	299.418	4.233	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@@H](C)c1ccc(Cl)cc1	ZINC000424547779	330373752	/nfs/dbraw/zinc/37/37/52/330373752.db2.gz	SPSFEXGOJVLIFL-NSHDSACASA-N	0	0	265.784	4.120	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)NCc1c(OC)ccc2ccccc21	ZINC000424558813	330375803	/nfs/dbraw/zinc/37/58/03/330375803.db2.gz	GAOFIWCUBRPLBH-UHFFFAOYSA-N	0	0	297.398	4.067	20	30		CIEDRN
Cc1cc(C(=O)N[C@H](C)c2ccc(C#N)cc2)ccc1Cl	ZINC000119622546	330377634	/nfs/dbraw/zinc/37/76/34/330377634.db2.gz	VOFKPUUNGRPZHI-GFCCVEGCSA-N	0	0	298.773	4.011	20	30		CIEDRN
C[C@H](c1ccc(Cl)c(Cl)c1)N1CCC(C#N)CC1	ZINC000057872721	330379182	/nfs/dbraw/zinc/37/91/82/330379182.db2.gz	KHYZLZGEPPZCGW-SNVBAGLBSA-N	0	0	283.202	4.290	20	30		CIEDRN
CCc1nc2cc(N[C@@H](C)c3ccc(C#N)cc3)ccc2o1	ZINC000119854717	330380504	/nfs/dbraw/zinc/38/05/04/330380504.db2.gz	AMILWOZFYJFTAY-LBPRGKRZSA-N	0	0	291.354	4.435	20	30		CIEDRN
CCc1nc2cc(N[C@H](C)c3ccc(C#N)cc3)ccc2o1	ZINC000119854858	330380513	/nfs/dbraw/zinc/38/05/13/330380513.db2.gz	AMILWOZFYJFTAY-GFCCVEGCSA-N	0	0	291.354	4.435	20	30		CIEDRN
C=CCN(Cc1cccs1)Cc1cnc(C2CC2)s1	ZINC000119946475	330381823	/nfs/dbraw/zinc/38/18/23/330381823.db2.gz	VMWGLXHFBUQOPJ-UHFFFAOYSA-N	0	0	290.457	4.270	20	30		CIEDRN
C[C@H](C#N)Sc1ccc(Cl)c(C(F)(F)F)c1	ZINC000058033679	330384065	/nfs/dbraw/zinc/38/40/65/330384065.db2.gz	MYAYKXIOQMBZKK-ZCFIWIBFSA-N	0	0	265.687	4.363	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@@H](C)c1ccccc1OC(F)F	ZINC000424575243	330385016	/nfs/dbraw/zinc/38/50/16/330385016.db2.gz	KUYCAXXOLIVMBS-NSHDSACASA-N	0	0	297.345	4.068	20	30		CIEDRN
N#CC1(CCCNc2ccccc2C(F)F)CCOCC1	ZINC000424573104	330385430	/nfs/dbraw/zinc/38/54/30/330385430.db2.gz	SBXLGSADAZXFCV-UHFFFAOYSA-N	0	0	294.345	4.137	20	30		CIEDRN
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000424579435	330385628	/nfs/dbraw/zinc/38/56/28/330385628.db2.gz	UZOFWBRLRIBXTQ-CZUORRHYSA-N	0	0	284.403	4.253	20	30		CIEDRN
C=CCN(CC=C)Cc1nc2cc(C(F)(F)F)ccc2o1	ZINC000120992395	330394320	/nfs/dbraw/zinc/39/43/20/330394320.db2.gz	GRZYKFMCRYUHPR-UHFFFAOYSA-N	0	0	296.292	4.021	20	30		CIEDRN
CN(C(=O)c1csc2ccccc12)c1cccc(C#N)c1	ZINC000059095706	330396052	/nfs/dbraw/zinc/39/60/52/330396052.db2.gz	ZPDJZNAMTKCCCE-UHFFFAOYSA-N	0	0	292.363	4.050	20	30		CIEDRN
C[C@H]1CCN(C)c2ccccc2N1CCCC(C)(C)C#N	ZINC000121496768	330402213	/nfs/dbraw/zinc/40/22/13/330402213.db2.gz	OXRIXVPOKYKJRX-HNNXBMFYSA-N	0	0	285.435	4.051	20	30		CIEDRN
C=C(C)CS[C@H](C)c1nc(-c2cccs2)no1	ZINC000121842475	330406913	/nfs/dbraw/zinc/40/69/13/330406913.db2.gz	QFNBKLCRHNOGDS-SECBINFHSA-N	0	0	266.391	4.168	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(Cc1ccccc1)C(C)C	ZINC000122076897	330411503	/nfs/dbraw/zinc/41/15/03/330411503.db2.gz	VKOMAGWCVBGMLN-UHFFFAOYSA-N	0	0	271.404	4.192	20	30		CIEDRN
C=CCCCN(C)C(=O)[C@H](C)CCCc1ccccc1	ZINC000537199407	330414634	/nfs/dbraw/zinc/41/46/34/330414634.db2.gz	PGNDMRBJJDWMOU-MRXNPFEDSA-N	0	0	273.420	4.070	20	30		CIEDRN
CCSCC[C@@H](C)Nc1cc(C#N)c2ccccc2n1	ZINC000122789986	330428558	/nfs/dbraw/zinc/42/85/58/330428558.db2.gz	MPFHMRPHCHTFNT-GFCCVEGCSA-N	0	0	285.416	4.050	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1	ZINC000537229196	330429546	/nfs/dbraw/zinc/42/95/46/330429546.db2.gz	GFODUQNBHTWTCG-YNEHKIRRSA-N	0	0	291.357	4.216	20	30		CIEDRN
C=CCCOCCCCC(=O)Nc1cccc(C)c1Cl	ZINC000537314157	330432355	/nfs/dbraw/zinc/43/23/55/330432355.db2.gz	JTJOHSGDDZATPF-UHFFFAOYSA-N	0	0	295.810	4.350	20	30		CIEDRN
C[C@@H]1CCN(CCC(C)(C)C#N)c2ccccc2S1	ZINC000537383765	330435452	/nfs/dbraw/zinc/43/54/52/330435452.db2.gz	AZSNQUCZWLVDCQ-CYBMUJFWSA-N	0	0	274.433	4.317	20	30		CIEDRN
CC(C)[C@@H](Nc1cccc(OCCCC#N)c1)C1CC1	ZINC000537427251	330436664	/nfs/dbraw/zinc/43/66/64/330436664.db2.gz	SAYHFWBXVOCDTF-QGZVFWFLSA-N	0	0	272.392	4.216	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H](c2ccccc2)CC1	ZINC000424638150	330437786	/nfs/dbraw/zinc/43/77/86/330437786.db2.gz	JUIWOAZHMRGIFD-QGZVFWFLSA-N	0	0	285.431	4.385	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@@H](C)c1ccc(F)cc1Cl	ZINC000424690752	330446437	/nfs/dbraw/zinc/44/64/37/330446437.db2.gz	YLHGRNMYXBEVEU-JTQLQIEISA-N	0	0	283.774	4.259	20	30		CIEDRN
C=CCCCCCN(C)C(=O)C[C@H]1CCO[C@@H](C(C)C)C1	ZINC000514185701	330460385	/nfs/dbraw/zinc/46/03/85/330460385.db2.gz	KGWKXOZMFMYAAX-DLBZAZTESA-N	0	0	295.467	4.033	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)c1ccc(-c2ccc(C)o2)s1	ZINC000514203723	330461599	/nfs/dbraw/zinc/46/15/99/330461599.db2.gz	LHFSKMZSEDUZDQ-SNVBAGLBSA-N	0	0	275.373	4.011	20	30		CIEDRN
C=CCCCNC(=O)N[C@@H](c1ccccc1)C(C)(C)C	ZINC000515009055	330469539	/nfs/dbraw/zinc/46/95/39/330469539.db2.gz	KNWZOKGVKIYGAR-HNNXBMFYSA-N	0	0	274.408	4.039	20	30		CIEDRN
C[C@H]1CC(Nc2nc(C(F)(F)F)ccc2C#N)C[C@H](C)C1	ZINC000084439161	330485819	/nfs/dbraw/zinc/48/58/19/330485819.db2.gz	BKIMGHCFLFEOBH-NXEZZACHSA-N	0	0	297.324	4.209	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N1CC=C(c2cccc(C)c2)CC1	ZINC000424772523	330486015	/nfs/dbraw/zinc/48/60/15/330486015.db2.gz	XCLXVRLGXFBPIQ-UHFFFAOYSA-N	0	0	283.415	4.213	20	30		CIEDRN
N#CCC1CCN(Cc2csc(Cl)c2Cl)CC1	ZINC000516235397	330489970	/nfs/dbraw/zinc/48/99/70/330489970.db2.gz	SGFCJKCEZXUKLC-UHFFFAOYSA-N	0	0	289.231	4.181	20	30		CIEDRN
C=C(C)CNC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000429216882	330540239	/nfs/dbraw/zinc/54/02/39/330540239.db2.gz	ULOPYKGKJQIARK-UHFFFAOYSA-N	0	0	282.343	4.177	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)N1CCC(C)(C(C)C)CC1	ZINC000429319141	330543805	/nfs/dbraw/zinc/54/38/05/330543805.db2.gz	QOLQSBMXKYHWKQ-UHFFFAOYSA-N	0	0	299.418	4.157	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H]1CCc2cc(Cl)ccc21	ZINC000429901657	330556147	/nfs/dbraw/zinc/55/61/47/330556147.db2.gz	VENUHBLGHKULHE-CQSZACIVSA-N	0	0	277.795	4.046	20	30		CIEDRN
C=CCn1c(S[C@@H](C)C(C)C)nnc1-c1ccccc1	ZINC000430086682	330559154	/nfs/dbraw/zinc/55/91/54/330559154.db2.gz	FCDKPDJNCWVNHG-ZDUSSCGKSA-N	0	0	287.432	4.268	20	30		CIEDRN
C=CCC[C@@H](NC(=O)N1CCC(C)=C(C)C1)c1ccccc1	ZINC000430903700	330576679	/nfs/dbraw/zinc/57/66/79/330576679.db2.gz	KPWWMRHJIDRFJZ-GOSISDBHSA-N	0	0	298.430	4.446	20	30		CIEDRN
C=CCCCS[C@H](C)c1cc(C(=O)OC)c(C)o1	ZINC000431076186	330578515	/nfs/dbraw/zinc/57/85/15/330578515.db2.gz	DDOQEHCDTCNWKE-LLVKDONJSA-N	0	0	268.378	4.135	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000431305084	330583243	/nfs/dbraw/zinc/58/32/43/330583243.db2.gz	LSLZIBPROZPXPY-DLBZAZTESA-N	0	0	299.418	4.075	20	30		CIEDRN
N#Cc1c(F)cccc1N[C@H]1C[C@H](c2ccc(F)cc2)C1	ZINC000431493346	330585612	/nfs/dbraw/zinc/58/56/12/330585612.db2.gz	BFIKEXDCABFYSC-MQMHXKEQSA-N	0	0	284.309	4.195	20	30		CIEDRN
N#CCCC[C@@H](Nc1ccccc1[N+](=O)[O-])c1ccccc1	ZINC000431509172	330586039	/nfs/dbraw/zinc/58/60/39/330586039.db2.gz	BTRLIFZIIYWGIC-OAHLLOKOSA-N	0	0	295.342	4.442	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)N(C)CCC1CCCCC1	ZINC000431705052	330588091	/nfs/dbraw/zinc/58/80/91/330588091.db2.gz	NKSJWAOXKHXCRC-UHFFFAOYSA-N	0	0	299.418	4.301	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)N1CCC[C@@H]1CCC(C)C	ZINC000431711102	330588226	/nfs/dbraw/zinc/58/82/26/330588226.db2.gz	WKXFZDHAYZRTKN-MRXNPFEDSA-N	0	0	299.418	4.299	20	30		CIEDRN
C=CCC(C)(C)CNc1ncc(C(F)(F)F)s1	ZINC000432164659	330594314	/nfs/dbraw/zinc/59/43/14/330594314.db2.gz	CMBQCEMVZMHRFI-UHFFFAOYSA-N	0	0	264.316	4.176	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)N(C)[C@@H](C)c1ccc(F)cc1	ZINC000432552966	330600482	/nfs/dbraw/zinc/60/04/82/330600482.db2.gz	GYTVVQRGPTZKSY-ZDUSSCGKSA-N	0	0	292.398	4.130	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Nc1cc(C)cc(F)c1	ZINC000432733425	330604552	/nfs/dbraw/zinc/60/45/52/330604552.db2.gz	DXVTXVJFHTWWOR-UHFFFAOYSA-N	0	0	278.371	4.344	20	30		CIEDRN
Cc1ccc(-c2csc(CN(C)CC(C)(C)C#N)n2)cc1	ZINC000433296249	330623168	/nfs/dbraw/zinc/62/31/68/330623168.db2.gz	RSCIOOTVFPTXMA-UHFFFAOYSA-N	0	0	299.443	4.100	20	30		CIEDRN
C=CCN(CC(F)(F)F)C(=O)[C@@H](C)CC1CCCCC1	ZINC000510469126	332904827	/nfs/dbraw/zinc/90/48/27/332904827.db2.gz	BXWALFQFZVEZCJ-LBPRGKRZSA-N	0	0	291.357	4.170	20	30		CIEDRN
CC1(C)CCCN(C(=O)c2cc3ccccc3s2)[C@@H]1C#N	ZINC000434019793	330634246	/nfs/dbraw/zinc/63/42/46/330634246.db2.gz	BJFFRXMYSUKHKV-OAHLLOKOSA-N	0	0	298.411	4.056	20	30		CIEDRN
CC1(C)CCCN(C(=O)c2ccc3sccc3c2)[C@H]1C#N	ZINC000434036910	330634763	/nfs/dbraw/zinc/63/47/63/330634763.db2.gz	NXNYFNDATNRZIH-HNNXBMFYSA-N	0	0	298.411	4.056	20	30		CIEDRN
C=C(C)CNC(=O)c1ccccc1SCC=C(C)C	ZINC000153036248	330638696	/nfs/dbraw/zinc/63/86/96/330638696.db2.gz	FFGRXGRCGKVJLV-UHFFFAOYSA-N	0	0	275.417	4.051	20	30		CIEDRN
N#Cc1cccc(SCC(=O)c2c[nH]c3ccccc23)c1	ZINC000435039033	330648469	/nfs/dbraw/zinc/64/84/69/330648469.db2.gz	ZLOMDCAKCQTITF-UHFFFAOYSA-N	0	0	292.363	4.015	20	30		CIEDRN
C=CCC[C@@H](NC(=O)[C@H]1[C@@H]2CCCC[C@@H]21)c1ccccc1	ZINC000435296881	330652621	/nfs/dbraw/zinc/65/26/21/330652621.db2.gz	GOQXEYSFRQWEFJ-XDNAFOTISA-N	0	0	283.415	4.246	20	30		CIEDRN
CCCCc1ccc(NC(=O)c2cc(C#N)oc2C)cc1	ZINC000435396164	330653941	/nfs/dbraw/zinc/65/39/41/330653941.db2.gz	URLXHFPBFBHSJB-UHFFFAOYSA-N	0	0	282.343	4.055	20	30		CIEDRN
C=CCC[C@@H](NC(=O)N1[C@H](C)CC[C@@H]1C)c1ccccc1	ZINC000435761025	330662336	/nfs/dbraw/zinc/66/23/36/330662336.db2.gz	LWJDLHQAJOIWGF-HLLBOEOZSA-N	0	0	286.419	4.276	20	30		CIEDRN
CC#CCSCc1nc(-c2ccccc2)cs1	ZINC000435898020	330664825	/nfs/dbraw/zinc/66/48/25/330664825.db2.gz	MXZRJBJEHZLTFG-UHFFFAOYSA-N	0	0	259.399	4.067	20	30		CIEDRN
CC[C@H](C#N)Sc1nc2c(n1-c1ccccc1)CCCC2	ZINC000436040339	330667813	/nfs/dbraw/zinc/66/78/13/330667813.db2.gz	JRUVKKSVXGFQGI-CQSZACIVSA-N	0	0	297.427	4.145	20	30		CIEDRN
CC1=C(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)CCC1	ZINC000437047336	330691902	/nfs/dbraw/zinc/69/19/02/330691902.db2.gz	VPLCBQBCDRDBKW-UHFFFAOYSA-N	0	0	294.276	4.016	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1C[C@H]1c1ccc(Cl)c(F)c1	ZINC000437373936	330698563	/nfs/dbraw/zinc/69/85/63/330698563.db2.gz	PGBYZIFMEWYXSK-IFUGULHKSA-N	0	0	295.785	4.054	20	30		CIEDRN
Cc1ccc(C#N)cc1NCc1cc2c(cccc2F)[nH]1	ZINC000437806527	330709198	/nfs/dbraw/zinc/70/91/98/330709198.db2.gz	YOZCQXZTGVHZLO-UHFFFAOYSA-N	0	0	279.318	4.099	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1ccc2ccn(CCC)c2c1	ZINC000438291151	330720926	/nfs/dbraw/zinc/72/09/26/330720926.db2.gz	FKYAJQRGOCSOBG-UHFFFAOYSA-N	0	0	299.418	4.481	20	30		CIEDRN
COCCCCCSCc1ccc(C#N)cc1Cl	ZINC000438877007	330730461	/nfs/dbraw/zinc/73/04/61/330730461.db2.gz	SCASDUSGWMMUOR-UHFFFAOYSA-N	0	0	283.824	4.262	20	30		CIEDRN
Cc1nc(N[C@@H](CCC#N)c2ccccc2)sc1C	ZINC000439088818	330733599	/nfs/dbraw/zinc/73/35/99/330733599.db2.gz	IOKPGBFRAROLPV-AWEZNQCLSA-N	0	0	271.389	4.217	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N(C)c1ccc(Cl)cc1F	ZINC000439182936	330735162	/nfs/dbraw/zinc/73/51/62/330735162.db2.gz	XCAUDERCFBGIPA-CQSZACIVSA-N	0	0	269.747	4.044	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1c(C)c(C)ccc1Cl	ZINC000439409792	330737978	/nfs/dbraw/zinc/73/79/78/330737978.db2.gz	NHHPCIGAGQDQGI-LBPRGKRZSA-N	0	0	280.799	4.433	20	30		CIEDRN
Cc1ccc(NCc2ccc(C#N)cc2OC(F)F)cc1	ZINC000439558913	330740491	/nfs/dbraw/zinc/74/04/91/330740491.db2.gz	ZAZKOLOVZMQELS-UHFFFAOYSA-N	0	0	288.297	4.080	20	30		CIEDRN
N#Cc1ccc(NC[C@@H]2CCC[C@@H](C(F)(F)F)C2)cc1	ZINC000439597248	330740939	/nfs/dbraw/zinc/74/09/39/330740939.db2.gz	NNTIZAWQXVJUPT-CHWSQXEVSA-N	0	0	282.309	4.339	20	30		CIEDRN
Cc1sc(NC(=O)C(C)(C)CC(C)C)c(C#N)c1C	ZINC000439782237	330743066	/nfs/dbraw/zinc/74/30/66/330743066.db2.gz	LQTRGKGUSVDTID-UHFFFAOYSA-N	0	0	278.421	4.247	20	30		CIEDRN
CN(C(=O)CCCC1CCCCC1)c1ccc(C#N)cc1	ZINC000440057145	330745920	/nfs/dbraw/zinc/74/59/20/330745920.db2.gz	ZHLSFJGVJILSLS-UHFFFAOYSA-N	0	0	284.403	4.272	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@H]1CCCCC1(F)F	ZINC000448633119	330745992	/nfs/dbraw/zinc/74/59/92/330745992.db2.gz	DFFRXGYJJWZSJL-CYBMUJFWSA-N	0	0	299.386	4.088	20	30		CIEDRN
C=C(C)CN(CC)C(=O)C(CC)(CC)c1ccccc1	ZINC000440368981	330747858	/nfs/dbraw/zinc/74/78/58/330747858.db2.gz	UIZZZQDIVVMOGZ-UHFFFAOYSA-N	0	0	273.420	4.169	20	30		CIEDRN
CCc1c(C)sc(NC(=O)C2(CC(C)C)CC2)c1C#N	ZINC000440475513	330748988	/nfs/dbraw/zinc/74/89/88/330748988.db2.gz	FOKXGOBQDTUADJ-UHFFFAOYSA-N	0	0	290.432	4.255	20	30		CIEDRN
C[C@@H](SCCC(=O)OC(C)(C)C)c1cccc(C#N)c1	ZINC000440585144	330751296	/nfs/dbraw/zinc/75/12/96/330751296.db2.gz	QLXROJGZZHJXIE-GFCCVEGCSA-N	0	0	291.416	4.084	20	30		CIEDRN
CC#CCCCC(=O)N(CC)c1ccc(Cl)c(F)c1	ZINC000441419079	330768185	/nfs/dbraw/zinc/76/81/85/330768185.db2.gz	JGDKAJUMNXOFPL-UHFFFAOYSA-N	0	0	281.758	4.026	20	30		CIEDRN
N#Cc1cccnc1Nc1cccc(CCC(F)(F)F)c1	ZINC000441804272	330772418	/nfs/dbraw/zinc/77/24/18/330772418.db2.gz	VDROKXDAMJBFLZ-UHFFFAOYSA-N	0	0	291.276	4.192	20	30		CIEDRN
CCCN(Cc1ccc(C#N)cc1)C(=O)[C@@H]1CCC[C@@H]1CC	ZINC000448665460	330774617	/nfs/dbraw/zinc/77/46/17/330774617.db2.gz	MJZKYHPJHWQYSL-ZWKOTPCHSA-N	0	0	298.430	4.123	20	30		CIEDRN
CCCN(Cc1ccc(C#N)cc1)C(=O)[C@H]1CCC[C@@H]1CC	ZINC000448665458	330774618	/nfs/dbraw/zinc/77/46/18/330774618.db2.gz	MJZKYHPJHWQYSL-ROUUACIJSA-N	0	0	298.430	4.123	20	30		CIEDRN
CCCN(Cc1ccc(C#N)cc1)C(=O)[C@@H]1CCC[C@H]1CC	ZINC000448665456	330774683	/nfs/dbraw/zinc/77/46/83/330774683.db2.gz	MJZKYHPJHWQYSL-QZTJIDSGSA-N	0	0	298.430	4.123	20	30		CIEDRN
Cc1cc(N[C@H]2CC[C@H](C#N)C2)ccc1C(F)(F)F	ZINC000442802911	330784713	/nfs/dbraw/zinc/78/47/13/330784713.db2.gz	UDXWTKCBRZWRDY-JQWIXIFHSA-N	0	0	268.282	4.118	20	30		CIEDRN
Cc1cc(C)c(N[C@H]2CC[C@@H](C#N)C2)cc1Br	ZINC000442837907	330786099	/nfs/dbraw/zinc/78/60/99/330786099.db2.gz	REJUIQUZAOCPDD-NEPJUHHUSA-N	0	0	293.208	4.170	20	30		CIEDRN
CCC(C)(C)c1ccc(N[C@@H]2CC[C@@H](C#N)C2)cc1	ZINC000442851792	330786955	/nfs/dbraw/zinc/78/69/55/330786955.db2.gz	GPPFAIWMZHVRRF-CZUORRHYSA-N	0	0	256.393	4.478	20	30		CIEDRN
Cc1ccc(NC(=O)C(C)(C)C)cc1N[C@H]1CC[C@H](C#N)C1	ZINC000442851350	330787003	/nfs/dbraw/zinc/78/70/03/330787003.db2.gz	FXZGHASYLSUQNP-KBPBESRZSA-N	0	0	299.418	4.084	20	30		CIEDRN
N#C[C@H]1CC[C@@H](Nc2cccc(COCc3ccco3)c2)C1	ZINC000442853920	330787170	/nfs/dbraw/zinc/78/71/70/330787170.db2.gz	NMPAWSGNRPVASA-WMLDXEAASA-N	0	0	296.370	4.101	20	30		CIEDRN
N#C[C@@H]1CC[C@@H](Nc2cccc(COCc3ccco3)c2)C1	ZINC000442853919	330787188	/nfs/dbraw/zinc/78/71/88/330787188.db2.gz	NMPAWSGNRPVASA-RHSMWYFYSA-N	0	0	296.370	4.101	20	30		CIEDRN
CC1CCN(c2cccc(N[C@H]3CC[C@@H](C#N)C3)c2)CC1	ZINC000442855820	330787407	/nfs/dbraw/zinc/78/74/07/330787407.db2.gz	KQUHUFFTXOUINK-WBVHZDCISA-N	0	0	283.419	4.027	20	30		CIEDRN
Cc1c(COC(C)(C)C)cccc1N[C@@H]1CC[C@@H](C#N)C1	ZINC000442864793	330788249	/nfs/dbraw/zinc/78/82/49/330788249.db2.gz	GXPJLYPSUCNGTJ-GDBMZVCRSA-N	0	0	286.419	4.414	20	30		CIEDRN
C[C@@H](c1cccc(C#N)c1)N1CC2(CC2)c2ccccc21	ZINC000442883364	330790508	/nfs/dbraw/zinc/79/05/08/330790508.db2.gz	UZKJTTNJYVSYTB-AWEZNQCLSA-N	0	0	274.367	4.171	20	30		CIEDRN
CCc1ccc(NCc2ccc(F)c(C#N)c2)cc1F	ZINC000443460937	330799951	/nfs/dbraw/zinc/79/99/51/330799951.db2.gz	BPVOPLLXEHQTQW-UHFFFAOYSA-N	0	0	272.298	4.011	20	30		CIEDRN
C=CCC(CC=C)c1nc(-c2ncccc2SC)no1	ZINC000445610630	330832888	/nfs/dbraw/zinc/83/28/88/330832888.db2.gz	PRYQYKROSFSVPK-UHFFFAOYSA-N	0	0	287.388	4.089	20	30		CIEDRN
C=CCC(CC=C)c1nc(-c2cscc2C)no1	ZINC000445636164	330833566	/nfs/dbraw/zinc/83/35/66/330833566.db2.gz	KMWIPKWYPHHONR-UHFFFAOYSA-N	0	0	260.362	4.342	20	30		CIEDRN
N#Cc1ccccc1NCc1cc(F)cc(C(F)(F)F)c1	ZINC000159189533	330844659	/nfs/dbraw/zinc/84/46/59/330844659.db2.gz	UKHNQTCRFQINDT-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
Cc1cc(CNc2ccc(Cl)c(C#N)c2)ccc1C#N	ZINC000446905187	330857612	/nfs/dbraw/zinc/85/76/12/330857612.db2.gz	RBTWWECASZMQKU-UHFFFAOYSA-N	0	0	281.746	4.004	20	30		CIEDRN
CC(=O)c1ccc(NCC#Cc2ccccc2Cl)cc1	ZINC000446992539	330859500	/nfs/dbraw/zinc/85/95/00/330859500.db2.gz	WCGQEJHEWWTTGF-UHFFFAOYSA-N	0	0	283.758	4.006	20	30		CIEDRN
Cc1cc(CSc2ccc(C#N)cc2)ccc1C#N	ZINC000447284219	330863431	/nfs/dbraw/zinc/86/34/31/330863431.db2.gz	DLKJMNPNHVJSBK-UHFFFAOYSA-N	0	0	264.353	4.031	20	30		CIEDRN
C=CCCCN(C)C(=O)N[C@H](CCC=C)c1ccccc1	ZINC000160401933	330864901	/nfs/dbraw/zinc/86/49/01/330864901.db2.gz	RLCSTNBVPBGCRG-QGZVFWFLSA-N	0	0	286.419	4.302	20	30		CIEDRN
C=CCC[C@@H](NC(=O)N(C)CC1CCC1)c1ccccc1	ZINC000160420665	330865106	/nfs/dbraw/zinc/86/51/06/330865106.db2.gz	PLZJUEGMOBALIV-QGZVFWFLSA-N	0	0	286.419	4.135	20	30		CIEDRN
CC[C@@H](Nc1ccc(F)cc1OC)c1ccc(C#N)cc1	ZINC000447587675	330871931	/nfs/dbraw/zinc/87/19/31/330871931.db2.gz	RSIOPECAUICYQM-OAHLLOKOSA-N	0	0	284.334	4.269	20	30		CIEDRN
CC[C@@H](Nc1cnn([C@@H](C)C2CC2)c1)c1ccc(C#N)cc1	ZINC000447597766	330872728	/nfs/dbraw/zinc/87/27/28/330872728.db2.gz	GTUZKPKZBFEOJL-SCLBCKFNSA-N	0	0	294.402	4.289	20	30		CIEDRN
CC(C)(C)Oc1cc(F)ccc1N[C@@H]1CCC[C@@H](C#N)C1	ZINC000447598351	330872988	/nfs/dbraw/zinc/87/29/88/330872988.db2.gz	HSTUHBOFZIZRNQ-TZMCWYRMSA-N	0	0	290.382	4.497	20	30		CIEDRN
CC(C)(C)Oc1cc(F)ccc1N[C@H]1CCC[C@@H](C#N)C1	ZINC000447598350	330873019	/nfs/dbraw/zinc/87/30/19/330873019.db2.gz	HSTUHBOFZIZRNQ-OCCSQVGLSA-N	0	0	290.382	4.497	20	30		CIEDRN
CC(C)(C)c1cnc(CNc2ccc(F)c(C#N)c2)s1	ZINC000447948461	330880943	/nfs/dbraw/zinc/88/09/43/330880943.db2.gz	OJUPDURCRZGOSJ-UHFFFAOYSA-N	0	0	289.379	4.063	20	30		CIEDRN
C=CCCCNC(=O)Nc1ccc(OCCCC)cc1C	ZINC000448009115	330882753	/nfs/dbraw/zinc/88/27/53/330882753.db2.gz	BDTUWAJLKLFRIN-UHFFFAOYSA-N	0	0	290.407	4.262	20	30		CIEDRN
CC[C@@H]1C[C@H]1C(=O)Nc1ccccc1S[C@H](C)CC#N	ZINC000448943706	330889157	/nfs/dbraw/zinc/88/91/57/330889157.db2.gz	PBHXRRIFUYNQIM-JHJVBQTASA-N	0	0	288.416	4.065	20	30		CIEDRN
C=C1CCN(Cc2cnc(CCc3ccccc3)s2)CC1	ZINC000449021681	330892573	/nfs/dbraw/zinc/89/25/73/330892573.db2.gz	DFVAECXSEIKUND-UHFFFAOYSA-N	0	0	298.455	4.080	20	30		CIEDRN
CC(C)OCc1cccc(NC2CCC(C)(C#N)CC2)c1	ZINC000449039339	330894414	/nfs/dbraw/zinc/89/44/14/330894414.db2.gz	BMAMNPOKHYVBKA-UHFFFAOYSA-N	0	0	286.419	4.496	20	30		CIEDRN
CC(C)C(=O)Nc1ccc(NC2CCC(C)(C#N)CC2)cc1	ZINC000449040126	330894586	/nfs/dbraw/zinc/89/45/86/330894586.db2.gz	GOOUJPHGKPXMSH-UHFFFAOYSA-N	0	0	299.418	4.165	20	30		CIEDRN
CCOCc1ccc(NC2CCC(C)(C#N)CC2)cc1	ZINC000449040460	330894639	/nfs/dbraw/zinc/89/46/39/330894639.db2.gz	HYWCLNCABVTQDJ-UHFFFAOYSA-N	0	0	272.392	4.107	20	30		CIEDRN
C[C@@H]1CCCN(C(=O)Nc2ccc(C(C)(C)C#N)cc2)CC1	ZINC000194602986	330912507	/nfs/dbraw/zinc/91/25/07/330912507.db2.gz	OEFJGOIWBXWBNV-CQSZACIVSA-N	0	0	299.418	4.142	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@@H](c3ccccc3C)C2)CCCC1	ZINC000449831097	330951499	/nfs/dbraw/zinc/95/14/99/330951499.db2.gz	SOKPSJKXQWCPOV-QGZVFWFLSA-N	0	0	297.442	4.447	20	30		CIEDRN
CC(C)CCCC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1	ZINC000450004647	330958224	/nfs/dbraw/zinc/95/82/24/330958224.db2.gz	RXEQWBKKDNMTIF-QZTJIDSGSA-N	0	0	298.430	4.111	20	30		CIEDRN
C=CC(C)(C)C(=O)Nc1cc(C(F)(F)F)ccc1C	ZINC000450065280	330960167	/nfs/dbraw/zinc/96/01/67/330960167.db2.gz	ANXLYQFNIBOEJS-UHFFFAOYSA-N	0	0	271.282	4.165	20	30		CIEDRN
C[C@@H](Nc1ccc(C#N)nc1)c1cccc(C2CC2)c1	ZINC000450560467	330986515	/nfs/dbraw/zinc/98/65/15/330986515.db2.gz	PEDRSFDEHRHNSE-GFCCVEGCSA-N	0	0	263.344	4.004	20	30		CIEDRN
C[C@@H](NCC1(C#N)CCC1)c1ccc(Cl)c(Cl)c1	ZINC000450659512	330991666	/nfs/dbraw/zinc/99/16/66/330991666.db2.gz	HUDXKPHMZKCTPV-SNVBAGLBSA-N	0	0	283.202	4.338	20	30		CIEDRN
N#CC[C@@H]1CC[C@H](Nc2ncc(-c3ccccc3)s2)C1	ZINC000450671459	330992496	/nfs/dbraw/zinc/99/24/96/330992496.db2.gz	HQZPDRDSPULJFB-JSGCOSHPSA-N	0	0	283.400	4.304	20	30		CIEDRN
COc1cccc2c(N[C@H]3CC[C@@H](CC#N)C3)cc(C)nc12	ZINC000450677369	330992939	/nfs/dbraw/zinc/99/29/39/330992939.db2.gz	YXWSKZVJDAIYFD-KBPBESRZSA-N	0	0	295.386	4.046	20	30		CIEDRN
CCC[C@H](NCC1(C#N)CCC1)c1ccc(F)cc1F	ZINC000450681752	330993267	/nfs/dbraw/zinc/99/32/67/330993267.db2.gz	MWSIONWVZWWBTN-HNNXBMFYSA-N	0	0	278.346	4.089	20	30		CIEDRN
N#C[C@H]1CC[C@@H](SCc2cccc(Cl)c2)C1	ZINC000450825327	331001289	/nfs/dbraw/zinc/00/12/89/331001289.db2.gz	YFOHQLUQIAXDMY-GXFFZTMASA-N	0	0	251.782	4.265	20	30		CIEDRN
COc1ccccc1[C@@H](C)SCC1(C#N)CCC1	ZINC000450852092	331002824	/nfs/dbraw/zinc/00/28/24/331002824.db2.gz	DFLMHCAMNXTONV-GFCCVEGCSA-N	0	0	261.390	4.183	20	30		CIEDRN
Cc1nc(C(C)C)oc1CSc1ccccc1C#N	ZINC000450858517	331003293	/nfs/dbraw/zinc/00/32/93/331003293.db2.gz	LFYJVCWHOYOPLH-UHFFFAOYSA-N	0	0	272.373	4.270	20	30		CIEDRN
C=CCC1(C(=O)N[C@H](CC)CC(F)(F)F)CCCCC1	ZINC000450874636	331004187	/nfs/dbraw/zinc/00/41/87/331004187.db2.gz	FASBBIRXRJKFCA-GFCCVEGCSA-N	0	0	291.357	4.360	20	30		CIEDRN
CCc1nc(C)c(CSc2ccc(C#N)cc2Cl)o1	ZINC000450879105	331004489	/nfs/dbraw/zinc/00/44/89/331004489.db2.gz	ZGRGMWAGRIACQL-UHFFFAOYSA-N	0	0	292.791	4.363	20	30		CIEDRN
CC(=O)CCCCCSc1cccc(Cl)c1C#N	ZINC000450904506	331006152	/nfs/dbraw/zinc/00/61/52/331006152.db2.gz	NAWGRTQBVVTNKY-UHFFFAOYSA-N	0	0	281.808	4.453	20	30		CIEDRN
N#C[C@H]1CC[C@H](SCc2ccccc2Cl)C1	ZINC000450912324	331006811	/nfs/dbraw/zinc/00/68/11/331006811.db2.gz	GSSHWKFIVPJBPI-JQWIXIFHSA-N	0	0	251.782	4.265	20	30		CIEDRN
N#C[C@@H]1CC[C@H](Sc2cc(Cl)ccc2F)C1	ZINC000450964946	331008972	/nfs/dbraw/zinc/00/89/72/331008972.db2.gz	UBZTWMRUOXWRJA-SCZZXKLOSA-N	0	0	255.745	4.263	20	30		CIEDRN
N#CCCn1cc(C(=O)CSC2CCC2)c2ccccc21	ZINC000450993632	331010959	/nfs/dbraw/zinc/01/09/59/331010959.db2.gz	WGBDXDDBCLUOAH-UHFFFAOYSA-N	0	0	298.411	4.023	20	30		CIEDRN
CC[C@@H](C#N)SC1CCC(C(F)(F)F)CC1	ZINC000451036098	331012745	/nfs/dbraw/zinc/01/27/45/331012745.db2.gz	JNVMITMZBKKQFF-KYHHOPLUSA-N	0	0	251.317	4.143	20	30		CIEDRN
C=CCCN(C)C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000451061542	331014148	/nfs/dbraw/zinc/01/41/48/331014148.db2.gz	LLFBROFZZRCLNN-TZMCWYRMSA-N	0	0	295.785	4.007	20	30		CIEDRN
Cc1ccc(Br)c(OCCC(C)(C)C#N)c1	ZINC000451069526	331014739	/nfs/dbraw/zinc/01/47/39/331014739.db2.gz	FPDIAGQCGDHKSU-UHFFFAOYSA-N	0	0	282.181	4.076	20	30		CIEDRN
N#CC1(CN[C@H](c2ccc(F)c(Cl)c2)C2CC2)CCC1	ZINC000451357667	331025572	/nfs/dbraw/zinc/02/55/72/331025572.db2.gz	TXFBASVZGULFCK-HNNXBMFYSA-N	0	0	292.785	4.214	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@@H]1C[C@H]1c1cccc2ccccc21	ZINC000451381607	331026583	/nfs/dbraw/zinc/02/65/83/331026583.db2.gz	FGMUNDIRELKVQX-DLBZAZTESA-N	0	0	279.383	4.024	20	30		CIEDRN
C=CC(C)(C)C(=O)Nc1cnn(CCC(C)C)c1C(C)C	ZINC000451386686	331026816	/nfs/dbraw/zinc/02/68/16/331026816.db2.gz	XMGSPFZJYMLBBT-UHFFFAOYSA-N	0	0	291.439	4.203	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)CC2(C)CCCCC2)s1	ZINC000510603574	332907727	/nfs/dbraw/zinc/90/77/27/332907727.db2.gz	YVHLQKVDRQLMPA-UHFFFAOYSA-N	0	0	290.432	4.481	20	30		CIEDRN
C=CCC1(C(=O)N[C@H]2C[C@H](c3ccccc3)C2)CCCC1	ZINC000451400002	331027729	/nfs/dbraw/zinc/02/77/29/331027729.db2.gz	NOPRSMPVPUPLPR-QAQDUYKDSA-N	0	0	283.415	4.185	20	30		CIEDRN
C=CC(C)(C)C(=O)NC1CC(c2ccc(F)c(Cl)c2)C1	ZINC000451445631	331029823	/nfs/dbraw/zinc/02/98/23/331029823.db2.gz	JVIMLKIUGHAXTM-UHFFFAOYSA-N	0	0	295.785	4.054	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)CC1CC(F)(F)C1	ZINC000451456887	331030204	/nfs/dbraw/zinc/03/02/04/331030204.db2.gz	MABUJOWOQSKMTE-UHFFFAOYSA-N	0	0	279.330	4.179	20	30		CIEDRN
C=CCC1(C(=O)N(C)c2ccc3cc[nH]c3c2)CCCC1	ZINC000451537635	331032915	/nfs/dbraw/zinc/03/29/15/331032915.db2.gz	RJYQZMPLZSRKSG-UHFFFAOYSA-N	0	0	282.387	4.267	20	30		CIEDRN
C=CCCCNc1cccc(C[S@](=O)c2ccccc2)c1	ZINC000194738483	331036341	/nfs/dbraw/zinc/03/63/41/331036341.db2.gz	QADKURBGNDZUGW-NRFANRHFSA-N	0	0	299.439	4.373	20	30		CIEDRN
C=CCCCNc1cccc(C[S@@](=O)c2ccccc2)c1	ZINC000194738467	331036413	/nfs/dbraw/zinc/03/64/13/331036413.db2.gz	QADKURBGNDZUGW-OAQYLSRUSA-N	0	0	299.439	4.373	20	30		CIEDRN
C=CC(C)(C)C(=O)N1CCC[C@@](C)(c2ccccc2)CC1	ZINC000451679710	331038887	/nfs/dbraw/zinc/03/88/87/331038887.db2.gz	KDAICORRSOTGMN-LJQANCHMSA-N	0	0	285.431	4.169	20	30		CIEDRN
C=CCC1(C(=O)N2Cc3cccc(Cl)c3C2)CCCC1	ZINC000451767729	331041514	/nfs/dbraw/zinc/04/15/14/331041514.db2.gz	WDQLDEHDDQXFKU-UHFFFAOYSA-N	0	0	289.806	4.319	20	30		CIEDRN
C[C@H](c1ccc(C#N)cc1)N1CC2(CCC2)[C@H]1c1ccco1	ZINC000451834306	331044281	/nfs/dbraw/zinc/04/42/81/331044281.db2.gz	IUXFNOMICIDRLH-RDTXWAMCSA-N	0	0	292.382	4.439	20	30		CIEDRN
N#Cc1ccc(F)cc1CN1CC2(CCC2)[C@@H]1c1ccco1	ZINC000451849332	331044751	/nfs/dbraw/zinc/04/47/51/331044751.db2.gz	HJCSHXSRYUPJAL-KRWDZBQOSA-N	0	0	296.345	4.018	20	30		CIEDRN
C[C@@H](c1cccc(C#N)c1)N1CC2(CCC2)[C@H]1c1ccco1	ZINC000451856360	331044845	/nfs/dbraw/zinc/04/48/45/331044845.db2.gz	PPEVLWKPJDLJDA-KBXCAEBGSA-N	0	0	292.382	4.439	20	30		CIEDRN
Cc1cccc(NC(=O)N[C@@H](CCC#N)c2ccccc2)c1	ZINC000163550947	331054896	/nfs/dbraw/zinc/05/48/96/331054896.db2.gz	MUXHOFQDMXTHJA-KRWDZBQOSA-N	0	0	293.370	4.162	20	30		CIEDRN
C=CC(C)(C)C(=O)NCC[C@H](c1ccccc1)C(F)(F)F	ZINC000452138506	331055635	/nfs/dbraw/zinc/05/56/35/331055635.db2.gz	JFURLWMTJUUSQW-CYBMUJFWSA-N	0	0	299.336	4.051	20	30		CIEDRN
CC[C@@H]1CCC[C@@H]1C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000452139509	331055700	/nfs/dbraw/zinc/05/57/00/331055700.db2.gz	NVYGSIQQBQYPSN-BPQIPLTHSA-N	0	0	298.430	4.364	20	30		CIEDRN
Cc1ccc(NC(=O)N[C@@H](CCC#N)c2ccccc2)s1	ZINC000163564099	331057225	/nfs/dbraw/zinc/05/72/25/331057225.db2.gz	IBXGYBBSNWOPAS-AWEZNQCLSA-N	0	0	299.399	4.223	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1[C@H](C)[C@H](CC(F)(F)F)C[C@@H]1C	ZINC000452226070	331059319	/nfs/dbraw/zinc/05/93/19/331059319.db2.gz	ALQVDWHOKOHFCU-RVMXOQNASA-N	0	0	291.357	4.167	20	30		CIEDRN
N#Cc1ccc(CSc2ccc(O)cc2)c(Cl)c1	ZINC000163643647	331065049	/nfs/dbraw/zinc/06/50/49/331065049.db2.gz	FTCJQEIWVAFWAW-UHFFFAOYSA-N	0	0	275.760	4.210	20	30		CIEDRN
CCC[C@@H](C)CC(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452643981	331070914	/nfs/dbraw/zinc/07/09/14/331070914.db2.gz	KRXBONZJGMIUBH-LLVKDONJSA-N	0	0	278.783	4.171	20	30		CIEDRN
CC(C)[C@@]1(C)C[C@@H]1C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452644243	331070944	/nfs/dbraw/zinc/07/09/44/331070944.db2.gz	BNWDEQGHFWUNEC-MLGOLLRUSA-N	0	0	290.794	4.027	20	30		CIEDRN
CC(C)C[C@@H](C)CC(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452646774	331070989	/nfs/dbraw/zinc/07/09/89/331070989.db2.gz	PJGHLVGQGPDQFD-GFCCVEGCSA-N	0	0	292.810	4.417	20	30		CIEDRN
C=C(C)CCNC(=O)c1c(C)c(C)oc1-c1ccccc1	ZINC000452716639	331073008	/nfs/dbraw/zinc/07/30/08/331073008.db2.gz	IUPDNKXJFLISJM-UHFFFAOYSA-N	0	0	283.371	4.259	20	30		CIEDRN
C=C(C)CCNC(=O)c1ccc(Cl)cc1C(F)(F)F	ZINC000452718234	331073259	/nfs/dbraw/zinc/07/32/59/331073259.db2.gz	OTUFDGOCOMNIHH-UHFFFAOYSA-N	0	0	291.700	4.055	20	30		CIEDRN
C=C(C)CCNC(=O)CCCc1csc2ccccc12	ZINC000452720692	331073721	/nfs/dbraw/zinc/07/37/21/331073721.db2.gz	XQCQYAHCLAWYBU-UHFFFAOYSA-N	0	0	287.428	4.306	20	30		CIEDRN
C=C(C)CCNC(=O)[C@H]1C[C@H]1c1cccc2ccccc21	ZINC000452722582	331074023	/nfs/dbraw/zinc/07/40/23/331074023.db2.gz	KNMMDMGRJNVYHF-ROUUACIJSA-N	0	0	279.383	4.026	20	30		CIEDRN
C=C[C@@](C)(CCOC)C(=O)Nc1cc(C)c(C)cc1Cl	ZINC000452908137	331080286	/nfs/dbraw/zinc/08/02/86/331080286.db2.gz	YODYFPZYPLOEJT-INIZCTEOSA-N	0	0	295.810	4.124	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(C(=O)C(C)C)cc1	ZINC000452970080	331082251	/nfs/dbraw/zinc/08/22/51/331082251.db2.gz	FICPURPFNQTGRQ-KRWDZBQOSA-N	0	0	273.376	4.066	20	30		CIEDRN
C=CCC1(c2nc(CCC(F)(F)F)no2)CCCCC1	ZINC000453069509	331086295	/nfs/dbraw/zinc/08/62/95/331086295.db2.gz	OFXMQZFZEZEIPQ-UHFFFAOYSA-N	0	0	288.313	4.343	20	30		CIEDRN
CCSCCNc1ccccc1S[C@H](C)CC#N	ZINC000453090576	331088259	/nfs/dbraw/zinc/08/82/59/331088259.db2.gz	PFMAXRFGEHNLKD-GFCCVEGCSA-N	0	0	280.462	4.246	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NCc1cn(C)nc1C	ZINC000453124423	331091636	/nfs/dbraw/zinc/09/16/36/331091636.db2.gz	QFWXKLYFGSZGJB-UHFFFAOYSA-N	0	0	283.419	4.193	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NCc1c(C)nnn1CC	ZINC000453128197	331092093	/nfs/dbraw/zinc/09/20/93/331092093.db2.gz	UTLMDYJWMCWMIQ-UHFFFAOYSA-N	0	0	298.434	4.070	20	30		CIEDRN
C=CCC1(c2nc(C3CCSCC3)no2)CCCC1	ZINC000453167621	331096393	/nfs/dbraw/zinc/09/63/93/331096393.db2.gz	XFWKKPSEEWNINZ-UHFFFAOYSA-N	0	0	278.421	4.068	20	30		CIEDRN
C=CC(C)(C)c1nc([C@@H](F)c2ccc(Cl)cc2)no1	ZINC000453184580	331098458	/nfs/dbraw/zinc/09/84/58/331098458.db2.gz	POZBRPFQODWNDT-NSHDSACASA-N	0	0	280.730	4.246	20	30		CIEDRN
CC(C)c1ccoc1-c1noc([C@]2(C#N)CC23CCCC3)n1	ZINC000453191058	331099362	/nfs/dbraw/zinc/09/93/62/331099362.db2.gz	VXJGEFKFGMZBBZ-QGZVFWFLSA-N	0	0	297.358	4.178	20	30		CIEDRN
C=CCC1(c2nc([C@@](C)(OC)C3CC3)no2)CCCCC1	ZINC000453190655	331099381	/nfs/dbraw/zinc/09/93/81/331099381.db2.gz	VMPOIPLYCWXECX-INIZCTEOSA-N	0	0	290.407	4.119	20	30		CIEDRN
C=CCC1(c2nc([C@@H]3CSc4ccccc43)no2)CCC1	ZINC000453213911	331102179	/nfs/dbraw/zinc/10/21/79/331102179.db2.gz	HFVRXGWKUDUJAV-CYBMUJFWSA-N	0	0	298.411	4.305	20	30		CIEDRN
C=CCC(C)(C)c1nc([C@H]2CSc3ccccc32)no1	ZINC000453214865	331102311	/nfs/dbraw/zinc/10/23/11/331102311.db2.gz	IHHBUKYFQFTVGR-LBPRGKRZSA-N	0	0	286.400	4.161	20	30		CIEDRN
C=CCCc1noc([C@@H]2CCCO[C@@H]2c2ccc(C)cc2)n1	ZINC000453240993	331106031	/nfs/dbraw/zinc/10/60/31/331106031.db2.gz	VAWOEGCRBSURJU-NVXWUHKLSA-N	0	0	298.386	4.132	20	30		CIEDRN
C=CCCc1noc([C@@H](CC)Oc2cccc(C)c2)n1	ZINC000453241162	331106048	/nfs/dbraw/zinc/10/60/48/331106048.db2.gz	VPWBEAGDYDBAHN-CQSZACIVSA-N	0	0	272.348	4.027	20	30		CIEDRN
N#Cc1ccc(CN2CC3(CCCC3)[C@H]2c2ccccc2)o1	ZINC000453611707	331136452	/nfs/dbraw/zinc/13/64/52/331136452.db2.gz	KZZUPXQSLBIXDH-GOSISDBHSA-N	0	0	292.382	4.269	20	30		CIEDRN
C=CCC[C@@H](C)Nc1ccc2c(c1)CN(CC(F)(F)F)C2	ZINC000453621642	331136923	/nfs/dbraw/zinc/13/69/23/331136923.db2.gz	XLWJXIBFJUMNHI-GFCCVEGCSA-N	0	0	298.352	4.331	20	30		CIEDRN
C=C(C)CCNC(=O)Nc1ccccc1C(C)(C)C	ZINC000454200537	331141595	/nfs/dbraw/zinc/14/15/95/331141595.db2.gz	KADGZDOHNWMYHH-UHFFFAOYSA-N	0	0	260.381	4.072	20	30		CIEDRN
CC(C)(CNC(=O)Nc1ccc(CC#N)cc1)C1=CCCC1	ZINC000454339447	331144430	/nfs/dbraw/zinc/14/44/30/331144430.db2.gz	DENQGDMTVLRYMD-UHFFFAOYSA-N	0	0	297.402	4.011	20	30		CIEDRN
CCC1(NC(=O)Nc2ccc(C(C)(C)C#N)cc2)CCCC1	ZINC000454452764	331146414	/nfs/dbraw/zinc/14/64/14/331146414.db2.gz	UARAHDYWAKMGHE-UHFFFAOYSA-N	0	0	299.418	4.332	20	30		CIEDRN
C=CC(C)(C)CNC(=O)N[C@@H](C)c1cc2ccccc2o1	ZINC000454508906	331147588	/nfs/dbraw/zinc/14/75/88/331147588.db2.gz	BSJLSUGNPQNVHN-LBPRGKRZSA-N	0	0	286.375	4.005	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N1CC2(CCCC2)[C@@H]1c1ccccc1	ZINC000454521157	331147816	/nfs/dbraw/zinc/14/78/16/331147816.db2.gz	JKJGTOMSQZRKRW-WBVHZDCISA-N	0	0	298.430	4.278	20	30		CIEDRN
C=C(CC)CNC(=O)Nc1cccc(-c2nc(C)c(C)o2)c1	ZINC000454570030	331149034	/nfs/dbraw/zinc/14/90/34/331149034.db2.gz	RNVLTYVSYNBDPG-UHFFFAOYSA-N	0	0	299.374	4.046	20	30		CIEDRN
CCCN(Cc1ccc(C#N)cc1)C(=O)C1=CC[C@@H](C)CC1	ZINC000454593916	331149512	/nfs/dbraw/zinc/14/95/12/331149512.db2.gz	MGYAKZJUEKVTNQ-OAHLLOKOSA-N	0	0	296.414	4.043	20	30		CIEDRN
C[C@H]1CC=C(C(=O)Nc2cccc(OCCCC#N)c2)CC1	ZINC000454862839	331155175	/nfs/dbraw/zinc/15/51/75/331155175.db2.gz	PLYSSGBICGCROI-AWEZNQCLSA-N	0	0	298.386	4.054	20	30		CIEDRN
C=C(C)CCNC(=O)Nc1cc(-c2nc(C)co2)ccc1C	ZINC000454959631	331157733	/nfs/dbraw/zinc/15/77/33/331157733.db2.gz	KIVPTRSOSHSHBX-UHFFFAOYSA-N	0	0	299.374	4.046	20	30		CIEDRN
CCN(C(=O)C1=CC[C@@H](C)CC1)[C@H](C)c1ccc(C#N)cc1	ZINC000454981128	331158124	/nfs/dbraw/zinc/15/81/24/331158124.db2.gz	RZKBIVRAHXAHEB-HUUCEWRRSA-N	0	0	296.414	4.214	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)N1CCC[C@]1(C)CC(C)C	ZINC000455005147	331158695	/nfs/dbraw/zinc/15/86/95/331158695.db2.gz	RXRBZVNCDXKLND-GOSISDBHSA-N	0	0	299.418	4.299	20	30		CIEDRN
C=C(CC)CNC(=O)Nc1cccc(C(F)F)c1Cl	ZINC000455138701	331161477	/nfs/dbraw/zinc/16/14/77/331161477.db2.gz	GVDSVKFMIDYPBU-UHFFFAOYSA-N	0	0	288.725	4.365	20	30		CIEDRN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)C1=CC[C@H](C)CC1	ZINC000455167959	331162155	/nfs/dbraw/zinc/16/21/55/331162155.db2.gz	YXDIPTINYZBWQC-HNNXBMFYSA-N	0	0	296.414	4.042	20	30		CIEDRN
C=C(C)CCNC(=O)N(CCC)[C@@H]1CCc2ccccc21	ZINC000455316766	331165876	/nfs/dbraw/zinc/16/58/76/331165876.db2.gz	WCSWMDALFQLGFR-QGZVFWFLSA-N	0	0	286.419	4.062	20	30		CIEDRN
C=CC(C)(C)CNC(=O)N1CC(C)(C)[C@@H]1c1cccs1	ZINC000455378387	331167849	/nfs/dbraw/zinc/16/78/49/331167849.db2.gz	CROBODZUPYWYIB-ZDUSSCGKSA-N	0	0	292.448	4.053	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)NC1(C2(C)CC2)CC1	ZINC000455385554	331168274	/nfs/dbraw/zinc/16/82/74/331168274.db2.gz	PLJVJPJUMNOYAA-UHFFFAOYSA-N	0	0	284.403	4.259	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000455689887	331175552	/nfs/dbraw/zinc/17/55/52/331175552.db2.gz	UFPVLPBISGLAGP-ADEWGFFLSA-N	0	0	298.213	4.178	20	30		CIEDRN
C=CCCCN(C)C(=O)c1ccc([C@@H](C)C(F)(F)F)cc1	ZINC000455696462	331175668	/nfs/dbraw/zinc/17/56/68/331175668.db2.gz	GMVYAUCNXZGOTH-GFCCVEGCSA-N	0	0	299.336	4.391	20	30		CIEDRN
CCCC(C)(C)NC(=O)Nc1ccc(CC#N)cc1Cl	ZINC000455708373	331175997	/nfs/dbraw/zinc/17/59/97/331175997.db2.gz	TXPYXJDJCZRVJT-UHFFFAOYSA-N	0	0	293.798	4.106	20	30		CIEDRN
C=CCN(CC=C)C(=O)Nc1ccccc1C(C)(F)F	ZINC000455782166	331177648	/nfs/dbraw/zinc/17/76/48/331177648.db2.gz	ALJMIHQCNQSLNB-UHFFFAOYSA-N	0	0	280.318	4.004	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccc(CSCC)cc1	ZINC000455869663	331179297	/nfs/dbraw/zinc/17/92/97/331179297.db2.gz	XDLWGBSUWURHBM-UHFFFAOYSA-N	0	0	292.448	4.370	20	30		CIEDRN
CC[C@H]1CCCC[C@H]1N(C)C(=O)Nc1cccc(CC#N)c1	ZINC000455914619	331180906	/nfs/dbraw/zinc/18/09/06/331180906.db2.gz	GWLFFFCNYXHKGJ-DOTOQJQBSA-N	0	0	299.418	4.185	20	30		CIEDRN
CCC1CCC(N(C)C(=O)Nc2cccc(CC#N)c2)CC1	ZINC000455918805	331181063	/nfs/dbraw/zinc/18/10/63/331181063.db2.gz	LKQGEPAQINKRRM-UHFFFAOYSA-N	0	0	299.418	4.185	20	30		CIEDRN
CC(C)[C@H]1CCCN(C(=O)Nc2cccc(CC#N)c2)CC1	ZINC000455925519	331181334	/nfs/dbraw/zinc/18/13/34/331181334.db2.gz	XLZFHHJBNXKTTL-INIZCTEOSA-N	0	0	299.418	4.043	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1ccc([C@@H](C)C(F)(F)F)cc1	ZINC000456011326	331182395	/nfs/dbraw/zinc/18/23/95/331182395.db2.gz	DOBIXZXYFGJOCO-RISCZKNCSA-N	0	0	299.336	4.437	20	30		CIEDRN
C=C[C@@H](CC(=O)NC(C)(C)C1CCC1)c1ccccc1	ZINC000456142292	331185377	/nfs/dbraw/zinc/18/53/77/331185377.db2.gz	GVKVBGAQPSQZAX-AWEZNQCLSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC1CC1)c1ccc(OC)cc1	ZINC000456186818	331186237	/nfs/dbraw/zinc/18/62/37/331186237.db2.gz	YFGWNAVZKJLXJM-UHFFFAOYSA-N	0	0	299.414	4.207	20	30		CIEDRN
C=CCN(CCc1ccccc1)C(=O)CCCC(C)(C)C	ZINC000303142340	332909532	/nfs/dbraw/zinc/90/95/32/332909532.db2.gz	BMCGHKBZGRKKNZ-UHFFFAOYSA-N	0	0	287.447	4.460	20	30		CIEDRN
C=CCC1(NC(=O)[C@H]2CCCC(F)(F)C2)CCCCC1	ZINC000456359539	331190867	/nfs/dbraw/zinc/19/08/67/331190867.db2.gz	CFBQVUHRQJOELG-ZDUSSCGKSA-N	0	0	285.378	4.207	20	30		CIEDRN
C=CCC1(NC(=O)[C@H](C)c2cccs2)CCCCC1	ZINC000456368099	331191305	/nfs/dbraw/zinc/19/13/05/331191305.db2.gz	OREXULYQZOOPEN-CYBMUJFWSA-N	0	0	277.433	4.247	20	30		CIEDRN
C=CCC1(NC(=O)CC2(C(F)(F)F)CC2)CCCCC1	ZINC000456374003	331191681	/nfs/dbraw/zinc/19/16/81/331191681.db2.gz	WNHMJZJDAPKNBU-UHFFFAOYSA-N	0	0	289.341	4.114	20	30		CIEDRN
C=CCCC(=O)N1CCCC[C@@H]1c1ccc(Cl)cc1	ZINC000456412790	331192335	/nfs/dbraw/zinc/19/23/35/331192335.db2.gz	HRQNHXDTWBWKDS-OAHLLOKOSA-N	0	0	277.795	4.360	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccc(CSCC)cc1	ZINC000456477246	331193413	/nfs/dbraw/zinc/19/34/13/331193413.db2.gz	CXGHYDKCMBTHDN-UHFFFAOYSA-N	0	0	275.417	4.072	20	30		CIEDRN
C=CCC1(CNC(=O)c2ccoc2C2CC2)CCCC1	ZINC000456510930	331194781	/nfs/dbraw/zinc/19/47/81/331194781.db2.gz	SJGFELQMTUFXQO-UHFFFAOYSA-N	0	0	273.376	4.023	20	30		CIEDRN
N#CCC[C@@H](Nc1ncc(C#N)cc1Cl)c1ccccc1	ZINC000164305002	331197371	/nfs/dbraw/zinc/19/73/71/331197371.db2.gz	UVDBLTJCBRNPEA-OAHLLOKOSA-N	0	0	296.761	4.064	20	30		CIEDRN
CCC[C@H](C(=O)Nc1cccc(CC#N)c1)c1ccccc1	ZINC000456739610	331199684	/nfs/dbraw/zinc/19/96/84/331199684.db2.gz	VZCAONLTPGVHBP-SFHVURJKSA-N	0	0	292.382	4.275	20	30		CIEDRN
Cc1oc(C(C)C)cc1C(=O)Nc1cccc(CC#N)c1	ZINC000456744296	331199792	/nfs/dbraw/zinc/19/97/92/331199792.db2.gz	GRNYCGUCBYBCFK-UHFFFAOYSA-N	0	0	282.343	4.030	20	30		CIEDRN
CC(C)(C#N)CC(=O)NC[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000456773041	331202531	/nfs/dbraw/zinc/20/25/31/331202531.db2.gz	PMAQCVQEQIUVKD-DLBZAZTESA-N	0	0	298.430	4.016	20	30		CIEDRN
CC(C)CN(C(=O)CC(C)(C)C#N)c1cccc(Cl)c1	ZINC000456789824	331204174	/nfs/dbraw/zinc/20/41/74/331204174.db2.gz	VEGNYCRHPIBDBJ-UHFFFAOYSA-N	0	0	292.810	4.269	20	30		CIEDRN
C=C(CC)CNC(=O)c1c(C)c(C)oc1-c1ccccc1	ZINC000456811769	331204951	/nfs/dbraw/zinc/20/49/51/331204951.db2.gz	KLKGNSGCCPLBMS-UHFFFAOYSA-N	0	0	283.371	4.259	20	30		CIEDRN
CC[C@@H]1CC[C@H](C)N(C(=O)C[C@H](CC#N)c2ccccc2)C1	ZINC000456822757	331205824	/nfs/dbraw/zinc/20/58/24/331205824.db2.gz	RVTLEQABCXNPCH-JZXOWHBKSA-N	0	0	298.430	4.111	20	30		CIEDRN
C=C(CC)CNC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000456829232	331206359	/nfs/dbraw/zinc/20/63/59/331206359.db2.gz	DONBMFUDRXSQCS-TZMCWYRMSA-N	0	0	295.785	4.055	20	30		CIEDRN
C=CCCOCCCCC(=O)NC[C@@H]1CCCC(C)(C)C1	ZINC000456893216	331208472	/nfs/dbraw/zinc/20/84/72/331208472.db2.gz	ZALSUNAWDKYBOS-MRXNPFEDSA-N	0	0	295.467	4.082	20	30		CIEDRN
C=CCCOCCCCC(=O)N(C(C)C)C1CC(C)(C)C1	ZINC000457072702	331211499	/nfs/dbraw/zinc/21/14/99/331211499.db2.gz	LBMHZTFMHSHVKK-UHFFFAOYSA-N	0	0	295.467	4.175	20	30		CIEDRN
C=CCCC1(C(=O)N2CC3(CCCC3)[C@H]2C(C)C)CC1	ZINC000457134857	331212858	/nfs/dbraw/zinc/21/28/58/331212858.db2.gz	FPEMZNFNYMBHOB-OAHLLOKOSA-N	0	0	275.436	4.160	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CC2(CCCC2)[C@@H]1C(C)C	ZINC000457146944	331212930	/nfs/dbraw/zinc/21/29/30/331212930.db2.gz	PQMHYBGYVZAFCI-CABCVRRESA-N	0	0	263.425	4.016	20	30		CIEDRN
C=CCC1(C(=O)N2CC3(CCCC3)[C@@H]2C(C)C)CCC1	ZINC000457150850	331212969	/nfs/dbraw/zinc/21/29/69/331212969.db2.gz	UWBMXSUEBOSTIW-HNNXBMFYSA-N	0	0	275.436	4.160	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC2(CCCC2)[C@@H]1C(C)C	ZINC000457173695	331213809	/nfs/dbraw/zinc/21/38/09/331213809.db2.gz	RGWLKLQXMZUZQI-INIZCTEOSA-N	0	0	275.436	4.182	20	30		CIEDRN
C=C[C@@H](CC(=O)N[C@@H](C1CC1)C1CCC1)c1ccccc1	ZINC000457238052	331216878	/nfs/dbraw/zinc/21/68/78/331216878.db2.gz	JOLAKZFINRQWAB-IFXJQAMLSA-N	0	0	283.415	4.041	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@@H](C1CC1)C1CCC1)c1ccccc1	ZINC000457246932	331217162	/nfs/dbraw/zinc/21/71/62/331217162.db2.gz	OGBSOZYKQHLWAF-ZWKOTPCHSA-N	0	0	283.415	4.041	20	30		CIEDRN
C=CCC[C@@H](NC(=O)c1[nH]ccc1C1CC1)c1ccccc1	ZINC000457672769	331230784	/nfs/dbraw/zinc/23/07/84/331230784.db2.gz	LNRUZRYXNAVUQA-QGZVFWFLSA-N	0	0	294.398	4.329	20	30		CIEDRN
C=CC[C@H]1N(C(=O)[C@H](CC)CC(F)F)CCCC1(C)C	ZINC000457750090	331233232	/nfs/dbraw/zinc/23/32/32/331233232.db2.gz	BWISPKGDBFJHGP-CHWSQXEVSA-N	0	0	287.394	4.261	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)[C@@H](C)C1CCC1	ZINC000457777119	331234070	/nfs/dbraw/zinc/23/40/70/331234070.db2.gz	NFAJQQVEFZFGKR-ZDUSSCGKSA-N	0	0	257.377	4.180	20	30		CIEDRN
CC(C)c1cccc(CC(=O)Nc2cccc(CC#N)c2)c1	ZINC000457870891	331236781	/nfs/dbraw/zinc/23/67/81/331236781.db2.gz	JIBXGMSTGUYUJY-UHFFFAOYSA-N	0	0	292.382	4.057	20	30		CIEDRN
CC(C)(CC#N)CNC(=O)C1CCC(c2ccccc2)CC1	ZINC000457987089	331238881	/nfs/dbraw/zinc/23/88/81/331238881.db2.gz	AFBFVEICVUPFLI-UHFFFAOYSA-N	0	0	298.430	4.016	20	30		CIEDRN
CC(C)(CC#N)CNC(=O)c1sccc1-c1ccccc1	ZINC000457992872	331239609	/nfs/dbraw/zinc/23/96/09/331239609.db2.gz	UYBUDNYFEOVQDJ-UHFFFAOYSA-N	0	0	298.411	4.085	20	30		CIEDRN
CCC[C@@H](CC1CCCC1)C(=O)NCC(C)(C)CC#N	ZINC000457997625	331240277	/nfs/dbraw/zinc/24/02/77/331240277.db2.gz	VZWZXEBKHMKZNM-HNNXBMFYSA-N	0	0	278.440	4.039	20	30		CIEDRN
CC(C)(CC#N)CNC(=O)c1ccc(C2CCCC2)cc1	ZINC000458013632	331240839	/nfs/dbraw/zinc/24/08/39/331240839.db2.gz	BESKBGRZXMHWDW-UHFFFAOYSA-N	0	0	284.403	4.014	20	30		CIEDRN
C=CCCCC(=O)N(C)[C@H]1CCC[C@H]1c1ccccc1	ZINC000458085811	331242431	/nfs/dbraw/zinc/24/24/31/331242431.db2.gz	KCYXTNVCQMBIMQ-IRXDYDNUSA-N	0	0	271.404	4.137	20	30		CIEDRN
C=CCCCC(=O)N(C)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000458085809	331242446	/nfs/dbraw/zinc/24/24/46/331242446.db2.gz	KCYXTNVCQMBIMQ-IAGOWNOFSA-N	0	0	271.404	4.137	20	30		CIEDRN
C=CCC1(C(=O)NC2CCC(C(F)F)CC2)CCCCC1	ZINC000458161694	331243985	/nfs/dbraw/zinc/24/39/85/331243985.db2.gz	JZWNGZIKDXZXEV-UHFFFAOYSA-N	0	0	299.405	4.453	20	30		CIEDRN
C=C[C@H](CC(=O)NC1(C2CCC2)CCC1)c1ccccc1	ZINC000458244367	331246059	/nfs/dbraw/zinc/24/60/59/331246059.db2.gz	WMQJLOFLHLLNDF-OAHLLOKOSA-N	0	0	283.415	4.185	20	30		CIEDRN
CC1(NC(=O)N[C@H](CCCC#N)c2ccccc2)CCCC1	ZINC000458265246	331246679	/nfs/dbraw/zinc/24/66/79/331246679.db2.gz	NRYPHQTWMMOCMQ-MRXNPFEDSA-N	0	0	299.418	4.053	20	30		CIEDRN
C=CCCC1(C(=O)N[C@@H](C)c2ccc(Cl)cc2)CC1	ZINC000458354593	331249980	/nfs/dbraw/zinc/24/99/80/331249980.db2.gz	HZHWVXODFBFELD-LBPRGKRZSA-N	0	0	277.795	4.264	20	30		CIEDRN
CCC1(NC(=O)N[C@H](CCCC#N)c2ccccc2)CCC1	ZINC000458795022	331259957	/nfs/dbraw/zinc/25/99/57/331259957.db2.gz	BYXJAWWEYQZPTP-MRXNPFEDSA-N	0	0	299.418	4.053	20	30		CIEDRN
N#CCCC[C@H](NC(=O)N1CCCCCC1)c1ccccc1	ZINC000458801443	331260080	/nfs/dbraw/zinc/26/00/80/331260080.db2.gz	NBOXFZLYNDHGQW-KRWDZBQOSA-N	0	0	299.418	4.007	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)NC/C=C/CC	ZINC000458991688	331264792	/nfs/dbraw/zinc/26/47/92/331264792.db2.gz	ZIJPILLCMKPVPJ-AATRIKPKSA-N	0	0	298.839	4.065	20	30		CIEDRN
CC(C)[C@@]1(C)C[C@H]1NC(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000459264868	331274040	/nfs/dbraw/zinc/27/40/40/331274040.db2.gz	ZTBHQOZOZGRWIN-CRAIPNDOSA-N	0	0	299.418	4.044	20	30		CIEDRN
N#CCCN(Cc1ccco1)Cc1ccc(C2CC2)cc1	ZINC000459285006	331274606	/nfs/dbraw/zinc/27/46/06/331274606.db2.gz	BTPCBEYEBVBTMY-UHFFFAOYSA-N	0	0	280.371	4.073	20	30		CIEDRN
C[C@H](c1ccc(CN[C@@H]2CCC[C@@H]2C#N)cc1)C(F)(F)F	ZINC000459451617	331281915	/nfs/dbraw/zinc/28/19/15/331281915.db2.gz	BDZQSYACZFUYQR-KCPJHIHWSA-N	0	0	296.336	4.134	20	30		CIEDRN
N#C[C@H]1CCC[C@H]1NCc1ccc(-c2cccs2)cc1	ZINC000459482802	331284211	/nfs/dbraw/zinc/28/42/11/331284211.db2.gz	RNRSMDLPLOFJAE-HZPDHXFCSA-N	0	0	282.412	4.197	20	30		CIEDRN
Cc1oc2ccc(NC(=O)NCC(C)(C)CC#N)cc2c1C	ZINC000459499244	331285051	/nfs/dbraw/zinc/28/50/51/331285051.db2.gz	WJYRFTFPKVAVKO-UHFFFAOYSA-N	0	0	299.374	4.111	20	30		CIEDRN
CC(C)(CC#N)CNC(=O)Nc1ccc(C2CCC2)cc1	ZINC000459527695	331286116	/nfs/dbraw/zinc/28/61/16/331286116.db2.gz	KFHLKNRWAVHGBA-UHFFFAOYSA-N	0	0	285.391	4.015	20	30		CIEDRN
N#CCC[C@H](C#N)CN1CC2(CCCC2)[C@H]1c1ccccc1	ZINC000459576972	331289093	/nfs/dbraw/zinc/28/90/93/331289093.db2.gz	VNWZXNHQJZJPDQ-SJLPKXTDSA-N	0	0	293.414	4.047	20	30		CIEDRN
CC(C)(C#N)c1ccccc1CN1Cc2cccc(F)c2C1	ZINC000459725385	331296016	/nfs/dbraw/zinc/29/60/16/331296016.db2.gz	CGOQUPBHQSQSSP-UHFFFAOYSA-N	0	0	294.373	4.143	20	30		CIEDRN
CC(C)(C#N)CCCCN1Cc2ccc(Cl)cc2C1	ZINC000459766169	331299349	/nfs/dbraw/zinc/29/93/49/331299349.db2.gz	PBQPNRBBDUYYFE-UHFFFAOYSA-N	0	0	276.811	4.376	20	30		CIEDRN
CC[C@H](C)N(Cc1ccccc1)C(=O)c1cscc1C#N	ZINC000459897916	331303090	/nfs/dbraw/zinc/30/30/90/331303090.db2.gz	YVOFJTKFPABJOO-ZDUSSCGKSA-N	0	0	298.411	4.061	20	30		CIEDRN
C=CCN(C(=O)c1ccn(C)c1C1CCC1)c1ccccc1	ZINC000459935468	331303565	/nfs/dbraw/zinc/30/35/65/331303565.db2.gz	UNTPUCMFSHGRDR-UHFFFAOYSA-N	0	0	294.398	4.125	20	30		CIEDRN
CC[C@H](CC(C)C)C(=O)N(Cc1ccc(C#N)cc1)C1CC1	ZINC000459944257	331303690	/nfs/dbraw/zinc/30/36/90/331303690.db2.gz	JQMLKJPJBHZUIC-QGZVFWFLSA-N	0	0	298.430	4.122	20	30		CIEDRN
Cc1ccc([C@H](C)N(C)C(=O)c2cscc2C#N)c(C)c1	ZINC000459955945	331303798	/nfs/dbraw/zinc/30/37/98/331303798.db2.gz	BSNBMCDUSQUTEJ-ZDUSSCGKSA-N	0	0	298.411	4.070	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)[C@@]1(C)CC=CCC1	ZINC000460014760	331304362	/nfs/dbraw/zinc/30/43/62/331304362.db2.gz	AROBTWSQPXIBNB-SFHVURJKSA-N	0	0	287.378	4.087	20	30		CIEDRN
N#Cc1ccc(F)c(COc2cccc(Cl)c2F)c1	ZINC000167124633	331308013	/nfs/dbraw/zinc/30/80/13/331308013.db2.gz	QSTQQISZIOTCFA-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
C=C(C)Cn1c([C@@H](C)CC)nnc1N1CCCCC[C@@H]1C	ZINC000460960267	331309445	/nfs/dbraw/zinc/30/94/45/331309445.db2.gz	RGKMXLXQTDRDBW-GJZGRUSLSA-N	0	0	290.455	4.137	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)[C@H](CC)c1ccc(F)cc1	ZINC000461092872	331311285	/nfs/dbraw/zinc/31/12/85/331311285.db2.gz	GPSXNNFKCDXGJW-CZUORRHYSA-N	0	0	277.383	4.180	20	30		CIEDRN
N#Cc1cccc(SCC(=O)CCC2CCCC2)c1	ZINC000461408507	331312999	/nfs/dbraw/zinc/31/29/99/331312999.db2.gz	NQEOQGAOADTPAI-UHFFFAOYSA-N	0	0	273.401	4.190	20	30		CIEDRN
C=CCCCCCNc1ccc2c(C)nn(C)c2c1	ZINC000461750076	331314437	/nfs/dbraw/zinc/31/44/37/331314437.db2.gz	WCJWKXAKQDCCFL-UHFFFAOYSA-N	0	0	257.381	4.040	20	30		CIEDRN
Cc1ccc(Cl)cc1NC(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000461777192	331314568	/nfs/dbraw/zinc/31/45/68/331314568.db2.gz	MVHCOTDZQFSJRI-LBPRGKRZSA-N	0	0	298.773	4.262	20	30		CIEDRN
N#CCCCc1nc(-c2ccc(-c3ccccc3)cc2)no1	ZINC000461802998	331314897	/nfs/dbraw/zinc/31/48/97/331314897.db2.gz	NPUCCVJLPNLIFH-UHFFFAOYSA-N	0	0	289.338	4.250	20	30		CIEDRN
CCCC1CCC(NC(=O)[C@@H](C)c2cccc(C#N)c2)CC1	ZINC000461921370	331315507	/nfs/dbraw/zinc/31/55/07/331315507.db2.gz	LPQKISUTJPJBMG-SYJJWHGVSA-N	0	0	298.430	4.137	20	30		CIEDRN
Cc1nc(N2[C@H](C)C[C@H]3CCCC[C@@H]32)c(Cl)cc1C#N	ZINC000461947413	331316053	/nfs/dbraw/zinc/31/60/53/331316053.db2.gz	JPOVRFUHUVWKPA-HCKVZZMMSA-N	0	0	289.810	4.073	20	30		CIEDRN
C[C@@H](C(=O)N1CCC[C@H]1CC(C)(C)C)c1cccc(C#N)c1	ZINC000462022747	331316786	/nfs/dbraw/zinc/31/67/86/331316786.db2.gz	HAQNIPMVYHTYFW-PBHICJAKSA-N	0	0	298.430	4.089	20	30		CIEDRN
CC[C@H](C)[C@@H](NC(=O)CCCC#N)c1ccc(Cl)cc1	ZINC000462139453	331317861	/nfs/dbraw/zinc/31/78/61/331317861.db2.gz	KFZJKOQLXALFME-BLLLJJGKSA-N	0	0	292.810	4.237	20	30		CIEDRN
CCCC[C@@H](NC(=O)[C@H](C)c1cccc(C#N)c1)C1CCC1	ZINC000462174963	331318096	/nfs/dbraw/zinc/31/80/96/331318096.db2.gz	IZRXBRHTWCJHDD-RDTXWAMCSA-N	0	0	298.430	4.137	20	30		CIEDRN
CCCC[C@@H](NC(=O)[C@@H](C)c1cccc(C#N)c1)C1CCC1	ZINC000462174858	331318119	/nfs/dbraw/zinc/31/81/19/331318119.db2.gz	IZRXBRHTWCJHDD-KBXCAEBGSA-N	0	0	298.430	4.137	20	30		CIEDRN
CC(C)C[C@@H]1CCCCN1C(=O)[C@H](C)c1cccc(C#N)c1	ZINC000462197289	331318296	/nfs/dbraw/zinc/31/82/96/331318296.db2.gz	CXTATUARHRJRRQ-QAPCUYQASA-N	0	0	298.430	4.089	20	30		CIEDRN
CC(C)CC[C@@H]1CCCN1C(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000462246856	331318823	/nfs/dbraw/zinc/31/88/23/331318823.db2.gz	MOAGPWBEHLXKCW-YJBOKZPZSA-N	0	0	298.430	4.089	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)[C@@H]1C[C@H]1CCC	ZINC000462318860	331319347	/nfs/dbraw/zinc/31/93/47/331319347.db2.gz	YVFDUWPSQHGDRZ-IAGOWNOFSA-N	0	0	271.404	4.028	20	30		CIEDRN
N#Cc1cccc(C(=O)Nc2cccc(C3CCC3)c2)c1	ZINC000462376988	331320940	/nfs/dbraw/zinc/32/09/40/331320940.db2.gz	UCYUDBPCUKULDM-UHFFFAOYSA-N	0	0	276.339	4.078	20	30		CIEDRN
N#Cc1cccc(Cl)c1N[C@H]1CCc2cc(F)ccc21	ZINC000462385580	331321078	/nfs/dbraw/zinc/32/10/78/331321078.db2.gz	AFWQBWOKTREYTM-HNNXBMFYSA-N	0	0	286.737	4.450	20	30		CIEDRN
N#Cc1cccc(Cl)c1N[C@@H]1CCc2cc(F)ccc21	ZINC000462385581	331321098	/nfs/dbraw/zinc/32/10/98/331321098.db2.gz	AFWQBWOKTREYTM-OAHLLOKOSA-N	0	0	286.737	4.450	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CCCCC12CCCC2	ZINC000462418066	331321727	/nfs/dbraw/zinc/32/17/27/331321727.db2.gz	XHWRKXIGKGYEDF-HUUCEWRRSA-N	0	0	263.425	4.208	20	30		CIEDRN
CCc1ccc(NC(=O)[C@@H](C)c2cccc(C#N)c2)cc1C	ZINC000462540289	331323256	/nfs/dbraw/zinc/32/32/56/331323256.db2.gz	RBKBBRMCLOAVSG-AWEZNQCLSA-N	0	0	292.382	4.171	20	30		CIEDRN
CCc1cc(NC(=O)[C@@H](C)c2cccc(C#N)c2)ccc1C	ZINC000462536419	331323262	/nfs/dbraw/zinc/32/32/62/331323262.db2.gz	FATFJUCNRDQNHO-AWEZNQCLSA-N	0	0	292.382	4.171	20	30		CIEDRN
N#C[C@H](NC(=O)c1cccc(C2CCC2)c1)C1CCCCC1	ZINC000462555200	331323424	/nfs/dbraw/zinc/32/34/24/331323424.db2.gz	REZJPQZUXJRBDN-SFHVURJKSA-N	0	0	296.414	4.156	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)CCc1cncc2ccccc21	ZINC000462619257	331324094	/nfs/dbraw/zinc/32/40/94/331324094.db2.gz	CWLVEPXCXFVPJK-OAHLLOKOSA-N	0	0	296.414	4.028	20	30		CIEDRN
COc1ccc(OCc2ccccc2C#N)c2ccccc12	ZINC000462660554	331324777	/nfs/dbraw/zinc/32/47/77/331324777.db2.gz	SSRUUPXBZMEKDT-UHFFFAOYSA-N	0	0	289.334	4.299	20	30		CIEDRN
N#Cc1cccc(Cl)c1NCCc1c(F)cccc1F	ZINC000462785519	331328968	/nfs/dbraw/zinc/32/89/68/331328968.db2.gz	OOFMATPSVCCNBE-UHFFFAOYSA-N	0	0	292.716	4.144	20	30		CIEDRN
N#Cc1cccc(Cl)c1NCCc1cc(F)cc(F)c1	ZINC000462804858	331329835	/nfs/dbraw/zinc/32/98/35/331329835.db2.gz	QVUYNVKTONPTSA-UHFFFAOYSA-N	0	0	292.716	4.144	20	30		CIEDRN
CCS[C@H]1CCCCN(c2c(Cl)cccc2C#N)C1	ZINC000462832295	331332074	/nfs/dbraw/zinc/33/20/74/331332074.db2.gz	FHTGHXRUUSVBNK-ZDUSSCGKSA-N	0	0	294.851	4.324	20	30		CIEDRN
Cc1cccc([C@H](C)Nc2ccc(F)cc2C#N)c1C	ZINC000462845837	331332599	/nfs/dbraw/zinc/33/25/99/331332599.db2.gz	PJHUDRXKOQBCDH-ZDUSSCGKSA-N	0	0	268.335	4.487	20	30		CIEDRN
C[C@H]1C[C@H](c2ccccc2)CN1c1ccc(F)cc1C#N	ZINC000462846633	331332608	/nfs/dbraw/zinc/33/26/08/331332608.db2.gz	BPNGEKBXUQMBHB-BBRMVZONSA-N	0	0	280.346	4.080	20	30		CIEDRN
N#Cc1ccc(Cl)cc1N1CC[C@H](Cc2ccccc2)C1	ZINC000462854601	331332789	/nfs/dbraw/zinc/33/27/89/331332789.db2.gz	MFRHRONKQJQZPU-OAHLLOKOSA-N	0	0	296.801	4.281	20	30		CIEDRN
N#Cc1cc(N[C@@H]2C[C@@H]2Cc2ccccc2)nc2ccccc12	ZINC000462870562	331333482	/nfs/dbraw/zinc/33/34/82/331333482.db2.gz	KEZSXCXUFGQTBN-HNAYVOBHSA-N	0	0	299.377	4.150	20	30		CIEDRN
COc1ccc([C@@H](C)CCNc2ccc(C#N)cc2)cc1	ZINC000462875046	331333672	/nfs/dbraw/zinc/33/36/72/331333672.db2.gz	FTLCKYLXZDHBAR-AWEZNQCLSA-N	0	0	280.371	4.173	20	30		CIEDRN
C[C@@H]1CN(c2ccc(F)cc2C#N)CC[C@@H]1c1ccccc1	ZINC000462893996	331334248	/nfs/dbraw/zinc/33/42/48/331334248.db2.gz	HTIUHJFYKLDZHL-KDOFPFPSSA-N	0	0	294.373	4.327	20	30		CIEDRN
C[C@@H]1CN(c2cccc(F)c2C#N)CC[C@@H]1c1ccccc1	ZINC000462903146	331334423	/nfs/dbraw/zinc/33/44/23/331334423.db2.gz	QSBAWZORKBBBDW-ZBFHGGJFSA-N	0	0	294.373	4.327	20	30		CIEDRN
Cc1cc(CNc2c(Cl)cccc2C#N)ccc1F	ZINC000462932211	331335421	/nfs/dbraw/zinc/33/54/21/331335421.db2.gz	ZFVFJRPXJPMCME-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
C[C@H](CNc1ccc(C#N)cc1F)c1ccc(F)cc1F	ZINC000463028165	331337466	/nfs/dbraw/zinc/33/74/66/331337466.db2.gz	JOJMHNIKSQQMNS-SNVBAGLBSA-N	0	0	290.288	4.191	20	30		CIEDRN
C[C@@H](CCc1ccsc1)Nc1ccc(CC#N)cc1	ZINC000463054899	331338848	/nfs/dbraw/zinc/33/88/48/331338848.db2.gz	SMYJCQDMAUVVBA-ZDUSSCGKSA-N	0	0	270.401	4.247	20	30		CIEDRN
Cc1ccsc1-c1noc([C@H](C)c2cccc(C#N)c2)n1	ZINC000463058739	331339047	/nfs/dbraw/zinc/33/90/47/331339047.db2.gz	VQPROJNQHVEKFS-LLVKDONJSA-N	0	0	295.367	4.130	20	30		CIEDRN
N#Cc1ccccc1NC(=O)c1ccc(C2CCCC2)cc1	ZINC000463067405	331339179	/nfs/dbraw/zinc/33/91/79/331339179.db2.gz	HDRSPPYTGQTEDW-UHFFFAOYSA-N	0	0	290.366	4.468	20	30		CIEDRN
Cc1cc(C)c(C#N)c(NC[C@@H](C)Sc2ccccc2)n1	ZINC000463077439	331339608	/nfs/dbraw/zinc/33/96/08/331339608.db2.gz	IUEFZEQFCGAAMT-CQSZACIVSA-N	0	0	297.427	4.163	20	30		CIEDRN
C[C@H]1C[C@@H](c2cccc(F)c2)N(c2cccc(F)c2C#N)C1	ZINC000463075858	331339689	/nfs/dbraw/zinc/33/96/89/331339689.db2.gz	FFWCRRFCNKSUQN-SGTLLEGYSA-N	0	0	298.336	4.424	20	30		CIEDRN
C=C(C)CN(CC)C(=O)C1CCC(c2ccccc2)CC1	ZINC000463101019	331340212	/nfs/dbraw/zinc/34/02/12/331340212.db2.gz	BJBAMUGKVMDRRW-UHFFFAOYSA-N	0	0	285.431	4.385	20	30		CIEDRN
N#C[C@H]1CCC[C@H](Nc2cc(Cl)cc(Cl)c2)C1	ZINC000463234837	331343410	/nfs/dbraw/zinc/34/34/10/331343410.db2.gz	BDGZQBCQFGPTBH-CABZTGNLSA-N	0	0	269.175	4.488	20	30		CIEDRN
CCSCc1cccc(N[C@@H]2CCC[C@@H](C#N)C2)c1	ZINC000463291887	331345366	/nfs/dbraw/zinc/34/53/66/331345366.db2.gz	PZBJMFYVGDPEQT-UKRRQHHQSA-N	0	0	274.433	4.434	20	30		CIEDRN
N#C[C@H]1CCC[C@@H](Nc2cccc3c2CCCC3)C1	ZINC000463295001	331345618	/nfs/dbraw/zinc/34/56/18/331345618.db2.gz	XGWRDYYOQZBKRY-DZGCQCFKSA-N	0	0	254.377	4.060	20	30		CIEDRN
N#C[C@@H]1CCC[C@H](Nc2cccc3c2CCCC3)C1	ZINC000463295002	331345731	/nfs/dbraw/zinc/34/57/31/331345731.db2.gz	XGWRDYYOQZBKRY-HIFRSBDPSA-N	0	0	254.377	4.060	20	30		CIEDRN
CCCCCN(C(=O)[C@H](C)c1cccc(C#N)c1)C(C)C	ZINC000463347261	331346386	/nfs/dbraw/zinc/34/63/86/331346386.db2.gz	BMVOWRBTILGKNZ-OAHLLOKOSA-N	0	0	286.419	4.089	20	30		CIEDRN
CCN(C(=O)[C@H](C)c1cccc(C#N)c1)c1cccc(C)c1	ZINC000463395070	331347053	/nfs/dbraw/zinc/34/70/53/331347053.db2.gz	RCKQGXXRDARYMP-OAHLLOKOSA-N	0	0	292.382	4.023	20	30		CIEDRN
Cc1cc2cc(C(=O)Nc3ccc(C#N)cc3)oc2cc1C	ZINC000463451669	331348004	/nfs/dbraw/zinc/34/80/04/331348004.db2.gz	WWQFBFGSMWSDER-UHFFFAOYSA-N	0	0	290.322	4.174	20	30		CIEDRN
CC(C)N(C(=O)[C@@H](C)c1cccc(C#N)c1)C1CCCCC1	ZINC000463603904	331349948	/nfs/dbraw/zinc/34/99/48/331349948.db2.gz	ZDUSPKNLPADWFO-HNNXBMFYSA-N	0	0	298.430	4.231	20	30		CIEDRN
Cc1ccc([C@H](C)Nc2ccc([N+](=O)[O-])c(C#N)c2)cc1C	ZINC000463651294	331350223	/nfs/dbraw/zinc/35/02/23/331350223.db2.gz	SZDDLJSQAGXYPT-ZDUSSCGKSA-N	0	0	295.342	4.256	20	30		CIEDRN
CCCCC[C@H]1CCCN1c1ccc([N+](=O)[O-])c(C#N)c1	ZINC000463659478	331350262	/nfs/dbraw/zinc/35/02/62/331350262.db2.gz	WZBKPNISYRTTPO-AWEZNQCLSA-N	0	0	287.363	4.016	20	30		CIEDRN
CC(C)(C)[C@H](C#N)NC(=O)c1ccc(C2CCCC2)cc1	ZINC000464038547	331355296	/nfs/dbraw/zinc/35/52/96/331355296.db2.gz	BDFRZZCFXFSODL-INIZCTEOSA-N	0	0	284.403	4.012	20	30		CIEDRN
CCCc1cc(C(=O)N[C@](C)(C#N)C(C)(C)C)sc1C	ZINC000464163964	331357324	/nfs/dbraw/zinc/35/73/24/331357324.db2.gz	MCIDMQRYVGSKBP-MRXNPFEDSA-N	0	0	292.448	4.067	20	30		CIEDRN
CC(C)(C)c1ccc(C(C)(C)NC(=O)CCCC#N)cc1	ZINC000464211723	331358096	/nfs/dbraw/zinc/35/80/96/331358096.db2.gz	ZGAWZIVEFHUJNZ-UHFFFAOYSA-N	0	0	286.419	4.029	20	30		CIEDRN
C=CCC(CC=C)C(=O)NCCC1=CCCCCC1	ZINC000464251459	331358708	/nfs/dbraw/zinc/35/87/08/331358708.db2.gz	RLVNIXWVZPHBNR-UHFFFAOYSA-N	0	0	261.409	4.152	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](CC)c1ccc(C)cc1	ZINC000464443842	331360327	/nfs/dbraw/zinc/36/03/27/331360327.db2.gz	BZGYWIBOKFMJNS-GOEBONIOSA-N	0	0	259.393	4.165	20	30		CIEDRN
CC#CCCCC(=O)N(CCCC)Cc1ccccc1F	ZINC000464439036	331360581	/nfs/dbraw/zinc/36/05/81/331360581.db2.gz	DDFDVGYKEICSSL-UHFFFAOYSA-N	0	0	289.394	4.148	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC)c1cc(C)cc(C)c1	ZINC000464443543	331360751	/nfs/dbraw/zinc/36/07/51/331360751.db2.gz	VCTIUNRMQLLDRB-OAHLLOKOSA-N	0	0	259.393	4.259	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC)c1cc(C)cc(C)c1	ZINC000464443541	331360773	/nfs/dbraw/zinc/36/07/73/331360773.db2.gz	VCTIUNRMQLLDRB-HNNXBMFYSA-N	0	0	259.393	4.259	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](CC)c1ccc(C)cc1	ZINC000464443841	331360826	/nfs/dbraw/zinc/36/08/26/331360826.db2.gz	BZGYWIBOKFMJNS-GDBMZVCRSA-N	0	0	259.393	4.165	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](c1ccccc1)C(C)(C)C	ZINC000464448053	331360860	/nfs/dbraw/zinc/36/08/60/331360860.db2.gz	FVLQHWAYILOHRQ-ZBFHGGJFSA-N	0	0	273.420	4.492	20	30		CIEDRN
CC#CCCCC(=O)N[C@H](c1ccccc1)C(C)(C)C	ZINC000464450334	331360922	/nfs/dbraw/zinc/36/09/22/331360922.db2.gz	NUQVFEVOSUXDKY-QGZVFWFLSA-N	0	0	271.404	4.084	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](CCC)c1ccccc1	ZINC000464531856	331361919	/nfs/dbraw/zinc/36/19/19/331361919.db2.gz	BHNUZGMJUGSWAW-ZBFHGGJFSA-N	0	0	259.393	4.246	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](c1ccc(C)cc1)C1CC1	ZINC000464537919	331361964	/nfs/dbraw/zinc/36/19/64/331361964.db2.gz	HTEZFJADIWCDDT-RHSMWYFYSA-N	0	0	271.404	4.165	20	30		CIEDRN
CC#CCCCC(=O)N(CCC)[C@@H]1CCc2ccccc21	ZINC000464533581	331362038	/nfs/dbraw/zinc/36/20/38/331362038.db2.gz	HHWVYRWSDVYIKR-GOSISDBHSA-N	0	0	283.415	4.106	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC)Cc1ccccc1Cl	ZINC000464542665	331362167	/nfs/dbraw/zinc/36/21/67/331362167.db2.gz	AUUUBNDEIMLKLD-ZDUSSCGKSA-N	0	0	279.811	4.291	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000464553549	331362451	/nfs/dbraw/zinc/36/24/51/331362451.db2.gz	JOGBMUBBTUSHML-VIFPVBQESA-N	0	0	255.720	4.020	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000464556154	331362501	/nfs/dbraw/zinc/36/25/01/331362501.db2.gz	PXCPHBJYPCWXKE-JTQLQIEISA-N	0	0	271.282	4.246	20	30		CIEDRN
CC#CCCCC(=O)N[C@H](C)c1ccc(Cl)cc1Cl	ZINC000464559525	331362600	/nfs/dbraw/zinc/36/26/00/331362600.db2.gz	VEPPLTKCKBKQEX-LLVKDONJSA-N	0	0	298.213	4.364	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC)c1ccccc1Cl	ZINC000464564100	331362669	/nfs/dbraw/zinc/36/26/69/331362669.db2.gz	BELGXMQMLAOUOC-LBPRGKRZSA-N	0	0	265.784	4.295	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(Cc1ccccc1)[C@H](C)C1CC1	ZINC000464568648	331362847	/nfs/dbraw/zinc/36/28/47/331362847.db2.gz	UFFSDQSHROZIID-HZPDHXFCSA-N	0	0	285.431	4.416	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000464637725	331364068	/nfs/dbraw/zinc/36/40/68/331364068.db2.gz	URITXNSRFPLHFG-KRWDZBQOSA-N	0	0	299.458	4.460	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H]1CCCC[C@H]1c1ccccc1	ZINC000464650696	331364225	/nfs/dbraw/zinc/36/42/25/331364225.db2.gz	AKVGNDARWVOESF-SZMVWBNQSA-N	0	0	285.431	4.431	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](C)CC(C)(C)c1ccccc1	ZINC000464649691	331364260	/nfs/dbraw/zinc/36/42/60/331364260.db2.gz	OBFLDALUDFVXRD-JKSUJKDBSA-N	0	0	287.447	4.461	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)CCc1cccc2ccccc21	ZINC000464647989	331364271	/nfs/dbraw/zinc/36/42/71/331364271.db2.gz	OVUKIFBKJOMAPP-MRXNPFEDSA-N	0	0	295.426	4.443	20	30		CIEDRN
CC#CCCCC(=O)N[C@H]1CCCC[C@H]1c1ccccc1	ZINC000464653547	331364332	/nfs/dbraw/zinc/36/43/32/331364332.db2.gz	SPOVBWLQFGQDCB-ROUUACIJSA-N	0	0	283.415	4.023	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCc1ccc(-c2ccccc2)o1	ZINC000464653774	331364360	/nfs/dbraw/zinc/36/43/60/331364360.db2.gz	WHHJSBZAUBWHPU-AWEZNQCLSA-N	0	0	283.371	4.165	20	30		CIEDRN
CC[C@@H](CC1CCCCC1)C(=O)N[C@@H](C#N)C(C)(C)C	ZINC000464706912	331364950	/nfs/dbraw/zinc/36/49/50/331364950.db2.gz	FFTSMTKRTXUFKV-GJZGRUSLSA-N	0	0	278.440	4.037	20	30		CIEDRN
CCC[C@H](CC1CCCC1)C(=O)N[C@@H](C#N)C(C)(C)C	ZINC000464710253	331365110	/nfs/dbraw/zinc/36/51/10/331365110.db2.gz	JSQDNRCCNQOHQU-CABCVRRESA-N	0	0	278.440	4.037	20	30		CIEDRN
C=C[C@H](C)NC(=O)N(C)[C@H](C)[C@@H](C)c1ccc(Cl)cc1	ZINC000464752929	331365551	/nfs/dbraw/zinc/36/55/51/331365551.db2.gz	QFLNJIRQSVKSPH-YNEHKIRRSA-N	0	0	294.826	4.048	20	30		CIEDRN
C=C[C@H](C)NC(=O)N[C@@H](c1ccc(Cl)cc1)C1CCC1	ZINC000464755775	331366254	/nfs/dbraw/zinc/36/62/54/331366254.db2.gz	JPLZADKIEVCKTJ-XHDPSFHLSA-N	0	0	292.810	4.055	20	30		CIEDRN
C=C[C@@H](C)NC(=O)N[C@H](C)c1ccc(SC(C)C)cc1	ZINC000464756505	331366366	/nfs/dbraw/zinc/36/63/66/331366366.db2.gz	RFGSUZJDWRUSCB-CHWSQXEVSA-N	0	0	292.448	4.122	20	30		CIEDRN
C=C[C@H](C)NC(=O)N[C@H](c1ccc(Cl)cc1)C1CCC1	ZINC000464755774	331366370	/nfs/dbraw/zinc/36/63/70/331366370.db2.gz	JPLZADKIEVCKTJ-NHYWBVRUSA-N	0	0	292.810	4.055	20	30		CIEDRN
C=C[C@H](C)NC(=O)C[C@@H](Cc1ccccc1)c1ccccc1	ZINC000465101942	331378408	/nfs/dbraw/zinc/37/84/08/331378408.db2.gz	IJWMJELVMKNWOY-QFBILLFUSA-N	0	0	293.410	4.094	20	30		CIEDRN
C=C[C@@H](C)NC(=O)c1sccc1-c1ccc(C)cc1	ZINC000465112600	331378676	/nfs/dbraw/zinc/37/86/76/331378676.db2.gz	QTXWNYQHTYRAEU-GFCCVEGCSA-N	0	0	271.385	4.028	20	30		CIEDRN
C=C[C@@H](C)NC(=O)c1ccc(CSc2ccccc2)cc1	ZINC000465113927	331378820	/nfs/dbraw/zinc/37/88/20/331378820.db2.gz	SQLYONJGXAQRRQ-CQSZACIVSA-N	0	0	297.423	4.283	20	30		CIEDRN
C=C[C@H](C)NC(=O)C(CC)(CC)c1ccc(Cl)cc1	ZINC000465116479	331378879	/nfs/dbraw/zinc/37/88/79/331378879.db2.gz	AWBAUSMTLDCBNO-LBPRGKRZSA-N	0	0	279.811	4.089	20	30		CIEDRN
C=C[C@@H](C)NC(=O)c1ccccc1SCC=C(C)C	ZINC000465123951	331379072	/nfs/dbraw/zinc/37/90/72/331379072.db2.gz	ZFHJZPYYYMEDOL-CYBMUJFWSA-N	0	0	275.417	4.049	20	30		CIEDRN
C=C[C@@H](C)NC(=O)Nc1cc(C(F)(F)F)ccc1Cl	ZINC000465177908	331380186	/nfs/dbraw/zinc/38/01/86/331380186.db2.gz	ZCNUXCVTPOUOQY-SSDOTTSWSA-N	0	0	292.688	4.055	20	30		CIEDRN
C=C[C@H](C)NC(=O)Nc1cc(C(F)(F)F)ccc1Cl	ZINC000465177909	331380194	/nfs/dbraw/zinc/38/01/94/331380194.db2.gz	ZCNUXCVTPOUOQY-ZETCQYMHSA-N	0	0	292.688	4.055	20	30		CIEDRN
C=C[C@@H](C)NC(=O)Nc1ccc(-c2ncc(C(C)C)o2)cc1	ZINC000465260901	331380908	/nfs/dbraw/zinc/38/09/08/331380908.db2.gz	VAGPLXWYLZHNPA-GFCCVEGCSA-N	0	0	299.374	4.161	20	30		CIEDRN
C=C[C@H](C)NC(=O)N[C@@H](c1cccs1)C(CC)CC	ZINC000465287315	331381341	/nfs/dbraw/zinc/38/13/41/331381341.db2.gz	CPGHCFVANYVZLX-SMDDNHRTSA-N	0	0	280.437	4.099	20	30		CIEDRN
C=CCCCCCN(C)C(=O)N[C@@H](C)C[C@H](C)CC	ZINC000466175267	331390656	/nfs/dbraw/zinc/39/06/56/331390656.db2.gz	YNZJPEDMWQDNSF-CABCVRRESA-N	0	0	268.445	4.199	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(OCCC(C)C)cc1	ZINC000465343528	331382450	/nfs/dbraw/zinc/38/24/50/331382450.db2.gz	PVPPGLVPRCVCHX-UHFFFAOYSA-N	0	0	261.365	4.016	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)C1(CC)CCCC1	ZINC000465451857	331383829	/nfs/dbraw/zinc/38/38/29/331383829.db2.gz	KDHGOLHVYKHVEY-UHFFFAOYSA-N	0	0	289.394	4.311	20	30		CIEDRN
C=CCOc1cccc(NC(=O)N[C@@H](C)C[C@H](C)CC)c1	ZINC000466172758	331390605	/nfs/dbraw/zinc/39/06/05/331390605.db2.gz	KUSMBERCLFOKLB-KGLIPLIRSA-N	0	0	290.407	4.198	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)N[C@H](C)C[C@H](C)CC	ZINC000466176051	331390662	/nfs/dbraw/zinc/39/06/62/331390662.db2.gz	ZWAKYCXKFGARCV-HZPDHXFCSA-N	0	0	288.435	4.209	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cn(CC(C)C)nc1C(F)F	ZINC000466232607	331391311	/nfs/dbraw/zinc/39/13/11/331391311.db2.gz	FAVVSUTZVWWAGW-NSHDSACASA-N	0	0	299.365	4.018	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1c(F)cc(Cl)c(C)c1F	ZINC000466243864	331391484	/nfs/dbraw/zinc/39/14/84/331391484.db2.gz	VUIFQWJLVPKUHU-QMMMGPOBSA-N	0	0	287.737	4.467	20	30		CIEDRN
CC#CCCCC(=O)Nc1ncc(C2CCCCC2)s1	ZINC000466235890	331391441	/nfs/dbraw/zinc/39/14/41/331391441.db2.gz	NTKKAIWJGUKMKX-UHFFFAOYSA-N	0	0	290.432	4.323	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](C#N)c1ccc(C(C)(C)C)cc1	ZINC000466240303	331391515	/nfs/dbraw/zinc/39/15/15/331391515.db2.gz	OUNYIHXHNKWHKC-PBHICJAKSA-N	0	0	298.430	4.267	20	30		CIEDRN
C=CCCC(=O)NC1(Cc2ccccc2)CCCCC1	ZINC000466250256	331391605	/nfs/dbraw/zinc/39/16/05/331391605.db2.gz	APONYPGWLILWOO-UHFFFAOYSA-N	0	0	271.404	4.014	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1c(C)oc2ccccc21	ZINC000466267066	331391903	/nfs/dbraw/zinc/39/19/03/331391903.db2.gz	XXXPNQUTSSLCTC-GFCCVEGCSA-N	0	0	271.360	4.216	20	30		CIEDRN
CC#CCCCC(=O)N(CC(C)(C)C)CC(C)(C)C	ZINC000466267710	331391932	/nfs/dbraw/zinc/39/19/32/331391932.db2.gz	ZPEWCWGQLQIQRR-UHFFFAOYSA-N	0	0	265.441	4.101	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC=C(c2ccc(CC)cc2)CC1	ZINC000466267157	331391954	/nfs/dbraw/zinc/39/19/54/331391954.db2.gz	WREARRPKLIQFCW-INIZCTEOSA-N	0	0	297.442	4.467	20	30		CIEDRN
CC#CCCCC(=O)N[C@H]1CC=C(c2ccc(F)cc2)CC1	ZINC000466270332	331392006	/nfs/dbraw/zinc/39/20/06/331392006.db2.gz	JUGYBVYMKGCQNK-SFHVURJKSA-N	0	0	299.389	4.071	20	30		CIEDRN
C=CCCC(=O)Nc1cc(Cl)c(OCC)c(Cl)c1	ZINC000466295202	331392310	/nfs/dbraw/zinc/39/23/10/331392310.db2.gz	CWIKIDMRTRTJDV-UHFFFAOYSA-N	0	0	288.174	4.297	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(CC(C)C)C(CC)CC	ZINC000466366565	331393189	/nfs/dbraw/zinc/39/31/89/331393189.db2.gz	JGJLJKHDDXWGHC-CQSZACIVSA-N	0	0	268.445	4.197	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N1CCC2(CCCCC2)CC1	ZINC000466366704	331393590	/nfs/dbraw/zinc/39/35/90/331393590.db2.gz	KTQDXXZLHGBWCH-OAHLLOKOSA-N	0	0	278.440	4.097	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(C)[C@H](C)c1ccc(C)cc1	ZINC000466367689	331393705	/nfs/dbraw/zinc/39/37/05/331393705.db2.gz	YJVBRWQXNSMUPM-ZBFHGGJFSA-N	0	0	274.408	4.052	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CCC[C@@H]1C1CCCCC1	ZINC000466385881	331393858	/nfs/dbraw/zinc/39/38/58/331393858.db2.gz	LAOZUUGEHWYQDB-JKSUJKDBSA-N	0	0	278.440	4.095	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(C)Cc1ccc(C(C)C)cc1	ZINC000466378295	331394014	/nfs/dbraw/zinc/39/40/14/331394014.db2.gz	KPWLHHKQLRDKIU-QGZVFWFLSA-N	0	0	288.435	4.306	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CCC[C@@H]1c1ccc(F)cc1	ZINC000466385020	331394276	/nfs/dbraw/zinc/39/42/76/331394276.db2.gz	YLSYANWQVUQGMQ-JKSUJKDBSA-N	0	0	290.382	4.027	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(CC)Cc1ccc(Cl)cc1	ZINC000466383344	331394306	/nfs/dbraw/zinc/39/43/06/331394306.db2.gz	PMWTWUPQYMKSRE-OAHLLOKOSA-N	0	0	294.826	4.226	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(C)[C@H](C)c1ccccc1Cl	ZINC000466387876	331394465	/nfs/dbraw/zinc/39/44/65/331394465.db2.gz	VYJQUOKBFKIESB-CHWSQXEVSA-N	0	0	294.826	4.397	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CC=C(c2cccc(C)c2)CC1	ZINC000466397497	331394897	/nfs/dbraw/zinc/39/48/97/331394897.db2.gz	FDELRFXOKIWPAM-SFHVURJKSA-N	0	0	298.430	4.148	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(CC)Cc1cccc(Cl)c1	ZINC000466400469	331395005	/nfs/dbraw/zinc/39/50/05/331395005.db2.gz	UKZNGYFSERORHT-HNNXBMFYSA-N	0	0	294.826	4.226	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NC(C)(C)c1cccc(Cl)c1	ZINC000466414466	331395843	/nfs/dbraw/zinc/39/58/43/331395843.db2.gz	APUSWQYDEVGGPU-LBPRGKRZSA-N	0	0	279.811	4.294	20	30		CIEDRN
CC#CCCCC(=O)N[C@H](CCC)CCc1ccccc1	ZINC000466420290	331396153	/nfs/dbraw/zinc/39/61/53/331396153.db2.gz	YZSAPFFTFQZISP-GOSISDBHSA-N	0	0	285.431	4.098	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H]1C[C@H]1c1c(F)cccc1Cl	ZINC000466421981	331396271	/nfs/dbraw/zinc/39/62/71/331396271.db2.gz	PDBJOOXHTCXBLD-WDMOLILDSA-N	0	0	295.785	4.054	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](c1ccc(F)cc1F)C(C)C	ZINC000466424606	331396509	/nfs/dbraw/zinc/39/65/09/331396509.db2.gz	IYTJOCUOGKLVDU-LRDDRELGSA-N	0	0	295.373	4.380	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](c2ccccc2)C(C)(C)C1	ZINC000466428134	331396820	/nfs/dbraw/zinc/39/68/20/331396820.db2.gz	ITUUKYCZLFANCE-WBVHZDCISA-N	0	0	285.431	4.241	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](c2ccccc2)C(C)(C)C1	ZINC000466428133	331396849	/nfs/dbraw/zinc/39/68/49/331396849.db2.gz	ITUUKYCZLFANCE-RDJZCZTQSA-N	0	0	285.431	4.241	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCc1ccc(C)cc1OCCC	ZINC000466433741	331396999	/nfs/dbraw/zinc/39/69/99/331396999.db2.gz	KDZCRCDSOMDRME-OAHLLOKOSA-N	0	0	289.419	4.002	20	30		CIEDRN
CC#CCCCC(=O)N1CC2(CCCC2)c2ccccc21	ZINC000466433547	331397049	/nfs/dbraw/zinc/39/70/49/331397049.db2.gz	IUVCVRLAJWRGIN-UHFFFAOYSA-N	0	0	281.399	4.039	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H]1CC(C)(C)c2ccccc21	ZINC000466437556	331397145	/nfs/dbraw/zinc/39/71/45/331397145.db2.gz	CUBNDCUCMFAZIP-BBRMVZONSA-N	0	0	271.404	4.128	20	30		CIEDRN
CC#CCCCC(=O)N(CC)[C@@H](CC)Cc1ccccc1	ZINC000466438151	331397152	/nfs/dbraw/zinc/39/71/52/331397152.db2.gz	JSPMMOPFCJPUCN-SFHVURJKSA-N	0	0	285.431	4.050	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@H]1CCCC[C@@H]1CC	ZINC000466441442	331397189	/nfs/dbraw/zinc/39/71/89/331397189.db2.gz	NTHLZMDWPIYPNH-KKUMJFAQSA-N	0	0	251.414	4.016	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(N2CC(C)(C)CC(C)(C)C2)c1	ZINC000466473335	331398006	/nfs/dbraw/zinc/39/80/06/331398006.db2.gz	KPTKQOVSEOAFOJ-UHFFFAOYSA-N	0	0	284.403	4.023	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccccc1NC(C)(C)C	ZINC000466499452	331398586	/nfs/dbraw/zinc/39/85/86/331398586.db2.gz	MVKOVGLZFALMHR-CYBMUJFWSA-N	0	0	274.408	4.438	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)C(c1ccccc1)c1ccccc1	ZINC000466528982	331399154	/nfs/dbraw/zinc/39/91/54/331399154.db2.gz	IUTPHCFJGAWPRR-GOSISDBHSA-N	0	0	293.410	4.289	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)C1(c2cccc(F)c2)CCCC1	ZINC000466530641	331399167	/nfs/dbraw/zinc/39/91/67/331399167.db2.gz	WBRGUQXCDGGMBR-INIZCTEOSA-N	0	0	289.394	4.108	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@@H](CCC)c1ccccc1	ZINC000466534000	331399285	/nfs/dbraw/zinc/39/92/85/331399285.db2.gz	LXMVDKHOZXDLDW-HOTGVXAUSA-N	0	0	259.393	4.041	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@H](CCC)c1ccccc1	ZINC000466534002	331399295	/nfs/dbraw/zinc/39/92/95/331399295.db2.gz	LXMVDKHOZXDLDW-JKSUJKDBSA-N	0	0	259.393	4.041	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)C(C)(C)c1cccc(Cl)c1	ZINC000466536525	331399394	/nfs/dbraw/zinc/39/93/94/331399394.db2.gz	PDSBMRGDWLAVDK-AWEZNQCLSA-N	0	0	279.811	4.089	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)C(C)(C)c1ccc(Cl)cc1F	ZINC000466537975	331399431	/nfs/dbraw/zinc/39/94/31/331399431.db2.gz	DNHVENUAEBMLCO-LBPRGKRZSA-N	0	0	297.801	4.228	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1sccc1-c1ccccc1	ZINC000466543144	331399575	/nfs/dbraw/zinc/39/95/75/331399575.db2.gz	SQFRJJUXRVRXHI-CQSZACIVSA-N	0	0	285.412	4.500	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1sc2ccc(F)cc2c1C	ZINC000466542479	331399634	/nfs/dbraw/zinc/39/96/34/331399634.db2.gz	RDRGTAQQOQZJMP-LBPRGKRZSA-N	0	0	291.391	4.433	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)C1(Cc2ccccc2Cl)CC1	ZINC000466545533	331399710	/nfs/dbraw/zinc/39/97/10/331399710.db2.gz	RMRILGVIDVDLGH-AWEZNQCLSA-N	0	0	291.822	4.134	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1ccc(C(F)(F)F)c(C)c1	ZINC000466582641	331400416	/nfs/dbraw/zinc/40/04/16/331400416.db2.gz	AERINJLWPXEFRX-UHFFFAOYSA-N	0	0	286.297	4.054	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1cccc(C(F)F)c1Cl	ZINC000466608937	331400538	/nfs/dbraw/zinc/40/05/38/331400538.db2.gz	QHBIXAOSGGGZBZ-UHFFFAOYSA-N	0	0	288.725	4.317	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cnn([C@@H](C)CC)c1C1CC1	ZINC000466643927	331401569	/nfs/dbraw/zinc/40/15/69/331401569.db2.gz	HBFHMFOUCSVKHG-STQMWFEESA-N	0	0	289.423	4.272	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@H](C)c1ccc(SC)cc1	ZINC000466677569	331402184	/nfs/dbraw/zinc/40/21/84/331402184.db2.gz	KBKSRTKWFCQIMM-WBMJQRKESA-N	0	0	277.433	4.188	20	30		CIEDRN
C[C@@H]1CCC[C@H]1CNC(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000466700784	331402589	/nfs/dbraw/zinc/40/25/89/331402589.db2.gz	VVSMCBBFPRHPHL-KGLIPLIRSA-N	0	0	299.418	4.045	20	30		CIEDRN
CC#CCCCC(=O)NC1(c2ccccc2)CCCCC1	ZINC000466861362	331406700	/nfs/dbraw/zinc/40/67/00/331406700.db2.gz	CQLZMRNQNMFLBX-UHFFFAOYSA-N	0	0	283.415	4.156	20	30		CIEDRN
C=CCCN(C)C(=O)N[C@@H](C)c1ccc(SCC)cc1	ZINC000467009753	331410328	/nfs/dbraw/zinc/41/03/28/331410328.db2.gz	UWIKLERSWMRZFQ-ZDUSSCGKSA-N	0	0	292.448	4.077	20	30		CIEDRN
C=CCCN(C)C(=O)N[C@@H](c1ccccc1Cl)C(C)C	ZINC000467015078	331410455	/nfs/dbraw/zinc/41/04/55/331410455.db2.gz	PVWYAJMEROKTDR-OAHLLOKOSA-N	0	0	294.826	4.255	20	30		CIEDRN
C=CCCN(C)C(=O)c1ccc(OC2CCCCC2)cc1	ZINC000467051955	331410651	/nfs/dbraw/zinc/41/06/51/331410651.db2.gz	UIEOFYUCATZNRN-UHFFFAOYSA-N	0	0	287.403	4.046	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H]1CCC[C@@H]1Cc1ccccc1	ZINC000467336243	331415322	/nfs/dbraw/zinc/41/53/22/331415322.db2.gz	OHABDGHWYMGOHD-RTBURBONSA-N	0	0	297.442	4.282	20	30		CIEDRN
C=CCC(CC=C)C(=O)NCCc1cccc2ccccc21	ZINC000467334191	331415340	/nfs/dbraw/zinc/41/53/40/331415340.db2.gz	VRDHKQYBCAZPOM-UHFFFAOYSA-N	0	0	293.410	4.267	20	30		CIEDRN
C=CCC(CC=C)C(=O)NC1(c2ccccc2)CCCC1	ZINC000467527538	331421158	/nfs/dbraw/zinc/42/11/58/331421158.db2.gz	NCFPURUKJVSHOU-UHFFFAOYSA-N	0	0	283.415	4.341	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(Cc1ccc(F)cc1)C1CC1	ZINC000467731296	331423361	/nfs/dbraw/zinc/42/33/61/331423361.db2.gz	BARBESCULXJZRW-UHFFFAOYSA-N	0	0	287.378	4.085	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@H](C)c2ccccc21	ZINC000467825775	331424303	/nfs/dbraw/zinc/42/43/03/331424303.db2.gz	HOVYGPMBWGROKK-AWEZNQCLSA-N	0	0	269.388	4.295	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCCC[C@H]1Cc1ccccc1	ZINC000467831437	331424317	/nfs/dbraw/zinc/42/43/17/331424317.db2.gz	JIBPGFDDMPLGBJ-IBGZPJMESA-N	0	0	297.442	4.379	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC)[C@@H]1CCCC[C@H]1C	ZINC000467823417	331424375	/nfs/dbraw/zinc/42/43/75/331424375.db2.gz	OODSKAWIOZEGLH-GDBMZVCRSA-N	0	0	263.425	4.182	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)[C@@H]1CCCC[C@H]1CC	ZINC000467861089	331424765	/nfs/dbraw/zinc/42/47/65/331424765.db2.gz	CSKRRYSPSZECAY-GDBMZVCRSA-N	0	0	263.425	4.182	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(C)c2ncccc12	ZINC000467868220	331424899	/nfs/dbraw/zinc/42/48/99/331424899.db2.gz	ZGFJIYKCWYRDIA-QGZVFWFLSA-N	0	0	268.360	4.084	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc2occ(C)c2c1	ZINC000467885162	331425126	/nfs/dbraw/zinc/42/51/26/331425126.db2.gz	CJYMNYBVAHBJQE-MRXNPFEDSA-N	0	0	257.333	4.282	20	30		CIEDRN
C=CCOc1ccccc1C(=O)Nc1ccc2ccoc2c1	ZINC000467898874	331425419	/nfs/dbraw/zinc/42/54/19/331425419.db2.gz	NHINOWRIWSAVRS-UHFFFAOYSA-N	0	0	293.322	4.250	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1C[C@H](c2ccccc2)C(C)(C)C1	ZINC000467969602	331426186	/nfs/dbraw/zinc/42/61/86/331426186.db2.gz	MJBZRWPAFJWVTL-VQIMIIECSA-N	0	0	285.431	4.241	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(C)c(OC(F)F)c1	ZINC000468002636	331426575	/nfs/dbraw/zinc/42/65/75/331426575.db2.gz	YGJARXYHJWVJFH-OAHLLOKOSA-N	0	0	283.318	4.137	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CCC[C@H]1Cc1ccc(C)cc1	ZINC000468004520	331426596	/nfs/dbraw/zinc/42/65/96/331426596.db2.gz	MEXJIOZQYNEUNE-PKOBYXMFSA-N	0	0	285.431	4.131	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)NCC1(c2cccc(Cl)c2)CC1	ZINC000468026225	331426806	/nfs/dbraw/zinc/42/68/06/331426806.db2.gz	SYHVGKFYJONKCX-INIZCTEOSA-N	0	0	291.822	4.090	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)NCC1(c2cccc(Cl)c2)CC1	ZINC000468026226	331426814	/nfs/dbraw/zinc/42/68/14/331426814.db2.gz	SYHVGKFYJONKCX-MRXNPFEDSA-N	0	0	291.822	4.090	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(OCC2CC2)cc1	ZINC000468027172	331427009	/nfs/dbraw/zinc/42/70/09/331427009.db2.gz	RKIJSGYUYDWWQL-KRWDZBQOSA-N	0	0	273.376	4.016	20	30		CIEDRN
C=CCCN(C)C(=O)Cc1cc2c(ccc3ccccc23)o1	ZINC000468177383	331429785	/nfs/dbraw/zinc/42/97/85/331429785.db2.gz	CBTVDWVCRIDCJJ-UHFFFAOYSA-N	0	0	293.366	4.163	20	30		CIEDRN
C=CCCN(C)C(=O)C(C)(c1ccccc1)c1ccccc1	ZINC000468187945	331429906	/nfs/dbraw/zinc/42/99/06/331429906.db2.gz	QBZLUMFLEITGEI-UHFFFAOYSA-N	0	0	293.410	4.027	20	30		CIEDRN
C=CCCC(=O)NCc1cccc(-c2ccc(C)cc2)c1	ZINC000468243978	331430684	/nfs/dbraw/zinc/43/06/84/331430684.db2.gz	WLYRTOWTYXQENA-UHFFFAOYSA-N	0	0	279.383	4.244	20	30		CIEDRN
C=CCCCNC(=O)c1ccc(Cl)cc1SCC	ZINC000468376931	331433175	/nfs/dbraw/zinc/43/31/75/331433175.db2.gz	JGWDZWIMQGHDPB-UHFFFAOYSA-N	0	0	283.824	4.148	20	30		CIEDRN
C=CCCCNC(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1Cl	ZINC000468393198	331433875	/nfs/dbraw/zinc/43/38/75/331433875.db2.gz	AUXNIFSYJFGONH-VXGBXAGGSA-N	0	0	298.213	4.179	20	30		CIEDRN
C[C@@H]1[C@@H](Nc2ccc(CC#N)cc2)C[C@@H]1c1ccccc1	ZINC000468474900	331435452	/nfs/dbraw/zinc/43/54/52/331435452.db2.gz	JAIDEAIQYIWYST-JVPBZIDWSA-N	0	0	276.383	4.357	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)C2C(C)(C)C2(C)C)cc1	ZINC000468511825	331436355	/nfs/dbraw/zinc/43/63/55/331436355.db2.gz	UVLMASYCDINJOW-UHFFFAOYSA-N	0	0	284.403	4.108	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccnn1[C@H](C)CC(C)C	ZINC000468684889	331438541	/nfs/dbraw/zinc/43/85/41/331438541.db2.gz	XHWYUDZYXHYBFZ-CQSZACIVSA-N	0	0	289.423	4.197	20	30		CIEDRN
Cc1ccc2oc(SCc3cc(F)ccc3C#N)nc2c1	ZINC000468817323	331440512	/nfs/dbraw/zinc/44/05/12/331440512.db2.gz	FFWNOBJEQAOXFT-UHFFFAOYSA-N	0	0	298.342	4.439	20	30		CIEDRN
CCCNc1ccc(C#N)cc1NC(=O)CC1=CCCCC1	ZINC000468946647	331442871	/nfs/dbraw/zinc/44/28/71/331442871.db2.gz	NGXUCDIVNAWJMP-UHFFFAOYSA-N	0	0	297.402	4.209	20	30		CIEDRN
C=C(C)CN(C)C(=O)CCC[C@@H](C)c1cccc(OC)c1	ZINC000469102776	331445797	/nfs/dbraw/zinc/44/57/97/331445797.db2.gz	UKIXZWIXSLSKDO-OAHLLOKOSA-N	0	0	289.419	4.004	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@H](C)c2cccc(O)c21	ZINC000469242205	331448223	/nfs/dbraw/zinc/44/82/23/331448223.db2.gz	HRBVYFUKOVDBSZ-ZDUSSCGKSA-N	0	0	285.387	4.001	20	30		CIEDRN
C=CCCCN(C)C(=O)[C@@H](C)Oc1cccc2ccccc21	ZINC000469457369	331451996	/nfs/dbraw/zinc/45/19/96/331451996.db2.gz	QZSDTLPGVQEJNN-OAHLLOKOSA-N	0	0	297.398	4.032	20	30		CIEDRN
C=C[C@@H](CC(=O)N[C@@H](C)CCC1CC1)c1ccccc1	ZINC000469801072	331460618	/nfs/dbraw/zinc/46/06/18/331460618.db2.gz	PFSBLMJESBABRO-HOCLYGCPSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cccc(C)c1Br	ZINC000470051375	331470452	/nfs/dbraw/zinc/47/04/52/331470452.db2.gz	QZOSBONLOHDZMB-LLVKDONJSA-N	0	0	296.208	4.298	20	30		CIEDRN
C=CC[C@H]1N(C(=O)c2ccc3cc[nH]c3c2)CCCC1(C)C	ZINC000470266208	331476954	/nfs/dbraw/zinc/47/69/54/331476954.db2.gz	JGFPGJCOTKUWAB-QGZVFWFLSA-N	0	0	296.414	4.375	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)[C@@H](C)c2cccs2)CCCC1(C)C	ZINC000470278035	331477572	/nfs/dbraw/zinc/47/75/72/331477572.db2.gz	CWOUFAARVZEOLM-ZFWWWQNUSA-N	0	0	291.460	4.445	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)c2ccc(C)s2)CCCC1(C)C	ZINC000470291219	331478221	/nfs/dbraw/zinc/47/82/21/331478221.db2.gz	FKMTXPZXUQVLGN-AWEZNQCLSA-N	0	0	277.433	4.263	20	30		CIEDRN
C=CC[C@H]1N(C(=O)C[C@@H](OCC)C(C)C)CCCC1(C)C	ZINC000470292755	331478345	/nfs/dbraw/zinc/47/83/45/331478345.db2.gz	LBAWHIMFCJHUDJ-HZPDHXFCSA-N	0	0	295.467	4.031	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](c2ccc(C)cc2)C[C@H]1C	ZINC000470563094	331485402	/nfs/dbraw/zinc/48/54/02/331485402.db2.gz	FYTFCCRMAAEQNP-JZXOWHBKSA-N	0	0	285.431	4.302	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)[C@H]1CC12CCCC2	ZINC000470640785	331486689	/nfs/dbraw/zinc/48/66/89/331486689.db2.gz	DJNGPXCYYZJRIK-QGZVFWFLSA-N	0	0	283.415	4.172	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)[C@@H](C)[C@H](C)CC	ZINC000470650011	331486978	/nfs/dbraw/zinc/48/69/78/331486978.db2.gz	ZGQXYHVGPSTBSG-CVEARBPZSA-N	0	0	273.420	4.274	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)[C@@H](C)c1cccc(C)c1	ZINC000471165702	331503102	/nfs/dbraw/zinc/50/31/02/331503102.db2.gz	PWBZJHJNVVJYCP-HNNXBMFYSA-N	0	0	286.419	4.029	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](c2ccc(C)cc2C)C1	ZINC000471319772	331506424	/nfs/dbraw/zinc/50/64/24/331506424.db2.gz	IUFKFWDGOPIMKJ-APWZRJJASA-N	0	0	285.431	4.222	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H]1CC[C@H](c2ccc(F)cc2)C1	ZINC000471541374	331510169	/nfs/dbraw/zinc/51/01/69/331510169.db2.gz	PZTNYAKJEQCJDL-QRTARXTBSA-N	0	0	289.394	4.180	20	30		CIEDRN
C=CCCCCNC(=O)Cc1c(Cl)cccc1Cl	ZINC000471664960	331514379	/nfs/dbraw/zinc/51/43/79/331514379.db2.gz	BLBIRMPNMRSTSR-UHFFFAOYSA-N	0	0	286.202	4.008	20	30		CIEDRN
C=CCCCCNC(=O)CC(C)(C)c1ccc(C)cc1	ZINC000471685603	331515427	/nfs/dbraw/zinc/51/54/27/331515427.db2.gz	PNTLSMVNIZUYJQ-UHFFFAOYSA-N	0	0	273.420	4.135	20	30		CIEDRN
C=CC1CCN(C(=O)[C@H](CC)CC2CCCC2)CC1	ZINC000510742773	332914805	/nfs/dbraw/zinc/91/48/05/332914805.db2.gz	IMFJKKZLMLQYMY-MRXNPFEDSA-N	0	0	263.425	4.018	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](C)CSc1ccc(C)cc1	ZINC000472250002	331533675	/nfs/dbraw/zinc/53/36/75/331533675.db2.gz	GMVDRGREWJTDQN-GJZGRUSLSA-N	0	0	291.460	4.194	20	30		CIEDRN
C=CCCCCNC(=O)N[C@H](C)c1cc(C)sc1C	ZINC000472768866	331542950	/nfs/dbraw/zinc/54/29/50/331542950.db2.gz	OIBSJGORVBOTDN-GFCCVEGCSA-N	0	0	280.437	4.081	20	30		CIEDRN
C=CCCCCNC(=O)N[C@H](C)c1ccccc1Cl	ZINC000472856304	331544689	/nfs/dbraw/zinc/54/46/89/331544689.db2.gz	WKAKRDSXGIXNCI-GFCCVEGCSA-N	0	0	280.799	4.057	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)NCCc1ccc2ccccc2c1	ZINC000473664537	331555054	/nfs/dbraw/zinc/55/50/54/331555054.db2.gz	YEDUXZYRMHUTQS-IBGZPJMESA-N	0	0	281.399	4.101	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N(C)CCC1CCCCC1	ZINC000473690403	331555781	/nfs/dbraw/zinc/55/57/81/331555781.db2.gz	CTYWPKPRAYMCQC-MRXNPFEDSA-N	0	0	251.414	4.018	20	30		CIEDRN
CC(C)(C)OCCCCSc1ccc(C#N)cc1F	ZINC000473782418	331557468	/nfs/dbraw/zinc/55/74/68/331557468.db2.gz	FYUJCSQCQHXDPT-UHFFFAOYSA-N	0	0	281.396	4.385	20	30		CIEDRN
Cc1ccnc(N[C@H](C)c2cc3cccc(F)c3o2)c1C#N	ZINC000473911376	331560333	/nfs/dbraw/zinc/56/03/33/331560333.db2.gz	HMRRCTSAWATWSP-LLVKDONJSA-N	0	0	295.317	4.320	20	30		CIEDRN
C=CCCCCNC(=O)Nc1c(C)cccc1SC	ZINC000473966613	331560872	/nfs/dbraw/zinc/56/08/72/331560872.db2.gz	CUYPYLRFNYIENF-UHFFFAOYSA-N	0	0	278.421	4.195	20	30		CIEDRN
C=CCC[C@H](C(=O)N[C@@H]1CC[C@H](C)C1)c1ccccc1	ZINC000474127715	331572599	/nfs/dbraw/zinc/57/25/99/331572599.db2.gz	WXTJKYMCQJOGHH-UAGQMJEPSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=C(C)CN(C)C(=O)CC(C)(C)Cc1ccc(Cl)cc1	ZINC000474156435	331573676	/nfs/dbraw/zinc/57/36/76/331573676.db2.gz	FRRIMDXPMUZZKI-UHFFFAOYSA-N	0	0	293.838	4.333	20	30		CIEDRN
N#CC[C@H](CC(=O)NCCC1=CCCCC1)c1ccccc1	ZINC000474288006	331579694	/nfs/dbraw/zinc/57/96/94/331579694.db2.gz	ABUCSQZPEKWCTE-GOSISDBHSA-N	0	0	296.414	4.081	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc2c(c1)O[C@@](C)(CC)O2	ZINC000474642843	331593356	/nfs/dbraw/zinc/59/33/56/331593356.db2.gz	YIABZTCGDHNCBI-PXAZEXFGSA-N	0	0	289.375	4.125	20	30		CIEDRN
C=CCCC1(C(=O)N[C@H](C)c2ccc(C)cc2C)CC1	ZINC000474698431	331594698	/nfs/dbraw/zinc/59/46/98/331594698.db2.gz	VQOJCDRVXCOZSB-OAHLLOKOSA-N	0	0	271.404	4.227	20	30		CIEDRN
C=C[C@H](CC(=O)N1C[C@H](C)C[C@@H](C)[C@H]1C)c1ccccc1	ZINC000474979419	331607851	/nfs/dbraw/zinc/60/78/51/331607851.db2.gz	XQNXQWMVROZVQM-QBPKDAKJSA-N	0	0	285.431	4.239	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC(C)C)CC(C)(C)C	ZINC000474985165	331608127	/nfs/dbraw/zinc/60/81/27/331608127.db2.gz	JRPJLNSLYQCJMS-UHFFFAOYSA-N	0	0	265.441	4.286	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1c(C)cccc1C	ZINC000475045602	331611268	/nfs/dbraw/zinc/61/12/68/331611268.db2.gz	HERUYCPIASKILH-UHFFFAOYSA-N	0	0	259.393	4.122	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](C)c1cc2cccc(F)c2o1	ZINC000475084187	331614101	/nfs/dbraw/zinc/61/41/01/331614101.db2.gz	MMXHQKSEYJSPPJ-NWDGAFQWSA-N	0	0	289.350	4.351	20	30		CIEDRN
C=CCN(Cc1cccc(C#N)c1)C(=O)[C@@H](C)CC(C)(C)C	ZINC000475338399	331627369	/nfs/dbraw/zinc/62/73/69/331627369.db2.gz	TWFXSLLNQZTFRN-HNNXBMFYSA-N	0	0	298.430	4.145	20	30		CIEDRN
CCC(CC)CN(CCC#N)C(=O)[C@@H](C)CC(C)(C)C	ZINC000475413515	331631367	/nfs/dbraw/zinc/63/13/67/331631367.db2.gz	QHFJNJOGINTNDU-AWEZNQCLSA-N	0	0	280.456	4.237	20	30		CIEDRN
Cc1cc(C(=O)N[C@](C)(C#N)CC(C)C)c(C)cc1Cl	ZINC000475469186	331632388	/nfs/dbraw/zinc/63/23/88/331632388.db2.gz	WNHHZEVEHSMXGY-INIZCTEOSA-N	0	0	292.810	4.015	20	30		CIEDRN
N#Cc1ccc(C(F)(F)F)c(N[C@@H]2CC=CCC2)c1	ZINC000475509687	331634776	/nfs/dbraw/zinc/63/47/76/331634776.db2.gz	SQUDBJFACATQKI-LLVKDONJSA-N	0	0	266.266	4.098	20	30		CIEDRN
C=CCCC1(C(=O)N(C)CCC2CCCCC2)CC1	ZINC000475536929	331636095	/nfs/dbraw/zinc/63/60/95/331636095.db2.gz	KXUIZVJAZUCAIA-UHFFFAOYSA-N	0	0	263.425	4.162	20	30		CIEDRN
CC[C@@H](NC(=O)C[C@@H](CC#N)c1ccccc1)C(C)(C)C	ZINC000475647627	331640256	/nfs/dbraw/zinc/64/02/56/331640256.db2.gz	FNPJJCGGTIZIPK-HZPDHXFCSA-N	0	0	286.419	4.015	20	30		CIEDRN
COc1cc(NCc2ccc(C#N)c(C)c2)c(C)cc1C	ZINC000475665114	331640725	/nfs/dbraw/zinc/64/07/25/331640725.db2.gz	CFFXIZDINCJZJG-UHFFFAOYSA-N	0	0	280.371	4.104	20	30		CIEDRN
C=C(C)[C@@H](NC(=O)CCC1CCC1)c1ccc(F)c(F)c1	ZINC000475674436	331641638	/nfs/dbraw/zinc/64/16/38/331641638.db2.gz	QHFKUWJTQZMUBS-QGZVFWFLSA-N	0	0	293.357	4.279	20	30		CIEDRN
C=C(C)[C@H](Nc1nccc(C)c1C#N)c1ccc(F)c(F)c1	ZINC000475727076	331643759	/nfs/dbraw/zinc/64/37/59/331643759.db2.gz	XGJCSCGFBFOSRP-INIZCTEOSA-N	0	0	299.324	4.269	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H](C)c1cc2cccc(F)c2o1	ZINC000475752165	331644821	/nfs/dbraw/zinc/64/48/21/331644821.db2.gz	YYZIJCCHMZBRLF-APPDUMDISA-N	0	0	289.350	4.351	20	30		CIEDRN
C[C@H](CC1CCCC1)C(=O)Nc1ccc(Cl)c(C#N)c1	ZINC000510940130	332921370	/nfs/dbraw/zinc/92/13/70/332921370.db2.gz	UVIDMUPKLZHLAK-LLVKDONJSA-N	0	0	290.794	4.367	20	30		CIEDRN
CCCC[C@H](S[C@@H](C)c1ccc(C#N)cc1)C(=O)OC	ZINC000475871314	331646592	/nfs/dbraw/zinc/64/65/92/331646592.db2.gz	VBPGILOBIVGSQH-WFASDCNBSA-N	0	0	291.416	4.084	20	30		CIEDRN
N#Cc1c(F)cccc1OCc1cccc(C(F)F)c1	ZINC000475899519	331648179	/nfs/dbraw/zinc/64/81/79/331648179.db2.gz	SGVZFLXNWTZDLZ-UHFFFAOYSA-N	0	0	277.245	4.214	20	30		CIEDRN
C=CCCC1(C(=O)N2CCC[C@](C)(c3ccccc3)C2)CC1	ZINC000476037984	331651726	/nfs/dbraw/zinc/65/17/26/331651726.db2.gz	BNDJHUSCLDYBAS-IBGZPJMESA-N	0	0	297.442	4.313	20	30		CIEDRN
C=CCCC1(C(=O)N2CCC[C@H](C(C)(C)C)CC2)CC1	ZINC000476066359	331651751	/nfs/dbraw/zinc/65/17/51/331651751.db2.gz	YAASEPNSEWOPBD-HNNXBMFYSA-N	0	0	277.452	4.408	20	30		CIEDRN
CC[C@@H]1CCCCCN1C(=O)C[C@H](CC#N)c1ccccc1	ZINC000476091021	331654671	/nfs/dbraw/zinc/65/46/71/331654671.db2.gz	NMOQBSFYSQVECV-ZWKOTPCHSA-N	0	0	298.430	4.255	20	30		CIEDRN
CC[C@@H]1CCC[C@H](NC(=O)c2ccc(C(C)(C)C#N)cc2)C1	ZINC000476095439	331654876	/nfs/dbraw/zinc/65/48/76/331654876.db2.gz	MBOADQZNIJZZMM-PBHICJAKSA-N	0	0	298.430	4.186	20	30		CIEDRN
CC[C@H](C)C[C@@H](C)NC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000476102640	331655061	/nfs/dbraw/zinc/65/50/61/331655061.db2.gz	YMPNFGCIQIUPRB-UONOGXRCSA-N	0	0	286.419	4.042	20	30		CIEDRN
CC[C@H](C)C[C@H](C)NC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000476102638	331655195	/nfs/dbraw/zinc/65/51/95/331655195.db2.gz	YMPNFGCIQIUPRB-KBPBESRZSA-N	0	0	286.419	4.042	20	30		CIEDRN
C[C@@H]1CCC[C@H](C)N(C(=O)c2ccc(C(C)(C)C#N)cc2)C1	ZINC000476110421	331655378	/nfs/dbraw/zinc/65/53/78/331655378.db2.gz	BUOMGAZEWFKDEK-CABCVRRESA-N	0	0	298.430	4.138	20	30		CIEDRN
C=CCCC1(C(=O)N2CC[C@@H](c3ccccc3)[C@@H]2C)CC1	ZINC000476280644	331659832	/nfs/dbraw/zinc/65/98/32/331659832.db2.gz	VXBUKTQGZHWBCT-DOTOQJQBSA-N	0	0	283.415	4.137	20	30		CIEDRN
C=CCCC1(C(=O)Nc2nc3cc(C)ccc3n2CC)CC1	ZINC000476592476	331666730	/nfs/dbraw/zinc/66/67/30/331666730.db2.gz	DXKHKMBUIJXWSX-UHFFFAOYSA-N	0	0	297.402	4.050	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)[C@@H]1CCCC[C@@H]1CC	ZINC000476624339	331667420	/nfs/dbraw/zinc/66/74/20/331667420.db2.gz	ATUQSAHSCHTSPX-DOTOQJQBSA-N	0	0	289.419	4.053	20	30		CIEDRN
C=CCCC1(C(=O)N[C@H]2CC[C@H](Cc3ccccc3)C2)CC1	ZINC000476927048	331671120	/nfs/dbraw/zinc/67/11/20/331671120.db2.gz	VXOIZHWTFOXBKI-MSOLQXFVSA-N	0	0	297.442	4.260	20	30		CIEDRN
C=CCCCC(=O)Nc1nc(-c2cccc(F)c2)cs1	ZINC000476936348	331671300	/nfs/dbraw/zinc/67/13/00/331671300.db2.gz	GGMACLIGRFNAJB-UHFFFAOYSA-N	0	0	290.363	4.244	20	30		CIEDRN
C=CCCC1(C(=O)N(C)Cc2ccc(F)c(Cl)c2)CC1	ZINC000477093258	331676244	/nfs/dbraw/zinc/67/62/44/331676244.db2.gz	WCTYPYLONWBTQZ-UHFFFAOYSA-N	0	0	295.785	4.184	20	30		CIEDRN
C=CCCC1(C(=O)N2CC[C@H](c3ccc(C)cc3C)C2)CC1	ZINC000477141125	331677525	/nfs/dbraw/zinc/67/75/25/331677525.db2.gz	UHQHHJZKUMEQFD-KRWDZBQOSA-N	0	0	297.442	4.366	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H]2CC[C@H]3CCCC[C@H]3C2)CCC1	ZINC000477890839	331692834	/nfs/dbraw/zinc/69/28/34/331692834.db2.gz	JBXTXETXVHWYOZ-OWCLPIDISA-N	0	0	275.436	4.208	20	30		CIEDRN
C=CCC1(C(=O)NCc2cccc3ccccc32)CCC1	ZINC000478081278	331697356	/nfs/dbraw/zinc/69/73/56/331697356.db2.gz	HXOVWPZKVSLMHD-UHFFFAOYSA-N	0	0	279.383	4.202	20	30		CIEDRN
COc1ccc(C#N)cc1CNc1ccc(C2CC2)c(C)c1	ZINC000478315225	331703828	/nfs/dbraw/zinc/70/38/28/331703828.db2.gz	QMHQHVJHDQZVEY-UHFFFAOYSA-N	0	0	292.382	4.365	20	30		CIEDRN
Cc1c(C#N)cccc1NCc1ccc(Cl)cc1C#N	ZINC000478339414	331704402	/nfs/dbraw/zinc/70/44/02/331704402.db2.gz	LVDGQCQRXDJGTO-UHFFFAOYSA-N	0	0	281.746	4.004	20	30		CIEDRN
N#Cc1cc(Cl)ccc1CNc1cccc(Cl)c1	ZINC000478376104	331704986	/nfs/dbraw/zinc/70/49/86/331704986.db2.gz	JXDADKPNBFKYBL-UHFFFAOYSA-N	0	0	277.154	4.477	20	30		CIEDRN
COc1ccc(CNc2cccc(C#N)c2C)cc1Cl	ZINC000478647725	331711068	/nfs/dbraw/zinc/71/10/68/331711068.db2.gz	KHFKDSOCYOVDNB-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
CCC(=O)c1ccc(O[C@H](C)c2ccc(C#N)cc2)c(F)c1	ZINC000478794303	331714116	/nfs/dbraw/zinc/71/41/16/331714116.db2.gz	FVFUQSNUNSTTQO-GFCCVEGCSA-N	0	0	297.329	4.430	20	30		CIEDRN
C=CCOCCCOc1cccc(-c2nc(C)cs2)c1	ZINC000478798532	331714470	/nfs/dbraw/zinc/71/44/70/331714470.db2.gz	QBEWKRBHULQYOW-UHFFFAOYSA-N	0	0	289.400	4.090	20	30		CIEDRN
Cc1[nH]c2ccc(OCc3ccc(C#N)cc3F)cc2c1C	ZINC000478834015	331715106	/nfs/dbraw/zinc/71/51/06/331715106.db2.gz	UKDHDQULIVEMHZ-UHFFFAOYSA-N	0	0	294.329	4.375	20	30		CIEDRN
N#Cc1cc(Cl)ccc1COc1cccc2cccnc21	ZINC000478929625	331717643	/nfs/dbraw/zinc/71/76/43/331717643.db2.gz	QAGAOKCASNLXIJ-UHFFFAOYSA-N	0	0	294.741	4.339	20	30		CIEDRN
C=CCC1(C(=O)N2CCC[C@@H](C(C)(C)C)CC2)CCC1	ZINC000479089532	331720155	/nfs/dbraw/zinc/72/01/55/331720155.db2.gz	JCEXVZSKIYWGNG-OAHLLOKOSA-N	0	0	277.452	4.408	20	30		CIEDRN
C=CCn1c(SCCC2CC2)nnc1-c1ccccc1C	ZINC000479132037	331720760	/nfs/dbraw/zinc/72/07/60/331720760.db2.gz	ORUZFLYYXSIFPN-UHFFFAOYSA-N	0	0	299.443	4.332	20	30		CIEDRN
C=CCCCC(=O)N[C@H](CC)c1cccc(Cl)c1	ZINC000479500044	331733366	/nfs/dbraw/zinc/73/33/66/331733366.db2.gz	GXLHLKYQURIOQC-CQSZACIVSA-N	0	0	265.784	4.264	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](CC(C)C)c1ccccc1	ZINC000479505967	331733859	/nfs/dbraw/zinc/73/38/59/331733859.db2.gz	VFQUIHJMAOUXJE-INIZCTEOSA-N	0	0	259.393	4.246	20	30		CIEDRN
N#Cc1ccc(CSCc2cccc(F)c2)cc1F	ZINC000479517634	331734579	/nfs/dbraw/zinc/73/45/79/331734579.db2.gz	PSIOSIDLPSPDEL-UHFFFAOYSA-N	0	0	275.323	4.270	20	30		CIEDRN
CC1=CCC[C@H](C)[C@H]1CNc1ccc(CC#N)cc1	ZINC000479540763	331736060	/nfs/dbraw/zinc/73/60/60/331736060.db2.gz	LTRFFRBMUMALEW-YOEHRIQHSA-N	0	0	254.377	4.157	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](C)c1ccccc1C(F)(F)F	ZINC000479547663	331736733	/nfs/dbraw/zinc/73/67/33/331736733.db2.gz	BLOQGGXKBTXPOX-NSHDSACASA-N	0	0	285.309	4.239	20	30		CIEDRN
C=CCCCC(=O)NCCCc1cccc(C(F)(F)F)c1	ZINC000479555735	331737264	/nfs/dbraw/zinc/73/72/64/331737264.db2.gz	UBIOJAGIHAIVLN-UHFFFAOYSA-N	0	0	299.336	4.111	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](CC)c1ccc(Cl)s1	ZINC000479613170	331738619	/nfs/dbraw/zinc/73/86/19/331738619.db2.gz	YWHLPDAJEDNUMN-JTQLQIEISA-N	0	0	271.813	4.325	20	30		CIEDRN
C=CCOCCCSCc1nc(C(C)(C)C)cs1	ZINC000479588994	331739357	/nfs/dbraw/zinc/73/93/57/331739357.db2.gz	XSHNCXSEZRDIAD-UHFFFAOYSA-N	0	0	285.478	4.267	20	30		CIEDRN
C=CCCCC(=O)N(Cc1ccc(C)c(C)c1)C1CC1	ZINC000479601441	331739953	/nfs/dbraw/zinc/73/99/53/331739953.db2.gz	MGBJHPXZFCGUDG-UHFFFAOYSA-N	0	0	271.404	4.151	20	30		CIEDRN
C=CCOCCCSc1ncc(Cl)cc1Cl	ZINC000479605520	331740380	/nfs/dbraw/zinc/74/03/80/331740380.db2.gz	WKXPIWJSXWHXNW-UHFFFAOYSA-N	0	0	278.204	4.073	20	30		CIEDRN
C=CCOCCCS[C@@H](C)c1cc(F)ccc1F	ZINC000479606661	331740422	/nfs/dbraw/zinc/74/04/22/331740422.db2.gz	YWMMJJZXMULLBQ-NSHDSACASA-N	0	0	272.360	4.352	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1ccoc1C(C)C	ZINC000480093337	331757800	/nfs/dbraw/zinc/75/78/00/331757800.db2.gz	NYPJPUMUNZFKNM-UHFFFAOYSA-N	0	0	263.381	4.221	20	30		CIEDRN
C=CCOc1ccccc1CNc1cc2c[nH]nc2cc1C	ZINC000480443537	331772854	/nfs/dbraw/zinc/77/28/54/331772854.db2.gz	JMCDJEDCWIEJQY-UHFFFAOYSA-N	0	0	293.370	4.048	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H]2CC[C@H](Cc3ccccc3)C2)CCC1	ZINC000480531122	331776292	/nfs/dbraw/zinc/77/62/92/331776292.db2.gz	SBYYZLBAWQEOMK-QZTJIDSGSA-N	0	0	297.442	4.260	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccccc1NCCC	ZINC000480541698	331776811	/nfs/dbraw/zinc/77/68/11/331776811.db2.gz	QEJFTIMDKWZCFQ-CYBMUJFWSA-N	0	0	260.381	4.049	20	30		CIEDRN
C=CCCCC(=O)N1CC[C@@H](C)Sc2ccccc21	ZINC000480559025	331777683	/nfs/dbraw/zinc/77/76/83/331777683.db2.gz	SIWASEBTJCXBST-CYBMUJFWSA-N	0	0	275.417	4.260	20	30		CIEDRN
C=CCCCC(=O)NC(C)(C)c1cccc(Cl)c1	ZINC000480843764	331789700	/nfs/dbraw/zinc/78/97/00/331789700.db2.gz	PSWJRSPNAUEYNC-UHFFFAOYSA-N	0	0	265.784	4.048	20	30		CIEDRN
C=CCCCC(=O)N(C1CC1)[C@@H]1CCCc2ccccc21	ZINC000480891591	331790795	/nfs/dbraw/zinc/79/07/95/331790795.db2.gz	WJTUHUGWXKEURI-GOSISDBHSA-N	0	0	283.415	4.411	20	30		CIEDRN
C[C@@H](CC#N)NC(=O)Nc1ccc2c(c1)C(C)(C)CC2(C)C	ZINC000480900675	331790970	/nfs/dbraw/zinc/79/09/70/331790970.db2.gz	RYUNCXJTHGQOHW-LBPRGKRZSA-N	0	0	299.418	4.069	20	30		CIEDRN
N#Cc1cc(Cl)ccc1NCCc1c(F)cccc1F	ZINC000511454251	332932302	/nfs/dbraw/zinc/93/23/02/332932302.db2.gz	NIUTUHSRVNHAIZ-UHFFFAOYSA-N	0	0	292.716	4.144	20	30		CIEDRN
C=CCCCC(=O)N[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000481154345	331799275	/nfs/dbraw/zinc/79/92/75/331799275.db2.gz	LROOIHSAWSQEHJ-IAGOWNOFSA-N	0	0	271.404	4.185	20	30		CIEDRN
C=CCCCC(=O)N[C@@H]1CCCC[C@H]1c1ccccc1	ZINC000481154344	331799313	/nfs/dbraw/zinc/79/93/13/331799313.db2.gz	LROOIHSAWSQEHJ-DLBZAZTESA-N	0	0	271.404	4.185	20	30		CIEDRN
C=CCn1c(S[C@H](C)CC)nnc1-c1cccs1	ZINC000481401873	331806026	/nfs/dbraw/zinc/80/60/26/331806026.db2.gz	LPVSQALSKKRLLP-SNVBAGLBSA-N	0	0	279.434	4.083	20	30		CIEDRN
C=CCc1ccccc1OCc1cc(-c2ccco2)on1	ZINC000511446649	332932314	/nfs/dbraw/zinc/93/23/14/332932314.db2.gz	QOEIULNFFUPAFD-UHFFFAOYSA-N	0	0	281.311	4.242	20	30		CIEDRN
C=CCCCC(=O)N1CCCc2cc(Cl)cc(F)c21	ZINC000481468775	331807489	/nfs/dbraw/zinc/80/74/89/331807489.db2.gz	YHWWTNXCOGZUGU-UHFFFAOYSA-N	0	0	281.758	4.115	20	30		CIEDRN
CCCCN(CCCC)C(=O)Nc1ccc(F)c(C#N)c1	ZINC000481629272	331810585	/nfs/dbraw/zinc/81/05/85/331810585.db2.gz	UHKRHZXIVZCMMS-UHFFFAOYSA-N	0	0	291.370	4.131	20	30		CIEDRN
C=CCCCC(=O)Nc1cnn(CCCC)c1C(C)C	ZINC000482734600	331844935	/nfs/dbraw/zinc/84/49/35/331844935.db2.gz	OZOTUOCSLDIHFN-UHFFFAOYSA-N	0	0	277.412	4.101	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H]1CC(C)(C)c2ccccc21	ZINC000482731450	331844978	/nfs/dbraw/zinc/84/49/78/331844978.db2.gz	IXTSFNWNWLWJHE-OAHLLOKOSA-N	0	0	271.404	4.128	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)c1sccc1C	ZINC000482757964	331845655	/nfs/dbraw/zinc/84/56/55/331845655.db2.gz	BAZKHNMWQZPQQJ-UHFFFAOYSA-N	0	0	277.433	4.265	20	30		CIEDRN
C=CCN(C(=O)c1coc2cc(F)ccc21)c1ccccc1	ZINC000483201713	331862720	/nfs/dbraw/zinc/86/27/20/331862720.db2.gz	OLVNPUQRTXUCCZ-UHFFFAOYSA-N	0	0	295.313	4.405	20	30		CIEDRN
C=CCCC1(C(=O)Nc2sc(C)c(CC)c2C#N)CC1	ZINC000483458969	331875030	/nfs/dbraw/zinc/87/50/30/331875030.db2.gz	ZNLSTGSTTLMINT-UHFFFAOYSA-N	0	0	288.416	4.176	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@H]1CC2CCC1CC2)c1ccccc1	ZINC000483460917	331876478	/nfs/dbraw/zinc/87/64/78/331876478.db2.gz	RIGLOGCCSRFINH-SYNTWQANSA-N	0	0	283.415	4.041	20	30		CIEDRN
CCN(C[C@@H](C)C#N)C(=O)c1sccc1-c1ccccc1	ZINC000483607726	331879406	/nfs/dbraw/zinc/87/94/06/331879406.db2.gz	PKCSQTYUFNVNLL-ZDUSSCGKSA-N	0	0	298.411	4.037	20	30		CIEDRN
CCCN(CC#N)Cc1cc(-c2ccccc2)ccc1OC	ZINC000511473355	332932665	/nfs/dbraw/zinc/93/26/65/332932665.db2.gz	NTQNANWKYXVUHL-UHFFFAOYSA-N	0	0	294.398	4.098	20	30		CIEDRN
CC[C@H]1CCCC[C@@H]1C(=O)Nc1ccc(C#N)cc1Cl	ZINC000483874255	331888257	/nfs/dbraw/zinc/88/82/57/331888257.db2.gz	VBAVWPMSUYCCGG-STQMWFEESA-N	0	0	290.794	4.367	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)[C@@H](C)CC(C)(C)C	ZINC000484321028	331896883	/nfs/dbraw/zinc/89/68/83/331896883.db2.gz	JQGFQVJDFLVTAY-ZDUSSCGKSA-N	0	0	266.429	4.037	20	30		CIEDRN
CN(C(=O)[C@H]1CCCC1(C)C)c1cc(Cl)ccc1C#N	ZINC000484321069	331896941	/nfs/dbraw/zinc/89/69/41/331896941.db2.gz	KGBBCTWBHHHUTQ-CYBMUJFWSA-N	0	0	290.794	4.001	20	30		CIEDRN
CC(C)c1ccc(/C=C\CC(=O)N[C@@]2(C#N)CC2(C)C)cc1	ZINC000484898850	331906875	/nfs/dbraw/zinc/90/68/75/331906875.db2.gz	GEFOBPRYXNVDOA-SFFCAUCYSA-N	0	0	296.414	4.022	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1cnn([C@H](C)CC)c1C	ZINC000485330137	331911807	/nfs/dbraw/zinc/91/18/07/331911807.db2.gz	KWNPWAHFUQHATN-QWHCGFSZSA-N	0	0	292.427	4.029	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N(C)C[C@H](C)CC	ZINC000485464950	331914994	/nfs/dbraw/zinc/91/49/94/331914994.db2.gz	JKXGUGPHXPJJIK-CYBMUJFWSA-N	0	0	277.433	4.083	20	30		CIEDRN
C=CCC1(C(=O)N2CCC[C@H]2Cc2ccc(C)cc2)CCC1	ZINC000485523690	331916127	/nfs/dbraw/zinc/91/61/27/331916127.db2.gz	QTYJUKXQTXXMGJ-SFHVURJKSA-N	0	0	297.442	4.275	20	30		CIEDRN
Cc1cc(CSC[C@@H](C)C(F)(F)F)ccc1C#N	ZINC000485580340	331917719	/nfs/dbraw/zinc/91/77/19/331917719.db2.gz	GWVZFXJJMXGIFM-SNVBAGLBSA-N	0	0	273.323	4.298	20	30		CIEDRN
C=CCCCCCSCC(=O)N[C@H](C)c1cccs1	ZINC000485590146	331918234	/nfs/dbraw/zinc/91/82/34/331918234.db2.gz	OYTUSIPGAUZAKX-CYBMUJFWSA-N	0	0	297.489	4.405	20	30		CIEDRN
CC(C)(C)[C@@](C)(C#N)NC(=O)c1ccc(C2CCC2)cc1	ZINC000485642669	331919525	/nfs/dbraw/zinc/91/95/25/331919525.db2.gz	KMTMEVCDKCEESK-GOSISDBHSA-N	0	0	284.403	4.012	20	30		CIEDRN
C=CCC1(C(=O)Nc2cc(F)cc(Cl)c2)CCC1	ZINC000485731448	331922778	/nfs/dbraw/zinc/92/27/78/331922778.db2.gz	MZEQRCGMYOBWDC-UHFFFAOYSA-N	0	0	267.731	4.164	20	30		CIEDRN
CCOc1c(Cl)cccc1CNc1cccc(C#N)c1	ZINC000485976453	331928380	/nfs/dbraw/zinc/92/83/80/331928380.db2.gz	RIKXMJGQLGFXCQ-UHFFFAOYSA-N	0	0	286.762	4.222	20	30		CIEDRN
N#Cc1cccnc1/C=C\c1ccc2ccccc2c1	ZINC000486049317	331930003	/nfs/dbraw/zinc/93/00/03/331930003.db2.gz	BYZIYFGFVOJGBY-NTMALXAHSA-N	0	0	256.308	4.277	20	30		CIEDRN
CC(C)(Sc1ccc(C#N)cc1[N+](=O)[O-])c1ccccc1	ZINC000486460192	331937610	/nfs/dbraw/zinc/93/76/10/331937610.db2.gz	AYGCFMZKAUOVKU-UHFFFAOYSA-N	0	0	298.367	4.494	20	30		CIEDRN
CCCCc1nc(COc2ccc(C#N)cc2F)cs1	ZINC000486687925	331941855	/nfs/dbraw/zinc/94/18/55/331941855.db2.gz	XUJUJSKVERPOPQ-UHFFFAOYSA-N	0	0	290.363	4.075	20	30		CIEDRN
CC(C)(C)[C@@H]1C[C@H](Nc2ccc(C#N)c(Cl)c2)CCO1	ZINC000487062479	331955789	/nfs/dbraw/zinc/95/57/89/331955789.db2.gz	QHVMVRRXBUJAJR-HIFRSBDPSA-N	0	0	292.810	4.217	20	30		CIEDRN
CC(C)(C)[C@@H]1C[C@H](Nc2ccc(Cl)cc2C#N)CCO1	ZINC000487114207	331956542	/nfs/dbraw/zinc/95/65/42/331956542.db2.gz	YKJPMXQACBNUTB-HIFRSBDPSA-N	0	0	292.810	4.217	20	30		CIEDRN
CC[C@@H](C)N(Cc1ccccc1)C(=O)c1ccc(C#N)s1	ZINC000487224951	331960030	/nfs/dbraw/zinc/96/00/30/331960030.db2.gz	DPMPBHVJBUMTIK-CYBMUJFWSA-N	0	0	298.411	4.061	20	30		CIEDRN
CC(C)c1nc(CSc2ccc(C#N)cc2)cs1	ZINC000511722621	332940741	/nfs/dbraw/zinc/94/07/41/332940741.db2.gz	WRIXZUOXUKCGOO-UHFFFAOYSA-N	0	0	274.414	4.430	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1cc(C)c(F)cc1Cl	ZINC000487425772	331969703	/nfs/dbraw/zinc/96/97/03/331969703.db2.gz	DYNLOVKPXMJKMC-LLVKDONJSA-N	0	0	296.773	4.360	20	30		CIEDRN
C=CC[C@H](C(=O)NCc1ccc(C)c(F)c1)c1ccccc1	ZINC000487754649	331980567	/nfs/dbraw/zinc/98/05/67/331980567.db2.gz	CZLLGAQJXWVLHJ-KRWDZBQOSA-N	0	0	297.373	4.110	20	30		CIEDRN
Cc1nc(N2CCC[C@H]2c2ccccc2Cl)ccc1C#N	ZINC000488066554	331988724	/nfs/dbraw/zinc/98/87/24/331988724.db2.gz	PCGWJYSLXDVMQC-INIZCTEOSA-N	0	0	297.789	4.257	20	30		CIEDRN
COc1cccc(CSCc2cccc(F)c2C#N)c1	ZINC000488234668	331995226	/nfs/dbraw/zinc/99/52/26/331995226.db2.gz	SABPOXRTPTUQLL-UHFFFAOYSA-N	0	0	287.359	4.139	20	30		CIEDRN
CC[C@@H](CC1CCCCC1)C(=O)NCc1ccc(C#N)cc1	ZINC000303589629	332940309	/nfs/dbraw/zinc/94/03/09/332940309.db2.gz	UPTHGIYVXPEQTH-SFHVURJKSA-N	0	0	298.430	4.171	20	30		CIEDRN
CCC[C@H](C(=O)Nc1cc(C#N)cn1C(C)(C)C)C(C)C	ZINC000488329210	332000039	/nfs/dbraw/zinc/00/00/39/332000039.db2.gz	WDWGNWSJBBQMKV-AWEZNQCLSA-N	0	0	289.423	4.126	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@H]1C[C@@H]1c1ccccc1)c1ccccc1	ZINC000488373978	332002774	/nfs/dbraw/zinc/00/27/74/332002774.db2.gz	XPZXRFQCNLRHKZ-OTWHNJEPSA-N	0	0	291.394	4.019	20	30		CIEDRN
C=CCOc1cccc(NC(=O)[C@@H](C)CC2CCCC2)c1	ZINC000303540749	332936940	/nfs/dbraw/zinc/93/69/40/332936940.db2.gz	JPOCRZPAEJOFSD-AWEZNQCLSA-N	0	0	287.403	4.406	20	30		CIEDRN
C=CCOc1cccc(NC(=O)[C@H](C)CC2CCCC2)c1	ZINC000303540751	332936989	/nfs/dbraw/zinc/93/69/89/332936989.db2.gz	JPOCRZPAEJOFSD-CQSZACIVSA-N	0	0	287.403	4.406	20	30		CIEDRN
C=C(C)CNC(=O)N1CCC[C@@H]1c1ccc(C(C)C)cc1	ZINC000488547040	332016640	/nfs/dbraw/zinc/01/66/40/332016640.db2.gz	IAWVJRDVIZACFR-QGZVFWFLSA-N	0	0	286.419	4.233	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1ccc(OCCC)cc1	ZINC000488557599	332017241	/nfs/dbraw/zinc/01/72/41/332017241.db2.gz	LLYMWZZEPNMQAJ-OAHLLOKOSA-N	0	0	288.391	4.048	20	30		CIEDRN
C=C(C)CNC(=O)N1CCC[C@H]1c1cccc2ccccc21	ZINC000488566151	332017727	/nfs/dbraw/zinc/01/77/27/332017727.db2.gz	UDGHMDWFLMTXCB-SFHVURJKSA-N	0	0	294.398	4.262	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1ccc(C)c(CC)c1	ZINC000488567725	332018034	/nfs/dbraw/zinc/01/80/34/332018034.db2.gz	ZHRGUKLHXFVKOD-INIZCTEOSA-N	0	0	272.392	4.130	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1ccc(-c2ccc[nH]2)cc1	ZINC000488597448	332020029	/nfs/dbraw/zinc/02/00/29/332020029.db2.gz	PAIUBFHWNVZZQP-MRXNPFEDSA-N	0	0	295.386	4.254	20	30		CIEDRN
C=CCC[C@H](C(=O)NCCC(C)(C)C)c1ccccc1	ZINC000488607112	332020138	/nfs/dbraw/zinc/02/01/38/332020138.db2.gz	HQBRZOICXHMNGI-INIZCTEOSA-N	0	0	273.420	4.289	20	30		CIEDRN
C=CCC[C@H](C(=O)NCC1CCCC1)c1ccccc1	ZINC000488614129	332020199	/nfs/dbraw/zinc/02/01/99/332020199.db2.gz	YEUNPJCUMSOUBS-KRWDZBQOSA-N	0	0	271.404	4.043	20	30		CIEDRN
C=CC[C@H](C(=O)NCc1sccc1C)c1ccccc1	ZINC000488689390	332021701	/nfs/dbraw/zinc/02/17/01/332021701.db2.gz	AFTNHUYZEMWLML-HNNXBMFYSA-N	0	0	285.412	4.033	20	30		CIEDRN
C=CCC[C@H](C(=O)NCc1sccc1C)c1ccccc1	ZINC000488693782	332021901	/nfs/dbraw/zinc/02/19/01/332021901.db2.gz	NIRQUVJSZYQVMF-INIZCTEOSA-N	0	0	299.439	4.423	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1cccc(F)c1F)c1ccccc1	ZINC000488710616	332022297	/nfs/dbraw/zinc/02/22/97/332022297.db2.gz	FPWNOBHDRSXTSA-ZDUSSCGKSA-N	0	0	287.309	4.263	20	30		CIEDRN
C=CCN(C(=O)[C@H](C)SCCCC)c1ccccc1	ZINC000511629205	332937416	/nfs/dbraw/zinc/93/74/16/332937416.db2.gz	NWTHOSNAHNTXLN-AWEZNQCLSA-N	0	0	277.433	4.127	20	30		CIEDRN
C=CCSCCCOc1cccc(C(F)(F)F)c1	ZINC000524458542	333362459	/nfs/dbraw/zinc/36/24/59/333362459.db2.gz	KWQXXPFTGGYDFI-UHFFFAOYSA-N	0	0	276.323	4.394	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1ccc(-c2ccccc2F)o1	ZINC000488844361	332028946	/nfs/dbraw/zinc/02/89/46/332028946.db2.gz	OHUONRKREJWQRR-CYBMUJFWSA-N	0	0	299.345	4.266	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)CC(C)(C)c1ccc(C)cc1	ZINC000488847799	332029159	/nfs/dbraw/zinc/02/91/59/332029159.db2.gz	ACQGOWYQDBZEAS-KRWDZBQOSA-N	0	0	285.431	4.230	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1cc(CCC)c(C)s1	ZINC000488852879	332029523	/nfs/dbraw/zinc/02/95/23/332029523.db2.gz	KJXAQYWMYAREBV-CQSZACIVSA-N	0	0	277.433	4.190	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1csc2c1CC[C@@H](C)C2	ZINC000488854697	332029595	/nfs/dbraw/zinc/02/95/95/332029595.db2.gz	NQXCNFUDAQHTPR-CHWSQXEVSA-N	0	0	289.444	4.054	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1cc2ccccc2s1	ZINC000488870437	332030486	/nfs/dbraw/zinc/03/04/86/332030486.db2.gz	OERDKLBTRSHMIC-ZDUSSCGKSA-N	0	0	271.385	4.082	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1ccc(O[C@H](C)CC)cc1	ZINC000488871242	332030562	/nfs/dbraw/zinc/03/05/62/332030562.db2.gz	FAZSNOMDAULBTP-GDBMZVCRSA-N	0	0	287.403	4.045	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)C[C@H](C)c1c[nH]c2ccccc21	ZINC000488875875	332031167	/nfs/dbraw/zinc/03/11/67/332031167.db2.gz	GZLRBBRWEKKQKJ-LSDHHAIUSA-N	0	0	296.414	4.229	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)CCC(C)(C)c1ccccc1	ZINC000488881902	332031902	/nfs/dbraw/zinc/03/19/02/332031902.db2.gz	WNXPYNHQXXXYPO-QGZVFWFLSA-N	0	0	285.431	4.312	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@H]1CCc2ccc(C(C)C)cc21	ZINC000488914389	332033627	/nfs/dbraw/zinc/03/36/27/332033627.db2.gz	JJSWPZTVNAATLF-GUYCJALGSA-N	0	0	286.419	4.061	20	30		CIEDRN
C=CC[C@H](C)NC(=O)C[C@@H]1C[C@@H](C)c2c1cccc2C	ZINC000488930008	332034150	/nfs/dbraw/zinc/03/41/50/332034150.db2.gz	DWGDDLZCSIUPHS-ILXRZTDVSA-N	0	0	271.404	4.057	20	30		CIEDRN
C=CCn1cccc1C(=O)Nc1cccc(SCC)c1	ZINC000488960701	332035763	/nfs/dbraw/zinc/03/57/63/332035763.db2.gz	MBAPUDICQXYRJH-UHFFFAOYSA-N	0	0	286.400	4.038	20	30		CIEDRN
C=CCn1cccc1C(=O)Nc1ccc(O[C@@H](C)CC)cc1	ZINC000489058509	332039739	/nfs/dbraw/zinc/03/97/39/332039739.db2.gz	OABUVWNEAUVDIY-AWEZNQCLSA-N	0	0	298.386	4.104	20	30		CIEDRN
C=C[C@@H]1CCCCN1Cc1csc(-c2ccsc2)n1	ZINC000489484071	332055624	/nfs/dbraw/zinc/05/56/24/332055624.db2.gz	POIARARNEIQQFC-CQSZACIVSA-N	0	0	290.457	4.412	20	30		CIEDRN
Cc1cccc([C@@H]2CCCN2Cc2ccc(F)cc2C#N)c1	ZINC000489570072	332059576	/nfs/dbraw/zinc/05/95/76/332059576.db2.gz	WDROHFMZLSRJCN-IBGZPJMESA-N	0	0	294.373	4.343	20	30		CIEDRN
CC(C)N(Cc1cccs1)Cc1ccc(F)cc1C#N	ZINC000489597928	332060873	/nfs/dbraw/zinc/06/08/73/332060873.db2.gz	QIJBTFKICYKVFR-UHFFFAOYSA-N	0	0	288.391	4.169	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@H]1CC12CCCCC2)c1ccccc1	ZINC000489595491	332060952	/nfs/dbraw/zinc/06/09/52/332060952.db2.gz	ZCFVHMOSRKMISN-SJORKVTESA-N	0	0	283.415	4.185	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCc1cc2ccccc2s1	ZINC000489652344	332063165	/nfs/dbraw/zinc/06/31/65/332063165.db2.gz	VMOMLGZIGZESKH-UHFFFAOYSA-N	0	0	273.401	4.120	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1scnc1C1CC1)c1ccccc1	ZINC000489649590	332063240	/nfs/dbraw/zinc/06/32/40/332063240.db2.gz	CGAIQJFGQNCFBH-AWEZNQCLSA-N	0	0	298.411	4.319	20	30		CIEDRN
C=CC[C@@H](C(=O)NC1CCC(F)(F)CC1)c1ccccc1	ZINC000489661784	332063589	/nfs/dbraw/zinc/06/35/89/332063589.db2.gz	ZUWOHUVEBHCWDH-OAHLLOKOSA-N	0	0	293.357	4.040	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(C(=O)C2CCC2)cc1	ZINC000489683293	332064703	/nfs/dbraw/zinc/06/47/03/332064703.db2.gz	QUDMCBZWDCJOPN-GOSISDBHSA-N	0	0	285.387	4.210	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1scnc1CC)c1ccccc1	ZINC000489693768	332065093	/nfs/dbraw/zinc/06/50/93/332065093.db2.gz	FQMTYBSJVHCLKV-ZDUSSCGKSA-N	0	0	286.400	4.004	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1cscc1C)c1ccccc1	ZINC000489716893	332065692	/nfs/dbraw/zinc/06/56/92/332065692.db2.gz	NSONZSSUIUIRKD-CQSZACIVSA-N	0	0	271.385	4.355	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1c(C)c(F)ccc1Cl	ZINC000489734469	332066471	/nfs/dbraw/zinc/06/64/71/332066471.db2.gz	APQICKQEFMQVMU-UHFFFAOYSA-N	0	0	283.774	4.120	20	30		CIEDRN
C=CCC[C@H](C(=O)Nc1cnc(C)s1)c1ccccc1	ZINC000489744265	332066662	/nfs/dbraw/zinc/06/66/62/332066662.db2.gz	WUNNZASQHFBOGH-AWEZNQCLSA-N	0	0	286.400	4.140	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@@H]1CCCC(F)(F)C1)c1ccccc1	ZINC000489758939	332066937	/nfs/dbraw/zinc/06/69/37/332066937.db2.gz	ZRCPDBOVCDUZKE-HUUCEWRRSA-N	0	0	293.357	4.040	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@H]1CCCC(F)(F)C1)c1ccccc1	ZINC000489758940	332066944	/nfs/dbraw/zinc/06/69/44/332066944.db2.gz	ZRCPDBOVCDUZKE-LSDHHAIUSA-N	0	0	293.357	4.040	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)CC(C)(C)c1ccccc1	ZINC000489770215	332067363	/nfs/dbraw/zinc/06/73/63/332067363.db2.gz	PMLDARMPYXQCRH-UHFFFAOYSA-N	0	0	273.420	4.073	20	30		CIEDRN
C=CCOc1ccc(-c2nnc(S[C@@H](C)CC)o2)cc1	ZINC000489794669	332068004	/nfs/dbraw/zinc/06/80/04/332068004.db2.gz	UIQFYUFKXOYRAJ-NSHDSACASA-N	0	0	290.388	4.192	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)CCc1ccc(Cl)s1	ZINC000489853417	332070425	/nfs/dbraw/zinc/07/04/25/332070425.db2.gz	CIRIAIHIUVRPGS-UHFFFAOYSA-N	0	0	285.840	4.053	20	30		CIEDRN
CCC[C@@H](C(=O)N(C)c1cc(Cl)ccc1C#N)C(C)C	ZINC000489956934	332074197	/nfs/dbraw/zinc/07/41/97/332074197.db2.gz	NBUCUZRLUXUEQG-CQSZACIVSA-N	0	0	292.810	4.247	20	30		CIEDRN
CC(C)c1ccc(/C=C/CC(=O)N[C@H](C#N)C(C)(C)C)cc1	ZINC000489979878	332075387	/nfs/dbraw/zinc/07/53/87/332075387.db2.gz	IIHRCYHYCXTHAE-DKRLNXSXSA-N	0	0	298.430	4.268	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)Cc1c(C)oc2ccccc21	ZINC000489977619	332075436	/nfs/dbraw/zinc/07/54/36/332075436.db2.gz	KAAPSXKRKCDZBS-UHFFFAOYSA-N	0	0	285.387	4.002	20	30		CIEDRN
C=CC[C@@H](C(=O)NCC(C)(C)CC=C)c1ccccc1	ZINC000489982076	332075437	/nfs/dbraw/zinc/07/54/37/332075437.db2.gz	WVHATYIAHQTLEQ-MRXNPFEDSA-N	0	0	271.404	4.065	20	30		CIEDRN
C=CC[C@H](C(=O)NCC(C)(C)CC=C)c1ccccc1	ZINC000489982070	332075459	/nfs/dbraw/zinc/07/54/59/332075459.db2.gz	WVHATYIAHQTLEQ-INIZCTEOSA-N	0	0	271.404	4.065	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1cc(C)c(F)cc1Cl	ZINC000490033256	332077505	/nfs/dbraw/zinc/07/75/05/332077505.db2.gz	RMLFJDSQENVFOZ-UHFFFAOYSA-N	0	0	283.774	4.120	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@@H](C)c1cccc(Cl)c1	ZINC000490036531	332077830	/nfs/dbraw/zinc/07/78/30/332077830.db2.gz	FUPKPFHPTQEJGT-LBPRGKRZSA-N	0	0	279.811	4.162	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@@H](c1ccccc1)C(C)C	ZINC000490035378	332077905	/nfs/dbraw/zinc/07/79/05/332077905.db2.gz	WVPVACPSMLUDTA-MRXNPFEDSA-N	0	0	273.420	4.145	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)[C@H]1CCCC(C)(C)C1	ZINC000490219971	332084975	/nfs/dbraw/zinc/08/49/75/332084975.db2.gz	ZTBYCQRKVONFQK-HNNXBMFYSA-N	0	0	289.419	4.053	20	30		CIEDRN
C=CC[C@@H](C(=O)N(C)C[C@H]1CC=CCC1)c1ccccc1	ZINC000490243164	332085363	/nfs/dbraw/zinc/08/53/63/332085363.db2.gz	ITHJTMVQDCQUKJ-FUHWJXTLSA-N	0	0	283.415	4.161	20	30		CIEDRN
N#CCc1ccc(NCc2ccc3c(c2)CCCC3)cc1	ZINC000490577742	332093412	/nfs/dbraw/zinc/09/34/12/332093412.db2.gz	HFVODMVWSQUSPJ-UHFFFAOYSA-N	0	0	276.383	4.244	20	30		CIEDRN
C=CCCCC(=O)NCC[C@H](c1ccccc1)C(F)(F)F	ZINC000490980810	332135610	/nfs/dbraw/zinc/13/56/10/332135610.db2.gz	OWFWGIMFRGAIJB-CQSZACIVSA-N	0	0	299.336	4.195	20	30		CIEDRN
C=CCN(C)C(=O)C(C)(C)c1ccc(-c2ccccc2)cc1	ZINC000491007272	332138184	/nfs/dbraw/zinc/13/81/84/332138184.db2.gz	UKUWPLPTFYTAGD-UHFFFAOYSA-N	0	0	293.410	4.276	20	30		CIEDRN
Cc1nnc(SCc2cc3ccccc3o2)c(C#N)c1C	ZINC000511880942	332946579	/nfs/dbraw/zinc/94/65/79/332946579.db2.gz	UAAVJLLSWDBUCZ-UHFFFAOYSA-N	0	0	295.367	4.004	20	30		CIEDRN
N#Cc1ccc(N[C@H](c2ccccc2)[C@@H]2CCCO2)c(F)c1	ZINC000172144767	335096052	/nfs/dbraw/zinc/09/60/52/335096052.db2.gz	QGSQMVITJNGLFF-ZWKOTPCHSA-N	0	0	296.345	4.030	20	30		CIEDRN
C=CCCCSCC(=O)Nc1ccc(SC)cc1	ZINC000172215411	335097765	/nfs/dbraw/zinc/09/77/65/335097765.db2.gz	NJQPLAZDBXVCJH-UHFFFAOYSA-N	0	0	281.446	4.046	20	30		CIEDRN
CC(C)[C@H]1CCCC[C@@H]1NC(=O)Nc1ccc(CC#N)cc1	ZINC000491836009	332371395	/nfs/dbraw/zinc/37/13/95/332371395.db2.gz	VLRKBMFKBSCWNR-SJORKVTESA-N	0	0	299.418	4.089	20	30		CIEDRN
Cc1cccc(Cl)c1NC(=O)/C=C\c1ccc(C#N)cc1	ZINC000492061989	332381240	/nfs/dbraw/zinc/38/12/40/332381240.db2.gz	ZIOWTQOUZWPPQY-KTKRTIGZSA-N	0	0	296.757	4.172	20	30		CIEDRN
N#Cc1ncccc1NCCCCc1ccc(Cl)s1	ZINC000575633310	335108628	/nfs/dbraw/zinc/10/86/28/335108628.db2.gz	DYNBTHVSXGGLOI-UHFFFAOYSA-N	0	0	291.807	4.103	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)/C=C\c1ccc(C)cn1	ZINC000492773494	332412974	/nfs/dbraw/zinc/41/29/74/332412974.db2.gz	WAJYSCBZQSVOIL-SEYXRHQNSA-N	0	0	292.382	4.161	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Nc1cc(C#N)ccc1C	ZINC000172443578	335105700	/nfs/dbraw/zinc/10/57/00/335105700.db2.gz	NORSCFHPFYTBRZ-UHFFFAOYSA-N	0	0	285.391	4.077	20	30		CIEDRN
N#CCCC[C@H](NC(=O)/C=C/C1CCCC1)c1ccccc1	ZINC000493351539	332436635	/nfs/dbraw/zinc/43/66/35/332436635.db2.gz	KGZYTYFLDUHDOF-JKGDOXCYSA-N	0	0	296.414	4.284	20	30		CIEDRN
COc1ccc(C#N)cc1N[C@@H](C)c1ccccc1Cl	ZINC000493837079	332455897	/nfs/dbraw/zinc/45/58/97/332455897.db2.gz	STFXDYBGZONZKD-NSHDSACASA-N	0	0	286.762	4.393	20	30		CIEDRN
C=CCn1c(SCCC(C)C)nnc1-c1ccoc1C	ZINC000494054206	332462056	/nfs/dbraw/zinc/46/20/56/332462056.db2.gz	JWCITMBWKYLDPZ-UHFFFAOYSA-N	0	0	291.420	4.171	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)N[C@H](c1ccccc1)C1CCC1	ZINC000494906529	332490605	/nfs/dbraw/zinc/49/06/05/332490605.db2.gz	FILRJRPSTHGYLK-ZWKOTPCHSA-N	0	0	298.430	4.278	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1cccc(F)c1Cl	ZINC000495009530	332499746	/nfs/dbraw/zinc/49/97/46/332499746.db2.gz	PMFKCZNIXZNZQP-JTQLQIEISA-N	0	0	284.762	4.345	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCc1ccc(C2CCC2)cc1	ZINC000495138249	332508107	/nfs/dbraw/zinc/50/81/07/332508107.db2.gz	IWUNMWWOFCENJS-CQSZACIVSA-N	0	0	271.404	4.173	20	30		CIEDRN
N#Cc1ccc(SCc2c(F)cccc2Cl)nc1	ZINC000495256720	332513100	/nfs/dbraw/zinc/51/31/00/332513100.db2.gz	NYBUNSBNWHYLOX-UHFFFAOYSA-N	0	0	278.739	4.038	20	30		CIEDRN
Cc1cc(N2CCC[C@H]2c2ccccc2Cl)cc(C#N)n1	ZINC000553276453	334373278	/nfs/dbraw/zinc/37/32/78/334373278.db2.gz	BKJIAOUFQZQNOR-KRWDZBQOSA-N	0	0	297.789	4.257	20	30		CIEDRN
CCc1ccc(C[NH2+][C@@H]2CCCc3cc(C#N)ccc32)cc1	ZINC000553293834	334374194	/nfs/dbraw/zinc/37/41/94/334374194.db2.gz	LHDZEJQAFLGLTH-HXUWFJFHSA-N	0	0	290.410	4.288	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CC[C@@H](c2cccc(Cl)c2)C1	ZINC000496650990	332555752	/nfs/dbraw/zinc/55/57/52/332555752.db2.gz	NGKKXLOPCWFERJ-UKRRQHHQSA-N	0	0	291.822	4.258	20	30		CIEDRN
C=CCCCC(=O)N1CC[C@@H](c2cccc(Cl)c2)C1	ZINC000497028938	332567939	/nfs/dbraw/zinc/56/79/39/332567939.db2.gz	BOCXOHSVVNMPIW-CQSZACIVSA-N	0	0	277.795	4.012	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc2cccc(Cl)c2n1	ZINC000498718623	332571711	/nfs/dbraw/zinc/57/17/11/332571711.db2.gz	UZVSSDGOZLGMBU-UHFFFAOYSA-N	0	0	288.778	4.429	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CC[C@@H](c2cc(C)cc(C)c2)C1	ZINC000499286346	332583547	/nfs/dbraw/zinc/58/35/47/332583547.db2.gz	KOTNTOIISCKAJL-MRXNPFEDSA-N	0	0	285.431	4.222	20	30		CIEDRN
C=CCN(CCc1ccccc1)C(=O)C[C@@H](C)CCC	ZINC000499310343	332584028	/nfs/dbraw/zinc/58/40/28/332584028.db2.gz	OAKNOQBYUPCWBJ-INIZCTEOSA-N	0	0	273.420	4.070	20	30		CIEDRN
C=CCOc1ccc(C(=O)N([C@@H](C)CC)[C@@H](C)CC)cc1	ZINC000499407990	332585523	/nfs/dbraw/zinc/58/55/23/332585523.db2.gz	NORBTIGAUZYSHB-GJZGRUSLSA-N	0	0	289.419	4.291	20	30		CIEDRN
Cc1ccnc(NC[C@@H]2CCC[C@H](C(F)(F)F)C2)c1C#N	ZINC000554732969	334449786	/nfs/dbraw/zinc/44/97/86/334449786.db2.gz	WDOJMHPWHHKRNJ-NEPJUHHUSA-N	0	0	297.324	4.042	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@@H]1CCCC(F)(F)C1	ZINC000499859517	332594771	/nfs/dbraw/zinc/59/47/71/332594771.db2.gz	XYHKJZURKDXZQH-CYBMUJFWSA-N	0	0	273.367	4.017	20	30		CIEDRN
Cc1ccc(C)c(OCCCC2(C#N)CCOCC2)c1C	ZINC000499909970	332595676	/nfs/dbraw/zinc/59/56/76/332595676.db2.gz	WYDYXXCLJNNWRV-UHFFFAOYSA-N	0	0	287.403	4.091	20	30		CIEDRN
Cc1ccc(C#N)c(N[C@@H]2CCC[C@H]2c2ccccc2)n1	ZINC000500274540	332604272	/nfs/dbraw/zinc/60/42/72/332604272.db2.gz	DXWKDVLMUUATRY-DLBZAZTESA-N	0	0	277.371	4.010	20	30		CIEDRN
C=CCN(CC=C)C(=O)N[C@@H](CC)c1cccc(Cl)c1	ZINC000500373351	332605671	/nfs/dbraw/zinc/60/56/71/332605671.db2.gz	APWMWFAQIBVIBA-HNNXBMFYSA-N	0	0	292.810	4.175	20	30		CIEDRN
N#Cc1cccc(N[C@@H]2CCC[C@H](c3cccnc3)C2)c1	ZINC000500393024	332606332	/nfs/dbraw/zinc/60/63/32/332606332.db2.gz	AAUZFGBJRBXCFI-MAUKXSAKSA-N	0	0	277.371	4.092	20	30		CIEDRN
C[C@@]1(c2ccccc2)CCCN(c2ccc(C#N)cc2)C1	ZINC000500390533	332606368	/nfs/dbraw/zinc/60/63/68/332606368.db2.gz	RBYTYTYEZZZGAO-LJQANCHMSA-N	0	0	276.383	4.116	20	30		CIEDRN
C=CCCc1ccccc1NCc1ncc(CC)s1	ZINC000500449823	332609771	/nfs/dbraw/zinc/60/97/71/332609771.db2.gz	BXKMACWLEJLBEU-UHFFFAOYSA-N	0	0	272.417	4.436	20	30		CIEDRN
C[C@H](CC(C)(C)C)C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000500711437	332616634	/nfs/dbraw/zinc/61/66/34/332616634.db2.gz	OMNXOSHUHDAXPW-CYBMUJFWSA-N	0	0	286.419	4.499	20	30		CIEDRN
COc1cc(C#N)ccc1CSCc1ccc(F)cc1	ZINC000500878437	332621101	/nfs/dbraw/zinc/62/11/01/332621101.db2.gz	YXKGYZWDGUCHAJ-UHFFFAOYSA-N	0	0	287.359	4.139	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc(C2CC2)c(C)c1	ZINC000501059039	332625279	/nfs/dbraw/zinc/62/52/79/332625279.db2.gz	UGUVFHRNEKXFQN-UHFFFAOYSA-N	0	0	257.377	4.413	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2cccc3ccsc32)CC1	ZINC000501220527	332628753	/nfs/dbraw/zinc/62/87/53/332628753.db2.gz	ZWCIAKSWCGNWBP-UHFFFAOYSA-N	0	0	286.400	4.331	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@@H]1CCCC(F)(F)C1	ZINC000501525501	332634745	/nfs/dbraw/zinc/63/47/45/332634745.db2.gz	WGYFPPMYSZGDTD-GFCCVEGCSA-N	0	0	299.386	4.088	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H](c1ccc(F)cc1)C(C)C	ZINC000501606932	332636846	/nfs/dbraw/zinc/63/68/46/332636846.db2.gz	KNIYVKOJAKLFDB-KRWDZBQOSA-N	0	0	289.394	4.407	20	30		CIEDRN
N#Cc1cnc(N2CCC[C@@H]2C2CCCCC2)c(Cl)c1	ZINC000513653324	332647673	/nfs/dbraw/zinc/64/76/73/332647673.db2.gz	QXTPUXLVXSRERR-OAHLLOKOSA-N	0	0	289.810	4.156	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)Cc1cccc(CC)c1	ZINC000502230354	332650819	/nfs/dbraw/zinc/65/08/19/332650819.db2.gz	TVSLQSNBRUAZSD-UHFFFAOYSA-N	0	0	293.410	4.006	20	30		CIEDRN
C=CCCc1ccccc1NCc1cccc(O)c1OC	ZINC000502316162	332653452	/nfs/dbraw/zinc/65/34/52/332653452.db2.gz	BXCNIJNHGAOUTQ-UHFFFAOYSA-N	0	0	283.371	4.132	20	30		CIEDRN
C=CCCc1ccccc1NC1CCC(OC)CC1	ZINC000502322486	332653647	/nfs/dbraw/zinc/65/36/47/332653647.db2.gz	RLXAIGFCBZVFSB-UHFFFAOYSA-N	0	0	259.393	4.175	20	30		CIEDRN
C[C@H]1CC(C(=O)Nc2ccc(C(C)(C)C#N)cc2)C[C@H](C)C1	ZINC000502792019	332673006	/nfs/dbraw/zinc/67/30/06/332673006.db2.gz	CPOUELGGFOLVLQ-ZIAGYGMSSA-N	0	0	298.430	4.499	20	30		CIEDRN
N#Cc1ccccc1SCc1c(F)cccc1F	ZINC000502909692	332676249	/nfs/dbraw/zinc/67/62/49/332676249.db2.gz	HQYQMGPIDFKDDF-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)[C@@H](CC)CCCC	ZINC000503090766	332681318	/nfs/dbraw/zinc/68/13/18/332681318.db2.gz	CVGJQNAJINDFTJ-KRWDZBQOSA-N	0	0	273.420	4.418	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)[C@@H]1CCCC(F)(F)C1	ZINC000503630850	332694442	/nfs/dbraw/zinc/69/44/42/332694442.db2.gz	FUBSHYVDMVHOSO-OAHLLOKOSA-N	0	0	299.405	4.407	20	30		CIEDRN
CC[C@@H](CC(=O)Nc1ccc(C#N)cc1)c1ccccc1	ZINC000504461200	332712330	/nfs/dbraw/zinc/71/23/30/332712330.db2.gz	VLISWLDFDFVVIV-HNNXBMFYSA-N	0	0	278.355	4.081	20	30		CIEDRN
CC[C@H](CC(=O)Nc1ccc(C#N)cc1)c1ccccc1	ZINC000504461201	332712433	/nfs/dbraw/zinc/71/24/33/332712433.db2.gz	VLISWLDFDFVVIV-OAHLLOKOSA-N	0	0	278.355	4.081	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H]1CC[C@H](Cc2ccccc2)C1	ZINC000504600422	332716404	/nfs/dbraw/zinc/71/64/04/332716404.db2.gz	AFFOXAFJHJWDSW-SJORKVTESA-N	0	0	285.431	4.116	20	30		CIEDRN
CC(C)COc1ccc(/C=C/c2ccncc2C#N)cc1	ZINC000504711106	332719291	/nfs/dbraw/zinc/71/92/91/332719291.db2.gz	GQAGDVBMWFIHHA-ZZXKWVIFSA-N	0	0	278.355	4.158	20	30		CIEDRN
Cc1ccc(/C=C/c2ccncc2C#N)c(Br)c1	ZINC000504733902	332719709	/nfs/dbraw/zinc/71/97/09/332719709.db2.gz	WGYYZAZKXBERAY-SNAWJCMRSA-N	0	0	299.171	4.195	20	30		CIEDRN
CCN(C(=O)c1cc(C#N)ccc1Cl)C1CCCCC1	ZINC000504871924	332723055	/nfs/dbraw/zinc/72/30/55/332723055.db2.gz	XDGQGHLGTNGYJC-UHFFFAOYSA-N	0	0	290.794	4.006	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N[C@H](C)[C@H](C)CC	ZINC000505010149	332727666	/nfs/dbraw/zinc/72/76/66/332727666.db2.gz	CAHKHRSMVFEXOO-ZIAGYGMSSA-N	0	0	274.408	4.361	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1[C@H](C)CC[C@@H]1C	ZINC000505011180	332727777	/nfs/dbraw/zinc/72/77/77/332727777.db2.gz	REXCSWKYFJNLGK-OKILXGFUSA-N	0	0	272.392	4.210	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CCC[C@H]1CC	ZINC000505016648	332727985	/nfs/dbraw/zinc/72/79/85/332727985.db2.gz	KJUMJLHUZYAOFL-OAHLLOKOSA-N	0	0	272.392	4.212	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CC[C@H](C)[C@@H]1CC	ZINC000505030431	332728504	/nfs/dbraw/zinc/72/85/04/332728504.db2.gz	VYXPGKGZJKXFLY-YOEHRIQHSA-N	0	0	286.419	4.458	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)Nc1ccc(O)c(C)c1	ZINC000505034264	332728667	/nfs/dbraw/zinc/72/86/67/332728667.db2.gz	CCHKFBHACYSKJU-UHFFFAOYSA-N	0	0	296.370	4.463	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CC2(C1)CCCC2	ZINC000505044841	332728936	/nfs/dbraw/zinc/72/89/36/332728936.db2.gz	FHQDEJFSFLHGLU-UHFFFAOYSA-N	0	0	284.403	4.213	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CC(C2CCCC2)C1	ZINC000505045975	332729206	/nfs/dbraw/zinc/72/92/06/332729206.db2.gz	MXIQXFXGHMLUAO-UHFFFAOYSA-N	0	0	298.430	4.459	20	30		CIEDRN
C=CCCC(=O)NCC(C)(C)CCCc1ccccc1	ZINC000505263849	332735477	/nfs/dbraw/zinc/73/54/77/332735477.db2.gz	HTVFKKSQHCXHMA-UHFFFAOYSA-N	0	0	273.420	4.118	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)CC[C@H](C)CC	ZINC000505274628	332735664	/nfs/dbraw/zinc/73/56/64/332735664.db2.gz	UPUVHGRBYRKQNZ-OAHLLOKOSA-N	0	0	259.393	4.028	20	30		CIEDRN
C[C@@H](NC(=O)Nc1ccccc1Cl)c1ccc(C#N)cc1	ZINC000505325369	332737104	/nfs/dbraw/zinc/73/71/04/332737104.db2.gz	NFOJXGFAABGIKD-LLVKDONJSA-N	0	0	299.761	4.094	20	30		CIEDRN
CC(C)(C)c1ccc([C@H](C#N)NC(=O)CCC2CCC2)cc1	ZINC000505827181	332753991	/nfs/dbraw/zinc/75/39/91/332753991.db2.gz	PYSXZNWQJXJVDX-KRWDZBQOSA-N	0	0	298.430	4.245	20	30		CIEDRN
N#Cc1ccc(OCc2cc(Cl)cc3cccnc32)cc1	ZINC000505844780	332754432	/nfs/dbraw/zinc/75/44/32/332754432.db2.gz	IEBMZAIIADFQAT-UHFFFAOYSA-N	0	0	294.741	4.339	20	30		CIEDRN
C=CCN(Cc1cccc(C(F)(F)F)c1)CC(F)(F)F	ZINC000511958360	332948835	/nfs/dbraw/zinc/94/88/35/332948835.db2.gz	UHURAUKEEHSBPN-UHFFFAOYSA-N	0	0	297.242	4.256	20	30		CIEDRN
C=CCN(Cc1cc(Cl)ccc1F)CC(F)(F)F	ZINC000511976607	332949452	/nfs/dbraw/zinc/94/94/52/332949452.db2.gz	BOHAVKIISKCLEJ-UHFFFAOYSA-N	0	0	281.680	4.029	20	30		CIEDRN
C=CCNC(=O)Nc1ccc(NC[C@H](C)CC(C)C)cc1	ZINC000572887702	334888290	/nfs/dbraw/zinc/88/82/90/334888290.db2.gz	YHRXWXIGCYCEEW-CQSZACIVSA-N	0	0	289.423	4.088	20	30		CIEDRN
C=CCCC(=O)N[C@H](c1ccc(Cl)cc1)[C@@H]1C[C@H]1C	ZINC000304053159	332965149	/nfs/dbraw/zinc/96/51/49/332965149.db2.gz	PEGQCTXNQOCADQ-DJSGYFEHSA-N	0	0	277.795	4.120	20	30		CIEDRN
C=CCCC(=O)N[C@H](c1ccc(Cl)cc1)[C@H]1C[C@@H]1C	ZINC000304053162	332965261	/nfs/dbraw/zinc/96/52/61/332965261.db2.gz	PEGQCTXNQOCADQ-HZUKXOBISA-N	0	0	277.795	4.120	20	30		CIEDRN
C=CC[C@H](C(=O)N1CCc2cc(F)ccc21)c1ccccc1	ZINC000512464113	332969441	/nfs/dbraw/zinc/96/94/41/332969441.db2.gz	UJZDEQXTVJUFET-KRWDZBQOSA-N	0	0	295.357	4.075	20	30		CIEDRN
C=CCOc1ccc(C(=O)N(CCCCC)C(C)C)cc1	ZINC000512522003	332971820	/nfs/dbraw/zinc/97/18/20/332971820.db2.gz	NBRVDTWRRBYATG-UHFFFAOYSA-N	0	0	289.419	4.292	20	30		CIEDRN
CCOc1cccc(N[C@H](C)c2ccc(C#N)cc2F)c1	ZINC000512631013	332976719	/nfs/dbraw/zinc/97/67/19/332976719.db2.gz	PEOBMJYIKIXBFX-GFCCVEGCSA-N	0	0	284.334	4.269	20	30		CIEDRN
Cc1cccc(N[C@@H](C)c2ccc(C#N)cc2F)c1C	ZINC000512653887	332978060	/nfs/dbraw/zinc/97/80/60/332978060.db2.gz	HROHMWJXNIDTES-ZDUSSCGKSA-N	0	0	268.335	4.487	20	30		CIEDRN
C=C(CNC(=O)N1CCC[C@H]1C1CCCC1)c1ccccc1	ZINC000512680361	332979854	/nfs/dbraw/zinc/97/98/54/332979854.db2.gz	ADIOCXWZRXTGGE-SFHVURJKSA-N	0	0	298.430	4.064	20	30		CIEDRN
C[C@H]1CCCC[C@@H]1CCNC(=O)Nc1ccc(CC#N)cc1	ZINC000512719775	332981461	/nfs/dbraw/zinc/98/14/61/332981461.db2.gz	FLKUVYDACRZKRG-GOEBONIOSA-N	0	0	299.418	4.091	20	30		CIEDRN
N#Cc1ccc(S[C@H]2CCCc3ccc(F)cc32)nc1	ZINC000512746365	332983001	/nfs/dbraw/zinc/98/30/01/332983001.db2.gz	GTFMVYKSAXZLPO-HNNXBMFYSA-N	0	0	284.359	4.262	20	30		CIEDRN
C=CCOc1cccc(NC(=O)N(CC)C(CC)CC)c1	ZINC000575782075	335114701	/nfs/dbraw/zinc/11/47/01/335114701.db2.gz	SPMVXBMBXWPJSL-UHFFFAOYSA-N	0	0	290.407	4.294	20	30		CIEDRN
C=CCCC(=O)NCCCc1ccc(Cl)cc1Cl	ZINC000173992475	332988221	/nfs/dbraw/zinc/98/82/21/332988221.db2.gz	NOOJDFGMQHFBPD-UHFFFAOYSA-N	0	0	286.202	4.008	20	30		CIEDRN
C[C@@H](Nc1ccc2scnc2c1)c1ccc(C#N)cc1	ZINC000174034220	332989448	/nfs/dbraw/zinc/98/94/48/332989448.db2.gz	CUDKKHOUXCEAKK-LLVKDONJSA-N	0	0	279.368	4.341	20	30		CIEDRN
CCc1sc(C(=O)N(CC)c2ccc(C#N)cc2)cc1C	ZINC000174077032	332990335	/nfs/dbraw/zinc/99/03/35/332990335.db2.gz	QTJRGWGUBPLVKJ-UHFFFAOYSA-N	0	0	298.411	4.157	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(NCC[C@H](C)c2ccccc2)c1	ZINC000513083481	333003302	/nfs/dbraw/zinc/00/33/02/333003302.db2.gz	POMHPLULDWYYAZ-AWEZNQCLSA-N	0	0	292.382	4.367	20	30		CIEDRN
CC(C)CN(CC(C)(C)C)C(=O)NCC(C)(C)CCC#N	ZINC000513129940	333005545	/nfs/dbraw/zinc/00/55/45/333005545.db2.gz	OUVJVXGMPRRVJD-UHFFFAOYSA-N	0	0	295.471	4.030	20	30		CIEDRN
N#Cc1cc(F)ccc1N[C@H](c1ccccc1)[C@H]1CCCO1	ZINC000174721850	333006321	/nfs/dbraw/zinc/00/63/21/333006321.db2.gz	GMINFCRXAXAGOK-QZTJIDSGSA-N	0	0	296.345	4.030	20	30		CIEDRN
C[N@H+](CCCC(C)(C)C#N)Cc1ccc(F)cc1Cl	ZINC000174852898	333009164	/nfs/dbraw/zinc/00/91/64/333009164.db2.gz	AKMYIPSPOJZRPC-UHFFFAOYSA-N	0	0	282.790	4.241	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1ccc2nccc(C)c2c1	ZINC000513280995	333012179	/nfs/dbraw/zinc/01/21/79/333012179.db2.gz	IOKIAOYDADWJEH-UHFFFAOYSA-N	0	0	296.414	4.362	20	30		CIEDRN
C=CCCCC(=O)N[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000175095690	333014801	/nfs/dbraw/zinc/01/48/01/333014801.db2.gz	QAGGAQJYAMAUBB-LLVKDONJSA-N	0	0	285.309	4.239	20	30		CIEDRN
C=C1CCN(Cc2cnc(-c3cccs3)s2)CC1	ZINC000513447388	333020021	/nfs/dbraw/zinc/02/00/21/333020021.db2.gz	MMOGPOOFLJAWRT-UHFFFAOYSA-N	0	0	276.430	4.024	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](C)c1oc2ccccc2c1C	ZINC000175356882	333022766	/nfs/dbraw/zinc/02/27/66/333022766.db2.gz	JNKNLMHXJZVXPE-ZDUSSCGKSA-N	0	0	271.360	4.275	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@H]1Cc1ccccc1Cl	ZINC000175410502	333024099	/nfs/dbraw/zinc/02/40/99/333024099.db2.gz	QQIKBQHKKMNLBL-HNNXBMFYSA-N	0	0	291.822	4.230	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(Oc2cccnc2)c(C)c1	ZINC000175420474	333024342	/nfs/dbraw/zinc/02/43/42/333024342.db2.gz	WXPOFRWAUGDKLP-UHFFFAOYSA-N	0	0	296.370	4.477	20	30		CIEDRN
Cc1cccc([C@H]2CCCN2c2ncc(C#N)cc2Cl)c1	ZINC000513616187	333026661	/nfs/dbraw/zinc/02/66/61/333026661.db2.gz	YCKVOYMZZRCYSS-MRXNPFEDSA-N	0	0	297.789	4.257	20	30		CIEDRN
Cc1ccccc1CN(c1ncc(C#N)cc1Cl)C1CC1	ZINC000513635196	333027975	/nfs/dbraw/zinc/02/79/75/333027975.db2.gz	KPHKQPDDRKVXIL-UHFFFAOYSA-N	0	0	297.789	4.084	20	30		CIEDRN
Cc1ccccc1Sc1ncc(C#N)cc1Cl	ZINC000513635819	333028199	/nfs/dbraw/zinc/02/81/99/333028199.db2.gz	RVKPDPLAASJWJX-UHFFFAOYSA-N	0	0	260.749	4.066	20	30		CIEDRN
Cc1ccc(C)c([C@H](C)N(C)c2ncc(C#N)cc2Cl)c1	ZINC000513640129	333028341	/nfs/dbraw/zinc/02/83/41/333028341.db2.gz	KAIWCSOIJWZICX-ZDUSSCGKSA-N	0	0	299.805	4.421	20	30		CIEDRN
Cc1ccc(Sc2ncc(C#N)cc2Cl)cc1	ZINC000513650363	333029051	/nfs/dbraw/zinc/02/90/51/333029051.db2.gz	MMUHVRBZYQFDCM-UHFFFAOYSA-N	0	0	260.749	4.066	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)[C@H]1CCC(C)(C)C1	ZINC000513673952	333031393	/nfs/dbraw/zinc/03/13/93/333031393.db2.gz	ACXJCDKIJISCEU-AWEZNQCLSA-N	0	0	289.394	4.167	20	30		CIEDRN
CC(C)Oc1ccccc1CN(CCC#N)CC(C)(C)C	ZINC000513713238	333034640	/nfs/dbraw/zinc/03/46/40/333034640.db2.gz	MOOZZFWGDZMSCN-UHFFFAOYSA-N	0	0	288.435	4.236	20	30		CIEDRN
Cc1ccccc1[C@H](Nc1ncc(C#N)cc1Cl)C1CC1	ZINC000513740070	333036686	/nfs/dbraw/zinc/03/66/86/333036686.db2.gz	QKXLLBYTHRABAD-MRXNPFEDSA-N	0	0	297.789	4.478	20	30		CIEDRN
Cc1ccc(-c2ccc(CN(C)[C@@H](C)CC#N)s2)cc1	ZINC000513737018	333036717	/nfs/dbraw/zinc/03/67/17/333036717.db2.gz	RULUZHYTCXYIJT-AWEZNQCLSA-N	0	0	284.428	4.458	20	30		CIEDRN
COc1ccc(CN(CCC#N)CCC(C)C)c(Cl)c1	ZINC000513746573	333037331	/nfs/dbraw/zinc/03/73/31/333037331.db2.gz	ZNJSBIXMFWHWAB-UHFFFAOYSA-N	0	0	294.826	4.110	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1ccc(Oc2ccccc2)o1	ZINC000176046943	333038982	/nfs/dbraw/zinc/03/89/82/333038982.db2.gz	VDSPLIRAZLXWAA-UHFFFAOYSA-N	0	0	285.343	4.110	20	30		CIEDRN
N#Cc1ccc(/C=C/c2nc3ccccc3s2)s1	ZINC000176400783	333041803	/nfs/dbraw/zinc/04/18/03/333041803.db2.gz	PQGBOYUDKFYERX-BQYQJAHWSA-N	0	0	268.366	4.400	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)c2cscc2C)c1	ZINC000176417700	333042003	/nfs/dbraw/zinc/04/20/03/333042003.db2.gz	AQVZOVYZLPNJRU-UHFFFAOYSA-N	0	0	287.384	4.264	20	30		CIEDRN
CCCn1c2cccc(F)c2nc1-c1ccc(C#N)cc1	ZINC000513868620	333044795	/nfs/dbraw/zinc/04/47/95/333044795.db2.gz	YORIAWAIZNAKAR-UHFFFAOYSA-N	0	0	279.318	4.124	20	30		CIEDRN
C=CCCSc1nnc(-c2cc3ccccc3o2)o1	ZINC000176793620	333047436	/nfs/dbraw/zinc/04/74/36/333047436.db2.gz	JZPHLRMBISDXHU-UHFFFAOYSA-N	0	0	272.329	4.151	20	30		CIEDRN
N#Cc1csc(/C=C/c2nc3ccccc3s2)c1	ZINC000176837344	333048533	/nfs/dbraw/zinc/04/85/33/333048533.db2.gz	YIATZYMWAGJZJI-AATRIKPKSA-N	0	0	268.366	4.400	20	30		CIEDRN
C=CCNC(=O)N[C@@H](C)c1ccc(Oc2ccccc2)cc1	ZINC000513899494	333048552	/nfs/dbraw/zinc/04/85/52/333048552.db2.gz	DOUBCGILDAYJSH-AWEZNQCLSA-N	0	0	296.370	4.025	20	30		CIEDRN
C=CCNC(=O)N[C@@H](C)c1ccccc1Oc1ccccc1	ZINC000513924062	333051498	/nfs/dbraw/zinc/05/14/98/333051498.db2.gz	NRWUOMHSIUNJDX-AWEZNQCLSA-N	0	0	296.370	4.025	20	30		CIEDRN
CCCC(CCC)[S@](=O)CCCC(C)(C)C#N	ZINC000177109188	333053760	/nfs/dbraw/zinc/05/37/60/333053760.db2.gz	SGVPVQTZPRSELB-QGZVFWFLSA-N	0	0	257.443	4.034	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC(C(C)(C)C)CC1	ZINC000177145599	333054147	/nfs/dbraw/zinc/05/41/47/333054147.db2.gz	ZJKIBQQSEUGPBJ-UHFFFAOYSA-N	0	0	263.425	4.040	20	30		CIEDRN
C=CCCC(=O)NC[C@H](Cc1ccccc1)c1ccccc1	ZINC000177615313	333061047	/nfs/dbraw/zinc/06/10/47/333061047.db2.gz	IYLZPWSXQAHBQK-IBGZPJMESA-N	0	0	293.410	4.095	20	30		CIEDRN
CCc1oc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1C	ZINC000177847577	333063930	/nfs/dbraw/zinc/06/39/30/333063930.db2.gz	ORTFGXWUTAJFTO-UHFFFAOYSA-N	0	0	296.370	4.204	20	30		CIEDRN
C=C(C)CS[C@@H](C)C(=O)Nc1c(CC)cccc1CC	ZINC000177864671	333064499	/nfs/dbraw/zinc/06/44/99/333064499.db2.gz	ASBOCHGMDHDAAU-ZDUSSCGKSA-N	0	0	291.460	4.448	20	30		CIEDRN
C=C(C)CSCC(=O)Nc1ccc(Cl)cc1Cl	ZINC000177872638	333064841	/nfs/dbraw/zinc/06/48/41/333064841.db2.gz	YTVQHFDODUOPCR-UHFFFAOYSA-N	0	0	290.215	4.241	20	30		CIEDRN
N#Cc1ccccc1SCc1nc2ccccc2s1	ZINC000172682368	335118999	/nfs/dbraw/zinc/11/89/99/335118999.db2.gz	SYXWLVWVCSOAOG-UHFFFAOYSA-N	0	0	282.393	4.460	20	30		CIEDRN
N#Cc1ccc(COc2cc(F)ccc2Cl)c(F)c1	ZINC000311588476	333070315	/nfs/dbraw/zinc/07/03/15/333070315.db2.gz	XDGDOTCIZIUQPA-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
COc1ccccc1Sc1nc(C)c(C#N)cc1Cl	ZINC000311936831	333074621	/nfs/dbraw/zinc/07/46/21/333074621.db2.gz	IYLUAXYCBAQDIE-UHFFFAOYSA-N	0	0	290.775	4.075	20	30		CIEDRN
COc1ccc(C#N)cc1CNc1ccc(Cl)cc1C	ZINC000312238608	333078739	/nfs/dbraw/zinc/07/87/39/333078739.db2.gz	HJFIUSBWGUMZEE-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2cc(F)ccc2C)no1	ZINC000516681202	333080559	/nfs/dbraw/zinc/08/05/59/333080559.db2.gz	HKBSFNPLOHZIIH-NSHDSACASA-N	0	0	260.312	4.254	20	30		CIEDRN
N#Cc1ccc(-c2nc(-c3cc4ccccc4o3)no2)cc1	ZINC000088337858	333088243	/nfs/dbraw/zinc/08/82/43/333088243.db2.gz	YWFCJYFHSJOZCM-UHFFFAOYSA-N	0	0	287.278	4.021	20	30		CIEDRN
Cc1c2ccccc2oc1[C@@H](C)Nc1cccnc1C#N	ZINC000516963026	333088260	/nfs/dbraw/zinc/08/82/60/333088260.db2.gz	NJCOBFSAGSXLRI-GFCCVEGCSA-N	0	0	277.327	4.181	20	30		CIEDRN
CC(C)Sc1ccc([C@@H](C)Nc2cc(C#N)ncn2)cc1	ZINC000517007771	333089576	/nfs/dbraw/zinc/08/95/76/333089576.db2.gz	GUKHAUGVOWAHKI-GFCCVEGCSA-N	0	0	298.415	4.022	20	30		CIEDRN
CSc1ccc(CNc2ccc(F)c(C#N)c2)s1	ZINC000517268367	333096366	/nfs/dbraw/zinc/09/63/66/333096366.db2.gz	MZMXVXQAPOHRPU-UHFFFAOYSA-N	0	0	278.377	4.093	20	30		CIEDRN
C=C(C)CN(CC)C(=O)[C@H]1C[C@H]1c1ccc2ccccc2c1	ZINC000517482970	333100394	/nfs/dbraw/zinc/10/03/94/333100394.db2.gz	SEFWTEZROVLEFZ-OALUTQOASA-N	0	0	293.410	4.368	20	30		CIEDRN
N#Cc1ccnc(SC[C@@H]2CCCc3ccccc32)c1	ZINC000517522685	333100979	/nfs/dbraw/zinc/10/09/79/333100979.db2.gz	LQFXCCYAURQLQM-HNNXBMFYSA-N	0	0	280.396	4.165	20	30		CIEDRN
CC(C)=CCC[C@@H](C)CC(=O)N(CC#N)C1CCCC1	ZINC000517571102	333102804	/nfs/dbraw/zinc/10/28/04/333102804.db2.gz	WQROIYVRZHKRJB-OAHLLOKOSA-N	0	0	276.424	4.054	20	30		CIEDRN
N#Cc1cc(F)ccc1N1CCC[C@@H]1c1cccs1	ZINC000521058017	333110631	/nfs/dbraw/zinc/11/06/31/333110631.db2.gz	HRARKDMAQWJDPR-CQSZACIVSA-N	0	0	272.348	4.100	20	30		CIEDRN
CC[C@H](CNc1ccc(C#N)c([N+](=O)[O-])c1)c1ccccc1	ZINC000521129388	333112264	/nfs/dbraw/zinc/11/22/64/333112264.db2.gz	SCAVSPQPUYVXSP-CYBMUJFWSA-N	0	0	295.342	4.072	20	30		CIEDRN
CC[C@H](C)[C@@H](C)C(=O)N(CC)[C@@H](C)c1ccc(C#N)cc1	ZINC000182967478	333118304	/nfs/dbraw/zinc/11/83/04/333118304.db2.gz	PVNSCWXANZGJSV-ZNMIVQPWSA-N	0	0	286.419	4.150	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@H](CCC)c1ccccc1	ZINC000217428629	333121067	/nfs/dbraw/zinc/12/10/67/333121067.db2.gz	MACHRKSVNXFEQC-MRXNPFEDSA-N	0	0	274.408	4.135	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@@H](CCC)c1ccccc1	ZINC000217428550	333121077	/nfs/dbraw/zinc/12/10/77/333121077.db2.gz	MACHRKSVNXFEQC-INIZCTEOSA-N	0	0	274.408	4.135	20	30		CIEDRN
CC#CCCCC(=O)Nc1cc(Cl)ccc1NC1CC1	ZINC000184344455	333127291	/nfs/dbraw/zinc/12/72/91/333127291.db2.gz	BJMNSCYRMGOOJJ-UHFFFAOYSA-N	0	0	290.794	4.046	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cc(Cl)ccc1C	ZINC000184896240	333133068	/nfs/dbraw/zinc/13/30/68/333133068.db2.gz	OYJVVDOOKGEDEK-LLVKDONJSA-N	0	0	251.757	4.189	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(Cl)cc1C	ZINC000184868467	333132848	/nfs/dbraw/zinc/13/28/48/333132848.db2.gz	UJQIZGHPCIUWHI-LLVKDONJSA-N	0	0	251.757	4.189	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(-c2nccs2)cc1	ZINC000184995782	333134148	/nfs/dbraw/zinc/13/41/48/333134148.db2.gz	DAPDEZSXIOBCQY-GFCCVEGCSA-N	0	0	286.400	4.351	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC)Cc1ccc(Cl)s1	ZINC000184991225	333134184	/nfs/dbraw/zinc/13/41/84/333134184.db2.gz	FZOVVGGIPRWRRF-LLVKDONJSA-N	0	0	285.840	4.352	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](C)c1cc(C)sc1C	ZINC000185094551	333135605	/nfs/dbraw/zinc/13/56/05/333135605.db2.gz	RPKXNTTWRPHRFD-JQWIXIFHSA-N	0	0	265.422	4.144	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(Cc1ccccc1)C(C)C	ZINC000185118568	333135763	/nfs/dbraw/zinc/13/57/63/333135763.db2.gz	IXPQDCHNSGJMJJ-OAHLLOKOSA-N	0	0	259.393	4.026	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](C)c1cccc(OC(C)C)c1	ZINC000185142593	333136031	/nfs/dbraw/zinc/13/60/31/333136031.db2.gz	JCBZPSALCFIEHX-CABCVRRESA-N	0	0	289.419	4.253	20	30		CIEDRN
N#Cc1ccc(F)cc1COc1c(F)cccc1Cl	ZINC000218826040	333136540	/nfs/dbraw/zinc/13/65/40/333136540.db2.gz	JRUNQDWLOFJKPG-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
CC#CCCCC(=O)N(Cc1ccccc1)[C@H](C)C1CC1	ZINC000185192743	333136545	/nfs/dbraw/zinc/13/65/45/333136545.db2.gz	AKLCTHUALYMWFC-MRXNPFEDSA-N	0	0	283.415	4.007	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCCc1csc2ccccc12	ZINC000185197235	333136562	/nfs/dbraw/zinc/13/65/62/333136562.db2.gz	JAFXVPPJAYUBAV-ZDUSSCGKSA-N	0	0	287.428	4.162	20	30		CIEDRN
CC#CCCCC(=O)N(Cc1ccccc1)CC1CCC1	ZINC000185266535	333137983	/nfs/dbraw/zinc/13/79/83/333137983.db2.gz	VQSKWSRHWYLXSL-UHFFFAOYSA-N	0	0	283.415	4.009	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccccc1-n1nc(C)cc1C	ZINC000185289660	333138455	/nfs/dbraw/zinc/13/84/55/333138455.db2.gz	BZWHOLURNUMNNT-ZDUSSCGKSA-N	0	0	297.402	4.030	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC2(CCCCC2)CC1	ZINC000185413578	333140374	/nfs/dbraw/zinc/14/03/74/333140374.db2.gz	IDTDZEMBJXPQAH-OAHLLOKOSA-N	0	0	263.425	4.162	20	30		CIEDRN
COc1ccc(CNc2c(C)cccc2SC)cc1C#N	ZINC000185437294	333140647	/nfs/dbraw/zinc/14/06/47/333140647.db2.gz	PHTCNKIOWCHLEX-UHFFFAOYSA-N	0	0	298.411	4.209	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H](c2ccccc2)CC1	ZINC000185439837	333140891	/nfs/dbraw/zinc/14/08/91/333140891.db2.gz	MKTJIVXYCZZANH-WMZOPIPTSA-N	0	0	285.431	4.385	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H]1Cc1ccc(C)cc1	ZINC000185556521	333143512	/nfs/dbraw/zinc/14/35/12/333143512.db2.gz	BMCRWPAXSVHYSH-SJLPKXTDSA-N	0	0	285.431	4.131	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc2cnn(C(C)C)c2c1	ZINC000185550485	333143532	/nfs/dbraw/zinc/14/35/32/333143532.db2.gz	PSXMVNJTDJBRLH-CYBMUJFWSA-N	0	0	285.391	4.158	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@](C)(c2ccccc2)C1	ZINC000185557366	333143846	/nfs/dbraw/zinc/14/38/46/333143846.db2.gz	PFNDCHFEBRPJBR-LPHOPBHVSA-N	0	0	285.431	4.169	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C(C)C)C1CCCCC1	ZINC000185588329	333144491	/nfs/dbraw/zinc/14/44/91/333144491.db2.gz	AEHBEZGFCYCJKF-AWEZNQCLSA-N	0	0	251.414	4.158	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(c1ccc(OC)c(F)c1)C(C)C	ZINC000185608335	333144844	/nfs/dbraw/zinc/14/48/44/333144844.db2.gz	YDFFDGGXOAWDDP-ZDUSSCGKSA-N	0	0	293.382	4.178	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(F)cc1OCC1CC1	ZINC000185650264	333145828	/nfs/dbraw/zinc/14/58/28/333145828.db2.gz	BUFZTQXMKUKJEP-LBPRGKRZSA-N	0	0	291.366	4.155	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](CC)c1cc(F)ccc1F	ZINC000185648367	333145854	/nfs/dbraw/zinc/14/58/54/333145854.db2.gz	GRMDJZYKOFPCGA-ABAIWWIYSA-N	0	0	281.346	4.134	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](C)C(C)(C)c1ccccc1	ZINC000185660358	333146247	/nfs/dbraw/zinc/14/62/47/333146247.db2.gz	KTZNDACVLOTBOK-LSDHHAIUSA-N	0	0	273.420	4.071	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC(F)(F)F)[C@H](C)C(C)C	ZINC000185704790	333146802	/nfs/dbraw/zinc/14/68/02/333146802.db2.gz	WVSPQNVTHJJCPY-NWDGAFQWSA-N	0	0	279.346	4.024	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC(F)(F)F)[C@H](C)C(C)C	ZINC000185704817	333146823	/nfs/dbraw/zinc/14/68/23/333146823.db2.gz	WVSPQNVTHJJCPY-VXGBXAGGSA-N	0	0	279.346	4.024	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](C)C[C@H]1c1ccc(C)o1	ZINC000185728871	333147410	/nfs/dbraw/zinc/14/74/10/333147410.db2.gz	JJQNEBXPCRCHNC-DZKIICNBSA-N	0	0	289.419	4.490	20	30		CIEDRN
CCCOc1cc(F)ccc1N[C@H]1CCC[C@H](C#N)C1	ZINC000185731407	333147439	/nfs/dbraw/zinc/14/74/39/333147439.db2.gz	YSHLDKYJBNGWBO-JSGCOSHPSA-N	0	0	276.355	4.109	20	30		CIEDRN
N#C[C@@H]1CCC[C@@H](Nc2ccc(F)cc2OCC2CC2)C1	ZINC000185730215	333147456	/nfs/dbraw/zinc/14/74/56/333147456.db2.gz	XFRFDBQLZULVKT-UKRRQHHQSA-N	0	0	288.366	4.109	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cccc(Oc2ccccn2)c1	ZINC000185729043	333147491	/nfs/dbraw/zinc/14/74/91/333147491.db2.gz	GPGWAEBXIGVQMN-AWEZNQCLSA-N	0	0	296.370	4.415	20	30		CIEDRN
N#Cc1ccccc1CNc1cccc(CC(F)(F)F)c1	ZINC000172938800	335124933	/nfs/dbraw/zinc/12/49/33/335124933.db2.gz	UEITZVZDNNXWCM-UHFFFAOYSA-N	0	0	290.288	4.275	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)C[C@H]1CCC[C@@H]1C	ZINC000185870279	333150749	/nfs/dbraw/zinc/15/07/49/333150749.db2.gz	LOZUZBLRYHHYOV-UONOGXRCSA-N	0	0	277.433	4.089	20	30		CIEDRN
CC(C)(C)C[C@H](N[C@H]1CCC[C@H](C#N)C1)C(F)(F)F	ZINC000185891529	333151160	/nfs/dbraw/zinc/15/11/60/333151160.db2.gz	SOMBRTNGWMAXAV-SRVKXCTJSA-N	0	0	276.346	4.025	20	30		CIEDRN
CC#CCCCC(=O)N1CCC[C@H]1CCCc1ccccc1	ZINC000185889659	333151189	/nfs/dbraw/zinc/15/11/89/333151189.db2.gz	SRLDSEATAJXUSZ-LJQANCHMSA-N	0	0	297.442	4.194	20	30		CIEDRN
CC#CCCCC(=O)N(Cc1ccoc1)C1CCCCC1	ZINC000185893808	333151232	/nfs/dbraw/zinc/15/12/32/333151232.db2.gz	BDRJAPRAOIJBSQ-UHFFFAOYSA-N	0	0	287.403	4.135	20	30		CIEDRN
C=CCC[C@@H](NC(=O)CCCC#CC)c1ccccc1	ZINC000185907168	333151654	/nfs/dbraw/zinc/15/16/54/333151654.db2.gz	YNOFAUHGNJLECF-QGZVFWFLSA-N	0	0	269.388	4.004	20	30		CIEDRN
C[C@H](CC(=O)Nc1ccccc1CC#N)C1CCCCC1	ZINC000564160965	333151679	/nfs/dbraw/zinc/15/16/79/333151679.db2.gz	NMSNUVFZCLXVTQ-CQSZACIVSA-N	0	0	284.403	4.298	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H](C)[C@H]1CCC	ZINC000185925601	333151855	/nfs/dbraw/zinc/15/18/55/333151855.db2.gz	RSBAPTVUNUMDDU-SOUVJXGZSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H](C)[C@@H]1CCC	ZINC000185925579	333151903	/nfs/dbraw/zinc/15/19/03/333151903.db2.gz	RSBAPTVUNUMDDU-ILXRZTDVSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(C)cc2cccnc21	ZINC000185977371	333152857	/nfs/dbraw/zinc/15/28/57/333152857.db2.gz	DEPTXTPCIFVOJH-ZDUSSCGKSA-N	0	0	268.360	4.084	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC=C(c2cccc(C)c2)CC1	ZINC000185982970	333152858	/nfs/dbraw/zinc/15/28/58/333152858.db2.gz	PMGMIKZWMAFZKT-INIZCTEOSA-N	0	0	283.415	4.213	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](C(=C)C)c1ccc(F)c(F)c1	ZINC000186033972	333153729	/nfs/dbraw/zinc/15/37/29/333153729.db2.gz	OHRKSSMGYOSDTP-BLLLJJGKSA-N	0	0	293.357	4.301	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](c2cc(C)cc(C)c2)C1	ZINC000186043229	333154009	/nfs/dbraw/zinc/15/40/09/333154009.db2.gz	PNKDQQZWUWYTEW-IRXDYDNUSA-N	0	0	285.431	4.222	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(OC)c(OC(C)C)c1	ZINC000186060895	333154162	/nfs/dbraw/zinc/15/41/62/333154162.db2.gz	KKINIENPWKJHPZ-ZDUSSCGKSA-N	0	0	291.391	4.023	20	30		CIEDRN
Cc1ccc(SCc2cccc(C#N)c2F)cc1	ZINC000219762549	333156345	/nfs/dbraw/zinc/15/63/45/333156345.db2.gz	OPMAOOLLWRGGEG-UHFFFAOYSA-N	0	0	257.333	4.298	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1nc(C)c(C)s1)c1ccccc1	ZINC000186191119	333156499	/nfs/dbraw/zinc/15/64/99/333156499.db2.gz	WXPYJRZRBAOGCL-AWEZNQCLSA-N	0	0	286.400	4.058	20	30		CIEDRN
N#Cc1cccc(CSc2ncccc2Cl)c1F	ZINC000219765194	333156523	/nfs/dbraw/zinc/15/65/23/333156523.db2.gz	HYZZXVPGKLRKTK-UHFFFAOYSA-N	0	0	278.739	4.038	20	30		CIEDRN
C=CC[C@@H](C(=O)N(CC)Cc1cccs1)c1ccccc1	ZINC000186239109	333157098	/nfs/dbraw/zinc/15/70/98/333157098.db2.gz	HHUWXZHRUOSUBH-QGZVFWFLSA-N	0	0	299.439	4.457	20	30		CIEDRN
N#CCN(Cc1cccc(Cl)c1Cl)C1CCCC1	ZINC000219822719	333157740	/nfs/dbraw/zinc/15/77/40/333157740.db2.gz	INNMJZUAMAQCDQ-UHFFFAOYSA-N	0	0	283.202	4.262	20	30		CIEDRN
C=C(C)[C@@H](N[C@@H](C)c1ccccn1)c1ccc(F)c(F)c1	ZINC000186448578	333161116	/nfs/dbraw/zinc/16/11/16/333161116.db2.gz	UFJJFOXYLDSASS-YVEFUNNKSA-N	0	0	288.341	4.328	20	30		CIEDRN
C=C(C)[C@@H](N[C@H](C)c1ccccn1)c1ccc(F)c(F)c1	ZINC000186448594	333161222	/nfs/dbraw/zinc/16/12/22/333161222.db2.gz	UFJJFOXYLDSASS-SJKOYZFVSA-N	0	0	288.341	4.328	20	30		CIEDRN
C=CCC[C@@H](C)Nc1ccc2c(c1)CCC(=O)N2CC1CC1	ZINC000186666003	333164157	/nfs/dbraw/zinc/16/41/57/333164157.db2.gz	KZKYORBLYSDYAC-CQSZACIVSA-N	0	0	298.430	4.142	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@H](CC)CCC)c1ccccc1	ZINC000187244445	333168816	/nfs/dbraw/zinc/16/88/16/333168816.db2.gz	KEZSJPKAPZBGFN-CVEARBPZSA-N	0	0	259.393	4.041	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@H](CC)CCC)c1ccccc1	ZINC000187244478	333168830	/nfs/dbraw/zinc/16/88/30/333168830.db2.gz	KEZSJPKAPZBGFN-HZPDHXFCSA-N	0	0	259.393	4.041	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(C)c(-c2ncco2)c1	ZINC000188851555	333174881	/nfs/dbraw/zinc/17/48/81/333174881.db2.gz	YURWDEGEPKIHSD-KRWDZBQOSA-N	0	0	284.359	4.191	20	30		CIEDRN
N#Cc1ccnc(SCc2cc(Cl)ccc2F)c1	ZINC000188960072	333176800	/nfs/dbraw/zinc/17/68/00/333176800.db2.gz	TULNNGNKPCWIBG-UHFFFAOYSA-N	0	0	278.739	4.038	20	30		CIEDRN
C=CCC[C@@H](C(=O)Nc1ccc(O)cc1)c1ccccc1	ZINC000189049085	333178989	/nfs/dbraw/zinc/17/89/89/333178989.db2.gz	HWFIGPCPFTVIGI-QGZVFWFLSA-N	0	0	281.355	4.081	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1cccc(F)c1)c1ccccc1	ZINC000189381440	333191443	/nfs/dbraw/zinc/19/14/43/333191443.db2.gz	BDMJNZCQVMQELW-MRXNPFEDSA-N	0	0	269.319	4.124	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1ccc(F)cc1F)c1ccccc1	ZINC000189443138	333193020	/nfs/dbraw/zinc/19/30/20/333193020.db2.gz	FVLNKIPZLXLMSY-AWEZNQCLSA-N	0	0	287.309	4.263	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000189760281	333198611	/nfs/dbraw/zinc/19/86/11/333198611.db2.gz	VTEUBNOOJMJJAQ-IBGZPJMESA-N	0	0	285.431	4.070	20	30		CIEDRN
CCCc1ccc(C(=O)N(CCC#N)C(C)(C)CC)cc1	ZINC000189901763	333200335	/nfs/dbraw/zinc/20/03/35/333200335.db2.gz	GZIYDSQCORQFMQ-UHFFFAOYSA-N	0	0	286.419	4.184	20	30		CIEDRN
C=CCC1(C(=O)N(C)c2ccc(F)c(Cl)c2)CCC1	ZINC000190024884	333201807	/nfs/dbraw/zinc/20/18/07/333201807.db2.gz	FVXZPAJGUQZGND-UHFFFAOYSA-N	0	0	281.758	4.188	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N(C)Cc1ccccc1C(F)(F)F	ZINC000190038678	333202433	/nfs/dbraw/zinc/20/24/33/333202433.db2.gz	YECDWSZWVCVWPU-HNNXBMFYSA-N	0	0	299.336	4.266	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H](C)c1ccc(OC(F)F)cc1	ZINC000190071902	333202982	/nfs/dbraw/zinc/20/29/82/333202982.db2.gz	ZFDZGAJNTYKPQZ-MEDUHNTESA-N	0	0	297.345	4.068	20	30		CIEDRN
N#Cc1ccc(CNc2cccc(Cl)c2F)cc1F	ZINC000190322236	333205411	/nfs/dbraw/zinc/20/54/11/333205411.db2.gz	XBMWJLZAMQVIRS-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
N#Cc1ccc(CNc2ccccc2OCC2CC2)cc1F	ZINC000190379385	333206296	/nfs/dbraw/zinc/20/62/96/333206296.db2.gz	LOVBAEBYPJPEIM-UHFFFAOYSA-N	0	0	296.345	4.098	20	30		CIEDRN
N#Cc1cccc(CNc2cc(F)ccc2OCC2CC2)c1	ZINC000190475897	333207260	/nfs/dbraw/zinc/20/72/60/333207260.db2.gz	RXDTZSWTSZSZIL-UHFFFAOYSA-N	0	0	296.345	4.098	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H](C)c1cccc(OC(F)F)c1	ZINC000190573474	333208550	/nfs/dbraw/zinc/20/85/50/333208550.db2.gz	OBVMGTIGEMHXDC-MEDUHNTESA-N	0	0	297.345	4.068	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H](C)c1cccc(OC(F)F)c1	ZINC000190573512	333208586	/nfs/dbraw/zinc/20/85/86/333208586.db2.gz	OBVMGTIGEMHXDC-BDJLRTHQSA-N	0	0	297.345	4.068	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H](C)c2ccccc2Cl)CCC1	ZINC000190604540	333208735	/nfs/dbraw/zinc/20/87/35/333208735.db2.gz	FWSOHSDSIPHKTP-LBPRGKRZSA-N	0	0	277.795	4.264	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](C(F)(F)F)C(C)(C)C1	ZINC000190695814	333209671	/nfs/dbraw/zinc/20/96/71/333209671.db2.gz	HDIQJCCVHGXODO-FZMZJTMJSA-N	0	0	291.357	4.026	20	30		CIEDRN
N#CCCCSCCOc1cc(Cl)ccc1Cl	ZINC000190884866	333212156	/nfs/dbraw/zinc/21/21/56/333212156.db2.gz	OVYLKCPYZINOOU-UHFFFAOYSA-N	0	0	290.215	4.409	20	30		CIEDRN
CC(C)OCCCS[C@H](C)c1ccc(C#N)cc1	ZINC000190948960	333212569	/nfs/dbraw/zinc/21/25/69/333212569.db2.gz	JDEPUUNLIJTJHV-CYBMUJFWSA-N	0	0	263.406	4.168	20	30		CIEDRN
CC[C@H](C)CC(=O)N[C@H](C#N)c1cccc(Cl)c1Cl	ZINC000191510310	333220620	/nfs/dbraw/zinc/22/06/20/333220620.db2.gz	BLBAADVVDCGMOO-JOYOIKCWSA-N	0	0	299.201	4.110	20	30		CIEDRN
C=CCCC(=O)Nc1cccc(OCc2cccc(C)c2)c1	ZINC000521930854	333223814	/nfs/dbraw/zinc/22/38/14/333223814.db2.gz	AXEVNQQAHMSKKC-UHFFFAOYSA-N	0	0	295.382	4.479	20	30		CIEDRN
Cc1cc(C#N)ccc1C(=O)N1CC[C@@H](C(C)(C)C)C[C@@H]1C	ZINC000521934974	333224021	/nfs/dbraw/zinc/22/40/21/333224021.db2.gz	KFPZSZCPHSXSBJ-GOEBONIOSA-N	0	0	298.430	4.154	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cc(Cl)ccc1F	ZINC000191806329	333225577	/nfs/dbraw/zinc/22/55/77/333225577.db2.gz	XTAVRFGFCTZETK-ZDUSSCGKSA-N	0	0	255.720	4.020	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1sc2c(c1C#N)CCCC2	ZINC000191798207	333225688	/nfs/dbraw/zinc/22/56/88/333225688.db2.gz	ZRAMBPYUANZYCC-MRXNPFEDSA-N	0	0	288.416	4.039	20	30		CIEDRN
C=CCC1(C(=O)Nc2cccc(Cl)c2F)CCC1	ZINC000191846624	333226232	/nfs/dbraw/zinc/22/62/32/333226232.db2.gz	XUIVEMKBFYWFIE-UHFFFAOYSA-N	0	0	267.731	4.164	20	30		CIEDRN
C=CCC1(C(=O)N2C[C@H](c3ccccc3)C[C@H]2C)CCC1	ZINC000191841488	333226369	/nfs/dbraw/zinc/22/63/69/333226369.db2.gz	XCWNJQXMXWPVLF-NVXWUHKLSA-N	0	0	283.415	4.137	20	30		CIEDRN
C=CCC1(C(=O)N2CCC(C(C)(C)C)CC2)CCC1	ZINC000191862365	333226558	/nfs/dbraw/zinc/22/65/58/333226558.db2.gz	ZLOZUCSZRMFKRZ-UHFFFAOYSA-N	0	0	263.425	4.018	20	30		CIEDRN
C=CCCCC(=O)Nc1cnn(-c2ccccc2C)c1CC	ZINC000192140170	333230634	/nfs/dbraw/zinc/23/06/34/333230634.db2.gz	VVTBDOMYICZTLE-UHFFFAOYSA-N	0	0	297.402	4.038	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cc(F)ccc1OCC1CC1	ZINC000192180589	333231907	/nfs/dbraw/zinc/23/19/07/333231907.db2.gz	YKJOGFGFPPHPPF-GFCCVEGCSA-N	0	0	291.366	4.155	20	30		CIEDRN
Cc1c(Cl)cccc1C(=O)N(CCC#N)CC(C)(C)C	ZINC000192522082	333235930	/nfs/dbraw/zinc/23/59/30/333235930.db2.gz	UKXSFBVDJMNQQT-UHFFFAOYSA-N	0	0	292.810	4.050	20	30		CIEDRN
N#CCc1ccc(NCc2cnc(-c3ccco3)s2)cc1	ZINC000193022223	333241568	/nfs/dbraw/zinc/24/15/68/333241568.db2.gz	WVLMMLUPRPSQAC-UHFFFAOYSA-N	0	0	295.367	4.081	20	30		CIEDRN
N#Cc1ccc(CN(C(=O)CCC2CCCC2)C2CC2)cc1	ZINC000193050607	333242038	/nfs/dbraw/zinc/24/20/38/333242038.db2.gz	KHFYEKVVWMGYDA-UHFFFAOYSA-N	0	0	296.414	4.020	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)N[C@H](CC)CCC	ZINC000195281130	333249595	/nfs/dbraw/zinc/24/95/95/333249595.db2.gz	YOHVIPLYDYYLNJ-CYBMUJFWSA-N	0	0	280.437	4.024	20	30		CIEDRN
N#Cc1cccc(/C=C/C(=O)Nc2cccc(C(F)F)c2)c1	ZINC000195422767	333252640	/nfs/dbraw/zinc/25/26/40/333252640.db2.gz	JHSMABUQXBWGSX-BQYQJAHWSA-N	0	0	298.292	4.148	20	30		CIEDRN
C[C@@H](CC(=O)Nc1ccc(C#N)cc1Cl)C(C)(C)C	ZINC000226345468	333257598	/nfs/dbraw/zinc/25/75/98/333257598.db2.gz	DDVXDWYTSYEZAH-JTQLQIEISA-N	0	0	278.783	4.222	20	30		CIEDRN
Cc1cccc(C)c1C(=O)Nc1ccc(C#N)cc1Cl	ZINC000226348607	333257834	/nfs/dbraw/zinc/25/78/34/333257834.db2.gz	INQDKXHKLVAJAA-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
N#Cc1ccc(CNc2ccc(-c3ccccc3)cn2)cc1	ZINC000194246884	333267941	/nfs/dbraw/zinc/26/79/41/333267941.db2.gz	RGUDFBLSDFRBLX-UHFFFAOYSA-N	0	0	285.350	4.232	20	30		CIEDRN
CC(=O)c1ccc(O[C@H](C)c2cccc(C#N)c2)cc1F	ZINC000194644126	333274441	/nfs/dbraw/zinc/27/44/41/333274441.db2.gz	PJBBJDUZVGKLKQ-GFCCVEGCSA-N	0	0	283.302	4.040	20	30		CIEDRN
C[C@@H]1CCC[C@@H](CNc2nc(C(F)(F)F)ccc2C#N)C1	ZINC000227115611	333276463	/nfs/dbraw/zinc/27/64/63/333276463.db2.gz	RKPYEVYDTCNYLO-GHMZBOCLSA-N	0	0	297.324	4.210	20	30		CIEDRN
CS[C@H]1CCC[C@H](Nc2cc(C#N)c3ccccc3n2)C1	ZINC000227652646	333287126	/nfs/dbraw/zinc/28/71/26/333287126.db2.gz	VWIKWCXBMCBWKE-KBPBESRZSA-N	0	0	297.427	4.193	20	30		CIEDRN
C=CCCC(=O)Nc1nc(-c2ccc(Cl)cc2)cs1	ZINC000522485714	333288099	/nfs/dbraw/zinc/28/80/99/333288099.db2.gz	ZRNGFIIOMYLXHR-UHFFFAOYSA-N	0	0	292.791	4.368	20	30		CIEDRN
C=C(C)CN(CC)C(=O)[C@@H](CC1CCCC1)C(C)C	ZINC000522505205	333288464	/nfs/dbraw/zinc/28/84/64/333288464.db2.gz	ODZBSKQWHUOXKO-INIZCTEOSA-N	0	0	265.441	4.264	20	30		CIEDRN
CC(C)[C@H](CC1CCCC1)C(=O)NCc1cccc(C#N)c1	ZINC000522510352	333288573	/nfs/dbraw/zinc/28/85/73/333288573.db2.gz	QFTHTGKSWSOKIY-SFHVURJKSA-N	0	0	298.430	4.027	20	30		CIEDRN
CC1(NC(=O)Nc2ccc(C#N)c(Cl)c2)CCCCC1	ZINC000522614475	333292321	/nfs/dbraw/zinc/29/23/21/333292321.db2.gz	DIHZDFZPWAJKRF-UHFFFAOYSA-N	0	0	291.782	4.056	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)CC1CCC(c2ccccc2)CC1	ZINC000522642840	333294313	/nfs/dbraw/zinc/29/43/13/333294313.db2.gz	LLKGTPATKMGVAX-KLHKWILBSA-N	0	0	285.431	4.431	20	30		CIEDRN
C[C@H]1CCC[C@@](C#N)(NC(=O)CCCC2CCCCC2)C1	ZINC000522643848	333294350	/nfs/dbraw/zinc/29/43/50/333294350.db2.gz	RVSBMFFTZJNDBQ-MAUKXSAKSA-N	0	0	290.451	4.326	20	30		CIEDRN
C=CCCCN(C)C(=O)Cc1ccc(-c2ccccc2)cc1	ZINC000522939973	333300639	/nfs/dbraw/zinc/30/06/39/333300639.db2.gz	MYMBRNKEIOUAHG-UHFFFAOYSA-N	0	0	293.410	4.321	20	30		CIEDRN
C=CCCCN(C)C(=O)[C@@H](CC)CC1CCCCC1	ZINC000522947395	333300712	/nfs/dbraw/zinc/30/07/12/333300712.db2.gz	AQYHEFPYWGHXIO-INIZCTEOSA-N	0	0	265.441	4.408	20	30		CIEDRN
CC1(C)CCCC[C@H]1C(=O)Nc1ccc(C#N)cc1Cl	ZINC000229418205	333304978	/nfs/dbraw/zinc/30/49/78/333304978.db2.gz	QYBVVFPCEAGORS-LBPRGKRZSA-N	0	0	290.794	4.367	20	30		CIEDRN
C=CC1CCN(C(=O)C[C@@H](CC)c2ccc(C)cc2)CC1	ZINC000523086730	333307299	/nfs/dbraw/zinc/30/72/99/333307299.db2.gz	TZHIEGDWTHRHCL-QGZVFWFLSA-N	0	0	285.431	4.303	20	30		CIEDRN
Cc1cccc(NCC(C)(C)CCC#N)c1Br	ZINC000229700568	333308036	/nfs/dbraw/zinc/30/80/36/333308036.db2.gz	FJVQWINLGJLHMU-UHFFFAOYSA-N	0	0	295.224	4.499	20	30		CIEDRN
CCCc1ccccc1NCc1ccc(F)c(C#N)c1	ZINC000229721886	333308609	/nfs/dbraw/zinc/30/86/09/333308609.db2.gz	LYZGSZLKFGCTHC-UHFFFAOYSA-N	0	0	268.335	4.262	20	30		CIEDRN
Cc1cc(Cl)ccc1NCc1ccc(F)c(C#N)c1	ZINC000229721430	333308611	/nfs/dbraw/zinc/30/86/11/333308611.db2.gz	FLEDBOULAGHJHM-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
C=CCCC(=O)N1CCC[C@H](C)[C@H]1c1ccc(C)cc1	ZINC000523143459	333310936	/nfs/dbraw/zinc/31/09/36/333310936.db2.gz	CPBHKOUEPPJPQZ-YJBOKZPZSA-N	0	0	271.404	4.261	20	30		CIEDRN
CCCc1ccccc1NCc1cccc(C#N)c1F	ZINC000230054814	333312572	/nfs/dbraw/zinc/31/25/72/333312572.db2.gz	YTLXZOCLQNOWKG-UHFFFAOYSA-N	0	0	268.335	4.262	20	30		CIEDRN
CCc1ccc(CNc2c(C#N)cnc3ccccc32)s1	ZINC000230899789	333322517	/nfs/dbraw/zinc/32/25/17/333322517.db2.gz	FNFRAFPRWJHSSR-UHFFFAOYSA-N	0	0	293.395	4.342	20	30		CIEDRN
CC[C@@H](C)CSc1nc(C(F)(F)F)ccc1C#N	ZINC000230932485	333322735	/nfs/dbraw/zinc/32/27/35/333322735.db2.gz	OZJOASGKIPRQGP-MRVPVSSYSA-N	0	0	274.311	4.110	20	30		CIEDRN
Cc1cc(C#N)ccc1-c1nc([C@@H]2CCC[C@H](C)C2)no1	ZINC000230997658	333323606	/nfs/dbraw/zinc/32/36/06/333323606.db2.gz	LPLFOMZYLOQQLU-SMDDNHRTSA-N	0	0	281.359	4.210	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@@H](C)CC1CCCC1	ZINC000523510892	333331304	/nfs/dbraw/zinc/33/13/04/333331304.db2.gz	IDOKVOKBQOMDRR-HNNXBMFYSA-N	0	0	265.441	4.408	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@H](C)CC1CCCC1	ZINC000523510893	333331338	/nfs/dbraw/zinc/33/13/38/333331338.db2.gz	IDOKVOKBQOMDRR-OAHLLOKOSA-N	0	0	265.441	4.408	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@@H](C)Cc1cccc(F)c1	ZINC000523511697	333331429	/nfs/dbraw/zinc/33/14/29/333331429.db2.gz	UMXHEJZGBVTASA-HNNXBMFYSA-N	0	0	291.410	4.209	20	30		CIEDRN
C[C@@H](Cc1ccc(Cl)cc1)Nc1ccc(CC#N)cc1	ZINC000231901381	333331850	/nfs/dbraw/zinc/33/18/50/333331850.db2.gz	YXLXCSRWIWWANH-ZDUSSCGKSA-N	0	0	284.790	4.449	20	30		CIEDRN
C=CCCSCc1ccc(F)c(Br)c1	ZINC000523519890	333332039	/nfs/dbraw/zinc/33/20/39/333332039.db2.gz	BPCQTMFMUVGQOJ-UHFFFAOYSA-N	0	0	275.186	4.398	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Cc1coc2cc(C)ccc12	ZINC000523541835	333332478	/nfs/dbraw/zinc/33/24/78/333332478.db2.gz	NOCHEKWMOCYQTC-UHFFFAOYSA-N	0	0	299.414	4.489	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Nc1ccc(CC)cc1	ZINC000523551999	333332784	/nfs/dbraw/zinc/33/27/84/333332784.db2.gz	MFLCZOGPPKRPFP-UHFFFAOYSA-N	0	0	274.408	4.459	20	30		CIEDRN
COc1cccc(CSCc2cccc(C#N)c2)c1	ZINC000302688954	333334744	/nfs/dbraw/zinc/33/47/44/333334744.db2.gz	ODWGZZSZXMOGOT-UHFFFAOYSA-N	0	0	269.369	4.000	20	30		CIEDRN
C=CCCC(=O)N(Cc1ccccc1)c1cccc(C)c1	ZINC000303105229	333337717	/nfs/dbraw/zinc/33/77/17/333337717.db2.gz	DPJZMHLXOLZZJL-UHFFFAOYSA-N	0	0	279.383	4.494	20	30		CIEDRN
N#Cc1cc(Cl)ccc1NCCCOC1CCCCC1	ZINC000303238042	333339089	/nfs/dbraw/zinc/33/90/89/333339089.db2.gz	ZMVLXFHETQWDPS-UHFFFAOYSA-N	0	0	292.810	4.363	20	30		CIEDRN
C=CCN(CCc1ccccc1)C(=O)CC1=CCCCC1	ZINC000303279109	333339660	/nfs/dbraw/zinc/33/96/60/333339660.db2.gz	ICEMMHPKEIFZOB-UHFFFAOYSA-N	0	0	283.415	4.134	20	30		CIEDRN
C=CC[C@H]1N(C(=O)c2cccc3[nH]ccc32)CCCC1(C)C	ZINC000575945589	335134618	/nfs/dbraw/zinc/13/46/18/335134618.db2.gz	ANYIXTWHMJBMDT-QGZVFWFLSA-N	0	0	296.414	4.375	20	30		CIEDRN
N#C[C@@H](Nc1cccc2c1CCCC2)C1CCCCC1	ZINC000523738351	333343008	/nfs/dbraw/zinc/34/30/08/333343008.db2.gz	PWHOJEPJGZVCNT-GOSISDBHSA-N	0	0	268.404	4.450	20	30		CIEDRN
Cc1c2ccccc2oc1CNc1nc(C)cc(C)c1C#N	ZINC000523755416	333344014	/nfs/dbraw/zinc/34/40/14/333344014.db2.gz	YSADPIWAXYXWKF-UHFFFAOYSA-N	0	0	291.354	4.237	20	30		CIEDRN
C=CCCSc1nc2ccccc2n1C(F)F	ZINC000303841812	333347261	/nfs/dbraw/zinc/34/72/61/333347261.db2.gz	SQYAPLCLIBNCFY-UHFFFAOYSA-N	0	0	254.305	4.100	20	30		CIEDRN
C[C@@H](CSc1ccc(C#N)cc1)c1ccccc1	ZINC000523932420	333349526	/nfs/dbraw/zinc/34/95/26/333349526.db2.gz	NZKRHLKIMQLJDT-ZDUSSCGKSA-N	0	0	253.370	4.454	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@@H](c1ccccc1)C1CCCC1	ZINC000523943904	333349724	/nfs/dbraw/zinc/34/97/24/333349724.db2.gz	OGJGSYHTJMGJHE-YOEHRIQHSA-N	0	0	286.419	4.182	20	30		CIEDRN
C=CCCC(=O)N(Cc1ccc(C(C)C)cc1)C1CC1	ZINC000523953758	333349973	/nfs/dbraw/zinc/34/99/73/333349973.db2.gz	UQFUOWHIMXZWMF-UHFFFAOYSA-N	0	0	271.404	4.267	20	30		CIEDRN
C=CC[C@H](C)NC(=O)[C@@H](CCC)CC1CCCCC1	ZINC000523967371	333350251	/nfs/dbraw/zinc/35/02/51/333350251.db2.gz	LUJXTQLLLFAYNU-HOCLYGCPSA-N	0	0	265.441	4.454	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1ccc2c(ccn2CCC)c1	ZINC000523986753	333350643	/nfs/dbraw/zinc/35/06/43/333350643.db2.gz	NJXPNHXYQOKJTC-ZDUSSCGKSA-N	0	0	285.391	4.137	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1cccc(Cl)c1OC(C)C	ZINC000524030900	333352251	/nfs/dbraw/zinc/35/22/51/333352251.db2.gz	NQOCGXJNEULFIV-NSHDSACASA-N	0	0	296.798	4.213	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1ccc(CCCC)cc1	ZINC000524206426	333356235	/nfs/dbraw/zinc/35/62/35/333356235.db2.gz	AUDJFQNSVSTVLI-ZDUSSCGKSA-N	0	0	260.381	4.115	20	30		CIEDRN
CC[C@@H](CC(=O)Nc1cccc(C#N)c1)c1ccc(C)cc1	ZINC000524250075	333357981	/nfs/dbraw/zinc/35/79/81/333357981.db2.gz	AVGIKAVXCSXVRN-INIZCTEOSA-N	0	0	292.382	4.389	20	30		CIEDRN
CC[C@H](CC(=O)Nc1ccccc1C#N)c1ccc(C)cc1	ZINC000524249377	333358029	/nfs/dbraw/zinc/35/80/29/333358029.db2.gz	CYJKUTQLBCNAMH-OAHLLOKOSA-N	0	0	292.382	4.389	20	30		CIEDRN
CC(C)CC[C@@H]1CCC[C@H]1NC(=O)c1cccc(CC#N)c1	ZINC000524329505	333360146	/nfs/dbraw/zinc/36/01/46/333360146.db2.gz	MHAGUVGEJUGVTG-FUHWJXTLSA-N	0	0	298.430	4.087	20	30		CIEDRN
CC(C)CC[C@@H]1CCC[C@@H]1NC(=O)c1cccc(CC#N)c1	ZINC000524329507	333360165	/nfs/dbraw/zinc/36/01/65/333360165.db2.gz	MHAGUVGEJUGVTG-WMZOPIPTSA-N	0	0	298.430	4.087	20	30		CIEDRN
COc1ccc(S[C@H](C#N)C2CCCCC2)cc1	ZINC000524534324	333365204	/nfs/dbraw/zinc/36/52/04/333365204.db2.gz	NMWKACYUDUPRJC-OAHLLOKOSA-N	0	0	261.390	4.260	20	30		CIEDRN
COc1cccc(S[C@@H](C#N)C2CCCCC2)c1	ZINC000524535202	333365250	/nfs/dbraw/zinc/36/52/50/333365250.db2.gz	RSKWOVNCIMLSHB-HNNXBMFYSA-N	0	0	261.390	4.260	20	30		CIEDRN
C=CCCSCc1ccc(OCC(F)(F)F)cc1	ZINC000524604774	333368396	/nfs/dbraw/zinc/36/83/96/333368396.db2.gz	GIKGTNDLUDHWNR-UHFFFAOYSA-N	0	0	276.323	4.437	20	30		CIEDRN
Cc1cc(OCCCCC(C)(C)C#N)ccc1[N+](=O)[O-]	ZINC000235757677	333371926	/nfs/dbraw/zinc/37/19/26/333371926.db2.gz	OMFVMFPKAXGIMY-UHFFFAOYSA-N	0	0	276.336	4.002	20	30		CIEDRN
N#Cc1ccnc(Oc2ccc(Cl)c(F)c2)c1Cl	ZINC000236200162	333373219	/nfs/dbraw/zinc/37/32/19/333373219.db2.gz	UMJBRBMOHNMSIH-UHFFFAOYSA-N	0	0	283.089	4.191	20	30		CIEDRN
C=CCCS[C@H]1CCCN(c2ccccc2Cl)C1=O	ZINC000524728796	333373308	/nfs/dbraw/zinc/37/33/08/333373308.db2.gz	BNHPCYDBSNXVSQ-AWEZNQCLSA-N	0	0	295.835	4.145	20	30		CIEDRN
Cc1sc(NC(=O)Cc2cc(C)ccc2C)c(C#N)c1C	ZINC000010701663	333374957	/nfs/dbraw/zinc/37/49/57/333374957.db2.gz	FOUFOTDSVWRFIC-UHFFFAOYSA-N	0	0	298.411	4.035	20	30		CIEDRN
Cc1cc([C@H](C)Nc2cc(C#N)c3ccccc3n2)c(C)o1	ZINC000316202673	333385963	/nfs/dbraw/zinc/38/59/63/333385963.db2.gz	CDAUQRYJOSTHDF-LBPRGKRZSA-N	0	0	291.354	4.489	20	30		CIEDRN
N#Cc1ccc(N[C@@H]2C[C@H]2c2c(F)cccc2Cl)cc1	ZINC000524842855	333390005	/nfs/dbraw/zinc/39/00/05/333390005.db2.gz	YFEHQJYJJBDPMF-IUODEOHRSA-N	0	0	286.737	4.319	20	30		CIEDRN
C=CCCCNc1ccc(-n2nc(C)cc2C)c(F)c1	ZINC000524845147	333390485	/nfs/dbraw/zinc/39/04/85/333390485.db2.gz	XWOFMUKPNQXTIV-UHFFFAOYSA-N	0	0	273.355	4.006	20	30		CIEDRN
N#Cc1nnc2ccccc2c1SCC1CCCCC1	ZINC000524846894	333390533	/nfs/dbraw/zinc/39/05/33/333390533.db2.gz	YXUZGOWLRMMGGB-UHFFFAOYSA-N	0	0	283.400	4.174	20	30		CIEDRN
CC(C)C[C@H]1CCCCCN1C(=O)Nc1ccc(C#N)cc1	ZINC000524886238	333391862	/nfs/dbraw/zinc/39/18/62/333391862.db2.gz	JMOXNHAMEVJZQG-QGZVFWFLSA-N	0	0	299.418	4.381	20	30		CIEDRN
C=CCOCCCc1nc(-c2cccc3ccccc32)no1	ZINC000525239147	333405040	/nfs/dbraw/zinc/40/50/40/333405040.db2.gz	MUSFOTDIQRGRTR-UHFFFAOYSA-N	0	0	294.354	4.025	20	30		CIEDRN
CC(C)C[C@@H](C(=O)Nc1ccc(C#N)cc1)c1ccccc1	ZINC000525334887	333409445	/nfs/dbraw/zinc/40/94/45/333409445.db2.gz	LFSATWAKBMBVAP-GOSISDBHSA-N	0	0	292.382	4.327	20	30		CIEDRN
C=CCCNc1cccc(OCc2cccc(F)c2)c1	ZINC000525361444	333410097	/nfs/dbraw/zinc/41/00/97/333410097.db2.gz	VGXYQCOPZGDFFY-UHFFFAOYSA-N	0	0	271.335	4.393	20	30		CIEDRN
Cc1nc(CSc2ccccc2C#N)nc2ccccc12	ZINC000173711061	335139125	/nfs/dbraw/zinc/13/91/25/335139125.db2.gz	FLUHNPVKRAASTJ-UHFFFAOYSA-N	0	0	291.379	4.102	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@H]1CCC(C)=C(C)C1	ZINC000575989833	335139404	/nfs/dbraw/zinc/13/94/04/335139404.db2.gz	AUNFGCJGLLUDAF-HNNXBMFYSA-N	0	0	289.444	4.399	20	30		CIEDRN
C=CCCSCC(=O)Nc1ccc(C(C)C)cc1	ZINC000243054936	333425574	/nfs/dbraw/zinc/42/55/74/333425574.db2.gz	IHBRYCHGQFCYIO-UHFFFAOYSA-N	0	0	263.406	4.058	20	30		CIEDRN
Cc1ccccc1[C@H](C)Nc1ccc(CC#N)cc1	ZINC000037071421	333472148	/nfs/dbraw/zinc/47/21/48/333472148.db2.gz	ZSNSKIGQQSXKNH-AWEZNQCLSA-N	0	0	250.345	4.234	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)[C@H]2CCCC23CC3)CCCC1(C)C	ZINC000529189738	333476485	/nfs/dbraw/zinc/47/64/85/333476485.db2.gz	XMTHPGURCGOJLD-CABCVRRESA-N	0	0	275.436	4.160	20	30		CIEDRN
CCC(C#N)(CC)C(=O)N1C[C@H](c2ccc(C)cc2)C[C@@H]1C	ZINC000529203729	333476976	/nfs/dbraw/zinc/47/69/76/333476976.db2.gz	TZNUUXJMSDYGFT-DOTOQJQBSA-N	0	0	298.430	4.029	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1cc(Cl)cc(C)c1OC	ZINC000529248242	333479325	/nfs/dbraw/zinc/47/93/25/333479325.db2.gz	LBCKTKZGZIGSBB-UHFFFAOYSA-N	0	0	296.798	4.087	20	30		CIEDRN
CC(C)Cn1ccc2cc(NC[C@H](C#N)CCC#N)ccc21	ZINC000576031195	335143413	/nfs/dbraw/zinc/14/34/13/335143413.db2.gz	HIDCGYUYSMRATK-HNNXBMFYSA-N	0	0	294.402	4.153	20	30		CIEDRN
CC(C)c1cc(Cl)ccc1NC(=O)CC(C)(C)C#N	ZINC000529853907	333511319	/nfs/dbraw/zinc/51/13/19/333511319.db2.gz	SATZBAZXBAJGPD-UHFFFAOYSA-N	0	0	278.783	4.342	20	30		CIEDRN
CCOc1ccccc1N[C@@H](C)c1cccc(C#N)c1	ZINC000037195944	333512152	/nfs/dbraw/zinc/51/21/52/333512152.db2.gz	BJBGUNNCLDGSLY-ZDUSSCGKSA-N	0	0	266.344	4.130	20	30		CIEDRN
Cc1ccc(N[C@H](C)c2cccc(C#N)c2)c(F)c1	ZINC000037244158	333523341	/nfs/dbraw/zinc/52/33/41/333523341.db2.gz	WYYXOXKPQNZQOT-GFCCVEGCSA-N	0	0	254.308	4.179	20	30		CIEDRN
Cc1ccc(N[C@@H](C)c2cccc(C#N)c2)c(F)c1	ZINC000037244156	333523342	/nfs/dbraw/zinc/52/33/42/333523342.db2.gz	WYYXOXKPQNZQOT-LBPRGKRZSA-N	0	0	254.308	4.179	20	30		CIEDRN
C(#Cc1ccccc1)CNc1cccc(C2CCOCC2)c1	ZINC000530122892	333523942	/nfs/dbraw/zinc/52/39/42/333523942.db2.gz	LINSGWZCLFAYBV-UHFFFAOYSA-N	0	0	291.394	4.044	20	30		CIEDRN
CC(C)Oc1ccc(CC#N)cc1-c1cnc(C2CC2)o1	ZINC000530249771	333530035	/nfs/dbraw/zinc/53/00/35/333530035.db2.gz	FWUQUVSKFGEJJR-UHFFFAOYSA-N	0	0	282.343	4.072	20	30		CIEDRN
CO[C@H](C)c1cccc(N[C@@H](C)c2ccc(C#N)cc2)c1	ZINC000174043143	335147065	/nfs/dbraw/zinc/14/70/65/335147065.db2.gz	AMCQFYUNQAXMEJ-UONOGXRCSA-N	0	0	280.371	4.439	20	30		CIEDRN
CO[C@H](C)c1cccc(N[C@H](C)c2ccc(C#N)cc2)c1	ZINC000174043154	335147110	/nfs/dbraw/zinc/14/71/10/335147110.db2.gz	AMCQFYUNQAXMEJ-ZIAGYGMSSA-N	0	0	280.371	4.439	20	30		CIEDRN
C=CCN(C(=O)CSc1ccc(C(C)C)cc1)C1CC1	ZINC000537933554	333547946	/nfs/dbraw/zinc/54/79/46/333547946.db2.gz	BZOSUFKRZIDGQJ-UHFFFAOYSA-N	0	0	289.444	4.079	20	30		CIEDRN
C[C@@H](CCC(=O)Nc1ccc(F)cc1C#N)c1ccccc1	ZINC000124105686	333556044	/nfs/dbraw/zinc/55/60/44/333556044.db2.gz	FKXDQQWDUPWJSB-ZDUSSCGKSA-N	0	0	296.345	4.220	20	30		CIEDRN
N#Cc1cc(NCc2cc(F)ccc2Cl)ccc1F	ZINC000124091479	333556058	/nfs/dbraw/zinc/55/60/58/333556058.db2.gz	OVPIXWGSBRUERM-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C[C@@H](c1cccs1)N(C)C(=O)Nc1ccc(CC#N)cc1	ZINC000125304451	333565650	/nfs/dbraw/zinc/56/56/50/333565650.db2.gz	WEMITUOOADGGKM-LBPRGKRZSA-N	0	0	299.399	4.039	20	30		CIEDRN
C=CCCC[C@@H](C)Sc1nnc(C2CC2)s1	ZINC000538171457	333577652	/nfs/dbraw/zinc/57/76/52/333577652.db2.gz	RZNGTRRUDUFEOK-SECBINFHSA-N	0	0	254.424	4.252	20	30		CIEDRN
C[C@H](NCC#N)c1ccccc1-c1ccc(Cl)cc1	ZINC000538186297	333577770	/nfs/dbraw/zinc/57/77/70/333577770.db2.gz	HUGZPJNOJRQSFJ-LBPRGKRZSA-N	0	0	270.763	4.181	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)C1(c2cccc(Cl)c2)CC1	ZINC000538331527	333585434	/nfs/dbraw/zinc/58/54/34/333585434.db2.gz	IMEZUDVKCLAXII-ZDUSSCGKSA-N	0	0	291.822	4.233	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Cc1ccc(C)cc1Cl	ZINC000538327902	333585519	/nfs/dbraw/zinc/58/55/19/333585519.db2.gz	FOULXQOUTZYJQN-CYBMUJFWSA-N	0	0	279.811	4.052	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)C1(c2ccc(Cl)cc2)CC1	ZINC000538332796	333585569	/nfs/dbraw/zinc/58/55/69/333585569.db2.gz	OZDKFOSZOQMLLU-ZDUSSCGKSA-N	0	0	291.822	4.233	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1	ZINC000538333287	333585757	/nfs/dbraw/zinc/58/57/57/333585757.db2.gz	BKKIZZKTYVEEBL-MAZHCROVSA-N	0	0	291.822	4.305	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)C1(c2cccc(F)c2)CCC1	ZINC000538335892	333585853	/nfs/dbraw/zinc/58/58/53/333585853.db2.gz	OPGPMNYFFJKXIP-CQSZACIVSA-N	0	0	289.394	4.108	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1ccc(COCC)cc1	ZINC000538353921	333586727	/nfs/dbraw/zinc/58/67/27/333586727.db2.gz	IIFONMZUWMPBMS-CQSZACIVSA-N	0	0	290.407	4.089	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)[C@@H]2CC[C@@H](C)C2)c1	ZINC000538442188	333592656	/nfs/dbraw/zinc/59/26/56/333592656.db2.gz	GONYTXOITVEJTC-ZIAGYGMSSA-N	0	0	273.376	4.016	20	30		CIEDRN
CSc1cccc(NCc2ccc(C#N)s2)c1C	ZINC000538453303	333593810	/nfs/dbraw/zinc/59/38/10/333593810.db2.gz	HSTRXWOMEBJHER-UHFFFAOYSA-N	0	0	274.414	4.262	20	30		CIEDRN
CCC(CC)CC(=O)N(Cc1ccc(C#N)cc1)C(C)C	ZINC000126196995	333594422	/nfs/dbraw/zinc/59/44/22/333594422.db2.gz	FKRSKCRAVFRDSB-UHFFFAOYSA-N	0	0	286.419	4.122	20	30		CIEDRN
C=CCC[C@H](Nc1cccc(COCC)c1)C1CC1	ZINC000538550840	333605389	/nfs/dbraw/zinc/60/53/89/333605389.db2.gz	IOBXOMQCQDZECG-KRWDZBQOSA-N	0	0	259.393	4.380	20	30		CIEDRN
C=CCCS[C@H](C)c1cc([N+](=O)[O-])ccc1C	ZINC000538703992	333612752	/nfs/dbraw/zinc/61/27/52/333612752.db2.gz	VPMLRUWQGMGOQT-LLVKDONJSA-N	0	0	251.351	4.274	20	30		CIEDRN
CC(C)(C)c1ccc(CN(CC#N)C2CCCC2)s1	ZINC000538720268	333615604	/nfs/dbraw/zinc/61/56/04/333615604.db2.gz	PNUNYBUHTJOUOL-UHFFFAOYSA-N	0	0	276.449	4.314	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H](C)c1cccc(OCC)c1	ZINC000127443251	333629092	/nfs/dbraw/zinc/62/90/92/333629092.db2.gz	RNNFNBWGFNUJRI-CQSZACIVSA-N	0	0	287.403	4.031	20	30		CIEDRN
C=C(C)CSc1nnc(C)n1[C@H]1CCC[C@@H](C)C1	ZINC000127448709	333629226	/nfs/dbraw/zinc/62/92/26/333629226.db2.gz	AZMHKSPWNUAQEM-YPMHNXCESA-N	0	0	265.426	4.006	20	30		CIEDRN
N#CC1(C(=O)Nc2cccc(Oc3ccccc3)c2)CCC1	ZINC000127852316	333636527	/nfs/dbraw/zinc/63/65/27/333636527.db2.gz	BKDHTGAMFCHHNP-UHFFFAOYSA-N	0	0	292.338	4.111	20	30		CIEDRN
N#Cc1cccc(NCc2ccc(-c3ccccc3)o2)c1	ZINC000538862625	333639548	/nfs/dbraw/zinc/63/95/48/333639548.db2.gz	WTQLJHYGMYRWRQ-UHFFFAOYSA-N	0	0	274.323	4.430	20	30		CIEDRN
Cc1ccc(F)c(NCc2cccc(OCCCC#N)c2)c1	ZINC000128197246	333644341	/nfs/dbraw/zinc/64/43/41/333644341.db2.gz	FYXUZFTXMVPUBE-UHFFFAOYSA-N	0	0	298.361	4.429	20	30		CIEDRN
C=CCN(C(=O)Nc1ccccc1OCCCC)C1CC1	ZINC000539029129	333649511	/nfs/dbraw/zinc/64/95/11/333649511.db2.gz	JWHYRKDEMTWSAO-UHFFFAOYSA-N	0	0	288.391	4.048	20	30		CIEDRN
C=CCN(C(=O)c1cc2c(ccc3ccccc23)[nH]1)C1CC1	ZINC000539034677	333649730	/nfs/dbraw/zinc/64/97/30/333649730.db2.gz	GYHMPCZEWCXATO-UHFFFAOYSA-N	0	0	290.366	4.112	20	30		CIEDRN
C=C(CC)CS[C@H](C)C(=O)Nc1cccc(SC)c1	ZINC000539094603	333657639	/nfs/dbraw/zinc/65/76/39/333657639.db2.gz	XAKNTQZQDBXBJD-GFCCVEGCSA-N	0	0	295.473	4.435	20	30		CIEDRN
C=C(CC)CSCCCc1nc(-c2cccs2)no1	ZINC000539095361	333657725	/nfs/dbraw/zinc/65/77/25/333657725.db2.gz	YITFHRXVKQPYGO-UHFFFAOYSA-N	0	0	294.445	4.430	20	30		CIEDRN
C=C(CC)CS[C@@H](C)C(=O)NCc1ccccc1Cl	ZINC000539094930	333657730	/nfs/dbraw/zinc/65/77/30/333657730.db2.gz	DBCAHJDIXOCZLD-LBPRGKRZSA-N	0	0	297.851	4.044	20	30		CIEDRN
C=C(CC)CSCC(=O)N(Cc1ccccc1)C(C)C	ZINC000539095095	333657745	/nfs/dbraw/zinc/65/77/45/333657745.db2.gz	QAWBQIROLIDBLQ-UHFFFAOYSA-N	0	0	291.460	4.123	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1ccccc1COC(C)(C)C	ZINC000539110286	333658692	/nfs/dbraw/zinc/65/86/92/333658692.db2.gz	GVJCSWRIKXFVGD-UHFFFAOYSA-N	0	0	289.419	4.040	20	30		CIEDRN
CC[C@H](C)[C@@H]1CCCCN1c1ncc(C#N)cc1Cl	ZINC000539291599	333664089	/nfs/dbraw/zinc/66/40/89/333664089.db2.gz	CZQOHVSOOVXVBJ-FZMZJTMJSA-N	0	0	277.799	4.012	20	30		CIEDRN
C=CCCOCCCCC(=O)Nc1ccc(C)cc1C	ZINC000539366313	333667660	/nfs/dbraw/zinc/66/76/60/333667660.db2.gz	MSQMRLJWSPNDLT-UHFFFAOYSA-N	0	0	275.392	4.005	20	30		CIEDRN
Cc1cc(C)cc(N(C)C(=O)c2ccc(Cl)c(C#N)c2)c1	ZINC000539368862	333667671	/nfs/dbraw/zinc/66/76/71/333667671.db2.gz	VIRONZFIZUTKOP-UHFFFAOYSA-N	0	0	298.773	4.105	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1cccc(C(=O)CC)c1	ZINC000539461839	333672762	/nfs/dbraw/zinc/67/27/62/333672762.db2.gz	ZZOIZCCQESFFPR-ZDUSSCGKSA-N	0	0	288.391	4.146	20	30		CIEDRN
C[C@@H](SCC1(C#N)CC1)c1ccccc1Cl	ZINC000539516055	333675811	/nfs/dbraw/zinc/67/58/11/333675811.db2.gz	ICNPHTWAXDFNNP-SNVBAGLBSA-N	0	0	251.782	4.438	20	30		CIEDRN
CC(C)C[C@@H]1C[C@@H](Nc2c(Cl)cccc2C#N)CCO1	ZINC000539611894	333681348	/nfs/dbraw/zinc/68/13/48/333681348.db2.gz	HHNLIXAZLVWGMD-UONOGXRCSA-N	0	0	292.810	4.217	20	30		CIEDRN
CC(C)CCCSCCCC1(C#N)CCOCC1	ZINC000539709515	333686642	/nfs/dbraw/zinc/68/66/42/333686642.db2.gz	SIXSWWIILISZDL-UHFFFAOYSA-N	0	0	269.454	4.256	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)NCc1csc2ccccc12	ZINC000539712935	333686786	/nfs/dbraw/zinc/68/67/86/333686786.db2.gz	UIYPNFVCBSIEPZ-ZDUSSCGKSA-N	0	0	288.416	4.055	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2ccc3[nH]ccc3c2)no1	ZINC000564222362	333691049	/nfs/dbraw/zinc/69/10/49/333691049.db2.gz	YRMKFORFEQRPBJ-NSHDSACASA-N	0	0	267.332	4.288	20	30		CIEDRN
C=C(CC)CS[C@H](C)C(=O)Nc1ccccc1OCC	ZINC000540193217	333720126	/nfs/dbraw/zinc/72/01/26/333720126.db2.gz	GFYUFECXPALQSB-CYBMUJFWSA-N	0	0	293.432	4.112	20	30		CIEDRN
C=CCCC[C@H](C)Sc1nnc(-c2ccco2)n1CC	ZINC000540372294	333727432	/nfs/dbraw/zinc/72/74/32/333727432.db2.gz	PKZIBVNNAHMHLV-LBPRGKRZSA-N	0	0	291.420	4.395	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)NCC(C)(C)c1cccs1	ZINC000540487381	333731820	/nfs/dbraw/zinc/73/18/20/333731820.db2.gz	RDVSVMYWILZQOQ-ZDUSSCGKSA-N	0	0	294.464	4.070	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1sc(C(C)C)nc1C	ZINC000540527105	333733952	/nfs/dbraw/zinc/73/39/52/333733952.db2.gz	UTGGHFFWNGIIJL-LLVKDONJSA-N	0	0	280.437	4.050	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)CCc1ccc(C)cc1C	ZINC000540535340	333734228	/nfs/dbraw/zinc/73/42/28/333734228.db2.gz	HRBFRCVLKGYJBD-INIZCTEOSA-N	0	0	273.420	4.097	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)CSc1ccc(Cl)cc1	ZINC000540534058	333734287	/nfs/dbraw/zinc/73/42/87/333734287.db2.gz	HGLGOOLOSHPUMD-GFCCVEGCSA-N	0	0	297.851	4.293	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1ccc(C)cc1C	ZINC000540536578	333734449	/nfs/dbraw/zinc/73/44/49/333734449.db2.gz	JNSUGEBQADXKOF-AWEZNQCLSA-N	0	0	260.381	4.170	20	30		CIEDRN
C[C@H]1Sc2ccccc2N(CCC(C)(C)C#N)[C@@H]1C	ZINC000540667870	333741259	/nfs/dbraw/zinc/74/12/59/333741259.db2.gz	OWVXKCIZJAMTTM-CHWSQXEVSA-N	0	0	274.433	4.316	20	30		CIEDRN
Cc1ccc(N[C@H](C)c2ccc(C#N)c(F)c2)cc1F	ZINC000540710169	333743028	/nfs/dbraw/zinc/74/30/28/333743028.db2.gz	JVKJIWKZULYHLI-LLVKDONJSA-N	0	0	272.298	4.318	20	30		CIEDRN
N#Cc1cccc(COc2ccc(-c3ccccc3)nc2)c1	ZINC000540858229	333750365	/nfs/dbraw/zinc/75/03/65/333750365.db2.gz	HMDGJHQMCTZDDJ-UHFFFAOYSA-N	0	0	286.334	4.199	20	30		CIEDRN
C=CCn1c(C)nnc1SCC1CCC(C)(C)CC1	ZINC000540923239	333753892	/nfs/dbraw/zinc/75/38/92/333753892.db2.gz	KTJXIDXHTVFSCJ-UHFFFAOYSA-N	0	0	279.453	4.081	20	30		CIEDRN
C=C(C)COc1cccc(NCc2ccc(C#N)cc2)c1	ZINC000129263471	333754391	/nfs/dbraw/zinc/75/43/91/333754391.db2.gz	SPQBSGLNHNLDGH-UHFFFAOYSA-N	0	0	278.355	4.125	20	30		CIEDRN
CC[C@]1(C)C[C@H]1C(=O)Nc1ccccc1SCCC#N	ZINC000129409231	333762233	/nfs/dbraw/zinc/76/22/33/333762233.db2.gz	AFHXETYJSKOJEZ-BLLLJJGKSA-N	0	0	288.416	4.067	20	30		CIEDRN
Cc1cc(CNc2cccc(C#N)c2C)cc2cccnc12	ZINC000541555128	333779935	/nfs/dbraw/zinc/77/99/35/333779935.db2.gz	MYMOLNAUEWYMPR-UHFFFAOYSA-N	0	0	287.366	4.335	20	30		CIEDRN
C=CCC[C@@H](C)Nc1ccccc1OC[C@@H]1CCCCO1	ZINC000541774705	333792034	/nfs/dbraw/zinc/79/20/34/333792034.db2.gz	YVBGMEOKOBASIZ-CVEARBPZSA-N	0	0	289.419	4.401	20	30		CIEDRN
N#Cc1ccc(OCc2c(F)cccc2F)c(Cl)c1	ZINC000129845684	333796219	/nfs/dbraw/zinc/79/62/19/333796219.db2.gz	VVLRBFOOSAQPFP-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
Cc1ccc(C(=O)N(CC#N)c2ccccc2)c(Cl)c1C	ZINC000542163561	333812779	/nfs/dbraw/zinc/81/27/79/333812779.db2.gz	OXFACPGFFHWEDP-UHFFFAOYSA-N	0	0	298.773	4.127	20	30		CIEDRN
C[C@@H]1C[C@@H](C(=O)Nc2ccccc2CC#N)CC(C)(C)C1	ZINC000567513513	333825257	/nfs/dbraw/zinc/82/52/57/333825257.db2.gz	AKUOJIIIWSFGOY-UKRRQHHQSA-N	0	0	284.403	4.154	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)c1ccc(OCCCC)cc1Cl	ZINC000542469565	333826162	/nfs/dbraw/zinc/82/61/62/333826162.db2.gz	RDGMITXGQDMMDO-GFCCVEGCSA-N	0	0	295.810	4.213	20	30		CIEDRN
C[C@H](CCC(C)(C)C)C(=O)N[C@@H](C)c1ccc(C#N)cc1	ZINC000542513020	333829715	/nfs/dbraw/zinc/82/97/15/333829715.db2.gz	CBYOUWYAOXUAPU-KGLIPLIRSA-N	0	0	286.419	4.198	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(NCc2ccc([C@H]3C[C@@H]3C)o2)c1	ZINC000542519906	333830547	/nfs/dbraw/zinc/83/05/47/333830547.db2.gz	VASVWZAGGGIAFX-ZBEGNZNMSA-N	0	0	294.354	4.089	20	30		CIEDRN
CC[C@@H](CC1CCCCC1)C(=O)N1CCC(CC#N)CC1	ZINC000542905431	333849024	/nfs/dbraw/zinc/84/90/24/333849024.db2.gz	OTVUFLLEABQOHX-KRWDZBQOSA-N	0	0	290.451	4.135	20	30		CIEDRN
C[C@H](CCC(C)(C)C)C(=O)N[C@@H](C#N)C1CCCCC1	ZINC000543453585	333876047	/nfs/dbraw/zinc/87/60/47/333876047.db2.gz	PROCVAVLVQPPQO-HIFRSBDPSA-N	0	0	278.440	4.037	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)[C@@H](C)CCC(C)(C)C	ZINC000543461652	333876545	/nfs/dbraw/zinc/87/65/45/333876545.db2.gz	QALSZRSMPYLFLC-HNNXBMFYSA-N	0	0	291.435	4.299	20	30		CIEDRN
Cc1cc(C)cc(-c2ccc(CNC[C@@H](C)C#N)cc2)c1	ZINC000543619286	333884916	/nfs/dbraw/zinc/88/49/16/333884916.db2.gz	AFNWDOYLNFDLPZ-INIZCTEOSA-N	0	0	278.399	4.220	20	30		CIEDRN
C=CCN(CC=C)Cc1cc(-c2ccc(Cl)cc2)no1	ZINC000071952052	333892652	/nfs/dbraw/zinc/89/26/52/333892652.db2.gz	HQGRYWXAVQZTOP-UHFFFAOYSA-N	0	0	288.778	4.169	20	30		CIEDRN
C=CCCN[C@H](c1ccc(OC(F)F)cc1)C(F)(F)F	ZINC000543753935	333895696	/nfs/dbraw/zinc/89/56/96/333895696.db2.gz	KQHWXNNHDQPNNJ-LLVKDONJSA-N	0	0	295.251	4.057	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(Br)cc1Cl	ZINC000072080251	333903168	/nfs/dbraw/zinc/90/31/68/333903168.db2.gz	LVHDKCGHLYBYTK-UHFFFAOYSA-N	0	0	288.572	4.007	20	30		CIEDRN
CCn1c2ccccc2nc1[C@H](C)Nc1ccc(C#N)cc1	ZINC000544026253	333911270	/nfs/dbraw/zinc/91/12/70/333911270.db2.gz	POAZUEPZJFWAGD-ZDUSSCGKSA-N	0	0	290.370	4.101	20	30		CIEDRN
CSc1ccc(C)c(NCc2cccc(C#N)c2F)c1	ZINC000544084236	333915152	/nfs/dbraw/zinc/91/51/52/333915152.db2.gz	QQYBIHSVGZOBBS-UHFFFAOYSA-N	0	0	286.375	4.340	20	30		CIEDRN
C=CCCO[C@@H](C)c1nc(CCC2CCCCC2)no1	ZINC000544128666	333917778	/nfs/dbraw/zinc/91/77/78/333917778.db2.gz	MSCMXDYOKWENLB-ZDUSSCGKSA-N	0	0	278.396	4.236	20	30		CIEDRN
Cc1cc(C#N)ccc1OCc1ncc(-c2cccs2)o1	ZINC000131393853	333933581	/nfs/dbraw/zinc/93/35/81/333933581.db2.gz	RIKCUVAXVDFGBE-UHFFFAOYSA-N	0	0	296.351	4.162	20	30		CIEDRN
C=CCCO[C@@H](C)c1nc(C[C@H](C)c2ccccc2)no1	ZINC000545052016	333960263	/nfs/dbraw/zinc/96/02/63/333960263.db2.gz	SZVXCTXRWSLUEN-KBPBESRZSA-N	0	0	286.375	4.070	20	30		CIEDRN
C[C@@H](Cc1noc(-c2ccc(C#N)s2)n1)c1ccccc1	ZINC000545052521	333960265	/nfs/dbraw/zinc/96/02/65/333960265.db2.gz	JRYMTGGDIGZCEI-NSHDSACASA-N	0	0	295.367	4.016	20	30		CIEDRN
CCCn1ccc2ccc(NC(=O)C3(C#N)CCCC3)cc21	ZINC000073141475	333968472	/nfs/dbraw/zinc/96/84/72/333968472.db2.gz	UQQCQFAWVUMZOB-UHFFFAOYSA-N	0	0	295.386	4.074	20	30		CIEDRN
C=CCC(CC=C)c1nc(-c2ccccc2C)no1	ZINC000545550576	333988035	/nfs/dbraw/zinc/98/80/35/333988035.db2.gz	UCYNOHMBZAAERJ-UHFFFAOYSA-N	0	0	254.333	4.281	20	30		CIEDRN
C[C@H]1CCCC[C@H]1c1noc(-c2cccc(CC#N)c2)n1	ZINC000545692261	333995162	/nfs/dbraw/zinc/99/51/62/333995162.db2.gz	ZDBRXXVJOCHUQC-SWLSCSKDSA-N	0	0	281.359	4.096	20	30		CIEDRN
C/C(=C\c1cccc(C(F)(F)F)c1)CN(C)[C@@H](C)CC#N	ZINC000564294864	334002807	/nfs/dbraw/zinc/00/28/07/334002807.db2.gz	LBLDZHQONRXPKK-SRXBQZRASA-N	0	0	296.336	4.343	20	30		CIEDRN
CC[C@H](CC1CCCC1)C(=O)N(C)Cc1ccc(C#N)cc1	ZINC000074436209	334005858	/nfs/dbraw/zinc/00/58/58/334005858.db2.gz	CFRFDIAJMCWYMO-GOSISDBHSA-N	0	0	298.430	4.123	20	30		CIEDRN
N#CCc1ccnc(NCc2cc(Cl)cc(Cl)c2)c1	ZINC000545927819	334006906	/nfs/dbraw/zinc/00/69/06/334006906.db2.gz	SGWRKGHPXGWMAO-UHFFFAOYSA-N	0	0	292.169	4.067	20	30		CIEDRN
C=C[C@@H](CC(=O)N[C@@H](CC)CC(F)(F)F)c1ccccc1	ZINC000546169448	334018038	/nfs/dbraw/zinc/01/80/38/334018038.db2.gz	UVWRTBFUNWQBQM-JSGCOSHPSA-N	0	0	299.336	4.194	20	30		CIEDRN
N#Cc1cccc(/C=C/c2nc(CC3=CCCCC3)no2)c1	ZINC000546276015	334024449	/nfs/dbraw/zinc/02/44/49/334024449.db2.gz	BBGIBANPJINESD-MDZDMXLPSA-N	0	0	291.354	4.155	20	30		CIEDRN
N#CCSCCCS[C@@H]1CCCc2ccccc21	ZINC000075076436	334027300	/nfs/dbraw/zinc/02/73/00/334027300.db2.gz	HJIRWAKESUUZMI-OAHLLOKOSA-N	0	0	277.458	4.444	20	30		CIEDRN
CC(C)(C)c1ccc(CNc2cc(CC#N)ccn2)s1	ZINC000546634071	334042300	/nfs/dbraw/zinc/04/23/00/334042300.db2.gz	XJYNSOKWBYSXAS-UHFFFAOYSA-N	0	0	285.416	4.119	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N[C@@H](C)c1c(F)cccc1Cl	ZINC000546667737	334044833	/nfs/dbraw/zinc/04/48/33/334044833.db2.gz	UVFXCOPUWICOIV-QWRGUYRKSA-N	0	0	298.789	4.194	20	30		CIEDRN
CCc1ccccc1-c1noc(-c2cccc(CC#N)c2)n1	ZINC000547013072	334061815	/nfs/dbraw/zinc/06/18/15/334061815.db2.gz	ZCOPRWATNXAJIK-UHFFFAOYSA-N	0	0	289.338	4.032	20	30		CIEDRN
C=CCC(CC=C)c1nc(-c2ccc(COC)cc2)no1	ZINC000547050147	334063916	/nfs/dbraw/zinc/06/39/16/334063916.db2.gz	HAQBDVNUDZWUDH-UHFFFAOYSA-N	0	0	284.359	4.119	20	30		CIEDRN
C=CCC(CC=C)c1nc([C@H]2CCOc3ccccc32)no1	ZINC000547102049	334066606	/nfs/dbraw/zinc/06/66/06/334066606.db2.gz	ZWSVBQYKNYZBGN-HNNXBMFYSA-N	0	0	296.370	4.220	20	30		CIEDRN
C=CCCO[C@H](C)c1nc(-c2cc(C)cc(C)c2)no1	ZINC000547103174	334066656	/nfs/dbraw/zinc/06/66/56/334066656.db2.gz	ZEDCQUVUIXAQHV-CYBMUJFWSA-N	0	0	272.348	4.007	20	30		CIEDRN
C=CCCCc1nc([C@H](C)c2c(F)cccc2F)no1	ZINC000547130545	334068435	/nfs/dbraw/zinc/06/84/35/334068435.db2.gz	PRIGRUSFNMGDBO-SNVBAGLBSA-N	0	0	278.302	4.008	20	30		CIEDRN
C=CCC[C@@H](NC(=O)C1CCCC1)c1ccccc1	ZINC000133939302	334073859	/nfs/dbraw/zinc/07/38/59/334073859.db2.gz	TZAYUUQAUWWMGT-MRXNPFEDSA-N	0	0	257.377	4.000	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc2nn(C(C)C)cc2c1	ZINC000134112916	334080633	/nfs/dbraw/zinc/08/06/33/334080633.db2.gz	AIHNEUGDHFETGC-UHFFFAOYSA-N	0	0	297.402	4.324	20	30		CIEDRN
CC[C@H](C)N(C(=O)c1ccc(Cl)c(C#N)c1)[C@@H](C)CC	ZINC000547348260	334082258	/nfs/dbraw/zinc/08/22/58/334082258.db2.gz	IHGFBVZTQCRSIR-RYUDHWBXSA-N	0	0	292.810	4.251	20	30		CIEDRN
N#Cc1ccc(N[C@H]2CCc3cc(F)ccc32)cc1Cl	ZINC000134508303	334092505	/nfs/dbraw/zinc/09/25/05/334092505.db2.gz	ZFQJQRHUFJAUSU-INIZCTEOSA-N	0	0	286.737	4.450	20	30		CIEDRN
N#Cc1ccc(N[C@@H]2CCc3cc(F)ccc32)cc1Cl	ZINC000134508279	334092632	/nfs/dbraw/zinc/09/26/32/334092632.db2.gz	ZFQJQRHUFJAUSU-MRXNPFEDSA-N	0	0	286.737	4.450	20	30		CIEDRN
CCSc1cccc(C(=O)Nc2cc(C#N)ccc2C)c1	ZINC000134536233	334094134	/nfs/dbraw/zinc/09/41/34/334094134.db2.gz	ACEKPKGLIIQGBR-UHFFFAOYSA-N	0	0	296.395	4.231	20	30		CIEDRN
CCCC[C@@H](CCC)NC(=O)N1CCC(CCC#N)CC1	ZINC000564322919	334094938	/nfs/dbraw/zinc/09/49/38/334094938.db2.gz	CNOHXFAAQWDOSS-MRXNPFEDSA-N	0	0	293.455	4.071	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1cccc2cc[nH]c21	ZINC000547526867	334098651	/nfs/dbraw/zinc/09/86/51/334098651.db2.gz	JAXDCKAJKHGILE-GFCCVEGCSA-N	0	0	271.364	4.034	20	30		CIEDRN
C=CCCNc1cccc(NC(=O)c2ccccc2)c1C	ZINC000077245402	334099803	/nfs/dbraw/zinc/09/98/03/334099803.db2.gz	WVICYDFFUYVKED-UHFFFAOYSA-N	0	0	280.371	4.235	20	30		CIEDRN
N#Cc1ccc(Cl)cc1NC[C@@H]1CCOc2ccccc21	ZINC000134826070	334105276	/nfs/dbraw/zinc/10/52/76/334105276.db2.gz	CIBHPWGNZJSUDT-ZDUSSCGKSA-N	0	0	298.773	4.190	20	30		CIEDRN
C=CCCC[C@@H](C)N1CCO[C@H](c2ccc(F)cc2F)C1	ZINC000547648057	334105524	/nfs/dbraw/zinc/10/55/24/334105524.db2.gz	SUBCCBZWYDTEMH-DYVFJYSZSA-N	0	0	295.373	4.083	20	30		CIEDRN
C=CCC[C@H](C(=O)NCCCC1CC1)c1ccccc1	ZINC000547651953	334106132	/nfs/dbraw/zinc/10/61/32/334106132.db2.gz	JKSJCJHIFKTVPW-KRWDZBQOSA-N	0	0	271.404	4.043	20	30		CIEDRN
C=CCN(Cc1csc(C2CC2)n1)Cc1ccccc1	ZINC000134878160	334106835	/nfs/dbraw/zinc/10/68/35/334106835.db2.gz	YPPYHVOZMWYGSA-UHFFFAOYSA-N	0	0	284.428	4.209	20	30		CIEDRN
C=CCCCN(C)C(=O)N[C@@H](CC)c1cc(F)ccc1F	ZINC000077857944	334116987	/nfs/dbraw/zinc/11/69/87/334116987.db2.gz	QRXXCNKQWPKOOZ-HNNXBMFYSA-N	0	0	296.361	4.024	20	30		CIEDRN
CC(C)CCN(CCC#N)Cc1ccccc1C(C)(C)C#N	ZINC000135253385	334121878	/nfs/dbraw/zinc/12/18/78/334121878.db2.gz	KLBXQQRHOWVNCV-UHFFFAOYSA-N	0	0	297.446	4.250	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@@H](CC)c1ccc(C)cc1	ZINC000078318562	334130983	/nfs/dbraw/zinc/13/09/83/334130983.db2.gz	QYSSTHSPKCCEIS-INIZCTEOSA-N	0	0	274.408	4.054	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@@H](C)Cc1ccsc1)c1ccccc1	ZINC000547953919	334131198	/nfs/dbraw/zinc/13/11/98/334131198.db2.gz	CQXYRUPNSNVCJP-WMLDXEAASA-N	0	0	299.439	4.155	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@H]1CCSc2ccc(F)cc21	ZINC000135501631	334132074	/nfs/dbraw/zinc/13/20/74/334132074.db2.gz	IPEPPCRHDDBCEY-BBRMVZONSA-N	0	0	293.407	4.081	20	30		CIEDRN
CCc1ccccc1NC(=O)N(CCC#N)CCC(C)C	ZINC000078462836	334133951	/nfs/dbraw/zinc/13/39/51/334133951.db2.gz	GWUVSSRNONJKQG-UHFFFAOYSA-N	0	0	287.407	4.043	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N[C@H](C(C)(C)C)C(F)(F)F	ZINC000548183801	334145741	/nfs/dbraw/zinc/14/57/41/334145741.db2.gz	OWDSYMMNHIJKFI-GHMZBOCLSA-N	0	0	294.361	4.007	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CCCCC[C@@H]1C)c1ccccc1	ZINC000548252264	334147141	/nfs/dbraw/zinc/14/71/41/334147141.db2.gz	CSQWXCDJBYNEJS-HOTGVXAUSA-N	0	0	271.404	4.137	20	30		CIEDRN
C=CCCCCCNC(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000564348352	334152013	/nfs/dbraw/zinc/15/20/13/334152013.db2.gz	JVHZXSQDUNEWBK-KRWDZBQOSA-N	0	0	299.418	4.077	20	30		CIEDRN
Cc1cc(Cl)c(OCCCC(C)(C)C#N)cc1F	ZINC000576258941	335178906	/nfs/dbraw/zinc/17/89/06/335178906.db2.gz	QLWMHZSMWXRSQB-UHFFFAOYSA-N	0	0	269.747	4.496	20	30		CIEDRN
C=CCCCCNC(=O)N(C)[C@@H]1CCCc2ccccc21	ZINC000548435831	334156247	/nfs/dbraw/zinc/15/62/47/334156247.db2.gz	IFELHLUDJZBONW-QGZVFWFLSA-N	0	0	286.419	4.062	20	30		CIEDRN
N#Cc1cnccc1Oc1ccc(Cl)c(C(F)(F)F)c1	ZINC000548479674	334159401	/nfs/dbraw/zinc/15/94/01/334159401.db2.gz	PPETZOJOENBMSN-UHFFFAOYSA-N	0	0	298.651	4.418	20	30		CIEDRN
Cc1cc(NC(=O)N(C[C@H](C)C#N)C2CC2)ccc1C1CC1	ZINC000548499228	334160767	/nfs/dbraw/zinc/16/07/67/334160767.db2.gz	OKKIUSYWSGAYPT-GFCCVEGCSA-N	0	0	297.402	4.028	20	30		CIEDRN
Cc1ccccc1C[C@H](C)Nc1ccc(CC#N)cc1	ZINC000136953810	334166038	/nfs/dbraw/zinc/16/60/38/334166038.db2.gz	LLDKYLHYLWSRLE-HNNXBMFYSA-N	0	0	264.372	4.104	20	30		CIEDRN
CC1CC(C#N)(C(=O)N[C@@H]2CCC[C@H](C(C)(C)C)CC2)C1	ZINC000548708590	334166687	/nfs/dbraw/zinc/16/66/87/334166687.db2.gz	SLAKXPVOVLHRIM-QRHJNKNDSA-N	0	0	290.451	4.037	20	30		CIEDRN
CCCCC1CCC(C(=O)N(CC#N)C2CCCC2)CC1	ZINC000080212336	334167494	/nfs/dbraw/zinc/16/74/94/334167494.db2.gz	UWYHBFFZJXDZSI-UHFFFAOYSA-N	0	0	290.451	4.278	20	30		CIEDRN
C=C[C@H](CC(=O)N1CC[C@H](CC(C)C)C1)c1ccccc1	ZINC000137086428	334169665	/nfs/dbraw/zinc/16/96/65/334169665.db2.gz	YNHMDSKDOPCNEC-IAGOWNOFSA-N	0	0	285.431	4.241	20	30		CIEDRN
C=CCNC(=O)N([C@H](C)c1ccc2ccccc2c1)C1CC1	ZINC000080596232	334172662	/nfs/dbraw/zinc/17/26/62/334172662.db2.gz	GXPGWBPTBWBIQP-CQSZACIVSA-N	0	0	294.398	4.261	20	30		CIEDRN
C=CCOCCSc1nc(C(C)C)nc2ccccc21	ZINC000549066702	334184532	/nfs/dbraw/zinc/18/45/32/334184532.db2.gz	AFBDMKQNCOFOOY-UHFFFAOYSA-N	0	0	288.416	4.048	20	30		CIEDRN
C[C@@H](CC(=O)Nc1ccccc1CC#N)c1cccc(F)c1	ZINC000550100041	334213089	/nfs/dbraw/zinc/21/30/89/334213089.db2.gz	GRLPCMVQUPDFTP-ZDUSSCGKSA-N	0	0	296.345	4.024	20	30		CIEDRN
Cc1ccccc1[C@@H](C)CC(=O)Nc1ccccc1CC#N	ZINC000550101806	334213173	/nfs/dbraw/zinc/21/31/73/334213173.db2.gz	VURWKGVBVMLCDF-HNNXBMFYSA-N	0	0	292.382	4.193	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1nc2ccc(C)cc2s1	ZINC000550254039	334217394	/nfs/dbraw/zinc/21/73/94/334217394.db2.gz	MYKQAYWCPJUEHC-UHFFFAOYSA-N	0	0	274.389	4.146	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CCC[C@@H](c2ccccc2)CC1	ZINC000550547642	334224171	/nfs/dbraw/zinc/22/41/71/334224171.db2.gz	HEPXWCVOWDCPNV-QGZVFWFLSA-N	0	0	285.431	4.385	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1nc(CC)cs1)c1ccccc1	ZINC000550581848	334224811	/nfs/dbraw/zinc/22/48/11/334224811.db2.gz	FOQLUHYFZZVCDL-LBPRGKRZSA-N	0	0	286.400	4.004	20	30		CIEDRN
C=CCC(C)(C)C(=O)N(C)Cc1ccc(F)cc1Cl	ZINC000550809152	334229360	/nfs/dbraw/zinc/22/93/60/334229360.db2.gz	FAOXJGLEWWZYQO-UHFFFAOYSA-N	0	0	283.774	4.040	20	30		CIEDRN
C=CC1CCN(C(=O)[C@@H](CCc2ccccc2)C(C)C)CC1	ZINC000550961768	334234924	/nfs/dbraw/zinc/23/49/24/334234924.db2.gz	JAXNLGCEFBSLQT-IBGZPJMESA-N	0	0	299.458	4.316	20	30		CIEDRN
Cc1nc2c(cccc2OCc2ccc(Cl)cc2C#N)o1	ZINC000550992643	334235537	/nfs/dbraw/zinc/23/55/37/334235537.db2.gz	BFCMLSRJMRPNJU-UHFFFAOYSA-N	0	0	298.729	4.240	20	30		CIEDRN
C=CCC(F)(F)c1nc(-c2oc3ccccc3c2C)no1	ZINC000551052478	334237156	/nfs/dbraw/zinc/23/71/56/334237156.db2.gz	DVGGNEUDAYPGTP-UHFFFAOYSA-N	0	0	290.269	4.459	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cnc3ccccc3c2C)n1	ZINC000551110513	334238774	/nfs/dbraw/zinc/23/87/74/334238774.db2.gz	XUTSJUZGQMXVCY-UHFFFAOYSA-N	0	0	293.370	4.447	20	30		CIEDRN
C=CCC(C)(C)c1noc(C[C@@H]2CCOc3ccccc32)n1	ZINC000551138217	334239214	/nfs/dbraw/zinc/23/92/14/334239214.db2.gz	ODRLPSCRMMUZQY-ZDUSSCGKSA-N	0	0	298.386	4.032	20	30		CIEDRN
C=CCC(C)(C)c1noc(Cc2cccc(Cl)c2F)n1	ZINC000551139693	334239234	/nfs/dbraw/zinc/23/92/34/334239234.db2.gz	JOPWCKLVXUQXPI-UHFFFAOYSA-N	0	0	294.757	4.307	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H]2C[C@@]23CCc2ccccc23)n1	ZINC000551140879	334239393	/nfs/dbraw/zinc/23/93/93/334239393.db2.gz	XNPKTTQXMSEJHF-HNAYVOBHSA-N	0	0	294.398	4.295	20	30		CIEDRN
CC[C@@H]1CCCC[C@H]1c1noc(-c2cc(C#N)oc2C)n1	ZINC000551184181	334240319	/nfs/dbraw/zinc/24/03/19/334240319.db2.gz	FOGZFAAQJLUCNP-DGCLKSJQSA-N	0	0	285.347	4.194	20	30		CIEDRN
CCOc1cc(NCc2ccc(C#N)cc2F)ccc1C	ZINC000551230147	334241733	/nfs/dbraw/zinc/24/17/33/334241733.db2.gz	MKDNNRHPWWBZAO-UHFFFAOYSA-N	0	0	284.334	4.017	20	30		CIEDRN
C=CCC[C@H](NC(=O)[C@@H]1CC=CC[C@H]1C)c1ccccc1	ZINC000551297531	334245555	/nfs/dbraw/zinc/24/55/55/334245555.db2.gz	GJSUPDUSRMOWEZ-NXHRZFHOSA-N	0	0	283.415	4.412	20	30		CIEDRN
C=CCC[C@@H](NC(=O)[C@@H]1CC=CC[C@H]1C)c1ccccc1	ZINC000551297530	334245710	/nfs/dbraw/zinc/24/57/10/334245710.db2.gz	GJSUPDUSRMOWEZ-KBAYOESNSA-N	0	0	283.415	4.412	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)CC2CC(C)(C)C2)cc1	ZINC000551323206	334247016	/nfs/dbraw/zinc/24/70/16/334247016.db2.gz	SPBSPFXQTVHLFH-UHFFFAOYSA-N	0	0	284.403	4.253	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H](CC)c1ccc(F)cc1F	ZINC000551344897	334247490	/nfs/dbraw/zinc/24/74/90/334247490.db2.gz	YZGHLTFQZCUDBO-CQSZACIVSA-N	0	0	281.346	4.134	20	30		CIEDRN
C=CCC(C)(C)c1noc(C(F)(F)Cc2ccccc2)n1	ZINC000551493531	334251531	/nfs/dbraw/zinc/25/15/31/334251531.db2.gz	ZLMWZRMFNRZYFA-UHFFFAOYSA-N	0	0	292.329	4.258	20	30		CIEDRN
C=CCC(C)(C)c1noc(CCC(=O)c2ccc(C)cc2)n1	ZINC000551497965	334251678	/nfs/dbraw/zinc/25/16/78/334251678.db2.gz	JGMMUWLPIORPTF-UHFFFAOYSA-N	0	0	298.386	4.047	20	30		CIEDRN
C=C(C)[C@H]1OCC[C@H]1c1nc([C@@H]2CCCC[C@H]2CC)no1	ZINC000551534538	334253416	/nfs/dbraw/zinc/25/34/16/334253416.db2.gz	NNYHONKRTBBCQM-KBUPBQIOSA-N	0	0	290.407	4.202	20	30		CIEDRN
C=CCN(CCc1ccccc1)C(=O)c1occc1C(C)C	ZINC000551560825	334254419	/nfs/dbraw/zinc/25/44/19/334254419.db2.gz	LNXXAQNZMVYECT-UHFFFAOYSA-N	0	0	297.398	4.274	20	30		CIEDRN
CCC(CC)[C@@H](C)C(=O)N(C)c1cc(Cl)ccc1C#N	ZINC000551683361	334257731	/nfs/dbraw/zinc/25/77/31/334257731.db2.gz	RMFARQNOFYOBAZ-LLVKDONJSA-N	0	0	292.810	4.247	20	30		CIEDRN
C=CCC[C@H](Nc1ccc(OC(F)F)nc1)c1ccco1	ZINC000552054448	334282384	/nfs/dbraw/zinc/28/23/84/334282384.db2.gz	YKVNNIXPOWFSRL-LBPRGKRZSA-N	0	0	294.301	4.395	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@H](C)Cn1ccc2ccccc21	ZINC000552152380	334295612	/nfs/dbraw/zinc/29/56/12/334295612.db2.gz	ZZHBCWWJTFUBPN-CVEARBPZSA-N	0	0	298.430	4.138	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)[C@H](C)Cn1ccc2ccccc21	ZINC000552152382	334295707	/nfs/dbraw/zinc/29/57/07/334295707.db2.gz	ZZHBCWWJTFUBPN-HZPDHXFCSA-N	0	0	298.430	4.138	20	30		CIEDRN
CC(C)(C(=O)Nc1ccc(C#N)cc1)c1ccccc1Cl	ZINC000248174094	334296389	/nfs/dbraw/zinc/29/63/89/334296389.db2.gz	USZDTLURIVHLIV-UHFFFAOYSA-N	0	0	298.773	4.128	20	30		CIEDRN
CCN(C(=O)[C@@H]1C[C@]1(C)C(C)C)[C@H](C)c1ccc(C#N)cc1	ZINC000249399196	334333216	/nfs/dbraw/zinc/33/32/16/334333216.db2.gz	BSDFMBLUHUIIBY-DKSSEZFCSA-N	0	0	298.430	4.150	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1coc2ccc(CC)cc21	ZINC000552550657	334334981	/nfs/dbraw/zinc/33/49/81/334334981.db2.gz	HRLAQLYXGSNJRM-AWEZNQCLSA-N	0	0	283.371	4.176	20	30		CIEDRN
C=CCC(CC=C)C(=O)NC[C@H]1CCCCC(F)(F)C1	ZINC000552653239	334341225	/nfs/dbraw/zinc/34/12/25/334341225.db2.gz	RMYZJKIXPRLIAK-ZDUSSCGKSA-N	0	0	285.378	4.087	20	30		CIEDRN
CC#CCCCC(=O)N1CCC[C@@](C)(c2ccccc2)CC1	ZINC000552833361	334347149	/nfs/dbraw/zinc/34/71/49/334347149.db2.gz	QLLAMEUMASDVOD-HXUWFJFHSA-N	0	0	297.442	4.150	20	30		CIEDRN
COCCCCOc1ccc(Oc2ccc(C#N)cc2)cc1	ZINC000089739179	334349435	/nfs/dbraw/zinc/34/94/35/334349435.db2.gz	AJQYAKZVGSXZSZ-UHFFFAOYSA-N	0	0	297.354	4.156	20	30		CIEDRN
C=CC1CCN(C(=O)CCCCC(C)(C)C)CC1	ZINC000552951672	334352546	/nfs/dbraw/zinc/35/25/46/334352546.db2.gz	DSGPJPSCNIZAKE-UHFFFAOYSA-N	0	0	251.414	4.018	20	30		CIEDRN
Cc1ccc([C@@H]2CCCN2c2nccc(C#N)c2Cl)cc1	ZINC000552976188	334354257	/nfs/dbraw/zinc/35/42/57/334354257.db2.gz	NGDAVVJORAQZSD-HNNXBMFYSA-N	0	0	297.789	4.257	20	30		CIEDRN
C=CCCc1csc(-c2ccc(NC(=O)CC)cc2)n1	ZINC000090065519	334356576	/nfs/dbraw/zinc/35/65/76/334356576.db2.gz	DWOFJUWKBCFLAS-UHFFFAOYSA-N	0	0	286.400	4.277	20	30		CIEDRN
C[C@@H](NCC#Cc1ccc(C(F)(F)F)cc1)c1ccco1	ZINC000090180656	334358384	/nfs/dbraw/zinc/35/83/84/334358384.db2.gz	WUTSBBRAADCBHM-GFCCVEGCSA-N	0	0	293.288	4.001	20	30		CIEDRN
C[C@H](NCC#Cc1ccc(C(F)(F)F)cc1)c1ccco1	ZINC000090180655	334358417	/nfs/dbraw/zinc/35/84/17/334358417.db2.gz	WUTSBBRAADCBHM-LBPRGKRZSA-N	0	0	293.288	4.001	20	30		CIEDRN
C=CCN(C(=O)c1ccccc1Cc1ccccc1)C1CC1	ZINC000553091370	334360824	/nfs/dbraw/zinc/36/08/24/334360824.db2.gz	SPGVWOOITLIHMX-UHFFFAOYSA-N	0	0	291.394	4.068	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N([C@H](C)c1ccccc1)C1CC1	ZINC000553139283	334364336	/nfs/dbraw/zinc/36/43/36/334364336.db2.gz	IHKRDICCRLGMFB-HUUCEWRRSA-N	0	0	271.404	4.341	20	30		CIEDRN
C=CCCCC(=O)N([C@H](C)c1ccccc1)C1CC1	ZINC000553142352	334364366	/nfs/dbraw/zinc/36/43/66/334364366.db2.gz	YCPRRBVUVLYDKT-CQSZACIVSA-N	0	0	257.377	4.095	20	30		CIEDRN
CCC[C@@H]1[C@@H](C)CCCN1c1nccc(C#N)c1Cl	ZINC000553154894	334365434	/nfs/dbraw/zinc/36/54/34/334365434.db2.gz	SMAGKCWIHOIUID-WCQYABFASA-N	0	0	277.799	4.012	20	30		CIEDRN
CCC[C@@H]1[C@H](C)CCCN1c1nccc(C#N)c1Cl	ZINC000553154893	334365601	/nfs/dbraw/zinc/36/56/01/334365601.db2.gz	SMAGKCWIHOIUID-DGCLKSJQSA-N	0	0	277.799	4.012	20	30		CIEDRN
C=CCC[C@H](Nc1cc(C#N)ccn1)c1ccccc1	ZINC000553172610	334366500	/nfs/dbraw/zinc/36/65/00/334366500.db2.gz	VDIBIJIGSBHCPS-INIZCTEOSA-N	0	0	263.344	4.073	20	30		CIEDRN
N#CC1CCC(CNc2ncc(Cl)cc2Cl)CC1	ZINC000553208637	334369266	/nfs/dbraw/zinc/36/92/66/334369266.db2.gz	SEKZSOSUAQHZAY-UHFFFAOYSA-N	0	0	284.190	4.130	20	30		CIEDRN
C=CCCC[C@H](C)Sc1nccn1Cc1ccccn1	ZINC000553253674	334371806	/nfs/dbraw/zinc/37/18/06/334371806.db2.gz	VVZKATYQXGTIDS-AWEZNQCLSA-N	0	0	287.432	4.163	20	30		CIEDRN
CC[C@@H](Nc1cc(C#N)ccn1)c1cccc(Cl)c1	ZINC000553397124	334382436	/nfs/dbraw/zinc/38/24/36/334382436.db2.gz	PBXYNGRCEKACQX-CQSZACIVSA-N	0	0	271.751	4.170	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H]1CCCc2sc(Cl)cc21	ZINC000553490761	334388133	/nfs/dbraw/zinc/38/81/33/334388133.db2.gz	QKPAMBUYHFTIAY-IAQYHMDHSA-N	0	0	297.851	4.497	20	30		CIEDRN
C[C@H]1CC[C@H](Nc2cc(C#N)c3ccccc3n2)CC1	ZINC000252894359	334399210	/nfs/dbraw/zinc/39/92/10/334399210.db2.gz	VDLAIOHPLRRQOO-MQMHXKEQSA-N	0	0	265.360	4.097	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(-c2ccc3[nH]ccc3c2)no1	ZINC000554792669	334452892	/nfs/dbraw/zinc/45/28/92/334452892.db2.gz	LAGFAVGWBIGEME-INIZCTEOSA-N	0	0	267.332	4.072	20	30		CIEDRN
CC[C@H]1CCCN1C(=O)c1sc2ccc(C#N)cc2c1C	ZINC000555801006	334489584	/nfs/dbraw/zinc/48/95/84/334489584.db2.gz	GZKXRSZUWKHMBH-ZDUSSCGKSA-N	0	0	298.411	4.096	20	30		CIEDRN
C=CCC(F)(F)c1nc([C@H]2CCCC[C@H]2C)no1	ZINC000556292203	334507058	/nfs/dbraw/zinc/50/70/58/334507058.db2.gz	IKBHFBXKPVDPIR-ZJUUUORDSA-N	0	0	256.296	4.031	20	30		CIEDRN
Cc1cc(C)c(C#N)c(NCc2ccc3sccc3c2)n1	ZINC000564566982	334512093	/nfs/dbraw/zinc/51/20/93/334512093.db2.gz	HAUBWHBZXOWXJQ-UHFFFAOYSA-N	0	0	293.395	4.397	20	30		CIEDRN
C=CCCC1(C(=O)N2CCc3sc(Cl)cc3C2)CC1	ZINC000565006990	334534182	/nfs/dbraw/zinc/53/41/82/334534182.db2.gz	GDBLILZISYKCBD-UHFFFAOYSA-N	0	0	295.835	4.033	20	30		CIEDRN
C=C(C)CCc1noc([C@@H]2C[C@@H]2c2ccc(F)cc2F)n1	ZINC000565389661	334558770	/nfs/dbraw/zinc/55/87/70/334558770.db2.gz	FZUPLJRNILNVNV-CHWSQXEVSA-N	0	0	290.313	4.128	20	30		CIEDRN
C=CCCOCCCCc1nc(C2(CC)CCCC2)no1	ZINC000565519808	334570676	/nfs/dbraw/zinc/57/06/76/334570676.db2.gz	WILZEIFWVREQEI-UHFFFAOYSA-N	0	0	292.423	4.207	20	30		CIEDRN
N#Cc1ccc(C(=O)Nc2ccc(Cl)cc2)cc1Cl	ZINC000153480881	334607816	/nfs/dbraw/zinc/60/78/16/334607816.db2.gz	JKAUWIZSDQEKKZ-UHFFFAOYSA-N	0	0	291.137	4.117	20	30		CIEDRN
Cc1cc(CNc2cccc3c2OC(C)(C)C3)ccc1C#N	ZINC000565931171	334609508	/nfs/dbraw/zinc/60/95/08/334609508.db2.gz	NNXOJQSTMVHJGA-UHFFFAOYSA-N	0	0	292.382	4.192	20	30		CIEDRN
C=C(C)CCc1noc(-c2nsc3ccc(C)cc32)n1	ZINC000566395568	334645829	/nfs/dbraw/zinc/64/58/29/334645829.db2.gz	KCADSSHBLHIAOA-UHFFFAOYSA-N	0	0	285.372	4.163	20	30		CIEDRN
C[C@@H](CNc1cccc(C(F)F)c1C#N)C(F)(F)F	ZINC000566485969	334651887	/nfs/dbraw/zinc/65/18/87/334651887.db2.gz	YCLKQSQALSWKOR-ZETCQYMHSA-N	0	0	278.224	4.106	20	30		CIEDRN
C=C[C@](C)(CC)c1nc([C@@H](C)c2cccs2)no1	ZINC000566940179	334670416	/nfs/dbraw/zinc/67/04/16/334670416.db2.gz	SHTHUCDSPJAPBU-IINYFYTJSA-N	0	0	262.378	4.137	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@@H](CC)c1cccc(OC)c1	ZINC000567016736	334673345	/nfs/dbraw/zinc/67/33/45/334673345.db2.gz	FWTDCVFGOVIDAT-PBHICJAKSA-N	0	0	289.419	4.207	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)[C@H]1CCC(C)=C(C)C1	ZINC000567112148	334682187	/nfs/dbraw/zinc/68/21/87/334682187.db2.gz	NTGUHHWMDPCMAL-HNNXBMFYSA-N	0	0	276.424	4.102	20	30		CIEDRN
C=CCCCCSc1nnc(-c2ccoc2C)o1	ZINC000567122100	334682898	/nfs/dbraw/zinc/68/28/98/334682898.db2.gz	HXXXVAZHQCUPRY-UHFFFAOYSA-N	0	0	264.350	4.086	20	30		CIEDRN
CCc1ccc([C@@H]2C[C@@H](C)CCN2c2ccnc(C#N)c2)o1	ZINC000567188459	334688774	/nfs/dbraw/zinc/68/87/74/334688774.db2.gz	SFYFLHJOCCCXML-GUYCJALGSA-N	0	0	295.386	4.086	20	30		CIEDRN
CCc1ccc([C@H]2C[C@@H](C)CCN2c2ccnc(C#N)c2)o1	ZINC000567188460	334688877	/nfs/dbraw/zinc/68/88/77/334688877.db2.gz	SFYFLHJOCCCXML-SUMWQHHRSA-N	0	0	295.386	4.086	20	30		CIEDRN
C=CC1CCN(C(=O)CCC(C)(C)c2ccccc2)CC1	ZINC000154188778	334690172	/nfs/dbraw/zinc/69/01/72/334690172.db2.gz	JPIGRXZMEJCYKR-UHFFFAOYSA-N	0	0	285.431	4.169	20	30		CIEDRN
CC(C)CC1(C)CCN(C(=O)Nc2ccc(C#N)cc2)CC1	ZINC000567273147	334700041	/nfs/dbraw/zinc/70/00/41/334700041.db2.gz	YXUADIUSJHNRQP-UHFFFAOYSA-N	0	0	299.418	4.238	20	30		CIEDRN
C=CCCSCC(=O)N(C)[C@H](C)c1ccc(Cl)cc1	ZINC000154974049	334709597	/nfs/dbraw/zinc/70/95/97/334709597.db2.gz	XQHSRSGSVLGYBQ-GFCCVEGCSA-N	0	0	297.851	4.169	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)CCCc1csc2ccccc12	ZINC000155302553	334718860	/nfs/dbraw/zinc/71/88/60/334718860.db2.gz	PVBQYQAMPADDIM-CYBMUJFWSA-N	0	0	287.428	4.305	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1ccc2ccccc2n1	ZINC000156839819	334751530	/nfs/dbraw/zinc/75/15/30/334751530.db2.gz	DRRQMRSYECWJAK-UHFFFAOYSA-N	0	0	282.387	4.053	20	30		CIEDRN
N#Cc1csc(CN2CCCSc3ccccc32)c1	ZINC000567803695	334762500	/nfs/dbraw/zinc/76/25/00/334762500.db2.gz	QKCFGDGDNWIHJW-UHFFFAOYSA-N	0	0	286.425	4.122	20	30		CIEDRN
C=CCCCn1c(C)c(C(C)C)c(=O)c2ccccc21	ZINC000568048939	334787462	/nfs/dbraw/zinc/78/74/62/334787462.db2.gz	CPYGNNASXMIUMX-UHFFFAOYSA-N	0	0	269.388	4.400	20	30		CIEDRN
Cc1ccc(C#N)c(S[C@@H]2CCCc3ccccc32)n1	ZINC000568055249	334787946	/nfs/dbraw/zinc/78/79/46/334787946.db2.gz	QJAZYYRCSHVYPS-MRXNPFEDSA-N	0	0	280.396	4.431	20	30		CIEDRN
CC#CCCCc1nc(-c2ccc(OC(C)(C)C)cc2)no1	ZINC000568094425	334791471	/nfs/dbraw/zinc/79/14/71/334791471.db2.gz	FTEKOFWNLSVBPB-UHFFFAOYSA-N	0	0	298.386	4.260	20	30		CIEDRN
C=CCCC1(C(=O)N(C)[C@H]2CCCc3ccccc32)CC1	ZINC000568462547	334826026	/nfs/dbraw/zinc/82/60/26/334826026.db2.gz	GKIZCPPGBUXRCG-KRWDZBQOSA-N	0	0	283.415	4.269	20	30		CIEDRN
C=CCC1(c2nc(-c3ccc4c(n3)CCCC4)no2)CCC1	ZINC000568560887	334830464	/nfs/dbraw/zinc/83/04/64/334830464.db2.gz	AJSSXEUVPHCHSJ-UHFFFAOYSA-N	0	0	295.386	4.008	20	30		CIEDRN
C=CCCCCCNC(=O)N(CC)Cc1cccs1	ZINC000569017940	334851638	/nfs/dbraw/zinc/85/16/38/334851638.db2.gz	YMHLSDBHDLITBS-UHFFFAOYSA-N	0	0	280.437	4.026	20	30		CIEDRN
C=CCCC1(C(=O)N(CCC)Cc2ccc(C)cc2)CC1	ZINC000569182884	334859777	/nfs/dbraw/zinc/85/97/77/334859777.db2.gz	CLFYJPAFKSGPIN-UHFFFAOYSA-N	0	0	285.431	4.480	20	30		CIEDRN
CC1(C(=O)N[C@@H]2CCCc3cc(C#N)ccc32)CCCCC1	ZINC000572942682	334893232	/nfs/dbraw/zinc/89/32/32/334893232.db2.gz	BWXOCPIQMBXKEE-QGZVFWFLSA-N	0	0	296.414	4.022	20	30		CIEDRN
C=CCCCCCNC(=O)N(C)[C@H](C)c1cccc(C#N)c1	ZINC000573104761	334908576	/nfs/dbraw/zinc/90/85/76/334908576.db2.gz	CSOREMLRVYXCRV-OAHLLOKOSA-N	0	0	299.418	4.007	20	30		CIEDRN
CCS[C@H]1CCC[C@@H]1Nc1nc(C)c(C#N)cc1Cl	ZINC000336815926	334913551	/nfs/dbraw/zinc/91/35/51/334913551.db2.gz	JTCPTCYOUUHUAU-STQMWFEESA-N	0	0	295.839	4.001	20	30		CIEDRN
CCC(C)(C)OCc1cccc(NCCC#N)c1C	ZINC000576392972	335197662	/nfs/dbraw/zinc/19/76/62/335197662.db2.gz	KUEAMRCOGDTANF-UHFFFAOYSA-N	0	0	260.381	4.026	20	30		CIEDRN
CN(C(=O)CCCC#N)c1ccc(-c2ccccc2)cc1	ZINC000576471616	335208591	/nfs/dbraw/zinc/20/85/91/335208591.db2.gz	KCNINRKPXZWPSG-UHFFFAOYSA-N	0	0	278.355	4.010	20	30		CIEDRN
Cc1ccc(CNc2cc(C#N)ccn2)c(OC(C)(C)C)c1	ZINC000576608796	335226101	/nfs/dbraw/zinc/22/61/01/335226101.db2.gz	ZYEKILASKQPEMO-UHFFFAOYSA-N	0	0	295.386	4.051	20	30		CIEDRN
C=CCCC(=O)N(C)c1ccc(Cl)c(C(F)(F)F)c1	ZINC000576621144	335226884	/nfs/dbraw/zinc/22/68/84/335226884.db2.gz	URQLEVUTXPKYIC-UHFFFAOYSA-N	0	0	291.700	4.288	20	30		CIEDRN
CC[C@@H](SCc1ccc(C#N)cn1)c1ccccc1	ZINC000576836866	335254126	/nfs/dbraw/zinc/25/41/26/335254126.db2.gz	GAHPSSPFXAFAFG-MRXNPFEDSA-N	0	0	268.385	4.338	20	30		CIEDRN
CN(C(=O)CCCCC(C)(C)C)c1cccc(C#N)c1	ZINC000576895129	335261821	/nfs/dbraw/zinc/26/18/21/335261821.db2.gz	XSZLCQZSIWTTFA-UHFFFAOYSA-N	0	0	272.392	4.128	20	30		CIEDRN
C=CCCCCSCC1CCN(C(=O)C(C)(C)C)CC1	ZINC000576928818	335264826	/nfs/dbraw/zinc/26/48/26/335264826.db2.gz	BECQSRWKUMWRFP-UHFFFAOYSA-N	0	0	297.508	4.361	20	30		CIEDRN
Cc1ccc(-c2nnc(SCC(C)(C)CC#N)o2)cc1	ZINC000580571579	335285509	/nfs/dbraw/zinc/28/55/09/335285509.db2.gz	ATPSINJZDLPOHL-UHFFFAOYSA-N	0	0	287.388	4.077	20	30		CIEDRN
CCc1ccc([C@H](C#N)NC(=O)[C@@H](C)CC2CCCC2)cc1	ZINC000577300613	335337020	/nfs/dbraw/zinc/33/70/20/335337020.db2.gz	IVLVFTSZWAIIBN-KSSFIOAISA-N	0	0	298.430	4.146	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2ccc(F)cc2C)no1	ZINC000577305438	335337267	/nfs/dbraw/zinc/33/72/67/335337267.db2.gz	OAWHOOYBOSJWHX-LLVKDONJSA-N	0	0	260.312	4.254	20	30		CIEDRN
N#Cc1ccc(CNCc2ccc(Cl)cc2Cl)s1	ZINC000176940850	335341884	/nfs/dbraw/zinc/34/18/84/335341884.db2.gz	TYAXRIHBSNATCB-UHFFFAOYSA-N	0	0	297.210	4.216	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(-c2ccccc2COCC)no1	ZINC000577421159	335351091	/nfs/dbraw/zinc/35/10/91/335351091.db2.gz	LBMNIHCJXVSFPL-QGZVFWFLSA-N	0	0	286.375	4.127	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1nc(C(C)(C)C)co1)c1ccccc1	ZINC000577505721	335361255	/nfs/dbraw/zinc/36/12/55/335361255.db2.gz	KTSYHOHGHJGMHM-AWEZNQCLSA-N	0	0	298.386	4.271	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)CC(C)(C)C1CC1	ZINC000577513009	335363270	/nfs/dbraw/zinc/36/32/70/335363270.db2.gz	JSZVYTIINJNJAE-UHFFFAOYSA-N	0	0	277.433	4.089	20	30		CIEDRN
N#Cc1c(F)cccc1SCc1ccc(F)cc1F	ZINC000577817336	335404652	/nfs/dbraw/zinc/40/46/52/335404652.db2.gz	HTBXIAJBVRNPPL-UHFFFAOYSA-N	0	0	279.286	4.268	20	30		CIEDRN
Cc1ccc(C#N)cc1NCc1coc(-c2ccccc2)n1	ZINC000179195177	335480333	/nfs/dbraw/zinc/48/03/33/335480333.db2.gz	YWYKFFHPAZMSGY-UHFFFAOYSA-N	0	0	289.338	4.134	20	30		CIEDRN
Cc1ccc(C#N)c(SCc2ccc(C)c(C)c2)n1	ZINC000578090195	335486367	/nfs/dbraw/zinc/48/63/67/335486367.db2.gz	ZDLQJNJATNLIEU-UHFFFAOYSA-N	0	0	268.385	4.171	20	30		CIEDRN
CC(C)c1cccc(-c2ccc(C(=O)N[C@H](C)CC#N)o2)c1	ZINC000180463145	335585605	/nfs/dbraw/zinc/58/56/05/335585605.db2.gz	DUYLBUNMVICLFP-CYBMUJFWSA-N	0	0	296.370	4.102	20	30		CIEDRN
C=CC1CCN(C(=O)[C@H](C)CCCc2ccccc2)CC1	ZINC000180639600	335615097	/nfs/dbraw/zinc/61/50/97/335615097.db2.gz	RIUJUNGTAVIFNQ-MRXNPFEDSA-N	0	0	285.431	4.070	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)CCCc1ccc2ccccc2c1	ZINC000180871800	335627451	/nfs/dbraw/zinc/62/74/51/335627451.db2.gz	WDZGOZRUKCSDAQ-OAHLLOKOSA-N	0	0	281.399	4.243	20	30		CIEDRN
Cc1cc(NCC(C)(C)CCC#N)nn1-c1ccc(C)cc1	ZINC000180967807	335631512	/nfs/dbraw/zinc/63/15/12/335631512.db2.gz	XEJHJQLHNRIFAI-UHFFFAOYSA-N	0	0	296.418	4.231	20	30		CIEDRN
C[C@@H](N[C@H](C)c1ccc(C#N)cc1)c1nc2ccccc2o1	ZINC000578486491	335639959	/nfs/dbraw/zinc/63/99/59/335639959.db2.gz	OBPAQEXOSZOAOV-CHWSQXEVSA-N	0	0	291.354	4.111	20	30		CIEDRN
C=CCCC(=O)N(CCCC)[C@@H]1CCC[C@@H](C)C1	ZINC000578690018	335663797	/nfs/dbraw/zinc/66/37/97/335663797.db2.gz	DAMXLHVRJFVWSG-HUUCEWRRSA-N	0	0	251.414	4.160	20	30		CIEDRN
C=CCCC(=O)N(CCCC)[C@@H]1CCC[C@H](C)C1	ZINC000578690019	335663940	/nfs/dbraw/zinc/66/39/40/335663940.db2.gz	DAMXLHVRJFVWSG-LSDHHAIUSA-N	0	0	251.414	4.160	20	30		CIEDRN
COCC(C)(C)CCCNc1ccc(C#N)c(Cl)c1	ZINC000578910667	335689160	/nfs/dbraw/zinc/68/91/60/335689160.db2.gz	WEARFDJJKXNBIR-UHFFFAOYSA-N	0	0	280.799	4.076	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N(C)[C@@H]1CC[C@@H](SCC)C1	ZINC000181097867	335750337	/nfs/dbraw/zinc/75/03/37/335750337.db2.gz	WYTODTSSFLHDKT-RRFJBIMHSA-N	0	0	298.496	4.047	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N(c1ccccc1)c1ccccc1	ZINC000182011408	335794532	/nfs/dbraw/zinc/79/45/32/335794532.db2.gz	LHTQMGJZSWUFLE-HNNXBMFYSA-N	0	0	280.371	4.499	20	30		CIEDRN
C[C@H](CCCc1ccccc1)C(=O)Nc1sccc1C#N	ZINC000182234194	335805528	/nfs/dbraw/zinc/80/55/28/335805528.db2.gz	KLTOWIIHGLCHHX-CYBMUJFWSA-N	0	0	298.411	4.217	20	30		CIEDRN
Cc1ccc2cccc(OCc3ccc(C#N)c(F)c3)c2n1	ZINC000358981302	335809926	/nfs/dbraw/zinc/80/99/26/335809926.db2.gz	FVTUEZZPIOBMHP-UHFFFAOYSA-N	0	0	292.313	4.133	20	30		CIEDRN
C[C@@H](Nc1ccc(CC#N)cc1)c1nc2ccccc2o1	ZINC000182423350	335818687	/nfs/dbraw/zinc/81/86/87/335818687.db2.gz	MBEAOVBRNISGKW-GFCCVEGCSA-N	0	0	277.327	4.067	20	30		CIEDRN
CC(C)(CCC#N)CNC(=O)[C@@H]1CC[C@H]2CCCC[C@H]2C1	ZINC000579628858	335826666	/nfs/dbraw/zinc/82/66/66/335826666.db2.gz	GCXPMIDISHMIAP-OWCLPIDISA-N	0	0	290.451	4.039	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@@H](C)c1ccc(Cl)s1	ZINC000182620945	335831130	/nfs/dbraw/zinc/83/11/30/335831130.db2.gz	OXIDZHDGUCTXJJ-QWRGUYRKSA-N	0	0	285.840	4.366	20	30		CIEDRN
C=CCC1(c2nc(-c3ccccc3C)no2)CCC1	ZINC000579642728	335831361	/nfs/dbraw/zinc/83/13/61/335831361.db2.gz	UKAZKWUKXRHLGK-UHFFFAOYSA-N	0	0	254.333	4.043	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@H]1C[C@@H]1c1sccc1C	ZINC000182628994	335831920	/nfs/dbraw/zinc/83/19/20/335831920.db2.gz	ZVVBRHFUTQTREC-IHRRRGAJSA-N	0	0	277.433	4.021	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)C[C@H](C)c1ccccc1OC	ZINC000182632131	335832140	/nfs/dbraw/zinc/83/21/40/335832140.db2.gz	SGTAVZSCKKYMIZ-LSDHHAIUSA-N	0	0	289.419	4.050	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H](CC(C)(C)C)C(F)(F)F	ZINC000182987091	335854830	/nfs/dbraw/zinc/85/48/30/335854830.db2.gz	KJEOOSXGIXGNKT-LBPRGKRZSA-N	0	0	291.357	4.238	20	30		CIEDRN
CO[C@H](CSc1ccccc1C#N)c1ccccc1	ZINC000579809500	335889516	/nfs/dbraw/zinc/88/95/16/335889516.db2.gz	DWTIJFZNEQOIBN-OAHLLOKOSA-N	0	0	269.369	4.038	20	30		CIEDRN
N#CCN[C@H](c1ccccc1)c1cc(Cl)ccc1Cl	ZINC000183734555	335904187	/nfs/dbraw/zinc/90/41/87/335904187.db2.gz	PBYGYSXGJHFAOC-OAHLLOKOSA-N	0	0	291.181	4.196	20	30		CIEDRN
C=CCC[C@H](Nc1ccc2c(c1)CCC(=O)N2CC)C1CC1	ZINC000183920392	335912719	/nfs/dbraw/zinc/91/27/19/335912719.db2.gz	VYUUPXFZJMWQDU-KRWDZBQOSA-N	0	0	298.430	4.142	20	30		CIEDRN
CCC[C@H](CC1CCCC1)C(=O)N1CCC(CC#N)CC1	ZINC000579937007	335931846	/nfs/dbraw/zinc/93/18/46/335931846.db2.gz	GFZVGRFSTOORPQ-QGZVFWFLSA-N	0	0	290.451	4.135	20	30		CIEDRN
C[C@H](CCc1cccc(F)c1)Nc1ccc(CC#N)cc1	ZINC000184745744	335932552	/nfs/dbraw/zinc/93/25/52/335932552.db2.gz	SNDFXKZEDMPBSV-CQSZACIVSA-N	0	0	282.362	4.325	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2c(C)cccc2SC)CC1	ZINC000185007698	335944041	/nfs/dbraw/zinc/94/40/41/335944041.db2.gz	ZTBRGAFAXFHOGP-UHFFFAOYSA-N	0	0	290.432	4.147	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(-c2ccc(Cl)cc2OC)no1	ZINC000580009952	335947374	/nfs/dbraw/zinc/94/73/74/335947374.db2.gz	PZCJRUOOUTYYTD-HNNXBMFYSA-N	0	0	292.766	4.252	20	30		CIEDRN
N#Cc1ccsc1C(=O)Nc1cc(Cl)ccc1Cl	ZINC000194589509	336030560	/nfs/dbraw/zinc/03/05/60/336030560.db2.gz	GMRPCZXUMWQFNJ-UHFFFAOYSA-N	0	0	297.166	4.179	20	30		CIEDRN
C=CCSCCNC(=O)Nc1ccccc1C(C)(C)C	ZINC000194596866	336030875	/nfs/dbraw/zinc/03/08/75/336030875.db2.gz	UOMBSIDJCANRCE-UHFFFAOYSA-N	0	0	292.448	4.025	20	30		CIEDRN
C=CCN(Cc1cccs1)Cc1cc(F)ccc1F	ZINC000195661753	336057677	/nfs/dbraw/zinc/05/76/77/336057677.db2.gz	MXNBSFCCLDWTBP-UHFFFAOYSA-N	0	0	279.355	4.215	20	30		CIEDRN
N#Cc1ccc(Cl)cc1NC[C@H]1CCCCC1(F)F	ZINC000381525011	336067355	/nfs/dbraw/zinc/06/73/55/336067355.db2.gz	NSPDXFYAPJLFCG-LLVKDONJSA-N	0	0	284.737	4.449	20	30		CIEDRN
Cc1cccc(NCc2ccc(F)c(C#N)c2)c1Cl	ZINC000381776917	336072830	/nfs/dbraw/zinc/07/28/30/336072830.db2.gz	CMLRPOBUKHDVAQ-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
Cc1csc(CNc2ccc(Cl)cc2C#N)c1	ZINC000383271685	336106843	/nfs/dbraw/zinc/10/68/43/336106843.db2.gz	VRHWCYYHVIQZDZ-UHFFFAOYSA-N	0	0	262.765	4.194	20	30		CIEDRN
Cc1cc(NCCC(C)(C)C#N)c(Cl)cc1F	ZINC000383569558	336114179	/nfs/dbraw/zinc/11/41/79/336114179.db2.gz	JUQHLQNGZXJUKA-UHFFFAOYSA-N	0	0	254.736	4.139	20	30		CIEDRN
Cc1ccsc1CN(C)c1c(C#N)cnc2ccccc21	ZINC000383911421	336119233	/nfs/dbraw/zinc/11/92/33/336119233.db2.gz	FOIVEYANOFXPMH-UHFFFAOYSA-N	0	0	293.395	4.113	20	30		CIEDRN
Cc1cc(C#N)ccc1-c1nc([C@@H]2CCCC[C@H]2C)no1	ZINC000384959274	336134973	/nfs/dbraw/zinc/13/49/73/336134973.db2.gz	HCPCIUOILVOGFC-BXUZGUMPSA-N	0	0	281.359	4.210	20	30		CIEDRN
C=CCCc1nc(-c2ccc3cc(OC)ccc3c2)no1	ZINC000581757590	336142449	/nfs/dbraw/zinc/14/24/49/336142449.db2.gz	OJGNCJWQEJFNPL-UHFFFAOYSA-N	0	0	280.327	4.017	20	30		CIEDRN
CCCCC1CCC(C(=O)NCc2cccc(C#N)c2)CC1	ZINC000385814177	336157649	/nfs/dbraw/zinc/15/76/49/336157649.db2.gz	SIMCWEXQHFTMNW-UHFFFAOYSA-N	0	0	298.430	4.171	20	30		CIEDRN
CCCCCc1ccc(NCc2nc(C#N)cs2)cc1	ZINC000386170921	336167398	/nfs/dbraw/zinc/16/73/98/336167398.db2.gz	YTIAFDZQVQMTDL-UHFFFAOYSA-N	0	0	285.416	4.360	20	30		CIEDRN
Cc1nsc(Nc2cccc3ccsc32)c1C#N	ZINC000386267091	336169463	/nfs/dbraw/zinc/16/94/63/336169463.db2.gz	XWHKTBGAWPPFSL-UHFFFAOYSA-N	0	0	271.370	4.282	20	30		CIEDRN
N#Cc1ccc(Nc2cccc3ccsc32)cc1[N+](=O)[O-]	ZINC000386483345	336175597	/nfs/dbraw/zinc/17/55/97/336175597.db2.gz	XDJGGIURBHBJMH-UHFFFAOYSA-N	0	0	295.323	4.425	20	30		CIEDRN
C[C@@H](SCC1(C#N)CC1)c1cc(F)ccc1F	ZINC000344488941	533988414	/nfs/dbraw/zinc/98/84/14/533988414.db2.gz	XEGAJNKCUGDFER-SECBINFHSA-N	0	0	253.317	4.063	20	30		CIEDRN
C[C@@H](S[C@H](C)c1ccc(C#N)cc1)c1nc(C2CC2)no1	ZINC000118444189	534004537	/nfs/dbraw/zinc/00/45/37/534004537.db2.gz	FBLGMCPJWMNBLT-GHMZBOCLSA-N	0	0	299.399	4.374	20	30		CIEDRN
C[C@H](Nc1c(Cl)cccc1C#N)c1nc2ccccc2[nH]1	ZINC000301369370	534016627	/nfs/dbraw/zinc/01/66/27/534016627.db2.gz	OYFOJUVJPXEUKB-JTQLQIEISA-N	0	0	296.761	4.261	20	30		CIEDRN
C[C@H](Nc1cc(Cl)ccc1C#N)[C@@H]1COc2ccccc21	ZINC000301806090	534017549	/nfs/dbraw/zinc/01/75/49/534017549.db2.gz	AEQMDQPRVAPYAV-NHYWBVRUSA-N	0	0	298.773	4.188	20	30		CIEDRN
C[C@@H]1C[C@H]1c1ccc(CN(CCC#N)CC(C)(C)C)o1	ZINC000353421034	534051415	/nfs/dbraw/zinc/05/14/15/534051415.db2.gz	IVXXMBLHRGCRKO-UKRRQHHQSA-N	0	0	274.408	4.165	20	30		CIEDRN
Cc1cc2ccccc2c(NC(=O)N(C)CC(C)(C)C#N)c1	ZINC000334715608	534117533	/nfs/dbraw/zinc/11/75/33/534117533.db2.gz	OUGOKVPLUKGNHN-UHFFFAOYSA-N	0	0	295.386	4.162	20	30		CIEDRN
Cc1ccc(-c2ncc[nH]2)cc1NC(=O)[C@@H]1C[C@H]1C1CC1	ZINC000330050164	534218447	/nfs/dbraw/zinc/21/84/47/534218447.db2.gz	KGCQHGLYAXMDHV-UONOGXRCSA-N	0	0	281.359	4.019	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H](C)c1cccc(OC(C)C)c1	ZINC000429828177	517323430	/nfs/dbraw/zinc/32/34/30/517323430.db2.gz	DHONQFRPYYCIGX-AWEZNQCLSA-N	0	0	289.419	4.253	20	30		CIEDRN
C=CCCCNC(=O)[C@@H]1C[C@@H]1c1cccc2ccccc21	ZINC000468362147	517326704	/nfs/dbraw/zinc/32/67/04/517326704.db2.gz	NWCDUAMUMZBDQM-QZTJIDSGSA-N	0	0	279.383	4.026	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N1CCc2sccc2[C@H]1C	ZINC000537188046	517326837	/nfs/dbraw/zinc/32/68/37/517326837.db2.gz	LRKUGQHFNOREPF-QWHCGFSZSA-N	0	0	292.448	4.122	20	30		CIEDRN
Cc1cc(C)c(C#N)c(SCCCCOC(C)(C)C)n1	ZINC000473779425	518186709	/nfs/dbraw/zinc/18/67/09/518186709.db2.gz	PJYAITSOWLBMLN-UHFFFAOYSA-N	0	0	292.448	4.258	20	30		CIEDRN
O=C(CC1=CCCCC1)Nc1ccc2[nH]cnc2c1	ZINC000329088726	534336728	/nfs/dbraw/zinc/33/67/28/534336728.db2.gz	VURCKBUFBBWHGB-UHFFFAOYSA-N	0	0	255.321	4.041	20	30		CIEDRN
C=CCC[C@H](CC)Nc1cccc(NC(=O)N(C)C)c1C	ZINC000279568020	518721759	/nfs/dbraw/zinc/72/17/59/518721759.db2.gz	AHACSOINWFMAAO-AWEZNQCLSA-N	0	0	289.423	4.245	20	30		CIEDRN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)C=C1CCCCC1	ZINC000299175506	519654102	/nfs/dbraw/zinc/65/41/02/519654102.db2.gz	XCJMQRANMPDUSC-UHFFFAOYSA-N	0	0	296.414	4.186	20	30		CIEDRN
CC(C)c1nc(CS[C@@H](C)c2ccc(C#N)cc2)no1	ZINC000118444390	519864915	/nfs/dbraw/zinc/86/49/15/519864915.db2.gz	PFMLSZKCGDXALZ-NSHDSACASA-N	0	0	287.388	4.059	20	30		CIEDRN
CC(C)n1ccnc1S[C@H](C)c1cccc(C#N)c1	ZINC000275945847	520037241	/nfs/dbraw/zinc/03/72/41/520037241.db2.gz	DCOFKNFGUOAGTR-GFCCVEGCSA-N	0	0	271.389	4.189	20	30		CIEDRN
CC1(C(=O)CSc2ccc(C#N)c(C(F)(F)F)c2)CC1	ZINC000280020403	520209137	/nfs/dbraw/zinc/20/91/37/520209137.db2.gz	UVOCUTPRLLOTBL-UHFFFAOYSA-N	0	0	299.317	4.038	20	30		CIEDRN
Cc1ccc2cccc(NC(=O)[C@@H]3CCC(=O)[C@H](C)C3)c2n1	ZINC000329000886	534477922	/nfs/dbraw/zinc/47/79/22/534477922.db2.gz	VUQVAAYCXMHYLQ-BXUZGUMPSA-N	0	0	296.370	4.137	20	30		CIEDRN
CCC(=CC(=O)N(Cc1ccc(C#N)cc1)C(C)C)CC	ZINC000126198096	521056948	/nfs/dbraw/zinc/05/69/48/521056948.db2.gz	KYKAGRAJDQHHGD-UHFFFAOYSA-N	0	0	284.403	4.042	20	30		CIEDRN
Cc1oc(C(C)C)cc1C(=O)Nc1ccccc1CC#N	ZINC000344341331	534543004	/nfs/dbraw/zinc/54/30/04/534543004.db2.gz	YHKRLZYZXKLFBV-UHFFFAOYSA-N	0	0	282.343	4.030	20	30		CIEDRN
Cc1oc2ccc(NC(=O)[C@H]3CCO[C@H]3C)cc2c1C	ZINC000330086913	534549847	/nfs/dbraw/zinc/54/98/47/534549847.db2.gz	MSCIGJVAXFAXEQ-AAEUAGOBSA-N	0	0	273.332	4.063	20	30		CIEDRN
Cc1oc2ccc(NC(=O)[C@@H]3CCC(=O)NC3)cc2c1C	ZINC000330069897	534550146	/nfs/dbraw/zinc/55/01/46/534550146.db2.gz	WONJDGFMOLDSDR-LLVKDONJSA-N	0	0	286.331	4.004	20	30		CIEDRN
CCCc1nc(C)c(CNc2c(Cl)cccc2C#N)o1	ZINC000292351045	521500344	/nfs/dbraw/zinc/50/03/44/521500344.db2.gz	QSWZGDHZBWRPIA-UHFFFAOYSA-N	0	0	289.766	4.073	20	30		CIEDRN
Cc1cccc(-n2ccnc2S[C@@H](C)CCC#N)c1C	ZINC000347626671	534567865	/nfs/dbraw/zinc/56/78/65/534567865.db2.gz	KRZSTHQUYJTZII-ZDUSSCGKSA-N	0	0	285.416	4.274	20	30		CIEDRN
Cc1nc2cc(C(=O)N[C@@H]3CC[C@@H]4CCC[C@@H]4C3)ccc2o1	ZINC000329929209	534636657	/nfs/dbraw/zinc/63/66/57/534636657.db2.gz	YOSZWSMJNLLTRY-GZBFAFLISA-N	0	0	298.386	4.410	20	30		CIEDRN
N#CCCOc1cc(Cl)c(Br)cc1Cl	ZINC000191744589	534651169	/nfs/dbraw/zinc/65/11/69/534651169.db2.gz	LGTIYKGBQXLZRB-UHFFFAOYSA-N	0	0	294.963	4.048	20	30		CIEDRN
N#CCC[C@@H](NCc1ccc(Cl)o1)c1ccccc1	ZINC000344862408	534655980	/nfs/dbraw/zinc/65/59/80/534655980.db2.gz	XKUFXCUFCBMUBZ-CQSZACIVSA-N	0	0	274.751	4.068	20	30		CIEDRN
N#C[C@H]1CCC[C@@H](Nc2cccc3ccccc32)C1	ZINC000193118943	534748819	/nfs/dbraw/zinc/74/88/19/534748819.db2.gz	DHVKYPJWBQOVJQ-DZGCQCFKSA-N	0	0	250.345	4.334	20	30		CIEDRN
Cc1cc(C(=O)Nc2ccc(C#N)c(Cl)c2)c(C)s1	ZINC000060951736	524163654	/nfs/dbraw/zinc/16/36/54/524163654.db2.gz	RLLHLMIQNVBHNE-UHFFFAOYSA-N	0	0	290.775	4.142	20	30		CIEDRN
Cc1cccc(CNc2cccc(Cl)c2C#N)c1	ZINC000055358951	524443614	/nfs/dbraw/zinc/44/36/14/524443614.db2.gz	FHAJFUCVNXKLEN-UHFFFAOYSA-N	0	0	256.736	4.132	20	30		CIEDRN
Cc1cccc([C@H]2CCCN2c2ccc(C#N)c(Cl)c2)n1	ZINC000150930024	524897202	/nfs/dbraw/zinc/89/72/02/524897202.db2.gz	CRWXHVMZAVOJLS-QGZVFWFLSA-N	0	0	297.789	4.257	20	30		CIEDRN
N#Cc1cccnc1Sc1nc(-c2ccccc2)cs1	ZINC000301056227	534821231	/nfs/dbraw/zinc/82/12/31/534821231.db2.gz	GFHSMLOWMGRHEY-UHFFFAOYSA-N	0	0	295.392	4.228	20	30		CIEDRN
N#Cc1cnccc1/C=C\c1csc(-c2ccsc2)n1	ZINC000347441705	534827844	/nfs/dbraw/zinc/82/78/44/534827844.db2.gz	LJDINFARBUXCDD-UPHRSURJSA-N	0	0	295.392	4.309	20	30		CIEDRN
Cc1ccccc1CSc1ccc(C#N)cc1F	ZINC000054964064	525185987	/nfs/dbraw/zinc/18/59/87/525185987.db2.gz	XMLDSSGWCANYRI-UHFFFAOYSA-N	0	0	257.333	4.298	20	30		CIEDRN
Cc1nc(C(=O)N[C@H]2CCCCC23CCCC3)c(C)o1	ZINC000329200441	534868261	/nfs/dbraw/zinc/86/82/61/534868261.db2.gz	XIKHFKIPVBGJAG-ZDUSSCGKSA-N	0	0	276.380	4.099	20	30		CIEDRN
C[C@@H](Nc1ccc(C#N)cc1)c1cccc(F)c1F	ZINC000162885824	525701766	/nfs/dbraw/zinc/70/17/66/525701766.db2.gz	YHHFTRXACFPDIS-SNVBAGLBSA-N	0	0	258.271	4.010	20	30		CIEDRN
C[C@@H](Nc1ccc(C(F)(F)F)c(C#N)c1)c1cccnc1	ZINC000163923429	525703436	/nfs/dbraw/zinc/70/34/36/525703436.db2.gz	WGVABENEATZTDA-SNVBAGLBSA-N	0	0	291.276	4.145	20	30		CIEDRN
CS[C@H]1CCC[C@H](Nc2ccc(C#N)c(Cl)c2)C1	ZINC000227358492	525910359	/nfs/dbraw/zinc/91/03/59/525910359.db2.gz	KYCROBZDBRCWGO-AAEUAGOBSA-N	0	0	280.824	4.298	20	30		CIEDRN
C[C@H](SCCC(F)(F)F)c1ccc(C#N)cc1	ZINC000265882148	525974332	/nfs/dbraw/zinc/97/43/32/525974332.db2.gz	OVOSFKMQSVCOSP-VIFPVBQESA-N	0	0	259.296	4.305	20	30		CIEDRN
C[C@H](c1ccco1)N(Cc1ccc(C#N)cc1F)C1CC1	ZINC000086234942	526146793	/nfs/dbraw/zinc/14/67/93/526146793.db2.gz	BBXRXFQYKKHSKC-GFCCVEGCSA-N	0	0	284.334	4.016	20	30		CIEDRN
Cc1cnccc1S[C@H](C)c1ccc(C#N)cc1	ZINC000338618225	526245516	/nfs/dbraw/zinc/24/55/16/526245516.db2.gz	JEAJXVMLZVOLKT-GFCCVEGCSA-N	0	0	254.358	4.115	20	30		CIEDRN
Cc1ccc(C(C)C)cc1Oc1nnc(C)c(C)c1C#N	ZINC000040217669	526250138	/nfs/dbraw/zinc/25/01/38/526250138.db2.gz	YGWZCYIRZGDKIL-UHFFFAOYSA-N	0	0	281.359	4.189	20	30		CIEDRN
Cc1csc(CS[C@H](C)c2ccc(C#N)cc2)n1	ZINC000088306826	526366912	/nfs/dbraw/zinc/36/69/12/526366912.db2.gz	DFRRBLZHHMWRAU-LLVKDONJSA-N	0	0	274.414	4.318	20	30		CIEDRN
N#Cc1cc(N2Cc3ccccc3C2)ccc1C(F)(F)F	ZINC000154086894	526566290	/nfs/dbraw/zinc/56/62/90/526566290.db2.gz	ZYGGBYUMRXOMQG-UHFFFAOYSA-N	0	0	288.272	4.097	20	30		CIEDRN
N#Cc1cc(NC(=O)c2coc3ccccc32)ccc1Cl	ZINC000113019262	526570335	/nfs/dbraw/zinc/57/03/35/526570335.db2.gz	XXMVWXNEGJPAQX-UHFFFAOYSA-N	0	0	296.713	4.210	20	30		CIEDRN
N#Cc1cc(NCc2cccc(F)c2)ccc1C(F)(F)F	ZINC000163917283	526572644	/nfs/dbraw/zinc/57/26/44/526572644.db2.gz	GJMKLNRKXPFTGW-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
N#Cc1ccc(COc2ccc(F)c(Cl)c2)c(F)c1	ZINC000070168569	526629892	/nfs/dbraw/zinc/62/98/92/526629892.db2.gz	FZQKBWLZBMKYPJ-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
N#Cc1ccc(N2CCC3(CCCCC3)CC2)cc1	ZINC000061559592	526643024	/nfs/dbraw/zinc/64/30/24/526643024.db2.gz	MAJVSLHBDXRXAN-UHFFFAOYSA-N	0	0	254.377	4.109	20	30		CIEDRN
N#Cc1ccc(NC(=O)c2coc3ccccc32)cc1Cl	ZINC000113012582	526658955	/nfs/dbraw/zinc/65/89/55/526658955.db2.gz	UEDSISFZIWIBPX-UHFFFAOYSA-N	0	0	296.713	4.210	20	30		CIEDRN
CC(C)(C)[C@@H]1NC(=O)CC[C@H]1NC(=O)CCC1CCCC1	ZINC000329224771	526680468	/nfs/dbraw/zinc/68/04/68/526680468.db2.gz	CQBKDEUJVHMQLD-CZUORRHYSA-N	0	0	294.439	4.447	20	30		CIEDRN
CC(C)(C)[C@@H]1NC(=O)CC[C@H]1NC(=O)C[C@@H]1C=CCCC1	ZINC000329264635	526680527	/nfs/dbraw/zinc/68/05/27/526680527.db2.gz	GTUHZUJSTSNANM-XJKCOSOUSA-N	0	0	292.423	4.223	20	30		CIEDRN
CC(C)(C)[C@@H]1NC(=O)CC[C@H]1NC(=O)C[C@H]1C=CCCC1	ZINC000329264634	526680797	/nfs/dbraw/zinc/68/07/97/526680797.db2.gz	GTUHZUJSTSNANM-WOSRLPQWSA-N	0	0	292.423	4.223	20	30		CIEDRN
N#Cc1ccc(SCc2ccc(-n3cccn3)cc2)cc1	ZINC000337905410	526686622	/nfs/dbraw/zinc/68/66/22/526686622.db2.gz	BEPOCDMRSSSZRF-UHFFFAOYSA-N	0	0	291.379	4.036	20	30		CIEDRN
N#Cc1ccc(SCc2ccc(C(F)(F)F)cn2)cc1	ZINC000340678242	526687028	/nfs/dbraw/zinc/68/70/28/526687028.db2.gz	QNADSLRONLNJIO-UHFFFAOYSA-N	0	0	294.301	4.264	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(C)c(-c2ncco2)c1	ZINC000186050265	526714492	/nfs/dbraw/zinc/71/44/92/526714492.db2.gz	QYSLYFDXHXKULJ-ZDUSSCGKSA-N	0	0	284.359	4.191	20	30		CIEDRN
Cc1nc(C)c(F)c(Oc2ccc(C#N)c3ccccc23)n1	ZINC000338826894	526732520	/nfs/dbraw/zinc/73/25/20/526732520.db2.gz	GPWWHRGFLBQJOG-UHFFFAOYSA-N	0	0	293.301	4.050	20	30		CIEDRN
C=C(C)[C@H]1OCC[C@H]1C(=O)Nc1cc2[nH]ccc2cc1C	ZINC000330249581	526842579	/nfs/dbraw/zinc/84/25/79/526842579.db2.gz	ZXZDBXJABPXOHK-CZUORRHYSA-N	0	0	284.359	4.046	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@H](CC1CCC1)c1ccccc1	ZINC000352153689	527028109	/nfs/dbraw/zinc/02/81/09/527028109.db2.gz	OOHMQZXTXJICBH-RHSMWYFYSA-N	0	0	286.419	4.182	20	30		CIEDRN
C=CCC1(C(=O)N[C@H]2CCCc3ccc(C)cc32)CCC1	ZINC000344696399	527058993	/nfs/dbraw/zinc/05/89/93/527058993.db2.gz	DFCDPBMOVUEAMI-KRWDZBQOSA-N	0	0	283.415	4.235	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(NC[C@@H](C)c2ccc(C)cc2)c1	ZINC000302095342	527225347	/nfs/dbraw/zinc/22/53/47/527225347.db2.gz	ITYIGDJQRJRBRF-CQSZACIVSA-N	0	0	292.382	4.285	20	30		CIEDRN
C=CCCCSCc1nnc(Cc2ccccc2C)o1	ZINC000348983706	527249050	/nfs/dbraw/zinc/24/90/50/527249050.db2.gz	ZGJHJHDIPXBRHR-UHFFFAOYSA-N	0	0	288.416	4.168	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)C=C	ZINC000355562630	527259035	/nfs/dbraw/zinc/25/90/35/527259035.db2.gz	OFOYLVCMSJPNKF-CYBMUJFWSA-N	0	0	272.392	4.235	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NCc1noc(CCC)n1	ZINC000352548970	527260766	/nfs/dbraw/zinc/26/07/66/527260766.db2.gz	XBHGTJJKDIAGSZ-UHFFFAOYSA-N	0	0	299.418	4.486	20	30		CIEDRN
C=CCC[C@@H](NCc1nnc(C(C)C)s1)c1ccco1	ZINC000353529626	527449273	/nfs/dbraw/zinc/44/92/73/527449273.db2.gz	JSDUJQHKUKNIOF-GFCCVEGCSA-N	0	0	291.420	4.052	20	30		CIEDRN
CC(C)(C#N)CC(=O)Nc1cccc(C(F)F)c1Cl	ZINC000346574184	527459180	/nfs/dbraw/zinc/45/91/80/527459180.db2.gz	SJLYHUWQOCDQQI-UHFFFAOYSA-N	0	0	286.709	4.156	20	30		CIEDRN
C=CCC[C@H](NC(=O)c1ccncc1CC)c1ccccc1	ZINC000348015515	527483132	/nfs/dbraw/zinc/48/31/32/527483132.db2.gz	MTWYLDRLSSBBCE-SFHVURJKSA-N	0	0	294.398	4.081	20	30		CIEDRN
Cc1ncsc1CS[C@@H](C)c1cccc(C#N)c1	ZINC000290873337	527515168	/nfs/dbraw/zinc/51/51/68/527515168.db2.gz	ZZDOWTZUSYRWLY-NSHDSACASA-N	0	0	274.414	4.318	20	30		CIEDRN
CC(=O)NC1(c2noc(C3=C(C)CCC3)n2)CCCCC1	ZINC000329450707	527540179	/nfs/dbraw/zinc/54/01/79/527540179.db2.gz	CNSOMHOHFHDCRA-UHFFFAOYSA-N	0	0	289.379	4.163	20	30		CIEDRN
CC(C)(C(=O)Nc1scnc1C1CC1)C1CCOCC1	ZINC000330142579	527544893	/nfs/dbraw/zinc/54/48/93/527544893.db2.gz	YIZRUMRUUHAHTA-UHFFFAOYSA-N	0	0	294.420	4.061	20	30		CIEDRN
CC(C)CCN(CCC#N)Cc1ccc([C@H]2C[C@H]2C)o1	ZINC000353416777	527715142	/nfs/dbraw/zinc/71/51/42/527715142.db2.gz	QDIGCNYUOIJNNI-ZBFHGGJFSA-N	0	0	274.408	4.165	20	30		CIEDRN
CC(C)CCN(CCC#N)Cc1ccccc1OC(F)F	ZINC000353421463	527715218	/nfs/dbraw/zinc/71/52/18/527715218.db2.gz	KCYJMZZXVBUIOE-UHFFFAOYSA-N	0	0	296.361	4.050	20	30		CIEDRN
CC(C)CCN(CCC#N)Cc1ccc([C@@H]2C[C@H]2C)o1	ZINC000353416774	527715613	/nfs/dbraw/zinc/71/56/13/527715613.db2.gz	QDIGCNYUOIJNNI-GDBMZVCRSA-N	0	0	274.408	4.165	20	30		CIEDRN
CC(C)CC[C@H](C)NC(=O)C[C@H](CC#N)c1ccccc1	ZINC000353852571	527836880	/nfs/dbraw/zinc/83/68/80/527836880.db2.gz	OPRVKOMPBBNUQK-RDJZCZTQSA-N	0	0	286.419	4.015	20	30		CIEDRN
CC(C)Oc1c(Cl)cccc1N[C@@H]1CC[C@H](C#N)C1	ZINC000442856597	528094583	/nfs/dbraw/zinc/09/45/83/528094583.db2.gz	OHSCUUWNLDXEOJ-NWDGAFQWSA-N	0	0	278.783	4.231	20	30		CIEDRN
CC(C)c1ccccc1N(C)C(=O)c1cscc1C#N	ZINC000334724505	528190574	/nfs/dbraw/zinc/19/05/74/528190574.db2.gz	MDNLXFWDDOSIRT-UHFFFAOYSA-N	0	0	284.384	4.020	20	30		CIEDRN
CC(C)C[C@H](C)C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000352217419	528454029	/nfs/dbraw/zinc/45/40/29/528454029.db2.gz	JQXUBJSOBVWKRB-DOTOQJQBSA-N	0	0	286.419	4.220	20	30		CIEDRN
CC(C)c1scnc1NC(=O)NC1(C)CCCCC1	ZINC000329504945	528523731	/nfs/dbraw/zinc/52/37/31/528523731.db2.gz	HFQLKZBGZBTOFW-UHFFFAOYSA-N	0	0	281.425	4.124	20	30		CIEDRN
CC(C)[C@@H]1CCCC[C@H]1NC(=O)Cc1ccc2n[nH]cc2c1	ZINC000330024163	528652218	/nfs/dbraw/zinc/65/22/18/528652218.db2.gz	JNQLJWHXUJGNHZ-DOTOQJQBSA-N	0	0	299.418	4.277	20	30		CIEDRN
CC1(C#N)CCC(Nc2ccc([C@@H]3CCOC3)cc2)CC1	ZINC000336217784	528833502	/nfs/dbraw/zinc/83/35/02/528833502.db2.gz	PSZRRZYVSIGPBJ-FAEJEUNOSA-N	0	0	284.403	4.075	20	30		CIEDRN
CCC(CC)[C@H]1C[C@@H](Nc2ccc(C#N)cc2F)CCO1	ZINC000302032328	528869954	/nfs/dbraw/zinc/86/99/54/528869954.db2.gz	IUNWVDOTRBSZEA-WMLDXEAASA-N	0	0	290.382	4.093	20	30		CIEDRN
CC1(C)CCCC[C@@H]1NC(=O)C[C@@H]1CCCCNC1=O	ZINC000329554841	528913564	/nfs/dbraw/zinc/91/35/64/528913564.db2.gz	QCMZZYVVBYDFEE-STQMWFEESA-N	0	0	280.412	4.058	20	30		CIEDRN
CC1(C)CCC[C@@H]1C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000352207213	528962864	/nfs/dbraw/zinc/96/28/64/528962864.db2.gz	VDULKFBDCHJIFD-IAGOWNOFSA-N	0	0	298.430	4.364	20	30		CIEDRN
CC1(C)CCC[C@H](NC(=O)Cc2ccc3c[nH]nc3c2)C1	ZINC000329262925	528978506	/nfs/dbraw/zinc/97/85/06/528978506.db2.gz	BIPSORDMUVIGFX-AWEZNQCLSA-N	0	0	285.391	4.031	20	30		CIEDRN
CC1(C)CCC[C@H]1C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000352207212	528987397	/nfs/dbraw/zinc/98/73/97/528987397.db2.gz	VDULKFBDCHJIFD-DLBZAZTESA-N	0	0	298.430	4.364	20	30		CIEDRN
CCC1(CC)CCCN(C(=O)c2ccc(CC#N)cc2)CC1	ZINC000346904584	529042298	/nfs/dbraw/zinc/04/22/98/529042298.db2.gz	FZRMTWZICJMUFE-UHFFFAOYSA-N	0	0	298.430	4.185	20	30		CIEDRN
CCN(C(=O)c1ccc(C)cc1Cl)c1ccc(C#N)cc1	ZINC000191641221	529081440	/nfs/dbraw/zinc/08/14/40/529081440.db2.gz	HWRSRSVYEROLCG-UHFFFAOYSA-N	0	0	298.773	4.187	20	30		CIEDRN
CC[C@H](C)[C@@H](C)C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000352225963	529200557	/nfs/dbraw/zinc/20/05/57/529200557.db2.gz	QFAGLBHFVSBVFC-ZMSDIMECSA-N	0	0	286.419	4.220	20	30		CIEDRN
CCS[C@@H]1CCCC[C@H]1Nc1ccc(Cl)c(C#N)n1	ZINC000301526525	529212027	/nfs/dbraw/zinc/21/20/27/529212027.db2.gz	GEVIFZKWGBTJGP-DGCLKSJQSA-N	0	0	295.839	4.083	20	30		CIEDRN
CC[C@@H](OC1CCCC1)C(=O)Nc1cccc2ocnc21	ZINC000330041717	529243694	/nfs/dbraw/zinc/24/36/94/529243694.db2.gz	BXTAVMUSLBTTKO-CYBMUJFWSA-N	0	0	288.347	4.154	20	30		CIEDRN
CC[C@@H]1CCC[C@H](NC(=O)C[C@@H]2CCCCNC2=O)C1	ZINC000329453248	529312810	/nfs/dbraw/zinc/31/28/10/529312810.db2.gz	PGKHTTBVEMDNGA-RDBSUJKOSA-N	0	0	280.412	4.058	20	30		CIEDRN
CC[C@@H]1CC[C@H](C(=O)Nc2ccc3occ(C)c3c2)O1	ZINC000330068717	529339992	/nfs/dbraw/zinc/33/99/92/529339992.db2.gz	VRFRMYJOMUFKJP-IUODEOHRSA-N	0	0	273.332	4.287	20	30		CIEDRN
C=CCCCN(C)C(=O)c1cc2cccc(C)c2s1	ZINC000573282928	334924321	/nfs/dbraw/zinc/92/43/21/334924321.db2.gz	UYTJMTYKPWNSTA-UHFFFAOYSA-N	0	0	273.401	4.248	20	30		CIEDRN
C#CCC(C)(C)C(=O)Nc1ccc(OC(C)C)cc1Cl	ZINC000188347138	260129969	/nfs/dbraw/zinc/12/99/69/260129969.db2.gz	KSURUIKBMDOCEP-UHFFFAOYSA-N	0	0	293.794	4.115	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc(F)cc1Cl	ZINC000297900768	260137042	/nfs/dbraw/zinc/13/70/42/260137042.db2.gz	PYJGESIXZBELEC-UHFFFAOYSA-N	0	0	255.720	4.020	20	30		CIEDRN
CCc1cc(=O)c2cc(NC(=O)C3CC(C)(C)C3)ccc2[nH]1	ZINC000329080066	529507154	/nfs/dbraw/zinc/50/71/54/529507154.db2.gz	CJKYICIKPMZCIN-UHFFFAOYSA-N	0	0	298.386	4.115	20	30		CIEDRN
CC[C@H](Nc1ccc(C#N)nc1)c1cccc(Cl)c1	ZINC000302499709	529675646	/nfs/dbraw/zinc/67/56/46/529675646.db2.gz	CJYXPQKVWIOKHJ-HNNXBMFYSA-N	0	0	271.751	4.170	20	30		CIEDRN
Cc1cc(C)c(NCc2ccc(F)c(C#N)c2)c(C)c1	ZINC000083510133	178535932	/nfs/dbraw/zinc/53/59/32/178535932.db2.gz	QJRUKVDPYKPZAH-UHFFFAOYSA-N	0	0	268.335	4.235	20	30		CIEDRN
CCc1ccc([C@H]2C[C@@H](C)CCN2c2ccc(C#N)cn2)o1	ZINC000301412825	529729956	/nfs/dbraw/zinc/72/99/56/529729956.db2.gz	APXPXZREYTXZBT-XJKSGUPXSA-N	0	0	295.386	4.086	20	30		CIEDRN
CN(C)c1nc2cc(NC(=O)[C@H]3CC34CCCC4)ccc2o1	ZINC000330039816	529804672	/nfs/dbraw/zinc/80/46/72/529804672.db2.gz	FNKYAKZSWSFXPF-GFCCVEGCSA-N	0	0	299.374	4.062	20	30		CIEDRN
CCc1nc(CSc2ccc(C#N)c(C)c2)cs1	ZINC000573683743	334957514	/nfs/dbraw/zinc/95/75/14/334957514.db2.gz	GPVRAEMGFALFEP-UHFFFAOYSA-N	0	0	274.414	4.178	20	30		CIEDRN
C=C(C)CN(CC)C(=O)[C@@H](c1ccccc1)[C@@H](C)CC	ZINC000098076123	185683550	/nfs/dbraw/zinc/68/35/50/185683550.db2.gz	VMDCAEQISYRKNB-DOTOQJQBSA-N	0	0	273.420	4.241	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2csc(C)c2C)n1	ZINC000573822781	334969529	/nfs/dbraw/zinc/96/95/29/334969529.db2.gz	SRVAVFISMBVIAV-UHFFFAOYSA-N	0	0	262.378	4.269	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2c[nH]c3ccccc32)no1	ZINC000573960034	334980548	/nfs/dbraw/zinc/98/05/48/334980548.db2.gz	LVORMHPUQLDHGI-NSHDSACASA-N	0	0	267.332	4.288	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2c[nH]c3ccccc32)no1	ZINC000573960030	334980563	/nfs/dbraw/zinc/98/05/63/334980563.db2.gz	LVORMHPUQLDHGI-LLVKDONJSA-N	0	0	267.332	4.288	20	30		CIEDRN
C=CCCCNC(=O)c1cscc1-c1ccccc1	ZINC000573971729	334981688	/nfs/dbraw/zinc/98/16/88/334981688.db2.gz	ZAOIFCCNGCSWPZ-UHFFFAOYSA-N	0	0	271.385	4.111	20	30		CIEDRN
C=CC[C@H](C)NC(=O)c1cscc1-c1ccccc1	ZINC000574087688	334991313	/nfs/dbraw/zinc/99/13/13/334991313.db2.gz	JIYHIADHALOOIQ-LBPRGKRZSA-N	0	0	271.385	4.110	20	30		CIEDRN
CCCC[C@H](C)N(CCCC)C(=O)c1cc(C#N)oc1C	ZINC000574307339	335008966	/nfs/dbraw/zinc/00/89/66/335008966.db2.gz	ZSLXOWSWHYZKDN-ZDUSSCGKSA-N	0	0	290.407	4.281	20	30		CIEDRN
CCCC[C@@H](C)N(CCCC)C(=O)c1cc(C#N)oc1C	ZINC000574307338	335009080	/nfs/dbraw/zinc/00/90/80/335009080.db2.gz	ZSLXOWSWHYZKDN-CYBMUJFWSA-N	0	0	290.407	4.281	20	30		CIEDRN
CC[C@H](CC(=O)N(CC#N)c1ccccc1)c1ccccc1	ZINC000171463613	335017795	/nfs/dbraw/zinc/01/77/95/335017795.db2.gz	UTEKNSONELXBDV-MRXNPFEDSA-N	0	0	292.382	4.127	20	30		CIEDRN
C=CCCCCNc1cccc2c1CN(c1ccccn1)C2	ZINC000574607354	335033468	/nfs/dbraw/zinc/03/34/68/335033468.db2.gz	DFWJMOIZJYXOMZ-UHFFFAOYSA-N	0	0	293.414	4.370	20	30		CIEDRN
CC[C@@H](c1ccccc1)[S@](=O)CCCC(C)(C)C#N	ZINC000178109341	261726018	/nfs/dbraw/zinc/72/60/18/261726018.db2.gz	RPOGFJGJGLASQW-HNAYVOBHSA-N	0	0	277.433	4.216	20	30		CIEDRN
Cc1sc2ncnc(S[C@H](C)CCC#N)c2c1C	ZINC000188223006	262152254	/nfs/dbraw/zinc/15/22/54/262152254.db2.gz	QTPGCPLREAMXFZ-MRVPVSSYSA-N	0	0	277.418	4.093	20	30		CIEDRN
C[C@H]1CCC[C@](C#N)(NC(=O)c2cc3ccccc3s2)C1	ZINC000116800167	260005698	/nfs/dbraw/zinc/00/56/98/260005698.db2.gz	VJSOPAKDWXDDJP-SJCJKPOMSA-N	0	0	298.411	4.104	20	30		CIEDRN
CCC(CC)(CC)[S@@](=O)CCCC(C)(C)C#N	ZINC000190575700	262184090	/nfs/dbraw/zinc/18/40/90/262184090.db2.gz	AFMJDKKHFZCOJB-KRWDZBQOSA-N	0	0	257.443	4.034	20	30		CIEDRN
Cc1cc(C(C)(C)C)cc(C)c1C[S@](=O)CCCC#N	ZINC000190731708	262185183	/nfs/dbraw/zinc/18/51/83/262185183.db2.gz	VTLDHSQELFGLDJ-HXUWFJFHSA-N	0	0	291.460	4.153	20	30		CIEDRN
Cc1ccccc1NC(=O)Nc1cc(C#N)cn1C(C)(C)C	ZINC000171138306	335056479	/nfs/dbraw/zinc/05/64/79/335056479.db2.gz	NUOKETOMDDXHQW-UHFFFAOYSA-N	0	0	296.374	4.067	20	30		CIEDRN
N#Cc1ccc(CNc2cc(F)ccc2Cl)c(F)c1	ZINC000171135881	335056522	/nfs/dbraw/zinc/05/65/22/335056522.db2.gz	ZQKDPTGXFRITBD-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
Cc1ccc(C(=O)/C=C\c2ccc(OC(F)F)cc2)cc1	ZINC000035678119	256777597	/nfs/dbraw/zinc/77/75/97/256777597.db2.gz	XAXNSLPYLILSQM-WDZFZDKYSA-N	0	0	288.293	4.493	20	30		CIEDRN
C=C(C)[C@@H](NCc1nc(C)cs1)c1ccc(F)c(F)c1	ZINC000187373444	260033324	/nfs/dbraw/zinc/03/33/24/260033324.db2.gz	RKLBPVAJRYBARS-OAHLLOKOSA-N	0	0	294.370	4.137	20	30		CIEDRN
C=CCCCSCC(=O)N(C1CC1)C1CCC(C)CC1	ZINC000522756783	262338566	/nfs/dbraw/zinc/33/85/66/262338566.db2.gz	HKFASWFJZKXQGA-UHFFFAOYSA-N	0	0	295.492	4.256	20	30		CIEDRN
N#Cc1ccc(CS[C@@H]2CCCc3ccccc32)nc1	ZINC000575068729	335061435	/nfs/dbraw/zinc/06/14/35/335061435.db2.gz	SGHXEKUWGAACIC-QGZVFWFLSA-N	0	0	280.396	4.264	20	30		CIEDRN
CSC(C)(C)CNc1cc(C#N)ccc1C(F)(F)F	ZINC000302322849	533471812	/nfs/dbraw/zinc/47/18/12/533471812.db2.gz	XABXOGWZVJPLGH-UHFFFAOYSA-N	0	0	288.338	4.131	20	30		CIEDRN
C[C@@H](Nc1c(F)cc(C#N)cc1F)c1ccc(F)cc1F	ZINC000301098557	533551371	/nfs/dbraw/zinc/55/13/71/533551371.db2.gz	JUCGLBLOIYCUEQ-MRVPVSSYSA-N	0	0	294.251	4.288	20	30		CIEDRN
C[C@@H](Nc1cc(Cl)ccc1C#N)[C@@H]1COc2ccccc21	ZINC000301806088	533551544	/nfs/dbraw/zinc/55/15/44/533551544.db2.gz	AEQMDQPRVAPYAV-ABAIWWIYSA-N	0	0	298.773	4.188	20	30		CIEDRN
C[C@@H](Nc1cc(C2CC2)ccn1)c1ccc(C#N)cc1F	ZINC000353627473	533551712	/nfs/dbraw/zinc/55/17/12/533551712.db2.gz	WHGSFAFPRDXTQT-LLVKDONJSA-N	0	0	281.334	4.143	20	30		CIEDRN
C[C@H](Nc1cc(C#N)ccn1)c1ccc(C(F)(F)F)cc1	ZINC000341742394	130016552	/nfs/dbraw/zinc/01/65/52/130016552.db2.gz	JXLACLVFJHUSLI-JTQLQIEISA-N	0	0	291.276	4.145	20	30		CIEDRN
Cc1nsc(NCc2ccc3[nH]c(C)c(C)c3c2)c1C#N	ZINC000341803064	130045862	/nfs/dbraw/zinc/04/58/62/130045862.db2.gz	YYIQVARNUYCRER-UHFFFAOYSA-N	0	0	296.399	4.033	20	30		CIEDRN
Cc1cc(C#N)ccc1C(=O)Nc1ccc(F)c(C2CC2)c1	ZINC000342094823	130257052	/nfs/dbraw/zinc/25/70/52/130257052.db2.gz	GIYQAKLXBATBOV-UHFFFAOYSA-N	0	0	294.329	4.136	20	30		CIEDRN
C[C@@H]1C[C@H]1c1ccc(CNc2ccc(CC#N)cc2)o1	ZINC000037071310	260066499	/nfs/dbraw/zinc/06/64/99/260066499.db2.gz	DGHGYQFFNJAXKD-MLGOLLRUSA-N	0	0	266.344	4.081	20	30		CIEDRN
CC[C@H](CC(=O)N(Cc1ccc(C#N)cc1)C1CC1)C(C)C	ZINC000171427687	335065635	/nfs/dbraw/zinc/06/56/35/335065635.db2.gz	VKKAEKUYWLRAEN-QGZVFWFLSA-N	0	0	298.430	4.122	20	30		CIEDRN
N#Cc1ccccc1CSCc1ccc(F)cc1C#N	ZINC000171437399	335065881	/nfs/dbraw/zinc/06/58/81/335065881.db2.gz	FABLQVDRQPKFKQ-UHFFFAOYSA-N	0	0	282.343	4.002	20	30		CIEDRN
N#Cc1ccc(N2CCC(c3ccccc3)CC2)c(F)c1	ZINC000079031555	134454070	/nfs/dbraw/zinc/45/40/70/134454070.db2.gz	KXYVYJNTYKOEIQ-UHFFFAOYSA-N	0	0	280.346	4.081	20	30		CIEDRN
CC(C)(C#N)CCCCN1CCOc2c(Cl)cccc21	ZINC000575123259	335069606	/nfs/dbraw/zinc/06/96/06/335069606.db2.gz	YTUBCMXLMOIAHE-UHFFFAOYSA-N	0	0	292.810	4.259	20	30		CIEDRN
C=C(C)CSc1ncnc2sc3c(c21)CCCC3	ZINC000005608063	170119282	/nfs/dbraw/zinc/11/92/82/170119282.db2.gz	XTCHCBUCUVEYNO-UHFFFAOYSA-N	0	0	276.430	4.238	20	30		CIEDRN
N#Cc1c(NC(=O)C2CCCC2)sc2c1CCCCC2	ZINC000005897840	170152270	/nfs/dbraw/zinc/15/22/70/170152270.db2.gz	SKIFOFPGFPKHNZ-UHFFFAOYSA-N	0	0	288.416	4.017	20	30		CIEDRN
CCc1c(C)sc(NC(=O)c2cccc(C)c2)c1C#N	ZINC000006122909	170177589	/nfs/dbraw/zinc/17/75/89/170177589.db2.gz	ANZGCYTVFIJPCX-UHFFFAOYSA-N	0	0	284.384	4.051	20	30		CIEDRN
N#Cc1ccccc1COc1ccc(Cl)c2cccnc12	ZINC000008195934	170323768	/nfs/dbraw/zinc/32/37/68/170323768.db2.gz	KMXNWYZMNYDEAQ-UHFFFAOYSA-N	0	0	294.741	4.339	20	30		CIEDRN
Cc1ccc(C)c(OCc2ccc(C#N)cc2F)c1C	ZINC000011233423	170416562	/nfs/dbraw/zinc/41/65/62/170416562.db2.gz	CHIIBQLZTIWPJE-UHFFFAOYSA-N	0	0	269.319	4.202	20	30		CIEDRN
N#Cc1ccccc1COc1cccc(Cl)c1Cl	ZINC000011834178	170445660	/nfs/dbraw/zinc/44/56/60/170445660.db2.gz	RJCLRZKEDGMBSD-UHFFFAOYSA-N	0	0	278.138	4.444	20	30		CIEDRN
CC[C@@H](NC(=O)c1cccc(C#N)c1)c1ccc(Cl)cc1	ZINC000014903768	170648241	/nfs/dbraw/zinc/64/82/41/170648241.db2.gz	BDPJKDGURANSMX-MRXNPFEDSA-N	0	0	298.773	4.093	20	30		CIEDRN
N#Cc1ccc(CNc2ccc3ccccc3c2)cc1	ZINC000016313208	170693172	/nfs/dbraw/zinc/69/31/72/170693172.db2.gz	DKIMUYAQXHLNES-UHFFFAOYSA-N	0	0	258.324	4.324	20	30		CIEDRN
N#Cc1cccc(CNc2cccc3ccccc32)c1	ZINC000019900820	170913480	/nfs/dbraw/zinc/91/34/80/170913480.db2.gz	MAJLLPSGJNTMPG-UHFFFAOYSA-N	0	0	258.324	4.324	20	30		CIEDRN
COc1ccc(N[C@@H](C)c2ccc(C#N)cc2)cc1Cl	ZINC000019903527	170915454	/nfs/dbraw/zinc/91/54/54/170915454.db2.gz	XBIIWZHPEKDQTI-NSHDSACASA-N	0	0	286.762	4.393	20	30		CIEDRN
C[C@H](Nc1ccc(F)c(F)c1)c1ccc(C#N)cc1	ZINC000019918175	170926658	/nfs/dbraw/zinc/92/66/58/170926658.db2.gz	ZKEHNXNIXFLXCQ-JTQLQIEISA-N	0	0	258.271	4.010	20	30		CIEDRN
CCc1ccc(N[C@H](C)c2ccc(C#N)cc2)cc1	ZINC000019955235	170941070	/nfs/dbraw/zinc/94/10/70/170941070.db2.gz	DKRXPDXOYWYHSM-CYBMUJFWSA-N	0	0	250.345	4.294	20	30		CIEDRN
CCc1ccc(N[C@@H](C)c2ccc(C#N)cc2)cc1	ZINC000019955231	170941083	/nfs/dbraw/zinc/94/10/83/170941083.db2.gz	DKRXPDXOYWYHSM-ZDUSSCGKSA-N	0	0	250.345	4.294	20	30		CIEDRN
Cc1nc2cc(N[C@@H](C)c3ccc(C#N)cc3)ccc2o1	ZINC000020144011	171029872	/nfs/dbraw/zinc/02/98/72/171029872.db2.gz	OCYMPYRHKXNURR-NSHDSACASA-N	0	0	277.327	4.181	20	30		CIEDRN
N#Cc1ccc(-c2csc(-c3cccs3)n2)cc1	ZINC000021224916	171300133	/nfs/dbraw/zinc/30/01/33/171300133.db2.gz	HNTAEGLACJOWNR-UHFFFAOYSA-N	0	0	268.366	4.410	20	30		CIEDRN
N#Cc1ccc(-c2csc(-c3cccc(F)c3)n2)cc1	ZINC000021474133	171304215	/nfs/dbraw/zinc/30/42/15/171304215.db2.gz	ZMSXFGJUOMWKJK-UHFFFAOYSA-N	0	0	280.327	4.488	20	30		CIEDRN
N#Cc1cccc(COc2cc(Cl)ccc2Cl)c1	ZINC000021814034	171331247	/nfs/dbraw/zinc/33/12/47/171331247.db2.gz	HGXPGNPQXTXCCN-UHFFFAOYSA-N	0	0	278.138	4.444	20	30		CIEDRN
Cc1ccc(C)c(C(=O)Nc2ccc(C(C)(C)C#N)cc2)c1	ZINC000025438232	171458180	/nfs/dbraw/zinc/45/81/80/171458180.db2.gz	VYOYCIBSUYBBKC-UHFFFAOYSA-N	0	0	292.382	4.357	20	30		CIEDRN
Cc1cc2c(ncnc2SCc2cccc(C#N)c2)s1	ZINC000031944816	171666747	/nfs/dbraw/zinc/66/67/47/171666747.db2.gz	RHLKZODYYVPIGQ-UHFFFAOYSA-N	0	0	297.408	4.164	20	30		CIEDRN
O=C1c2ccccc2OC/C1=C/c1c(F)cccc1Cl	ZINC000033336347	171784925	/nfs/dbraw/zinc/78/49/25/171784925.db2.gz	YYJMAENVZAGDGJ-NTMALXAHSA-N	0	0	288.705	4.138	20	30		CIEDRN
N#Cc1c(F)cccc1N[C@@H]1CCSc2ccccc21	ZINC000035134979	172001461	/nfs/dbraw/zinc/00/14/61/172001461.db2.gz	IHNMPQBRNCXVEA-OAHLLOKOSA-N	0	0	284.359	4.346	20	30		CIEDRN
N#Cc1c(F)cccc1NCc1ccc(C(F)(F)F)cc1	ZINC000035148443	172009956	/nfs/dbraw/zinc/00/99/56/172009956.db2.gz	ZCENQZDKWJTPKO-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
CCOc1ccccc1CNc1ccc(Cl)c(C#N)c1	ZINC000035224495	172068891	/nfs/dbraw/zinc/06/88/91/172068891.db2.gz	AISDAFRQDBMMFI-UHFFFAOYSA-N	0	0	286.762	4.222	20	30		CIEDRN
CC[C@@H](C)[C@H](C)Nc1cccc(OCCCC#N)c1	ZINC000037777493	173708265	/nfs/dbraw/zinc/70/82/65/173708265.db2.gz	XGBLDCFBCQHBPG-KGLIPLIRSA-N	0	0	260.381	4.216	20	30		CIEDRN
CCCC[C@H](C)Nc1cccc(OCCCC#N)c1	ZINC000037777437	173708642	/nfs/dbraw/zinc/70/86/42/173708642.db2.gz	CHZSZLYVIMQZGX-AWEZNQCLSA-N	0	0	260.381	4.360	20	30		CIEDRN
Cn1cc(C(=O)/C=C/c2ccccc2F)c2ccccc21	ZINC000072125100	176320389	/nfs/dbraw/zinc/32/03/89/176320389.db2.gz	NBTLSNYTIITGBP-ZHACJKMWSA-N	0	0	279.314	4.214	20	30		CIEDRN
N#Cc1ccc(NCc2cc(F)ccc2F)cc1Cl	ZINC000037233417	260076922	/nfs/dbraw/zinc/07/69/22/260076922.db2.gz	PFHLPXZZTMGPEQ-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
Cc1csc(NC(=O)CC2CCC(C)CC2)c1C#N	ZINC000344931090	225207031	/nfs/dbraw/zinc/20/70/31/225207031.db2.gz	RZESXOLRVPYMRG-UHFFFAOYSA-N	0	0	276.405	4.083	20	30		CIEDRN
N#CCCCSCc1ccc(Br)s1	ZINC000190928634	225303823	/nfs/dbraw/zinc/30/38/23/225303823.db2.gz	GZDPDFIGYKCALA-UHFFFAOYSA-N	0	0	276.224	4.048	20	30		CIEDRN
N#CCCCSCc1csc(Br)c1	ZINC000190916261	225245596	/nfs/dbraw/zinc/24/55/96/225245596.db2.gz	JJEPUHQWXOTTOK-UHFFFAOYSA-N	0	0	276.224	4.048	20	30		CIEDRN
C[C@]1(C(=O)Nc2ccc(CC#N)cc2Cl)CC=CCC1	ZINC000334645698	225251433	/nfs/dbraw/zinc/25/14/33/225251433.db2.gz	UQZYXSMWWMDKRT-INIZCTEOSA-N	0	0	288.778	4.091	20	30		CIEDRN
Cc1ccc(C#N)c(NCc2cc3ccccc3s2)n1	ZINC000346827613	225934226	/nfs/dbraw/zinc/93/42/26/225934226.db2.gz	IZAZGNCLUQHDTG-UHFFFAOYSA-N	0	0	279.368	4.089	20	30		CIEDRN
Cc1sc2nc(C)nc(SCC3(C#N)CC3)c2c1C	ZINC000347022136	226017549	/nfs/dbraw/zinc/01/75/49/226017549.db2.gz	NRGMESYEFWVLEV-UHFFFAOYSA-N	0	0	289.429	4.012	20	30		CIEDRN
N#CCCN(CCCC1CCCCC1)Cc1cccnc1	ZINC000347656545	226228302	/nfs/dbraw/zinc/22/83/02/226228302.db2.gz	SLGATROXEYILDO-UHFFFAOYSA-N	0	0	285.435	4.158	20	30		CIEDRN
C[C@@H](CC#N)NC(=O)c1cc(-c2ccccc2)ccc1Cl	ZINC000171768578	335078401	/nfs/dbraw/zinc/07/84/01/335078401.db2.gz	NAQUWHCFXHVICE-LBPRGKRZSA-N	0	0	298.773	4.039	20	30		CIEDRN
N#Cc1cc(Cl)ccc1CN1CCC=C(c2ccco2)C1	ZINC000352570445	227071419	/nfs/dbraw/zinc/07/14/19/227071419.db2.gz	HIAHTRIABCAWEG-UHFFFAOYSA-N	0	0	298.773	4.094	20	30		CIEDRN
N#Cc1ccc(CNc2ccc(F)c(C3CC3)c2)cc1F	ZINC000352608624	227104927	/nfs/dbraw/zinc/10/49/27/227104927.db2.gz	NWWGHPPZPQXJGF-UHFFFAOYSA-N	0	0	284.309	4.326	20	30		CIEDRN
N#Cc1ccc(CNc2ccc(F)c(C3CC3)c2)c(F)c1	ZINC000352631201	227130217	/nfs/dbraw/zinc/13/02/17/227130217.db2.gz	VEEPLGFBWYNXNZ-UHFFFAOYSA-N	0	0	284.309	4.326	20	30		CIEDRN
C=C[C@](C)(CC)c1nc([C@@H](OCC)c2ccccc2)no1	ZINC000575217569	335082874	/nfs/dbraw/zinc/08/28/74/335082874.db2.gz	RWXJAXWFCKGZQI-WMLDXEAASA-N	0	0	286.375	4.049	20	30		CIEDRN
Cc1nc(CCNC(=O)[C@@H](C)CC2CCCCC2)c(C)o1	ZINC000329026190	227263220	/nfs/dbraw/zinc/26/32/20/227263220.db2.gz	OARQLARAFIDRPE-LBPRGKRZSA-N	0	0	292.423	4.397	20	30		CIEDRN
O=C(N[C@@H]1CC[C@@H]2CCCC[C@H]2C1)c1cc(C2CC2)on1	ZINC000329042179	227269587	/nfs/dbraw/zinc/26/95/87/227269587.db2.gz	TUPCWNFLFIDAAO-FPMFFAJLSA-N	0	0	288.391	4.216	20	30		CIEDRN
C[C@@H]1CC=CC[C@H]1C(=O)N[C@@H]1CCC(=O)N[C@H]1C(C)(C)C	ZINC000329265703	227394296	/nfs/dbraw/zinc/39/42/96/227394296.db2.gz	HDYZYMNIGGWVCB-RGCMKSIDSA-N	0	0	292.423	4.079	20	30		CIEDRN
N#Cc1ccc(CC(=O)NC[C@@H]2C[C@H]2C2CCCCC2)cc1	ZINC000329350309	227462348	/nfs/dbraw/zinc/46/23/48/227462348.db2.gz	SXOHBBZLZJASRO-ROUUACIJSA-N	0	0	296.414	4.274	20	30		CIEDRN
Cc1cc(C)cc([C@H](C)Nc2ccc(Cl)c(C#N)n2)c1	ZINC000301174558	227466043	/nfs/dbraw/zinc/46/60/43/227466043.db2.gz	LUIQBKSWEOFIDW-LBPRGKRZSA-N	0	0	285.778	4.397	20	30		CIEDRN
N#Cc1ccc(NCc2cc3ccccc3[nH]2)cc1Cl	ZINC000301226866	227479386	/nfs/dbraw/zinc/47/93/86/227479386.db2.gz	FGUZCJHLQYHGTQ-UHFFFAOYSA-N	0	0	281.746	4.305	20	30		CIEDRN
Cc1nc(C2CC2)oc1C(=O)NCC1CCC(C)(C)CC1	ZINC000329543826	227590186	/nfs/dbraw/zinc/59/01/86/227590186.db2.gz	YMLVPWSEQCNQFN-UHFFFAOYSA-N	0	0	290.407	4.381	20	30		CIEDRN
Cc1cccc([C@@H](Nc2ncccc2C#N)C(C)(C)C)c1	ZINC000301570647	227591991	/nfs/dbraw/zinc/59/19/91/227591991.db2.gz	NREDPDFILQKCPL-MRXNPFEDSA-N	0	0	279.387	4.461	20	30		CIEDRN
Cc1ccc([C@@H](C)CNc2snc(Cl)c2C#N)cc1	ZINC000301352644	227518946	/nfs/dbraw/zinc/51/89/46/227518946.db2.gz	JOWPLQMIHBSVQO-JTQLQIEISA-N	0	0	291.807	4.192	20	30		CIEDRN
N#Cc1c(Cl)nsc1N[C@@H]1C[C@@H]1C1CCCCC1	ZINC000301377118	227523610	/nfs/dbraw/zinc/52/36/10/227523610.db2.gz	XZBWIZDNXYLSRV-MWLCHTKSSA-N	0	0	281.812	4.049	20	30		CIEDRN
N#Cc1ccc(C(F)(F)F)c(NCc2ccccc2F)c1	ZINC000301702113	227646761	/nfs/dbraw/zinc/64/67/61/227646761.db2.gz	DYXWBFJXEGTNNP-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
Cc1ccccc1[C@@H](Nc1ncccc1C#N)C(C)(C)C	ZINC000301585890	227599278	/nfs/dbraw/zinc/59/92/78/227599278.db2.gz	VLHRPBUXRDPDQS-MRXNPFEDSA-N	0	0	279.387	4.461	20	30		CIEDRN
Cc1ccc(CN(C)c2ccc3cc(C#N)ccc3n2)s1	ZINC000301957161	227741489	/nfs/dbraw/zinc/74/14/89/227741489.db2.gz	AFKJGIPZKBVVDV-UHFFFAOYSA-N	0	0	293.395	4.113	20	30		CIEDRN
Cc1ccccc1CSc1cc(C#N)ccc1[N+](=O)[O-]	ZINC000302218061	227824370	/nfs/dbraw/zinc/82/43/70/227824370.db2.gz	QHAZEOLQYINGBE-UHFFFAOYSA-N	0	0	284.340	4.067	20	30		CIEDRN
N#CC1(C(=O)N[C@@H]2CC[C@@H]3CCC[C@H]3C2)CCCCC1	ZINC000329678706	227838111	/nfs/dbraw/zinc/83/81/11/227838111.db2.gz	VQPJNJNWDJRGPQ-SOUVJXGZSA-N	0	0	274.408	4.386	20	30		CIEDRN
Cc1cc([C@H](C)Nc2ccc(C)c(C#N)n2)c(C)s1	ZINC000302613454	227870498	/nfs/dbraw/zinc/87/04/98/227870498.db2.gz	FMVGHSFUOXMTLB-NSHDSACASA-N	0	0	271.389	4.113	20	30		CIEDRN
N#Cc1ccc(N[C@H]2CCCc3c(O)cccc32)cc1Cl	ZINC000302707139	227878405	/nfs/dbraw/zinc/87/84/05/227878405.db2.gz	JQPFSYCAQFFQMW-INIZCTEOSA-N	0	0	298.773	4.407	20	30		CIEDRN
N#Cc1cccc(C#N)c1SCc1ccccc1Cl	ZINC000302873112	227895261	/nfs/dbraw/zinc/89/52/61/227895261.db2.gz	CSYSCSZXORKIJQ-UHFFFAOYSA-N	0	0	284.771	4.376	20	30		CIEDRN
Cc1nc(C2CC2)oc1C(=O)N[C@@H](C)C1CCCCC1	ZINC000329785508	227947551	/nfs/dbraw/zinc/94/75/51/227947551.db2.gz	QADSPLHTHQWJAL-JTQLQIEISA-N	0	0	276.380	4.134	20	30		CIEDRN
O=C(Cc1ccon1)NC1CCC2(CCCCC2)CC1	ZINC000329974674	228004116	/nfs/dbraw/zinc/00/41/16/228004116.db2.gz	ZGCMPOAPMYOKSS-UHFFFAOYSA-N	0	0	276.380	4.067	20	30		CIEDRN
C[C@@H]1CC(C)(C)CC[C@H]1NC(=O)Cc1ccc2n[nH]cc2c1	ZINC000330012039	228016701	/nfs/dbraw/zinc/01/67/01/228016701.db2.gz	JXIKZLGYTKRBDB-IUODEOHRSA-N	0	0	299.418	4.277	20	30		CIEDRN
O=C(NC1CCC(C(=O)Nc2ccsc2)CC1)C1CC1	ZINC000330018751	228017663	/nfs/dbraw/zinc/01/76/63/228017663.db2.gz	UBDFPXQIXBNZHF-UHFFFAOYSA-N	0	0	292.404	4.261	20	30		CIEDRN
Cc1onc(-c2ccccc2C)c1C(=O)N[C@@H]1C=CCCC1	ZINC000330018457	228017864	/nfs/dbraw/zinc/01/78/64/228017864.db2.gz	SVHOQKYZWGWVDF-CQSZACIVSA-N	0	0	296.370	4.372	20	30		CIEDRN
Cc1coc2ccc(NC(=O)[C@@H]3CCO[C@H](C)C3)cc12	ZINC000330047574	228026536	/nfs/dbraw/zinc/02/65/36/228026536.db2.gz	HUCJIQASPNZOCG-VXGBXAGGSA-N	0	0	273.332	4.144	20	30		CIEDRN
Cc1ccc(-c2cccnc2)cc1NC(=O)[C@]1(C)CCCO1	ZINC000330099649	228039324	/nfs/dbraw/zinc/03/93/24/228039324.db2.gz	ZVMKDCINOMHCHG-SFHVURJKSA-N	0	0	296.370	4.214	20	30		CIEDRN
Cc1coc2ccc(NC(=O)[C@H]3CC(=O)N[C@H](C)C3)cc12	ZINC000330104981	228040218	/nfs/dbraw/zinc/04/02/18/228040218.db2.gz	JIBARBMKMJIZDU-GHMZBOCLSA-N	0	0	286.331	4.084	20	30		CIEDRN
Cc1coc2ccc(NC(=O)[C@H]3CC(=O)N[C@@H](C)C3)cc12	ZINC000330104984	228040508	/nfs/dbraw/zinc/04/05/08/228040508.db2.gz	JIBARBMKMJIZDU-WDEREUQCSA-N	0	0	286.331	4.084	20	30		CIEDRN
N#C[C@@H]1CCC[C@H](Nc2cccc3ccccc32)C1	ZINC000193118979	228051359	/nfs/dbraw/zinc/05/13/59/228051359.db2.gz	DHVKYPJWBQOVJQ-HIFRSBDPSA-N	0	0	250.345	4.334	20	30		CIEDRN
Cc1cc(NC(=O)C[C@H]2C=CCCC2)cc2n[nH]cc21	ZINC000330221743	228071603	/nfs/dbraw/zinc/07/16/03/228071603.db2.gz	LXFCEDADXZKHLX-LBPRGKRZSA-N	0	0	269.348	4.206	20	30		CIEDRN
Cc1ccc(F)cc1NC(=O)C[C@H](CC#N)c1ccccc1	ZINC000353356598	228090046	/nfs/dbraw/zinc/09/00/46/228090046.db2.gz	UMWCKVKQNAIKKP-HNNXBMFYSA-N	0	0	296.345	4.160	20	30		CIEDRN
Cc1cscc1C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000352165219	228190738	/nfs/dbraw/zinc/19/07/38/228190738.db2.gz	CICPRLICGCTNBV-INIZCTEOSA-N	0	0	298.411	4.222	20	30		CIEDRN
N#CCCC[C@@H](NC(=O)CC1CCCC1)c1ccccc1	ZINC000352205582	228198297	/nfs/dbraw/zinc/19/82/97/228198297.db2.gz	GZSKGWARZCBPOM-QGZVFWFLSA-N	0	0	284.403	4.118	20	30		CIEDRN
N#Cc1cc(NCc2cc(F)c(F)cc2F)ccc1Cl	ZINC000227555302	260025588	/nfs/dbraw/zinc/02/55/88/260025588.db2.gz	RBCXSZMYVKIAAK-UHFFFAOYSA-N	0	0	296.679	4.241	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@@H](C)c1ccccc1)c1ccccc1	ZINC000187702250	260028439	/nfs/dbraw/zinc/02/84/39/260028439.db2.gz	OZTVAZNZWCXICE-MAUKXSAKSA-N	0	0	279.383	4.224	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000187703279	260052576	/nfs/dbraw/zinc/05/25/76/260052576.db2.gz	LHPJFZUFQYTRFK-JSGCOSHPSA-N	0	0	299.336	4.051	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC(c2ccsc2)CC1	ZINC000187842598	260061752	/nfs/dbraw/zinc/06/17/52/260061752.db2.gz	SGHIAJOKNDNTLA-UHFFFAOYSA-N	0	0	289.444	4.223	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccncc1	ZINC000188065610	260070875	/nfs/dbraw/zinc/07/08/75/260070875.db2.gz	JWTMBYBSOZETTR-UHFFFAOYSA-N	0	0	294.398	4.115	20	30		CIEDRN
C=CCC(CC=C)c1nc(COc2cccc(F)c2)no1	ZINC000188157907	260072344	/nfs/dbraw/zinc/07/23/44/260072344.db2.gz	WXYOBGGYGXSWJH-UHFFFAOYSA-N	0	0	288.322	4.024	20	30		CIEDRN
CCc1ccc(N[C@@H](C)c2ccc(OCC#N)cc2)cc1	ZINC000037212914	260074435	/nfs/dbraw/zinc/07/44/35/260074435.db2.gz	USJSPLFAPDHXBW-AWEZNQCLSA-N	0	0	280.371	4.324	20	30		CIEDRN
CC(C)(C)C[C@@H](NCc1cccc(C#N)c1)C(F)(F)F	ZINC000180366194	260099206	/nfs/dbraw/zinc/09/92/06/260099206.db2.gz	NRBDUPUYJZZDTP-CYBMUJFWSA-N	0	0	284.325	4.015	20	30		CIEDRN
C=C(C)CN(C)C(=O)Cc1cc2c(ccc3ccccc23)o1	ZINC000180388891	260099946	/nfs/dbraw/zinc/09/99/46/260099946.db2.gz	CWVXFWMYHXJXRY-UHFFFAOYSA-N	0	0	293.366	4.163	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1ccc(-c2ccccc2)cc1	ZINC000180390656	260100545	/nfs/dbraw/zinc/10/05/45/260100545.db2.gz	VTZZVLCKTKAXSD-UHFFFAOYSA-N	0	0	265.356	4.002	20	30		CIEDRN
C=C(C)CN(C)C(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl	ZINC000180398485	260100777	/nfs/dbraw/zinc/10/07/77/260100777.db2.gz	OHLCOPBPJCJRPI-QWHCGFSZSA-N	0	0	298.213	4.131	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1ccccc1Oc1ccccc1	ZINC000180414857	260101418	/nfs/dbraw/zinc/10/14/18/260101418.db2.gz	FNGBXMAWCBKURQ-UHFFFAOYSA-N	0	0	281.355	4.127	20	30		CIEDRN
C=C(C)CN(C)C(=O)CCCCCO[C@H]1CCC[C@H](C)C1	ZINC000180438729	260101656	/nfs/dbraw/zinc/10/16/56/260101656.db2.gz	RHUBDEBGCOWBMN-IRXDYDNUSA-N	0	0	295.467	4.177	20	30		CIEDRN
C=C(C)CN(C)C(=O)C[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000180448762	260102161	/nfs/dbraw/zinc/10/21/61/260102161.db2.gz	KWKDVEVTQFJBCU-GFCCVEGCSA-N	0	0	299.336	4.234	20	30		CIEDRN
N#Cc1ccc(OC[C@H]2CCC(F)(F)C2)cc1Cl	ZINC000306034419	260114222	/nfs/dbraw/zinc/11/42/22/260114222.db2.gz	SDLXCHNWAWWYEM-VIFPVBQESA-N	0	0	271.694	4.026	20	30		CIEDRN
N#Cc1ccnc(Oc2ccc(Cl)cc2F)c1Cl	ZINC000394164283	260120641	/nfs/dbraw/zinc/12/06/41/260120641.db2.gz	QBDXOXMOSNWMHE-UHFFFAOYSA-N	0	0	283.089	4.191	20	30		CIEDRN
C=C(C)CS[C@@H](C)C(=O)Nc1c(C)cc(C)cc1C	ZINC000357036485	260123055	/nfs/dbraw/zinc/12/30/55/260123055.db2.gz	KOIIADBIMXXTKE-AWEZNQCLSA-N	0	0	277.433	4.248	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)N([C@H](C)c1ccco1)C1CC1	ZINC000297536784	260127846	/nfs/dbraw/zinc/12/78/46/260127846.db2.gz	YKJQGEVJWFCDIW-CYBMUJFWSA-N	0	0	290.407	4.117	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccccc1OCC1CC1	ZINC000297602028	260129451	/nfs/dbraw/zinc/12/94/51/260129451.db2.gz	HEOZMLFEXAVIQW-UHFFFAOYSA-N	0	0	273.376	4.016	20	30		CIEDRN
N#CCOc1cccc(NC2CCC(C(F)(F)F)CC2)c1	ZINC000068634890	260145154	/nfs/dbraw/zinc/14/51/54/260145154.db2.gz	MWZPXUFODUJHGY-UHFFFAOYSA-N	0	0	298.308	4.122	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@H](C)c1ncc(-c2ccccc2)o1	ZINC000188489422	260149022	/nfs/dbraw/zinc/14/90/22/260149022.db2.gz	YRPAZYFIWCVFHT-ACJLOTCBSA-N	0	0	298.386	4.121	20	30		CIEDRN
N#CCc1ccc(N[C@H]2CCC[C@H](C(F)(F)F)C2)cc1	ZINC000069380421	260149905	/nfs/dbraw/zinc/14/99/05/260149905.db2.gz	QQRXEBSKAPTDHC-JSGCOSHPSA-N	0	0	282.309	4.286	20	30		CIEDRN
N#CCOc1cccc(N[C@@H]2CCC[C@@H](C(F)(F)F)C2)c1	ZINC000069380279	260149925	/nfs/dbraw/zinc/14/99/25/260149925.db2.gz	HCPSACWXAIIBRL-VXGBXAGGSA-N	0	0	298.308	4.122	20	30		CIEDRN
COc1cccc(F)c1[C@@H](C)Nc1ccc(C#N)cc1F	ZINC000078421053	260167011	/nfs/dbraw/zinc/16/70/11/260167011.db2.gz	KCXNSZWKRDVQHE-SNVBAGLBSA-N	0	0	288.297	4.018	20	30		CIEDRN
COc1cccc(F)c1[C@H](C)Nc1ccc(C#N)cc1F	ZINC000078421048	260167037	/nfs/dbraw/zinc/16/70/37/260167037.db2.gz	KCXNSZWKRDVQHE-JTQLQIEISA-N	0	0	288.297	4.018	20	30		CIEDRN
C[C@H](Nc1cc(C(F)(F)F)ccn1)c1ccc(C#N)cc1	ZINC000078592013	260168252	/nfs/dbraw/zinc/16/82/52/260168252.db2.gz	RSBSHAJZMIWQKT-JTQLQIEISA-N	0	0	291.276	4.145	20	30		CIEDRN
Cc1cc(NCCCC(C)(C)C#N)ccc1Br	ZINC000087597020	260191736	/nfs/dbraw/zinc/19/17/36/260191736.db2.gz	MDAGOESBVQLIMO-UHFFFAOYSA-N	0	0	295.224	4.499	20	30		CIEDRN
Cc1c(Cl)cccc1NCCCC(C)(C)C#N	ZINC000087596985	260191970	/nfs/dbraw/zinc/19/19/70/260191970.db2.gz	ZKGGKXNCNNFIPT-UHFFFAOYSA-N	0	0	250.773	4.390	20	30		CIEDRN
CC(C)(C#N)CCCOc1ccccc1Br	ZINC000087598975	260191963	/nfs/dbraw/zinc/19/19/63/260191963.db2.gz	GOWWURJIEADJBX-UHFFFAOYSA-N	0	0	282.181	4.158	20	30		CIEDRN
Cc1nc(NCc2cc(Cl)sc2Cl)ccc1C#N	ZINC000312754050	260197510	/nfs/dbraw/zinc/19/75/10/260197510.db2.gz	CJQBDPRSHKFIOT-UHFFFAOYSA-N	0	0	298.198	4.242	20	30		CIEDRN
CC(C)(C#N)CCCN1c2cccc3cccc(c23)C1=O	ZINC000087608826	260215352	/nfs/dbraw/zinc/21/53/52/260215352.db2.gz	RRKGEKDFLUDILH-UHFFFAOYSA-N	0	0	278.355	4.130	20	30		CIEDRN
C[C@H](NC(=O)C1(C#N)CCCCC1)c1cc2ccccc2o1	ZINC000057384374	260224505	/nfs/dbraw/zinc/22/45/05/260224505.db2.gz	GFSRWBVQFLVEQY-ZDUSSCGKSA-N	0	0	296.370	4.084	20	30		CIEDRN
CC[C@H]1CC[C@H](C)N1C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000408091697	260226369	/nfs/dbraw/zinc/22/63/69/260226369.db2.gz	VZVIRPMCQQJQJH-GWCFXTLKSA-N	0	0	291.782	4.006	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)Nc1ccc2c(c1)Cc1ccccc1-2	ZINC000317451454	260229426	/nfs/dbraw/zinc/22/94/26/260229426.db2.gz	SVPDWJAVQXJOQX-LJQANCHMSA-N	0	0	290.366	4.136	20	30		CIEDRN
N#CC1(C(=O)Nc2cccc(SC(F)F)c2)CCCC1	ZINC000066554766	260247138	/nfs/dbraw/zinc/24/71/38/260247138.db2.gz	HTMRYOPAPDXNRG-UHFFFAOYSA-N	0	0	296.342	4.024	20	30		CIEDRN
CC[C@@H](C)NC(=O)Nc1ccccc1S[C@H](C)CC#N	ZINC000066954488	260250180	/nfs/dbraw/zinc/25/01/80/260250180.db2.gz	FUEQPPDGCQNOKN-VXGBXAGGSA-N	0	0	291.420	4.001	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N(C)[C@H](C)c1cccs1	ZINC000069606765	260262072	/nfs/dbraw/zinc/26/20/72/260262072.db2.gz	BEKRYJXUMLRRBW-GFCCVEGCSA-N	0	0	299.399	4.153	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(OC(C)C)cc1C	ZINC000526047215	260262395	/nfs/dbraw/zinc/26/23/95/260262395.db2.gz	XJWUJCYHOOYLSV-KRWDZBQOSA-N	0	0	275.392	4.323	20	30		CIEDRN
Cc1ccc(C(F)(F)F)cc1NCCC(C)(C)C#N	ZINC000091479279	260265910	/nfs/dbraw/zinc/26/59/10/260265910.db2.gz	FSZLKLDCKJGUCQ-UHFFFAOYSA-N	0	0	270.298	4.366	20	30		CIEDRN
CC(C)(C)c1ccc(NC(=O)N(CCC#N)CC2CC2)cc1	ZINC000078439795	260300296	/nfs/dbraw/zinc/30/02/96/260300296.db2.gz	MSNWVLMJUNFTGC-UHFFFAOYSA-N	0	0	299.418	4.142	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N[C@H]1CCc2sc(Cl)cc21	ZINC000518021973	260335296	/nfs/dbraw/zinc/33/52/96/260335296.db2.gz	GATWRYIZAUUYGD-ONGXEEELSA-N	0	0	298.839	4.043	20	30		CIEDRN
CC(C)(C#N)CCNc1cc(Cl)ccc1Cl	ZINC000083637513	260353818	/nfs/dbraw/zinc/35/38/18/260353818.db2.gz	JXVUWQRLFRILEC-UHFFFAOYSA-N	0	0	257.164	4.345	20	30		CIEDRN
N#Cc1ccsc1C(=O)N(CC1CCC1)c1ccccc1	ZINC000084244477	260361569	/nfs/dbraw/zinc/36/15/69/260361569.db2.gz	HZSMVYRJJJREKD-UHFFFAOYSA-N	0	0	296.395	4.067	20	30		CIEDRN
C=C(C)CN(CC)C(=O)CCCCCc1cccs1	ZINC000518285102	260368157	/nfs/dbraw/zinc/36/81/57/260368157.db2.gz	HLWMPEXDCDXKKX-UHFFFAOYSA-N	0	0	279.449	4.276	20	30		CIEDRN
CC1(C)CCC(Nc2nc(C(F)(F)F)ccc2C#N)CC1	ZINC000090794917	260410690	/nfs/dbraw/zinc/41/06/90/260410690.db2.gz	MJCQUWHYMACELY-UHFFFAOYSA-N	0	0	297.324	4.353	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@@H](C)CSCc1ccccc1	ZINC000410134323	260464275	/nfs/dbraw/zinc/46/42/75/260464275.db2.gz	IBTOKTIYIBSULP-HOCLYGCPSA-N	0	0	291.460	4.027	20	30		CIEDRN
Cc1cccc2sc(NCc3cccc(C#N)c3)nc21	ZINC000091945870	260468747	/nfs/dbraw/zinc/46/87/47/260468747.db2.gz	QPFMWZBXNJSSRP-UHFFFAOYSA-N	0	0	279.368	4.089	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)[C@@H]1C[C@@]1(C)CC	ZINC000410343165	260487429	/nfs/dbraw/zinc/48/74/29/260487429.db2.gz	DIIJWPMSTFPBHV-WMLDXEAASA-N	0	0	257.377	4.180	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc2ccc(Cl)cc2n1	ZINC000410425300	260494152	/nfs/dbraw/zinc/49/41/52/260494152.db2.gz	BIVCYBJLTSMTOH-LLVKDONJSA-N	0	0	288.778	4.429	20	30		CIEDRN
CC(C)[C@H](c1ccccc1)N(C)C(=O)c1cscc1C#N	ZINC000410476701	260529603	/nfs/dbraw/zinc/52/96/03/260529603.db2.gz	MDBVTVVYUACAJZ-MRXNPFEDSA-N	0	0	298.411	4.089	20	30		CIEDRN
C=C(C)CN(C)[C@H](C)C(=O)Nc1ccccc1[C@H](C)CC	ZINC000181289111	260577722	/nfs/dbraw/zinc/57/77/22/260577722.db2.gz	GAAOGPISMMLHIE-HUUCEWRRSA-N	0	0	288.435	4.035	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ncccc1-c1ccccc1	ZINC000181417839	260582020	/nfs/dbraw/zinc/58/20/20/260582020.db2.gz	SNOBVFHFOJXFIA-UHFFFAOYSA-N	0	0	292.382	4.456	20	30		CIEDRN
C=CCN(CC(F)(F)F)C(=O)CC/C=C/c1ccccc1	ZINC000152546435	260654202	/nfs/dbraw/zinc/65/42/02/260654202.db2.gz	WRVWSCWCVXPHRQ-UXBLZVDNSA-N	0	0	297.320	4.057	20	30		CIEDRN
CC(C)CC[C@H]1CCCN1C(=O)Nc1ccc(CC#N)cc1	ZINC000121101241	260707873	/nfs/dbraw/zinc/70/78/73/260707873.db2.gz	IZTRTFLFOBUCDS-QGZVFWFLSA-N	0	0	299.418	4.185	20	30		CIEDRN
N#CCCCCSc1nnc(-c2ccc(Cl)s2)o1	ZINC000122765739	260723048	/nfs/dbraw/zinc/72/30/48/260723048.db2.gz	SCUMHQZHRNBJIH-UHFFFAOYSA-N	0	0	299.808	4.237	20	30		CIEDRN
C=CCC[C@@H](Nc1ccc2nccnc2n1)c1ccccc1	ZINC000154569909	260749727	/nfs/dbraw/zinc/74/97/27/260749727.db2.gz	FVAQRJIDFNHDQO-OAHLLOKOSA-N	0	0	290.370	4.144	20	30		CIEDRN
N#Cc1c(F)cccc1CNc1ccc(F)cc1Cl	ZINC000427516073	260756977	/nfs/dbraw/zinc/75/69/77/260756977.db2.gz	WTSIJQRMEOMDIQ-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
CCCOc1cccc(NCc2cccc(F)c2C#N)c1	ZINC000427569287	260771233	/nfs/dbraw/zinc/77/12/33/260771233.db2.gz	OEDINIITEOMRMC-UHFFFAOYSA-N	0	0	284.334	4.098	20	30		CIEDRN
C=CC[C@H](C(=O)N1CC2(CCC2)[C@H]1C1CC1)c1ccccc1	ZINC000427594701	260777357	/nfs/dbraw/zinc/77/73/57/260777357.db2.gz	BBMPORXWLGGJHW-ZWKOTPCHSA-N	0	0	295.426	4.137	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Nc1ccc2[nH]ccc2c1	ZINC000158858054	260905225	/nfs/dbraw/zinc/90/52/25/260905225.db2.gz	TVSRWQVONZQYOP-UHFFFAOYSA-N	0	0	285.391	4.378	20	30		CIEDRN
C[C@H](CC#N)Sc1ccccc1NCCCCCCO	ZINC000134655524	260914179	/nfs/dbraw/zinc/91/41/79/260914179.db2.gz	YGLJUVPXMKKFJY-CQSZACIVSA-N	0	0	292.448	4.045	20	30		CIEDRN
Cc1cccc2c1CC[C@@H]2Nc1ccc(F)cc1C#N	ZINC000525706122	260946533	/nfs/dbraw/zinc/94/65/33/260946533.db2.gz	VTOPLPCRGWSLOI-KRWDZBQOSA-N	0	0	266.319	4.105	20	30		CIEDRN
C[C@H](C(=O)Nc1ccc(C(C)(C)C#N)cc1)c1cccs1	ZINC000151822906	261056042	/nfs/dbraw/zinc/05/60/42/261056042.db2.gz	YJLOXWNSWIZCSR-LBPRGKRZSA-N	0	0	298.411	4.291	20	30		CIEDRN
C=CCCCNC(=O)N(C)[C@H](c1ccc(F)cc1)C(C)C	ZINC000448248995	261061540	/nfs/dbraw/zinc/06/15/40/261061540.db2.gz	SONIDTWHXDGPBZ-INIZCTEOSA-N	0	0	292.398	4.130	20	30		CIEDRN
N#CCC[C@H](NC(=O)CC1=CCCCC1)c1ccccc1	ZINC000153229016	261075285	/nfs/dbraw/zinc/07/52/85/261075285.db2.gz	VOPYZTCQZBGOPL-KRWDZBQOSA-N	0	0	282.387	4.038	20	30		CIEDRN
CC(C)Oc1ccccc1NCCCC(C)(C)C#N	ZINC000153209502	261075338	/nfs/dbraw/zinc/07/53/38/261075338.db2.gz	YGZYRPUZPYPQDD-UHFFFAOYSA-N	0	0	260.381	4.216	20	30		CIEDRN
N#CCC[C@@H](NC(=O)CC1=CCCCC1)c1ccccc1	ZINC000153228896	261075394	/nfs/dbraw/zinc/07/53/94/261075394.db2.gz	VOPYZTCQZBGOPL-QGZVFWFLSA-N	0	0	282.387	4.038	20	30		CIEDRN
CC(C)c1cccc(C(C)C)c1NC(=O)N[C@@H](C)CC#N	ZINC000153245501	261075733	/nfs/dbraw/zinc/07/57/33/261075733.db2.gz	MIVWELXLXDSHFP-ZDUSSCGKSA-N	0	0	287.407	4.357	20	30		CIEDRN
CC(C)(C#N)CCCNc1ccc(OC(F)F)c(F)c1	ZINC000153408167	261077764	/nfs/dbraw/zinc/07/77/64/261077764.db2.gz	ZNJADSPIEJXAKG-UHFFFAOYSA-N	0	0	286.297	4.169	20	30		CIEDRN
COc1ccc(OC(C)C)c(NCCCC(C)(C)C#N)c1	ZINC000153900107	261085014	/nfs/dbraw/zinc/08/50/14/261085014.db2.gz	DMGHQAAZHTWLFS-UHFFFAOYSA-N	0	0	290.407	4.224	20	30		CIEDRN
CC(C)(C#N)CCCNc1c(F)cccc1N1CCCC1	ZINC000153958035	261085543	/nfs/dbraw/zinc/08/55/43/261085543.db2.gz	FMCJESKNHZKIOG-UHFFFAOYSA-N	0	0	289.398	4.168	20	30		CIEDRN
CCc1noc([C@@H](C)Sc2ccc(C#N)cc2Cl)n1	ZINC000154159413	261088554	/nfs/dbraw/zinc/08/85/54/261088554.db2.gz	WMQXVFUWLLQARQ-MRVPVSSYSA-N	0	0	293.779	4.010	20	30		CIEDRN
Cc1cc(C#N)cc(C)c1OC[C@@H]1CCCCC1(F)F	ZINC000394493328	261091088	/nfs/dbraw/zinc/09/10/88/261091088.db2.gz	DYGQBYGCBUDKNH-AWEZNQCLSA-N	0	0	279.330	4.379	20	30		CIEDRN
Cc1cc(C#N)cc(C)c1OC[C@H]1CCCCC1(F)F	ZINC000394493333	261091847	/nfs/dbraw/zinc/09/18/47/261091847.db2.gz	DYGQBYGCBUDKNH-CQSZACIVSA-N	0	0	279.330	4.379	20	30		CIEDRN
N#Cc1ccc(OC[C@H]2CCCCC2(F)F)c(Cl)c1	ZINC000394499294	261102066	/nfs/dbraw/zinc/10/20/66/261102066.db2.gz	LIXJNDBYCPFFTG-LLVKDONJSA-N	0	0	285.721	4.416	20	30		CIEDRN
CCN(C(=O)[C@H]1CCCCC1(C)C)c1ccc(C#N)cc1	ZINC000448305524	261105352	/nfs/dbraw/zinc/10/53/52/261105352.db2.gz	BUPIJXPIQLXBES-MRXNPFEDSA-N	0	0	284.403	4.128	20	30		CIEDRN
C=CCCCNC(=O)N(C1CC1)[C@@H]1CCCc2ccccc21	ZINC000448391022	261138681	/nfs/dbraw/zinc/13/86/81/261138681.db2.gz	SKLOLOYHEZPVIP-GOSISDBHSA-N	0	0	298.430	4.204	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)[C@H]1CCCCC1(C)C	ZINC000448400386	261143138	/nfs/dbraw/zinc/14/31/38/261143138.db2.gz	RWGVXWLNCGSIEH-CQSZACIVSA-N	0	0	278.440	4.134	20	30		CIEDRN
N#Cc1ccccc1NC(=O)c1cccc(Cl)c1Cl	ZINC000000513757	261183966	/nfs/dbraw/zinc/18/39/66/261183966.db2.gz	VCVSLGIECXPYRC-UHFFFAOYSA-N	0	0	291.137	4.117	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)NCc2ccsc2)CCCC1(C)C	ZINC000444869990	261192059	/nfs/dbraw/zinc/19/20/59/261192059.db2.gz	FYTSRELCCDJGJQ-AWEZNQCLSA-N	0	0	292.448	4.024	20	30		CIEDRN
CCc1noc(C)c1CS[C@H](C)c1ccc(C#N)cc1	ZINC000159802714	261194208	/nfs/dbraw/zinc/19/42/08/261194208.db2.gz	DEGVPTXNPUDLKQ-GFCCVEGCSA-N	0	0	286.400	4.412	20	30		CIEDRN
CCN(Cc1ccc(OC(C)C)c(Cl)c1)C[C@@H](C)C#N	ZINC000187792840	261195002	/nfs/dbraw/zinc/19/50/02/261195002.db2.gz	WTEUYIKSDULFKD-ZDUSSCGKSA-N	0	0	294.826	4.109	20	30		CIEDRN
CC(C)Oc1cccc([C@H](C)NCc2ccccc2C#N)c1	ZINC000160145511	261206234	/nfs/dbraw/zinc/20/62/34/261206234.db2.gz	FINSCSHQPUCRJE-HNNXBMFYSA-N	0	0	294.398	4.196	20	30		CIEDRN
Cc1ccc(C)c(NC(=O)c2cccc(SCC#N)c2)c1	ZINC000175492592	261228958	/nfs/dbraw/zinc/22/89/58/261228958.db2.gz	RQKIMPICJKXRPK-UHFFFAOYSA-N	0	0	296.395	4.171	20	30		CIEDRN
CC(C)(C#N)CCCSCc1ccc2c(c1)OCCO2	ZINC000161674374	261256157	/nfs/dbraw/zinc/25/61/57/261256157.db2.gz	MPQLNMSKOXBSOC-UHFFFAOYSA-N	0	0	291.416	4.021	20	30		CIEDRN
N#CCCCCSCc1ccc(Br)s1	ZINC000161672225	261256296	/nfs/dbraw/zinc/25/62/96/261256296.db2.gz	GOQWHHJBSMKMRE-UHFFFAOYSA-N	0	0	290.251	4.438	20	30		CIEDRN
Cc1ccc(NCc2cccc(OCCCC#N)c2)cc1	ZINC000102938761	261272943	/nfs/dbraw/zinc/27/29/43/261272943.db2.gz	MPLORSQLOXZZFA-UHFFFAOYSA-N	0	0	280.371	4.290	20	30		CIEDRN
CCC(CC)CN(CCC#N)C(=O)Nc1ccc(C)s1	ZINC000176338576	261277293	/nfs/dbraw/zinc/27/72/93/261277293.db2.gz	DXDGPPUAMPQRAV-UHFFFAOYSA-N	0	0	293.436	4.240	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N1CCC[C@H]1c1cccc(C)c1C	ZINC000176859731	261313241	/nfs/dbraw/zinc/31/32/41/261313241.db2.gz	UXMWODJZSNCFNB-YOEHRIQHSA-N	0	0	286.419	4.115	20	30		CIEDRN
CCCCc1noc([C@@H](C)Sc2cccc(C#N)c2)n1	ZINC000177098982	261332618	/nfs/dbraw/zinc/33/26/18/261332618.db2.gz	XGIKTFYDFOEKAX-LLVKDONJSA-N	0	0	287.388	4.137	20	30		CIEDRN
CO[C@@H](CNc1cc(Cl)ccc1C#N)c1ccccc1	ZINC000301353638	261332696	/nfs/dbraw/zinc/33/26/96/261332696.db2.gz	JSKOBLJKKYDJQS-INIZCTEOSA-N	0	0	286.762	4.011	20	30		CIEDRN
CC(C)c1nnc(N[C@@H](CCC#N)c2ccccc2)s1	ZINC000164321558	261347995	/nfs/dbraw/zinc/34/79/95/261347995.db2.gz	LSQRCROQVNCIBM-ZDUSSCGKSA-N	0	0	286.404	4.118	20	30		CIEDRN
Cc1c2ccccc2oc1C(=O)Nc1ccc(F)cc1C#N	ZINC000177566349	261361247	/nfs/dbraw/zinc/36/12/47/261361247.db2.gz	MHHLHKFHIVXKCS-UHFFFAOYSA-N	0	0	294.285	4.004	20	30		CIEDRN
N#Cc1c(F)cccc1Sc1ccc(C(F)(F)F)cn1	ZINC000106007891	261365267	/nfs/dbraw/zinc/36/52/67/261365267.db2.gz	YIBQCNLRYCIHSX-UHFFFAOYSA-N	0	0	298.264	4.262	20	30		CIEDRN
CCc1sc(C(=O)Nc2cccc(C#N)c2C)cc1C	ZINC000178381321	261389600	/nfs/dbraw/zinc/38/96/00/261389600.db2.gz	ZLRSGOPJWJQXOY-UHFFFAOYSA-N	0	0	284.384	4.051	20	30		CIEDRN
C=CCC[C@@H](NC(=O)N(C(C)C)C1CC1)c1ccccc1	ZINC000178452598	261392231	/nfs/dbraw/zinc/39/22/31/261392231.db2.gz	UXPKSEPGKLYUDS-QGZVFWFLSA-N	0	0	286.419	4.276	20	30		CIEDRN
N#CCCCOc1cccc(N[C@H]2CCCc3occc32)c1	ZINC000178494098	261395125	/nfs/dbraw/zinc/39/51/25/261395125.db2.gz	YKNVJAWRXWFIHO-KRWDZBQOSA-N	0	0	296.370	4.452	20	30		CIEDRN
N#Cc1ccc(/C=C/c2cc(F)cc(C(F)(F)F)c2)nc1	ZINC000178724157	261402843	/nfs/dbraw/zinc/40/28/43/261402843.db2.gz	JNBJYNAYUJHMDB-HNQUOIGGSA-N	0	0	292.235	4.282	20	30		CIEDRN
C[C@@H](Nc1cccc(OCCCC#N)c1)c1cncc(F)c1	ZINC000179821912	261419838	/nfs/dbraw/zinc/41/98/38/261419838.db2.gz	NROYIPKDTHMVCZ-CYBMUJFWSA-N	0	0	299.349	4.076	20	30		CIEDRN
CCCC[C@@H](CC)Cn1cc(C#N)c(=O)c2ccccc21	ZINC000171555188	261471326	/nfs/dbraw/zinc/47/13/26/261471326.db2.gz	YYROSHGUSFFCNP-CQSZACIVSA-N	0	0	282.387	4.090	20	30		CIEDRN
C[C@@H](C#N)CSc1ccccc1NC(=O)CC1CCC1	ZINC000173137411	261523398	/nfs/dbraw/zinc/52/33/98/261523398.db2.gz	SBFSUXLYGIWZKQ-LBPRGKRZSA-N	0	0	288.416	4.067	20	30		CIEDRN
N#CCSCCCSc1ccccc1Cl	ZINC000174003166	261553475	/nfs/dbraw/zinc/55/34/75/261553475.db2.gz	MTNZKMGOZIWSMV-UHFFFAOYSA-N	0	0	257.811	4.079	20	30		CIEDRN
C=C(C)Cn1c(C(C)C)nnc1N(C)c1ccc(C)cc1	ZINC000460549807	261620086	/nfs/dbraw/zinc/62/00/86/261620086.db2.gz	BDWQODSNQIWLQL-UHFFFAOYSA-N	0	0	284.407	4.054	20	30		CIEDRN
Cc1ccc(OCCCSc2ccc(C#N)cn2)cc1C	ZINC000514487522	261746161	/nfs/dbraw/zinc/74/61/61/261746161.db2.gz	GFJQCVYMSLGQPQ-UHFFFAOYSA-N	0	0	298.411	4.131	20	30		CIEDRN
C=CCOc1ccc(CN(C(=O)C(C)C)C(C)(C)C)cc1	ZINC000188082501	261842034	/nfs/dbraw/zinc/84/20/34/261842034.db2.gz	BOSNOBBMPMROFN-UHFFFAOYSA-N	0	0	289.419	4.035	20	30		CIEDRN
CC(C)COc1cccc(NCc2ccc(F)c(C#N)c2)c1	ZINC000318574498	262000131	/nfs/dbraw/zinc/00/01/31/262000131.db2.gz	COPMJBZLICRDJB-UHFFFAOYSA-N	0	0	298.361	4.344	20	30		CIEDRN
N#Cc1ccc(Sc2cc(Cl)ccc2Cl)nc1	ZINC000019230289	262046964	/nfs/dbraw/zinc/04/69/64/262046964.db2.gz	HAIOEXOWTIQPFW-UHFFFAOYSA-N	0	0	281.167	4.411	20	30		CIEDRN
N#C[C@@H]1CCC[C@@H](Nc2ccccc2N2CCCCC2)C1	ZINC000185731607	262068820	/nfs/dbraw/zinc/06/88/20/262068820.db2.gz	PYIVUEXCKIOPJD-HZPDHXFCSA-N	0	0	283.419	4.171	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](c2cccs2)C[C@@H]1C	ZINC000364068470	262135312	/nfs/dbraw/zinc/13/53/12/262135312.db2.gz	SLTCNVLMZUUFFD-IHRRRGAJSA-N	0	0	277.433	4.055	20	30		CIEDRN
CC[C@H](C#N)Sc1nc2cc(F)cc(Cl)c2o1	ZINC000187996101	262146879	/nfs/dbraw/zinc/14/68/79/262146879.db2.gz	UEQNNPGNIKAPKE-SSDOTTSWSA-N	0	0	270.716	4.015	20	30		CIEDRN
C[C@@H](CCC#N)Sc1nc2cc(Cl)ccc2[nH]1	ZINC000188189244	262150232	/nfs/dbraw/zinc/15/02/32/262150232.db2.gz	VWWIGCMYBRHUEI-QMMMGPOBSA-N	0	0	265.769	4.001	20	30		CIEDRN
C[C@H](CCC#N)Sc1nc2cc(Cl)ccc2[nH]1	ZINC000188189267	262150385	/nfs/dbraw/zinc/15/03/85/262150385.db2.gz	VWWIGCMYBRHUEI-MRVPVSSYSA-N	0	0	265.769	4.001	20	30		CIEDRN
C=CCN(CCc1ccccc1)C(=O)CC1CCCCC1	ZINC000499303533	262152421	/nfs/dbraw/zinc/15/24/21/262152421.db2.gz	ZVOPKJGMJNKDSK-UHFFFAOYSA-N	0	0	285.431	4.214	20	30		CIEDRN
C/C=C(\CC)C(=O)Nc1ccccc1S[C@@H](C)CC#N	ZINC000188787155	262161537	/nfs/dbraw/zinc/16/15/37/262161537.db2.gz	WQJCJOQHZGRCNB-XUKLUBCTSA-N	0	0	288.416	4.376	20	30		CIEDRN
CN(CC(C)(C)C#N)C(=O)c1sccc1-c1ccccc1	ZINC000497454616	262164223	/nfs/dbraw/zinc/16/42/23/262164223.db2.gz	XDHHRKLLRSGMCP-UHFFFAOYSA-N	0	0	298.411	4.037	20	30		CIEDRN
C=CCC1(C(=O)Nc2cccc(OCCCC#N)c2)CCC1	ZINC000189013798	262165130	/nfs/dbraw/zinc/16/51/30/262165130.db2.gz	NEKZYXYQFYCFIG-UHFFFAOYSA-N	0	0	298.386	4.054	20	30		CIEDRN
CC(C)c1ccc(C(=O)COc2cc(F)cc(C#N)c2)cc1	ZINC000319076747	262165429	/nfs/dbraw/zinc/16/54/29/262165429.db2.gz	BALKHQIEDKTEPH-UHFFFAOYSA-N	0	0	297.329	4.082	20	30		CIEDRN
CC(C)c1ccc([C@H]2CCCCN2C(=O)[C@@H](C)C#N)cc1	ZINC000497474991	262167551	/nfs/dbraw/zinc/16/75/51/262167551.db2.gz	WACGPCYHVKKFNZ-WMLDXEAASA-N	0	0	284.403	4.023	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1oc2c(c1C)c(C)ccc2C	ZINC000497488076	262168421	/nfs/dbraw/zinc/16/84/21/262168421.db2.gz	ITQXFBFGZMDITD-UHFFFAOYSA-N	0	0	285.387	4.396	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cccc(O[C@H](C)CC)c1	ZINC000497634573	262183721	/nfs/dbraw/zinc/18/37/21/262183721.db2.gz	SHRBVQSYQHDADF-ZIAGYGMSSA-N	0	0	275.392	4.405	20	30		CIEDRN
Cc1cccc(C)c1NC(=O)CCCSCCCC#N	ZINC000190873690	262186571	/nfs/dbraw/zinc/18/65/71/262186571.db2.gz	LVVXDTLMIUJWSR-UHFFFAOYSA-N	0	0	290.432	4.059	20	30		CIEDRN
CC[C@H](C)CC(=O)Nc1ccccc1S[C@@H](C)CC#N	ZINC000191527795	262192977	/nfs/dbraw/zinc/19/29/77/262192977.db2.gz	JRSBEXPKKKFVDH-STQMWFEESA-N	0	0	290.432	4.456	20	30		CIEDRN
C#CCCCC(=O)N(c1ccc(F)cc1Cl)C(C)C	ZINC000192251627	262201070	/nfs/dbraw/zinc/20/10/70/262201070.db2.gz	CXKKVDKWQWXRRQ-UHFFFAOYSA-N	0	0	281.758	4.024	20	30		CIEDRN
CCCCCCCC(=O)N1CCC(c2ccncc2)CC1	ZINC000192290459	262201287	/nfs/dbraw/zinc/20/12/87/262201287.db2.gz	IIUCUPMBNHIWQD-UHFFFAOYSA-N	0	0	288.435	4.148	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@H](c1ccccc1C)C(C)(C)C	ZINC000497839383	262216843	/nfs/dbraw/zinc/21/68/43/262216843.db2.gz	HJMJKZMYYQTDQH-MRXNPFEDSA-N	0	0	288.435	4.300	20	30		CIEDRN
Cc1ncc(-c2ccc(N[C@H]3CCC[C@H](C#N)C3)cc2)o1	ZINC000193139657	262217256	/nfs/dbraw/zinc/21/72/56/262217256.db2.gz	SNJVIYBUNJLZRR-BBRMVZONSA-N	0	0	281.359	4.144	20	30		CIEDRN
CC(C)n1ncc2ccc(N[C@H]3CCC[C@H](C#N)C3)cc21	ZINC000193207022	262218086	/nfs/dbraw/zinc/21/80/86/262218086.db2.gz	MACABQRACSGRDW-ZFWWWQNUSA-N	0	0	282.391	4.111	20	30		CIEDRN
Cc1coc(-c2cc(N[C@H]3CCC[C@H](C#N)C3)ccc2C)n1	ZINC000193269175	262219414	/nfs/dbraw/zinc/21/94/14/262219414.db2.gz	VCACKMQDJHYNAC-GJZGRUSLSA-N	0	0	295.386	4.453	20	30		CIEDRN
CC(F)(F)c1cccc(N[C@H]2CCC[C@H](C#N)C2)c1	ZINC000193322703	262220675	/nfs/dbraw/zinc/22/06/75/262220675.db2.gz	RJBMNLPXRYKNJF-AAEUAGOBSA-N	0	0	264.319	4.293	20	30		CIEDRN
COc1cc(NCC(C)(C)CCC#N)ccc1Cl	ZINC000193680734	262225998	/nfs/dbraw/zinc/22/59/98/262225998.db2.gz	LGOCXJXLCIIITK-UHFFFAOYSA-N	0	0	266.772	4.090	20	30		CIEDRN
C[C@H](Nc1ccc(C#N)cc1)c1cccc(OC(F)F)c1	ZINC000020091281	262228380	/nfs/dbraw/zinc/22/83/80/262228380.db2.gz	QXHDUXCRNTVTEB-NSHDSACASA-N	0	0	288.297	4.333	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)[C@H](OC(C)C)c1ccccc1	ZINC000497938940	262236074	/nfs/dbraw/zinc/23/60/74/262236074.db2.gz	SOGWNZLZWJBYJN-NVXWUHKLSA-N	0	0	289.419	4.014	20	30		CIEDRN
CC[C@@H](CC#N)NCc1cc(-c2ccccc2)cs1	ZINC000054183957	262259770	/nfs/dbraw/zinc/25/97/70/262259770.db2.gz	YPMSQJVPBXVCHW-HNNXBMFYSA-N	0	0	270.401	4.197	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2ccccc2C(F)(F)F)CC1	ZINC000111419254	262262376	/nfs/dbraw/zinc/26/23/76/262262376.db2.gz	ZPNBNGQNQICJKJ-UHFFFAOYSA-N	0	0	298.308	4.135	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1cc(OC)ccc1F)c1ccccc1	ZINC000188512728	262305113	/nfs/dbraw/zinc/30/51/13/262305113.db2.gz	DIKHFRNBUNUHEC-HNNXBMFYSA-N	0	0	299.345	4.133	20	30		CIEDRN
N#C[C@H]1CCC[C@H](Nc2cccc3c2CCCC3)C1	ZINC000463295004	262308816	/nfs/dbraw/zinc/30/88/16/262308816.db2.gz	XGWRDYYOQZBKRY-ZFWWWQNUSA-N	0	0	254.377	4.060	20	30		CIEDRN
CC(C)C[C@@H]1CCCCN1C(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000462197290	262317074	/nfs/dbraw/zinc/31/70/74/262317074.db2.gz	CXTATUARHRJRRQ-YJBOKZPZSA-N	0	0	298.430	4.089	20	30		CIEDRN
C[C@H](SCCCCC#N)c1nc(-c2cccs2)no1	ZINC000161500067	262317262	/nfs/dbraw/zinc/31/72/62/262317262.db2.gz	IDJPEMLGMRDTMW-JTQLQIEISA-N	0	0	293.417	4.286	20	30		CIEDRN
C[C@@H](SCCCCC#N)c1nc(-c2cccs2)no1	ZINC000161500159	262317370	/nfs/dbraw/zinc/31/73/70/262317370.db2.gz	IDJPEMLGMRDTMW-SNVBAGLBSA-N	0	0	293.417	4.286	20	30		CIEDRN
C[C@H](SCCCCC#N)c1cc(F)ccc1F	ZINC000161576550	262317575	/nfs/dbraw/zinc/31/75/75/262317575.db2.gz	UAROHWZSTVWXIM-JTQLQIEISA-N	0	0	255.333	4.453	20	30		CIEDRN
CC(C)Oc1ccc2ccccc2c1CN(C)[C@H](C)CC#N	ZINC000161794253	262319464	/nfs/dbraw/zinc/31/94/64/262319464.db2.gz	OHAQRDGZEOKWIV-OAHLLOKOSA-N	0	0	296.414	4.361	20	30		CIEDRN
C[N@H+](Cc1cccc(C#N)c1)[C@@H]1CCc2c1cccc2Cl	ZINC000488447065	262323259	/nfs/dbraw/zinc/32/32/59/262323259.db2.gz	UWNRDKOYSQZSMT-GOSISDBHSA-N	0	0	296.801	4.331	20	30		CIEDRN
C=CCCC(=O)N1CCC[C@@]1(c1ccccc1)C(F)(F)F	ZINC000162140197	262324937	/nfs/dbraw/zinc/32/49/37/262324937.db2.gz	BGKXKCKLURAOIQ-OAHLLOKOSA-N	0	0	297.320	4.033	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc2nc(C3CC3)oc2c1	ZINC000188619568	262328075	/nfs/dbraw/zinc/32/80/75/262328075.db2.gz	YLUYYAPRDAGERJ-KRWDZBQOSA-N	0	0	284.359	4.246	20	30		CIEDRN
C=CCCCSCCC(=O)Nc1ccc(Cl)cc1	ZINC000522757306	262338359	/nfs/dbraw/zinc/33/83/59/262338359.db2.gz	YVHBVQQQOZLERI-UHFFFAOYSA-N	0	0	283.824	4.368	20	30		CIEDRN
C=CCCCSCCC(=O)NCc1ccccc1Cl	ZINC000522757822	262338896	/nfs/dbraw/zinc/33/88/96/262338896.db2.gz	WUNLFJLHXRHXEX-UHFFFAOYSA-N	0	0	297.851	4.046	20	30		CIEDRN
CCC[C@H](C)[C@H]1CCCN1C(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000462244159	262384162	/nfs/dbraw/zinc/38/41/62/262384162.db2.gz	DDCDQNTYVJUGEP-RLFYNMQTSA-N	0	0	298.430	4.089	20	30		CIEDRN
CCC[C@H](C)[C@H]1CCCN1C(=O)[C@H](C)c1cccc(C#N)c1	ZINC000462244157	262384185	/nfs/dbraw/zinc/38/41/85/262384185.db2.gz	DDCDQNTYVJUGEP-HDMKZQKVSA-N	0	0	298.430	4.089	20	30		CIEDRN
C=CCOc1ccc(CNc2ccc(F)c(F)c2)cc1	ZINC000021500813	262386757	/nfs/dbraw/zinc/38/67/57/262386757.db2.gz	BMYDSYXKXMBYQO-UHFFFAOYSA-N	0	0	275.298	4.142	20	30		CIEDRN
N#Cc1cc(F)c(NCc2cccc(Cl)c2)c(F)c1	ZINC000060196942	262391036	/nfs/dbraw/zinc/39/10/36/262391036.db2.gz	OZHDRFNXCKUAHZ-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C[C@H](CC#N)N(C)Cc1cc(Cl)cc(C(F)(F)F)c1	ZINC000187181061	262392325	/nfs/dbraw/zinc/39/23/25/262392325.db2.gz	IQWQBMWJPGEQKD-SECBINFHSA-N	0	0	290.716	4.093	20	30		CIEDRN
N#CCN(CCCCCOc1ccccc1)C1CCCC1	ZINC000187346652	262399590	/nfs/dbraw/zinc/39/95/90/262399590.db2.gz	XMMKQAFSBGQENC-UHFFFAOYSA-N	0	0	286.419	4.004	20	30		CIEDRN
C=C(C)CSCc1ncc(-c2ccccc2OC)o1	ZINC000365814715	262476728	/nfs/dbraw/zinc/47/67/28/262476728.db2.gz	OEFPZOGSCNOHRC-UHFFFAOYSA-N	0	0	275.373	4.160	20	30		CIEDRN
C=CCCC(=O)N(CC)c1ccc(C(F)(F)F)cc1	ZINC000338102694	262505593	/nfs/dbraw/zinc/50/55/93/262505593.db2.gz	DBWLPFWOOJSXNQ-UHFFFAOYSA-N	0	0	271.282	4.025	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)c1ccn(C(C)C)c1C	ZINC000338858079	262566153	/nfs/dbraw/zinc/56/61/53/262566153.db2.gz	OMXHPWHYPICPOD-UHFFFAOYSA-N	0	0	296.414	4.206	20	30		CIEDRN
Cc1cc(N[C@@H](C)c2ccc(C#N)cc2)c(F)cc1[N+](=O)[O-]	ZINC000320341487	262625111	/nfs/dbraw/zinc/62/51/11/262625111.db2.gz	JLQXSZZIWHDJRY-NSHDSACASA-N	0	0	299.305	4.087	20	30		CIEDRN
C[C@H]1CC(C)(C)N(C(=O)c2ccc(C#N)o2)c2ccccc21	ZINC000410681937	262658579	/nfs/dbraw/zinc/65/85/79/262658579.db2.gz	HGSNNLFTQSZDTA-LBPRGKRZSA-N	0	0	294.354	4.084	20	30		CIEDRN
C[C@@H]1CC(C)(C)N(C(=O)c2ccc(C#N)o2)c2ccccc21	ZINC000410681936	262658755	/nfs/dbraw/zinc/65/87/55/262658755.db2.gz	HGSNNLFTQSZDTA-GFCCVEGCSA-N	0	0	294.354	4.084	20	30		CIEDRN
C=CCC1(C(=O)Nc2sccc2C(C)=O)CCCC1	ZINC000410897754	262672415	/nfs/dbraw/zinc/67/24/15/262672415.db2.gz	SQBDFSXNBJZENB-UHFFFAOYSA-N	0	0	277.389	4.026	20	30		CIEDRN
CC(C)[C@@H](C)C(=O)Nc1scc(C(C)(C)C)c1C#N	ZINC000410927152	262672907	/nfs/dbraw/zinc/67/29/07/262672907.db2.gz	JSMVUKXLLJXWKM-SNVBAGLBSA-N	0	0	278.421	4.148	20	30		CIEDRN
CC(C)(C)c1cc(C#N)c(NC(=O)C[C@@H]2C=CCC2)s1	ZINC000411009660	262675374	/nfs/dbraw/zinc/67/53/74/262675374.db2.gz	YXWWDMILBCKSBF-LLVKDONJSA-N	0	0	288.416	4.212	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccccc1C(C)(F)F	ZINC000411031628	262676012	/nfs/dbraw/zinc/67/60/12/262676012.db2.gz	GSEBPIVVUVNYJZ-AWEZNQCLSA-N	0	0	267.319	4.339	20	30		CIEDRN
C=CC[C@H](C(=O)NC12CCC(CC1)CC2)c1ccccc1	ZINC000411044736	262676050	/nfs/dbraw/zinc/67/60/50/262676050.db2.gz	IQDJARGGASLBMA-RMXPPQQLSA-N	0	0	283.415	4.185	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)C(C)(C)CC(F)F)c1	ZINC000411948329	262710426	/nfs/dbraw/zinc/71/04/26/262710426.db2.gz	USIRESNYZUPXTC-UHFFFAOYSA-N	0	0	297.345	4.261	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC(c2cccc(Cl)c2)C1	ZINC000412388696	262730393	/nfs/dbraw/zinc/73/03/93/262730393.db2.gz	PLDIXIHIJCBLIT-UHFFFAOYSA-N	0	0	289.806	4.034	20	30		CIEDRN
C=CC[C@H](Cc1ccccc1)NC(=O)[C@@H](C)c1ccsc1	ZINC000412837130	262743555	/nfs/dbraw/zinc/74/35/55/262743555.db2.gz	HBZBGRVDJIYAKQ-WMLDXEAASA-N	0	0	299.439	4.155	20	30		CIEDRN
C=CC[C@@H](Cc1ccccc1)NC(=O)[C@H](C)c1ccccc1	ZINC000412838821	262744071	/nfs/dbraw/zinc/74/40/71/262744071.db2.gz	KUSIPPIBZNAXGD-APWZRJJASA-N	0	0	293.410	4.094	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)Nc1ccc(C)cc1SC)OCC	ZINC000413903254	262792179	/nfs/dbraw/zinc/79/21/79/262792179.db2.gz	MQEZDWBPEGOMOI-CQSZACIVSA-N	0	0	293.432	4.027	20	30		CIEDRN
Cc1c2ccccc2oc1C(=O)N(CCC#N)CC(C)(C)C	ZINC000264223138	262885188	/nfs/dbraw/zinc/88/51/88/262885188.db2.gz	HLLCBYWUZVWHAA-UHFFFAOYSA-N	0	0	298.386	4.143	20	30		CIEDRN
CCCCCC(=O)Nc1ccccc1SCCC#N	ZINC000264581302	262890894	/nfs/dbraw/zinc/89/08/94/262890894.db2.gz	XLVKGWDHVZWTSE-UHFFFAOYSA-N	0	0	276.405	4.211	20	30		CIEDRN
CC(C)(C)[C@@](C)(C#N)NC(=O)c1cc(Cl)ccc1Cl	ZINC000272415246	263004170	/nfs/dbraw/zinc/00/41/70/263004170.db2.gz	MHWAWKSJKFRLDF-CQSZACIVSA-N	0	0	299.201	4.052	20	30		CIEDRN
CC[C@H](CC(=O)N1CCC(C)(C#N)CC1)c1ccc(C)cc1	ZINC000272520459	263005580	/nfs/dbraw/zinc/00/55/80/263005580.db2.gz	LBCWIIXMVNBSJZ-MRXNPFEDSA-N	0	0	298.430	4.031	20	30		CIEDRN
Cc1cc(CNc2ccccc2O[C@@H](C)C#N)c(C)s1	ZINC000272533534	263006055	/nfs/dbraw/zinc/00/60/55/263006055.db2.gz	KJKQUFIPLAGMOC-NSHDSACASA-N	0	0	286.400	4.268	20	30		CIEDRN
CSc1ccc(CN(CCC#N)CCC(C)C)cc1	ZINC000353417306	263021307	/nfs/dbraw/zinc/02/13/07/263021307.db2.gz	SHOMDTICZJVENP-UHFFFAOYSA-N	0	0	276.449	4.170	20	30		CIEDRN
C[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc(Cl)cn1	ZINC000274819100	263030942	/nfs/dbraw/zinc/03/09/42/263030942.db2.gz	BHRMQBDCSRPPLC-CXAGYDPISA-N	0	0	299.805	4.431	20	30		CIEDRN
CC(C)(C)Nc1ccccc1NCc1ccccc1C#N	ZINC000277573663	263042216	/nfs/dbraw/zinc/04/22/16/263042216.db2.gz	TXTIEEKPPYZKEF-UHFFFAOYSA-N	0	0	279.387	4.381	20	30		CIEDRN
Cn1cccc1[C@H]1CCCC[N@@H+]1CCCCC(C)(C)C#N	ZINC000277716236	263043092	/nfs/dbraw/zinc/04/30/92/263043092.db2.gz	NCWLIGWLDDZYCH-QGZVFWFLSA-N	0	0	287.451	4.272	20	30		CIEDRN
Cc1cccc(C)c1C[S@@](=O)CCCCC(C)(C)C#N	ZINC000278000657	263045077	/nfs/dbraw/zinc/04/50/77/263045077.db2.gz	UYQUUNMYIIDCQP-FQEVSTJZSA-N	0	0	291.460	4.272	20	30		CIEDRN
Cc1csc(N(C(=O)CC(C)(C)C#N)c2ccccc2)n1	ZINC000278235046	263045822	/nfs/dbraw/zinc/04/58/22/263045822.db2.gz	KTARJDNHKQREGC-UHFFFAOYSA-N	0	0	299.399	4.056	20	30		CIEDRN
CCCOc1ccc(Cl)cc1NC(=O)CC(C)(C)C#N	ZINC000278252789	263046016	/nfs/dbraw/zinc/04/60/16/263046016.db2.gz	MQHIDLQBCVBVEB-UHFFFAOYSA-N	0	0	294.782	4.007	20	30		CIEDRN
C[C@@H](c1ccccc1F)[S@@](=O)CCCCC(C)(C)C#N	ZINC000278365909	263047269	/nfs/dbraw/zinc/04/72/69/263047269.db2.gz	XMQREEUEIMKHJT-RBZFPXEDSA-N	0	0	295.423	4.355	20	30		CIEDRN
CSc1ccc(C)c(N[C@H]2CCC[C@@H](C#N)C2)c1	ZINC000278369483	263047438	/nfs/dbraw/zinc/04/74/38/263047438.db2.gz	CDMTVTWLHKSRJB-OLZOCXBDSA-N	0	0	260.406	4.211	20	30		CIEDRN
N#C[C@@H]1CC[C@@H]([N@@H+]2CCC[C@H]2c2nc3ccccc3s2)C1	ZINC000278562450	263048801	/nfs/dbraw/zinc/04/88/01/263048801.db2.gz	IMJYMKAPOXHYAR-NFAWXSAZSA-N	0	0	297.427	4.125	20	30		CIEDRN
N#C[C@@H]1CC[C@H]([N@@H+]2CCC[C@H]2c2nc3ccccc3s2)C1	ZINC000278562449	263048994	/nfs/dbraw/zinc/04/89/94/263048994.db2.gz	IMJYMKAPOXHYAR-IPYPFGDCSA-N	0	0	297.427	4.125	20	30		CIEDRN
Cc1sc2ncnc(S[C@H]3CC[C@H](C#N)C3)c2c1C	ZINC000278566860	263049019	/nfs/dbraw/zinc/04/90/19/263049019.db2.gz	NEHWRIOVMAIOAH-QWRGUYRKSA-N	0	0	289.429	4.093	20	30		CIEDRN
CC(C)Oc1ccc(NC(=O)CC(C)(C)C#N)cc1Cl	ZINC000278572791	263049042	/nfs/dbraw/zinc/04/90/42/263049042.db2.gz	RCJCAEVCFNPCJR-UHFFFAOYSA-N	0	0	294.782	4.006	20	30		CIEDRN
N#C[C@H]1CC[C@@H](Sc2ccc3ccccc3n2)C1	ZINC000278566805	263049131	/nfs/dbraw/zinc/04/91/31/263049131.db2.gz	NDUSDHPEAUPFQL-WCQYABFASA-N	0	0	254.358	4.019	20	30		CIEDRN
C[C@H](CSCCCSCC#N)c1ccccc1	ZINC000280068530	263058759	/nfs/dbraw/zinc/05/87/59/263058759.db2.gz	ZXFKZVWLXBVZLK-CYBMUJFWSA-N	0	0	265.447	4.170	20	30		CIEDRN
CC(C)[C@H]1CCCCN1C(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000280180504	263059669	/nfs/dbraw/zinc/05/96/69/263059669.db2.gz	PMHIDIKHGMASCK-QGZVFWFLSA-N	0	0	298.430	4.138	20	30		CIEDRN
N#CCC[C@@H](C#N)CSCc1ccc(C(F)(F)F)cc1	ZINC000280226792	263059713	/nfs/dbraw/zinc/05/97/13/263059713.db2.gz	GYCWHQWRLCZTPF-LBPRGKRZSA-N	0	0	298.333	4.382	20	30		CIEDRN
CCC[C@](C)(CC)C(=O)Nc1ccccc1O[C@H](C)C#N	ZINC000280448330	263061635	/nfs/dbraw/zinc/06/16/35/263061635.db2.gz	VXZTVRDWGZUPSI-DYVFJYSZSA-N	0	0	288.391	4.132	20	30		CIEDRN
C[C@H]1CCC[C@H](N(C)C(=O)c2ccc(C(C)(C)C#N)cc2)C1	ZINC000280858254	263064762	/nfs/dbraw/zinc/06/47/62/263064762.db2.gz	LVVPKKNJVIQQBE-YOEHRIQHSA-N	0	0	298.430	4.138	20	30		CIEDRN
Cc1cccc(SCCCC2(C#N)CCOCC2)c1	ZINC000280917500	263065053	/nfs/dbraw/zinc/06/50/53/263065053.db2.gz	GFUBCRPLMPPERZ-UHFFFAOYSA-N	0	0	275.417	4.188	20	30		CIEDRN
Cc1ccc(Cl)cc1NCCCC1(C#N)CCOCC1	ZINC000280994403	263065669	/nfs/dbraw/zinc/06/56/69/263065669.db2.gz	JJEDEJPANKUHMV-UHFFFAOYSA-N	0	0	292.810	4.161	20	30		CIEDRN
CC(C)c1cccc(OCCCC2(C#N)CCOCC2)c1	ZINC000281169677	263067066	/nfs/dbraw/zinc/06/70/66/263067066.db2.gz	AACSLIYOIRPVKL-UHFFFAOYSA-N	0	0	287.403	4.289	20	30		CIEDRN
Cc1ccc(-c2ccnn2C)cc1NCC(C)(C)CCC#N	ZINC000281199259	263067091	/nfs/dbraw/zinc/06/70/91/263067091.db2.gz	IXFNFWRQLREZMT-UHFFFAOYSA-N	0	0	296.418	4.137	20	30		CIEDRN
C[C@@H](C#N)Oc1ccccc1NC1CCC(C(F)F)CC1	ZINC000282514014	263077310	/nfs/dbraw/zinc/07/73/10/263077310.db2.gz	ZEYFEIHVGZRCLN-HIFPTAJRSA-N	0	0	294.345	4.213	20	30		CIEDRN
C[C@H](CCC(=O)NCC1CCC(C#N)CC1)c1ccccc1	ZINC000282546217	263077333	/nfs/dbraw/zinc/07/73/33/263077333.db2.gz	BBVRVCIQUVTBKG-KLAILNCOSA-N	0	0	298.430	4.016	20	30		CIEDRN
CC(C)c1cccc(NC(=O)NCC2CCC(C#N)CC2)c1	ZINC000282632730	263077788	/nfs/dbraw/zinc/07/77/88/263077788.db2.gz	HXSHFZWULJNCEK-UHFFFAOYSA-N	0	0	299.418	4.261	20	30		CIEDRN
CC(C)c1ccccc1OCCCC1(C#N)CCOCC1	ZINC000283895683	263084891	/nfs/dbraw/zinc/08/48/91/263084891.db2.gz	DCPKWODOWJHYEL-UHFFFAOYSA-N	0	0	287.403	4.289	20	30		CIEDRN
C[C@H](C#N)CSc1ccccc1NCCCCF	ZINC000285091741	263089974	/nfs/dbraw/zinc/08/99/74/263089974.db2.gz	IFXLFWQHMQMBOC-GFCCVEGCSA-N	0	0	266.385	4.100	20	30		CIEDRN
CCCOc1ccc(NC(=O)[C@](C)(C#N)CC)cc1Cl	ZINC000285089184	263090047	/nfs/dbraw/zinc/09/00/47/263090047.db2.gz	MZFRFFMSUCFNAZ-HNNXBMFYSA-N	0	0	294.782	4.007	20	30		CIEDRN
CC[C@@H](C)CCC(=O)Nc1ccccc1SCCC#N	ZINC000285534645	263094119	/nfs/dbraw/zinc/09/41/19/263094119.db2.gz	SSKDKLRTNZQWBR-CYBMUJFWSA-N	0	0	290.432	4.457	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)O[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000285607396	263094471	/nfs/dbraw/zinc/09/44/71/263094471.db2.gz	IYSNZGJNAZKYGE-YGRLFVJLSA-N	0	0	299.292	4.249	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)O[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000285607386	263094494	/nfs/dbraw/zinc/09/44/94/263094494.db2.gz	IYSNZGJNAZKYGE-HZMBPMFUSA-N	0	0	299.292	4.249	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)O[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000285607389	263094502	/nfs/dbraw/zinc/09/45/02/263094502.db2.gz	IYSNZGJNAZKYGE-IINYFYTJSA-N	0	0	299.292	4.249	20	30		CIEDRN
CC[C@@](C)(C#N)c1nc(C(C)(C)C2=CCCCC2)no1	ZINC000288968511	263106711	/nfs/dbraw/zinc/10/67/11/263106711.db2.gz	BCOSATCDGWRSBR-INIZCTEOSA-N	0	0	273.380	4.039	20	30		CIEDRN
CC[C@@H](C)Oc1ccc(-c2noc(CC(C)(C)C#N)n2)cc1	ZINC000289163920	263108042	/nfs/dbraw/zinc/10/80/42/263108042.db2.gz	URIYIZQBPXLUMO-GFCCVEGCSA-N	0	0	299.374	4.006	20	30		CIEDRN
CC(C)(C#N)CCSCCCOCc1ccccc1	ZINC000289382282	263109695	/nfs/dbraw/zinc/10/96/95/263109695.db2.gz	KRGCKURTJKHTOU-UHFFFAOYSA-N	0	0	277.433	4.266	20	30		CIEDRN
Cc1ccc([C@H](c2noc(CC(C)(C)C#N)n2)C(C)C)cc1	ZINC000289506823	263110695	/nfs/dbraw/zinc/11/06/95/263110695.db2.gz	ZBJFGYZWUCXASL-MRXNPFEDSA-N	0	0	297.402	4.258	20	30		CIEDRN
C[C@H](SCCC#N)c1cccc(Br)c1	ZINC000291623742	263124301	/nfs/dbraw/zinc/12/43/01/263124301.db2.gz	KUGZSEXPMMGMMK-VIFPVBQESA-N	0	0	270.195	4.157	20	30		CIEDRN
Cc1ccc(-c2ccc(C)c(NC(=O)CCCC#N)c2)o1	ZINC000291849564	263126005	/nfs/dbraw/zinc/12/60/05/263126005.db2.gz	GJVYAGWAEXAJMT-UHFFFAOYSA-N	0	0	282.343	4.196	20	30		CIEDRN
CC(C)(C#N)CCCCN[C@H](c1ccccc1)C(F)F	ZINC000292900402	263136355	/nfs/dbraw/zinc/13/63/55/263136355.db2.gz	ZNRRFTXIQADDMQ-CQSZACIVSA-N	0	0	280.362	4.302	20	30		CIEDRN
C=CC(C)(C)CNC(=O)c1cc(F)c(Cl)cc1Cl	ZINC000452775805	263144849	/nfs/dbraw/zinc/14/48/49/263144849.db2.gz	JDKAOIKHEBAUES-UHFFFAOYSA-N	0	0	290.165	4.075	20	30		CIEDRN
N#C[C@]1(C(=O)Nc2cccc(C(F)F)c2)CC12CCCC2	ZINC000294555024	263163607	/nfs/dbraw/zinc/16/36/07/263163607.db2.gz	MXADNIZPVCEHQA-INIZCTEOSA-N	0	0	290.313	4.037	20	30		CIEDRN
CC(C)Oc1cccc(NCC(C)(C)CCC#N)c1	ZINC000295019035	263170797	/nfs/dbraw/zinc/17/07/97/263170797.db2.gz	NAKCHDPPLBIHLX-UHFFFAOYSA-N	0	0	260.381	4.216	20	30		CIEDRN
Cc1cccc(NC(=O)[C@]2(C#N)CC23CCCC3)c1Cl	ZINC000295232718	263174897	/nfs/dbraw/zinc/17/48/97/263174897.db2.gz	ZLBBKKPULMAMPT-MRXNPFEDSA-N	0	0	288.778	4.061	20	30		CIEDRN
Cc1cc(Cl)c(NC(=O)C2(C#N)CCCCC2)cc1C	ZINC000295772799	263182053	/nfs/dbraw/zinc/18/20/53/263182053.db2.gz	CLMARFZJGIBDSD-UHFFFAOYSA-N	0	0	290.794	4.369	20	30		CIEDRN
N#CC[C@@H]1CC[C@H](NC(=O)Nc2ccc3ccccc3c2)C1	ZINC000296438922	263191649	/nfs/dbraw/zinc/19/16/49/263191649.db2.gz	XGSLMIRFLLWUEV-BBRMVZONSA-N	0	0	293.370	4.044	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cccc(C(F)(F)F)n2)n1	ZINC000453184284	263199812	/nfs/dbraw/zinc/19/98/12/263199812.db2.gz	HFFBCNSWIODRCZ-UHFFFAOYSA-N	0	0	297.280	4.004	20	30		CIEDRN
C=CCCc1noc([C@@H]2C[C@@H]2c2ccccc2Cl)n1	ZINC000453228690	263204753	/nfs/dbraw/zinc/20/47/53/263204753.db2.gz	BEHSFZSWWBBIDH-VXGBXAGGSA-N	0	0	274.751	4.113	20	30		CIEDRN
C[C@@H](C#N)CSc1ccccc1NCC1CC(F)(F)C1	ZINC000297544532	263206364	/nfs/dbraw/zinc/20/63/64/263206364.db2.gz	FGTUYNGRCOMWBY-NSHDSACASA-N	0	0	296.386	4.396	20	30		CIEDRN
C=CCCCCNC(=O)[C@@H](C)c1cc2ccccc2o1	ZINC000471708173	263206790	/nfs/dbraw/zinc/20/67/90/263206790.db2.gz	AKHGWQKRKKVWMF-ZDUSSCGKSA-N	0	0	271.360	4.009	20	30		CIEDRN
CCC1CCN(C(=O)Nc2ccc(C(C)(C)C#N)cc2)CC1	ZINC000298855147	263227008	/nfs/dbraw/zinc/22/70/08/263227008.db2.gz	OIKGEMBATVHPPC-UHFFFAOYSA-N	0	0	299.418	4.142	20	30		CIEDRN
C=CCCCCNC(=O)[C@H](C)CSCc1ccccc1	ZINC000471717231	263260155	/nfs/dbraw/zinc/26/01/55/263260155.db2.gz	YSOGHECRKVOBGG-OAHLLOKOSA-N	0	0	291.460	4.028	20	30		CIEDRN
CC(F)(F)c1cccc(NCc2ccc(F)c(C#N)c2)c1	ZINC000187582076	263262525	/nfs/dbraw/zinc/26/25/25/263262525.db2.gz	AAPCJKIUVSYDPW-UHFFFAOYSA-N	0	0	290.288	4.421	20	30		CIEDRN
N#CCC[C@@H](Nc1nc2ccccc2o1)c1ccccc1	ZINC000164293338	263270917	/nfs/dbraw/zinc/27/09/17/263270917.db2.gz	KUESAIFTQKGEHS-CQSZACIVSA-N	0	0	277.327	4.285	20	30		CIEDRN
C#CCCCCC(=O)N(Cc1ccc([C@H]2C[C@H]2C)o1)C1CC1	ZINC000119589895	263276086	/nfs/dbraw/zinc/27/60/86/263276086.db2.gz	ALWQUHRQSNQTQD-PBHICJAKSA-N	0	0	299.414	4.088	20	30		CIEDRN
C#Cc1cccc(NC(=O)N([C@@H](C)c2ccco2)C2CC2)c1	ZINC000119996239	263280596	/nfs/dbraw/zinc/28/05/96/263280596.db2.gz	KRZSVJUVPPJIFZ-ZDUSSCGKSA-N	0	0	294.354	4.018	20	30		CIEDRN
C#CCCCCC(=O)N(Cc1ccoc1)C1CCCCC1	ZINC000120205367	263283093	/nfs/dbraw/zinc/28/30/93/263283093.db2.gz	PAPKOQKZJFVMIU-UHFFFAOYSA-N	0	0	287.403	4.135	20	30		CIEDRN
CC(C)(C)CN(CCC#N)Cc1nc2ccccc2s1	ZINC000171939149	335085833	/nfs/dbraw/zinc/08/58/33/335085833.db2.gz	FMWLRVPDTKWIET-UHFFFAOYSA-N	0	0	287.432	4.058	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1ccc2nc(C)sc2c1	ZINC000341431083	263337695	/nfs/dbraw/zinc/33/76/95/263337695.db2.gz	JXBZOTMANNXNHD-LLVKDONJSA-N	0	0	289.404	4.081	20	30		CIEDRN
C=CCCS[C@H](C)C(=O)Nc1ccccc1SC	ZINC000341912774	263365631	/nfs/dbraw/zinc/36/56/31/263365631.db2.gz	AEFKWAGPCBRRQJ-LLVKDONJSA-N	0	0	281.446	4.045	20	30		CIEDRN
C=CCCS[C@H](C)c1nccn1-c1ccccc1	ZINC000341924709	263366941	/nfs/dbraw/zinc/36/69/41/263366941.db2.gz	LQTYKSDSGXFOIV-CYBMUJFWSA-N	0	0	258.390	4.243	20	30		CIEDRN
C=CCCN(C)C(=O)c1cc(Cl)cc(C(F)(F)F)c1	ZINC000342025239	263380212	/nfs/dbraw/zinc/38/02/12/263380212.db2.gz	YFQRKIBSUPTTGB-UHFFFAOYSA-N	0	0	291.700	4.007	20	30		CIEDRN
CC[C@H](C)CCC(=O)N(C)c1cc(Cl)ccc1C#N	ZINC000342482294	263440787	/nfs/dbraw/zinc/44/07/87/263440787.db2.gz	RLSBRHHGPGDCRI-NSHDSACASA-N	0	0	278.783	4.001	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@@H]1CCC(C)(C)c2ccccc21	ZINC000342502214	263443468	/nfs/dbraw/zinc/44/34/68/263443468.db2.gz	GLIFATRBAUSDIA-CZUORRHYSA-N	0	0	286.419	4.063	20	30		CIEDRN
CC[C@H](CC1CCCC1)C(=O)N[C@@](C)(C#N)C(C)(C)C	ZINC000415384212	263630779	/nfs/dbraw/zinc/63/07/79/263630779.db2.gz	CKXUWDKYDGXXRT-PBHICJAKSA-N	0	0	278.440	4.037	20	30		CIEDRN
CC(C)c1ccc([C@H](C)CC(=O)NCC2(C#N)CCC2)cc1	ZINC000416348275	263699555	/nfs/dbraw/zinc/69/95/55/263699555.db2.gz	SYFIZOUMCNRKRQ-OAHLLOKOSA-N	0	0	298.430	4.114	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1ccc(C(=O)C(C)C)cc1	ZINC000425308883	263812788	/nfs/dbraw/zinc/81/27/88/263812788.db2.gz	FTDCMAAJPUXDDN-UHFFFAOYSA-N	0	0	273.376	4.066	20	30		CIEDRN
C[C@@H](CCc1ccccc1)Nc1snc(Cl)c1C#N	ZINC000048544112	263818444	/nfs/dbraw/zinc/81/84/44/263818444.db2.gz	AAUMECXETHAREX-JTQLQIEISA-N	0	0	291.807	4.101	20	30		CIEDRN
C[C@H](NC(=O)C[C@H]1CCCCC(=O)N1)c1cccs1	ZINC000328639169	263830990	/nfs/dbraw/zinc/83/09/90/263830990.db2.gz	DOYSZIVKNDUFLP-WDEREUQCSA-N	0	0	280.393	4.055	20	30		CIEDRN
Cc1sc(NC(=O)C(C2CC2)C2CC2)c(C#N)c1C	ZINC000328766611	263858460	/nfs/dbraw/zinc/85/84/60/263858460.db2.gz	AVXHAJQQPHKVEI-UHFFFAOYSA-N	0	0	274.389	4.261	20	30		CIEDRN
CC1(C)c2ccc(C(=O)NC[C@H]3CC=CCC3)cc2NC1=O	ZINC000328801089	263874243	/nfs/dbraw/zinc/87/42/43/263874243.db2.gz	ZBAZCLPZKVJKSV-LBPRGKRZSA-N	0	0	298.386	4.227	20	30		CIEDRN
O=C(CCC(=O)NC1CCCCCC1)NC1CCCC1	ZINC000328857621	263881511	/nfs/dbraw/zinc/88/15/11/263881511.db2.gz	KSDQHARDXFPLQH-UHFFFAOYSA-N	0	0	280.412	4.345	20	30		CIEDRN
N#CC1(C(=O)Nc2scnc2C2CC2)CCCCC1	ZINC000328916569	263901421	/nfs/dbraw/zinc/90/14/21/263901421.db2.gz	KHDQWJPOOQBJNA-UHFFFAOYSA-N	0	0	275.377	4.083	20	30		CIEDRN
CCC[C@H](CC)NC(=O)Nc1ncc(C(F)(F)F)s1	ZINC000330424907	263936732	/nfs/dbraw/zinc/93/67/32/263936732.db2.gz	FVYWVKVBWUSUOV-ZETCQYMHSA-N	0	0	295.330	4.067	20	30		CIEDRN
Cc1cc([C@H](C)NC(=O)c2cc[nH]c2C(C)C)c(C)o1	ZINC000330606017	263972752	/nfs/dbraw/zinc/97/27/52/263972752.db2.gz	ZRGYYLLHGASQNV-NSHDSACASA-N	0	0	274.364	4.414	20	30		CIEDRN
CC[C@@H](C)NC(=O)Nc1cc(C(C)(C)C)nn1C(C)(C)C	ZINC000330632639	264001260	/nfs/dbraw/zinc/00/12/60/264001260.db2.gz	IQBNYCQCTTZSGK-LLVKDONJSA-N	0	0	294.443	4.060	20	30		CIEDRN
NC(=O)C1CCC(NC(=O)c2cccc(C(F)F)c2)CC1	ZINC000330636789	264001698	/nfs/dbraw/zinc/00/16/98/264001698.db2.gz	VIABPKOEPMZZKU-UHFFFAOYSA-N	0	0	296.317	4.023	20	30		CIEDRN
CC(C)(C)c1nc(C(=O)Nc2cc(Cl)ccn2)cs1	ZINC000330748091	264028697	/nfs/dbraw/zinc/02/86/97/264028697.db2.gz	ACNQAHXWVHINHM-UHFFFAOYSA-N	0	0	295.795	4.125	20	30		CIEDRN
CCC1(CNC(=O)N[C@@H](C)c2cccnc2)CCCCC1	ZINC000330873248	264059387	/nfs/dbraw/zinc/05/93/87/264059387.db2.gz	HPSJQAZEJBFPSP-AWEZNQCLSA-N	0	0	289.423	4.007	20	30		CIEDRN
CCc1cc(NC(=O)c2sccc2C(C)C)nc(C)n1	ZINC000330885058	264062712	/nfs/dbraw/zinc/06/27/12/264062712.db2.gz	QEIXQASRAWIZAK-UHFFFAOYSA-N	0	0	289.404	4.169	20	30		CIEDRN
CCC(C)(C)NC(=O)Nc1ccnn1[C@H](C)CC(C)C	ZINC000330887056	264063761	/nfs/dbraw/zinc/06/37/61/264063761.db2.gz	SJHYJBXSCFAKAY-GFCCVEGCSA-N	0	0	280.416	4.005	20	30		CIEDRN
CCC(CC)CC(=O)Nc1sc(C)c(C)c1C#N	ZINC000330960989	264088899	/nfs/dbraw/zinc/08/88/99/264088899.db2.gz	PPSFUWILXRHQGR-UHFFFAOYSA-N	0	0	264.394	4.001	20	30		CIEDRN
Cc1cc([C@H](C)NC(=O)Nc2ccsc2)c(C)o1	ZINC000330935036	264080205	/nfs/dbraw/zinc/08/02/05/264080205.db2.gz	LIKKHVOMXANPGF-VIFPVBQESA-N	0	0	264.350	4.045	20	30		CIEDRN
CCO[C@H](C)c1ncc(C(=O)N[C@H]2CC[C@H](C)CC2)s1	ZINC000330924490	264094807	/nfs/dbraw/zinc/09/48/07/264094807.db2.gz	UNZGGYYTMCFJIA-IJLUTSLNSA-N	0	0	296.436	4.124	20	30		CIEDRN
CC(C)c1occc1C(=O)Nc1cnc(C(C)(C)C)nc1	ZINC000331086698	264118717	/nfs/dbraw/zinc/11/87/17/264118717.db2.gz	PRLLEYRJQRBBHT-UHFFFAOYSA-N	0	0	287.363	4.127	20	30		CIEDRN
CCc1ocnc1C(=O)N[C@H](C)[C@H](C)C1CCCCC1	ZINC000331122304	264131176	/nfs/dbraw/zinc/13/11/76/264131176.db2.gz	XUROKLFCRUGBSD-NWDGAFQWSA-N	0	0	278.396	4.147	20	30		CIEDRN
Cc1nc([C@H](C)NC(=O)c2ccoc2C(C)C)cs1	ZINC000331089818	264133088	/nfs/dbraw/zinc/13/30/88/264133088.db2.gz	URCCCAMQZLFHMA-VIFPVBQESA-N	0	0	278.377	4.234	20	30		CIEDRN
CC(C)c1nc(CN(C)[C@H](C)c2cccc(C#N)c2)cs1	ZINC000425364725	264138504	/nfs/dbraw/zinc/13/85/04/264138504.db2.gz	HHGBUUKSKITNPG-CYBMUJFWSA-N	0	0	299.443	4.331	20	30		CIEDRN
Cc1nc([C@H](C)NC(=O)c2ccc(C(C)C)nc2)cs1	ZINC000331226725	264150767	/nfs/dbraw/zinc/15/07/67/264150767.db2.gz	FNQFYSGYNNZKDJ-JTQLQIEISA-N	0	0	289.404	4.036	20	30		CIEDRN
Cc1cc(C)c(NC(=O)N[C@H](C)CCC(C)C)c(C)n1	ZINC000331232226	264152677	/nfs/dbraw/zinc/15/26/77/264152677.db2.gz	JDPSZHXOBBERQW-GFCCVEGCSA-N	0	0	277.412	4.157	20	30		CIEDRN
Cc1ccc(C(=O)N[C@@](C)(C#N)CC(C)C)c(Cl)c1	ZINC000331181053	264155225	/nfs/dbraw/zinc/15/52/25/264155225.db2.gz	HTNVYEWFOHLSNP-OAHLLOKOSA-N	0	0	278.783	4.281	20	30		CIEDRN
Cc1nc2cc(Cl)c(NC(=O)NC(C)(C)C)cc2s1	ZINC000331221208	264166861	/nfs/dbraw/zinc/16/68/61/264166861.db2.gz	BTZPNHKOILUMPJ-UHFFFAOYSA-N	0	0	297.811	4.192	20	30		CIEDRN
C[C@@H]1CC[C@H](NC(=O)Nc2ccc(C(C)(C)C#N)cc2)C1	ZINC000331282323	264171723	/nfs/dbraw/zinc/17/17/23/264171723.db2.gz	LPLFMXMDJGXRBO-DOMZBBRYSA-N	0	0	285.391	4.002	20	30		CIEDRN
Cc1oc(C#N)cc1C(=O)NCC(C)(C)C1=CCCCC1	ZINC000331237247	264175470	/nfs/dbraw/zinc/17/54/70/264175470.db2.gz	USJNHWDUZGYUSA-UHFFFAOYSA-N	0	0	286.375	4.291	20	30		CIEDRN
CCO[C@H](C)c1ncc(C(=O)N[C@]2(C)CC=CCC2)s1	ZINC000331356053	264207982	/nfs/dbraw/zinc/20/79/82/264207982.db2.gz	RKOCCXGPADOYBU-IAQYHMDHSA-N	0	0	294.420	4.044	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)CCC2CCCC2)s1	ZINC000126758428	264222743	/nfs/dbraw/zinc/22/27/43/264222743.db2.gz	IZKSNNSAKHUAIT-UHFFFAOYSA-N	0	0	276.405	4.091	20	30		CIEDRN
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000424857302	264233866	/nfs/dbraw/zinc/23/38/66/264233866.db2.gz	WSNRWBPAQHCJAP-YPMHNXCESA-N	0	0	290.794	4.171	20	30		CIEDRN
C[C@H](CCC(=O)N[C@@]1(C#N)CCC[C@@H](C)C1)c1ccccc1	ZINC000160318653	264241963	/nfs/dbraw/zinc/24/19/63/264241963.db2.gz	CVDXQWXURLIVNY-MDZRGWNJSA-N	0	0	298.430	4.159	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1nccc2ccccc21	ZINC000128755734	264303498	/nfs/dbraw/zinc/30/34/98/264303498.db2.gz	JWYBVLNWMYMPGV-UHFFFAOYSA-N	0	0	282.387	4.053	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N1CCc2sccc2[C@@H]1CC	ZINC000425437562	264319794	/nfs/dbraw/zinc/31/97/94/264319794.db2.gz	ZXIDJMQYVONKDB-ZDUSSCGKSA-N	0	0	277.433	4.186	20	30		CIEDRN
C[C@@H](Sc1ncc2ccccn21)c1cccc(C#N)c1	ZINC000189805226	264327487	/nfs/dbraw/zinc/32/74/87/264327487.db2.gz	NECKMPRUGJSUNR-GFCCVEGCSA-N	0	0	279.368	4.059	20	30		CIEDRN
C[C@@H](Oc1ccc2c(c1)CCCC2=O)c1cccc(C#N)c1	ZINC000189841388	264334872	/nfs/dbraw/zinc/33/48/72/264334872.db2.gz	YIQSNFCFDVFOTO-CYBMUJFWSA-N	0	0	291.350	4.217	20	30		CIEDRN
C=CCCO[C@H](C)C(=O)Nc1c(C)cccc1C(C)C	ZINC000253608703	264337213	/nfs/dbraw/zinc/33/72/13/264337213.db2.gz	UTGAFGKHJUWHAQ-CQSZACIVSA-N	0	0	275.392	4.038	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)NCc1ccc(OCCC)cc1C	ZINC000475888158	264338752	/nfs/dbraw/zinc/33/87/52/264338752.db2.gz	YPHDFPMAGINJLS-SFHVURJKSA-N	0	0	289.419	4.002	20	30		CIEDRN
CC(C)OC1CCC(Nc2ccc(C#N)c(Cl)c2)CC1	ZINC000130130109	264341845	/nfs/dbraw/zinc/34/18/45/264341845.db2.gz	ZYHGMZYCMQEODX-UHFFFAOYSA-N	0	0	292.810	4.360	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccc(Cl)cc1C	ZINC000077178921	264349680	/nfs/dbraw/zinc/34/96/80/264349680.db2.gz	ZPRPJRCPYSBGKA-UHFFFAOYSA-N	0	0	266.772	4.078	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]1Cc1ccc(C)cc1	ZINC000425489049	264354657	/nfs/dbraw/zinc/35/46/57/264354657.db2.gz	NKLFOQVVTOKSCX-KRWDZBQOSA-N	0	0	285.431	4.131	20	30		CIEDRN
CC(C)(C)C[C@H]1CCCN1C(=O)Nc1ccc(CC#N)cc1	ZINC000130465420	264354763	/nfs/dbraw/zinc/35/47/63/264354763.db2.gz	PINRLQSFLNXFBV-MRXNPFEDSA-N	0	0	299.418	4.185	20	30		CIEDRN
C=C[C@@H](CC(=O)N(C)[C@@H](C)c1ccco1)c1ccccc1	ZINC000131361879	264369944	/nfs/dbraw/zinc/36/99/44/264369944.db2.gz	ZARBSVULEUCTPU-GJZGRUSLSA-N	0	0	283.371	4.159	20	30		CIEDRN
C#CCCCCC(=O)N1CCCCC[C@@H]1c1ccc(C)o1	ZINC000180217560	264397551	/nfs/dbraw/zinc/39/75/51/264397551.db2.gz	FDPPUTBHCOLGNA-MRXNPFEDSA-N	0	0	287.403	4.225	20	30		CIEDRN
C=CCCCC(=O)N1C[C@H](c2ccccc2)[C@H]2CCC[C@H]21	ZINC000286232485	264571528	/nfs/dbraw/zinc/57/15/28/264571528.db2.gz	UEJQYGOFOIIRAS-KZNAEPCWSA-N	0	0	283.415	4.137	20	30		CIEDRN
C=CCCCC(=O)Nc1c(F)cccc1SCC	ZINC000291639133	264843761	/nfs/dbraw/zinc/84/37/61/264843761.db2.gz	KPDVKISJGMQBPC-UHFFFAOYSA-N	0	0	267.369	4.233	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H](C)c1ccccc1OC(F)F	ZINC000293119352	264908778	/nfs/dbraw/zinc/90/87/78/264908778.db2.gz	YAJTWMYSMJBCEG-LLVKDONJSA-N	0	0	297.345	4.068	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)CC2=CCCCC2)s1	ZINC000106629264	264931659	/nfs/dbraw/zinc/93/16/59/264931659.db2.gz	JVEUFMDKFZEPAE-UHFFFAOYSA-N	0	0	274.389	4.011	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1ccccc1C(F)(F)F	ZINC000293833917	264997682	/nfs/dbraw/zinc/99/76/82/264997682.db2.gz	SVOYMZQUUIDTCP-UHFFFAOYSA-N	0	0	285.309	4.038	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(Cc1ccco1)C1CCCC1	ZINC000185231123	265011179	/nfs/dbraw/zinc/01/11/79/265011179.db2.gz	AYNHAAVSAKGNSE-CQSZACIVSA-N	0	0	275.392	4.153	20	30		CIEDRN
C=CC(C)(C)C(=O)N(C)Cc1csc2ccccc12	ZINC000294377643	265013914	/nfs/dbraw/zinc/01/39/14/265013914.db2.gz	HEIJHPZOBMXZKV-UHFFFAOYSA-N	0	0	273.401	4.072	20	30		CIEDRN
C[C@@H](c1ccccc1)N(C)Cc1cn2ccccc2c1C#N	ZINC000343335300	265016755	/nfs/dbraw/zinc/01/67/55/265016755.db2.gz	NHCAXRXDSMWICN-HNNXBMFYSA-N	0	0	289.382	4.004	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](C(F)(F)F)C(C)(C)C1	ZINC000335076393	265088339	/nfs/dbraw/zinc/08/83/39/265088339.db2.gz	LORPFNAOXYRPNX-LLVKDONJSA-N	0	0	291.357	4.026	20	30		CIEDRN
CCCOc1cc(C)ccc1NCc1cc(C#N)cs1	ZINC000093687342	265187740	/nfs/dbraw/zinc/18/77/40/265187740.db2.gz	DIAWOLNFHHIRPZ-UHFFFAOYSA-N	0	0	286.400	4.329	20	30		CIEDRN
Cc1ccc(CN(C)c2ccc(C#N)c(Cl)c2)s1	ZINC000518929925	265223578	/nfs/dbraw/zinc/22/35/78/265223578.db2.gz	UNSNAYUMKIMBFY-UHFFFAOYSA-N	0	0	276.792	4.218	20	30		CIEDRN
N#Cc1ccc(C(F)(F)F)nc1SC1CCCC1	ZINC000094336989	265238233	/nfs/dbraw/zinc/23/82/33/265238233.db2.gz	LYGLZJQOQYUYIG-UHFFFAOYSA-N	0	0	272.295	4.007	20	30		CIEDRN
CC(C)CCc1ccccc1NC(=O)NCCCCC#N	ZINC000519072618	265310395	/nfs/dbraw/zinc/31/03/95/265310395.db2.gz	PCXLFCNWEJQZRR-UHFFFAOYSA-N	0	0	287.407	4.091	20	30		CIEDRN
C=CCN(CC=C)C(=O)[C@@H](c1ccccc1)[C@H](C)CC	ZINC000216543799	265666499	/nfs/dbraw/zinc/66/64/99/265666499.db2.gz	LSQVUQIYQPZCQG-NVXWUHKLSA-N	0	0	271.404	4.017	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1c(F)cccc1Cl	ZINC000514600180	266012726	/nfs/dbraw/zinc/01/27/26/266012726.db2.gz	MTHXIBZXZKAWGI-JTQLQIEISA-N	0	0	284.762	4.345	20	30		CIEDRN
C[C@@H]1CCC[C@H](C)N(C(=O)C[C@@H](CC#N)c2ccccc2)C1	ZINC000356190502	266067322	/nfs/dbraw/zinc/06/73/22/266067322.db2.gz	KSVLOPIAOVROET-SOLBZPMBSA-N	0	0	298.430	4.111	20	30		CIEDRN
C[C@H](CC(C)(C)C)C(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000356374571	266103973	/nfs/dbraw/zinc/10/39/73/266103973.db2.gz	VZHJFFJPQCCSOB-ZBFHGGJFSA-N	0	0	286.419	4.220	20	30		CIEDRN
C[C@@H](CC(C)(C)C)C(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000356374570	266104160	/nfs/dbraw/zinc/10/41/60/266104160.db2.gz	VZHJFFJPQCCSOB-HOCLYGCPSA-N	0	0	286.419	4.220	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cccc(-c3nc(C)co3)c2)CC1	ZINC000356429236	266112384	/nfs/dbraw/zinc/11/23/84/266112384.db2.gz	LNOLPXXWGPQPIM-UHFFFAOYSA-N	0	0	296.370	4.335	20	30		CIEDRN
C[C@H](Sc1ccccc1)c1ccc(NC(=O)CC#N)cc1	ZINC000356935555	266213677	/nfs/dbraw/zinc/21/36/77/266213677.db2.gz	NKPADUHKCLOOMH-ZDUSSCGKSA-N	0	0	296.395	4.392	20	30		CIEDRN
C=CCCCSCc1ccc(-n2ccnc2)cc1	ZINC000357033522	266236980	/nfs/dbraw/zinc/23/69/80/266236980.db2.gz	YYXAOPDUGKCBCZ-UHFFFAOYSA-N	0	0	258.390	4.072	20	30		CIEDRN
Cc1ccc2sc(/C=C\c3nc(C#N)cs3)nc2c1	ZINC000357164976	266258202	/nfs/dbraw/zinc/25/82/02/266258202.db2.gz	BRCBAZWYLZYDLS-PLNGDYQASA-N	0	0	283.381	4.103	20	30		CIEDRN
CC(C)(C)c1ccc(C(=O)N(C2CC2)C2(C#N)CCC2)cc1	ZINC000357378381	266286775	/nfs/dbraw/zinc/28/67/75/266286775.db2.gz	HNLMABRAKQFEHD-UHFFFAOYSA-N	0	0	296.414	4.035	20	30		CIEDRN
CC[C@@H](C)n1ncc(N[C@@H](C)c2ccc(C#N)cc2)c1C	ZINC000357842071	266375799	/nfs/dbraw/zinc/37/57/99/266375799.db2.gz	AEMMJTXOVMJDTQ-OLZOCXBDSA-N	0	0	282.391	4.207	20	30		CIEDRN
CC[C@H](C)n1ncc(N[C@@H](C)c2ccc(C#N)cc2)c1C	ZINC000357842073	266376116	/nfs/dbraw/zinc/37/61/16/266376116.db2.gz	AEMMJTXOVMJDTQ-STQMWFEESA-N	0	0	282.391	4.207	20	30		CIEDRN
Cc1cc(NC(=O)c2sccc2C#N)ccc1C1CC1	ZINC000357967199	266391426	/nfs/dbraw/zinc/39/14/26/266391426.db2.gz	MXQCPVCFPNQKNZ-UHFFFAOYSA-N	0	0	282.368	4.058	20	30		CIEDRN
CSc1ccc(CS[C@@H](C)CCC#N)cc1	ZINC000358538347	266474224	/nfs/dbraw/zinc/47/42/24/266474224.db2.gz	FWSUUVICIIQVQK-NSHDSACASA-N	0	0	251.420	4.334	20	30		CIEDRN
Cc1cc(N[C@@H]2CCC[C@@H](C#N)C2)c2cccnc2c1C	ZINC000193267428	266664551	/nfs/dbraw/zinc/66/45/51/266664551.db2.gz	WQYUQINLNFKIBX-HUUCEWRRSA-N	0	0	279.387	4.346	20	30		CIEDRN
N#Cc1c(Cl)cccc1SCC[C@H]1CCCC1=O	ZINC000360948588	266759231	/nfs/dbraw/zinc/75/92/31/266759231.db2.gz	ARVMEFQVGRAGAF-SNVBAGLBSA-N	0	0	279.792	4.063	20	30		CIEDRN
C=CCCC(=O)N1CCC[C@@H]1c1cccc2ccccc21	ZINC000361503117	266834726	/nfs/dbraw/zinc/83/47/26/266834726.db2.gz	JRWVGXUCAZNUTB-GOSISDBHSA-N	0	0	279.383	4.470	20	30		CIEDRN
C[C@@H](c1ccccc1)N(C(=O)CCCC#N)c1ccccc1	ZINC000361603072	266857886	/nfs/dbraw/zinc/85/78/86/266857886.db2.gz	VHSBLLXPASPISC-INIZCTEOSA-N	0	0	292.382	4.475	20	30		CIEDRN
CCSc1ccc(Cl)cc1NC(=O)CCCC#N	ZINC000361853541	266894902	/nfs/dbraw/zinc/89/49/02/266894902.db2.gz	CIVKRMCENFBTHV-UHFFFAOYSA-N	0	0	282.796	4.084	20	30		CIEDRN
C[C@H]1CC(C)(C)c2ccccc2N1C(=O)CC(C)(C)C#N	ZINC000362725486	267039275	/nfs/dbraw/zinc/03/92/75/267039275.db2.gz	QFMCUYAKCOJRPB-ZDUSSCGKSA-N	0	0	284.403	4.029	20	30		CIEDRN
C=CCCC(=O)N1CCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000363017058	267072456	/nfs/dbraw/zinc/07/24/56/267072456.db2.gz	LBUYPYFWUFYPJB-CQSZACIVSA-N	0	0	297.320	4.335	20	30		CIEDRN
C=CCCC(=O)N1CCc2sccc2[C@@H]1c1ccccc1	ZINC000363018983	267073029	/nfs/dbraw/zinc/07/30/29/267073029.db2.gz	MWMIJGJQAVWCIA-SFHVURJKSA-N	0	0	297.423	4.188	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H](c1ccccn1)C1CCCC1	ZINC000363155437	267077519	/nfs/dbraw/zinc/07/75/19/267077519.db2.gz	NSZDHTJTCJPRSB-GOSISDBHSA-N	0	0	298.430	4.198	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H]1c1ccc(Cl)cc1	ZINC000368434072	267171529	/nfs/dbraw/zinc/17/15/29/267171529.db2.gz	PMBOAKDDQONHJQ-DOMZBBRYSA-N	0	0	277.795	4.216	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1C[C@@H](c2ccsc2)C[C@@H]1C	ZINC000370450912	267319523	/nfs/dbraw/zinc/31/95/23/267319523.db2.gz	XOTDTGBUNWNEJJ-BBRMVZONSA-N	0	0	289.444	4.221	20	30		CIEDRN
CCCCCCCC(=O)N1CCC(c2ccccn2)CC1	ZINC000371322636	267388788	/nfs/dbraw/zinc/38/87/88/267388788.db2.gz	GWJGUOBPSXQGBD-UHFFFAOYSA-N	0	0	288.435	4.148	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cccc(-c2ncc(C)o2)c1	ZINC000373362230	267669975	/nfs/dbraw/zinc/66/99/75/267669975.db2.gz	NJLUQMROWFOCPG-GFCCVEGCSA-N	0	0	284.359	4.191	20	30		CIEDRN
CCCCCCCC(=O)N1CCCC[C@H](CCOC)C1	ZINC000375155017	267835445	/nfs/dbraw/zinc/83/54/45/267835445.db2.gz	WNKZXOUMBOEILH-MRXNPFEDSA-N	0	0	283.456	4.012	20	30		CIEDRN
CO[C@@H](CSCc1ccc(C#N)c(C)c1)c1ccccc1	ZINC000521451449	267891535	/nfs/dbraw/zinc/89/15/35/267891535.db2.gz	PYZCTJHAFVHCJT-SFHVURJKSA-N	0	0	297.423	4.488	20	30		CIEDRN
CCN(CCC#N)[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000123309546	268035272	/nfs/dbraw/zinc/03/52/72/268035272.db2.gz	IZQAGSLVYVNBRU-NSHDSACASA-N	0	0	270.298	4.002	20	30		CIEDRN
C=CCCCNC(=O)N1CC[C@@H](C)C[C@@H]1c1ccc(C)o1	ZINC000448387999	327613694	/nfs/dbraw/zinc/61/36/94/327613694.db2.gz	YJEHGEZTWAUJHG-UKRRQHHQSA-N	0	0	290.407	4.037	20	30		CIEDRN
N#Cc1ccccc1CNc1cccc(C(F)F)c1	ZINC000170642801	327647512	/nfs/dbraw/zinc/64/75/12/327647512.db2.gz	LZWQTNVZJLYDKZ-UHFFFAOYSA-N	0	0	258.271	4.108	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1cc(Cl)c(F)cc1Cl	ZINC000512100355	332954009	/nfs/dbraw/zinc/95/40/09/332954009.db2.gz	STBJAHULOKXOGT-MRVPVSSYSA-N	0	0	290.165	4.217	20	30		CIEDRN
C=C[C@@H](CC(=O)NCCC1=CCCCC1)c1ccccc1	ZINC000533924065	327708657	/nfs/dbraw/zinc/70/86/57/327708657.db2.gz	OYGAUIUHUCCUFZ-KRWDZBQOSA-N	0	0	283.415	4.353	20	30		CIEDRN
C=C[C@H](CC(=O)NCCC1=CCCCC1)c1ccccc1	ZINC000533924066	327708755	/nfs/dbraw/zinc/70/87/55/327708755.db2.gz	OYGAUIUHUCCUFZ-QGZVFWFLSA-N	0	0	283.415	4.353	20	30		CIEDRN
C=C[C@H](CC(=O)N1CC(C)(C)[C@H]2CCC[C@@H]21)c1ccccc1	ZINC000580235623	327746322	/nfs/dbraw/zinc/74/63/22/327746322.db2.gz	AHZSUTHWOYCORO-NJAFHUGGSA-N	0	0	297.442	4.383	20	30		CIEDRN
CC/C=C(\C)C(=O)Nc1ccccc1SC[C@@H](C)C#N	ZINC000170974251	327750150	/nfs/dbraw/zinc/75/01/50/327750150.db2.gz	LDGLGMHIRVIONC-ALFJJAPYSA-N	0	0	288.416	4.233	20	30		CIEDRN
C=C(CC)CSCc1noc(Cc2ccccc2C)n1	ZINC000540193288	327808833	/nfs/dbraw/zinc/80/88/33/327808833.db2.gz	AQYZZTBRYRAXKJ-UHFFFAOYSA-N	0	0	288.416	4.168	20	30		CIEDRN
C[C@@H](CCC#N)SC1=Nc2ccccc2CS1	ZINC000188273589	327862776	/nfs/dbraw/zinc/86/27/76/327862776.db2.gz	RHJCNTTXAMYFCL-JTQLQIEISA-N	0	0	262.403	4.346	20	30		CIEDRN
C[C@H](CCC#N)Sc1ncc(-c2ccc(F)cc2)o1	ZINC000188283978	327863076	/nfs/dbraw/zinc/86/30/76/327863076.db2.gz	OMGFZLWBUGLLSF-SNVBAGLBSA-N	0	0	276.336	4.265	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)C[C@@H](C)c1cccc(F)c1	ZINC000540525452	327889318	/nfs/dbraw/zinc/88/93/18/327889318.db2.gz	NVQJSCYAKPDWKN-KGLIPLIRSA-N	0	0	277.383	4.180	20	30		CIEDRN
COc1cc(F)ccc1N[C@H](C)c1ccc(C#N)c(F)c1	ZINC000540708920	327897355	/nfs/dbraw/zinc/89/73/55/327897355.db2.gz	GIJBUJYQEAOWCO-SNVBAGLBSA-N	0	0	288.297	4.018	20	30		CIEDRN
CCCCOc1ccccc1NCc1cccc(C#N)c1	ZINC000531390162	327902901	/nfs/dbraw/zinc/90/29/01/327902901.db2.gz	AERIDZWKQVGCEB-UHFFFAOYSA-N	0	0	280.371	4.349	20	30		CIEDRN
Cc1ccc(Br)cc1N[C@H]1CCC[C@H](C#N)C1	ZINC000463285968	327915699	/nfs/dbraw/zinc/91/56/99/327915699.db2.gz	ZFRLEKDKLVUOOR-AAEUAGOBSA-N	0	0	293.208	4.252	20	30		CIEDRN
C=C(C)[C@H]1OCC[C@H]1c1nc(C2CCC(CC)CC2)no1	ZINC000583466607	327911686	/nfs/dbraw/zinc/91/16/86/327911686.db2.gz	OKWCBVMUQABLIC-NEXFUWMNSA-N	0	0	290.407	4.202	20	30		CIEDRN
Cc1cccc(CCS[C@H](C)c2ccc(C#N)cc2)n1	ZINC000563146832	327930099	/nfs/dbraw/zinc/93/00/99/327930099.db2.gz	JZOAUHOTMDMVBA-CQSZACIVSA-N	0	0	282.412	4.299	20	30		CIEDRN
C=CCCc1ccccc1NCc1cnc(C)s1	ZINC000336973354	327948561	/nfs/dbraw/zinc/94/85/61/327948561.db2.gz	RVSUWJGMMNDJRB-UHFFFAOYSA-N	0	0	258.390	4.182	20	30		CIEDRN
C=CCN(C)C(=O)N[C@@H](c1ccc(Cl)cc1)[C@@H](C)CC	ZINC000488921291	328004430	/nfs/dbraw/zinc/00/44/30/328004430.db2.gz	RIQXUGPFCBJVAB-SWLSCSKDSA-N	0	0	294.826	4.255	20	30		CIEDRN
CC(C)[C@@H](c1ccccc1Cl)N(C)CC1(C#N)CC1	ZINC000563282997	328008620	/nfs/dbraw/zinc/00/86/20/328008620.db2.gz	VWNFBFUJZUOCJW-HNNXBMFYSA-N	0	0	276.811	4.273	20	30		CIEDRN
C=CCN(C)C(=O)N[C@@H](c1ccc(Cl)cc1)[C@H](C)CC	ZINC000488921290	328004562	/nfs/dbraw/zinc/00/45/62/328004562.db2.gz	RIQXUGPFCBJVAB-IUODEOHRSA-N	0	0	294.826	4.255	20	30		CIEDRN
COc1cccc(CSCc2cc(F)ccc2C#N)c1	ZINC000531581572	328016368	/nfs/dbraw/zinc/01/63/68/328016368.db2.gz	QWOHQGLKQGRYHZ-UHFFFAOYSA-N	0	0	287.359	4.139	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCCC[C@H]1[C@@H](C)CC	ZINC000531559886	328017698	/nfs/dbraw/zinc/01/76/98/328017698.db2.gz	PAAPNZKUUARKTC-HOCLYGCPSA-N	0	0	263.425	4.182	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1cccc(F)c1)c1ccccc1	ZINC000533967762	328029494	/nfs/dbraw/zinc/02/94/94/328029494.db2.gz	SRQSROPLLULHOT-CYBMUJFWSA-N	0	0	269.319	4.124	20	30		CIEDRN
Cc1cc(C#N)ccc1OCc1cccc(Cl)c1	ZINC000110076165	328032999	/nfs/dbraw/zinc/03/29/99/328032999.db2.gz	LNDVZGZRDXWBNO-UHFFFAOYSA-N	0	0	257.720	4.099	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1cc(-c2ccccc2)cnc1C	ZINC000534091290	328034445	/nfs/dbraw/zinc/03/44/45/328034445.db2.gz	DPINDDCCXCFREK-CYBMUJFWSA-N	0	0	295.386	4.143	20	30		CIEDRN
CCC(CC)[C@H](C)C(=O)N[C@@H](C#N)c1ccc(Cl)cc1	ZINC000534168244	328037890	/nfs/dbraw/zinc/03/78/90/328037890.db2.gz	ZKLIQHJCUURNFU-NHYWBVRUSA-N	0	0	292.810	4.093	20	30		CIEDRN
C=CCCC(=O)CSc1ccc2ccccc2c1	ZINC000534244503	328041717	/nfs/dbraw/zinc/04/17/17/328041717.db2.gz	RRMWKQZORHFONF-UHFFFAOYSA-N	0	0	256.370	4.467	20	30		CIEDRN
C=CCCSCc1ccc(Oc2ccccc2)nn1	ZINC000534286636	328043198	/nfs/dbraw/zinc/04/31/98/328043198.db2.gz	YEXZPILNXMZBSM-UHFFFAOYSA-N	0	0	272.373	4.078	20	30		CIEDRN
N#Cc1cc(F)c(NCCC2=CCCCC2)c(F)c1	ZINC000110315900	328044984	/nfs/dbraw/zinc/04/49/84/328044984.db2.gz	FRDRARYNEGRKLQ-UHFFFAOYSA-N	0	0	262.303	4.139	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc(-c2ncco2)cc1C	ZINC000563403248	328062717	/nfs/dbraw/zinc/06/27/17/328062717.db2.gz	XGWRVUOMDYBQNQ-UHFFFAOYSA-N	0	0	284.359	4.191	20	30		CIEDRN
C=CCC(CC=C)C(=O)NCC1CC(c2ccccc2)C1	ZINC000563467108	328067324	/nfs/dbraw/zinc/06/73/24/328067324.db2.gz	VNMGNXNPJGQVLK-UHFFFAOYSA-N	0	0	283.415	4.065	20	30		CIEDRN
CCN(C(=O)CCCC(C)(C)C)c1ccc(C#N)cc1	ZINC000152231985	328082225	/nfs/dbraw/zinc/08/22/25/328082225.db2.gz	IMDBFPDXFZWUML-UHFFFAOYSA-N	0	0	272.392	4.128	20	30		CIEDRN
CN(Cc1cc(-c2ccccc2)cs1)CC(C)(C)C#N	ZINC000571111936	328086535	/nfs/dbraw/zinc/08/65/35/328086535.db2.gz	GAPQUCXXGLANJM-UHFFFAOYSA-N	0	0	284.428	4.397	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@@H]1CC[C@@H](c2ccc(Cl)cc2)C1	ZINC000412582123	328112739	/nfs/dbraw/zinc/11/27/39/328112739.db2.gz	APJGVDGEEQYCFG-UKRRQHHQSA-N	0	0	291.822	4.305	20	30		CIEDRN
CC1(C)CCC[C@H](c2noc(-c3ccc(CC#N)cc3)n2)C1	ZINC000534450893	328114707	/nfs/dbraw/zinc/11/47/07/328114707.db2.gz	WDOWXRDNBVHQFC-HNNXBMFYSA-N	0	0	295.386	4.486	20	30		CIEDRN
C[C@H](CCSc1ccccc1)SCCC#N	ZINC000413013898	328140217	/nfs/dbraw/zinc/14/02/17/328140217.db2.gz	PCGVXUBWHGNWFH-GFCCVEGCSA-N	0	0	251.420	4.204	20	30		CIEDRN
C[C@H](CSCCC#N)c1ccc(C(F)(F)F)cc1	ZINC000413015557	328140297	/nfs/dbraw/zinc/14/02/97/328140297.db2.gz	TWAXIOHEHVFTIF-SNVBAGLBSA-N	0	0	273.323	4.456	20	30		CIEDRN
C[C@@H](c1ccc(CSCCC#N)cc1)C(F)(F)F	ZINC000413015334	328140349	/nfs/dbraw/zinc/14/03/49/328140349.db2.gz	JXAHGNRRYYYAQC-JTQLQIEISA-N	0	0	273.323	4.499	20	30		CIEDRN
N#CCCSCCc1cccc(Cl)c1Cl	ZINC000413016548	328140618	/nfs/dbraw/zinc/14/06/18/328140618.db2.gz	WCQJXDKTAICSGD-UHFFFAOYSA-N	0	0	260.189	4.183	20	30		CIEDRN
C=CCCSCc1nc2c(cccc2F)n1CC	ZINC000571596787	328136721	/nfs/dbraw/zinc/13/67/21/328136721.db2.gz	WWQJISGGPJIKPF-UHFFFAOYSA-N	0	0	264.369	4.005	20	30		CIEDRN
CCC(CC)C(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1	ZINC000161164125	328138219	/nfs/dbraw/zinc/13/82/19/328138219.db2.gz	SFEHFVYQGYUGHS-ZDUSSCGKSA-N	0	0	299.201	4.110	20	30		CIEDRN
Cc1ccc(C)c([C@H]2CCCN2c2ncc(C#N)cc2F)c1	ZINC000413209581	328142551	/nfs/dbraw/zinc/14/25/51/328142551.db2.gz	UUMFYCIWYVHSSZ-QGZVFWFLSA-N	0	0	295.361	4.051	20	30		CIEDRN
Cc1ccc(C)c([S@](=O)CCC2(C#N)CCCCC2)c1	ZINC000414219698	328153406	/nfs/dbraw/zinc/15/34/06/328153406.db2.gz	BDTNBRMBVHCLAJ-HXUWFJFHSA-N	0	0	289.444	4.275	20	30		CIEDRN
CC/C=C(\C)C(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl	ZINC000264552644	328160187	/nfs/dbraw/zinc/16/01/87/328160187.db2.gz	LQPHSVVDSXBWDE-LHXVZLOVSA-N	0	0	297.185	4.031	20	30		CIEDRN
N#CCCCCN[C@H](c1c[nH]c2ccccc12)C(F)(F)F	ZINC000353158136	328166590	/nfs/dbraw/zinc/16/65/90/328166590.db2.gz	XTWHBZJPOVJQMG-CQSZACIVSA-N	0	0	295.308	4.055	20	30		CIEDRN
N#C[C@@H]1CCC[C@H](Nc2cccc(-c3nccs3)c2)C1	ZINC000274206284	328209450	/nfs/dbraw/zinc/20/94/50/328209450.db2.gz	MGFHFVHBGIWIAK-OCCSQVGLSA-N	0	0	283.400	4.304	20	30		CIEDRN
C=CCCCC(=O)N1CCCCC[C@H]1c1ccco1	ZINC000176133740	329173850	/nfs/dbraw/zinc/17/38/50/329173850.db2.gz	KQFOKRFAYTVVPP-AWEZNQCLSA-N	0	0	261.365	4.080	20	30		CIEDRN
C=CCCCC(=O)Nc1ccccc1CCC(F)(F)F	ZINC000177074796	329180698	/nfs/dbraw/zinc/18/06/98/329180698.db2.gz	DKNPTSJECVWDAJ-UHFFFAOYSA-N	0	0	285.309	4.476	20	30		CIEDRN
CC(C)(C)[C@@H]1CN(C(=O)NCCCCC#N)c2ccccc21	ZINC000278111800	328223555	/nfs/dbraw/zinc/22/35/55/328223555.db2.gz	KNDHXXRGNSBGJA-OAHLLOKOSA-N	0	0	299.418	4.040	20	30		CIEDRN
CCN(Cc1ccc2ccccc2c1)C(=O)CC(C)(C)C#N	ZINC000278189216	328224266	/nfs/dbraw/zinc/22/42/66/328224266.db2.gz	DKYRLAQKQCITRV-UHFFFAOYSA-N	0	0	294.398	4.128	20	30		CIEDRN
N#C[C@@H]1CC[C@H](Sc2nc3ccccc3s2)C1	ZINC000278547950	328227217	/nfs/dbraw/zinc/22/72/17/328227217.db2.gz	KZQQDRHDBUEALD-ZJUUUORDSA-N	0	0	260.387	4.081	20	30		CIEDRN
CC(C)Oc1ccc(NC(=O)CC(C)(C)C#N)c(Cl)c1	ZINC000278848584	328231241	/nfs/dbraw/zinc/23/12/41/328231241.db2.gz	SJQGWHFYUILNKM-UHFFFAOYSA-N	0	0	294.782	4.006	20	30		CIEDRN
C[C@H](CC#N)Sc1ccccc1NCCOC1CCC1	ZINC000288648792	328253189	/nfs/dbraw/zinc/25/31/89/328253189.db2.gz	DWCKATYWZCPXHB-CYBMUJFWSA-N	0	0	290.432	4.062	20	30		CIEDRN
C[C@@H](S[C@@H](C)C#N)c1cccc(Br)c1	ZINC000291548501	328264922	/nfs/dbraw/zinc/26/49/22/328264922.db2.gz	AOIBCJMPASVNLB-DTWKUNHWSA-N	0	0	270.195	4.155	20	30		CIEDRN
C=CCN(CCC#N)Cc1csc(C2CCCCC2)n1	ZINC000292307406	328269394	/nfs/dbraw/zinc/26/93/94/328269394.db2.gz	VBYQDRIUKKFWPU-UHFFFAOYSA-N	0	0	289.448	4.092	20	30		CIEDRN
C[C@H](c1ccc(Cl)cc1Cl)N(C)C(=O)CCCC#N	ZINC000292801940	328273660	/nfs/dbraw/zinc/27/36/60/328273660.db2.gz	YPZXCIIONYGOCO-SNVBAGLBSA-N	0	0	299.201	4.207	20	30		CIEDRN
CC/C(C)=C/C(=O)Nc1ccccc1S[C@@H](C)CC#N	ZINC000294717133	328282879	/nfs/dbraw/zinc/28/28/79/328282879.db2.gz	UVYVTYHSTSDCBX-YLSINNKHSA-N	0	0	288.416	4.376	20	30		CIEDRN
COc1ccccc1[C@H](C)S[C@H]1CC[C@@H](C#N)C1	ZINC000295943880	328288189	/nfs/dbraw/zinc/28/81/89/328288189.db2.gz	ICNBTZUAWDHPMB-XQQFMLRXSA-N	0	0	261.390	4.182	20	30		CIEDRN
COc1ccccc1[C@H](C)S[C@@H]1CC[C@@H](C#N)C1	ZINC000295943886	328288267	/nfs/dbraw/zinc/28/82/67/328288267.db2.gz	ICNBTZUAWDHPMB-YNEHKIRRSA-N	0	0	261.390	4.182	20	30		CIEDRN
Cc1ccc(Cl)c(OCc2ccc(C#N)cc2F)c1	ZINC000036984991	328298281	/nfs/dbraw/zinc/29/82/81/328298281.db2.gz	RLTKWTIXZYEQJT-UHFFFAOYSA-N	0	0	275.710	4.238	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(Cc2nccc3ccccc32)no1	ZINC000582148360	328302912	/nfs/dbraw/zinc/30/29/12/328302912.db2.gz	LADMXBHPHZJMSY-GOSISDBHSA-N	0	0	293.370	4.062	20	30		CIEDRN
Cc1ccc(C(=O)Nc2cc(C(C)(C)C)sc2C#N)cc1	ZINC000534520245	328305203	/nfs/dbraw/zinc/30/52/03/328305203.db2.gz	WYXPFKLKOUXUQV-UHFFFAOYSA-N	0	0	298.411	4.478	20	30		CIEDRN
Cc1ccc(C(=O)CSc2ccc(C#N)cc2)cc1C	ZINC000048512036	328309221	/nfs/dbraw/zinc/30/92/21/328309221.db2.gz	CFEZDQCWZJUXRY-UHFFFAOYSA-N	0	0	281.380	4.150	20	30		CIEDRN
C[C@H](Sc1ccc(C#N)cc1)c1cccc([N+](=O)[O-])c1	ZINC000048512032	328309261	/nfs/dbraw/zinc/30/92/61/328309261.db2.gz	OHSYKGVQUBPFHY-NSHDSACASA-N	0	0	284.340	4.320	20	30		CIEDRN
CC(C)C[C@@](C)(C#N)NC(=O)CC[C@H](C)c1ccccc1	ZINC000534597816	328314364	/nfs/dbraw/zinc/31/43/64/328314364.db2.gz	TXMVVQZKKJELMX-YJBOKZPZSA-N	0	0	286.419	4.015	20	30		CIEDRN
CC(C)C[C@@](C)(C#N)NC(=O)CC[C@@H](C)c1ccccc1	ZINC000534597815	328314453	/nfs/dbraw/zinc/31/44/53/328314453.db2.gz	TXMVVQZKKJELMX-QAPCUYQASA-N	0	0	286.419	4.015	20	30		CIEDRN
CC(C)C[C@@](C)(C#N)NC(=O)C[C@@H]1CCCCC1(C)C	ZINC000534595655	328319477	/nfs/dbraw/zinc/31/94/77/328319477.db2.gz	HGBNMUUGCBPTAF-YOEHRIQHSA-N	0	0	278.440	4.037	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1ccc(C)cc1)c1ccccc1	ZINC000534601326	328320412	/nfs/dbraw/zinc/32/04/12/328320412.db2.gz	NTSHYMCBUQSALP-HNNXBMFYSA-N	0	0	265.356	4.293	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@@H](C)CCC(C)C)c1ccccc1	ZINC000534604743	328321381	/nfs/dbraw/zinc/32/13/81/328321381.db2.gz	QKZSGYLAPYWEOU-JKSUJKDBSA-N	0	0	273.420	4.287	20	30		CIEDRN
N#Cc1cc(NC(=O)CCC2CCCC2)ccc1Cl	ZINC000048824376	328324797	/nfs/dbraw/zinc/32/47/97/328324797.db2.gz	ZLPSPGNSFKFLER-UHFFFAOYSA-N	0	0	276.767	4.121	20	30		CIEDRN
CC[C@@H](CNc1ccc(Cl)c(C#N)n1)c1ccccc1	ZINC000111218693	328331190	/nfs/dbraw/zinc/33/11/90/328331190.db2.gz	HCCOLJCORUWEIR-LBPRGKRZSA-N	0	0	285.778	4.212	20	30		CIEDRN
Cc1ccc(N[C@@H](CCC#N)c2ccccc2)c([N+](=O)[O-])c1	ZINC000164327590	328335769	/nfs/dbraw/zinc/33/57/69/328335769.db2.gz	OAMZGJXXBOZOJY-HNNXBMFYSA-N	0	0	295.342	4.360	20	30		CIEDRN
CC(C)c1cccc(NC(=O)c2ccc(CC#N)cc2)c1	ZINC000534648853	328343731	/nfs/dbraw/zinc/34/37/31/328343731.db2.gz	HAVQBFHKYGTTKU-UHFFFAOYSA-N	0	0	278.355	4.128	20	30		CIEDRN
C[C@H](c1ccc(C#N)cc1)N1CCCc2ccccc21	ZINC000303661020	328352532	/nfs/dbraw/zinc/35/25/32/328352532.db2.gz	DGZJRXYQRWDTMI-CQSZACIVSA-N	0	0	262.356	4.072	20	30		CIEDRN
C=CCCC(=O)N[C@H](Cc1ccccc1)c1ccccc1F	ZINC000303829841	328359616	/nfs/dbraw/zinc/35/96/16/328359616.db2.gz	LHSZVYQXFKFFSZ-GOSISDBHSA-N	0	0	297.373	4.192	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CCC[C@@H](CC)CC1)c1ccccc1	ZINC000534690829	328356266	/nfs/dbraw/zinc/35/62/66/328356266.db2.gz	KSHADEVJPHHKGW-SJORKVTESA-N	0	0	285.431	4.385	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)[C@H]1CCC[C@@H](C)C1	ZINC000303805368	328357193	/nfs/dbraw/zinc/35/71/93/328357193.db2.gz	AVOKPNLSOPLRBR-CABCVRRESA-N	0	0	289.394	4.167	20	30		CIEDRN
C=CCCCNc1ccc(C)cc1OCC(F)(F)F	ZINC000303771267	328358276	/nfs/dbraw/zinc/35/82/76/328358276.db2.gz	BRTIBWFFWAWKOM-UHFFFAOYSA-N	0	0	273.298	4.314	20	30		CIEDRN
Cc1ccc(C#N)cc1NCc1ccccc1Cl	ZINC000049488165	328363849	/nfs/dbraw/zinc/36/38/49/328363849.db2.gz	SPPSMSHGCRXNIE-UHFFFAOYSA-N	0	0	256.736	4.132	20	30		CIEDRN
CCC(CC)[C@H](C)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000534912060	328368234	/nfs/dbraw/zinc/36/82/34/328368234.db2.gz	BXDBWOARMYXGNQ-JTQLQIEISA-N	0	0	290.432	4.119	20	30		CIEDRN
C=CCCCNc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000303922852	328369087	/nfs/dbraw/zinc/36/90/87/328369087.db2.gz	WCBCKTJJNVDMNU-UHFFFAOYSA-N	0	0	280.371	4.317	20	30		CIEDRN
CCC(CC)[C@H](C)C(=O)N[C@H](C#N)c1ccccc1Cl	ZINC000534903789	328369505	/nfs/dbraw/zinc/36/95/05/328369505.db2.gz	CARPZMIPJIUXBI-XHDPSFHLSA-N	0	0	292.810	4.093	20	30		CIEDRN
CCC(CC)[C@@H](C)C(=O)N[C@H](C#N)c1ccccc1Cl	ZINC000534903787	328369521	/nfs/dbraw/zinc/36/95/21/328369521.db2.gz	CARPZMIPJIUXBI-IAQYHMDHSA-N	0	0	292.810	4.093	20	30		CIEDRN
CC[C@H](C)Oc1cccc(NCc2ccc(C#N)cc2)c1	ZINC000049593053	328374195	/nfs/dbraw/zinc/37/41/95/328374195.db2.gz	LGHQQARBCOBCLT-AWEZNQCLSA-N	0	0	280.371	4.348	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000111701333	328376403	/nfs/dbraw/zinc/37/64/03/328376403.db2.gz	BTVLJOBSJJHCFT-UHFFFAOYSA-N	0	0	298.308	4.135	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2ccc(Cl)cc2Cl)CC1	ZINC000111701830	328376508	/nfs/dbraw/zinc/37/65/08/328376508.db2.gz	HTMZYSTZTUBYMJ-UHFFFAOYSA-N	0	0	299.201	4.423	20	30		CIEDRN
CCC(CC)C(=O)N[C@H](C#N)c1ccc(C(C)(C)C)cc1	ZINC000049884512	328380974	/nfs/dbraw/zinc/38/09/74/328380974.db2.gz	WOFCIPOMNMCRCO-MRXNPFEDSA-N	0	0	286.419	4.101	20	30		CIEDRN
CC(C)(C)c1ccc([C@@H](C#N)NC(=O)C2CCCCC2)cc1	ZINC000049904283	328381328	/nfs/dbraw/zinc/38/13/28/328381328.db2.gz	MELHGYCXUKMUIX-QGZVFWFLSA-N	0	0	298.430	4.245	20	30		CIEDRN
C[C@H]1C[C@H]1c1ccc(CNc2ccc(C#N)cc2F)o1	ZINC000112012203	328381530	/nfs/dbraw/zinc/38/15/30/328381530.db2.gz	VKMHNFCZUZVXAM-GXFFZTMASA-N	0	0	270.307	4.026	20	30		CIEDRN
C=C(C)CN(CC)C(=O)[C@@H]1CC[C@@H]2CCCC[C@H]2C1	ZINC000535139326	328392066	/nfs/dbraw/zinc/39/20/66/328392066.db2.gz	XHZYESAFUGITQG-HRCADAONSA-N	0	0	263.425	4.018	20	30		CIEDRN
CC1(C)CCC[C@H](C(=O)Nc2ccc(C#N)cc2Cl)C1	ZINC000535210309	328394763	/nfs/dbraw/zinc/39/47/63/328394763.db2.gz	JKYUKYOEFJHVPV-LBPRGKRZSA-N	0	0	290.794	4.367	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)C[C@@H]1C[C@H]1c1ccccc1	ZINC000341678525	328414022	/nfs/dbraw/zinc/41/40/22/328414022.db2.gz	QDBASCRKVIZESL-IRXDYDNUSA-N	0	0	298.430	4.111	20	30		CIEDRN
C=C[C@@H](CC(=O)N(C)c1cccc(C)c1)c1ccccc1	ZINC000535344362	328443542	/nfs/dbraw/zinc/44/35/42/328443542.db2.gz	JIVWLEUKGYVOMI-INIZCTEOSA-N	0	0	279.383	4.318	20	30		CIEDRN
CC(C)(C#N)c1ccccc1CSc1ccc(O)cc1	ZINC000152285353	328438348	/nfs/dbraw/zinc/43/83/48/328438348.db2.gz	PXUPQXCCOYPCCQ-UHFFFAOYSA-N	0	0	283.396	4.486	20	30		CIEDRN
COc1ccc(Cl)cc1CNc1cc(C#N)ccc1C	ZINC000050430030	328439529	/nfs/dbraw/zinc/43/95/29/328439529.db2.gz	IQYGZFNZWKLQGM-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
CC(C)C[C@](C)(C#N)NC(=O)c1ccc(C(C)(C)C)s1	ZINC000535324154	328441486	/nfs/dbraw/zinc/44/14/86/328441486.db2.gz	DRQRWBADNUMKST-MRXNPFEDSA-N	0	0	292.448	4.104	20	30		CIEDRN
CC(C)C[C@@](C)(C#N)NC(=O)C[C@H]1CCCC(C)(C)C1	ZINC000535326728	328441488	/nfs/dbraw/zinc/44/14/88/328441488.db2.gz	ROCNQDOEUULHIW-PBHICJAKSA-N	0	0	278.440	4.037	20	30		CIEDRN
C=C(C)[C@H](Cc1nc([C@@H]2CCCC(C)(C)C2)no1)OCC	ZINC000535354567	328444146	/nfs/dbraw/zinc/44/41/46/328444146.db2.gz	KKYRXJAHZCZGKK-KGLIPLIRSA-N	0	0	292.423	4.277	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCc2cccc(F)c2[C@H]1C	ZINC000532071614	328445524	/nfs/dbraw/zinc/44/55/24/328445524.db2.gz	JZBTVENJLUUDPK-CYBMUJFWSA-N	0	0	287.378	4.040	20	30		CIEDRN
C=CCCC(=O)N1CCC[C@H]1[C@H](CC)c1ccccc1	ZINC000102343226	328450347	/nfs/dbraw/zinc/45/03/47/328450347.db2.gz	OKSXOGHHGHCHFZ-SJORKVTESA-N	0	0	271.404	4.137	20	30		CIEDRN
C[C@@H]1CCCC[C@H]1CNC(=O)Nc1scnc1C1CC1	ZINC000328908291	328459833	/nfs/dbraw/zinc/45/98/33/328459833.db2.gz	CUPNOOBCNYFVAJ-PWSUYJOCSA-N	0	0	293.436	4.173	20	30		CIEDRN
C[C@H]1C[C@H](NC(=O)C[C@@H](CC#N)c2ccccc2)C[C@@H](C)C1	ZINC000331055763	328476787	/nfs/dbraw/zinc/47/67/87/328476787.db2.gz	KRHHTXWOLALSTF-ATLSCFEFSA-N	0	0	298.430	4.015	20	30		CIEDRN
CCN(C(=O)c1cc(C)cc(Cl)c1)c1ccc(C#N)cc1	ZINC000152312176	328481814	/nfs/dbraw/zinc/48/18/14/328481814.db2.gz	YIVBKRIPBQLULM-UHFFFAOYSA-N	0	0	298.773	4.187	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)NC(C)C	ZINC000191440727	328509721	/nfs/dbraw/zinc/50/97/21/328509721.db2.gz	GNDMWNZBWQJUCK-UHFFFAOYSA-N	0	0	260.381	4.068	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)c1coc2c1cccc2C	ZINC000425559688	328537131	/nfs/dbraw/zinc/53/71/31/328537131.db2.gz	HNFRAZNYCLNEPN-UHFFFAOYSA-N	0	0	298.386	4.286	20	30		CIEDRN
C=CCCCN(Cc1cccs1)CC(F)(F)F	ZINC000535575282	328594356	/nfs/dbraw/zinc/59/43/56/328594356.db2.gz	LNKPWVSDQQQKIT-UHFFFAOYSA-N	0	0	263.328	4.079	20	30		CIEDRN
C=CCS[C@@H](C)c1nc(-c2ccc(C)c(F)c2)no1	ZINC000522282989	326797067	/nfs/dbraw/zinc/79/70/67/326797067.db2.gz	MKQQTDHOUXJQHQ-JTQLQIEISA-N	0	0	278.352	4.164	20	30		CIEDRN
C=C(C)[C@H](CC(=O)N1CCCC[C@@H]1CCC(C)C)OCC	ZINC000583948227	326804835	/nfs/dbraw/zinc/80/48/35/326804835.db2.gz	ZYMWOUPRTIHMRH-SJORKVTESA-N	0	0	295.467	4.175	20	30		CIEDRN
CCc1ccc([C@H](C#N)NC(=O)C[C@H](C)CC(C)C)cc1	ZINC000583959449	326814264	/nfs/dbraw/zinc/81/42/64/326814264.db2.gz	CWVPCKHNJRWMEW-PBHICJAKSA-N	0	0	286.419	4.002	20	30		CIEDRN
CCc1ccc([C@H](C#N)NC(=O)C[C@@H](C)CC(C)C)cc1	ZINC000583959452	326814404	/nfs/dbraw/zinc/81/44/04/326814404.db2.gz	CWVPCKHNJRWMEW-YOEHRIQHSA-N	0	0	286.419	4.002	20	30		CIEDRN
C=CCC(F)(F)c1nc(C2(c3ccccc3)CCC2)no1	ZINC000556308634	326817101	/nfs/dbraw/zinc/81/71/01/326817101.db2.gz	QESQGMOUDJWAOS-UHFFFAOYSA-N	0	0	290.313	4.208	20	30		CIEDRN
C=C(CC)CSc1nnc(C(C)C)n1Cc1ccco1	ZINC000538007699	326835139	/nfs/dbraw/zinc/83/51/39/326835139.db2.gz	ABPWTGFBHPTZLZ-UHFFFAOYSA-N	0	0	291.420	4.101	20	30		CIEDRN
C=CCCC1(c2nc(-c3ccc(F)c(F)c3)no2)CC1	ZINC000584020168	326852434	/nfs/dbraw/zinc/85/24/34/326852434.db2.gz	OLUBNEBXODBJTH-UHFFFAOYSA-N	0	0	276.286	4.013	20	30		CIEDRN
C=CCCc1nc(-c2c(Cl)cccc2Cl)no1	ZINC000109486405	326856380	/nfs/dbraw/zinc/85/63/80/326856380.db2.gz	WSNPPKHVVNCMKT-UHFFFAOYSA-N	0	0	269.131	4.162	20	30		CIEDRN
CCOc1cc(C)ccc1N[C@@H](C)c1cccc(C#N)c1	ZINC000037778053	326861638	/nfs/dbraw/zinc/86/16/38/326861638.db2.gz	KHBDZXMZJBKIKM-AWEZNQCLSA-N	0	0	280.371	4.439	20	30		CIEDRN
Cc1ccc([C@H](C)Nc2cccc(OCCCC#N)c2)o1	ZINC000037777415	326861664	/nfs/dbraw/zinc/86/16/64/326861664.db2.gz	BJIWYMHTQGBFSH-AWEZNQCLSA-N	0	0	284.359	4.444	20	30		CIEDRN
N#CCCCOc1cccc(NCc2ccc(F)cc2)c1	ZINC000037777433	326861742	/nfs/dbraw/zinc/86/17/42/326861742.db2.gz	KFNWNXUSODRULE-UHFFFAOYSA-N	0	0	284.334	4.120	20	30		CIEDRN
N#CCCCOc1cccc(NCc2ccc(Cl)o2)c1	ZINC000037777479	326861758	/nfs/dbraw/zinc/86/17/58/326861758.db2.gz	ARXGRFZYACELTC-UHFFFAOYSA-N	0	0	290.750	4.228	20	30		CIEDRN
CCc1c(C)sc(NC(=O)[C@@H]2CC23CCCC3)c1C#N	ZINC000530854519	326893891	/nfs/dbraw/zinc/89/38/91/326893891.db2.gz	ZOJJYFIMKOFRCT-ZDUSSCGKSA-N	0	0	288.416	4.009	20	30		CIEDRN
Cc1ncsc1CCSc1cccc(Cl)c1C#N	ZINC000506370008	332771428	/nfs/dbraw/zinc/77/14/28/332771428.db2.gz	OEXRUIVSGITBPL-UHFFFAOYSA-N	0	0	294.832	4.311	20	30		CIEDRN
N#Cc1cccc(Oc2ccc(Cl)c(C(F)(F)F)c2)n1	ZINC000533685169	326902082	/nfs/dbraw/zinc/90/20/82/326902082.db2.gz	CVNJEOPVEZPEMC-UHFFFAOYSA-N	0	0	298.651	4.418	20	30		CIEDRN
C=CCCC(=O)CSc1cc(Cl)ccc1F	ZINC000506378890	332771630	/nfs/dbraw/zinc/77/16/30/332771630.db2.gz	GLSUQAUHXVXGOL-UHFFFAOYSA-N	0	0	258.745	4.107	20	30		CIEDRN
C=CCN(C(=O)N[C@H](CC(C)C)c1ccccc1)C1CC1	ZINC000538958182	326920233	/nfs/dbraw/zinc/92/02/33/326920233.db2.gz	JAGCVIAKFSBUST-QGZVFWFLSA-N	0	0	286.419	4.134	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(C2(c3ccccc3OC)CC2)no1	ZINC000556367804	326924046	/nfs/dbraw/zinc/92/40/46/326924046.db2.gz	QOSMLHZALQILNM-QGZVFWFLSA-N	0	0	298.386	4.012	20	30		CIEDRN
C=C(C)[C@H](CC(=O)N(c1cccc(C)c1)C(C)C)OCC	ZINC000533762076	326929443	/nfs/dbraw/zinc/92/94/43/326929443.db2.gz	ZDUAYYWCNGREPG-KRWDZBQOSA-N	0	0	289.419	4.108	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@@](C)(CC)C(F)(F)F)c1ccccc1	ZINC000536285593	326934838	/nfs/dbraw/zinc/93/48/38/326934838.db2.gz	LSPZUINKZCQIMV-DOMZBBRYSA-N	0	0	299.336	4.194	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)CC/C=C\c1ccccc1	ZINC000255120355	326945444	/nfs/dbraw/zinc/94/54/44/326945444.db2.gz	KKKZSAZHQVSWCS-UITAMQMPSA-N	0	0	290.366	4.299	20	30		CIEDRN
N#Cc1ccc(/C=C\c2nc3ccccc3s2)s1	ZINC000255316459	326963659	/nfs/dbraw/zinc/96/36/59/326963659.db2.gz	PQGBOYUDKFYERX-FPLPWBNLSA-N	0	0	268.366	4.400	20	30		CIEDRN
C=C(C)CCc1noc([C@H](CC)Cc2ccccc2)n1	ZINC000556805439	326966203	/nfs/dbraw/zinc/96/62/03/326966203.db2.gz	ZGXANHCKRYAAJV-OAHLLOKOSA-N	0	0	270.376	4.315	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)C/C=C\c1ccccc1F	ZINC000255393716	326969714	/nfs/dbraw/zinc/96/97/14/326969714.db2.gz	BDFKFDNUIHPWSP-XQRVVYSFSA-N	0	0	294.329	4.048	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cnn(C(CC)CC)c1CC	ZINC000506649018	332776098	/nfs/dbraw/zinc/77/60/98/332776098.db2.gz	OPZHMLNYIIREJT-UHFFFAOYSA-N	0	0	291.439	4.347	20	30		CIEDRN
CCc1cc(N[C@H](C)c2cccc(C#N)c2)ccc1F	ZINC000506649060	332776334	/nfs/dbraw/zinc/77/63/34/332776334.db2.gz	PKOBSMCEDIWVPS-GFCCVEGCSA-N	0	0	268.335	4.433	20	30		CIEDRN
CC(C)(C#N)CC[S@@](=O)Cc1ccc(C2CCC2)cc1	ZINC000568352865	326994289	/nfs/dbraw/zinc/99/42/89/326994289.db2.gz	FNJZAYMDZWPMSJ-HXUWFJFHSA-N	0	0	289.444	4.143	20	30		CIEDRN
C=CCC1(C(=O)NC[C@H]2CCCCC(F)(F)C2)CCC1	ZINC000557320327	327001522	/nfs/dbraw/zinc/00/15/22/327001522.db2.gz	RRVJXKWLBQULDS-ZDUSSCGKSA-N	0	0	285.378	4.065	20	30		CIEDRN
Cc1cc(C#N)nc(Nc2cccc(-c3cccs3)c2)n1	ZINC000557572278	327013558	/nfs/dbraw/zinc/01/35/58/327013558.db2.gz	OOIUQFFELCYLQV-UHFFFAOYSA-N	0	0	292.367	4.129	20	30		CIEDRN
Cc1nsc(N[C@@H](C)c2c(C)cccc2C)c1C#N	ZINC000557632658	327017568	/nfs/dbraw/zinc/01/75/68/327017568.db2.gz	SVBCLZUIXDJVCO-LBPRGKRZSA-N	0	0	271.389	4.113	20	30		CIEDRN
C[C@@H](Nc1cc(C#N)ccn1)c1ccc2c(c1)CCCC2	ZINC000557633094	327017666	/nfs/dbraw/zinc/01/76/66/327017666.db2.gz	ONUCARRULQVUCP-CYBMUJFWSA-N	0	0	277.371	4.005	20	30		CIEDRN
C=CCC[C@H](Nc1ccc(F)cn1)c1ccccc1	ZINC000557639284	327018388	/nfs/dbraw/zinc/01/83/88/327018388.db2.gz	DZAGJFHWRHYANS-HNNXBMFYSA-N	0	0	256.324	4.340	20	30		CIEDRN
N#Cc1ccnc(N[C@@H]2CCC[C@@H](c3ccccc3)C2)c1	ZINC000557682505	327020601	/nfs/dbraw/zinc/02/06/01/327020601.db2.gz	OKFHQIZHDCSSRZ-IAGOWNOFSA-N	0	0	277.371	4.092	20	30		CIEDRN
COc1ccc(CNc2ccc(C(C)C)cc2)cc1C#N	ZINC000087822316	327022771	/nfs/dbraw/zinc/02/27/71/327022771.db2.gz	GNNIYKPUKRQTDP-UHFFFAOYSA-N	0	0	280.371	4.302	20	30		CIEDRN
COc1ccc(CNc2cc(Cl)ccc2C)cc1C#N	ZINC000087822220	327022887	/nfs/dbraw/zinc/02/28/87/327022887.db2.gz	OEJHWHZBCLHJDP-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
N#Cc1ccc(/C=C\c2ccc3cccc(O)c3n2)s1	ZINC000255889090	327025780	/nfs/dbraw/zinc/02/57/80/327025780.db2.gz	UOEMKFVQPKKFPE-SREVYHEPSA-N	0	0	278.336	4.044	20	30		CIEDRN
Cc1cc(Oc2ncnc3sccc32)c(C)c(C)c1C#N	ZINC000557766054	327025988	/nfs/dbraw/zinc/02/59/88/327025988.db2.gz	WOBJIHYETSOVNJ-UHFFFAOYSA-N	0	0	295.367	4.281	20	30		CIEDRN
C=C(C)CN(CC)C(=O)COc1ccccc1[C@@H](C)CC	ZINC000255932355	327032909	/nfs/dbraw/zinc/03/29/09/327032909.db2.gz	VWDOXVGJRDUPGZ-HNNXBMFYSA-N	0	0	289.419	4.004	20	30		CIEDRN
CC(C)CC1(C(=O)NCC(C)(C)CCC#N)CCCC1	ZINC000557922098	327035433	/nfs/dbraw/zinc/03/54/33/327035433.db2.gz	FDIARVOHSDRAAQ-UHFFFAOYSA-N	0	0	278.440	4.039	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N1Cc2cccc(Cl)c2C1	ZINC000557945965	327036697	/nfs/dbraw/zinc/03/66/97/327036697.db2.gz	CJACZLCPOMWMKX-GFCCVEGCSA-N	0	0	292.810	4.110	20	30		CIEDRN
CC(C)(C)CCCCC(=O)NCC(C)(C)CCC#N	ZINC000557999362	327039745	/nfs/dbraw/zinc/03/97/45/327039745.db2.gz	BZYFSKMKKWNZMW-UHFFFAOYSA-N	0	0	266.429	4.039	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@@H](C(C)(C)C)C[C@H]2C)CCC1	ZINC000576763504	327039962	/nfs/dbraw/zinc/03/99/62/327039962.db2.gz	UMLVGUDIZCBTCJ-HUUCEWRRSA-N	0	0	277.452	4.406	20	30		CIEDRN
C=CCNc1ccccc1COCc1ccccc1	ZINC000558049960	327048719	/nfs/dbraw/zinc/04/87/19/327048719.db2.gz	FLAUPHDFPCNDAG-UHFFFAOYSA-N	0	0	253.345	4.001	20	30		CIEDRN
CCCCN(C(=O)Cc1cccc(C#N)c1)C1CCCCC1	ZINC000558088488	327067623	/nfs/dbraw/zinc/06/76/23/327067623.db2.gz	PQKHDEGNQYMXLU-UHFFFAOYSA-N	0	0	298.430	4.062	20	30		CIEDRN
C[C@@H](C#N)CN(C)[C@@H](C)c1ccc(C(C)(C)C)cc1	ZINC000558087815	327067669	/nfs/dbraw/zinc/06/76/69/327067669.db2.gz	LGJIXPCUCPRYCP-KBPBESRZSA-N	0	0	258.409	4.137	20	30		CIEDRN
C=CCC[C@H](Nc1cnn(CC(C)C)c1C)C1CC1	ZINC000558135398	327075442	/nfs/dbraw/zinc/07/54/42/327075442.db2.gz	PVIPGIPOVFAXIJ-HNNXBMFYSA-N	0	0	261.413	4.004	20	30		CIEDRN
C/C=C\c1ccc(NC(=O)Nc2ccc(CC#N)cc2)cc1	ZINC000558245244	327081117	/nfs/dbraw/zinc/08/11/17/327081117.db2.gz	JZRHDUXNDSHHTC-IHWYPQMZSA-N	0	0	291.354	4.430	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@@H](c3ccc(CC)cc3)C2)CCC1	ZINC000558306050	327086693	/nfs/dbraw/zinc/08/66/93/327086693.db2.gz	XLWFNLMCSCRMGK-GOSISDBHSA-N	0	0	297.442	4.311	20	30		CIEDRN
N#CCSCCCN1CCCCc2c(Cl)cccc21	ZINC000558412959	327092233	/nfs/dbraw/zinc/09/22/33/327092233.db2.gz	VFXDYDXHVQDZBJ-UHFFFAOYSA-N	0	0	294.851	4.130	20	30		CIEDRN
Cc1cc(C(=O)N[C@H](CCCC#N)c2ccccc2)oc1C	ZINC000558457903	327095786	/nfs/dbraw/zinc/09/57/86/327095786.db2.gz	PTNCSZRCNACZMJ-MRXNPFEDSA-N	0	0	296.370	4.061	20	30		CIEDRN
CC[C@](C)(C#N)NC(=O)c1ccc(C(C)(C)C)c(Cl)c1	ZINC000558670255	327113185	/nfs/dbraw/zinc/11/31/85/327113185.db2.gz	ZEAWWXOPOVTPLA-MRXNPFEDSA-N	0	0	292.810	4.060	20	30		CIEDRN
N#Cc1ccc(CSc2c(F)cc(F)cc2F)cc1F	ZINC000558723736	327117518	/nfs/dbraw/zinc/11/75/18/327117518.db2.gz	QIIBSCKNBSBIHI-UHFFFAOYSA-N	0	0	297.276	4.407	20	30		CIEDRN
C=CCn1c(S[C@H]2CC[C@H](C)C2)nnc1-c1ccco1	ZINC000558829671	327123663	/nfs/dbraw/zinc/12/36/63/327123663.db2.gz	ZDAWGRRZGJHEHJ-RYUDHWBXSA-N	0	0	289.404	4.005	20	30		CIEDRN
C=CCCCNc1ccccc1SC[C@H](C)C#N	ZINC000077246008	327131748	/nfs/dbraw/zinc/13/17/48/327131748.db2.gz	QPSPVUKDKUNHJE-CYBMUJFWSA-N	0	0	260.406	4.316	20	30		CIEDRN
Cc1csc(NC(=O)c2cc3cc(C)ccc3o2)c1C#N	ZINC000569349193	327141917	/nfs/dbraw/zinc/14/19/17/327141917.db2.gz	GEZIUODWXKXLPF-UHFFFAOYSA-N	0	0	296.351	4.235	20	30		CIEDRN
Cc1nc(Sc2cccs2)c(Cl)cc1C#N	ZINC000381222677	327155990	/nfs/dbraw/zinc/15/59/90/327155990.db2.gz	HLTWDOVWSVDQQN-UHFFFAOYSA-N	0	0	266.778	4.128	20	30		CIEDRN
CC(=O)c1ccc(C#N)cc1N1CCC[C@H](C(C)C)CC1	ZINC000131301435	327161495	/nfs/dbraw/zinc/16/14/95/327161495.db2.gz	DXXWZEPZLOJOJM-INIZCTEOSA-N	0	0	284.403	4.023	20	30		CIEDRN
C=CCC[C@H](C(=O)N[C@H]1CCC[C@H]1C)c1ccccc1	ZINC000409658816	327163064	/nfs/dbraw/zinc/16/30/64/327163064.db2.gz	ZKAIJGBASZZUSR-PVAVHDDUSA-N	0	0	271.404	4.041	20	30		CIEDRN
CC[C@H](C)C[C@@H](C)NC(=O)Nc1ccc(C#N)cc1Cl	ZINC000426137386	327164245	/nfs/dbraw/zinc/16/42/45/327164245.db2.gz	GTPVXENRDBTNCN-WDEREUQCSA-N	0	0	293.798	4.158	20	30		CIEDRN
C=CCCCCNC(=O)N[C@H](C)c1ccccc1SC	ZINC000409748928	327164467	/nfs/dbraw/zinc/16/44/67/327164467.db2.gz	JUJMJKNHDFKIKC-CYBMUJFWSA-N	0	0	292.448	4.125	20	30		CIEDRN
C=CCCc1ccccc1NCCCC1(C#N)CCOCC1	ZINC000409836229	327165362	/nfs/dbraw/zinc/16/53/62/327165362.db2.gz	NCCYJSHUVICVTD-UHFFFAOYSA-N	0	0	298.430	4.318	20	30		CIEDRN
Cc1cc(F)cc(N[C@@H](C)c2cccc(C#N)c2)c1	ZINC000091510140	327170509	/nfs/dbraw/zinc/17/05/09/327170509.db2.gz	ZGHZZVWYZAZWOU-LBPRGKRZSA-N	0	0	254.308	4.179	20	30		CIEDRN
Cc1nsc(SCc2ccccc2C2CC2)c1C#N	ZINC000569382443	327170866	/nfs/dbraw/zinc/17/08/66/327170866.db2.gz	QAXLUEGHCBZBMN-UHFFFAOYSA-N	0	0	286.425	4.493	20	30		CIEDRN
C=C(C)CCSCc1ccn(-c2ccccc2)n1	ZINC000507090602	332786089	/nfs/dbraw/zinc/78/60/89/332786089.db2.gz	XSMLMEDFPUVGPP-UHFFFAOYSA-N	0	0	258.390	4.072	20	30		CIEDRN
C[C@H]1CCCCCN1C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000408166975	327177028	/nfs/dbraw/zinc/17/70/28/327177028.db2.gz	BLPBWSMUGSHHTJ-NSHDSACASA-N	0	0	291.782	4.008	20	30		CIEDRN
C=C(C)CCSCc1nccn1Cc1ccccc1	ZINC000507097623	332786285	/nfs/dbraw/zinc/78/62/85/332786285.db2.gz	IGZMUBRQWSVDFJ-UHFFFAOYSA-N	0	0	272.417	4.131	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1ccc(-c2ccccc2F)o1	ZINC000410128206	327179776	/nfs/dbraw/zinc/17/97/76/327179776.db2.gz	QUEOJDQCPBVNSJ-GFCCVEGCSA-N	0	0	287.334	4.170	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)C[C@H](CC)c1ccc(OC)cc1	ZINC000410128949	327179884	/nfs/dbraw/zinc/17/98/84/327179884.db2.gz	WGKVFLMZRFIWHB-HOCLYGCPSA-N	0	0	289.419	4.050	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)C[C@H](CC)c1ccc(OC)cc1	ZINC000410128948	327179958	/nfs/dbraw/zinc/17/99/58/327179958.db2.gz	WGKVFLMZRFIWHB-GOEBONIOSA-N	0	0	289.419	4.050	20	30		CIEDRN
C=CCCC1(C(=O)NCC[C@@H](C)c2ccccc2)CC1	ZINC000410210353	327182663	/nfs/dbraw/zinc/18/26/63/327182663.db2.gz	LJMQTOAIIIHXJD-OAHLLOKOSA-N	0	0	271.404	4.043	20	30		CIEDRN
CC(C)=CCC[C@@H](C)CC(=O)Nc1snc(C)c1C#N	ZINC000569487495	327185420	/nfs/dbraw/zinc/18/54/20/327185420.db2.gz	JDLLOFWOMWIAGI-LLVKDONJSA-N	0	0	291.420	4.034	20	30		CIEDRN
CC[C@@H]1c2ccsc2CCN1Cc1cc(C#N)cs1	ZINC000091898209	327186967	/nfs/dbraw/zinc/18/69/67/327186967.db2.gz	ZZCBAVDCAPELKU-CQSZACIVSA-N	0	0	288.441	4.191	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)C1(CCC)CC1	ZINC000410377845	327188988	/nfs/dbraw/zinc/18/89/88/327188988.db2.gz	IKVCPZABXSTXRX-UHFFFAOYSA-N	0	0	257.377	4.324	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1ccc(COC)cc1	ZINC000410379123	327189145	/nfs/dbraw/zinc/18/91/45/327189145.db2.gz	OGRHWHQIXCCGHF-UHFFFAOYSA-N	0	0	295.382	4.204	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1ccc(CC#N)cc1	ZINC000410380507	327189266	/nfs/dbraw/zinc/18/92/66/327189266.db2.gz	GPOSRMLNXROMTN-UHFFFAOYSA-N	0	0	290.366	4.124	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)[C@H]1CC[C@H](C)C1	ZINC000410382220	327189600	/nfs/dbraw/zinc/18/96/00/327189600.db2.gz	LNKQCKUJYYDJQV-ZFWWWQNUSA-N	0	0	257.377	4.180	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1ccc(C#N)cc1C	ZINC000410391861	327189862	/nfs/dbraw/zinc/18/98/62/327189862.db2.gz	IQAKQGHUYFZXML-UHFFFAOYSA-N	0	0	290.366	4.238	20	30		CIEDRN
Cc1nn(-c2ccccc2)cc1NC1CCC(C)(C#N)CC1	ZINC000569544056	327195859	/nfs/dbraw/zinc/19/58/59/327195859.db2.gz	WZJSYZMILNRMJV-UHFFFAOYSA-N	0	0	294.402	4.065	20	30		CIEDRN
CC(C)(CCC#N)CN(Cc1ccccc1)CC(F)F	ZINC000093735817	327199479	/nfs/dbraw/zinc/19/94/79/327199479.db2.gz	IZABIHWKFZZPIY-UHFFFAOYSA-N	0	0	280.362	4.084	20	30		CIEDRN
C[C@H](Nc1cccc(Cl)c1C#N)c1ccc(C#N)cc1	ZINC000047873346	327216327	/nfs/dbraw/zinc/21/63/27/327216327.db2.gz	OPHRBFKNBDPEHM-NSHDSACASA-N	0	0	281.746	4.256	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)c1cc(C)c(CC)s1	ZINC000531041194	327226634	/nfs/dbraw/zinc/22/66/34/327226634.db2.gz	BFRZNJXVEUFGND-UHFFFAOYSA-N	0	0	292.448	4.211	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)CC1CCC(C)CC1	ZINC000531070187	327238890	/nfs/dbraw/zinc/23/88/90/327238890.db2.gz	NIRFFVXZOOTWJL-UHFFFAOYSA-N	0	0	270.376	4.022	20	30		CIEDRN
C=CCCCC(=O)Nc1c(F)cc(Cl)c(C)c1F	ZINC000536441360	327239160	/nfs/dbraw/zinc/23/91/60/327239160.db2.gz	DUPJKZLBZHNHGV-UHFFFAOYSA-N	0	0	273.710	4.221	20	30		CIEDRN
CC(C)[C@H]1CCc2ccccc2N1CCCCC#N	ZINC000536471861	327240675	/nfs/dbraw/zinc/24/06/75/327240675.db2.gz	MCNJDOHAFCYPCP-MRXNPFEDSA-N	0	0	256.393	4.158	20	30		CIEDRN
CC(C)(C#N)CCN1CCc2cc(Cl)cc(Cl)c2C1	ZINC000536472771	327240760	/nfs/dbraw/zinc/24/07/60/327240760.db2.gz	ULUMVXGWNXCJEP-UHFFFAOYSA-N	0	0	297.229	4.291	20	30		CIEDRN
CC[C@H](C)[C@H]1CCCCN1C(=O)Nc1cc(C#N)ccc1C	ZINC000531080830	327240774	/nfs/dbraw/zinc/24/07/74/327240774.db2.gz	KDUWTRKNGRMZEJ-SUMWQHHRSA-N	0	0	299.418	4.299	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1scnc1C1CC1)c1ccccc1	ZINC000536487222	327241293	/nfs/dbraw/zinc/24/12/93/327241293.db2.gz	YKCYXIMZGYGVDC-LBPRGKRZSA-N	0	0	298.411	4.319	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc(C)c(OC(F)F)c1	ZINC000559846826	327264686	/nfs/dbraw/zinc/26/46/86/327264686.db2.gz	ZDILBVGPHFUTQT-UHFFFAOYSA-N	0	0	283.318	4.137	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@@H]1CCC[C@@H](C)C1)c1ccccc1	ZINC000533888770	327266911	/nfs/dbraw/zinc/26/69/11/327266911.db2.gz	IZGTWABEDKQHSW-BFYDXBDKSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1C[C@@H](c2ccccc2C)C[C@@H]1C	ZINC000559926526	327271608	/nfs/dbraw/zinc/27/16/08/327271608.db2.gz	ACWOJSCYYMBRPI-HOTGVXAUSA-N	0	0	285.431	4.302	20	30		CIEDRN
C=CCN(Cc1ccccc1F)Cc1cc(F)ccc1F	ZINC000559945106	327273224	/nfs/dbraw/zinc/27/32/24/327273224.db2.gz	OYZBJRKLCFNANF-UHFFFAOYSA-N	0	0	291.316	4.292	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ccccc2OC2CC2)n1	ZINC000560008398	327276151	/nfs/dbraw/zinc/27/61/51/327276151.db2.gz	MXHUVAFUZFMWEA-UHFFFAOYSA-N	0	0	284.359	4.132	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ccc3ncsc3c2)n1	ZINC000560023648	327278106	/nfs/dbraw/zinc/27/81/06/327278106.db2.gz	GGKHXIVZZSBPKS-UHFFFAOYSA-N	0	0	285.372	4.200	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H]2[C@H](c3ccccc3)[C@@H]2C)n1	ZINC000560024374	327278155	/nfs/dbraw/zinc/27/81/55/327278155.db2.gz	SZDNPDOUWLQENJ-AEGPPILISA-N	0	0	282.387	4.440	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2[nH]c3ccccc3c2OC)n1	ZINC000560029437	327278871	/nfs/dbraw/zinc/27/88/71/327278871.db2.gz	VVTHWFJWMHCZPQ-UHFFFAOYSA-N	0	0	297.358	4.080	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ccccc2Cl)n1	ZINC000560029747	327278995	/nfs/dbraw/zinc/27/89/95/327278995.db2.gz	XYYHQSORMKGART-UHFFFAOYSA-N	0	0	262.740	4.244	20	30		CIEDRN
CO[C@H](CSCc1ccccc1C#N)c1ccccc1	ZINC000560063025	327281980	/nfs/dbraw/zinc/28/19/80/327281980.db2.gz	JZJJWBAHYHGTKP-QGZVFWFLSA-N	0	0	283.396	4.179	20	30		CIEDRN
CCCC[C@@H](CC)CC(=O)N(C1CC1)C1(C#N)CCC1	ZINC000560115876	327284759	/nfs/dbraw/zinc/28/47/59/327284759.db2.gz	CVULYIXYVLAZOB-CQSZACIVSA-N	0	0	276.424	4.030	20	30		CIEDRN
C[C@@H](CC1CCCCC1)C(=O)N(C1CC1)C1(C#N)CCC1	ZINC000560115992	327284822	/nfs/dbraw/zinc/28/48/22/327284822.db2.gz	GYQDWWBQOASZMP-AWEZNQCLSA-N	0	0	288.435	4.030	20	30		CIEDRN
CC#CCCCC(=O)NCCCCc1ccc(Cl)s1	ZINC000560134296	327285694	/nfs/dbraw/zinc/28/56/94/327285694.db2.gz	CAYAGDGDHICWMP-UHFFFAOYSA-N	0	0	297.851	4.034	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CC[C@@H](Cc2ccccc2)[C@@H]1C	ZINC000560135689	327286088	/nfs/dbraw/zinc/28/60/88/327286088.db2.gz	WZFOSXFJKDKFCZ-RDJZCZTQSA-N	0	0	285.431	4.068	20	30		CIEDRN
C=CCCCCSc1nnc(Cc2ccccc2F)o1	ZINC000560232511	327291467	/nfs/dbraw/zinc/29/14/67/327291467.db2.gz	IKSRDKNFYSVCEJ-UHFFFAOYSA-N	0	0	292.379	4.248	20	30		CIEDRN
N#Cc1c(NC[C@@H]2CCCCS2)cccc1C(F)F	ZINC000578083493	327299289	/nfs/dbraw/zinc/29/92/89/327299289.db2.gz	ZYVVEZVRRCJTIP-JTQLQIEISA-N	0	0	282.359	4.193	20	30		CIEDRN
N#Cc1cscc1C(=O)Nc1ccc(C2CCC2)cc1	ZINC000560456906	327309325	/nfs/dbraw/zinc/30/93/25/327309325.db2.gz	VQHAPQXGNIMVJU-UHFFFAOYSA-N	0	0	282.368	4.140	20	30		CIEDRN
C=C(C)[C@@H](NC(=O)C1CC(C)(C)C1)c1ccc(F)c(F)c1	ZINC000560642556	327333496	/nfs/dbraw/zinc/33/34/96/327333496.db2.gz	QTCYVVOBGCBLOB-OAHLLOKOSA-N	0	0	293.357	4.134	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H]1CCCc2ccc(C)cc21	ZINC000560689586	327336759	/nfs/dbraw/zinc/33/67/59/327336759.db2.gz	YJVAIRMOVRERNF-INIZCTEOSA-N	0	0	271.404	4.091	20	30		CIEDRN
C[C@H]1C[C@H]1c1ccc(CNc2ccc(F)cc2C#N)o1	ZINC000097635462	327345360	/nfs/dbraw/zinc/34/53/60/327345360.db2.gz	CWFNPLXRKCUEKL-IINYFYTJSA-N	0	0	270.307	4.026	20	30		CIEDRN
CN(Cc1ccc(C#N)cc1)C(=O)CCCCC(C)(C)C	ZINC000561017197	327359032	/nfs/dbraw/zinc/35/90/32/327359032.db2.gz	TYMRVICWKDJKDI-UHFFFAOYSA-N	0	0	286.419	4.123	20	30		CIEDRN
CC(C)c1ccc2occ(C(=O)N[C@@](C)(C#N)C(C)C)c2c1	ZINC000561098592	327366256	/nfs/dbraw/zinc/36/62/56/327366256.db2.gz	BZLMSWLZVAXEPN-SFHVURJKSA-N	0	0	298.386	4.224	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)c1coc2ccc(C(C)C)cc21	ZINC000561146157	327369807	/nfs/dbraw/zinc/36/98/07/327369807.db2.gz	GQRPSBAANIJBFL-GFCCVEGCSA-N	0	0	271.360	4.251	20	30		CIEDRN
C=CCCCCSCc1csc([C@@H](C)OC)n1	ZINC000561256406	327379933	/nfs/dbraw/zinc/37/99/33/327379933.db2.gz	JEONHHXEWKHZCQ-LLVKDONJSA-N	0	0	271.451	4.440	20	30		CIEDRN
C/C(=C/c1ccccc1)CN(C)c1nccc(C#N)c1Cl	ZINC000561340318	327386886	/nfs/dbraw/zinc/38/68/86/327386886.db2.gz	NNNCBACUXKFEPK-RAXLEYEMSA-N	0	0	297.789	4.146	20	30		CIEDRN
C=CCC(CC=C)C(=O)NC(C)(C)CC(C)(C)C	ZINC000467729662	331423206	/nfs/dbraw/zinc/42/32/06/331423206.db2.gz	HSQZPDDNUJIAIQ-UHFFFAOYSA-N	0	0	251.414	4.086	20	30		CIEDRN
C=CCCCCCN(C)[C@H](C)c1nc(C(C)(C)C)no1	ZINC000150877558	327394182	/nfs/dbraw/zinc/39/41/82/327394182.db2.gz	TZGGPFWQTLEDKF-CYBMUJFWSA-N	0	0	279.428	4.106	20	30		CIEDRN
CC(C)(CC#N)CSc1nc(-c2ccc(F)cc2)c[nH]1	ZINC000566495704	327399401	/nfs/dbraw/zinc/39/94/01/327399401.db2.gz	IKYQUYDNWBMGMH-UHFFFAOYSA-N	0	0	289.379	4.248	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CCCc2ccc(C)cc21	ZINC000561533091	327401180	/nfs/dbraw/zinc/40/11/80/327401180.db2.gz	DSQWOMBONOPDKN-WMLDXEAASA-N	0	0	271.404	4.091	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H]1CCCc2ccc(C)cc21	ZINC000561536163	327401465	/nfs/dbraw/zinc/40/14/65/327401465.db2.gz	YJVAIRMOVRERNF-MRXNPFEDSA-N	0	0	271.404	4.091	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)Nc1cccc(-c2ccccc2)c1	ZINC000561667839	327408761	/nfs/dbraw/zinc/40/87/61/327408761.db2.gz	MLSCQAFZGQTWPK-SFHVURJKSA-N	0	0	278.355	4.232	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H](C)[C@H](C)c1ccccc1	ZINC000151177837	327451597	/nfs/dbraw/zinc/45/15/97/327451597.db2.gz	DNXPMVXSFXJGPP-GJZGRUSLSA-N	0	0	271.404	4.063	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)c1ccccc1SC	ZINC000151424830	327469847	/nfs/dbraw/zinc/46/98/47/327469847.db2.gz	MENGBZJIOGVIKJ-UHFFFAOYSA-N	0	0	275.417	4.140	20	30		CIEDRN
Cc1c2cc(C#N)ccc2sc1C(=O)Nc1ccccc1	ZINC000428003468	327478182	/nfs/dbraw/zinc/47/81/82/327478182.db2.gz	BVXGFJKLBBCMOV-UHFFFAOYSA-N	0	0	292.363	4.334	20	30		CIEDRN
C=C[C@H](CC(=O)N1C[C@H](C)[C@@H]2CCCC[C@@H]21)c1ccccc1	ZINC000248418516	327478337	/nfs/dbraw/zinc/47/83/37/327478337.db2.gz	KJXTYVOYKCHCPS-NBMJBFSESA-N	0	0	297.442	4.383	20	30		CIEDRN
C[C@@H](Sc1cccc(F)c1C#N)c1cccc(C#N)c1	ZINC000562440028	327481267	/nfs/dbraw/zinc/48/12/67/327481267.db2.gz	MMXGGYQIBDPZAP-LLVKDONJSA-N	0	0	282.343	4.422	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H](c1ccco1)c1ccccc1	ZINC000159163619	327488890	/nfs/dbraw/zinc/48/88/90/327488890.db2.gz	FLXDKAFXJDVPIK-SFHVURJKSA-N	0	0	295.382	4.254	20	30		CIEDRN
Cc1nc(N(C)[C@H](C)c2cccc(Cl)c2)ccc1C#N	ZINC000380293507	327508985	/nfs/dbraw/zinc/50/89/85/327508985.db2.gz	RLBPSUAOWJHSLV-GFCCVEGCSA-N	0	0	285.778	4.113	20	30		CIEDRN
CCCC[C@H](CC)C(=O)Nc1cc(C#N)ccc1NCC	ZINC000562856709	327520313	/nfs/dbraw/zinc/52/03/13/327520313.db2.gz	HSJWXUAQISWRIT-AWEZNQCLSA-N	0	0	287.407	4.145	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc([C@@H](C)c2ccccc2C)no1	ZINC000584317152	327540976	/nfs/dbraw/zinc/54/09/76/327540976.db2.gz	AMHMJCPZPJKVCS-GUYCJALGSA-N	0	0	270.376	4.384	20	30		CIEDRN
C=CCCCCS[C@H](C)C(=O)Nc1c(F)cccc1F	ZINC000569948924	327557830	/nfs/dbraw/zinc/55/78/30/327557830.db2.gz	QQMXOARUCIEOMU-LLVKDONJSA-N	0	0	299.386	4.381	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(Cc2c[nH]c3cc(F)ccc23)no1	ZINC000569963897	327558194	/nfs/dbraw/zinc/55/81/94/327558194.db2.gz	NCNJZBGEMIYYTQ-LLVKDONJSA-N	0	0	299.349	4.351	20	30		CIEDRN
CN(C(=O)C[C@H]1CCCCC1(C)C)c1ccc(C#N)cc1	ZINC000507518631	332811579	/nfs/dbraw/zinc/81/15/79/332811579.db2.gz	SBCBDLGFHPZPNL-OAHLLOKOSA-N	0	0	284.403	4.128	20	30		CIEDRN
CN(C(=O)C[C@@H]1CCCCC1(C)C)c1ccc(C#N)cc1	ZINC000507518628	332811710	/nfs/dbraw/zinc/81/17/10/332811710.db2.gz	SBCBDLGFHPZPNL-HNNXBMFYSA-N	0	0	284.403	4.128	20	30		CIEDRN
C[C@H]1CC(C(=O)N[C@@](C)(C#N)C2CCCCC2)C[C@H](C)C1	ZINC000583583392	328621456	/nfs/dbraw/zinc/62/14/56/328621456.db2.gz	QMZIOGQRTLYSBV-LBTNJELSSA-N	0	0	290.451	4.037	20	30		CIEDRN
CC[C@@H](C)Oc1cccc(NC(=O)C(C#N)(CC)CC)c1	ZINC000051781356	328632279	/nfs/dbraw/zinc/63/22/79/328632279.db2.gz	NYZMTIFHILFQGD-CYBMUJFWSA-N	0	0	288.391	4.132	20	30		CIEDRN
CCCN(CC#N)Cc1ccc(-c2ccc(Cl)cc2)o1	ZINC000535796687	328635307	/nfs/dbraw/zinc/63/53/07/328635307.db2.gz	UDAWIFFMGMZMTK-UHFFFAOYSA-N	0	0	288.778	4.336	20	30		CIEDRN
N#Cc1ccsc1C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000052027822	328639232	/nfs/dbraw/zinc/63/92/32/328639232.db2.gz	IHSVMUMFBNBJOF-UHFFFAOYSA-N	0	0	297.166	4.179	20	30		CIEDRN
C=C[C@H](CC(=O)N(CC)C[C@@H](C)CC)c1ccccc1	ZINC000536171275	328660642	/nfs/dbraw/zinc/66/06/42/328660642.db2.gz	ZNTXUGNDGJMCCF-JKSUJKDBSA-N	0	0	273.420	4.241	20	30		CIEDRN
N#Cc1cccc(OCCCOc2ccccc2Cl)c1	ZINC000034674976	328685460	/nfs/dbraw/zinc/68/54/60/328685460.db2.gz	ZPTBXYIHSKIUJK-UHFFFAOYSA-N	0	0	287.746	4.060	20	30		CIEDRN
CC[C@@H](CC#N)NCc1cccc(Oc2ccccc2)c1	ZINC000054182213	328690017	/nfs/dbraw/zinc/69/00/17/328690017.db2.gz	OKENUPDUWYNTSL-INIZCTEOSA-N	0	0	280.371	4.261	20	30		CIEDRN
CCC[C@H](CC1CCCC1)C(=O)Nc1cc(CC#N)ccn1	ZINC000532179827	328702379	/nfs/dbraw/zinc/70/23/79/328702379.db2.gz	HTAIPFHPLBJUBV-MRXNPFEDSA-N	0	0	299.418	4.083	20	30		CIEDRN
C=CCCS[C@@H](C)C(=O)N1c2ccccc2CC[C@@H]1C	ZINC000532261810	328711741	/nfs/dbraw/zinc/71/17/41/328711741.db2.gz	LTYMVNKJYSAZRI-KBPBESRZSA-N	0	0	289.444	4.052	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)c1ccc2sccc2c1	ZINC000395319191	328735915	/nfs/dbraw/zinc/73/59/15/328735915.db2.gz	KOJSZBQYOXPWDW-UHFFFAOYSA-N	0	0	292.363	4.334	20	30		CIEDRN
CCCCCN(C(=O)c1cc(C#N)ccc1Cl)C(C)C	ZINC000507771283	332822741	/nfs/dbraw/zinc/82/27/41/332822741.db2.gz	OHUXQTOAOCSTKY-UHFFFAOYSA-N	0	0	292.810	4.252	20	30		CIEDRN
CC(C)CCN(CCC#N)C(=O)c1ccc(C(C)C)cc1	ZINC000103440620	328768856	/nfs/dbraw/zinc/76/88/56/328768856.db2.gz	JVQRMAXZPWFGQN-UHFFFAOYSA-N	0	0	286.419	4.212	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)c2cc(C)c(C)o2)c1	ZINC000532618121	328791490	/nfs/dbraw/zinc/79/14/90/328791490.db2.gz	CQDZSDDVMFOEQG-UHFFFAOYSA-N	0	0	285.343	4.104	20	30		CIEDRN
CO[C@@H](CNc1ccc(C#N)cc1Cl)c1ccccc1	ZINC000379214516	328795559	/nfs/dbraw/zinc/79/55/59/328795559.db2.gz	OCANEKQRQWBCAI-INIZCTEOSA-N	0	0	286.762	4.011	20	30		CIEDRN
C=C(C)COc1cccc(NCc2ccc3c(c2)CCO3)c1	ZINC000532725379	328807374	/nfs/dbraw/zinc/80/73/74/328807374.db2.gz	LEDOGPKZYCANLE-UHFFFAOYSA-N	0	0	295.382	4.189	20	30		CIEDRN
CC[C@@H](CC#N)NC(=O)C1(C2CCCCC2)CCCCC1	ZINC000526958487	328816805	/nfs/dbraw/zinc/81/68/05/328816805.db2.gz	IYUFRRJPFGJLSU-INIZCTEOSA-N	0	0	290.451	4.326	20	30		CIEDRN
C=C(C)CCS[C@H](C)C(=O)Nc1cc(C)ccc1OC	ZINC000507801531	332824615	/nfs/dbraw/zinc/82/46/15/332824615.db2.gz	MGOBPTQXAKTMLD-CYBMUJFWSA-N	0	0	293.432	4.030	20	30		CIEDRN
C=C(C)COc1cccc(NCc2ccsc2)c1	ZINC000532887092	328846557	/nfs/dbraw/zinc/84/65/57/328846557.db2.gz	NICPGZKJCYAFBA-UHFFFAOYSA-N	0	0	259.374	4.315	20	30		CIEDRN
N#CCN(Cc1ccc(Oc2ccccc2)o1)C1CCCC1	ZINC000507808990	332825239	/nfs/dbraw/zinc/82/52/39/332825239.db2.gz	CMYVVMCQQVWCMM-UHFFFAOYSA-N	0	0	296.370	4.340	20	30		CIEDRN
C=C(C)CCS[C@H](C)C(=O)Nc1cccc(C)c1C	ZINC000507819663	332826226	/nfs/dbraw/zinc/82/62/26/332826226.db2.gz	RWNHGPDVDBFDGE-CQSZACIVSA-N	0	0	277.433	4.330	20	30		CIEDRN
N#Cc1cccc(CSCc2ncc(Cl)s2)c1	ZINC000358666779	328890412	/nfs/dbraw/zinc/89/04/12/328890412.db2.gz	YVJCKCCLGFWZLG-UHFFFAOYSA-N	0	0	280.805	4.102	20	30		CIEDRN
C=CCCC(=O)N1CCC(c2c[nH]c3cc(C)ccc32)CC1	ZINC000368956194	328941253	/nfs/dbraw/zinc/94/12/53/328941253.db2.gz	JJSRCOZLXPFXTD-UHFFFAOYSA-N	0	0	296.414	4.149	20	30		CIEDRN
CN(C(=O)[C@@H]1CC[C@H]2CCCC[C@@H]2C1)c1ccccc1C#N	ZINC000389566718	328945169	/nfs/dbraw/zinc/94/51/69/328945169.db2.gz	ZGGZZERCCBTAIN-BZUAXINKSA-N	0	0	296.414	4.128	20	30		CIEDRN
N#Cc1ccc(NC2CCC(F)(F)CC2)cc1Cl	ZINC000390013827	328965014	/nfs/dbraw/zinc/96/50/14/328965014.db2.gz	PDHBETDYCFSLFO-UHFFFAOYSA-N	0	0	270.710	4.201	20	30		CIEDRN
C=C(C)CCSCC(=O)N1CCC[C@H]1c1ccsc1	ZINC000375641039	329004865	/nfs/dbraw/zinc/00/48/65/329004865.db2.gz	LWOBUEBWEGQWDJ-AWEZNQCLSA-N	0	0	295.473	4.111	20	30		CIEDRN
CCC[C@@H](C)CC(=O)N1CC=C(c2ccc(C#N)cc2)CC1	ZINC000377282289	329009695	/nfs/dbraw/zinc/00/96/95/329009695.db2.gz	CVRPETOTOLRJNX-OAHLLOKOSA-N	0	0	296.414	4.000	20	30		CIEDRN
Cc1ccc(C[C@@H](C#N)Sc2ccccc2F)cc1	ZINC000508274058	332836297	/nfs/dbraw/zinc/83/62/97/332836297.db2.gz	BMCGGRVMQJLOPZ-AWEZNQCLSA-N	0	0	271.360	4.361	20	30		CIEDRN
CC(C)c1ccc([C@@H]2CCCN2C(=O)CC(C)(C)C#N)cc1	ZINC000377572145	329019344	/nfs/dbraw/zinc/01/93/44/329019344.db2.gz	GVDIPYHEHYOPHW-KRWDZBQOSA-N	0	0	298.430	4.413	20	30		CIEDRN
Cc1ccc(CNc2ccc(CC#N)cc2)cc1Cl	ZINC000193732180	329061565	/nfs/dbraw/zinc/06/15/65/329061565.db2.gz	LPAIXWXKVRPUIN-UHFFFAOYSA-N	0	0	270.763	4.327	20	30		CIEDRN
CCCCCCCC(=O)N1CCC[C@@H](c2nccs2)C1	ZINC000170891825	329069449	/nfs/dbraw/zinc/06/94/49/329069449.db2.gz	GBWHCBISHWSAAW-CQSZACIVSA-N	0	0	294.464	4.210	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@@H]1CCC(C)(C)C1)c1ccccc1	ZINC000508491112	332839585	/nfs/dbraw/zinc/83/95/85/332839585.db2.gz	UHOMJCFEMHOXGF-GDBMZVCRSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)C2CC3(CCC3)C2)CCCC1(C)C	ZINC000582547436	329105471	/nfs/dbraw/zinc/10/54/71/329105471.db2.gz	FNYCDMKWIUENIO-HNNXBMFYSA-N	0	0	275.436	4.160	20	30		CIEDRN
C=C(C)CCc1noc(CC/C=C\c2ccccc2)n1	ZINC000508594533	332842791	/nfs/dbraw/zinc/84/27/91/332842791.db2.gz	JYROIONLWRKFEK-POHAHGRESA-N	0	0	268.360	4.224	20	30		CIEDRN
C=CCN(Cc1sc(C)nc1C)Cc1ccccc1F	ZINC000172759603	329138432	/nfs/dbraw/zinc/13/84/32/329138432.db2.gz	ORVQOSQOONYRPH-UHFFFAOYSA-N	0	0	290.407	4.087	20	30		CIEDRN
N#CCc1ccccc1NC(=O)[C@@H]1CCC[C@@H]2CCCC[C@H]12	ZINC000582748369	329142421	/nfs/dbraw/zinc/14/24/21/329142421.db2.gz	BGIHVKYBGUEMCI-BHYGNILZSA-N	0	0	296.414	4.298	20	30		CIEDRN
N#CCc1ccccc1NC(=O)[C@@H]1CCC[C@H]2CCCC[C@@H]21	ZINC000582748373	329142424	/nfs/dbraw/zinc/14/24/24/329142424.db2.gz	BGIHVKYBGUEMCI-HYVNUMGLSA-N	0	0	296.414	4.298	20	30		CIEDRN
C=C(C)CCc1noc(-c2cc(Cl)ccc2NCC)n1	ZINC000582751970	329143567	/nfs/dbraw/zinc/14/35/67/329143567.db2.gz	DOPIVTNTELPPMR-UHFFFAOYSA-N	0	0	291.782	4.331	20	30		CIEDRN
C=CCCCC(=O)Nc1cc(-c2ccncc2)ccc1C	ZINC000175517482	329169402	/nfs/dbraw/zinc/16/94/02/329169402.db2.gz	MOHKTNVVDMJSKT-UHFFFAOYSA-N	0	0	280.371	4.352	20	30		CIEDRN
C=CCCCC(=O)N1CCc2cc(Cl)cc(Cl)c2C1	ZINC000177679216	329188000	/nfs/dbraw/zinc/18/80/00/329188000.db2.gz	KLIWLZUCVHVMCG-UHFFFAOYSA-N	0	0	298.213	4.234	20	30		CIEDRN
CC(C)OCc1cccc(NCc2cc(C#N)cs2)c1	ZINC000177690756	329189236	/nfs/dbraw/zinc/18/92/36/329189236.db2.gz	XEGYNEIHDDFQTF-UHFFFAOYSA-N	0	0	286.400	4.157	20	30		CIEDRN
CC(C)(C)CCc1noc(/C=C/c2ccccc2C#N)n1	ZINC000508650099	332846153	/nfs/dbraw/zinc/84/61/53/332846153.db2.gz	IWUGFJCVXWTPCY-CMDGGOBGSA-N	0	0	281.359	4.090	20	30		CIEDRN
C#CCCCCC(=O)N[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000179731487	329207773	/nfs/dbraw/zinc/20/77/73/329207773.db2.gz	ZFLWMZAGVUQHQV-LBPRGKRZSA-N	0	0	297.320	4.076	20	30		CIEDRN
C#CCCCCC(=O)N1CCC[C@@H]1c1cccc(Cl)c1	ZINC000179778345	329212119	/nfs/dbraw/zinc/21/21/19/329212119.db2.gz	MSLMFXKOUVFIBZ-MRXNPFEDSA-N	0	0	289.806	4.197	20	30		CIEDRN
C=C(C)CCc1noc(COc2c(C)cc(C)cc2C)n1	ZINC000508668533	332846886	/nfs/dbraw/zinc/84/68/86/332846886.db2.gz	YVKFAZCJAOAINK-UHFFFAOYSA-N	0	0	286.375	4.083	20	30		CIEDRN
N#CCCN(CCC#N)Cc1ccc(-c2ccccc2)s1	ZINC000180042193	329214873	/nfs/dbraw/zinc/21/48/73/329214873.db2.gz	BBDOKJAGMBBNDH-UHFFFAOYSA-N	0	0	295.411	4.044	20	30		CIEDRN
CCC(CC)CN(CCC#N)C(=O)c1csc(C)c1C	ZINC000180056614	329215082	/nfs/dbraw/zinc/21/50/82/329215082.db2.gz	SAECGBZMYMJTKU-UHFFFAOYSA-N	0	0	292.448	4.157	20	30		CIEDRN
C=C(C)CCc1noc(C2(c3ccc(OC)cc3)CCC2)n1	ZINC000508679638	332847125	/nfs/dbraw/zinc/84/71/25/332847125.db2.gz	MZNKSSJAEPROAA-UHFFFAOYSA-N	0	0	298.386	4.057	20	30		CIEDRN
C=C(C)CCc1noc(C(C)(C)c2ccc(C)cc2)n1	ZINC000508687241	332847597	/nfs/dbraw/zinc/84/75/97/332847597.db2.gz	RNOQXHZZHCRRBD-UHFFFAOYSA-N	0	0	270.376	4.213	20	30		CIEDRN
CCCC[C@@H](CC)CN(CCC#N)Cc1ccccn1	ZINC000183630170	329251629	/nfs/dbraw/zinc/25/16/29/329251629.db2.gz	QCAQTUBODVVELW-MRXNPFEDSA-N	0	0	273.424	4.014	20	30		CIEDRN
CC#CCCCC(=O)N1CCC[C@@H]1c1cccc(Cl)c1	ZINC000185213593	329268915	/nfs/dbraw/zinc/26/89/15/329268915.db2.gz	MJMQEUKWOFTYRA-MRXNPFEDSA-N	0	0	289.806	4.197	20	30		CIEDRN
N#Cc1ccc(CSCc2ccccc2C2CC2)nc1	ZINC000582915985	329288375	/nfs/dbraw/zinc/28/83/75/329288375.db2.gz	URMUGGAORJIOLJ-UHFFFAOYSA-N	0	0	280.396	4.264	20	30		CIEDRN
N#Cc1ccc(C(F)(F)F)nc1N[C@H]1CC12CCCCC2	ZINC000395654299	329293994	/nfs/dbraw/zinc/29/39/94/329293994.db2.gz	UPJNGHCEFNSXSE-LBPRGKRZSA-N	0	0	295.308	4.107	20	30		CIEDRN
Cc1ccccc1[C@H]1C[C@H](C)N(c2cccc(F)c2C#N)C1	ZINC000582992147	329294463	/nfs/dbraw/zinc/29/44/63/329294463.db2.gz	WMILTQWPKHUIRD-GJZGRUSLSA-N	0	0	294.373	4.388	20	30		CIEDRN
CC#CCCCC(=O)N1CCCC[C@H]1c1ccc(C)cc1	ZINC000185658710	329328648	/nfs/dbraw/zinc/32/86/48/329328648.db2.gz	GINUIXPFIRMIAS-SFHVURJKSA-N	0	0	283.415	4.242	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CC=C(c2ccccc2F)CC1	ZINC000186130380	329338314	/nfs/dbraw/zinc/33/83/14/329338314.db2.gz	FPGBZSGIQIIPEZ-CQSZACIVSA-N	0	0	287.378	4.044	20	30		CIEDRN
Cc1cn(Cc2cc(-c3ccc(Cl)cc3)no2)cc1C#N	ZINC000532906568	329345586	/nfs/dbraw/zinc/34/55/86/329345586.db2.gz	UMZCRPFKDYFMJQ-UHFFFAOYSA-N	0	0	297.745	4.025	20	30		CIEDRN
N#CCC1CCN(Cc2cc(Cl)ccc2Cl)CC1	ZINC000397235681	329345643	/nfs/dbraw/zinc/34/56/43/329345643.db2.gz	UQRPWDLIWBRVMA-UHFFFAOYSA-N	0	0	283.202	4.119	20	30		CIEDRN
Cc1nc2ccc(CN3CCCC(C)(C)[C@H]3C#N)cc2s1	ZINC000583183335	329348084	/nfs/dbraw/zinc/34/80/84/329348084.db2.gz	CQONVYPNDRBXFC-MRXNPFEDSA-N	0	0	299.443	4.119	20	30		CIEDRN
N#Cc1cccc(-c2csc(C3CCCC3)n2)c1	ZINC000062938265	329356392	/nfs/dbraw/zinc/35/63/92/329356392.db2.gz	PGHRIGJNVJTYBK-UHFFFAOYSA-N	0	0	254.358	4.339	20	30		CIEDRN
CC(=O)c1cccc(NCc2ccc(Cl)cc2C#N)c1	ZINC000187704057	329362523	/nfs/dbraw/zinc/36/25/23/329362523.db2.gz	ROSWCMSTGYSRNK-UHFFFAOYSA-N	0	0	284.746	4.026	20	30		CIEDRN
C=CCC[C@H](C(=O)Nc1c(C)noc1CC)c1ccccc1	ZINC000188869724	329372788	/nfs/dbraw/zinc/37/27/88/329372788.db2.gz	BJKBJLAWPAAAJW-HNNXBMFYSA-N	0	0	298.386	4.234	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(OC(F)F)c(F)c2)CCC1	ZINC000189003405	329374856	/nfs/dbraw/zinc/37/48/56/329374856.db2.gz	SXNAKLULCSBERA-UHFFFAOYSA-N	0	0	299.292	4.112	20	30		CIEDRN
CC(C)(C#N)CCCC[S@](=O)c1ccccc1Cl	ZINC000232526621	329387415	/nfs/dbraw/zinc/38/74/15/329387415.db2.gz	IMHVNDDFPKSFNZ-SFHVURJKSA-N	0	0	283.824	4.168	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1ccncc1	ZINC000189885837	329388065	/nfs/dbraw/zinc/38/80/65/329388065.db2.gz	KAXXFUGLIXLJGT-UHFFFAOYSA-N	0	0	280.371	4.186	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)C[C@H]1CCCO1	ZINC000189870042	329388945	/nfs/dbraw/zinc/38/89/45/329388945.db2.gz	SZWGYRLDYLXYRO-OAHLLOKOSA-N	0	0	287.403	4.046	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@@H](C)c1ccc(Cl)cc1	ZINC000189862534	329388974	/nfs/dbraw/zinc/38/89/74/329388974.db2.gz	CZDPRWNXFZLEGM-NHYWBVRUSA-N	0	0	265.784	4.120	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)SC	ZINC000189888120	329388953	/nfs/dbraw/zinc/38/89/53/329388953.db2.gz	SXCNZUFKUXQHKM-GFCCVEGCSA-N	0	0	277.433	4.229	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1ncoc1C	ZINC000189900363	329389181	/nfs/dbraw/zinc/38/91/81/329389181.db2.gz	LLLVLCJKHMVMTN-UHFFFAOYSA-N	0	0	284.359	4.087	20	30		CIEDRN
C=CCC1(C(=O)N2CCC(C)(C(C)C)CC2)CCC1	ZINC000190517222	329398786	/nfs/dbraw/zinc/39/87/86/329398786.db2.gz	HEVFRVSGMZLYMF-UHFFFAOYSA-N	0	0	263.425	4.018	20	30		CIEDRN
N#Cc1ccccc1SC[C@H]1CCCC(F)(F)C1	ZINC000509059713	332857755	/nfs/dbraw/zinc/85/77/55/332857755.db2.gz	DWQSRBNMBVDPQH-NSHDSACASA-N	0	0	267.344	4.476	20	30		CIEDRN
C=CCN(CC=C)C(=O)Nc1c(C)cccc1C(C)C	ZINC000192543764	329434057	/nfs/dbraw/zinc/43/40/57/329434057.db2.gz	BPXJKFFGDJPIKI-UHFFFAOYSA-N	0	0	272.392	4.324	20	30		CIEDRN
CCCOc1ccccc1OCc1ccc(CC#N)cc1	ZINC000399030746	329447834	/nfs/dbraw/zinc/44/78/34/329447834.db2.gz	JNCBOHJGGHIKJR-UHFFFAOYSA-N	0	0	281.355	4.120	20	30		CIEDRN
Cc1ccc(Cl)c(OCc2ccc(CC#N)cc2)c1	ZINC000399121347	329448543	/nfs/dbraw/zinc/44/85/43/329448543.db2.gz	ICKWJZUNVOYVPU-UHFFFAOYSA-N	0	0	271.747	4.294	20	30		CIEDRN
N#CCc1ccc(CNc2cccc(Cl)c2F)cc1	ZINC000399113464	329448624	/nfs/dbraw/zinc/44/86/24/329448624.db2.gz	LQTGTFYAZDNDNJ-UHFFFAOYSA-N	0	0	274.726	4.157	20	30		CIEDRN
CC#CCCSC[C@@H](OC)c1ccc(Cl)cc1	ZINC000509147735	332860268	/nfs/dbraw/zinc/86/02/68/332860268.db2.gz	WZWWTHFHRVWXRL-CQSZACIVSA-N	0	0	268.809	4.174	20	30		CIEDRN
C=CCN(C(=O)c1ccc(F)cc1Cl)c1ccccc1	ZINC000301845409	332861274	/nfs/dbraw/zinc/86/12/74/332861274.db2.gz	NEAXQSJFQXXHKT-UHFFFAOYSA-N	0	0	289.737	4.312	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)N(C)C1CCCC1	ZINC000509247438	332862184	/nfs/dbraw/zinc/86/21/84/332862184.db2.gz	LCZOUQKGUSVMMZ-UHFFFAOYSA-N	0	0	286.419	4.059	20	30		CIEDRN
C=C(C)CN(CC)C(=O)[C@@H](C)Sc1ccc(Cl)cc1	ZINC000301993145	332864382	/nfs/dbraw/zinc/86/43/82/332864382.db2.gz	BDZJUKNLVQYVKO-GFCCVEGCSA-N	0	0	297.851	4.245	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CCC(c2ccccc2F)CC1	ZINC000525954503	329551603	/nfs/dbraw/zinc/55/16/03/329551603.db2.gz	HTTKQCONJQOIBB-GOSISDBHSA-N	0	0	289.394	4.134	20	30		CIEDRN
CC(=O)c1cccc(OCCC2(C#N)CCCCC2)c1	ZINC000418787049	329552834	/nfs/dbraw/zinc/55/28/34/329552834.db2.gz	GKUMWNODKZVVKV-UHFFFAOYSA-N	0	0	271.360	4.132	20	30		CIEDRN
CSc1cccc(C)c1NC(=O)c1cccc(C#N)c1C	ZINC000509317481	332864912	/nfs/dbraw/zinc/86/49/12/332864912.db2.gz	QOKQHKXQHUWKMM-UHFFFAOYSA-N	0	0	296.395	4.149	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1ccc(Cl)cc1COC	ZINC000425629879	329573926	/nfs/dbraw/zinc/57/39/26/329573926.db2.gz	FQUPWTRAILKMQZ-UHFFFAOYSA-N	0	0	281.783	4.027	20	30		CIEDRN
CCC(CC)N(CC(C)C)C(=O)c1cccc(C#N)c1C	ZINC000509360582	332866513	/nfs/dbraw/zinc/86/65/13/332866513.db2.gz	LPVKJIPOAJAKAO-UHFFFAOYSA-N	0	0	286.419	4.154	20	30		CIEDRN
C[C@@H](CC(C)(C)C)C(=O)N(C)[C@@H](C)c1cccc(C#N)c1	ZINC000425132297	329604050	/nfs/dbraw/zinc/60/40/50/329604050.db2.gz	QXPDHFRJFIXWDH-KBPBESRZSA-N	0	0	286.419	4.150	20	30		CIEDRN
Cc1cc(C)cc(C(=O)N(C)[C@H](C)c2cccc(C#N)c2)c1	ZINC000425133440	329604484	/nfs/dbraw/zinc/60/44/84/329604484.db2.gz	SPNNAOMFFLXEES-OAHLLOKOSA-N	0	0	292.382	4.008	20	30		CIEDRN
N#C[C@@H](C(=O)c1ccc(-c2ccccc2)cc1)c1ccccn1	ZINC000046439779	329608574	/nfs/dbraw/zinc/60/85/74/329608574.db2.gz	AHFZWXQYBLUATG-GOSISDBHSA-N	0	0	298.345	4.239	20	30		CIEDRN
Cc1cc(SCc2ccccc2C2CC2)c(C#N)cn1	ZINC000425251192	329650457	/nfs/dbraw/zinc/65/04/57/329650457.db2.gz	DZFAHZURDYEXDU-UHFFFAOYSA-N	0	0	280.396	4.431	20	30		CIEDRN
N#C[C@H]1CC[C@@H](Nc2ccnc3cc(F)c(Cl)cc32)C1	ZINC000425270347	329653455	/nfs/dbraw/zinc/65/34/55/329653455.db2.gz	FYGUMFYIVVONSH-VHSXEESVSA-N	0	0	289.741	4.131	20	30		CIEDRN
N#Cc1cccc(CNc2ccc3nc(C4CC4)oc3c2)c1	ZINC000152493321	329659799	/nfs/dbraw/zinc/65/97/99/329659799.db2.gz	FBKITJQWFWIGTC-UHFFFAOYSA-N	0	0	289.338	4.189	20	30		CIEDRN
CC(C)(C#N)CCSCc1ccc2c(c1)CCC2	ZINC000564090930	329668145	/nfs/dbraw/zinc/66/81/45/329668145.db2.gz	ZBDTWYPVKIUQRL-UHFFFAOYSA-N	0	0	259.418	4.348	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CCC2(CCCC2)C1)c1ccccc1	ZINC000136639223	329673701	/nfs/dbraw/zinc/67/37/01/329673701.db2.gz	FJVWHMOFBDJEFC-INIZCTEOSA-N	0	0	283.415	4.139	20	30		CIEDRN
Cc1c(C#N)cccc1C(=O)N(CC1CC1)C1CCCCC1	ZINC000509500620	332871790	/nfs/dbraw/zinc/87/17/90/332871790.db2.gz	MPXYYHSZJKXDDR-UHFFFAOYSA-N	0	0	296.414	4.052	20	30		CIEDRN
COc1cc(C#N)cc(Cl)c1OCCC(C)(C)C	ZINC000527106260	329696077	/nfs/dbraw/zinc/69/60/77/329696077.db2.gz	XMNPGLWAMCTWBD-UHFFFAOYSA-N	0	0	267.756	4.035	20	30		CIEDRN
CCc1csc(N[C@@H]2CCCc3cc(C#N)ccc32)n1	ZINC000419017989	329703584	/nfs/dbraw/zinc/70/35/84/329703584.db2.gz	RWHMZKALHNWERC-OAHLLOKOSA-N	0	0	283.400	4.067	20	30		CIEDRN
C[C@@H](NCc1cccc(F)c1C#N)c1ccc(C2CC2)cc1	ZINC000419342112	329718542	/nfs/dbraw/zinc/71/85/42/329718542.db2.gz	PASSJTNCQOLXHH-CYBMUJFWSA-N	0	0	294.373	4.426	20	30		CIEDRN
Cc1cccc(C)c1OCCSCC1(C#N)CCC1	ZINC000419346312	329718963	/nfs/dbraw/zinc/71/89/63/329718963.db2.gz	NGNPVYXAFOINIV-UHFFFAOYSA-N	0	0	275.417	4.109	20	30		CIEDRN
N#CC1(CSCc2cc(-c3ccccc3)no2)CCC1	ZINC000419362930	329720321	/nfs/dbraw/zinc/72/03/21/329720321.db2.gz	CLLBTRCKMYBQMB-UHFFFAOYSA-N	0	0	284.384	4.269	20	30		CIEDRN
Cc1ccc(C)c(OCCSCC2(C#N)CCC2)c1	ZINC000419389893	329721694	/nfs/dbraw/zinc/72/16/94/329721694.db2.gz	HXZMRHXRCLQOMS-UHFFFAOYSA-N	0	0	275.417	4.109	20	30		CIEDRN
COc1cc(CSCC2(C#N)CCC2)ccc1SC	ZINC000419402522	329723789	/nfs/dbraw/zinc/72/37/89/329723789.db2.gz	BSUOHWKDJISIHL-UHFFFAOYSA-N	0	0	293.457	4.344	20	30		CIEDRN
C=CCOCCSCc1csc(-c2ccsc2)n1	ZINC000419412933	329724627	/nfs/dbraw/zinc/72/46/27/329724627.db2.gz	JRNICKWJSZQOJD-UHFFFAOYSA-N	0	0	297.470	4.307	20	30		CIEDRN
N#CC1(CSCc2ncc(-c3cccs3)o2)CCC1	ZINC000419412330	329724702	/nfs/dbraw/zinc/72/47/02/329724702.db2.gz	QZHMCDBYINDFIZ-UHFFFAOYSA-N	0	0	290.413	4.330	20	30		CIEDRN
N#Cc1cnc(CS[C@H]2CCCCc3ccccc32)nc1	ZINC000419416192	329725126	/nfs/dbraw/zinc/72/51/26/329725126.db2.gz	IPJLNMRIABDODX-INIZCTEOSA-N	0	0	295.411	4.049	20	30		CIEDRN
CC(C)OC1CC(S[C@@H](C)c2ccc(C#N)cc2)C1	ZINC000419420711	329727372	/nfs/dbraw/zinc/72/73/72/329727372.db2.gz	KIQGYRKTMHMZFD-JQRITLKVSA-N	0	0	275.417	4.308	20	30		CIEDRN
C[C@H]1C[C@@H](CSCCC2(C#N)CCCCC2)CCO1	ZINC000419499968	329732529	/nfs/dbraw/zinc/73/25/29/329732529.db2.gz	PLYFVMMRGNZELN-GJZGRUSLSA-N	0	0	281.465	4.399	20	30		CIEDRN
N#CC1(CCSCCOC2CCC2)CCCCC1	ZINC000419473852	329735247	/nfs/dbraw/zinc/73/52/47/329735247.db2.gz	KNEIHLHNDKNWLW-UHFFFAOYSA-N	0	0	267.438	4.153	20	30		CIEDRN
CC(=O)c1ccc(CSCCC(C)(C)C#N)cc1	ZINC000419481597	329736355	/nfs/dbraw/zinc/73/63/55/329736355.db2.gz	WNGNZJBPEULTLM-UHFFFAOYSA-N	0	0	261.390	4.062	20	30		CIEDRN
CO[C@@H](CSCCCC(C)(C)C#N)Cc1ccccc1	ZINC000419532848	329737924	/nfs/dbraw/zinc/73/79/24/329737924.db2.gz	NVMHUZSZUUWMIA-MRXNPFEDSA-N	0	0	291.460	4.307	20	30		CIEDRN
N#CC1(CSCc2cnc3ccccc3c2)CCC1	ZINC000419553351	329738960	/nfs/dbraw/zinc/73/89/60/329738960.db2.gz	AGNLVOUJYJZSMK-UHFFFAOYSA-N	0	0	268.385	4.162	20	30		CIEDRN
N#CCCCCSCc1ccn(CCc2ccccc2)n1	ZINC000419599555	329742296	/nfs/dbraw/zinc/74/22/96/329742296.db2.gz	UMVKXYFIBPQJEP-UHFFFAOYSA-N	0	0	299.443	4.053	20	30		CIEDRN
C=CCCCCCNC(=O)Nc1ncsc1C(C)C	ZINC000565160584	329742817	/nfs/dbraw/zinc/74/28/17/329742817.db2.gz	DUSPUUBHCGAATB-UHFFFAOYSA-N	0	0	281.425	4.134	20	30		CIEDRN
Cc1cc(Oc2c(C)cc(Cl)cc2C#N)nc(C2CC2)n1	ZINC000420646727	329780860	/nfs/dbraw/zinc/78/08/60/329780860.db2.gz	WNFBAEVMYFSHSE-UHFFFAOYSA-N	0	0	299.761	4.288	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)N[C@@H](c1ccccc1)C1CC1	ZINC000432102857	329804139	/nfs/dbraw/zinc/80/41/39/329804139.db2.gz	NBLIXQBOUJFHKV-INIZCTEOSA-N	0	0	286.419	4.039	20	30		CIEDRN
CC[C@@H](C)CNC(=O)c1ccccc1-c1ccccc1C#N	ZINC000421580251	329843507	/nfs/dbraw/zinc/84/35/07/329843507.db2.gz	MSQDPSTUPNYGAI-CQSZACIVSA-N	0	0	292.382	4.001	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(-c2ccc(F)cc2C)no1	ZINC000572078542	329942513	/nfs/dbraw/zinc/94/25/13/329942513.db2.gz	VOBUAHAVBHUMJP-HNNXBMFYSA-N	0	0	260.312	4.038	20	30		CIEDRN
C=CCCCCCNC(=O)Nc1cccc(C(F)F)c1	ZINC000572131967	329948220	/nfs/dbraw/zinc/94/82/20/329948220.db2.gz	UJFDPABYWORYJW-UHFFFAOYSA-N	0	0	282.334	4.492	20	30		CIEDRN
C=CCOc1ccccc1-c1nc(-c2cscc2C)no1	ZINC000572164718	329951055	/nfs/dbraw/zinc/95/10/55/329951055.db2.gz	UYNIXCYNPYFDNQ-UHFFFAOYSA-N	0	0	298.367	4.338	20	30		CIEDRN
C=CCC[C@@H](C(=O)NCC1(C2CC2)CC1)c1ccccc1	ZINC000188777576	329963151	/nfs/dbraw/zinc/96/31/51/329963151.db2.gz	BNMNFAIGSKSXAK-QGZVFWFLSA-N	0	0	283.415	4.043	20	30		CIEDRN
C[C@H](NCc1ccccc1C#N)c1nc(C(C)(C)C)cs1	ZINC000162055164	329970646	/nfs/dbraw/zinc/97/06/46/329970646.db2.gz	FLBOVGXGSNAQRU-LBPRGKRZSA-N	0	0	299.443	4.163	20	30		CIEDRN
C[C@@H](CC1CCCCC1)C(=O)N[C@@H](C)c1ccc(C#N)cc1	ZINC000510045180	332889267	/nfs/dbraw/zinc/88/92/67/332889267.db2.gz	YDSBVKNFSZEMTN-GJZGRUSLSA-N	0	0	298.430	4.342	20	30		CIEDRN
N#Cc1csc(CNc2ncccc2-c2ccccc2)c1	ZINC000162385031	330008067	/nfs/dbraw/zinc/00/80/67/330008067.db2.gz	YAHPMNDWXJFUCD-UHFFFAOYSA-N	0	0	291.379	4.294	20	30		CIEDRN
C=CCCC(=O)N1CCCCC[C@@H]1c1ccccc1	ZINC000263700605	330060184	/nfs/dbraw/zinc/06/01/84/330060184.db2.gz	UFTFXHTUYTUILL-MRXNPFEDSA-N	0	0	257.377	4.097	20	30		CIEDRN
C=C(C)C[N@@H+]1CCC[C@@H]1c1nc2ccccc2s1	ZINC000263841511	330060757	/nfs/dbraw/zinc/06/07/57/330060757.db2.gz	KMRFWZPAPNIRMS-CYBMUJFWSA-N	0	0	258.390	4.009	20	30		CIEDRN
C=CCCC(=O)N(CC)[C@H](C)c1cc2ccccc2o1	ZINC000264009066	330060986	/nfs/dbraw/zinc/06/09/86/330060986.db2.gz	UVBKDSWYYJTECL-CYBMUJFWSA-N	0	0	271.360	4.309	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1ccc(-c2cnco2)cc1	ZINC000265697467	330062973	/nfs/dbraw/zinc/06/29/73/330062973.db2.gz	CCGLHWLJDCJXLU-UHFFFAOYSA-N	0	0	298.386	4.160	20	30		CIEDRN
C=CCCS[C@H](C)C(=O)Nc1ccc(SC)cc1	ZINC000265766853	330063251	/nfs/dbraw/zinc/06/32/51/330063251.db2.gz	LCJIVRHEQCJOTC-LLVKDONJSA-N	0	0	281.446	4.045	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)Nc1cc(C(C)C)on1	ZINC000266350662	330063999	/nfs/dbraw/zinc/06/39/99/330063999.db2.gz	DTNDGPUPXLYCLH-UHFFFAOYSA-N	0	0	299.374	4.018	20	30		CIEDRN
C=CCCCC(=O)N1CCCC[C@H]1c1ccc(F)cc1	ZINC000267790305	330064945	/nfs/dbraw/zinc/06/49/45/330064945.db2.gz	YDVMEQGUKLVKCE-INIZCTEOSA-N	0	0	275.367	4.236	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@@H]1c1cccc(F)c1	ZINC000268131268	330065239	/nfs/dbraw/zinc/06/52/39/330065239.db2.gz	ANYWWRVMHQBVNA-QGZVFWFLSA-N	0	0	287.378	4.258	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@H]1c1cccc(F)c1	ZINC000268131266	330065584	/nfs/dbraw/zinc/06/55/84/330065584.db2.gz	ANYWWRVMHQBVNA-KRWDZBQOSA-N	0	0	287.378	4.258	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc2c(c1)C(=O)CCCC2	ZINC000421716990	330069664	/nfs/dbraw/zinc/06/96/64/330069664.db2.gz	VGHUELVQGVFVGZ-UHFFFAOYSA-N	0	0	285.387	4.137	20	30		CIEDRN
CCCc1[nH]ccc1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000421743068	330072832	/nfs/dbraw/zinc/07/28/32/330072832.db2.gz	IVRDWPFRZVFKMS-UHFFFAOYSA-N	0	0	295.386	4.021	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1sc(C)nc1C)c1ccccc1	ZINC000270396944	330075162	/nfs/dbraw/zinc/07/51/62/330075162.db2.gz	UKPFIUDACOEWCD-ZDUSSCGKSA-N	0	0	286.400	4.058	20	30		CIEDRN
C#CCCCCC(=O)N1CCC(=Cc2ccccc2F)CC1	ZINC000271342571	330078995	/nfs/dbraw/zinc/07/89/95/330078995.db2.gz	CNHLMVNVVAVLQK-UHFFFAOYSA-N	0	0	299.389	4.025	20	30		CIEDRN
CCC[C@H]1CCc2ccccc2N1Cc1ccc(C#N)cn1	ZINC000572434986	330081668	/nfs/dbraw/zinc/08/16/68/330081668.db2.gz	VPPXQGAGERMIQS-SFHVURJKSA-N	0	0	291.398	4.075	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1cccc(SC)c1C	ZINC000271666044	330081718	/nfs/dbraw/zinc/08/17/18/330081718.db2.gz	FJALLLVZGDOEPW-UHFFFAOYSA-N	0	0	278.421	4.147	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)Nc1cccc(C)c1C	ZINC000272220492	330085024	/nfs/dbraw/zinc/08/50/24/330085024.db2.gz	BVCIVWSCPHACGQ-UHFFFAOYSA-N	0	0	298.386	4.159	20	30		CIEDRN
C=C[C@H](CC(=O)N1CC2(C1)CCCCC2)c1ccccc1	ZINC000273771495	330097427	/nfs/dbraw/zinc/09/74/27/330097427.db2.gz	QVUJDHBHQHEIGQ-MRXNPFEDSA-N	0	0	283.415	4.139	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H]1c1ccsc1	ZINC000274278088	330104164	/nfs/dbraw/zinc/10/41/64/330104164.db2.gz	JLEXBSGJKPQNKO-JSGCOSHPSA-N	0	0	263.406	4.014	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H]1c1ccc(F)cc1	ZINC000274264614	330104469	/nfs/dbraw/zinc/10/44/69/330104469.db2.gz	DQSZDKKRGRDKBC-CZUORRHYSA-N	0	0	275.367	4.092	20	30		CIEDRN
C=CCCCCNC(=O)c1c(Cl)cccc1Cl	ZINC000274441012	330106209	/nfs/dbraw/zinc/10/62/09/330106209.db2.gz	DPVUJKWJINICBH-UHFFFAOYSA-N	0	0	272.175	4.080	20	30		CIEDRN
C=C(C)CCSc1nnc(-c2sccc2C)o1	ZINC000274724536	330107797	/nfs/dbraw/zinc/10/77/97/330107797.db2.gz	GEFNTDNBWXRJHA-UHFFFAOYSA-N	0	0	266.391	4.165	20	30		CIEDRN
C=C(C)[C@H](N[C@H](C)c1cscn1)c1ccc(F)c(F)c1	ZINC000274804145	330107975	/nfs/dbraw/zinc/10/79/75/330107975.db2.gz	WBLVFOZQVHFKRM-BMIGLBTASA-N	0	0	294.370	4.389	20	30		CIEDRN
C=CCC[C@H]([NH2+][C@@H](CCCO)c1ccccc1)c1ccco1	ZINC000276443862	330113532	/nfs/dbraw/zinc/11/35/32/330113532.db2.gz	KSMAUJPXXMNHOA-ROUUACIJSA-N	0	0	299.414	4.390	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)N(C)CC=C	ZINC000276458399	330113874	/nfs/dbraw/zinc/11/38/74/330113874.db2.gz	VXDRPIUTSPDIHO-UHFFFAOYSA-N	0	0	272.392	4.188	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1ncccc1C	ZINC000276507343	330114040	/nfs/dbraw/zinc/11/40/40/330114040.db2.gz	YOQHILSCXCZINQ-UHFFFAOYSA-N	0	0	294.398	4.494	20	30		CIEDRN
C#CCCCC(=O)N(C)[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000276982641	330115040	/nfs/dbraw/zinc/11/50/40/330115040.db2.gz	HHYDCGPUZODQTL-GFCCVEGCSA-N	0	0	297.320	4.028	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cc2c(cc1Cl)CCC2=O	ZINC000277083350	330115220	/nfs/dbraw/zinc/11/52/20/330115220.db2.gz	JXDIZBIPHQSWPR-MRXNPFEDSA-N	0	0	291.778	4.010	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Oc1ccc(-c2c(C)noc2C)cc1	ZINC000277059429	330115272	/nfs/dbraw/zinc/11/52/72/330115272.db2.gz	DCDDLFJYRAZEBR-GFCCVEGCSA-N	0	0	299.370	4.466	20	30		CIEDRN
CC#CCCCC(=O)Oc1ccc(-c2c(C)noc2C)cc1	ZINC000277196013	330115403	/nfs/dbraw/zinc/11/54/03/330115403.db2.gz	MERHAAUMZQIVMX-UHFFFAOYSA-N	0	0	297.354	4.057	20	30		CIEDRN
C#CCCCC(=O)Nc1cc(C(F)F)ccc1Cl	ZINC000277665552	330116774	/nfs/dbraw/zinc/11/67/74/330116774.db2.gz	ONGFMQHLLABDPT-UHFFFAOYSA-N	0	0	271.694	4.020	20	30		CIEDRN
C=CCCCN(C)C(=O)C[C@H](C)c1c[nH]c2ccccc21	ZINC000278408741	330117068	/nfs/dbraw/zinc/11/70/68/330117068.db2.gz	VKXOHSUMBDFEDH-AWEZNQCLSA-N	0	0	284.403	4.086	20	30		CIEDRN
C#CC[C@H](NCc1ncc(C(C)(C)C)s1)c1ccccc1	ZINC000279213063	330122304	/nfs/dbraw/zinc/12/23/04/330122304.db2.gz	WIUZYOKWAYWVRF-HNNXBMFYSA-N	0	0	298.455	4.295	20	30		CIEDRN
COc1ccc([C@H](C)[C@@H](C)Nc2cccc(C#N)c2)cc1	ZINC000527218660	330238302	/nfs/dbraw/zinc/23/83/02/330238302.db2.gz	UVBWQAGHBMCJGD-ZIAGYGMSSA-N	0	0	280.371	4.171	20	30		CIEDRN
C[C@@H](Nc1cccc(F)c1C#N)c1c(F)cccc1F	ZINC000036138645	330249721	/nfs/dbraw/zinc/24/97/21/330249721.db2.gz	MXMZVJZHMGDJNO-SECBINFHSA-N	0	0	276.261	4.149	20	30		CIEDRN
N#Cc1c(F)cccc1NCc1ccccc1C(F)(F)F	ZINC000036138565	330249737	/nfs/dbraw/zinc/24/97/37/330249737.db2.gz	VZBQODRPXHZDCP-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
CC[C@@H](C#N)c1ccc(-c2ccc3c(c2)CCOC3)cc1	ZINC000527588510	330264438	/nfs/dbraw/zinc/26/44/38/330264438.db2.gz	AQOLXLGVSPIZCN-AWEZNQCLSA-N	0	0	277.367	4.443	20	30		CIEDRN
CC(C)[C@H](C)Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000036805594	330275527	/nfs/dbraw/zinc/27/55/27/330275527.db2.gz	FZDTWBNPGDXTKN-VIFPVBQESA-N	0	0	256.271	4.033	20	30		CIEDRN
COCc1ccc(NCc2ccc([C@H]3C[C@@H]3C)o2)cc1C#N	ZINC000527762161	330281357	/nfs/dbraw/zinc/28/13/57/330281357.db2.gz	GUBHMGVQLMNQOA-SJCJKPOMSA-N	0	0	296.370	4.033	20	30		CIEDRN
CCN(Cc1cccc(Cl)c1)C(=O)C(C#N)(CC)CC	ZINC000527855901	330288928	/nfs/dbraw/zinc/28/89/28/330288928.db2.gz	XZLFVGZETUWIGO-UHFFFAOYSA-N	0	0	292.810	4.018	20	30		CIEDRN
N#Cc1cccc(NC2CC(c3cccc(F)c3)C2)c1	ZINC000036842296	330292347	/nfs/dbraw/zinc/29/23/47/330292347.db2.gz	WVHRCCPNHKVGLS-UHFFFAOYSA-N	0	0	266.319	4.055	20	30		CIEDRN
COc1c(C)cc(Cl)cc1N[C@@H]1CCC[C@@H](C#N)C1	ZINC000527973605	330301858	/nfs/dbraw/zinc/30/18/58/330301858.db2.gz	JXBMYNSBBPHGPA-DGCLKSJQSA-N	0	0	278.783	4.151	20	30		CIEDRN
Cc1cc(C#N)cc(N[C@H]2CCc3cc(Cl)ccc32)n1	ZINC000528193464	330312368	/nfs/dbraw/zinc/31/23/68/330312368.db2.gz	OOQLBMMHFRBXAW-HNNXBMFYSA-N	0	0	283.762	4.015	20	30		CIEDRN
CCC(C#N)(CC)c1nc(C(C)(C)C2=CCCCC2)no1	ZINC000528183354	330314097	/nfs/dbraw/zinc/31/40/97/330314097.db2.gz	YLWPAQRXAZHMQP-UHFFFAOYSA-N	0	0	287.407	4.429	20	30		CIEDRN
CCc1nc2cc(NCc3ccc(C#N)cc3F)ccc2o1	ZINC000532989510	330323241	/nfs/dbraw/zinc/32/32/41/330323241.db2.gz	NSVWNRNTGCVBBX-UHFFFAOYSA-N	0	0	295.317	4.013	20	30		CIEDRN
C[C@@H](c1ccccc1F)N(C)CC#Cc1ccc(F)cc1	ZINC000533001633	330324976	/nfs/dbraw/zinc/32/49/76/330324976.db2.gz	JBKXRJBNQAZTRD-AWEZNQCLSA-N	0	0	285.337	4.009	20	30		CIEDRN
C=CC[C@H](C)NC(=O)C[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000116862289	330325271	/nfs/dbraw/zinc/32/52/71/330325271.db2.gz	UJDFHZBSBQMPFZ-RYUDHWBXSA-N	0	0	299.336	4.280	20	30		CIEDRN
N#Cc1ccc(OCc2ccc(F)c(F)c2)c(Cl)c1	ZINC000105833270	330328450	/nfs/dbraw/zinc/32/84/50/330328450.db2.gz	RQMLXQPROHZFPK-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
CC(C)Oc1ccc(C#N)cc1NC(=O)CC1=CCCCC1	ZINC000106630664	330340947	/nfs/dbraw/zinc/34/09/47/330340947.db2.gz	IAQAAGLGYWBVNU-UHFFFAOYSA-N	0	0	298.386	4.174	20	30		CIEDRN
C=C(C)C(C)(C)c1nc(CCn2ccc3ccccc32)no1	ZINC000424351992	330345546	/nfs/dbraw/zinc/34/55/46/330345546.db2.gz	XIAUYRNXMZJBCF-UHFFFAOYSA-N	0	0	295.386	4.121	20	30		CIEDRN
C=C(C)C(C)(C)c1nc(-c2ccc(C(C)C)nc2)no1	ZINC000424360224	330346873	/nfs/dbraw/zinc/34/68/73/330346873.db2.gz	RQWHGNHUEHMOEX-UHFFFAOYSA-N	0	0	271.364	4.109	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)c1cccs1	ZINC000045603583	330347082	/nfs/dbraw/zinc/34/70/82/330347082.db2.gz	RVFZSVIFJGYDTB-UHFFFAOYSA-N	0	0	297.832	4.291	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)C1CCCC1	ZINC000045603634	330347102	/nfs/dbraw/zinc/34/71/02/330347102.db2.gz	MZHSRTRDBMKLMP-UHFFFAOYSA-N	0	0	283.824	4.106	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)CCCC	ZINC000045905741	330349851	/nfs/dbraw/zinc/34/98/51/330349851.db2.gz	CIHGDONOMXYOJQ-UHFFFAOYSA-N	0	0	271.813	4.106	20	30		CIEDRN
CCCC[C@H](CC)C(=O)N[C@@](C)(C#N)C1CCCCC1	ZINC000580499476	330354880	/nfs/dbraw/zinc/35/48/80/330354880.db2.gz	ONINQRRFMLDCNV-YOEHRIQHSA-N	0	0	278.440	4.182	20	30		CIEDRN
C=CCC[C@@H](NC(=O)C[C@H](C)n1cccc1)c1ccccc1	ZINC000533261596	330355674	/nfs/dbraw/zinc/35/56/74/330355674.db2.gz	FPDHEDSZNPRJAL-FUHWJXTLSA-N	0	0	296.414	4.263	20	30		CIEDRN
C=C(CC)CSCC(=O)N(c1ccccc1)C(C)C	ZINC000536880478	330358180	/nfs/dbraw/zinc/35/81/80/330358180.db2.gz	BYKXFQWQUCZDIS-UHFFFAOYSA-N	0	0	277.433	4.127	20	30		CIEDRN
C=C(CC)CSCC(=O)Nc1cccc(Cl)c1C	ZINC000536881947	330360750	/nfs/dbraw/zinc/36/07/50/330360750.db2.gz	OQGCUIFSCBXFOV-UHFFFAOYSA-N	0	0	283.824	4.286	20	30		CIEDRN
C=C(CC)CNc1cccc(Cl)c1OCCOCC	ZINC000536881754	330360760	/nfs/dbraw/zinc/36/07/60/330360760.db2.gz	LKWICYMIJOBXCP-UHFFFAOYSA-N	0	0	283.799	4.133	20	30		CIEDRN
C=C(CC)CSc1nnc(C[C@@H](C)c2ccccc2)o1	ZINC000536905665	330363703	/nfs/dbraw/zinc/36/37/03/330363703.db2.gz	PKPZHNBMNQXUQI-CYBMUJFWSA-N	0	0	288.416	4.474	20	30		CIEDRN
C=CCCCS[C@@H](C)C(=O)Nc1ccc(C)cc1F	ZINC000117944989	330366578	/nfs/dbraw/zinc/36/65/78/330366578.db2.gz	PPXLQEFJDUTRPG-LBPRGKRZSA-N	0	0	281.396	4.161	20	30		CIEDRN
C=CCCCS[C@@H](C)C(=O)Nc1cc(C)ccc1C	ZINC000117944535	330366621	/nfs/dbraw/zinc/36/66/21/330366621.db2.gz	HFWBPOALXZQFTM-AWEZNQCLSA-N	0	0	277.433	4.330	20	30		CIEDRN
COc1c(Cl)cccc1N[C@H](C)c1ccc(C#N)cc1	ZINC000118443215	330367214	/nfs/dbraw/zinc/36/72/14/330367214.db2.gz	AIENUHXVHAHJMI-LLVKDONJSA-N	0	0	286.762	4.393	20	30		CIEDRN
Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C1CC1	ZINC000056469590	330367948	/nfs/dbraw/zinc/36/79/48/330367948.db2.gz	QTRYCGLKORRMLF-UHFFFAOYSA-N	0	0	292.338	4.008	20	30		CIEDRN
C=CCOc1cccc(NC(=O)Nc2ccccc2F)c1	ZINC000056516906	330368542	/nfs/dbraw/zinc/36/85/42/330368542.db2.gz	LXTRQKBIXXGWOJ-UHFFFAOYSA-N	0	0	286.306	4.035	20	30		CIEDRN
CCCC[C@@H](NC(=O)Nc1ccc(CC#N)cc1)C1CCC1	ZINC000119028848	330368873	/nfs/dbraw/zinc/36/88/73/330368873.db2.gz	RWMKXXWMQREXLP-QGZVFWFLSA-N	0	0	299.418	4.233	20	30		CIEDRN
C=C(C)CNC(=O)N(c1ccccc1)c1ccccc1	ZINC000119149108	330371348	/nfs/dbraw/zinc/37/13/48/330371348.db2.gz	FUZXPIZZULAMRK-UHFFFAOYSA-N	0	0	266.344	4.110	20	30		CIEDRN
Cc1cc(C#N)ccc1C(=O)N1CCC2(CCCCC2)CC1	ZINC000119249875	330372238	/nfs/dbraw/zinc/37/22/38/330372238.db2.gz	VTVMSLXYBKUSCQ-UHFFFAOYSA-N	0	0	296.414	4.053	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N(C)Cc1ccccc1C(F)(F)F	ZINC000424556166	330374933	/nfs/dbraw/zinc/37/49/33/330374933.db2.gz	GHQRJEHMRPTNJF-UHFFFAOYSA-N	0	0	299.336	4.266	20	30		CIEDRN
CC(C)(C#N)CCCNc1ccccc1C(F)F	ZINC000424561331	330376134	/nfs/dbraw/zinc/37/61/34/330376134.db2.gz	BESLWYQSTFEFHN-UHFFFAOYSA-N	0	0	252.308	4.366	20	30		CIEDRN
CC(C)CCN(CCC(C)C)C(=O)c1cccc(C#N)c1	ZINC000057613074	330377068	/nfs/dbraw/zinc/37/70/68/330377068.db2.gz	BUIUZCFKMZQUAP-UHFFFAOYSA-N	0	0	286.419	4.093	20	30		CIEDRN
N#Cc1c(F)cccc1Oc1ccc(F)c(Cl)c1	ZINC000057652347	330377603	/nfs/dbraw/zinc/37/76/03/330377603.db2.gz	LJFFCWCHDRISIS-UHFFFAOYSA-N	0	0	265.646	4.282	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@H]1CCSc2ccc(F)cc21	ZINC000424567904	330379827	/nfs/dbraw/zinc/37/98/27/330379827.db2.gz	SWAUAKROPGAJTL-ZDUSSCGKSA-N	0	0	293.407	4.081	20	30		CIEDRN
C[C@@H](c1ccccc1Cl)N(C)Cc1ccccc1C#N	ZINC000058000627	330381615	/nfs/dbraw/zinc/38/16/15/330381615.db2.gz	JZWCANMZPGKUBG-ZDUSSCGKSA-N	0	0	284.790	4.405	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@H](C)c1ccccc1OC(F)F	ZINC000424575242	330385082	/nfs/dbraw/zinc/38/50/82/330385082.db2.gz	KUYCAXXOLIVMBS-LLVKDONJSA-N	0	0	297.345	4.068	20	30		CIEDRN
C=CCOc1ccc(CNc2cnn(CC(C)C)c2C)cc1	ZINC000537025877	330385565	/nfs/dbraw/zinc/38/55/65/330385565.db2.gz	MFWHHTNCMZGPPZ-UHFFFAOYSA-N	0	0	299.418	4.024	20	30		CIEDRN
CC[C@@H](NC(=O)Nc1cc(C#N)ccc1C)c1cccs1	ZINC000058451491	330388048	/nfs/dbraw/zinc/38/80/48/330388048.db2.gz	IBEYAFWBGJHGTQ-CYBMUJFWSA-N	0	0	299.399	4.201	20	30		CIEDRN
Cc1cc(NCc2cccc(OCCCC#N)c2)ccc1F	ZINC000089791988	330388074	/nfs/dbraw/zinc/38/80/74/330388074.db2.gz	ZARUOJLICQEZPU-UHFFFAOYSA-N	0	0	298.361	4.429	20	30		CIEDRN
N#Cc1cnc(Oc2ccc(Cl)c(F)c2)c(Cl)c1	ZINC000120630460	330389669	/nfs/dbraw/zinc/38/96/69/330389669.db2.gz	WWWIUJIDBUUMCA-UHFFFAOYSA-N	0	0	283.089	4.191	20	30		CIEDRN
N#Cc1cccc(CSCc2cccc(F)c2)c1F	ZINC000537046642	330394357	/nfs/dbraw/zinc/39/43/57/330394357.db2.gz	YBBGPTBQQCBLDG-UHFFFAOYSA-N	0	0	275.323	4.270	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1cc(C#N)ccc1C)c1ccccc1	ZINC000121230479	330397974	/nfs/dbraw/zinc/39/79/74/330397974.db2.gz	FGCXFCOOQRTEIX-INIZCTEOSA-N	0	0	290.366	4.165	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1c(C)cc(C)nc1C)c1ccccc1	ZINC000121374996	330399643	/nfs/dbraw/zinc/39/96/43/330399643.db2.gz	GUSFCGZODOMZLB-MRXNPFEDSA-N	0	0	294.398	4.305	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@H]1CCCC1(C)C)c1ccccc1	ZINC000121749895	330406285	/nfs/dbraw/zinc/40/62/85/330406285.db2.gz	LRUDBBYDFXHXDF-ZBFHGGJFSA-N	0	0	271.404	4.041	20	30		CIEDRN
C[C@@H](CCc1ccccc1)Nc1c(F)cc(C#N)cc1F	ZINC000060320103	330412500	/nfs/dbraw/zinc/41/25/00/330412500.db2.gz	QNBODXWOVVWYFM-LBPRGKRZSA-N	0	0	286.325	4.270	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N[C@@H](C)c1ccc(C)cc1	ZINC000537186391	330412941	/nfs/dbraw/zinc/41/29/41/330412941.db2.gz	SZRSVBYBAKIVHI-GJZGRUSLSA-N	0	0	274.408	4.100	20	30		CIEDRN
CC[C@@H](C#N)N[C@H](CCc1ccccc1)c1ccccc1	ZINC000122208590	330415775	/nfs/dbraw/zinc/41/57/75/330415775.db2.gz	VUANKSJXOWEHOF-RBUKOAKNSA-N	0	0	278.399	4.252	20	30		CIEDRN
Cc1cc(C#N)ccc1C(=O)N1CCCC2(CCCCC2)C1	ZINC000122468844	330422899	/nfs/dbraw/zinc/42/28/99/330422899.db2.gz	VLIZMQXZNZWSEX-UHFFFAOYSA-N	0	0	296.414	4.053	20	30		CIEDRN
C=C[C@H](CC(=O)N1CCC[C@H]1CC(C)C)c1ccccc1	ZINC000122880769	330428142	/nfs/dbraw/zinc/42/81/42/330428142.db2.gz	LGLAYEMINDKTGT-AEFFLSMTSA-N	0	0	285.431	4.383	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)C[C@@H](C)Cc1cccc(F)c1	ZINC000537226508	330429401	/nfs/dbraw/zinc/42/94/01/330429401.db2.gz	YPAFIDOIHHVABD-LSDHHAIUSA-N	0	0	291.410	4.255	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1	ZINC000537229192	330429503	/nfs/dbraw/zinc/42/95/03/330429503.db2.gz	GFODUQNBHTWTCG-RWMBFGLXSA-N	0	0	291.357	4.216	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)C[C@H](C)c1ccc(F)cc1F	ZINC000537228096	330429509	/nfs/dbraw/zinc/42/95/09/330429509.db2.gz	BHJUVADZSXQWKY-QWHCGFSZSA-N	0	0	295.373	4.319	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)C[C@H](C)c1ccc(F)cc1F	ZINC000537228098	330429512	/nfs/dbraw/zinc/42/95/12/330429512.db2.gz	BHJUVADZSXQWKY-STQMWFEESA-N	0	0	295.373	4.319	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1occc1-c1ccccc1	ZINC000537228154	330429541	/nfs/dbraw/zinc/42/95/41/330429541.db2.gz	BMCIXWULOSUBKX-CQSZACIVSA-N	0	0	283.371	4.421	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N[C@@H](c1cccs1)C1CC1	ZINC000537251985	330430623	/nfs/dbraw/zinc/43/06/23/330430623.db2.gz	CICIAVLUQCULQU-SWLSCSKDSA-N	0	0	292.448	4.243	20	30		CIEDRN
Cc1ccc(C#N)cc1OCc1coc(-c2cccs2)n1	ZINC000122963900	330435745	/nfs/dbraw/zinc/43/57/45/330435745.db2.gz	DKCDMYJEAIWUEV-UHFFFAOYSA-N	0	0	296.351	4.162	20	30		CIEDRN
CCOCc1ccc(N[C@H](C)c2cccc(C#N)c2)cc1	ZINC000537450905	330437485	/nfs/dbraw/zinc/43/74/85/330437485.db2.gz	VCIZSGCYJRNLBZ-CQSZACIVSA-N	0	0	280.371	4.268	20	30		CIEDRN
CCc1ccc(CSc2cccc(Cl)c2C#N)nc1	ZINC000515177869	330472397	/nfs/dbraw/zinc/47/23/97/330472397.db2.gz	WVOFPLOPGMQFBQ-UHFFFAOYSA-N	0	0	288.803	4.461	20	30		CIEDRN
C=CCn1c(C)nnc1SC[C@@H](CC)CCCC	ZINC000515289181	330474049	/nfs/dbraw/zinc/47/40/49/330474049.db2.gz	NCJNJRDCAWBRQY-ZDUSSCGKSA-N	0	0	267.442	4.081	20	30		CIEDRN
CC(C)(C#N)C(=O)Nc1ccc2oc3ccccc3c2c1	ZINC000515436612	330477278	/nfs/dbraw/zinc/47/72/78/330477278.db2.gz	YSYWTFNTTHUHJE-UHFFFAOYSA-N	0	0	278.311	4.074	20	30		CIEDRN
C[C@@H]1CCC[C@@H](CC(=O)N[C@@](C)(C#N)C2CCCCC2)C1	ZINC000515482746	330478309	/nfs/dbraw/zinc/47/83/09/330478309.db2.gz	PQOTUPADQLEQPF-RKVPGOIHSA-N	0	0	290.451	4.182	20	30		CIEDRN
COc1cccc(Cl)c1CN(CCC#N)CC(C)(C)C	ZINC000516666835	330483487	/nfs/dbraw/zinc/48/34/87/330483487.db2.gz	GQCVMJSNHKYLAT-UHFFFAOYSA-N	0	0	294.826	4.110	20	30		CIEDRN
N#Cc1csc(C(=O)Nc2cc(Cl)cc(Cl)c2)c1	ZINC000084058252	330483673	/nfs/dbraw/zinc/48/36/73/330483673.db2.gz	FFZGTECDHQOMMI-UHFFFAOYSA-N	0	0	297.166	4.179	20	30		CIEDRN
CCS[C@@H]1CCCC[C@H]1Nc1ncc(C#N)cc1Cl	ZINC000426355836	330505439	/nfs/dbraw/zinc/50/54/39/330505439.db2.gz	DRGRHLGZVRLNFI-CHWSQXEVSA-N	0	0	295.839	4.083	20	30		CIEDRN
C=CCC(C)(C)c1nc(-c2cccc(C)c2F)no1	ZINC000426593514	330512834	/nfs/dbraw/zinc/51/28/34/330512834.db2.gz	OPBXRFLCZIKJQX-UHFFFAOYSA-N	0	0	260.312	4.038	20	30		CIEDRN
C=CCC(C)(C)c1nc(-c2cccc3ncccc32)no1	ZINC000426604035	330512989	/nfs/dbraw/zinc/51/29/89/330512989.db2.gz	SDARKZUCCMDNRG-UHFFFAOYSA-N	0	0	279.343	4.139	20	30		CIEDRN
Cc1c(Cl)cc(NC(=O)c2ccc(C#N)o2)cc1Cl	ZINC000428203984	330515824	/nfs/dbraw/zinc/51/58/24/330515824.db2.gz	ZPXZLZSBRQRQIS-UHFFFAOYSA-N	0	0	295.125	4.019	20	30		CIEDRN
C=CCC[C@@H](C(=O)N1CC2(C1)CCCC2)c1ccccc1	ZINC000428451184	330524097	/nfs/dbraw/zinc/52/40/97/330524097.db2.gz	YYPYIKDURCIKMD-QGZVFWFLSA-N	0	0	283.415	4.139	20	30		CIEDRN
C=C(C)CNC(=O)Nc1ccc2nc(C(C)C)sc2c1	ZINC000429361205	330544477	/nfs/dbraw/zinc/54/44/77/330544477.db2.gz	DGSUWYLAIBUSPG-UHFFFAOYSA-N	0	0	289.404	4.117	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000429837209	330555581	/nfs/dbraw/zinc/55/55/81/330555581.db2.gz	BOJBRZXTNDWZLJ-LLVKDONJSA-N	0	0	299.336	4.485	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCc1ccc(Cl)cc1Cl	ZINC000429925049	330556502	/nfs/dbraw/zinc/55/65/02/330556502.db2.gz	NBJSGQNWYVQJIX-UHFFFAOYSA-N	0	0	286.202	4.212	20	30		CIEDRN
Cc1ccnc(N[C@H](CCCC#N)c2ccccc2)c1C#N	ZINC000431495569	330585577	/nfs/dbraw/zinc/58/55/77/330585577.db2.gz	PGBCTZLSADVTKU-QGZVFWFLSA-N	0	0	290.370	4.109	20	30		CIEDRN
CC(C)c1cc(N[C@@H](CCCC#N)c2ccccc2)ncn1	ZINC000431496047	330585606	/nfs/dbraw/zinc/58/56/06/330585606.db2.gz	QZNDGRQOHQFXIE-INIZCTEOSA-N	0	0	294.402	4.447	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)N1C[C@H](C)c2ccccc21	ZINC000431709795	330588167	/nfs/dbraw/zinc/58/81/67/330588167.db2.gz	HHKZBSACIFYAAU-LBPRGKRZSA-N	0	0	291.354	4.022	20	30		CIEDRN
CCc1cc(Cl)c(Cl)cc1OC[C@@H](C#N)CCC#N	ZINC000432249593	330595929	/nfs/dbraw/zinc/59/59/29/330595929.db2.gz	GJZLAZSPWOKNNZ-SNVBAGLBSA-N	0	0	297.185	4.378	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)c1sccc1C(C)C	ZINC000432336176	330597567	/nfs/dbraw/zinc/59/75/67/330597567.db2.gz	OMXLDNYHGPALRY-UHFFFAOYSA-N	0	0	284.384	4.304	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)C1CCC(C(C)C)CC1	ZINC000432542153	330600235	/nfs/dbraw/zinc/60/02/35/330600235.db2.gz	NEBQJJZETFXWSQ-QQFBHYJXSA-N	0	0	265.441	4.262	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1C[C@H]1C1CC1	ZINC000432588700	330601458	/nfs/dbraw/zinc/60/14/58/330601458.db2.gz	QJBLQSKNVKTJRK-DLBZAZTESA-N	0	0	298.430	4.459	20	30		CIEDRN
CCC1(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)CCC1	ZINC000434116726	330635501	/nfs/dbraw/zinc/63/55/01/330635501.db2.gz	XXHDBWFDLKWPRV-UHFFFAOYSA-N	0	0	296.292	4.096	20	30		CIEDRN
C=CCC[C@@H](NC(=O)N1CC[C@H](CC)C1)c1ccccc1	ZINC000435102462	330649335	/nfs/dbraw/zinc/64/93/35/330649335.db2.gz	HUOPSHWAYNOXFB-DOTOQJQBSA-N	0	0	286.419	4.135	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)NCC(C)(C)CC(C)C	ZINC000435127185	330649818	/nfs/dbraw/zinc/64/98/18/330649818.db2.gz	VEPSYAJBISFSBX-UHFFFAOYSA-N	0	0	287.407	4.061	20	30		CIEDRN
C=CCC[C@H](NC(=O)[C@@H](C)C(C)C)c1ccccc1	ZINC000435289029	330652505	/nfs/dbraw/zinc/65/25/05/330652505.db2.gz	MVTDJKNVWIFFRL-HOCLYGCPSA-N	0	0	259.393	4.102	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@@H]1C[C@H]1c1ccccc1)c1ccccc1	ZINC000435337655	330653043	/nfs/dbraw/zinc/65/30/43/330653043.db2.gz	XPZXRFQCNLRHKZ-GBESFXJTSA-N	0	0	291.394	4.019	20	30		CIEDRN
CC(C)(C#N)CCCC[S@](=O)C1CCC(C)(C)CC1	ZINC000435428178	330654865	/nfs/dbraw/zinc/65/48/65/330654865.db2.gz	PGUXGAJTQVGXLD-IBGZPJMESA-N	0	0	283.481	4.424	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)Nc2cccc(F)c2)CCCC1(C)C	ZINC000435680093	330660138	/nfs/dbraw/zinc/66/01/38/330660138.db2.gz	BTRNNNAKTLQDEA-HNNXBMFYSA-N	0	0	290.382	4.424	20	30		CIEDRN
CC(C)(C#N)CCCCSCCOCC(F)(F)F	ZINC000435890726	330664772	/nfs/dbraw/zinc/66/47/72/330664772.db2.gz	AEHIRGFVUHYFNH-UHFFFAOYSA-N	0	0	283.359	4.019	20	30		CIEDRN
CCN(C(=O)c1cccc(C#N)c1C)c1cccc(C)c1C	ZINC000510489043	332905153	/nfs/dbraw/zinc/90/51/53/332905153.db2.gz	DCGPGKVNXIYZFM-UHFFFAOYSA-N	0	0	292.382	4.150	20	30		CIEDRN
CC1(c2ccccc2)CC(Nc2ccc(CC#N)cc2)C1	ZINC000436471689	330678089	/nfs/dbraw/zinc/67/80/89/330678089.db2.gz	QZJILBUZFZCHGK-UHFFFAOYSA-N	0	0	276.383	4.285	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1ccc2ccccc2c1O	ZINC000436532133	330679284	/nfs/dbraw/zinc/67/92/84/330679284.db2.gz	VKVVIXLNOAVADE-UHFFFAOYSA-N	0	0	297.398	4.364	20	30		CIEDRN
C=CCC[C@@H](CC)Nc1ccc(C(=O)N(CC)CC)cc1	ZINC000437116846	330694213	/nfs/dbraw/zinc/69/42/13/330694213.db2.gz	MPTGQIRTOFCYPW-MRXNPFEDSA-N	0	0	288.435	4.325	20	30		CIEDRN
C=CC[C@@H](C)[C@@H](C)Nc1cc(NC(=O)N(C)C)ccc1C	ZINC000437344066	330697900	/nfs/dbraw/zinc/69/79/00/330697900.db2.gz	IBAYAEAVMJINCG-TZMCWYRMSA-N	0	0	289.423	4.101	20	30		CIEDRN
C=CC(C)(C)C(=O)N(C)Cc1ccc2ccccc2c1	ZINC000448588641	330699754	/nfs/dbraw/zinc/69/97/54/330699754.db2.gz	WOHKQKZRKWZXRO-UHFFFAOYSA-N	0	0	267.372	4.010	20	30		CIEDRN
COc1ccc(C#N)cc1N[C@@H]1CCC[C@@H](C(F)(F)F)C1	ZINC000437805862	330709221	/nfs/dbraw/zinc/70/92/21/330709221.db2.gz	XUQLESQAJJPLAQ-VXGBXAGGSA-N	0	0	298.308	4.100	20	30		CIEDRN
CCCN(CC#N)Cc1ccc(Oc2ccccc2)c(F)c1	ZINC000438027057	330713805	/nfs/dbraw/zinc/71/38/05/330713805.db2.gz	OFQAHGPSLAXSCV-UHFFFAOYSA-N	0	0	298.361	4.354	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Nc1ccc2ccn(C)c2c1	ZINC000438458636	330725059	/nfs/dbraw/zinc/72/50/59/330725059.db2.gz	KJNSTGPUBSALQU-UHFFFAOYSA-N	0	0	299.418	4.388	20	30		CIEDRN
N#Cc1ccc(Oc2ccc(Cl)c(F)c2)cc1[N+](=O)[O-]	ZINC000156269194	330728411	/nfs/dbraw/zinc/72/84/11/330728411.db2.gz	AOKKTZPSGPDEIY-UHFFFAOYSA-N	0	0	292.653	4.051	20	30		CIEDRN
C=CCOc1ccc(C(=O)N2CCCC3(CCCC3)C2)cc1	ZINC000438693677	330728690	/nfs/dbraw/zinc/72/86/90/330728690.db2.gz	URANLSBETBPQBG-UHFFFAOYSA-N	0	0	299.414	4.048	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1cc(CC)ccc1CC	ZINC000438852129	330730019	/nfs/dbraw/zinc/73/00/19/330730019.db2.gz	AQKPXMNVULCIPY-UHFFFAOYSA-N	0	0	274.408	4.241	20	30		CIEDRN
N#Cc1cccc(C(=O)CSc2ccc(Cl)cc2)c1	ZINC000439041096	330732877	/nfs/dbraw/zinc/73/28/77/330732877.db2.gz	POCJHLAFOLOCBI-UHFFFAOYSA-N	0	0	287.771	4.187	20	30		CIEDRN
N#Cc1ccc(/C=C\c2cccc(-c3ccccn3)c2)nc1	ZINC000439152724	330734782	/nfs/dbraw/zinc/73/47/82/330734782.db2.gz	KLDIRAFNDQCDMB-CLFYSBASSA-N	0	0	283.334	4.186	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1cccc(SCC)c1	ZINC000439530965	330740018	/nfs/dbraw/zinc/74/00/18/330740018.db2.gz	VEXIDFMJHGWNKU-GFCCVEGCSA-N	0	0	278.421	4.275	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1cccc(CSCC)c1	ZINC000439592171	330740884	/nfs/dbraw/zinc/74/08/84/330740884.db2.gz	URJOXYLOCWEGJR-AWEZNQCLSA-N	0	0	292.448	4.416	20	30		CIEDRN
C=CCCCN(C)C(=O)[C@@H](C)c1ccc2ccccc2c1	ZINC000439739196	330742495	/nfs/dbraw/zinc/74/24/95/330742495.db2.gz	MQJUIBQLSQBLIV-HNNXBMFYSA-N	0	0	281.399	4.368	20	30		CIEDRN
C=C(C)CN(CC)C(=O)[C@H](C)c1ccc2ccccc2c1	ZINC000439787204	330743134	/nfs/dbraw/zinc/74/31/34/330743134.db2.gz	FQEQTBQNFKGPOB-OAHLLOKOSA-N	0	0	281.399	4.368	20	30		CIEDRN
C[C@@H](CCC(=O)Nc1ccc(F)c(C#N)c1)c1ccccc1	ZINC000440773160	330755912	/nfs/dbraw/zinc/75/59/12/330755912.db2.gz	SWPVPJKHFMIXOA-ZDUSSCGKSA-N	0	0	296.345	4.220	20	30		CIEDRN
C=CCC[C@@H](NC(=O)CC)c1ccc(C(F)(F)F)cc1	ZINC000441543550	330770536	/nfs/dbraw/zinc/77/05/36/330770536.db2.gz	REWZHQUEQULOEZ-CYBMUJFWSA-N	0	0	285.309	4.239	20	30		CIEDRN
CC[C@@H](F)CSCc1ccc(Cl)cc1C#N	ZINC000442560876	330777062	/nfs/dbraw/zinc/77/70/62/330777062.db2.gz	YHXSZKJZVYDLPX-GFCCVEGCSA-N	0	0	257.761	4.193	20	30		CIEDRN
Cc1csc(-c2ccc(N[C@@H]3CC[C@H](C#N)C3)cc2)n1	ZINC000442859018	330787754	/nfs/dbraw/zinc/78/77/54/330787754.db2.gz	PUROYUMGAAXBNB-SWLSCSKDSA-N	0	0	283.400	4.223	20	30		CIEDRN
Cc1nc2cc(Cl)c(N[C@H]3CC[C@H](C#N)C3)cc2s1	ZINC000442863605	330788219	/nfs/dbraw/zinc/78/82/19/330788219.db2.gz	DDXPMRUEPMMBCP-UWVGGRQHSA-N	0	0	291.807	4.362	20	30		CIEDRN
Cc1ccc(N[C@H]2CC[C@H](C#N)C2)c(OCC(F)(F)F)c1	ZINC000442872085	330789256	/nfs/dbraw/zinc/78/92/56/330789256.db2.gz	NCHFGZXNJKTWAI-RYUDHWBXSA-N	0	0	298.308	4.040	20	30		CIEDRN
C[C@H](Oc1ccc(Cl)cc1F)c1cccc(C#N)c1	ZINC000442902099	330791382	/nfs/dbraw/zinc/79/13/82/330791382.db2.gz	MIGGTZDTELLRNU-JTQLQIEISA-N	0	0	275.710	4.491	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CCC(CC)(CC)CC1	ZINC000442934505	330791710	/nfs/dbraw/zinc/79/17/10/330791710.db2.gz	IIJLWUPRUPOWIO-OAHLLOKOSA-N	0	0	251.414	4.018	20	30		CIEDRN
CCc1ccc(NCc2cc(C#N)ccc2F)cc1F	ZINC000443456868	330799890	/nfs/dbraw/zinc/79/98/90/330799890.db2.gz	XFIVMRVWJRCZRW-UHFFFAOYSA-N	0	0	272.298	4.011	20	30		CIEDRN
CC(C)(C#N)CCCOc1ccccc1OC(F)(F)F	ZINC000157836947	330806206	/nfs/dbraw/zinc/80/62/06/330806206.db2.gz	OJLOVDXQHSSRCS-UHFFFAOYSA-N	0	0	287.281	4.294	20	30		CIEDRN
Cc1sc(CNCc2ccc(C#N)c(C)c2)nc1C(C)C	ZINC000443990490	330808546	/nfs/dbraw/zinc/80/85/46/330808546.db2.gz	RAEAHAFZWLLWJZ-UHFFFAOYSA-N	0	0	299.443	4.045	20	30		CIEDRN
Cc1cc(CNc2cccc(C(F)F)c2)ccc1C#N	ZINC000443993018	330808756	/nfs/dbraw/zinc/80/87/56/330808756.db2.gz	IAVKQGFBJDLOAB-UHFFFAOYSA-N	0	0	272.298	4.416	20	30		CIEDRN
C=CCCC(=O)N(Cc1ccccc1)c1ccccc1C#N	ZINC000572500979	330814183	/nfs/dbraw/zinc/81/41/83/330814183.db2.gz	WTOXSCCBDXHKQB-UHFFFAOYSA-N	0	0	290.366	4.058	20	30		CIEDRN
CC(C)(C#N)CCCCN1CCCc2cc(F)ccc21	ZINC000444635027	330815838	/nfs/dbraw/zinc/81/58/38/330815838.db2.gz	CHYMPEPJDWRFHW-UHFFFAOYSA-N	0	0	274.383	4.298	20	30		CIEDRN
C=CCCO[C@H](C)c1nc(-c2oc3ccccc3c2C)no1	ZINC000445507492	330830308	/nfs/dbraw/zinc/83/03/08/330830308.db2.gz	YWVVGJYBBLKQEO-GFCCVEGCSA-N	0	0	298.342	4.445	20	30		CIEDRN
N#CC1(c2nc(-c3coc4ccccc34)no2)CCCCC1	ZINC000445576286	330831777	/nfs/dbraw/zinc/83/17/77/330831777.db2.gz	WASQZVBYEYFUCX-UHFFFAOYSA-N	0	0	293.326	4.208	20	30		CIEDRN
N#Cc1ccc(SCc2cc(F)cc(F)c2)c(F)c1	ZINC000445610286	330832870	/nfs/dbraw/zinc/83/28/70/330832870.db2.gz	YYVFTVIFISBNSY-UHFFFAOYSA-N	0	0	279.286	4.268	20	30		CIEDRN
N#Cc1ccc(NCc2cc(F)cc(C(F)(F)F)c2)cc1	ZINC000159191195	330844685	/nfs/dbraw/zinc/84/46/85/330844685.db2.gz	XRVBGDZYWLFTHV-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
N#Cc1csc(CNc2cc(F)cc(Cl)c2)c1	ZINC000159336351	330846157	/nfs/dbraw/zinc/84/61/57/330846157.db2.gz	ATOATVONUIKDOS-UHFFFAOYSA-N	0	0	266.728	4.024	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1cc(C)c(OC)cc1C	ZINC000446355737	330848024	/nfs/dbraw/zinc/84/80/24/330848024.db2.gz	SIYDEANFASHZII-AWEZNQCLSA-N	0	0	290.407	4.178	20	30		CIEDRN
C=CCCC(=O)N[C@H](c1ccccc1F)C1CCCC1	ZINC000446432278	330848759	/nfs/dbraw/zinc/84/87/59/330848759.db2.gz	VHIVBFBZDYIIIO-KRWDZBQOSA-N	0	0	275.367	4.139	20	30		CIEDRN
Cc1ccc(NCc2cn3ccccc3c2C#N)c(C)c1	ZINC000446620603	330851086	/nfs/dbraw/zinc/85/10/86/330851086.db2.gz	QTPVVQDHFCYOLG-UHFFFAOYSA-N	0	0	275.355	4.040	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](c1ccccc1)c1cccc(F)c1	ZINC000446649110	330851215	/nfs/dbraw/zinc/85/12/15/330851215.db2.gz	OYCMUUNNFIBQBX-IBGZPJMESA-N	0	0	297.373	4.388	20	30		CIEDRN
Cc1ccc2[nH]c(CN3CCCC(C)(C)[C@H]3C#N)cc2c1C	ZINC000446978535	330859464	/nfs/dbraw/zinc/85/94/64/330859464.db2.gz	YARUSAZXUCBYSU-GOSISDBHSA-N	0	0	295.430	4.299	20	30		CIEDRN
C=CCC[C@H](C)Nc1ccc(SC)cc1OC	ZINC000447076284	330860761	/nfs/dbraw/zinc/86/07/61/330860761.db2.gz	JKNICVQGNGPCNO-NSHDSACASA-N	0	0	251.395	4.184	20	30		CIEDRN
C=CCCCCCSc1nc(C)nc(C)c1C(C)=O	ZINC000447300997	330863948	/nfs/dbraw/zinc/86/39/48/330863948.db2.gz	GDNVITUTJPOSPS-UHFFFAOYSA-N	0	0	278.421	4.135	20	30		CIEDRN
COCC[C@@H](C)Sc1nc(-c2ccccc2)ccc1C#N	ZINC000447349440	330865407	/nfs/dbraw/zinc/86/54/07/330865407.db2.gz	FRMNTNJRJVFUIK-CYBMUJFWSA-N	0	0	298.411	4.137	20	30		CIEDRN
COCC[C@H](C)Oc1ccc(-c2ccc(C#N)cc2)cc1	ZINC000447356386	330865513	/nfs/dbraw/zinc/86/55/13/330865513.db2.gz	VBFKFVXWSKNNIC-AWEZNQCLSA-N	0	0	281.355	4.029	20	30		CIEDRN
COc1cc(SC)ccc1N[C@@H](C#N)C1CCCCC1	ZINC000194525010	330867205	/nfs/dbraw/zinc/86/72/05/330867205.db2.gz	QHYWTBBWOFYCHG-HNNXBMFYSA-N	0	0	290.432	4.301	20	30		CIEDRN
CC[C@H](N[C@@H](C)c1nc(C)cs1)c1ccc(C#N)cc1	ZINC000447539979	330868940	/nfs/dbraw/zinc/86/89/40/330868940.db2.gz	BIDRGNYMYHOSBV-WFASDCNBSA-N	0	0	285.416	4.125	20	30		CIEDRN
CC[C@@H](Nc1cc(C)ccc1OC)c1ccc(C#N)cc1	ZINC000447602790	330873216	/nfs/dbraw/zinc/87/32/16/330873216.db2.gz	UHPIYLNWKKSKSR-MRXNPFEDSA-N	0	0	280.371	4.439	20	30		CIEDRN
C=CCCCNC(=O)Nc1ccc(F)cc1OC(C)(C)C	ZINC000448002695	330882586	/nfs/dbraw/zinc/88/25/86/330882586.db2.gz	YPYJWPUSDVMLMC-UHFFFAOYSA-N	0	0	294.370	4.091	20	30		CIEDRN
C=CCC1(C(=O)N[C@H]2CCc3c2cccc3O)CCCCC1	ZINC000448981981	330890196	/nfs/dbraw/zinc/89/01/96/330890196.db2.gz	IZHQMMRZFNEFOT-INIZCTEOSA-N	0	0	299.414	4.022	20	30		CIEDRN
CC1(C#N)CCC(Nc2cc(F)ccc2OC(F)F)CC1	ZINC000449056775	330895927	/nfs/dbraw/zinc/89/59/27/330895927.db2.gz	SMBHZFBVXHSAJW-UHFFFAOYSA-N	0	0	298.308	4.311	20	30		CIEDRN
Cc1c(NC2CCC(C)(C#N)CC2)cnn1CCC(C)C	ZINC000449245864	330909443	/nfs/dbraw/zinc/90/94/43/330909443.db2.gz	CKJWSMPEOJACBS-UHFFFAOYSA-N	0	0	288.439	4.122	20	30		CIEDRN
CC1(C#N)CCC(Nc2ccc3ccoc3c2)CC1	ZINC000449268006	330911043	/nfs/dbraw/zinc/91/10/43/330911043.db2.gz	CUSYHMHGBYOCHG-UHFFFAOYSA-N	0	0	254.333	4.317	20	30		CIEDRN
CCSCc1ccc(NCc2ccc(C#N)o2)cc1	ZINC000449599699	330938750	/nfs/dbraw/zinc/93/87/50/330938750.db2.gz	HNYXIVUMJQRCPQ-UHFFFAOYSA-N	0	0	272.373	4.016	20	30		CIEDRN
CCSCc1ccc(N[C@@H]2CC[C@@H](C#N)C2)cc1	ZINC000449597903	330938766	/nfs/dbraw/zinc/93/87/66/330938766.db2.gz	GWYNBJKJMIDRTA-UKRRQHHQSA-N	0	0	260.406	4.044	20	30		CIEDRN
N#CC1(CN2Cc3ccccc3-c3ccccc3C2)CCC1	ZINC000450342487	330973722	/nfs/dbraw/zinc/97/37/22/330973722.db2.gz	SEIGGGONEKJDDQ-UHFFFAOYSA-N	0	0	288.394	4.363	20	30		CIEDRN
C=C(C)CN(C)C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000450472399	330982316	/nfs/dbraw/zinc/98/23/16/330982316.db2.gz	XMRXGAMKFWYHLQ-TZMCWYRMSA-N	0	0	295.785	4.007	20	30		CIEDRN
N#C[C@@H]1CC[C@@H](Sc2nc3ccc(Cl)cc3o2)C1	ZINC000450589635	330988116	/nfs/dbraw/zinc/98/81/16/330988116.db2.gz	DMFJCHGAVRYWJL-PSASIEDQSA-N	0	0	278.764	4.266	20	30		CIEDRN
C=CCn1c(SCCC2=CCCCC2)nnc1C1CC1	ZINC000450654083	330991408	/nfs/dbraw/zinc/99/14/08/330991408.db2.gz	UVNHFESOCGVKKR-UHFFFAOYSA-N	0	0	289.448	4.324	20	30		CIEDRN
CC(C)COc1ccc([C@@H](C)NCC2(C#N)CCC2)cc1	ZINC000450679900	330993209	/nfs/dbraw/zinc/99/32/09/330993209.db2.gz	KIWOKHUWVFDBIJ-OAHLLOKOSA-N	0	0	286.419	4.066	20	30		CIEDRN
CC(C)(CC(=O)CSc1ccc(C#N)cc1)C1CC1	ZINC000450813613	331000744	/nfs/dbraw/zinc/00/07/44/331000744.db2.gz	WPMUOXVRFOEDII-UHFFFAOYSA-N	0	0	273.401	4.046	20	30		CIEDRN
CC(C)(C)c1cc(CSc2ccc(C#N)cc2F)no1	ZINC000450850435	331002862	/nfs/dbraw/zinc/00/28/62/331002862.db2.gz	XITADBJRVWGWEX-UHFFFAOYSA-N	0	0	290.363	4.275	20	30		CIEDRN
N#Cc1ccccc1SC[C@@H]1CCC(F)(F)C1	ZINC000450860243	331003360	/nfs/dbraw/zinc/00/33/60/331003360.db2.gz	NAKDLTFCINTUKG-SNVBAGLBSA-N	0	0	253.317	4.086	20	30		CIEDRN
Cc1ccccc1[C@H](CC(F)(F)F)NCC1(C#N)CCC1	ZINC000450860987	331003544	/nfs/dbraw/zinc/00/35/44/331003544.db2.gz	DGSMFFXXOCTFOU-AWEZNQCLSA-N	0	0	296.336	4.272	20	30		CIEDRN
C[C@H]1CCC(=O)[C@H](Sc2ccc(C#N)cc2Cl)C1	ZINC000450871552	331003987	/nfs/dbraw/zinc/00/39/87/331003987.db2.gz	RFDSKGLODURRCK-LKFCYVNXSA-N	0	0	279.792	4.061	20	30		CIEDRN
Cc1nc(C(C)C)oc1COc1cc(Cl)ccc1C#N	ZINC000450872841	331003997	/nfs/dbraw/zinc/00/39/97/331003997.db2.gz	OVZQWYGZYBZELQ-UHFFFAOYSA-N	0	0	290.750	4.211	20	30		CIEDRN
C[C@@H]1CCC(=O)[C@@H](Sc2cccc(Cl)c2C#N)C1	ZINC000450899827	331005808	/nfs/dbraw/zinc/00/58/08/331005808.db2.gz	DVDRLALLDQPVEM-OTYXRUKQSA-N	0	0	279.792	4.061	20	30		CIEDRN
N#C[C@@H]1CC[C@H](SCc2ccccc2Cl)C1	ZINC000450912325	331006776	/nfs/dbraw/zinc/00/67/76/331006776.db2.gz	GSSHWKFIVPJBPI-PWSUYJOCSA-N	0	0	251.782	4.265	20	30		CIEDRN
COc1ccc(CSCC2(C#N)CCC2)cc1Cl	ZINC000450915002	331007035	/nfs/dbraw/zinc/00/70/35/331007035.db2.gz	ONTRMLMPYAWCFG-UHFFFAOYSA-N	0	0	281.808	4.276	20	30		CIEDRN
Cc1ccnc(N2CCC[C@H]2c2ccc(F)cc2C)c1C#N	ZINC000450916453	331007143	/nfs/dbraw/zinc/00/71/43/331007143.db2.gz	VOPBKDZFTTWXTH-KRWDZBQOSA-N	0	0	295.361	4.051	20	30		CIEDRN
CSc1ccc(CSCC2(C#N)CCC2)cc1	ZINC000450938837	331008146	/nfs/dbraw/zinc/00/81/46/331008146.db2.gz	KAVTZWWCNRZPRT-UHFFFAOYSA-N	0	0	263.431	4.336	20	30		CIEDRN
C=CCN(CCC#N)Cc1ccc([C@H](C)C(F)(F)F)cc1	ZINC000451061964	331014269	/nfs/dbraw/zinc/01/42/69/331014269.db2.gz	RQIKQDFZACPFLR-ZDUSSCGKSA-N	0	0	296.336	4.254	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1Cl	ZINC000451248194	331021761	/nfs/dbraw/zinc/02/17/61/331021761.db2.gz	NSKHEFNIILEQIF-AEGPPILISA-N	0	0	289.806	4.011	20	30		CIEDRN
C=CCC1(C(=O)N2CCSC(C)(C)CC2)CCCCC1	ZINC000451285540	331023144	/nfs/dbraw/zinc/02/31/44/331023144.db2.gz	NLTISEBPBJQYOY-UHFFFAOYSA-N	0	0	295.492	4.257	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCO[C@H]1C=C	ZINC000451339163	331024949	/nfs/dbraw/zinc/02/49/49/331024949.db2.gz	ZQDIWXQEZNAOFV-SJORKVTESA-N	0	0	299.414	4.068	20	30		CIEDRN
C=CCC1(C(=O)NC[C@@H]2CCC(F)(F)C2)CCCCC1	ZINC000451385882	331026763	/nfs/dbraw/zinc/02/67/63/331026763.db2.gz	UGJBEUUBHWYKFQ-CYBMUJFWSA-N	0	0	285.378	4.065	20	30		CIEDRN
N#Cc1ccc(NCc2ccc(F)c(C(F)(F)F)c2)cc1	ZINC000163413890	331037032	/nfs/dbraw/zinc/03/70/32/331037032.db2.gz	GYBMJHNNAVCXRH-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000451627841	331037236	/nfs/dbraw/zinc/03/72/36/331037236.db2.gz	ZGUJVUDWYAXTCA-GVDBMIGSSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CC(C)(C)C(=O)Nc1cc(Cc2ccccn2)ccc1C	ZINC000451716050	331039980	/nfs/dbraw/zinc/03/99/80/331039980.db2.gz	YCSVVMCHFMGPJG-UHFFFAOYSA-N	0	0	294.398	4.132	20	30		CIEDRN
C=CCCCN1CCC[C@@H](C(F)(F)F)[C@H]1C(F)(F)F	ZINC000451834972	331044175	/nfs/dbraw/zinc/04/41/75/331044175.db2.gz	DMOZCGIDQAFRJC-ZJUUUORDSA-N	0	0	289.263	4.158	20	30		CIEDRN
C[C@@H](c1ccc(C#N)cc1)N1CC2(CCC2)[C@H]1c1ccco1	ZINC000451834302	331044278	/nfs/dbraw/zinc/04/42/78/331044278.db2.gz	IUXFNOMICIDRLH-KBXCAEBGSA-N	0	0	292.382	4.439	20	30		CIEDRN
CC(C)(CCC#N)CNC(=O)C1=C(c2ccccc2)CCC1	ZINC000452097937	331053972	/nfs/dbraw/zinc/05/39/72/331053972.db2.gz	FIHYRJDJVLTOIO-UHFFFAOYSA-N	0	0	296.414	4.070	20	30		CIEDRN
C=CCC1(C(=O)Nc2cc(F)cc(F)c2F)CCCC1	ZINC000452395909	331063898	/nfs/dbraw/zinc/06/38/98/331063898.db2.gz	XHGUJPFDBSCBKA-UHFFFAOYSA-N	0	0	283.293	4.179	20	30		CIEDRN
CC(C)C[C@@H](C(=O)N[C@H]1CC[C@@H](CC#N)C1)c1ccccc1	ZINC000452563091	331069179	/nfs/dbraw/zinc/06/91/79/331069179.db2.gz	SQBBYTRXNVVVJF-RYQLBKOJSA-N	0	0	298.430	4.015	20	30		CIEDRN
CC(C)C[C@H](C(=O)N[C@H]1CC[C@@H](CC#N)C1)c1ccccc1	ZINC000452563098	331069256	/nfs/dbraw/zinc/06/92/56/331069256.db2.gz	SQBBYTRXNVVVJF-SZMVWBNQSA-N	0	0	298.430	4.015	20	30		CIEDRN
CC(C)[C@@H](C)CC(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452639485	331070788	/nfs/dbraw/zinc/07/07/88/331070788.db2.gz	CCGDUFUQCUENLS-NSHDSACASA-N	0	0	278.783	4.027	20	30		CIEDRN
CCC(C)(C)CC(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452647477	331071006	/nfs/dbraw/zinc/07/10/06/331071006.db2.gz	RZZUFLIXTBJJRM-UHFFFAOYSA-N	0	0	278.783	4.171	20	30		CIEDRN
CC[C@@H]1CCC[C@H]1C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452653250	331071215	/nfs/dbraw/zinc/07/12/15/331071215.db2.gz	ZHVRQBHAMOKDSY-CHWSQXEVSA-N	0	0	290.794	4.171	20	30		CIEDRN
CC1(C)CCC[C@H]1C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452655662	331071234	/nfs/dbraw/zinc/07/12/34/331071234.db2.gz	SJARPZHYYGITGB-LBPRGKRZSA-N	0	0	290.794	4.171	20	30		CIEDRN
N#CCc1ccc(NC(=O)C[C@H]2C=CCCC2)c(Cl)c1	ZINC000452656781	331071287	/nfs/dbraw/zinc/07/12/87/331071287.db2.gz	UVRBSGBRBTYTHU-LBPRGKRZSA-N	0	0	288.778	4.091	20	30		CIEDRN
N#CCc1ccc(NC(=O)C[C@@H]2C=CCCC2)c(Cl)c1	ZINC000452656776	331071371	/nfs/dbraw/zinc/07/13/71/331071371.db2.gz	UVRBSGBRBTYTHU-GFCCVEGCSA-N	0	0	288.778	4.091	20	30		CIEDRN
C=C(C)CCNC(=O)[C@H](C)c1ccc2ccccc2c1	ZINC000452715065	331072755	/nfs/dbraw/zinc/07/27/55/331072755.db2.gz	BSPAQCRAXWCXPP-CQSZACIVSA-N	0	0	267.372	4.026	20	30		CIEDRN
C=C(C)CCNC(=O)[C@@H](CC)c1cccc(C(F)(F)F)c1	ZINC000452716399	331072924	/nfs/dbraw/zinc/07/29/24/331072924.db2.gz	HLXWMHRZVFGMQH-AWEZNQCLSA-N	0	0	299.336	4.281	20	30		CIEDRN
C=C(C)CCNC(=O)CCCc1cccc(C(F)(F)F)c1	ZINC000452717001	331073027	/nfs/dbraw/zinc/07/30/27/331073027.db2.gz	KHMVCZUSDNYDGN-UHFFFAOYSA-N	0	0	299.336	4.111	20	30		CIEDRN
C=C(C)CCNC(=O)[C@@H](C)c1ccc(Cl)c(Cl)c1	ZINC000452720465	331073698	/nfs/dbraw/zinc/07/36/98/331073698.db2.gz	XABBLDKCVUZTPL-JTQLQIEISA-N	0	0	286.202	4.179	20	30		CIEDRN
C=C(C)CCNC(=O)CCC[C@@H](C)c1cccc(OC)c1	ZINC000452720987	331073824	/nfs/dbraw/zinc/07/38/24/331073824.db2.gz	YREUODVNAWMDAE-OAHLLOKOSA-N	0	0	289.419	4.051	20	30		CIEDRN
C=CC(C)(C)CNC(=O)CC1CCC(C(F)(F)F)CC1	ZINC000452771818	331075533	/nfs/dbraw/zinc/07/55/33/331075533.db2.gz	BTNURRYYHBWULG-UHFFFAOYSA-N	0	0	291.357	4.074	20	30		CIEDRN
N#CC[C@@H](CC(=O)NCC1CCCCCC1)c1ccccc1	ZINC000452796638	331078131	/nfs/dbraw/zinc/07/81/31/331078131.db2.gz	SWAQGSJFDLXPSK-SFHVURJKSA-N	0	0	298.430	4.161	20	30		CIEDRN
C=CCCO[C@H](C)C(=O)Nc1cc(C)cc2ccccc21	ZINC000452839080	331079118	/nfs/dbraw/zinc/07/91/18/331079118.db2.gz	DKKJCZUYTUNUON-CQSZACIVSA-N	0	0	283.371	4.068	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1Cc2cccc(C)c2CC1(C)C	ZINC000452930901	331081087	/nfs/dbraw/zinc/08/10/87/331081087.db2.gz	HNCSEGVJZWKKMS-HNNXBMFYSA-N	0	0	285.431	4.261	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc(C(=O)C(C)C)cc1	ZINC000452931164	331081119	/nfs/dbraw/zinc/08/11/19/331081119.db2.gz	IASBEOAHRLESGR-UHFFFAOYSA-N	0	0	285.387	4.232	20	30		CIEDRN
CC(C)(Cc1ccc(C#N)cc1)c1nc(C2CCCC2)no1	ZINC000453070409	331086434	/nfs/dbraw/zinc/08/64/34/331086434.db2.gz	VKKSTSOGJVTWOD-UHFFFAOYSA-N	0	0	295.386	4.119	20	30		CIEDRN
Cc1cccc(CNc2ccccc2SCCC#N)n1	ZINC000453087195	331087825	/nfs/dbraw/zinc/08/78/25/331087825.db2.gz	MCDCIUHWVPTRJW-UHFFFAOYSA-N	0	0	283.400	4.008	20	30		CIEDRN
C=CCC1(c2nc(CCCOC(C)C)no2)CCCCC1	ZINC000453126152	331091867	/nfs/dbraw/zinc/09/18/67/331091867.db2.gz	HVTSTCYRQJICMH-UHFFFAOYSA-N	0	0	292.423	4.205	20	30		CIEDRN
CCc1nc(C(C)C)ccc1CNc1cccc(CC#N)c1	ZINC000453138025	331093094	/nfs/dbraw/zinc/09/30/94/331093094.db2.gz	DJJDYPBNHWWQQA-UHFFFAOYSA-N	0	0	293.414	4.446	20	30		CIEDRN
C=CCC1(c2nc([C@H]3CCO[C@@H](C)C3)no2)CCCCC1	ZINC000453145660	331094052	/nfs/dbraw/zinc/09/40/52/331094052.db2.gz	HWANNIVMWHYGIR-KBPBESRZSA-N	0	0	290.407	4.130	20	30		CIEDRN
CC(C)C(=O)c1ccc(NCCCC(C)(C)C#N)cc1	ZINC000453166988	331096251	/nfs/dbraw/zinc/09/62/51/331096251.db2.gz	WBZLXWVYNDUYKZ-UHFFFAOYSA-N	0	0	272.392	4.267	20	30		CIEDRN
C=CC(C)(C)c1nc(C2(OCCC)CCCCC2)no1	ZINC000453177427	331097517	/nfs/dbraw/zinc/09/75/17/331097517.db2.gz	GKXQNIRJOXLSNF-UHFFFAOYSA-N	0	0	278.396	4.119	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H]2C[C@H]2c2cccc(OC)c2)n1	ZINC000453192273	331099631	/nfs/dbraw/zinc/09/96/31/331099631.db2.gz	YWGXJSSFUHEVGG-LSDHHAIUSA-N	0	0	298.386	4.203	20	30		CIEDRN
C=CCCc1noc(CC2CCC(C(F)(F)F)CC2)n1	ZINC000453230872	331104414	/nfs/dbraw/zinc/10/44/14/331104414.db2.gz	IITOSQBRUWRCGE-UHFFFAOYSA-N	0	0	288.313	4.099	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc([C@@H](Cc2ccccc2)OC)no1	ZINC000453236096	331105139	/nfs/dbraw/zinc/10/51/39/331105139.db2.gz	UIIHAHZENXLRCQ-UKRRQHHQSA-N	0	0	286.375	4.070	20	30		CIEDRN
C=CCCc1noc([C@H](CC)Oc2cccc(C)c2)n1	ZINC000453241161	331106006	/nfs/dbraw/zinc/10/60/06/331106006.db2.gz	VPWBEAGDYDBAHN-AWEZNQCLSA-N	0	0	272.348	4.027	20	30		CIEDRN
C=CCCc1noc([C@H](C)c2cc3ccccc3o2)n1	ZINC000453241776	331106113	/nfs/dbraw/zinc/10/61/13/331106113.db2.gz	WFSHYLVEMRMKHK-LLVKDONJSA-N	0	0	268.316	4.086	20	30		CIEDRN
C=CCCc1noc(CSc2cc(C)ccc2C)n1	ZINC000453244461	331106760	/nfs/dbraw/zinc/10/67/60/331106760.db2.gz	DZQAXRXKEJUXEV-UHFFFAOYSA-N	0	0	274.389	4.097	20	30		CIEDRN
C=CCCc1noc([C@@H](C)Sc2ccccc2)n1	ZINC000453247775	331107149	/nfs/dbraw/zinc/10/71/49/331107149.db2.gz	OVJTTXVBOORUMB-LLVKDONJSA-N	0	0	260.362	4.042	20	30		CIEDRN
C=CCCc1noc([C@H]2C[C@@H]2c2cccc(Cl)c2)n1	ZINC000453247622	331107162	/nfs/dbraw/zinc/10/71/62/331107162.db2.gz	OBDGUPSLUHQYJG-OLZOCXBDSA-N	0	0	274.751	4.113	20	30		CIEDRN
C=CCC(CC=C)c1nc(-c2cccc([N+](=O)[O-])c2C)no1	ZINC000453262201	331108914	/nfs/dbraw/zinc/10/89/14/331108914.db2.gz	SNCPEFOHBZJNNO-UHFFFAOYSA-N	0	0	299.330	4.189	20	30		CIEDRN
N#C[C@@H]1CC[C@H](Nc2cc(Cl)cc(Br)c2)C1	ZINC000453407175	331129455	/nfs/dbraw/zinc/12/94/55/331129455.db2.gz	DIWNZASMTDJMDP-KCJUWKMLSA-N	0	0	299.599	4.207	20	30		CIEDRN
C=CCC[C@H](C)Nc1ccc2c(c1)CN(CC(F)(F)F)C2	ZINC000453621643	331137058	/nfs/dbraw/zinc/13/70/58/331137058.db2.gz	XLWJXIBFJUMNHI-LBPRGKRZSA-N	0	0	298.352	4.331	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)NCC2=CCCCC2)cc1	ZINC000454448887	331146356	/nfs/dbraw/zinc/14/63/56/331146356.db2.gz	OSXQPJRWHLWZDP-UHFFFAOYSA-N	0	0	297.402	4.110	20	30		CIEDRN
C[C@@H]1CC=C(C(=O)Nc2ccc(C(C)(C)C#N)cc2)CC1	ZINC000454626355	331150077	/nfs/dbraw/zinc/15/00/77/331150077.db2.gz	WDSLEHHXYOXWKG-CYBMUJFWSA-N	0	0	282.387	4.173	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N1CCC[C@@]1(C)CC(C)C	ZINC000454632587	331150188	/nfs/dbraw/zinc/15/01/88/331150188.db2.gz	AOOIWGMCXYRBTR-SFHVURJKSA-N	0	0	299.418	4.299	20	30		CIEDRN
C=C(CC)CNC(=O)Nc1ccc(C)c(-c2nc(C)co2)c1	ZINC000454977785	331158133	/nfs/dbraw/zinc/15/81/33/331158133.db2.gz	RLCPXLCJKXZUBI-UHFFFAOYSA-N	0	0	299.374	4.046	20	30		CIEDRN
C=C(C)CCNC(=O)Nc1cc(C(F)F)ccc1Cl	ZINC000454984345	331158173	/nfs/dbraw/zinc/15/81/73/331158173.db2.gz	BRMRYIJHNDXNKB-UHFFFAOYSA-N	0	0	288.725	4.365	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)Nc1ccc(-c2ncco2)cc1	ZINC000455038191	331159430	/nfs/dbraw/zinc/15/94/30/331159430.db2.gz	KJKCUUSAKWDWDB-UHFFFAOYSA-N	0	0	299.374	4.065	20	30		CIEDRN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)C1=CC[C@@H](C)CC1	ZINC000455167962	331162099	/nfs/dbraw/zinc/16/20/99/331162099.db2.gz	YXDIPTINYZBWQC-OAHLLOKOSA-N	0	0	296.414	4.042	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)Nc1cc2[nH]ccc2cc1C	ZINC000455228318	331162942	/nfs/dbraw/zinc/16/29/42/331162942.db2.gz	PAWOHWMBEKEUFD-UHFFFAOYSA-N	0	0	285.391	4.200	20	30		CIEDRN
C=C(CC)CNC(=O)Nc1c(C)c(C)ccc1Cl	ZINC000455267730	331163473	/nfs/dbraw/zinc/16/34/73/331163473.db2.gz	GLCSBUWMIKFGAA-UHFFFAOYSA-N	0	0	266.772	4.045	20	30		CIEDRN
C=C(C)CCNC(=O)N(C)[C@@H](C)c1cccc(Cl)c1	ZINC000455309111	331165265	/nfs/dbraw/zinc/16/52/65/331165265.db2.gz	KRJMABASRUTFLZ-LBPRGKRZSA-N	0	0	280.799	4.009	20	30		CIEDRN
C=C(C)CCNC(=O)N(C)[C@H](C)c1ccc(Cl)cc1	ZINC000455317325	331165907	/nfs/dbraw/zinc/16/59/07/331165907.db2.gz	XBALIKAJNPBXNS-GFCCVEGCSA-N	0	0	280.799	4.009	20	30		CIEDRN
C=CC(C)(C)CNC(=O)N(C)[C@H](C)c1cccc(Cl)c1	ZINC000455363499	331167126	/nfs/dbraw/zinc/16/71/26/331167126.db2.gz	HUAQODMIQIWYNE-GFCCVEGCSA-N	0	0	294.826	4.255	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CC[C@@H](CC2CC2)C1	ZINC000455378964	331167843	/nfs/dbraw/zinc/16/78/43/331167843.db2.gz	GSONKKSQPCJTMD-INIZCTEOSA-N	0	0	298.430	4.459	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)NCCCC(C)(F)F	ZINC000455387108	331168275	/nfs/dbraw/zinc/16/82/75/331168275.db2.gz	SEPIOHLNLPCRNM-UHFFFAOYSA-N	0	0	296.361	4.362	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N[C@H]1CC[C@@H](CC#N)C1	ZINC000455388964	331168428	/nfs/dbraw/zinc/16/84/28/331168428.db2.gz	VUILBIFMARCIFF-HOCLYGCPSA-N	0	0	297.402	4.009	20	30		CIEDRN
C=CCC1(NC(=O)Nc2c(C)ccnc2C)CCCCC1	ZINC000455448139	331170064	/nfs/dbraw/zinc/17/00/64/331170064.db2.gz	WNDQNCQKJZJDRQ-UHFFFAOYSA-N	0	0	287.407	4.099	20	30		CIEDRN
C=CCC1(CNC(=O)N(C)[C@H](C)c2ccco2)CCCC1	ZINC000455483197	331170822	/nfs/dbraw/zinc/17/08/22/331170822.db2.gz	UUEBLXURGXFMIN-CQSZACIVSA-N	0	0	290.407	4.119	20	30		CIEDRN
C=CCCCCCSc1nnc(C2CC2)n1CC=C	ZINC000195418317	331172903	/nfs/dbraw/zinc/17/29/03/331172903.db2.gz	DRGAMTUQAYOBHB-UHFFFAOYSA-N	0	0	277.437	4.180	20	30		CIEDRN
C=CCCCCCNc1cc(C[S@](C)=O)ccc1Cl	ZINC000195449241	331173698	/nfs/dbraw/zinc/17/36/98/331173698.db2.gz	GIMYBUOVMWRLMF-IBGZPJMESA-N	0	0	299.867	4.377	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Nc1cccc(C2CC2)n1	ZINC000455615918	331174030	/nfs/dbraw/zinc/17/40/30/331174030.db2.gz	HCYUENHCWQJCFH-UHFFFAOYSA-N	0	0	287.407	4.169	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1cc(C)c(C)cc1Cl	ZINC000455741195	331176767	/nfs/dbraw/zinc/17/67/67/331176767.db2.gz	FYWBQOXEQWCLFD-UHFFFAOYSA-N	0	0	280.799	4.387	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1ccc(CSCC)cc1	ZINC000455854025	331178896	/nfs/dbraw/zinc/17/88/96/331178896.db2.gz	GHOXKIILBAIEQO-LBPRGKRZSA-N	0	0	278.421	4.026	20	30		CIEDRN
CCC[C@@H](C)[C@@H]1CCCN1C(=O)Nc1cccc(CC#N)c1	ZINC000455899636	331179868	/nfs/dbraw/zinc/17/98/68/331179868.db2.gz	BAOKRPUUUZYGEP-PBHICJAKSA-N	0	0	299.418	4.185	20	30		CIEDRN
CC(C)CN(C(=O)Nc1cccc(CC#N)c1)C1CCCC1	ZINC000455910719	331180640	/nfs/dbraw/zinc/18/06/40/331180640.db2.gz	CZKRXKODJPUSAL-UHFFFAOYSA-N	0	0	299.418	4.185	20	30		CIEDRN
CC[C@@H]1CCCC[C@@H]1N(C)C(=O)Nc1cccc(CC#N)c1	ZINC000455914622	331180926	/nfs/dbraw/zinc/18/09/26/331180926.db2.gz	GWLFFFCNYXHKGJ-WBVHZDCISA-N	0	0	299.418	4.185	20	30		CIEDRN
C[C@@H](CCC(C)(C)C)NC(=O)Nc1cccc(CC#N)c1	ZINC000455916455	331180958	/nfs/dbraw/zinc/18/09/58/331180958.db2.gz	ILAZJSBJYMOQME-ZDUSSCGKSA-N	0	0	287.407	4.089	20	30		CIEDRN
CC[C@H](NC(=O)Nc1cccc(CC#N)c1)c1cccs1	ZINC000455920721	331181156	/nfs/dbraw/zinc/18/11/56/331181156.db2.gz	NWDGGEJTEKTJLL-AWEZNQCLSA-N	0	0	299.399	4.087	20	30		CIEDRN
CCC(CC)(CC)CNC(=O)Nc1cccc(CC#N)c1	ZINC000455923418	331181230	/nfs/dbraw/zinc/18/12/30/331181230.db2.gz	SXTSSMIYARYFAJ-UHFFFAOYSA-N	0	0	287.407	4.091	20	30		CIEDRN
CCC[C@@H]1[C@@H](C)CCCN1C(=O)Nc1cccc(CC#N)c1	ZINC000455924318	331181316	/nfs/dbraw/zinc/18/13/16/331181316.db2.gz	VNBUXZITSBIFCK-WMLDXEAASA-N	0	0	299.418	4.185	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1	ZINC000456015620	331182501	/nfs/dbraw/zinc/18/25/01/331182501.db2.gz	ATSCNWWNORLJBI-HRCADAONSA-N	0	0	289.806	4.011	20	30		CIEDRN
C=CCCCNC(=O)c1ccc([C@@H](C)C(F)(F)F)cc1	ZINC000456015640	331182529	/nfs/dbraw/zinc/18/25/29/331182529.db2.gz	AULVWVNEOKHOIT-LLVKDONJSA-N	0	0	285.309	4.048	20	30		CIEDRN
C=CCCN(C)C(=O)c1ccc([C@@H](C)C(F)(F)F)cc1	ZINC000456030277	331182834	/nfs/dbraw/zinc/18/28/34/331182834.db2.gz	RLYIMKITSKLQLG-LLVKDONJSA-N	0	0	285.309	4.001	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(OCC)ccc1Cl	ZINC000456043062	331183156	/nfs/dbraw/zinc/18/31/56/331183156.db2.gz	JBBFWWLTPBXZLU-NSHDSACASA-N	0	0	281.783	4.280	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cc(OCC)ccc2Cl)CC1	ZINC000456048412	331183298	/nfs/dbraw/zinc/18/32/98/331183298.db2.gz	PBRCNYCNJSGPLS-UHFFFAOYSA-N	0	0	293.794	4.424	20	30		CIEDRN
C[C@@H]1CC=C(C(=O)N[C@H](CCCC#N)c2ccccc2)CC1	ZINC000456077209	331183950	/nfs/dbraw/zinc/18/39/50/331183950.db2.gz	ZBHMGIVMBLUPEQ-CRAIPNDOSA-N	0	0	296.414	4.284	20	30		CIEDRN
N#CCCCC(=O)N1CCCC[C@@H]1c1ccc(Cl)cc1	ZINC000456343399	331190375	/nfs/dbraw/zinc/19/03/75/331190375.db2.gz	CVTDFOHEQIFGMB-OAHLLOKOSA-N	0	0	290.794	4.087	20	30		CIEDRN
C=CCC1(NC(=O)CC(C)(C)C(F)(F)F)CCCCC1	ZINC000456361293	331190822	/nfs/dbraw/zinc/19/08/22/331190822.db2.gz	FQYMGEKZONHXEA-UHFFFAOYSA-N	0	0	291.357	4.360	20	30		CIEDRN
C=CCC1(NC(=O)[C@H](C)c2cccc(C#N)c2)CCCCC1	ZINC000456360595	331190954	/nfs/dbraw/zinc/19/09/54/331190954.db2.gz	DPQYWBRUIGRGRY-OAHLLOKOSA-N	0	0	296.414	4.057	20	30		CIEDRN
C=CCC1(NC(=O)c2scnc2C2CC2)CCCCC1	ZINC000456375974	331191705	/nfs/dbraw/zinc/19/17/05/331191705.db2.gz	YRLFHUJHDNJSCY-UHFFFAOYSA-N	0	0	290.432	4.029	20	30		CIEDRN
C=CCC1(CNC(=O)[C@@H](C)c2cccs2)CCCC1	ZINC000456484241	331193605	/nfs/dbraw/zinc/19/36/05/331193605.db2.gz	IYWBLMSIKQDGPP-ZDUSSCGKSA-N	0	0	277.433	4.104	20	30		CIEDRN
N#CCC[C@H](Nc1nc2cc(F)ccc2o1)c1ccccc1	ZINC000164312654	331199012	/nfs/dbraw/zinc/19/90/12/331199012.db2.gz	IBAQZXUBTSHCGY-AWEZNQCLSA-N	0	0	295.317	4.424	20	30		CIEDRN
CC(C)(CC(=O)Nc1cccc(CC#N)c1)c1ccccc1	ZINC000456726137	331199248	/nfs/dbraw/zinc/19/92/48/331199248.db2.gz	HABOXUXXXBZBJP-UHFFFAOYSA-N	0	0	292.382	4.059	20	30		CIEDRN
CCC[C@@H](C(=O)Nc1cccc(CC#N)c1)c1ccccc1	ZINC000456739609	331199636	/nfs/dbraw/zinc/19/96/36/331199636.db2.gz	VZCAONLTPGVHBP-GOSISDBHSA-N	0	0	292.382	4.275	20	30		CIEDRN
CC(C)c1nccc(N[C@H](CCC#N)c2ccccc2)n1	ZINC000164349837	331209333	/nfs/dbraw/zinc/20/93/33/331209333.db2.gz	NPYMWOHXVVOROV-OAHLLOKOSA-N	0	0	280.375	4.057	20	30		CIEDRN
C=CCCC(=O)N[C@H]1CC[C@@H](c2cccc(Cl)c2)C1	ZINC000457052850	331210989	/nfs/dbraw/zinc/21/09/89/331210989.db2.gz	ATHBGEAVKFXMHU-HIFRSBDPSA-N	0	0	277.795	4.059	20	30		CIEDRN
C=CCC[C@H](NC(=O)[C@H](CC)CC(F)F)c1ccccc1	ZINC000457681303	331231033	/nfs/dbraw/zinc/23/10/33/331231033.db2.gz	PZOFRTFNTFSFPE-HIFRSBDPSA-N	0	0	295.373	4.492	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(OC)c(SC)c2)CCC1	ZINC000457910443	331237471	/nfs/dbraw/zinc/23/74/71/331237471.db2.gz	JWYBKNZYNWHCAM-UHFFFAOYSA-N	0	0	291.416	4.102	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(OC)c(SC)c2)CC1	ZINC000457916847	331237555	/nfs/dbraw/zinc/23/75/55/331237555.db2.gz	SYSRVFRMBJNBSM-UHFFFAOYSA-N	0	0	291.416	4.102	20	30		CIEDRN
CC(C)c1ccc2occ(C(=O)NCC(C)(C)CC#N)c2c1	ZINC000458014680	331240807	/nfs/dbraw/zinc/24/08/07/331240807.db2.gz	CEMRUQMTCOWNNH-UHFFFAOYSA-N	0	0	298.386	4.226	20	30		CIEDRN
C=CCC[C@H](C(=O)NCCC1(C)CC1)c1ccccc1	ZINC000471229451	331242385	/nfs/dbraw/zinc/24/23/85/331242385.db2.gz	BLIWTVYXYDOGCK-INIZCTEOSA-N	0	0	271.404	4.043	20	30		CIEDRN
C=CCCCC(=O)N(C)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000458085807	331242455	/nfs/dbraw/zinc/24/24/55/331242455.db2.gz	KCYXTNVCQMBIMQ-DLBZAZTESA-N	0	0	271.404	4.137	20	30		CIEDRN
C=C[C@@H](CC(=O)NC1(C2CCC2)CCC1)c1ccccc1	ZINC000458244366	331246079	/nfs/dbraw/zinc/24/60/79/331246079.db2.gz	WMQJLOFLHLLNDF-HNNXBMFYSA-N	0	0	283.415	4.185	20	30		CIEDRN
C=CCC[C@@H](C(=O)N[C@H]1CCC[C@@H]2C[C@@H]21)c1ccccc1	ZINC000458307289	331247972	/nfs/dbraw/zinc/24/79/72/331247972.db2.gz	UGXCEJAPUCWSPZ-BDXSIMOUSA-N	0	0	283.415	4.041	20	30		CIEDRN
CCC[C@@H](NC(=O)C[C@@H](CC#N)c1ccccc1)C1CCC1	ZINC000458333297	331249046	/nfs/dbraw/zinc/24/90/46/331249046.db2.gz	OOISRZBZKSELMB-QZTJIDSGSA-N	0	0	298.430	4.159	20	30		CIEDRN
CCC1(NC(=O)N[C@@H](CCCC#N)c2ccccc2)CCC1	ZINC000458795021	331259982	/nfs/dbraw/zinc/25/99/82/331259982.db2.gz	BYXJAWWEYQZPTP-INIZCTEOSA-N	0	0	299.418	4.053	20	30		CIEDRN
CCCN(C(=O)N[C@H](CCCC#N)c1ccccc1)C1CC1	ZINC000458803255	331260132	/nfs/dbraw/zinc/26/01/32/331260132.db2.gz	QUWFECFDCXVXQH-QGZVFWFLSA-N	0	0	299.418	4.006	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)NCCC(=C)C	ZINC000458993965	331265011	/nfs/dbraw/zinc/26/50/11/331265011.db2.gz	FKZIYJINWRBXND-UHFFFAOYSA-N	0	0	298.839	4.065	20	30		CIEDRN
C=CCC[C@H](C)Nc1cc(-c2ccnn2C)ccc1C	ZINC000467409716	331276276	/nfs/dbraw/zinc/27/62/76/331276276.db2.gz	ZVOVCABYCQASIE-AWEZNQCLSA-N	0	0	269.392	4.162	20	30		CIEDRN
C=CCCc1ccccc1NCc1cnc(C2CC2)nc1	ZINC000459532961	331286302	/nfs/dbraw/zinc/28/63/02/331286302.db2.gz	OXVZGHNPPXCGOD-UHFFFAOYSA-N	0	0	279.387	4.085	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N[C@H]1CCC[C@@H]2C[C@@H]21	ZINC000459547477	331287179	/nfs/dbraw/zinc/28/71/79/331287179.db2.gz	JZIAFALPCZYBRC-VYDXJSESSA-N	0	0	284.403	4.115	20	30		CIEDRN
N#CC1(CN2CC3(CCCCC3)[C@H]2c2ccccc2)CC1	ZINC000459764880	331299431	/nfs/dbraw/zinc/29/94/31/331299431.db2.gz	ZSSVHLWWVSZNIC-QGZVFWFLSA-N	0	0	280.415	4.298	20	30		CIEDRN
CC[C@H]1CCC[C@H]1C(=O)Nc1sc(C)c(C)c1C#N	ZINC000459846902	331302499	/nfs/dbraw/zinc/30/24/99/331302499.db2.gz	RUXYFMJXOFFSIX-NWDGAFQWSA-N	0	0	276.405	4.001	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1sc2c(c1C#N)CCCC2	ZINC000459845290	331302545	/nfs/dbraw/zinc/30/25/45/331302545.db2.gz	IQTQVMFSTPMJKO-UHFFFAOYSA-N	0	0	288.416	4.039	20	30		CIEDRN
C=CCC1(C(=O)Nc2sc(C)c(C)c2C#N)CCCC1	ZINC000459847611	331302604	/nfs/dbraw/zinc/30/26/04/331302604.db2.gz	UKHXEHXWLNUBTK-UHFFFAOYSA-N	0	0	288.416	4.312	20	30		CIEDRN
C=CCC1(C(=O)N2CCC[C@@H]3CCCC[C@H]32)CCCC1	ZINC000459876563	331302722	/nfs/dbraw/zinc/30/27/22/331302722.db2.gz	ORDFBKDAKIJWNJ-JKSUJKDBSA-N	0	0	275.436	4.304	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@@]1(C)CC=CCC1	ZINC000459886391	331303006	/nfs/dbraw/zinc/30/30/06/331303006.db2.gz	ZKRHYVJQQVPVKZ-INIZCTEOSA-N	0	0	275.417	4.009	20	30		CIEDRN
C=CCN(C(=O)[C@@H](CC)CC(F)(F)F)c1ccccc1	ZINC000459934080	331303573	/nfs/dbraw/zinc/30/35/73/331303573.db2.gz	RTLLCEZEZQPNTH-LBPRGKRZSA-N	0	0	285.309	4.184	20	30		CIEDRN
Cc1ccc([C@@H](C)N(C)C(=O)c2cscc2C#N)c(C)c1	ZINC000459955941	331303810	/nfs/dbraw/zinc/30/38/10/331303810.db2.gz	BSNBMCDUSQUTEJ-CYBMUJFWSA-N	0	0	298.411	4.070	20	30		CIEDRN
C[C@@H]1CCN(C(=O)[C@@]2(C#N)CC23CCCC3)c2ccccc21	ZINC000459988545	331304057	/nfs/dbraw/zinc/30/40/57/331304057.db2.gz	IZVUFEPINOJZSZ-KUHUBIRLSA-N	0	0	294.398	4.001	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(N(C)C)cc2C)CCCC1	ZINC000460011660	331304384	/nfs/dbraw/zinc/30/43/84/331304384.db2.gz	HPCKCCIFFOYJBT-UHFFFAOYSA-N	0	0	286.419	4.136	20	30		CIEDRN
C=CCC1(C(=O)Nc2cc(C#N)ccc2OCC)CCCC1	ZINC000460059058	331304929	/nfs/dbraw/zinc/30/49/29/331304929.db2.gz	ZZGISICZDUJKCV-UHFFFAOYSA-N	0	0	298.386	4.032	20	30		CIEDRN
C=C[C@H](CC(=O)N1CCc2c1cccc2F)c1ccccc1	ZINC000461085057	331311146	/nfs/dbraw/zinc/31/11/46/331311146.db2.gz	JMRHRMCWLDMCPB-CQSZACIVSA-N	0	0	295.357	4.075	20	30		CIEDRN
C=CCCC(=O)Nc1ncc(-c2ccc(Cl)cc2)s1	ZINC000461099586	331311393	/nfs/dbraw/zinc/31/13/93/331311393.db2.gz	TXQQADMOUPZDTB-UHFFFAOYSA-N	0	0	292.791	4.368	20	30		CIEDRN
Cc1cccc(Oc2ccc(NC(=O)CCCC#N)cc2)c1	ZINC000461803297	331314843	/nfs/dbraw/zinc/31/48/43/331314843.db2.gz	YATJDMFIRVSIKV-UHFFFAOYSA-N	0	0	294.354	4.420	20	30		CIEDRN
CC[C@@H](CC(F)(F)F)Nc1nc(C)c(C#N)cc1Cl	ZINC000461933479	331315586	/nfs/dbraw/zinc/31/55/86/331315586.db2.gz	DAPGIUGDTUZUHR-VIFPVBQESA-N	0	0	291.704	4.058	20	30		CIEDRN
CC(C)(C)[C@H](CC1CCCCC1)NC(=O)CCCC#N	ZINC000462080683	331317212	/nfs/dbraw/zinc/31/72/12/331317212.db2.gz	XIFXONZIBSZNNV-HNNXBMFYSA-N	0	0	278.440	4.182	20	30		CIEDRN
CC(C)(C)[C@@H](CC1CCCCC1)NC(=O)CCCC#N	ZINC000462080684	331317229	/nfs/dbraw/zinc/31/72/29/331317229.db2.gz	XIFXONZIBSZNNV-OAHLLOKOSA-N	0	0	278.440	4.182	20	30		CIEDRN
C[C@@H]1CCC[C@@](C#N)(NC(=O)c2cccc(C3CCC3)c2)C1	ZINC000462104670	331317240	/nfs/dbraw/zinc/31/72/40/331317240.db2.gz	LICAJFPRHNMRSJ-AUUYWEPGSA-N	0	0	296.414	4.156	20	30		CIEDRN
CC[C@H](C)[C@H]1CCCCN1C(=O)[C@H](C)c1cccc(C#N)c1	ZINC000462211184	331318513	/nfs/dbraw/zinc/31/85/13/331318513.db2.gz	SALQIUUYZULRQN-HDMKZQKVSA-N	0	0	298.430	4.089	20	30		CIEDRN
CCC[C@@H]1[C@H](C)CCCN1C(=O)[C@H](C)c1cccc(C#N)c1	ZINC000462215346	331318577	/nfs/dbraw/zinc/31/85/77/331318577.db2.gz	VZXWLXIZFYDLPS-IIDMSEBBSA-N	0	0	298.430	4.089	20	30		CIEDRN
CCCCC[C@@H]1CCCN1C(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000462256425	331318762	/nfs/dbraw/zinc/31/87/62/331318762.db2.gz	SSIWQVOMKBKWSI-MAUKXSAKSA-N	0	0	298.430	4.233	20	30		CIEDRN
CC#CCCSCc1cc(-c2ccc(F)cc2)no1	ZINC000462361285	331320396	/nfs/dbraw/zinc/32/03/96/331320396.db2.gz	SAXITJWXPHFTMQ-UHFFFAOYSA-N	0	0	275.348	4.127	20	30		CIEDRN
CC#CCCSCc1ncc(Cl)cc1Cl	ZINC000462374618	331320898	/nfs/dbraw/zinc/32/08/98/331320898.db2.gz	BAXBKSDTAACNIO-UHFFFAOYSA-N	0	0	260.189	4.035	20	30		CIEDRN
Cc1ccccc1OCCNc1c(Cl)cccc1C#N	ZINC000462379810	331320952	/nfs/dbraw/zinc/32/09/52/331320952.db2.gz	UREFUHCIDRZYIT-UHFFFAOYSA-N	0	0	286.762	4.011	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H]1CCCCC12CCCC2	ZINC000462386854	331321168	/nfs/dbraw/zinc/32/11/68/331321168.db2.gz	GVHSLKSCVYAPES-MRXNPFEDSA-N	0	0	275.436	4.374	20	30		CIEDRN
C[C@@H]1CCCN(c2c(C#N)cnc3ccc(Cl)cc32)CC1	ZINC000462389467	331321186	/nfs/dbraw/zinc/32/11/86/331321186.db2.gz	RUUGARHXKPGTRB-GFCCVEGCSA-N	0	0	299.805	4.386	20	30		CIEDRN
CC#CCCSc1nnc(-c2ccc3ccccc3c2)o1	ZINC000462387562	331321214	/nfs/dbraw/zinc/32/12/14/331321214.db2.gz	KJPRHKGPUUZYCY-UHFFFAOYSA-N	0	0	294.379	4.395	20	30		CIEDRN
Cc1cc(C#N)ccc1C(=O)Nc1cccc(C2CCC2)c1	ZINC000462386630	331321254	/nfs/dbraw/zinc/32/12/54/331321254.db2.gz	FSFKKGXENRBRIW-UHFFFAOYSA-N	0	0	290.366	4.387	20	30		CIEDRN
CC#CCCSc1nnc(-c2ccccc2)n1[C@@H](C)CC	ZINC000462413146	331321614	/nfs/dbraw/zinc/32/16/14/331321614.db2.gz	AATTWSJPKHBTSF-AWEZNQCLSA-N	0	0	299.443	4.422	20	30		CIEDRN
C=CCCC1(C(=O)NCCc2ccc(Cl)c(C)c2)CC1	ZINC000462459170	331322395	/nfs/dbraw/zinc/32/23/95/331322395.db2.gz	LRFUYNCRZXXPIV-UHFFFAOYSA-N	0	0	291.822	4.054	20	30		CIEDRN
C/C=C\c1ccc(NC(=O)[C@@H](C)c2cccc(C#N)c2)cc1	ZINC000462475603	331322645	/nfs/dbraw/zinc/32/26/45/331322645.db2.gz	PJYVZTYCFFMXQE-MFBWXBCUSA-N	0	0	290.366	4.334	20	30		CIEDRN
C/C=C/c1ccc(NC(=O)[C@@H](C)c2cccc(C#N)c2)cc1	ZINC000462475601	331322648	/nfs/dbraw/zinc/32/26/48/331322648.db2.gz	PJYVZTYCFFMXQE-KQIUPUNMSA-N	0	0	290.366	4.334	20	30		CIEDRN
C=CCNC(=O)N[C@@H](C)c1ccc(Cl)c2ccccc21	ZINC000462507095	331323024	/nfs/dbraw/zinc/32/30/24/331323024.db2.gz	CNTOPOUCMCUFBG-NSHDSACASA-N	0	0	288.778	4.039	20	30		CIEDRN
C[C@H](C(=O)NCC1(C)CCCCCC1)c1cccc(C#N)c1	ZINC000462546047	331323320	/nfs/dbraw/zinc/32/33/20/331323320.db2.gz	QBRQQQKQJULQNO-HNNXBMFYSA-N	0	0	298.430	4.138	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)Nc1cccc(C2CCC2)c1)OCC	ZINC000462730042	331325839	/nfs/dbraw/zinc/32/58/39/331325839.db2.gz	FJNWUQNDNFXQAB-QGZVFWFLSA-N	0	0	287.403	4.264	20	30		CIEDRN
CCC1CCN(c2c(C#N)cnc3ccc(Cl)cc32)CC1	ZINC000462786025	331328933	/nfs/dbraw/zinc/32/89/33/331328933.db2.gz	SXCMNWGHYLEXMG-UHFFFAOYSA-N	0	0	299.805	4.386	20	30		CIEDRN
Cc1[nH]c2ccccc2c1CCNc1ccc(F)cc1C#N	ZINC000462794925	331329456	/nfs/dbraw/zinc/32/94/56/331329456.db2.gz	KSKBUHJANAGURV-UHFFFAOYSA-N	0	0	293.345	4.142	20	30		CIEDRN
N#C[C@@H]1CCC[C@H](Nc2cccc(C3CCC3)c2)C1	ZINC000462872032	331333472	/nfs/dbraw/zinc/33/34/72/331333472.db2.gz	SSSDPIRKDDZHMC-CJNGLKHVSA-N	0	0	254.377	4.448	20	30		CIEDRN
COc1ccc([C@H](C)CCNc2ccc(F)cc2C#N)cc1	ZINC000462881066	331333770	/nfs/dbraw/zinc/33/37/70/331333770.db2.gz	KBLAAVYFDUBBER-CYBMUJFWSA-N	0	0	298.361	4.312	20	30		CIEDRN
CO[C@H](CNc1ccc(C#N)cc1)c1ccc(Cl)cc1	ZINC000462890074	331334084	/nfs/dbraw/zinc/33/40/84/331334084.db2.gz	AOPDDOFWEXUWJC-MRXNPFEDSA-N	0	0	286.762	4.011	20	30		CIEDRN
C[C@@H](CNc1c(F)cc(C#N)cc1F)Cc1cccs1	ZINC000462894890	331334170	/nfs/dbraw/zinc/33/41/70/331334170.db2.gz	JWIOMORRTHRNJX-SNVBAGLBSA-N	0	0	292.354	4.189	20	30		CIEDRN
N#Cc1ccc(N[C@@H]2CC[C@H]3CCC[C@@H]3C2)c(F)c1	ZINC000462900767	331334300	/nfs/dbraw/zinc/33/43/00/331334300.db2.gz	DCUYSJCAZWOCJI-MGPQQGTHSA-N	0	0	258.340	4.078	20	30		CIEDRN
C[C@H]1CN(c2ccc(C#N)cc2)CC[C@@H]1c1ccccc1	ZINC000462910999	331334821	/nfs/dbraw/zinc/33/48/21/331334821.db2.gz	LYHZEQISRQNSBB-KXBFYZLASA-N	0	0	276.383	4.188	20	30		CIEDRN
C=C[C@H](CC(=O)N(CC)CC(C)(C)C)c1ccccc1	ZINC000462987374	331336499	/nfs/dbraw/zinc/33/64/99/331336499.db2.gz	CGMIVLUGNXNOOS-OAHLLOKOSA-N	0	0	273.420	4.241	20	30		CIEDRN
CCc1ccc(CC)c(N[C@@H]2CCC[C@H](C#N)C2)c1	ZINC000463278922	331344352	/nfs/dbraw/zinc/34/43/52/331344352.db2.gz	FBITXRGXAKAPJP-GOEBONIOSA-N	0	0	256.393	4.306	20	30		CIEDRN
C=CCN(CC=C)C(=O)c1c(C)c(C)oc1-c1ccccc1	ZINC000463258230	331344626	/nfs/dbraw/zinc/34/46/26/331344626.db2.gz	KBPZZWAGBCBBAT-UHFFFAOYSA-N	0	0	295.382	4.378	20	30		CIEDRN
C=CCN(CC=C)C(=O)[C@@H](Sc1ccccc1)C(C)C	ZINC000463266045	331344670	/nfs/dbraw/zinc/34/46/70/331344670.db2.gz	MMEVCWQAJQLDAS-INIZCTEOSA-N	0	0	289.444	4.004	20	30		CIEDRN
C=CCN(CC=C)C(=O)C1(c2cccs2)CCCCC1	ZINC000463279460	331344891	/nfs/dbraw/zinc/34/48/91/331344891.db2.gz	QBPUTCZKBKEPET-UHFFFAOYSA-N	0	0	289.444	4.151	20	30		CIEDRN
CCSCc1cccc(N[C@H]2CCC[C@H](C#N)C2)c1	ZINC000463291888	331345451	/nfs/dbraw/zinc/34/54/51/331345451.db2.gz	PZBJMFYVGDPEQT-ZFWWWQNUSA-N	0	0	274.433	4.434	20	30		CIEDRN
CCCCCN(C(=O)[C@@H](C)c1cccc(C#N)c1)C(C)C	ZINC000463347260	331346410	/nfs/dbraw/zinc/34/64/10/331346410.db2.gz	BMVOWRBTILGKNZ-HNNXBMFYSA-N	0	0	286.419	4.089	20	30		CIEDRN
CCCC[C@@H](CC)C(=O)Nc1sc(CC)cc1C#N	ZINC000463457868	331348127	/nfs/dbraw/zinc/34/81/27/331348127.db2.gz	LVNYJRSJXKKXRF-LLVKDONJSA-N	0	0	278.421	4.337	20	30		CIEDRN
C[C@H]1C[C@H]1CC(=O)Nc1sc(-c2ccccc2)cc1C#N	ZINC000463465777	331348187	/nfs/dbraw/zinc/34/81/87/331348187.db2.gz	CEIRHGRHGZPAJA-AAEUAGOBSA-N	0	0	296.395	4.271	20	30		CIEDRN
CCN(C(=O)[C@H](C)c1cccc(C#N)c1)[C@H]1CCCC[C@@H]1C	ZINC000463716947	331350885	/nfs/dbraw/zinc/35/08/85/331350885.db2.gz	SWQDLLVPYIOHGZ-DAYGRLMNSA-N	0	0	298.430	4.089	20	30		CIEDRN
CC(C)CCN(CCC#N)C(=O)CCCC1CCCC1	ZINC000463882297	331352799	/nfs/dbraw/zinc/35/27/99/331352799.db2.gz	XQRDMXOEGXFCIC-UHFFFAOYSA-N	0	0	278.440	4.135	20	30		CIEDRN
CCCn1c2ccc(Cl)cc2nc1-c1ccc(C#N)o1	ZINC000463913683	331353750	/nfs/dbraw/zinc/35/37/50/331353750.db2.gz	RWQHFZYGBORPOD-UHFFFAOYSA-N	0	0	285.734	4.231	20	30		CIEDRN
CC[C@H](C)[C@H](C)N(C(=O)[C@H](C)c1cccc(C#N)c1)C1CC1	ZINC000463941095	331354192	/nfs/dbraw/zinc/35/41/92/331354192.db2.gz	DCDYDYCHRKSBSB-ZNMIVQPWSA-N	0	0	298.430	4.087	20	30		CIEDRN
N#Cc1ccc(-c2nc3cccc(Cl)c3s2)o1	ZINC000463939171	331354200	/nfs/dbraw/zinc/35/42/00/331354200.db2.gz	VSPIQNQVXZXBIY-UHFFFAOYSA-N	0	0	260.705	4.081	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1cccc(F)c1OCC	ZINC000464060344	331355696	/nfs/dbraw/zinc/35/56/96/331355696.db2.gz	UZXKBOSSAYMZKB-UHFFFAOYSA-N	0	0	293.382	4.043	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@]1(C)CCc2ccccc2C1	ZINC000464084523	331356460	/nfs/dbraw/zinc/35/64/60/331356460.db2.gz	ZJIMJXJFCOOQAC-HXUWFJFHSA-N	0	0	299.458	4.386	20	30		CIEDRN
CC#CCSCc1csc(-c2ccsc2)n1	ZINC000464096640	331356793	/nfs/dbraw/zinc/35/67/93/331356793.db2.gz	ZHYSNPIFZWKMQQ-UHFFFAOYSA-N	0	0	265.428	4.128	20	30		CIEDRN
CC[C@H](C#N)NC(=O)C1(c2ccc(C(C)C)cc2)CCCC1	ZINC000464123274	331356896	/nfs/dbraw/zinc/35/68/96/331356896.db2.gz	SFOHNNAPGJQXGC-QGZVFWFLSA-N	0	0	298.430	4.040	20	30		CIEDRN
CC(C)(C)[C@](C)(C#N)NC(=O)CC1CCC(C)(C)CC1	ZINC000464159549	331357280	/nfs/dbraw/zinc/35/72/80/331357280.db2.gz	NDNJWHHVORVDER-KRWDZBQOSA-N	0	0	278.440	4.037	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC)[C@@H](C)c1ccc(F)cc1	ZINC000464435416	331360429	/nfs/dbraw/zinc/36/04/29/331360429.db2.gz	DAWXCVJJVIDWON-KGLIPLIRSA-N	0	0	277.383	4.338	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](c1ccccc1)C1CCC1	ZINC000464435861	331360436	/nfs/dbraw/zinc/36/04/36/331360436.db2.gz	ADUSAOSAPBQIJL-RHSMWYFYSA-N	0	0	271.404	4.246	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](CC(F)(F)F)c1ccccc1	ZINC000464435170	331360464	/nfs/dbraw/zinc/36/04/64/331360464.db2.gz	CLOAIANIUPXCDI-TZMCWYRMSA-N	0	0	299.336	4.399	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](c1ccc(F)cc1)C1CCC1	ZINC000464439337	331360565	/nfs/dbraw/zinc/36/05/65/331360565.db2.gz	OFBYVTDRMOILBY-SUMWQHHRSA-N	0	0	289.394	4.385	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC2(CCC2)c2c1cccc2F	ZINC000464437657	331360593	/nfs/dbraw/zinc/36/05/93/331360593.db2.gz	BPGDMZAZNRGMMK-ZDUSSCGKSA-N	0	0	287.378	4.196	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](c1ccc(F)cc1)C1CCC1	ZINC000464439335	331360600	/nfs/dbraw/zinc/36/06/00/331360600.db2.gz	OFBYVTDRMOILBY-DYVFJYSZSA-N	0	0	289.394	4.385	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](CC)c1ccccc1OCC	ZINC000464440428	331360722	/nfs/dbraw/zinc/36/07/22/331360722.db2.gz	JIZOBLFDYWXXHY-GDBMZVCRSA-N	0	0	289.419	4.255	20	30		CIEDRN
CC#CCCCC(=O)N(C)[C@H](C)c1cc(C)ccc1C	ZINC000464522842	331361754	/nfs/dbraw/zinc/36/17/54/331361754.db2.gz	LLPSUUDZKQPTFP-MRXNPFEDSA-N	0	0	271.404	4.016	20	30		CIEDRN
CC#CCCCC(=O)N(C)[C@@H](C)c1cc(C)ccc1C	ZINC000464522841	331361812	/nfs/dbraw/zinc/36/18/12/331361812.db2.gz	LLPSUUDZKQPTFP-INIZCTEOSA-N	0	0	271.404	4.016	20	30		CIEDRN
CC#CCCCC(=O)N(C)[C@@H](C)c1ccc(C)cc1C	ZINC000464518426	331361835	/nfs/dbraw/zinc/36/18/35/331361835.db2.gz	FPUUNXGNSZLEAZ-INIZCTEOSA-N	0	0	271.404	4.016	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC(C)C)c1ccc(C#N)cc1	ZINC000464530736	331361920	/nfs/dbraw/zinc/36/19/20/331361920.db2.gz	UKCUIJJPJAOPOQ-HNNXBMFYSA-N	0	0	284.403	4.150	20	30		CIEDRN
CC#CCCCC(=O)Nc1nc2cc(Cl)ccc2s1	ZINC000464528513	331361950	/nfs/dbraw/zinc/36/19/50/331361950.db2.gz	MZTIZWKJHHLTIY-UHFFFAOYSA-N	0	0	292.791	4.082	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC)Cc1ccccc1Cl	ZINC000464542664	331362232	/nfs/dbraw/zinc/36/22/32/331362232.db2.gz	AUUUBNDEIMLKLD-CYBMUJFWSA-N	0	0	279.811	4.291	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(Cc1ccccc1C)C1CC1	ZINC000464554066	331362360	/nfs/dbraw/zinc/36/23/60/331362360.db2.gz	YAOCIGXKFSEAQX-HNNXBMFYSA-N	0	0	271.404	4.088	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1nc(-c2ccccc2)cs1	ZINC000464553376	331362394	/nfs/dbraw/zinc/36/23/94/331362394.db2.gz	XJQIELCHXSQVBE-LBPRGKRZSA-N	0	0	286.400	4.351	20	30		CIEDRN
Cc1cc(C)c(C#N)c(SCc2ccc(F)cc2F)n1	ZINC000464562967	331362593	/nfs/dbraw/zinc/36/25/93/331362593.db2.gz	BUJHKGDFIUGETE-UHFFFAOYSA-N	0	0	290.338	4.141	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(Cc1ccccc1)[C@H](C)C1CC1	ZINC000464568650	331362783	/nfs/dbraw/zinc/36/27/83/331362783.db2.gz	UFFSDQSHROZIID-JKSUJKDBSA-N	0	0	285.431	4.416	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(Cc1ccccc1)[C@@H](C)C1CC1	ZINC000464568644	331362872	/nfs/dbraw/zinc/36/28/72/331362872.db2.gz	UFFSDQSHROZIID-CVEARBPZSA-N	0	0	285.431	4.416	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(Cc1ccccc1)CC(C)C	ZINC000464570538	331362926	/nfs/dbraw/zinc/36/29/26/331362926.db2.gz	MEDUGKZNOZEREE-MRXNPFEDSA-N	0	0	273.420	4.274	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@H]1CCCC[C@H]1C(F)(F)F	ZINC000464607604	331363799	/nfs/dbraw/zinc/36/37/99/331363799.db2.gz	KOOHXRCIYDXFAP-XQQFMLRXSA-N	0	0	291.357	4.168	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)c1cccc(C(C)C)c1	ZINC000464645752	331364137	/nfs/dbraw/zinc/36/41/37/331364137.db2.gz	DSKPMVDENDGQIA-AWEZNQCLSA-N	0	0	259.393	4.375	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H]1CCC(C)(C)c2ccccc21	ZINC000464644830	331364152	/nfs/dbraw/zinc/36/41/52/331364152.db2.gz	CQIIYLPYTBFDRA-QGZVFWFLSA-N	0	0	283.415	4.109	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000464650693	331364186	/nfs/dbraw/zinc/36/41/86/331364186.db2.gz	AKVGNDARWVOESF-CGTJXYLNSA-N	0	0	285.431	4.431	20	30		CIEDRN
C[C@H]1C[C@@H](c2ccccc2F)N(Cc2ccccc2C#N)C1	ZINC000464729168	331365385	/nfs/dbraw/zinc/36/53/85/331365385.db2.gz	ZSLRVLBBPTXCLS-LIRRHRJNSA-N	0	0	294.373	4.280	20	30		CIEDRN
N#CCN(C1CC1)[C@H]1CCCC[C@H]1C1CCCCC1	ZINC000464728967	331365430	/nfs/dbraw/zinc/36/54/30/331365430.db2.gz	HPGHQSJITFDSAW-IRXDYDNUSA-N	0	0	260.425	4.113	20	30		CIEDRN
C=C[C@H](C)NC(=O)N(C)[C@@H](C)[C@@H](C)c1ccc(Cl)cc1	ZINC000464752928	331365584	/nfs/dbraw/zinc/36/55/84/331365584.db2.gz	QFLNJIRQSVKSPH-XQQFMLRXSA-N	0	0	294.826	4.048	20	30		CIEDRN
N#CCSCCCN(c1ccc(F)cc1)C1CCCC1	ZINC000464851278	331371161	/nfs/dbraw/zinc/37/11/61/331371161.db2.gz	LUJLOQVRJNGCKH-UHFFFAOYSA-N	0	0	292.423	4.222	20	30		CIEDRN
C[C@H]1CCN(Cc2cc(C#N)ccc2F)[C@@H](c2ccco2)C1	ZINC000464855212	331371465	/nfs/dbraw/zinc/37/14/65/331371465.db2.gz	LLOVAQKSVVXHKU-SUMWQHHRSA-N	0	0	298.361	4.264	20	30		CIEDRN
C[C@@H]1CCN(Cc2cc(C#N)ccc2F)[C@@H](c2ccco2)C1	ZINC000464855205	331371471	/nfs/dbraw/zinc/37/14/71/331371471.db2.gz	LLOVAQKSVVXHKU-CXAGYDPISA-N	0	0	298.361	4.264	20	30		CIEDRN
CSc1cc(C)ccc1CNc1nc(C)cc(C)c1C#N	ZINC000465055089	331377086	/nfs/dbraw/zinc/37/70/86/331377086.db2.gz	JLTQGIGIYFEQDL-UHFFFAOYSA-N	0	0	297.427	4.213	20	30		CIEDRN
C=C[C@H](C)NC(=O)Cc1coc2cc(C)c(C(C)C)cc12	ZINC000465105604	331378519	/nfs/dbraw/zinc/37/85/19/331378519.db2.gz	ZFRQVPYWDMAEDI-ZDUSSCGKSA-N	0	0	285.387	4.098	20	30		CIEDRN
C=C[C@@H](C)NC(=O)C1(c2ccc(Cl)c(Cl)c2)CCC1	ZINC000465110147	331378615	/nfs/dbraw/zinc/37/86/15/331378615.db2.gz	FOTIGKSDKXUYJM-SNVBAGLBSA-N	0	0	298.213	4.106	20	30		CIEDRN
C=C[C@H](C)NC(=O)c1ccccc1SCC=C(C)C	ZINC000465123952	331379102	/nfs/dbraw/zinc/37/91/02/331379102.db2.gz	ZFHJZPYYYMEDOL-ZDUSSCGKSA-N	0	0	275.417	4.049	20	30		CIEDRN
C=CCN(CCc1ccccc1)C(=O)CC(C)(C)CC	ZINC000465166338	331379349	/nfs/dbraw/zinc/37/93/49/331379349.db2.gz	FSKYZUFXWRKGQW-UHFFFAOYSA-N	0	0	273.420	4.070	20	30		CIEDRN
C=C[C@@H](C)NC(=O)c1ccccc1Sc1ccccc1	ZINC000465145670	331379608	/nfs/dbraw/zinc/37/96/08/331379608.db2.gz	JNZLPUKVGXBFIW-CYBMUJFWSA-N	0	0	283.396	4.142	20	30		CIEDRN
C=C[C@H](C)NC(=O)Nc1ccc2c(c1)oc1ccccc12	ZINC000465161590	331379835	/nfs/dbraw/zinc/37/98/35/331379835.db2.gz	AIEFQANZROJFRG-NSHDSACASA-N	0	0	280.327	4.282	20	30		CIEDRN
C=C[C@@H](C)NC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000465164690	331379937	/nfs/dbraw/zinc/37/99/37/331379937.db2.gz	DGBNSGSJKCQCQX-SSDOTTSWSA-N	0	0	292.688	4.055	20	30		CIEDRN
C=CCOc1cccc(NC(=O)CC(C)(C)CC)c1	ZINC000465172929	331380137	/nfs/dbraw/zinc/38/01/37/331380137.db2.gz	JJIKNKAKHRCKOO-UHFFFAOYSA-N	0	0	261.365	4.016	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@@H](CC)C(C)(C)c1ccccc1	ZINC000465970914	331388123	/nfs/dbraw/zinc/38/81/23/331388123.db2.gz	FMBNVSXXSLFPJI-ZBFHGGJFSA-N	0	0	288.435	4.007	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@H](CC)C(C)(C)c1ccccc1	ZINC000465970911	331388146	/nfs/dbraw/zinc/38/81/46/331388146.db2.gz	FMBNVSXXSLFPJI-GDBMZVCRSA-N	0	0	288.435	4.007	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@@H](CC)C(C)(C)c1ccccc1	ZINC000465970913	331388154	/nfs/dbraw/zinc/38/81/54/331388154.db2.gz	FMBNVSXXSLFPJI-HOCLYGCPSA-N	0	0	288.435	4.007	20	30		CIEDRN
C=CCCCCCN(C)C(=O)N[C@H](C)C1CCCCC1	ZINC000466004997	331388645	/nfs/dbraw/zinc/38/86/45/331388645.db2.gz	FJNNCMTZTMEWHR-OAHLLOKOSA-N	0	0	280.456	4.343	20	30		CIEDRN
CC[C@@H](C)C[C@@H](C)NC(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000466166988	331390351	/nfs/dbraw/zinc/39/03/51/331390351.db2.gz	MSLACAVDLKJQSU-GHMZBOCLSA-N	0	0	293.798	4.158	20	30		CIEDRN
CC[C@@H](C)C[C@H](C)NC(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000466166989	331390402	/nfs/dbraw/zinc/39/04/02/331390402.db2.gz	MSLACAVDLKJQSU-MNOVXSKESA-N	0	0	293.798	4.158	20	30		CIEDRN
C=CCOc1cccc(NC(=O)N[C@H](C)C[C@H](C)CC)c1	ZINC000466172761	331390562	/nfs/dbraw/zinc/39/05/62/331390562.db2.gz	KUSMBERCLFOKLB-ZIAGYGMSSA-N	0	0	290.407	4.198	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NC1(Cc2ccccc2)CCCC1	ZINC000466232688	331391289	/nfs/dbraw/zinc/39/12/89/331391289.db2.gz	FIBFAVKOUYTETO-MRXNPFEDSA-N	0	0	285.431	4.260	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](C)c1c(C)cccc1C	ZINC000466238885	331391416	/nfs/dbraw/zinc/39/14/16/331391416.db2.gz	BHVWFLLITAZDGA-GJZGRUSLSA-N	0	0	259.393	4.083	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](C#N)c1ccc(C(C)(C)C)cc1	ZINC000466240306	331391482	/nfs/dbraw/zinc/39/14/82/331391482.db2.gz	OUNYIHXHNKWHKC-YOEHRIQHSA-N	0	0	298.430	4.267	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(OCCC)cc1	ZINC000466244436	331391513	/nfs/dbraw/zinc/39/15/13/331391513.db2.gz	JLCFWKXUCRWRHC-ZDUSSCGKSA-N	0	0	261.365	4.016	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1c2ccccc2CC[C@@H]1C	ZINC000466245381	331391648	/nfs/dbraw/zinc/39/16/48/331391648.db2.gz	IBIFCPVOKLFTQX-ZQIUZPCESA-N	0	0	271.404	4.029	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cccc2ccsc21	ZINC000466255911	331391673	/nfs/dbraw/zinc/39/16/73/331391673.db2.gz	SLAVSMBKPGZRAR-LLVKDONJSA-N	0	0	259.374	4.442	20	30		CIEDRN
CC#CCCCC(=O)Nc1cccc2ccsc21	ZINC000466260957	331391854	/nfs/dbraw/zinc/39/18/54/331391854.db2.gz	YYDVHSNPFVHCNG-UHFFFAOYSA-N	0	0	257.358	4.033	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H]1CC=C(c2ccc(F)cc2)CC1	ZINC000466270331	331392005	/nfs/dbraw/zinc/39/20/05/331392005.db2.gz	JUGYBVYMKGCQNK-GOSISDBHSA-N	0	0	299.389	4.071	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCc2c1cccc2C(F)(F)F	ZINC000466304264	331392421	/nfs/dbraw/zinc/39/24/21/331392421.db2.gz	CCHWSZLISWTAKW-NSHDSACASA-N	0	0	297.320	4.197	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(Cc1ccccc1F)C(C)C	ZINC000466321928	331392839	/nfs/dbraw/zinc/39/28/39/331392839.db2.gz	AXCHZGHNCMXDKX-OAHLLOKOSA-N	0	0	292.398	4.100	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(CC(=C)C)Cc1ccccc1	ZINC000466323972	331392850	/nfs/dbraw/zinc/39/28/50/331392850.db2.gz	CGUBTKSLBZNRKW-QGZVFWFLSA-N	0	0	286.419	4.129	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000466362686	331393383	/nfs/dbraw/zinc/39/33/83/331393383.db2.gz	PXOCLZXPEXYZHM-FQEVSTJZSA-N	0	0	299.458	4.460	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N(C)Cc1ccc(C(C)C)cc1	ZINC000466361206	331393397	/nfs/dbraw/zinc/39/33/97/331393397.db2.gz	QWMZSWYGXSLWCF-GOSISDBHSA-N	0	0	273.420	4.371	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1ccc2oc(C3CC3)nc2c1	ZINC000466366256	331393554	/nfs/dbraw/zinc/39/35/54/331393554.db2.gz	FHEOJMPKYSPHFM-GFCCVEGCSA-N	0	0	299.374	4.181	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(C)[C@@H](C)c1cccc(Cl)c1	ZINC000466366866	331393666	/nfs/dbraw/zinc/39/36/66/331393666.db2.gz	MJNAYHJLVZVSOG-WFASDCNBSA-N	0	0	294.826	4.397	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(CC)Cc1ccccc1Cl	ZINC000466366631	331393672	/nfs/dbraw/zinc/39/36/72/331393672.db2.gz	KAZYBRPWOTVRLK-AWEZNQCLSA-N	0	0	294.826	4.226	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1ccc(C(C)(C)C)cc1	ZINC000466372695	331393746	/nfs/dbraw/zinc/39/37/46/331393746.db2.gz	IPEDHUCBRINTAU-UHFFFAOYSA-N	0	0	260.381	4.024	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1ccc(Cl)c(Cl)c1	ZINC000466373342	331393783	/nfs/dbraw/zinc/39/37/83/331393783.db2.gz	FAZGDGUUKLHHGS-UHFFFAOYSA-N	0	0	273.163	4.033	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000466377526	331393991	/nfs/dbraw/zinc/39/39/91/331393991.db2.gz	ULROPJFLBCUBHQ-BFRYPLHYSA-N	0	0	298.430	4.229	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(Cc1ccc(C)s1)C(C)C	ZINC000466379540	331394017	/nfs/dbraw/zinc/39/40/17/331394017.db2.gz	ZCMLOVXLAWBMMY-AWEZNQCLSA-N	0	0	294.464	4.331	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N[C@H](CC(C)(C)C)C(F)(F)F	ZINC000466379473	331394057	/nfs/dbraw/zinc/39/40/57/331394057.db2.gz	DHXLJQDBADWCNM-GHMZBOCLSA-N	0	0	294.361	4.007	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000466385435	331394317	/nfs/dbraw/zinc/39/43/17/331394317.db2.gz	FKCIRYFSFCUWJW-LLVKDONJSA-N	0	0	286.297	4.182	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(C)[C@@H](C)c1ccccc1Cl	ZINC000466387879	331394454	/nfs/dbraw/zinc/39/44/54/331394454.db2.gz	VYJQUOKBFKIESB-STQMWFEESA-N	0	0	294.826	4.397	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(C)[C@H](C)c1ccccc1Cl	ZINC000466387877	331394489	/nfs/dbraw/zinc/39/44/89/331394489.db2.gz	VYJQUOKBFKIESB-OLZOCXBDSA-N	0	0	294.826	4.397	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1cccc(C(C)C)c1	ZINC000466401607	331395081	/nfs/dbraw/zinc/39/50/81/331395081.db2.gz	KMKBPTIVEWOYTC-CQSZACIVSA-N	0	0	260.381	4.286	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N1CCC[C@@H]1c1cccc(C)c1	ZINC000466406328	331395469	/nfs/dbraw/zinc/39/54/69/331395469.db2.gz	SYOPZSODSXJPGQ-IAGOWNOFSA-N	0	0	286.419	4.196	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(C)[C@H](C)c1cc(C)ccc1C	ZINC000466410029	331395642	/nfs/dbraw/zinc/39/56/42/331395642.db2.gz	PNWPKTDLTQRJLD-HZPDHXFCSA-N	0	0	288.435	4.361	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)[C@H]1C[C@]1(C)CC	ZINC000466414476	331395772	/nfs/dbraw/zinc/39/57/72/331395772.db2.gz	JYOXKBBNIDKMGH-DOMZBBRYSA-N	0	0	297.851	4.352	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@H](c1ccccc1)C(C)C	ZINC000466415418	331395882	/nfs/dbraw/zinc/39/58/82/331395882.db2.gz	FKSRLZAMLXKAJO-WBVHZDCISA-N	0	0	273.420	4.444	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC1CC1)C1CCCCC1	ZINC000466416641	331395895	/nfs/dbraw/zinc/39/58/95/331395895.db2.gz	LUJGKYMTYUHHHJ-CQSZACIVSA-N	0	0	263.425	4.160	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccc(C(F)(F)F)c(C)c1	ZINC000466416229	331395965	/nfs/dbraw/zinc/39/59/65/331395965.db2.gz	JOSOILUWLNISLL-UHFFFAOYSA-N	0	0	283.293	4.146	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H](C)CCC1CCCCC1	ZINC000466420161	331396150	/nfs/dbraw/zinc/39/61/50/331396150.db2.gz	XCSFKYQQAZAXPA-HNNXBMFYSA-N	0	0	263.425	4.045	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](c1ccc(F)cc1F)C(C)C	ZINC000466424608	331396449	/nfs/dbraw/zinc/39/64/49/331396449.db2.gz	IYTJOCUOGKLVDU-WBMJQRKESA-N	0	0	295.373	4.380	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H]1CCC[C@@H]1c1ccccc1	ZINC000466425755	331396636	/nfs/dbraw/zinc/39/66/36/331396636.db2.gz	MZUDUONHOQHTSY-UAGQMJEPSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NC1(c2ccc(F)cc2)CCCC1	ZINC000466427964	331396785	/nfs/dbraw/zinc/39/67/85/331396785.db2.gz	GQJWSQNZOZGZNB-AWEZNQCLSA-N	0	0	289.394	4.314	20	30		CIEDRN
CC#CCCCC(=O)N(CCC)c1ccc(Cl)cc1	ZINC000466427614	331396798	/nfs/dbraw/zinc/39/67/98/331396798.db2.gz	BWEWLDWPRBZNGM-UHFFFAOYSA-N	0	0	277.795	4.277	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CCC)CCc1cccc(F)c1	ZINC000466427670	331396819	/nfs/dbraw/zinc/39/68/19/331396819.db2.gz	CHWMANSHDQTMBL-HNNXBMFYSA-N	0	0	291.410	4.209	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H]1CCCCC	ZINC000466428480	331396844	/nfs/dbraw/zinc/39/68/44/331396844.db2.gz	NGXFOGVDONCYTO-LSDHHAIUSA-N	0	0	251.414	4.160	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](c1ccccc1C)C1CC1	ZINC000466433690	331396886	/nfs/dbraw/zinc/39/68/86/331396886.db2.gz	FLVXMDZPMBYRBA-YOEHRIQHSA-N	0	0	271.404	4.165	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)[C@@H](C)CC(=C)C	ZINC000466439269	331397086	/nfs/dbraw/zinc/39/70/86/331397086.db2.gz	WJWMCPCTGSJGLU-HNNXBMFYSA-N	0	0	263.425	4.184	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CCC[C@H]1Cc1ccccc1	ZINC000466444661	331397364	/nfs/dbraw/zinc/39/73/64/331397364.db2.gz	YJMLNPBCKFQQFN-RYQLBKOJSA-N	0	0	285.431	4.116	20	30		CIEDRN
CC(=O)c1ccc(C#N)cc1N1CC(C)(C)CC(C)(C)C1	ZINC000466468945	331397868	/nfs/dbraw/zinc/39/78/68/331397868.db2.gz	NEENQMVYZQKYSO-UHFFFAOYSA-N	0	0	284.403	4.023	20	30		CIEDRN
N#Cc1ccc(SCc2ccc(F)cc2F)cc1	ZINC000466488598	331398358	/nfs/dbraw/zinc/39/83/58/331398358.db2.gz	MDUJZOXGNFQWFQ-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1ccc(-c2ccccc2)nc1C	ZINC000466525032	331398955	/nfs/dbraw/zinc/39/89/55/331398955.db2.gz	FPPYWWGUCAXYDI-INIZCTEOSA-N	0	0	294.398	4.142	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1ccccc1CSCC	ZINC000466525231	331398989	/nfs/dbraw/zinc/39/89/89/331398989.db2.gz	AEBCTOTVEFPLQJ-CQSZACIVSA-N	0	0	277.433	4.024	20	30		CIEDRN
C=CCC[C@@H](C(=O)N[C@@H](CC)CC=C)c1ccccc1	ZINC000466529290	331399171	/nfs/dbraw/zinc/39/91/71/331399171.db2.gz	JXUZYMHSKUPTCD-DLBZAZTESA-N	0	0	271.404	4.207	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)C1(c2cccc(F)c2)CCCC1	ZINC000466530642	331399218	/nfs/dbraw/zinc/39/92/18/331399218.db2.gz	WBRGUQXCDGGMBR-MRXNPFEDSA-N	0	0	289.394	4.108	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@@H](c1ccccc1)[C@@H](C)CC	ZINC000466532270	331399290	/nfs/dbraw/zinc/39/92/90/331399290.db2.gz	WMXSFPJWILDSGX-BHYGNILZSA-N	0	0	273.420	4.287	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)C1(Cc2ccc(Cl)cc2)CC1	ZINC000466536461	331399404	/nfs/dbraw/zinc/39/94/04/331399404.db2.gz	ORMLCXADOWXMEE-HNNXBMFYSA-N	0	0	291.822	4.134	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)C(C)(C)c1cccc(Cl)c1	ZINC000466536526	331399429	/nfs/dbraw/zinc/39/94/29/331399429.db2.gz	PDSBMRGDWLAVDK-CQSZACIVSA-N	0	0	279.811	4.089	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1ncc(C2CCCCC2)s1	ZINC000466627636	331400846	/nfs/dbraw/zinc/40/08/46/331400846.db2.gz	MOMYIWIVCNAQIG-UHFFFAOYSA-N	0	0	293.436	4.231	20	30		CIEDRN
C=CCCN(C)C(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1Cl	ZINC000466641290	331401298	/nfs/dbraw/zinc/40/12/98/331401298.db2.gz	SEGAKALPCRBRBA-NWDGAFQWSA-N	0	0	298.213	4.131	20	30		CIEDRN
C=CCCN(C)C(=O)N[C@H](CCC)CCc1ccccc1	ZINC000466783215	331404811	/nfs/dbraw/zinc/40/48/11/331404811.db2.gz	UPPWMTXCAUPHII-QGZVFWFLSA-N	0	0	288.435	4.005	20	30		CIEDRN
CC#CCCCC(=O)N(c1ccccc1)C1CCCC1	ZINC000466877676	331407046	/nfs/dbraw/zinc/40/70/46/331407046.db2.gz	NRTINXFVGBGRMI-UHFFFAOYSA-N	0	0	269.388	4.156	20	30		CIEDRN
C=CCCN(C)C(=O)N[C@H](c1cccc(C)c1)C(C)(C)C	ZINC000466965259	331409262	/nfs/dbraw/zinc/40/92/62/331409262.db2.gz	PQYJZKQPTJMQBB-MRXNPFEDSA-N	0	0	288.435	4.300	20	30		CIEDRN
C=CCCN(C)C(=O)N[C@@H](CC(C)(C)C)c1ccccc1	ZINC000466974576	331409492	/nfs/dbraw/zinc/40/94/92/331409492.db2.gz	LGGQHRDRRYTGMG-INIZCTEOSA-N	0	0	288.435	4.381	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H]1CCC[C@@H]1CCCC	ZINC000467360651	331416222	/nfs/dbraw/zinc/41/62/22/331416222.db2.gz	YXQZAUFNPNMFHN-HOCLYGCPSA-N	0	0	263.425	4.230	20	30		CIEDRN
C=CCC(CC=C)C(=O)NCCCCC(C)(C)C	ZINC000467366902	331416429	/nfs/dbraw/zinc/41/64/29/331416429.db2.gz	BJFHQIMOMLTGTK-UHFFFAOYSA-N	0	0	251.414	4.087	20	30		CIEDRN
C=CCC(CC=C)C(=O)NCCc1csc2ccccc12	ZINC000467367912	331416521	/nfs/dbraw/zinc/41/65/21/331416521.db2.gz	FCDUBJBARDORCY-UHFFFAOYSA-N	0	0	299.439	4.328	20	30		CIEDRN
Cc1cccnc1[C@@H]1CCC[C@H](Nc2cccc(C#N)c2)C1	ZINC000467429170	331418693	/nfs/dbraw/zinc/41/86/93/331418693.db2.gz	KVIHLFTXGBBPKX-AEFFLSMTSA-N	0	0	291.398	4.400	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@@H]1Cc1ccccc1C	ZINC000467529239	331421202	/nfs/dbraw/zinc/42/12/02/331421202.db2.gz	LJAWGVAMITZTKB-LJQANCHMSA-N	0	0	297.442	4.297	20	30		CIEDRN
C=CCC(CC=C)c1nc(-c2ccc(F)c(F)c2)no1	ZINC000467767002	331424033	/nfs/dbraw/zinc/42/40/33/331424033.db2.gz	FTZLHCKEOYGIRT-UHFFFAOYSA-N	0	0	276.286	4.251	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(F)cc1NC(C)C	ZINC000467783349	331424097	/nfs/dbraw/zinc/42/40/97/331424097.db2.gz	DZIQRJYWGHKGRK-GFCCVEGCSA-N	0	0	278.371	4.187	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)C1CCC(CC)CC1	ZINC000467820843	331424321	/nfs/dbraw/zinc/42/43/21/331424321.db2.gz	HXWIISSUFZBUKS-UHFFFAOYSA-N	0	0	263.425	4.182	20	30		CIEDRN
C=CCCC(=O)N[C@H]1C[C@H](c2ccc(Cl)c(Cl)c2)C1	ZINC000467828068	331424349	/nfs/dbraw/zinc/42/43/49/331424349.db2.gz	IDISBJQQHRTXFG-HAQNSBGRSA-N	0	0	298.213	4.322	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC)c1cccc(C)c1	ZINC000467817186	331424373	/nfs/dbraw/zinc/42/43/73/331424373.db2.gz	ZPVJRIVKWCIRLX-UHFFFAOYSA-N	0	0	257.377	4.116	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC1CC1)C1CCCCC1	ZINC000467839451	331424482	/nfs/dbraw/zinc/42/44/82/331424482.db2.gz	PEBPVQOQOIDOHH-UHFFFAOYSA-N	0	0	275.436	4.326	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H](c1ccccc1)C1CCC1	ZINC000467839081	331424495	/nfs/dbraw/zinc/42/44/95/331424495.db2.gz	BIQKPTIAHZDKPC-GOSISDBHSA-N	0	0	283.415	4.412	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H](C)c1ccc2ncsc2c1	ZINC000467881212	331425173	/nfs/dbraw/zinc/42/51/73/331425173.db2.gz	XLSFHKFKNDNICX-BDJLRTHQSA-N	0	0	288.416	4.076	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CC[C@](C)(CCc2ccccc2)C1	ZINC000467993826	331426481	/nfs/dbraw/zinc/42/64/81/331426481.db2.gz	IUDZTIYOEURIPE-VQTJNVASSA-N	0	0	299.458	4.460	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cccc(N(C)C(C)C)c1	ZINC000468002787	331426573	/nfs/dbraw/zinc/42/65/73/331426573.db2.gz	GHJFFLQDJJJTJK-KRWDZBQOSA-N	0	0	274.408	4.072	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)NCc1ccc2ccccc2c1	ZINC000468013471	331426651	/nfs/dbraw/zinc/42/66/51/331426651.db2.gz	HASWTOXHGQMWKX-GOSISDBHSA-N	0	0	267.372	4.058	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@@H](C)c1cccc(C)c1C	ZINC000468011739	331426653	/nfs/dbraw/zinc/42/66/53/331426653.db2.gz	MTAUKBKAZJHOBY-YOEHRIQHSA-N	0	0	259.393	4.083	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H](C(C)(C)C)CC1	ZINC000468010681	331426654	/nfs/dbraw/zinc/42/66/54/331426654.db2.gz	AOGHIZLKMITVHK-PBHICJAKSA-N	0	0	265.441	4.264	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cc(CC)ccc1CC	ZINC000468017755	331426727	/nfs/dbraw/zinc/42/67/27/331426727.db2.gz	VLXSVBGODYESBT-KRWDZBQOSA-N	0	0	259.393	4.352	20	30		CIEDRN
C=CCCN(C)C(=O)C/C=C\c1ccc(C(C)C)cc1	ZINC000468183459	331429765	/nfs/dbraw/zinc/42/97/65/331429765.db2.gz	OZTGUMQDAYDBMA-FPLPWBNLSA-N	0	0	271.404	4.248	20	30		CIEDRN
C=CCCCNC(=O)c1ccc(C(C)(C)C(F)(F)F)cc1	ZINC000468372952	331433102	/nfs/dbraw/zinc/43/31/02/331433102.db2.gz	OQOXDZUNZNMHLS-UHFFFAOYSA-N	0	0	299.336	4.223	20	30		CIEDRN
CCc1ccc([C@H](NC(=O)CC(C)(C)C#N)C(C)C)cc1	ZINC000498271781	331433449	/nfs/dbraw/zinc/43/34/49/331433449.db2.gz	JKPQOBWFBIVSGY-QGZVFWFLSA-N	0	0	286.419	4.002	20	30		CIEDRN
Cc1sccc1CC(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000468401195	331434126	/nfs/dbraw/zinc/43/41/26/331434126.db2.gz	BGWCHHZCQYIWBS-UHFFFAOYSA-N	0	0	298.411	4.039	20	30		CIEDRN
C=CCCCNC(=O)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl	ZINC000468402525	331434228	/nfs/dbraw/zinc/43/42/28/331434228.db2.gz	KILHCMKTWALFNV-CHWSQXEVSA-N	0	0	298.213	4.179	20	30		CIEDRN
CC[C@@H](Sc1cccc(C#N)c1)C(=O)c1ccccc1	ZINC000468639964	331438066	/nfs/dbraw/zinc/43/80/66/331438066.db2.gz	VEQRDDWVPIUOMW-MRXNPFEDSA-N	0	0	281.380	4.312	20	30		CIEDRN
Cc1ccc2oc(SCc3ccc(F)c(C#N)c3)nc2c1	ZINC000468643467	331438122	/nfs/dbraw/zinc/43/81/22/331438122.db2.gz	ZFHXASDFOIRRHZ-UHFFFAOYSA-N	0	0	298.342	4.439	20	30		CIEDRN
COC(C)(C)CCS[C@@H](C)c1ccc(C#N)cc1	ZINC000468649232	331438207	/nfs/dbraw/zinc/43/82/07/331438207.db2.gz	BIWNILYWJYXCJQ-LBPRGKRZSA-N	0	0	263.406	4.168	20	30		CIEDRN
CCC(C)(C)c1ccc(NC(=O)C2(C#N)CCC2)cc1	ZINC000468736016	331439082	/nfs/dbraw/zinc/43/90/82/331439082.db2.gz	FAYIUXZFJPZPOV-UHFFFAOYSA-N	0	0	270.376	4.007	20	30		CIEDRN
CCC(CC)CC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1	ZINC000468909505	331442220	/nfs/dbraw/zinc/44/22/20/331442220.db2.gz	KWLNRJBPFQDJSV-ROUUACIJSA-N	0	0	298.430	4.111	20	30		CIEDRN
N#Cc1ccc(F)cc1COc1cc(Cl)ccc1F	ZINC000468955688	331443080	/nfs/dbraw/zinc/44/30/80/331443080.db2.gz	LZLXBRXIZICASL-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
N#Cc1ccc(SCc2cc(F)ccc2C#N)c(F)c1	ZINC000468961702	331443304	/nfs/dbraw/zinc/44/33/04/331443304.db2.gz	NXIXMDFCGICCQY-UHFFFAOYSA-N	0	0	286.306	4.000	20	30		CIEDRN
CC(C)c1ccc(NC(=O)c2ccc(F)c(C#N)c2)cc1	ZINC000469057037	331444932	/nfs/dbraw/zinc/44/49/32/331444932.db2.gz	VJSUUZYZOYAHBX-UHFFFAOYSA-N	0	0	282.318	4.073	20	30		CIEDRN
C=CC1CCN(C(=O)c2cc3ccccc3n2CCC)CC1	ZINC000469098629	331445647	/nfs/dbraw/zinc/44/56/47/331445647.db2.gz	YVDOHPGPZNIUMW-UHFFFAOYSA-N	0	0	296.414	4.090	20	30		CIEDRN
COc1cc(COc2cc(C#N)ccc2C)ccc1SC	ZINC000469188886	331447303	/nfs/dbraw/zinc/44/73/03/331447303.db2.gz	FTCTWDGZPPASFL-UHFFFAOYSA-N	0	0	299.395	4.176	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)CCC[C@@H](C)c1cccc(OC)c1	ZINC000469256359	331448430	/nfs/dbraw/zinc/44/84/30/331448430.db2.gz	IQMRFSQFYIFJBT-HUUCEWRRSA-N	0	0	289.419	4.050	20	30		CIEDRN
Cc1ccc(C#N)cc1OCc1cccc(OC(F)F)c1	ZINC000469332161	331449782	/nfs/dbraw/zinc/44/97/82/331449782.db2.gz	HBZMAOZLZVGIQD-UHFFFAOYSA-N	0	0	289.281	4.047	20	30		CIEDRN
C=CCCCN(C)C(=O)c1cccc2c1ccn2CC(C)C	ZINC000469457268	331452038	/nfs/dbraw/zinc/45/20/38/331452038.db2.gz	PUHRDZCSWNLNFE-UHFFFAOYSA-N	0	0	298.430	4.336	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)C[C@H]1CCC[C@@H]1C	ZINC000469725519	331456198	/nfs/dbraw/zinc/45/61/98/331456198.db2.gz	OFYHFOBSTDYOJF-DOTOQJQBSA-N	0	0	271.404	4.028	20	30		CIEDRN
C=CCCCCNC(=O)[C@H](C)Oc1cccc2ccccc21	ZINC000469785380	331458693	/nfs/dbraw/zinc/45/86/93/331458693.db2.gz	BJDFYDXPXYRMGE-HNNXBMFYSA-N	0	0	297.398	4.080	20	30		CIEDRN
C=C[C@H](CC(=O)NC1CCC2(CC2)CC1)c1ccccc1	ZINC000470106052	331471819	/nfs/dbraw/zinc/47/18/19/331471819.db2.gz	SCMOUUULLLUODU-OAHLLOKOSA-N	0	0	283.415	4.185	20	30		CIEDRN
CC(C)[C@@H]1CCC[C@@H](NC(=O)c2cccc(CC#N)c2)CC1	ZINC000470200192	331475304	/nfs/dbraw/zinc/47/53/04/331475304.db2.gz	KNXJIKNKYUYGPK-SJLPKXTDSA-N	0	0	298.430	4.087	20	30		CIEDRN
C=CC[C@H]1N(C(=O)c2ccc(F)c(F)c2)CCCC1(C)C	ZINC000470270829	331477187	/nfs/dbraw/zinc/47/71/87/331477187.db2.gz	NUGCOSRCIWRBAE-OAHLLOKOSA-N	0	0	293.357	4.172	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)c2ccc(Cl)o2)CCCC1(C)C	ZINC000470284499	331477806	/nfs/dbraw/zinc/47/78/06/331477806.db2.gz	HKRMMXFLCJWEPJ-LBPRGKRZSA-N	0	0	281.783	4.140	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)Cc2ccsc2C)CCCC1(C)C	ZINC000470283327	331477860	/nfs/dbraw/zinc/47/78/60/331477860.db2.gz	MWAVLLVBIKOWIA-HNNXBMFYSA-N	0	0	291.460	4.192	20	30		CIEDRN
C=CC[C@H]1N(C(=O)c2ccc3[nH]ccc3c2)CCCC1(C)C	ZINC000470288989	331478092	/nfs/dbraw/zinc/47/80/92/331478092.db2.gz	QYUBDDMFSAYGHN-QGZVFWFLSA-N	0	0	296.414	4.375	20	30		CIEDRN
N#Cc1cnccc1/C=C\c1ccc(C(F)(F)F)cc1	ZINC000470286960	331478161	/nfs/dbraw/zinc/47/81/61/331478161.db2.gz	OSXLMVSGEZRXDK-RJRFIUFISA-N	0	0	274.245	4.142	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1C[C@@H](c2ccc(C)cc2)C[C@@H]1C	ZINC000470573618	331485605	/nfs/dbraw/zinc/48/56/05/331485605.db2.gz	KJDASCNEBZIGAH-LPHOPBHVSA-N	0	0	297.442	4.468	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)CCc1ccccc1	ZINC000470650849	331486870	/nfs/dbraw/zinc/48/68/70/331486870.db2.gz	VCMCRISTDRVUDZ-UHFFFAOYSA-N	0	0	293.410	4.224	20	30		CIEDRN
C=CC[C@H](C(=O)N1CCCC2(CCC2)C1)c1ccccc1	ZINC000470689250	331487412	/nfs/dbraw/zinc/48/74/12/331487412.db2.gz	PLHCJHPAPXKZNZ-KRWDZBQOSA-N	0	0	283.415	4.139	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@@H](C(C)C)C(F)(F)F)c1ccccc1	ZINC000470782222	331491202	/nfs/dbraw/zinc/49/12/02/331491202.db2.gz	RWNYJFHLYYMXOA-KBPBESRZSA-N	0	0	299.336	4.049	20	30		CIEDRN
Cc1cc(/C=C/c2ccc(C#N)cn2)ccc1Br	ZINC000470874160	331493446	/nfs/dbraw/zinc/49/34/46/331493446.db2.gz	UHYXWPMUPCRXFQ-GORDUTHDSA-N	0	0	299.171	4.195	20	30		CIEDRN
CC(C)c1ccc(CN(C)C(=O)c2ccc(C#N)s2)cc1	ZINC000470943063	331496272	/nfs/dbraw/zinc/49/62/72/331496272.db2.gz	CDQSLYDXVCQHTI-UHFFFAOYSA-N	0	0	298.411	4.015	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)CCCC1CCCC1	ZINC000471173522	331503497	/nfs/dbraw/zinc/50/34/97/331503497.db2.gz	PNDBLIPXSOZQDV-UHFFFAOYSA-N	0	0	278.440	4.278	20	30		CIEDRN
CC(C)CN(Cc1cc(C#N)ccc1F)c1cccc(O)c1	ZINC000471189963	331503657	/nfs/dbraw/zinc/50/36/57/331503657.db2.gz	BGDKTSYVFXNJEQ-UHFFFAOYSA-N	0	0	298.361	4.066	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@@H](c2ccc(C)cc2C)C1	ZINC000471335013	331506831	/nfs/dbraw/zinc/50/68/31/331506831.db2.gz	GBOFMVLEWOQGMC-GOSISDBHSA-N	0	0	297.442	4.388	20	30		CIEDRN
C=CCCCCNC(=O)c1cc2cc(Cl)ccc2o1	ZINC000471668542	331514691	/nfs/dbraw/zinc/51/46/91/331514691.db2.gz	KWTRGJMCAWLLEF-UHFFFAOYSA-N	0	0	277.751	4.172	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)c2cccc(C)c2F)c1	ZINC000471696189	331516089	/nfs/dbraw/zinc/51/60/89/331516089.db2.gz	GDBVJRNBMPFWRE-UHFFFAOYSA-N	0	0	299.345	4.341	20	30		CIEDRN
CCN(Cc1ccc(C#N)cc1)c1ccc2[nH]ccc2c1	ZINC000471812674	331521482	/nfs/dbraw/zinc/52/14/82/331521482.db2.gz	WKIVABVEQCZOIS-UHFFFAOYSA-N	0	0	275.355	4.066	20	30		CIEDRN
C=C1CCN(C(=O)[C@H](C)c2ccc(Cl)c(Cl)c2)CC1	ZINC000471870031	331522723	/nfs/dbraw/zinc/52/27/23/331522723.db2.gz	LWCQEAJZOQOKMO-LLVKDONJSA-N	0	0	298.213	4.276	20	30		CIEDRN
C=C(C)COc1cccc(NCc2ncc(Cl)s2)c1	ZINC000472074466	331528519	/nfs/dbraw/zinc/52/85/19/331528519.db2.gz	MIOKLTUIMVVVGT-UHFFFAOYSA-N	0	0	294.807	4.364	20	30		CIEDRN
C=CCC[C@@H](O)CN(Cc1ccsc1)c1ccccc1	ZINC000472682041	331541262	/nfs/dbraw/zinc/54/12/62/331541262.db2.gz	HKWWWYFDZYKOOT-QGZVFWFLSA-N	0	0	287.428	4.082	20	30		CIEDRN
C=CCCCC(=O)N1CCCC[C@@H]1CCC(C)C	ZINC000472711507	331541587	/nfs/dbraw/zinc/54/15/87/331541587.db2.gz	DWEDZIKXFNXVCL-OAHLLOKOSA-N	0	0	251.414	4.160	20	30		CIEDRN
C=CCCCCNC(=O)N[C@@H](C)c1cc(C)sc1C	ZINC000472768868	331542908	/nfs/dbraw/zinc/54/29/08/331542908.db2.gz	OIBSJGORVBOTDN-LBPRGKRZSA-N	0	0	280.437	4.081	20	30		CIEDRN
CCSc1cccc(CNc2cccc(C#N)c2)c1	ZINC000473137958	331548150	/nfs/dbraw/zinc/54/81/50/331548150.db2.gz	GUXLHWGJGHGKNG-UHFFFAOYSA-N	0	0	268.385	4.282	20	30		CIEDRN
C=CCCCCNC(=O)Nc1c(C)cccc1CC	ZINC000473499078	331552099	/nfs/dbraw/zinc/55/20/99/331552099.db2.gz	QOUDXILIHCBJKG-UHFFFAOYSA-N	0	0	260.381	4.035	20	30		CIEDRN
C[C@H](CCOc1cccc(F)c1C#N)OCc1ccccc1	ZINC000473673956	331555417	/nfs/dbraw/zinc/55/54/17/331555417.db2.gz	DIQPSSOWWWOGPE-CQSZACIVSA-N	0	0	299.345	4.072	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)[C@H]2CC23CCCC3)c1	ZINC000474404206	331584681	/nfs/dbraw/zinc/58/46/81/331584681.db2.gz	UXVMPKKQXBKLJD-MRXNPFEDSA-N	0	0	285.387	4.160	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@@H]1CCCC[C@H]1CC	ZINC000474432080	331586728	/nfs/dbraw/zinc/58/67/28/331586728.db2.gz	PICZHYJHDDUTEZ-GDBMZVCRSA-N	0	0	291.460	4.479	20	30		CIEDRN
CN(C(=O)C[C@@H](CC#N)c1ccccc1)C1CCCCCC1	ZINC000474584055	331590753	/nfs/dbraw/zinc/59/07/53/331590753.db2.gz	WMFOSBCMKYIBSO-QGZVFWFLSA-N	0	0	298.430	4.255	20	30		CIEDRN
C=CCCC1(C(=O)NCc2cccc3ccccc32)CC1	ZINC000474715905	331595695	/nfs/dbraw/zinc/59/56/95/331595695.db2.gz	RKWBIGIDPYOCJF-UHFFFAOYSA-N	0	0	279.383	4.202	20	30		CIEDRN
C=CCCC1(C(=O)N2CC[C@H](c3ccccc3C)C2)CC1	ZINC000475465484	331632371	/nfs/dbraw/zinc/63/23/71/331632371.db2.gz	XYSGEYSGMLJLKB-INIZCTEOSA-N	0	0	283.415	4.057	20	30		CIEDRN
CCN(C(=O)[C@H]1CCCC1(C)C)[C@@H](C)c1ccc(C#N)cc1	ZINC000475614649	331639518	/nfs/dbraw/zinc/63/95/18/331639518.db2.gz	WSFOJDGXOOJQQD-WMLDXEAASA-N	0	0	298.430	4.294	20	30		CIEDRN
CC[C@@H](NC(=O)c1ccc(C(C)(C)C#N)cc1)C(C)(C)C	ZINC000475651508	331640238	/nfs/dbraw/zinc/64/02/38/331640238.db2.gz	PVGUSIGOCJOCCR-OAHLLOKOSA-N	0	0	286.419	4.042	20	30		CIEDRN
C=CCCCC(=O)N(C)[C@H]1CCC[C@@H]1c1ccc(C)cc1	ZINC000475653341	331640339	/nfs/dbraw/zinc/64/03/39/331640339.db2.gz	VKPZAEVIKXQOLC-MSOLQXFVSA-N	0	0	285.431	4.446	20	30		CIEDRN
C=CCCC1(C(=O)N2CCC[C@@H](Cc3ccccc3)C2)CC1	ZINC000475660935	331640490	/nfs/dbraw/zinc/64/04/90/331640490.db2.gz	ZHRNVVIOBXYZIQ-SFHVURJKSA-N	0	0	297.442	4.214	20	30		CIEDRN
CC(C)(C)[C@@H]1CCCN1C(=O)C[C@H](CC#N)c1ccccc1	ZINC000475658413	331640545	/nfs/dbraw/zinc/64/05/45/331640545.db2.gz	CTPLSUGSVSHZDE-IRXDYDNUSA-N	0	0	298.430	4.111	20	30		CIEDRN
C=C(C)[C@H](NC(=O)[C@H]1C[C@]1(C)CC)c1ccc(F)c(F)c1	ZINC000475661216	331640643	/nfs/dbraw/zinc/64/06/43/331640643.db2.gz	LQUMMJSJCIHKEI-PVUWLOKVSA-N	0	0	293.357	4.134	20	30		CIEDRN
C=C(C)[C@@H](NC(=O)[C@H](C)CCC)c1ccc(F)c(F)c1	ZINC000475675102	331641647	/nfs/dbraw/zinc/64/16/47/331641647.db2.gz	GLMQKZXKEGDDHL-IAQYHMDHSA-N	0	0	281.346	4.134	20	30		CIEDRN
C[C@@H](CNc1ccc(C(F)(F)F)cc1C#N)C(F)(F)F	ZINC000475717761	331642873	/nfs/dbraw/zinc/64/28/73/331642873.db2.gz	BLPZYJDQFWRDPU-ZETCQYMHSA-N	0	0	296.214	4.187	20	30		CIEDRN
C=C(C)[C@H](Nc1ncccc1F)c1ccc(F)c(F)c1	ZINC000475723802	331643389	/nfs/dbraw/zinc/64/33/89/331643389.db2.gz	QNCFAOCRFSVLMT-AWEZNQCLSA-N	0	0	278.277	4.228	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)C[C@@H]1CCC[C@H](C)C1	ZINC000475742469	331644552	/nfs/dbraw/zinc/64/45/52/331644552.db2.gz	QMOJJYKDSFUZOQ-LSDHHAIUSA-N	0	0	278.440	4.182	20	30		CIEDRN
Cc1cc(C#N)ccc1C(=O)Nc1ccc(C2CC2)c(C)c1	ZINC000475845208	331645597	/nfs/dbraw/zinc/64/55/97/331645597.db2.gz	CPHDXDNTGQHLII-UHFFFAOYSA-N	0	0	290.366	4.305	20	30		CIEDRN
CCCC[C@H](S[C@H](C)c1ccc(C#N)cc1)C(=O)OC	ZINC000475871311	331646598	/nfs/dbraw/zinc/64/65/98/331646598.db2.gz	VBPGILOBIVGSQH-DOMZBBRYSA-N	0	0	291.416	4.084	20	30		CIEDRN
C=CCCC1(C(=O)N[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000475900253	331648095	/nfs/dbraw/zinc/64/80/95/331648095.db2.gz	PWXLXGFKTZEYDN-DLBZAZTESA-N	0	0	283.415	4.185	20	30		CIEDRN
C=CCOCCCSc1cc(C)c2ccccc2n1	ZINC000475942002	331649293	/nfs/dbraw/zinc/64/92/93/331649293.db2.gz	RREROOSGYAYQSC-UHFFFAOYSA-N	0	0	273.401	4.228	20	30		CIEDRN
N#Cc1ccc(OCc2cccc(C(F)F)c2)cc1F	ZINC000475986066	331650584	/nfs/dbraw/zinc/65/05/84/331650584.db2.gz	JFNPHLAQRHLAMD-UHFFFAOYSA-N	0	0	277.245	4.214	20	30		CIEDRN
C=CCOCCCS[C@H](C)c1ccccc1OC	ZINC000475989204	331650735	/nfs/dbraw/zinc/65/07/35/331650735.db2.gz	ZKYIRPHVLGINSF-CYBMUJFWSA-N	0	0	266.406	4.082	20	30		CIEDRN
CC(C)(C(=O)CSc1ccc(C#N)cc1)c1ccccc1	ZINC000475999115	331651058	/nfs/dbraw/zinc/65/10/58/331651058.db2.gz	QQIMRGBOUJLXNT-UHFFFAOYSA-N	0	0	295.407	4.197	20	30		CIEDRN
CC(C)(CC(=O)N(CC#N)C1CCCC1)C1CCCCC1	ZINC000476082312	331653976	/nfs/dbraw/zinc/65/39/76/331653976.db2.gz	BZFRFYRNZCMFGG-UHFFFAOYSA-N	0	0	290.451	4.278	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1coc2cc(F)ccc12	ZINC000476089957	331654667	/nfs/dbraw/zinc/65/46/67/331654667.db2.gz	KCWOQITWZLVDNI-UHFFFAOYSA-N	0	0	289.350	4.390	20	30		CIEDRN
CCC[C@@H]1CCCN(C(=O)C[C@H](CC#N)c2ccccc2)C1	ZINC000476297895	331660497	/nfs/dbraw/zinc/66/04/97/331660497.db2.gz	DLBWPQDJDJVUAR-AEFFLSMTSA-N	0	0	298.430	4.113	20	30		CIEDRN
CCC[C@H]1CCCN(C(=O)c2ccc(C(C)(C)C#N)cc2)C1	ZINC000476304904	331660833	/nfs/dbraw/zinc/66/08/33/331660833.db2.gz	WXPHNHLHCQXXOW-HNNXBMFYSA-N	0	0	298.430	4.140	20	30		CIEDRN
C=CCCC1(C(=O)N2CCSC3(CCCCC3)C2)CC1	ZINC000476307397	331661013	/nfs/dbraw/zinc/66/10/13/331661013.db2.gz	SLUONMIVMRWWHX-UHFFFAOYSA-N	0	0	293.476	4.011	20	30		CIEDRN
CC[C@@H](c1ccc(Cl)cc1)N1CCC(F)(C#N)CC1	ZINC000510964452	332922225	/nfs/dbraw/zinc/92/22/25/332922225.db2.gz	BTQIPULQUXQUEJ-AWEZNQCLSA-N	0	0	280.774	4.119	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cccc(SC)c2C)CC1	ZINC000476557604	331666430	/nfs/dbraw/zinc/66/64/30/331666430.db2.gz	AJCMIDLTGNEEFQ-UHFFFAOYSA-N	0	0	275.417	4.402	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N1C[C@H](C)c2ccccc21	ZINC000476785904	331669690	/nfs/dbraw/zinc/66/96/90/331669690.db2.gz	CYTFNLRWCSGBRK-ZDUSSCGKSA-N	0	0	291.354	4.022	20	30		CIEDRN
CCC[C@H](CC)S[C@@H](C)C(=O)Nc1ccccc1C#N	ZINC000477055966	331674410	/nfs/dbraw/zinc/67/44/10/331674410.db2.gz	IHTKITMSZRFYGI-JSGCOSHPSA-N	0	0	290.432	4.197	20	30		CIEDRN
C=CCCC1(C(=O)N2C[C@@H](c3ccc(C)cc3)C[C@H]2C)CC1	ZINC000477095620	331676136	/nfs/dbraw/zinc/67/61/36/331676136.db2.gz	YQBGVBNNNXLVDO-AEFFLSMTSA-N	0	0	297.442	4.446	20	30		CIEDRN
C=CCCC1(C(=O)N2C[C@H](c3ccc(C)cc3)C[C@H]2C)CC1	ZINC000477095633	331676214	/nfs/dbraw/zinc/67/62/14/331676214.db2.gz	YQBGVBNNNXLVDO-SJLPKXTDSA-N	0	0	297.442	4.446	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1cc(C)c(Cl)cc1C	ZINC000477114326	331676891	/nfs/dbraw/zinc/67/68/91/331676891.db2.gz	PKPKCNZLSCVCGM-ZDUSSCGKSA-N	0	0	277.795	4.138	20	30		CIEDRN
C=CCCCC(=O)N(CC)C[C@H](CC)c1ccccc1	ZINC000477247463	331679966	/nfs/dbraw/zinc/67/99/66/331679966.db2.gz	IASPYVFPZOMOHW-INIZCTEOSA-N	0	0	273.420	4.385	20	30		CIEDRN
N#Cc1ccc(-c2ccccc2)nc1SCC1CC1	ZINC000477525680	331686242	/nfs/dbraw/zinc/68/62/42/331686242.db2.gz	JALIVLPDWOKIFK-UHFFFAOYSA-N	0	0	266.369	4.122	20	30		CIEDRN
N#Cc1ccc(SCCc2ccc3ccccc3c2)nc1	ZINC000511001180	332923520	/nfs/dbraw/zinc/92/35/20/332923520.db2.gz	IVUVKXJPKNXQDX-UHFFFAOYSA-N	0	0	290.391	4.441	20	30		CIEDRN
C[C@H](Nc1ncc(C(F)(F)F)s1)c1ccc(C#N)cc1	ZINC000477730455	331689404	/nfs/dbraw/zinc/68/94/04/331689404.db2.gz	JPSZCQOGUZQJEN-QMMMGPOBSA-N	0	0	297.305	4.207	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(Br)cc2)CCC1	ZINC000478266270	331702282	/nfs/dbraw/zinc/70/22/82/331702282.db2.gz	PTEUOIDQKOWLPN-UHFFFAOYSA-N	0	0	294.192	4.134	20	30		CIEDRN
CCOc1ccccc1NCc1ccc(Cl)cc1C#N	ZINC000478339042	331704131	/nfs/dbraw/zinc/70/41/31/331704131.db2.gz	IMZYYTXZNCROEM-UHFFFAOYSA-N	0	0	286.762	4.222	20	30		CIEDRN
C=CCCCC(=O)NC(C)(C)c1ccc(OCCC)cc1	ZINC000478526598	331707875	/nfs/dbraw/zinc/70/78/75/331707875.db2.gz	KSGXWPXJSYOMNB-UHFFFAOYSA-N	0	0	289.419	4.183	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(OCC)c(Cl)c2)CCC1	ZINC000478699648	331711972	/nfs/dbraw/zinc/71/19/72/331711972.db2.gz	DKSKLCVTEPVEOD-UHFFFAOYSA-N	0	0	293.794	4.424	20	30		CIEDRN
COC1(CSc2ccc(C#N)cc2Cl)CCCC1	ZINC000478725032	331712417	/nfs/dbraw/zinc/71/24/17/331712417.db2.gz	TUSLIUAGHQBFHG-UHFFFAOYSA-N	0	0	281.808	4.263	20	30		CIEDRN
Cc1[nH]c2ccc(OCc3ccc(C#N)c(F)c3)cc2c1C	ZINC000478821502	331714976	/nfs/dbraw/zinc/71/49/76/331714976.db2.gz	BGQSBGCMAYCWJH-UHFFFAOYSA-N	0	0	294.329	4.375	20	30		CIEDRN
N#Cc1cc(Cl)ccc1COc1ccc2[nH]ccc2c1	ZINC000478853115	331715626	/nfs/dbraw/zinc/71/56/26/331715626.db2.gz	HQUJZGHCFMZMID-UHFFFAOYSA-N	0	0	282.730	4.272	20	30		CIEDRN
Cc1cc2ncn(Cc3ccc(Cl)cc3C#N)c2cc1C	ZINC000478940340	331717811	/nfs/dbraw/zinc/71/78/11/331717811.db2.gz	UCSBQDZOXOFUMO-UHFFFAOYSA-N	0	0	295.773	4.227	20	30		CIEDRN
N#Cc1ccnc(SCCCCc2ccccc2)c1	ZINC000479189832	331721788	/nfs/dbraw/zinc/72/17/88/331721788.db2.gz	FRYZPDVBKZSYSP-UHFFFAOYSA-N	0	0	268.385	4.068	20	30		CIEDRN
C=C(C)CN(C)C(=O)[C@H](CC)CC1CCCCC1	ZINC000479212268	331721936	/nfs/dbraw/zinc/72/19/36/331721936.db2.gz	HLJVUILCKVREMC-OAHLLOKOSA-N	0	0	251.414	4.018	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1cc2c(s1)CCCCCC2	ZINC000479209433	331721998	/nfs/dbraw/zinc/72/19/98/331721998.db2.gz	BNMUWZOGRMRBFU-UHFFFAOYSA-N	0	0	277.433	4.055	20	30		CIEDRN
Cc1cc(NCc2cc(C#N)cs2)ccc1C1CC1	ZINC000479405983	331727583	/nfs/dbraw/zinc/72/75/83/331727583.db2.gz	GFSORJRVZUCTKC-UHFFFAOYSA-N	0	0	268.385	4.418	20	30		CIEDRN
CCCOc1cc(C)ccc1NCc1ccc(C#N)c(F)c1	ZINC000479479689	331732522	/nfs/dbraw/zinc/73/25/22/331732522.db2.gz	AQZIEDOVRNFDLS-UHFFFAOYSA-N	0	0	298.361	4.407	20	30		CIEDRN
N#Cc1ccc(CSCc2ccc(F)cc2)cc1F	ZINC000479497722	331733529	/nfs/dbraw/zinc/73/35/29/331733529.db2.gz	DRLNCHICLKPCRE-UHFFFAOYSA-N	0	0	275.323	4.270	20	30		CIEDRN
C=CCCCC(=O)N(C)[C@@H](C)c1ccc(C)cc1C	ZINC000479525830	331734985	/nfs/dbraw/zinc/73/49/85/331734985.db2.gz	MHFKZEOPBHJQAV-HNNXBMFYSA-N	0	0	259.393	4.179	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@@H]1CC1CCCCC1	ZINC000479553908	331737182	/nfs/dbraw/zinc/73/71/82/331737182.db2.gz	KXDUODDVSRBBKJ-MRXNPFEDSA-N	0	0	263.425	4.304	20	30		CIEDRN
C=CCOCCCSc1cc(C)nc2ccccc21	ZINC000479579441	331738673	/nfs/dbraw/zinc/73/86/73/331738673.db2.gz	CGTLHPYCVVIBDC-UHFFFAOYSA-N	0	0	273.401	4.228	20	30		CIEDRN
C=CCOCCCSCc1ncc(-c2ccccc2)o1	ZINC000479597976	331739779	/nfs/dbraw/zinc/73/97/79/331739779.db2.gz	BYUGKSQTKSTLOZ-UHFFFAOYSA-N	0	0	289.400	4.168	20	30		CIEDRN
C=CCOCCCSCc1ccc(C#N)cc1Cl	ZINC000479598353	331739972	/nfs/dbraw/zinc/73/99/72/331739972.db2.gz	AQJVQELROPMYDS-UHFFFAOYSA-N	0	0	281.808	4.038	20	30		CIEDRN
C=CCCCC(=O)NCC1(c2ccc(Cl)cc2)CCC1	ZINC000479666069	331742778	/nfs/dbraw/zinc/74/27/78/331742778.db2.gz	LPOOSQXOYGSXRF-UHFFFAOYSA-N	0	0	291.822	4.234	20	30		CIEDRN
C=CCN(CC=C)C(=O)CCc1cc(Cl)cc(Cl)c1	ZINC000479824208	331746631	/nfs/dbraw/zinc/74/66/31/331746631.db2.gz	VCYHCQCUULATCH-UHFFFAOYSA-N	0	0	298.213	4.127	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(OC2CCCC2)c(F)c1	ZINC000479847432	331747789	/nfs/dbraw/zinc/74/77/89/331747789.db2.gz	JCVSEATZNMYFKX-UHFFFAOYSA-N	0	0	291.366	4.442	20	30		CIEDRN
C=CCCCC(=O)N1CCCCC[C@H]1CC(C)C	ZINC000479957934	331752486	/nfs/dbraw/zinc/75/24/86/331752486.db2.gz	MFAQAFJSAFTUQK-HNNXBMFYSA-N	0	0	251.414	4.160	20	30		CIEDRN
C=CCOc1ccc(C(=O)N(CC)CC(CC)CC)cc1	ZINC000480102115	331758153	/nfs/dbraw/zinc/75/81/53/331758153.db2.gz	ZSBGCZHRFLZXFA-UHFFFAOYSA-N	0	0	289.419	4.150	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H](C)Cc2ccc(C)cc2C)CCC1	ZINC000480114261	331758681	/nfs/dbraw/zinc/75/86/81/331758681.db2.gz	VESNFFHWLOKLLC-INIZCTEOSA-N	0	0	285.431	4.097	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](C)[C@@H](C)C1CCCCC1	ZINC000480356555	331769365	/nfs/dbraw/zinc/76/93/65/331769365.db2.gz	VIGBSIFAAPJUKY-KGLIPLIRSA-N	0	0	251.414	4.064	20	30		CIEDRN
COC1CCC(C)(CNc2c(Cl)cccc2C#N)CC1	ZINC000480504664	331775035	/nfs/dbraw/zinc/77/50/35/331775035.db2.gz	WRFONMBROQMTEG-UHFFFAOYSA-N	0	0	292.810	4.219	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1ccc(SCC)cc1	ZINC000480816038	331789272	/nfs/dbraw/zinc/78/92/72/331789272.db2.gz	JRZLDLHLIDMSNX-CYBMUJFWSA-N	0	0	277.433	4.273	20	30		CIEDRN
C=CCCCC(=O)NC(C)(C)c1cccc(C(F)(F)F)c1	ZINC000480866982	331790237	/nfs/dbraw/zinc/79/02/37/331790237.db2.gz	GGVBIPKDZKPEBP-UHFFFAOYSA-N	0	0	299.336	4.413	20	30		CIEDRN
C=CCCCC(=O)NC(C)(C)Cc1ccccc1Cl	ZINC000480887362	331790478	/nfs/dbraw/zinc/79/04/78/331790478.db2.gz	URAFMSUINCGYIN-UHFFFAOYSA-N	0	0	279.811	4.134	20	30		CIEDRN
C=CCn1c(S[C@@H](C)CC)nnc1-c1ccccc1C	ZINC000481373282	331805266	/nfs/dbraw/zinc/80/52/66/331805266.db2.gz	NIWSOIWZESSNBP-ZDUSSCGKSA-N	0	0	287.432	4.330	20	30		CIEDRN
C=C(C)[C@H](N[C@@H](C)c1ncc(C)o1)c1ccc(F)c(F)c1	ZINC000481578109	331809505	/nfs/dbraw/zinc/80/95/05/331809505.db2.gz	BXWFDOPUQHVAEU-NHYWBVRUSA-N	0	0	292.329	4.229	20	30		CIEDRN
CC(C)CC[C@H](O)CSc1ccc(C#N)cc1Cl	ZINC000481708301	331812831	/nfs/dbraw/zinc/81/28/31/331812831.db2.gz	AIFASWSHUDWNBY-LBPRGKRZSA-N	0	0	283.824	4.101	20	30		CIEDRN
N#Cc1ccccc1S[C@H]1CCc2ccc(F)cc21	ZINC000481986041	331820110	/nfs/dbraw/zinc/82/01/10/331820110.db2.gz	ZOXOFOFZAZLJQR-INIZCTEOSA-N	0	0	269.344	4.477	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)[C@H](C)CCC	ZINC000482761224	331845558	/nfs/dbraw/zinc/84/55/58/331845558.db2.gz	KFQMFZJAJVLJFF-CQSZACIVSA-N	0	0	251.414	4.018	20	30		CIEDRN
Cc1c(C#N)cccc1NCc1ccsc1Cl	ZINC000483317102	331869305	/nfs/dbraw/zinc/86/93/05/331869305.db2.gz	BZDATSSYGHABBN-UHFFFAOYSA-N	0	0	262.765	4.194	20	30		CIEDRN
CC#CCCNC(=O)N1CCC[C@@H]1c1ccc(C(C)C)cc1	ZINC000483416644	331873500	/nfs/dbraw/zinc/87/35/00/331873500.db2.gz	KQRIMLNVQAZKJK-GOSISDBHSA-N	0	0	298.430	4.070	20	30		CIEDRN
C=CCOc1cccc(NC(=O)N(CC)C[C@@H](C)CC)c1	ZINC000483450968	331876382	/nfs/dbraw/zinc/87/63/82/331876382.db2.gz	NHJVXOXSEISJGR-AWEZNQCLSA-N	0	0	290.407	4.151	20	30		CIEDRN
CCN(CC#N)Cc1ccc(-c2cccc(Cl)c2)s1	ZINC000511472839	332932815	/nfs/dbraw/zinc/93/28/15/332932815.db2.gz	MSXBJZGIMYYLJN-UHFFFAOYSA-N	0	0	290.819	4.414	20	30		CIEDRN
CCC[C@@](C)(CC)C(=O)N[C@@H](C#N)c1ccc(Cl)cc1	ZINC000483984792	331890557	/nfs/dbraw/zinc/89/05/57/331890557.db2.gz	KJJZHPHTGSTJKF-GOEBONIOSA-N	0	0	292.810	4.237	20	30		CIEDRN
CCC[C@](C)(CC)C(=O)N[C@@H](C#N)c1ccc(Cl)cc1	ZINC000483984793	331890582	/nfs/dbraw/zinc/89/05/82/331890582.db2.gz	KJJZHPHTGSTJKF-HOCLYGCPSA-N	0	0	292.810	4.237	20	30		CIEDRN
CC(C)[C@@H]1C[C@@H]1C(=O)Nc1cc(C(C)(C)C)sc1C#N	ZINC000484128932	331893034	/nfs/dbraw/zinc/89/30/34/331893034.db2.gz	KGZWRFSOGCXDTB-QWRGUYRKSA-N	0	0	290.432	4.148	20	30		CIEDRN
CC(C)[C@H]1C[C@@H]1C(=O)Nc1cc(C(C)(C)C)sc1C#N	ZINC000484128930	331893056	/nfs/dbraw/zinc/89/30/56/331893056.db2.gz	KGZWRFSOGCXDTB-MNOVXSKESA-N	0	0	290.432	4.148	20	30		CIEDRN
CN(C(=O)[C@@H]1CCCC1(C)C)c1cc(Cl)ccc1C#N	ZINC000484321070	331896937	/nfs/dbraw/zinc/89/69/37/331896937.db2.gz	KGBBCTWBHHHUTQ-ZDUSSCGKSA-N	0	0	290.794	4.001	20	30		CIEDRN
C=CC[C@@H](C(=O)N(CC)CC(C)(C)C)c1ccccc1	ZINC000485456930	331914802	/nfs/dbraw/zinc/91/48/02/331914802.db2.gz	OZMWUINFWCZBLX-MRXNPFEDSA-N	0	0	273.420	4.241	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1cccn1C1CCCC1	ZINC000485542214	331916386	/nfs/dbraw/zinc/91/63/86/331916386.db2.gz	JZWDTDIGKUEBHK-AWEZNQCLSA-N	0	0	274.408	4.078	20	30		CIEDRN
C=CCCCC(=O)Nc1cc(Br)c(C)cc1C	ZINC000485646999	331919526	/nfs/dbraw/zinc/91/95/26/331919526.db2.gz	WEUFFYIUFBSATI-UHFFFAOYSA-N	0	0	296.208	4.361	20	30		CIEDRN
C=CCN(Cc1cc(F)cc(Cl)c1)CC(F)(F)F	ZINC000485698965	331920956	/nfs/dbraw/zinc/92/09/56/331920956.db2.gz	ZKEACVPCSGVULV-UHFFFAOYSA-N	0	0	281.680	4.029	20	30		CIEDRN
Cc1c(Cl)cccc1C(=O)N[C@H](C)c1ccc(C#N)cc1	ZINC000485756357	331923361	/nfs/dbraw/zinc/92/33/61/331923361.db2.gz	WJDBSBYCFBUYOV-GFCCVEGCSA-N	0	0	298.773	4.011	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H](CCC)CCCC)CCC1	ZINC000485766053	331923549	/nfs/dbraw/zinc/92/35/49/331923549.db2.gz	ZQEGLYCZURBEGG-AWEZNQCLSA-N	0	0	251.414	4.208	20	30		CIEDRN
COc1ccc2cc(/C=C\c3ncccc3C#N)ccc2c1	ZINC000485975983	331928154	/nfs/dbraw/zinc/92/81/54/331928154.db2.gz	KEDWJNQOZPZLQP-UITAMQMPSA-N	0	0	286.334	4.285	20	30		CIEDRN
C=CCOc1ccc(Oc2nc3c(cccc3F)o2)cc1	ZINC000485984152	331928584	/nfs/dbraw/zinc/92/85/84/331928584.db2.gz	YFVJKGPMDNARED-UHFFFAOYSA-N	0	0	285.274	4.324	20	30		CIEDRN
CCC(CC)CN(CCC#N)c1nc2c(cccc2F)o1	ZINC000485994894	331928982	/nfs/dbraw/zinc/92/89/82/331928982.db2.gz	WCNIUMBHRPSJRV-UHFFFAOYSA-N	0	0	289.354	4.123	20	30		CIEDRN
Cc1ccc(/C=C/c2nc3ccccc3n2CC#N)s1	ZINC000486054569	331930245	/nfs/dbraw/zinc/93/02/45/331930245.db2.gz	PVUKQJDHECRABX-CMDGGOBGSA-N	0	0	279.368	4.100	20	30		CIEDRN
N#Cc1cccnc1/C=C\c1csc(-c2ccccc2)n1	ZINC000486076894	331930873	/nfs/dbraw/zinc/93/08/73/331930873.db2.gz	LUSIZSOZWDFMBX-HJWRWDBZSA-N	0	0	289.363	4.247	20	30		CIEDRN
CC(C)(C#N)CC(=O)Nc1cccc(Oc2ccccc2)c1	ZINC000486351560	331935580	/nfs/dbraw/zinc/93/55/80/331935580.db2.gz	IDGBBWDOAOBNLH-UHFFFAOYSA-N	0	0	294.354	4.357	20	30		CIEDRN
C=CCSc1ccccc1C(=O)NCC1(C(C)C)CC1	ZINC000486427007	331936853	/nfs/dbraw/zinc/93/68/53/331936853.db2.gz	ABBDEFIKCKDCIB-UHFFFAOYSA-N	0	0	289.444	4.131	20	30		CIEDRN
Cc1ccccc1OCc1ccccc1C(C)(C)C#N	ZINC000486880260	331948121	/nfs/dbraw/zinc/94/81/21/331948121.db2.gz	CDKMPEJYVNJVOC-UHFFFAOYSA-N	0	0	265.356	4.375	20	30		CIEDRN
Cc1cscc1C(=O)N(CC(C)C)c1ccc(C#N)cc1	ZINC000486895548	331948601	/nfs/dbraw/zinc/94/86/01/331948601.db2.gz	CQUYICBSMPRVKU-UHFFFAOYSA-N	0	0	298.411	4.231	20	30		CIEDRN
COc1ccc(OCc2ccccc2C(C)(C)C#N)cc1F	ZINC000486903068	331948865	/nfs/dbraw/zinc/94/88/65/331948865.db2.gz	MFIXCAYSQXQPRO-UHFFFAOYSA-N	0	0	299.345	4.214	20	30		CIEDRN
N#Cc1ccncc1N[C@H]1CCC[C@@H](c2ccccc2)C1	ZINC000487116768	331956859	/nfs/dbraw/zinc/95/68/59/331956859.db2.gz	OKHGTIQKPDHLFG-WBVHZDCISA-N	0	0	277.371	4.092	20	30		CIEDRN
N#CCCCC(=O)Nc1ccccc1Nc1ccc(F)cc1	ZINC000487223280	331960024	/nfs/dbraw/zinc/96/00/24/331960024.db2.gz	MKKALGHZNSGSCS-UHFFFAOYSA-N	0	0	297.333	4.202	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H](C)CC2CCCCC2)CCC1	ZINC000487241594	331960592	/nfs/dbraw/zinc/96/05/92/331960592.db2.gz	NZVCQQDPADVMMQ-AWEZNQCLSA-N	0	0	263.425	4.208	20	30		CIEDRN
N#Cc1cc(Cl)cc(OCCCCC(F)(F)F)c1	ZINC000487472374	331971148	/nfs/dbraw/zinc/97/11/48/331971148.db2.gz	LDXVXCCUJNWPSV-UHFFFAOYSA-N	0	0	277.673	4.323	20	30		CIEDRN
C=CC[C@H](C(=O)NCC1CCCCC1)c1ccccc1	ZINC000487555141	331974115	/nfs/dbraw/zinc/97/41/15/331974115.db2.gz	FLTUNTRRKJIFQW-KRWDZBQOSA-N	0	0	271.404	4.043	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@@H](C)CCC(C)C)c1ccccc1	ZINC000487576391	331975763	/nfs/dbraw/zinc/97/57/63/331975763.db2.gz	SBDPBHXMZLYTQE-DOTOQJQBSA-N	0	0	273.420	4.287	20	30		CIEDRN
C=CC[C@H](C(=O)NC[C@@H](C)c1ccccc1)c1ccccc1	ZINC000487624637	331977343	/nfs/dbraw/zinc/97/73/43/331977343.db2.gz	FCRMHJHIPGZPRL-APWZRJJASA-N	0	0	293.410	4.266	20	30		CIEDRN
N#Cc1ccc(NC[C@@H]2SCCc3ccccc32)cc1	ZINC000487639000	331977864	/nfs/dbraw/zinc/97/78/64/331977864.db2.gz	VVQNECDLEBRLLV-KRWDZBQOSA-N	0	0	280.396	4.001	20	30		CIEDRN
C=CCN(CC=C)C(=O)N[C@H]1CCC[C@H](c2ccccc2)C1	ZINC000487753375	331980592	/nfs/dbraw/zinc/98/05/92/331980592.db2.gz	ULLPQNXTERWUSU-ROUUACIJSA-N	0	0	298.430	4.096	20	30		CIEDRN
CC(C)[C@@H]1CN(C(=O)c2sccc2C#N)c2ccccc21	ZINC000487772996	331980988	/nfs/dbraw/zinc/98/09/88/331980988.db2.gz	SAHYSSYGOCIWMH-AWEZNQCLSA-N	0	0	296.395	4.020	20	30		CIEDRN
CC(C)[C@H]1CN(C(=O)c2sccc2C#N)c2ccccc21	ZINC000487772997	331981036	/nfs/dbraw/zinc/98/10/36/331981036.db2.gz	SAHYSSYGOCIWMH-CQSZACIVSA-N	0	0	296.395	4.020	20	30		CIEDRN
Cc1ccc(C)c([C@H]2CCCN2c2ccc(C#N)c(C)n2)c1	ZINC000488065055	331988807	/nfs/dbraw/zinc/98/88/07/331988807.db2.gz	BATMOMUEROPLET-GOSISDBHSA-N	0	0	291.398	4.220	20	30		CIEDRN
Cc1ccc2ncc(C#N)c(N3C[C@@H]4CCCC[C@@H]4C3)c2c1	ZINC000488080506	331989502	/nfs/dbraw/zinc/98/95/02/331989502.db2.gz	VRKNTPGDLNNQOE-GASCZTMLSA-N	0	0	291.398	4.041	20	30		CIEDRN
N#Cc1ccc(COc2cccc(OC(F)(F)F)c2)cc1	ZINC000488152950	331992215	/nfs/dbraw/zinc/99/22/15/331992215.db2.gz	RIFMXUMRBWYQBJ-UHFFFAOYSA-N	0	0	293.244	4.036	20	30		CIEDRN
N#Cc1cc(Cl)ccc1NCCc1cccc(F)c1F	ZINC000488181555	331993076	/nfs/dbraw/zinc/99/30/76/331993076.db2.gz	NTCLWZVDJKAELH-UHFFFAOYSA-N	0	0	292.716	4.144	20	30		CIEDRN
N#Cc1c(F)cccc1COc1c(F)cccc1Cl	ZINC000488250121	331996024	/nfs/dbraw/zinc/99/60/24/331996024.db2.gz	NAKOABBPOAXFRF-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
CC(C)O[C@H](COc1ccc(C#N)cc1)c1ccccc1	ZINC000488262109	331996469	/nfs/dbraw/zinc/99/64/69/331996469.db2.gz	YCKCCWFIQYIFEM-GOSISDBHSA-N	0	0	281.355	4.103	20	30		CIEDRN
N#Cc1c(F)cccc1CSc1ccc(F)cc1	ZINC000488276500	331996955	/nfs/dbraw/zinc/99/69/55/331996955.db2.gz	ZVJIIRXSXSJGBH-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
CC(C)O[C@@H](COc1cc(F)cc(C#N)c1)c1ccccc1	ZINC000488293676	331997789	/nfs/dbraw/zinc/99/77/89/331997789.db2.gz	JWDNBMULCAZGPB-SFHVURJKSA-N	0	0	299.345	4.242	20	30		CIEDRN
Cc1ccc2ncc(C#N)c(OCc3ccc(F)cc3)c2c1	ZINC000488297296	331998047	/nfs/dbraw/zinc/99/80/47/331998047.db2.gz	SOHNGKQMZPBHJP-UHFFFAOYSA-N	0	0	292.313	4.133	20	30		CIEDRN
C=CCCCCCN[C@H](C)c1noc(Cc2ccccc2)n1	ZINC000488303771	331998505	/nfs/dbraw/zinc/99/85/05/331998505.db2.gz	XIXYJZGKZWOTJA-OAHLLOKOSA-N	0	0	299.418	4.057	20	30		CIEDRN
C=CC[C@H](C(=O)N(C)c1cccc(C)c1)c1ccccc1	ZINC000488324232	331999722	/nfs/dbraw/zinc/99/97/22/331999722.db2.gz	UYNRTBHJPCUDIT-SFHVURJKSA-N	0	0	279.383	4.318	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1ccc(OC(C)C)cc1	ZINC000488351311	332001397	/nfs/dbraw/zinc/00/13/97/332001397.db2.gz	HAFKSVWEGJSMAQ-OAHLLOKOSA-N	0	0	288.391	4.046	20	30		CIEDRN
C=CCN(CCC#N)c1nc2cc(Cl)cc(Cl)c2o1	ZINC000488514145	332014993	/nfs/dbraw/zinc/01/49/93/332014993.db2.gz	ITSQWPNMUPBSQH-UHFFFAOYSA-N	0	0	296.157	4.041	20	30		CIEDRN
C=C(C)CNC(=O)N(CCC)[C@H](CC)c1ccccc1	ZINC000488589190	332019506	/nfs/dbraw/zinc/01/95/06/332019506.db2.gz	CGNZXVMZLVZFLQ-MRXNPFEDSA-N	0	0	274.408	4.135	20	30		CIEDRN
C=C(C)CN(C)C(=O)C[C@H]1C[C@H](C)c2c1cccc2C	ZINC000488782562	332025447	/nfs/dbraw/zinc/02/54/47/332025447.db2.gz	LJXINDBWYZUWSR-LSDHHAIUSA-N	0	0	271.404	4.010	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)C[C@@H]1CCCC(C)(C)C1	ZINC000488812971	332026762	/nfs/dbraw/zinc/02/67/62/332026762.db2.gz	GDLMYHWHPVGLDR-GJZGRUSLSA-N	0	0	263.425	4.160	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)[C@H](C)Cc1cccc(Cl)c1	ZINC000488818716	332027307	/nfs/dbraw/zinc/02/73/07/332027307.db2.gz	RJAHQLATQXJQOB-CJNGLKHVSA-N	0	0	291.822	4.086	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1ccc(C)c(C)c1Cl	ZINC000488834534	332028138	/nfs/dbraw/zinc/02/81/38/332028138.db2.gz	XOAVOYXMMBIOBM-ZDUSSCGKSA-N	0	0	277.795	4.138	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1ccc(SC(C)C)cc1	ZINC000488834206	332028215	/nfs/dbraw/zinc/02/82/15/332028215.db2.gz	GCUVSBJVFLSGPV-OAHLLOKOSA-N	0	0	289.444	4.368	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Cc1csc2ccccc12	ZINC000488841230	332028584	/nfs/dbraw/zinc/02/85/84/332028584.db2.gz	QZPHNHZHGDFRSS-CQSZACIVSA-N	0	0	285.412	4.011	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1ccc(OCCCC)cc1	ZINC000488841563	332028611	/nfs/dbraw/zinc/02/86/11/332028611.db2.gz	REZLEYDPFKDAGX-INIZCTEOSA-N	0	0	287.403	4.046	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1cc2c(s1)CC[C@H](C)C2	ZINC000488845038	332029105	/nfs/dbraw/zinc/02/91/05/332029105.db2.gz	PSKHRKMXJILBAQ-JSGCOSHPSA-N	0	0	289.444	4.054	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1cc(Cl)cc(Cl)c1	ZINC000488847957	332029270	/nfs/dbraw/zinc/02/92/70/332029270.db2.gz	CKHXULRCDCDOLE-ZDUSSCGKSA-N	0	0	284.186	4.174	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1cc(Cl)cc(Cl)c1	ZINC000488847956	332029335	/nfs/dbraw/zinc/02/93/35/332029335.db2.gz	CKHXULRCDCDOLE-CYBMUJFWSA-N	0	0	284.186	4.174	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1cc(CCC)c(C)s1	ZINC000488852878	332029473	/nfs/dbraw/zinc/02/94/73/332029473.db2.gz	KJXAQYWMYAREBV-AWEZNQCLSA-N	0	0	277.433	4.190	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1csc2c1CC[C@H](C)C2	ZINC000488854706	332029474	/nfs/dbraw/zinc/02/94/74/332029474.db2.gz	NQXCNFUDAQHTPR-STQMWFEESA-N	0	0	289.444	4.054	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)C[C@@H](CC)CCCC	ZINC000488886493	332029492	/nfs/dbraw/zinc/02/94/92/332029492.db2.gz	VEJICMJSTNRTCQ-LSDHHAIUSA-N	0	0	251.414	4.160	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)CCCCCc1cccs1	ZINC000488867962	332030254	/nfs/dbraw/zinc/03/02/54/332030254.db2.gz	NYAMIXNDYWKLQJ-HNNXBMFYSA-N	0	0	291.460	4.418	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1ccc(Oc2ccccc2)o1	ZINC000488875417	332031002	/nfs/dbraw/zinc/03/10/02/332031002.db2.gz	DVNWRXUQHVTIEN-AWEZNQCLSA-N	0	0	297.354	4.253	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)C[C@@H](C)c1c[nH]c2ccccc21	ZINC000488875872	332031216	/nfs/dbraw/zinc/03/12/16/332031216.db2.gz	GZLRBBRWEKKQKJ-CABCVRRESA-N	0	0	296.414	4.229	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@H](C)c1cccc(Cl)c1	ZINC000488878269	332031373	/nfs/dbraw/zinc/03/13/73/332031373.db2.gz	IJQSTRPYHWWERO-IUODEOHRSA-N	0	0	277.795	4.011	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)CCCCc1ccc(C)cc1	ZINC000488878948	332031656	/nfs/dbraw/zinc/03/16/56/332031656.db2.gz	QXNXJQWGVHFCHI-GOSISDBHSA-N	0	0	285.431	4.275	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@@H]1C[C@@H]1c1ccc([C@H]2C[C@@H]2C)o1	ZINC000488881516	332031903	/nfs/dbraw/zinc/03/19/03/332031903.db2.gz	ORYZGNWTQRVGFW-XFIYOXNOSA-N	0	0	299.414	4.074	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1cccc(OC2CCCC2)c1	ZINC000488885329	332032045	/nfs/dbraw/zinc/03/20/45/332032045.db2.gz	VBFROEXILBFAEV-INIZCTEOSA-N	0	0	299.414	4.189	20	30		CIEDRN
C=CCCCSc1nnc(-c2ccccc2C)n1CC=C	ZINC000488921999	332033710	/nfs/dbraw/zinc/03/37/10/332033710.db2.gz	SKJUJYLDBVFNAM-UHFFFAOYSA-N	0	0	299.443	4.498	20	30		CIEDRN
C=CC1CCN(C(=O)C[C@@H]2C[C@@H](C)c3c2cccc3C)CC1	ZINC000488952063	332035065	/nfs/dbraw/zinc/03/50/65/332035065.db2.gz	TYQGHFQFEVFYHM-WBVHZDCISA-N	0	0	297.442	4.401	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1cc(C)ccc1Cl	ZINC000488956234	332035222	/nfs/dbraw/zinc/03/52/22/332035222.db2.gz	PFMSNUKWBXHPKY-GFCCVEGCSA-N	0	0	278.783	4.221	20	30		CIEDRN
C=CCn1cccc1C(=O)N1CCCC[C@H]1CCC(C)C	ZINC000489007379	332037420	/nfs/dbraw/zinc/03/74/20/332037420.db2.gz	FSPSROVCXPXWIC-INIZCTEOSA-N	0	0	288.435	4.105	20	30		CIEDRN
C[C@H](c1cccc(C#N)c1)N(C)Cc1ccc(F)cc1F	ZINC000489095673	332041203	/nfs/dbraw/zinc/04/12/03/332041203.db2.gz	DCJFJRHZHVGJLM-GFCCVEGCSA-N	0	0	286.325	4.029	20	30		CIEDRN
CCCCC[C@@H]1CCCN1C(=O)CCc1ccc(C#N)cc1	ZINC000489290869	332045315	/nfs/dbraw/zinc/04/53/15/332045315.db2.gz	BXBJDIPCRLXTBD-GOSISDBHSA-N	0	0	298.430	4.062	20	30		CIEDRN
CCc1cccc(NC(=O)c2ccc(CC#N)cc2)c1CC	ZINC000489481258	332055446	/nfs/dbraw/zinc/05/54/46/332055446.db2.gz	OLJQRYNYLJDKEV-UHFFFAOYSA-N	0	0	292.382	4.130	20	30		CIEDRN
C=C[C@H]1CCCCN1Cc1coc(-c2cccc(F)c2)n1	ZINC000489491723	332056064	/nfs/dbraw/zinc/05/60/64/332056064.db2.gz	CNWGMQCQDWSDTG-INIZCTEOSA-N	0	0	286.350	4.021	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@@H]1CC12CCCCC2)c1ccccc1	ZINC000489595488	332060798	/nfs/dbraw/zinc/06/07/98/332060798.db2.gz	ZCFVHMOSRKMISN-DLBZAZTESA-N	0	0	283.415	4.185	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CCC[C@@H](c2ccccc2)C1	ZINC000489665796	332063805	/nfs/dbraw/zinc/06/38/05/332063805.db2.gz	MFVYLOIHLALNSY-CGTJXYLNSA-N	0	0	285.431	4.431	20	30		CIEDRN
C=CC[C@@H](C(=O)NCC1(CC)CCC1)c1ccccc1	ZINC000489689423	332064936	/nfs/dbraw/zinc/06/49/36/332064936.db2.gz	IQGFUWZVTZEZIK-MRXNPFEDSA-N	0	0	271.404	4.043	20	30		CIEDRN
C=CCC[C@H](C(=O)Nc1cccnc1C)c1ccccc1	ZINC000489694847	332064977	/nfs/dbraw/zinc/06/49/77/332064977.db2.gz	BXCSQOXZRASQIS-INIZCTEOSA-N	0	0	280.371	4.079	20	30		CIEDRN
C=CCC[C@@H](C(=O)Nc1ncccc1CC)c1ccccc1	ZINC000489717256	332065864	/nfs/dbraw/zinc/06/58/64/332065864.db2.gz	CBBUEVHDPVFJSO-QGZVFWFLSA-N	0	0	294.398	4.333	20	30		CIEDRN
C=CCC[C@H](C(=O)NCC1(CC)CC1)c1ccccc1	ZINC000489724024	332066109	/nfs/dbraw/zinc/06/61/09/332066109.db2.gz	KQDCODOYIGMWFY-INIZCTEOSA-N	0	0	271.404	4.043	20	30		CIEDRN
C=CCC[C@@H](C(=O)Nc1cc(C)cc(C)n1)c1ccccc1	ZINC000489732590	332066449	/nfs/dbraw/zinc/06/64/49/332066449.db2.gz	DVNKOIMWIKFSIZ-QGZVFWFLSA-N	0	0	294.398	4.387	20	30		CIEDRN
C=CCC[C@H](C(=O)Nc1cc(C)cc(C)n1)c1ccccc1	ZINC000489732589	332066573	/nfs/dbraw/zinc/06/65/73/332066573.db2.gz	DVNKOIMWIKFSIZ-KRWDZBQOSA-N	0	0	294.398	4.387	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)C[C@@H](C)c1cccc(F)c1	ZINC000489770216	332067350	/nfs/dbraw/zinc/06/73/50/332067350.db2.gz	PMVHMXUDJAQSMU-CYBMUJFWSA-N	0	0	277.383	4.038	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1coc(C2CCCCC2)n1	ZINC000489962061	332074769	/nfs/dbraw/zinc/07/47/69/332074769.db2.gz	AUXQRWSCADMNPV-UHFFFAOYSA-N	0	0	290.407	4.054	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)CCSCc1ccccc1	ZINC000489964731	332074774	/nfs/dbraw/zinc/07/47/74/332074774.db2.gz	KFLSAZAFXNGENJ-UHFFFAOYSA-N	0	0	291.460	4.028	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@H](C)Sc1ccc(C)cc1	ZINC000489980529	332075428	/nfs/dbraw/zinc/07/54/28/332075428.db2.gz	RPSZWMXSWVUJIA-AWEZNQCLSA-N	0	0	291.460	4.194	20	30		CIEDRN
CC(C)c1ccc(/C=C\CC(=O)N[C@H](C#N)C(C)(C)C)cc1	ZINC000489979879	332075480	/nfs/dbraw/zinc/07/54/80/332075480.db2.gz	IIHRCYHYCXTHAE-JTGQJZMRSA-N	0	0	298.430	4.268	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)C[C@H](C)c1c[nH]c2ccccc21	ZINC000489985944	332075660	/nfs/dbraw/zinc/07/56/60/332075660.db2.gz	DMZIKIPKDLKSHK-AWEZNQCLSA-N	0	0	298.430	4.380	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@@H](C)Cc1cccc(Cl)c1	ZINC000490003677	332076359	/nfs/dbraw/zinc/07/63/59/332076359.db2.gz	KGJRVZMBDWUGQH-ZDUSSCGKSA-N	0	0	293.838	4.237	20	30		CIEDRN
C=CCn1cccc1C(=O)N1CCCCCc2ccccc21	ZINC000490019966	332077000	/nfs/dbraw/zinc/07/70/00/332077000.db2.gz	PZZRAQIUGRYRLX-UHFFFAOYSA-N	0	0	294.398	4.047	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1cc(C)c(C)cc1Cl	ZINC000490036408	332077919	/nfs/dbraw/zinc/07/79/19/332077919.db2.gz	YMYGMBFUPSWFAT-UHFFFAOYSA-N	0	0	279.811	4.289	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1	ZINC000490038868	332078039	/nfs/dbraw/zinc/07/80/39/332078039.db2.gz	KMFHRROYAZEIGZ-GHMZBOCLSA-N	0	0	297.851	4.224	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@@H]1CCCC[C@H]1C(F)(F)F	ZINC000490060311	332079336	/nfs/dbraw/zinc/07/93/36/332079336.db2.gz	PGUWJKFLCNXCOP-VXGBXAGGSA-N	0	0	291.357	4.074	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1ccc(C)c(C)c1Cl	ZINC000490063808	332079517	/nfs/dbraw/zinc/07/95/17/332079517.db2.gz	YOYAJSCHAVGXDF-UHFFFAOYSA-N	0	0	279.811	4.289	20	30		CIEDRN
C=CCN(C)C(=O)C1(c2cccc(Cl)c2)CCCCC1	ZINC000490069596	332079854	/nfs/dbraw/zinc/07/98/54/332079854.db2.gz	FSQAZDAOYXRBFO-UHFFFAOYSA-N	0	0	291.822	4.186	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@@H](CC)c1ccc(F)cc1	ZINC000490092535	332081151	/nfs/dbraw/zinc/08/11/51/332081151.db2.gz	WJYCNMHCMKZQNV-HNNXBMFYSA-N	0	0	277.383	4.038	20	30		CIEDRN
Cc1cc(NC(=O)c2cccc(F)c2C#N)ccc1C1CC1	ZINC000490139671	332082542	/nfs/dbraw/zinc/08/25/42/332082542.db2.gz	NBOJDVJEUXNNTC-UHFFFAOYSA-N	0	0	294.329	4.136	20	30		CIEDRN
C[C@@H](C#N)CN(C)[C@H](C)c1cc(Cl)ccc1Cl	ZINC000490159218	332083193	/nfs/dbraw/zinc/08/31/93/332083193.db2.gz	QEKLIQQTALRAPO-VHSXEESVSA-N	0	0	271.191	4.146	20	30		CIEDRN
C[C@@H](C#N)CN(C)[C@H]1CCc2c1cc(Cl)cc2Cl	ZINC000490189535	332083909	/nfs/dbraw/zinc/08/39/09/332083909.db2.gz	ZEJBOCDTYWNJOI-XPTSAGLGSA-N	0	0	283.202	4.072	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@H](CC)CC(F)(F)F)c1ccccc1	ZINC000490220594	332084853	/nfs/dbraw/zinc/08/48/53/332084853.db2.gz	BWQNCWNSTZNXRP-KGLIPLIRSA-N	0	0	299.336	4.194	20	30		CIEDRN
C=CC[C@@H](C(=O)N1CC[C@@H](C(C)(C)C)C1)c1ccccc1	ZINC000490251451	332085307	/nfs/dbraw/zinc/08/53/07/332085307.db2.gz	POHUOUFEVACEHS-IAGOWNOFSA-N	0	0	285.431	4.241	20	30		CIEDRN
C=CCC[C@H](C(=O)N[C@@H](C)CC(F)(F)F)c1ccccc1	ZINC000490260453	332085564	/nfs/dbraw/zinc/08/55/64/332085564.db2.gz	PKKCTGHBZFSUSK-JSGCOSHPSA-N	0	0	299.336	4.194	20	30		CIEDRN
C=CCC[C@@H](C(=O)N[C@H](C)CC(F)(F)F)c1ccccc1	ZINC000490260455	332085646	/nfs/dbraw/zinc/08/56/46/332085646.db2.gz	PKKCTGHBZFSUSK-TZMCWYRMSA-N	0	0	299.336	4.194	20	30		CIEDRN
CCCC(=O)Nc1ccc(Oc2ccccc2)c(C#N)c1	ZINC000490478461	332090155	/nfs/dbraw/zinc/09/01/55/332090155.db2.gz	HTMXNSYOEPIQQR-UHFFFAOYSA-N	0	0	280.327	4.089	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2ccc(CC)c(Cl)c2)CC1	ZINC000490806693	332117110	/nfs/dbraw/zinc/11/71/10/332117110.db2.gz	QMCJOWLSRAYUFS-UHFFFAOYSA-N	0	0	292.810	4.332	20	30		CIEDRN
C[C@@H](NC(=O)C1(C#N)CCCCC1)[C@@H](C)C1CCCCC1	ZINC000490887267	332124899	/nfs/dbraw/zinc/12/48/99/332124899.db2.gz	LOTPPWPAHKZNRG-HUUCEWRRSA-N	0	0	290.451	4.182	20	30		CIEDRN
C=C(C)CSCc1c(Cl)cccc1[N+](=O)[O-]	ZINC000490896412	332126566	/nfs/dbraw/zinc/12/65/66/332126566.db2.gz	ZYVUBOFGOCDMTM-UHFFFAOYSA-N	0	0	257.742	4.058	20	30		CIEDRN
C=CCCCC(=O)NCC[C@@H](c1ccccc1)C(F)(F)F	ZINC000490980809	332135572	/nfs/dbraw/zinc/13/55/72/332135572.db2.gz	OWFWGIMFRGAIJB-AWEZNQCLSA-N	0	0	299.336	4.195	20	30		CIEDRN
C#C[C@@H](C)N(C)C(=O)Nc1c(CCC)cccc1C(C)C	ZINC000491252313	332174313	/nfs/dbraw/zinc/17/43/13/332174313.db2.gz	HHMHQWZAKNZRRY-CQSZACIVSA-N	0	0	286.419	4.248	20	30		CIEDRN
C#C[C@H](C)N(C)C(=O)Nc1c(CCC)cccc1C(C)C	ZINC000491252312	332174337	/nfs/dbraw/zinc/17/43/37/332174337.db2.gz	HHMHQWZAKNZRRY-AWEZNQCLSA-N	0	0	286.419	4.248	20	30		CIEDRN
N#CCN(Cc1ccc(F)c(-c2cccs2)c1)C1CC1	ZINC000511912457	332947792	/nfs/dbraw/zinc/94/77/92/332947792.db2.gz	TXTWONUMGSALNC-UHFFFAOYSA-N	0	0	286.375	4.042	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)Nc1ccc(C)c(C)c1	ZINC000491341402	332193880	/nfs/dbraw/zinc/19/38/80/332193880.db2.gz	CYXIXQNFZRUAGL-UHFFFAOYSA-N	0	0	298.386	4.159	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@H](C)c1cc2ccccc2s1	ZINC000172135503	335095848	/nfs/dbraw/zinc/09/58/48/335095848.db2.gz	XEOWVFZLBPZGBN-VXGBXAGGSA-N	0	0	288.416	4.226	20	30		CIEDRN
CC#CCCCc1nc([C@@H]2CCCC(C)(C)C2)no1	ZINC000575366810	335098178	/nfs/dbraw/zinc/09/81/78/335098178.db2.gz	IVCNFBFWOUONEK-CYBMUJFWSA-N	0	0	260.381	4.099	20	30		CIEDRN
Cc1ccccc1[C@@H](C)CC(=O)N(CC#N)c1ccccc1	ZINC000172231500	335098300	/nfs/dbraw/zinc/09/83/00/335098300.db2.gz	KTCZNXMOQICAMO-INIZCTEOSA-N	0	0	292.382	4.045	20	30		CIEDRN
Cc1ccccc1[C@H](C)CC(=O)N(CC#N)c1ccccc1	ZINC000172231505	335098365	/nfs/dbraw/zinc/09/83/65/335098365.db2.gz	KTCZNXMOQICAMO-MRXNPFEDSA-N	0	0	292.382	4.045	20	30		CIEDRN
C=CCCCCCN(C)C(=O)N[C@H](C)Cc1cccs1	ZINC000172369382	335103413	/nfs/dbraw/zinc/10/34/13/335103413.db2.gz	PLUWSHZNDKANKC-CQSZACIVSA-N	0	0	294.464	4.067	20	30		CIEDRN
C/C=C\CSCc1cc(C#N)ccc1Br	ZINC000492212558	332387463	/nfs/dbraw/zinc/38/74/63/332387463.db2.gz	ZTNWQORZLSNMTJ-IHWYPQMZSA-N	0	0	282.206	4.130	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)/C=C/c1cnccc1C	ZINC000492889383	332417445	/nfs/dbraw/zinc/41/74/45/332417445.db2.gz	CRFSRJDHCAENOJ-ZHACJKMWSA-N	0	0	292.382	4.161	20	30		CIEDRN
COc1ccc(C#N)cc1N[C@H](C)CCc1ccccc1	ZINC000493836412	332455978	/nfs/dbraw/zinc/45/59/78/332455978.db2.gz	PWSFAKDWCGWQRQ-CQSZACIVSA-N	0	0	280.371	4.000	20	30		CIEDRN
C=CCCCC(=O)N[C@@H]1CCc2ccc(C(C)C)cc21	ZINC000494219711	332467003	/nfs/dbraw/zinc/46/70/03/332467003.db2.gz	LAZAJOFHCPJJRV-QGZVFWFLSA-N	0	0	271.404	4.270	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)N[C@H](CCC)c1ccccc1	ZINC000494241391	332467833	/nfs/dbraw/zinc/46/78/33/332467833.db2.gz	LMWCYJUJMOAIQX-DLBZAZTESA-N	0	0	286.419	4.278	20	30		CIEDRN
CC(C)(C)CN(CCC#N)C(=O)CC1CCCCCC1	ZINC000494308559	332470057	/nfs/dbraw/zinc/47/00/57/332470057.db2.gz	LZPNFZHAWMMPBM-UHFFFAOYSA-N	0	0	278.440	4.135	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)C/C(C)=C/c1ccccc1	ZINC000494862741	332488735	/nfs/dbraw/zinc/48/87/35/332488735.db2.gz	DNLKPWRKMRURRD-STTHAQSSSA-N	0	0	271.404	4.151	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)N[C@H](C)c1cc(C)cc(C)c1	ZINC000494886353	332489719	/nfs/dbraw/zinc/48/97/19/332489719.db2.gz	OGEQZCKUKZWENE-NVXWUHKLSA-N	0	0	286.419	4.115	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1ncc(C(C)C)s1	ZINC000494919664	332491332	/nfs/dbraw/zinc/49/13/32/332491332.db2.gz	FGHXETRCNAFJHC-NSHDSACASA-N	0	0	281.425	4.133	20	30		CIEDRN
Cc1cc2cc(/C=C\c3ccc(C#N)cn3)oc2cc1C	ZINC000495080753	332504410	/nfs/dbraw/zinc/50/44/10/332504410.db2.gz	DXYOJOAGNFXGCX-WAYWQWQTSA-N	0	0	274.323	4.487	20	30		CIEDRN
CCCCC[C@@H]1CCCN1C(=O)Nc1ccc(CC#N)cc1	ZINC000495112418	332507024	/nfs/dbraw/zinc/50/70/24/332507024.db2.gz	PUXPQEJXGMRNBS-QGZVFWFLSA-N	0	0	299.418	4.329	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCc1ccc(C2CCC2)cc1	ZINC000495138247	332508211	/nfs/dbraw/zinc/50/82/11/332508211.db2.gz	IWUNMWWOFCENJS-AWEZNQCLSA-N	0	0	271.404	4.173	20	30		CIEDRN
CCC(C#N)(CC)C(=O)Nc1cc(C(F)(F)F)ccc1C	ZINC000091480084	334379090	/nfs/dbraw/zinc/37/90/90/334379090.db2.gz	LGRUQEHUXMPZFO-UHFFFAOYSA-N	0	0	298.308	4.282	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCCCc2cc(OC)ccc21	ZINC000498772384	332572866	/nfs/dbraw/zinc/57/28/66/332572866.db2.gz	XNJUTQXETQNBIL-UHFFFAOYSA-N	0	0	299.414	4.133	20	30		CIEDRN
Cc1ccc([C@H](C)N(C)c2ccc(C#N)cc2)cc1	ZINC000498848970	332574334	/nfs/dbraw/zinc/57/43/34/332574334.db2.gz	GYECAPQABLCRCT-AWEZNQCLSA-N	0	0	250.345	4.064	20	30		CIEDRN
CC(C)(C#N)CCSCc1ccccc1OC(F)F	ZINC000554705854	334447488	/nfs/dbraw/zinc/44/74/88/334447488.db2.gz	UZRPNKDLSNCGCE-UHFFFAOYSA-N	0	0	285.359	4.461	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@@]1(CCC)C(F)(F)F	ZINC000499522479	332587603	/nfs/dbraw/zinc/58/76/03/332587603.db2.gz	UVUPQESEDURWAF-ZDUSSCGKSA-N	0	0	277.330	4.066	20	30		CIEDRN
C=CCC[C@H](NC(=O)N1CC(C2CCC2)C1)c1ccccc1	ZINC000500186279	332602098	/nfs/dbraw/zinc/60/20/98/332602098.db2.gz	QCZMXXGEYJRYMG-SFHVURJKSA-N	0	0	298.430	4.135	20	30		CIEDRN
Cc1ccc(C#N)c(N[C@H](c2ccc(Cl)cc2)C2CC2)n1	ZINC000500280790	332604240	/nfs/dbraw/zinc/60/42/40/332604240.db2.gz	OGAISGMGFMGCSJ-INIZCTEOSA-N	0	0	297.789	4.478	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)[C@@H](C)CC(C)(C)C	ZINC000500397549	332606902	/nfs/dbraw/zinc/60/69/02/332606902.db2.gz	QXBYPJVEKLGUHE-HNNXBMFYSA-N	0	0	273.420	4.274	20	30		CIEDRN
C=CCCc1ccccc1NCc1scnc1C	ZINC000500449677	332609767	/nfs/dbraw/zinc/60/97/67/332609767.db2.gz	WTWKWWHZFPOPOA-UHFFFAOYSA-N	0	0	258.390	4.182	20	30		CIEDRN
Cc1ccc2c(c1)CC[C@H]2Nc1c(F)cc(C#N)cc1F	ZINC000500506401	332611721	/nfs/dbraw/zinc/61/17/21/332611721.db2.gz	WVQOKXLDAUTJIQ-MRXNPFEDSA-N	0	0	284.309	4.244	20	30		CIEDRN
COc1ccc2oc(CNc3cccc(C#N)c3C)cc2c1	ZINC000500699870	332616109	/nfs/dbraw/zinc/61/61/09/332616109.db2.gz	SPTLTCZMBCMFGA-UHFFFAOYSA-N	0	0	292.338	4.234	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H](C)c1ccc2ncsc2c1	ZINC000501360949	332630909	/nfs/dbraw/zinc/63/09/09/332630909.db2.gz	WNTOJYRFRAEDEU-LLVKDONJSA-N	0	0	288.416	4.076	20	30		CIEDRN
CCC(CC)CN(CC)C(=O)c1ccc(C#N)c(Cl)c1	ZINC000154858205	334705896	/nfs/dbraw/zinc/70/58/96/334705896.db2.gz	PUYUZKFMQZXKFL-UHFFFAOYSA-N	0	0	292.810	4.110	20	30		CIEDRN
C[C@@H]1c2cc(Cl)cc(Cl)c2CCN1CC1(C#N)CC1	ZINC000501530170	332634925	/nfs/dbraw/zinc/63/49/25/332634925.db2.gz	VYIGKXHUACLPOO-SNVBAGLBSA-N	0	0	295.213	4.216	20	30		CIEDRN
C=CCCCN(C)C(=O)CCOc1ccccc1C(C)C	ZINC000501993762	332644756	/nfs/dbraw/zinc/64/47/56/332644756.db2.gz	HQOUHSHKDJHGQC-UHFFFAOYSA-N	0	0	289.419	4.004	20	30		CIEDRN
CCCC[C@H](C)C(=O)N(CC)[C@H](C)c1ccc(C#N)cc1	ZINC000503132221	332682143	/nfs/dbraw/zinc/68/21/43/332682143.db2.gz	POKQJLJPJOHNFX-LSDHHAIUSA-N	0	0	286.419	4.294	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)[C@@H](C)CCCC	ZINC000503153974	332682725	/nfs/dbraw/zinc/68/27/25/332682725.db2.gz	UEACDKXLNHTZJA-AWEZNQCLSA-N	0	0	277.383	4.167	20	30		CIEDRN
C=CCN(Cc1ccc(OC)cc1)C(=O)[C@@H](C)CCCC	ZINC000503148639	332682773	/nfs/dbraw/zinc/68/27/73/332682773.db2.gz	JUZXLAVPXFRDRB-HNNXBMFYSA-N	0	0	289.419	4.036	20	30		CIEDRN
CCCC[C@H](C)C(=O)Nc1cc(C#N)ccc1OC(C)C	ZINC000503170412	332683326	/nfs/dbraw/zinc/68/33/26/332683326.db2.gz	HAPRRUHZFXUNDK-ZDUSSCGKSA-N	0	0	288.391	4.110	20	30		CIEDRN
CCc1cccc(CC)c1-n1ccnc1S[C@H](C)C#N	ZINC000503253940	332684624	/nfs/dbraw/zinc/68/46/24/332684624.db2.gz	LBCPRCGNQDYXIC-GFCCVEGCSA-N	0	0	285.416	4.001	20	30		CIEDRN
N#Cc1cccc(NC(=O)NCCCC2CCCCC2)c1	ZINC000503308843	332686130	/nfs/dbraw/zinc/68/61/30/332686130.db2.gz	GLIIEXYVTYMIGX-UHFFFAOYSA-N	0	0	285.391	4.040	20	30		CIEDRN
CCCC[C@H](C)C(=O)N(CCC)Cc1ccc(C#N)cc1	ZINC000503977942	332701648	/nfs/dbraw/zinc/70/16/48/332701648.db2.gz	VCDFYSCNHPPGRU-HNNXBMFYSA-N	0	0	286.419	4.123	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)C2C[C@@H](C)C[C@H](C)C2)s1	ZINC000504098570	332704067	/nfs/dbraw/zinc/70/40/67/332704067.db2.gz	ZPRWQVJNUZTWQA-QWRGUYRKSA-N	0	0	290.432	4.193	20	30		CIEDRN
Cc1sc(NC(=O)C[C@@H]2CCC[C@@H](C)C2)c(C#N)c1C	ZINC000504341962	332708488	/nfs/dbraw/zinc/70/84/88/332708488.db2.gz	AWMVYWKGAUOVCM-ZWNOBZJWSA-N	0	0	290.432	4.392	20	30		CIEDRN
Cc1ccc(/C=C\c2ccncc2C#N)c(Br)c1	ZINC000504733901	332719648	/nfs/dbraw/zinc/71/96/48/332719648.db2.gz	WGYYZAZKXBERAY-PLNGDYQASA-N	0	0	299.171	4.195	20	30		CIEDRN
CCCCOc1ccccc1/C=C\c1ccncc1C#N	ZINC000504734063	332719715	/nfs/dbraw/zinc/71/97/15/332719715.db2.gz	WOAPSDXMXVQRQU-HJWRWDBZSA-N	0	0	278.355	4.303	20	30		CIEDRN
C=C[C@H](CC(=O)NC1CC(C(C)(C)C)C1)c1ccccc1	ZINC000504810938	332721344	/nfs/dbraw/zinc/72/13/44/332721344.db2.gz	RQIINOSDMASLOM-ODIFPOPNSA-N	0	0	285.431	4.287	20	30		CIEDRN
Cc1ccccc1-c1noc(/C=C/c2ccc(C#N)cc2)n1	ZINC000504964069	332726398	/nfs/dbraw/zinc/72/63/98/332726398.db2.gz	VOZHAQPUKIOIPT-ZHACJKMWSA-N	0	0	287.322	4.087	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CCC[C@H](C)C1	ZINC000505004862	332727448	/nfs/dbraw/zinc/72/74/48/332727448.db2.gz	GYTWGMZMGQWNHV-AWEZNQCLSA-N	0	0	272.392	4.069	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)NCc1ccsc1	ZINC000505010764	332727694	/nfs/dbraw/zinc/72/76/94/332727694.db2.gz	LQFOBUSHDIKNFB-UHFFFAOYSA-N	0	0	286.400	4.188	20	30		CIEDRN
Cc1ccc(-c2noc(/C=C/c3ccc(C#N)cc3)n2)cc1	ZINC000505018677	332728200	/nfs/dbraw/zinc/72/82/00/332728200.db2.gz	MXHDEQAPWRVAJP-DHZHZOJOSA-N	0	0	287.322	4.087	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)NC1CCCCC1	ZINC000505023343	332728207	/nfs/dbraw/zinc/72/82/07/332728207.db2.gz	LPWLCOYWIFTVMC-UHFFFAOYSA-N	0	0	272.392	4.259	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N(CCC)CC1CC1	ZINC000505046761	332729189	/nfs/dbraw/zinc/72/91/89/332729189.db2.gz	YPALUFDUAGWBFX-UHFFFAOYSA-N	0	0	286.419	4.459	20	30		CIEDRN
C=C(C)CCSc1nnc(-c2ccc(C)cc2)o1	ZINC000505445014	332740693	/nfs/dbraw/zinc/74/06/93/332740693.db2.gz	VCHQUAKBUHOBAZ-UHFFFAOYSA-N	0	0	260.362	4.103	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)[C@H](c1ccccc1)C(C)C	ZINC000172909978	332952897	/nfs/dbraw/zinc/95/28/97/332952897.db2.gz	GOXZOUJZJRAZRR-SFHVURJKSA-N	0	0	292.382	4.245	20	30		CIEDRN
Cc1ccc(N[C@H](C)c2ccc(C#N)cc2F)c(F)c1	ZINC000512281252	332961119	/nfs/dbraw/zinc/96/11/19/332961119.db2.gz	QWFMPMXEZITODX-LLVKDONJSA-N	0	0	272.298	4.318	20	30		CIEDRN
C=C(C)[C@H](CC(=O)N1CC[C@@H](C(C)(C)C)C[C@@H]1C)OCC	ZINC000572515842	332965097	/nfs/dbraw/zinc/96/50/97/332965097.db2.gz	SXWKFOJKCMTKSZ-XHSDSOJGSA-N	0	0	295.467	4.031	20	30		CIEDRN
C=C(C)[C@H](CC(=O)N1CC[C@H](C(C)(C)C)C[C@H]1C)OCC	ZINC000572515841	332965202	/nfs/dbraw/zinc/96/52/02/332965202.db2.gz	SXWKFOJKCMTKSZ-PMPSAXMXSA-N	0	0	295.467	4.031	20	30		CIEDRN
C[C@@H](Nc1cccc(F)c1)c1ccc(C#N)cc1F	ZINC000512658970	332978387	/nfs/dbraw/zinc/97/83/87/332978387.db2.gz	BGOHQLSZLAOXNQ-SNVBAGLBSA-N	0	0	258.271	4.010	20	30		CIEDRN
C[C@H](Nc1cccc(F)c1)c1ccc(C#N)cc1F	ZINC000512658969	332978393	/nfs/dbraw/zinc/97/83/93/332978393.db2.gz	BGOHQLSZLAOXNQ-JTQLQIEISA-N	0	0	258.271	4.010	20	30		CIEDRN
C=C(CNC(=O)N1CCCC12CCCCC2)c1ccccc1	ZINC000512664826	332978744	/nfs/dbraw/zinc/97/87/44/332978744.db2.gz	BSLPBNMHCFQKCJ-UHFFFAOYSA-N	0	0	298.430	4.208	20	30		CIEDRN
C=CC[C@H](C)NC(=O)[C@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1	ZINC000173800037	332981545	/nfs/dbraw/zinc/98/15/45/332981545.db2.gz	IJKQNPIHYYZOON-FZZIBODNSA-N	0	0	298.213	4.178	20	30		CIEDRN
C[C@H](CC1CCCC1)C(=O)Nc1ccc(C#N)cc1Cl	ZINC000512848229	332989460	/nfs/dbraw/zinc/98/94/60/332989460.db2.gz	BOPFLLNPMCIEIU-LLVKDONJSA-N	0	0	290.794	4.367	20	30		CIEDRN
C=C(CC)CN[C@H](c1c[nH]c2ccccc21)C(F)(F)F	ZINC000513162312	333006692	/nfs/dbraw/zinc/00/66/92/333006692.db2.gz	XTPSYOJEVSEGSB-CQSZACIVSA-N	0	0	282.309	4.327	20	30		CIEDRN
C=CCCCC(=O)NC(c1ccccc1)c1ccccc1	ZINC000175088553	333014505	/nfs/dbraw/zinc/01/45/05/333014505.db2.gz	GCDGSQXKNOJSCE-UHFFFAOYSA-N	0	0	279.383	4.249	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(OC(F)F)c(Cl)c1	ZINC000175168395	333015968	/nfs/dbraw/zinc/01/59/68/333015968.db2.gz	BCZGSAYRMWSQRO-UHFFFAOYSA-N	0	0	289.709	4.236	20	30		CIEDRN
C=CCCCN(C)C(=O)[C@@H]1CCC[C@H]2CCCC[C@@H]21	ZINC000513377025	333016222	/nfs/dbraw/zinc/01/62/22/333016222.db2.gz	RHOJRHYGUSGJBU-OWCLPIDISA-N	0	0	263.425	4.018	20	30		CIEDRN
C[C@@H](C#N)CN(C)[C@H](C)c1ccc(Cl)c(Cl)c1	ZINC000513402919	333017556	/nfs/dbraw/zinc/01/75/56/333017556.db2.gz	OQEYQCOSTIXDEL-VHSXEESVSA-N	0	0	271.191	4.146	20	30		CIEDRN
C=CCCCC(=O)N(C)[C@@H](C)c1ccccc1Cl	ZINC000175242213	333018356	/nfs/dbraw/zinc/01/83/56/333018356.db2.gz	ORSGAXPPCGUXCZ-LBPRGKRZSA-N	0	0	265.784	4.216	20	30		CIEDRN
CCc1ccc([C@H](C)[NH2+]Cc2ccc(C#N)c(F)c2)s1	ZINC000404647503	333018977	/nfs/dbraw/zinc/01/89/77/333018977.db2.gz	PGUIZVCGUQXETL-NSHDSACASA-N	0	0	288.391	4.172	20	30		CIEDRN
CCc1ccc([C@@H](C)[NH2+]Cc2ccc(C#N)c(F)c2)s1	ZINC000404647502	333019054	/nfs/dbraw/zinc/01/90/54/333019054.db2.gz	PGUIZVCGUQXETL-LLVKDONJSA-N	0	0	288.391	4.172	20	30		CIEDRN
CC[C@H](CC1CCCC1)C(=O)N(CCC#N)CC(C)(C)C	ZINC000513437466	333019172	/nfs/dbraw/zinc/01/91/72/333019172.db2.gz	MROZLVNMSHGDNN-MRXNPFEDSA-N	0	0	292.467	4.381	20	30		CIEDRN
N#CCCCCSC[C@@H]1CCc2ccccc2C1	ZINC000513436325	333019286	/nfs/dbraw/zinc/01/92/86/333019286.db2.gz	DMMFORYUESLXQW-CQSZACIVSA-N	0	0	259.418	4.219	20	30		CIEDRN
C=CCCCC(=O)N(C)Cc1csc2ccccc12	ZINC000175327784	333021387	/nfs/dbraw/zinc/02/13/87/333021387.db2.gz	STUYWIYWSNSKOQ-UHFFFAOYSA-N	0	0	273.401	4.216	20	30		CIEDRN
CCC[C@@H](CC(C)C)C(=O)Nc1ccc(CC#N)cc1	ZINC000308085103	333024392	/nfs/dbraw/zinc/02/43/92/333024392.db2.gz	FPDGVDSWXPHSFX-HNNXBMFYSA-N	0	0	272.392	4.154	20	30		CIEDRN
N#Cc1ccc(CSc2cccc(F)c2)cc1F	ZINC000404760303	333025495	/nfs/dbraw/zinc/02/54/95/333025495.db2.gz	RDSHJFXJTHPBSG-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
Cc1cccc([C@@H]2CCCN2c2ncc(C#N)cc2Cl)c1	ZINC000513616186	333026714	/nfs/dbraw/zinc/02/67/14/333026714.db2.gz	YCKVOYMZZRCYSS-INIZCTEOSA-N	0	0	297.789	4.257	20	30		CIEDRN
Cc1ccc2oc(Oc3ccc(C#N)cc3Cl)nc2c1	ZINC000513617821	333027064	/nfs/dbraw/zinc/02/70/64/333027064.db2.gz	AFOWFPGDTSZNQM-UHFFFAOYSA-N	0	0	284.702	4.454	20	30		CIEDRN
Cc1ccc([C@H](C)N(C)c2ncc(C#N)cc2Cl)c(C)c1	ZINC000513618493	333027173	/nfs/dbraw/zinc/02/71/73/333027173.db2.gz	GSLHIJQOYGWPRN-ZDUSSCGKSA-N	0	0	299.805	4.421	20	30		CIEDRN
CCCCN(CCCC)c1ncc(C#N)cc1Cl	ZINC000513640050	333028469	/nfs/dbraw/zinc/02/84/69/333028469.db2.gz	JCJQLGJKVXFCES-UHFFFAOYSA-N	0	0	265.788	4.013	20	30		CIEDRN
CC(C)(C)C[C@@H]1CCCN1c1ncc(C#N)cc1Cl	ZINC000513640112	333028495	/nfs/dbraw/zinc/02/84/95/333028495.db2.gz	JWNJZMFJTMPOPU-LBPRGKRZSA-N	0	0	277.799	4.012	20	30		CIEDRN
Cc1cc(C)c(C)c(Oc2ncc(C#N)cc2Cl)c1	ZINC000513645251	333028818	/nfs/dbraw/zinc/02/88/18/333028818.db2.gz	JKKVVECPDVCBLX-UHFFFAOYSA-N	0	0	272.735	4.324	20	30		CIEDRN
C[C@@H](C#N)CN(C(=O)Nc1ccc(C(C)(C)C)cc1)C1CC1	ZINC000513654053	333029418	/nfs/dbraw/zinc/02/94/18/333029418.db2.gz	JBZOHBNAOKHLFO-ZDUSSCGKSA-N	0	0	299.418	4.140	20	30		CIEDRN
CC(C)CCN(CCC#N)Cc1ccccc1OC(C)C	ZINC000513729985	333036076	/nfs/dbraw/zinc/03/60/76/333036076.db2.gz	VBGTXPVXMHASNE-UHFFFAOYSA-N	0	0	288.435	4.236	20	30		CIEDRN
C=CCOc1cccc(CN(CCC#N)CCC(C)C)c1	ZINC000513729077	333036111	/nfs/dbraw/zinc/03/61/11/333036111.db2.gz	MHVFFFNMIOTBBF-UHFFFAOYSA-N	0	0	286.419	4.013	20	30		CIEDRN
CC(C)CCN(CCC#N)Cc1cccc(OC(C)C)c1	ZINC000513728448	333036136	/nfs/dbraw/zinc/03/61/36/333036136.db2.gz	IAGQPCFMRXRWEK-UHFFFAOYSA-N	0	0	288.435	4.236	20	30		CIEDRN
C=CCCCCNC(=O)N1CC[C@@H]1c1ccc(Cl)cc1	ZINC000575811274	335117946	/nfs/dbraw/zinc/11/79/46/335117946.db2.gz	YMTOERPRBPXEDS-OAHLLOKOSA-N	0	0	292.810	4.153	20	30		CIEDRN
C=CCOc1cccc(CN(CCC#N)CC(C)(C)C)c1	ZINC000513750656	333037547	/nfs/dbraw/zinc/03/75/47/333037547.db2.gz	MGSBRPGVQQHFOR-UHFFFAOYSA-N	0	0	286.419	4.013	20	30		CIEDRN
C=CCCCC(=O)N1CCCCC[C@@H]1c1ccccc1	ZINC000176108547	333039419	/nfs/dbraw/zinc/03/94/19/333039419.db2.gz	HXJRNTSQMWFQAF-QGZVFWFLSA-N	0	0	271.404	4.487	20	30		CIEDRN
N#C[C@H](NC(=O)CC/C=C/c1ccccc1)C1CCCCC1	ZINC000176624636	333044429	/nfs/dbraw/zinc/04/44/29/333044429.db2.gz	IYBGKRMLBLQSOZ-DBEXCURXSA-N	0	0	296.414	4.069	20	30		CIEDRN
N#C[C@@H](NC(=O)CC/C=C/c1ccccc1)C1CCCCC1	ZINC000176624652	333044453	/nfs/dbraw/zinc/04/44/53/333044453.db2.gz	IYBGKRMLBLQSOZ-JGZYNSJSSA-N	0	0	296.414	4.069	20	30		CIEDRN
C=CCOc1cccc(-c2nc3cc(C)ccc3n2C)c1	ZINC000513868022	333044840	/nfs/dbraw/zinc/04/48/40/333044840.db2.gz	PBRUCUHLVQEEJE-UHFFFAOYSA-N	0	0	278.355	4.114	20	30		CIEDRN
CCN(C[C@H](C)C#N)C(c1ccccc1)c1ccccc1	ZINC000513898148	333048440	/nfs/dbraw/zinc/04/84/40/333048440.db2.gz	GFWPGYQBXQVJIT-MRXNPFEDSA-N	0	0	278.399	4.258	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1scnc1C(C)(C)C	ZINC000176885612	333050040	/nfs/dbraw/zinc/05/00/40/333050040.db2.gz	YPKPMOWOASPNHJ-UHFFFAOYSA-N	0	0	294.464	4.259	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc2cnn(C(C)C)c2c1	ZINC000177067326	333053272	/nfs/dbraw/zinc/05/32/72/333053272.db2.gz	QPKZSFFMOUKGNZ-UHFFFAOYSA-N	0	0	297.402	4.324	20	30		CIEDRN
Cc1nc2ccccc2c(SCCCC(C)(C)C#N)n1	ZINC000177145158	333054135	/nfs/dbraw/zinc/05/41/35/333054135.db2.gz	VTGAKLRWPMUORV-UHFFFAOYSA-N	0	0	285.416	4.360	20	30		CIEDRN
C=CCn1c(C)nnc1S[C@H]1CCCCc2ccccc21	ZINC000177183573	333054735	/nfs/dbraw/zinc/05/47/35/333054735.db2.gz	YYNNXZGYWRFAOA-INIZCTEOSA-N	0	0	299.443	4.332	20	30		CIEDRN
C=CCCCC(=O)Nc1cc(OC)ccc1OCCCC	ZINC000177531422	333060142	/nfs/dbraw/zinc/06/01/42/333060142.db2.gz	FZPIWBQKHQSFPG-UHFFFAOYSA-N	0	0	291.391	4.169	20	30		CIEDRN
Cc1nc(SCc2ccc(Cl)cc2)ccc1C#N	ZINC000310945368	333062688	/nfs/dbraw/zinc/06/26/88/333062688.db2.gz	XLNHBJUIMRBIMT-UHFFFAOYSA-N	0	0	274.776	4.207	20	30		CIEDRN
C=CCCCC(=O)Nc1scnc1-c1ccccc1	ZINC000177815768	333063538	/nfs/dbraw/zinc/06/35/38/333063538.db2.gz	LOUKVKAYEDMSJZ-UHFFFAOYSA-N	0	0	272.373	4.105	20	30		CIEDRN
C=CCCCC(=O)Nc1ccccc1OC(C)(C)C	ZINC000177862932	333064271	/nfs/dbraw/zinc/06/42/71/333064271.db2.gz	RVICOZUEZYJURH-UHFFFAOYSA-N	0	0	261.365	4.159	20	30		CIEDRN
C=C(C)CS[C@H](C)C(=O)Nc1cc(Cl)ccc1C	ZINC000177864529	333064496	/nfs/dbraw/zinc/06/44/96/333064496.db2.gz	GOERGAJVSBXLKX-LLVKDONJSA-N	0	0	283.824	4.285	20	30		CIEDRN
C=C(C)CSCc1ncc(-c2cccc(F)c2)o1	ZINC000177870412	333064798	/nfs/dbraw/zinc/06/47/98/333064798.db2.gz	CMMVHILAYLCQMR-UHFFFAOYSA-N	0	0	263.337	4.290	20	30		CIEDRN
Cc1nc2ccccc2nc1CSc1ccccc1C#N	ZINC000172682479	335118944	/nfs/dbraw/zinc/11/89/44/335118944.db2.gz	YPSWSYZNGCQPJA-UHFFFAOYSA-N	0	0	291.379	4.102	20	30		CIEDRN
CN(CC#N)[C@H](c1ccc(F)cc1)c1ccc(Cl)cc1	ZINC000178068725	333067351	/nfs/dbraw/zinc/06/73/51/333067351.db2.gz	GVIFBEKCJGLOJM-INIZCTEOSA-N	0	0	288.753	4.024	20	30		CIEDRN
CCC[C@H](C)[C@@H]1CCCN1C(=O)Nc1cc(C#N)ccc1C	ZINC000178141132	333068375	/nfs/dbraw/zinc/06/83/75/333068375.db2.gz	QIKKYXMPAZJDQM-YOEHRIQHSA-N	0	0	299.418	4.299	20	30		CIEDRN
N#CCCSc1ccccc1NCc1cccc(C#N)c1	ZINC000178386223	333071928	/nfs/dbraw/zinc/07/19/28/333071928.db2.gz	JKGWJRLWZIZQHC-UHFFFAOYSA-N	0	0	293.395	4.176	20	30		CIEDRN
C[C@@H]1C[C@H](C(C)(C)C)CCN1C(=O)c1ccc(CC#N)cc1	ZINC000516677140	333080291	/nfs/dbraw/zinc/08/02/91/333080291.db2.gz	NDDLCKFARPOFBP-RHSMWYFYSA-N	0	0	298.430	4.039	20	30		CIEDRN
CC(C)(C#N)c1ccc(C(=O)NCCC(C)(C)C2CC2)cc1	ZINC000516677399	333080413	/nfs/dbraw/zinc/08/04/13/333080413.db2.gz	YDRSPVXAORBGAD-UHFFFAOYSA-N	0	0	298.430	4.044	20	30		CIEDRN
C=CCOc1cccc(NC(=O)CC(C)(C)C2CC2)c1	ZINC000516855465	333084232	/nfs/dbraw/zinc/08/42/32/333084232.db2.gz	SRQRLPJHVHGXTH-UHFFFAOYSA-N	0	0	273.376	4.016	20	30		CIEDRN
CCCCN(C(=O)CC(C)(C)C#N)[C@@H]1CCC[C@H](C)C1	ZINC000516886950	333085293	/nfs/dbraw/zinc/08/52/93/333085293.db2.gz	HYZMZMXICVKGKB-LSDHHAIUSA-N	0	0	278.440	4.134	20	30		CIEDRN
CC[C@H](C)Oc1ccc(-c2noc([C@@](C)(C#N)CC)n2)cc1	ZINC000517201669	333094406	/nfs/dbraw/zinc/09/44/06/333094406.db2.gz	ONONEROLZKISFL-YVEFUNNKSA-N	0	0	299.374	4.105	20	30		CIEDRN
N#Cc1c(Br)cccc1NCCC1(F)CCC1	ZINC000517217992	333095071	/nfs/dbraw/zinc/09/50/71/333095071.db2.gz	LPTMAXJUFVCSPT-UHFFFAOYSA-N	0	0	297.171	4.015	20	30		CIEDRN
C/C=C\c1ccc(NCCCC2(C#N)CCOCC2)cc1	ZINC000517347759	333097788	/nfs/dbraw/zinc/09/77/88/333097788.db2.gz	DCLCJUZHXBXTTJ-RQOWECAXSA-N	0	0	284.403	4.232	20	30		CIEDRN
C=C1CCN(C(=O)c2oc3c(c2C)c(C)ccc3C)CC1	ZINC000517453284	333099681	/nfs/dbraw/zinc/09/96/81/333099681.db2.gz	ATLMNTBALCMYQC-UHFFFAOYSA-N	0	0	283.371	4.150	20	30		CIEDRN
C=C1CCN(Cc2ncc(-c3ccc(Cl)cc3)o2)CC1	ZINC000517469779	333100128	/nfs/dbraw/zinc/10/01/28/333100128.db2.gz	YSHIXMMYIJNNRU-UHFFFAOYSA-N	0	0	288.778	4.147	20	30		CIEDRN
CC(C)Oc1cccc(COc2ccc(C#N)c(F)c2)c1	ZINC000517524988	333101289	/nfs/dbraw/zinc/10/12/89/333101289.db2.gz	OAIPPQQHAGKCTG-UHFFFAOYSA-N	0	0	285.318	4.064	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(Cc2ccc(F)c(F)c2)no1	ZINC000517624190	333104446	/nfs/dbraw/zinc/10/44/46/333104446.db2.gz	RORNLYNTMGCZAI-SNVBAGLBSA-N	0	0	278.302	4.008	20	30		CIEDRN
C=CC1CCN(C(=O)c2sccc2-c2ccccc2)CC1	ZINC000517657183	333105280	/nfs/dbraw/zinc/10/52/80/333105280.db2.gz	LSLGZVDWXRQVRO-UHFFFAOYSA-N	0	0	297.423	4.453	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC(C)(CC(C)C)CC1	ZINC000520906887	333107665	/nfs/dbraw/zinc/10/76/65/333107665.db2.gz	VTKOHOBJJOWADT-UHFFFAOYSA-N	0	0	277.452	4.430	20	30		CIEDRN
C=CCN(Cc1cccc(C#N)c1)C(=O)[C@@H](CC)CCCC	ZINC000521114325	333111849	/nfs/dbraw/zinc/11/18/49/333111849.db2.gz	RPTXDHHTXAAGGP-SFHVURJKSA-N	0	0	298.430	4.289	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1ccc(OCC)c(F)c1	ZINC000521289931	333117133	/nfs/dbraw/zinc/11/71/33/333117133.db2.gz	QYEBVBXJBOQVPB-GFCCVEGCSA-N	0	0	294.370	4.091	20	30		CIEDRN
CC[C@@H](CC1CCCCC1)C(=O)NCc1cccc(C#N)c1	ZINC000217193706	333119699	/nfs/dbraw/zinc/11/96/99/333119699.db2.gz	KETXQUXQVWPEKZ-SFHVURJKSA-N	0	0	298.430	4.171	20	30		CIEDRN
CSCCCCNc1ccc(C#N)cc1C(F)(F)F	ZINC000217485602	333121381	/nfs/dbraw/zinc/12/13/81/333121381.db2.gz	SBOMRLYLQJHJNP-UHFFFAOYSA-N	0	0	288.338	4.132	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@H](CC1CCC1)c1ccccc1	ZINC000183627073	333121506	/nfs/dbraw/zinc/12/15/06/333121506.db2.gz	VKVVUUJUIKLBBW-QGZVFWFLSA-N	0	0	286.419	4.135	20	30		CIEDRN
CC(C)CCc1ccc(N[C@@H]2CC[C@H](C#N)C2)cc1	ZINC000564159270	333132170	/nfs/dbraw/zinc/13/21/70/333132170.db2.gz	UBUFFXGAOWISQW-DOTOQJQBSA-N	0	0	256.393	4.379	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1sc2c(c1C#N)CCCC2	ZINC000184903670	333132991	/nfs/dbraw/zinc/13/29/91/333132991.db2.gz	LXKVFZOQGPMVCA-NSHDSACASA-N	0	0	288.416	4.039	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](C)c1cccc(Cl)c1	ZINC000184907534	333133210	/nfs/dbraw/zinc/13/32/10/333133210.db2.gz	JKHRWYXXNFRGFO-VXGBXAGGSA-N	0	0	265.784	4.120	20	30		CIEDRN
CC#CCCCC(=O)N(C)Cc1ccc(Cl)c(Cl)c1	ZINC000184978858	333133943	/nfs/dbraw/zinc/13/39/43/333133943.db2.gz	OHUIMEYHHCFQNE-UHFFFAOYSA-N	0	0	298.213	4.145	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCc1c(OC)ccc2ccccc21	ZINC000184976520	333133985	/nfs/dbraw/zinc/13/39/85/333133985.db2.gz	WSHCSJJFNKQMPP-CQSZACIVSA-N	0	0	297.398	4.067	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](c1ccc(OC)cc1)C(C)C	ZINC000184986604	333134040	/nfs/dbraw/zinc/13/40/40/333134040.db2.gz	JTWSUVFPEVKBKI-RHSMWYFYSA-N	0	0	289.419	4.111	20	30		CIEDRN
COCCOc1ccc(SCCCC(C)(C)C#N)cc1	ZINC000185030574	333134533	/nfs/dbraw/zinc/13/45/33/333134533.db2.gz	YBCABAPNGWEIKK-UHFFFAOYSA-N	0	0	293.432	4.134	20	30		CIEDRN
CC#CCCCC(=O)N(Cc1ccc([C@@H]2C[C@H]2C)o1)C1CC1	ZINC000185072253	333135101	/nfs/dbraw/zinc/13/51/01/333135101.db2.gz	KZQBFDPBEKISAU-RHSMWYFYSA-N	0	0	299.414	4.088	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000185085870	333135424	/nfs/dbraw/zinc/13/54/24/333135424.db2.gz	HHTYXMOEHNGPFG-VXGBXAGGSA-N	0	0	299.336	4.485	20	30		CIEDRN
CC#CCCCC(=O)N(Cc1ccc(Cl)cc1)C1CC1	ZINC000185210680	333136776	/nfs/dbraw/zinc/13/67/76/333136776.db2.gz	KWMQXXGXIZXNJZ-UHFFFAOYSA-N	0	0	289.806	4.025	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC)[C@H](C)c1cccc(OC)c1	ZINC000185227839	333137010	/nfs/dbraw/zinc/13/70/10/333137010.db2.gz	WFLJNFKGSIXLDS-HUUCEWRRSA-N	0	0	289.419	4.207	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@H](C)c1cccc(Cl)c1	ZINC000185223520	333137073	/nfs/dbraw/zinc/13/70/73/333137073.db2.gz	HHNRIRNKDDFKJN-QWHCGFSZSA-N	0	0	279.811	4.462	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc2oc(C3CC3)nc2c1	ZINC000185303706	333138368	/nfs/dbraw/zinc/13/83/68/333138368.db2.gz	DCJDIRYTQCGLAO-LLVKDONJSA-N	0	0	284.359	4.246	20	30		CIEDRN
CSc1cccc(C)c1NCc1ccc(F)c(C#N)c1	ZINC000185428279	333140633	/nfs/dbraw/zinc/14/06/33/333140633.db2.gz	IYBYEACGKKWBKL-UHFFFAOYSA-N	0	0	286.375	4.340	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccc(Oc2ccncc2)cc1	ZINC000185559258	333143828	/nfs/dbraw/zinc/14/38/28/333143828.db2.gz	WJQITALTAXNBAM-UHFFFAOYSA-N	0	0	294.354	4.006	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(C)c(OC(F)F)c1	ZINC000185573048	333144098	/nfs/dbraw/zinc/14/40/98/333144098.db2.gz	PPVHEMOSPZXYBQ-LLVKDONJSA-N	0	0	283.318	4.137	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1C[C@H](c2ccccc2C)C[C@H]1C	ZINC000185623806	333145289	/nfs/dbraw/zinc/14/52/89/333145289.db2.gz	LKBDHVRSDFYKKM-GVDBMIGSSA-N	0	0	285.431	4.302	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@H](CC)Cc1ccccc1	ZINC000185676061	333146407	/nfs/dbraw/zinc/14/64/07/333146407.db2.gz	WRDWZDQPSARRFG-DOTOQJQBSA-N	0	0	273.420	4.068	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@H](c1ccccc1)C(F)(F)F	ZINC000185680660	333146566	/nfs/dbraw/zinc/14/65/66/333146566.db2.gz	ZHINTVMXVGJKPE-TZMCWYRMSA-N	0	0	299.336	4.351	20	30		CIEDRN
N#C[C@@H]1CCC[C@@H](Nc2ccc(CC(F)(F)F)cc2)C1	ZINC000185730446	333147415	/nfs/dbraw/zinc/14/74/15/333147415.db2.gz	QTRUMLLBBBQWQC-TZMCWYRMSA-N	0	0	282.309	4.286	20	30		CIEDRN
CCCOc1cc(F)ccc1N[C@@H]1CCC[C@@H](C#N)C1	ZINC000185731425	333147461	/nfs/dbraw/zinc/14/74/61/333147461.db2.gz	YSHLDKYJBNGWBO-TZMCWYRMSA-N	0	0	276.355	4.109	20	30		CIEDRN
CCCOc1cc(F)ccc1N[C@@H]1CCC[C@H](C#N)C1	ZINC000185731390	333147471	/nfs/dbraw/zinc/14/74/71/333147471.db2.gz	YSHLDKYJBNGWBO-GXTWGEPZSA-N	0	0	276.355	4.109	20	30		CIEDRN
CCOc1cc(Cl)ccc1N[C@@H]1CCC[C@H](C#N)C1	ZINC000185731303	333147520	/nfs/dbraw/zinc/14/75/20/333147520.db2.gz	CBNUGTORXWIMHB-WCQYABFASA-N	0	0	278.783	4.233	20	30		CIEDRN
Cc1ccc(N[C@H]2CCC[C@@H](C#N)C2)cc1OCC(F)F	ZINC000185745345	333147817	/nfs/dbraw/zinc/14/78/17/333147817.db2.gz	OUPTZEXFGCXQCS-OLZOCXBDSA-N	0	0	294.345	4.133	20	30		CIEDRN
N#Cc1ccccc1OCc1ccc(C(F)F)cc1	ZINC000185774883	333148447	/nfs/dbraw/zinc/14/84/47/333148447.db2.gz	FFRPUXBMKOTQBY-UHFFFAOYSA-N	0	0	259.255	4.075	20	30		CIEDRN
C=C(C)[C@H](NC(=O)N(C)[C@@H](C)CC)c1ccc(F)c(F)c1	ZINC000185839933	333150106	/nfs/dbraw/zinc/15/01/06/333150106.db2.gz	DLDIPQZAQKWUEZ-NHYWBVRUSA-N	0	0	296.361	4.022	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@H](C)c1cn(C)c2ccccc12	ZINC000185876724	333150853	/nfs/dbraw/zinc/15/08/53/333150853.db2.gz	XRUSWHBRXWTHCL-LSDHHAIUSA-N	0	0	298.430	4.143	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H]1CCC(C)C	ZINC000185889199	333151115	/nfs/dbraw/zinc/15/11/15/333151115.db2.gz	QPLVCHWTXSGPKX-GJZGRUSLSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H]1CCC(C)C	ZINC000185889254	333151208	/nfs/dbraw/zinc/15/12/08/333151208.db2.gz	QPLVCHWTXSGPKX-HUUCEWRRSA-N	0	0	251.414	4.016	20	30		CIEDRN
Cc1ccc2cccc(N[C@H]3CCC[C@@H](C#N)C3)c2n1	ZINC000185888871	333151230	/nfs/dbraw/zinc/15/12/30/333151230.db2.gz	OZFXZGYMFYFFMB-HIFRSBDPSA-N	0	0	265.360	4.038	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1[C@H](C)C[C@H](c2ccccc2)[C@@H]1C	ZINC000185899602	333151372	/nfs/dbraw/zinc/15/13/72/333151372.db2.gz	UEKXAQMZJYLUNL-DFGXFYAUSA-N	0	0	285.431	4.382	20	30		CIEDRN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)C[C@H]1CCC[C@H]1C	ZINC000185906618	333151592	/nfs/dbraw/zinc/15/15/92/333151592.db2.gz	UNINOYVSAYBZGE-CRAIPNDOSA-N	0	0	298.430	4.122	20	30		CIEDRN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)C[C@@H]1CCC[C@@H]1C	ZINC000185906675	333151594	/nfs/dbraw/zinc/15/15/94/333151594.db2.gz	UNINOYVSAYBZGE-YJBOKZPZSA-N	0	0	298.430	4.122	20	30		CIEDRN
C[C@H](c1ccccc1F)N(C)Cc1cccc(C#N)c1F	ZINC000219517069	333151665	/nfs/dbraw/zinc/15/16/65/333151665.db2.gz	YFWICIULBAJWFU-GFCCVEGCSA-N	0	0	286.325	4.029	20	30		CIEDRN
C[C@@H](c1ccccc1F)N(C)Cc1cccc(C#N)c1F	ZINC000219517004	333151706	/nfs/dbraw/zinc/15/17/06/333151706.db2.gz	YFWICIULBAJWFU-LBPRGKRZSA-N	0	0	286.325	4.029	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc2nc(C3CC3)oc2c1	ZINC000185986952	333152973	/nfs/dbraw/zinc/15/29/73/333152973.db2.gz	OOLIMXCMNUPFCN-LLVKDONJSA-N	0	0	284.359	4.246	20	30		CIEDRN
CC#CCCCC(=O)N1CC=C(c2ccc(CC)cc2)CC1	ZINC000185986215	333153022	/nfs/dbraw/zinc/15/30/22/333153022.db2.gz	KBGHYSJYADEAFF-UHFFFAOYSA-N	0	0	295.426	4.058	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1ccc(C)cc1F)c1ccccc1	ZINC000186024122	333153519	/nfs/dbraw/zinc/15/35/19/333153519.db2.gz	KHVSBDUZGFBNKG-OAHLLOKOSA-N	0	0	283.346	4.433	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](C(=C)C)c1ccc(F)c(F)c1	ZINC000186034002	333153765	/nfs/dbraw/zinc/15/37/65/333153765.db2.gz	OHRKSSMGYOSDTP-LRDDRELGSA-N	0	0	293.357	4.301	20	30		CIEDRN
C=C(C)[C@@H](NC(=O)c1ccsc1)c1ccc(F)c(F)c1	ZINC000186044442	333154039	/nfs/dbraw/zinc/15/40/39/333154039.db2.gz	OKEQVYXACGPTFY-CQSZACIVSA-N	0	0	293.338	4.074	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1ccccc1C(C)=O)c1ccccc1	ZINC000186057781	333154190	/nfs/dbraw/zinc/15/41/90/333154190.db2.gz	IUXWOHMLASUEHA-QGZVFWFLSA-N	0	0	293.366	4.188	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CCC)CCc1cccs1	ZINC000186072305	333154374	/nfs/dbraw/zinc/15/43/74/333154374.db2.gz	FRFUQWGATMAJHW-CQSZACIVSA-N	0	0	279.449	4.132	20	30		CIEDRN
C=CCCCC(=O)N[C@H](C(=C)C)c1ccc(F)c(F)c1	ZINC000186074357	333154390	/nfs/dbraw/zinc/15/43/90/333154390.db2.gz	IEEVNAZUOOXYMR-MRXNPFEDSA-N	0	0	279.330	4.055	20	30		CIEDRN
C=CCC[C@@H](C(=O)NCc1cccs1)c1ccccc1	ZINC000186097839	333154706	/nfs/dbraw/zinc/15/47/06/333154706.db2.gz	SODMUFYPXANGNZ-MRXNPFEDSA-N	0	0	285.412	4.114	20	30		CIEDRN
CC#CCCCC(=O)N(CC1CCCCC1)c1ccccn1	ZINC000186085328	333154809	/nfs/dbraw/zinc/15/48/09/333154809.db2.gz	WVZNVXXIKADUSV-UHFFFAOYSA-N	0	0	298.430	4.189	20	30		CIEDRN
C=CCN(C)C(=O)c1cc2sc3ccccc3c2s1	ZINC000186102402	333154917	/nfs/dbraw/zinc/15/49/17/333154917.db2.gz	MSJJJQQFDHZARC-UHFFFAOYSA-N	0	0	287.409	4.374	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@@H](C)c1cccs1)c1ccccc1	ZINC000186197264	333156510	/nfs/dbraw/zinc/15/65/10/333156510.db2.gz	WNCTUVHVQSSIOV-ZFWWWQNUSA-N	0	0	285.412	4.285	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1Cc2ccccc2C[C@H]1CC	ZINC000186365028	333159592	/nfs/dbraw/zinc/15/95/92/333159592.db2.gz	RTVFRALVHFPLTM-GOSISDBHSA-N	0	0	283.415	4.118	20	30		CIEDRN
C=C(C)[C@H](N[C@@H](C)c1cccnc1)c1ccc(F)c(F)c1	ZINC000186445976	333161112	/nfs/dbraw/zinc/16/11/12/333161112.db2.gz	QOSWZEXRZOXACB-SJCJKPOMSA-N	0	0	288.341	4.328	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccc2oc(C)c(C)c2c1	ZINC000186467031	333161328	/nfs/dbraw/zinc/16/13/28/333161328.db2.gz	XWZVSPIIFOVAIA-UHFFFAOYSA-N	0	0	286.375	4.480	20	30		CIEDRN
CC(C)[C@]1(C)C[C@@H]1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000186463669	333161478	/nfs/dbraw/zinc/16/14/78/333161478.db2.gz	WZIBHRYCNRYDRK-QAPCUYQASA-N	0	0	284.403	4.108	20	30		CIEDRN
CC(C)(C)C(=O)CSCc1ccc(Cl)cc1C#N	ZINC000186627648	333163886	/nfs/dbraw/zinc/16/38/86/333163886.db2.gz	KWVYIOXLAWEBBI-UHFFFAOYSA-N	0	0	281.808	4.060	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1ccccc1COC)c1ccccc1	ZINC000186723445	333164844	/nfs/dbraw/zinc/16/48/44/333164844.db2.gz	IHIVQWLVPFXJTA-QGZVFWFLSA-N	0	0	295.382	4.131	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1ccc(OC)c(F)c1)c1ccccc1	ZINC000186785460	333164890	/nfs/dbraw/zinc/16/48/90/333164890.db2.gz	KMKKXLZCXXYAJQ-OAHLLOKOSA-N	0	0	299.345	4.133	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1ccc(OC)c(F)c1)c1ccccc1	ZINC000186785443	333165086	/nfs/dbraw/zinc/16/50/86/333165086.db2.gz	KMKKXLZCXXYAJQ-HNNXBMFYSA-N	0	0	299.345	4.133	20	30		CIEDRN
C=CC[C@H](C(=O)N(C)CCc1ccccc1)c1ccccc1	ZINC000186841016	333165630	/nfs/dbraw/zinc/16/56/30/333165630.db2.gz	DDLWCWNCYNDDAC-IBGZPJMESA-N	0	0	293.410	4.047	20	30		CIEDRN
Cc1ccc([C@@H](C)NCc2ccc(Cl)cc2C#N)cc1	ZINC000187411008	333170664	/nfs/dbraw/zinc/17/06/64/333170664.db2.gz	KGSXETUWLOWCSF-CYBMUJFWSA-N	0	0	284.790	4.371	20	30		CIEDRN
C=CCCCS[C@@H](C)C(=O)N[C@@H](C)c1ccccc1C	ZINC000564166517	333181702	/nfs/dbraw/zinc/18/17/02/333181702.db2.gz	UVXBGQPOTIDODA-GJZGRUSLSA-N	0	0	291.460	4.260	20	30		CIEDRN
Cc1coc2ccc(NC(=O)c3cccc(F)c3C#N)cc12	ZINC000189171798	333183157	/nfs/dbraw/zinc/18/31/57/333183157.db2.gz	LCSNZHYUXADOPA-UHFFFAOYSA-N	0	0	294.285	4.004	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(-c2cc(F)ccc2C)no1	ZINC000521680830	333183861	/nfs/dbraw/zinc/18/38/61/333183861.db2.gz	HOYQEEJKWADYSC-OAHLLOKOSA-N	0	0	260.312	4.038	20	30		CIEDRN
C=CC[C@@H](C(=O)N(C)C1CCCCC1)c1ccccc1	ZINC000189365837	333191158	/nfs/dbraw/zinc/19/11/58/333191158.db2.gz	QLFRLWWXEKUVEA-QGZVFWFLSA-N	0	0	271.404	4.137	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1cccc(C(C)=O)c1)c1ccccc1	ZINC000189444968	333192883	/nfs/dbraw/zinc/19/28/83/333192883.db2.gz	WZLUAYJEJBTEES-GOSISDBHSA-N	0	0	293.366	4.188	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@@H](C)c1ccccc1Cl	ZINC000189859477	333199887	/nfs/dbraw/zinc/19/98/87/333199887.db2.gz	HWOUORKOGDUISW-NHYWBVRUSA-N	0	0	265.784	4.120	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)c1ccc(Cl)cc1C	ZINC000189903845	333200355	/nfs/dbraw/zinc/20/03/55/333200355.db2.gz	RVXVFCIEIIWEDT-UHFFFAOYSA-N	0	0	292.810	4.193	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)c1ccc2c(c1)CCCC2	ZINC000189919993	333200513	/nfs/dbraw/zinc/20/05/13/333200513.db2.gz	PITOCRCLRZBGAA-UHFFFAOYSA-N	0	0	298.430	4.110	20	30		CIEDRN
C=C[C@@H](CC(=O)N(CCC#N)C(C)(C)CC)c1ccccc1	ZINC000189958506	333201131	/nfs/dbraw/zinc/20/11/31/333201131.db2.gz	OTSVJTXJPXDJGW-INIZCTEOSA-N	0	0	298.430	4.277	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H]1CCSc2c(F)cccc21	ZINC000189962207	333201306	/nfs/dbraw/zinc/20/13/06/333201306.db2.gz	KJDJWLFWONZADF-XJKSGUPXSA-N	0	0	293.407	4.081	20	30		CIEDRN
N#Cc1ccc(CNc2ccc(Cl)cc2F)cc1F	ZINC000190313706	333205383	/nfs/dbraw/zinc/20/53/83/333205383.db2.gz	RDTKSGWSTPYGFF-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
N#Cc1ccc(CNc2ccc(F)cc2Cl)cc1F	ZINC000190313591	333205485	/nfs/dbraw/zinc/20/54/85/333205485.db2.gz	HWDKEUXFENFWAX-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@@H](C)c1cc(C)sc1C	ZINC000190325824	333205501	/nfs/dbraw/zinc/20/55/01/333205501.db2.gz	CDHZIYZPQDOVND-NHYWBVRUSA-N	0	0	265.422	4.144	20	30		CIEDRN
CC(F)(F)c1cccc(NCc2ccc(C#N)c(F)c2)c1	ZINC000190405083	333206318	/nfs/dbraw/zinc/20/63/18/333206318.db2.gz	UUYPBLIBGWOMFQ-UHFFFAOYSA-N	0	0	290.288	4.421	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N(C)Cc1cccc(C(F)(F)F)c1	ZINC000190738489	333210225	/nfs/dbraw/zinc/21/02/25/333210225.db2.gz	ZBFSSIDXLNPLKL-HNNXBMFYSA-N	0	0	299.336	4.266	20	30		CIEDRN
N#CCc1ccc(NCc2ccc(OCC3CC3)cc2)cc1	ZINC000190815192	333210987	/nfs/dbraw/zinc/21/09/87/333210987.db2.gz	WACMDIIUMSQZOI-UHFFFAOYSA-N	0	0	292.382	4.154	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cccc(-c2nc(C)c(C)o2)c1	ZINC000190822706	333211169	/nfs/dbraw/zinc/21/11/69/333211169.db2.gz	CRSXOBKQAVLBCQ-GOSISDBHSA-N	0	0	298.386	4.499	20	30		CIEDRN
Cc1ncsc1CCS[C@@H](C)c1ccc(C#N)cc1	ZINC000190949270	333212684	/nfs/dbraw/zinc/21/26/84/333212684.db2.gz	AQDLSCQNAORBOD-LBPRGKRZSA-N	0	0	288.441	4.360	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cccc(COC(C)C)c1	ZINC000191009967	333213521	/nfs/dbraw/zinc/21/35/21/333213521.db2.gz	HSMBRXQHPWZKMV-KRWDZBQOSA-N	0	0	275.392	4.152	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1ccc(O)cc1CC)c1ccccc1	ZINC000191036535	333214065	/nfs/dbraw/zinc/21/40/65/333214065.db2.gz	SWPUNUFLHNAMQD-QGZVFWFLSA-N	0	0	295.382	4.253	20	30		CIEDRN
Cc1cc(Br)c(F)cc1NCCC(C)(C)C#N	ZINC000224373562	333219998	/nfs/dbraw/zinc/21/99/98/333219998.db2.gz	BICHQIHHPONWPE-UHFFFAOYSA-N	0	0	299.187	4.248	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(F)cc1Cl	ZINC000191795292	333225319	/nfs/dbraw/zinc/22/53/19/333225319.db2.gz	NRTDVVWKJYTJTR-CYBMUJFWSA-N	0	0	255.720	4.020	20	30		CIEDRN
COc1ccccc1CS[C@@H](C#N)C1CCCCC1	ZINC000522847560	333223989	/nfs/dbraw/zinc/22/39/89/333223989.db2.gz	AADXMRVKCFVDJZ-INIZCTEOSA-N	0	0	275.417	4.401	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N(C)[C@@H](CC)c1ccccc1OC	ZINC000521940247	333224456	/nfs/dbraw/zinc/22/44/56/333224456.db2.gz	CZELHTRTQVBLIG-MAUKXSAKSA-N	0	0	289.419	4.207	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(OCC)cc2C)CCC1	ZINC000191881116	333226751	/nfs/dbraw/zinc/22/67/51/333226751.db2.gz	NXOQCGDPAJPXRU-UHFFFAOYSA-N	0	0	273.376	4.079	20	30		CIEDRN
C=CCCCC(=O)N(CCC(F)(F)F)Cc1ccccc1	ZINC000191941631	333227517	/nfs/dbraw/zinc/22/75/17/333227517.db2.gz	WDDHIQHCNPCOGY-UHFFFAOYSA-N	0	0	299.336	4.324	20	30		CIEDRN
CN(C(=O)c1cccc(C(C)(C)C)c1)c1cccc(C#N)c1	ZINC000522011382	333230191	/nfs/dbraw/zinc/23/01/91/333230191.db2.gz	YBQHNGSRMROKCN-UHFFFAOYSA-N	0	0	292.382	4.132	20	30		CIEDRN
CCCC1CCC(N(C)C(=O)c2cc(C#N)cs2)CC1	ZINC000192271129	333233981	/nfs/dbraw/zinc/23/39/81/333233981.db2.gz	KAJIDNBOMSYHJY-UHFFFAOYSA-N	0	0	290.432	4.051	20	30		CIEDRN
COc1cccc(CSCc2cc(C#N)ccc2F)c1	ZINC000522064178	333236337	/nfs/dbraw/zinc/23/63/37/333236337.db2.gz	NINWCLCPXKIPHZ-UHFFFAOYSA-N	0	0	287.359	4.139	20	30		CIEDRN
N#Cc1c(F)cccc1NCCc1ccc(Cl)s1	ZINC000225733836	333239549	/nfs/dbraw/zinc/23/95/49/333239549.db2.gz	HIVODYBCFJDHHX-UHFFFAOYSA-N	0	0	280.755	4.067	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)N2CCC[C@@H]2CC)c1	ZINC000522093222	333239728	/nfs/dbraw/zinc/23/97/28/333239728.db2.gz	LXBSHNMVNWGJBK-HNNXBMFYSA-N	0	0	288.391	4.048	20	30		CIEDRN
CCCCN(C(=O)c1cccc(C#N)c1)[C@H]1CCC[C@@H](C)C1	ZINC000575896349	335129058	/nfs/dbraw/zinc/12/90/58/335129058.db2.gz	LCBNZLKHBGISSN-QAPCUYQASA-N	0	0	298.430	4.379	20	30		CIEDRN
N#CC1CCN(CCCc2c(Cl)cccc2Cl)CC1	ZINC000193242613	333246258	/nfs/dbraw/zinc/24/62/58/333246258.db2.gz	PEEQKOHMASNSSV-UHFFFAOYSA-N	0	0	297.229	4.162	20	30		CIEDRN
CCS[C@H]1CCC[C@@H]1Nc1cc(C#N)c2ccccc2n1	ZINC000226126331	333251190	/nfs/dbraw/zinc/25/11/90/333251190.db2.gz	XKIHXTMDJUTUKV-HOTGVXAUSA-N	0	0	297.427	4.193	20	30		CIEDRN
C=CCN(CC=C)C(=O)Nc1cccc(OCCCC)c1	ZINC000193754531	333256517	/nfs/dbraw/zinc/25/65/17/333256517.db2.gz	GZYRQMBHFDEHSA-UHFFFAOYSA-N	0	0	288.391	4.071	20	30		CIEDRN
C[C@@H]1CCCC[C@@H]1OCCNc1ccc(C#N)c(Cl)c1	ZINC000195708345	333261266	/nfs/dbraw/zinc/26/12/66/333261266.db2.gz	UQPAJKIQIHJVJV-WBMJQRKESA-N	0	0	292.810	4.219	20	30		CIEDRN
Cc1cc(C)c(CNc2nc(C)cc(C)c2C#N)c(C)c1	ZINC000195732203	333262480	/nfs/dbraw/zinc/26/24/80/333262480.db2.gz	GDEKNPLRFMFZPD-UHFFFAOYSA-N	0	0	279.387	4.107	20	30		CIEDRN
CC1(C)CCCC[C@@H]1C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000194391434	333270314	/nfs/dbraw/zinc/27/03/14/333270314.db2.gz	BLPPINGQLQHYSN-IAGOWNOFSA-N	0	0	298.430	4.364	20	30		CIEDRN
CCC(=O)c1ccc(O[C@H](C)c2ccc(C#N)cc2)cc1	ZINC000194622075	333273377	/nfs/dbraw/zinc/27/33/77/333273377.db2.gz	BJRJZHRHEOCIMB-CYBMUJFWSA-N	0	0	279.339	4.291	20	30		CIEDRN
CCCC[C@@H](CC)CC(=O)Nc1scc(C)c1C#N	ZINC000564191245	333277277	/nfs/dbraw/zinc/27/72/77/333277277.db2.gz	ZEINTNORSOPQJA-GFCCVEGCSA-N	0	0	278.421	4.473	20	30		CIEDRN
N#Cc1ccc(OCc2ccc(Cl)c(F)c2)c(F)c1	ZINC000227301381	333280016	/nfs/dbraw/zinc/28/00/16/333280016.db2.gz	DIDASWFKNFPKKV-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
C[C@H](C(=O)Nc1sc2c(c1C#N)CCCC2)C(C)(C)C	ZINC000522334781	333283139	/nfs/dbraw/zinc/28/31/39/333283139.db2.gz	OOVJIFLZHYQXQV-SNVBAGLBSA-N	0	0	290.432	4.119	20	30		CIEDRN
CS[C@H]1CCC[C@@H](Nc2cc(Cl)ccc2C#N)C1	ZINC000227652654	333287270	/nfs/dbraw/zinc/28/72/70/333287270.db2.gz	PEMHAJWELLSTPP-OLZOCXBDSA-N	0	0	280.824	4.298	20	30		CIEDRN
CCc1ccc(CNc2cc(C#N)c3ccccc3n2)s1	ZINC000227649392	333287308	/nfs/dbraw/zinc/28/73/08/333287308.db2.gz	CWORPHDXJQABJD-UHFFFAOYSA-N	0	0	293.395	4.342	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(OCCC)c(Cl)c1	ZINC000522571419	333290631	/nfs/dbraw/zinc/29/06/31/333290631.db2.gz	VXAZKRSFURCTRO-UHFFFAOYSA-N	0	0	267.756	4.034	20	30		CIEDRN
C=CCCC(=O)NCC1(c2ccc(Cl)cc2)CCCC1	ZINC000522571445	333290704	/nfs/dbraw/zinc/29/07/04/333290704.db2.gz	WOIBWBZJWCSMIA-UHFFFAOYSA-N	0	0	291.822	4.234	20	30		CIEDRN
C=CCCC(=O)Nc1ccc2c(ccn2CC(C)C)c1	ZINC000522576648	333290844	/nfs/dbraw/zinc/29/08/44/333290844.db2.gz	WQQTYRKXUNQFNB-UHFFFAOYSA-N	0	0	270.376	4.202	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1ccc2c(ccn2CC(C)C)c1	ZINC000522654819	333295168	/nfs/dbraw/zinc/29/51/68/333295168.db2.gz	JESUQOYCHNBPQC-AWEZNQCLSA-N	0	0	299.418	4.383	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1ccc(OC(C)C)c(Cl)c1	ZINC000522661306	333295544	/nfs/dbraw/zinc/29/55/44/333295544.db2.gz	QNZZVGWFBVDWFN-NSHDSACASA-N	0	0	296.798	4.213	20	30		CIEDRN
C[C@H](CNc1cc(Cl)ccc1C#N)Oc1ccccc1	ZINC000522903695	333299494	/nfs/dbraw/zinc/29/94/94/333299494.db2.gz	BQJSPSXQBGOEHZ-GFCCVEGCSA-N	0	0	286.762	4.091	20	30		CIEDRN
C=CCCCN(C)C(=O)Cc1coc2cc(C)c(C)cc12	ZINC000522946495	333300637	/nfs/dbraw/zinc/30/06/37/333300637.db2.gz	HMZGONYUWYFAQJ-UHFFFAOYSA-N	0	0	285.387	4.017	20	30		CIEDRN
C=CCCCN(C)C(=O)c1ccc(OCCC(C)C)cc1	ZINC000522947609	333300720	/nfs/dbraw/zinc/30/07/20/333300720.db2.gz	OKEJKYJEWFYSFW-UHFFFAOYSA-N	0	0	289.419	4.150	20	30		CIEDRN
C=CCCCN(C)C(=O)[C@H](CC1CCCC1)C(C)C	ZINC000522947630	333301000	/nfs/dbraw/zinc/30/10/00/333301000.db2.gz	PZPKOPHBAKFQPP-MRXNPFEDSA-N	0	0	265.441	4.264	20	30		CIEDRN
C=CCCCN(C)C(=O)N[C@@H](CCC)Cc1ccccc1	ZINC000522985806	333303313	/nfs/dbraw/zinc/30/33/13/333303313.db2.gz	NKPUUBALIXHWLV-KRWDZBQOSA-N	0	0	288.435	4.005	20	30		CIEDRN
N#Cc1cc(CNc2ccc(C(F)(F)F)cc2)ccc1F	ZINC000229721302	333308543	/nfs/dbraw/zinc/30/85/43/333308543.db2.gz	VERQSSDXEULZBH-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
Cc1ccc(C[C@H](C)Nc2ncc(C#N)cc2Cl)s1	ZINC000523101819	333308824	/nfs/dbraw/zinc/30/88/24/333308824.db2.gz	BNFVGUWYNSQUHO-VIFPVBQESA-N	0	0	291.807	4.020	20	30		CIEDRN
N#Cc1cc(CSc2ccc(F)c(F)c2)ccc1F	ZINC000229753787	333309340	/nfs/dbraw/zinc/30/93/40/333309340.db2.gz	FWDBLMNPAMLFAX-UHFFFAOYSA-N	0	0	279.286	4.268	20	30		CIEDRN
C=CCCC(=O)N[C@H](C)C(c1ccccc1)c1ccccc1	ZINC000523223960	333313004	/nfs/dbraw/zinc/31/30/04/333313004.db2.gz	DEDLBKUBNDTASH-MRXNPFEDSA-N	0	0	293.410	4.289	20	30		CIEDRN
Cc1cc(C#N)ccc1OCc1cc(-c2cccs2)on1	ZINC000523382177	333325035	/nfs/dbraw/zinc/32/50/35/333325035.db2.gz	IMBUIULQQOKRIT-UHFFFAOYSA-N	0	0	296.351	4.162	20	30		CIEDRN
C[C@H](Nc1cccc(F)c1C#N)c1cccc(F)c1F	ZINC000231631892	333326337	/nfs/dbraw/zinc/32/63/37/333326337.db2.gz	UHHVXXWBQGYFCI-VIFPVBQESA-N	0	0	276.261	4.149	20	30		CIEDRN
C[C@H](Nc1ccc(F)cc1C#N)c1cccc(F)c1F	ZINC000231631843	333326350	/nfs/dbraw/zinc/32/63/50/333326350.db2.gz	BNNCHYWHPZXBJW-VIFPVBQESA-N	0	0	276.261	4.149	20	30		CIEDRN
C[C@H]1C[C@H]1c1ccc(CNc2c(F)cc(C#N)cc2F)o1	ZINC000523478637	333329263	/nfs/dbraw/zinc/32/92/63/333329263.db2.gz	YSRHDAMDYDHCLO-JOYOIKCWSA-N	0	0	288.297	4.165	20	30		CIEDRN
C=CCCCCCN(C)C(=O)CCSc1ccccc1	ZINC000523510930	333331434	/nfs/dbraw/zinc/33/14/34/333331434.db2.gz	KSXINJADRITAFE-UHFFFAOYSA-N	0	0	291.460	4.374	20	30		CIEDRN
C=CCCS[C@@H](C(=O)N1CCCCC1)c1ccccc1	ZINC000523521812	333331995	/nfs/dbraw/zinc/33/19/95/333331995.db2.gz	DXSCEKBFNUBGSB-MRXNPFEDSA-N	0	0	289.444	4.050	20	30		CIEDRN
C=CCCS[C@@H](C)C(=O)N[C@@H](C)c1ccc(CC)cc1	ZINC000523522768	333332136	/nfs/dbraw/zinc/33/21/36/333332136.db2.gz	ANRWVXPLVWLSLA-KBPBESRZSA-N	0	0	291.460	4.124	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@@H](CC)Nc1ccccc1	ZINC000523562955	333333159	/nfs/dbraw/zinc/33/31/59/333333159.db2.gz	CVZKEFHKUYNAIX-QGZVFWFLSA-N	0	0	288.435	4.082	20	30		CIEDRN
Cc1cc(Br)cc(NCCC(C)(C)C#N)c1	ZINC000232067608	333333565	/nfs/dbraw/zinc/33/35/65/333333565.db2.gz	LWSJJYASPBRVJN-UHFFFAOYSA-N	0	0	281.197	4.109	20	30		CIEDRN
Cc1ccc(NC(=O)Nc2ccc(C#N)cc2)c(Cl)c1	ZINC000302971597	333336256	/nfs/dbraw/zinc/33/62/56/333336256.db2.gz	SIXJXRIZOYRSNI-UHFFFAOYSA-N	0	0	285.734	4.164	20	30		CIEDRN
CC(C)(C#N)CCCCOc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000232520573	333337921	/nfs/dbraw/zinc/33/79/21/333337921.db2.gz	YZPRJVNECFAFEN-UHFFFAOYSA-N	0	0	296.754	4.347	20	30		CIEDRN
CC(C)(C#N)CCCCn1cnc2cc(F)c(F)cc21	ZINC000232528499	333338189	/nfs/dbraw/zinc/33/81/89/333338189.db2.gz	CDAUPUOOJSEGRM-UHFFFAOYSA-N	0	0	277.318	4.035	20	30		CIEDRN
CC(C)(C#N)CCCCN1CCCc2ccccc21	ZINC000232528938	333338193	/nfs/dbraw/zinc/33/81/93/333338193.db2.gz	GYBHHXWMXCSYQF-UHFFFAOYSA-N	0	0	256.393	4.159	20	30		CIEDRN
C=CCOc1cccc(NC(=O)C[C@H](CC)C(C)C)c1	ZINC000303283385	333339452	/nfs/dbraw/zinc/33/94/52/333339452.db2.gz	VDZHYHNDSDBROA-AWEZNQCLSA-N	0	0	275.392	4.262	20	30		CIEDRN
CC[C@H](Sc1ccccc1)C(=O)Nc1cccc(C#N)c1	ZINC000303459810	333342391	/nfs/dbraw/zinc/34/23/91/333342391.db2.gz	LMERDTIIPQVTBO-INIZCTEOSA-N	0	0	296.395	4.068	20	30		CIEDRN
Cc1sc(NC(=O)C2CCCCCC2)c(C#N)c1C	ZINC000523868157	333348694	/nfs/dbraw/zinc/34/86/94/333348694.db2.gz	SLWGDTHMVDLTJR-UHFFFAOYSA-N	0	0	276.405	4.146	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(OCCC)c(OCCC)c1	ZINC000523956145	333350098	/nfs/dbraw/zinc/35/00/98/333350098.db2.gz	ATLCFWLSYJCDDK-UHFFFAOYSA-N	0	0	291.391	4.169	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)c1cc2c(s1)-c1ccccc1CC2	ZINC000523961832	333350196	/nfs/dbraw/zinc/35/01/96/333350196.db2.gz	GWKLVEYZLQPWSR-GFCCVEGCSA-N	0	0	297.423	4.208	20	30		CIEDRN
CC(C)c1ccc(C(=O)N[C@]2(C#N)CCC[C@@H](C)C2)cc1	ZINC000523969541	333350301	/nfs/dbraw/zinc/35/03/01/333350301.db2.gz	UTJRFJOQKPXTGA-RDTXWAMCSA-N	0	0	284.403	4.012	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)c1ccc(-c2ccc(F)cc2)s1	ZINC000523968424	333350314	/nfs/dbraw/zinc/35/03/14/333350314.db2.gz	SMVJPTOHHADSGT-LLVKDONJSA-N	0	0	289.375	4.249	20	30		CIEDRN
C=CCn1c2ccccc2nc1S[C@@H](C)c1cccnc1	ZINC000523981185	333350530	/nfs/dbraw/zinc/35/05/30/333350530.db2.gz	FOGOLQQVBGOIDZ-ZDUSSCGKSA-N	0	0	295.411	4.471	20	30		CIEDRN
CCN(CCCCC(C)(C)C#N)c1ccc(F)cc1	ZINC000233444240	333352323	/nfs/dbraw/zinc/35/23/23/333352323.db2.gz	MNJZLILICQNZPQ-UHFFFAOYSA-N	0	0	262.372	4.372	20	30		CIEDRN
CCCCOc1ccccc1NCc1ccc(C#N)cc1F	ZINC000524095906	333353241	/nfs/dbraw/zinc/35/32/41/333353241.db2.gz	YHPDPHCSMNSYSW-UHFFFAOYSA-N	0	0	298.361	4.488	20	30		CIEDRN
CN(CCCCc1ccccc1)c1ncc(C#N)cc1Cl	ZINC000524166459	333355091	/nfs/dbraw/zinc/35/50/91/333355091.db2.gz	HQVWOIFSKWCNMO-UHFFFAOYSA-N	0	0	299.805	4.066	20	30		CIEDRN
CC(C)CC[C@H](NC(=O)c1sccc1C#N)C(C)(C)C	ZINC000524185894	333355485	/nfs/dbraw/zinc/35/54/85/333355485.db2.gz	AOOLLTJJCAHJFK-ZDUSSCGKSA-N	0	0	292.448	4.200	20	30		CIEDRN
C=CC[C@H](C)NC(=O)[C@@H](CC)CC1CCCCC1	ZINC000524194715	333356159	/nfs/dbraw/zinc/35/61/59/333356159.db2.gz	ITGKYTFJIBLWGZ-ZFWWWQNUSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1ccc(CCCC)cc1	ZINC000524206425	333356314	/nfs/dbraw/zinc/35/63/14/333356314.db2.gz	AUDJFQNSVSTVLI-CYBMUJFWSA-N	0	0	260.381	4.115	20	30		CIEDRN
CCc1ccc([C@H](C)Nc2nccc(C#N)c2Cl)cc1	ZINC000234159885	333358521	/nfs/dbraw/zinc/35/85/21/333358521.db2.gz	DRWCGQVVBFCLFX-NSHDSACASA-N	0	0	285.778	4.342	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)N(C)[C@H](C)CCC)c1	ZINC000524305387	333359620	/nfs/dbraw/zinc/35/96/20/333359620.db2.gz	JKDAXUIXFMIQCE-CQSZACIVSA-N	0	0	290.407	4.294	20	30		CIEDRN
C=CCSCC(=O)N(C1CCCCC1)C1CCCCC1	ZINC000524460021	333362685	/nfs/dbraw/zinc/36/26/85/333362685.db2.gz	PAJNVNQBHOGMKH-UHFFFAOYSA-N	0	0	295.492	4.400	20	30		CIEDRN
C[C@H](CC(=O)Nc1ccccc1C#N)C1CCCCC1	ZINC000524466451	333362687	/nfs/dbraw/zinc/36/26/87/333362687.db2.gz	HNLSRKSILRGUHF-CYBMUJFWSA-N	0	0	270.376	4.103	20	30		CIEDRN
CC(C)CC[C@@H](NC(=O)c1cccc(C#N)c1)C(C)(C)C	ZINC000524529628	333364995	/nfs/dbraw/zinc/36/49/95/333364995.db2.gz	VJOCAGWAMFIFAR-MRXNPFEDSA-N	0	0	286.419	4.139	20	30		CIEDRN
N#Cc1ccc(SCc2ccc3c(c2)CCC3)cc1	ZINC000524537321	333365343	/nfs/dbraw/zinc/36/53/43/333365343.db2.gz	NJPHMUOZEWUIFP-UHFFFAOYSA-N	0	0	265.381	4.339	20	30		CIEDRN
C[C@@H](Nc1nccc(C#N)c1Cl)c1ccccc1Cl	ZINC000235285907	333367299	/nfs/dbraw/zinc/36/72/99/333367299.db2.gz	UOVZKAGUAKEELU-SECBINFHSA-N	0	0	292.169	4.433	20	30		CIEDRN
C=CCCSCc1cccc(OCC(F)(F)F)c1	ZINC000524604729	333368466	/nfs/dbraw/zinc/36/84/66/333368466.db2.gz	CWGAICPFMLGNHL-UHFFFAOYSA-N	0	0	276.323	4.437	20	30		CIEDRN
CC1=C[C@H](C)C[C@@H](CNc2ccc(CC#N)cc2)C1	ZINC000235403888	333369139	/nfs/dbraw/zinc/36/91/39/333369139.db2.gz	ILFCVEJMFAKQMN-XJKSGUPXSA-N	0	0	254.377	4.157	20	30		CIEDRN
Cc1ccc(C[C@@H](C)Nc2nccc(C#N)c2Cl)s1	ZINC000235461548	333369797	/nfs/dbraw/zinc/36/97/97/333369797.db2.gz	LNJOZDUXZBKJNI-SECBINFHSA-N	0	0	291.807	4.020	20	30		CIEDRN
Cc1csc(C(=O)Nc2ccc(CC#N)cc2)c1Cl	ZINC000235966135	333372756	/nfs/dbraw/zinc/37/27/56/333372756.db2.gz	KIQQZRSQNUEOSQ-UHFFFAOYSA-N	0	0	290.775	4.028	20	30		CIEDRN
C=CCOc1ccc(CNc2ccc3oc(C)nc3c2)cc1	ZINC000237846097	333381887	/nfs/dbraw/zinc/38/18/87/333381887.db2.gz	BQIHWLMYQCKJLD-UHFFFAOYSA-N	0	0	294.354	4.313	20	30		CIEDRN
CCOc1cc(C#N)ccc1OCc1ccc2c(c1)CCC2	ZINC000315946184	333384547	/nfs/dbraw/zinc/38/45/47/333384547.db2.gz	JNMPCGIXHPLSRG-UHFFFAOYSA-N	0	0	293.366	4.025	20	30		CIEDRN
Cc1cc(C#N)cc(C)c1OCc1ccn(C2CCCC2)n1	ZINC000316086568	333385267	/nfs/dbraw/zinc/38/52/67/333385267.db2.gz	BMNRZZFKOGKRNY-UHFFFAOYSA-N	0	0	295.386	4.066	20	30		CIEDRN
CC(C)(C)c1ccc(C(=O)N[C@@H](C#N)C2CCCCC2)cc1	ZINC000316099559	333385395	/nfs/dbraw/zinc/38/53/95/333385395.db2.gz	MQESNMOGQFUHFC-KRWDZBQOSA-N	0	0	298.430	4.186	20	30		CIEDRN
C=CCCCCCN(C)C(=O)N[C@@H](C)CCC(C)C	ZINC000524799953	333388508	/nfs/dbraw/zinc/38/85/08/333388508.db2.gz	YOKCGTJJMYIGHG-HNNXBMFYSA-N	0	0	268.445	4.199	20	30		CIEDRN
C=CCCCNc1cc(Cl)ccc1OC[C@H]1CCCO1	ZINC000524842583	333389963	/nfs/dbraw/zinc/38/99/63/333389963.db2.gz	BWHRQQOLNUQCSM-CQSZACIVSA-N	0	0	295.810	4.276	20	30		CIEDRN
Cc1ccccc1OCCCSc1ccccc1C#N	ZINC000525083363	333398313	/nfs/dbraw/zinc/39/83/13/333398313.db2.gz	ODMNUEUUKGHPDK-UHFFFAOYSA-N	0	0	283.396	4.428	20	30		CIEDRN
C[C@@H]1CCCC[C@@H]1OCCSc1ccc(C#N)cc1F	ZINC000525115862	333398709	/nfs/dbraw/zinc/39/87/09/333398709.db2.gz	DKKFCFWENLOKDS-DOMZBBRYSA-N	0	0	293.407	4.385	20	30		CIEDRN
C=C1CCN(Cc2cc(Cl)ccc2Cl)CC1	ZINC000525111832	333398820	/nfs/dbraw/zinc/39/88/20/333398820.db2.gz	CWAUCTDQMNAWOV-UHFFFAOYSA-N	0	0	256.176	4.145	20	30		CIEDRN
CC#CC[N@H+](Cc1ccccc1)[C@H](C)c1cccs1	ZINC000525119949	333399201	/nfs/dbraw/zinc/39/92/01/333399201.db2.gz	FFMUSDWETFCHJH-OAHLLOKOSA-N	0	0	269.413	4.335	20	30		CIEDRN
CCC(CC)(CC)NC(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000525127784	333400476	/nfs/dbraw/zinc/40/04/76/333400476.db2.gz	CMZMJDNMGSSKDB-UHFFFAOYSA-N	0	0	293.798	4.302	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)NC[C@@H](C)C(C)C	ZINC000525317978	333408629	/nfs/dbraw/zinc/40/86/29/333408629.db2.gz	QKUYWXAJRCIJDB-OAHLLOKOSA-N	0	0	280.456	4.056	20	30		CIEDRN
COc1cccc([C@H](C)Nc2ccc(C#N)c(Cl)c2)c1	ZINC000036963985	333443292	/nfs/dbraw/zinc/44/32/92/333443292.db2.gz	QILDHRFBJIMQGO-NSHDSACASA-N	0	0	286.762	4.393	20	30		CIEDRN
CCC(C#N)(CC)C(=O)N[C@H]1CCC[C@H](c2ccccc2)C1	ZINC000529163079	333475393	/nfs/dbraw/zinc/47/53/93/333475393.db2.gz	CYNACXXRVQGJOD-IRXDYDNUSA-N	0	0	298.430	4.159	20	30		CIEDRN
C=CC[C@@H]1CCCN(C(=O)Nc2ccc3occc3c2)C1	ZINC000529276702	333480985	/nfs/dbraw/zinc/48/09/85/333480985.db2.gz	PDGBLOIZFSQXGQ-CYBMUJFWSA-N	0	0	284.359	4.253	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cc(OC)c(O)c2ccccc12	ZINC000529543073	333495671	/nfs/dbraw/zinc/49/56/71/333495671.db2.gz	MTHDLFVZZMQHHH-GFCCVEGCSA-N	0	0	299.370	4.095	20	30		CIEDRN
COc1ccc(SCCCOc2cccc(C#N)c2)cc1	ZINC000037143607	333497967	/nfs/dbraw/zinc/49/79/67/333497967.db2.gz	CALCLHWJMSLASO-UHFFFAOYSA-N	0	0	299.395	4.128	20	30		CIEDRN
COC(C)(C)c1ccc(-c2ccc(C#N)s2)cc1	ZINC000530247732	333529850	/nfs/dbraw/zinc/52/98/50/333529850.db2.gz	AVHFHRJKEQAQBL-UHFFFAOYSA-N	0	0	257.358	4.168	20	30		CIEDRN
N#Cc1cc(-c2cnc(C3CC3)o2)cc(C(F)(F)F)c1	ZINC000530250730	333530201	/nfs/dbraw/zinc/53/02/01/333530201.db2.gz	NFWFQPOLQHFLFX-UHFFFAOYSA-N	0	0	278.233	4.109	20	30		CIEDRN
N#Cc1ccccc1CSc1ccc(F)c(F)c1	ZINC000037374917	333532641	/nfs/dbraw/zinc/53/26/41/333532641.db2.gz	FZFSVISUKOZOJB-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
N#Cc1ccc(OCCSC2CCCCC2)cc1	ZINC000037485915	333533404	/nfs/dbraw/zinc/53/34/04/333533404.db2.gz	LGGUDWZAGQGNCI-UHFFFAOYSA-N	0	0	261.390	4.003	20	30		CIEDRN
C[C@H]1CCCC[C@@H]1Nc1cccc(OCCCC#N)c1	ZINC000037777387	333539552	/nfs/dbraw/zinc/53/95/52/333539552.db2.gz	ZMRLYAKUWPDLNN-YOEHRIQHSA-N	0	0	272.392	4.360	20	30		CIEDRN
C[C@@H]1CCCC[C@H]1Nc1cccc(OCCCC#N)c1	ZINC000037777388	333539559	/nfs/dbraw/zinc/53/95/59/333539559.db2.gz	ZMRLYAKUWPDLNN-RHSMWYFYSA-N	0	0	272.392	4.360	20	30		CIEDRN
CC(C)Oc1ccccc1NCc1ccc(F)c(C#N)c1	ZINC000124020594	333555399	/nfs/dbraw/zinc/55/53/99/333555399.db2.gz	KEFHPGKCBUZHIX-UHFFFAOYSA-N	0	0	284.334	4.097	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccc(F)cc1OCCC	ZINC000125601727	333568172	/nfs/dbraw/zinc/56/81/72/333568172.db2.gz	PNXSJEUHBXVZJJ-UHFFFAOYSA-N	0	0	294.370	4.044	20	30		CIEDRN
C=C(CC)COc1ccc(Oc2nccs2)cc1	ZINC000537993781	333569962	/nfs/dbraw/zinc/56/99/62/333569962.db2.gz	XCMNESDILBTWGZ-UHFFFAOYSA-N	0	0	261.346	4.280	20	30		CIEDRN
C=CC[C@H](C)NC(=O)c1sc(C2CCCCC2)nc1C	ZINC000538251574	333581631	/nfs/dbraw/zinc/58/16/31/333581631.db2.gz	BVLPOWIGUAVIPP-NSHDSACASA-N	0	0	292.448	4.194	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N[C@@H](C)c1cccc(F)c1F	ZINC000538287857	333583178	/nfs/dbraw/zinc/58/31/78/333583178.db2.gz	SGCFLJLFUCCDBV-NEPJUHHUSA-N	0	0	296.361	4.070	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N(CC)Cc1cccc(F)c1	ZINC000538291854	333583471	/nfs/dbraw/zinc/58/34/71/333583471.db2.gz	TTYKIPKRKUUZSC-CQSZACIVSA-N	0	0	292.398	4.102	20	30		CIEDRN
C=CCCOCCCCC(=O)N(CC)[C@@H]1CCCC[C@H]1C	ZINC000538296756	333583627	/nfs/dbraw/zinc/58/36/27/333583627.db2.gz	LSZKLALJDAISGR-IAGOWNOFSA-N	0	0	295.467	4.177	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1cc2cccc(C)c2o1	ZINC000538332300	333585465	/nfs/dbraw/zinc/58/54/65/333585465.db2.gz	ACMLZTUSAMYPPI-ZDUSSCGKSA-N	0	0	271.360	4.216	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Cc1ccc2ccccc2c1	ZINC000538334003	333585754	/nfs/dbraw/zinc/58/57/54/333585754.db2.gz	IHCJBECVCWRGQC-OAHLLOKOSA-N	0	0	281.399	4.243	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1c[nH]cc1-c1ccccc1	ZINC000538337197	333585889	/nfs/dbraw/zinc/58/58/89/333585889.db2.gz	JFIXYDVPQLNEID-CQSZACIVSA-N	0	0	282.387	4.156	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1ccc(Cl)cc1F	ZINC000538339650	333586212	/nfs/dbraw/zinc/58/62/12/333586212.db2.gz	LOGZRTFHDRZNRN-JTQLQIEISA-N	0	0	284.762	4.345	20	30		CIEDRN
Cc1c2ccccc2oc1[C@@H](NCC1(C#N)CC1)C(C)C	ZINC000538388874	333587532	/nfs/dbraw/zinc/58/75/32/333587532.db2.gz	IJHGRIMULQMNON-INIZCTEOSA-N	0	0	282.387	4.332	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)[C@H]2CC[C@@H](C)C2)c1	ZINC000538442186	333592657	/nfs/dbraw/zinc/59/26/57/333592657.db2.gz	GONYTXOITVEJTC-KGLIPLIRSA-N	0	0	273.376	4.016	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)c1ccc(Cl)cc1F	ZINC000126264611	333595529	/nfs/dbraw/zinc/59/55/29/333595529.db2.gz	DEGJSSNBTDSWFB-UHFFFAOYSA-N	0	0	296.773	4.071	20	30		CIEDRN
CN(Cc1cccc(C#N)c1)c1cccc2ccccc21	ZINC000065590193	333598010	/nfs/dbraw/zinc/59/80/10/333598010.db2.gz	AYOMZCXDTDZOME-UHFFFAOYSA-N	0	0	272.351	4.348	20	30		CIEDRN
C=C(C)COc1cc(/C=C(/C)c2cnccn2)ccc1OC	ZINC000126561015	333600105	/nfs/dbraw/zinc/60/01/05/333600105.db2.gz	LVVAVXLJIMCQOH-ZROIWOOFSA-N	0	0	296.370	4.001	20	30		CIEDRN
C=CCCCCN(C)Cc1csc([C@H](C)OCC)n1	ZINC000576075768	335149798	/nfs/dbraw/zinc/14/97/98/335149798.db2.gz	PAOZMTZOXQEYAC-ZDUSSCGKSA-N	0	0	282.453	4.029	20	30		CIEDRN
C=CCCCCSc1nnc(-c2sc(C)nc2C)o1	ZINC000576106040	335154883	/nfs/dbraw/zinc/15/48/83/335154883.db2.gz	ZUTHOZQIYYLZEZ-UHFFFAOYSA-N	0	0	295.433	4.258	20	30		CIEDRN
COc1ccc(C)cc1CNc1ccc(C#N)cc1Cl	ZINC000225235630	333625490	/nfs/dbraw/zinc/62/54/90/333625490.db2.gz	GKOIQPKAIVFTSZ-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
CCN(CCC#N)Cc1cc(C(F)(F)F)ccc1Cl	ZINC000127606789	333632575	/nfs/dbraw/zinc/63/25/75/333632575.db2.gz	QMNFSVPTZKXGCK-UHFFFAOYSA-N	0	0	290.716	4.094	20	30		CIEDRN
C=C(CC)CS[C@@H](C)c1nc(CCCC)no1	ZINC000539095073	333657659	/nfs/dbraw/zinc/65/76/59/333657659.db2.gz	PIPGMUYSTAJXRX-NSHDSACASA-N	0	0	254.399	4.173	20	30		CIEDRN
C=C(CC)CSc1nnc(COc2cccc(C)c2)o1	ZINC000539112971	333659005	/nfs/dbraw/zinc/65/90/05/333659005.db2.gz	QILMUMGJUOFOLI-UHFFFAOYSA-N	0	0	290.388	4.015	20	30		CIEDRN
CC(C)N(C(=O)c1ccc(Cl)c(C#N)c1)c1ccccc1	ZINC000539368350	333667677	/nfs/dbraw/zinc/66/76/77/333667677.db2.gz	OKWCKDROZXZOPK-UHFFFAOYSA-N	0	0	298.773	4.267	20	30		CIEDRN
N#Cc1cc(CNc2cc(F)cc(Cl)c2)ccc1F	ZINC000128419450	333669691	/nfs/dbraw/zinc/66/96/91/333669691.db2.gz	LIVXMAZWQXICLS-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@@H](c1ccccc1)C(C)C	ZINC000539435856	333671237	/nfs/dbraw/zinc/67/12/37/333671237.db2.gz	YWXVGXHRPJDOIH-DOTOQJQBSA-N	0	0	273.420	4.287	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)[C@@H](CC)Cc1ccccc1	ZINC000539433370	333671367	/nfs/dbraw/zinc/67/13/67/333671367.db2.gz	KUSMSYKUSBZGHG-WBVHZDCISA-N	0	0	273.420	4.116	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1cc(F)c(Cl)cc1F	ZINC000539434805	333671393	/nfs/dbraw/zinc/67/13/93/333671393.db2.gz	WHIQXWBMOLFEBM-SECBINFHSA-N	0	0	287.737	4.093	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)[C@H](C)CCc1ccccc1F	ZINC000539437591	333671579	/nfs/dbraw/zinc/67/15/79/333671579.db2.gz	XVYLPALFIKUIJT-HUUCEWRRSA-N	0	0	291.410	4.255	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1ccc2ncsc2c1	ZINC000539446651	333671902	/nfs/dbraw/zinc/67/19/02/333671902.db2.gz	MBBFUKHBYZOTIA-LLVKDONJSA-N	0	0	289.404	4.163	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)[C@H]1CC[C@@H](C)C1	ZINC000539548711	333678037	/nfs/dbraw/zinc/67/80/37/333678037.db2.gz	RXVUMDMEYAMKBY-NEPJUHHUSA-N	0	0	297.851	4.352	20	30		CIEDRN
N#Cc1cccc(SCCCCC2CCOCC2)c1	ZINC000539709469	333686529	/nfs/dbraw/zinc/68/65/29/333686529.db2.gz	OFJJLMHWSWFWOI-UHFFFAOYSA-N	0	0	275.417	4.247	20	30		CIEDRN
C=C(CC)CSCC(=O)c1c[nH]c2ccccc12	ZINC000540193344	333720102	/nfs/dbraw/zinc/72/01/02/333720102.db2.gz	FLDPXBYBZNDUTE-UHFFFAOYSA-N	0	0	259.374	4.050	20	30		CIEDRN
N#Cc1ccc(SCc2cccc(C#N)c2F)c(F)c1	ZINC000540349776	333726603	/nfs/dbraw/zinc/72/66/03/333726603.db2.gz	LQDOTXYCWXSCPK-UHFFFAOYSA-N	0	0	286.306	4.000	20	30		CIEDRN
C=CCCC[C@@H](C)Sc1ccc(NC(C)=O)cc1	ZINC000540371244	333727372	/nfs/dbraw/zinc/72/73/72/333727372.db2.gz	CVJKYWCXTKIHNW-GFCCVEGCSA-N	0	0	263.406	4.482	20	30		CIEDRN
C=CCCC[C@@H](C)Sc1nnc(-c2ccoc2C)o1	ZINC000540371918	333727383	/nfs/dbraw/zinc/72/73/83/333727383.db2.gz	NJTMXTGXTHEYMC-SNVBAGLBSA-N	0	0	278.377	4.475	20	30		CIEDRN
C=CCCOCCCCC(=O)Nc1ccc(Cl)cc1	ZINC000540466159	333730871	/nfs/dbraw/zinc/73/08/71/333730871.db2.gz	VVMSILBAFBOOFP-UHFFFAOYSA-N	0	0	281.783	4.042	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N1CCC[C@@H]1C1CCCC1	ZINC000540487779	333732000	/nfs/dbraw/zinc/73/20/00/333732000.db2.gz	NVOBFBVKLDEORD-GOEBONIOSA-N	0	0	278.440	4.095	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1cc(Cl)ccc1Cl	ZINC000540532179	333734299	/nfs/dbraw/zinc/73/42/99/333734299.db2.gz	OLDPOMWUMKAPRJ-SNVBAGLBSA-N	0	0	286.202	4.468	20	30		CIEDRN
C=CCC[C@H](NC(=O)N1CC[C@@H]1C(C)C)c1ccccc1	ZINC000540583295	333735736	/nfs/dbraw/zinc/73/57/36/333735736.db2.gz	AVLMZSBVVRWGMM-DLBZAZTESA-N	0	0	286.419	4.134	20	30		CIEDRN
CCC[C@H](C(=O)Nc1cc(C#N)ccc1C)c1ccccc1	ZINC000069177362	333753901	/nfs/dbraw/zinc/75/39/01/333753901.db2.gz	WQWQDAFEMNJPRJ-KRWDZBQOSA-N	0	0	292.382	4.389	20	30		CIEDRN
C=C(C)COc1cccc(NCc2occc2C)c1	ZINC000129255012	333754121	/nfs/dbraw/zinc/75/41/21/333754121.db2.gz	VCTCKDSHBSUXAY-UHFFFAOYSA-N	0	0	257.333	4.155	20	30		CIEDRN
COc1ccc(C#N)cc1CSc1ccc(F)c(F)c1	ZINC000129273310	333754577	/nfs/dbraw/zinc/75/45/77/333754577.db2.gz	BUSJLJHAJCIUQI-UHFFFAOYSA-N	0	0	291.322	4.137	20	30		CIEDRN
C=CCCCC(=O)Nc1cc(F)c(OC(C)(C)C)c(F)c1	ZINC000541121497	333762847	/nfs/dbraw/zinc/76/28/47/333762847.db2.gz	KYYYKUVCZBCSNE-UHFFFAOYSA-N	0	0	297.345	4.437	20	30		CIEDRN
C=C[C@H](CC(=O)N1CC(C2CCCCC2)C1)c1ccccc1	ZINC000576137513	335159470	/nfs/dbraw/zinc/15/94/70/335159470.db2.gz	DIVAXQLKLDDJMM-MRXNPFEDSA-N	0	0	297.442	4.385	20	30		CIEDRN
N#CCc1ccc(CSc2c(F)cc(F)cc2F)cc1	ZINC000542225079	333817370	/nfs/dbraw/zinc/81/73/70/333817370.db2.gz	ZOVOXGWPEPDKFS-UHFFFAOYSA-N	0	0	293.313	4.462	20	30		CIEDRN
C[C@@H](NC(=O)[C@@H](C)CCC(C)(C)C)c1ccc(C#N)cc1	ZINC000542513021	333829717	/nfs/dbraw/zinc/82/97/17/333829717.db2.gz	CBYOUWYAOXUAPU-UONOGXRCSA-N	0	0	286.419	4.198	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N[C@H](C)c1cc(C)cc(C)c1	ZINC000542847751	333845067	/nfs/dbraw/zinc/84/50/67/333845067.db2.gz	SLTPRGWCCPTYCB-ZBFHGGJFSA-N	0	0	274.408	4.018	20	30		CIEDRN
CCSc1ccccc1OCCOc1cccc(C#N)c1	ZINC000542923953	333850026	/nfs/dbraw/zinc/85/00/26/333850026.db2.gz	NBTFXBBAGLWSKA-UHFFFAOYSA-N	0	0	299.395	4.128	20	30		CIEDRN
N#CCN(Cc1ncc(-c2ccccc2)s1)C1CCCC1	ZINC000130539354	333851042	/nfs/dbraw/zinc/85/10/42/333851042.db2.gz	PPGMJVVOJRRXDQ-UHFFFAOYSA-N	0	0	297.427	4.078	20	30		CIEDRN
C=CCC[C@H](C)Nc1cccc(OCCCC#N)c1	ZINC000130610439	333858487	/nfs/dbraw/zinc/85/84/87/333858487.db2.gz	IFLIXEOVDSVIFQ-AWEZNQCLSA-N	0	0	258.365	4.136	20	30		CIEDRN
CC(=O)c1ccc(C#N)cc1N1CCC[C@@H]1c1cccs1	ZINC000543450117	333875828	/nfs/dbraw/zinc/87/58/28/333875828.db2.gz	ZYANPLFBQWGMRQ-OAHLLOKOSA-N	0	0	296.395	4.164	20	30		CIEDRN
C=CCCC(=O)Nc1cccc(C(F)F)c1Cl	ZINC000543507379	333878642	/nfs/dbraw/zinc/87/86/42/333878642.db2.gz	UCHWBNWZLQVGCF-UHFFFAOYSA-N	0	0	259.683	4.182	20	30		CIEDRN
CCc1nocc1CS[C@H](C)c1ccc(C#N)cc1	ZINC000576172371	335165170	/nfs/dbraw/zinc/16/51/70/335165170.db2.gz	KTJMMIHIMOWMHE-LLVKDONJSA-N	0	0	272.373	4.103	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)C[C@@H](C)c1ccccc1	ZINC000071873657	333888544	/nfs/dbraw/zinc/88/85/44/333888544.db2.gz	RUVGNSGMKIBNMU-QGZVFWFLSA-N	0	0	293.410	4.395	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1ccc(F)cc1OC)c1ccccc1	ZINC000131111880	333903147	/nfs/dbraw/zinc/90/31/47/333903147.db2.gz	SSVWMPINNRVOBZ-ZDUSSCGKSA-N	0	0	299.345	4.133	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N[C@@H](C)c1c(C)cccc1C	ZINC000544435183	333931326	/nfs/dbraw/zinc/93/13/26/333931326.db2.gz	LCYCDIYENYHALI-GJZGRUSLSA-N	0	0	274.408	4.018	20	30		CIEDRN
Cc1ccccc1NCc1ccccc1C(C)(C)C#N	ZINC000131398616	333933840	/nfs/dbraw/zinc/93/38/40/333933840.db2.gz	YUPBPLVXQGGQIL-UHFFFAOYSA-N	0	0	264.372	4.408	20	30		CIEDRN
C[C@@H](Nc1cccc2ccncc21)c1ccc(C#N)cc1	ZINC000131416426	333934867	/nfs/dbraw/zinc/93/48/67/333934867.db2.gz	GKLNOBUQSVMRNP-CYBMUJFWSA-N	0	0	273.339	4.280	20	30		CIEDRN
CC#CCCNC(=O)c1cc(-c2ccccc2)ccc1Cl	ZINC000544582319	333938026	/nfs/dbraw/zinc/93/80/26/333938026.db2.gz	DEMCZVUYZFYCMP-UHFFFAOYSA-N	0	0	297.785	4.150	20	30		CIEDRN
CC(C)(C#N)c1ccccc1CNc1cc(F)cc(F)c1	ZINC000131441527	333939770	/nfs/dbraw/zinc/93/97/70/333939770.db2.gz	HDCSOLDZEZMGSZ-UHFFFAOYSA-N	0	0	286.325	4.378	20	30		CIEDRN
C=CCC(CC=C)c1nc(-c2ccccc2OCC)no1	ZINC000544992142	333957199	/nfs/dbraw/zinc/95/71/99/333957199.db2.gz	KACKCMQASMTVSP-UHFFFAOYSA-N	0	0	284.359	4.371	20	30		CIEDRN
C[C@H](Cc1noc(-c2ccc(C#N)s2)n1)c1ccccc1	ZINC000545052520	333960367	/nfs/dbraw/zinc/96/03/67/333960367.db2.gz	JRYMTGGDIGZCEI-LLVKDONJSA-N	0	0	295.367	4.016	20	30		CIEDRN
CC[C@H](CC#N)NC(=O)[C@H](CC1CCCCC1)C(C)C	ZINC000545156784	333965182	/nfs/dbraw/zinc/96/51/82/333965182.db2.gz	GLROYEYENDUEMB-HZPDHXFCSA-N	0	0	278.440	4.037	20	30		CIEDRN
Cc1noc(-c2ccc(Oc3ccc(C#N)cc3C)cc2)n1	ZINC000132366183	333978585	/nfs/dbraw/zinc/97/85/85/333978585.db2.gz	PZUUQJXMDOYPLM-UHFFFAOYSA-N	0	0	291.310	4.017	20	30		CIEDRN
CC(C)(C#N)CCCN1CCc2c1cccc2C(F)(F)F	ZINC000545396901	333980956	/nfs/dbraw/zinc/98/09/56/333980956.db2.gz	AQEPABZLJKGJSE-UHFFFAOYSA-N	0	0	296.336	4.398	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccccc1C(C)(C)C	ZINC000132802047	334005803	/nfs/dbraw/zinc/00/58/03/334005803.db2.gz	BJISIJHNCQPXLI-UHFFFAOYSA-N	0	0	274.408	4.414	20	30		CIEDRN
CC[C@@H](CC1CCCC1)C(=O)N(C)Cc1ccc(C#N)cc1	ZINC000074436207	334005834	/nfs/dbraw/zinc/00/58/34/334005834.db2.gz	CFRFDIAJMCWYMO-SFHVURJKSA-N	0	0	298.430	4.123	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](C)[C@@H]2CCCC[C@@H]21	ZINC000545923975	334006506	/nfs/dbraw/zinc/00/65/06/334006506.db2.gz	DBFDFQOFNXSQPA-VGWMRTNUSA-N	0	0	263.425	4.016	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](C)[C@H]2CCCC[C@@H]21	ZINC000545923973	334006536	/nfs/dbraw/zinc/00/65/36/334006536.db2.gz	DBFDFQOFNXSQPA-JONQDZQNSA-N	0	0	263.425	4.016	20	30		CIEDRN
Cc1cc(Cl)cc(C)c1CNc1cc(CC#N)ccn1	ZINC000545927148	334006944	/nfs/dbraw/zinc/00/69/44/334006944.db2.gz	QDPOJDBEZGLEHE-UHFFFAOYSA-N	0	0	285.778	4.030	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(Cc2ccccc2Cl)no1	ZINC000545933624	334007463	/nfs/dbraw/zinc/00/74/63/334007463.db2.gz	WYASKQCGOOXUQX-NSHDSACASA-N	0	0	276.767	4.384	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2ccccc2Cl)no1	ZINC000545933530	334007535	/nfs/dbraw/zinc/00/75/35/334007535.db2.gz	CGNMRHSPCNJSEB-JTQLQIEISA-N	0	0	262.740	4.460	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CC[C@H](C)C(C)(C)C1)c1ccccc1	ZINC000546139323	334016513	/nfs/dbraw/zinc/01/65/13/334016513.db2.gz	JJBVWNRVNPBXGO-HOTGVXAUSA-N	0	0	285.431	4.241	20	30		CIEDRN
C=CCCc1nc(-c2ccc(OC(C)(C)C)cc2)no1	ZINC000546277753	334024628	/nfs/dbraw/zinc/02/46/28/334024628.db2.gz	BRESCUPZHSUGIQ-UHFFFAOYSA-N	0	0	272.348	4.033	20	30		CIEDRN
C[C@H]1CCC[C@H](c2noc(-c3ccc(CC#N)cc3)n2)C1	ZINC000546349718	334028864	/nfs/dbraw/zinc/02/88/64/334028864.db2.gz	WZBBJDNYAMBICD-WFASDCNBSA-N	0	0	281.359	4.096	20	30		CIEDRN
C[C@@H]1CCCC[C@@H]1c1noc(CCc2ccc(C#N)cc2)n1	ZINC000546401013	334030867	/nfs/dbraw/zinc/03/08/67/334030867.db2.gz	QVLLYXKNJWLYBD-CJNGLKHVSA-N	0	0	295.386	4.020	20	30		CIEDRN
C=CCC(CC=C)c1nc([C@H](C)Oc2ccccc2)no1	ZINC000546430469	334032137	/nfs/dbraw/zinc/03/21/37/334032137.db2.gz	YCWPFPLRDVSHIJ-ZDUSSCGKSA-N	0	0	284.359	4.445	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2cccc(Cl)c2)no1	ZINC000546638587	334042806	/nfs/dbraw/zinc/04/28/06/334042806.db2.gz	CCFKRFSOKQNXTB-SNVBAGLBSA-N	0	0	262.740	4.460	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N[C@H](C)c1c(F)cccc1Cl	ZINC000546667735	334044943	/nfs/dbraw/zinc/04/49/43/334044943.db2.gz	UVFXCOPUWICOIV-GHMZBOCLSA-N	0	0	298.789	4.194	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1nc(C)oc1-c1ccccc1	ZINC000546756795	334050131	/nfs/dbraw/zinc/05/01/31/334050131.db2.gz	ZAIPDPSXESPUJM-ZDUSSCGKSA-N	0	0	298.386	4.125	20	30		CIEDRN
N#Cc1ccc(-c2ccc(OCC3CCOCC3)cc2)cc1	ZINC000546887032	334053904	/nfs/dbraw/zinc/05/39/04/334053904.db2.gz	QOOCCTHUNORTBQ-UHFFFAOYSA-N	0	0	293.366	4.031	20	30		CIEDRN
CC(C)(C#N)c1ccccc1COc1ccccc1	ZINC000133786243	334056886	/nfs/dbraw/zinc/05/68/86/334056886.db2.gz	SUWNWWQDWMKOHM-UHFFFAOYSA-N	0	0	251.329	4.067	20	30		CIEDRN
C=CCCc1nc(CSc2ccc(Cl)cc2)no1	ZINC000546942124	334057013	/nfs/dbraw/zinc/05/70/13/334057013.db2.gz	XJUJIGYYRKPEFU-UHFFFAOYSA-N	0	0	280.780	4.134	20	30		CIEDRN
COc1ccccc1OCc1ccccc1C(C)(C)C#N	ZINC000133789501	334057511	/nfs/dbraw/zinc/05/75/11/334057511.db2.gz	CEONAFFDJPXQDT-UHFFFAOYSA-N	0	0	281.355	4.075	20	30		CIEDRN
C=CCCc1nc(-c2cc(F)ccc2C(F)(F)F)no1	ZINC000546987087	334059653	/nfs/dbraw/zinc/05/96/53/334059653.db2.gz	NCTYWJPSOCZRCK-UHFFFAOYSA-N	0	0	286.228	4.013	20	30		CIEDRN
CCCCOc1ccccc1NCc1ccc(C#N)cc1	ZINC000236648346	334062488	/nfs/dbraw/zinc/06/24/88/334062488.db2.gz	KOVVLUYNEJVEHA-UHFFFAOYSA-N	0	0	280.371	4.349	20	30		CIEDRN
C[C@@H]1CCC[C@@H](c2noc(-c3cccc(CC#N)c3)n2)C1	ZINC000547052028	334064120	/nfs/dbraw/zinc/06/41/20/334064120.db2.gz	CTGFYWPZTILYKK-TZMCWYRMSA-N	0	0	281.359	4.096	20	30		CIEDRN
C[C@@H]1CCC[C@@H](c2noc(C3(C#N)CCCCC3)n2)C1	ZINC000547056551	334064284	/nfs/dbraw/zinc/06/42/84/334064284.db2.gz	JRLSQNMYMOBLHT-CHWSQXEVSA-N	0	0	273.380	4.089	20	30		CIEDRN
C=CCCO[C@H](C)c1nc([C@@H](C)c2ccc(C)cc2)no1	ZINC000547087441	334065943	/nfs/dbraw/zinc/06/59/43/334065943.db2.gz	BUQANBLRWLTACP-UONOGXRCSA-N	0	0	286.375	4.184	20	30		CIEDRN
C[C@@H]1CCCC[C@@H]1c1noc(-c2ccc(CC#N)cc2)n1	ZINC000547108082	334067038	/nfs/dbraw/zinc/06/70/38/334067038.db2.gz	WVVSYCARXZCKFJ-DOMZBBRYSA-N	0	0	281.359	4.096	20	30		CIEDRN
C=CCCCc1nc(-c2cc(Cl)ccc2C)no1	ZINC000547107295	334067080	/nfs/dbraw/zinc/06/70/80/334067080.db2.gz	VEAMLLLIWBSLNZ-UHFFFAOYSA-N	0	0	262.740	4.207	20	30		CIEDRN
C=C[C@H](Cc1nc(CCC(C)C)no1)c1ccccc1	ZINC000547121707	334067834	/nfs/dbraw/zinc/06/78/34/334067834.db2.gz	XKZHNKIOMRGKHA-CQSZACIVSA-N	0	0	270.376	4.171	20	30		CIEDRN
Cc1cc(C#N)ccc1-c1nc([C@@H](C)c2cccs2)no1	ZINC000547163950	334070241	/nfs/dbraw/zinc/07/02/41/334070241.db2.gz	GWVXGBDWPDPQIO-NSHDSACASA-N	0	0	295.367	4.130	20	30		CIEDRN
C=CCC[C@H](NC(=O)C[C@@H]1C=CCC1)c1ccccc1	ZINC000133942844	334073985	/nfs/dbraw/zinc/07/39/85/334073985.db2.gz	HDFYCDMOPINADQ-WBVHZDCISA-N	0	0	269.388	4.166	20	30		CIEDRN
Cc1ccccc1[C@H](C)c1noc(-c2ccc(C#N)cc2)n1	ZINC000547249381	334075075	/nfs/dbraw/zinc/07/50/75/334075075.db2.gz	NIWWVJQXBPLDKJ-ZDUSSCGKSA-N	0	0	289.338	4.069	20	30		CIEDRN
C=CCC[C@@H](NC(=O)CCc1ccoc1)c1ccccc1	ZINC000134010166	334077295	/nfs/dbraw/zinc/07/72/95/334077295.db2.gz	AKVAYHXNDFTVPH-QGZVFWFLSA-N	0	0	283.371	4.036	20	30		CIEDRN
C=CCNC(=O)Nc1ccc(N[C@H](C)c2ccccc2)cc1	ZINC000076316529	334078980	/nfs/dbraw/zinc/07/89/80/334078980.db2.gz	OXCVFZPTSZBOQX-CQSZACIVSA-N	0	0	295.386	4.167	20	30		CIEDRN
N#CCc1ccnc(NCc2cccc(-c3ccccc3)c2)c1	ZINC000547340792	334081327	/nfs/dbraw/zinc/08/13/27/334081327.db2.gz	FGMACULLSFKROK-UHFFFAOYSA-N	0	0	299.377	4.427	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2nccc3ccccc32)no1	ZINC000547346388	334082003	/nfs/dbraw/zinc/08/20/03/334082003.db2.gz	LPOWTUVXNFBGHV-LBPRGKRZSA-N	0	0	279.343	4.355	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2ccc(F)c(C)c2)no1	ZINC000547346337	334082014	/nfs/dbraw/zinc/08/20/14/334082014.db2.gz	BIGBTPATFLFFQW-NSHDSACASA-N	0	0	260.312	4.254	20	30		CIEDRN
C[C@@H](CCc1ccco1)Nc1cccc(OCCCC#N)c1	ZINC000237361876	334087530	/nfs/dbraw/zinc/08/75/30/334087530.db2.gz	PEPHASIHNZKFFA-HNNXBMFYSA-N	0	0	298.386	4.395	20	30		CIEDRN
C=CCCCN(C)C(=O)N[C@@H](C)c1ccc(Cl)cc1	ZINC000076939890	334091766	/nfs/dbraw/zinc/09/17/66/334091766.db2.gz	GXNOGHXECBAEPI-LBPRGKRZSA-N	0	0	280.799	4.009	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)N2CCCC2(C)C)c1	ZINC000077497353	334106817	/nfs/dbraw/zinc/10/68/17/334106817.db2.gz	RWOREBQDHSQZRQ-UHFFFAOYSA-N	0	0	288.391	4.048	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1ccsc1)c1ccccc1	ZINC000135056651	334113785	/nfs/dbraw/zinc/11/37/85/334113785.db2.gz	VZLSSRQIJIPXHW-LBPRGKRZSA-N	0	0	257.358	4.047	20	30		CIEDRN
Cc1ccnc(N[C@H](C)c2cccc(Cl)c2)c1C#N	ZINC000135068674	334114404	/nfs/dbraw/zinc/11/44/04/334114404.db2.gz	YVPFCCWZTLTIOU-LLVKDONJSA-N	0	0	271.751	4.088	20	30		CIEDRN
CC(C)c1cccc(N(C)C(=O)c2ccc(F)c(C#N)c2)c1	ZINC000547757798	334115068	/nfs/dbraw/zinc/11/50/68/334115068.db2.gz	YWEFIUDOSYKWNV-UHFFFAOYSA-N	0	0	296.345	4.097	20	30		CIEDRN
N#Cc1ccc(COc2ccc(OC(F)(F)F)cc2)cc1	ZINC000135121401	334116451	/nfs/dbraw/zinc/11/64/51/334116451.db2.gz	FYBCTGPZPWANGS-UHFFFAOYSA-N	0	0	293.244	4.036	20	30		CIEDRN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)CCC(C)(C)C	ZINC000078059368	334123002	/nfs/dbraw/zinc/12/30/02/334123002.db2.gz	JKQXSQMZQVLYTG-UHFFFAOYSA-N	0	0	286.419	4.122	20	30		CIEDRN
N#CCN(C(=O)CC/C=C/c1ccccc1)c1ccccc1	ZINC000078091331	334123871	/nfs/dbraw/zinc/12/38/71/334123871.db2.gz	CSGFARIAPLTGAZ-YRNVUSSQSA-N	0	0	290.366	4.037	20	30		CIEDRN
CC[C@@H]1CCCC[C@H]1N(C)C(=O)Nc1ccc(CC#N)cc1	ZINC000135360663	334127680	/nfs/dbraw/zinc/12/76/80/334127680.db2.gz	UFKFGOKNBKQQJC-NVXWUHKLSA-N	0	0	299.418	4.185	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(N2CCCC2)cc1C	ZINC000135465274	334130853	/nfs/dbraw/zinc/13/08/53/334130853.db2.gz	IMLQNWFKKHCWJC-SFHVURJKSA-N	0	0	286.419	4.136	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N1CCCC[C@H]1CC(C)C	ZINC000135584956	334133886	/nfs/dbraw/zinc/13/38/86/334133886.db2.gz	VNSUKCVQLCPMKB-INIZCTEOSA-N	0	0	299.418	4.299	20	30		CIEDRN
CC(=O)c1ccccc1OCc1ccccc1C(C)(C)C#N	ZINC000135655670	334135279	/nfs/dbraw/zinc/13/52/79/334135279.db2.gz	DWMVLEPJYDLAAT-UHFFFAOYSA-N	0	0	293.366	4.269	20	30		CIEDRN
N#Cc1ccc(CN[C@H](c2ccco2)c2ccccc2)s1	ZINC000135673163	334135916	/nfs/dbraw/zinc/13/59/16/334135916.db2.gz	FZXAKXUSCXFFNK-KRWDZBQOSA-N	0	0	294.379	4.092	20	30		CIEDRN
COc1cc(Cl)c(C)cc1NCc1ccc(C#N)s1	ZINC000135692306	334136437	/nfs/dbraw/zinc/13/64/37/334136437.db2.gz	UMXRXMLEFLTVFF-UHFFFAOYSA-N	0	0	292.791	4.202	20	30		CIEDRN
N#CCCCC[S@@](=O)C(c1ccccc1)c1ccccc1	ZINC000078700292	334139058	/nfs/dbraw/zinc/13/90/58/334139058.db2.gz	BLXPWQCTAVRLRN-NRFANRHFSA-N	0	0	297.423	4.219	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)c1cc(C)c(C)o1	ZINC000548091419	334139461	/nfs/dbraw/zinc/13/94/61/334139461.db2.gz	USFLFOGGWVCLBG-UHFFFAOYSA-N	0	0	283.371	4.115	20	30		CIEDRN
CC[C@H]1CCCC[C@@H]1Nc1nc(C(F)(F)F)ccc1C#N	ZINC000078833795	334141214	/nfs/dbraw/zinc/14/12/14/334141214.db2.gz	KHEBKAUQNKCULJ-JQWIXIFHSA-N	0	0	297.324	4.353	20	30		CIEDRN
C[C@@H]1CCC[C@H](Nc2nc(C(F)(F)F)ccc2C#N)[C@@H]1C	ZINC000078832551	334141257	/nfs/dbraw/zinc/14/12/57/334141257.db2.gz	UXJNRGKTTWXWPX-FOGDFJRCSA-N	0	0	297.324	4.209	20	30		CIEDRN
C[C@@H]1CCCC[C@H]1CNc1nc(C(F)(F)F)ccc1C#N	ZINC000078834852	334141285	/nfs/dbraw/zinc/14/12/85/334141285.db2.gz	JJUMYWJUQMKPMS-PWSUYJOCSA-N	0	0	297.324	4.210	20	30		CIEDRN
Cc1cc(Cl)ccc1NCc1ccc(C#N)s1	ZINC000135933633	334141381	/nfs/dbraw/zinc/14/13/81/334141381.db2.gz	RMGXFJJMOIZJLL-UHFFFAOYSA-N	0	0	262.765	4.194	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1ccc(-c2ccccc2F)o1	ZINC000078939066	334143477	/nfs/dbraw/zinc/14/34/77/334143477.db2.gz	YWBBOKWSCYJKNV-UHFFFAOYSA-N	0	0	287.334	4.124	20	30		CIEDRN
CCCCCOc1ccc(Oc2ccncc2C#N)cc1	ZINC000548156917	334143634	/nfs/dbraw/zinc/14/36/34/334143634.db2.gz	MWQLKHJLRBGJDM-UHFFFAOYSA-N	0	0	282.343	4.315	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N[C@@H](C(C)(C)C)C(F)(F)F	ZINC000548183802	334145662	/nfs/dbraw/zinc/14/56/62/334145662.db2.gz	OWDSYMMNHIJKFI-MNOVXSKESA-N	0	0	294.361	4.007	20	30		CIEDRN
C=CCSc1ccccc1C(=O)Nc1ccc(C#N)cc1	ZINC000548259188	334147520	/nfs/dbraw/zinc/14/75/20/334147520.db2.gz	XGSFVBRORDKCNX-UHFFFAOYSA-N	0	0	294.379	4.089	20	30		CIEDRN
Cc1ccc(NC(=O)c2ccc(C#N)c(Cl)c2)cc1C	ZINC000548278651	334148220	/nfs/dbraw/zinc/14/82/20/334148220.db2.gz	SLKDHQYCVCFQEM-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
COc1cccc(S[C@@H](C#N)Cc2ccc(C)cc2)c1	ZINC000079134289	334148742	/nfs/dbraw/zinc/14/87/42/334148742.db2.gz	INNUSJFMNKEBSY-QGZVFWFLSA-N	0	0	283.396	4.231	20	30		CIEDRN
CCC[C@@H]1CCCCN1C(=O)c1ccc(C#N)c(Cl)c1	ZINC000548288213	334148799	/nfs/dbraw/zinc/14/87/99/334148799.db2.gz	HEAUGXQJAHEKNW-CQSZACIVSA-N	0	0	290.794	4.006	20	30		CIEDRN
C=CCCCCCNC(=O)N[C@H](CCC#N)c1ccccc1	ZINC000564348377	334152016	/nfs/dbraw/zinc/15/20/16/334152016.db2.gz	JVHZXSQDUNEWBK-QGZVFWFLSA-N	0	0	299.418	4.077	20	30		CIEDRN
C=CCOc1ccc(CNc2cccc3cc[nH]c32)cc1	ZINC000548474245	334159018	/nfs/dbraw/zinc/15/90/18/334159018.db2.gz	IQVNXWXDDLPSQO-UHFFFAOYSA-N	0	0	278.355	4.345	20	30		CIEDRN
Cc1cn(Cc2ccc(OC(C)C)c(Cl)c2)cc1C#N	ZINC000548611732	334163789	/nfs/dbraw/zinc/16/37/89/334163789.db2.gz	VCEKBOQTARHWDT-UHFFFAOYSA-N	0	0	288.778	4.157	20	30		CIEDRN
CC1CC(C#N)(C(=O)N[C@H]2CCC[C@H](C(C)(C)C)CC2)C1	ZINC000548708588	334166755	/nfs/dbraw/zinc/16/67/55/334166755.db2.gz	SLAKXPVOVLHRIM-DIODGJHASA-N	0	0	290.451	4.037	20	30		CIEDRN
Cc1ccc(C)c(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)c1	ZINC000080456272	334171619	/nfs/dbraw/zinc/17/16/19/334171619.db2.gz	ZONNLNCUCWIVSJ-CQSZACIVSA-N	0	0	298.411	4.373	20	30		CIEDRN
Cc1ccc(C)c(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)c1	ZINC000080456275	334171644	/nfs/dbraw/zinc/17/16/44/334171644.db2.gz	ZONNLNCUCWIVSJ-AWEZNQCLSA-N	0	0	298.411	4.373	20	30		CIEDRN
Cc1cccc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)c1C	ZINC000080451235	334171656	/nfs/dbraw/zinc/17/16/56/334171656.db2.gz	MMRDXNJLBNPQRH-CQSZACIVSA-N	0	0	298.411	4.373	20	30		CIEDRN
Cc1cccc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)c1C	ZINC000080451242	334171754	/nfs/dbraw/zinc/17/17/54/334171754.db2.gz	MMRDXNJLBNPQRH-AWEZNQCLSA-N	0	0	298.411	4.373	20	30		CIEDRN
Fc1ccc(NCCC(F)(F)F)cc1C(F)(F)F	ZINC000080937012	334175457	/nfs/dbraw/zinc/17/54/57/334175457.db2.gz	WTZHDNFYYBYKGR-UHFFFAOYSA-N	0	0	275.167	4.209	20	30		CIEDRN
CCCCCN(C(=O)Nc1ccc(F)cc1C#N)C(C)C	ZINC000548926242	334180468	/nfs/dbraw/zinc/18/04/68/334180468.db2.gz	PDEUKWUKDCYXOI-UHFFFAOYSA-N	0	0	291.370	4.130	20	30		CIEDRN
C[C@@H]1CC(CCNc2ccc(C#N)c(Cl)c2)C[C@@H](C)O1	ZINC000548987941	334181964	/nfs/dbraw/zinc/18/19/64/334181964.db2.gz	VZLOYJBEPQMBNK-VXGBXAGGSA-N	0	0	292.810	4.217	20	30		CIEDRN
CCc1nc(C(C)C)ccc1COc1cccc(C#N)c1	ZINC000549012416	334182506	/nfs/dbraw/zinc/18/25/06/334182506.db2.gz	OMSYVAIPXVQITM-UHFFFAOYSA-N	0	0	280.371	4.218	20	30		CIEDRN
N#Cc1ccc(C(=O)N2CCCC3(C2)CCCCCC3)cc1	ZINC000081304413	334184255	/nfs/dbraw/zinc/18/42/55/334184255.db2.gz	DJDBTPHSWSJBLL-UHFFFAOYSA-N	0	0	296.414	4.135	20	30		CIEDRN
C=CCOCCOc1c(Cl)cc(Cl)c2cccnc21	ZINC000549063420	334184386	/nfs/dbraw/zinc/18/43/86/334184386.db2.gz	DMVZUJKQKUQNTP-UHFFFAOYSA-N	0	0	298.169	4.123	20	30		CIEDRN
C=CC[C@H](C(=O)NCC(C)(C)C(F)(F)F)c1ccccc1	ZINC000549065881	334184411	/nfs/dbraw/zinc/18/44/11/334184411.db2.gz	QHMYKEBFORHYQR-ZDUSSCGKSA-N	0	0	299.336	4.051	20	30		CIEDRN
N#Cc1cc(NCc2cnoc2-c2ccco2)ccc1Cl	ZINC000549111212	334185532	/nfs/dbraw/zinc/18/55/32/334185532.db2.gz	USTXVXMUFMDZQS-UHFFFAOYSA-N	0	0	299.717	4.072	20	30		CIEDRN
C=CCOCCS[C@H](C)c1ccc(Cl)cc1	ZINC000549350472	334191057	/nfs/dbraw/zinc/19/10/57/334191057.db2.gz	XVEDXIAMHJTJAV-LLVKDONJSA-N	0	0	256.798	4.337	20	30		CIEDRN
N#Cc1ccc(NC(=O)c2cc(F)c3ccccc3c2)cc1	ZINC000549461394	334194433	/nfs/dbraw/zinc/19/44/33/334194433.db2.gz	UQPGQMQZIWTRFN-UHFFFAOYSA-N	0	0	290.297	4.103	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)CC(C)(C)C1CC1	ZINC000549537830	334196788	/nfs/dbraw/zinc/19/67/88/334196788.db2.gz	LLHQTSOOVRHLAU-UHFFFAOYSA-N	0	0	289.394	4.167	20	30		CIEDRN
C=CCN(Cc1cccs1)Cc1nc(C)c(C)s1	ZINC000081645824	334201538	/nfs/dbraw/zinc/20/15/38/334201538.db2.gz	YDSKBLBYAGYIEB-UHFFFAOYSA-N	0	0	278.446	4.010	20	30		CIEDRN
CC(C)c1cc(Oc2ccc(C#N)c3ccccc23)ncn1	ZINC000549697956	334202066	/nfs/dbraw/zinc/20/20/66/334202066.db2.gz	ZLAJYYNJOFQTFM-UHFFFAOYSA-N	0	0	289.338	4.417	20	30		CIEDRN
CC[C@H](C)[C@@H](C)C(=O)N(CC)[C@H](C)c1ccc(C#N)cc1	ZINC000245728309	334215774	/nfs/dbraw/zinc/21/57/74/334215774.db2.gz	PVNSCWXANZGJSV-RRFJBIMHSA-N	0	0	286.419	4.150	20	30		CIEDRN
C[C@@H]1CCCC[C@@H]1CC(=O)N[C@@](C)(C#N)C1CCCCC1	ZINC000550350078	334220707	/nfs/dbraw/zinc/22/07/07/334220707.db2.gz	KIMNFCQOXJBYJV-RKVPGOIHSA-N	0	0	290.451	4.182	20	30		CIEDRN
C[C@@H]1CCCC[C@H]1CC(=O)N[C@](C)(C#N)C1CCCCC1	ZINC000550350079	334220738	/nfs/dbraw/zinc/22/07/38/334220738.db2.gz	KIMNFCQOXJBYJV-RVKKMQEKSA-N	0	0	290.451	4.182	20	30		CIEDRN
C=C[C@H](CC(=O)N1CCc2ccc(F)cc21)c1ccccc1	ZINC000550534298	334224023	/nfs/dbraw/zinc/22/40/23/334224023.db2.gz	XGEJVGWTQSUVKW-CQSZACIVSA-N	0	0	295.357	4.075	20	30		CIEDRN
C=C(C)CCc1noc(-c2cc(F)ccc2Cl)n1	ZINC000551078181	334238071	/nfs/dbraw/zinc/23/80/71/334238071.db2.gz	CJONTOJHZVWFKJ-UHFFFAOYSA-N	0	0	266.703	4.038	20	30		CIEDRN
N#Cc1ccc(SCCCCCF)c(Cl)c1	ZINC000551085574	334238107	/nfs/dbraw/zinc/23/81/07/334238107.db2.gz	WRWPACDIOLFBOH-UHFFFAOYSA-N	0	0	257.761	4.444	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H]2CCC(=O)[C@@H](C)C2(C)C)n1	ZINC000551110485	334238771	/nfs/dbraw/zinc/23/87/71/334238771.db2.gz	WKGRSOSQPSUYOD-VXGBXAGGSA-N	0	0	290.407	4.032	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H]2CCC(=O)[C@@H](C)C2(C)C)n1	ZINC000551110480	334238795	/nfs/dbraw/zinc/23/87/95/334238795.db2.gz	WKGRSOSQPSUYOD-NEPJUHHUSA-N	0	0	290.407	4.032	20	30		CIEDRN
C=CCC(C)(C)c1noc(CSc2ccc(F)cc2)n1	ZINC000551112053	334238949	/nfs/dbraw/zinc/23/89/49/334238949.db2.gz	QAFSZNNXEQUKTM-UHFFFAOYSA-N	0	0	292.379	4.355	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cncc3ccccc32)n1	ZINC000551145839	334239381	/nfs/dbraw/zinc/23/93/81/334239381.db2.gz	XXXZYHXJYZRKMS-UHFFFAOYSA-N	0	0	279.343	4.139	20	30		CIEDRN
C=CCC(C)(C)c1noc(C/C=C/c2ccccc2F)n1	ZINC000551141408	334239408	/nfs/dbraw/zinc/23/94/08/334239408.db2.gz	ZXCHRKGQRCOOMM-VQHVLOKHSA-N	0	0	286.350	4.318	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ccc(SCC)nc2)n1	ZINC000551142325	334239410	/nfs/dbraw/zinc/23/94/10/334239410.db2.gz	AGPTWFDVGRVNPB-UHFFFAOYSA-N	0	0	289.404	4.097	20	30		CIEDRN
C=CCC(C)(C)c1noc(Cc2c[nH]c3cccc(C)c23)n1	ZINC000551143365	334239493	/nfs/dbraw/zinc/23/94/93/334239493.db2.gz	KDMHTKMOQMSBLZ-UHFFFAOYSA-N	0	0	295.386	4.304	20	30		CIEDRN
CCC(CC)[C@@H](C)C(=O)N[C@](C)(C#N)C1CCCCC1	ZINC000551305109	334245908	/nfs/dbraw/zinc/24/59/08/334245908.db2.gz	AYLBZJKYXSHLND-CXAGYDPISA-N	0	0	278.440	4.037	20	30		CIEDRN
C=CCC(F)(F)c1nc(-c2cc(C)cc(C)c2)no1	ZINC000551370100	334248085	/nfs/dbraw/zinc/24/80/85/334248085.db2.gz	DVFJKXJFZGLADZ-UHFFFAOYSA-N	0	0	264.275	4.021	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1cc(Cl)cc(OC)c1	ZINC000551365541	334248147	/nfs/dbraw/zinc/24/81/47/334248147.db2.gz	PGTHRKJUBGJPNP-UHFFFAOYSA-N	0	0	295.810	4.167	20	30		CIEDRN
CSc1ccccc1C[NH2+]C1(c2cccc(C#N)c2)CC1	ZINC000551412517	334249815	/nfs/dbraw/zinc/24/98/15/334249815.db2.gz	YCUHGXABUKNDGZ-UHFFFAOYSA-N	0	0	294.423	4.059	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cnc(C(C)(C)C)s2)n1	ZINC000551491568	334251580	/nfs/dbraw/zinc/25/15/80/334251580.db2.gz	AGWGJARARORCIE-UHFFFAOYSA-N	0	0	291.420	4.344	20	30		CIEDRN
C=CCC(C)(C)c1noc(C(C)(C)c2cccc(F)c2)n1	ZINC000551489909	334251593	/nfs/dbraw/zinc/25/15/93/334251593.db2.gz	HZQWHNZDISCOJH-UHFFFAOYSA-N	0	0	288.366	4.388	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H]2C[C@H]2c2cccc(OC)c2)n1	ZINC000551493512	334251597	/nfs/dbraw/zinc/25/15/97/334251597.db2.gz	YWGXJSSFUHEVGG-GJZGRUSLSA-N	0	0	298.386	4.203	20	30		CIEDRN
C=CCC(C)(C)c1noc(/C=C(/C)c2ccc(OC)cc2)n1	ZINC000551493947	334251658	/nfs/dbraw/zinc/25/16/58/334251658.db2.gz	OWZAFYJFVWUKEK-SEYXRHQNSA-N	0	0	298.386	4.492	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cccc([C@H]3CCOC3)c2)n1	ZINC000551494526	334251697	/nfs/dbraw/zinc/25/16/97/334251697.db2.gz	XMDRPMBGXXZOST-HNNXBMFYSA-N	0	0	298.386	4.094	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cccc([C@@H]3CCOC3)c2)n1	ZINC000551494527	334251698	/nfs/dbraw/zinc/25/16/98/334251698.db2.gz	XMDRPMBGXXZOST-OAHLLOKOSA-N	0	0	298.386	4.094	20	30		CIEDRN
C=CCC(C)(C)c1noc(/C=C\c2ccc(OC)cc2)n1	ZINC000551497864	334251714	/nfs/dbraw/zinc/25/17/14/334251714.db2.gz	HKOAPOIQFFNFLH-FLIBITNWSA-N	0	0	284.359	4.102	20	30		CIEDRN
C=C(C)[C@H](Cc1nc([C@@H]2CCCC[C@@H]2CC)no1)OCC	ZINC000551533591	334253119	/nfs/dbraw/zinc/25/31/19/334253119.db2.gz	BPTXHBUHTBBTBX-ZNMIVQPWSA-N	0	0	292.423	4.277	20	30		CIEDRN
C=C(C)[C@H]1OCC[C@H]1c1nc([C@H]2CCCC[C@@H]2CC)no1	ZINC000551534535	334253417	/nfs/dbraw/zinc/25/34/17/334253417.db2.gz	NNYHONKRTBBCQM-BYNSBNAKSA-N	0	0	290.407	4.202	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCCCCC1CCCC1	ZINC000551547169	334253722	/nfs/dbraw/zinc/25/37/22/334253722.db2.gz	KHAAKKBVCIHQLW-UHFFFAOYSA-N	0	0	251.414	4.065	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N1CCC=C(c2ccccc2)C1	ZINC000551639322	334256542	/nfs/dbraw/zinc/25/65/42/334256542.db2.gz	AUMPFVOZTCFEAB-INIZCTEOSA-N	0	0	298.430	4.230	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N1CCC=C(c2ccccc2)C1	ZINC000551639323	334256593	/nfs/dbraw/zinc/25/65/93/334256593.db2.gz	AUMPFVOZTCFEAB-MRXNPFEDSA-N	0	0	298.430	4.230	20	30		CIEDRN
N#Cc1ccc(CN2CC3(CCC3)[C@@H]2c2ccccc2)s1	ZINC000552085846	334287247	/nfs/dbraw/zinc/28/72/47/334287247.db2.gz	OCTZBSRJWWLRJH-KRWDZBQOSA-N	0	0	294.423	4.347	20	30		CIEDRN
N#CCCNc1ccc(Cc2nc3ccccc3s2)cc1	ZINC000552163035	334297800	/nfs/dbraw/zinc/29/78/00/334297800.db2.gz	SPDYCBUYZCUSAS-UHFFFAOYSA-N	0	0	293.395	4.213	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CC[C@@H](C(C)(C)C)C[C@@H]1C	ZINC000552195955	334301446	/nfs/dbraw/zinc/30/14/46/334301446.db2.gz	IRUNBCWGIBPBTR-UONOGXRCSA-N	0	0	265.441	4.262	20	30		CIEDRN
CCC(CC)[C@H](C)C(=O)Nc1cc(C#N)ccc1NC1CC1	ZINC000552245074	334307677	/nfs/dbraw/zinc/30/76/77/334307677.db2.gz	NIXQBYUDLAXYKD-LBPRGKRZSA-N	0	0	299.418	4.143	20	30		CIEDRN
CC(C)CC(C)(C)CNC(=O)c1cc(C#N)ccc1Cl	ZINC000552342754	334319033	/nfs/dbraw/zinc/31/90/33/334319033.db2.gz	SJIBPHZBYXSERA-UHFFFAOYSA-N	0	0	292.810	4.014	20	30		CIEDRN
CC(C)(C)C[C@H](N[C@H]1CCC[C@@H](C#N)C1)C(F)(F)F	ZINC000248890023	334320931	/nfs/dbraw/zinc/32/09/31/334320931.db2.gz	SOMBRTNGWMAXAV-WOPDTQHZSA-N	0	0	276.346	4.025	20	30		CIEDRN
CCCCCN(CCC#N)Cc1ccc(Cl)cc1	ZINC000552466364	334329443	/nfs/dbraw/zinc/32/94/43/334329443.db2.gz	FWAXCDQCCBQXPS-UHFFFAOYSA-N	0	0	264.800	4.246	20	30		CIEDRN
Cc1c(COC(C)(C)C)cccc1NCc1ccc(C#N)o1	ZINC000552529677	334333925	/nfs/dbraw/zinc/33/39/25/334333925.db2.gz	ZBYQQWBMZDNTJL-UHFFFAOYSA-N	0	0	298.386	4.387	20	30		CIEDRN
CC(C)C[C@@H](C)CC(=O)Nc1cc(C#N)ccc1NC1CC1	ZINC000552586516	334337981	/nfs/dbraw/zinc/33/79/81/334337981.db2.gz	JZCGBBOFJKZCFB-CYBMUJFWSA-N	0	0	299.418	4.143	20	30		CIEDRN
CC(C)(C)CCCC(=O)Nc1cc(C#N)ccc1NC1CC1	ZINC000552587295	334338018	/nfs/dbraw/zinc/33/80/18/334338018.db2.gz	BCNPKZRMIQSWEH-UHFFFAOYSA-N	0	0	299.418	4.287	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cccc(-c2ncco2)c1C	ZINC000552710305	334343052	/nfs/dbraw/zinc/34/30/52/334343052.db2.gz	OGDJPRJZHNJXEC-UHFFFAOYSA-N	0	0	284.359	4.191	20	30		CIEDRN
C=CCCC(=O)N1CCC[C@@H]1c1ccc(C(C)C)cc1	ZINC000089355813	334344336	/nfs/dbraw/zinc/34/43/36/334344336.db2.gz	LENWUSHONXDNRW-QGZVFWFLSA-N	0	0	271.404	4.440	20	30		CIEDRN
C=C[C@@H](CC(=O)NC(C#N)(CCC)CCC)c1ccccc1	ZINC000090000829	334355297	/nfs/dbraw/zinc/35/52/97/334355297.db2.gz	GFQAOHDGAWSLBD-INIZCTEOSA-N	0	0	298.430	4.325	20	30		CIEDRN
Cc1ccc(C#N)c(Nc2cccc(CC(F)(F)F)c2)n1	ZINC000553067629	334359739	/nfs/dbraw/zinc/35/97/39/334359739.db2.gz	CNNOXYSDSHEKSB-UHFFFAOYSA-N	0	0	291.276	4.110	20	30		CIEDRN
CC(C)c1ccc([C@@H]2CCCN2c2ccnc(C#N)c2)cc1	ZINC000553146319	334364760	/nfs/dbraw/zinc/36/47/60/334364760.db2.gz	JLNGIKUFDFZQGC-IBGZPJMESA-N	0	0	291.398	4.418	20	30		CIEDRN
CC(C)C[C@@](C)(C#N)NC(=O)CCCCC(C)(C)C	ZINC000553237178	334370923	/nfs/dbraw/zinc/37/09/23/334370923.db2.gz	OHKGMMGTNDBWJP-INIZCTEOSA-N	0	0	266.429	4.037	20	30		CIEDRN
Cc1cc(N2CCC[C@@H]2c2ccc(C)c(C)c2)cc(C#N)n1	ZINC000553330795	334378044	/nfs/dbraw/zinc/37/80/44/334378044.db2.gz	KLPIVBDFXHSATE-LJQANCHMSA-N	0	0	291.398	4.220	20	30		CIEDRN
CC(C)C[C@H]1CCCCN1c1nccc(C#N)c1Cl	ZINC000553448300	334385873	/nfs/dbraw/zinc/38/58/73/334385873.db2.gz	VLUARWWGGNTJBN-CYBMUJFWSA-N	0	0	277.799	4.012	20	30		CIEDRN
Cc1cccnc1S[C@@H](C)c1ccc(C#N)cc1	ZINC000553498856	334388865	/nfs/dbraw/zinc/38/88/65/334388865.db2.gz	WBJUUAPWBWAULN-LBPRGKRZSA-N	0	0	254.358	4.115	20	30		CIEDRN
CC(C)N(CCC#N)C(=O)c1ccc(C2CCCC2)cc1	ZINC000572538049	334394233	/nfs/dbraw/zinc/39/42/33/334394233.db2.gz	JAQBYAWNHLHZAN-UHFFFAOYSA-N	0	0	284.403	4.108	20	30		CIEDRN
C=CCCCCNC(=O)N1C[C@@H](C)C[C@H]1c1ccccc1	ZINC000553720142	334396730	/nfs/dbraw/zinc/39/67/30/334396730.db2.gz	QPKLPVNZZNSFHG-RDJZCZTQSA-N	0	0	286.419	4.135	20	30		CIEDRN
CCCCN(C(=O)c1ccc(C#N)cc1)C1CCCCC1	ZINC000553730607	334397345	/nfs/dbraw/zinc/39/73/45/334397345.db2.gz	WZWQSEKLHAZRDF-UHFFFAOYSA-N	0	0	284.403	4.133	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1C[C@@H](C)C[C@H]1c1ccccc1	ZINC000553792452	334398951	/nfs/dbraw/zinc/39/89/51/334398951.db2.gz	MSQWUJPVFISCFK-XIRDDKMYSA-N	0	0	286.419	4.134	20	30		CIEDRN
C/C=C/c1ccc(NC(=O)c2ccc(C#N)c(Cl)c2)cc1	ZINC000554014870	334406167	/nfs/dbraw/zinc/40/61/67/334406167.db2.gz	JICWSZHQDCZIEX-NSCUHMNNSA-N	0	0	296.757	4.497	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CC[C@H](c2ccc(CC)cc2)C1	ZINC000554155046	334414592	/nfs/dbraw/zinc/41/45/92/334414592.db2.gz	FXISDXXHWZMVBE-PKOBYXMFSA-N	0	0	285.431	4.167	20	30		CIEDRN
C=C1CCN(Cc2cc(F)c(C(F)(F)F)cc2F)CC1	ZINC000554237833	334417924	/nfs/dbraw/zinc/41/79/24/334417924.db2.gz	QGBBCKQFYFZGRL-UHFFFAOYSA-N	0	0	291.263	4.136	20	30		CIEDRN
CCOCc1cccc(N[C@@H]2CCc3ccc(C#N)cc32)c1	ZINC000554998832	334464206	/nfs/dbraw/zinc/46/42/06/334464206.db2.gz	WLUIGKLCQKTZCO-LJQANCHMSA-N	0	0	292.382	4.194	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc(N2CCCC2)cc1C	ZINC000555844430	334490189	/nfs/dbraw/zinc/49/01/89/334490189.db2.gz	LDXLDYDBDBEGCC-UHFFFAOYSA-N	0	0	286.419	4.136	20	30		CIEDRN
CC(C)(C#N)CCSCCc1cccc(F)c1F	ZINC000564606126	334513508	/nfs/dbraw/zinc/51/35/08/334513508.db2.gz	PZJDZQSGMORZHS-UHFFFAOYSA-N	0	0	269.360	4.180	20	30		CIEDRN
C=CCCCCS[C@@H](C)c1ccc(S(C)(=O)=O)cc1	ZINC000565588895	334576691	/nfs/dbraw/zinc/57/66/91/334576691.db2.gz	XQMLEWBNCYFRFG-ZDUSSCGKSA-N	0	0	298.473	4.241	20	30		CIEDRN
C=CCC1(c2nc([C@H](C)Oc3ccccc3)no2)CCC1	ZINC000565682143	334587233	/nfs/dbraw/zinc/58/72/33/334587233.db2.gz	FXBVUFHYELAJAT-ZDUSSCGKSA-N	0	0	284.359	4.207	20	30		CIEDRN
N#Cc1ccc(NCCc2ccc(F)cc2F)cc1Cl	ZINC000565851818	334603245	/nfs/dbraw/zinc/60/32/45/334603245.db2.gz	FYXIKRPBCPWZAX-UHFFFAOYSA-N	0	0	292.716	4.144	20	30		CIEDRN
C=CCC1(c2nc(-c3sccc3C)no2)CCC1	ZINC000565980719	334613650	/nfs/dbraw/zinc/61/36/50/334613650.db2.gz	LGJARCUAWATQTF-UHFFFAOYSA-N	0	0	260.362	4.104	20	30		CIEDRN
C=CCCCCCNC(=O)Nc1ccsc1Cl	ZINC000566429645	334648465	/nfs/dbraw/zinc/64/84/65/334648465.db2.gz	YFYAZJXUJMXPIK-UHFFFAOYSA-N	0	0	272.801	4.269	20	30		CIEDRN
N#Cc1c(NCCC[C@H]2CCCCO2)cccc1C(F)F	ZINC000566485804	334652051	/nfs/dbraw/zinc/65/20/51/334652051.db2.gz	VFGBZCNLRSVWDY-GFCCVEGCSA-N	0	0	294.345	4.257	20	30		CIEDRN
C=CC[C@H](C(=O)NCCC(C)(C)C1CC1)c1ccccc1	ZINC000566817186	334665561	/nfs/dbraw/zinc/66/55/61/334665561.db2.gz	JTEPCGDSRFEAQM-KRWDZBQOSA-N	0	0	285.431	4.289	20	30		CIEDRN
Cc1cc(N2CCC(CCC#N)CC2)c2cccc(F)c2n1	ZINC000567107293	334681657	/nfs/dbraw/zinc/68/16/57/334681657.db2.gz	WJYDSQYIDGHMKD-UHFFFAOYSA-N	0	0	297.377	4.203	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1ccc(OC)c(F)c1)c1ccccc1	ZINC000154828841	334705317	/nfs/dbraw/zinc/70/53/17/334705317.db2.gz	RPFITJGTIRUWPA-ZDUSSCGKSA-N	0	0	299.345	4.133	20	30		CIEDRN
C[C@H]1C[C@@H](C(=O)Nc2ccccc2CC#N)CC(C)(C)C1	ZINC000567513511	334727471	/nfs/dbraw/zinc/72/74/71/334727471.db2.gz	AKUOJIIIWSFGOY-DZGCQCFKSA-N	0	0	284.403	4.154	20	30		CIEDRN
C=C[C@H](CC(=O)N(C)c1ccc(F)cc1)c1ccccc1	ZINC000156393677	334741585	/nfs/dbraw/zinc/74/15/85/334741585.db2.gz	ALSXBNHDWPUPBI-CQSZACIVSA-N	0	0	283.346	4.148	20	30		CIEDRN
N#Cc1cccc(CNCc2cc(Cl)sc2Cl)c1	ZINC000312609789	334750704	/nfs/dbraw/zinc/75/07/04/334750704.db2.gz	UZLLYIGDWPUNAO-UHFFFAOYSA-N	0	0	297.210	4.216	20	30		CIEDRN
CC(C)c1nc2cc(NCc3ccc(C#N)s3)ccc2o1	ZINC000157453629	334771659	/nfs/dbraw/zinc/77/16/59/334771659.db2.gz	ULOOOPAMQBBXHT-UHFFFAOYSA-N	0	0	297.383	4.496	20	30		CIEDRN
CC(C)=CCC[C@@H](C)CC(=O)NCC1CCC(C#N)CC1	ZINC000567927602	334776516	/nfs/dbraw/zinc/77/65/16/334776516.db2.gz	KJGZSVGDTRVDDI-KLAILNCOSA-N	0	0	290.451	4.205	20	30		CIEDRN
N#CCC[C@@H](C#N)CNc1ccc(Oc2ccccc2)cc1	ZINC000568375872	334820463	/nfs/dbraw/zinc/82/04/63/334820463.db2.gz	VAEAYHIHEKNIOY-HNNXBMFYSA-N	0	0	291.354	4.334	20	30		CIEDRN
Cc1nc(C(C)C)sc1C(=O)Nc1cc(C)cc(C#N)c1	ZINC000568480294	334826542	/nfs/dbraw/zinc/82/65/42/334826542.db2.gz	SHOOKCQGQPKRHG-UHFFFAOYSA-N	0	0	299.399	4.007	20	30		CIEDRN
CC[C@H]1CCCC[C@@H]1c1noc(C2(C#N)CCCCC2)n1	ZINC000569126356	334856966	/nfs/dbraw/zinc/85/69/66/334856966.db2.gz	IQKGSQXPWFWJHJ-KBPBESRZSA-N	0	0	287.407	4.479	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H]1CCCc2ccc(C)cc21	ZINC000572753212	334875812	/nfs/dbraw/zinc/87/58/12/334875812.db2.gz	DSQWOMBONOPDKN-PBHICJAKSA-N	0	0	271.404	4.091	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H]1CCCc2ccc(C)cc21	ZINC000572753213	334875823	/nfs/dbraw/zinc/87/58/23/334875823.db2.gz	DSQWOMBONOPDKN-YOEHRIQHSA-N	0	0	271.404	4.091	20	30		CIEDRN
CCS[C@@H]1CCC[C@@H]1Nc1nc(C)c(C#N)cc1Cl	ZINC000336815925	334913619	/nfs/dbraw/zinc/91/36/19/334913619.db2.gz	JTCPTCYOUUHUAU-QWHCGFSZSA-N	0	0	295.839	4.001	20	30		CIEDRN
C[C@H](C(=O)Nc1ccccc1C#N)c1ccc(Cl)s1	ZINC000175506019	335186919	/nfs/dbraw/zinc/18/69/19/335186919.db2.gz	JUWYGUFIDYDPLU-VIFPVBQESA-N	0	0	290.775	4.015	20	30		CIEDRN
C=C(C)[C@H]1OCC[C@H]1c1nc([C@@H]2CCCC(C)(C)C2)no1	ZINC000576312945	335188345	/nfs/dbraw/zinc/18/83/45/335188345.db2.gz	ONAKPVFGMBBKFL-MGPQQGTHSA-N	0	0	290.407	4.202	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(-c2ccc3cc[nH]c3c2)no1	ZINC000576334832	335190598	/nfs/dbraw/zinc/19/05/98/335190598.db2.gz	JIYJWSRSGWKLSO-INIZCTEOSA-N	0	0	267.332	4.072	20	30		CIEDRN
C=CCCC1(C(=O)NC[C@H]2CCCCC(F)(F)C2)CC1	ZINC000576537259	335216846	/nfs/dbraw/zinc/21/68/46/335216846.db2.gz	DBMQLJBTVQZJLM-ZDUSSCGKSA-N	0	0	285.378	4.065	20	30		CIEDRN
CCCC[C@@H](CC)CC(=O)NCC(C)(C)CCC#N	ZINC000576641793	335229787	/nfs/dbraw/zinc/22/97/87/335229787.db2.gz	VWMJYAMBYLTWLB-CQSZACIVSA-N	0	0	266.429	4.039	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cc(C)c(F)cc1Cl	ZINC000576785712	335247449	/nfs/dbraw/zinc/24/74/49/335247449.db2.gz	IEYQPYBVJVUZFT-SNVBAGLBSA-N	0	0	269.747	4.328	20	30		CIEDRN
Cc1nc(CSCc2ccc(F)cc2C#N)sc1C	ZINC000176405667	335271385	/nfs/dbraw/zinc/27/13/85/335271385.db2.gz	WDYYKBXTLKUSIT-UHFFFAOYSA-N	0	0	292.404	4.204	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(C(C)(C)c2ccccc2)no1	ZINC000577025508	335283671	/nfs/dbraw/zinc/28/36/71/335283671.db2.gz	MRLQDUNJQVEORP-KRWDZBQOSA-N	0	0	270.376	4.249	20	30		CIEDRN
CC[C@@H](Nc1cccc(CCCO)c1)c1ccc(C#N)cc1	ZINC000577143478	335308277	/nfs/dbraw/zinc/30/82/77/335308277.db2.gz	IQHYWICYBHMHHD-LJQANCHMSA-N	0	0	294.398	4.046	20	30		CIEDRN
COCCC1(CNc2cccc(C(F)F)c2C#N)CCC1	ZINC000577191553	335320173	/nfs/dbraw/zinc/32/01/73/335320173.db2.gz	OQRGHXOAIYTWPO-UHFFFAOYSA-N	0	0	294.345	4.115	20	30		CIEDRN
C=CCC(C)(C)c1nc(C(F)(F)c2ccc(F)cc2)no1	ZINC000580691002	335328016	/nfs/dbraw/zinc/32/80/16/335328016.db2.gz	CXYDVUNAMLQRQF-UHFFFAOYSA-N	0	0	296.292	4.203	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cnccc2C(F)(F)F)n1	ZINC000581083347	335328954	/nfs/dbraw/zinc/32/89/54/335328954.db2.gz	XCEWWJAKNJIROB-UHFFFAOYSA-N	0	0	297.280	4.004	20	30		CIEDRN
N#Cc1c(NC(C2CC2)C2CC2)cccc1C(F)F	ZINC000577388659	335346921	/nfs/dbraw/zinc/34/69/21/335346921.db2.gz	MUESVXUZGFIHTQ-UHFFFAOYSA-N	0	0	262.303	4.096	20	30		CIEDRN
CCOc1ccc(CNc2ccc(C#N)cc2)cc1Cl	ZINC000577427221	335351428	/nfs/dbraw/zinc/35/14/28/335351428.db2.gz	APQKJCBQDYNIEO-UHFFFAOYSA-N	0	0	286.762	4.222	20	30		CIEDRN
CC(C)N(Cc1ccc(C#N)cn1)c1ccc(Cl)cc1	ZINC000577646013	335385291	/nfs/dbraw/zinc/38/52/91/335385291.db2.gz	CFHJWYZRWXVNAG-UHFFFAOYSA-N	0	0	285.778	4.022	20	30		CIEDRN
C=C(C)CCS[C@H](C)C(=O)Nc1ccccc1SC	ZINC000577676167	335387707	/nfs/dbraw/zinc/38/77/07/335387707.db2.gz	WWAOCJVVDOSAGD-GFCCVEGCSA-N	0	0	295.473	4.435	20	30		CIEDRN
Cc1cn(Cc2ccc([C@@H](C)C(F)(F)F)cc2)cc1C#N	ZINC000577713149	335391561	/nfs/dbraw/zinc/39/15/61/335391561.db2.gz	JACIRWBLFXXMNG-GFCCVEGCSA-N	0	0	292.304	4.382	20	30		CIEDRN
CC1(C)CCC[C@H](C(=O)N[C@@H](CCC#N)c2ccccc2)C1	ZINC000179075856	335472053	/nfs/dbraw/zinc/47/20/53/335472053.db2.gz	AKZNUGSCFQPUID-IRXDYDNUSA-N	0	0	298.430	4.364	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@@H]1C[C@@H]1c1ccccc1Cl	ZINC000578123856	335506545	/nfs/dbraw/zinc/50/65/45/335506545.db2.gz	SILVABWVCNJFLL-NWANDNLSSA-N	0	0	291.822	4.305	20	30		CIEDRN
C=C[C@](C)(CCOC)c1nc([C@@H]2CCCC(C)(C)C2)no1	ZINC000578367729	335621178	/nfs/dbraw/zinc/62/11/78/335621178.db2.gz	JTBFEHRFBDOZLY-CXAGYDPISA-N	0	0	292.423	4.234	20	30		CIEDRN
C=CCCC(=O)N(CCCC)[C@H]1CCC[C@@H](C)C1	ZINC000578690016	335663828	/nfs/dbraw/zinc/66/38/28/335663828.db2.gz	DAMXLHVRJFVWSG-CABCVRRESA-N	0	0	251.414	4.160	20	30		CIEDRN
Cc1cc(C#N)ccc1-c1nc(CC2(C)CCCC2)no1	ZINC000578698514	335664449	/nfs/dbraw/zinc/66/44/49/335664449.db2.gz	ZTMIHJYJZWWRCN-UHFFFAOYSA-N	0	0	281.359	4.040	20	30		CIEDRN
C=C1CCN(C(=O)c2cc3cccc(Cl)c3s2)CC1	ZINC000578893882	335686647	/nfs/dbraw/zinc/68/66/47/335686647.db2.gz	HDVGXBUCODDUHH-UHFFFAOYSA-N	0	0	291.803	4.347	20	30		CIEDRN
CC[C@@H](C)CCC(=O)N(CC)c1ccc(C#N)c(Cl)c1	ZINC000579157364	335716984	/nfs/dbraw/zinc/71/69/84/335716984.db2.gz	VXTQMKABNRLBJW-GFCCVEGCSA-N	0	0	292.810	4.391	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N(C)[C@@H]1CCc2ccccc21	ZINC000181089373	335749979	/nfs/dbraw/zinc/74/99/79/335749979.db2.gz	ZGJXPUVSBFCSDM-WMLDXEAASA-N	0	0	286.419	4.060	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N1CCC[C@H]1c1cccs1	ZINC000181429491	335761932	/nfs/dbraw/zinc/76/19/32/335761932.db2.gz	FPTVZKUHWMQXIL-KBPBESRZSA-N	0	0	292.448	4.339	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1cc(F)c(F)cc1Cl	ZINC000182626868	335831748	/nfs/dbraw/zinc/83/17/48/335831748.db2.gz	ZOKUHAUIZVIXTI-VIFPVBQESA-N	0	0	287.737	4.093	20	30		CIEDRN
C=CCC[C@@H](NC(=O)CCCOC(C)C)c1ccccc1	ZINC000183174284	335870785	/nfs/dbraw/zinc/87/07/85/335870785.db2.gz	GUJQFTDLAAPWNP-QGZVFWFLSA-N	0	0	289.419	4.015	20	30		CIEDRN
CC[C@@H](CC#N)NCc1ccc(-c2ccccc2F)s1	ZINC000184096040	335918165	/nfs/dbraw/zinc/91/81/65/335918165.db2.gz	BFSZOLDHKKDMLC-LBPRGKRZSA-N	0	0	288.391	4.336	20	30		CIEDRN
Cc1cc(C#N)ccc1OCc1ccccc1C(C)(C)C#N	ZINC000579906675	335921401	/nfs/dbraw/zinc/92/14/01/335921401.db2.gz	GMAUVRDFJGRGGR-UHFFFAOYSA-N	0	0	290.366	4.247	20	30		CIEDRN
CC(C)c1ccc2c(c1)[C@H](Nc1cccnc1C#N)CC2	ZINC000580747126	335961878	/nfs/dbraw/zinc/96/18/78/335961878.db2.gz	NVCSBLJNBPDLSX-MRXNPFEDSA-N	0	0	277.371	4.176	20	30		CIEDRN
Cc1nc(N2CCC[C@H]3CCCC[C@H]32)c(Cl)cc1C#N	ZINC000380605545	336004394	/nfs/dbraw/zinc/00/43/94/336004394.db2.gz	CVPSXPZDGHGOBF-IUODEOHRSA-N	0	0	289.810	4.074	20	30		CIEDRN
C=CCS[C@H](C)C(=O)Nc1ccccc1[C@@H](C)CC	ZINC000581153842	336016503	/nfs/dbraw/zinc/01/65/03/336016503.db2.gz	MMTGIKYCCNHLEL-QWHCGFSZSA-N	0	0	277.433	4.446	20	30		CIEDRN
C=CC[C@H](c1nc(C(C)(C)C)no1)c1ccccc1	ZINC000581201486	336024175	/nfs/dbraw/zinc/02/41/75/336024175.db2.gz	ZXAZWBDDGXAMBO-ZDUSSCGKSA-N	0	0	256.349	4.075	20	30		CIEDRN
C=CCSCCNC(=O)Nc1c(C)cccc1C(C)C	ZINC000194596830	336030819	/nfs/dbraw/zinc/03/08/19/336030819.db2.gz	SJWPXMMAAFZMPZ-UHFFFAOYSA-N	0	0	292.448	4.159	20	30		CIEDRN
N#Cc1ccc(CSCc2cc(F)ccc2F)cc1	ZINC000195541077	336055855	/nfs/dbraw/zinc/05/58/55/336055855.db2.gz	IPZJDISISNAJJL-UHFFFAOYSA-N	0	0	275.323	4.270	20	30		CIEDRN
N#Cc1ccc(Cl)cc1OC[C@@H]1CCCC1(F)F	ZINC000381740295	336072166	/nfs/dbraw/zinc/07/21/66/336072166.db2.gz	ULPALUGVYQVRMI-JTQLQIEISA-N	0	0	271.694	4.026	20	30		CIEDRN
CCCC[C@@H](C)N(CCCC)C(=O)c1cc(C#N)cs1	ZINC000581508405	336091869	/nfs/dbraw/zinc/09/18/69/336091869.db2.gz	NBKZCLRESOBPON-CYBMUJFWSA-N	0	0	292.448	4.441	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1cccc(SC)n1)c1ccccc1	ZINC000581628261	336114456	/nfs/dbraw/zinc/11/44/56/336114456.db2.gz	QKTAQRQANQNKCD-AWEZNQCLSA-N	0	0	298.411	4.102	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cc(C(CC)CC)no2)n1	ZINC000581898737	336163003	/nfs/dbraw/zinc/16/30/03/336163003.db2.gz	IMAOCOLDVQJXEF-UHFFFAOYSA-N	0	0	289.379	4.482	20	30		CIEDRN
N#Cc1cnc(NCc2ccc3sccc3c2)c(Cl)c1	ZINC000581916636	336165414	/nfs/dbraw/zinc/16/54/14/336165414.db2.gz	ISHAVYBRXIEZFW-UHFFFAOYSA-N	0	0	299.786	4.433	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1cccc(C)c1Cl	ZINC000581919955	336166303	/nfs/dbraw/zinc/16/63/03/336166303.db2.gz	NZLGBBZJXBBZLM-GFCCVEGCSA-N	0	0	278.783	4.221	20	30		CIEDRN
Cc1nc(SCc2ccccc2)c(Cl)cc1C#N	ZINC000386215665	336168225	/nfs/dbraw/zinc/16/82/25/336168225.db2.gz	NPGOYNBMKRYWJL-UHFFFAOYSA-N	0	0	274.776	4.207	20	30		CIEDRN
N#Cc1cccc(CNc2cccc3ccsc32)c1	ZINC000386291308	336170291	/nfs/dbraw/zinc/17/02/91/336170291.db2.gz	HYPFKCJZCWDKIU-UHFFFAOYSA-N	0	0	264.353	4.385	20	30		CIEDRN
Cc1nc(NCc2ccc(Cl)s2)c(Cl)cc1C#N	ZINC000386450780	336175171	/nfs/dbraw/zinc/17/51/71/336175171.db2.gz	DPCGAAXJDYNXEO-UHFFFAOYSA-N	0	0	298.198	4.242	20	30		CIEDRN
CC(C)c1nc2cc(NCc3cccc(C#N)c3)ccc2o1	ZINC000387144590	336186255	/nfs/dbraw/zinc/18/62/55/336186255.db2.gz	DVEALUORVRXMRC-UHFFFAOYSA-N	0	0	291.354	4.435	20	30		CIEDRN
C[C@@H]1CCC[C@H](CCNC(=O)[C@H]2CCCCC(=O)N2)C1	ZINC000329837443	533835013	/nfs/dbraw/zinc/83/50/13/533835013.db2.gz	IGPZOLLLVFJNCB-MGPQQGTHSA-N	0	0	280.412	4.058	20	30		CIEDRN
CS[C@@H]1CCC[C@@H](Nc2cc(C#N)nc3ccccc32)C1	ZINC000301406383	533951199	/nfs/dbraw/zinc/95/11/99/533951199.db2.gz	UXYUAXKSVAZJKI-TZMCWYRMSA-N	0	0	297.427	4.193	20	30		CIEDRN
Cc1c2ccccc2oc1[C@@H](C)NC(=O)[C@@H]1C[C@]12CCOC2	ZINC000330046344	533980064	/nfs/dbraw/zinc/98/00/64/533980064.db2.gz	ISGHJYGEFAPYEA-IAISJRAMSA-N	0	0	299.370	4.185	20	30		CIEDRN
C[C@@H]1CC[C@@H](C(=O)Nc2ncc(C3CCCCC3)s2)O1	ZINC000329288082	534140607	/nfs/dbraw/zinc/14/06/07/534140607.db2.gz	HPJGXOKMSSIWOV-PWSUYJOCSA-N	0	0	294.420	4.346	20	30		CIEDRN
Cc1ccc(N2CCC[C@H]2c2ccc(Cl)cc2)nc1C#N	ZINC000302626180	534162485	/nfs/dbraw/zinc/16/24/85/534162485.db2.gz	ICNUIMLSNZWPFX-INIZCTEOSA-N	0	0	297.789	4.257	20	30		CIEDRN
C[C@H]1CC(=O)CC[C@@H]1C(=O)Nc1ncc(C(C)(C)C)s1	ZINC000329000833	534166210	/nfs/dbraw/zinc/16/62/10/534166210.db2.gz	VUAKKEUIRSFZOK-ONGXEEELSA-N	0	0	294.420	4.034	20	30		CIEDRN
C[C@@H]1CC[C@H](C(=O)Nc2ccccc2SCCC#N)C1	ZINC000345460876	534213827	/nfs/dbraw/zinc/21/38/27/534213827.db2.gz	SGYPMOSHRUCWPB-OLZOCXBDSA-N	0	0	288.416	4.067	20	30		CIEDRN
Cc1ccc(-n2ccnc2S[C@@H](C)CCC#N)cc1C	ZINC000347590396	534241643	/nfs/dbraw/zinc/24/16/43/534241643.db2.gz	BMJNHHBKFVGDCA-AWEZNQCLSA-N	0	0	285.416	4.274	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)Nc1ncccc1C	ZINC000469910038	517314447	/nfs/dbraw/zinc/31/44/47/517314447.db2.gz	UAPAWMXDRNBZQO-UHFFFAOYSA-N	0	0	295.386	4.000	20	30		CIEDRN
C=CCC(C)(C)c1noc(CSc2ccccc2)n1	ZINC000515470032	517321468	/nfs/dbraw/zinc/32/14/68/517321468.db2.gz	JFLGGIBUJZSQSK-UHFFFAOYSA-N	0	0	274.389	4.216	20	30		CIEDRN
CC[C@H](C)Oc1cc(C)ccc1CNc1ccc(C#N)nc1	ZINC000301595812	517802847	/nfs/dbraw/zinc/80/28/47/517802847.db2.gz	FWCHBWKFKWQMTG-AWEZNQCLSA-N	0	0	295.386	4.051	20	30		CIEDRN
Cc1noc(C)c1C(C)(C)NC(=O)[C@H]1CC12CCCC2	ZINC000329176741	534323608	/nfs/dbraw/zinc/32/36/08/534323608.db2.gz	CAUQIWNKIMFKIZ-GFCCVEGCSA-N	0	0	276.380	4.063	20	30		CIEDRN
C=CCCCCCNc1cccc(NC(=O)N(C)C)c1C	ZINC000279968668	518700482	/nfs/dbraw/zinc/70/04/82/518700482.db2.gz	DAMGHGFHABJQMN-UHFFFAOYSA-N	0	0	289.423	4.247	20	30		CIEDRN
CC(C)(C)c1cnc(CNc2ccc(C#N)cc2Cl)o1	ZINC000268925291	519074246	/nfs/dbraw/zinc/07/42/46/519074246.db2.gz	ANSFBZBMMOIDNC-UHFFFAOYSA-N	0	0	289.766	4.109	20	30		CIEDRN
CC(C)[C@@H]1CN(C(=O)c2cc(C#N)cs2)c2ccccc21	ZINC000278305059	519803880	/nfs/dbraw/zinc/80/38/80/519803880.db2.gz	BKYILXANCBBBNG-AWEZNQCLSA-N	0	0	296.395	4.020	20	30		CIEDRN
CC(C)c1ccoc1C(=O)Nc1ccc(Cl)c(C#N)c1	ZINC000339882330	519849512	/nfs/dbraw/zinc/84/95/12/519849512.db2.gz	XMZBILIVAWWKGD-UHFFFAOYSA-N	0	0	288.734	4.180	20	30		CIEDRN
CCN(C(=O)CC1CCC(C)CC1)c1ccc(C#N)cc1	ZINC000337974015	519902062	/nfs/dbraw/zinc/90/20/62/519902062.db2.gz	CUMXLAJCANXOFP-UHFFFAOYSA-N	0	0	284.403	4.128	20	30		CIEDRN
N#CC1(C(=O)NC[C@@H]2C[C@H]2C2CCCCC2)CCCC1	ZINC000329333994	534541938	/nfs/dbraw/zinc/54/19/38/534541938.db2.gz	KLECCTHTIYJQOK-GJZGRUSLSA-N	0	0	274.408	4.243	20	30		CIEDRN
Cc1oc2ccc(NC(=O)C3CCC(=O)CC3)cc2c1C	ZINC000330114876	534550556	/nfs/dbraw/zinc/55/05/56/534550556.db2.gz	TVURPKNZVJHFLW-UHFFFAOYSA-N	0	0	285.343	4.397	20	30		CIEDRN
CCc1ccccc1CNc1ccc(C#N)c(Cl)c1	ZINC000052200854	521846287	/nfs/dbraw/zinc/84/62/87/521846287.db2.gz	SAZMKJGWDIHIGY-UHFFFAOYSA-N	0	0	270.763	4.386	20	30		CIEDRN
CC[C@H](c1ccccc1)N(CC)C(=O)c1cc(C#N)cs1	ZINC000267641706	522940988	/nfs/dbraw/zinc/94/09/88/522940988.db2.gz	RADUEWPUAVYNRA-OAHLLOKOSA-N	0	0	298.411	4.233	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)c2sccc2CC)s1	ZINC000291557847	523746357	/nfs/dbraw/zinc/74/63/57/523746357.db2.gz	TWQUQSWEGGVYBI-UHFFFAOYSA-N	0	0	290.413	4.058	20	30		CIEDRN
Cc1cc(C)c(COc2ccc(C#N)cc2)c(C)c1	ZINC000049899114	524274950	/nfs/dbraw/zinc/27/49/50/524274950.db2.gz	GEXITLIYKFXVFQ-UHFFFAOYSA-N	0	0	251.329	4.063	20	30		CIEDRN
N#Cc1cnccc1/C=C\c1ccccc1C(F)(F)F	ZINC000347453544	534827329	/nfs/dbraw/zinc/82/73/29/534827329.db2.gz	VEYQFYIQZIUWQO-WAYWQWQTSA-N	0	0	274.245	4.142	20	30		CIEDRN
Cc1cc(Oc2ccc(C#N)cn2)cc(C)c1Cl	ZINC000036683324	525385387	/nfs/dbraw/zinc/38/53/87/525385387.db2.gz	ATSCETWOSMYUNC-UHFFFAOYSA-N	0	0	258.708	4.016	20	30		CIEDRN
Cc1ccccc1[C@H](C)CC(=O)N(C)c1ccccc1C#N	ZINC000269802960	525400118	/nfs/dbraw/zinc/40/01/18/525400118.db2.gz	DSQQAKIYWZPRNY-OAHLLOKOSA-N	0	0	292.382	4.023	20	30		CIEDRN
Cc1nc(-c2cccc(NC(=O)[C@H]3CC34CCCC4)c2)no1	ZINC000329953916	534859619	/nfs/dbraw/zinc/85/96/19/534859619.db2.gz	JRULMRIPOLNMII-CQSZACIVSA-N	0	0	297.358	4.213	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)N1C[C@@H]2CCCCCC[C@H]21	ZINC000366545691	525548484	/nfs/dbraw/zinc/54/84/84/525548484.db2.gz	KLSCPONDTCXZLV-DOTOQJQBSA-N	0	0	297.402	4.053	20	30		CIEDRN
C[C@H](Nc1cccc(C(F)(F)F)n1)c1ccc(C#N)cc1	ZINC000044271482	525665420	/nfs/dbraw/zinc/66/54/20/525665420.db2.gz	JJJZMPLULYQGER-JTQLQIEISA-N	0	0	291.276	4.145	20	30		CIEDRN
C=CCN(Cc1ncc(Cl)s1)Cc1ccccc1F	ZINC000351997224	526383451	/nfs/dbraw/zinc/38/34/51/526383451.db2.gz	SAOIWFUTTWZXMS-UHFFFAOYSA-N	0	0	296.798	4.124	20	30		CIEDRN
N#Cc1c(F)cccc1Sc1nc2ccccc2s1	ZINC000057796849	526526415	/nfs/dbraw/zinc/52/64/15/526526415.db2.gz	BIMPTFOLRMBHRC-UHFFFAOYSA-N	0	0	286.356	4.458	20	30		CIEDRN
Cc1noc(C)c1[C@H](C)CNc1c(Cl)cccc1C#N	ZINC000129475535	526575792	/nfs/dbraw/zinc/57/57/92/526575792.db2.gz	FRPNTHJPAXXILA-SECBINFHSA-N	0	0	289.766	4.032	20	30		CIEDRN
N#Cc1ccc(NCc2cccc(F)c2)cc1C(F)(F)F	ZINC000037306436	526664084	/nfs/dbraw/zinc/66/40/84/526664084.db2.gz	QKVOYODNLNNTKL-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
N#Cc1ccc(NCc2ccc(Cl)cc2F)c(F)c1	ZINC000157227569	526664735	/nfs/dbraw/zinc/66/47/35/526664735.db2.gz	KWGGOMIUQMSFAE-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
N#Cc1ccc(N[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)cc1	ZINC000273323045	526666494	/nfs/dbraw/zinc/66/64/94/526666494.db2.gz	PREPDSXLTJZEFP-MSOLQXFVSA-N	0	0	296.345	4.030	20	30		CIEDRN
CC(C)(C)[C@@H]1NC(=O)CC[C@H]1NC(=O)C1CCCCC1	ZINC000329301150	526681390	/nfs/dbraw/zinc/68/13/90/526681390.db2.gz	VRNACZITUQFPII-TZMCWYRMSA-N	0	0	280.412	4.057	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](C)C[C@@H]1c1ccccc1F	ZINC000185699501	526709514	/nfs/dbraw/zinc/70/95/14/526709514.db2.gz	AVQKPYSKVCDPHO-GRDNDAEWSA-N	0	0	289.394	4.338	20	30		CIEDRN
N#Cc1cccc(CSCc2nc3ccccc3[nH]2)c1F	ZINC000340857204	526712485	/nfs/dbraw/zinc/71/24/85/526712485.db2.gz	SYZDVNKHVCQGEF-UHFFFAOYSA-N	0	0	297.358	4.007	20	30		CIEDRN
N#Cc1cccc(NC(=O)N2CCC[C@H]2C2CCCCC2)c1	ZINC000047338288	526719257	/nfs/dbraw/zinc/71/92/57/526719257.db2.gz	FRGQPHJPLCWVAH-KRWDZBQOSA-N	0	0	297.402	4.135	20	30		CIEDRN
N#Cc1ccccc1/C=C/c1nc([C@@H]2CCCCS2)no1	ZINC000273981260	526735022	/nfs/dbraw/zinc/73/50/22/526735022.db2.gz	KXWJKMDVRJPSFD-VFNNOXKTSA-N	0	0	297.383	4.070	20	30		CIEDRN
CC(C)(C)[C@](C)(C#N)NC(=O)[C@@H]1CCC[C@H]2CCCC[C@@H]21	ZINC000332656015	526741812	/nfs/dbraw/zinc/74/18/12/526741812.db2.gz	AKFJZCSIIVBRLD-FSZRXZPDSA-N	0	0	290.451	4.037	20	30		CIEDRN
Cc1oc(C#N)cc1C(=O)Nc1c(C)cccc1C(C)C	ZINC000280609481	526758136	/nfs/dbraw/zinc/75/81/36/526758136.db2.gz	JZCRLAURPUQOGP-UHFFFAOYSA-N	0	0	282.343	4.144	20	30		CIEDRN
N#Cc1ccsc1NC(=O)[C@@H]1CC[C@@H]2CCCC[C@H]2C1	ZINC000245920065	526770895	/nfs/dbraw/zinc/77/08/95/526770895.db2.gz	OLTBCLSVRQZRNM-RWMBFGLXSA-N	0	0	288.416	4.165	20	30		CIEDRN
N#Cc1sc(N2CCC[C@@H]2c2ccccc2)nc1Cl	ZINC000278659921	526800044	/nfs/dbraw/zinc/80/00/44/526800044.db2.gz	JASGMUOKMQGGNN-LLVKDONJSA-N	0	0	289.791	4.010	20	30		CIEDRN
C=C(C)[C@@H]1OCC[C@H]1c1nc(C2CCC(C)(C)CC2)no1	ZINC000347497561	526804096	/nfs/dbraw/zinc/80/40/96/526804096.db2.gz	HLUOZTIJHDFPHD-KGLIPLIRSA-N	0	0	290.407	4.202	20	30		CIEDRN
C=CCOc1cccc(NC(=O)c2ccc(C(C)C)cn2)c1	ZINC000353424165	526918848	/nfs/dbraw/zinc/91/88/48/526918848.db2.gz	FGVLAVSCSRYUMG-UHFFFAOYSA-N	0	0	296.370	4.022	20	30		CIEDRN
C=CC1CCN(C(=O)c2coc3ccc(CC)cc32)CC1	ZINC000352686781	526977140	/nfs/dbraw/zinc/97/71/40/526977140.db2.gz	PWBVHDCAORSACW-UHFFFAOYSA-N	0	0	283.371	4.033	20	30		CIEDRN
CC(C)(CCC#N)CNC(=O)c1cc(Cl)ccc1Cl	ZINC000345980881	526996055	/nfs/dbraw/zinc/99/60/55/526996055.db2.gz	CDKZQRNAPQOFCC-UHFFFAOYSA-N	0	0	299.201	4.053	20	30		CIEDRN
C=CCCC(=O)N[C@@H](CC(F)(F)F)c1ccccc1C	ZINC000347457318	527075532	/nfs/dbraw/zinc/07/55/32/527075532.db2.gz	YWMHPEJABDSVIF-ZDUSSCGKSA-N	0	0	285.309	4.071	20	30		CIEDRN
C=CCCC1(C(=O)NC[C@@]2(C)C[C@H]2c2ccccc2)CC1	ZINC000355002886	527089041	/nfs/dbraw/zinc/08/90/41/527089041.db2.gz	RSSODOQDCGHRTA-FUHWJXTLSA-N	0	0	283.415	4.043	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)c2ccc(C3CC3)cn2)CCCC1(C)C	ZINC000347486011	527118288	/nfs/dbraw/zinc/11/82/88/527118288.db2.gz	PAZLYCXMJFABSW-KRWDZBQOSA-N	0	0	298.430	4.166	20	30		CIEDRN
C=CCCCCNc1nc(C(F)F)nc2ccccc21	ZINC000302273697	527171661	/nfs/dbraw/zinc/17/16/61/527171661.db2.gz	SNXRMVKSDJYYTK-UHFFFAOYSA-N	0	0	277.318	4.336	20	30		CIEDRN
C=CC[C@H]1N(C(=O)[C@@H]2CCC(F)(F)C2)CCCC1(C)C	ZINC000335333588	527225598	/nfs/dbraw/zinc/22/55/98/527225598.db2.gz	ZMMUOGFCXBPDNQ-CHWSQXEVSA-N	0	0	285.378	4.015	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NCc1nccc(C)n1	ZINC000352563645	527260936	/nfs/dbraw/zinc/26/09/36/527260936.db2.gz	WGGUBBIVZYEOQW-UHFFFAOYSA-N	0	0	281.403	4.249	20	30		CIEDRN
C=CCCO[C@H](C)c1nc(C2CCC(C)(C)CC2)no1	ZINC000347477883	527405074	/nfs/dbraw/zinc/40/50/74/527405074.db2.gz	ARAFNKHWHFQJOD-GFCCVEGCSA-N	0	0	278.396	4.407	20	30		CIEDRN
C=C[C@@H](Cc1nc([C@H](CCC)OC)no1)c1ccccc1	ZINC000296316178	527444782	/nfs/dbraw/zinc/44/47/82/527444782.db2.gz	FLOAJQUIESVWKA-ZFWWWQNUSA-N	0	0	286.375	4.070	20	30		CIEDRN
C=CCC[C@@H](Nc1nc(CC)ns1)c1ccccc1	ZINC000301774949	527452955	/nfs/dbraw/zinc/45/29/55/527452955.db2.gz	KVFMQMHHWUHURA-CYBMUJFWSA-N	0	0	273.405	4.220	20	30		CIEDRN
CC(C)(C#N)c1ccc(Nc2ccc([N+](=O)[O-])cc2F)cc1	ZINC000301074292	527498556	/nfs/dbraw/zinc/49/85/56/527498556.db2.gz	IJTAMYWVXYUXPU-UHFFFAOYSA-N	0	0	299.305	4.279	20	30		CIEDRN
C=CCN(CC(F)(F)F)C(=O)c1ccc2sccc2c1	ZINC000348354551	527588392	/nfs/dbraw/zinc/58/83/92/527588392.db2.gz	YMVCCZLCGMTDGR-UHFFFAOYSA-N	0	0	299.317	4.092	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1ccccc1C(C)(F)F	ZINC000334581615	527601881	/nfs/dbraw/zinc/60/18/81/527601881.db2.gz	SUERFCCSJBEAPA-LBPRGKRZSA-N	0	0	294.345	4.371	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000335863659	527602242	/nfs/dbraw/zinc/60/22/42/527602242.db2.gz	GTZOFOGZUUWEBD-INIZCTEOSA-N	0	0	297.402	4.060	20	30		CIEDRN
CC(C)(C)CCNc1c(C#N)cnc2c(F)cc(F)cc21	ZINC000352315872	527670792	/nfs/dbraw/zinc/67/07/92/527670792.db2.gz	PWNBAPDDEMPTMJ-UHFFFAOYSA-N	0	0	289.329	4.233	20	30		CIEDRN
CC(C)CCN(CCC#N)Cc1ccc([C@H]2C[C@@H]2C)o1	ZINC000353416776	527715690	/nfs/dbraw/zinc/71/56/90/527715690.db2.gz	QDIGCNYUOIJNNI-HOCLYGCPSA-N	0	0	274.408	4.165	20	30		CIEDRN
CC(C)CC[C@@H](C)NC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000353852570	527800373	/nfs/dbraw/zinc/80/03/73/527800373.db2.gz	OPRVKOMPBBNUQK-NVXWUHKLSA-N	0	0	286.419	4.015	20	30		CIEDRN
CCC1CCC(NC(=O)Cc2ccc3n[nH]cc3c2)CC1	ZINC000329968579	527823973	/nfs/dbraw/zinc/82/39/73/527823973.db2.gz	TYWOBANARIENDY-UHFFFAOYSA-N	0	0	285.391	4.031	20	30		CIEDRN
CCC[C@@H]1[C@H](C)CCCN1c1snc(Cl)c1C#N	ZINC000301959407	527879779	/nfs/dbraw/zinc/87/97/79/527879779.db2.gz	PGQIPMZUFXNRHP-MWLCHTKSSA-N	0	0	283.828	4.073	20	30		CIEDRN
CC1=C(C(=O)Nc2ccc3c(c2)N(C(N)=O)CCC3)CCC1	ZINC000330309862	528084169	/nfs/dbraw/zinc/08/41/69/528084169.db2.gz	NAXYJPPAEHMHQQ-UHFFFAOYSA-N	0	0	299.374	4.020	20	30		CIEDRN
CC1=C(C(=O)Nc2nc(C3CCOCC3)cs2)CCC1	ZINC000329214875	528084182	/nfs/dbraw/zinc/08/41/82/528084182.db2.gz	LVPYJHIZSSDCSI-UHFFFAOYSA-N	0	0	292.404	4.126	20	30		CIEDRN
CC(C)c1ccc2c(c1)[C@H](Nc1ccc(C#N)nc1)CC2	ZINC000302351947	528155394	/nfs/dbraw/zinc/15/53/94/528155394.db2.gz	BRPNARBAOHIZTE-GOSISDBHSA-N	0	0	277.371	4.176	20	30		CIEDRN
CC1CCC(C)(NC(=O)C[C@H](CC#N)c2ccccc2)CC1	ZINC000355465349	528171541	/nfs/dbraw/zinc/17/15/41/528171541.db2.gz	NCNUUMUBVJEEBD-RMXPPQQLSA-N	0	0	298.430	4.159	20	30		CIEDRN
CC(C)c1ccccc1N(C)C(=O)c1ccc(C#N)s1	ZINC000336512923	528190498	/nfs/dbraw/zinc/19/04/98/528190498.db2.gz	VBUNJFYLSUTAJL-UHFFFAOYSA-N	0	0	284.384	4.020	20	30		CIEDRN
CC(C)Sc1ccc([C@H](C)NCC2(C#N)CC2)cc1	ZINC000343564523	528328760	/nfs/dbraw/zinc/32/87/60/528328760.db2.gz	OLTCOFYHHAICAO-ZDUSSCGKSA-N	0	0	274.433	4.141	20	30		CIEDRN
CC(C)c1ncc(NC(=O)CC2=CCCCC2)cn1	ZINC000330063254	528355510	/nfs/dbraw/zinc/35/55/10/528355510.db2.gz	PXEDWIWUZDZRHY-UHFFFAOYSA-N	0	0	259.353	4.079	20	30		CIEDRN
CC(C)c1scnc1NC(=O)N[C@@H]1CCCC[C@@H]1C	ZINC000329559597	528523606	/nfs/dbraw/zinc/52/36/06/528523606.db2.gz	LYRRKDOBAFAVAD-WDEREUQCSA-N	0	0	281.425	4.171	20	30		CIEDRN
CCOc1ccc(N[C@H](C)c2ccc(OCC#N)cc2)cc1	ZINC000192910008	528556817	/nfs/dbraw/zinc/55/68/17/528556817.db2.gz	NNURZWOJQNPGRE-CQSZACIVSA-N	0	0	296.370	4.161	20	30		CIEDRN
CC(C)[C@@H](Nc1ncccc1C#N)c1ccc(F)cc1F	ZINC000301656813	528600558	/nfs/dbraw/zinc/60/05/58/528600558.db2.gz	VNIBJBYACDKVFM-OAHLLOKOSA-N	0	0	287.313	4.041	20	30		CIEDRN
CC(C)[C@@H]1CCCCN1C(=O)C[C@H](CC#N)c1ccccc1	ZINC000356117175	528648716	/nfs/dbraw/zinc/64/87/16/528648716.db2.gz	LXYUAGIDIPSJEU-ROUUACIJSA-N	0	0	298.430	4.111	20	30		CIEDRN
CCC[C@@H](C)CC(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000352174392	528875523	/nfs/dbraw/zinc/87/55/23/528875523.db2.gz	MNQKDBUBNLZLTQ-NVXWUHKLSA-N	0	0	286.419	4.364	20	30		CIEDRN
CC1(C)CCC(c2noc(C3(C#N)CCCC3)n2)CC1	ZINC000331516380	528908395	/nfs/dbraw/zinc/90/83/95/528908395.db2.gz	DKYSFWCEJNQERX-UHFFFAOYSA-N	0	0	273.380	4.089	20	30		CIEDRN
CC1(C)CCCC[C@@H]1C(=O)Nc1nc(C2CC2)c[nH]1	ZINC000329315372	528914691	/nfs/dbraw/zinc/91/46/91/528914691.db2.gz	RYWAGYNECTUAOO-LLVKDONJSA-N	0	0	261.369	4.092	20	30		CIEDRN
CC1(C)CCC[C@@H](CC(=O)NCc2nnc(C3CC3)o2)C1	ZINC000329514600	528954520	/nfs/dbraw/zinc/95/45/20/528954520.db2.gz	ODOGZVOWMKQJHS-NSHDSACASA-N	0	0	291.395	4.010	20	30		CIEDRN
CCC1(NC(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)CCC1	ZINC000330221374	528981367	/nfs/dbraw/zinc/98/13/67/528981367.db2.gz	LOWHWKDZWZIMHS-UHFFFAOYSA-N	0	0	286.375	4.203	20	30		CIEDRN
CC1(C)CCC[C@H]1C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000352207214	528987141	/nfs/dbraw/zinc/98/71/41/528987141.db2.gz	VDULKFBDCHJIFD-IRXDYDNUSA-N	0	0	298.430	4.364	20	30		CIEDRN
CCc1cccc(C)c1NC(=O)NCC(C)(C)CCC#N	ZINC000348155581	529158572	/nfs/dbraw/zinc/15/85/72/529158572.db2.gz	NBKQMOKHXLCLNP-UHFFFAOYSA-N	0	0	287.407	4.009	20	30		CIEDRN
CCSCC[C@@H](C)Nc1ccc2cc(C#N)ccc2n1	ZINC000301972100	529189299	/nfs/dbraw/zinc/18/92/99/529189299.db2.gz	HGEXKAOTNPOYLR-GFCCVEGCSA-N	0	0	285.416	4.050	20	30		CIEDRN
CCSc1ccc([C@@H](C)Nc2ncccc2C#N)cc1	ZINC000301187788	529246709	/nfs/dbraw/zinc/24/67/09/529246709.db2.gz	KJZNQINWJLCWJZ-GFCCVEGCSA-N	0	0	283.400	4.238	20	30		CIEDRN
CC[C@H]1CC[C@H](C(=O)NCCc2nc(C)oc2C)CC1	ZINC000329983612	529249948	/nfs/dbraw/zinc/24/99/48/529249948.db2.gz	BJPGQNBJZFYHCY-HDJSIYSDSA-N	0	0	278.396	4.007	20	30		CIEDRN
CC[C@@H]1CCCC[C@@H]1NC(=O)c1oc(CC2CC2)nc1C	ZINC000329997319	529274723	/nfs/dbraw/zinc/27/47/23/529274723.db2.gz	QIMUSKSBZYSKCO-KGLIPLIRSA-N	0	0	290.407	4.209	20	30		CIEDRN
CCCCCCCC(=O)N1CCC[C@H]1c1cccnc1	ZINC000085814586	560066653	/nfs/dbraw/zinc/06/66/53/560066653.db2.gz	KEQBTQJDZSZAMQ-INIZCTEOSA-N	0	0	274.408	4.106	20	30	biogenic,in-vitro	CIEDRN
CC[C@@H](C)Oc1cc(C)ccc1CNc1ccc(C#N)nc1	ZINC000301595813	529380824	/nfs/dbraw/zinc/38/08/24/529380824.db2.gz	FWCHBWKFKWQMTG-CQSZACIVSA-N	0	0	295.386	4.051	20	30		CIEDRN
CCc1ccc(CC)c(NC(=O)C[C@H]2CCCC(=O)N2)c1	ZINC000329612433	529621543	/nfs/dbraw/zinc/62/15/43/529621543.db2.gz	CKIKERXRPPFCNH-CQSZACIVSA-N	0	0	288.391	4.299	20	30		CIEDRN
CCc1ccc([C@@H]2C[C@@H](C)CCN2c2ncccc2C#N)o1	ZINC000301446411	529718089	/nfs/dbraw/zinc/71/80/89/529718089.db2.gz	OBPNRQNMWVZDIE-BBRMVZONSA-N	0	0	295.386	4.086	20	30		CIEDRN
C=CCCCN[C@@H](c1cccc(OC(C)C)c1)C(F)F	ZINC000573584176	334949322	/nfs/dbraw/zinc/94/93/22/334949322.db2.gz	HWJPFZZFKFMDAD-HNNXBMFYSA-N	0	0	283.362	4.336	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1ccc2c(c1)CCCCC2=O	ZINC000573736961	334962127	/nfs/dbraw/zinc/96/21/27/334962127.db2.gz	ISZOOLFPJJPFDR-CQSZACIVSA-N	0	0	299.414	4.070	20	30		CIEDRN
N#Cc1ccc(F)c(CSCc2cccc(F)c2)c1	ZINC000518483509	260437880	/nfs/dbraw/zinc/43/78/80/260437880.db2.gz	SYTFYVWILOFHKQ-UHFFFAOYSA-N	0	0	275.323	4.270	20	30		CIEDRN
N#Cc1ccc(C(=O)Nc2ccsc2Cl)cc1Cl	ZINC000336494013	126187640	/nfs/dbraw/zinc/18/76/40/126187640.db2.gz	HWPDASUEARPXPM-UHFFFAOYSA-N	0	0	297.166	4.179	20	30		CIEDRN
N#Cc1c(F)cccc1CNc1ccc(Cl)c(F)c1	ZINC000427561593	260770618	/nfs/dbraw/zinc/77/06/18/260770618.db2.gz	CERWVFOKIUHWCN-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N1CCC[C@H]1c1ccc(C)c(C)c1	ZINC000574184672	334999186	/nfs/dbraw/zinc/99/91/86/334999186.db2.gz	NZAIEGDANGGXAA-WBVHZDCISA-N	0	0	286.419	4.115	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N1CCC[C@H]1c1ccc(C)c(C)c1	ZINC000574184671	334999112	/nfs/dbraw/zinc/99/91/12/334999112.db2.gz	NZAIEGDANGGXAA-RDJZCZTQSA-N	0	0	286.419	4.115	20	30		CIEDRN
CO[C@H](CSCc1ccc(C#N)cc1)c1ccccc1	ZINC000574221486	335002494	/nfs/dbraw/zinc/00/24/94/335002494.db2.gz	CHBVBWNGZDCQFL-QGZVFWFLSA-N	0	0	283.396	4.179	20	30		CIEDRN
C=CCCCc1nc(-c2ccc(C(C)(F)F)cc2)no1	ZINC000574370625	335014142	/nfs/dbraw/zinc/01/41/42/335014142.db2.gz	WYNXSVMUONUGEN-UHFFFAOYSA-N	0	0	278.302	4.357	20	30		CIEDRN
CC[C@@H](CC(=O)N(CC#N)c1ccccc1)c1ccccc1	ZINC000171463607	335017915	/nfs/dbraw/zinc/01/79/15/335017915.db2.gz	UTEKNSONELXBDV-INIZCTEOSA-N	0	0	292.382	4.127	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc([C@@H](C)Oc2ccccc2)no1	ZINC000574433700	335019273	/nfs/dbraw/zinc/01/92/73/335019273.db2.gz	MJLNPNUQMUBJKS-QWHCGFSZSA-N	0	0	272.348	4.279	20	30		CIEDRN
CC(C)(C#N)c1ccc(C(=O)NC[C@@H]2CCCC2(C)C)cc1	ZINC000574718395	335042489	/nfs/dbraw/zinc/04/24/89/335042489.db2.gz	PRPGHMRGUUFYNO-INIZCTEOSA-N	0	0	298.430	4.044	20	30		CIEDRN
C=CC[C@@H](C(=O)N1CC2(CCC2)[C@@H]1C(C)C)c1ccccc1	ZINC000574779869	335046947	/nfs/dbraw/zinc/04/69/47/335046947.db2.gz	AQDBGKWQDPRJMC-MSOLQXFVSA-N	0	0	297.442	4.383	20	30		CIEDRN
Cc1cccc(CNc2cccc(C#N)c2)c1OC(F)F	ZINC000574782258	335047288	/nfs/dbraw/zinc/04/72/88/335047288.db2.gz	VCZXKMKSNVYVOK-UHFFFAOYSA-N	0	0	288.297	4.080	20	30		CIEDRN
C[C@@H](Nc1ncccc1C#N)c1ccc(F)c2ccccc21	ZINC000575018723	335056304	/nfs/dbraw/zinc/05/63/04/335056304.db2.gz	RSLQQBXJHKHQIX-GFCCVEGCSA-N	0	0	291.329	4.419	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N(C)[C@@H](C)c1cccc(Cl)c1	ZINC000116971233	260021168	/nfs/dbraw/zinc/02/11/68/260021168.db2.gz	RDVOBNDQBBCZIS-RYUDHWBXSA-N	0	0	280.799	4.007	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000186993336	260024851	/nfs/dbraw/zinc/02/48/51/260024851.db2.gz	UQPBHMQVGYUFLC-UHFFFAOYSA-N	0	0	282.334	4.228	20	30		CIEDRN
N#Cc1c(F)cccc1N[C@@H](c1ccccc1)[C@@H]1CCCO1	ZINC000171372898	335063490	/nfs/dbraw/zinc/06/34/90/335063490.db2.gz	HJVYSTBIDAVUNY-ROUUACIJSA-N	0	0	296.345	4.030	20	30		CIEDRN
C[C@@H](C(=O)NCCCC1CCCCC1)c1cccc(C#N)c1	ZINC000461903941	533256834	/nfs/dbraw/zinc/25/68/34/533256834.db2.gz	WDJYMVAJHLTYLM-OAHLLOKOSA-N	0	0	298.430	4.138	20	30		CIEDRN
COc1ccc(C)cc1CSc1cccc(F)c1C#N	ZINC000301652307	533389128	/nfs/dbraw/zinc/38/91/28/533389128.db2.gz	STVOZUMPPXIIPH-UHFFFAOYSA-N	0	0	287.359	4.307	20	30		CIEDRN
C[C@@H](CC#N)N(C)C(=O)Nc1cccc(-c2ccccc2)c1	ZINC000353032005	533393339	/nfs/dbraw/zinc/39/33/39/533393339.db2.gz	HGAFBUXFRCOOOQ-AWEZNQCLSA-N	0	0	293.370	4.119	20	30		CIEDRN
C[C@@H](Nc1ccc(C#N)nc1)c1ccc2c(c1)CCCC2	ZINC000301560362	533552847	/nfs/dbraw/zinc/55/28/47/533552847.db2.gz	IGQDZHIYTSHMEM-CYBMUJFWSA-N	0	0	277.371	4.005	20	30		CIEDRN
Cc1[nH]nc(-c2ccccc2)c1NC(=O)[C@H]1[C@@H]2CCC[C@@H]21	ZINC000330137448	533656807	/nfs/dbraw/zinc/65/68/07/533656807.db2.gz	UWNKOBUAKZNZNQ-WDNDVIMCSA-N	0	0	281.359	4.019	20	30		CIEDRN
C[C@@H](Nc1cc(C#N)ccn1)c1ccc(C(F)(F)F)cc1	ZINC000341742395	130016257	/nfs/dbraw/zinc/01/62/57/130016257.db2.gz	JXLACLVFJHUSLI-SNVBAGLBSA-N	0	0	291.276	4.145	20	30		CIEDRN
CCCC[C@@H](CC)C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000005713369	170132109	/nfs/dbraw/zinc/13/21/09/170132109.db2.gz	NDTGYSYIHAEHKA-LLVKDONJSA-N	0	0	278.783	4.367	20	30		CIEDRN
CCCCc1ccc(C(=O)Nc2cccc(C#N)c2)cc1	ZINC000007956125	170309824	/nfs/dbraw/zinc/30/98/24/170309824.db2.gz	PXZGVWCXHYWKDZ-UHFFFAOYSA-N	0	0	278.355	4.153	20	30		CIEDRN
CCC[C@@H](Nc1ccc([N+](=O)[O-])cc1C#N)c1ccccc1	ZINC000008204909	170324295	/nfs/dbraw/zinc/32/42/95/170324295.db2.gz	SJEFWJRSASBHOY-MRXNPFEDSA-N	0	0	295.342	4.420	20	30		CIEDRN
CSc1ccc(/C=C/C(=O)c2cccc(O)c2)cc1	ZINC000008322410	170331133	/nfs/dbraw/zinc/33/11/33/170331133.db2.gz	YZVOJJFYKRXHPP-JXMROGBWSA-N	0	0	270.353	4.010	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)NC2CCCCC2)c1	ZINC000009824064	170386304	/nfs/dbraw/zinc/38/63/04/170386304.db2.gz	BNMGKGRGILINPZ-UHFFFAOYSA-N	0	0	288.391	4.096	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)/C=C/c2ccccc2)c1	ZINC000009823730	170386335	/nfs/dbraw/zinc/38/63/35/170386335.db2.gz	JDNCECBTRPXFLG-VAWYXSNFSA-N	0	0	293.366	4.293	20	30		CIEDRN
N#Cc1cccnc1Sc1ccc2ccccc2c1	ZINC000015171458	170658521	/nfs/dbraw/zinc/65/85/21/170658521.db2.gz	SMGGTQYHEDBYSZ-UHFFFAOYSA-N	0	0	262.337	4.258	20	30		CIEDRN
N#Cc1ccc(NC(=O)c2cc3ccccc3s2)cc1	ZINC000018115020	170742818	/nfs/dbraw/zinc/74/28/18/170742818.db2.gz	IUEDHHXCPYFQSB-UHFFFAOYSA-N	0	0	278.336	4.025	20	30		CIEDRN
N#Cc1ccc(CNc2cccc(C(F)(F)F)c2)cc1	ZINC000019905276	170916784	/nfs/dbraw/zinc/91/67/84/170916784.db2.gz	SWBFRDSBUQRMMO-UHFFFAOYSA-N	0	0	276.261	4.189	20	30		CIEDRN
C[C@@H](Nc1ccc(OC(F)F)cc1)c1ccc(C#N)cc1	ZINC000020096085	170995790	/nfs/dbraw/zinc/99/57/90/170995790.db2.gz	JQFYLKMALFADRT-LLVKDONJSA-N	0	0	288.297	4.333	20	30		CIEDRN
Cc1ccc(NCc2ccc(C#N)cc2F)c(Cl)c1	ZINC000020362974	171161383	/nfs/dbraw/zinc/16/13/83/171161383.db2.gz	WRUVINXYIBHLEW-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
CC(C)c1cccc(NCc2ccc(C#N)cc2F)c1	ZINC000020362958	171161756	/nfs/dbraw/zinc/16/17/56/171161756.db2.gz	CAGSVAVJOSCYQN-UHFFFAOYSA-N	0	0	268.335	4.433	20	30		CIEDRN
N#Cc1ccc(F)c(COc2cccc(C(F)(F)F)c2)c1	ZINC000020560126	171251401	/nfs/dbraw/zinc/25/14/01/171251401.db2.gz	TZVKWBBTDVQCKH-UHFFFAOYSA-N	0	0	295.235	4.295	20	30		CIEDRN
N#Cc1ccc(Sc2ccccc2Cl)c([N+](=O)[O-])c1	ZINC000020666591	171269674	/nfs/dbraw/zinc/26/96/74/171269674.db2.gz	FHEJPXQYZYRBOY-UHFFFAOYSA-N	0	0	290.731	4.271	20	30		CIEDRN
Cc1cc(C)c(CNc2ccc(C#N)cc2)c(C)c1	ZINC000021812754	171330011	/nfs/dbraw/zinc/33/00/11/171330011.db2.gz	ZTNPMUXPCOHRBS-UHFFFAOYSA-N	0	0	250.345	4.096	20	30		CIEDRN
COc1cccc(C(=O)/C=C\c2ccccc2Cl)c1	ZINC000033410921	171790956	/nfs/dbraw/zinc/79/09/56/171790956.db2.gz	ZEPQJEYAOQGWLD-KTKRTIGZSA-N	0	0	272.731	4.245	20	30		CIEDRN
Cc1cc(C)cc(OCCCOc2ccc(C#N)cc2)c1	ZINC000034652285	171847629	/nfs/dbraw/zinc/84/76/29/171847629.db2.gz	VFBCXAMQGSLYES-UHFFFAOYSA-N	0	0	281.355	4.023	20	30		CIEDRN
COc1ccc([C@@H](C)Nc2cccc(F)c2C#N)cc1F	ZINC000035137402	172004721	/nfs/dbraw/zinc/00/47/21/172004721.db2.gz	HBMGDUSJAXHRQS-SNVBAGLBSA-N	0	0	288.297	4.018	20	30		CIEDRN
N#Cc1ccc(F)c(CNc2cc(Cl)ccc2F)c1	ZINC000035284588	172102709	/nfs/dbraw/zinc/10/27/09/172102709.db2.gz	WDUNHVNSDPNUED-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
N#Cc1ccc(CSc2ccc(F)c(F)c2)cc1	ZINC000037374909	173164175	/nfs/dbraw/zinc/16/41/75/173164175.db2.gz	HWDAEUAOPNUMHT-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
CC(C)(C)c1ccc(NC(=O)c2cccc(CC#N)c2)cc1	ZINC000042194851	174655432	/nfs/dbraw/zinc/65/54/32/174655432.db2.gz	LANNBPSWKQWPBU-UHFFFAOYSA-N	0	0	292.382	4.302	20	30		CIEDRN
CC(C)c1ccccc1NC(=O)c1cccc(CC#N)c1	ZINC000042198354	174656429	/nfs/dbraw/zinc/65/64/29/174656429.db2.gz	HMNQLVCZLOYLDW-UHFFFAOYSA-N	0	0	278.355	4.128	20	30		CIEDRN
Cc1ccc([C@H](C)Nc2nc(C)cc(C)c2C#N)s1	ZINC000042291731	174675616	/nfs/dbraw/zinc/67/56/16/174675616.db2.gz	QTQBBTIEKKOZEH-LBPRGKRZSA-N	0	0	271.389	4.113	20	30		CIEDRN
CC(C)c1ccc(NC(=O)C2(C#N)CCCCC2)cc1	ZINC000044385236	175169587	/nfs/dbraw/zinc/16/95/87/175169587.db2.gz	YCMIZZGGGGPPRZ-UHFFFAOYSA-N	0	0	270.376	4.223	20	30		CIEDRN
C=CCCC(=O)Nc1nc(-c2ccc(C)s2)c(C)s1	ZINC000078416313	177339781	/nfs/dbraw/zinc/33/97/81/177339781.db2.gz	ADBQNJLSOSDOAF-UHFFFAOYSA-N	0	0	292.429	4.393	20	30		CIEDRN
Cc1c(CNc2nccc(C)c2C#N)oc2ccc(F)cc12	ZINC000343442152	224750147	/nfs/dbraw/zinc/75/01/47/224750147.db2.gz	SHFHLHGTAGVNFV-UHFFFAOYSA-N	0	0	295.317	4.068	20	30		CIEDRN
N#C[C@@H]1CC[C@H](Nc2ccc3nc(C(F)F)sc3c2)C1	ZINC000334583054	225017287	/nfs/dbraw/zinc/01/72/87/225017287.db2.gz	RDIAXRAXKDLORY-BDAKNGLRSA-N	0	0	293.342	4.338	20	30		CIEDRN
N#CC1(CSCc2cc(-c3ccc(F)cc3)no2)CC1	ZINC000344469891	225068131	/nfs/dbraw/zinc/06/81/31/225068131.db2.gz	UBUQKQZKIKJOER-UHFFFAOYSA-N	0	0	288.347	4.018	20	30		CIEDRN
Cc1cc(C(=O)CS[C@@H](C)c2ccc(C#N)cc2)c(C)[nH]1	ZINC000118446568	225087383	/nfs/dbraw/zinc/08/73/83/225087383.db2.gz	MMDXLTCDFHROAR-ZDUSSCGKSA-N	0	0	298.411	4.180	20	30		CIEDRN
C[C@H](SCc1ccc(F)cn1)c1cccc(C#N)c1	ZINC000344900745	225195470	/nfs/dbraw/zinc/19/54/70/225195470.db2.gz	MOQYQDXFOFFAKN-NSHDSACASA-N	0	0	272.348	4.087	20	30		CIEDRN
N#CC1(CSCc2cc(Cl)ccc2F)CC1	ZINC000344863402	225205769	/nfs/dbraw/zinc/20/57/69/225205769.db2.gz	QRDKRAVBLJSMGT-UHFFFAOYSA-N	0	0	255.745	4.016	20	30		CIEDRN
N#CC1(CSc2cccc3cccnc32)CCC1	ZINC000334660764	225266085	/nfs/dbraw/zinc/26/60/85/225266085.db2.gz	AAPLZIQEXVWRLE-UHFFFAOYSA-N	0	0	254.358	4.021	20	30		CIEDRN
N#Cc1cccc(S[C@H]2CCc3ccc(F)cc32)c1	ZINC000468640197	225998295	/nfs/dbraw/zinc/99/82/95/225998295.db2.gz	VRUZEZLDNSKKOF-INIZCTEOSA-N	0	0	269.344	4.477	20	30		CIEDRN
N#Cc1cnccc1/C=C/c1csc2ccccc12	ZINC000347417790	226152311	/nfs/dbraw/zinc/15/23/11/226152311.db2.gz	AHEHGBSXOWIBNQ-AATRIKPKSA-N	0	0	262.337	4.338	20	30		CIEDRN
Cc1ccc(NC(=O)N(C)[C@@H](C)c2cccc(C#N)c2)s1	ZINC000335297336	226238042	/nfs/dbraw/zinc/23/80/42/226238042.db2.gz	BVASLPFIQXRHDT-LBPRGKRZSA-N	0	0	299.399	4.153	20	30		CIEDRN
Cc1cc(C)c(NCCCC2(C#N)CCOCC2)c(C)c1	ZINC000347857906	226385526	/nfs/dbraw/zinc/38/55/26/226385526.db2.gz	GMCHJAVGJFLJMG-UHFFFAOYSA-N	0	0	286.419	4.124	20	30		CIEDRN
C=CCCC1(c2nc(-c3ccc(C)c(OC)c3)no2)CC1	ZINC000575160481	335073917	/nfs/dbraw/zinc/07/39/17/335073917.db2.gz	GKTLOTGHVUPUIB-UHFFFAOYSA-N	0	0	284.359	4.051	20	30		CIEDRN
C=C(C)CN(C)C(=O)Nc1ccc(Cl)c(Cl)c1	ZINC000180017070	260087220	/nfs/dbraw/zinc/08/72/20/260087220.db2.gz	VDZXQGYWXMNMEC-UHFFFAOYSA-N	0	0	273.163	4.033	20	30		CIEDRN
C[C@@H]1CC(=O)CC[C@H]1C(=O)Nc1ncc(C(C)(C)C)s1	ZINC000329000831	227252005	/nfs/dbraw/zinc/25/20/05/227252005.db2.gz	VUAKKEUIRSFZOK-MWLCHTKSSA-N	0	0	294.420	4.034	20	30		CIEDRN
Cc1nc(CCNC(=O)[C@H](C)CC2CCCCC2)c(C)o1	ZINC000329026189	227264043	/nfs/dbraw/zinc/26/40/43/227264043.db2.gz	OARQLARAFIDRPE-GFCCVEGCSA-N	0	0	292.423	4.397	20	30		CIEDRN
Cc1nnc(NC(=O)[C@@H]2CCC[C@@H]3CCCC[C@H]23)s1	ZINC000329037315	227267345	/nfs/dbraw/zinc/26/73/45/227267345.db2.gz	ZFBSUPSFCJHDAY-SDDRHHMPSA-N	0	0	279.409	4.041	20	30		CIEDRN
N#CC1(NC(=O)[C@@H]2CCC[C@@H]3CCCC[C@H]23)CCCC1	ZINC000329072247	227282738	/nfs/dbraw/zinc/28/27/38/227282738.db2.gz	ODVSMEQXOPMDGF-SOUVJXGZSA-N	0	0	274.408	4.386	20	30		CIEDRN
C[C@H](NC(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1ccon1	ZINC000329136755	227319492	/nfs/dbraw/zinc/31/94/92/227319492.db2.gz	CYPPWCPKEXVUGR-IGQOVBAYSA-N	0	0	276.380	4.299	20	30		CIEDRN
C[C@H](NC(=O)[C@@H]1CC[C@@H]2CCCC[C@H]2C1)c1ccon1	ZINC000329136757	227320856	/nfs/dbraw/zinc/32/08/56/227320856.db2.gz	CYPPWCPKEXVUGR-XDQVBPFNSA-N	0	0	276.380	4.299	20	30		CIEDRN
Cc1nnc(NC(=O)C[C@@H](C)C2CCCCC2)n1C1CC1	ZINC000329153240	227329111	/nfs/dbraw/zinc/32/91/11/227329111.db2.gz	UDGWEKSKLBWWEB-LLVKDONJSA-N	0	0	290.411	4.116	20	30		CIEDRN
Cc1ccc(NC(=O)[C@@H]2CCC(=O)[C@@H](C)C2)c2cccnc12	ZINC000329153580	227329372	/nfs/dbraw/zinc/32/93/72/227329372.db2.gz	AFLXWFQYLNQTMU-QWHCGFSZSA-N	0	0	296.370	4.137	20	30		CIEDRN
Cc1ccc(NC(=O)[C@H]2CCC(=O)[C@H](C)C2)c2cccnc12	ZINC000329153579	227329778	/nfs/dbraw/zinc/32/97/78/227329778.db2.gz	AFLXWFQYLNQTMU-OLZOCXBDSA-N	0	0	296.370	4.137	20	30		CIEDRN
C[C@@H](CC(C)(C)c1ccccc1)Nc1ncccc1C#N	ZINC000301132711	227459183	/nfs/dbraw/zinc/45/91/83/227459183.db2.gz	XGCSYPZQBFUJAY-AWEZNQCLSA-N	0	0	279.387	4.122	20	30		CIEDRN
N#Cc1nc(NCCc2cc3ccccc3o2)ccc1Cl	ZINC000301390437	227527115	/nfs/dbraw/zinc/52/71/15/227527115.db2.gz	ZAGAMUSQNZCLQO-UHFFFAOYSA-N	0	0	297.745	4.007	20	30		CIEDRN
N#CCC[C@H](Nc1ncnc2ccccc21)c1ccccc1	ZINC000301766634	227669473	/nfs/dbraw/zinc/66/94/73/227669473.db2.gz	DCQAHTBVDFVEKT-INIZCTEOSA-N	0	0	288.354	4.087	20	30		CIEDRN
Cc1ccccc1CNc1ccc2cc(C#N)ccc2n1	ZINC000301836386	227697777	/nfs/dbraw/zinc/69/77/77/227697777.db2.gz	XGUYNUKJUTXVBN-UHFFFAOYSA-N	0	0	273.339	4.027	20	30		CIEDRN
N#Cc1ccc(CC(=O)N[C@@H]2CC[C@@H]3CCC[C@H]3C2)cc1	ZINC000329650901	227766382	/nfs/dbraw/zinc/76/63/82/227766382.db2.gz	KBTSCSFIQUELRV-YESZJQIVSA-N	0	0	282.387	4.026	20	30		CIEDRN
N#Cc1cccc(Nc2ccc(OC3CCCC3)cc2)n1	ZINC000301842738	227704020	/nfs/dbraw/zinc/70/40/20/227704020.db2.gz	KBEKSLWEQDJQBT-UHFFFAOYSA-N	0	0	279.343	4.018	20	30		CIEDRN
Cc1nnccc1NC(=O)C[C@@H]1C[C@@H](C)CC(C)(C)C1	ZINC000329662704	227814035	/nfs/dbraw/zinc/81/40/35/227814035.db2.gz	JFJZHDNTHYZWRW-YPMHNXCESA-N	0	0	275.396	4.226	20	30		CIEDRN
O=C(Cc1noc2ccccc21)N[C@@H]1CC[C@@H]2CCC[C@H]2C1	ZINC000329674892	227836497	/nfs/dbraw/zinc/83/64/97/227836497.db2.gz	UDDVDBURKPEKTQ-MELADBBJSA-N	0	0	298.386	4.296	20	30		CIEDRN
N#Cc1ccc(Oc2cccc(NC(=O)C3=CCC3)c2)cc1	ZINC000355525216	227873690	/nfs/dbraw/zinc/87/36/90/227873690.db2.gz	MMGUINFXROCVDH-UHFFFAOYSA-N	0	0	290.322	4.009	20	30		CIEDRN
Cc1ncc(NC(=O)C[C@@H]2CC[C@H](C)C2)c(C2CC2)n1	ZINC000329809990	227955204	/nfs/dbraw/zinc/95/52/04/227955204.db2.gz	QLZZXNIJTBFYLS-CMPLNLGQSA-N	0	0	273.380	4.077	20	30		CIEDRN
Cc1nnc([C@H](C)NC(=O)C[C@@H](C)C2CCCCC2)s1	ZINC000329861623	227969208	/nfs/dbraw/zinc/96/92/08/227969208.db2.gz	XZLGYQDOIQSZBD-MNOVXSKESA-N	0	0	295.452	4.471	20	30		CIEDRN
O=C(Nc1cnc(-c2ccccc2)nc1)[C@@H]1CC12CCCC2	ZINC000329965889	228000191	/nfs/dbraw/zinc/00/01/91/228000191.db2.gz	RMKZJSBQDRAZPR-HNNXBMFYSA-N	0	0	293.370	4.312	20	30		CIEDRN
N#CCCN(Cc1ccc(Cl)c(Cl)c1)CC1CC1	ZINC000353420556	228098916	/nfs/dbraw/zinc/09/89/16/228098916.db2.gz	SCFAJBJUCIOVOP-UHFFFAOYSA-N	0	0	283.202	4.119	20	30		CIEDRN
N#CCc1ccc(NCc2cc3cc(F)ccc3o2)cc1	ZINC000353450231	228104858	/nfs/dbraw/zinc/10/48/58/228104858.db2.gz	KNOZFAXWKBWXQB-UHFFFAOYSA-N	0	0	280.302	4.250	20	30		CIEDRN
Cc1oc(C#N)cc1-c1nc(C2C[C@H](C)C[C@@H](C)C2)no1	ZINC000331573579	228112936	/nfs/dbraw/zinc/11/29/36/228112936.db2.gz	MGNJPIIWAUCDNO-NXEZZACHSA-N	0	0	285.347	4.049	20	30		CIEDRN
N#C[C@@H]1CCC[C@H]1NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1	ZINC000330227655	228072543	/nfs/dbraw/zinc/07/25/43/228072543.db2.gz	PIXIMWTZOGSYNK-LNFKQOIKSA-N	0	0	294.807	4.154	20	30		CIEDRN
Cc1ccccc1NC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000353311174	228084231	/nfs/dbraw/zinc/08/42/31/228084231.db2.gz	IJTJDBWNYILTNR-MRXNPFEDSA-N	0	0	278.355	4.021	20	30		CIEDRN
Cc1ccc(NC(=O)C[C@H](CC#N)c2ccccc2)cc1F	ZINC000353354129	228089727	/nfs/dbraw/zinc/08/97/27/228089727.db2.gz	QFGXDULBTRDLER-HNNXBMFYSA-N	0	0	296.345	4.160	20	30		CIEDRN
Cc1ccc(F)cc1NC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000353356599	228089971	/nfs/dbraw/zinc/08/99/71/228089971.db2.gz	UMWCKVKQNAIKKP-OAHLLOKOSA-N	0	0	296.345	4.160	20	30		CIEDRN
C[C@@H]1CCC[C@H](NC(=O)C[C@@H](CC#N)c2ccccc2)CC1	ZINC000331999075	228142776	/nfs/dbraw/zinc/14/27/76/228142776.db2.gz	NQGVJADTOOUZSD-NXHRZFHOSA-N	0	0	298.430	4.159	20	30		CIEDRN
N#C[C@@]1(C(=O)Nc2cccc(C3CCC3)c2)CC12CCCC2	ZINC000333113791	228190349	/nfs/dbraw/zinc/19/03/49/228190349.db2.gz	SRKYBPJEVLXFCG-LJQANCHMSA-N	0	0	294.398	4.367	20	30		CIEDRN
N#CCCC[C@H](NC(=O)C1=CCCCC1)c1ccccc1	ZINC000352193878	228195066	/nfs/dbraw/zinc/19/50/66/228195066.db2.gz	URLCYOPAIKJBKL-KRWDZBQOSA-N	0	0	282.387	4.038	20	30		CIEDRN
N#CCCC[C@H](NC(=O)[C@H]1CC12CCCC2)c1ccccc1	ZINC000352207159	228199251	/nfs/dbraw/zinc/19/92/51/228199251.db2.gz	ULPXLUQSPXMQRF-SJORKVTESA-N	0	0	296.414	4.118	20	30		CIEDRN
N#CCCC[C@H](NC(=O)C[C@@H]1C=CCCC1)c1ccccc1	ZINC000352216373	228200610	/nfs/dbraw/zinc/20/06/10/228200610.db2.gz	HKKXTIVIBUETIN-AEFFLSMTSA-N	0	0	296.414	4.284	20	30		CIEDRN
N#CCCC[C@@H](NC(=O)CCC1CCC1)c1ccccc1	ZINC000352224909	228201355	/nfs/dbraw/zinc/20/13/55/228201355.db2.gz	FPLDMYZTXDVVBS-QGZVFWFLSA-N	0	0	284.403	4.118	20	30		CIEDRN
N#C[C@]1(c2nc(-c3ccc(Cl)cc3)no2)CC12CCCC2	ZINC000333852348	228217141	/nfs/dbraw/zinc/21/71/41/228217141.db2.gz	PSQFTDGHROJLSH-INIZCTEOSA-N	0	0	299.761	4.115	20	30		CIEDRN
Cc1nc2ccc(NC3CCC(C)(C#N)CC3)cc2o1	ZINC000336224574	228217583	/nfs/dbraw/zinc/21/75/83/228217583.db2.gz	MQPQZVZMFSEWHT-UHFFFAOYSA-N	0	0	269.348	4.021	20	30		CIEDRN
Cc1ccc(Cl)cc1NC(=O)[C@@]1(C#N)CC12CCCC2	ZINC000336236700	228219080	/nfs/dbraw/zinc/21/90/80/228219080.db2.gz	ULHJAUUTDXWIAS-INIZCTEOSA-N	0	0	288.778	4.061	20	30		CIEDRN
C[C@H]1CCC[C@](C#N)(NC(=O)c2cccc3ccccc32)C1	ZINC000116806308	260005803	/nfs/dbraw/zinc/00/58/03/260005803.db2.gz	JWAIRWAXCIZMPF-LIRRHRJNSA-N	0	0	292.382	4.042	20	30		CIEDRN
C[C@@H]1CCC[C@](C#N)(NC(=O)c2cccc3ccccc32)C1	ZINC000116806307	260005821	/nfs/dbraw/zinc/00/58/21/260005821.db2.gz	JWAIRWAXCIZMPF-KUHUBIRLSA-N	0	0	292.382	4.042	20	30		CIEDRN
C=CCC[C@@H](C(=O)N[C@@H](C)c1cccnc1)c1ccccc1	ZINC000187479732	260038710	/nfs/dbraw/zinc/03/87/10/260038710.db2.gz	JBTWFURTRSFOAZ-MAUKXSAKSA-N	0	0	294.398	4.009	20	30		CIEDRN
CC#CCCCC(=O)Nc1cc(Cl)ccc1OC(C)C	ZINC000521323472	260044902	/nfs/dbraw/zinc/04/49/02/260044902.db2.gz	UEIHYZVYQRDZDB-UHFFFAOYSA-N	0	0	293.794	4.259	20	30		CIEDRN
CCC[C@@H](C(=O)N(Cc1ccc(C#N)cc1)C1CC1)C(C)C	ZINC000179451029	260048817	/nfs/dbraw/zinc/04/88/17/260048817.db2.gz	TYBDBUYDGDADEG-GOSISDBHSA-N	0	0	298.430	4.122	20	30		CIEDRN
CCCCCCCCC(=O)N1CCC[C@H]1c1cc(C)on1	ZINC000363332331	260058619	/nfs/dbraw/zinc/05/86/19/260058619.db2.gz	WYXMVPXMJLLMGI-INIZCTEOSA-N	0	0	292.423	4.397	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC(c2ccsc2)CC1	ZINC000187840501	260061465	/nfs/dbraw/zinc/06/14/65/260061465.db2.gz	ZPGPTRDHKQREKP-CYBMUJFWSA-N	0	0	277.433	4.056	20	30		CIEDRN
C=CCCCC(=O)Nc1cccc2oc(C(F)(F)F)nc21	ZINC000179943927	260081306	/nfs/dbraw/zinc/08/13/06/260081306.db2.gz	RTYLHLDZGLFQJF-UHFFFAOYSA-N	0	0	298.264	4.141	20	30		CIEDRN
N#Cc1ccc(CN2CCC[C@@H]2c2ccc(Cl)cc2)o1	ZINC000180148441	260094782	/nfs/dbraw/zinc/09/47/82/260094782.db2.gz	GHBOADGFRRNLEK-MRXNPFEDSA-N	0	0	286.762	4.142	20	30		CIEDRN
C=C(C)CN(C)C(=O)[C@@H](CC)c1cccc(C(F)(F)F)c1	ZINC000180448979	260102520	/nfs/dbraw/zinc/10/25/20/260102520.db2.gz	HLEBMIBMPWEYMG-AWEZNQCLSA-N	0	0	299.336	4.234	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1oc2c(c1C)c(C)ccc2C	ZINC000180460733	260102793	/nfs/dbraw/zinc/10/27/93/260102793.db2.gz	SRONOTCRFOLXCC-UHFFFAOYSA-N	0	0	271.360	4.006	20	30		CIEDRN
N#Cc1ccc(OC[C@@H]2CCC(F)(F)C2)cc1Cl	ZINC000306034416	260114230	/nfs/dbraw/zinc/11/42/30/260114230.db2.gz	SDLXCHNWAWWYEM-SECBINFHSA-N	0	0	271.694	4.026	20	30		CIEDRN
C=CCCCSCC(=O)Nc1c(CC)cccc1CC	ZINC000117944496	260117507	/nfs/dbraw/zinc/11/75/07/260117507.db2.gz	NJNCJVDLACIYCQ-UHFFFAOYSA-N	0	0	291.460	4.449	20	30		CIEDRN
N#CCc1ccc(NC2CCC(C(F)(F)F)CC2)cc1	ZINC000068634894	260144925	/nfs/dbraw/zinc/14/49/25/260144925.db2.gz	FLLOOFXXQZKQDM-UHFFFAOYSA-N	0	0	282.309	4.286	20	30		CIEDRN
N#Cc1ccc(N[C@H]2CC=CCC2)cc1C(F)(F)F	ZINC000080120304	260178201	/nfs/dbraw/zinc/17/82/01/260178201.db2.gz	NJMUXTMDTKGAGD-NSHDSACASA-N	0	0	266.266	4.098	20	30		CIEDRN
N#Cc1ccccc1C[S@](=O)c1ccc2ccccc2c1	ZINC000084265120	260190989	/nfs/dbraw/zinc/19/09/89/260190989.db2.gz	GLWIWPZFCIQSMA-OAQYLSRUSA-N	0	0	291.375	4.019	20	30		CIEDRN
CC(C)(C#N)CCCNc1ccccc1OC(F)F	ZINC000087597268	260191844	/nfs/dbraw/zinc/19/18/44/260191844.db2.gz	VWGOSODIZXDJFO-UHFFFAOYSA-N	0	0	268.307	4.030	20	30		CIEDRN
Cc1ccc(NCCCC(C)(C)C#N)cc1Cl	ZINC000087596944	260191895	/nfs/dbraw/zinc/19/18/95/260191895.db2.gz	PPINLFIEBMEXIM-UHFFFAOYSA-N	0	0	250.773	4.390	20	30		CIEDRN
Cc1ccc2cccc(OCCCC(C)(C)C#N)c2n1	ZINC000087609002	260215350	/nfs/dbraw/zinc/21/53/50/260215350.db2.gz	DOVYZMGLIMMHTR-UHFFFAOYSA-N	0	0	268.360	4.252	20	30		CIEDRN
CC(C)(C#N)CCCOc1c(F)c(F)c(F)c(F)c1F	ZINC000087609006	260215551	/nfs/dbraw/zinc/21/55/51/260215551.db2.gz	GNCZJZVULCJNGJ-UHFFFAOYSA-N	0	0	293.235	4.091	20	30		CIEDRN
N#Cc1ccc(SCc2cccc(F)c2)c(F)c1	ZINC000525503729	260217576	/nfs/dbraw/zinc/21/75/76/260217576.db2.gz	UWDZFIMSLRGTFU-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
CC(C)(C#N)C(=O)Nc1ccc(SC2CCCC2)cc1	ZINC000055279489	260220428	/nfs/dbraw/zinc/22/04/28/260220428.db2.gz	NULFPJZHZULNBO-UHFFFAOYSA-N	0	0	288.416	4.210	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc3cc[nH]c(=O)c3c2)CCCC1	ZINC000516922324	260281974	/nfs/dbraw/zinc/28/19/74/260281974.db2.gz	VWWHAYSXDVTXBU-UHFFFAOYSA-N	0	0	296.370	4.015	20	30		CIEDRN
C[C@H](CCCC(F)(F)F)Nc1cccc(CC#N)c1	ZINC000313404941	260291293	/nfs/dbraw/zinc/29/12/93/260291293.db2.gz	AHIQKSYDDZXARZ-LLVKDONJSA-N	0	0	270.298	4.286	20	30		CIEDRN
CC1(C)Cc2cccc(CNc3cccc(CC#N)c3)c2O1	ZINC000313409520	260291931	/nfs/dbraw/zinc/29/19/31/260291931.db2.gz	LLLOSBJTEMEUTH-UHFFFAOYSA-N	0	0	292.382	4.078	20	30		CIEDRN
CC(C)(C)c1nc(CNc2cccc(CC#N)c2)cs1	ZINC000313433712	260292856	/nfs/dbraw/zinc/29/28/56/260292856.db2.gz	RREIGUBWTOFXEX-UHFFFAOYSA-N	0	0	285.416	4.119	20	30		CIEDRN
Cc1cc(CNc2cccc(CC#N)c2)c(C)s1	ZINC000313455342	260295534	/nfs/dbraw/zinc/29/55/34/260295534.db2.gz	XFHZGEUVHSWENK-UHFFFAOYSA-N	0	0	256.374	4.043	20	30		CIEDRN
N#CCc1cccc(NCc2ccc(C3CC3)cc2)c1	ZINC000313485758	260298297	/nfs/dbraw/zinc/29/82/97/260298297.db2.gz	XVQJBSQXYNOPEW-UHFFFAOYSA-N	0	0	262.356	4.242	20	30		CIEDRN
N#Cc1cc([N+](=O)[O-])ccc1Sc1ccc2c(c1)CCC2	ZINC000008203566	260322783	/nfs/dbraw/zinc/32/27/83/260322783.db2.gz	SYVFLDJHDAATPT-UHFFFAOYSA-N	0	0	296.351	4.106	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N[C@H]1CCc2sc(Cl)cc21	ZINC000518021969	260335461	/nfs/dbraw/zinc/33/54/61/260335461.db2.gz	GATWRYIZAUUYGD-KOLCDFICSA-N	0	0	298.839	4.043	20	30		CIEDRN
N#Cc1cccc(N[C@H]2CCCc3sccc32)c1[N+](=O)[O-]	ZINC000125905923	260344948	/nfs/dbraw/zinc/34/49/48/260344948.db2.gz	QCMIEHSSWJOTGH-LBPRGKRZSA-N	0	0	299.355	4.017	20	30		CIEDRN
CC(C)c1ccc(C[S@](=O)CCCC(C)(C)C#N)cc1	ZINC000083080124	260346207	/nfs/dbraw/zinc/34/62/07/260346207.db2.gz	QOKARMMYABZAPY-FQEVSTJZSA-N	0	0	291.460	4.389	20	30		CIEDRN
N#Cc1cc(F)ccc1NCc1ccc(C(F)F)cc1	ZINC000126213531	260346488	/nfs/dbraw/zinc/34/64/88/260346488.db2.gz	NSBZJGIGEXDECT-UHFFFAOYSA-N	0	0	276.261	4.247	20	30		CIEDRN
CC(C)(C#N)CCCNc1cccc(Br)c1	ZINC000083640740	260353924	/nfs/dbraw/zinc/35/39/24/260353924.db2.gz	OFWJJJXONYUZRG-UHFFFAOYSA-N	0	0	281.197	4.191	20	30		CIEDRN
COc1ccc(CNc2c(C)cccc2Cl)cc1C#N	ZINC000090526309	260367062	/nfs/dbraw/zinc/36/70/62/260367062.db2.gz	OLBFHEXTPMXVNO-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
Cc1cccc(SCc2cn3ccccc3c2C#N)c1	ZINC000520018052	260373163	/nfs/dbraw/zinc/37/31/63/260373163.db2.gz	ZWYUBRDJTCKLFV-UHFFFAOYSA-N	0	0	278.380	4.412	20	30		CIEDRN
CCCCCc1ccc(NC(=O)N(C)[C@@H](C)CC#N)cc1	ZINC000086281094	260387695	/nfs/dbraw/zinc/38/76/95/260387695.db2.gz	OXWLXXIXFUMTNC-AWEZNQCLSA-N	0	0	287.407	4.185	20	30		CIEDRN
C=CC1CCN(C(=O)c2cccc(OC3CCCC3)c2)CC1	ZINC000518379443	260392530	/nfs/dbraw/zinc/39/25/30/260392530.db2.gz	UNSZYUSFFJWNRG-UHFFFAOYSA-N	0	0	299.414	4.046	20	30		CIEDRN
CC(=O)c1ccc(C#N)cc1N(C)Cc1ccccc1Cl	ZINC000130591668	260397430	/nfs/dbraw/zinc/39/74/30/260397430.db2.gz	FJZBBPBRKOIXEL-UHFFFAOYSA-N	0	0	298.773	4.051	20	30		CIEDRN
CC(C)(C#N)CCCSc1ccc(N)cc1Cl	ZINC000087599416	260412024	/nfs/dbraw/zinc/41/20/24/260412024.db2.gz	ASMQSPFLUMRUSV-UHFFFAOYSA-N	0	0	268.813	4.344	20	30		CIEDRN
C=CCCCN(C)C(=O)[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000409715745	260426173	/nfs/dbraw/zinc/42/61/73/260426173.db2.gz	INGBSPMJDWMAON-GFCCVEGCSA-N	0	0	299.336	4.234	20	30		CIEDRN
CC(=O)c1cc(N[C@@H](C#N)C2CCCCC2)ccc1C	ZINC000518558470	260452908	/nfs/dbraw/zinc/45/29/08/260452908.db2.gz	UKGBYFVTQDZWOJ-KRWDZBQOSA-N	0	0	270.376	4.082	20	30		CIEDRN
Cc1cccc(Cl)c1NCc1cccc(C#N)c1	ZINC000090523260	260461738	/nfs/dbraw/zinc/46/17/38/260461738.db2.gz	SDOUZZHXKQXHOT-UHFFFAOYSA-N	0	0	256.736	4.132	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)C[C@H](CC)c1ccc(C)cc1	ZINC000410121788	260463885	/nfs/dbraw/zinc/46/38/85/260463885.db2.gz	AJVCZOLOORNNSA-RDJZCZTQSA-N	0	0	273.420	4.350	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)CCSc1ccccc1Cl	ZINC000410143549	260465609	/nfs/dbraw/zinc/46/56/09/260465609.db2.gz	RELLNDMWAXZRDU-GFCCVEGCSA-N	0	0	297.851	4.293	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1cncc(-c2cccc(C)c2)c1	ZINC000410150011	260467449	/nfs/dbraw/zinc/46/74/49/260467449.db2.gz	YXDFALMSFDWSCN-GOSISDBHSA-N	0	0	294.398	4.142	20	30		CIEDRN
Cc1cccc2sc(NCc3ccc(C#N)cc3)nc21	ZINC000091945862	260468571	/nfs/dbraw/zinc/46/85/71/260468571.db2.gz	SXWKPFVEMFDORQ-UHFFFAOYSA-N	0	0	279.368	4.089	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H](C)c1ccc(SC)cc1	ZINC000410233636	260474031	/nfs/dbraw/zinc/47/40/31/260474031.db2.gz	KBKSRTKWFCQIMM-BLLLJJGKSA-N	0	0	277.433	4.188	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)[C@H]1[C@@H]2CCCC[C@@H]21	ZINC000410351514	260488348	/nfs/dbraw/zinc/48/83/48/260488348.db2.gz	FTDUIYRXIULBSD-QLPKVWCKSA-N	0	0	269.388	4.180	20	30		CIEDRN
N#Cc1cscc1C(=O)N(c1ccccc1)C1CCCC1	ZINC000410448164	260529032	/nfs/dbraw/zinc/52/90/32/260529032.db2.gz	REBFFJAMGUYUJD-UHFFFAOYSA-N	0	0	296.395	4.209	20	30		CIEDRN
C=CC(C)(C)C(=O)Nc1ccccc1SC[C@@H](C)C#N	ZINC000410460457	260529554	/nfs/dbraw/zinc/52/95/54/260529554.db2.gz	VTUVWYKWVSPENT-LBPRGKRZSA-N	0	0	288.416	4.089	20	30		CIEDRN
C=CCC1(C(=O)N2CCc3ccccc3[C@@H]2C)CCCC1	ZINC000410550660	260534370	/nfs/dbraw/zinc/53/43/70/260534370.db2.gz	YWYCYPQXEUJAQM-HNNXBMFYSA-N	0	0	283.415	4.269	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N(C)C/C(C)=C/c1ccccc1	ZINC000427225695	260571118	/nfs/dbraw/zinc/57/11/18/260571118.db2.gz	PQHSDVTUFVAYPM-FDPSAONLSA-N	0	0	271.404	4.151	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N(C)C/C(C)=C/c1ccccc1	ZINC000427225693	260571174	/nfs/dbraw/zinc/57/11/74/260571174.db2.gz	PQHSDVTUFVAYPM-DUVHGLKDSA-N	0	0	271.404	4.151	20	30		CIEDRN
C=CCC[C@@H](Nc1cccc2c1OCC[C@@H]2OC)C1CC1	ZINC000448028681	260592285	/nfs/dbraw/zinc/59/22/85/260592285.db2.gz	OXZVRMHQSYUTPX-WBVHZDCISA-N	0	0	287.403	4.313	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1c(C)cccc1C(C)C	ZINC000116997098	260684151	/nfs/dbraw/zinc/68/41/51/260684151.db2.gz	RVWCLVYCBPYMKN-CYBMUJFWSA-N	0	0	260.381	4.205	20	30		CIEDRN
CCCNc1ccc(C#N)cc1NC(=O)C[C@@H]1C=CCCC1	ZINC000427469857	260745125	/nfs/dbraw/zinc/74/51/25/260745125.db2.gz	OLMMIOUGDVIGPO-CQSZACIVSA-N	0	0	297.402	4.065	20	30		CIEDRN
CC[C@@H](c1nnc(S[C@H](C#N)CC)o1)c1ccccc1	ZINC000127649757	260803019	/nfs/dbraw/zinc/80/30/19/260803019.db2.gz	DBOWSFRFRBIRBI-QWHCGFSZSA-N	0	0	287.388	4.006	20	30		CIEDRN
C=C(C)COc1cccc(NCc2nc(C)cs2)c1	ZINC000129265303	260834110	/nfs/dbraw/zinc/83/41/10/260834110.db2.gz	BDVZXTYNWWMWGS-UHFFFAOYSA-N	0	0	274.389	4.019	20	30		CIEDRN
C=CCC(C)(C)c1nc(-c2ccc(Cl)cc2OC)no1	ZINC000426600688	260881909	/nfs/dbraw/zinc/88/19/09/260881909.db2.gz	KWXMKJAOSRJHJY-UHFFFAOYSA-N	0	0	292.766	4.252	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N(C)Cc1cccc(C)c1C	ZINC000489851935	260934235	/nfs/dbraw/zinc/93/42/35/260934235.db2.gz	PUQOZMKHXSRGJK-OAHLLOKOSA-N	0	0	288.435	4.190	20	30		CIEDRN
N#CCCCC(=O)N1CCCC[C@H]1c1cccc(Cl)c1	ZINC000360455004	261062612	/nfs/dbraw/zinc/06/26/12/261062612.db2.gz	LNBGRPHHSWGZRS-HNNXBMFYSA-N	0	0	290.794	4.087	20	30		CIEDRN
CC(C)(c1ccc(NC(=O)CCCC#N)cc1)C(F)(F)F	ZINC000360457627	261063331	/nfs/dbraw/zinc/06/33/31/261063331.db2.gz	WJKUREOACGSPAF-UHFFFAOYSA-N	0	0	298.308	4.159	20	30		CIEDRN
C[C@H](C#N)CSc1ccccc1NCC1CCC1	ZINC000152722711	261068783	/nfs/dbraw/zinc/06/87/83/261068783.db2.gz	WOLZLTUSDWTWIF-GFCCVEGCSA-N	0	0	260.406	4.150	20	30		CIEDRN
Cc1cc(C(=O)N[C@@H](CCC#N)c2ccccc2)sc1C	ZINC000153200287	261074673	/nfs/dbraw/zinc/07/46/73/261074673.db2.gz	TYHGLFFLEGZPGK-HNNXBMFYSA-N	0	0	298.411	4.140	20	30		CIEDRN
Cc1ccc(C)c(C(=O)N[C@@H](CCC#N)c2ccccc2)c1	ZINC000153445038	261078163	/nfs/dbraw/zinc/07/81/63/261078163.db2.gz	HEYBJOVEJRMKAB-SFHVURJKSA-N	0	0	292.382	4.078	20	30		CIEDRN
N#CCC[C@H](NC(=O)CCC1CCCC1)c1ccccc1	ZINC000153500948	261079190	/nfs/dbraw/zinc/07/91/90/261079190.db2.gz	GSHGEYKMHHZVFL-KRWDZBQOSA-N	0	0	284.403	4.118	20	30		CIEDRN
Cc1cc(SC2CCCCC2)ccc1NC(=O)CC#N	ZINC000153703265	261081563	/nfs/dbraw/zinc/08/15/63/261081563.db2.gz	UAFMXVYYXODQLT-UHFFFAOYSA-N	0	0	288.416	4.272	20	30		CIEDRN
CC(C)(C#N)CCCNc1ccccc1SCCC#N	ZINC000153920795	261084993	/nfs/dbraw/zinc/08/49/93/261084993.db2.gz	QJGDHAJNGCVQLU-UHFFFAOYSA-N	0	0	287.432	4.434	20	30		CIEDRN
C=CCN(C(=O)N[C@@H]1C[C@H](C(C)C)c2ccccc21)C1CC1	ZINC000448285242	261089804	/nfs/dbraw/zinc/08/98/04/261089804.db2.gz	HYFIHGFEQRPLIE-QZTJIDSGSA-N	0	0	298.430	4.231	20	30		CIEDRN
CC(C)(C#N)CCCNc1ccccc1OCC(F)F	ZINC000154426932	261091613	/nfs/dbraw/zinc/09/16/13/261091613.db2.gz	VCFVKYZILKWXEK-UHFFFAOYSA-N	0	0	282.334	4.072	20	30		CIEDRN
CCN(C(=O)[C@@H]1CCCCC1(C)C)c1ccc(C#N)cc1	ZINC000448305523	261105511	/nfs/dbraw/zinc/10/55/11/261105511.db2.gz	BUPIJXPIQLXBES-INIZCTEOSA-N	0	0	284.403	4.128	20	30		CIEDRN
CCOCc1cccc(NC2CCC(C)(C#N)CC2)c1	ZINC000449054933	261133282	/nfs/dbraw/zinc/13/32/82/261133282.db2.gz	SHPQLXRKHHNPQP-UHFFFAOYSA-N	0	0	272.392	4.107	20	30		CIEDRN
C=CCCCNC(=O)N(CC=C)Cc1ccc(Cl)s1	ZINC000448384986	261136892	/nfs/dbraw/zinc/13/68/92/261136892.db2.gz	RWONTASBUXADIG-UHFFFAOYSA-N	0	0	298.839	4.065	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N1CCC(C(C)(C)C)CC1	ZINC000172152012	261152302	/nfs/dbraw/zinc/15/23/02/261152302.db2.gz	ODUGFWLAQCDDPV-UHFFFAOYSA-N	0	0	299.418	4.157	20	30		CIEDRN
CCC[C@@H]1C[C@H]1C(=O)N[C@@H](C#N)c1ccc(C(C)(C)C)cc1	ZINC000464398935	261174086	/nfs/dbraw/zinc/17/40/86/261174086.db2.gz	NAQXIRVARQUALA-OIISXLGYSA-N	0	0	298.430	4.101	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCC1(c2ccccc2)CCCC1	ZINC000464562012	261194330	/nfs/dbraw/zinc/19/43/30/261194330.db2.gz	YUOXOCXQDVYVFN-INIZCTEOSA-N	0	0	285.431	4.217	20	30		CIEDRN
N#Cc1c(F)cccc1C(=O)Nc1cccc(C2CCC2)c1	ZINC000462374130	261201282	/nfs/dbraw/zinc/20/12/82/261201282.db2.gz	CQZLEEYKRVUHPF-UHFFFAOYSA-N	0	0	294.329	4.217	20	30		CIEDRN
CSCCCCCNc1ccc(Cl)cc1C#N	ZINC000229570050	261202272	/nfs/dbraw/zinc/20/22/72/261202272.db2.gz	FOBCTCRLJMZJHA-UHFFFAOYSA-N	0	0	268.813	4.157	20	30		CIEDRN
CC(C)(CCC#N)CNc1cccc(-c2ncco2)c1	ZINC000160312834	261210900	/nfs/dbraw/zinc/21/09/00/261210900.db2.gz	KMGCITRZUJKUQA-UHFFFAOYSA-N	0	0	269.348	4.083	20	30		CIEDRN
Cc1cccc2c1[C@H](C)C[C@H]2CC(=O)N[C@@H](C#N)C(C)(C)C	ZINC000464712433	261215200	/nfs/dbraw/zinc/21/52/00/261215200.db2.gz	QIFKQWBROPQOFH-YCPHGPKFSA-N	0	0	298.430	4.030	20	30		CIEDRN
Cc1ccc(-c2nc(/C=C/c3ccc(C#N)cn3)co2)cc1	ZINC000175324547	261219827	/nfs/dbraw/zinc/21/98/27/261219827.db2.gz	BRNSJAGXDNXQPJ-CMDGGOBGSA-N	0	0	287.322	4.087	20	30		CIEDRN
N#Cc1c(F)cccc1N[C@@H]1CCO[C@@H](c2ccccc2)C1	ZINC000160685349	261222446	/nfs/dbraw/zinc/22/24/46/261222446.db2.gz	YKJVSJBLKVKNHG-RDTXWAMCSA-N	0	0	296.345	4.030	20	30		CIEDRN
CCc1cccc(NC(=O)c2cccc(SCC#N)c2)c1	ZINC000175505486	261228993	/nfs/dbraw/zinc/22/89/93/261228993.db2.gz	HAPZIQACXSEBMC-UHFFFAOYSA-N	0	0	296.395	4.117	20	30		CIEDRN
N#C[C@@H](Nc1ccc2c(c1)C(=O)CCC2)C1CCCCC1	ZINC000175514318	261231745	/nfs/dbraw/zinc/23/17/45/261231745.db2.gz	QNGVGIFZUJUHQK-QGZVFWFLSA-N	0	0	282.387	4.090	20	30		CIEDRN
C[C@@H](SCCCCC#N)c1c(F)cccc1F	ZINC000161556156	261251285	/nfs/dbraw/zinc/25/12/85/261251285.db2.gz	UIBQZXHICLFHLW-SNVBAGLBSA-N	0	0	255.333	4.453	20	30		CIEDRN
CCC1(CNC(=O)Nc2ccc(C(C)(C)C#N)cc2)CCC1	ZINC000175917401	261256196	/nfs/dbraw/zinc/25/61/96/261256196.db2.gz	GHCVMSQEHZYMTJ-UHFFFAOYSA-N	0	0	299.418	4.190	20	30		CIEDRN
Cc1ccc(C(=O)N(C)c2cc(Cl)ccc2C#N)c(C)c1	ZINC000176426255	261285333	/nfs/dbraw/zinc/28/53/33/261285333.db2.gz	CRIUJEZGAZVYLO-UHFFFAOYSA-N	0	0	298.773	4.105	20	30		CIEDRN
Cc1ccc(C(=O)N(CCC#N)CC(C)(C)C)cc1Cl	ZINC000104628258	261299123	/nfs/dbraw/zinc/29/91/23/261299123.db2.gz	JMYLYVCRHINJNA-UHFFFAOYSA-N	0	0	292.810	4.050	20	30		CIEDRN
N#Cc1cnc2ccccc2c1N1CC[C@@H](c2ccccc2)C1	ZINC000301107867	261330026	/nfs/dbraw/zinc/33/00/26/261330026.db2.gz	MDHZOSXCCDBILT-MRXNPFEDSA-N	0	0	299.377	4.100	20	30		CIEDRN
CO[C@@H](CNc1ccc(C#N)c(Cl)c1)c1ccccc1	ZINC000301340981	261332719	/nfs/dbraw/zinc/33/27/19/261332719.db2.gz	FQKBALZYWXGJFJ-INIZCTEOSA-N	0	0	286.762	4.011	20	30		CIEDRN
N#Cc1cccc(SCc2ccc3ccccc3n2)c1	ZINC000177113884	261332871	/nfs/dbraw/zinc/33/28/71/261332871.db2.gz	PKJGDGXZNNMUMI-UHFFFAOYSA-N	0	0	276.364	4.399	20	30		CIEDRN
Cc1ccccc1[C@@H](C)CC(=O)Nc1ccc(F)cc1C#N	ZINC000177578154	261363146	/nfs/dbraw/zinc/36/31/46/261363146.db2.gz	FLZDCQLLIABHMG-ZDUSSCGKSA-N	0	0	296.345	4.138	20	30		CIEDRN
Cc1ccccc1[C@H](C)CC(=O)Nc1ccc(F)cc1C#N	ZINC000177578167	261363343	/nfs/dbraw/zinc/36/33/43/261363343.db2.gz	FLZDCQLLIABHMG-CYBMUJFWSA-N	0	0	296.345	4.138	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000466360459	261394893	/nfs/dbraw/zinc/39/48/93/261394893.db2.gz	DTAFXIUJGKUMLR-XHDPSFHLSA-N	0	0	299.336	4.485	20	30		CIEDRN
N#CCCCOc1cccc(N[C@@H]2CCCc3occc32)c1	ZINC000178494087	261395051	/nfs/dbraw/zinc/39/50/51/261395051.db2.gz	YKNVJAWRXWFIHO-QGZVFWFLSA-N	0	0	296.370	4.452	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(C)[C@@H](c1ccccc1)C(C)C	ZINC000466367598	261395554	/nfs/dbraw/zinc/39/55/54/261395554.db2.gz	XBKABZUXUOIAIH-DLBZAZTESA-N	0	0	288.435	4.380	20	30		CIEDRN
CCSc1cccc(NC(=O)c2ccc(C#N)cc2C)c1	ZINC000178711280	261402747	/nfs/dbraw/zinc/40/27/47/261402747.db2.gz	JVOCUQIRFVNADI-UHFFFAOYSA-N	0	0	296.395	4.231	20	30		CIEDRN
CC(C)CCN(CCC#N)Cc1ncc(-c2ccccc2)o1	ZINC000173545042	261536283	/nfs/dbraw/zinc/53/62/83/261536283.db2.gz	CKDAMJMVBAYLRV-UHFFFAOYSA-N	0	0	297.402	4.103	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)CCC2CCC2)cc1	ZINC000175513548	261610956	/nfs/dbraw/zinc/61/09/56/261610956.db2.gz	RKMVOSFWFYABRT-UHFFFAOYSA-N	0	0	270.376	4.007	20	30		CIEDRN
C=CCCN(C)C(=O)N[C@H](c1ccccc1)C1CCCC1	ZINC000466979161	261619943	/nfs/dbraw/zinc/61/99/43/261619943.db2.gz	NQQAWRHJCPVNNO-QGZVFWFLSA-N	0	0	286.419	4.135	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cccc(C)c1Br	ZINC000188075379	261840699	/nfs/dbraw/zinc/84/06/99/261840699.db2.gz	GDKJFQXYYQFYRC-AWEZNQCLSA-N	0	0	296.208	4.298	20	30		CIEDRN
Cc1cc(C(F)(F)F)c(C#N)c(SCCCCC#N)n1	ZINC000182817924	261951378	/nfs/dbraw/zinc/95/13/78/261951378.db2.gz	LOOWUXKIGPWQPY-UHFFFAOYSA-N	0	0	299.321	4.066	20	30		CIEDRN
C/C(=C\C(C)(C)C)C(=O)N(Cc1ccc(C#N)cc1)C1CC1	ZINC000185167186	262044436	/nfs/dbraw/zinc/04/44/36/262044436.db2.gz	TXIOYHJIEOXPCH-SDNWHVSQSA-N	0	0	296.414	4.042	20	30		CIEDRN
N#C[C@H]1CCC[C@@H](Nc2ccccc2N2CCCCC2)C1	ZINC000185731563	262068825	/nfs/dbraw/zinc/06/88/25/262068825.db2.gz	PYIVUEXCKIOPJD-JKSUJKDBSA-N	0	0	283.419	4.171	20	30		CIEDRN
C=CCCCC(=O)Nc1cccnc1-c1csc(C)c1	ZINC000186894889	262114829	/nfs/dbraw/zinc/11/48/29/262114829.db2.gz	CEDQIIBKGRGAJI-UHFFFAOYSA-N	0	0	286.400	4.413	20	30		CIEDRN
CCCCCCCC(=O)N1CCC[C@@H]1c1csc(C)n1	ZINC000187016766	262120773	/nfs/dbraw/zinc/12/07/73/262120773.db2.gz	TVOKYJBZYHJABX-OAHLLOKOSA-N	0	0	294.464	4.476	20	30		CIEDRN
CC(C)c1ccc(/C=C\CC(=O)N(C)CC(C)(C)C#N)cc1	ZINC000497258888	262126608	/nfs/dbraw/zinc/12/66/08/262126608.db2.gz	BZNFTIHEOZKPOI-SREVYHEPSA-N	0	0	298.430	4.221	20	30		CIEDRN
CCc1ccccc1CNc1ccccc1O[C@@H](C)C#N	ZINC000187307831	262131743	/nfs/dbraw/zinc/13/17/43/262131743.db2.gz	HLIXTEMOIOJHIT-AWEZNQCLSA-N	0	0	280.371	4.152	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](c1ccccn1)C1CCCC1	ZINC000364071797	262136603	/nfs/dbraw/zinc/13/66/03/262136603.db2.gz	CTZJCWWENUNWRD-RHSMWYFYSA-N	0	0	286.419	4.031	20	30		CIEDRN
Cc1nc(S[C@@H](C)CCC#N)[nH]c1Cc1ccccc1	ZINC000188200075	262150674	/nfs/dbraw/zinc/15/06/74/262150674.db2.gz	LFCBEVDJOMOATR-LBPRGKRZSA-N	0	0	285.416	4.093	20	30		CIEDRN
C[C@H](CCC#N)Sc1nnc(-c2cc3ccccc3o2)o1	ZINC000188323065	262153962	/nfs/dbraw/zinc/15/39/62/262153962.db2.gz	FAXDHUOLWMLEDO-SNVBAGLBSA-N	0	0	299.355	4.267	20	30		CIEDRN
C[C@@H](CCC#N)Sc1nnc(-c2ccccc2Cl)o1	ZINC000188314432	262153974	/nfs/dbraw/zinc/15/39/74/262153974.db2.gz	SLEVYQDOTOIPOL-VIFPVBQESA-N	0	0	293.779	4.174	20	30		CIEDRN
CCCC[C@H](C)C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000500505161	262156832	/nfs/dbraw/zinc/15/68/32/262156832.db2.gz	WFGPHYORIBRSID-ZDUSSCGKSA-N	0	0	272.392	4.253	20	30		CIEDRN
C=C(C)CN(CC)C(=O)CCOc1ccc(C(C)C)cc1	ZINC000497490052	262169553	/nfs/dbraw/zinc/16/95/53/262169553.db2.gz	DRHQJZFLNBYTIW-UHFFFAOYSA-N	0	0	289.419	4.004	20	30		CIEDRN
CC(C)(C#N)c1ccccc1CSCCOCC(F)F	ZINC000190093475	262179043	/nfs/dbraw/zinc/17/90/43/262179043.db2.gz	LNYWYNHNQKCTFN-UHFFFAOYSA-N	0	0	299.386	4.003	20	30		CIEDRN
C=CCC1(C(=O)N2C[C@H](c3ccsc3)C[C@@H]2C)CCC1	ZINC000364202697	262183543	/nfs/dbraw/zinc/18/35/43/262183543.db2.gz	USDJEPWESBNHMK-DZGCQCFKSA-N	0	0	289.444	4.199	20	30		CIEDRN
CCCCCCCCC[S@@](=O)[C@@H](C)c1cnccn1	ZINC000190851907	262186531	/nfs/dbraw/zinc/18/65/31/262186531.db2.gz	LFANVXQHGLYKMJ-IFXJQAMLSA-N	0	0	282.453	4.037	20	30		CIEDRN
Cc1ccccc1-c1noc([C@H](C)SCCCC#N)n1	ZINC000190977461	262187644	/nfs/dbraw/zinc/18/76/44/262187644.db2.gz	QIKYMRKVVFHBGS-LBPRGKRZSA-N	0	0	287.388	4.143	20	30		CIEDRN
C[C@@H](Sc1ccc(C#N)cn1)c1ccc(F)cc1F	ZINC000497683191	262189451	/nfs/dbraw/zinc/18/94/51/262189451.db2.gz	LWIMPIBAKSHJPZ-SECBINFHSA-N	0	0	276.311	4.085	20	30		CIEDRN
N#Cc1ccc(SCc2ccc(OC(F)F)cc2)cc1	ZINC000497688091	262190057	/nfs/dbraw/zinc/19/00/57/262190057.db2.gz	ZCUFAGHUQGXMOJ-UHFFFAOYSA-N	0	0	291.322	4.452	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@H]1CCC(C)(C)c2ccccc21	ZINC000497687116	262190441	/nfs/dbraw/zinc/19/04/41/262190441.db2.gz	MQSMDMFWBWIIGR-INIZCTEOSA-N	0	0	286.419	4.017	20	30		CIEDRN
CC(F)(F)c1cccc(N[C@@H]2CCC[C@@H](C#N)C2)c1	ZINC000193322715	262220449	/nfs/dbraw/zinc/22/04/49/262220449.db2.gz	RJBMNLPXRYKNJF-DGCLKSJQSA-N	0	0	264.319	4.293	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1nsc2ccc(C)cc21	ZINC000497936328	262235805	/nfs/dbraw/zinc/23/58/05/262235805.db2.gz	GRSKXZVUDZVFEP-GFCCVEGCSA-N	0	0	288.416	4.079	20	30		CIEDRN
Cc1ccc(C)c([C@H](C)N(C)C(=O)c2sccc2C#N)c1	ZINC000497978886	262242981	/nfs/dbraw/zinc/24/29/81/262242981.db2.gz	AIVLUOGTURDEPT-ZDUSSCGKSA-N	0	0	298.411	4.070	20	30		CIEDRN
CC[C@H](CC#N)NCc1ccc(F)c(-c2cccs2)c1	ZINC000054183972	262259707	/nfs/dbraw/zinc/25/97/07/262259707.db2.gz	XCZNXZXFNKBJGF-CYBMUJFWSA-N	0	0	288.391	4.336	20	30		CIEDRN
C=CCC1(C(=O)NC[C@@H](C)Sc2ccccc2)CCC1	ZINC000188354098	262291258	/nfs/dbraw/zinc/29/12/58/262291258.db2.gz	UXKXGYMRBTYOII-CQSZACIVSA-N	0	0	289.444	4.030	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1cccc(F)c1C)c1ccccc1	ZINC000188377337	262293247	/nfs/dbraw/zinc/29/32/47/262293247.db2.gz	HOFVHPDOHCTTEF-HNNXBMFYSA-N	0	0	283.346	4.433	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CCC(C)(c2ccccc2)CC1	ZINC000188544568	262314871	/nfs/dbraw/zinc/31/48/71/262314871.db2.gz	BXCPTXUATHZXTP-GOSISDBHSA-N	0	0	285.431	4.169	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CC=C(c2cccc(C)c2)CC1	ZINC000188563684	262317619	/nfs/dbraw/zinc/31/76/19/262317619.db2.gz	QOMUJWBWVMZXED-LJQANCHMSA-N	0	0	283.415	4.213	20	30		CIEDRN
C[N@H+](Cc1cccc(C#N)c1)[C@H]1CCc2c1cccc2Cl	ZINC000488447066	262323246	/nfs/dbraw/zinc/32/32/46/262323246.db2.gz	UWNRDKOYSQZSMT-SFHVURJKSA-N	0	0	296.801	4.331	20	30		CIEDRN
C=C(C)CCc1noc(/C=C(\C)c2ccc(F)cc2)n1	ZINC000508631357	262333612	/nfs/dbraw/zinc/33/36/12/262333612.db2.gz	JWGRENDVLZAILT-ZRDIBKRKSA-N	0	0	272.323	4.278	20	30		CIEDRN
N#Cc1ccccc1NCc1nc(-c2ccccc2)cs1	ZINC000058000506	262350703	/nfs/dbraw/zinc/35/07/03/262350703.db2.gz	KOXDGPRVSNEPEF-UHFFFAOYSA-N	0	0	291.379	4.294	20	30		CIEDRN
C=CCCCSCC(=O)Nc1c(C)cc(C)cc1C	ZINC000117944847	262366505	/nfs/dbraw/zinc/36/65/05/262366505.db2.gz	ZDRFKYOLNJADRO-UHFFFAOYSA-N	0	0	277.433	4.250	20	30		CIEDRN
CC(C)CN(C(=O)[C@H](C)c1cccc(C#N)c1)C1CCCC1	ZINC000462244351	262384778	/nfs/dbraw/zinc/38/47/78/262384778.db2.gz	LBOUVQDLOGFYFH-OAHLLOKOSA-N	0	0	298.430	4.089	20	30		CIEDRN
Cc1cc(C)c(C#N)c(N[C@@H]2CCCc3sccc32)n1	ZINC000061364208	262396287	/nfs/dbraw/zinc/39/62/87/262396287.db2.gz	KDSVJCANXIUFTM-CQSZACIVSA-N	0	0	283.400	4.121	20	30		CIEDRN
Cc1ccc2cccc(NCc3ccc(C#N)cc3)c2n1	ZINC000061874870	262404326	/nfs/dbraw/zinc/40/43/26/262404326.db2.gz	GGVNXWCFZBKODA-UHFFFAOYSA-N	0	0	273.339	4.027	20	30		CIEDRN
C=CCCc1ccccc1NCc1ncc(C)s1	ZINC000336970669	262410380	/nfs/dbraw/zinc/41/03/80/262410380.db2.gz	ORRSUKRGIOINKK-UHFFFAOYSA-N	0	0	258.390	4.182	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1cnn(C(C)C)c1C	ZINC000337522198	262455394	/nfs/dbraw/zinc/45/53/94/262455394.db2.gz	VWMQSBLJVAQDKH-UHFFFAOYSA-N	0	0	297.402	4.143	20	30		CIEDRN
CC(C)N(C(=O)c1cscc1C#N)[C@@H](C)c1ccccc1	ZINC000410890472	262672053	/nfs/dbraw/zinc/67/20/53/262672053.db2.gz	FABBVOPXGZTCRO-ZDUSSCGKSA-N	0	0	298.411	4.232	20	30		CIEDRN
C=CC[C@@H](C(=O)N(CC)Cc1occc1C)c1ccccc1	ZINC000412803844	262742810	/nfs/dbraw/zinc/74/28/10/262742810.db2.gz	OQURGYKULCDHAE-QGZVFWFLSA-N	0	0	297.398	4.296	20	30		CIEDRN
Cc1cnccc1SCCC1(C#N)CCCCC1	ZINC000412997338	262751142	/nfs/dbraw/zinc/75/11/42/262751142.db2.gz	AESOLZUXMFFCPS-UHFFFAOYSA-N	0	0	260.406	4.346	20	30		CIEDRN
N#CCCSCc1cc(Cl)cc(Br)c1	ZINC000413021436	262753238	/nfs/dbraw/zinc/75/32/38/262753238.db2.gz	YTAPBTZVKSREIQ-UHFFFAOYSA-N	0	0	290.613	4.249	20	30		CIEDRN
CCC[C@H](C)C(=O)Nc1ccccc1S[C@H](C)CC#N	ZINC000265081902	262901457	/nfs/dbraw/zinc/90/14/57/262901457.db2.gz	VPWFNCYMNAOVBG-QWHCGFSZSA-N	0	0	290.432	4.456	20	30		CIEDRN
CC(C)(C#N)CCN1CC[C@H]1c1ccc(Cl)cc1	ZINC000272070944	263002065	/nfs/dbraw/zinc/00/20/65/263002065.db2.gz	YVTOKQVNASAJAU-AWEZNQCLSA-N	0	0	262.784	4.027	20	30		CIEDRN
CC(C)C(=O)Nc1ccc(NCC(C)(C)CCC#N)cc1	ZINC000155687834	263002195	/nfs/dbraw/zinc/00/21/95/263002195.db2.gz	CPMPTAPOBUFGBK-UHFFFAOYSA-N	0	0	287.407	4.023	20	30		CIEDRN
CC1(C#N)CCN(Cc2ccc(Oc3ccccc3)o2)CC1	ZINC000272543280	263006375	/nfs/dbraw/zinc/00/63/75/263006375.db2.gz	PPNQQZDBLRKGQS-UHFFFAOYSA-N	0	0	296.370	4.198	20	30		CIEDRN
CCCCc1ccc(NC(=O)N2CCC(C)(C#N)CC2)cc1	ZINC000272551010	263006455	/nfs/dbraw/zinc/00/64/55/263006455.db2.gz	PHZJIRSHOQYYGJ-UHFFFAOYSA-N	0	0	299.418	4.187	20	30		CIEDRN
C[C@@H](c1cccs1)c1noc(C2(C#N)CCCCC2)n1	ZINC000273877255	263020253	/nfs/dbraw/zinc/02/02/53/263020253.db2.gz	MMCODXWRNIAQFM-NSHDSACASA-N	0	0	287.388	4.008	20	30		CIEDRN
CC[C@H](CC1CCCC1)C(=O)Nc1ccccc1C#N	ZINC000414670271	263028618	/nfs/dbraw/zinc/02/86/18/263028618.db2.gz	LWUIECPHEORKHN-CQSZACIVSA-N	0	0	270.376	4.103	20	30		CIEDRN
CC(C)(C#N)CCSCc1ccc(-n2cccn2)cc1	ZINC000276568682	263037286	/nfs/dbraw/zinc/03/72/86/263037286.db2.gz	DSKKVZCXVPMGTF-UHFFFAOYSA-N	0	0	285.416	4.045	20	30		CIEDRN
CCC(CC)n1ccc(CSCCC(C)(C)C#N)n1	ZINC000276627652	263037662	/nfs/dbraw/zinc/03/76/62/263037662.db2.gz	PGZNHGCNQCCUJW-UHFFFAOYSA-N	0	0	279.453	4.417	20	30		CIEDRN
CCCCCCC[C@@H](CC(=O)[O-])[NH2+]Cc1sccc1C	ZINC000277380372	263040981	/nfs/dbraw/zinc/04/09/81/263040981.db2.gz	QTWRKAKJWJVERH-AWEZNQCLSA-N	0	0	297.464	4.350	20	30		CIEDRN
Cc1cc(C[S@@](=O)CCCCC(C)(C)C#N)c(C)s1	ZINC000277495673	263041421	/nfs/dbraw/zinc/04/14/21/263041421.db2.gz	ASHNATMSFDRUFD-IBGZPJMESA-N	0	0	297.489	4.334	20	30		CIEDRN
Cn1cccc1[C@@H]1CCCC[N@@H+]1CCCCC(C)(C)C#N	ZINC000277716230	263043140	/nfs/dbraw/zinc/04/31/40/263043140.db2.gz	NCWLIGWLDDZYCH-KRWDZBQOSA-N	0	0	287.451	4.272	20	30		CIEDRN
Cc1nn(C)c(Cl)c1CSCCCCC(C)(C)C#N	ZINC000277928154	263044737	/nfs/dbraw/zinc/04/47/37/263044737.db2.gz	PQTDFAXYRDEJEG-UHFFFAOYSA-N	0	0	299.871	4.335	20	30		CIEDRN
CC(C)(C#N)CCCCSCc1nccs1	ZINC000277989223	263044804	/nfs/dbraw/zinc/04/48/04/263044804.db2.gz	UFMCWTUZOQLOIO-UHFFFAOYSA-N	0	0	254.424	4.096	20	30		CIEDRN
CC[C@@H](C)c1ccccc1OC(=O)CC(C)(C)C#N	ZINC000278216373	263045929	/nfs/dbraw/zinc/04/59/29/263045929.db2.gz	IQGHJKNCSBQCGY-GFCCVEGCSA-N	0	0	259.349	4.045	20	30		CIEDRN
Cc1cccc([C@H]2CCCCN2C(=O)CC(C)(C)C#N)c1C	ZINC000278275359	263046420	/nfs/dbraw/zinc/04/64/20/263046420.db2.gz	FMORJVQSHRXPIG-QGZVFWFLSA-N	0	0	298.430	4.297	20	30		CIEDRN
CC(C)(C#N)CC(=O)N(Cc1ccsc1)c1ccccc1	ZINC000278279672	263046465	/nfs/dbraw/zinc/04/64/65/263046465.db2.gz	PYFKIUUIODEVDV-UHFFFAOYSA-N	0	0	298.411	4.221	20	30		CIEDRN
CC(C)(C#N)CC(=O)N(Cc1ccccc1)c1ccccc1	ZINC000278567747	263049151	/nfs/dbraw/zinc/04/91/51/263049151.db2.gz	QNAQWLWXFSKIRF-UHFFFAOYSA-N	0	0	292.382	4.160	20	30		CIEDRN
CCC[C@@H](CC)SCC(=O)Nc1ccc(CC#N)cc1	ZINC000280061145	263058847	/nfs/dbraw/zinc/05/88/47/263058847.db2.gz	ZDNVGUAFVAMWOP-OAHLLOKOSA-N	0	0	290.432	4.003	20	30		CIEDRN
CC(C)[C@@H]1CCCCN1C(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000280180502	263059681	/nfs/dbraw/zinc/05/96/81/263059681.db2.gz	PMHIDIKHGMASCK-KRWDZBQOSA-N	0	0	298.430	4.138	20	30		CIEDRN
CCCC1(C(=O)Nc2ccc(C#N)cc2Cl)CCC1	ZINC000430364745	263060340	/nfs/dbraw/zinc/06/03/40/263060340.db2.gz	KDHBUTJFAVYKTO-UHFFFAOYSA-N	0	0	276.767	4.121	20	30		CIEDRN
N#CC1(CCCSCc2ccccc2)CCOCC1	ZINC000280873225	263064809	/nfs/dbraw/zinc/06/48/09/263064809.db2.gz	BTDRANPMMODOHK-UHFFFAOYSA-N	0	0	275.417	4.020	20	30		CIEDRN
CC(C)(C#N)CCC[S@@](=O)Cc1cccc(C(F)F)c1	ZINC000280990089	263065607	/nfs/dbraw/zinc/06/56/07/263065607.db2.gz	MRMXBEZCALLXFL-HXUWFJFHSA-N	0	0	299.386	4.203	20	30		CIEDRN
Cc1ccc(-c2ccc(C)c(NC(=O)CC(C)(C)C#N)c2)o1	ZINC000281185385	263067006	/nfs/dbraw/zinc/06/70/06/263067006.db2.gz	LPWSSNUFYIIBDB-UHFFFAOYSA-N	0	0	296.370	4.442	20	30		CIEDRN
CCc1cccc(C)c1NC(=O)NCC1CCC(C#N)CC1	ZINC000282033766	263073956	/nfs/dbraw/zinc/07/39/56/263073956.db2.gz	ZKKVKHJKWJDTQO-UHFFFAOYSA-N	0	0	299.418	4.009	20	30		CIEDRN
C[C@H](C#N)Oc1ccccc1NC1CCC(C(F)F)CC1	ZINC000282514031	263077278	/nfs/dbraw/zinc/07/72/78/263077278.db2.gz	ZEYFEIHVGZRCLN-PNESKVBLSA-N	0	0	294.345	4.213	20	30		CIEDRN
C=CCC1(C(=O)N2CC(C)(C)[C@@H]2C(C)C)CCCC1	ZINC000452408903	263086792	/nfs/dbraw/zinc/08/67/92/263086792.db2.gz	PZWYJTBVGHUDQQ-AWEZNQCLSA-N	0	0	263.425	4.016	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)N[C@H](C)c1cc2ccccc2s1	ZINC000285250496	263091628	/nfs/dbraw/zinc/09/16/28/263091628.db2.gz	AMKQQMULJBOCCC-BDJLRTHQSA-N	0	0	286.400	4.018	20	30		CIEDRN
CC[C@H](C)CCC(=O)Nc1ccccc1SCCC#N	ZINC000285534647	263094031	/nfs/dbraw/zinc/09/40/31/263094031.db2.gz	SSKDKLRTNZQWBR-ZDUSSCGKSA-N	0	0	290.432	4.457	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)Nc1cc(C(F)F)ccc1Cl	ZINC000286771340	263099534	/nfs/dbraw/zinc/09/95/34/263099534.db2.gz	NPKTWVUDFFDJQA-CYBMUJFWSA-N	0	0	286.709	4.156	20	30		CIEDRN
C=C(C)CCNc1ccccc1SC[C@H](C)C#N	ZINC000288638778	263105279	/nfs/dbraw/zinc/10/52/79/263105279.db2.gz	CIIAIZAXSBREIB-CYBMUJFWSA-N	0	0	260.406	4.316	20	30		CIEDRN
CC[C@H](C)Oc1ccc(-c2noc(CC(C)(C)C#N)n2)cc1	ZINC000289163921	263108004	/nfs/dbraw/zinc/10/80/04/263108004.db2.gz	URIYIZQBPXLUMO-LBPRGKRZSA-N	0	0	299.374	4.006	20	30		CIEDRN
CCSc1ccc(-c2noc([C@](C)(C#N)CC)n2)cc1	ZINC000289302099	263108718	/nfs/dbraw/zinc/10/87/18/263108718.db2.gz	WLAHEGWBBSQFGJ-HNNXBMFYSA-N	0	0	287.388	4.040	20	30		CIEDRN
CCSc1ccc(-c2noc([C@@](C)(C#N)CC)n2)cc1	ZINC000289302100	263108810	/nfs/dbraw/zinc/10/88/10/263108810.db2.gz	WLAHEGWBBSQFGJ-OAHLLOKOSA-N	0	0	287.388	4.040	20	30		CIEDRN
N#CCCCC(=O)N[C@H](CC1CCCC1)c1ccccc1	ZINC000291876536	263126182	/nfs/dbraw/zinc/12/61/82/263126182.db2.gz	IPEIHYMRWGHBKR-QGZVFWFLSA-N	0	0	284.403	4.118	20	30		CIEDRN
CC(C)(C#N)CCCCN[C@@H](c1ccccc1)C(F)F	ZINC000292900399	263136436	/nfs/dbraw/zinc/13/64/36/263136436.db2.gz	ZNRRFTXIQADDMQ-AWEZNQCLSA-N	0	0	280.362	4.302	20	30		CIEDRN
Cc1c(Cl)cccc1NC(=O)[C@]1(C#N)CC12CCCC2	ZINC000294196332	263157425	/nfs/dbraw/zinc/15/74/25/263157425.db2.gz	GPLILXTUPNJJBK-MRXNPFEDSA-N	0	0	288.778	4.061	20	30		CIEDRN
N#C[C@@]1(C(=O)Nc2csc3ccccc23)CC12CCCC2	ZINC000294951768	263169907	/nfs/dbraw/zinc/16/99/07/263169907.db2.gz	KHSVXQIGFHYDMH-QGZVFWFLSA-N	0	0	296.395	4.314	20	30		CIEDRN
N#C[C@H]1CC[C@H](Sc2nc3cc(Cl)ccc3o2)C1	ZINC000295023414	263171176	/nfs/dbraw/zinc/17/11/76/263171176.db2.gz	USCXBYSLPGDGON-WPRPVWTQSA-N	0	0	278.764	4.266	20	30		CIEDRN
Cc1nocc1/C=C/C(=O)c1ccc(OC(C)(C)C)cc1	ZINC000296087555	263185597	/nfs/dbraw/zinc/18/55/97/263185597.db2.gz	YYJGLWWLIRDGJI-JXMROGBWSA-N	0	0	285.343	4.056	20	30		CIEDRN
CC(C)c1ccc(NC(=O)N[C@H]2CC[C@@H](CC#N)C2)cc1	ZINC000296152001	263186619	/nfs/dbraw/zinc/18/66/19/263186619.db2.gz	JQVAAJZMANDRGO-BBRMVZONSA-N	0	0	285.391	4.014	20	30		CIEDRN
CC(C)=CCC[C@H](C)NC(=O)Nc1ccc(CC#N)cc1	ZINC000296513890	263192422	/nfs/dbraw/zinc/19/24/22/263192422.db2.gz	ZMSMQYGXPJCTSV-AWEZNQCLSA-N	0	0	285.391	4.009	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)C(C)(C)CC(F)F	ZINC000414997005	263194179	/nfs/dbraw/zinc/19/41/79/263194179.db2.gz	YPNHMFQFNMMPJF-UHFFFAOYSA-N	0	0	299.336	4.022	20	30		CIEDRN
C=CCCc1noc([C@H](C)SCc2ccccc2)n1	ZINC000453246964	263207154	/nfs/dbraw/zinc/20/71/54/263207154.db2.gz	MHFQWEXBTDKZGF-LBPRGKRZSA-N	0	0	274.389	4.183	20	30		CIEDRN
CCCCCCCC(=O)N1CCC[C@@H]1c1ccc[nH]1	ZINC000298888208	263227369	/nfs/dbraw/zinc/22/73/69/263227369.db2.gz	YNWPNXODASNKAQ-OAHLLOKOSA-N	0	0	262.397	4.039	20	30		CIEDRN
CC[C@](C)(C#N)c1nc(-c2cccc(C(C)(F)F)c2)no1	ZINC000453338236	263241853	/nfs/dbraw/zinc/24/18/53/263241853.db2.gz	ASLKVTWTNVNLNL-CQSZACIVSA-N	0	0	291.301	4.040	20	30		CIEDRN
CC(F)(F)c1cccc(NCc2ccc(C#N)cc2F)c1	ZINC000187587898	263262788	/nfs/dbraw/zinc/26/27/88/263262788.db2.gz	KAYYWMKGHJEBSI-UHFFFAOYSA-N	0	0	290.288	4.421	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)NCc1c(OC)ccc2ccccc21	ZINC000467512496	263262838	/nfs/dbraw/zinc/26/28/38/263262838.db2.gz	HUUVYGVNSQPHGR-IBGZPJMESA-N	0	0	297.398	4.067	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)NCc1c(OC)ccc2ccccc21	ZINC000467512497	263262896	/nfs/dbraw/zinc/26/28/96/263262896.db2.gz	HUUVYGVNSQPHGR-LJQANCHMSA-N	0	0	297.398	4.067	20	30		CIEDRN
C=CCC[C@H](Nc1cnn([C@H](C)C2CC2)c1)C1CC1	ZINC000187624582	263265135	/nfs/dbraw/zinc/26/51/35/263265135.db2.gz	IEYGZSMWSWAOLS-WBMJQRKESA-N	0	0	259.397	4.011	20	30		CIEDRN
C#CCCCCC(=O)N(C)[C@H](C)c1cccc(Cl)c1	ZINC000119566287	263276280	/nfs/dbraw/zinc/27/62/80/263276280.db2.gz	UFCSGISOVOLGKT-CYBMUJFWSA-N	0	0	277.795	4.053	20	30		CIEDRN
C#CCCCCC(=O)N(C)[C@@H](C)c1cccc(Cl)c1	ZINC000119566138	263276417	/nfs/dbraw/zinc/27/64/17/263276417.db2.gz	UFCSGISOVOLGKT-ZDUSSCGKSA-N	0	0	277.795	4.053	20	30		CIEDRN
C#CCCCCC(=O)N(C)[C@@H](c1ccccc1)C(C)C	ZINC000120142164	263281147	/nfs/dbraw/zinc/28/11/47/263281147.db2.gz	HEEIZIKDULBGAH-GOSISDBHSA-N	0	0	271.404	4.036	20	30		CIEDRN
C#CCCCCC(=O)Nc1ccccc1CCC(F)(F)F	ZINC000120267577	263284704	/nfs/dbraw/zinc/28/47/04/263284704.db2.gz	GMYFXLPBPGIIQT-UHFFFAOYSA-N	0	0	297.320	4.314	20	30		CIEDRN
N#CCC[C@@H](Nc1cccc(F)c1C#N)c1ccccc1	ZINC000164345102	263286770	/nfs/dbraw/zinc/28/67/70/263286770.db2.gz	DBESRXBFDXHKCO-MRXNPFEDSA-N	0	0	279.318	4.154	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1cc(C)ccc1Cl	ZINC000120623995	263287651	/nfs/dbraw/zinc/28/76/51/263287651.db2.gz	AFGDPZQWVNEXHU-UHFFFAOYSA-N	0	0	266.772	4.078	20	30		CIEDRN
C[C@H](C#N)CNc1nc(-c2ccccc2Cl)cs1	ZINC000302078284	263293908	/nfs/dbraw/zinc/29/39/08/263293908.db2.gz	KFQGZQLOXSBWFT-SECBINFHSA-N	0	0	277.780	4.035	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N[C@@H](CC)c1ccc(F)cc1F	ZINC000341505819	263339671	/nfs/dbraw/zinc/33/96/71/263339671.db2.gz	ZYPQIXNFERPCQY-DOMZBBRYSA-N	0	0	296.361	4.070	20	30		CIEDRN
C=CCCC[C@H](C)Sc1nnc(C2CC2)n1CC	ZINC000341519500	263341841	/nfs/dbraw/zinc/34/18/41/263341841.db2.gz	CCPRZHZUYYYZBM-NSHDSACASA-N	0	0	265.426	4.012	20	30		CIEDRN
CC1(C)CCC(CC(=O)N(C2CC2)C2(C#N)CCC2)CC1	ZINC000341596491	263343768	/nfs/dbraw/zinc/34/37/68/263343768.db2.gz	FVONFJAKDKRMBI-UHFFFAOYSA-N	0	0	288.435	4.030	20	30		CIEDRN
CC[C@H](c1ccccc1)[S@@](=O)Cc1ccc(CC#N)cc1	ZINC000342142190	263398725	/nfs/dbraw/zinc/39/87/25/263398725.db2.gz	SFTXXBVICPXWCM-NQIIRXRSSA-N	0	0	297.423	4.153	20	30		CIEDRN
CCc1cccc(C)c1NCc1ccc(CC#N)cc1	ZINC000342434918	263433454	/nfs/dbraw/zinc/43/34/54/263433454.db2.gz	KGFSETYKDIBWJC-UHFFFAOYSA-N	0	0	264.372	4.236	20	30		CIEDRN
N#CCCCNC(=O)c1cc(-c2ccccc2)ccc1Cl	ZINC000342637728	263457676	/nfs/dbraw/zinc/45/76/76/263457676.db2.gz	VMVAEKZYMGRKQB-UHFFFAOYSA-N	0	0	298.773	4.041	20	30		CIEDRN
N#Cc1ccnc(N[C@@H]2CC=C(c3ccc(F)cc3)CC2)c1	ZINC000342918834	263546313	/nfs/dbraw/zinc/54/63/13/263546313.db2.gz	QSCPUUDKHSISGP-QGZVFWFLSA-N	0	0	293.345	4.140	20	30		CIEDRN
Cc1cccc(C)c1NC(=O)c1cc(C#N)ccc1Cl	ZINC000334422337	263622059	/nfs/dbraw/zinc/62/20/59/263622059.db2.gz	DPSIMXVLJSZKJR-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
CCC1(C(=O)N[C@@H]2CCCc3cc(C#N)ccc32)CCCC1	ZINC000416094827	263667827	/nfs/dbraw/zinc/66/78/27/263667827.db2.gz	GBGRFOLRTNVUGM-QGZVFWFLSA-N	0	0	296.414	4.022	20	30		CIEDRN
CCCC1(C(=O)N[C@@H]2CCCc3cc(C#N)ccc32)CCC1	ZINC000416112744	263675078	/nfs/dbraw/zinc/67/50/78/263675078.db2.gz	WHQFXUBKYMFWGF-QGZVFWFLSA-N	0	0	296.414	4.022	20	30		CIEDRN
C=CCC[C@H](NC(=O)c1sccc1F)c1ccccc1	ZINC000343213966	263748293	/nfs/dbraw/zinc/74/82/93/263748293.db2.gz	ZSAKGABZGDDAGF-AWEZNQCLSA-N	0	0	289.375	4.325	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1cccc(-c2ncco2)c1C	ZINC000424840665	263825498	/nfs/dbraw/zinc/82/54/98/263825498.db2.gz	YNAMQGPXLMBICO-UHFFFAOYSA-N	0	0	284.359	4.191	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@@H]1CC[C@H](c2ccccc2F)C1	ZINC000424846238	263827611	/nfs/dbraw/zinc/82/76/11/263827611.db2.gz	XIKGMZGDBSENKC-UONOGXRCSA-N	0	0	289.394	4.180	20	30		CIEDRN
Cc1coc2ccc(NC(=O)[C@@H]3O[C@@H](C)C[C@@H]3C)cc12	ZINC000328633819	263829941	/nfs/dbraw/zinc/82/99/41/263829941.db2.gz	BDIGXJCYCHRGDM-CCUNJIBTSA-N	0	0	273.332	4.143	20	30		CIEDRN
Cc1nc([C@H](C)NC(=O)c2occc2C(C)C)cs1	ZINC000330472460	263944554	/nfs/dbraw/zinc/94/45/54/263944554.db2.gz	AGZHNRZTIRSVAT-VIFPVBQESA-N	0	0	278.377	4.234	20	30		CIEDRN
Cc1c2ccccc2oc1C(=O)N[C@](C)(C#N)CC(C)C	ZINC000330474933	263945349	/nfs/dbraw/zinc/94/53/49/263945349.db2.gz	FECLTMSSFZTHHF-KRWDZBQOSA-N	0	0	284.359	4.374	20	30		CIEDRN
CC(C)C[C@@](C)(C#N)NC(=O)c1ccc(Cl)c(F)c1	ZINC000330555456	263965079	/nfs/dbraw/zinc/96/50/79/263965079.db2.gz	GVNCOOKRYFSRMA-AWEZNQCLSA-N	0	0	282.746	4.112	20	30		CIEDRN
CCC1(CC)CCC(NC(=O)c2nc(C)oc2C)CC1	ZINC000330579974	263979197	/nfs/dbraw/zinc/97/91/97/263979197.db2.gz	PLEPUOFAWBWVHW-UHFFFAOYSA-N	0	0	278.396	4.345	20	30		CIEDRN
Cc1ncc(C(=O)Nc2nc(CC(C)(C)C)cs2)s1	ZINC000330675162	264014665	/nfs/dbraw/zinc/01/46/65/264014665.db2.gz	HCHTZUTUEDPYPE-UHFFFAOYSA-N	0	0	295.433	4.133	20	30		CIEDRN
CCC1(NC(=O)Nc2ccc(C(C)C)cc2)CCOCC1	ZINC000330710272	264020927	/nfs/dbraw/zinc/02/09/27/264020927.db2.gz	TVEAFBAOOBXCDQ-UHFFFAOYSA-N	0	0	290.407	4.095	20	30		CIEDRN
CC(C)C[C@](C)(C#N)NC(=O)c1ccc(F)cc1Cl	ZINC000330757682	264030501	/nfs/dbraw/zinc/03/05/01/264030501.db2.gz	ILRYDSFUINSCSE-CQSZACIVSA-N	0	0	282.746	4.112	20	30		CIEDRN
CC(C)c1ncncc1C(=O)N[C@@H](C)CCC(C)(C)C	ZINC000330801271	264042284	/nfs/dbraw/zinc/04/22/84/264042284.db2.gz	GTTJGDSHKWOKMG-LBPRGKRZSA-N	0	0	277.412	4.119	20	30		CIEDRN
Cc1ncsc1NC(=O)c1sc(CC(C)C)nc1C	ZINC000330907279	264074553	/nfs/dbraw/zinc/07/45/53/264074553.db2.gz	NUVWCRHQVOSRGE-UHFFFAOYSA-N	0	0	295.433	4.051	20	30		CIEDRN
CC(C)(C)Oc1cccc(CNC(=O)C2=CCCCC2)n1	ZINC000330899504	264078941	/nfs/dbraw/zinc/07/89/41/264078941.db2.gz	JGFMIOPVEKBKSC-UHFFFAOYSA-N	0	0	288.391	4.216	20	30		CIEDRN
CCO[C@H](C)c1ncc(C(=O)N[C@@H](C)C2CCCC2)s1	ZINC000330925390	264094420	/nfs/dbraw/zinc/09/44/20/264094420.db2.gz	VVZQKESRKVPALB-WDEREUQCSA-N	0	0	296.436	4.124	20	30		CIEDRN
C[C@@H]1CCC[C@H](NC(=O)C[C@@H](CC#N)c2ccccc2)[C@H]1C	ZINC000331029570	264100450	/nfs/dbraw/zinc/10/04/50/264100450.db2.gz	RVAGOAPOLPHCGN-ATLSCFEFSA-N	0	0	298.430	4.015	20	30		CIEDRN
C[C@@H]1CCC[C@H](NC(=O)C[C@H](CC#N)c2ccccc2)[C@H]1C	ZINC000331029571	264100580	/nfs/dbraw/zinc/10/05/80/264100580.db2.gz	RVAGOAPOLPHCGN-FZCLSBEQSA-N	0	0	298.430	4.015	20	30		CIEDRN
CSc1ccsc1C(=O)N[C@@](C)(C#N)CC(C)C	ZINC000331058497	264109698	/nfs/dbraw/zinc/10/96/98/264109698.db2.gz	MLRNSEIYRHMHIW-CYBMUJFWSA-N	0	0	282.434	4.103	20	30		CIEDRN
CCc1nc(NC(=O)c2ccoc2C(C)C)sc1C	ZINC000331080055	264115758	/nfs/dbraw/zinc/11/57/58/264115758.db2.gz	KZYUDSSQEFNNLK-UHFFFAOYSA-N	0	0	278.377	4.367	20	30		CIEDRN
CC(C)c1occc1C(=O)NCCC[C@@H]1CCCC[C@@H]1O	ZINC000331103764	264123975	/nfs/dbraw/zinc/12/39/75/264123975.db2.gz	PUDPEAKUYHHLLI-ZFWWWQNUSA-N	0	0	293.407	4.039	20	30		CIEDRN
Cc1c(Cl)cccc1C(=O)N[C@](C)(C#N)CC(C)C	ZINC000331116154	264128902	/nfs/dbraw/zinc/12/89/02/264128902.db2.gz	KKFJUNJVHAQZRD-HNNXBMFYSA-N	0	0	278.783	4.281	20	30		CIEDRN
Cc1oc(C#N)cc1C(=O)N[C@H](C)CC1CCCCC1	ZINC000331234782	264174633	/nfs/dbraw/zinc/17/46/33/264174633.db2.gz	KVIVTKQOFXFJTK-LLVKDONJSA-N	0	0	274.364	4.123	20	30		CIEDRN
CCc1cc(C)cc(CC)c1NC(=O)N[C@@H]1CCC[C@H]1C#N	ZINC000331244970	264178889	/nfs/dbraw/zinc/17/88/89/264178889.db2.gz	OWGCGRYQBQIZML-JKSUJKDBSA-N	0	0	299.418	4.138	20	30		CIEDRN
CC(C)Oc1ncc(Cl)cc1NC(=O)C1=CCCC1	ZINC000331330779	264192079	/nfs/dbraw/zinc/19/20/79/264192079.db2.gz	HKWSUTOHRYPJEK-UHFFFAOYSA-N	0	0	280.755	4.221	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1c(C)noc1-c1ccccc1	ZINC000126543456	264217974	/nfs/dbraw/zinc/21/79/74/264217974.db2.gz	OWTSKRSGNVFMPA-UHFFFAOYSA-N	0	0	299.374	4.080	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1c(C)noc1-c1ccccc1	ZINC000126473943	264218203	/nfs/dbraw/zinc/21/82/03/264218203.db2.gz	RZMPGTKHZCGOSC-UHFFFAOYSA-N	0	0	299.374	4.080	20	30		CIEDRN
CC[C@H](Cc1ccccc1C)C(=O)Nc1ccccc1C#N	ZINC000425384434	264219764	/nfs/dbraw/zinc/21/97/64/264219764.db2.gz	MWXPIRAOSLUJES-OAHLLOKOSA-N	0	0	292.382	4.074	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N1C[C@@H](c2ccc(C)cc2)C[C@@H]1C	ZINC000424857416	264234159	/nfs/dbraw/zinc/23/41/59/264234159.db2.gz	RHLVPVXFFPOTPY-RDJZCZTQSA-N	0	0	285.431	4.302	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N1C[C@H](c2ccc(C)cc2)C[C@@H]1C	ZINC000424857219	264234238	/nfs/dbraw/zinc/23/42/38/264234238.db2.gz	RHLVPVXFFPOTPY-DOTOQJQBSA-N	0	0	285.431	4.302	20	30		CIEDRN
N#Cc1nc(N[C@H]2CCCc3sccc32)ccc1Cl	ZINC000161064091	264265422	/nfs/dbraw/zinc/26/54/22/264265422.db2.gz	VLPJKAOVNRUYCK-NSHDSACASA-N	0	0	289.791	4.158	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1cccc(C)c1Cl	ZINC000072580553	264268609	/nfs/dbraw/zinc/26/86/09/264268609.db2.gz	ZMLCCGJWZBETET-UHFFFAOYSA-N	0	0	266.772	4.078	20	30		CIEDRN
CC(F)(F)c1cccc(NCc2ccc(C#N)s2)c1	ZINC000189543877	264306647	/nfs/dbraw/zinc/30/66/47/264306647.db2.gz	GQNAIUHYDSSNNM-UHFFFAOYSA-N	0	0	278.327	4.344	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1cc2ccccc2n1CCC	ZINC000468333744	264317280	/nfs/dbraw/zinc/31/72/80/264317280.db2.gz	JAFAMHUGFZNWME-UHFFFAOYSA-N	0	0	284.403	4.090	20	30		CIEDRN
C[C@H](Sc1ncccc1Cl)c1cccc(C#N)c1	ZINC000189824254	264327448	/nfs/dbraw/zinc/32/74/48/264327448.db2.gz	FRLYIWFYVNIGOX-JTQLQIEISA-N	0	0	274.776	4.460	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1ccccc1OCC(C)C	ZINC000425453395	264328038	/nfs/dbraw/zinc/32/80/38/264328038.db2.gz	QDCMCRQGEFGINQ-UHFFFAOYSA-N	0	0	275.392	4.262	20	30		CIEDRN
C[C@H](Sc1ccc(Cl)cn1)c1cccc(C#N)c1	ZINC000189832661	264331394	/nfs/dbraw/zinc/33/13/94/264331394.db2.gz	AHAGZJCYHJFGDU-JTQLQIEISA-N	0	0	274.776	4.460	20	30		CIEDRN
C[C@@H](Sc1ccc(Cl)cn1)c1cccc(C#N)c1	ZINC000189832678	264331532	/nfs/dbraw/zinc/33/15/32/264331532.db2.gz	AHAGZJCYHJFGDU-SNVBAGLBSA-N	0	0	274.776	4.460	20	30		CIEDRN
C[C@@H](Sc1ccc(O)cc1)c1cccc(C#N)c1	ZINC000189837189	264333136	/nfs/dbraw/zinc/33/31/36/264333136.db2.gz	BECOJLMQJUJAKQ-LLVKDONJSA-N	0	0	255.342	4.117	20	30		CIEDRN
Cc1cc(C)c(C#N)c(S[C@H](C)c2cccc(C#N)c2)n1	ZINC000189769389	264333236	/nfs/dbraw/zinc/33/32/36/264333236.db2.gz	YFSYMTQBBDHDDO-CYBMUJFWSA-N	0	0	293.395	4.295	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N1C[C@@H](c2ccccc2)C2(CCC2)C1	ZINC000424891223	264336505	/nfs/dbraw/zinc/33/65/05/264336505.db2.gz	ZQPCFWZDPKXBNM-KRWDZBQOSA-N	0	0	297.442	4.385	20	30		CIEDRN
C=C(CC)CNC(=O)CCCc1cccc(C(F)(F)F)c1	ZINC000456814365	264350328	/nfs/dbraw/zinc/35/03/28/264350328.db2.gz	UAOJTODKEILGDJ-UHFFFAOYSA-N	0	0	299.336	4.111	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccc(OCCC)cc1C	ZINC000077281250	264353045	/nfs/dbraw/zinc/35/30/45/264353045.db2.gz	LFQMCDLQEZQQPF-UHFFFAOYSA-N	0	0	290.407	4.214	20	30		CIEDRN
CC1(CC(=O)Nc2ccc(CC#N)cc2)CCCCC1	ZINC000163609407	264361544	/nfs/dbraw/zinc/36/15/44/264361544.db2.gz	NLLNMVDBNDXJPT-UHFFFAOYSA-N	0	0	270.376	4.052	20	30		CIEDRN
C=C(C)CNC(=O)Nc1ccc(-c2ncc(C(C)C)o2)cc1	ZINC000157438792	264362364	/nfs/dbraw/zinc/36/23/64/264362364.db2.gz	SWXCQOUDALCKTB-UHFFFAOYSA-N	0	0	299.374	4.163	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccccc1C(C)C	ZINC000132739589	264392772	/nfs/dbraw/zinc/39/27/72/264392772.db2.gz	FAFAKCKQQBSDLH-UHFFFAOYSA-N	0	0	260.381	4.240	20	30		CIEDRN
C=CCCC(=O)N[C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000281366117	264474665	/nfs/dbraw/zinc/47/46/65/264474665.db2.gz	KWNBWQYXIPPIEU-MQMHXKEQSA-N	0	0	297.320	4.034	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)NCC1CC1	ZINC000191417550	264501772	/nfs/dbraw/zinc/50/17/72/264501772.db2.gz	SPPAZRWCECWGEI-UHFFFAOYSA-N	0	0	272.392	4.070	20	30		CIEDRN
C#CCCCCC(=O)N(c1nc(C)cs1)c1ccccc1	ZINC000182769539	264513743	/nfs/dbraw/zinc/51/37/43/264513743.db2.gz	MFFFMMKDOSMIKA-UHFFFAOYSA-N	0	0	298.411	4.310	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccccc2Br)CCC1	ZINC000191830216	264528186	/nfs/dbraw/zinc/52/81/86/264528186.db2.gz	LXBIHHJBEPZETF-UHFFFAOYSA-N	0	0	294.192	4.134	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)CF	ZINC000287078779	264607274	/nfs/dbraw/zinc/60/72/74/264607274.db2.gz	IGXRDFGDGVJDCF-GFCCVEGCSA-N	0	0	278.371	4.018	20	30		CIEDRN
CC[C@H](C)[C@@H](C)NC(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000194480821	264775470	/nfs/dbraw/zinc/77/54/70/264775470.db2.gz	IYUXQFDVASZGOT-QWHCGFSZSA-N	0	0	287.407	4.044	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@H](C)c1ccc(F)c(F)c1	ZINC000184988087	264935930	/nfs/dbraw/zinc/93/59/30/264935930.db2.gz	PDKXKVOXCBBHMD-VXGBXAGGSA-N	0	0	281.346	4.087	20	30		CIEDRN
C[C@H](SCc1ccc(CO)cc1)c1cccc(C#N)c1	ZINC000190822625	264978133	/nfs/dbraw/zinc/97/81/33/264978133.db2.gz	DGOUYDIYFSALNW-ZDUSSCGKSA-N	0	0	283.396	4.045	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](C)c1cccc(OC(F)F)c1	ZINC000185130816	264985147	/nfs/dbraw/zinc/98/51/47/264985147.db2.gz	QOUKRXKQRCJNQA-RYUDHWBXSA-N	0	0	297.345	4.068	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H]1c1ccccc1C	ZINC000185231221	265011617	/nfs/dbraw/zinc/01/16/17/265011617.db2.gz	MHMWHKUIYNZMOK-DOTOQJQBSA-N	0	0	271.404	4.261	20	30		CIEDRN
C=CCCC(=O)N1CC[C@@H](C(F)(F)F)c2ccccc21	ZINC000294363434	265013585	/nfs/dbraw/zinc/01/35/85/265013585.db2.gz	YAZLTUGEHFIYFT-GFCCVEGCSA-N	0	0	283.293	4.035	20	30		CIEDRN
C=CCCC(=O)N1CC[C@H](C(F)(F)F)c2ccccc21	ZINC000294363440	265013765	/nfs/dbraw/zinc/01/37/65/265013765.db2.gz	YAZLTUGEHFIYFT-LBPRGKRZSA-N	0	0	283.293	4.035	20	30		CIEDRN
C[C@H](c1ccccc1)N(C)Cc1cn2ccccc2c1C#N	ZINC000343335309	265016742	/nfs/dbraw/zinc/01/67/42/265016742.db2.gz	NHCAXRXDSMWICN-OAHLLOKOSA-N	0	0	289.382	4.004	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N1CC[C@H](C(F)(F)F)C(C)(C)C1	ZINC000335076401	265088227	/nfs/dbraw/zinc/08/82/27/265088227.db2.gz	LORPFNAOXYRPNX-NSHDSACASA-N	0	0	291.357	4.026	20	30		CIEDRN
N#Cc1ccc(Nc2cccc(Oc3ccccc3)c2)nc1	ZINC000314646333	265173917	/nfs/dbraw/zinc/17/39/17/265173917.db2.gz	ANFRCBRGMDEJOU-UHFFFAOYSA-N	0	0	287.322	4.489	20	30		CIEDRN
N#Cc1csc(CN[C@@H](c2ccco2)c2ccccc2)c1	ZINC000093492202	265182033	/nfs/dbraw/zinc/18/20/33/265182033.db2.gz	TWRAKAGMRLGNFQ-QGZVFWFLSA-N	0	0	294.379	4.092	20	30		CIEDRN
C=CC1CCN(C(=O)C2CCC(CCCC)CC2)CC1	ZINC000518909235	265208967	/nfs/dbraw/zinc/20/89/67/265208967.db2.gz	SUQRDFBTUBMRIR-UHFFFAOYSA-N	0	0	277.452	4.408	20	30		CIEDRN
N#Cc1ccc(C(F)(F)F)nc1SCC1CCCC1	ZINC000094336991	265238208	/nfs/dbraw/zinc/23/82/08/265238208.db2.gz	KBUBSYYJVBVGMD-UHFFFAOYSA-N	0	0	286.322	4.254	20	30		CIEDRN
N#Cc1ccc(C(F)(F)F)nc1SCc1ccccc1	ZINC000094336886	265238228	/nfs/dbraw/zinc/23/82/28/265238228.db2.gz	ZFDFZWSVKMSBSP-UHFFFAOYSA-N	0	0	294.301	4.264	20	30		CIEDRN
Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(C#N)cc2)cc1F	ZINC000094837110	265262058	/nfs/dbraw/zinc/26/20/58/265262058.db2.gz	VZVYEOJBPFBSFH-KGLIPLIRSA-N	0	0	282.362	4.418	20	30		CIEDRN
N#Cc1cnccc1SCc1ccc(C(F)(F)F)cc1	ZINC000519014032	265297025	/nfs/dbraw/zinc/29/70/25/265297025.db2.gz	RDUPGJFYGLCTCE-UHFFFAOYSA-N	0	0	294.301	4.264	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1ccccc1OCCCC	ZINC000519185887	265356812	/nfs/dbraw/zinc/35/68/12/265356812.db2.gz	SEXMOMIVLBEVQR-UHFFFAOYSA-N	0	0	290.407	4.295	20	30		CIEDRN
Cc1ccc(Cl)cc1Oc1ccc([N+](=O)[O-])cc1C#N	ZINC000097635734	265446632	/nfs/dbraw/zinc/44/66/32/265446632.db2.gz	QZLBYBJPMKQSRC-UHFFFAOYSA-N	0	0	288.690	4.221	20	30		CIEDRN
C[C@H](CCC(=O)N1CCC(CCC#N)CC1)c1ccccc1	ZINC000519601101	265498429	/nfs/dbraw/zinc/49/84/29/265498429.db2.gz	HEKWDUHCGDYSBN-MRXNPFEDSA-N	0	0	298.430	4.113	20	30		CIEDRN
C=CC1CCN(C(=O)N[C@H](c2ccccc2)C2CCC2)CC1	ZINC000520384186	265791815	/nfs/dbraw/zinc/79/18/15/265791815.db2.gz	ISYJXEFUDJNQHU-GOSISDBHSA-N	0	0	298.430	4.135	20	30		CIEDRN
CC[C@H](C)C[C@H](C)NC(=O)C[C@H](CC#N)c1ccccc1	ZINC000356186278	266065849	/nfs/dbraw/zinc/06/58/49/266065849.db2.gz	AXTVJKPUYYDFLY-ZOBUZTSGSA-N	0	0	286.419	4.015	20	30		CIEDRN
CC[C@@H]1CCCC[C@@H]1C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000356490876	266124424	/nfs/dbraw/zinc/12/44/24/266124424.db2.gz	QVMOCFJYFWCTTN-BPQIPLTHSA-N	0	0	298.430	4.364	20	30		CIEDRN
CC[C@@H]1CCCC[C@H]1C(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000356490880	266124447	/nfs/dbraw/zinc/12/44/47/266124447.db2.gz	QVMOCFJYFWCTTN-NXHRZFHOSA-N	0	0	298.430	4.364	20	30		CIEDRN
C=CCCC1(C(=O)N[C@H]2CC[C@H](C)c3ccccc32)CC1	ZINC000356569261	266138573	/nfs/dbraw/zinc/13/85/73/266138573.db2.gz	SXFYAVYIHOHDGU-YOEHRIQHSA-N	0	0	283.415	4.488	20	30		CIEDRN
C[C@H](CC#N)N(C)Cc1ccc(-c2ccccc2)cc1F	ZINC000356992557	266227416	/nfs/dbraw/zinc/22/74/16/266227416.db2.gz	MXZFUVGSUVCQSU-CQSZACIVSA-N	0	0	282.362	4.227	20	30		CIEDRN
CC(C)N(CC1CCC1)C(=O)C[C@@H](CC#N)c1ccccc1	ZINC000357138808	266254016	/nfs/dbraw/zinc/25/40/16/266254016.db2.gz	CQIZAPUZOZELJS-GOSISDBHSA-N	0	0	298.430	4.111	20	30		CIEDRN
C=CCCC1(C(=O)N(C)Cc2ccccc2SC)CC1	ZINC000357170415	266259281	/nfs/dbraw/zinc/25/92/81/266259281.db2.gz	NJTBUFVQMQKUHS-UHFFFAOYSA-N	0	0	289.444	4.113	20	30		CIEDRN
C=CCC1(C(=O)N[C@H]2CCCc3ccc(F)cc32)CCC1	ZINC000357481971	266306045	/nfs/dbraw/zinc/30/60/45/266306045.db2.gz	SIRSUEDVAZOEAC-INIZCTEOSA-N	0	0	287.378	4.066	20	30		CIEDRN
N#CCCCN[C@H](c1cccc2ccccc21)C(F)(F)F	ZINC000357809471	266369055	/nfs/dbraw/zinc/36/90/55/266369055.db2.gz	AYKIYOJLKPIAIF-OAHLLOKOSA-N	0	0	292.304	4.337	20	30		CIEDRN
C=CCC(CC=C)C(=O)NCc1ccc(C2CC2)cc1F	ZINC000358898603	266505118	/nfs/dbraw/zinc/50/51/18/266505118.db2.gz	SKAYXYUCDXANGS-UHFFFAOYSA-N	0	0	287.378	4.088	20	30		CIEDRN
C=CCC1(C(=O)Nc2cc3[nH]ccc3cc2C)CCC1	ZINC000359851184	266646081	/nfs/dbraw/zinc/64/60/81/266646081.db2.gz	WEQMJUMVBJBOBI-UHFFFAOYSA-N	0	0	268.360	4.161	20	30		CIEDRN
C=CCCC(=O)N[C@@H](C)c1ccc(Oc2cccnc2)cc1	ZINC000359869890	266649371	/nfs/dbraw/zinc/64/93/71/266649371.db2.gz	FNLFOKRWPLTXMU-AWEZNQCLSA-N	0	0	296.370	4.017	20	30		CIEDRN
C[C@@H](c1nc(C2CCC(C)CC2)no1)c1cccc(C#N)c1	ZINC000361023306	266770060	/nfs/dbraw/zinc/77/00/60/266770060.db2.gz	USMGNEDJJUVUMP-JVWICGRDSA-N	0	0	295.386	4.387	20	30		CIEDRN
N#CCCCC(=O)N(Cc1ccccc1F)c1ccccc1	ZINC000361461747	266827998	/nfs/dbraw/zinc/82/79/98/266827998.db2.gz	AYJWRDHESMSUSG-UHFFFAOYSA-N	0	0	296.345	4.053	20	30		CIEDRN
Cc1oc2ccccc2c1C(=O)N(CCC#N)CCC(C)C	ZINC000362164205	266936746	/nfs/dbraw/zinc/93/67/46/266936746.db2.gz	UUWZJUBENXTKAZ-UHFFFAOYSA-N	0	0	298.386	4.143	20	30		CIEDRN
C=C[C@H](C)NC(=O)N[C@@H](CC(C)(C)C)c1ccccc1	ZINC000362370806	266970875	/nfs/dbraw/zinc/97/08/75/266970875.db2.gz	MZZXIBRFGCHYJZ-ZFWWWQNUSA-N	0	0	274.408	4.038	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N1CCC[C@@H](C)[C@@H]1C	ZINC000362816763	267050263	/nfs/dbraw/zinc/05/02/63/267050263.db2.gz	FDOHAXXAXSSIHW-KGLIPLIRSA-N	0	0	289.444	4.225	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(-c2ncc(C(C)C)o2)cc1	ZINC000116699461	267168033	/nfs/dbraw/zinc/16/80/33/267168033.db2.gz	RCBJNXWHIMLBLN-UHFFFAOYSA-N	0	0	284.359	4.370	20	30		CIEDRN
CC#CCCCC(=O)N1CCCC[C@H]1c1ccc(F)cc1	ZINC000368760763	267202733	/nfs/dbraw/zinc/20/27/33/267202733.db2.gz	HJSLDKJQLCAXLU-KRWDZBQOSA-N	0	0	287.378	4.073	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC=C(c2cccc(F)c2)CC1	ZINC000368769785	267203013	/nfs/dbraw/zinc/20/30/13/267203013.db2.gz	JJZWSKGQAJTYTR-AWEZNQCLSA-N	0	0	287.378	4.044	20	30		CIEDRN
CCCCCCCC(=O)N1CCC[C@@H](C[C@H]2CCOC2)C1	ZINC000369841450	267270994	/nfs/dbraw/zinc/27/09/94/267270994.db2.gz	QMFMCCRKVJDSPB-DLBZAZTESA-N	0	0	295.467	4.012	20	30		CIEDRN
N#CCCCN1CCC[C@@H]1c1nc(C2CCCCC2)co1	ZINC000370208361	267299070	/nfs/dbraw/zinc/29/90/70/267299070.db2.gz	SUPTZAXOFKQJOE-MRXNPFEDSA-N	0	0	287.407	4.163	20	30		CIEDRN
CCCC(=O)Nc1cccc(NCC(C)(C)CCC#N)c1	ZINC000119585303	267346431	/nfs/dbraw/zinc/34/64/31/267346431.db2.gz	QPGJNTHSMBCHMM-UHFFFAOYSA-N	0	0	287.407	4.167	20	30		CIEDRN
N#CCc1ccc(N[C@H]2CCC[C@@H](c3cccnc3)C2)cc1	ZINC000376739066	268012261	/nfs/dbraw/zinc/01/22/61/268012261.db2.gz	WMWHXMPMGLGMSY-APWZRJJASA-N	0	0	291.398	4.286	20	30		CIEDRN
C=CCCCCC[N@@H+]1CCC[C@H]1c1nccs1	ZINC000377096520	268047604	/nfs/dbraw/zinc/04/76/04/268047604.db2.gz	BOKKRAWWCCLSIQ-ZDUSSCGKSA-N	0	0	250.411	4.026	20	30		CIEDRN
N#Cc1ccc(CNc2cccc(C(F)F)c2)cc1	ZINC000170642831	327648511	/nfs/dbraw/zinc/64/85/11/327648511.db2.gz	AWYKOCHARVSVFB-UHFFFAOYSA-N	0	0	258.271	4.108	20	30		CIEDRN
CC(C)c1ccc(C(=O)N[C@H](C#N)C2CCCCC2)s1	ZINC000186212666	327683659	/nfs/dbraw/zinc/68/36/59/327683659.db2.gz	QKZRGTGKHHKISG-CYBMUJFWSA-N	0	0	290.432	4.074	20	30		CIEDRN
CCCC(C)(C)CC(=O)N[C@@](C)(C#N)C1CCCCC1	ZINC000580144643	327709547	/nfs/dbraw/zinc/70/95/47/327709547.db2.gz	RIBSVAAXZSXDGU-KRWDZBQOSA-N	0	0	278.440	4.182	20	30		CIEDRN
C[C@H](Nc1c(C#N)cnc2ccccc21)c1ccc(C#N)cc1	ZINC000301063182	327715419	/nfs/dbraw/zinc/71/54/19/327715419.db2.gz	CNZJMOGHZYGRSZ-ZDUSSCGKSA-N	0	0	298.349	4.151	20	30		CIEDRN
Cc1cc(C#N)cc(C)c1OCc1cccc2cccnc21	ZINC000388083249	327834803	/nfs/dbraw/zinc/83/48/03/327834803.db2.gz	MPXOJSTXEIRWPK-UHFFFAOYSA-N	0	0	288.350	4.302	20	30		CIEDRN
Cc1nc(-c2cccc(N[C@H]3CCC[C@@H](C#N)C3)c2)oc1C	ZINC000185741150	327843846	/nfs/dbraw/zinc/84/38/46/327843846.db2.gz	VUDWEJYJDKXCKB-ZBFHGGJFSA-N	0	0	295.386	4.453	20	30		CIEDRN
N#C[C@@H]1CCC[C@H](Nc2cccc(C(F)F)c2)C1	ZINC000185745238	327843908	/nfs/dbraw/zinc/84/39/08/327843908.db2.gz	QDJUVIQDBGBESP-PWSUYJOCSA-N	0	0	250.292	4.118	20	30		CIEDRN
Cc1coc(-c2ccc(C)c(N[C@H]3CCC[C@H](C#N)C3)c2)n1	ZINC000185750766	327844062	/nfs/dbraw/zinc/84/40/62/327844062.db2.gz	BTPLDZREOFEBGZ-HOCLYGCPSA-N	0	0	295.386	4.453	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1ccc(/C=C/C)cc1	ZINC000497398131	327863533	/nfs/dbraw/zinc/86/35/33/327863533.db2.gz	YIJFRZUEVHOMLM-SEJWUHKESA-N	0	0	270.376	4.292	20	30		CIEDRN
N#Cc1cnc2ccccc2c1NCCC1=CCCCC1	ZINC000040453915	327907441	/nfs/dbraw/zinc/90/74/41/327907441.db2.gz	DPWIEMAIIYEYAQ-UHFFFAOYSA-N	0	0	277.371	4.409	20	30		CIEDRN
C[C@@H](SCCOCCC#N)c1ccc(Cl)cc1	ZINC000338545986	327984277	/nfs/dbraw/zinc/98/42/77/327984277.db2.gz	HVSLHUPEXQIJCI-LLVKDONJSA-N	0	0	269.797	4.064	20	30		CIEDRN
CC(C)[C@H](c1ccccc1Cl)N(C)CC1(C#N)CC1	ZINC000563283004	328008580	/nfs/dbraw/zinc/00/85/80/328008580.db2.gz	VWNFBFUJZUOCJW-OAHLLOKOSA-N	0	0	276.811	4.273	20	30		CIEDRN
C[C@H]1CCCN(C(=O)c2cscc2C#N)c2ccccc21	ZINC000410699256	328013160	/nfs/dbraw/zinc/01/31/60/328013160.db2.gz	GMUBGYBOCBHHGC-LBPRGKRZSA-N	0	0	296.395	4.164	20	30		CIEDRN
Cc1ccccc1[C@H](CC(C)C)NC(=O)C1(C#N)CC(C)C1	ZINC000531556534	328017259	/nfs/dbraw/zinc/01/72/59/328017259.db2.gz	DBADZMSHLBZULN-KGYZHSKHSA-N	0	0	298.430	4.138	20	30		CIEDRN
N#Cc1ccc(CNc2ccc(F)c(C(F)(F)F)c2)cc1	ZINC000040712628	328017830	/nfs/dbraw/zinc/01/78/30/328017830.db2.gz	JTPGCDNPEHJJFV-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
CC1(C)CC(C)(C)c2cc(NC(=O)C3(C#N)CCC3)ccc21	ZINC000534016317	328033101	/nfs/dbraw/zinc/03/31/01/328033101.db2.gz	QIENRBXALZFSHX-UHFFFAOYSA-N	0	0	296.414	4.278	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@H](C)[C@@H]2CCCC[C@H]21	ZINC000531823747	328039988	/nfs/dbraw/zinc/03/99/88/328039988.db2.gz	UZDFMSRWMALROM-BHYGNILZSA-N	0	0	275.436	4.182	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cc(Cl)cc(C)c1O	ZINC000531833122	328041110	/nfs/dbraw/zinc/04/11/10/328041110.db2.gz	HWQOHZWVGAYADD-UHFFFAOYSA-N	0	0	279.767	4.061	20	30		CIEDRN
CN(Cc1c(F)cccc1Cl)c1cccc(F)c1C#N	ZINC000007147437	328042926	/nfs/dbraw/zinc/04/29/26/328042926.db2.gz	JXQUJBNZRSPCRS-UHFFFAOYSA-N	0	0	292.716	4.126	20	30		CIEDRN
Cc1cccc(C(=O)N[C@H](C)c2ccc(C#N)cc2)c1Cl	ZINC000534357837	328048197	/nfs/dbraw/zinc/04/81/97/328048197.db2.gz	BLYNSXQZPLXMKG-GFCCVEGCSA-N	0	0	298.773	4.011	20	30		CIEDRN
C=C(C)CS[C@@H](C)C(=O)Nc1ccccc1SC	ZINC000563567095	328074165	/nfs/dbraw/zinc/07/41/65/328074165.db2.gz	WOKIBNSDGDXEMQ-NSHDSACASA-N	0	0	281.446	4.045	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Cc1csc2ccc(Cl)cc12	ZINC000152258694	328083124	/nfs/dbraw/zinc/08/31/24/328083124.db2.gz	WZSCPNGHVIOLDS-SNVBAGLBSA-N	0	0	293.819	4.178	20	30		CIEDRN
COc1ccccc1[C@H](C)SCC(C)(C)CC#N	ZINC000571179012	328089850	/nfs/dbraw/zinc/08/98/50/328089850.db2.gz	FFMHYSREFQIESF-LBPRGKRZSA-N	0	0	263.406	4.429	20	30		CIEDRN
C=C(C)CCNc1ccc(C)c(OCC2CCOCC2)c1	ZINC000571201478	328091940	/nfs/dbraw/zinc/09/19/40/328091940.db2.gz	KSPIQEWJGGIJPJ-UHFFFAOYSA-N	0	0	289.419	4.179	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCCCCCc1ccccc1	ZINC000571228821	328093932	/nfs/dbraw/zinc/09/39/32/328093932.db2.gz	JMHXCDDUZYRQGV-UHFFFAOYSA-N	0	0	273.420	4.118	20	30		CIEDRN
N#CC1(CCN[C@H](c2ccccc2)C(F)F)CCCCC1	ZINC000411759891	328099049	/nfs/dbraw/zinc/09/90/49/328099049.db2.gz	QSCNXVAONMRLQT-OAHLLOKOSA-N	0	0	292.373	4.447	20	30		CIEDRN
C=CCCCC(=O)N1C[C@H](c2ccccc2)C2(CCC2)C1	ZINC000412663783	328116007	/nfs/dbraw/zinc/11/60/07/328116007.db2.gz	CFNVVTYNRYMZCA-QGZVFWFLSA-N	0	0	283.415	4.139	20	30		CIEDRN
CC(C)(C#N)CC[S@](=O)c1ccc(Cl)cc1Cl	ZINC000322990879	328122568	/nfs/dbraw/zinc/12/25/68/328122568.db2.gz	CRCAKAQEMIRZJX-KRWDZBQOSA-N	0	0	290.215	4.041	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CC(c2ccccc2)(C(C)C)C1	ZINC000412807846	328125685	/nfs/dbraw/zinc/12/56/85/328125685.db2.gz	LYMZGOJTHUFRLO-UHFFFAOYSA-N	0	0	285.431	4.025	20	30		CIEDRN
C=CCCC(=O)N1CC[C@@H](CC(C)(C)C)C1(C)C	ZINC000412826407	328126949	/nfs/dbraw/zinc/12/69/49/328126949.db2.gz	QRIBDAUXLHBJHB-ZDUSSCGKSA-N	0	0	251.414	4.016	20	30		CIEDRN
N#CCCSCc1ccc(Br)c(Cl)c1	ZINC000413015213	328140430	/nfs/dbraw/zinc/14/04/30/328140430.db2.gz	SNGIXFBCYUUOOG-UHFFFAOYSA-N	0	0	290.613	4.249	20	30		CIEDRN
CN(Cc1ccc(C#N)o1)Cc1ccc(Cl)c(Cl)c1	ZINC000161138901	328136268	/nfs/dbraw/zinc/13/62/68/328136268.db2.gz	BKYXIDQHPQLLLX-UHFFFAOYSA-N	0	0	295.169	4.090	20	30		CIEDRN
Cc1cc(NCC(C)(C)CC#N)c2cccc(F)c2n1	ZINC000413398900	328144171	/nfs/dbraw/zinc/14/41/71/328144171.db2.gz	ALZACJNYMMXLON-UHFFFAOYSA-N	0	0	271.339	4.034	20	30		CIEDRN
CC(C)(CC#N)CNc1ncc(-c2ccccc2)s1	ZINC000413414048	328146014	/nfs/dbraw/zinc/14/60/14/328146014.db2.gz	UZARZFMSEDSZHD-UHFFFAOYSA-N	0	0	271.389	4.162	20	30		CIEDRN
CC[C@H](CC(C)C)C(=O)N(CCC#N)c1ccc(F)cc1	ZINC000571648847	328194828	/nfs/dbraw/zinc/19/48/28/328194828.db2.gz	ATXFLRWEAODZAE-CQSZACIVSA-N	0	0	290.382	4.145	20	30		CIEDRN
N#CCCCC[NH2+]C1(c2c(Cl)cccc2Cl)CC1	ZINC000271809613	328197267	/nfs/dbraw/zinc/19/72/67/328197267.db2.gz	RJKLNBGEOMFVNL-UHFFFAOYSA-N	0	0	283.202	4.266	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)c1cc(F)cc(Cl)c1	ZINC000276192900	328217491	/nfs/dbraw/zinc/21/74/91/328217491.db2.gz	DZNLUHWVTRLNLY-UHFFFAOYSA-N	0	0	296.773	4.024	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)N(C)C[C@@H](C)C#N	ZINC000276410888	328218363	/nfs/dbraw/zinc/21/83/63/328218363.db2.gz	MEWZPYMZRMXOBR-AWEZNQCLSA-N	0	0	299.418	4.162	20	30		CIEDRN
N#Cc1c(NC[C@@H]2CCCSC2)cccc1C(F)F	ZINC000571657697	328221127	/nfs/dbraw/zinc/22/11/27/328221127.db2.gz	PVHOTVMZRPXWMG-JTQLQIEISA-N	0	0	282.359	4.051	20	30		CIEDRN
CC(C)[C@H]1c2ccccc2C(=O)/C1=C\c1cncs1	ZINC000277755586	328222410	/nfs/dbraw/zinc/22/24/10/328222410.db2.gz	ZPJHHLNYXSDUOH-GSHXUFRSSA-N	0	0	269.369	4.163	20	30		CIEDRN
C=CCC[C@@H](NC(=O)N1CC2(C1)CCCC2)c1ccccc1	ZINC000430345513	328228107	/nfs/dbraw/zinc/22/81/07/328228107.db2.gz	RRLZVHXVAOXOAZ-QGZVFWFLSA-N	0	0	298.430	4.280	20	30		CIEDRN
C[C@@H](OC(=O)CC(C)(C)C#N)c1cccc(Cl)c1F	ZINC000278839975	328230959	/nfs/dbraw/zinc/23/09/59/328230959.db2.gz	RLHHMWSGZFCGGM-SECBINFHSA-N	0	0	283.730	4.023	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)Nc1ncc(C2CCCCC2)s1	ZINC000285980565	328248754	/nfs/dbraw/zinc/24/87/54/328248754.db2.gz	FSEJWKCCEWPDEX-OAHLLOKOSA-N	0	0	291.420	4.069	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)Nc1ccc(CCC(F)(F)F)cc1	ZINC000287522303	328251723	/nfs/dbraw/zinc/25/17/23/328251723.db2.gz	OPIUWUMACPVGQR-CQSZACIVSA-N	0	0	298.308	4.060	20	30		CIEDRN
C[C@H](Nc1cc(C2CC2)ccn1)c1ccc(OCC#N)cc1	ZINC000289587397	328255620	/nfs/dbraw/zinc/25/56/20/328255620.db2.gz	ATWBWNPHQZXWKS-ZDUSSCGKSA-N	0	0	293.370	4.034	20	30		CIEDRN
N#CC1(CCCNc2cccc(C3CCC3)c2)CCOCC1	ZINC000291017403	328261844	/nfs/dbraw/zinc/26/18/44/328261844.db2.gz	VRIHWRMIFICBIH-UHFFFAOYSA-N	0	0	298.430	4.467	20	30		CIEDRN
C[C@@H](C#N)S[C@@H](C)c1cccc(Br)c1	ZINC000291548502	328265021	/nfs/dbraw/zinc/26/50/21/328265021.db2.gz	AOIBCJMPASVNLB-IUCAKERBSA-N	0	0	270.195	4.155	20	30		CIEDRN
Cc1nocc1/C=C/C(=O)c1ccc(SC(C)C)cc1	ZINC000296066463	328288796	/nfs/dbraw/zinc/28/87/96/328288796.db2.gz	XOCZQHBBZVXZMR-RMKNXTFCSA-N	0	0	287.384	4.380	20	30		CIEDRN
CC1(C#N)CCC(Nc2ccc(F)c(Cl)c2)CC1	ZINC000453182566	328293038	/nfs/dbraw/zinc/29/30/38/328293038.db2.gz	NQLGPUWWWCZUCD-UHFFFAOYSA-N	0	0	266.747	4.363	20	30		CIEDRN
CCc1ccc(NCc2ccc(C#N)cc2)cc1C	ZINC000388773422	328301296	/nfs/dbraw/zinc/30/12/96/328301296.db2.gz	ISRCEMSXVHVPAT-UHFFFAOYSA-N	0	0	250.345	4.041	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)C[C@@H]1CCCC[C@H]1C	ZINC000531896255	328305583	/nfs/dbraw/zinc/30/55/83/328305583.db2.gz	SPIBIQKBESHOMV-CABCVRRESA-N	0	0	278.440	4.182	20	30		CIEDRN
Cc1ccccc1C[C@H](C)Nc1cccc(F)c1C#N	ZINC000048565907	328315564	/nfs/dbraw/zinc/31/55/64/328315564.db2.gz	JOEYXKDMWXVEIZ-ZDUSSCGKSA-N	0	0	268.335	4.049	20	30		CIEDRN
Cc1c(C#N)c(-c2ccsc2)nc2ccccc12	ZINC000048607380	328319071	/nfs/dbraw/zinc/31/90/71/328319071.db2.gz	YJDQWBWMTHDTJF-UHFFFAOYSA-N	0	0	250.326	4.143	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1ccc(C)cc1)c1ccccc1	ZINC000534601327	328320505	/nfs/dbraw/zinc/32/05/05/328320505.db2.gz	NTSHYMCBUQSALP-OAHLLOKOSA-N	0	0	265.356	4.293	20	30		CIEDRN
C=C[C@H](CC(=O)NCc1ccc(F)c(C)c1)c1ccccc1	ZINC000534604274	328321429	/nfs/dbraw/zinc/32/14/29/328321429.db2.gz	JQAHXOYSRWWSDS-MRXNPFEDSA-N	0	0	297.373	4.110	20	30		CIEDRN
Cc1cccc(OCCNc2cccc(Cl)c2C#N)c1	ZINC000048936270	328326259	/nfs/dbraw/zinc/32/62/59/328326259.db2.gz	JTMBQJJWVPJPPZ-UHFFFAOYSA-N	0	0	286.762	4.011	20	30		CIEDRN
N#Cc1ccc(NCc2cc(F)cc(F)c2)cc1Cl	ZINC000111106821	328326364	/nfs/dbraw/zinc/32/63/64/328326364.db2.gz	MCZQJYXQKBHEHR-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C=C[C@H](CC(=O)N1CCC[C@@H](CC)CC1)c1ccccc1	ZINC000534690826	328356357	/nfs/dbraw/zinc/35/63/57/328356357.db2.gz	KSHADEVJPHHKGW-IAGOWNOFSA-N	0	0	285.431	4.385	20	30		CIEDRN
CC(C)[C@@H](Cc1ccccc1)C(=O)Nc1cccc(C#N)c1	ZINC000303746038	328357883	/nfs/dbraw/zinc/35/78/83/328357883.db2.gz	ALZCQGJYTTVAFD-GOSISDBHSA-N	0	0	292.382	4.012	20	30		CIEDRN
N#Cc1ccc(OCc2csc(C3CCCC3)n2)cc1	ZINC000049487912	328363926	/nfs/dbraw/zinc/36/39/26/328363926.db2.gz	GJOZCIASSPGXJW-UHFFFAOYSA-N	0	0	284.384	4.251	20	30		CIEDRN
CCC(CC)[C@@H](C)C(=O)N[C@@H](C#N)c1ccccc1Cl	ZINC000534903782	328369575	/nfs/dbraw/zinc/36/95/75/328369575.db2.gz	CARPZMIPJIUXBI-ABAIWWIYSA-N	0	0	292.810	4.093	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)[C@H]2CCC[C@@H](C)C2)c1	ZINC000303953267	328369776	/nfs/dbraw/zinc/36/97/76/328369776.db2.gz	ZNXHAXIFEOGRGR-CABCVRRESA-N	0	0	287.403	4.406	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@@H](C)c1oc2ccccc2c1C	ZINC000172062162	335093003	/nfs/dbraw/zinc/09/30/03/335093003.db2.gz	UUCJFEUOQHPOJL-AAEUAGOBSA-N	0	0	286.375	4.066	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2ccccc2C(C)(C)C)CC1	ZINC000111705472	328376425	/nfs/dbraw/zinc/37/64/25/328376425.db2.gz	IYTJVDHZZAKFQT-UHFFFAOYSA-N	0	0	286.419	4.414	20	30		CIEDRN
Cc1ccc(NCc2ccc(C#N)cc2)cc1C(F)(F)F	ZINC000049943015	328379590	/nfs/dbraw/zinc/37/95/90/328379590.db2.gz	UBJXUZZVYWVXMQ-UHFFFAOYSA-N	0	0	290.288	4.498	20	30		CIEDRN
N#Cc1cc2c(nc1NCc1ccccc1Cl)CCCC2	ZINC000049956986	328379720	/nfs/dbraw/zinc/37/97/20/328379720.db2.gz	BDTQKNZXAQHXER-UHFFFAOYSA-N	0	0	297.789	4.098	20	30		CIEDRN
N#Cc1cc2c(nc1NCc1cccc(Cl)c1)CCCC2	ZINC000049956987	328379777	/nfs/dbraw/zinc/37/97/77/328379777.db2.gz	NGJNNUZFIHVLJD-UHFFFAOYSA-N	0	0	297.789	4.098	20	30		CIEDRN
CCC(CC)C(=O)N[C@@H](C#N)c1ccc(C(C)(C)C)cc1	ZINC000049884511	328380797	/nfs/dbraw/zinc/38/07/97/328380797.db2.gz	WOFCIPOMNMCRCO-INIZCTEOSA-N	0	0	286.419	4.101	20	30		CIEDRN
N#Cc1cc([N+](=O)[O-])ccc1Sc1cccc(Cl)c1	ZINC000112090992	328383931	/nfs/dbraw/zinc/38/39/31/328383931.db2.gz	YWRZMGKRAGGMRM-UHFFFAOYSA-N	0	0	290.731	4.271	20	30		CIEDRN
CC1(C)CCC[C@H](c2noc(Cc3cccc(C#N)c3)n2)C1	ZINC000535249461	328397987	/nfs/dbraw/zinc/39/79/87/328397987.db2.gz	ZRMQOCGZEIHDDK-HNNXBMFYSA-N	0	0	295.386	4.216	20	30		CIEDRN
C=CCCC(=O)N(C)[C@H](c1ccccc1C)C(C)C	ZINC000112258132	328394478	/nfs/dbraw/zinc/39/44/78/328394478.db2.gz	AJPBOILETDSONJ-KRWDZBQOSA-N	0	0	259.393	4.117	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cc(F)cc3cccnc32)n1	ZINC000340809270	328401080	/nfs/dbraw/zinc/40/10/80/328401080.db2.gz	ZKGOUKYRCZPNPZ-UHFFFAOYSA-N	0	0	297.333	4.278	20	30		CIEDRN
C=CCCCSc1nnc(C)n1[C@@H]1CCC[C@H](C)C1	ZINC000535333088	328440493	/nfs/dbraw/zinc/44/04/93/328440493.db2.gz	MEHJMMKBJUAZGO-GXTWGEPZSA-N	0	0	279.453	4.396	20	30		CIEDRN
C=CCCCSc1nnc(C)n1[C@H]1CCC[C@@H](C)C1	ZINC000535333102	328440503	/nfs/dbraw/zinc/44/05/03/328440503.db2.gz	MEHJMMKBJUAZGO-OCCSQVGLSA-N	0	0	279.453	4.396	20	30		CIEDRN
N#Cc1ccc(-c2nc3ccc(F)cc3n2C2CC2)c(F)c1	ZINC000535352604	328443875	/nfs/dbraw/zinc/44/38/75/328443875.db2.gz	BGRHTWYMSJRVKK-UHFFFAOYSA-N	0	0	295.292	4.188	20	30		CIEDRN
C=C[C@H](Cc1nc(Cc2cccs2)no1)c1ccccc1	ZINC000535383673	328448610	/nfs/dbraw/zinc/44/86/10/328448610.db2.gz	KHRFWUFJDCMMHM-CYBMUJFWSA-N	0	0	296.395	4.234	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1ccc(Cl)c(OC)c1	ZINC000535396082	328450596	/nfs/dbraw/zinc/45/05/96/328450596.db2.gz	ZCSHLOAJGDHLLA-UHFFFAOYSA-N	0	0	295.810	4.167	20	30		CIEDRN
C=C[C@H](CC(=O)N1CCC[C@](C)(CC)C1)c1ccccc1	ZINC000535404319	328451414	/nfs/dbraw/zinc/45/14/14/328451414.db2.gz	JDICPQNBPOOVDY-APWZRJJASA-N	0	0	285.431	4.385	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccc(COC(C)C)cc1	ZINC000134116293	328505866	/nfs/dbraw/zinc/50/58/66/328505866.db2.gz	GYJPVNMZUFCQIK-UHFFFAOYSA-N	0	0	290.407	4.042	20	30		CIEDRN
C[C@@H](c1ccc(C#N)cc1)N1C[C@@H](C)c2ccccc21	ZINC000563774130	328512649	/nfs/dbraw/zinc/51/26/49/328512649.db2.gz	ODCJVNITRPLGMA-KGLIPLIRSA-N	0	0	262.356	4.243	20	30		CIEDRN
CC[C@@H](C)CC(=O)Nc1sc2c(c1C#N)CC[C@@H](C)C2	ZINC000563765030	328513011	/nfs/dbraw/zinc/51/30/11/328513011.db2.gz	ZRVNASBINPSITF-GHMZBOCLSA-N	0	0	290.432	4.119	20	30		CIEDRN
C=C[C@H](CC(=O)N1C[C@H](C)[C@H]2CCCC[C@@H]21)c1ccccc1	ZINC000183760273	328523129	/nfs/dbraw/zinc/52/31/29/328523129.db2.gz	KJXTYVOYKCHCPS-ISARSNTHSA-N	0	0	297.442	4.383	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)C(C)(C)Cc1ccccc1	ZINC000172065283	335093273	/nfs/dbraw/zinc/09/32/73/335093273.db2.gz	INOGOOPIKYAHMS-UHFFFAOYSA-N	0	0	292.382	4.074	20	30		CIEDRN
C=CCOc1ccccc1-c1nc([C@H](C)SCC)no1	ZINC000290149137	328529389	/nfs/dbraw/zinc/52/93/89/328529389.db2.gz	ROAHYHDOPZWGGG-NSHDSACASA-N	0	0	290.388	4.116	20	30		CIEDRN
C=CCC(C)(C)C(=O)O[C@@H](C)c1nc2ccccc2o1	ZINC000292248313	328536547	/nfs/dbraw/zinc/53/65/47/328536547.db2.gz	OVRNBGFQJWHHIV-NSHDSACASA-N	0	0	273.332	4.034	20	30		CIEDRN
C=C(C)CSc1nnc(C[C@@H](C)c2ccccc2)o1	ZINC000097603478	328543258	/nfs/dbraw/zinc/54/32/58/328543258.db2.gz	MEBXQEJOSVULEL-GFCCVEGCSA-N	0	0	274.389	4.084	20	30		CIEDRN
Cc1c(Cl)cc(F)c(NCc2cccc(C#N)c2)c1F	ZINC000535592995	328595533	/nfs/dbraw/zinc/59/55/33/328595533.db2.gz	LTFAOPUPCGTOBR-UHFFFAOYSA-N	0	0	292.716	4.410	20	30		CIEDRN
C[C@H](Nc1cccc2c1OC(C)(C)C2)c1cccc(C#N)c1	ZINC000530489082	326817552	/nfs/dbraw/zinc/81/75/52/326817552.db2.gz	KLOPSJVIFOUBRW-ZDUSSCGKSA-N	0	0	292.382	4.445	20	30		CIEDRN
N#Cc1ccc(C(=O)Nc2cccc(C3CCC3)c2)s1	ZINC000583968446	326819656	/nfs/dbraw/zinc/81/96/56/326819656.db2.gz	NOKCUFORHLIVKK-UHFFFAOYSA-N	0	0	282.368	4.140	20	30		CIEDRN
CC(C)(C)c1ccc(C(=O)N2CCC(CCC#N)CC2)cc1	ZINC000399790321	326827694	/nfs/dbraw/zinc/82/76/94/326827694.db2.gz	XRHRBARKBFWRKT-UHFFFAOYSA-N	0	0	298.430	4.140	20	30		CIEDRN
CC[C@@H](C#N)NC(=O)c1ccc(-c2cccc(C(C)C)c2)o1	ZINC000179835888	326842583	/nfs/dbraw/zinc/84/25/83/326842583.db2.gz	TVGLMDHWQVZEKY-HNNXBMFYSA-N	0	0	296.370	4.102	20	30		CIEDRN
Cc1ccsc1CNc1cccc(OCCCC#N)c1	ZINC000037777404	326861419	/nfs/dbraw/zinc/86/14/19/326861419.db2.gz	BQMLAFDZHBCKBA-UHFFFAOYSA-N	0	0	286.400	4.351	20	30		CIEDRN
Cc1cccc(CNc2cccc(OCCCC#N)c2)c1	ZINC000037777376	326861440	/nfs/dbraw/zinc/86/14/40/326861440.db2.gz	VNKXLSSKIXPGBZ-UHFFFAOYSA-N	0	0	280.371	4.290	20	30		CIEDRN
N#Cc1ccc(Cl)cc1NCc1ccc(F)cc1F	ZINC000036954241	326877246	/nfs/dbraw/zinc/87/72/46/326877246.db2.gz	RMAXSNLEQQGHAR-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C[C@@H](CCc1ccco1)Nc1cc(Cl)ccc1C#N	ZINC000036954568	326877318	/nfs/dbraw/zinc/87/73/18/326877318.db2.gz	JFZWULBERGFJOV-NSHDSACASA-N	0	0	274.751	4.238	20	30		CIEDRN
COc1ccc(S[C@H](C#N)Cc2ccc(C)cc2)cc1	ZINC000067444147	326884940	/nfs/dbraw/zinc/88/49/40/326884940.db2.gz	UFJMNSXWFHKSAL-KRWDZBQOSA-N	0	0	283.396	4.231	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@@H]1CCCC(C)(C)C1	ZINC000533701762	326910282	/nfs/dbraw/zinc/91/02/82/326910282.db2.gz	IUMWMTKTRXSDOM-CQSZACIVSA-N	0	0	291.460	4.479	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N(CCC)C(C)C	ZINC000584061135	326912427	/nfs/dbraw/zinc/91/24/27/326912427.db2.gz	BJDFJBSFXJVPEB-UHFFFAOYSA-N	0	0	274.408	4.458	20	30		CIEDRN
C=CCC(C)(C)c1noc(/C=C\c2ccc(F)cc2)n1	ZINC000556364495	326923404	/nfs/dbraw/zinc/92/34/04/326923404.db2.gz	FOFLPLVNVYQJCM-YFHOEESVSA-N	0	0	272.323	4.233	20	30		CIEDRN
C=C[C@@H](CC(=O)NC/C=C\c1ccccc1)c1ccccc1	ZINC000255077780	326926565	/nfs/dbraw/zinc/92/65/65/326926565.db2.gz	VYHIZOZMDKJANZ-DVESRUBUSA-N	0	0	291.394	4.176	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(-c2ccc(C)c(F)c2)no1	ZINC000569326988	326938035	/nfs/dbraw/zinc/93/80/35/326938035.db2.gz	FJXYAPKESKFWBB-OAHLLOKOSA-N	0	0	260.312	4.038	20	30		CIEDRN
C=C(C)CCSc1nnc(-c2ccc(F)cc2)n1CC	ZINC000506447277	332773363	/nfs/dbraw/zinc/77/33/63/332773363.db2.gz	ZDEGTGLKJXHFSI-UHFFFAOYSA-N	0	0	291.395	4.162	20	30		CIEDRN
CCc1ccc(C(=O)COc2ccc(C#N)cc2Cl)cc1	ZINC000007856400	326938876	/nfs/dbraw/zinc/93/88/76/326938876.db2.gz	MQONPKKIQUGBGL-UHFFFAOYSA-N	0	0	299.757	4.036	20	30		CIEDRN
N#Cc1ccc(/C=C\c2cnc(-c3ccccc3)s2)nc1	ZINC000255082401	326939318	/nfs/dbraw/zinc/93/93/18/326939318.db2.gz	PHBRQMBWJIEMFU-HJWRWDBZSA-N	0	0	289.363	4.247	20	30		CIEDRN
Cc1cc(C)c(NC(=O)/C=C\c2cccc(C#N)c2)c(C)c1	ZINC000255237674	326959141	/nfs/dbraw/zinc/95/91/41/326959141.db2.gz	FXFJNOCTEBQRKY-FPLPWBNLSA-N	0	0	290.366	4.135	20	30		CIEDRN
CN(C(=O)[C@@H]1CCC[C@@H]2CCCC[C@@H]12)c1cccc(C#N)c1	ZINC000556810056	326967533	/nfs/dbraw/zinc/96/75/33/326967533.db2.gz	JZFGTCCHJRCXBM-CGTJXYLNSA-N	0	0	296.414	4.128	20	30		CIEDRN
Cc1cc2c(ncnc2SCC(C)(C)CC#N)s1	ZINC000568270364	326987634	/nfs/dbraw/zinc/98/76/34/326987634.db2.gz	CTFREJOLQHNVQH-UHFFFAOYSA-N	0	0	277.418	4.032	20	30		CIEDRN
C=CCC1(C(=O)NC[C@@H]2CCCCC(F)(F)C2)CCC1	ZINC000557320326	327001514	/nfs/dbraw/zinc/00/15/14/327001514.db2.gz	RRVJXKWLBQULDS-CYBMUJFWSA-N	0	0	285.378	4.065	20	30		CIEDRN
CC[C@H](Nc1cc(C#N)ccn1)c1ccc(Cl)cc1	ZINC000557479078	327007848	/nfs/dbraw/zinc/00/78/48/327007848.db2.gz	RODWHGNOHZHASJ-AWEZNQCLSA-N	0	0	271.751	4.170	20	30		CIEDRN
C[C@H]1CC[C@@H](Nc2nccc(C#N)c2Cl)c2ccccc21	ZINC000557639841	327018096	/nfs/dbraw/zinc/01/80/96/327018096.db2.gz	UFPYNZAFDVMOTM-XHDPSFHLSA-N	0	0	297.789	4.079	20	30		CIEDRN
N#Cc1ccnc(N[C@H]2CCC[C@H](c3ccccc3)C2)c1	ZINC000557682506	327020621	/nfs/dbraw/zinc/02/06/21/327020621.db2.gz	OKFHQIZHDCSSRZ-IRXDYDNUSA-N	0	0	277.371	4.092	20	30		CIEDRN
COc1ccc(CNc2ccc(Cl)cc2C)cc1C#N	ZINC000087822481	327022479	/nfs/dbraw/zinc/02/24/79/327022479.db2.gz	AZZAPXSFXLNRDH-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
C=CCn1c(C)cc(C(=O)COc2ccc(C)c(C)c2)c1C	ZINC000255926078	327031013	/nfs/dbraw/zinc/03/10/13/327031013.db2.gz	CXEBGNFHCLSVLE-UHFFFAOYSA-N	0	0	297.398	4.169	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)NCCc1cc2ccccc2s1	ZINC000506585720	332774997	/nfs/dbraw/zinc/77/49/97/332774997.db2.gz	HOCOZOSGHROBGR-QGZVFWFLSA-N	0	0	287.428	4.162	20	30		CIEDRN
C=CCC[C@@H](C(=O)N[C@H]1CCC1(C)C)c1ccccc1	ZINC000557977627	327038381	/nfs/dbraw/zinc/03/83/81/327038381.db2.gz	LMJGIKIOVBZELM-CVEARBPZSA-N	0	0	271.404	4.041	20	30		CIEDRN
CC(C)[C@@H]1C[C@@H](Nc2cccc(C(F)F)c2C#N)CCO1	ZINC000584182920	327062183	/nfs/dbraw/zinc/06/21/83/327062183.db2.gz	PDZOLQVEXBQVDU-NHYWBVRUSA-N	0	0	294.345	4.111	20	30		CIEDRN
CC[C@@H](C)CCC(=O)Nc1cc(C#N)ccc1OC(C)C	ZINC000506789575	332780050	/nfs/dbraw/zinc/78/00/50/332780050.db2.gz	HVOODRXZPGIHMK-CYBMUJFWSA-N	0	0	288.391	4.110	20	30		CIEDRN
C[C@H](C#N)CN(C)[C@@H](C)c1ccc(C(C)(C)C)cc1	ZINC000558087823	327067518	/nfs/dbraw/zinc/06/75/18/327067518.db2.gz	LGJIXPCUCPRYCP-KGLIPLIRSA-N	0	0	258.409	4.137	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1cccc(O[C@H](C)CC)c1	ZINC000584224415	327073056	/nfs/dbraw/zinc/07/30/56/327073056.db2.gz	VDXAEMGRTQRJAN-CQSZACIVSA-N	0	0	290.407	4.294	20	30		CIEDRN
N#Cc1cnc(N[C@@H]2CCC[C@H]2c2ccccc2)c(Cl)c1	ZINC000558116514	327074787	/nfs/dbraw/zinc/07/47/87/327074787.db2.gz	KEVRVBVGADEGCO-GOEBONIOSA-N	0	0	297.789	4.355	20	30		CIEDRN
CC(C)C[C@](C)(C#N)NC(=O)c1ccc(-c2ccccc2)o1	ZINC000558140120	327075836	/nfs/dbraw/zinc/07/58/36/327075836.db2.gz	WHCICELEJWEANZ-GOSISDBHSA-N	0	0	296.370	4.005	20	30		CIEDRN
C[C@H]1C[C@@H](C(C)(C)C)CCN1C(=O)Nc1cccc(C#N)c1	ZINC000558227191	327079612	/nfs/dbraw/zinc/07/96/12/327079612.db2.gz	SPHZGGSQOKNWEB-ZFWWWQNUSA-N	0	0	299.418	4.237	20	30		CIEDRN
N#Cc1c(F)cccc1N1CCC[C@H]1Cc1ccc(F)cc1	ZINC000506841540	332780852	/nfs/dbraw/zinc/78/08/52/332780852.db2.gz	SEXNCWWSOZDLOS-HNNXBMFYSA-N	0	0	298.336	4.048	20	30		CIEDRN
Cc1cc(N2CCCC2)ccc1Nc1cccc(F)c1C#N	ZINC000506858639	332781335	/nfs/dbraw/zinc/78/13/35/332781335.db2.gz	XPRNRZBJZHTCAL-UHFFFAOYSA-N	0	0	295.361	4.350	20	30		CIEDRN
CCC(CC)CN(CCC#N)Cc1cc(C(C)(C)C)on1	ZINC000558457980	327095772	/nfs/dbraw/zinc/09/57/72/327095772.db2.gz	ACBNNSVDNRBSTO-UHFFFAOYSA-N	0	0	291.439	4.124	20	30		CIEDRN
CC(C)c1nc2ccc(NC[C@H](C#N)CCC#N)cc2s1	ZINC000558506723	327099638	/nfs/dbraw/zinc/09/96/38/327099638.db2.gz	KDWPKKTUBUKPNX-LBPRGKRZSA-N	0	0	298.415	4.275	20	30		CIEDRN
N#CCCC1CCN(c2noc3ccc(Cl)cc32)CC1	ZINC000566006701	327111626	/nfs/dbraw/zinc/11/16/26/327111626.db2.gz	NCMJRTKXYUGFFN-UHFFFAOYSA-N	0	0	289.766	4.001	20	30		CIEDRN
Cc1ccccc1CN(c1nccc(C#N)c1Cl)C1CC1	ZINC000584248873	327128050	/nfs/dbraw/zinc/12/80/50/327128050.db2.gz	HXLSCEMSECTXAJ-UHFFFAOYSA-N	0	0	297.789	4.084	20	30		CIEDRN
N#CCc1cccc(N[C@H]2CCC[C@@H](C3CC3)C2)c1	ZINC000313421934	327128954	/nfs/dbraw/zinc/12/89/54/327128954.db2.gz	DCSWCMCBTSSZAK-WBVHZDCISA-N	0	0	254.377	4.133	20	30		CIEDRN
CC(C)(C)c1ncc(CNc2cccc(CC#N)c2)s1	ZINC000313440122	327130729	/nfs/dbraw/zinc/13/07/29/327130729.db2.gz	YSEIEULQVWOWHH-UHFFFAOYSA-N	0	0	285.416	4.119	20	30		CIEDRN
C[C@@H]1C[C@H]1c1ccc(CNc2cccc(CC#N)c2)o1	ZINC000313448094	327131568	/nfs/dbraw/zinc/13/15/68/327131568.db2.gz	MRPWKRXDKGOWJQ-MLGOLLRUSA-N	0	0	266.344	4.081	20	30		CIEDRN
C=CCCCNc1ccccc1SC[C@@H](C)C#N	ZINC000077246009	327131652	/nfs/dbraw/zinc/13/16/52/327131652.db2.gz	QPSPVUKDKUNHJE-ZDUSSCGKSA-N	0	0	260.406	4.316	20	30		CIEDRN
N#Cc1ccc(Oc2cnc3ccccc3n2)c2ccccc12	ZINC000559008020	327137837	/nfs/dbraw/zinc/13/78/37/327137837.db2.gz	WXIWNNJCLWKVDB-UHFFFAOYSA-N	0	0	297.317	4.447	20	30		CIEDRN
C[C@H](CNc1ccc(C#N)cc1F)c1ccc(F)cc1	ZINC000507015938	332784239	/nfs/dbraw/zinc/78/42/39/332784239.db2.gz	UMIXVDVBPCPROR-LLVKDONJSA-N	0	0	272.298	4.052	20	30		CIEDRN
N#Cc1c(F)cccc1NCc1ccc(C(F)F)cc1	ZINC000131316146	327161296	/nfs/dbraw/zinc/16/12/96/327161296.db2.gz	JVEVVRQPEDQCNA-UHFFFAOYSA-N	0	0	276.261	4.247	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc(-c2ncco2)cc1	ZINC000152944960	327162784	/nfs/dbraw/zinc/16/27/84/327162784.db2.gz	OAAVGJYCBWIUPI-UHFFFAOYSA-N	0	0	282.343	4.049	20	30		CIEDRN
C=CCCc1ccccc1NCc1cccc([N+](=O)[O-])c1	ZINC000409847211	327165334	/nfs/dbraw/zinc/16/53/34/327165334.db2.gz	WGKRJQHABAOXQI-UHFFFAOYSA-N	0	0	282.343	4.326	20	30		CIEDRN
C=CCCc1ccccc1NC[C@H]1CCO[C@@H](C)C1	ZINC000409835730	327165388	/nfs/dbraw/zinc/16/53/88/327165388.db2.gz	KZXXDIODLYIUPA-GJZGRUSLSA-N	0	0	259.393	4.032	20	30		CIEDRN
C=CCCc1ccccc1NCc1ccc([N+](=O)[O-])cc1	ZINC000409844617	327165871	/nfs/dbraw/zinc/16/58/71/327165871.db2.gz	MXEVOHIELGOMAC-UHFFFAOYSA-N	0	0	282.343	4.326	20	30		CIEDRN
C=CCCCCNC(=O)CC1CC(c2ccccc2)C1	ZINC000409920631	327167388	/nfs/dbraw/zinc/16/73/88/327167388.db2.gz	FVGYLIUMIOZZKK-UHFFFAOYSA-N	0	0	271.404	4.043	20	30		CIEDRN
C=CCCCCNC(=O)[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000409920510	327167487	/nfs/dbraw/zinc/16/74/87/327167487.db2.gz	GIGMGOBEEIUTBJ-GFCCVEGCSA-N	0	0	299.336	4.281	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1ccc2c(c1)COC2)c1ccccc1	ZINC000091673347	327175504	/nfs/dbraw/zinc/17/55/04/327175504.db2.gz	FURXYYUIUPDVCY-AWEZNQCLSA-N	0	0	293.366	4.015	20	30		CIEDRN
CSC1(CNc2cccc(OCCCC#N)c2)CCC1	ZINC000290364389	327177699	/nfs/dbraw/zinc/17/76/99/327177699.db2.gz	HCTKRDALFRYQCB-UHFFFAOYSA-N	0	0	290.432	4.067	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)C[C@H](C)c1ccc(CC)cc1	ZINC000410129836	327180025	/nfs/dbraw/zinc/18/00/25/327180025.db2.gz	HGRJRJSNHRLHFK-WMLDXEAASA-N	0	0	273.420	4.214	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@H](C)Sc1ccc(Cl)cc1	ZINC000410128665	327180063	/nfs/dbraw/zinc/18/00/63/327180063.db2.gz	UKULTSXZPYEQRR-AAEUAGOBSA-N	0	0	297.851	4.292	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)CCc1cccc(C(F)(F)F)c1	ZINC000410120485	327180110	/nfs/dbraw/zinc/18/01/10/327180110.db2.gz	UOGVYKMICWHELX-CQSZACIVSA-N	0	0	299.336	4.109	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Cc1cccc(Cl)c1Cl	ZINC000410120367	327180192	/nfs/dbraw/zinc/18/01/92/327180192.db2.gz	LQKRSLGTTZUHAE-LLVKDONJSA-N	0	0	286.202	4.007	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1ccc(C2CCC2)cc1	ZINC000410146098	327181324	/nfs/dbraw/zinc/18/13/24/327181324.db2.gz	SXUMLVVNEDQTDH-INIZCTEOSA-N	0	0	257.377	4.039	20	30		CIEDRN
N#Cc1c(NCCC2(F)CCC2)cccc1C(F)F	ZINC000569504957	327186744	/nfs/dbraw/zinc/18/67/44/327186744.db2.gz	YURSXARYHMRZAW-UHFFFAOYSA-N	0	0	268.282	4.190	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1cc(CC)ccn1	ZINC000410353196	327187533	/nfs/dbraw/zinc/18/75/33/327187533.db2.gz	LZOZMOHSZPOVMH-UHFFFAOYSA-N	0	0	280.371	4.015	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)C(C)(C)c1cccnc1	ZINC000410345662	327187621	/nfs/dbraw/zinc/18/76/21/327187621.db2.gz	RXWQEEWOYPNROY-UHFFFAOYSA-N	0	0	294.398	4.117	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)CC[C@H]1CC[C@H](C)O1	ZINC000410388715	327190718	/nfs/dbraw/zinc/19/07/18/327190718.db2.gz	ZKLXNFZFTPYXFN-GOEBONIOSA-N	0	0	287.403	4.091	20	30		CIEDRN
C=CCCC1(c2nc(C[C@H](C)c3ccccc3)no2)CC1	ZINC000569530117	327194382	/nfs/dbraw/zinc/19/43/82/327194382.db2.gz	HKVGUKGZLFJUFL-AWEZNQCLSA-N	0	0	282.387	4.414	20	30		CIEDRN
N#Cc1cc(F)ccc1CSCCCC1CCOCC1	ZINC000569588338	327201663	/nfs/dbraw/zinc/20/16/63/327201663.db2.gz	RRYZXAKVJCYRIM-UHFFFAOYSA-N	0	0	293.407	4.137	20	30		CIEDRN
CC#CCCCc1nc(-c2ccc(C(C)(F)F)cc2)no1	ZINC000584262074	327203687	/nfs/dbraw/zinc/20/36/87/327203687.db2.gz	JGLMEYYYKWKWRO-UHFFFAOYSA-N	0	0	290.313	4.194	20	30		CIEDRN
CCOC1CC(CSCc2ccc(Cl)cc2C#N)C1	ZINC000507121120	332788552	/nfs/dbraw/zinc/78/85/52/332788552.db2.gz	NMXDRHVBIAKMLR-UHFFFAOYSA-N	0	0	295.835	4.260	20	30		CIEDRN
C=CCOc1cccc(NC(=O)N2[C@@H](C)CC[C@@H]2CC)c1	ZINC000537928837	327239136	/nfs/dbraw/zinc/23/91/36/327239136.db2.gz	IBGSHTFSBUJLRB-ZFWWWQNUSA-N	0	0	288.391	4.046	20	30		CIEDRN
COC(=O)c1ccc(SCCCCC(C)(C)C#N)cc1	ZINC000559620039	327255749	/nfs/dbraw/zinc/25/57/49/327255749.db2.gz	CBTUBZLEKYIVKW-UHFFFAOYSA-N	0	0	291.416	4.285	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@H]1CCC[C@H](C)C1)c1ccccc1	ZINC000533888772	327266714	/nfs/dbraw/zinc/26/67/14/327266714.db2.gz	IZGTWABEDKQHSW-UXLLHSPISA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CCC(F)(F)c1nc(-c2cccc(Cl)c2F)no1	ZINC000559968043	327274470	/nfs/dbraw/zinc/27/44/70/327274470.db2.gz	XSDPRSPXSQQIAD-UHFFFAOYSA-N	0	0	288.656	4.197	20	30		CIEDRN
C=CCC(C)(C)c1noc(CCc2cc3ccccc3o2)n1	ZINC000560022544	327277988	/nfs/dbraw/zinc/27/79/88/327277988.db2.gz	ZDAQWXJAOADJCO-UHFFFAOYSA-N	0	0	296.370	4.455	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H]2CCc3ccc(OC)cc32)n1	ZINC000560023446	327278093	/nfs/dbraw/zinc/27/80/93/327278093.db2.gz	CJUVCYIDLFUASE-AWEZNQCLSA-N	0	0	298.386	4.010	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H](C)Cc2cccc(F)c2)n1	ZINC000560025309	327278113	/nfs/dbraw/zinc/27/81/13/327278113.db2.gz	QXCVAJWHMCNFEG-LBPRGKRZSA-N	0	0	288.366	4.409	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H](C)Cc2cccc(F)c2)n1	ZINC000560025306	327278160	/nfs/dbraw/zinc/27/81/60/327278160.db2.gz	QXCVAJWHMCNFEG-GFCCVEGCSA-N	0	0	288.366	4.409	20	30		CIEDRN
C=CCC(C)(C)c1noc(Cc2cn(C)c3ccccc23)n1	ZINC000560026353	327278373	/nfs/dbraw/zinc/27/83/73/327278373.db2.gz	USLNWIVAVCTEMI-UHFFFAOYSA-N	0	0	295.386	4.006	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cc(C)ccc2F)n1	ZINC000560027169	327278380	/nfs/dbraw/zinc/27/83/80/327278380.db2.gz	JYLDRSGHFPOFEN-UHFFFAOYSA-N	0	0	260.312	4.038	20	30		CIEDRN
C=CCC(C)(C)c1noc(Cc2c(F)cccc2Cl)n1	ZINC000560026987	327278472	/nfs/dbraw/zinc/27/84/72/327278472.db2.gz	YKQZZYURQYWXRV-UHFFFAOYSA-N	0	0	294.757	4.307	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)NCCCCc1ccc(Cl)s1	ZINC000560112263	327284525	/nfs/dbraw/zinc/28/45/25/327284525.db2.gz	FRDXOWWZMAKJIR-HNNXBMFYSA-N	0	0	299.867	4.443	20	30		CIEDRN
C=CCCCNC(=O)N(CC)[C@H](CC)c1ccccc1	ZINC000448034794	327289759	/nfs/dbraw/zinc/28/97/59/327289759.db2.gz	LKVFLYMYOBMSNR-MRXNPFEDSA-N	0	0	274.408	4.135	20	30		CIEDRN
Cc1ccc(CNC2(c3cccc(C#N)c3)CC2)c(Cl)c1	ZINC000566335712	327319471	/nfs/dbraw/zinc/31/94/71/327319471.db2.gz	CLOOXUARJFNANY-UHFFFAOYSA-N	0	0	296.801	4.299	20	30		CIEDRN
CCNc1ccc(C#N)cc1NC(=O)[C@H](C)CC1CCCC1	ZINC000560587647	327328528	/nfs/dbraw/zinc/32/85/28/327328528.db2.gz	AAUNEJJHCFFBQY-CYBMUJFWSA-N	0	0	299.418	4.145	20	30		CIEDRN
C=CCCc1ccccc1N[C@@H]1C[C@@H](C)O[C@@H](C)C1	ZINC000564705189	327371286	/nfs/dbraw/zinc/37/12/86/327371286.db2.gz	QDCLEWOKUGIHEL-MIFYACCESA-N	0	0	259.393	4.173	20	30		CIEDRN
C[C@@H]1CCC[C@@H](C(=O)Nc2ccc(C(C)(C)C#N)cc2)C1	ZINC000150782002	327377687	/nfs/dbraw/zinc/37/76/87/327377687.db2.gz	RRRZINYCQKJUBT-ZIAGYGMSSA-N	0	0	284.403	4.253	20	30		CIEDRN
C=C[C@](C)(CC)c1nc([C@@H](C)Oc2ccccc2)no1	ZINC000561888739	327428616	/nfs/dbraw/zinc/42/86/16/327428616.db2.gz	XEFFWNXRAMIGAO-MLGOLLRUSA-N	0	0	272.348	4.063	20	30		CIEDRN
C=CCC[C@@H](C)Nc1cccc(Cl)c1OCCOC	ZINC000562005580	327438701	/nfs/dbraw/zinc/43/87/01/327438701.db2.gz	MJBWWMMHUUOVOL-GFCCVEGCSA-N	0	0	283.799	4.132	20	30		CIEDRN
C[C@@H]1CCN(c2ncc(C#N)cc2Cl)[C@@H]2CCCC[C@H]12	ZINC000562329827	327470496	/nfs/dbraw/zinc/47/04/96/327470496.db2.gz	IMGUBIBQQZAFBV-UXIGCNINSA-N	0	0	289.810	4.012	20	30		CIEDRN
CCSCc1cccc(NCc2ccc(C#N)cc2)c1	ZINC000151558102	327477627	/nfs/dbraw/zinc/47/76/27/327477627.db2.gz	XKMLKCIIOPFSKA-UHFFFAOYSA-N	0	0	282.412	4.423	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)Nc1cc(F)ccc1Cl	ZINC000562421823	327480542	/nfs/dbraw/zinc/48/05/42/327480542.db2.gz	TXCQCULSXSNIRT-UHFFFAOYSA-N	0	0	284.762	4.203	20	30		CIEDRN
C[C@H](CC#N)NC(=O)Nc1ccc(SC(C)(C)C)cc1	ZINC000159183650	327488961	/nfs/dbraw/zinc/48/89/61/327488961.db2.gz	HTEYANIBWAXXHN-LLVKDONJSA-N	0	0	291.420	4.001	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H](c1ccco1)c1ccccc1	ZINC000159163741	327494225	/nfs/dbraw/zinc/49/42/25/327494225.db2.gz	FLXDKAFXJDVPIK-GOSISDBHSA-N	0	0	295.382	4.254	20	30		CIEDRN
CCc1ccc([C@@H](C#N)NC(=O)CCCC(C)(C)C)cc1	ZINC000562898522	327523157	/nfs/dbraw/zinc/52/31/57/327523157.db2.gz	LZYXKUVEKDYQOT-MRXNPFEDSA-N	0	0	286.419	4.146	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc([C@H](C)c2ccccc2C)no1	ZINC000584317151	327540897	/nfs/dbraw/zinc/54/08/97/327540897.db2.gz	AMHMJCPZPJKVCS-DYVFJYSZSA-N	0	0	270.376	4.384	20	30		CIEDRN
CCCCC(=O)N(Cc1ccccc1)c1ccccc1C#N	ZINC000569723121	327542500	/nfs/dbraw/zinc/54/25/00/327542500.db2.gz	FIESLGWJWZPBJQ-UHFFFAOYSA-N	0	0	292.382	4.282	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)c1cccc(C)c1F	ZINC000159613196	327546889	/nfs/dbraw/zinc/54/68/89/327546889.db2.gz	CXXUWTKRTMPYAD-UHFFFAOYSA-N	0	0	289.375	4.024	20	30		CIEDRN
CCOc1cc(N[C@H](C)c2ccc(C#N)cc2)ccc1C	ZINC000575441463	327556893	/nfs/dbraw/zinc/55/68/93/327556893.db2.gz	CKUNIFGHWFLDNM-CQSZACIVSA-N	0	0	280.371	4.439	20	30		CIEDRN
C=CCCCCCNC(=O)N1CCC[C@@H]1c1ccsc1	ZINC000569986390	327560340	/nfs/dbraw/zinc/56/03/40/327560340.db2.gz	VENZRCNLXLZCSC-OAHLLOKOSA-N	0	0	292.448	4.341	20	30		CIEDRN
Cc1csc(NC(=O)C[C@@H]2CCC[C@H](C)C2)c1C#N	ZINC000570078595	327567910	/nfs/dbraw/zinc/56/79/10/327567910.db2.gz	UUJMMDSZBCSCLL-CMPLNLGQSA-N	0	0	276.405	4.083	20	30		CIEDRN
Cc1csc(NC(=O)[C@@H](C)CCC(C)(C)C)c1C#N	ZINC000570078629	327567980	/nfs/dbraw/zinc/56/79/80/327567980.db2.gz	VRJLJSMTXWPNTE-JTQLQIEISA-N	0	0	278.421	4.329	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2ccc(OC)c(C)c2)no1	ZINC000570483531	327594390	/nfs/dbraw/zinc/59/43/90/327594390.db2.gz	VOTBKLFCNZLFFA-GFCCVEGCSA-N	0	0	272.348	4.123	20	30		CIEDRN
CC[C@@H](C)N(C(=O)c1ccc(C#N)c(Cl)c1)[C@H](C)CC	ZINC000160136754	327596030	/nfs/dbraw/zinc/59/60/30/327596030.db2.gz	QWGNVOONDJVIRX-VXGBXAGGSA-N	0	0	292.810	4.251	20	30		CIEDRN
Cc1noc(C)c1CCS[C@H](C)c1ccc(C#N)cc1	ZINC000160144068	327596574	/nfs/dbraw/zinc/59/65/74/327596574.db2.gz	AVIMNYIPFQVTNV-CYBMUJFWSA-N	0	0	286.400	4.200	20	30		CIEDRN
C=CCCCCCNC(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1	ZINC000570525811	327597701	/nfs/dbraw/zinc/59/77/01/327597701.db2.gz	TZRVDOIDRHMJPA-QWHCGFSZSA-N	0	0	291.357	4.218	20	30		CIEDRN
C=CCCCC(=O)N1CC[C@H](C(C)(C)C)C[C@H]1C	ZINC000570545023	327599096	/nfs/dbraw/zinc/59/90/96/327599096.db2.gz	YCEGWTXEFHCNCO-KGLIPLIRSA-N	0	0	251.414	4.016	20	30		CIEDRN
N#Cc1ccccc1CSCCCCC1CCOCC1	ZINC000507508790	332810747	/nfs/dbraw/zinc/81/07/47/332810747.db2.gz	KJNCFKPSYKQQPD-UHFFFAOYSA-N	0	0	289.444	4.388	20	30		CIEDRN
Cc1ccc([C@H](C)N(C)C(=O)Nc2cccc(C#N)c2)cc1	ZINC000051377329	328613574	/nfs/dbraw/zinc/61/35/74/328613574.db2.gz	JSTBRQCYYVTRON-AWEZNQCLSA-N	0	0	293.370	4.092	20	30		CIEDRN
C[C@@H](Nc1cccc(Cl)c1)c1cccc(C#N)c1	ZINC000037202566	328644422	/nfs/dbraw/zinc/64/44/22/328644422.db2.gz	SZBOCWMXOVWWIA-LLVKDONJSA-N	0	0	256.736	4.385	20	30		CIEDRN
N#Cc1ccn(CCCc2cccc3ccccc32)c1	ZINC000535881360	328645219	/nfs/dbraw/zinc/64/52/19/328645219.db2.gz	XTOYJDJPJIUVEQ-UHFFFAOYSA-N	0	0	260.340	4.146	20	30		CIEDRN
C=C(C)[C@H](CC(=O)Nc1ccc(C(C)(C)C)cc1)OCC	ZINC000535882505	328645489	/nfs/dbraw/zinc/64/54/89/328645489.db2.gz	IPMYDCVLCZKVDI-INIZCTEOSA-N	0	0	289.419	4.294	20	30		CIEDRN
N#Cc1ccccc1/C=C/c1nc2ccccc2s1	ZINC000535912092	328647803	/nfs/dbraw/zinc/64/78/03/328647803.db2.gz	XLLKFHYHNUDOBS-MDZDMXLPSA-N	0	0	262.337	4.338	20	30		CIEDRN
Cc1ccccc1-c1cnc(COc2cccc(C#N)c2)o1	ZINC000536017499	328652856	/nfs/dbraw/zinc/65/28/56/328652856.db2.gz	KFDPTSHIKSJKPZ-UHFFFAOYSA-N	0	0	290.322	4.101	20	30		CIEDRN
C[C@H](Nc1cccc(OCCCC#N)c1)C1CCCC1	ZINC000054080660	328686981	/nfs/dbraw/zinc/68/69/81/328686981.db2.gz	QPCDLBHSASPQLM-AWEZNQCLSA-N	0	0	272.392	4.360	20	30		CIEDRN
C[C@@H](Nc1cccc(OCCCC#N)c1)C1CCCC1	ZINC000054080662	328687064	/nfs/dbraw/zinc/68/70/64/328687064.db2.gz	QPCDLBHSASPQLM-CQSZACIVSA-N	0	0	272.392	4.360	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)C[C@@H](C)c1ccccc1C	ZINC000116007561	328688747	/nfs/dbraw/zinc/68/87/47/328688747.db2.gz	VHGIVXJEODPCSL-OAHLLOKOSA-N	0	0	292.382	4.307	20	30		CIEDRN
Cc1ccc(OCc2ccccc2C#N)c(Cl)c1	ZINC000054351088	328691364	/nfs/dbraw/zinc/69/13/64/328691364.db2.gz	YLBJIEXLJKPVLU-UHFFFAOYSA-N	0	0	257.720	4.099	20	30		CIEDRN
CC1(C#N)CCC(Nc2ccc(-c3cnco3)cc2)CC1	ZINC000336211930	328747403	/nfs/dbraw/zinc/74/74/03/328747403.db2.gz	RIWJUPGUSKUYKN-UHFFFAOYSA-N	0	0	281.359	4.226	20	30		CIEDRN
C=CCC(C)(C)C(=O)N(C)Cc1cc(Cl)ccc1F	ZINC000507673931	332818892	/nfs/dbraw/zinc/81/88/92/332818892.db2.gz	QDQILWBESVCNCJ-UHFFFAOYSA-N	0	0	283.774	4.040	20	30		CIEDRN
C=CCN(CC(F)(F)F)C(=O)C[C@@H](CC)c1ccccc1	ZINC000103384742	328769811	/nfs/dbraw/zinc/76/98/11/328769811.db2.gz	VNKQEYLUPYKEDT-CYBMUJFWSA-N	0	0	299.336	4.147	20	30		CIEDRN
C=CCC[C@H](NC(=O)N(C)C[C@@H](C)CC)c1ccccc1	ZINC000532495175	328782476	/nfs/dbraw/zinc/78/24/76/328782476.db2.gz	VQBHZLWWONYDHZ-RDJZCZTQSA-N	0	0	288.435	4.381	20	30		CIEDRN
Cc1c(F)cccc1N[C@H](C)c1ccc(C#N)cc1	ZINC000043319470	328786585	/nfs/dbraw/zinc/78/65/85/328786585.db2.gz	VBKATRURPLQJMU-GFCCVEGCSA-N	0	0	254.308	4.179	20	30		CIEDRN
C[C@H]1CCCC[C@@H]1Nc1c(C#N)cnc2ccccc21	ZINC000037507640	328805920	/nfs/dbraw/zinc/80/59/20/328805920.db2.gz	DIUJTQWDJCBFQL-WFASDCNBSA-N	0	0	265.360	4.097	20	30		CIEDRN
Cc1cn(Cc2cc(Cl)ccc2Cl)cc1C#N	ZINC000532767106	328809483	/nfs/dbraw/zinc/80/94/83/328809483.db2.gz	HVNNUPOSUSQUKV-UHFFFAOYSA-N	0	0	265.143	4.023	20	30		CIEDRN
C=C(C)CN(CC)C(=O)C1(c2cccc(F)c2)CCCC1	ZINC000104824806	328809882	/nfs/dbraw/zinc/80/98/82/328809882.db2.gz	WPNKIIDLPSZLKP-UHFFFAOYSA-N	0	0	289.394	4.062	20	30		CIEDRN
C[C@H](Nc1cccc2cc[nH]c21)c1cccc(C#N)c1	ZINC000526944360	328815672	/nfs/dbraw/zinc/81/56/72/328815672.db2.gz	CGZJQEYNAJSWAN-LBPRGKRZSA-N	0	0	261.328	4.213	20	30		CIEDRN
CC(C)CC[C@H]1CCCN1c1ccc(Cl)c(C#N)n1	ZINC000301682660	328829547	/nfs/dbraw/zinc/82/95/47/328829547.db2.gz	GSYIXINUPOCTLR-GFCCVEGCSA-N	0	0	277.799	4.012	20	30		CIEDRN
C=CCCCCCNC(=O)Nc1ccc2[nH]ccc2c1	ZINC000514611104	328838768	/nfs/dbraw/zinc/83/87/68/328838768.db2.gz	IWNKVGASEKIBNF-UHFFFAOYSA-N	0	0	271.364	4.036	20	30		CIEDRN
C=C(C)CCS[C@@H](C)C(=O)Nc1ccccc1C	ZINC000507802414	332824700	/nfs/dbraw/zinc/82/47/00/332824700.db2.gz	UXPKBPQAPJMSQO-ZDUSSCGKSA-N	0	0	263.406	4.021	20	30		CIEDRN
C=C(C)CCS[C@H](C)C(=O)Nc1ccccc1Cl	ZINC000507819056	332826286	/nfs/dbraw/zinc/82/62/86/332826286.db2.gz	MMUURJBAYZZVJI-LLVKDONJSA-N	0	0	283.824	4.366	20	30		CIEDRN
N#Cc1ccccc1CSCCOc1cccc(F)c1	ZINC000507821483	332826465	/nfs/dbraw/zinc/82/64/65/332826465.db2.gz	PDAALCFQRDXBPZ-UHFFFAOYSA-N	0	0	287.359	4.010	20	30		CIEDRN
C=C(C)CCSCC(=O)N[C@@H](C)c1ccc(CC)cc1	ZINC000507826241	332826622	/nfs/dbraw/zinc/82/66/22/332826622.db2.gz	VVRARSBMVXYKDO-AWEZNQCLSA-N	0	0	291.460	4.126	20	30		CIEDRN
Cn1cc(/C=C\c2nc(-c3ccccc3)cs2)cc1C#N	ZINC000358661468	328890207	/nfs/dbraw/zinc/89/02/07/328890207.db2.gz	MQDKKUFLJVLGCD-FPLPWBNLSA-N	0	0	291.379	4.191	20	30		CIEDRN
C[C@@H](CC1CCCCC1)C(=O)N(C)c1ccccc1C#N	ZINC000508088909	332833365	/nfs/dbraw/zinc/83/33/65/332833365.db2.gz	PZAWYDCHQNRPJR-AWEZNQCLSA-N	0	0	284.403	4.128	20	30		CIEDRN
C=C(C)CCS[C@H](C)C(=O)Nc1cccc(C)c1	ZINC000507865328	332828384	/nfs/dbraw/zinc/82/83/84/332828384.db2.gz	SQEJUNGAILLKEK-CYBMUJFWSA-N	0	0	263.406	4.021	20	30		CIEDRN
C=C(C)CCS[C@H](C)C(=O)N(CC)Cc1ccccc1	ZINC000507875290	332828586	/nfs/dbraw/zinc/82/85/86/332828586.db2.gz	PFAHEWVGPCRAOB-OAHLLOKOSA-N	0	0	291.460	4.123	20	30		CIEDRN
C=CCC[C@H](NC(=O)Nc1ccc(F)cn1)c1ccccc1	ZINC000360398018	328906284	/nfs/dbraw/zinc/90/62/84/328906284.db2.gz	QHPRZVZMZFDYGX-HNNXBMFYSA-N	0	0	299.349	4.050	20	30		CIEDRN
C=CCC[C@@H](NC(=O)Nc1ccc(F)cn1)c1ccccc1	ZINC000360398021	328906296	/nfs/dbraw/zinc/90/62/96/328906296.db2.gz	QHPRZVZMZFDYGX-OAHLLOKOSA-N	0	0	299.349	4.050	20	30		CIEDRN
CC(C)c1ccc([C@@H]2CCCN2C(=O)CCCC#N)cc1	ZINC000360402321	328906517	/nfs/dbraw/zinc/90/65/17/328906517.db2.gz	VWSKHKPONUQBON-KRWDZBQOSA-N	0	0	284.403	4.167	20	30		CIEDRN
CC[C@H](CC(=O)N(C)c1ccccc1C#N)c1ccccc1	ZINC000508086043	332833405	/nfs/dbraw/zinc/83/34/05/332833405.db2.gz	ZQKHAXZWYPATAV-OAHLLOKOSA-N	0	0	292.382	4.105	20	30		CIEDRN
Cc1cc(NC(=O)c2ccc(CC#N)cc2)cc(C)c1Cl	ZINC000508079864	332833537	/nfs/dbraw/zinc/83/35/37/332833537.db2.gz	RWQONEINEIHCMU-UHFFFAOYSA-N	0	0	298.773	4.275	20	30		CIEDRN
CCC1(CNc2cccc(C(F)F)c2C#N)CCOCC1	ZINC000582370081	328972674	/nfs/dbraw/zinc/97/26/74/328972674.db2.gz	FGGLBJBNXCSROQ-UHFFFAOYSA-N	0	0	294.345	4.115	20	30		CIEDRN
Cc1cn(Cc2cccc(Cl)c2Cl)cc1C#N	ZINC000582400141	328979667	/nfs/dbraw/zinc/97/96/67/328979667.db2.gz	CALLBRMYMJTFKA-UHFFFAOYSA-N	0	0	265.143	4.023	20	30		CIEDRN
C=CCCCC(=O)N1CCCC[C@H]1c1nc2ccccc2o1	ZINC000378145624	329041541	/nfs/dbraw/zinc/04/15/41/329041541.db2.gz	TYAOWJJWRUNHDO-HNNXBMFYSA-N	0	0	298.386	4.238	20	30		CIEDRN
C=CCCC(=O)N1CC=C(c2cccc3ccccc32)C1	ZINC000378603952	329056202	/nfs/dbraw/zinc/05/62/02/329056202.db2.gz	FNUMESLGEVVPII-UHFFFAOYSA-N	0	0	277.367	4.032	20	30		CIEDRN
CC1=C(C(=O)N2CCC(CCC#N)CC2)CCC(C)(C)C1	ZINC000582493425	329098016	/nfs/dbraw/zinc/09/80/16/329098016.db2.gz	YPWHKMSLHXUYBR-UHFFFAOYSA-N	0	0	288.435	4.055	20	30		CIEDRN
Cc1csc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)c1	ZINC000394260478	329109812	/nfs/dbraw/zinc/10/98/12/329109812.db2.gz	LOZMLDHHJZPNLT-UHFFFAOYSA-N	0	0	284.384	4.110	20	30		CIEDRN
C=C(C)CCc1noc(CCc2c[nH]c3c2cccc3C)n1	ZINC000508592825	332842513	/nfs/dbraw/zinc/84/25/13/332842513.db2.gz	CECDPWAWTIFHJA-UHFFFAOYSA-N	0	0	295.386	4.153	20	30		CIEDRN
C=C(C)CCc1noc([C@H]2C[C@H]2c2c(F)cccc2F)n1	ZINC000508595671	332842734	/nfs/dbraw/zinc/84/27/34/332842734.db2.gz	OOAXENZBIUFRJB-MNOVXSKESA-N	0	0	290.313	4.128	20	30		CIEDRN
N#Cc1c(F)cccc1SC[C@@H]1CCC2(CCCC2)O1	ZINC000582736912	329134308	/nfs/dbraw/zinc/13/43/08/329134308.db2.gz	LCZQNICRLJZWJZ-LBPRGKRZSA-N	0	0	291.391	4.281	20	30		CIEDRN
C=C(C)CCc1noc(C/C=C/c2ccc(C)cc2)n1	ZINC000508593926	332842784	/nfs/dbraw/zinc/84/27/84/332842784.db2.gz	HLMODHWNGWLHEZ-SNAWJCMRSA-N	0	0	268.360	4.143	20	30		CIEDRN
N#CCc1ccccc1NC(=O)[C@@H]1CCC[C@H]2CCCC[C@H]21	ZINC000582748371	329142422	/nfs/dbraw/zinc/14/24/22/329142422.db2.gz	BGIHVKYBGUEMCI-DJIMGWMZSA-N	0	0	296.414	4.298	20	30		CIEDRN
C=C(C)CCc1noc(-c2cccc(F)c2Cl)n1	ZINC000508600493	332843236	/nfs/dbraw/zinc/84/32/36/332843236.db2.gz	QPTLZSIDKIHXOE-UHFFFAOYSA-N	0	0	266.703	4.038	20	30		CIEDRN
C=C(C)CCc1noc([C@H](C)c2cc3ccccc3o2)n1	ZINC000508600474	332843289	/nfs/dbraw/zinc/84/32/89/332843289.db2.gz	QMVLWHORUICYNI-GFCCVEGCSA-N	0	0	282.343	4.476	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1cc(C2CC2)ccn1)c1ccccc1	ZINC000582758696	329147172	/nfs/dbraw/zinc/14/71/72/329147172.db2.gz	GIWRQAIKUFBIPS-CQSZACIVSA-N	0	0	292.382	4.257	20	30		CIEDRN
C=C(C)CCc1noc(-c2ccc(-c3ccco3)nc2C)n1	ZINC000508608412	332844020	/nfs/dbraw/zinc/84/40/20/332844020.db2.gz	JQQCGTCPCRIVST-UHFFFAOYSA-N	0	0	295.342	4.209	20	30		CIEDRN
C=CCCCC(=O)N(C)Cc1cccc(C(F)(F)F)c1	ZINC000175358706	329164663	/nfs/dbraw/zinc/16/46/63/329164663.db2.gz	SVVLCOPSIWGCCQ-UHFFFAOYSA-N	0	0	285.309	4.020	20	30		CIEDRN
C=CCCCC(=O)N(C)Cc1ccccc1C(F)(F)F	ZINC000175212076	329166437	/nfs/dbraw/zinc/16/64/37/329166437.db2.gz	RUWAXOQVJNMROQ-UHFFFAOYSA-N	0	0	285.309	4.020	20	30		CIEDRN
C=CCCCC(=O)N1CCC(c2ccccc2C)CC1	ZINC000175591170	329169094	/nfs/dbraw/zinc/16/90/94/329169094.db2.gz	UGLHYZFINIIHID-UHFFFAOYSA-N	0	0	271.404	4.057	20	30		CIEDRN
C=CCCCC(=O)N1CC[C@@H](C)C[C@H]1c1ccc(C)o1	ZINC000176106716	329173844	/nfs/dbraw/zinc/17/38/44/329173844.db2.gz	NMURBRTUNQDMBV-HIFRSBDPSA-N	0	0	275.392	4.244	20	30		CIEDRN
N#CCCCC(=O)Nc1ccccc1Nc1ccccc1	ZINC000486986790	329177375	/nfs/dbraw/zinc/17/73/75/329177375.db2.gz	KSIVEQDQZKEGFG-UHFFFAOYSA-N	0	0	279.343	4.063	20	30		CIEDRN
CCC1(C(=O)Nc2ccc(C(C)(C)C#N)cc2)CCC1	ZINC000176672249	329177858	/nfs/dbraw/zinc/17/78/58/329177858.db2.gz	SUBIFPTWVGWQNT-UHFFFAOYSA-N	0	0	270.376	4.007	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)N[C@H]2CCCC2(C)C)cc1	ZINC000176853005	329179255	/nfs/dbraw/zinc/17/92/55/329179255.db2.gz	XPYQXRKUFLQMBJ-HNNXBMFYSA-N	0	0	299.418	4.188	20	30		CIEDRN
C=C(C)CCc1noc(/C(C)=C/c2ccc([N+](=O)[O-])cc2)n1	ZINC000508661969	332846440	/nfs/dbraw/zinc/84/64/40/332846440.db2.gz	BEXQSKDNQBPPBI-ZRDIBKRKSA-N	0	0	299.330	4.047	20	30		CIEDRN
C=C(C)CCc1noc(Cc2ccc(C(F)(F)F)cc2)n1	ZINC000508643498	332845683	/nfs/dbraw/zinc/84/56/83/332845683.db2.gz	KACKEMHLPSALFO-UHFFFAOYSA-N	0	0	296.292	4.188	20	30		CIEDRN
C=C(C)CCc1noc(CSc2ccc(F)c(F)c2)n1	ZINC000508643460	332845690	/nfs/dbraw/zinc/84/56/90/332845690.db2.gz	JKBXLGIHSONWDS-UHFFFAOYSA-N	0	0	296.342	4.149	20	30		CIEDRN
C=C(C)CCc1noc(/C=C/c2ccccc2OCC)n1	ZINC000508646058	332846025	/nfs/dbraw/zinc/84/60/25/332846025.db2.gz	QPYATAHLFYYCMN-ZRDIBKRKSA-N	0	0	284.359	4.147	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1cc(F)c2ccccc2c1	ZINC000508646896	332846039	/nfs/dbraw/zinc/84/60/39/332846039.db2.gz	VRGNHOZLMPSMFE-HNNXBMFYSA-N	0	0	283.346	4.160	20	30		CIEDRN
C=C(C)CCc1noc(/C=C\c2ccc3[nH]ccc3c2)n1	ZINC000508659519	332846425	/nfs/dbraw/zinc/84/64/25/332846425.db2.gz	DORKBFGJIIQXOI-YVMONPNESA-N	0	0	279.343	4.230	20	30		CIEDRN
CC(C)(CCC(=O)NC1(C#N)CCCCC1)c1ccccc1	ZINC000179202026	329205958	/nfs/dbraw/zinc/20/59/58/329205958.db2.gz	SQWIAOXRTXVTQX-UHFFFAOYSA-N	0	0	298.430	4.087	20	30		CIEDRN
C=C(C)CCc1noc(COc2ccc(Cl)c(C)c2)n1	ZINC000508662506	332846582	/nfs/dbraw/zinc/84/65/82/332846582.db2.gz	CNMHJHQYONTMES-UHFFFAOYSA-N	0	0	292.766	4.119	20	30		CIEDRN
C#CCCCCC(=O)N1CCC[C@H]1c1ccccc1Cl	ZINC000179792217	329207554	/nfs/dbraw/zinc/20/75/54/329207554.db2.gz	VKJPETAPXXPVMS-INIZCTEOSA-N	0	0	289.806	4.197	20	30		CIEDRN
C=C(C)CCc1noc(CCCCC(=O)c2ccccc2)n1	ZINC000508666345	332846662	/nfs/dbraw/zinc/84/66/62/332846662.db2.gz	OLPPUXZABYBKHW-UHFFFAOYSA-N	0	0	298.386	4.174	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)c1csc(C)c1C	ZINC000179687058	329211202	/nfs/dbraw/zinc/21/12/02/329211202.db2.gz	WSYROGWYHJFHNP-UHFFFAOYSA-N	0	0	291.441	4.255	20	30		CIEDRN
Cc1cc(CN(CCC#N)Cc2ccco2)ccc1Cl	ZINC000180415297	329216390	/nfs/dbraw/zinc/21/63/90/329216390.db2.gz	QWMHXWYXGYDTJE-UHFFFAOYSA-N	0	0	288.778	4.157	20	30		CIEDRN
C[C@H]1CC(C(=O)N[C@@H](CCC#N)c2ccccc2)C[C@H](C)C1	ZINC000181159709	329233073	/nfs/dbraw/zinc/23/30/73/329233073.db2.gz	ZOACAZBBEPGJCW-RKVPGOIHSA-N	0	0	298.430	4.220	20	30		CIEDRN
Cc1ncc(CSCc2ccc(Cl)cc2C#N)s1	ZINC000184823032	329263087	/nfs/dbraw/zinc/26/30/87/329263087.db2.gz	PFDPEGMWOSSXBF-UHFFFAOYSA-N	0	0	294.832	4.410	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](c1ccco1)c1ccccc1	ZINC000185059444	329265261	/nfs/dbraw/zinc/26/52/61/329265261.db2.gz	OBRAYMWLQODAPZ-PBHICJAKSA-N	0	0	283.371	4.088	20	30		CIEDRN
Cc1cc(CSc2ncnc3sccc32)ccc1C#N	ZINC000582824993	329272518	/nfs/dbraw/zinc/27/25/18/329272518.db2.gz	YAKOMMPLVINZFX-UHFFFAOYSA-N	0	0	297.408	4.164	20	30		CIEDRN
Cc1ccccc1[C@@H]1C[C@@H](C)N(c2cccc(F)c2C#N)C1	ZINC000582992148	329294448	/nfs/dbraw/zinc/29/44/48/329294448.db2.gz	WMILTQWPKHUIRD-HUUCEWRRSA-N	0	0	294.373	4.388	20	30		CIEDRN
C=C(C)CCN[C@H](c1cccc(C)c1)C(F)(F)F	ZINC000509005470	332854949	/nfs/dbraw/zinc/85/49/49/332854949.db2.gz	DCPOOVXKDKPTFF-CYBMUJFWSA-N	0	0	257.299	4.154	20	30		CIEDRN
C=C(C)CCN[C@@H](c1cccc(F)c1F)C(F)(F)F	ZINC000508981168	332853732	/nfs/dbraw/zinc/85/37/32/332853732.db2.gz	ZXABQNODRKXTLN-LBPRGKRZSA-N	0	0	279.252	4.124	20	30		CIEDRN
Cc1cc([C@H](C)NCc2ccc(Cl)cc2C#N)c(C)o1	ZINC000187496997	329358113	/nfs/dbraw/zinc/35/81/13/329358113.db2.gz	QVWNAIWOWDCWID-NSHDSACASA-N	0	0	288.778	4.272	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1ccc[nH]1	ZINC000188059225	329364078	/nfs/dbraw/zinc/36/40/78/329364078.db2.gz	IARBGSCAEFIPDV-UHFFFAOYSA-N	0	0	268.360	4.119	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc3[nH]c(C)cc3c2)CCC1	ZINC000188431679	329368671	/nfs/dbraw/zinc/36/86/71/329368671.db2.gz	MNHGDWUNXDDQLE-UHFFFAOYSA-N	0	0	268.360	4.161	20	30		CIEDRN
Cc1ccc(NC(=O)c2cccc(C#N)c2C)cc1Cl	ZINC000509015589	332855855	/nfs/dbraw/zinc/85/58/55/332855855.db2.gz	NULQSVNSPCVWEG-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
CCc1cccc(CC)c1NC(=O)c1cccc(C#N)c1C	ZINC000509011041	332855888	/nfs/dbraw/zinc/85/58/88/332855888.db2.gz	AAECEZAHJDNKFX-UHFFFAOYSA-N	0	0	292.382	4.244	20	30		CIEDRN
C=CCC1(C(=O)Nc2cccc(-c3cnco3)c2)CCC1	ZINC000189071307	329375486	/nfs/dbraw/zinc/37/54/86/329375486.db2.gz	YXLOXGPVJCOKCO-UHFFFAOYSA-N	0	0	282.343	4.027	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(C)c(-c3ncco3)c2)CCC1	ZINC000189496003	329381732	/nfs/dbraw/zinc/38/17/32/329381732.db2.gz	OKJUGSOKCNGJHM-UHFFFAOYSA-N	0	0	296.370	4.335	20	30		CIEDRN
C[C@H](CC1CCCCC1)C(=O)Nc1ccccc1CC#N	ZINC000583226503	329381893	/nfs/dbraw/zinc/38/18/93/329381893.db2.gz	IRVVMIGSLKJASM-CQSZACIVSA-N	0	0	284.403	4.298	20	30		CIEDRN
CCCCN(C(=O)c1cccc(C#N)c1C)c1ccccc1	ZINC000509026591	332856487	/nfs/dbraw/zinc/85/64/87/332856487.db2.gz	MOPLIBFCCONRLA-UHFFFAOYSA-N	0	0	292.382	4.314	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)Cc1cc(C)on1	ZINC000189889533	329388861	/nfs/dbraw/zinc/38/88/61/329388861.db2.gz	YLNDZRUGOOVPEG-UHFFFAOYSA-N	0	0	298.386	4.016	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCCCO1	ZINC000189895773	329388968	/nfs/dbraw/zinc/38/89/68/329388968.db2.gz	JZCFVWGNYOLHHI-INIZCTEOSA-N	0	0	287.403	4.046	20	30		CIEDRN
N#CCCCSCc1cc(F)ccc1Br	ZINC000190936219	329403321	/nfs/dbraw/zinc/40/33/21/329403321.db2.gz	JGPAKNYFUIHPPS-UHFFFAOYSA-N	0	0	288.185	4.125	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(CSC)cc2)CCC1	ZINC000191127267	329409026	/nfs/dbraw/zinc/40/90/26/329409026.db2.gz	DNBBBUBJTYDDRC-UHFFFAOYSA-N	0	0	275.417	4.235	20	30		CIEDRN
C=C(C)CSc1nc2ccccc2n1C(F)F	ZINC000043875221	329433244	/nfs/dbraw/zinc/43/32/44/329433244.db2.gz	FNFJHOZZXHVVMM-UHFFFAOYSA-N	0	0	254.305	4.100	20	30		CIEDRN
CCC(CC)C(=O)Nc1ccccc1S[C@H](C)CC#N	ZINC000193055135	329438381	/nfs/dbraw/zinc/43/83/81/329438381.db2.gz	PEPFOHHJLHVSBE-GFCCVEGCSA-N	0	0	290.432	4.456	20	30		CIEDRN
CC[C@@](C)(C#N)c1nc(-c2ccc(OC(C)(C)C)cc2)no1	ZINC000583777992	329476782	/nfs/dbraw/zinc/47/67/82/329476782.db2.gz	XZSVNYWKVIWECB-KRWDZBQOSA-N	0	0	299.374	4.105	20	30		CIEDRN
C=CCC[C@@H](NC(=O)N(C)CC(C)(C)C)c1ccccc1	ZINC000509223702	332861784	/nfs/dbraw/zinc/86/17/84/332861784.db2.gz	LQCJIHNGBYAURT-MRXNPFEDSA-N	0	0	288.435	4.381	20	30		CIEDRN
N#Cc1cccc(CNc2ccc3c(c2)C(=O)CCCC3)c1	ZINC000584523233	329510794	/nfs/dbraw/zinc/51/07/94/329510794.db2.gz	NWSORIJXHZWGAG-UHFFFAOYSA-N	0	0	290.366	4.079	20	30		CIEDRN
N#Cc1ccc(F)c(CSc2ncccc2Cl)c1	ZINC000043895731	329546552	/nfs/dbraw/zinc/54/65/52/329546552.db2.gz	KRZZDKZTJRDYBJ-UHFFFAOYSA-N	0	0	278.739	4.038	20	30		CIEDRN
C=C(C)CN(CC)C(=O)CCSc1ccccc1Cl	ZINC000301995749	332864715	/nfs/dbraw/zinc/86/47/15/332864715.db2.gz	JLOUYRAJNUXINT-UHFFFAOYSA-N	0	0	297.851	4.247	20	30		CIEDRN
CC[C@@H](C)c1ccc(OCc2nc(C#N)cs2)cc1	ZINC000418774163	329551086	/nfs/dbraw/zinc/55/10/86/329551086.db2.gz	CVVACRXVVMKDMT-LLVKDONJSA-N	0	0	272.373	4.107	20	30		CIEDRN
Cc1ccc(C(C)C)cc1OCc1nc(C#N)cs1	ZINC000418788518	329552800	/nfs/dbraw/zinc/55/28/00/329552800.db2.gz	VVJYEJXZAYVIEH-UHFFFAOYSA-N	0	0	272.373	4.026	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N(C)[C@@H](CC)c1cccc(OC)c1	ZINC000425615339	329555003	/nfs/dbraw/zinc/55/50/03/329555003.db2.gz	XWDGWEIGQYGELU-INIZCTEOSA-N	0	0	289.419	4.207	20	30		CIEDRN
C[C@H](c1cccc(C#N)c1)N(C)C(=O)[C@H]1CC[C@@H](C)[C@@H](C)C1	ZINC000425108181	329595359	/nfs/dbraw/zinc/59/53/59/329595359.db2.gz	KMWSKQDYMNKIDP-FSZRXZPDSA-N	0	0	298.430	4.150	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(Cl)cc1COC	ZINC000425117427	329597114	/nfs/dbraw/zinc/59/71/14/329597114.db2.gz	WCWIPGYGGKGTSV-NSHDSACASA-N	0	0	281.783	4.027	20	30		CIEDRN
C[C@@H](CC(=O)N(C)[C@@H](C)c1cccc(C#N)c1)C(C)(C)C	ZINC000425129980	329603623	/nfs/dbraw/zinc/60/36/23/329603623.db2.gz	MTLNHGWQUSEZOR-KBPBESRZSA-N	0	0	286.419	4.150	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1ccc(C(=O)C2CCC2)cc1	ZINC000424803556	329612500	/nfs/dbraw/zinc/61/25/00/329612500.db2.gz	MQBSOATULLVMGR-UHFFFAOYSA-N	0	0	285.387	4.210	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@@H]1CC[C@@H](c2ccc(F)cc2)C1	ZINC000424807019	329616613	/nfs/dbraw/zinc/61/66/13/329616613.db2.gz	DVBVNXURYAQQRH-GDBMZVCRSA-N	0	0	289.394	4.180	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1ccccc1C(F)F	ZINC000425699656	329648071	/nfs/dbraw/zinc/64/80/71/329648071.db2.gz	JBAIXUWPHDHLRV-NSHDSACASA-N	0	0	282.334	4.491	20	30		CIEDRN
Cc1ccc(-c2ncc(CNc3cccc(C#N)c3)s2)o1	ZINC000132874055	329649492	/nfs/dbraw/zinc/64/94/92/329649492.db2.gz	HAAULXCHRIBBGT-UHFFFAOYSA-N	0	0	295.367	4.195	20	30		CIEDRN
CC1(C)CCC[C@H]1CNC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000564038799	329658658	/nfs/dbraw/zinc/65/86/58/329658658.db2.gz	VKXMVYNUQIMNIW-SJORKVTESA-N	0	0	298.430	4.016	20	30		CIEDRN
C=CCS[C@@H](C)C(=O)Nc1cccc2ccccc21	ZINC000564090572	329668218	/nfs/dbraw/zinc/66/82/18/329668218.db2.gz	QFKUCYDZPDGIBE-LBPRGKRZSA-N	0	0	271.385	4.086	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)c1cccc(C#N)c1C	ZINC000509475812	332871030	/nfs/dbraw/zinc/87/10/30/332871030.db2.gz	NWAHMIYQDOFXQW-UHFFFAOYSA-N	0	0	296.414	4.075	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@H](c1ccccc1)C(CC)CC	ZINC000498156006	329684567	/nfs/dbraw/zinc/68/45/67/329684567.db2.gz	LJADVHWYPPFMNE-KRWDZBQOSA-N	0	0	288.435	4.381	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1cccc(C2CC2)n1)c1ccccc1	ZINC000498164358	329694637	/nfs/dbraw/zinc/69/46/37/329694637.db2.gz	BVWDIOIFVVIIPC-MRXNPFEDSA-N	0	0	292.382	4.257	20	30		CIEDRN
CC(=O)c1sccc1OCCC1(C#N)CCCCC1	ZINC000418967020	329702618	/nfs/dbraw/zinc/70/26/18/329702618.db2.gz	RCIHUWKNHCRNIF-UHFFFAOYSA-N	0	0	277.389	4.194	20	30		CIEDRN
Cc1nc(N[C@@H]2CCCc3cc(C#N)ccc32)sc1C	ZINC000419015283	329703379	/nfs/dbraw/zinc/70/33/79/329703379.db2.gz	MFVFWJLSCNVIJW-OAHLLOKOSA-N	0	0	283.400	4.121	20	30		CIEDRN
C[C@H](Nc1ncc(C#N)cc1F)c1ccc(C2CC2)cc1	ZINC000419009074	329705602	/nfs/dbraw/zinc/70/56/02/329705602.db2.gz	VIGWEBXFYRERPJ-NSHDSACASA-N	0	0	281.334	4.143	20	30		CIEDRN
CC(C)c1noc(CSCCC2(C#N)CCCCC2)n1	ZINC000419389740	329721698	/nfs/dbraw/zinc/72/16/98/329721698.db2.gz	UBAOFXPWDWUTEF-UHFFFAOYSA-N	0	0	293.436	4.290	20	30		CIEDRN
CC(C)C[C@](C)(C#N)NC(=O)[C@@H]1CCC[C@@H]2CCCC[C@H]12	ZINC000509546797	332873404	/nfs/dbraw/zinc/87/34/04/332873404.db2.gz	WDZCSQJJMIZMCR-LISAXSMJSA-N	0	0	290.451	4.037	20	30		CIEDRN
CC(C)c1nc(CSCCC2(C#N)CCCCC2)no1	ZINC000419419357	329725298	/nfs/dbraw/zinc/72/52/98/329725298.db2.gz	YXRUUQJJLQDDIM-UHFFFAOYSA-N	0	0	293.436	4.290	20	30		CIEDRN
COCC[C@@H](C)SCCC1(C#N)CCCCC1	ZINC000419419855	329727400	/nfs/dbraw/zinc/72/74/00/329727400.db2.gz	DHADSXCYHUMAGS-CYBMUJFWSA-N	0	0	255.427	4.009	20	30		CIEDRN
N#CC1(CCSCc2ccc(CO)cc2)CCCCC1	ZINC000419458368	329731491	/nfs/dbraw/zinc/73/14/91/329731491.db2.gz	ZLEJOGJWEBYBMY-UHFFFAOYSA-N	0	0	289.444	4.276	20	30		CIEDRN
C[C@@H](SCCOCC1CCC1)c1cccc(C#N)c1	ZINC000419458891	329731501	/nfs/dbraw/zinc/73/15/01/329731501.db2.gz	CGNKNRXNUFSLGM-CYBMUJFWSA-N	0	0	275.417	4.169	20	30		CIEDRN
N#CC1(CSCc2ccc(Cl)cc2F)CCC1	ZINC000419461572	329731658	/nfs/dbraw/zinc/73/16/58/329731658.db2.gz	KATWSSMNNSWLOA-UHFFFAOYSA-N	0	0	269.772	4.406	20	30		CIEDRN
N#Cc1ccc(CSCCC2CCOCC2)c(Cl)c1	ZINC000419478589	329735866	/nfs/dbraw/zinc/73/58/66/329735866.db2.gz	NFYSUNYBWGGJIA-UHFFFAOYSA-N	0	0	295.835	4.262	20	30		CIEDRN
CC(C)(C#N)CCCCSCCC1CCOCC1	ZINC000419481056	329736178	/nfs/dbraw/zinc/73/61/78/329736178.db2.gz	QTEKRTQHYKZPJW-UHFFFAOYSA-N	0	0	269.454	4.256	20	30		CIEDRN
CC(C)(C#N)CCSCc1cnc2ccccc2c1	ZINC000419481690	329736335	/nfs/dbraw/zinc/73/63/35/329736335.db2.gz	WUSLYBRGOQLZBX-UHFFFAOYSA-N	0	0	270.401	4.408	20	30		CIEDRN
C=CCCCCCSCc1cccc(S(C)(=O)=O)c1	ZINC000419488008	329736922	/nfs/dbraw/zinc/73/69/22/329736922.db2.gz	BMCCMTVAFPOYRN-UHFFFAOYSA-N	0	0	298.473	4.070	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@@H](C)c1ccc(C2CC2)cc1	ZINC000419572755	329739639	/nfs/dbraw/zinc/73/96/39/329739639.db2.gz	QWZUPJHNKSZOPU-AWEZNQCLSA-N	0	0	286.419	4.233	20	30		CIEDRN
CSc1ccc(OCCSCC2(C#N)CCC2)cc1	ZINC000419576053	329739823	/nfs/dbraw/zinc/73/98/23/329739823.db2.gz	FUXRVSWXDCSYDO-UHFFFAOYSA-N	0	0	293.457	4.214	20	30		CIEDRN
CC[C@H](CSCCC1(C#N)CCCCC1)OC	ZINC000419621102	329740263	/nfs/dbraw/zinc/74/02/63/329740263.db2.gz	FNUIZVSWFLXFBE-CYBMUJFWSA-N	0	0	255.427	4.009	20	30		CIEDRN
CC(C)(C#N)CCCCSCC1(C#N)CCC1	ZINC000419589999	329741719	/nfs/dbraw/zinc/74/17/19/329741719.db2.gz	WBJGJJSXGUISKB-UHFFFAOYSA-N	0	0	250.411	4.134	20	30		CIEDRN
C[C@@H](SCC1(C#N)CCC1)c1ccccc1[N+](=O)[O-]	ZINC000419591712	329741898	/nfs/dbraw/zinc/74/18/98/329741898.db2.gz	XXLIWDYVCBQIQT-LLVKDONJSA-N	0	0	276.361	4.083	20	30		CIEDRN
CC(C)(C#N)CCCCSCc1nnc(C2CC2)s1	ZINC000419595977	329742144	/nfs/dbraw/zinc/74/21/44/329742144.db2.gz	MOYQOQXNJTUVSA-UHFFFAOYSA-N	0	0	295.477	4.369	20	30		CIEDRN
C=C(C)CCc1noc(C[C@H](c2ccc(O)cc2)C2CC2)n1	ZINC000420500232	329770406	/nfs/dbraw/zinc/77/04/06/329770406.db2.gz	FOGQIIIEQUKUMD-INIZCTEOSA-N	0	0	298.386	4.020	20	30		CIEDRN
CCCn1c2ccc(C#N)cc2nc1-c1ccsc1	ZINC000086636186	332877145	/nfs/dbraw/zinc/87/71/45/332877145.db2.gz	RKLSMKSCDDOZJK-UHFFFAOYSA-N	0	0	267.357	4.046	20	30		CIEDRN
CCCn1c2ccc(C#N)cc2nc1-c1cccc(F)c1	ZINC000086636205	332877214	/nfs/dbraw/zinc/87/72/14/332877214.db2.gz	MXYSHDJPVMZCIN-UHFFFAOYSA-N	0	0	279.318	4.124	20	30		CIEDRN
CC(C)[C@H]1CC[C@H](C(=O)Nc2ccc(CC#N)cc2)CC1	ZINC000509699701	332879752	/nfs/dbraw/zinc/87/97/52/332879752.db2.gz	RCMSTBHDIVGWDT-WKILWMFISA-N	0	0	284.403	4.154	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CC12CC2	ZINC000421503822	329839939	/nfs/dbraw/zinc/83/99/39/329839939.db2.gz	JKYBZUWTPZRFAO-HNNXBMFYSA-N	0	0	269.388	4.277	20	30		CIEDRN
Cc1c(C#N)c(C#N)ccc1NC(=O)CCCC1CCCC1	ZINC000421562321	329846660	/nfs/dbraw/zinc/84/66/60/329846660.db2.gz	VAHPTEYZIWJCCU-UHFFFAOYSA-N	0	0	295.386	4.037	20	30		CIEDRN
CC(C)c1ccccc1-n1ccnc1SCCC#N	ZINC000066400901	329847267	/nfs/dbraw/zinc/84/72/67/329847267.db2.gz	MSTBATWXCCRUTL-UHFFFAOYSA-N	0	0	271.389	4.001	20	30		CIEDRN
Cc1nc(SCCC#N)n(C2CCCCC2)c1C	ZINC000072636162	329858129	/nfs/dbraw/zinc/85/81/29/329858129.db2.gz	CPQAGWRFRNVQCW-UHFFFAOYSA-N	0	0	263.410	4.011	20	30		CIEDRN
C[C@H]1Sc2ccccc2N(CCCSCC#N)[C@@H]1C	ZINC000161229473	329915879	/nfs/dbraw/zinc/91/58/79/329915879.db2.gz	HVNKKPCWDYGJCA-CHWSQXEVSA-N	0	0	292.473	4.023	20	30		CIEDRN
CC(C)(C)CCc1noc([C@@H]2C[C@H]2c2cccc(C#N)c2)n1	ZINC000572107005	329945167	/nfs/dbraw/zinc/94/51/67/329945167.db2.gz	ZGHITWMRSRHIAG-LSDHHAIUSA-N	0	0	295.386	4.191	20	30		CIEDRN
C[C@H](Nc1cc(C#N)ccn1)c1ccc2c(c1)CCCC2	ZINC000572172282	329951838	/nfs/dbraw/zinc/95/18/38/329951838.db2.gz	ONUCARRULQVUCP-ZDUSSCGKSA-N	0	0	277.371	4.005	20	30		CIEDRN
CC(C)(C#N)CCCSCCc1ccc2c(c1)CCO2	ZINC000161883699	329958541	/nfs/dbraw/zinc/95/85/41/329958541.db2.gz	CIFCIRLOXUXDKC-UHFFFAOYSA-N	0	0	289.444	4.227	20	30		CIEDRN
C[C@H](CCC(=O)N[C@@H](C#N)C1CCCCC1)c1ccccc1	ZINC000161918634	329959721	/nfs/dbraw/zinc/95/97/21/329959721.db2.gz	ADYOINNNUHMSIJ-QAPCUYQASA-N	0	0	298.430	4.159	20	30		CIEDRN
C=CCOc1ccccc1-c1nc(CC2CCCC2)no1	ZINC000572265631	329963140	/nfs/dbraw/zinc/96/31/40/329963140.db2.gz	OJOAQVYHCYSUTF-UHFFFAOYSA-N	0	0	284.359	4.034	20	30		CIEDRN
C=C(Cl)CSc1nnc(C[C@@H](C)c2ccccc2)o1	ZINC000255939365	329966236	/nfs/dbraw/zinc/96/62/36/329966236.db2.gz	RROUWIBTTCKPDO-SNVBAGLBSA-N	0	0	294.807	4.260	20	30		CIEDRN
C=CCN(C(=O)c1ccc(OCCCCC)cc1)C1CC1	ZINC000536819353	329968093	/nfs/dbraw/zinc/96/80/93/329968093.db2.gz	CMJAVNPIRMZWPZ-UHFFFAOYSA-N	0	0	287.403	4.046	20	30		CIEDRN
N#Cc1ccc(CNc2ncccc2-c2ccccc2)cc1	ZINC000162381700	330010532	/nfs/dbraw/zinc/01/05/32/330010532.db2.gz	LAAQEBLKQNWSGV-UHFFFAOYSA-N	0	0	285.350	4.232	20	30		CIEDRN
C=C(C)CN(CC)C(=O)[C@H](C)CC1CCCCC1	ZINC000510088461	332891554	/nfs/dbraw/zinc/89/15/54/332891554.db2.gz	KDODOTGYOFZPQZ-CQSZACIVSA-N	0	0	251.414	4.018	20	30		CIEDRN
C=CCCC(=O)N1CCCCC[C@H]1c1ccc(OC)cc1	ZINC000263694322	330060215	/nfs/dbraw/zinc/06/02/15/330060215.db2.gz	SCLSDLMJBJYOCK-KRWDZBQOSA-N	0	0	287.403	4.105	20	30		CIEDRN
C=C1CCN(C(=O)CCc2ccc(Cl)c(Cl)c2)CC1	ZINC000264468904	330061426	/nfs/dbraw/zinc/06/14/26/330061426.db2.gz	IITSWKYDPFYFRU-UHFFFAOYSA-N	0	0	298.213	4.105	20	30		CIEDRN
C=C1CCN(C(=O)[C@H]2C[C@H]2c2cccc3ccccc32)CC1	ZINC000264440420	330061577	/nfs/dbraw/zinc/06/15/77/330061577.db2.gz	BRUFLYUJPQZYLH-OALUTQOASA-N	0	0	291.394	4.122	20	30		CIEDRN
C=CCCC(=O)N(C(C)C)[C@H](C)c1ccsc1	ZINC000421694905	330067841	/nfs/dbraw/zinc/06/78/41/330067841.db2.gz	WGPZIYAVFVRRPG-GFCCVEGCSA-N	0	0	251.395	4.012	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H](CC(F)F)c1ccccc1	ZINC000421698022	330068483	/nfs/dbraw/zinc/06/84/83/330068483.db2.gz	HLDWPFPIGXEBEE-HNNXBMFYSA-N	0	0	293.357	4.268	20	30		CIEDRN
C=CCCCC(=O)Nc1c(C)cc(C)cc1Br	ZINC000269455895	330069915	/nfs/dbraw/zinc/06/99/15/330069915.db2.gz	MBMVEOCLBFSPMW-UHFFFAOYSA-N	0	0	296.208	4.361	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)Nc1ccccc1C(C)C)OCC	ZINC000270068661	330073138	/nfs/dbraw/zinc/07/31/38/330073138.db2.gz	WWBYAHHUXAHUCY-MRXNPFEDSA-N	0	0	275.392	4.120	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@H](C)CCc1ccco1)c1ccccc1	ZINC000270189402	330073490	/nfs/dbraw/zinc/07/34/90/330073490.db2.gz	BSAWODDISHLZGA-HZPDHXFCSA-N	0	0	297.398	4.077	20	30		CIEDRN
C=CCCCN(C)C(=O)c1ccccc1CCC(F)(F)F	ZINC000270342744	330075157	/nfs/dbraw/zinc/07/51/57/330075157.db2.gz	QZTMLPWJMFCDSD-UHFFFAOYSA-N	0	0	299.336	4.220	20	30		CIEDRN
C#CCCCSc1nnc([C@@H](CC)c2ccccc2)o1	ZINC000270890319	330076752	/nfs/dbraw/zinc/07/67/52/330076752.db2.gz	RAKJIUCXMPSQIK-AWEZNQCLSA-N	0	0	286.400	4.117	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@H](c2cccc(C)c2)C1	ZINC000273022314	330090182	/nfs/dbraw/zinc/09/01/82/330090182.db2.gz	ASYLJLOLQMAYAL-SFHVURJKSA-N	0	0	283.415	4.079	20	30		CIEDRN
C[C@H](N[C@H](CCC#N)c1ccccc1)c1ccncc1Cl	ZINC000421833839	330091496	/nfs/dbraw/zinc/09/14/96/330091496.db2.gz	JNYCRNSOJHGWPB-SUMWQHHRSA-N	0	0	299.805	4.431	20	30		CIEDRN
C=CCCO[C@H](C)c1nc([C@H]2CCC[C@@H](C)C2)no1	ZINC000273945291	330101080	/nfs/dbraw/zinc/10/10/80/330101080.db2.gz	NKATVSYPZWFUMT-UPJWGTAASA-N	0	0	264.369	4.017	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@H]1c1ccsc1	ZINC000274278090	330104018	/nfs/dbraw/zinc/10/40/18/330104018.db2.gz	JLEXBSGJKPQNKO-OCCSQVGLSA-N	0	0	263.406	4.014	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(Cc2cccc3cccnc32)no1	ZINC000274296480	330104193	/nfs/dbraw/zinc/10/41/93/330104193.db2.gz	ADJJCKHTZXNCCI-ZDUSSCGKSA-N	0	0	293.370	4.278	20	30		CIEDRN
C=C(C)[C@H](N[C@@H](C)c1cscn1)c1ccc(F)c(F)c1	ZINC000274804147	330108093	/nfs/dbraw/zinc/10/80/93/330108093.db2.gz	WBLVFOZQVHFKRM-BONVTDFDSA-N	0	0	294.370	4.389	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1cccc(SC(F)F)c1	ZINC000276175883	330112356	/nfs/dbraw/zinc/11/23/56/330112356.db2.gz	USUSCXVTCAIAQT-UHFFFAOYSA-N	0	0	286.347	4.041	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1cc(Cl)ccc1Cl	ZINC000276358805	330113059	/nfs/dbraw/zinc/11/30/59/330113059.db2.gz	VKOSSACQBRLGLA-UHFFFAOYSA-N	0	0	273.163	4.033	20	30		CIEDRN
C=CCC[C@H]([NH2+]C[C@H](CCO)c1ccccc1)c1ccco1	ZINC000276479314	330113289	/nfs/dbraw/zinc/11/32/89/330113289.db2.gz	RIKXHRSBUNQKLA-ROUUACIJSA-N	0	0	299.414	4.043	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)NCC(=C)Cl	ZINC000276414718	330113295	/nfs/dbraw/zinc/11/32/95/330113295.db2.gz	MUIINRSPCGMAPB-UHFFFAOYSA-N	0	0	292.810	4.413	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H]1C[C@H]1C	ZINC000276441975	330113549	/nfs/dbraw/zinc/11/35/49/330113549.db2.gz	RSTCXYZUCSRHME-HIFRSBDPSA-N	0	0	286.419	4.316	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC)c1ccc2[nH]ccc2c1	ZINC000276731821	330114539	/nfs/dbraw/zinc/11/45/39/330114539.db2.gz	XVXKQXCGGOOJHD-ZDUSSCGKSA-N	0	0	270.376	4.123	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H]1CC[C@@H](c2ccc(F)cc2)C1	ZINC000510155057	332895099	/nfs/dbraw/zinc/89/50/99/332895099.db2.gz	UQSAOPVQKCIJEP-GDBMZVCRSA-N	0	0	289.394	4.180	20	30		CIEDRN
C=CCC[C@H]([NH2+]Cc1ccc(F)nc1C)c1ccccc1	ZINC000278535966	330117565	/nfs/dbraw/zinc/11/75/65/330117565.db2.gz	SLZDKZDCUQHZDH-KRWDZBQOSA-N	0	0	284.378	4.326	20	30		CIEDRN
C=CCCO[C@H](C)c1nc(-c2ccc(Cl)s2)no1	ZINC000277807525	330118474	/nfs/dbraw/zinc/11/84/74/330118474.db2.gz	BDXFBHWRAHKWKO-MRVPVSSYSA-N	0	0	284.768	4.105	20	30		CIEDRN
N#Cc1cc(Cl)ccc1CNC1(C(F)F)CCCCC1	ZINC000510161786	332895592	/nfs/dbraw/zinc/89/55/92/332895592.db2.gz	XVDKRTHHDUFMCX-UHFFFAOYSA-N	0	0	298.764	4.269	20	30		CIEDRN
N#Cc1ccc(CN(C(=O)C2CCCCCC2)C2CC2)cc1	ZINC000171027170	330126264	/nfs/dbraw/zinc/12/62/64/330126264.db2.gz	VUYSANLFUVIVMX-UHFFFAOYSA-N	0	0	296.414	4.020	20	30		CIEDRN
Cc1cc(C)c(C#N)c(SCc2cc(F)ccc2F)n1	ZINC000510278120	332899279	/nfs/dbraw/zinc/89/92/79/332899279.db2.gz	BRNACRPAVITQQP-UHFFFAOYSA-N	0	0	290.338	4.141	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1	ZINC000536833288	330229827	/nfs/dbraw/zinc/22/98/27/330229827.db2.gz	MXQAJRYLKHNQGK-DLBZAZTESA-N	0	0	289.394	4.134	20	30		CIEDRN
C=CCCC1(C(=O)N[C@H]2CCCCc3ccccc32)CC1	ZINC000527240490	330240869	/nfs/dbraw/zinc/24/08/69/330240869.db2.gz	OSVPXJYNWLZVKE-KRWDZBQOSA-N	0	0	283.415	4.317	20	30		CIEDRN
Cc1cc(C)c(CNc2cccc(F)c2C#N)c(C)c1	ZINC000036138577	330249585	/nfs/dbraw/zinc/24/95/85/330249585.db2.gz	WHOYMHOBVGMIFC-UHFFFAOYSA-N	0	0	268.335	4.235	20	30		CIEDRN
C[C@H](C#N)c1ccc(-c2ccc3c(c2)CCOC3)cc1	ZINC000527589832	330264815	/nfs/dbraw/zinc/26/48/15/330264815.db2.gz	KGFRKYPSCQGRSX-CYBMUJFWSA-N	0	0	263.340	4.053	20	30		CIEDRN
CCN(C(=O)C[C@@H]1CCC[C@H](C)C1)c1ccc(C#N)cc1	ZINC000510380256	332901586	/nfs/dbraw/zinc/90/15/86/332901586.db2.gz	RBZIUJUEQYRNDR-GOEBONIOSA-N	0	0	284.403	4.128	20	30		CIEDRN
CCC(C#N)(CC)C(=O)N[C@H](C)c1oc2ccccc2c1C	ZINC000528041562	330305810	/nfs/dbraw/zinc/30/58/10/330305810.db2.gz	YBQNGZOLLNORNK-CYBMUJFWSA-N	0	0	298.386	4.248	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H]2C[C@H]2c2ccsc2)n1	ZINC000528201432	330312812	/nfs/dbraw/zinc/31/28/12/330312812.db2.gz	AXAHPOSVCGDUIU-NWDGAFQWSA-N	0	0	274.389	4.256	20	30		CIEDRN
CCC(F)(F)C(C)(C)CNc1ncc(C#N)cc1Cl	ZINC000528183355	330314119	/nfs/dbraw/zinc/31/41/19/330314119.db2.gz	YNIPVFCZBOOBJP-UHFFFAOYSA-N	0	0	287.741	4.090	20	30		CIEDRN
C=CCC(CC=C)c1nc(C(C)(C)c2cc(C)ccn2)no1	ZINC000528267411	330318075	/nfs/dbraw/zinc/31/80/75/330318075.db2.gz	SIHCPPQXABCUIE-UHFFFAOYSA-N	0	0	297.402	4.335	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)c1oc2ccc(Cl)cc2c1C	ZINC000116850702	330321628	/nfs/dbraw/zinc/32/16/28/330321628.db2.gz	NBDLFFPIOKLMKA-SECBINFHSA-N	0	0	277.751	4.089	20	30		CIEDRN
CCN(CCC#N)[C@@H](c1ccccc1)c1ccc(F)cc1	ZINC000533063130	330325462	/nfs/dbraw/zinc/32/54/62/330325462.db2.gz	ZXKAIODEPGAOKB-SFHVURJKSA-N	0	0	282.362	4.151	20	30		CIEDRN
CCN(CCC#N)[C@H](c1ccccc1)c1ccc(F)cc1	ZINC000533063129	330325518	/nfs/dbraw/zinc/32/55/18/330325518.db2.gz	ZXKAIODEPGAOKB-GOSISDBHSA-N	0	0	282.362	4.151	20	30		CIEDRN
Cc1cc(C)c(C#N)c(NCc2ccc(C(C)C)cc2)n1	ZINC000044381912	330327997	/nfs/dbraw/zinc/32/79/97/330327997.db2.gz	KTLPLAYFVZEMBP-UHFFFAOYSA-N	0	0	279.387	4.306	20	30		CIEDRN
C[C@H](CCc1ccccc1)Nc1ccc(C#N)cc1F	ZINC000044482822	330328373	/nfs/dbraw/zinc/32/83/73/330328373.db2.gz	MEOKJALNKLTVNT-CYBMUJFWSA-N	0	0	268.335	4.131	20	30		CIEDRN
C=C(C)C(C)(C)c1nc(Cc2cccc3cccnc32)no1	ZINC000424220886	330329603	/nfs/dbraw/zinc/32/96/03/330329603.db2.gz	JLTWSDPXNSFURJ-UHFFFAOYSA-N	0	0	293.370	4.062	20	30		CIEDRN
CCC(C#N)(CC)C(=O)Nc1ccc(C)c(C(F)(F)F)c1	ZINC000044767366	330332927	/nfs/dbraw/zinc/33/29/27/330332927.db2.gz	MCIYYKFDDLBAAT-UHFFFAOYSA-N	0	0	298.308	4.282	20	30		CIEDRN
C=CCOc1ccccc1C(=O)Nc1ccccc1CC	ZINC000045180373	330340724	/nfs/dbraw/zinc/34/07/24/330340724.db2.gz	FSUNBVPEUZQGLT-UHFFFAOYSA-N	0	0	281.355	4.066	20	30		CIEDRN
C=C(C)C(C)(C)c1nc(Cc2csc(C(C)C)n2)no1	ZINC000424339522	330343915	/nfs/dbraw/zinc/34/39/15/330343915.db2.gz	CXLNUHWQZZMTRA-UHFFFAOYSA-N	0	0	291.420	4.094	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)[C@H]1CC=CCC1	ZINC000045905726	330349894	/nfs/dbraw/zinc/34/98/94/330349894.db2.gz	VMYBJNXNMCJVKM-LBPRGKRZSA-N	0	0	295.835	4.272	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)[C@@H]1CC=CCC1	ZINC000045905729	330349923	/nfs/dbraw/zinc/34/99/23/330349923.db2.gz	VMYBJNXNMCJVKM-GFCCVEGCSA-N	0	0	295.835	4.272	20	30		CIEDRN
C=C(C)CSCc1csc(-c2ccoc2)n1	ZINC000108420022	330354658	/nfs/dbraw/zinc/35/46/58/330354658.db2.gz	HCEPMBKHBIQCFR-UHFFFAOYSA-N	0	0	251.376	4.212	20	30		CIEDRN
C=CCC[C@H](NC(=O)N1C2CCC1CC2)c1ccccc1	ZINC000533262662	330355807	/nfs/dbraw/zinc/35/58/07/330355807.db2.gz	IZZWWEKWJBHYHF-JCYILVPMSA-N	0	0	284.403	4.030	20	30		CIEDRN
C=C(CC)CSCC(=O)N[C@H](C)c1ccc(Cl)cc1	ZINC000536880804	330358248	/nfs/dbraw/zinc/35/82/48/330358248.db2.gz	FPXDLCFUNNUUNL-GFCCVEGCSA-N	0	0	297.851	4.217	20	30		CIEDRN
C=C(CC)CS[C@H](C)C(=O)Nc1cc(C)ccc1C	ZINC000536882850	330360903	/nfs/dbraw/zinc/36/09/03/330360903.db2.gz	ZWQDGEDQKPHCQH-CQSZACIVSA-N	0	0	277.433	4.330	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)C1c2ccccc2Oc2ccccc21	ZINC000116987479	330362934	/nfs/dbraw/zinc/36/29/34/330362934.db2.gz	AZOMQEPYIKSECK-CYBMUJFWSA-N	0	0	293.366	4.005	20	30		CIEDRN
C=C(CC)CSc1nnc(C2CC2)n1Cc1ccccc1	ZINC000536903876	330363694	/nfs/dbraw/zinc/36/36/94/330363694.db2.gz	GZRXUSKTTJBYEG-UHFFFAOYSA-N	0	0	299.443	4.262	20	30		CIEDRN
CC(C)(C)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1	ZINC000055428099	330365442	/nfs/dbraw/zinc/36/54/42/330365442.db2.gz	HDRRSSRMQKXYOW-UHFFFAOYSA-N	0	0	294.354	4.335	20	30		CIEDRN
C=CCCCSc1nnc(C2CC2)n1Cc1ccccc1	ZINC000117547688	330365977	/nfs/dbraw/zinc/36/59/77/330365977.db2.gz	IKMNNILANYJKDE-UHFFFAOYSA-N	0	0	299.443	4.262	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1ccc(Cc2ccncc2)cc1	ZINC000424530341	330367633	/nfs/dbraw/zinc/36/76/33/330367633.db2.gz	GVYOROMDDSAAQK-UHFFFAOYSA-N	0	0	294.398	4.213	20	30		CIEDRN
N#Cc1ccc(CNc2ccc(Cl)c(Cl)c2)o1	ZINC000119125393	330371049	/nfs/dbraw/zinc/37/10/49/330371049.db2.gz	HEYVGNCHXJEOQQ-UHFFFAOYSA-N	0	0	267.115	4.070	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@@H](C)c1ccccc1Cl	ZINC000424541393	330371649	/nfs/dbraw/zinc/37/16/49/330371649.db2.gz	KCRPTPRYIOLFPV-NSHDSACASA-N	0	0	265.784	4.120	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1cccc(F)c1F)c1ccccc1	ZINC000119326588	330372864	/nfs/dbraw/zinc/37/28/64/330372864.db2.gz	MOBYXPYOHDUHPN-LBPRGKRZSA-N	0	0	287.309	4.263	20	30		CIEDRN
C=CCC1(C(=O)Nc2cccc(C(C)C)c2)CCOCC1	ZINC000424549506	330374036	/nfs/dbraw/zinc/37/40/36/330374036.db2.gz	WMFMWOFABPWPHM-UHFFFAOYSA-N	0	0	287.403	4.121	20	30		CIEDRN
C[C@@H](c1ccc(Cl)cc1Cl)N1CCC(C#N)CC1	ZINC000057872725	330379251	/nfs/dbraw/zinc/37/92/51/330379251.db2.gz	ZENXMBYZLLYFHC-JTQLQIEISA-N	0	0	283.202	4.290	20	30		CIEDRN
N#CC1CCN(Cc2sc3ccccc3c2Cl)CC1	ZINC000057880303	330380451	/nfs/dbraw/zinc/38/04/51/330380451.db2.gz	RMHHBLZVHZVPQP-UHFFFAOYSA-N	0	0	290.819	4.290	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@@H]1CCCC[C@@H]1C	ZINC000424569806	330380724	/nfs/dbraw/zinc/38/07/24/330380724.db2.gz	VMOSWTBLMOTKIF-DZGCQCFKSA-N	0	0	277.433	4.089	20	30		CIEDRN
C[C@H]1CCC[C@@H](CCN(CCC#N)Cc2ccccn2)C1	ZINC000089129866	330380743	/nfs/dbraw/zinc/38/07/43/330380743.db2.gz	JNEOEFQSKIZCSO-IRXDYDNUSA-N	0	0	285.435	4.014	20	30		CIEDRN
C=CCN(C(=O)CCc1ccc(C)cc1C)c1ccccc1	ZINC000058642407	330391628	/nfs/dbraw/zinc/39/16/28/330391628.db2.gz	ZZSYSIMWWKHDJN-UHFFFAOYSA-N	0	0	293.410	4.455	20	30		CIEDRN
CC(C)CN(Cc1cccc(C#N)c1F)c1cccc(O)c1	ZINC000537048103	330394413	/nfs/dbraw/zinc/39/44/13/330394413.db2.gz	KYZGRAAXICRMDI-UHFFFAOYSA-N	0	0	298.361	4.066	20	30		CIEDRN
C=CCCC[C@@H](C)Sc1nnc(-c2ccoc2C)n1C	ZINC000537074067	330396924	/nfs/dbraw/zinc/39/69/24/330396924.db2.gz	URRINXVPDXHQQU-LLVKDONJSA-N	0	0	291.420	4.220	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@@H](C)c1ccccc1)c1ccccc1	ZINC000121403496	330400011	/nfs/dbraw/zinc/40/00/11/330400011.db2.gz	GBVSSCGEAXXJQM-JKSUJKDBSA-N	0	0	279.383	4.224	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1ccc(F)cc1F)c1ccccc1	ZINC000121911677	330408263	/nfs/dbraw/zinc/40/82/63/330408263.db2.gz	NMIZFHBLSLTAIH-LBPRGKRZSA-N	0	0	287.309	4.263	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N[C@@H](c1ccccc1)C1CC1	ZINC000537184940	330412625	/nfs/dbraw/zinc/41/26/25/330412625.db2.gz	KLWQXLVJCUZXKC-PBHICJAKSA-N	0	0	286.419	4.182	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N[C@H](c1ccccc1)C1CC1	ZINC000537184941	330412701	/nfs/dbraw/zinc/41/27/01/330412701.db2.gz	KLWQXLVJCUZXKC-RHSMWYFYSA-N	0	0	286.419	4.182	20	30		CIEDRN
C=CCn1c(C)nnc1S[C@@H](C)c1cccc(Cl)c1	ZINC000060423855	330414441	/nfs/dbraw/zinc/41/44/41/330414441.db2.gz	FNDIKQQYAVFFJE-JTQLQIEISA-N	0	0	293.823	4.279	20	30		CIEDRN
CC[C@H](C#N)Nc1cccc(COc2ccccc2)c1C	ZINC000122252610	330416396	/nfs/dbraw/zinc/41/63/96/330416396.db2.gz	AYIIWALVZJWLCT-MRXNPFEDSA-N	0	0	280.371	4.288	20	30		CIEDRN
C[C@@H](CC#N)N(C)Cc1cc(C(F)(F)F)ccc1Cl	ZINC000093090578	330416747	/nfs/dbraw/zinc/41/67/47/330416747.db2.gz	TZSUGQJLESGKIF-VIFPVBQESA-N	0	0	290.716	4.093	20	30		CIEDRN
C[C@H](NCc1ccc([C@H]2C[C@@H]2C)o1)c1ccc(C#N)c(F)c1	ZINC000537408100	330435009	/nfs/dbraw/zinc/43/50/09/330435009.db2.gz	QWGZTIQHVOSCSW-MKBNYLNASA-N	0	0	298.361	4.265	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Nc1ncc(CCC)s1	ZINC000537386900	330435628	/nfs/dbraw/zinc/43/56/28/330435628.db2.gz	QFUPFDIDCHFLMF-UHFFFAOYSA-N	0	0	295.452	4.306	20	30		CIEDRN
CC(C)[C@H](Nc1cccc(OCCCC#N)c1)C1CC1	ZINC000537427248	330436665	/nfs/dbraw/zinc/43/66/65/330436665.db2.gz	SAYHFWBXVOCDTF-KRWDZBQOSA-N	0	0	272.392	4.216	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)NC[C@H]1CCC[C@H](C(F)(F)F)C1	ZINC000424708315	330451916	/nfs/dbraw/zinc/45/19/16/330451916.db2.gz	DVQIVQSLYXFRLW-RYUDHWBXSA-N	0	0	291.357	4.074	20	30		CIEDRN
C[C@@H]1CCN(c2c(C#N)cnc3ccccc32)CC12CCC2	ZINC000537822296	330458332	/nfs/dbraw/zinc/45/83/32/330458332.db2.gz	DSITVUAWQGFVTC-CQSZACIVSA-N	0	0	291.398	4.123	20	30		CIEDRN
C=CCN(C(=O)[C@H]1CCC(C)(C)C1)c1ccccc1	ZINC000514169228	330460711	/nfs/dbraw/zinc/46/07/11/330460711.db2.gz	GKEAOPATIXQRQA-AWEZNQCLSA-N	0	0	257.377	4.032	20	30		CIEDRN
C=CCCCN(C)C(=O)c1cc2c(s1)CCCCC2	ZINC000515016514	330468957	/nfs/dbraw/zinc/46/89/57/330468957.db2.gz	JLRHTHIWZRMMBI-UHFFFAOYSA-N	0	0	277.433	4.055	20	30		CIEDRN
C[C@@H]1CCC[C@H](CC(=O)N[C@](C)(C#N)C2CCCCC2)C1	ZINC000515482748	330478268	/nfs/dbraw/zinc/47/82/68/330478268.db2.gz	PQOTUPADQLEQPF-RVKKMQEKSA-N	0	0	290.451	4.182	20	30		CIEDRN
N#Cc1cccc(OCCSCc2ccccc2F)c1	ZINC000515721190	330482038	/nfs/dbraw/zinc/48/20/38/330482038.db2.gz	BNTKUOZXKUFLAK-UHFFFAOYSA-N	0	0	287.359	4.010	20	30		CIEDRN
N#Cc1cnc2ccccc2c1NCc1ccc(Cl)s1	ZINC000083684350	330482923	/nfs/dbraw/zinc/48/29/23/330482923.db2.gz	XSHNUXYIDGBXDQ-UHFFFAOYSA-N	0	0	299.786	4.433	20	30		CIEDRN
C=CCC1(C(=O)N2C[C@H](C)[C@@H]2c2ccccc2)CCCC1	ZINC000515848661	330484019	/nfs/dbraw/zinc/48/40/19/330484019.db2.gz	JEQRSHCGJRFAJK-DOTOQJQBSA-N	0	0	283.415	4.343	20	30		CIEDRN
CN(Cc1cccc(F)c1)c1cccc(C(F)F)c1C#N	ZINC000516442276	330492848	/nfs/dbraw/zinc/49/28/48/330492848.db2.gz	OIYCIDGXFCTBHU-UHFFFAOYSA-N	0	0	290.288	4.271	20	30		CIEDRN
C=C(C)CN(CC)C(=O)NCc1ccc(C2CCC2)cc1	ZINC000426104318	330499822	/nfs/dbraw/zinc/49/98/22/330499822.db2.gz	QCLKWRYJNNHEMM-UHFFFAOYSA-N	0	0	286.419	4.062	20	30		CIEDRN
CCC[C@H](NCc1cccc(F)c1C#N)c1ccccc1	ZINC000428307192	330519768	/nfs/dbraw/zinc/51/97/68/330519768.db2.gz	SKXXWKPICOIWMU-SFHVURJKSA-N	0	0	282.362	4.328	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000429919397	330556504	/nfs/dbraw/zinc/55/65/04/330556504.db2.gz	FAZDMTSUDJOJAL-NSHDSACASA-N	0	0	299.336	4.485	20	30		CIEDRN
C=CCN(CCC#N)Cc1ccc(-c2cccc(F)c2C)o1	ZINC000430089564	330559348	/nfs/dbraw/zinc/55/93/48/330559348.db2.gz	KDPGOHRHOVQIKN-UHFFFAOYSA-N	0	0	298.361	4.296	20	30		CIEDRN
CC(C)(C)c1csc(/C=C/c2cccc(C#N)c2)n1	ZINC000430130123	330562001	/nfs/dbraw/zinc/56/20/01/330562001.db2.gz	VUQWLMSTFWMLHG-BQYQJAHWSA-N	0	0	268.385	4.483	20	30		CIEDRN
C=CCC[C@H](NC(=O)N1CCC(C)=C(C)C1)c1ccccc1	ZINC000430903701	330576650	/nfs/dbraw/zinc/57/66/50/330576650.db2.gz	KPWWMRHJIDRFJZ-SFHVURJKSA-N	0	0	298.430	4.446	20	30		CIEDRN
N#Cc1ccc(/C=C/c2ccc(C(F)(F)F)s2)nc1	ZINC000431580256	330586714	/nfs/dbraw/zinc/58/67/14/330586714.db2.gz	SXJQKKOHWXGZGI-ONEGZZNKSA-N	0	0	280.274	4.204	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)[C@@H](C)CC1CCCC1	ZINC000431835960	330589451	/nfs/dbraw/zinc/58/94/51/330589451.db2.gz	XIRSEBRUVXMEHY-LBPRGKRZSA-N	0	0	270.376	4.022	20	30		CIEDRN
N#Cc1nn(C/C=C\c2ccc(Cl)cc2)c2ccccc12	ZINC000432485439	330599663	/nfs/dbraw/zinc/59/96/63/330599663.db2.gz	KWLYZSUVUYZZQU-ARJAWSKDSA-N	0	0	293.757	4.275	20	30		CIEDRN
CCN(Cc1csc(Cl)c1Cl)C[C@H](C)C#N	ZINC000432745069	330605408	/nfs/dbraw/zinc/60/54/08/330605408.db2.gz	QUCZFAPQAPMDSW-MRVPVSSYSA-N	0	0	277.220	4.036	20	30		CIEDRN
N#CCCC[C@@H](NC(=O)Nc1ccsc1)c1ccccc1	ZINC000433012609	330612102	/nfs/dbraw/zinc/61/21/02/330612102.db2.gz	UDBOHGUZCYPJJO-OAHLLOKOSA-N	0	0	299.399	4.305	20	30		CIEDRN
C=CCn1c2ccccc2nc1SCc1cnccc1C	ZINC000433378289	330627436	/nfs/dbraw/zinc/62/74/36/330627436.db2.gz	TUILZYVBPWHGKC-UHFFFAOYSA-N	0	0	295.411	4.218	20	30		CIEDRN
C=CC1CCN(C(=O)c2ccccc2C(C)(C)C)CC1	ZINC000433767555	330630955	/nfs/dbraw/zinc/63/09/55/330630955.db2.gz	UFEDNZOVYUZIQZ-UHFFFAOYSA-N	0	0	271.404	4.022	20	30		CIEDRN
CC1(C)CCCN(C(=O)c2cccc3ccsc32)[C@@H]1C#N	ZINC000434019017	330634241	/nfs/dbraw/zinc/63/42/41/330634241.db2.gz	UVUXRBGZTLNMFL-CQSZACIVSA-N	0	0	298.411	4.056	20	30		CIEDRN
C=CCC[C@H](Nc1ncccc1F)c1ccccc1	ZINC000434947241	330646840	/nfs/dbraw/zinc/64/68/40/330646840.db2.gz	NSECXVNKFQCWRH-HNNXBMFYSA-N	0	0	256.324	4.340	20	30		CIEDRN
C=CCC[C@@H](NC(=O)CC(C)(C)C)c1ccccc1	ZINC000435299622	330652396	/nfs/dbraw/zinc/65/23/96/330652396.db2.gz	PTXUGJFUIIGYEU-OAHLLOKOSA-N	0	0	259.393	4.246	20	30		CIEDRN
CCCC[C@@H](CCC)NC(=O)C1(c2cccc(C#N)c2)CC1	ZINC000435359924	330653527	/nfs/dbraw/zinc/65/35/27/330653527.db2.gz	XUFZMTXCJUPLOR-QGZVFWFLSA-N	0	0	298.430	4.065	20	30		CIEDRN
CC[C@H](C#N)Nc1cccc(COC(C)(C)CC)c1C	ZINC000435931305	330665467	/nfs/dbraw/zinc/66/54/67/330665467.db2.gz	UQVNRTIQOPRRHS-OAHLLOKOSA-N	0	0	274.408	4.414	20	30		CIEDRN
CC[C@H](C#N)Sc1nc(-c2ccccc2)ccc1C#N	ZINC000436040629	330667841	/nfs/dbraw/zinc/66/78/41/330667841.db2.gz	BIBNAIJVKISHJF-CQSZACIVSA-N	0	0	279.368	4.015	20	30		CIEDRN
N#Cc1cccc(C#N)c1NCc1csc2ccccc12	ZINC000436310326	330675208	/nfs/dbraw/zinc/67/52/08/330675208.db2.gz	RBEOOUDHJZIBPV-UHFFFAOYSA-N	0	0	289.363	4.257	20	30		CIEDRN
COc1ccccc1[C@H](C)Sc1c(C#N)cccc1C#N	ZINC000436386339	330676308	/nfs/dbraw/zinc/67/63/08/330676308.db2.gz	HSFVVDIPARULSL-LBPRGKRZSA-N	0	0	294.379	4.292	20	30		CIEDRN
COc1cccc(CCCSCc2ccc(C#N)cc2)c1	ZINC000437444135	330699910	/nfs/dbraw/zinc/69/99/10/330699910.db2.gz	XOLPYSCQHTXJJA-UHFFFAOYSA-N	0	0	297.423	4.433	20	30		CIEDRN
C=CCN(CC=C)C(=O)Nc1ccc2ccn(CCC)c2c1	ZINC000438301186	330721050	/nfs/dbraw/zinc/72/10/50/330721050.db2.gz	JPFGLBUJFSXHMO-UHFFFAOYSA-N	0	0	297.402	4.257	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1cccc(CSCC)c1	ZINC000438383529	330723652	/nfs/dbraw/zinc/72/36/52/330723652.db2.gz	ZKKSNQNRKCJRLQ-LBPRGKRZSA-N	0	0	278.421	4.026	20	30		CIEDRN
C=CCCCSCc1nc(CCc2ccccc2)no1	ZINC000438782940	330729255	/nfs/dbraw/zinc/72/92/55/330729255.db2.gz	DBFBSYYPAAZPPS-UHFFFAOYSA-N	0	0	288.416	4.054	20	30		CIEDRN
CCSc1cccc(CNc2ccccc2C#N)c1	ZINC000438931124	330731053	/nfs/dbraw/zinc/73/10/53/330731053.db2.gz	ZXCTXSHCDSNJMW-UHFFFAOYSA-N	0	0	268.385	4.282	20	30		CIEDRN
C[C@@H](CSCCCC(C)(C)C#N)C(F)(F)F	ZINC000439019226	330732453	/nfs/dbraw/zinc/73/24/53/330732453.db2.gz	KFQYKWKCVBYTNI-VIFPVBQESA-N	0	0	253.333	4.248	20	30		CIEDRN
CC[C@H]1CC[C@H](C(=O)N(CC)c2ccc(C#N)cc2)CC1	ZINC000439158856	330734790	/nfs/dbraw/zinc/73/47/90/330734790.db2.gz	PZOQOYIWWIWZHS-KOMQPUFPSA-N	0	0	284.403	4.128	20	30		CIEDRN
Cc1ccc(OCc2ccc(C#N)cc2OC(F)F)cc1	ZINC000439554039	330740402	/nfs/dbraw/zinc/74/04/02/330740402.db2.gz	VJZRLVGGOOLLPM-UHFFFAOYSA-N	0	0	289.281	4.047	20	30		CIEDRN
C[C@@H]1CCC[C@H](CC(=O)N[C@H](CCC#N)c2ccccc2)C1	ZINC000439661538	330741783	/nfs/dbraw/zinc/74/17/83/330741783.db2.gz	HIRFKHWAQCCDSH-SOLBZPMBSA-N	0	0	298.430	4.364	20	30		CIEDRN
Cc1cc(CCCC(=O)Nc2cccc(C#N)c2)c(C)s1	ZINC000439723538	330742373	/nfs/dbraw/zinc/74/23/73/330742373.db2.gz	VSVAXMVIVWLOBD-UHFFFAOYSA-N	0	0	298.411	4.198	20	30		CIEDRN
C[C@H](CC1CCCCC1)C(=O)N(C)c1ccc(C#N)cc1	ZINC000440046659	330745881	/nfs/dbraw/zinc/74/58/81/330745881.db2.gz	CEVXXGYWCKIZCX-CQSZACIVSA-N	0	0	284.403	4.128	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@@H]1CCCCC1(F)F	ZINC000448633120	330745918	/nfs/dbraw/zinc/74/59/18/330745918.db2.gz	DFFRXGYJJWZSJL-ZDUSSCGKSA-N	0	0	299.386	4.088	20	30		CIEDRN
C=C(C)CN(CC)C(=O)C(C)(C)Cc1cccc(Cl)c1	ZINC000440504940	330749481	/nfs/dbraw/zinc/74/94/81/330749481.db2.gz	AJEXUQNQJYRJHB-UHFFFAOYSA-N	0	0	293.838	4.333	20	30		CIEDRN
C=CC1CCN(c2ncnc3sc4ccccc4c32)CC1	ZINC000440660505	330753702	/nfs/dbraw/zinc/75/37/02/330753702.db2.gz	IMJPYBKVOSTFQF-UHFFFAOYSA-N	0	0	295.411	4.247	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cc(Cl)cc(F)c1F	ZINC000441579719	330771108	/nfs/dbraw/zinc/77/11/08/330771108.db2.gz	FBEVNWNBYBIZKM-CYBMUJFWSA-N	0	0	273.710	4.159	20	30		CIEDRN
N#Cc1ccc(CNc2cc(Cl)cc(F)c2F)cc1	ZINC000442095157	330774057	/nfs/dbraw/zinc/77/40/57/330774057.db2.gz	JQYGNACXSMFENJ-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C=C(CC)CNc1cccc(C[S@@](=O)c2ccccc2)c1	ZINC000442108711	330774176	/nfs/dbraw/zinc/77/41/76/330774176.db2.gz	OAWJKVWRBYHUJS-OAQYLSRUSA-N	0	0	299.439	4.373	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1cc(Cl)cc(F)c1F	ZINC000442187916	330774643	/nfs/dbraw/zinc/77/46/43/330774643.db2.gz	LHJWQMKROUZXTP-UHFFFAOYSA-N	0	0	288.725	4.048	20	30		CIEDRN
CC1=C(C(=O)N[C@@H](C)c2ccc(C#N)cc2)CCC(C)(C)C1	ZINC000448665365	330774684	/nfs/dbraw/zinc/77/46/84/330774684.db2.gz	PYUICHJWNWDDKA-AWEZNQCLSA-N	0	0	296.414	4.262	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1cc(C)c(Cl)c(C)c1	ZINC000442470699	330776131	/nfs/dbraw/zinc/77/61/31/330776131.db2.gz	KCKDZZXZCAUYDT-UHFFFAOYSA-N	0	0	280.799	4.387	20	30		CIEDRN
Cc1cc(N[C@@H]2CCC[C@@H](C#N)C2)cc(C)c1Cl	ZINC000442807563	330784958	/nfs/dbraw/zinc/78/49/58/330784958.db2.gz	DWBIZPFDNQGVTC-CHWSQXEVSA-N	0	0	262.784	4.451	20	30		CIEDRN
N#C[C@@H]1CC[C@@H](Nc2cccc(C(F)F)c2Cl)C1	ZINC000442834717	330785968	/nfs/dbraw/zinc/78/59/68/330785968.db2.gz	KRLPJVPPNWLSEG-RKDXNWHRSA-N	0	0	270.710	4.382	20	30		CIEDRN
Cc1cc(C)c(N[C@H]2CC[C@H](C#N)C2)cc1Br	ZINC000442837909	330786169	/nfs/dbraw/zinc/78/61/69/330786169.db2.gz	REJUIQUZAOCPDD-RYUDHWBXSA-N	0	0	293.208	4.170	20	30		CIEDRN
CC(C)(C)c1nc2cc(N[C@@H]3CC[C@H](C#N)C3)ccc2o1	ZINC000442857814	330787619	/nfs/dbraw/zinc/78/76/19/330787619.db2.gz	GLJWOIMDWXNIJH-NWDGAFQWSA-N	0	0	283.375	4.229	20	30		CIEDRN
Cc1ccc(N[C@@H]2CC[C@H](C#N)C2)cc1NC(=O)C(C)(C)C	ZINC000442859378	330787793	/nfs/dbraw/zinc/78/77/93/330787793.db2.gz	VDIPTGVPZVSHGC-UONOGXRCSA-N	0	0	299.418	4.084	20	30		CIEDRN
CSc1ccc(N[C@H]2CC[C@H](C#N)C2)cc1Cl	ZINC000442867405	330788694	/nfs/dbraw/zinc/78/86/94/330788694.db2.gz	LGMMHVVALADABS-UWVGGRQHSA-N	0	0	266.797	4.166	20	30		CIEDRN
C[C@H](Nc1ccc2ccn(C)c2c1)c1ccc(C#N)cc1F	ZINC000443096515	330794693	/nfs/dbraw/zinc/79/46/93/330794693.db2.gz	JAOLCJXCGROXSO-LBPRGKRZSA-N	0	0	293.345	4.362	20	30		CIEDRN
Cc1cnc([C@@H](C)S[C@H](C)c2cccc(C#N)c2)o1	ZINC000443138646	330795592	/nfs/dbraw/zinc/79/55/92/330795592.db2.gz	XJUUXPJVQJHDBH-VXGBXAGGSA-N	0	0	272.373	4.410	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)[C@H](CC)CC(F)(F)F	ZINC000448683939	330796083	/nfs/dbraw/zinc/79/60/83/330796083.db2.gz	DSGRWVNZOCZMHR-CQSZACIVSA-N	0	0	299.336	4.180	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)c2cccc(C(C)=O)c2)CCCC1(C)C	ZINC000443866868	330806886	/nfs/dbraw/zinc/80/68/86/330806886.db2.gz	HJLYOLDVHFYEKT-KRWDZBQOSA-N	0	0	299.414	4.096	20	30		CIEDRN
Cc1ccc(NCc2ccc(C#N)c(C)c2)c(C)c1	ZINC000443966409	330808097	/nfs/dbraw/zinc/80/80/97/330808097.db2.gz	XUHPUMNBLUNQKZ-UHFFFAOYSA-N	0	0	250.345	4.096	20	30		CIEDRN
Cc1cc(CNc2cccc(COC(C)C)c2)ccc1C#N	ZINC000443979672	330808289	/nfs/dbraw/zinc/80/82/89/330808289.db2.gz	BCYCYPITZQULPU-UHFFFAOYSA-N	0	0	294.398	4.404	20	30		CIEDRN
Cc1ccc2cccc(NCc3ccc(C#N)c(C)c3)c2n1	ZINC000444003268	330809065	/nfs/dbraw/zinc/80/90/65/330809065.db2.gz	RSXZSSYYTRTFAA-UHFFFAOYSA-N	0	0	287.366	4.335	20	30		CIEDRN
C=CC[C@H]1N(C(=O)c2cccc3cc[nH]c32)CCCC1(C)C	ZINC000444637766	330816066	/nfs/dbraw/zinc/81/60/66/330816066.db2.gz	RZYZVPMEHOBKIX-MRXNPFEDSA-N	0	0	296.414	4.375	20	30		CIEDRN
C[C@@H]1CN(CCCCC(C)(C)C#N)c2cccc(F)c2O1	ZINC000444673850	330818564	/nfs/dbraw/zinc/81/85/64/330818564.db2.gz	NJTFMUYNGJXKST-CYBMUJFWSA-N	0	0	290.382	4.133	20	30		CIEDRN
N#C[C@H]1CC[C@H](Sc2nc3ccc(Cl)cc3o2)C1	ZINC000450589638	330826988	/nfs/dbraw/zinc/82/69/88/330826988.db2.gz	DMFJCHGAVRYWJL-WPRPVWTQSA-N	0	0	278.764	4.266	20	30		CIEDRN
C=CCC(CC=C)c1nc(-c2cc(C)oc2C)no1	ZINC000445858816	330840335	/nfs/dbraw/zinc/84/03/35/330840335.db2.gz	ZMUOBAYFMMCIJN-UHFFFAOYSA-N	0	0	258.321	4.182	20	30		CIEDRN
Cc1cc(C#N)ccc1C(=O)N[C@H](C)c1cccc(Cl)c1	ZINC000159512271	330848565	/nfs/dbraw/zinc/84/85/65/330848565.db2.gz	IQSQHMWOCHRZHV-GFCCVEGCSA-N	0	0	298.773	4.011	20	30		CIEDRN
COc1cc(Cl)c(Cl)cc1N[C@@H]1CCC[C@H](C#N)C1	ZINC000446800237	330854571	/nfs/dbraw/zinc/85/45/71/330854571.db2.gz	VCNYRMHDVOVDMZ-VHSXEESVSA-N	0	0	299.201	4.496	20	30		CIEDRN
C=CCC[C@@H](CC)Nc1cnn(C2CCCC2)c1C	ZINC000446891817	330857308	/nfs/dbraw/zinc/85/73/08/330857308.db2.gz	CXBYEPLESWAVAO-CQSZACIVSA-N	0	0	261.413	4.463	20	30		CIEDRN
Cc1ccc2[nH]c(CN3CCCC(C)(C)[C@@H]3C#N)cc2c1C	ZINC000446978538	330859389	/nfs/dbraw/zinc/85/93/89/330859389.db2.gz	YARUSAZXUCBYSU-SFHVURJKSA-N	0	0	295.430	4.299	20	30		CIEDRN
COc1cc(OCc2ccc(C(F)F)cc2)ccc1C#N	ZINC000194503393	330862621	/nfs/dbraw/zinc/86/26/21/330862621.db2.gz	XIVVGNPDXBJWDF-UHFFFAOYSA-N	0	0	289.281	4.083	20	30		CIEDRN
Cc1cc(CSc2ncccc2Cl)ccc1C#N	ZINC000447297533	330863750	/nfs/dbraw/zinc/86/37/50/330863750.db2.gz	XPGVZIJYXALGOZ-UHFFFAOYSA-N	0	0	274.776	4.207	20	30		CIEDRN
CC(=O)c1cc(Cl)ccc1OCc1ccc(C#N)c(C)c1	ZINC000447309239	330864129	/nfs/dbraw/zinc/86/41/29/330864129.db2.gz	LVQNLTVOFJAFJM-UHFFFAOYSA-N	0	0	299.757	4.302	20	30		CIEDRN
Cc1cc(CSc2nncc3ccccc32)ccc1C#N	ZINC000447311118	330864358	/nfs/dbraw/zinc/86/43/58/330864358.db2.gz	FKHWPDUPQVFAIC-UHFFFAOYSA-N	0	0	291.379	4.102	20	30		CIEDRN
Cc1cc(CN2c3cccc4cccc(c34)C2=O)ccc1C#N	ZINC000447328223	330864956	/nfs/dbraw/zinc/86/49/56/330864956.db2.gz	ZSNOYGJXIIMDGG-UHFFFAOYSA-N	0	0	298.345	4.180	20	30		CIEDRN
CC(C)c1ccc2ncc(C#N)c(N3CC[C@@H](C)C3)c2c1	ZINC000447684032	330874166	/nfs/dbraw/zinc/87/41/66/330874166.db2.gz	WIRZRMGZVJJORP-CYBMUJFWSA-N	0	0	279.387	4.076	20	30		CIEDRN
CC(C)c1ccc2ncc(C#N)c(N3CCC[C@@H]3C)c2c1	ZINC000447681371	330874237	/nfs/dbraw/zinc/87/42/37/330874237.db2.gz	YSZXAQHLOUECNG-ZDUSSCGKSA-N	0	0	279.387	4.219	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@@H](C)c1ccccc1C(F)(F)F	ZINC000448786372	330883728	/nfs/dbraw/zinc/88/37/28/330883728.db2.gz	ZSZVPNGHDWKFCO-JTQLQIEISA-N	0	0	285.309	4.095	20	30		CIEDRN
CC(C)c1cccc(N(C)C(=O)[C@@]2(C#N)CC23CCCC3)c1	ZINC000448795625	330884068	/nfs/dbraw/zinc/88/40/68/330884068.db2.gz	QFWJOMXRIYUOMJ-IBGZPJMESA-N	0	0	296.414	4.247	20	30		CIEDRN
CC[C@H]1CCC[C@H]1C(=O)N(Cc1ccc(C#N)cc1)C(C)C	ZINC000448818642	330884785	/nfs/dbraw/zinc/88/47/85/330884785.db2.gz	NWWFNWZSEIAOEU-ZWKOTPCHSA-N	0	0	298.430	4.122	20	30		CIEDRN
Cc1ccc(Br)c(NCC(C)(C)CCC#N)c1	ZINC000162137820	330886001	/nfs/dbraw/zinc/88/60/01/330886001.db2.gz	UISQRXUSSQTXOM-UHFFFAOYSA-N	0	0	295.224	4.499	20	30		CIEDRN
C[C@@H](Cc1ccoc1)Nc1cccc(OCCCC#N)c1	ZINC000449042580	330894871	/nfs/dbraw/zinc/89/48/71/330894871.db2.gz	SZFYUNKHAGVYHS-AWEZNQCLSA-N	0	0	284.359	4.005	20	30		CIEDRN
COc1ccc(Cl)c(NC2CCC(C)(C#N)CC2)c1	ZINC000449056484	330895746	/nfs/dbraw/zinc/89/57/46/330895746.db2.gz	PTMFDNTZPXGFEV-UHFFFAOYSA-N	0	0	278.783	4.233	20	30		CIEDRN
COc1cc(SC)ccc1NC1CCC(C)(C#N)CC1	ZINC000449290571	330912276	/nfs/dbraw/zinc/91/22/76/330912276.db2.gz	XOEUNWOCQSISLD-UHFFFAOYSA-N	0	0	290.432	4.301	20	30		CIEDRN
N#C[C@H]1CCC[C@H](Nc2ccc3c(c2)CCCC3)C1	ZINC000449414947	330923905	/nfs/dbraw/zinc/92/39/05/330923905.db2.gz	YZTIDMSCLMKZFH-BBRMVZONSA-N	0	0	254.377	4.060	20	30		CIEDRN
CCSCc1ccc(NCc2ccc(C#N)s2)cc1	ZINC000449602682	330938870	/nfs/dbraw/zinc/93/88/70/330938870.db2.gz	PJKHKWAKEXPQMI-UHFFFAOYSA-N	0	0	288.441	4.485	20	30		CIEDRN
CC(C)(C)[C@@H]1C[C@H](Nc2cccc(CC#N)c2)CS1	ZINC000449697541	330944469	/nfs/dbraw/zinc/94/44/69/330944469.db2.gz	LURUQANVPXPEBI-GJZGRUSLSA-N	0	0	274.433	4.085	20	30		CIEDRN
Cc1cc(C#N)cc(NCc2csc(C(C)C)n2)c1	ZINC000449759481	330948305	/nfs/dbraw/zinc/94/83/05/330948305.db2.gz	JOHPXUDHOKJFKH-UHFFFAOYSA-N	0	0	271.389	4.059	20	30		CIEDRN
C=CCC1(C(=O)Nc2cccc(F)c2F)CCCC1	ZINC000449811618	330951064	/nfs/dbraw/zinc/95/10/64/330951064.db2.gz	LULHCYWLVLSRBE-UHFFFAOYSA-N	0	0	265.303	4.040	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@@H](CC)CC(F)(F)F	ZINC000449917590	330954811	/nfs/dbraw/zinc/95/48/11/330954811.db2.gz	VDDHPPZITPAQAL-LBPRGKRZSA-N	0	0	279.346	4.170	20	30		CIEDRN
C=CC(C)(C)C(=O)Nc1cccc(C(F)(F)F)c1C	ZINC000450167192	330964362	/nfs/dbraw/zinc/96/43/62/330964362.db2.gz	BXMCLYDIARLLAN-UHFFFAOYSA-N	0	0	271.282	4.165	20	30		CIEDRN
C[C@@H](Nc1cc(C#N)ccn1)c1cccc(C2CC2)c1	ZINC000450549255	330985818	/nfs/dbraw/zinc/98/58/18/330985818.db2.gz	BFQMDLFUQQWPAD-GFCCVEGCSA-N	0	0	263.344	4.004	20	30		CIEDRN
N#CC1(CSCc2ccc(Cl)cc2)CCC1	ZINC000450624162	330989953	/nfs/dbraw/zinc/98/99/53/330989953.db2.gz	OTOALRJWZQVTMY-UHFFFAOYSA-N	0	0	251.782	4.267	20	30		CIEDRN
N#CC1(COc2ccc(Cl)c(Cl)c2)CCC1	ZINC000450622557	330989929	/nfs/dbraw/zinc/98/99/29/330989929.db2.gz	JCMCOCFHFSHGFK-UHFFFAOYSA-N	0	0	256.132	4.066	20	30		CIEDRN
C[C@H](NCC1(C#N)CCC1)c1cc(Cl)ccc1Cl	ZINC000450665354	330992012	/nfs/dbraw/zinc/99/20/12/330992012.db2.gz	FUGHGFYKNXHLBW-JTQLQIEISA-N	0	0	283.202	4.338	20	30		CIEDRN
CC[C@H](NCC1(C#N)CCC1)c1ccc(Cl)s1	ZINC000450723529	330996042	/nfs/dbraw/zinc/99/60/42/330996042.db2.gz	DELOYEUSKGRQQL-JTQLQIEISA-N	0	0	268.813	4.136	20	30		CIEDRN
N#C[C@H]1CC[C@H](Sc2nc(-c3ccc(F)cc3)c[nH]2)C1	ZINC000450741475	330997281	/nfs/dbraw/zinc/99/72/81/330997281.db2.gz	YTDMAOPFQSIUNQ-GWCFXTLKSA-N	0	0	287.363	4.000	20	30		CIEDRN
Cc1nc(C(C)C)oc1CSc1ccc(C#N)cc1	ZINC000450810254	331000672	/nfs/dbraw/zinc/00/06/72/331000672.db2.gz	MEJCOGSILISIAF-UHFFFAOYSA-N	0	0	272.373	4.270	20	30		CIEDRN
N#Cc1cccnc1N1CCCC[C@H]1c1ccc(Cl)cc1	ZINC000450826515	331001453	/nfs/dbraw/zinc/00/14/53/331001453.db2.gz	GEGWNULPRUOSOW-INIZCTEOSA-N	0	0	297.789	4.338	20	30		CIEDRN
Cc1ccccc1[C@@H](CC(F)(F)F)NCC1(C#N)CCC1	ZINC000450860997	331003472	/nfs/dbraw/zinc/00/34/72/331003472.db2.gz	DGSMFFXXOCTFOU-CQSZACIVSA-N	0	0	296.336	4.272	20	30		CIEDRN
CC(C)(CC(=O)CSc1cccc(C#N)c1)C1CC1	ZINC000450865913	331003798	/nfs/dbraw/zinc/00/37/98/331003798.db2.gz	WLFHQJQILJZGJR-UHFFFAOYSA-N	0	0	273.401	4.046	20	30		CIEDRN
C[C@@H]1CCC(=O)[C@@H](Sc2ccc(C#N)cc2Cl)C1	ZINC000450871562	331003948	/nfs/dbraw/zinc/00/39/48/331003948.db2.gz	RFDSKGLODURRCK-OTYXRUKQSA-N	0	0	279.792	4.061	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H](CC)CC(F)(F)F)CCCCC1	ZINC000450874637	331004128	/nfs/dbraw/zinc/00/41/28/331004128.db2.gz	FASBBIRXRJKFCA-LBPRGKRZSA-N	0	0	291.357	4.360	20	30		CIEDRN
N#C[C@@H]1CC[C@@H](SCc2ccccc2C2CC2)C1	ZINC000450904431	331006203	/nfs/dbraw/zinc/00/62/03/331006203.db2.gz	FGYHFMADRXXPPU-IUODEOHRSA-N	0	0	257.402	4.489	20	30		CIEDRN
Cc1cc(C#N)cc(N2CCC[C@@H]2c2ccc(F)cc2C)n1	ZINC000450907246	331006326	/nfs/dbraw/zinc/00/63/26/331006326.db2.gz	FJAMGMJGORGNIF-QGZVFWFLSA-N	0	0	295.361	4.051	20	30		CIEDRN
Cc1cc(N2CCC[C@H]2c2ccc(F)cc2C)cc(C#N)n1	ZINC000450915557	331006981	/nfs/dbraw/zinc/00/69/81/331006981.db2.gz	SSUZMSXBUORJJV-SFHVURJKSA-N	0	0	295.361	4.051	20	30		CIEDRN
N#CC1(CSc2nc(-c3ccccc3)co2)CCC1	ZINC000450923225	331007400	/nfs/dbraw/zinc/00/74/00/331007400.db2.gz	QDBRDQVBJFDFQI-UHFFFAOYSA-N	0	0	270.357	4.128	20	30		CIEDRN
N#C[C@@H]1CC[C@@H](Sc2cc(Cl)ccc2F)C1	ZINC000450964945	331009024	/nfs/dbraw/zinc/00/90/24/331009024.db2.gz	UBZTWMRUOXWRJA-PSASIEDQSA-N	0	0	255.745	4.263	20	30		CIEDRN
CCCc1nc(C)c(COc2cc(Cl)cc(C#N)c2)o1	ZINC000450967465	331009077	/nfs/dbraw/zinc/00/90/77/331009077.db2.gz	WUVBQSDYAYZOJL-UHFFFAOYSA-N	0	0	290.750	4.040	20	30		CIEDRN
C=CCCN(C)C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000451061536	331014246	/nfs/dbraw/zinc/01/42/46/331014246.db2.gz	LLFBROFZZRCLNN-GXTWGEPZSA-N	0	0	295.785	4.007	20	30		CIEDRN
C[C@H](NCc1cccc(F)c1C#N)c1cccc(C2CC2)c1	ZINC000451116461	331016263	/nfs/dbraw/zinc/01/62/63/331016263.db2.gz	QRSJHYVAXQGVPH-ZDUSSCGKSA-N	0	0	294.373	4.426	20	30		CIEDRN
C=CCC1(C(=O)Nc2cnn([C@H](C)CC)c2C)CCCC1	ZINC000451152234	331017857	/nfs/dbraw/zinc/01/78/57/331017857.db2.gz	XEYMIFUNCCKPET-CYBMUJFWSA-N	0	0	289.423	4.238	20	30		CIEDRN
C=CCC1(C(=O)N[C@H](C)CCCC(F)(F)F)CCCC1	ZINC000451175691	331018752	/nfs/dbraw/zinc/01/87/52/331018752.db2.gz	LTVOGGJZJMBISN-GFCCVEGCSA-N	0	0	291.357	4.360	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@H](C)C(F)(F)C2)CCCCC1	ZINC000451174096	331018823	/nfs/dbraw/zinc/01/88/23/331018823.db2.gz	XUFYTWWPJNBYQL-ZDUSSCGKSA-N	0	0	285.378	4.017	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)C[C@@H]1CC[C@@H]2C[C@@H]21	ZINC000451325932	331024498	/nfs/dbraw/zinc/02/44/98/331024498.db2.gz	PDJRFBHVXPVPOE-SQNIBIBYSA-N	0	0	283.415	4.028	20	30		CIEDRN
C=CC(C)(C)C(=O)N1CCC(c2cccc(Cl)c2)CC1	ZINC000451356479	331025554	/nfs/dbraw/zinc/02/55/54/331025554.db2.gz	AUHAQMRXIFAIBA-UHFFFAOYSA-N	0	0	291.822	4.258	20	30		CIEDRN
C=CC(C)(C)C(=O)NCCCCc1ccc(Cl)s1	ZINC000451533031	331032968	/nfs/dbraw/zinc/03/29/68/331032968.db2.gz	LUKFWTNKZSVDRE-UHFFFAOYSA-N	0	0	285.840	4.053	20	30		CIEDRN
C=CCC1(C(=O)N2CCC(F)(F)[C@H](C)C2)CCCCC1	ZINC000451832958	331044066	/nfs/dbraw/zinc/04/40/66/331044066.db2.gz	CKAZLWWGSABKIQ-CYBMUJFWSA-N	0	0	285.378	4.017	20	30		CIEDRN
N#Cc1cc(F)ccc1CN1CC2(CCC2)[C@H]1c1ccco1	ZINC000451845768	331044550	/nfs/dbraw/zinc/04/45/50/331044550.db2.gz	VLLOBPPOQQQOIL-QGZVFWFLSA-N	0	0	296.345	4.018	20	30		CIEDRN
C=CCC1(C(=O)Nc2cc(C3CC3)ccn2)CCCC1	ZINC000451857737	331044999	/nfs/dbraw/zinc/04/49/99/331044999.db2.gz	HPKCMBNBBMZKRO-UHFFFAOYSA-N	0	0	270.376	4.034	20	30		CIEDRN
CCCC(CCC)C(=O)Nc1cc(C#N)ccc1OCC	ZINC000510622210	332908122	/nfs/dbraw/zinc/90/81/22/332908122.db2.gz	MUJFIGVCWARLKO-UHFFFAOYSA-N	0	0	288.391	4.112	20	30		CIEDRN
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000452142418	331055850	/nfs/dbraw/zinc/05/58/50/331055850.db2.gz	XFXGUXHZOGBISJ-KZNAEPCWSA-N	0	0	298.430	4.220	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc([C@H]3CCOC3)cc2)CCCC1	ZINC000452157216	331056426	/nfs/dbraw/zinc/05/64/26/331056426.db2.gz	YIMHNPLMIZFEHU-INIZCTEOSA-N	0	0	299.414	4.266	20	30		CIEDRN
CC(C)=CCC[C@H](C)NC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000452540301	331067947	/nfs/dbraw/zinc/06/79/47/331067947.db2.gz	JDUPXAABGDCAOS-FUHWJXTLSA-N	0	0	298.430	4.325	20	30		CIEDRN
CC(C)=CCC[C@H](C)NC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000452542808	331068066	/nfs/dbraw/zinc/06/80/66/331068066.db2.gz	OKYGOFPIQZXCEZ-HNNXBMFYSA-N	0	0	298.430	4.352	20	30		CIEDRN
CC[C@H]1CCC[C@@H]1C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452653258	331071194	/nfs/dbraw/zinc/07/11/94/331071194.db2.gz	ZHVRQBHAMOKDSY-STQMWFEESA-N	0	0	290.794	4.171	20	30		CIEDRN
C=C(C)[C@H](CC(=O)Nc1ccccc1C(C)(F)F)OCC	ZINC000452676644	331072067	/nfs/dbraw/zinc/07/20/67/331072067.db2.gz	TWCVVZNEQSIIBI-AWEZNQCLSA-N	0	0	297.345	4.108	20	30		CIEDRN
C=C(C)CCNC(=O)CC1(CSc2ccccc2)CC1	ZINC000452721421	331073798	/nfs/dbraw/zinc/07/37/98/331073798.db2.gz	ZZTDPDKPQQVQDD-UHFFFAOYSA-N	0	0	289.444	4.031	20	30		CIEDRN
C=C(C)CCNC(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000452728283	331074530	/nfs/dbraw/zinc/07/45/30/331074530.db2.gz	DCDYHMNWEBFZSC-TZMCWYRMSA-N	0	0	295.785	4.055	20	30		CIEDRN
C=C(C)CCNC(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000452728282	331074558	/nfs/dbraw/zinc/07/45/58/331074558.db2.gz	DCDYHMNWEBFZSC-OCCSQVGLSA-N	0	0	295.785	4.055	20	30		CIEDRN
CC(C)(CNC(=O)C[C@@H](CC#N)c1ccccc1)C1CCC1	ZINC000452784325	331077781	/nfs/dbraw/zinc/07/77/81/331077781.db2.gz	KFJQGHAMTVCWEK-MRXNPFEDSA-N	0	0	298.430	4.016	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(C(=O)C(C)C)cc1	ZINC000452974497	331082408	/nfs/dbraw/zinc/08/24/08/331082408.db2.gz	LPSCKMZXGFNZSF-ZDUSSCGKSA-N	0	0	273.376	4.066	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(C(=O)C(C)C)cc1	ZINC000452974495	331082416	/nfs/dbraw/zinc/08/24/16/331082416.db2.gz	LPSCKMZXGFNZSF-CYBMUJFWSA-N	0	0	273.376	4.066	20	30		CIEDRN
Cc1nc(CNc2ccc(CC#N)cc2Cl)c(C)s1	ZINC000453130522	331092378	/nfs/dbraw/zinc/09/23/78/331092378.db2.gz	ONTKQDOFZDQMSZ-UHFFFAOYSA-N	0	0	291.807	4.092	20	30		CIEDRN
C=CCC1(c2nc([C@@H]3CCCCS3)no2)CCCC1	ZINC000453145006	331093910	/nfs/dbraw/zinc/09/39/10/331093910.db2.gz	MZHVHIXYVOCTLM-LBPRGKRZSA-N	0	0	278.421	4.416	20	30		CIEDRN
C=CCC1(c2nc([C@H]3CCO[C@H](C)C3)no2)CCCCC1	ZINC000453145662	331093990	/nfs/dbraw/zinc/09/39/90/331093990.db2.gz	HWANNIVMWHYGIR-KGLIPLIRSA-N	0	0	290.407	4.130	20	30		CIEDRN
C=C(C)CCc1noc([C@@H](CC)CC(F)(F)F)n1	ZINC000453177206	331097450	/nfs/dbraw/zinc/09/74/50/331097450.db2.gz	GGVJMGJXGMJGPL-VIFPVBQESA-N	0	0	262.275	4.024	20	30		CIEDRN
C=CC(C)(C)c1nc(-c2ccc(C(C)(F)F)cc2)no1	ZINC000453181681	331098007	/nfs/dbraw/zinc/09/80/07/331098007.db2.gz	MGZKNIBCDGBLAJ-UHFFFAOYSA-N	0	0	278.302	4.312	20	30		CIEDRN
C=C[C@](C)(CC)c1nc([C@@H]2CSc3ccccc32)no1	ZINC000453213126	331102124	/nfs/dbraw/zinc/10/21/24/331102124.db2.gz	GWPCRCWEBBLTBA-MLGOLLRUSA-N	0	0	286.400	4.161	20	30		CIEDRN
C=CCCc1noc(/C=C\c2cnc(C(C)(C)C)s2)n1	ZINC000453236281	331105183	/nfs/dbraw/zinc/10/51/83/331105183.db2.gz	NFSNSDMLFNVLFZ-HJWRWDBZSA-N	0	0	289.404	4.113	20	30		CIEDRN
C=CCCc1noc([C@H]2CCCO[C@@H]2c2ccc(C)cc2)n1	ZINC000453240991	331106062	/nfs/dbraw/zinc/10/60/62/331106062.db2.gz	VAWOEGCRBSURJU-DOTOQJQBSA-N	0	0	298.386	4.132	20	30		CIEDRN
C=CCCc1noc([C@@H](C)c2cc3ccccc3o2)n1	ZINC000453241777	331106118	/nfs/dbraw/zinc/10/61/18/331106118.db2.gz	WFSHYLVEMRMKHK-NSHDSACASA-N	0	0	268.316	4.086	20	30		CIEDRN
C=CCCc1noc([C@H](C)c2ccc(Cl)s2)n1	ZINC000453243871	331106519	/nfs/dbraw/zinc/10/65/19/331106519.db2.gz	ZUQPRDSYVNQQOP-MRVPVSSYSA-N	0	0	268.769	4.055	20	30		CIEDRN
C=CCCc1noc([C@H](C)CSc2ccc(F)cc2)n1	ZINC000453243638	331106607	/nfs/dbraw/zinc/10/66/07/331106607.db2.gz	ZNPAJVHJHCXYBD-LLVKDONJSA-N	0	0	292.379	4.223	20	30		CIEDRN
C=CCCc1noc([C@H](C)Oc2cc(C)ccc2Cl)n1	ZINC000453244451	331106692	/nfs/dbraw/zinc/10/66/92/331106692.db2.gz	DUHFCBSBZJKWPS-NSHDSACASA-N	0	0	292.766	4.290	20	30		CIEDRN
C=CCCc1noc([C@@H](C)SCc2ccccc2)n1	ZINC000453246962	331106932	/nfs/dbraw/zinc/10/69/32/331106932.db2.gz	MHFQWEXBTDKZGF-GFCCVEGCSA-N	0	0	274.389	4.183	20	30		CIEDRN
C=CCCc1noc([C@H](C)Sc2ccc(C)cc2)n1	ZINC000453247656	331107041	/nfs/dbraw/zinc/10/70/41/331107041.db2.gz	ODAWHLFKVZNVOV-LBPRGKRZSA-N	0	0	274.389	4.350	20	30		CIEDRN
C=CCCc1noc([C@H](C)CSc2ccccc2)n1	ZINC000453247816	331107130	/nfs/dbraw/zinc/10/71/30/331107130.db2.gz	PASTXEDBCAFVCC-GFCCVEGCSA-N	0	0	274.389	4.084	20	30		CIEDRN
CCCn1ncc(N[C@@H](C)c2ccc(C#N)cc2)c1C1CC1	ZINC000453287964	331111509	/nfs/dbraw/zinc/11/15/09/331111509.db2.gz	LEKMDHPOIXNNJJ-ZDUSSCGKSA-N	0	0	294.402	4.215	20	30		CIEDRN
CCc1ccc(N[C@H](C)c2cccc(C#N)c2)cc1OC	ZINC000453391686	331127275	/nfs/dbraw/zinc/12/72/75/331127275.db2.gz	ZAULDAZGPOQRIE-CYBMUJFWSA-N	0	0	280.371	4.302	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1C[C@H](c2ccccc2C)C[C@@H]1C	ZINC000467340738	331133855	/nfs/dbraw/zinc/13/38/55/331133855.db2.gz	KFRKIRVTCMTBPX-FUHWJXTLSA-N	0	0	297.442	4.468	20	30		CIEDRN
C=C(CC)CNC(=O)Nc1c(C)cccc1C(C)C	ZINC000454211835	331141809	/nfs/dbraw/zinc/14/18/09/331141809.db2.gz	BUPMNKWTZJWFAO-UHFFFAOYSA-N	0	0	260.381	4.206	20	30		CIEDRN
CC(C)(C)C[C@H]1CCN(C(=O)Nc2ccc(CC#N)cc2)C1	ZINC000454344227	331144639	/nfs/dbraw/zinc/14/46/39/331144639.db2.gz	NIESIHRWVFJODG-OAHLLOKOSA-N	0	0	299.418	4.043	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)NC(C)(C)C2CCC2)cc1	ZINC000454453482	331146540	/nfs/dbraw/zinc/14/65/40/331146540.db2.gz	VJPMYMQRUHYFBN-UHFFFAOYSA-N	0	0	299.418	4.188	20	30		CIEDRN
C=C(C)CCNC(=O)Nc1cccc(-c2nc(C)c(C)o2)c1	ZINC000454572215	331149094	/nfs/dbraw/zinc/14/90/94/331149094.db2.gz	UOOLWWHIWDSBMG-UHFFFAOYSA-N	0	0	299.374	4.046	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N1CCC[C@]1(C)CC(C)C	ZINC000454632586	331150197	/nfs/dbraw/zinc/15/01/97/331150197.db2.gz	AOOIWGMCXYRBTR-GOSISDBHSA-N	0	0	299.418	4.299	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N1CC[C@@H](CC(C)(C)C)C1	ZINC000454649425	331150444	/nfs/dbraw/zinc/15/04/44/331150444.db2.gz	SVPKMWITDFOALL-HNNXBMFYSA-N	0	0	299.418	4.157	20	30		CIEDRN
C=C(C)CCNC(=O)Nc1ccccc1SC(C)C	ZINC000454944405	331157325	/nfs/dbraw/zinc/15/73/25/331157325.db2.gz	AXWZTPSBUREQKM-UHFFFAOYSA-N	0	0	278.421	4.275	20	30		CIEDRN
CCN(C(=O)C1=CC[C@H](C)CC1)[C@H](C)c1ccc(C#N)cc1	ZINC000454981129	331158131	/nfs/dbraw/zinc/15/81/31/331158131.db2.gz	RZKBIVRAHXAHEB-LSDHHAIUSA-N	0	0	296.414	4.214	20	30		CIEDRN
CCN(C(=O)C1=CC[C@H](C)CC1)[C@@H](C)c1ccc(C#N)cc1	ZINC000454981127	331158161	/nfs/dbraw/zinc/15/81/61/331158161.db2.gz	RZKBIVRAHXAHEB-GJZGRUSLSA-N	0	0	296.414	4.214	20	30		CIEDRN
C=C(C)CCNC(=O)Nc1ccc(OC(C)C)cc1Cl	ZINC000455213475	331162789	/nfs/dbraw/zinc/16/27/89/331162789.db2.gz	DVYWAIJVAYSFDK-UHFFFAOYSA-N	0	0	296.798	4.215	20	30		CIEDRN
CCc1cccc(NC(=O)N[C@H]2CC[C@@H](CC#N)C2)c1CC	ZINC000455273400	331163806	/nfs/dbraw/zinc/16/38/06/331163806.db2.gz	YMXIIVXJUUERTJ-ZFWWWQNUSA-N	0	0	299.418	4.015	20	30		CIEDRN
C=CCN(CCC#N)C(=O)Nc1ccc(C(C)(C)CC)cc1	ZINC000455306712	331165096	/nfs/dbraw/zinc/16/50/96/331165096.db2.gz	NNXKSJNXCQMEQH-UHFFFAOYSA-N	0	0	299.418	4.308	20	30		CIEDRN
C=C(C)CCNC(=O)N(CC)[C@H](CC)c1ccccc1	ZINC000455310843	331165359	/nfs/dbraw/zinc/16/53/59/331165359.db2.gz	MZWYCZGYLFHSGF-MRXNPFEDSA-N	0	0	274.408	4.135	20	30		CIEDRN
C=C(C)CCNC(=O)N1CCC[C@H]1c1ccc(Cl)cc1	ZINC000455315438	331165767	/nfs/dbraw/zinc/16/57/67/331165767.db2.gz	UBVOLROIRSHUFU-HNNXBMFYSA-N	0	0	292.810	4.153	20	30		CIEDRN
C=C(C)CCNC(=O)N(C)[C@H](C)c1ccccc1Cl	ZINC000455316254	331165812	/nfs/dbraw/zinc/16/58/12/331165812.db2.gz	VTCJTAQBCDIIAG-GFCCVEGCSA-N	0	0	280.799	4.009	20	30		CIEDRN
C=C(C)CCNC(=O)N(C)[C@@H](C)c1ccccc1Cl	ZINC000455316256	331165858	/nfs/dbraw/zinc/16/58/58/331165858.db2.gz	VTCJTAQBCDIIAG-LBPRGKRZSA-N	0	0	280.799	4.009	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CCC[C@@](C)(F)C1	ZINC000455387676	331168316	/nfs/dbraw/zinc/16/83/16/331168316.db2.gz	SQRIXQPZCSJAEW-QGZVFWFLSA-N	0	0	290.382	4.161	20	30		CIEDRN
C=CCCCCCNc1cc(NC(C)=O)ccc1C	ZINC000195447707	331174789	/nfs/dbraw/zinc/17/47/89/331174789.db2.gz	RHLNZQOZUXUGFI-UHFFFAOYSA-N	0	0	260.381	4.112	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1cc(C)c(C)cc1Cl	ZINC000455732628	331176494	/nfs/dbraw/zinc/17/64/94/331176494.db2.gz	MKYNHVAVJQMNQK-NSHDSACASA-N	0	0	266.772	4.043	20	30		CIEDRN
C=CCN(C(=O)Nc1cc(C)cc2ccccc21)C1CC1	ZINC000455745765	331176956	/nfs/dbraw/zinc/17/69/56/331176956.db2.gz	SZSMDWCWPQKCJL-UHFFFAOYSA-N	0	0	280.371	4.331	20	30		CIEDRN
C=CCCCCNC(=O)Nc1ccccc1C(C)(F)F	ZINC000455768226	331177406	/nfs/dbraw/zinc/17/74/06/331177406.db2.gz	IRUOMFUNIPHRMR-UHFFFAOYSA-N	0	0	282.334	4.276	20	30		CIEDRN
C=CC(C)(C)CNC(=O)Nc1ccccc1C(C)(F)F	ZINC000455791931	331177818	/nfs/dbraw/zinc/17/78/18/331177818.db2.gz	PCMZFZNOIWKURF-UHFFFAOYSA-N	0	0	282.334	4.132	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Nc1scnc1C(C)C	ZINC000455850648	331178822	/nfs/dbraw/zinc/17/88/22/331178822.db2.gz	STKAJNHFRXROMD-UHFFFAOYSA-N	0	0	295.452	4.477	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1ccc(CSCC)cc1	ZINC000455854023	331178868	/nfs/dbraw/zinc/17/88/68/331178868.db2.gz	GHOXKIILBAIEQO-GFCCVEGCSA-N	0	0	278.421	4.026	20	30		CIEDRN
CCCCC[C@H]1CCCN1C(=O)Nc1cccc(CC#N)c1	ZINC000455904057	331180185	/nfs/dbraw/zinc/18/01/85/331180185.db2.gz	JJELMNGEVCBNTD-KRWDZBQOSA-N	0	0	299.418	4.329	20	30		CIEDRN
C=C(C)CCNC(=O)Nc1ccc(CSCC)cc1	ZINC000455904372	331180208	/nfs/dbraw/zinc/18/02/08/331180208.db2.gz	VZZNWYSEVFPBPV-UHFFFAOYSA-N	0	0	278.421	4.027	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N(C)CCCSC	ZINC000505057808	331180321	/nfs/dbraw/zinc/18/03/21/331180321.db2.gz	LVLZLVNSQQVEJC-UHFFFAOYSA-N	0	0	292.448	4.022	20	30		CIEDRN
CC[C@@H](C)[C@H]1CCCCN1C(=O)Nc1cccc(CC#N)c1	ZINC000455909407	331180495	/nfs/dbraw/zinc/18/04/95/331180495.db2.gz	BKYGBHMOTUQATG-RHSMWYFYSA-N	0	0	299.418	4.185	20	30		CIEDRN
CC(C)(C)C1CCN(C(=O)Nc2cccc(CC#N)c2)CC1	ZINC000455910643	331180574	/nfs/dbraw/zinc/18/05/74/331180574.db2.gz	UMJXJNYHFDEVRQ-UHFFFAOYSA-N	0	0	299.418	4.043	20	30		CIEDRN
CCCC[C@@H](NC(=O)Nc1cccc(CC#N)c1)C1CCC1	ZINC000455918900	331181014	/nfs/dbraw/zinc/18/10/14/331181014.db2.gz	LUTQUPSIYGQBSI-QGZVFWFLSA-N	0	0	299.418	4.233	20	30		CIEDRN
CC[C@@H](NC(=O)Nc1cccc(CC#N)c1)c1cccs1	ZINC000455920724	331181091	/nfs/dbraw/zinc/18/10/91/331181091.db2.gz	NWDGGEJTEKTJLL-CQSZACIVSA-N	0	0	299.399	4.087	20	30		CIEDRN
CN(C(=O)Nc1cccc(CC#N)c1)C1CCC(C)(C)CC1	ZINC000455923059	331181227	/nfs/dbraw/zinc/18/12/27/331181227.db2.gz	SCYCHMPXQOVOGK-UHFFFAOYSA-N	0	0	299.418	4.185	20	30		CIEDRN
CC1(C)CC=C(C(=O)N[C@@H](CCC#N)c2ccccc2)CC1	ZINC000455987890	331181904	/nfs/dbraw/zinc/18/19/04/331181904.db2.gz	FMQYKXMTOULRDH-KRWDZBQOSA-N	0	0	296.414	4.284	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1ccc([C@@H](C)C(F)(F)F)cc1	ZINC000455994496	331182051	/nfs/dbraw/zinc/18/20/51/331182051.db2.gz	MTMKUKJCYFAIME-LLVKDONJSA-N	0	0	285.309	4.001	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1ccc([C@H](C)C(F)(F)F)cc1	ZINC000455994497	331182067	/nfs/dbraw/zinc/18/20/67/331182067.db2.gz	MTMKUKJCYFAIME-NSHDSACASA-N	0	0	285.309	4.001	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1ccc([C@H](C)C(F)(F)F)cc1	ZINC000456011327	331182371	/nfs/dbraw/zinc/18/23/71/331182371.db2.gz	DOBIXZXYFGJOCO-SMDDNHRTSA-N	0	0	299.336	4.437	20	30		CIEDRN
C=CCC1(C(=O)Nc2cc(OCC)ccc2Cl)CCC1	ZINC000456038171	331183027	/nfs/dbraw/zinc/18/30/27/331183027.db2.gz	DBZRKIYMNHQDAY-UHFFFAOYSA-N	0	0	293.794	4.424	20	30		CIEDRN
CCC1(NC(=O)C[C@H](CC#N)c2ccccc2)CCCCC1	ZINC000456242971	331187087	/nfs/dbraw/zinc/18/70/87/331187087.db2.gz	ZXNCXTMETPEBJH-KRWDZBQOSA-N	0	0	298.430	4.303	20	30		CIEDRN
C=CCC1(C(=O)N2C[C@H](C3CC3)[C@@H]2C2CC2)CCCCC1	ZINC000456259499	331187671	/nfs/dbraw/zinc/18/76/71/331187671.db2.gz	RKSOCEKLZDKFCV-SJORKVTESA-N	0	0	287.447	4.160	20	30		CIEDRN
C=C[C@@H](CC(=O)NC12CCC(CC1)CC2)c1ccccc1	ZINC000456290377	331189183	/nfs/dbraw/zinc/18/91/83/331189183.db2.gz	VXKMCNREEXXDMA-WUJZJPHMSA-N	0	0	283.415	4.185	20	30		CIEDRN
C=CCC1(NC(=O)Cc2c[nH]c3ccccc23)CCCCC1	ZINC000456385911	331192024	/nfs/dbraw/zinc/19/20/24/331192024.db2.gz	SQJOOEYUBSMYMX-UHFFFAOYSA-N	0	0	296.414	4.106	20	30		CIEDRN
CCCCCc1ccc(NC(=O)N[C@H](CC)CC#N)cc1	ZINC000460125062	331193197	/nfs/dbraw/zinc/19/31/97/331193197.db2.gz	OENISJIVGYSTDJ-OAHLLOKOSA-N	0	0	287.407	4.233	20	30		CIEDRN
C=CCC1(CNC(=O)c2sccc2Cl)CCCC1	ZINC000456508724	331194727	/nfs/dbraw/zinc/19/47/27/331194727.db2.gz	PKCNPNVWPYLWFC-UHFFFAOYSA-N	0	0	283.824	4.268	20	30		CIEDRN
Cc1cc(C(=O)Nc2cccc(CC#N)c2)c(C)n1C(C)C	ZINC000456722250	331199076	/nfs/dbraw/zinc/19/90/76/331199076.db2.gz	CLLYXSDBQKLMRT-UHFFFAOYSA-N	0	0	295.386	4.004	20	30		CIEDRN
Cc1ccccc1[C@H](C)CC(=O)Nc1cccc(CC#N)c1	ZINC000456739556	331199610	/nfs/dbraw/zinc/19/96/10/331199610.db2.gz	VPAFHARVGDXQRX-OAHLLOKOSA-N	0	0	292.382	4.193	20	30		CIEDRN
CC(C)[C@H](C(=O)Nc1cccc(CC#N)c1)c1ccccc1	ZINC000456747456	331199877	/nfs/dbraw/zinc/19/98/77/331199877.db2.gz	JBODVQWFFAHVGI-SFHVURJKSA-N	0	0	292.382	4.131	20	30		CIEDRN
C[C@@H](CCC(C)(C)C)C(=O)Nc1cccc(CC#N)c1	ZINC000456760523	331200789	/nfs/dbraw/zinc/20/07/89/331200789.db2.gz	WWXPZFUSHVVMKR-ZDUSSCGKSA-N	0	0	272.392	4.154	20	30		CIEDRN
C=C(CC)CNC(=O)[C@H]1C[C@H]1c1ccc2ccccc2c1	ZINC000456828643	331206341	/nfs/dbraw/zinc/20/63/41/331206341.db2.gz	MOSCYYPDJXYQGW-ROUUACIJSA-N	0	0	279.383	4.026	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@H]1c1ccc(F)cc1C	ZINC000456838653	331207094	/nfs/dbraw/zinc/20/70/94/331207094.db2.gz	JHWSXEJHZCFEAE-INIZCTEOSA-N	0	0	275.367	4.154	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@](C)(Cc1ccccc1)C1CC1	ZINC000457052110	331210922	/nfs/dbraw/zinc/21/09/22/331210922.db2.gz	SUGDMONFXRKPBN-DNVCBOLYSA-N	0	0	285.431	4.116	20	30		CIEDRN
C=CCC1(C(=O)N2CC3(CCCC3)[C@H]2C(C)C)CCC1	ZINC000457150852	331212954	/nfs/dbraw/zinc/21/29/54/331212954.db2.gz	UWBMXSUEBOSTIW-OAHLLOKOSA-N	0	0	275.436	4.160	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CC2(CCCC2)[C@@H]1C(C)C	ZINC000457152713	331213066	/nfs/dbraw/zinc/21/30/66/331213066.db2.gz	XZWKYKQALCIKNJ-GOEBONIOSA-N	0	0	263.425	4.016	20	30		CIEDRN
C=CCC(CC=C)C(=O)NCC(C)(C)C1=CCCC1	ZINC000457181374	331214049	/nfs/dbraw/zinc/21/40/49/331214049.db2.gz	LQUXOOQQLQIVOS-UHFFFAOYSA-N	0	0	261.409	4.008	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@@H](C1CC1)C1CCC1)c1ccccc1	ZINC000457238050	331216830	/nfs/dbraw/zinc/21/68/30/331216830.db2.gz	JOLAKZFINRQWAB-AUUYWEPGSA-N	0	0	283.415	4.041	20	30		CIEDRN
C=CCC[C@H](NC(=O)[C@@H](C)CC(F)(F)F)c1ccccc1	ZINC000457673998	331230833	/nfs/dbraw/zinc/23/08/33/331230833.db2.gz	MEIRDCXKHJBIOU-JSGCOSHPSA-N	0	0	299.336	4.399	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)[C@H](C)CC(F)(F)F	ZINC000457771827	331233887	/nfs/dbraw/zinc/23/38/87/331233887.db2.gz	JGDQZOWMWVBJDO-CYBMUJFWSA-N	0	0	299.336	4.180	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)[C@@H](C)C1CCC1	ZINC000457781880	331234204	/nfs/dbraw/zinc/23/42/04/331234204.db2.gz	YLOXDWXJCPSVSM-HNNXBMFYSA-N	0	0	271.404	4.028	20	30		CIEDRN
Cc1cccc2c1[C@H](C)C[C@H]2CC(=O)NCC(C)(C)CC#N	ZINC000457990887	331239445	/nfs/dbraw/zinc/23/94/45/331239445.db2.gz	ICXWKOHAZYNBCL-CABCVRRESA-N	0	0	298.430	4.032	20	30		CIEDRN
Cc1cccc2c1[C@H](C)C[C@@H]2CC(=O)NCC(C)(C)CC#N	ZINC000457990891	331239477	/nfs/dbraw/zinc/23/94/77/331239477.db2.gz	ICXWKOHAZYNBCL-HUUCEWRRSA-N	0	0	298.430	4.032	20	30		CIEDRN
N#CCCCC(=O)N1CC2(CCCCC2)[C@@H]1c1ccccc1	ZINC000458121321	331243409	/nfs/dbraw/zinc/24/34/09/331243409.db2.gz	HQGUJJBLGAJKAN-SFHVURJKSA-N	0	0	296.414	4.214	20	30		CIEDRN
C=CCC[C@@H](C(=O)N[C@@H]1CCC[C@@H]2C[C@@H]21)c1ccccc1	ZINC000458307292	331248017	/nfs/dbraw/zinc/24/80/17/331248017.db2.gz	UGXCEJAPUCWSPZ-ZJPYXAASSA-N	0	0	283.415	4.041	20	30		CIEDRN
CCC[C@H](NC(=O)c1ccc(C(C)(C)C#N)cc1)C1CCC1	ZINC000458330139	331249006	/nfs/dbraw/zinc/24/90/06/331249006.db2.gz	MGVVKMOQISXJJJ-KRWDZBQOSA-N	0	0	298.430	4.186	20	30		CIEDRN
CC[C@@H]1CCCN1C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000458798614	331260001	/nfs/dbraw/zinc/26/00/01/331260001.db2.gz	IFUQGSUBRLGMCC-IAGOWNOFSA-N	0	0	299.418	4.006	20	30		CIEDRN
N#CCCC[C@@H](NC(=O)N1CCCCCC1)c1ccccc1	ZINC000458801445	331260100	/nfs/dbraw/zinc/26/01/00/331260100.db2.gz	NBOXFZLYNDHGQW-QGZVFWFLSA-N	0	0	299.418	4.007	20	30		CIEDRN
C[C@H]1CCCCN1C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000458807662	331260454	/nfs/dbraw/zinc/26/04/54/331260454.db2.gz	XWUOCWDBIPBYNA-DOTOQJQBSA-N	0	0	299.418	4.006	20	30		CIEDRN
C=CCC1(NC(=O)NCCCC(C)(F)F)CCCCC1	ZINC000458883856	331262279	/nfs/dbraw/zinc/26/22/79/331262279.db2.gz	NFZJNKYYGUFYKO-UHFFFAOYSA-N	0	0	288.382	4.000	20	30		CIEDRN
C=CC(C)(C)CNC(=O)N1CCCCC[C@@H]1c1ccco1	ZINC000458992259	331264742	/nfs/dbraw/zinc/26/47/42/331264742.db2.gz	VKIFINLUEPQSJE-CQSZACIVSA-N	0	0	290.407	4.119	20	30		CIEDRN
C=C(C)CCNC(=O)N1CC[C@@H](C)C[C@@H]1c1ccc(C)o1	ZINC000459009259	331266192	/nfs/dbraw/zinc/26/61/92/331266192.db2.gz	VLPVMKQPPQNLLK-UKRRQHHQSA-N	0	0	290.407	4.037	20	30		CIEDRN
CCC[C@H](NC(=O)Nc1ccc(CC#N)cc1)C1CCCC1	ZINC000459273627	331274257	/nfs/dbraw/zinc/27/42/57/331274257.db2.gz	GCKUAHGHCHCMFH-KRWDZBQOSA-N	0	0	299.418	4.233	20	30		CIEDRN
C[C@H](c1ccc(CN[C@H]2CCC[C@H]2C#N)cc1)C(F)(F)F	ZINC000459451619	331281923	/nfs/dbraw/zinc/28/19/23/331281923.db2.gz	BDZQSYACZFUYQR-UGFHNGPFSA-N	0	0	296.336	4.134	20	30		CIEDRN
CCC[C@@H](NC(=O)Nc1cccc(CC#N)c1)C1CCCC1	ZINC000459610084	331290506	/nfs/dbraw/zinc/29/05/06/331290506.db2.gz	MGGCGUCYSQLSEN-QGZVFWFLSA-N	0	0	299.418	4.233	20	30		CIEDRN
N#CC1(CN2CC3(CCCCC3)[C@@H]2c2ccccc2)CC1	ZINC000459764876	331299331	/nfs/dbraw/zinc/29/93/31/331299331.db2.gz	ZSSVHLWWVSZNIC-KRWDZBQOSA-N	0	0	280.415	4.298	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccccc2OC)CCCCC1	ZINC000459827986	331302311	/nfs/dbraw/zinc/30/23/11/331302311.db2.gz	ZFMAOVRQKCBQFN-UHFFFAOYSA-N	0	0	273.376	4.160	20	30		CIEDRN
CC(C)CC(CC(C)C)C(=O)Nc1sccc1C#N	ZINC000459853659	331302616	/nfs/dbraw/zinc/30/26/16/331302616.db2.gz	DTZTYTJFTMUMFM-UHFFFAOYSA-N	0	0	278.421	4.267	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cccc(Cl)c1F	ZINC000459870789	331302741	/nfs/dbraw/zinc/30/27/41/331302741.db2.gz	XBSZNCHYCMHNBH-UHFFFAOYSA-N	0	0	255.720	4.020	20	30		CIEDRN
C[C@H]1CCN(C(=O)[C@]2(C#N)CC23CCCC3)c2ccccc21	ZINC000459988539	331304113	/nfs/dbraw/zinc/30/41/13/331304113.db2.gz	IZVUFEPINOJZSZ-IFXJQAMLSA-N	0	0	294.398	4.001	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccccc1OCC(C)C	ZINC000460019700	331304414	/nfs/dbraw/zinc/30/44/14/331304414.db2.gz	XQPMRUFJDVPBJB-UHFFFAOYSA-N	0	0	275.392	4.262	20	30		CIEDRN
N#Cc1ccc(C(=O)N(c2ccccc2)C2CCCCC2)o1	ZINC000460019256	331304492	/nfs/dbraw/zinc/30/44/92/331304492.db2.gz	JVDTWSDJBWDFJR-UHFFFAOYSA-N	0	0	294.354	4.131	20	30		CIEDRN
CCC[C@H](CC(C)C)C(=O)N(CC#N)c1ccccc1	ZINC000460064117	331304878	/nfs/dbraw/zinc/30/48/78/331304878.db2.gz	OMWOMRNUWOKZSJ-OAHLLOKOSA-N	0	0	272.392	4.006	20	30		CIEDRN
CC1(C)CCC[C@H](CC(=O)Nc2sccc2C#N)C1	ZINC000164836612	331305306	/nfs/dbraw/zinc/30/53/06/331305306.db2.gz	HMVBJPLDTWZPDU-LLVKDONJSA-N	0	0	276.405	4.165	20	30		CIEDRN
N#Cc1cc(NCc2cccc(Cl)c2F)ccc1F	ZINC000166741301	331307616	/nfs/dbraw/zinc/30/76/16/331307616.db2.gz	TXEXCEUDOHVZOH-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C=C(C)Cn1c([C@@H](C)CC)nnc1N1CCCCC[C@H]1C	ZINC000460960269	331309492	/nfs/dbraw/zinc/30/94/92/331309492.db2.gz	RGKMXLXQTDRDBW-LSDHHAIUSA-N	0	0	290.455	4.137	20	30		CIEDRN
C[C@@H]1C[C@H](C)CN(c2c(C#N)cnc3ccc(Cl)cc32)C1	ZINC000461467321	331313587	/nfs/dbraw/zinc/31/35/87/331313587.db2.gz	ZNOTUIICBLWYHL-TXEJJXNPSA-N	0	0	299.805	4.242	20	30		CIEDRN
COc1ccc(C#N)cc1CNc1cccc(C2CCC2)c1	ZINC000461737710	331314228	/nfs/dbraw/zinc/31/42/28/331314228.db2.gz	QEWIJIBFHAHPIC-UHFFFAOYSA-N	0	0	292.382	4.446	20	30		CIEDRN
CC(C)c1ccc(NC(=O)[C@H](C)c2cccc(C#N)c2)cc1	ZINC000461739474	331314267	/nfs/dbraw/zinc/31/42/67/331314267.db2.gz	QSFQGPFHIFLKQK-CQSZACIVSA-N	0	0	292.382	4.424	20	30		CIEDRN
CC(C)c1ccc(NC(=O)[C@@H](C)c2cccc(C#N)c2)cc1	ZINC000461739473	331314302	/nfs/dbraw/zinc/31/43/02/331314302.db2.gz	QSFQGPFHIFLKQK-AWEZNQCLSA-N	0	0	292.382	4.424	20	30		CIEDRN
Cc1c(Cl)cccc1NC(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000461776318	331314543	/nfs/dbraw/zinc/31/45/43/331314543.db2.gz	BNIRGDBZXPNDLQ-NSHDSACASA-N	0	0	298.773	4.262	20	30		CIEDRN
CC(C)c1ccccc1NC(=O)[C@H](C)c1cccc(C#N)c1	ZINC000461776674	331314621	/nfs/dbraw/zinc/31/46/21/331314621.db2.gz	MWGUKYRQSCTIFW-CQSZACIVSA-N	0	0	292.382	4.424	20	30		CIEDRN
CCC1CCC(N(C)C(=O)[C@@H](C)c2cccc(C#N)c2)CC1	ZINC000461899358	331315261	/nfs/dbraw/zinc/31/52/61/331315261.db2.gz	IXIIEZHROFNWRY-SYJJWHGVSA-N	0	0	298.430	4.089	20	30		CIEDRN
C[C@H](C(=O)N1CCC[C@@H]1CC(C)(C)C)c1cccc(C#N)c1	ZINC000462022750	331316849	/nfs/dbraw/zinc/31/68/49/331316849.db2.gz	HAQNIPMVYHTYFW-WMLDXEAASA-N	0	0	298.430	4.089	20	30		CIEDRN
CCC[C@]1(C)CCCN(C(=O)[C@H](C)c2cccc(C#N)c2)C1	ZINC000462194233	331318195	/nfs/dbraw/zinc/31/81/95/331318195.db2.gz	ZUNHDJWDBUMLAY-DNVCBOLYSA-N	0	0	298.430	4.091	20	30		CIEDRN
CCCc1ccccc1NCCOc1cccc(C#N)c1	ZINC000462207935	331318464	/nfs/dbraw/zinc/31/84/64/331318464.db2.gz	HDJSUWGPIUHGME-UHFFFAOYSA-N	0	0	280.371	4.002	20	30		CIEDRN
CC(C)CC[C@H]1CCCN1C(=O)[C@H](C)c1cccc(C#N)c1	ZINC000462246851	331318800	/nfs/dbraw/zinc/31/88/00/331318800.db2.gz	MOAGPWBEHLXKCW-CRAIPNDOSA-N	0	0	298.430	4.089	20	30		CIEDRN
CC#CCCSCc1coc(-c2ccc(C)cc2)n1	ZINC000462356069	331320357	/nfs/dbraw/zinc/32/03/57/331320357.db2.gz	DKYOYFTYNNVDDU-UHFFFAOYSA-N	0	0	271.385	4.297	20	30		CIEDRN
N#Cc1cc(F)ccc1N[C@H]1CCc2c1cccc2Cl	ZINC000462376411	331320924	/nfs/dbraw/zinc/32/09/24/331320924.db2.gz	JTLMDUCGPKVNRK-INIZCTEOSA-N	0	0	286.737	4.450	20	30		CIEDRN
CC#CCCSc1nnc(-c2ccc(C(C)C)cc2)o1	ZINC000462397509	331321413	/nfs/dbraw/zinc/32/14/13/331321413.db2.gz	MXJQVMFHQRMTMJ-UHFFFAOYSA-N	0	0	286.400	4.366	20	30		CIEDRN
C/C=C\c1ccc(NC(=O)[C@H](C)c2cccc(C#N)c2)cc1	ZINC000462475604	331322613	/nfs/dbraw/zinc/32/26/13/331322613.db2.gz	PJYVZTYCFFMXQE-PKXJPQMGSA-N	0	0	290.366	4.334	20	30		CIEDRN
CCC1(CNC(=O)[C@@H](C)c2cccc(C#N)c2)CCCCC1	ZINC000462497641	331322825	/nfs/dbraw/zinc/32/28/25/331322825.db2.gz	AMUWFHZIQFAGPA-HNNXBMFYSA-N	0	0	298.430	4.138	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)[C@H](C)CC(C)C	ZINC000462492727	331322869	/nfs/dbraw/zinc/32/28/69/331322869.db2.gz	RRJWNPLORFCJEP-CQSZACIVSA-N	0	0	277.383	4.023	20	30		CIEDRN
C[C@@H](C(=O)NCCC1=CCCCCC1)c1cccc(C#N)c1	ZINC000462504910	331322970	/nfs/dbraw/zinc/32/29/70/331322970.db2.gz	SXHZQBDRWLAGQO-OAHLLOKOSA-N	0	0	296.414	4.059	20	30		CIEDRN
C[C@@H](C(=O)NCC1(C)CCCCCC1)c1cccc(C#N)c1	ZINC000462546049	331323350	/nfs/dbraw/zinc/32/33/50/331323350.db2.gz	QBRQQQKQJULQNO-OAHLLOKOSA-N	0	0	298.430	4.138	20	30		CIEDRN
CN(CCCCNc1ccc(F)cc1C#N)c1ccccc1	ZINC000462783850	331328783	/nfs/dbraw/zinc/32/87/83/331328783.db2.gz	WWEICILOUBBZRS-UHFFFAOYSA-N	0	0	297.377	4.026	20	30		CIEDRN
CCc1cccc2c1OCC[C@H]2Nc1ccc(F)cc1C#N	ZINC000462798383	331329578	/nfs/dbraw/zinc/32/95/78/331329578.db2.gz	KWAQSFWGHUYZJT-QGZVFWFLSA-N	0	0	296.345	4.195	20	30		CIEDRN
CN(Cc1ccc(F)cc1Cl)c1ccc(F)cc1C#N	ZINC000462809809	331330240	/nfs/dbraw/zinc/33/02/40/331330240.db2.gz	SONPQRWWAXBRBX-UHFFFAOYSA-N	0	0	292.716	4.126	20	30		CIEDRN
N#Cc1cccc(Cl)c1NC[C@H]1CCOc2ccccc21	ZINC000462829355	331331595	/nfs/dbraw/zinc/33/15/95/331331595.db2.gz	BSWVIKFCDYDFGS-CYBMUJFWSA-N	0	0	298.773	4.190	20	30		CIEDRN
N#Cc1cc(F)ccc1N1CCC[C@]2(CC=CCC2)C1	ZINC000462831467	331331927	/nfs/dbraw/zinc/33/19/27/331331927.db2.gz	CTROKKYZCGNHPP-QGZVFWFLSA-N	0	0	270.351	4.024	20	30		CIEDRN
C[C@@H]1C[C@H](c2ccccc2)CN1c1ccc(F)cc1C#N	ZINC000462846634	331332553	/nfs/dbraw/zinc/33/25/53/331332553.db2.gz	BPNGEKBXUQMBHB-CJNGLKHVSA-N	0	0	280.346	4.080	20	30		CIEDRN
C[C@H]1C[C@@H](c2ccccc2)CN1c1ccc(F)cc1C#N	ZINC000462846636	331332581	/nfs/dbraw/zinc/33/25/81/331332581.db2.gz	BPNGEKBXUQMBHB-XJKSGUPXSA-N	0	0	280.346	4.080	20	30		CIEDRN
N#Cc1cc(F)ccc1N[C@@H](Cc1ccccc1)C1CC1	ZINC000462864007	331332998	/nfs/dbraw/zinc/33/29/98/331332998.db2.gz	SEOTZWMVLTUIPW-SFHVURJKSA-N	0	0	280.346	4.131	20	30		CIEDRN
CC[C@@H](C)[C@H](Nc1ccc(C#N)cn1)c1ccc(Cl)cc1	ZINC000462890976	331334044	/nfs/dbraw/zinc/33/40/44/331334044.db2.gz	PGWRCGXNHXRGFO-PXAZEXFGSA-N	0	0	299.805	4.228	20	30		CIEDRN
C[C@H]1CN(c2ccc(F)cc2C#N)CC[C@H]1c1ccccc1	ZINC000462893995	331334143	/nfs/dbraw/zinc/33/41/43/331334143.db2.gz	HTIUHJFYKLDZHL-KBXCAEBGSA-N	0	0	294.373	4.327	20	30		CIEDRN
N#Cc1ccc(N[C@@H]2CC[C@@H]3CCC[C@H]3C2)c(F)c1	ZINC000462900666	331334382	/nfs/dbraw/zinc/33/43/82/331334382.db2.gz	DCUYSJCAZWOCJI-MELADBBJSA-N	0	0	258.340	4.078	20	30		CIEDRN
C[C@@H]1CN(c2ccc(C#N)cc2)CC[C@H]1c1ccccc1	ZINC000462910997	331334746	/nfs/dbraw/zinc/33/47/46/331334746.db2.gz	LYHZEQISRQNSBB-DNVCBOLYSA-N	0	0	276.383	4.188	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NC(CC(C)C)CC(C)C	ZINC000464440968	331360699	/nfs/dbraw/zinc/36/06/99/331360699.db2.gz	YSEMYEZVQTZRNG-CQSZACIVSA-N	0	0	253.430	4.166	20	30		CIEDRN
C=CCOc1ccc(Oc2ccc(F)cc2[N+](=O)[O-])cc1	ZINC000462935323	331335431	/nfs/dbraw/zinc/33/54/31/331335431.db2.gz	NDCBMXKENZIDRW-UHFFFAOYSA-N	0	0	289.262	4.091	20	30		CIEDRN
C=CCOc1ccc(Oc2nc3cc(F)ccc3o2)cc1	ZINC000462946117	331335695	/nfs/dbraw/zinc/33/56/95/331335695.db2.gz	RBNQWMWPXNJFGA-UHFFFAOYSA-N	0	0	285.274	4.324	20	30		CIEDRN
C[C@@H](c1nc([C@@H]2CCCC[C@@H]2C)no1)c1cccc(C#N)c1	ZINC000463052257	331338748	/nfs/dbraw/zinc/33/87/48/331338748.db2.gz	FAMCCPGBMCNVOY-WOSRLPQWSA-N	0	0	295.386	4.387	20	30		CIEDRN
CC(C)(C)[C@](C)(C#N)NC(=O)c1cccc(C2CCC2)c1	ZINC000463054298	331338781	/nfs/dbraw/zinc/33/87/81/331338781.db2.gz	QNFUFNCIJYVBEA-SFHVURJKSA-N	0	0	284.403	4.012	20	30		CIEDRN
C[C@H](c1nc(CC2(C)CCCC2)no1)c1cccc(C#N)c1	ZINC000463057577	331338961	/nfs/dbraw/zinc/33/89/61/331338961.db2.gz	QMMZJXPTCJFWQE-ZDUSSCGKSA-N	0	0	295.386	4.216	20	30		CIEDRN
Cc1ccc(CC[C@H](C)Nc2ccc(C#N)cc2F)o1	ZINC000463078044	331339706	/nfs/dbraw/zinc/33/97/06/331339706.db2.gz	UYJADYAQERNHEL-NSHDSACASA-N	0	0	272.323	4.032	20	30		CIEDRN
C=CCN(CC=C)C(=O)c1ccc(-c2ccc(CC)cc2)o1	ZINC000463236386	331343372	/nfs/dbraw/zinc/34/33/72/331343372.db2.gz	HLBYCTMEKUDGOD-UHFFFAOYSA-N	0	0	295.382	4.323	20	30		CIEDRN
Cc1cc2cc(C(=O)Nc3cccc(C#N)c3)oc2cc1C	ZINC000463240838	331343778	/nfs/dbraw/zinc/34/37/78/331343778.db2.gz	AMBAOJPZIISPLO-UHFFFAOYSA-N	0	0	290.322	4.174	20	30		CIEDRN
CCCCN1CCc2ccc(N[C@H]3CCC[C@H](C#N)C3)cc21	ZINC000463243354	331343997	/nfs/dbraw/zinc/34/39/97/331343997.db2.gz	PHDRJLKEYKFGNU-RDJZCZTQSA-N	0	0	297.446	4.343	20	30		CIEDRN
CC(C)Oc1cc(F)ccc1N[C@@H]1CCC[C@@H](C#N)C1	ZINC000463246213	331344041	/nfs/dbraw/zinc/34/40/41/331344041.db2.gz	UXACFFPDWPWIDT-TZMCWYRMSA-N	0	0	276.355	4.107	20	30		CIEDRN
C=CCN(CC=C)C(=O)c1cc(Cl)ccc1SCC	ZINC000463253801	331344375	/nfs/dbraw/zinc/34/43/75/331344375.db2.gz	CEZPAQUFEBRLSH-UHFFFAOYSA-N	0	0	295.835	4.266	20	30		CIEDRN
C=CCN(C(=O)c1ccoc1C(F)(F)F)c1ccccc1	ZINC000463256746	331344515	/nfs/dbraw/zinc/34/45/15/331344515.db2.gz	KOPWNXDUVQNENI-UHFFFAOYSA-N	0	0	295.260	4.131	20	30		CIEDRN
C=CCN(CC=C)C(=O)[C@@H](c1cccc(Cl)c1)C(C)C	ZINC000463263532	331344592	/nfs/dbraw/zinc/34/45/92/331344592.db2.gz	UCMHNXMPIUQBTA-MRXNPFEDSA-N	0	0	291.822	4.280	20	30		CIEDRN
Cc1c(Br)cccc1N[C@H]1CCC[C@H](C#N)C1	ZINC000463287184	331345263	/nfs/dbraw/zinc/34/52/63/331345263.db2.gz	JESPOYDMTXPHJG-RYUDHWBXSA-N	0	0	293.208	4.252	20	30		CIEDRN
Cc1c(Br)cccc1N[C@@H]1CCC[C@H](C#N)C1	ZINC000463287183	331345297	/nfs/dbraw/zinc/34/52/97/331345297.db2.gz	JESPOYDMTXPHJG-NWDGAFQWSA-N	0	0	293.208	4.252	20	30		CIEDRN
CCC[C@H](Nc1ccc([N+](=O)[O-])c(C#N)c1)c1ccccc1	ZINC000463435805	331347572	/nfs/dbraw/zinc/34/75/72/331347572.db2.gz	KFJHSCFLWGECOS-INIZCTEOSA-N	0	0	295.342	4.420	20	30		CIEDRN
C=C(C)CN(CC)C(=O)CCc1cccc(C(F)(F)F)c1	ZINC000463500919	331348675	/nfs/dbraw/zinc/34/86/75/331348675.db2.gz	AIGWNGAWMXVRIN-UHFFFAOYSA-N	0	0	299.336	4.063	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)CCCC1CCCC1	ZINC000463563308	331349544	/nfs/dbraw/zinc/34/95/44/331349544.db2.gz	LEQOHOWCQUAQNB-UHFFFAOYSA-N	0	0	270.376	4.166	20	30		CIEDRN
CCC(CC)(NC(=O)CCCC#N)c1ccc(Cl)cc1	ZINC000463725338	331350976	/nfs/dbraw/zinc/35/09/76/331350976.db2.gz	ZCUOUZXDTZWJMS-UHFFFAOYSA-N	0	0	292.810	4.165	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)c1ccc(-c2ccc(CC)cc2)o1	ZINC000463728157	331351039	/nfs/dbraw/zinc/35/10/39/331351039.db2.gz	IZEPBWOGWINYCG-CYBMUJFWSA-N	0	0	283.371	4.203	20	30		CIEDRN
FC(F)(F)CCSCC#Cc1ccccc1Cl	ZINC000464083568	331356504	/nfs/dbraw/zinc/35/65/04/331356504.db2.gz	DGQWRUULZJSMHX-UHFFFAOYSA-N	0	0	278.726	4.377	20	30		CIEDRN
C[C@@H](CC1CCCCC1)C(=O)N[C@@](C)(C#N)C(C)(C)C	ZINC000464158097	331357231	/nfs/dbraw/zinc/35/72/31/331357231.db2.gz	MAKCTTXOZYLZRV-GUYCJALGSA-N	0	0	278.440	4.037	20	30		CIEDRN
CCC(CC)C(=O)N(CC)c1ccc(C#N)c(Cl)c1	ZINC000464199136	331357988	/nfs/dbraw/zinc/35/79/88/331357988.db2.gz	PNQHXNQGXWZHKN-UHFFFAOYSA-N	0	0	278.783	4.001	20	30		CIEDRN
CC(C)(C)[C@@](C)(C#N)NC(=O)c1ccc(C2=CCCC2)cc1	ZINC000464303876	331359510	/nfs/dbraw/zinc/35/95/10/331359510.db2.gz	QFKBICMYJFTHSI-LJQANCHMSA-N	0	0	296.414	4.312	20	30		CIEDRN
CC[C@@H](C)N(C(=O)[C@@H](C)c1cccc(C#N)c1)[C@@H](C)CC	ZINC000464335302	331359817	/nfs/dbraw/zinc/35/98/17/331359817.db2.gz	MTBRPBSKMQQMLG-ZNMIVQPWSA-N	0	0	286.419	4.087	20	30		CIEDRN
CC#CCCCC(=O)N[C@H]1CCCC[C@@H]1Cc1ccccc1	ZINC000464435130	331360426	/nfs/dbraw/zinc/36/04/26/331360426.db2.gz	BWWPRQPGAHGIKT-MOPGFXCFSA-N	0	0	297.442	4.098	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C1CC1)C1CCC(C)CC1	ZINC000464435137	331360491	/nfs/dbraw/zinc/36/04/91/331360491.db2.gz	BYMCTYJTWQNCHX-SLTAFYQDSA-N	0	0	263.425	4.158	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H]1CCCC[C@H]1Cc1ccccc1	ZINC000464435132	331360523	/nfs/dbraw/zinc/36/05/23/331360523.db2.gz	BWWPRQPGAHGIKT-RBUKOAKNSA-N	0	0	297.442	4.098	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CC2(CCC2)c2c1cccc2F	ZINC000464437641	331360560	/nfs/dbraw/zinc/36/05/60/331360560.db2.gz	BPGDMZAZNRGMMK-CYBMUJFWSA-N	0	0	287.378	4.196	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](c1ccc(F)cc1)C1CCC1	ZINC000464439334	331360615	/nfs/dbraw/zinc/36/06/15/331360615.db2.gz	OFBYVTDRMOILBY-CXAGYDPISA-N	0	0	289.394	4.385	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](CCC)Cc1ccccc1	ZINC000464445525	331360748	/nfs/dbraw/zinc/36/07/48/331360748.db2.gz	XCRNKTYHFHVKLI-RDJZCZTQSA-N	0	0	273.420	4.116	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)CCCCc1ccccc1	ZINC000464448429	331360854	/nfs/dbraw/zinc/36/08/54/331360854.db2.gz	GQDJIABFOORFPS-INIZCTEOSA-N	0	0	273.420	4.070	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H](c1ccccc1)C(C)(C)C	ZINC000464450333	331360875	/nfs/dbraw/zinc/36/08/75/331360875.db2.gz	NUQVFEVOSUXDKY-KRWDZBQOSA-N	0	0	271.404	4.084	20	30		CIEDRN
CCCC[C@@H](CC)C(=O)N(CCC#N)C(C)(C)CC	ZINC000464465643	331361054	/nfs/dbraw/zinc/36/10/54/331361054.db2.gz	ZVJFKCBNQBPAJR-CQSZACIVSA-N	0	0	266.429	4.134	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@H](C)c1ccc(C)cc1C	ZINC000464528880	331361768	/nfs/dbraw/zinc/36/17/68/331361768.db2.gz	UQIYRBYPENIAGQ-JKSUJKDBSA-N	0	0	273.420	4.425	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](CCC)c1ccccc1	ZINC000464531853	331361869	/nfs/dbraw/zinc/36/18/69/331361869.db2.gz	BHNUZGMJUGSWAW-GDBMZVCRSA-N	0	0	259.393	4.246	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](c1ccc(C)cc1)C1CC1	ZINC000464537921	331362035	/nfs/dbraw/zinc/36/20/35/331362035.db2.gz	HTEZFJADIWCDDT-YOEHRIQHSA-N	0	0	271.404	4.165	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC)c1ccc(OCC)cc1	ZINC000464571437	331362146	/nfs/dbraw/zinc/36/21/46/331362146.db2.gz	OQLCGYZOQNXQOJ-CQSZACIVSA-N	0	0	275.392	4.041	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)Cc1ccc(C(C)C)cc1	ZINC000464546684	331362254	/nfs/dbraw/zinc/36/22/54/331362254.db2.gz	GJWXGXGDOKZGTL-HNNXBMFYSA-N	0	0	273.420	4.371	20	30		CIEDRN
CC#CCCCC(=O)N(C)Cc1c(Cl)cccc1Cl	ZINC000464550233	331362309	/nfs/dbraw/zinc/36/23/09/331362309.db2.gz	MRLFIKAKYGQPEF-UHFFFAOYSA-N	0	0	298.213	4.145	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cccc(OC(F)(F)F)c1	ZINC000464559278	331362466	/nfs/dbraw/zinc/36/24/66/331362466.db2.gz	GCRZEOQEMLWCFA-SNVBAGLBSA-N	0	0	287.281	4.126	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@H](C)c1c(F)cccc1F	ZINC000464558786	331362548	/nfs/dbraw/zinc/36/25/48/331362548.db2.gz	HAPNEZYATUZBMI-NWDGAFQWSA-N	0	0	281.346	4.087	20	30		CIEDRN
CC#CCCCC(=O)Nc1nc(-c2ccc(C)cc2)cs1	ZINC000464560958	331362567	/nfs/dbraw/zinc/36/25/67/331362567.db2.gz	PYQBSPIBIKFFNH-UHFFFAOYSA-N	0	0	298.411	4.251	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCc1ccc(C(C)C)cc1	ZINC000464565211	331362662	/nfs/dbraw/zinc/36/26/62/331362662.db2.gz	BFTWNECMFVGWGP-AWEZNQCLSA-N	0	0	259.393	4.029	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCc1ccc(Cl)cc1Cl	ZINC000464565791	331362667	/nfs/dbraw/zinc/36/26/67/331362667.db2.gz	BBIJMKUJKNIPHY-SNVBAGLBSA-N	0	0	286.202	4.212	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1nc(-c2cccs2)cs1	ZINC000464570213	331362789	/nfs/dbraw/zinc/36/27/89/331362789.db2.gz	OTRKMCRAAWUVMR-JTQLQIEISA-N	0	0	292.429	4.412	20	30		CIEDRN
CC#CCCCC(=O)N[C@H](C)c1cc(Cl)ccc1Cl	ZINC000464569776	331362794	/nfs/dbraw/zinc/36/27/94/331362794.db2.gz	OCSNLAHABOJGNN-LLVKDONJSA-N	0	0	298.213	4.364	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](C)c2ccccc21	ZINC000464569385	331362832	/nfs/dbraw/zinc/36/28/32/331362832.db2.gz	ITSFGLBMZVSMIS-UONOGXRCSA-N	0	0	257.377	4.129	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1nc2ccc(C)cc2s1	ZINC000464571767	331362897	/nfs/dbraw/zinc/36/28/97/331362897.db2.gz	SYROCKPFNIFPMW-LLVKDONJSA-N	0	0	274.389	4.146	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NC[C@H](c1ccccc1)C(C)C	ZINC000464571786	331362995	/nfs/dbraw/zinc/36/29/95/331362995.db2.gz	SZIKFYJWRDCGDV-WBVHZDCISA-N	0	0	273.420	4.145	20	30		CIEDRN
C=C[C@](C)(CCOC)C(=O)Nc1cccc(C2CCC2)c1	ZINC000464586004	331363312	/nfs/dbraw/zinc/36/33/12/331363312.db2.gz	GBJSRXYFIXOUOV-GOSISDBHSA-N	0	0	287.403	4.121	20	30		CIEDRN
CC#CCCCC(=O)N1CCC[C@H]1CC1CCCCC1	ZINC000464647067	331364113	/nfs/dbraw/zinc/36/41/13/331364113.db2.gz	DNDSSSXAMQXSJN-KRWDZBQOSA-N	0	0	275.436	4.141	20	30		CIEDRN
CC(C)[C@@H](C(=O)Nc1ccc(C#N)c(F)c1)c1ccccc1	ZINC000464647617	331364116	/nfs/dbraw/zinc/36/41/16/331364116.db2.gz	FMUOUGWBNWXGMT-QGZVFWFLSA-N	0	0	296.345	4.076	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@H]1CC(C)(C)C	ZINC000464650297	331364210	/nfs/dbraw/zinc/36/42/10/331364210.db2.gz	YFYJQYHFJMCWSL-KGLIPLIRSA-N	0	0	251.414	4.016	20	30		CIEDRN
N#Cc1ccc(NC(=O)c2cccc(C3CCC3)c2)cc1F	ZINC000464651726	331364216	/nfs/dbraw/zinc/36/42/16/331364216.db2.gz	WJCCAJJMFVXHDL-UHFFFAOYSA-N	0	0	294.329	4.217	20	30		CIEDRN
CC[C@H](CC1CCCCC1)C(=O)N[C@H](C#N)C(C)(C)C	ZINC000464706913	331364953	/nfs/dbraw/zinc/36/49/53/331364953.db2.gz	FFTSMTKRTXUFKV-HUUCEWRRSA-N	0	0	278.440	4.037	20	30		CIEDRN
N#CCN(C1CC1)[C@@H]1CCCC[C@H]1C1CCCCC1	ZINC000464728965	331365514	/nfs/dbraw/zinc/36/55/14/331365514.db2.gz	HPGHQSJITFDSAW-DLBZAZTESA-N	0	0	260.425	4.113	20	30		CIEDRN
C=C[C@@H](C)NC(=O)N(CC)[C@H](C)c1cc2ccccc2o1	ZINC000464753179	331366199	/nfs/dbraw/zinc/36/61/99/331366199.db2.gz	HLSKXWVJADZKMQ-CHWSQXEVSA-N	0	0	286.375	4.100	20	30		CIEDRN
C=C[C@@H](C)NC(=O)N(CC)[C@@H](C)c1cc2ccccc2o1	ZINC000464753180	331366219	/nfs/dbraw/zinc/36/62/19/331366219.db2.gz	HLSKXWVJADZKMQ-OLZOCXBDSA-N	0	0	286.375	4.100	20	30		CIEDRN
C=C[C@H](C)NC(=O)N(CCC)[C@H](CC)c1ccccc1	ZINC000464760133	331366482	/nfs/dbraw/zinc/36/64/82/331366482.db2.gz	CJZQPZCLAQUMKJ-GOEBONIOSA-N	0	0	274.408	4.134	20	30		CIEDRN
N#CCCCCN(c1ccc(F)cc1)C1CCCC1	ZINC000464852068	331371284	/nfs/dbraw/zinc/37/12/84/331371284.db2.gz	KYQANOVNIZAJKG-UHFFFAOYSA-N	0	0	260.356	4.269	20	30		CIEDRN
CCC1(C(=O)Nc2ccc(Cl)c(C#N)c2)CCCC1	ZINC000464853142	331371298	/nfs/dbraw/zinc/37/12/98/331371298.db2.gz	DNSAWZVFRRIPMB-UHFFFAOYSA-N	0	0	276.767	4.121	20	30		CIEDRN
C=CCCCC(=O)NCc1ccc(C)cc1O[C@@H](C)CC	ZINC000464992552	331375435	/nfs/dbraw/zinc/37/54/35/331375435.db2.gz	HKIKOAODCMVXJO-HNNXBMFYSA-N	0	0	289.419	4.145	20	30		CIEDRN
C=CCCC(=O)N(CCc1cccc(F)c1)C1CCCC1	ZINC000465088685	331377863	/nfs/dbraw/zinc/37/78/63/331377863.db2.gz	KAAIGHCARSWPPQ-UHFFFAOYSA-N	0	0	289.394	4.106	20	30		CIEDRN
C=CC[C@H](C)NC(=O)c1cccc(NCC(C)(C)C)c1C	ZINC000465432651	331383070	/nfs/dbraw/zinc/38/30/70/331383070.db2.gz	YLBBNMPIVTZMLV-ZDUSSCGKSA-N	0	0	288.435	4.147	20	30		CIEDRN
CCC1(C(=O)Nc2sc(C)c(C)c2C#N)CCCC1	ZINC000465452095	331383780	/nfs/dbraw/zinc/38/37/80/331383780.db2.gz	KQEPCKPLRFOYHA-UHFFFAOYSA-N	0	0	276.405	4.146	20	30		CIEDRN
C=CCCCCCN(C)C(=O)N[C@@H](C)C1CCCCC1	ZINC000466004996	331388588	/nfs/dbraw/zinc/38/85/88/331388588.db2.gz	FJNNCMTZTMEWHR-HNNXBMFYSA-N	0	0	280.456	4.343	20	30		CIEDRN
C[C@@H]1CCC[C@](C#N)(NC(=O)c2cccc3ccsc32)C1	ZINC000466234776	331391376	/nfs/dbraw/zinc/39/13/76/331391376.db2.gz	HIAUISNVURDGBM-PXAZEXFGSA-N	0	0	298.411	4.104	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1[C@H](C)Cc2cc(F)ccc2[C@H]1C	ZINC000466242932	331391561	/nfs/dbraw/zinc/39/15/61/331391561.db2.gz	FVCLUHVNUGQMQK-BFHYXJOUSA-N	0	0	289.394	4.262	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCc2ccc(C(C)(C)C)cc2C1	ZINC000466256661	331391698	/nfs/dbraw/zinc/39/16/98/331391698.db2.gz	RHBMOPMSJWLQSV-HNNXBMFYSA-N	0	0	299.458	4.471	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(Cc1ccccc1)C(C)(C)C	ZINC000466251920	331391720	/nfs/dbraw/zinc/39/17/20/331391720.db2.gz	CBZKNELCPCSLAX-OAHLLOKOSA-N	0	0	273.420	4.416	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](c1cccc(C)c1)C(F)(F)F	ZINC000466261415	331391788	/nfs/dbraw/zinc/39/17/88/331391788.db2.gz	SVKWKPMDZULZCW-JSGCOSHPSA-N	0	0	299.336	4.317	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(Cc1ccccc1)[C@H](C)CC	ZINC000466321188	331392731	/nfs/dbraw/zinc/39/27/31/331392731.db2.gz	UGTNLJBJZINCEH-NVXWUHKLSA-N	0	0	288.435	4.351	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CCCC2(CCCCC2)C1	ZINC000466323425	331392848	/nfs/dbraw/zinc/39/28/48/331392848.db2.gz	WOPZPJTXRGOFCK-HNNXBMFYSA-N	0	0	278.440	4.097	20	30		CIEDRN
N#Cc1ccc(SCc2ccc(F)cc2F)c(F)c1	ZINC000466366869	331393601	/nfs/dbraw/zinc/39/36/01/331393601.db2.gz	MKEONEDLRLJNNQ-UHFFFAOYSA-N	0	0	279.286	4.268	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N[C@H](C)c1ccc(SC)cc1	ZINC000466367486	331393606	/nfs/dbraw/zinc/39/36/06/331393606.db2.gz	VNEBIIMAMDIMCT-TZMCWYRMSA-N	0	0	292.448	4.123	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(C)[C@H](CC)Cc1ccccc1	ZINC000466367052	331393649	/nfs/dbraw/zinc/39/36/49/331393649.db2.gz	OVACJWDQFVUSQI-IAGOWNOFSA-N	0	0	288.435	4.004	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(C)[C@H](C)c1ccc(C)cc1	ZINC000466367686	331393664	/nfs/dbraw/zinc/39/36/64/331393664.db2.gz	YJVBRWQXNSMUPM-GDBMZVCRSA-N	0	0	274.408	4.052	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CC2(CCCC2)c2ccccc21	ZINC000466377002	331393884	/nfs/dbraw/zinc/39/38/84/331393884.db2.gz	ALSXEFJVBGUTEN-HNNXBMFYSA-N	0	0	298.430	4.383	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000466377527	331393967	/nfs/dbraw/zinc/39/39/67/331393967.db2.gz	ULROPJFLBCUBHQ-DPYIKZRWSA-N	0	0	298.430	4.229	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N1CCC[C@@H]1c1cccc(F)c1	ZINC000466380179	331394117	/nfs/dbraw/zinc/39/41/17/331394117.db2.gz	MDQOTVHUVHYLCH-HZPDHXFCSA-N	0	0	290.382	4.027	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N1CCC[C@@H]1C1CCCCC1	ZINC000466385880	331394312	/nfs/dbraw/zinc/39/43/12/331394312.db2.gz	LAOZUUGEHWYQDB-HZPDHXFCSA-N	0	0	278.440	4.095	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1ccccc1CCC	ZINC000466385747	331394359	/nfs/dbraw/zinc/39/43/59/331394359.db2.gz	JKEHXOGPLLYKPH-AWEZNQCLSA-N	0	0	260.381	4.115	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1ccc(COC(C)C)cc1	ZINC000466387976	331394426	/nfs/dbraw/zinc/39/44/26/331394426.db2.gz	HXTSTHNBZBUDFR-OAHLLOKOSA-N	0	0	290.407	4.088	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(CC)Cc1c[nH]c2ccccc12	ZINC000466401371	331395088	/nfs/dbraw/zinc/39/50/88/331395088.db2.gz	IOXFCLORRMDVPR-HNNXBMFYSA-N	0	0	299.418	4.054	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1ccc(C(C)C)cc1	ZINC000466407374	331395463	/nfs/dbraw/zinc/39/54/63/331395463.db2.gz	OVSJTVAOUYBQRK-CQSZACIVSA-N	0	0	260.381	4.286	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCCC[C@@H]1[C@H](C)CC	ZINC000466418683	331396027	/nfs/dbraw/zinc/39/60/27/331396027.db2.gz	ZSKGULQSJSDJET-QLFBSQMISA-N	0	0	251.414	4.016	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](c1ccc(F)cc1F)C(C)C	ZINC000466424607	331396478	/nfs/dbraw/zinc/39/64/78/331396478.db2.gz	IYTJOCUOGKLVDU-MLGOLLRUSA-N	0	0	295.373	4.380	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H]1CCC[C@H]1c1ccccc1	ZINC000466425757	331396631	/nfs/dbraw/zinc/39/66/31/331396631.db2.gz	MZUDUONHOQHTSY-XIRDDKMYSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CCC)CCc1cccc(F)c1	ZINC000466427671	331396823	/nfs/dbraw/zinc/39/68/23/331396823.db2.gz	CHWMANSHDQTMBL-OAHLLOKOSA-N	0	0	291.410	4.209	20	30		CIEDRN
CC#CCCCC(=O)N[C@H](C)c1cccc(Cl)c1Cl	ZINC000466430187	331396928	/nfs/dbraw/zinc/39/69/28/331396928.db2.gz	GVXKZBRVIWOZND-LLVKDONJSA-N	0	0	298.213	4.364	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC1CCC1)c1ccccc1	ZINC000466429946	331396970	/nfs/dbraw/zinc/39/69/70/331396970.db2.gz	BQENSDIWEWFDLW-HNNXBMFYSA-N	0	0	271.404	4.422	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CC[C@@H](c2ccc(Cl)cc2)C1	ZINC000466433122	331396986	/nfs/dbraw/zinc/39/69/86/331396986.db2.gz	ADEMKSYFNFFTFB-UKRRQHHQSA-N	0	0	291.822	4.258	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccc2[nH]c(CCCC)nc2c1	ZINC000466433684	331396994	/nfs/dbraw/zinc/39/69/94/331396994.db2.gz	FJYBNMWLTSDBGV-UHFFFAOYSA-N	0	0	297.402	4.038	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@@H](C)Cc1ccc(Cl)cc1	ZINC000466433975	331397020	/nfs/dbraw/zinc/39/70/20/331397020.db2.gz	MPWJNMKUVJUZKM-KBPBESRZSA-N	0	0	293.838	4.332	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](c2ccc(Cl)cc2)C1	ZINC000466433123	331397076	/nfs/dbraw/zinc/39/70/76/331397076.db2.gz	ADEMKSYFNFFTFB-ZFWWWQNUSA-N	0	0	291.822	4.258	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cc(C)ccc1-n1cc(C)cn1	ZINC000466438665	331397109	/nfs/dbraw/zinc/39/71/09/331397109.db2.gz	NQPHERNYYRTMQJ-OAHLLOKOSA-N	0	0	297.402	4.030	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NC[C@@H]1CCC[C@@H](C(F)(F)F)C1	ZINC000466437439	331397124	/nfs/dbraw/zinc/39/71/24/331397124.db2.gz	BVDVMGNYNLDOKD-YNEHKIRRSA-N	0	0	291.357	4.074	20	30		CIEDRN
C=CCC[C@@H](NC(=O)[C@H](C)CC(=C)C)c1ccccc1	ZINC000466441089	331397216	/nfs/dbraw/zinc/39/72/16/331397216.db2.gz	LPVFKRHBTUVMBN-NVXWUHKLSA-N	0	0	271.404	4.412	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@H]1CCCC[C@H]1CC	ZINC000466441445	331397249	/nfs/dbraw/zinc/39/72/49/331397249.db2.gz	NTHLZMDWPIYPNH-ZNMIVQPWSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CCC[C@@H]1Cc1ccccc1	ZINC000466444659	331397281	/nfs/dbraw/zinc/39/72/81/331397281.db2.gz	YJMLNPBCKFQQFN-CGTJXYLNSA-N	0	0	285.431	4.116	20	30		CIEDRN
CC(C)(C)Nc1ccccc1NC(=O)c1ccc(C#N)s1	ZINC000466465264	331397790	/nfs/dbraw/zinc/39/77/90/331397790.db2.gz	OYTNSXVGTDIXLX-UHFFFAOYSA-N	0	0	299.399	4.082	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)CCOc1ccccc1C(C)C	ZINC000466531220	331399149	/nfs/dbraw/zinc/39/91/49/331399149.db2.gz	XNEAGBFZZDPKQH-OAHLLOKOSA-N	0	0	289.419	4.050	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@H](OC(C)(C)C)c1ccccc1	ZINC000466529206	331399215	/nfs/dbraw/zinc/39/92/15/331399215.db2.gz	NMITTWPTOKRDEK-JKSUJKDBSA-N	0	0	289.419	4.014	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCC1(Cc2ccccc2)CCC1	ZINC000466531795	331399263	/nfs/dbraw/zinc/39/92/63/331399263.db2.gz	REAJINQSWWDVKO-INIZCTEOSA-N	0	0	285.431	4.118	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@@H](CC(C)C)c1ccccc1	ZINC000466540598	331399526	/nfs/dbraw/zinc/39/95/26/331399526.db2.gz	KWKCVMZRDVZPTM-IRXDYDNUSA-N	0	0	273.420	4.287	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)[C@H](CC(C)C)c1ccccc1	ZINC000466540596	331399529	/nfs/dbraw/zinc/39/95/29/331399529.db2.gz	KWKCVMZRDVZPTM-IAGOWNOFSA-N	0	0	273.420	4.287	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)C(C)(C)Cc1cccc(Cl)c1	ZINC000466543915	331399568	/nfs/dbraw/zinc/39/95/68/331399568.db2.gz	MNMJRPBEHMNTHX-HNNXBMFYSA-N	0	0	293.838	4.380	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1sccc1-c1ccccc1	ZINC000466543143	331399612	/nfs/dbraw/zinc/39/96/12/331399612.db2.gz	SQFRJJUXRVRXHI-AWEZNQCLSA-N	0	0	285.412	4.500	20	30		CIEDRN
C=CCCN(C)C(=O)[C@@H](CCC)CC1CCCC1	ZINC000466632789	331401025	/nfs/dbraw/zinc/40/10/25/331401025.db2.gz	BZIAQNTUOKLOCK-HNNXBMFYSA-N	0	0	251.414	4.018	20	30		CIEDRN
C=CCCN(C)C(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1Cl	ZINC000466641292	331401291	/nfs/dbraw/zinc/40/12/91/331401291.db2.gz	SEGAKALPCRBRBA-VXGBXAGGSA-N	0	0	298.213	4.131	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](CC)Cc1ccc(Cl)cc1	ZINC000466642309	331401415	/nfs/dbraw/zinc/40/14/15/331401415.db2.gz	QBHPSGGYVABPII-CZUORRHYSA-N	0	0	293.838	4.380	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H]1c2cccc(F)c2CC[C@@H]1C	ZINC000466642724	331401454	/nfs/dbraw/zinc/40/14/54/331401454.db2.gz	RNQINFYKJZZELZ-GDZNZVCISA-N	0	0	289.394	4.168	20	30		CIEDRN
C=CCCN(C)C(=O)c1ccccc1SCC=C(C)C	ZINC000466645765	331401559	/nfs/dbraw/zinc/40/15/59/331401559.db2.gz	ZJGXBOSPOCUQBX-UHFFFAOYSA-N	0	0	289.444	4.393	20	30		CIEDRN
CC#CCCCC(=O)N(C)[C@@H]1CCC[C@@H]1c1ccc(C)cc1	ZINC000466862980	331406695	/nfs/dbraw/zinc/40/66/95/331406695.db2.gz	XNQRQYFDCZOLNJ-RTBURBONSA-N	0	0	297.442	4.283	20	30		CIEDRN
CC#CCCCC(=O)Nc1cc(Cl)c(C)cc1Cl	ZINC000466864216	331406731	/nfs/dbraw/zinc/40/67/31/331406731.db2.gz	SXEFKLZYUFWFED-UHFFFAOYSA-N	0	0	284.186	4.434	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCCc2cc(Cl)cc(F)c21	ZINC000466867121	331406736	/nfs/dbraw/zinc/40/67/36/331406736.db2.gz	KAOXWTBHEWOLBR-LLVKDONJSA-N	0	0	295.785	4.361	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1c2ccccc2SC[C@@H]1C	ZINC000466869806	331406862	/nfs/dbraw/zinc/40/68/62/331406862.db2.gz	DZIOIYRVMQYCDA-STQMWFEESA-N	0	0	275.417	4.116	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1C[C@H](C)CSc2ccccc21	ZINC000466878203	331407033	/nfs/dbraw/zinc/40/70/33/331407033.db2.gz	QFMBEXBBCSDLNA-KBPBESRZSA-N	0	0	289.444	4.364	20	30		CIEDRN
C=CCCN(C)C(=O)N[C@H](c1cccs1)C(CC)CC	ZINC000466973742	331409498	/nfs/dbraw/zinc/40/94/98/331409498.db2.gz	PATLBBZKBURVRB-HNNXBMFYSA-N	0	0	294.464	4.443	20	30		CIEDRN
CSc1ccc(F)cc1CNc1ccc(C#N)cc1F	ZINC000467016033	331410421	/nfs/dbraw/zinc/41/04/21/331410421.db2.gz	UZRMVGZASVHLSC-UHFFFAOYSA-N	0	0	290.338	4.170	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCc1ccc(C(F)(F)F)cc1C	ZINC000467025262	331410641	/nfs/dbraw/zinc/41/06/41/331410641.db2.gz	SDQZFYWVKWUARF-GFCCVEGCSA-N	0	0	299.336	4.232	20	30		CIEDRN
C=CCC(CC=C)C(=O)NCc1cccc2ccccc21	ZINC000467327380	331415106	/nfs/dbraw/zinc/41/51/06/331415106.db2.gz	ICYZBXBNOFBTKS-UHFFFAOYSA-N	0	0	279.383	4.224	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H]1CCC[C@@H]1CCCC	ZINC000467360650	331416242	/nfs/dbraw/zinc/41/62/42/331416242.db2.gz	YXQZAUFNPNMFHN-GOEBONIOSA-N	0	0	263.425	4.230	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H]1CCC(C)(C)C[C@@H]1C	ZINC000467371533	331416713	/nfs/dbraw/zinc/41/67/13/331416713.db2.gz	VKILCMORZDQAPT-ZFWWWQNUSA-N	0	0	263.425	4.086	20	30		CIEDRN
C=CCC(CC=C)C(=O)N([C@@H](C)[C@H](C)CC)C1CC1	ZINC000467518176	331420916	/nfs/dbraw/zinc/42/09/16/331420916.db2.gz	BSYPYRYVYUNXMJ-KGLIPLIRSA-N	0	0	263.425	4.180	20	30		CIEDRN
C=CCC(CC=C)C(=O)NC(C)(C)c1cccc(Cl)c1	ZINC000467520616	331421136	/nfs/dbraw/zinc/42/11/36/331421136.db2.gz	VSIFPXPVIZLWPQ-UHFFFAOYSA-N	0	0	291.822	4.460	20	30		CIEDRN
C=CCCSCCOc1ccc(OC(F)(F)F)cc1	ZINC000467541158	331421558	/nfs/dbraw/zinc/42/15/58/331421558.db2.gz	SINRCODTUNNNCR-UHFFFAOYSA-N	0	0	292.322	4.273	20	30		CIEDRN
C=CCC(CC=C)C(=O)NCc1ccc(Cl)cc1Cl	ZINC000467737234	331423582	/nfs/dbraw/zinc/42/35/82/331423582.db2.gz	IDIQSAAZOJPOCC-UHFFFAOYSA-N	0	0	298.213	4.378	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H](c1ccc(C)cc1)C1CC1	ZINC000467748231	331423738	/nfs/dbraw/zinc/42/37/38/331423738.db2.gz	VHCQFQORTJLCAB-SFHVURJKSA-N	0	0	283.415	4.331	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1nc(C(C)(C)C)cs1	ZINC000467830089	331424311	/nfs/dbraw/zinc/42/43/11/331424311.db2.gz	YVXOQENJZOMERN-UHFFFAOYSA-N	0	0	278.421	4.148	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)c1cc(C)cc(C)c1	ZINC000467821922	331424341	/nfs/dbraw/zinc/42/43/41/331424341.db2.gz	HHZRRSHPWRTABN-UHFFFAOYSA-N	0	0	257.377	4.035	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)[C@@H](C)c1c(F)cccc1F	ZINC000467819099	331424369	/nfs/dbraw/zinc/42/43/69/331424369.db2.gz	LCJOJWGZLWCCPS-LBPRGKRZSA-N	0	0	293.357	4.253	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC)c1cccc(Cl)c1	ZINC000467818690	331424400	/nfs/dbraw/zinc/42/44/00/331424400.db2.gz	FMXQAUCRNJLRJR-UHFFFAOYSA-N	0	0	277.795	4.461	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)[C@H]1CCCC[C@H]1CC	ZINC000467861093	331424650	/nfs/dbraw/zinc/42/46/50/331424650.db2.gz	CSKRRYSPSZECAY-ZBFHGGJFSA-N	0	0	263.425	4.182	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H]1CC[C@H](Cc2ccccc2)C1	ZINC000467879436	331425088	/nfs/dbraw/zinc/42/50/88/331425088.db2.gz	WOAYTJLIQKXVNJ-ZHALLVOQSA-N	0	0	285.431	4.116	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H](C)c1c(F)cccc1Cl	ZINC000467965444	331426147	/nfs/dbraw/zinc/42/61/47/331426147.db2.gz	ZEEMZDSIZXYCBR-ZUZCIYMTSA-N	0	0	283.774	4.259	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H](C#N)c1ccc(C(C)(C)C)cc1	ZINC000467972526	331426152	/nfs/dbraw/zinc/42/61/52/331426152.db2.gz	BFGOMMXIEDUOKV-QFBILLFUSA-N	0	0	298.430	4.267	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(-c2ccc[nH]2)cc1	ZINC000467978212	331426205	/nfs/dbraw/zinc/42/62/05/331426205.db2.gz	HAEZSLIGUNQQMX-QGZVFWFLSA-N	0	0	268.360	4.223	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)NC[C@H]1CCC[C@H](C(F)(F)F)C1	ZINC000467995631	331426477	/nfs/dbraw/zinc/42/64/77/331426477.db2.gz	QLJNTSGVDQNVSL-SGMGOOAPSA-N	0	0	291.357	4.074	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CC[C@@](C)(CCc2ccccc2)C1	ZINC000467993825	331426478	/nfs/dbraw/zinc/42/64/78/331426478.db2.gz	IUDZTIYOEURIPE-UXHICEINSA-N	0	0	299.458	4.460	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc2nn(C(C)C)cc2c1	ZINC000468000725	331426529	/nfs/dbraw/zinc/42/65/29/331426529.db2.gz	RZYBDVUBJZHNFK-KRWDZBQOSA-N	0	0	285.391	4.158	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H](C)c1cccc(C)c1C	ZINC000468011738	331426613	/nfs/dbraw/zinc/42/66/13/331426613.db2.gz	MTAUKBKAZJHOBY-WMLDXEAASA-N	0	0	259.393	4.083	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1sc(C)c(CC)c1C#N	ZINC000468013678	331426622	/nfs/dbraw/zinc/42/66/22/331426622.db2.gz	JDJUZIYMOXIOIR-OAHLLOKOSA-N	0	0	276.405	4.031	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CCC[C@H](C(C)(C)C)CC1	ZINC000468010683	331426663	/nfs/dbraw/zinc/42/66/63/331426663.db2.gz	AOGHIZLKMITVHK-WMLDXEAASA-N	0	0	265.441	4.264	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H](C(C)(C)C)CC1	ZINC000468010682	331426678	/nfs/dbraw/zinc/42/66/78/331426678.db2.gz	AOGHIZLKMITVHK-RHSMWYFYSA-N	0	0	265.441	4.264	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](c2ccc(Cl)cc2)C1	ZINC000468022817	331426722	/nfs/dbraw/zinc/42/67/22/331426722.db2.gz	RRZRYTQPRLJFKE-YOEHRIQHSA-N	0	0	291.822	4.258	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)NCc1ccc(C(C)C)cc1	ZINC000468113025	331428736	/nfs/dbraw/zinc/42/87/36/331428736.db2.gz	HXEWWLNIHVTTBS-KRWDZBQOSA-N	0	0	259.393	4.029	20	30		CIEDRN
CC(C)CN(Cc1ccc(F)c(C#N)c1)c1cccc(O)c1	ZINC000468272384	331431681	/nfs/dbraw/zinc/43/16/81/331431681.db2.gz	KVXDRBZMAOSKRV-UHFFFAOYSA-N	0	0	298.361	4.066	20	30		CIEDRN
C=CCCCNC(=O)[C@@H](C)c1ccc2ccccc2c1	ZINC000468366312	331432891	/nfs/dbraw/zinc/43/28/91/331432891.db2.gz	FLRZVZPVFLBMOA-AWEZNQCLSA-N	0	0	267.372	4.026	20	30		CIEDRN
C=CCCCNC(=O)CCc1cc(Cl)cc(Cl)c1	ZINC000468368327	331432925	/nfs/dbraw/zinc/43/29/25/331432925.db2.gz	SUVILOQFOXRKOW-UHFFFAOYSA-N	0	0	286.202	4.008	20	30		CIEDRN
C=CCCCNC(=O)C1(c2c(Cl)cccc2Cl)CC1	ZINC000468392656	331433767	/nfs/dbraw/zinc/43/37/67/331433767.db2.gz	OKNMESHLEQCZBS-UHFFFAOYSA-N	0	0	298.213	4.107	20	30		CIEDRN
C=CCCCNC(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1	ZINC000468395031	331433799	/nfs/dbraw/zinc/43/37/99/331433799.db2.gz	KHYRYXPQLNJDFO-ZWKOTPCHSA-N	0	0	279.383	4.026	20	30		CIEDRN
C=CCCCNC(=O)c1cc2c(ccc3ccccc23)[nH]1	ZINC000468393593	331433889	/nfs/dbraw/zinc/43/38/89/331433889.db2.gz	VBXFQWSOQGFJND-UHFFFAOYSA-N	0	0	278.355	4.017	20	30		CIEDRN
C=CCCCNC(=O)c1cc2ccccc2c2cccnc12	ZINC000468400167	331434101	/nfs/dbraw/zinc/43/41/01/331434101.db2.gz	VOXXQGXEGDSLFV-UHFFFAOYSA-N	0	0	290.366	4.084	20	30		CIEDRN
N#CC1(CSC/C=C/c2ccc(Cl)cc2)CC1	ZINC000468656556	331438414	/nfs/dbraw/zinc/43/84/14/331438414.db2.gz	XLZSSSRBINERJR-OWOJBTEDSA-N	0	0	263.793	4.390	20	30		CIEDRN
N#CC1(CSC/C=C\c2ccc(Cl)cc2)CC1	ZINC000468656557	331438448	/nfs/dbraw/zinc/43/84/48/331438448.db2.gz	XLZSSSRBINERJR-UPHRSURJSA-N	0	0	263.793	4.390	20	30		CIEDRN
C=CCCCCCN(C)C(=O)C[C@@H]1CC[C@@H](C)C1	ZINC000469135428	331444592	/nfs/dbraw/zinc/44/45/92/331444592.db2.gz	QBTAPWCHNLDMDM-HUUCEWRRSA-N	0	0	251.414	4.018	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)CC(CC)CC	ZINC000469090782	331445574	/nfs/dbraw/zinc/44/55/74/331445574.db2.gz	ZBKKTUKEXFUZSX-UHFFFAOYSA-N	0	0	277.383	4.167	20	30		CIEDRN
C=CCN(Cc1ccccc1F)Cc1cc(F)ccc1C#N	ZINC000469225534	331447930	/nfs/dbraw/zinc/44/79/30/331447930.db2.gz	NDDZSGBZFFKGOF-UHFFFAOYSA-N	0	0	298.336	4.025	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@@](C)(c3ccc(C)cc3)C2)CCC1	ZINC000469333669	331449777	/nfs/dbraw/zinc/44/97/77/331449777.db2.gz	CMPRCJCFFIXLQZ-LJQANCHMSA-N	0	0	297.442	4.231	20	30		CIEDRN
C=CCCCN(C)C(=O)[C@H](C)Oc1cccc2ccccc21	ZINC000469457368	331452080	/nfs/dbraw/zinc/45/20/80/331452080.db2.gz	QZSDTLPGVQEJNN-HNNXBMFYSA-N	0	0	297.398	4.032	20	30		CIEDRN
CCc1c(C)sc(NC(=O)C[C@H]2CC[C@H](C)C2)c1C#N	ZINC000469476503	331452409	/nfs/dbraw/zinc/45/24/09/331452409.db2.gz	QPOYEKURASYQRN-JQWIXIFHSA-N	0	0	290.432	4.255	20	30		CIEDRN
CC(C)[C@@H]1CCC[C@H](NC(=O)c2ccc(CC#N)cc2)CC1	ZINC000469478592	331452601	/nfs/dbraw/zinc/45/26/01/331452601.db2.gz	UVKAYSALKALIGY-AEFFLSMTSA-N	0	0	298.430	4.087	20	30		CIEDRN
CCCC(C)(C)CC(=O)Nc1cccc(C#N)c1C	ZINC000469680393	331455365	/nfs/dbraw/zinc/45/53/65/331455365.db2.gz	AEOGFISGFTWLIP-UHFFFAOYSA-N	0	0	258.365	4.022	20	30		CIEDRN
C[C@H](NCc1ccccc1C#N)c1ccc2ncsc2c1	ZINC000469777532	331457851	/nfs/dbraw/zinc/45/78/51/331457851.db2.gz	AHKUEKWGMYQBFJ-LBPRGKRZSA-N	0	0	293.395	4.019	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)C[C@H]1CCC[C@H]1C	ZINC000469930993	331465279	/nfs/dbraw/zinc/46/52/79/331465279.db2.gz	ZOZDUKSURIGNSS-HUUCEWRRSA-N	0	0	289.394	4.167	20	30		CIEDRN
C[C@@H]1CC[C@H](C(=O)NC2(C#N)CCC(C(C)(C)C)CC2)C1	ZINC000470186654	331474763	/nfs/dbraw/zinc/47/47/63/331474763.db2.gz	SYNGZPQCVPFNIK-CZSZNVFWSA-N	0	0	290.451	4.037	20	30		CIEDRN
C=CC[C@H]1N(C(=O)CCC(C)C)CCCC1(C)C	ZINC000470289118	331477880	/nfs/dbraw/zinc/47/78/80/331477880.db2.gz	RYNLXJONPIIGLA-CQSZACIVSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)C[C@H](C)CC)CCCC1(C)C	ZINC000470287069	331478158	/nfs/dbraw/zinc/47/81/58/331478158.db2.gz	XZTPTDZESQZZBG-KGLIPLIRSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)C[C@H](OCC)C(C)C)CCCC1(C)C	ZINC000470292754	331478405	/nfs/dbraw/zinc/47/84/05/331478405.db2.gz	LBAWHIMFCJHUDJ-HOTGVXAUSA-N	0	0	295.467	4.031	20	30		CIEDRN
C=CCC[C@H](C(=O)NCc1cscc1C)c1ccccc1	ZINC000470463150	331483227	/nfs/dbraw/zinc/48/32/27/331483227.db2.gz	GUIJWMJUHFCQKU-KRWDZBQOSA-N	0	0	299.439	4.423	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1C[C@H](c2ccc(C)cc2)C[C@H]1C	ZINC000470573620	331485594	/nfs/dbraw/zinc/48/55/94/331485594.db2.gz	KJDASCNEBZIGAH-VQIMIIECSA-N	0	0	297.442	4.468	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)C[C@@H](C)CC	ZINC000470637338	331486548	/nfs/dbraw/zinc/48/65/48/331486548.db2.gz	PTMUBNUVJJUCER-HNNXBMFYSA-N	0	0	259.393	4.028	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)C[C@H](C)CC	ZINC000470637340	331486606	/nfs/dbraw/zinc/48/66/06/331486606.db2.gz	PTMUBNUVJJUCER-OAHLLOKOSA-N	0	0	259.393	4.028	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC(=C)C)Cc1ccccc1	ZINC000470640891	331486762	/nfs/dbraw/zinc/48/67/62/331486762.db2.gz	GPQBHWXZCVHELJ-UHFFFAOYSA-N	0	0	283.415	4.360	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC(=C)C)Cc1ccccc1	ZINC000470644908	331486766	/nfs/dbraw/zinc/48/67/66/331486766.db2.gz	NNNJUOFSJVRIEU-INIZCTEOSA-N	0	0	271.404	4.194	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)CCc1ccc(C)o1	ZINC000470644769	331486802	/nfs/dbraw/zinc/48/68/02/331486802.db2.gz	MWUFGZLQKKMLDO-UHFFFAOYSA-N	0	0	297.398	4.126	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)CCc1cccs1	ZINC000470645632	331486875	/nfs/dbraw/zinc/48/68/75/331486875.db2.gz	RICYENVBRRDJMY-UHFFFAOYSA-N	0	0	299.439	4.286	20	30		CIEDRN
C=CCCCC(=O)N1CCC(CCC(C)C)CC1	ZINC000470772317	331490310	/nfs/dbraw/zinc/49/03/10/331490310.db2.gz	JSDLEERSMLKEAT-UHFFFAOYSA-N	0	0	251.414	4.018	20	30		CIEDRN
C=CCCC(=O)N(c1ccccc1)C1Cc2ccccc2C1	ZINC000470772255	331490440	/nfs/dbraw/zinc/49/04/40/331490440.db2.gz	JKYLGKCDNQMQJG-UHFFFAOYSA-N	0	0	291.394	4.153	20	30		CIEDRN
CC1(C)CCCN(Cc2cccc(C(F)F)c2)[C@@H]1C#N	ZINC000470864952	331493078	/nfs/dbraw/zinc/49/30/78/331493078.db2.gz	DIAVZTCURKMFMG-CQSZACIVSA-N	0	0	278.346	4.138	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000471138395	331501876	/nfs/dbraw/zinc/50/18/76/331501876.db2.gz	YVXFWFMBHSJZMV-UHFFFAOYSA-N	0	0	280.371	4.297	20	30		CIEDRN
C=CCNC(=O)N1CCCc2cc(-c3ccccc3)ccc21	ZINC000471368876	331507451	/nfs/dbraw/zinc/50/74/51/331507451.db2.gz	AGWORQBXKZQHPX-UHFFFAOYSA-N	0	0	292.382	4.002	20	30		CIEDRN
C=CCCCCNC(=O)c1cc(F)c(Cl)cc1Cl	ZINC000471693223	331516011	/nfs/dbraw/zinc/51/60/11/331516011.db2.gz	OGBQZLDJDUASDL-UHFFFAOYSA-N	0	0	290.165	4.219	20	30		CIEDRN
C=CCCCCNC(=O)[C@@H](CC)Sc1ccccc1	ZINC000471706734	331517090	/nfs/dbraw/zinc/51/70/90/331517090.db2.gz	RUHYNXSQRLTILT-OAHLLOKOSA-N	0	0	277.433	4.030	20	30		CIEDRN
N#CCCCOc1cccc(N[C@H]2CC[C@H]2C2CCC2)c1	ZINC000510739726	332914521	/nfs/dbraw/zinc/91/45/21/332914521.db2.gz	YDCAHJQARLBHJF-ROUUACIJSA-N	0	0	284.403	4.360	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)N[C@H](C)CC(C)C	ZINC000472124166	331529427	/nfs/dbraw/zinc/52/94/27/331529427.db2.gz	LRHFWBRYAJUKIG-MRXNPFEDSA-N	0	0	288.435	4.209	20	30		CIEDRN
C=CC1CCN(C(=O)[C@@H](C)CC2CCCCC2)CC1	ZINC000510743543	332914772	/nfs/dbraw/zinc/91/47/72/332914772.db2.gz	VYXDXTHGKRSHIM-AWEZNQCLSA-N	0	0	263.425	4.018	20	30		CIEDRN
C=CCCCCNC(=O)Nc1cccc2ccccc21	ZINC000472136867	331529598	/nfs/dbraw/zinc/52/95/98/331529598.db2.gz	QYVGNMXRBDMEID-UHFFFAOYSA-N	0	0	268.360	4.318	20	30		CIEDRN
C=CCCCCNC(=O)N(CC(=C)C)Cc1ccccc1	ZINC000472166695	331530790	/nfs/dbraw/zinc/53/07/90/331530790.db2.gz	AEJZACZQSFABBM-UHFFFAOYSA-N	0	0	286.419	4.131	20	30		CIEDRN
Cc1cc2occ(C(=O)N[C@@](C)(C#N)C(C)(C)C)c2cc1C	ZINC000472375536	331536420	/nfs/dbraw/zinc/53/64/20/331536420.db2.gz	SGUUENWKFIIXMG-SFHVURJKSA-N	0	0	298.386	4.108	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1ccc(OCCCC)cc1Cl	ZINC000472410240	331536785	/nfs/dbraw/zinc/53/67/85/331536785.db2.gz	YHYLWWMBOSPIDU-UHFFFAOYSA-N	0	0	295.810	4.167	20	30		CIEDRN
C=CCCCCNC(=O)N(C)Cc1cccc2ccccc21	ZINC000472841052	331544204	/nfs/dbraw/zinc/54/42/04/331544204.db2.gz	MUGPVJYIOJJYGI-UHFFFAOYSA-N	0	0	296.414	4.338	20	30		CIEDRN
C=CCCCCNC(=O)Nc1ccc(-c2ccc[nH]2)cc1	ZINC000473769526	331556798	/nfs/dbraw/zinc/55/67/98/331556798.db2.gz	DEBZGOYFIWFVGO-UHFFFAOYSA-N	0	0	283.375	4.160	20	30		CIEDRN
C=CCCCCNC(=O)Nc1cccc(SC)c1C	ZINC000473782455	331557517	/nfs/dbraw/zinc/55/75/17/331557517.db2.gz	AHSFUAPWGQZWQJ-UHFFFAOYSA-N	0	0	278.421	4.195	20	30		CIEDRN
CC(C)(C)OCCCCSc1ccccc1C#N	ZINC000473795238	331557936	/nfs/dbraw/zinc/55/79/36/331557936.db2.gz	IGSLEEVQGBGDEG-UHFFFAOYSA-N	0	0	263.406	4.246	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CCC[C@](C)(CCC)C1	ZINC000473895628	331559481	/nfs/dbraw/zinc/55/94/81/331559481.db2.gz	POUVQKUKBPMQSY-JKSUJKDBSA-N	0	0	251.414	4.018	20	30		CIEDRN
CCc1cccc(NC(=O)C[C@@H](CC#N)c2ccccc2)c1	ZINC000474082145	331568757	/nfs/dbraw/zinc/56/87/57/331568757.db2.gz	RTGIOWVGOGFDOD-QGZVFWFLSA-N	0	0	292.382	4.275	20	30		CIEDRN
CC(C)(C)[C@@H]1CCC[C@H](NC(=O)C2(C#N)CCCC2)CC1	ZINC000474287150	331579833	/nfs/dbraw/zinc/57/98/33/331579833.db2.gz	FXBXYWJKESFOIC-CABCVRRESA-N	0	0	290.451	4.182	20	30		CIEDRN
C=CCN(CCc1ccccc1)C(=O)[C@@H](C)CC1CCCC1	ZINC000510817451	332918018	/nfs/dbraw/zinc/91/80/18/332918018.db2.gz	WBZMXNPXKWPPPU-KRWDZBQOSA-N	0	0	299.458	4.460	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cccc(OC(F)(F)F)c2)CC1	ZINC000474571331	331590531	/nfs/dbraw/zinc/59/05/31/331590531.db2.gz	AXABFUZBUJYXNF-UHFFFAOYSA-N	0	0	299.292	4.270	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(C(C)(C)C#N)cc2)CC1	ZINC000474780002	331597785	/nfs/dbraw/zinc/59/77/85/331597785.db2.gz	LTCLFAIPNAAALB-UHFFFAOYSA-N	0	0	282.387	4.173	20	30		CIEDRN
C=CCCC1(C(=O)N[C@@H](C)c2ccc(F)c(Cl)c2)CC1	ZINC000475106036	331615136	/nfs/dbraw/zinc/61/51/36/331615136.db2.gz	GWCGFVAQCUFXCN-NSHDSACASA-N	0	0	295.785	4.403	20	30		CIEDRN
CC1(C)CCCN(Cc2ccc(C(F)F)cc2)[C@H]1C#N	ZINC000475197900	331617725	/nfs/dbraw/zinc/61/77/25/331617725.db2.gz	ZHPBCRZQIDLRLO-AWEZNQCLSA-N	0	0	278.346	4.138	20	30		CIEDRN
C=CCCC1(C(=O)NCCCc2cccc(Cl)c2)CC1	ZINC000475379522	331630214	/nfs/dbraw/zinc/63/02/14/331630214.db2.gz	BDJVIRGAGXXAER-UHFFFAOYSA-N	0	0	291.822	4.135	20	30		CIEDRN
C=CCCC1(C(=O)N(CC)Cc2c(F)cccc2F)CC1	ZINC000475523779	331635522	/nfs/dbraw/zinc/63/55/22/331635522.db2.gz	GHKONDVAHISZBJ-UHFFFAOYSA-N	0	0	293.357	4.060	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)NCCC#CC	ZINC000475544556	331635976	/nfs/dbraw/zinc/63/59/76/331635976.db2.gz	GWGKSHCFUQTCQN-UHFFFAOYSA-N	0	0	284.403	4.073	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)c1ccc(C(F)F)cc1	ZINC000475737942	331643915	/nfs/dbraw/zinc/64/39/15/331643915.db2.gz	HBMQPSAHDJFHPT-UHFFFAOYSA-N	0	0	294.345	4.217	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000475814194	331645532	/nfs/dbraw/zinc/64/55/32/331645532.db2.gz	LONFTSQVSXSLGB-DEWHONNTSA-N	0	0	283.415	4.293	20	30		CIEDRN
C=CCCC1(C(=O)N[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000475900254	331648124	/nfs/dbraw/zinc/64/81/24/331648124.db2.gz	PWXLXGFKTZEYDN-IAGOWNOFSA-N	0	0	283.415	4.185	20	30		CIEDRN
C=CCCC1(C(=O)N2CCC[C@H](C(C)C)CC2)CC1	ZINC000476069056	331652858	/nfs/dbraw/zinc/65/28/58/331652858.db2.gz	CDTHBGMGNMFEAD-HNNXBMFYSA-N	0	0	263.425	4.018	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ncc(C(C)(C)C)s2)CC1	ZINC000476185918	331656705	/nfs/dbraw/zinc/65/67/05/331656705.db2.gz	CELALZYAJMDSNL-UHFFFAOYSA-N	0	0	278.421	4.126	20	30		CIEDRN
C=CCCC1(C(=O)N2CCC[C@](C)(CCC)C2)CC1	ZINC000476196882	331657044	/nfs/dbraw/zinc/65/70/44/331657044.db2.gz	ILLCAAUIYRDTBK-INIZCTEOSA-N	0	0	263.425	4.162	20	30		CIEDRN
CC[C@]1(C)CCCN(C(=O)c2ccc(C(C)(C)C#N)cc2)C1	ZINC000476202782	331657245	/nfs/dbraw/zinc/65/72/45/331657245.db2.gz	SBNKSHATEBVBHC-LJQANCHMSA-N	0	0	298.430	4.140	20	30		CIEDRN
Cc1c(F)cccc1NC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000476198728	331657320	/nfs/dbraw/zinc/65/73/20/331657320.db2.gz	TUODFKOOSBVBHK-UHFFFAOYSA-N	0	0	296.345	4.188	20	30		CIEDRN
CCC1(CNC(=O)c2ccc(C(C)(C)C#N)cc2)CCCC1	ZINC000476336931	331661887	/nfs/dbraw/zinc/66/18/87/331661887.db2.gz	OQHRXQIXHGEOCT-UHFFFAOYSA-N	0	0	298.430	4.188	20	30		CIEDRN
N#Cc1ccccc1NCc1csc(-c2ccsc2)n1	ZINC000476380355	331663146	/nfs/dbraw/zinc/66/31/46/331663146.db2.gz	NBXVBFBUBCYJJX-UHFFFAOYSA-N	0	0	297.408	4.355	20	30		CIEDRN
CC(C)(C#N)CCCSc1nccn1-c1ccccc1	ZINC000476498431	331665353	/nfs/dbraw/zinc/66/53/53/331665353.db2.gz	CZMRYDLPVMYWFA-UHFFFAOYSA-N	0	0	285.416	4.294	20	30		CIEDRN
C=C(C)CN(C)C(=O)Nc1ccc2c(ccn2CC(C)C)c1	ZINC000477510321	331685968	/nfs/dbraw/zinc/68/59/68/331685968.db2.gz	MLUCBBOSSOFDBF-UHFFFAOYSA-N	0	0	299.418	4.337	20	30		CIEDRN
C=C(C)CSCc1ccc(Oc2ccccc2)nn1	ZINC000498388560	331687404	/nfs/dbraw/zinc/68/74/04/331687404.db2.gz	CBXYHIVSJMIJQH-UHFFFAOYSA-N	0	0	272.373	4.078	20	30		CIEDRN
C=CCCC(=O)N(CCC(C)C)c1ccc(OC)cc1	ZINC000477934072	331694904	/nfs/dbraw/zinc/69/49/04/331694904.db2.gz	UBJGHTDNKIFOTJ-UHFFFAOYSA-N	0	0	275.392	4.041	20	30		CIEDRN
C[C@H](CC(=O)Nc1ccc(CC#N)cc1)C1CCCCC1	ZINC000511012010	332924108	/nfs/dbraw/zinc/92/41/08/332924108.db2.gz	JCVOEWXYSKQBGX-CQSZACIVSA-N	0	0	284.403	4.298	20	30		CIEDRN
N#Cc1cccc(NC(=O)c2ccc(C3CCC3)cc2)c1	ZINC000478250542	331701921	/nfs/dbraw/zinc/70/19/21/331701921.db2.gz	JXAKAMZSOTTYCR-UHFFFAOYSA-N	0	0	276.339	4.078	20	30		CIEDRN
C=CCC1(C(=O)NCCc2cccc3ccccc32)CCC1	ZINC000478669406	331711392	/nfs/dbraw/zinc/71/13/92/331711392.db2.gz	BQXJTMSSNCQEMM-UHFFFAOYSA-N	0	0	293.410	4.245	20	30		CIEDRN
CC(C)Oc1ccc(O[C@@H](C)c2ccc(C#N)cc2)cc1	ZINC000478779307	331713642	/nfs/dbraw/zinc/71/36/42/331713642.db2.gz	ISCUSDWEUFRGBD-AWEZNQCLSA-N	0	0	281.355	4.485	20	30		CIEDRN
C=CCOc1ccc(O[C@@H](C)c2cccc(C#N)c2)cc1	ZINC000478784042	331713970	/nfs/dbraw/zinc/71/39/70/331713970.db2.gz	SCJCTDAOSNNQHZ-AWEZNQCLSA-N	0	0	279.339	4.263	20	30		CIEDRN
C=CCC1(C(=O)Nc2cc(Cl)cc(C)c2O)CCC1	ZINC000478859350	331715602	/nfs/dbraw/zinc/71/56/02/331715602.db2.gz	TWLWGXJXWDUFJB-UHFFFAOYSA-N	0	0	279.767	4.039	20	30		CIEDRN
Cn1cc(/C=C\c2ccc3ccc(Cl)cc3n2)cc1C#N	ZINC000478919482	331717125	/nfs/dbraw/zinc/71/71/25/331717125.db2.gz	ATUKMUAHPQBSRA-KXFIGUGUSA-N	0	0	293.757	4.269	20	30		CIEDRN
C=C(C)CN(C)C(=O)CCCSc1ccc(Cl)cc1	ZINC000479245453	331722790	/nfs/dbraw/zinc/72/27/90/331722790.db2.gz	NNHCGHRLXZDJDQ-UHFFFAOYSA-N	0	0	297.851	4.247	20	30		CIEDRN
CC(C)COc1ccccc1NCc1ccc(C#N)c(F)c1	ZINC000479485215	331732772	/nfs/dbraw/zinc/73/27/72/331732772.db2.gz	FFRCIZQAKYNWMY-UHFFFAOYSA-N	0	0	298.361	4.344	20	30		CIEDRN
C=CCCCC(=O)N[C@H](c1ccc(Cl)cc1)C1CC1	ZINC000479498849	331733505	/nfs/dbraw/zinc/73/35/05/331733505.db2.gz	GJONKLDSKKKQFX-INIZCTEOSA-N	0	0	277.795	4.264	20	30		CIEDRN
C=CCCCC(=O)N(C)[C@H](C)c1ccc(C)cc1C	ZINC000479525831	331735006	/nfs/dbraw/zinc/73/50/06/331735006.db2.gz	MHFKZEOPBHJQAV-OAHLLOKOSA-N	0	0	259.393	4.179	20	30		CIEDRN
C=CCCCC(=O)NCc1cc(C)cc2c(C)c(C)[nH]c21	ZINC000479553403	331737178	/nfs/dbraw/zinc/73/71/78/331737178.db2.gz	JQDAGPXFYGJACZ-UHFFFAOYSA-N	0	0	284.403	4.066	20	30		CIEDRN
C=CCOCCCS[C@@H](C)c1ncc(C(C)(C)C)o1	ZINC000479603406	331740269	/nfs/dbraw/zinc/74/02/69/331740269.db2.gz	CYMIYHNWIHJVEZ-LBPRGKRZSA-N	0	0	283.437	4.359	20	30		CIEDRN
C=CCOCCCS[C@@H](C)c1ccc(F)cc1F	ZINC000479602269	331740282	/nfs/dbraw/zinc/74/02/82/331740282.db2.gz	ITZSWWUOOPPYEE-NSHDSACASA-N	0	0	272.360	4.352	20	30		CIEDRN
C=CCOCCCSCc1ncc(-c2cccs2)o1	ZINC000479607876	331740578	/nfs/dbraw/zinc/74/05/78/331740578.db2.gz	UGPCPJRSPPDBSK-UHFFFAOYSA-N	0	0	295.429	4.229	20	30		CIEDRN
C=CCCCC(=O)N(Cc1ccccc1)CC1CCC1	ZINC000479624482	331741418	/nfs/dbraw/zinc/74/14/18/331741418.db2.gz	TZXRRKMNAOLRKG-UHFFFAOYSA-N	0	0	271.404	4.172	20	30		CIEDRN
C=CCC1(C(=O)N(C)c2cc(C)cc(C)c2)CCC1	ZINC000479639235	331741831	/nfs/dbraw/zinc/74/18/31/331741831.db2.gz	KYXJMTDTQNQEPZ-UHFFFAOYSA-N	0	0	257.377	4.013	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H]2CCc3c2cccc3Cl)CCC1	ZINC000479663859	331742445	/nfs/dbraw/zinc/74/24/45/331742445.db2.gz	SWQWDZGFACLUFX-OAHLLOKOSA-N	0	0	289.806	4.190	20	30		CIEDRN
Cc1cccc2nc(Oc3ccccc3C#N)sc21	ZINC000479848509	331747873	/nfs/dbraw/zinc/74/78/73/331747873.db2.gz	GGRMKRSTIMSMNO-UHFFFAOYSA-N	0	0	266.325	4.269	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)NCc1cc2ccccc2s1	ZINC000480014968	331754544	/nfs/dbraw/zinc/75/45/44/331754544.db2.gz	BXZJRTCIACGFDT-CYBMUJFWSA-N	0	0	288.416	4.055	20	30		CIEDRN
C=CCC1(C(=O)N[C@H]2CCC[C@@H](C(C)C)C2)CCC1	ZINC000480176033	331761579	/nfs/dbraw/zinc/76/15/79/331761579.db2.gz	DRYWAOZVXKCWBO-CABCVRRESA-N	0	0	263.425	4.064	20	30		CIEDRN
C=CCC1(C(=O)NCCC2=CCCCCC2)CCC1	ZINC000480452096	331773286	/nfs/dbraw/zinc/77/32/86/331773286.db2.gz	YPVXVMURCFZXNB-UHFFFAOYSA-N	0	0	261.409	4.130	20	30		CIEDRN
C=CCOc1ccccc1CNc1cnn([C@@H](C)CC)c1C	ZINC000480469727	331773712	/nfs/dbraw/zinc/77/37/12/331773712.db2.gz	LDZCVTDHXWFTDX-AWEZNQCLSA-N	0	0	299.418	4.339	20	30		CIEDRN
CCCCn1ncc(NCc2ccc(C#N)cc2)c1C(C)C	ZINC000480483346	331774230	/nfs/dbraw/zinc/77/42/30/331774230.db2.gz	PLCLUHSPRHXGFG-UHFFFAOYSA-N	0	0	296.418	4.290	20	30		CIEDRN
C=CCC1(C(=O)N2CCc3c(cccc3C(C)C)C2)CCC1	ZINC000480525482	331775968	/nfs/dbraw/zinc/77/59/68/331775968.db2.gz	KYQIVKJFQWIZRY-UHFFFAOYSA-N	0	0	297.442	4.441	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H]1C[C@H](c2ccc(Cl)cc2)C1	ZINC000511095044	332926584	/nfs/dbraw/zinc/92/65/84/332926584.db2.gz	ZTTICEWCYSMTGN-CTYIDZIISA-N	0	0	291.822	4.305	20	30		CIEDRN
CCC[C@H](CC)Sc1ccc([N+](=O)[O-])cc1C#N	ZINC000480843489	331789767	/nfs/dbraw/zinc/78/97/67/331789767.db2.gz	MSYDTYANCXJEIW-LBPRGKRZSA-N	0	0	264.350	4.137	20	30		CIEDRN
CCC[C@@H](CC)Sc1ccc(Cl)c(C#N)n1	ZINC000480850288	331789775	/nfs/dbraw/zinc/78/97/75/331789775.db2.gz	CPGORLMHMYEWBH-SECBINFHSA-N	0	0	254.786	4.277	20	30		CIEDRN
C=CCCCC(=O)NC(C)(c1ccccc1)c1ccccc1	ZINC000480885957	331790366	/nfs/dbraw/zinc/79/03/66/331790366.db2.gz	PXDLOORCLVYLOS-UHFFFAOYSA-N	0	0	293.410	4.423	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)[C@@H]1CCC(F)(F)C1	ZINC000481134299	331798862	/nfs/dbraw/zinc/79/88/62/331798862.db2.gz	BPLCPUOSNGDURB-OAHLLOKOSA-N	0	0	293.357	4.027	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(F)c(C(F)(F)F)c1	ZINC000481165792	331799440	/nfs/dbraw/zinc/79/94/40/331799440.db2.gz	ALJNGPUBMUMKKA-UHFFFAOYSA-N	0	0	275.245	4.139	20	30		CIEDRN
C=CCN(C(=O)Nc1ccc2oc(C)c(C)c2c1)C1CC1	ZINC000481668602	331811550	/nfs/dbraw/zinc/81/15/50/331811550.db2.gz	MMCLUVVEJNCXOO-UHFFFAOYSA-N	0	0	284.359	4.232	20	30		CIEDRN
COc1cccc(N[C@@H]2CCCCc3cc(C#N)ccc32)c1	ZINC000481678708	331811711	/nfs/dbraw/zinc/81/17/11/331811711.db2.gz	RBHFKORNDPRRIB-LJQANCHMSA-N	0	0	292.382	4.446	20	30		CIEDRN
CCc1ccc(-c2noc(-c3cccc(C#N)c3C)n2)cc1	ZINC000511241549	332929855	/nfs/dbraw/zinc/92/98/55/332929855.db2.gz	PDQBHZIFOJZERP-UHFFFAOYSA-N	0	0	289.338	4.146	20	30		CIEDRN
C=CCCC(=O)Nc1cnn(-c2ccc(C)cc2)c1C(C)C	ZINC000481875353	331817471	/nfs/dbraw/zinc/81/74/71/331817471.db2.gz	OQYHWKMCSVIMQR-UHFFFAOYSA-N	0	0	297.402	4.209	20	30		CIEDRN
N#Cc1cc(Cl)ccc1NCc1cc(F)cc(F)c1	ZINC000511394243	332931449	/nfs/dbraw/zinc/93/14/49/332931449.db2.gz	NOBWQPSNZMZGFN-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cc(C)c(Cl)cc2OC)CC1	ZINC000483051894	331856529	/nfs/dbraw/zinc/85/65/29/331856529.db2.gz	RYEPIAOQTCBKGY-UHFFFAOYSA-N	0	0	293.794	4.342	20	30		CIEDRN
CCCC1CCC(N(C)C(=O)c2ccc(C#N)s2)CC1	ZINC000483073654	331857106	/nfs/dbraw/zinc/85/71/06/331857106.db2.gz	MJKXMOCUYMHSEE-UHFFFAOYSA-N	0	0	290.432	4.051	20	30		CIEDRN
CC[C@H]1CCCC[C@H]1C(=O)N(CC)c1ccc(C#N)cc1	ZINC000483637970	331880177	/nfs/dbraw/zinc/88/01/77/331880177.db2.gz	IMPLNIIUQHYWKR-DOTOQJQBSA-N	0	0	284.403	4.128	20	30		CIEDRN
CC[C@@H]1CCCC[C@@H]1C(=O)N(CC)c1ccc(C#N)cc1	ZINC000483637973	331880379	/nfs/dbraw/zinc/88/03/79/331880379.db2.gz	IMPLNIIUQHYWKR-WBVHZDCISA-N	0	0	284.403	4.128	20	30		CIEDRN
Cc1sc(NC(=O)[C@H](C)CC(C)(C)C)c(C#N)c1C	ZINC000483907677	331888793	/nfs/dbraw/zinc/88/87/93/331888793.db2.gz	DMIHVXWFFYCENU-SECBINFHSA-N	0	0	278.421	4.247	20	30		CIEDRN
CCc1c(C)sc(NC(=O)[C@H]2CCCC2(C)C)c1C#N	ZINC000483997179	331891248	/nfs/dbraw/zinc/89/12/48/331891248.db2.gz	YADHRRJBIOZSBJ-CYBMUJFWSA-N	0	0	290.432	4.255	20	30		CIEDRN
C=CCN(C(=O)[C@H]1CCCC1(C)C)c1ccccc1	ZINC000484094353	331892536	/nfs/dbraw/zinc/89/25/36/331892536.db2.gz	GBIKJGWECUOPBN-OAHLLOKOSA-N	0	0	257.377	4.032	20	30		CIEDRN
C=CCN(C(=O)c1ccc2c(c1)CCC2)c1ccccc1	ZINC000484235028	331894704	/nfs/dbraw/zinc/89/47/04/331894704.db2.gz	QYLZSAJPCUWZGO-UHFFFAOYSA-N	0	0	277.367	4.008	20	30		CIEDRN
C=CCN(C(=O)CC1CCCCC1)c1ccccc1	ZINC000484286611	331895428	/nfs/dbraw/zinc/89/54/28/331895428.db2.gz	TZXULXGOYDQLKH-UHFFFAOYSA-N	0	0	257.377	4.176	20	30		CIEDRN
C[C@@H](CC(C)(C)C)C(=O)N(C)c1cc(Cl)ccc1C#N	ZINC000484319766	331896942	/nfs/dbraw/zinc/89/69/42/331896942.db2.gz	BLHGBTKXERHVOV-NSHDSACASA-N	0	0	292.810	4.247	20	30		CIEDRN
CC1(C)CC[C@H](CSc2ccc(C#N)cc2Cl)O1	ZINC000484505689	331900919	/nfs/dbraw/zinc/90/09/19/331900919.db2.gz	QDCFCTDRVAXMIT-LLVKDONJSA-N	0	0	281.808	4.261	20	30		CIEDRN
CC(C)c1ccc([C@H](C)CC(=O)N[C@]2(C#N)CC2(C)C)cc1	ZINC000484916891	331907387	/nfs/dbraw/zinc/90/73/87/331907387.db2.gz	GIVBLVWAUJCNES-KUHUBIRLSA-N	0	0	298.430	4.112	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N(CC)CC(C)(C)C	ZINC000485455901	331914574	/nfs/dbraw/zinc/91/45/74/331914574.db2.gz	QDKXBODCCKORFC-UHFFFAOYSA-N	0	0	291.460	4.473	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N1CC[C@](C)(CC)C1	ZINC000485464533	331914975	/nfs/dbraw/zinc/91/49/75/331914975.db2.gz	LFPODWHBPSLIRZ-KRWDZBQOSA-N	0	0	289.444	4.227	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@H](C)Cc1ccc(C)cc1	ZINC000485542909	331916269	/nfs/dbraw/zinc/91/62/69/331916269.db2.gz	KYAGGFGOZRWMEA-CVEARBPZSA-N	0	0	273.420	4.035	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1ccc(F)c(Cl)c1	ZINC000485566659	331916950	/nfs/dbraw/zinc/91/69/50/331916950.db2.gz	GATLYTFNVXUCMZ-NSHDSACASA-N	0	0	282.746	4.052	20	30		CIEDRN
C=CCCCCCSCc1nncn1-c1ccccc1	ZINC000485582900	331917936	/nfs/dbraw/zinc/91/79/36/331917936.db2.gz	UURUAHNKFZTNNZ-UHFFFAOYSA-N	0	0	287.432	4.247	20	30		CIEDRN
C=CCCCCCSCC(=O)Nc1ccc(OC)cc1	ZINC000485596468	331918301	/nfs/dbraw/zinc/91/83/01/331918301.db2.gz	GLYJDAOMZUWBCN-UHFFFAOYSA-N	0	0	293.432	4.113	20	30		CIEDRN
CC(C)(C)CN(C(=O)CC(C)(C)C#N)c1ccccc1	ZINC000485755011	331923243	/nfs/dbraw/zinc/92/32/43/331923243.db2.gz	XMRMOOGTYYZRCI-UHFFFAOYSA-N	0	0	272.392	4.006	20	30		CIEDRN
Cc1cc(C)cc(/C=C/c2nc3ccccc3n2CC#N)c1	ZINC000485976964	331928182	/nfs/dbraw/zinc/92/81/82/331928182.db2.gz	LOGIGOKLTSDGRK-BQYQJAHWSA-N	0	0	287.366	4.347	20	30		CIEDRN
N#Cc1cccnc1/C=C/c1cccc(C(F)(F)F)c1	ZINC000486051224	331930100	/nfs/dbraw/zinc/93/01/00/331930100.db2.gz	JOXAOCQCBJXGPU-VOTSOKGWSA-N	0	0	274.245	4.142	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N[C@@H](CC)CCC	ZINC000486064155	331930509	/nfs/dbraw/zinc/93/05/09/331930509.db2.gz	QBDFREIBLKHNGK-ZDUSSCGKSA-N	0	0	277.433	4.273	20	30		CIEDRN
CCC[C@@H]1CCc2ccccc2N1C(=O)CC(C)(C)C#N	ZINC000486276662	331934152	/nfs/dbraw/zinc/93/41/52/331934152.db2.gz	ARGRUYRNRMCVRA-OAHLLOKOSA-N	0	0	284.403	4.074	20	30		CIEDRN
CCCCC[C@@H]1CCCN1C(=O)Nc1ccc(C#N)cc1	ZINC000486778708	331944761	/nfs/dbraw/zinc/94/47/61/331944761.db2.gz	RZHNGTZJIJHOMR-MRXNPFEDSA-N	0	0	285.391	4.135	20	30		CIEDRN
N#Cc1ccncc1N[C@@H]1CCC[C@@H](c2ccccc2)C1	ZINC000487116757	331956836	/nfs/dbraw/zinc/95/68/36/331956836.db2.gz	OKHGTIQKPDHLFG-NVXWUHKLSA-N	0	0	277.371	4.092	20	30		CIEDRN
N#Cc1ccc(N[C@@H]2CCC[C@@H](c3ccccc3)C2)cn1	ZINC000487136787	331957020	/nfs/dbraw/zinc/95/70/20/331957020.db2.gz	KPPVSSGBSYVTBB-HZPDHXFCSA-N	0	0	277.371	4.092	20	30		CIEDRN
N#Cc1ccc(CNc2ccc(C3CCC3)cc2)cc1	ZINC000487180933	331958514	/nfs/dbraw/zinc/95/85/14/331958514.db2.gz	JZXOCMFEHTYVER-UHFFFAOYSA-N	0	0	262.356	4.438	20	30		CIEDRN
C=C1CCN(C(=O)[C@H](c2cccc(Cl)c2)C(C)C)CC1	ZINC000487333983	331966740	/nfs/dbraw/zinc/96/67/40/331966740.db2.gz	LDAKHVFBWSEVES-INIZCTEOSA-N	0	0	291.822	4.258	20	30		CIEDRN
CC(C)(C#N)c1ccccc1CN1CCc2ccccc21	ZINC000487363407	331967688	/nfs/dbraw/zinc/96/76/88/331967688.db2.gz	JSBHBNAABFNQNF-UHFFFAOYSA-N	0	0	276.383	4.050	20	30		CIEDRN
C=CCCCCNC(=O)Nc1cc(C)c(F)cc1Cl	ZINC000487432778	331970258	/nfs/dbraw/zinc/97/02/58/331970258.db2.gz	WRKVVHZZHSMYRL-UHFFFAOYSA-N	0	0	284.762	4.265	20	30		CIEDRN
C=CC[C@@H](C(=O)N(C)Cc1cccs1)c1ccccc1	ZINC000487548429	331973400	/nfs/dbraw/zinc/97/34/00/331973400.db2.gz	BZFPRSUUWZMXCL-MRXNPFEDSA-N	0	0	285.412	4.066	20	30		CIEDRN
C=CCC[C@H](C(=O)N(C)[C@H](C)C(C)C)c1ccccc1	ZINC000487691007	331978836	/nfs/dbraw/zinc/97/88/36/331978836.db2.gz	QTRCOUJUAMHIND-WBVHZDCISA-N	0	0	273.420	4.239	20	30		CIEDRN
C=CCC[C@@H](C(=O)N(CC)CC(=C)C)c1ccccc1	ZINC000487802464	331981632	/nfs/dbraw/zinc/98/16/32/331981632.db2.gz	PCZADFJONNZPFM-QGZVFWFLSA-N	0	0	271.404	4.161	20	30		CIEDRN
C=C(C)CN(C)C(=O)NCc1ccc(C(C)(C)CC)cc1	ZINC000487822901	331982034	/nfs/dbraw/zinc/98/20/34/331982034.db2.gz	XMJCQEDCVDKCOM-UHFFFAOYSA-N	0	0	288.435	4.092	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1cccc(OCCC)c1	ZINC000487911171	331983948	/nfs/dbraw/zinc/98/39/48/331983948.db2.gz	NXKCNLDHSRGAHX-HNNXBMFYSA-N	0	0	288.391	4.048	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1cccc(OCCC)c1	ZINC000487911172	331983960	/nfs/dbraw/zinc/98/39/60/331983960.db2.gz	NXKCNLDHSRGAHX-OAHLLOKOSA-N	0	0	288.391	4.048	20	30		CIEDRN
N#Cc1cccc(C(=O)N2CCC[C@@H]2CCC2CCCC2)c1	ZINC000488259169	331996343	/nfs/dbraw/zinc/99/63/43/331996343.db2.gz	FTUMGWMOBMEGGQ-GOSISDBHSA-N	0	0	296.414	4.133	20	30		CIEDRN
C=CCCC(=O)N1CCC[C@H]1CCC1CCCCC1	ZINC000488313991	331998964	/nfs/dbraw/zinc/99/89/64/331998964.db2.gz	NUGJHYVGNINDRU-INIZCTEOSA-N	0	0	263.425	4.304	20	30		CIEDRN
CC(C)COc1cccc(CNc2ccccc2C#N)c1	ZINC000511727590	332940832	/nfs/dbraw/zinc/94/08/32/332940832.db2.gz	QTYYDHJODSYPJI-UHFFFAOYSA-N	0	0	280.371	4.205	20	30		CIEDRN
CCC[C@H](CC)Nc1c(C#N)cnc2c(F)cc(F)cc21	ZINC000488326028	331999841	/nfs/dbraw/zinc/99/98/41/331999841.db2.gz	KLPIVAYLTWLDDH-LBPRGKRZSA-N	0	0	289.329	4.375	20	30		CIEDRN
C=CCn1cccc1C(=O)N(C)[C@H](C)c1cc(C)ccc1C	ZINC000488384872	332003364	/nfs/dbraw/zinc/00/33/64/332003364.db2.gz	BIEWGXVMMWBBHT-MRXNPFEDSA-N	0	0	296.414	4.124	20	30		CIEDRN
C=CCC[C@H](C(=O)N(C)CC(C)(C)C)c1ccccc1	ZINC000488396638	332003760	/nfs/dbraw/zinc/00/37/60/332003760.db2.gz	XYZMWYMOLDDAFC-INIZCTEOSA-N	0	0	273.420	4.241	20	30		CIEDRN
C[C@@H](Nc1ccc2scnc2c1)c1ccc(C#N)cc1F	ZINC000488470485	332012262	/nfs/dbraw/zinc/01/22/62/332012262.db2.gz	BMLMBDIJNOHLNJ-SNVBAGLBSA-N	0	0	297.358	4.480	20	30		CIEDRN
N#Cc1cccc(C#N)c1NC[C@H]1CCCCC(F)(F)C1	ZINC000488470281	332012360	/nfs/dbraw/zinc/01/23/60/332012360.db2.gz	VEBLOKPNRBEEIN-LBPRGKRZSA-N	0	0	289.329	4.057	20	30		CIEDRN
N#Cc1ccc(NCc2ccc(C3CC3)cc2F)cc1	ZINC000488501937	332014095	/nfs/dbraw/zinc/01/40/95/332014095.db2.gz	HJKYCLHOZZYTLV-UHFFFAOYSA-N	0	0	266.319	4.187	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1cccc(SC)c1C	ZINC000488560454	332017611	/nfs/dbraw/zinc/01/76/11/332017611.db2.gz	KIXVQKGZORZWSG-ZDUSSCGKSA-N	0	0	290.432	4.289	20	30		CIEDRN
N#Cc1cc(F)ccc1CSCc1ccccc1F	ZINC000488572680	332018274	/nfs/dbraw/zinc/01/82/74/332018274.db2.gz	XOEFTBQEDSWWTK-UHFFFAOYSA-N	0	0	275.323	4.270	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1ccc(C2CC2)c(C)c1	ZINC000488597350	332019946	/nfs/dbraw/zinc/01/99/46/332019946.db2.gz	DVBJCPJWTYNESD-MRXNPFEDSA-N	0	0	284.403	4.445	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1c(C)cccc1Cl	ZINC000488621838	332020424	/nfs/dbraw/zinc/02/04/24/332020424.db2.gz	KRJPKUYVMJITEV-LBPRGKRZSA-N	0	0	278.783	4.221	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1c(C)cccc1SC	ZINC000488656966	332021093	/nfs/dbraw/zinc/02/10/93/332021093.db2.gz	LSVKIODLBVJKRH-CYBMUJFWSA-N	0	0	290.432	4.289	20	30		CIEDRN
C=CCC[C@H](C(=O)N[C@@H](C)[C@@H](C)CC)c1ccccc1	ZINC000488688578	332021686	/nfs/dbraw/zinc/02/16/86/332021686.db2.gz	IOIUQUAYGBKGHM-ZOBUZTSGSA-N	0	0	273.420	4.287	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@H](C)c1cc(C)oc1C)c1ccccc1	ZINC000488707351	332022143	/nfs/dbraw/zinc/02/21/43/332022143.db2.gz	WWHAKZGFPIUCBK-PBHICJAKSA-N	0	0	297.398	4.434	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@@H](C)c1cc(C)oc1C)c1ccccc1	ZINC000488707361	332022195	/nfs/dbraw/zinc/02/21/95/332022195.db2.gz	WWHAKZGFPIUCBK-YOEHRIQHSA-N	0	0	297.398	4.434	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000488714875	332022299	/nfs/dbraw/zinc/02/22/99/332022299.db2.gz	VKJPTCUXXYKNDO-AWEZNQCLSA-N	0	0	294.345	4.371	20	30		CIEDRN
C=CCC[C@@H](C(=O)NC[C@@H]1CC=CCC1)c1ccccc1	ZINC000488719631	332022625	/nfs/dbraw/zinc/02/26/25/332022625.db2.gz	XISPQVZOZVDJJY-SJLPKXTDSA-N	0	0	283.415	4.209	20	30		CIEDRN
N#Cc1ncccc1N[C@H]1CCCc2sc(Cl)cc21	ZINC000488744314	332023710	/nfs/dbraw/zinc/02/37/10/332023710.db2.gz	BQOCOBDTKUMAMW-JTQLQIEISA-N	0	0	289.791	4.158	20	30		CIEDRN
Cc1cc(Cl)c(C(=O)N(C)c2ccccc2C#N)cc1C	ZINC000511627984	332937552	/nfs/dbraw/zinc/93/75/52/332937552.db2.gz	MBMSJDXLUDSMAK-UHFFFAOYSA-N	0	0	298.773	4.105	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)C[C@@H]1CCCC(C)(C)C1	ZINC000488812973	332026772	/nfs/dbraw/zinc/02/67/72/332026772.db2.gz	GDLMYHWHPVGLDR-LSDHHAIUSA-N	0	0	263.425	4.160	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)CC1CCC(C)(C)CC1	ZINC000488817971	332027270	/nfs/dbraw/zinc/02/72/70/332027270.db2.gz	PVKLBLTWGFKIKN-OAHLLOKOSA-N	0	0	263.425	4.160	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1cc(C)c(C)cc1Cl	ZINC000488819407	332027271	/nfs/dbraw/zinc/02/72/71/332027271.db2.gz	SGNJQMACHASYDC-CYBMUJFWSA-N	0	0	277.795	4.138	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Cc1ccc(Cl)c(Cl)c1	ZINC000488825172	332027634	/nfs/dbraw/zinc/02/76/34/332027634.db2.gz	NWHNVZNOBBULLC-GFCCVEGCSA-N	0	0	298.213	4.103	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1ccc(SC(C)C)cc1	ZINC000488834205	332028211	/nfs/dbraw/zinc/02/82/11/332028211.db2.gz	GCUVSBJVFLSGPV-HNNXBMFYSA-N	0	0	289.444	4.368	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Cc1ccc(Cl)cc1Cl	ZINC000488836789	332028357	/nfs/dbraw/zinc/02/83/57/332028357.db2.gz	BEWVFKMJWRMNCI-CYBMUJFWSA-N	0	0	298.213	4.103	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1ccc(Cl)cc1Cl	ZINC000488840143	332028656	/nfs/dbraw/zinc/02/86/56/332028656.db2.gz	NPGNGPRQTDTXPM-LLVKDONJSA-N	0	0	284.186	4.174	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Cc1csc2ccccc12	ZINC000488841227	332028680	/nfs/dbraw/zinc/02/86/80/332028680.db2.gz	QZPHNHZHGDFRSS-AWEZNQCLSA-N	0	0	285.412	4.011	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1cc(Cl)sc1Cl	ZINC000488850235	332029378	/nfs/dbraw/zinc/02/93/78/332029378.db2.gz	GYJABDRXBZWDMM-QMMMGPOBSA-N	0	0	290.215	4.236	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)C[C@H](CC)CCCC	ZINC000488886491	332029501	/nfs/dbraw/zinc/02/95/01/332029501.db2.gz	VEJICMJSTNRTCQ-HUUCEWRRSA-N	0	0	251.414	4.160	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1ccc(-c2ccc(F)cc2)o1	ZINC000488855376	332029648	/nfs/dbraw/zinc/02/96/48/332029648.db2.gz	OLUVQZIKHHKFQE-HNNXBMFYSA-N	0	0	299.345	4.266	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)C[C@@H](CC)c1ccccc1	ZINC000488862093	332030133	/nfs/dbraw/zinc/03/01/33/332030133.db2.gz	HEXLEKDZQJSFJM-WBVHZDCISA-N	0	0	271.404	4.137	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)CCc1ccc2ccccc2c1	ZINC000488868824	332030297	/nfs/dbraw/zinc/03/02/97/332030297.db2.gz	PCHDABONCDADAR-LJQANCHMSA-N	0	0	293.410	4.340	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)CCCCCc1cccs1	ZINC000488867963	332030332	/nfs/dbraw/zinc/03/03/32/332030332.db2.gz	NYAMIXNDYWKLQJ-OAHLLOKOSA-N	0	0	291.460	4.418	20	30		CIEDRN
C=C1CCN(C(=O)C[C@@H]2C[C@@H](C)c3c2cccc3C)CC1	ZINC000488870048	332030506	/nfs/dbraw/zinc/03/05/06/332030506.db2.gz	BQKBKYKAUAOGOJ-CVEARBPZSA-N	0	0	283.415	4.155	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)[C@H](C)Sc1ccc(C)cc1	ZINC000488872418	332030752	/nfs/dbraw/zinc/03/07/52/332030752.db2.gz	AFEYSLKJQWYXTD-GJZGRUSLSA-N	0	0	289.444	4.043	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@@H](C)c1cc2ccccc2o1	ZINC000488877874	332031340	/nfs/dbraw/zinc/03/13/40/332031340.db2.gz	JDIFWIFXJLOGQG-DZGCQCFKSA-N	0	0	283.371	4.103	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)[C@@H](C)Cc1ccccc1Cl	ZINC000488879924	332031636	/nfs/dbraw/zinc/03/16/36/332031636.db2.gz	POWQFSHQTPHBEX-ZFWWWQNUSA-N	0	0	291.822	4.086	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1ccc(C(C)C)s1	ZINC000488882645	332031809	/nfs/dbraw/zinc/03/18/09/332031809.db2.gz	QNBUITZJDGVDSC-GFCCVEGCSA-N	0	0	263.406	4.052	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)CC/C=C\c1ccccc1	ZINC000488883873	332032071	/nfs/dbraw/zinc/03/20/71/332032071.db2.gz	XPBPOWSUAIZBAQ-HMPQKADESA-N	0	0	269.388	4.047	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@H](C)C[C@@H](C)CC)c1ccccc1	ZINC000488982010	332036432	/nfs/dbraw/zinc/03/64/32/332036432.db2.gz	NGNUFQHTAVYNDC-UXLLHSPISA-N	0	0	273.420	4.287	20	30		CIEDRN
C=CCn1cccc1C(=O)N(CC)[C@H](CC)c1ccccc1	ZINC000488985615	332036676	/nfs/dbraw/zinc/03/66/76/332036676.db2.gz	RGZJZYHQRKGITH-QGZVFWFLSA-N	0	0	296.414	4.288	20	30		CIEDRN
CCCCC[C@H]1CCCN1C(=O)CCc1ccc(C#N)cc1	ZINC000489290870	332045398	/nfs/dbraw/zinc/04/53/98/332045398.db2.gz	BXBJDIPCRLXTBD-SFHVURJKSA-N	0	0	298.430	4.062	20	30		CIEDRN
C=CCn1c(SCCCC)nnc1-c1cccs1	ZINC000489420738	332051311	/nfs/dbraw/zinc/05/13/11/332051311.db2.gz	BUBGURCCTCAVJC-UHFFFAOYSA-N	0	0	279.434	4.085	20	30		CIEDRN
C=C[C@@H]1CCCCN1Cc1sc(C)nc1C(F)(F)F	ZINC000489440986	332052817	/nfs/dbraw/zinc/05/28/17/332052817.db2.gz	UCMFVNKSURJWQI-SNVBAGLBSA-N	0	0	290.354	4.011	20	30		CIEDRN
C=C[C@@H]1CCCCN1Cc1csc(CCCC)n1	ZINC000489490447	332056011	/nfs/dbraw/zinc/05/60/11/332056011.db2.gz	NTGLPPRWNQYJOQ-CQSZACIVSA-N	0	0	264.438	4.026	20	30		CIEDRN
C=C[C@@H]1CCCCN1Cc1coc(-c2cccc(F)c2)n1	ZINC000489491727	332056017	/nfs/dbraw/zinc/05/60/17/332056017.db2.gz	CNWGMQCQDWSDTG-MRXNPFEDSA-N	0	0	286.350	4.021	20	30		CIEDRN
C=C[C@H]1CCCCN1Cc1nc(-c2ccccc2)oc1C	ZINC000489492138	332056302	/nfs/dbraw/zinc/05/63/02/332056302.db2.gz	YRDXNTKRJHXVIP-INIZCTEOSA-N	0	0	282.387	4.191	20	30		CIEDRN
C=C[C@@H]1CCCCN1Cc1nc(-c2ccccc2)cs1	ZINC000489495967	332056764	/nfs/dbraw/zinc/05/67/64/332056764.db2.gz	KCEDFMKRLUKOMT-OAHLLOKOSA-N	0	0	284.428	4.351	20	30		CIEDRN
C=C[C@H]1CCCCN1Cc1ccc(Br)s1	ZINC000489499404	332056977	/nfs/dbraw/zinc/05/69/77/332056977.db2.gz	QQBRNRDPYUDBJG-JTQLQIEISA-N	0	0	286.238	4.051	20	30		CIEDRN
N#Cc1cc(F)ccc1CN(Cc1ccc(F)cc1)C1CC1	ZINC000489545349	332058804	/nfs/dbraw/zinc/05/88/04/332058804.db2.gz	FGEGWOWYRXEONU-UHFFFAOYSA-N	0	0	298.336	4.001	20	30		CIEDRN
N#Cc1cc(F)ccc1CN1CCC[C@@H]1c1cccc(F)c1	ZINC000489599967	332060857	/nfs/dbraw/zinc/06/08/57/332060857.db2.gz	VXWRNAGGCZXNAX-GOSISDBHSA-N	0	0	298.336	4.174	20	30		CIEDRN
C=CC[C@H](C(=O)NCCc1sccc1C)c1ccccc1	ZINC000489608922	332061255	/nfs/dbraw/zinc/06/12/55/332061255.db2.gz	IYCFICJNIVWMTC-INIZCTEOSA-N	0	0	299.439	4.075	20	30		CIEDRN
C=CC[C@@H](C(=O)NCCc1sccc1C)c1ccccc1	ZINC000489608923	332061298	/nfs/dbraw/zinc/06/12/98/332061298.db2.gz	IYCFICJNIVWMTC-MRXNPFEDSA-N	0	0	299.439	4.075	20	30		CIEDRN
C=CCCC1(C(=O)NCc2cc3ccccc3s2)CC1	ZINC000489620856	332061909	/nfs/dbraw/zinc/06/19/09/332061909.db2.gz	KJQLWMHLAHTKTN-UHFFFAOYSA-N	0	0	285.412	4.264	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@H]1CCC(C)(C)C1)c1ccccc1	ZINC000489632896	332062400	/nfs/dbraw/zinc/06/24/00/332062400.db2.gz	WTYCYQKBWOFSBU-JKSUJKDBSA-N	0	0	271.404	4.041	20	30		CIEDRN
CCN(Cc1ccccc1C)Cc1ccc(F)cc1C#N	ZINC000489651041	332063152	/nfs/dbraw/zinc/06/31/52/332063152.db2.gz	SDZZXRVPHNFXNS-UHFFFAOYSA-N	0	0	282.362	4.028	20	30		CIEDRN
C=CC[C@H](C(=O)N1Cc2ccccc2[C@H]1C)c1ccccc1	ZINC000489683283	332064601	/nfs/dbraw/zinc/06/46/01/332064601.db2.gz	QQGKCPCXLRUIPB-BEFAXECRSA-N	0	0	291.394	4.450	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1cc(C)cc(OC)c1C	ZINC000489691339	332065044	/nfs/dbraw/zinc/06/50/44/332065044.db2.gz	OGYMGXPCLQCKKP-CYBMUJFWSA-N	0	0	290.407	4.178	20	30		CIEDRN
C=CC[C@@H](C(=O)N(CC)C[C@@H](C)CC)c1ccccc1	ZINC000489695860	332065252	/nfs/dbraw/zinc/06/52/52/332065252.db2.gz	FAWYOIKICJLUJX-DOTOQJQBSA-N	0	0	273.420	4.241	20	30		CIEDRN
C=CCC[C@H](NC(=O)NCc1occc1C)c1ccccc1	ZINC000489760426	332067090	/nfs/dbraw/zinc/06/70/90/332067090.db2.gz	JIPZWPRQXLXIHM-INIZCTEOSA-N	0	0	298.386	4.095	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)CC[C@@H](C)c1ccccc1	ZINC000489825792	332069293	/nfs/dbraw/zinc/06/92/93/332069293.db2.gz	GXNLWYPHJVTUBR-OAHLLOKOSA-N	0	0	273.420	4.289	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)C[C@H](C)c1ccccc1F	ZINC000489912442	332072673	/nfs/dbraw/zinc/07/26/73/332072673.db2.gz	VSVVUDSTHDSVPO-ZDUSSCGKSA-N	0	0	277.383	4.038	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@H](C)CSc1ccccc1	ZINC000489942457	332073528	/nfs/dbraw/zinc/07/35/28/332073528.db2.gz	PCZIULZEOHAORA-CQSZACIVSA-N	0	0	291.460	4.133	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@@H](C)c1cc2ccccc2o1	ZINC000489954745	332074269	/nfs/dbraw/zinc/07/42/69/332074269.db2.gz	HMIIQUAOCZKVSM-ZDUSSCGKSA-N	0	0	285.387	4.255	20	30		CIEDRN
Cc1cccc2c(Sc3ccc(C#N)cc3F)ncnc12	ZINC000489972992	332075189	/nfs/dbraw/zinc/07/51/89/332075189.db2.gz	PLEMXOJDJDLQMR-UHFFFAOYSA-N	0	0	295.342	4.100	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1cccc(-c2ccoc2)c1	ZINC000490007693	332076241	/nfs/dbraw/zinc/07/62/41/332076241.db2.gz	XNSVHMCUIKTAAA-UHFFFAOYSA-N	0	0	283.371	4.279	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@H](C)Cc1cccc(Cl)c1	ZINC000490003672	332076291	/nfs/dbraw/zinc/07/62/91/332076291.db2.gz	KGJRVZMBDWUGQH-CYBMUJFWSA-N	0	0	293.838	4.237	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)CC/C=C/c1ccccc1	ZINC000490007362	332076305	/nfs/dbraw/zinc/07/63/05/332076305.db2.gz	VSGLRSAUQFCGPR-XYOKQWHBSA-N	0	0	271.404	4.199	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)Cc1ccc2ccccc2c1	ZINC000490028853	332077231	/nfs/dbraw/zinc/07/72/31/332077231.db2.gz	JCYZRCMOHWIZAY-UHFFFAOYSA-N	0	0	281.399	4.101	20	30		CIEDRN
C=CCn1cccc1C(=O)N(C)[C@@H](c1ccccc1)C(C)C	ZINC000490025646	332077306	/nfs/dbraw/zinc/07/73/06/332077306.db2.gz	IEWMSWXCQXFYQZ-GOSISDBHSA-N	0	0	296.414	4.143	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1ccc2ccccc2c1	ZINC000490043713	332078478	/nfs/dbraw/zinc/07/84/78/332078478.db2.gz	ZWTGJCGXFJUMAE-UHFFFAOYSA-N	0	0	267.372	4.172	20	30		CIEDRN
CC(C)c1ccc2c(c1)[C@@H](Nc1cnccc1C#N)CC2	ZINC000490052135	332078656	/nfs/dbraw/zinc/07/86/56/332078656.db2.gz	YKSDGWIAWKJREQ-KRWDZBQOSA-N	0	0	277.371	4.176	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@@H](C)c1ccc(CC)cc1	ZINC000490064578	332079579	/nfs/dbraw/zinc/07/95/79/332079579.db2.gz	BWBBSDKCPBTCLV-AWEZNQCLSA-N	0	0	273.420	4.071	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@H](C)CCc1cccc(F)c1	ZINC000490067586	332079778	/nfs/dbraw/zinc/07/97/78/332079778.db2.gz	OAKFASIREVNVSK-CQSZACIVSA-N	0	0	291.410	4.113	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)Cc1csc2ccccc12	ZINC000490081523	332080693	/nfs/dbraw/zinc/08/06/93/332080693.db2.gz	BPIYPYPQBRUTDH-UHFFFAOYSA-N	0	0	287.428	4.162	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)CCSc1ccc(F)cc1	ZINC000490089366	332081130	/nfs/dbraw/zinc/08/11/30/332081130.db2.gz	QNCASDDQSIVWDI-UHFFFAOYSA-N	0	0	295.423	4.026	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)CSc1ccc(Cl)cc1	ZINC000490091154	332081212	/nfs/dbraw/zinc/08/12/12/332081212.db2.gz	VPZCCEQHYRRCMX-UHFFFAOYSA-N	0	0	297.851	4.151	20	30		CIEDRN
C=CCn1cccc1C(=O)Nc1ccc(Cl)cc1Cl	ZINC000490094986	332081301	/nfs/dbraw/zinc/08/13/01/332081301.db2.gz	WJQXEORNZAXHDO-UHFFFAOYSA-N	0	0	295.169	4.233	20	30		CIEDRN
C=CCCCCNC(=O)[C@@H](CCC=C)c1ccccc1	ZINC000490181682	332083739	/nfs/dbraw/zinc/08/37/39/332083739.db2.gz	RAPAQHGZBCPRKU-KRWDZBQOSA-N	0	0	271.404	4.209	20	30		CIEDRN
C=CCC[C@H](C(=O)N[C@H](C)CCC1CC1)c1ccccc1	ZINC000490239167	332084998	/nfs/dbraw/zinc/08/49/98/332084998.db2.gz	DTLQBOHUKVYJRJ-QAPCUYQASA-N	0	0	285.431	4.431	20	30		CIEDRN
C=CCC[C@H](C(=O)N[C@@H](C)CCC1CC1)c1ccccc1	ZINC000490239169	332085234	/nfs/dbraw/zinc/08/52/34/332085234.db2.gz	DTLQBOHUKVYJRJ-YJBOKZPZSA-N	0	0	285.431	4.431	20	30		CIEDRN
C=CC[C@@H](C(=O)N1CC[C@H](C(C)(C)C)C1)c1ccccc1	ZINC000490251446	332085305	/nfs/dbraw/zinc/08/53/05/332085305.db2.gz	POHUOUFEVACEHS-DLBZAZTESA-N	0	0	285.431	4.241	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)C[C@@H]1CCC[C@H](C)C1	ZINC000490279349	332086047	/nfs/dbraw/zinc/08/60/47/332086047.db2.gz	ZQPHIWUJWLCFFV-JKSUJKDBSA-N	0	0	289.419	4.053	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)C[C@@H](C)c1ccccc1	ZINC000490312753	332086599	/nfs/dbraw/zinc/08/65/99/332086599.db2.gz	HWEPPJMZALBVKY-MRXNPFEDSA-N	0	0	297.398	4.031	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCCCCCc1ccc(F)cc1	ZINC000490458750	332089766	/nfs/dbraw/zinc/08/97/66/332089766.db2.gz	OMFAIGGKUSHXIM-HNNXBMFYSA-N	0	0	291.410	4.257	20	30		CIEDRN
CC(C)c1ccc([C@H]2CCCCN2CCC#N)cc1	ZINC000490613370	332095354	/nfs/dbraw/zinc/09/53/54/332095354.db2.gz	XSTBQYMCLHWYRW-QGZVFWFLSA-N	0	0	256.393	4.251	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cc(Cl)ccc1NCC	ZINC000490711771	332106821	/nfs/dbraw/zinc/10/68/21/332106821.db2.gz	WVDCZLUNERGANR-UHFFFAOYSA-N	0	0	292.810	4.479	20	30		CIEDRN
C=CCCCC(=O)Nc1cc(Cl)ccc1NCC	ZINC000490730629	332109500	/nfs/dbraw/zinc/10/95/00/332109500.db2.gz	GYCJUVCYMPVXSM-UHFFFAOYSA-N	0	0	266.772	4.067	20	30		CIEDRN
C=CCN(Cc1cccc(Cl)c1F)CC(F)(F)F	ZINC000511939690	332948342	/nfs/dbraw/zinc/94/83/42/332948342.db2.gz	QGUWYFGDYNHGSO-UHFFFAOYSA-N	0	0	281.680	4.029	20	30		CIEDRN
N#CCc1cccc(C(=O)Nc2csc3ccccc23)c1	ZINC000491482817	332219278	/nfs/dbraw/zinc/21/92/78/332219278.db2.gz	YVHDIPNEPUPQST-UHFFFAOYSA-N	0	0	292.363	4.220	20	30		CIEDRN
C#C[C@H](C)N(C)C(=O)Nc1c(CC=C)cccc1C(C)C	ZINC000491682305	332285186	/nfs/dbraw/zinc/28/51/86/332285186.db2.gz	RJCMLVBWVUIBOS-AWEZNQCLSA-N	0	0	284.403	4.024	20	30		CIEDRN
N#Cc1ccc(OCCCCC2CCOCC2)cc1Cl	ZINC000379843434	335101098	/nfs/dbraw/zinc/10/10/98/335101098.db2.gz	KHAWBZNWUHBPOJ-UHFFFAOYSA-N	0	0	293.794	4.187	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)CC(C)(C)CCC	ZINC000493081522	332425584	/nfs/dbraw/zinc/42/55/84/332425584.db2.gz	QZJZNGAXNNORMB-UHFFFAOYSA-N	0	0	279.449	4.479	20	30		CIEDRN
N#Cc1cc(NC(=O)C2=CCC2)ccc1Oc1ccccc1	ZINC000493934396	332458545	/nfs/dbraw/zinc/45/85/45/332458545.db2.gz	GCCBXQFSDNPGTL-UHFFFAOYSA-N	0	0	290.322	4.009	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)N[C@@H](CC)c1ccc(C)cc1	ZINC000494185501	332465806	/nfs/dbraw/zinc/46/58/06/332465806.db2.gz	KQQDOYPUSLTYRR-SJORKVTESA-N	0	0	286.419	4.196	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)N[C@H](C)c1cc(C)sc1C	ZINC000494698189	332483466	/nfs/dbraw/zinc/48/34/66/332483466.db2.gz	HZEKUVHIFPATMZ-TZMCWYRMSA-N	0	0	292.448	4.176	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)N[C@@H](C)c1cc(C)cc(C)c1	ZINC000494886354	332489710	/nfs/dbraw/zinc/48/97/10/332489710.db2.gz	OGEQZCKUKZWENE-RDJZCZTQSA-N	0	0	286.419	4.115	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1cccc(F)c1Cl	ZINC000495009531	332499814	/nfs/dbraw/zinc/49/98/14/332499814.db2.gz	PMFKCZNIXZNZQP-SNVBAGLBSA-N	0	0	284.762	4.345	20	30		CIEDRN
COCC[C@H](Sc1cccc(C#N)c1)c1ccccc1	ZINC000495253126	332513128	/nfs/dbraw/zinc/51/31/28/332513128.db2.gz	NZVPQFVEOVHIBF-KRWDZBQOSA-N	0	0	283.396	4.428	20	30		CIEDRN
C=CC[C@H](C)NC(=O)C/C=C\c1ccc(C(C)C)cc1	ZINC000495473905	332520243	/nfs/dbraw/zinc/52/02/43/332520243.db2.gz	JIVISERTKPJOGR-LYASGUKUSA-N	0	0	271.404	4.294	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)C/C=C/c1ccc(C(C)C)cc1	ZINC000495473908	332520284	/nfs/dbraw/zinc/52/02/84/332520284.db2.gz	JIVISERTKPJOGR-PMGBHYCQSA-N	0	0	271.404	4.294	20	30		CIEDRN
Cc1cccc(C)c1OCCCSc1cc(C#N)ccn1	ZINC000495828638	332531330	/nfs/dbraw/zinc/53/13/30/332531330.db2.gz	DSUIPPQGFVEQFM-UHFFFAOYSA-N	0	0	298.411	4.131	20	30		CIEDRN
CC(C)[C@H](NC(=O)CC(C)(C)C#N)c1ccc(Cl)cc1	ZINC000498870798	332574508	/nfs/dbraw/zinc/57/45/08/332574508.db2.gz	HAQADNXRMMHHLZ-HNNXBMFYSA-N	0	0	292.810	4.093	20	30		CIEDRN
CC(C)CN(C(=O)CC1CCCC1)c1ccc(C#N)cc1	ZINC000499321280	332584325	/nfs/dbraw/zinc/58/43/25/332584325.db2.gz	ZPXNJQVMXVXKBN-UHFFFAOYSA-N	0	0	284.403	4.128	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CC[C@H](C)C2(CCCCC2)C1	ZINC000500198385	332602441	/nfs/dbraw/zinc/60/24/41/332602441.db2.gz	DGHHKSYEEZMKJQ-HNNXBMFYSA-N	0	0	277.452	4.408	20	30		CIEDRN
C=CCCc1ccccc1NCc1ccc(OC)c(OC)c1	ZINC000500402658	332607276	/nfs/dbraw/zinc/60/72/76/332607276.db2.gz	LIEKOFWRPWBIOY-UHFFFAOYSA-N	0	0	297.398	4.435	20	30		CIEDRN
C=CCCc1ccccc1NCc1cccc2nccn21	ZINC000500447514	332609376	/nfs/dbraw/zinc/60/93/76/332609376.db2.gz	MBQPPOKNWRJPBI-UHFFFAOYSA-N	0	0	277.371	4.065	20	30		CIEDRN
C=CCCc1ccccc1NCc1sccc1OC	ZINC000500451252	332609715	/nfs/dbraw/zinc/60/97/15/332609715.db2.gz	LRJQLIDMYFPBIH-UHFFFAOYSA-N	0	0	273.401	4.487	20	30		CIEDRN
CC[C@@H]1C[C@@]1(NCc1ccccc1C#N)c1cccc(C)c1	ZINC000500503562	332611649	/nfs/dbraw/zinc/61/16/49/332611649.db2.gz	OPINCTXHGOBCFS-QUCCMNQESA-N	0	0	290.410	4.282	20	30		CIEDRN
COc1ccc(C#N)cc1NCc1csc2ccccc12	ZINC000501007624	332624056	/nfs/dbraw/zinc/62/40/56/332624056.db2.gz	YMYGOUGLUDIBLL-UHFFFAOYSA-N	0	0	294.379	4.394	20	30		CIEDRN
CCOc1ccc(C#N)cc1NCc1coc2ccccc12	ZINC000501019189	332624310	/nfs/dbraw/zinc/62/43/10/332624310.db2.gz	IILPOIQZKFGBGB-UHFFFAOYSA-N	0	0	292.338	4.315	20	30		CIEDRN
C=CCOc1cccc(NC(=O)c2ccc(Cl)s2)c1	ZINC000501155857	332627847	/nfs/dbraw/zinc/62/78/47/332627847.db2.gz	MVCCGNOGCSHUDD-UHFFFAOYSA-N	0	0	293.775	4.219	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H](c1ccc(F)cc1)C(C)C	ZINC000501606933	332636822	/nfs/dbraw/zinc/63/68/22/332636822.db2.gz	KNIYVKOJAKLFDB-QGZVFWFLSA-N	0	0	289.394	4.407	20	30		CIEDRN
C=CCCCC(=O)N[C@@]1(c2cccc(C)c2)C[C@@H]1CC	ZINC000501629196	332637055	/nfs/dbraw/zinc/63/70/55/332637055.db2.gz	LPMVZCZYRHHREH-YJBOKZPZSA-N	0	0	271.404	4.093	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)C[C@@H](C)CCC	ZINC000501671289	332638300	/nfs/dbraw/zinc/63/83/00/332638300.db2.gz	KNBFUDCHKSXPDN-AWEZNQCLSA-N	0	0	277.383	4.167	20	30		CIEDRN
CCc1ccc([C@H](Nc2ncccc2C#N)C(C)C)cc1	ZINC000501888931	332642613	/nfs/dbraw/zinc/64/26/13/332642613.db2.gz	SUXQYMHXIMQSTA-QGZVFWFLSA-N	0	0	279.387	4.325	20	30		CIEDRN
C=CCCc1ccccc1N[C@@H]1CCO[C@H](C(C)C)C1	ZINC000502308233	332653228	/nfs/dbraw/zinc/65/32/28/332653228.db2.gz	HDCXKLHJULNNLX-AEFFLSMTSA-N	0	0	273.420	4.421	20	30		CIEDRN
C=CCCc1ccccc1N[C@H](C)c1ccccn1	ZINC000502360830	332654773	/nfs/dbraw/zinc/65/47/73/332654773.db2.gz	CASANVPFZLPNGT-CQSZACIVSA-N	0	0	252.361	4.373	20	30		CIEDRN
CC#CCCSCc1csc(-c2ccoc2)n1	ZINC000154935767	334708365	/nfs/dbraw/zinc/70/83/65/334708365.db2.gz	RZZFPXVDEWFBQX-UHFFFAOYSA-N	0	0	263.387	4.050	20	30		CIEDRN
C=CCOc1ccccc1CN[C@@H](C)c1cc(C)c(C)o1	ZINC000502710927	332670664	/nfs/dbraw/zinc/67/06/64/332670664.db2.gz	FLYGDKRPNHIWKG-AWEZNQCLSA-N	0	0	285.387	4.312	20	30		CIEDRN
C[C@@H]1CC(C(=O)Nc2ccc(C(C)(C)C#N)cc2)C[C@@H](C)C1	ZINC000502792018	332673059	/nfs/dbraw/zinc/67/30/59/332673059.db2.gz	CPOUELGGFOLVLQ-KBPBESRZSA-N	0	0	298.430	4.499	20	30		CIEDRN
N#Cc1ccc(NC(=O)Nc2cccc3ccsc32)cc1	ZINC000502861464	332674027	/nfs/dbraw/zinc/67/40/27/332674027.db2.gz	PPMDDKYLGGHGAP-UHFFFAOYSA-N	0	0	293.351	4.417	20	30		CIEDRN
N#CCc1cccc(C(=O)Nc2cccc3ccsc32)c1	ZINC000502940893	332676833	/nfs/dbraw/zinc/67/68/33/332676833.db2.gz	RXMHLWCKYRXBMG-UHFFFAOYSA-N	0	0	292.363	4.220	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)NCC1CCCCC1	ZINC000503460927	332690148	/nfs/dbraw/zinc/69/01/48/332690148.db2.gz	AFGMTZPFOWPNNJ-UHFFFAOYSA-N	0	0	292.448	4.026	20	30		CIEDRN
CCc1cccc(CC)c1-n1ccnc1SCCC#N	ZINC000503581787	332693262	/nfs/dbraw/zinc/69/32/62/332693262.db2.gz	RJMKMCQKHSCKIP-UHFFFAOYSA-N	0	0	285.416	4.003	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1cnn(C(C)(C)C)c1	ZINC000504277754	332707317	/nfs/dbraw/zinc/70/73/17/332707317.db2.gz	YFYHYSCRCSHBDN-UHFFFAOYSA-N	0	0	297.402	4.009	20	30		CIEDRN
C[C@@H](NC(=O)C[C@H]1CCCCC1(C)C)c1ccc(C#N)cc1	ZINC000504429580	332711651	/nfs/dbraw/zinc/71/16/51/332711651.db2.gz	SVEDGFDOUBNMQV-RHSMWYFYSA-N	0	0	298.430	4.342	20	30		CIEDRN
CCCCN(C(=O)Cc1ccc(C#N)cc1)C1CCCCC1	ZINC000504619665	332716886	/nfs/dbraw/zinc/71/68/86/332716886.db2.gz	LUISTPKIPFXXEC-UHFFFAOYSA-N	0	0	298.430	4.062	20	30		CIEDRN
Cc1cc2cc(/C=C\c3ccncc3C#N)oc2cc1C	ZINC000504712210	332719244	/nfs/dbraw/zinc/71/92/44/332719244.db2.gz	NMFDTRYAACCAER-ARJAWSKDSA-N	0	0	274.323	4.487	20	30		CIEDRN
C=CCC(C)(C)C(=O)N(CC)Cc1c[nH]c2ccccc12	ZINC000504925328	332725382	/nfs/dbraw/zinc/72/53/82/332725382.db2.gz	BFYMEDKAGLYLOA-UHFFFAOYSA-N	0	0	284.403	4.119	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N[C@@H]1CCC[C@H]1C	ZINC000505001286	332727257	/nfs/dbraw/zinc/72/72/57/332727257.db2.gz	RCEPBHQQVHTVBL-UKRRQHHQSA-N	0	0	272.392	4.115	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N(CC)CC1CC1	ZINC000505007167	332727667	/nfs/dbraw/zinc/72/76/67/332727667.db2.gz	ZIBTXGLUDJZMGI-UHFFFAOYSA-N	0	0	272.392	4.069	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CCCC[C@@H](C)C1	ZINC000505011170	332727670	/nfs/dbraw/zinc/72/76/70/332727670.db2.gz	QZQYWYOVXRJIGN-OAHLLOKOSA-N	0	0	286.419	4.459	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CC[C@@H](C)[C@H](C)C1	ZINC000505011112	332727679	/nfs/dbraw/zinc/72/76/79/332727679.db2.gz	QHGOXLCJAMBCEM-HUUCEWRRSA-N	0	0	286.419	4.315	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1[C@@H](C)CC[C@@H]1C	ZINC000505011179	332727738	/nfs/dbraw/zinc/72/77/38/332727738.db2.gz	REXCSWKYFJNLGK-KBPBESRZSA-N	0	0	272.392	4.210	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CC[C@@H](CC)C1	ZINC000505052515	332729440	/nfs/dbraw/zinc/72/94/40/332729440.db2.gz	UQFKVOFVBGCUAT-CQSZACIVSA-N	0	0	272.392	4.069	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N(C)[C@@H](C)C1(C)CC1	ZINC000505059871	332729532	/nfs/dbraw/zinc/72/95/32/332729532.db2.gz	BRDDZDKAHRDKLP-AWEZNQCLSA-N	0	0	286.419	4.458	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)C[C@H]2CCC[C@H](C)C2)s1	ZINC000505069944	332729929	/nfs/dbraw/zinc/72/99/29/332729929.db2.gz	DTZOTJMKDOYLGU-RYUDHWBXSA-N	0	0	290.432	4.337	20	30		CIEDRN
CCCC[C@@H](CC)CNC(=O)c1cc(C#N)ccc1Cl	ZINC000505213065	332733747	/nfs/dbraw/zinc/73/37/47/332733747.db2.gz	HCDUHGKKKUQONN-GFCCVEGCSA-N	0	0	292.810	4.158	20	30		CIEDRN
C[C@H](F)CCOc1ccc(-c2ccc(C#N)cc2)cc1	ZINC000505427184	332739882	/nfs/dbraw/zinc/73/98/82/332739882.db2.gz	LBZWRJURKLMMCY-ZDUSSCGKSA-N	0	0	269.319	4.352	20	30		CIEDRN
C=CCn1c(SCCC(=C)C)nnc1-c1ccccc1	ZINC000505444102	332740574	/nfs/dbraw/zinc/74/05/74/332740574.db2.gz	OQQFVPUHSUNXMQ-UHFFFAOYSA-N	0	0	285.416	4.189	20	30		CIEDRN
CCCC[C@@H](CC)C(=O)N[C@H](C#N)c1ccccc1Cl	ZINC000505661876	332748492	/nfs/dbraw/zinc/74/84/92/332748492.db2.gz	OPPOOMLQHOGMRP-IUODEOHRSA-N	0	0	292.810	4.237	20	30		CIEDRN
C[C@H](CC(=O)N[C@@H](C#N)c1ccc(Cl)cc1)C(C)(C)C	ZINC000505800636	332752897	/nfs/dbraw/zinc/75/28/97/332752897.db2.gz	DFKQWPWWXXHJQE-RISCZKNCSA-N	0	0	292.810	4.093	20	30		CIEDRN
CC(C)CCC(=O)N[C@@H](C#N)c1ccc(C(C)(C)C)cc1	ZINC000505831029	332753901	/nfs/dbraw/zinc/75/39/01/332753901.db2.gz	FUBNNLRVVQXMRC-INIZCTEOSA-N	0	0	286.419	4.101	20	30		CIEDRN
CC(C)(C)c1ccc([C@@H](C#N)NC(=O)CCC2CCC2)cc1	ZINC000505827182	332753948	/nfs/dbraw/zinc/75/39/48/332753948.db2.gz	PYSXZNWQJXJVDX-QGZVFWFLSA-N	0	0	298.430	4.245	20	30		CIEDRN
N#Cc1ccccc1OCc1cc(Cl)cc2cccnc21	ZINC000505847372	332754522	/nfs/dbraw/zinc/75/45/22/332754522.db2.gz	YVDSYTGQMSKCNF-UHFFFAOYSA-N	0	0	294.741	4.339	20	30		CIEDRN
CCCC[C@@H](CC)CC(=O)N[C@@H](C#N)c1ccccc1F	ZINC000505923649	332757989	/nfs/dbraw/zinc/75/79/89/332757989.db2.gz	WWDKHKOVOYCTRN-CJNGLKHVSA-N	0	0	290.382	4.113	20	30		CIEDRN
COc1cc(C)ccc1N[C@@H](C)c1ccc(C#N)cc1F	ZINC000512281064	332961182	/nfs/dbraw/zinc/96/11/82/332961182.db2.gz	IRSLOCXSSGHAJN-LBPRGKRZSA-N	0	0	284.334	4.188	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H](C)c1ccccc1SC	ZINC000512752830	332983654	/nfs/dbraw/zinc/98/36/54/332983654.db2.gz	DUHXOKLXNJUGOI-GFCCVEGCSA-N	0	0	277.433	4.188	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1csc(C(C)=O)c1	ZINC000512779683	332985469	/nfs/dbraw/zinc/98/54/69/332985469.db2.gz	SWIMPIJVOZGWKT-UHFFFAOYSA-N	0	0	299.395	4.322	20	30		CIEDRN
C[C@H](Nc1ccc2scnc2c1)c1ccc(C#N)cc1	ZINC000174034207	332989373	/nfs/dbraw/zinc/98/93/73/332989373.db2.gz	CUDKKHOUXCEAKK-NSHDSACASA-N	0	0	279.368	4.341	20	30		CIEDRN
CCc1ccc(NCc2cc(C#N)cs2)cc1Cl	ZINC000513002296	332998042	/nfs/dbraw/zinc/99/80/42/332998042.db2.gz	WWVQQQJGYLNXFR-UHFFFAOYSA-N	0	0	276.792	4.448	20	30		CIEDRN
Cc1ccccc1[C@H]1C[C@H](Nc2ncc(C#N)cc2Cl)C1	ZINC000513048150	333001362	/nfs/dbraw/zinc/00/13/62/333001362.db2.gz	XJMOPJZEGJIIBF-HDJSIYSDSA-N	0	0	297.789	4.273	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(NCC[C@@H](C)c2ccccc2)c1	ZINC000513083482	333003308	/nfs/dbraw/zinc/00/33/08/333003308.db2.gz	POMHPLULDWYYAZ-CQSZACIVSA-N	0	0	292.382	4.367	20	30		CIEDRN
Cc1ccccc1[C@H]1C[C@H](Nc2c(C#N)cccc2C#N)C1	ZINC000513083627	333003339	/nfs/dbraw/zinc/00/33/39/333003339.db2.gz	PZCTZNQDKXHPCB-QAQDUYKDSA-N	0	0	287.366	4.096	20	30		CIEDRN
C=C(CC)CN[C@@H](c1c[nH]c2ccccc21)C(F)(F)F	ZINC000513162311	333006638	/nfs/dbraw/zinc/00/66/38/333006638.db2.gz	XTPSYOJEVSEGSB-AWEZNQCLSA-N	0	0	282.309	4.327	20	30		CIEDRN
C[C@@H]1C[C@@H](c2ccccc2)[N@H+](Cc2ccc(C#N)cc2F)C1	ZINC000513265189	333011507	/nfs/dbraw/zinc/01/15/07/333011507.db2.gz	CVZJAWHTJMNVEH-KUHUBIRLSA-N	0	0	294.373	4.280	20	30		CIEDRN
C[C@@H]1C[C@H](c2ccccc2)[N@H+](Cc2ccc(C#N)cc2F)C1	ZINC000513265187	333011554	/nfs/dbraw/zinc/01/15/54/333011554.db2.gz	CVZJAWHTJMNVEH-AUUYWEPGSA-N	0	0	294.373	4.280	20	30		CIEDRN
COc1ccc(CN(CCC#N)CCC(C)C)cc1Cl	ZINC000513339261	333014861	/nfs/dbraw/zinc/01/48/61/333014861.db2.gz	RGUMRKCUIPEWDD-UHFFFAOYSA-N	0	0	294.826	4.110	20	30		CIEDRN
C=CCCCC(=O)N(C)[C@@H](C)c1cccc(Cl)c1	ZINC000175241447	333018334	/nfs/dbraw/zinc/01/83/34/333018334.db2.gz	JTJKOKHYPALTNI-LBPRGKRZSA-N	0	0	265.784	4.216	20	30		CIEDRN
CC[C@@H](CC1CCCC1)C(=O)N(CCC#N)CCC(C)C	ZINC000513441641	333019449	/nfs/dbraw/zinc/01/94/49/333019449.db2.gz	DFZHAABFEFDBCC-KRWDZBQOSA-N	0	0	292.467	4.381	20	30		CIEDRN
C=C1CCN(Cc2csc(-c3ccc(C)cc3)n2)CC1	ZINC000513452618	333020481	/nfs/dbraw/zinc/02/04/81/333020481.db2.gz	ZIUSHEVIVLDWBH-UHFFFAOYSA-N	0	0	284.428	4.271	20	30		CIEDRN
N#Cc1ccc(NC(=O)c2ccc3ccccc3c2)cc1F	ZINC000308113308	333025067	/nfs/dbraw/zinc/02/50/67/333025067.db2.gz	LEOLHUQOQMMDIE-UHFFFAOYSA-N	0	0	290.297	4.103	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(-c2nc(C)cs2)cc1	ZINC000175512032	333026094	/nfs/dbraw/zinc/02/60/94/333026094.db2.gz	CJAVLMACCMZNHV-UHFFFAOYSA-N	0	0	286.400	4.413	20	30		CIEDRN
C=CCCCC(=O)Nc1c(C)cc(Br)cc1C	ZINC000175650279	333027998	/nfs/dbraw/zinc/02/79/98/333027998.db2.gz	UXPBWFGDCPWZKY-UHFFFAOYSA-N	0	0	296.208	4.361	20	30		CIEDRN
CSCc1ccc(Nc2ncc(C#N)cc2Cl)cc1	ZINC000513635218	333028020	/nfs/dbraw/zinc/02/80/20/333028020.db2.gz	KSWOIDWGCYJVKE-UHFFFAOYSA-N	0	0	289.791	4.213	20	30		CIEDRN
CC(C)CN(Cc1ccccc1)c1ncc(C#N)cc1Cl	ZINC000513650893	333029192	/nfs/dbraw/zinc/02/91/92/333029192.db2.gz	STJXBWLWSSRNJF-UHFFFAOYSA-N	0	0	299.805	4.269	20	30		CIEDRN
CC(C)(C)CN(CCC#N)Cc1cccc(Cl)c1	ZINC000513740887	333036960	/nfs/dbraw/zinc/03/69/60/333036960.db2.gz	ADGQQEDMZNISEK-UHFFFAOYSA-N	0	0	264.800	4.102	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)C/C=C/c1ccccc1F	ZINC000175935431	333037981	/nfs/dbraw/zinc/03/79/81/333037981.db2.gz	BDFKFDNUIHPWSP-GQCTYLIASA-N	0	0	294.329	4.048	20	30		CIEDRN
C=CCCCC(=O)N1CC[C@H](C)C[C@@H]1c1ccc(CC)o1	ZINC000176107167	333039553	/nfs/dbraw/zinc/03/95/53/333039553.db2.gz	IOQCXNNLIUEUPT-GOEBONIOSA-N	0	0	289.419	4.498	20	30		CIEDRN
C=CCCCN(C)C(=O)N[C@@H](C)c1c(F)cccc1Cl	ZINC000176162395	333039663	/nfs/dbraw/zinc/03/96/63/333039663.db2.gz	BPWMTTLQJZSNSK-NSHDSACASA-N	0	0	298.789	4.148	20	30		CIEDRN
N#Cc1ccc(/C=C/c2ccc3cccc(O)c3n2)s1	ZINC000176404299	333041795	/nfs/dbraw/zinc/04/17/95/333041795.db2.gz	UOEMKFVQPKKFPE-VOTSOKGWSA-N	0	0	278.336	4.044	20	30		CIEDRN
C=CCOc1cccc(NC(=O)Nc2cccc(F)c2)c1	ZINC000513849849	333043200	/nfs/dbraw/zinc/04/32/00/333043200.db2.gz	HPYJFKKXUUPTKL-UHFFFAOYSA-N	0	0	286.306	4.035	20	30		CIEDRN
CCCn1c2cccc(F)c2nc1-c1cccc(C#N)c1	ZINC000513869173	333045006	/nfs/dbraw/zinc/04/50/06/333045006.db2.gz	HPLAVOXVCYOAAL-UHFFFAOYSA-N	0	0	279.318	4.124	20	30		CIEDRN
C=CC[C@@H](C)[NH2+]Cc1ccc(F)c(Cl)c1Cl	ZINC000309755192	333048653	/nfs/dbraw/zinc/04/86/53/333048653.db2.gz	LHWNNFGXUNUXSD-MRVPVSSYSA-N	0	0	262.155	4.187	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H](c1ccc(OC)cc1)C1CC1	ZINC000176930680	333050807	/nfs/dbraw/zinc/05/08/07/333050807.db2.gz	QOIHDBKYJVDRRK-GOSISDBHSA-N	0	0	299.414	4.031	20	30		CIEDRN
C[C@H](Sc1ccccc1O)c1ccc(C#N)cc1	ZINC000177283355	333056800	/nfs/dbraw/zinc/05/68/00/333056800.db2.gz	FFHKRLAORWYGEH-NSHDSACASA-N	0	0	255.342	4.117	20	30		CIEDRN
C[C@@H](Sc1ccccc1O)c1ccc(C#N)cc1	ZINC000177283376	333056816	/nfs/dbraw/zinc/05/68/16/333056816.db2.gz	FFHKRLAORWYGEH-LLVKDONJSA-N	0	0	255.342	4.117	20	30		CIEDRN
C=CCCCC(=O)N(Cc1ccc(C)s1)C(C)C	ZINC000177765148	333062563	/nfs/dbraw/zinc/06/25/63/333062563.db2.gz	KJXXOBXDMBNAFO-UHFFFAOYSA-N	0	0	265.422	4.150	20	30		CIEDRN
C=CCCCC(=O)Nc1cc(C(F)(F)F)ccc1F	ZINC000177815620	333063498	/nfs/dbraw/zinc/06/34/98/333063498.db2.gz	QMOURERTAFXQCE-UHFFFAOYSA-N	0	0	275.245	4.139	20	30		CIEDRN
C=C(C)CS[C@@H](C)C(=O)Nc1cccc(SC)c1	ZINC000177864619	333064560	/nfs/dbraw/zinc/06/45/60/333064560.db2.gz	GONUARXWMVRBOY-NSHDSACASA-N	0	0	281.446	4.045	20	30		CIEDRN
CC(C)Oc1ccccc1NCc1cc(C#N)ccc1F	ZINC000178278984	333070403	/nfs/dbraw/zinc/07/04/03/333070403.db2.gz	XYDSKNZABSMOPT-UHFFFAOYSA-N	0	0	284.334	4.097	20	30		CIEDRN
C=CCC[C@H](NC(=O)Nc1ncccc1C)c1ccccc1	ZINC000178824182	333077858	/nfs/dbraw/zinc/07/78/58/333077858.db2.gz	OAGXVPSDTVUXFC-INIZCTEOSA-N	0	0	295.386	4.219	20	30		CIEDRN
Cc1c2ccccc2oc1[C@H](C)NCc1ccccc1C#N	ZINC000179063561	333079564	/nfs/dbraw/zinc/07/95/64/333079564.db2.gz	AWNPZUQACLNIBK-AWEZNQCLSA-N	0	0	290.366	4.464	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(-c2ccc3ncccc3c2)no1	ZINC000516812773	333083008	/nfs/dbraw/zinc/08/30/08/333083008.db2.gz	ZCBWFWOGUMOVCW-KRWDZBQOSA-N	0	0	279.343	4.139	20	30		CIEDRN
Cc1ccc(C)c(Sc2ccc([N+](=O)[O-])cc2C#N)c1	ZINC000006473330	333083951	/nfs/dbraw/zinc/08/39/51/333083951.db2.gz	BMITWDGRBRQCSL-UHFFFAOYSA-N	0	0	284.340	4.235	20	30		CIEDRN
CCCCN(C(=O)CC(C)(C)C#N)[C@@H]1CCC[C@@H](C)C1	ZINC000516886949	333085338	/nfs/dbraw/zinc/08/53/38/333085338.db2.gz	HYZMZMXICVKGKB-HUUCEWRRSA-N	0	0	278.440	4.134	20	30		CIEDRN
C[C@@H](C#N)CNc1ccc2c(Cl)c3c(nc2c1)CCCC3	ZINC000516900100	333085728	/nfs/dbraw/zinc/08/57/28/333085728.db2.gz	XHAKMXMCYRZQSK-NSHDSACASA-N	0	0	299.805	4.339	20	30		CIEDRN
N#Cc1ccc(N2CCC[C@@H]2C2CCCCC2)cc1[N+](=O)[O-]	ZINC000516943038	333087372	/nfs/dbraw/zinc/08/73/72/333087372.db2.gz	PXRGZMJJTBYRBS-MRXNPFEDSA-N	0	0	299.374	4.016	20	30		CIEDRN
COc1ccc(CSc2cccc(F)c2C#N)cc1F	ZINC000517008548	333089542	/nfs/dbraw/zinc/08/95/42/333089542.db2.gz	VQSISWPASJJHCQ-UHFFFAOYSA-N	0	0	291.322	4.137	20	30		CIEDRN
N#Cc1ccnc(N2Cc3ccccc3-c3ccccc3C2)c1	ZINC000517253325	333095947	/nfs/dbraw/zinc/09/59/47/333095947.db2.gz	VTXZBBZWYALTQQ-UHFFFAOYSA-N	0	0	297.361	4.140	20	30		CIEDRN
C=CCN(CC=C)C(=O)CCCCCc1cccs1	ZINC000517555400	333102479	/nfs/dbraw/zinc/10/24/79/333102479.db2.gz	WJRYZRWSJGVLDT-UHFFFAOYSA-N	0	0	277.433	4.052	20	30		CIEDRN
C=CCN1C(=O)c2ccccc2N[C@H]1c1ccc(CC)s1	ZINC000520897306	333107479	/nfs/dbraw/zinc/10/74/79/333107479.db2.gz	XUTHCDBDALTMNX-MRXNPFEDSA-N	0	0	298.411	4.063	20	30		CIEDRN
CC[C@@H](CNc1ccc(C#N)c([N+](=O)[O-])c1)c1ccccc1	ZINC000521129389	333112301	/nfs/dbraw/zinc/11/23/01/333112301.db2.gz	SCAVSPQPUYVXSP-ZDUSSCGKSA-N	0	0	295.342	4.072	20	30		CIEDRN
C=CC1CCN(C(=O)N[C@@H](CCC)c2ccccc2)CC1	ZINC000521173916	333113606	/nfs/dbraw/zinc/11/36/06/333113606.db2.gz	MLKYXXYOZXLMEU-KRWDZBQOSA-N	0	0	286.419	4.135	20	30		CIEDRN
CCCN(Cc1ccc(C)cc1)C(=O)C1(C#N)CCCCC1	ZINC000521269823	333116856	/nfs/dbraw/zinc/11/68/56/333116856.db2.gz	SLUHXXJEDMJJEW-UHFFFAOYSA-N	0	0	298.430	4.208	20	30		CIEDRN
C=CCCC(=O)NCc1c(OC(C)C)ccc2ccccc21	ZINC000183965952	333123986	/nfs/dbraw/zinc/12/39/86/333123986.db2.gz	QLPJKZBJXCXZPU-UHFFFAOYSA-N	0	0	297.398	4.209	20	30		CIEDRN
C[C@H]1CCC[C@H]1CC(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000184641926	333130975	/nfs/dbraw/zinc/13/09/75/333130975.db2.gz	MIXXBFRXOGJMLK-KBPBESRZSA-N	0	0	284.403	4.253	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(C)cc1Cl	ZINC000184872058	333132882	/nfs/dbraw/zinc/13/28/82/333132882.db2.gz	WGYNLLZZEWHMOZ-NSHDSACASA-N	0	0	251.757	4.189	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccccc1Cc1ccccc1	ZINC000184890480	333133088	/nfs/dbraw/zinc/13/30/88/333133088.db2.gz	YVOQYDDQVCHEFC-UHFFFAOYSA-N	0	0	291.394	4.410	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000184910535	333133267	/nfs/dbraw/zinc/13/32/67/333133267.db2.gz	BANZUERUARKJRD-VXGBXAGGSA-N	0	0	299.336	4.485	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1c(C)cccc1SC	ZINC000184942961	333133445	/nfs/dbraw/zinc/13/34/45/333133445.db2.gz	YRMREZAZMNZMAA-UHFFFAOYSA-N	0	0	278.421	4.147	20	30		CIEDRN
CC#CCCSCc1sc(C)nc1C(F)(F)F	ZINC000184936840	333133480	/nfs/dbraw/zinc/13/34/80/333133480.db2.gz	NRTWIABPMXCXFD-UHFFFAOYSA-N	0	0	279.352	4.117	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(Br)cc1C	ZINC000184962515	333133798	/nfs/dbraw/zinc/13/37/98/333133798.db2.gz	OBZDDAOFGGDUKH-NSHDSACASA-N	0	0	296.208	4.298	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H](c1ccc(Cl)cc1)C1CC1	ZINC000185003616	333134349	/nfs/dbraw/zinc/13/43/49/333134349.db2.gz	XNESOTKHBNCBAM-QGZVFWFLSA-N	0	0	289.806	4.101	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H](CC)c1cccc(Cl)c1	ZINC000185119343	333135863	/nfs/dbraw/zinc/13/58/63/333135863.db2.gz	UALZAUSOXPYKNH-HNNXBMFYSA-N	0	0	277.795	4.101	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(Cc1ccc(F)cc1F)C1CC1	ZINC000185210725	333136780	/nfs/dbraw/zinc/13/67/80/333136780.db2.gz	YULHVWOQVQPJNZ-LBPRGKRZSA-N	0	0	293.357	4.058	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC)[C@@H](C)c1cccc(OC)c1	ZINC000185227790	333137096	/nfs/dbraw/zinc/13/70/96/333137096.db2.gz	WFLJNFKGSIXLDS-GJZGRUSLSA-N	0	0	289.419	4.207	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccccc1OCC(C)C	ZINC000185230346	333137292	/nfs/dbraw/zinc/13/72/92/333137292.db2.gz	BMESXAWKGHUZIQ-AWEZNQCLSA-N	0	0	275.392	4.262	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC2(CCCCC2)CC1	ZINC000185413559	333140378	/nfs/dbraw/zinc/14/03/78/333140378.db2.gz	IDTDZEMBJXPQAH-HNNXBMFYSA-N	0	0	263.425	4.162	20	30		CIEDRN
C=C(C)[C@@H](NC(=O)N(C)CCCC)c1ccc(F)c(F)c1	ZINC000185462429	333141052	/nfs/dbraw/zinc/14/10/52/333141052.db2.gz	HNUQGRSHLLUJMZ-OAHLLOKOSA-N	0	0	296.361	4.024	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NC(C)(C)Cc1ccccc1C	ZINC000185457787	333141133	/nfs/dbraw/zinc/14/11/33/333141133.db2.gz	MQIRFJWPBUIZDS-HNNXBMFYSA-N	0	0	273.420	4.035	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](C)c1nc(C(C)(C)C)cs1	ZINC000185492765	333141880	/nfs/dbraw/zinc/14/18/80/333141880.db2.gz	PGOUSZIHONQDSR-RYUDHWBXSA-N	0	0	294.464	4.220	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)Cc1ccc(F)cc1Cl	ZINC000185498587	333142158	/nfs/dbraw/zinc/14/21/58/333142158.db2.gz	AJDHGJOBVZXVKX-NSHDSACASA-N	0	0	283.774	4.040	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cnccc1Oc1ccccc1	ZINC000185565181	333143864	/nfs/dbraw/zinc/14/38/64/333143864.db2.gz	QRFGWFGSMOWGJW-AWEZNQCLSA-N	0	0	296.370	4.415	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](C)c1cccc(C)c1C	ZINC000185583371	333144227	/nfs/dbraw/zinc/14/42/27/333144227.db2.gz	MVXSTDXVIVDLPF-UKRRQHHQSA-N	0	0	259.393	4.083	20	30		CIEDRN
CC#CCCCC(=O)N(c1ccc(F)cc1Cl)C(C)C	ZINC000185616151	333145171	/nfs/dbraw/zinc/14/51/71/333145171.db2.gz	BTZSVYSEIMHFIG-UHFFFAOYSA-N	0	0	295.785	4.414	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](CC)c1ccc(F)cc1F	ZINC000185628087	333145375	/nfs/dbraw/zinc/14/53/75/333145375.db2.gz	DWXSSFKHBMCXFX-XHDPSFHLSA-N	0	0	281.346	4.134	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(CC(F)(F)F)cc1	ZINC000185658754	333146246	/nfs/dbraw/zinc/14/62/46/333146246.db2.gz	ISOYTYNCNKPWHO-NSHDSACASA-N	0	0	285.309	4.332	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@@H](CC)Cc1ccccc1	ZINC000185676076	333146346	/nfs/dbraw/zinc/14/63/46/333146346.db2.gz	WRDWZDQPSARRFG-WBVHZDCISA-N	0	0	273.420	4.068	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC(F)(F)F)c1ccccc1	ZINC000185712714	333146947	/nfs/dbraw/zinc/14/69/47/333146947.db2.gz	OXNOJAYCLKPFHH-LBPRGKRZSA-N	0	0	285.309	4.184	20	30		CIEDRN
Cc1cc(N2CCCC2)ccc1N[C@H]1CCC[C@H](C#N)C1	ZINC000185722241	333147179	/nfs/dbraw/zinc/14/71/79/333147179.db2.gz	UUQKZPLNCSKGRM-HOTGVXAUSA-N	0	0	283.419	4.090	20	30		CIEDRN
N#C[C@H]1CCC[C@H](Nc2ccc(CC(F)(F)F)cc2)C1	ZINC000185730433	333147483	/nfs/dbraw/zinc/14/74/83/333147483.db2.gz	QTRUMLLBBBQWQC-JSGCOSHPSA-N	0	0	282.309	4.286	20	30		CIEDRN
CC(C)Oc1ccc(F)cc1N[C@@H]1CCC[C@H](C#N)C1	ZINC000185745637	333147825	/nfs/dbraw/zinc/14/78/25/333147825.db2.gz	HOQRUBLCQZEXHE-GXTWGEPZSA-N	0	0	276.355	4.107	20	30		CIEDRN
CC(C)Oc1ccc(F)cc1N[C@H]1CCC[C@@H](C#N)C1	ZINC000185745701	333147858	/nfs/dbraw/zinc/14/78/58/333147858.db2.gz	HOQRUBLCQZEXHE-OCCSQVGLSA-N	0	0	276.355	4.107	20	30		CIEDRN
CCN(C(=O)[C@@H]1C[C@@]1(C)C(C)C)[C@H](C)c1ccc(C#N)cc1	ZINC000185741331	333147876	/nfs/dbraw/zinc/14/78/76/333147876.db2.gz	BSDFMBLUHUIIBY-LJHODMEESA-N	0	0	298.430	4.150	20	30		CIEDRN
C=C(C)COc1cccc(N[C@H]2CCC[C@@H](C#N)C2)c1	ZINC000185745874	333147924	/nfs/dbraw/zinc/14/79/24/333147924.db2.gz	XPHHBGCATQNEDL-CABCVRRESA-N	0	0	270.376	4.136	20	30		CIEDRN
CC1CCN(c2cccc(N[C@H]3CCC[C@H](C#N)C3)c2)CC1	ZINC000185749400	333147933	/nfs/dbraw/zinc/14/79/33/333147933.db2.gz	KWTXLXAVOPIZBU-IRXDYDNUSA-N	0	0	297.446	4.417	20	30		CIEDRN
N#Cc1ccc(CNc2ccccc2CC(F)(F)F)cc1	ZINC000172930188	335124831	/nfs/dbraw/zinc/12/48/31/335124831.db2.gz	FPDFBBHECFWRLF-UHFFFAOYSA-N	0	0	290.288	4.275	20	30		CIEDRN
C=CC1CCN(C(=O)c2coc3cc(C)c(C)cc32)CC1	ZINC000185759985	333148282	/nfs/dbraw/zinc/14/82/82/333148282.db2.gz	IWDYZFGFKKEJMH-UHFFFAOYSA-N	0	0	283.371	4.088	20	30		CIEDRN
N#Cc1ccc(OCc2ccc(C(F)F)cc2)cc1	ZINC000185774163	333148547	/nfs/dbraw/zinc/14/85/47/333148547.db2.gz	NKHZPMHCVUHHHY-UHFFFAOYSA-N	0	0	259.255	4.075	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC1CC1)c1ccccc1	ZINC000185806987	333149436	/nfs/dbraw/zinc/14/94/36/333149436.db2.gz	LYIUZQVWJKVONI-AWEZNQCLSA-N	0	0	257.377	4.032	20	30		CIEDRN
CC#CCCCC(=O)Nc1sccc1C(=O)C(C)(C)C	ZINC000185817081	333149624	/nfs/dbraw/zinc/14/96/24/333149624.db2.gz	BVGREDZZNNZALB-UHFFFAOYSA-N	0	0	291.416	4.109	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(Cl)cc1OCC	ZINC000185845916	333150149	/nfs/dbraw/zinc/15/01/49/333150149.db2.gz	COOJZTMYIRINTJ-LLVKDONJSA-N	0	0	281.783	4.280	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H]1[C@H](C)CCC	ZINC000185889408	333151196	/nfs/dbraw/zinc/15/11/96/333151196.db2.gz	MCSYNDIOJFHOHZ-ILXRZTDVSA-N	0	0	251.414	4.016	20	30		CIEDRN
Cc1ccc(N[C@@H]2CCC[C@H](C#N)C2)c2cccnc12	ZINC000185888653	333151239	/nfs/dbraw/zinc/15/12/39/333151239.db2.gz	CABQWFKNQWQTRF-UONOGXRCSA-N	0	0	265.360	4.038	20	30		CIEDRN
C=CCCCC(=O)N1CCC(c2ccc(Cl)cc2)CC1	ZINC000185915270	333151630	/nfs/dbraw/zinc/15/16/30/333151630.db2.gz	SGBOAYPHUMVOID-UHFFFAOYSA-N	0	0	291.822	4.402	20	30		CIEDRN
C[C@@H](NCc1cccc(C#N)c1F)c1ccccc1Cl	ZINC000219525787	333151915	/nfs/dbraw/zinc/15/19/15/333151915.db2.gz	GHDLLNPONDWVBM-LLVKDONJSA-N	0	0	288.753	4.202	20	30		CIEDRN
CC#CCCCC(=O)N(CC(F)F)c1cccc(Cl)c1	ZINC000186002345	333153231	/nfs/dbraw/zinc/15/32/31/333153231.db2.gz	BWHNDOZQSJWGEO-UHFFFAOYSA-N	0	0	299.748	4.132	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCCC[C@@H]1CC(C)C	ZINC000186025304	333153453	/nfs/dbraw/zinc/15/34/53/333153453.db2.gz	RGUQDBQPNZXXRN-HUUCEWRRSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](CC(C)(C)C)C(F)(F)F	ZINC000186018897	333153527	/nfs/dbraw/zinc/15/35/27/333153527.db2.gz	AYLXHHPATQDQAJ-QWRGUYRKSA-N	0	0	279.346	4.072	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCCC[C@H]1CC(C)C	ZINC000186025283	333153570	/nfs/dbraw/zinc/15/35/70/333153570.db2.gz	RGUQDBQPNZXXRN-CABCVRRESA-N	0	0	251.414	4.016	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1sc(C)nc1CC(C)C	ZINC000186037026	333153712	/nfs/dbraw/zinc/15/37/12/333153712.db2.gz	ZEVKTVYLONNCJS-NSHDSACASA-N	0	0	280.437	4.191	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CC[C@@H](c2cc(C)cc(C)c2)C1	ZINC000186043246	333154068	/nfs/dbraw/zinc/15/40/68/333154068.db2.gz	PNKDQQZWUWYTEW-IAGOWNOFSA-N	0	0	285.431	4.222	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H]1C(C)(C)CC	ZINC000186083556	333154840	/nfs/dbraw/zinc/15/48/40/333154840.db2.gz	LKTYUVNRCKSNNT-ZIAGYGMSSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=CC[C@H](C(=O)N(C)Cc1ccccc1F)c1ccccc1	ZINC000186139174	333155694	/nfs/dbraw/zinc/15/56/94/333155694.db2.gz	ZABOEPRSALZALQ-KRWDZBQOSA-N	0	0	297.373	4.144	20	30		CIEDRN
C=CC[C@@H](C(=O)N(C)c1ccccc1)c1ccccc1	ZINC000186215808	333156738	/nfs/dbraw/zinc/15/67/38/333156738.db2.gz	XMQWAMYQQXDDHI-QGZVFWFLSA-N	0	0	265.356	4.009	20	30		CIEDRN
CCSc1cccc(CN(CC#N)C2CCCC2)c1	ZINC000186235791	333157276	/nfs/dbraw/zinc/15/72/76/333157276.db2.gz	AYCOWTVHHIVWSB-UHFFFAOYSA-N	0	0	274.433	4.067	20	30		CIEDRN
C=C(C)[C@@H](N[C@@H](C)c1cccnc1)c1ccc(F)c(F)c1	ZINC000186445947	333161075	/nfs/dbraw/zinc/16/10/75/333161075.db2.gz	QOSWZEXRZOXACB-YVEFUNNKSA-N	0	0	288.341	4.328	20	30		CIEDRN
C=CCC[C@H](C)Nc1ccc2c(c1)CCC(=O)N2CC1CC1	ZINC000186665983	333164054	/nfs/dbraw/zinc/16/40/54/333164054.db2.gz	KZKYORBLYSDYAC-AWEZNQCLSA-N	0	0	298.430	4.142	20	30		CIEDRN
C[C@@H]1CCC[C@@H]1CC(=O)N(C)c1cc(Cl)ccc1C#N	ZINC000186841512	333165492	/nfs/dbraw/zinc/16/54/92/333165492.db2.gz	USKLAAZYJXXISO-VXGBXAGGSA-N	0	0	290.794	4.001	20	30		CIEDRN
CCN(C[C@H](C)C#N)[C@@H](C)c1cccc(Cl)c1F	ZINC000186903956	333166258	/nfs/dbraw/zinc/16/62/58/333166258.db2.gz	UPSBSPNLLFXMIO-MNOVXSKESA-N	0	0	268.763	4.022	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1ccc(C)cc1OC)c1ccccc1	ZINC000186978629	333167095	/nfs/dbraw/zinc/16/70/95/333167095.db2.gz	AJGPLJJZCQODBK-INIZCTEOSA-N	0	0	295.382	4.302	20	30		CIEDRN
C=CCCCC(=O)Nc1cccnc1-c1ccc(C)s1	ZINC000187071357	333167644	/nfs/dbraw/zinc/16/76/44/333167644.db2.gz	ANFVIELAFJNFPS-UHFFFAOYSA-N	0	0	286.400	4.413	20	30		CIEDRN
C=CC[C@@H](C(=O)N(C)c1ccccc1F)c1ccccc1	ZINC000187343069	333169797	/nfs/dbraw/zinc/16/97/97/333169797.db2.gz	NNGAQNWUNKVFPY-OAHLLOKOSA-N	0	0	283.346	4.148	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)C[C@@H](C)c1ccccc1	ZINC000187528806	333171991	/nfs/dbraw/zinc/17/19/91/333171991.db2.gz	LIQDUYIXLHNWDR-OAHLLOKOSA-N	0	0	286.419	4.111	20	30		CIEDRN
C=CCC[C@@H](C(=O)Nc1cnccc1C)c1ccccc1	ZINC000187626054	333173200	/nfs/dbraw/zinc/17/32/00/333173200.db2.gz	QCWLZGXVENRIFN-MRXNPFEDSA-N	0	0	280.371	4.079	20	30		CIEDRN
C=CCN(C(=O)c1sccc1Cl)c1ccccc1	ZINC000521497684	333174345	/nfs/dbraw/zinc/17/43/45/333174345.db2.gz	NDNSMHBNSUOJKS-UHFFFAOYSA-N	0	0	277.776	4.234	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cc(Cl)ccc1C	ZINC000189797145	333199237	/nfs/dbraw/zinc/19/92/37/333199237.db2.gz	LREJYWPQOMYCPA-CQSZACIVSA-N	0	0	251.757	4.189	20	30		CIEDRN
N#CC1(NC(=O)c2ccc(C3=CCCC3)cc2)CCCCC1	ZINC000521519496	333175342	/nfs/dbraw/zinc/17/53/42/333175342.db2.gz	YGASEIZLKCZWPS-UHFFFAOYSA-N	0	0	294.398	4.210	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)c1csc(Cl)c1	ZINC000188968061	333176929	/nfs/dbraw/zinc/17/69/29/333176929.db2.gz	BSIYTIQOYPQJFM-UHFFFAOYSA-N	0	0	297.832	4.291	20	30		CIEDRN
C=CCC[C@H](C(=O)Nc1ccc(O)cc1)c1ccccc1	ZINC000189049060	333179007	/nfs/dbraw/zinc/17/90/07/333179007.db2.gz	HWFIGPCPFTVIGI-KRWDZBQOSA-N	0	0	281.355	4.081	20	30		CIEDRN
Cc1csc2c1ncnc2N[C@@H](C)c1ccc(C#N)cc1	ZINC000222281788	333179604	/nfs/dbraw/zinc/17/96/04/333179604.db2.gz	IAUKRWJTDTYNGL-NSHDSACASA-N	0	0	294.383	4.045	20	30		CIEDRN
CSc1ccc2c(c1)[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)CCC2	ZINC000572522629	333184857	/nfs/dbraw/zinc/18/48/57/333184857.db2.gz	IXVQDCRJJNAVIO-QEORTHHSSA-N	0	0	286.444	4.068	20	30		CIEDRN
C=CCOc1cccc(CNc2cnn([C@H](C)C3CC3)c2)c1	ZINC000189257069	333188302	/nfs/dbraw/zinc/18/83/02/333188302.db2.gz	UHVMHUHQBAWNNI-CQSZACIVSA-N	0	0	297.402	4.031	20	30		CIEDRN
C=CC[C@@H](C(=O)N(C)Cc1ccccc1)c1ccccc1	ZINC000189364543	333191266	/nfs/dbraw/zinc/19/12/66/333191266.db2.gz	JMFKNFFYABLGDJ-GOSISDBHSA-N	0	0	279.383	4.005	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1ccc(F)cc1)c1ccccc1	ZINC000189376015	333191505	/nfs/dbraw/zinc/19/15/05/333191505.db2.gz	ICAFCUWNIXIKAL-MRXNPFEDSA-N	0	0	269.319	4.124	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1ccc(F)cc1)c1ccccc1	ZINC000189375995	333191526	/nfs/dbraw/zinc/19/15/26/333191526.db2.gz	ICAFCUWNIXIKAL-INIZCTEOSA-N	0	0	269.319	4.124	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1ccccc1F)c1ccccc1	ZINC000189405694	333192205	/nfs/dbraw/zinc/19/22/05/333192205.db2.gz	KHIYYSZDRYQFER-CQSZACIVSA-N	0	0	269.319	4.124	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@H](C)c1ccccc1Cl	ZINC000189859515	333199761	/nfs/dbraw/zinc/19/97/61/333199761.db2.gz	HWOUORKOGDUISW-ABAIWWIYSA-N	0	0	265.784	4.120	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(Cc1c(F)cccc1F)C1CC1	ZINC000190021760	333201983	/nfs/dbraw/zinc/20/19/83/333201983.db2.gz	PDVWTHFAZKZGDE-GFCCVEGCSA-N	0	0	293.357	4.058	20	30		CIEDRN
N#Cc1cc(Cl)ccc1CSCC[C@@H]1CCCO1	ZINC000190146787	333203729	/nfs/dbraw/zinc/20/37/29/333203729.db2.gz	YYPCSMWNVZSINO-AWEZNQCLSA-N	0	0	281.808	4.014	20	30		CIEDRN
C=CCC1(C(=O)Nc2cccc(Cl)c2C)CCC1	ZINC000190291272	333205271	/nfs/dbraw/zinc/20/52/71/333205271.db2.gz	AZQHDXMQPPLXJI-UHFFFAOYSA-N	0	0	263.768	4.333	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H](C)c1cc(C)sc1C	ZINC000190325808	333205583	/nfs/dbraw/zinc/20/55/83/333205583.db2.gz	CDHZIYZPQDOVND-XHDPSFHLSA-N	0	0	265.422	4.144	20	30		CIEDRN
CC(C)Oc1ccccc1NCc1ccc(C#N)c(F)c1	ZINC000190341181	333205856	/nfs/dbraw/zinc/20/58/56/333205856.db2.gz	CRNJDZWCVVWZTG-UHFFFAOYSA-N	0	0	284.334	4.097	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCCSc2ccc(F)cc21	ZINC000190425347	333206869	/nfs/dbraw/zinc/20/68/69/333206869.db2.gz	GCRSNJNRJIQKRQ-GFCCVEGCSA-N	0	0	293.407	4.257	20	30		CIEDRN
N#Cc1ccc(CNc2cc(F)ccc2OCC2CC2)cc1	ZINC000190480164	333207347	/nfs/dbraw/zinc/20/73/47/333207347.db2.gz	GXMJUPLSFWDDQD-UHFFFAOYSA-N	0	0	296.345	4.098	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N(C)Cc1cccc(C(F)(F)F)c1	ZINC000190738473	333210289	/nfs/dbraw/zinc/21/02/89/333210289.db2.gz	ZBFSSIDXLNPLKL-OAHLLOKOSA-N	0	0	299.336	4.266	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H](C)c2cc3ccccc3o2)CCC1	ZINC000190832130	333211466	/nfs/dbraw/zinc/21/14/66/333211466.db2.gz	YPMKWSDYFRDYTC-ZDUSSCGKSA-N	0	0	283.371	4.356	20	30		CIEDRN
N#Cc1cccc(CNc2ccc(F)cc2Cl)c1F	ZINC000223726716	333211605	/nfs/dbraw/zinc/21/16/05/333211605.db2.gz	NXENQDKPRMYANI-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
CC(C)OCCCS[C@@H](C)c1ccc(C#N)cc1	ZINC000190948945	333212570	/nfs/dbraw/zinc/21/25/70/333212570.db2.gz	JDEPUUNLIJTJHV-ZDUSSCGKSA-N	0	0	263.406	4.168	20	30		CIEDRN
N#Cc1ccc(CSc2ccc(Cl)cn2)cc1F	ZINC000190972866	333212757	/nfs/dbraw/zinc/21/27/57/333212757.db2.gz	KJBMHVUIDBKSJU-UHFFFAOYSA-N	0	0	278.739	4.038	20	30		CIEDRN
N#CCCCSC/C=C/c1ccc(Cl)cc1	ZINC000191026868	333213723	/nfs/dbraw/zinc/21/37/23/333213723.db2.gz	YGOKTHXFHOOHPY-ONEGZZNKSA-N	0	0	251.782	4.390	20	30		CIEDRN
CC[C@@H](C)CC(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1	ZINC000191541035	333221167	/nfs/dbraw/zinc/22/11/67/333221167.db2.gz	IOLYDKVFNSTYNL-RNCFNFMXSA-N	0	0	299.201	4.110	20	30		CIEDRN
COc1ccccc1CS[C@H](C#N)C1CCCCC1	ZINC000522847561	333224061	/nfs/dbraw/zinc/22/40/61/333224061.db2.gz	AADXMRVKCFVDJZ-MRXNPFEDSA-N	0	0	275.417	4.401	20	30		CIEDRN
N#Cc1c(F)cccc1/C=C/c1ccc2ccccc2n1	ZINC000521947251	333225140	/nfs/dbraw/zinc/22/51/40/333225140.db2.gz	CXCDZHXGIGCREC-CSKARUKUSA-N	0	0	274.298	4.416	20	30		CIEDRN
C=CCCCC(=O)Nc1cnn(-c2cccc(C)c2)c1CC	ZINC000192150378	333230899	/nfs/dbraw/zinc/23/08/99/333230899.db2.gz	BPZIOLUYVJLSOP-UHFFFAOYSA-N	0	0	297.402	4.038	20	30		CIEDRN
C[C@H](NCC#Cc1ccccc1)c1nc(C(C)(C)C)cs1	ZINC000192182143	333231738	/nfs/dbraw/zinc/23/17/38/333231738.db2.gz	HZHVOZRLDWYXBP-AWEZNQCLSA-N	0	0	298.455	4.143	20	30		CIEDRN
C[C@@H](NCC#Cc1ccccc1)c1nc(C(C)(C)C)cs1	ZINC000192182148	333231865	/nfs/dbraw/zinc/23/18/65/333231865.db2.gz	HZHVOZRLDWYXBP-CQSZACIVSA-N	0	0	298.455	4.143	20	30		CIEDRN
N#Cc1ccc(NCc2cccc(F)c2F)c(Cl)c1	ZINC000225233366	333233880	/nfs/dbraw/zinc/23/38/80/333233880.db2.gz	DDDIXOLEPBCQPI-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
Cc1ccc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1C	ZINC000193308278	333247544	/nfs/dbraw/zinc/24/75/44/333247544.db2.gz	FXIOKNMUOSZBKR-UHFFFAOYSA-N	0	0	292.382	4.357	20	30		CIEDRN
N#Cc1ccccc1OCCSCc1cccc(F)c1	ZINC000195594898	333256625	/nfs/dbraw/zinc/25/66/25/333256625.db2.gz	FZCBGUUBQUUDNZ-UHFFFAOYSA-N	0	0	287.359	4.010	20	30		CIEDRN
CCCC[C@@H](CC)C(=O)Nc1ccc(C#N)cc1Cl	ZINC000226345431	333257600	/nfs/dbraw/zinc/25/76/00/333257600.db2.gz	QINMTSUCOCHWQA-GFCCVEGCSA-N	0	0	278.783	4.367	20	30		CIEDRN
CC[C@@H](C(=O)Nc1ccc(C#N)cc1Cl)c1ccccc1	ZINC000226345232	333257645	/nfs/dbraw/zinc/25/76/45/333257645.db2.gz	RKYADPQWIISYGB-CQSZACIVSA-N	0	0	298.773	4.344	20	30		CIEDRN
C=CCCC(=O)N[C@@H](C)c1ccc(Cl)cc1Cl	ZINC000194027591	333263940	/nfs/dbraw/zinc/26/39/40/333263940.db2.gz	SBADJBLELWMTHU-VIFPVBQESA-N	0	0	272.175	4.137	20	30		CIEDRN
C[C@H](c1cccc(C#N)c1)N(C)C(=O)C[C@@H]1CCCC[C@H]1C	ZINC000575917648	335130669	/nfs/dbraw/zinc/13/06/69/335130669.db2.gz	FQBPERPANPATLD-INMHGKMJSA-N	0	0	298.430	4.294	20	30		CIEDRN
C[C@H](Oc1ccc(C#N)c(Cl)c1)c1cccc(C#N)c1	ZINC000194706605	333275969	/nfs/dbraw/zinc/27/59/69/333275969.db2.gz	BBYDSWWSNZHTLF-NSHDSACASA-N	0	0	282.730	4.223	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc(Cl)c(OC)c1	ZINC000194718872	333276162	/nfs/dbraw/zinc/27/61/62/333276162.db2.gz	FIXAROCUHIUJQV-UHFFFAOYSA-N	0	0	279.767	4.056	20	30		CIEDRN
C=CCSCc1csc(-c2ccc(C)o2)n1	ZINC000522282589	333278600	/nfs/dbraw/zinc/27/86/00/333278600.db2.gz	VTMUIMNOGKWOCX-UHFFFAOYSA-N	0	0	251.376	4.131	20	30		CIEDRN
C=CCSCc1ncc(-c2cccc(Cl)c2)o1	ZINC000522283600	333278969	/nfs/dbraw/zinc/27/89/69/333278969.db2.gz	WDXPVDZQNCWIMP-UHFFFAOYSA-N	0	0	265.765	4.414	20	30		CIEDRN
N#Cc1cc(NC(=O)C2CCCCCC2)ccc1Cl	ZINC000522380457	333285487	/nfs/dbraw/zinc/28/54/87/333285487.db2.gz	WZVZPPNXJOKDFQ-UHFFFAOYSA-N	0	0	276.767	4.121	20	30		CIEDRN
C[C@H]1C[C@H](c2ccccc2)CN1c1c(F)cc(C#N)cc1F	ZINC000522405284	333286454	/nfs/dbraw/zinc/28/64/54/333286454.db2.gz	ZNXUHMNBBUCUJH-WFASDCNBSA-N	0	0	298.336	4.219	20	30		CIEDRN
CS[C@@H]1CCC[C@@H](Nc2cc(Cl)ccc2C#N)C1	ZINC000227652651	333287319	/nfs/dbraw/zinc/28/73/19/333287319.db2.gz	PEMHAJWELLSTPP-CHWSQXEVSA-N	0	0	280.824	4.298	20	30		CIEDRN
Cc1cc(C#N)ccc1-c1nc(-c2cccc(Cl)c2)no1	ZINC000227793639	333288417	/nfs/dbraw/zinc/28/84/17/333288417.db2.gz	UBFZFDMCMRBDLX-UHFFFAOYSA-N	0	0	295.729	4.237	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@H](c1ccc(CC)cc1)C(C)C	ZINC000522631246	333293447	/nfs/dbraw/zinc/29/34/47/333293447.db2.gz	QVMRYWOLUXISJY-YOEHRIQHSA-N	0	0	288.435	4.210	20	30		CIEDRN
C=CC[C@H](C)Nc1cc(C)c(C#N)c2nc3ccccc3n21	ZINC000522631491	333293558	/nfs/dbraw/zinc/29/35/58/333293558.db2.gz	AIEMCCSZMRMPDO-ZDUSSCGKSA-N	0	0	290.370	4.044	20	30		CIEDRN
C=CC[C@H](C)NC(=O)CC1CCC(c2ccccc2)CC1	ZINC000522642839	333294462	/nfs/dbraw/zinc/29/44/62/333294462.db2.gz	LLKGTPATKMGVAX-HJOIGYKYSA-N	0	0	285.431	4.431	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)c1ccc(Oc2ccccc2)cc1	ZINC000522645685	333294572	/nfs/dbraw/zinc/29/45/72/333294572.db2.gz	HCAGHVPZHDEOMO-CQSZACIVSA-N	0	0	281.355	4.173	20	30		CIEDRN
C[C@H](CC(=O)N[C@@]1(C#N)CCC[C@@H](C)C1)C1CCCCC1	ZINC000522644451	333294601	/nfs/dbraw/zinc/29/46/01/333294601.db2.gz	WAKIZGFOAXFIBX-RKVPGOIHSA-N	0	0	290.451	4.182	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1cccc(OC2CCCC2)c1	ZINC000522660542	333295228	/nfs/dbraw/zinc/29/52/28/333295228.db2.gz	AEICOPPLLOWKKZ-CYBMUJFWSA-N	0	0	288.391	4.094	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@@H](CC(C)C)c1ccccc1C	ZINC000522665175	333295571	/nfs/dbraw/zinc/29/55/71/333295571.db2.gz	SEYHTOWTNYFTMF-WBVHZDCISA-N	0	0	288.435	4.346	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@H](CC(C)C)c1ccccc1C	ZINC000522665173	333295640	/nfs/dbraw/zinc/29/56/40/333295640.db2.gz	SEYHTOWTNYFTMF-NVXWUHKLSA-N	0	0	288.435	4.346	20	30		CIEDRN
CCCC[C@H](CC)CC(=O)Nc1cc(C#N)ccc1OC	ZINC000522670299	333296016	/nfs/dbraw/zinc/29/60/16/333296016.db2.gz	IQBDMVXLRAKTOG-ZDUSSCGKSA-N	0	0	288.391	4.112	20	30		CIEDRN
C=CCCCN(C)C(=O)c1cc(F)c(Cl)cc1Cl	ZINC000522954132	333300933	/nfs/dbraw/zinc/30/09/33/333300933.db2.gz	DJKBKXGPGMAARL-UHFFFAOYSA-N	0	0	290.165	4.171	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1cccc2ccccc21	ZINC000522951395	333301010	/nfs/dbraw/zinc/30/10/10/333301010.db2.gz	IMJJXVZMQVUUAW-UHFFFAOYSA-N	0	0	268.360	4.270	20	30		CIEDRN
CC(C)[C@@H](CC1CCCC1)C(=O)NCc1ccc(C#N)cc1	ZINC000522963728	333301786	/nfs/dbraw/zinc/30/17/86/333301786.db2.gz	CGLOZTOMHQMRHK-GOSISDBHSA-N	0	0	298.430	4.027	20	30		CIEDRN
C=CCCCS[C@@H](C)c1nc(CCCC)no1	ZINC000522968461	333302205	/nfs/dbraw/zinc/30/22/05/333302205.db2.gz	UJUJKABXZQKZGW-NSHDSACASA-N	0	0	254.399	4.173	20	30		CIEDRN
C=CCCCN(C)C(=O)N[C@H](CCC)C1CCCCC1	ZINC000523001516	333304195	/nfs/dbraw/zinc/30/41/95/333304195.db2.gz	BLNXKERZTSCYKH-MRXNPFEDSA-N	0	0	280.456	4.343	20	30		CIEDRN
CCSCCCNc1ccc(C#N)c(C(F)(F)F)c1	ZINC000229512437	333305735	/nfs/dbraw/zinc/30/57/35/333305735.db2.gz	NHQBWPQYYNOJHN-UHFFFAOYSA-N	0	0	288.338	4.132	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)[C@H](C)c1ccsc1	ZINC000523088094	333307589	/nfs/dbraw/zinc/30/75/89/333307589.db2.gz	REVOFRHAPQDOKC-CQSZACIVSA-N	0	0	291.460	4.447	20	30		CIEDRN
Cc1cccc(SCc2ccc(F)c(C#N)c2)c1	ZINC000229754109	333309438	/nfs/dbraw/zinc/30/94/38/333309438.db2.gz	ITNPKKZDOONDNL-UHFFFAOYSA-N	0	0	257.333	4.298	20	30		CIEDRN
N#Cc1ccc(F)cc1COc1ccc(F)cc1Cl	ZINC000229946942	333311827	/nfs/dbraw/zinc/31/18/27/333311827.db2.gz	HUVBBVKZBMEPNH-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
N#Cc1ccc(F)cc1CSc1ccccc1F	ZINC000229949324	333311925	/nfs/dbraw/zinc/31/19/25/333311925.db2.gz	CLLMEPBUKMZRAY-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
C=CCCC(=O)N(Cc1cccc(C(F)(F)F)c1)C(C)C	ZINC000523223654	333312962	/nfs/dbraw/zinc/31/29/62/333312962.db2.gz	NVLFQYFODDFIRT-UHFFFAOYSA-N	0	0	299.336	4.409	20	30		CIEDRN
C=CCCC(=O)N(CCC)[C@@H](CC)c1ccccc1	ZINC000523222933	333312999	/nfs/dbraw/zinc/31/29/99/333312999.db2.gz	BCGRZGYVCIEFJN-INIZCTEOSA-N	0	0	259.393	4.343	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(OC)c(Cc2ccccc2)c1	ZINC000523227107	333313215	/nfs/dbraw/zinc/31/32/15/333313215.db2.gz	WZFUAPSLJQKDIY-UHFFFAOYSA-N	0	0	295.382	4.191	20	30		CIEDRN
C=CCCC(=O)N[C@H](c1cccc(C(F)(F)F)c1)C(C)C	ZINC000523269687	333313506	/nfs/dbraw/zinc/31/35/06/333313506.db2.gz	KXCQMLQHAIGWAT-HNNXBMFYSA-N	0	0	299.336	4.485	20	30		CIEDRN
C=CCCC(=O)NC[C@@H](C)c1c(Cl)cccc1Cl	ZINC000523275996	333313550	/nfs/dbraw/zinc/31/35/50/333313550.db2.gz	WQZPPBFCXUCTTD-SNVBAGLBSA-N	0	0	286.202	4.179	20	30		CIEDRN
Cc1ccc(Cl)c(NCc2cc(C#N)ccc2F)c1	ZINC000230213060	333315699	/nfs/dbraw/zinc/31/56/99/333315699.db2.gz	KKBNASHJRRCMIN-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
C=CCc1ccccc1OCC(=O)Nc1cccc(C)c1C	ZINC000001284698	333318688	/nfs/dbraw/zinc/31/86/88/333318688.db2.gz	BUBVQKBNWBIPTH-UHFFFAOYSA-N	0	0	295.382	4.049	20	30		CIEDRN
Cc1cc(C#N)ccc1-c1nc([C@H]2CCC[C@@H](C)C2)no1	ZINC000230997656	333323584	/nfs/dbraw/zinc/32/35/84/333323584.db2.gz	LPLFOMZYLOQQLU-RISCZKNCSA-N	0	0	281.359	4.210	20	30		CIEDRN
Cc1cc(C#N)ccc1OCc1ccccc1C(F)(F)F	ZINC000523382163	333324893	/nfs/dbraw/zinc/32/48/93/333324893.db2.gz	DSKXLMFNDPEKNT-UHFFFAOYSA-N	0	0	291.272	4.465	20	30		CIEDRN
C[C@H](CC(F)(F)F)Nc1ccc(C(F)(F)F)c(C#N)c1	ZINC000231750231	333329037	/nfs/dbraw/zinc/32/90/37/333329037.db2.gz	MNWUSLPKZJDDAG-SSDOTTSWSA-N	0	0	296.214	4.330	20	30		CIEDRN
C[C@@H]1C[C@@H]1c1ccc(CNc2c(F)cc(C#N)cc2F)o1	ZINC000523478638	333329399	/nfs/dbraw/zinc/32/93/99/333329399.db2.gz	YSRHDAMDYDHCLO-SKDRFNHKSA-N	0	0	288.297	4.165	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1cccc(OCCC)c1	ZINC000523511358	333331476	/nfs/dbraw/zinc/33/14/76/333331476.db2.gz	CGQUJRSVLRTYMU-UHFFFAOYSA-N	0	0	289.419	4.294	20	30		CIEDRN
C=CCCCCCN(C)C(=O)N[C@H](CC)C(C)(C)C	ZINC000523523317	333332164	/nfs/dbraw/zinc/33/21/64/333332164.db2.gz	RZNLFMITMCPTTH-CQSZACIVSA-N	0	0	268.445	4.199	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Cc1coc2c1ccc(C)c2C	ZINC000301998060	333332904	/nfs/dbraw/zinc/33/29/04/333332904.db2.gz	OGVOEIMCQBTMGV-UHFFFAOYSA-N	0	0	285.387	4.017	20	30		CIEDRN
CC(C)(C)CCCNC(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000523558207	333333123	/nfs/dbraw/zinc/33/31/23/333333123.db2.gz	VKLQEIZAOAVXDI-UHFFFAOYSA-N	0	0	293.798	4.159	20	30		CIEDRN
C[C@@H](C#N)N[C@H](CC1CCCCC1)c1ccccc1	ZINC000523624671	333334370	/nfs/dbraw/zinc/33/43/70/333334370.db2.gz	VWDPBXSIDFOGJO-WMLDXEAASA-N	0	0	256.393	4.200	20	30		CIEDRN
CC(C)(C#N)CCCCOc1cc(Cl)ccc1C#N	ZINC000232518863	333337823	/nfs/dbraw/zinc/33/78/23/333337823.db2.gz	XSSTWQRUJXIKCL-UHFFFAOYSA-N	0	0	276.767	4.311	20	30		CIEDRN
CC(C)(C#N)CCCCOc1c(F)c(F)cc(F)c1F	ZINC000232518404	333337839	/nfs/dbraw/zinc/33/78/39/333337839.db2.gz	AKAVGGFBKSGVLO-UHFFFAOYSA-N	0	0	289.272	4.342	20	30		CIEDRN
CC(C)(C#N)CCCC[S@@](=O)Cc1ccc(Cl)cc1	ZINC000232525995	333337947	/nfs/dbraw/zinc/33/79/47/333337947.db2.gz	HTMDJLXFARTYGG-LJQANCHMSA-N	0	0	297.851	4.309	20	30		CIEDRN
CC(C)(C#N)CCCC[S@@](=O)Cc1ccccc1Cl	ZINC000232526007	333338008	/nfs/dbraw/zinc/33/80/08/333338008.db2.gz	YWGRYWWWFIZTAL-LJQANCHMSA-N	0	0	297.851	4.309	20	30		CIEDRN
N#Cc1cc(Cl)ccc1N[C@H]1CCc2cc(F)ccc21	ZINC000303164629	333338415	/nfs/dbraw/zinc/33/84/15/333338415.db2.gz	FUGIJEZJPKWCLP-INIZCTEOSA-N	0	0	286.737	4.450	20	30		CIEDRN
CC(=O)c1ccc(OCCCCC(C)(C)C#N)c(F)c1	ZINC000232566541	333338895	/nfs/dbraw/zinc/33/88/95/333338895.db2.gz	HYKDMHFUCQMAML-UHFFFAOYSA-N	0	0	277.339	4.127	20	30		CIEDRN
C=CCOc1cccc(NC(=O)C[C@@H](CC)C(C)C)c1	ZINC000303283388	333339445	/nfs/dbraw/zinc/33/94/45/333339445.db2.gz	VDZHYHNDSDBROA-CQSZACIVSA-N	0	0	275.392	4.262	20	30		CIEDRN
CC(C)Oc1ccc(Nc2nccc(C#N)c2Cl)cc1	ZINC000232706032	333340671	/nfs/dbraw/zinc/34/06/71/333340671.db2.gz	KUEGSKQJHHMUGY-UHFFFAOYSA-N	0	0	287.750	4.137	20	30		CIEDRN
N#Cc1cccc(Cl)c1NCc1cccc(Cl)c1	ZINC000303483549	333342782	/nfs/dbraw/zinc/34/27/82/333342782.db2.gz	OWENQESKEQFKKM-UHFFFAOYSA-N	0	0	277.154	4.477	20	30		CIEDRN
Cc1ccccc1[C@H]1C[C@@H](C)N(c2ccc(C#N)cc2F)C1	ZINC000303768399	333346084	/nfs/dbraw/zinc/34/60/84/333346084.db2.gz	IYRLNIXQAPHEDP-ZBFHGGJFSA-N	0	0	294.373	4.388	20	30		CIEDRN
C=CCCC(=O)N[C@@H](c1ccc(Cl)cc1)C(C)C	ZINC000523953847	333349909	/nfs/dbraw/zinc/34/99/09/333349909.db2.gz	YFMCLUFXGQRXRQ-OAHLLOKOSA-N	0	0	265.784	4.120	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@@H](c1ccccc1)C(C)(C)C	ZINC000523986500	333350785	/nfs/dbraw/zinc/35/07/85/333350785.db2.gz	FHCPDRXFUIZCBZ-HIFRSBDPSA-N	0	0	274.408	4.038	20	30		CIEDRN
C[C@@H](Sc1ccc(C#N)cc1)c1ccc(C#N)cc1	ZINC000524025491	333351895	/nfs/dbraw/zinc/35/18/95/333351895.db2.gz	NDIUNMLFYYRYOU-GFCCVEGCSA-N	0	0	264.353	4.283	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1cccc(Cl)c1OC(C)C	ZINC000524030899	333352106	/nfs/dbraw/zinc/35/21/06/333352106.db2.gz	NQOCGXJNEULFIV-LLVKDONJSA-N	0	0	296.798	4.213	20	30		CIEDRN
COc1cc(CNc2ccc(C)cc2Cl)ccc1C#N	ZINC000234903710	333362914	/nfs/dbraw/zinc/36/29/14/333362914.db2.gz	OONBKUSSKKPCCC-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
Cc1ccc([C@@H](C)Nc2nccc(C#N)c2Cl)cc1F	ZINC000235285207	333367329	/nfs/dbraw/zinc/36/73/29/333367329.db2.gz	IVZBRWONIGUNBQ-SNVBAGLBSA-N	0	0	289.741	4.227	20	30		CIEDRN
C=C1CCN([C@@H](CC)c2ccc(F)cc2F)CC1	ZINC000524597838	333368201	/nfs/dbraw/zinc/36/82/01/333368201.db2.gz	SSVIVLRRTGTMGF-HNNXBMFYSA-N	0	0	251.320	4.068	20	30		CIEDRN
C[C@@H]1Cc2ccccc2N1CCCCC(C)(C)C#N	ZINC000235405963	333369175	/nfs/dbraw/zinc/36/91/75/333369175.db2.gz	UAFVXGJYOFSCQO-CQSZACIVSA-N	0	0	256.393	4.158	20	30		CIEDRN
Cc1ccccc1[C@H](C)Nc1nccc(C#N)c1Cl	ZINC000235538961	333370752	/nfs/dbraw/zinc/37/07/52/333370752.db2.gz	YZSQWKLXIUDISJ-NSHDSACASA-N	0	0	271.751	4.088	20	30		CIEDRN
C=CCN(C(=O)Nc1ccc(OC(C)(C)C)cc1)C1CC1	ZINC000537906574	333379378	/nfs/dbraw/zinc/37/93/78/333379378.db2.gz	SRDLWCWRQAFQPU-UHFFFAOYSA-N	0	0	288.391	4.046	20	30		CIEDRN
C=CCc1ccccc1OCCOc1ccccc1C(C)=O	ZINC000315637667	333382697	/nfs/dbraw/zinc/38/26/97/333382697.db2.gz	VNEBKVUJOZTWGA-UHFFFAOYSA-N	0	0	296.366	4.076	20	30		CIEDRN
N#Cc1cc(NC(c2ccccc2)c2ccccc2)ccn1	ZINC000315749600	333383411	/nfs/dbraw/zinc/38/34/11/333383411.db2.gz	RISUYSFSPFJIKE-UHFFFAOYSA-N	0	0	285.350	4.155	20	30		CIEDRN
CCCC1CCC(Nc2c(C#N)nnc3ccccc32)CC1	ZINC000315875920	333384125	/nfs/dbraw/zinc/38/41/25/333384125.db2.gz	ARDUPZOLZVMSOM-UHFFFAOYSA-N	0	0	294.402	4.272	20	30		CIEDRN
Cc1cc(C)c(CNc2ccc([N+](=O)[O-])cc2C#N)c(C)c1	ZINC000315924549	333384709	/nfs/dbraw/zinc/38/47/09/333384709.db2.gz	UOMZHSFZCILOEY-UHFFFAOYSA-N	0	0	295.342	4.004	20	30		CIEDRN
C=CCCCNc1cc(Cl)ccc1OC[C@@H]1CCCO1	ZINC000524842582	333390080	/nfs/dbraw/zinc/39/00/80/333390080.db2.gz	BWHRQQOLNUQCSM-AWEZNQCLSA-N	0	0	295.810	4.276	20	30		CIEDRN
CC(C)C[C@H](C(=O)Nc1cccc(C#N)c1)c1ccccc1	ZINC000524854569	333390721	/nfs/dbraw/zinc/39/07/21/333390721.db2.gz	YUYMOUGZPUZKMF-SFHVURJKSA-N	0	0	292.382	4.327	20	30		CIEDRN
C[C@@H](Sc1ccc(C#N)cc1F)c1ccc(C#N)cc1	ZINC000525117635	333398943	/nfs/dbraw/zinc/39/89/43/333398943.db2.gz	VNSKNGOIJMUWQW-LLVKDONJSA-N	0	0	282.343	4.422	20	30		CIEDRN
COc1cc(C#N)ccc1OCCSc1ccc(C)cc1	ZINC000525334712	333409516	/nfs/dbraw/zinc/40/95/16/333409516.db2.gz	GWZAUYPCZCDVQO-UHFFFAOYSA-N	0	0	299.395	4.046	20	30		CIEDRN
CC(C)(CC(=O)N1CCC(CC#N)CC1)C1CCCCC1	ZINC000526013237	333418920	/nfs/dbraw/zinc/41/89/20/333418920.db2.gz	KRUIYGXZHBJBNP-UHFFFAOYSA-N	0	0	290.451	4.135	20	30		CIEDRN
Cc1ccc2sc(CN3CCCC(C)(C)[C@H]3C#N)nc2c1	ZINC000528474911	333440228	/nfs/dbraw/zinc/44/02/28/333440228.db2.gz	JBLUWHKZDFSGOR-OAHLLOKOSA-N	0	0	299.443	4.119	20	30		CIEDRN
N#Cc1cc(NCc2cc(F)ccc2F)ccc1Cl	ZINC000036972818	333445654	/nfs/dbraw/zinc/44/56/54/333445654.db2.gz	PXRGNNAWIYGTFP-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
Cc1ccccc1CN(C)c1ccc(C#N)c(Cl)c1	ZINC000061850947	333449743	/nfs/dbraw/zinc/44/97/43/333449743.db2.gz	ROIXUAKVVBLENK-UHFFFAOYSA-N	0	0	270.763	4.157	20	30		CIEDRN
C[C@H](Nc1ccc(CC#N)cc1)c1ccc2c(c1)CCC2	ZINC000037071217	333472212	/nfs/dbraw/zinc/47/22/12/333472212.db2.gz	XFQXIJAPJVAPOD-AWEZNQCLSA-N	0	0	276.383	4.414	20	30		CIEDRN
C=CC[C@H]1N(C(=O)C[C@@H](C)c2ccco2)CCCC1(C)C	ZINC000529182179	333476320	/nfs/dbraw/zinc/47/63/20/333476320.db2.gz	DGDDQNGSFSNGQM-GDBMZVCRSA-N	0	0	289.419	4.367	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)[C@@H]2CCCC23CC3)CCCC1(C)C	ZINC000529189739	333476429	/nfs/dbraw/zinc/47/64/29/333476429.db2.gz	XMTHPGURCGOJLD-GJZGRUSLSA-N	0	0	275.436	4.160	20	30		CIEDRN
CCC(C#N)(CC)C(=O)Nc1ccc(C2CCC2)cc1	ZINC000529201220	333476960	/nfs/dbraw/zinc/47/69/60/333476960.db2.gz	QAPDOOAQVZKTQY-UHFFFAOYSA-N	0	0	270.376	4.223	20	30		CIEDRN
N#Cc1cccc(OCCSc2ccc(F)cc2F)c1	ZINC000037143776	333500962	/nfs/dbraw/zinc/50/09/62/333500962.db2.gz	FPLBAGVTCHLZFA-UHFFFAOYSA-N	0	0	291.322	4.008	20	30		CIEDRN
CC1(C)COc2cc(NC3CCC(C)(C#N)CC3)ccc21	ZINC000529643878	333503329	/nfs/dbraw/zinc/50/33/29/333503329.db2.gz	VUOWWAVXNOLUMP-UHFFFAOYSA-N	0	0	284.403	4.241	20	30		CIEDRN
Cc1cccc(N[C@H](C)c2cccc(C#N)c2)c1C	ZINC000037215735	333515803	/nfs/dbraw/zinc/51/58/03/333515803.db2.gz	QCVCZPIHMYVJGS-CQSZACIVSA-N	0	0	250.345	4.348	20	30		CIEDRN
C[C@H]1CCC[C@H](Nc2c(C#N)cnc3ccccc32)C1	ZINC000037413225	333532852	/nfs/dbraw/zinc/53/28/52/333532852.db2.gz	IHIUBPYWUSJFAP-JSGCOSHPSA-N	0	0	265.360	4.097	20	30		CIEDRN
C=CCSc1ccccc1NC(=O)CNc1ccccc1	ZINC000037495163	333533926	/nfs/dbraw/zinc/53/39/26/333533926.db2.gz	WLBQDWFXZRFZEJ-UHFFFAOYSA-N	0	0	298.411	4.015	20	30		CIEDRN
C[C@@H](N[C@@H](C)c1c(F)cccc1F)c1ccc(C#N)cc1	ZINC000037508437	333534541	/nfs/dbraw/zinc/53/45/41/333534541.db2.gz	MIPDMRNZDZICGS-NEPJUHHUSA-N	0	0	286.325	4.248	20	30		CIEDRN
CO[C@@H](C)c1cccc(N[C@@H](C)c2ccc(C#N)cc2)c1	ZINC000174043165	335147068	/nfs/dbraw/zinc/14/70/68/335147068.db2.gz	AMCQFYUNQAXMEJ-KBPBESRZSA-N	0	0	280.371	4.439	20	30		CIEDRN
COc1cc(NCCCC(C)(C)C#N)c(C)cc1C	ZINC000530372812	333545508	/nfs/dbraw/zinc/54/55/08/333545508.db2.gz	IBHRFBLUKGUICB-UHFFFAOYSA-N	0	0	260.381	4.054	20	30		CIEDRN
CO[C@@H](C)c1cccc(N[C@H](C)c2ccc(C#N)cc2)c1	ZINC000174043176	335147186	/nfs/dbraw/zinc/14/71/86/335147186.db2.gz	AMCQFYUNQAXMEJ-KGLIPLIRSA-N	0	0	280.371	4.439	20	30		CIEDRN
N#Cc1cc(CNc2cc(F)ccc2Cl)ccc1F	ZINC000124374038	333558521	/nfs/dbraw/zinc/55/85/21/333558521.db2.gz	WEGPEVLTQALQPM-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1cc(OC)ccc1F)c1ccccc1	ZINC000125486278	333567044	/nfs/dbraw/zinc/56/70/44/333567044.db2.gz	OJJSGOBGOYXAJM-CYBMUJFWSA-N	0	0	299.345	4.133	20	30		CIEDRN
C=C(CC)CSCC(=O)Nc1cc(Cl)ccc1F	ZINC000537993394	333569896	/nfs/dbraw/zinc/56/98/96/333569896.db2.gz	UQPVRZCCUDECBC-UHFFFAOYSA-N	0	0	287.787	4.117	20	30		CIEDRN
C=CCCOCCCCC(=O)N[C@H]1CCCC[C@@H]1C(C)C	ZINC000538295006	333583701	/nfs/dbraw/zinc/58/37/01/333583701.db2.gz	ZUDKYMDYKBQIEV-SJORKVTESA-N	0	0	295.467	4.080	20	30		CIEDRN
C=CCCOCCCCC(=O)N[C@@H]1CCCC[C@H]1C(C)C	ZINC000538294996	333583765	/nfs/dbraw/zinc/58/37/65/333583765.db2.gz	ZUDKYMDYKBQIEV-DLBZAZTESA-N	0	0	295.467	4.080	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)CCSc1ccc(F)cc1	ZINC000538333533	333585254	/nfs/dbraw/zinc/58/52/54/333585254.db2.gz	FXEQSHHENCWYFX-ZDUSSCGKSA-N	0	0	295.423	4.169	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)CC/C=C\c1ccccc1	ZINC000538326159	333585531	/nfs/dbraw/zinc/58/55/31/333585531.db2.gz	NKLOFPMDIJCZOQ-IHWMJMDHSA-N	0	0	271.404	4.341	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1ccccc1SC	ZINC000538339432	333586070	/nfs/dbraw/zinc/58/60/70/333586070.db2.gz	DXXATDKFNBRXFB-LBPRGKRZSA-N	0	0	278.421	4.275	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1cc(C)ccc1C	ZINC000538338870	333586107	/nfs/dbraw/zinc/58/61/07/333586107.db2.gz	HCWCDIRJJOQDAA-AWEZNQCLSA-N	0	0	260.381	4.170	20	30		CIEDRN
N#CCc1ccc(NC(=O)c2cccc(C3CCC3)c2)cc1	ZINC000538404592	333588993	/nfs/dbraw/zinc/58/89/93/333588993.db2.gz	JNSHMPDMRLKELD-UHFFFAOYSA-N	0	0	290.366	4.272	20	30		CIEDRN
CC[C@H](C#N)Sc1nnc(-c2cccc3ccccc32)o1	ZINC000127754618	333635574	/nfs/dbraw/zinc/63/55/74/333635574.db2.gz	YUHCNVLUTMKISD-GFCCVEGCSA-N	0	0	295.367	4.284	20	30		CIEDRN
CC[C@H](C)N(Cc1ccccc1)C(=O)c1sccc1C#N	ZINC000128011075	333640109	/nfs/dbraw/zinc/64/01/09/333640109.db2.gz	PQYKZEXGEDBGOL-ZDUSSCGKSA-N	0	0	298.411	4.061	20	30		CIEDRN
C=CCN(C(=O)N[C@@H](CC)c1ccc(Cl)cc1)C1CC1	ZINC000538955848	333646473	/nfs/dbraw/zinc/64/64/73/333646473.db2.gz	KKQHNRUJMKAIKF-HNNXBMFYSA-N	0	0	292.810	4.151	20	30		CIEDRN
C=C(CC)CSCCC(=O)Nc1ccccc1Cl	ZINC000539094706	333657747	/nfs/dbraw/zinc/65/77/47/333657747.db2.gz	CMBMBNOAUHEDKE-UHFFFAOYSA-N	0	0	283.824	4.368	20	30		CIEDRN
C=CCCC[C@@H](C)Sc1nncn1-c1ccccc1	ZINC000539274763	333663708	/nfs/dbraw/zinc/66/37/08/333663708.db2.gz	DKYVAUXDIUWOGG-CYBMUJFWSA-N	0	0	273.405	4.104	20	30		CIEDRN
C[C@H](NCc1c(F)cccc1Cl)c1cccc(C#N)c1	ZINC000539500217	333674730	/nfs/dbraw/zinc/67/47/30/333674730.db2.gz	UWJFMMPZCPTCLN-NSHDSACASA-N	0	0	288.753	4.202	20	30		CIEDRN
CC(C)[C@H](NCc1ccc(C#N)o1)c1ccccc1Cl	ZINC000174398692	335153671	/nfs/dbraw/zinc/15/36/71/335153671.db2.gz	LUOMAYNGMSOXET-INIZCTEOSA-N	0	0	288.778	4.292	20	30		CIEDRN
C[C@@H](C#N)CN(Cc1c(Cl)oc2ccccc21)C1CC1	ZINC000539864101	333699850	/nfs/dbraw/zinc/69/98/50/333699850.db2.gz	YESACZBAPFGRPR-NSHDSACASA-N	0	0	288.778	4.210	20	30		CIEDRN
C=CCN(C(=O)Nc1ccc(CCCC)cc1)C1CC1	ZINC000540064697	333707915	/nfs/dbraw/zinc/70/79/15/333707915.db2.gz	BKNPQTDNMZRRST-UHFFFAOYSA-N	0	0	272.392	4.212	20	30		CIEDRN
C=C(CC)CS[C@H](C)c1cn(-c2ccccc2)nn1	ZINC000540194068	333720266	/nfs/dbraw/zinc/72/02/66/333720266.db2.gz	ZNSKNXLLECSQQE-CYBMUJFWSA-N	0	0	273.405	4.028	20	30		CIEDRN
C=C(CC)CNc1cccc(C(=O)N(C)c2ccccc2)c1	ZINC000540201404	333720853	/nfs/dbraw/zinc/72/08/53/333720853.db2.gz	BGFSVYDITHLYEN-UHFFFAOYSA-N	0	0	294.398	4.341	20	30		CIEDRN
N#Cc1ccc(Oc2ccc(NC(=O)C3CCC3)cc2)cc1	ZINC000068824811	333732886	/nfs/dbraw/zinc/73/28/86/333732886.db2.gz	BGWVIFHDKREEED-UHFFFAOYSA-N	0	0	292.338	4.089	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1cc(Cl)ccc1C	ZINC000540533676	333734216	/nfs/dbraw/zinc/73/42/16/333734216.db2.gz	YDMFGAMSAGCATD-GFCCVEGCSA-N	0	0	265.784	4.123	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)CCCc1sccc1C	ZINC000540534343	333734291	/nfs/dbraw/zinc/73/42/91/333734291.db2.gz	JCZOEWPAZMWZJJ-CQSZACIVSA-N	0	0	279.449	4.240	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1ccc(C)cc1F	ZINC000540535864	333734440	/nfs/dbraw/zinc/73/44/40/333734440.db2.gz	LHXQTBNHABBCCY-LBPRGKRZSA-N	0	0	264.344	4.000	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1ccc(C)cc1F	ZINC000540535859	333734487	/nfs/dbraw/zinc/73/44/87/333734487.db2.gz	LHXQTBNHABBCCY-GFCCVEGCSA-N	0	0	264.344	4.000	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)C[C@@H](CC)c1ccccc1	ZINC000540540168	333734688	/nfs/dbraw/zinc/73/46/88/333734688.db2.gz	SLRNZORMNMNKLA-HZPDHXFCSA-N	0	0	273.420	4.431	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1cc(F)ccc1Cl	ZINC000540555310	333735066	/nfs/dbraw/zinc/73/50/66/333735066.db2.gz	RRSOCYGJSLELDN-JTQLQIEISA-N	0	0	284.762	4.345	20	30		CIEDRN
C=CCC[C@H](NC(=O)N1CC[C@H]1C(C)C)c1ccccc1	ZINC000540583297	333735985	/nfs/dbraw/zinc/73/59/85/333735985.db2.gz	AVLMZSBVVRWGMM-IRXDYDNUSA-N	0	0	286.419	4.134	20	30		CIEDRN
N#CC1(CSCc2ccc3ccccc3c2)CC1	ZINC000540619052	333738628	/nfs/dbraw/zinc/73/86/28/333738628.db2.gz	UGSAMBCITTZILQ-UHFFFAOYSA-N	0	0	253.370	4.377	20	30		CIEDRN
CCCC[C@H](CC)CNC(=O)c1ccc(C2(C#N)CC2)cc1	ZINC000540691447	333741943	/nfs/dbraw/zinc/74/19/43/333741943.db2.gz	FFEZHFHJTYZRFL-HNNXBMFYSA-N	0	0	298.430	4.188	20	30		CIEDRN
C[C@@H]1CCC[C@H](Nc2cc(C#N)c3ccccc3n2)C1	ZINC000069052351	333750548	/nfs/dbraw/zinc/75/05/48/333750548.db2.gz	PQHRRTOQFRRPBA-OCCSQVGLSA-N	0	0	265.360	4.097	20	30		CIEDRN
CC(C)Oc1ccc(F)cc1NCc1cc(C#N)cs1	ZINC000129191617	333752482	/nfs/dbraw/zinc/75/24/82/333752482.db2.gz	BGAJNLMVUHFEMP-UHFFFAOYSA-N	0	0	290.363	4.158	20	30		CIEDRN
C=C(C)CS[C@@H](C)c1nc(-c2ccc(OC)cc2)no1	ZINC000129357123	333756829	/nfs/dbraw/zinc/75/68/29/333756829.db2.gz	XWDYRFXVIDBLRG-NSHDSACASA-N	0	0	290.388	4.116	20	30		CIEDRN
Cc1ccnc(N2CCC[C@@H](c3ccccc3)CC2)c1C#N	ZINC000541277312	333769344	/nfs/dbraw/zinc/76/93/44/333769344.db2.gz	GQMLUZCOZYECSE-QGZVFWFLSA-N	0	0	291.398	4.036	20	30		CIEDRN
N#Cc1cccc(CNc2ccccc2OCC2CC2)c1F	ZINC000541293904	333770824	/nfs/dbraw/zinc/77/08/24/333770824.db2.gz	DFFLUYZNARYAGN-UHFFFAOYSA-N	0	0	296.345	4.098	20	30		CIEDRN
Cc1ccc([C@H](C)NC(=O)Nc2cc(C#N)ccc2C)cc1	ZINC000069606561	333776434	/nfs/dbraw/zinc/77/64/34/333776434.db2.gz	ZGZCMDRQNKRBMP-AWEZNQCLSA-N	0	0	293.370	4.058	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Cc1cc2c(ccc3ccccc23)o1	ZINC000129561624	333776796	/nfs/dbraw/zinc/77/67/96/333776796.db2.gz	CYOYUPVVOMNCIA-CYBMUJFWSA-N	0	0	293.366	4.209	20	30		CIEDRN
C=CCC[C@H](C)Nc1ccccc1OC[C@@H]1CCCCO1	ZINC000541774709	333791928	/nfs/dbraw/zinc/79/19/28/333791928.db2.gz	YVBGMEOKOBASIZ-HOTGVXAUSA-N	0	0	289.419	4.401	20	30		CIEDRN
C/C(=C\c1cccc(C(F)(F)F)c1)CN(C)C[C@@H](C)C#N	ZINC000576147933	335160436	/nfs/dbraw/zinc/16/04/36/335160436.db2.gz	SOSNXXSNBARWOI-WHGQRRHOSA-N	0	0	296.336	4.200	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cc(F)ccc1OC(C)C	ZINC000130191863	333822815	/nfs/dbraw/zinc/82/28/15/333822815.db2.gz	QJIFCBKFHMXGFP-UHFFFAOYSA-N	0	0	291.366	4.320	20	30		CIEDRN
C=CCCCC(=O)NC1CCC(c2ccc(F)cc2)CC1	ZINC000542862435	333846050	/nfs/dbraw/zinc/84/60/50/333846050.db2.gz	YKAMMESXFCRACP-UHFFFAOYSA-N	0	0	289.394	4.324	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1ccn(Cc2ccccc2)c1	ZINC000542869276	333846523	/nfs/dbraw/zinc/84/65/23/333846523.db2.gz	UDIDXDILCDVAOB-MRXNPFEDSA-N	0	0	296.414	4.011	20	30		CIEDRN
C[C@@H]1CCC[C@@H]1Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000071209377	333848854	/nfs/dbraw/zinc/84/88/54/333848854.db2.gz	GFHASAAOIBOKQY-RNCFNFMXSA-N	0	0	268.282	4.178	20	30		CIEDRN
Cc1cc(C#N)ccc1OCc1csc(C(C)C)n1	ZINC000130588436	333854417	/nfs/dbraw/zinc/85/44/17/333854417.db2.gz	SXIMRFWQNOGXSV-UHFFFAOYSA-N	0	0	272.373	4.026	20	30		CIEDRN
N#CCC[C@@H](NCc1ccccc1Cl)c1ccccc1	ZINC000130604404	333857428	/nfs/dbraw/zinc/85/74/28/333857428.db2.gz	JTHNEXAJWGPZEP-QGZVFWFLSA-N	0	0	284.790	4.475	20	30		CIEDRN
Cc1c(Cl)cnc(N2C[C@H](C)[C@@H]2c2ccccc2)c1C#N	ZINC000543133907	333859709	/nfs/dbraw/zinc/85/97/09/333859709.db2.gz	MHFYSJWQABQZRU-MEDUHNTESA-N	0	0	297.789	4.113	20	30		CIEDRN
CCCOc1cc(C)ccc1NCc1ccc(CC#N)cc1	ZINC000543164939	333862011	/nfs/dbraw/zinc/86/20/11/333862011.db2.gz	FDHSFENODUAGGP-UHFFFAOYSA-N	0	0	294.398	4.462	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1ccc(F)cc1OC)c1ccccc1	ZINC000131111670	333903109	/nfs/dbraw/zinc/90/31/09/333903109.db2.gz	SSVWMPINNRVOBZ-CYBMUJFWSA-N	0	0	299.345	4.133	20	30		CIEDRN
N#Cc1c(Cl)cccc1S[C@@H]1Cc2ccccc2C1=O	ZINC000543958533	333906906	/nfs/dbraw/zinc/90/69/06/333906906.db2.gz	OELFATHGTDDSFA-OAHLLOKOSA-N	0	0	299.782	4.111	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N[C@@H](C)c1cccc(C)c1C	ZINC000544009459	333909811	/nfs/dbraw/zinc/90/98/11/333909811.db2.gz	GJJUKWXGRDRULA-LSDHHAIUSA-N	0	0	274.408	4.018	20	30		CIEDRN
N#Cc1nc(N2CCCC[C@@H]2c2ccccc2)ccc1Cl	ZINC000544022992	333910795	/nfs/dbraw/zinc/91/07/95/333910795.db2.gz	ALMMQMKQUFUSSV-MRXNPFEDSA-N	0	0	297.789	4.338	20	30		CIEDRN
Cc1cccc([C@H](C)Nc2nccc(C)c2C#N)c1C	ZINC000544143394	333918675	/nfs/dbraw/zinc/91/86/75/333918675.db2.gz	KFVLLXUJZKJPCH-AWEZNQCLSA-N	0	0	265.360	4.052	20	30		CIEDRN
CCN(C(=O)c1ccc(Cl)c(C#N)c1)c1cccc(C)c1	ZINC000544403007	333929399	/nfs/dbraw/zinc/92/93/99/333929399.db2.gz	PBGGPNAZDNASSE-UHFFFAOYSA-N	0	0	298.773	4.187	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N[C@H](C)c1c(C)cccc1C	ZINC000544435182	333931303	/nfs/dbraw/zinc/93/13/03/333931303.db2.gz	LCYCDIYENYHALI-CABCVRRESA-N	0	0	274.408	4.018	20	30		CIEDRN
CC(C)(C#N)c1ccccc1CNc1ccc(F)cc1	ZINC000131401442	333934050	/nfs/dbraw/zinc/93/40/50/333934050.db2.gz	YVKINPLTUXWHMO-UHFFFAOYSA-N	0	0	268.335	4.239	20	30		CIEDRN
CC(C)(C#N)c1ccccc1CNc1cc(F)ccc1F	ZINC000131447911	333940807	/nfs/dbraw/zinc/94/08/07/333940807.db2.gz	HYPYAVJAEYMOPY-UHFFFAOYSA-N	0	0	286.325	4.378	20	30		CIEDRN
CCOCCSCc1ccc(-c2ccccc2C#N)cc1	ZINC000544643693	333942129	/nfs/dbraw/zinc/94/21/29/333942129.db2.gz	PSKIWNGBLSHZRU-UHFFFAOYSA-N	0	0	297.423	4.495	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(CCC)Cc1ccc(C)cc1	ZINC000545245424	333973120	/nfs/dbraw/zinc/97/31/20/333973120.db2.gz	MCCYXHTWPOLIBC-QGZVFWFLSA-N	0	0	288.435	4.271	20	30		CIEDRN
Cc1cccc(C)c1[C@@H](C)NC(=O)Nc1ccc(C#N)cc1	ZINC000545472323	333983897	/nfs/dbraw/zinc/98/38/97/333983897.db2.gz	TUYZBVVMKZRKMX-CQSZACIVSA-N	0	0	293.370	4.058	20	30		CIEDRN
C=C[C@H](Cc1nc(CCC(F)(F)F)no1)c1ccccc1	ZINC000545579640	333989455	/nfs/dbraw/zinc/98/94/55/333989455.db2.gz	DNKNTMLWILMTQB-LLVKDONJSA-N	0	0	296.292	4.077	20	30		CIEDRN
CCC(CC)c1noc(/C=C\c2cccc(C#N)c2)n1	ZINC000545669495	333994065	/nfs/dbraw/zinc/99/40/65/333994065.db2.gz	SUTGYHJEPGCYIZ-HJWRWDBZSA-N	0	0	267.332	4.015	20	30		CIEDRN
Cc1ccc([C@H](C)c2noc(C3(C#N)CCCCC3)n2)cc1	ZINC000545674344	333994242	/nfs/dbraw/zinc/99/42/42/333994242.db2.gz	ALWPTVQPHKCHBO-AWEZNQCLSA-N	0	0	295.386	4.255	20	30		CIEDRN
CC[C@H](CC#N)NCc1ccc(-c2cccc(F)c2C)o1	ZINC000545871220	334003295	/nfs/dbraw/zinc/00/32/95/334003295.db2.gz	GBUHMGOXOKPIBW-CYBMUJFWSA-N	0	0	286.350	4.176	20	30		CIEDRN
C[C@@H](CC1CCCCC1)C(=O)N(C)Cc1cccc(C#N)c1	ZINC000074435927	334005900	/nfs/dbraw/zinc/00/59/00/334005900.db2.gz	FIXHLFUJJLGPHY-HNNXBMFYSA-N	0	0	298.430	4.123	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CCC)Cc1ccc(C)cc1	ZINC000545923668	334006496	/nfs/dbraw/zinc/00/64/96/334006496.db2.gz	LFTDKSGIUFCPPH-MRXNPFEDSA-N	0	0	273.420	4.336	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CCC)Cc1ccc(C)cc1	ZINC000545923667	334006543	/nfs/dbraw/zinc/00/65/43/334006543.db2.gz	LFTDKSGIUFCPPH-INIZCTEOSA-N	0	0	273.420	4.336	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccc2nc(C)sc2c1	ZINC000132885597	334009134	/nfs/dbraw/zinc/00/91/34/334009134.db2.gz	MSFPLQYNUOYYHW-UHFFFAOYSA-N	0	0	289.404	4.035	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)c1ccc(C(C)C)s1	ZINC000546184032	334018862	/nfs/dbraw/zinc/01/88/62/334018862.db2.gz	KBXMQIMVGSIHAQ-UHFFFAOYSA-N	0	0	292.448	4.464	20	30		CIEDRN
CC(C)c1ccc(C(=O)N(C)c2ccccc2C#N)s1	ZINC000546184340	334018973	/nfs/dbraw/zinc/01/89/73/334018973.db2.gz	RABQNSWQBFTWQW-UHFFFAOYSA-N	0	0	284.384	4.020	20	30		CIEDRN
C=CCn1c(SCC2CCC(C)CC2)nnc1C1CC1	ZINC000546190990	334019091	/nfs/dbraw/zinc/01/90/91/334019091.db2.gz	SFBQYQHJXUHDMY-UHFFFAOYSA-N	0	0	291.464	4.260	20	30		CIEDRN
Cc1cccc(C)c1[C@H](C)NCc1ccc(F)cc1C#N	ZINC000546227797	334020857	/nfs/dbraw/zinc/02/08/57/334020857.db2.gz	APTJKOCLFCLLRF-AWEZNQCLSA-N	0	0	282.362	4.165	20	30		CIEDRN
C=CCCCc1nc([C@@H]2CCCc3ccccc32)no1	ZINC000546289659	334025344	/nfs/dbraw/zinc/02/53/44/334025344.db2.gz	XZBNQMIZNBJVEJ-OAHLLOKOSA-N	0	0	268.360	4.047	20	30		CIEDRN
C=CCC(CC=C)c1nc(-c2ccccc2F)no1	ZINC000546303583	334026364	/nfs/dbraw/zinc/02/63/64/334026364.db2.gz	QSQDQMHHKUIJBA-UHFFFAOYSA-N	0	0	258.296	4.112	20	30		CIEDRN
C=CCC(CC=C)c1nc(Cc2c(F)cccc2F)no1	ZINC000546315804	334027129	/nfs/dbraw/zinc/02/71/29/334027129.db2.gz	BZXOXIPJYFZMHC-UHFFFAOYSA-N	0	0	290.313	4.174	20	30		CIEDRN
C=CCCOCCCCc1nc([C@H]2CCCC[C@H]2C)no1	ZINC000546396787	334030691	/nfs/dbraw/zinc/03/06/91/334030691.db2.gz	ZAPOICHEWNEFPM-CABCVRRESA-N	0	0	292.423	4.279	20	30		CIEDRN
C=CCC(CC=C)c1nc([C@@H](C)Oc2ccccc2)no1	ZINC000546430468	334032247	/nfs/dbraw/zinc/03/22/47/334032247.db2.gz	YCWPFPLRDVSHIJ-CYBMUJFWSA-N	0	0	284.359	4.445	20	30		CIEDRN
C=CCC(CC=C)c1nc(-c2ccc(N(C)C)cc2C)no1	ZINC000546435111	334032568	/nfs/dbraw/zinc/03/25/68/334032568.db2.gz	LYIDPQPPQKDPAW-UHFFFAOYSA-N	0	0	297.402	4.347	20	30		CIEDRN
C=CCCCc1nc(-c2ccc3nc(C)sc3c2)no1	ZINC000546448912	334033154	/nfs/dbraw/zinc/03/31/54/334033154.db2.gz	UXBUZMKQFWSJFK-UHFFFAOYSA-N	0	0	285.372	4.163	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cnc(-c2ccccc2)s1	ZINC000546632462	334042339	/nfs/dbraw/zinc/04/23/39/334042339.db2.gz	XWARMMXKSWLCCX-LBPRGKRZSA-N	0	0	286.400	4.351	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2cccc(Cl)c2)no1	ZINC000546638586	334042702	/nfs/dbraw/zinc/04/27/02/334042702.db2.gz	CCFKRFSOKQNXTB-JTQLQIEISA-N	0	0	262.740	4.460	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(CCCc2ccccc2)no1	ZINC000546639592	334042953	/nfs/dbraw/zinc/04/29/53/334042953.db2.gz	QWQLMIQFMNLIAD-AWEZNQCLSA-N	0	0	270.376	4.315	20	30		CIEDRN
N#Cc1ccccc1SCc1ccc2ncccc2c1	ZINC000546728110	334048467	/nfs/dbraw/zinc/04/84/67/334048467.db2.gz	SOHSWBILOXNWJI-UHFFFAOYSA-N	0	0	276.364	4.399	20	30		CIEDRN
C=CCC[C@@H](NC(=O)CCCCSC)c1ccccc1	ZINC000133718103	334051205	/nfs/dbraw/zinc/05/12/05/334051205.db2.gz	USDZHFCHPKNDMQ-MRXNPFEDSA-N	0	0	291.460	4.343	20	30		CIEDRN
CC[C@H](CC(F)(F)F)Nc1ncc(Cl)c(C)c1C#N	ZINC000546887448	334053972	/nfs/dbraw/zinc/05/39/72/334053972.db2.gz	LVDZJSFFMDUXGW-MRVPVSSYSA-N	0	0	291.704	4.058	20	30		CIEDRN
C=CCC(CC=C)c1nc(-c2cccc(C)c2)no1	ZINC000546937017	334056643	/nfs/dbraw/zinc/05/66/43/334056643.db2.gz	MQKBXYMYCPRIHG-UHFFFAOYSA-N	0	0	254.333	4.281	20	30		CIEDRN
Cc1cccc(-c2noc(/C=C/c3ccc(C#N)cc3)n2)c1	ZINC000546939064	334057086	/nfs/dbraw/zinc/05/70/86/334057086.db2.gz	LDWVEIXMNXNNMC-MDZDMXLPSA-N	0	0	287.322	4.087	20	30		CIEDRN
C=CCC[C@@H](NC(=O)c1occc1C)c1ccccc1	ZINC000133842516	334063447	/nfs/dbraw/zinc/06/34/47/334063447.db2.gz	XRRIUQVFFVYLLG-OAHLLOKOSA-N	0	0	269.344	4.025	20	30		CIEDRN
C=CCCO[C@@H](C)c1nc([C@H](C)c2ccc(C)cc2)no1	ZINC000547087440	334065858	/nfs/dbraw/zinc/06/58/58/334065858.db2.gz	BUQANBLRWLTACP-KGLIPLIRSA-N	0	0	286.375	4.184	20	30		CIEDRN
C[C@@H]1CCCC[C@H]1c1noc(-c2ccc(CC#N)cc2)n1	ZINC000547108083	334067077	/nfs/dbraw/zinc/06/70/77/334067077.db2.gz	WVVSYCARXZCKFJ-IUODEOHRSA-N	0	0	281.359	4.096	20	30		CIEDRN
C[C@@H](c1noc(-c2ccc(C3(C#N)CC3)cc2)n1)C(C)(C)C	ZINC000547142839	334069023	/nfs/dbraw/zinc/06/90/23/334069023.db2.gz	GNVYJDVNMAGQPO-LBPRGKRZSA-N	0	0	295.386	4.441	20	30		CIEDRN
C[C@@H](Cc1noc(C2(C#N)CCCCC2)n1)c1ccccc1	ZINC000547166934	334070409	/nfs/dbraw/zinc/07/04/09/334070409.db2.gz	JJBCPQNGJPWJFT-AWEZNQCLSA-N	0	0	295.386	4.141	20	30		CIEDRN
C=CCC[C@H](NC(=O)[C@@H]1CC=CCC1)c1ccccc1	ZINC000133948305	334074315	/nfs/dbraw/zinc/07/43/15/334074315.db2.gz	WBIODYUPGOZWSH-SJORKVTESA-N	0	0	269.388	4.166	20	30		CIEDRN
Cc1ccccc1[C@@H](C)c1noc(-c2ccc(C#N)cc2)n1	ZINC000547249380	334075025	/nfs/dbraw/zinc/07/50/25/334075025.db2.gz	NIWWVJQXBPLDKJ-CYBMUJFWSA-N	0	0	289.338	4.069	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](C)c1ccccc1OC(C)C	ZINC000547337497	334080843	/nfs/dbraw/zinc/08/08/43/334080843.db2.gz	BZBSFWZUHGVRGE-CABCVRRESA-N	0	0	289.419	4.253	20	30		CIEDRN
CC(C)(C)c1nc(COc2ccc(C#N)cc2F)cs1	ZINC000134298868	334087282	/nfs/dbraw/zinc/08/72/82/334087282.db2.gz	KEKXOIOWKIVDLH-UHFFFAOYSA-N	0	0	290.363	4.030	20	30		CIEDRN
C=CCOc1cccc(NC(=O)C2=CCCCCC2)c1	ZINC000547512193	334096878	/nfs/dbraw/zinc/09/68/78/334096878.db2.gz	OHKJNLHUDPCWAU-UHFFFAOYSA-N	0	0	271.360	4.080	20	30		CIEDRN
C=CCCCNc1ccccc1NC(=O)C[C@@H]1C=CCC1	ZINC000077245985	334099670	/nfs/dbraw/zinc/09/96/70/334099670.db2.gz	MZLPPBYETXKRBM-OAHLLOKOSA-N	0	0	284.403	4.360	20	30		CIEDRN
C=CCCCNc1ccccc1NC(=O)C[C@H]1C=CCC1	ZINC000077245984	334099819	/nfs/dbraw/zinc/09/98/19/334099819.db2.gz	MZLPPBYETXKRBM-HNNXBMFYSA-N	0	0	284.403	4.360	20	30		CIEDRN
N#CCc1ccc(NCc2ccccc2OCC2CC2)cc1	ZINC000237834683	334100117	/nfs/dbraw/zinc/10/01/17/334100117.db2.gz	QHRVDUYLJCGZJU-UHFFFAOYSA-N	0	0	292.382	4.154	20	30		CIEDRN
N#Cc1cccc(CNc2ccccc2OC2CCCC2)c1	ZINC000237847766	334100561	/nfs/dbraw/zinc/10/05/61/334100561.db2.gz	NZFHBXXZFPRRDT-UHFFFAOYSA-N	0	0	292.382	4.492	20	30		CIEDRN
N#Cc1ccc(Cl)cc1N[C@@H]1CCc2cc(F)ccc21	ZINC000134825517	334105307	/nfs/dbraw/zinc/10/53/07/334105307.db2.gz	FBMOGMPAYNQQNC-OAHLLOKOSA-N	0	0	286.737	4.450	20	30		CIEDRN
Cc1ccnc(NCc2cccc3ccccc32)c1C#N	ZINC000135075106	334114511	/nfs/dbraw/zinc/11/45/11/334114511.db2.gz	UHKLWNMDHVUTLJ-UHFFFAOYSA-N	0	0	273.339	4.027	20	30		CIEDRN
N#Cc1ccccc1COc1ccc(OC(F)(F)F)cc1	ZINC000135121354	334116578	/nfs/dbraw/zinc/11/65/78/334116578.db2.gz	IMDPZXOMEWAZEL-UHFFFAOYSA-N	0	0	293.244	4.036	20	30		CIEDRN
CCCN(CC#N)C(=O)C[C@H](C)c1ccc(C(C)C)cc1	ZINC000078082798	334123563	/nfs/dbraw/zinc/12/35/63/334123563.db2.gz	DDFAEXOLLNJEPF-HNNXBMFYSA-N	0	0	286.419	4.066	20	30		CIEDRN
CC(C)(C#N)CCCOc1ccc(OC(F)(F)F)cc1	ZINC000135508462	334131993	/nfs/dbraw/zinc/13/19/93/334131993.db2.gz	PXKLUVZGWKUHCD-UHFFFAOYSA-N	0	0	287.281	4.294	20	30		CIEDRN
C=CCCC(=O)NC(C)(c1ccccc1)c1ccccc1	ZINC000078418246	334133318	/nfs/dbraw/zinc/13/33/18/334133318.db2.gz	YPQRZYKZBQEXEJ-UHFFFAOYSA-N	0	0	279.383	4.033	20	30		CIEDRN
C=CCCC(=O)NCc1ccccc1Oc1ccc(C)cc1	ZINC000078547746	334135908	/nfs/dbraw/zinc/13/59/08/334135908.db2.gz	NNNJDPKAZHMYNB-UHFFFAOYSA-N	0	0	295.382	4.370	20	30		CIEDRN
CC(C)CC[C@H](C)Nc1nc(C(F)(F)F)ccc1C#N	ZINC000078834775	334141265	/nfs/dbraw/zinc/14/12/65/334141265.db2.gz	CQUZQYDIYGJJFH-JTQLQIEISA-N	0	0	285.313	4.209	20	30		CIEDRN
CC(C)N(Cc1ccccn1)Cc1ccc(Cl)cc1C#N	ZINC000548156775	334143471	/nfs/dbraw/zinc/14/34/71/334143471.db2.gz	KXVVPRWKODOVKA-UHFFFAOYSA-N	0	0	299.805	4.017	20	30		CIEDRN
CC(C)Oc1ccc(NC(=O)C2=CCCCCC2)cc1C#N	ZINC000548164542	334144221	/nfs/dbraw/zinc/14/42/21/334144221.db2.gz	UDJMHTHCRCXJGJ-UHFFFAOYSA-N	0	0	298.386	4.174	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CCC(C(C)C)CC1)c1ccccc1	ZINC000136040178	334144847	/nfs/dbraw/zinc/14/48/47/334144847.db2.gz	BABAWZCHADRUFG-INIZCTEOSA-N	0	0	285.431	4.241	20	30		CIEDRN
CCC(=O)Nc1ccc(N[C@@H](C)c2ccc(C#N)cc2)cc1	ZINC000078990108	334145048	/nfs/dbraw/zinc/14/50/48/334145048.db2.gz	RJVXSBXCFLAENR-ZDUSSCGKSA-N	0	0	293.370	4.080	20	30		CIEDRN
N#Cc1ccccc1CNC1(c2ccc(F)cc2F)CCC1	ZINC000136135907	334147684	/nfs/dbraw/zinc/14/76/84/334147684.db2.gz	RPVHFODVJSJQEK-UHFFFAOYSA-N	0	0	298.336	4.005	20	30		CIEDRN
COc1cccc(S[C@H](C#N)Cc2ccc(C)cc2)c1	ZINC000079134288	334148600	/nfs/dbraw/zinc/14/86/00/334148600.db2.gz	INNUSJFMNKEBSY-KRWDZBQOSA-N	0	0	283.396	4.231	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)CCCc2ccccc2)s1	ZINC000079263892	334151033	/nfs/dbraw/zinc/15/10/33/334151033.db2.gz	OQSOCVHVBYJJSB-UHFFFAOYSA-N	0	0	298.411	4.144	20	30		CIEDRN
C=C[C@@H](Cc1nc(Cc2ccccc2)no1)c1ccccc1	ZINC000136293498	334151416	/nfs/dbraw/zinc/15/14/16/334151416.db2.gz	WXYQHKRLUFOMAJ-INIZCTEOSA-N	0	0	290.366	4.173	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1ncc(CC)s1)c1ccccc1	ZINC000136355804	334152668	/nfs/dbraw/zinc/15/26/68/334152668.db2.gz	NIXPYCAXTYFMLG-LBPRGKRZSA-N	0	0	286.400	4.004	20	30		CIEDRN
CCC(CC)(CC)NC(=O)c1cccc(SCC#N)c1	ZINC000079529920	334156510	/nfs/dbraw/zinc/15/65/10/334156510.db2.gz	AYNJXDZOBMWKCA-UHFFFAOYSA-N	0	0	290.432	4.001	20	30		CIEDRN
N#Cc1cnccc1N1Cc2ccccc2-c2ccccc2C1	ZINC000548480203	334159471	/nfs/dbraw/zinc/15/94/71/334159471.db2.gz	XXMLOBHBAPUGKO-UHFFFAOYSA-N	0	0	297.361	4.140	20	30		CIEDRN
N#Cc1cnccc1Oc1ccc(OC2CCCCC2)cc1	ZINC000548480478	334159486	/nfs/dbraw/zinc/15/94/86/334159486.db2.gz	JYNDCCPYRXLGAJ-UHFFFAOYSA-N	0	0	294.354	4.457	20	30		CIEDRN
C=CCSc1ccccc1C(=O)NC1CCCCC1	ZINC000548587473	334163058	/nfs/dbraw/zinc/16/30/58/334163058.db2.gz	TXFHPJCLCSZRFG-UHFFFAOYSA-N	0	0	275.417	4.027	20	30		CIEDRN
C=C(C)CNC(=O)Nc1ccc2oc3ccccc3c2c1	ZINC000548652160	334165205	/nfs/dbraw/zinc/16/52/05/334165205.db2.gz	UAROWGBLSNGKLQ-UHFFFAOYSA-N	0	0	280.327	4.284	20	30		CIEDRN
CC(C)c1ccc(CN(CC#N)C2CCCC2)cc1	ZINC000080215824	334167818	/nfs/dbraw/zinc/16/78/18/334167818.db2.gz	SOQDNEPFKWPQIQ-UHFFFAOYSA-N	0	0	256.393	4.078	20	30		CIEDRN
C=CCCCN(C)C(=O)c1cc2cc(C)c(C)cc2o1	ZINC000080388319	334171129	/nfs/dbraw/zinc/17/11/29/334171129.db2.gz	JPXIXUWXRCLEAO-UHFFFAOYSA-N	0	0	271.360	4.088	20	30		CIEDRN
Cc1cc(NC(=O)C2(C#N)CCCC2)ccc1C(F)(F)F	ZINC000175325934	335180128	/nfs/dbraw/zinc/18/01/28/335180128.db2.gz	LKPYPHNZHDRTHP-UHFFFAOYSA-N	0	0	296.292	4.036	20	30		CIEDRN
Cc1cc(SCCCSCC#N)nc2ccccc12	ZINC000080708765	334173022	/nfs/dbraw/zinc/17/30/22/334173022.db2.gz	JUJJLIDIWNIWOL-UHFFFAOYSA-N	0	0	288.441	4.282	20	30		CIEDRN
CC(C)CCc1ccccc1NC(=O)CC(C)(C)C#N	ZINC000548776315	334173656	/nfs/dbraw/zinc/17/36/56/334173656.db2.gz	YHDVYKHMGORSDX-UHFFFAOYSA-N	0	0	272.392	4.154	20	30		CIEDRN
Cc1ccc(C(C)(C)C)cc1SCCOCCC#N	ZINC000549300736	334189671	/nfs/dbraw/zinc/18/96/71/334189671.db2.gz	VZCWRMOCTMZZDI-UHFFFAOYSA-N	0	0	277.433	4.315	20	30		CIEDRN
CC(C)COc1ccc(CNc2ccccc2C#N)cc1	ZINC000549528082	334196306	/nfs/dbraw/zinc/19/63/06/334196306.db2.gz	SCTAVKRQLDUMEK-UHFFFAOYSA-N	0	0	280.371	4.205	20	30		CIEDRN
C=C[C@@H](CC(=O)N(C)Cc1sccc1C)c1ccccc1	ZINC000549573293	334198384	/nfs/dbraw/zinc/19/83/84/334198384.db2.gz	ZYPMHRDMYRLZMX-HNNXBMFYSA-N	0	0	299.439	4.375	20	30		CIEDRN
Cc1ccc(C#N)c(NCCc2cc3ccccc3s2)n1	ZINC000549618970	334199734	/nfs/dbraw/zinc/19/97/34/334199734.db2.gz	XZFSBDYRKWDRND-UHFFFAOYSA-N	0	0	293.395	4.131	20	30		CIEDRN
CC(C)(C)c1ccc(C(=O)Nc2ccccc2CC#N)cc1	ZINC000549692275	334201896	/nfs/dbraw/zinc/20/18/96/334201896.db2.gz	GEHLTIGORQFJGL-UHFFFAOYSA-N	0	0	292.382	4.302	20	30		CIEDRN
CO[C@H](CSCc1ccc(CC#N)cc1)c1ccccc1	ZINC000549953730	334210183	/nfs/dbraw/zinc/21/01/83/334210183.db2.gz	YQTASWVXYBJHPO-GOSISDBHSA-N	0	0	297.423	4.374	20	30		CIEDRN
C[C@H](CC(=O)Nc1ccccc1CC#N)c1cccc(F)c1	ZINC000550100040	334213136	/nfs/dbraw/zinc/21/31/36/334213136.db2.gz	GRLPCMVQUPDFTP-CYBMUJFWSA-N	0	0	296.345	4.024	20	30		CIEDRN
C[C@@H](C#N)SC(c1ccccc1)c1ccccc1	ZINC000081970904	334215446	/nfs/dbraw/zinc/21/54/46/334215446.db2.gz	WTTYWIWVWGVSJN-ZDUSSCGKSA-N	0	0	253.370	4.421	20	30		CIEDRN
CC[C@@H](CC(=O)N[C@](C)(C#N)C1CCCCC1)C(C)C	ZINC000550351466	334220757	/nfs/dbraw/zinc/22/07/57/334220757.db2.gz	LLCVIFXHSGXLMT-WMLDXEAASA-N	0	0	278.440	4.037	20	30		CIEDRN
N#Cc1ccccc1NC(=O)[C@@H]1CC[C@H]2CCCC[C@H]2C1	ZINC000245876420	334222611	/nfs/dbraw/zinc/22/26/11/334222611.db2.gz	HEJNTYMNJFELBP-QLFBSQMISA-N	0	0	282.387	4.103	20	30		CIEDRN
CCSc1ccccc1OCc1ccc(OC)c(C#N)c1	ZINC000550462197	334223009	/nfs/dbraw/zinc/22/30/09/334223009.db2.gz	POACEAHULVNKHK-UHFFFAOYSA-N	0	0	299.395	4.258	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@H]1C[C@H]1c1ccccc1)c1ccccc1	ZINC000550492166	334223435	/nfs/dbraw/zinc/22/34/35/334223435.db2.gz	XRKOTECKXYIIIR-MNEFBYGVSA-N	0	0	291.394	4.019	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CC[C@H](c2ccc(Cl)cc2)C1	ZINC000550629524	334225571	/nfs/dbraw/zinc/22/55/71/334225571.db2.gz	SXMVUHSEDZIQPD-AWEZNQCLSA-N	0	0	291.822	4.258	20	30		CIEDRN
C=C1CCN(C(=O)[C@@H](CCc2ccccc2)C(C)C)CC1	ZINC000550721168	334227834	/nfs/dbraw/zinc/22/78/34/334227834.db2.gz	JVLHVTVUTZNZGT-SFHVURJKSA-N	0	0	285.431	4.070	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CCC[C@H](C(C)(C)C)CC1	ZINC000550829784	334229657	/nfs/dbraw/zinc/22/96/57/334229657.db2.gz	LBBZEGKLGNIJEZ-AWEZNQCLSA-N	0	0	265.441	4.264	20	30		CIEDRN
C=CC1CCN(C(=O)[C@H](CCc2ccccc2)C(C)C)CC1	ZINC000550961769	334234988	/nfs/dbraw/zinc/23/49/88/334234988.db2.gz	JAXNLGCEFBSLQT-LJQANCHMSA-N	0	0	299.458	4.316	20	30		CIEDRN
C=CCc1ccccc1OCc1ccc(C(F)(F)F)cn1	ZINC000550990582	334235622	/nfs/dbraw/zinc/23/56/22/334235622.db2.gz	ZFTLOJWMUDDXFB-UHFFFAOYSA-N	0	0	293.288	4.408	20	30		CIEDRN
C=CCn1c(SCCC(C)(C)C)nnc1-c1ccco1	ZINC000551059877	334237523	/nfs/dbraw/zinc/23/75/23/334237523.db2.gz	UZYGMSJBVRXJRH-UHFFFAOYSA-N	0	0	291.420	4.252	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H]2C[C@H]2c2ccc(F)cc2)n1	ZINC000551136918	334239273	/nfs/dbraw/zinc/23/92/73/334239273.db2.gz	RSSXCTAJGHCZDJ-KBPBESRZSA-N	0	0	286.350	4.334	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ccc(OC)c(C3CC3)c2)n1	ZINC000551139844	334239332	/nfs/dbraw/zinc/23/93/32/334239332.db2.gz	IVRKVKSNRKZRSW-UHFFFAOYSA-N	0	0	298.386	4.476	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H](C)Cc2ccccc2F)n1	ZINC000551140133	334239453	/nfs/dbraw/zinc/23/94/53/334239453.db2.gz	PPEUYBVFDMYXHC-LBPRGKRZSA-N	0	0	288.366	4.409	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ccc(OC)c(Cl)c2)n1	ZINC000551141859	334239466	/nfs/dbraw/zinc/23/94/66/334239466.db2.gz	BEDOTLAESHGTLE-UHFFFAOYSA-N	0	0	292.766	4.252	20	30		CIEDRN
C=CCC(F)(F)c1nc([C@H]2CCCC[C@@H]2CC)no1	ZINC000551182706	334240156	/nfs/dbraw/zinc/24/01/56/334240156.db2.gz	JHVMXNUPVOTCFC-QWRGUYRKSA-N	0	0	270.323	4.421	20	30		CIEDRN
CC[C@H]1CCCC[C@@H]1c1noc(-c2cc(C#N)oc2C)n1	ZINC000551184163	334240283	/nfs/dbraw/zinc/24/02/83/334240283.db2.gz	FOGZFAAQJLUCNP-AAEUAGOBSA-N	0	0	285.347	4.194	20	30		CIEDRN
C[C@H](SCCCCCF)c1ccc(C#N)cc1	ZINC000551372939	334248106	/nfs/dbraw/zinc/24/81/06/334248106.db2.gz	AGMXWXHWCOOJKF-LBPRGKRZSA-N	0	0	251.370	4.492	20	30		CIEDRN
C=CCC(F)(F)c1nc(-c2cc(Cl)ccc2C)no1	ZINC000551368970	334248165	/nfs/dbraw/zinc/24/81/65/334248165.db2.gz	DPFNXDUDHRUEGP-UHFFFAOYSA-N	0	0	284.693	4.366	20	30		CIEDRN
N#Cc1ccc(F)cc1CSCCCCCF	ZINC000551373507	334248225	/nfs/dbraw/zinc/24/82/25/334248225.db2.gz	XVLQGMSVNYOPKI-UHFFFAOYSA-N	0	0	255.333	4.070	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H](C)c2ccc(F)c(F)c2)n1	ZINC000551493721	334251600	/nfs/dbraw/zinc/25/16/00/334251600.db2.gz	KAYBQEGVDMXRMT-SNVBAGLBSA-N	0	0	292.329	4.353	20	30		CIEDRN
C=CCC(C)(C)c1noc(C2(C(F)F)CCCC2)n1	ZINC000551498016	334251751	/nfs/dbraw/zinc/25/17/51/334251751.db2.gz	LAZBIPQIPXFCFV-UHFFFAOYSA-N	0	0	270.323	4.000	20	30		CIEDRN
CC(C)N(CCC#N)Cc1ccc(C2CCC2)cc1	ZINC000551947614	334267395	/nfs/dbraw/zinc/26/73/95/334267395.db2.gz	TZSLNZKLHHYIEK-UHFFFAOYSA-N	0	0	256.393	4.078	20	30		CIEDRN
Cc1cc(NC(=O)c2cscc2C#N)ccc1C1CC1	ZINC000551965530	334268064	/nfs/dbraw/zinc/26/80/64/334268064.db2.gz	XWCKJEDVCQWLTG-UHFFFAOYSA-N	0	0	282.368	4.058	20	30		CIEDRN
CC(C)[C@H]1CC[C@H]1Nc1cccc(OCCCC#N)c1	ZINC000552061976	334283596	/nfs/dbraw/zinc/28/35/96/334283596.db2.gz	HVGAVDKONIWQQJ-IAGOWNOFSA-N	0	0	272.392	4.216	20	30		CIEDRN
C=CCC[C@@H](Nc1cccc(C(=O)NCC)c1)c1ccco1	ZINC000552070472	334285493	/nfs/dbraw/zinc/28/54/93/334285493.db2.gz	RBXDICUKIYCVBO-MRXNPFEDSA-N	0	0	298.386	4.149	20	30		CIEDRN
C=CC[C@H](C)NC(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1Cl	ZINC000247583431	334286429	/nfs/dbraw/zinc/28/64/29/334286429.db2.gz	YZXDXBAVSGRQOM-ZMLRMANQSA-N	0	0	298.213	4.178	20	30		CIEDRN
CCc1ccc(NC(=O)c2cc(C#N)ccc2Cl)cc1C	ZINC000552139537	334294222	/nfs/dbraw/zinc/29/42/22/334294222.db2.gz	KOURNIDEJMLHMM-UHFFFAOYSA-N	0	0	298.773	4.335	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CC[C@@H](C(C)(C)C)C[C@H]1C	ZINC000552195956	334301435	/nfs/dbraw/zinc/30/14/35/334301435.db2.gz	IRUNBCWGIBPBTR-ZIAGYGMSSA-N	0	0	265.441	4.262	20	30		CIEDRN
CC(C)(C)C[C@H](N[C@@H]1CCC[C@@H](C#N)C1)C(F)(F)F	ZINC000248890021	334321013	/nfs/dbraw/zinc/32/10/13/334321013.db2.gz	SOMBRTNGWMAXAV-UTUOFQBUSA-N	0	0	276.346	4.025	20	30		CIEDRN
C[C@H](CCC(C)(C)C)C(=O)NC1(c2cccc(C#N)c2)CC1	ZINC000552471380	334329963	/nfs/dbraw/zinc/32/99/63/334329963.db2.gz	NIVMGEDUBYRFSH-CQSZACIVSA-N	0	0	298.430	4.126	20	30		CIEDRN
C=CCC(CC=C)C(=O)NC[C@@H]1CCCCC(F)(F)C1	ZINC000552653238	334341203	/nfs/dbraw/zinc/34/12/03/334341203.db2.gz	RMYZJKIXPRLIAK-CYBMUJFWSA-N	0	0	285.378	4.087	20	30		CIEDRN
Cc1nsc(N[C@H]2CCC[C@H]2c2ccccc2)c1C#N	ZINC000553058650	334359316	/nfs/dbraw/zinc/35/93/16/334359316.db2.gz	HWRGRZHLRVVMQX-ZFWWWQNUSA-N	0	0	283.400	4.071	20	30		CIEDRN
N#Cc1cc(N2Cc3ccccc3-c3ccccc3C2)ccn1	ZINC000553379104	334381335	/nfs/dbraw/zinc/38/13/35/334381335.db2.gz	RGJLHSBULMETHH-UHFFFAOYSA-N	0	0	297.361	4.140	20	30		CIEDRN
C[C@@H](Nc1cc(C#N)ccn1)c1cccc(Cl)c1Cl	ZINC000553433463	334384733	/nfs/dbraw/zinc/38/47/33/334384733.db2.gz	CEKQRFYUZKHTMN-SECBINFHSA-N	0	0	292.169	4.433	20	30		CIEDRN
C=CC[C@H](C)NC(=O)CCCCCO[C@@H]1CCC[C@H](C)C1	ZINC000163005695	334390736	/nfs/dbraw/zinc/39/07/36/334390736.db2.gz	KDLBDBXNYSMSKW-YESZJQIVSA-N	0	0	295.467	4.223	20	30		CIEDRN
Cc1c2ccccc2oc1[C@H](C)Nc1cc(C#N)ccn1	ZINC000553583297	334392875	/nfs/dbraw/zinc/39/28/75/334392875.db2.gz	QMSOLFJEUSFDPY-LBPRGKRZSA-N	0	0	277.327	4.181	20	30		CIEDRN
N#Cc1c(F)cccc1N1CC[C@@H]1c1ccc(Cl)cc1	ZINC000553604788	334393305	/nfs/dbraw/zinc/39/33/05/334393305.db2.gz	YZDCEADXIWQGBE-OAHLLOKOSA-N	0	0	286.737	4.302	20	30		CIEDRN
Cc1cc(Oc2nc(C(C)C)ns2)c(C)c(C)c1C#N	ZINC000553727822	334396390	/nfs/dbraw/zinc/39/63/90/334396390.db2.gz	KFJIAURYKSCCFO-UHFFFAOYSA-N	0	0	287.388	4.251	20	30		CIEDRN
C[C@@H]1C[C@H](c2ccccc2)N(c2ccc(C#N)cc2)C1	ZINC000553729192	334397337	/nfs/dbraw/zinc/39/73/37/334397337.db2.gz	WXSGDMCWYWCGED-RDTXWAMCSA-N	0	0	262.356	4.146	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1c(C)cc(OC)c(C)c1C	ZINC000553736509	334397526	/nfs/dbraw/zinc/39/75/26/334397526.db2.gz	YYZKABOTONSXOX-GFCCVEGCSA-N	0	0	275.392	4.161	20	30		CIEDRN
Cc1cc(C#N)ccc1OCc1ncc(Cl)cc1Cl	ZINC000553821127	334399652	/nfs/dbraw/zinc/39/96/52/334399652.db2.gz	HZVPPPCWHCMOBX-UHFFFAOYSA-N	0	0	293.153	4.148	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](c2ccc(CC)cc2)C1	ZINC000554155043	334414651	/nfs/dbraw/zinc/41/46/51/334414651.db2.gz	FXISDXXHWZMVBE-HKUYNNGSSA-N	0	0	285.431	4.167	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)NCc1ccc(C2CCCCC2)cc1	ZINC000554359941	334424004	/nfs/dbraw/zinc/42/40/04/334424004.db2.gz	YBWXNTXMZXAERO-IBGZPJMESA-N	0	0	298.430	4.290	20	30		CIEDRN
Cc1sc(NC(=O)[C@@H](C)Cc2ccccc2)c(C#N)c1C	ZINC000554674790	334445913	/nfs/dbraw/zinc/44/59/13/334445913.db2.gz	CJXOAMABOVWLLH-NSHDSACASA-N	0	0	298.411	4.054	20	30		CIEDRN
C[C@H](CC(C)(C)C)C(=O)Nc1cc(C#N)c2ccccc2n1	ZINC000554776210	334451649	/nfs/dbraw/zinc/45/16/49/334451649.db2.gz	UCRCQTPXLWYMNB-GFCCVEGCSA-N	0	0	295.386	4.117	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2cc(OC3CCC3)ccn2)no1	ZINC000554806227	334453607	/nfs/dbraw/zinc/45/36/07/334453607.db2.gz	CTQNTJGHHMJMQK-LBPRGKRZSA-N	0	0	299.374	4.133	20	30		CIEDRN
Cc1ccc2ncc(C#N)c(N3CC[C@@H](CC4CC4)C3)c2c1	ZINC000555247722	334472973	/nfs/dbraw/zinc/47/29/73/334472973.db2.gz	HPAYEOUBJVUOMB-HNNXBMFYSA-N	0	0	291.398	4.041	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCc1ccc(-c2ccccc2)o1	ZINC000555905480	334491899	/nfs/dbraw/zinc/49/18/99/334491899.db2.gz	IJHKNPWZOBFUAD-UHFFFAOYSA-N	0	0	283.371	4.165	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1cc(Cl)ccc1OC(C)C	ZINC000564688685	334516544	/nfs/dbraw/zinc/51/65/44/334516544.db2.gz	ASKSZFBSQFWVMV-LLVKDONJSA-N	0	0	296.798	4.213	20	30		CIEDRN
CC[C@@H](CC1CCCC1)C(=O)N1CCC(CCC#N)CC1	ZINC000565020788	334535004	/nfs/dbraw/zinc/53/50/04/334535004.db2.gz	OIVOHHRDZZJGFA-KRWDZBQOSA-N	0	0	290.451	4.135	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCCC[C@@H]1CC(C)C	ZINC000153212077	334571064	/nfs/dbraw/zinc/57/10/64/334571064.db2.gz	ZMPMDZDVBWVNLT-MRXNPFEDSA-N	0	0	263.425	4.182	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1cc(Cl)c(F)cc1Cl	ZINC000565763410	334594723	/nfs/dbraw/zinc/59/47/23/334594723.db2.gz	UAHQSOYYWMNIMA-UHFFFAOYSA-N	0	0	290.165	4.171	20	30		CIEDRN
Cc1csc(NC(=O)CCc2cc(C)cc(C)c2)c1C#N	ZINC000565685644	334587448	/nfs/dbraw/zinc/58/74/48/334587448.db2.gz	VUUQHKHCGXOQAZ-UHFFFAOYSA-N	0	0	298.411	4.116	20	30		CIEDRN
C=CCC1(c2nc(-c3ccc4[nH]ccc4c3)no2)CCC1	ZINC000565740894	334593218	/nfs/dbraw/zinc/59/32/18/334593218.db2.gz	UUARCKBVJKLSER-UHFFFAOYSA-N	0	0	279.343	4.216	20	30		CIEDRN
N#Cc1cccc(N2CCCC[C@H]2c2cccc(Cl)c2)n1	ZINC000565865213	334604094	/nfs/dbraw/zinc/60/40/94/334604094.db2.gz	JPRKDIXSPDWEPN-INIZCTEOSA-N	0	0	297.789	4.338	20	30		CIEDRN
Cc1cc(Cl)c2ncc(C#N)c(N3CCCCC3)c2c1	ZINC000565880711	334605385	/nfs/dbraw/zinc/60/53/85/334605385.db2.gz	VOHLZNGQULDHSK-UHFFFAOYSA-N	0	0	285.778	4.059	20	30		CIEDRN
C[C@@H](CC(=O)N[C@](C)(C#N)C1CCCCC1)c1ccccc1	ZINC000565911451	334608322	/nfs/dbraw/zinc/60/83/22/334608322.db2.gz	IXRQGJBUKIRSOE-HNAYVOBHSA-N	0	0	298.430	4.159	20	30		CIEDRN
C=C(C)CCc1noc(-c2ccccc2OCC2CC2)n1	ZINC000566002588	334615047	/nfs/dbraw/zinc/61/50/47/334615047.db2.gz	SIHCZXSQLFSMLU-UHFFFAOYSA-N	0	0	284.359	4.034	20	30		CIEDRN
N#Cc1c(N[C@@H]2CCC[C@@H](F)C2)cccc1C(F)F	ZINC000566483933	334651996	/nfs/dbraw/zinc/65/19/96/334651996.db2.gz	XZSHSWWUZRPPCJ-NXEZZACHSA-N	0	0	268.282	4.188	20	30		CIEDRN
CC1(C)C[C@H](CNc2cccc(C(F)F)c2C#N)CCO1	ZINC000566688483	334660537	/nfs/dbraw/zinc/66/05/37/334660537.db2.gz	AUEUJIMCNZVMAV-LLVKDONJSA-N	0	0	294.345	4.113	20	30		CIEDRN
C=C[C@](C)(CC)c1nc([C@H](C)c2cccs2)no1	ZINC000566940180	334670408	/nfs/dbraw/zinc/67/04/08/334670408.db2.gz	SHTHUCDSPJAPBU-QMTHXVAHSA-N	0	0	262.378	4.137	20	30		CIEDRN
CC#CCCCc1nc(-c2ccc3sccc3c2)no1	ZINC000566999026	334672534	/nfs/dbraw/zinc/67/25/34/334672534.db2.gz	LBMWHWFMGMODLE-UHFFFAOYSA-N	0	0	282.368	4.297	20	30		CIEDRN
Cc1ccccc1C(=O)Nc1cc(C(C)(C)C)sc1C#N	ZINC000154291024	334692049	/nfs/dbraw/zinc/69/20/49/334692049.db2.gz	GONZGOAGOPBNHW-UHFFFAOYSA-N	0	0	298.411	4.478	20	30		CIEDRN
C[C@@H](CC#N)Sc1ccccc1NC(=O)C1=CCCC1	ZINC000154335641	334692747	/nfs/dbraw/zinc/69/27/47/334692747.db2.gz	VDLCPUZOOBIVJU-LBPRGKRZSA-N	0	0	286.400	4.130	20	30		CIEDRN
N#Cc1ccc(CNc2cccnc2-c2ccccc2)s1	ZINC000567290446	334701235	/nfs/dbraw/zinc/70/12/35/334701235.db2.gz	GGMSWMXMPMXSOR-UHFFFAOYSA-N	0	0	291.379	4.294	20	30		CIEDRN
C=CCCSCC(=O)N(CC)[C@H](C)c1ccc(F)cc1	ZINC000154969904	334709449	/nfs/dbraw/zinc/70/94/49/334709449.db2.gz	CCNJHEVJLPGCOP-CYBMUJFWSA-N	0	0	295.423	4.045	20	30		CIEDRN
CC#CCCSc1nnc(-c2c(C)cc(C)cc2C)o1	ZINC000155290426	334718555	/nfs/dbraw/zinc/71/85/55/334718555.db2.gz	DLZBRFJNQLLONB-UHFFFAOYSA-N	0	0	286.400	4.167	20	30		CIEDRN
CC1(C#N)CCC(Nc2cccc3cc[nH]c32)CC1	ZINC000567440139	334718568	/nfs/dbraw/zinc/71/85/68/334718568.db2.gz	ONFZCVZKSCLIJP-UHFFFAOYSA-N	0	0	253.349	4.052	20	30		CIEDRN
C=C[C@@H](C)NC(=O)[C@@H](Sc1ccccc1)c1ccccc1	ZINC000155510565	334722676	/nfs/dbraw/zinc/72/26/76/334722676.db2.gz	NPQMUCLPCDAXBM-PBHICJAKSA-N	0	0	297.423	4.211	20	30		CIEDRN
Cc1ccccc1N(C(=O)c1ccc(C#N)cc1C)C(C)C	ZINC000156069761	334734228	/nfs/dbraw/zinc/73/42/28/334734228.db2.gz	GDUJFCKRVMLMHU-UHFFFAOYSA-N	0	0	292.382	4.230	20	30		CIEDRN
CCN(C(=O)C1CCCCC1)c1ccc(C#N)c(Cl)c1	ZINC000156532375	334743747	/nfs/dbraw/zinc/74/37/47/334743747.db2.gz	UWTREENKTHQGEW-UHFFFAOYSA-N	0	0	290.794	4.145	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)c1cccc(Cl)c1F	ZINC000157132499	334760471	/nfs/dbraw/zinc/76/04/71/334760471.db2.gz	QEGXZWVQCMGATQ-UHFFFAOYSA-N	0	0	296.773	4.071	20	30		CIEDRN
Cc1ccc(-c2ncco2)cc1NCc1cc(C#N)cs1	ZINC000157148960	334760869	/nfs/dbraw/zinc/76/08/69/334760869.db2.gz	LBCXXZMDVXDRIN-UHFFFAOYSA-N	0	0	295.367	4.195	20	30		CIEDRN
CC[C@H](C)CNc1ccccc1SC[C@H](C)C#N	ZINC000157817557	334784741	/nfs/dbraw/zinc/78/47/41/334784741.db2.gz	DWGHIEIVRCOLOQ-QWHCGFSZSA-N	0	0	262.422	4.396	20	30		CIEDRN
CCC(CC)C(=O)N[C@H](C#N)c1cccc(Cl)c1Cl	ZINC000157881860	334787046	/nfs/dbraw/zinc/78/70/46/334787046.db2.gz	LJYODVQDJXQIJL-GFCCVEGCSA-N	0	0	299.201	4.110	20	30		CIEDRN
CC[C@@H](CC(=O)N(CCC#N)CC1CC1)c1ccc(C)cc1	ZINC000158870717	334815445	/nfs/dbraw/zinc/81/54/45/334815445.db2.gz	VQJLXKIFZVAJME-KRWDZBQOSA-N	0	0	298.430	4.031	20	30		CIEDRN
CCC(CC)c1noc(-c2ccc(C#N)c(Cl)c2)n1	ZINC000568560493	334830463	/nfs/dbraw/zinc/83/04/63/334830463.db2.gz	BAAKQYCVTIXJAO-UHFFFAOYSA-N	0	0	275.739	4.165	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc([C@@H](C)c2cccs2)no1	ZINC000568813190	334841831	/nfs/dbraw/zinc/84/18/31/334841831.db2.gz	REIFGBMWMDCKKR-MNOVXSKESA-N	0	0	262.378	4.353	20	30		CIEDRN
C=CCOc1ccccc1-c1nc(-c2cccc(C)c2)no1	ZINC000568930076	334847405	/nfs/dbraw/zinc/84/74/05/334847405.db2.gz	RKJZDBRHSMLNKG-UHFFFAOYSA-N	0	0	292.338	4.277	20	30		CIEDRN
CC[C@@H]1CCCC[C@@H]1c1noc(C2(C#N)CCCCC2)n1	ZINC000569126357	334856776	/nfs/dbraw/zinc/85/67/76/334856776.db2.gz	IQKGSQXPWFWJHJ-KGLIPLIRSA-N	0	0	287.407	4.479	20	30		CIEDRN
CC1(C2CC2)CCN(c2cc(C#N)c3ccccc3n2)CC1	ZINC000569278997	334865369	/nfs/dbraw/zinc/86/53/69/334865369.db2.gz	OMZRASCMYIZCLM-UHFFFAOYSA-N	0	0	291.398	4.123	20	30		CIEDRN
N#Cc1ccc(NCCC2(F)CCC2)c(Br)c1	ZINC000572876022	334886919	/nfs/dbraw/zinc/88/69/19/334886919.db2.gz	MGLSTVVPPMXLFE-UHFFFAOYSA-N	0	0	297.171	4.015	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(Cc2ccc(F)cc2C)no1	ZINC000573247508	334921269	/nfs/dbraw/zinc/92/12/69/334921269.db2.gz	UBNAQHXGDAZCSD-GFCCVEGCSA-N	0	0	274.339	4.178	20	30		CIEDRN
C=CCCCC(=O)Nc1cccc(Cl)c1Cl	ZINC000175591942	335188549	/nfs/dbraw/zinc/18/85/49/335188549.db2.gz	FAKANQMNOMQMFY-UHFFFAOYSA-N	0	0	258.148	4.288	20	30		CIEDRN
C=CCCCNC(=O)Nc1c(F)cccc1SCC	ZINC000576390413	335197379	/nfs/dbraw/zinc/19/73/79/335197379.db2.gz	LQNVQLVRCVLOPO-UHFFFAOYSA-N	0	0	282.384	4.025	20	30		CIEDRN
CC1(C#N)CCC(Nc2ccc(-c3csnn3)cc2)CC1	ZINC000576430625	335202468	/nfs/dbraw/zinc/20/24/68/335202468.db2.gz	FQYSSBNTVKMTAH-UHFFFAOYSA-N	0	0	298.415	4.089	20	30		CIEDRN
CC(C)=CCNc1ccccc1SC[C@H](C)C#N	ZINC000576430084	335202512	/nfs/dbraw/zinc/20/25/12/335202512.db2.gz	IYPSNRBMVIWYKE-CYBMUJFWSA-N	0	0	260.406	4.316	20	30		CIEDRN
CC(C)(C)c1ccc(C[S@](=O)CCC(C)(C)C#N)cc1	ZINC000576760931	335244735	/nfs/dbraw/zinc/24/47/35/335244735.db2.gz	VIOQVVZICNKQDO-HXUWFJFHSA-N	0	0	291.460	4.173	20	30		CIEDRN
C=CCN(CC=C)C(=O)c1cscc1-c1ccccc1	ZINC000576868280	335257802	/nfs/dbraw/zinc/25/78/02/335257802.db2.gz	PXBXGSSSKIQPQT-UHFFFAOYSA-N	0	0	283.396	4.229	20	30		CIEDRN
C[C@H]1CC[C@@H](Nc2ccc(Oc3ccnc(C#N)c3)cc2)C1	ZINC000576991281	335274685	/nfs/dbraw/zinc/27/46/85/335274685.db2.gz	VTQRQZUWMPJYLJ-DZGCQCFKSA-N	0	0	293.370	4.346	20	30		CIEDRN
CN(c1ccc(C#N)cc1)[C@H]1CC[C@@H](C(F)(F)F)CC1	ZINC000577272772	335332911	/nfs/dbraw/zinc/33/29/11/335332911.db2.gz	SRDFACDSUWEHCZ-XBXGTLAGSA-N	0	0	282.309	4.116	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(-c2cc(C)ccc2F)no1	ZINC000577323828	335338840	/nfs/dbraw/zinc/33/88/40/335338840.db2.gz	MGCYXVMMCHOIRT-HNNXBMFYSA-N	0	0	260.312	4.038	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(-c2ccccc2COCC)no1	ZINC000577421157	335351141	/nfs/dbraw/zinc/35/11/41/335351141.db2.gz	LBMNIHCJXVSFPL-KRWDZBQOSA-N	0	0	286.375	4.127	20	30		CIEDRN
Cc1ccccc1NCc1ccc(C#N)cc1C(F)(F)F	ZINC000577433084	335351825	/nfs/dbraw/zinc/35/18/25/335351825.db2.gz	UZIIPHBRKKEZHO-UHFFFAOYSA-N	0	0	290.288	4.498	20	30		CIEDRN
N#Cc1csc(CNc2cccc(COCC3CC3)c2)c1	ZINC000177690934	335379296	/nfs/dbraw/zinc/37/92/96/335379296.db2.gz	ZLASNKICMXOGEV-UHFFFAOYSA-N	0	0	298.411	4.158	20	30		CIEDRN
N#Cc1csc(CNc2ccc(CC(F)(F)F)cc2)c1	ZINC000177705470	335380060	/nfs/dbraw/zinc/38/00/60/335380060.db2.gz	DBQFYYWDDCWGMW-UHFFFAOYSA-N	0	0	296.317	4.337	20	30		CIEDRN
CC[C@H](Nc1cccc(F)c1)c1ccc(C#N)cc1	ZINC000577695144	335389393	/nfs/dbraw/zinc/38/93/93/335389393.db2.gz	YRUIBQKZBFDBBZ-INIZCTEOSA-N	0	0	254.308	4.261	20	30		CIEDRN
C/C(=C/c1cccc(C(F)(F)F)c1)CN(CC#N)C1CC1	ZINC000577918262	335420424	/nfs/dbraw/zinc/42/04/24/335420424.db2.gz	MBCVKNXPMGFXEG-XFXZXTDPSA-N	0	0	294.320	4.097	20	30		CIEDRN
C=C[C@H](CC(=O)NC/C=C/c1ccccc1)c1ccccc1	ZINC000179427608	335493603	/nfs/dbraw/zinc/49/36/03/335493603.db2.gz	VYHIZOZMDKJANZ-ZPHJMFTNSA-N	0	0	291.394	4.176	20	30		CIEDRN
C=C(C)COc1cccc(N[C@@H](C)c2ccccn2)c1	ZINC000179623592	335504520	/nfs/dbraw/zinc/50/45/20/335504520.db2.gz	YIKUTLVKWQCLOY-AWEZNQCLSA-N	0	0	268.360	4.210	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1cccc(-c2ncco2)c1	ZINC000179755252	335514910	/nfs/dbraw/zinc/51/49/10/335514910.db2.gz	ZOAZFWKCBSZOOJ-ZDUSSCGKSA-N	0	0	299.374	4.208	20	30		CIEDRN
C=CCC(C)(C)c1noc(COc2ccc(CC)cc2)n1	ZINC000578149100	335530176	/nfs/dbraw/zinc/53/01/76/335530176.db2.gz	HCRRZNNIVDGTGO-UHFFFAOYSA-N	0	0	286.375	4.065	20	30		CIEDRN
C=CCOc1ccccc1C(=O)N1CCC2(CCCC2)CC1	ZINC000578282834	335594924	/nfs/dbraw/zinc/59/49/24/335594924.db2.gz	WGCVLOUJJOQWEH-UHFFFAOYSA-N	0	0	299.414	4.048	20	30		CIEDRN
N#Cc1ncccc1N[C@@H]1C[C@H]1c1ccc2ccccc2c1	ZINC000578289726	335595422	/nfs/dbraw/zinc/59/54/22/335595422.db2.gz	ANQYQMZMSNZBJA-FUHWJXTLSA-N	0	0	285.350	4.074	20	30		CIEDRN
CC[C@H](Cc1ccc(Cl)cc1)Nc1ncccc1C#N	ZINC000578573124	335650405	/nfs/dbraw/zinc/65/04/05/335650405.db2.gz	LLNIIISOHOQALF-OAHLLOKOSA-N	0	0	285.778	4.040	20	30		CIEDRN
C=CCCCC(=O)N[C@H]1C[C@H](c2ccccc2Cl)C1	ZINC000578932964	335690506	/nfs/dbraw/zinc/69/05/06/335690506.db2.gz	FUEODJGGXODYKD-JOCQHMNTSA-N	0	0	277.795	4.059	20	30		CIEDRN
CC[C@](C)(C#N)c1nc(-c2cc(Cl)cc(Cl)c2)no1	ZINC000579339141	335735533	/nfs/dbraw/zinc/73/55/33/335735533.db2.gz	MPKCBSZSZQRDDR-CYBMUJFWSA-N	0	0	296.157	4.235	20	30		CIEDRN
CC(C)=CCC[C@H](C)CC(=O)Nc1ccccc1C#N	ZINC000579595526	335817159	/nfs/dbraw/zinc/81/71/59/335817159.db2.gz	ZOSDVAGLUSLVQV-AWEZNQCLSA-N	0	0	270.376	4.269	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)C[C@H](C)c1ccccc1	ZINC000182609140	335829984	/nfs/dbraw/zinc/82/99/84/335829984.db2.gz	KENGCHJVHQACNQ-LSDHHAIUSA-N	0	0	259.393	4.041	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1cc(F)ccc1C	ZINC000182765849	335841314	/nfs/dbraw/zinc/84/13/14/335841314.db2.gz	GEQQBBUQMVFRCZ-GFCCVEGCSA-N	0	0	264.344	4.000	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1cc(F)ccc1C	ZINC000182765828	335841326	/nfs/dbraw/zinc/84/13/26/335841326.db2.gz	GEQQBBUQMVFRCZ-LBPRGKRZSA-N	0	0	264.344	4.000	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1ccc(F)cc1C	ZINC000182779977	335842386	/nfs/dbraw/zinc/84/23/86/335842386.db2.gz	FALZVHARTZQPDR-LBPRGKRZSA-N	0	0	264.344	4.000	20	30		CIEDRN
C=CCC[C@H](Nc1cccc(NC(=O)C(C)C)c1)C1CC1	ZINC000182945880	335852332	/nfs/dbraw/zinc/85/23/32/335852332.db2.gz	JCVHXPAZSYIWNW-KRWDZBQOSA-N	0	0	286.419	4.438	20	30		CIEDRN
C=CCC[C@H](Nc1cccc(NC(=O)C2CC2)c1)C1CC1	ZINC000182953773	335852797	/nfs/dbraw/zinc/85/27/97/335852797.db2.gz	XAIOZNUFZQEULC-KRWDZBQOSA-N	0	0	284.403	4.192	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H](CC(C)(C)C)C(F)(F)F	ZINC000182987112	335854874	/nfs/dbraw/zinc/85/48/74/335854874.db2.gz	KJEOOSXGIXGNKT-GFCCVEGCSA-N	0	0	291.357	4.238	20	30		CIEDRN
C/C=C\c1ccc(NCc2cc(C#N)ccc2F)cc1	ZINC000579771867	335881259	/nfs/dbraw/zinc/88/12/59/335881259.db2.gz	HAKWVYYDPJENMQ-IHWYPQMZSA-N	0	0	266.319	4.343	20	30		CIEDRN
C=CCN(C(=O)c1cc2cccc(Cl)c2s1)C1CC1	ZINC000579836008	335901811	/nfs/dbraw/zinc/90/18/11/335901811.db2.gz	ZGXWWGPDZWSYFP-UHFFFAOYSA-N	0	0	291.803	4.345	20	30		CIEDRN
CC[C@@H](CC#N)NCc1ccc(-c2ccccc2Cl)o1	ZINC000184081358	335917308	/nfs/dbraw/zinc/91/73/08/335917308.db2.gz	MHFIFTMPAZHPDC-LBPRGKRZSA-N	0	0	288.778	4.382	20	30		CIEDRN
CSc1cccc(C)c1NCCCC(C)(C)C#N	ZINC000185434526	335951838	/nfs/dbraw/zinc/95/18/38/335951838.db2.gz	JRIZKPWHQDDQRN-UHFFFAOYSA-N	0	0	262.422	4.459	20	30		CIEDRN
N#CCc1cccc(NC(=O)NCCC2=CCCCCC2)c1	ZINC000580877535	335978172	/nfs/dbraw/zinc/97/81/72/335978172.db2.gz	SVKLGGJIBDHQEI-UHFFFAOYSA-N	0	0	297.402	4.155	20	30		CIEDRN
C=CCCCCSc1nnc(-c2cccs2)o1	ZINC000581232069	336028526	/nfs/dbraw/zinc/02/85/26/336028526.db2.gz	JIZRDUVZTNIYSJ-UHFFFAOYSA-N	0	0	266.391	4.247	20	30		CIEDRN
CC[C@@](C)(C#N)c1nc(-c2ccc3sccc3c2)no1	ZINC000581276266	336035702	/nfs/dbraw/zinc/03/57/02/336035702.db2.gz	BDPMYZMYWLBLRS-HNNXBMFYSA-N	0	0	283.356	4.143	20	30		CIEDRN
C=CCn1c(C)nnc1SCc1ccc(CCC)cc1	ZINC000194776038	336038717	/nfs/dbraw/zinc/03/87/17/336038717.db2.gz	BLPLEIWMZVXYMX-UHFFFAOYSA-N	0	0	287.432	4.017	20	30		CIEDRN
C=CCOc1ccccc1C(=O)N1C[C@@H](C)c2ccccc21	ZINC000195603699	336056934	/nfs/dbraw/zinc/05/69/34/336056934.db2.gz	VGWCKIKDKCBPIM-CQSZACIVSA-N	0	0	293.366	4.015	20	30		CIEDRN
CCc1ccc(NCc2cccc(C#N)c2)cc1C	ZINC000381806938	336073338	/nfs/dbraw/zinc/07/33/38/336073338.db2.gz	KZHWRNMDXIGZDE-UHFFFAOYSA-N	0	0	250.345	4.041	20	30		CIEDRN
N#Cc1cc(Cl)cc(OC[C@@H]2CCCCC2(F)F)c1	ZINC000382065547	336081233	/nfs/dbraw/zinc/08/12/33/336081233.db2.gz	GSVDCKLCTXUVJK-NSHDSACASA-N	0	0	285.721	4.416	20	30		CIEDRN
N#Cc1ccc(Cl)cc1OC[C@@H]1CCCCC1(F)F	ZINC000382186934	336084236	/nfs/dbraw/zinc/08/42/36/336084236.db2.gz	QXGKWPCBJNARAX-NSHDSACASA-N	0	0	285.721	4.416	20	30		CIEDRN
CCN(Cc1cccs1)c1nc(C)c(C#N)cc1Cl	ZINC000382270267	336085292	/nfs/dbraw/zinc/08/52/92/336085292.db2.gz	BNNLRJAQXXENTB-UHFFFAOYSA-N	0	0	291.807	4.003	20	30		CIEDRN
Cc1nc(N(C)[C@H](C)c2ccccc2)c(Cl)cc1C#N	ZINC000383628440	336115786	/nfs/dbraw/zinc/11/57/86/336115786.db2.gz	JOVYJASZXNIJPN-GFCCVEGCSA-N	0	0	285.778	4.113	20	30		CIEDRN
N#Cc1cnccc1Nc1ccc(COC2CCCC2)cc1	ZINC000581701399	336130002	/nfs/dbraw/zinc/13/00/02/336130002.db2.gz	WUQBMVQQWYNQNK-UHFFFAOYSA-N	0	0	293.370	4.156	20	30		CIEDRN
C=CC(C)(C)C[NH2+]Cc1nc(-c2ccccc2)cs1	ZINC000384994459	336135529	/nfs/dbraw/zinc/13/55/29/336135529.db2.gz	UIKPSXNDDMEZJG-UHFFFAOYSA-N	0	0	272.417	4.112	20	30		CIEDRN
CCc1cc(NCc2cc(C#N)ccc2OC)ccc1C	ZINC000385224493	336142601	/nfs/dbraw/zinc/14/26/01/336142601.db2.gz	HOMCIOWPBLJCKH-UHFFFAOYSA-N	0	0	280.371	4.050	20	30		CIEDRN
C[C@H](Nc1ccc(C#N)c(Cl)c1)c1ccc2n[nH]cc2c1	ZINC000581961389	336179857	/nfs/dbraw/zinc/17/98/57/336179857.db2.gz	WSVSBAJQXFUWRW-JTQLQIEISA-N	0	0	296.761	4.261	20	30		CIEDRN
Cc1ccc(F)cc1CSCCC(C)(C)C#N	ZINC000581966021	336180556	/nfs/dbraw/zinc/18/05/56/336180556.db2.gz	IWYCTKLBFCGGKL-UHFFFAOYSA-N	0	0	251.370	4.307	20	30		CIEDRN
COCCSCCCS[C@H](C)c1cccc(C#N)c1	ZINC000278414860	521775127	/nfs/dbraw/zinc/77/51/27/521775127.db2.gz	WHUGYOLURIFZDM-CYBMUJFWSA-N	0	0	295.473	4.122	20	30		CIEDRN
C[C@@H]1CCC[C@@H](C(=O)N[C@@H]2CCC(=O)N[C@H]2C(C)(C)C)C1	ZINC000329272964	533722265	/nfs/dbraw/zinc/72/22/65/533722265.db2.gz	JUDXGHXSJFIQKA-RGCMKSIDSA-N	0	0	294.439	4.303	20	30		CIEDRN
C[C@H]1CC[C@@]2(CCN(c3c(C#N)cnc4ccccc43)C2)C1	ZINC000302030068	533731479	/nfs/dbraw/zinc/73/14/79/533731479.db2.gz	BNKGGGQHYIKOOU-IFXJQAMLSA-N	0	0	291.398	4.123	20	30		CIEDRN
C[C@H]1CC[C@H](C(=O)Nc2ncc3c(n2)CCC(C)(C)C3)C1	ZINC000330168843	533739022	/nfs/dbraw/zinc/73/90/22/533739022.db2.gz	BCUVEWCFDNZCSH-RYUDHWBXSA-N	0	0	287.407	4.016	20	30		CIEDRN
C[C@@H]1CCC[C@@H]1CC(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000352197949	533778975	/nfs/dbraw/zinc/77/89/75/533778975.db2.gz	HICHURONLHONDJ-KBAYOESNSA-N	0	0	298.430	4.364	20	30		CIEDRN
Cc1cc(F)ccc1NC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000353562783	533879945	/nfs/dbraw/zinc/87/99/45/533879945.db2.gz	PZPZIUZYTFCQDX-OAHLLOKOSA-N	0	0	296.345	4.160	20	30		CIEDRN
C[C@@H](SCC1(C#N)CC1)c1ccc(F)cc1F	ZINC000344492316	533988789	/nfs/dbraw/zinc/98/87/89/533988789.db2.gz	YYQLTOHDXUBNAZ-SECBINFHSA-N	0	0	253.317	4.063	20	30		CIEDRN
C[C@@H]1CC[C@@H](C(=O)Nc2ncc3c(n2)CCC(C)(C)C3)C1	ZINC000330168844	534140738	/nfs/dbraw/zinc/14/07/38/534140738.db2.gz	BCUVEWCFDNZCSH-VXGBXAGGSA-N	0	0	287.407	4.016	20	30		CIEDRN
CSc1ccc(CN(CCC#N)CC(C)(C)C)cc1	ZINC000353404879	534204878	/nfs/dbraw/zinc/20/48/78/534204878.db2.gz	QTUQJPODQOMMJX-UHFFFAOYSA-N	0	0	276.449	4.170	20	30		CIEDRN
Cc1ccc(-c2nnco2)cc1NC(=O)[C@H]1CC12CCCC2	ZINC000329989997	534227175	/nfs/dbraw/zinc/22/71/75/534227175.db2.gz	IOWUHQOPBMPXFE-CYBMUJFWSA-N	0	0	297.358	4.213	20	30		CIEDRN
CC(C)Oc1ccccc1NCc1ccc(CC#N)cc1	ZINC000541303914	517457301	/nfs/dbraw/zinc/45/73/01/517457301.db2.gz	JUWZNSOJMIYYLK-UHFFFAOYSA-N	0	0	280.371	4.152	20	30		CIEDRN
O=C(Nc1nc(C2CC2)c[nH]1)[C@@H]1CCC[C@H]2CCCC[C@H]21	ZINC000329300871	534333548	/nfs/dbraw/zinc/33/35/48/534333548.db2.gz	MPXNCVWOIJAELJ-MRVWCRGKSA-N	0	0	287.407	4.482	20	30		CIEDRN
COc1ccccc1S[C@H](C#N)Cc1ccc(C)cc1	ZINC000067008065	518170295	/nfs/dbraw/zinc/17/02/95/518170295.db2.gz	OBZRFFKFGDFGNE-HNNXBMFYSA-N	0	0	283.396	4.231	20	30		CIEDRN
C[C@H](Nc1cccc2ccn(C)c21)c1cccc(C#N)c1	ZINC000188778893	518183685	/nfs/dbraw/zinc/18/36/85/518183685.db2.gz	LXGVROYVJFOTAI-ZDUSSCGKSA-N	0	0	275.355	4.223	20	30		CIEDRN
C=CCCCNC(=O)Nc1ccc(C)c(-c2nc(C)co2)c1	ZINC000279644339	518702434	/nfs/dbraw/zinc/70/24/34/518702434.db2.gz	WCYXWGQBNIONJO-UHFFFAOYSA-N	0	0	299.374	4.046	20	30		CIEDRN
CC#CCCCC(=O)Nc1cc(C(=O)CC)ccc1Cl	ZINC000279774734	519336212	/nfs/dbraw/zinc/33/62/12/519336212.db2.gz	WTOBZWLOPPFUMJ-UHFFFAOYSA-N	0	0	291.778	4.065	20	30		CIEDRN
CC(C)N(Cc1cccs1)C(=O)Nc1cccc(C#N)c1	ZINC000299175142	519661220	/nfs/dbraw/zinc/66/12/20/519661220.db2.gz	SNTFNMSCDSLMAG-UHFFFAOYSA-N	0	0	299.399	4.062	20	30		CIEDRN
CC(=O)Nc1ccc(S[C@H](C)c2ccc(C#N)cc2)cc1	ZINC000118172752	519732808	/nfs/dbraw/zinc/73/28/08/519732808.db2.gz	TZRRXZYOXATJMJ-GFCCVEGCSA-N	0	0	296.395	4.370	20	30		CIEDRN
CCN(C(=O)/C=C/C(C)(C)C)[C@H](C)c1ccc(C#N)cc1	ZINC000264593780	519897875	/nfs/dbraw/zinc/89/78/75/519897875.db2.gz	BKYIJONEQWZVCD-GCZGRYASSA-N	0	0	284.403	4.070	20	30		CIEDRN
Cc1oc(C(C)C)nc1C(=O)N[C@@H]1CC[C@@H]2CCC[C@H]2C1	ZINC000329151998	534543290	/nfs/dbraw/zinc/54/32/90/534543290.db2.gz	BBSXMMQJUMOQOL-MELADBBJSA-N	0	0	290.407	4.380	20	30		CIEDRN
Cc1oc2ccc(NC(=O)[C@H]3CCC(=O)NC3)cc2c1C	ZINC000330069898	534550249	/nfs/dbraw/zinc/55/02/49/534550249.db2.gz	WONJDGFMOLDSDR-NSHDSACASA-N	0	0	286.331	4.004	20	30		CIEDRN
Cc1oc2ccc(NC(=O)[C@@H]3[C@@H]4CCCO[C@H]34)cc2c1C	ZINC000330049956	534550626	/nfs/dbraw/zinc/55/06/26/534550626.db2.gz	JZRUZMFPNOVNME-MAZHCROVSA-N	0	0	285.343	4.063	20	30		CIEDRN
CCCc1nc(C)c(CNc2ccc(C#N)c(Cl)c2)o1	ZINC000292292950	521500329	/nfs/dbraw/zinc/50/03/29/521500329.db2.gz	NCADYXXTRBKSLX-UHFFFAOYSA-N	0	0	289.766	4.073	20	30		CIEDRN
CCCc1nc(C)c(CNc2cccc(Cl)c2C#N)o1	ZINC000295677598	521500592	/nfs/dbraw/zinc/50/05/92/521500592.db2.gz	LKLJXACPXUMGMD-UHFFFAOYSA-N	0	0	289.766	4.073	20	30		CIEDRN
CCOC1CC(CS[C@@H](C)c2ccc(C#N)cc2)C1	ZINC000285076638	521649218	/nfs/dbraw/zinc/64/92/18/521649218.db2.gz	MAWQYLISADBEGV-YGONEPDPSA-N	0	0	275.417	4.168	20	30		CIEDRN
Cc1cnc([C@@H](C)CNc2c(Cl)cccc2C#N)s1	ZINC000302154082	534605923	/nfs/dbraw/zinc/60/59/23/534605923.db2.gz	VIKZFCAWLTTZNE-VIFPVBQESA-N	0	0	291.807	4.192	20	30		CIEDRN
Cc1cccc(C(C)C)c1NC(=O)c1ccc(F)c(C#N)c1	ZINC000353558886	534643912	/nfs/dbraw/zinc/64/39/12/534643912.db2.gz	YOVITJUYIYZOEB-UHFFFAOYSA-N	0	0	296.345	4.382	20	30		CIEDRN
CC[C@H](NC(=O)c1cccc(C#N)c1C)c1ccc(C)cc1	ZINC000337746590	522542462	/nfs/dbraw/zinc/54/24/62/522542462.db2.gz	GPMGIZGQXIIPGU-SFHVURJKSA-N	0	0	292.382	4.056	20	30		CIEDRN
CCc1noc(C)c1CS[C@@H](C)c1cccc(C#N)c1	ZINC000276248736	522854647	/nfs/dbraw/zinc/85/46/47/522854647.db2.gz	VSBFLNUVDPNJPZ-LBPRGKRZSA-N	0	0	286.400	4.412	20	30		CIEDRN
CC[C@@H](NCc1nc(C2CC2)cs1)c1ccc(C#N)cc1	ZINC000278898673	522891603	/nfs/dbraw/zinc/89/16/03/522891603.db2.gz	ZFOWNXFMCBIFQB-OAHLLOKOSA-N	0	0	297.427	4.133	20	30		CIEDRN
CO[C@@H](C)c1nc(CSc2ccc(C#N)cc2)cs1	ZINC000356561785	523478623	/nfs/dbraw/zinc/47/86/23/523478623.db2.gz	DKIZAKXOWMGYBB-JTQLQIEISA-N	0	0	290.413	4.014	20	30		CIEDRN
CCc1cc(C)cc(CC)c1NC(=O)c1cccc(C#N)c1	ZINC000281089170	523785731	/nfs/dbraw/zinc/78/57/31/523785731.db2.gz	CPWCDENEVQXJKO-UHFFFAOYSA-N	0	0	292.382	4.244	20	30		CIEDRN
O=C(NCC1(NC(=O)C2CCCC2)CCC1)C1CCCC1	ZINC000329122310	534751402	/nfs/dbraw/zinc/75/14/02/534751402.db2.gz	QZNLMDSXEGNBDP-UHFFFAOYSA-N	0	0	292.423	4.203	20	30		CIEDRN
O=C(Nc1scnc1C1CC1)N[C@@H]1CC12CCCCC2	ZINC000329122042	534759425	/nfs/dbraw/zinc/75/94/25/534759425.db2.gz	QVKJSXWXDIWGIM-LLVKDONJSA-N	0	0	291.420	4.069	20	30		CIEDRN
N#Cc1ccnc(NC(=O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)c1	ZINC000329628945	534823323	/nfs/dbraw/zinc/82/33/23/534823323.db2.gz	HKDXGAFIOZFAMK-QLFBSQMISA-N	0	0	283.375	4.148	20	30		CIEDRN
C[C@@H](NC(=O)C1(C#N)CCCC1)c1cccc2ccccc21	ZINC000052752652	525056944	/nfs/dbraw/zinc/05/69/44/525056944.db2.gz	FXNJTEVFGMPSQW-CQSZACIVSA-N	0	0	292.382	4.101	20	30		CIEDRN
Cc1ccccc1[C@@H](C)N(C)C(=O)c1cccc(C#N)c1C	ZINC000337903613	525349124	/nfs/dbraw/zinc/34/91/24/525349124.db2.gz	SJJCEMBUIHQZSX-OAHLLOKOSA-N	0	0	292.382	4.008	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)N1C[C@@H]2CCCCCC[C@@H]21	ZINC000366545693	525547760	/nfs/dbraw/zinc/54/77/60/525547760.db2.gz	KLSCPONDTCXZLV-RDJZCZTQSA-N	0	0	297.402	4.053	20	30		CIEDRN
C[C@H](Sc1ccc(C#N)c(C(F)(F)F)c1)C(=O)C1CC1	ZINC000280989572	525984995	/nfs/dbraw/zinc/98/49/95/525984995.db2.gz	MLVDLPRDXSUGOR-QMMMGPOBSA-N	0	0	299.317	4.037	20	30		CIEDRN
C[C@@H](Sc1cccc(C#N)c1)c1nc(C(C)(C)C)no1	ZINC000158819068	525990383	/nfs/dbraw/zinc/99/03/83/525990383.db2.gz	PHWQLYHNFGDVDZ-SNVBAGLBSA-N	0	0	287.388	4.092	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N1[C@H](C)C[C@H]2CCCC[C@@H]21	ZINC000083560545	526001744	/nfs/dbraw/zinc/00/17/44/526001744.db2.gz	TZOAMGSNBJCTGW-UNEWFSDZSA-N	0	0	297.402	4.052	20	30		CIEDRN
C[C@@H](c1ccco1)N(Cc1ccc(C#N)cc1F)C1CC1	ZINC000086234940	526137629	/nfs/dbraw/zinc/13/76/29/526137629.db2.gz	BBXRXFQYKKHSKC-LBPRGKRZSA-N	0	0	284.334	4.016	20	30		CIEDRN
Cc1cnccc1SCc1ccc(Cl)cc1C#N	ZINC000338625033	526243543	/nfs/dbraw/zinc/24/35/43/526243543.db2.gz	LIVIDCIKEHDXEA-UHFFFAOYSA-N	0	0	274.776	4.207	20	30		CIEDRN
Cc1cnccc1S[C@@H](C)c1ccc(C#N)cc1	ZINC000338618226	526245585	/nfs/dbraw/zinc/24/55/85/526245585.db2.gz	JEAJXVMLZVOLKT-LBPRGKRZSA-N	0	0	254.358	4.115	20	30		CIEDRN
CC#CCCCC(=O)N1CCC[C@@H]1c1cccc(C)c1C	ZINC000185655262	526291480	/nfs/dbraw/zinc/29/14/80/526291480.db2.gz	RKUZOTYKQFYAQO-GOSISDBHSA-N	0	0	283.415	4.161	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)c1ccoc1CCC	ZINC000344261587	526375204	/nfs/dbraw/zinc/37/52/04/526375204.db2.gz	NNRBZAIJQDYKOR-UHFFFAOYSA-N	0	0	289.400	4.122	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N1CCC(c2ccsc2)CC1	ZINC000335208404	526430759	/nfs/dbraw/zinc/43/07/59/526430759.db2.gz	JCCBONVDVIRUQW-UHFFFAOYSA-N	0	0	277.433	4.056	20	30		CIEDRN
C=C(C)CCc1noc(-c2ccc3nc(C)ccc3c2)n1	ZINC000351641813	526465382	/nfs/dbraw/zinc/46/53/82/526465382.db2.gz	QYNOJEVQTOAAMU-UHFFFAOYSA-N	0	0	279.343	4.102	20	30		CIEDRN
Cc1noc(C)c1CS[C@H](C)c1ccc(C#N)cc1	ZINC000118443713	526527767	/nfs/dbraw/zinc/52/77/67/526527767.db2.gz	ATWUUHNYSDAVQH-GFCCVEGCSA-N	0	0	272.373	4.158	20	30		CIEDRN
CC(C)(C)SCCNc1cc(C#N)nc2ccccc21	ZINC000301392538	526605703	/nfs/dbraw/zinc/60/57/03/526605703.db2.gz	BRVFLTFQHPBGQD-UHFFFAOYSA-N	0	0	285.416	4.050	20	30		CIEDRN
N#Cc1ccc(Cl)cc1OCc1csc(C2CC2)n1	ZINC000340042649	526636967	/nfs/dbraw/zinc/63/69/67/526636967.db2.gz	VSGGNOGQOYHIHC-UHFFFAOYSA-N	0	0	290.775	4.125	20	30		CIEDRN
CC(C)(C)[C@@H]1NC(=O)CC[C@H]1NC(=O)CC1CCCC1	ZINC000329222526	526680635	/nfs/dbraw/zinc/68/06/35/526680635.db2.gz	WNLIUZNMGWTGJQ-IUODEOHRSA-N	0	0	280.412	4.057	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC)c1ccc(C#N)c(Cl)c1	ZINC000186087825	526705124	/nfs/dbraw/zinc/70/51/24/526705124.db2.gz	ACGTWQTYILZCSJ-LBPRGKRZSA-N	0	0	290.794	4.167	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1C[C@H](C)C[C@@H]1c1cccc(F)c1	ZINC000185688810	526709634	/nfs/dbraw/zinc/70/96/34/526709634.db2.gz	XFTFEAUPSDMZSZ-JKIFEVAISA-N	0	0	289.394	4.338	20	30		CIEDRN
N#Cc1ccccc1CSCc1ccccc1F	ZINC000058238612	526738402	/nfs/dbraw/zinc/73/84/02/526738402.db2.gz	QIPOWRUYHZZEBN-UHFFFAOYSA-N	0	0	257.333	4.131	20	30		CIEDRN
CC(C)(C)[C@](C)(C#N)NC(=O)[C@@H]1CC[C@H]2CCCC[C@@H]2C1	ZINC000332714325	526741755	/nfs/dbraw/zinc/74/17/55/526741755.db2.gz	LYHUHIVPMBOPBM-ADAWSYLGSA-N	0	0	290.451	4.037	20	30		CIEDRN
Cc1oc(C#N)cc1C(=O)N(c1ccccc1)C1CCCC1	ZINC000280665224	526755486	/nfs/dbraw/zinc/75/54/86/526755486.db2.gz	BUADSHUJWBDTAQ-UHFFFAOYSA-N	0	0	294.354	4.049	20	30		CIEDRN
C=C1CCN(C(=O)c2ccc3c(c2)oc2ccccc23)CC1	ZINC000352640972	526900053	/nfs/dbraw/zinc/90/00/53/526900053.db2.gz	VIQDBCQCUHQXMZ-UHFFFAOYSA-N	0	0	291.350	4.378	20	30		CIEDRN
C=C1CCN(C(=O)c2cscc2-c2ccccc2)CC1	ZINC000354268204	526901827	/nfs/dbraw/zinc/90/18/27/526901827.db2.gz	LFYNSZAWKQTJGK-UHFFFAOYSA-N	0	0	283.396	4.207	20	30		CIEDRN
C=CC1CCN(C(=O)c2cc(F)ccc2-c2ccoc2)CC1	ZINC000348281943	526974444	/nfs/dbraw/zinc/97/44/44/526974444.db2.gz	NONXJCJOVANYRJ-UHFFFAOYSA-N	0	0	299.345	4.124	20	30		CIEDRN
CC(C)(CCC#N)CNC(=O)c1c(Cl)cccc1Cl	ZINC000345735001	526996242	/nfs/dbraw/zinc/99/62/42/526996242.db2.gz	CUOTZEMGBHEOIM-UHFFFAOYSA-N	0	0	299.201	4.053	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cnn([C@H](C)CC)c1C1CC1	ZINC000344362081	526998077	/nfs/dbraw/zinc/99/80/77/526998077.db2.gz	NTNGQBURZWAVQU-GFCCVEGCSA-N	0	0	289.423	4.272	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@]3(C)[C@H](C2)C3(F)F)CCCCC1	ZINC000334698679	527048961	/nfs/dbraw/zinc/04/89/61/527048961.db2.gz	YKCQDXHQLUCEQM-DZGCQCFKSA-N	0	0	297.389	4.017	20	30		CIEDRN
C=CCCC(=O)N[C@H](CC(F)(F)F)c1ccccc1C	ZINC000347457313	527076477	/nfs/dbraw/zinc/07/64/77/527076477.db2.gz	YWMHPEJABDSVIF-CYBMUJFWSA-N	0	0	285.309	4.071	20	30		CIEDRN
C=CCCC(=O)Nc1c(C)cccc1-c1nc(C(C)C)no1	ZINC000108166854	527077743	/nfs/dbraw/zinc/07/77/43/527077743.db2.gz	MPVAGCFOEORRLK-UHFFFAOYSA-N	0	0	299.374	4.073	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(SC)cc2)CC1	ZINC000353793240	527097040	/nfs/dbraw/zinc/09/70/40/527097040.db2.gz	PLXIFBQYWYSRIG-UHFFFAOYSA-N	0	0	261.390	4.093	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cccc(SC)c2)CC1	ZINC000353679419	527097093	/nfs/dbraw/zinc/09/70/93/527097093.db2.gz	WUMDKMXLMLSMAE-UHFFFAOYSA-N	0	0	261.390	4.093	20	30		CIEDRN
C=CC[C@H]1N(C(=O)c2ccnc(C3CC3)c2)CCCC1(C)C	ZINC000347479413	527226005	/nfs/dbraw/zinc/22/60/05/527226005.db2.gz	GIHSUZVIGFKXEF-QGZVFWFLSA-N	0	0	298.430	4.166	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CC[C@H]1C	ZINC000351528013	527259611	/nfs/dbraw/zinc/25/96/11/527259611.db2.gz	CAHWFJHJJPRPJE-CZUORRHYSA-N	0	0	286.419	4.459	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NCCCCCO	ZINC000352548834	527260310	/nfs/dbraw/zinc/26/03/10/527260310.db2.gz	WOZHZSVWLULSDQ-UHFFFAOYSA-N	0	0	261.409	4.113	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NCCCc1nc(C)no1	ZINC000352549016	527260395	/nfs/dbraw/zinc/26/03/95/527260395.db2.gz	XSCOIJVRMCFWPO-UHFFFAOYSA-N	0	0	299.418	4.275	20	30		CIEDRN
C=CCCO[C@@H](C)c1nc(C2CCC(C)(C)CC2)no1	ZINC000347477884	527387718	/nfs/dbraw/zinc/38/77/18/527387718.db2.gz	ARAFNKHWHFQJOD-LBPRGKRZSA-N	0	0	278.396	4.407	20	30		CIEDRN
C=CCC[C@H](Nc1nc(CC)ns1)c1ccccc1	ZINC000301774950	527488712	/nfs/dbraw/zinc/48/87/12/527488712.db2.gz	KVFMQMHHWUHURA-ZDUSSCGKSA-N	0	0	273.405	4.220	20	30		CIEDRN
CC(C)CCN(CCC#N)Cc1cnc(CC(C)C)s1	ZINC000353436520	527715442	/nfs/dbraw/zinc/71/54/42/527715442.db2.gz	OZCZVOJTBLTTKM-UHFFFAOYSA-N	0	0	293.480	4.103	20	30		CIEDRN
CCC[C@H](C)CC(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000352174391	528030210	/nfs/dbraw/zinc/03/02/10/528030210.db2.gz	MNQKDBUBNLZLTQ-DOTOQJQBSA-N	0	0	286.419	4.364	20	30		CIEDRN
CC(C)c1ccc([C@@H](Nc2cnc(C#N)cn2)C(C)C)cc1	ZINC000302252318	528135010	/nfs/dbraw/zinc/13/50/10/528135010.db2.gz	XGEOZKXVKIBZNI-SFHVURJKSA-N	0	0	294.402	4.281	20	30		CIEDRN
CC1CCC(N(C)C(=O)C[C@H](CC#N)c2ccccc2)CC1	ZINC000353828027	528187887	/nfs/dbraw/zinc/18/78/87/528187887.db2.gz	PKUTZELVZWQDKP-NXYGQSRBSA-N	0	0	298.430	4.111	20	30		CIEDRN
CC1CCC(N(C)C(=O)C[C@@H](CC#N)c2ccccc2)CC1	ZINC000353828023	528189003	/nfs/dbraw/zinc/18/90/03/528189003.db2.gz	PKUTZELVZWQDKP-IIIMJFFVSA-N	0	0	298.430	4.111	20	30		CIEDRN
CC(C)Sc1ccccc1NCc1nc(C#N)cs1	ZINC000352812023	528335461	/nfs/dbraw/zinc/33/54/61/528335461.db2.gz	VSRVLYLMJHCBGJ-UHFFFAOYSA-N	0	0	289.429	4.127	20	30		CIEDRN
CCN(CCC#N)C(=O)c1ccc(C(C)(C)C)c(Cl)c1	ZINC000354926445	528371405	/nfs/dbraw/zinc/37/14/05/528371405.db2.gz	VLOOGUAJWGFZCM-UHFFFAOYSA-N	0	0	292.810	4.013	20	30		CIEDRN
CC(C)c1scnc1NC(=O)NC1CCCCCC1	ZINC000329557961	528523908	/nfs/dbraw/zinc/52/39/08/528523908.db2.gz	LJHQKXDDCCILHF-UHFFFAOYSA-N	0	0	281.425	4.315	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)[C@H]1CCCc2ccccc21	ZINC000348525599	528541477	/nfs/dbraw/zinc/54/14/77/528541477.db2.gz	OEGNUGDRMICBCI-KRWDZBQOSA-N	0	0	298.430	4.037	20	30		CIEDRN
CC(C)[C@@H]1CCC[C@H](NC(=O)[C@@H]2C[C@H](C)CC(=O)N2)CC1	ZINC000329077728	528682850	/nfs/dbraw/zinc/68/28/50/528682850.db2.gz	CQSRPAMCVSOZME-XGUBFFRZSA-N	0	0	294.439	4.303	20	30		CIEDRN
CCCOc1ccc(Cl)cc1N[C@@H]1CC[C@@H](C#N)C1	ZINC000442863960	528696585	/nfs/dbraw/zinc/69/65/85/528696585.db2.gz	FGEOLOHYSTZQEV-DGCLKSJQSA-N	0	0	278.783	4.233	20	30		CIEDRN
CCCc1nc(C)c(NCc2ccc(C#N)cc2F)s1	ZINC000354931956	528742919	/nfs/dbraw/zinc/74/29/19/528742919.db2.gz	QFHAQAAOHXTZKZ-UHFFFAOYSA-N	0	0	289.379	4.027	20	30		CIEDRN
CC(=O)Nc1ncccc1NC(=O)C[C@@H]1C=CCCC1	ZINC000330333975	528748596	/nfs/dbraw/zinc/74/85/96/528748596.db2.gz	YNDKXMWUJOWUTH-GFCCVEGCSA-N	0	0	273.336	4.024	20	30		CIEDRN
CCC(CC)CN(CCC#N)Cc1ccc(Cl)o1	ZINC000353438742	528750543	/nfs/dbraw/zinc/75/05/43/528750543.db2.gz	VGIFFZCIGSRVIY-UHFFFAOYSA-N	0	0	268.788	4.085	20	30		CIEDRN
CC(C)[C@@H]1C[C@H](CC(=O)N(C)[C@H](C)CC#N)c2ccccc21	ZINC000346043611	528774631	/nfs/dbraw/zinc/77/46/31/528774631.db2.gz	XBYRBQXFGQOUIJ-RKVPGOIHSA-N	0	0	298.430	4.064	20	30		CIEDRN
CC1(NC(=O)C2CCC(NC(=O)C3CC3)CC2)CCCC1	ZINC000330025518	528831737	/nfs/dbraw/zinc/83/17/37/528831737.db2.gz	KQKRGKKYZHLUCO-UHFFFAOYSA-N	0	0	292.423	4.201	20	30		CIEDRN
CCC(CC)[C@@H]1C[C@@H](Nc2ccc(C#N)cc2F)CCO1	ZINC000302032329	528837831	/nfs/dbraw/zinc/83/78/31/528837831.db2.gz	IUNWVDOTRBSZEA-YOEHRIQHSA-N	0	0	290.382	4.093	20	30		CIEDRN
CC1(C)CC(C(=O)Nc2ccccc2-c2cn[nH]c2)C1	ZINC000329127788	528882372	/nfs/dbraw/zinc/88/23/72/528882372.db2.gz	ZGPFRXAGESFEKF-UHFFFAOYSA-N	0	0	269.348	4.101	20	30		CIEDRN
CC1(C)CCC(CNC(=O)c2ocnc2C2CC2)CC1	ZINC000329645165	528899854	/nfs/dbraw/zinc/89/98/54/528899854.db2.gz	JGKXMPMXRUNTNJ-UHFFFAOYSA-N	0	0	276.380	4.073	20	30		CIEDRN
CC(C)[C@H](CNc1ccc(C#N)c(Cl)c1)c1cccnc1	ZINC000301582466	529017162	/nfs/dbraw/zinc/01/71/62/529017162.db2.gz	PZORZZBOIDBKCK-INIZCTEOSA-N	0	0	299.805	4.458	20	30		CIEDRN
CC1(C)CC[C@H](Nc2ccc(C#N)cn2)c2ccccc21	ZINC000301063346	529049390	/nfs/dbraw/zinc/04/93/90/529049390.db2.gz	CNVAMJXIGXQBJE-INIZCTEOSA-N	0	0	277.371	4.178	20	30		CIEDRN
CC[C@H](C)[C@H](C)C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000352226064	529235424	/nfs/dbraw/zinc/23/54/24/529235424.db2.gz	QFAGLBHFVSBVFC-ZOBUZTSGSA-N	0	0	286.419	4.220	20	30		CIEDRN
CC[C@@H](c1ccccc1)N(CC)C(=O)c1cccc(C#N)c1	ZINC000346214088	529256701	/nfs/dbraw/zinc/25/67/01/529256701.db2.gz	HZJSZOGZWGOPSU-SFHVURJKSA-N	0	0	292.382	4.172	20	30		CIEDRN
CC[C@H](CC#N)NC(=O)C[C@H]1C[C@H](C(C)C)c2ccccc21	ZINC000346542099	529297196	/nfs/dbraw/zinc/29/71/96/529297196.db2.gz	NTXCQYJSTHLEQQ-IIDMSEBBSA-N	0	0	298.430	4.112	20	30		CIEDRN
CC(C)(C)c1cccc(-c2ccc(C#N)c(F)n2)c1	ZINC000725269252	567924522	/nfs/dbraw/zinc/92/45/22/567924522.db2.gz	IJJPZXQLGONQNI-UHFFFAOYSA-N	0	0	254.308	4.057	20	30		CIEDRN
CC(C)(CNc1ccc(CC#N)cc1)c1ccccc1	ZINC000082712180	178224991	/nfs/dbraw/zinc/22/49/91/178224991.db2.gz	WVFOIGXMZLKFEP-UHFFFAOYSA-N	0	0	264.372	4.142	20	30		CIEDRN
N#CCc1ccc(NCCc2ccc(Cl)cc2)cc1	ZINC000082712312	178225037	/nfs/dbraw/zinc/22/50/37/178225037.db2.gz	PNJDZRJRZVDBBX-UHFFFAOYSA-N	0	0	270.763	4.061	20	30		CIEDRN
CC[C@@]1(C)CCN(C(=O)Nc2ccc(C(C)(C)C#N)cc2)C1	ZINC000335529072	529526227	/nfs/dbraw/zinc/52/62/27/529526227.db2.gz	CJGRSWVXLHJHEN-SFHVURJKSA-N	0	0	299.418	4.142	20	30		CIEDRN
CCc1cc2c(ncnc2Sc2cccc(C#N)c2)s1	ZINC000301623965	529573709	/nfs/dbraw/zinc/57/37/09/529573709.db2.gz	FPHHRIUPIXBNLJ-UHFFFAOYSA-N	0	0	297.408	4.277	20	30		CIEDRN
CCc1cccc(C)c1NCc1ccc(C#N)cc1F	ZINC000083510125	178535762	/nfs/dbraw/zinc/53/57/62/178535762.db2.gz	ORPHEHRKTLVDIF-UHFFFAOYSA-N	0	0	268.335	4.180	20	30		CIEDRN
CCc1nc(C)c(C(=O)N[C@@H]2CC[C@@H]3CCCC[C@H]3C2)o1	ZINC000330313343	529717551	/nfs/dbraw/zinc/71/75/51/529717551.db2.gz	XDHDZCMIVSUFHY-MELADBBJSA-N	0	0	290.407	4.209	20	30		CIEDRN
CC[C@H](OC1CCCC1)C(=O)Nc1cccc2ocnc21	ZINC000330041718	529716938	/nfs/dbraw/zinc/71/69/38/529716938.db2.gz	BXTAVMUSLBTTKO-ZDUSSCGKSA-N	0	0	288.347	4.154	20	30		CIEDRN
CN(CC(C)(C)C#N)C(=O)c1cscc1-c1ccccc1	ZINC000353295286	529843434	/nfs/dbraw/zinc/84/34/34/529843434.db2.gz	MMMWDVHSHQDWLE-UHFFFAOYSA-N	0	0	298.411	4.037	20	30		CIEDRN
CC#CCSc1nc(-c2ccco2)nc2ccccc21	ZINC000097599472	185636791	/nfs/dbraw/zinc/63/67/91/185636791.db2.gz	PZPZSYGKLIRGKF-UHFFFAOYSA-N	0	0	280.352	4.005	20	30		CIEDRN
F[C@@H](CSc1ccc(C(F)(F)F)cn1)C(F)(F)F	ZINC000409880172	260434685	/nfs/dbraw/zinc/43/46/85/260434685.db2.gz	ODHXNQKYYRPIRO-LURJTMIESA-N	0	0	293.207	4.093	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)C1(CC)CCC1	ZINC000410371439	260491389	/nfs/dbraw/zinc/49/13/89/260491389.db2.gz	FCGASZWUJAEAKF-UHFFFAOYSA-N	0	0	257.377	4.324	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCc1ccc2sccc2c1	ZINC000574028537	334985734	/nfs/dbraw/zinc/98/57/34/334985734.db2.gz	XFSSJBAGAPPACA-GFCCVEGCSA-N	0	0	273.401	4.120	20	30		CIEDRN
COc1cc(N[C@H](C)c2ccc(C#N)cc2)c(C)cc1C	ZINC000479822411	541323059	/nfs/dbraw/zinc/32/30/59/541323059.db2.gz	DVQUASSDIDGRDR-CQSZACIVSA-N	0	0	280.371	4.357	20	30		CIEDRN
CCC(C)(C)C(=O)Nc1ccccc1SC[C@H](C)C#N	ZINC000108238828	260640333	/nfs/dbraw/zinc/64/03/33/260640333.db2.gz	NICXFFXPQSDGLQ-GFCCVEGCSA-N	0	0	290.432	4.313	20	30		CIEDRN
COc1c(Cl)cccc1NCCCC(C)(C)C#N	ZINC000153546016	261080221	/nfs/dbraw/zinc/08/02/21/261080221.db2.gz	AWCRFYIYLDHWGY-UHFFFAOYSA-N	0	0	266.772	4.090	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N(Cc1ccccc1)CC(C)(C)C	ZINC000574312384	335009243	/nfs/dbraw/zinc/00/92/43/335009243.db2.gz	HPKXFUINPUMKMH-OAHLLOKOSA-N	0	0	288.435	4.209	20	30		CIEDRN
C/C=C/CSCc1cc(C#N)ccc1Br	ZINC000492212559	332387400	/nfs/dbraw/zinc/38/74/00/332387400.db2.gz	ZTNWQORZLSNMTJ-NSCUHMNNSA-N	0	0	282.206	4.130	20	30		CIEDRN
N#Cc1cc(NCCCCC(F)(F)F)ccc1Cl	ZINC000151559016	327477543	/nfs/dbraw/zinc/47/75/43/327477543.db2.gz	SMLZRGJJVCGPNK-UHFFFAOYSA-N	0	0	276.689	4.356	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(Cc2csc(C(C)C)n2)no1	ZINC000574484238	335023253	/nfs/dbraw/zinc/02/32/53/335023253.db2.gz	PPASNUOLVVRQMF-HNNXBMFYSA-N	0	0	291.420	4.094	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cc(C)c(OC)cc1Cl	ZINC000574673374	335038603	/nfs/dbraw/zinc/03/86/03/335038603.db2.gz	LQNWQKWIMUUWIB-LLVKDONJSA-N	0	0	281.783	4.198	20	30		CIEDRN
COc1ccccc1[C@@H]1CCCN1c1ccc(F)cc1C#N	ZINC000301528207	532985275	/nfs/dbraw/zinc/98/52/75/532985275.db2.gz	ISBCWPOKPJOPMO-KRWDZBQOSA-N	0	0	296.345	4.047	20	30		CIEDRN
C=CCC(C)(C)C(=O)N(CC)c1nc2ccccc2s1	ZINC000574856196	335052408	/nfs/dbraw/zinc/05/24/08/335052408.db2.gz	LORZDGFWEGHLTM-UHFFFAOYSA-N	0	0	288.416	4.252	20	30		CIEDRN
COc1ccc([C@@H](Nc2ccc(C#N)cc2)C(C)C)cc1	ZINC000301061624	533134449	/nfs/dbraw/zinc/13/44/49/533134449.db2.gz	BUNHYIYKOPXFJP-SFHVURJKSA-N	0	0	280.371	4.376	20	30		CIEDRN
CCCCCCCC(=O)N1CCC[C@H]1c1nccs1	ZINC000364236732	262189162	/nfs/dbraw/zinc/18/91/62/262189162.db2.gz	ILXUJOOZHRZCPI-ZDUSSCGKSA-N	0	0	280.437	4.167	20	30		CIEDRN
CCCCCCCCC[S@](=O)[C@H](C)c1cnccn1	ZINC000190851950	262186296	/nfs/dbraw/zinc/18/62/96/262186296.db2.gz	LFANVXQHGLYKMJ-KUHUBIRLSA-N	0	0	282.453	4.037	20	30		CIEDRN
N#Cc1ccc(OCc2ccc(C(F)F)cc2)c(F)c1	ZINC000185797343	260012265	/nfs/dbraw/zinc/01/22/65/260012265.db2.gz	KISNMKJXVRCVQZ-UHFFFAOYSA-N	0	0	277.245	4.214	20	30		CIEDRN
N#Cc1cccc(CSc2ccc(F)c(F)c2)c1F	ZINC000219764684	260042164	/nfs/dbraw/zinc/04/21/64/260042164.db2.gz	LEHCQQSEHJPFHH-UHFFFAOYSA-N	0	0	279.286	4.268	20	30		CIEDRN
C[C@H](CC#N)Nc1nc2ccccc2c(-c2ccccc2)n1	ZINC000171365931	335063291	/nfs/dbraw/zinc/06/32/91/335063291.db2.gz	XPGWFCITSOPPLP-CYBMUJFWSA-N	0	0	288.354	4.011	20	30		CIEDRN
N#Cc1c(F)cccc1N[C@@H](c1ccccc1)[C@H]1CCCO1	ZINC000171372909	335063519	/nfs/dbraw/zinc/06/35/19/335063519.db2.gz	HJVYSTBIDAVUNY-MSOLQXFVSA-N	0	0	296.345	4.030	20	30		CIEDRN
N#Cc1cc(F)ccc1CN1CCC[C@H]1c1cccs1	ZINC000171373924	335063793	/nfs/dbraw/zinc/06/37/93/335063793.db2.gz	KUKKKYHFKFABGK-HNNXBMFYSA-N	0	0	286.375	4.096	20	30		CIEDRN
N#Cc1ccc(Oc2ccc(Cl)c(F)c2)c([N+](=O)[O-])c1	ZINC000120622806	129135178	/nfs/dbraw/zinc/13/51/78/129135178.db2.gz	KRPRKKCRLJOHJO-UHFFFAOYSA-N	0	0	292.653	4.051	20	30		CIEDRN
C[C@@H](Nc1ccc(Cl)c(C#N)n1)[C@@H](C)c1ccccc1	ZINC000301479607	533553472	/nfs/dbraw/zinc/55/34/72/533553472.db2.gz	RACKHQRBPQMXSU-VXGBXAGGSA-N	0	0	285.778	4.211	20	30		CIEDRN
N#Cc1cccc(NC(=O)C[C@@H]2CCCc3ccccc32)c1	ZINC000341744903	130017783	/nfs/dbraw/zinc/01/77/83/130017783.db2.gz	ITITVFWICGPEQG-INIZCTEOSA-N	0	0	290.366	4.007	20	30		CIEDRN
Cc1sc(NC(=O)c2cc(C)ccc2C)c(C#N)c1C	ZINC000005144859	170070628	/nfs/dbraw/zinc/07/06/28/170070628.db2.gz	NSPIFHAYSRVKIN-UHFFFAOYSA-N	0	0	284.384	4.106	20	30		CIEDRN
CC(C)(C)c1ccc(NC(=O)c2cccc(C#N)c2)cc1	ZINC000005577611	170115659	/nfs/dbraw/zinc/11/56/59/170115659.db2.gz	LNMXHBRRYUAOJI-UHFFFAOYSA-N	0	0	278.355	4.108	20	30		CIEDRN
COc1cc(C#N)cc(Cl)c1OC/C=C\c1ccccc1	ZINC000006603447	170218466	/nfs/dbraw/zinc/21/84/66/170218466.db2.gz	IECXIEKQZXGRQI-YVMONPNESA-N	0	0	299.757	4.312	20	30		CIEDRN
N#Cc1cccc(OCc2cc3ccccc3nc2Cl)c1	ZINC000007441625	170285033	/nfs/dbraw/zinc/28/50/33/170285033.db2.gz	KERRENQROPIONR-UHFFFAOYSA-N	0	0	294.741	4.339	20	30		CIEDRN
CC(C)c1ccc(C(=O)Nc2ccc(CC#N)cc2)cc1	ZINC000008125635	170320113	/nfs/dbraw/zinc/32/01/13/170320113.db2.gz	AUKLXRIELMSLTL-UHFFFAOYSA-N	0	0	278.355	4.128	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)c2ccc(C)cc2)c1	ZINC000009823870	170386576	/nfs/dbraw/zinc/38/65/76/170386576.db2.gz	BCXBKOPPZXQZEX-UHFFFAOYSA-N	0	0	281.355	4.202	20	30		CIEDRN
N#Cc1ccc(NC(=O)c2ccc(Cl)s2)cc1Cl	ZINC000015543199	170670039	/nfs/dbraw/zinc/67/00/39/170670039.db2.gz	JCCBNCQEWMBMIK-UHFFFAOYSA-N	0	0	297.166	4.179	20	30		CIEDRN
COc1ccc(C)cc1N[C@H](C)c1ccc(C#N)cc1	ZINC000019914361	170924473	/nfs/dbraw/zinc/92/44/73/170924473.db2.gz	BCNNHOODGVFFCO-CYBMUJFWSA-N	0	0	266.344	4.048	20	30		CIEDRN
CC(C)c1ccc(NCc2cc(C#N)ccc2F)cc1	ZINC000020047403	170977910	/nfs/dbraw/zinc/97/79/10/170977910.db2.gz	XMJLLDKXISJQIW-UHFFFAOYSA-N	0	0	268.335	4.433	20	30		CIEDRN
Cc1cc(C)c(C)c(OCc2cccc(C#N)c2)c1	ZINC000020362793	171161641	/nfs/dbraw/zinc/16/16/41/171161641.db2.gz	MUDIWFASNFHBMW-UHFFFAOYSA-N	0	0	251.329	4.063	20	30		CIEDRN
Cc1ccc(F)c(N[C@@H](C)c2ccc(C#N)cc2)c1	ZINC000020471772	171214424	/nfs/dbraw/zinc/21/44/24/171214424.db2.gz	ZYHAZVNTABYCAS-LBPRGKRZSA-N	0	0	254.308	4.179	20	30		CIEDRN
N#Cc1ccc(N[C@@H](c2ccccc2)c2ccccn2)cc1	ZINC000020828561	171275174	/nfs/dbraw/zinc/27/51/74/171275174.db2.gz	QIPFOQZXSMBIQJ-IBGZPJMESA-N	0	0	285.350	4.155	20	30		CIEDRN
N#Cc1ccccc1NCc1ccc(Cl)cc1Cl	ZINC000021518094	171313968	/nfs/dbraw/zinc/31/39/68/171313968.db2.gz	DBWRGAUZOXQWIN-UHFFFAOYSA-N	0	0	277.154	4.477	20	30		CIEDRN
N#Cc1cccc(COc2ccc(Cl)cc2Cl)c1	ZINC000021812950	171330010	/nfs/dbraw/zinc/33/00/10/171330010.db2.gz	TXLZDCSGCZRFTL-UHFFFAOYSA-N	0	0	278.138	4.444	20	30		CIEDRN
N#Cc1cccnc1Oc1cc(Cl)cc(Cl)c1	ZINC000022806417	171399971	/nfs/dbraw/zinc/39/99/71/171399971.db2.gz	BCZLUHFRRBUDOW-UHFFFAOYSA-N	0	0	265.099	4.052	20	30		CIEDRN
C[C@H](CCc1ccccc1)Nc1cccc(F)c1C#N	ZINC000035134940	172001494	/nfs/dbraw/zinc/00/14/94/172001494.db2.gz	VDOAXTZEJQAKID-CYBMUJFWSA-N	0	0	268.335	4.131	20	30		CIEDRN
N#Cc1ccc(Oc2ccc(-c3ccccc3)cc2)nc1	ZINC000035216990	172057806	/nfs/dbraw/zinc/05/78/06/172057806.db2.gz	ZQCHMWWKCUDZEY-UHFFFAOYSA-N	0	0	272.307	4.413	20	30		CIEDRN
N#Cc1c(F)cccc1NCc1cc2ccccc2o1	ZINC000036138470	172462309	/nfs/dbraw/zinc/46/23/09/172462309.db2.gz	PUEIORABOKMWIB-UHFFFAOYSA-N	0	0	266.275	4.056	20	30		CIEDRN
CCOc1ccccc1CNc1cc(Cl)ccc1C#N	ZINC000036954247	172826562	/nfs/dbraw/zinc/82/65/62/172826562.db2.gz	KWOGTSJQIHMAQL-UHFFFAOYSA-N	0	0	286.762	4.222	20	30		CIEDRN
CCCCCCCC(=O)Nc1cc(Cl)ccc1O	ZINC000043781043	175105475	/nfs/dbraw/zinc/10/54/75/175105475.db2.gz	ZVJYWGLCOKVUCJ-UHFFFAOYSA-N	0	0	269.772	4.345	20	30		CIEDRN
CC(C)(C)c1ccc(NC(=O)C2(C#N)CCCCC2)cc1	ZINC000044385157	175169636	/nfs/dbraw/zinc/16/96/36/175169636.db2.gz	BMWVCDMELGDIHR-UHFFFAOYSA-N	0	0	284.403	4.397	20	30		CIEDRN
C[C@H](Cc1cccs1)Nc1ccc(C#N)c(Cl)c1	ZINC000071271113	176104320	/nfs/dbraw/zinc/10/43/20/176104320.db2.gz	LLZFRIXCUUWGOZ-SNVBAGLBSA-N	0	0	276.792	4.316	20	30		CIEDRN
COc1ccc(Nc2ccc(F)cc2C#N)cc1Cl	ZINC000071627772	176235590	/nfs/dbraw/zinc/23/55/90/176235590.db2.gz	GMUNVUSLTYVERF-UHFFFAOYSA-N	0	0	276.698	4.103	20	30		CIEDRN
N#CCCCSc1nc(-c2ccco2)nc2ccccc21	ZINC000071817004	176269373	/nfs/dbraw/zinc/26/93/73/176269373.db2.gz	OZULRGVLVOQZDN-UHFFFAOYSA-N	0	0	295.367	4.286	20	30		CIEDRN
N#Cc1cccnc1Oc1cc(C(F)(F)F)ccc1Cl	ZINC000075914749	176829314	/nfs/dbraw/zinc/82/93/14/176829314.db2.gz	RFHOHHHRZQMVJL-UHFFFAOYSA-N	0	0	298.651	4.418	20	30		CIEDRN
N#CCCCOc1ccc(C(=O)c2ccc(Cl)cc2)cc1	ZINC000078803088	177390309	/nfs/dbraw/zinc/39/03/09/177390309.db2.gz	XHEAHZQYZHNLDR-UHFFFAOYSA-N	0	0	299.757	4.254	20	30		CIEDRN
C[C@@H](CCC#N)Sc1nnc(NC2CCCCC2)s1	ZINC000188221613	260075981	/nfs/dbraw/zinc/07/59/81/260075981.db2.gz	NYJUSJAMNMEZPS-JTQLQIEISA-N	0	0	296.465	4.067	20	30		CIEDRN
N#CC1(CSCc2csc(Br)c2)CC1	ZINC000344492326	225085340	/nfs/dbraw/zinc/08/53/40/225085340.db2.gz	ZCFWADCTOJEFQV-UHFFFAOYSA-N	0	0	288.235	4.048	20	30		CIEDRN
N#Cc1ccc(C[NH2+][C@@H]2CCc3sc(Cl)cc32)s1	ZINC000334756055	225309915	/nfs/dbraw/zinc/30/99/15/225309915.db2.gz	MJTMZHDGIZEHPU-LLVKDONJSA-N	0	0	294.832	4.112	20	30		CIEDRN
COc1ccc(C)cc1N[C@@H](C)c1ccc(OCC#N)cc1	ZINC000192920540	227384875	/nfs/dbraw/zinc/38/48/75/227384875.db2.gz	OVUKQEWUVYCVOH-AWEZNQCLSA-N	0	0	296.370	4.079	20	30		CIEDRN
Cc1nc(S[C@@H](C)c2cccc(C#N)c2)oc1C	ZINC000336432497	227007824	/nfs/dbraw/zinc/00/78/24/227007824.db2.gz	CCEJRLWQVKNEKA-NSHDSACASA-N	0	0	258.346	4.016	20	30		CIEDRN
N#Cc1ccc(CSCc2nc(C3CCCC3)no2)cc1	ZINC000171790875	335080152	/nfs/dbraw/zinc/08/01/52/335080152.db2.gz	UYQPQTOYNHTRDL-UHFFFAOYSA-N	0	0	299.399	4.032	20	30		CIEDRN
N#Cc1cccc(CNc2ccc(F)c(C3CC3)c2)c1F	ZINC000352631641	227130094	/nfs/dbraw/zinc/13/00/94/227130094.db2.gz	VZHHCECBYNOAFT-UHFFFAOYSA-N	0	0	284.309	4.326	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc([C@H](OCC)c2ccccc2)no1	ZINC000575217567	335082805	/nfs/dbraw/zinc/08/28/05/335082805.db2.gz	RWXJAXWFCKGZQI-PBHICJAKSA-N	0	0	286.375	4.049	20	30		CIEDRN
CSc1ccc(NCc2nc(C#N)cs2)cc1Cl	ZINC000352811120	227248882	/nfs/dbraw/zinc/24/88/82/227248882.db2.gz	QTFAUWHKZNPFQH-UHFFFAOYSA-N	0	0	295.820	4.002	20	30		CIEDRN
N#CC1(C(=O)N[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)CCCC1	ZINC000329036358	227266849	/nfs/dbraw/zinc/26/68/49/227266849.db2.gz	RIHNQXSLIKJTLV-RRFJBIMHSA-N	0	0	274.408	4.386	20	30		CIEDRN
N#CC1(C(=O)N[C@@H]2CC[C@@H]3CCCC[C@H]3C2)CCCC1	ZINC000329036359	227267264	/nfs/dbraw/zinc/26/72/64/227267264.db2.gz	RIHNQXSLIKJTLV-SOUVJXGZSA-N	0	0	274.408	4.386	20	30		CIEDRN
N#Cc1ccc(NC2CC2)c(NC(=O)CC2CCCC2)c1	ZINC000329128759	227316459	/nfs/dbraw/zinc/31/64/59/227316459.db2.gz	ZRXAUMKQULPMCJ-UHFFFAOYSA-N	0	0	283.375	4.301	20	30		CIEDRN
Cc1nnc(NC(=O)C[C@@H]2CCCC(C)(C)C2)n1C1CC1	ZINC000329160087	227332560	/nfs/dbraw/zinc/33/25/60/227332560.db2.gz	XYSVXDPDSUTCND-LBPRGKRZSA-N	0	0	290.411	4.116	20	30		CIEDRN
Cc1nnc(NC(=O)CC2CCC(C)(C)CC2)n1C1CC1	ZINC000329158404	227333756	/nfs/dbraw/zinc/33/37/56/227333756.db2.gz	WXGYHNOIKMMKEP-UHFFFAOYSA-N	0	0	290.411	4.116	20	30		CIEDRN
NC(=O)[C@@H]1CCC[C@@H](C(=O)NC(C2CCC2)C2CCC2)C1	ZINC000329183335	227342568	/nfs/dbraw/zinc/34/25/68/227342568.db2.gz	FOZUMDSLFULINT-ZIAGYGMSSA-N	0	0	292.423	4.253	20	30		CIEDRN
N#Cc1ccc(N[C@@H](c2ccccc2)C2CCCC2)nc1	ZINC000301172628	227464909	/nfs/dbraw/zinc/46/49/09/227464909.db2.gz	VBKIWEBDNLDFGP-SFHVURJKSA-N	0	0	277.371	4.297	20	30		CIEDRN
Cc1nc(C)c(NC(=O)NC(C2CCC2)C2CCC2)s1	ZINC000329358864	227466787	/nfs/dbraw/zinc/46/67/87/227466787.db2.gz	HRIOGXVRJMPJNJ-UHFFFAOYSA-N	0	0	293.436	4.055	20	30		CIEDRN
Cc1cccc2c(CCNc3ccc(C#N)cc3)c[nH]c21	ZINC000301448357	227541973	/nfs/dbraw/zinc/54/19/73/227541973.db2.gz	WIVVVTWBILWZGU-UHFFFAOYSA-N	0	0	275.355	4.003	20	30		CIEDRN
N#Cc1c(Cl)nsc1N[C@@H](c1ccccc1)C1CC1	ZINC000301501304	227562728	/nfs/dbraw/zinc/56/27/28/227562728.db2.gz	DYHTTZNOSHQXBO-LBPRGKRZSA-N	0	0	289.791	4.231	20	30		CIEDRN
C[C@H]1CCN(c2cccc(F)c2C#N)[C@H](c2ccco2)C1	ZINC000301430772	227536495	/nfs/dbraw/zinc/53/64/95/227536495.db2.gz	IPLUEWRNPOJJPV-LRDDRELGSA-N	0	0	284.334	4.268	20	30		CIEDRN
N#Cc1cccc(N[C@@H](c2ccc(F)cc2)C2CCC2)n1	ZINC000301818994	227690649	/nfs/dbraw/zinc/69/06/49/227690649.db2.gz	FRXRCILYZLIIHW-QGZVFWFLSA-N	0	0	281.334	4.046	20	30		CIEDRN
C[C@H](Sc1cccc(C#N)n1)c1ccc(Cl)cc1	ZINC000301842801	227704514	/nfs/dbraw/zinc/70/45/14/227704514.db2.gz	KDHPAQRHZQYPHV-JTQLQIEISA-N	0	0	274.776	4.460	20	30		CIEDRN
Cc1ccc([C@@H]2[C@@H](C)CCCN2c2cccc(C#N)n2)cc1	ZINC000301874682	227713965	/nfs/dbraw/zinc/71/39/65/227713965.db2.gz	XUQHASNHYJSQLW-KXBFYZLASA-N	0	0	291.398	4.239	20	30		CIEDRN
N#Cc1ccc2nc(N3CCCc4ccccc4C3)ccc2c1	ZINC000301958061	227741068	/nfs/dbraw/zinc/74/10/68/227741068.db2.gz	AXSQHLIMGMNSPT-UHFFFAOYSA-N	0	0	299.377	4.059	20	30		CIEDRN
CS[C@H]1CCC[C@H](Nc2ccc3cc(C#N)ccc3n2)C1	ZINC000301980771	227749165	/nfs/dbraw/zinc/74/91/65/227749165.db2.gz	PUIKMMKMDSJUSH-GJZGRUSLSA-N	0	0	297.427	4.193	20	30		CIEDRN
C[C@H]1C[C@H](c2cccnc2)N(c2cc(Cl)ccc2C#N)C1	ZINC000302116922	227793573	/nfs/dbraw/zinc/79/35/73/227793573.db2.gz	DAZMXHKIXRXEOD-BLLLJJGKSA-N	0	0	297.789	4.194	20	30		CIEDRN
N#Cc1cc(N2CCC[C@H]2C2CCCCC2)ccc1[N+](=O)[O-]	ZINC000302181798	227814580	/nfs/dbraw/zinc/81/45/80/227814580.db2.gz	RBPHEXAZBCWSFU-INIZCTEOSA-N	0	0	299.374	4.016	20	30		CIEDRN
Cc1coc2ccc(NC(=O)NCC(C)(C)CCC#N)cc12	ZINC000351461606	227827342	/nfs/dbraw/zinc/82/73/42/227827342.db2.gz	PCUJJKKRBRFGOL-UHFFFAOYSA-N	0	0	299.374	4.193	20	30		CIEDRN
Cc1ccc(N(C)[C@H](C)c2cc3ccccc3o2)nc1C#N	ZINC000302667743	227873746	/nfs/dbraw/zinc/87/37/46/227873746.db2.gz	QOESVUIOTGIMGM-CYBMUJFWSA-N	0	0	291.354	4.205	20	30		CIEDRN
N#Cc1cccc(C#N)c1Oc1cccc(C(F)(F)F)c1	ZINC000302766644	227884230	/nfs/dbraw/zinc/88/42/30/227884230.db2.gz	AJKZPOJLQHSXJE-UHFFFAOYSA-N	0	0	288.228	4.241	20	30		CIEDRN
Cc1cc(C2CC2)nc(NC(=O)C2C[C@H](C)C[C@@H](C)C2)n1	ZINC000329807877	227954416	/nfs/dbraw/zinc/95/44/16/227954416.db2.gz	LTHPCUSLGVGQLI-GHMZBOCLSA-N	0	0	287.407	4.323	20	30		CIEDRN
Cc1nc(CC2CC2)oc1C(=O)N[C@@H]1CC[C@H](C)[C@H](C)C1	ZINC000330002035	228013178	/nfs/dbraw/zinc/01/31/78/228013178.db2.gz	ATMCCCUESIFOIM-MISXGVKJSA-N	0	0	290.407	4.065	20	30		CIEDRN
Cc1nc(CC2CC2)oc1C(=O)NC1[C@H](C)CCC[C@H]1C	ZINC000330031243	228021764	/nfs/dbraw/zinc/02/17/64/228021764.db2.gz	SWSOBXNOFTVIGS-GHMZBOCLSA-N	0	0	290.407	4.065	20	30		CIEDRN
N#CCCN(Cc1c(Cl)cccc1Cl)CC1CC1	ZINC000353417645	228099198	/nfs/dbraw/zinc/09/91/98/228099198.db2.gz	VSCAUOIBGOMAQQ-UHFFFAOYSA-N	0	0	283.202	4.119	20	30		CIEDRN
Cc1oc(C#N)cc1-c1nc(C2C[C@@H](C)C[C@H](C)C2)no1	ZINC000331573581	228112686	/nfs/dbraw/zinc/11/26/86/228112686.db2.gz	MGNJPIIWAUCDNO-UWVGGRQHSA-N	0	0	285.347	4.049	20	30		CIEDRN
Cc1ccc(-c2cccnc2)cc1NC(=O)[C@@]1(C)CCCO1	ZINC000330099648	228039557	/nfs/dbraw/zinc/03/95/57/228039557.db2.gz	ZVMKDCINOMHCHG-GOSISDBHSA-N	0	0	296.370	4.214	20	30		CIEDRN
C[C@H]1CCCCCN1C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000332365536	228157219	/nfs/dbraw/zinc/15/72/19/228157219.db2.gz	XNUJDNHALTYVNN-DOTOQJQBSA-N	0	0	299.418	4.006	20	30		CIEDRN
Cc1ccc(Cl)c(NC(=O)c2ccc(C#N)cc2C)c1C	ZINC000336142447	228196665	/nfs/dbraw/zinc/19/66/65/228196665.db2.gz	GSLIDMBMJKQQJV-UHFFFAOYSA-N	0	0	298.773	4.389	20	30		CIEDRN
N#Cc1ccc(C(=O)Nc2csc3ccccc23)cc1	ZINC000352205026	228198102	/nfs/dbraw/zinc/19/81/02/228198102.db2.gz	CNFYSTOBAZXFKO-UHFFFAOYSA-N	0	0	278.336	4.025	20	30		CIEDRN
CCc1occc1C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000352219972	228200817	/nfs/dbraw/zinc/20/08/17/228200817.db2.gz	UHTVBRXZALBPSO-MRXNPFEDSA-N	0	0	296.370	4.007	20	30		CIEDRN
N#CCCC[C@H](NC(=O)CCC1CCC1)c1ccccc1	ZINC000352224908	228201361	/nfs/dbraw/zinc/20/13/61/228201361.db2.gz	FPLDMYZTXDVVBS-KRWDZBQOSA-N	0	0	284.403	4.118	20	30		CIEDRN
C[C@@H]1CCC[C@](C#N)(NC(=O)c2cc3ccccc3s2)C1	ZINC000116800165	260005810	/nfs/dbraw/zinc/00/58/10/260005810.db2.gz	VJSOPAKDWXDDJP-PXAZEXFGSA-N	0	0	298.411	4.104	20	30		CIEDRN
Cc1ccccc1NCc1ccc(Cl)cc1C#N	ZINC000187703200	260029182	/nfs/dbraw/zinc/02/91/82/260029182.db2.gz	BZMKEXLERVAGPV-UHFFFAOYSA-N	0	0	256.736	4.132	20	30		CIEDRN
C=CCC[C@H](C(=O)N[C@H](C)c1cccnc1)c1ccccc1	ZINC000187479716	260038716	/nfs/dbraw/zinc/03/87/16/260038716.db2.gz	JBTWFURTRSFOAZ-QAPCUYQASA-N	0	0	294.398	4.009	20	30		CIEDRN
C=CCC[C@H](C(=O)N[C@@H](C)c1cccnc1)c1ccccc1	ZINC000187479698	260039085	/nfs/dbraw/zinc/03/90/85/260039085.db2.gz	JBTWFURTRSFOAZ-YJBOKZPZSA-N	0	0	294.398	4.009	20	30		CIEDRN
N#Cc1cccc(COc2ccc(F)cc2Cl)c1F	ZINC000219761495	260041882	/nfs/dbraw/zinc/04/18/82/260041882.db2.gz	KYDOMNLIBWRMCC-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
Cc1cc(N(C)C)ccc1N[C@@H](C)c1ccc(C#N)cc1	ZINC000036934877	260052392	/nfs/dbraw/zinc/05/23/92/260052392.db2.gz	ITDMSDQOGHLFKH-AWEZNQCLSA-N	0	0	279.387	4.106	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC(c2ccsc2)CC1	ZINC000187840475	260061754	/nfs/dbraw/zinc/06/17/54/260061754.db2.gz	ZPGPTRDHKQREKP-ZDUSSCGKSA-N	0	0	277.433	4.056	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N(Cc1ccccc1)c1ccncc1	ZINC000188050370	260069744	/nfs/dbraw/zinc/06/97/44/260069744.db2.gz	PYDRFRPEHUWLLA-LJQANCHMSA-N	0	0	294.398	4.217	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1c(C)ccn1C	ZINC000188062055	260070567	/nfs/dbraw/zinc/07/05/67/260070567.db2.gz	RKLWHPDBNYXGQA-UHFFFAOYSA-N	0	0	296.414	4.438	20	30		CIEDRN
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)Sc1cc(C#N)ccn1	ZINC000180035891	260090229	/nfs/dbraw/zinc/09/02/29/260090229.db2.gz	UQUHNCLIPSKWGZ-LLVKDONJSA-N	0	0	299.355	4.023	20	30		CIEDRN
CC(C)(C)C[C@@H](NCc1cc(C#N)cs1)C(F)(F)F	ZINC000180366399	260099008	/nfs/dbraw/zinc/09/90/08/260099008.db2.gz	NZPKAPNYTBROIW-LLVKDONJSA-N	0	0	290.354	4.076	20	30		CIEDRN
C=C(C)CN(C)C(=O)CCCc1csc2ccccc12	ZINC000180450156	260102292	/nfs/dbraw/zinc/10/22/92/260102292.db2.gz	MVIMTVPPHJFXIT-UHFFFAOYSA-N	0	0	287.428	4.259	20	30		CIEDRN
Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(C#N)cc2)cc1	ZINC000037508451	260113660	/nfs/dbraw/zinc/11/36/60/260113660.db2.gz	YLSWJHFIKQZJCU-LSDHHAIUSA-N	0	0	264.372	4.279	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1ccc(-c2ccccn2)cc1	ZINC000517751223	260122008	/nfs/dbraw/zinc/12/20/08/260122008.db2.gz	MYUVDVGEXUUFGQ-OAHLLOKOSA-N	0	0	295.386	4.225	20	30		CIEDRN
C=C(C)CS[C@H](C)C(=O)Nc1c(C)cc(C)cc1C	ZINC000357036495	260123015	/nfs/dbraw/zinc/12/30/15/260123015.db2.gz	KOIIADBIMXXTKE-CQSZACIVSA-N	0	0	277.433	4.248	20	30		CIEDRN
C#CCN(C(=O)Nc1c(CC=C)cccc1C(C)C)C1CC1	ZINC000297656445	260131016	/nfs/dbraw/zinc/13/10/16/260131016.db2.gz	DRGFEDJBOCEBOD-UHFFFAOYSA-N	0	0	296.414	4.168	20	30		CIEDRN
C#CCN(C(=O)Nc1c(CCC)cccc1C(C)C)C1CC1	ZINC000297664573	260132267	/nfs/dbraw/zinc/13/22/67/260132267.db2.gz	FFNANBPPKWTDPI-UHFFFAOYSA-N	0	0	298.430	4.392	20	30		CIEDRN
Cc1cc([C@@H](C)Nc2ccc(C#N)cc2)c(C)s1	ZINC000019991185	260148303	/nfs/dbraw/zinc/14/83/03/260148303.db2.gz	PDCDPZNFJDRQKE-LLVKDONJSA-N	0	0	256.374	4.410	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H](C)c1ncc(-c2ccccc2)o1	ZINC000188489399	260149029	/nfs/dbraw/zinc/14/90/29/260149029.db2.gz	YRPAZYFIWCVFHT-FZKQIMNGSA-N	0	0	298.386	4.121	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(Oc2ccncc2)cc1	ZINC000187721075	260163764	/nfs/dbraw/zinc/16/37/64/260163764.db2.gz	RTIWRFMYPZKYDY-SFHVURJKSA-N	0	0	296.370	4.415	20	30		CIEDRN
N#Cc1ccccc1C[S@@](=O)c1ccc2ccccc2c1	ZINC000084265124	260191388	/nfs/dbraw/zinc/19/13/88/260191388.db2.gz	GLWIWPZFCIQSMA-NRFANRHFSA-N	0	0	291.375	4.019	20	30		CIEDRN
COc1cc(C)ccc1NCc1ccc(Cl)cc1C#N	ZINC000187724429	260214380	/nfs/dbraw/zinc/21/43/80/260214380.db2.gz	OKHALBWNKICJEA-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
CSc1ccc(/C=C/C(=O)c2cnn(C(C)C)c2)cc1	ZINC000058465419	260227046	/nfs/dbraw/zinc/22/70/46/260227046.db2.gz	RPMHMAMLAZKTRU-RMKNXTFCSA-N	0	0	286.400	4.082	20	30		CIEDRN
CCOc1cc(C#N)ccc1OC[C@@H]1CCCC(F)(F)C1	ZINC000313091733	260247044	/nfs/dbraw/zinc/24/70/44/260247044.db2.gz	UFMSNSKHBVBINK-CYBMUJFWSA-N	0	0	295.329	4.161	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(OC(C)C)cc1C	ZINC000526047216	260262326	/nfs/dbraw/zinc/26/23/26/260262326.db2.gz	XJWUJCYHOOYLSV-QGZVFWFLSA-N	0	0	275.392	4.323	20	30		CIEDRN
C=CCCC(=O)Nc1ccccc1-c1csc(C)n1	ZINC000357668893	260273516	/nfs/dbraw/zinc/27/35/16/260273516.db2.gz	VLMPVCJXMUIVPK-UHFFFAOYSA-N	0	0	272.373	4.023	20	30		CIEDRN
CCSc1cccc(NC(=O)C2(C#N)CCCCC2)c1	ZINC000072701419	260277831	/nfs/dbraw/zinc/27/78/31/260277831.db2.gz	HDBGJSHKXFXPBH-UHFFFAOYSA-N	0	0	288.416	4.211	20	30		CIEDRN
N#CCSCCCSc1nc2ccccc2s1	ZINC000075075386	260289093	/nfs/dbraw/zinc/28/90/93/260289093.db2.gz	ULXMVWYYRGVHGP-UHFFFAOYSA-N	0	0	280.443	4.035	20	30		CIEDRN
Cc1cccc2c1CC[C@H]2Nc1cccc(F)c1C#N	ZINC000517873582	260313052	/nfs/dbraw/zinc/31/30/52/260313052.db2.gz	GEOYVLKPUKANKR-QGZVFWFLSA-N	0	0	266.319	4.105	20	30		CIEDRN
C=C(C)CCc1noc(CO[C@H]2CCCc3ccccc32)n1	ZINC000518005848	260333398	/nfs/dbraw/zinc/33/33/98/260333398.db2.gz	AIJHWCCHLZGYQD-INIZCTEOSA-N	0	0	298.386	4.173	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(C[C@@H](C)c2ccccc2)no1	ZINC000518006911	260333878	/nfs/dbraw/zinc/33/38/78/260333878.db2.gz	VDWFCQKEARZBKO-KGLIPLIRSA-N	0	0	270.376	4.486	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N[C@@H]1CCc2sc(Cl)cc21	ZINC000518021971	260335112	/nfs/dbraw/zinc/33/51/12/260335112.db2.gz	GATWRYIZAUUYGD-MWLCHTKSSA-N	0	0	298.839	4.043	20	30		CIEDRN
CSc1cccc(F)c1CNc1ccc(F)cc1C#N	ZINC000518148940	260346176	/nfs/dbraw/zinc/34/61/76/260346176.db2.gz	XBBBYMOFDUEIRM-UHFFFAOYSA-N	0	0	290.338	4.170	20	30		CIEDRN
C=C1CCN(C(=O)C2(c3ccccc3C)CCCCC2)CC1	ZINC000518181661	260349411	/nfs/dbraw/zinc/34/94/11/260349411.db2.gz	LBEAKCSNHNWMSP-UHFFFAOYSA-N	0	0	297.442	4.376	20	30		CIEDRN
Cc1cccc(Cl)c1NCc1ccc(C#N)cc1F	ZINC000090532899	260366951	/nfs/dbraw/zinc/36/69/51/260366951.db2.gz	QAJJOLKNZVOIKD-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
N#Cc1cc(F)c(NCC2CCC(F)(F)CC2)c(F)c1	ZINC000409664812	260422728	/nfs/dbraw/zinc/42/27/28/260422728.db2.gz	YCLKMKRHBPOFIE-UHFFFAOYSA-N	0	0	286.272	4.074	20	30		CIEDRN
CCCOc1ccccc1NCC(C)(C)CCC#N	ZINC000092128538	260485080	/nfs/dbraw/zinc/48/50/80/260485080.db2.gz	RNKGODWRUYFDMY-UHFFFAOYSA-N	0	0	260.381	4.217	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)C[C@H](C)c1cccnc1	ZINC000410358920	260489925	/nfs/dbraw/zinc/48/99/25/260489925.db2.gz	IZVKQJKDMWUZCE-HNNXBMFYSA-N	0	0	294.398	4.333	20	30		CIEDRN
Cc1ccc(Cl)cc1NCC(C)(C)CCC#N	ZINC000092108289	260492506	/nfs/dbraw/zinc/49/25/06/260492506.db2.gz	AJQGDMWDJWFYIJ-UHFFFAOYSA-N	0	0	250.773	4.390	20	30		CIEDRN
C=CCCCNC(=O)N1CCC[C@H]1c1cc(C)ccc1C	ZINC000448032530	260637191	/nfs/dbraw/zinc/63/71/91/260637191.db2.gz	VPGRWPPKCPRDDD-KRWDZBQOSA-N	0	0	286.419	4.116	20	30		CIEDRN
C=CCCCC(=O)N1CCC(c2c(F)cccc2F)CC1	ZINC000375330714	260659301	/nfs/dbraw/zinc/65/93/01/260659301.db2.gz	DABLNVYZZYAKAY-UHFFFAOYSA-N	0	0	293.357	4.027	20	30		CIEDRN
C=CCCCNC(=O)N[C@@H](CC)c1ccc(Cl)cc1	ZINC000448035021	260671283	/nfs/dbraw/zinc/67/12/83/260671283.db2.gz	NBMGBYAILVIMCR-AWEZNQCLSA-N	0	0	280.799	4.057	20	30		CIEDRN
C=C(C)CCSCC(=O)N1CCC[C@H]1c1cccs1	ZINC000375639853	260671830	/nfs/dbraw/zinc/67/18/30/260671830.db2.gz	GJHKRPKEVXUBPQ-ZDUSSCGKSA-N	0	0	295.473	4.111	20	30		CIEDRN
N#Cc1cc(CSc2ccc(Cl)cn2)ccc1F	ZINC000158484772	260672655	/nfs/dbraw/zinc/67/26/55/260672655.db2.gz	IZMGRYCCJOUWGO-UHFFFAOYSA-N	0	0	278.739	4.038	20	30		CIEDRN
CC(C)c1ccccc1NCc1cccc(F)c1C#N	ZINC000427518514	260758091	/nfs/dbraw/zinc/75/80/91/260758091.db2.gz	GQHMVGUTWVENGD-UHFFFAOYSA-N	0	0	268.335	4.433	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1ccnc(SCC)c1	ZINC000156767622	260806911	/nfs/dbraw/zinc/80/69/11/260806911.db2.gz	MNSJLEUXGFSFIE-UHFFFAOYSA-N	0	0	292.448	4.012	20	30		CIEDRN
Clc1cccc(C#CCSCc2ccco2)c1	ZINC000448105024	260838232	/nfs/dbraw/zinc/83/82/32/260838232.db2.gz	MZIJJOSNOZYTMA-UHFFFAOYSA-N	0	0	262.761	4.218	20	30		CIEDRN
C=CCC[C@@H](C(=O)NC[C@@H](C)C(F)(F)F)c1ccccc1	ZINC000427817464	260846313	/nfs/dbraw/zinc/84/63/13/260846313.db2.gz	LTUZCEZTAUAPTH-TZMCWYRMSA-N	0	0	299.336	4.051	20	30		CIEDRN
CC(C)(C#N)CCN(Cc1ccco1)Cc1cccs1	ZINC000130921544	260866066	/nfs/dbraw/zinc/86/60/66/260866066.db2.gz	KNYSEZZBSOOPDI-UHFFFAOYSA-N	0	0	288.416	4.283	20	30		CIEDRN
CC(C)(C#N)c1ccccc1CO/N=C/c1cccs1	ZINC000133836098	260909991	/nfs/dbraw/zinc/90/99/91/260909991.db2.gz	IYSDAMZDMICKTI-VCHYOVAHSA-N	0	0	284.384	4.100	20	30		CIEDRN
C[C@H](CCC(=O)Nc1sccc1C#N)c1ccccc1	ZINC000136564127	260927506	/nfs/dbraw/zinc/92/75/06/260927506.db2.gz	QYAZNLCIZCCNNV-GFCCVEGCSA-N	0	0	284.384	4.142	20	30		CIEDRN
C[C@@H](c1cccc(Cl)c1)[S@@](=O)CCCC(C)(C)C#N	ZINC000150895117	260974945	/nfs/dbraw/zinc/97/49/45/260974945.db2.gz	WGVVFPCSOCPOAM-HXPMCKFVSA-N	0	0	297.851	4.480	20	30		CIEDRN
Cc1ccc(C#N)c(NCc2cccc3ccccc32)n1	ZINC000052062352	261054328	/nfs/dbraw/zinc/05/43/28/261054328.db2.gz	WVNMUNSNNJQGDE-UHFFFAOYSA-N	0	0	273.339	4.027	20	30		CIEDRN
CCOc1cc(C)ccc1NCCCC(C)(C)C#N	ZINC000153427402	261078251	/nfs/dbraw/zinc/07/82/51/261078251.db2.gz	CBWDKSWEXOKDJW-UHFFFAOYSA-N	0	0	260.381	4.136	20	30		CIEDRN
N#Cc1ccc(CNc2ccccc2CCC(F)(F)F)o1	ZINC000153719470	261082389	/nfs/dbraw/zinc/08/23/89/261082389.db2.gz	QUQAHQOACFLFSX-UHFFFAOYSA-N	0	0	294.276	4.258	20	30		CIEDRN
C[C@H](N[C@@H](C)c1cccnc1Cl)c1ccc(C#N)cc1	ZINC000154325660	261090274	/nfs/dbraw/zinc/09/02/74/261090274.db2.gz	CXUYRMGTVWSINU-RYUDHWBXSA-N	0	0	285.778	4.018	20	30		CIEDRN
CCN(C[C@@H](C)C#N)C(=O)C1=C(c2ccccc2)CCCC1	ZINC000448727809	261114683	/nfs/dbraw/zinc/11/46/83/261114683.db2.gz	ZWEFTTXWVNNCNI-HNNXBMFYSA-N	0	0	296.414	4.022	20	30		CIEDRN
CC1(C#N)CCC(Nc2cccc(OC(F)(F)F)c2)CC1	ZINC000449039780	261120572	/nfs/dbraw/zinc/12/05/72/261120572.db2.gz	DYQCXQXOHUHRDK-UHFFFAOYSA-N	0	0	298.308	4.470	20	30		CIEDRN
C[C@H](SCc1nccs1)c1ccc(C#N)cc1	ZINC000161682709	261122282	/nfs/dbraw/zinc/12/22/82/261122282.db2.gz	FRBFQOVHDRKROZ-JTQLQIEISA-N	0	0	260.387	4.009	20	30		CIEDRN
CC(C)(CCC#N)CNc1cccc(Oc2cnccn2)c1	ZINC000156411621	261123125	/nfs/dbraw/zinc/12/31/25/261123125.db2.gz	OWVXOYODHVLYDH-UHFFFAOYSA-N	0	0	296.374	4.011	20	30		CIEDRN
C=CCCCNC(=O)N(C1CC1)[C@H]1CCCc2ccccc21	ZINC000448391023	261138027	/nfs/dbraw/zinc/13/80/27/261138027.db2.gz	SKLOLOYHEZPVIP-SFHVURJKSA-N	0	0	298.430	4.204	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)N[C@H](C)C1CCCC1	ZINC000172194681	261152765	/nfs/dbraw/zinc/15/27/65/261152765.db2.gz	GQBOLWNWCXUWOR-CYBMUJFWSA-N	0	0	292.448	4.024	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(Oc2ccccc2)cn1	ZINC000464435930	261181389	/nfs/dbraw/zinc/18/13/89/261181389.db2.gz	AYAKIOBKEMKIIX-CQSZACIVSA-N	0	0	296.370	4.415	20	30		CIEDRN
CCCCN(C)c1c(C#N)cnc2c(F)ccc(Cl)c21	ZINC000514083035	261200181	/nfs/dbraw/zinc/20/01/81/261200181.db2.gz	LJBSCRVABXWFAL-UHFFFAOYSA-N	0	0	291.757	4.135	20	30		CIEDRN
N#Cc1c(Cl)nsc1N[C@@H]1CCCc2sccc21	ZINC000161052861	261235251	/nfs/dbraw/zinc/23/52/51/261235251.db2.gz	NVXGEIHLZJVPCS-SECBINFHSA-N	0	0	295.820	4.219	20	30		CIEDRN
N#CCCCCSCCCOc1ccc(F)cc1	ZINC000161169091	261239487	/nfs/dbraw/zinc/23/94/87/261239487.db2.gz	WGALAQWAVCLWLN-UHFFFAOYSA-N	0	0	267.369	4.022	20	30		CIEDRN
C=CCCC(=O)N(Cc1cc(F)ccc1F)C1CCCC1	ZINC000175812873	261248198	/nfs/dbraw/zinc/24/81/98/261248198.db2.gz	MLZQSVLNVUEWIU-UHFFFAOYSA-N	0	0	293.357	4.202	20	30		CIEDRN
CC(C)c1nc(CSCCCCC#N)cs1	ZINC000161509170	261249391	/nfs/dbraw/zinc/24/93/91/261249391.db2.gz	SKKDMQHLLIIAEM-UHFFFAOYSA-N	0	0	254.424	4.194	20	30		CIEDRN
CCC(CC)CN(CCC#N)C(=O)Nc1cccc(F)c1	ZINC000176339280	261280199	/nfs/dbraw/zinc/28/01/99/261280199.db2.gz	UPDSCELWFMOIIZ-UHFFFAOYSA-N	0	0	291.370	4.009	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1ccc2nc(C)sc2c1	ZINC000104978144	261304411	/nfs/dbraw/zinc/30/44/11/261304411.db2.gz	GZMCMSZBATZNKC-UHFFFAOYSA-N	0	0	289.404	4.035	20	30		CIEDRN
CCc1nc(CSCc2cc(C#N)ccc2F)cs1	ZINC000105630752	261314227	/nfs/dbraw/zinc/31/42/27/261314227.db2.gz	GNWKCPJAEYTUIF-UHFFFAOYSA-N	0	0	292.404	4.150	20	30		CIEDRN
Cc1cc([C@H](C)Nc2c(C#N)cnc3ccccc32)c(C)o1	ZINC000301092051	261327097	/nfs/dbraw/zinc/32/70/97/261327097.db2.gz	FYZGJENNISEHFE-LBPRGKRZSA-N	0	0	291.354	4.489	20	30		CIEDRN
CC[C@H](CC(=O)Nc1ccc(F)cc1C#N)c1ccccc1	ZINC000177595797	261363302	/nfs/dbraw/zinc/36/33/02/261363302.db2.gz	NNSWWPGKGYEOSJ-CYBMUJFWSA-N	0	0	296.345	4.220	20	30		CIEDRN
CC(C)(CC(=O)Nc1ccc(F)cc1C#N)c1ccccc1	ZINC000177595372	261363427	/nfs/dbraw/zinc/36/34/27/261363427.db2.gz	KQHGPSGMGKEIKT-UHFFFAOYSA-N	0	0	296.345	4.004	20	30		CIEDRN
CC[C@@H](CC(=O)Nc1ccc(F)cc1C#N)c1ccccc1	ZINC000177595783	261363435	/nfs/dbraw/zinc/36/34/35/261363435.db2.gz	NNSWWPGKGYEOSJ-ZDUSSCGKSA-N	0	0	296.345	4.220	20	30		CIEDRN
Cc1ccc(CNc2cccc(OCCCC#N)c2)cc1F	ZINC000106410164	261371253	/nfs/dbraw/zinc/37/12/53/261371253.db2.gz	JOJHYNCCIWTMNW-UHFFFAOYSA-N	0	0	298.361	4.429	20	30		CIEDRN
N#Cc1cccc(C[S@](=O)c2ccc3ccccc3c2)c1	ZINC000108004621	261383158	/nfs/dbraw/zinc/38/31/58/261383158.db2.gz	OBWXXHAKNBEBOX-OAQYLSRUSA-N	0	0	291.375	4.019	20	30		CIEDRN
CC#CCCCC(=O)N[C@H]1c2ccccc2CCC[C@H]1C	ZINC000466306391	261390564	/nfs/dbraw/zinc/39/05/64/261390564.db2.gz	JSQMGZGTYMTVCT-DNVCBOLYSA-N	0	0	283.415	4.010	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)N1[C@H](C)C[C@@H]2CCCC[C@@H]21	ZINC000178541799	261396674	/nfs/dbraw/zinc/39/66/74/261396674.db2.gz	KPAZNEIXHKJMOD-IFIJOSMWSA-N	0	0	297.402	4.052	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)N1[C@H](C)C[C@H]2CCCC[C@@H]21	ZINC000178541768	261396751	/nfs/dbraw/zinc/39/67/51/261396751.db2.gz	KPAZNEIXHKJMOD-MRRJBJDNSA-N	0	0	297.402	4.052	20	30		CIEDRN
C#C[C@H](NCc1ccc(C(F)F)cc1)c1ccc(F)cc1	ZINC000491276709	261397790	/nfs/dbraw/zinc/39/77/90/261397790.db2.gz	KZUXUKFTEPWBQP-INIZCTEOSA-N	0	0	289.300	4.227	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N[C@@H](C)c1ccc(SC)cc1	ZINC000466379080	261398748	/nfs/dbraw/zinc/39/87/48/261398748.db2.gz	VNEBIIMAMDIMCT-GXTWGEPZSA-N	0	0	292.448	4.123	20	30		CIEDRN
C[C@@H](NCc1ccccc1C#N)c1cc2ccccc2o1	ZINC000181768381	261434722	/nfs/dbraw/zinc/43/47/22/261434722.db2.gz	JPDPKLMKBVXXOY-CYBMUJFWSA-N	0	0	276.339	4.155	20	30		CIEDRN
N#Cc1ccsc1NC(=O)C[C@H]1CCCc2ccccc21	ZINC000170986792	261454113	/nfs/dbraw/zinc/45/41/13/261454113.db2.gz	DDGITVGFGFBIBI-CYBMUJFWSA-N	0	0	296.395	4.068	20	30		CIEDRN
N#Cc1cc(Cl)ccc1NCc1cc(F)ccc1F	ZINC000111235076	261499880	/nfs/dbraw/zinc/49/98/80/261499880.db2.gz	LJTLQWPTJGHNBH-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
N#CCN(Cc1cnc(-c2ccccc2)s1)C1CCCC1	ZINC000172571662	261504468	/nfs/dbraw/zinc/50/44/68/261504468.db2.gz	MZBJCUPBHLSNCH-UHFFFAOYSA-N	0	0	297.427	4.078	20	30		CIEDRN
Cc1c(CSC(C)C)cccc1NC(=O)C(C)(C)C#N	ZINC000173367517	261530653	/nfs/dbraw/zinc/53/06/53/261530653.db2.gz	GKPRLHYVSXHRTD-UHFFFAOYSA-N	0	0	290.432	4.125	20	30		CIEDRN
C[C@H](Sc1nnc(C2CC2)s1)c1ccc(C#N)cc1	ZINC000173938230	261551008	/nfs/dbraw/zinc/55/10/08/261551008.db2.gz	KCSVKTQGUTVCPL-VIFPVBQESA-N	0	0	287.413	4.140	20	30		CIEDRN
CC(C(=O)N(Cc1ccc(C#N)cc1)C(C)C)=C1CCCC1	ZINC000176589977	261659433	/nfs/dbraw/zinc/65/94/33/261659433.db2.gz	BGRUKIQCJJJFIO-UHFFFAOYSA-N	0	0	296.414	4.186	20	30		CIEDRN
Cc1nc(CSCCCC(C)(C)C#N)sc1C	ZINC000178399064	261740500	/nfs/dbraw/zinc/74/05/00/261740500.db2.gz	DHOOSGKOONOHBU-UHFFFAOYSA-N	0	0	268.451	4.323	20	30		CIEDRN
CC[C@H](C)[C@H](C)C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000183014865	261775298	/nfs/dbraw/zinc/77/52/98/261775298.db2.gz	VLXHPKCEJBAINQ-STQMWFEESA-N	0	0	272.392	4.108	20	30		CIEDRN
C=CCCCC(=O)N[C@H](C)Cc1ccccc1C(F)(F)F	ZINC000182169410	261792010	/nfs/dbraw/zinc/79/20/10/261792010.db2.gz	SSVWVLWOAXPGAB-GFCCVEGCSA-N	0	0	299.336	4.109	20	30		CIEDRN
Cc1ccccc1[C@H](C)Nc1ccccc1O[C@@H](C)C#N	ZINC000182265034	261932215	/nfs/dbraw/zinc/93/22/15/261932215.db2.gz	QXAWLCPVTYTUAK-GJZGRUSLSA-N	0	0	280.371	4.459	20	30		CIEDRN
CCCCCCCC(=O)N(C)C[C@H](C)c1nccs1	ZINC000184975787	262035549	/nfs/dbraw/zinc/03/55/49/262035549.db2.gz	JLDUWZONUJZNPN-ZDUSSCGKSA-N	0	0	282.453	4.066	20	30		CIEDRN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)C1=CCCCCC1	ZINC000185713849	262068046	/nfs/dbraw/zinc/06/80/46/262068046.db2.gz	PWZFGOJLNNLCIJ-UHFFFAOYSA-N	0	0	296.414	4.186	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccccc1SCCC#N	ZINC000185727432	262068841	/nfs/dbraw/zinc/06/88/41/262068841.db2.gz	IXNQBAYTPBFUCC-ZDUSSCGKSA-N	0	0	288.416	4.233	20	30		CIEDRN
CC[C@H]1[C@H](C)CCN1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000186088193	262079254	/nfs/dbraw/zinc/07/92/54/262079254.db2.gz	KRGLQDYNKQRQEB-CJNGLKHVSA-N	0	0	299.418	4.140	20	30		CIEDRN
CCN(C(=O)C[C@@H]1C=CCCC1)[C@@H](C)c1ccc(C#N)cc1	ZINC000186525939	262097600	/nfs/dbraw/zinc/09/76/00/262097600.db2.gz	NCUFWQPXCQKPJS-JKSUJKDBSA-N	0	0	296.414	4.214	20	30		CIEDRN
CC(=O)c1sccc1OCc1ccccc1C(C)(C)C#N	ZINC000186572120	262100200	/nfs/dbraw/zinc/10/02/00/262100200.db2.gz	BSADNGVCRCUGRC-UHFFFAOYSA-N	0	0	299.395	4.331	20	30		CIEDRN
CC(C)c1ccc(/C=C/CC(=O)N(C)CC(C)(C)C#N)cc1	ZINC000497258900	262126720	/nfs/dbraw/zinc/12/67/20/262126720.db2.gz	BZNFTIHEOZKPOI-VOTSOKGWSA-N	0	0	298.430	4.221	20	30		CIEDRN
CC#CCCCC(=O)N1[C@H](C)CCC[C@@H]1c1ccccc1	ZINC000364067129	262134640	/nfs/dbraw/zinc/13/46/40/262134640.db2.gz	OWDBDBWJNWEVEG-SJLPKXTDSA-N	0	0	283.415	4.322	20	30		CIEDRN
C[C@@H](NC[C@H](C#N)CCC#N)c1cc(Cl)ccc1Cl	ZINC000187526845	262140088	/nfs/dbraw/zinc/14/00/88/262140088.db2.gz	VOOJAKLNIXFCBE-MNOVXSKESA-N	0	0	296.201	4.088	20	30		CIEDRN
CCOc1ccccc1CSc1ccccc1C#N	ZINC000525757889	262142952	/nfs/dbraw/zinc/14/29/52/262142952.db2.gz	UZQQPSIFVDGPFW-UHFFFAOYSA-N	0	0	269.369	4.249	20	30		CIEDRN
CN(CC(C)(C)C#N)C(=O)CC1CCC(C(C)(C)C)CC1	ZINC000497449134	262159161	/nfs/dbraw/zinc/15/91/61/262159161.db2.gz	ASXZTZBPSCQBJG-UHFFFAOYSA-N	0	0	292.467	4.237	20	30		CIEDRN
C=CCOc1ccc(C(=O)Nc2ccccc2CCC)cc1	ZINC000497445374	262161712	/nfs/dbraw/zinc/16/17/12/262161712.db2.gz	JTXSSJVJNLKEKF-UHFFFAOYSA-N	0	0	295.382	4.456	20	30		CIEDRN
C=C(C)CN(CC)C(=O)CCSc1ccc(C)c(C)c1	ZINC000497487783	262168364	/nfs/dbraw/zinc/16/83/64/262168364.db2.gz	GZNCLTRBGFVSLQ-UHFFFAOYSA-N	0	0	291.460	4.210	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CC=C(c2ccc(CC)cc2)CC1	ZINC000497541740	262174130	/nfs/dbraw/zinc/17/41/30/262174130.db2.gz	MQAVKAFSXQWMPK-UHFFFAOYSA-N	0	0	297.442	4.467	20	30		CIEDRN
C=CCCC(=O)N1[C@@H](c2ccccc2)CCC[C@@H]1C	ZINC000364177136	262180455	/nfs/dbraw/zinc/18/04/55/262180455.db2.gz	YBSCZRCDEDWTLG-GOEBONIOSA-N	0	0	257.377	4.095	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cccc(O[C@@H](C)CC)c1	ZINC000497634569	262183819	/nfs/dbraw/zinc/18/38/19/262183819.db2.gz	SHRBVQSYQHDADF-KBPBESRZSA-N	0	0	275.392	4.405	20	30		CIEDRN
N#CCC[C@@H](C#N)CSCc1ccccc1Cl	ZINC000190677862	262184983	/nfs/dbraw/zinc/18/49/83/262184983.db2.gz	SUOBPAXYWWQXAA-NSHDSACASA-N	0	0	264.781	4.017	20	30		CIEDRN
C=CCOc1ccc(CNc2ccc3c(c2)CCC3)cc1	ZINC000020017792	262185959	/nfs/dbraw/zinc/18/59/59/262185959.db2.gz	MLPISKHDNPZODP-UHFFFAOYSA-N	0	0	279.383	4.352	20	30		CIEDRN
N#CCCCSCc1ccc(OCC(F)(F)F)cc1	ZINC000190918482	262187026	/nfs/dbraw/zinc/18/70/26/262187026.db2.gz	JDNABFKMVGJLER-UHFFFAOYSA-N	0	0	289.322	4.165	20	30		CIEDRN
CC[C@@H](SCCCC#N)c1ccc(F)cc1F	ZINC000190953621	262187593	/nfs/dbraw/zinc/18/75/93/262187593.db2.gz	SQQHHKPXZQOCRB-CYBMUJFWSA-N	0	0	255.333	4.453	20	30		CIEDRN
C[C@@H](NC(=O)CC(C)(C)C#N)c1cc2ccccc2s1	ZINC000497679111	262188845	/nfs/dbraw/zinc/18/88/45/262188845.db2.gz	DYUCELSCLCPKSH-LLVKDONJSA-N	0	0	286.400	4.018	20	30		CIEDRN
N#Cc1cc(N2CCC3(C2)CCCCC3)nc2ccccc12	ZINC000319306943	262194779	/nfs/dbraw/zinc/19/47/79/262194779.db2.gz	HBIJHWOUVFZTLM-UHFFFAOYSA-N	0	0	291.398	4.267	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@H]1c1ccc(C)cc1	ZINC000364300144	262196866	/nfs/dbraw/zinc/19/68/66/262196866.db2.gz	AZMHGMGFSDBNFV-WBVHZDCISA-N	0	0	271.404	4.261	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H]1c1ccc(F)c(F)c1	ZINC000364311782	262199002	/nfs/dbraw/zinc/19/90/02/262199002.db2.gz	AAOIWGGKBKTQNS-MLGOLLRUSA-N	0	0	293.357	4.231	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)CC1CCCCC1	ZINC000497789538	262208749	/nfs/dbraw/zinc/20/87/49/262208749.db2.gz	IEGRVPCIIVYKME-UHFFFAOYSA-N	0	0	271.404	4.172	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)c1cc2c(s1)CCC2	ZINC000497796892	262210076	/nfs/dbraw/zinc/21/00/76/262210076.db2.gz	LHUQBOXCZAMURF-UHFFFAOYSA-N	0	0	297.423	4.065	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@@H](c1ccccc1C)C(C)(C)C	ZINC000497839382	262216378	/nfs/dbraw/zinc/21/63/78/262216378.db2.gz	HJMJKZMYYQTDQH-INIZCTEOSA-N	0	0	288.435	4.300	20	30		CIEDRN
Cc1ccc(N[C@@H]2CCC[C@@H](C#N)C2)cc1-c1ncco1	ZINC000193268200	262218869	/nfs/dbraw/zinc/21/88/69/262218869.db2.gz	ZOPOECXOTPZFCK-ZIAGYGMSSA-N	0	0	281.359	4.144	20	30		CIEDRN
Cc1coc(-c2cc(N[C@@H]3CCC[C@@H](C#N)C3)ccc2C)n1	ZINC000193269189	262219844	/nfs/dbraw/zinc/21/98/44/262219844.db2.gz	VCACKMQDJHYNAC-HUUCEWRRSA-N	0	0	295.386	4.453	20	30		CIEDRN
C[C@@H](Nc1ccc(C#N)cc1)c1cccc(OC(F)F)c1	ZINC000020091279	262228303	/nfs/dbraw/zinc/22/83/03/262228303.db2.gz	QXHDUXCRNTVTEB-LLVKDONJSA-N	0	0	288.297	4.333	20	30		CIEDRN
N#Cc1cc(F)ccc1NCCCCOCc1ccccc1	ZINC000390665107	262237218	/nfs/dbraw/zinc/23/72/18/262237218.db2.gz	SGAPQCQTCVJOHU-UHFFFAOYSA-N	0	0	298.361	4.106	20	30		CIEDRN
Cc1ccc(C)c([C@@H](C)N(C)C(=O)c2sccc2C#N)c1	ZINC000497978879	262243003	/nfs/dbraw/zinc/24/30/03/262243003.db2.gz	AIVLUOGTURDEPT-CYBMUJFWSA-N	0	0	298.411	4.070	20	30		CIEDRN
CC(C)(C#N)CCSCc1cccc(-n2cccn2)c1	ZINC000364584869	262254570	/nfs/dbraw/zinc/25/45/70/262254570.db2.gz	WGGVLDINEWATLA-UHFFFAOYSA-N	0	0	285.416	4.045	20	30		CIEDRN
CC[C@@H](CC#N)NCc1ccc(SC(F)(F)F)cc1	ZINC000054182010	262260091	/nfs/dbraw/zinc/26/00/91/262260091.db2.gz	AAQXFMUCOXQTKY-NSHDSACASA-N	0	0	288.338	4.080	20	30		CIEDRN
C=CCCCN(C)C(=O)c1cccc(-c2ccccn2)c1C	ZINC000119084931	262270643	/nfs/dbraw/zinc/27/06/43/262270643.db2.gz	DQAUZUWJFHZHTE-UHFFFAOYSA-N	0	0	294.398	4.095	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@@H](c3csc(C)c3)C2)CCC1	ZINC000365077955	262277295	/nfs/dbraw/zinc/27/72/95/262277295.db2.gz	QLORMTMWIGYEEO-CQSZACIVSA-N	0	0	289.444	4.119	20	30		CIEDRN
C=CCC1(C(=O)N2C[C@@H](c3cccs3)C[C@H]2C)CCC1	ZINC000365153175	262280559	/nfs/dbraw/zinc/28/05/59/262280559.db2.gz	ACWFTZYDTZHOAJ-KGLIPLIRSA-N	0	0	289.444	4.199	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cccc(Oc2ccncc2)c1	ZINC000188391096	262293596	/nfs/dbraw/zinc/29/35/96/262293596.db2.gz	KXTUOXSUTFMEJL-SFHVURJKSA-N	0	0	296.370	4.415	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CCCC2(CCCCC2)C1	ZINC000188389324	262293643	/nfs/dbraw/zinc/29/36/43/262293643.db2.gz	GBUDIDHCCKCZQP-MRXNPFEDSA-N	0	0	263.425	4.162	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1C[C@H](c2ccc(F)cc2)C[C@@H]1C	ZINC000188434238	262296038	/nfs/dbraw/zinc/29/60/38/262296038.db2.gz	NTXCCYXVYGFTSW-JCKWVBRZSA-N	0	0	289.394	4.132	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CC[C@H](c2ccccc2)[C@H](C)C1	ZINC000188454534	262297990	/nfs/dbraw/zinc/29/79/90/262297990.db2.gz	CBDLIIGXLDEFBR-HHXXYDBFSA-N	0	0	285.431	4.241	20	30		CIEDRN
Cc1ccc(Br)cc1N[C@@H]1CCC[C@@H](C#N)C1	ZINC000463285970	262305142	/nfs/dbraw/zinc/30/51/42/262305142.db2.gz	ZFRLEKDKLVUOOR-DGCLKSJQSA-N	0	0	293.208	4.252	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](C)c1ccc(F)cc1Cl	ZINC000185614385	262306633	/nfs/dbraw/zinc/30/66/33/262306633.db2.gz	KIKYRQCSSLAMRC-GHMZBOCLSA-N	0	0	283.774	4.259	20	30		CIEDRN
C=CCCCSCC(=O)N[C@H](c1ccccc1)C(C)C	ZINC000522756384	262338615	/nfs/dbraw/zinc/33/86/15/262338615.db2.gz	TURRZHDYVPLDOH-KRWDZBQOSA-N	0	0	291.460	4.199	20	30		CIEDRN
Cc1cc(Oc2ccc(C#N)cc2Cl)ccc1[N+](=O)[O-]	ZINC000058000407	262350523	/nfs/dbraw/zinc/35/05/23/262350523.db2.gz	TVTQRJWPMCKIRI-UHFFFAOYSA-N	0	0	288.690	4.221	20	30		CIEDRN
N#Cc1c(Cl)cccc1NC[C@@H]1CCCC1(F)F	ZINC000390878441	262358338	/nfs/dbraw/zinc/35/83/38/262358338.db2.gz	WGHWHAQZGXRWQL-VIFPVBQESA-N	0	0	270.710	4.059	20	30		CIEDRN
N#Cc1c(Cl)cccc1NC[C@H]1CCCC1(F)F	ZINC000390878439	262358349	/nfs/dbraw/zinc/35/83/49/262358349.db2.gz	WGHWHAQZGXRWQL-SECBINFHSA-N	0	0	270.710	4.059	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2cccc(C(F)F)c2)CC1	ZINC000111747568	262365986	/nfs/dbraw/zinc/36/59/86/262365986.db2.gz	SPXWPVJDDZJOJA-UHFFFAOYSA-N	0	0	280.318	4.054	20	30		CIEDRN
C=CCCCSCC(=O)Nc1cccc2c1N=S=N2	ZINC000117944973	262366761	/nfs/dbraw/zinc/36/67/61/262366761.db2.gz	LZFBXWAXPRLZST-UHFFFAOYSA-N	0	0	293.417	4.051	20	30		CIEDRN
N#Cc1cc([N+](=O)[O-])ccc1N[C@H]1CCCc2sccc21	ZINC000061327743	262394074	/nfs/dbraw/zinc/39/40/74/262394074.db2.gz	HYFVZHMQNHPOGI-AWEZNQCLSA-N	0	0	299.355	4.017	20	30		CIEDRN
C=CCCc1ccccc1NCc1nccn1C(C)C	ZINC000336969162	262410275	/nfs/dbraw/zinc/41/02/75/262410275.db2.gz	BFEZREWKEGWAKK-UHFFFAOYSA-N	0	0	269.392	4.195	20	30		CIEDRN
Cc1cc(CSCCCC#N)ccc1Br	ZINC000336988854	262410748	/nfs/dbraw/zinc/41/07/48/262410748.db2.gz	JWLXDIVRDQGOQY-UHFFFAOYSA-N	0	0	284.222	4.295	20	30		CIEDRN
C=CCC[C@@H](NC(=O)c1coc(CCC)n1)c1ccccc1	ZINC000337908699	262483025	/nfs/dbraw/zinc/48/30/25/262483025.db2.gz	WONFJFGUUAPKRE-OAHLLOKOSA-N	0	0	298.386	4.064	20	30		CIEDRN
C=CCCO[C@@H](C)c1nc(C2CCC(C)CC2)no1	ZINC000356184196	262556332	/nfs/dbraw/zinc/55/63/32/262556332.db2.gz	CVSAVNYLJNNKSG-CPCZMJQVSA-N	0	0	264.369	4.017	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1cc2ccc(Cl)cc2[nH]1	ZINC000428037629	262605451	/nfs/dbraw/zinc/60/54/51/262605451.db2.gz	KNQAFRCTUPIIBC-CYBMUJFWSA-N	0	0	288.778	4.002	20	30		CIEDRN
CSCCCSCc1ccc(C#N)cc1Cl	ZINC000320349873	262628249	/nfs/dbraw/zinc/62/82/49/262628249.db2.gz	KHIAHKZTPNZTQX-UHFFFAOYSA-N	0	0	271.838	4.198	20	30		CIEDRN
CC(C)(C)N(Cc1ccccc1)C(=O)c1cscc1C#N	ZINC000410670012	262652632	/nfs/dbraw/zinc/65/26/32/262652632.db2.gz	DOHRRSPKQQNYQI-UHFFFAOYSA-N	0	0	298.411	4.061	20	30		CIEDRN
CCC(CC)N(C(=O)c1ccc(C#N)o1)c1cccc(C)c1	ZINC000410802359	262665976	/nfs/dbraw/zinc/66/59/76/262665976.db2.gz	ZCXLUQBKYWGTJK-UHFFFAOYSA-N	0	0	296.370	4.295	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1c(C)onc1C1CC1	ZINC000410821222	262667091	/nfs/dbraw/zinc/66/70/91/262667091.db2.gz	AMHOPVQABXGKDA-UHFFFAOYSA-N	0	0	296.370	4.231	20	30		CIEDRN
CC(C)[C@H](C)C(=O)Nc1scc(C(C)(C)C)c1C#N	ZINC000410927149	262672891	/nfs/dbraw/zinc/67/28/91/262672891.db2.gz	JSMVUKXLLJXWKM-JTQLQIEISA-N	0	0	278.421	4.148	20	30		CIEDRN
Cc1ccoc1C(=O)Nc1scc(C(C)(C)C)c1C#N	ZINC000410929302	262673521	/nfs/dbraw/zinc/67/35/21/262673521.db2.gz	MMOOSCPBPDLSEQ-UHFFFAOYSA-N	0	0	288.372	4.071	20	30		CIEDRN
Cc1cccc2c1N(C(=O)c1sccc1C#N)CC[C@H]2C	ZINC000410963750	262673742	/nfs/dbraw/zinc/67/37/42/262673742.db2.gz	CCWSIHRXXGKHIE-LLVKDONJSA-N	0	0	296.395	4.082	20	30		CIEDRN
CC1(C)CCC[C@H]1C(=O)Nc1ccc(Cl)cc1CC#N	ZINC000410961985	262674560	/nfs/dbraw/zinc/67/45/60/262674560.db2.gz	BRWAOGHFQIPEOW-ZDUSSCGKSA-N	0	0	290.794	4.171	20	30		CIEDRN
C[C@H]1CCc2sc(NC(=O)C3CCC3)c(C#N)c2[C@H]1C	ZINC000410983087	262674660	/nfs/dbraw/zinc/67/46/60/262674660.db2.gz	IYCBAQPVSQXBDV-UWVGGRQHSA-N	0	0	288.416	4.044	20	30		CIEDRN
CC(C)(C)C(C)(C)C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000411012395	262675448	/nfs/dbraw/zinc/67/54/48/262675448.db2.gz	HAAVNXRYKOJGBK-UHFFFAOYSA-N	0	0	292.810	4.417	20	30		CIEDRN
C[C@H](CCC#N)N1CCc2c(Cl)cc(Cl)cc2C1	ZINC000411318106	262688659	/nfs/dbraw/zinc/68/86/59/262688659.db2.gz	DHAASKQKLYWJEP-SNVBAGLBSA-N	0	0	283.202	4.044	20	30		CIEDRN
C=CCCCN(C)C(=O)c1csc(C2CCCCC2)n1	ZINC000412136651	262721396	/nfs/dbraw/zinc/72/13/96/262721396.db2.gz	WMOCPDWGIQNGFB-UHFFFAOYSA-N	0	0	292.448	4.229	20	30		CIEDRN
C=CCC[C@@H](C(=O)N(C)Cc1ccc(C)o1)c1ccccc1	ZINC000187458592	262746796	/nfs/dbraw/zinc/74/67/96/262746796.db2.gz	FYBUEMYVMHIMKK-GOSISDBHSA-N	0	0	297.398	4.296	20	30		CIEDRN
CCCCCCCCC(=O)Nc1c(C)nn(CC)c1C	ZINC000266167273	262914515	/nfs/dbraw/zinc/91/45/15/262914515.db2.gz	PXSQFBLAUYNOEW-UHFFFAOYSA-N	0	0	279.428	4.209	20	30		CIEDRN
Cc1ccncc1[C@@H](C)Nc1cccc(OCCCC#N)c1	ZINC000271927032	263000400	/nfs/dbraw/zinc/00/04/00/263000400.db2.gz	GLIZQVGCNKPHHY-OAHLLOKOSA-N	0	0	295.386	4.246	20	30		CIEDRN
CC(C)(C#N)CCOc1ccc(Oc2ccccn2)cc1	ZINC000272108133	263002128	/nfs/dbraw/zinc/00/21/28/263002128.db2.gz	OCAFYLOCLOUVPA-UHFFFAOYSA-N	0	0	282.343	4.193	20	30		CIEDRN
CCC(C)(C)c1ccc(C(=O)N2CCC(C)(C#N)CC2)cc1	ZINC000272551364	263006600	/nfs/dbraw/zinc/00/66/00/263006600.db2.gz	RJRSUOCSGIQEJM-UHFFFAOYSA-N	0	0	298.430	4.140	20	30		CIEDRN
CC(C)(C)[C@](C)(C#N)NC(=O)c1ccc(-c2ccccc2)o1	ZINC000274312409	263022839	/nfs/dbraw/zinc/02/28/39/263022839.db2.gz	IPQNGLJTUFESAI-SFHVURJKSA-N	0	0	296.370	4.005	20	30		CIEDRN
C[C@@H](CCC(=O)N[C@@](C)(C#N)C(C)(C)C)c1ccccc1	ZINC000274321112	263023226	/nfs/dbraw/zinc/02/32/26/263023226.db2.gz	KIRYNUPAFZPTSH-KSSFIOAISA-N	0	0	286.419	4.015	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)c1cc2cccc(C)c2o1	ZINC000276318412	263036084	/nfs/dbraw/zinc/03/60/84/263036084.db2.gz	WGSFIMFHJAYXIA-UHFFFAOYSA-N	0	0	298.386	4.286	20	30		CIEDRN
C[C@H](SCCC(C)(C)C#N)c1cccc(C#N)c1	ZINC000276612723	263037530	/nfs/dbraw/zinc/03/75/30/263037530.db2.gz	MCQFNYMMEOMIKX-LBPRGKRZSA-N	0	0	258.390	4.292	20	30		CIEDRN
C[C@H](SCCCC#N)c1ccc(OC(F)F)cc1	ZINC000276629577	263037594	/nfs/dbraw/zinc/03/75/94/263037594.db2.gz	PTCNCDCGCPUCSO-JTQLQIEISA-N	0	0	271.332	4.386	20	30		CIEDRN
C[C@@H](SCCCC#N)c1ccc(OC(F)F)cc1	ZINC000276629582	263037674	/nfs/dbraw/zinc/03/76/74/263037674.db2.gz	PTCNCDCGCPUCSO-SNVBAGLBSA-N	0	0	271.332	4.386	20	30		CIEDRN
CCCCCCC[C@@H](CC(=O)[O-])[NH2+]Cc1cccc(F)c1	ZINC000277186993	263040038	/nfs/dbraw/zinc/04/00/38/263040038.db2.gz	FPCLFYMRYFHRSA-INIZCTEOSA-N	0	0	295.398	4.119	20	30		CIEDRN
CC(C)(C#N)CCCC[S@](=O)C/C=C/c1ccccc1	ZINC000277847051	263044032	/nfs/dbraw/zinc/04/40/32/263044032.db2.gz	LBOAGXMCILWZJQ-ZBWUASRJSA-N	0	0	289.444	4.169	20	30		CIEDRN
CC[C@H](C)c1ccccc1OC(=O)CC(C)(C)C#N	ZINC000278216375	263045877	/nfs/dbraw/zinc/04/58/77/263045877.db2.gz	IQGHJKNCSBQCGY-LBPRGKRZSA-N	0	0	259.349	4.045	20	30		CIEDRN
Cc1cccc([C@@H]2CCCCN2C(=O)CC(C)(C)C#N)c1C	ZINC000278275250	263046548	/nfs/dbraw/zinc/04/65/48/263046548.db2.gz	FMORJVQSHRXPIG-KRWDZBQOSA-N	0	0	298.430	4.297	20	30		CIEDRN
Cc1sc2ncnc(S[C@@H]3CC[C@@H](C#N)C3)c2c1C	ZINC000278566852	263049006	/nfs/dbraw/zinc/04/90/06/263049006.db2.gz	NEHWRIOVMAIOAH-GHMZBOCLSA-N	0	0	289.429	4.093	20	30		CIEDRN
N#C[C@@H]1CC[C@@H](Sc2nc3cc(Cl)ccc3[nH]2)C1	ZINC000278665126	263049604	/nfs/dbraw/zinc/04/96/04/263049604.db2.gz	XJIWLDQSNYDQNB-PSASIEDQSA-N	0	0	277.780	4.001	20	30		CIEDRN
COc1cc(C)cc(NCCCC(C)(C)C#N)c1C	ZINC000278677136	263049668	/nfs/dbraw/zinc/04/96/68/263049668.db2.gz	HHRGXSJARZGDBD-UHFFFAOYSA-N	0	0	260.381	4.054	20	30		CIEDRN
C[C@@H](NC(=O)CC(C)(C)C#N)c1cc(Cl)ccc1Cl	ZINC000278752631	263050806	/nfs/dbraw/zinc/05/08/06/263050806.db2.gz	JNZFUODLIGHQIA-SECBINFHSA-N	0	0	299.201	4.110	20	30		CIEDRN
CSc1cccc(N[C@H]2CCC[C@@H](C#N)C2)c1C	ZINC000278776412	263050881	/nfs/dbraw/zinc/05/08/81/263050881.db2.gz	PNJGBQWFVDRBMX-OLZOCXBDSA-N	0	0	260.406	4.211	20	30		CIEDRN
CSc1cccc(N[C@@H]2CCC[C@@H](C#N)C2)c1C	ZINC000278776409	263050984	/nfs/dbraw/zinc/05/09/84/263050984.db2.gz	PNJGBQWFVDRBMX-CHWSQXEVSA-N	0	0	260.406	4.211	20	30		CIEDRN
CCCCCCCCC(=O)N(C)c1ncccc1C	ZINC000279405694	263055211	/nfs/dbraw/zinc/05/52/11/263055211.db2.gz	HZYPXSSSICYMEJ-UHFFFAOYSA-N	0	0	262.397	4.103	20	30		CIEDRN
C[C@@H](C[S@@](=O)CCCCC(C)(C)C#N)c1ccccc1	ZINC000280072538	263059077	/nfs/dbraw/zinc/05/90/77/263059077.db2.gz	USDPNFNEDKIXLC-YWZLYKJASA-N	0	0	291.460	4.259	20	30		CIEDRN
CCC[C@H](NC(=O)c1ccc(CC#N)cc1)c1ccccc1	ZINC000340048897	263059843	/nfs/dbraw/zinc/05/98/43/263059843.db2.gz	WPINUSISFIEZRT-SFHVURJKSA-N	0	0	292.382	4.024	20	30		CIEDRN
Cc1ccc2c(c1)scc2C(=O)N(CC#N)C1CCCC1	ZINC000280345076	263060586	/nfs/dbraw/zinc/06/05/86/263060586.db2.gz	MNMRMOGIDVGFGG-UHFFFAOYSA-N	0	0	298.411	4.118	20	30		CIEDRN
C[C@@H]1CCC[C@H](N(C)C(=O)c2ccc(C(C)(C)C#N)cc2)C1	ZINC000280858244	263064751	/nfs/dbraw/zinc/06/47/51/263064751.db2.gz	LVVPKKNJVIQQBE-PBHICJAKSA-N	0	0	298.430	4.138	20	30		CIEDRN
Cc1ccc(SCCCC2(C#N)CCOCC2)c(C)c1	ZINC000280958033	263065262	/nfs/dbraw/zinc/06/52/62/263065262.db2.gz	JUBYKHQGIIIFKQ-UHFFFAOYSA-N	0	0	289.444	4.496	20	30		CIEDRN
C[C@@H]1CCCC[C@@H]1N(C)C(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000281031607	263065905	/nfs/dbraw/zinc/06/59/05/263065905.db2.gz	YPYNZWOLBDLMKZ-PBHICJAKSA-N	0	0	298.430	4.138	20	30		CIEDRN
N#CC1(CCCSCc2ccc(F)cc2)CCOCC1	ZINC000281168547	263067003	/nfs/dbraw/zinc/06/70/03/263067003.db2.gz	BXXMDXPCWZXHKQ-UHFFFAOYSA-N	0	0	293.407	4.159	20	30		CIEDRN
Cc1ccc(Cl)c(OCCCC2(C#N)CCOCC2)c1	ZINC000281421554	263068819	/nfs/dbraw/zinc/06/88/19/263068819.db2.gz	RSMPIDWRDKCUTR-UHFFFAOYSA-N	0	0	293.794	4.128	20	30		CIEDRN
N#CC1(CCCSCc2ccccc2F)CCOCC1	ZINC000281733962	263071543	/nfs/dbraw/zinc/07/15/43/263071543.db2.gz	DSVWLLCJZFXWFO-UHFFFAOYSA-N	0	0	293.407	4.159	20	30		CIEDRN
CC(C)(C#N)CCCNc1ccc(OC(F)F)cc1F	ZINC000282237676	263075396	/nfs/dbraw/zinc/07/53/96/263075396.db2.gz	LSKNGQNSVDPXLX-UHFFFAOYSA-N	0	0	286.297	4.169	20	30		CIEDRN
CO[C@@H](CSCCCCC#N)c1ccc(Cl)cc1	ZINC000282757692	263078563	/nfs/dbraw/zinc/07/85/63/263078563.db2.gz	ZGHIUOZAJWVPSQ-AWEZNQCLSA-N	0	0	283.824	4.455	20	30		CIEDRN
CC(C)c1ccoc1C(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000284349647	263086431	/nfs/dbraw/zinc/08/64/31/263086431.db2.gz	YFMQZZCFOPIFKT-INIZCTEOSA-N	0	0	296.370	4.178	20	30		CIEDRN
Cc1ccnc([C@H](C)N[C@H](CCC#N)c2ccccc2)c1	ZINC000286172473	263097519	/nfs/dbraw/zinc/09/75/19/263097519.db2.gz	PXGKCPUBJWCELE-DOTOQJQBSA-N	0	0	279.387	4.086	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)O[C@H](C)c1cccc(Cl)c1F	ZINC000286715790	263099343	/nfs/dbraw/zinc/09/93/43/263099343.db2.gz	IQVSRQSESUCHSD-OTYXRUKQSA-N	0	0	283.730	4.023	20	30		CIEDRN
CC[C@](C)(C#N)c1nc(C(C)(C)C2=CCCCC2)no1	ZINC000288968513	263106821	/nfs/dbraw/zinc/10/68/21/263106821.db2.gz	BCOSATCDGWRSBR-MRXNPFEDSA-N	0	0	273.380	4.039	20	30		CIEDRN
CCSc1ccc(Cl)cc1NC(=O)[C@@](C)(C#N)CC	ZINC000289315714	263109037	/nfs/dbraw/zinc/10/90/37/263109037.db2.gz	AZFKSPFDWCTWPU-CQSZACIVSA-N	0	0	296.823	4.330	20	30		CIEDRN
N#CCCN(CC1CC1)C(=O)c1ccc(C2=CCCC2)cc1	ZINC000290315229	263116172	/nfs/dbraw/zinc/11/61/72/263116172.db2.gz	HNDDCIHMNGQBTK-UHFFFAOYSA-N	0	0	294.398	4.020	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1ccc(OC(C)C)c(C)c1	ZINC000439442282	263120979	/nfs/dbraw/zinc/12/09/79/263120979.db2.gz	LQJMESPDSPSRAX-CQSZACIVSA-N	0	0	290.407	4.258	20	30		CIEDRN
CC(C)Sc1c(Cl)cccc1NC(=O)CCCC#N	ZINC000291492747	263123450	/nfs/dbraw/zinc/12/34/50/263123450.db2.gz	MLRGFQQPMHSJQE-UHFFFAOYSA-N	0	0	296.823	4.473	20	30		CIEDRN
Cc1cc(CSCc2ccccc2C(C)(C)C#N)ncn1	ZINC000291914121	263126576	/nfs/dbraw/zinc/12/65/76/263126576.db2.gz	SWUMZEYOBOKASM-UHFFFAOYSA-N	0	0	297.427	4.020	20	30		CIEDRN
CCCc1cccc(C(C)C)c1NC(=O)CCCC#N	ZINC000292279731	263130501	/nfs/dbraw/zinc/13/05/01/263130501.db2.gz	LTXZGNRYTYXDCF-UHFFFAOYSA-N	0	0	272.392	4.395	20	30		CIEDRN
Cc1c(CSC(C)C)cccc1NC(=O)CCCC#N	ZINC000292292889	263130608	/nfs/dbraw/zinc/13/06/08/263130608.db2.gz	YGMAHNSZSUOWDH-UHFFFAOYSA-N	0	0	290.432	4.269	20	30		CIEDRN
N#CCCCC(=O)N1CCC[C@@H]1c1cccc2ccccc21	ZINC000292321038	263130905	/nfs/dbraw/zinc/13/09/05/263130905.db2.gz	NUIRRCWKVIFSLC-GOSISDBHSA-N	0	0	292.382	4.197	20	30		CIEDRN
C=C(C)CCNC(=O)CCCCCO[C@H]1CCC[C@@H](C)C1	ZINC000452718774	263136023	/nfs/dbraw/zinc/13/60/23/263136023.db2.gz	QWHIZSHIEBEOEA-SJORKVTESA-N	0	0	295.467	4.225	20	30		CIEDRN
Cc1c(Cl)cccc1NC(=O)[C@@]1(C#N)CC12CCCC2	ZINC000294196327	263157573	/nfs/dbraw/zinc/15/75/73/263157573.db2.gz	GPLILXTUPNJJBK-INIZCTEOSA-N	0	0	288.778	4.061	20	30		CIEDRN
N#C[C@]1(C(=O)Nc2ccc3ccccc3c2)CC12CCCC2	ZINC000294268199	263159010	/nfs/dbraw/zinc/15/90/10/263159010.db2.gz	RJPWXTCJIRZOOL-IBGZPJMESA-N	0	0	290.366	4.252	20	30		CIEDRN
N#CC[C@@H]1CC[C@H](Nc2ccc(C#N)cc2C(F)(F)F)C1	ZINC000294924061	263169411	/nfs/dbraw/zinc/16/94/11/263169411.db2.gz	GUOCBXMJQFUQFX-JQWIXIFHSA-N	0	0	293.292	4.071	20	30		CIEDRN
CCN(CCC#N)Cc1ccc([C@H](C)C(F)(F)F)cc1	ZINC000294958248	263169886	/nfs/dbraw/zinc/16/98/86/263169886.db2.gz	KUHRRIBNMPWZRW-LBPRGKRZSA-N	0	0	284.325	4.088	20	30		CIEDRN
N#CC[C@@H]1CC[C@H](NC(=O)c2ccc(C3=CCCC3)cc2)C1	ZINC000295575800	263179888	/nfs/dbraw/zinc/17/98/88/263179888.db2.gz	POQSRGBHYPVHFO-KSSFIOAISA-N	0	0	294.398	4.066	20	30		CIEDRN
CC(C)=CCC[C@@H](C)NC(=O)c1ccc(C2(C#N)CC2)cc1	ZINC000295646611	263180675	/nfs/dbraw/zinc/18/06/75/263180675.db2.gz	PHBNHNDUSSEDHM-OAHLLOKOSA-N	0	0	296.414	4.106	20	30		CIEDRN
C=CCCc1noc([C@H]2C[C@H]2c2ccccc2Cl)n1	ZINC000453228687	263204676	/nfs/dbraw/zinc/20/46/76/263204676.db2.gz	BEHSFZSWWBBIDH-RYUDHWBXSA-N	0	0	274.751	4.113	20	30		CIEDRN
CCCCN(C(=O)Nc1ccc(C(C)(C)C#N)cc1)C1CC1	ZINC000298501300	263220760	/nfs/dbraw/zinc/22/07/60/263220760.db2.gz	NASIHMVCLUDLPZ-UHFFFAOYSA-N	0	0	299.418	4.284	20	30		CIEDRN
CCCCCCCCC(=O)N1CCC[C@@H]1c1ccc[nH]1	ZINC000298847313	263226895	/nfs/dbraw/zinc/22/68/95/263226895.db2.gz	DHHKGRSFUNOSJE-MRXNPFEDSA-N	0	0	276.424	4.429	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)C=C(C2CC2)C2CC2)cc1	ZINC000298834385	263227142	/nfs/dbraw/zinc/22/71/42/263227142.db2.gz	YHWPHTMUPQASRL-UHFFFAOYSA-N	0	0	294.398	4.173	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1ccn(C(C)C)c1C	ZINC000340619991	263234932	/nfs/dbraw/zinc/23/49/32/263234932.db2.gz	LBYGKMGMXQCXGF-UHFFFAOYSA-N	0	0	276.424	4.196	20	30		CIEDRN
CC[C@@](C)(C#N)c1nc(-c2cccc(C(C)(F)F)c2)no1	ZINC000453338191	263242094	/nfs/dbraw/zinc/24/20/94/263242094.db2.gz	ASLKVTWTNVNLNL-AWEZNQCLSA-N	0	0	291.301	4.040	20	30		CIEDRN
C[C@@H](C#N)CN(C)[C@H](C)c1ccc(Cl)cc1Cl	ZINC000514092022	263260489	/nfs/dbraw/zinc/26/04/89/263260489.db2.gz	AZFXBZUQRIGUBY-VHSXEESVSA-N	0	0	271.191	4.146	20	30		CIEDRN
CC(F)(F)c1cccc(NCc2ccc(C#N)cc2)c1	ZINC000187573624	263261967	/nfs/dbraw/zinc/26/19/67/263261967.db2.gz	ASRMDOLAXWMPRD-UHFFFAOYSA-N	0	0	272.298	4.282	20	30		CIEDRN
C#CCCCCC(=O)N1CCCCC[C@H]1c1ccccc1	ZINC000119644034	263275146	/nfs/dbraw/zinc/27/51/46/263275146.db2.gz	BAVFZUMNTUESSC-SFHVURJKSA-N	0	0	283.415	4.324	20	30		CIEDRN
C#CCCCCC(=O)Nc1cc(Cl)ccc1Cl	ZINC000119743553	263276142	/nfs/dbraw/zinc/27/61/42/263276142.db2.gz	ACFIJENRDSQJRR-UHFFFAOYSA-N	0	0	270.159	4.126	20	30		CIEDRN
N#CCC[C@H](Nc1cccc(F)c1[N+](=O)[O-])c1ccccc1	ZINC000164338612	263285929	/nfs/dbraw/zinc/28/59/29/263285929.db2.gz	FPIFUWNINIIIJC-AWEZNQCLSA-N	0	0	299.305	4.191	20	30		CIEDRN
N#CCC[C@H](Nc1ccccc1[N+](=O)[O-])c1ccccc1	ZINC000164352592	263288982	/nfs/dbraw/zinc/28/89/82/263288982.db2.gz	VQUBOIGZEMZUJJ-AWEZNQCLSA-N	0	0	281.315	4.052	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1cc(-c2nc(C)co2)ccc1C	ZINC000121246679	263291296	/nfs/dbraw/zinc/29/12/96/263291296.db2.gz	YIUQMHRKNAKJJR-GFCCVEGCSA-N	0	0	299.374	4.045	20	30		CIEDRN
C=C(C)COc1ccc(C2SCCS2)cc1OC	ZINC000122210308	263300424	/nfs/dbraw/zinc/30/04/24/263300424.db2.gz	OQDLINMPMFZKFP-UHFFFAOYSA-N	0	0	282.430	4.129	20	30		CIEDRN
C=CCCO[C@@H](C)C(=O)Nc1ccccc1SC(C)C	ZINC000122179118	263300518	/nfs/dbraw/zinc/30/05/18/263300518.db2.gz	TWGDBKYLCDRMLX-ZDUSSCGKSA-N	0	0	293.432	4.107	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ccoc2C2CC2)n1	ZINC000340825130	263307773	/nfs/dbraw/zinc/30/77/73/263307773.db2.gz	NNWDHERYVXQHHG-UHFFFAOYSA-N	0	0	258.321	4.061	20	30		CIEDRN
CCCCCCCCCC(=O)N1CC[C@@H]([C@H]2CCOC2)C1	ZINC000366723832	263327450	/nfs/dbraw/zinc/32/74/50/263327450.db2.gz	ZBTBUISTRIGNFO-SJORKVTESA-N	0	0	295.467	4.012	20	30		CIEDRN
CCC(CC)[C@@H](C)C(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000341876889	263360997	/nfs/dbraw/zinc/36/09/97/263360997.db2.gz	PWUXGUGPTARVCV-PBHICJAKSA-N	0	0	286.419	4.220	20	30		CIEDRN
C=C(C)CS[C@H](C)c1nccn1-c1ccccc1	ZINC000341953211	263370723	/nfs/dbraw/zinc/37/07/23/263370723.db2.gz	LXGJNGVACKQANL-CYBMUJFWSA-N	0	0	258.390	4.243	20	30		CIEDRN
CC(C)(C#N)CCSCc1nccn1-c1ccccc1	ZINC000342011377	263377554	/nfs/dbraw/zinc/37/75/54/263377554.db2.gz	WQDJGDQXMKZMNE-UHFFFAOYSA-N	0	0	285.416	4.045	20	30		CIEDRN
CC[C@H](c1ccccc1)[S@](=O)Cc1ccc(CC#N)cc1	ZINC000342142193	263398676	/nfs/dbraw/zinc/39/86/76/263398676.db2.gz	SFTXXBVICPXWCM-WIYYLYMNSA-N	0	0	297.423	4.153	20	30		CIEDRN
Cc1nc2ccc(NCc3ccc(CC#N)cc3)cc2s1	ZINC000342438667	263433994	/nfs/dbraw/zinc/43/39/94/263433994.db2.gz	PFEIEIYXFOGALX-UHFFFAOYSA-N	0	0	293.395	4.283	20	30		CIEDRN
N#Cc1ccc(Cl)cc1OCc1nc(C2CC2)cs1	ZINC000342489488	263442083	/nfs/dbraw/zinc/44/20/83/263442083.db2.gz	KMBNMHBUYGLFEJ-UHFFFAOYSA-N	0	0	290.775	4.125	20	30		CIEDRN
Cc1ccc(C(=O)N[C@@](C)(C#N)C(C)(C)C)c2ccccc12	ZINC000415390778	263630191	/nfs/dbraw/zinc/63/01/91/263630191.db2.gz	KRNUVKCQISEPQT-IBGZPJMESA-N	0	0	294.398	4.206	20	30		CIEDRN
CC[C@@H](CC1CCCC1)C(=O)N[C@@](C)(C#N)C(C)(C)C	ZINC000415384215	263630609	/nfs/dbraw/zinc/63/06/09/263630609.db2.gz	CKXUWDKYDGXXRT-YOEHRIQHSA-N	0	0	278.440	4.037	20	30		CIEDRN
N#Cc1ccc(SCc2ncccc2C(F)(F)F)cc1	ZINC000428064273	263811224	/nfs/dbraw/zinc/81/12/24/263811224.db2.gz	PDXUGXGWTYTTRY-UHFFFAOYSA-N	0	0	294.301	4.264	20	30		CIEDRN
C[C@@H]1CC(C)(C)CC[C@@H]1NC(=O)C[C@@H]1CCCCC(=O)N1	ZINC000328650976	263832329	/nfs/dbraw/zinc/83/23/29/263832329.db2.gz	JLEGJMICWGJJAA-RDBSUJKOSA-N	0	0	294.439	4.447	20	30		CIEDRN
CC1(C)CCCC[C@@H]1CC(=O)N[C@@H]1CCCc2c[nH]nc21	ZINC000328660589	263834833	/nfs/dbraw/zinc/83/48/33/263834833.db2.gz	VQCQKCMEKSZOHL-ZIAGYGMSSA-N	0	0	289.423	4.350	20	30		CIEDRN
C[C@@H](NC(=O)[C@@H]1CCC(=O)[C@H](C)C1)c1cc2ccccc2o1	ZINC000328925692	263903041	/nfs/dbraw/zinc/90/30/41/263903041.db2.gz	WAKQFUSETSMXGC-YRGRVCCFSA-N	0	0	299.370	4.456	20	30		CIEDRN
Cc1ccc(O)c(NC(=O)c2csc(C(C)(C)C)n2)c1	ZINC000330454947	263939979	/nfs/dbraw/zinc/93/99/79/263939979.db2.gz	WMYARBSNLAFOJK-UHFFFAOYSA-N	0	0	290.388	4.091	20	30		CIEDRN
CCC[C@@H](NC(=O)c1nc(C)oc1C)C1CCCCC1	ZINC000330470489	263943740	/nfs/dbraw/zinc/94/37/40/263943740.db2.gz	MNBUQJAQQUWTQQ-CQSZACIVSA-N	0	0	278.396	4.345	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cccc(-n2nc(C)cc2C)c1	ZINC000468113004	263960097	/nfs/dbraw/zinc/96/00/97/263960097.db2.gz	HTMCTCRDBWYITF-SFHVURJKSA-N	0	0	297.402	4.030	20	30		CIEDRN
Cc1nc(C(=O)NCC(C)(C)C2=CCCCC2)c(C)o1	ZINC000330551376	263964302	/nfs/dbraw/zinc/96/43/02/263964302.db2.gz	BLQAMULTMOHMGS-UHFFFAOYSA-N	0	0	276.380	4.123	20	30		CIEDRN
Cc1[nH]ccc1C(=O)Nc1nc(CC(C)(C)C)cs1	ZINC000330668056	263992611	/nfs/dbraw/zinc/99/26/11/263992611.db2.gz	BXZAMSPYPRJASJ-UHFFFAOYSA-N	0	0	277.393	4.005	20	30		CIEDRN
Cc1nc([C@H](C)NC(=O)Nc2cc(C)cc(C)c2)cs1	ZINC000330634089	264001336	/nfs/dbraw/zinc/00/13/36/264001336.db2.gz	AZPMNZSZWYHUDJ-NSHDSACASA-N	0	0	289.404	4.155	20	30		CIEDRN
Cc1cccc(OC(F)F)c1NC(=O)NC1(C)CCCC1	ZINC000330689351	264003868	/nfs/dbraw/zinc/00/38/68/264003868.db2.gz	VQUPCKQZQLEDRZ-UHFFFAOYSA-N	0	0	298.333	4.064	20	30		CIEDRN
CC[C@H](NC(=O)N[C@H](c1ncccc1C)C(C)C)C(C)C	ZINC000330807164	264043273	/nfs/dbraw/zinc/04/32/73/264043273.db2.gz	MSUITLACFCPDQD-GJZGRUSLSA-N	0	0	291.439	4.025	20	30		CIEDRN
CC1(C)CCC[C@H](CC(=O)Nc2ccccc2CC#N)C1	ZINC000330827955	264048816	/nfs/dbraw/zinc/04/88/16/264048816.db2.gz	HYKOATDDONDQPH-CQSZACIVSA-N	0	0	284.403	4.298	20	30		CIEDRN
CC(C)Sc1ccccc1C(=O)N[C@@H]1CCC[C@@H]1C#N	ZINC000330841341	264065133	/nfs/dbraw/zinc/06/51/33/264065133.db2.gz	JSSILFZTWJKFSR-TZMCWYRMSA-N	0	0	288.416	4.184	20	30		CIEDRN
CCO[C@H](C)c1ncc(C(=O)NCC2CCCCC2)s1	ZINC000330906629	264074459	/nfs/dbraw/zinc/07/44/59/264074459.db2.gz	DQQUREANLGOARB-LLVKDONJSA-N	0	0	296.436	4.126	20	30		CIEDRN
CCO[C@H](C)c1ncc(C(=O)N[C@@H]2CCC[C@@H](C)C2)s1	ZINC000330917018	264092928	/nfs/dbraw/zinc/09/29/28/264092928.db2.gz	LKKZRNZYTJBGET-IJLUTSLNSA-N	0	0	296.436	4.124	20	30		CIEDRN
CCO[C@@H](C)c1ncc(C(=O)N[C@H]2CC[C@H](C)CC2)s1	ZINC000330924491	264094405	/nfs/dbraw/zinc/09/44/05/264094405.db2.gz	UNZGGYYTMCFJIA-SRVKXCTJSA-N	0	0	296.436	4.124	20	30		CIEDRN
Cc1cc(C(=O)Nc2ncc(C(C)(C)C)s2)c(C)o1	ZINC000330926392	264094529	/nfs/dbraw/zinc/09/45/29/264094529.db2.gz	WZDJUWMUFXPOEW-UHFFFAOYSA-N	0	0	278.377	4.287	20	30		CIEDRN
C[C@H]1CC(NC(=O)C[C@H](CC#N)c2ccccc2)C[C@H](C)C1	ZINC000331055766	264109412	/nfs/dbraw/zinc/10/94/12/264109412.db2.gz	KRHHTXWOLALSTF-INMHGKMJSA-N	0	0	298.430	4.015	20	30		CIEDRN
CCC[C@H](NC(=O)c1ccnc(C#N)c1)C1CCCCC1	ZINC000331065058	264111421	/nfs/dbraw/zinc/11/14/21/264111421.db2.gz	QBRIAGQYTUHXDD-INIZCTEOSA-N	0	0	285.391	4.007	20	30		CIEDRN
CCc1onc(C)c1C(=O)NCC(C)(C)C1=CCCCC1	ZINC000331074295	264114017	/nfs/dbraw/zinc/11/40/17/264114017.db2.gz	GISLADVQJBAXDE-UHFFFAOYSA-N	0	0	290.407	4.377	20	30		CIEDRN
COc1cc(C)c(NC(=O)NCC2CCCCC2)cc1F	ZINC000331096037	264120955	/nfs/dbraw/zinc/12/09/55/264120955.db2.gz	AGHOFWYOEZAMDW-UHFFFAOYSA-N	0	0	294.370	4.049	20	30		CIEDRN
C=CCC[C@H](C(=O)Nc1ccccc1O)c1ccccc1	ZINC000188523114	264122007	/nfs/dbraw/zinc/12/20/07/264122007.db2.gz	NGFHWXQSHBBYDB-HNNXBMFYSA-N	0	0	281.355	4.081	20	30		CIEDRN
CCCc1nc(C)c(C(=O)Nc2c(C)ccnc2C)s1	ZINC000331100815	264123693	/nfs/dbraw/zinc/12/36/93/264123693.db2.gz	CWYAGBJADZVQCE-UHFFFAOYSA-N	0	0	289.404	4.052	20	30		CIEDRN
CC[C@@H](C)n1ncc(NC(=O)N[C@H]2CC[C@H](C)CC2)c1C	ZINC000331120793	264130282	/nfs/dbraw/zinc/13/02/82/264130282.db2.gz	LZLPVWYRRLFJGJ-YRGRVCCFSA-N	0	0	292.427	4.067	20	30		CIEDRN
CC[C@H](C)n1ncc(NC(=O)NCC(C)(C)C(C)C)c1C	ZINC000331122905	264130749	/nfs/dbraw/zinc/13/07/49/264130749.db2.gz	MSKAYGOZLZGKJZ-LBPRGKRZSA-N	0	0	294.443	4.171	20	30		CIEDRN
CC[C@H](C)[C@H](C)NC(=O)Nc1cc(C)cc(OC)c1C	ZINC000331165788	264144813	/nfs/dbraw/zinc/14/48/13/264144813.db2.gz	SJKYBIKSYTUVFE-AAEUAGOBSA-N	0	0	278.396	4.073	20	30		CIEDRN
Cc1ccc(-c2ccc(C)c(NC(=O)NC(C)C)c2)o1	ZINC000331169750	264145723	/nfs/dbraw/zinc/14/57/23/264145723.db2.gz	CHQLKFQCGHSEQA-UHFFFAOYSA-N	0	0	272.348	4.298	20	30		CIEDRN
C[C@H](CCC(C)(C)C)NC(=O)NCC1CCC(C#N)CC1	ZINC000331281801	264172008	/nfs/dbraw/zinc/17/20/08/264172008.db2.gz	GBLIHEJVLWPNIQ-WLYUNCDWSA-N	0	0	293.455	4.035	20	30		CIEDRN
CCOCc1ccc(NC(=O)N[C@@H]2CCC[C@@H](C)C2)cc1	ZINC000331237807	264175473	/nfs/dbraw/zinc/17/54/73/264175473.db2.gz	HZVKQMIAIXYLNS-CZUORRHYSA-N	0	0	290.407	4.128	20	30		CIEDRN
Cc1nc([C@H](C)NC(=O)c2cnc(C(C)C)s2)cs1	ZINC000331298494	264198751	/nfs/dbraw/zinc/19/87/51/264198751.db2.gz	AXIBRMQEEFLLFU-QMMMGPOBSA-N	0	0	295.433	4.097	20	30		CIEDRN
Cc1nc([C@@H](C)NC(=O)c2cnc(C(C)C)s2)cs1	ZINC000331297909	264198769	/nfs/dbraw/zinc/19/87/69/264198769.db2.gz	AXIBRMQEEFLLFU-MRVPVSSYSA-N	0	0	295.433	4.097	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC)[C@H](C)c1ccc(C#N)cc1	ZINC000126174236	264210307	/nfs/dbraw/zinc/21/03/07/264210307.db2.gz	WIADIGBJCHPHIF-OAHLLOKOSA-N	0	0	296.414	4.236	20	30		CIEDRN
C[C@H](c1cccc(C#N)c1)N(C)Cc1csc(C2CC2)n1	ZINC000425367490	264212257	/nfs/dbraw/zinc/21/22/57/264212257.db2.gz	SXFRYVOVCGGGIM-GFCCVEGCSA-N	0	0	297.427	4.085	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(Oc2cc(C)[nH]n2)cc1	ZINC000188733298	264243512	/nfs/dbraw/zinc/24/35/12/264243512.db2.gz	SWCRDFREOFAABF-KRWDZBQOSA-N	0	0	299.374	4.051	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cc(C(C)C)c(O)cc1C	ZINC000188968010	264260569	/nfs/dbraw/zinc/26/05/69/264260569.db2.gz	CNIGBYTVPPCQPC-KRWDZBQOSA-N	0	0	275.392	4.365	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(Cc1ccc(C#N)cc1)C(C)C	ZINC000127574605	264263599	/nfs/dbraw/zinc/26/35/99/264263599.db2.gz	ZZEWDFCWDYBEJX-UHFFFAOYSA-N	0	0	296.414	4.064	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)[C@@H]1CCCC1(C)C	ZINC000475374727	264311324	/nfs/dbraw/zinc/31/13/24/264311324.db2.gz	ZNIJQYJFHMKNOX-HNNXBMFYSA-N	0	0	289.394	4.167	20	30		CIEDRN
C=C(C)COc1cccc(NCc2csc(C)n2)c1	ZINC000129261909	264319539	/nfs/dbraw/zinc/31/95/39/264319539.db2.gz	AWATVTOLEISNJR-UHFFFAOYSA-N	0	0	274.389	4.019	20	30		CIEDRN
Cc1ccc(S[C@@H](C)c2cccc(C#N)c2)nc1	ZINC000189835630	264332083	/nfs/dbraw/zinc/33/20/83/264332083.db2.gz	AFCUDKNZBHCMCT-LBPRGKRZSA-N	0	0	254.358	4.115	20	30		CIEDRN
COc1ccccc1S[C@@H](C)c1cccc(C#N)c1	ZINC000189839595	264334312	/nfs/dbraw/zinc/33/43/12/264334312.db2.gz	JUJRIOPYEYRZNC-LBPRGKRZSA-N	0	0	269.369	4.420	20	30		CIEDRN
C[C@H](Sc1ccccc1C#N)c1cccc(C#N)c1	ZINC000189850326	264334768	/nfs/dbraw/zinc/33/47/68/264334768.db2.gz	ZOFBRPNCGPISQM-LBPRGKRZSA-N	0	0	264.353	4.283	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N1C[C@H](c2ccccc2)C2(CCC2)C1	ZINC000424891224	264336421	/nfs/dbraw/zinc/33/64/21/264336421.db2.gz	ZQPCFWZDPKXBNM-QGZVFWFLSA-N	0	0	297.442	4.385	20	30		CIEDRN
C=C(C)[C@@H](NCc1cncc(C)c1)c1ccc(F)c(F)c1	ZINC000190037832	264345325	/nfs/dbraw/zinc/34/53/25/264345325.db2.gz	XEFRPMFVCOVSOL-QGZVFWFLSA-N	0	0	288.341	4.075	20	30		CIEDRN
CC(=O)Nc1ccc(NCC(C)(C)CCC#N)cc1Cl	ZINC000157440982	264360609	/nfs/dbraw/zinc/36/06/09/264360609.db2.gz	IQZOYNDCJYIAMP-UHFFFAOYSA-N	0	0	293.798	4.040	20	30		CIEDRN
C=C(C)CNC(=O)Nc1cccc(CSC(C)C)c1C	ZINC000157490507	264397494	/nfs/dbraw/zinc/39/74/94/264397494.db2.gz	QVZQRBQAVUYAAV-UHFFFAOYSA-N	0	0	292.448	4.334	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)CC(C)(C)C(F)(F)F	ZINC000280018719	264438273	/nfs/dbraw/zinc/43/82/73/264438273.db2.gz	JOTZVTZABWKFIC-UHFFFAOYSA-N	0	0	299.336	4.180	20	30		CIEDRN
Cc1ccc(C2CC2)c(C(=O)Nc2cccc(C#N)c2C)c1	ZINC000425531629	264443983	/nfs/dbraw/zinc/44/39/83/264443983.db2.gz	ANXOJMQSORJAEV-UHFFFAOYSA-N	0	0	290.366	4.305	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(C)[C@@H](C)c1ccc(F)c(F)c1	ZINC000281415943	264485268	/nfs/dbraw/zinc/48/52/68/264485268.db2.gz	QNWUNWHZWWVBOC-AAEUAGOBSA-N	0	0	296.361	4.022	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)CC	ZINC000191499562	264504293	/nfs/dbraw/zinc/50/42/93/264504293.db2.gz	UZZUHRCGEUMYCY-CYBMUJFWSA-N	0	0	274.408	4.459	20	30		CIEDRN
C=C1CCN(C(=O)Nc2ccc(Cl)cc2Cl)CC1	ZINC000283084730	264515436	/nfs/dbraw/zinc/51/54/36/264515436.db2.gz	VYKOCOWQVHMKPJ-UHFFFAOYSA-N	0	0	285.174	4.177	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CCc2sccc2[C@@H]1CC	ZINC000191835298	264528575	/nfs/dbraw/zinc/52/85/75/264528575.db2.gz	FVKZUEONMIOLGH-BBRMVZONSA-N	0	0	277.433	4.186	20	30		CIEDRN
C#CCCCC(=O)Nc1c(CC)ccc(Cl)c1CC	ZINC000192060472	264554624	/nfs/dbraw/zinc/55/46/24/264554624.db2.gz	UDHFJGOFSJZQMN-UHFFFAOYSA-N	0	0	277.795	4.207	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](C)c1ncc(-c2ccccc2)o1	ZINC000184126814	264701514	/nfs/dbraw/zinc/70/15/14/264701514.db2.gz	HVTTZVJFDCPXBQ-ZIAGYGMSSA-N	0	0	298.386	4.121	20	30		CIEDRN
C=CCN(Cc1cccc(C#N)c1)C(=O)/C(C)=C/C(C)(C)C	ZINC000185164662	265003281	/nfs/dbraw/zinc/00/32/81/265003281.db2.gz	QHRWLNNSACLVAQ-NTCAYCPXSA-N	0	0	296.414	4.065	20	30		CIEDRN
N#Cc1cc(N[C@H]2CCc3ccccc3C2)nc2ccccc12	ZINC000320700579	265021349	/nfs/dbraw/zinc/02/13/49/265021349.db2.gz	POTIJTIMWCYXOL-KRWDZBQOSA-N	0	0	299.377	4.076	20	30		CIEDRN
CC(C)CCN(CCC#N)Cc1ccc2occc2c1	ZINC000347777093	265136592	/nfs/dbraw/zinc/13/65/92/265136592.db2.gz	BAHJQOPSAXJYKN-UHFFFAOYSA-N	0	0	270.376	4.195	20	30		CIEDRN
N#Cc1csc(CNc2cccc3c2CCCC3)c1	ZINC000093492459	265183119	/nfs/dbraw/zinc/18/31/19/265183119.db2.gz	PTTUJDGVZKEMBZ-UHFFFAOYSA-N	0	0	268.385	4.111	20	30		CIEDRN
CC(C)COc1cccc(NCc2cc(C#N)cs2)c1	ZINC000093492481	265183109	/nfs/dbraw/zinc/18/31/09/265183109.db2.gz	AURFTGIPNAXEIY-UHFFFAOYSA-N	0	0	286.400	4.267	20	30		CIEDRN
CC[C@H](C)Oc1cccc(NCc2cc(C#N)cs2)c1	ZINC000093492535	265184213	/nfs/dbraw/zinc/18/42/13/265184213.db2.gz	YAWVMRRDBUXXLC-LBPRGKRZSA-N	0	0	286.400	4.409	20	30		CIEDRN
CCCOc1ccccc1NCc1cc(C#N)cs1	ZINC000093492659	265184353	/nfs/dbraw/zinc/18/43/53/265184353.db2.gz	FWJKQKKPCZWXKU-UHFFFAOYSA-N	0	0	272.373	4.021	20	30		CIEDRN
N#Cc1csc(CNc2cccc(OC(F)(F)F)c2)c1	ZINC000093685222	265189799	/nfs/dbraw/zinc/18/97/99/265189799.db2.gz	ZBKPISYFFLZTLT-UHFFFAOYSA-N	0	0	298.289	4.130	20	30		CIEDRN
N#Cc1ccc(Oc2ccc(F)cc2Cl)cc1[N+](=O)[O-]	ZINC000094593575	265244500	/nfs/dbraw/zinc/24/45/00/265244500.db2.gz	TWGQMEHKDRKORU-UHFFFAOYSA-N	0	0	292.653	4.051	20	30		CIEDRN
N#Cc1ccc(Oc2ccc(F)c(Cl)c2)cc1[N+](=O)[O-]	ZINC000094593628	265246094	/nfs/dbraw/zinc/24/60/94/265246094.db2.gz	BNNZPRFOPYIFEG-UHFFFAOYSA-N	0	0	292.653	4.051	20	30		CIEDRN
C=CCC1(C(=O)N2CCC[C@H](c3ccccc3)C2)CCC1	ZINC000519015567	265296318	/nfs/dbraw/zinc/29/63/18/265296318.db2.gz	GTICMOLRDPVEGR-KRWDZBQOSA-N	0	0	283.415	4.139	20	30		CIEDRN
C=CCC(CC=C)c1nc(Cc2ccc(C)s2)no1	ZINC000519032529	265300345	/nfs/dbraw/zinc/30/03/45/265300345.db2.gz	PITOUAGHLWZJHC-UHFFFAOYSA-N	0	0	274.389	4.266	20	30		CIEDRN
C=CCC[C@@H](Nc1cccc(CCCO)c1)c1ccco1	ZINC000519124967	265324839	/nfs/dbraw/zinc/32/48/39/265324839.db2.gz	PJCUMERSVZRFJG-QGZVFWFLSA-N	0	0	285.387	4.324	20	30		CIEDRN
Cc1cccc(C)c1CNc1ccc(Cl)c(C#N)c1	ZINC000096810907	265385108	/nfs/dbraw/zinc/38/51/08/265385108.db2.gz	HOJKYUQJGSWZAC-UHFFFAOYSA-N	0	0	270.763	4.441	20	30		CIEDRN
Cc1cnccc1SCC#Cc1cccc(Cl)c1	ZINC000519529566	265456621	/nfs/dbraw/zinc/45/66/21/265456621.db2.gz	VAQXWGZNDPUEGN-UHFFFAOYSA-N	0	0	273.788	4.187	20	30		CIEDRN
CC(C)(C)CCCCC(=O)N(CC#N)c1ccccc1	ZINC000519847223	265621769	/nfs/dbraw/zinc/62/17/69/265621769.db2.gz	XGMFJGCJBRCHCX-UHFFFAOYSA-N	0	0	272.392	4.150	20	30		CIEDRN
C=CCN(CC=C)C(=O)N[C@H]1CCC(C)(C)c2ccccc21	ZINC000520210609	265689652	/nfs/dbraw/zinc/68/96/52/265689652.db2.gz	UGCFOJFYOWDHHI-KRWDZBQOSA-N	0	0	298.430	4.183	20	30		CIEDRN
C[C@H](Nc1cnccc1C#N)c1cc2cccc(F)c2o1	ZINC000353057695	266026179	/nfs/dbraw/zinc/02/61/79/266026179.db2.gz	PPXOOGYMGDBNHZ-JTQLQIEISA-N	0	0	281.290	4.012	20	30		CIEDRN
C[C@H](Nc1ncccc1C#N)c1cc2cccc(F)c2o1	ZINC000353056294	266026404	/nfs/dbraw/zinc/02/64/04/266026404.db2.gz	QIQIBEXCMARGGC-JTQLQIEISA-N	0	0	281.290	4.012	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)C1CCC(=O)CC1	ZINC000356160174	266059970	/nfs/dbraw/zinc/05/99/70/266059970.db2.gz	BKRURRWZJCLPLH-UHFFFAOYSA-N	0	0	299.414	4.236	20	30		CIEDRN
C[C@@H]1CCC[C@H](C)N(C(=O)C[C@H](CC#N)c2ccccc2)C1	ZINC000356190501	266067408	/nfs/dbraw/zinc/06/74/08/266067408.db2.gz	KSVLOPIAOVROET-RYRKJORJSA-N	0	0	298.430	4.111	20	30		CIEDRN
CC1CCC(c2noc(CCc3ccc(C#N)cc3)n2)CC1	ZINC000356211554	266072879	/nfs/dbraw/zinc/07/28/79/266072879.db2.gz	FJVSFPUCSBMGAO-UHFFFAOYSA-N	0	0	295.386	4.020	20	30		CIEDRN
CC1CCC(c2noc(-c3cccc(CC#N)c3)n2)CC1	ZINC000356223605	266076597	/nfs/dbraw/zinc/07/65/97/266076597.db2.gz	SCUMSWNTCJXJCJ-UHFFFAOYSA-N	0	0	281.359	4.096	20	30		CIEDRN
CC(C)(C)CN(Cc1nc(C#N)cs1)Cc1ccccc1	ZINC000356232898	266078929	/nfs/dbraw/zinc/07/89/29/266078929.db2.gz	PUEVXLCYTLTBPX-UHFFFAOYSA-N	0	0	299.443	4.063	20	30		CIEDRN
CCC1(CC)CCN(C(=O)C[C@H](CC#N)c2ccccc2)C1	ZINC000356363394	266102696	/nfs/dbraw/zinc/10/26/96/266102696.db2.gz	JAQCJMPQQNNTIA-KRWDZBQOSA-N	0	0	298.430	4.113	20	30		CIEDRN
C[C@H](CC(C)(C)C)C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000356374568	266104233	/nfs/dbraw/zinc/10/42/33/266104233.db2.gz	VZHJFFJPQCCSOB-GDBMZVCRSA-N	0	0	286.419	4.220	20	30		CIEDRN
C=CCCC1(C(=O)N[C@@H]2CC(C)(C)Oc3ccccc32)CC1	ZINC000356425125	266111042	/nfs/dbraw/zinc/11/10/42/266111042.db2.gz	PRSOQKCYYSPCLG-OAHLLOKOSA-N	0	0	299.414	4.151	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1c[nH]cc1C	ZINC000356816451	266179715	/nfs/dbraw/zinc/17/97/15/266179715.db2.gz	OFYPALLPCGTJPL-UHFFFAOYSA-N	0	0	282.387	4.427	20	30		CIEDRN
C=C(C)CSCC(=O)N[C@@H](CC(C)C)c1ccccc1	ZINC000357024250	266235404	/nfs/dbraw/zinc/23/54/04/266235404.db2.gz	FDIMSYJVHKHSRR-INIZCTEOSA-N	0	0	291.460	4.199	20	30		CIEDRN
N#CCC(=O)Nc1cccc(CSC2CCCCC2)c1	ZINC000357056585	266239673	/nfs/dbraw/zinc/23/96/73/266239673.db2.gz	XJINBZVRUXLZIY-UHFFFAOYSA-N	0	0	288.416	4.105	20	30		CIEDRN
C=CCn1c(C)cc(C(=O)CSc2ccoc2C)c1C	ZINC000357090221	266246336	/nfs/dbraw/zinc/24/63/36/266246336.db2.gz	VYYWSCBXFNBGFP-UHFFFAOYSA-N	0	0	289.400	4.167	20	30		CIEDRN
Cc1ccc2sc(/C=C/c3nc(C#N)cs3)nc2c1	ZINC000357164978	266258502	/nfs/dbraw/zinc/25/85/02/266258502.db2.gz	BRCBAZWYLZYDLS-SNAWJCMRSA-N	0	0	283.381	4.103	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NCc1ncnn1C(C)C	ZINC000357187039	266261992	/nfs/dbraw/zinc/26/19/92/266261992.db2.gz	IADASFNQDOHVHW-UHFFFAOYSA-N	0	0	298.434	4.323	20	30		CIEDRN
Cc1nsc(N[C@H]2CCc3sc(Cl)cc32)c1C#N	ZINC000357607791	266335442	/nfs/dbraw/zinc/33/54/42/266335442.db2.gz	QIXMXYRKIZNXTB-VIFPVBQESA-N	0	0	295.820	4.138	20	30		CIEDRN
Cc1cc(NCc2ccc3sccc3c2)cc(C#N)n1	ZINC000357610957	266335526	/nfs/dbraw/zinc/33/55/26/266335526.db2.gz	UEXOIEFDHFKWAY-UHFFFAOYSA-N	0	0	279.368	4.089	20	30		CIEDRN
N#Cc1ccc(/C=C/c2cc3cc(F)ccc3o2)nc1	ZINC000358006860	266396755	/nfs/dbraw/zinc/39/67/55/266396755.db2.gz	SRGIKIYERWCLBE-SNAWJCMRSA-N	0	0	264.259	4.009	20	30		CIEDRN
CN(C(=O)C[C@H](CC#N)c1ccccc1)[C@@H]1CCC(C)(C)C1	ZINC000358071041	266414619	/nfs/dbraw/zinc/41/46/19/266414619.db2.gz	IAGFJSQBJXSBEO-DLBZAZTESA-N	0	0	298.430	4.111	20	30		CIEDRN
C=CCN(CCC#N)C(=O)c1coc2ccc(C(C)C)cc12	ZINC000359441713	266586580	/nfs/dbraw/zinc/58/65/80/266586580.db2.gz	QSBKSYLUGWOXAC-UHFFFAOYSA-N	0	0	296.370	4.098	20	30		CIEDRN
CC(C)(CCC#N)CNC(=O)c1occc1-c1ccccc1	ZINC000359761967	266636279	/nfs/dbraw/zinc/63/62/79/266636279.db2.gz	FDHFKKPGUUJROV-UHFFFAOYSA-N	0	0	296.370	4.006	20	30		CIEDRN
N#Cc1ccc(NC(=O)c2ccc(C3=CCCC3)cc2)cc1	ZINC000361282419	266815300	/nfs/dbraw/zinc/81/53/00/266815300.db2.gz	WLLKYVSVLHRIBU-UHFFFAOYSA-N	0	0	288.350	4.378	20	30		CIEDRN
CC#CCCCC(=O)N(Cc1ccco1)c1ccccc1	ZINC000362226883	266947541	/nfs/dbraw/zinc/94/75/41/266947541.db2.gz	OACSTTPHRIUWGH-UHFFFAOYSA-N	0	0	281.355	4.006	20	30		CIEDRN
CCCC(C)(C)N(Cc1cccs1)C(=O)CCCC#N	ZINC000362275813	266953696	/nfs/dbraw/zinc/95/36/96/266953696.db2.gz	BEZVXVWMLYITPB-UHFFFAOYSA-N	0	0	292.448	4.349	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N1CCC[C@@H](C)[C@H]1C	ZINC000362816765	267050077	/nfs/dbraw/zinc/05/00/77/267050077.db2.gz	FDOHAXXAXSSIHW-ZIAGYGMSSA-N	0	0	289.444	4.225	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N1C[C@H](C)CC[C@@H]1C	ZINC000362819930	267051087	/nfs/dbraw/zinc/05/10/87/267051087.db2.gz	ISGQCSUMQUDUAR-KGLIPLIRSA-N	0	0	289.444	4.225	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N1C[C@@H](C)CC[C@H]1C	ZINC000362819931	267051432	/nfs/dbraw/zinc/05/14/32/267051432.db2.gz	ISGQCSUMQUDUAR-UONOGXRCSA-N	0	0	289.444	4.225	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@H]1c1ccc(Cl)cc1	ZINC000368434075	267171487	/nfs/dbraw/zinc/17/14/87/267171487.db2.gz	PMBOAKDDQONHJQ-WFASDCNBSA-N	0	0	277.795	4.216	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)c1sc2ccc(F)cc2c1C	ZINC000116849584	267183677	/nfs/dbraw/zinc/18/36/77/267183677.db2.gz	SFCHKYNJXGEKBK-SECBINFHSA-N	0	0	277.364	4.043	20	30		CIEDRN
Cc1cc(C#N)ccc1C(=O)Nc1cccc(C(F)F)c1	ZINC000119127998	267302246	/nfs/dbraw/zinc/30/22/46/267302246.db2.gz	AFVOGMZLISBAOX-UHFFFAOYSA-N	0	0	286.281	4.057	20	30		CIEDRN
N#CCC[C@H](NCc1cc(F)cc(F)c1)c1ccccc1	ZINC000119273775	267314241	/nfs/dbraw/zinc/31/42/41/267314241.db2.gz	NLBFFOGKZVSBNX-KRWDZBQOSA-N	0	0	286.325	4.099	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1C[C@@H](c2ccsc2)C[C@H]1C	ZINC000370450913	267319667	/nfs/dbraw/zinc/31/96/67/267319667.db2.gz	XOTDTGBUNWNEJJ-CJNGLKHVSA-N	0	0	289.444	4.221	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1C[C@@H](c2cccs2)C[C@@H]1C	ZINC000370448887	267319706	/nfs/dbraw/zinc/31/97/06/267319706.db2.gz	HNJFFFIRMSOJET-ZFWWWQNUSA-N	0	0	289.444	4.221	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccccc1-c1nc(C)c[nH]1	ZINC000371249282	267377352	/nfs/dbraw/zinc/37/73/52/267377352.db2.gz	ZMPFKAXLVPJTSK-UHFFFAOYSA-N	0	0	295.386	4.092	20	30		CIEDRN
N#CCCCCSc1nccn1-c1cccc(Cl)c1	ZINC000122045373	267800362	/nfs/dbraw/zinc/80/03/62/267800362.db2.gz	LAOLLBMNTBWXFD-UHFFFAOYSA-N	0	0	291.807	4.312	20	30		CIEDRN
CC(C)c1cnc(SCCCCC#N)n1C(C)C	ZINC000122748420	267922922	/nfs/dbraw/zinc/92/29/22/267922922.db2.gz	PVTGHIZGGOFYIQ-UHFFFAOYSA-N	0	0	265.426	4.373	20	30		CIEDRN
C=CCCCCC[N@@H+]1CCC[C@@H]1c1nccs1	ZINC000377096519	268047221	/nfs/dbraw/zinc/04/72/21/268047221.db2.gz	BOKKRAWWCCLSIQ-CYBMUJFWSA-N	0	0	250.411	4.026	20	30		CIEDRN
C=Cc1ccc(C(=O)N[C@H](CCC#N)c2ccccc2)cc1	ZINC000192186817	335091206	/nfs/dbraw/zinc/09/12/06/335091206.db2.gz	SBRMIMLZGVQZDH-GOSISDBHSA-N	0	0	290.366	4.104	20	30		CIEDRN
N#CCCC1CCN(C(=O)c2cccc3ccsc32)CC1	ZINC000335384815	335092226	/nfs/dbraw/zinc/09/22/26/335092226.db2.gz	NMKHIIXIQXCATI-UHFFFAOYSA-N	0	0	298.411	4.057	20	30		CIEDRN
CC1(Cc2noc(/C=C\c3ccc(C#N)cc3)n2)CCCC1	ZINC000570760126	327616471	/nfs/dbraw/zinc/61/64/71/327616471.db2.gz	ADZLKTBJGRTUSR-HJWRWDBZSA-N	0	0	293.370	4.234	20	30		CIEDRN
C=CC(C)(C)C(=O)Nc1cccc(Cl)c1Cl	ZINC000570779044	327618464	/nfs/dbraw/zinc/61/84/64/327618464.db2.gz	OSIREPJRHJAGDP-UHFFFAOYSA-N	0	0	258.148	4.144	20	30		CIEDRN
Cc1ccc(C#N)c(N[C@@H]2CCSc3c(F)cccc32)n1	ZINC000160558813	327621328	/nfs/dbraw/zinc/62/13/28/327621328.db2.gz	NZWSKZVXXVOSPL-CQSZACIVSA-N	0	0	299.374	4.050	20	30		CIEDRN
C=CCN(C(=O)[C@@H](C)c1ccc2ccccc2c1)C1CC1	ZINC000537929300	327625542	/nfs/dbraw/zinc/62/55/42/327625542.db2.gz	BFCSSEUCQJUTSC-AWEZNQCLSA-N	0	0	279.383	4.120	20	30		CIEDRN
Cc1noc(C)c1-c1ccc(OCC2(C#N)CCC2)cc1	ZINC000580173539	327720123	/nfs/dbraw/zinc/72/01/23/327720123.db2.gz	QFPURKLKUCWPKM-UHFFFAOYSA-N	0	0	282.343	4.031	20	30		CIEDRN
Cc1cc([C@@H](C)Nc2ccc(F)cc2C#N)c(C)o1	ZINC000113317596	327786265	/nfs/dbraw/zinc/78/62/65/327786265.db2.gz	GNBQOVIASSSMJM-SNVBAGLBSA-N	0	0	258.296	4.080	20	30		CIEDRN
CCSc1nnc(SCCCC(C)(C)C#N)s1	ZINC000177152548	327788038	/nfs/dbraw/zinc/78/80/38/327788038.db2.gz	RFRIIVPCUBSRGA-UHFFFAOYSA-N	0	0	287.479	4.072	20	30		CIEDRN
Cc1cc(COc2cccc(F)c2C#N)c2ccccc2n1	ZINC000387934880	327820254	/nfs/dbraw/zinc/82/02/54/327820254.db2.gz	RYQBPMHMBLNIMV-UHFFFAOYSA-N	0	0	292.313	4.133	20	30		CIEDRN
N#CCc1ccc(CSCc2nc3ccccc3[nH]2)cc1	ZINC000582055194	327823020	/nfs/dbraw/zinc/82/30/20/327823020.db2.gz	VLZQXQOKBFXFNB-UHFFFAOYSA-N	0	0	293.395	4.062	20	30		CIEDRN
CC#CCCCC(=O)Nc1cccc(Cl)c1Cl	ZINC000184879550	327834452	/nfs/dbraw/zinc/83/44/52/327834452.db2.gz	WEGADWRZNVLOMJ-UHFFFAOYSA-N	0	0	270.159	4.126	20	30		CIEDRN
CC#CCCCC(=O)N1CCC[C@H]1c1cccc(C)c1C	ZINC000185655281	327842329	/nfs/dbraw/zinc/84/23/29/327842329.db2.gz	RKUZOTYKQFYAQO-SFHVURJKSA-N	0	0	283.415	4.161	20	30		CIEDRN
N#C[C@@H]1CCC[C@@H](Nc2ccccc2CC(F)(F)F)C1	ZINC000185749745	327844055	/nfs/dbraw/zinc/84/40/55/327844055.db2.gz	VKQFPWPRHVOKQO-DGCLKSJQSA-N	0	0	282.309	4.286	20	30		CIEDRN
N#Cc1ccc(CNc2cc(C(F)(F)F)ccc2F)cc1	ZINC000062655438	327853989	/nfs/dbraw/zinc/85/39/89/327853989.db2.gz	FNJNCCPCHMTGQK-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
Cc1cc(C)cc(-c2nnc(S[C@@H](C)CCC#N)o2)c1	ZINC000188263128	327862480	/nfs/dbraw/zinc/86/24/80/327862480.db2.gz	SGFVAQDHBULAGG-LBPRGKRZSA-N	0	0	287.388	4.138	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1ccc(/C=C\C)cc1	ZINC000497398130	327863471	/nfs/dbraw/zinc/86/34/71/327863471.db2.gz	YIJFRZUEVHOMLM-QTONRWBISA-N	0	0	270.376	4.292	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1ccc(/C=C\C)cc1	ZINC000497398129	327863506	/nfs/dbraw/zinc/86/35/06/327863506.db2.gz	YIJFRZUEVHOMLM-NKPXIPJASA-N	0	0	270.376	4.292	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)c1ccc(F)c(Cl)c1	ZINC000189932357	327869053	/nfs/dbraw/zinc/86/90/53/327869053.db2.gz	FZCYYPHWWQXCSS-UHFFFAOYSA-N	0	0	296.773	4.024	20	30		CIEDRN
Cc1cccc(CC[C@@H](C)Nc2ccc(CC#N)cc2)c1	ZINC000040500703	327907381	/nfs/dbraw/zinc/90/73/81/327907381.db2.gz	PIVQTSMQNXVZOG-MRXNPFEDSA-N	0	0	278.399	4.494	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N(C)Cc1cccc(OC(C)C)c1	ZINC000188547685	327916743	/nfs/dbraw/zinc/91/67/43/327916743.db2.gz	MEVYGYCYNWUXOF-SFHVURJKSA-N	0	0	289.419	4.035	20	30		CIEDRN
N#CCCCCSCc1coc(-c2ccc(F)cc2)n1	ZINC000161402965	327916805	/nfs/dbraw/zinc/91/68/05/327916805.db2.gz	RWFIWHFHKGSDPI-UHFFFAOYSA-N	0	0	290.363	4.408	20	30		CIEDRN
C=CC[C@H](C)NC(=O)c1c(C)c(C)oc1-c1ccccc1	ZINC000187078587	327943173	/nfs/dbraw/zinc/94/31/73/327943173.db2.gz	WPXGVFABNOJHOE-LBPRGKRZSA-N	0	0	283.371	4.258	20	30		CIEDRN
CCSc1cccc(NC(=O)c2ccc(CC#N)cc2)c1	ZINC000533948480	327943348	/nfs/dbraw/zinc/94/33/48/327943348.db2.gz	VXWVMOINXKTMPH-UHFFFAOYSA-N	0	0	296.395	4.117	20	30		CIEDRN
CCCC[C@H](CC)CC(=O)N1CCC(CCC#N)CC1	ZINC000563185664	327953192	/nfs/dbraw/zinc/95/31/92/327953192.db2.gz	KXTFMEWDJRZURY-HNNXBMFYSA-N	0	0	278.440	4.135	20	30		CIEDRN
Cc1cc(C#N)ccc1OCc1nc(C(C)(C)C)cs1	ZINC000531522015	328013796	/nfs/dbraw/zinc/01/37/96/328013796.db2.gz	UQECDYLFAFQWJK-UHFFFAOYSA-N	0	0	286.400	4.200	20	30		CIEDRN
C=CCN[C@H](c1ccc(OC)cc1)c1ccccc1Cl	ZINC000531791229	328034559	/nfs/dbraw/zinc/03/45/59/328034559.db2.gz	PDCRRBGQNYBVBI-QGZVFWFLSA-N	0	0	287.790	4.214	20	30		CIEDRN
C=CCCCC(=O)NC1(c2ccc(F)cc2F)CCCC1	ZINC000534108452	328035694	/nfs/dbraw/zinc/03/56/94/328035694.db2.gz	QCHOCOWVEXDENB-UHFFFAOYSA-N	0	0	293.357	4.207	20	30		CIEDRN
C=CCCC(=O)COc1cc(C(F)(F)F)ccc1Cl	ZINC000534243710	328041589	/nfs/dbraw/zinc/04/15/89/328041589.db2.gz	DNFYYRFOGGEZOW-UHFFFAOYSA-N	0	0	292.684	4.273	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)N(CC)c1cc(C)cc(C)c1)OCC	ZINC000534389896	328050480	/nfs/dbraw/zinc/05/04/80/328050480.db2.gz	MDGDVQSPCFOZNL-QGZVFWFLSA-N	0	0	289.419	4.028	20	30		CIEDRN
C=CC1CCN(C(=O)[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)CC1	ZINC000534420672	328052417	/nfs/dbraw/zinc/05/24/17/328052417.db2.gz	FNHHUXTWKOATMK-GVDBMIGSSA-N	0	0	275.436	4.018	20	30		CIEDRN
C=CCOc1ccc(CN(CCC#N)C(C)C)cc1Cl	ZINC000534337073	328049642	/nfs/dbraw/zinc/04/96/42/328049642.db2.gz	VYEAJSOBISQSKQ-UHFFFAOYSA-N	0	0	292.810	4.029	20	30		CIEDRN
C=CCCCCCNC(=O)c1ccccc1C(F)(F)F	ZINC000563356999	328057864	/nfs/dbraw/zinc/05/78/64/328057864.db2.gz	RBCHRXIMXMCWTD-UHFFFAOYSA-N	0	0	285.309	4.182	20	30		CIEDRN
C=CCCCCCNC(=O)N(C)[C@@H](C)c1cccs1	ZINC000563372582	328057906	/nfs/dbraw/zinc/05/79/06/328057906.db2.gz	ATFUCQVBOQGXEY-ZDUSSCGKSA-N	0	0	280.437	4.197	20	30		CIEDRN
CC[C@H](CC#N)NCc1ccc(-c2ccccc2C#N)cc1	ZINC000563368536	328059885	/nfs/dbraw/zinc/05/98/85/328059885.db2.gz	XBPRJZVQDULPTD-GOSISDBHSA-N	0	0	289.382	4.007	20	30		CIEDRN
CC[C@@](C)(C#N)c1nc([C@@H](c2ccccc2C)C(C)C)no1	ZINC000563479252	328068817	/nfs/dbraw/zinc/06/88/17/328068817.db2.gz	CWRLWCCDMMTPLK-QAPCUYQASA-N	0	0	297.402	4.357	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1ccccc1N(C)C)c1ccccc1	ZINC000152128760	328071424	/nfs/dbraw/zinc/07/14/24/328071424.db2.gz	VSHNIQLBSRRVKT-OAHLLOKOSA-N	0	0	294.398	4.051	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1cncc(-c2ccc(C)cc2)c1	ZINC000160823409	328088441	/nfs/dbraw/zinc/08/84/41/328088441.db2.gz	USVUOZHFGPCQOA-UHFFFAOYSA-N	0	0	294.398	4.095	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(-c2ccncc2)c(C)c1	ZINC000571270948	328096630	/nfs/dbraw/zinc/09/66/30/328096630.db2.gz	ONXZHSZTQBDJMK-UHFFFAOYSA-N	0	0	280.371	4.352	20	30		CIEDRN
C=CCCNc1ccccc1O[C@H](C)C(F)(F)F	ZINC000571244053	328094924	/nfs/dbraw/zinc/09/49/24/328094924.db2.gz	SAAZVFCGGHIZKK-SNVBAGLBSA-N	0	0	259.271	4.004	20	30		CIEDRN
C[C@H]1CC=C(C(=O)Nc2ccc(Cl)cc2CC#N)CC1	ZINC000571297318	328100442	/nfs/dbraw/zinc/10/04/42/328100442.db2.gz	ITKZHALGJLFYGP-NSHDSACASA-N	0	0	288.778	4.091	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)NCc1ccc2sccc2c1	ZINC000571371559	328117315	/nfs/dbraw/zinc/11/73/15/328117315.db2.gz	PRLIUADKSXXCPN-AWEZNQCLSA-N	0	0	288.416	4.055	20	30		CIEDRN
CCN(C(=O)c1ccc(C(C)(C)C#N)cc1)C1CC(C)(C)C1	ZINC000412808384	328125904	/nfs/dbraw/zinc/12/59/04/328125904.db2.gz	GVQAXVWAJROVDQ-UHFFFAOYSA-N	0	0	298.430	4.138	20	30		CIEDRN
C=C(C)[C@H](CC(=O)Nc1ccccc1C(C)(C)C)OCC	ZINC000534462072	328130224	/nfs/dbraw/zinc/13/02/24/328130224.db2.gz	DCNRYWKUXSNNPI-INIZCTEOSA-N	0	0	289.419	4.294	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N[C@H](C)c1ccccc1Cl	ZINC000541776837	328130906	/nfs/dbraw/zinc/13/09/06/328130906.db2.gz	WVXCYYNDHCAWIC-VXGBXAGGSA-N	0	0	280.799	4.055	20	30		CIEDRN
C=CCC[C@@H](Nc1ccc([C@@H]2CCOC2)cc1)C1CC1	ZINC000571543812	328132876	/nfs/dbraw/zinc/13/28/76/328132876.db2.gz	ZUORZEMLFRNSDI-SJLPKXTDSA-N	0	0	271.404	4.347	20	30		CIEDRN
N#CCCSCc1csc(-c2cccs2)n1	ZINC000413009396	328139324	/nfs/dbraw/zinc/13/93/24/328139324.db2.gz	CMYRMZSDLOZOQK-UHFFFAOYSA-N	0	0	266.416	4.018	20	30		CIEDRN
N#CCCSCCOc1cc(Cl)cc(Cl)c1	ZINC000413011862	328139793	/nfs/dbraw/zinc/13/97/93/328139793.db2.gz	KAARGMRPCNREGE-UHFFFAOYSA-N	0	0	276.188	4.019	20	30		CIEDRN
N#Cc1cccnc1N1CC2(CCCC2)[C@H]1c1ccccc1	ZINC000413355669	328144081	/nfs/dbraw/zinc/14/40/81/328144081.db2.gz	BCTBRBZTGZRFED-QGZVFWFLSA-N	0	0	289.382	4.075	20	30		CIEDRN
Cc1nc(NC2CCC(C(F)F)CC2)c(Cl)cc1C#N	ZINC000413438207	328145567	/nfs/dbraw/zinc/14/55/67/328145567.db2.gz	IQADCUJVNAKANJ-UHFFFAOYSA-N	0	0	299.752	4.151	20	30		CIEDRN
CC[C@H](CNc1cc(C(C)=O)ccc1C#N)CC(F)(F)F	ZINC000413517665	328147877	/nfs/dbraw/zinc/14/78/77/328147877.db2.gz	HQEKHXYYOBGDSW-NSHDSACASA-N	0	0	298.308	4.151	20	30		CIEDRN
CCc1ccc([C@H](C)NC2(c3cccc(C#N)c3)CC2)o1	ZINC000272339417	328199859	/nfs/dbraw/zinc/19/98/59/328199859.db2.gz	ZIUBLXOJSMGZFX-ZDUSSCGKSA-N	0	0	280.371	4.054	20	30		CIEDRN
CCc1ccc([C@@H](C)NC2(c3cccc(C#N)c3)CC2)o1	ZINC000272339413	328199911	/nfs/dbraw/zinc/19/99/11/328199911.db2.gz	ZIUBLXOJSMGZFX-CYBMUJFWSA-N	0	0	280.371	4.054	20	30		CIEDRN
CCCCn1c(C)c(C)nc1S[C@H]1CC[C@H](C#N)C1	ZINC000278691405	328229429	/nfs/dbraw/zinc/22/94/29/328229429.db2.gz	ZLAYRPKUBSITQW-KBPBESRZSA-N	0	0	277.437	4.084	20	30		CIEDRN
CCCCn1c(C)c(C)nc1S[C@@H]1CC[C@H](C#N)C1	ZINC000278691413	328229604	/nfs/dbraw/zinc/22/96/04/328229604.db2.gz	ZLAYRPKUBSITQW-UONOGXRCSA-N	0	0	277.437	4.084	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@H]1C[C@@H]1c1sccc1C	ZINC000438823881	328244999	/nfs/dbraw/zinc/24/49/99/328244999.db2.gz	NFCCELUCWNZPTD-GJZGRUSLSA-N	0	0	291.460	4.365	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@@H]1C[C@@H]1c1sccc1C	ZINC000438823883	328245194	/nfs/dbraw/zinc/24/51/94/328245194.db2.gz	NFCCELUCWNZPTD-LSDHHAIUSA-N	0	0	291.460	4.365	20	30		CIEDRN
N#C[C@H]1CC[C@@H](Sc2nc(-c3ccccc3)co2)C1	ZINC000287506018	328251567	/nfs/dbraw/zinc/25/15/67/328251567.db2.gz	KYMQOOCMKSKDCJ-WCQYABFASA-N	0	0	270.357	4.126	20	30		CIEDRN
Cc1ccccc1[C@H](c1noc(C2(C#N)CCC2)n1)C(C)C	ZINC000289244435	328254252	/nfs/dbraw/zinc/25/42/52/328254252.db2.gz	XWDZPDBCORIPSA-OAHLLOKOSA-N	0	0	295.386	4.111	20	30		CIEDRN
N#CCCCC(=O)N(Cc1ccccc1)C1CCCCC1	ZINC000291542674	328265042	/nfs/dbraw/zinc/26/50/42/328265042.db2.gz	RKVWUQYCQGHCDM-UHFFFAOYSA-N	0	0	284.403	4.042	20	30		CIEDRN
C[C@@H](c1ccccc1)N(CC1CCC1)C(=O)CCCC#N	ZINC000291836371	328266634	/nfs/dbraw/zinc/26/66/34/328266634.db2.gz	BJWSKJDNZRJBES-HNNXBMFYSA-N	0	0	284.403	4.070	20	30		CIEDRN
CCN(C(=O)CCCC#N)[C@@H](C)c1cc2ccccc2o1	ZINC000292174189	328268320	/nfs/dbraw/zinc/26/83/20/328268320.db2.gz	AJGLTDZMHCLACJ-ZDUSSCGKSA-N	0	0	284.359	4.036	20	30		CIEDRN
N#CCCCC(=O)Nc1ccc(SC2CCCC2)cc1	ZINC000292521092	328271135	/nfs/dbraw/zinc/27/11/35/328271135.db2.gz	GZXRGHKQFWAVAJ-UHFFFAOYSA-N	0	0	288.416	4.354	20	30		CIEDRN
CC/C(C)=C/C(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1	ZINC000294526926	328281724	/nfs/dbraw/zinc/28/17/24/328281724.db2.gz	HAMJTDGJDVKYCJ-YSKGHYERSA-N	0	0	297.185	4.031	20	30		CIEDRN
C[C@@H](SC[C@H](O)CC#N)c1ccc(Cl)c(Cl)c1	ZINC000296135762	328289226	/nfs/dbraw/zinc/28/92/26/328289226.db2.gz	WWCGHBILLVTOAI-PSASIEDQSA-N	0	0	290.215	4.062	20	30		CIEDRN
CC(C)c1cccc(-c2ccc(C(=O)N(C)[C@H](C)C#N)o2)c1	ZINC000297775984	328294521	/nfs/dbraw/zinc/29/45/21/328294521.db2.gz	IRRZMMHDCJWKSR-CYBMUJFWSA-N	0	0	296.370	4.054	20	30		CIEDRN
C=CCN(C(=O)c1cccc(Cl)c1F)c1ccccc1	ZINC000531923203	328313389	/nfs/dbraw/zinc/31/33/89/328313389.db2.gz	FRHFTEOQIVMYCA-UHFFFAOYSA-N	0	0	289.737	4.312	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)[C@H]2CC23CCCCC3)s1	ZINC000531923787	328315600	/nfs/dbraw/zinc/31/56/00/328315600.db2.gz	UNLHIBIZUBZUOE-CYBMUJFWSA-N	0	0	288.416	4.091	20	30		CIEDRN
CC(C)C[C@](C)(C#N)NC(=O)c1cc2sccc2s1	ZINC000534596626	328319336	/nfs/dbraw/zinc/31/93/36/328319336.db2.gz	JNCRQDXSPOPMDQ-CQSZACIVSA-N	0	0	292.429	4.021	20	30		CIEDRN
CCc1nc2sccc2c(Sc2ccc(C#N)cc2)n1	ZINC000534602596	328321046	/nfs/dbraw/zinc/32/10/46/328321046.db2.gz	RHNPJHQGNDMPBD-UHFFFAOYSA-N	0	0	297.408	4.277	20	30		CIEDRN
Cc1ccc(C(=O)Nc2ccc(Cl)c(C#N)c2)c(C)c1	ZINC000048824329	328324796	/nfs/dbraw/zinc/32/47/96/328324796.db2.gz	ODWHVLPIIUSSSA-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
C=C(C)COc1c(Cl)c(Cl)ccc1C(C)=O	ZINC000303137922	328328773	/nfs/dbraw/zinc/32/87/73/328328773.db2.gz	DDWSHCRJQHMUQY-UHFFFAOYSA-N	0	0	259.132	4.151	20	30		CIEDRN
N#Cc1c(NCCc2cccs2)cccc1C(F)F	ZINC000583113994	329313148	/nfs/dbraw/zinc/31/31/48/329313148.db2.gz	XZPGVRMUOSAFNM-UHFFFAOYSA-N	0	0	278.327	4.212	20	30		CIEDRN
C=C[C@H](CC(=O)N([C@@H](C)C(C)C)C1CC1)c1ccccc1	ZINC000534646069	328333625	/nfs/dbraw/zinc/33/36/25/328333625.db2.gz	BECXTWUHKGKXCW-JKSUJKDBSA-N	0	0	285.431	4.382	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@@H](C)Cc1ccsc1)c1ccccc1	ZINC000534644912	328330498	/nfs/dbraw/zinc/33/04/98/328330498.db2.gz	BOJLBAHDDCDPLE-GOEBONIOSA-N	0	0	299.439	4.155	20	30		CIEDRN
CC[C@H](CNc1ccc(Cl)c(C#N)n1)c1ccccc1	ZINC000111218694	328331129	/nfs/dbraw/zinc/33/11/29/328331129.db2.gz	HCCOLJCORUWEIR-GFCCVEGCSA-N	0	0	285.778	4.212	20	30		CIEDRN
CC(C)(C)CN(CCC#N)c1nc2ccccc2s1	ZINC000534657980	328341013	/nfs/dbraw/zinc/34/10/13/328341013.db2.gz	WKSJABTXIOUOSW-UHFFFAOYSA-N	0	0	273.405	4.062	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@H]1CCCC(F)(F)C1)c1ccccc1	ZINC000534667693	328345838	/nfs/dbraw/zinc/34/58/38/328345838.db2.gz	YSFWQHZFYJNSEY-HIFRSBDPSA-N	0	0	293.357	4.040	20	30		CIEDRN
CC(C)C[C@@H]1CCCCCN1C(=O)c1ccc(CC#N)cc1	ZINC000534664135	328351508	/nfs/dbraw/zinc/35/15/08/328351508.db2.gz	FMSMNHABVBVOGO-SFHVURJKSA-N	0	0	298.430	4.184	20	30		CIEDRN
C=C[C@H](CC(=O)NCC1(CC)CCC1)c1ccccc1	ZINC000534720766	328359144	/nfs/dbraw/zinc/35/91/44/328359144.db2.gz	CHFRMBCESXJSDJ-OAHLLOKOSA-N	0	0	271.404	4.043	20	30		CIEDRN
C=C[C@@H](CC(=O)NCCc1ccccc1C)c1ccccc1	ZINC000534725408	328359415	/nfs/dbraw/zinc/35/94/15/328359415.db2.gz	HWCOPJYBSHTRMI-KRWDZBQOSA-N	0	0	293.410	4.014	20	30		CIEDRN
C=CCCC(=O)N[C@@H](Cc1ccccc1)c1ccccc1F	ZINC000303829842	328359610	/nfs/dbraw/zinc/35/96/10/328359610.db2.gz	LHSZVYQXFKFFSZ-SFHVURJKSA-N	0	0	297.373	4.192	20	30		CIEDRN
CCN(C(=O)Nc1ccc(C#N)c(Cl)c1)[C@@H](C)C(C)C	ZINC000049414302	328358637	/nfs/dbraw/zinc/35/86/37/328358637.db2.gz	RORIXQNWDGHREM-NSHDSACASA-N	0	0	293.798	4.110	20	30		CIEDRN
C=CCCCNc1ccccc1N1CCCCCC1	ZINC000303887305	328364605	/nfs/dbraw/zinc/36/46/05/328364605.db2.gz	RPDJNIMLXNKJPV-UHFFFAOYSA-N	0	0	258.409	4.445	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)[C@@H]2CCC[C@H](C)C2)c1	ZINC000303953270	328369864	/nfs/dbraw/zinc/36/98/64/328369864.db2.gz	ZNXHAXIFEOGRGR-LSDHHAIUSA-N	0	0	287.403	4.406	20	30		CIEDRN
CC[C@H](C)Oc1cccc(NCc2cccc(C#N)c2)c1	ZINC000049593057	328374172	/nfs/dbraw/zinc/37/41/72/328374172.db2.gz	CEMPPAMPEWIBET-AWEZNQCLSA-N	0	0	280.371	4.348	20	30		CIEDRN
CC[C@@H](C)Oc1cccc(NCc2ccc(C#N)cc2)c1	ZINC000049593052	328373965	/nfs/dbraw/zinc/37/39/65/328373965.db2.gz	LGHQQARBCOBCLT-CQSZACIVSA-N	0	0	280.371	4.348	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)C1CCCCCC1	ZINC000101809857	328377255	/nfs/dbraw/zinc/37/72/55/328377255.db2.gz	HJPKVLSQSWYQLP-UHFFFAOYSA-N	0	0	277.433	4.233	20	30		CIEDRN
CCN(C(=O)C1CCCCCC1)[C@H](C)c1ccc(C#N)cc1	ZINC000101812662	328377673	/nfs/dbraw/zinc/37/76/73/328377673.db2.gz	LURBFDHEMITKQU-OAHLLOKOSA-N	0	0	298.430	4.438	20	30		CIEDRN
Cc1ccc(C#N)c(NCc2c(Cl)cccc2Cl)n1	ZINC000535035431	328379103	/nfs/dbraw/zinc/37/91/03/328379103.db2.gz	ANXRRATYJQVTNF-UHFFFAOYSA-N	0	0	292.169	4.181	20	30		CIEDRN
Cc1cc(C)c(CNc2ccc(C#N)cc2F)c(C)c1	ZINC000112012624	328381828	/nfs/dbraw/zinc/38/18/28/328381828.db2.gz	FJUXHIBRDIMYKH-UHFFFAOYSA-N	0	0	268.335	4.235	20	30		CIEDRN
Cc1cc(CN(CCC#N)C(C)C)cc(C)c1OC(F)F	ZINC000535077124	328384795	/nfs/dbraw/zinc/38/47/95/328384795.db2.gz	HJUZKDLMGHZIOS-UHFFFAOYSA-N	0	0	296.361	4.029	20	30		CIEDRN
C=C(C)CS[C@@H](C)c1nc(-c2cccs2)no1	ZINC000121842339	328386639	/nfs/dbraw/zinc/38/66/39/328386639.db2.gz	QFNBKLCRHNOGDS-VIFPVBQESA-N	0	0	266.391	4.168	20	30		CIEDRN
N#Cc1cccc(Nc2ccc(CCC(F)(F)F)cc2)n1	ZINC000535133088	328389716	/nfs/dbraw/zinc/38/97/16/328389716.db2.gz	GUHSCXOTOGXTNU-UHFFFAOYSA-N	0	0	291.276	4.192	20	30		CIEDRN
C=CCN(CC(F)(F)F)C(=O)C[C@@H]1CCCC(C)(C)C1	ZINC000535160559	328393889	/nfs/dbraw/zinc/39/38/89/328393889.db2.gz	DMLUNFQTLOZQFW-LBPRGKRZSA-N	0	0	291.357	4.170	20	30		CIEDRN
CC1(C)CCC[C@@H](C(=O)Nc2ccc(C#N)cc2Cl)C1	ZINC000535210274	328394728	/nfs/dbraw/zinc/39/47/28/328394728.db2.gz	JKYUKYOEFJHVPV-GFCCVEGCSA-N	0	0	290.794	4.367	20	30		CIEDRN
CC(C)c1ccc(-n2ccnc2SCCCC#N)cc1	ZINC000341741152	328415380	/nfs/dbraw/zinc/41/53/80/328415380.db2.gz	DFDWXEAZJCWBDU-UHFFFAOYSA-N	0	0	285.416	4.392	20	30		CIEDRN
CN(C(=O)c1ccc(CC#N)cc1)[C@H]1CCC[C@H]1C(C)(C)C	ZINC000416282835	328434221	/nfs/dbraw/zinc/43/42/21/328434221.db2.gz	DETCSHFZCVPKFA-SJORKVTESA-N	0	0	298.430	4.039	20	30		CIEDRN
Cc1ccc(C#N)cc1NCc1cccc(Cl)c1	ZINC000050429258	328439500	/nfs/dbraw/zinc/43/95/00/328439500.db2.gz	ZWKWREOFQPCYFG-UHFFFAOYSA-N	0	0	256.736	4.132	20	30		CIEDRN
C=C(C)[C@H](Cc1nc([C@H]2CCCC(C)(C)C2)no1)OCC	ZINC000535354565	328444256	/nfs/dbraw/zinc/44/42/56/328444256.db2.gz	KKYRXJAHZCZGKK-KBPBESRZSA-N	0	0	292.423	4.277	20	30		CIEDRN
N#Cc1ccc(NC2CC(c3ccccc3)C2)c(F)c1	ZINC000112633215	328444456	/nfs/dbraw/zinc/44/44/56/328444456.db2.gz	ZJMKQUVUBFWSJC-UHFFFAOYSA-N	0	0	266.319	4.055	20	30		CIEDRN
CC(C)CC1(CNC(=O)c2ccc(CC#N)cc2)CCCC1	ZINC000535440114	328452124	/nfs/dbraw/zinc/45/21/24/328452124.db2.gz	IEGVALFWZRCYFL-UHFFFAOYSA-N	0	0	298.430	4.089	20	30		CIEDRN
CC(C)OCc1ccc(NC(=O)NC2(C)CCCC2)cc1	ZINC000330586003	328463578	/nfs/dbraw/zinc/46/35/78/328463578.db2.gz	NDVIMLKFSDLDRJ-UHFFFAOYSA-N	0	0	290.407	4.270	20	30		CIEDRN
N#C[C@H](NC(=O)c1cc(F)cc(Cl)c1)C1CCCCC1	ZINC000330588591	328463983	/nfs/dbraw/zinc/46/39/83/328463983.db2.gz	WVXUCLVISLRAFK-AWEZNQCLSA-N	0	0	294.757	4.256	20	30		CIEDRN
CC[C@@H](C)n1ncc(NC(=O)NCC2(C)CCCC2)c1C	ZINC000331144632	328477353	/nfs/dbraw/zinc/47/73/53/328477353.db2.gz	SBFAHCCXSKIZPJ-GFCCVEGCSA-N	0	0	292.427	4.069	20	30		CIEDRN
CC(C)(C#N)CCSc1ccc(C#N)cc1Cl	ZINC000154167102	328486748	/nfs/dbraw/zinc/48/67/48/328486748.db2.gz	DQTADQRSNIPSFD-UHFFFAOYSA-N	0	0	264.781	4.244	20	30		CIEDRN
CC(C)(C)CC(C)(C)NC(=O)Nc1ccc(CC#N)cc1	ZINC000130070446	328487676	/nfs/dbraw/zinc/48/76/76/328487676.db2.gz	FCEQUUPNJVLZBX-UHFFFAOYSA-N	0	0	287.407	4.089	20	30		CIEDRN
N#Cc1ccccc1NC(=O)C[C@@H]1CCCc2ccccc21	ZINC000170986575	328517897	/nfs/dbraw/zinc/51/78/97/328517897.db2.gz	LXKFCPIUARCSCD-HNNXBMFYSA-N	0	0	290.366	4.007	20	30		CIEDRN
C=CCC[C@@H](Nc1ccc(OC2COC2)cc1)c1ccco1	ZINC000287335685	328523752	/nfs/dbraw/zinc/52/37/52/328523752.db2.gz	GDJSDIWHHOQZNC-QGZVFWFLSA-N	0	0	299.370	4.177	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cccc(F)c1Cl	ZINC000290224134	328530166	/nfs/dbraw/zinc/53/01/66/328530166.db2.gz	VIICVRKZRQBXIQ-VIFPVBQESA-N	0	0	255.720	4.020	20	30		CIEDRN
C[C@@H]1CN(CCCCC(C)(C)C#N)c2ccccc21	ZINC000398491110	328593215	/nfs/dbraw/zinc/59/32/15/328593215.db2.gz	IESAKAHGYABYGZ-CQSZACIVSA-N	0	0	256.393	4.330	20	30		CIEDRN
CCC(CC)[C@H](C)C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000535582732	328594810	/nfs/dbraw/zinc/59/48/10/328594810.db2.gz	LCLUTAKJJOOJED-ZDUSSCGKSA-N	0	0	286.419	4.499	20	30		CIEDRN
N#Cc1ccc(NC(=O)CCCC2CCCCC2)cc1	ZINC000028882990	328597952	/nfs/dbraw/zinc/59/79/52/328597952.db2.gz	MVUMGWYTTFFFEA-UHFFFAOYSA-N	0	0	270.376	4.247	20	30		CIEDRN
CCc1ccc([C@@H](C#N)NC(=O)C[C@@H](C)CC(C)C)cc1	ZINC000583959451	326814274	/nfs/dbraw/zinc/81/42/74/326814274.db2.gz	CWVPCKHNJRWMEW-WMLDXEAASA-N	0	0	286.419	4.002	20	30		CIEDRN
COc1cccc(CSCc2ccc(C#N)cc2F)c1	ZINC000519939601	326819930	/nfs/dbraw/zinc/81/99/30/326819930.db2.gz	AJPYRFOOXPJEAB-UHFFFAOYSA-N	0	0	287.359	4.139	20	30		CIEDRN
N#CCCCCN1CC2(CCCC2)c2c1cccc2F	ZINC000533496671	326842961	/nfs/dbraw/zinc/84/29/61/326842961.db2.gz	ATUAISKJFYRXNU-UHFFFAOYSA-N	0	0	272.367	4.151	20	30		CIEDRN
CC[C@@](C)(NCc1ccccc1C(C)(C)C#N)C(F)(F)F	ZINC000533526198	326851580	/nfs/dbraw/zinc/85/15/80/326851580.db2.gz	UZPGDBSPXBTGIC-OAHLLOKOSA-N	0	0	298.352	4.308	20	30		CIEDRN
C=C(C)CSCc1cc(-c2ccc(F)cc2)no1	ZINC000530871540	326894335	/nfs/dbraw/zinc/89/43/35/326894335.db2.gz	OQTJFKHXPVGTCS-UHFFFAOYSA-N	0	0	263.337	4.290	20	30		CIEDRN
COc1ccc(CNc2ccc(C#N)cc2)c2ccccc12	ZINC000317268513	326918555	/nfs/dbraw/zinc/91/85/55/326918555.db2.gz	SCHJACILYQFICU-UHFFFAOYSA-N	0	0	288.350	4.332	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cc3sccc3[nH]2)n1	ZINC000556363916	326923358	/nfs/dbraw/zinc/92/33/58/326923358.db2.gz	PHDIICJRPFKERD-UHFFFAOYSA-N	0	0	273.361	4.133	20	30		CIEDRN
C=CCC(CC=C)C(=O)NCCc1cc2ccccc2s1	ZINC000506535822	332774160	/nfs/dbraw/zinc/77/41/60/332774160.db2.gz	VFKKZPMZHRIHAV-UHFFFAOYSA-N	0	0	299.439	4.328	20	30		CIEDRN
CCCNc1ccc(C#N)cc1NC(=O)[C@H](C)[C@@H](C)CC	ZINC000506625242	332775451	/nfs/dbraw/zinc/77/54/51/332775451.db2.gz	IMNBRNJEJBQETD-QWHCGFSZSA-N	0	0	287.407	4.001	20	30		CIEDRN
C=CCCCCCNC(=O)c1c[nH]cc1-c1ccccc1	ZINC000568223759	326971657	/nfs/dbraw/zinc/97/16/57/326971657.db2.gz	UUJAUHVFDKNDFW-UHFFFAOYSA-N	0	0	282.387	4.158	20	30		CIEDRN
Cc1ccc(/C=C\CC(=O)Nc2ccc(CC#N)cc2)cc1	ZINC000255436905	326972550	/nfs/dbraw/zinc/97/25/50/326972550.db2.gz	QVPHKLCPPTWXDV-IHWYPQMZSA-N	0	0	290.366	4.103	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@@H]1CCC[C@H]2CCCC[C@@H]21	ZINC000557041789	326990500	/nfs/dbraw/zinc/99/05/00/326990500.db2.gz	HMADJOUHTDZMON-WCXIOVBPSA-N	0	0	275.436	4.160	20	30		CIEDRN
CCN(C(=O)c1cc(C(C)C)oc1C)c1ccc(C#N)cc1	ZINC000568320078	326992802	/nfs/dbraw/zinc/99/28/02/326992802.db2.gz	GJMCRURCUHEXOM-UHFFFAOYSA-N	0	0	296.370	4.250	20	30		CIEDRN
C=C(C)C(C)(C)c1nc(Cc2cc3ccccc3o2)no1	ZINC000564833373	326997682	/nfs/dbraw/zinc/99/76/82/326997682.db2.gz	YLTKDEXIZDOATF-UHFFFAOYSA-N	0	0	282.343	4.260	20	30		CIEDRN
N#Cc1ccc(/C=C\c2cccc(C(F)(F)F)c2)nc1	ZINC000255716533	327007220	/nfs/dbraw/zinc/00/72/20/327007220.db2.gz	NBZGMALLLCARFG-XQRVVYSFSA-N	0	0	274.245	4.142	20	30		CIEDRN
CCCc1ccccc1NC(=O)N1CCC(CCC#N)CC1	ZINC000584111772	327009046	/nfs/dbraw/zinc/00/90/46/327009046.db2.gz	UIZZNFNSGONNIL-UHFFFAOYSA-N	0	0	299.418	4.187	20	30		CIEDRN
C=C(C)CCc1noc([C@@H]2[C@@H](C)[C@@H]2c2ccccc2)n1	ZINC000557517263	327011109	/nfs/dbraw/zinc/01/11/09/327011109.db2.gz	JFNPBWAFDIROBY-APHBMKBZSA-N	0	0	268.360	4.095	20	30		CIEDRN
CC(C)[C@H](Nc1cc(C#N)ccn1)c1ccc(F)cc1F	ZINC000557607489	327015927	/nfs/dbraw/zinc/01/59/27/327015927.db2.gz	WKSVGTJRYLHWDO-INIZCTEOSA-N	0	0	287.313	4.041	20	30		CIEDRN
C[C@@H]1CC[C@H](Nc2nccc(C#N)c2Cl)c2ccccc21	ZINC000557639833	327018381	/nfs/dbraw/zinc/01/83/81/327018381.db2.gz	UFPYNZAFDVMOTM-ABAIWWIYSA-N	0	0	297.789	4.079	20	30		CIEDRN
C[C@H]1C[C@H](c2ccccc2)N(c2nccc(C#N)c2Cl)C1	ZINC000557763087	327025501	/nfs/dbraw/zinc/02/55/01/327025501.db2.gz	PMUNUCWQPBNLKP-SWLSCSKDSA-N	0	0	297.789	4.194	20	30		CIEDRN
Cc1cc(Oc2ccnc(C(C)C)n2)c(C)c(C)c1C#N	ZINC000557763569	327025537	/nfs/dbraw/zinc/02/55/37/327025537.db2.gz	ZZCZIINJUWPSRR-UHFFFAOYSA-N	0	0	281.359	4.189	20	30		CIEDRN
Cc1cc(Oc2cc(C)c(C#N)c(C)c2C)nc(C2CC2)n1	ZINC000557762535	327025787	/nfs/dbraw/zinc/02/57/87/327025787.db2.gz	KXSULBREKGVFKB-UHFFFAOYSA-N	0	0	293.370	4.252	20	30		CIEDRN
C[C@H]1C[C@H](c2ccccc2)N(c2ccc(Cl)c(C#N)n2)C1	ZINC000557764312	327025833	/nfs/dbraw/zinc/02/58/33/327025833.db2.gz	OHQPMOUKWPSNNZ-BLLLJJGKSA-N	0	0	297.789	4.194	20	30		CIEDRN
C[C@H](Cc1ccccc1)C(=O)Nc1ccc(Cl)c(C#N)c1	ZINC000557885698	327033873	/nfs/dbraw/zinc/03/38/73/327033873.db2.gz	INAXKZSYCIHRFU-GFCCVEGCSA-N	0	0	298.773	4.029	20	30		CIEDRN
C/C=C\c1ccc(NC(=O)c2ccc(C#N)cc2C)cc1	ZINC000557937733	327036401	/nfs/dbraw/zinc/03/64/01/327036401.db2.gz	OLCZHBHZPWOJGH-ARJAWSKDSA-N	0	0	276.339	4.152	20	30		CIEDRN
C=CCC[C@@H](C(=O)N[C@@H]1CCC1(C)C)c1ccccc1	ZINC000557977632	327038287	/nfs/dbraw/zinc/03/82/87/327038287.db2.gz	LMJGIKIOVBZELM-HZPDHXFCSA-N	0	0	271.404	4.041	20	30		CIEDRN
C[C@H]1C[C@H](CC(=O)NCC(C)(C)CCC#N)CC(C)(C)C1	ZINC000557999691	327039757	/nfs/dbraw/zinc/03/97/57/327039757.db2.gz	LCOMLKWDSGRMOE-LSDHHAIUSA-N	0	0	292.467	4.285	20	30		CIEDRN
CCc1cccc2c1OCC[C@@H]2Nc1cccc(F)c1C#N	ZINC000506752970	332778947	/nfs/dbraw/zinc/77/89/47/332778947.db2.gz	WORNKIPEYQIPEW-KRWDZBQOSA-N	0	0	296.345	4.195	20	30		CIEDRN
C=C(C)CN(CC)C(=O)CCSc1cccc(Cl)c1	ZINC000558025480	327045286	/nfs/dbraw/zinc/04/52/86/327045286.db2.gz	WNFQGEIQIKJELH-UHFFFAOYSA-N	0	0	297.851	4.247	20	30		CIEDRN
CC[C@@H](C)CCC(=O)N(CC)[C@H](C)c1ccc(C#N)cc1	ZINC000506756620	332779225	/nfs/dbraw/zinc/77/92/25/332779225.db2.gz	BRWDMWLMUYYLDM-HUUCEWRRSA-N	0	0	286.419	4.294	20	30		CIEDRN
CC(C)[C@@H]1C[C@H](Nc2cccc(C(F)F)c2C#N)CCO1	ZINC000584182918	327062108	/nfs/dbraw/zinc/06/21/08/327062108.db2.gz	PDZOLQVEXBQVDU-ABAIWWIYSA-N	0	0	294.345	4.111	20	30		CIEDRN
CC(C)(C)c1cc(NC(=O)C2CC(C)(C)C2)c(C#N)s1	ZINC000558156023	327076626	/nfs/dbraw/zinc/07/66/26/327076626.db2.gz	JZDFMTUZEIOXTA-UHFFFAOYSA-N	0	0	290.432	4.292	20	30		CIEDRN
N#Cc1ccc(NCCc2cccc(Cl)c2)c(F)c1	ZINC000506835122	332780703	/nfs/dbraw/zinc/78/07/03/332780703.db2.gz	CIXCQJMHBJSGFW-UHFFFAOYSA-N	0	0	274.726	4.005	20	30		CIEDRN
CC[C@H](c1ccccc1OC)N(C)Cc1ccccc1C#N	ZINC000558177334	327077318	/nfs/dbraw/zinc/07/73/18/327077318.db2.gz	UJJPFWZXRHXSBJ-GOSISDBHSA-N	0	0	294.398	4.150	20	30		CIEDRN
C[C@@H]1C[C@H](C(C)(C)C)CCN1C(=O)Nc1cccc(C#N)c1	ZINC000558227188	327079385	/nfs/dbraw/zinc/07/93/85/327079385.db2.gz	SPHZGGSQOKNWEB-UKRRQHHQSA-N	0	0	299.418	4.237	20	30		CIEDRN
C[C@@H]1C[C@@H](C(C)(C)C)CCN1C(=O)Nc1cccc(C#N)c1	ZINC000558227184	327079434	/nfs/dbraw/zinc/07/94/34/327079434.db2.gz	SPHZGGSQOKNWEB-HIFRSBDPSA-N	0	0	299.418	4.237	20	30		CIEDRN
CC[C@H](CC(=O)Nc1cc(C#N)c2ccccc2n1)C(C)C	ZINC000558248453	327081370	/nfs/dbraw/zinc/08/13/70/327081370.db2.gz	WGRANSXNXJZOBS-CYBMUJFWSA-N	0	0	295.386	4.117	20	30		CIEDRN
CC#CCCCc1nc(C(C)(C)C2=CCCCC2)no1	ZINC000558381047	327089438	/nfs/dbraw/zinc/08/94/38/327089438.db2.gz	VMUXCKUYORFUGB-UHFFFAOYSA-N	0	0	272.392	4.194	20	30		CIEDRN
CC(C)(C)CN(C/C=C\c1ccc(F)c(F)c1)CCC#N	ZINC000558400285	327090567	/nfs/dbraw/zinc/09/05/67/327090567.db2.gz	JMYSFDSRJKHARV-XQRVVYSFSA-N	0	0	292.373	4.240	20	30		CIEDRN
COc1cc(F)c(F)cc1N[C@@H](C)c1cccc(C#N)c1	ZINC000558509393	327099740	/nfs/dbraw/zinc/09/97/40/327099740.db2.gz	OXDZKEJNMXTJPB-JTQLQIEISA-N	0	0	288.297	4.018	20	30		CIEDRN
C=CCCCCNC(=O)N[C@H]1CCc2sc(Cl)cc21	ZINC000558606688	327108537	/nfs/dbraw/zinc/10/85/37/327108537.db2.gz	QPFPAXALUUGBCT-NSHDSACASA-N	0	0	298.839	4.044	20	30		CIEDRN
N#CCCCC(=O)Nc1ccc2oc3ccccc3c2c1	ZINC000564637706	327118347	/nfs/dbraw/zinc/11/83/47/327118347.db2.gz	IQBBOLMPGKTLJC-UHFFFAOYSA-N	0	0	278.311	4.218	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H]1CCC[C@@H](c2ccccc2)C1	ZINC000506993875	332783177	/nfs/dbraw/zinc/78/31/77/332783177.db2.gz	AWPKSHSSZWKPKN-SJORKVTESA-N	0	0	285.431	4.431	20	30		CIEDRN
COCc1ccc(CSc2ccc(C#N)cc2F)cc1	ZINC000558844424	327124716	/nfs/dbraw/zinc/12/47/16/327124716.db2.gz	CKXNGCOGYADOPK-UHFFFAOYSA-N	0	0	287.359	4.136	20	30		CIEDRN
C=CCCn1c(COc2ccccc2)nc2ccccc21	ZINC000559152973	327143669	/nfs/dbraw/zinc/14/36/69/327143669.db2.gz	UZXMSBVRQNKSIV-UHFFFAOYSA-N	0	0	278.355	4.191	20	30		CIEDRN
COc1ccccc1[C@H](C)Sc1snc(C)c1C#N	ZINC000569381500	327170086	/nfs/dbraw/zinc/17/00/86/327170086.db2.gz	IDWQMCFOGWGSFB-JTQLQIEISA-N	0	0	290.413	4.185	20	30		CIEDRN
N#Cc1c(NC(=O)CC2CC2)sc2c1CCCCCC2	ZINC000408166352	327175544	/nfs/dbraw/zinc/17/55/44/327175544.db2.gz	XZAPNXMTBORPEE-UHFFFAOYSA-N	0	0	288.416	4.017	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)C[C@@H](C)c1ccc(CC)cc1	ZINC000410129834	327180065	/nfs/dbraw/zinc/18/00/65/327180065.db2.gz	HGRJRJSNHRLHFK-PBHICJAKSA-N	0	0	273.420	4.214	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@H]1C[C@@H]1c1c(F)cccc1Cl	ZINC000410130703	327180166	/nfs/dbraw/zinc/18/01/66/327180166.db2.gz	NHEYJEDZSRLHLY-SRVKXCTJSA-N	0	0	295.785	4.054	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1	ZINC000410130510	327180170	/nfs/dbraw/zinc/18/01/70/327180170.db2.gz	MOPGUBIDWJSJIM-GBESFXJTSA-N	0	0	293.410	4.414	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)[C@H](C)CSc1ccc(F)cc1	ZINC000410131342	327180220	/nfs/dbraw/zinc/18/02/20/327180220.db2.gz	QZMPDXXMRUROLX-TZMCWYRMSA-N	0	0	295.423	4.025	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1cccc(N(C)C)c1	ZINC000410355499	327187333	/nfs/dbraw/zinc/18/73/33/327187333.db2.gz	UHVOFLVYSIXPLZ-UHFFFAOYSA-N	0	0	294.398	4.124	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)C[C@@H](OCC)C(=C)C	ZINC000410344907	327187457	/nfs/dbraw/zinc/18/74/57/327187457.db2.gz	NFYNBDPJUXBIMB-QGZVFWFLSA-N	0	0	287.403	4.115	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)CC[C@H]1CC[C@@H](C)O1	ZINC000410388713	327190724	/nfs/dbraw/zinc/19/07/24/327190724.db2.gz	ZKLXNFZFTPYXFN-GDBMZVCRSA-N	0	0	287.403	4.091	20	30		CIEDRN
N#Cc1ccc(CNc2ccc(Cl)c(OC(F)F)c2)o1	ZINC000181167616	327207585	/nfs/dbraw/zinc/20/75/85/327207585.db2.gz	OCIFLDGYVZMNBU-UHFFFAOYSA-N	0	0	298.676	4.018	20	30		CIEDRN
C=C(C)CN(C)C(=O)Nc1ccc2c(ccn2CCC)c1	ZINC000181700204	327212714	/nfs/dbraw/zinc/21/27/14/327212714.db2.gz	CRETYNQXJMFQRX-UHFFFAOYSA-N	0	0	285.391	4.091	20	30		CIEDRN
C=CCCCC(=O)N(CC)c1ccc(C(F)(F)F)cc1	ZINC000512514108	332971594	/nfs/dbraw/zinc/97/15/94/332971594.db2.gz	ISURCWAFAFXCTR-UHFFFAOYSA-N	0	0	285.309	4.415	20	30		CIEDRN
C=CCC[C@@H](CCC)Nc1cccc(C(=O)N(C)CC)c1	ZINC000584295213	327225638	/nfs/dbraw/zinc/22/56/38/327225638.db2.gz	VRRPUNWVIQOYGF-MRXNPFEDSA-N	0	0	288.435	4.325	20	30		CIEDRN
CCCC[C@H](CC)CC(=O)N[C@](C)(C#N)CC(C)C	ZINC000533878028	327231205	/nfs/dbraw/zinc/23/12/05/327231205.db2.gz	UOYKNHZQNCZHIA-HOCLYGCPSA-N	0	0	266.429	4.037	20	30		CIEDRN
C=CCC(C)(C)C(=O)N(Cc1ccc(F)cc1)CC1CC1	ZINC000584305947	327233644	/nfs/dbraw/zinc/23/36/44/327233644.db2.gz	KYQFTWVLFRDZMQ-UHFFFAOYSA-N	0	0	289.394	4.167	20	30		CIEDRN
CC[C@@H](Cc1ccccc1)C(=O)Nc1cc(C#N)ccc1C	ZINC000531082418	327241092	/nfs/dbraw/zinc/24/10/92/327241092.db2.gz	XEHASEXFZFNOLG-KRWDZBQOSA-N	0	0	292.382	4.074	20	30		CIEDRN
Cc1coc(-c2cc(N[C@H]3CC[C@H](C#N)C3)ccc2C)n1	ZINC000555951445	327250304	/nfs/dbraw/zinc/25/03/04/327250304.db2.gz	TYVGFBOFAUZLIG-KBPBESRZSA-N	0	0	281.359	4.063	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc([C@H](OCC)c2ccccc2)no1	ZINC000573763936	327256104	/nfs/dbraw/zinc/25/61/04/327256104.db2.gz	UJWJRLBFJFJAPJ-DZGCQCFKSA-N	0	0	286.375	4.265	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cccc(-c2ncc(C)o2)c1	ZINC000559681680	327257796	/nfs/dbraw/zinc/25/77/96/327257796.db2.gz	QDHADRLDIKEGQF-UHFFFAOYSA-N	0	0	284.359	4.191	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc(OCC2CC2)cc1	ZINC000559803884	327262741	/nfs/dbraw/zinc/26/27/41/327262741.db2.gz	YXLYHNSVRSVPMD-UHFFFAOYSA-N	0	0	273.376	4.016	20	30		CIEDRN
CC(C)(C)[C@@H]1CCCC[C@H]1NC(=O)c1ccc(CC#N)cc1	ZINC000533888782	327266716	/nfs/dbraw/zinc/26/67/16/327266716.db2.gz	JKVUQULFEQPYCL-IAGOWNOFSA-N	0	0	298.430	4.087	20	30		CIEDRN
C=CC[C@H](C)[C@@H](C)Nc1ccc([C@@H]2CCOC2)cc1	ZINC000559896844	327269331	/nfs/dbraw/zinc/26/93/31/327269331.db2.gz	BNNRWGHYSDKTOC-SQWLQELKSA-N	0	0	259.393	4.203	20	30		CIEDRN
N#Cc1cccc(COc2cnc3ccc(Cl)cc3c2)c1	ZINC000559946707	327273203	/nfs/dbraw/zinc/27/32/03/327273203.db2.gz	MJNDNUBBAYNZBY-UHFFFAOYSA-N	0	0	294.741	4.339	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H]1C[C@H]1c1c(F)cccc1Cl	ZINC000559963560	327274355	/nfs/dbraw/zinc/27/43/55/327274355.db2.gz	OOUBCSRNNDDFDS-MFKMUULPSA-N	0	0	295.785	4.054	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc(OC(C)(C)C)cc1	ZINC000559978630	327274937	/nfs/dbraw/zinc/27/49/37/327274937.db2.gz	CEJUQMPNRVCENO-UHFFFAOYSA-N	0	0	275.392	4.405	20	30		CIEDRN
C=CCC(C)(C)c1noc(Cc2ccc(Cl)s2)n1	ZINC000560023141	327277966	/nfs/dbraw/zinc/27/79/66/327277966.db2.gz	CUGDKTBPDREFKC-UHFFFAOYSA-N	0	0	282.796	4.229	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H]2CCc3ccc(OC)cc32)n1	ZINC000560023451	327278219	/nfs/dbraw/zinc/27/82/19/327278219.db2.gz	CJUVCYIDLFUASE-CQSZACIVSA-N	0	0	298.386	4.010	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H](c2cccnc2)C(C)C)n1	ZINC000560025462	327278335	/nfs/dbraw/zinc/27/83/35/327278335.db2.gz	ANUSLJLLFGOENC-CQSZACIVSA-N	0	0	285.391	4.106	20	30		CIEDRN
C=CCC(C)(C)c1noc(/C=C/c2cccc(OC)c2)n1	ZINC000560027840	327278516	/nfs/dbraw/zinc/27/85/16/327278516.db2.gz	MMMGOAYLCOEGSC-MDZDMXLPSA-N	0	0	284.359	4.102	20	30		CIEDRN
N#C[C@@H](NC(=O)c1cc2ccccc2s1)C1CCCCC1	ZINC000048855589	327280264	/nfs/dbraw/zinc/28/02/64/327280264.db2.gz	BWEWRILJYDCPHP-CQSZACIVSA-N	0	0	298.411	4.104	20	30		CIEDRN
C=CCC1(c2nc(Cc3cc4ccccc4o3)no2)CCC1	ZINC000560047604	327280549	/nfs/dbraw/zinc/28/05/49/327280549.db2.gz	NPRKTPFBLCFWAV-UHFFFAOYSA-N	0	0	294.354	4.404	20	30		CIEDRN
C[C@H](C(=O)Nc1ccc(CC#N)cc1)c1cccc(Cl)c1	ZINC000525623835	327282924	/nfs/dbraw/zinc/28/29/24/327282924.db2.gz	GGCDKDRMEUJOTF-LBPRGKRZSA-N	0	0	298.773	4.148	20	30		CIEDRN
C=CC[C@H]1N(C(=O)[C@@H]2CC=CC[C@H]2C)CCCC1(C)C	ZINC000560120203	327285357	/nfs/dbraw/zinc/28/53/57/327285357.db2.gz	IPNWMQVZNKBHAM-BZUAXINKSA-N	0	0	275.436	4.182	20	30		CIEDRN
N#Cc1c(NC[C@H]2CCCCS2)cccc1C(F)F	ZINC000578083494	327299279	/nfs/dbraw/zinc/29/92/79/327299279.db2.gz	ZYVVEZVRRCJTIP-SNVBAGLBSA-N	0	0	282.359	4.193	20	30		CIEDRN
CCCCCCCC(=O)N(CC)[C@H](C)c1cccnc1	ZINC000115224893	327299538	/nfs/dbraw/zinc/29/95/38/327299538.db2.gz	VBOPROFQROMFFH-OAHLLOKOSA-N	0	0	276.424	4.352	20	30		CIEDRN
Cc1ccc(F)c(NCc2ccc(Cl)cc2C#N)c1	ZINC000560434040	327307403	/nfs/dbraw/zinc/30/74/03/327307403.db2.gz	MHVKYNUXVUOTAP-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
C=C(C)CCc1noc(-c2oc3ccc(OC)cc3c2C)n1	ZINC000560457259	327309467	/nfs/dbraw/zinc/30/94/67/327309467.db2.gz	DTRPNMKHTMNTJB-UHFFFAOYSA-N	0	0	298.342	4.309	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)N1CC(CC)(CC)c2ccccc21	ZINC000560606708	327329788	/nfs/dbraw/zinc/32/97/88/327329788.db2.gz	YXOQKDUDAJRZOY-KRWDZBQOSA-N	0	0	284.403	4.031	20	30		CIEDRN
CCc1ccc(NC(=O)c2ccc(CC#N)cc2)cc1Cl	ZINC000560775450	327342202	/nfs/dbraw/zinc/34/22/02/327342202.db2.gz	NORYZZRMRBLHKF-UHFFFAOYSA-N	0	0	298.773	4.221	20	30		CIEDRN
N#Cc1cc(F)ccc1CSCc1ccc(Cl)cn1	ZINC000583399432	327343960	/nfs/dbraw/zinc/34/39/60/327343960.db2.gz	PAXXQGDULMBVRM-UHFFFAOYSA-N	0	0	292.766	4.179	20	30		CIEDRN
CCOc1ccc(C#N)cc1NCc1ccc(Cl)cc1	ZINC000560854161	327348278	/nfs/dbraw/zinc/34/82/78/327348278.db2.gz	BONKIRSBROEHKF-UHFFFAOYSA-N	0	0	286.762	4.222	20	30		CIEDRN
C=CCC1(C(=O)N(C)Cc2cccc(C)c2C)CCC1	ZINC000560955947	327353952	/nfs/dbraw/zinc/35/39/52/327353952.db2.gz	GSSPFRGXTGXSNM-UHFFFAOYSA-N	0	0	271.404	4.008	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1cc2cccc(C)c2s1	ZINC000574601585	327354049	/nfs/dbraw/zinc/35/40/49/327354049.db2.gz	FCCJHHGBSIEWQP-CQSZACIVSA-N	0	0	285.412	4.390	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)CCCCC(C)(C)C	ZINC000561100251	327366320	/nfs/dbraw/zinc/36/63/20/327366320.db2.gz	NWNOHNYBUORVKK-UHFFFAOYSA-N	0	0	272.392	4.412	20	30		CIEDRN
CC[C@H](CC(=O)Nc1cc(C#N)cn1C(C)(C)C)C(C)C	ZINC000561112820	327367453	/nfs/dbraw/zinc/36/74/53/327367453.db2.gz	LCCCOHHCHFMXGZ-CQSZACIVSA-N	0	0	289.423	4.126	20	30		CIEDRN
C=CCCc1ccccc1N[C@H]1C[C@@H](C)O[C@@H](C)C1	ZINC000564705188	327371274	/nfs/dbraw/zinc/37/12/74/327371274.db2.gz	QDCLEWOKUGIHEL-FOLVSLTJSA-N	0	0	259.393	4.173	20	30		CIEDRN
CCc1cc(NCc2cccc(F)c2C#N)ccc1F	ZINC000427424793	327374709	/nfs/dbraw/zinc/37/47/09/327374709.db2.gz	QGPSOEHEWILZHM-UHFFFAOYSA-N	0	0	272.298	4.011	20	30		CIEDRN
Cc1ccccc1-c1nnc(SCCC(C)(C)C#N)o1	ZINC000123677196	327377521	/nfs/dbraw/zinc/37/75/21/327377521.db2.gz	NUZGRAUWLRWLMX-UHFFFAOYSA-N	0	0	287.388	4.077	20	30		CIEDRN
C=CCN(C(=O)c1coc2ccc(C(C)C)cc21)C1CC1	ZINC000561245425	327378525	/nfs/dbraw/zinc/37/85/25/327378525.db2.gz	ZJOQEXGHTMLKKM-UHFFFAOYSA-N	0	0	283.371	4.347	20	30		CIEDRN
C=CCN(C(=O)CCC1CCCC1)c1ccccc1	ZINC000561266510	327381530	/nfs/dbraw/zinc/38/15/30/327381530.db2.gz	RBQCTEJUKPXYBK-UHFFFAOYSA-N	0	0	257.377	4.176	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)CCCCC(C)(C)C	ZINC000561306569	327384516	/nfs/dbraw/zinc/38/45/16/327384516.db2.gz	DFVHOLPMPUNNPF-CQSZACIVSA-N	0	0	251.414	4.160	20	30		CIEDRN
C=CCC(CC=C)C(=O)NC1(c2cccc(Cl)c2)CC1	ZINC000150833699	327386706	/nfs/dbraw/zinc/38/67/06/327386706.db2.gz	CLDZFESMNZHEGG-UHFFFAOYSA-N	0	0	289.806	4.214	20	30		CIEDRN
Cc1nsc(N2CCc3c(cccc3C(C)C)C2)c1C#N	ZINC000561341621	327388119	/nfs/dbraw/zinc/38/81/19/327388119.db2.gz	YLDHPRNGDZFZOY-UHFFFAOYSA-N	0	0	297.427	4.009	20	30		CIEDRN
Cc1cc2cc(CNc3c(F)cc(C#N)cc3F)ccc2[nH]1	ZINC000561435787	327394838	/nfs/dbraw/zinc/39/48/38/327394838.db2.gz	YWCYDFYTIFCLOG-UHFFFAOYSA-N	0	0	297.308	4.238	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc(/C=C/C)cc1	ZINC000561658253	327408253	/nfs/dbraw/zinc/40/82/53/327408253.db2.gz	UKSZYLDNZAVYJO-QPJJXVBHSA-N	0	0	255.361	4.427	20	30		CIEDRN
C=C[C@](C)(CCOC)c1nc(CCC2CCCCC2)no1	ZINC000561877754	327427974	/nfs/dbraw/zinc/42/79/74/327427974.db2.gz	KLVJDOXYLVJGHG-QGZVFWFLSA-N	0	0	292.423	4.063	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(C2(c3cccc(OC)c3)CC2)no1	ZINC000561943086	327432183	/nfs/dbraw/zinc/43/21/83/327432183.db2.gz	GHPMQMZXAIHPNV-KRWDZBQOSA-N	0	0	298.386	4.012	20	30		CIEDRN
CC(C)(C#N)CC(=O)NCc1ccc(C2CCCCC2)cc1	ZINC000562048686	327442543	/nfs/dbraw/zinc/44/25/43/327442543.db2.gz	JBNKVHRUXJMPGX-UHFFFAOYSA-N	0	0	298.430	4.290	20	30		CIEDRN
N#Cc1cc(N[C@@H](CC2CCCC2)c2ccccc2)ncn1	ZINC000562419936	327480196	/nfs/dbraw/zinc/48/01/96/327480196.db2.gz	KOVXPLLDOMJKNR-KRWDZBQOSA-N	0	0	292.386	4.082	20	30		CIEDRN
CC(C)CC(C)(C)C(=O)N[C@@H](C#N)c1ccc(Cl)cc1	ZINC000159390933	327499319	/nfs/dbraw/zinc/49/93/19/327499319.db2.gz	FHHCZUHNUHGYBU-AWEZNQCLSA-N	0	0	292.810	4.093	20	30		CIEDRN
C=CCCCNC(=O)Nc1ccc2oc(C(C)C)nc2c1	ZINC000562625412	327500729	/nfs/dbraw/zinc/50/07/29/327500729.db2.gz	SQAKRTPIIFVZPK-UHFFFAOYSA-N	0	0	287.363	4.039	20	30		CIEDRN
C=CCCCCNc1cc(NC(=O)C2CC2)ccc1C	ZINC000562772256	327513683	/nfs/dbraw/zinc/51/36/83/327513683.db2.gz	LUWADJCJTHWRGX-UHFFFAOYSA-N	0	0	272.392	4.112	20	30		CIEDRN
COc1ccc(C#N)cc1CNc1cccc(C(F)F)c1	ZINC000151919653	327525179	/nfs/dbraw/zinc/52/51/79/327525179.db2.gz	CAQQEEYGARQXOJ-UHFFFAOYSA-N	0	0	288.297	4.117	20	30		CIEDRN
C=CCCSCc1coc(-c2ccc(OC)cc2)n1	ZINC000151947213	327529727	/nfs/dbraw/zinc/52/97/27/327529727.db2.gz	NZBVGCKAHMFLSR-UHFFFAOYSA-N	0	0	275.373	4.160	20	30		CIEDRN
N#CCCN(Cc1ccco1)Cc1cc2ccccc2s1	ZINC000159565634	327536422	/nfs/dbraw/zinc/53/64/22/327536422.db2.gz	XTLWHWMFIZEOCA-UHFFFAOYSA-N	0	0	296.395	4.410	20	30		CIEDRN
CSC[C@@H]1CCCN(c2cccc(C(F)F)c2C#N)C1	ZINC000569825725	327550507	/nfs/dbraw/zinc/55/05/07/327550507.db2.gz	VCOXGGKIZVTCCJ-LLVKDONJSA-N	0	0	296.386	4.075	20	30		CIEDRN
N#C[C@H](Nc1ccccc1OCC1CC1)C1CCCCC1	ZINC000569893335	327554184	/nfs/dbraw/zinc/55/41/84/327554184.db2.gz	YGDFMCXBNYFQOY-KRWDZBQOSA-N	0	0	284.403	4.360	20	30		CIEDRN
Cc1cccc(C)c1[C@H](C)Nc1ccc(C#N)c([N+](=O)[O-])c1	ZINC000570015173	327562200	/nfs/dbraw/zinc/56/22/00/327562200.db2.gz	YLRVQSWXXGZVTD-ZDUSSCGKSA-N	0	0	295.342	4.256	20	30		CIEDRN
Cc1cccc(C)c1[C@@H](C)Nc1ccc(C#N)c([N+](=O)[O-])c1	ZINC000570015172	327562227	/nfs/dbraw/zinc/56/22/27/327562227.db2.gz	YLRVQSWXXGZVTD-CYBMUJFWSA-N	0	0	295.342	4.256	20	30		CIEDRN
Cc1ccsc1-c1noc(/C=C/c2cccc(C#N)c2)n1	ZINC000570090525	327568425	/nfs/dbraw/zinc/56/84/25/327568425.db2.gz	MSDZGEYMOWIXEZ-AATRIKPKSA-N	0	0	293.351	4.149	20	30		CIEDRN
CC(C)C[C@](C)(C#N)NC(=O)c1cc(F)c2ccccc2c1	ZINC000570532701	327598063	/nfs/dbraw/zinc/59/80/63/327598063.db2.gz	YFMFIAXLKHRORZ-GOSISDBHSA-N	0	0	298.361	4.037	20	30		CIEDRN
CC[C@H](CC#N)NC(=O)c1cc(C)c(-c2ccccc2)s1	ZINC000570697010	327611776	/nfs/dbraw/zinc/61/17/76/327611776.db2.gz	UJKFRSVCQKVBKE-CQSZACIVSA-N	0	0	298.411	4.146	20	30		CIEDRN
C=CCCC(=O)N[C@H]1CCCc2ccc(C(C)C)cc21	ZINC000535673566	328608710	/nfs/dbraw/zinc/60/87/10/328608710.db2.gz	AXRLPBLCWJSDET-KRWDZBQOSA-N	0	0	271.404	4.270	20	30		CIEDRN
N#Cc1cc(NCc2cccc3ccccc32)ccc1F	ZINC000051635023	328626233	/nfs/dbraw/zinc/62/62/33/328626233.db2.gz	SYIWYBCEZBNCJQ-UHFFFAOYSA-N	0	0	276.314	4.463	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)Nc1ccc(C(C)C)cc1)OCC	ZINC000535882574	328645501	/nfs/dbraw/zinc/64/55/01/328645501.db2.gz	JWPHVVNMXBHXNS-MRXNPFEDSA-N	0	0	275.392	4.120	20	30		CIEDRN
Cc1ccccc1-c1cnc(COc2ccc(C#N)cc2)o1	ZINC000536019747	328652863	/nfs/dbraw/zinc/65/28/63/328652863.db2.gz	VDRNFYZCXMRVGE-UHFFFAOYSA-N	0	0	290.322	4.101	20	30		CIEDRN
C=CCSc1ccccc1C(=O)NC[C@H]1CCC[C@@H]1C	ZINC000536093489	328656318	/nfs/dbraw/zinc/65/63/18/328656318.db2.gz	SRBSQUIMQSPXRK-UONOGXRCSA-N	0	0	289.444	4.131	20	30		CIEDRN
N#CCc1ccc(CNc2c(F)cccc2Cl)cc1	ZINC000399128419	328665921	/nfs/dbraw/zinc/66/59/21/328665921.db2.gz	UXMDWONMCTXJNK-UHFFFAOYSA-N	0	0	274.726	4.157	20	30		CIEDRN
N#CCc1ccc(COc2cc(F)ccc2Cl)cc1	ZINC000399136605	328667656	/nfs/dbraw/zinc/66/76/56/328667656.db2.gz	RFYRZYPSDNOIFZ-UHFFFAOYSA-N	0	0	275.710	4.124	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@@H](C)c1cc2ccccc2o1	ZINC000053986195	328674406	/nfs/dbraw/zinc/67/44/06/328674406.db2.gz	MUTWGZRUCQNNMK-ZDUSSCGKSA-N	0	0	286.375	4.101	20	30		CIEDRN
Cc1ccc(C)c(OCCCOc2cccc(C#N)c2)c1	ZINC000034652300	328684328	/nfs/dbraw/zinc/68/43/28/328684328.db2.gz	UTWZSVLYUNYYOE-UHFFFAOYSA-N	0	0	281.355	4.023	20	30		CIEDRN
CC(C)(C)c1cnc(COc2cc(Cl)ccc2C#N)o1	ZINC000532140999	328700463	/nfs/dbraw/zinc/70/04/63/328700463.db2.gz	ZWEJBLGKESBGMY-UHFFFAOYSA-N	0	0	290.750	4.076	20	30		CIEDRN
C=CCCC(=O)N(CCc1ccc(F)cc1)C1CCCC1	ZINC000532305697	328714785	/nfs/dbraw/zinc/71/47/85/328714785.db2.gz	OUVJMWQBNVKMPM-UHFFFAOYSA-N	0	0	289.394	4.106	20	30		CIEDRN
CC[C@@H](C#N)c1ccc(-c2cnc(C3CC3)o2)cc1	ZINC000530251451	328718736	/nfs/dbraw/zinc/71/87/36/328718736.db2.gz	RIJOBXZHJCXCLZ-NSHDSACASA-N	0	0	252.317	4.236	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)c1cccc2ccsc21	ZINC000395435972	328737728	/nfs/dbraw/zinc/73/77/28/328737728.db2.gz	RUMVHYZYYSOOLV-UHFFFAOYSA-N	0	0	292.363	4.334	20	30		CIEDRN
N#Cc1ccc(NC(=O)c2ccc3sccc3c2)cc1	ZINC000395511771	328740030	/nfs/dbraw/zinc/74/00/30/328740030.db2.gz	WZRUOCWYDHTCMQ-UHFFFAOYSA-N	0	0	278.336	4.025	20	30		CIEDRN
Cc1ccc(C#N)c(Oc2ccc(Cl)cc2Cl)n1	ZINC000043400274	328790077	/nfs/dbraw/zinc/79/00/77/328790077.db2.gz	CYWYQPPJWKGIHD-UHFFFAOYSA-N	0	0	279.126	4.361	20	30		CIEDRN
C[C@@H]1CCCC[C@@H]1Nc1c(C#N)cnc2ccccc21	ZINC000037507639	328806014	/nfs/dbraw/zinc/80/60/14/328806014.db2.gz	DIUJTQWDJCBFQL-DOMZBBRYSA-N	0	0	265.360	4.097	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)C[C@H]1CCCC[C@H]1C	ZINC000527061171	328823300	/nfs/dbraw/zinc/82/33/00/328823300.db2.gz	ZHVZZGKDBVQDIO-HUUCEWRRSA-N	0	0	278.440	4.134	20	30		CIEDRN
N#Cc1ccc(N[C@H](c2ccc(F)cc2)C2CCCC2)nc1	ZINC000301153662	328827038	/nfs/dbraw/zinc/82/70/38/328827038.db2.gz	LUOXUVJOORRCNZ-SFHVURJKSA-N	0	0	295.361	4.436	20	30		CIEDRN
CC(C)C(=O)Nc1ccc(Oc2cccc(F)c2C#N)cc1	ZINC000301167667	328827285	/nfs/dbraw/zinc/82/72/85/328827285.db2.gz	DFWHBAWMUQEJSP-UHFFFAOYSA-N	0	0	298.317	4.084	20	30		CIEDRN
Cc1ccc(CN(C)c2c(C#N)cnc3ccccc32)s1	ZINC000301397285	328827713	/nfs/dbraw/zinc/82/77/13/328827713.db2.gz	GXNHMPMPNKXTQW-UHFFFAOYSA-N	0	0	293.395	4.113	20	30		CIEDRN
C=CCN1C(=O)c2ccccc2NC12CCC(CC)CC2	ZINC000514647203	328843330	/nfs/dbraw/zinc/84/33/30/328843330.db2.gz	KCSJMYAQWSQCTI-UHFFFAOYSA-N	0	0	284.403	4.037	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(OC(C)C)cc2C)CCC1	ZINC000583677140	328852286	/nfs/dbraw/zinc/85/22/86/328852286.db2.gz	FWJRPBAZCOLCEA-UHFFFAOYSA-N	0	0	287.403	4.467	20	30		CIEDRN
C=CCC[C@H](Nc1ccc(NC(C)=O)cc1)c1ccco1	ZINC000353652878	328855332	/nfs/dbraw/zinc/85/53/32/328855332.db2.gz	JJDCRYDIWIJZNV-INIZCTEOSA-N	0	0	284.359	4.357	20	30		CIEDRN
C=C(C)CCSCC(=O)N1c2ccccc2CC[C@@H]1C	ZINC000507818862	332826202	/nfs/dbraw/zinc/82/62/02/332826202.db2.gz	KRHBDNHBBNVVEI-AWEZNQCLSA-N	0	0	289.444	4.054	20	30		CIEDRN
C=C(C)CCSCCC(=O)NCc1ccccc1Cl	ZINC000507819639	332826224	/nfs/dbraw/zinc/82/62/24/332826224.db2.gz	VSNDRSATFAPLRK-UHFFFAOYSA-N	0	0	297.851	4.046	20	30		CIEDRN
N#Cc1ccc(Cl)cc1OCCCCC(F)(F)F	ZINC000507830158	332826643	/nfs/dbraw/zinc/82/66/43/332826643.db2.gz	LAXMUPBKGNRYFN-UHFFFAOYSA-N	0	0	277.673	4.323	20	30		CIEDRN
C=C(C)CCS[C@H](C)C(=O)N(C)Cc1ccccc1C	ZINC000507825572	332826677	/nfs/dbraw/zinc/82/66/77/332826677.db2.gz	SYOFELNXFBOHPU-OAHLLOKOSA-N	0	0	291.460	4.041	20	30		CIEDRN
Cc1oc2ccc(NC(=O)c3cccc(C#N)c3)cc2c1C	ZINC000357852890	328877178	/nfs/dbraw/zinc/87/71/78/328877178.db2.gz	PPKBXECTJPKBRE-UHFFFAOYSA-N	0	0	290.322	4.174	20	30		CIEDRN
N#Cc1cc(F)ccc1CSCc1ncc(Cl)s1	ZINC000358652160	328889325	/nfs/dbraw/zinc/88/93/25/328889325.db2.gz	NKGWZBNUENCQGD-UHFFFAOYSA-N	0	0	298.795	4.241	20	30		CIEDRN
C=C(C)CCS[C@@H](C)C(=O)Nc1ccc(C)cc1F	ZINC000507859061	332828169	/nfs/dbraw/zinc/82/81/69/332828169.db2.gz	JUDPWCCLNXNUSZ-LBPRGKRZSA-N	0	0	281.396	4.161	20	30		CIEDRN
Cc1ccc(CSc2ccc(C#N)cc2F)c(C)n1	ZINC000358778700	328894700	/nfs/dbraw/zinc/89/47/00/328894700.db2.gz	IJDOQRJMTOPGFA-UHFFFAOYSA-N	0	0	272.348	4.002	20	30		CIEDRN
C=C[C@H](CC(=O)N1C[C@H]2CCCCC[C@H]21)c1ccccc1	ZINC000372587358	328966161	/nfs/dbraw/zinc/96/61/61/328966161.db2.gz	MOCDCKHGHNISNV-KBAYOESNSA-N	0	0	283.415	4.137	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1Cc2ccccc2C2(CCC2)C1	ZINC000375992965	329006170	/nfs/dbraw/zinc/00/61/70/329006170.db2.gz	OMJWFCUHNWAYJK-OAHLLOKOSA-N	0	0	283.415	4.053	20	30		CIEDRN
C#Cc1ccc(CN[C@@H](c2ccco2)c2ccccc2)cc1	ZINC000377613737	329020267	/nfs/dbraw/zinc/02/02/67/329020267.db2.gz	FNYNOWDVVAZZPQ-HXUWFJFHSA-N	0	0	287.362	4.140	20	30		CIEDRN
C#Cc1ccc(CN[C@H](c2ccco2)c2ccccc2)cc1	ZINC000377613734	329020330	/nfs/dbraw/zinc/02/03/30/329020330.db2.gz	FNYNOWDVVAZZPQ-FQEVSTJZSA-N	0	0	287.362	4.140	20	30		CIEDRN
CC(C)(C)c1ccc(C(=O)NCC2CCC(C#N)CC2)cc1	ZINC000508360833	332837615	/nfs/dbraw/zinc/83/76/15/332837615.db2.gz	JVGGQOPBGHHEEX-UHFFFAOYSA-N	0	0	298.430	4.044	20	30		CIEDRN
C[C@H](Nc1cccc2c1OCCC2)c1ccc(C#N)cc1	ZINC000378132637	329041025	/nfs/dbraw/zinc/04/10/25/329041025.db2.gz	IUKPFWBFIUGOFV-ZDUSSCGKSA-N	0	0	278.355	4.056	20	30		CIEDRN
CC(C)CN(C(=O)CC(C)(C)C#N)c1ccc(Cl)cc1	ZINC000486312918	329061036	/nfs/dbraw/zinc/06/10/36/329061036.db2.gz	AUZFACUSNJJTAW-UHFFFAOYSA-N	0	0	292.810	4.269	20	30		CIEDRN
N#CCCCOc1cccc(N[C@@H]2CCc3ccccc32)c1	ZINC000193905458	329061793	/nfs/dbraw/zinc/06/17/93/329061793.db2.gz	GBZGENSDIFRBNO-LJQANCHMSA-N	0	0	292.382	4.469	20	30		CIEDRN
CCc1nc2cc(N[C@@H](C)c3cccc(C#N)c3)ccc2o1	ZINC000193928558	329063627	/nfs/dbraw/zinc/06/36/27/329063627.db2.gz	ZJNKETFOPJOMRF-LBPRGKRZSA-N	0	0	291.354	4.435	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)C2CCCCCC2)cc1	ZINC000171027386	329074366	/nfs/dbraw/zinc/07/43/66/329074366.db2.gz	PZKUWTJYWATDRM-UHFFFAOYSA-N	0	0	284.403	4.397	20	30		CIEDRN
COc1ccc([C@H](Nc2nccc(C)c2C#N)C(C)C)cc1	ZINC000582568609	329109449	/nfs/dbraw/zinc/10/94/49/329109449.db2.gz	BKFSUMXEUTYBHD-QGZVFWFLSA-N	0	0	295.386	4.080	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CC[C@@H]1c1ccc(Cl)cc1	ZINC000582684083	329128173	/nfs/dbraw/zinc/12/81/73/329128173.db2.gz	SOEWNHPLUKBXEC-LSDHHAIUSA-N	0	0	292.810	4.151	20	30		CIEDRN
C=C(C)CCc1noc(-c2ccc3ccc(Cl)cc3n2)n1	ZINC000508592741	332842525	/nfs/dbraw/zinc/84/25/25/332842525.db2.gz	BSSXREJILPFXEW-UHFFFAOYSA-N	0	0	299.761	4.447	20	30		CIEDRN
C=C(C)CCc1noc([C@H]2C[C@H]2c2cccc(F)c2F)n1	ZINC000508595744	332842661	/nfs/dbraw/zinc/84/26/61/332842661.db2.gz	PLTIPXKSKJHFHS-RYUDHWBXSA-N	0	0	290.313	4.128	20	30		CIEDRN
N#Cc1c(F)cccc1SC[C@H]1CCC2(CCCC2)O1	ZINC000582736911	329134275	/nfs/dbraw/zinc/13/42/75/329134275.db2.gz	LCZQNICRLJZWJZ-GFCCVEGCSA-N	0	0	291.391	4.281	20	30		CIEDRN
C=C(C)CCc1noc([C@@H](SCC)C(C)C)n1	ZINC000508599448	332843253	/nfs/dbraw/zinc/84/32/53/332843253.db2.gz	MFVPWKOANULPLD-LBPRGKRZSA-N	0	0	254.399	4.029	20	30		CIEDRN
C=C(C)CCc1noc([C@@H](C)c2cc3ccccc3o2)n1	ZINC000508600475	332843297	/nfs/dbraw/zinc/84/32/97/332843297.db2.gz	QMVLWHORUICYNI-LBPRGKRZSA-N	0	0	282.343	4.476	20	30		CIEDRN
CCC(=O)N(Cc1ccc(Cl)cc1)c1cccc(C#N)c1	ZINC000173788527	329152152	/nfs/dbraw/zinc/15/21/52/329152152.db2.gz	BTNZFCAMIUIZFC-UHFFFAOYSA-N	0	0	298.773	4.155	20	30		CIEDRN
C[C@H](Nc1c(Cl)cccc1C#N)c1cccc(O)c1	ZINC000174720153	329160942	/nfs/dbraw/zinc/16/09/42/329160942.db2.gz	POWJOJABHMECBZ-JTQLQIEISA-N	0	0	272.735	4.090	20	30		CIEDRN
C=CCCCC(=O)N1CC=C(c2c[nH]c3ccccc32)CC1	ZINC000175162503	329163140	/nfs/dbraw/zinc/16/31/40/329163140.db2.gz	KUQDIVNIVIPSNB-UHFFFAOYSA-N	0	0	294.398	4.140	20	30		CIEDRN
C=CCCCC(=O)Nc1cccc(C2SCCS2)c1	ZINC000175128034	329163187	/nfs/dbraw/zinc/16/31/87/329163187.db2.gz	YPYHZKUSILBUMR-UHFFFAOYSA-N	0	0	293.457	4.460	20	30		CIEDRN
C=CCCCC(=O)NC(c1cccs1)c1cccs1	ZINC000175726223	329168084	/nfs/dbraw/zinc/16/80/84/329168084.db2.gz	GRJFPWUKJFYNBI-UHFFFAOYSA-N	0	0	291.441	4.372	20	30		CIEDRN
COc1cc(CNc2cccc(C(F)F)c2)ccc1C#N	ZINC000386262765	329170911	/nfs/dbraw/zinc/17/09/11/329170911.db2.gz	WDDAZVGUNNEEGU-UHFFFAOYSA-N	0	0	288.297	4.117	20	30		CIEDRN
C=CCCCC(=O)N1CC[C@H](C)C[C@H]1c1ccc(C)o1	ZINC000176106752	329173925	/nfs/dbraw/zinc/17/39/25/329173925.db2.gz	NMURBRTUNQDMBV-ZFWWWQNUSA-N	0	0	275.392	4.244	20	30		CIEDRN
C=CCCCC(=O)N1CC[C@H](C)[C@@H]1c1cccc(F)c1	ZINC000176339108	329174357	/nfs/dbraw/zinc/17/43/57/329174357.db2.gz	HGANKNMWJUODSO-SUMWQHHRSA-N	0	0	275.367	4.092	20	30		CIEDRN
C=CCCCC(=O)N1CC[C@H](C)[C@H]1c1cccc(F)c1	ZINC000176339076	329174524	/nfs/dbraw/zinc/17/45/24/329174524.db2.gz	HGANKNMWJUODSO-GUYCJALGSA-N	0	0	275.367	4.092	20	30		CIEDRN
C=CCCCC(=O)Nc1cc(C(C)C)c(O)cc1C	ZINC000176852051	329178989	/nfs/dbraw/zinc/17/89/89/329178989.db2.gz	RQOUWNDPJFRWBP-UHFFFAOYSA-N	0	0	261.365	4.119	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC(c2ccccc2)CC1	ZINC000176917921	329179717	/nfs/dbraw/zinc/17/97/17/329179717.db2.gz	CPMUTIBOVDVSDL-UHFFFAOYSA-N	0	0	283.415	4.161	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(CCC(F)(F)F)cc1	ZINC000177444515	329183877	/nfs/dbraw/zinc/18/38/77/329183877.db2.gz	RZYPTVFBHVKGSX-UHFFFAOYSA-N	0	0	271.282	4.086	20	30		CIEDRN
C=C(C)CCc1noc(-c2cc(F)c(F)cc2Cl)n1	ZINC000508660929	332846438	/nfs/dbraw/zinc/84/64/38/332846438.db2.gz	IARUSKOPIMCFTK-UHFFFAOYSA-N	0	0	284.693	4.177	20	30		CIEDRN
C=CCN(C)C(=O)Nc1ccc(CCCCC)cc1	ZINC000429275739	329200628	/nfs/dbraw/zinc/20/06/28/329200628.db2.gz	RSEVYRZNKCBRBH-UHFFFAOYSA-N	0	0	260.381	4.069	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)N1CCC2(C1)CCCCC2	ZINC000178568032	329200671	/nfs/dbraw/zinc/20/06/71/329200671.db2.gz	IWVLBNWYQKIPCB-UHFFFAOYSA-N	0	0	297.402	4.055	20	30		CIEDRN
Cc1c(C#N)cccc1NCc1csc(C(C)C)n1	ZINC000179058161	329203837	/nfs/dbraw/zinc/20/38/37/329203837.db2.gz	LOCXEXFJSRSRPC-UHFFFAOYSA-N	0	0	271.389	4.059	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)[C@H]1CCCCC1(C)C	ZINC000469340622	329204442	/nfs/dbraw/zinc/20/44/42/329204442.db2.gz	RBTNATPXNBXASS-MRXNPFEDSA-N	0	0	289.419	4.053	20	30		CIEDRN
C#CCCCCC(=O)Nc1cccc(-c2nc(C)c(C)o2)c1	ZINC000179795220	329207630	/nfs/dbraw/zinc/20/76/30/329207630.db2.gz	SKXCBVOSLRXZTH-UHFFFAOYSA-N	0	0	296.370	4.091	20	30		CIEDRN
C=C(C)CCc1noc(-c2ccccc2C(F)(F)F)n1	ZINC000508673017	332846955	/nfs/dbraw/zinc/84/69/55/332846955.db2.gz	VKZZHPVNNOHBDU-UHFFFAOYSA-N	0	0	282.265	4.264	20	30		CIEDRN
C=C(C)CCc1noc(-c2cccc([C@H]3CCCOC3)c2)n1	ZINC000508670258	332846969	/nfs/dbraw/zinc/84/69/69/332846969.db2.gz	HHXYMXJRYAJVRS-INIZCTEOSA-N	0	0	298.386	4.139	20	30		CIEDRN
COC(=O)c1ccc(Cl)c(CSCCCCC#N)c1	ZINC000180759703	329222925	/nfs/dbraw/zinc/22/29/25/329222925.db2.gz	GJXOFRFFQBIXAZ-UHFFFAOYSA-N	0	0	297.807	4.054	20	30		CIEDRN
C=C(C)CCc1noc(-c2cccc(Cl)c2F)n1	ZINC000508681969	332847335	/nfs/dbraw/zinc/84/73/35/332847335.db2.gz	VCPSOBCMEMQGAJ-UHFFFAOYSA-N	0	0	266.703	4.038	20	30		CIEDRN
CC(=O)c1ccc(NCc2ccccc2C#N)cc1Cl	ZINC000181037180	329225180	/nfs/dbraw/zinc/22/51/80/329225180.db2.gz	YVIQOBGLBJEMAD-UHFFFAOYSA-N	0	0	284.746	4.026	20	30		CIEDRN
C[C@H]1CC(C(=O)N[C@@H](CCC#N)c2ccccc2)C[C@@H](C)C1	ZINC000181159671	329233124	/nfs/dbraw/zinc/23/31/24/329233124.db2.gz	ZOACAZBBEPGJCW-MPBLMAKGSA-N	0	0	298.430	4.220	20	30		CIEDRN
C=CC[C@H](CC)[NH2+]Cc1nc(-c2ccccc2)cs1	ZINC000393745837	329238943	/nfs/dbraw/zinc/23/89/43/329238943.db2.gz	LWCFUWJPPWLIMQ-AWEZNQCLSA-N	0	0	272.417	4.254	20	30		CIEDRN
CC[C@H](CC#N)NCc1ccc(-c2ccc(C)cc2)o1	ZINC000184089179	329256192	/nfs/dbraw/zinc/25/61/92/329256192.db2.gz	YAJOGXQKHOPZRB-OAHLLOKOSA-N	0	0	268.360	4.037	20	30		CIEDRN
N#C[C@@H]1CCC[C@H]1N[C@H]1CCc2c1cc(Cl)cc2Cl	ZINC000459459727	329257380	/nfs/dbraw/zinc/25/73/80/329257380.db2.gz	HYRUBUNYZNGFOA-AMFBXLIHSA-N	0	0	295.213	4.263	20	30		CIEDRN
N#CCc1ccc(NCc2cc(F)cc3cccnc32)cc1	ZINC000185154280	329266745	/nfs/dbraw/zinc/26/67/45/329266745.db2.gz	QYKDHMXTCRJWPF-UHFFFAOYSA-N	0	0	291.329	4.052	20	30		CIEDRN
C[C@@H](c1cccc(C#N)c1)N(C)C(=O)C1(C)CCCCC1	ZINC000582842132	329277125	/nfs/dbraw/zinc/27/71/25/329277125.db2.gz	JXJYILPVRULVLW-AWEZNQCLSA-N	0	0	284.403	4.048	20	30		CIEDRN
CCOc1ccc(C#N)cc1NCc1ccc2occc2c1	ZINC000582871657	329278719	/nfs/dbraw/zinc/27/87/19/329278719.db2.gz	HUBJUQVJBBUJLS-UHFFFAOYSA-N	0	0	292.338	4.315	20	30		CIEDRN
CC(C)c1c(N[C@H]2CC[C@H](C#N)C2)cnn1-c1ccccc1	ZINC000582884040	329285252	/nfs/dbraw/zinc/28/52/52/329285252.db2.gz	YMCFSNDZZWXPLY-GJZGRUSLSA-N	0	0	294.402	4.100	20	30		CIEDRN
CCC[C@@H](C)[C@H]1CCCN1c1nccc(C#N)c1Cl	ZINC000582921471	329288848	/nfs/dbraw/zinc/28/88/48/329288848.db2.gz	CJVYUHYWLPSSTB-DGCLKSJQSA-N	0	0	277.799	4.012	20	30		CIEDRN
C=CCCOc1ccc(NC(=O)C2CCCCC2)cc1	ZINC000582952452	329293149	/nfs/dbraw/zinc/29/31/49/329293149.db2.gz	BZZTVAPVMLHLEQ-UHFFFAOYSA-N	0	0	273.376	4.160	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cnccc1-c1cccc(F)c1	ZINC000185810117	329329534	/nfs/dbraw/zinc/32/95/34/329329534.db2.gz	DURBJCNRGLLVNX-CYBMUJFWSA-N	0	0	298.361	4.429	20	30		CIEDRN
N#CCCCSc1nc2cc(F)cc(Cl)c2o1	ZINC000186825409	329349388	/nfs/dbraw/zinc/34/93/88/329349388.db2.gz	NDNUZZSROIDAGS-UHFFFAOYSA-N	0	0	270.716	4.016	20	30		CIEDRN
N#CCCN(CCCCc1ccccc1)Cc1ccco1	ZINC000187112554	329353400	/nfs/dbraw/zinc/35/34/00/329353400.db2.gz	UAUPAIQFGJOQDH-UHFFFAOYSA-N	0	0	282.387	4.018	20	30		CIEDRN
C=CCC[C@H](C(=O)N[C@@H](C)c1ccccn1)c1ccccc1	ZINC000188872721	329372835	/nfs/dbraw/zinc/37/28/35/329372835.db2.gz	CKQBMODCIDDJEO-RDJZCZTQSA-N	0	0	294.398	4.009	20	30		CIEDRN
Cc1c(Cl)cccc1NC(=O)c1cccc(C#N)c1C	ZINC000509032068	332855845	/nfs/dbraw/zinc/85/58/45/332855845.db2.gz	HHBJEOUAXLTNGQ-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc3oc(CC)nc3c2)CCC1	ZINC000189025379	329375005	/nfs/dbraw/zinc/37/50/05/329375005.db2.gz	DOUNXPJZUFPBFH-UHFFFAOYSA-N	0	0	284.359	4.075	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(C2(c3cccc(C)c3)CC2)no1	ZINC000583234379	329386375	/nfs/dbraw/zinc/38/63/75/329386375.db2.gz	PMKFGVGQAHAEGD-KRWDZBQOSA-N	0	0	282.387	4.312	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1cccn1C	ZINC000189897033	329388121	/nfs/dbraw/zinc/38/81/21/329388121.db2.gz	UBKCZFVUYHEOPJ-UHFFFAOYSA-N	0	0	282.387	4.129	20	30		CIEDRN
C[C@H](CC(=O)N(CC#N)c1ccccc1)C1CCCCC1	ZINC000509107077	332859154	/nfs/dbraw/zinc/85/91/54/332859154.db2.gz	LAOTWEVKHWMTER-OAHLLOKOSA-N	0	0	284.403	4.150	20	30		CIEDRN
C[C@@H](Sc1nnc(C(C)(C)C)o1)c1cccc(C#N)c1	ZINC000189836927	329389484	/nfs/dbraw/zinc/38/94/84/329389484.db2.gz	QKAGHMDBRKAOFA-SNVBAGLBSA-N	0	0	287.388	4.092	20	30		CIEDRN
Cc1c(C#N)cccc1C(=O)N[C@H](C)c1ccc(Cl)cc1	ZINC000509030603	332856728	/nfs/dbraw/zinc/85/67/28/332856728.db2.gz	BQAVDPCINPGUKP-GFCCVEGCSA-N	0	0	298.773	4.011	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CC=C(c2ccc(F)cc2)CC1	ZINC000189959841	329389933	/nfs/dbraw/zinc/38/99/33/329389933.db2.gz	RSNVNHKZDJZAGF-GOSISDBHSA-N	0	0	287.378	4.044	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1ccncc1F	ZINC000189911995	329390102	/nfs/dbraw/zinc/39/01/02/329390102.db2.gz	VQXRXAQALBFLEI-UHFFFAOYSA-N	0	0	298.361	4.325	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(COC(C)C)cc2)CCC1	ZINC000190068480	329392184	/nfs/dbraw/zinc/39/21/84/329392184.db2.gz	JISFFHCBARLZMD-UHFFFAOYSA-N	0	0	287.403	4.297	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(OC)c(Cl)c2)CCC1	ZINC000190422050	329396553	/nfs/dbraw/zinc/39/65/53/329396553.db2.gz	HOUOQEYCXCRVBA-UHFFFAOYSA-N	0	0	279.767	4.034	20	30		CIEDRN
N#CCCCSCc1csc(Cc2ccccc2)n1	ZINC000190902094	329402905	/nfs/dbraw/zinc/40/29/05/329402905.db2.gz	NHRVWXLBAKIFMH-UHFFFAOYSA-N	0	0	288.441	4.271	20	30		CIEDRN
N#CCCCSCc1coc(-c2cccc(F)c2)n1	ZINC000190902987	329402980	/nfs/dbraw/zinc/40/29/80/329402980.db2.gz	SAZCUWAZHIJCCU-UHFFFAOYSA-N	0	0	276.336	4.018	20	30		CIEDRN
N#Cc1ccccc1SC[C@@H]1CCCC(F)(F)C1	ZINC000509059712	332857769	/nfs/dbraw/zinc/85/77/69/332857769.db2.gz	DWQSRBNMBVDPQH-LLVKDONJSA-N	0	0	267.344	4.476	20	30		CIEDRN
N#CCc1ccc(CNc2ccccc2C(F)(F)F)cc1	ZINC000398957916	329446915	/nfs/dbraw/zinc/44/69/15/329446915.db2.gz	JXXPXZPOYKRRSM-UHFFFAOYSA-N	0	0	290.288	4.384	20	30		CIEDRN
CC(C)(C#N)CC[S@@](=O)c1ccc(-c2ccccc2)cc1	ZINC000583740105	329471619	/nfs/dbraw/zinc/47/16/19/329471619.db2.gz	TVCWRBJPFYMMMB-OAQYLSRUSA-N	0	0	297.423	4.401	20	30		CIEDRN
CC[C@H](CC#N)NC(c1ccccc1)c1ccccc1	ZINC000036680882	329516585	/nfs/dbraw/zinc/51/65/85/329516585.db2.gz	LHYNEXHKVCIUAV-QGZVFWFLSA-N	0	0	264.372	4.058	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@H](c2ccc(CC)cc2)C1	ZINC000583889561	329530246	/nfs/dbraw/zinc/53/02/46/329530246.db2.gz	PJPNUTMCMILFMX-SFHVURJKSA-N	0	0	285.431	4.311	20	30		CIEDRN
C=C(C)CN(CC)C(=O)CCCC1CCCCC1	ZINC000301993777	332864538	/nfs/dbraw/zinc/86/45/38/332864538.db2.gz	DRZZVACSNBVDCJ-UHFFFAOYSA-N	0	0	251.414	4.162	20	30		CIEDRN
C[C@H](c1cccc(C#N)c1)N(C)C(=O)CC1(C)CCCC1	ZINC000425105920	329593354	/nfs/dbraw/zinc/59/33/54/329593354.db2.gz	FQPSCYLJPBDXMV-CQSZACIVSA-N	0	0	284.403	4.048	20	30		CIEDRN
CC[C@@H](CC(C)C)C(=O)N(C)[C@H](C)c1cccc(C#N)c1	ZINC000425106960	329595042	/nfs/dbraw/zinc/59/50/42/329595042.db2.gz	INXWSQXPSWQKIY-ZBFHGGJFSA-N	0	0	286.419	4.150	20	30		CIEDRN
C[C@@H](c1cccc(C#N)c1)N(C)C(=O)CCCC1CCCC1	ZINC000425119733	329597608	/nfs/dbraw/zinc/59/76/08/329597608.db2.gz	AAXZQNPLJAGGNP-HNNXBMFYSA-N	0	0	298.430	4.438	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CC12CC2	ZINC000425664567	329602908	/nfs/dbraw/zinc/60/29/08/329602908.db2.gz	PLGFDBHPLAMPKM-HNNXBMFYSA-N	0	0	284.403	4.213	20	30		CIEDRN
CC[C@H](CC(=O)N(C)[C@H](C)c1cccc(C#N)c1)C(C)C	ZINC000425127956	329605687	/nfs/dbraw/zinc/60/56/87/329605687.db2.gz	JMCJJSYWPRQHQA-GDBMZVCRSA-N	0	0	286.419	4.150	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1cccc(C#N)c1C)c1ccccc1	ZINC000188724743	329609767	/nfs/dbraw/zinc/60/97/67/329609767.db2.gz	NRGKGXCVVLBGKC-QGZVFWFLSA-N	0	0	290.366	4.165	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@H]1CC[C@@H](c2ccc(F)cc2)C1	ZINC000424807025	329616661	/nfs/dbraw/zinc/61/66/61/329616661.db2.gz	DVBVNXURYAQQRH-ZBFHGGJFSA-N	0	0	289.394	4.180	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N1CC[C@H](c2ccc(C)cc2C)C1	ZINC000424808094	329616965	/nfs/dbraw/zinc/61/69/65/329616965.db2.gz	GJBUIUOWUSXRLX-INIZCTEOSA-N	0	0	285.431	4.222	20	30		CIEDRN
Cc1cnc(-c2cccc(NCc3cc(C#N)cs3)c2)o1	ZINC000131102452	329631634	/nfs/dbraw/zinc/63/16/34/329631634.db2.gz	NDNKXDKDSRJWNB-UHFFFAOYSA-N	0	0	295.367	4.195	20	30		CIEDRN
CC(C)N(C)c1cccc(NCC(C)(C)CCC#N)c1	ZINC000131709154	329639778	/nfs/dbraw/zinc/63/97/78/329639778.db2.gz	FYZDJFHLEUTOLL-UHFFFAOYSA-N	0	0	273.424	4.273	20	30		CIEDRN
C[C@H](c1ccc(Cn2ccc(C#N)c2)cc1)C(F)(F)F	ZINC000418928006	329699314	/nfs/dbraw/zinc/69/93/14/329699314.db2.gz	YBVLYCATCISFIS-LLVKDONJSA-N	0	0	278.277	4.074	20	30		CIEDRN
CCOc1ccc2ccccc2c1OCC1(C#N)CCC1	ZINC000418940556	329699984	/nfs/dbraw/zinc/69/99/84/329699984.db2.gz	GXYRMUZATPNDQQ-UHFFFAOYSA-N	0	0	281.355	4.311	20	30		CIEDRN
N#CC1(CCOc2ccc([C@@H]3CCOC3)cc2)CCCCC1	ZINC000418985482	329701233	/nfs/dbraw/zinc/70/12/33/329701233.db2.gz	FTCPHLVFMVPOJF-QGZVFWFLSA-N	0	0	299.414	4.433	20	30		CIEDRN
N#CC1(CNc2ccnc3cc(F)c(Cl)cc32)CCC1	ZINC000419020495	329703893	/nfs/dbraw/zinc/70/38/93/329703893.db2.gz	LDIWEFOCDKGRAK-UHFFFAOYSA-N	0	0	289.741	4.133	20	30		CIEDRN
CC(C)(C)c1ccn(CCC2(C#N)CCCCC2)c(=O)c1	ZINC000419004580	329705408	/nfs/dbraw/zinc/70/54/08/329705408.db2.gz	FNRVBSUGIQFVRR-UHFFFAOYSA-N	0	0	286.419	4.010	20	30		CIEDRN
CC(C)(C#N)CCOc1ccc(Oc2cccnc2)cc1	ZINC000419042900	329706300	/nfs/dbraw/zinc/70/63/00/329706300.db2.gz	MMXWMEQTZUJZFR-UHFFFAOYSA-N	0	0	282.343	4.193	20	30		CIEDRN
COCc1ccccc1OCc1ccccc1C(C)(C)C#N	ZINC000419101543	329708188	/nfs/dbraw/zinc/70/81/88/329708188.db2.gz	XEGQNNIWSXRBDU-UHFFFAOYSA-N	0	0	295.382	4.213	20	30		CIEDRN
C[C@@H](NCc1ccc(F)cc1C#N)c1ccc(C2CC2)cc1	ZINC000419361728	329720083	/nfs/dbraw/zinc/72/00/83/329720083.db2.gz	UFHXBNIJOAPUQX-CYBMUJFWSA-N	0	0	294.373	4.426	20	30		CIEDRN
C[C@H](CCc1ccccc1)SCC1(C#N)CCC1	ZINC000419390768	329722066	/nfs/dbraw/zinc/72/20/66/329722066.db2.gz	MMEHXUVIJBDLRS-CQSZACIVSA-N	0	0	259.418	4.435	20	30		CIEDRN
CC(C)(C)c1cc(CSCc2ccccc2C#N)no1	ZINC000419392773	329722199	/nfs/dbraw/zinc/72/21/99/329722199.db2.gz	LRTQLKWHXJLZTO-UHFFFAOYSA-N	0	0	286.400	4.277	20	30		CIEDRN
C=CCOCCSCc1nc(-c2ccsc2)oc1C	ZINC000419409745	329724451	/nfs/dbraw/zinc/72/44/51/329724451.db2.gz	ZWSHHUVKKQSIIK-UHFFFAOYSA-N	0	0	295.429	4.147	20	30		CIEDRN
N#CC1(CCSCc2noc(C3CC3)n2)CCCCC1	ZINC000419415316	329725136	/nfs/dbraw/zinc/72/51/36/329725136.db2.gz	HSUFXZWDYDVDEX-UHFFFAOYSA-N	0	0	291.420	4.044	20	30		CIEDRN
C=CCOCCSCc1csc(C2CCCC2)n1	ZINC000419418408	329725535	/nfs/dbraw/zinc/72/55/35/329725535.db2.gz	QXBPLFAAXITXTE-UHFFFAOYSA-N	0	0	283.462	4.237	20	30		CIEDRN
C=CCOCCCSCC1CCC(F)(F)CC1	ZINC000419470104	329727186	/nfs/dbraw/zinc/72/71/86/329727186.db2.gz	DZJYKAKKRVCLHP-UHFFFAOYSA-N	0	0	264.381	4.138	20	30		CIEDRN
COCC[C@H](C)SCCC1(C#N)CCCCC1	ZINC000419419856	329727321	/nfs/dbraw/zinc/72/73/21/329727321.db2.gz	DHADSXCYHUMAGS-ZDUSSCGKSA-N	0	0	255.427	4.009	20	30		CIEDRN
N#Cc1cccc(OCCCSCC2CC(F)(F)C2)c1	ZINC000419428203	329728258	/nfs/dbraw/zinc/72/82/58/329728258.db2.gz	ABZGPQXELRJYEK-UHFFFAOYSA-N	0	0	297.370	4.106	20	30		CIEDRN
C[C@H](SCC1(C#N)CCC1)c1nc2ccccc2o1	ZINC000419458355	329731414	/nfs/dbraw/zinc/73/14/14/329731414.db2.gz	ZGUNQOIEZZFALG-NSHDSACASA-N	0	0	272.373	4.316	20	30		CIEDRN
C[C@H](SCCc1cncs1)c1cccc(C#N)c1	ZINC000419462115	329731811	/nfs/dbraw/zinc/73/18/11/329731811.db2.gz	JABDWPKXHMIEOK-NSHDSACASA-N	0	0	274.414	4.052	20	30		CIEDRN
C[C@@H]1C[C@H](CSCCC2(C#N)CCCCC2)CCO1	ZINC000419499969	329732598	/nfs/dbraw/zinc/73/25/98/329732598.db2.gz	PLYFVMMRGNZELN-HUUCEWRRSA-N	0	0	281.465	4.399	20	30		CIEDRN
C=CCOCCS[C@@H](C)c1ncc(-c2ccccc2)o1	ZINC000419507167	329733496	/nfs/dbraw/zinc/73/34/96/329733496.db2.gz	OBSFDEJECLWUMY-ZDUSSCGKSA-N	0	0	289.400	4.338	20	30		CIEDRN
CC(C)(C#N)c1ccccc1CSCC[C@@H]1CCOC1	ZINC000419545509	329738697	/nfs/dbraw/zinc/73/86/97/329738697.db2.gz	XAFOHXZOZKZYDC-AWEZNQCLSA-N	0	0	289.444	4.148	20	30		CIEDRN
N#CC1(CSCCCOCc2ccccc2)CCC1	ZINC000419576463	329739788	/nfs/dbraw/zinc/73/97/88/329739788.db2.gz	FXEHJFJKUDHEPX-UHFFFAOYSA-N	0	0	275.417	4.020	20	30		CIEDRN
N#CC1(CSCc2cccc3cccnc32)CCC1	ZINC000419584680	329741617	/nfs/dbraw/zinc/74/16/17/329741617.db2.gz	PFRYFDUBISFTCP-UHFFFAOYSA-N	0	0	268.385	4.162	20	30		CIEDRN
C=C(C)CCc1noc(C[C@@H](c2ccc(O)cc2)C2CC2)n1	ZINC000420500243	329770367	/nfs/dbraw/zinc/77/03/67/329770367.db2.gz	FOGQIIIEQUKUMD-MRXNPFEDSA-N	0	0	298.386	4.020	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H](CC)OC2CCCC2)n1	ZINC000420500690	329770413	/nfs/dbraw/zinc/77/04/13/329770413.db2.gz	GVZIXTPCUHBAMN-CYBMUJFWSA-N	0	0	278.396	4.334	20	30		CIEDRN
N#CCCN(Cc1ccco1)Cc1cccc(C2CC2)c1	ZINC000421332204	329813148	/nfs/dbraw/zinc/81/31/48/329813148.db2.gz	VBXDVFFUQJDREL-UHFFFAOYSA-N	0	0	280.371	4.073	20	30		CIEDRN
C=CCOc1ccc(C(=O)N(CC=C)c2ccccc2)cc1	ZINC000509674670	332878407	/nfs/dbraw/zinc/87/84/07/332878407.db2.gz	BPMIPQFFACREGA-UHFFFAOYSA-N	0	0	293.366	4.084	20	30		CIEDRN
N#CCc1ccc(NC2CC3(C2)CCCCC3)cc1	ZINC000421349559	329815184	/nfs/dbraw/zinc/81/51/84/329815184.db2.gz	XYCVVTDSCQWCAG-UHFFFAOYSA-N	0	0	254.377	4.277	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CC[C@H](C2CCCC2)C1)c1ccccc1	ZINC000421644922	329861542	/nfs/dbraw/zinc/86/15/42/329861542.db2.gz	GFBSRGLNYMKSCV-LPHOPBHVSA-N	0	0	297.442	4.385	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H](C)c1ccccc1OC(C)C	ZINC000525960263	329887527	/nfs/dbraw/zinc/88/75/27/329887527.db2.gz	RPIJBWQFKSYUQB-KBXCAEBGSA-N	0	0	289.419	4.253	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)CCCc1ccccc1Cl	ZINC000572084711	329942939	/nfs/dbraw/zinc/94/29/39/329942939.db2.gz	ADZIRCZAPLAGNH-HNNXBMFYSA-N	0	0	291.822	4.230	20	30		CIEDRN
CCc1ccc([C@H](C#N)N(C)C(=O)CCC2CCCC2)cc1	ZINC000572188592	329953240	/nfs/dbraw/zinc/95/32/40/329953240.db2.gz	UTVREVDBXINVCT-SFHVURJKSA-N	0	0	298.430	4.242	20	30		CIEDRN
N#Cc1ccccc1NCc1csc(-c2ccccc2)n1	ZINC000509900491	332885017	/nfs/dbraw/zinc/88/50/17/332885017.db2.gz	OFEAPHJTBJUFRK-UHFFFAOYSA-N	0	0	291.379	4.294	20	30		CIEDRN
C=CCC(C)(C)c1noc(COc2cccc(CC)c2)n1	ZINC000572263592	329962637	/nfs/dbraw/zinc/96/26/37/329962637.db2.gz	LXIJMHFCBHIQTJ-UHFFFAOYSA-N	0	0	286.375	4.065	20	30		CIEDRN
C=CCN(C(=O)c1sc2cccc(F)c2c1C)C1CC1	ZINC000536823488	329968583	/nfs/dbraw/zinc/96/85/83/329968583.db2.gz	VLRKYUHYXXLWQP-UHFFFAOYSA-N	0	0	289.375	4.139	20	30		CIEDRN
CN(C(=O)[C@@H]1CCC[C@@H]2CCCC[C@@H]12)c1ccccc1C#N	ZINC000564137453	330000485	/nfs/dbraw/zinc/00/04/85/330000485.db2.gz	IBDZZUGCYHXTLE-USXIJHARSA-N	0	0	296.414	4.128	20	30		CIEDRN
CN(C(=O)[C@@H]1CCC[C@@H]2CCCC[C@H]12)c1ccccc1C#N	ZINC000564137447	330001593	/nfs/dbraw/zinc/00/15/93/330001593.db2.gz	IBDZZUGCYHXTLE-BHYGNILZSA-N	0	0	296.414	4.128	20	30		CIEDRN
C=C1CCN(C(=O)[C@H]2C[C@@H]2c2cccc3ccccc32)CC1	ZINC000264440418	330061245	/nfs/dbraw/zinc/06/12/45/330061245.db2.gz	BRUFLYUJPQZYLH-MOPGFXCFSA-N	0	0	291.394	4.122	20	30		CIEDRN
C=C1CCN(C(=O)[C@@H]2C[C@@H]2c2ccc3ccccc3c2)CC1	ZINC000264580961	330061725	/nfs/dbraw/zinc/06/17/25/330061725.db2.gz	VGXGTNOQRMEXFO-RTBURBONSA-N	0	0	291.394	4.122	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)[C@@H](C)c1cccs1	ZINC000268196840	330065303	/nfs/dbraw/zinc/06/53/03/330065303.db2.gz	XUEYGTHYYOKSOB-LBPRGKRZSA-N	0	0	263.406	4.036	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCCCC[C@@H]1c1ccncc1	ZINC000268144464	330065330	/nfs/dbraw/zinc/06/53/30/330065330.db2.gz	ISPTZJFTWZMINR-GOSISDBHSA-N	0	0	298.430	4.294	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)[C@@H](C)c1sc(C)nc1C	ZINC000268206510	330065499	/nfs/dbraw/zinc/06/54/99/330065499.db2.gz	NTVDYJXYAPFZQJ-LBPRGKRZSA-N	0	0	292.448	4.048	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC=C(c2ccc(F)cc2)CC1	ZINC000268117304	330065568	/nfs/dbraw/zinc/06/55/68/330065568.db2.gz	AJUYTDPQJWEGJA-UHFFFAOYSA-N	0	0	299.389	4.210	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1c(C)cccc1Cl	ZINC000268153066	330065572	/nfs/dbraw/zinc/06/55/72/330065572.db2.gz	BTWYMEXEOAXFPO-UHFFFAOYSA-N	0	0	263.768	4.355	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)[C@H](C)c1ccc(F)c(F)c1	ZINC000268125634	330065592	/nfs/dbraw/zinc/06/55/92/330065592.db2.gz	DBKRGWBNVRUGJW-GFCCVEGCSA-N	0	0	293.357	4.253	20	30		CIEDRN
C=CCN(C(=O)c1ccn(C(CC)CC)n1)c1ccccc1	ZINC000269341841	330068355	/nfs/dbraw/zinc/06/83/55/330068355.db2.gz	HFFORINNPOOION-UHFFFAOYSA-N	0	0	297.402	4.077	20	30		CIEDRN
C=CCC[C@@H](NC(=O)Nc1nc(C)c(C)o1)c1ccccc1	ZINC000269376485	330069924	/nfs/dbraw/zinc/06/99/24/330069924.db2.gz	NQUCFJTTYSIMLD-OAHLLOKOSA-N	0	0	299.374	4.120	20	30		CIEDRN
C=C(C)[C@@H](Cc1nc(-c2cc3ccccc3o2)no1)OCC	ZINC000270033685	330072374	/nfs/dbraw/zinc/07/23/74/330072374.db2.gz	MFLZBGNAXKWYHA-CQSZACIVSA-N	0	0	298.342	4.007	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)Nc1c(CC)cccc1CC)OCC	ZINC000270020505	330073265	/nfs/dbraw/zinc/07/32/65/330073265.db2.gz	FEBAGKUKFZBLSC-MRXNPFEDSA-N	0	0	289.419	4.121	20	30		CIEDRN
C=CCCCSCC(=O)Nc1c(C)cccc1Cl	ZINC000270141680	330073649	/nfs/dbraw/zinc/07/36/49/330073649.db2.gz	PFHUCRUVNJQBBH-UHFFFAOYSA-N	0	0	283.824	4.286	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CC[C@@H](c2ccccc2)C1(C)C	ZINC000421723592	330074593	/nfs/dbraw/zinc/07/45/93/330074593.db2.gz	WGFBLXKVZOKHDO-WBVHZDCISA-N	0	0	285.431	4.383	20	30		CIEDRN
C#CCCCSc1nnc([C@H](CC)c2ccccc2)o1	ZINC000270890321	330076890	/nfs/dbraw/zinc/07/68/90/330076890.db2.gz	RAKJIUCXMPSQIK-CQSZACIVSA-N	0	0	286.400	4.117	20	30		CIEDRN
C#CCCCCC(=O)N[C@@H](CC)c1ccc(Cl)s1	ZINC000271364821	330078789	/nfs/dbraw/zinc/07/87/89/330078789.db2.gz	KXSXWRNBNIPQKW-NSHDSACASA-N	0	0	283.824	4.162	20	30		CIEDRN
C#CCCCCC(=O)N1CCCC[C@H]1c1ccc(F)cc1	ZINC000271377069	330079404	/nfs/dbraw/zinc/07/94/04/330079404.db2.gz	CPPJGJOLCYIYBR-KRWDZBQOSA-N	0	0	287.378	4.073	20	30		CIEDRN
CCC[C@@H]1CCc2ccccc2N1Cc1ccc(C#N)cn1	ZINC000572434985	330081610	/nfs/dbraw/zinc/08/16/10/330081610.db2.gz	VPPXQGAGERMIQS-GOSISDBHSA-N	0	0	291.398	4.075	20	30		CIEDRN
C#CC[C@H](NCc1csc(CCCC)n1)c1ccccc1	ZINC000271743792	330081896	/nfs/dbraw/zinc/08/18/96/330081896.db2.gz	WADYPXHXHUPLIB-KRWDZBQOSA-N	0	0	298.455	4.340	20	30		CIEDRN
N#CCCC[S@](=O)Cc1ccc(Cl)c2ccccc12	ZINC000421813099	330085527	/nfs/dbraw/zinc/08/55/27/330085527.db2.gz	MXKOCGHKCFWWAD-IBGZPJMESA-N	0	0	291.803	4.046	20	30		CIEDRN
N#CCCC[S@@](=O)Cc1ccc(Cl)c2ccccc12	ZINC000421813100	330085533	/nfs/dbraw/zinc/08/55/33/330085533.db2.gz	MXKOCGHKCFWWAD-LJQANCHMSA-N	0	0	291.803	4.046	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(Cc2cccc3cccnc32)no1	ZINC000274296479	330104095	/nfs/dbraw/zinc/10/40/95/330104095.db2.gz	ADJJCKHTZXNCCI-CYBMUJFWSA-N	0	0	293.370	4.278	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCCC[C@@H]1c1ccc(F)cc1	ZINC000274364336	330105232	/nfs/dbraw/zinc/10/52/32/330105232.db2.gz	TWKJBLWCAFNYSY-RHSMWYFYSA-N	0	0	289.394	4.482	20	30		CIEDRN
C=C(C)CC[NH2+][C@@H](CC)c1nc(C(F)(F)F)cs1	ZINC000274856945	330108072	/nfs/dbraw/zinc/10/80/72/330108072.db2.gz	SMRMYHFZLYSAPT-VIFPVBQESA-N	0	0	278.343	4.169	20	30		CIEDRN
C=CCCN(C)C(=O)N[C@H](C)c1cc2ccccc2s1	ZINC000276051991	330111636	/nfs/dbraw/zinc/11/16/36/330111636.db2.gz	AGUNNBGKBVLRJA-GFCCVEGCSA-N	0	0	288.416	4.180	20	30		CIEDRN
C=CCCCc1nc(-c2cc(C)c3ccccc3n2)no1	ZINC000445403854	330112268	/nfs/dbraw/zinc/11/22/68/330112268.db2.gz	QIANSYJOVSMTCS-UHFFFAOYSA-N	0	0	279.343	4.102	20	30		CIEDRN
C=CCCN(C)C(=O)c1ccc(Cl)cc1C(F)(F)F	ZINC000276219029	330112556	/nfs/dbraw/zinc/11/25/56/330112556.db2.gz	CXLAFBDVJREOKU-UHFFFAOYSA-N	0	0	291.700	4.007	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1ccc(OCCCC)cc1C	ZINC000276321009	330112940	/nfs/dbraw/zinc/11/29/40/330112940.db2.gz	OVPSZIATLSZLRO-UHFFFAOYSA-N	0	0	290.407	4.214	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H]1C[C@@H]1C	ZINC000276441980	330113693	/nfs/dbraw/zinc/11/36/93/330113693.db2.gz	RSTCXYZUCSRHME-ZFWWWQNUSA-N	0	0	286.419	4.316	20	30		CIEDRN
C#C[C@H](C)NC(=O)Nc1c(C(C)C)cccc1C(C)C	ZINC000276538440	330114028	/nfs/dbraw/zinc/11/40/28/330114028.db2.gz	OGRVQKACKQKFHA-ZDUSSCGKSA-N	0	0	272.392	4.077	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)[C@@]1(C)CCCO1	ZINC000276509106	330114099	/nfs/dbraw/zinc/11/40/99/330114099.db2.gz	YZHYOPLYYUJUDG-GOSISDBHSA-N	0	0	287.403	4.046	20	30		CIEDRN
C#CCCCC(=O)N1CCC[C@H]1c1cccc2ccccc21	ZINC000277170741	330115463	/nfs/dbraw/zinc/11/54/63/330115463.db2.gz	ZMJGIKDUSOMGTH-IBGZPJMESA-N	0	0	291.394	4.307	20	30		CIEDRN
CC#CC(=O)N[C@H](c1cccs1)c1ccc(C(C)C)cc1	ZINC000277533393	330116204	/nfs/dbraw/zinc/11/62/04/330116204.db2.gz	UUSOQSSIVIEREP-SFHVURJKSA-N	0	0	297.423	4.100	20	30		CIEDRN
C=CCC[C@@H](NCc1c(CC)noc1CC)c1ccco1	ZINC000278880883	330120827	/nfs/dbraw/zinc/12/08/27/330120827.db2.gz	GXCYDQXDFRMEIU-OAHLLOKOSA-N	0	0	288.391	4.190	20	30		CIEDRN
C=CC[C@H](C)[C@H](C)Nc1cccc(NC(=O)NCC)c1C	ZINC000278927773	330121053	/nfs/dbraw/zinc/12/10/53/330121053.db2.gz	XBZFQRGOPBSIGA-JSGCOSHPSA-N	0	0	289.423	4.149	20	30		CIEDRN
C=CCCC1(C(=O)N2CC[C@@H](C(C)(C)C)C[C@H]2C)CC1	ZINC000580458950	330141260	/nfs/dbraw/zinc/14/12/60/330141260.db2.gz	RMFZLVYHZRUIQQ-HUUCEWRRSA-N	0	0	277.452	4.406	20	30		CIEDRN
C[C@@H](CC1CCCC1)C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000510221533	332897604	/nfs/dbraw/zinc/89/76/04/332897604.db2.gz	NRFZHADJSGTRSP-NSHDSACASA-N	0	0	290.794	4.367	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(-c2ccccc2Cl)no1	ZINC000527196684	330234844	/nfs/dbraw/zinc/23/48/44/330234844.db2.gz	XRBUQCDEUXPBLJ-AWEZNQCLSA-N	0	0	262.740	4.244	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cccc(Br)c2)CC1	ZINC000527217758	330238298	/nfs/dbraw/zinc/23/82/98/330238298.db2.gz	CJLVZGOHMJDMLH-UHFFFAOYSA-N	0	0	294.192	4.134	20	30		CIEDRN
COc1ccc([C@@H](C)[C@@H](C)Nc2cccc(C#N)c2)cc1	ZINC000527218659	330238466	/nfs/dbraw/zinc/23/84/66/330238466.db2.gz	UVBWQAGHBMCJGD-UONOGXRCSA-N	0	0	280.371	4.171	20	30		CIEDRN
C[C@H]1C[C@H]1c1ccc(CNc2cccc(F)c2C#N)o1	ZINC000036138636	330249606	/nfs/dbraw/zinc/24/96/06/330249606.db2.gz	HOTUITBZPUMGBS-CMPLNLGQSA-N	0	0	270.307	4.026	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(-c2cccc(Cl)c2)no1	ZINC000527487747	330250769	/nfs/dbraw/zinc/25/07/69/330250769.db2.gz	NXGRLUPYKQYAKD-AWEZNQCLSA-N	0	0	262.740	4.244	20	30		CIEDRN
CC[C@@H](CNc1ccc(C#N)cc1[N+](=O)[O-])c1ccccc1	ZINC000036781877	330265394	/nfs/dbraw/zinc/26/53/94/330265394.db2.gz	TYSUOMSQJZALLA-AWEZNQCLSA-N	0	0	295.342	4.072	20	30		CIEDRN
CCC(CC)Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000036805545	330275505	/nfs/dbraw/zinc/27/55/05/330275505.db2.gz	HLNXOLIWWVUBCD-UHFFFAOYSA-N	0	0	256.271	4.178	20	30		CIEDRN
COCc1ccc(NCc2ccc([C@H]3C[C@H]3C)o2)cc1C#N	ZINC000527762152	330281369	/nfs/dbraw/zinc/28/13/69/330281369.db2.gz	GUBHMGVQLMNQOA-PXAZEXFGSA-N	0	0	296.370	4.033	20	30		CIEDRN
CC(C)c1cc(Cl)ccc1NCc1nc(C#N)cs1	ZINC000527782630	330283211	/nfs/dbraw/zinc/28/32/11/330283211.db2.gz	ICOYLAUPQBVTQT-UHFFFAOYSA-N	0	0	291.807	4.404	20	30		CIEDRN
CCC(C#N)(CC)C(=O)Nc1ccc2oc(C(C)C)nc2c1	ZINC000527897793	330292981	/nfs/dbraw/zinc/29/29/81/330292981.db2.gz	AMPZKPBYBNOLBA-UHFFFAOYSA-N	0	0	299.374	4.220	20	30		CIEDRN
N#C[C@@H]1CCC[C@@H](Nc2cccc(C3CCOCC3)c2)C1	ZINC000527994202	330299383	/nfs/dbraw/zinc/29/93/83/330299383.db2.gz	HRVPPHDTFPZIST-RHSMWYFYSA-N	0	0	284.403	4.075	20	30		CIEDRN
C=CCC(C)(C)c1noc(C2(C)CCC(F)(F)CC2)n1	ZINC000528203010	330312963	/nfs/dbraw/zinc/31/29/63/330312963.db2.gz	SONUSOPKISZNSI-UHFFFAOYSA-N	0	0	284.350	4.390	20	30		CIEDRN
CCC(C#N)(CC)c1nc(-c2ccc(C)c(Cl)c2)no1	ZINC000528203773	330312982	/nfs/dbraw/zinc/31/29/82/330312982.db2.gz	FFLGFSAXYJSIJV-UHFFFAOYSA-N	0	0	289.766	4.280	20	30		CIEDRN
CC(C)Cc1ccccc1-c1noc(CC(C)(C)C#N)n1	ZINC000528222600	330315765	/nfs/dbraw/zinc/31/57/65/330315765.db2.gz	CRUZHLQUAKIMDP-UHFFFAOYSA-N	0	0	283.375	4.027	20	30		CIEDRN
CC[C@@](C)(C#N)c1nc(-c2ccccc2CC(C)C)no1	ZINC000528226035	330315942	/nfs/dbraw/zinc/31/59/42/330315942.db2.gz	XYRWHEFKNHLLBM-KRWDZBQOSA-N	0	0	283.375	4.126	20	30		CIEDRN
C=CCC1(c2nc([C@@H]3CC[C@H](C)O3)no2)CCCCC1	ZINC000528237200	330316891	/nfs/dbraw/zinc/31/68/91/330316891.db2.gz	MAUKRUXEHITELJ-STQMWFEESA-N	0	0	276.380	4.088	20	30		CIEDRN
C[C@@H](Cc1ccsc1)Nc1c(C#N)cnc2ccccc21	ZINC000044386597	330327931	/nfs/dbraw/zinc/32/79/31/330327931.db2.gz	NSQYGHQCFAKBND-LBPRGKRZSA-N	0	0	293.395	4.211	20	30		CIEDRN
C=C(C)C(C)(C)c1nc(CSc2ccc(F)cc2)no1	ZINC000424356791	330346383	/nfs/dbraw/zinc/34/63/83/330346383.db2.gz	SBVSVBVVSMICDD-UHFFFAOYSA-N	0	0	292.379	4.355	20	30		CIEDRN
C=CCn1cc(Br)c(-c2ccc(Cl)cc2)n1	ZINC000533168615	330351688	/nfs/dbraw/zinc/35/16/88/330351688.db2.gz	DWNIFJWFUKFZGU-UHFFFAOYSA-N	0	0	297.583	4.152	20	30		CIEDRN
N#CCc1ccc(NC(=O)c2cc3sccc3s2)cc1	ZINC000108453400	330353951	/nfs/dbraw/zinc/35/39/51/330353951.db2.gz	XHVNRCKYYMINHB-UHFFFAOYSA-N	0	0	298.392	4.281	20	30		CIEDRN
Cc1cn(Cc2coc(-c3ccc(Cl)cc3)n2)cc1C#N	ZINC000533228177	330354673	/nfs/dbraw/zinc/35/46/73/330354673.db2.gz	OKPBNSDIVUQSAH-UHFFFAOYSA-N	0	0	297.745	4.025	20	30		CIEDRN
CCCC[C@@H](CC)C(=O)N[C@@](C)(C#N)C1CCCCC1	ZINC000580499473	330354917	/nfs/dbraw/zinc/35/49/17/330354917.db2.gz	ONINQRRFMLDCNV-PBHICJAKSA-N	0	0	278.440	4.182	20	30		CIEDRN
C=CCC[C@@H](NC(=O)N1C2CCC1CC2)c1ccccc1	ZINC000533262663	330355746	/nfs/dbraw/zinc/35/57/46/330355746.db2.gz	IZZWWEKWJBHYHF-OFLPRAFFSA-N	0	0	284.403	4.030	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N(C)[C@@H](C)c1ccccc1Cl	ZINC000116972638	330362887	/nfs/dbraw/zinc/36/28/87/330362887.db2.gz	IQUPTLVQNIABAH-RYUDHWBXSA-N	0	0	280.799	4.007	20	30		CIEDRN
C=C(CC)CSc1nnc(-c2ccc(F)cc2)n1CC	ZINC000536902220	330363630	/nfs/dbraw/zinc/36/36/30/330363630.db2.gz	SSSMGKZGOQENKB-UHFFFAOYSA-N	0	0	291.395	4.162	20	30		CIEDRN
CCC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C	ZINC000057002748	330370336	/nfs/dbraw/zinc/37/03/36/330370336.db2.gz	OTPVFULCOQLCOQ-UHFFFAOYSA-N	0	0	280.327	4.008	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1cc(Cl)ccc1Cl	ZINC000057157921	330372078	/nfs/dbraw/zinc/37/20/78/330372078.db2.gz	WGISTZOYOJLQQC-UHFFFAOYSA-N	0	0	272.175	4.032	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@@H]1CCSc2ccc(F)cc21	ZINC000424567903	330379782	/nfs/dbraw/zinc/37/97/82/330379782.db2.gz	SWAUAKROPGAJTL-CYBMUJFWSA-N	0	0	293.407	4.081	20	30		CIEDRN
C[C@@H]1CCC[C@H](CCN(CCC#N)Cc2ccccn2)C1	ZINC000089129863	330380800	/nfs/dbraw/zinc/38/08/00/330380800.db2.gz	JNEOEFQSKIZCSO-IAGOWNOFSA-N	0	0	285.435	4.014	20	30		CIEDRN
CCC(CC)CN(CC)C(=O)Nc1cc(C#N)ccc1C	ZINC000058452205	330387967	/nfs/dbraw/zinc/38/79/67/330387967.db2.gz	MWXLCLDAGSPJKJ-UHFFFAOYSA-N	0	0	287.407	4.157	20	30		CIEDRN
C=CCN(Cc1cccc(C#N)c1)C(=O)[C@@H](CCC)C(C)C	ZINC000120832515	330392770	/nfs/dbraw/zinc/39/27/70/330392770.db2.gz	HTIJIKHQKVZTDI-SFHVURJKSA-N	0	0	298.430	4.145	20	30		CIEDRN
C=CCCCN(C)C(=O)[C@@H](C)CCCc1ccccc1	ZINC000537199406	330414543	/nfs/dbraw/zinc/41/45/43/330414543.db2.gz	PGNDMRBJJDWMOU-INIZCTEOSA-N	0	0	273.420	4.070	20	30		CIEDRN
CC[C@@H](C#N)Nc1cccc(COc2ccccc2)c1C	ZINC000122252467	330416392	/nfs/dbraw/zinc/41/63/92/330416392.db2.gz	AYIIWALVZJWLCT-INIZCTEOSA-N	0	0	280.371	4.288	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)C[C@@H]1CCc2ccccc2C1	ZINC000537226757	330429409	/nfs/dbraw/zinc/42/94/09/330429409.db2.gz	VRMOTZRXSNCPCG-JKSUJKDBSA-N	0	0	285.431	4.043	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@H]1CCCC(C)(C)C1	ZINC000537237217	330430145	/nfs/dbraw/zinc/43/01/45/330430145.db2.gz	PUZXNIRBIHYIPH-KBPBESRZSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H]1c2ccccc2CC[C@@H]1C	ZINC000537593505	330443442	/nfs/dbraw/zinc/44/34/42/330443442.db2.gz	BXDMTXPZDIOGHD-KBXCAEBGSA-N	0	0	283.415	4.195	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1cn(CC(C)C)nc1C(F)F	ZINC000424741239	330455916	/nfs/dbraw/zinc/45/59/16/330455916.db2.gz	DWWBQHADRHCROL-UHFFFAOYSA-N	0	0	299.365	4.018	20	30		CIEDRN
C[C@H]1CCN(c2c(C#N)cnc3ccccc32)CC12CCC2	ZINC000537822289	330458383	/nfs/dbraw/zinc/45/83/83/330458383.db2.gz	DSITVUAWQGFVTC-AWEZNQCLSA-N	0	0	291.398	4.123	20	30		CIEDRN
C[C@H](Nc1cc(C#N)ccn1)c1ccc(F)c2ccccc21	ZINC000514751835	330463615	/nfs/dbraw/zinc/46/36/15/330463615.db2.gz	KWUCMIZYKIFRNA-LBPRGKRZSA-N	0	0	291.329	4.419	20	30		CIEDRN
CC(C)C[C@@H](NC(=O)c1cccc(C#N)c1)c1cccs1	ZINC000515459980	330477952	/nfs/dbraw/zinc/47/79/52/330477952.db2.gz	UWPXIMCFPOQYDE-OAHLLOKOSA-N	0	0	298.411	4.137	20	30		CIEDRN
Cc1ccsc1CNc1cc(C#N)c2ccccc2n1	ZINC000083798727	330482663	/nfs/dbraw/zinc/48/26/63/330482663.db2.gz	QDGHCLAUWXEFSM-UHFFFAOYSA-N	0	0	279.368	4.089	20	30		CIEDRN
N#Cc1cccc(N[C@H]2CCC[C@@H](C(F)(F)F)C2)c1	ZINC000085127907	330489017	/nfs/dbraw/zinc/48/90/17/330489017.db2.gz	YKONNZXBDSMMNH-YPMHNXCESA-N	0	0	268.282	4.091	20	30		CIEDRN
C=CCCc1nc(-c2ccc(Cl)cc2Cl)no1	ZINC000445457961	330497372	/nfs/dbraw/zinc/49/73/72/330497372.db2.gz	PLCYPYVJQIJODH-UHFFFAOYSA-N	0	0	269.131	4.162	20	30		CIEDRN
C=CCC(C)(C)c1nc(-c2cccc3cnccc32)no1	ZINC000426398820	330506980	/nfs/dbraw/zinc/50/69/80/330506980.db2.gz	YWOVUBRWYUMQPG-UHFFFAOYSA-N	0	0	279.343	4.139	20	30		CIEDRN
Cc1c2cc(C#N)ccc2sc1-c1nc(C(C)(C)C)no1	ZINC000426456424	330510149	/nfs/dbraw/zinc/51/01/49/330510149.db2.gz	CYOMLULIODVWOD-UHFFFAOYSA-N	0	0	297.383	4.429	20	30		CIEDRN
C=CCN(C)C(=O)Nc1ccccc1COC(C)(C)CC	ZINC000429566869	330549625	/nfs/dbraw/zinc/54/96/25/330549625.db2.gz	LXVAXYXJLFZLGS-UHFFFAOYSA-N	0	0	290.407	4.042	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCc1ccc(C(C)C)cc1	ZINC000429821014	330555421	/nfs/dbraw/zinc/55/54/21/330555421.db2.gz	CZYCBBKTGYLYTH-UHFFFAOYSA-N	0	0	259.393	4.029	20	30		CIEDRN
C=CCN(C)C(=O)N[C@@H]1C[C@H]2CCC(C)(C)c3cccc1c32	ZINC000430311192	330566925	/nfs/dbraw/zinc/56/69/25/330566925.db2.gz	HMEOLRVZIKDYQG-CZUORRHYSA-N	0	0	298.430	4.114	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1ccn(C(CC)CC)n1	ZINC000431475850	330585216	/nfs/dbraw/zinc/58/52/16/330585216.db2.gz	HBWCNEPVEPWCKQ-UHFFFAOYSA-N	0	0	291.439	4.063	20	30		CIEDRN
Cc1cccc2cc(C(=O)Nc3cccc(C#N)c3C)oc21	ZINC000431843608	330589513	/nfs/dbraw/zinc/58/95/13/330589513.db2.gz	WKELTHJJFGLQSK-UHFFFAOYSA-N	0	0	290.322	4.174	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H]1CC(C)(C)Cc2oc(C)cc21	ZINC000432004560	330591238	/nfs/dbraw/zinc/59/12/38/330591238.db2.gz	AYTCDYYATIULFN-CQSZACIVSA-N	0	0	289.419	4.320	20	30		CIEDRN
N#Cc1c(F)cccc1N1CC2(CCC2)[C@@H]1c1ccccc1	ZINC000432152474	330594082	/nfs/dbraw/zinc/59/40/82/330594082.db2.gz	XBBBUACGMSQLCR-SFHVURJKSA-N	0	0	292.357	4.429	20	30		CIEDRN
Cc1c(Cl)ccc2ccc(N(C)CC(C)(C)C#N)nc12	ZINC000432159554	330594162	/nfs/dbraw/zinc/59/41/62/330594162.db2.gz	VJXQNKLRLQGDJM-UHFFFAOYSA-N	0	0	287.794	4.183	20	30		CIEDRN
CCC[C@@H](C(=O)Nc1cccc(C#N)c1C)c1ccccc1	ZINC000432343194	330597651	/nfs/dbraw/zinc/59/76/51/330597651.db2.gz	SFGSVPNKVNYBFO-QGZVFWFLSA-N	0	0	292.382	4.389	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N1CC2(CCC2)[C@@H]1c1ccccc1	ZINC000432348532	330597808	/nfs/dbraw/zinc/59/78/08/330597808.db2.gz	QXMRXZQUBMZTNH-SJORKVTESA-N	0	0	298.430	4.278	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)Nc1ccc(Cl)cc1F	ZINC000432454155	330599371	/nfs/dbraw/zinc/59/93/71/330599371.db2.gz	DXLVIQPGHIAKIQ-UHFFFAOYSA-N	0	0	284.762	4.203	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)Nc1ccc(C)cc1C	ZINC000432456880	330599385	/nfs/dbraw/zinc/59/93/85/330599385.db2.gz	ZSSOOPWRPBECKN-UHFFFAOYSA-N	0	0	260.381	4.027	20	30		CIEDRN
CCCCc1ccc(NC(=O)N(C)CC(C)(C)C#N)cc1	ZINC000432482302	330599623	/nfs/dbraw/zinc/59/96/23/330599623.db2.gz	GBOACUALJIRZMX-UHFFFAOYSA-N	0	0	287.407	4.043	20	30		CIEDRN
Cc1c(F)ccc(Cl)c1NCc1ccc(CC#N)cc1	ZINC000432710492	330604010	/nfs/dbraw/zinc/60/40/10/330604010.db2.gz	WGJZCFVJJFHBPT-UHFFFAOYSA-N	0	0	288.753	4.466	20	30		CIEDRN
C=CCCCNC(=O)Nc1cc(-c2cccnc2)ccc1C	ZINC000432997142	330611809	/nfs/dbraw/zinc/61/18/09/330611809.db2.gz	VYYXJDHIDUIXEW-UHFFFAOYSA-N	0	0	295.386	4.145	20	30		CIEDRN
Cc1cc(C)cc(NC(=O)[C@@H](C#N)CCc2ccccc2)c1	ZINC000433125820	330617760	/nfs/dbraw/zinc/61/77/60/330617760.db2.gz	AALSNMUCOJFGQG-QGZVFWFLSA-N	0	0	292.382	4.015	20	30		CIEDRN
COc1cc(NCc2ccc(C#N)c(C)c2)ccc1Cl	ZINC000433200864	330619730	/nfs/dbraw/zinc/61/97/30/330619730.db2.gz	JYZDDVPCXKTHDB-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
CCCC[C@H](CC)CC(=O)Nc1ccc(F)cc1C#N	ZINC000433967863	330633293	/nfs/dbraw/zinc/63/32/93/330633293.db2.gz	NUNRPJLJQLOEEH-LBPRGKRZSA-N	0	0	276.355	4.242	20	30		CIEDRN
CC1(C)CCCN(C(=O)c2ccc(C3CCC3)cc2)[C@@H]1C#N	ZINC000434017241	330634199	/nfs/dbraw/zinc/63/41/99/330634199.db2.gz	QRLXKYPKJAXSOX-QGZVFWFLSA-N	0	0	296.414	4.108	20	30		CIEDRN
CC1(C)CCCN(C(=O)CC/C=C\c2ccccc2)[C@@H]1C#N	ZINC000434038369	330634818	/nfs/dbraw/zinc/63/48/18/330634818.db2.gz	UALSSJJIVUYPOR-ACAQERRYSA-N	0	0	296.414	4.021	20	30		CIEDRN
C[C@H](CCC(=O)N1CCCC(C)(C)[C@H]1C#N)c1ccccc1	ZINC000434039017	330634859	/nfs/dbraw/zinc/63/48/59/330634859.db2.gz	WPGXTWGSCHIXNF-NVXWUHKLSA-N	0	0	298.430	4.111	20	30		CIEDRN
C=CCCCC(=O)N1CC[C@](C)(CCc2ccccc2)C1	ZINC000434254680	330637515	/nfs/dbraw/zinc/63/75/15/330637515.db2.gz	RFOVSXQCCNDGFV-IBGZPJMESA-N	0	0	285.431	4.214	20	30		CIEDRN
C=CCC[C@H](NC(=O)CCc1ccc(C)o1)c1ccccc1	ZINC000435292257	330652521	/nfs/dbraw/zinc/65/25/21/330652521.db2.gz	XGYQMJLAYQNRGX-SFHVURJKSA-N	0	0	297.398	4.344	20	30		CIEDRN
C=CCC[C@H](NC(=O)c1cccs1)c1ccccc1	ZINC000435301293	330652623	/nfs/dbraw/zinc/65/26/23/330652623.db2.gz	VYVRKDBOQBTPRO-AWEZNQCLSA-N	0	0	271.385	4.185	20	30		CIEDRN
C=CCC[C@@H](NC(=O)N(C)[C@@H](C)C(C)C)c1ccccc1	ZINC000435758102	330662264	/nfs/dbraw/zinc/66/22/64/330662264.db2.gz	DPUVHGMSSFATPE-DOTOQJQBSA-N	0	0	288.435	4.380	20	30		CIEDRN
CCCCc1noc(CSCCCCC(C)(C)C#N)n1	ZINC000435881713	330664313	/nfs/dbraw/zinc/66/43/13/330664313.db2.gz	BSCMDBPONBCONP-UHFFFAOYSA-N	0	0	295.452	4.365	20	30		CIEDRN
CC[C@H](C#N)N[C@@H](C)c1ccc(-c2csc(C)n2)cc1	ZINC000435931934	330666029	/nfs/dbraw/zinc/66/60/29/330666029.db2.gz	ANFXTECGEFGCDB-XHDPSFHLSA-N	0	0	285.416	4.071	20	30		CIEDRN
C=CC(C)(C)C(=O)Nc1ccc(OC(F)F)c(Cl)c1	ZINC000448570411	330671256	/nfs/dbraw/zinc/67/12/56/330671256.db2.gz	UPHKENNFESPHJL-UHFFFAOYSA-N	0	0	289.709	4.092	20	30		CIEDRN
Cc1c(Cl)cnc(N[C@H](C)c2ccccc2)c1C#N	ZINC000436831644	330686272	/nfs/dbraw/zinc/68/62/72/330686272.db2.gz	FTSUCJRJGPMRHH-LLVKDONJSA-N	0	0	271.751	4.088	20	30		CIEDRN
C=CCC[C@@H](CC)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000437137467	330694562	/nfs/dbraw/zinc/69/45/62/330694562.db2.gz	NLDFUNDVQBZIPH-MRXNPFEDSA-N	0	0	286.419	4.079	20	30		CIEDRN
CC(C)(C)C1CCC(C#N)(NC(=O)C2=CCCCC2)CC1	ZINC000438444672	330724569	/nfs/dbraw/zinc/72/45/69/330724569.db2.gz	ALQLUUKTPMJPLJ-UHFFFAOYSA-N	0	0	288.435	4.102	20	30		CIEDRN
C=CCN(CC=C)C(=O)Nc1ccc(C(F)(F)F)c(C)c1	ZINC000438510120	330726547	/nfs/dbraw/zinc/72/65/47/330726547.db2.gz	BYZIKUWFVJOOBZ-UHFFFAOYSA-N	0	0	298.308	4.220	20	30		CIEDRN
C=CCCOCCCCC(=O)Nc1ccsc1Cl	ZINC000438565584	330727348	/nfs/dbraw/zinc/72/73/48/330727348.db2.gz	BZYZMGXIVSCQJR-UHFFFAOYSA-N	0	0	287.812	4.103	20	30		CIEDRN
CCOc1ccccc1OCCSc1ccccc1C#N	ZINC000439695397	330742088	/nfs/dbraw/zinc/74/20/88/330742088.db2.gz	FCFPLWHYGOMHGN-UHFFFAOYSA-N	0	0	299.395	4.128	20	30		CIEDRN
N#Cc1ccccc1SCc1ccc2c(c1)CCC2	ZINC000439713795	330742327	/nfs/dbraw/zinc/74/23/27/330742327.db2.gz	ACQYULSDSNXZNH-UHFFFAOYSA-N	0	0	265.381	4.339	20	30		CIEDRN
C=CCN(CC=C)Cc1csc(CCc2ccccc2)n1	ZINC000440317601	330747291	/nfs/dbraw/zinc/74/72/91/330747291.db2.gz	RNFZXOSGHSOOEG-UHFFFAOYSA-N	0	0	298.455	4.102	20	30		CIEDRN
C=CCN(C)C(=O)Nc1ccc2nc(C(C)C)sc2c1	ZINC000156898821	330749811	/nfs/dbraw/zinc/74/98/11/330749811.db2.gz	FUCVODVQZWMXMA-UHFFFAOYSA-N	0	0	289.404	4.069	20	30		CIEDRN
CC(C)(C#N)c1ccccc1CN(C#N)c1ccc(F)cc1	ZINC000440588660	330751529	/nfs/dbraw/zinc/75/15/29/330751529.db2.gz	MMKKFPYBDXAQAC-UHFFFAOYSA-N	0	0	293.345	4.115	20	30		CIEDRN
COc1cc(CNc2ccc(CSC)cc2)ccc1C#N	ZINC000440622173	330752798	/nfs/dbraw/zinc/75/27/98/330752798.db2.gz	SIPUZPWCXHJNOQ-UHFFFAOYSA-N	0	0	298.411	4.042	20	30		CIEDRN
C=CCC[C@@H](NC(=O)C1CC1)c1ccc(C(F)(F)F)cc1	ZINC000441551763	330770710	/nfs/dbraw/zinc/77/07/10/330770710.db2.gz	NUMRMXGNHBARCJ-CQSZACIVSA-N	0	0	297.320	4.239	20	30		CIEDRN
C=CCC1(C(=O)N(C)Cc2cccc(C#N)c2)CCCCC1	ZINC000448662830	330773416	/nfs/dbraw/zinc/77/34/16/330773416.db2.gz	DMSDHZMYYVUHSD-UHFFFAOYSA-N	0	0	296.414	4.043	20	30		CIEDRN
CCc1cc(C#N)ccc1OCc1ccn(C2CCCC2)n1	ZINC000442091553	330773890	/nfs/dbraw/zinc/77/38/90/330773890.db2.gz	PDQNJNPOXYHTGZ-UHFFFAOYSA-N	0	0	295.386	4.011	20	30		CIEDRN
C[C@@H]1CCN(CC2(C#N)CCC2)c2ccccc2S1	ZINC000450507882	330775107	/nfs/dbraw/zinc/77/51/07/330775107.db2.gz	VZQBUBVXSNSJSL-CYBMUJFWSA-N	0	0	272.417	4.071	20	30		CIEDRN
CN(CC(C)(C)C#N)c1ccnc2cc(F)c(Cl)cc21	ZINC000450542595	330775779	/nfs/dbraw/zinc/77/57/79/330775779.db2.gz	UYSFWAOBEOQXOR-UHFFFAOYSA-N	0	0	291.757	4.013	20	30		CIEDRN
Cc1ncc(-c2ccccc2)cc1N[C@@H]1CC[C@H](C#N)C1	ZINC000442833220	330785841	/nfs/dbraw/zinc/78/58/41/330785841.db2.gz	BQCSPXKQHWSGGU-WMLDXEAASA-N	0	0	277.371	4.161	20	30		CIEDRN
N#CC1(CSCc2ccc(Cl)c(F)c2)CC1	ZINC000443145854	330795713	/nfs/dbraw/zinc/79/57/13/330795713.db2.gz	NRDUQYIPMKSNMC-UHFFFAOYSA-N	0	0	255.745	4.016	20	30		CIEDRN
N#Cc1ccc(OCCNc2cccc3ccsc32)cc1	ZINC000443462273	330799964	/nfs/dbraw/zinc/79/99/64/330799964.db2.gz	HEBOVQIYOKQHCI-UHFFFAOYSA-N	0	0	294.379	4.264	20	30		CIEDRN
CC#CCNC(=O)Nc1ccc(C(C)C)cc1C(C)C	ZINC000443573916	330801688	/nfs/dbraw/zinc/80/16/88/330801688.db2.gz	YMQBXAROJITYSW-UHFFFAOYSA-N	0	0	272.392	4.078	20	30		CIEDRN
CC(C)[C@@H](C)CC(=O)Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000443881128	330807106	/nfs/dbraw/zinc/80/71/06/330807106.db2.gz	GVBWXQJIWVMSFD-JTQLQIEISA-N	0	0	298.308	4.198	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N(C)Cc1cc(C)ccc1F	ZINC000444134459	330810454	/nfs/dbraw/zinc/81/04/54/330810454.db2.gz	VWSAROWYBOFCLN-CQSZACIVSA-N	0	0	292.398	4.020	20	30		CIEDRN
CC(C)(C#N)CCCCN1CCc2cc(F)c(F)cc21	ZINC000444638568	330816039	/nfs/dbraw/zinc/81/60/39/330816039.db2.gz	JNTDRYLXRIMIGK-UHFFFAOYSA-N	0	0	278.346	4.047	20	30		CIEDRN
CCN(CCCCC(C)(C)C#N)c1ccccc1OC	ZINC000444655274	330816976	/nfs/dbraw/zinc/81/69/76/330816976.db2.gz	STWOZYFRNTXAFO-UHFFFAOYSA-N	0	0	274.408	4.242	20	30		CIEDRN
CN1CCCN(CCCCC(C)(C)C#N)c2ccccc21	ZINC000444675623	330818459	/nfs/dbraw/zinc/81/84/59/330818459.db2.gz	MORNEJQGESRFAY-UHFFFAOYSA-N	0	0	285.435	4.053	20	30		CIEDRN
C=CCCO[C@@H](C)c1nc(-c2oc3ccccc3c2C)no1	ZINC000445507494	330830229	/nfs/dbraw/zinc/83/02/29/330830229.db2.gz	YWVVGJYBBLKQEO-LBPRGKRZSA-N	0	0	298.342	4.445	20	30		CIEDRN
Cc1cscc1-c1noc(/C=C\c2ccccc2C#N)n1	ZINC000445626310	330833279	/nfs/dbraw/zinc/83/32/79/330833279.db2.gz	HHLNFENKUBEGAM-SREVYHEPSA-N	0	0	293.351	4.149	20	30		CIEDRN
CC(C)[C@@H](CC(F)(F)F)Nc1cccc(F)c1C#N	ZINC000445663812	330834266	/nfs/dbraw/zinc/83/42/66/330834266.db2.gz	ZVWFZILBXUZITL-GFCCVEGCSA-N	0	0	274.261	4.086	20	30		CIEDRN
CCC1(c2noc(-c3ccc(CC#N)cc3)n2)CCCC1	ZINC000445802059	330837422	/nfs/dbraw/zinc/83/74/22/330837422.db2.gz	JZTPTCYTGMDODJ-UHFFFAOYSA-N	0	0	281.359	4.024	20	30		CIEDRN
C=CCCCc1nc(-c2ccc(C)c(N3CCCC3)c2)no1	ZINC000445816186	330838278	/nfs/dbraw/zinc/83/82/78/330838278.db2.gz	UAQZCUJHFDDKDB-UHFFFAOYSA-N	0	0	297.402	4.154	20	30		CIEDRN
Cc1cc(C#N)ccc1C(=O)N[C@@H](C)c1ccccc1Cl	ZINC000159510464	330848582	/nfs/dbraw/zinc/84/85/82/330848582.db2.gz	XQIMELJVOPUZCH-LBPRGKRZSA-N	0	0	298.773	4.011	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N(C)C1CCC(C)(C)CC1	ZINC000446913437	330857729	/nfs/dbraw/zinc/85/77/29/330857729.db2.gz	TYDZFGZEGWTIMF-UHFFFAOYSA-N	0	0	299.418	4.299	20	30		CIEDRN
C=CCOc1ccc(CNc2ccc(F)c(OC)c2)cc1	ZINC000160066884	330857959	/nfs/dbraw/zinc/85/79/59/330857959.db2.gz	CWLCZGWOXSIMTK-UHFFFAOYSA-N	0	0	287.334	4.011	20	30		CIEDRN
Cc1cc(C)c(C#N)c(SCc2ccc(C#N)c(C)c2)n1	ZINC000447312416	330864322	/nfs/dbraw/zinc/86/43/22/330864322.db2.gz	MOMSJUIGQYPWEV-UHFFFAOYSA-N	0	0	293.395	4.043	20	30		CIEDRN
CC(C)c1nc2ccccc2c(SCC2(C#N)CC2)n1	ZINC000447328612	330865024	/nfs/dbraw/zinc/86/50/24/330865024.db2.gz	AQPNRVIENROPTQ-UHFFFAOYSA-N	0	0	283.400	4.149	20	30		CIEDRN
CC(C)N(C(=O)CC(C)(C)C#N)c1ccc(Cl)cc1	ZINC000447340922	330865144	/nfs/dbraw/zinc/86/51/44/330865144.db2.gz	MPCSEHBTFJUSBV-UHFFFAOYSA-N	0	0	278.783	4.021	20	30		CIEDRN
COCC[C@H](C)Sc1nc(-c2ccccc2)ccc1C#N	ZINC000447349443	330865370	/nfs/dbraw/zinc/86/53/70/330865370.db2.gz	FRMNTNJRJVFUIK-ZDUSSCGKSA-N	0	0	298.411	4.137	20	30		CIEDRN
Cc1cc(C#N)ccc1C(=O)Nc1ccccc1C(C)C	ZINC000160569876	330867432	/nfs/dbraw/zinc/86/74/32/330867432.db2.gz	LYYNJLJWWURDKC-UHFFFAOYSA-N	0	0	278.355	4.242	20	30		CIEDRN
CCCCn1ncc(N[C@@H](CC)c2ccc(C#N)cc2)c1C	ZINC000447602753	330873335	/nfs/dbraw/zinc/87/33/35/330873335.db2.gz	UABFJRUVGAQQLK-KRWDZBQOSA-N	0	0	296.418	4.427	20	30		CIEDRN
Cc1cccc(OCc2cccc(C#N)c2)c1Cl	ZINC000447776521	330876454	/nfs/dbraw/zinc/87/64/54/330876454.db2.gz	JAKWJWITDARKDB-UHFFFAOYSA-N	0	0	257.720	4.099	20	30		CIEDRN
C=CCCCNC(=O)N[C@@H](C)c1ccc(SCC)cc1	ZINC000447977374	330882034	/nfs/dbraw/zinc/88/20/34/330882034.db2.gz	NBHGDNOVDUTNLR-ZDUSSCGKSA-N	0	0	292.448	4.125	20	30		CIEDRN
C=CCCCNC(=O)N[C@@H](CC)c1cccc(Cl)c1	ZINC000447983263	330882131	/nfs/dbraw/zinc/88/21/31/330882131.db2.gz	QFQMVBPLPYIRTG-AWEZNQCLSA-N	0	0	280.799	4.057	20	30		CIEDRN
CC(C)c1cccc(N(C)C(=O)[C@]2(C#N)CC23CCCC3)c1	ZINC000448795626	330884073	/nfs/dbraw/zinc/88/40/73/330884073.db2.gz	QFWJOMXRIYUOMJ-LJQANCHMSA-N	0	0	296.414	4.247	20	30		CIEDRN
CC[C@@H]1CCC[C@H]1C(=O)N(Cc1ccc(C#N)cc1)C(C)C	ZINC000448818640	330884819	/nfs/dbraw/zinc/88/48/19/330884819.db2.gz	NWWFNWZSEIAOEU-QZTJIDSGSA-N	0	0	298.430	4.122	20	30		CIEDRN
CC(C)CCCC(=O)N(Cc1ccc(C#N)cc1)C(C)C	ZINC000448821622	330884894	/nfs/dbraw/zinc/88/48/94/330884894.db2.gz	HJUSESQMKDSKLC-UHFFFAOYSA-N	0	0	286.419	4.122	20	30		CIEDRN
C=CC(C)(C)C(=O)N1CCc2c(Cl)c(Cl)ccc2C1	ZINC000448863339	330886192	/nfs/dbraw/zinc/88/61/92/330886192.db2.gz	ALKJKFBLUIVCIP-UHFFFAOYSA-N	0	0	298.213	4.090	20	30		CIEDRN
CCOc1cc(NC2CCC(C)(C#N)CC2)ccc1C	ZINC000449053339	330895547	/nfs/dbraw/zinc/89/55/47/330895547.db2.gz	KGONUMYBBHRXQK-UHFFFAOYSA-N	0	0	272.392	4.278	20	30		CIEDRN
CC1(C#N)CCC(Nc2ccc3ncccc3c2)CC1	ZINC000449225490	330907461	/nfs/dbraw/zinc/90/74/61/330907461.db2.gz	UCOUEFPQDLXEKY-UHFFFAOYSA-N	0	0	265.360	4.119	20	30		CIEDRN
C=CCC1(C(=O)N[C@H](C)c2cccc(OC)c2)CCCC1	ZINC000449431177	330925184	/nfs/dbraw/zinc/92/51/84/330925184.db2.gz	CXFYSKJXJAERRA-CQSZACIVSA-N	0	0	287.403	4.009	20	30		CIEDRN
CC(C)Oc1cccc(NCc2cc(C#N)cs2)c1	ZINC000449468883	330928157	/nfs/dbraw/zinc/92/81/57/330928157.db2.gz	RHLFSTKJPDWXCR-UHFFFAOYSA-N	0	0	272.373	4.019	20	30		CIEDRN
C=CCC1(C(=O)N[C@H](C)c2cc(C)oc2C)CCCC1	ZINC000449811623	330951073	/nfs/dbraw/zinc/95/10/73/330951073.db2.gz	LVIBBCUDJJNZGT-CYBMUJFWSA-N	0	0	275.392	4.210	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H]2CCCC(F)(F)C2)CCCCC1	ZINC000450157917	330963935	/nfs/dbraw/zinc/96/39/35/330963935.db2.gz	PLOCQZCFCKDRDY-CYBMUJFWSA-N	0	0	285.378	4.207	20	30		CIEDRN
N#Cc1ccc(COc2cc(F)cc(F)c2)c(Cl)c1	ZINC000162989054	330972826	/nfs/dbraw/zinc/97/28/26/330972826.db2.gz	SRLHDDJDUUCHBI-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
CC(C)(C)[C@@H]1C[C@H](Nc2cccc(Cl)c2C#N)CCO1	ZINC000450408189	330977114	/nfs/dbraw/zinc/97/71/14/330977114.db2.gz	JBPOLPSZSSJIHC-ABAIWWIYSA-N	0	0	292.810	4.217	20	30		CIEDRN
C=CCC1(C(=O)Nc2cccc(N(C)C)c2C)CCCC1	ZINC000450425206	330978414	/nfs/dbraw/zinc/97/84/14/330978414.db2.gz	SLSHOPDDAVJMSU-UHFFFAOYSA-N	0	0	286.419	4.136	20	30		CIEDRN
N#CC1(COc2ccc(Cl)cc2Cl)CCC1	ZINC000450622857	330989883	/nfs/dbraw/zinc/98/98/83/330989883.db2.gz	OTQZDUJTWUKKNP-UHFFFAOYSA-N	0	0	256.132	4.066	20	30		CIEDRN
C[C@H](Nc1ncccc1C#N)c1cccc(C2CC2)c1	ZINC000450558850	330986412	/nfs/dbraw/zinc/98/64/12/330986412.db2.gz	OKYHZRYWOCTYLH-LBPRGKRZSA-N	0	0	263.344	4.004	20	30		CIEDRN
N#Cc1ccc(-c2ccc(OCC[C@H]3CCOC3)cc2)cc1	ZINC000450619607	330989607	/nfs/dbraw/zinc/98/96/07/330989607.db2.gz	BIDLLSABYIHWBN-MRXNPFEDSA-N	0	0	293.366	4.031	20	30		CIEDRN
C=CC(C)(C)C(=O)N1CC[C@@H](C)C2(CCCCC2)C1	ZINC000450649045	330991268	/nfs/dbraw/zinc/99/12/68/330991268.db2.gz	PPNPEDRACYJJTK-CQSZACIVSA-N	0	0	263.425	4.018	20	30		CIEDRN
C[C@H](NCC1(C#N)CCC1)c1ccc(C(F)(F)F)cc1	ZINC000450672546	330992539	/nfs/dbraw/zinc/99/25/39/330992539.db2.gz	ZXJRSWDHYLKZLV-NSHDSACASA-N	0	0	282.309	4.050	20	30		CIEDRN
N#CC1(CNC2(c3ccc(F)cc3F)CCCC2)CCC1	ZINC000450686071	330993544	/nfs/dbraw/zinc/99/35/44/330993544.db2.gz	UHJMCGCKSHYSCP-UHFFFAOYSA-N	0	0	290.357	4.018	20	30		CIEDRN
CC[C@@H](NCC1(C#N)CCC1)c1ccc(Cl)s1	ZINC000450723530	330995958	/nfs/dbraw/zinc/99/59/58/330995958.db2.gz	DELOYEUSKGRQQL-SNVBAGLBSA-N	0	0	268.813	4.136	20	30		CIEDRN
N#CC1(CSc2ccccc2Br)CCC1	ZINC000450745998	330997554	/nfs/dbraw/zinc/99/75/54/330997554.db2.gz	HMHOODDHYVCFEX-UHFFFAOYSA-N	0	0	282.206	4.235	20	30		CIEDRN
Cn1c2ccc(Cl)cc2nc1SCC1(C#N)CCC1	ZINC000450810536	331000704	/nfs/dbraw/zinc/00/07/04/331000704.db2.gz	MZSYSFSIZZXWTR-UHFFFAOYSA-N	0	0	291.807	4.013	20	30		CIEDRN
N#Cc1ccc(SC[C@H]2CCC(F)(F)C2)c(F)c1	ZINC000450850797	331002838	/nfs/dbraw/zinc/00/28/38/331002838.db2.gz	ZGMKFFSRAOXLBJ-JTQLQIEISA-N	0	0	271.307	4.225	20	30		CIEDRN
N#Cc1c(F)cccc1N1CC2(CCC2)[C@H]1c1ccco1	ZINC000450857124	331003245	/nfs/dbraw/zinc/00/32/45/331003245.db2.gz	ILRUIEUFAFYWFN-MRXNPFEDSA-N	0	0	282.318	4.022	20	30		CIEDRN
CC(=O)CCCCCSc1ccc(C#N)cc1Cl	ZINC000450858775	331003294	/nfs/dbraw/zinc/00/32/94/331003294.db2.gz	AOECLOGUNYPXOJ-UHFFFAOYSA-N	0	0	281.808	4.453	20	30		CIEDRN
N#Cc1ccc(SCC2CC(F)(F)C2)c(Cl)c1	ZINC000450868808	331003821	/nfs/dbraw/zinc/00/38/21/331003821.db2.gz	MZKDZIJYSMCCKP-UHFFFAOYSA-N	0	0	273.735	4.349	20	30		CIEDRN
N#CC1(CSc2cc(Cl)ccc2F)CCC1	ZINC000450961689	331008869	/nfs/dbraw/zinc/00/88/69/331008869.db2.gz	PVJJBAZLKHQVKQ-UHFFFAOYSA-N	0	0	255.745	4.265	20	30		CIEDRN
CC(C)(C#N)c1ccccc1CSc1ncccc1F	ZINC000451051854	331013707	/nfs/dbraw/zinc/01/37/07/331013707.db2.gz	DBPHTESIKUQPCT-UHFFFAOYSA-N	0	0	286.375	4.314	20	30		CIEDRN
N#CC1(CN2CC[C@H](C(F)(F)F)c3ccccc32)CCC1	ZINC000451063133	331014393	/nfs/dbraw/zinc/01/43/93/331014393.db2.gz	LGOKXZHLFGRLCH-ZDUSSCGKSA-N	0	0	294.320	4.236	20	30		CIEDRN
C=CCCCCCN[C@@H](c1nc(C)cs1)C(F)(F)F	ZINC000451130746	331016855	/nfs/dbraw/zinc/01/68/55/331016855.db2.gz	QLOPELCSLYTUGZ-NSHDSACASA-N	0	0	292.370	4.391	20	30		CIEDRN
Cc1cccc(C(C)C)c1NC(=O)Cc1ccc(C#N)cc1	ZINC000194707334	331016863	/nfs/dbraw/zinc/01/68/63/331016863.db2.gz	NFSQTHCGFXXGKW-UHFFFAOYSA-N	0	0	292.382	4.171	20	30		CIEDRN
C=CCC1(C(=O)N2CC3(CCC3)C[C@H]2C)CCCCC1	ZINC000451188351	331019507	/nfs/dbraw/zinc/01/95/07/331019507.db2.gz	DIPTXSDOSJRIOM-OAHLLOKOSA-N	0	0	275.436	4.304	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@@H]1C[C@H]1c1ccc2ccccc2c1	ZINC000451397170	331027552	/nfs/dbraw/zinc/02/75/52/331027552.db2.gz	QETWWUUINYJFKG-DLBZAZTESA-N	0	0	279.383	4.024	20	30		CIEDRN
CC(C)CC(CC(C)C)C(=O)NCC1CCC(C#N)CC1	ZINC000451450875	331029935	/nfs/dbraw/zinc/02/99/35/331029935.db2.gz	ZVGGSNIIFZAKAN-UHFFFAOYSA-N	0	0	292.467	4.141	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)C[C@@H]1CC[C@@H]2C[C@@H]21	ZINC000451458207	331030239	/nfs/dbraw/zinc/03/02/39/331030239.db2.gz	OGKLCCPNUNETMB-PMPSAXMXSA-N	0	0	269.388	4.180	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000451627840	331037248	/nfs/dbraw/zinc/03/72/48/331037248.db2.gz	ZGUJVUDWYAXTCA-BBWFWOEESA-N	0	0	271.404	4.041	20	30		CIEDRN
C[C@@H](CCCC(F)(F)F)Nc1ccc(C#N)cc1F	ZINC000163475160	331044367	/nfs/dbraw/zinc/04/43/67/331044367.db2.gz	MDDSQZRZDUFNEG-VIFPVBQESA-N	0	0	274.261	4.230	20	30		CIEDRN
C[C@H](c1cccc(C#N)c1)N1CC2(CCC2)[C@@H]1c1ccco1	ZINC000451856361	331044923	/nfs/dbraw/zinc/04/49/23/331044923.db2.gz	PPEVLWKPJDLJDA-KDOFPFPSSA-N	0	0	292.382	4.439	20	30		CIEDRN
C=CCC1(C(=O)N(C)Cc2c(F)cccc2F)CCCC1	ZINC000452143698	331055865	/nfs/dbraw/zinc/05/58/65/331055865.db2.gz	PHLDAWXIVSCJBO-UHFFFAOYSA-N	0	0	293.357	4.060	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H](C)c1ccc(F)cc1Cl	ZINC000452185337	331057333	/nfs/dbraw/zinc/05/73/33/331057333.db2.gz	LKRPFUAOWBSRMU-SNVBAGLBSA-N	0	0	283.774	4.259	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@]1(C)CC(C)C	ZINC000452513370	331067131	/nfs/dbraw/zinc/06/71/31/331067131.db2.gz	REWBKQRNAHSNBW-ZBFHGGJFSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=CCCC(=O)N[C@H](c1ccc(F)c(Cl)c1)C1CC1	ZINC000452586836	331069643	/nfs/dbraw/zinc/06/96/43/331069643.db2.gz	FCXSQODDTPZTOL-HNNXBMFYSA-N	0	0	281.758	4.013	20	30		CIEDRN
N#CCc1ccc(NC(=O)C2CCCCCC2)c(Cl)c1	ZINC000452643747	331070820	/nfs/dbraw/zinc/07/08/20/331070820.db2.gz	KDROYDJBNUKMPF-UHFFFAOYSA-N	0	0	290.794	4.315	20	30		CIEDRN
CC(C)[C@]1(C)C[C@@H]1C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452644244	331070925	/nfs/dbraw/zinc/07/09/25/331070925.db2.gz	BNWDEQGHFWUNEC-WBMJQRKESA-N	0	0	290.794	4.027	20	30		CIEDRN
CCC(CC)[C@H](C)C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452646337	331070968	/nfs/dbraw/zinc/07/09/68/331070968.db2.gz	QCJQFUUHDXGBPF-NSHDSACASA-N	0	0	292.810	4.417	20	30		CIEDRN
CCC[C@@H](C(=O)Nc1ccc(CC#N)cc1Cl)C(C)C	ZINC000452645882	331070980	/nfs/dbraw/zinc/07/09/80/331070980.db2.gz	PHLREVJDWRWRAK-CYBMUJFWSA-N	0	0	292.810	4.417	20	30		CIEDRN
CC(C)[C@]1(C)C[C@H]1C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452644242	331070990	/nfs/dbraw/zinc/07/09/90/331070990.db2.gz	BNWDEQGHFWUNEC-LRDDRELGSA-N	0	0	290.794	4.027	20	30		CIEDRN
CC[C@@H](C)CCC(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452649453	331071011	/nfs/dbraw/zinc/07/10/11/331071011.db2.gz	KBMFMRIJHVIYMN-LLVKDONJSA-N	0	0	278.783	4.171	20	30		CIEDRN
CC[C@H](C)[C@@H](C)C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452648105	331071057	/nfs/dbraw/zinc/07/10/57/331071057.db2.gz	UJUXUZLVLUQUOL-WDEREUQCSA-N	0	0	278.783	4.027	20	30		CIEDRN
CC[C@H](C)[C@H](C)C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452648103	331071058	/nfs/dbraw/zinc/07/10/58/331071058.db2.gz	UJUXUZLVLUQUOL-QWRGUYRKSA-N	0	0	278.783	4.027	20	30		CIEDRN
CC[C@@H](C)[C@@H](C)C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452648100	331071068	/nfs/dbraw/zinc/07/10/68/331071068.db2.gz	UJUXUZLVLUQUOL-GHMZBOCLSA-N	0	0	278.783	4.027	20	30		CIEDRN
CC1(CC(=O)Nc2ccc(CC#N)cc2Cl)CCCC1	ZINC000452652817	331071276	/nfs/dbraw/zinc/07/12/76/331071276.db2.gz	NROYAEIQEAQTFR-UHFFFAOYSA-N	0	0	290.794	4.315	20	30		CIEDRN
CCCC[C@H](C)C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452657221	331071305	/nfs/dbraw/zinc/07/13/05/331071305.db2.gz	VMJWGJKMNNQZME-NSHDSACASA-N	0	0	278.783	4.171	20	30		CIEDRN
CCCC[C@@H](C)C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452657220	331071336	/nfs/dbraw/zinc/07/13/36/331071336.db2.gz	VMJWGJKMNNQZME-LLVKDONJSA-N	0	0	278.783	4.171	20	30		CIEDRN
C=C(C)CCNC(=O)[C@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1	ZINC000452715050	331072769	/nfs/dbraw/zinc/07/27/69/331072769.db2.gz	BNULOBLZAUXZEQ-KGLIPLIRSA-N	0	0	298.213	4.179	20	30		CIEDRN
C=C(C)CCNC(=O)[C@H]1C[C@H]1c1ccc2ccccc2c1	ZINC000452722141	331073900	/nfs/dbraw/zinc/07/39/00/331073900.db2.gz	JAHSTFKGTJNBBL-ROUUACIJSA-N	0	0	279.383	4.026	20	30		CIEDRN
C=C(C)CCNC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000452728281	331074480	/nfs/dbraw/zinc/07/44/80/331074480.db2.gz	DCDYHMNWEBFZSC-JSGCOSHPSA-N	0	0	295.785	4.055	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@@H](Cc2ccccc2)[C@@H]1C	ZINC000467330388	331075307	/nfs/dbraw/zinc/07/53/07/331075307.db2.gz	PIZDLZGERVOLIO-LPHOPBHVSA-N	0	0	297.442	4.235	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1Cc2cccc(C)c2CC1(C)C	ZINC000452930904	331081083	/nfs/dbraw/zinc/08/10/83/331081083.db2.gz	HNCSEGVJZWKKMS-OAHLLOKOSA-N	0	0	285.431	4.261	20	30		CIEDRN
C=CCC1(c2nc(-c3cccnc3C)no2)CCCCC1	ZINC000453173393	331097050	/nfs/dbraw/zinc/09/70/50/331097050.db2.gz	ABQWCAJTEJTGST-UHFFFAOYSA-N	0	0	283.375	4.218	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ccc(C(C)(F)F)nc2)n1	ZINC000453192232	331099600	/nfs/dbraw/zinc/09/96/00/331099600.db2.gz	YTNFWBXPRHBSDL-UHFFFAOYSA-N	0	0	293.317	4.097	20	30		CIEDRN
C=CCOCc1nc(C2CCC(c3ccccc3)CC2)no1	ZINC000453196011	331100069	/nfs/dbraw/zinc/10/00/69/331100069.db2.gz	LALUNZBVLDXBPP-UHFFFAOYSA-N	0	0	298.386	4.214	20	30		CIEDRN
C=CCC1(c2nc([C@H]3CSc4ccccc43)no2)CCC1	ZINC000453213915	331102103	/nfs/dbraw/zinc/10/21/03/331102103.db2.gz	HFVRXGWKUDUJAV-ZDUSSCGKSA-N	0	0	298.411	4.305	20	30		CIEDRN
C=CCCCC[C@@H](C)Nc1ccc(F)c(NC(=O)NC)c1	ZINC000453215802	331102345	/nfs/dbraw/zinc/10/23/45/331102345.db2.gz	SHLXRRQSNLZSIE-GFCCVEGCSA-N	0	0	293.386	4.124	20	30		CIEDRN
CCC[C@H](OC)c1noc(-c2ccc(C(C)(C)C#N)cc2)n1	ZINC000453232488	331104751	/nfs/dbraw/zinc/10/47/51/331104751.db2.gz	VWSZDOOFSPFLNV-AWEZNQCLSA-N	0	0	299.374	4.025	20	30		CIEDRN
CCC[C@@H](OC)c1noc(-c2ccc(C(C)(C)C#N)cc2)n1	ZINC000453232489	331104800	/nfs/dbraw/zinc/10/48/00/331104800.db2.gz	VWSZDOOFSPFLNV-CQSZACIVSA-N	0	0	299.374	4.025	20	30		CIEDRN
C=CCCc1noc([C@@H](C)Sc2ccc(C)cc2)n1	ZINC000453247644	331107116	/nfs/dbraw/zinc/10/71/16/331107116.db2.gz	ODAWHLFKVZNVOV-GFCCVEGCSA-N	0	0	274.389	4.350	20	30		CIEDRN
C=CCCc1noc([C@H]2C[C@H]2c2cccc(Cl)c2)n1	ZINC000453247626	331107132	/nfs/dbraw/zinc/10/71/32/331107132.db2.gz	OBDGUPSLUHQYJG-STQMWFEESA-N	0	0	274.751	4.113	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Nc1c(C)cccc1OC	ZINC000194996338	331116960	/nfs/dbraw/zinc/11/69/60/331116960.db2.gz	ZUTITCJKOIIXSS-UHFFFAOYSA-N	0	0	290.407	4.214	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1C[C@@H](c2ccc(C)cc2)C[C@@H]1C	ZINC000470585432	331139281	/nfs/dbraw/zinc/13/92/81/331139281.db2.gz	WTADPOGQWLXOSJ-VDZJLULYSA-N	0	0	285.431	4.302	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N1C[C@H](C(C)C)[C@H]1C(C)C	ZINC000454644906	331150334	/nfs/dbraw/zinc/15/03/34/331150334.db2.gz	OSMCNDKHPSIBFB-NVXWUHKLSA-N	0	0	299.418	4.011	20	30		CIEDRN
C=CC(C)(C)CNC(=O)N(C)[C@@H](C)c1ccccc1Cl	ZINC000455371493	331167585	/nfs/dbraw/zinc/16/75/85/331167585.db2.gz	SJYHWMUIBZYPAZ-LBPRGKRZSA-N	0	0	294.826	4.255	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CCC(CF)CC1	ZINC000455381101	331167916	/nfs/dbraw/zinc/16/79/16/331167916.db2.gz	JCPAMCVMWMVEHR-UHFFFAOYSA-N	0	0	290.382	4.019	20	30		CIEDRN
C=C(CC)CNC(=O)N(C)[C@@H](C)c1cccc(Cl)c1	ZINC000455527711	331172310	/nfs/dbraw/zinc/17/23/10/331172310.db2.gz	VUFUPHMRHVIIOL-LBPRGKRZSA-N	0	0	280.799	4.009	20	30		CIEDRN
C=CCCCCCSc1nnc(C2CC2)s1	ZINC000195442198	331174590	/nfs/dbraw/zinc/17/45/90/331174590.db2.gz	NRIJZBRSIRSNOD-UHFFFAOYSA-N	0	0	254.424	4.254	20	30		CIEDRN
CCC(C)(CC)NC(=O)Nc1ccc(CC#N)cc1Cl	ZINC000455697321	331175692	/nfs/dbraw/zinc/17/56/92/331175692.db2.gz	DQEALLKGAZPUFC-UHFFFAOYSA-N	0	0	293.798	4.106	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1ccc(C)nc1C1CC1	ZINC000455726306	331176331	/nfs/dbraw/zinc/17/63/31/331176331.db2.gz	TYPKGILGFDYGFU-UHFFFAOYSA-N	0	0	286.419	4.086	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1cccc(OC(C)C)c1	ZINC000455782569	331177664	/nfs/dbraw/zinc/17/76/64/331177664.db2.gz	NDCSQDQXYNMIEB-HNNXBMFYSA-N	0	0	288.391	4.046	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1cccc(OC(C)C)c1	ZINC000455782570	331177697	/nfs/dbraw/zinc/17/76/97/331177697.db2.gz	NDCSQDQXYNMIEB-OAHLLOKOSA-N	0	0	288.391	4.046	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1scnc1C(C)C	ZINC000455863553	331179187	/nfs/dbraw/zinc/17/91/87/331179187.db2.gz	KQMPMGRIAQMHCY-NSHDSACASA-N	0	0	281.425	4.133	20	30		CIEDRN
C=CCC1(CNC(=O)Nc2cccc(CC#N)c2)CCCC1	ZINC000455904136	331180152	/nfs/dbraw/zinc/18/01/52/331180152.db2.gz	JVRRJUDVHULLTO-UHFFFAOYSA-N	0	0	297.402	4.011	20	30		CIEDRN
CC[C@H](C)[C@@H]1CCCCN1C(=O)Nc1cccc(CC#N)c1	ZINC000455909409	331180494	/nfs/dbraw/zinc/18/04/94/331180494.db2.gz	BKYGBHMOTUQATG-YOEHRIQHSA-N	0	0	299.418	4.185	20	30		CIEDRN
C[C@@H](c1cccs1)N(C)C(=O)Nc1cccc(CC#N)c1	ZINC000455914680	331180925	/nfs/dbraw/zinc/18/09/25/331180925.db2.gz	HEDINKOUXBSUND-LBPRGKRZSA-N	0	0	299.399	4.039	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1ccc([C@H](C)C(F)(F)F)cc1	ZINC000456011325	331182413	/nfs/dbraw/zinc/18/24/13/331182413.db2.gz	DOBIXZXYFGJOCO-FZMZJTMJSA-N	0	0	299.336	4.437	20	30		CIEDRN
CC[C@@H](NC(=O)Nc1cc(C)cc(C#N)c1)c1cccs1	ZINC000456016173	331182514	/nfs/dbraw/zinc/18/25/14/331182514.db2.gz	YXVQOUGJBWQOSL-CQSZACIVSA-N	0	0	299.399	4.201	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cc(OCC)ccc1Cl	ZINC000456043716	331183212	/nfs/dbraw/zinc/18/32/12/331183212.db2.gz	KEDXMEFTOMARIY-UHFFFAOYSA-N	0	0	293.794	4.446	20	30		CIEDRN
CC(C)=CCC[C@@H](C)NC(=O)[C@@H](C#N)CCc1ccccc1	ZINC000456050368	331183376	/nfs/dbraw/zinc/18/33/76/331183376.db2.gz	GCIXKQBTHSAPHR-SJLPKXTDSA-N	0	0	298.430	4.010	20	30		CIEDRN
CC(C)=CCC[C@H](C)NC(=O)[C@@H](C#N)CCc1ccccc1	ZINC000456050364	331183398	/nfs/dbraw/zinc/18/33/98/331183398.db2.gz	GCIXKQBTHSAPHR-FUHWJXTLSA-N	0	0	298.430	4.010	20	30		CIEDRN
C=C(C)CCNC(=O)c1c(Cl)cc(Cl)cc1Cl	ZINC000456124808	331185087	/nfs/dbraw/zinc/18/50/87/331185087.db2.gz	UFAHBWHHTZRTBU-UHFFFAOYSA-N	0	0	292.593	4.343	20	30		CIEDRN
C=CCC1(NC(=O)[C@H](C)c2ccsc2)CCCCC1	ZINC000456365346	331191206	/nfs/dbraw/zinc/19/12/06/331191206.db2.gz	KYOLGQUSBWVNOF-CYBMUJFWSA-N	0	0	277.433	4.247	20	30		CIEDRN
C=CCC1(NC(=O)c2ccccc2SC)CCCCC1	ZINC000456381518	331191872	/nfs/dbraw/zinc/19/18/72/331191872.db2.gz	MGVREYMJUZGICK-UHFFFAOYSA-N	0	0	289.444	4.417	20	30		CIEDRN
C=CCC1(CNC(=O)c2cc[nH]c2C(C)C)CCCC1	ZINC000456501164	331194477	/nfs/dbraw/zinc/19/44/77/331194477.db2.gz	FGSWCTUCGZNJNQ-UHFFFAOYSA-N	0	0	274.408	4.004	20	30		CIEDRN
N#CCC[C@H](Nc1nccc2occc21)c1ccccc1	ZINC000164301922	331196917	/nfs/dbraw/zinc/19/69/17/331196917.db2.gz	RWHNCRAKTCJMKQ-HNNXBMFYSA-N	0	0	277.327	4.285	20	30		CIEDRN
CC[C@@H](NC(=O)c1ccc(C(C)(C)C#N)cc1)C1CCCC1	ZINC000456659283	331198420	/nfs/dbraw/zinc/19/84/20/331198420.db2.gz	LXDRFDRRCNACBK-QGZVFWFLSA-N	0	0	298.430	4.186	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NC1(Cc2cccc(Cl)c2)CC1	ZINC000456722200	331199139	/nfs/dbraw/zinc/19/91/39/331199139.db2.gz	GIYRGJPHCZNEKV-CYBMUJFWSA-N	0	0	291.822	4.134	20	30		CIEDRN
Cc1ccc(CCCC(=O)Nc2cccc(CC#N)c2)cc1	ZINC000456737519	331199586	/nfs/dbraw/zinc/19/95/86/331199586.db2.gz	SHTYEXQDICJWEJ-UHFFFAOYSA-N	0	0	292.382	4.023	20	30		CIEDRN
CC(C)(C#N)CC(=O)NC[C@H]1CCCC[C@@H]1c1ccccc1	ZINC000456773042	331202546	/nfs/dbraw/zinc/20/25/46/331202546.db2.gz	PMAQCVQEQIUVKD-IAGOWNOFSA-N	0	0	298.430	4.016	20	30		CIEDRN
C=C(CC)CNC(=O)[C@H]1C[C@@H]1c1cccc2ccccc21	ZINC000456831938	331206770	/nfs/dbraw/zinc/20/67/70/331206770.db2.gz	VPTQIYBSJCDQBT-MSOLQXFVSA-N	0	0	279.383	4.026	20	30		CIEDRN
C=CCCCc1nc(-c2ccccc2Br)no1	ZINC000460136686	331208267	/nfs/dbraw/zinc/20/82/67/331208267.db2.gz	GBDPZNNRWXAGIQ-UHFFFAOYSA-N	0	0	293.164	4.008	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@](C)(Cc1ccccc1)C1CC1	ZINC000457052113	331210978	/nfs/dbraw/zinc/21/09/78/331210978.db2.gz	SUGDMONFXRKPBN-KXBFYZLASA-N	0	0	285.431	4.116	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@H]1CC[C@@H](c2cccc(Cl)c2)C1	ZINC000457066116	331211218	/nfs/dbraw/zinc/21/12/18/331211218.db2.gz	GSOUQPNJCRRWAT-HIFRSBDPSA-N	0	0	291.822	4.305	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@@H]1CC[C@H](c2cccc(Cl)c2)C1	ZINC000457066115	331211243	/nfs/dbraw/zinc/21/12/43/331211243.db2.gz	GSOUQPNJCRRWAT-DZGCQCFKSA-N	0	0	291.822	4.305	20	30		CIEDRN
CC(C)N(C(=O)[C@H](C)c1cccc(C#N)c1)C1CC(C)(C)C1	ZINC000457069413	331211313	/nfs/dbraw/zinc/21/13/13/331211313.db2.gz	FTTVOHJVFSBZPZ-CQSZACIVSA-N	0	0	298.430	4.087	20	30		CIEDRN
C=CCCOCCCCC(=O)N1CC[C@@H](CC(C)(C)C)C1	ZINC000457093113	331212054	/nfs/dbraw/zinc/21/20/54/331212054.db2.gz	UKLJUXIMTVECSL-INIZCTEOSA-N	0	0	295.467	4.034	20	30		CIEDRN
C=CCCC1(C(=O)N2CC3(CCCC3)[C@@H]2C(C)C)CC1	ZINC000457134855	331212779	/nfs/dbraw/zinc/21/27/79/331212779.db2.gz	FPEMZNFNYMBHOB-HNNXBMFYSA-N	0	0	275.436	4.160	20	30		CIEDRN
CC[C@]1(C(C)C)C[C@@H]1NC(=O)C[C@H](CC#N)c1ccccc1	ZINC000457308565	331218665	/nfs/dbraw/zinc/21/86/65/331218665.db2.gz	WKTOKOGAENFTMM-JENIJYKNSA-N	0	0	298.430	4.015	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1Cc2sccc2CC1(C)C	ZINC000457317967	331218882	/nfs/dbraw/zinc/21/88/82/331218882.db2.gz	IJKLITQWAZOBEK-UHFFFAOYSA-N	0	0	289.444	4.180	20	30		CIEDRN
C[C@@H](CC(F)(F)F)C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000457431112	331222724	/nfs/dbraw/zinc/22/27/24/331222724.db2.gz	YKMBGRZBBJOMML-JTQLQIEISA-N	0	0	298.308	4.015	20	30		CIEDRN
C=CCC[C@H](NC(=O)[C@@H](CC)CC(F)F)c1ccccc1	ZINC000457681308	331231065	/nfs/dbraw/zinc/23/10/65/331231065.db2.gz	PZOFRTFNTFSFPE-ZFWWWQNUSA-N	0	0	295.373	4.492	20	30		CIEDRN
C=C(C)[C@H](NC(=O)[C@@H](C)C1CCC1)c1ccc(F)c(F)c1	ZINC000457719256	331232328	/nfs/dbraw/zinc/23/23/28/331232328.db2.gz	QRSZSWBDAOYMBJ-ZBEGNZNMSA-N	0	0	293.357	4.134	20	30		CIEDRN
C=CC[C@H]1N(C(=O)[C@@H](C)CC(F)(F)F)CCCC1(C)C	ZINC000457760021	331233510	/nfs/dbraw/zinc/23/35/10/331233510.db2.gz	KUQCPDKXAQNDCB-NWDGAFQWSA-N	0	0	291.357	4.168	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)[C@H](CC)CC(F)F	ZINC000457774850	331234013	/nfs/dbraw/zinc/23/40/13/331234013.db2.gz	JEJHDIIAAQXMNS-GFCCVEGCSA-N	0	0	281.346	4.425	20	30		CIEDRN
Cc1c(C(=O)NCC(C)(C)CC#N)oc2c1c(C)ccc2C	ZINC000457994609	331239887	/nfs/dbraw/zinc/23/98/87/331239887.db2.gz	XXQWICWBULRSTP-UHFFFAOYSA-N	0	0	298.386	4.028	20	30		CIEDRN
C=CCCCC(=O)N1CC2(CCCCC2)[C@H]1C(C)C	ZINC000458169876	331244128	/nfs/dbraw/zinc/24/41/28/331244128.db2.gz	FMPTUMFTRJBVBJ-MRXNPFEDSA-N	0	0	263.425	4.160	20	30		CIEDRN
C=CCCCC(=O)N1CC2(CCCCC2)[C@@H]1C(C)C	ZINC000458169875	331244133	/nfs/dbraw/zinc/24/41/33/331244133.db2.gz	FMPTUMFTRJBVBJ-INIZCTEOSA-N	0	0	263.425	4.160	20	30		CIEDRN
CCC[C@H](NC(=O)C[C@@H](CC#N)c1ccccc1)C1CCC1	ZINC000458333296	331249035	/nfs/dbraw/zinc/24/90/35/331249035.db2.gz	OOISRZBZKSELMB-MSOLQXFVSA-N	0	0	298.430	4.159	20	30		CIEDRN
C[C@H]1CCCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000458807664	331260382	/nfs/dbraw/zinc/26/03/82/331260382.db2.gz	XWUOCWDBIPBYNA-RDJZCZTQSA-N	0	0	299.418	4.006	20	30		CIEDRN
C=C(C)CCNC(=O)N(Cc1ccoc1)C1CCCCC1	ZINC000458997236	331265259	/nfs/dbraw/zinc/26/52/59/331265259.db2.gz	IYCJPTXATIMKKP-UHFFFAOYSA-N	0	0	290.407	4.090	20	30		CIEDRN
C=C(C)CCNC(=O)N(C)[C@H](c1ccc(F)cc1)C(C)C	ZINC000459007077	331266010	/nfs/dbraw/zinc/26/60/10/331266010.db2.gz	SGKUSTASCVXQIV-INIZCTEOSA-N	0	0	292.398	4.130	20	30		CIEDRN
CC(C)(C)CN(CC(C)(C)C)C(=O)NCC(C)(C)CC#N	ZINC000459252183	331273192	/nfs/dbraw/zinc/27/31/92/331273192.db2.gz	BODOKCWDVZNVBM-UHFFFAOYSA-N	0	0	295.471	4.030	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N(C)C1CC(C)(C)C1	ZINC000459545131	331286936	/nfs/dbraw/zinc/28/69/36/331286936.db2.gz	FSTHPCHILSGTMC-UHFFFAOYSA-N	0	0	286.419	4.458	20	30		CIEDRN
C=CCOc1ccccc1CN1CC(C)(CC(F)(F)F)C1	ZINC000459643687	331291808	/nfs/dbraw/zinc/29/18/08/331291808.db2.gz	VENBTRNUISAOKP-UHFFFAOYSA-N	0	0	299.336	4.026	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccccc2OCC)CCCC1	ZINC000459833306	331302376	/nfs/dbraw/zinc/30/23/76/331302376.db2.gz	KCGSPKOPIIQORR-UHFFFAOYSA-N	0	0	273.376	4.160	20	30		CIEDRN
CCC[C@@H](CC(C)C)C(=O)Nc1sccc1C#N	ZINC000459851557	331302628	/nfs/dbraw/zinc/30/26/28/331302628.db2.gz	ANVMNMBXXRAQAF-NSHDSACASA-N	0	0	264.394	4.021	20	30		CIEDRN
C=CCC1(C(=O)N2CCC[C@H]3CCCC[C@H]32)CCCC1	ZINC000459876562	331302725	/nfs/dbraw/zinc/30/27/25/331302725.db2.gz	ORDFBKDAKIJWNJ-HZPDHXFCSA-N	0	0	275.436	4.304	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccccc2CC)CCCC1	ZINC000459862301	331302736	/nfs/dbraw/zinc/30/27/36/331302736.db2.gz	JQQQJIHURDXJJP-UHFFFAOYSA-N	0	0	257.377	4.324	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@]1(C)CC=CCC1	ZINC000459886392	331302972	/nfs/dbraw/zinc/30/29/72/331302972.db2.gz	ZKRHYVJQQVPVKZ-MRXNPFEDSA-N	0	0	275.417	4.009	20	30		CIEDRN
C=CCC1(C(=O)N(C)c2nc3ccccc3o2)CCCCC1	ZINC000459918046	331303494	/nfs/dbraw/zinc/30/34/94/331303494.db2.gz	HYNHKXUUYGDFJB-UHFFFAOYSA-N	0	0	298.386	4.317	20	30		CIEDRN
Cc1ccc(C)c([C@H](C)N(C)C(=O)c2cscc2C#N)c1	ZINC000459972610	331303995	/nfs/dbraw/zinc/30/39/95/331303995.db2.gz	LOVQOKQTHHLJEV-ZDUSSCGKSA-N	0	0	298.411	4.070	20	30		CIEDRN
N#Cc1ccc(COc2cccc(Cl)c2F)c(F)c1	ZINC000167126242	331307907	/nfs/dbraw/zinc/30/79/07/331307907.db2.gz	XLYLPKGLMRPBBZ-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
C=CCc1ccccc1OCc1cncc(C(F)(F)F)c1	ZINC000461055364	331310988	/nfs/dbraw/zinc/31/09/88/331310988.db2.gz	QBIYXOHEMRMWQT-UHFFFAOYSA-N	0	0	293.288	4.408	20	30		CIEDRN
C=CCSCCCCCn1c(C)nc2ccccc21	ZINC000461243388	331312010	/nfs/dbraw/zinc/31/20/10/331312010.db2.gz	HDDHIJUFCCBOKF-UHFFFAOYSA-N	0	0	274.433	4.434	20	30		CIEDRN
C=C(C)CS[C@@H](C)C(=O)Nc1ccc(Cl)cc1C	ZINC000461242490	331312036	/nfs/dbraw/zinc/31/20/36/331312036.db2.gz	IEDVFHSMLIPFOW-NSHDSACASA-N	0	0	283.824	4.285	20	30		CIEDRN
C=CCCS[C@H](C)C(=O)Nc1ccc(Cl)cc1C	ZINC000461247182	331312145	/nfs/dbraw/zinc/31/21/45/331312145.db2.gz	QJYBOXPISCZXEJ-LLVKDONJSA-N	0	0	283.824	4.285	20	30		CIEDRN
COc1cc(C#N)ccc1CNc1cccc(C2CCC2)c1	ZINC000461755348	331314517	/nfs/dbraw/zinc/31/45/17/331314517.db2.gz	LRXCXQSZGMDVQF-UHFFFAOYSA-N	0	0	292.382	4.446	20	30		CIEDRN
Cc1c(Cl)cccc1NC(=O)[C@H](C)c1cccc(C#N)c1	ZINC000461776317	331314546	/nfs/dbraw/zinc/31/45/46/331314546.db2.gz	BNIRGDBZXPNDLQ-LLVKDONJSA-N	0	0	298.773	4.262	20	30		CIEDRN
CCCCN(CCCC)C(=O)[C@H](C)c1cccc(C#N)c1	ZINC000461898941	331315259	/nfs/dbraw/zinc/31/52/59/331315259.db2.gz	ADUYLNSGEXOJAA-OAHLLOKOSA-N	0	0	286.419	4.091	20	30		CIEDRN
CCCC[C@H](NC(=O)[C@H](C)c1cccc(C#N)c1)C1CCC1	ZINC000462174961	331318040	/nfs/dbraw/zinc/31/80/40/331318040.db2.gz	IZRXBRHTWCJHDD-KDOFPFPSSA-N	0	0	298.430	4.137	20	30		CIEDRN
C[C@H](C(=O)N(C)C1CCC(C)(C)CC1)c1cccc(C#N)c1	ZINC000462190910	331318198	/nfs/dbraw/zinc/31/81/98/331318198.db2.gz	PSABLMIUBOFZLS-AWEZNQCLSA-N	0	0	298.430	4.089	20	30		CIEDRN
C[C@@H](C(=O)Nc1ccc2ccoc2c1)c1cccc(C#N)c1	ZINC000462322012	331319636	/nfs/dbraw/zinc/31/96/36/331319636.db2.gz	PEONYIDESXCAFV-GFCCVEGCSA-N	0	0	290.322	4.047	20	30		CIEDRN
C=CCCC[C@@H](C)Sc1nnc(SCC)s1	ZINC000462373404	331320823	/nfs/dbraw/zinc/32/08/23/331320823.db2.gz	WGEREHRJQNHTCU-SECBINFHSA-N	0	0	274.480	4.487	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CCCCC12CCCC2	ZINC000462418067	331321663	/nfs/dbraw/zinc/32/16/63/331321663.db2.gz	XHWRKXIGKGYEDF-LSDHHAIUSA-N	0	0	263.425	4.208	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H]1CCCCC12CCCC2	ZINC000462418065	331321722	/nfs/dbraw/zinc/32/17/22/331321722.db2.gz	XHWRKXIGKGYEDF-GJZGRUSLSA-N	0	0	263.425	4.208	20	30		CIEDRN
CCc1c(C)sc(NC(=O)[C@H](C)CC(C)C)c1C#N	ZINC000462493422	331322865	/nfs/dbraw/zinc/32/28/65/331322865.db2.gz	ZDMBCTKZOVTLHL-SNVBAGLBSA-N	0	0	278.421	4.111	20	30		CIEDRN
C=CCOc1ccc(OCc2ccc(F)c(F)c2)cc1	ZINC000462664800	331324799	/nfs/dbraw/zinc/32/47/99/331324799.db2.gz	YGADAQSKCPVVDO-UHFFFAOYSA-N	0	0	276.282	4.109	20	30		CIEDRN
CC(C)(C)C[C@H]1CCCN1c1c(F)cc(C#N)cc1F	ZINC000462803528	331329816	/nfs/dbraw/zinc/32/98/16/331329816.db2.gz	KFJIMFDUVDRGMI-GFCCVEGCSA-N	0	0	278.346	4.241	20	30		CIEDRN
CC(C)(C)C[C@@H]1CCCN1c1ccc(C#N)cc1F	ZINC000462805249	331329845	/nfs/dbraw/zinc/32/98/45/331329845.db2.gz	GXRAVJRVTLWFIQ-ZDUSSCGKSA-N	0	0	260.356	4.102	20	30		CIEDRN
Cc1cccc(-c2noc([C@H](C)c3cccc(C#N)c3)n2)c1	ZINC000462825723	331331391	/nfs/dbraw/zinc/33/13/91/331331391.db2.gz	KVULMDGNOYIBPS-CYBMUJFWSA-N	0	0	289.338	4.069	20	30		CIEDRN
Cc1ccccc1[C@@H]1C[C@H](C)N(c2ccc(F)cc2C#N)C1	ZINC000462852299	331332622	/nfs/dbraw/zinc/33/26/22/331332622.db2.gz	LCWSYXYYNWSHAA-GOEBONIOSA-N	0	0	294.373	4.388	20	30		CIEDRN
C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1c1ccc(F)cc1C#N	ZINC000462857558	331332874	/nfs/dbraw/zinc/33/28/74/331332874.db2.gz	SRWHLOCXEYHCML-IUODEOHRSA-N	0	0	298.336	4.219	20	30		CIEDRN
N#C[C@H]1CCC[C@@H](Nc2cccc(C3CCC3)c2)C1	ZINC000462872034	331333453	/nfs/dbraw/zinc/33/34/53/331333453.db2.gz	SSSDPIRKDDZHMC-XJKSGUPXSA-N	0	0	254.377	4.448	20	30		CIEDRN
C[C@H](CNc1ccc(F)cc1C#N)Cc1cccs1	ZINC000462901965	331334466	/nfs/dbraw/zinc/33/44/66/331334466.db2.gz	GYVBONXKEFGJEF-NSHDSACASA-N	0	0	274.364	4.050	20	30		CIEDRN
CN(Cc1ccc(F)c(F)c1)c1c(Cl)cccc1C#N	ZINC000462919292	331335166	/nfs/dbraw/zinc/33/51/66/331335166.db2.gz	ODNVXBSVHKKUMN-UHFFFAOYSA-N	0	0	292.716	4.126	20	30		CIEDRN
CC(C)C[C@H](Nc1ccc(C#N)cn1)c1ccc(Cl)cc1	ZINC000463017346	331337117	/nfs/dbraw/zinc/33/71/17/331337117.db2.gz	ZUHYRKGQYSPWLA-INIZCTEOSA-N	0	0	299.805	4.228	20	30		CIEDRN
C=CCCCC(=O)N1CC[C@H](C)C2(CCCCC2)C1	ZINC000463038465	331338083	/nfs/dbraw/zinc/33/80/83/331338083.db2.gz	WMFIGNHORCXYMJ-HNNXBMFYSA-N	0	0	263.425	4.162	20	30		CIEDRN
C[C@@H](c1nc(CC2CCCCC2)no1)c1cccc(C#N)c1	ZINC000463041544	331338264	/nfs/dbraw/zinc/33/82/64/331338264.db2.gz	GFQRVKBVIUUIEP-CYBMUJFWSA-N	0	0	295.386	4.216	20	30		CIEDRN
C[C@@H](c1nc(CC2(C)CCCC2)no1)c1cccc(C#N)c1	ZINC000463057576	331338958	/nfs/dbraw/zinc/33/89/58/331338958.db2.gz	QMMZJXPTCJFWQE-CYBMUJFWSA-N	0	0	295.386	4.216	20	30		CIEDRN
Cc1ccc(CC[C@@H](C)Nc2ccc(F)cc2C#N)o1	ZINC000463070286	331339281	/nfs/dbraw/zinc/33/92/81/331339281.db2.gz	DVNNEYOSGCPVBB-LLVKDONJSA-N	0	0	272.323	4.032	20	30		CIEDRN
Cc1ccc(CC[C@H](C)Nc2ccc(F)cc2C#N)o1	ZINC000463070289	331339298	/nfs/dbraw/zinc/33/92/98/331339298.db2.gz	DVNNEYOSGCPVBB-NSHDSACASA-N	0	0	272.323	4.032	20	30		CIEDRN
C[C@H](CNc1ccc(C#N)cc1)Oc1cccc(Cl)c1	ZINC000463070564	331339354	/nfs/dbraw/zinc/33/93/54/331339354.db2.gz	OMSSDQHMBWAETC-GFCCVEGCSA-N	0	0	286.762	4.091	20	30		CIEDRN
C[C@H]1C[C@H](c2cccc(F)c2)N(c2cccc(F)c2C#N)C1	ZINC000463075856	331339692	/nfs/dbraw/zinc/33/96/92/331339692.db2.gz	FFWCRRFCNKSUQN-KPZWWZAWSA-N	0	0	298.336	4.424	20	30		CIEDRN
CC1(C)CC(Cc2noc(/C=C\c3cccc(C#N)c3)n2)C1	ZINC000463169720	331341409	/nfs/dbraw/zinc/34/14/09/331341409.db2.gz	DIPVHCWWIVRAIQ-SREVYHEPSA-N	0	0	293.370	4.090	20	30		CIEDRN
C[C@H](c1nc(CC2CC(C)(C)C2)no1)c1cccc(C#N)c1	ZINC000463179677	331341600	/nfs/dbraw/zinc/34/16/00/331341600.db2.gz	GWBDOHDYXCLAFF-LBPRGKRZSA-N	0	0	295.386	4.072	20	30		CIEDRN
CC1(C)CC(Cc2noc(/C=C/c3ccccc3C#N)n2)C1	ZINC000463183154	331341689	/nfs/dbraw/zinc/34/16/89/331341689.db2.gz	GZTXTEJNVIIMHY-BQYQJAHWSA-N	0	0	293.370	4.090	20	30		CIEDRN
CC(C)[C@@H](C)SCc1cn2ccccc2c1C#N	ZINC000463219314	331342593	/nfs/dbraw/zinc/34/25/93/331342593.db2.gz	OTKZIAMKCZYZIA-GFCCVEGCSA-N	0	0	258.390	4.089	20	30		CIEDRN
C=CCN(CC=C)C(=O)[C@H](CC(C)C)c1ccccc1	ZINC000463264580	331344724	/nfs/dbraw/zinc/34/47/24/331344724.db2.gz	ZJVOUTITDPIJES-QGZVFWFLSA-N	0	0	271.404	4.017	20	30		CIEDRN
Cc1ccc(Br)c(N[C@@H]2CCC[C@H](C#N)C2)c1	ZINC000463290787	331345409	/nfs/dbraw/zinc/34/54/09/331345409.db2.gz	LCQVLCXYOZEVDP-NWDGAFQWSA-N	0	0	293.208	4.252	20	30		CIEDRN
Cc1ccc(Br)c(N[C@H]2CCC[C@H](C#N)C2)c1	ZINC000463290788	331345433	/nfs/dbraw/zinc/34/54/33/331345433.db2.gz	LCQVLCXYOZEVDP-RYUDHWBXSA-N	0	0	293.208	4.252	20	30		CIEDRN
CCCCN(C(=O)[C@@H](C)c1cccc(C#N)c1)[C@H](C)CC	ZINC000463343043	331346307	/nfs/dbraw/zinc/34/63/07/331346307.db2.gz	AHTMDBBXYUBPHX-CABCVRRESA-N	0	0	286.419	4.089	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1cccc(C2CCC2)c1	ZINC000463832172	331352268	/nfs/dbraw/zinc/35/22/68/331352268.db2.gz	SXXXLNAUWLDJRK-GFCCVEGCSA-N	0	0	258.365	4.040	20	30		CIEDRN
C=CCNC(=O)N[C@H](CC(C)(C)C)c1ccc(Cl)cc1	ZINC000463967450	331354792	/nfs/dbraw/zinc/35/47/92/331354792.db2.gz	KBNSIDLYLLSCEO-CQSZACIVSA-N	0	0	294.826	4.303	20	30		CIEDRN
CC#CCSCc1csc(C2CCCC2)n1	ZINC000464068813	331356050	/nfs/dbraw/zinc/35/60/50/331356050.db2.gz	FZVHEZKOLNESTL-UHFFFAOYSA-N	0	0	251.420	4.057	20	30		CIEDRN
CC[C@H](CC(=O)N[C@](C)(C#N)C(C)(C)C)c1ccccc1	ZINC000464160577	331357241	/nfs/dbraw/zinc/35/72/41/331357241.db2.gz	XFKDDGGUSDLMRQ-RDTXWAMCSA-N	0	0	286.419	4.015	20	30		CIEDRN
C[C@H](CC(=O)N[C@](C)(C#N)C(C)(C)C)C1CCCCC1	ZINC000464158767	331357283	/nfs/dbraw/zinc/35/72/83/331357283.db2.gz	PNFQOTZCWZCIQS-CXAGYDPISA-N	0	0	278.440	4.037	20	30		CIEDRN
C=CCC[C@H](NC(=O)C(CC)CC)c1ccccc1	ZINC000464200913	331358025	/nfs/dbraw/zinc/35/80/25/331358025.db2.gz	UUDCSUFBJJASHH-INIZCTEOSA-N	0	0	259.393	4.246	20	30		CIEDRN
CCC[C@@H]1C[C@H]1C(=O)Nc1cc(C(C)(C)C)sc1C#N	ZINC000464406188	331360277	/nfs/dbraw/zinc/36/02/77/331360277.db2.gz	OPXYYLZYMZKFQX-GHMZBOCLSA-N	0	0	290.432	4.292	20	30		CIEDRN
CCC(CC)C(=O)Nc1cc(C(C)(C)C)sc1C#N	ZINC000464402380	331360291	/nfs/dbraw/zinc/36/02/91/331360291.db2.gz	HEENNOTUSJUVQX-UHFFFAOYSA-N	0	0	278.421	4.292	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](c1ccc(F)cc1)C1CCC1	ZINC000464439336	331360532	/nfs/dbraw/zinc/36/05/32/331360532.db2.gz	OFBYVTDRMOILBY-GUYCJALGSA-N	0	0	289.394	4.385	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NC1CCC(CCC)CC1	ZINC000464438625	331360607	/nfs/dbraw/zinc/36/06/07/331360607.db2.gz	BERUNLYHJPWNDE-WLYUNCDWSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)[C@H](C)CC(=C)C)c1	ZINC000464438290	331360626	/nfs/dbraw/zinc/36/06/26/331360626.db2.gz	AIKGVMRBXXLALD-CQSZACIVSA-N	0	0	273.376	4.182	20	30		CIEDRN
CC#CCCCC(=O)N[C@H](CC(C)C)c1cccs1	ZINC000464440874	331360652	/nfs/dbraw/zinc/36/06/52/331360652.db2.gz	SOZFHMZGJOVRQW-CQSZACIVSA-N	0	0	277.433	4.145	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(OCC)c(Cl)c1	ZINC000464439907	331360723	/nfs/dbraw/zinc/36/07/23/331360723.db2.gz	FYEYGFIUHPNIQI-LLVKDONJSA-N	0	0	281.783	4.280	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(Cc1cccc(F)c1)C(C)C	ZINC000464443316	331360787	/nfs/dbraw/zinc/36/07/87/331360787.db2.gz	AMEYOYDIPVOWEK-AWEZNQCLSA-N	0	0	277.383	4.165	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCC(C)(C)c1ccc(Cl)cc1	ZINC000464449240	331360839	/nfs/dbraw/zinc/36/08/39/331360839.db2.gz	JGAUPGGMXJLFGM-ZDUSSCGKSA-N	0	0	293.838	4.336	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)CCCCc1ccccc1	ZINC000464448430	331360848	/nfs/dbraw/zinc/36/08/48/331360848.db2.gz	GQDJIABFOORFPS-MRXNPFEDSA-N	0	0	273.420	4.070	20	30		CIEDRN
CCC(CC)C(=O)NC1(C#N)CCC(C(C)(C)C)CC1	ZINC000464449558	331360870	/nfs/dbraw/zinc/36/08/70/331360870.db2.gz	SOUYUACBOQETDS-UHFFFAOYSA-N	0	0	278.440	4.037	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(C)cc1OCCC	ZINC000464451425	331360942	/nfs/dbraw/zinc/36/09/42/331360942.db2.gz	SROPBZPJPYCYNJ-AWEZNQCLSA-N	0	0	275.392	4.325	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(C)cc1OCCC	ZINC000464451426	331361006	/nfs/dbraw/zinc/36/10/06/331361006.db2.gz	SROPBZPJPYCYNJ-CQSZACIVSA-N	0	0	275.392	4.325	20	30		CIEDRN
C=CCC[C@H](C(=O)N(C)[C@H]1CC[C@H](C)C1)c1ccccc1	ZINC000464477807	331361250	/nfs/dbraw/zinc/36/12/50/331361250.db2.gz	CMHMKWCKDDRXAE-SZMVWBNQSA-N	0	0	285.431	4.383	20	30		CIEDRN
C=CC[C@H]1N(C(=O)C(CC)CC)CCCC1(C)C	ZINC000464515852	331361674	/nfs/dbraw/zinc/36/16/74/331361674.db2.gz	CVLAFBKWKDULMU-CQSZACIVSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)C(CC)CC)CCCC1(C)C	ZINC000464515851	331361736	/nfs/dbraw/zinc/36/17/36/331361736.db2.gz	CVLAFBKWKDULMU-AWEZNQCLSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC(C)C)c1ccc(C#N)cc1	ZINC000464530737	331361915	/nfs/dbraw/zinc/36/19/15/331361915.db2.gz	UKCUIJJPJAOPOQ-OAHLLOKOSA-N	0	0	284.403	4.150	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](CCC)c1ccccc1	ZINC000464531855	331361923	/nfs/dbraw/zinc/36/19/23/331361923.db2.gz	BHNUZGMJUGSWAW-HOCLYGCPSA-N	0	0	259.393	4.246	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](c1ccccc1)C(C)C	ZINC000464529763	331361926	/nfs/dbraw/zinc/36/19/26/331361926.db2.gz	RDFBBQGQSSDVKR-GOEBONIOSA-N	0	0	259.393	4.102	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](c1ccccc1)C(C)C	ZINC000464529762	331361946	/nfs/dbraw/zinc/36/19/46/331361946.db2.gz	RDFBBQGQSSDVKR-GDBMZVCRSA-N	0	0	259.393	4.102	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](CCC)c1ccccc1	ZINC000464531854	331361948	/nfs/dbraw/zinc/36/19/48/331361948.db2.gz	BHNUZGMJUGSWAW-GOEBONIOSA-N	0	0	259.393	4.246	20	30		CIEDRN
CC#CCCCC(=O)N[C@H](c1ccc(Cl)cc1)C(C)C	ZINC000464543290	331362168	/nfs/dbraw/zinc/36/21/68/331362168.db2.gz	LNFVRXHVTAHEEL-KRWDZBQOSA-N	0	0	291.822	4.347	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(Cc1ccccc1F)C(C)C	ZINC000464557175	331362497	/nfs/dbraw/zinc/36/24/97/331362497.db2.gz	XTVQXBZPIGURRY-AWEZNQCLSA-N	0	0	277.383	4.165	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@@H]1CCCCC12CCCC2	ZINC000464560165	331362611	/nfs/dbraw/zinc/36/26/11/331362611.db2.gz	LZEVXAFUIMHZJB-OAHLLOKOSA-N	0	0	278.440	4.097	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000464563488	331362771	/nfs/dbraw/zinc/36/27/71/331362771.db2.gz	KXZOCLHFNWWGMR-JTQLQIEISA-N	0	0	271.282	4.246	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H](C)c1cc(Cl)ccc1Cl	ZINC000464569777	331362881	/nfs/dbraw/zinc/36/28/81/331362881.db2.gz	OCSNLAHABOJGNN-NSHDSACASA-N	0	0	298.213	4.364	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NC[C@@H](c1ccccc1)C(C)C	ZINC000464571781	331362905	/nfs/dbraw/zinc/36/29/05/331362905.db2.gz	SZIKFYJWRDCGDV-NVXWUHKLSA-N	0	0	273.420	4.145	20	30		CIEDRN
N#CCCCN1CCc2c1cccc2-c1ccccc1	ZINC000464579943	331363116	/nfs/dbraw/zinc/36/31/16/331363116.db2.gz	DNWCJEOTUGNLKS-UHFFFAOYSA-N	0	0	262.356	4.020	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000464637726	331363984	/nfs/dbraw/zinc/36/39/84/331363984.db2.gz	URITXNSRFPLHFG-QGZVFWFLSA-N	0	0	299.458	4.460	20	30		CIEDRN
CC#CCCCC(=O)NC1CCC(CCCC)CC1	ZINC000464649280	331364177	/nfs/dbraw/zinc/36/41/77/331364177.db2.gz	PPTDLRKNCUGFPU-UHFFFAOYSA-N	0	0	263.425	4.045	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](C)CC(C)(C)c1ccccc1	ZINC000464649690	331364226	/nfs/dbraw/zinc/36/42/26/331364226.db2.gz	OBFLDALUDFVXRD-HZPDHXFCSA-N	0	0	287.447	4.461	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(Cc1ccccc1)CC1CCC1	ZINC000464653916	331364302	/nfs/dbraw/zinc/36/43/02/331364302.db2.gz	YNBGDQDQUNAHIF-INIZCTEOSA-N	0	0	285.431	4.418	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)Nc1cc(Cl)ccc1OC(C)C	ZINC000464661248	331364441	/nfs/dbraw/zinc/36/44/41/331364441.db2.gz	FKRKEDJYQZSANY-HNNXBMFYSA-N	0	0	294.782	4.006	20	30		CIEDRN
Cc1c(C(=O)N[C@@H](C#N)C(C)(C)C)oc2c1c(C)ccc2C	ZINC000464712928	331365182	/nfs/dbraw/zinc/36/51/82/331365182.db2.gz	QWMVKLKAXUGEFS-ZDUSSCGKSA-N	0	0	298.386	4.026	20	30		CIEDRN
CC(C)c1ccc(C(=O)N[C@H](C#N)C(C)(C)C)cc1Cl	ZINC000464714649	331365196	/nfs/dbraw/zinc/36/51/96/331365196.db2.gz	VGPAHHXTZRLIAK-CQSZACIVSA-N	0	0	292.810	4.131	20	30		CIEDRN
C=C[C@@H](C)NC(=O)N[C@H](c1ccc(Cl)cc1)C1CCC1	ZINC000464755772	331366290	/nfs/dbraw/zinc/36/62/90/331366290.db2.gz	JPLZADKIEVCKTJ-ABAIWWIYSA-N	0	0	292.810	4.055	20	30		CIEDRN
C=C[C@@H](C)NC(=O)N(CC1CCC1)[C@@H](C)c1ccccc1	ZINC000464757130	331366378	/nfs/dbraw/zinc/36/63/78/331366378.db2.gz	UJHSVEAXBZYBSJ-CABCVRRESA-N	0	0	286.419	4.134	20	30		CIEDRN
C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)CCC#N	ZINC000464759529	331366610	/nfs/dbraw/zinc/36/66/10/331366610.db2.gz	VXRJZKFIGCGNHH-HNNXBMFYSA-N	0	0	264.372	4.260	20	30		CIEDRN
N#CCCCN1CCc2cc(-c3cccc(F)c3)ccc21	ZINC000464788431	331368253	/nfs/dbraw/zinc/36/82/53/331368253.db2.gz	AJHUJZCFQLAISP-UHFFFAOYSA-N	0	0	280.346	4.159	20	30		CIEDRN
Cc1ccc([C@@H]2C[C@@H](C)CCN2Cc2ccccc2C#N)o1	ZINC000464829434	331369900	/nfs/dbraw/zinc/36/99/00/331369900.db2.gz	JLHHEIHVDRIKLK-KSSFIOAISA-N	0	0	294.398	4.433	20	30		CIEDRN
C=C[C@@H](C)NC(=O)C[C@@H](Cc1ccccc1)c1ccccc1	ZINC000465101943	331378388	/nfs/dbraw/zinc/37/83/88/331378388.db2.gz	IJWMJELVMKNWOY-VQIMIIECSA-N	0	0	293.410	4.094	20	30		CIEDRN
C=C[C@@H](C)NC(=O)Cc1coc2cc(C)c(C(C)C)cc12	ZINC000465105603	331378473	/nfs/dbraw/zinc/37/84/73/331378473.db2.gz	ZFRQVPYWDMAEDI-CYBMUJFWSA-N	0	0	285.387	4.098	20	30		CIEDRN
C=C[C@H](C)NC(=O)C1(Sc2ccc(C)cc2)CCCC1	ZINC000465115352	331378836	/nfs/dbraw/zinc/37/88/36/331378836.db2.gz	AIUNUGKUTNPGPI-AWEZNQCLSA-N	0	0	289.444	4.091	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)CC(C)(C)CC)c1	ZINC000465134277	331379402	/nfs/dbraw/zinc/37/94/02/331379402.db2.gz	WQYYKAGAUUVEIH-UHFFFAOYSA-N	0	0	275.392	4.406	20	30		CIEDRN
C=C[C@H](C)NC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000465175586	331380260	/nfs/dbraw/zinc/38/02/60/331380260.db2.gz	BQQZOYYQBUGIPV-ZDUSSCGKSA-N	0	0	282.343	4.175	20	30		CIEDRN
C=C[C@H](C)NC(=O)Nc1cccc(CSC(C)C)c1C	ZINC000465251173	331380614	/nfs/dbraw/zinc/38/06/14/331380614.db2.gz	IONYBRAERUMUAX-LBPRGKRZSA-N	0	0	292.448	4.333	20	30		CIEDRN
C=CCCCC(=O)N(c1ccc(F)cc1)C1CCCC1	ZINC000465491647	331384510	/nfs/dbraw/zinc/38/45/10/331384510.db2.gz	UZYCLXBMZUDWJH-UHFFFAOYSA-N	0	0	275.367	4.458	20	30		CIEDRN
C=CCCC(=O)N1CCc2c(Cl)cc(Cl)cc2[C@H]1C	ZINC000465614561	331385235	/nfs/dbraw/zinc/38/52/35/331385235.db2.gz	BSSAGEYXXXBVNR-SNVBAGLBSA-N	0	0	298.213	4.405	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@H](CCC)CCc1ccccc1	ZINC000466052250	331388961	/nfs/dbraw/zinc/38/89/61/331388961.db2.gz	ATECAZRVZIUFLM-DOTOQJQBSA-N	0	0	288.435	4.052	20	30		CIEDRN
C=CCCCCCN(C)C(=O)N[C@@H]1CC[C@H]2CCC[C@@H]2C1	ZINC000466135837	331389652	/nfs/dbraw/zinc/38/96/52/331389652.db2.gz	RJEPSCPVUDWWDC-BRWVUGGUSA-N	0	0	292.467	4.343	20	30		CIEDRN
C=CCCCCCN(C)C(=O)N[C@@H]1CC[C@@H]2CCC[C@H]2C1	ZINC000466135840	331389685	/nfs/dbraw/zinc/38/96/85/331389685.db2.gz	RJEPSCPVUDWWDC-YESZJQIVSA-N	0	0	292.467	4.343	20	30		CIEDRN
CC#CCCCC(=O)N1CCC[C@H](C)c2ccccc21	ZINC000466233579	331391437	/nfs/dbraw/zinc/39/14/37/331391437.db2.gz	HMGYPDVQUAYCPA-HNNXBMFYSA-N	0	0	269.388	4.111	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](C#N)c1ccc(C(C)(C)C)cc1	ZINC000466240304	331391471	/nfs/dbraw/zinc/39/14/71/331391471.db2.gz	OUNYIHXHNKWHKC-RHSMWYFYSA-N	0	0	298.430	4.267	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](CC)CSc1ccccc1	ZINC000466249926	331391594	/nfs/dbraw/zinc/39/15/94/331391594.db2.gz	NDKWYTVUTXFROA-HUUCEWRRSA-N	0	0	291.460	4.276	20	30		CIEDRN
CC#CCCCC(=O)Nc1csc2ccccc12	ZINC000466241653	331391535	/nfs/dbraw/zinc/39/15/35/331391535.db2.gz	FJXNOAGTHRVYHK-UHFFFAOYSA-N	0	0	257.358	4.033	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccnc(-c2ccccc2)c1	ZINC000466246605	331391589	/nfs/dbraw/zinc/39/15/89/331391589.db2.gz	LTSXMEXFBSSRCZ-AWEZNQCLSA-N	0	0	280.371	4.289	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCC1(C)CCCCCC1	ZINC000466251546	331391679	/nfs/dbraw/zinc/39/16/79/331391679.db2.gz	IPGWDZLRZLVBQN-AWEZNQCLSA-N	0	0	251.414	4.065	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H]1/C=C\c1ccccc1	ZINC000466267859	331391869	/nfs/dbraw/zinc/39/18/69/331391869.db2.gz	YRTKJPUQKITGJU-JZDUJLCSSA-N	0	0	283.415	4.293	20	30		CIEDRN
C=CCCN(C)C(=O)N[C@H](CCC(C)C)C(C)(C)C	ZINC000467010667	331410297	/nfs/dbraw/zinc/41/02/97/331410297.db2.gz	LBGSTVUHRIEABU-CQSZACIVSA-N	0	0	268.445	4.055	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(C)[C@@H](C)c1cccc(Cl)c1	ZINC000466366865	331393612	/nfs/dbraw/zinc/39/36/12/331393612.db2.gz	MJNAYHJLVZVSOG-SWLSCSKDSA-N	0	0	294.826	4.397	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(CC)[C@H](C)c1ccc(F)cc1	ZINC000466366575	331393638	/nfs/dbraw/zinc/39/36/38/331393638.db2.gz	JIWTWXLDKSFSCI-CJNGLKHVSA-N	0	0	292.398	4.273	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1cc(Cl)ccc1OCCC	ZINC000466377059	331393910	/nfs/dbraw/zinc/39/39/10/331393910.db2.gz	BMNMDMUVYLIUQT-UHFFFAOYSA-N	0	0	296.798	4.169	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CCC[C@H]1CCCCC	ZINC000466377606	331393922	/nfs/dbraw/zinc/39/39/22/331393922.db2.gz	FXOHQVHBQYSLKD-LSDHHAIUSA-N	0	0	266.429	4.095	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N1CCC[C@@H]1CCCCC	ZINC000466377602	331393943	/nfs/dbraw/zinc/39/39/43/331393943.db2.gz	FXOHQVHBQYSLKD-CABCVRRESA-N	0	0	266.429	4.095	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(Cc1ccccc1)CC(C)C	ZINC000466384591	331394216	/nfs/dbraw/zinc/39/42/16/331394216.db2.gz	ULEIWZAZRYRKGQ-KRWDZBQOSA-N	0	0	288.435	4.209	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000466385436	331394329	/nfs/dbraw/zinc/39/43/29/331394329.db2.gz	FKCIRYFSFCUWJW-NSHDSACASA-N	0	0	286.297	4.182	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CCC[C@H]1C1CCCCC1	ZINC000466385879	331394351	/nfs/dbraw/zinc/39/43/51/331394351.db2.gz	LAOZUUGEHWYQDB-HOTGVXAUSA-N	0	0	278.440	4.095	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(CCC)Cc1ccc(F)cc1	ZINC000466394124	331394661	/nfs/dbraw/zinc/39/46/61/331394661.db2.gz	AZNZIXAOMCCAAF-MRXNPFEDSA-N	0	0	292.398	4.102	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(CCC)Cc1ccc(F)cc1	ZINC000466394123	331394711	/nfs/dbraw/zinc/39/47/11/331394711.db2.gz	AZNZIXAOMCCAAF-INIZCTEOSA-N	0	0	292.398	4.102	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1cccc(C(C)C)c1	ZINC000466401606	331395043	/nfs/dbraw/zinc/39/50/43/331395043.db2.gz	KMKBPTIVEWOYTC-AWEZNQCLSA-N	0	0	260.381	4.286	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(C)[C@H](C)c1cc(C)ccc1C	ZINC000466410027	331395587	/nfs/dbraw/zinc/39/55/87/331395587.db2.gz	PNWPKTDLTQRJLD-CVEARBPZSA-N	0	0	288.435	4.361	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@@H](c1ccccc1)C(C)C	ZINC000466415415	331395929	/nfs/dbraw/zinc/39/59/29/331395929.db2.gz	FKSRLZAMLXKAJO-DOTOQJQBSA-N	0	0	273.420	4.444	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@@H](c1ccccc1)C(C)C	ZINC000466415416	331395952	/nfs/dbraw/zinc/39/59/52/331395952.db2.gz	FKSRLZAMLXKAJO-NVXWUHKLSA-N	0	0	273.420	4.444	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](C)Sc2ccccc21	ZINC000466440984	331396965	/nfs/dbraw/zinc/39/69/65/331396965.db2.gz	HPYRRMDYMCYLDT-QWHCGFSZSA-N	0	0	275.417	4.116	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NC1(c2ccccc2)CCCC1	ZINC000466436816	331397079	/nfs/dbraw/zinc/39/70/79/331397079.db2.gz	QUODLCIEHYHWBF-HNNXBMFYSA-N	0	0	271.404	4.174	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](c2ccc(Cl)cc2)C1	ZINC000466433120	331397081	/nfs/dbraw/zinc/39/70/81/331397081.db2.gz	ADEMKSYFNFFTFB-DZGCQCFKSA-N	0	0	291.822	4.258	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H]1CC(C)(C)c2ccccc21	ZINC000466437558	331397123	/nfs/dbraw/zinc/39/71/23/331397123.db2.gz	CUBNDCUCMFAZIP-CJNGLKHVSA-N	0	0	271.404	4.128	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NC1(c2ccccc2)CCCC1	ZINC000466436817	331397179	/nfs/dbraw/zinc/39/71/79/331397179.db2.gz	QUODLCIEHYHWBF-OAHLLOKOSA-N	0	0	271.404	4.174	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@@H]1CCCC[C@@H]1CC	ZINC000466441444	331397260	/nfs/dbraw/zinc/39/72/60/331397260.db2.gz	NTHLZMDWPIYPNH-SOUVJXGZSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](C1CCCCC1)C(F)(F)F	ZINC000466440582	331397269	/nfs/dbraw/zinc/39/72/69/331397269.db2.gz	DFHPMGBHFJKJHU-WCQYABFASA-N	0	0	291.357	4.216	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H]1CCC[C@@H]1Cc1ccccc1	ZINC000466444660	331397337	/nfs/dbraw/zinc/39/73/37/331397337.db2.gz	YJMLNPBCKFQQFN-JQHSSLGASA-N	0	0	285.431	4.116	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N[C@@H](CC)CC=C	ZINC000466528163	331399081	/nfs/dbraw/zinc/39/90/81/331399081.db2.gz	KGJUOVBYWWHURZ-ZDUSSCGKSA-N	0	0	275.417	4.049	20	30		CIEDRN
C=CCC[C@H](C(=O)N[C@H](CC)CC=C)c1ccccc1	ZINC000466529293	331399229	/nfs/dbraw/zinc/39/92/29/331399229.db2.gz	JXUZYMHSKUPTCD-SJORKVTESA-N	0	0	271.404	4.207	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Cc1coc2cc(C)c(C)cc12	ZINC000466540340	331399525	/nfs/dbraw/zinc/39/95/25/331399525.db2.gz	FEEYFAAYEFTTNR-HNNXBMFYSA-N	0	0	285.387	4.063	20	30		CIEDRN
CC#CCCCC(=O)Nc1cc(Cl)c(Cl)cc1F	ZINC000466569355	331400050	/nfs/dbraw/zinc/40/00/50/331400050.db2.gz	DRDGITHHXMYKCQ-UHFFFAOYSA-N	0	0	288.149	4.265	20	30		CIEDRN
N#CCc1ccc(NC(=O)NCCCCC2CCCC2)cc1	ZINC000466589760	331400355	/nfs/dbraw/zinc/40/03/55/331400355.db2.gz	MRTCPJFDBFYIKG-UHFFFAOYSA-N	0	0	299.418	4.235	20	30		CIEDRN
C=CCCN(C)C(=O)CCCCCO[C@H]1CCC[C@@H](C)C1	ZINC000466630740	331400969	/nfs/dbraw/zinc/40/09/69/331400969.db2.gz	JTRIMDZWZOGFET-SJORKVTESA-N	0	0	295.467	4.177	20	30		CIEDRN
C=CCCN(C)C(=O)CCCCCO[C@@H]1CCC[C@H](C)C1	ZINC000466630737	331401049	/nfs/dbraw/zinc/40/10/49/331401049.db2.gz	JTRIMDZWZOGFET-DLBZAZTESA-N	0	0	295.467	4.177	20	30		CIEDRN
C=CCCN(C)C(=O)C[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000466643544	331401419	/nfs/dbraw/zinc/40/14/19/331401419.db2.gz	GGLOZYZQCGIDHA-LBPRGKRZSA-N	0	0	299.336	4.234	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cccc(SCC)c1	ZINC000466643848	331401530	/nfs/dbraw/zinc/40/15/30/331401530.db2.gz	WNHJUTJCEMEUDH-GFCCVEGCSA-N	0	0	263.406	4.339	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC(C)C)CC(C)(C)C	ZINC000466665121	331402112	/nfs/dbraw/zinc/40/21/12/331402112.db2.gz	NYIRILYMOLKEGP-CQSZACIVSA-N	0	0	253.430	4.119	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H](C)c1ccc(SC)cc1	ZINC000466677563	331402249	/nfs/dbraw/zinc/40/22/49/331402249.db2.gz	KBKSRTKWFCQIMM-MLGOLLRUSA-N	0	0	277.433	4.188	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccc(Oc2ccccn2)cc1	ZINC000466861317	331406651	/nfs/dbraw/zinc/40/66/51/331406651.db2.gz	BXLJFQFVXRFEAK-UHFFFAOYSA-N	0	0	294.354	4.006	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC)[C@H]1CCCC[C@@H]1C	ZINC000466870877	331406850	/nfs/dbraw/zinc/40/68/50/331406850.db2.gz	CVTPWJCLNCGGNA-KKUMJFAQSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=CCN(C(=O)c1ccc(C(C)C)c(Cl)c1)C1CC1	ZINC000466988864	331409725	/nfs/dbraw/zinc/40/97/25/331409725.db2.gz	VOBZMQVTUQMUQJ-UHFFFAOYSA-N	0	0	277.795	4.254	20	30		CIEDRN
C=CCCN(C)C(=O)N[C@H]1CCC(C)(C)c2ccccc21	ZINC000467112886	331411189	/nfs/dbraw/zinc/41/11/89/331411189.db2.gz	XZVBREUNHLZNKS-INIZCTEOSA-N	0	0	286.419	4.017	20	30		CIEDRN
N#CCc1ccc(CN2CCC=Cc3ccccc32)cc1	ZINC000467293705	331414014	/nfs/dbraw/zinc/41/40/14/331414014.db2.gz	OCFBXHPNHABTDB-UHFFFAOYSA-N	0	0	274.367	4.176	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@H](C(C)(C)C)CC1	ZINC000467321597	331414975	/nfs/dbraw/zinc/41/49/75/331414975.db2.gz	ODZBILSHGKZUOB-INIZCTEOSA-N	0	0	277.452	4.430	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H]1CCc2c1cccc2Cl	ZINC000467326540	331415129	/nfs/dbraw/zinc/41/51/29/331415129.db2.gz	UNSNNLUTPQXLGD-INIZCTEOSA-N	0	0	289.806	4.212	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H]1CCC[C@H](C(C)C)C1	ZINC000467349388	331415737	/nfs/dbraw/zinc/41/57/37/331415737.db2.gz	JDDZLNFTMKEDDF-JKSUJKDBSA-N	0	0	263.425	4.086	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC1CC1)c1ccccc1	ZINC000467528534	331420713	/nfs/dbraw/zinc/42/07/13/331420713.db2.gz	VUSMHDPOINDNOT-UHFFFAOYSA-N	0	0	269.388	4.198	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@@H](C)[C@H]1CCC	ZINC000467521501	331421151	/nfs/dbraw/zinc/42/11/51/331421151.db2.gz	ZKVRPGZBTOGEAM-GDBMZVCRSA-N	0	0	263.425	4.182	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCCc2cc(F)cc(C)c21	ZINC000467529082	331421176	/nfs/dbraw/zinc/42/11/76/331421176.db2.gz	JJMRGEWPSGDQSH-UHFFFAOYSA-N	0	0	287.378	4.182	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(OC(C)C)cc1	ZINC000467732618	331423372	/nfs/dbraw/zinc/42/33/72/331423372.db2.gz	RFEDWQVLESVEEV-MRXNPFEDSA-N	0	0	261.365	4.015	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(Cc1ccccc1C)C1CC1	ZINC000467831905	331424306	/nfs/dbraw/zinc/42/43/06/331424306.db2.gz	XHEMMFQZFJDWPJ-UHFFFAOYSA-N	0	0	283.415	4.254	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H](c1ccccc1)C1CCC1	ZINC000467839082	331424564	/nfs/dbraw/zinc/42/45/64/331424564.db2.gz	BIQKPTIAHZDKPC-SFHVURJKSA-N	0	0	283.415	4.412	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cc(C)c(Cl)cc1OC	ZINC000467858930	331424761	/nfs/dbraw/zinc/42/47/61/331424761.db2.gz	NJCFPCAYXUXSSC-HNNXBMFYSA-N	0	0	281.783	4.198	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000467915024	331425663	/nfs/dbraw/zinc/42/56/63/331425663.db2.gz	ZFJWBXARHSMVRP-RHSMWYFYSA-N	0	0	259.393	4.083	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CC[C@H](Cc2ccccc2)[C@H]1C	ZINC000467981395	331426216	/nfs/dbraw/zinc/42/62/16/331426216.db2.gz	FTVCYIHXORWPPV-SZVBFZGTSA-N	0	0	285.431	4.068	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H]1Cc1ccc(C)cc1	ZINC000468004517	331426578	/nfs/dbraw/zinc/42/65/78/331426578.db2.gz	MEXJIOZQYNEUNE-HKUYNNGSSA-N	0	0	285.431	4.131	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H](C)C(C)(C)c1ccccc1	ZINC000468006982	331426681	/nfs/dbraw/zinc/42/66/81/331426681.db2.gz	SUXMJJDPXZUXAO-RDTXWAMCSA-N	0	0	273.420	4.071	20	30		CIEDRN
C=CCCN(C)C(=O)c1cc(C(C)C)cc(C(C)C)c1O	ZINC000468192261	331429884	/nfs/dbraw/zinc/42/98/84/331429884.db2.gz	MVONEDAOIYSTPL-UHFFFAOYSA-N	0	0	289.419	4.287	20	30		CIEDRN
C=CCCN(C)C(=O)C/C=C/c1ccc(C(C)C)cc1	ZINC000468183458	331429895	/nfs/dbraw/zinc/42/98/95/331429895.db2.gz	OZTGUMQDAYDBMA-BQYQJAHWSA-N	0	0	271.404	4.248	20	30		CIEDRN
C=CCCCNC(=O)[C@H](C)c1ccc2ccccc2c1	ZINC000468366313	331432922	/nfs/dbraw/zinc/43/29/22/331432922.db2.gz	FLRZVZPVFLBMOA-CQSZACIVSA-N	0	0	267.372	4.026	20	30		CIEDRN
C=CCCCNC(=O)c1ccc(OCCCC)cc1Cl	ZINC000468395633	331434080	/nfs/dbraw/zinc/43/40/80/331434080.db2.gz	PCWYUFAZALURSG-UHFFFAOYSA-N	0	0	295.810	4.215	20	30		CIEDRN
CCc1ccc(C(=O)CSc2cccc(C#N)c2)cc1	ZINC000468639249	331438075	/nfs/dbraw/zinc/43/80/75/331438075.db2.gz	RSBJRRNPUGOZSW-UHFFFAOYSA-N	0	0	281.380	4.096	20	30		CIEDRN
N#Cc1cccc(SCc2cccc(OC(F)F)c2)c1	ZINC000468643167	331438129	/nfs/dbraw/zinc/43/81/29/331438129.db2.gz	OGWAMMBGVNGZPR-UHFFFAOYSA-N	0	0	291.322	4.452	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC(F)(F)F)[C@@H](C)C(C)C	ZINC000468712842	331438949	/nfs/dbraw/zinc/43/89/49/331438949.db2.gz	AJPSNISVQKDOLX-LBPRGKRZSA-N	0	0	291.357	4.190	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1C[C@@H](C)Sc2ccccc21	ZINC000468827690	331440625	/nfs/dbraw/zinc/44/06/25/331440625.db2.gz	DVXWWMFHWQPELC-CYBMUJFWSA-N	0	0	287.428	4.282	20	30		CIEDRN
C=CCC(CC=C)C(=O)NCC(CC)(CC)CC	ZINC000468935222	331442563	/nfs/dbraw/zinc/44/25/63/331442563.db2.gz	KHBDTIAIRQILJJ-UHFFFAOYSA-N	0	0	251.414	4.087	20	30		CIEDRN
C=CCCCC(=O)N(C)[C@H](c1ccc(F)cc1)C(C)C	ZINC000468978916	331443541	/nfs/dbraw/zinc/44/35/41/331443541.db2.gz	OJLZAFBAUXKPQX-KRWDZBQOSA-N	0	0	277.383	4.338	20	30		CIEDRN
N#Cc1ccc(F)cc1CSCCOc1ccccc1	ZINC000468985658	331443755	/nfs/dbraw/zinc/44/37/55/331443755.db2.gz	NKEOLSGWGASPMH-UHFFFAOYSA-N	0	0	287.359	4.010	20	30		CIEDRN
C=CC[C@H](C)NC(=O)CCC[C@@H](C)c1cccc(OC)c1	ZINC000469256350	331448489	/nfs/dbraw/zinc/44/84/89/331448489.db2.gz	IQMRFSQFYIFJBT-CABCVRRESA-N	0	0	289.419	4.050	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CC[C@@](C)(c2ccc(C)cc2)C1	ZINC000469284102	331449027	/nfs/dbraw/zinc/44/90/27/331449027.db2.gz	TVCDLKCQBHJYRS-VQIMIIECSA-N	0	0	285.431	4.087	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)[C@@H]1CCCCC1(C)C	ZINC000469312744	331449466	/nfs/dbraw/zinc/44/94/66/331449466.db2.gz	ZESNHEKSLDMIEJ-KGLIPLIRSA-N	0	0	251.414	4.064	20	30		CIEDRN
Cc1ccccc1[C@H](C(C)C)N(C)C(=O)CC(C)(C)C#N	ZINC000469393083	331450647	/nfs/dbraw/zinc/45/06/47/331450647.db2.gz	JYFFRHPFLNMDSQ-KRWDZBQOSA-N	0	0	286.419	4.090	20	30		CIEDRN
C=CCCN(C)C(=O)c1ccc(C(C)(C)C(F)(F)F)cc1	ZINC000469821192	331462104	/nfs/dbraw/zinc/46/21/04/331462104.db2.gz	SQPQNSFLEHVFOG-UHFFFAOYSA-N	0	0	299.336	4.175	20	30		CIEDRN
C=CC[C@H]1N(C(=O)[C@@H](C)CC(=C)C)CCCC1(C)C	ZINC000470275810	331476254	/nfs/dbraw/zinc/47/62/54/331476254.db2.gz	DVSOFRCEWGYCPJ-LSDHHAIUSA-N	0	0	263.425	4.182	20	30		CIEDRN
N#Cc1cnccc1/C=C\c1cccc2ccccc12	ZINC000470281369	331477650	/nfs/dbraw/zinc/47/76/50/331477650.db2.gz	XHZJAGIBBIVBAH-HJWRWDBZSA-N	0	0	256.308	4.277	20	30		CIEDRN
COc1ccc(/C=C/c2ccncc2C#N)c2ccccc12	ZINC000470280128	331477654	/nfs/dbraw/zinc/47/76/54/331477654.db2.gz	NHGJIDDVXFVGSD-VOTSOKGWSA-N	0	0	286.334	4.285	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)c2cccn2C(C)C)CCCC1(C)C	ZINC000470295289	331478270	/nfs/dbraw/zinc/47/82/70/331478270.db2.gz	HWVZUKRJPSCYCE-INIZCTEOSA-N	0	0	288.435	4.276	20	30		CIEDRN
C=CC[C@H]1N(C(=O)c2cc3ccccc3[nH]2)CCCC1(C)C	ZINC000470297674	331478444	/nfs/dbraw/zinc/47/84/44/331478444.db2.gz	NGSLWIVWFCOKQD-QGZVFWFLSA-N	0	0	296.414	4.375	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)CCc2ccc(C)o2)CCCC1(C)C	ZINC000470302389	331478696	/nfs/dbraw/zinc/47/86/96/331478696.db2.gz	HCRIJLNBXIRGLO-INIZCTEOSA-N	0	0	289.419	4.114	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@@H](C)C1CCCCC1	ZINC000470382474	331481111	/nfs/dbraw/zinc/48/11/11/331481111.db2.gz	KBMUSDUKBNCIFK-KBPBESRZSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=CC[C@H](C(=O)NCc1cscc1C)c1ccccc1	ZINC000470447726	331482855	/nfs/dbraw/zinc/48/28/55/331482855.db2.gz	DNIVHMHPFRARJM-INIZCTEOSA-N	0	0	285.412	4.033	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)CCCCC	ZINC000470640526	331486812	/nfs/dbraw/zinc/48/68/12/331486812.db2.gz	BWZOZAHVMNHGCO-UHFFFAOYSA-N	0	0	259.393	4.172	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)[C@H](C)c1ccsc1	ZINC000470646900	331486836	/nfs/dbraw/zinc/48/68/36/331486836.db2.gz	NJKUAJVWROHQHN-OAHLLOKOSA-N	0	0	299.439	4.457	20	30		CIEDRN
CCO[C@H](CCNc1cc(Cl)ccc1C#N)C(C)C	ZINC000470863844	331492962	/nfs/dbraw/zinc/49/29/62/331492962.db2.gz	JTJDVJFBAOGVMP-OAHLLOKOSA-N	0	0	280.799	4.075	20	30		CIEDRN
C=CCCCN(C)C(=O)[C@H](C)Oc1ccc2ccccc2c1	ZINC000470983246	331497927	/nfs/dbraw/zinc/49/79/27/331497927.db2.gz	LRVGLOBTDXZCQA-HNNXBMFYSA-N	0	0	297.398	4.032	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](c2ccc(C)cc2C)C1	ZINC000471337421	331506835	/nfs/dbraw/zinc/50/68/35/331506835.db2.gz	QOYNFGHFUFLOPR-DLBZAZTESA-N	0	0	285.431	4.222	20	30		CIEDRN
C=CCCc1csc(-c2ccc(F)c(F)c2)n1	ZINC000471481736	331509428	/nfs/dbraw/zinc/50/94/28/331509428.db2.gz	VCEQSOYSFXCNAP-UHFFFAOYSA-N	0	0	251.301	4.207	20	30		CIEDRN
C=CCCCCNC(=O)CCCc1ccc(Cl)cc1	ZINC000471690941	331515734	/nfs/dbraw/zinc/51/57/34/331515734.db2.gz	AUVYHMLUPRAZQR-UHFFFAOYSA-N	0	0	279.811	4.135	20	30		CIEDRN
C=CCCCCNC(=O)C[C@@H](CC)c1ccccc1	ZINC000471701045	331516378	/nfs/dbraw/zinc/51/63/78/331516378.db2.gz	FIWKRQHJHSHHNF-OAHLLOKOSA-N	0	0	259.393	4.043	20	30		CIEDRN
C=CCCCCNC(=O)[C@@H]1C[C@@H]1c1cccc2ccccc21	ZINC000471708450	331517027	/nfs/dbraw/zinc/51/70/27/331517027.db2.gz	DUTGPQYRVNMWJH-RTBURBONSA-N	0	0	293.410	4.416	20	30		CIEDRN
C=CCCCCNC(=O)c1sc(C2CCCC2)nc1C	ZINC000471709319	331517241	/nfs/dbraw/zinc/51/72/41/331517241.db2.gz	NTHFVCFKHKBWOB-UHFFFAOYSA-N	0	0	292.448	4.195	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)N[C@H](C)[C@@H](C)CC	ZINC000471736170	331518753	/nfs/dbraw/zinc/51/87/53/331518753.db2.gz	JVLSLLWHCFYJPM-JKSUJKDBSA-N	0	0	288.435	4.209	20	30		CIEDRN
C=CCCCCNC(=O)N1CCC[C@@H]1c1ccc(C)cc1	ZINC000472833842	331544074	/nfs/dbraw/zinc/54/40/74/331544074.db2.gz	OMLRAOXQAMRVCF-QGZVFWFLSA-N	0	0	286.419	4.198	20	30		CIEDRN
C=CCCCCNC(=O)N1CCC[C@H]1c1ccc(F)cc1	ZINC000472849244	331544465	/nfs/dbraw/zinc/54/44/65/331544465.db2.gz	NFXBXQCIXNSYRU-INIZCTEOSA-N	0	0	290.382	4.029	20	30		CIEDRN
C=CCCCCNC(=O)N(C)[C@H](C)c1c(F)cccc1F	ZINC000472882812	331544888	/nfs/dbraw/zinc/54/48/88/331544888.db2.gz	RVWMMHKYTKQLKH-GFCCVEGCSA-N	0	0	296.361	4.024	20	30		CIEDRN
C=CCCCCNC(=O)N(C)[C@@H](C)c1ccc(C)cc1C	ZINC000472871540	331544922	/nfs/dbraw/zinc/54/49/22/331544922.db2.gz	SBNHJWBMLPZDOZ-INIZCTEOSA-N	0	0	288.435	4.362	20	30		CIEDRN
C=CCCCCNC(=O)NCc1cc2ccccc2s1	ZINC000472937156	331545426	/nfs/dbraw/zinc/54/54/26/331545426.db2.gz	SEESVGMWBFTLQE-UHFFFAOYSA-N	0	0	288.416	4.057	20	30		CIEDRN
C=CCCCCNC(=O)Nc1ccc(CCSC)cc1	ZINC000473680398	331555672	/nfs/dbraw/zinc/55/56/72/331555672.db2.gz	VUSXMZOGFXZMHQ-UHFFFAOYSA-N	0	0	292.448	4.070	20	30		CIEDRN
C=CCCCCNC(=O)Nc1cccc(SCC)c1	ZINC000473678396	331555675	/nfs/dbraw/zinc/55/56/75/331555675.db2.gz	CVOIWPGCKWKWKP-UHFFFAOYSA-N	0	0	278.421	4.276	20	30		CIEDRN
COc1c(CNc2ccc(F)cc2C#N)oc2ccccc21	ZINC000473721621	331556060	/nfs/dbraw/zinc/55/60/60/331556060.db2.gz	CIHMOMPLRBDPRQ-UHFFFAOYSA-N	0	0	296.301	4.064	20	30		CIEDRN
C=CCCCCCN(C)C(=O)C/C=C/c1ccc(F)cc1	ZINC000473896430	331559765	/nfs/dbraw/zinc/55/97/65/331559765.db2.gz	RBCFMZNRIUDRHX-CMDGGOBGSA-N	0	0	289.394	4.434	20	30		CIEDRN
Cc1ccc(C)c(NC(=O)C[C@@H](CC#N)c2ccccc2)c1	ZINC000474071867	331567875	/nfs/dbraw/zinc/56/78/75/331567875.db2.gz	GGTVZCJRBBZSMB-QGZVFWFLSA-N	0	0	292.382	4.330	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(OC(F)(F)F)cc2)CC1	ZINC000474075534	331568033	/nfs/dbraw/zinc/56/80/33/331568033.db2.gz	WVPVYMHVGKSAQW-UHFFFAOYSA-N	0	0	299.292	4.270	20	30		CIEDRN
N#CC[C@H](CC(=O)Nc1cccc(Cl)c1)c1ccccc1	ZINC000474080037	331568617	/nfs/dbraw/zinc/56/86/17/331568617.db2.gz	KVHSPYZPVGWBRM-CQSZACIVSA-N	0	0	298.773	4.366	20	30		CIEDRN
C=CCCCCNC(=O)N(CC)[C@@H](C)c1ccc(F)cc1	ZINC000474085951	331569139	/nfs/dbraw/zinc/56/91/39/331569139.db2.gz	ZOISUNCCMNVWNF-AWEZNQCLSA-N	0	0	292.398	4.275	20	30		CIEDRN
C=CCCCCNC(=O)N(Cc1ccccc1F)C(C)C	ZINC000474090817	331569471	/nfs/dbraw/zinc/56/94/71/331569471.db2.gz	UCGABTAVWPPMCX-UHFFFAOYSA-N	0	0	292.398	4.102	20	30		CIEDRN
C[C@@H]1CCC[C@H](NC(=O)c2ccc(C(C)(C)C#N)cc2)[C@@H]1C	ZINC000474091275	331569735	/nfs/dbraw/zinc/56/97/35/331569735.db2.gz	WHALFLPNWNZMOU-CPUCHLNUSA-N	0	0	298.430	4.042	20	30		CIEDRN
C=C[C@H](CC(=O)N1CCCCC(C)(C)C1)c1ccccc1	ZINC000474107354	331571232	/nfs/dbraw/zinc/57/12/32/331571232.db2.gz	YAFLIUMHYMDOKZ-MRXNPFEDSA-N	0	0	285.431	4.385	20	30		CIEDRN
C=CCCCCNC(=O)C(C)(C)c1ccc(Cl)cc1F	ZINC000474195390	331575043	/nfs/dbraw/zinc/57/50/43/331575043.db2.gz	YPRVSSRKYFXAJC-UHFFFAOYSA-N	0	0	297.801	4.229	20	30		CIEDRN
C=CCCC1(C(=O)N(C)Cc2ccc(Cl)cc2)CC1	ZINC000474210439	331575464	/nfs/dbraw/zinc/57/54/64/331575464.db2.gz	YEMJHDJAJSDXFZ-UHFFFAOYSA-N	0	0	277.795	4.045	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N1CCC[C@H]1c1cc(C)ccc1C	ZINC000474261228	331577240	/nfs/dbraw/zinc/57/72/40/331577240.db2.gz	XOHYDPXYOPLTLQ-WBVHZDCISA-N	0	0	286.419	4.115	20	30		CIEDRN
C=CCN(CCc1ccccc1)C(=O)[C@H](C)CC1CCCC1	ZINC000510817452	332917953	/nfs/dbraw/zinc/91/79/53/332917953.db2.gz	WBZMXNPXKWPPPU-QGZVFWFLSA-N	0	0	299.458	4.460	20	30		CIEDRN
C=C[C@H](CC(=O)N1CCC[C@@H](C(C)C)C1)c1ccccc1	ZINC000474402388	331584386	/nfs/dbraw/zinc/58/43/86/331584386.db2.gz	KUNZGDFIPSRABW-SJLPKXTDSA-N	0	0	285.431	4.241	20	30		CIEDRN
C=C[C@H](CC(=O)N1CCC[C@H](C(C)C)C1)c1ccccc1	ZINC000474402386	331584456	/nfs/dbraw/zinc/58/44/56/331584456.db2.gz	KUNZGDFIPSRABW-AEFFLSMTSA-N	0	0	285.431	4.241	20	30		CIEDRN
C=CCCC1(C(=O)N[C@@H]2CC[C@H]3CCCC[C@@H]3C2)CC1	ZINC000474419044	331586198	/nfs/dbraw/zinc/58/61/98/331586198.db2.gz	YTWNABCKOWPJPR-BZUAXINKSA-N	0	0	275.436	4.208	20	30		CIEDRN
CC(C)(C)Oc1cc(F)ccc1NCc1cccc(C#N)c1	ZINC000498352204	331587622	/nfs/dbraw/zinc/58/76/22/331587622.db2.gz	GEISNGFBCIIDCM-UHFFFAOYSA-N	0	0	298.361	4.487	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)C1(C)CCCCCC1	ZINC000510834924	332918352	/nfs/dbraw/zinc/91/83/52/332918352.db2.gz	GEIKGHBGKCJGTN-UHFFFAOYSA-N	0	0	270.376	4.166	20	30		CIEDRN
N#Cc1ccc(Cl)cc1Oc1ncnc2sccc21	ZINC000474794142	331598405	/nfs/dbraw/zinc/59/84/05/331598405.db2.gz	QUGALODSLHBXOH-UHFFFAOYSA-N	0	0	287.731	4.009	20	30		CIEDRN
C=C[C@H](CC(=O)N1C[C@H](C)C[C@H](C)[C@@H]1C)c1ccccc1	ZINC000474979418	331607873	/nfs/dbraw/zinc/60/78/73/331607873.db2.gz	XQNXQWMVROZVQM-LTIDMASMSA-N	0	0	285.431	4.239	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(-c3ccccc3)cn2)CC1	ZINC000475029922	331609868	/nfs/dbraw/zinc/60/98/68/331609868.db2.gz	HDIAQVNMTSKHSM-UHFFFAOYSA-N	0	0	292.382	4.434	20	30		CIEDRN
C[C@@H]1CCC[C@H](CNC(=O)C[C@H](CC#N)c2ccccc2)C1	ZINC000475125798	331615582	/nfs/dbraw/zinc/61/55/82/331615582.db2.gz	WMVXXUHMJQVJCF-RYRKJORJSA-N	0	0	298.430	4.016	20	30		CIEDRN
C[C@@H]1CCC[C@H](CNC(=O)C[C@@H](CC#N)c2ccccc2)C1	ZINC000475125799	331615584	/nfs/dbraw/zinc/61/55/84/331615584.db2.gz	WMVXXUHMJQVJCF-SOLBZPMBSA-N	0	0	298.430	4.016	20	30		CIEDRN
C=CCN(Cc1cc(-n2ccnc2)cs1)c1ccccc1	ZINC000475125302	331615699	/nfs/dbraw/zinc/61/56/99/331615699.db2.gz	QHFSZKDQPSBTQP-UHFFFAOYSA-N	0	0	295.411	4.126	20	30		CIEDRN
CC[C@@H]1CCCC[C@@H]1C(=O)Nc1cc(C#N)ccc1C	ZINC000475383545	331630353	/nfs/dbraw/zinc/63/03/53/331630353.db2.gz	MRAUUPOFURLZSL-CABCVRRESA-N	0	0	270.376	4.022	20	30		CIEDRN
C=CCCC1(C(=O)N2CC[C@@H](c3ccccc3C)C2)CC1	ZINC000475465485	331632368	/nfs/dbraw/zinc/63/23/68/331632368.db2.gz	XYSGEYSGMLJLKB-MRXNPFEDSA-N	0	0	283.415	4.057	20	30		CIEDRN
C=C(C)[C@H](NC(=O)[C@@H](C)CC(C)C)c1ccc(F)c(F)c1	ZINC000475657907	331640438	/nfs/dbraw/zinc/64/04/38/331640438.db2.gz	BXGPORNEDOHZEZ-LRDDRELGSA-N	0	0	295.373	4.380	20	30		CIEDRN
CC(C)(C)[C@H]1CCCN1C(=O)C[C@@H](CC#N)c1ccccc1	ZINC000475658412	331640532	/nfs/dbraw/zinc/64/05/32/331640532.db2.gz	CTPLSUGSVSHZDE-IAGOWNOFSA-N	0	0	298.430	4.111	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)c1ccc(C)c(Cl)c1	ZINC000475737132	331643890	/nfs/dbraw/zinc/64/38/90/331643890.db2.gz	CJOZJSFUKOLAMU-UHFFFAOYSA-N	0	0	292.810	4.241	20	30		CIEDRN
C[C@@H](CNc1ccc(C#N)cc1C(F)(F)F)C(F)(F)F	ZINC000475733102	331643941	/nfs/dbraw/zinc/64/39/41/331643941.db2.gz	JPIKDRBUWKLBTP-ZETCQYMHSA-N	0	0	296.214	4.187	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)C[C@H](CC)C(C)C	ZINC000475736094	331643992	/nfs/dbraw/zinc/64/39/92/331643992.db2.gz	XJSBHUJXHYXJCM-AWEZNQCLSA-N	0	0	266.429	4.037	20	30		CIEDRN
C=CCOCCCSc1nc(-c2ccccc2)co1	ZINC000475874268	331646830	/nfs/dbraw/zinc/64/68/30/331646830.db2.gz	DDMBYQGUAVHAAD-UHFFFAOYSA-N	0	0	275.373	4.026	20	30		CIEDRN
COc1cc(OCc2cccc(C(F)F)c2)ccc1C#N	ZINC000475876954	331647039	/nfs/dbraw/zinc/64/70/39/331647039.db2.gz	QMPVRXFXZZVBIS-UHFFFAOYSA-N	0	0	289.281	4.083	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccc(C2CC2)c(C)c1	ZINC000475885038	331647470	/nfs/dbraw/zinc/64/74/70/331647470.db2.gz	RZSAEKFQSLRJJZ-UHFFFAOYSA-N	0	0	255.361	4.005	20	30		CIEDRN
C=CCOCCCSc1nc2ccccc2n1C(F)F	ZINC000475973384	331650415	/nfs/dbraw/zinc/65/04/15/331650415.db2.gz	FEMXNUJVCGLMBN-UHFFFAOYSA-N	0	0	298.358	4.116	20	30		CIEDRN
C[C@H](Oc1ccc(F)cc1Cl)c1cccc(C#N)c1	ZINC000476042876	331651747	/nfs/dbraw/zinc/65/17/47/331651747.db2.gz	PYPTXBJXFPXYIB-JTQLQIEISA-N	0	0	275.710	4.491	20	30		CIEDRN
C=CCCC1(C(=O)N2CCC[C@@](C)(c3ccccc3)C2)CC1	ZINC000476037985	331651832	/nfs/dbraw/zinc/65/18/32/331651832.db2.gz	BNDJHUSCLDYBAS-LJQANCHMSA-N	0	0	297.442	4.313	20	30		CIEDRN
C=CCCC1(C(=O)N2C[C@@H](c3ccccc3)C[C@H]2C)CC1	ZINC000476044548	331651907	/nfs/dbraw/zinc/65/19/07/331651907.db2.gz	OJKPMKCLAAXBFH-WBVHZDCISA-N	0	0	283.415	4.137	20	30		CIEDRN
C=CCCC1(C(=O)N[C@H](C)Cc2cc(C)cc(C)c2)CC1	ZINC000476123522	331655686	/nfs/dbraw/zinc/65/56/86/331655686.db2.gz	PIIWSLPWJZDHII-MRXNPFEDSA-N	0	0	285.431	4.097	20	30		CIEDRN
C[C@H](CC(C)(C)C)C(=O)N[C@@H](C#N)c1ccccc1Cl	ZINC000476195343	331657041	/nfs/dbraw/zinc/65/70/41/331657041.db2.gz	QXZWPBUHLASCGE-RISCZKNCSA-N	0	0	292.810	4.093	20	30		CIEDRN
CCC[C@@H]1CCCN(C(=O)c2ccc(C(C)(C)C#N)cc2)C1	ZINC000476304909	331660810	/nfs/dbraw/zinc/66/08/10/331660810.db2.gz	WXPHNHLHCQXXOW-OAHLLOKOSA-N	0	0	298.430	4.140	20	30		CIEDRN
C=CCCC1(C(=O)N2Cc3ccccc3C(C)(C)C2)CC1	ZINC000476452796	331664490	/nfs/dbraw/zinc/66/44/90/331664490.db2.gz	ARLFQSARWINKFF-UHFFFAOYSA-N	0	0	283.415	4.053	20	30		CIEDRN
C=CCCC1(C(=O)N[C@@H](C)c2c(C)cccc2C)CC1	ZINC000476686441	331668729	/nfs/dbraw/zinc/66/87/29/331668729.db2.gz	HABXVRNEJNFOPF-HNNXBMFYSA-N	0	0	271.404	4.227	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)c1ccc(C(C)(C)C)s1	ZINC000476995664	331672107	/nfs/dbraw/zinc/67/21/07/331672107.db2.gz	YNEQDUQZBQAOTP-UHFFFAOYSA-N	0	0	298.411	4.478	20	30		CIEDRN
CCC[C@H](CC)S[C@H](C)C(=O)NC1(C#N)CCCCC1	ZINC000477058316	331674494	/nfs/dbraw/zinc/67/44/94/331674494.db2.gz	QSIOXTVQVILWJX-KGLIPLIRSA-N	0	0	296.480	4.029	20	30		CIEDRN
C=C(C)CN(C)C(=O)Nc1cc(C(F)F)ccc1Cl	ZINC000477598670	331687504	/nfs/dbraw/zinc/68/75/04/331687504.db2.gz	OTSJHDTVWUVLNN-UHFFFAOYSA-N	0	0	288.725	4.317	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H]2CC[C@H]3CCCC[C@@H]3C2)CCC1	ZINC000477890837	331692828	/nfs/dbraw/zinc/69/28/28/331692828.db2.gz	JBXTXETXVHWYOZ-BZUAXINKSA-N	0	0	275.436	4.208	20	30		CIEDRN
C=CCC1(C(=O)N(C)c2nc3ccccc3s2)CCC1	ZINC000478022918	331696601	/nfs/dbraw/zinc/69/66/01/331696601.db2.gz	IDYQOPACVGDNCF-UHFFFAOYSA-N	0	0	286.400	4.006	20	30		CIEDRN
C=CCC1(C(=O)NCCCSc2ccccc2)CCC1	ZINC000478067728	331696983	/nfs/dbraw/zinc/69/69/83/331696983.db2.gz	PFUXVGINNWHCML-UHFFFAOYSA-N	0	0	289.444	4.031	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(Br)cc1CC	ZINC000478331066	331704206	/nfs/dbraw/zinc/70/42/06/331704206.db2.gz	PXRCIAVHKZCPRL-UHFFFAOYSA-N	0	0	296.208	4.306	20	30		CIEDRN
Cc1ccc(NCc2ccc(Cl)cc2C#N)cc1F	ZINC000478345604	331704391	/nfs/dbraw/zinc/70/43/91/331704391.db2.gz	XNVHSWDPYBXTMC-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
Cc1cc(F)ccc1NCc1ccc(Cl)cc1C#N	ZINC000478382628	331704993	/nfs/dbraw/zinc/70/49/93/331704993.db2.gz	VLBSUVXUZLPMBE-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
CC(C)(C)CNc1ncc(Cc2ccc(C#N)cc2)s1	ZINC000478565810	331708803	/nfs/dbraw/zinc/70/88/03/331708803.db2.gz	YJBMDIXEVBCIOT-UHFFFAOYSA-N	0	0	285.416	4.064	20	30		CIEDRN
C[C@H](SCc1ccc2c(c1)OCO2)c1ccc(C#N)cc1	ZINC000478758558	331713517	/nfs/dbraw/zinc/71/35/17/331713517.db2.gz	KZKOFOFILLXSMU-LBPRGKRZSA-N	0	0	297.379	4.281	20	30		CIEDRN
N#Cc1cc(Cl)ccc1CSCCC(F)(F)F	ZINC000478755851	331713543	/nfs/dbraw/zinc/71/35/43/331713543.db2.gz	LBTOBJJTBKUWRU-UHFFFAOYSA-N	0	0	279.714	4.397	20	30		CIEDRN
Cc1cccc(O[C@@H](C)c2ccc(C#N)cc2)c1F	ZINC000478767615	331713778	/nfs/dbraw/zinc/71/37/78/331713778.db2.gz	DUAZKKUNQGBMAZ-LBPRGKRZSA-N	0	0	255.292	4.146	20	30		CIEDRN
C[C@H](Oc1cccc(Cl)c1F)c1ccc(C#N)cc1	ZINC000478792521	331714100	/nfs/dbraw/zinc/71/41/00/331714100.db2.gz	APNNOXBXVFZXEA-JTQLQIEISA-N	0	0	275.710	4.491	20	30		CIEDRN
Cc1cc2nc(/C=C\c3cc(C#N)n(C)c3)sc2cc1C	ZINC000478925827	331717635	/nfs/dbraw/zinc/71/76/35/331717635.db2.gz	URPBGLZBNXLDET-PLNGDYQASA-N	0	0	293.395	4.294	20	30		CIEDRN
C=CCC1(C(=O)N2CCC[C@@](C)(c3ccccc3)C2)CCC1	ZINC000479066872	331719518	/nfs/dbraw/zinc/71/95/18/331719518.db2.gz	JDCDNBMJYUIJIY-LJQANCHMSA-N	0	0	297.442	4.313	20	30		CIEDRN
C=C(C)CN(C)C(=O)C/C=C/c1ccc(C(C)C)cc1	ZINC000479213334	331722008	/nfs/dbraw/zinc/72/20/08/331722008.db2.gz	ITZADOBWTZEBFF-VOTSOKGWSA-N	0	0	271.404	4.248	20	30		CIEDRN
C=C(C)CN(C)C(=O)C(C)(C)CCCc1ccccc1	ZINC000479337024	331725102	/nfs/dbraw/zinc/72/51/02/331725102.db2.gz	BALBZFJDXGANPR-UHFFFAOYSA-N	0	0	273.420	4.070	20	30		CIEDRN
CSc1cccc(C)c1NCC#Cc1ccccc1	ZINC000479475861	331732353	/nfs/dbraw/zinc/73/23/53/331732353.db2.gz	NOKHHJBHITXYFA-UHFFFAOYSA-N	0	0	267.397	4.181	20	30		CIEDRN
CCCCCNc1ccccc1Oc1ncccc1C#N	ZINC000479486853	331732822	/nfs/dbraw/zinc/73/28/22/331732822.db2.gz	XDLCMGSGCCJOJC-UHFFFAOYSA-N	0	0	281.359	4.348	20	30		CIEDRN
N#Cc1ccc(CSCc2ccc(F)c(F)c2)cc1F	ZINC000479508615	331733886	/nfs/dbraw/zinc/73/38/86/331733886.db2.gz	ABZBGGBLFXMEKX-UHFFFAOYSA-N	0	0	293.313	4.409	20	30		CIEDRN
C=CCCCC(=O)Nc1cccc(C(=O)c2ccccc2)c1	ZINC000479567299	331737809	/nfs/dbraw/zinc/73/78/09/331737809.db2.gz	NJGLELPMKBQWFT-UHFFFAOYSA-N	0	0	293.366	4.212	20	30		CIEDRN
C=CCCCC(=O)N[C@H]1C[C@@H]1c1ccccc1C(F)(F)F	ZINC000479571429	331738169	/nfs/dbraw/zinc/73/81/69/331738169.db2.gz	SZIUGBRSWNVOGZ-OCCSQVGLSA-N	0	0	297.320	4.034	20	30		CIEDRN
C=CCOCCCS[C@H](C)c1cc([N+](=O)[O-])ccc1C	ZINC000479581375	331738788	/nfs/dbraw/zinc/73/87/88/331738788.db2.gz	AVPCZDPKZQHSJH-CYBMUJFWSA-N	0	0	295.404	4.290	20	30		CIEDRN
C=CCOCCCS[C@@H](C)c1ccccc1C	ZINC000479594940	331739783	/nfs/dbraw/zinc/73/97/83/331739783.db2.gz	SLOKZMWAYHLHIA-AWEZNQCLSA-N	0	0	250.407	4.382	20	30		CIEDRN
CCC[C@@H](C(=O)Nc1ccc(C(C)(C)C#N)cc1)C(C)C	ZINC000479686735	331743424	/nfs/dbraw/zinc/74/34/24/331743424.db2.gz	GBCNBOIJPAJTPE-MRXNPFEDSA-N	0	0	286.419	4.499	20	30		CIEDRN
CC[C@@H](C)CC(=O)N[C@H](C#N)c1ccc(C(C)(C)C)cc1	ZINC000480082586	331757296	/nfs/dbraw/zinc/75/72/96/331757296.db2.gz	NPXPNUXLVFIJDL-CZUORRHYSA-N	0	0	286.419	4.101	20	30		CIEDRN
Cc1cccc2nc(Oc3cccc(F)c3C#N)sc21	ZINC000480091627	331757886	/nfs/dbraw/zinc/75/78/86/331757886.db2.gz	NPFMDXPKOBAKKS-UHFFFAOYSA-N	0	0	284.315	4.408	20	30		CIEDRN
CC#CCNc1ccc(-c2csc(C(F)(F)F)n2)cc1	ZINC000480150653	331759923	/nfs/dbraw/zinc/75/99/23/331759923.db2.gz	WZLLOYNFKVSANK-UHFFFAOYSA-N	0	0	296.317	4.264	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H]2CCC[C@H](C(C)C)C2)CCC1	ZINC000480176036	331761578	/nfs/dbraw/zinc/76/15/78/331761578.db2.gz	DRYWAOZVXKCWBO-LSDHHAIUSA-N	0	0	263.425	4.064	20	30		CIEDRN
CC[C@@H](C)CC(=O)N[C@@H](C#N)c1c(Cl)cccc1Cl	ZINC000480178035	331761854	/nfs/dbraw/zinc/76/18/54/331761854.db2.gz	HFCDZTZWSQFXOZ-SKDRFNHKSA-N	0	0	299.201	4.110	20	30		CIEDRN
C=CCCCC(=O)N(CC)c1cccc(Cl)c1	ZINC000480736643	331786419	/nfs/dbraw/zinc/78/64/19/331786419.db2.gz	ZURMFIDYQIOPKE-UHFFFAOYSA-N	0	0	251.757	4.049	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc(C)cc1NCC	ZINC000480805337	331789060	/nfs/dbraw/zinc/78/90/60/331789060.db2.gz	YEQYFQCHKYTKGZ-UHFFFAOYSA-N	0	0	272.392	4.134	20	30		CIEDRN
CCC[C@H](CC)Sc1c(C#N)nnc2ccccc21	ZINC000480847318	331789762	/nfs/dbraw/zinc/78/97/62/331789762.db2.gz	PMRSUEAFEWOOJD-NSHDSACASA-N	0	0	271.389	4.172	20	30		CIEDRN
C[C@@H](c1cccc(Cl)c1F)N1CCC(C)(C#N)CC1	ZINC000481023393	331794758	/nfs/dbraw/zinc/79/47/58/331794758.db2.gz	IZOLIRPOHKNBOX-NSHDSACASA-N	0	0	280.774	4.166	20	30		CIEDRN
C=CCCCC(=O)N[C@H]1CCCC[C@@H]1c1ccccc1	ZINC000481154347	331799285	/nfs/dbraw/zinc/79/92/85/331799285.db2.gz	LROOIHSAWSQEHJ-SJORKVTESA-N	0	0	271.404	4.185	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1cc(Cl)ccc1SCC	ZINC000481196563	331800777	/nfs/dbraw/zinc/80/07/77/331800777.db2.gz	FHLCCLAFKRZGRX-UHFFFAOYSA-N	0	0	297.851	4.490	20	30		CIEDRN
C=C(C)CN(CC)C(=O)C1(CC(C)C)CCCC1	ZINC000481202162	331801090	/nfs/dbraw/zinc/80/10/90/331801090.db2.gz	QYRQTGPXDJAKFL-UHFFFAOYSA-N	0	0	251.414	4.018	20	30		CIEDRN
C=C(C)[C@@H](N[C@@H](C)c1ncc(C)o1)c1ccc(F)c(F)c1	ZINC000481578110	331809571	/nfs/dbraw/zinc/80/95/71/331809571.db2.gz	BXWFDOPUQHVAEU-XHDPSFHLSA-N	0	0	292.329	4.229	20	30		CIEDRN
COc1ccccc1N[C@@H]1CCCCc2cc(C#N)ccc21	ZINC000481675277	331811696	/nfs/dbraw/zinc/81/16/96/331811696.db2.gz	WLAJKEAADJEMSL-QGZVFWFLSA-N	0	0	292.382	4.446	20	30		CIEDRN
Cc1cc(Br)ccc1CSCC1(C#N)CC1	ZINC000481917526	331818478	/nfs/dbraw/zinc/81/84/78/331818478.db2.gz	DEVRXINBTFVFQB-UHFFFAOYSA-N	0	0	296.233	4.295	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)CCc1ccccc1	ZINC000482913430	331852271	/nfs/dbraw/zinc/85/22/71/331852271.db2.gz	YZOYODYKVXUXBC-UHFFFAOYSA-N	0	0	285.431	4.214	20	30		CIEDRN
C=CCCCC(=O)NC1CC(F)(c2cccc(Cl)c2)C1	ZINC000483023851	331856155	/nfs/dbraw/zinc/85/61/55/331856155.db2.gz	SUSZHUWCJSXUBB-UHFFFAOYSA-N	0	0	295.785	4.140	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N[C@H]1CCC1(C)C	ZINC000483051852	331856647	/nfs/dbraw/zinc/85/66/47/331856647.db2.gz	ZWTAHMVJQPLMLK-HNNXBMFYSA-N	0	0	272.392	4.115	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CCC[C@@H]1C(F)F	ZINC000483135930	331859689	/nfs/dbraw/zinc/85/96/89/331859689.db2.gz	OGSMKQWEJHRKSP-CQSZACIVSA-N	0	0	294.345	4.067	20	30		CIEDRN
C=CCCC1(C(=O)N(Cc2ccccc2)CC(C)C)CC1	ZINC000483245400	331864874	/nfs/dbraw/zinc/86/48/74/331864874.db2.gz	YGWZEQSPQLYBIV-UHFFFAOYSA-N	0	0	285.431	4.418	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)NCc1ccsc1	ZINC000483883354	331888569	/nfs/dbraw/zinc/88/85/69/331888569.db2.gz	IXCCIWWOHJAAHV-UHFFFAOYSA-N	0	0	292.448	4.026	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)[C@@H](C)CC(C)(C)C)s1	ZINC000483973758	331890363	/nfs/dbraw/zinc/89/03/63/331890363.db2.gz	LXGMJHLWSRVLIR-JTQLQIEISA-N	0	0	278.421	4.193	20	30		CIEDRN
CCC[C@](C)(CC)C(=O)N[C@H](C#N)c1ccccc1Cl	ZINC000483986747	331890844	/nfs/dbraw/zinc/89/08/44/331890844.db2.gz	XDPLCQWGZSRFKR-ZBFHGGJFSA-N	0	0	292.810	4.237	20	30		CIEDRN
CCc1c(C)sc(NC(=O)[C@H]2C[C@]2(C)C(C)C)c1C#N	ZINC000483997187	331891320	/nfs/dbraw/zinc/89/13/20/331891320.db2.gz	YBQGPDIYMMITQJ-CZUORRHYSA-N	0	0	290.432	4.111	20	30		CIEDRN
CCN(CC#N)Cc1cccc(-c2ccccc2C)c1	ZINC000511490638	332933270	/nfs/dbraw/zinc/93/32/70/332933270.db2.gz	AWGVTEUBRLRMEP-UHFFFAOYSA-N	0	0	264.372	4.008	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)CCC1CCCCC1	ZINC000484450390	331898323	/nfs/dbraw/zinc/89/83/23/331898323.db2.gz	WDKUTNSCIWOXKO-UHFFFAOYSA-N	0	0	278.440	4.278	20	30		CIEDRN
CCN(CC#N)Cc1cccc(-c2ccc(C)cc2)c1	ZINC000511503495	332933582	/nfs/dbraw/zinc/93/35/82/332933582.db2.gz	HESQEIZQWDXGGB-UHFFFAOYSA-N	0	0	264.372	4.008	20	30		CIEDRN
CC(C)c1ccc(/C=C\CC(=O)N[C@]2(C#N)CC2(C)C)cc1	ZINC000484898852	331906804	/nfs/dbraw/zinc/90/68/04/331906804.db2.gz	GEFOBPRYXNVDOA-VOFKWLDRSA-N	0	0	296.414	4.022	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1c(F)cccc1SCC	ZINC000484928621	331907672	/nfs/dbraw/zinc/90/76/72/331907672.db2.gz	RUCPFZROZDTYEB-LLVKDONJSA-N	0	0	281.396	4.479	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N1CCC[C@H](CC)C1	ZINC000485459528	331914845	/nfs/dbraw/zinc/91/48/45/331914845.db2.gz	BPAFFQWWGJISPA-AWEZNQCLSA-N	0	0	289.444	4.227	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N(C)C[C@@H](C)CC	ZINC000485464952	331915077	/nfs/dbraw/zinc/91/50/77/331915077.db2.gz	JKXGUGPHXPJJIK-ZDUSSCGKSA-N	0	0	277.433	4.083	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N[C@@H]1CCC[C@@H](C)C1	ZINC000485475446	331915285	/nfs/dbraw/zinc/91/52/85/331915285.db2.gz	FQONFHWUJRQLOM-ZIAGYGMSSA-N	0	0	289.444	4.273	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N[C@@H]1CCCC[C@@H]1C	ZINC000485481464	331915291	/nfs/dbraw/zinc/91/52/91/331915291.db2.gz	UGSCTQBDEOMUOU-DZGCQCFKSA-N	0	0	289.444	4.273	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)[C@H](C)Cc1ccc(C)cc1	ZINC000485542911	331916257	/nfs/dbraw/zinc/91/62/57/331916257.db2.gz	KYAGGFGOZRWMEA-HZPDHXFCSA-N	0	0	273.420	4.035	20	30		CIEDRN
C=CCCCCCSCCc1csc(C)n1	ZINC000485574663	331917389	/nfs/dbraw/zinc/91/73/89/331917389.db2.gz	OWEFETINSXHWQJ-UHFFFAOYSA-N	0	0	255.452	4.474	20	30		CIEDRN
C=CCCCCCS[C@H](C)c1nc(CC)no1	ZINC000485591822	331918232	/nfs/dbraw/zinc/91/82/32/331918232.db2.gz	TZOFWJIHZGKTEW-LLVKDONJSA-N	0	0	254.399	4.173	20	30		CIEDRN
CC[C@H](C)CC(=O)Nc1sc2c(c1C#N)CCCCC2	ZINC000485613915	331918757	/nfs/dbraw/zinc/91/87/57/331918757.db2.gz	NMVVALXODGEOSD-NSHDSACASA-N	0	0	290.432	4.263	20	30		CIEDRN
N#Cc1cccnc1/C=C/c1cc(F)cc(C(F)(F)F)c1	ZINC000485987007	331928728	/nfs/dbraw/zinc/92/87/28/331928728.db2.gz	ROAXGBSATMMLKQ-ONEGZZNKSA-N	0	0	292.235	4.282	20	30		CIEDRN
CCSc1cccc(/C=C/c2ncccc2C#N)c1	ZINC000486053547	331930121	/nfs/dbraw/zinc/93/01/21/331930121.db2.gz	MNEYEDFTGCJYDQ-CMDGGOBGSA-N	0	0	266.369	4.236	20	30		CIEDRN
N#Cc1cccnc1/C=C/c1cccc(Cl)c1Cl	ZINC000486051687	331930166	/nfs/dbraw/zinc/93/01/66/331930166.db2.gz	LLFKVKWDOFLEMO-VOTSOKGWSA-N	0	0	275.138	4.430	20	30		CIEDRN
N#CCn1c(/C=C\c2sccc2Cl)nc2ccccc21	ZINC000486077797	331930907	/nfs/dbraw/zinc/93/09/07/331930907.db2.gz	SJLHHEZTWFOKDQ-WAYWQWQTSA-N	0	0	299.786	4.445	20	30		CIEDRN
CCCCOc1cccc(NCc2cc(C#N)ccc2F)c1	ZINC000486138380	331932276	/nfs/dbraw/zinc/93/22/76/331932276.db2.gz	PAYZHGVXIGJUGC-UHFFFAOYSA-N	0	0	298.361	4.488	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(C(=O)C2CCC2)cc1	ZINC000486292743	331934366	/nfs/dbraw/zinc/93/43/66/331934366.db2.gz	KJOLXLRLRUUIQX-CYBMUJFWSA-N	0	0	285.387	4.210	20	30		CIEDRN
C=CCOCCCC(=O)N(CC(C)(C)C)c1ccccc1	ZINC000486602364	331940088	/nfs/dbraw/zinc/94/00/88/331940088.db2.gz	KJUAVCJFHJAPTO-UHFFFAOYSA-N	0	0	289.419	4.049	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1ccc(F)cc1Cl	ZINC000486752951	331943719	/nfs/dbraw/zinc/94/37/19/331943719.db2.gz	KVCZCTMSPIQVDT-NSHDSACASA-N	0	0	282.746	4.052	20	30		CIEDRN
N#Cc1ccc(Cl)cc1N[C@@H]1CCCC(F)(F)C1	ZINC000486901975	331948983	/nfs/dbraw/zinc/94/89/83/331948983.db2.gz	KGSHNSMVBLADNS-LLVKDONJSA-N	0	0	270.710	4.201	20	30		CIEDRN
CC(C)(C)[C@@H]1C[C@@H](Nc2ccc(C#N)c(Cl)c2)CCO1	ZINC000487062481	331955777	/nfs/dbraw/zinc/95/57/77/331955777.db2.gz	QHVMVRRXBUJAJR-ZFWWWQNUSA-N	0	0	292.810	4.217	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1cc2cc(Cl)sc2[nH]1	ZINC000487488386	331971522	/nfs/dbraw/zinc/97/15/22/331971522.db2.gz	SHQYOMSUSOMIPA-JTQLQIEISA-N	0	0	294.807	4.064	20	30		CIEDRN
C=CC[C@@H](C(=O)NCCC1CCCC1)c1ccccc1	ZINC000487575188	331975884	/nfs/dbraw/zinc/97/58/84/331975884.db2.gz	QPWDHSDHQJKRFK-QGZVFWFLSA-N	0	0	271.404	4.043	20	30		CIEDRN
C=CC[C@H](C(=O)NCc1ccccc1Cl)c1ccccc1	ZINC000487590482	331976558	/nfs/dbraw/zinc/97/65/58/331976558.db2.gz	KUWIHLXMCVPQPZ-INIZCTEOSA-N	0	0	299.801	4.316	20	30		CIEDRN
C=CCC[C@H](C(=O)Nc1cccc(OC)c1)c1ccccc1	ZINC000487642812	331978068	/nfs/dbraw/zinc/97/80/68/331978068.db2.gz	YMNLNAICFJFYEI-SFHVURJKSA-N	0	0	295.382	4.384	20	30		CIEDRN
C=CCC[C@H](C(=O)N(CC)CCCC)c1ccccc1	ZINC000487759143	331980578	/nfs/dbraw/zinc/98/05/78/331980578.db2.gz	JXENVUQSWIHSBL-KRWDZBQOSA-N	0	0	273.420	4.385	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1cccc(SCC)c1	ZINC000488076784	331989401	/nfs/dbraw/zinc/98/94/01/331989401.db2.gz	NLHPDLLNNBGFID-CQSZACIVSA-N	0	0	290.432	4.371	20	30		CIEDRN
C=CCCCC(=O)N[C@H](c1cccc(C)c1)C(F)(F)F	ZINC000511705136	332940071	/nfs/dbraw/zinc/94/00/71/332940071.db2.gz	VBTGUYHMROLQDJ-CQSZACIVSA-N	0	0	285.309	4.071	20	30		CIEDRN
CC(C)O[C@H](COc1ccc(C#N)c(F)c1)c1ccccc1	ZINC000488232882	331994976	/nfs/dbraw/zinc/99/49/76/331994976.db2.gz	KIUZYQVJXFCDKO-GOSISDBHSA-N	0	0	299.345	4.242	20	30		CIEDRN
N#Cc1cccc(CN(Cc2ccco2)c2ccccc2)c1	ZINC000488284050	331997224	/nfs/dbraw/zinc/99/72/24/331997224.db2.gz	VLUBIPMUWLMOFZ-UHFFFAOYSA-N	0	0	288.350	4.358	20	30		CIEDRN
C=CCC[C@@H](C(=O)N(C)CC(C)(C)C)c1ccccc1	ZINC000488396639	332003795	/nfs/dbraw/zinc/00/37/95/332003795.db2.gz	XYZMWYMOLDDAFC-MRXNPFEDSA-N	0	0	273.420	4.241	20	30		CIEDRN
C=CCCCC(=O)NC12CCC(C(F)(F)F)(CC1)CC2	ZINC000488414905	332005528	/nfs/dbraw/zinc/00/55/28/332005528.db2.gz	RSTNHXJELSHSEM-UHFFFAOYSA-N	0	0	289.341	4.114	20	30		CIEDRN
N#Cc1cccc(C#N)c1NC[C@@H]1CCCCC(F)(F)C1	ZINC000488470280	332012254	/nfs/dbraw/zinc/01/22/54/332012254.db2.gz	VEBLOKPNRBEEIN-GFCCVEGCSA-N	0	0	289.329	4.057	20	30		CIEDRN
C=CCC[C@H](NC(=O)N1CC[C@@H]2CCC[C@@H]21)c1ccccc1	ZINC000488520773	332015360	/nfs/dbraw/zinc/01/53/60/332015360.db2.gz	TVDKCHWZGFMAET-BZSNNMDCSA-N	0	0	298.430	4.278	20	30		CIEDRN
C=C(C)CSCc1coc(-c2ccc(F)c(F)c2)n1	ZINC000488555000	332017105	/nfs/dbraw/zinc/01/71/05/332017105.db2.gz	NXEJQWCXWHIOFE-UHFFFAOYSA-N	0	0	281.327	4.429	20	30		CIEDRN
N#Cc1cc(F)ccc1CSCCc1ccccc1	ZINC000488569722	332018002	/nfs/dbraw/zinc/01/80/02/332018002.db2.gz	PHQJLWOKCOPRRR-UHFFFAOYSA-N	0	0	271.360	4.173	20	30		CIEDRN
C=C(C)CNC(=O)N(CCC)[C@@H](CC)c1ccccc1	ZINC000488589187	332019450	/nfs/dbraw/zinc/01/94/50/332019450.db2.gz	CGNZXVMZLVZFLQ-INIZCTEOSA-N	0	0	274.408	4.135	20	30		CIEDRN
CC[C@H](CC1CCCCC1)C(=O)N[C@@](C)(C#N)C(C)C	ZINC000488691110	332021611	/nfs/dbraw/zinc/02/16/11/332021611.db2.gz	GDQIVJLOKSNJSK-WBVHZDCISA-N	0	0	278.440	4.037	20	30		CIEDRN
C=CCn1cccc1C(=O)Nc1ccc(OC(C)(C)C)cc1	ZINC000488763584	332024423	/nfs/dbraw/zinc/02/44/23/332024423.db2.gz	QKYWSJQDVKFCFS-UHFFFAOYSA-N	0	0	298.386	4.104	20	30		CIEDRN
N#Cc1ccncc1N[C@@H]1CCCc2sc(Cl)cc21	ZINC000488765242	332024679	/nfs/dbraw/zinc/02/46/79/332024679.db2.gz	SPRCHQBRUIUOHS-LLVKDONJSA-N	0	0	289.791	4.158	20	30		CIEDRN
C=CCn1cccc1C(=O)N1CCCCC[C@@H]1c1ccco1	ZINC000488772209	332024999	/nfs/dbraw/zinc/02/49/99/332024999.db2.gz	TVRLFHDCQMNBID-OAHLLOKOSA-N	0	0	298.386	4.025	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1ccccc1CSC	ZINC000488781682	332025501	/nfs/dbraw/zinc/02/55/01/332025501.db2.gz	JUFGVQSTSVNNRA-CQSZACIVSA-N	0	0	290.432	4.122	20	30		CIEDRN
C=CCn1cccc1C(=O)Nc1cccc2ccsc21	ZINC000488782356	332025529	/nfs/dbraw/zinc/02/55/29/332025529.db2.gz	LJXNJXFLPLYLIB-UHFFFAOYSA-N	0	0	282.368	4.141	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@H](C)CCC(C)(C)C	ZINC000488817034	332025999	/nfs/dbraw/zinc/02/59/99/332025999.db2.gz	DIEXMNRRFBHHCK-ZIAGYGMSSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Cc1c(C)cccc1Cl	ZINC000488798773	332026117	/nfs/dbraw/zinc/02/61/17/332026117.db2.gz	JTKNGQUQRPCXHY-ZDUSSCGKSA-N	0	0	279.811	4.052	20	30		CIEDRN
C=CC[C@@H](C(=O)NC/C=C\c1ccccc1)c1ccccc1	ZINC000488813329	332026752	/nfs/dbraw/zinc/02/67/52/332026752.db2.gz	GOPJESOQGNWNPU-RKWFYDHTSA-N	0	0	291.394	4.176	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)[C@@H](C)CCC(C)(C)C	ZINC000488817031	332027041	/nfs/dbraw/zinc/02/70/41/332027041.db2.gz	DIEXMNRRFBHHCK-KBPBESRZSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1ccc(-c2ccccc2)o1	ZINC000488828242	332027881	/nfs/dbraw/zinc/02/78/81/332027881.db2.gz	PDOYYDUCLQLJRS-HNNXBMFYSA-N	0	0	281.355	4.127	20	30		CIEDRN
C=CC[C@H](C(=O)N1CCCCC[C@H]1C)c1ccccc1	ZINC000488866075	332030270	/nfs/dbraw/zinc/03/02/70/332030270.db2.gz	VZSGSQAOGWWODS-WBVHZDCISA-N	0	0	271.404	4.137	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1oc2c(cccc2C)c1C	ZINC000488871315	332030449	/nfs/dbraw/zinc/03/04/49/332030449.db2.gz	FKTRDZNJGRMWDT-AWEZNQCLSA-N	0	0	283.371	4.230	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)[C@@H](C)CC1CCCCC1	ZINC000488869227	332030456	/nfs/dbraw/zinc/03/04/56/332030456.db2.gz	AKQMZQQCLOHUHQ-HOCLYGCPSA-N	0	0	263.425	4.160	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)[C@H](C)Cc1ccc(Cl)cc1	ZINC000488875453	332030888	/nfs/dbraw/zinc/03/08/88/332030888.db2.gz	DXIOGASEFJKDJS-CJNGLKHVSA-N	0	0	291.822	4.086	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)C[C@H](CC)c1ccc(C)cc1	ZINC000488889020	332032427	/nfs/dbraw/zinc/03/24/27/332032427.db2.gz	ZJTMXCUVUWPICL-FUHWJXTLSA-N	0	0	285.431	4.446	20	30		CIEDRN
C=CC1CCN(C(=O)C[C@H]2C[C@@H](C)c3c2cccc3C)CC1	ZINC000488952057	332035074	/nfs/dbraw/zinc/03/50/74/332035074.db2.gz	TYQGHFQFEVFYHM-NVXWUHKLSA-N	0	0	297.442	4.401	20	30		CIEDRN
C=CCCCN(C)C(=O)[C@H](CCC=C)c1ccccc1	ZINC000489009399	332037612	/nfs/dbraw/zinc/03/76/12/332037612.db2.gz	ILQNZAQOURSLMA-QGZVFWFLSA-N	0	0	271.404	4.161	20	30		CIEDRN
C=CC[C@H](C(=O)N1CCC[C@H]2CCC[C@H]21)c1ccccc1	ZINC000489026503	332038548	/nfs/dbraw/zinc/03/85/48/332038548.db2.gz	ZCSOVWRIBFZGLJ-FGTMMUONSA-N	0	0	283.415	4.137	20	30		CIEDRN
C=CCn1cccc1C(=O)Nc1ccc(OCCC)cc1C	ZINC000489062377	332040019	/nfs/dbraw/zinc/04/00/19/332040019.db2.gz	UGPJVFNGQFWXBY-UHFFFAOYSA-N	0	0	298.386	4.024	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@H]1CCCc1ccccc1	ZINC000489344873	332047850	/nfs/dbraw/zinc/04/78/50/332047850.db2.gz	BCETZNHCTCQDHF-GOSISDBHSA-N	0	0	285.431	4.357	20	30		CIEDRN
C=C[C@H]1CCCCN1Cc1ncc(-c2ccccc2F)o1	ZINC000489405462	332050493	/nfs/dbraw/zinc/05/04/93/332050493.db2.gz	QOPJUAFTAZTCFO-ZDUSSCGKSA-N	0	0	286.350	4.021	20	30		CIEDRN
C=C[C@@H]1CCCCN1Cc1nc(-c2ccsc2)oc1C	ZINC000489451960	332053601	/nfs/dbraw/zinc/05/36/01/332053601.db2.gz	VISFRTONCZWGAC-CQSZACIVSA-N	0	0	288.416	4.252	20	30		CIEDRN
C=C[C@@H]1CCCCN1Cc1nc(-c2cccs2)oc1C	ZINC000489501177	332057082	/nfs/dbraw/zinc/05/70/82/332057082.db2.gz	UAEJZQHUENNRAS-CYBMUJFWSA-N	0	0	288.416	4.252	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1ccc(C)c(OC(C)C)c1	ZINC000489528039	332058426	/nfs/dbraw/zinc/05/84/26/332058426.db2.gz	RKRCSQUGGQSCFF-UHFFFAOYSA-N	0	0	290.407	4.212	20	30		CIEDRN
C=CCCN(C)C(=O)C[C@@H]1C[C@H](C)c2c1cccc2C	ZINC000489573982	332059923	/nfs/dbraw/zinc/05/99/23/332059923.db2.gz	RJDAGOYBUNEEBZ-GJZGRUSLSA-N	0	0	271.404	4.010	20	30		CIEDRN
C=CCC[C@H](C(=O)N(C)[C@H](C)C1CCC1)c1ccccc1	ZINC000489615763	332061638	/nfs/dbraw/zinc/06/16/38/332061638.db2.gz	GFLBBQYSXKELSA-QAPCUYQASA-N	0	0	285.431	4.383	20	30		CIEDRN
Cc1ccc([C@@H]2CCCN2Cc2ccc(F)cc2C#N)cc1	ZINC000489657623	332063459	/nfs/dbraw/zinc/06/34/59/332063459.db2.gz	HGMYYBDRZMYKNK-IBGZPJMESA-N	0	0	294.373	4.343	20	30		CIEDRN
C=CCCCC(=O)N[C@H]1CCC[C@H](c2ccccc2)C1	ZINC000489658288	332063472	/nfs/dbraw/zinc/06/34/72/332063472.db2.gz	BXGVMCLRSMKXRK-IRXDYDNUSA-N	0	0	271.404	4.185	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CCC[C@H](c2ccccc2)C1	ZINC000489665800	332063854	/nfs/dbraw/zinc/06/38/54/332063854.db2.gz	MFVYLOIHLALNSY-RYQLBKOJSA-N	0	0	285.431	4.431	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1cscc1C)c1ccccc1	ZINC000489716892	332065893	/nfs/dbraw/zinc/06/58/93/332065893.db2.gz	NSONZSSUIUIRKD-AWEZNQCLSA-N	0	0	271.385	4.355	20	30		CIEDRN
CC(C)Oc1ccc(NC(=O)C[C@H]2C=CCCC2)cc1C#N	ZINC000489731470	332066358	/nfs/dbraw/zinc/06/63/58/332066358.db2.gz	BBAUUBOJIKYRJL-AWEZNQCLSA-N	0	0	298.386	4.030	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)C[C@@H](C)c1ccccc1C	ZINC000489858726	332070549	/nfs/dbraw/zinc/07/05/49/332070549.db2.gz	LZBMQZJZZHJNFN-OAHLLOKOSA-N	0	0	273.420	4.207	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@@H](CCC)c1ccccn1	ZINC000498575744	332073317	/nfs/dbraw/zinc/07/33/17/332073317.db2.gz	PEWXZTJFRBLTJA-INIZCTEOSA-N	0	0	288.435	4.170	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1cc2cccc(C)c2o1	ZINC000489982792	332075631	/nfs/dbraw/zinc/07/56/31/332075631.db2.gz	YNCZLHNFSQMRAH-UHFFFAOYSA-N	0	0	271.360	4.073	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)C[C@@H](C)c1c[nH]c2ccccc21	ZINC000489985945	332075672	/nfs/dbraw/zinc/07/56/72/332075672.db2.gz	DMZIKIPKDLKSHK-CQSZACIVSA-N	0	0	298.430	4.380	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1cccc2ccccc21	ZINC000489986569	332075731	/nfs/dbraw/zinc/07/57/31/332075731.db2.gz	FVKMKRQUDKEKJW-UHFFFAOYSA-N	0	0	267.372	4.172	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)C[C@@H](C)c1ccc(F)cc1	ZINC000490001842	332076037	/nfs/dbraw/zinc/07/60/37/332076037.db2.gz	CDZQMANQRIVDKE-CYBMUJFWSA-N	0	0	277.383	4.038	20	30		CIEDRN
CC(C)(C)C[N@@H+](CCC#N)CCCc1cccc(F)c1	ZINC000490034505	332077469	/nfs/dbraw/zinc/07/74/69/332077469.db2.gz	AELVPMVJXIVJSF-UHFFFAOYSA-N	0	0	276.399	4.020	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1oc2ccccc2c1C	ZINC000490093544	332081028	/nfs/dbraw/zinc/08/10/28/332081028.db2.gz	ZPMSOLLUEGHIFT-UHFFFAOYSA-N	0	0	271.360	4.073	20	30		CIEDRN
C=CCn1cccc1C(=O)Nc1cccc2ccccc21	ZINC000490111506	332081935	/nfs/dbraw/zinc/08/19/35/332081935.db2.gz	CNQRNXWIBHXVRC-UHFFFAOYSA-N	0	0	276.339	4.080	20	30		CIEDRN
C=CCC(CC=C)C(=O)NCc1ccc(C(C)(F)F)cc1	ZINC000490129023	332082406	/nfs/dbraw/zinc/08/24/06/332082406.db2.gz	BSXWGICVBQKORY-UHFFFAOYSA-N	0	0	293.357	4.183	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)NCc1ccc(C(C)(F)F)cc1	ZINC000490163460	332083318	/nfs/dbraw/zinc/08/33/18/332083318.db2.gz	DSNLKYSZNAATPF-HNNXBMFYSA-N	0	0	281.346	4.017	20	30		CIEDRN
C[C@@H](C#N)CN(C)[C@@H]1CCc2c1cc(Cl)cc2Cl	ZINC000490189533	332084051	/nfs/dbraw/zinc/08/40/51/332084051.db2.gz	ZEJBOCDTYWNJOI-LKFCYVNXSA-N	0	0	283.202	4.072	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(Cl)c2ccncc12	ZINC000490626515	332096643	/nfs/dbraw/zinc/09/66/43/332096643.db2.gz	OJRHBEBRWFQQJH-INIZCTEOSA-N	0	0	288.778	4.429	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(Cl)c2ccncc12	ZINC000490654638	332100300	/nfs/dbraw/zinc/10/03/00/332100300.db2.gz	MVWGWXFDTRZOBM-NSHDSACASA-N	0	0	288.778	4.429	20	30		CIEDRN
C#CCN(CC)C(=O)Nc1c(CC=C)cccc1C(C)C	ZINC000490741403	332111822	/nfs/dbraw/zinc/11/18/22/332111822.db2.gz	RGYCDNHALUNKEN-UHFFFAOYSA-N	0	0	284.403	4.026	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)NCC1CCC(c2ccccc2)CC1	ZINC000511843092	332944256	/nfs/dbraw/zinc/94/42/56/332944256.db2.gz	IPVVJMSHICQVRQ-GXOAENINSA-N	0	0	298.430	4.016	20	30		CIEDRN
N#Cc1ccc(/C=C\C(=O)Nc2cccc(C(F)F)c2)cc1	ZINC000491380183	332200804	/nfs/dbraw/zinc/20/08/04/332200804.db2.gz	CRUOWMKUGLAHJB-HJWRWDBZSA-N	0	0	298.292	4.148	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@@H](C)c1cc2ccccc2s1	ZINC000172135493	335095700	/nfs/dbraw/zinc/09/57/00/335095700.db2.gz	XEOWVFZLBPZGBN-NEPJUHHUSA-N	0	0	288.416	4.226	20	30		CIEDRN
C#C[C@@H](C)N(C)C(=O)Nc1c(C(C)C)cccc1C(C)C	ZINC000491676910	332282032	/nfs/dbraw/zinc/28/20/32/332282032.db2.gz	ZNLBWNPMDOSFCH-CQSZACIVSA-N	0	0	286.419	4.419	20	30		CIEDRN
C#C[C@H](C)N(C)C(=S)Nc1ccccc1-c1ccccc1	ZINC000491815833	332366923	/nfs/dbraw/zinc/36/69/23/332366923.db2.gz	VEZKAZCYVSNOPC-AWEZNQCLSA-N	0	0	294.423	4.004	20	30		CIEDRN
C#C[C@@H](C)N(C)C(=O)Nc1ccc(SC(C)(C)C)cc1	ZINC000491817826	332368061	/nfs/dbraw/zinc/36/80/61/332368061.db2.gz	JOMLUKNISUGLNB-GFCCVEGCSA-N	0	0	290.432	4.063	20	30		CIEDRN
Cc1nc2ccc(-c3nc4cc(C#N)ccc4[nH]3)cc2s1	ZINC000491845160	332371852	/nfs/dbraw/zinc/37/18/52/332371852.db2.gz	GZEQTNVCDPFQRM-UHFFFAOYSA-N	0	0	290.351	4.020	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)[C@@H](C)Cc1ccccc1	ZINC000491903585	332374379	/nfs/dbraw/zinc/37/43/79/332374379.db2.gz	WBHSJBZXXXFYJK-KRWDZBQOSA-N	0	0	293.410	4.080	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)/C=C\OCC	ZINC000492957293	332420179	/nfs/dbraw/zinc/42/01/79/332420179.db2.gz	KOZFPABAKPVZMB-QXMHVHEDSA-N	0	0	273.376	4.027	20	30		CIEDRN
N#CCc1ccc(NC(=O)/C=C\C2CCCC2)c(Cl)c1	ZINC000493272669	332433365	/nfs/dbraw/zinc/43/33/65/332433365.db2.gz	VNFRZPPAPFUEOS-VURMDHGXSA-N	0	0	288.778	4.091	20	30		CIEDRN
N#Cc1c(F)cccc1N1CCC(c2ccccc2F)CC1	ZINC000575540328	335106789	/nfs/dbraw/zinc/10/67/89/335106789.db2.gz	WEZWFYNEBHDNBL-UHFFFAOYSA-N	0	0	298.336	4.220	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2ccc([N+](=O)[O-])cc2C)no1	ZINC000575557193	335106964	/nfs/dbraw/zinc/10/69/64/335106964.db2.gz	SNMAKHQHLOKZEP-LLVKDONJSA-N	0	0	287.319	4.023	20	30		CIEDRN
COc1ccc(C#N)cc1N[C@@H](C)c1c(F)cccc1F	ZINC000493921105	332458418	/nfs/dbraw/zinc/45/84/18/332458418.db2.gz	TYPXYXAKSZTPAU-JTQLQIEISA-N	0	0	288.297	4.018	20	30		CIEDRN
CC(C)C[C@H]1CCCCCN1C(=O)c1cccc(CC#N)c1	ZINC000172571645	335109549	/nfs/dbraw/zinc/10/95/49/335109549.db2.gz	ZRKNKDHBFTWCGV-GOSISDBHSA-N	0	0	298.430	4.184	20	30		CIEDRN
N#C[C@@H]1CCC[C@@H](Nc2ccc(C3CCC3)cc2)C1	ZINC000494475892	332474849	/nfs/dbraw/zinc/47/48/49/332474849.db2.gz	NGPWJDQGYGZRNC-CXAGYDPISA-N	0	0	254.377	4.448	20	30		CIEDRN
C[C@H]1CCC[C@@H](CC(=O)Nc2ccc(C#N)cc2Cl)C1	ZINC000494577720	332478558	/nfs/dbraw/zinc/47/85/58/332478558.db2.gz	FIPYRWIURPDIIW-NWDGAFQWSA-N	0	0	290.794	4.367	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)C/C(C)=C\c1ccccc1	ZINC000494857455	332488538	/nfs/dbraw/zinc/48/85/38/332488538.db2.gz	PKOSUDLBCNTFKS-PEZBUJJGSA-N	0	0	283.415	4.317	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)C/C(C)=C/c1ccccc1	ZINC000494862738	332488701	/nfs/dbraw/zinc/48/87/01/332488701.db2.gz	DNLKPWRKMRURRD-ASNKMWSDSA-N	0	0	271.404	4.151	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)NCc1cccc2ccccc21	ZINC000494866292	332488873	/nfs/dbraw/zinc/48/88/73/332488873.db2.gz	SFCKMFPRESYXCJ-KRWDZBQOSA-N	0	0	294.398	4.090	20	30		CIEDRN
C=C1CCN(C(=O)C/C=C\c2ccc(C(C)C)cc2)CC1	ZINC000495100930	332506208	/nfs/dbraw/zinc/50/62/08/332506208.db2.gz	YXMNRXBRDHBHRH-PLNGDYQASA-N	0	0	283.415	4.392	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)C(C)(C)C2CC2)c1	ZINC000495257155	332513114	/nfs/dbraw/zinc/51/31/14/332513114.db2.gz	QVVQWZIHPDAMKH-UHFFFAOYSA-N	0	0	273.376	4.016	20	30		CIEDRN
CCC[C@H](C(=O)N[C@H](C#N)c1ccccc1Cl)C(C)C	ZINC000495520992	332521605	/nfs/dbraw/zinc/52/16/05/332521605.db2.gz	KEIVQIXTAFKHCB-SWLSCSKDSA-N	0	0	292.810	4.093	20	30		CIEDRN
N#Cc1ccc(N(Cc2ccc(F)cc2F)C2CC2)cc1	ZINC000498862419	332574209	/nfs/dbraw/zinc/57/42/09/332574209.db2.gz	ABBAHWRCFRARTA-UHFFFAOYSA-N	0	0	284.309	4.005	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CCc2c1cccc2C(F)(F)F	ZINC000499670951	332591520	/nfs/dbraw/zinc/59/15/20/332591520.db2.gz	NZIJIJKIJVYXKR-UHFFFAOYSA-N	0	0	297.320	4.197	20	30		CIEDRN
N#CC1(CCCOc2ccc(C3CCC3)cc2)CCOCC1	ZINC000499977440	332596896	/nfs/dbraw/zinc/59/68/96/332596896.db2.gz	GTVKQZXNXQZOPX-UHFFFAOYSA-N	0	0	299.414	4.433	20	30		CIEDRN
C=CCCc1ccccc1NCc1cnccc1C	ZINC000500450448	332609624	/nfs/dbraw/zinc/60/96/24/332609624.db2.gz	GVTPRKHEEBTELL-UHFFFAOYSA-N	0	0	252.361	4.121	20	30		CIEDRN
C=CCCc1ccccc1NCc1cccnc1C	ZINC000500450945	332609747	/nfs/dbraw/zinc/60/97/47/332609747.db2.gz	KJMOTRPAOBHFPQ-UHFFFAOYSA-N	0	0	252.361	4.121	20	30		CIEDRN
COc1cc(C#N)ccc1CNc1ccccc1C(C)C	ZINC000500839760	332619968	/nfs/dbraw/zinc/61/99/68/332619968.db2.gz	FPJRWEODYYDDTC-UHFFFAOYSA-N	0	0	280.371	4.302	20	30		CIEDRN
C=CCOc1cccc(NC(=O)[C@H](C)CCCC)c1	ZINC000500852391	332620362	/nfs/dbraw/zinc/62/03/62/332620362.db2.gz	KDBGMEUFAVQGBF-CYBMUJFWSA-N	0	0	261.365	4.016	20	30		CIEDRN
COc1cc(C#N)ccc1CSCc1ccccc1F	ZINC000500877996	332621066	/nfs/dbraw/zinc/62/10/66/332621066.db2.gz	VLPKQDFUWSYCOM-UHFFFAOYSA-N	0	0	287.359	4.139	20	30		CIEDRN
CCOc1ccc(C#N)cc1NCc1ccc(F)c(C)c1	ZINC000501005633	332623893	/nfs/dbraw/zinc/62/38/93/332623893.db2.gz	SAYPQSVBVASECQ-UHFFFAOYSA-N	0	0	284.334	4.017	20	30		CIEDRN
Cc1ccc(-c2nnc(SCCCCC#N)o2)cc1C	ZINC000154855076	334705887	/nfs/dbraw/zinc/70/58/87/334705887.db2.gz	FYKHMJQETGAOEU-UHFFFAOYSA-N	0	0	287.388	4.139	20	30		CIEDRN
C[C@H]1CC[C@H](C(=O)N(C)c2cc(Cl)ccc2C#N)CC1	ZINC000566305815	334642005	/nfs/dbraw/zinc/64/20/05/334642005.db2.gz	XUMREKFTJBYBFB-HAQNSBGRSA-N	0	0	290.794	4.001	20	30		CIEDRN
C=CCCc1ccccc1N[C@@H]1CCO[C@@H](C(C)C)C1	ZINC000502308235	332653225	/nfs/dbraw/zinc/65/32/25/332653225.db2.gz	HDCXKLHJULNNLX-SJLPKXTDSA-N	0	0	273.420	4.421	20	30		CIEDRN
C=CCOc1ccc(C(=O)N(CCCC)CCCC)cc1	ZINC000502310220	332653245	/nfs/dbraw/zinc/65/32/45/332653245.db2.gz	PMIABVWAPHRYQB-UHFFFAOYSA-N	0	0	289.419	4.294	20	30		CIEDRN
C[C@H](CCNC(=O)NCC(C)(C)CCC#N)CC(C)(C)C	ZINC000502364269	332654819	/nfs/dbraw/zinc/65/48/19/332654819.db2.gz	GTNAEPQLNCFUEA-CQSZACIVSA-N	0	0	295.471	4.078	20	30		CIEDRN
CCc1cccc(NC(=O)Nc2ccc(C#N)c(Cl)c2)c1	ZINC000502702972	332669976	/nfs/dbraw/zinc/66/99/76/332669976.db2.gz	GCUSMBKJBMKTNE-UHFFFAOYSA-N	0	0	299.761	4.418	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)[C@H](C)CCCC	ZINC000503153977	332682776	/nfs/dbraw/zinc/68/27/76/332682776.db2.gz	UEACDKXLNHTZJA-CQSZACIVSA-N	0	0	277.383	4.167	20	30		CIEDRN
CC(C)N(Cc1cccc(C#N)c1)c1ccc(F)cc1	ZINC000504102829	332704066	/nfs/dbraw/zinc/70/40/66/332704066.db2.gz	FYCZNJCCMHTUHD-UHFFFAOYSA-N	0	0	268.335	4.112	20	30		CIEDRN
C=CCOc1ccccc1-c1nc(-c2cccc(F)c2)no1	ZINC000504252680	332706933	/nfs/dbraw/zinc/70/69/33/332706933.db2.gz	JUBAKGXCZSQCNC-UHFFFAOYSA-N	0	0	296.301	4.108	20	30		CIEDRN
CC(C)C[C@@](C)(C#N)NC(=O)C[C@@H](C)C1CCCCC1	ZINC000504568729	332715158	/nfs/dbraw/zinc/71/51/58/332715158.db2.gz	UCPOCRGNQKRURO-PBHICJAKSA-N	0	0	278.440	4.037	20	30		CIEDRN
CC[C@@H](CC(=O)Nc1cc(C#N)ccc1C)c1ccccc1	ZINC000504672871	332717649	/nfs/dbraw/zinc/71/76/49/332717649.db2.gz	GKZQAKXHXRCRDK-INIZCTEOSA-N	0	0	292.382	4.389	20	30		CIEDRN
CC1(C)CCc2cc(/C=C\c3ccncc3C#N)ccc2O1	ZINC000504731752	332719641	/nfs/dbraw/zinc/71/96/41/332719641.db2.gz	QEUZJJAOFCPGRE-HYXAFXHYSA-N	0	0	290.366	4.227	20	30		CIEDRN
C=CCOc1ccc(/C=C/c2ccncc2C#N)cc1Cl	ZINC000504743664	332720155	/nfs/dbraw/zinc/72/01/55/332720155.db2.gz	XQUQLMKOYFFXRW-HWKANZROSA-N	0	0	296.757	4.342	20	30		CIEDRN
Cc1ccc([C@@H](C)NC(=O)c2cc(C#N)ccc2Cl)cc1	ZINC000504826257	332721789	/nfs/dbraw/zinc/72/17/89/332721789.db2.gz	QERQJUARCKTIIX-GFCCVEGCSA-N	0	0	298.773	4.011	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1C[C@H](C)CC1(C)C	ZINC000505004533	332727435	/nfs/dbraw/zinc/72/74/35/332727435.db2.gz	DUHXTMXKBMSSAM-CQSZACIVSA-N	0	0	286.419	4.458	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)NCc1cccc(F)c1	ZINC000505010314	332727744	/nfs/dbraw/zinc/72/77/44/332727744.db2.gz	FILQKAVADSZADA-UHFFFAOYSA-N	0	0	298.361	4.266	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CCCC(C)(C)C1	ZINC000505017193	332727888	/nfs/dbraw/zinc/72/78/88/332727888.db2.gz	SBYIYSNEINFXMB-UHFFFAOYSA-N	0	0	286.419	4.459	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CCC(C)(C)CC1	ZINC000505016132	332727940	/nfs/dbraw/zinc/72/79/40/332727940.db2.gz	BZDPRDGEHZVJTM-UHFFFAOYSA-N	0	0	286.419	4.459	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N(CC)CC(C)C	ZINC000505016390	332727960	/nfs/dbraw/zinc/72/79/60/332727960.db2.gz	GQVMMYRKXVYUQT-UHFFFAOYSA-N	0	0	274.408	4.315	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N(C)CC(C)(C)C	ZINC000505016110	332727973	/nfs/dbraw/zinc/72/79/73/332727973.db2.gz	BTMLFKCSUPQOTI-UHFFFAOYSA-N	0	0	274.408	4.315	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CC[C@@H](C)[C@@H]1CC	ZINC000505030426	332728510	/nfs/dbraw/zinc/72/85/10/332728510.db2.gz	VYXPGKGZJKXFLY-PBHICJAKSA-N	0	0	286.419	4.458	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1C[C@H](C)C[C@H]1C	ZINC000505034864	332728545	/nfs/dbraw/zinc/72/85/45/332728545.db2.gz	HZCDCQZJXIUJRS-ZIAGYGMSSA-N	0	0	272.392	4.067	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)NCc1cccc(C)c1	ZINC000505030788	332728585	/nfs/dbraw/zinc/72/85/85/332728585.db2.gz	ZLDHTLWENJLCQZ-UHFFFAOYSA-N	0	0	294.398	4.435	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1C[C@H](C)C[C@@H]1C	ZINC000505034862	332728603	/nfs/dbraw/zinc/72/86/03/332728603.db2.gz	HZCDCQZJXIUJRS-KGLIPLIRSA-N	0	0	272.392	4.067	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)C[C@H]2CCC[C@@H](C)C2)s1	ZINC000505069942	332729927	/nfs/dbraw/zinc/72/99/27/332729927.db2.gz	DTZOTJMKDOYLGU-NEPJUHHUSA-N	0	0	290.432	4.337	20	30		CIEDRN
CC(C)[C@H]1CCc2ccccc2[C@H]1NC(=O)CC(C)(C)C#N	ZINC000505275498	332735703	/nfs/dbraw/zinc/73/57/03/332735703.db2.gz	TYXFVXAOOZIPFX-QAPCUYQASA-N	0	0	298.430	4.002	20	30		CIEDRN
N#Cc1ccc(-c2ccccc2)nc1SCCCCF	ZINC000505521715	332743100	/nfs/dbraw/zinc/74/31/00/332743100.db2.gz	XXFGYGLCVPVGJU-UHFFFAOYSA-N	0	0	286.375	4.462	20	30		CIEDRN
Cc1cccc(C)c1OCCCNc1ccc(C#N)cc1	ZINC000505602056	332745991	/nfs/dbraw/zinc/74/59/91/332745991.db2.gz	LANBVXXLDIOXPJ-UHFFFAOYSA-N	0	0	280.371	4.056	20	30		CIEDRN
CCCC[C@H](CC)C(=O)N[C@H](C#N)c1ccc(Cl)cc1	ZINC000505797118	332752808	/nfs/dbraw/zinc/75/28/08/332752808.db2.gz	SPLKBHFWBJIREC-SWLSCSKDSA-N	0	0	292.810	4.237	20	30		CIEDRN
CCCC[C@@H](CC)C(=O)N[C@@H](C#N)c1ccc(Cl)cc1	ZINC000505797116	332752890	/nfs/dbraw/zinc/75/28/90/332752890.db2.gz	SPLKBHFWBJIREC-DOMZBBRYSA-N	0	0	292.810	4.237	20	30		CIEDRN
CCC(C)(C)C(=O)N[C@H](C#N)c1ccc(C(C)(C)C)cc1	ZINC000505810385	332753240	/nfs/dbraw/zinc/75/32/40/332753240.db2.gz	ZGBOAJOTDYLMHF-OAHLLOKOSA-N	0	0	286.419	4.101	20	30		CIEDRN
CC(C)(C)c1ccc([C@@H](C#N)NC(=O)C2(C)CCCC2)cc1	ZINC000505815059	332753266	/nfs/dbraw/zinc/75/32/66/332753266.db2.gz	JHOMYQNBMLLLJK-MRXNPFEDSA-N	0	0	298.430	4.245	20	30		CIEDRN
CC[C@]1(C)C[C@H]1C(=O)N[C@H](C#N)c1ccc(C(C)(C)C)cc1	ZINC000505810254	332753433	/nfs/dbraw/zinc/75/34/33/332753433.db2.gz	YAJHGPUAMWTGNR-FRQCXROJSA-N	0	0	298.430	4.101	20	30		CIEDRN
C=C(C)CN[C@H](c1ccccc1C(F)(F)F)C(F)(F)F	ZINC000505841511	332754240	/nfs/dbraw/zinc/75/42/40/332754240.db2.gz	WHVQILULOXMJSS-LLVKDONJSA-N	0	0	297.242	4.475	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H](C)c1ccccc1SC	ZINC000512541280	332972800	/nfs/dbraw/zinc/97/28/00/332972800.db2.gz	DUHXOKLXNJUGOI-LBPRGKRZSA-N	0	0	277.433	4.188	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@H](C)C1CCCCC1	ZINC000512725146	332981835	/nfs/dbraw/zinc/98/18/35/332981835.db2.gz	KBMUSDUKBNCIFK-ZIAGYGMSSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=CCCC1(C(=O)N(C)[C@@H](C)C2CCCCC2)CC1	ZINC000512775804	332985043	/nfs/dbraw/zinc/98/50/43/332985043.db2.gz	CQLZCOFXYNMROW-AWEZNQCLSA-N	0	0	263.425	4.160	20	30		CIEDRN
CCc1ccc(NCc2ccc(C#N)s2)cc1Cl	ZINC000512988203	332997279	/nfs/dbraw/zinc/99/72/79/332997279.db2.gz	HGJAMEYKHZKMQL-UHFFFAOYSA-N	0	0	276.792	4.448	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CCC(C)(CC(C)C)CC1	ZINC000575793826	335115505	/nfs/dbraw/zinc/11/55/05/335115505.db2.gz	LNJDRSKWBPGBCS-QGZVFWFLSA-N	0	0	265.441	4.264	20	30		CIEDRN
C=C1CCN(Cc2csc(-c3cccs3)n2)CC1	ZINC000513460213	333020889	/nfs/dbraw/zinc/02/08/89/333020889.db2.gz	COKNXNLSDLTNDY-UHFFFAOYSA-N	0	0	276.430	4.024	20	30		CIEDRN
N#Cc1ccc(NC(=O)c2cc3ccccc3s2)cc1F	ZINC000308130553	333025015	/nfs/dbraw/zinc/02/50/15/333025015.db2.gz	XFMXFVJHLQQCFK-UHFFFAOYSA-N	0	0	296.326	4.164	20	30		CIEDRN
Cc1cc(C#N)cc(NCc2nc(C(C)(C)C)cs2)c1	ZINC000308127394	333025055	/nfs/dbraw/zinc/02/50/55/333025055.db2.gz	CERNFQXUMOPHBX-UHFFFAOYSA-N	0	0	285.416	4.233	20	30		CIEDRN
Cc1cc(C#N)cc(NCc2cnc(C(C)(C)C)s2)c1	ZINC000308125589	333025081	/nfs/dbraw/zinc/02/50/81/333025081.db2.gz	ZPPQHOCCEQLKOL-UHFFFAOYSA-N	0	0	285.416	4.233	20	30		CIEDRN
CC(C)(C)c1ccccc1C(=O)Nc1ccc(C#N)c(F)c1	ZINC000308125369	333025121	/nfs/dbraw/zinc/02/51/21/333025121.db2.gz	VDSSQFFTSOUBEL-UHFFFAOYSA-N	0	0	296.345	4.247	20	30		CIEDRN
CCC(CC)n1ccc(CNc2cc(C)cc(C#N)c2)n1	ZINC000308150558	333025540	/nfs/dbraw/zinc/02/55/40/333025540.db2.gz	HSAFIGLQJYHCSF-UHFFFAOYSA-N	0	0	282.391	4.036	20	30		CIEDRN
Cc1cc(N[C@H](C)c2cccc(Cl)c2)cc(C#N)n1	ZINC000308277911	333026840	/nfs/dbraw/zinc/02/68/40/333026840.db2.gz	LORLQJKRJYRMMQ-LLVKDONJSA-N	0	0	271.751	4.088	20	30		CIEDRN
CSc1ccc(Nc2ncc(C#N)cc2Cl)cc1	ZINC000513623234	333027246	/nfs/dbraw/zinc/02/72/46/333027246.db2.gz	DEBULKWKPMEYSF-UHFFFAOYSA-N	0	0	275.764	4.072	20	30		CIEDRN
CC(C)CCC[C@@H](C)Nc1ncc(C#N)cc1Cl	ZINC000513623577	333027345	/nfs/dbraw/zinc/02/73/45/333027345.db2.gz	FWZUIIIEMNYAJF-LLVKDONJSA-N	0	0	265.788	4.233	20	30		CIEDRN
C=CCCCC(=O)N[C@H](C)Cc1ccc(C(F)(F)F)cc1	ZINC000175630336	333027454	/nfs/dbraw/zinc/02/74/54/333027454.db2.gz	SCGDUXRGZJYFDN-GFCCVEGCSA-N	0	0	299.336	4.109	20	30		CIEDRN
CO[C@H](C)c1cccc(Nc2ncc(C#N)cc2Cl)c1	ZINC000513640616	333028350	/nfs/dbraw/zinc/02/83/50/333028350.db2.gz	QAYKAGXDHKJLAW-SNVBAGLBSA-N	0	0	287.750	4.058	20	30		CIEDRN
CC(C)(C)c1ccc(CN(CCC#N)CC2CC2)s1	ZINC000513730149	333036041	/nfs/dbraw/zinc/03/60/41/333036041.db2.gz	WLYFIHKHUHLROV-UHFFFAOYSA-N	0	0	276.449	4.171	20	30		CIEDRN
Cc1ccc(-c2cccc(CN(C)[C@@H](C)CC#N)c2)cc1	ZINC000513727903	333036081	/nfs/dbraw/zinc/03/60/81/333036081.db2.gz	BWNUEMMWQXVCDB-INIZCTEOSA-N	0	0	278.399	4.396	20	30		CIEDRN
C=CCOc1ccccc1CN(CCC#N)CCC(C)C	ZINC000513728279	333036105	/nfs/dbraw/zinc/03/61/05/333036105.db2.gz	GOILSPDNQMLZTP-UHFFFAOYSA-N	0	0	286.419	4.013	20	30		CIEDRN
C[C@@H](C(=O)Nc1cccc(C#N)c1)c1cc2ccccc2o1	ZINC000175883582	333036567	/nfs/dbraw/zinc/03/65/67/333036567.db2.gz	WGUYASGIUDLCGJ-GFCCVEGCSA-N	0	0	290.322	4.047	20	30		CIEDRN
CCN(Cc1cccc(C#N)c1)c1cccc(Cl)c1	ZINC000513762107	333037988	/nfs/dbraw/zinc/03/79/88/333037988.db2.gz	QEHDCXZSAVIXEV-UHFFFAOYSA-N	0	0	270.763	4.238	20	30		CIEDRN
C=CCCCC(=O)Nc1cccc(CC(F)(F)F)c1	ZINC000176048152	333038944	/nfs/dbraw/zinc/03/89/44/333038944.db2.gz	BHFKMNAKMOAIKN-UHFFFAOYSA-N	0	0	271.282	4.086	20	30		CIEDRN
C=CCCCC(=O)N1CC[C@H](C)C[C@H]1c1ccc(CC)o1	ZINC000176107148	333039429	/nfs/dbraw/zinc/03/94/29/333039429.db2.gz	IOQCXNNLIUEUPT-HOCLYGCPSA-N	0	0	289.419	4.498	20	30		CIEDRN
C=CCCCC(=O)N[C@H](C)c1c(F)cccc1Cl	ZINC000176515645	333042749	/nfs/dbraw/zinc/04/27/49/333042749.db2.gz	JQXVCJZSEIGCOI-SNVBAGLBSA-N	0	0	269.747	4.013	20	30		CIEDRN
CCCn1c2ccc(C)cc2nc1-c1ccc(C#N)cc1	ZINC000513858088	333043585	/nfs/dbraw/zinc/04/35/85/333043585.db2.gz	UXZXLCLGGFPNNF-UHFFFAOYSA-N	0	0	275.355	4.293	20	30		CIEDRN
N#Cc1cccc(-c2nc3cccc(Cl)c3s2)c1	ZINC000513857609	333043682	/nfs/dbraw/zinc/04/36/82/333043682.db2.gz	NXBYJHCUCUGUAR-UHFFFAOYSA-N	0	0	270.744	4.488	20	30		CIEDRN
C[C@@H](Sc1cccc(C#N)c1)C(=O)c1ccc(F)cc1	ZINC000177109382	333053662	/nfs/dbraw/zinc/05/36/62/333053662.db2.gz	JHHBKERUNXRCND-LLVKDONJSA-N	0	0	285.343	4.061	20	30		CIEDRN
CC(C)c1ccc(CN(C)C(=O)c2cc(C#N)cs2)cc1	ZINC000177393399	333058591	/nfs/dbraw/zinc/05/85/91/333058591.db2.gz	IQHMMUHRVUQEDP-UHFFFAOYSA-N	0	0	298.411	4.015	20	30		CIEDRN
CC(C)CC[C@H]1CCCCN1C(=O)c1cc(C#N)cs1	ZINC000177499765	333059610	/nfs/dbraw/zinc/05/96/10/333059610.db2.gz	NRBUTNYYYRCJSF-CQSZACIVSA-N	0	0	290.432	4.051	20	30		CIEDRN
C=CCCCC(=O)N(C)c1ccc(Br)cc1C	ZINC000177761133	333062705	/nfs/dbraw/zinc/06/27/05/333062705.db2.gz	GXLPGCAOAWIBQE-UHFFFAOYSA-N	0	0	296.208	4.077	20	30		CIEDRN
C=C(C)CSCc1ncc(-c2ccccc2F)o1	ZINC000177866372	333064402	/nfs/dbraw/zinc/06/44/02/333064402.db2.gz	LCQWOBPZGBTLHW-UHFFFAOYSA-N	0	0	263.337	4.290	20	30		CIEDRN
C=CCCCC(=O)N(Cc1ccoc1)C1CCCCC1	ZINC000177889040	333065138	/nfs/dbraw/zinc/06/51/38/333065138.db2.gz	QFLKSTGLNFFEFT-UHFFFAOYSA-N	0	0	275.392	4.297	20	30		CIEDRN
Cc1nc(Oc2ccc(Cl)c(Cl)c2)ccc1C#N	ZINC000311205571	333065977	/nfs/dbraw/zinc/06/59/77/333065977.db2.gz	MLRNRNVUCDGOGO-UHFFFAOYSA-N	0	0	279.126	4.361	20	30		CIEDRN
N#CCCSc1ccccc1NCCOc1ccccc1	ZINC000178385781	333072004	/nfs/dbraw/zinc/07/20/04/333072004.db2.gz	HVUNDXOENPVQBX-UHFFFAOYSA-N	0	0	298.411	4.183	20	30		CIEDRN
C=CCn1c(S[C@H](C)CCC)nnc1-c1ccoc1C	ZINC000178409021	333072319	/nfs/dbraw/zinc/07/23/19/333072319.db2.gz	LIHRBRSUJMKCDX-LLVKDONJSA-N	0	0	291.420	4.313	20	30		CIEDRN
CCc1ccc(NCc2ccc(F)c(C#N)c2)cc1C	ZINC000312262910	333079013	/nfs/dbraw/zinc/07/90/13/333079013.db2.gz	MGTOTKLPDDHOAV-UHFFFAOYSA-N	0	0	268.335	4.180	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccc(Cl)cc1Cl	ZINC000006262167	333080693	/nfs/dbraw/zinc/08/06/93/333080693.db2.gz	IULMTPZPNDOKEL-UHFFFAOYSA-N	0	0	270.159	4.126	20	30		CIEDRN
C=CCCCCCNc1cc(C(=O)NC2CC2)ccc1C	ZINC000516949804	333087708	/nfs/dbraw/zinc/08/77/08/333087708.db2.gz	QYUGQSXRNIOMHJ-UHFFFAOYSA-N	0	0	286.419	4.046	20	30		CIEDRN
N#CCC[C@@H](C#N)CNc1ccccc1CCC(F)(F)F	ZINC000517129231	333093033	/nfs/dbraw/zinc/09/30/33/333093033.db2.gz	GRQTVYLEWJGBNV-LBPRGKRZSA-N	0	0	295.308	4.037	20	30		CIEDRN
CC(C)(C#N)Cc1nc(C(C)(C)C2CCCCC2)no1	ZINC000517202119	333094533	/nfs/dbraw/zinc/09/45/33/333094533.db2.gz	RYXLOTDIYJSVJA-UHFFFAOYSA-N	0	0	275.396	4.020	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(Cc2cc3ccccc3o2)no1	ZINC000517250912	333095851	/nfs/dbraw/zinc/09/58/51/333095851.db2.gz	WTLKWKSKKIMOTQ-LBPRGKRZSA-N	0	0	282.343	4.476	20	30		CIEDRN
C=C1CCN([C@H](C)c2ccccc2Br)CC1	ZINC000517468377	333100099	/nfs/dbraw/zinc/10/00/99/333100099.db2.gz	LREXUOJWBBZAEB-GFCCVEGCSA-N	0	0	280.209	4.162	20	30		CIEDRN
C=C1CCN([C@@H](C)c2ccccc2Br)CC1	ZINC000517468378	333100137	/nfs/dbraw/zinc/10/01/37/333100137.db2.gz	LREXUOJWBBZAEB-LBPRGKRZSA-N	0	0	280.209	4.162	20	30		CIEDRN
N#Cc1ccc(N[C@H]2CCC[C@@H]2c2ccccc2)cc1	ZINC000517665127	333105435	/nfs/dbraw/zinc/10/54/35/333105435.db2.gz	SVXFLQFSVZVCQI-MSOLQXFVSA-N	0	0	262.356	4.306	20	30		CIEDRN
C=CCOc1cccc(NC(=O)Nc2cccc(C)c2)c1	ZINC000517716127	333106536	/nfs/dbraw/zinc/10/65/36/333106536.db2.gz	FZFNPHAXVVNTRT-UHFFFAOYSA-N	0	0	282.343	4.204	20	30		CIEDRN
C=C1CCN(Cc2csc(C3CCCCC3)n2)CC1	ZINC000520848273	333106822	/nfs/dbraw/zinc/10/68/22/333106822.db2.gz	NTENQAIETKLMDK-UHFFFAOYSA-N	0	0	276.449	4.343	20	30		CIEDRN
C=CCN(CC=C)C(=O)[C@H]1C[C@H]1c1ccc2ccccc2c1	ZINC000520861733	333107041	/nfs/dbraw/zinc/10/70/41/333107041.db2.gz	BJCRICXUHLGPBB-OALUTQOASA-N	0	0	291.394	4.144	20	30		CIEDRN
CN(C(=O)CC(C)(C)C#N)c1ccc(-c2ccccc2)cc1	ZINC000564146318	333112874	/nfs/dbraw/zinc/11/28/74/333112874.db2.gz	QQEMASLFMDXEJC-UHFFFAOYSA-N	0	0	292.382	4.256	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@]1(C)Cc1ccccc1	ZINC000183997854	333124293	/nfs/dbraw/zinc/12/42/93/333124293.db2.gz	XJSYHPBATWBNRG-APWZRJJASA-N	0	0	285.431	4.213	20	30		CIEDRN
C=CCC(CC=C)C(=O)NCc1c(C)oc2ccccc21	ZINC000184034639	333124627	/nfs/dbraw/zinc/12/46/27/333124627.db2.gz	BRWZBUDMYAHYMG-UHFFFAOYSA-N	0	0	283.371	4.126	20	30		CIEDRN
N#Cc1cc(CSc2ccc(N)cc2Cl)ccc1F	ZINC000217981784	333125612	/nfs/dbraw/zinc/12/56/12/333125612.db2.gz	ICUFMOKCOUVBDI-UHFFFAOYSA-N	0	0	292.766	4.225	20	30		CIEDRN
CC(C)CCc1ccc(N[C@H]2CC[C@H](C#N)C2)cc1	ZINC000564159323	333132319	/nfs/dbraw/zinc/13/23/19/333132319.db2.gz	UBUFFXGAOWISQW-RDJZCZTQSA-N	0	0	256.393	4.379	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](C)c1cc2ccccc2o1	ZINC000184920471	333133259	/nfs/dbraw/zinc/13/32/59/333133259.db2.gz	NEUVXHZCHBPWOR-CHWSQXEVSA-N	0	0	271.360	4.212	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cc(Cl)ccc1F	ZINC000184993024	333134160	/nfs/dbraw/zinc/13/41/60/333134160.db2.gz	WPBBSKOCXHZCBG-SECBINFHSA-N	0	0	255.720	4.020	20	30		CIEDRN
CC#CCCCC(=O)N(Cc1ccc([C@H]2C[C@@H]2C)o1)C1CC1	ZINC000185072238	333135094	/nfs/dbraw/zinc/13/50/94/333135094.db2.gz	KZQBFDPBEKISAU-YOEHRIQHSA-N	0	0	299.414	4.088	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000185085830	333135482	/nfs/dbraw/zinc/13/54/82/333135482.db2.gz	HHTYXMOEHNGPFG-NEPJUHHUSA-N	0	0	299.336	4.485	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(Cc1ccc(F)cc1F)C1CC1	ZINC000185210743	333136805	/nfs/dbraw/zinc/13/68/05/333136805.db2.gz	YULHVWOQVQPJNZ-GFCCVEGCSA-N	0	0	293.357	4.058	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccccc1OC1CCCC1	ZINC000185205320	333136844	/nfs/dbraw/zinc/13/68/44/333136844.db2.gz	TZQHQNIDOCWRJL-UHFFFAOYSA-N	0	0	285.387	4.140	20	30		CIEDRN
CC#CCCCC(=O)NC1CCC(c2ccccc2)CC1	ZINC000185222855	333137050	/nfs/dbraw/zinc/13/70/50/333137050.db2.gz	VOTQGNRVDCQCKR-UHFFFAOYSA-N	0	0	283.415	4.023	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@@H](C)c1ccc(C)cc1	ZINC000185227573	333137066	/nfs/dbraw/zinc/13/70/66/333137066.db2.gz	HJPMMIHHGLJZOZ-GJZGRUSLSA-N	0	0	259.393	4.117	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@H](C)c1ccc(C)cc1	ZINC000185227590	333137089	/nfs/dbraw/zinc/13/70/89/333137089.db2.gz	HJPMMIHHGLJZOZ-HUUCEWRRSA-N	0	0	259.393	4.117	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CCc2cc(Cl)ccc21	ZINC000185262044	333137694	/nfs/dbraw/zinc/13/76/94/333137694.db2.gz	UISXKSHMKRBBSD-XHDPSFHLSA-N	0	0	277.795	4.046	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cccc(COC(C)C)c1	ZINC000185272133	333137924	/nfs/dbraw/zinc/13/79/24/333137924.db2.gz	BXDBOZIRFZYDKQ-AWEZNQCLSA-N	0	0	275.392	4.152	20	30		CIEDRN
CSc1cccc(C)c1NCc1ccc(C#N)cc1	ZINC000185434049	333140573	/nfs/dbraw/zinc/14/05/73/333140573.db2.gz	PMTXENOPPUKCTE-UHFFFAOYSA-N	0	0	268.385	4.201	20	30		CIEDRN
COc1cc(C#N)ccc1CNc1c(C)cccc1SC	ZINC000185445370	333140758	/nfs/dbraw/zinc/14/07/58/333140758.db2.gz	KHTPGJDDTQZNHD-UHFFFAOYSA-N	0	0	298.411	4.209	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H](c2ccccc2)CC1	ZINC000185439896	333140826	/nfs/dbraw/zinc/14/08/26/333140826.db2.gz	MKTJIVXYCZZANH-SJLPKXTDSA-N	0	0	285.431	4.385	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC(c2ccccc2C)CC1	ZINC000185491394	333141741	/nfs/dbraw/zinc/14/17/41/333141741.db2.gz	BZXXYLIPSQFUIR-MRXNPFEDSA-N	0	0	285.431	4.303	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(Oc2ccncc2)cc1	ZINC000185559230	333143922	/nfs/dbraw/zinc/14/39/22/333143922.db2.gz	ZGYBYVFRCAJRRK-CQSZACIVSA-N	0	0	296.370	4.415	20	30		CIEDRN
CC#CCCCC(=O)N(Cc1ccsc1)c1ccccc1	ZINC000185598116	333144564	/nfs/dbraw/zinc/14/45/64/333144564.db2.gz	MFYSHEIQBZHVCL-UHFFFAOYSA-N	0	0	297.423	4.475	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCC1(c2cccc(Cl)c2)CC1	ZINC000185640697	333145751	/nfs/dbraw/zinc/14/57/51/333145751.db2.gz	UCCCYVIIVIIWSJ-CYBMUJFWSA-N	0	0	291.822	4.090	20	30		CIEDRN
CC#CCCCC(=O)Nc1cccc(Oc2ccccn2)c1	ZINC000185729119	333147478	/nfs/dbraw/zinc/14/74/78/333147478.db2.gz	JAKGRXGNGMWJIL-UHFFFAOYSA-N	0	0	294.354	4.006	20	30		CIEDRN
N#C[C@H]1CCC[C@@H](Nc2ccc(CC(F)(F)F)cc2)C1	ZINC000185730415	333147488	/nfs/dbraw/zinc/14/74/88/333147488.db2.gz	QTRUMLLBBBQWQC-GXTWGEPZSA-N	0	0	282.309	4.286	20	30		CIEDRN
CCOc1cc(Cl)ccc1N[C@H]1CCC[C@H](C#N)C1	ZINC000185731322	333147517	/nfs/dbraw/zinc/14/75/17/333147517.db2.gz	CBNUGTORXWIMHB-AAEUAGOBSA-N	0	0	278.783	4.233	20	30		CIEDRN
N#C[C@H]1CCC[C@H](Nc2cccc(C(F)(F)F)c2)C1	ZINC000185735167	333147689	/nfs/dbraw/zinc/14/76/89/333147689.db2.gz	MZASERLCGGRDHQ-JQWIXIFHSA-N	0	0	268.282	4.200	20	30		CIEDRN
N#C[C@@H]1CCC[C@H](Nc2cccc(C(F)(F)F)c2)C1	ZINC000185735205	333147699	/nfs/dbraw/zinc/14/76/99/333147699.db2.gz	MZASERLCGGRDHQ-PWSUYJOCSA-N	0	0	268.282	4.200	20	30		CIEDRN
CC1CCN(c2cccc(N[C@@H]3CCC[C@@H](C#N)C3)c2)CC1	ZINC000185749421	333147917	/nfs/dbraw/zinc/14/79/17/333147917.db2.gz	KWTXLXAVOPIZBU-IAGOWNOFSA-N	0	0	297.446	4.417	20	30		CIEDRN
Cc1ccc(N[C@@H]2CCC[C@H](C#N)C2)cc1OCC(F)F	ZINC000185745293	333147959	/nfs/dbraw/zinc/14/79/59/333147959.db2.gz	OUPTZEXFGCXQCS-QWHCGFSZSA-N	0	0	294.345	4.133	20	30		CIEDRN
CC#CCCCC(=O)Nc1cccc(N2CCC(C)CC2)c1	ZINC000185870046	333150752	/nfs/dbraw/zinc/15/07/52/333150752.db2.gz	ZWUSAGYYXQGMBS-UHFFFAOYSA-N	0	0	298.430	4.055	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)[C@@H](C)c1cn(C)c2ccccc12	ZINC000185876704	333150933	/nfs/dbraw/zinc/15/09/33/333150933.db2.gz	XRUSWHBRXWTHCL-CABCVRRESA-N	0	0	298.430	4.143	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)[C@H](C)c1cn(C)c2ccccc12	ZINC000185876741	333151023	/nfs/dbraw/zinc/15/10/23/333151023.db2.gz	XRUSWHBRXWTHCL-HUUCEWRRSA-N	0	0	298.430	4.143	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC(C)(c2ccccc2)CC1	ZINC000185933309	333151975	/nfs/dbraw/zinc/15/19/75/333151975.db2.gz	WJPTYEFVFWTIHY-INIZCTEOSA-N	0	0	285.431	4.169	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)Cc1ccc(Cl)c(F)c1	ZINC000185962865	333152628	/nfs/dbraw/zinc/15/26/28/333152628.db2.gz	YSOMRGWMESDJKG-LLVKDONJSA-N	0	0	283.774	4.040	20	30		CIEDRN
C=CCC[C@H](C(=O)NC(CC)CC)c1ccccc1	ZINC000186009264	333153336	/nfs/dbraw/zinc/15/33/36/333153336.db2.gz	RUPJFTCJUVEQIL-INIZCTEOSA-N	0	0	259.393	4.041	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCCC[C@H]1CC(C)C	ZINC000186025248	333153434	/nfs/dbraw/zinc/15/34/34/333153434.db2.gz	RGUQDBQPNZXXRN-GJZGRUSLSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](CC(C)(C)C)C(F)(F)F	ZINC000186018932	333153575	/nfs/dbraw/zinc/15/35/75/333153575.db2.gz	AYLXHHPATQDQAJ-WDEREUQCSA-N	0	0	279.346	4.072	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1ccccc1OCC)c1ccccc1	ZINC000186028993	333153776	/nfs/dbraw/zinc/15/37/76/333153776.db2.gz	WUIMZGDHUYRUPW-INIZCTEOSA-N	0	0	295.382	4.384	20	30		CIEDRN
C=CC[C@H](C(=O)N(C)Cc1cccc(F)c1)c1ccccc1	ZINC000186133761	333155592	/nfs/dbraw/zinc/15/55/92/333155592.db2.gz	CXKFJFWDEMBXFW-SFHVURJKSA-N	0	0	297.373	4.144	20	30		CIEDRN
C=CCC[C@@H](C(=O)Nc1ccc(C)cn1)c1ccccc1	ZINC000186221825	333156952	/nfs/dbraw/zinc/15/69/52/333156952.db2.gz	DVGNKUWDSMOYSD-MRXNPFEDSA-N	0	0	280.371	4.079	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1ccc(Cl)cn1)c1ccccc1	ZINC000186221082	333156984	/nfs/dbraw/zinc/15/69/84/333156984.db2.gz	FZFKRMFNSDCEJO-CQSZACIVSA-N	0	0	286.762	4.033	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1cccc(COC)c1)c1ccccc1	ZINC000186583702	333163281	/nfs/dbraw/zinc/16/32/81/333163281.db2.gz	WRLSBRAHPGICAN-GOSISDBHSA-N	0	0	295.382	4.131	20	30		CIEDRN
Cc1ccc(C)c(NC(=O)Nc2cc(C#N)ccc2C)c1	ZINC000186618851	333163742	/nfs/dbraw/zinc/16/37/42/333163742.db2.gz	JYSFDRSCAXIVAO-UHFFFAOYSA-N	0	0	279.343	4.128	20	30		CIEDRN
C=C(C)CN(C)C(=O)CCCc1cccc(C(F)(F)F)c1	ZINC000186701805	333164413	/nfs/dbraw/zinc/16/44/13/333164413.db2.gz	YYPJWUDMNCLFAE-UHFFFAOYSA-N	0	0	299.336	4.063	20	30		CIEDRN
C=C(C)[C@@H](NCc1ccsc1)c1ccc(F)c(F)c1	ZINC000187370622	333169701	/nfs/dbraw/zinc/16/97/01/333169701.db2.gz	ZZLGWSQPERCRPA-OAHLLOKOSA-N	0	0	279.355	4.433	20	30		CIEDRN
C=CCCCC(=O)N(Cc1ccc(F)cc1)C(C)(C)C	ZINC000187344161	333169818	/nfs/dbraw/zinc/16/98/18/333169818.db2.gz	YQAMMPROJRJKGZ-UHFFFAOYSA-N	0	0	277.383	4.309	20	30		CIEDRN
CC#CCCCC(=O)N(Cc1ccc(F)cc1)C(C)(C)C	ZINC000187344576	333169819	/nfs/dbraw/zinc/16/98/19/333169819.db2.gz	HGYFKQNBHJBCIM-UHFFFAOYSA-N	0	0	289.394	4.146	20	30		CIEDRN
Cc1cc(Cl)ccc1CNc1ccc(C#N)cc1	ZINC000220977459	333171658	/nfs/dbraw/zinc/17/16/58/333171658.db2.gz	FEEJJJHLSGETQK-UHFFFAOYSA-N	0	0	256.736	4.132	20	30		CIEDRN
C=CC[C@@H](C(=O)N(C)Cc1ccc(C)s1)c1ccccc1	ZINC000187543358	333172335	/nfs/dbraw/zinc/17/23/35/333172335.db2.gz	BYPBIFNCEOIBDX-QGZVFWFLSA-N	0	0	299.439	4.375	20	30		CIEDRN
C=CCC[C@@H](C(=O)N1Cc2ccccc2C1)c1ccccc1	ZINC000187649429	333173345	/nfs/dbraw/zinc/17/33/45/333173345.db2.gz	DSMONWDWBXBKDB-LJQANCHMSA-N	0	0	291.394	4.279	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1ccc(F)c(OC)c1)c1ccccc1	ZINC000187649705	333173369	/nfs/dbraw/zinc/17/33/69/333173369.db2.gz	BQZWRDLUUFTEEV-OAHLLOKOSA-N	0	0	299.345	4.133	20	30		CIEDRN
CCCCC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1	ZINC000521495391	333174379	/nfs/dbraw/zinc/17/43/79/333174379.db2.gz	XKXVRMJFVZQXFG-UHFFFAOYSA-N	0	0	294.354	4.479	20	30		CIEDRN
CC(C)C[C@@H](C)CC(=O)Nc1cc(C#N)cn1C(C)(C)C	ZINC000521716599	333184626	/nfs/dbraw/zinc/18/46/26/333184626.db2.gz	HEGLTNQIQBIZEW-CYBMUJFWSA-N	0	0	289.423	4.126	20	30		CIEDRN
C=C1CCN([C@@H](C)c2ccc(F)c(Cl)c2)CC1	ZINC000521742383	333186454	/nfs/dbraw/zinc/18/64/54/333186454.db2.gz	SRVHAGYYGQFAIW-NSHDSACASA-N	0	0	253.748	4.192	20	30		CIEDRN
C=CCC[C@H](C(=O)N1CCCC2(CC2)C1)c1ccccc1	ZINC000189242285	333187366	/nfs/dbraw/zinc/18/73/66/333187366.db2.gz	WCILSFGRAVJCQT-KRWDZBQOSA-N	0	0	283.415	4.139	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1cc(F)ccc1F)c1ccccc1	ZINC000189443470	333192936	/nfs/dbraw/zinc/19/29/36/333192936.db2.gz	PCFCRLXXISURGD-AWEZNQCLSA-N	0	0	287.309	4.263	20	30		CIEDRN
C=CCC[C@H](C(=O)Nc1nc(C)cs1)c1ccccc1	ZINC000189446128	333192973	/nfs/dbraw/zinc/19/29/73/333192973.db2.gz	OCKHDAOUROSLCS-AWEZNQCLSA-N	0	0	286.400	4.140	20	30		CIEDRN
CC(C)c1ccc(CN(C)c2ccc(Cl)c(C#N)n2)cc1	ZINC000521857515	333193804	/nfs/dbraw/zinc/19/38/04/333193804.db2.gz	QCESRMXSVNDAFQ-UHFFFAOYSA-N	0	0	299.805	4.366	20	30		CIEDRN
CCC(CC)c1cc(C(=O)Nc2cc(C#N)ccc2C)on1	ZINC000172812102	335123008	/nfs/dbraw/zinc/12/30/08/335123008.db2.gz	XMJVXDHJCVUQFV-UHFFFAOYSA-N	0	0	297.358	4.011	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H](C)c1ccccc1Cl	ZINC000189859457	333199825	/nfs/dbraw/zinc/19/98/25/333199825.db2.gz	HWOUORKOGDUISW-XHDPSFHLSA-N	0	0	265.784	4.120	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)c1c(C)oc2ccccc21	ZINC000189914051	333200533	/nfs/dbraw/zinc/20/05/33/333200533.db2.gz	NRVOJUPMTJBHCU-UHFFFAOYSA-N	0	0	298.386	4.286	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@@H](C)c1cccc(OC(F)F)c1	ZINC000190573493	333208523	/nfs/dbraw/zinc/20/85/23/333208523.db2.gz	OBVMGTIGEMHXDC-ZBEGNZNMSA-N	0	0	297.345	4.068	20	30		CIEDRN
C=CCC1(C(=O)N[C@H](C)c2ccccc2Cl)CCC1	ZINC000190604549	333208830	/nfs/dbraw/zinc/20/88/30/333208830.db2.gz	FWSOHSDSIPHKTP-GFCCVEGCSA-N	0	0	277.795	4.264	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCc2c(cccc2C(C)C)C1	ZINC000190707999	333210081	/nfs/dbraw/zinc/21/00/81/333210081.db2.gz	CPIBWPSVWUIZSJ-HNNXBMFYSA-N	0	0	285.431	4.297	20	30		CIEDRN
Cc1ccc(Cl)cc1NCc1cccc(C#N)c1F	ZINC000223727786	333211534	/nfs/dbraw/zinc/21/15/34/333211534.db2.gz	DHVIKGZLJBWGGE-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
C=CCC1(C(=O)N2C[C@H](c3ccccc3)C[C@@H]2C)CCC1	ZINC000191841501	333226388	/nfs/dbraw/zinc/22/63/88/333226388.db2.gz	XCWNJQXMXWPVLF-DOTOQJQBSA-N	0	0	283.415	4.137	20	30		CIEDRN
CCc1nc(C)c([C@H](C)N(C)CC#Cc2ccccc2)s1	ZINC000192039240	333228676	/nfs/dbraw/zinc/22/86/76/333228676.db2.gz	UEFYNMPJEGFASO-HNNXBMFYSA-N	0	0	298.455	4.058	20	30		CIEDRN
CCCC1CCC(N(C)C(=O)c2cccc(CC#N)c2)CC1	ZINC000192268121	333233680	/nfs/dbraw/zinc/23/36/80/333233680.db2.gz	GYLAAMCLBGBRCU-UHFFFAOYSA-N	0	0	298.430	4.184	20	30		CIEDRN
C=C(C)CN(C)C(=O)Nc1cc(Cl)c(F)c(Cl)c1	ZINC000192421472	333235593	/nfs/dbraw/zinc/23/55/93/333235593.db2.gz	XVMHSLIZURMPJB-UHFFFAOYSA-N	0	0	291.153	4.172	20	30		CIEDRN
CCCCN(C(=O)c1cccc(C#N)c1)[C@H]1CCC[C@H](C)C1	ZINC000575896350	335129202	/nfs/dbraw/zinc/12/92/02/335129202.db2.gz	LCBNZLKHBGISSN-YJBOKZPZSA-N	0	0	298.430	4.379	20	30		CIEDRN
N#Cc1ccnc(SCCc2c(F)cccc2Cl)c1	ZINC000195713978	333261364	/nfs/dbraw/zinc/26/13/64/333261364.db2.gz	MLZOWSOOMWMMNQ-UHFFFAOYSA-N	0	0	292.766	4.081	20	30		CIEDRN
C=CCN(CCc1ccccc1)C(=O)N[C@@H](CC)CCC	ZINC000195725840	333262070	/nfs/dbraw/zinc/26/20/70/333262070.db2.gz	SWGAFVJJWAMUFL-KRWDZBQOSA-N	0	0	288.435	4.005	20	30		CIEDRN
CCc1ccccc1C(=O)Nc1ccc(C#N)cc1Cl	ZINC000226654094	333267128	/nfs/dbraw/zinc/26/71/28/333267128.db2.gz	XMUKRGZINDLCAV-UHFFFAOYSA-N	0	0	284.746	4.026	20	30		CIEDRN
C=CCC[C@H](C)Nc1ccc(C)c(C(=O)N(C)C(C)C)c1	ZINC000194238946	333267923	/nfs/dbraw/zinc/26/79/23/333267923.db2.gz	HHPUQECCWIKJEP-HNNXBMFYSA-N	0	0	288.435	4.242	20	30		CIEDRN
N#Cc1c(F)cccc1Sc1c(F)cc(F)cc1F	ZINC000522285176	333279108	/nfs/dbraw/zinc/27/91/08/333279108.db2.gz	JCXLPBFELICDIL-UHFFFAOYSA-N	0	0	283.249	4.266	20	30		CIEDRN
CS[C@@H]1CCC[C@@H](Nc2ccc(Cl)cc2C#N)C1	ZINC000227358030	333281683	/nfs/dbraw/zinc/28/16/83/333281683.db2.gz	UGQABLPTUVILGM-CHWSQXEVSA-N	0	0	280.824	4.298	20	30		CIEDRN
C[C@H](CCC1CCCCC1)NC(=O)c1sccc1C#N	ZINC000522314541	333282388	/nfs/dbraw/zinc/28/23/88/333282388.db2.gz	ICBOLYMCIYHPEW-GFCCVEGCSA-N	0	0	290.432	4.099	20	30		CIEDRN
C[C@H]1C[C@@H](c2ccccc2)CN1c1c(F)cc(C#N)cc1F	ZINC000522405283	333286524	/nfs/dbraw/zinc/28/65/24/333286524.db2.gz	ZNXUHMNBBUCUJH-SWLSCSKDSA-N	0	0	298.336	4.219	20	30		CIEDRN
C=CCNC(=O)Nc1ccccc1O[C@@H](C)c1ccccc1	ZINC000522462889	333287554	/nfs/dbraw/zinc/28/75/54/333287554.db2.gz	HELZQJJGLFXKMK-AWEZNQCLSA-N	0	0	296.370	4.134	20	30		CIEDRN
C=CCCC(=O)N(C)[C@@H](C)c1ccc(Cl)c(Cl)c1	ZINC000522473211	333287788	/nfs/dbraw/zinc/28/77/88/333287788.db2.gz	IAKPWPINRZFZKW-JTQLQIEISA-N	0	0	286.202	4.479	20	30		CIEDRN
C=CCCC(=O)Nc1nc(-c2ccc(CC)cc2)cs1	ZINC000522484399	333288034	/nfs/dbraw/zinc/28/80/34/333288034.db2.gz	JERWGBYTUFWCQA-UHFFFAOYSA-N	0	0	286.400	4.277	20	30		CIEDRN
C=CCCC(=O)Nc1nc(-c2ccccc2)c(CC)s1	ZINC000522571586	333290523	/nfs/dbraw/zinc/29/05/23/333290523.db2.gz	DAQHISLIPGXYCH-UHFFFAOYSA-N	0	0	286.400	4.277	20	30		CIEDRN
N#Cc1ccc(OCc2cccc(Cl)c2F)c(F)c1	ZINC000228023122	333292827	/nfs/dbraw/zinc/29/28/27/333292827.db2.gz	KNIDYHHHMWBVAF-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
N#Cc1ccc(NCc2cccc3cc[nH]c32)cc1Cl	ZINC000228032283	333293107	/nfs/dbraw/zinc/29/31/07/333293107.db2.gz	LWLQIOZVYGULSY-UHFFFAOYSA-N	0	0	281.746	4.305	20	30		CIEDRN
C=CC[C@H](C)NC(=O)c1cc2ccc(C(C)(C)C)cc2[nH]1	ZINC000522642356	333294244	/nfs/dbraw/zinc/29/42/44/333294244.db2.gz	FXCJCIJXQUJIHQ-LBPRGKRZSA-N	0	0	284.403	4.160	20	30		CIEDRN
C[C@@H](CC(=O)N[C@@]1(C#N)CCC[C@@H](C)C1)C1CCCCC1	ZINC000522644453	333294532	/nfs/dbraw/zinc/29/45/32/333294532.db2.gz	WAKIZGFOAXFIBX-VKJFTORMSA-N	0	0	290.451	4.182	20	30		CIEDRN
C=CC[C@H](C)NC(=O)c1c[nH]cc1-c1ccc(Cl)s1	ZINC000522645287	333294644	/nfs/dbraw/zinc/29/46/44/333294644.db2.gz	MJCMGRGFWJISMX-VIFPVBQESA-N	0	0	294.807	4.091	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1ccc2c(ccn2CC(C)C)c1	ZINC000522654820	333295083	/nfs/dbraw/zinc/29/50/83/333295083.db2.gz	JESUQOYCHNBPQC-CQSZACIVSA-N	0	0	299.418	4.383	20	30		CIEDRN
C=CCCCN(C)C(=O)c1sc2cccc(F)c2c1C	ZINC000522953623	333300964	/nfs/dbraw/zinc/30/09/64/333300964.db2.gz	MOGRXEYHOHTTNR-UHFFFAOYSA-N	0	0	291.391	4.387	20	30		CIEDRN
C=CCN(CC=C)C(=O)C[C@H](CC)c1ccc(C)cc1	ZINC000523083987	333307228	/nfs/dbraw/zinc/30/72/28/333307228.db2.gz	DBIMBXMTBQHSST-INIZCTEOSA-N	0	0	271.404	4.079	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)CCC(C)(C)C	ZINC000523103143	333308876	/nfs/dbraw/zinc/30/88/76/333308876.db2.gz	WOTIUFWTFLUOAW-UHFFFAOYSA-N	0	0	265.422	4.089	20	30		CIEDRN
C=CCN(CCc1ccccc1)C(=O)C1CCCCCC1	ZINC000523153451	333311481	/nfs/dbraw/zinc/31/14/81/333311481.db2.gz	JRYZCCFAOLYLRX-UHFFFAOYSA-N	0	0	285.431	4.214	20	30		CIEDRN
C=CCCC(=O)NCc1ccc(Oc2ccccc2)cc1	ZINC000523277283	333313557	/nfs/dbraw/zinc/31/35/57/333313557.db2.gz	YHPLGLQEQHFVFH-UHFFFAOYSA-N	0	0	281.355	4.061	20	30		CIEDRN
N#Cc1ccc(OCc2ccc(F)c(Cl)c2)c(F)c1	ZINC000230400871	333317067	/nfs/dbraw/zinc/31/70/67/333317067.db2.gz	JTKFIMDSCFJSHO-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
CS[C@@H]1CCC[C@H](Nc2c(C#N)cnc3ccccc32)C1	ZINC000230906983	333322432	/nfs/dbraw/zinc/32/24/32/333322432.db2.gz	JCOIBCATFMSFRB-UONOGXRCSA-N	0	0	297.427	4.193	20	30		CIEDRN
Cc1cc(C#N)ccc1-c1nc([C@@H]2CCC[C@@H](C)C2)no1	ZINC000230997652	333323600	/nfs/dbraw/zinc/32/36/00/333323600.db2.gz	LPLFOMZYLOQQLU-BXUZGUMPSA-N	0	0	281.359	4.210	20	30		CIEDRN
C[C@@H](CC(F)(F)F)Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000231749743	333329093	/nfs/dbraw/zinc/32/90/93/333329093.db2.gz	MIXGJHHMDLUAOG-ZETCQYMHSA-N	0	0	296.214	4.330	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@@H]1CCCc2ccccc21	ZINC000523510515	333331217	/nfs/dbraw/zinc/33/12/17/333331217.db2.gz	LVVNENRMTNCWQP-GOSISDBHSA-N	0	0	285.431	4.311	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@H](CC)c1ccccc1	ZINC000523512612	333331590	/nfs/dbraw/zinc/33/15/90/333331590.db2.gz	IXLUMBHQHQJTNR-QGZVFWFLSA-N	0	0	273.420	4.385	20	30		CIEDRN
C=CCCCCCN(C)C(=O)C(C)(C)c1ccc(F)cc1	ZINC000523512545	333331651	/nfs/dbraw/zinc/33/16/51/333331651.db2.gz	FKFUTWWFVKKQHM-UHFFFAOYSA-N	0	0	291.410	4.308	20	30		CIEDRN
CCC(C)(C)c1ccc(Oc2nc(C)cc(C#N)n2)cc1	ZINC000231907967	333331847	/nfs/dbraw/zinc/33/18/47/333331847.db2.gz	BMFZDTNVDMRGLC-UHFFFAOYSA-N	0	0	281.359	4.137	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Nc1cc(F)cc(F)c1	ZINC000523557811	333333062	/nfs/dbraw/zinc/33/30/62/333333062.db2.gz	BDTJLXIBWXBMNY-UHFFFAOYSA-N	0	0	282.334	4.175	20	30		CIEDRN
CCCCCc1ccc(NCc2cc(C#N)n(C)c2)cc1	ZINC000232313914	333335623	/nfs/dbraw/zinc/33/56/23/333335623.db2.gz	RSABJIRTAUOOLR-UHFFFAOYSA-N	0	0	281.403	4.242	20	30		CIEDRN
CC(C)(C#N)CCCCOc1ccc([N+](=O)[O-])cc1Cl	ZINC000232521074	333337920	/nfs/dbraw/zinc/33/79/20/333337920.db2.gz	KSTWIJQELYHYME-UHFFFAOYSA-N	0	0	296.754	4.347	20	30		CIEDRN
CC(C)(C#N)CCCCOc1ccc2c(c1)CCCC2=O	ZINC000232522360	333337930	/nfs/dbraw/zinc/33/79/30/333337930.db2.gz	TZUPKUBHPNOOQR-UHFFFAOYSA-N	0	0	285.387	4.304	20	30		CIEDRN
COc1c(C)ccc(N[C@@H](C#N)C2CCCCC2)c1C	ZINC000523740539	333343137	/nfs/dbraw/zinc/34/31/37/333343137.db2.gz	RHKYUFCRKVZLOS-INIZCTEOSA-N	0	0	272.392	4.196	20	30		CIEDRN
CC(C)[C@H](CC1CCCC1)C(=O)NCC#Cc1ccccc1	ZINC000523840101	333347715	/nfs/dbraw/zinc/34/77/15/333347715.db2.gz	TZHFZCOMIGIWCS-IBGZPJMESA-N	0	0	297.442	4.007	20	30		CIEDRN
C=C(C)CN(CC)C(=O)[C@H](C)Sc1cccc(Cl)c1	ZINC000523869758	333348824	/nfs/dbraw/zinc/34/88/24/333348824.db2.gz	DLHLKYWPBMPEJE-LBPRGKRZSA-N	0	0	297.851	4.245	20	30		CIEDRN
C[C@H](CSc1ccc(C#N)cc1)c1ccccc1	ZINC000523932419	333349649	/nfs/dbraw/zinc/34/96/49/333349649.db2.gz	NZKRHLKIMQLJDT-CYBMUJFWSA-N	0	0	253.370	4.454	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@H](CC(C)C)c1cccs1	ZINC000523949190	333349977	/nfs/dbraw/zinc/34/99/77/333349977.db2.gz	OGWCCHWLXJAPCJ-QWHCGFSZSA-N	0	0	280.437	4.099	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@H](CC(C)C)c1cccs1	ZINC000523949188	333350022	/nfs/dbraw/zinc/35/00/22/333350022.db2.gz	OGWCCHWLXJAPCJ-CHWSQXEVSA-N	0	0	280.437	4.099	20	30		CIEDRN
Cc1nc2ccccc2cc1OCc1ccc(C#N)cc1F	ZINC000575958480	335135301	/nfs/dbraw/zinc/13/53/01/335135301.db2.gz	STTGJWOYSNXVFA-UHFFFAOYSA-N	0	0	292.313	4.133	20	30		CIEDRN
C=CCCCN(C)C(=O)c1cn(CC(C)C)c2ccccc12	ZINC000524069431	333352795	/nfs/dbraw/zinc/35/27/95/333352795.db2.gz	CRHBOQPXLYQOPA-UHFFFAOYSA-N	0	0	298.430	4.336	20	30		CIEDRN
C=CCCCN(C)c1ncc(C(F)(F)F)cc1Cl	ZINC000524067658	333352823	/nfs/dbraw/zinc/35/28/23/333352823.db2.gz	FRXWLEGBXYQPQN-UHFFFAOYSA-N	0	0	278.705	4.156	20	30		CIEDRN
CC(C)C[C@H](C)CC(=O)Nc1sc2c(c1C#N)CCC2	ZINC000524088578	333353032	/nfs/dbraw/zinc/35/30/32/333353032.db2.gz	KEDPGIRBHYCPFI-NSHDSACASA-N	0	0	290.432	4.119	20	30		CIEDRN
CC[C@@H](Nc1nccc(C#N)c1Cl)c1ccccc1	ZINC000233905959	333356088	/nfs/dbraw/zinc/35/60/88/333356088.db2.gz	CVJHLZMEKPVFJA-CYBMUJFWSA-N	0	0	271.751	4.170	20	30		CIEDRN
C=CCc1ccc(OCc2ccc(F)c(F)c2)c(OC)c1	ZINC000524230770	333356886	/nfs/dbraw/zinc/35/68/86/333356886.db2.gz	OWOUTYGQBNWWHG-UHFFFAOYSA-N	0	0	290.309	4.281	20	30		CIEDRN
Cc1sc(NC(=O)C[C@H](C)CC(C)C)c(C#N)c1C	ZINC000524243343	333357703	/nfs/dbraw/zinc/35/77/03/333357703.db2.gz	CJDSJDQBEJEAIE-SNVBAGLBSA-N	0	0	278.421	4.247	20	30		CIEDRN
Cc1sc(NC(=O)C[C@@H](C)CC(C)C)c(C#N)c1C	ZINC000524243342	333357727	/nfs/dbraw/zinc/35/77/27/333357727.db2.gz	CJDSJDQBEJEAIE-JTQLQIEISA-N	0	0	278.421	4.247	20	30		CIEDRN
COc1cc(CNc2ccc(C(C)C)cc2)ccc1C#N	ZINC000234902601	333362940	/nfs/dbraw/zinc/36/29/40/333362940.db2.gz	IUNXRUZZBXMXAS-UHFFFAOYSA-N	0	0	280.371	4.302	20	30		CIEDRN
CC(C)CC[C@H](NC(=O)c1cccc(C#N)c1)C(C)(C)C	ZINC000524529627	333364971	/nfs/dbraw/zinc/36/49/71/333364971.db2.gz	VJOCAGWAMFIFAR-INIZCTEOSA-N	0	0	286.419	4.139	20	30		CIEDRN
Cc1ccc(C[NH2+][C@H](C)c2ccc(C#N)cc2)cc1Cl	ZINC000235224249	333366810	/nfs/dbraw/zinc/36/68/10/333366810.db2.gz	KSAXWGVYWFMHPK-CYBMUJFWSA-N	0	0	284.790	4.371	20	30		CIEDRN
C[C@H](Nc1nccc(C#N)c1Cl)c1cccc(Cl)c1	ZINC000235538894	333370570	/nfs/dbraw/zinc/37/05/70/333370570.db2.gz	VLAAFZLARWHMJW-VIFPVBQESA-N	0	0	292.169	4.433	20	30		CIEDRN
N#Cc1cccc(Cl)c1NC[C@@H]1CCc2ccccc2N1	ZINC000524689283	333371345	/nfs/dbraw/zinc/37/13/45/333371345.db2.gz	AGZDZVSNFLPPPI-AWEZNQCLSA-N	0	0	297.789	4.050	20	30		CIEDRN
N#Cc1cccc(Cl)c1NC[C@H]1CCc2ccccc2N1	ZINC000524689284	333371419	/nfs/dbraw/zinc/37/14/19/333371419.db2.gz	AGZDZVSNFLPPPI-CQSZACIVSA-N	0	0	297.789	4.050	20	30		CIEDRN
Cc1ccc([N+](=O)[O-])cc1OCCCCC(C)(C)C#N	ZINC000235769571	333371991	/nfs/dbraw/zinc/37/19/91/333371991.db2.gz	JAEBDTQUWBPZKU-UHFFFAOYSA-N	0	0	276.336	4.002	20	30		CIEDRN
Cc1ccccc1Sc1nccc(C#N)c1Cl	ZINC000235803892	333372222	/nfs/dbraw/zinc/37/22/22/333372222.db2.gz	CNXKAXPNRSTABE-UHFFFAOYSA-N	0	0	260.749	4.066	20	30		CIEDRN
Cc1ccc(CNc2ccc(C#N)cc2)cc1Cl	ZINC000235880708	333372521	/nfs/dbraw/zinc/37/25/21/333372521.db2.gz	GTCABXUDRKDZGB-UHFFFAOYSA-N	0	0	256.736	4.132	20	30		CIEDRN
Cc1csc(C(=O)Nc2cc(C#N)ccc2C)c1Cl	ZINC000235964967	333372744	/nfs/dbraw/zinc/37/27/44/333372744.db2.gz	WZDRYKNOAOGBGZ-UHFFFAOYSA-N	0	0	290.775	4.142	20	30		CIEDRN
C=CCOc1ccc(CNc2ccc3ncccc3c2)cc1	ZINC000236685771	333374520	/nfs/dbraw/zinc/37/45/20/333374520.db2.gz	JWVFRQLBXFHVGJ-UHFFFAOYSA-N	0	0	290.366	4.412	20	30		CIEDRN
Cc1cc(N2CCCC2)ccc1NCc1cccc(C#N)c1	ZINC000237672552	333380878	/nfs/dbraw/zinc/38/08/78/333380878.db2.gz	AORQLAGOXDVMDT-UHFFFAOYSA-N	0	0	291.398	4.079	20	30		CIEDRN
CC(C)(C)c1ccc(C(=O)N[C@H](C#N)C2CCCCC2)cc1	ZINC000316099567	333385391	/nfs/dbraw/zinc/38/53/91/333385391.db2.gz	MQESNMOGQFUHFC-QGZVFWFLSA-N	0	0	298.430	4.186	20	30		CIEDRN
C=CCCCNc1cccc(-c2nc(C)cs2)c1	ZINC000524840261	333389919	/nfs/dbraw/zinc/38/99/19/333389919.db2.gz	SJMNDIPCIBNMLY-UHFFFAOYSA-N	0	0	258.390	4.497	20	30		CIEDRN
C=CCCCNc1cccc(C(=O)c2ccccc2)c1	ZINC000524842718	333389938	/nfs/dbraw/zinc/38/99/38/333389938.db2.gz	PCUIPDVRFAEFQF-UHFFFAOYSA-N	0	0	265.356	4.296	20	30		CIEDRN
N#Cc1ccc(N[C@H]2C[C@@H]2c2c(F)cccc2Cl)cc1	ZINC000524842857	333390072	/nfs/dbraw/zinc/39/00/72/333390072.db2.gz	YFEHQJYJJBDPMF-WFASDCNBSA-N	0	0	286.737	4.319	20	30		CIEDRN
C=CCCCNc1cccc(OCC(F)(F)F)c1C	ZINC000524844269	333390170	/nfs/dbraw/zinc/39/01/70/333390170.db2.gz	QOJWEPPJVJDIJA-UHFFFAOYSA-N	0	0	273.298	4.314	20	30		CIEDRN
C=CCCCNc1cc(OC)ccc1OCCCC	ZINC000524843976	333390260	/nfs/dbraw/zinc/39/02/60/333390260.db2.gz	BXSFYVZNJBERPN-UHFFFAOYSA-N	0	0	263.381	4.252	20	30		CIEDRN
C=CCN(CC=C)Cc1cc(Cl)ccc1Cl	ZINC000525120301	333398533	/nfs/dbraw/zinc/39/85/33/333398533.db2.gz	LRQVNJASQHTUQK-UHFFFAOYSA-N	0	0	256.176	4.167	20	30		CIEDRN
CC#CC[N@H+](Cc1ccccc1)[C@@H](C)c1cccs1	ZINC000525119948	333399305	/nfs/dbraw/zinc/39/93/05/333399305.db2.gz	FFMUSDWETFCHJH-HNNXBMFYSA-N	0	0	269.413	4.335	20	30		CIEDRN
COc1ccc(C#N)cc1CNc1cccc2c1CCCC2	ZINC000316617942	333402000	/nfs/dbraw/zinc/40/20/00/333402000.db2.gz	KQVGOPMKPUMFMJ-UHFFFAOYSA-N	0	0	292.382	4.058	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H](C)Cc2ccccc2)n1	ZINC000576009142	335141337	/nfs/dbraw/zinc/14/13/37/335141337.db2.gz	UOGPOJYTXJYMAO-CYBMUJFWSA-N	0	0	270.376	4.270	20	30		CIEDRN
Cc1cccc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)c1F	ZINC000316857035	333405540	/nfs/dbraw/zinc/40/55/40/333405540.db2.gz	OOSGGKZALSGCTI-UHFFFAOYSA-N	0	0	296.345	4.188	20	30		CIEDRN
N#Cc1ccc(NCCSc2ccccc2)cc1Cl	ZINC000061846087	333449725	/nfs/dbraw/zinc/44/97/25/333449725.db2.gz	GJRAJVLDCHKVRG-UHFFFAOYSA-N	0	0	288.803	4.416	20	30		CIEDRN
Cc1nsc(Sc2nc3ccccc3s2)c1C#N	ZINC000576020550	335142395	/nfs/dbraw/zinc/14/23/95/335142395.db2.gz	AFIMGCAAPOEHNY-UHFFFAOYSA-N	0	0	289.410	4.084	20	30		CIEDRN
CCC(C#N)(CC)C(=O)Nc1ccc2occ(C)c2c1	ZINC000529065233	333471182	/nfs/dbraw/zinc/47/11/82/333471182.db2.gz	RZCDHNDGWXKNTP-UHFFFAOYSA-N	0	0	270.332	4.010	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1cc2cscc2s1	ZINC000529197516	333476670	/nfs/dbraw/zinc/47/66/70/333476670.db2.gz	DVVNCPKVXOKYEY-NSHDSACASA-N	0	0	277.414	4.144	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)[C@@H]1CCCC12CC2	ZINC000529219303	333477487	/nfs/dbraw/zinc/47/74/87/333477487.db2.gz	RHOWLNOSLJDUQO-KRWDZBQOSA-N	0	0	283.415	4.172	20	30		CIEDRN
C=C(C)CNC(=O)Nc1ccc(Cl)cc1C(C)C	ZINC000529242360	333478701	/nfs/dbraw/zinc/47/87/01/333478701.db2.gz	GMZAIMBBUSHELC-UHFFFAOYSA-N	0	0	266.772	4.161	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1sc2ncccc2c1Cl	ZINC000529252241	333479701	/nfs/dbraw/zinc/47/97/01/333479701.db2.gz	FLOQRYFCJQFGQM-SECBINFHSA-N	0	0	294.807	4.034	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)[C@@H]1CCCC12CC2	ZINC000529271517	333480627	/nfs/dbraw/zinc/48/06/27/333480627.db2.gz	JHRAREVHBIBUDH-HNNXBMFYSA-N	0	0	269.388	4.324	20	30		CIEDRN
COc1c(C)ccc(N[C@@H](C)c2ccc(C#N)cc2)c1C	ZINC000037125845	333490333	/nfs/dbraw/zinc/49/03/33/333490333.db2.gz	QKMIMUFMQHUHNX-AWEZNQCLSA-N	0	0	280.371	4.357	20	30		CIEDRN
COc1cccc(SCCCOc2cccc(C#N)c2)c1	ZINC000037143578	333497945	/nfs/dbraw/zinc/49/79/45/333497945.db2.gz	WVUFTWYPLNLCRY-UHFFFAOYSA-N	0	0	299.395	4.128	20	30		CIEDRN
N#Cc1ccccc1OCCSc1ccc(F)c(F)c1	ZINC000037143754	333500908	/nfs/dbraw/zinc/50/09/08/333500908.db2.gz	GALLEXASBKIIKA-UHFFFAOYSA-N	0	0	291.322	4.008	20	30		CIEDRN
C=CCCC(=O)N1CC=C(c2ccc(Cl)cc2C)CC1	ZINC000529941785	333515283	/nfs/dbraw/zinc/51/52/83/333515283.db2.gz	UMLWWRRQPYPEJO-UHFFFAOYSA-N	0	0	289.806	4.230	20	30		CIEDRN
C=CCCCC(=O)N1CC[C@@H](c2cccc(F)c2)C1(C)C	ZINC000530036597	333520859	/nfs/dbraw/zinc/52/08/59/333520859.db2.gz	NMDCSAJLPPGTDT-INIZCTEOSA-N	0	0	289.394	4.277	20	30		CIEDRN
COc1ccc(CNc2ccc(Cl)c(C#N)c2)cc1C	ZINC000037282119	333530433	/nfs/dbraw/zinc/53/04/33/333530433.db2.gz	PDXDGSQSLUNUBO-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
N#Cc1ccc(F)c(CSc2ccc(F)cc2F)c1	ZINC000037375162	333532538	/nfs/dbraw/zinc/53/25/38/333532538.db2.gz	JAFWJDHWTDBKBT-UHFFFAOYSA-N	0	0	279.286	4.268	20	30		CIEDRN
CCOc1cccc(N[C@H](C)c2cccc(C#N)c2)c1	ZINC000037780429	333539901	/nfs/dbraw/zinc/53/99/01/333539901.db2.gz	CDHIDJATDTWMEK-CYBMUJFWSA-N	0	0	266.344	4.130	20	30		CIEDRN
C=CCOc1ccc(CNc2cccc(OCC)c2)cc1	ZINC000037780578	333539942	/nfs/dbraw/zinc/53/99/42/333539942.db2.gz	CGRIGVUODDXPSF-UHFFFAOYSA-N	0	0	283.371	4.262	20	30		CIEDRN
C=CCN(C(=O)c1ccc2c(c1)Cc1ccccc1-2)C1CC1	ZINC000537929376	333547548	/nfs/dbraw/zinc/54/75/48/333547548.db2.gz	HGBLCHRIICRGGX-UHFFFAOYSA-N	0	0	289.378	4.048	20	30		CIEDRN
Cc1ccc(Cl)c(NCc2cc(C#N)cs2)c1	ZINC000124057315	333555675	/nfs/dbraw/zinc/55/56/75/333555675.db2.gz	MSSWZJJKMOUSRB-UHFFFAOYSA-N	0	0	262.765	4.194	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc(-c2cnco2)cc1	ZINC000124913899	333562332	/nfs/dbraw/zinc/56/23/32/333562332.db2.gz	YTAUPWFYQVBUSA-UHFFFAOYSA-N	0	0	282.343	4.049	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@@H]1C1CCCCC1	ZINC000125120894	333564101	/nfs/dbraw/zinc/56/41/01/333564101.db2.gz	TVXDCZXIVUFYRJ-QGZVFWFLSA-N	0	0	275.436	4.326	20	30		CIEDRN
C=C(CC)CNc1ccc(C)c(NC(=O)C(C)(C)C)c1	ZINC000537996471	333569897	/nfs/dbraw/zinc/56/98/97/333569897.db2.gz	YTJVSNSDQDDUSJ-UHFFFAOYSA-N	0	0	274.408	4.358	20	30		CIEDRN
C=C(CC)CS[C@H](C)c1nc(Cc2ccccc2)no1	ZINC000537994005	333569903	/nfs/dbraw/zinc/56/99/03/333569903.db2.gz	XPKCQOWVWBRVGU-CYBMUJFWSA-N	0	0	288.416	4.421	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N[C@@H](C)c1cccc(F)c1F	ZINC000538287862	333583101	/nfs/dbraw/zinc/58/31/01/333583101.db2.gz	SGCFLJLFUCCDBV-RYUDHWBXSA-N	0	0	296.361	4.070	20	30		CIEDRN
C=CCCOCCCCC(=O)N1CCCC[C@H]1[C@H](C)CC	ZINC000538302668	333583758	/nfs/dbraw/zinc/58/37/58/333583758.db2.gz	YWRXFNXJWYWTHB-SJORKVTESA-N	0	0	295.467	4.177	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)CCCOc1cccc(C)c1	ZINC000538326885	333585460	/nfs/dbraw/zinc/58/54/60/333585460.db2.gz	WOCGDVAMDBAKAZ-INIZCTEOSA-N	0	0	289.419	4.015	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1ccc(Cl)cc1Cl	ZINC000538327704	333585488	/nfs/dbraw/zinc/58/54/88/333585488.db2.gz	IURFTCOOKNRZST-SNVBAGLBSA-N	0	0	286.202	4.468	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Cc1ccc(C)cc1Cl	ZINC000538327903	333585521	/nfs/dbraw/zinc/58/55/21/333585521.db2.gz	FOULXQOUTZYJQN-ZDUSSCGKSA-N	0	0	279.811	4.052	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)C1(CC(C)C)CCC1	ZINC000538335491	333585958	/nfs/dbraw/zinc/58/59/58/333585958.db2.gz	JPBLUYXZQLFKGF-AWEZNQCLSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1cccc2cccnc21	ZINC000538340137	333586115	/nfs/dbraw/zinc/58/61/15/333586115.db2.gz	WWEKQAHRWOGUML-ZDUSSCGKSA-N	0	0	283.375	4.101	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)CCc1ccccc1Cl	ZINC000538422299	333591517	/nfs/dbraw/zinc/59/15/17/333591517.db2.gz	KHRQVAMIXLFIIG-CYBMUJFWSA-N	0	0	279.811	4.134	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2ccc3cc[nH]c3c2)no1	ZINC000576072036	335149325	/nfs/dbraw/zinc/14/93/25/335149325.db2.gz	SOJUOOBZPBZFPQ-LLVKDONJSA-N	0	0	267.332	4.288	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@@H](C)c1ccc(Cl)cc1	ZINC000126579997	333600181	/nfs/dbraw/zinc/60/01/81/333600181.db2.gz	PNQUEESEWXYCGR-LBPRGKRZSA-N	0	0	280.799	4.009	20	30		CIEDRN
Cc1cscc1N[C@@H](C)c1ccc(C#N)c(F)c1	ZINC000538550294	333605607	/nfs/dbraw/zinc/60/56/07/333605607.db2.gz	WRBLFSMDISFBNI-JTQLQIEISA-N	0	0	260.337	4.240	20	30		CIEDRN
C=CCn1c(SC[C@H](C)CC(C)C)nnc1C1CC1	ZINC000538570121	333606908	/nfs/dbraw/zinc/60/69/08/333606908.db2.gz	PXXWWOLAKQNOME-GFCCVEGCSA-N	0	0	279.453	4.116	20	30		CIEDRN
C=C(CC)CS[C@@H](C)C(=O)N1CCCc2ccccc21	ZINC000539094956	333657635	/nfs/dbraw/zinc/65/76/35/333657635.db2.gz	FUBUOLSHDLPLQI-AWEZNQCLSA-N	0	0	289.444	4.054	20	30		CIEDRN
C=C(CC)CS[C@H](C)C(=O)N1CCCc2ccccc21	ZINC000539094957	333657683	/nfs/dbraw/zinc/65/76/83/333657683.db2.gz	FUBUOLSHDLPLQI-CQSZACIVSA-N	0	0	289.444	4.054	20	30		CIEDRN
C=C(CC)CSCC(=O)N[C@H](C)c1ccccc1Cl	ZINC000539094798	333657723	/nfs/dbraw/zinc/65/77/23/333657723.db2.gz	NISISINUJFVULH-GFCCVEGCSA-N	0	0	297.851	4.217	20	30		CIEDRN
CC(C)Oc1ccccc1[C@H](C)NCc1ccccc1C#N	ZINC000539224656	333662080	/nfs/dbraw/zinc/66/20/80/333662080.db2.gz	CGKYMZKXAJSAGB-HNNXBMFYSA-N	0	0	294.398	4.196	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N1CCC[C@]2(CC=CCC2)C1	ZINC000539390743	333668764	/nfs/dbraw/zinc/66/87/64/333668764.db2.gz	WBFLNWQIPYLLGK-SJLPKXTDSA-N	0	0	290.451	4.263	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1cccc(SCC)c1	ZINC000539435602	333671033	/nfs/dbraw/zinc/67/10/33/333671033.db2.gz	NLMNDXHBECGNIA-CYBMUJFWSA-N	0	0	277.433	4.273	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)C[C@H](C)c1ccccc1F	ZINC000539438088	333671547	/nfs/dbraw/zinc/67/15/47/333671547.db2.gz	VETYUDRYCKOFJT-KBPBESRZSA-N	0	0	277.383	4.180	20	30		CIEDRN
C=CCCOCCCCC(=O)Nc1cccc(C(F)F)c1	ZINC000539501710	333674691	/nfs/dbraw/zinc/67/46/91/333674691.db2.gz	GTCSTFMOXWQCRC-UHFFFAOYSA-N	0	0	297.345	4.326	20	30		CIEDRN
Cc1cccc(N[C@@H](C)c2ccc(C#N)c(F)c2)c1	ZINC000539608939	333680579	/nfs/dbraw/zinc/68/05/79/333680579.db2.gz	MZXIDSDMRNYHGA-LBPRGKRZSA-N	0	0	254.308	4.179	20	30		CIEDRN
C=C[C@H](CC(=O)NCCCc1cccs1)c1ccccc1	ZINC000539900973	333702134	/nfs/dbraw/zinc/70/21/34/333702134.db2.gz	NADHBBMUIWSUAO-OAHLLOKOSA-N	0	0	299.439	4.157	20	30		CIEDRN
N#Cc1c(Cl)cccc1SCc1cn2ccccc2n1	ZINC000540050613	333706868	/nfs/dbraw/zinc/70/68/68/333706868.db2.gz	WBKCYBYQWNQSAT-UHFFFAOYSA-N	0	0	299.786	4.152	20	30		CIEDRN
C=CCCCN(C)C(=O)C[C@@H](C)Cc1ccc(Cl)cc1	ZINC000540107166	333709764	/nfs/dbraw/zinc/70/97/64/333709764.db2.gz	GPVBRHVMMZPGFE-AWEZNQCLSA-N	0	0	293.838	4.333	20	30		CIEDRN
C=CCN(C(=O)Cc1ccc(-c2ccccc2)cc1)C1CC1	ZINC000540133197	333711113	/nfs/dbraw/zinc/71/11/13/333711113.db2.gz	BRGNBCTVVOBNOP-UHFFFAOYSA-N	0	0	291.394	4.073	20	30		CIEDRN
C=C(CC)CSCc1nc(CCc2ccccc2)no1	ZINC000540193272	333720138	/nfs/dbraw/zinc/72/01/38/333720138.db2.gz	MWCHHUGQLJABMF-UHFFFAOYSA-N	0	0	288.416	4.054	20	30		CIEDRN
N#Cc1cc(CNc2c(F)cc(Cl)cc2F)ccc1F	ZINC000540340273	333726182	/nfs/dbraw/zinc/72/61/82/333726182.db2.gz	DBVNVWPUOJCAHT-UHFFFAOYSA-N	0	0	296.679	4.241	20	30		CIEDRN
CCCCCSCC(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000540345995	333726547	/nfs/dbraw/zinc/72/65/47/333726547.db2.gz	VPNLUJKIFRYXBW-UHFFFAOYSA-N	0	0	296.823	4.074	20	30		CIEDRN
N#Cc1cc(NCCC2CCCC2)nc2ccccc12	ZINC000068770061	333728722	/nfs/dbraw/zinc/72/87/22/333728722.db2.gz	MTKKCFIOQVWIEO-UHFFFAOYSA-N	0	0	265.360	4.099	20	30		CIEDRN
C=CCCOCCCCC(=O)N[C@@H]1CCC(C)(C)C[C@H]1C	ZINC000540485659	333731755	/nfs/dbraw/zinc/73/17/55/333731755.db2.gz	NSPSVIDHVXAPQI-HZPDHXFCSA-N	0	0	295.467	4.080	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Cc1ccc(C(F)(F)F)cc1	ZINC000540531434	333733950	/nfs/dbraw/zinc/73/39/50/333733950.db2.gz	LCMRDHMDALSNBC-LBPRGKRZSA-N	0	0	299.336	4.109	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)CSc1ccc(Cl)cc1	ZINC000540534059	333734130	/nfs/dbraw/zinc/73/41/30/333734130.db2.gz	HGLGOOLOSHPUMD-LBPRGKRZSA-N	0	0	297.851	4.293	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)CCSc1ccccc1F	ZINC000540532843	333734137	/nfs/dbraw/zinc/73/41/37/333734137.db2.gz	SJIXGFGEHQPGKN-ZDUSSCGKSA-N	0	0	295.423	4.169	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@H](C)CCc1cccc(F)c1	ZINC000540538602	333734332	/nfs/dbraw/zinc/73/43/32/333734332.db2.gz	UQLGNYKMGKNOQU-CABCVRRESA-N	0	0	291.410	4.255	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1ccc2[nH]c(C)cc2c1	ZINC000540554516	333735188	/nfs/dbraw/zinc/73/51/88/333735188.db2.gz	COIDQTKACXPTGT-GFCCVEGCSA-N	0	0	285.391	4.343	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1nc2cc(C)ccc2n1CC	ZINC000540560305	333735424	/nfs/dbraw/zinc/73/54/24/333735424.db2.gz	JOAPVABIUJATPP-UHFFFAOYSA-N	0	0	297.402	4.072	20	30		CIEDRN
C=CCCOCCCCC(=O)NCC1(C)CCCCCC1	ZINC000540639728	333739647	/nfs/dbraw/zinc/73/96/47/333739647.db2.gz	PLRUEWGCHGTVDW-UHFFFAOYSA-N	0	0	295.467	4.226	20	30		CIEDRN
C[C@@H]1Sc2ccccc2N(CCC(C)(C)C#N)[C@H]1C	ZINC000540667881	333741379	/nfs/dbraw/zinc/74/13/79/333741379.db2.gz	OWVXKCIZJAMTTM-STQMWFEESA-N	0	0	274.433	4.316	20	30		CIEDRN
CC1(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)CC1	ZINC000129147187	333750425	/nfs/dbraw/zinc/75/04/25/333750425.db2.gz	JHQLKJBLPVSRQM-UHFFFAOYSA-N	0	0	292.338	4.089	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)C[C@@H]1CCCC[C@H]1C	ZINC000540916932	333753420	/nfs/dbraw/zinc/75/34/20/333753420.db2.gz	SMGHVENLTBQNNG-CVEARBPZSA-N	0	0	289.419	4.053	20	30		CIEDRN
COc1ccc(C#N)cc1CNc1cccc(Cl)c1C	ZINC000129242287	333753927	/nfs/dbraw/zinc/75/39/27/333753927.db2.gz	SEYITIJRBQPGCZ-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N1CCC[C@@H](CC(C)C)C1	ZINC000129377712	333758513	/nfs/dbraw/zinc/75/85/13/333758513.db2.gz	IUTAHSPEJRBUMC-INIZCTEOSA-N	0	0	299.418	4.157	20	30		CIEDRN
C=CCCO[C@@H](C)c1nc(-c2cc3ccccc3o2)no1	ZINC000129440688	333763842	/nfs/dbraw/zinc/76/38/42/333763842.db2.gz	VQHCKFACTJIGMU-NSHDSACASA-N	0	0	284.315	4.137	20	30		CIEDRN
CSc1cccc(NCc2ccc(CC#N)cc2)c1C	ZINC000541296217	333770943	/nfs/dbraw/zinc/77/09/43/333770943.db2.gz	WLBCBDCOUIQFKC-UHFFFAOYSA-N	0	0	282.412	4.395	20	30		CIEDRN
N#CCc1ccc(CSc2ccc(C#N)cc2F)cc1	ZINC000541295084	333771031	/nfs/dbraw/zinc/77/10/31/333771031.db2.gz	ZENZCODVFBRYNQ-UHFFFAOYSA-N	0	0	282.343	4.056	20	30		CIEDRN
CCCOc1cccc(NCc2cccc(C#N)c2F)c1	ZINC000541304517	333771474	/nfs/dbraw/zinc/77/14/74/333771474.db2.gz	AMQURXZYVHHKEZ-UHFFFAOYSA-N	0	0	284.334	4.098	20	30		CIEDRN
CC[C@H](NC(=O)Nc1cc(C#N)ccc1C)c1cccs1	ZINC000069606066	333776287	/nfs/dbraw/zinc/77/62/87/333776287.db2.gz	IBEYAFWBGJHGTQ-ZDUSSCGKSA-N	0	0	299.399	4.201	20	30		CIEDRN
C=CCCC(=O)Nc1cc(Cl)ccc1Br	ZINC000129933405	333799737	/nfs/dbraw/zinc/79/97/37/333799737.db2.gz	FHXUUICNJUISJO-UHFFFAOYSA-N	0	0	288.572	4.007	20	30		CIEDRN
CN(C(=O)c1cccc(C2CCC2)c1)c1ccc(C#N)cc1	ZINC000542177511	333813529	/nfs/dbraw/zinc/81/35/29/333813529.db2.gz	WPWFBHHEDQKOQF-UHFFFAOYSA-N	0	0	290.366	4.102	20	30		CIEDRN
CCCCN(C(=O)c1ccc(Cl)c(C#N)c1)[C@@H](C)CC	ZINC000542531364	333831096	/nfs/dbraw/zinc/83/10/96/333831096.db2.gz	ITLYJUUCNBJXPW-LBPRGKRZSA-N	0	0	292.810	4.252	20	30		CIEDRN
N#Cc1ccc(SCCCOCc2ccccc2)cc1	ZINC000542711234	333838149	/nfs/dbraw/zinc/83/81/49/333838149.db2.gz	COPQWMDDTHOEIJ-UHFFFAOYSA-N	0	0	283.396	4.257	20	30		CIEDRN
CN(C(=O)Nc1ccc(CC#N)cc1)C1CCC(C)(C)CC1	ZINC000130343287	333838562	/nfs/dbraw/zinc/83/85/62/333838562.db2.gz	BVAOAXOMHLJGBO-UHFFFAOYSA-N	0	0	299.418	4.185	20	30		CIEDRN
N#CCC[C@H](NCc1cc(F)ccc1F)c1ccccc1	ZINC000130421109	333841970	/nfs/dbraw/zinc/84/19/70/333841970.db2.gz	OIKJCQIPXTYEOY-KRWDZBQOSA-N	0	0	286.325	4.099	20	30		CIEDRN
N#Cc1cc(NCc2ccc(Cl)s2)nc2ccccc12	ZINC000071308795	333853502	/nfs/dbraw/zinc/85/35/02/333853502.db2.gz	UKWYMBBDKOSQQJ-UHFFFAOYSA-N	0	0	299.786	4.433	20	30		CIEDRN
COc1ccc(C)cc1CN[C@H](CCC#N)c1ccccc1	ZINC000130582869	333854046	/nfs/dbraw/zinc/85/40/46/333854046.db2.gz	DIGUSUMLUHITHT-GOSISDBHSA-N	0	0	294.398	4.138	20	30		CIEDRN
Cc1ccc(C(=O)N[C@@](C)(C#N)CC(C)C)c(Cl)c1C	ZINC000543079713	333855931	/nfs/dbraw/zinc/85/59/31/333855931.db2.gz	MHMHVXFBKRDBKX-MRXNPFEDSA-N	0	0	292.810	4.015	20	30		CIEDRN
Cc1ccnc(NCc2ccc(Cl)cc2Cl)c1C#N	ZINC000543132680	333859640	/nfs/dbraw/zinc/85/96/40/333859640.db2.gz	PGUIUNPGRCSQNB-UHFFFAOYSA-N	0	0	292.169	4.181	20	30		CIEDRN
CCCOc1ccccc1NCc1ccc(CC#N)cc1	ZINC000543163853	333862019	/nfs/dbraw/zinc/86/20/19/333862019.db2.gz	DMASCIKTQIWZLT-UHFFFAOYSA-N	0	0	280.371	4.154	20	30		CIEDRN
CC(=O)c1ccc(C#N)cc1N1CCC[C@H]1c1cccs1	ZINC000543450114	333875918	/nfs/dbraw/zinc/87/59/18/333875918.db2.gz	ZYANPLFBQWGMRQ-HNNXBMFYSA-N	0	0	296.395	4.164	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1c(C)noc1-c1ccccc1	ZINC000130877142	333885283	/nfs/dbraw/zinc/88/52/83/333885283.db2.gz	RZJAUASKEKDQKA-UHFFFAOYSA-N	0	0	296.370	4.357	20	30		CIEDRN
CC(C)C[C@](C)(C#N)NC(=O)CC1CC(c2ccccc2)C1	ZINC000543636585	333886530	/nfs/dbraw/zinc/88/65/30/333886530.db2.gz	CXMVJUDGYOITQR-GXOAENINSA-N	0	0	298.430	4.015	20	30		CIEDRN
CC[C@@H](Nc1nccc(C)c1C#N)c1ccc(Cl)cc1	ZINC000544067737	333913848	/nfs/dbraw/zinc/91/38/48/333913848.db2.gz	VIZOFBBBFWMOOE-OAHLLOKOSA-N	0	0	285.778	4.478	20	30		CIEDRN
Cc1ccnc(N[C@H](C)c2ccccc2OC(C)C)c1C#N	ZINC000544147853	333918866	/nfs/dbraw/zinc/91/88/66/333918866.db2.gz	NXFWUFDRPJWCSJ-CQSZACIVSA-N	0	0	295.386	4.222	20	30		CIEDRN
CC[C@H]1CCCCCN1C(=O)c1ccc(Cl)c(C#N)c1	ZINC000544399281	333929165	/nfs/dbraw/zinc/92/91/65/333929165.db2.gz	MOFPEIZURVVUKN-AWEZNQCLSA-N	0	0	290.794	4.006	20	30		CIEDRN
COCCCCOc1ccc(-c2ccc(C#N)cc2)cc1	ZINC000131451858	333941696	/nfs/dbraw/zinc/94/16/96/333941696.db2.gz	ILUWILWSIUZYMR-UHFFFAOYSA-N	0	0	281.355	4.031	20	30		CIEDRN
CC(C)(C#N)c1ccccc1CNc1ccccc1	ZINC000131469180	333942616	/nfs/dbraw/zinc/94/26/16/333942616.db2.gz	WBOIXLALIRNECU-UHFFFAOYSA-N	0	0	250.345	4.100	20	30		CIEDRN
N#Cc1ccccc1SCc1cccc(-n2cccn2)c1	ZINC000544858188	333949465	/nfs/dbraw/zinc/94/94/65/333949465.db2.gz	DAELJPIEWRYHFF-UHFFFAOYSA-N	0	0	291.379	4.036	20	30		CIEDRN
Cc1ccccc1[C@@H](C)c1noc(C2(C#N)CCCCC2)n1	ZINC000545133425	333964542	/nfs/dbraw/zinc/96/45/42/333964542.db2.gz	SCBDBPLOIHQKKI-CQSZACIVSA-N	0	0	295.386	4.255	20	30		CIEDRN
CC[C@H](CC#N)NCc1cc(-c2ccccc2)ccc1OC	ZINC000545168140	333965654	/nfs/dbraw/zinc/96/56/54/333965654.db2.gz	ZEHLPKZVMCPNLB-GOSISDBHSA-N	0	0	294.398	4.144	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC)c1nc2ccccc2s1	ZINC000545215185	333969852	/nfs/dbraw/zinc/96/98/52/333969852.db2.gz	DVKDUZIJADJDNJ-GFCCVEGCSA-N	0	0	288.416	4.252	20	30		CIEDRN
C=CCCOCCCCc1nc(CC2(C)CCCC2)no1	ZINC000564286347	333969947	/nfs/dbraw/zinc/96/99/47/333969947.db2.gz	IJCDABZLKCNTNL-UHFFFAOYSA-N	0	0	292.423	4.108	20	30		CIEDRN
N#Cc1ncccc1NC1CCC(c2ccccc2)CC1	ZINC000576201134	335168511	/nfs/dbraw/zinc/16/85/11/335168511.db2.gz	NIIGBEYSUOUNEW-UHFFFAOYSA-N	0	0	277.371	4.092	20	30		CIEDRN
C=CCCc1nc(CSc2cc(C)ccc2C)no1	ZINC000545525448	333986777	/nfs/dbraw/zinc/98/67/77/333986777.db2.gz	LXIUVMZJIGUUPB-UHFFFAOYSA-N	0	0	274.389	4.097	20	30		CIEDRN
C=CCC(CC=C)c1nc(Cc2ccc(F)cc2)no1	ZINC000545551472	333988016	/nfs/dbraw/zinc/98/80/16/333988016.db2.gz	JLANHPSLCMPNID-UHFFFAOYSA-N	0	0	272.323	4.035	20	30		CIEDRN
C=CCCO[C@@H](C)c1nc(-c2cc(Cl)ccc2C)no1	ZINC000545695093	333995442	/nfs/dbraw/zinc/99/54/42/333995442.db2.gz	IYONGBORTDWAQA-NSHDSACASA-N	0	0	292.766	4.352	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000132773347	334005391	/nfs/dbraw/zinc/00/53/91/334005391.db2.gz	KLDSMTAXJOMKEZ-QZTJIDSGSA-N	0	0	283.415	4.207	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](C)[C@@H]2CCCC[C@H]21	ZINC000545923978	334006556	/nfs/dbraw/zinc/00/65/56/334006556.db2.gz	DBFDFQOFNXSQPA-YHUYYLMFSA-N	0	0	263.425	4.016	20	30		CIEDRN
C=CCOc1cccc(NC(=O)c2c(C)cccc2C)c1	ZINC000074722725	334012464	/nfs/dbraw/zinc/01/24/64/334012464.db2.gz	FJCHVNPSRPGZFU-UHFFFAOYSA-N	0	0	281.355	4.121	20	30		CIEDRN
CCCCn1ncc(N[C@H](C)c2ccc(C#N)cc2)c1C	ZINC000133039615	334014060	/nfs/dbraw/zinc/01/40/60/334014060.db2.gz	ROFUDHKXGNBHFB-CYBMUJFWSA-N	0	0	282.391	4.036	20	30		CIEDRN
N#CC1(c2nc(CCC3CCCCC3)no2)CCCCC1	ZINC000546342701	334028537	/nfs/dbraw/zinc/02/85/37/334028537.db2.gz	FMWJGINXQFBTKF-UHFFFAOYSA-N	0	0	287.407	4.308	20	30		CIEDRN
C=CCCCc1nc(-c2ccc(CSC)cc2)no1	ZINC000546353264	334029002	/nfs/dbraw/zinc/02/90/02/334029002.db2.gz	PVQGHOSTFQMHSW-UHFFFAOYSA-N	0	0	274.389	4.108	20	30		CIEDRN
C=CCCCc1nc(-c2ccc3[nH]c(C)c(C)c3c2)no1	ZINC000546356382	334029061	/nfs/dbraw/zinc/02/90/61/334029061.db2.gz	VDJHIGHXIXIVMK-UHFFFAOYSA-N	0	0	281.359	4.343	20	30		CIEDRN
C=CCC(CC=C)c1nc(-c2cc(F)ccc2C)no1	ZINC000546410706	334031455	/nfs/dbraw/zinc/03/14/55/334031455.db2.gz	CRVYWJUXZGTEEA-UHFFFAOYSA-N	0	0	272.323	4.420	20	30		CIEDRN
C[C@H](Oc1ccccc1C#N)c1nc([C@@H](C)C(C)(C)C)no1	ZINC000546418090	334031636	/nfs/dbraw/zinc/03/16/36/334031636.db2.gz	XEGGCZAXWVLSGO-NEPJUHHUSA-N	0	0	299.374	4.231	20	30		CIEDRN
Cc1ccccc1[C@H](C)c1noc(-c2cccc(C#N)c2)n1	ZINC000546547141	334038204	/nfs/dbraw/zinc/03/82/04/334038204.db2.gz	CGJYLAQVZRFLFE-ZDUSSCGKSA-N	0	0	289.338	4.069	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC(c2ccccc2F)CC1	ZINC000546634412	334042509	/nfs/dbraw/zinc/04/25/09/334042509.db2.gz	NXMBJJHEVBAKPL-CQSZACIVSA-N	0	0	289.394	4.134	20	30		CIEDRN
C=CCC[C@@H](NC(=O)c1ccc(C)o1)c1ccccc1	ZINC000133708761	334050879	/nfs/dbraw/zinc/05/08/79/334050879.db2.gz	UHMIBKOOLMIAAN-OAHLLOKOSA-N	0	0	269.344	4.025	20	30		CIEDRN
C=CCC[C@@H](NC(=O)c1ccoc1C)c1ccccc1	ZINC000133744404	334052230	/nfs/dbraw/zinc/05/22/30/334052230.db2.gz	YBUMXJIOUYHCRE-MRXNPFEDSA-N	0	0	269.344	4.025	20	30		CIEDRN
CC[C@@H](CC(F)(F)F)Nc1ncc(Cl)c(C)c1C#N	ZINC000546887449	334053875	/nfs/dbraw/zinc/05/38/75/334053875.db2.gz	LVDZJSFFMDUXGW-QMMMGPOBSA-N	0	0	291.704	4.058	20	30		CIEDRN
Cc1ccccc1C(NCC1(C#N)CC1)c1ccccc1C	ZINC000546931872	334055885	/nfs/dbraw/zinc/05/58/85/334055885.db2.gz	XMPBTLADRRYAGE-UHFFFAOYSA-N	0	0	290.410	4.286	20	30		CIEDRN
COc1ccc(OCc2ccccc2C(C)(C)C#N)cc1	ZINC000133790522	334057487	/nfs/dbraw/zinc/05/74/87/334057487.db2.gz	KLUQISOPPPIXRB-UHFFFAOYSA-N	0	0	281.355	4.075	20	30		CIEDRN
C[C@H]1CCCC[C@H]1c1noc(-c2ccc(CC#N)cc2)n1	ZINC000547108084	334067065	/nfs/dbraw/zinc/06/70/65/334067065.db2.gz	WVVSYCARXZCKFJ-SWLSCSKDSA-N	0	0	281.359	4.096	20	30		CIEDRN
CCCCOc1cccc(NCc2ccc(C#N)cc2)c1	ZINC000236717637	334067605	/nfs/dbraw/zinc/06/76/05/334067605.db2.gz	XZSQIYZIKDBPDT-UHFFFAOYSA-N	0	0	280.371	4.349	20	30		CIEDRN
Cc1cc(C#N)ccc1-c1nc([C@H](C)c2cccs2)no1	ZINC000547163949	334070209	/nfs/dbraw/zinc/07/02/09/334070209.db2.gz	GWVXGBDWPDPQIO-LLVKDONJSA-N	0	0	295.367	4.130	20	30		CIEDRN
C=CCCCc1nc(-c2cccc(-c3cscn3)c2)no1	ZINC000547197648	334072744	/nfs/dbraw/zinc/07/27/44/334072744.db2.gz	BYYOYENILBQJRU-UHFFFAOYSA-N	0	0	297.383	4.369	20	30		CIEDRN
C=CCCCc1nc([C@H](C)c2ccccc2C)no1	ZINC000547249901	334074943	/nfs/dbraw/zinc/07/49/43/334074943.db2.gz	LXHVFJBQQPHVCW-CYBMUJFWSA-N	0	0	256.349	4.039	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](C)c1ccccc1OC(C)C	ZINC000547337500	334080945	/nfs/dbraw/zinc/08/09/45/334080945.db2.gz	BZBSFWZUHGVRGE-LSDHHAIUSA-N	0	0	289.419	4.253	20	30		CIEDRN
CC(C)(C#N)c1ccccc1COc1ccc(C#N)c(F)c1	ZINC000134162534	334082539	/nfs/dbraw/zinc/08/25/39/334082539.db2.gz	FOKJVSNDIZVTFP-UHFFFAOYSA-N	0	0	294.329	4.078	20	30		CIEDRN
C=CCCCN(C)C(=O)c1c(C)c(CC)nc2ccccc21	ZINC000076489798	334082559	/nfs/dbraw/zinc/08/25/59/334082559.db2.gz	FLGKVRRUTJJSCE-UHFFFAOYSA-N	0	0	296.414	4.144	20	30		CIEDRN
C=CCCCN(C)C(=O)N[C@H](C)c1ccc(F)cc1Cl	ZINC000076978082	334092514	/nfs/dbraw/zinc/09/25/14/334092514.db2.gz	BFZLWBVFEFMUEP-LLVKDONJSA-N	0	0	298.789	4.148	20	30		CIEDRN
Clc1ccc(C#CCNc2cccc3cc[nH]c32)cc1	ZINC000547489419	334093110	/nfs/dbraw/zinc/09/31/10/334093110.db2.gz	ZNFQTXCNJCZTGK-UHFFFAOYSA-N	0	0	280.758	4.285	20	30		CIEDRN
C=CCCC[C@H](C)N1CCO[C@@H](c2ccc(F)cc2F)C1	ZINC000547648059	334105570	/nfs/dbraw/zinc/10/55/70/334105570.db2.gz	SUBCCBZWYDTEMH-SUMWQHHRSA-N	0	0	295.373	4.083	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)[C@H](C)c1cccs1	ZINC000078060911	334122929	/nfs/dbraw/zinc/12/29/29/334122929.db2.gz	RJHZICRMIJDNFH-CQSZACIVSA-N	0	0	285.412	4.066	20	30		CIEDRN
C=CCN(CC=C)C(=O)Nc1ccccc1SC(C)C	ZINC000135344938	334126726	/nfs/dbraw/zinc/12/67/26/334126726.db2.gz	JXMOXYMIRFCVTA-UHFFFAOYSA-N	0	0	290.432	4.393	20	30		CIEDRN
CC[C@H]1CCCC[C@H]1N(C)C(=O)Nc1ccc(CC#N)cc1	ZINC000135360684	334127764	/nfs/dbraw/zinc/12/77/64/334127764.db2.gz	UFKFGOKNBKQQJC-DOTOQJQBSA-N	0	0	299.418	4.185	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1coc(C2CCCCC2)n1	ZINC000547946958	334130471	/nfs/dbraw/zinc/13/04/71/334130471.db2.gz	VPPZTPCFZGRFKU-ZDUSSCGKSA-N	0	0	290.407	4.197	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H](C)c1cc2ccccc2o1	ZINC000135474165	334131210	/nfs/dbraw/zinc/13/12/10/334131210.db2.gz	KVMYGPKZSGEYGA-YVEFUNNKSA-N	0	0	271.360	4.212	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1cc2cc(F)ccc2s1	ZINC000078362137	334131987	/nfs/dbraw/zinc/13/19/87/334131987.db2.gz	OZBPRIDUOWWFBN-UHFFFAOYSA-N	0	0	277.364	4.079	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H]1CCSc2ccc(F)cc21	ZINC000135501613	334132089	/nfs/dbraw/zinc/13/20/89/334132089.db2.gz	IPEPPCRHDDBCEY-XJKSGUPXSA-N	0	0	293.407	4.081	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)N2[C@H](C)CC[C@H]2C)c1	ZINC000135659187	334135445	/nfs/dbraw/zinc/13/54/45/334135445.db2.gz	UHKUGSLEZNKZLK-ZIAGYGMSSA-N	0	0	288.391	4.046	20	30		CIEDRN
CC(C)Oc1ccccc1NCc1ccc(C#N)s1	ZINC000135692437	334136416	/nfs/dbraw/zinc/13/64/16/334136416.db2.gz	GOJLILWNGYKQOO-UHFFFAOYSA-N	0	0	272.373	4.019	20	30		CIEDRN
CC1CCC(CNc2nc(C(F)(F)F)ccc2C#N)CC1	ZINC000078834620	334141219	/nfs/dbraw/zinc/14/12/19/334141219.db2.gz	SWNBMCRBXORPLX-UHFFFAOYSA-N	0	0	297.324	4.210	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)/C=C/C=C/C	ZINC000078901346	334142584	/nfs/dbraw/zinc/14/25/84/334142584.db2.gz	HERAGPWTAVPHCN-TWTPFVCWSA-N	0	0	281.808	4.048	20	30		CIEDRN
Cc1cscc1C([O-])=C(C#N)c1nc(C(C)C)cs1	ZINC000079172687	334149255	/nfs/dbraw/zinc/14/92/55/334149255.db2.gz	MLJQDBHUDAVLAV-SNVBAGLBSA-N	0	0	290.413	4.127	20	30		CIEDRN
Cc1ccc(CCCC(=O)Nc2cc(C#N)ccc2C)s1	ZINC000079442611	334154472	/nfs/dbraw/zinc/15/44/72/334154472.db2.gz	DJSHRVFGUAFALY-UHFFFAOYSA-N	0	0	298.411	4.198	20	30		CIEDRN
C=CCCCCNC(=O)N(C)[C@H]1CCCc2ccccc21	ZINC000548435830	334156376	/nfs/dbraw/zinc/15/63/76/334156376.db2.gz	IFELHLUDJZBONW-KRWDZBQOSA-N	0	0	286.419	4.062	20	30		CIEDRN
Cc1cc(NC(=O)N(C[C@@H](C)C#N)C2CC2)ccc1C1CC1	ZINC000548499229	334160706	/nfs/dbraw/zinc/16/07/06/334160706.db2.gz	OKKIUSYWSGAYPT-LBPRGKRZSA-N	0	0	297.402	4.028	20	30		CIEDRN
CCCOc1cccc(NCC(C)(C)CCC#N)c1	ZINC000080192558	334167340	/nfs/dbraw/zinc/16/73/40/334167340.db2.gz	TYIBRSAWURFWNH-UHFFFAOYSA-N	0	0	260.381	4.217	20	30		CIEDRN
N#Cc1cccc(CNc2cccnc2-c2ccccc2)c1	ZINC000549531179	334196498	/nfs/dbraw/zinc/19/64/98/334196498.db2.gz	UXZIMDVJTOFXCQ-UHFFFAOYSA-N	0	0	285.350	4.232	20	30		CIEDRN
C=C[C@H](CC(=O)N(C)Cc1sccc1C)c1ccccc1	ZINC000549573303	334198389	/nfs/dbraw/zinc/19/83/89/334198389.db2.gz	ZYPMHRDMYRLZMX-OAHLLOKOSA-N	0	0	299.439	4.375	20	30		CIEDRN
CO[C@@H](CSCc1cccc(C#N)c1)c1ccccc1	ZINC000549954641	334210344	/nfs/dbraw/zinc/21/03/44/334210344.db2.gz	LIIYENZWRPTVOO-KRWDZBQOSA-N	0	0	283.396	4.179	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)[C@H]2CCCC(C)(C)C2)s1	ZINC000549988488	334210767	/nfs/dbraw/zinc/21/07/67/334210767.db2.gz	SXVLVCZCACEVOL-NSHDSACASA-N	0	0	290.432	4.337	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)N1[C@H](C)C[C@H]2CCCC[C@H]21	ZINC000245681231	334212072	/nfs/dbraw/zinc/21/20/72/334212072.db2.gz	KPAZNEIXHKJMOD-SUYBPPKGSA-N	0	0	297.402	4.052	20	30		CIEDRN
CCN(C[C@H](C)C#N)[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000245752632	334217242	/nfs/dbraw/zinc/21/72/42/334217242.db2.gz	GWUQVXFUOVRJDJ-VXGBXAGGSA-N	0	0	284.325	4.248	20	30		CIEDRN
CCCN(C(=O)c1sc2ccc(C#N)cc2c1C)C1CC1	ZINC000550294594	334219272	/nfs/dbraw/zinc/21/92/72/334219272.db2.gz	KYBDFYUYEMTKKH-UHFFFAOYSA-N	0	0	298.411	4.096	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@@H]1C[C@@H]1c1ccccc1)c1ccccc1	ZINC000550492164	334223332	/nfs/dbraw/zinc/22/33/32/334223332.db2.gz	XRKOTECKXYIIIR-ATZDWAIDSA-N	0	0	291.394	4.019	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc(CSC)cc1	ZINC000550548361	334224161	/nfs/dbraw/zinc/22/41/61/334224161.db2.gz	PZESYGVBCOZOLX-UHFFFAOYSA-N	0	0	263.406	4.090	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H](C)c1cccc(C)c1C	ZINC000550843077	334229986	/nfs/dbraw/zinc/22/99/86/334229986.db2.gz	WLUCIANARXZVMA-AWEZNQCLSA-N	0	0	259.393	4.083	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCC1(c2cccc(Cl)c2)CC1	ZINC000550982299	334235376	/nfs/dbraw/zinc/23/53/76/334235376.db2.gz	DSWPQEQDCYNLGK-UHFFFAOYSA-N	0	0	291.822	4.090	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CCCC2(CCCCC2)C1	ZINC000551013327	334236290	/nfs/dbraw/zinc/23/62/90/334236290.db2.gz	HNHNBTJPXGZEGQ-UHFFFAOYSA-N	0	0	263.425	4.162	20	30		CIEDRN
C=CCC(C)(C)c1noc(Cc2ccccc2SC)n1	ZINC000551140015	334239302	/nfs/dbraw/zinc/23/93/02/334239302.db2.gz	KYCBBUKVWAYUII-UHFFFAOYSA-N	0	0	288.416	4.236	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cc(C)nc3ccccc32)n1	ZINC000551135624	334239303	/nfs/dbraw/zinc/23/93/03/334239303.db2.gz	DPBBKMXHXOUPIW-UHFFFAOYSA-N	0	0	293.370	4.447	20	30		CIEDRN
C=CCC(C)(C)c1noc(/C=C/c2cccc(F)c2)n1	ZINC000551142783	334239454	/nfs/dbraw/zinc/23/94/54/334239454.db2.gz	KSYZHYVKVCNLEL-CMDGGOBGSA-N	0	0	272.323	4.233	20	30		CIEDRN
CC[C@@H]1CCCC[C@@H]1c1noc(-c2ccc(CC#N)cc2)n1	ZINC000551182964	334240307	/nfs/dbraw/zinc/24/03/07/334240307.db2.gz	SQGJJHNCAPSNDJ-ZBFHGGJFSA-N	0	0	295.386	4.486	20	30		CIEDRN
N#Cc1cc(C(=O)Nc2csc3ccccc23)ccc1F	ZINC000551266263	334244044	/nfs/dbraw/zinc/24/40/44/334244044.db2.gz	DZJOSDNRDYNLKK-UHFFFAOYSA-N	0	0	296.326	4.164	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H](CC)c1ccc(F)cc1F	ZINC000551344895	334247537	/nfs/dbraw/zinc/24/75/37/334247537.db2.gz	YZGHLTFQZCUDBO-AWEZNQCLSA-N	0	0	281.346	4.134	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H](C)c1c(F)cccc1Cl	ZINC000551389635	334248632	/nfs/dbraw/zinc/24/86/32/334248632.db2.gz	LNXMRTUMROSUQQ-JTQLQIEISA-N	0	0	283.774	4.259	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H](C)OCc2ccccc2)n1	ZINC000551496637	334251547	/nfs/dbraw/zinc/25/15/47/334251547.db2.gz	NYNLGKVSMGSBQO-ZDUSSCGKSA-N	0	0	286.375	4.201	20	30		CIEDRN
C=CCC(C)(C)c1noc(/C=C/c2ccc(OC)cc2)n1	ZINC000551497863	334251685	/nfs/dbraw/zinc/25/16/85/334251685.db2.gz	HKOAPOIQFFNFLH-DHZHZOJOSA-N	0	0	284.359	4.102	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cc3c(cccc3F)[nH]2)n1	ZINC000551497093	334251746	/nfs/dbraw/zinc/25/17/46/334251746.db2.gz	SGMPXAQVBGTZOM-UHFFFAOYSA-N	0	0	285.322	4.211	20	30		CIEDRN
C=C(C)[C@H](Cc1nc([C@H]2CCCC[C@@H]2CC)no1)OCC	ZINC000551533590	334253151	/nfs/dbraw/zinc/25/31/51/334253151.db2.gz	BPTXHBUHTBBTBX-KKUMJFAQSA-N	0	0	292.423	4.277	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)c1ccc2c(c1)CCC=C2	ZINC000551634300	334256543	/nfs/dbraw/zinc/25/65/43/334256543.db2.gz	TUSYXBIYPDSFLK-UHFFFAOYSA-N	0	0	288.350	4.078	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCc1ccc(C)cc1OC(C)C	ZINC000551786984	334260961	/nfs/dbraw/zinc/26/09/61/334260961.db2.gz	GTZMNNUCWTZOBI-UHFFFAOYSA-N	0	0	289.419	4.001	20	30		CIEDRN
N#CC1(CNCc2ccc(-c3ccc(Cl)cc3)cc2)CC1	ZINC000551823667	334263433	/nfs/dbraw/zinc/26/34/33/334263433.db2.gz	OTGTXLQSZUHXTP-UHFFFAOYSA-N	0	0	296.801	4.400	20	30		CIEDRN
CCN(C(=O)C[C@@H]1CC[C@@H](C)C1)[C@H](C)c1ccc(C#N)cc1	ZINC000246635812	334266020	/nfs/dbraw/zinc/26/60/20/334266020.db2.gz	OPHGMCCDIINXOM-BFYDXBDKSA-N	0	0	298.430	4.294	20	30		CIEDRN
C=C(C)CCc1noc(-c2cc3cc(C)ccc3[nH]2)n1	ZINC000552047850	334281411	/nfs/dbraw/zinc/28/14/11/334281411.db2.gz	HOKWRSXBORGPNW-UHFFFAOYSA-N	0	0	267.332	4.035	20	30		CIEDRN
CN(Cc1ccc(-c2ccc(F)cc2)o1)CC(C)(C)C#N	ZINC000552085258	334287293	/nfs/dbraw/zinc/28/72/93/334287293.db2.gz	WQKQBQJBVDOMAA-UHFFFAOYSA-N	0	0	286.350	4.067	20	30		CIEDRN
C=CCCCC(=O)N1[C@H](C)C[C@@H](c2ccccc2)[C@H]1C	ZINC000248345711	334298804	/nfs/dbraw/zinc/29/88/04/334298804.db2.gz	NCMHBRAOVHFMCG-BFYDXBDKSA-N	0	0	271.404	4.136	20	30		CIEDRN
CCN(C(=O)C[C@@H]1CCC[C@H]1C)[C@@H](C)c1ccc(C#N)cc1	ZINC000249043898	334325616	/nfs/dbraw/zinc/32/56/16/334325616.db2.gz	VNZSHZFGCFDHSM-VKJFTORMSA-N	0	0	298.430	4.294	20	30		CIEDRN
N#Cc1cscc1C(=O)Nc1cccc(C2CCC2)c1	ZINC000552536649	334334234	/nfs/dbraw/zinc/33/42/34/334334234.db2.gz	NWJJXENETSGDLD-UHFFFAOYSA-N	0	0	282.368	4.140	20	30		CIEDRN
Cc1nc(CSCc2cc(C#N)ccc2F)sc1C	ZINC000088309669	334335947	/nfs/dbraw/zinc/33/59/47/334335947.db2.gz	DWARZYNEHZBXGO-UHFFFAOYSA-N	0	0	292.404	4.204	20	30		CIEDRN
C=CCCC(=O)N[C@H](C)Cc1c(Cl)cccc1Cl	ZINC000089335949	334344347	/nfs/dbraw/zinc/34/43/47/334344347.db2.gz	HQCMJQRWHIIVJM-SNVBAGLBSA-N	0	0	286.202	4.007	20	30		CIEDRN
N#Cc1ccc(F)c(CNc2c(F)cc(Cl)cc2F)c1	ZINC000552827061	334346830	/nfs/dbraw/zinc/34/68/30/334346830.db2.gz	LCSNCGCWYQURNS-UHFFFAOYSA-N	0	0	296.679	4.241	20	30		CIEDRN
Cc1ccccc1[C@H](C)N(C)c1nccc(C#N)c1Cl	ZINC000552952231	334352562	/nfs/dbraw/zinc/35/25/62/334352562.db2.gz	XAZVDLIKRXMXHL-LBPRGKRZSA-N	0	0	285.778	4.113	20	30		CIEDRN
Cc1ccc([C@@H](C)N(C)c2nccc(C#N)c2Cl)cc1	ZINC000552960544	334353058	/nfs/dbraw/zinc/35/30/58/334353058.db2.gz	UPJMGFJOUJEDJY-GFCCVEGCSA-N	0	0	285.778	4.113	20	30		CIEDRN
Cc1ccc([C@H](C)N(C)c2nccc(C#N)c2Cl)cc1	ZINC000552960545	334353076	/nfs/dbraw/zinc/35/30/76/334353076.db2.gz	UPJMGFJOUJEDJY-LBPRGKRZSA-N	0	0	285.778	4.113	20	30		CIEDRN
Cc1nsc(N2C[C@@H](c3ccccc3C)C[C@H]2C)c1C#N	ZINC000553102317	334361642	/nfs/dbraw/zinc/36/16/42/334361642.db2.gz	KIKJKISWTRYRDF-OCCSQVGLSA-N	0	0	297.427	4.014	20	30		CIEDRN
CC[C@H]1CC[C@H](C(=O)N[C@H](CCC#N)c2ccccc2)CC1	ZINC000251928289	334372024	/nfs/dbraw/zinc/37/20/24/334372024.db2.gz	SVYZLZUZJJUZEN-KBAYOESNSA-N	0	0	298.430	4.364	20	30		CIEDRN
Cc1nsc(N2CCC(c3ccccc3C)CC2)c1C#N	ZINC000553408190	334382932	/nfs/dbraw/zinc/38/29/32/334382932.db2.gz	RRXONXCBAGDACE-UHFFFAOYSA-N	0	0	297.427	4.016	20	30		CIEDRN
C=CCCCC(=O)N1C[C@H](C)CC[C@@H]1c1ccccc1	ZINC000553510020	334389311	/nfs/dbraw/zinc/38/93/11/334389311.db2.gz	ORZSELNFKCSGKC-NVXWUHKLSA-N	0	0	271.404	4.343	20	30		CIEDRN
CC(C)c1ccc2c(c1)[C@H](Nc1cc(C#N)ccn1)CC2	ZINC000553540049	334390681	/nfs/dbraw/zinc/39/06/81/334390681.db2.gz	NEFCQAFUIZEQRW-QGZVFWFLSA-N	0	0	277.371	4.176	20	30		CIEDRN
Cc1ccnc(N2C[C@H](C)CC[C@H]2c2ccccc2)c1C#N	ZINC000553675576	334395176	/nfs/dbraw/zinc/39/51/76/334395176.db2.gz	ZPTZZYDCSCAOMM-KDOFPFPSSA-N	0	0	291.398	4.239	20	30		CIEDRN
C=CCn1c(Cc2ccccc2)nnc1SCC=C(C)C	ZINC000554145331	334414229	/nfs/dbraw/zinc/41/42/29/334414229.db2.gz	PHPMOUHPRZODNZ-UHFFFAOYSA-N	0	0	299.443	4.113	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CC[C@H](c2ccc(CC)cc2)C1	ZINC000554156530	334414593	/nfs/dbraw/zinc/41/45/93/334414593.db2.gz	XFKIMSAKTWFPQQ-KRWDZBQOSA-N	0	0	285.431	4.167	20	30		CIEDRN
C[C@@H]1CC[C@@]2(CCN(c3cc(C#N)c4ccccc4n3)C2)C1	ZINC000554620347	334443579	/nfs/dbraw/zinc/44/35/79/334443579.db2.gz	VEEKLQSHWCCOIR-AUUYWEPGSA-N	0	0	291.398	4.123	20	30		CIEDRN
Cc1csc(NC(=O)CC(C)(C)c2ccccc2)c1C#N	ZINC000554774328	334451622	/nfs/dbraw/zinc/45/16/22/334451622.db2.gz	DZECRRLKUVYEER-UHFFFAOYSA-N	0	0	298.411	4.235	20	30		CIEDRN
C[C@@H]1C[C@@H](CCNc2cc(Cl)ccc2C#N)C[C@H](C)O1	ZINC000554933780	334461266	/nfs/dbraw/zinc/46/12/66/334461266.db2.gz	OLIWVDBZSVARBR-CLLJXQQHSA-N	0	0	292.810	4.217	20	30		CIEDRN
C=CCCN[C@@H](c1ccc(F)c(Cl)c1)C(F)(F)F	ZINC000555007171	334464809	/nfs/dbraw/zinc/46/48/09/334464809.db2.gz	UKKMKSMLTRJCAJ-NSHDSACASA-N	0	0	281.680	4.248	20	30		CIEDRN
Cc1cc(NC[C@@H]2CCC[C@H](C(F)(F)F)C2)cc(C#N)n1	ZINC000572550639	334469330	/nfs/dbraw/zinc/46/93/30/334469330.db2.gz	TXZZYWBCGVVTFB-NEPJUHHUSA-N	0	0	297.324	4.042	20	30		CIEDRN
Cc1cc(NC[C@@H]2CCC[C@@H](C(F)(F)F)C2)cc(C#N)n1	ZINC000572550642	334469339	/nfs/dbraw/zinc/46/93/39/334469339.db2.gz	TXZZYWBCGVVTFB-VXGBXAGGSA-N	0	0	297.324	4.042	20	30		CIEDRN
C=CCCC(=O)Nc1cc(Cl)c(C)c(Cl)c1	ZINC000555143927	334469580	/nfs/dbraw/zinc/46/95/80/334469580.db2.gz	RCCOJEVKDFBJQR-UHFFFAOYSA-N	0	0	258.148	4.207	20	30		CIEDRN
C=CCCCSCc1ccc(C(F)(F)F)cn1	ZINC000556295252	334507259	/nfs/dbraw/zinc/50/72/59/334507259.db2.gz	IESTXWLXUFUBPE-UHFFFAOYSA-N	0	0	261.312	4.300	20	30		CIEDRN
CCOc1cc(Cl)ccc1NCc1ccc(C#N)s1	ZINC000152692536	334508583	/nfs/dbraw/zinc/50/85/83/334508583.db2.gz	LDLNGZIBRDVMHJ-UHFFFAOYSA-N	0	0	292.791	4.284	20	30		CIEDRN
Cc1ccnc(N[C@@H](c2ccc(F)c(C)c2)C2CC2)c1C#N	ZINC000564488276	334509397	/nfs/dbraw/zinc/50/93/97/334509397.db2.gz	QENRATBJYRFACO-QGZVFWFLSA-N	0	0	295.361	4.272	20	30		CIEDRN
N#Cc1cnc(SCc2c(F)cccc2F)c(Cl)c1	ZINC000564564238	334512106	/nfs/dbraw/zinc/51/21/06/334512106.db2.gz	UZHHSBLOLXTQMD-UHFFFAOYSA-N	0	0	296.729	4.177	20	30		CIEDRN
Cc1cc(Cl)cc(C(=O)N(CCC#N)CC(C)(C)C)c1	ZINC000152787823	334514634	/nfs/dbraw/zinc/51/46/34/334514634.db2.gz	LBSNUNJEPLQFOS-UHFFFAOYSA-N	0	0	292.810	4.050	20	30		CIEDRN
CCc1ccc([C@H](C#N)N(C)C(=O)CC2=CCCCC2)cc1	ZINC000565574805	334575274	/nfs/dbraw/zinc/57/52/74/334575274.db2.gz	RFBNIFZVDUMALA-SFHVURJKSA-N	0	0	296.414	4.163	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](C(C)(C)C)C[C@@H]1C	ZINC000565973414	334613426	/nfs/dbraw/zinc/61/34/26/334613426.db2.gz	RNQZVGUDKSCGHW-SOUVJXGZSA-N	0	0	265.441	4.262	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H](C)c1ccc(F)c2ccccc21	ZINC000566002203	334615041	/nfs/dbraw/zinc/61/50/41/334615041.db2.gz	BRSYYWBVHQFSEK-AWEZNQCLSA-N	0	0	297.373	4.350	20	30		CIEDRN
N#CCc1ccccc1NC(=O)CC1CCCCCC1	ZINC000566608934	334657107	/nfs/dbraw/zinc/65/71/07/334657107.db2.gz	BRKKZEBUOATHAJ-UHFFFAOYSA-N	0	0	270.376	4.052	20	30		CIEDRN
C[C@H]1C[C@@H](C(C)(C)C)CCN1C(=O)c1cccc(CC#N)c1	ZINC000566640395	334658775	/nfs/dbraw/zinc/65/87/75/334658775.db2.gz	HSZIHGPVQRILCE-YOEHRIQHSA-N	0	0	298.430	4.039	20	30		CIEDRN
C[C@@H](CCC(C)(C)C)C(=O)Nc1ccccc1CC#N	ZINC000566820924	334665872	/nfs/dbraw/zinc/66/58/72/334665872.db2.gz	MIIJGTWFODAZLB-ZDUSSCGKSA-N	0	0	272.392	4.154	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)Nc1c(F)cccc1Cl	ZINC000566912751	334669022	/nfs/dbraw/zinc/66/90/22/334669022.db2.gz	JPBFEZFNFURBHL-UHFFFAOYSA-N	0	0	284.762	4.203	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@H](CC)c1cccc(OC)c1	ZINC000567016738	334673350	/nfs/dbraw/zinc/67/33/50/334673350.db2.gz	FWTDCVFGOVIDAT-WMLDXEAASA-N	0	0	289.419	4.207	20	30		CIEDRN
Cc1cccc(NCCCC(C)(C)C#N)c1Cl	ZINC000154237520	334691182	/nfs/dbraw/zinc/69/11/82/334691182.db2.gz	FNXKPTBJJOTOLK-UHFFFAOYSA-N	0	0	250.773	4.390	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@@H](C(C)(C)C)C[C@H]1C	ZINC000567304805	334702526	/nfs/dbraw/zinc/70/25/26/334702526.db2.gz	NCUMZFXADHYVDX-GDBMZVCRSA-N	0	0	277.452	4.428	20	30		CIEDRN
Cc1cc(C)cc(N(C)C(=O)c2ccc(C#N)c(Cl)c2)c1	ZINC000155207251	334716117	/nfs/dbraw/zinc/71/61/17/334716117.db2.gz	FNDMKOBVGLPIJM-UHFFFAOYSA-N	0	0	298.773	4.105	20	30		CIEDRN
CC#CCCSc1nnc([C@@H](CC)c2ccccc2)o1	ZINC000155288538	334718527	/nfs/dbraw/zinc/71/85/27/334718527.db2.gz	RWQIODZUWWPPKV-AWEZNQCLSA-N	0	0	286.400	4.117	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@H]1[C@@H](C)CCC	ZINC000155970346	334732790	/nfs/dbraw/zinc/73/27/90/334732790.db2.gz	KMLIURJEXNCSDX-HOCLYGCPSA-N	0	0	263.425	4.182	20	30		CIEDRN
C=C(C)CNC(=O)N(C)[C@H](C)[C@@H](C)c1ccc(Cl)cc1	ZINC000156361834	334740747	/nfs/dbraw/zinc/74/07/47/334740747.db2.gz	OKSSKJVIQFBGJM-CHWSQXEVSA-N	0	0	294.826	4.050	20	30		CIEDRN
Cc1cscc1N[C@H](C)c1ccc(OCC#N)cc1	ZINC000272176938	334750111	/nfs/dbraw/zinc/75/01/11/334750111.db2.gz	FDIVOWVLPUBJNR-GFCCVEGCSA-N	0	0	272.373	4.132	20	30		CIEDRN
C[C@H]1CCC[C@@H](C(=O)N(C)c2cc(Cl)ccc2C#N)C1	ZINC000156843247	334751586	/nfs/dbraw/zinc/75/15/86/334751586.db2.gz	BXIWCMGCGWJWTP-NWDGAFQWSA-N	0	0	290.794	4.001	20	30		CIEDRN
C[C@H](c1noc([C@@H]2C[C@H]2c2cccc(C#N)c2)n1)C(C)(C)C	ZINC000568373969	334820261	/nfs/dbraw/zinc/82/02/61/334820261.db2.gz	VXBYLXPPKVLDMV-BYCMXARLSA-N	0	0	295.386	4.362	20	30		CIEDRN
CC(C)(C)c1ccc([C@@H](C#N)NC(=O)C(C)(C)C2CC2)cc1	ZINC000568676288	334835920	/nfs/dbraw/zinc/83/59/20/334835920.db2.gz	BUSYCGYPOGTKBY-MRXNPFEDSA-N	0	0	298.430	4.101	20	30		CIEDRN
CCOc1ccccc1CSCC1(C#N)CCC1	ZINC000568849437	334843183	/nfs/dbraw/zinc/84/31/83/334843183.db2.gz	OCFSEBDYFXGWEA-UHFFFAOYSA-N	0	0	261.390	4.012	20	30		CIEDRN
C=CCCCCCNC(=O)[C@@H]1CCCC[C@@H]1C(F)(F)F	ZINC000569136770	334857454	/nfs/dbraw/zinc/85/74/54/334857454.db2.gz	GGWAJEODKCWDJG-OLZOCXBDSA-N	0	0	291.357	4.218	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)c1cccc(C2CC2)c1	ZINC000569256817	334863936	/nfs/dbraw/zinc/86/39/36/334863936.db2.gz	SEFCMFUZPAMQJX-UHFFFAOYSA-N	0	0	284.403	4.156	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)C1CC(C)(C)C1	ZINC000569272195	334864835	/nfs/dbraw/zinc/86/48/35/334864835.db2.gz	LKVORBRONBQIIQ-UHFFFAOYSA-N	0	0	257.377	4.180	20	30		CIEDRN
C=CCCC1(c2nc(Cc3ccc(F)cc3C)no2)CC1	ZINC000572682022	334871040	/nfs/dbraw/zinc/87/10/40/334871040.db2.gz	RFXFISDFGWHNCO-UHFFFAOYSA-N	0	0	286.350	4.106	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(-c3ncco3)cc2C)CC1	ZINC000572898830	334889242	/nfs/dbraw/zinc/88/92/42/334889242.db2.gz	KYCFATCFMAJFDL-UHFFFAOYSA-N	0	0	296.370	4.335	20	30		CIEDRN
CC(C)(C)c1cc(C#N)c(NC(=O)[C@]23C[C@H]2CCC3)s1	ZINC000573234186	334920061	/nfs/dbraw/zinc/92/00/61/334920061.db2.gz	KSBFRVRKWMXILD-BDJLRTHQSA-N	0	0	288.416	4.046	20	30		CIEDRN
CC(C)=CCSCCCOc1cccc(C#N)c1	ZINC000573240371	334920671	/nfs/dbraw/zinc/92/06/71/334920671.db2.gz	UXUOWGDVHBGCGE-UHFFFAOYSA-N	0	0	261.390	4.027	20	30		CIEDRN
CC/C=C\CCNc1ccccc1SCCC#N	ZINC000342687956	335185652	/nfs/dbraw/zinc/18/56/52/335185652.db2.gz	MXNVNLRBGQXTEN-ARJAWSKDSA-N	0	0	260.406	4.461	20	30		CIEDRN
C=CCN(C(=O)c1cccc(Cl)c1C)c1ccccc1	ZINC000576553334	335218190	/nfs/dbraw/zinc/21/81/90/335218190.db2.gz	VIGOFQDIWACBHK-UHFFFAOYSA-N	0	0	285.774	4.481	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@H](C(C)(C)C)C[C@@H]2C)CCC1	ZINC000576763501	335244828	/nfs/dbraw/zinc/24/48/28/335244828.db2.gz	UMLVGUDIZCBTCJ-GJZGRUSLSA-N	0	0	277.452	4.406	20	30		CIEDRN
CC[C@H](CC#N)NCc1ccc(-c2ccsc2)cc1	ZINC000576835612	335253884	/nfs/dbraw/zinc/25/38/84/335253884.db2.gz	HUOHBPFJIHUGDM-MRXNPFEDSA-N	0	0	270.401	4.197	20	30		CIEDRN
C[C@H]1C[C@@H](CC(=O)Nc2ccccc2C#N)CC(C)(C)C1	ZINC000576890960	335261463	/nfs/dbraw/zinc/26/14/63/335261463.db2.gz	HNSJBBAVAFHXSO-KBPBESRZSA-N	0	0	284.403	4.349	20	30		CIEDRN
N#Cc1c(F)cccc1NC[C@H]1CC[C@H](c2ccccc2)O1	ZINC000576900372	335262454	/nfs/dbraw/zinc/26/24/54/335262454.db2.gz	FBBKYSVNOHSTOG-RDTXWAMCSA-N	0	0	296.345	4.030	20	30		CIEDRN
Cc1ccc(C[S@](=O)CCCCC(C)(C)C#N)c(C)c1	ZINC000580774534	335263910	/nfs/dbraw/zinc/26/39/10/335263910.db2.gz	UEKZZXJGJFHLMU-HXUWFJFHSA-N	0	0	291.460	4.272	20	30		CIEDRN
C=CCCCN(C)C(=O)c1c(Cl)cccc1Cl	ZINC000176364610	335265178	/nfs/dbraw/zinc/26/51/78/335265178.db2.gz	IIQGJNDXPCCCIZ-UHFFFAOYSA-N	0	0	272.175	4.032	20	30		CIEDRN
C=CCC(C)(C)c1noc(CCc2ccc(C)s2)n1	ZINC000576951848	335268758	/nfs/dbraw/zinc/26/87/58/335268758.db2.gz	JPEPSRSFBQHNRX-UHFFFAOYSA-N	0	0	276.405	4.078	20	30		CIEDRN
C=CC1CCN(C(=O)c2cc(F)c3ccccc3c2)CC1	ZINC000577081791	335296875	/nfs/dbraw/zinc/29/68/75/335296875.db2.gz	XXOPTZQTRXSFRT-UHFFFAOYSA-N	0	0	283.346	4.017	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(-c2ccc(OC(F)F)cc2)no1	ZINC000580599707	335297025	/nfs/dbraw/zinc/29/70/25/335297025.db2.gz	MUYCVKNHOZANSI-OAHLLOKOSA-N	0	0	294.301	4.192	20	30		CIEDRN
Cc1cc(NCc2ccc(C#N)cc2F)c(Cl)cc1F	ZINC000380086799	335319335	/nfs/dbraw/zinc/31/93/35/335319335.db2.gz	CDOPPVBKSGXAPV-UHFFFAOYSA-N	0	0	292.716	4.410	20	30		CIEDRN
Cc1nsc(Sc2ccc(Cl)cc2)c1C#N	ZINC000577224656	335326160	/nfs/dbraw/zinc/32/61/60/335326160.db2.gz	COYJQUQVEJZPQO-UHFFFAOYSA-N	0	0	266.778	4.128	20	30		CIEDRN
CC(C)CCc1ccccc1NCc1nc(C#N)cs1	ZINC000577250230	335329768	/nfs/dbraw/zinc/32/97/68/335329768.db2.gz	RASBNNRFCDWWIG-UHFFFAOYSA-N	0	0	285.416	4.215	20	30		CIEDRN
N#Cc1c(F)cccc1SCc1csc(C2CC2)n1	ZINC000580692918	335332959	/nfs/dbraw/zinc/33/29/59/335332959.db2.gz	QHFJBHNLIUTQFU-UHFFFAOYSA-N	0	0	290.388	4.324	20	30		CIEDRN
CCc1ccc([C@@H](C#N)NC(=O)[C@H](C)CC2CCCC2)cc1	ZINC000577300614	335337148	/nfs/dbraw/zinc/33/71/48/335337148.db2.gz	IVLVFTSZWAIIBN-RDTXWAMCSA-N	0	0	298.430	4.146	20	30		CIEDRN
CC(C)OCc1cccc(NCc2ccc(C#N)s2)c1	ZINC000176955896	335344883	/nfs/dbraw/zinc/34/48/83/335344883.db2.gz	UBYBGBIUEQAHQK-UHFFFAOYSA-N	0	0	286.400	4.157	20	30		CIEDRN
C[C@H](NCc1ccc(C#N)s1)c1c(F)cccc1Cl	ZINC000176981575	335351371	/nfs/dbraw/zinc/35/13/71/335351371.db2.gz	QSYFYLNRQAOTQW-VIFPVBQESA-N	0	0	294.782	4.263	20	30		CIEDRN
Cc1cc(NCc2cc3ccccc3s2)cc(C#N)n1	ZINC000577478151	335356492	/nfs/dbraw/zinc/35/64/92/335356492.db2.gz	FLPWDORNDPEWKY-UHFFFAOYSA-N	0	0	279.368	4.089	20	30		CIEDRN
N#Cc1ccc(-c2ccc(OCc3cccnc3)cc2)cc1	ZINC000193017958	335367418	/nfs/dbraw/zinc/36/74/18/335367418.db2.gz	RQIAEXSPRWNMPA-UHFFFAOYSA-N	0	0	286.334	4.199	20	30		CIEDRN
C[C@H](NCc1cc(C#N)cs1)c1c(F)cccc1Cl	ZINC000177714073	335381426	/nfs/dbraw/zinc/38/14/26/335381426.db2.gz	WZLDUTRTNVOPRS-VIFPVBQESA-N	0	0	294.782	4.263	20	30		CIEDRN
CC(C)c1noc(CSc2ccc(C#N)cc2Cl)n1	ZINC000178830566	335453545	/nfs/dbraw/zinc/45/35/45/335453545.db2.gz	BQEXUYZJSGSPCM-UHFFFAOYSA-N	0	0	293.779	4.010	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)C(C)(C)C1CCCC1	ZINC000179272397	335485014	/nfs/dbraw/zinc/48/50/14/335485014.db2.gz	SNTJJQLGZBYFPR-UHFFFAOYSA-N	0	0	270.376	4.022	20	30		CIEDRN
C=C[C@@H](CC(=O)NCC1(C2CC2)CCC1)c1ccccc1	ZINC000179511336	335498249	/nfs/dbraw/zinc/49/82/49/335498249.db2.gz	FIUYWJBWGSGELL-HNNXBMFYSA-N	0	0	283.415	4.043	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@H]1C[C@@H]1c1ccccc1Cl	ZINC000578123855	335506368	/nfs/dbraw/zinc/50/63/68/335506368.db2.gz	SILVABWVCNJFLL-CFVMTHIKSA-N	0	0	291.822	4.305	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1cccc(F)c1C	ZINC000179663730	335506740	/nfs/dbraw/zinc/50/67/40/335506740.db2.gz	SHGGVQQEEIAJHO-LLVKDONJSA-N	0	0	264.344	4.000	20	30		CIEDRN
C=CCN(C(=O)[C@@H]1CC[C@@H](C(F)(F)F)C1)c1ccccc1	ZINC000578167326	335540043	/nfs/dbraw/zinc/54/00/43/335540043.db2.gz	LNKIANZVQHGYAV-CHWSQXEVSA-N	0	0	297.320	4.184	20	30		CIEDRN
C=CCCCCCNc1cc(Cl)ccc1C(=O)N(C)C	ZINC000578306720	335597095	/nfs/dbraw/zinc/59/70/95/335597095.db2.gz	RCBOVNNTSOXCTP-UHFFFAOYSA-N	0	0	294.826	4.200	20	30		CIEDRN
C=CCCCCSc1nncn1[C@H](C)c1ccccc1	ZINC000578310505	335599159	/nfs/dbraw/zinc/59/91/59/335599159.db2.gz	NQLKBGWRCFUKJZ-CQSZACIVSA-N	0	0	287.432	4.336	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(-c2ncco2)cc1C	ZINC000578336270	335613851	/nfs/dbraw/zinc/61/38/51/335613851.db2.gz	AOAXSPJXGHWIHE-QGZVFWFLSA-N	0	0	284.359	4.191	20	30		CIEDRN
C=CCCCCNC(=O)Nc1cccc(C)c1Cl	ZINC000578708847	335665221	/nfs/dbraw/zinc/66/52/21/335665221.db2.gz	YDNOGXCGRUNUPX-UHFFFAOYSA-N	0	0	266.772	4.126	20	30		CIEDRN
C=C(C)CCNc1ccccc1NC(=O)c1cccs1	ZINC000578798048	335676270	/nfs/dbraw/zinc/67/62/70/335676270.db2.gz	IOUIIUVUNHAIBV-UHFFFAOYSA-N	0	0	286.400	4.379	20	30		CIEDRN
CCCc1ccc([C@H](Nc2cc(C#N)ncn2)C(C)C)cc1	ZINC000578948894	335692066	/nfs/dbraw/zinc/69/20/66/335692066.db2.gz	SMZUZRYRFHTXNG-GOSISDBHSA-N	0	0	294.402	4.110	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N(C)[C@@H]1CC[C@H](SCC)C1	ZINC000181097885	335750267	/nfs/dbraw/zinc/75/02/67/335750267.db2.gz	WYTODTSSFLHDKT-ZNMIVQPWSA-N	0	0	298.496	4.047	20	30		CIEDRN
C[C@H](Nc1ccc(CC#N)cc1)c1nc2ccccc2o1	ZINC000182423330	335818698	/nfs/dbraw/zinc/81/86/98/335818698.db2.gz	MBEAOVBRNISGKW-LBPRGKRZSA-N	0	0	277.327	4.067	20	30		CIEDRN
CC(C)(CCC#N)CNC(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1	ZINC000579628855	335826561	/nfs/dbraw/zinc/82/65/61/335826561.db2.gz	GCXPMIDISHMIAP-ARFHVFGLSA-N	0	0	290.451	4.039	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1cnn(C(CC)CC)c1C	ZINC000182590755	335828625	/nfs/dbraw/zinc/82/86/25/335828625.db2.gz	MNQQZFRCDMQHKT-CYBMUJFWSA-N	0	0	291.439	4.027	20	30		CIEDRN
CCCCN(CCCC)C(=O)c1ccc(C2(C#N)CC2)cc1	ZINC000182766875	335841375	/nfs/dbraw/zinc/84/13/75/335841375.db2.gz	ZKIUJZIXRIYUIW-UHFFFAOYSA-N	0	0	298.430	4.284	20	30		CIEDRN
CC[C@@H](Nc1ccc(SC)cn1)c1ccc(C#N)cc1	ZINC000579671855	335849988	/nfs/dbraw/zinc/84/99/88/335849988.db2.gz	IFNJPVSCQDVZJG-OAHLLOKOSA-N	0	0	283.400	4.238	20	30		CIEDRN
C=CCC[C@H](NC(=O)CCCOC(C)C)c1ccccc1	ZINC000183174269	335870798	/nfs/dbraw/zinc/87/07/98/335870798.db2.gz	GUJQFTDLAAPWNP-KRWDZBQOSA-N	0	0	289.419	4.015	20	30		CIEDRN
N#Cc1ccc(COc2ccccc2-c2nccs2)cc1	ZINC000183176446	335870799	/nfs/dbraw/zinc/87/07/99/335870799.db2.gz	RUZLVWQYSSJRFW-UHFFFAOYSA-N	0	0	292.363	4.261	20	30		CIEDRN
C[C@@H](C#N)CNCc1ccc(-c2ccccc2Cl)s1	ZINC000183821145	335907633	/nfs/dbraw/zinc/90/76/33/335907633.db2.gz	DMVUDMOKNGTWNQ-NSHDSACASA-N	0	0	290.819	4.318	20	30		CIEDRN
CC[C@@H]1CCCC[C@H]1C(=O)N[C@@](C)(C#N)C1CCCCC1	ZINC000579904881	335920279	/nfs/dbraw/zinc/92/02/79/335920279.db2.gz	HWFKPKOTAYPUBK-KYJSFNMBSA-N	0	0	290.451	4.182	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@H](Cc2ccc(C)cc2)C1	ZINC000579905269	335920463	/nfs/dbraw/zinc/92/04/63/335920463.db2.gz	GLBRAEZFHSGVPA-GOSISDBHSA-N	0	0	285.431	4.132	20	30		CIEDRN
CC1=C(C)CN(c2cccc(C(F)F)c2C#N)CC1	ZINC000579973202	335941281	/nfs/dbraw/zinc/94/12/81/335941281.db2.gz	WLTVTEVRUNQDTN-UHFFFAOYSA-N	0	0	262.303	4.042	20	30		CIEDRN
Cc1cc(CNc2ccc(CC#N)cc2)ccc1Cl	ZINC000185144588	335947160	/nfs/dbraw/zinc/94/71/60/335947160.db2.gz	PAYOGUKIWYEDOD-UHFFFAOYSA-N	0	0	270.763	4.327	20	30		CIEDRN
N#CCCCCNc1c(Cl)cc([N+](=O)[O-])cc1Cl	ZINC000185355638	335950925	/nfs/dbraw/zinc/95/09/25/335950925.db2.gz	ORAUQLJFMCKWOL-UHFFFAOYSA-N	0	0	288.134	4.007	20	30		CIEDRN
C[C@H](Sc1cccc(O)c1)c1ccc(C#N)cc1	ZINC000185693228	335955470	/nfs/dbraw/zinc/95/54/70/335955470.db2.gz	XYWHUTJRFNOUHK-NSHDSACASA-N	0	0	255.342	4.117	20	30		CIEDRN
Cc1cc(OCCCC(C)(C)C#N)c(Cl)cc1[N+](=O)[O-]	ZINC000380284542	335968902	/nfs/dbraw/zinc/96/89/02/335968902.db2.gz	CBINGZJZVRHCRX-UHFFFAOYSA-N	0	0	296.754	4.265	20	30		CIEDRN
C=CCCCCSc1nnc(C(F)(F)F)s1	ZINC000581112962	336009948	/nfs/dbraw/zinc/00/99/48/336009948.db2.gz	GWMBKKJJAFWZTI-UHFFFAOYSA-N	0	0	268.329	4.005	20	30		CIEDRN
N#CCC1CCN(Cc2cc(Cl)sc2Cl)CC1	ZINC000581171882	336018869	/nfs/dbraw/zinc/01/88/69/336018869.db2.gz	MYQLHEIPPSCSHM-UHFFFAOYSA-N	0	0	289.231	4.181	20	30		CIEDRN
CCCn1c2ccc(C#N)cc2nc1-c1csc(C)c1	ZINC000381148335	336052503	/nfs/dbraw/zinc/05/25/03/336052503.db2.gz	KZJQDCVVGFCSLO-UHFFFAOYSA-N	0	0	281.384	4.355	20	30		CIEDRN
C=CCOc1ccccc1C(=O)N1C[C@H](C)c2ccccc21	ZINC000195603701	336057098	/nfs/dbraw/zinc/05/70/98/336057098.db2.gz	VGWCKIKDKCBPIM-AWEZNQCLSA-N	0	0	293.366	4.015	20	30		CIEDRN
C=CCSCCNC(=O)Nc1ccc(C(C)(C)C)cc1	ZINC000195729787	336058930	/nfs/dbraw/zinc/05/89/30/336058930.db2.gz	OFVPIUPANLHBSL-UHFFFAOYSA-N	0	0	292.448	4.025	20	30		CIEDRN
CC#CCCCc1nc([C@@H]2CCCC[C@@H]2CC)no1	ZINC000581384725	336066383	/nfs/dbraw/zinc/06/63/83/336066383.db2.gz	JDVJDBDFPDZYOG-UONOGXRCSA-N	0	0	260.381	4.099	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@H]1CC[C@@H](C(F)(F)F)CC1	ZINC000581395807	336067947	/nfs/dbraw/zinc/06/79/47/336067947.db2.gz	YNZMQGXWNKEDLX-RWMBFGLXSA-N	0	0	291.357	4.168	20	30		CIEDRN
N#Cc1cc(Cl)cc(OC[C@H]2CCCC2(F)F)c1	ZINC000381610213	336069433	/nfs/dbraw/zinc/06/94/33/336069433.db2.gz	IJQOFSQMSUJEKU-SNVBAGLBSA-N	0	0	271.694	4.026	20	30		CIEDRN
CC(F)(F)CCNc1ccc(C(F)(F)F)c(C#N)c1	ZINC000381642153	336069966	/nfs/dbraw/zinc/06/99/66/336069966.db2.gz	OMBQEOMVQYQFTQ-UHFFFAOYSA-N	0	0	278.224	4.034	20	30		CIEDRN
N#Cc1ccnc(N2CCCC3(CCCCC3)C2)c1Cl	ZINC000581505579	336091802	/nfs/dbraw/zinc/09/18/02/336091802.db2.gz	RIIBBMMGABIPNP-UHFFFAOYSA-N	0	0	289.810	4.157	20	30		CIEDRN
C[C@H](c1ccccc1)N(C)Cc1ccc(C#N)cc1Cl	ZINC000383898412	336119254	/nfs/dbraw/zinc/11/92/54/336119254.db2.gz	BWEWKFGYGRDIIC-CYBMUJFWSA-N	0	0	284.790	4.405	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCc1cccc(SCC)c1	ZINC000581731478	336139352	/nfs/dbraw/zinc/13/93/52/336139352.db2.gz	BMBDDUGSRPERFK-ZDUSSCGKSA-N	0	0	277.433	4.017	20	30		CIEDRN
C[C@H](N[C@H](CCCC#N)c1ccccc1)c1cscn1	ZINC000581839213	336150400	/nfs/dbraw/zinc/15/04/00/336150400.db2.gz	WAXROGBZNAPXAX-DZGCQCFKSA-N	0	0	285.416	4.229	20	30		CIEDRN
N#Cc1ccc(NCCC2(F)CCC2)cc1C(F)(F)F	ZINC000581905433	336164045	/nfs/dbraw/zinc/16/40/45/336164045.db2.gz	FGYIKVYECVCMAY-UHFFFAOYSA-N	0	0	286.272	4.271	20	30		CIEDRN
CN(CCC1(C#N)CCCCC1)Cc1nc2ccccc2o1	ZINC000581930017	336171346	/nfs/dbraw/zinc/17/13/46/336171346.db2.gz	XUAZLPMADDTPML-UHFFFAOYSA-N	0	0	297.402	4.124	20	30		CIEDRN
C[C@@H]1C[C@@H]1[C@@H](Nc1cccc(C#N)n1)c1ccc(Cl)cc1	ZINC000301873413	533741861	/nfs/dbraw/zinc/74/18/61/533741861.db2.gz	XMMSNVQDWWBBDD-PJQXDXOGSA-N	0	0	297.789	4.416	20	30		CIEDRN
C[C@@H]1CCC[C@@H](NC(=O)C[C@@H](CC#N)c2ccccc2)CC1	ZINC000331999072	533765600	/nfs/dbraw/zinc/76/56/00/533765600.db2.gz	NQGVJADTOOUZSD-KBAYOESNSA-N	0	0	298.430	4.159	20	30		CIEDRN
C[C@H](CC1CCCCC1)C(=O)N[C@@H]1CCCc2c[nH]nc21	ZINC000330099537	533773609	/nfs/dbraw/zinc/77/36/09/533773609.db2.gz	DDZLWBIGVYWVNN-IUODEOHRSA-N	0	0	289.423	4.350	20	30		CIEDRN
C[C@@H]1CCC[C@H](C(=O)Nc2cccc3c2OCCC3=O)C1	ZINC000329508740	533820023	/nfs/dbraw/zinc/82/00/23/533820023.db2.gz	MBFMGGWKXMSUPH-NEPJUHHUSA-N	0	0	287.359	4.066	20	30		CIEDRN
C[C@H](Nc1cc(C2CC2)ccn1)c1ccc(C#N)cc1F	ZINC000353627490	534015515	/nfs/dbraw/zinc/01/55/15/534015515.db2.gz	WHGSFAFPRDXTQT-NSHDSACASA-N	0	0	281.334	4.143	20	30		CIEDRN
C[C@H]1Cc2ccccc2[C@@H]1Nc1cccc(F)c1C#N	ZINC000301239957	534115770	/nfs/dbraw/zinc/11/57/70/534115770.db2.gz	NLKOEBYHEZPIBZ-APPDUMDISA-N	0	0	266.319	4.043	20	30		CIEDRN
C[C@H](SCC1(C#N)CC1)c1ccc(F)cc1F	ZINC000344492317	534124369	/nfs/dbraw/zinc/12/43/69/534124369.db2.gz	YYQLTOHDXUBNAZ-VIFPVBQESA-N	0	0	253.317	4.063	20	30		CIEDRN
Cc1ccc(-c2nc(/C=C\c3ccncc3C#N)co2)cc1	ZINC000347457296	534205440	/nfs/dbraw/zinc/20/54/40/534205440.db2.gz	YVPIQVLHCHQEEY-SREVYHEPSA-N	0	0	287.322	4.087	20	30		CIEDRN
C[C@H](NC(=O)[C@]1(C)CCCNC1=O)[C@@H](C)C1CCCCC1	ZINC000330308634	534280864	/nfs/dbraw/zinc/28/08/64/534280864.db2.gz	MISVSVXBURNHQN-IIYDPXPESA-N	0	0	294.439	4.304	20	30		CIEDRN
CC(C)n1c2cc(F)ccc2nc1-c1ccc(C#N)cc1	ZINC000536143042	517497094	/nfs/dbraw/zinc/49/70/94/517497094.db2.gz	VFEYSXZUBPVYLA-UHFFFAOYSA-N	0	0	279.318	4.295	20	30		CIEDRN
C[C@@H](NC(=O)Nc1cccc(Cl)c1)c1ccc(C#N)cc1	ZINC000505326238	518177870	/nfs/dbraw/zinc/17/78/70/518177870.db2.gz	STRCSBOOMMBMNJ-LLVKDONJSA-N	0	0	299.761	4.094	20	30		CIEDRN
O=C(CCC1CCCC1)Nc1cccc2ocnc21	ZINC000330096073	534336767	/nfs/dbraw/zinc/33/67/67/534336767.db2.gz	WSKHCYVJZBGPEZ-UHFFFAOYSA-N	0	0	258.321	4.386	20	30		CIEDRN
C#CCCCCC(=O)N(c1cnc2ccccc2c1)C(C)C	ZINC000279706429	518246084	/nfs/dbraw/zinc/24/60/84/518246084.db2.gz	NNMMHGMVMHPVKB-UHFFFAOYSA-N	0	0	294.398	4.170	20	30		CIEDRN
C=CCCCNC(=O)Nc1cccc(-c2nc(C)c(C)o2)c1	ZINC000279862095	518701415	/nfs/dbraw/zinc/70/14/15/518701415.db2.gz	FAENWKFMLOVKHW-UHFFFAOYSA-N	0	0	299.374	4.046	20	30		CIEDRN
C=CC[C@H](C)[C@@H](C)Nc1cccc(NC(=O)N(C)C)c1C	ZINC000279749158	519111232	/nfs/dbraw/zinc/11/12/32/519111232.db2.gz	YMHJCBRGLMAKBV-GXTWGEPZSA-N	0	0	289.423	4.101	20	30		CIEDRN
CC(C)Oc1ccc(NCc2ccc(C#N)o2)cc1Cl	ZINC000157449246	519781118	/nfs/dbraw/zinc/78/11/18/519781118.db2.gz	WAYOULRIODJJFM-UHFFFAOYSA-N	0	0	290.750	4.204	20	30		CIEDRN
Cc1ccc2cccc(NC(=O)[C@@H]3CCC(=O)[C@@H](C)C3)c2n1	ZINC000329000896	534478203	/nfs/dbraw/zinc/47/82/03/534478203.db2.gz	VUQVAAYCXMHYLQ-SMDDNHRTSA-N	0	0	296.370	4.137	20	30		CIEDRN
Cc1c[nH]c(-c2ccccc2NC(=O)[C@@H]2C[C@@H]2C2CC2)n1	ZINC000330220804	534518506	/nfs/dbraw/zinc/51/85/06/534518506.db2.gz	LCBRLBXWEVSSMZ-ZIAGYGMSSA-N	0	0	281.359	4.019	20	30		CIEDRN
Cc1c[nH]c(-c2ccccc2NC(=O)[C@H]2C[C@H]2C2CC2)n1	ZINC000330220801	534519582	/nfs/dbraw/zinc/51/95/82/534519582.db2.gz	LCBRLBXWEVSSMZ-KBPBESRZSA-N	0	0	281.359	4.019	20	30		CIEDRN
Cc1oc(-c2ccccc2)nc1CSCC1(C#N)CC1	ZINC000344463607	534529445	/nfs/dbraw/zinc/52/94/45/534529445.db2.gz	NPDSKQGVODEFMT-UHFFFAOYSA-N	0	0	284.384	4.187	20	30		CIEDRN
Cc1oc2ccc(NC(=O)[C@@H]3CCO[C@@H]3C)cc2c1C	ZINC000330086914	534549905	/nfs/dbraw/zinc/54/99/05/534549905.db2.gz	MSCIGJVAXFAXEQ-DGCLKSJQSA-N	0	0	273.332	4.063	20	30		CIEDRN
CC[C@H](C)Oc1cc(C)ccc1CNc1cnccc1C#N	ZINC000354546472	521764336	/nfs/dbraw/zinc/76/43/36/521764336.db2.gz	VBAYZKBQNZGQPV-AWEZNQCLSA-N	0	0	295.386	4.051	20	30		CIEDRN
CCc1nc([C@@H](C)N[C@@H](CC)c2ccc(C#N)cc2)cs1	ZINC000278827114	522421372	/nfs/dbraw/zinc/42/13/72/522421372.db2.gz	SYBYSWYCHAJTJG-DOMZBBRYSA-N	0	0	299.443	4.379	20	30		CIEDRN
CCc1nc([C@H](C)N[C@H](CC)c2ccc(C#N)cc2)cs1	ZINC000278827128	522457531	/nfs/dbraw/zinc/45/75/31/522457531.db2.gz	SYBYSWYCHAJTJG-SWLSCSKDSA-N	0	0	299.443	4.379	20	30		CIEDRN
Cc1nc2ccc(C(=O)N[C@@H]3CC[C@@H]4CCC[C@@H]4C3)cc2o1	ZINC000329897883	534648126	/nfs/dbraw/zinc/64/81/26/534648126.db2.gz	DGXUWHMGVFHHHL-GZBFAFLISA-N	0	0	298.386	4.410	20	30		CIEDRN
Cc1cnc([C@H](C)S[C@H](C)c2ccc(C#N)cc2)o1	ZINC000356077663	534660793	/nfs/dbraw/zinc/66/07/93/534660793.db2.gz	LAMRDVAVTABYDU-NEPJUHHUSA-N	0	0	272.373	4.410	20	30		CIEDRN
N#CCN(Cc1cscc1C(F)(F)F)C1CCCC1	ZINC000356144267	534665090	/nfs/dbraw/zinc/66/50/90/534665090.db2.gz	YRMULVUKEURQSG-UHFFFAOYSA-N	0	0	288.338	4.035	20	30		CIEDRN
CC[C@@H](Nc1cc(OC)cc(OC)c1)c1ccc(C#N)cc1	ZINC000278381234	522956602	/nfs/dbraw/zinc/95/66/02/522956602.db2.gz	DBIDLJGFXVFXBO-GOSISDBHSA-N	0	0	296.370	4.139	20	30		CIEDRN
CN(C(=O)CC1=CCCCC1)c1cc(Cl)ccc1C#N	ZINC000156939740	523794706	/nfs/dbraw/zinc/79/47/06/523794706.db2.gz	BFJXLZJPSVGBET-UHFFFAOYSA-N	0	0	288.778	4.065	20	30		CIEDRN
CC[C@H](C)CC(=O)N(Cc1ccco1)c1ccccc1C#N	ZINC000276695081	523842776	/nfs/dbraw/zinc/84/27/76/523842776.db2.gz	ADMQZFWYONCFTJ-AWEZNQCLSA-N	0	0	296.370	4.121	20	30		CIEDRN
N#Cc1cnccc1/C=C\c1cccc(-c2ccccn2)c1	ZINC000349103814	534827737	/nfs/dbraw/zinc/82/77/37/534827737.db2.gz	CZXUSYOULIMWPA-FPLPWBNLSA-N	0	0	283.334	4.186	20	30		CIEDRN
C[C@@H]1C[C@H]1c1ccc(CNC2(c3cccc(C#N)c3)CC2)o1	ZINC000269632143	525507274	/nfs/dbraw/zinc/50/72/74/525507274.db2.gz	UZOZDXDTPFWSHK-CXAGYDPISA-N	0	0	292.382	4.054	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)N1C[C@H]2CCCCCC[C@H]21	ZINC000366545692	525548967	/nfs/dbraw/zinc/54/89/67/525548967.db2.gz	KLSCPONDTCXZLV-NVXWUHKLSA-N	0	0	297.402	4.053	20	30		CIEDRN
CSCCc1ccc(NCc2ccc(C#N)s2)cc1	ZINC000129080803	525602889	/nfs/dbraw/zinc/60/28/89/525602889.db2.gz	QLUDSCFXQVTMIP-UHFFFAOYSA-N	0	0	288.441	4.137	20	30		CIEDRN
C[C@H](Nc1ccc([C@H]2CCOC2)cc1)c1cccc(C#N)c1	ZINC000294991436	525659696	/nfs/dbraw/zinc/65/96/96/525659696.db2.gz	LIPWZZCXZXLBAL-KSSFIOAISA-N	0	0	292.382	4.235	20	30		CIEDRN
Cc1ccc([C@@H](C)Nc2ccc(C#N)cc2F)cc1	ZINC000049558453	525752575	/nfs/dbraw/zinc/75/25/75/525752575.db2.gz	JVAHECUBOCTMGQ-GFCCVEGCSA-N	0	0	254.308	4.179	20	30		CIEDRN
Cc1ccc([C@@H](C)Nc2nc3c(cc2C#N)CCCC3)s1	ZINC000044420077	525754466	/nfs/dbraw/zinc/75/44/66/525754466.db2.gz	QOPSHXFCAJDVMO-GFCCVEGCSA-N	0	0	297.427	4.375	20	30		CIEDRN
Cc1ccsc1CNc1ccc(C#N)c(Cl)c1	ZINC000037393330	525861403	/nfs/dbraw/zinc/86/14/03/525861403.db2.gz	NFBGKFLSKSVMDL-UHFFFAOYSA-N	0	0	262.765	4.194	20	30		CIEDRN
Cc1c(N[C@H](C)c2ccc(C#N)cc2)cnn1C1CCCC1	ZINC000194625808	525876639	/nfs/dbraw/zinc/87/66/39/525876639.db2.gz	MNBYDBDEAZIZCC-CYBMUJFWSA-N	0	0	294.402	4.351	20	30		CIEDRN
CS[C@H]1CCC[C@@H](Nc2ccc(C#N)c(Cl)c2)C1	ZINC000227358483	525907711	/nfs/dbraw/zinc/90/77/11/525907711.db2.gz	KYCROBZDBRCWGO-YPMHNXCESA-N	0	0	280.824	4.298	20	30		CIEDRN
Cc1coc(-c2cccc(NCc3cccc(C#N)c3)c2)n1	ZINC000152045514	526281082	/nfs/dbraw/zinc/28/10/82/526281082.db2.gz	YUBHUZIKSODQFU-UHFFFAOYSA-N	0	0	289.338	4.134	20	30		CIEDRN
N#Cc1c(Cl)nsc1N1CCC[C@@H]1c1ccccc1	ZINC000267234033	526519648	/nfs/dbraw/zinc/51/96/48/526519648.db2.gz	QNBUULJTODMVBM-GFCCVEGCSA-N	0	0	289.791	4.010	20	30		CIEDRN
N#Cc1cc(C(F)(F)F)ccc1NCc1ccc(F)cc1	ZINC000037333903	526548725	/nfs/dbraw/zinc/54/87/25/526548725.db2.gz	JEZOSWANBADOCZ-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)c1cscc1C	ZINC000347882086	526568075	/nfs/dbraw/zinc/56/80/75/526568075.db2.gz	OKTZOQMJARCEIK-UHFFFAOYSA-N	0	0	285.412	4.275	20	30		CIEDRN
N#Cc1ccc(-c2nnc(CSC3CCCCC3)o2)cc1	ZINC000133321572	526584320	/nfs/dbraw/zinc/58/43/20/526584320.db2.gz	LUKAVZKDSLFKCJ-UHFFFAOYSA-N	0	0	299.399	4.174	20	30		CIEDRN
N#Cc1ccc(Cl)cc1NCCc1ccccc1F	ZINC000062785199	526634798	/nfs/dbraw/zinc/63/47/98/526634798.db2.gz	IFWABBQNDBOZAY-UHFFFAOYSA-N	0	0	274.726	4.005	20	30		CIEDRN
N#Cc1ccc(NCc2ccc(F)cc2)cc1C(F)(F)F	ZINC000036805571	526664669	/nfs/dbraw/zinc/66/46/69/526664669.db2.gz	LTXITJGORYKDEG-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
CC(C)(C)[C@@H]1NC(=O)CC[C@H]1NC(=O)[C@H]1CCC(C)(C)C1	ZINC000329287451	526680846	/nfs/dbraw/zinc/68/08/46/526680846.db2.gz	PPIUIMQAUQWEMW-OUCADQQQSA-N	0	0	294.439	4.303	20	30		CIEDRN
CC(C)(C)[C@@H]1NC(=O)CC[C@H]1NC(=O)CC1CCCCC1	ZINC000329286631	526681150	/nfs/dbraw/zinc/68/11/50/526681150.db2.gz	PIALHPKZDXUUMO-CZUORRHYSA-N	0	0	294.439	4.447	20	30		CIEDRN
N#Cc1ccc(SCC(=O)C2CCC2)cc1C(F)(F)F	ZINC000277889682	526685142	/nfs/dbraw/zinc/68/51/42/526685142.db2.gz	DGHDIWAEVRMVKH-UHFFFAOYSA-N	0	0	299.317	4.038	20	30		CIEDRN
N#Cc1ccc(SCc2csc(C3CC3)n2)cc1	ZINC000340043186	526687043	/nfs/dbraw/zinc/68/70/43/526687043.db2.gz	LQDBPLPNTZROLV-UHFFFAOYSA-N	0	0	272.398	4.184	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)c1ccc(OC(C)C)cc1	ZINC000191628579	526692291	/nfs/dbraw/zinc/69/22/91/526692291.db2.gz	JUYPKCRNOZAZEG-CQSZACIVSA-N	0	0	275.392	4.039	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000352166336	526700851	/nfs/dbraw/zinc/70/08/51/526700851.db2.gz	MZENTVDDWLBRDD-WBVHZDCISA-N	0	0	284.403	4.140	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H]1c1cccc(C)c1	ZINC000185244194	526707267	/nfs/dbraw/zinc/70/72/67/526707267.db2.gz	GDLUPDZWHOGQGF-RDJZCZTQSA-N	0	0	271.404	4.261	20	30		CIEDRN
Cc1nsc(N(C)Cc2csc3ccccc23)c1C#N	ZINC000339968969	526708954	/nfs/dbraw/zinc/70/89/54/526708954.db2.gz	JTUFHFKFKUONBN-UHFFFAOYSA-N	0	0	299.424	4.174	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000352166335	526712764	/nfs/dbraw/zinc/71/27/64/526712764.db2.gz	MZENTVDDWLBRDD-RDJZCZTQSA-N	0	0	284.403	4.140	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(COC(C)C)cc1	ZINC000185265192	526714654	/nfs/dbraw/zinc/71/46/54/526714654.db2.gz	MRDYSPIJJOZOLB-AWEZNQCLSA-N	0	0	275.392	4.152	20	30		CIEDRN
C=C(C)[C@H]1OCC[C@H]1C(=O)Nc1cc(C)cc2cccnc21	ZINC000330151745	526842660	/nfs/dbraw/zinc/84/26/60/526842660.db2.gz	WIPACVRZHAVZBJ-RHSMWYFYSA-N	0	0	296.370	4.112	20	30		CIEDRN
Cc1sc(NC(=O)[C@H]2CCC[C@@H](C)C2)c(C#N)c1C	ZINC000356602806	526883338	/nfs/dbraw/zinc/88/33/38/526883338.db2.gz	YPSMGZSBSOYLRM-SKDRFNHKSA-N	0	0	276.405	4.001	20	30		CIEDRN
C=CC(C)(C)C(=O)Oc1ccc(-c2c(C)noc2C)cc1	ZINC000297070697	526949370	/nfs/dbraw/zinc/94/93/70/526949370.db2.gz	UEDULAVXWOYGPS-UHFFFAOYSA-N	0	0	285.343	4.076	20	30		CIEDRN
C=CC(C)(C)C(=O)Nc1cccc(C2SCCS2)c1	ZINC000294526245	526949828	/nfs/dbraw/zinc/94/98/28/526949828.db2.gz	UFLLJRKOECTPRQ-UHFFFAOYSA-N	0	0	293.457	4.316	20	30		CIEDRN
C=CCSCCCC(=O)Nc1c(C)cc(C)cc1C	ZINC000114756412	526979764	/nfs/dbraw/zinc/97/97/64/526979764.db2.gz	ZZYVJFTVZVVILE-UHFFFAOYSA-N	0	0	277.433	4.250	20	30		CIEDRN
CC(C)(CCC#N)CNC(=O)c1ccc(Cl)cc1Cl	ZINC000345906430	526996802	/nfs/dbraw/zinc/99/68/02/526996802.db2.gz	MBUSVCZRKLOHAE-UHFFFAOYSA-N	0	0	299.201	4.053	20	30		CIEDRN
C=CCS[C@@H](C)C(=O)Nc1ccccc1C(C)C	ZINC000114756902	527007309	/nfs/dbraw/zinc/00/73/09/527007309.db2.gz	VYKGOFRRELFQMW-LBPRGKRZSA-N	0	0	263.406	4.056	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000352166381	527031132	/nfs/dbraw/zinc/03/11/32/527031132.db2.gz	NJTNVTIBONSDEY-SFHVURJKSA-N	0	0	296.414	4.306	20	30		CIEDRN
C=CCCC1(C(=O)NC[C@]2(C)C[C@H]2c2ccccc2)CC1	ZINC000355002889	527091331	/nfs/dbraw/zinc/09/13/31/527091331.db2.gz	RSSODOQDCGHRTA-WMZOPIPTSA-N	0	0	283.415	4.043	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)c2cscc2C)CCCC1(C)C	ZINC000347478087	527117682	/nfs/dbraw/zinc/11/76/82/527117682.db2.gz	DYIBRZJCUDQHDR-AWEZNQCLSA-N	0	0	277.433	4.263	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)c2ccnc(C3CC3)c2)CCCC1(C)C	ZINC000347479412	527118347	/nfs/dbraw/zinc/11/83/47/527118347.db2.gz	GIHSUZVIGFKXEF-KRWDZBQOSA-N	0	0	298.430	4.166	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(N[C@@H](C)CCc2ccccc2)c1	ZINC000302037046	527226285	/nfs/dbraw/zinc/22/62/85/527226285.db2.gz	PVUYLQBPRHJMGP-AWEZNQCLSA-N	0	0	292.382	4.194	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(N[C@H]2CSc3ccccc32)c1	ZINC000347424558	527228143	/nfs/dbraw/zinc/22/81/43/527228143.db2.gz	UCXUHAZGNDMWOU-INIZCTEOSA-N	0	0	294.379	4.020	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1cc(F)c[nH]1	ZINC000349565813	527258638	/nfs/dbraw/zinc/25/86/38/527258638.db2.gz	YPOYLMDIMZYGSL-UHFFFAOYSA-N	0	0	286.350	4.258	20	30		CIEDRN
C=CCC[C@@H](Nc1cccc(F)n1)c1ccccc1	ZINC000301796803	527451541	/nfs/dbraw/zinc/45/15/41/527451541.db2.gz	UDAAKTJJAWKBQI-CQSZACIVSA-N	0	0	256.324	4.340	20	30		CIEDRN
CC(C)(C#N)CC(=O)N[C@H](CC1CCCC1)c1ccccc1	ZINC000355141708	527457248	/nfs/dbraw/zinc/45/72/48/527457248.db2.gz	KTBNLVPQIILPLW-QGZVFWFLSA-N	0	0	298.430	4.364	20	30		CIEDRN
CC(C)(C#N)CCC[S@](=O)C1CCC(C)(C)CC1	ZINC000346086866	527466850	/nfs/dbraw/zinc/46/68/50/527466850.db2.gz	VBCIMNZBJBLZQD-SFHVURJKSA-N	0	0	269.454	4.034	20	30		CIEDRN
O=C(/C=C/c1cccc(O)c1)c1ccc(Cl)s1	ZINC000057437836	527628165	/nfs/dbraw/zinc/62/81/65/527628165.db2.gz	AEVVKDBZDSQTGG-SNAWJCMRSA-N	0	0	264.733	4.003	20	30		CIEDRN
CC(C)CCN(CCC#N)Cc1cccc(C(F)F)c1	ZINC000348047062	527716337	/nfs/dbraw/zinc/71/63/37/527716337.db2.gz	KWGWFPPUSQDJMK-UHFFFAOYSA-N	0	0	280.362	4.386	20	30		CIEDRN
CC1(CCNC(=O)c2ccc3c(c2)NC(=O)C3(C)C)CC1	ZINC000329065931	527921989	/nfs/dbraw/zinc/92/19/89/527921989.db2.gz	LFDBYTRQOVMFNL-UHFFFAOYSA-N	0	0	286.375	4.061	20	30		CIEDRN
CC(C)C[C@@H](NC(=O)c1sccc1C#N)c1ccccc1	ZINC000353603005	528358037	/nfs/dbraw/zinc/35/80/37/528358037.db2.gz	HZIOCOKJNWAVBE-OAHLLOKOSA-N	0	0	298.411	4.137	20	30		CIEDRN
CC(C)[C@@H](C)CC(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000352226438	528387286	/nfs/dbraw/zinc/38/72/86/528387286.db2.gz	TZJZLZSPCVYEAL-RDJZCZTQSA-N	0	0	286.419	4.220	20	30		CIEDRN
CC(C)c1scnc1NC(=O)NCC1(C)CCCC1	ZINC000329494375	528523051	/nfs/dbraw/zinc/52/30/51/528523051.db2.gz	DDXFDFOHRLMZGL-UHFFFAOYSA-N	0	0	281.425	4.173	20	30		CIEDRN
CC(C)[C@@H]1CCCC[C@@H]1NC(=O)Cc1ccc2n[nH]cc2c1	ZINC000330024164	528649613	/nfs/dbraw/zinc/64/96/13/528649613.db2.gz	JNQLJWHXUJGNHZ-RDJZCZTQSA-N	0	0	299.418	4.277	20	30		CIEDRN
CC(C)[C@@H]1CCC[C@@H](NC(=O)c2ncoc2C2CC2)CC1	ZINC000329142717	528676207	/nfs/dbraw/zinc/67/62/07/528676207.db2.gz	VEAYJAYYSRZRLP-TZMCWYRMSA-N	0	0	290.407	4.462	20	30		CIEDRN
CCOc1cccc([C@H](C)Nc2ccc(C#N)cc2F)c1	ZINC000301156812	528690229	/nfs/dbraw/zinc/69/02/29/528690229.db2.gz	RSRSICQHBCMDJW-LBPRGKRZSA-N	0	0	284.334	4.269	20	30		CIEDRN
CC(=O)Nc1ncccc1NC(=O)C[C@H]1C=CCCC1	ZINC000330333976	528747921	/nfs/dbraw/zinc/74/79/21/528747921.db2.gz	YNDKXMWUJOWUTH-LBPRGKRZSA-N	0	0	273.336	4.024	20	30		CIEDRN
CCC(CC)CN(CCC#N)C(=O)c1sccc1Cl	ZINC000352636491	528750848	/nfs/dbraw/zinc/75/08/48/528750848.db2.gz	HBSVFMVMWPKTOW-UHFFFAOYSA-N	0	0	298.839	4.194	20	30		CIEDRN
CCCc1occc1C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000344249650	528803689	/nfs/dbraw/zinc/80/36/89/528803689.db2.gz	DRHJSQHYDSLVQP-UHFFFAOYSA-N	0	0	288.734	4.009	20	30		CIEDRN
CC1(C)CC(CC(=O)N[C@@H](CCCC#N)c2ccccc2)C1	ZINC000352205573	528884987	/nfs/dbraw/zinc/88/49/87/528884987.db2.gz	GXGSCCQEFRCJOS-KRWDZBQOSA-N	0	0	298.430	4.364	20	30		CIEDRN
CCCC[C@H](C)C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000352175660	528885685	/nfs/dbraw/zinc/88/56/85/528885685.db2.gz	WXESTNAOHNHWJU-DOTOQJQBSA-N	0	0	286.419	4.364	20	30		CIEDRN
CC1(C)CCCC[C@@H]1NC(=O)Cc1ccc2c[nH]nc2c1	ZINC000329563923	528914163	/nfs/dbraw/zinc/91/41/63/528914163.db2.gz	SDFKZZGYLRMJMU-HNNXBMFYSA-N	0	0	285.391	4.031	20	30		CIEDRN
CC1(C)CCCC[C@H]1Nc1snc(Cl)c1C#N	ZINC000301611132	528923330	/nfs/dbraw/zinc/92/33/30/528923330.db2.gz	DGSHWKQUEOYWAG-SECBINFHSA-N	0	0	269.801	4.049	20	30		CIEDRN
CC1(C)CCC[C@H](CC(=O)NCc2noc(C3CC3)n2)C1	ZINC000329006404	528980032	/nfs/dbraw/zinc/98/00/32/528980032.db2.gz	XTXAQQGMVOKQFP-LLVKDONJSA-N	0	0	291.395	4.010	20	30		CIEDRN
CC1(C)CCC[C@H]1C(=O)Nc1ncn(C2CCCCC2)n1	ZINC000330082638	528987688	/nfs/dbraw/zinc/98/76/88/528987688.db2.gz	KJLWQVWLTVCLHR-ZDUSSCGKSA-N	0	0	290.411	4.198	20	30		CIEDRN
CCc1cccc(C)c1NCc1ccc(C#N)cc1OC	ZINC000347068688	529160114	/nfs/dbraw/zinc/16/01/14/529160114.db2.gz	NRJVIOOCOIKMNT-UHFFFAOYSA-N	0	0	280.371	4.050	20	30		CIEDRN
CC[C@H](C)n1ncc(N[C@H]2CCc3ccc(C#N)cc32)c1C	ZINC000353619666	529294933	/nfs/dbraw/zinc/29/49/33/529294933.db2.gz	CXEGTVCPGGUYMG-SJCJKPOMSA-N	0	0	294.402	4.134	20	30		CIEDRN
CC[C@H](CC#N)Nc1cc(C(C)(C)C)nc(C(C)C)n1	ZINC000302827486	529301418	/nfs/dbraw/zinc/30/14/18/529301418.db2.gz	HWLVWAQOBGVSRD-GFCCVEGCSA-N	0	0	274.412	4.002	20	30		CIEDRN
CC[C@H](CC1CCCC1)C(=O)N[C@H]1CCCc2c[nH]nc21	ZINC000330124088	529319372	/nfs/dbraw/zinc/31/93/72/529319372.db2.gz	LELVFQGSPPAOQE-HIFRSBDPSA-N	0	0	289.423	4.350	20	30		CIEDRN
CC[C@H]1C[C@H](C)CN1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000336045269	529325159	/nfs/dbraw/zinc/32/51/59/529325159.db2.gz	ZBGVPIDBYORGFZ-BBRMVZONSA-N	0	0	299.418	4.140	20	30		CIEDRN
O=C1c2ccccc2SC/C1=C/c1ccccc1	ZINC000000084815	567928387	/nfs/dbraw/zinc/92/83/87/567928387.db2.gz	WQEPLGCJMWZKFO-RAXLEYEMSA-N	0	0	252.338	4.059	20	30		CIEDRN
Cc1cc(C(=O)Nc2ccc(Cl)c(C#N)c2)sc1C	ZINC000096995321	185149469	/nfs/dbraw/zinc/14/94/69/185149469.db2.gz	NIHQDNMZFXSEPP-UHFFFAOYSA-N	0	0	290.775	4.142	20	30		CIEDRN
CC[C@]1(C)CCN(C(=O)Nc2ccc(C(C)(C)C#N)cc2)C1	ZINC000335529071	529398670	/nfs/dbraw/zinc/39/86/70/529398670.db2.gz	CJGRSWVXLHJHEN-GOSISDBHSA-N	0	0	299.418	4.142	20	30		CIEDRN
CCc1cc(C(=O)N(CCC#N)C(C)(C)CC)sc1C	ZINC000348513320	529510956	/nfs/dbraw/zinc/51/09/56/529510956.db2.gz	WVBNAFOQTAUXCF-UHFFFAOYSA-N	0	0	292.448	4.163	20	30		CIEDRN
CC[C@H](NC(=O)C[C@@H]1CCCC(=O)N1)c1cccs1	ZINC000329260100	529579333	/nfs/dbraw/zinc/57/93/33/529579333.db2.gz	AVGRCHXQFVEPOG-QWRGUYRKSA-N	0	0	280.393	4.055	20	30		CIEDRN
CCc1nc([C@@H](C)Nc2ccc(C#N)c(Cl)c2)cs1	ZINC000301250649	529745409	/nfs/dbraw/zinc/74/54/09/529745409.db2.gz	MKVSZLRQZTTYMU-SECBINFHSA-N	0	0	291.807	4.404	20	30		CIEDRN
C=CCOCCSCc1ccc(C(F)(F)F)cc1	ZINC000519652688	265519344	/nfs/dbraw/zinc/51/93/44/265519344.db2.gz	PGBHATIXWWMLPM-UHFFFAOYSA-N	0	0	276.323	4.141	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(-c2cccc(C(F)(F)F)n2)no1	ZINC000573842257	334970731	/nfs/dbraw/zinc/97/07/31/334970731.db2.gz	VUGOMEBJOUALLB-CYBMUJFWSA-N	0	0	297.280	4.004	20	30		CIEDRN
CCN(CCC#N)[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000123329051	187085223	/nfs/dbraw/zinc/08/52/23/187085223.db2.gz	HPGLRLPLQIKGAM-LLVKDONJSA-N	0	0	270.298	4.002	20	30		CIEDRN
Cc1cc([C@H](C)Nc2nc(C)c(C#N)cc2Cl)c(C)o1	ZINC000336832335	334984467	/nfs/dbraw/zinc/98/44/67/334984467.db2.gz	LRBUGCHBEYJEJW-JTQLQIEISA-N	0	0	289.766	4.298	20	30		CIEDRN
CCC[C@H](C)CC(=O)Nc1ccccc1SCCC#N	ZINC000108199604	260639787	/nfs/dbraw/zinc/63/97/87/260639787.db2.gz	LMOIHICXIMLQAY-ZDUSSCGKSA-N	0	0	290.432	4.457	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N1CCC[C@@H]1c1ccc(C)c(C)c1	ZINC000574184667	334999102	/nfs/dbraw/zinc/99/91/02/334999102.db2.gz	NZAIEGDANGGXAA-DOTOQJQBSA-N	0	0	286.419	4.115	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(Cc2csc(C(C)C)n2)no1	ZINC000574197990	334999970	/nfs/dbraw/zinc/99/99/70/334999970.db2.gz	RRZGZNYMHDIZTA-LLVKDONJSA-N	0	0	291.420	4.310	20	30		CIEDRN
N#Cc1ccc(CNc2ccccc2F)c(C(F)(F)F)c1	ZINC000574243655	335003488	/nfs/dbraw/zinc/00/34/88/335003488.db2.gz	SSTZOIKHBXAULJ-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc([C@H](C)Oc2ccccc2)no1	ZINC000574433702	335019322	/nfs/dbraw/zinc/01/93/22/335019322.db2.gz	MJLNPNUQMUBJKS-STQMWFEESA-N	0	0	272.348	4.279	20	30		CIEDRN
CCc1ccc([C@@H](C#N)NC(=O)C[C@H](CC)C(C)C)cc1	ZINC000574721933	335042589	/nfs/dbraw/zinc/04/25/89/335042589.db2.gz	QHAWXPFMSUXMPX-DOTOQJQBSA-N	0	0	286.419	4.002	20	30		CIEDRN
Cc1cc(NC[C@H]2CCCC[C@H]2C(F)(F)F)cc(C#N)n1	ZINC000574787658	335047552	/nfs/dbraw/zinc/04/75/52/335047552.db2.gz	GYVUUWGIMVIJGK-BXUZGUMPSA-N	0	0	297.324	4.042	20	30		CIEDRN
C=C(C)CSCc1cc(C(C)=O)ccc1OCC	ZINC000497202493	262104345	/nfs/dbraw/zinc/10/43/45/262104345.db2.gz	ZKDYQIWKEDLNSY-UHFFFAOYSA-N	0	0	264.390	4.097	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)C[C@H](C)c1ccccc1F	ZINC000171160157	335057047	/nfs/dbraw/zinc/05/70/47/335057047.db2.gz	YRTAGPUQUGRPPT-ZDUSSCGKSA-N	0	0	296.345	4.138	20	30		CIEDRN
C=CCCCSCC(=O)N[C@@H](C)c1ccc(C)c(C)c1	ZINC000522758419	262339110	/nfs/dbraw/zinc/33/91/10/262339110.db2.gz	XFHUQIYVOPIZRU-HNNXBMFYSA-N	0	0	291.460	4.180	20	30		CIEDRN
CCC[C@H](C(=O)N(Cc1ccc(C#N)cc1)C1CC1)C(C)C	ZINC000179451016	260048407	/nfs/dbraw/zinc/04/84/07/260048407.db2.gz	TYBDBUYDGDADEG-SFHVURJKSA-N	0	0	298.430	4.122	20	30		CIEDRN
C=C(C)[C@@H](NCc1ncc(C)s1)c1ccc(F)c(F)c1	ZINC000187784941	260057723	/nfs/dbraw/zinc/05/77/23/260057723.db2.gz	XMHMSOSDLNGNFQ-OAHLLOKOSA-N	0	0	294.370	4.137	20	30		CIEDRN
C[C@@H](Nc1ccc(C#N)nc1)c1cccc(Cl)c1Cl	ZINC000301534243	533552833	/nfs/dbraw/zinc/55/28/33/533552833.db2.gz	SXJPLNXGOXCRPY-SECBINFHSA-N	0	0	292.169	4.433	20	30		CIEDRN
N#Cc1ccnc(Oc2ccccc2OC(F)F)c1Cl	ZINC000342247505	130370834	/nfs/dbraw/zinc/37/08/34/130370834.db2.gz	UCBZDMPCHFYFOW-UHFFFAOYSA-N	0	0	296.660	4.000	20	30		CIEDRN
CC(C)C[C@H](C)CC(=O)N(Cc1ccc(C#N)cc1)C1CC1	ZINC000171408396	335064887	/nfs/dbraw/zinc/06/48/87/335064887.db2.gz	HOUJZQLADGCERW-HNNXBMFYSA-N	0	0	298.430	4.122	20	30		CIEDRN
CC[C@@H](CC(=O)N(Cc1ccc(C#N)cc1)C1CC1)C(C)C	ZINC000171427682	335065644	/nfs/dbraw/zinc/06/56/44/335065644.db2.gz	VKKAEKUYWLRAEN-KRWDZBQOSA-N	0	0	298.430	4.122	20	30		CIEDRN
C=CCN(C(=O)c1cccc(C(F)F)c1)c1ccccc1	ZINC000171531908	335069313	/nfs/dbraw/zinc/06/93/13/335069313.db2.gz	KDCIYMSQQUEXJF-UHFFFAOYSA-N	0	0	287.309	4.457	20	30		CIEDRN
Cc1ccc(C#N)c(N[C@H]2CCc3cc(Cl)ccc32)n1	ZINC000179763747	260068283	/nfs/dbraw/zinc/06/82/83/260068283.db2.gz	UCDJFUPWUGIMBP-HNNXBMFYSA-N	0	0	283.762	4.015	20	30		CIEDRN
COc1cc(C#N)cc(Cl)c1OCc1cccc(C)c1	ZINC000004827302	170024879	/nfs/dbraw/zinc/02/48/79/170024879.db2.gz	YSUJZEOQXWWGHM-UHFFFAOYSA-N	0	0	287.746	4.108	20	30		CIEDRN
N#Cc1cccc(COc2cccc3ccccc32)c1	ZINC000005111792	170067013	/nfs/dbraw/zinc/06/70/13/170067013.db2.gz	JYQJMXKZSSGIBG-UHFFFAOYSA-N	0	0	259.308	4.290	20	30		CIEDRN
CCCCCC(=O)Nc1sc(C)c(CC)c1C#N	ZINC000006040050	170170799	/nfs/dbraw/zinc/17/07/99/170170799.db2.gz	UDZZXBUEJIMIOL-UHFFFAOYSA-N	0	0	264.394	4.009	20	30		CIEDRN
N#Cc1ccc(COc2ccc3ccccc3c2)cc1	ZINC000006231766	170184248	/nfs/dbraw/zinc/18/42/48/170184248.db2.gz	DXSMDOOHDDDCEU-UHFFFAOYSA-N	0	0	259.308	4.290	20	30		CIEDRN
O=C(/C=C/c1ccccc1Br)c1ccccc1	ZINC000006338073	170193747	/nfs/dbraw/zinc/19/37/47/170193747.db2.gz	OLPPSDMJGDTGJV-ZHACJKMWSA-N	0	0	287.156	4.345	20	30		CIEDRN
CN(Cc1ccc2ccccc2c1)Cc1ccccc1C#N	ZINC000007500527	170287468	/nfs/dbraw/zinc/28/74/68/170287468.db2.gz	JFOVFQAQMQXWME-UHFFFAOYSA-N	0	0	286.378	4.343	20	30		CIEDRN
N#Cc1ccc(C(=O)Nc2ccc(Cl)cc2Cl)cc1	ZINC000015432214	170666189	/nfs/dbraw/zinc/66/61/89/170666189.db2.gz	JMUMPHKCQRLNKA-UHFFFAOYSA-N	0	0	291.137	4.117	20	30		CIEDRN
COc1ccc(Cl)cc1N[C@H](C)c1ccc(C#N)cc1	ZINC000019914119	170924449	/nfs/dbraw/zinc/92/44/49/170924449.db2.gz	JEJYSGSJZCAQHJ-LLVKDONJSA-N	0	0	286.762	4.393	20	30		CIEDRN
N#Cc1cccc(NCc2ccccc2C(F)(F)F)c1	ZINC000019921915	170929142	/nfs/dbraw/zinc/92/91/42/170929142.db2.gz	DBINIDOMSHYTMG-UHFFFAOYSA-N	0	0	276.261	4.189	20	30		CIEDRN
CSc1ccc([C@@H](C)Nc2ccc(C#N)cc2)cc1	ZINC000019951659	170939642	/nfs/dbraw/zinc/93/96/42/170939642.db2.gz	OGMAPEWGHXCWIV-GFCCVEGCSA-N	0	0	268.385	4.453	20	30		CIEDRN
CC(C)c1cccc(NCc2ccc(C#N)cc2)c1	ZINC000020136543	171023956	/nfs/dbraw/zinc/02/39/56/171023956.db2.gz	IDFCJLXLLWRAJL-UHFFFAOYSA-N	0	0	250.345	4.294	20	30		CIEDRN
N#Cc1ccc(F)c(CNc2cccc(Cl)c2F)c1	ZINC000020472542	171215486	/nfs/dbraw/zinc/21/54/86/171215486.db2.gz	VMZZZOSETQBTLZ-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
N#Cc1ccc(CNc2cccc(Cl)c2Cl)cc1	ZINC000020564578	171253563	/nfs/dbraw/zinc/25/35/63/171253563.db2.gz	NNOJKXTVGRMSMM-UHFFFAOYSA-N	0	0	277.154	4.477	20	30		CIEDRN
CC[C@@H](Nc1cccc(F)c1C#N)c1ccc(OC)cc1	ZINC000035135154	172002085	/nfs/dbraw/zinc/00/20/85/172002085.db2.gz	XCEBDIOWMWOBSF-MRXNPFEDSA-N	0	0	284.334	4.269	20	30		CIEDRN
CCOc1ccc([C@@H](C)Nc2cccc(F)c2C#N)cc1	ZINC000035149564	172011453	/nfs/dbraw/zinc/01/14/53/172011453.db2.gz	ZJBBWBLEJVOGRI-GFCCVEGCSA-N	0	0	284.334	4.269	20	30		CIEDRN
Cc1ccc(CNc2ccc(Cl)c(C#N)c2)cc1	ZINC000035224466	172068892	/nfs/dbraw/zinc/06/88/92/172068892.db2.gz	HYUYISORGMZITM-UHFFFAOYSA-N	0	0	256.736	4.132	20	30		CIEDRN
N#Cc1ccc(N[C@@H]2CCSc3c(F)cccc32)cc1	ZINC000035254989	172084145	/nfs/dbraw/zinc/08/41/45/172084145.db2.gz	YJHHOTWMWXXRHR-OAHLLOKOSA-N	0	0	284.359	4.346	20	30		CIEDRN
CN(Cc1cccs1)c1ccc(C#N)c(C(F)(F)F)c1	ZINC000035717596	172370958	/nfs/dbraw/zinc/37/09/58/172370958.db2.gz	UMTLTTUFBIUAAA-UHFFFAOYSA-N	0	0	296.317	4.275	20	30		CIEDRN
Cc1cc(C#N)ccc1OCc1ccccc1Cl	ZINC000036194516	172506123	/nfs/dbraw/zinc/50/61/23/172506123.db2.gz	BRILSXHAGSJCOJ-UHFFFAOYSA-N	0	0	257.720	4.099	20	30		CIEDRN
Cc1ccc(N[C@@H](C)c2cccc(C#N)c2)cc1C	ZINC000037202383	173026111	/nfs/dbraw/zinc/02/61/11/173026111.db2.gz	XPUGGVIXHSBYSP-AWEZNQCLSA-N	0	0	250.345	4.348	20	30		CIEDRN
C=CCn1c2ccccc2nc1SCc1c(C)noc1C	ZINC000043461711	175051912	/nfs/dbraw/zinc/05/19/12/175051912.db2.gz	LKDNXFROAZFWMJ-UHFFFAOYSA-N	0	0	299.399	4.119	20	30		CIEDRN
CC(C)c1cccc(NC(=O)NCc2cccc(C#N)c2)c1	ZINC000043551528	175064822	/nfs/dbraw/zinc/06/48/22/175064822.db2.gz	VTUSASFVRICBRI-UHFFFAOYSA-N	0	0	293.370	4.003	20	30		CIEDRN
O=C(/C=C/c1ccccc1)c1ccc(OC(F)F)cc1	ZINC000071793142	176264144	/nfs/dbraw/zinc/26/41/44/176264144.db2.gz	DTXDHMJKUBVRGG-IZZDOVSWSA-N	0	0	274.266	4.184	20	30		CIEDRN
CC(C)c1ccc(CN(c2ncccc2C#N)C2CC2)cc1	ZINC000071802169	176266148	/nfs/dbraw/zinc/26/61/48/176266148.db2.gz	MJNYQYWYWMDHBM-UHFFFAOYSA-N	0	0	291.398	4.246	20	30		CIEDRN
N#Cc1nccnc1Oc1ccc(C2CCCCC2)cc1	ZINC000072082111	176313210	/nfs/dbraw/zinc/31/32/10/176313210.db2.gz	VMVFXDOBVQZEJK-UHFFFAOYSA-N	0	0	279.343	4.188	20	30		CIEDRN
N#CC1(CSCc2cc(Cl)cc3cccnc32)CC1	ZINC000344469771	225068376	/nfs/dbraw/zinc/06/83/76/225068376.db2.gz	SNQGAAVPHSXGKN-UHFFFAOYSA-N	0	0	288.803	4.425	20	30		CIEDRN
N#Cc1ccc(CSCC[C@@H]2CCCO2)c(Cl)c1	ZINC000344857197	225181360	/nfs/dbraw/zinc/18/13/60/225181360.db2.gz	FTKYPRZPXNQRLD-ZDUSSCGKSA-N	0	0	281.808	4.014	20	30		CIEDRN
N#Cc1csc(C[NH2+][C@H]2CCc3sc(Cl)cc32)c1	ZINC000334755580	225309357	/nfs/dbraw/zinc/30/93/57/225309357.db2.gz	DWWWVEZFAFWDHT-NSHDSACASA-N	0	0	294.832	4.112	20	30		CIEDRN
C[C@]1(C(=O)N[C@@H]2CC[C@@H]3CCCC[C@H]3C2)CCC(=O)NC1	ZINC000329256088	227386655	/nfs/dbraw/zinc/38/66/55/227386655.db2.gz	DNADFTHDGZXTSD-ZJOBFFGXSA-N	0	0	292.423	4.058	20	30		CIEDRN
Cc1oc(C#N)cc1-c1nc([C@@H]2CCCC(C)(C)C2)no1	ZINC000347264061	226104665	/nfs/dbraw/zinc/10/46/65/226104665.db2.gz	NFRTYYSOCLJNSZ-LLVKDONJSA-N	0	0	285.347	4.194	20	30		CIEDRN
N#Cc1cnccc1/C=C/c1ccccc1C(F)(F)F	ZINC000347453526	226161133	/nfs/dbraw/zinc/16/11/33/226161133.db2.gz	VEYQFYIQZIUWQO-AATRIKPKSA-N	0	0	274.245	4.142	20	30		CIEDRN
N#Cc1c(Cl)cccc1SCC1CCC(=O)CC1	ZINC000347912614	226385676	/nfs/dbraw/zinc/38/56/76/226385676.db2.gz	DGQCUQWSJZUJGP-UHFFFAOYSA-N	0	0	279.792	4.063	20	30		CIEDRN
N#CCC1CCN(C(=O)c2ccc(C3=CCCC3)cc2)CC1	ZINC000335322494	226428441	/nfs/dbraw/zinc/42/84/41/226428441.db2.gz	QJSMVCBJFBBOAL-UHFFFAOYSA-N	0	0	294.398	4.020	20	30		CIEDRN
CCCOc1ccccc1NCc1ccc(C#N)cc1F	ZINC000171754979	335077780	/nfs/dbraw/zinc/07/77/80/335077780.db2.gz	UPSRXIPCISRBPU-UHFFFAOYSA-N	0	0	284.334	4.098	20	30		CIEDRN
Cc1c(COC(C)(C)C)cccc1N[C@@H]1CC[C@H](C#N)C1	ZINC000442864796	226661802	/nfs/dbraw/zinc/66/18/02/226661802.db2.gz	GXPJLYPSUCNGTJ-GOEBONIOSA-N	0	0	286.419	4.414	20	30		CIEDRN
Cc1c(C#N)cccc1NCc1cnc(C(C)C)s1	ZINC000354764456	227093129	/nfs/dbraw/zinc/09/31/29/227093129.db2.gz	MYAQVHSBIHOSDN-UHFFFAOYSA-N	0	0	271.389	4.059	20	30		CIEDRN
Cc1c(C#N)cccc1NCc1cnc(C2CCC2)s1	ZINC000354794640	227114080	/nfs/dbraw/zinc/11/40/80/227114080.db2.gz	PXTXDPSWCNXNJT-UHFFFAOYSA-N	0	0	283.400	4.203	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)[C@@H](C)C(C)C	ZINC000171912217	335084504	/nfs/dbraw/zinc/08/45/04/335084504.db2.gz	FVNQWLYIXYRRCW-NSHDSACASA-N	0	0	285.840	4.208	20	30		CIEDRN
C[C@H](C(=O)NCCCC1CCCCC1)c1cccc(C#N)c1	ZINC000461903940	227130969	/nfs/dbraw/zinc/13/09/69/227130969.db2.gz	WDJYMVAJHLTYLM-HNNXBMFYSA-N	0	0	298.430	4.138	20	30		CIEDRN
N#Cc1csc(CNc2cccc(-c3cccs3)c2)n1	ZINC000352810417	227247387	/nfs/dbraw/zinc/24/73/87/227247387.db2.gz	NIKQTGMFTJUZGW-UHFFFAOYSA-N	0	0	297.408	4.355	20	30		CIEDRN
Cc1nc(CCNC(=O)CC2CCCCCC2)c(C)o1	ZINC000329026799	227263512	/nfs/dbraw/zinc/26/35/12/227263512.db2.gz	OFKMHRGZWCNJCW-UHFFFAOYSA-N	0	0	278.396	4.151	20	30		CIEDRN
Cc1noc([C@H](C)NC(=O)[C@@H]2CCC[C@@H]3CCCC[C@H]23)n1	ZINC000329075218	227283038	/nfs/dbraw/zinc/28/30/38/227283038.db2.gz	PNLLWZYBYVKURB-DOERSZECSA-N	0	0	291.395	4.002	20	30		CIEDRN
O=C(CCc1nc2ccccc2o1)N[C@@H]1CC12CCCCC2	ZINC000329096128	227293422	/nfs/dbraw/zinc/29/34/22/227293422.db2.gz	BPFILCPLNDGRGY-OAHLLOKOSA-N	0	0	298.386	4.440	20	30		CIEDRN
N#Cc1ccc(Cl)c(C(=O)Nc2ccc3ccoc3c2)c1	ZINC000354994539	227295193	/nfs/dbraw/zinc/29/51/93/227295193.db2.gz	BRONEOFNHWMCCM-UHFFFAOYSA-N	0	0	296.713	4.210	20	30		CIEDRN
N#C[C@@H]1CCC[C@@H]1NC(=O)[C@@H]1CCC[C@@H]2CCCC[C@@H]12	ZINC000329160024	227333581	/nfs/dbraw/zinc/33/35/81/227333581.db2.gz	FAXATVHJNCZDLH-RBZJEDDUSA-N	0	0	274.408	4.242	20	30		CIEDRN
O=C(N[C@H]1CCCCC12CCCC2)c1ncoc1C1CC1	ZINC000329170562	227336206	/nfs/dbraw/zinc/33/62/06/227336206.db2.gz	KAXJILGUDWUNGI-ZDUSSCGKSA-N	0	0	288.391	4.360	20	30		CIEDRN
N#Cc1csc(/C=C/c2ncc(Br)s2)c1	ZINC000193050919	227477574	/nfs/dbraw/zinc/47/75/74/227477574.db2.gz	XBKPJMZLTGZXPJ-OWOJBTEDSA-N	0	0	297.202	4.009	20	30		CIEDRN
Cc1ccc(Cl)c(Oc2ccc(Cl)c(C#N)n2)c1	ZINC000301549331	227581748	/nfs/dbraw/zinc/58/17/48/227581748.db2.gz	QKOZHRALUCNHPE-UHFFFAOYSA-N	0	0	279.126	4.361	20	30		CIEDRN
N#Cc1ccc2nc(NCCC3=CCCC3)ccc2c1	ZINC000301953972	227740737	/nfs/dbraw/zinc/74/07/37/227740737.db2.gz	IQXXKVMBBMDIOZ-UHFFFAOYSA-N	0	0	263.344	4.019	20	30		CIEDRN
Cc1cc(CNc2snc(Cl)c2C#N)ccc1Cl	ZINC000302147886	227805150	/nfs/dbraw/zinc/80/51/50/227805150.db2.gz	SBMDJOIPXHMDCR-UHFFFAOYSA-N	0	0	298.198	4.242	20	30		CIEDRN
Cc1ccc(N2CCC[C@@H]2c2ccc(Cl)cc2)nc1C#N	ZINC000302626181	227871214	/nfs/dbraw/zinc/87/12/14/227871214.db2.gz	ICNUIMLSNZWPFX-MRXNPFEDSA-N	0	0	297.789	4.257	20	30		CIEDRN
Cc1noc(C(C)C)c1C(=O)NC1CCC2(CC2)CC1	ZINC000329965661	228000334	/nfs/dbraw/zinc/00/03/34/228000334.db2.gz	UMXIXKXHEIHLMV-UHFFFAOYSA-N	0	0	276.380	4.134	20	30		CIEDRN
Cc1noc(C)c1[C@@H](C)CC(=O)NC1CCC2(CC2)CC1	ZINC000329967194	228000883	/nfs/dbraw/zinc/00/08/83/228000883.db2.gz	VIGCFWVFQCEHKM-NSHDSACASA-N	0	0	290.407	4.464	20	30		CIEDRN
O=C(NCc1ncc[nH]1)C1(C2CCCCC2)CCCCC1	ZINC000329976303	228003763	/nfs/dbraw/zinc/00/37/63/228003763.db2.gz	FHFVFQQCFUSZRC-UHFFFAOYSA-N	0	0	289.423	4.397	20	30		CIEDRN
O=C(Nc1cccc(-c2cc[nH]n2)c1)[C@H]1CC12CCCC2	ZINC000329994427	228010414	/nfs/dbraw/zinc/01/04/14/228010414.db2.gz	MEBHMGOTMMPLIM-CQSZACIVSA-N	0	0	281.359	4.245	20	30		CIEDRN
O=C(NC1CCC(C(=O)NC2CCCCC2)CC1)C1CC1	ZINC000329999926	228012907	/nfs/dbraw/zinc/01/29/07/228012907.db2.gz	VPGKVTFUGRXDPL-UHFFFAOYSA-N	0	0	292.423	4.201	20	30		CIEDRN
Cc1ccc([C@H](C)Nc2ccc(F)cc2C#N)s1	ZINC000113317481	228042165	/nfs/dbraw/zinc/04/21/65/228042165.db2.gz	DSKRJHLNQODVMR-JTQLQIEISA-N	0	0	260.337	4.240	20	30		CIEDRN
Cc1ccc(NC(=O)C[C@H]2C=CCCC2)c2n[nH]cc21	ZINC000330205751	228065376	/nfs/dbraw/zinc/06/53/76/228065376.db2.gz	CQVYDOKDQOGPAB-LBPRGKRZSA-N	0	0	269.348	4.206	20	30		CIEDRN
C[C@@H]1CC=CC[C@H]1C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000352174714	228191744	/nfs/dbraw/zinc/19/17/44/228191744.db2.gz	PDGYFUAIFGKLHR-NXHRZFHOSA-N	0	0	296.414	4.140	20	30		CIEDRN
N#Cc1cc(Cl)cc(OCc2csc(C3CC3)n2)c1	ZINC000352192326	228195014	/nfs/dbraw/zinc/19/50/14/228195014.db2.gz	LPCMGIMKYTUFLU-UHFFFAOYSA-N	0	0	290.775	4.125	20	30		CIEDRN
Cc1ccc(Cl)c(NC(=O)c2cccc(CC#N)c2)c1C	ZINC000336142798	228196722	/nfs/dbraw/zinc/19/67/22/228196722.db2.gz	PFMOHRVBTYYYDH-UHFFFAOYSA-N	0	0	298.773	4.275	20	30		CIEDRN
Cc1ccsc1C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000352206169	228198876	/nfs/dbraw/zinc/19/88/76/228198876.db2.gz	KWEOSCQCKUOPGX-HNNXBMFYSA-N	0	0	298.411	4.222	20	30		CIEDRN
Cc1ccsc1C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000352206170	228198887	/nfs/dbraw/zinc/19/88/87/228198887.db2.gz	KWEOSCQCKUOPGX-OAHLLOKOSA-N	0	0	298.411	4.222	20	30		CIEDRN
Cc1cc(C)c(C(=O)N[C@H](CCCC#N)c2ccccc2)o1	ZINC000352226369	228201521	/nfs/dbraw/zinc/20/15/21/228201521.db2.gz	SARCDLFIHJZSNE-MRXNPFEDSA-N	0	0	296.370	4.061	20	30		CIEDRN
N#Cc1cnc2c(F)cc(F)cc2c1NC[C@H]1CC=CCC1	ZINC000352315054	228219637	/nfs/dbraw/zinc/21/96/37/228219637.db2.gz	MVCYZZXCTUFFEC-NSHDSACASA-N	0	0	299.324	4.153	20	30		CIEDRN
C=C(C)CN(C)C(=O)[C@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1	ZINC000180388222	260099937	/nfs/dbraw/zinc/09/99/37/260099937.db2.gz	IRWKHBVZTFDARB-KGLIPLIRSA-N	0	0	298.213	4.131	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(CC(F)(F)F)cc1	ZINC000185658772	260003805	/nfs/dbraw/zinc/00/38/05/260003805.db2.gz	ISOYTYNCNKPWHO-LLVKDONJSA-N	0	0	285.309	4.332	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000187703313	260052210	/nfs/dbraw/zinc/05/22/10/260052210.db2.gz	LHPJFZUFQYTRFK-GXTWGEPZSA-N	0	0	299.336	4.051	20	30		CIEDRN
CC(C)CC(C)(C)C(=O)N[C@H](C#N)c1ccccc1Cl	ZINC000179553136	260054713	/nfs/dbraw/zinc/05/47/13/260054713.db2.gz	QSBDZDGLIVZRET-CQSZACIVSA-N	0	0	292.810	4.093	20	30		CIEDRN
Cc1nc2cc(N[C@H](C)c3cccc(C#N)c3)ccc2o1	ZINC000037232800	260076267	/nfs/dbraw/zinc/07/62/67/260076267.db2.gz	LDKBCIYLEBFASK-LLVKDONJSA-N	0	0	277.327	4.181	20	30		CIEDRN
CC(C)Oc1ccc(CNc2ccc(CC#N)cc2)cc1	ZINC000037301818	260081879	/nfs/dbraw/zinc/08/18/79/260081879.db2.gz	COAYDFZVBFWNIU-UHFFFAOYSA-N	0	0	280.371	4.152	20	30		CIEDRN
CC(C)(C)C[C@H](NCc1ccc(C#N)s1)C(F)(F)F	ZINC000180365927	260098960	/nfs/dbraw/zinc/09/89/60/260098960.db2.gz	ZTWHLUDQTGGBQW-NSHDSACASA-N	0	0	290.354	4.076	20	30		CIEDRN
CC(C)(C)C[C@@H](NCc1ccc(C#N)s1)C(F)(F)F	ZINC000180365942	260099452	/nfs/dbraw/zinc/09/94/52/260099452.db2.gz	ZTWHLUDQTGGBQW-LLVKDONJSA-N	0	0	290.354	4.076	20	30		CIEDRN
CC(C)(C)C[C@H](NCc1cccc(C#N)c1)C(F)(F)F	ZINC000180366176	260099570	/nfs/dbraw/zinc/09/95/70/260099570.db2.gz	NRBDUPUYJZZDTP-ZDUSSCGKSA-N	0	0	284.325	4.015	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1ccc(Cl)c(C(F)(F)F)c1	ZINC000180388474	260100134	/nfs/dbraw/zinc/10/01/34/260100134.db2.gz	IVONNPMKYNQKRM-UHFFFAOYSA-N	0	0	291.700	4.007	20	30		CIEDRN
C=C(C)CN(C)C(=O)[C@H](CC)c1cccc(C(F)(F)F)c1	ZINC000180449001	260102324	/nfs/dbraw/zinc/10/23/24/260102324.db2.gz	HLEBMIBMPWEYMG-CQSZACIVSA-N	0	0	299.336	4.234	20	30		CIEDRN
C=CCCCSCC(=O)Nc1c(C)cccc1CC	ZINC000117944779	260118086	/nfs/dbraw/zinc/11/80/86/260118086.db2.gz	PXHIUBZTMBUSAK-UHFFFAOYSA-N	0	0	277.433	4.195	20	30		CIEDRN
N#CCOc1cccc(N[C@H]2CCC[C@H](C(F)(F)F)C2)c1	ZINC000069380270	260150138	/nfs/dbraw/zinc/15/01/38/260150138.db2.gz	HCPSACWXAIIBRL-RYUDHWBXSA-N	0	0	298.308	4.122	20	30		CIEDRN
C=CC(C)(C)C(=O)Nc1cc(C(=O)CC)ccc1Cl	ZINC000298817728	260162505	/nfs/dbraw/zinc/16/25/05/260162505.db2.gz	YGFBOJUPPQPQCL-UHFFFAOYSA-N	0	0	279.767	4.083	20	30		CIEDRN
Cc1cccc(NC(=O)C2(C#N)CCCCC2)c1Cl	ZINC000073345752	260165233	/nfs/dbraw/zinc/16/52/33/260165233.db2.gz	YBZGNFZKJVXJTA-UHFFFAOYSA-N	0	0	276.767	4.061	20	30		CIEDRN
C[C@@H](Nc1cc(C(F)(F)F)ccn1)c1ccc(C#N)cc1	ZINC000078592019	260168261	/nfs/dbraw/zinc/16/82/61/260168261.db2.gz	RSBSHAJZMIWQKT-SNVBAGLBSA-N	0	0	291.276	4.145	20	30		CIEDRN
N#Cc1cccc(Sc2ccc3ccccc3c2)n1	ZINC000081622409	260184520	/nfs/dbraw/zinc/18/45/20/260184520.db2.gz	QUPKXDITIIBDKS-UHFFFAOYSA-N	0	0	262.337	4.258	20	30		CIEDRN
N#Cc1ccc(C[S@](=O)c2ccc3ccccc3c2)cc1	ZINC000084265092	260190925	/nfs/dbraw/zinc/19/09/25/260190925.db2.gz	NSGIBISRBPKNMD-OAQYLSRUSA-N	0	0	291.375	4.019	20	30		CIEDRN
Cc1ccc(Br)cc1NCCCC(C)(C)C#N	ZINC000087597384	260191791	/nfs/dbraw/zinc/19/17/91/260191791.db2.gz	CQAMXPXBQQWQCA-UHFFFAOYSA-N	0	0	295.224	4.499	20	30		CIEDRN
C[C@@H]1CCc2ccccc2N1CCCC(C)(C)C#N	ZINC000087608406	260192395	/nfs/dbraw/zinc/19/23/95/260192395.db2.gz	LBDRLTZYGZWQNO-CQSZACIVSA-N	0	0	256.393	4.158	20	30		CIEDRN
C=CCCC(=O)CSc1cccc(Br)c1	ZINC000085219443	260201849	/nfs/dbraw/zinc/20/18/49/260201849.db2.gz	QTXCFQZCEUHAAT-UHFFFAOYSA-N	0	0	285.206	4.077	20	30		CIEDRN
Cc1ccc(OCCCCC(C)(C)C#N)cc1[N+](=O)[O-]	ZINC000312787562	260202902	/nfs/dbraw/zinc/20/29/02/260202902.db2.gz	OWBCKDFAXDRJAK-UHFFFAOYSA-N	0	0	276.336	4.002	20	30		CIEDRN
N#Cc1cccc(NCc2cc(Cl)ccc2Cl)c1	ZINC000087758552	260225401	/nfs/dbraw/zinc/22/54/01/260225401.db2.gz	PLXOWQKNILTXFF-UHFFFAOYSA-N	0	0	277.154	4.477	20	30		CIEDRN
N#Cc1cc(C(F)(F)F)ccc1N[C@@H]1CC=CCC1	ZINC000088748715	260234508	/nfs/dbraw/zinc/23/45/08/260234508.db2.gz	QBERCKMFVJKPAE-GFCCVEGCSA-N	0	0	266.266	4.098	20	30		CIEDRN
Cc1ccc(Oc2nc(C)c(C#N)cc2Cl)cc1C	ZINC000311557408	260253311	/nfs/dbraw/zinc/25/33/11/260253311.db2.gz	JYQSHSRNDHOMMA-UHFFFAOYSA-N	0	0	272.735	4.324	20	30		CIEDRN
Cc1nc(NCc2ccccc2Cl)c(Cl)cc1C#N	ZINC000311556837	260253356	/nfs/dbraw/zinc/25/33/56/260253356.db2.gz	JWBFYPCBAWKRMA-UHFFFAOYSA-N	0	0	292.169	4.181	20	30		CIEDRN
N#CCSCCCSc1nc2cc(Cl)ccc2o1	ZINC000075075502	260289633	/nfs/dbraw/zinc/28/96/33/260289633.db2.gz	GYGFRQXMBFDFCG-UHFFFAOYSA-N	0	0	298.820	4.220	20	30		CIEDRN
N#Cc1ccc(N2CCC3(CCCCC3)CC2)cc1[N+](=O)[O-]	ZINC000317641790	260297207	/nfs/dbraw/zinc/29/72/07/260297207.db2.gz	XWMNKGDPEPONEI-UHFFFAOYSA-N	0	0	299.374	4.017	20	30		CIEDRN
COc1ccc(CC[C@@H](C)Nc2cccc(CC#N)c2)cc1	ZINC000313477061	260297738	/nfs/dbraw/zinc/29/77/38/260297738.db2.gz	KRHKWCABSYCBPW-OAHLLOKOSA-N	0	0	294.398	4.194	20	30		CIEDRN
CC(C)(CCC#N)CNc1cccc(COCC2CC2)c1	ZINC000080197282	260312705	/nfs/dbraw/zinc/31/27/05/260312705.db2.gz	VRJUEPMGMVWMEM-UHFFFAOYSA-N	0	0	286.419	4.355	20	30		CIEDRN
CC(=O)c1ccc(C#N)cc1N1CCC(C(C)(C)C)CC1	ZINC000131280768	260401928	/nfs/dbraw/zinc/40/19/28/260401928.db2.gz	MRXNTSNLKLETKV-UHFFFAOYSA-N	0	0	284.403	4.023	20	30		CIEDRN
N#Cc1cc(NCc2cccc(C(F)F)c2)ccc1F	ZINC000131840028	260418039	/nfs/dbraw/zinc/41/80/39/260418039.db2.gz	LHABTSQJTDVVQZ-UHFFFAOYSA-N	0	0	276.261	4.247	20	30		CIEDRN
CC(C)COCCSCc1ccc(Cl)cc1C#N	ZINC000409880092	260434774	/nfs/dbraw/zinc/43/47/74/260434774.db2.gz	SWDNNFMHQCZFSI-UHFFFAOYSA-N	0	0	283.824	4.117	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@H](C)Oc1cccc2ccccc21	ZINC000410125123	260462843	/nfs/dbraw/zinc/46/28/43/260462843.db2.gz	YWACYUNCWRLALU-HOCLYGCPSA-N	0	0	297.398	4.078	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1ccc(-c2ccccc2)o1	ZINC000410124146	260462849	/nfs/dbraw/zinc/46/28/49/260462849.db2.gz	SFBOLAFEIHFJPC-CQSZACIVSA-N	0	0	269.344	4.031	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1oc2ccc(Cl)cc2c1C	ZINC000410134274	260464412	/nfs/dbraw/zinc/46/44/12/260464412.db2.gz	MCZISASENZZOCS-GFCCVEGCSA-N	0	0	291.778	4.479	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1cc(SC)ccc1Cl	ZINC000410132543	260464595	/nfs/dbraw/zinc/46/45/95/260464595.db2.gz	WZRJLPQFHDPJIL-SNVBAGLBSA-N	0	0	283.824	4.146	20	30		CIEDRN
N#Cc1ccnc(Sc2ccc(F)c(F)c2)c1Cl	ZINC000236161654	260472028	/nfs/dbraw/zinc/47/20/28/260472028.db2.gz	XUJRRYBXDRBOIO-UHFFFAOYSA-N	0	0	282.702	4.036	20	30		CIEDRN
Cc1csc(-c2cccc(OCCC(C)(C)C#N)c2)n1	ZINC000410298454	260481047	/nfs/dbraw/zinc/48/10/47/260481047.db2.gz	GJDQXHGCBAJMRU-UHFFFAOYSA-N	0	0	286.400	4.437	20	30		CIEDRN
COc1cc(Cl)c(C)cc1NCC(C)(C)CCC#N	ZINC000092128411	260485058	/nfs/dbraw/zinc/48/50/58/260485058.db2.gz	JAGYCHKESHRTAG-UHFFFAOYSA-N	0	0	280.799	4.399	20	30		CIEDRN
CCOc1ccc(OCC)c(NCC(C)(C)CCC#N)c1	ZINC000092143543	260485126	/nfs/dbraw/zinc/48/51/26/260485126.db2.gz	UZYPNTXQYWXEMT-UHFFFAOYSA-N	0	0	290.407	4.226	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)[C@H](C)OCCC(C)C	ZINC000410375174	260492408	/nfs/dbraw/zinc/49/24/08/260492408.db2.gz	ZSCZTEIQQZMRBQ-HNNXBMFYSA-N	0	0	289.419	4.195	20	30		CIEDRN
C=CCC[C@H](CC)Nc1cccc2c1OCC[C@@H]2OC	ZINC000448023139	260576795	/nfs/dbraw/zinc/57/67/95/260576795.db2.gz	RVRQUGCLXRSYRL-BBRMVZONSA-N	0	0	275.392	4.313	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc(F)cc1OC(F)F	ZINC000150944409	260588219	/nfs/dbraw/zinc/58/82/19/260588219.db2.gz	FGMYRBJHGZBBHT-UHFFFAOYSA-N	0	0	299.292	4.134	20	30		CIEDRN
C=CCSCCNc1ncc(C(F)(F)F)cc1Cl	ZINC000223895427	260672698	/nfs/dbraw/zinc/67/26/98/260672698.db2.gz	AJOBKLPKWVVONZ-UHFFFAOYSA-N	0	0	296.745	4.085	20	30		CIEDRN
CC(C)(C)Sc1ccc(NC(=O)C2(C#N)CCC2)cc1	ZINC000119918969	260698406	/nfs/dbraw/zinc/69/84/06/260698406.db2.gz	FENWKQQWZOHKSN-UHFFFAOYSA-N	0	0	288.416	4.210	20	30		CIEDRN
Cc1ccc(-c2nnc(SCCCCC#N)o2)c(C)c1	ZINC000122598026	260720976	/nfs/dbraw/zinc/72/09/76/260720976.db2.gz	QACVZOLRJJTLQN-UHFFFAOYSA-N	0	0	287.388	4.139	20	30		CIEDRN
CCN(CC#N)Cc1c(Cl)cccc1SC(C)C	ZINC000428472004	260752514	/nfs/dbraw/zinc/75/25/14/260752514.db2.gz	DMYDETJWUJORDK-UHFFFAOYSA-N	0	0	282.840	4.186	20	30		CIEDRN
CC(C)c1ccc(NCc2cccc(F)c2C#N)cc1	ZINC000427526557	260758342	/nfs/dbraw/zinc/75/83/42/260758342.db2.gz	DGFPUHOKQVLZIC-UHFFFAOYSA-N	0	0	268.335	4.433	20	30		CIEDRN
CC[C@H](C#N)Sc1nnc(-c2c(C)cc(C)cc2C)o1	ZINC000127705490	260804525	/nfs/dbraw/zinc/80/45/25/260804525.db2.gz	CMMSIBICYTZXFA-GFCCVEGCSA-N	0	0	287.388	4.056	20	30		CIEDRN
N#CCCCOc1cccc(CNc2ccccc2F)c1	ZINC000157510432	260846304	/nfs/dbraw/zinc/84/63/04/260846304.db2.gz	OTNUYCQCHNKVDM-UHFFFAOYSA-N	0	0	284.334	4.120	20	30		CIEDRN
Cc1sc(NC(=O)C2CCC(C)(C)CC2)c(C#N)c1C	ZINC000428374848	260878370	/nfs/dbraw/zinc/87/83/70/260878370.db2.gz	REVRGEYOYXECMD-UHFFFAOYSA-N	0	0	290.432	4.392	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1	ZINC000489881926	260936316	/nfs/dbraw/zinc/93/63/16/260936316.db2.gz	HVCSNCOYDRDBQC-LSDHHAIUSA-N	0	0	291.822	4.162	20	30		CIEDRN
CC(C)Oc1ccc(CCNc2ccc(F)cc2C#N)cc1	ZINC000525707428	260977508	/nfs/dbraw/zinc/97/75/08/260977508.db2.gz	BPSQOXZKFGEJJL-UHFFFAOYSA-N	0	0	298.361	4.139	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@@H](C)c1oc2ccccc2c1C	ZINC000448732223	261065313	/nfs/dbraw/zinc/06/53/13/261065313.db2.gz	BYWOOKCUEJFBSK-LBPRGKRZSA-N	0	0	271.360	4.131	20	30		CIEDRN
C[C@@H](C#N)CSc1ccccc1NCC1CCC1	ZINC000152722778	261068751	/nfs/dbraw/zinc/06/87/51/261068751.db2.gz	WOLZLTUSDWTWIF-LBPRGKRZSA-N	0	0	260.406	4.150	20	30		CIEDRN
C[C@H](Nc1ccn(CCC#N)n1)c1ccc(C(C)(C)C)cc1	ZINC000152769869	261069002	/nfs/dbraw/zinc/06/90/02/261069002.db2.gz	YGLISLLGGLICEH-AWEZNQCLSA-N	0	0	296.418	4.267	20	30		CIEDRN
CCCOc1cccc(NCCCC(C)(C)C#N)c1	ZINC000153149977	261074113	/nfs/dbraw/zinc/07/41/13/261074113.db2.gz	HEYLOSWDVUXEJZ-UHFFFAOYSA-N	0	0	260.381	4.217	20	30		CIEDRN
C[C@H](C(=O)N[C@H](CCC#N)c1ccccc1)c1cccs1	ZINC000153576261	261080264	/nfs/dbraw/zinc/08/02/64/261080264.db2.gz	KTZATSDPTFWIAK-DZGCQCFKSA-N	0	0	298.411	4.013	20	30		CIEDRN
N#CCC[C@H](NC(=O)C1CCCCCC1)c1ccccc1	ZINC000153689477	261081568	/nfs/dbraw/zinc/08/15/68/261081568.db2.gz	PJTCZZKZSZGKHI-KRWDZBQOSA-N	0	0	284.403	4.118	20	30		CIEDRN
C[C@@H](N[C@H](C)c1cccnc1Cl)c1ccc(C#N)cc1	ZINC000154325990	261090377	/nfs/dbraw/zinc/09/03/77/261090377.db2.gz	CXUYRMGTVWSINU-VXGBXAGGSA-N	0	0	285.778	4.018	20	30		CIEDRN
CCCc1nc(COc2cc(Cl)ccc2C#N)cs1	ZINC000161650235	261108290	/nfs/dbraw/zinc/10/82/90/261108290.db2.gz	BXLZQVQHEASTKD-UHFFFAOYSA-N	0	0	292.791	4.200	20	30		CIEDRN
N#CCCCCSCc1nc(C(F)(F)F)cs1	ZINC000155886049	261109272	/nfs/dbraw/zinc/10/92/72/261109272.db2.gz	VQRJENMZSDBPAW-UHFFFAOYSA-N	0	0	280.340	4.089	20	30		CIEDRN
CC(C)CCN(CCC#N)Cc1ncc(C(C)(C)C)s1	ZINC000448335227	261116905	/nfs/dbraw/zinc/11/69/05/261116905.db2.gz	PNASNFDAVHSFTP-UHFFFAOYSA-N	0	0	293.480	4.202	20	30		CIEDRN
CC[C@H](CC#N)NC(=O)Nc1ccccc1SC(C)C	ZINC000156207537	261116942	/nfs/dbraw/zinc/11/69/42/261116942.db2.gz	PDACBAZCGUFYEZ-GFCCVEGCSA-N	0	0	291.420	4.001	20	30		CIEDRN
CCCOc1ccccc1NC1CCC(C)(C#N)CC1	ZINC000449039028	261119816	/nfs/dbraw/zinc/11/98/16/261119816.db2.gz	AKSKEYPYPHLKCO-UHFFFAOYSA-N	0	0	272.392	4.360	20	30		CIEDRN
N#Cc1ccc(Oc2ccc(F)cc2[N+](=O)[O-])c(Cl)c1	ZINC000052719487	261123271	/nfs/dbraw/zinc/12/32/71/261123271.db2.gz	YRPRSTCZXWUZMC-UHFFFAOYSA-N	0	0	292.653	4.051	20	30		CIEDRN
C[C@@H](Nc1ccc(Cl)cc1C#N)c1ccc(C#N)cc1	ZINC000052857247	261148767	/nfs/dbraw/zinc/14/87/67/261148767.db2.gz	QDAPIVVZDRLIHR-LLVKDONJSA-N	0	0	281.746	4.256	20	30		CIEDRN
N#Cc1ccccc1SCc1cn2cc(Cl)ccc2n1	ZINC000173712539	261168606	/nfs/dbraw/zinc/16/86/06/261168606.db2.gz	GIMIFOCRIHSRGO-UHFFFAOYSA-N	0	0	299.786	4.152	20	30		CIEDRN
C[C@@H](Sc1ccccc1C#N)c1ccc(C#N)cc1	ZINC000173709386	261168947	/nfs/dbraw/zinc/16/89/47/261168947.db2.gz	OGHNYDXBBFTJCD-GFCCVEGCSA-N	0	0	264.353	4.283	20	30		CIEDRN
C[C@@H](C(=O)Nc1ccc(C#N)cc1)c1ccc(Cl)s1	ZINC000175124188	261210016	/nfs/dbraw/zinc/21/00/16/261210016.db2.gz	YRNXTFILGRMOBK-SECBINFHSA-N	0	0	290.775	4.015	20	30		CIEDRN
CC(C)(C#N)CCC[S@](=O)[C@@H]1CCCc2ccccc21	ZINC000161205628	261240240	/nfs/dbraw/zinc/24/02/40/261240240.db2.gz	ZHVMOZGFISSBSU-OXQOHEQNSA-N	0	0	289.444	4.143	20	30		CIEDRN
CCCCc1nc(CSCCCCC#N)cs1	ZINC000161613531	261253674	/nfs/dbraw/zinc/25/36/74/261253674.db2.gz	KRGBFHKKDZUACL-UHFFFAOYSA-N	0	0	268.451	4.413	20	30		CIEDRN
C=CCCC1(C(=O)N(CC=C)Cc2cccs2)CC1	ZINC000361481358	261289320	/nfs/dbraw/zinc/28/93/20/261289320.db2.gz	LZCLYGPIDHTARU-UHFFFAOYSA-N	0	0	275.417	4.009	20	30		CIEDRN
Cc1cc([C@H](C)Nc2nc3c(cc2C#N)CCCC3)c(C)o1	ZINC000301127441	261330425	/nfs/dbraw/zinc/33/04/25/261330425.db2.gz	QWSUVBKZRYQHOO-LBPRGKRZSA-N	0	0	295.386	4.215	20	30		CIEDRN
CC(C)(C)SCCNc1ccc(Cl)cc1C#N	ZINC000301204548	261331749	/nfs/dbraw/zinc/33/17/49/261331749.db2.gz	QWHFSYLDMYLWBS-UHFFFAOYSA-N	0	0	268.813	4.155	20	30		CIEDRN
CCCCc1noc([C@H](C)Sc2cccc(C#N)c2)n1	ZINC000177098995	261332723	/nfs/dbraw/zinc/33/27/23/261332723.db2.gz	XGIKTFYDFOEKAX-NSHDSACASA-N	0	0	287.388	4.137	20	30		CIEDRN
C[C@H](Nc1c(F)cc(C#N)cc1F)c1ccccc1	ZINC000107296020	261377523	/nfs/dbraw/zinc/37/75/23/261377523.db2.gz	KCBSWOVOKVARHO-JTQLQIEISA-N	0	0	258.271	4.010	20	30		CIEDRN
C[C@@H](Nc1c(F)cc(C#N)cc1F)c1ccccc1	ZINC000107296112	261377577	/nfs/dbraw/zinc/37/75/77/261377577.db2.gz	KCBSWOVOKVARHO-SNVBAGLBSA-N	0	0	258.271	4.010	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)CCc1ccccc1Cl	ZINC000178371164	261388154	/nfs/dbraw/zinc/38/81/54/261388154.db2.gz	GILYSBRAVNEIFK-UHFFFAOYSA-N	0	0	298.773	4.091	20	30		CIEDRN
Cc1ccc(CCCC(=O)Nc2cccc(C#N)c2C)s1	ZINC000178379706	261388938	/nfs/dbraw/zinc/38/89/38/261388938.db2.gz	AWHPNEGDFZPCAA-UHFFFAOYSA-N	0	0	298.411	4.198	20	30		CIEDRN
C=CCC[C@H](NC(=O)N(C(C)C)C1CC1)c1ccccc1	ZINC000178452589	261392459	/nfs/dbraw/zinc/39/24/59/261392459.db2.gz	UXPKSEPGKLYUDS-KRWDZBQOSA-N	0	0	286.419	4.276	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)N(C)[C@@H](C)c1ccccc1	ZINC000178539565	261396491	/nfs/dbraw/zinc/39/64/91/261396491.db2.gz	BPOUOTDNEHWESM-AWEZNQCLSA-N	0	0	293.370	4.092	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)N(C)[C@H](C)c1ccccc1	ZINC000178539579	261396758	/nfs/dbraw/zinc/39/67/58/261396758.db2.gz	BPOUOTDNEHWESM-CQSZACIVSA-N	0	0	293.370	4.092	20	30		CIEDRN
C#C[C@@H](NCc1ccc(C(F)F)cc1)c1ccc(F)cc1	ZINC000491276711	261397805	/nfs/dbraw/zinc/39/78/05/261397805.db2.gz	KZUXUKFTEPWBQP-MRXNPFEDSA-N	0	0	289.300	4.227	20	30		CIEDRN
CC[C@H]1CCCCCN1C(=O)Nc1cccc(C#N)c1C	ZINC000178586902	261399293	/nfs/dbraw/zinc/39/92/93/261399293.db2.gz	GDMKTSSAFBQWTL-HNNXBMFYSA-N	0	0	285.391	4.053	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N1C[C@@H](C(C)C)c2ccccc21	ZINC000466395891	261401129	/nfs/dbraw/zinc/40/11/29/261401129.db2.gz	LXFXEXGQXDGASJ-ZBFHGGJFSA-N	0	0	286.419	4.311	20	30		CIEDRN
C[C@H](Nc1ccc2c(c1)CCCO2)c1cccc(C#N)c1	ZINC000183070161	261476886	/nfs/dbraw/zinc/47/68/86/261476886.db2.gz	QAAANPNRXCLAIQ-ZDUSSCGKSA-N	0	0	278.355	4.056	20	30		CIEDRN
Cc1cc(C)c(C(=O)Nc2ccc(C#N)c(Cl)c2)c(C)c1	ZINC000313980548	261551743	/nfs/dbraw/zinc/55/17/43/261551743.db2.gz	POMNCGJYVGMMHZ-UHFFFAOYSA-N	0	0	298.773	4.389	20	30		CIEDRN
CC[C@@H](C)[C@H]1CCCCN1c1ccc(Cl)c(C#N)n1	ZINC000462702388	261566054	/nfs/dbraw/zinc/56/60/54/261566054.db2.gz	PLOODLHCFZBPOZ-BXUZGUMPSA-N	0	0	277.799	4.012	20	30		CIEDRN
C[C@@H](C(=O)Nc1ccccc1S[C@@H](C)CC#N)C1CC1	ZINC000178484285	261745319	/nfs/dbraw/zinc/74/53/19/261745319.db2.gz	TYTPXZSRIGIPFI-NWDGAFQWSA-N	0	0	288.416	4.065	20	30		CIEDRN
CC[C@H](C)[C@H](C)C(=O)N(CC)c1ccc(C#N)c(Cl)c1	ZINC000181174662	261887974	/nfs/dbraw/zinc/88/79/74/261887974.db2.gz	SSMWRYFKWVXWOE-RYUDHWBXSA-N	0	0	292.810	4.247	20	30		CIEDRN
CC(C)Oc1ccc(NCC(C)(C)CCC#N)cc1C#N	ZINC000181530783	261900741	/nfs/dbraw/zinc/90/07/41/261900741.db2.gz	HBNHCKRLSDKCCI-UHFFFAOYSA-N	0	0	285.391	4.087	20	30		CIEDRN
C[C@@H](CSC(C)(C)C)Nc1ccc(CC#N)cc1	ZINC000184746496	262028167	/nfs/dbraw/zinc/02/81/67/262028167.db2.gz	WYBUNEMFMWKBIV-LBPRGKRZSA-N	0	0	262.422	4.085	20	30		CIEDRN
CCOc1ccc2ccccc2c1OC[C@@H](C#N)CCC#N	ZINC000184773976	262028868	/nfs/dbraw/zinc/02/88/68/262028868.db2.gz	IJRJZHFJQOOUDV-CQSZACIVSA-N	0	0	294.354	4.061	20	30		CIEDRN
N#CCC[C@H](C#N)CSCCCCc1ccccc1	ZINC000185081338	262040192	/nfs/dbraw/zinc/04/01/92/262040192.db2.gz	VFRMJSSKAASHLF-MRXNPFEDSA-N	0	0	272.417	4.186	20	30		CIEDRN
C=CCCC(=O)N(Cc1ccc(C)o1)c1ccc(F)cc1	ZINC000108758080	262060585	/nfs/dbraw/zinc/06/05/85/262060585.db2.gz	LLVKVLWVZXFIKM-UHFFFAOYSA-N	0	0	287.334	4.227	20	30		CIEDRN
N#CCCCOc1cccc(NC(=O)C2=CCCCCC2)c1	ZINC000185690072	262066504	/nfs/dbraw/zinc/06/65/04/262066504.db2.gz	FWOREPYLKDYHLC-UHFFFAOYSA-N	0	0	298.386	4.198	20	30		CIEDRN
Cc1ccc(N[C@H]2CCC[C@H](C#N)C2)cc1OC(F)F	ZINC000185729755	262068852	/nfs/dbraw/zinc/06/88/52/262068852.db2.gz	SSBHVWPYLZQFKS-RYUDHWBXSA-N	0	0	280.318	4.091	20	30		CIEDRN
C=C(C)CN(C)Cc1cc(Cl)c(OC)cc1Cl	ZINC000497196971	262099675	/nfs/dbraw/zinc/09/96/75/262099675.db2.gz	CRBJHTAULGQZIR-UHFFFAOYSA-N	0	0	274.191	4.010	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC(c2cccc(F)c2)CC1	ZINC000364057941	262128854	/nfs/dbraw/zinc/12/88/54/262128854.db2.gz	RRXMNHBCOAUIHD-AWEZNQCLSA-N	0	0	289.394	4.134	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2ccc(/C=C/C)cc2)CC1	ZINC000497376647	262148852	/nfs/dbraw/zinc/14/88/52/262148852.db2.gz	MOOGCXDYPJLDHL-HWKANZROSA-N	0	0	270.376	4.150	20	30		CIEDRN
C[C@H](CCC#N)Sc1nc2cc(Cl)ccc2n1C	ZINC000188299055	262153216	/nfs/dbraw/zinc/15/32/16/262153216.db2.gz	FWFWFWZIVNWQPX-SECBINFHSA-N	0	0	279.796	4.011	20	30		CIEDRN
C[C@@H](CCC#N)Sc1nnc(-c2cc3ccccc3o2)o1	ZINC000188323043	262153593	/nfs/dbraw/zinc/15/35/93/262153593.db2.gz	FAXDHUOLWMLEDO-JTQLQIEISA-N	0	0	299.355	4.267	20	30		CIEDRN
C[C@H](CCC#N)Sc1ccc(C#N)c(C(F)(F)F)c1	ZINC000188329235	262154075	/nfs/dbraw/zinc/15/40/75/262154075.db2.gz	NZHDZDVWIDWEER-SECBINFHSA-N	0	0	284.306	4.361	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1ccc(/C=C\C)cc1	ZINC000497405612	262155935	/nfs/dbraw/zinc/15/59/35/262155935.db2.gz	KEKKPVXEIGKRTI-ALCCZGGFSA-N	0	0	258.365	4.150	20	30		CIEDRN
CC(C)C1(C)CCN(C(=O)Nc2ccc(CC#N)cc2)CC1	ZINC000188447668	262156154	/nfs/dbraw/zinc/15/61/54/262156154.db2.gz	PEWMDRPFUCPUAW-UHFFFAOYSA-N	0	0	299.418	4.043	20	30		CIEDRN
N#CCCCCSCc1ccc(F)c(Cl)c1	ZINC000190193828	262180539	/nfs/dbraw/zinc/18/05/39/262180539.db2.gz	XJNQYPUNDFLYQK-UHFFFAOYSA-N	0	0	257.761	4.406	20	30		CIEDRN
C=CCCC(=O)N1[C@H](C)CCC[C@H]1c1ccccc1	ZINC000364177138	262180563	/nfs/dbraw/zinc/18/05/63/262180563.db2.gz	YBSCZRCDEDWTLG-ZBFHGGJFSA-N	0	0	257.377	4.095	20	30		CIEDRN
C=CCC1(C(=O)N2C[C@H](c3ccsc3)C[C@H]2C)CCC1	ZINC000364202699	262183522	/nfs/dbraw/zinc/18/35/22/262183522.db2.gz	USDJEPWESBNHMK-UKRRQHHQSA-N	0	0	289.444	4.199	20	30		CIEDRN
CC#CCCNC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000497650218	262184932	/nfs/dbraw/zinc/18/49/32/262184932.db2.gz	CJVQQZPDARBBIJ-UHFFFAOYSA-N	0	0	294.354	4.014	20	30		CIEDRN
C=CCCCC(=O)Nc1cccc(O[C@@H](C)CC)c1	ZINC000497657787	262185484	/nfs/dbraw/zinc/18/54/84/262185484.db2.gz	RSULCPAKXOIKRB-ZDUSSCGKSA-N	0	0	261.365	4.159	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@H](CC)c1ccc(Cl)s1	ZINC000497663856	262186354	/nfs/dbraw/zinc/18/63/54/262186354.db2.gz	VZVBJPHJDDJKRS-SNVBAGLBSA-N	0	0	286.828	4.070	20	30		CIEDRN
Cc1oc(-c2cccs2)nc1CSCCCC#N	ZINC000190891837	262186622	/nfs/dbraw/zinc/18/66/22/262186622.db2.gz	LOOYYAXWRNOUDJ-UHFFFAOYSA-N	0	0	278.402	4.249	20	30		CIEDRN
N#CCCCSCCCc1ccc(Cl)cc1	ZINC000190955025	262187437	/nfs/dbraw/zinc/18/74/37/262187437.db2.gz	MMWSJRARNJEYRK-UHFFFAOYSA-N	0	0	253.798	4.310	20	30		CIEDRN
CC(C)(C#N)CC(=O)NCC1CCC(c2ccccc2)CC1	ZINC000497690002	262190381	/nfs/dbraw/zinc/19/03/81/262190381.db2.gz	UMOZLAOTUYXQGE-UHFFFAOYSA-N	0	0	298.430	4.016	20	30		CIEDRN
CC[C@H](C)CC(=O)Nc1ccccc1SC[C@H](C)C#N	ZINC000191482291	262192555	/nfs/dbraw/zinc/19/25/55/262192555.db2.gz	WJRLAJJNDGEPAY-QWHCGFSZSA-N	0	0	290.432	4.313	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)C[C@@H](C)CCC	ZINC000497796802	262210106	/nfs/dbraw/zinc/21/01/06/262210106.db2.gz	IVLKFJGAJDIZGO-HNNXBMFYSA-N	0	0	259.393	4.028	20	30		CIEDRN
CCCC[C@H](C)C(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1	ZINC000502994084	262235549	/nfs/dbraw/zinc/23/55/49/262235549.db2.gz	AAAKUXCUHGKIBU-CGTJXYLNSA-N	0	0	298.430	4.111	20	30		CIEDRN
N#CCCCCSc1nc(-c2ccccc2)co1	ZINC000195101407	262246321	/nfs/dbraw/zinc/24/63/21/262246321.db2.gz	HXECUCVLCKRAPG-UHFFFAOYSA-N	0	0	258.346	4.128	20	30		CIEDRN
COc1cc(SC)ccc1NCC(C)(C)CCC#N	ZINC000195197618	262247459	/nfs/dbraw/zinc/24/74/59/262247459.db2.gz	HOUZTVAKORVBCC-UHFFFAOYSA-N	0	0	278.421	4.159	20	30		CIEDRN
CC[C@H](CC#N)NCc1cc(-c2ccccc2)cs1	ZINC000054183958	262259703	/nfs/dbraw/zinc/25/97/03/262259703.db2.gz	YPMSQJVPBXVCHW-OAHLLOKOSA-N	0	0	270.401	4.197	20	30		CIEDRN
CC[C@@H](CC#N)NCc1cccc(OCc2ccccc2)c1	ZINC000184087585	262269164	/nfs/dbraw/zinc/26/91/64/262269164.db2.gz	BGRVPQPXILAZEB-SFHVURJKSA-N	0	0	294.398	4.047	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@H](c3csc(C)c3)C2)CCC1	ZINC000365077947	262277370	/nfs/dbraw/zinc/27/73/70/262277370.db2.gz	QLORMTMWIGYEEO-AWEZNQCLSA-N	0	0	289.444	4.119	20	30		CIEDRN
N#C[C@H]1CCC[C@@H](Nc2csc3ccccc23)C1	ZINC000463237308	262279604	/nfs/dbraw/zinc/27/96/04/262279604.db2.gz	MCWNPNVJVNVUDX-NWDGAFQWSA-N	0	0	256.374	4.396	20	30		CIEDRN
C=CCC1(C(=O)N2C[C@H](c3cccs3)C[C@@H]2C)CCC1	ZINC000365153176	262280631	/nfs/dbraw/zinc/28/06/31/262280631.db2.gz	ACWFTZYDTZHOAJ-UONOGXRCSA-N	0	0	289.444	4.199	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)NCC1(Sc2ccccc2)CC1	ZINC000188373914	262293005	/nfs/dbraw/zinc/29/30/05/262293005.db2.gz	YIVQOUXTLZXTCG-MRXNPFEDSA-N	0	0	289.444	4.030	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1C[C@@H](c2ccccc2C)C[C@@H]1C	ZINC000188434697	262297057	/nfs/dbraw/zinc/29/70/57/262297057.db2.gz	BKCNCMGWIUFQEM-TXPKVOOTSA-N	0	0	285.431	4.302	20	30		CIEDRN
Cc1cc(Br)cc(NCCCC(C)(C)C#N)c1	ZINC000186014378	262311499	/nfs/dbraw/zinc/31/14/99/262311499.db2.gz	QYJQPMHWSPLSEL-UHFFFAOYSA-N	0	0	295.224	4.499	20	30		CIEDRN
C=CC[C@@H](C(=O)NCC1(C)CCCC1)c1ccccc1	ZINC000488325859	262311963	/nfs/dbraw/zinc/31/19/63/262311963.db2.gz	BTYBSSRDLOLYNV-MRXNPFEDSA-N	0	0	271.404	4.043	20	30		CIEDRN
C=CCC[C@@H](C(=O)N1CCC2(CCC2)C1)c1ccccc1	ZINC000188547278	262314100	/nfs/dbraw/zinc/31/41/00/262314100.db2.gz	RCNUFHDOUPRCSD-QGZVFWFLSA-N	0	0	283.415	4.139	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](c2cc(C)cc(C)c2)C1	ZINC000188581713	262319393	/nfs/dbraw/zinc/31/93/93/262319393.db2.gz	GKBUQBWGMJHDME-VQIMIIECSA-N	0	0	285.431	4.222	20	30		CIEDRN
CC[C@@H]1CCCC[C@H]1N(C)C(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000462202386	262319506	/nfs/dbraw/zinc/31/95/06/262319506.db2.gz	WCYDMKZVGKAZDY-YXJHDRRASA-N	0	0	298.430	4.089	20	30		CIEDRN
CCO[C@H](C)c1nc(CSCCCCC#N)cs1	ZINC000161829537	262320328	/nfs/dbraw/zinc/32/03/28/262320328.db2.gz	OGCWJRWYZJGYIL-LLVKDONJSA-N	0	0	284.450	4.168	20	30		CIEDRN
C=CCC[C@@H](C(=O)Nc1c(C)onc1CC)c1ccccc1	ZINC000188844487	262325293	/nfs/dbraw/zinc/32/52/93/262325293.db2.gz	OOVDJRROUVKQSU-OAHLLOKOSA-N	0	0	298.386	4.234	20	30		CIEDRN
C=CCCCS[C@@H](C)C(=O)NCc1ccc(Cl)cc1	ZINC000522758681	262339047	/nfs/dbraw/zinc/33/90/47/262339047.db2.gz	JBDUJGHXZQJJEZ-LBPRGKRZSA-N	0	0	297.851	4.044	20	30		CIEDRN
N#C[C@@H]1CC[C@H](Nc2cc(Cl)cc(Cl)c2)C1	ZINC000390776562	262345158	/nfs/dbraw/zinc/34/51/58/262345158.db2.gz	FYCGPQGZWSJZDT-KCJUWKMLSA-N	0	0	255.148	4.098	20	30		CIEDRN
Cc1nc2ccc(NC(=O)C3(C#N)CCCCC3)cc2s1	ZINC000057382035	262348927	/nfs/dbraw/zinc/34/89/27/262348927.db2.gz	MIJKFBNHUYOOSH-UHFFFAOYSA-N	0	0	299.399	4.017	20	30		CIEDRN
C=C(C)CCc1noc(/C=C(/C)c2ccccc2)n1	ZINC000508632898	262365634	/nfs/dbraw/zinc/36/56/34/262365634.db2.gz	ASCCXQFYKWZLAW-QBFSEMIESA-N	0	0	254.333	4.139	20	30		CIEDRN
Cc1ccc(C#N)cc1NCc1cc2ccc(F)cc2[nH]1	ZINC000488589410	262378898	/nfs/dbraw/zinc/37/88/98/262378898.db2.gz	MVULUHQPATYYAI-UHFFFAOYSA-N	0	0	279.318	4.099	20	30		CIEDRN
Cc1cc(F)ccc1-c1noc(-c2ccc(C#N)cc2C)n1	ZINC000320060710	262385446	/nfs/dbraw/zinc/38/54/46/262385446.db2.gz	KSTURIWLUSPFBU-UHFFFAOYSA-N	0	0	293.301	4.031	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)[C@@H](C)CCCc1ccccc1	ZINC000488812002	262395640	/nfs/dbraw/zinc/39/56/40/262395640.db2.gz	CSTJOGWNWDKIHA-WMZOPIPTSA-N	0	0	285.431	4.213	20	30		CIEDRN
N#Cc1ccc(N[C@@H]2CCCc3sccc32)c(F)c1	ZINC000061364262	262396238	/nfs/dbraw/zinc/39/62/38/262396238.db2.gz	MDWXORRTPYRSRM-CYBMUJFWSA-N	0	0	272.348	4.248	20	30		CIEDRN
N#Cc1cc(F)c(NCc2ccccc2Cl)c(F)c1	ZINC000063507801	262447313	/nfs/dbraw/zinc/44/73/13/262447313.db2.gz	RYRJRKHHRMFLGE-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
CC(C)(C#N)CCCC[S@](=O)c1ccc(Cl)cc1	ZINC000232526488	262497243	/nfs/dbraw/zinc/49/72/43/262497243.db2.gz	QOKFOQDKOXRVKK-SFHVURJKSA-N	0	0	283.824	4.168	20	30		CIEDRN
C=CCCSCc1csc(-c2ccccn2)n1	ZINC000339092085	262596964	/nfs/dbraw/zinc/59/69/64/262596964.db2.gz	UNNSKOJNAZLRIG-UHFFFAOYSA-N	0	0	262.403	4.014	20	30		CIEDRN
CC[C@@H]1CCC[C@H]1C(=O)Nc1ccc(Cl)cc1CC#N	ZINC000410968680	262674146	/nfs/dbraw/zinc/67/41/46/262674146.db2.gz	OAIRBLLEULWVSY-BXUZGUMPSA-N	0	0	290.794	4.171	20	30		CIEDRN
C=CCCC(=O)Nc1sc2c(c1C#N)C[C@H](C)C[C@H]2C	ZINC000410991329	262674630	/nfs/dbraw/zinc/67/46/30/262674630.db2.gz	UXHIJVNUBVXUBJ-GHMZBOCLSA-N	0	0	288.416	4.210	20	30		CIEDRN
Cc1ccc2ncc(CN3CCCC(C)(C)[C@@H]3C#N)cc2c1	ZINC000411632287	262701318	/nfs/dbraw/zinc/70/13/18/262701318.db2.gz	FHANVQQQGQPNNT-SFHVURJKSA-N	0	0	293.414	4.057	20	30		CIEDRN
C[C@@H](SCCC#N)c1nnc(-c2ccccc2F)s1	ZINC000413015755	262752816	/nfs/dbraw/zinc/75/28/16/262752816.db2.gz	ULPAKFJCTSXGPH-SECBINFHSA-N	0	0	293.392	4.052	20	30		CIEDRN
C[C@H](SCCC#N)c1nnc(-c2ccccc2F)s1	ZINC000413015756	262752897	/nfs/dbraw/zinc/75/28/97/262752897.db2.gz	ULPAKFJCTSXGPH-VIFPVBQESA-N	0	0	293.392	4.052	20	30		CIEDRN
C=CC[C@@H](Cc1ccccc1)NC(=O)[C@]1(C)CC=CCC1	ZINC000413985387	262796064	/nfs/dbraw/zinc/79/60/64/262796064.db2.gz	KAGVRJCTKRILSA-PKOBYXMFSA-N	0	0	283.415	4.036	20	30		CIEDRN
C/C=C/C=C/C(=O)Nc1ccccc1SC[C@@H](C)C#N	ZINC000264448306	262888504	/nfs/dbraw/zinc/88/85/04/262888504.db2.gz	BWVVDOJFGPOYNE-CGNPCLDQSA-N	0	0	286.400	4.009	20	30		CIEDRN
Cc1ccncc1[C@H](C)Nc1cccc(OCCCC#N)c1	ZINC000271927031	263000450	/nfs/dbraw/zinc/00/04/50/263000450.db2.gz	GLIZQVGCNKPHHY-HNNXBMFYSA-N	0	0	295.386	4.246	20	30		CIEDRN
CC(C)(C)[C@](C)(C#N)NC(=O)c1cc(Cl)ccc1Cl	ZINC000272415243	263004104	/nfs/dbraw/zinc/00/41/04/263004104.db2.gz	MHWAWKSJKFRLDF-AWEZNQCLSA-N	0	0	299.201	4.052	20	30		CIEDRN
Cc1ccc(N(CCC#N)C(=O)[C@H](C)c2ccccc2)cc1	ZINC000273103680	263012789	/nfs/dbraw/zinc/01/27/89/263012789.db2.gz	JCFPSIQNLLVLAA-MRXNPFEDSA-N	0	0	292.382	4.045	20	30		CIEDRN
CCS[C@H](C)c1noc(-c2ccc(C3(C#N)CC3)cc2)n1	ZINC000274059323	263021187	/nfs/dbraw/zinc/02/11/87/263021187.db2.gz	VULQUOQSMLWLEN-LLVKDONJSA-N	0	0	299.399	4.106	20	30		CIEDRN
CCS[C@@H](C)c1noc(-c2ccc(C3(C#N)CC3)cc2)n1	ZINC000274059325	263021296	/nfs/dbraw/zinc/02/12/96/263021296.db2.gz	VULQUOQSMLWLEN-NSHDSACASA-N	0	0	299.399	4.106	20	30		CIEDRN
N#Cc1cccc(/C=C/c2nc([C@H]3CCCCS3)no2)c1	ZINC000274172915	263021658	/nfs/dbraw/zinc/02/16/58/263021658.db2.gz	YWQMKKQKRWWREK-HSBSLETESA-N	0	0	297.383	4.070	20	30		CIEDRN
CC(C)(C#N)CCSCc1nc(C(F)(F)F)cs1	ZINC000276589180	263037434	/nfs/dbraw/zinc/03/74/34/263037434.db2.gz	IAMJNWGSVCMGQQ-UHFFFAOYSA-N	0	0	294.367	4.335	20	30		CIEDRN
COc1ccc(CSCCC(C)(C)C#N)cc1F	ZINC000276611053	263037480	/nfs/dbraw/zinc/03/74/80/263037480.db2.gz	LWNIDBBNGCNQJI-UHFFFAOYSA-N	0	0	267.369	4.007	20	30		CIEDRN
CCCCCCC[C@H](CC(=O)[O-])[NH2+]Cc1cccc(F)c1	ZINC000277187000	263040060	/nfs/dbraw/zinc/04/00/60/263040060.db2.gz	FPCLFYMRYFHRSA-MRXNPFEDSA-N	0	0	295.398	4.119	20	30		CIEDRN
CCCCCCC[C@H](CC(=O)[O-])[NH2+]Cc1sccc1C	ZINC000277380376	263040851	/nfs/dbraw/zinc/04/08/51/263040851.db2.gz	QTWRKAKJWJVERH-CQSZACIVSA-N	0	0	297.464	4.350	20	30		CIEDRN
C[C@H](c1ccccc1F)[S@@](=O)CCCCC(C)(C)C#N	ZINC000278365922	263047270	/nfs/dbraw/zinc/04/72/70/263047270.db2.gz	XMQREEUEIMKHJT-XCLFUZPHSA-N	0	0	295.423	4.355	20	30		CIEDRN
CC(C)c1nc2ccccc2c(SCCCC#N)n1	ZINC000278379517	263047734	/nfs/dbraw/zinc/04/77/34/263047734.db2.gz	QNQPIHBAEDHCKJ-UHFFFAOYSA-N	0	0	271.389	4.149	20	30		CIEDRN
C[C@H](NC(=O)CC(C)(C)C#N)c1ccc(Cl)cc1Cl	ZINC000278450713	263048199	/nfs/dbraw/zinc/04/81/99/263048199.db2.gz	WCZUEZMLVDMHFU-VIFPVBQESA-N	0	0	299.201	4.110	20	30		CIEDRN
C[C@@H](NC(=O)CC(C)(C)C#N)c1ccc(Cl)cc1Cl	ZINC000278450710	263048316	/nfs/dbraw/zinc/04/83/16/263048316.db2.gz	WCZUEZMLVDMHFU-SECBINFHSA-N	0	0	299.201	4.110	20	30		CIEDRN
N#C[C@H]1CC[C@H](Sc2nc3ccccc3n2C(F)F)C1	ZINC000278489952	263048392	/nfs/dbraw/zinc/04/83/92/263048392.db2.gz	BBCFLJLKRWKOTA-UWVGGRQHSA-N	0	0	293.342	4.216	20	30		CIEDRN
N#C[C@H]1CC[C@H](Sc2ccc3ccccc3n2)C1	ZINC000278566797	263049169	/nfs/dbraw/zinc/04/91/69/263049169.db2.gz	NDUSDHPEAUPFQL-AAEUAGOBSA-N	0	0	254.358	4.019	20	30		CIEDRN
CC(C)Oc1cccc([C@H](C)OC(=O)CC(C)(C)C#N)c1	ZINC000278824916	263051066	/nfs/dbraw/zinc/05/10/66/263051066.db2.gz	QBNAMWYHJHTJGR-ZDUSSCGKSA-N	0	0	289.375	4.018	20	30		CIEDRN
N#CCCN(CC1CC1)C(=O)Nc1ccc(C2CCC2)cc1	ZINC000278877962	263051665	/nfs/dbraw/zinc/05/16/65/263051665.db2.gz	HQCSNPDCKOOSGX-UHFFFAOYSA-N	0	0	297.402	4.112	20	30		CIEDRN
CCCNc1ccc(Cl)cc1NC(=O)CC(C)(C)C#N	ZINC000279306901	263054466	/nfs/dbraw/zinc/05/44/66/263054466.db2.gz	DHACTJBRYPPJGO-UHFFFAOYSA-N	0	0	293.798	4.040	20	30		CIEDRN
C=C(C)CN(CC)C(=O)[C@H](C)SCC1CCCCC1	ZINC000195737067	263058192	/nfs/dbraw/zinc/05/81/92/263058192.db2.gz	BJINSKNNMFGICJ-AWEZNQCLSA-N	0	0	283.481	4.113	20	30		CIEDRN
C=C(C)CN(CC)C(=O)[C@@H](C)SCC1CCCCC1	ZINC000195737066	263058299	/nfs/dbraw/zinc/05/82/99/263058299.db2.gz	BJINSKNNMFGICJ-CQSZACIVSA-N	0	0	283.481	4.113	20	30		CIEDRN
CSc1ccc(CSCCCSCC#N)cc1	ZINC000280066381	263058823	/nfs/dbraw/zinc/05/88/23/263058823.db2.gz	ZPIHKHRCBXBLPM-UHFFFAOYSA-N	0	0	283.487	4.289	20	30		CIEDRN
C[C@@H](C[S@](=O)CCCCC(C)(C)C#N)c1ccccc1	ZINC000280072535	263058948	/nfs/dbraw/zinc/05/89/48/263058948.db2.gz	USDPNFNEDKIXLC-MGPUTAFESA-N	0	0	291.460	4.259	20	30		CIEDRN
N#CC1(CCCSc2cc(F)ccc2F)CCOCC1	ZINC000280970454	263065547	/nfs/dbraw/zinc/06/55/47/263065547.db2.gz	KXRCYRIRCFPNOL-UHFFFAOYSA-N	0	0	297.370	4.157	20	30		CIEDRN
C[C@H]1CCCC[C@H]1N(C)C(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000281031611	263065746	/nfs/dbraw/zinc/06/57/46/263065746.db2.gz	YPYNZWOLBDLMKZ-WMLDXEAASA-N	0	0	298.430	4.138	20	30		CIEDRN
CC(=O)c1ccc2cc(OCCC(C)(C)C#N)ccc2c1	ZINC000281837385	263072450	/nfs/dbraw/zinc/07/24/50/263072450.db2.gz	IRIXATDYEQGMDA-UHFFFAOYSA-N	0	0	281.355	4.361	20	30		CIEDRN
CC(C)N(CC1CCC1)C(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000281894079	263072858	/nfs/dbraw/zinc/07/28/58/263072858.db2.gz	PMEIRIZQAJCQMB-UHFFFAOYSA-N	0	0	298.430	4.138	20	30		CIEDRN
CC(C)(C#N)CCOc1cccc(-c2nccs2)c1	ZINC000281924338	263073162	/nfs/dbraw/zinc/07/31/62/263073162.db2.gz	OEXLZHRPWGPWTG-UHFFFAOYSA-N	0	0	272.373	4.129	20	30		CIEDRN
CCCC[C@@H](C)C(=O)Nc1cccc(OCCCC#N)c1	ZINC000282188375	263074973	/nfs/dbraw/zinc/07/49/73/263074973.db2.gz	PBHCUCWMDIBGHT-CQSZACIVSA-N	0	0	288.391	4.134	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)Nc1ccc2nc(C3CC3)sc2c1	ZINC000285053737	263089812	/nfs/dbraw/zinc/08/98/12/263089812.db2.gz	CYSPHWRGFNXMOA-INIZCTEOSA-N	0	0	299.399	4.052	20	30		CIEDRN
CCCOc1ccc(NC(=O)[C@@](C)(C#N)CC)cc1Cl	ZINC000285089192	263090048	/nfs/dbraw/zinc/09/00/48/263090048.db2.gz	MZFRFFMSUCFNAZ-OAHLLOKOSA-N	0	0	294.782	4.007	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)N[C@H](C)c1cc2ccccc2s1	ZINC000285250504	263091505	/nfs/dbraw/zinc/09/15/05/263091505.db2.gz	AMKQQMULJBOCCC-BZNIZROVSA-N	0	0	286.400	4.018	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)O[C@H](C)c1cccc(OC(C)C)c1	ZINC000285731845	263095417	/nfs/dbraw/zinc/09/54/17/263095417.db2.gz	KEUNTCPKATWVTQ-DYVFJYSZSA-N	0	0	289.375	4.018	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)O[C@@H](C)c1cccc(Cl)c1F	ZINC000286715791	263099344	/nfs/dbraw/zinc/09/93/44/263099344.db2.gz	IQVSRQSESUCHSD-XPTSAGLGSA-N	0	0	283.730	4.023	20	30		CIEDRN
CC[C@](C)(C#N)c1nc(-c2ccc(Cl)cc2Cl)no1	ZINC000289180251	263107939	/nfs/dbraw/zinc/10/79/39/263107939.db2.gz	WERRBKADURVMDZ-CYBMUJFWSA-N	0	0	296.157	4.235	20	30		CIEDRN
C[C@H](SCCC(C)(C)C#N)c1ccccc1[N+](=O)[O-]	ZINC000289414523	263110080	/nfs/dbraw/zinc/11/00/80/263110080.db2.gz	OZUQBKNMQLRBDW-NSHDSACASA-N	0	0	278.377	4.329	20	30		CIEDRN
CC(C)(C#N)Cc1nc(-c2ccc(Cl)c(Cl)c2)no1	ZINC000290123586	263114869	/nfs/dbraw/zinc/11/48/69/263114869.db2.gz	GLZGTEZOSBFKJD-UHFFFAOYSA-N	0	0	296.157	4.136	20	30		CIEDRN
Cc1cccc([C@H]2CCCCN2C(=O)CCCC#N)c1C	ZINC000291061055	263119860	/nfs/dbraw/zinc/11/98/60/263119860.db2.gz	AYMGSDCNULCTAK-QGZVFWFLSA-N	0	0	284.403	4.051	20	30		CIEDRN
CC(C)(C)[C@H](C#N)NC(=O)c1sccc1-c1ccccc1	ZINC000291508402	263123690	/nfs/dbraw/zinc/12/36/90/263123690.db2.gz	WEWMSQNSXNYJQO-AWEZNQCLSA-N	0	0	298.411	4.083	20	30		CIEDRN
CCSc1cccc(C[NH2+]Cc2ccc(C#N)s2)c1	ZINC000291685040	263124786	/nfs/dbraw/zinc/12/47/86/263124786.db2.gz	IFYRDKPKJFVMLW-UHFFFAOYSA-N	0	0	288.441	4.022	20	30		CIEDRN
C=CCN(CCC#N)Cc1nc(-c2ccc(C)cc2)cs1	ZINC000292130152	263128722	/nfs/dbraw/zinc/12/87/22/263128722.db2.gz	IPUZYTBWYCHTOZ-UHFFFAOYSA-N	0	0	297.427	4.020	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1ccc(CSC)cc1	ZINC000439520886	263129139	/nfs/dbraw/zinc/12/91/39/263129139.db2.gz	VGVYUZMXFLHLPX-ZDUSSCGKSA-N	0	0	278.421	4.026	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1ccc(CSC)cc1	ZINC000439520883	263129235	/nfs/dbraw/zinc/12/92/35/263129235.db2.gz	VGVYUZMXFLHLPX-CYBMUJFWSA-N	0	0	278.421	4.026	20	30		CIEDRN
C=C(C)CCNC(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl	ZINC000452725305	263137584	/nfs/dbraw/zinc/13/75/84/263137584.db2.gz	SIFVHYHBAGLKKS-QWHCGFSZSA-N	0	0	298.213	4.179	20	30		CIEDRN
CN(CCCCC(C)(C)C#N)Cc1c(F)cccc1F	ZINC000293425282	263140041	/nfs/dbraw/zinc/14/00/41/263140041.db2.gz	NIRPGSBPBRFNHN-UHFFFAOYSA-N	0	0	280.362	4.117	20	30		CIEDRN
Cc1cccc(CN[C@H](CCC#N)c2ccccc2)c1F	ZINC000294946924	263169674	/nfs/dbraw/zinc/16/96/74/263169674.db2.gz	BXQBZJFYUACZMW-QGZVFWFLSA-N	0	0	282.362	4.269	20	30		CIEDRN
Cc1cccc(CN[C@@H](CCC#N)c2ccccc2)c1F	ZINC000294946923	263169777	/nfs/dbraw/zinc/16/97/77/263169777.db2.gz	BXQBZJFYUACZMW-KRWDZBQOSA-N	0	0	282.362	4.269	20	30		CIEDRN
Cc1[nH]c(S[C@@H]2CC[C@@H](C#N)C2)nc1-c1ccccc1	ZINC000295154819	263173366	/nfs/dbraw/zinc/17/33/66/263173366.db2.gz	GMSWHHXUTDBRLJ-TZMCWYRMSA-N	0	0	283.400	4.170	20	30		CIEDRN
Cc1[nH]c(S[C@@H]2CC[C@H](C#N)C2)nc1-c1ccccc1	ZINC000295154816	263173498	/nfs/dbraw/zinc/17/34/98/263173498.db2.gz	GMSWHHXUTDBRLJ-GXTWGEPZSA-N	0	0	283.400	4.170	20	30		CIEDRN
CC[C@@H](C)[C@@H](C(=O)N[C@H]1CC[C@@H](CC#N)C1)c1ccccc1	ZINC000295600056	263180195	/nfs/dbraw/zinc/18/01/95/263180195.db2.gz	SGPHMCNNKSFUGD-MXSMSXNCSA-N	0	0	298.430	4.015	20	30		CIEDRN
Cc1cnc(/C=C2/C(=O)c3cccc(C)c3[C@H]2C)s1	ZINC000295768515	263181994	/nfs/dbraw/zinc/18/19/94/263181994.db2.gz	BNIDANXXUANNBH-DELQEKLWSA-N	0	0	269.369	4.143	20	30		CIEDRN
N#CC1(CCCNc2ccc3c(c2)CCCC3)CCOCC1	ZINC000297112453	263201314	/nfs/dbraw/zinc/20/13/14/263201314.db2.gz	YDIHYEPPUXYXTB-UHFFFAOYSA-N	0	0	298.430	4.078	20	30		CIEDRN
N#CC[C@@H]1CC[C@H](NC(=O)Nc2cccc(C3CCC3)c2)C1	ZINC000297391120	263204260	/nfs/dbraw/zinc/20/42/60/263204260.db2.gz	LUDYCMZNXUXFMJ-GUYCJALGSA-N	0	0	297.402	4.158	20	30		CIEDRN
CC(C)(C)c1ccccc1NC(=O)N[C@H]1CC[C@@H](CC#N)C1	ZINC000297424064	263204779	/nfs/dbraw/zinc/20/47/79/263204779.db2.gz	JWDASMXSBGTCBQ-KBPBESRZSA-N	0	0	299.418	4.188	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)c1cc(F)ccc1Cl	ZINC000298030525	263214405	/nfs/dbraw/zinc/21/44/05/263214405.db2.gz	NNHRMXKGFVXTCA-UHFFFAOYSA-N	0	0	296.773	4.024	20	30		CIEDRN
CC[C@@H]([NH2+][C@@H](C)CCC#N)c1ccc(Cl)s1	ZINC000299008367	263228859	/nfs/dbraw/zinc/22/88/59/263228859.db2.gz	QSPMUFKMCPEYKL-VHSXEESVSA-N	0	0	256.802	4.134	20	30		CIEDRN
C[C@@H](CCC#N)[NH2+][C@@H](C)c1ccc(-c2cccnc2)cc1	ZINC000299007768	263229280	/nfs/dbraw/zinc/22/92/80/263229280.db2.gz	QPIWMXNIRXYIHY-GJZGRUSLSA-N	0	0	279.387	4.091	20	30		CIEDRN
C=CCC[C@@H](Nc1cnn([C@H](C)C2CC2)c1)C1CC1	ZINC000187624611	263265186	/nfs/dbraw/zinc/26/51/86/263265186.db2.gz	IEYGZSMWSWAOLS-MLGOLLRUSA-N	0	0	259.397	4.011	20	30		CIEDRN
N#CCC[C@@H](Nc1ccc([N+](=O)[O-])cc1F)c1ccccc1	ZINC000164294130	263270222	/nfs/dbraw/zinc/27/02/22/263270222.db2.gz	LSEOZJPMLIDTAZ-OAHLLOKOSA-N	0	0	299.305	4.191	20	30		CIEDRN
C#CCCCCC(=O)Nc1cccc(CCC(F)(F)F)c1	ZINC000119981258	263280964	/nfs/dbraw/zinc/28/09/64/263280964.db2.gz	DQRALVDAECPUOS-UHFFFAOYSA-N	0	0	297.320	4.314	20	30		CIEDRN
C#CCCCCC(=O)N1CCCC[C@H]1c1ccc(C)cc1	ZINC000120204384	263283105	/nfs/dbraw/zinc/28/31/05/263283105.db2.gz	XEKFNJQNTVNKPS-SFHVURJKSA-N	0	0	283.415	4.242	20	30		CIEDRN
N#CCC[C@@H](Nc1ccc(F)cc1[N+](=O)[O-])c1ccccc1	ZINC000164348033	263287668	/nfs/dbraw/zinc/28/76/68/263287668.db2.gz	RZQLSQJVRVTKBP-CQSZACIVSA-N	0	0	299.305	4.191	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@H]1c1cccs1	ZINC000121311201	263291646	/nfs/dbraw/zinc/29/16/46/263291646.db2.gz	HMJVKMAXADXXMU-AWEZNQCLSA-N	0	0	275.417	4.180	20	30		CIEDRN
C=CCC(F)(F)c1nc([C@H]2C[C@H]2c2ccccc2)no1	ZINC000340704704	263301074	/nfs/dbraw/zinc/30/10/74/263301074.db2.gz	PDLZSVZJRFQTBT-RYUDHWBXSA-N	0	0	276.286	4.009	20	30		CIEDRN
CC(C)(CCC#N)CNc1nccc(Oc2ccccc2)n1	ZINC000340944834	263313157	/nfs/dbraw/zinc/31/31/57/263313157.db2.gz	WZTGLZYZJBBPSU-UHFFFAOYSA-N	0	0	296.374	4.011	20	30		CIEDRN
N#CCCSc1ccccc1NC(=O)c1ccsc1	ZINC000341796333	263349481	/nfs/dbraw/zinc/34/94/81/263349481.db2.gz	CENOSJIOHMRWQO-UHFFFAOYSA-N	0	0	288.397	4.006	20	30		CIEDRN
C=CCCN(C)C(=O)c1cc(Cl)ccc1SCC	ZINC000342011292	263377721	/nfs/dbraw/zinc/37/77/21/263377721.db2.gz	YMWAUPZWUKTMDG-UHFFFAOYSA-N	0	0	283.824	4.100	20	30		CIEDRN
C=CCCN(C)C(=O)c1ccc(Cl)cc1SCC	ZINC000341988985	263381092	/nfs/dbraw/zinc/38/10/92/263381092.db2.gz	ZBCMAHZORZFPMV-UHFFFAOYSA-N	0	0	283.824	4.100	20	30		CIEDRN
CC[C@@H](c1ccccc1)[S@@](=O)Cc1ccc(CC#N)cc1	ZINC000342142191	263398708	/nfs/dbraw/zinc/39/87/08/263398708.db2.gz	SFTXXBVICPXWCM-RXVVDRJESA-N	0	0	297.423	4.153	20	30		CIEDRN
CCc1nc(CSCc2ccc(CC#N)cc2)cs1	ZINC000342552506	263447055	/nfs/dbraw/zinc/44/70/55/263447055.db2.gz	FJFQEYYOEPUQDI-UHFFFAOYSA-N	0	0	288.441	4.205	20	30		CIEDRN
C=CCCOCCCCC(=O)Nc1ccc(SC)cc1	ZINC000342611170	263461681	/nfs/dbraw/zinc/46/16/81/263461681.db2.gz	UUPNAAUXKZBXFE-UHFFFAOYSA-N	0	0	293.432	4.110	20	30		CIEDRN
Cc1ccc([C@H](C)Nc2snc(Cl)c2C#N)cc1	ZINC000048566198	263823566	/nfs/dbraw/zinc/82/35/66/263823566.db2.gz	YYTGVHCCNZINMT-VIFPVBQESA-N	0	0	277.780	4.150	20	30		CIEDRN
O=C(Nc1cccc2[nH]ccc21)N[C@@H]1CC[C@@H]2CCC[C@@H]2C1	ZINC000328616544	263828488	/nfs/dbraw/zinc/82/84/88/263828488.db2.gz	SPUXDVKLLNVNIP-BFHYXJOUSA-N	0	0	297.402	4.463	20	30		CIEDRN
CCC[C@@H](NC(=O)[C@H]1CCCC(=O)N1)C1CCCCC1	ZINC000328825854	263868936	/nfs/dbraw/zinc/86/89/36/263868936.db2.gz	SNQIHMFTPIRHLK-ZIAGYGMSSA-N	0	0	280.412	4.201	20	30		CIEDRN
Cc1noc(NC(=O)[C@@H]2CC[C@H]3CCCC[C@H]3C2)c1C	ZINC000328875101	263886097	/nfs/dbraw/zinc/88/60/97/263886097.db2.gz	RWKCHHNGGAWGSK-HZSPNIEDSA-N	0	0	276.380	4.486	20	30		CIEDRN
CC1(C)CCCC[C@H]1NC(=O)Nc1scnc1C1CC1	ZINC000328956791	263898050	/nfs/dbraw/zinc/89/80/50/263898050.db2.gz	ZJFMGQWQARHJFD-LLVKDONJSA-N	0	0	293.436	4.315	20	30		CIEDRN
CO[C@H]1CCC[C@H](C(=O)Nc2nc(C3CCC3)cs2)C1	ZINC000328989888	263912472	/nfs/dbraw/zinc/91/24/72/263912472.db2.gz	HYFLRPGDGSRQNT-RYUDHWBXSA-N	0	0	294.420	4.204	20	30		CIEDRN
C=CCC[C@H](NC(=O)N1CCCC[C@@H]1C=C)c1ccccc1	ZINC000425932600	263914825	/nfs/dbraw/zinc/91/48/25/263914825.db2.gz	QVRYBGQCMIBXAW-ROUUACIJSA-N	0	0	298.430	4.444	20	30		CIEDRN
CC(=O)c1c(C)[nH]c(C(=O)NCCC(C)(C)C)c1C(C)C	ZINC000330394540	263926542	/nfs/dbraw/zinc/92/65/42/263926542.db2.gz	LSKNALIODOXXQK-UHFFFAOYSA-N	0	0	292.423	4.390	20	30		CIEDRN
Cc1cnc([C@@H](C)NC(=O)c2sccc2C(C)C)o1	ZINC000330703724	264018728	/nfs/dbraw/zinc/01/87/28/264018728.db2.gz	JHNLMBDNBDKFLG-SNVBAGLBSA-N	0	0	278.377	4.234	20	30		CIEDRN
CC(C)C[C@](C)(C#N)NC(=O)c1cc(Cl)ccc1F	ZINC000330752112	264029344	/nfs/dbraw/zinc/02/93/44/264029344.db2.gz	CGIZYBRBIPZYQZ-CQSZACIVSA-N	0	0	282.746	4.112	20	30		CIEDRN
CC(C)C[C@@](C)(C#N)NC(=O)c1ccc(F)cc1Cl	ZINC000330757681	264030561	/nfs/dbraw/zinc/03/05/61/264030561.db2.gz	ILRYDSFUINSCSE-AWEZNQCLSA-N	0	0	282.746	4.112	20	30		CIEDRN
CC(C)c1ccsc1C(=O)NCC1(C(N)=O)CCCC1	ZINC000330792955	264039335	/nfs/dbraw/zinc/03/93/35/264039335.db2.gz	CBZCAHBOFVHQKE-UHFFFAOYSA-N	0	0	294.420	4.272	20	30		CIEDRN
CC(=O)c1ccc(NC(=O)NC2(C)CCCC2)cc1Cl	ZINC000330805867	264043406	/nfs/dbraw/zinc/04/34/06/264043406.db2.gz	LBELYLPTKMDECJ-UHFFFAOYSA-N	0	0	294.782	4.010	20	30		CIEDRN
C[C@@H]1CCC[C@H](NC(=O)C[C@H](CC#N)c2ccccc2)[C@@H]1C	ZINC000331029572	264100210	/nfs/dbraw/zinc/10/02/10/264100210.db2.gz	RVAGOAPOLPHCGN-LMSBXDPUSA-N	0	0	298.430	4.015	20	30		CIEDRN
CSc1ccsc1C(=O)N[C@](C)(C#N)CC(C)C	ZINC000331058498	264109116	/nfs/dbraw/zinc/10/91/16/264109116.db2.gz	MLRNSEIYRHMHIW-ZDUSSCGKSA-N	0	0	282.434	4.103	20	30		CIEDRN
Cc1cc(C)c(C(=O)Nc2cnc(C(C)C)nc2)c(C)c1	ZINC000331074023	264113998	/nfs/dbraw/zinc/11/39/98/264113998.db2.gz	KMRKTDUQJVYMOB-UHFFFAOYSA-N	0	0	283.375	4.162	20	30		CIEDRN
CC1(C)CCCC[C@@H]1NC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000331079140	264116055	/nfs/dbraw/zinc/11/60/55/264116055.db2.gz	XAGISQYZIOKAOG-SJORKVTESA-N	0	0	298.430	4.159	20	30		CIEDRN
CCCCC1CCC(NC(=O)c2nc(C)oc2C)CC1	ZINC000331174717	264147306	/nfs/dbraw/zinc/14/73/06/264147306.db2.gz	KQCCRDHTPWJCJO-UHFFFAOYSA-N	0	0	278.396	4.345	20	30		CIEDRN
CCCC1CCC(N(C)C(=O)Nc2c(C)noc2C)CC1	ZINC000331183600	264155657	/nfs/dbraw/zinc/15/56/57/264155657.db2.gz	SPWHVMRARPOTOG-UHFFFAOYSA-N	0	0	293.411	4.128	20	30		CIEDRN
CCO[C@H](C)c1ncc(C(=O)N[C@@H]2CCCC2(C)C)s1	ZINC000331198608	264159291	/nfs/dbraw/zinc/15/92/91/264159291.db2.gz	MIJRZZOIGVXRAL-ZYHUDNBSSA-N	0	0	296.436	4.124	20	30		CIEDRN
Cc1noc(C)c1NC(=O)NCC1CCC(C(C)C)CC1	ZINC000331200690	264159951	/nfs/dbraw/zinc/15/99/51/264159951.db2.gz	PVGWWZMKONADME-UHFFFAOYSA-N	0	0	293.411	4.080	20	30		CIEDRN
Cc1cc(C)c(NC(=O)NCC(C)(C)C(C)C)c(C)n1	ZINC000331234300	264173418	/nfs/dbraw/zinc/17/34/18/264173418.db2.gz	KNVFJWUTTMFUCP-UHFFFAOYSA-N	0	0	277.412	4.015	20	30		CIEDRN
CCOCc1ccc(NC(=O)N[C@@H]2CCCC[C@H]2C)cc1	ZINC000331243369	264177665	/nfs/dbraw/zinc/17/76/65/264177665.db2.gz	KVPVEKCQLQLMLS-CZUORRHYSA-N	0	0	290.407	4.128	20	30		CIEDRN
CC(C)OCc1ccc(NC(=O)N[C@H]2CC[C@@H](C)C2)cc1	ZINC000331310534	264186377	/nfs/dbraw/zinc/18/63/77/264186377.db2.gz	YUANZPJMJIGPBE-CJNGLKHVSA-N	0	0	290.407	4.126	20	30		CIEDRN
CC[C@H](C)C[C@H](C)NC(=O)Nc1c(C)cc(C)nc1C	ZINC000331344051	264196351	/nfs/dbraw/zinc/19/63/51/264196351.db2.gz	UMOLXFMLGTZXMA-JQWIXIFHSA-N	0	0	277.412	4.157	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cc(C(C)C)c(O)cc1C	ZINC000188967990	264260804	/nfs/dbraw/zinc/26/08/04/264260804.db2.gz	CNIGBYTVPPCQPC-QGZVFWFLSA-N	0	0	275.392	4.365	20	30		CIEDRN
CCCn1ccc2cc(NC(=O)C3(C#N)CCCC3)ccc21	ZINC000072053733	264261807	/nfs/dbraw/zinc/26/18/07/264261807.db2.gz	ZMTBMSKNKBUPPR-UHFFFAOYSA-N	0	0	295.386	4.074	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1cccc2ccc(C)nc21	ZINC000343263313	264263454	/nfs/dbraw/zinc/26/34/54/264263454.db2.gz	XUEDODXAEUPFIB-ZDUSSCGKSA-N	0	0	282.387	4.018	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N1CC(c2ccccc2)(C(C)C)C1	ZINC000424877972	264269664	/nfs/dbraw/zinc/26/96/64/264269664.db2.gz	JNJHRSBIAIZIES-UHFFFAOYSA-N	0	0	285.431	4.025	20	30		CIEDRN
Cc1sc(NC(=O)[C@@H]2CCCC[C@@H]2C)c(C#N)c1C	ZINC000425404549	264283282	/nfs/dbraw/zinc/28/32/82/264283282.db2.gz	WTHJSXQYQXLFOT-JOYOIKCWSA-N	0	0	276.405	4.001	20	30		CIEDRN
Cc1csc2nc(C)nc(Oc3cccc(F)c3C#N)c12	ZINC000128369918	264291317	/nfs/dbraw/zinc/29/13/17/264291317.db2.gz	ZODYRHDBJVCYIY-UHFFFAOYSA-N	0	0	299.330	4.111	20	30		CIEDRN
C=C[C@H](CC(=O)N1CCC[C@@H]1C1CCC1)c1ccccc1	ZINC000128694836	264303384	/nfs/dbraw/zinc/30/33/84/264303384.db2.gz	LJBKIIRJEYAYGH-CRAIPNDOSA-N	0	0	283.415	4.137	20	30		CIEDRN
C=C[C@H](CC(=O)N1CCC[C@H]1C1CCC1)c1ccccc1	ZINC000128695295	264303539	/nfs/dbraw/zinc/30/35/39/264303539.db2.gz	LJBKIIRJEYAYGH-QAPCUYQASA-N	0	0	283.415	4.137	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)C2=CCCCCC2)cc1	ZINC000128631638	264304478	/nfs/dbraw/zinc/30/44/78/264304478.db2.gz	XWTWYQXCQAPNIZ-UHFFFAOYSA-N	0	0	282.387	4.317	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)[C@H]1CCCC1(C)C	ZINC000475374733	264310701	/nfs/dbraw/zinc/31/07/01/264310701.db2.gz	ZNIJQYJFHMKNOX-OAHLLOKOSA-N	0	0	289.394	4.167	20	30		CIEDRN
C=C(C)COc1cccc(NCc2scnc2C)c1	ZINC000129253414	264319184	/nfs/dbraw/zinc/31/91/84/264319184.db2.gz	DJVWQQJOKCBPHT-UHFFFAOYSA-N	0	0	274.389	4.019	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1c(C)cccc1OC(F)F	ZINC000129210886	264319473	/nfs/dbraw/zinc/31/94/73/264319473.db2.gz	GKWXWLMGQJZZQD-UHFFFAOYSA-N	0	0	295.329	4.303	20	30		CIEDRN
C[C@H](Sc1ncc2ccccn21)c1cccc(C#N)c1	ZINC000189805206	264327484	/nfs/dbraw/zinc/32/74/84/264327484.db2.gz	NECKMPRUGJSUNR-LBPRGKRZSA-N	0	0	279.368	4.059	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cccc(C(F)F)c1	ZINC000129612745	264328199	/nfs/dbraw/zinc/32/81/99/264328199.db2.gz	JFITXFKZUMVWDH-UHFFFAOYSA-N	0	0	265.303	4.331	20	30		CIEDRN
C=C(C)CNC(=O)Nc1ccc(C(F)(F)F)cc1Cl	ZINC000157382566	264344734	/nfs/dbraw/zinc/34/47/34/264344734.db2.gz	PTDCJZJNSGFWNE-UHFFFAOYSA-N	0	0	292.688	4.056	20	30		CIEDRN
C=CCCCNC(=O)c1sccc1-c1ccccc1	ZINC000468393590	264344965	/nfs/dbraw/zinc/34/49/65/264344965.db2.gz	VAOPNOYBJAZCGN-UHFFFAOYSA-N	0	0	271.385	4.111	20	30		CIEDRN
C=CCCCN(C)C(=O)N[C@H](C)c1cc(C)sc1C	ZINC000076946701	264350873	/nfs/dbraw/zinc/35/08/73/264350873.db2.gz	MLENCDSXOLSOBA-GFCCVEGCSA-N	0	0	280.437	4.034	20	30		CIEDRN
C#CCCCCC(=O)N1CCC[C@H]1c1cc(C)ccc1C	ZINC000180388379	264406855	/nfs/dbraw/zinc/40/68/55/264406855.db2.gz	JACOSLAHSDJMDO-SFHVURJKSA-N	0	0	283.415	4.161	20	30		CIEDRN
C[C@@H](NCc1ccc(C#N)o1)c1cccc(C(F)(F)F)c1	ZINC000135122903	264553894	/nfs/dbraw/zinc/55/38/94/264553894.db2.gz	NVBGYMSRSRKATK-SNVBAGLBSA-N	0	0	294.276	4.021	20	30		CIEDRN
C#CCCCCC(=O)N1C[C@H](C)CC[C@@H]1c1ccccc1	ZINC000288233536	264673963	/nfs/dbraw/zinc/67/39/63/264673963.db2.gz	FIGGOFZORZWAQE-SJLPKXTDSA-N	0	0	283.415	4.180	20	30		CIEDRN
Cc1ccc(C)c(NC(=O)c2cc(C#N)ccc2Cl)c1	ZINC000336135995	533686509	/nfs/dbraw/zinc/68/65/09/533686509.db2.gz	HPXIDKIWENIYQX-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
C=CCCCCCN[C@@H](c1nccs1)C(F)(F)F	ZINC000293119840	264908906	/nfs/dbraw/zinc/90/89/06/264908906.db2.gz	ZCHRXFTTYJCRKS-JTQLQIEISA-N	0	0	278.343	4.083	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CCSc2ccc(F)cc21	ZINC000185071681	264957806	/nfs/dbraw/zinc/95/78/06/264957806.db2.gz	BOKGRTONLJJEIV-SMDDNHRTSA-N	0	0	293.407	4.081	20	30		CIEDRN
CC[C@@H](C)Oc1cccc(NCc2cc(C#N)cs2)c1	ZINC000093492534	265183506	/nfs/dbraw/zinc/18/35/06/265183506.db2.gz	YAWVMRRDBUXXLC-GFCCVEGCSA-N	0	0	286.400	4.409	20	30		CIEDRN
COc1cc(Cl)c(C)cc1NCc1cc(C#N)cs1	ZINC000093492658	265184094	/nfs/dbraw/zinc/18/40/94/265184094.db2.gz	JXZBCLLDGYPFNG-UHFFFAOYSA-N	0	0	292.791	4.202	20	30		CIEDRN
N#Cc1csc(CNc2ccccc2OC(F)(F)F)c1	ZINC000093685041	265190048	/nfs/dbraw/zinc/19/00/48/265190048.db2.gz	LERXALSPCDOBNI-UHFFFAOYSA-N	0	0	298.289	4.130	20	30		CIEDRN
Cc1ccc(Oc2ccc(C#N)c([N+](=O)[O-])c2)c(Cl)c1	ZINC000094593618	265244289	/nfs/dbraw/zinc/24/42/89/265244289.db2.gz	HNBJCHGGVSBKPK-UHFFFAOYSA-N	0	0	288.690	4.221	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2cccc(NC(=O)CC)c2)no1	ZINC000518951937	265247206	/nfs/dbraw/zinc/24/72/06/265247206.db2.gz	FVDJJLRFPCIOAK-LBPRGKRZSA-N	0	0	299.374	4.155	20	30		CIEDRN
Cc1cscc1CNc1ccc(Cl)cc1C#N	ZINC000094878117	265269573	/nfs/dbraw/zinc/26/95/73/265269573.db2.gz	KSJNINPMIIEZHR-UHFFFAOYSA-N	0	0	262.765	4.194	20	30		CIEDRN
CC[C@@H](CNc1nc2c(cc1C#N)CCC2)c1ccccc1	ZINC000519152608	265339557	/nfs/dbraw/zinc/33/95/57/265339557.db2.gz	PXXLBXZABMMOHE-AWEZNQCLSA-N	0	0	291.398	4.048	20	30		CIEDRN
N#Cc1ccc2c(c1)CCCN2Cc1cccc2cccnc21	ZINC000519518963	265447633	/nfs/dbraw/zinc/44/76/33/265447633.db2.gz	BCXRABQLSDWTLI-UHFFFAOYSA-N	0	0	299.377	4.059	20	30		CIEDRN
CC[C@]1(C)CCCN(C(=O)C[C@H](CC#N)c2ccccc2)C1	ZINC000356248059	266080961	/nfs/dbraw/zinc/08/09/61/266080961.db2.gz	NUSOAZUJYXMUQE-PKOBYXMFSA-N	0	0	298.430	4.113	20	30		CIEDRN
CC(C)CC1(CNC(=O)C[C@H](CC#N)c2ccccc2)CC1	ZINC000356323811	266096774	/nfs/dbraw/zinc/09/67/74/266096774.db2.gz	YSAQLAXZHHAAEN-KRWDZBQOSA-N	0	0	298.430	4.016	20	30		CIEDRN
CCCC1(CNC(=O)C[C@H](CC#N)c2ccccc2)CCC1	ZINC000356428079	266112437	/nfs/dbraw/zinc/11/24/37/266112437.db2.gz	KRJHWPCAGRVTAV-KRWDZBQOSA-N	0	0	298.430	4.161	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(OC(C)C)c(C#N)c2)CC1	ZINC000356520463	266129517	/nfs/dbraw/zinc/12/95/17/266129517.db2.gz	RRFGESSBKZCUSY-UHFFFAOYSA-N	0	0	298.386	4.030	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cccc(-c3ncco3)c2)CC1	ZINC000356551835	266136183	/nfs/dbraw/zinc/13/61/83/266136183.db2.gz	VDNGSGFTGRMDSM-UHFFFAOYSA-N	0	0	282.343	4.027	20	30		CIEDRN
CC(C)N(CC1CCC1)C(=O)C[C@H](CC#N)c1ccccc1	ZINC000357138809	266253646	/nfs/dbraw/zinc/25/36/46/266253646.db2.gz	CQIZAPUZOZELJS-SFHVURJKSA-N	0	0	298.430	4.111	20	30		CIEDRN
Cc1ccc2nc(/C=C/c3nc(C#N)cs3)ccc2c1	ZINC000357141818	266253711	/nfs/dbraw/zinc/25/37/11/266253711.db2.gz	AAHILPKACAXOHZ-FNORWQNLSA-N	0	0	277.352	4.042	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NCC1CCOCC1	ZINC000357183120	266260839	/nfs/dbraw/zinc/26/08/39/266260839.db2.gz	CUNQNRQYAYCFSZ-UHFFFAOYSA-N	0	0	273.420	4.377	20	30		CIEDRN
N#Cc1ccc(F)c(CSCc2nc3ccccc3[nH]2)c1	ZINC000357370381	266285891	/nfs/dbraw/zinc/28/58/91/266285891.db2.gz	YTCGPUNMSKLWNL-UHFFFAOYSA-N	0	0	297.358	4.007	20	30		CIEDRN
N#Cc1ccccc1/C=C\c1nc([C@@H]2CCCCS2)no1	ZINC000357547084	266320380	/nfs/dbraw/zinc/32/03/80/266320380.db2.gz	KXWJKMDVRJPSFD-CKXPSTMWSA-N	0	0	297.383	4.070	20	30		CIEDRN
C=C(C)CN(CC)C(=O)CSCc1cc(C)sc1C	ZINC000357618617	266337625	/nfs/dbraw/zinc/33/76/25/266337625.db2.gz	ZHRWIDMAPBGWGW-UHFFFAOYSA-N	0	0	297.489	4.023	20	30		CIEDRN
N#Cc1cccc(-c2nnc(CSC3CCCCC3)o2)c1	ZINC000358002347	266394540	/nfs/dbraw/zinc/39/45/40/266394540.db2.gz	LEJYIJGEQXDBKY-UHFFFAOYSA-N	0	0	299.399	4.174	20	30		CIEDRN
CSCc1ccc(N[C@@H]2CCC[C@@H](C#N)C2)cc1	ZINC000193245032	266652820	/nfs/dbraw/zinc/65/28/20/266652820.db2.gz	DCGLNWZSMOJFRA-UKRRQHHQSA-N	0	0	260.406	4.044	20	30		CIEDRN
Cc1cc(N[C@H]2CCC[C@@H](C#N)C2)c2cccnc2c1C	ZINC000193267440	266664463	/nfs/dbraw/zinc/66/44/63/266664463.db2.gz	WQYUQINLNFKIBX-CABCVRRESA-N	0	0	279.387	4.346	20	30		CIEDRN
C=CCOCCCC(=O)N(CCC)c1ccc(Cl)cc1	ZINC000361796260	266884601	/nfs/dbraw/zinc/88/46/01/266884601.db2.gz	JWIUBMOUHPDQEU-UHFFFAOYSA-N	0	0	295.810	4.066	20	30		CIEDRN
C[C@H]1CCN(CCCC#N)c2cc(Cl)ccc2S1	ZINC000361860819	266896018	/nfs/dbraw/zinc/89/60/18/266896018.db2.gz	QGKYFSCJMDGPBB-NSHDSACASA-N	0	0	280.824	4.334	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(SC)cc2OC)CC1	ZINC000361916382	266903599	/nfs/dbraw/zinc/90/35/99/266903599.db2.gz	PYBTXQUKIGGNPZ-UHFFFAOYSA-N	0	0	291.416	4.102	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc3cn(C(C)C)nc3c2)CCC1	ZINC000361934705	266906960	/nfs/dbraw/zinc/90/69/60/266906960.db2.gz	DDCXDSGMZXOFDP-UHFFFAOYSA-N	0	0	297.402	4.302	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1sc(CCC)nc1C	ZINC000362535377	267002972	/nfs/dbraw/zinc/00/29/72/267002972.db2.gz	TZKKVKQZGJMCJE-UHFFFAOYSA-N	0	0	278.421	4.111	20	30		CIEDRN
CC(C)(C#N)CC(=O)N(c1ccccc1F)C1CCCC1	ZINC000362621181	267024655	/nfs/dbraw/zinc/02/46/55/267024655.db2.gz	ZBZFFIPZZRRUQA-UHFFFAOYSA-N	0	0	288.366	4.041	20	30		CIEDRN
C=C(C)CCNc1cccc2c1CN(c1nccs1)C2	ZINC000368578516	267187428	/nfs/dbraw/zinc/18/74/28/267187428.db2.gz	NVMYZHSXIZFORR-UHFFFAOYSA-N	0	0	285.416	4.041	20	30		CIEDRN
CCCCCCCC(=O)N1CCC[C@@H](C[C@@H]2CCOC2)C1	ZINC000369841463	267271718	/nfs/dbraw/zinc/27/17/18/267271718.db2.gz	QMFMCCRKVJDSPB-IRXDYDNUSA-N	0	0	295.467	4.012	20	30		CIEDRN
C=C(C)CSCc1ncc(-c2ccc(C#N)cc2)o1	ZINC000370047951	267285900	/nfs/dbraw/zinc/28/59/00/267285900.db2.gz	UYLRTVIEOYVVNO-UHFFFAOYSA-N	0	0	270.357	4.023	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@H]1c1ccc(C)s1	ZINC000370066828	267288313	/nfs/dbraw/zinc/28/83/13/267288313.db2.gz	KLLOMARFIYFXRO-ZDUSSCGKSA-N	0	0	263.406	4.076	20	30		CIEDRN
N#CCC[C@@H](NCc1cc(F)cc(F)c1)c1ccccc1	ZINC000119273669	267314666	/nfs/dbraw/zinc/31/46/66/267314666.db2.gz	NLBFFOGKZVSBNX-QGZVFWFLSA-N	0	0	286.325	4.099	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1C[C@@H](c2cccs2)C[C@H]1C	ZINC000370448885	267319467	/nfs/dbraw/zinc/31/94/67/267319467.db2.gz	HNJFFFIRMSOJET-HIFRSBDPSA-N	0	0	289.444	4.221	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1C[C@H](c2cccs2)C[C@H]1C	ZINC000370448886	267319798	/nfs/dbraw/zinc/31/97/98/267319798.db2.gz	HNJFFFIRMSOJET-UKRRQHHQSA-N	0	0	289.444	4.221	20	30		CIEDRN
CSc1ccccc1NCc1cn2ccccc2c1C#N	ZINC000193405883	267325527	/nfs/dbraw/zinc/32/55/27/267325527.db2.gz	CBZFZUGAMHJPRN-UHFFFAOYSA-N	0	0	293.395	4.145	20	30		CIEDRN
C=CCCCC(=O)N1CCCC[C@H]1c1ccc(F)cc1F	ZINC000371224446	267374472	/nfs/dbraw/zinc/37/44/72/267374472.db2.gz	YZYAJTQUBKPISQ-INIZCTEOSA-N	0	0	293.357	4.375	20	30		CIEDRN
CCCCCCCCCC(=O)N1CCC[C@@H]1c1cc[nH]n1	ZINC000376099614	267937709	/nfs/dbraw/zinc/93/77/09/267937709.db2.gz	DPTAHTBIKLNKEB-MRXNPFEDSA-N	0	0	291.439	4.214	20	30		CIEDRN
N#CCc1ccc(N[C@@H]2CCC[C@@H](c3cccnc3)C2)cc1	ZINC000376739075	268013773	/nfs/dbraw/zinc/01/37/73/268013773.db2.gz	WMWHXMPMGLGMSY-VQIMIIECSA-N	0	0	291.398	4.286	20	30		CIEDRN
C=C[C@H](CC(=O)NCc1sccc1C)c1ccccc1	ZINC000533917733	327700864	/nfs/dbraw/zinc/70/08/64/327700864.db2.gz	HWTRPXCZLKKLHK-CQSZACIVSA-N	0	0	285.412	4.033	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1cc(C)ccc1F)c1ccccc1	ZINC000533924027	327709484	/nfs/dbraw/zinc/70/94/84/327709484.db2.gz	UVRAQZXFWGNJKT-AWEZNQCLSA-N	0	0	283.346	4.433	20	30		CIEDRN
C[C@@H]1CCC[C@H](OCc2cccc(NCCC#N)c2)C1	ZINC000565300771	327785834	/nfs/dbraw/zinc/78/58/34/327785834.db2.gz	VPJRUNIORGYKHZ-PBHICJAKSA-N	0	0	272.392	4.107	20	30		CIEDRN
CC(C)CC(=O)Nc1ccc(N[C@@H]2CCC[C@@H](C#N)C2)cc1	ZINC000185724448	327843155	/nfs/dbraw/zinc/84/31/55/327843155.db2.gz	TWJOGEGSPXCYHC-RHSMWYFYSA-N	0	0	299.418	4.165	20	30		CIEDRN
N#C[C@@H]1CCC[C@H](Nc2cccc(CC(F)(F)F)c2)C1	ZINC000185749845	327844261	/nfs/dbraw/zinc/84/42/61/327844261.db2.gz	BEYJCMSOPJLDKA-OCCSQVGLSA-N	0	0	282.309	4.286	20	30		CIEDRN
Cc1ccc2ccnc(N3CCC(CCC#N)CC3)c2c1	ZINC000563053966	327851885	/nfs/dbraw/zinc/85/18/85/327851885.db2.gz	RMGVSOCCBLHIOT-UHFFFAOYSA-N	0	0	279.387	4.063	20	30		CIEDRN
CCN(C(=O)[C@H](C)CC1CCCC1)c1ccc(C#N)cc1	ZINC000151986733	327852353	/nfs/dbraw/zinc/85/23/53/327852353.db2.gz	CEMAGMAWZLKZAO-CQSZACIVSA-N	0	0	284.403	4.128	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1ccc(/C=C/C)cc1	ZINC000497398128	327863505	/nfs/dbraw/zinc/86/35/05/327863505.db2.gz	YIJFRZUEVHOMLM-LERPRCHQSA-N	0	0	270.376	4.292	20	30		CIEDRN
N#CCCCSCc1coc(-c2c(F)cccc2F)n1	ZINC000190984602	327871953	/nfs/dbraw/zinc/87/19/53/327871953.db2.gz	DJFISRMFZUFWTQ-UHFFFAOYSA-N	0	0	294.326	4.157	20	30		CIEDRN
N#CCCCCSCc1coc(-c2cccc(F)c2)n1	ZINC000161405361	327916948	/nfs/dbraw/zinc/91/69/48/327916948.db2.gz	HYQFTLWPCCWWRG-UHFFFAOYSA-N	0	0	290.363	4.408	20	30		CIEDRN
Cc1ccc(Sc2ccc(C#N)cc2[N+](=O)[O-])cc1C	ZINC000020667398	327929421	/nfs/dbraw/zinc/92/94/21/327929421.db2.gz	QKOMSOANONARMU-UHFFFAOYSA-N	0	0	284.340	4.235	20	30		CIEDRN
C=CCCC(=O)N1CCCC[C@H]1c1cccc(Cl)c1	ZINC000365535857	327939133	/nfs/dbraw/zinc/93/91/33/327939133.db2.gz	RPLBULLSLZHDIU-HNNXBMFYSA-N	0	0	277.795	4.360	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)c2cccc(C#N)c2C)CCCC1(C)C	ZINC000338037940	327964646	/nfs/dbraw/zinc/96/46/46/327964646.db2.gz	WUDKJILISAZDBK-KRWDZBQOSA-N	0	0	296.414	4.074	20	30		CIEDRN
C[C@H]1CCCN(c2cccc(C(F)F)c2C#N)CC1	ZINC000571009826	327974378	/nfs/dbraw/zinc/97/43/78/327974378.db2.gz	JMZNKCNTYBBXSC-NSHDSACASA-N	0	0	264.319	4.122	20	30		CIEDRN
CC(C)Oc1cccc(CNc2ccc(CC#N)cc2)c1	ZINC000040640434	328014337	/nfs/dbraw/zinc/01/43/37/328014337.db2.gz	ZIIPAKBLRDRXHS-UHFFFAOYSA-N	0	0	280.371	4.152	20	30		CIEDRN
Cc1cccc(SCc2ccc(C#N)cc2F)c1	ZINC000040696063	328017163	/nfs/dbraw/zinc/01/71/63/328017163.db2.gz	YEUDUXKPUXZYHP-UHFFFAOYSA-N	0	0	257.333	4.298	20	30		CIEDRN
CC(C)(C)CNc1ccc(C#N)cc1C(F)(F)F	ZINC000041120387	328028462	/nfs/dbraw/zinc/02/84/62/328028462.db2.gz	VNAWWMUGZGGYJH-UHFFFAOYSA-N	0	0	256.271	4.035	20	30		CIEDRN
CC1(C)CCC(CNC(=O)Nc2ccc(CC#N)cc2)CC1	ZINC000534038930	328033683	/nfs/dbraw/zinc/03/36/83/328033683.db2.gz	KNBAERZIPRYHSG-UHFFFAOYSA-N	0	0	299.418	4.091	20	30		CIEDRN
C=C[C@@H](CC(=O)N(CCC)C(C)(C)C)c1ccccc1	ZINC000534053227	328034102	/nfs/dbraw/zinc/03/41/02/328034102.db2.gz	MLSZLJQOGQVCHL-HNNXBMFYSA-N	0	0	273.420	4.383	20	30		CIEDRN
CCC(CC)[C@H](C)C(=O)N[C@H](C#N)c1ccc(Cl)cc1	ZINC000534168246	328037793	/nfs/dbraw/zinc/03/77/93/328037793.db2.gz	ZKLIQHJCUURNFU-XHDPSFHLSA-N	0	0	292.810	4.093	20	30		CIEDRN
Cc1cccc([C@H]2CCCN2c2cccc(F)c2C#N)c1	ZINC000110195940	328042309	/nfs/dbraw/zinc/04/23/09/328042309.db2.gz	BDKSHTXBSARKKO-QGZVFWFLSA-N	0	0	280.346	4.347	20	30		CIEDRN
N#CC1(c2nc(C3CCCCCC3)no2)CCCCC1	ZINC000534284647	328042390	/nfs/dbraw/zinc/04/23/90/328042390.db2.gz	XBIFTTTWEHGINH-UHFFFAOYSA-N	0	0	273.380	4.233	20	30		CIEDRN
C=CCC[C@H](NC(=O)NC(C)(C)C1CC1)c1ccccc1	ZINC000534291993	328044611	/nfs/dbraw/zinc/04/46/11/328044611.db2.gz	TUJZNJXDNBNQGR-INIZCTEOSA-N	0	0	286.419	4.182	20	30		CIEDRN
CN(Cc1ccc(C#N)cc1)C(=O)C[C@H]1CCCC(C)(C)C1	ZINC000534401250	328051319	/nfs/dbraw/zinc/05/13/19/328051319.db2.gz	MOAIHMDZWYZMMS-QGZVFWFLSA-N	0	0	298.430	4.123	20	30		CIEDRN
C=CC1CCN(C(=O)[C@@H]2CC[C@H]3CCCC[C@H]3C2)CC1	ZINC000534420673	328052384	/nfs/dbraw/zinc/05/23/84/328052384.db2.gz	FNHHUXTWKOATMK-IXDOHACOSA-N	0	0	275.436	4.018	20	30		CIEDRN
N#Cc1c(F)cccc1/C=C\c1nc2ccccc2o1	ZINC000563330034	328055569	/nfs/dbraw/zinc/05/55/69/328055569.db2.gz	HMOYHNSMIGZTSR-HJWRWDBZSA-N	0	0	264.259	4.009	20	30		CIEDRN
CCOC(=O)CC[C@@H](C)Sc1ccc(C#N)cc1Cl	ZINC000563495747	328070255	/nfs/dbraw/zinc/07/02/55/328070255.db2.gz	IMXNXGLSBIZSMF-SNVBAGLBSA-N	0	0	297.807	4.036	20	30		CIEDRN
C[C@@H](SCC1(C#N)CCC1)c1nc(-c2ccccc2)no1	ZINC000563622901	328078173	/nfs/dbraw/zinc/07/81/73/328078173.db2.gz	ORUQSOAEAHIKCW-GFCCVEGCSA-N	0	0	299.399	4.225	20	30		CIEDRN
CC(C)(C#N)CCCSCc1ccccc1F	ZINC000160945701	328096563	/nfs/dbraw/zinc/09/65/63/328096563.db2.gz	JHJCLCYUGJEBBS-UHFFFAOYSA-N	0	0	251.370	4.389	20	30		CIEDRN
N#CC1(CCN[C@@H](c2ccccc2)C(F)F)CCCCC1	ZINC000411759886	328099089	/nfs/dbraw/zinc/09/90/89/328099089.db2.gz	QSCNXVAONMRLQT-HNNXBMFYSA-N	0	0	292.373	4.447	20	30		CIEDRN
Cc1cccnc1S[C@H](C)c1cccc(C#N)c1	ZINC000571307352	328101441	/nfs/dbraw/zinc/10/14/41/328101441.db2.gz	WMAYWLCLTCTTBH-GFCCVEGCSA-N	0	0	254.358	4.115	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@@H]1CC[C@H](c2ccc(Cl)cc2)C1	ZINC000412582118	328112834	/nfs/dbraw/zinc/11/28/34/328112834.db2.gz	APJGVDGEEQYCFG-DZGCQCFKSA-N	0	0	291.822	4.305	20	30		CIEDRN
COc1ccc(CSCCCC(C)(C)C#N)cc1F	ZINC000161063660	328124198	/nfs/dbraw/zinc/12/41/98/328124198.db2.gz	BWJFGJOKRZCBAN-UHFFFAOYSA-N	0	0	281.396	4.397	20	30		CIEDRN
C=C[C@H](CC(=O)N(CC)Cc1occc1C)c1ccccc1	ZINC000412790594	328126198	/nfs/dbraw/zinc/12/61/98/328126198.db2.gz	OGDIPHWSYMNBSO-MRXNPFEDSA-N	0	0	297.398	4.296	20	30		CIEDRN
C[C@@H]1Sc2ccccc2N(CCCCC#N)[C@H]1C	ZINC000161119692	328132835	/nfs/dbraw/zinc/13/28/35/328132835.db2.gz	ZTTHLGLRBQUXTK-STQMWFEESA-N	0	0	260.406	4.070	20	30		CIEDRN
C[C@H](C#N)CSc1ccccc1NCCC(F)(F)F	ZINC000571605680	328137535	/nfs/dbraw/zinc/13/75/35/328137535.db2.gz	DDWYBMIJTNEPQB-SNVBAGLBSA-N	0	0	288.338	4.303	20	30		CIEDRN
CC(C)(C)c1cccc(OCCSCCC#N)c1	ZINC000413013442	328139976	/nfs/dbraw/zinc/13/99/76/328139976.db2.gz	OFHQUZAKJXOPNX-UHFFFAOYSA-N	0	0	263.406	4.010	20	30		CIEDRN
CCCCCCCCNC(=O)N(C)[C@@H](C)c1ccccn1	ZINC000269967286	328191445	/nfs/dbraw/zinc/19/14/45/328191445.db2.gz	XCCASXNRMNJGFS-HNNXBMFYSA-N	0	0	291.439	4.145	20	30		CIEDRN
O=C(/C=C/c1ccc(N2CCCCC2)cc1)c1cncs1	ZINC000276198845	328217369	/nfs/dbraw/zinc/21/73/69/328217369.db2.gz	FAGXQYGBTWGWQM-RMKNXTFCSA-N	0	0	298.411	4.030	20	30		CIEDRN
CCN(C(=O)CC(C)(C)C#N)c1ccc2ccccc2c1	ZINC000278171629	328224035	/nfs/dbraw/zinc/22/40/35/328224035.db2.gz	BGRFTRDKVAVYJS-UHFFFAOYSA-N	0	0	280.371	4.133	20	30		CIEDRN
CC(C)(C)c1cnc(S[C@@H]2CC[C@@H](C#N)C2)s1	ZINC000278538140	328226844	/nfs/dbraw/zinc/22/68/44/328226844.db2.gz	JKQWJSGMTZHZAH-NXEZZACHSA-N	0	0	266.435	4.225	20	30		CIEDRN
CC(C)(C#N)CCCCN1C[C@H]2CCC(=O)c3cccc1c32	ZINC000278541714	328226910	/nfs/dbraw/zinc/22/69/10/328226910.db2.gz	AHBNDSIRIQEHBO-CQSZACIVSA-N	0	0	296.414	4.287	20	30		CIEDRN
N#C[C@H]1CC[C@H](Sc2nc3ccccc3s2)C1	ZINC000278547945	328227169	/nfs/dbraw/zinc/22/71/69/328227169.db2.gz	KZQQDRHDBUEALD-UWVGGRQHSA-N	0	0	260.387	4.081	20	30		CIEDRN
C#CCCCCC(=O)Nc1ccc(Cl)cc1Cl	ZINC000179612159	329210512	/nfs/dbraw/zinc/21/05/12/329210512.db2.gz	LMQSDWHEJCDVNK-UHFFFAOYSA-N	0	0	270.159	4.126	20	30		CIEDRN
Cc1ccc(NC(=O)c2ccc(C(C)(C)C#N)cc2)c(C)c1	ZINC000279548400	328232880	/nfs/dbraw/zinc/23/28/80/328232880.db2.gz	DEHCLGXMXRIUFR-UHFFFAOYSA-N	0	0	292.382	4.357	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)Nc1ccc(OC(C)C)cc1Cl	ZINC000285517801	328248092	/nfs/dbraw/zinc/24/80/92/328248092.db2.gz	ADAONALEPQJKFQ-HNNXBMFYSA-N	0	0	294.782	4.006	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)Nc1ncc(C2CCCCC2)s1	ZINC000285980561	328248768	/nfs/dbraw/zinc/24/87/68/328248768.db2.gz	FSEJWKCCEWPDEX-HNNXBMFYSA-N	0	0	291.420	4.069	20	30		CIEDRN
CC[C@@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)c1ccc(F)cc1[O-]	ZINC000286297171	328249466	/nfs/dbraw/zinc/24/94/66/328249466.db2.gz	WLJXZWGIHSTRKA-YVEFUNNKSA-N	0	0	298.361	4.205	20	30		CIEDRN
C[C@H](NC(=O)CCCC#N)c1ccc(-c2ccccc2)cc1	ZINC000290903766	328260935	/nfs/dbraw/zinc/26/09/35/328260935.db2.gz	FKYDWZFCTJJQGD-HNNXBMFYSA-N	0	0	292.382	4.225	20	30		CIEDRN
Cc1nc(SCc2ccccc2C(C)(C)C#N)[nH]c1C	ZINC000292550587	328271436	/nfs/dbraw/zinc/27/14/36/328271436.db2.gz	CBAJDFWWPNVFBH-UHFFFAOYSA-N	0	0	285.416	4.120	20	30		CIEDRN
Cc1nc(Sc2nc(C)c(C#N)cc2Cl)sc1C	ZINC000582878942	329284401	/nfs/dbraw/zinc/28/44/01/329284401.db2.gz	STAKXHRJVNXVFF-UHFFFAOYSA-N	0	0	295.820	4.140	20	30		CIEDRN
Cc1cc2ccccc2c(NC(=O)CC(C)(C)C#N)c1	ZINC000296002249	328288622	/nfs/dbraw/zinc/28/86/22/328288622.db2.gz	KUDVMWXYYXBDRU-UHFFFAOYSA-N	0	0	266.344	4.027	20	30		CIEDRN
COc1ccc(CS[C@H](C)CCC#N)cc1Cl	ZINC000298412726	328296263	/nfs/dbraw/zinc/29/62/63/328296263.db2.gz	WGDBFIHKKPTJAF-SNVBAGLBSA-N	0	0	269.797	4.274	20	30		CIEDRN
C=CCC[C@H]([NH2+]Cc1cccc(OCC)c1)c1ccco1	ZINC000514092969	328300824	/nfs/dbraw/zinc/30/08/24/328300824.db2.gz	HKRGWOXTLTVSSE-KRWDZBQOSA-N	0	0	285.387	4.475	20	30		CIEDRN
C[C@H]1CCN(Cc2cccc(C#N)c2)c2ccccc21	ZINC000048574361	328316127	/nfs/dbraw/zinc/31/61/27/328316127.db2.gz	WVNKMUSXZGFIEF-AWEZNQCLSA-N	0	0	262.356	4.072	20	30		CIEDRN
Cc1ccc(N[C@H](CCC#N)c2ccccc2)c([N+](=O)[O-])c1	ZINC000164327687	328336289	/nfs/dbraw/zinc/33/62/89/328336289.db2.gz	OAMZGJXXBOZOJY-OAHLLOKOSA-N	0	0	295.342	4.360	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CCC[C@H]1C(C)(C)C)c1ccccc1	ZINC000534671091	328347568	/nfs/dbraw/zinc/34/75/68/328347568.db2.gz	GZOWPHOPTJUEDV-RDJZCZTQSA-N	0	0	285.431	4.383	20	30		CIEDRN
C=C[C@H](CC(=O)N1CCC[C@@H](CCC)C1)c1ccccc1	ZINC000534720976	328359215	/nfs/dbraw/zinc/35/92/15/328359215.db2.gz	GTERPVIXJDXNPB-IAGOWNOFSA-N	0	0	285.431	4.385	20	30		CIEDRN
C=C[C@H](CC(=O)N1CC[C@H](C)C[C@@H](C)C1)c1ccccc1	ZINC000534724273	328359361	/nfs/dbraw/zinc/35/93/61/328359361.db2.gz	ZBPGGPAKVLOJSA-GVDBMIGSSA-N	0	0	285.431	4.241	20	30		CIEDRN
C=C[C@@H](CC(=O)NCC1(CCC)CC1)c1ccccc1	ZINC000534725158	328359440	/nfs/dbraw/zinc/35/94/40/328359440.db2.gz	NTGHRXFBZVLZFQ-HNNXBMFYSA-N	0	0	271.404	4.043	20	30		CIEDRN
CN(CCC#N)C(=O)Nc1ccc2c(c1)C(C)(C)CC2(C)C	ZINC000534747606	328361445	/nfs/dbraw/zinc/36/14/45/328361445.db2.gz	CAOGDUQIJCCYCX-UHFFFAOYSA-N	0	0	299.418	4.023	20	30		CIEDRN
COc1cc(C#N)ccc1O[C@H]1CCCc2ccc(F)cc21	ZINC000534799232	328362226	/nfs/dbraw/zinc/36/22/26/328362226.db2.gz	AWWCUZIWORHTSX-INIZCTEOSA-N	0	0	297.329	4.162	20	30		CIEDRN
CCCC(CCC)SCC(=O)Nc1cccc(C#N)c1	ZINC000049494601	328364215	/nfs/dbraw/zinc/36/42/15/328364215.db2.gz	UHXLNTALAVVERG-UHFFFAOYSA-N	0	0	290.432	4.199	20	30		CIEDRN
CCC(CC)[C@H](C)C(=O)Nc1sc(C)c(C)c1C#N	ZINC000534884433	328366902	/nfs/dbraw/zinc/36/69/02/328366902.db2.gz	BCGNJISMDCJCLX-JTQLQIEISA-N	0	0	278.421	4.247	20	30		CIEDRN
CC[C@H](C)n1ncc(Nc2cccc(F)c2C#N)c1C1CC1	ZINC000534979678	328372890	/nfs/dbraw/zinc/37/28/90/328372890.db2.gz	ACVONHZJVIMCDT-NSHDSACASA-N	0	0	298.365	4.486	20	30		CIEDRN
C=CCOc1ccccc1CNc1ccc(F)cc1OC	ZINC000049564174	328373485	/nfs/dbraw/zinc/37/34/85/328373485.db2.gz	SUOCXAJDYBEPPF-UHFFFAOYSA-N	0	0	287.334	4.011	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2ccccc2CCC)CC1	ZINC000111719696	328376756	/nfs/dbraw/zinc/37/67/56/328376756.db2.gz	NOCZUTYWVUQSQJ-UHFFFAOYSA-N	0	0	272.392	4.069	20	30		CIEDRN
N#CCc1ccc(NC(=O)c2csc3ccccc23)cc1	ZINC000049942949	328379589	/nfs/dbraw/zinc/37/95/89/328379589.db2.gz	ASMQPKMLRCMOAS-UHFFFAOYSA-N	0	0	292.363	4.220	20	30		CIEDRN
C=CCCSCCOc1ccccc1Br	ZINC000535067703	328383227	/nfs/dbraw/zinc/38/32/27/328383227.db2.gz	APKGYTJDJPVAEH-UHFFFAOYSA-N	0	0	287.222	4.137	20	30		CIEDRN
C=CC1CCN(C(=O)C[C@H]2CCCC(C)(C)C2)CC1	ZINC000535175407	328392825	/nfs/dbraw/zinc/39/28/25/328392825.db2.gz	SAMRSPHWKXVOGH-OAHLLOKOSA-N	0	0	263.425	4.018	20	30		CIEDRN
N#Cc1ccc(NCC2CCCC2)c(C(F)(F)F)c1	ZINC000050271648	328394579	/nfs/dbraw/zinc/39/45/79/328394579.db2.gz	MOHXQVLVLPWJRO-UHFFFAOYSA-N	0	0	268.282	4.179	20	30		CIEDRN
CCOc1cc(NCC(C)(C)CCC#N)ccc1C	ZINC000341252896	328405049	/nfs/dbraw/zinc/40/50/49/328405049.db2.gz	HMXYWRGURHVYAI-UHFFFAOYSA-N	0	0	260.381	4.136	20	30		CIEDRN
CO[C@@H](C)c1cccc(NCc2cccc(C#N)c2F)c1	ZINC000342431088	328418849	/nfs/dbraw/zinc/41/88/49/328418849.db2.gz	FCAUROJLEFZSCU-LBPRGKRZSA-N	0	0	284.334	4.017	20	30		CIEDRN
C=CCN(C(=O)C[C@H](OCC)C1=CCCC1)c1ccccc1	ZINC000342545059	328419536	/nfs/dbraw/zinc/41/95/36/328419536.db2.gz	ZIACSHQHQRYYPE-SFHVURJKSA-N	0	0	299.414	4.111	20	30		CIEDRN
C=CCCCSc1nnc(C)n1[C@@H]1CCC[C@@H](C)C1	ZINC000535333103	328440413	/nfs/dbraw/zinc/44/04/13/328440413.db2.gz	MEHJMMKBJUAZGO-TZMCWYRMSA-N	0	0	279.453	4.396	20	30		CIEDRN
CC(C)C[C@@](C)(C#N)NC(=O)C[C@@H]1CCCC(C)(C)C1	ZINC000535326747	328441521	/nfs/dbraw/zinc/44/15/21/328441521.db2.gz	ROCNQDOEUULHIW-YOEHRIQHSA-N	0	0	278.440	4.037	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@@H]1CC[C@H]2CCC[C@@H]2C1)c1ccccc1	ZINC000535386513	328449018	/nfs/dbraw/zinc/44/90/18/328449018.db2.gz	VAGPVWUDEBUNDW-NXWXRZEISA-N	0	0	297.442	4.431	20	30		CIEDRN
C=C[C@H](CC(=O)N(C)Cc1ccc(C)cc1)c1ccccc1	ZINC000535459218	328453193	/nfs/dbraw/zinc/45/31/93/328453193.db2.gz	KRTJZZVKEQVZSG-GOSISDBHSA-N	0	0	293.410	4.313	20	30		CIEDRN
CC(C)C[C@](C)(C#N)NC(=O)c1csc(Cl)c1	ZINC000330998167	328471965	/nfs/dbraw/zinc/47/19/65/328471965.db2.gz	PJIGQPJFLHBVSS-GFCCVEGCSA-N	0	0	270.785	4.034	20	30		CIEDRN
CC[C@H](C)n1ncc(NC(=O)NCC2(C)CCCC2)c1C	ZINC000331144636	328477387	/nfs/dbraw/zinc/47/73/87/328477387.db2.gz	SBFAHCCXSKIZPJ-LBPRGKRZSA-N	0	0	292.427	4.069	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1ccc(Cl)cc1SCC	ZINC000162477524	328484780	/nfs/dbraw/zinc/48/47/80/328484780.db2.gz	LYYQKHWCRPIBAZ-UHFFFAOYSA-N	0	0	283.824	4.100	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)Nc1c[nH]nc1C	ZINC000191441214	328509723	/nfs/dbraw/zinc/50/97/23/328509723.db2.gz	HOTUFQTXCLUYHU-UHFFFAOYSA-N	0	0	298.390	4.214	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)N(C)CCC	ZINC000191424606	328510902	/nfs/dbraw/zinc/51/09/02/328510902.db2.gz	KPXRGJMPWFYTTE-UHFFFAOYSA-N	0	0	274.408	4.412	20	30		CIEDRN
C[C@@H](c1ccc(C#N)cc1)N1C[C@H](C)c2ccccc21	ZINC000563774127	328512621	/nfs/dbraw/zinc/51/26/21/328512621.db2.gz	ODCJVNITRPLGMA-KBPBESRZSA-N	0	0	262.356	4.243	20	30		CIEDRN
CC#CC(=O)N(C)[C@H](c1ccc(Cl)cc1)C1CCCC1	ZINC000283816812	328516908	/nfs/dbraw/zinc/51/69/08/328516908.db2.gz	SIZMXMAHYQSCOA-KRWDZBQOSA-N	0	0	289.806	4.053	20	30		CIEDRN
Cc1csc([C@@H](C)Nc2ccc(C#N)c(Cl)c2)n1	ZINC000096474674	328532406	/nfs/dbraw/zinc/53/24/06/328532406.db2.gz	KPMOCDLPQJURSF-SECBINFHSA-N	0	0	277.780	4.150	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@@H](C)C(CC)CC	ZINC000535586249	328595045	/nfs/dbraw/zinc/59/50/45/328595045.db2.gz	TVYLUNCIZMWIAO-ZDUSSCGKSA-N	0	0	279.449	4.335	20	30		CIEDRN
C=CCS[C@H](C)c1nc(-c2ccc(C)c(F)c2)no1	ZINC000522282990	326796974	/nfs/dbraw/zinc/79/69/74/326796974.db2.gz	MKQQTDHOUXJQHQ-SNVBAGLBSA-N	0	0	278.352	4.164	20	30		CIEDRN
Cc1occc1CN(C)c1cccc(C(F)F)c1C#N	ZINC000583332562	326806934	/nfs/dbraw/zinc/80/69/34/326806934.db2.gz	LHLGQVXRAAUFHT-UHFFFAOYSA-N	0	0	276.286	4.034	20	30		CIEDRN
N#Cc1cnccc1Oc1ccc(Cl)c(Cl)c1	ZINC000399545206	326807446	/nfs/dbraw/zinc/80/74/46/326807446.db2.gz	BNIIJFOZINMATR-UHFFFAOYSA-N	0	0	265.099	4.052	20	30		CIEDRN
C=CCC(F)(F)c1nc([C@H](C)c2ccccc2C)no1	ZINC000556308508	326817069	/nfs/dbraw/zinc/81/70/69/326817069.db2.gz	MYGVQMXSNYSDOP-LLVKDONJSA-N	0	0	278.302	4.198	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)[C@@H](C)c1ccccc1F	ZINC000108961941	326817608	/nfs/dbraw/zinc/81/76/08/326817608.db2.gz	LLFYZPCPUYKTCJ-HNNXBMFYSA-N	0	0	297.373	4.144	20	30		CIEDRN
CSCc1cccc(NC(=O)Nc2ccc(C#N)cc2)c1	ZINC000109353258	326841199	/nfs/dbraw/zinc/84/11/99/326841199.db2.gz	JGRGNNXWKUDFFC-UHFFFAOYSA-N	0	0	297.383	4.065	20	30		CIEDRN
N#Cc1ccccc1CSc1ccc2c(c1)CCC2	ZINC000037329307	326846028	/nfs/dbraw/zinc/84/60/28/326846028.db2.gz	BBACHJGSTCKJLD-UHFFFAOYSA-N	0	0	265.381	4.339	20	30		CIEDRN
N#Cc1ccc(NC2CCCCC2)c(C(F)(F)F)c1	ZINC000036973670	326875152	/nfs/dbraw/zinc/87/51/52/326875152.db2.gz	LAMDYVKYTXWYPR-UHFFFAOYSA-N	0	0	268.282	4.322	20	30		CIEDRN
N#Cc1ccc(Cl)cc1NCc1ccc(F)c(F)c1	ZINC000036954259	326877248	/nfs/dbraw/zinc/87/72/48/326877248.db2.gz	WUZJQTAWISCDFY-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
CCCc1cc(C(=O)Nc2cc(C#N)ccc2C)sc1C	ZINC000530593964	326881409	/nfs/dbraw/zinc/88/14/09/326881409.db2.gz	NSSDOKGDLMFJGV-UHFFFAOYSA-N	0	0	298.411	4.441	20	30		CIEDRN
CC(C)Oc1cccc(OCCCC(C)(C)C#N)c1	ZINC000533674801	326900443	/nfs/dbraw/zinc/90/04/43/326900443.db2.gz	KGZQEMLSYQQUME-UHFFFAOYSA-N	0	0	261.365	4.183	20	30		CIEDRN
C=C(C)CCSc1nc(C(F)(F)F)ccc1C#N	ZINC000506383260	332771491	/nfs/dbraw/zinc/77/14/91/332771491.db2.gz	SVJSUDULULMFIN-UHFFFAOYSA-N	0	0	272.295	4.030	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@H]1CCCC(C)(C)C1	ZINC000533701761	326910281	/nfs/dbraw/zinc/91/02/81/326910281.db2.gz	IUMWMTKTRXSDOM-AWEZNQCLSA-N	0	0	291.460	4.479	20	30		CIEDRN
C=CCC(C)(C)c1noc(CCc2c[nH]c3ccccc23)n1	ZINC000556361129	326923551	/nfs/dbraw/zinc/92/35/51/326923551.db2.gz	GCBLVWLOIDTIQB-UHFFFAOYSA-N	0	0	295.386	4.190	20	30		CIEDRN
CC[C@@H](C)[C@H]1CCCCN1c1nccc(C#N)c1Cl	ZINC000553184689	326930309	/nfs/dbraw/zinc/93/03/09/326930309.db2.gz	JMOAZBFWRMPEHN-DGCLKSJQSA-N	0	0	277.799	4.012	20	30		CIEDRN
Cc1cc(Br)ccc1OCCC(C)(C)C#N	ZINC000087592242	326942458	/nfs/dbraw/zinc/94/24/58/326942458.db2.gz	QNHJBDLRUGOPOG-UHFFFAOYSA-N	0	0	282.181	4.076	20	30		CIEDRN
CC(C)(C#N)CCOc1ccc(Cl)cc1Cl	ZINC000087595926	326943422	/nfs/dbraw/zinc/94/34/22/326943422.db2.gz	DBDFKCHBLOJIBS-UHFFFAOYSA-N	0	0	258.148	4.312	20	30		CIEDRN
Cc1c2cc(C#N)ccc2sc1C(=O)N1[C@@H](C)CC[C@@H]1C	ZINC000556623777	326954792	/nfs/dbraw/zinc/95/47/92/326954792.db2.gz	QFWOJXHOIWLUHS-QWRGUYRKSA-N	0	0	298.411	4.094	20	30		CIEDRN
Cc1cc(OCCCC(C)(C)C#N)c(C)c(C)c1C#N	ZINC000312760955	326962620	/nfs/dbraw/zinc/96/26/20/326962620.db2.gz	KMRCSOCQEFNOMQ-UHFFFAOYSA-N	0	0	270.376	4.192	20	30		CIEDRN
C=CCN(CC(F)(F)F)C(=O)CCCCC(C)(C)C	ZINC000557471581	327007531	/nfs/dbraw/zinc/00/75/31/327007531.db2.gz	OPYMEOWIFBEMNH-UHFFFAOYSA-N	0	0	279.346	4.170	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@@H]1CCC[C@H]2CCCC[C@@H]21	ZINC000557034830	326990103	/nfs/dbraw/zinc/99/01/03/326990103.db2.gz	VXLPYYOHCXILME-FXUDXRNXSA-N	0	0	263.425	4.064	20	30		CIEDRN
CNc1ccc(C#N)cc1NC(=O)[C@@H](C)CC1CCCCC1	ZINC000557061746	326991802	/nfs/dbraw/zinc/99/18/02/326991802.db2.gz	NTXHYEAQOFFCQW-ZDUSSCGKSA-N	0	0	299.418	4.145	20	30		CIEDRN
C=CCN(C(=O)Nc1cccc(O[C@@H](C)CC)c1)C1CC1	ZINC000557243394	326998458	/nfs/dbraw/zinc/99/84/58/326998458.db2.gz	UTSOEHPXKKSLDY-ZDUSSCGKSA-N	0	0	288.391	4.046	20	30		CIEDRN
C=C(CC)CS[C@H](C)C(=O)Nc1ccc(C)c(C)c1	ZINC000557306485	327001057	/nfs/dbraw/zinc/00/10/57/327001057.db2.gz	YWIGMDGRSPYNFB-CQSZACIVSA-N	0	0	277.433	4.330	20	30		CIEDRN
Cc1ccc(C(=O)N(CCC#N)C(C)C)c(Cl)c1Cl	ZINC000575984695	327005709	/nfs/dbraw/zinc/00/57/09/327005709.db2.gz	JQKYMVXEPCMPIA-UHFFFAOYSA-N	0	0	299.201	4.066	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(Cc2c(F)cccc2F)no1	ZINC000557510086	327010779	/nfs/dbraw/zinc/01/07/79/327010779.db2.gz	UAHGTXFVCXMHTO-JTQLQIEISA-N	0	0	278.302	4.008	20	30		CIEDRN
Cc1nsc(NCc2ccc3ccccc3c2)c1C#N	ZINC000557525085	327011689	/nfs/dbraw/zinc/01/16/89/327011689.db2.gz	BWMFXUXJEYPZEY-UHFFFAOYSA-N	0	0	279.368	4.089	20	30		CIEDRN
Cc1ccc(C#N)c(Nc2csc3ccccc23)n1	ZINC000557644820	327018897	/nfs/dbraw/zinc/01/88/97/327018897.db2.gz	QXXGEEYSJIYIJG-UHFFFAOYSA-N	0	0	265.341	4.220	20	30		CIEDRN
CCCc1ccccc1NCc1ccc(OC)c(C#N)c1	ZINC000087823338	327022475	/nfs/dbraw/zinc/02/24/75/327022475.db2.gz	SYZRLIZKMIQLON-UHFFFAOYSA-N	0	0	280.371	4.131	20	30		CIEDRN
CC(C)(C)CCCCC(=O)N1CCc2ccc(C#N)cc21	ZINC000553434406	327023469	/nfs/dbraw/zinc/02/34/69/327023469.db2.gz	AGSBWLGEKLRSPJ-UHFFFAOYSA-N	0	0	284.403	4.054	20	30		CIEDRN
CC(C)(CCC#N)CNC(=O)CCCC1CCCCC1	ZINC000557998293	327039908	/nfs/dbraw/zinc/03/99/08/327039908.db2.gz	VPYPHHCCSVWXGE-UHFFFAOYSA-N	0	0	278.440	4.183	20	30		CIEDRN
C[C@@H](CC1CCCCC1)C(=O)NCC(C)(C)CCC#N	ZINC000557997336	327039987	/nfs/dbraw/zinc/03/99/87/327039987.db2.gz	QGHGQCGPDRQKQY-AWEZNQCLSA-N	0	0	278.440	4.039	20	30		CIEDRN
CC(C)(C)CCCCC(=O)N1CCCC(C)(C)[C@H]1C#N	ZINC000584118539	327042641	/nfs/dbraw/zinc/04/26/41/327042641.db2.gz	ZOKRLGNARCDYQP-CQSZACIVSA-N	0	0	278.440	4.134	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCC(C)(C)c1ccccc1Cl	ZINC000584127031	327047123	/nfs/dbraw/zinc/04/71/23/327047123.db2.gz	JAOYIUQLSCODSL-UHFFFAOYSA-N	0	0	293.838	4.336	20	30		CIEDRN
C=CCNc1cccc(COCc2ccc(OC)cc2)c1	ZINC000558043409	327048601	/nfs/dbraw/zinc/04/86/01/327048601.db2.gz	ZRWYFFBOVBBBEC-UHFFFAOYSA-N	0	0	283.371	4.010	20	30		CIEDRN
CC1(C)Cc2cccc(NCc3ccc(C#N)c(F)c3)c2O1	ZINC000584207080	327063730	/nfs/dbraw/zinc/06/37/30/327063730.db2.gz	CKQRGZRLGBZVAO-UHFFFAOYSA-N	0	0	296.345	4.023	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(Cc2cc(C)ccc2C)no1	ZINC000558296231	327086058	/nfs/dbraw/zinc/08/60/58/327086058.db2.gz	OWIYOSGHSRXZBO-QGZVFWFLSA-N	0	0	270.376	4.131	20	30		CIEDRN
C=CCCC1(C(=O)N2CCC[C@@H](c3ccccc3)C2)CC1	ZINC000558299851	327086153	/nfs/dbraw/zinc/08/61/53/327086153.db2.gz	BQJFSUXAPPBSKI-QGZVFWFLSA-N	0	0	283.415	4.139	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(Cc2c[nH]c3cccc(C)c23)no1	ZINC000558326946	327087193	/nfs/dbraw/zinc/08/71/93/327087193.db2.gz	DSXYZHZVDKPRFX-GOSISDBHSA-N	0	0	295.386	4.304	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(-c2ccc(OCC)c(F)c2)no1	ZINC000558385498	327089971	/nfs/dbraw/zinc/08/99/71/327089971.db2.gz	COLZHTGYYQKYIN-INIZCTEOSA-N	0	0	290.338	4.128	20	30		CIEDRN
C=CCCCCNC(=O)NCc1ccc2sccc2c1	ZINC000558605811	327108470	/nfs/dbraw/zinc/10/84/70/327108470.db2.gz	FCMSCCDWSCXBGB-UHFFFAOYSA-N	0	0	288.416	4.057	20	30		CIEDRN
CC(C)CCc1ccc(NCc2cc(C#N)n(C)c2)cc1	ZINC000558756916	327119288	/nfs/dbraw/zinc/11/92/88/327119288.db2.gz	FCVHAPUJSWULMZ-UHFFFAOYSA-N	0	0	281.403	4.097	20	30		CIEDRN
N#Cc1cccc(CN2CC3(CCC3)c3c2cccc3F)c1	ZINC000558779558	327120175	/nfs/dbraw/zinc/12/01/75/327120175.db2.gz	OPNQKJYOYWFDSS-UHFFFAOYSA-N	0	0	292.357	4.139	20	30		CIEDRN
C=C(C)CCSCc1ccc(-n2ccnc2)cc1	ZINC000507109147	332787050	/nfs/dbraw/zinc/78/70/50/332787050.db2.gz	BCRZUVHINLXPPL-UHFFFAOYSA-N	0	0	258.390	4.072	20	30		CIEDRN
C[C@H]1C[C@@H]1c1ccc(CNc2cccc(CC#N)c2)o1	ZINC000313448093	327131411	/nfs/dbraw/zinc/13/14/11/327131411.db2.gz	MRPWKRXDKGOWJQ-LRDDRELGSA-N	0	0	266.344	4.081	20	30		CIEDRN
C=C[C@H]1CCCCN1c1ncc(C)c(-c2ccccc2F)n1	ZINC000558946404	327133999	/nfs/dbraw/zinc/13/39/99/327133999.db2.gz	GQUMWPLWTJTYQH-AWEZNQCLSA-N	0	0	297.377	4.136	20	30		CIEDRN
C=CCn1c(SCC2(C)CCC2)nnc1-c1ccco1	ZINC000559193619	327145603	/nfs/dbraw/zinc/14/56/03/327145603.db2.gz	JESSZICIKMCQSX-UHFFFAOYSA-N	0	0	289.404	4.006	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc(OC(C)C)cc1F	ZINC000559349579	327163465	/nfs/dbraw/zinc/16/34/65/327163465.db2.gz	XQUJLYJZDZGBAM-UHFFFAOYSA-N	0	0	279.355	4.154	20	30		CIEDRN
CC[C@H]1CCC[C@H]1Nc1cccc(OCCCC#N)c1	ZINC000165147065	327163481	/nfs/dbraw/zinc/16/34/81/327163481.db2.gz	CUHXVLDNSDIVAK-WMLDXEAASA-N	0	0	272.392	4.360	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1c(F)cccc1SC	ZINC000409735976	327164602	/nfs/dbraw/zinc/16/46/02/327164602.db2.gz	FWXBGPYPKKRHHD-UHFFFAOYSA-N	0	0	295.423	4.366	20	30		CIEDRN
C=CCCc1ccccc1NCc1csc([N+](=O)[O-])c1	ZINC000409860590	327166210	/nfs/dbraw/zinc/16/62/10/327166210.db2.gz	UWBSGGAZVNWPQB-UHFFFAOYSA-N	0	0	288.372	4.387	20	30		CIEDRN
C=CCCc1ccccc1NCc1cc(C(=O)OC)c(C)o1	ZINC000409851373	327166434	/nfs/dbraw/zinc/16/64/34/327166434.db2.gz	ZYVBDLIJOXYMHY-UHFFFAOYSA-N	0	0	299.370	4.105	20	30		CIEDRN
Cc1cc(CSCC2(C#N)CC2)ccc1Br	ZINC000409853782	327166713	/nfs/dbraw/zinc/16/67/13/327166713.db2.gz	GOOJPCJAZJTGIC-UHFFFAOYSA-N	0	0	296.233	4.295	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)CC1(C)CCCC1	ZINC000569382634	327170743	/nfs/dbraw/zinc/17/07/43/327170743.db2.gz	ZAJJBGYZQPWTTC-UHFFFAOYSA-N	0	0	271.404	4.172	20	30		CIEDRN
Cc1cc(F)cc(N[C@H](C)c2ccc(C#N)cc2)c1	ZINC000091510815	327170780	/nfs/dbraw/zinc/17/07/80/327170780.db2.gz	IRESWPYJNWQBAK-GFCCVEGCSA-N	0	0	254.308	4.179	20	30		CIEDRN
C=C(C)CCc1noc(-c2coc3cc(F)ccc23)n1	ZINC000569390756	327171781	/nfs/dbraw/zinc/17/17/81/327171781.db2.gz	SYEHKMZSYBDYQT-UHFFFAOYSA-N	0	0	272.279	4.131	20	30		CIEDRN
C=C(C)CCSCc1cccc(-n2cccn2)c1	ZINC000507095221	332786330	/nfs/dbraw/zinc/78/63/30/332786330.db2.gz	ZOEIJDLGTVJBHK-UHFFFAOYSA-N	0	0	258.390	4.072	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@@H](C)CCCc1ccccc1	ZINC000410128229	327179733	/nfs/dbraw/zinc/17/97/33/327179733.db2.gz	QYBFBYGZYRNSSY-RDJZCZTQSA-N	0	0	273.420	4.116	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)[C@H](C)Sc1ccc(Cl)cc1	ZINC000410128668	327179881	/nfs/dbraw/zinc/17/98/81/327179881.db2.gz	UKULTSXZPYEQRR-WCQYABFASA-N	0	0	297.851	4.292	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)C[C@@H](CC)c1ccc(OC)cc1	ZINC000410128946	327180005	/nfs/dbraw/zinc/18/00/05/327180005.db2.gz	WGKVFLMZRFIWHB-GDBMZVCRSA-N	0	0	289.419	4.050	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1coc2cc(C)c(C)cc21	ZINC000410131033	327180138	/nfs/dbraw/zinc/18/01/38/327180138.db2.gz	PATHXRNWNVCPNS-ZDUSSCGKSA-N	0	0	271.360	4.134	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1cccc(OC2CCCC2)c1	ZINC000410131083	327180246	/nfs/dbraw/zinc/18/02/46/327180246.db2.gz	PQMJLGMDGVYTKS-OAHLLOKOSA-N	0	0	287.403	4.093	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)CCc1ccc(-c2ccccc2)o1	ZINC000410147478	327181585	/nfs/dbraw/zinc/18/15/85/327181585.db2.gz	KZSLKJPINSWEDY-MRXNPFEDSA-N	0	0	297.398	4.350	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)CCc1ccc(-c2ccccc2)o1	ZINC000410147477	327181700	/nfs/dbraw/zinc/18/17/00/327181700.db2.gz	KZSLKJPINSWEDY-INIZCTEOSA-N	0	0	297.398	4.350	20	30		CIEDRN
N#Cc1cc(Nc2ccc(SC3CCCC3)cc2)ncn1	ZINC000520949333	327190077	/nfs/dbraw/zinc/19/00/77/327190077.db2.gz	FFQSJPONEVBTSM-UHFFFAOYSA-N	0	0	296.399	4.127	20	30		CIEDRN
C=CCC1(c2nc(-c3cccc4cnccc43)no2)CCC1	ZINC000569526560	327192082	/nfs/dbraw/zinc/19/20/82/327192082.db2.gz	BUOPXYZBVDOOFF-UHFFFAOYSA-N	0	0	291.354	4.283	20	30		CIEDRN
CC(C)(Sc1ccc(C#N)c([N+](=O)[O-])c1)c1ccccc1	ZINC000569537748	327195030	/nfs/dbraw/zinc/19/50/30/327195030.db2.gz	MLJBHTVYVBWUEP-UHFFFAOYSA-N	0	0	298.367	4.494	20	30		CIEDRN
CC(C)C[C@@](C)(C#N)NC(=O)CCCC1CCCCC1	ZINC000533876956	327229805	/nfs/dbraw/zinc/22/98/05/327229805.db2.gz	YCJQDWHTHBRXLN-KRWDZBQOSA-N	0	0	278.440	4.182	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)C[C@@H]1CCCC[C@@H]1C	ZINC000531070098	327238888	/nfs/dbraw/zinc/23/88/88/327238888.db2.gz	HFEOPVQSZCRMLM-WFASDCNBSA-N	0	0	270.376	4.022	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCc1ccc(C2CCC2)cc1	ZINC000507133650	332789937	/nfs/dbraw/zinc/78/99/37/332789937.db2.gz	CABHIIHOAQPHSC-UHFFFAOYSA-N	0	0	271.404	4.173	20	30		CIEDRN
C=C(C)CCS[C@H](C)c1cn(-c2ccccc2)nn1	ZINC000507134332	332789982	/nfs/dbraw/zinc/78/99/82/332789982.db2.gz	LMWHYIADNGVAOP-CYBMUJFWSA-N	0	0	273.405	4.028	20	30		CIEDRN
CC[C@@H](C)[C@@H]1CCCCN1C(=O)Nc1cc(C#N)ccc1C	ZINC000531080828	327240755	/nfs/dbraw/zinc/24/07/55/327240755.db2.gz	KDUWTRKNGRMZEJ-DYVFJYSZSA-N	0	0	299.418	4.299	20	30		CIEDRN
Cc1ccc(Cl)c(NC(=O)Cc2cccc(C#N)c2)c1C	ZINC000559513392	327251965	/nfs/dbraw/zinc/25/19/65/327251965.db2.gz	JYRQBBSNCIXUQL-UHFFFAOYSA-N	0	0	298.773	4.010	20	30		CIEDRN
CC[C@@H](CC(=O)N[C@@](C)(C#N)CC(C)C)c1ccccc1	ZINC000559575467	327254118	/nfs/dbraw/zinc/25/41/18/327254118.db2.gz	UYWPTPFAVUYJJN-MAUKXSAKSA-N	0	0	286.419	4.015	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc([C@@H](OCC)c2ccccc2)no1	ZINC000573763943	327256295	/nfs/dbraw/zinc/25/62/95/327256295.db2.gz	UJWJRLBFJFJAPJ-ZFWWWQNUSA-N	0	0	286.375	4.265	20	30		CIEDRN
C=C[C@@H](CC(=O)N1C[C@H](C)c2ccccc21)c1ccccc1	ZINC000559667239	327257358	/nfs/dbraw/zinc/25/73/58/327257358.db2.gz	WOPNETNRSLPFLV-HOTGVXAUSA-N	0	0	291.394	4.497	20	30		CIEDRN
CC1CC(C#N)(C(=O)N2C[C@@H](C(C)(C)C)c3ccccc32)C1	ZINC000559840393	327265040	/nfs/dbraw/zinc/26/50/40/327265040.db2.gz	QBLXBOKZFQWMMU-SHBDPFAUSA-N	0	0	296.414	4.103	20	30		CIEDRN
C=CC[C@H](C)[C@@H](C)Nc1ccc([C@H]2CCOC2)cc1	ZINC000559896842	327269392	/nfs/dbraw/zinc/26/93/92/327269392.db2.gz	BNNRWGHYSDKTOC-LZWOXQAQSA-N	0	0	259.393	4.203	20	30		CIEDRN
C=CCC(F)(F)c1nc(-c2cccc(OCCC)c2)no1	ZINC000559944190	327272809	/nfs/dbraw/zinc/27/28/09/327272809.db2.gz	SGFVSPSWOFPLFS-UHFFFAOYSA-N	0	0	294.301	4.193	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H]1C[C@@H]1c1c(F)cccc1Cl	ZINC000559963559	327274356	/nfs/dbraw/zinc/27/43/56/327274356.db2.gz	OOUBCSRNNDDFDS-GXFFZTMASA-N	0	0	295.785	4.054	20	30		CIEDRN
C=CCC(C)(C)c1noc(C[C@@H](C)c2ccc(F)cc2)n1	ZINC000560025128	327278185	/nfs/dbraw/zinc/27/81/85/327278185.db2.gz	ZHFYFDXBWLKFIZ-GFCCVEGCSA-N	0	0	288.366	4.409	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H]2CC[C@@H](C(F)(F)F)C2)n1	ZINC000560023996	327278289	/nfs/dbraw/zinc/27/82/89/327278289.db2.gz	RMCWRSMYPIYMAZ-NXEZZACHSA-N	0	0	288.313	4.369	20	30		CIEDRN
CC(C)(C#N)c1ccc(-c2nc(CC3CCCC3)no2)cc1	ZINC000560033147	327279011	/nfs/dbraw/zinc/27/90/11/327279011.db2.gz	CSESYUKNZXOQEC-UHFFFAOYSA-N	0	0	295.386	4.270	20	30		CIEDRN
C=CCN(C/C=C/c1ccc(F)c(F)c1)CC(F)(F)F	ZINC000577986268	327292634	/nfs/dbraw/zinc/29/26/34/327292634.db2.gz	ZMFKXSJBWHIENO-ONEGZZNKSA-N	0	0	291.263	4.028	20	30		CIEDRN
C=CCCCCNc1ccc(F)cc1OC1CCOCC1	ZINC000560340240	327300214	/nfs/dbraw/zinc/30/02/14/327300214.db2.gz	ASKFOVBSBVVQEM-UHFFFAOYSA-N	0	0	293.382	4.152	20	30		CIEDRN
C=CCCCCCNC(=O)c1cc(C)oc1C(F)(F)F	ZINC000569617982	327323919	/nfs/dbraw/zinc/32/39/19/327323919.db2.gz	AJISLAJQXZAOMD-UHFFFAOYSA-N	0	0	289.297	4.083	20	30		CIEDRN
CC(F)(F)CCNc1c(C#N)cnc2c(Cl)cccc21	ZINC000583378120	327333595	/nfs/dbraw/zinc/33/35/95/327333595.db2.gz	INFZTWIRCZFIKE-UHFFFAOYSA-N	0	0	295.720	4.217	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1cccc(O[C@H](C)CC)c1	ZINC000560744449	327340699	/nfs/dbraw/zinc/34/06/99/327340699.db2.gz	QVHWDMICLDYCAQ-CQSZACIVSA-N	0	0	290.407	4.294	20	30		CIEDRN
Cc1cc(N2CCC[C@@H](c3ccccc3)CC2)cc(C#N)n1	ZINC000561188539	327372459	/nfs/dbraw/zinc/37/24/59/327372459.db2.gz	APZCGVDWBUNMJI-QGZVFWFLSA-N	0	0	291.398	4.036	20	30		CIEDRN
Cc1ccc(Cl)c(NCc2cccc(F)c2C#N)c1	ZINC000427432064	327376041	/nfs/dbraw/zinc/37/60/41/327376041.db2.gz	QCJVNLHAQXSCSK-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
Cc1c2ccsc2nc(-c2ccc(F)cc2)c1C#N	ZINC000427439486	327377434	/nfs/dbraw/zinc/37/74/34/327377434.db2.gz	QZQHJQWRYMAQRB-UHFFFAOYSA-N	0	0	268.316	4.283	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H]2CCC(=O)c3ccccc32)n1	ZINC000561284301	327382666	/nfs/dbraw/zinc/38/26/66/327382666.db2.gz	NSMPNITWCXBHPR-CQSZACIVSA-N	0	0	296.370	4.032	20	30		CIEDRN
C=C(C)[C@@H](Nc1ccc(F)cn1)c1ccc(F)c(F)c1	ZINC000561295129	327383313	/nfs/dbraw/zinc/38/33/13/327383313.db2.gz	LBHHQSUAOQLMPA-OAHLLOKOSA-N	0	0	278.277	4.228	20	30		CIEDRN
CC#CCCSc1nnc(CCC2CCCCC2)o1	ZINC000155286766	327391409	/nfs/dbraw/zinc/39/14/09/327391409.db2.gz	MSJLMFVYTRMJIB-UHFFFAOYSA-N	0	0	278.421	4.088	20	30		CIEDRN
C=CCCCCCN(C)Cc1ncc(C(C)(C)C)o1	ZINC000150877740	327394205	/nfs/dbraw/zinc/39/42/05/327394205.db2.gz	LJQPKSYHFGVVIO-UHFFFAOYSA-N	0	0	264.413	4.150	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CCCc2ccc(C)cc21	ZINC000561533090	327401283	/nfs/dbraw/zinc/40/12/83/327401283.db2.gz	DSQWOMBONOPDKN-RHSMWYFYSA-N	0	0	271.404	4.091	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)Nc1cc(Cl)c(C)c(Cl)c1	ZINC000561724165	327413381	/nfs/dbraw/zinc/41/33/81/327413381.db2.gz	YJVNVNGHRQXPPW-CYBMUJFWSA-N	0	0	285.174	4.180	20	30		CIEDRN
CC(C)(CCC#N)CNc1ccc(OC(F)F)c(F)c1	ZINC000156890616	327418317	/nfs/dbraw/zinc/41/83/17/327418317.db2.gz	FVQKUIMSABRKMW-UHFFFAOYSA-N	0	0	286.297	4.169	20	30		CIEDRN
C=C(C)CCc1noc(/C=C\c2cc(F)c(F)c(F)c2)n1	ZINC000561930322	327430922	/nfs/dbraw/zinc/43/09/22/327430922.db2.gz	VVXGFIATNOLSRB-XQRVVYSFSA-N	0	0	294.276	4.166	20	30		CIEDRN
CC1(C)Cc2cccc(N[C@H](C#N)C3CCCCC3)c2O1	ZINC000562304652	327465582	/nfs/dbraw/zinc/46/55/82/327465582.db2.gz	OSSGDNNKAPOVGC-MRXNPFEDSA-N	0	0	284.403	4.284	20	30		CIEDRN
CCSCc1cccc(NCc2cccc(C#N)c2)c1	ZINC000151554584	327477084	/nfs/dbraw/zinc/47/70/84/327477084.db2.gz	MRVMRAUCFSZFLT-UHFFFAOYSA-N	0	0	282.412	4.423	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2cc(C)ccc2F)no1	ZINC000569649138	327530544	/nfs/dbraw/zinc/53/05/44/327530544.db2.gz	VMDKHKZBLAXTAM-NSHDSACASA-N	0	0	260.312	4.254	20	30		CIEDRN
N#CCCC1CCN(C(=O)c2ccc(C3CCC3)cc2)CC1	ZINC000569695858	327536698	/nfs/dbraw/zinc/53/66/98/327536698.db2.gz	AVORENFLQXBGEH-UHFFFAOYSA-N	0	0	296.414	4.110	20	30		CIEDRN
Cc1oc2ccccc2c1CN(CCC#N)Cc1ccco1	ZINC000159588926	327544386	/nfs/dbraw/zinc/54/43/86/327544386.db2.gz	JJCFPDFTDZHTFU-UHFFFAOYSA-N	0	0	294.354	4.250	20	30		CIEDRN
C=C(C)CCNc1cc(NC(=O)CCC)ccc1Cl	ZINC000569885461	327553946	/nfs/dbraw/zinc/55/39/46/327553946.db2.gz	IKSLZUYXFPUTKX-UHFFFAOYSA-N	0	0	280.799	4.457	20	30		CIEDRN
Cc1cn(Cc2nc(C3CCCCC3)cs2)cc1C#N	ZINC000570269192	327580439	/nfs/dbraw/zinc/58/04/39/327580439.db2.gz	RTOAGPHKRITGGQ-UHFFFAOYSA-N	0	0	285.416	4.221	20	30		CIEDRN
C[C@H](Nc1ccc(C#N)nc1)c1ccc(F)c2ccccc21	ZINC000570337205	327584645	/nfs/dbraw/zinc/58/46/45/327584645.db2.gz	RJDYVZFKYCWWLZ-LBPRGKRZSA-N	0	0	291.329	4.419	20	30		CIEDRN
CC[C@](C)(C#N)c1nc(C(C)(C)C2CCCCC2)no1	ZINC000570435305	327590976	/nfs/dbraw/zinc/59/09/76/327590976.db2.gz	HINQVDNXYSAGHI-MRXNPFEDSA-N	0	0	275.396	4.119	20	30		CIEDRN
Cc1noc(C)c1CCS[C@@H](C)c1ccc(C#N)cc1	ZINC000160143940	327596484	/nfs/dbraw/zinc/59/64/84/327596484.db2.gz	AVIMNYIPFQVTNV-ZDUSSCGKSA-N	0	0	286.400	4.200	20	30		CIEDRN
CC[C@@H](CC#N)NC(=O)c1cc(C)c(-c2ccccc2)s1	ZINC000570697008	327611818	/nfs/dbraw/zinc/61/18/18/327611818.db2.gz	UJKFRSVCQKVBKE-AWEZNQCLSA-N	0	0	298.411	4.146	20	30		CIEDRN
CCC[C@H](C#N)NC(=O)C/C=C/c1ccc(C(C)C)cc1	ZINC000535730068	328620842	/nfs/dbraw/zinc/62/08/42/328620842.db2.gz	FBWGVOBDFCRWBC-QQOXCAACSA-N	0	0	284.403	4.022	20	30		CIEDRN
CCCOc1cccc(CNc2ccc(F)c(C#N)c2)c1	ZINC000051636167	328626467	/nfs/dbraw/zinc/62/64/67/328626467.db2.gz	MZPVOQOBSIGYSY-UHFFFAOYSA-N	0	0	284.334	4.098	20	30		CIEDRN
N#Cc1cc(NC(=O)c2csc3ccccc32)ccc1F	ZINC000051637468	328626501	/nfs/dbraw/zinc/62/65/01/328626501.db2.gz	MFNYBQHTPOIRPW-UHFFFAOYSA-N	0	0	296.326	4.164	20	30		CIEDRN
CCc1ccc(NC(=O)CCc2ccc(C#N)cc2)cc1C	ZINC000535807024	328637858	/nfs/dbraw/zinc/63/78/58/328637858.db2.gz	SDPAXHNVONQLEH-UHFFFAOYSA-N	0	0	292.382	4.000	20	30		CIEDRN
Cc1ccc([C@@H]2CCCN2c2ccc(C#N)cc2)s1	ZINC000114710627	328656061	/nfs/dbraw/zinc/65/60/61/328656061.db2.gz	JFLCYBXYDYPBLM-HNNXBMFYSA-N	0	0	268.385	4.270	20	30		CIEDRN
Cc1ccc(NCc2cccc(C#N)c2)cc1OC(F)F	ZINC000114777178	328657548	/nfs/dbraw/zinc/65/75/48/328657548.db2.gz	UOIITRNVARBITO-UHFFFAOYSA-N	0	0	288.297	4.080	20	30		CIEDRN
Cc1ccc(OCCCOc2ccc(C#N)cc2)cc1C	ZINC000034653038	328684165	/nfs/dbraw/zinc/68/41/65/328684165.db2.gz	ZFLBPHHKUVINNU-UHFFFAOYSA-N	0	0	281.355	4.023	20	30		CIEDRN
Cc1cccc(C)c1OCCCOc1cccc(C#N)c1	ZINC000034674934	328685456	/nfs/dbraw/zinc/68/54/56/328685456.db2.gz	SCPXKIORZGSZQJ-UHFFFAOYSA-N	0	0	281.355	4.023	20	30		CIEDRN
CCc1ccc(N[C@@H](C)c2ccc(C#N)cc2)cc1F	ZINC000507597473	332816145	/nfs/dbraw/zinc/81/61/45/332816145.db2.gz	MZVLHVHNZHSQND-LBPRGKRZSA-N	0	0	268.335	4.433	20	30		CIEDRN
CC[C@H](Cc1ccccc1)Nc1ccc(CC#N)cc1	ZINC000116384482	328694161	/nfs/dbraw/zinc/69/41/61/328694161.db2.gz	FRSVXGRQYQVRAD-QGZVFWFLSA-N	0	0	264.372	4.186	20	30		CIEDRN
CC(C)(C#N)c1ccccc1COc1cccc(F)c1	ZINC000532261065	328711823	/nfs/dbraw/zinc/71/18/23/328711823.db2.gz	FSZQCWFXCNOPRV-UHFFFAOYSA-N	0	0	269.319	4.206	20	30		CIEDRN
CCc1cccc(CC)c1NC(=O)c1cccc(CC#N)c1	ZINC000042212618	328762203	/nfs/dbraw/zinc/76/22/03/328762203.db2.gz	ZEPWRNNNTYRXDL-UHFFFAOYSA-N	0	0	292.382	4.130	20	30		CIEDRN
CC[C@](C)(C#N)NC(=O)CC1CCC(C(C)(C)C)CC1	ZINC000532469819	328781219	/nfs/dbraw/zinc/78/12/19/328781219.db2.gz	WSRKIJQZCWGLIJ-MQBCKMQZSA-N	0	0	278.440	4.037	20	30		CIEDRN
CCSc1cccc(NCc2ccc(C#N)cc2F)c1	ZINC000532563369	328790298	/nfs/dbraw/zinc/79/02/98/328790298.db2.gz	CGIQCSRGBOGKSO-UHFFFAOYSA-N	0	0	286.375	4.421	20	30		CIEDRN
C=CCS[C@@H](C)c1ccc(Br)cc1	ZINC000379381050	328803980	/nfs/dbraw/zinc/80/39/80/328803980.db2.gz	GBXJBQHIXDJMMK-VIFPVBQESA-N	0	0	257.196	4.429	20	30		CIEDRN
COc1cc(C)c([C@H](C)Nc2ccc(C#N)cc2)cc1OC	ZINC000301111631	328826267	/nfs/dbraw/zinc/82/62/67/328826267.db2.gz	OWSWJWHLTVOPGX-ZDUSSCGKSA-N	0	0	296.370	4.057	20	30		CIEDRN
C=C(C)CCS[C@H](C)C(=O)Nc1cc(F)ccc1C	ZINC000507817967	332826155	/nfs/dbraw/zinc/82/61/55/332826155.db2.gz	BFBKKPNLTSSGQY-GFCCVEGCSA-N	0	0	281.396	4.161	20	30		CIEDRN
C=C(C)CCSCC(=O)Nc1ccc(SC)cc1	ZINC000507820188	332826453	/nfs/dbraw/zinc/82/64/53/332826453.db2.gz	XINOPEZRVJBZPL-UHFFFAOYSA-N	0	0	281.446	4.046	20	30		CIEDRN
C=C(C)CCS[C@H](C)C(=O)Nc1cccc(SC)c1	ZINC000507823304	332826461	/nfs/dbraw/zinc/82/64/61/332826461.db2.gz	KLCDTCLNDYIMND-GFCCVEGCSA-N	0	0	295.473	4.435	20	30		CIEDRN
N#Cc1csc(CNc2cccnc2-c2ccccc2)c1	ZINC000357715525	328875151	/nfs/dbraw/zinc/87/51/51/328875151.db2.gz	XRPYKKCQZGBUGT-UHFFFAOYSA-N	0	0	291.379	4.294	20	30		CIEDRN
C=C(C)CCS[C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000507833055	332826972	/nfs/dbraw/zinc/82/69/72/332826972.db2.gz	IQKYBWJXDQYOPH-NSHDSACASA-N	0	0	251.351	4.355	20	30		CIEDRN
C=C(C)CCS[C@H](C)C(=O)Nc1ccccc1OCC	ZINC000507863036	332828129	/nfs/dbraw/zinc/82/81/29/332828129.db2.gz	VODPZMVMPAURBH-CYBMUJFWSA-N	0	0	293.432	4.112	20	30		CIEDRN
C=C(C)CCS[C@@H](C)C(=O)Nc1ccccc1OCC	ZINC000507863038	332828160	/nfs/dbraw/zinc/82/81/60/332828160.db2.gz	VODPZMVMPAURBH-ZDUSSCGKSA-N	0	0	293.432	4.112	20	30		CIEDRN
Cc1ccc(NC(=O)CCCC#N)cc1OCCC(C)C	ZINC000360275636	328905856	/nfs/dbraw/zinc/90/58/56/328905856.db2.gz	CLWYGCMFLIQWHJ-UHFFFAOYSA-N	0	0	288.391	4.052	20	30		CIEDRN
N#Cc1cc(Cl)ccc1NC1CCC(F)(F)CC1	ZINC000390014642	328965056	/nfs/dbraw/zinc/96/50/56/328965056.db2.gz	PRDUWJSTARIKAG-UHFFFAOYSA-N	0	0	270.710	4.201	20	30		CIEDRN
C[C@@H](CCOCc1ccccc1)Nc1ccc(F)cc1C#N	ZINC000390207434	328966615	/nfs/dbraw/zinc/96/66/15/328966615.db2.gz	SWJMUNUKRJKBJT-AWEZNQCLSA-N	0	0	298.361	4.105	20	30		CIEDRN
Cc1csc(NC(=O)[C@H](C)CC2CCCC2)c1C#N	ZINC000582445414	329002623	/nfs/dbraw/zinc/00/26/23/329002623.db2.gz	RVKNRVPQTHDVML-SNVBAGLBSA-N	0	0	276.405	4.083	20	30		CIEDRN
C=C(C)CCSCC(=O)N1CCC[C@@H]1c1ccsc1	ZINC000375641040	329004953	/nfs/dbraw/zinc/00/49/53/329004953.db2.gz	LWOBUEBWEGQWDJ-CQSZACIVSA-N	0	0	295.473	4.111	20	30		CIEDRN
C=C(C)CCc1noc([C@H]2CC[C@@H](c3ccccc3)O2)n1	ZINC000377458420	329015554	/nfs/dbraw/zinc/01/55/54/329015554.db2.gz	FBEQOGDTWXFBQR-LSDHHAIUSA-N	0	0	284.359	4.171	20	30		CIEDRN
Cc1ccc([C@H](C)N(C)C(=O)c2ccc(C#N)s2)c(C)c1	ZINC000486803011	329061820	/nfs/dbraw/zinc/06/18/20/329061820.db2.gz	PVECLFINYXJVFN-ZDUSSCGKSA-N	0	0	298.411	4.070	20	30		CIEDRN
CCOc1cccc(N[C@@H](C)c2ccc(OCC#N)cc2)c1	ZINC000193913600	329063596	/nfs/dbraw/zinc/06/35/96/329063596.db2.gz	VAAJJVQBYHSOLM-AWEZNQCLSA-N	0	0	296.370	4.161	20	30		CIEDRN
CC(C)[C@@H](C)CC(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000171408937	329075596	/nfs/dbraw/zinc/07/55/96/329075596.db2.gz	LBDNPBPYIFIKFL-ZDUSSCGKSA-N	0	0	272.392	4.108	20	30		CIEDRN
CC(C)(C)C1CCN(C(=O)Nc2ccc(CC#N)cc2)CC1	ZINC000172144665	329081744	/nfs/dbraw/zinc/08/17/44/329081744.db2.gz	ZGZKWLNECLUBGL-UHFFFAOYSA-N	0	0	299.418	4.043	20	30		CIEDRN
C[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)C1CCCC1	ZINC000172207904	329083785	/nfs/dbraw/zinc/08/37/85/329083785.db2.gz	OWYVGEBYVMNHJE-CYBMUJFWSA-N	0	0	299.418	4.188	20	30		CIEDRN
CCC[C@@H](C(=O)Nc1cc(C#N)c2ccccc2n1)C(C)C	ZINC000582510713	329099111	/nfs/dbraw/zinc/09/91/11/329099111.db2.gz	BFFHXYRSZUOKCY-CQSZACIVSA-N	0	0	295.386	4.117	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2ccc(N(C)C)cc2F)no1	ZINC000582512532	329099416	/nfs/dbraw/zinc/09/94/16/329099416.db2.gz	KMBNJJXNNIFWIA-NSHDSACASA-N	0	0	289.354	4.011	20	30		CIEDRN
C=CCN(CC=C)C(=O)CCSc1cccc(Cl)c1	ZINC000582627185	329119210	/nfs/dbraw/zinc/11/92/10/329119210.db2.gz	QTVAJNNVZSWYAT-UHFFFAOYSA-N	0	0	295.835	4.023	20	30		CIEDRN
CC(C)CCN(CCC#N)Cc1csc(C(C)(C)C)n1	ZINC000173547170	329148766	/nfs/dbraw/zinc/14/87/66/329148766.db2.gz	PMHCUDOMPXLWPL-UHFFFAOYSA-N	0	0	293.480	4.202	20	30		CIEDRN
C[C@@H](CC#N)Nc1nc2cc(C(F)(F)F)ccc2s1	ZINC000174715634	329160944	/nfs/dbraw/zinc/16/09/44/329160944.db2.gz	NYKDWUBWGOZTEU-ZETCQYMHSA-N	0	0	285.294	4.029	20	30		CIEDRN
C=CCCCC(=O)Nc1cccc(-c2nc(C)c(C)o2)c1	ZINC000175379829	329164523	/nfs/dbraw/zinc/16/45/23/329164523.db2.gz	XJNBGJKTLZUGBE-UHFFFAOYSA-N	0	0	284.359	4.253	20	30		CIEDRN
C=CCCC(=O)Nc1cccc(CCC(F)(F)F)c1	ZINC000176948342	329179832	/nfs/dbraw/zinc/17/98/32/329179832.db2.gz	FHSWCUMLYNLBEG-UHFFFAOYSA-N	0	0	271.282	4.086	20	30		CIEDRN
C=C(C)CN(CC)C(=O)CCCc1cc(C)sc1C	ZINC000177100029	329180395	/nfs/dbraw/zinc/18/03/95/329180395.db2.gz	FVEZOCPHFOJECX-UHFFFAOYSA-N	0	0	279.449	4.112	20	30		CIEDRN
C=CCCCC(=O)N(Cc1ccco1)Cc1cccs1	ZINC000177527668	329185046	/nfs/dbraw/zinc/18/50/46/329185046.db2.gz	YMSPGKKLCOLQBW-UHFFFAOYSA-N	0	0	289.400	4.226	20	30		CIEDRN
C=C(C)CCc1noc(/C=C(/C)c2ccc([N+](=O)[O-])cc2)n1	ZINC000508662342	332846432	/nfs/dbraw/zinc/84/64/32/332846432.db2.gz	CJTBIIHZLGHCLV-BENRWUELSA-N	0	0	299.330	4.047	20	30		CIEDRN
C=C(C)CSCC(=O)Nc1c(C)cccc1C(C)C	ZINC000177871870	329193550	/nfs/dbraw/zinc/19/35/50/329193550.db2.gz	PEKHFIXQPYJSHS-UHFFFAOYSA-N	0	0	277.433	4.366	20	30		CIEDRN
N#CCC[C@@H](Nc1ccncc1Cl)c1ccccc1	ZINC000178659269	329201883	/nfs/dbraw/zinc/20/18/83/329201883.db2.gz	LEHRVDMOKCJCBZ-CQSZACIVSA-N	0	0	271.751	4.192	20	30		CIEDRN
C=C(C)CCc1noc(/C=C(\C)c2ccc([N+](=O)[O-])cc2)n1	ZINC000508662344	332846494	/nfs/dbraw/zinc/84/64/94/332846494.db2.gz	CJTBIIHZLGHCLV-ZRDIBKRKSA-N	0	0	299.330	4.047	20	30		CIEDRN
C#CCCCCC(=O)N[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000179643645	329210328	/nfs/dbraw/zinc/21/03/28/329210328.db2.gz	ZOOVFWVEVWMBTI-GFCCVEGCSA-N	0	0	297.320	4.076	20	30		CIEDRN
C=C(C)CCc1noc(C[C@@H](C)c2cccc(F)c2)n1	ZINC000508685402	332847417	/nfs/dbraw/zinc/84/74/17/332847417.db2.gz	GEULERBSJAGDGA-GFCCVEGCSA-N	0	0	274.339	4.064	20	30		CIEDRN
C=C(C)CCc1noc(-c2cncc(-c3ccccc3)c2)n1	ZINC000508685701	332847428	/nfs/dbraw/zinc/84/74/28/332847428.db2.gz	HWCBWAPGWTWTGF-UHFFFAOYSA-N	0	0	291.354	4.307	20	30		CIEDRN
N#Cc1cc(F)cc(OCc2cccc(C(F)F)c2)c1	ZINC000582807383	329232594	/nfs/dbraw/zinc/23/25/94/329232594.db2.gz	BHAMBZYOODEUME-UHFFFAOYSA-N	0	0	277.245	4.214	20	30		CIEDRN
COc1cc(-c2ccccc2)ccc1CN(C)[C@H](C)CC#N	ZINC000183420505	329247687	/nfs/dbraw/zinc/24/76/87/329247687.db2.gz	MLXATAUYLRDINJ-OAHLLOKOSA-N	0	0	294.398	4.096	20	30		CIEDRN
C=CCC[C@@H](NC(=O)Nc1ccncc1F)c1ccccc1	ZINC000184225602	329258180	/nfs/dbraw/zinc/25/81/80/329258180.db2.gz	BXFDHWDXPAUOSG-OAHLLOKOSA-N	0	0	299.349	4.050	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](c1ccco1)c1ccccc1	ZINC000185059493	329265314	/nfs/dbraw/zinc/26/53/14/329265314.db2.gz	OBRAYMWLQODAPZ-RHSMWYFYSA-N	0	0	283.371	4.088	20	30		CIEDRN
N#CCc1ccc(NCc2cnc(C3CCCC3)s2)cc1	ZINC000185149075	329266730	/nfs/dbraw/zinc/26/67/30/329266730.db2.gz	XCPCFKXWNMMUTL-UHFFFAOYSA-N	0	0	297.427	4.479	20	30		CIEDRN
C=CCN(CC(F)(F)F)C(=O)C[C@H](C)C1CCCCC1	ZINC000508752912	332849675	/nfs/dbraw/zinc/84/96/75/332849675.db2.gz	FYWGATNQSUKNSS-LBPRGKRZSA-N	0	0	291.357	4.170	20	30		CIEDRN
C[C@H](c1cccc(C#N)c1)N(C)C(=O)C1(C)CCCCC1	ZINC000582842133	329277108	/nfs/dbraw/zinc/27/71/08/329277108.db2.gz	JXJYILPVRULVLW-CQSZACIVSA-N	0	0	284.403	4.048	20	30		CIEDRN
C=CCCCNC(=O)C1(Cc2cccs2)CCCCC1	ZINC000582910980	329287287	/nfs/dbraw/zinc/28/72/87/329287287.db2.gz	YSSCLCPBDLNGRZ-UHFFFAOYSA-N	0	0	291.460	4.324	20	30		CIEDRN
C=CCC1(C(=O)Nc2cccc3c(=O)[nH]ccc23)CCCC1	ZINC000583008516	329301891	/nfs/dbraw/zinc/30/18/91/329301891.db2.gz	JQRGBXUVERBHIN-UHFFFAOYSA-N	0	0	296.370	4.015	20	30		CIEDRN
C=C(C)CCc1noc(/C=C\c2ccc(F)c(F)c2)n1	ZINC000584377514	329306727	/nfs/dbraw/zinc/30/67/27/329306727.db2.gz	SHNQWLKILKELDT-YVMONPNESA-N	0	0	276.286	4.027	20	30		CIEDRN
N#Cc1ccnc(SCc2ccc(C(F)F)cc2)c1	ZINC000185885902	329334409	/nfs/dbraw/zinc/33/44/09/329334409.db2.gz	LGGQMCMAKVHECN-UHFFFAOYSA-N	0	0	276.311	4.183	20	30		CIEDRN
Cc1oc2ccc(NC(=O)c3sccc3C#N)cc2c1C	ZINC000186802707	329349178	/nfs/dbraw/zinc/34/91/78/329349178.db2.gz	KBFCYLAZWRXRCY-UHFFFAOYSA-N	0	0	296.351	4.235	20	30		CIEDRN
N#CCCCCSC[C@H]1CCC2(CCCCC2)O1	ZINC000188751965	329372877	/nfs/dbraw/zinc/37/28/77/329372877.db2.gz	GCHZMQPKJKKLPB-CQSZACIVSA-N	0	0	267.438	4.295	20	30		CIEDRN
C=CCC[C@@H](C(=O)N[C@@H](C)c1ccccn1)c1ccccc1	ZINC000188872766	329372884	/nfs/dbraw/zinc/37/28/84/329372884.db2.gz	CKQBMODCIDDJEO-DOTOQJQBSA-N	0	0	294.398	4.009	20	30		CIEDRN
C=CCC[C@@H](NC(=O)c1coc(C)c1)c1ccccc1	ZINC000188822989	329373501	/nfs/dbraw/zinc/37/35/01/329373501.db2.gz	MJLHASPKMGFLDS-MRXNPFEDSA-N	0	0	269.344	4.025	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc2[nH]c(C(F)F)nc2c1	ZINC000189036033	329374955	/nfs/dbraw/zinc/37/49/55/329374955.db2.gz	CYBSFVOVSHHCDP-OAHLLOKOSA-N	0	0	293.317	4.041	20	30		CIEDRN
C[C@@H](CC1CCCCC1)C(=O)Nc1ccccc1CC#N	ZINC000583226499	329381640	/nfs/dbraw/zinc/38/16/40/329381640.db2.gz	IRVVMIGSLKJASM-AWEZNQCLSA-N	0	0	284.403	4.298	20	30		CIEDRN
C=C(C)CCN[C@@H](c1c(F)cccc1F)C(F)(F)F	ZINC000509021194	332856232	/nfs/dbraw/zinc/85/62/32/332856232.db2.gz	JBRRUBLLYZKIRA-LBPRGKRZSA-N	0	0	279.252	4.124	20	30		CIEDRN
CC1(CC(=O)Nc2ccc(C#N)cc2Cl)CCCC1	ZINC000583226659	329384132	/nfs/dbraw/zinc/38/41/32/329384132.db2.gz	PHAQXKHBVOTTJD-UHFFFAOYSA-N	0	0	276.767	4.121	20	30		CIEDRN
CC[C@H](C)CC(=O)Nc1nc(-c2cccc(C#N)c2)cs1	ZINC000189711482	329385626	/nfs/dbraw/zinc/38/56/26/329385626.db2.gz	UAZQMKYYHQCCRZ-NSHDSACASA-N	0	0	299.399	4.056	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)Cc1cccnc1	ZINC000189895586	329388690	/nfs/dbraw/zinc/38/86/90/329388690.db2.gz	HOAHJTUBTLCXIS-UHFFFAOYSA-N	0	0	294.398	4.115	20	30		CIEDRN
C[C@H](Sc1nnc(C(C)(C)C)o1)c1cccc(C#N)c1	ZINC000189836910	329389453	/nfs/dbraw/zinc/38/94/53/329389453.db2.gz	QKAGHMDBRKAOFA-JTQLQIEISA-N	0	0	287.388	4.092	20	30		CIEDRN
C[C@@H](CC(=O)N(CC#N)c1ccccc1)C1CCCCC1	ZINC000509107076	332859158	/nfs/dbraw/zinc/85/91/58/332859158.db2.gz	LAOTWEVKHWMTER-HNNXBMFYSA-N	0	0	284.403	4.150	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NCc1nnc(C2CC2)[nH]1	ZINC000190407397	329396454	/nfs/dbraw/zinc/39/64/54/329396454.db2.gz	OVSNYIHKXAARSC-UHFFFAOYSA-N	0	0	296.418	4.146	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cccc(-n2cccc2)c1	ZINC000509067125	332858084	/nfs/dbraw/zinc/85/80/84/332858084.db2.gz	KAXGXVMBUAPPIA-AWEZNQCLSA-N	0	0	268.360	4.018	20	30		CIEDRN
N#C[C@@H](Sc1cccc([N+](=O)[O-])c1)C1CCCCC1	ZINC000509089815	332858811	/nfs/dbraw/zinc/85/88/11/332858811.db2.gz	MEHRGGSTYGGFRI-CQSZACIVSA-N	0	0	276.361	4.159	20	30		CIEDRN
CC[C@H](C#N)NC(=O)[C@@H]1CC12CCC(C(C)(C)CC)CC2	ZINC000509095623	332859048	/nfs/dbraw/zinc/85/90/48/332859048.db2.gz	NRIIKCPPVGBDME-DGSCNEQVSA-N	0	0	290.451	4.037	20	30		CIEDRN
N#Cc1ccc(SC[C@H]2CCCC(F)(F)C2)cc1	ZINC000509101770	332859088	/nfs/dbraw/zinc/85/90/88/332859088.db2.gz	BEZVZYQNZIHFAD-LBPRGKRZSA-N	0	0	267.344	4.476	20	30		CIEDRN
CC(C)CN(C(=O)C1CC2(CCC2)C1)c1ccc(C#N)cc1	ZINC000584413519	329461989	/nfs/dbraw/zinc/46/19/89/329461989.db2.gz	RKUNMVRSVLZTBW-UHFFFAOYSA-N	0	0	296.414	4.128	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(-c2ncco2)cc1C	ZINC000584420443	329465300	/nfs/dbraw/zinc/46/53/00/329465300.db2.gz	JIHUYGMZXLWOKN-CYBMUJFWSA-N	0	0	284.359	4.191	20	30		CIEDRN
CCC(C)(C)C1CCC(CC(=O)N[C@H](C#N)C2CC2)CC1	ZINC000509284751	332863691	/nfs/dbraw/zinc/86/36/91/332863691.db2.gz	XAQSIJJVMRMSLT-AVVWSFFYSA-N	0	0	290.451	4.037	20	30		CIEDRN
N#CC1(COc2ccccc2-c2ccccc2)CCC1	ZINC000418783911	329552471	/nfs/dbraw/zinc/55/24/71/329552471.db2.gz	FUXLVLHUWJZCON-UHFFFAOYSA-N	0	0	263.340	4.426	20	30		CIEDRN
N#CCCSc1ccccc1NCCc1ccccc1	ZINC000123607134	329560755	/nfs/dbraw/zinc/56/07/55/329560755.db2.gz	NBYLKZHBACGQHS-UHFFFAOYSA-N	0	0	282.412	4.347	20	30		CIEDRN
CCC1(C(=O)N(C)[C@H](C)c2cccc(C#N)c2)CCCCC1	ZINC000425633637	329575009	/nfs/dbraw/zinc/57/50/09/329575009.db2.gz	FTCUTCKDGRZGDS-OAHLLOKOSA-N	0	0	298.430	4.438	20	30		CIEDRN
CCCC1(C(=O)N(C)[C@@H](C)c2cccc(C#N)c2)CCC1	ZINC000425638474	329590785	/nfs/dbraw/zinc/59/07/85/329590785.db2.gz	NKZNQOMXWMKFOZ-AWEZNQCLSA-N	0	0	284.403	4.048	20	30		CIEDRN
CCC[C@@H]1CCC[C@@H]1C(=O)N(C)[C@H](C)c1cccc(C#N)c1	ZINC000425111023	329595766	/nfs/dbraw/zinc/59/57/66/329595766.db2.gz	NROVQINPYWFRLX-KYJSFNMBSA-N	0	0	298.430	4.294	20	30		CIEDRN
C[C@H](CC(C)(C)C)C(=O)N(C)[C@H](C)c1cccc(C#N)c1	ZINC000425132302	329604023	/nfs/dbraw/zinc/60/40/23/329604023.db2.gz	QXPDHFRJFIXWDH-ZIAGYGMSSA-N	0	0	286.419	4.150	20	30		CIEDRN
Cc1cc(C)cc(C(=O)N(C)[C@@H](C)c2cccc(C#N)c2)c1	ZINC000425133439	329604586	/nfs/dbraw/zinc/60/45/86/329604586.db2.gz	SPNNAOMFFLXEES-HNNXBMFYSA-N	0	0	292.382	4.008	20	30		CIEDRN
Cc1ccc(C(=O)N(C)[C@@H](C)c2cccc(C#N)c2)c(C)c1	ZINC000425135290	329604936	/nfs/dbraw/zinc/60/49/36/329604936.db2.gz	VLIWMQRPNPKJQL-HNNXBMFYSA-N	0	0	292.382	4.008	20	30		CIEDRN
CC(C)C[C@H](C)CC(=O)N(C)[C@H](C)c1cccc(C#N)c1	ZINC000425137414	329606983	/nfs/dbraw/zinc/60/69/83/329606983.db2.gz	XPVUIOZWXWYAAR-LSDHHAIUSA-N	0	0	286.419	4.150	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)[C@@H]1CCC[C@H](F)C1	ZINC000424817068	329620460	/nfs/dbraw/zinc/62/04/60/329620460.db2.gz	CKOXZHMASSEBNW-CABCVRRESA-N	0	0	275.367	4.272	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cccc(-c2ncc(C)o2)c1	ZINC000132030221	329642128	/nfs/dbraw/zinc/64/21/28/329642128.db2.gz	URZLOLRIOKGAQA-UHFFFAOYSA-N	0	0	296.370	4.357	20	30		CIEDRN
C=CCCCCNC(=O)Nc1ccccc1C(F)F	ZINC000425699035	329648065	/nfs/dbraw/zinc/64/80/65/329648065.db2.gz	HKKMYGHFFBONOK-UHFFFAOYSA-N	0	0	268.307	4.102	20	30		CIEDRN
CC[C@H](Nc1cccc(OCCCC#N)c1)[C@H]1C[C@@H]1C	ZINC000322091918	329686546	/nfs/dbraw/zinc/68/65/46/329686546.db2.gz	WNNXFASRNQSSFG-JQFCIGGWSA-N	0	0	272.392	4.216	20	30		CIEDRN
COc1c(OCCC(C)(C)C#N)ccc2ccccc21	ZINC000419083736	329706027	/nfs/dbraw/zinc/70/60/27/329706027.db2.gz	RXLBGAJLLBNQAR-UHFFFAOYSA-N	0	0	269.344	4.167	20	30		CIEDRN
C[C@@H](SCCC#N)c1ccc(OC(F)(F)F)cc1	ZINC000065280426	329707023	/nfs/dbraw/zinc/70/70/23/329707023.db2.gz	ZLDRRNDYZRLZLI-SECBINFHSA-N	0	0	275.295	4.293	20	30		CIEDRN
N#CC1(CSCc2cc(-c3ccccc3)on2)CCC1	ZINC000419360274	329720165	/nfs/dbraw/zinc/72/01/65/329720165.db2.gz	LKWMAHAZPDFHFV-UHFFFAOYSA-N	0	0	284.384	4.269	20	30		CIEDRN
C[C@@H](SCCC1CCOCC1)c1ccc(C#N)cc1	ZINC000419413213	329724629	/nfs/dbraw/zinc/72/46/29/329724629.db2.gz	DEODTIZZBFNCBS-CYBMUJFWSA-N	0	0	275.417	4.169	20	30		CIEDRN
CC(C)(C)c1nc(CSCC2(C#N)CCC2)cs1	ZINC000419386661	329726435	/nfs/dbraw/zinc/72/64/35/329726435.db2.gz	BVRZOGLTZDGGKC-UHFFFAOYSA-N	0	0	280.462	4.368	20	30		CIEDRN
C[C@@H](SCC1(C#N)CCC1)c1ccc(F)c(F)c1	ZINC000419386671	329726580	/nfs/dbraw/zinc/72/65/80/329726580.db2.gz	BWFAOGFSJPUTOT-SNVBAGLBSA-N	0	0	267.344	4.453	20	30		CIEDRN
C[C@H](SCCc1cscn1)c1cccc(C#N)c1	ZINC000419462058	329731878	/nfs/dbraw/zinc/73/18/78/329731878.db2.gz	IUORWHZMVNQPTQ-NSHDSACASA-N	0	0	274.414	4.052	20	30		CIEDRN
CC(C)OC1CC(S[C@@H](C)c2cccc(C#N)c2)C1	ZINC000419463640	329732065	/nfs/dbraw/zinc/73/20/65/329732065.db2.gz	LWWBWKMQXYAKOQ-JQRITLKVSA-N	0	0	275.417	4.308	20	30		CIEDRN
N#Cc1ccc(CSCC2CC(F)(F)C2)c(Cl)c1	ZINC000419498971	329732321	/nfs/dbraw/zinc/73/23/21/329732321.db2.gz	AGODYYFWJRNHSO-UHFFFAOYSA-N	0	0	287.762	4.490	20	30		CIEDRN
N#Cc1cnc(CSCc2ccc(C3CCC3)cc2)nc1	ZINC000419493925	329737499	/nfs/dbraw/zinc/73/74/99/329737499.db2.gz	ISVWLIAPPISSNC-UHFFFAOYSA-N	0	0	295.411	4.049	20	30		CIEDRN
C=CCN(CC=C)C(=O)N[C@H](C)c1ccc(C2CC2)cc1	ZINC000419566113	329739428	/nfs/dbraw/zinc/73/94/28/329739428.db2.gz	FPSAFIROOMJNIV-CQSZACIVSA-N	0	0	284.403	4.009	20	30		CIEDRN
Cc1cc(SCC2(C#N)CCC2)c2ccccc2n1	ZINC000419578784	329741151	/nfs/dbraw/zinc/74/11/51/329741151.db2.gz	JEOWXCSOAIFURY-UHFFFAOYSA-N	0	0	268.385	4.329	20	30		CIEDRN
C[C@H](CCSCC1(C#N)CCC1)OCc1ccccc1	ZINC000419587241	329741443	/nfs/dbraw/zinc/74/14/43/329741443.db2.gz	RVVWHMWTCFBROM-OAHLLOKOSA-N	0	0	289.444	4.409	20	30		CIEDRN
N#CC1(CCCSCC2=CCCCC2)CCOCC1	ZINC000419598380	329742281	/nfs/dbraw/zinc/74/22/81/329742281.db2.gz	RGSBURUVXKULPW-UHFFFAOYSA-N	0	0	279.449	4.321	20	30		CIEDRN
N#Cc1csc(CSCC2CCC(F)(F)CC2)n1	ZINC000419606826	329742602	/nfs/dbraw/zinc/74/26/02/329742602.db2.gz	TTXQDPAGUGMNMN-UHFFFAOYSA-N	0	0	288.388	4.073	20	30		CIEDRN
C=C(C)[C@H]1OCCC[C@H]1c1nc([C@@H]2CCCC[C@H]2C)no1	ZINC000420501487	329770599	/nfs/dbraw/zinc/77/05/99/329770599.db2.gz	HMMCYSUVLSKLJC-KBUPBQIOSA-N	0	0	290.407	4.202	20	30		CIEDRN
CCn1c2ccc(C#N)cc2nc1-c1ccc(C)c(F)c1	ZINC000086635499	332876279	/nfs/dbraw/zinc/87/62/79/332876279.db2.gz	JWTVXOGLHJYNGS-UHFFFAOYSA-N	0	0	279.318	4.042	20	30		CIEDRN
C=CCC(CC=C)c1nc(-c2cccc(SC)n2)no1	ZINC000420524888	329775826	/nfs/dbraw/zinc/77/58/26/329775826.db2.gz	XEOMASSAPVPTPX-UHFFFAOYSA-N	0	0	287.388	4.089	20	30		CIEDRN
CC(C)(C#N)CCCNc1ccc2c(c1)C(=O)CCCC2	ZINC000421199463	329807466	/nfs/dbraw/zinc/80/74/66/329807466.db2.gz	WPXHTIKRFUDKIB-UHFFFAOYSA-N	0	0	284.403	4.338	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H](C)c1ccccc1OC(C)C	ZINC000525960266	329887576	/nfs/dbraw/zinc/88/75/76/329887576.db2.gz	RPIJBWQFKSYUQB-RDTXWAMCSA-N	0	0	289.419	4.253	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1coc(C2CCCC2)n1	ZINC000509965195	332887165	/nfs/dbraw/zinc/88/71/65/332887165.db2.gz	ZTUYZCWYEFDPJN-UHFFFAOYSA-N	0	0	290.407	4.151	20	30		CIEDRN
C=CCCc1nc([C@H](c2ccccc2C)C(C)C)no1	ZINC000572080181	329942507	/nfs/dbraw/zinc/94/25/07/329942507.db2.gz	ZLKULMLWUNTSBA-INIZCTEOSA-N	0	0	270.376	4.285	20	30		CIEDRN
CC(C)c1ccc(/C=C/CC(=O)N(C)C2(C#N)CCC2)cc1	ZINC000161510843	329943624	/nfs/dbraw/zinc/94/36/24/329943624.db2.gz	HPQMLDJGPAMAFS-GQCTYLIASA-N	0	0	296.414	4.118	20	30		CIEDRN
C=CCN(C)C(=O)CCCc1cc(Cl)sc1Cl	ZINC000161633095	329949857	/nfs/dbraw/zinc/94/98/57/329949857.db2.gz	STUTYSHJYCFIKX-UHFFFAOYSA-N	0	0	292.231	4.022	20	30		CIEDRN
N#Cc1c(F)cccc1SCCCC(=O)c1ccccc1	ZINC000572344392	329987528	/nfs/dbraw/zinc/98/75/28/329987528.db2.gz	FHOXCMCOOSMLGM-UHFFFAOYSA-N	0	0	299.370	4.453	20	30		CIEDRN
C=CCOCCCC(=O)N(C(C)C)[C@@H](C)c1ccsc1	ZINC000421692304	330071335	/nfs/dbraw/zinc/07/13/35/330071335.db2.gz	OWKUKPHDVRBWAT-AWEZNQCLSA-N	0	0	295.448	4.029	20	30		CIEDRN
C#CCCCCC(=O)N1CCCC[C@@H]1c1ccc(F)cc1	ZINC000271377075	330079171	/nfs/dbraw/zinc/07/91/71/330079171.db2.gz	CPPJGJOLCYIYBR-QGZVFWFLSA-N	0	0	287.378	4.073	20	30		CIEDRN
C=CCN(C(=O)Nc1ccccc1SC(F)F)C1CC1	ZINC000271408894	330079706	/nfs/dbraw/zinc/07/97/06/330079706.db2.gz	VPGKSKHPKANMGL-UHFFFAOYSA-N	0	0	298.358	4.184	20	30		CIEDRN
C=CCN(C(=O)Nc1cc(Cl)ccc1Cl)C1CC1	ZINC000271410211	330079906	/nfs/dbraw/zinc/07/99/06/330079906.db2.gz	KDEIPXCUFJRCMB-UHFFFAOYSA-N	0	0	285.174	4.176	20	30		CIEDRN
C#CC[C@@H](NCc1nc(C(C)(C)C)cs1)c1ccccc1	ZINC000271708801	330082636	/nfs/dbraw/zinc/08/26/36/330082636.db2.gz	NYZWIPGHNBEWGQ-OAHLLOKOSA-N	0	0	298.455	4.295	20	30		CIEDRN
C=CCN(C(=O)Nc1csc2ccccc12)C1CC1	ZINC000272347800	330085503	/nfs/dbraw/zinc/08/55/03/330085503.db2.gz	CSYIAJHDNHKDNY-UHFFFAOYSA-N	0	0	272.373	4.084	20	30		CIEDRN
C=CCC(CC=C)c1nc([C@@H](C)SCC)no1	ZINC000273813520	330099940	/nfs/dbraw/zinc/09/99/40/330099940.db2.gz	CKVMOGGPJHDLFT-SNVBAGLBSA-N	0	0	252.383	4.120	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCCCC[C@@H]1c1cccn1C	ZINC000274297098	330104381	/nfs/dbraw/zinc/10/43/81/330104381.db2.gz	RJMCGLVZMLWYMN-NVXWUHKLSA-N	0	0	288.435	4.071	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)c1csc(Cl)n1	ZINC000275513803	330110566	/nfs/dbraw/zinc/11/05/66/330110566.db2.gz	XUSVYOLJHXKVOI-UHFFFAOYSA-N	0	0	298.839	4.005	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1ccccc1SC(F)F	ZINC000276285677	330112623	/nfs/dbraw/zinc/11/26/23/330112623.db2.gz	IYTUQQRFJONOKR-UHFFFAOYSA-N	0	0	286.347	4.041	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1cc(Cl)ccc1SC	ZINC000276274855	330112733	/nfs/dbraw/zinc/11/27/33/330112733.db2.gz	HQHLPWYYXHXOHV-UHFFFAOYSA-N	0	0	284.812	4.102	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1ccn(C)c1	ZINC000276509349	330114401	/nfs/dbraw/zinc/11/44/01/330114401.db2.gz	ZBEHRYBKUFGQNI-UHFFFAOYSA-N	0	0	282.387	4.129	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000276961936	330114798	/nfs/dbraw/zinc/11/47/98/330114798.db2.gz	RZAZUQKCXXBCQA-HIFRSBDPSA-N	0	0	299.336	4.051	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000276961940	330114819	/nfs/dbraw/zinc/11/48/19/330114819.db2.gz	RZAZUQKCXXBCQA-ZFWWWQNUSA-N	0	0	299.336	4.051	20	30		CIEDRN
C#CCCCC(=O)N(C)[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000277223143	330115619	/nfs/dbraw/zinc/11/56/19/330115619.db2.gz	MBGOCEHGYHPNLG-LBPRGKRZSA-N	0	0	297.320	4.028	20	30		CIEDRN
Cc1cccc(CCNc2c(C#N)cnc3ccccc32)c1	ZINC000302964644	332895105	/nfs/dbraw/zinc/89/51/05/332895105.db2.gz	AAAOQOVIRYQVOW-UHFFFAOYSA-N	0	0	287.366	4.070	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cnn(CCC(C)C)c1CC	ZINC000277662876	330116795	/nfs/dbraw/zinc/11/67/95/330116795.db2.gz	WRTQFABTKWIXJN-AWEZNQCLSA-N	0	0	291.439	4.032	20	30		CIEDRN
C=CCC[C@H](NCc1c(CC)noc1CC)c1ccco1	ZINC000278880881	330120815	/nfs/dbraw/zinc/12/08/15/330120815.db2.gz	GXCYDQXDFRMEIU-HNNXBMFYSA-N	0	0	288.391	4.190	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1c(C)c(F)ccc1Cl	ZINC000279251607	330122389	/nfs/dbraw/zinc/12/23/89/330122389.db2.gz	RXIDBPHSPIGKLG-UHFFFAOYSA-N	0	0	281.758	4.494	20	30		CIEDRN
CC(C)(C#N)CCC[S@@](=O)c1ccc2c(c1)CCCC2	ZINC000422099162	330124885	/nfs/dbraw/zinc/12/48/85/330124885.db2.gz	NKDFXARYXUGUGX-HXUWFJFHSA-N	0	0	289.444	4.003	20	30		CIEDRN
C=CCCC1(C(=O)N2CC[C@H](C(C)(C)C)C[C@H]2C)CC1	ZINC000580458948	330141229	/nfs/dbraw/zinc/14/12/29/330141229.db2.gz	RMFZLVYHZRUIQQ-CABCVRRESA-N	0	0	277.452	4.406	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)NCCCF	ZINC000191476230	330144516	/nfs/dbraw/zinc/14/45/16/330144516.db2.gz	GCGCKWIHNZRASM-UHFFFAOYSA-N	0	0	278.371	4.020	20	30		CIEDRN
N#Cc1ccc(C(F)(F)F)c(NCCC2(F)CCC2)c1	ZINC000580474685	330145217	/nfs/dbraw/zinc/14/52/17/330145217.db2.gz	IRQACAXTBWDVDY-UHFFFAOYSA-N	0	0	286.272	4.271	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2ccc(C)cc2OC)no1	ZINC000580482259	330146626	/nfs/dbraw/zinc/14/66/26/330146626.db2.gz	LRGYDCYMAMLSJZ-GFCCVEGCSA-N	0	0	272.348	4.123	20	30		CIEDRN
CCCc1ccccc1NCc1ccc(C#N)cc1	ZINC000035252550	330244317	/nfs/dbraw/zinc/24/43/17/330244317.db2.gz	STVOHRXFGXEXDB-UHFFFAOYSA-N	0	0	250.345	4.123	20	30		CIEDRN
N#Cc1cccc(OCCSc2cc(F)ccc2F)c1	ZINC000035676290	330249221	/nfs/dbraw/zinc/24/92/21/330249221.db2.gz	HCIBVSZTSFIXTE-UHFFFAOYSA-N	0	0	291.322	4.008	20	30		CIEDRN
C[C@@H](Sc1ccc2c(c1)OCCO2)c1cccc(C#N)c1	ZINC000527486248	330249404	/nfs/dbraw/zinc/24/94/04/330249404.db2.gz	DHUOLURRNZHRIK-GFCCVEGCSA-N	0	0	297.379	4.183	20	30		CIEDRN
C[C@H]1C[C@@H]1c1ccc(CNc2cccc(F)c2C#N)o1	ZINC000036138631	330249710	/nfs/dbraw/zinc/24/97/10/330249710.db2.gz	HOTUITBZPUMGBS-JQWIXIFHSA-N	0	0	270.307	4.026	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(-c2nccc3ccccc32)no1	ZINC000527487857	330250693	/nfs/dbraw/zinc/25/06/93/330250693.db2.gz	WKRPWLNJLZYTQZ-QGZVFWFLSA-N	0	0	279.343	4.139	20	30		CIEDRN
C[C@@H](NC(=O)C1(C)CCCCCC1)c1ccc(C#N)cc1	ZINC000510333093	332900499	/nfs/dbraw/zinc/90/04/99/332900499.db2.gz	MRQKDKSBSYSBCE-CQSZACIVSA-N	0	0	284.403	4.096	20	30		CIEDRN
C=C(C)COc1cccc(NCc2cncn2C(C)C)c1	ZINC000424138077	330274816	/nfs/dbraw/zinc/27/48/16/330274816.db2.gz	BSNWSPPDHUJMBJ-UHFFFAOYSA-N	0	0	285.391	4.031	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)[C@@H]2CCCC23CC3)cc1	ZINC000527869020	330285999	/nfs/dbraw/zinc/28/59/99/330285999.db2.gz	MZOSHNJRDULZCO-HNNXBMFYSA-N	0	0	282.387	4.007	20	30		CIEDRN
N#Cc1c(F)cccc1NC1CC(c2ccccc2)C1	ZINC000036840647	330292008	/nfs/dbraw/zinc/29/20/08/330292008.db2.gz	LRNBBCGJNZJQFA-UHFFFAOYSA-N	0	0	266.319	4.055	20	30		CIEDRN
CCN(C(=O)[C@@H]1CCCC12CC2)[C@H](C)c1ccc(C#N)cc1	ZINC000528152287	330309754	/nfs/dbraw/zinc/30/97/54/330309754.db2.gz	FAKTVCWPXGAPQX-PBHICJAKSA-N	0	0	296.414	4.048	20	30		CIEDRN
CCC(C#N)(CC)C(=O)Nc1ccc2c3c(cccc31)CC2	ZINC000528153171	330309766	/nfs/dbraw/zinc/30/97/66/330309766.db2.gz	HJCNZAGAYHHUCK-UHFFFAOYSA-N	0	0	292.382	4.207	20	30		CIEDRN
CCC(C#N)(CC)c1nc(C2(c3ccccc3)CCC2)no1	ZINC000528157001	330310128	/nfs/dbraw/zinc/31/01/28/330310128.db2.gz	PEIJMWIPYUCKAW-UHFFFAOYSA-N	0	0	295.386	4.121	20	30		CIEDRN
Cc1cc(C(=O)COc2cccc(C#N)c2)c(C)c(C)c1C	ZINC000036885540	330311931	/nfs/dbraw/zinc/31/19/31/330311931.db2.gz	TWXXAALXFKZVSC-UHFFFAOYSA-N	0	0	293.366	4.054	20	30		CIEDRN
CCC(C#N)(CC)c1nc(-c2ccc(Cl)cc2F)no1	ZINC000528199328	330312684	/nfs/dbraw/zinc/31/26/84/330312684.db2.gz	AFBAIOZGDLTURT-UHFFFAOYSA-N	0	0	293.729	4.110	20	30		CIEDRN
C=CCC1(c2nc([C@H]3CC[C@H](C)O3)no2)CCCCC1	ZINC000528237195	330316847	/nfs/dbraw/zinc/31/68/47/330316847.db2.gz	MAUKRUXEHITELJ-QWHCGFSZSA-N	0	0	276.380	4.088	20	30		CIEDRN
C=CCC1(c2nc([C@@H]3CC[C@@H](C)O3)no2)CCCCC1	ZINC000528237190	330316893	/nfs/dbraw/zinc/31/68/93/330316893.db2.gz	MAUKRUXEHITELJ-OLZOCXBDSA-N	0	0	276.380	4.088	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(C(C)(C)c2cc(C)ccn2)no1	ZINC000528262254	330317829	/nfs/dbraw/zinc/31/78/29/330317829.db2.gz	KRSUSMRRZTYJKF-CYBMUJFWSA-N	0	0	285.391	4.169	20	30		CIEDRN
CC#CCCCc1nc(-c2ccccc2OC2CCC2)no1	ZINC000528259841	330317851	/nfs/dbraw/zinc/31/78/51/330317851.db2.gz	LXETZJYBZUYFGG-UHFFFAOYSA-N	0	0	296.370	4.014	20	30		CIEDRN
C=CC[C@H](C)NC(=O)CCc1ccc(Cl)cc1Cl	ZINC000116860505	330323157	/nfs/dbraw/zinc/32/31/57/330323157.db2.gz	WHPWMXAJWGLIFO-JTQLQIEISA-N	0	0	286.202	4.007	20	30		CIEDRN
C=CCNC(=O)Nc1ccc(SC2CCCC2)cc1	ZINC000044345012	330329238	/nfs/dbraw/zinc/32/92/38/330329238.db2.gz	IVEGSWFKGGDDRJ-UHFFFAOYSA-N	0	0	276.405	4.029	20	30		CIEDRN
CCCN(Cc1ccc(C#N)cc1)C(=O)CC1=CCCCC1	ZINC000106611356	330340783	/nfs/dbraw/zinc/34/07/83/330340783.db2.gz	HHSSFJLNOQDNLF-UHFFFAOYSA-N	0	0	296.414	4.187	20	30		CIEDRN
C=C(C)C(C)(C)c1nc(-c2cc(F)ccc2C)no1	ZINC000424340974	330344083	/nfs/dbraw/zinc/34/40/83/330344083.db2.gz	ULFGEMPEMFQASE-UHFFFAOYSA-N	0	0	260.312	4.038	20	30		CIEDRN
C=C(C)C(C)(C)c1nc([C@@H](C)c2cccs2)no1	ZINC000424344220	330344521	/nfs/dbraw/zinc/34/45/21/330344521.db2.gz	BOGMKOFUZUNJBT-JTQLQIEISA-N	0	0	262.378	4.137	20	30		CIEDRN
C=C(C)C(C)(C)c1nc([C@@H]2CCc3ccccc32)no1	ZINC000424344679	330344557	/nfs/dbraw/zinc/34/45/57/330344557.db2.gz	CZOZRLOPKOSYRS-CQSZACIVSA-N	0	0	268.360	4.001	20	30		CIEDRN
C=C(C)C(C)(C)c1nc(-c2cnc3ccsc3c2)no1	ZINC000424349675	330345124	/nfs/dbraw/zinc/34/51/24/330345124.db2.gz	RKTTZYUUYVBYAG-UHFFFAOYSA-N	0	0	285.372	4.200	20	30		CIEDRN
N#Cc1cccc(-c2nc3cc(C(F)(F)F)ccc3[nH]2)c1	ZINC000107793519	330351197	/nfs/dbraw/zinc/35/11/97/330351197.db2.gz	QVSLLYTZEKMHOF-UHFFFAOYSA-N	0	0	287.244	4.120	20	30		CIEDRN
N#Cc1ccc(NC(=O)[C@H]2CC23CCCCC3)c(Cl)c1	ZINC000533199357	330353166	/nfs/dbraw/zinc/35/31/66/330353166.db2.gz	MKOFDOWONSCIGJ-GFCCVEGCSA-N	0	0	288.778	4.121	20	30		CIEDRN
C[C@H](c1ccccc1Cl)N(C)Cc1cccc(C#N)c1	ZINC000046517975	330353454	/nfs/dbraw/zinc/35/34/54/330353454.db2.gz	KUJNNIHYUMFFNV-CYBMUJFWSA-N	0	0	284.790	4.405	20	30		CIEDRN
C=CCC[C@@H](NC(=O)c1cc(C)c(C)o1)c1ccccc1	ZINC000533261311	330355734	/nfs/dbraw/zinc/35/57/34/330355734.db2.gz	BATWBNITJLEPMQ-MRXNPFEDSA-N	0	0	283.371	4.334	20	30		CIEDRN
C=CCC[C@H](NC(=O)C[C@@H](C)n1cccc1)c1ccccc1	ZINC000533261595	330355753	/nfs/dbraw/zinc/35/57/53/330355753.db2.gz	FPDHEDSZNPRJAL-AEFFLSMTSA-N	0	0	296.414	4.263	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)NC1CCCCCC1	ZINC000125321338	330356147	/nfs/dbraw/zinc/35/61/47/330356147.db2.gz	ACWQHAXRYULBLN-UHFFFAOYSA-N	0	0	292.448	4.169	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N(C)[C@@H](C)c1cc2ccccc2o1	ZINC000116971274	330362770	/nfs/dbraw/zinc/36/27/70/330362770.db2.gz	FLIPIJNGIVHCJG-OLZOCXBDSA-N	0	0	286.375	4.100	20	30		CIEDRN
C=CC[C@H](C)NC(=O)C1c2ccccc2Oc2ccccc21	ZINC000116987478	330362930	/nfs/dbraw/zinc/36/29/30/330362930.db2.gz	AZOMQEPYIKSECK-ZDUSSCGKSA-N	0	0	293.366	4.005	20	30		CIEDRN
C=C(CC)CSc1nnc(-c2cc(C)cc(C)c2)o1	ZINC000536900095	330364529	/nfs/dbraw/zinc/36/45/29/330364529.db2.gz	IHBRJKDBLMYFRN-UHFFFAOYSA-N	0	0	274.389	4.412	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1ccc(N2CCCC2)cc1C	ZINC000424544669	330372921	/nfs/dbraw/zinc/37/29/21/330372921.db2.gz	NWVZFHMWUWCBLJ-UHFFFAOYSA-N	0	0	286.419	4.136	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@H](C)c1ccc(Cl)cc1	ZINC000424547776	330373669	/nfs/dbraw/zinc/37/36/69/330373669.db2.gz	SPSFEXGOJVLIFL-LLVKDONJSA-N	0	0	265.784	4.120	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N(C)Cc1c(F)cccc1Cl	ZINC000424548484	330373923	/nfs/dbraw/zinc/37/39/23/330373923.db2.gz	UOOJWGYWOKEARN-UHFFFAOYSA-N	0	0	283.774	4.040	20	30		CIEDRN
CC[C@]1(C)C[C@H]1C(=O)Nc1cc(C(C)(C)C)sc1C#N	ZINC000536972252	330374832	/nfs/dbraw/zinc/37/48/32/330374832.db2.gz	IILVKQJDQYWASO-MGPLVRAMSA-N	0	0	290.432	4.292	20	30		CIEDRN
CCN(C(=O)CCC(C)(C)C)c1ccc(C#N)c(Cl)c1	ZINC000536972743	330374888	/nfs/dbraw/zinc/37/48/88/330374888.db2.gz	NVUOMABZSOOPOH-UHFFFAOYSA-N	0	0	292.810	4.391	20	30		CIEDRN
C=CCCC[C@@H](C)N1CCO[C@@H](c2ccc(F)c(F)c2)C1	ZINC000536995101	330375306	/nfs/dbraw/zinc/37/53/06/330375306.db2.gz	ODXUIRKLNFXTKM-CXAGYDPISA-N	0	0	295.373	4.083	20	30		CIEDRN
C=CCCC[C@H](C)N1CCO[C@H](c2ccc(F)c(F)c2)C1	ZINC000536995103	330375426	/nfs/dbraw/zinc/37/54/26/330375426.db2.gz	ODXUIRKLNFXTKM-GUYCJALGSA-N	0	0	295.373	4.083	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@H](C)c1ccc(OC(C)C)cc1	ZINC000424561334	330376069	/nfs/dbraw/zinc/37/60/69/330376069.db2.gz	BETMKJYKJOUWLR-CQSZACIVSA-N	0	0	289.419	4.253	20	30		CIEDRN
Cc1cc(C)cc(CSCCCSCC#N)c1	ZINC000119740862	330377988	/nfs/dbraw/zinc/37/79/88/330377988.db2.gz	SLHHOJSSGWJHFM-UHFFFAOYSA-N	0	0	265.447	4.184	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@H](CC)CCC)c1ccccc1	ZINC000119860144	330380400	/nfs/dbraw/zinc/38/04/00/330380400.db2.gz	CCQUHXHTKKUHRS-GDBMZVCRSA-N	0	0	259.393	4.041	20	30		CIEDRN
C[C@H]1CCCC[C@@H]1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000424579433	330385730	/nfs/dbraw/zinc/38/57/30/330385730.db2.gz	UZOFWBRLRIBXTQ-BBRMVZONSA-N	0	0	284.403	4.253	20	30		CIEDRN
CSc1cccc(NCc2cc(C#N)cs2)c1C	ZINC000537024520	330385933	/nfs/dbraw/zinc/38/59/33/330385933.db2.gz	NQGKUPDFXZHAPA-UHFFFAOYSA-N	0	0	274.414	4.262	20	30		CIEDRN
CC(C)(NCc1ccccc1C#N)c1cccc(Cl)c1	ZINC000162813525	330388990	/nfs/dbraw/zinc/38/89/90/330388990.db2.gz	SWXQIMSTVJVXLQ-UHFFFAOYSA-N	0	0	284.790	4.237	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2cc(C)ccc2Cl)CC1	ZINC000120639038	330389789	/nfs/dbraw/zinc/38/97/89/330389789.db2.gz	NHNZARHFUHGGEE-UHFFFAOYSA-N	0	0	278.783	4.078	20	30		CIEDRN
CSc1cccc(NC(=O)Nc2ccc(C#N)cc2)c1C	ZINC000537037696	330393353	/nfs/dbraw/zinc/39/33/53/330393353.db2.gz	VMAMSYHYIGYRDY-UHFFFAOYSA-N	0	0	297.383	4.233	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@H]1CCc2c1cccc2Cl	ZINC000424591705	330394153	/nfs/dbraw/zinc/39/41/53/330394153.db2.gz	AMQRHXCEUYYITM-AWEZNQCLSA-N	0	0	277.795	4.046	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@@H](C)c1cccc(OC(F)F)c1	ZINC000424592256	330394183	/nfs/dbraw/zinc/39/41/83/330394183.db2.gz	OJAAKQQUUQKQAI-NSHDSACASA-N	0	0	297.345	4.068	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H](C)c1cc2ccccc2o1	ZINC000121392960	330399834	/nfs/dbraw/zinc/39/98/34/330399834.db2.gz	YYDZJMAQWHZKBP-ZDUSSCGKSA-N	0	0	283.371	4.378	20	30		CIEDRN
C=C[C@@H](CC(=O)N[C@@H](C)c1ccccc1)c1ccccc1	ZINC000121403809	330400100	/nfs/dbraw/zinc/40/01/00/330400100.db2.gz	GBVSSCGEAXXJQM-HOTGVXAUSA-N	0	0	279.383	4.224	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N(CC)CCc1ccccc1	ZINC000537187307	330413315	/nfs/dbraw/zinc/41/33/15/330413315.db2.gz	AXODTMDYSWQZPQ-MRXNPFEDSA-N	0	0	288.435	4.005	20	30		CIEDRN
C=C[C@@H](CC(=O)NC(C)(C)CCC)c1ccccc1	ZINC000122267571	330417781	/nfs/dbraw/zinc/41/77/81/330417781.db2.gz	ZILTWUSNFPQHKI-AWEZNQCLSA-N	0	0	259.393	4.041	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1ccc(F)cc1C)c1ccccc1	ZINC000122704308	330427485	/nfs/dbraw/zinc/42/74/85/330427485.db2.gz	HAODPZLNZHDELV-CQSZACIVSA-N	0	0	283.346	4.433	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)C1CCC(C)(C)CC1	ZINC000537231442	330429738	/nfs/dbraw/zinc/42/97/38/330429738.db2.gz	PUDUKYYQYWERPY-ZDUSSCGKSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1cc(C)c(F)cc1Cl	ZINC000537233798	330429903	/nfs/dbraw/zinc/42/99/03/330429903.db2.gz	BHBRLTMIWRJGCF-NSHDSACASA-N	0	0	283.774	4.262	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N1C[C@@H](c2ccccc2C)C[C@@H]1C	ZINC000424676580	330444488	/nfs/dbraw/zinc/44/44/88/330444488.db2.gz	HLKKEWHTTDZZIA-HOTGVXAUSA-N	0	0	285.431	4.302	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@H](C)c1ncc(-c2ccccc2)o1	ZINC000424683926	330445396	/nfs/dbraw/zinc/44/53/96/330445396.db2.gz	NCMQWAVODBMIHT-CYBMUJFWSA-N	0	0	298.386	4.121	20	30		CIEDRN
C=CCCCCCN(C)C(=O)C[C@@H]1CCO[C@H](C(C)C)C1	ZINC000514185704	330460300	/nfs/dbraw/zinc/46/03/00/330460300.db2.gz	KGWKXOZMFMYAAX-SJORKVTESA-N	0	0	295.467	4.033	20	30		CIEDRN
CC(C)Sc1nc2c(c(-c3ccco3)c1C#N)CCC2	ZINC000514760148	330464434	/nfs/dbraw/zinc/46/44/34/330464434.db2.gz	VFFOLCDEDIBDLD-UHFFFAOYSA-N	0	0	284.384	4.202	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(COc2ccc(Cl)cc2)no1	ZINC000514816681	330465083	/nfs/dbraw/zinc/46/50/83/330465083.db2.gz	LSHRFZHHYGRFQX-OAHLLOKOSA-N	0	0	292.766	4.156	20	30		CIEDRN
CC(C)c1nc2cc(N[C@@H]3CC[C@@H](C#N)C3)ccc2o1	ZINC000515364012	330476148	/nfs/dbraw/zinc/47/61/48/330476148.db2.gz	XHZYYGGJUGOBMN-VXGBXAGGSA-N	0	0	269.348	4.055	20	30		CIEDRN
CC(C)c1ccc(/C=C/c2ccc(C#N)cn2)cc1[N+](=O)[O-]	ZINC000515420754	330477030	/nfs/dbraw/zinc/47/70/30/330477030.db2.gz	ZTDZPCCDZPDSLA-ZZXKWVIFSA-N	0	0	293.326	4.155	20	30		CIEDRN
C[C@@H](CNc1cccc(C(F)F)c1C#N)CC(F)(F)F	ZINC000515671211	330480895	/nfs/dbraw/zinc/48/08/95/330480895.db2.gz	AVHPLECEVKNAST-MRVPVSSYSA-N	0	0	292.251	4.496	20	30		CIEDRN
CCCOc1cc(C)ccc1NCc1ccc(C#N)cc1F	ZINC000515662287	330481222	/nfs/dbraw/zinc/48/12/22/330481222.db2.gz	KMKSVHZWQXIVQK-UHFFFAOYSA-N	0	0	298.361	4.407	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)c1ccc(CC)cc1	ZINC000515868570	330484449	/nfs/dbraw/zinc/48/44/49/330484449.db2.gz	JOAKECMCLOHNBT-UHFFFAOYSA-N	0	0	297.373	4.217	20	30		CIEDRN
CC(C)(C)CCCCC(=O)Nc1ccccc1C#N	ZINC000516109009	330486646	/nfs/dbraw/zinc/48/66/46/330486646.db2.gz	WNWIBBLBPTWXRS-UHFFFAOYSA-N	0	0	258.365	4.103	20	30		CIEDRN
C=CCCC1(c2nc(-c3ccc(OC)c(C)c3)no2)CC1	ZINC000516115028	330487708	/nfs/dbraw/zinc/48/77/08/330487708.db2.gz	KDLJUGGAJDAPOL-UHFFFAOYSA-N	0	0	284.359	4.051	20	30		CIEDRN
CC[C@@H](C)C[C@H](C)NC(=O)Nc1ccc(C#N)cc1Cl	ZINC000426137383	330500122	/nfs/dbraw/zinc/50/01/22/330500122.db2.gz	GTPVXENRDBTNCN-MNOVXSKESA-N	0	0	293.798	4.158	20	30		CIEDRN
C=CCC(C)(C)c1nc(C2(c3cccc(OC)c3)CC2)no1	ZINC000426625176	330513166	/nfs/dbraw/zinc/51/31/66/330513166.db2.gz	YBIQNSYCUWBXBV-UHFFFAOYSA-N	0	0	298.386	4.012	20	30		CIEDRN
C[C@H](CC#N)Sc1ccccc1NC(=O)CC1(C)CC1	ZINC000428722329	330530302	/nfs/dbraw/zinc/53/03/02/330530302.db2.gz	PGPBSRPWTCCFJQ-GFCCVEGCSA-N	0	0	288.416	4.210	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H](C)c1ccc(OC(C)C)cc1	ZINC000429867467	330555950	/nfs/dbraw/zinc/55/59/50/330555950.db2.gz	QMSNJSGDAZMRQF-CQSZACIVSA-N	0	0	289.419	4.253	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H](C)c1ccccc1Cl	ZINC000429931002	330556584	/nfs/dbraw/zinc/55/65/84/330556584.db2.gz	VQSLSORUEBYYJU-LLVKDONJSA-N	0	0	265.784	4.120	20	30		CIEDRN
C=CCC[C@H](C(=O)N[C@H]1CC12CCCC2)c1ccccc1	ZINC000430225926	330564652	/nfs/dbraw/zinc/56/46/52/330564652.db2.gz	ZNIBJDLTVIYVNZ-IRXDYDNUSA-N	0	0	283.415	4.185	20	30		CIEDRN
C=CCCC(=O)N[C@@H](c1ccccc1C)C(C)(C)C	ZINC000430564695	330569163	/nfs/dbraw/zinc/56/91/63/330569163.db2.gz	CJMXMZLHZULSGI-INIZCTEOSA-N	0	0	259.393	4.165	20	30		CIEDRN
C=CCC[C@@H](NC(=O)c1ccoc1CC)c1ccccc1	ZINC000430788046	330574314	/nfs/dbraw/zinc/57/43/14/330574314.db2.gz	XTLIPBGNHRACKV-MRXNPFEDSA-N	0	0	283.371	4.279	20	30		CIEDRN
C=CC[C@H]1N(C(=O)c2ccoc2CC)CCCC1(C)C	ZINC000430802445	330574541	/nfs/dbraw/zinc/57/45/41/330574541.db2.gz	MJNWKXLPMLJOHB-OAHLLOKOSA-N	0	0	275.392	4.049	20	30		CIEDRN
C=CCC[C@H](NC(=O)N1CC(C)=C[C@H](C)C1)c1ccccc1	ZINC000430903340	330576654	/nfs/dbraw/zinc/57/66/54/330576654.db2.gz	HSLWUPLFDAGMET-YJBOKZPZSA-N	0	0	298.430	4.302	20	30		CIEDRN
N#CCCC[C@@H](NC(=O)Nc1ccccc1)c1ccccc1	ZINC000430932005	330576957	/nfs/dbraw/zinc/57/69/57/330576957.db2.gz	DBJWRMYMKFBCAP-QGZVFWFLSA-N	0	0	293.370	4.243	20	30		CIEDRN
C=CCn1c(SC2CCC2)nnc1-c1ccccc1C	ZINC000430992157	330577658	/nfs/dbraw/zinc/57/76/58/330577658.db2.gz	SETZXMJHMRSXFT-UHFFFAOYSA-N	0	0	285.416	4.084	20	30		CIEDRN
N#Cc1ccc(/C=C\c2csc(Cl)c2Cl)nc1	ZINC000431580272	330586668	/nfs/dbraw/zinc/58/66/68/330586668.db2.gz	SZJJWIVGTAVXMT-RQOWECAXSA-N	0	0	281.167	4.492	20	30		CIEDRN
C=CCCCC(=O)Nc1ncc(-c2ccc(F)cc2)s1	ZINC000432215318	330595085	/nfs/dbraw/zinc/59/50/85/330595085.db2.gz	YMEVUIATGOEBHK-UHFFFAOYSA-N	0	0	290.363	4.244	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)NCc1ccc(C(F)F)cc1	ZINC000432352347	330597905	/nfs/dbraw/zinc/59/79/05/330597905.db2.gz	AVRATDHVHAUWBQ-UHFFFAOYSA-N	0	0	296.361	4.026	20	30		CIEDRN
Cc1c(F)ccc(Cl)c1NCc1cccc(C#N)c1F	ZINC000432708558	330603997	/nfs/dbraw/zinc/60/39/97/330603997.db2.gz	YOYOZLMZARRGOH-UHFFFAOYSA-N	0	0	292.716	4.410	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)Nc1ccc(CSC)cc1	ZINC000432838230	330608974	/nfs/dbraw/zinc/60/89/74/330608974.db2.gz	BWZMXPUDIPXLFJ-UHFFFAOYSA-N	0	0	292.448	4.273	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)Nc1ccc2scnc2c1	ZINC000432844914	330609037	/nfs/dbraw/zinc/60/90/37/330609037.db2.gz	ZLSZJOHOKWEGLL-UHFFFAOYSA-N	0	0	289.404	4.020	20	30		CIEDRN
N#CCCCCN1CC2(CCCC2)c2cccc(F)c21	ZINC000433140700	330618073	/nfs/dbraw/zinc/61/80/73/330618073.db2.gz	JEGRZGLTCMGOPC-UHFFFAOYSA-N	0	0	272.367	4.151	20	30		CIEDRN
CC1(C)CCCN(C(=O)c2cccc3ccsc32)[C@H]1C#N	ZINC000434019016	330634255	/nfs/dbraw/zinc/63/42/55/330634255.db2.gz	UVUXRBGZTLNMFL-AWEZNQCLSA-N	0	0	298.411	4.056	20	30		CIEDRN
C=CCCCC(=O)N1CC[C@@](C)(CCc2ccccc2)C1	ZINC000434254681	330637517	/nfs/dbraw/zinc/63/75/17/330637517.db2.gz	RFOVSXQCCNDGFV-LJQANCHMSA-N	0	0	285.431	4.214	20	30		CIEDRN
C=CCCCCCN(C)C(=O)NC1CCC2(CC2)CC1	ZINC000434339503	330638236	/nfs/dbraw/zinc/63/82/36/330638236.db2.gz	YHXFGDLGKDOYTE-UHFFFAOYSA-N	0	0	278.440	4.097	20	30		CIEDRN
C=CCCCSCc1nccn1-c1ccccc1	ZINC000434627125	330641960	/nfs/dbraw/zinc/64/19/60/330641960.db2.gz	LOERENVAMRORDX-UHFFFAOYSA-N	0	0	258.390	4.072	20	30		CIEDRN
CCc1cccc(C)c1NCc1cc(C#N)ccc1OC	ZINC000434883781	330646135	/nfs/dbraw/zinc/64/61/35/330646135.db2.gz	SUJJXNDYADPEDM-UHFFFAOYSA-N	0	0	280.371	4.050	20	30		CIEDRN
C=CCC[C@@H](NC(=O)NC(C1CC1)C1CC1)c1ccccc1	ZINC000434971064	330646952	/nfs/dbraw/zinc/64/69/52/330646952.db2.gz	GXWACTQCFOBZRI-QGZVFWFLSA-N	0	0	298.430	4.182	20	30		CIEDRN
C=CCOc1cccc(NC(=O)c2ccc(C(C)C)nc2)c1	ZINC000435020992	330648063	/nfs/dbraw/zinc/64/80/63/330648063.db2.gz	TYQRJXGBBTXLDT-UHFFFAOYSA-N	0	0	296.370	4.022	20	30		CIEDRN
CCCC[C@H](CCC)NC(=O)C1(c2cccc(C#N)c2)CC1	ZINC000435359923	330653438	/nfs/dbraw/zinc/65/34/38/330653438.db2.gz	XUFZMTXCJUPLOR-KRWDZBQOSA-N	0	0	298.430	4.065	20	30		CIEDRN
N#Cc1ccc(N[C@H]2C[C@H](c3ccccc3F)C2)c(F)c1	ZINC000435589165	330658132	/nfs/dbraw/zinc/65/81/32/330658132.db2.gz	QNMRLTCQRJWVEY-JOCQHMNTSA-N	0	0	284.309	4.195	20	30		CIEDRN
C=CC[C@H]1N(C(=O)Nc2cccc(F)c2)CCCC1(C)C	ZINC000435680095	330660132	/nfs/dbraw/zinc/66/01/32/330660132.db2.gz	BTRNNNAKTLQDEA-OAHLLOKOSA-N	0	0	290.382	4.424	20	30		CIEDRN
Cc1cc(/C=C\c2nc3ccccc3o2)ccc1C#N	ZINC000435742157	330661597	/nfs/dbraw/zinc/66/15/97/330661597.db2.gz	SSDWBPRBAWCSLW-CLFYSBASSA-N	0	0	260.296	4.178	20	30		CIEDRN
C=CCC[C@H](NC(=O)N1CCCC1(C)C)c1ccccc1	ZINC000435761156	330662324	/nfs/dbraw/zinc/66/23/24/330662324.db2.gz	MDGHTJSBQZKAHA-INIZCTEOSA-N	0	0	286.419	4.278	20	30		CIEDRN
C=CCC[C@H](NC(=O)N[C@H]1CC=CCC1)c1ccccc1	ZINC000435765934	330662440	/nfs/dbraw/zinc/66/24/40/330662440.db2.gz	ZOSBAFDLAXVGOJ-IRXDYDNUSA-N	0	0	284.403	4.102	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1cccc(F)c1SC	ZINC000436056038	330668097	/nfs/dbraw/zinc/66/80/97/330668097.db2.gz	YDMFJIFXDVYVOJ-LLVKDONJSA-N	0	0	281.396	4.022	20	30		CIEDRN
C=CC(C)(C)C(=O)N(C)Cc1cccc(Cl)c1Cl	ZINC000448572793	330677671	/nfs/dbraw/zinc/67/76/71/330677671.db2.gz	KICNJLPXUCWXFQ-UHFFFAOYSA-N	0	0	286.202	4.164	20	30		CIEDRN
C=C1CCN(C(=O)c2ccc(C(C)(C)CC)cc2)CC1	ZINC000510490362	332905226	/nfs/dbraw/zinc/90/52/26/332905226.db2.gz	IWRJEMYRSOVXNY-UHFFFAOYSA-N	0	0	271.404	4.166	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1cc2ccccc2cc1O	ZINC000436532672	330679293	/nfs/dbraw/zinc/67/92/93/330679293.db2.gz	WNKJFDQUCRNQNM-UHFFFAOYSA-N	0	0	297.398	4.364	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1cc(C(C)C)c(O)cc1C	ZINC000436644019	330682122	/nfs/dbraw/zinc/68/21/22/330682122.db2.gz	HELDAGHAHCNLEL-AWEZNQCLSA-N	0	0	289.419	4.299	20	30		CIEDRN
C=C(C)CCc1noc(-c2ccc3ccccc3c2O)n1	ZINC000436685234	330682644	/nfs/dbraw/zinc/68/26/44/330682644.db2.gz	KZWCJQBZKQHMTM-UHFFFAOYSA-N	0	0	280.327	4.104	20	30		CIEDRN
CC(C)c1cccc(NC(=O)[C@@]2(C#N)CC23CCCC3)c1	ZINC000448583474	330690052	/nfs/dbraw/zinc/69/00/52/330690052.db2.gz	SYGPHKFVBMLHQP-SFHVURJKSA-N	0	0	282.387	4.223	20	30		CIEDRN
C=CCCC1(C(=O)N[C@@H]2C[C@H]2c2ccc(Cl)cc2)CC1	ZINC000437359538	330698217	/nfs/dbraw/zinc/69/82/17/330698217.db2.gz	QBFGNPYXIZTUGL-LSDHHAIUSA-N	0	0	289.806	4.059	20	30		CIEDRN
Cc1cc(C#N)ccc1C(=O)Nc1ccc(C(C)C)cc1	ZINC000438893474	330730633	/nfs/dbraw/zinc/73/06/33/330730633.db2.gz	GCCNGKJBMWIQQA-UHFFFAOYSA-N	0	0	278.355	4.242	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)c1ccc(Cl)cc1F	ZINC000439184958	330735296	/nfs/dbraw/zinc/73/52/96/330735296.db2.gz	YHJHVUFBZDPZQB-JTQLQIEISA-N	0	0	269.747	4.044	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1ccc(C2CC2)c(C)c1	ZINC000439372488	330737493	/nfs/dbraw/zinc/73/74/93/330737493.db2.gz	RLYAZUAGHNHJDQ-AWEZNQCLSA-N	0	0	272.392	4.349	20	30		CIEDRN
C=CCCC(=O)N1CCC[C@H](CCCc2ccccc2)C1	ZINC000439700808	330742058	/nfs/dbraw/zinc/74/20/58/330742058.db2.gz	UCJFQIJHDHJPGV-SFHVURJKSA-N	0	0	285.431	4.214	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1ccc(F)c(C2CC2)c1	ZINC000439811655	330743690	/nfs/dbraw/zinc/74/36/90/330743690.db2.gz	NWROTQYPRWUNLU-CQSZACIVSA-N	0	0	288.366	4.276	20	30		CIEDRN
C[C@H](CCC(=O)Nc1ccc(F)c(C#N)c1)c1ccccc1	ZINC000440773157	330755870	/nfs/dbraw/zinc/75/58/70/330755870.db2.gz	SWPVPJKHFMIXOA-CYBMUJFWSA-N	0	0	296.345	4.220	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cc(Cl)cc(F)c2F)CC1	ZINC000441584010	330771075	/nfs/dbraw/zinc/77/10/75/330771075.db2.gz	YTJVLCAMILLQCU-UHFFFAOYSA-N	0	0	285.721	4.303	20	30		CIEDRN
CC[C@H](F)CNc1ccccc1SC[C@H](C)C#N	ZINC000442116283	330774262	/nfs/dbraw/zinc/77/42/62/330774262.db2.gz	AXNAEQNVPZWHTF-NEPJUHHUSA-N	0	0	266.385	4.098	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)[C@@]2(C)CC=CCC2)cc1	ZINC000448666033	330774732	/nfs/dbraw/zinc/77/47/32/330774732.db2.gz	DQVIKNJXOBOPLK-SFHVURJKSA-N	0	0	282.387	4.173	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1cc(Cl)cc(F)c1F	ZINC000442214379	330775054	/nfs/dbraw/zinc/77/50/54/330775054.db2.gz	NEZJBSCCMYZLIF-VIFPVBQESA-N	0	0	288.725	4.094	20	30		CIEDRN
Cc1cc(C#N)ccc1C(=O)N1CC[C@@H](C)c2ccccc21	ZINC000162004534	330777366	/nfs/dbraw/zinc/77/73/66/330777366.db2.gz	ZIQZAFNATHSIPG-CYBMUJFWSA-N	0	0	290.366	4.021	20	30		CIEDRN
Cc1cc(C)c(N[C@@H]2CC[C@@H](C#N)C2)cc1Br	ZINC000442837911	330786079	/nfs/dbraw/zinc/78/60/79/330786079.db2.gz	REJUIQUZAOCPDD-VXGBXAGGSA-N	0	0	293.208	4.170	20	30		CIEDRN
CCc1cc(Br)ccc1N[C@H]1CC[C@@H](C#N)C1	ZINC000442836615	330786087	/nfs/dbraw/zinc/78/60/87/330786087.db2.gz	OCXYPVPWPGYWID-MFKMUULPSA-N	0	0	293.208	4.116	20	30		CIEDRN
Cc1cc(N[C@H]2CC[C@@H](C#N)C2)cc(C)c1Br	ZINC000442855342	330787460	/nfs/dbraw/zinc/78/74/60/330787460.db2.gz	BOJOZMPVZKQCQZ-NEPJUHHUSA-N	0	0	293.208	4.170	20	30		CIEDRN
Cc1nc2cc(Cl)c(N[C@@H]3CC[C@@H](C#N)C3)cc2s1	ZINC000442863601	330788231	/nfs/dbraw/zinc/78/82/31/330788231.db2.gz	DDXPMRUEPMMBCP-NXEZZACHSA-N	0	0	291.807	4.362	20	30		CIEDRN
Cc1ccc(N[C@@H]2CC[C@H](C#N)C2)cc1C(F)(F)F	ZINC000442878827	330789953	/nfs/dbraw/zinc/78/99/53/330789953.db2.gz	VBEYOJFMJLCOLJ-WDEREUQCSA-N	0	0	268.282	4.118	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cc2[nH]ccc2cc1C	ZINC000442931669	330791645	/nfs/dbraw/zinc/79/16/45/330791645.db2.gz	KCPAYDLNZRWESM-MRXNPFEDSA-N	0	0	256.349	4.017	20	30		CIEDRN
C=CCCCCNC(=O)N[C@H](C)c1cc2ccccc2o1	ZINC000443181015	330796087	/nfs/dbraw/zinc/79/60/87/330796087.db2.gz	RNIUIQYSEIZYSN-CYBMUJFWSA-N	0	0	286.375	4.149	20	30		CIEDRN
Cc1ccccc1Oc1ccc(C(F)(F)F)c(C#N)n1	ZINC000443406563	330798997	/nfs/dbraw/zinc/79/89/97/330798997.db2.gz	FIMAGRNUFGJXGE-UHFFFAOYSA-N	0	0	278.233	4.073	20	30		CIEDRN
N#Cc1nc(SC2CCCC2)ccc1C(F)(F)F	ZINC000443408375	330799003	/nfs/dbraw/zinc/79/90/03/330799003.db2.gz	SRNQRHZNWVZBMH-UHFFFAOYSA-N	0	0	272.295	4.007	20	30		CIEDRN
CCc1nc2cc(NCc3ccc(C#N)c(C)c3)ccc2o1	ZINC000443957872	330807853	/nfs/dbraw/zinc/80/78/53/330807853.db2.gz	JQVQASAZLSLWFF-UHFFFAOYSA-N	0	0	291.354	4.182	20	30		CIEDRN
CSc1ccccc1NCc1ccc(C#N)c(C)c1	ZINC000443990381	330808627	/nfs/dbraw/zinc/80/86/27/330808627.db2.gz	QOJFHILKOOBATB-UHFFFAOYSA-N	0	0	268.385	4.201	20	30		CIEDRN
C[C@H](Nc1ncc(C#N)cc1Cl)c1cccc(F)c1F	ZINC000162896232	330811051	/nfs/dbraw/zinc/81/10/51/330811051.db2.gz	PZQVBLIDENMXPM-QMMMGPOBSA-N	0	0	293.704	4.058	20	30		CIEDRN
CC(C)(C#N)c1ccccc1CN1CCCC(C)(C)[C@H]1C#N	ZINC000444741125	330822981	/nfs/dbraw/zinc/82/29/81/330822981.db2.gz	XQOJWUMJLIWCRS-QGZVFWFLSA-N	0	0	295.430	4.002	20	30		CIEDRN
N#Cc1csc(-c2nc(-c3ccc(Cl)s3)no2)c1	ZINC000445571078	330831609	/nfs/dbraw/zinc/83/16/09/330831609.db2.gz	LDOUIWHVWBLJSE-UHFFFAOYSA-N	0	0	293.760	4.052	20	30		CIEDRN
Cc1cc(C)c(C#N)c(SCc2cc(F)cc(F)c2)n1	ZINC000445597698	330832537	/nfs/dbraw/zinc/83/25/37/330832537.db2.gz	ROQAKKJMVCFIHI-UHFFFAOYSA-N	0	0	290.338	4.141	20	30		CIEDRN
N#Cc1ccc(SCc2cc(F)cc(F)c2)cc1	ZINC000445601838	330832684	/nfs/dbraw/zinc/83/26/84/330832684.db2.gz	UKWHAPQJTJRYQA-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
Cc1c(Cl)cnc(N2CCCC3(CCCC3)C2)c1C#N	ZINC000445666596	330834326	/nfs/dbraw/zinc/83/43/26/330834326.db2.gz	VWKWVCRMJSTXNB-UHFFFAOYSA-N	0	0	289.810	4.076	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(Oc2ccccc2)cc1OC	ZINC000158878584	330837301	/nfs/dbraw/zinc/83/73/01/330837301.db2.gz	PVDDJBVZAFQTAB-UHFFFAOYSA-N	0	0	297.354	4.392	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N[C@H]([C@@H](C)CC)C(F)(F)F	ZINC000446278939	330846636	/nfs/dbraw/zinc/84/66/36/330846636.db2.gz	CCYZXCATOUAIIR-SDDRHHMPSA-N	0	0	294.361	4.007	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N[C@@H](CC(F)(F)F)C(C)C	ZINC000446654898	330851378	/nfs/dbraw/zinc/85/13/78/330851378.db2.gz	SRAUVLIQBJSXMV-NEPJUHHUSA-N	0	0	294.361	4.007	20	30		CIEDRN
COc1cc(SC)ccc1NCc1ccc(C#N)c(C)c1	ZINC000447086689	330860949	/nfs/dbraw/zinc/86/09/49/330860949.db2.gz	BDIHTACWSMHJQL-UHFFFAOYSA-N	0	0	298.411	4.209	20	30		CIEDRN
COc1ccccc1SCc1ccc(C#N)c(C)c1	ZINC000447284747	330863455	/nfs/dbraw/zinc/86/34/55/330863455.db2.gz	APFQKNRUEWZYAP-UHFFFAOYSA-N	0	0	269.369	4.168	20	30		CIEDRN
C=CCCCCCSc1nnc(C)n1C(C)C	ZINC000447287602	330863550	/nfs/dbraw/zinc/86/35/50/330863550.db2.gz	KYDONGYSOPYLIU-UHFFFAOYSA-N	0	0	253.415	4.006	20	30		CIEDRN
CSc1ccc(OCc2ccc(C#N)c(C)c2)cc1	ZINC000447318153	330864580	/nfs/dbraw/zinc/86/45/80/330864580.db2.gz	QJBOYVNFWLGCJC-UHFFFAOYSA-N	0	0	269.369	4.168	20	30		CIEDRN
C=CCCCCCOc1ccc2c(c1)CCCC(=O)N2	ZINC000447326209	330864872	/nfs/dbraw/zinc/86/48/72/330864872.db2.gz	NPSPHELGXDLOLL-UHFFFAOYSA-N	0	0	273.376	4.087	20	30		CIEDRN
Cc1cc(COc2ccccc2OC(F)F)ccc1C#N	ZINC000447324368	330864900	/nfs/dbraw/zinc/86/49/00/330864900.db2.gz	MRFBBPXSKVNQLS-UHFFFAOYSA-N	0	0	289.281	4.047	20	30		CIEDRN
C=CCCCN(C)C(=O)N[C@@H](CCC=C)c1ccccc1	ZINC000160401811	330864904	/nfs/dbraw/zinc/86/49/04/330864904.db2.gz	RLCSTNBVPBGCRG-KRWDZBQOSA-N	0	0	286.419	4.302	20	30		CIEDRN
C=CCC[C@H](NC(=O)N1C[C@H]2CCC[C@@H]2C1)c1ccccc1	ZINC000160406500	330865027	/nfs/dbraw/zinc/86/50/27/330865027.db2.gz	AFPVXTJVWAGDTO-KURKYZTESA-N	0	0	298.430	4.135	20	30		CIEDRN
CC[C@H](N[C@H](C)c1nc(C)cs1)c1ccc(C#N)cc1	ZINC000447539976	330868989	/nfs/dbraw/zinc/86/89/89/330868989.db2.gz	BIDRGNYMYHOSBV-DOMZBBRYSA-N	0	0	285.416	4.125	20	30		CIEDRN
Cc1nc2ccc(N[C@@H]3CCC[C@H](C#N)C3)cc2s1	ZINC000447589935	330872008	/nfs/dbraw/zinc/87/20/08/330872008.db2.gz	ZGFOCAIZGHUKOD-NWDGAFQWSA-N	0	0	271.389	4.099	20	30		CIEDRN
Cc1nc2ccc(N[C@H]3CCC[C@H](C#N)C3)cc2s1	ZINC000447589937	330872049	/nfs/dbraw/zinc/87/20/49/330872049.db2.gz	ZGFOCAIZGHUKOD-RYUDHWBXSA-N	0	0	271.389	4.099	20	30		CIEDRN
CC[C@@H](Nc1cnn([C@H](C)C2CC2)c1)c1ccc(C#N)cc1	ZINC000447597765	330872822	/nfs/dbraw/zinc/87/28/22/330872822.db2.gz	GTUZKPKZBFEOJL-FZKQIMNGSA-N	0	0	294.402	4.289	20	30		CIEDRN
CC[C@@H](Nc1ccc(F)c(F)c1)c1ccc(C#N)cc1	ZINC000447606016	330873466	/nfs/dbraw/zinc/87/34/66/330873466.db2.gz	LASSIUAVGHUAKT-MRXNPFEDSA-N	0	0	272.298	4.400	20	30		CIEDRN
C=CCN(CC[C@@H](C)c1ccccc1)CC(F)(F)F	ZINC000447736407	330875634	/nfs/dbraw/zinc/87/56/34/330875634.db2.gz	MCKKXHDUPPQDEX-CYBMUJFWSA-N	0	0	271.326	4.231	20	30		CIEDRN
C=CCCCC(=O)Nc1cc(-c2ccco2)nn1C(C)C	ZINC000447857995	330878803	/nfs/dbraw/zinc/87/88/03/330878803.db2.gz	GTMSCTQINSSNSP-UHFFFAOYSA-N	0	0	287.363	4.019	20	30		CIEDRN
N#Cc1cc(NCc2cc(F)cc(Cl)c2)ccc1F	ZINC000160926940	330879857	/nfs/dbraw/zinc/87/98/57/330879857.db2.gz	OTGMYEPQODYLAB-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C=CCCCNC(=O)N[C@H](CC)c1cccc(Cl)c1	ZINC000447983264	330882114	/nfs/dbraw/zinc/88/21/14/330882114.db2.gz	QFQMVBPLPYIRTG-CQSZACIVSA-N	0	0	280.799	4.057	20	30		CIEDRN
Cc1cc(C#N)ccc1-c1nc(-c2ccccc2Cl)no1	ZINC000160985268	330882451	/nfs/dbraw/zinc/88/24/51/330882451.db2.gz	GSPBHLPEEYMWAI-UHFFFAOYSA-N	0	0	295.729	4.237	20	30		CIEDRN
CC[C@@H]1CCC[C@@H]1C(=O)N(CC)[C@@H](C)c1ccc(C#N)cc1	ZINC000448777981	330883512	/nfs/dbraw/zinc/88/35/12/330883512.db2.gz	QZXIAPAUKHKNLK-LESCRADOSA-N	0	0	298.430	4.294	20	30		CIEDRN
CC1(C#N)CCC(Nc2cccc(OC(F)F)c2)CC1	ZINC000449041964	330894867	/nfs/dbraw/zinc/89/48/67/330894867.db2.gz	PNJBYAKKLAHXPJ-UHFFFAOYSA-N	0	0	280.318	4.172	20	30		CIEDRN
CCSCc1ccc(N[C@H]2CC[C@H](C#N)C2)cc1	ZINC000449597904	330938815	/nfs/dbraw/zinc/93/88/15/330938815.db2.gz	GWYNBJKJMIDRTA-ZFWWWQNUSA-N	0	0	260.406	4.044	20	30		CIEDRN
N#CCc1cccc(N[C@@H]2CCCC[C@H]2C2CC2)c1	ZINC000449692252	330943962	/nfs/dbraw/zinc/94/39/62/330943962.db2.gz	AWNYVILPZWYGRV-DLBZAZTESA-N	0	0	254.377	4.133	20	30		CIEDRN
Cc1cc(C#N)cc(NCc2ncc(C(C)(C)C)s2)c1	ZINC000449759857	330948347	/nfs/dbraw/zinc/94/83/47/330948347.db2.gz	KZNUPLRBPYCHIU-UHFFFAOYSA-N	0	0	285.416	4.233	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@@H](c3ccccc3)C2)CCCC1	ZINC000449815784	330951114	/nfs/dbraw/zinc/95/11/14/330951114.db2.gz	RWUSJSBSJKSUMY-QGZVFWFLSA-N	0	0	283.415	4.139	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H](C)c2cccc(O)c2)CCCCC1	ZINC000449838597	330951751	/nfs/dbraw/zinc/95/17/51/330951751.db2.gz	GXWYKKMOSDUGFM-AWEZNQCLSA-N	0	0	287.403	4.096	20	30		CIEDRN
C=CCC1(C(=O)NC2CC(c3ccccc3)C2)CCCC1	ZINC000449839793	330951763	/nfs/dbraw/zinc/95/17/63/330951763.db2.gz	NOPRSMPVPUPLPR-UHFFFAOYSA-N	0	0	283.415	4.185	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@H](CC)CC(F)(F)F	ZINC000449917589	330954755	/nfs/dbraw/zinc/95/47/55/330954755.db2.gz	VDDHPPZITPAQAL-GFCCVEGCSA-N	0	0	279.346	4.170	20	30		CIEDRN
C=CC(C)(C)C(=O)N1CC[C@H](c2ccccc2)[C@H](CC)C1	ZINC000450020370	330958814	/nfs/dbraw/zinc/95/88/14/330958814.db2.gz	WVKVEOBFMUHHBW-WBVHZDCISA-N	0	0	285.431	4.241	20	30		CIEDRN
C=CCC1(C(=O)N2C[C@@H]3CCCC[C@@H]3C2)CCCCC1	ZINC000450064809	330960233	/nfs/dbraw/zinc/96/02/33/330960233.db2.gz	FLJRUTJZDOLXFD-IYBDPMFKSA-N	0	0	275.436	4.162	20	30		CIEDRN
N#Cc1cccc(COc2ccc(OC(F)(F)F)cc2)c1	ZINC000163125738	330985662	/nfs/dbraw/zinc/98/56/62/330985662.db2.gz	JOMDHBKZXRMNFK-UHFFFAOYSA-N	0	0	293.244	4.036	20	30		CIEDRN
N#Cc1ccc(-c2ccc(OCC3(C#N)CCC3)cc2)cc1	ZINC000450619009	330989668	/nfs/dbraw/zinc/98/96/68/330989668.db2.gz	AFCFOKMCKZLMOX-UHFFFAOYSA-N	0	0	288.350	4.298	20	30		CIEDRN
N#CC1(CSc2cccc(Br)c2)CCC1	ZINC000450827906	331001426	/nfs/dbraw/zinc/00/14/26/331001426.db2.gz	KJESANOEBSQVKF-UHFFFAOYSA-N	0	0	282.206	4.235	20	30		CIEDRN
N#C[C@@H]1CC[C@H](SCc2cccc(Cl)c2)C1	ZINC000450825329	331001332	/nfs/dbraw/zinc/00/13/32/331001332.db2.gz	YFOHQLUQIAXDMY-MFKMUULPSA-N	0	0	251.782	4.265	20	30		CIEDRN
CC(C)c1cnc(S[C@@H]2CC[C@H](C#N)C2)n1C(C)C	ZINC000450843534	331002308	/nfs/dbraw/zinc/00/23/08/331002308.db2.gz	DYXJISAPPCMSHX-QWHCGFSZSA-N	0	0	277.437	4.372	20	30		CIEDRN
CC(C)(C)OC1CC(Sc2ccc(C#N)cc2F)C1	ZINC000450848932	331002771	/nfs/dbraw/zinc/00/27/71/331002771.db2.gz	SVKOJIRPYIZPKH-UHFFFAOYSA-N	0	0	279.380	4.136	20	30		CIEDRN
CC(C)(C)c1cc(CSc2ccccc2C#N)no1	ZINC000450852369	331002878	/nfs/dbraw/zinc/00/28/78/331002878.db2.gz	CVLJFBIPHCXNJD-UHFFFAOYSA-N	0	0	272.373	4.136	20	30		CIEDRN
N#Cc1ccc(SC[C@@H]2CCC(F)(F)C2)c(F)c1	ZINC000450850798	331002883	/nfs/dbraw/zinc/00/28/83/331002883.db2.gz	ZGMKFFSRAOXLBJ-SNVBAGLBSA-N	0	0	271.307	4.225	20	30		CIEDRN
C[C@H]1CCC(=O)[C@@H](Sc2cccc(Cl)c2C#N)C1	ZINC000450899828	331005825	/nfs/dbraw/zinc/00/58/25/331005825.db2.gz	DVDRLALLDQPVEM-XPTSAGLGSA-N	0	0	279.792	4.061	20	30		CIEDRN
CSc1ccc(CS[C@@H]2CC[C@H](C#N)C2)cc1	ZINC000450943387	331008329	/nfs/dbraw/zinc/00/83/29/331008329.db2.gz	SMFZLTMGQCEWGL-GXTWGEPZSA-N	0	0	263.431	4.334	20	30		CIEDRN
CCOC(=O)C1CCC(SCCCC(C)(C)C#N)CC1	ZINC000451016694	331011854	/nfs/dbraw/zinc/01/18/54/331011854.db2.gz	OIXSJYRQMVUPBM-UHFFFAOYSA-N	0	0	297.464	4.171	20	30		CIEDRN
C=CCCCCCOc1ccc(NC(C)=O)c(F)c1F	ZINC000451039068	331013092	/nfs/dbraw/zinc/01/30/92/331013092.db2.gz	CFSHTMSGKGSOBW-UHFFFAOYSA-N	0	0	283.318	4.048	20	30		CIEDRN
C[C@@H](NCc1ccc(F)cc1C#N)c1cccc(C2CC2)c1	ZINC000451108867	331015770	/nfs/dbraw/zinc/01/57/70/331015770.db2.gz	BRPFHAHYMZUUCY-CYBMUJFWSA-N	0	0	294.373	4.426	20	30		CIEDRN
CC(C)(C#N)CCCN1CCc2c(Cl)cc(F)cc2C1	ZINC000451155466	331017991	/nfs/dbraw/zinc/01/79/91/331017991.db2.gz	BRHPZLSKGXEKKA-UHFFFAOYSA-N	0	0	294.801	4.167	20	30		CIEDRN
C=CC(C)(C)C(=O)Nc1ccc(OC(C)C)cc1Cl	ZINC000451212949	331020850	/nfs/dbraw/zinc/02/08/50/331020850.db2.gz	CSXRUNPCCAKLFN-UHFFFAOYSA-N	0	0	281.783	4.278	20	30		CIEDRN
C/C=C/c1ccc(NC(=O)[C@@]2(C#N)CC23CCCC3)cc1	ZINC000451771087	331041545	/nfs/dbraw/zinc/04/15/45/331041545.db2.gz	QPVDHFGGEJYJHH-SRSGJAESSA-N	0	0	280.371	4.132	20	30		CIEDRN
CC(C)(CCC#N)CNC(=O)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000451782368	331041937	/nfs/dbraw/zinc/04/19/37/331041937.db2.gz	YWYYBNWNOXPBHM-DLBZAZTESA-N	0	0	298.430	4.016	20	30		CIEDRN
CC(C)(CCC#N)CNC(=O)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000451782379	331041950	/nfs/dbraw/zinc/04/19/50/331041950.db2.gz	YWYYBNWNOXPBHM-SJORKVTESA-N	0	0	298.430	4.016	20	30		CIEDRN
C=CCC1(C(=O)N2CCC(C)(C3CC3)CC2)CCCC1	ZINC000451830458	331043913	/nfs/dbraw/zinc/04/39/13/331043913.db2.gz	CTILNXIWQQSLHH-UHFFFAOYSA-N	0	0	275.436	4.162	20	30		CIEDRN
C[C@@H](c1ccc(C#N)cc1)N1CC2(CCC2)[C@@H]1c1ccco1	ZINC000451834305	331044257	/nfs/dbraw/zinc/04/42/57/331044257.db2.gz	IUXFNOMICIDRLH-KSSFIOAISA-N	0	0	292.382	4.439	20	30		CIEDRN
C[C@@H](CCCC(F)(F)F)Nc1ccc(F)cc1C#N	ZINC000163479258	331044448	/nfs/dbraw/zinc/04/44/48/331044448.db2.gz	OTYZBDJTOMIORX-VIFPVBQESA-N	0	0	274.261	4.230	20	30		CIEDRN
N#Cc1cc(CN2CC3(CCC3)[C@@H]2c2ccco2)ccc1F	ZINC000451862807	331045350	/nfs/dbraw/zinc/04/53/50/331045350.db2.gz	VRAIVAXBFGXZLW-KRWDZBQOSA-N	0	0	296.345	4.018	20	30		CIEDRN
CC[C@@H]1CCC[C@@H]1C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000452139511	331055631	/nfs/dbraw/zinc/05/56/31/331055631.db2.gz	NVYGSIQQBQYPSN-NJAFHUGGSA-N	0	0	298.430	4.364	20	30		CIEDRN
CC[C@@H]1CCC[C@H]1C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000452139512	331055665	/nfs/dbraw/zinc/05/56/65/331055665.db2.gz	NVYGSIQQBQYPSN-NXHRZFHOSA-N	0	0	298.430	4.364	20	30		CIEDRN
CC[C@@H](C(=O)N[C@H]1CC[C@@H](CC#N)C1)C1CCC(C)CC1	ZINC000452557972	331068744	/nfs/dbraw/zinc/06/87/44/331068744.db2.gz	SLYSUFVHMQRAOX-SSNHOHEISA-N	0	0	290.451	4.037	20	30		CIEDRN
CC(C)C[C@H](C)C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452640233	331070759	/nfs/dbraw/zinc/07/07/59/331070759.db2.gz	AWZDRKGHDAFPTR-NSHDSACASA-N	0	0	278.783	4.027	20	30		CIEDRN
CCC[C@H](C)CC(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452643983	331070923	/nfs/dbraw/zinc/07/09/23/331070923.db2.gz	KRXBONZJGMIUBH-NSHDSACASA-N	0	0	278.783	4.171	20	30		CIEDRN
C[C@@H](CC(C)(C)C)C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452654100	331071232	/nfs/dbraw/zinc/07/12/32/331071232.db2.gz	QAGQIMFTXTWBSB-NSHDSACASA-N	0	0	292.810	4.417	20	30		CIEDRN
C=C(C)CCNC(=O)[C@@H]1C[C@@H]1c1cccc2ccccc21	ZINC000452722579	331074062	/nfs/dbraw/zinc/07/40/62/331074062.db2.gz	KNMMDMGRJNVYHF-QZTJIDSGSA-N	0	0	279.383	4.026	20	30		CIEDRN
C=CC(C)(C)CNC(=O)C[C@H](c1ccccc1)C(F)(F)F	ZINC000452774354	331076092	/nfs/dbraw/zinc/07/60/92/331076092.db2.gz	LDWCXSBBOUCFSB-CYBMUJFWSA-N	0	0	299.336	4.051	20	30		CIEDRN
Cc1cccc(CNc2ccccc2SC[C@@H](C)C#N)n1	ZINC000453086430	331087843	/nfs/dbraw/zinc/08/78/43/331087843.db2.gz	LDYVRHPKHNHVOE-ZDUSSCGKSA-N	0	0	297.427	4.254	20	30		CIEDRN
C=CCC1(c2nc([C@H]3CCCCS3)no2)CCCC1	ZINC000453145004	331093918	/nfs/dbraw/zinc/09/39/18/331093918.db2.gz	MZHVHIXYVOCTLM-GFCCVEGCSA-N	0	0	278.421	4.416	20	30		CIEDRN
C=C[C@@H]1OCC[C@H]1c1nc(-c2ccc(C(C)(C)C)cc2)no1	ZINC000453169505	331096631	/nfs/dbraw/zinc/09/66/31/331096631.db2.gz	SSZVRTDRDJQDMD-CABCVRRESA-N	0	0	298.386	4.093	20	30		CIEDRN
C=CCC1(c2nc(C3CC(F)(F)C3)no2)CCCCC1	ZINC000453183222	331098296	/nfs/dbraw/zinc/09/82/96/331098296.db2.gz	GYGJUNXRYIACAD-UHFFFAOYSA-N	0	0	282.334	4.360	20	30		CIEDRN
C=CCC1(c2nc(-c3ncsc3Cl)no2)CCCC1	ZINC000453184881	331098515	/nfs/dbraw/zinc/09/85/15/331098515.db2.gz	JFXZFGIDPYEJSG-UHFFFAOYSA-N	0	0	295.795	4.234	20	30		CIEDRN
C=C[C@](C)(CC)c1nc([C@H]2CSc3ccccc32)no1	ZINC000453213122	331102158	/nfs/dbraw/zinc/10/21/58/331102158.db2.gz	GWPCRCWEBBLTBA-BLLLJJGKSA-N	0	0	286.400	4.161	20	30		CIEDRN
C=CCCc1noc([C@H]2C[C@@H]2c2ccccc2Cl)n1	ZINC000453228685	331104216	/nfs/dbraw/zinc/10/42/16/331104216.db2.gz	BEHSFZSWWBBIDH-NEPJUHHUSA-N	0	0	274.751	4.113	20	30		CIEDRN
C=CCCc1noc([C@@H](C)c2ccc(Cl)s2)n1	ZINC000453243875	331106606	/nfs/dbraw/zinc/10/66/06/331106606.db2.gz	ZUQPRDSYVNQQOP-QMMMGPOBSA-N	0	0	268.769	4.055	20	30		CIEDRN
C=CCCc1noc(-c2sc3nccc(C)c3c2C)n1	ZINC000453245139	331106635	/nfs/dbraw/zinc/10/66/35/331106635.db2.gz	GSZJZRVAUVMMGH-UHFFFAOYSA-N	0	0	285.372	4.082	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1c(C)cccc1OC)c1ccccc1	ZINC000194985630	331106813	/nfs/dbraw/zinc/10/68/13/331106813.db2.gz	UEJRRRRBXPOVRU-HNNXBMFYSA-N	0	0	295.382	4.302	20	30		CIEDRN
C=CCCc1noc([C@H](C)Sc2ccccc2)n1	ZINC000453247780	331107038	/nfs/dbraw/zinc/10/70/38/331107038.db2.gz	OVJTTXVBOORUMB-NSHDSACASA-N	0	0	260.362	4.042	20	30		CIEDRN
C=CCC[C@@H](NCc1cnc(CCC)o1)c1ccco1	ZINC000453383077	331126079	/nfs/dbraw/zinc/12/60/79/331126079.db2.gz	MEMBPPOCVSBOCQ-CQSZACIVSA-N	0	0	274.364	4.017	20	30		CIEDRN
N#Cc1ccc(CN2CC3(CCCC3)[C@@H]2c2ccccc2)o1	ZINC000453611718	331136540	/nfs/dbraw/zinc/13/65/40/331136540.db2.gz	KZZUPXQSLBIXDH-SFHVURJKSA-N	0	0	292.382	4.269	20	30		CIEDRN
CCCCc1ccc(NC(=O)N[C@H]2CC[C@@H](CC#N)C2)cc1	ZINC000454180278	331141008	/nfs/dbraw/zinc/14/10/08/331141008.db2.gz	YYGHTOFAUVCZMV-RDJZCZTQSA-N	0	0	299.418	4.233	20	30		CIEDRN
C=CCC1(CNC(=O)Nc2ccc(CC#N)cc2)CCCC1	ZINC000454348762	331144643	/nfs/dbraw/zinc/14/46/43/331144643.db2.gz	WBCZVRKPNLXMMW-UHFFFAOYSA-N	0	0	297.402	4.011	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N1C[C@@H](C(C)C)[C@H]1C(C)C	ZINC000454644904	331150310	/nfs/dbraw/zinc/15/03/10/331150310.db2.gz	OSMCNDKHPSIBFB-DOTOQJQBSA-N	0	0	299.418	4.011	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)N1CC[C@H](CC(C)(C)C)C1	ZINC000455000433	331158528	/nfs/dbraw/zinc/15/85/28/331158528.db2.gz	NCOJZBYYXKBPNE-CQSZACIVSA-N	0	0	299.418	4.157	20	30		CIEDRN
C=C(CC)CNC(=O)Nc1c(F)cc(Cl)c(C)c1F	ZINC000455055240	331159731	/nfs/dbraw/zinc/15/97/31/331159731.db2.gz	VMEAYGRZJYLIDQ-UHFFFAOYSA-N	0	0	288.725	4.014	20	30		CIEDRN
C=C(C)CCNC(=O)N[C@H](CC)c1ccc(Cl)s1	ZINC000455303733	331164820	/nfs/dbraw/zinc/16/48/20/331164820.db2.gz	AVFUKDKCHUTCBQ-SNVBAGLBSA-N	0	0	286.828	4.118	20	30		CIEDRN
C=C(C)CCNC(=O)N1CCC[C@@H]1c1cccc(Cl)c1	ZINC000455312536	331165517	/nfs/dbraw/zinc/16/55/17/331165517.db2.gz	PEJPTVRKNWWQFO-OAHLLOKOSA-N	0	0	292.810	4.153	20	30		CIEDRN
C=C(C)CCNC(=O)N1CCC[C@H]1c1ccccc1Cl	ZINC000455317797	331165900	/nfs/dbraw/zinc/16/59/00/331165900.db2.gz	XTYNQYKQRBESQD-HNNXBMFYSA-N	0	0	292.810	4.153	20	30		CIEDRN
C=CC(C)(C)CNC(=O)N1CCC[C@H]1c1ccccc1C	ZINC000455371143	331167582	/nfs/dbraw/zinc/16/75/82/331167582.db2.gz	SCYNCAXRWRQFDZ-INIZCTEOSA-N	0	0	286.419	4.054	20	30		CIEDRN
C=CC(C)(C)CNC(=O)N1CC(C)(C)[C@H]1c1cccs1	ZINC000455378386	331167891	/nfs/dbraw/zinc/16/78/91/331167891.db2.gz	CROBODZUPYWYIB-CYBMUJFWSA-N	0	0	292.448	4.053	20	30		CIEDRN
C=CC(C)(C)CNC(=O)N1CC2(CCC2)[C@@H]1c1ccccc1	ZINC000455380205	331167976	/nfs/dbraw/zinc/16/79/76/331167976.db2.gz	GBNVCKXSSUIURH-INIZCTEOSA-N	0	0	298.430	4.135	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CCC[C@](C)(F)C1	ZINC000455387675	331168328	/nfs/dbraw/zinc/16/83/28/331168328.db2.gz	SQRIXQPZCSJAEW-KRWDZBQOSA-N	0	0	290.382	4.161	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1cccc(-c2ncco2)c1C	ZINC000455532826	331172532	/nfs/dbraw/zinc/17/25/32/331172532.db2.gz	OCKXGOBFPQBYAX-ZDUSSCGKSA-N	0	0	299.374	4.126	20	30		CIEDRN
C=CCN(CC=C)C(=O)Nc1cc(C)c(C)cc1Cl	ZINC000455736345	331176640	/nfs/dbraw/zinc/17/66/40/331176640.db2.gz	UQTOLLIKJNEYNE-UHFFFAOYSA-N	0	0	278.783	4.163	20	30		CIEDRN
C=CCN(CC=C)C(=O)Nc1ccc(CSCC)cc1	ZINC000455869119	331179220	/nfs/dbraw/zinc/17/92/20/331179220.db2.gz	JLEZAKLLVPXMEY-UHFFFAOYSA-N	0	0	290.432	4.146	20	30		CIEDRN
CC(C)=CCC[C@@H](C)NC(=O)Nc1cccc(CC#N)c1	ZINC000455909245	331180556	/nfs/dbraw/zinc/18/05/56/331180556.db2.gz	RNYNXMAFQUUZLL-CQSZACIVSA-N	0	0	285.391	4.009	20	30		CIEDRN
CCC[C@H](NC(=O)Nc1cccc(CC#N)c1)C(C)(C)C	ZINC000455911325	331180679	/nfs/dbraw/zinc/18/06/79/331180679.db2.gz	WEBPFSWTKNFIOA-HNNXBMFYSA-N	0	0	287.407	4.089	20	30		CIEDRN
CCC[C@@H](NC(=O)Nc1cccc(CC#N)c1)C(C)(C)C	ZINC000455911337	331180757	/nfs/dbraw/zinc/18/07/57/331180757.db2.gz	WEBPFSWTKNFIOA-OAHLLOKOSA-N	0	0	287.407	4.089	20	30		CIEDRN
CCC[C@H]1[C@@H](C)CCCN1C(=O)Nc1cccc(CC#N)c1	ZINC000455924319	331181299	/nfs/dbraw/zinc/18/12/99/331181299.db2.gz	VNBUXZITSBIFCK-YOEHRIQHSA-N	0	0	299.418	4.185	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1	ZINC000456015622	331182520	/nfs/dbraw/zinc/18/25/20/331182520.db2.gz	ATSCNWWNORLJBI-OWCLPIDISA-N	0	0	289.806	4.011	20	30		CIEDRN
CCC[C@@H](CC1CCCC1)C(=O)N[C@H]1CC[C@@H](CC#N)C1	ZINC000456046691	331183263	/nfs/dbraw/zinc/18/32/63/331183263.db2.gz	JSQNWZITGKKZHB-ULQDDVLXSA-N	0	0	290.451	4.182	20	30		CIEDRN
C=CCCCC(=O)Nc1cc(OCC)ccc1Cl	ZINC000456045426	331183291	/nfs/dbraw/zinc/18/32/91/331183291.db2.gz	LJDGRZXZQQBZOI-UHFFFAOYSA-N	0	0	267.756	4.034	20	30		CIEDRN
C=CC(C)(C)CNC(=O)c1ccc([C@H](C)C(F)(F)F)cc1	ZINC000456118214	331184676	/nfs/dbraw/zinc/18/46/76/331184676.db2.gz	GTDOKZWQFLRNNW-NSHDSACASA-N	0	0	299.336	4.294	20	30		CIEDRN
C=CC(C)(C)CNC(=O)c1ccc([C@@H](C)C(F)(F)F)cc1	ZINC000456118213	331184726	/nfs/dbraw/zinc/18/47/26/331184726.db2.gz	GTDOKZWQFLRNNW-LLVKDONJSA-N	0	0	299.336	4.294	20	30		CIEDRN
C=CCC1(C(=O)N2C[C@@H](C3CC3)[C@H]2C2CC2)CCCCC1	ZINC000456259492	331187699	/nfs/dbraw/zinc/18/76/99/331187699.db2.gz	RKSOCEKLZDKFCV-DLBZAZTESA-N	0	0	287.447	4.160	20	30		CIEDRN
C=CCC1(NC(=O)c2cscc2C)CCCCC1	ZINC000456365905	331191132	/nfs/dbraw/zinc/19/11/32/331191132.db2.gz	LVJPVLPQVQIUTD-UHFFFAOYSA-N	0	0	263.406	4.065	20	30		CIEDRN
C=CCC1(NC(=O)c2sccc2C)CCCCC1	ZINC000456368606	331191280	/nfs/dbraw/zinc/19/12/80/331191280.db2.gz	ATLZBLPQDGJTAS-UHFFFAOYSA-N	0	0	263.406	4.065	20	30		CIEDRN
C=CCC1(CNC(=O)c2c(F)cccc2Cl)CCCC1	ZINC000456489353	331194081	/nfs/dbraw/zinc/19/40/81/331194081.db2.gz	TVQMLCZVZWXFCZ-UHFFFAOYSA-N	0	0	295.785	4.345	20	30		CIEDRN
N#CCC[C@@H](Nc1nccc2occc21)c1ccccc1	ZINC000164301791	331196925	/nfs/dbraw/zinc/19/69/25/331196925.db2.gz	RWHNCRAKTCJMKQ-OAHLLOKOSA-N	0	0	277.327	4.285	20	30		CIEDRN
CC[C@H](NC(=O)C[C@H](CC#N)c1ccccc1)C1CCCC1	ZINC000456656318	331198446	/nfs/dbraw/zinc/19/84/46/331198446.db2.gz	IVQBDMIMWZUTBL-ROUUACIJSA-N	0	0	298.430	4.159	20	30		CIEDRN
CCCc1cc(C(=O)Nc2cccc(CC#N)c2)sc1C	ZINC000456731334	331199417	/nfs/dbraw/zinc/19/94/17/331199417.db2.gz	MFEQLJLAOCMPGS-UHFFFAOYSA-N	0	0	298.411	4.327	20	30		CIEDRN
Cc1ccc(CCCC(=O)Nc2cccc(CC#N)c2)s1	ZINC000456750151	331199972	/nfs/dbraw/zinc/19/99/72/331199972.db2.gz	LSQCCSLDOXMGDE-UHFFFAOYSA-N	0	0	298.411	4.084	20	30		CIEDRN
CC(C)CN(C(=O)CCCC#N)c1cccc(Cl)c1	ZINC000456791495	331204113	/nfs/dbraw/zinc/20/41/13/331204113.db2.gz	YVVPZYMTKYXDTA-UHFFFAOYSA-N	0	0	278.783	4.023	20	30		CIEDRN
C=C(CC)CNC(=O)[C@H](C)c1ccc2ccccc2c1	ZINC000456809312	331204706	/nfs/dbraw/zinc/20/47/06/331204706.db2.gz	BHHFYLPVOTUMBY-CQSZACIVSA-N	0	0	267.372	4.026	20	30		CIEDRN
C=C(CC)CNC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000456828239	331206297	/nfs/dbraw/zinc/20/62/97/331206297.db2.gz	DONBMFUDRXSQCS-JSGCOSHPSA-N	0	0	295.785	4.055	20	30		CIEDRN
C=C(CC)CNC(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000456828229	331206301	/nfs/dbraw/zinc/20/63/01/331206301.db2.gz	DONBMFUDRXSQCS-GXTWGEPZSA-N	0	0	295.785	4.055	20	30		CIEDRN
C=C(CC)CNC(=O)c1ccc([C@@H](C)C(F)(F)F)cc1	ZINC000456833244	331206897	/nfs/dbraw/zinc/20/68/97/331206897.db2.gz	ZJTCQPIQSXXJSZ-LLVKDONJSA-N	0	0	285.309	4.048	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@](C)(Cc1ccccc1)C1CC1	ZINC000457052112	331210986	/nfs/dbraw/zinc/21/09/86/331210986.db2.gz	SUGDMONFXRKPBN-HNAYVOBHSA-N	0	0	285.431	4.116	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@H](C1CC1)C1CCC1)c1ccccc1	ZINC000457246925	331217173	/nfs/dbraw/zinc/21/71/73/331217173.db2.gz	OGBSOZYKQHLWAF-MSOLQXFVSA-N	0	0	283.415	4.041	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1Cc2sccc2CC1(C)C	ZINC000457321083	331219015	/nfs/dbraw/zinc/21/90/15/331219015.db2.gz	SFNBPIJBADEZGQ-GFCCVEGCSA-N	0	0	277.433	4.014	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1Cc2sccc2CC1(C)C	ZINC000457321084	331219016	/nfs/dbraw/zinc/21/90/16/331219016.db2.gz	SFNBPIJBADEZGQ-LBPRGKRZSA-N	0	0	277.433	4.014	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)[C@H](CC)CC(F)F)c1	ZINC000457545484	331226537	/nfs/dbraw/zinc/22/65/37/331226537.db2.gz	WCDQEXSKKRSSML-GFCCVEGCSA-N	0	0	297.345	4.261	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)[C@@H](CC)CC(F)F	ZINC000457576867	331227552	/nfs/dbraw/zinc/22/75/52/331227552.db2.gz	XAOVCHRIIBRYLW-AWEZNQCLSA-N	0	0	287.394	4.263	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)[C@H](CC)CC(F)F	ZINC000457576870	331227617	/nfs/dbraw/zinc/22/76/17/331227617.db2.gz	XAOVCHRIIBRYLW-CQSZACIVSA-N	0	0	287.394	4.263	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)[C@H](CC)CC(F)F)CCCC1(C)C	ZINC000457750092	331233221	/nfs/dbraw/zinc/23/32/21/331233221.db2.gz	BWISPKGDBFJHGP-OLZOCXBDSA-N	0	0	287.394	4.261	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)[C@H](C)CC(F)(F)F)CCCC1(C)C	ZINC000457760010	331233493	/nfs/dbraw/zinc/23/34/93/331233493.db2.gz	KUQCPDKXAQNDCB-NEPJUHHUSA-N	0	0	291.357	4.168	20	30		CIEDRN
C=CC[C@H]1N(C(=O)c2[nH]ccc2C2CC2)CCCC1(C)C	ZINC000457763665	331233627	/nfs/dbraw/zinc/23/36/27/331233627.db2.gz	NIOJVLVDGRITPC-OAHLLOKOSA-N	0	0	286.419	4.099	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)[C@@H](C)CC(F)(F)F	ZINC000457771828	331233959	/nfs/dbraw/zinc/23/39/59/331233959.db2.gz	JGDQZOWMWVBJDO-ZDUSSCGKSA-N	0	0	299.336	4.180	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)[C@H](C)C1CCC1	ZINC000457777118	331234098	/nfs/dbraw/zinc/23/40/98/331234098.db2.gz	NFAJQQVEFZFGKR-CYBMUJFWSA-N	0	0	257.377	4.180	20	30		CIEDRN
C=CCC1(NC(=O)[C@@H](CC)CC(F)F)CCCCC1	ZINC000457880037	331236892	/nfs/dbraw/zinc/23/68/92/331236892.db2.gz	QELOJCJLBIHTGH-LBPRGKRZSA-N	0	0	273.367	4.063	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc(OC)c(SC)c1	ZINC000457896196	331237199	/nfs/dbraw/zinc/23/71/99/331237199.db2.gz	CSBWJXLOGDHMNR-UHFFFAOYSA-N	0	0	291.416	4.124	20	30		CIEDRN
CC(C)(CC#N)CNC(=O)CC(C)(C)C1CCCCC1	ZINC000458044342	331241560	/nfs/dbraw/zinc/24/15/60/331241560.db2.gz	RGQNBDBGCNZMPA-UHFFFAOYSA-N	0	0	278.440	4.039	20	30		CIEDRN
C=CCC[C@@H](C(=O)NCCC1(C)CC1)c1ccccc1	ZINC000471229452	331242471	/nfs/dbraw/zinc/24/24/71/331242471.db2.gz	BLIWTVYXYDOGCK-MRXNPFEDSA-N	0	0	271.404	4.043	20	30		CIEDRN
C=CCCC(=O)N1CC2(CCCCC2)[C@H]1c1ccccc1	ZINC000458123304	331243470	/nfs/dbraw/zinc/24/34/70/331243470.db2.gz	JPRMUTWOMLNJMW-GOSISDBHSA-N	0	0	283.415	4.487	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N(C)C1CC(C)(C)C1	ZINC000458180776	331244396	/nfs/dbraw/zinc/24/43/96/331244396.db2.gz	HDLZCTVRSGXKGX-UHFFFAOYSA-N	0	0	289.444	4.225	20	30		CIEDRN
CCC[C@@H](NC(=O)[C@@H](C)c1cccc(C#N)c1)C1CCCC1	ZINC000458314883	331248255	/nfs/dbraw/zinc/24/82/55/331248255.db2.gz	DALKNURXZODNBU-KBXCAEBGSA-N	0	0	298.430	4.137	20	30		CIEDRN
CCC1(NC(=O)N[C@H](CCC#N)c2ccccc2)CCCC1	ZINC000458561908	331253048	/nfs/dbraw/zinc/25/30/48/331253048.db2.gz	BWOYSOVEGLIREG-MRXNPFEDSA-N	0	0	299.418	4.053	20	30		CIEDRN
CCC1(NC(=O)N[C@@H](CCC#N)c2ccccc2)CCCC1	ZINC000458561907	331253049	/nfs/dbraw/zinc/25/30/49/331253049.db2.gz	BWOYSOVEGLIREG-INIZCTEOSA-N	0	0	299.418	4.053	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000458798208	331259977	/nfs/dbraw/zinc/25/99/77/331259977.db2.gz	HQIGLMUIXBSVCI-KRWDZBQOSA-N	0	0	299.418	4.029	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000458798209	331259986	/nfs/dbraw/zinc/25/99/86/331259986.db2.gz	HQIGLMUIXBSVCI-QGZVFWFLSA-N	0	0	299.418	4.029	20	30		CIEDRN
CCN(CC#N)Cc1cc(-c2ccccc2C)ccc1OC	ZINC000459319662	331276071	/nfs/dbraw/zinc/27/60/71/331276071.db2.gz	DHCYZLUHYNJSOJ-UHFFFAOYSA-N	0	0	294.398	4.016	20	30		CIEDRN
N#C[C@@H]1CCC[C@H]1NCc1ccc(-c2ccsc2)cc1	ZINC000459452311	331282043	/nfs/dbraw/zinc/28/20/43/331282043.db2.gz	BLJAQORRASWMHI-DOTOQJQBSA-N	0	0	282.412	4.197	20	30		CIEDRN
Cc1cc2ccccc2c(NC(=O)NCC(C)(C)CC#N)c1	ZINC000459602003	331290178	/nfs/dbraw/zinc/29/01/78/331290178.db2.gz	DHVKDHGRFRACPY-UHFFFAOYSA-N	0	0	295.386	4.210	20	30		CIEDRN
C=CCOc1ccc(CN2CC(C)(CC(F)(F)F)C2)cc1	ZINC000459637737	331291624	/nfs/dbraw/zinc/29/16/24/331291624.db2.gz	LVGCCBIPRYWJSU-UHFFFAOYSA-N	0	0	299.336	4.026	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(C)cc2OC)CCCC1	ZINC000460004688	331304266	/nfs/dbraw/zinc/30/42/66/331304266.db2.gz	CSKLRRACONGOKU-UHFFFAOYSA-N	0	0	273.376	4.079	20	30		CIEDRN
CC[C@@H](C(=O)N(CC#N)C1CCCC1)C1CCC(C)CC1	ZINC000461031192	331310702	/nfs/dbraw/zinc/31/07/02/331310702.db2.gz	ZHCPOTGJIJLFEX-VMBOVVBDSA-N	0	0	290.451	4.134	20	30		CIEDRN
CC[C@H](C(=O)N(CC#N)C1CCCC1)C1CCC(C)CC1	ZINC000461031191	331310725	/nfs/dbraw/zinc/31/07/25/331310725.db2.gz	ZHCPOTGJIJLFEX-DQPZFDDXSA-N	0	0	290.451	4.134	20	30		CIEDRN
C=CCOCCCSC[C@@H]1C[C@H]1c1ccccc1	ZINC000461246025	331312009	/nfs/dbraw/zinc/31/20/09/331312009.db2.gz	MLKGZIQKWBKYGF-HOTGVXAUSA-N	0	0	262.418	4.116	20	30		CIEDRN
C=C1CCN(C(=O)[C@H](CC)C2CCC(C)CC2)CC1	ZINC000461656620	331313922	/nfs/dbraw/zinc/31/39/22/331313922.db2.gz	BQEVMCVRNLXOAD-AVVWSFFYSA-N	0	0	263.425	4.018	20	30		CIEDRN
Cc1nc(N[C@H](c2ccccc2)C2CC2)c(Cl)cc1C#N	ZINC000461738317	331314301	/nfs/dbraw/zinc/31/43/01/331314301.db2.gz	ZBYGYHIARQYSKI-MRXNPFEDSA-N	0	0	297.789	4.478	20	30		CIEDRN
CSc1ccc(NC(=O)[C@@H](C)c2cccc(C#N)c2)cc1	ZINC000461803263	331314859	/nfs/dbraw/zinc/31/48/59/331314859.db2.gz	PHICXYCKANWYOR-LBPRGKRZSA-N	0	0	296.395	4.022	20	30		CIEDRN
CCC1CCC(N(C)C(=O)[C@H](C)c2cccc(C#N)c2)CC1	ZINC000461899356	331315210	/nfs/dbraw/zinc/31/52/10/331315210.db2.gz	IXIIEZHROFNWRY-KSTDHSDQSA-N	0	0	298.430	4.089	20	30		CIEDRN
Cc1nc(N2CCc3ccccc3[C@@H]2C)c(Cl)cc1C#N	ZINC000461933379	331315615	/nfs/dbraw/zinc/31/56/15/331315615.db2.gz	FSKILTRBLFGIHL-LBPRGKRZSA-N	0	0	297.789	4.039	20	30		CIEDRN
Cc1nc(Nc2ccc3[nH]ccc3c2)c(Cl)cc1C#N	ZINC000461958035	331316199	/nfs/dbraw/zinc/31/61/99/331316199.db2.gz	LKZIXUYZGFWHEI-UHFFFAOYSA-N	0	0	282.734	4.140	20	30		CIEDRN
CCCCCN(CCCCC)C(=O)N[C@H]1CCC[C@@H]1C#N	ZINC000461961888	331316282	/nfs/dbraw/zinc/31/62/82/331316282.db2.gz	WISJIRFJCCZVCJ-CVEARBPZSA-N	0	0	293.455	4.071	20	30		CIEDRN
Cc1nc(N2C[C@@H](C)[C@H]2c2ccccc2)c(Cl)cc1C#N	ZINC000461966784	331316422	/nfs/dbraw/zinc/31/64/22/331316422.db2.gz	PBEPZLSLAQXMKY-BZNIZROVSA-N	0	0	297.789	4.113	20	30		CIEDRN
CCCC[C@@H]1CCC[C@H]1NC(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000462021381	331316843	/nfs/dbraw/zinc/31/68/43/331316843.db2.gz	VNSKNEJOCDWOTC-YXJHDRRASA-N	0	0	298.430	4.137	20	30		CIEDRN
C=C(C)CN(CC)C(=O)NCc1ccc2sccc2c1	ZINC000462165894	331317993	/nfs/dbraw/zinc/31/79/93/331317993.db2.gz	RDDBPSRGXRIAPY-UHFFFAOYSA-N	0	0	288.416	4.009	20	30		CIEDRN
C[C@@H](C(=O)NCCCCC1CCCC1)c1cccc(C#N)c1	ZINC000462183150	331318085	/nfs/dbraw/zinc/31/80/85/331318085.db2.gz	RVUGMHVDSWBSHC-OAHLLOKOSA-N	0	0	298.430	4.138	20	30		CIEDRN
CCC[C@@]1(C)CCCN(C(=O)[C@H](C)c2cccc(C#N)c2)C1	ZINC000462194232	331318229	/nfs/dbraw/zinc/31/82/29/331318229.db2.gz	ZUNHDJWDBUMLAY-BEFAXECRSA-N	0	0	298.430	4.091	20	30		CIEDRN
CC[C@@H]1CCCC[C@@H]1N(C)C(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000462202384	331318334	/nfs/dbraw/zinc/31/83/34/331318334.db2.gz	WCYDMKZVGKAZDY-LESCRADOSA-N	0	0	298.430	4.089	20	30		CIEDRN
CC[C@H](C)[C@@H]1CCCCN1C(=O)[C@H](C)c1cccc(C#N)c1	ZINC000462211183	331318441	/nfs/dbraw/zinc/31/84/41/331318441.db2.gz	SALQIUUYZULRQN-DAYGRLMNSA-N	0	0	298.430	4.089	20	30		CIEDRN
CCC[C@H](C)[C@@H]1CCCN1C(=O)[C@H](C)c1cccc(C#N)c1	ZINC000462244156	331318754	/nfs/dbraw/zinc/31/87/54/331318754.db2.gz	DDCDQNTYVJUGEP-DAYGRLMNSA-N	0	0	298.430	4.089	20	30		CIEDRN
CCCCC[C@H]1CCCN1C(=O)[C@H](C)c1cccc(C#N)c1	ZINC000462256426	331318757	/nfs/dbraw/zinc/31/87/57/331318757.db2.gz	SSIWQVOMKBKWSI-QAPCUYQASA-N	0	0	298.430	4.233	20	30		CIEDRN
CC(C)C[C@H](C)C(=O)Nc1sc2c(c1C#N)CCCC2	ZINC000462382613	331321090	/nfs/dbraw/zinc/32/10/90/331321090.db2.gz	BUNHNLOXBRELSJ-NSHDSACASA-N	0	0	290.432	4.119	20	30		CIEDRN
C[C@H](C1CCCCC1)N(C)C(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000462396910	331321354	/nfs/dbraw/zinc/32/13/54/331321354.db2.gz	LLQUHPPILBHXFT-LSDHHAIUSA-N	0	0	298.430	4.089	20	30		CIEDRN
CC#CCCSc1nnc(-c2ccccc2)n1[C@H](C)CC	ZINC000462413147	331321557	/nfs/dbraw/zinc/32/15/57/331321557.db2.gz	AATTWSJPKHBTSF-CQSZACIVSA-N	0	0	299.443	4.422	20	30		CIEDRN
N#C[C@@H](NC(=O)c1cccc(C2CCC2)c1)C1CCCCC1	ZINC000462555199	331323458	/nfs/dbraw/zinc/32/34/58/331323458.db2.gz	REZJPQZUXJRBDN-GOSISDBHSA-N	0	0	296.414	4.156	20	30		CIEDRN
COc1ccc(OCc2ccc(C#N)cc2)c2ccccc12	ZINC000462652120	331324618	/nfs/dbraw/zinc/32/46/18/331324618.db2.gz	BHCQTLMLNJUVJO-UHFFFAOYSA-N	0	0	289.334	4.299	20	30		CIEDRN
Cc1ccccc1[C@H]1C[C@H](C)N(c2ccc(F)cc2C#N)C1	ZINC000462852300	331332627	/nfs/dbraw/zinc/33/26/27/331332627.db2.gz	LCWSYXYYNWSHAA-HOCLYGCPSA-N	0	0	294.373	4.388	20	30		CIEDRN
CS[C@@H]1CCC[C@H](Nc2c(Cl)cccc2C#N)C1	ZINC000462868840	331333302	/nfs/dbraw/zinc/33/33/02/331333302.db2.gz	STDINNJWZAKSLM-NWDGAFQWSA-N	0	0	280.824	4.298	20	30		CIEDRN
N#Cc1cccc(Cl)c1N[C@H]1CSc2ccccc21	ZINC000462875890	331333725	/nfs/dbraw/zinc/33/37/25/331333725.db2.gz	UPBDVFSZKFLJGB-ZDUSSCGKSA-N	0	0	286.787	4.471	20	30		CIEDRN
C[C@H](CNc1cccc(F)c1C#N)Cc1cccs1	ZINC000462913928	331334012	/nfs/dbraw/zinc/33/40/12/331334012.db2.gz	VSYYAVOMXLGUEM-NSHDSACASA-N	0	0	274.364	4.050	20	30		CIEDRN
CC[C@@H](C)[C@@H](Nc1ccc(C#N)cn1)c1ccc(Cl)cc1	ZINC000462890978	331334026	/nfs/dbraw/zinc/33/40/26/331334026.db2.gz	PGWRCGXNHXRGFO-SJKOYZFVSA-N	0	0	299.805	4.228	20	30		CIEDRN
C[C@H]1CN(c2cccc(F)c2C#N)CC[C@H]1c1ccccc1	ZINC000462903144	331334420	/nfs/dbraw/zinc/33/44/20/331334420.db2.gz	QSBAWZORKBBBDW-GOEBONIOSA-N	0	0	294.373	4.327	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H]1CCC[C@H]1CCCC	ZINC000464443540	331360767	/nfs/dbraw/zinc/36/07/67/331360767.db2.gz	RLTFBIJOESFEJD-ZNMIVQPWSA-N	0	0	251.414	4.064	20	30		CIEDRN
Cc1cc(C#N)ccc1C(=O)N[C@@H]1CCCCC12CCCC2	ZINC000462964036	331335877	/nfs/dbraw/zinc/33/58/77/331335877.db2.gz	AJELFIUDZDZOSN-QGZVFWFLSA-N	0	0	296.414	4.100	20	30		CIEDRN
Cc1cc(C#N)ccc1C(=O)N[C@H]1CCCCC12CCCC2	ZINC000462964035	331336138	/nfs/dbraw/zinc/33/61/38/331336138.db2.gz	AJELFIUDZDZOSN-KRWDZBQOSA-N	0	0	296.414	4.100	20	30		CIEDRN
CCCNc1ccc(C#N)cc1NC(=O)[C@H](C)CC(C)C	ZINC000462989893	331336417	/nfs/dbraw/zinc/33/64/17/331336417.db2.gz	HULJHKNYMKLBIS-CYBMUJFWSA-N	0	0	287.407	4.001	20	30		CIEDRN
C[C@H](CNc1ccc(F)cc1C#N)c1ccc(F)cc1F	ZINC000463025752	331337398	/nfs/dbraw/zinc/33/73/98/331337398.db2.gz	WXLTVRAERCSZEJ-SNVBAGLBSA-N	0	0	290.288	4.191	20	30		CIEDRN
C[C@@H](CNc1cccc(F)c1C#N)c1ccc(F)cc1F	ZINC000463027115	331337478	/nfs/dbraw/zinc/33/74/78/331337478.db2.gz	CFSLZHSIVCWZNX-JTQLQIEISA-N	0	0	290.288	4.191	20	30		CIEDRN
C=CCn1c(SCC2CCC2)nnc1-c1cccc(C)c1	ZINC000463047557	331338623	/nfs/dbraw/zinc/33/86/23/331338623.db2.gz	HQNAQGPJBLEGTP-UHFFFAOYSA-N	0	0	299.443	4.332	20	30		CIEDRN
N#Cc1ccc(NCCc2c[nH]c3ccc(Cl)cc23)cc1	ZINC000463069409	331339226	/nfs/dbraw/zinc/33/92/26/331339226.db2.gz	LQUCZVMKHUMIGO-UHFFFAOYSA-N	0	0	295.773	4.348	20	30		CIEDRN
C[C@@H](CNc1ccc(C#N)cc1)Oc1ccccc1Cl	ZINC000463067409	331339261	/nfs/dbraw/zinc/33/92/61/331339261.db2.gz	DOVKRAVMDDIBCK-LBPRGKRZSA-N	0	0	286.762	4.091	20	30		CIEDRN
Cc1ccc(CC[C@@H](C)Nc2ccc(C#N)cc2F)o1	ZINC000463078043	331339661	/nfs/dbraw/zinc/33/96/61/331339661.db2.gz	UYJADYAQERNHEL-LLVKDONJSA-N	0	0	272.323	4.032	20	30		CIEDRN
C[C@@H]1C[C@@H](c2cccc(F)c2)N(c2cccc(F)c2C#N)C1	ZINC000463075859	331339669	/nfs/dbraw/zinc/33/96/69/331339669.db2.gz	FFWCRRFCNKSUQN-XIKOKIGWSA-N	0	0	298.336	4.424	20	30		CIEDRN
Cc1ccc2sc(C(=O)Nc3sccc3C#N)cc2c1	ZINC000463109508	331340547	/nfs/dbraw/zinc/34/05/47/331340547.db2.gz	WNYXMKWUDDAMJP-UHFFFAOYSA-N	0	0	298.392	4.395	20	30		CIEDRN
CC(C)Oc1cc(F)ccc1N[C@H]1CCC[C@H](C#N)C1	ZINC000463245811	331344029	/nfs/dbraw/zinc/34/40/29/331344029.db2.gz	UXACFFPDWPWIDT-JSGCOSHPSA-N	0	0	276.355	4.107	20	30		CIEDRN
C=CCC[C@H](C(=O)N(CCC)CC1CC1)c1ccccc1	ZINC000463261742	331344616	/nfs/dbraw/zinc/34/46/16/331344616.db2.gz	IZWCSYCFUGBWTN-SFHVURJKSA-N	0	0	285.431	4.385	20	30		CIEDRN
CC(C)[C@@H](C(=O)Nc1ccc(F)c(C#N)c1)c1ccccc1	ZINC000463483068	331348448	/nfs/dbraw/zinc/34/84/48/331348448.db2.gz	VZQIFZXAZNKNMZ-QGZVFWFLSA-N	0	0	296.345	4.076	20	30		CIEDRN
CC(C)N(C(=O)[C@H](C)c1cccc(C#N)c1)C1CCCCC1	ZINC000463603905	331350035	/nfs/dbraw/zinc/35/00/35/331350035.db2.gz	ZDUSPKNLPADWFO-OAHLLOKOSA-N	0	0	298.430	4.231	20	30		CIEDRN
Cc1ccc([C@@H](C)Nc2ccc([N+](=O)[O-])c(C#N)c2)cc1C	ZINC000463651293	331350185	/nfs/dbraw/zinc/35/01/85/331350185.db2.gz	SZDDLJSQAGXYPT-CYBMUJFWSA-N	0	0	295.342	4.256	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1cccc(C2CCC2)c1	ZINC000463832173	331352246	/nfs/dbraw/zinc/35/22/46/331352246.db2.gz	SXXXLNAUWLDJRK-LBPRGKRZSA-N	0	0	258.365	4.040	20	30		CIEDRN
CCCC[C@H](CC)C(=O)N(CC)c1ccc(C#N)cc1	ZINC000463957813	331354572	/nfs/dbraw/zinc/35/45/72/331354572.db2.gz	GRWVDHVIACDNAC-HNNXBMFYSA-N	0	0	272.392	4.128	20	30		CIEDRN
FC(F)(F)CCSCC#Cc1ccc(Cl)cc1	ZINC000464085218	331356630	/nfs/dbraw/zinc/35/66/30/331356630.db2.gz	OBLQZWLCHPQDLC-UHFFFAOYSA-N	0	0	278.726	4.377	20	30		CIEDRN
Cc1ccc(Cl)c(NC(=O)[C@H](C)c2cccc(C#N)c2)c1	ZINC000464142754	331357087	/nfs/dbraw/zinc/35/70/87/331357087.db2.gz	RYKLBQZAKURNBF-GFCCVEGCSA-N	0	0	298.773	4.262	20	30		CIEDRN
CCCC[C@@H](CC)CC(=O)N[C@@](C)(C#N)C(C)(C)C	ZINC000464155346	331357132	/nfs/dbraw/zinc/35/71/32/331357132.db2.gz	CUWLCPBIJNACMP-CJNGLKHVSA-N	0	0	266.429	4.037	20	30		CIEDRN
CC[C@@H](CC(=O)N[C@@](C)(C#N)C(C)(C)C)c1ccccc1	ZINC000464160576	331357275	/nfs/dbraw/zinc/35/72/75/331357275.db2.gz	XFKDDGGUSDLMRQ-KSSFIOAISA-N	0	0	286.419	4.015	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)[C@H](CC)c1ccccc1	ZINC000464274632	331359063	/nfs/dbraw/zinc/35/90/63/331359063.db2.gz	IQKUQAUKOIMTDX-MRXNPFEDSA-N	0	0	286.419	4.159	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)[C@H](CC)CCCC	ZINC000464325350	331359705	/nfs/dbraw/zinc/35/97/05/331359705.db2.gz	BRKSUIFPRTZZIG-OAHLLOKOSA-N	0	0	277.408	4.053	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](CC)c1ccccc1OCC	ZINC000464440431	331360663	/nfs/dbraw/zinc/36/06/63/331360663.db2.gz	JIZOBLFDYWXXHY-ZBFHGGJFSA-N	0	0	289.419	4.255	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cccc(-c2nccs2)c1	ZINC000464440723	331360675	/nfs/dbraw/zinc/36/06/75/331360675.db2.gz	JAJWLOPPWUJLDT-GFCCVEGCSA-N	0	0	286.400	4.351	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H](c1ccccc1)C1CCCC1	ZINC000464440441	331360698	/nfs/dbraw/zinc/36/06/98/331360698.db2.gz	JKRXDZQMXCHJQM-IBGZPJMESA-N	0	0	283.415	4.228	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC)c1cc(C)ccc1C	ZINC000464441396	331360708	/nfs/dbraw/zinc/36/07/08/331360708.db2.gz	NCNJCSSVWRLXJR-OAHLLOKOSA-N	0	0	259.393	4.259	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](CCC)Cc1ccccc1	ZINC000464445523	331360793	/nfs/dbraw/zinc/36/07/93/331360793.db2.gz	XCRNKTYHFHVKLI-DOTOQJQBSA-N	0	0	273.420	4.116	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](c1ccccc1)C(C)(C)C	ZINC000464448050	331360872	/nfs/dbraw/zinc/36/08/72/331360872.db2.gz	FVLQHWAYILOHRQ-GDBMZVCRSA-N	0	0	273.420	4.492	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@H](C)c1cc(C)ccc1C	ZINC000464525799	331361790	/nfs/dbraw/zinc/36/17/90/331361790.db2.gz	OPXNGNPQRNOLHS-JKSUJKDBSA-N	0	0	273.420	4.425	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](c1ccccc1)C(C)C	ZINC000464529765	331361885	/nfs/dbraw/zinc/36/18/85/331361885.db2.gz	RDFBBQGQSSDVKR-ZBFHGGJFSA-N	0	0	259.393	4.102	20	30		CIEDRN
CC#CCCCC(=O)N[C@H](CC(C)C)c1ccccc1	ZINC000464534753	331361952	/nfs/dbraw/zinc/36/19/52/331361952.db2.gz	LYHIJZFTYXGIEP-QGZVFWFLSA-N	0	0	271.404	4.084	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCCCSc1ccc(F)cc1	ZINC000464541699	331362072	/nfs/dbraw/zinc/36/20/72/331362072.db2.gz	VWTMCKWHOXWHTG-CYBMUJFWSA-N	0	0	295.423	4.026	20	30		CIEDRN
CC#CCCCC(=O)Nc1nc2ccc(Cl)cc2s1	ZINC000464546436	331362196	/nfs/dbraw/zinc/36/21/96/331362196.db2.gz	GVJHDMOJXAKFSY-UHFFFAOYSA-N	0	0	292.791	4.082	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cc(C)nn1-c1ccccc1C	ZINC000464555325	331362367	/nfs/dbraw/zinc/36/23/67/331362367.db2.gz	YOPLQLMJYKGSSA-CQSZACIVSA-N	0	0	297.402	4.030	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@@H](C)c1c(F)cccc1F	ZINC000464558787	331362468	/nfs/dbraw/zinc/36/24/68/331362468.db2.gz	HAPNEZYATUZBMI-RYUDHWBXSA-N	0	0	281.346	4.087	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(Cc1ccco1)c1ccccc1	ZINC000464558450	331362534	/nfs/dbraw/zinc/36/25/34/331362534.db2.gz	YIRWRYYVWXNCQW-OAHLLOKOSA-N	0	0	283.371	4.415	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000464556155	331362553	/nfs/dbraw/zinc/36/25/53/331362553.db2.gz	PXCPHBJYPCWXKE-SNVBAGLBSA-N	0	0	271.282	4.246	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCc1csc2ccccc12	ZINC000464556633	331362560	/nfs/dbraw/zinc/36/25/60/331362560.db2.gz	SNSBVVZBPAUQIN-GFCCVEGCSA-N	0	0	273.401	4.120	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)Cc1c(F)cccc1Cl	ZINC000464564090	331362702	/nfs/dbraw/zinc/36/27/02/331362702.db2.gz	BAYKHXHQNCLZNM-LLVKDONJSA-N	0	0	283.774	4.040	20	30		CIEDRN
CC#CCCCC(=O)N(Cc1cccc(C)c1)CC(C)C	ZINC000464570208	331362837	/nfs/dbraw/zinc/36/28/37/331362837.db2.gz	OQMCJKVDPNKCRC-UHFFFAOYSA-N	0	0	285.431	4.173	20	30		CIEDRN
CC#CCCCC(=O)N[C@H](c1ccc(F)cc1)C(C)(C)C	ZINC000464566328	331362852	/nfs/dbraw/zinc/36/28/52/331362852.db2.gz	ANHXGRKTOWNXSH-QGZVFWFLSA-N	0	0	289.394	4.223	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000464568740	331362877	/nfs/dbraw/zinc/36/28/77/331362877.db2.gz	UWUAUERUVXPMKA-JTQLQIEISA-N	0	0	287.281	4.126	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(Cc1ccccc1)[C@H](C)CC	ZINC000464574486	331362901	/nfs/dbraw/zinc/36/29/01/331362901.db2.gz	XEXZOPVUTPHOKE-JKSUJKDBSA-N	0	0	273.420	4.416	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(Cc1ccccc1)[C@H](C)CC	ZINC000464574483	331362965	/nfs/dbraw/zinc/36/29/65/331362965.db2.gz	XEXZOPVUTPHOKE-HZPDHXFCSA-N	0	0	273.420	4.416	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cccc(OCCC)c1	ZINC000464574315	331362989	/nfs/dbraw/zinc/36/29/89/331362989.db2.gz	YFRHPQJLGDKVTM-CYBMUJFWSA-N	0	0	261.365	4.016	20	30		CIEDRN
N#CC1(CN2CCc3c2cccc3-c2ccccc2)CC1	ZINC000464583511	331363188	/nfs/dbraw/zinc/36/31/88/331363188.db2.gz	SXCILDHCRDERAY-UHFFFAOYSA-N	0	0	274.367	4.020	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCC(C)(C)c1cccc(Cl)c1	ZINC000464645738	331364127	/nfs/dbraw/zinc/36/41/27/331364127.db2.gz	DNPSANYTYBPWJZ-ZDUSSCGKSA-N	0	0	293.838	4.336	20	30		CIEDRN
CC(C)c1ccsc1C(=O)Nc1ccc(C#N)c(F)c1	ZINC000464648920	331364193	/nfs/dbraw/zinc/36/41/93/331364193.db2.gz	LWNRQKPIBYNERR-UHFFFAOYSA-N	0	0	288.347	4.135	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H]1CCCC[C@H]1c1ccccc1	ZINC000464653548	331364362	/nfs/dbraw/zinc/36/43/62/331364362.db2.gz	SPOVBWLQFGQDCB-ZWKOTPCHSA-N	0	0	283.415	4.023	20	30		CIEDRN
C=C[C@H](C)NC(=O)c1cc(C)c(-c2ccc(F)cc2)s1	ZINC000465106015	331378560	/nfs/dbraw/zinc/37/85/60/331378560.db2.gz	BRBWRMUKEKXDTF-NSHDSACASA-N	0	0	289.375	4.167	20	30		CIEDRN
C=C[C@@H](C)NC(=O)C1(Sc2ccc(C)cc2)CCCC1	ZINC000465115353	331378850	/nfs/dbraw/zinc/37/88/50/331378850.db2.gz	AIUNUGKUTNPGPI-CQSZACIVSA-N	0	0	289.444	4.091	20	30		CIEDRN
C=C[C@@H](C)NC(=O)C1(Cc2cccc(Cl)c2)CCCC1	ZINC000465124249	331379145	/nfs/dbraw/zinc/37/91/45/331379145.db2.gz	WFDAXCKOTLCBGN-CYBMUJFWSA-N	0	0	291.822	4.134	20	30		CIEDRN
C=C[C@H](C)NC(=O)Nc1cccc(-c2ccccc2OC)c1	ZINC000465246727	331380823	/nfs/dbraw/zinc/38/08/23/331380823.db2.gz	OXPANKCXXNROPC-ZDUSSCGKSA-N	0	0	296.370	4.058	20	30		CIEDRN
C=CCCC(=O)N[C@H](c1cccc(F)c1)C1CCCC1	ZINC000465278720	331381090	/nfs/dbraw/zinc/38/10/90/331381090.db2.gz	VOYLRTDPQUUTPJ-KRWDZBQOSA-N	0	0	275.367	4.139	20	30		CIEDRN
C=CCCC(=O)N[C@@H](c1cccc(F)c1)C1CCCC1	ZINC000465278721	331381160	/nfs/dbraw/zinc/38/11/60/331381160.db2.gz	VOYLRTDPQUUTPJ-QGZVFWFLSA-N	0	0	275.367	4.139	20	30		CIEDRN
Cc1sc(NC(=O)C2(CC(C)C)CCC2)c(C#N)c1C	ZINC000465453072	331383948	/nfs/dbraw/zinc/38/39/48/331383948.db2.gz	PRKIKOKVHPZIHZ-UHFFFAOYSA-N	0	0	290.432	4.392	20	30		CIEDRN
C=CCCCCCN(C)C(=O)N[C@@H]1CC[C@@H]2CCC[C@@H]2C1	ZINC000466135838	331389666	/nfs/dbraw/zinc/38/96/66/331389666.db2.gz	RJEPSCPVUDWWDC-GVDBMIGSSA-N	0	0	292.467	4.343	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@](C)(c1ccccc1)C(F)(F)F	ZINC000466236808	331391359	/nfs/dbraw/zinc/39/13/59/331391359.db2.gz	QHLXVPSQGRWJCU-DOMZBBRYSA-N	0	0	299.336	4.183	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000466238888	331391407	/nfs/dbraw/zinc/39/14/07/331391407.db2.gz	BHVWFLLITAZDGA-HUUCEWRRSA-N	0	0	259.393	4.083	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H]1c2ccccc2CC[C@@H]1C	ZINC000466245378	331391638	/nfs/dbraw/zinc/39/16/38/331391638.db2.gz	IBIFCPVOKLFTQX-GRDNDAEWSA-N	0	0	271.404	4.029	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(Cc1ccccc1)C(C)(C)C	ZINC000466251919	331391748	/nfs/dbraw/zinc/39/17/48/331391748.db2.gz	CBZKNELCPCSLAX-HNNXBMFYSA-N	0	0	273.420	4.416	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(SC)ccc1C	ZINC000466279118	331391862	/nfs/dbraw/zinc/39/18/62/331391862.db2.gz	VTUYKAONKWAATL-LBPRGKRZSA-N	0	0	263.406	4.258	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H]1/C=C/c1ccccc1	ZINC000466267854	331391890	/nfs/dbraw/zinc/39/18/90/331391890.db2.gz	YRTKJPUQKITGJU-BJICUUOASA-N	0	0	283.415	4.293	20	30		CIEDRN
CC#CCCCC(=O)N1CCCC[C@@H]1CCc1ccccc1	ZINC000466270330	331392009	/nfs/dbraw/zinc/39/20/09/331392009.db2.gz	JTDADHGRDWCOEX-LJQANCHMSA-N	0	0	297.442	4.194	20	30		CIEDRN
CC#CCCCC(=O)N1CCCC[C@H]1CCc1ccccc1	ZINC000466270329	331392040	/nfs/dbraw/zinc/39/20/40/331392040.db2.gz	JTDADHGRDWCOEX-IBGZPJMESA-N	0	0	297.442	4.194	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cc(SC)ccc1C	ZINC000466279117	331392138	/nfs/dbraw/zinc/39/21/38/331392138.db2.gz	VTUYKAONKWAATL-GFCCVEGCSA-N	0	0	263.406	4.258	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCC1(CC)CCCCC1	ZINC000466316868	331392713	/nfs/dbraw/zinc/39/27/13/331392713.db2.gz	HVSKTBSNBOHAGY-CQSZACIVSA-N	0	0	251.414	4.065	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(Cc1ccccc1F)C(C)C	ZINC000466321926	331392786	/nfs/dbraw/zinc/39/27/86/331392786.db2.gz	AXCHZGHNCMXDKX-HNNXBMFYSA-N	0	0	292.398	4.100	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1ccc2oc(C3CC3)nc2c1	ZINC000466366257	331393502	/nfs/dbraw/zinc/39/35/02/331393502.db2.gz	FHEOJMPKYSPHFM-LBPRGKRZSA-N	0	0	299.374	4.181	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CC[C@H](C)C[C@@H]1c1ccco1	ZINC000466367622	331393641	/nfs/dbraw/zinc/39/36/41/331393641.db2.gz	XJNGIANRWJFGMT-SOUVJXGZSA-N	0	0	290.407	4.117	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(C)C/C(C)=C\c1ccccc1	ZINC000466377691	331393990	/nfs/dbraw/zinc/39/39/90/331393990.db2.gz	GUONRFZPAIWTSH-AKMXKPQHSA-N	0	0	286.419	4.086	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N[C@@H](CC(C)(C)C)C(F)(F)F	ZINC000466379474	331394052	/nfs/dbraw/zinc/39/40/52/331394052.db2.gz	DHXLJQDBADWCNM-MNOVXSKESA-N	0	0	294.361	4.007	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CCC[C@H]1c1ccc(C)cc1	ZINC000466388632	331394450	/nfs/dbraw/zinc/39/44/50/331394450.db2.gz	ZOGXPWGUMQQUFE-IRXDYDNUSA-N	0	0	286.419	4.196	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CCC[C@H]1c1ccc(C)s1	ZINC000466397535	331394914	/nfs/dbraw/zinc/39/49/14/331394914.db2.gz	FYWXNSZROQSYIT-KBPBESRZSA-N	0	0	292.448	4.258	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1ccc(OC(C)(C)C)cc1	ZINC000466400636	331395049	/nfs/dbraw/zinc/39/50/49/331395049.db2.gz	DXKGLRWKLOGLDL-CYBMUJFWSA-N	0	0	290.407	4.340	20	30		CIEDRN
CC[C@@H](C#N)Nc1cc(Cl)ccc1OCC1CCC1	ZINC000466409974	331395657	/nfs/dbraw/zinc/39/56/57/331395657.db2.gz	NXFLHGXMTMFUDX-ZDUSSCGKSA-N	0	0	278.783	4.233	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](c1ccccc1C)C(C)C	ZINC000466418053	331396091	/nfs/dbraw/zinc/39/60/91/331396091.db2.gz	UMFGVZJGUUKWGX-DOTOQJQBSA-N	0	0	273.420	4.411	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCCCCCOC1CCCCC1	ZINC000466422294	331396265	/nfs/dbraw/zinc/39/62/65/331396265.db2.gz	KLOILLBGMKJXDR-MRXNPFEDSA-N	0	0	295.467	4.225	20	30		CIEDRN
CC#CCCCC(=O)N[C@H](c1ccccc1C)C(C)(C)C	ZINC000466425615	331396649	/nfs/dbraw/zinc/39/66/49/331396649.db2.gz	ODSSMUCOMJQNPQ-GOSISDBHSA-N	0	0	285.431	4.392	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](Cc2ccccc2)[C@@H]1C	ZINC000466427226	331396692	/nfs/dbraw/zinc/39/66/92/331396692.db2.gz	WPKQTJQUJCHFHC-BQFCYCMXSA-N	0	0	285.431	4.068	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(Cc1ccc(C)c(C)c1)C1CC1	ZINC000466428824	331396786	/nfs/dbraw/zinc/39/67/86/331396786.db2.gz	RPEXXMZXVIKWRG-MRXNPFEDSA-N	0	0	285.431	4.397	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1C[C@H](c2ccccc2)C(C)(C)C1	ZINC000466428132	331396815	/nfs/dbraw/zinc/39/68/15/331396815.db2.gz	ITUUKYCZLFANCE-NVXWUHKLSA-N	0	0	285.431	4.241	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@H]1CCCCC	ZINC000466428479	331396836	/nfs/dbraw/zinc/39/68/36/331396836.db2.gz	NGXFOGVDONCYTO-HUUCEWRRSA-N	0	0	251.414	4.160	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H]1CCCCC	ZINC000466428477	331396854	/nfs/dbraw/zinc/39/68/54/331396854.db2.gz	NGXFOGVDONCYTO-CABCVRRESA-N	0	0	251.414	4.160	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(OC(C)(C)C)cc1	ZINC000466428317	331396860	/nfs/dbraw/zinc/39/68/60/331396860.db2.gz	KWSZLLQEJXBXIQ-ZDUSSCGKSA-N	0	0	275.392	4.405	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCCCC[C@H]1CC(C)C	ZINC000466430677	331396882	/nfs/dbraw/zinc/39/68/82/331396882.db2.gz	HWBAHNSPAFWXIX-CVEARBPZSA-N	0	0	265.441	4.406	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](CC)C(C)(C)c1ccccc1	ZINC000466431782	331396961	/nfs/dbraw/zinc/39/69/61/331396961.db2.gz	RUPCUHWSIKSIJY-RDJZCZTQSA-N	0	0	287.447	4.461	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC)[C@@H](CC)Cc1ccccc1	ZINC000466437452	331397131	/nfs/dbraw/zinc/39/71/31/331397131.db2.gz	BJQXQSPSFXMOJC-AEFFLSMTSA-N	0	0	287.447	4.459	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NC1(c2ccc(Cl)cc2)CC1	ZINC000466444160	331397323	/nfs/dbraw/zinc/39/73/23/331397323.db2.gz	RLIUTNUHGFPKPQ-LBPRGKRZSA-N	0	0	277.795	4.048	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1sc2cccc(F)c2c1C	ZINC000466526077	331399077	/nfs/dbraw/zinc/39/90/77/331399077.db2.gz	CFRYTMMTYUBTBQ-NSHDSACASA-N	0	0	291.391	4.433	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)C1(Cc2cccc(F)c2)CCC1	ZINC000466535321	331399347	/nfs/dbraw/zinc/39/93/47/331399347.db2.gz	YJYIJDGNHNKXKM-INIZCTEOSA-N	0	0	289.394	4.009	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)C(C)(C)c1ccc(Cl)cc1F	ZINC000466537974	331399414	/nfs/dbraw/zinc/39/94/14/331399414.db2.gz	DNHVENUAEBMLCO-GFCCVEGCSA-N	0	0	297.801	4.228	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1sc2ccc(F)cc2c1C	ZINC000466542478	331399569	/nfs/dbraw/zinc/39/95/69/331399569.db2.gz	RDRGTAQQOQZJMP-GFCCVEGCSA-N	0	0	291.391	4.433	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1ccccc1COC(C)(C)C	ZINC000466542950	331399594	/nfs/dbraw/zinc/39/95/94/331399594.db2.gz	WQAKVWFEQHFGQF-HNNXBMFYSA-N	0	0	289.419	4.086	20	30		CIEDRN
C=CCCN(C)C(=O)c1cn(CCCCC)c2ccccc12	ZINC000466629806	331400998	/nfs/dbraw/zinc/40/09/98/331400998.db2.gz	CIZFIIYSLIMJAF-UHFFFAOYSA-N	0	0	298.430	4.480	20	30		CIEDRN
N#Cc1ccc(NCC2CCC(C(F)(F)F)CC2)cc1	ZINC000466644135	331401534	/nfs/dbraw/zinc/40/15/34/331401534.db2.gz	TUKGWFYCNPCOBE-UHFFFAOYSA-N	0	0	282.309	4.339	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cnn(CC(C)C)c1C(C)C	ZINC000466653193	331401886	/nfs/dbraw/zinc/40/18/86/331401886.db2.gz	FKEDPKRKQYKPIB-AWEZNQCLSA-N	0	0	291.439	4.203	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccc2oc(C(C)(C)C)nc2c1	ZINC000466788722	331404949	/nfs/dbraw/zinc/40/49/49/331404949.db2.gz	KKFVTSNZPHIRSY-UHFFFAOYSA-N	0	0	298.386	4.257	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1C[C@H](C)Oc2ccc(Cl)cc21	ZINC000466858133	331406537	/nfs/dbraw/zinc/40/65/37/331406537.db2.gz	GIEOZDYSVFBKTA-NEPJUHHUSA-N	0	0	293.794	4.056	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCCc2c(Cl)ccc(F)c21	ZINC000466868105	331406856	/nfs/dbraw/zinc/40/68/56/331406856.db2.gz	OHXDYHJHPTVMJK-NSHDSACASA-N	0	0	295.785	4.361	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CC[C@H](c2ccccc2)C[C@H]1C	ZINC000466901721	331407538	/nfs/dbraw/zinc/40/75/38/331407538.db2.gz	ADWATEWWNCMLCP-HHXXYDBFSA-N	0	0	285.431	4.383	20	30		CIEDRN
C=CCCN(C)C(=O)C[C@@H](C)c1ccccc1C(F)(F)F	ZINC000467083719	331410935	/nfs/dbraw/zinc/41/09/35/331410935.db2.gz	VRIZAHBSSZLPPW-GFCCVEGCSA-N	0	0	299.336	4.234	20	30		CIEDRN
C=CCCN(C)C(=O)C[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000467084751	331410937	/nfs/dbraw/zinc/41/09/37/331410937.db2.gz	ZJWSWFAYXRNIFR-GFCCVEGCSA-N	0	0	299.336	4.234	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@@H](C(C)(C)C)CC1	ZINC000467321598	331414997	/nfs/dbraw/zinc/41/49/97/331414997.db2.gz	ODZBILSHGKZUOB-MRXNPFEDSA-N	0	0	277.452	4.430	20	30		CIEDRN
C=CCC(CC=C)C(=O)NCc1ccccc1C(F)(F)F	ZINC000467323939	331415130	/nfs/dbraw/zinc/41/51/30/331415130.db2.gz	VHOFRLCOZRZKCW-UHFFFAOYSA-N	0	0	297.320	4.090	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H]1CC[C@@H]2CCCC[C@H]2C1	ZINC000467429358	331418659	/nfs/dbraw/zinc/41/86/59/331418659.db2.gz	WZXZGWUGVSYPEG-LJIGWXMPSA-N	0	0	263.425	4.064	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccccc1OCC(C)C	ZINC000467816755	331424210	/nfs/dbraw/zinc/42/42/10/331424210.db2.gz	WXHCXCBKOARJES-UHFFFAOYSA-N	0	0	287.403	4.428	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC)[C@H]1CCCC[C@@H]1C	ZINC000467823619	331424304	/nfs/dbraw/zinc/42/43/04/331424304.db2.gz	OODSKAWIOZEGLH-HOCLYGCPSA-N	0	0	263.425	4.182	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC)Cc1cccc(Cl)c1	ZINC000467828312	331424346	/nfs/dbraw/zinc/42/43/46/331424346.db2.gz	LEIFSOHFMQTGNG-UHFFFAOYSA-N	0	0	291.822	4.457	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC)Cc1ccccc1Cl	ZINC000467828337	331424360	/nfs/dbraw/zinc/42/43/60/331424360.db2.gz	LORPNPQZVUNOBA-UHFFFAOYSA-N	0	0	291.822	4.457	20	30		CIEDRN
CC(C)c1ccc(C(=O)N[C@@](C)(C#N)C(C)C)cc1Cl	ZINC000467856154	331424701	/nfs/dbraw/zinc/42/47/01/331424701.db2.gz	ORZARXOXVYWJKE-INIZCTEOSA-N	0	0	292.810	4.131	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)NCc1cccc(C(C)C)c1	ZINC000467870560	331424929	/nfs/dbraw/zinc/42/49/29/331424929.db2.gz	DDEHDPZYVGUCIR-KRWDZBQOSA-N	0	0	259.393	4.029	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H](C)CSc1ccc(C)cc1	ZINC000467881935	331425172	/nfs/dbraw/zinc/42/51/72/331425172.db2.gz	XTVXFVJYJVWAPD-WMLDXEAASA-N	0	0	291.460	4.194	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)NCCCCc1ccc(F)c(F)c1	ZINC000467908113	331425568	/nfs/dbraw/zinc/42/55/68/331425568.db2.gz	FFVKSNAXIJDHNO-QGZVFWFLSA-N	0	0	295.373	4.006	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cc(F)c(SC)c(F)c1	ZINC000467910158	331425701	/nfs/dbraw/zinc/42/57/01/331425701.db2.gz	MWLVUXXCFFCQBG-AWEZNQCLSA-N	0	0	285.359	4.228	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cccc2ccsc21	ZINC000467957084	331426021	/nfs/dbraw/zinc/42/60/21/331426021.db2.gz	FIXUWQOWSVXUIH-OAHLLOKOSA-N	0	0	259.374	4.442	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1nc2c(ccc(F)c2F)s1	ZINC000467981612	331426225	/nfs/dbraw/zinc/42/62/25/331426225.db2.gz	GEEWYJPRYAUKTL-AWEZNQCLSA-N	0	0	296.342	4.115	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cc(F)cc(Cl)c1	ZINC000467974507	331426280	/nfs/dbraw/zinc/42/62/80/331426280.db2.gz	VAVJEBMYXYUKKE-ZDUSSCGKSA-N	0	0	255.720	4.020	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)NCc1ccc(C)cc1OC(C)C	ZINC000467974741	331426281	/nfs/dbraw/zinc/42/62/81/331426281.db2.gz	WMLRQVAJERYMHB-SFHVURJKSA-N	0	0	289.419	4.001	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)NCC1(Cc2ccccc2)CCC1	ZINC000467988362	331426375	/nfs/dbraw/zinc/42/63/75/331426375.db2.gz	LUMLVRPGDVZTLW-SFHVURJKSA-N	0	0	285.431	4.118	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cccc(OCC(=C)C)c1	ZINC000468010826	331426630	/nfs/dbraw/zinc/42/66/30/331426630.db2.gz	BYOUQLBWJGOJHE-QGZVFWFLSA-N	0	0	273.376	4.182	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@H](C)c1cccc(C)c1C	ZINC000468011736	331426672	/nfs/dbraw/zinc/42/66/72/331426672.db2.gz	MTAUKBKAZJHOBY-PBHICJAKSA-N	0	0	259.393	4.083	20	30		CIEDRN
N#CCc1ccc(NCCc2ccc(F)cc2Cl)cc1	ZINC000468078425	331428240	/nfs/dbraw/zinc/42/82/40/331428240.db2.gz	IJHBJFMKDCZLJZ-UHFFFAOYSA-N	0	0	288.753	4.200	20	30		CIEDRN
C=CCCCNC(=O)CCC[C@@H](C)c1cccc(OC)c1	ZINC000468375512	331433112	/nfs/dbraw/zinc/43/31/12/331433112.db2.gz	ZGNLSKRORZULTJ-OAHLLOKOSA-N	0	0	289.419	4.051	20	30		CIEDRN
C=CCCCNC(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1	ZINC000468395029	331433911	/nfs/dbraw/zinc/43/39/11/331433911.db2.gz	KHYRYXPQLNJDFO-QZTJIDSGSA-N	0	0	279.383	4.026	20	30		CIEDRN
C=CCCCNC(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1Cl	ZINC000468393196	331433914	/nfs/dbraw/zinc/43/39/14/331433914.db2.gz	AUXNIFSYJFGONH-NWDGAFQWSA-N	0	0	298.213	4.179	20	30		CIEDRN
C=CCCCNC(=O)c1sc2ccc(C)cc2c1C	ZINC000468401641	331434234	/nfs/dbraw/zinc/43/42/34/331434234.db2.gz	FDJYUNCVRVWNHQ-UHFFFAOYSA-N	0	0	273.401	4.214	20	30		CIEDRN
C=CCCCNC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl	ZINC000468402526	331434238	/nfs/dbraw/zinc/43/42/38/331434238.db2.gz	KILHCMKTWALFNV-OLZOCXBDSA-N	0	0	298.213	4.179	20	30		CIEDRN
C[C@@H]1[C@H](Nc2ccc(CC#N)cc2)C[C@H]1c1ccccc1	ZINC000468474899	331435488	/nfs/dbraw/zinc/43/54/88/331435488.db2.gz	JAIDEAIQYIWYST-GDIGMMSISA-N	0	0	276.383	4.357	20	30		CIEDRN
N#Cc1cccc(SCCOC2CCCCCC2)c1	ZINC000468636429	331437926	/nfs/dbraw/zinc/43/79/26/331437926.db2.gz	AWPWXDMBKVDJPO-UHFFFAOYSA-N	0	0	275.417	4.390	20	30		CIEDRN
Cc1cc(C(=O)CSc2cccc(C#N)c2)cc(C)c1F	ZINC000468641984	331438156	/nfs/dbraw/zinc/43/81/56/331438156.db2.gz	HUWNQMSHAIKPNL-UHFFFAOYSA-N	0	0	299.370	4.289	20	30		CIEDRN
COC(C)(C)CCS[C@H](C)c1ccc(C#N)cc1	ZINC000468649231	331438216	/nfs/dbraw/zinc/43/82/16/331438216.db2.gz	BIWNILYWJYXCJQ-GFCCVEGCSA-N	0	0	263.406	4.168	20	30		CIEDRN
CCC(C)(C)c1ccc(NC(=O)C2(C#N)CCCC2)cc1	ZINC000468745053	331439245	/nfs/dbraw/zinc/43/92/45/331439245.db2.gz	PQMKHQBKLSLJRQ-UHFFFAOYSA-N	0	0	284.403	4.397	20	30		CIEDRN
CCC(CC)CC(=O)Nc1cc(C#N)ccc1OC(C)C	ZINC000468810429	331440405	/nfs/dbraw/zinc/44/04/05/331440405.db2.gz	DNEUDNVNPRCWMP-UHFFFAOYSA-N	0	0	288.391	4.110	20	30		CIEDRN
C=CCCCCCN(C)C(=O)C[C@H]1CC[C@H](C)C1	ZINC000469135328	331444535	/nfs/dbraw/zinc/44/45/35/331444535.db2.gz	QBTAPWCHNLDMDM-GJZGRUSLSA-N	0	0	251.414	4.018	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1ccccc1CSCC	ZINC000469307229	331449445	/nfs/dbraw/zinc/44/94/45/331449445.db2.gz	WTUWCTXTFJOUFH-CQSZACIVSA-N	0	0	291.460	4.414	20	30		CIEDRN
CCCC(C)(C)CC(=O)Nc1cc(C#N)ccc1C	ZINC000469531229	331453690	/nfs/dbraw/zinc/45/36/90/331453690.db2.gz	OGWHSJPNFUKVHY-UHFFFAOYSA-N	0	0	258.365	4.022	20	30		CIEDRN
CCCN(Cc1ccc(C#N)cc1)C(=O)C[C@@H]1CCC[C@@H]1C	ZINC000469719968	331456092	/nfs/dbraw/zinc/45/60/92/331456092.db2.gz	CIQGZVBOAICEEZ-YJBOKZPZSA-N	0	0	298.430	4.123	20	30		CIEDRN
C[C@@H](NCc1ccccc1C#N)c1ccc2ncsc2c1	ZINC000469777529	331457856	/nfs/dbraw/zinc/45/78/56/331457856.db2.gz	AHKUEKWGMYQBFJ-GFCCVEGCSA-N	0	0	293.395	4.019	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@@H](C)CCC1CC1)c1ccccc1	ZINC000469801071	331460635	/nfs/dbraw/zinc/46/06/35/331460635.db2.gz	PFSBLMJESBABRO-GOEBONIOSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CCN(C(=O)C[C@@H]1CCC[C@@H]1C)c1ccccc1	ZINC000469929323	331465340	/nfs/dbraw/zinc/46/53/40/331465340.db2.gz	OMEFKJRFFVSBQD-GJZGRUSLSA-N	0	0	257.377	4.032	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)Cc1ccc(F)c(Cl)c1	ZINC000470013182	331469824	/nfs/dbraw/zinc/46/98/24/331469824.db2.gz	VRNOKEMUDWYZGU-UHFFFAOYSA-N	0	0	295.785	4.206	20	30		CIEDRN
CC(C)[C@@H]1CCC[C@H](NC(=O)c2cccc(CC#N)c2)CC1	ZINC000470200190	331475293	/nfs/dbraw/zinc/47/52/93/331475293.db2.gz	KNXJIKNKYUYGPK-AEFFLSMTSA-N	0	0	298.430	4.087	20	30		CIEDRN
C=CCCC(=O)N(Cc1ccccc1)[C@H](C)C(C)(C)C	ZINC000470199562	331475332	/nfs/dbraw/zinc/47/53/32/331475332.db2.gz	ZIIAOYPYPQGKFD-OAHLLOKOSA-N	0	0	273.420	4.416	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)CCc2ccsc2)CCCC1(C)C	ZINC000470286201	331477797	/nfs/dbraw/zinc/47/77/97/331477797.db2.gz	KNIHHSXBJYTSQO-HNNXBMFYSA-N	0	0	291.460	4.274	20	30		CIEDRN
CC(C)(C)[C@H]1CN(C(=O)C2(C#N)CCCC2)c2ccccc21	ZINC000470286644	331478148	/nfs/dbraw/zinc/47/81/48/331478148.db2.gz	XBPUTFVRDKKUTF-HNNXBMFYSA-N	0	0	296.414	4.247	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)C2CCCCC2)CCCC1(C)C	ZINC000470292816	331478276	/nfs/dbraw/zinc/47/82/76/331478276.db2.gz	LLZGDMRKQHJJAW-HNNXBMFYSA-N	0	0	263.425	4.160	20	30		CIEDRN
C=CCCCC(=O)N1C[C@H](C(C)C)c2ccccc21	ZINC000470390433	331481360	/nfs/dbraw/zinc/48/13/60/331481360.db2.gz	RMZBAHCDTYMWGB-OAHLLOKOSA-N	0	0	257.377	4.129	20	30		CIEDRN
CC(C)CCC1CCN(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000470524036	331484777	/nfs/dbraw/zinc/48/47/77/331484777.db2.gz	PKXXGSCLJITTBV-UHFFFAOYSA-N	0	0	299.418	4.238	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)[C@H](C)[C@@H](C)CC	ZINC000470650014	331486872	/nfs/dbraw/zinc/48/68/72/331486872.db2.gz	ZGQXYHVGPSTBSG-JKSUJKDBSA-N	0	0	273.420	4.274	20	30		CIEDRN
CC(C)(C#N)C(=O)Nc1cc(-c2ccccc2)ccc1Cl	ZINC000471450402	331508843	/nfs/dbraw/zinc/50/88/43/331508843.db2.gz	GTESKVFDNUPFIH-UHFFFAOYSA-N	0	0	298.773	4.495	20	30		CIEDRN
C=CCCCCNC(=O)C1(c2cccc(F)c2)CCCC1	ZINC000471669086	331514679	/nfs/dbraw/zinc/51/46/79/331514679.db2.gz	VBDLIOAZXNIIPN-UHFFFAOYSA-N	0	0	289.394	4.110	20	30		CIEDRN
C=CCCCCNC(=O)C(C)(C)c1cccc(Cl)c1	ZINC000471704699	331516786	/nfs/dbraw/zinc/51/67/86/331516786.db2.gz	GLWSASFIKWHWQD-UHFFFAOYSA-N	0	0	279.811	4.090	20	30		CIEDRN
C=CCCCCNC(=O)[C@H]1C[C@H]1c1cccc2ccccc21	ZINC000471708448	331516939	/nfs/dbraw/zinc/51/69/39/331516939.db2.gz	DUTGPQYRVNMWJH-OALUTQOASA-N	0	0	293.410	4.416	20	30		CIEDRN
C=CCCCCNC(=O)[C@@H](C)CSc1ccc(F)cc1	ZINC000471710008	331517429	/nfs/dbraw/zinc/51/74/29/331517429.db2.gz	WYUKWWHEEHRGBE-ZDUSSCGKSA-N	0	0	295.423	4.026	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)NC[C@@H]1CC=CCC1	ZINC000471738083	331518816	/nfs/dbraw/zinc/51/88/16/331518816.db2.gz	AHDAPUIXFZCKLE-QGZVFWFLSA-N	0	0	298.430	4.131	20	30		CIEDRN
CCN(Cc1cc(C#N)ccc1F)c1ccc2[nH]ccc2c1	ZINC000472197804	331531344	/nfs/dbraw/zinc/53/13/44/331531344.db2.gz	ZXQBENISYRHRDK-UHFFFAOYSA-N	0	0	293.345	4.205	20	30		CIEDRN
C=CCCCCNC(=O)N[C@H](C)c1cccc(Cl)c1	ZINC000472846235	331544495	/nfs/dbraw/zinc/54/44/95/331544495.db2.gz	ILFBLVXQXCEYHB-GFCCVEGCSA-N	0	0	280.799	4.057	20	30		CIEDRN
CCSc1cccc(CNc2cc(C#N)ccc2OC)c1	ZINC000473126828	331547446	/nfs/dbraw/zinc/54/74/46/331547446.db2.gz	IKSAKEFOVWGYSJ-UHFFFAOYSA-N	0	0	298.411	4.291	20	30		CIEDRN
CCC[C@H]1[C@@H](C)CCCN1C(=O)Nc1cc(C#N)ccc1C	ZINC000473338974	331550435	/nfs/dbraw/zinc/55/04/35/331550435.db2.gz	ZUVBPVIXFAXYOT-YOEHRIQHSA-N	0	0	299.418	4.299	20	30		CIEDRN
C=CCCCCNC(=O)Nc1ccccc1CCC	ZINC000473504161	331552245	/nfs/dbraw/zinc/55/22/45/331552245.db2.gz	GSGJNVGBEPNIKR-UHFFFAOYSA-N	0	0	260.381	4.117	20	30		CIEDRN
CC(C)(C#N)c1ccc(C(=O)Nc2ccc(Cl)cc2)cc1	ZINC000474089427	331569534	/nfs/dbraw/zinc/56/95/34/331569534.db2.gz	NPPMOMQXRFFCIW-UHFFFAOYSA-N	0	0	298.773	4.393	20	30		CIEDRN
C[C@@H]1CCC[C@H](NC(=O)c2ccc(C(C)(C)C#N)cc2)[C@H]1C	ZINC000474091281	331569730	/nfs/dbraw/zinc/56/97/30/331569730.db2.gz	WHALFLPNWNZMOU-KEYYUXOJSA-N	0	0	298.430	4.042	20	30		CIEDRN
CC(C)CC[C@@H](C)NC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000474412367	331585504	/nfs/dbraw/zinc/58/55/04/331585504.db2.gz	HXJPLYCTYBMJID-CQSZACIVSA-N	0	0	286.419	4.042	20	30		CIEDRN
CC[C@@H]1CCCC[C@H]1NC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000474785901	331598148	/nfs/dbraw/zinc/59/81/48/331598148.db2.gz	WBCWEBJSEMCDSL-KBAYOESNSA-N	0	0	298.430	4.159	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)c1cccc(N[C@H](C)C(C)C)c1C	ZINC000474801202	331599050	/nfs/dbraw/zinc/59/90/50/331599050.db2.gz	KQMPWRZWRWOKRM-UKRRQHHQSA-N	0	0	288.435	4.146	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCc1ccc(OCCC)cc1C	ZINC000474916418	331603741	/nfs/dbraw/zinc/60/37/41/331603741.db2.gz	GWFQNAQNSFTXLI-OAHLLOKOSA-N	0	0	289.419	4.002	20	30		CIEDRN
C=CCCC1(C(=O)N[C@@H]2CCc3cc(Cl)ccc32)CC1	ZINC000475118260	331615442	/nfs/dbraw/zinc/61/54/42/331615442.db2.gz	MCRRZMWWCZCNTE-OAHLLOKOSA-N	0	0	289.806	4.190	20	30		CIEDRN
Cc1cc(OCc2ccc(F)cc2C#N)ccc1Cl	ZINC000303223906	332919743	/nfs/dbraw/zinc/91/97/43/332919743.db2.gz	WDWXFSFDOKCZLQ-UHFFFAOYSA-N	0	0	275.710	4.238	20	30		CIEDRN
C=C(C)[C@H](NC(=O)[C@H]1C[C@@]1(C)CC)c1ccc(F)c(F)c1	ZINC000475661214	331640506	/nfs/dbraw/zinc/64/05/06/331640506.db2.gz	LQUMMJSJCIHKEI-ISTRZQFTSA-N	0	0	293.357	4.134	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)C[C@H]1CCC[C@H](C)C1	ZINC000475742467	331644544	/nfs/dbraw/zinc/64/45/44/331644544.db2.gz	QMOJJYKDSFUZOQ-GJZGRUSLSA-N	0	0	278.440	4.182	20	30		CIEDRN
CC(C)c1cccc(CNc2ccc([N+](=O)[O-])c(C#N)c2)c1	ZINC000475743276	331644551	/nfs/dbraw/zinc/64/45/51/331644551.db2.gz	YCDNGMPWVDGTKI-UHFFFAOYSA-N	0	0	295.342	4.202	20	30		CIEDRN
C=CCN(CC=C)C(=O)Nc1cc(-c2ccccc2)ns1	ZINC000475810154	331645182	/nfs/dbraw/zinc/64/51/82/331645182.db2.gz	JJPYQCOMKRODMB-UHFFFAOYSA-N	0	0	299.399	4.016	20	30		CIEDRN
C=CCCC1(C(=O)N2CCCC3(CCCCC3)C2)CC1	ZINC000475902372	331648251	/nfs/dbraw/zinc/64/82/51/331648251.db2.gz	BSLMDZAJDAFTBY-UHFFFAOYSA-N	0	0	275.436	4.306	20	30		CIEDRN
C=CCOc1ccccc1CNC(=O)[C@](C)(CC)CCC	ZINC000475942090	331649290	/nfs/dbraw/zinc/64/92/90/331649290.db2.gz	WGPJAUSZONEXCM-GOSISDBHSA-N	0	0	289.419	4.084	20	30		CIEDRN
C=CCC(CC=C)C(=O)NCc1cccc(C(C)C)c1	ZINC000475943745	331649503	/nfs/dbraw/zinc/64/95/03/331649503.db2.gz	CRHTVAJXWYXOIQ-UHFFFAOYSA-N	0	0	271.404	4.195	20	30		CIEDRN
C=CCOCCCOc1ccc(-c2ccc(C#N)cc2)cc1	ZINC000475949966	331649604	/nfs/dbraw/zinc/64/96/04/331649604.db2.gz	WUJYGXMGJSWYIN-UHFFFAOYSA-N	0	0	293.366	4.197	20	30		CIEDRN
C=CCOCCCSc1ccc(Br)cc1	ZINC000475969452	331650201	/nfs/dbraw/zinc/65/02/01/331650201.db2.gz	SVQUOEVSTRYBIN-UHFFFAOYSA-N	0	0	287.222	4.134	20	30		CIEDRN
C=CCOCCCSc1cccc(Br)c1	ZINC000475974164	331650354	/nfs/dbraw/zinc/65/03/54/331650354.db2.gz	RFXJNOGRGOQOJY-UHFFFAOYSA-N	0	0	287.222	4.134	20	30		CIEDRN
C=CCOCCCS[C@H](C)c1c(F)cccc1F	ZINC000475984211	331650580	/nfs/dbraw/zinc/65/05/80/331650580.db2.gz	IXFCVRDSOLHQEC-LLVKDONJSA-N	0	0	272.360	4.352	20	30		CIEDRN
CC[C@@H]1CCCCCN1C(=O)C[C@@H](CC#N)c1ccccc1	ZINC000476091019	331654658	/nfs/dbraw/zinc/65/46/58/331654658.db2.gz	NMOQBSFYSQVECV-QZTJIDSGSA-N	0	0	298.430	4.255	20	30		CIEDRN
C[C@H](NC(=O)C[C@H](CC#N)c1ccccc1)C1CCCCC1	ZINC000476169199	331656537	/nfs/dbraw/zinc/65/65/37/331656537.db2.gz	VYWLXJAZSWONBM-YJBOKZPZSA-N	0	0	298.430	4.159	20	30		CIEDRN
C[C@H](CC(C)(C)C)C(=O)N[C@H](C#N)c1ccccc1Cl	ZINC000476195333	331657040	/nfs/dbraw/zinc/65/70/40/331657040.db2.gz	QXZWPBUHLASCGE-BXUZGUMPSA-N	0	0	292.810	4.093	20	30		CIEDRN
C=CCC[C@H](NC(=O)[C@H]1C[C@H]1C(C)C)c1ccccc1	ZINC000476283375	331659834	/nfs/dbraw/zinc/65/98/34/331659834.db2.gz	HECIMZPRCPQQBI-ULQDDVLXSA-N	0	0	271.404	4.102	20	30		CIEDRN
C=CCCC1(C(=O)NCC2(Cc3ccccc3)CCC2)CC1	ZINC000476297591	331660423	/nfs/dbraw/zinc/66/04/23/331660423.db2.gz	DXPCDVXZYPBDPB-UHFFFAOYSA-N	0	0	297.442	4.262	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)[C@H]1CCCC[C@H]1CC	ZINC000476624342	331667439	/nfs/dbraw/zinc/66/74/39/331667439.db2.gz	ATUQSAHSCHTSPX-WBVHZDCISA-N	0	0	289.419	4.053	20	30		CIEDRN
CC(C)(C#N)c1ccc(C(=O)N[C@H]2CCCC(C)(C)C2)cc1	ZINC000476920323	331671225	/nfs/dbraw/zinc/67/12/25/331671225.db2.gz	GIOYXYZKWXJZJZ-INIZCTEOSA-N	0	0	298.430	4.186	20	30		CIEDRN
N#Cc1ccnc(SCCc2ccc3ccccc3c2)c1	ZINC000510989478	332923089	/nfs/dbraw/zinc/92/30/89/332923089.db2.gz	XIXMOHIKJFGUSI-UHFFFAOYSA-N	0	0	290.391	4.441	20	30		CIEDRN
C=CCCCSCCCOc1cccc(C#N)c1	ZINC000477353567	331682540	/nfs/dbraw/zinc/68/25/40/331682540.db2.gz	SELXZFOTUSHOCZ-UHFFFAOYSA-N	0	0	261.390	4.027	20	30		CIEDRN
N#Cc1ccccc1CSCc1ccn(C2CCCC2)n1	ZINC000477357951	331682556	/nfs/dbraw/zinc/68/25/56/331682556.db2.gz	UXZRSHXMPJYUNS-UHFFFAOYSA-N	0	0	297.427	4.303	20	30		CIEDRN
C=C(C)CN(C)C(=O)Nc1ccccc1-c1cccs1	ZINC000477509550	331685937	/nfs/dbraw/zinc/68/59/37/331685937.db2.gz	KSUIVBLAVIENIQ-UHFFFAOYSA-N	0	0	286.400	4.455	20	30		CIEDRN
N#Cc1cccc(SCc2ccn(C3CCCC3)n2)c1	ZINC000477512436	331686015	/nfs/dbraw/zinc/68/60/15/331686015.db2.gz	CTACKHGCOBZEEY-UHFFFAOYSA-N	0	0	283.400	4.162	20	30		CIEDRN
CCCCn1ncc(Nc2nccc(C)c2C#N)c1C(C)C	ZINC000477702733	331688751	/nfs/dbraw/zinc/68/87/51/331688751.db2.gz	NELOLEXOGNHBQQ-UHFFFAOYSA-N	0	0	297.406	4.125	20	30		CIEDRN
C=C[C@@H](CC(=O)N(C)[C@H]1CCC(C)(C)C1)c1ccccc1	ZINC000478196686	331700259	/nfs/dbraw/zinc/70/02/59/331700259.db2.gz	KILLIXQEXBHUNP-RDJZCZTQSA-N	0	0	285.431	4.383	20	30		CIEDRN
Cc1cccc(NCc2ccc(Cl)cc2C#N)c1F	ZINC000478344012	331704303	/nfs/dbraw/zinc/70/43/03/331704303.db2.gz	HZJBJTGOBKDALT-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
COc1cc(C#N)ccc1CNc1ccc(C2CC2)c(C)c1	ZINC000478342857	331704305	/nfs/dbraw/zinc/70/43/05/331704305.db2.gz	NSLXIKNBHVYMDE-UHFFFAOYSA-N	0	0	292.382	4.365	20	30		CIEDRN
N#Cc1cc(Cl)ccc1CNc1cc(F)c(F)c(F)c1	ZINC000478386658	331705202	/nfs/dbraw/zinc/70/52/02/331705202.db2.gz	AUBKPYHFGBWGLV-UHFFFAOYSA-N	0	0	296.679	4.241	20	30		CIEDRN
C=CCC1(C(=O)N2CCC[C@@H](C(C)(C)C)C2)CCC1	ZINC000478489759	331707279	/nfs/dbraw/zinc/70/72/79/331707279.db2.gz	IUVRGMCEYRMSJN-CQSZACIVSA-N	0	0	263.425	4.018	20	30		CIEDRN
CC(C)(C#N)CCCCN(C#N)c1cccc(Cl)c1	ZINC000478761046	331713548	/nfs/dbraw/zinc/71/35/48/331713548.db2.gz	MDJYXQGPENIYLO-UHFFFAOYSA-N	0	0	275.783	4.348	20	30		CIEDRN
C[C@@H](SCCC(F)(F)F)c1cccc(C#N)c1	ZINC000478755573	331713571	/nfs/dbraw/zinc/71/35/71/331713571.db2.gz	NCXUWVSSCHTAFE-SECBINFHSA-N	0	0	259.296	4.305	20	30		CIEDRN
Cn1cc(/C=C\c2nc3cc(Cl)ccc3s2)cc1C#N	ZINC000478921257	331717360	/nfs/dbraw/zinc/71/73/60/331717360.db2.gz	IKJLINRFQCYCKD-DJWKRKHSSA-N	0	0	299.786	4.330	20	30		CIEDRN
C=CCN(C(=O)c1cc(C)cc(Cl)c1)c1ccccc1	ZINC000479079459	331719926	/nfs/dbraw/zinc/71/99/26/331719926.db2.gz	PUIABZAYPXGBTB-UHFFFAOYSA-N	0	0	285.774	4.481	20	30		CIEDRN
C=C(C)CN(C)C(=O)C1(c2cccc(Cl)c2)CCCC1	ZINC000479286300	331723713	/nfs/dbraw/zinc/72/37/13/331723713.db2.gz	VFEHNFLEKUXLLO-UHFFFAOYSA-N	0	0	291.822	4.186	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1ccccc1Sc1ccccc1	ZINC000479323084	331724872	/nfs/dbraw/zinc/72/48/72/331724872.db2.gz	YEMNYXBESJLPNU-UHFFFAOYSA-N	0	0	297.423	4.486	20	30		CIEDRN
CC(F)(F)c1cccc(NCC#Cc2ccccc2)c1	ZINC000479486370	331732767	/nfs/dbraw/zinc/73/27/67/331732767.db2.gz	IOKJKCBMPYPDDY-UHFFFAOYSA-N	0	0	271.310	4.262	20	30		CIEDRN
C=CCCCC(=O)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000479508363	331733854	/nfs/dbraw/zinc/73/38/54/331733854.db2.gz	ZXNKFQWUNMLIGG-LJQANCHMSA-N	0	0	293.410	4.443	20	30		CIEDRN
C=CCCCC(=O)NCC(c1ccccc1)c1ccccc1	ZINC000479525996	331734970	/nfs/dbraw/zinc/73/49/70/331734970.db2.gz	KJEOGTMNCOVEKX-UHFFFAOYSA-N	0	0	293.410	4.291	20	30		CIEDRN
CCCc1cccc(CNc2ccc(CC#N)cc2)c1	ZINC000479537838	331735558	/nfs/dbraw/zinc/73/55/58/331735558.db2.gz	HKSQXAPTGPKKLR-UHFFFAOYSA-N	0	0	264.372	4.317	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](CC(C)C)c1cccs1	ZINC000479551931	331737021	/nfs/dbraw/zinc/73/70/21/331737021.db2.gz	GMQYHXPOQBGIFS-ZDUSSCGKSA-N	0	0	265.422	4.308	20	30		CIEDRN
C=CCCCC(=O)N(CC)[C@@H](CC)c1ccccc1	ZINC000479562067	331737609	/nfs/dbraw/zinc/73/76/09/331737609.db2.gz	WYBXMRGQUZOZIM-INIZCTEOSA-N	0	0	259.393	4.343	20	30		CIEDRN
C=CCOCCCS[C@@H](C)c1nc2ccccc2o1	ZINC000479607176	331740525	/nfs/dbraw/zinc/74/05/25/331740525.db2.gz	SUOWNRSIIDTVAG-LBPRGKRZSA-N	0	0	277.389	4.215	20	30		CIEDRN
C=CCCCC(=O)N[C@H](CCc1ccccc1)C(F)(F)F	ZINC000479659387	331742417	/nfs/dbraw/zinc/74/24/17/331742417.db2.gz	UQGIPLCQDWIGOP-CQSZACIVSA-N	0	0	299.336	4.023	20	30		CIEDRN
C=CCn1c2ccccc2nc1SCc1cncc(F)c1	ZINC000479711153	331744170	/nfs/dbraw/zinc/74/41/70/331744170.db2.gz	IMMZPPZVQHIGDE-UHFFFAOYSA-N	0	0	299.374	4.049	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)c1ccc(C2CCC2)cc1	ZINC000479869330	331749687	/nfs/dbraw/zinc/74/96/87/331749687.db2.gz	YBNRRFGMXPUAEQ-UHFFFAOYSA-N	0	0	290.366	4.387	20	30		CIEDRN
C=CCC1(C(=O)NCC(C)(C)c2ccc(C)cc2)CCC1	ZINC000480165740	331760777	/nfs/dbraw/zinc/76/07/77/331760777.db2.gz	FHDXIQBLMVMPOC-UHFFFAOYSA-N	0	0	285.431	4.135	20	30		CIEDRN
C=CCC1(C(=O)NCCCCC(C)(C)C)CCC1	ZINC000480166163	331760793	/nfs/dbraw/zinc/76/07/93/331760793.db2.gz	BLIPOQJWACVLRB-UHFFFAOYSA-N	0	0	251.414	4.065	20	30		CIEDRN
C=C[C@H](CC(=O)NC(C)(C)C(C)(C)C)c1ccccc1	ZINC000480626071	331780628	/nfs/dbraw/zinc/78/06/28/331780628.db2.gz	NCKRKHSRXNVKLF-CQSZACIVSA-N	0	0	273.420	4.287	20	30		CIEDRN
N#CCN(CCCCc1ccccc1)c1ccccc1	ZINC000480745921	331786891	/nfs/dbraw/zinc/78/68/91/331786891.db2.gz	PVDXILUPAIMSKF-UHFFFAOYSA-N	0	0	264.372	4.039	20	30		CIEDRN
CCC[C@@H](CC)Sc1cc(C#N)ccc1[N+](=O)[O-]	ZINC000480854177	331790005	/nfs/dbraw/zinc/79/00/05/331790005.db2.gz	NODDYTASHYCDSQ-LLVKDONJSA-N	0	0	264.350	4.137	20	30		CIEDRN
C=CCCCc1nc(-c2ccc(N3CCCCC3)cc2)no1	ZINC000481015934	331794801	/nfs/dbraw/zinc/79/48/01/331794801.db2.gz	AREVTBYBEIBTCV-UHFFFAOYSA-N	0	0	297.402	4.236	20	30		CIEDRN
C[C@H](c1cccc(Cl)c1F)N1CCC(C)(C#N)CC1	ZINC000481023385	331794857	/nfs/dbraw/zinc/79/48/57/331794857.db2.gz	IZOLIRPOHKNBOX-LLVKDONJSA-N	0	0	280.774	4.166	20	30		CIEDRN
C=C(C)CN(CC)C(=O)[C@H](CC(C)C)c1ccccc1	ZINC000481262704	331802189	/nfs/dbraw/zinc/80/21/89/331802189.db2.gz	VMUPHMUIZLDPPW-QGZVFWFLSA-N	0	0	273.420	4.241	20	30		CIEDRN
C=CCn1c(SCC(=C)C)nnc1-c1ccc(C)cc1	ZINC000481339429	331804448	/nfs/dbraw/zinc/80/44/48/331804448.db2.gz	LYKVUPWVVWQMKO-UHFFFAOYSA-N	0	0	285.416	4.108	20	30		CIEDRN
C[C@H](c1ccc(C#N)cc1)N1CC2(CC2)c2ccccc21	ZINC000481604889	331810311	/nfs/dbraw/zinc/81/03/11/331810311.db2.gz	MWUVNXPVTKCIOP-CQSZACIVSA-N	0	0	274.367	4.171	20	30		CIEDRN
C=CCCCC(=O)N(c1ccccc1F)C1CCCC1	ZINC000481859380	331817268	/nfs/dbraw/zinc/81/72/68/331817268.db2.gz	WVJCTUQOGIBFCU-UHFFFAOYSA-N	0	0	275.367	4.458	20	30		CIEDRN
N#Cc1ccccc1S[C@@H]1CCc2ccc(F)cc21	ZINC000481986045	331820169	/nfs/dbraw/zinc/82/01/69/331820169.db2.gz	ZOXOFOFZAZLJQR-MRXNPFEDSA-N	0	0	269.344	4.477	20	30		CIEDRN
CC[C@H](N[C@@H]1CCCCc2cc(C#N)ccc21)C(F)(F)F	ZINC000481996350	331820879	/nfs/dbraw/zinc/82/08/79/331820879.db2.gz	CMZVBVYRJCZQMK-CABCVRRESA-N	0	0	296.336	4.256	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1cc2ccc(C(C)(C)C)cc2[nH]1	ZINC000482131018	331825311	/nfs/dbraw/zinc/82/53/11/331825311.db2.gz	NIMGYMZEUSMONZ-UHFFFAOYSA-N	0	0	284.403	4.114	20	30		CIEDRN
C=C(C)CN(C)C(=O)C1(c2ccc(Cl)cc2)CCCC1	ZINC000482165699	331826235	/nfs/dbraw/zinc/82/62/35/331826235.db2.gz	DINWFTVXGFOLED-UHFFFAOYSA-N	0	0	291.822	4.186	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cnn(C(CC)CC)c1CC	ZINC000482702123	331844009	/nfs/dbraw/zinc/84/40/09/331844009.db2.gz	AIHFQESKXSQNFL-ZDUSSCGKSA-N	0	0	291.439	4.347	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)c1ccc(C)cc1	ZINC000482793462	331846610	/nfs/dbraw/zinc/84/66/10/331846610.db2.gz	LLYOOOVXPXDSFB-UHFFFAOYSA-N	0	0	271.404	4.204	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CC[C@H](c2ccccc2F)C1	ZINC000482899188	331851607	/nfs/dbraw/zinc/85/16/07/331851607.db2.gz	MCKUNWPCIGZFRZ-SOUVJXGZSA-N	0	0	289.394	4.180	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H]1CC[C@@H](c2ccccc2F)C1	ZINC000482901276	331851801	/nfs/dbraw/zinc/85/18/01/331851801.db2.gz	UKRAFARDLGBMMI-QWQRMKEZSA-N	0	0	289.394	4.180	20	30		CIEDRN
C=CCN(CC=C)C(=O)N[C@@H](c1ccccc1C)C(C)C	ZINC000303463271	332931722	/nfs/dbraw/zinc/93/17/22/332931722.db2.gz	ORNNKFRDNPIMNL-QGZVFWFLSA-N	0	0	286.419	4.076	20	30		CIEDRN
N#Cc1cc(F)ccc1CSCc1ccccc1	ZINC000483211553	331862958	/nfs/dbraw/zinc/86/29/58/331862958.db2.gz	UYDFRPOITHESKZ-UHFFFAOYSA-N	0	0	257.333	4.131	20	30		CIEDRN
C=C(C)[C@H](NC(=O)NC(C)(C)CC)c1ccc(F)c(F)c1	ZINC000483305321	331868371	/nfs/dbraw/zinc/86/83/71/331868371.db2.gz	RSZGFZTVDJJQPF-AWEZNQCLSA-N	0	0	296.361	4.070	20	30		CIEDRN
Cc1ccc(CNc2ccc(Cl)cc2C#N)c(C)c1	ZINC000511452114	332932209	/nfs/dbraw/zinc/93/22/09/332932209.db2.gz	ADNLYGVZOOETQH-UHFFFAOYSA-N	0	0	270.763	4.441	20	30		CIEDRN
CCCN(CC#N)Cc1cccc(-c2ccccc2)c1	ZINC000511470227	332932544	/nfs/dbraw/zinc/93/25/44/332932544.db2.gz	CTDRCYZJAKQOEY-UHFFFAOYSA-N	0	0	264.372	4.089	20	30		CIEDRN
C=CCCC1(C(=O)N[C@H]2CCC(C)(C)C[C@H]2C)CC1	ZINC000483707149	331882437	/nfs/dbraw/zinc/88/24/37/331882437.db2.gz	FAACGBWDOHTXHF-KGLIPLIRSA-N	0	0	263.425	4.064	20	30		CIEDRN
C=CCCC1(C(=O)N2CCC[C@@H]2/C=C\c2ccccc2)CC1	ZINC000484022367	331891353	/nfs/dbraw/zinc/89/13/53/331891353.db2.gz	DJLDVZKPTJVDDT-YUIUBULTSA-N	0	0	295.426	4.437	20	30		CIEDRN
CC[C@H](NCC#Cc1ccccc1)c1cc(F)ccc1F	ZINC000484074702	331892325	/nfs/dbraw/zinc/89/23/25/331892325.db2.gz	JXZMKLWSMHLBRP-SFHVURJKSA-N	0	0	285.337	4.057	20	30		CIEDRN
CCN(CC#N)Cc1ccc(-c2ccc(Cl)cc2)s1	ZINC000511502106	332933580	/nfs/dbraw/zinc/93/35/80/332933580.db2.gz	ATAKUUCJXCTBBY-UHFFFAOYSA-N	0	0	290.819	4.414	20	30		CIEDRN
CCCN(CC#N)Cc1ccc(-c2cccc(F)c2)s1	ZINC000511506194	332933632	/nfs/dbraw/zinc/93/36/32/332933632.db2.gz	PZACLTCJOUAUHC-UHFFFAOYSA-N	0	0	288.391	4.290	20	30		CIEDRN
CCCN(CC#N)Cc1ccc(-c2ccccc2)cc1	ZINC000511519903	332934077	/nfs/dbraw/zinc/93/40/77/332934077.db2.gz	CLKFZGJWVGGYEE-UHFFFAOYSA-N	0	0	264.372	4.089	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N(CC)CCCC	ZINC000485469655	331915029	/nfs/dbraw/zinc/91/50/29/331915029.db2.gz	VHARVERNAGTTEV-UHFFFAOYSA-N	0	0	277.433	4.227	20	30		CIEDRN
C=C(C)CN(CC)C(=O)CSC(C)(C)c1ccccc1	ZINC000485480648	331915213	/nfs/dbraw/zinc/91/52/13/331915213.db2.gz	NMFKLWMIJWMBJJ-UHFFFAOYSA-N	0	0	291.460	4.080	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cc(C(C)(C)C)ccc1O	ZINC000485538408	331916351	/nfs/dbraw/zinc/91/63/51/331916351.db2.gz	UQELMICPSMCKMK-UHFFFAOYSA-N	0	0	275.392	4.231	20	30		CIEDRN
C[C@H](SC[C@@H]1CCO[C@H](C)C1)c1cccc(C#N)c1	ZINC000485578295	331917757	/nfs/dbraw/zinc/91/77/57/331917757.db2.gz	FFIJLFUSWVSRKM-VNHYZAJKSA-N	0	0	275.417	4.168	20	30		CIEDRN
C=CCCCCCSCCc1c(C)noc1C	ZINC000485594439	331918411	/nfs/dbraw/zinc/91/84/11/331918411.db2.gz	PHSCRLAABZRDGZ-UHFFFAOYSA-N	0	0	253.411	4.314	20	30		CIEDRN
N#Cc1cccnc1/C=C/c1ccc(F)c(C(F)(F)F)c1	ZINC000485989406	331928774	/nfs/dbraw/zinc/92/87/74/331928774.db2.gz	XMMRVJKNLWCKPZ-GQCTYLIASA-N	0	0	292.235	4.282	20	30		CIEDRN
N#Cc1cccc(COc2cc(Cl)cc3cccnc32)c1	ZINC000486115547	331932010	/nfs/dbraw/zinc/93/20/10/331932010.db2.gz	DNAMDCWSINHWIR-UHFFFAOYSA-N	0	0	294.741	4.339	20	30		CIEDRN
Cc1ccc(CCNc2cccc(OCCCC#N)c2)cc1	ZINC000486127708	331932033	/nfs/dbraw/zinc/93/20/33/331932033.db2.gz	RWLUYECFHNXTCS-UHFFFAOYSA-N	0	0	294.398	4.332	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N[C@@H](C)[C@H](C)CC	ZINC000486250581	331933953	/nfs/dbraw/zinc/93/39/53/331933953.db2.gz	GSWNVFSWIQJMGD-OLZOCXBDSA-N	0	0	277.433	4.129	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(C(=O)C2CCC2)cc1	ZINC000486292744	331934358	/nfs/dbraw/zinc/93/43/58/331934358.db2.gz	KJOLXLRLRUUIQX-ZDUSSCGKSA-N	0	0	285.387	4.210	20	30		CIEDRN
Cc1c2cc(C)c(C)cc2sc1C(=O)NC1(C#N)CCC1	ZINC000486305350	331934580	/nfs/dbraw/zinc/93/45/80/331934580.db2.gz	RDFKTJHYIULIRY-UHFFFAOYSA-N	0	0	298.411	4.003	20	30		CIEDRN
N#Cc1nc(Sc2ccc(F)cc2F)ccc1Cl	ZINC000486437400	331937027	/nfs/dbraw/zinc/93/70/27/331937027.db2.gz	VIWHGTWYJNZWKF-UHFFFAOYSA-N	0	0	282.702	4.036	20	30		CIEDRN
C=CCN(C(=O)c1sc2ccc(C)cc2c1C)C1CC1	ZINC000486440925	331937314	/nfs/dbraw/zinc/93/73/14/331937314.db2.gz	DBWMNNKDFKMCGJ-UHFFFAOYSA-N	0	0	285.412	4.309	20	30		CIEDRN
N#Cc1nc(Sc2cc(F)ccc2F)ccc1Cl	ZINC000486461438	331937628	/nfs/dbraw/zinc/93/76/28/331937628.db2.gz	ZPJBBRPKIJUZNU-UHFFFAOYSA-N	0	0	282.702	4.036	20	30		CIEDRN
CC(C)(Sc1ccc([N+](=O)[O-])cc1C#N)c1ccccc1	ZINC000486464699	331937630	/nfs/dbraw/zinc/93/76/30/331937630.db2.gz	GUSQKLWTQKKEPI-UHFFFAOYSA-N	0	0	298.367	4.494	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N(C)CC1CCCC1	ZINC000486476039	331938099	/nfs/dbraw/zinc/93/80/99/331938099.db2.gz	CTZAXPALEVRWFC-UHFFFAOYSA-N	0	0	289.444	4.227	20	30		CIEDRN
CC(C)(C)CN(C(=O)c1ccc(C#N)cc1)c1ccccc1	ZINC000486606624	331940426	/nfs/dbraw/zinc/94/04/26/331940426.db2.gz	QZSPURCBTCLVCV-UHFFFAOYSA-N	0	0	292.382	4.251	20	30		CIEDRN
CC(C)(C#N)c1ccccc1COc1cccc(F)c1F	ZINC000486900825	331948928	/nfs/dbraw/zinc/94/89/28/331948928.db2.gz	SXTPDCGOJSBVHQ-UHFFFAOYSA-N	0	0	287.309	4.345	20	30		CIEDRN
N#Cc1ccc(Cl)cc1N[C@H]1CCCC(F)(F)C1	ZINC000486901977	331948980	/nfs/dbraw/zinc/94/89/80/331948980.db2.gz	KGSHNSMVBLADNS-NSHDSACASA-N	0	0	270.710	4.201	20	30		CIEDRN
C=CCOc1ccc(C(=O)N(CC)c2ccccc2C)cc1	ZINC000487237950	331960626	/nfs/dbraw/zinc/96/06/26/331960626.db2.gz	VEXTXYXFTKCVNV-UHFFFAOYSA-N	0	0	295.382	4.227	20	30		CIEDRN
C=C(C)COc1cccc(NC/C=C/c2ccncc2)c1	ZINC000487272801	331962000	/nfs/dbraw/zinc/96/20/00/331962000.db2.gz	XBJKMMBNUSEMSY-SNAWJCMRSA-N	0	0	280.371	4.162	20	30		CIEDRN
CC(C)(C)OCCCCOc1cc(Cl)cc(C#N)c1	ZINC000487364617	331967623	/nfs/dbraw/zinc/96/76/23/331967623.db2.gz	YNQJVMRARSXDKU-UHFFFAOYSA-N	0	0	281.783	4.186	20	30		CIEDRN
C=CC[C@@H](C(=O)N(C)Cc1ccc(C)cc1)c1ccccc1	ZINC000487586157	331976505	/nfs/dbraw/zinc/97/65/05/331976505.db2.gz	UVZGALTZCKEJGM-LJQANCHMSA-N	0	0	293.410	4.313	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1ccc(OCC)cc1)c1ccccc1	ZINC000487636514	331977828	/nfs/dbraw/zinc/97/78/28/331977828.db2.gz	IBMSHNADHWJHAW-GOSISDBHSA-N	0	0	295.382	4.384	20	30		CIEDRN
C=CC[C@@H](C(=O)NCc1ccc(Cl)cc1)c1ccccc1	ZINC000487646132	331977988	/nfs/dbraw/zinc/97/79/88/331977988.db2.gz	MOTMZVPMUAZCSC-QGZVFWFLSA-N	0	0	299.801	4.316	20	30		CIEDRN
CC(C)c1ccc(NC(=O)c2cccc(F)c2C#N)cc1	ZINC000487646463	331978000	/nfs/dbraw/zinc/97/80/00/331978000.db2.gz	DEGAWYRDEJSNDO-UHFFFAOYSA-N	0	0	282.318	4.073	20	30		CIEDRN
CSc1ccc(CSc2ccc(C#N)c(C)n2)cc1	ZINC000487720217	331979623	/nfs/dbraw/zinc/97/96/23/331979623.db2.gz	AEJIVIQWRTYHDC-UHFFFAOYSA-N	0	0	286.425	4.276	20	30		CIEDRN
Cc1nc(N(C)Cc2csc3ccccc23)ccc1C#N	ZINC000487876124	331983134	/nfs/dbraw/zinc/98/31/34/331983134.db2.gz	NHHJHXVVLIVATC-UHFFFAOYSA-N	0	0	293.395	4.113	20	30		CIEDRN
C=CCCCNc1cc(Cl)ccc1OC[C@@H]1CCOC1	ZINC000488196899	331993563	/nfs/dbraw/zinc/99/35/63/331993563.db2.gz	NFNIRUMAOWCPHG-CYBMUJFWSA-N	0	0	295.810	4.133	20	30		CIEDRN
CC(C)O[C@H](CSc1ccc(C#N)cn1)c1ccccc1	ZINC000488210401	331993848	/nfs/dbraw/zinc/99/38/48/331993848.db2.gz	CAVMCTBGYPHRRT-MRXNPFEDSA-N	0	0	298.411	4.212	20	30		CIEDRN
N#Cc1c(F)cccc1CSc1cc(F)ccc1F	ZINC000488240696	331995642	/nfs/dbraw/zinc/99/56/42/331995642.db2.gz	CBRJOQWYWDNOLZ-UHFFFAOYSA-N	0	0	279.286	4.268	20	30		CIEDRN
CC(C)O[C@@H](COc1ccc(C#N)cc1)c1ccccc1	ZINC000488262110	331996352	/nfs/dbraw/zinc/99/63/52/331996352.db2.gz	YCKCCWFIQYIFEM-SFHVURJKSA-N	0	0	281.355	4.103	20	30		CIEDRN
Cc1ccc2ncc(C#N)c(OCc3cccc(F)c3)c2c1	ZINC000488261415	331996419	/nfs/dbraw/zinc/99/64/19/331996419.db2.gz	ITJZGESWHJHQSS-UHFFFAOYSA-N	0	0	292.313	4.133	20	30		CIEDRN
CCc1c(C)sc(NC(=O)C[C@H]2C=CCCC2)c1C#N	ZINC000488341980	332000953	/nfs/dbraw/zinc/00/09/53/332000953.db2.gz	WEYGFERIZQXIKA-LBPRGKRZSA-N	0	0	288.416	4.176	20	30		CIEDRN
C=CCC[C@@H](C(=O)N(C)C[C@@H](C)CC)c1ccccc1	ZINC000488388816	332003437	/nfs/dbraw/zinc/00/34/37/332003437.db2.gz	RDZQAYNIKXPHCE-DOTOQJQBSA-N	0	0	273.420	4.241	20	30		CIEDRN
Cc1cccc2c1[C@H](C)C[C@H]2CC(=O)N[C@@](C)(C#N)C(C)C	ZINC000488396723	332003856	/nfs/dbraw/zinc/00/38/56/332003856.db2.gz	YPJVSQYPXPJWLS-VCBZYWHSSA-N	0	0	298.430	4.030	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1cccc(SC)c1C	ZINC000488560452	332017605	/nfs/dbraw/zinc/01/76/05/332017605.db2.gz	KIXVQKGZORZWSG-CYBMUJFWSA-N	0	0	290.432	4.289	20	30		CIEDRN
C=CCC[C@@H](C(=O)N(CC)CC(C)C)c1ccccc1	ZINC000488613560	332020128	/nfs/dbraw/zinc/02/01/28/332020128.db2.gz	NOTMHIVJTBJAQU-QGZVFWFLSA-N	0	0	273.420	4.241	20	30		CIEDRN
C=CCC[C@@H](C(=O)N(CC)CC(F)(F)F)c1ccccc1	ZINC000488626593	332020334	/nfs/dbraw/zinc/02/03/34/332020334.db2.gz	KVJNKWDCXNBWEL-CQSZACIVSA-N	0	0	299.336	4.147	20	30		CIEDRN
Cc1ccccc1[C@H](C)Sc1ccc(C#N)cn1	ZINC000488651152	332020764	/nfs/dbraw/zinc/02/07/64/332020764.db2.gz	DBLHRMWMSJSMHG-LBPRGKRZSA-N	0	0	254.358	4.115	20	30		CIEDRN
CCN(C[C@@H](C)C#N)[C@H]1CCc2c1cc(Cl)cc2Cl	ZINC000488641674	332020843	/nfs/dbraw/zinc/02/08/43/332020843.db2.gz	FDTZCHKWJZERGX-BONVTDFDSA-N	0	0	297.229	4.462	20	30		CIEDRN
Cc1ccccc1[C@@H](C)Sc1ccc(C#N)cn1	ZINC000488651150	332020895	/nfs/dbraw/zinc/02/08/95/332020895.db2.gz	DBLHRMWMSJSMHG-GFCCVEGCSA-N	0	0	254.358	4.115	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@H](C)Cc1ccccc1	ZINC000498547973	332021255	/nfs/dbraw/zinc/02/12/55/332021255.db2.gz	JFITXZDBMNMYJL-MRXNPFEDSA-N	0	0	273.420	4.070	20	30		CIEDRN
CC[C@H](CC1CCCCC1)C(=O)N[C@](C)(C#N)C(C)C	ZINC000488690882	332021782	/nfs/dbraw/zinc/02/17/82/332021782.db2.gz	GDQIVJLOKSNJSK-NVXWUHKLSA-N	0	0	278.440	4.037	20	30		CIEDRN
Cc1ccoc1CNc1cc(C#N)ccc1C(F)(F)F	ZINC000488694219	332021973	/nfs/dbraw/zinc/02/19/73/332021973.db2.gz	FHBFQFYUHGUZEK-UHFFFAOYSA-N	0	0	280.249	4.091	20	30		CIEDRN
N#Cc1cccc(N[C@@H]2CCCc3sc(Cl)cc32)n1	ZINC000488724249	332022946	/nfs/dbraw/zinc/02/29/46/332022946.db2.gz	SAWIWVZEDHGTBM-LLVKDONJSA-N	0	0	289.791	4.158	20	30		CIEDRN
Cc1cc(Cl)c(C(=O)N(C)c2ccc(C#N)cc2)cc1C	ZINC000511630855	332937554	/nfs/dbraw/zinc/93/75/54/332937554.db2.gz	SDTXFJBDAXTMRE-UHFFFAOYSA-N	0	0	298.773	4.105	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1ccc(-c2cccs2)o1	ZINC000488817426	332027025	/nfs/dbraw/zinc/02/70/25/332027025.db2.gz	OUGLTRRUOGUTEV-LBPRGKRZSA-N	0	0	287.384	4.189	20	30		CIEDRN
C=CCCC(=O)N[C@H](c1cccc(C)c1)C(C)(C)C	ZINC000488821708	332027484	/nfs/dbraw/zinc/02/74/84/332027484.db2.gz	RPWGPYPMVQVLMZ-MRXNPFEDSA-N	0	0	259.393	4.165	20	30		CIEDRN
C=CCCC(=O)N[C@@H](c1cccc(C)c1)C(C)(C)C	ZINC000488821706	332027513	/nfs/dbraw/zinc/02/75/13/332027513.db2.gz	RPWGPYPMVQVLMZ-INIZCTEOSA-N	0	0	259.393	4.165	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1ccc(CSCC)cc1	ZINC000488829274	332027812	/nfs/dbraw/zinc/02/78/12/332027812.db2.gz	CVBIJHULKDVNJS-INIZCTEOSA-N	0	0	289.444	4.120	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1ccc(Cl)c(Cl)c1	ZINC000488838700	332028390	/nfs/dbraw/zinc/02/83/90/332028390.db2.gz	DQRSKFBWDANYFH-NSHDSACASA-N	0	0	284.186	4.174	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1ccc(OCCCC)cc1	ZINC000488841564	332028626	/nfs/dbraw/zinc/02/86/26/332028626.db2.gz	REZLEYDPFKDAGX-MRXNPFEDSA-N	0	0	287.403	4.046	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)C[C@@H](c1ccccc1)C(C)C	ZINC000488855516	332029594	/nfs/dbraw/zinc/02/95/94/332029594.db2.gz	ANAZIXPMIAJYMR-ZWKOTPCHSA-N	0	0	285.431	4.383	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)C[C@@H]1CCCc2ccccc21	ZINC000488855324	332029669	/nfs/dbraw/zinc/02/96/69/332029669.db2.gz	ABRDLAYRKBZZEJ-IRXDYDNUSA-N	0	0	283.415	4.064	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)C[C@@H]1CCCc2ccccc21	ZINC000488855320	332029702	/nfs/dbraw/zinc/02/97/02/332029702.db2.gz	ABRDLAYRKBZZEJ-DLBZAZTESA-N	0	0	283.415	4.064	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1ccc(C(C)(C)C)cc1	ZINC000488856985	332029709	/nfs/dbraw/zinc/02/97/09/332029709.db2.gz	NCXFYPSLQTVAPC-MRXNPFEDSA-N	0	0	271.404	4.165	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1cc2ccccc2s1	ZINC000488870436	332030408	/nfs/dbraw/zinc/03/04/08/332030408.db2.gz	OERDKLBTRSHMIC-CYBMUJFWSA-N	0	0	271.385	4.082	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@H]1C[C@H]1c1cccc(Cl)c1	ZINC000488873046	332030675	/nfs/dbraw/zinc/03/06/75/332030675.db2.gz	ATSCNWWNORLJBI-PMPSAXMXSA-N	0	0	289.806	4.011	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1	ZINC000488873044	332030711	/nfs/dbraw/zinc/03/07/11/332030711.db2.gz	ATSCNWWNORLJBI-BZUAXINKSA-N	0	0	289.806	4.011	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)CCCCc1ccc(C)cc1	ZINC000488878951	332031642	/nfs/dbraw/zinc/03/16/42/332031642.db2.gz	QXNXJQWGVHFCHI-SFHVURJKSA-N	0	0	285.431	4.275	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@@H]1CC[C@H]2CCC[C@@H]2C1)c1ccccc1	ZINC000488995230	332037097	/nfs/dbraw/zinc/03/70/97/332037097.db2.gz	HUUAJZYKXGPHFG-OWYHZJEWSA-N	0	0	297.442	4.431	20	30		CIEDRN
C=CC[C@H](C(=O)N1CCC[C@@H]2CCC[C@@H]21)c1ccccc1	ZINC000489026499	332038434	/nfs/dbraw/zinc/03/84/34/332038434.db2.gz	ZCSOVWRIBFZGLJ-BZSNNMDCSA-N	0	0	283.415	4.137	20	30		CIEDRN
C=C[C@H]1CCCCN1Cc1cc(Br)cs1	ZINC000489403447	332050641	/nfs/dbraw/zinc/05/06/41/332050641.db2.gz	LILMYQXSJKBWOH-NSHDSACASA-N	0	0	286.238	4.051	20	30		CIEDRN
C=C[C@H]1CCCCN1Cc1csc(-c2ccc(C)o2)n1	ZINC000489448176	332052976	/nfs/dbraw/zinc/05/29/76/332052976.db2.gz	QYYRABDAUQILRZ-AWEZNQCLSA-N	0	0	288.416	4.252	20	30		CIEDRN
C=C[C@H]1CCCC[N@@H+]1Cc1cnc(-c2ccccc2)s1	ZINC000489469104	332054549	/nfs/dbraw/zinc/05/45/49/332054549.db2.gz	CZAWZNTVMXDOOL-HNNXBMFYSA-N	0	0	284.428	4.351	20	30		CIEDRN
C=C[C@H]1CCCCN1Cc1csc(-c2ccsc2)n1	ZINC000489484069	332055562	/nfs/dbraw/zinc/05/55/62/332055562.db2.gz	POIARARNEIQQFC-AWEZNQCLSA-N	0	0	290.457	4.412	20	30		CIEDRN
C=C[C@@H]1CCCCN1Cc1ccc(Br)s1	ZINC000489499405	332057032	/nfs/dbraw/zinc/05/70/32/332057032.db2.gz	QQBRNRDPYUDBJG-SNVBAGLBSA-N	0	0	286.238	4.051	20	30		CIEDRN
C=C[C@H]1CCCCN1Cc1nc(-c2cccs2)oc1C	ZINC000489501178	332057113	/nfs/dbraw/zinc/05/71/13/332057113.db2.gz	UAEJZQHUENNRAS-ZDUSSCGKSA-N	0	0	288.416	4.252	20	30		CIEDRN
C=CCCN(C)C(=O)C[C@H]1C[C@@H](C)c2c1cccc2C	ZINC000489573983	332059880	/nfs/dbraw/zinc/05/98/80/332059880.db2.gz	RJDAGOYBUNEEBZ-HUUCEWRRSA-N	0	0	271.404	4.010	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)NCc1cc2ccccc2s1	ZINC000489596898	332060817	/nfs/dbraw/zinc/06/08/17/332060817.db2.gz	LEEOQKPMJDJRCM-INIZCTEOSA-N	0	0	273.401	4.120	20	30		CIEDRN
C=CCC[C@@H](C(=O)N(C)[C@@H](C)C1CCC1)c1ccccc1	ZINC000489615759	332061514	/nfs/dbraw/zinc/06/15/14/332061514.db2.gz	GFLBBQYSXKELSA-MAUKXSAKSA-N	0	0	285.431	4.383	20	30		CIEDRN
C=CCC[C@@H](C(=O)N(C)[C@H](C)C1CCC1)c1ccccc1	ZINC000489615756	332061670	/nfs/dbraw/zinc/06/16/70/332061670.db2.gz	GFLBBQYSXKELSA-CRAIPNDOSA-N	0	0	285.431	4.383	20	30		CIEDRN
CC#CCCCC(=O)N[C@H]1CCC[C@H](c2ccccc2)C1	ZINC000489638098	332062557	/nfs/dbraw/zinc/06/25/57/332062557.db2.gz	VPXUKSSQMCGWRC-ROUUACIJSA-N	0	0	283.415	4.023	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)[C@H](CC=C)c1ccccc1	ZINC000489643427	332062646	/nfs/dbraw/zinc/06/26/46/332062646.db2.gz	TYEDTABWBXEZNE-NVXWUHKLSA-N	0	0	271.404	4.207	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1scnc1CC)c1ccccc1	ZINC000489693767	332064958	/nfs/dbraw/zinc/06/49/58/332064958.db2.gz	FQMTYBSJVHCLKV-CYBMUJFWSA-N	0	0	286.400	4.004	20	30		CIEDRN
C=C[C@H](C)NC(=O)Nc1cc(Cl)ccc1C(F)(F)F	ZINC000489740193	332066499	/nfs/dbraw/zinc/06/64/99/332066499.db2.gz	WXJOOYTYWWBIIH-ZETCQYMHSA-N	0	0	292.688	4.055	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@@H]1CCCC(F)(F)C1)c1ccccc1	ZINC000489758937	332067056	/nfs/dbraw/zinc/06/70/56/332067056.db2.gz	ZRCPDBOVCDUZKE-CABCVRRESA-N	0	0	293.357	4.040	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1[nH]c2ccccc2c1Cl	ZINC000489795854	332067982	/nfs/dbraw/zinc/06/79/82/332067982.db2.gz	KQJGPOLMEAQKHM-UHFFFAOYSA-N	0	0	290.794	4.153	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)CCc1cc(Cl)cs1	ZINC000489799584	332068259	/nfs/dbraw/zinc/06/82/59/332068259.db2.gz	KHZYUMMMRHCEJG-UHFFFAOYSA-N	0	0	285.840	4.053	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1ccc(C2CCC2)cc1	ZINC000489820438	332069002	/nfs/dbraw/zinc/06/90/02/332069002.db2.gz	NYYHGRLXBUIECO-UHFFFAOYSA-N	0	0	272.392	4.384	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)C[C@@H](C)c1ccccc1F	ZINC000489912440	332072714	/nfs/dbraw/zinc/07/27/14/332072714.db2.gz	VSVVUDSTHDSVPO-CYBMUJFWSA-N	0	0	277.383	4.038	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@H](CCC)c1ccccn1	ZINC000498575752	332073419	/nfs/dbraw/zinc/07/34/19/332073419.db2.gz	PEWXZTJFRBLTJA-MRXNPFEDSA-N	0	0	288.435	4.170	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)CC1CC(c2ccccc2)C1	ZINC000489967637	332074989	/nfs/dbraw/zinc/07/49/89/332074989.db2.gz	UFYPKTLCGPPOAG-UHFFFAOYSA-N	0	0	285.431	4.289	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1cc(C(C)C)oc1C	ZINC000490034182	332077520	/nfs/dbraw/zinc/07/75/20/332077520.db2.gz	UBFQJKKJRJSNQR-UHFFFAOYSA-N	0	0	263.381	4.044	20	30		CIEDRN
C=CCn1cccc1C(=O)Nc1ccccc1OC(C)(C)C	ZINC000490042899	332078146	/nfs/dbraw/zinc/07/81/46/332078146.db2.gz	JYFSEFHRPPPQEB-UHFFFAOYSA-N	0	0	298.386	4.104	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@H]1CCC[C@H](C(F)(F)F)C1	ZINC000490055330	332078895	/nfs/dbraw/zinc/07/88/95/332078895.db2.gz	BNCWJVLNJFOPLP-RYUDHWBXSA-N	0	0	291.357	4.074	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1	ZINC000490055332	332079022	/nfs/dbraw/zinc/07/90/22/332079022.db2.gz	BNCWJVLNJFOPLP-VXGBXAGGSA-N	0	0	291.357	4.074	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@H]1CCCC[C@@H]1C(F)(F)F	ZINC000490060309	332079380	/nfs/dbraw/zinc/07/93/80/332079380.db2.gz	PGUWJKFLCNXCOP-RYUDHWBXSA-N	0	0	291.357	4.074	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@H](C)c1ccc(CC)cc1	ZINC000490064579	332079451	/nfs/dbraw/zinc/07/94/51/332079451.db2.gz	BWBBSDKCPBTCLV-CQSZACIVSA-N	0	0	273.420	4.071	20	30		CIEDRN
C=CCN(C)C(=O)c1ccc(C)cc1Sc1ccccc1	ZINC000490067148	332079909	/nfs/dbraw/zinc/07/99/09/332079909.db2.gz	WOUNYQSWOITQIG-UHFFFAOYSA-N	0	0	297.423	4.404	20	30		CIEDRN
C[C@@H](C#N)CN(C)[C@@H](C)c1cc(Cl)ccc1Cl	ZINC000490159217	332083214	/nfs/dbraw/zinc/08/32/14/332083214.db2.gz	QEKLIQQTALRAPO-UWVGGRQHSA-N	0	0	271.191	4.146	20	30		CIEDRN
C[C@H](C#N)CN(C)[C@@H](C)c1cc(Cl)ccc1Cl	ZINC000490159219	332083384	/nfs/dbraw/zinc/08/33/84/332083384.db2.gz	QEKLIQQTALRAPO-ZJUUUORDSA-N	0	0	271.191	4.146	20	30		CIEDRN
N#CC1(C(=O)Nc2csc3ccccc23)CCCCC1	ZINC000490213722	332084558	/nfs/dbraw/zinc/08/45/58/332084558.db2.gz	YZVQLQAJRLERFX-UHFFFAOYSA-N	0	0	284.384	4.314	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)CCCC(C)(C)C	ZINC000490227706	332085031	/nfs/dbraw/zinc/08/50/31/332085031.db2.gz	STWRFUJNGSLROH-UHFFFAOYSA-N	0	0	277.408	4.053	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@@H](C)CCC1CC1)c1ccccc1	ZINC000490251671	332085377	/nfs/dbraw/zinc/08/53/77/332085377.db2.gz	OFXGJYDMMULSRD-WMLDXEAASA-N	0	0	271.404	4.041	20	30		CIEDRN
C=C(C)[C@H](CC(=O)Nc1csc2ccccc12)OCC	ZINC000490239759	332085397	/nfs/dbraw/zinc/08/53/97/332085397.db2.gz	FQSMRYWJWXGTCR-AWEZNQCLSA-N	0	0	289.400	4.211	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)Nc1csc2ccccc12)OCC	ZINC000490239790	332085403	/nfs/dbraw/zinc/08/54/03/332085403.db2.gz	FQSMRYWJWXGTCR-CQSZACIVSA-N	0	0	289.400	4.211	20	30		CIEDRN
C=CC[C@H](C(=O)N1CCc2c1cccc2F)c1ccccc1	ZINC000490252829	332085630	/nfs/dbraw/zinc/08/56/30/332085630.db2.gz	RAABTQHPXUGBQZ-HNNXBMFYSA-N	0	0	295.357	4.075	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)[C@H](C)CC1CCCC1	ZINC000490269965	332085787	/nfs/dbraw/zinc/08/57/87/332085787.db2.gz	FHBQEGSILHPBBW-OAHLLOKOSA-N	0	0	289.419	4.053	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCCCCCc1ccc(F)cc1	ZINC000490458751	332089929	/nfs/dbraw/zinc/08/99/29/332089929.db2.gz	OMFAIGGKUSHXIM-OAHLLOKOSA-N	0	0	291.410	4.257	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1ccc(-c2ccco2)cc1F	ZINC000490508948	332090374	/nfs/dbraw/zinc/09/03/74/332090374.db2.gz	GBMUQKANUYYTKF-UHFFFAOYSA-N	0	0	288.322	4.126	20	30		CIEDRN
Cc1ccc2oc(SCc3cccc(C#N)c3)nc2c1	ZINC000303646453	332943644	/nfs/dbraw/zinc/94/36/44/332943644.db2.gz	STNOZMZDWWULAB-UHFFFAOYSA-N	0	0	280.352	4.300	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1ccc(CC)c(Cl)c1	ZINC000490784967	332115730	/nfs/dbraw/zinc/11/57/30/332115730.db2.gz	PZVOGSBOAAZOGC-UHFFFAOYSA-N	0	0	280.799	4.332	20	30		CIEDRN
C=CCN(C)C(=O)C1(Sc2ccc(C)cc2)CCCC1	ZINC000490929448	332130154	/nfs/dbraw/zinc/13/01/54/332130154.db2.gz	WPDOHESGTBSDFB-UHFFFAOYSA-N	0	0	289.444	4.044	20	30		CIEDRN
CCCN(C(=O)CC(C)(C)C#N)[C@H](CC)c1ccccc1	ZINC000490933553	332130363	/nfs/dbraw/zinc/13/03/63/332130363.db2.gz	KZTDWRDIYPBNHE-MRXNPFEDSA-N	0	0	286.419	4.316	20	30		CIEDRN
C=CCN(C)C(=O)c1ccc(-c2ccc(C)c(C)c2)cc1F	ZINC000490936221	332130848	/nfs/dbraw/zinc/13/08/48/332130848.db2.gz	AELJUQKUJNBCOH-UHFFFAOYSA-N	0	0	297.373	4.368	20	30		CIEDRN
C=CCN(C)C(=O)c1cc(C)ccc1SC1CCCC1	ZINC000491019929	332139341	/nfs/dbraw/zinc/13/93/41/332139341.db2.gz	POJTUIKQMANXQG-UHFFFAOYSA-N	0	0	289.444	4.288	20	30		CIEDRN
Cc1ccc2oc(SCc3cc(C#N)ccc3F)nc2c1	ZINC000303685361	332947461	/nfs/dbraw/zinc/94/74/61/332947461.db2.gz	ZTXDEUBDRRHSNG-UHFFFAOYSA-N	0	0	298.342	4.439	20	30		CIEDRN
C#C[C@H](N[C@H](C)c1cc(C)ccn1)c1ccc(Cl)cc1	ZINC000491496724	332223280	/nfs/dbraw/zinc/22/32/80/332223280.db2.gz	SLSYKSIUGTUSBK-CJNGLKHVSA-N	0	0	284.790	4.069	20	30		CIEDRN
CC(C)[C@H]1CCCC[C@H]1NC(=O)Nc1ccc(CC#N)cc1	ZINC000491836007	332371402	/nfs/dbraw/zinc/37/14/02/332371402.db2.gz	VLRKBMFKBSCWNR-IAGOWNOFSA-N	0	0	299.418	4.089	20	30		CIEDRN
Cc1cccc(Cl)c1NC(=O)/C=C/c1ccc(C#N)cc1	ZINC000492061993	332381225	/nfs/dbraw/zinc/38/12/25/332381225.db2.gz	ZIOWTQOUZWPPQY-MDZDMXLPSA-N	0	0	296.757	4.172	20	30		CIEDRN
CCC[C@H](CC1CCCCC1)C(=O)N(CC)CCC#N	ZINC000492075326	332381672	/nfs/dbraw/zinc/38/16/72/332381672.db2.gz	DUMZIGISGDBAOG-MRXNPFEDSA-N	0	0	278.440	4.135	20	30		CIEDRN
CCCCCc1ccc(Oc2nnc(C)c(C)c2C#N)cc1	ZINC000492100101	332382906	/nfs/dbraw/zinc/38/29/06/332382906.db2.gz	HICFHXBDAIESDQ-UHFFFAOYSA-N	0	0	295.386	4.490	20	30		CIEDRN
C=CCCO[C@@H](C)C(=O)Nc1ccc(CCCCC)cc1	ZINC000492246748	332388937	/nfs/dbraw/zinc/38/89/37/332388937.db2.gz	UIHGVCINROBMHS-HNNXBMFYSA-N	0	0	289.419	4.339	20	30		CIEDRN
CCOc1ccc(C#N)cc1N[C@H](C)c1ccc(C#N)cc1	ZINC000172417721	335104947	/nfs/dbraw/zinc/10/49/47/335104947.db2.gz	WARXIWKINWFHFG-CYBMUJFWSA-N	0	0	291.354	4.002	20	30		CIEDRN
N#CCCC[C@@H](NC(=O)/C=C\C1CCCC1)c1ccccc1	ZINC000493351541	332436655	/nfs/dbraw/zinc/43/66/55/332436655.db2.gz	KGZYTYFLDUHDOF-SWNWVQGVSA-N	0	0	296.414	4.284	20	30		CIEDRN
C/C=C(/C=C/C(=O)N[C@@H](CCC#N)c1ccccc1)CC	ZINC000493597766	332446611	/nfs/dbraw/zinc/44/66/11/332446611.db2.gz	NIBPBYQGIXTNPJ-OLXSXQHCSA-N	0	0	282.387	4.060	20	30		CIEDRN
COc1ccc(C#N)cc1N[C@H](C)c1cccc(Cl)c1	ZINC000493835531	332455898	/nfs/dbraw/zinc/45/58/98/332455898.db2.gz	NFVFUXXPJWNHKI-LLVKDONJSA-N	0	0	286.762	4.393	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1ccc(F)cc1OC(C)C	ZINC000494331683	332470411	/nfs/dbraw/zinc/47/04/11/332470411.db2.gz	JZHBKDKGCCRLBI-UHFFFAOYSA-N	0	0	294.370	4.043	20	30		CIEDRN
C[C@H](CC(=O)Nc1ccc(C#N)cc1Cl)c1ccccc1	ZINC000494633569	332481042	/nfs/dbraw/zinc/48/10/42/332481042.db2.gz	QMMPAUUCEQHVRI-GFCCVEGCSA-N	0	0	298.773	4.344	20	30		CIEDRN
C=CC[C@H](C)[C@@H](C)Nc1cnn(CC(C)C)c1C(F)F	ZINC000495146448	332508480	/nfs/dbraw/zinc/50/84/80/332508480.db2.gz	FEFQCKUDQSUURK-NWDGAFQWSA-N	0	0	285.382	4.489	20	30		CIEDRN
CC(C)[C@@H](c1ccccc1)N(C)C(=O)c1sccc1C#N	ZINC000496220798	332542914	/nfs/dbraw/zinc/54/29/14/332542914.db2.gz	AOIWLVFSVPIQDJ-HNNXBMFYSA-N	0	0	298.411	4.089	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H](C)c1cc(C)sc1C	ZINC000496879713	332563157	/nfs/dbraw/zinc/56/31/57/332563157.db2.gz	FFUMWLANDHCHRZ-NSHDSACASA-N	0	0	265.422	4.144	20	30		CIEDRN
N#Cc1c(F)cccc1N(Cc1ccccc1F)C1CC1	ZINC000498803165	332573148	/nfs/dbraw/zinc/57/31/48/332573148.db2.gz	INYYAKBDHYBNID-UHFFFAOYSA-N	0	0	284.309	4.005	20	30		CIEDRN
N#Cc1c(F)cccc1Nc1ccc(OCC2CC2)cc1	ZINC000498927500	332575679	/nfs/dbraw/zinc/57/56/79/332575679.db2.gz	ZADIXQFFPCHQKE-UHFFFAOYSA-N	0	0	282.318	4.230	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cc(F)c(SC)c(F)c1	ZINC000499112003	332579662	/nfs/dbraw/zinc/57/96/62/332579662.db2.gz	DLFQMSYANHSQJF-UHFFFAOYSA-N	0	0	285.359	4.228	20	30		CIEDRN
CCC[C@@H](CC1CCCCC1)C(=O)N1CCC(C#N)CC1	ZINC000500021578	332597577	/nfs/dbraw/zinc/59/75/77/332597577.db2.gz	WUVXXGZFFHDHFG-KRWDZBQOSA-N	0	0	290.451	4.135	20	30		CIEDRN
CC(C)(C#N)c1ccccc1CN(C#N)c1ccccc1F	ZINC000500045199	332597952	/nfs/dbraw/zinc/59/79/52/332597952.db2.gz	JGTWLNOTUHBBRJ-UHFFFAOYSA-N	0	0	293.345	4.115	20	30		CIEDRN
CCCN(Cc1ccc(C#N)cc1)C(=O)[C@@H]1CCCC1(C)C	ZINC000500091141	332598988	/nfs/dbraw/zinc/59/89/88/332598988.db2.gz	SEOBRGVGLIJZGU-KRWDZBQOSA-N	0	0	298.430	4.123	20	30		CIEDRN
N#Cc1ccc(CSc2ccccc2F)cc1F	ZINC000404763693	332611201	/nfs/dbraw/zinc/61/12/01/332611201.db2.gz	UEYKDLCNFUZNIM-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
CCC1(CC)CN(C(=O)C2(C#N)CCCC2)c2ccccc21	ZINC000500850262	332620358	/nfs/dbraw/zinc/62/03/58/332620358.db2.gz	RPWTZBUZYIAQMK-UHFFFAOYSA-N	0	0	296.414	4.175	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCc1cccc(C(C)C)c1	ZINC000501096086	332626506	/nfs/dbraw/zinc/62/65/06/332626506.db2.gz	SYNUOCQJVPQZEC-UHFFFAOYSA-N	0	0	259.393	4.029	20	30		CIEDRN
C=CCOc1cccc(NC(=O)C[C@@H](C)c2ccccc2)c1	ZINC000501155501	332627834	/nfs/dbraw/zinc/62/78/34/332627834.db2.gz	OCXQDQXBACYBEL-OAHLLOKOSA-N	0	0	295.382	4.384	20	30		CIEDRN
C=CCOc1cccc(NC(=O)C[C@H](C)CCC)c1	ZINC000501184933	332628127	/nfs/dbraw/zinc/62/81/27/332628127.db2.gz	JBJGEGCYZTTXKV-CYBMUJFWSA-N	0	0	261.365	4.016	20	30		CIEDRN
CC(C)C[C@@H]1CCN(c2ccc(Cl)cc2C#N)C1	ZINC000307781264	332635112	/nfs/dbraw/zinc/63/51/12/332635112.db2.gz	UHPNWPUTHKEMSQ-LBPRGKRZSA-N	0	0	262.784	4.084	20	30		CIEDRN
C=CCCc1ccccc1N[C@@H](C)c1ccccn1	ZINC000502360829	332654780	/nfs/dbraw/zinc/65/47/80/332654780.db2.gz	CASANVPFZLPNGT-AWEZNQCLSA-N	0	0	252.361	4.373	20	30		CIEDRN
CC#CCCS[C@H](C)c1nc(-c2cccs2)no1	ZINC000154931728	334708397	/nfs/dbraw/zinc/70/83/97/334708397.db2.gz	AKNZVJATNXALJF-SNVBAGLBSA-N	0	0	278.402	4.006	20	30		CIEDRN
N#CCc1ccc(NC(=O)NCCCC2CCCCC2)cc1	ZINC000503257810	332684832	/nfs/dbraw/zinc/68/48/32/332684832.db2.gz	OPILYIUAXCBZGX-UHFFFAOYSA-N	0	0	299.418	4.235	20	30		CIEDRN
CCc1cccc(CC)c1-n1ccnc1SCCCC#N	ZINC000503259058	332684900	/nfs/dbraw/zinc/68/49/00/332684900.db2.gz	YNVGTZADDWMSGZ-UHFFFAOYSA-N	0	0	299.443	4.393	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)[C@H]1C[C@H](C)C[C@H](C)C1	ZINC000503420558	332689010	/nfs/dbraw/zinc/68/90/10/332689010.db2.gz	SSNSXZLJYSMQKV-FICVDOATSA-N	0	0	278.440	4.037	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)C1C[C@H](C)C[C@@H](C)C1	ZINC000503420560	332689159	/nfs/dbraw/zinc/68/91/59/332689159.db2.gz	SSNSXZLJYSMQKV-ZIAGYGMSSA-N	0	0	278.440	4.037	20	30		CIEDRN
CCC(C)(C)CC(=O)N1CC=C(c2ccc(C#N)cc2)CC1	ZINC000503889044	332697764	/nfs/dbraw/zinc/69/77/64/332697764.db2.gz	FSLAJXOPBCILOZ-UHFFFAOYSA-N	0	0	296.414	4.000	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N1CC(C)(C)[C@H]1c1cccs1	ZINC000504079232	332703361	/nfs/dbraw/zinc/70/33/61/332703361.db2.gz	VASWMZQTLGUKCX-TZMCWYRMSA-N	0	0	292.448	4.195	20	30		CIEDRN
CC[C@H](CC(=O)Nc1ccc(CC#N)cc1)c1ccccc1	ZINC000504360147	332709200	/nfs/dbraw/zinc/70/92/00/332709200.db2.gz	QMDAUWRDSUBANI-MRXNPFEDSA-N	0	0	292.382	4.275	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)CCc1ccccc1C	ZINC000504389451	332710561	/nfs/dbraw/zinc/71/05/61/332710561.db2.gz	XACHALKIXZCDFI-UHFFFAOYSA-N	0	0	299.439	4.204	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)C[C@@H]1CCC[C@@H](C)C1	ZINC000504590613	332716014	/nfs/dbraw/zinc/71/60/14/332716014.db2.gz	FDXJIXMWDWGJLI-TZMCWYRMSA-N	0	0	270.376	4.022	20	30		CIEDRN
N#Cc1cnccc1/C=C\c1ccccc1OC1CCCC1	ZINC000504710289	332719256	/nfs/dbraw/zinc/71/92/56/332719256.db2.gz	ADIXZEZYWYKONQ-KTKRTIGZSA-N	0	0	290.366	4.445	20	30		CIEDRN
Cc1cc(Br)ccc1/C=C\c1ccncc1C#N	ZINC000504743406	332719989	/nfs/dbraw/zinc/71/99/89/332719989.db2.gz	WBOLHYLMFBWKDB-IHWYPQMZSA-N	0	0	299.171	4.195	20	30		CIEDRN
CC(C)(C)c1nc(COc2cc(F)cc(C#N)c2)cs1	ZINC000516597194	332720144	/nfs/dbraw/zinc/72/01/44/332720144.db2.gz	XEJXHZRISFMNNP-UHFFFAOYSA-N	0	0	290.363	4.030	20	30		CIEDRN
CC(C)(C)CN(Cc1ccccc1)C(=O)C1(C#N)CCCC1	ZINC000504887507	332723531	/nfs/dbraw/zinc/72/35/31/332723531.db2.gz	JNNWDJKNHYAFMJ-UHFFFAOYSA-N	0	0	298.430	4.145	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N(C)Cc1ccoc1C	ZINC000505000962	332727277	/nfs/dbraw/zinc/72/72/77/332727277.db2.gz	MMHZHVASBFGDQZ-UHFFFAOYSA-N	0	0	298.386	4.371	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CC[C@@H](C)[C@@H](C)C1	ZINC000505011110	332727675	/nfs/dbraw/zinc/72/76/75/332727675.db2.gz	QHGOXLCJAMBCEM-CABCVRRESA-N	0	0	286.419	4.315	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N[C@@H]1C=CCCC1	ZINC000505011208	332727780	/nfs/dbraw/zinc/72/77/80/332727780.db2.gz	RQVWLZOITKPRCL-OAHLLOKOSA-N	0	0	270.376	4.035	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N(C)C(C1CC1)C1CC1	ZINC000505016411	332727972	/nfs/dbraw/zinc/72/79/72/332727972.db2.gz	GZNUFDQBANSLJZ-UHFFFAOYSA-N	0	0	298.430	4.458	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N(C)[C@@H]1CC[C@H](C)C1	ZINC000505028212	332728392	/nfs/dbraw/zinc/72/83/92/332728392.db2.gz	AALXUBLSGGQMBE-GOEBONIOSA-N	0	0	286.419	4.458	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N(CC)CC1CCC1	ZINC000505045312	332728922	/nfs/dbraw/zinc/72/89/22/332728922.db2.gz	HYOQDYNKYWTDQP-UHFFFAOYSA-N	0	0	286.419	4.459	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)C[C@@H]2CCC[C@H](C)C2)s1	ZINC000505069943	332730039	/nfs/dbraw/zinc/73/00/39/332730039.db2.gz	DTZOTJMKDOYLGU-NWDGAFQWSA-N	0	0	290.432	4.337	20	30		CIEDRN
C=C(C)CN(CC)C(=O)NC[C@H](c1ccccc1)C(C)C	ZINC000505209505	332733751	/nfs/dbraw/zinc/73/37/51/332733751.db2.gz	HIEQQRHTKJEPBB-KRWDZBQOSA-N	0	0	288.435	4.034	20	30		CIEDRN
CCC[C@H](C)C(=O)N[C@H](C#N)c1cccc(Cl)c1Cl	ZINC000505330614	332737562	/nfs/dbraw/zinc/73/75/62/332737562.db2.gz	LEHKQPCBBXEDKL-JOYOIKCWSA-N	0	0	299.201	4.110	20	30		CIEDRN
C=C(C)CCSc1nnc(SCCCC)s1	ZINC000505443340	332740616	/nfs/dbraw/zinc/74/06/16/332740616.db2.gz	GTBFDUMUWWJEDB-UHFFFAOYSA-N	0	0	274.480	4.489	20	30		CIEDRN
C=CCn1c2ccccc2nc1SCCCCF	ZINC000505455884	332741259	/nfs/dbraw/zinc/74/12/59/332741259.db2.gz	RSIBKLQHSRBUHH-UHFFFAOYSA-N	0	0	264.369	4.064	20	30		CIEDRN
CCCCCC(=O)N[C@@H](C#N)c1c(Cl)cccc1Cl	ZINC000505513075	332742880	/nfs/dbraw/zinc/74/28/80/332742880.db2.gz	MDRRFKXOSNOHOH-LBPRGKRZSA-N	0	0	299.201	4.255	20	30		CIEDRN
N#Cc1ccc(Oc2ccc(OCCCCF)cc2)cc1	ZINC000505531487	332743300	/nfs/dbraw/zinc/74/33/00/332743300.db2.gz	CMEKGKKVRSSEOJ-UHFFFAOYSA-N	0	0	285.318	4.479	20	30		CIEDRN
C=C[C@H](C)NC(=O)C(C)(C)c1ccc(-c2ccccc2)cc1	ZINC000505598623	332745888	/nfs/dbraw/zinc/74/58/88/332745888.db2.gz	DSZBSNIBNWTVEL-HNNXBMFYSA-N	0	0	293.410	4.322	20	30		CIEDRN
C[C@H](CC(=O)N[C@@H](C#N)c1ccccc1Cl)C(C)(C)C	ZINC000505684838	332748989	/nfs/dbraw/zinc/74/89/89/332748989.db2.gz	RUKHWGPGKJOURC-RISCZKNCSA-N	0	0	292.810	4.093	20	30		CIEDRN
C=C(C)CCn1cnc2cc(-c3ccccc3)sc2c1=O	ZINC000505706911	332749721	/nfs/dbraw/zinc/74/97/21/332749721.db2.gz	QAEACZCCLSJHSJ-UHFFFAOYSA-N	0	0	296.395	4.091	20	30		CIEDRN
CCCC(CCC)C(=O)N[C@@H](C#N)c1ccc(Cl)cc1	ZINC000505795276	332752958	/nfs/dbraw/zinc/75/29/58/332752958.db2.gz	IIVZNEKPJCTSQI-HNNXBMFYSA-N	0	0	292.810	4.237	20	30		CIEDRN
N#Cc1cccc(OCc2cc(Cl)cc3cccnc32)c1	ZINC000505829440	332753933	/nfs/dbraw/zinc/75/39/33/332753933.db2.gz	AJDAORRSGAGRCI-UHFFFAOYSA-N	0	0	294.741	4.339	20	30		CIEDRN
CCCCCC(=O)N[C@@H](C#N)c1ccc(C(C)(C)C)cc1	ZINC000505833618	332754320	/nfs/dbraw/zinc/75/43/20/332754320.db2.gz	QGMLGQUFMIYGIM-INIZCTEOSA-N	0	0	286.419	4.245	20	30		CIEDRN
N#CCc1ccc(NC/C=C\c2ccc(F)c(F)c2)cc1	ZINC000512113809	332954194	/nfs/dbraw/zinc/95/41/94/332954194.db2.gz	DOTQFJSBONVGTL-UPHRSURJSA-N	0	0	284.309	4.156	20	30		CIEDRN
CCOCc1ccc(N[C@H](C)c2ccc(C#N)cc2F)cc1	ZINC000512279154	332961224	/nfs/dbraw/zinc/96/12/24/332961224.db2.gz	LIINNDCPHSGXSE-CYBMUJFWSA-N	0	0	298.361	4.407	20	30		CIEDRN
Cc1ccc(C)c(N[C@@H](C)c2ccc(C#N)cc2F)c1	ZINC000512289823	332961615	/nfs/dbraw/zinc/96/16/15/332961615.db2.gz	VLVZTHBAEMJSJO-ZDUSSCGKSA-N	0	0	268.335	4.487	20	30		CIEDRN
Cc1ccc(C)c(N[C@H](C)c2ccc(C#N)cc2F)c1	ZINC000512289822	332961633	/nfs/dbraw/zinc/96/16/33/332961633.db2.gz	VLVZTHBAEMJSJO-CYBMUJFWSA-N	0	0	268.335	4.487	20	30		CIEDRN
C=CCCC(=O)N[C@H](c1ccc(Cl)cc1)[C@H]1C[C@H]1C	ZINC000304053157	332965196	/nfs/dbraw/zinc/96/51/96/332965196.db2.gz	PEGQCTXNQOCADQ-DIOULYMOSA-N	0	0	277.795	4.120	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1cc2cc(C)c(C)cc2o1	ZINC000173424586	332971367	/nfs/dbraw/zinc/97/13/67/332971367.db2.gz	TXZJCLLASPCPJS-UHFFFAOYSA-N	0	0	271.360	4.088	20	30		CIEDRN
CC(C)[C@H]1CC[C@H](C(=O)N[C@@H](C#N)C2CCCCC2)CC1	ZINC000512618238	332976084	/nfs/dbraw/zinc/97/60/84/332976084.db2.gz	IDOQIPMJOFSUIY-XIRDDKMYSA-N	0	0	290.451	4.037	20	30		CIEDRN
COCc1cccc(N[C@@H](C)c2ccc(C#N)cc2F)c1	ZINC000512656024	332978026	/nfs/dbraw/zinc/97/80/26/332978026.db2.gz	XUECTNTWIGUPAS-LBPRGKRZSA-N	0	0	284.334	4.017	20	30		CIEDRN
C=C(CNC(=O)N1C[C@H](C)c2ccccc21)c1ccccc1	ZINC000512679172	332979894	/nfs/dbraw/zinc/97/98/94/332979894.db2.gz	WYVWEKZPBMPROR-HNNXBMFYSA-N	0	0	292.382	4.033	20	30		CIEDRN
C=C(CNC(=O)N1CCC2(CCCC2)CC1)c1ccccc1	ZINC000512678748	332979933	/nfs/dbraw/zinc/97/99/33/332979933.db2.gz	TULQWIAAUVAHFC-UHFFFAOYSA-N	0	0	298.430	4.066	20	30		CIEDRN
Cc1ccc(Cl)cc1NCc1ccc(C#N)c(F)c1	ZINC000404102957	332987317	/nfs/dbraw/zinc/98/73/17/332987317.db2.gz	FFPDGBOOMLKKLO-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
CCCc1ccccc1NCc1ccc(C#N)c(F)c1	ZINC000404146064	332990135	/nfs/dbraw/zinc/99/01/35/332990135.db2.gz	OOIPLDPCUARHHD-UHFFFAOYSA-N	0	0	268.335	4.262	20	30		CIEDRN
CCN(C(=O)C[C@H](C)c1ccccc1)c1ccc(C#N)cc1	ZINC000174077908	332990409	/nfs/dbraw/zinc/99/04/09/332990409.db2.gz	OHLNIIWCHFNTAZ-HNNXBMFYSA-N	0	0	292.382	4.105	20	30		CIEDRN
C=CC1CCN(C(=O)c2ccc(C3CCCC3)cc2)CC1	ZINC000575792465	335115264	/nfs/dbraw/zinc/11/52/64/335115264.db2.gz	WFOIWTDLEAQWDS-UHFFFAOYSA-N	0	0	283.415	4.382	20	30		CIEDRN
CC(C)(C)CNC(=O)c1ccccc1-c1ccccc1C#N	ZINC000513110055	333004779	/nfs/dbraw/zinc/00/47/79/333004779.db2.gz	JMQKUQUZWAEVNO-UHFFFAOYSA-N	0	0	292.382	4.001	20	30		CIEDRN
CCOc1ccc(CNc2cccc(Cl)c2C#N)cc1	ZINC000513193721	333007719	/nfs/dbraw/zinc/00/77/19/333007719.db2.gz	HDCLMCSMEABBGU-UHFFFAOYSA-N	0	0	286.762	4.222	20	30		CIEDRN
C[C@H]1C[C@H](c2ccccc2)[N@H+](Cc2ccc(C#N)cc2F)C1	ZINC000513265188	333011539	/nfs/dbraw/zinc/01/15/39/333011539.db2.gz	CVZJAWHTJMNVEH-IFXJQAMLSA-N	0	0	294.373	4.280	20	30		CIEDRN
CC(C)C[C@@H]1CCN(c2ccc(C#N)c(Cl)c2)C1	ZINC000307772443	333016354	/nfs/dbraw/zinc/01/63/54/333016354.db2.gz	IGPPXCYDHNQSKV-LBPRGKRZSA-N	0	0	262.784	4.084	20	30		CIEDRN
CC(=O)[C@H](C)SCc1ccc(-c2ccccc2C#N)cc1	ZINC000175190980	333016834	/nfs/dbraw/zinc/01/68/34/333016834.db2.gz	GPKWBQMIVPWSET-AWEZNQCLSA-N	0	0	295.407	4.436	20	30		CIEDRN
C=CCCCC(=O)N(Cc1ccc(Cl)cc1)C1CC1	ZINC000175238652	333018076	/nfs/dbraw/zinc/01/80/76/333018076.db2.gz	FCXASWZVUABPQD-UHFFFAOYSA-N	0	0	277.795	4.187	20	30		CIEDRN
CCCCCN(C(=O)c1cccc(C#N)c1)[C@@H](C)CCC	ZINC000513447950	333019946	/nfs/dbraw/zinc/01/99/46/333019946.db2.gz	JANSDTHYWBKNJK-HNNXBMFYSA-N	0	0	286.419	4.379	20	30		CIEDRN
C=C1CCN(Cc2ccc(OC(F)F)c(Cl)c2)CC1	ZINC000513467218	333021358	/nfs/dbraw/zinc/02/13/58/333021358.db2.gz	SCLVCLDITFENBU-UHFFFAOYSA-N	0	0	287.737	4.093	20	30		CIEDRN
C=CCCCC(=O)Nc1ccccc1OCCCC	ZINC000175391690	333023735	/nfs/dbraw/zinc/02/37/35/333023735.db2.gz	ICHCAABXQONFRG-UHFFFAOYSA-N	0	0	261.365	4.160	20	30		CIEDRN
CCC[C@H](CC(C)C)C(=O)Nc1ccc(CC#N)cc1	ZINC000308085104	333024349	/nfs/dbraw/zinc/02/43/49/333024349.db2.gz	FPDGVDSWXPHSFX-OAHLLOKOSA-N	0	0	272.392	4.154	20	30		CIEDRN
C=CCOc1cccc(CNc2ccc(F)cc2OC)c1	ZINC000513570912	333025405	/nfs/dbraw/zinc/02/54/05/333025405.db2.gz	DZPKVJHWBDDDMK-UHFFFAOYSA-N	0	0	287.334	4.011	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](C)c1ccc(SCC)cc1	ZINC000175568499	333026913	/nfs/dbraw/zinc/02/69/13/333026913.db2.gz	ASHNUGOGWVSDKB-ZDUSSCGKSA-N	0	0	277.433	4.332	20	30		CIEDRN
N#Cc1cnc(Oc2cccc(Cl)c2)c(Cl)c1	ZINC000513619469	333027020	/nfs/dbraw/zinc/02/70/20/333027020.db2.gz	MWIKIDQDTHMAED-UHFFFAOYSA-N	0	0	265.099	4.052	20	30		CIEDRN
CC(C)CCC[C@H](C)Nc1ncc(C#N)cc1Cl	ZINC000513623578	333027218	/nfs/dbraw/zinc/02/72/18/333027218.db2.gz	FWZUIIIEMNYAJF-NSHDSACASA-N	0	0	265.788	4.233	20	30		CIEDRN
Cc1ccc(Sc2ncc(C#N)cc2Cl)c(C)c1	ZINC000513624262	333027386	/nfs/dbraw/zinc/02/73/86/333027386.db2.gz	JTNNZYIPYHXTQG-UHFFFAOYSA-N	0	0	274.776	4.375	20	30		CIEDRN
CO[C@@H](C)c1cccc(Nc2ncc(C#N)cc2Cl)c1	ZINC000513640615	333028415	/nfs/dbraw/zinc/02/84/15/333028415.db2.gz	QAYKAGXDHKJLAW-JTQLQIEISA-N	0	0	287.750	4.058	20	30		CIEDRN
Cc1cc(Oc2ncc(C#N)cc2Cl)ccc1Cl	ZINC000513644620	333028634	/nfs/dbraw/zinc/02/86/34/333028634.db2.gz	DDXPWIFVMBNVMP-UHFFFAOYSA-N	0	0	279.126	4.361	20	30		CIEDRN
CC(C)Oc1ccc(Nc2ncc(C#N)cc2Cl)cc1	ZINC000513650915	333029164	/nfs/dbraw/zinc/02/91/64/333029164.db2.gz	SZYAABFSUZJVJI-UHFFFAOYSA-N	0	0	287.750	4.137	20	30		CIEDRN
C=CCCCC(=O)N(C)[C@@H](C)Cc1ccc(Cl)cc1	ZINC000175723663	333030806	/nfs/dbraw/zinc/03/08/06/333030806.db2.gz	HQTRXLBASIPZCA-ZDUSSCGKSA-N	0	0	279.811	4.086	20	30		CIEDRN
C=CCCCC(=O)N1Cc2cc(C)ccc2CC1(C)C	ZINC000513674984	333031430	/nfs/dbraw/zinc/03/14/30/333031430.db2.gz	MVBXXNLRRIRJQL-UHFFFAOYSA-N	0	0	271.404	4.015	20	30		CIEDRN
CCCCc1ccc(NC(=O)N(C[C@H](C)C#N)C2CC2)cc1	ZINC000513677514	333031706	/nfs/dbraw/zinc/03/17/06/333031706.db2.gz	XTVXAMAQPYZPDY-CQSZACIVSA-N	0	0	299.418	4.185	20	30		CIEDRN
C=CCCCN(C)C(=O)N[C@H](C)c1c(F)cccc1Cl	ZINC000176162412	333039588	/nfs/dbraw/zinc/03/95/88/333039588.db2.gz	BPWMTTLQJZSNSK-LLVKDONJSA-N	0	0	298.789	4.148	20	30		CIEDRN
C[C@H](Cc1ccccc1Cl)C(=O)Nc1ccc(C#N)cc1	ZINC000513806926	333040156	/nfs/dbraw/zinc/04/01/56/333040156.db2.gz	RQABEWSBIWBZFC-GFCCVEGCSA-N	0	0	298.773	4.029	20	30		CIEDRN
C=CC1CCN(C(=O)c2ccc(Oc3ccccc3)o2)CC1	ZINC000176355704	333041051	/nfs/dbraw/zinc/04/10/51/333041051.db2.gz	ZWFUEHOPYUMPAB-UHFFFAOYSA-N	0	0	297.354	4.110	20	30		CIEDRN
CCn1c2ccc(Cl)cc2nc1-c1ccc(C#N)cc1	ZINC000513871449	333045231	/nfs/dbraw/zinc/04/52/31/333045231.db2.gz	QXPVQWAOGFMXMX-UHFFFAOYSA-N	0	0	281.746	4.248	20	30		CIEDRN
N#CCCN(Cc1ccco1)Cc1ccc2ccccc2c1	ZINC000176838822	333048690	/nfs/dbraw/zinc/04/86/90/333048690.db2.gz	PNZAOJNOADGPAJ-UHFFFAOYSA-N	0	0	290.366	4.349	20	30		CIEDRN
Cc1ncsc1CCSc1ccc(C#N)cc1Cl	ZINC000176897960	333050072	/nfs/dbraw/zinc/05/00/72/333050072.db2.gz	KRSMLLRBGAVTAD-UHFFFAOYSA-N	0	0	294.832	4.311	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H](c1ccc(OC)cc1)C1CC1	ZINC000176930697	333050665	/nfs/dbraw/zinc/05/06/65/333050665.db2.gz	QOIHDBKYJVDRRK-SFHVURJKSA-N	0	0	299.414	4.031	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc(C)c(OC)c1C	ZINC000176943236	333051082	/nfs/dbraw/zinc/05/10/82/333051082.db2.gz	ZZDBFJKYRGYURF-UHFFFAOYSA-N	0	0	273.376	4.019	20	30		CIEDRN
Cc1ccccc1Oc1nc(C)c(C#N)cc1Cl	ZINC000310757310	333061098	/nfs/dbraw/zinc/06/10/98/333061098.db2.gz	LRZYRYYTQPXCSQ-UHFFFAOYSA-N	0	0	258.708	4.016	20	30		CIEDRN
Cc1nc(Oc2ccc(Cl)cc2)c(Cl)cc1C#N	ZINC000310778838	333061326	/nfs/dbraw/zinc/06/13/26/333061326.db2.gz	RCMHIOYLGHHCKT-UHFFFAOYSA-N	0	0	279.126	4.361	20	30		CIEDRN
C=CCCCC(=O)N(C1CC1)[C@H]1CCc2ccccc21	ZINC000177775547	333062843	/nfs/dbraw/zinc/06/28/43/333062843.db2.gz	PQDHBWSTQYJOAC-KRWDZBQOSA-N	0	0	269.388	4.021	20	30		CIEDRN
C=CCCCC(=O)N(C)[C@H](c1ccccc1)C(C)C	ZINC000177847474	333063936	/nfs/dbraw/zinc/06/39/36/333063936.db2.gz	ZCUDGAVXQRPKFO-KRWDZBQOSA-N	0	0	259.393	4.198	20	30		CIEDRN
C=C(C)CSCCC(=O)Nc1ccc(Cl)cc1F	ZINC000177872949	333064765	/nfs/dbraw/zinc/06/47/65/333064765.db2.gz	UOIDKCKDOIAMTO-UHFFFAOYSA-N	0	0	287.787	4.117	20	30		CIEDRN
C=CCCCC(=O)N1CCCC[C@@H]1c1ccc(C)cc1	ZINC000177888567	333064882	/nfs/dbraw/zinc/06/48/82/333064882.db2.gz	RYDLIXZMRSZAIP-QGZVFWFLSA-N	0	0	271.404	4.405	20	30		CIEDRN
Cc1nc(N[C@H](C)c2ccccc2)c(Cl)cc1C#N	ZINC000311441901	333068464	/nfs/dbraw/zinc/06/84/64/333068464.db2.gz	GSTGCNCBLFJKBC-SNVBAGLBSA-N	0	0	271.751	4.088	20	30		CIEDRN
N#Cc1ccc(NCCCCCF)cc1C(F)(F)F	ZINC000311562508	333069944	/nfs/dbraw/zinc/06/99/44/333069944.db2.gz	NOYXRSYNQZYJBO-UHFFFAOYSA-N	0	0	274.261	4.129	20	30		CIEDRN
Cc1nc(NCc2ccc(Cl)cc2)c(Cl)cc1C#N	ZINC000311625967	333070469	/nfs/dbraw/zinc/07/04/69/333070469.db2.gz	XZXXOVAXSDTYBH-UHFFFAOYSA-N	0	0	292.169	4.181	20	30		CIEDRN
Cc1nc(Oc2ccc(F)c(Cl)c2)c(Cl)cc1C#N	ZINC000311621860	333070495	/nfs/dbraw/zinc/07/04/95/333070495.db2.gz	XIIADHYVMNGTNG-UHFFFAOYSA-N	0	0	297.116	4.500	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@@H]1c1cc(C)ccc1C	ZINC000178295559	333070690	/nfs/dbraw/zinc/07/06/90/333070690.db2.gz	IWGKFJPVFSZQEL-QGZVFWFLSA-N	0	0	271.404	4.323	20	30		CIEDRN
N#Cc1ccc(COc2ccc(Cl)cc2F)c(F)c1	ZINC000311653227	333070968	/nfs/dbraw/zinc/07/09/68/333070968.db2.gz	UKBJAQXTSPMTOC-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
C=CCC[C@@H](NC(=O)N(C)C1CCCC1)c1ccccc1	ZINC000178452096	333073113	/nfs/dbraw/zinc/07/31/13/333073113.db2.gz	MKCYGHLOLNHUQK-QGZVFWFLSA-N	0	0	286.419	4.278	20	30		CIEDRN
CCOc1cc(C#N)ccc1OCc1sccc1Cl	ZINC000312029497	333075837	/nfs/dbraw/zinc/07/58/37/333075837.db2.gz	XPYLGUVVUKSHKL-UHFFFAOYSA-N	0	0	293.775	4.251	20	30		CIEDRN
CC(C)C[C@@H](C)CNc1cccc(OCCCC#N)c1	ZINC000312155433	333077613	/nfs/dbraw/zinc/07/76/13/333077613.db2.gz	OERJMNAZEIXNAI-OAHLLOKOSA-N	0	0	274.408	4.463	20	30		CIEDRN
CCCc1ccc(C(=O)Nc2sc(CC)cc2C#N)cc1	ZINC000516781236	333082408	/nfs/dbraw/zinc/08/24/08/333082408.db2.gz	GOYSUILERTXEGR-UHFFFAOYSA-N	0	0	298.411	4.387	20	30		CIEDRN
N#Cc1ncccc1N[C@H](c1ccc(Cl)cc1)C1CC1	ZINC000516823796	333083426	/nfs/dbraw/zinc/08/34/26/333083426.db2.gz	CYRXSTVDAXCDND-INIZCTEOSA-N	0	0	283.762	4.170	20	30		CIEDRN
CCOc1ccc(C#N)cc1N[C@@H](C)c1cccc(F)c1	ZINC000516838166	333083820	/nfs/dbraw/zinc/08/38/20/333083820.db2.gz	GNBIQTVFEWERLP-LBPRGKRZSA-N	0	0	284.334	4.269	20	30		CIEDRN
CCCCN(C(=O)CC(C)(C)C#N)[C@H]1CCC[C@H](C)C1	ZINC000516886948	333085347	/nfs/dbraw/zinc/08/53/47/333085347.db2.gz	HYZMZMXICVKGKB-GJZGRUSLSA-N	0	0	278.440	4.134	20	30		CIEDRN
C[C@H](C#N)CNc1ccc2c(Cl)c3c(nc2c1)CCCC3	ZINC000516900099	333085871	/nfs/dbraw/zinc/08/58/71/333085871.db2.gz	XHAKMXMCYRZQSK-LLVKDONJSA-N	0	0	299.805	4.339	20	30		CIEDRN
CC(C)c1cccc(CNc2ccc(C#N)c([N+](=O)[O-])c2)c1	ZINC000516943356	333087220	/nfs/dbraw/zinc/08/72/20/333087220.db2.gz	WMBCCPYONFYBOX-UHFFFAOYSA-N	0	0	295.342	4.202	20	30		CIEDRN
N#Cc1ccsc1C(=O)Nc1cccc(C2CCC2)c1	ZINC000517004002	333089455	/nfs/dbraw/zinc/08/94/55/333089455.db2.gz	WFXOMKFMKQOZIC-UHFFFAOYSA-N	0	0	282.368	4.140	20	30		CIEDRN
CCCC[C@@H](C)N(C)C(=O)Nc1ccc(C#N)cc1Cl	ZINC000517060368	333091396	/nfs/dbraw/zinc/09/13/96/333091396.db2.gz	IQYCPNMJBIZZHS-LLVKDONJSA-N	0	0	293.798	4.254	20	30		CIEDRN
Cc1ccc(Cl)cc1OCc1ccccc1C#N	ZINC000088729879	333091632	/nfs/dbraw/zinc/09/16/32/333091632.db2.gz	QLOSMPQZVFLFLZ-UHFFFAOYSA-N	0	0	257.720	4.099	20	30		CIEDRN
C=CCN(C(=O)c1cccc2cccnc21)c1ccccc1	ZINC000517203053	333094663	/nfs/dbraw/zinc/09/46/63/333094663.db2.gz	JLUAPJDISBUMJU-UHFFFAOYSA-N	0	0	288.350	4.068	20	30		CIEDRN
CCC(CC)(CNc1cccc(C(F)F)c1C#N)OC	ZINC000517247919	333095923	/nfs/dbraw/zinc/09/59/23/333095923.db2.gz	ZDKPBFCASKLBBO-UHFFFAOYSA-N	0	0	282.334	4.113	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(Cc2cc3ccccc3o2)no1	ZINC000517250911	333095932	/nfs/dbraw/zinc/09/59/32/333095932.db2.gz	WTLKWKSKKIMOTQ-GFCCVEGCSA-N	0	0	282.343	4.476	20	30		CIEDRN
CC#CCN(C)C(=O)c1ccc(-c2cccc(C(C)C)c2)o1	ZINC000517257519	333096234	/nfs/dbraw/zinc/09/62/34/333096234.db2.gz	RXPFTRDPJDSNMM-UHFFFAOYSA-N	0	0	295.382	4.165	20	30		CIEDRN
CC[C@@](C)(C#N)NC(=O)CC1CCC(c2ccccc2)CC1	ZINC000517461800	333100208	/nfs/dbraw/zinc/10/02/08/333100208.db2.gz	PDEVCYRHHSCPEN-KVWWFHCMSA-N	0	0	298.430	4.159	20	30		CIEDRN
C=C(C)CN(CC)C(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1	ZINC000517482973	333100421	/nfs/dbraw/zinc/10/04/21/333100421.db2.gz	SEFWTEZROVLEFZ-RBUKOAKNSA-N	0	0	293.410	4.368	20	30		CIEDRN
Cc1csc(NC(=O)[C@H](C)CC2CCCCC2)c1C#N	ZINC000517620356	333104080	/nfs/dbraw/zinc/10/40/80/333104080.db2.gz	LUWYDXMGRRWCCR-LLVKDONJSA-N	0	0	290.432	4.473	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(Cc2ccc(F)c(F)c2)no1	ZINC000517624189	333104273	/nfs/dbraw/zinc/10/42/73/333104273.db2.gz	RORNLYNTMGCZAI-JTQLQIEISA-N	0	0	278.302	4.008	20	30		CIEDRN
C=CCCc1nc(-c2cccc3ccccc32)no1	ZINC000517630126	333104663	/nfs/dbraw/zinc/10/46/63/333104663.db2.gz	GVSFTUBNDTWTPD-UHFFFAOYSA-N	0	0	250.301	4.008	20	30		CIEDRN
C=CCOc1ccccc1CNC(=O)[C@H](CC)CCCC	ZINC000517677365	333105762	/nfs/dbraw/zinc/10/57/62/333105762.db2.gz	FKSIFHCYRALPJP-OAHLLOKOSA-N	0	0	289.419	4.084	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000184910617	333133240	/nfs/dbraw/zinc/13/32/40/333133240.db2.gz	FNKCKDGKJKOCGM-LBPRGKRZSA-N	0	0	297.320	4.076	20	30		CIEDRN
Cc1cc2c(ccc(OCc3ccc(C#N)cc3)c2F)[nH]1	ZINC000184964066	333133795	/nfs/dbraw/zinc/13/37/95/333133795.db2.gz	GSSUAJKVBPYSRE-UHFFFAOYSA-N	0	0	280.302	4.066	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)Cc1ccccc1C(F)(F)F	ZINC000184993761	333134076	/nfs/dbraw/zinc/13/40/76/333134076.db2.gz	DLKFEGUCNVVRNU-GFCCVEGCSA-N	0	0	299.336	4.266	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCc1ccc2cc(OC)ccc2c1	ZINC000184986047	333134089	/nfs/dbraw/zinc/13/40/89/333134089.db2.gz	COELUDWYIIUJDP-CQSZACIVSA-N	0	0	297.398	4.067	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](c1ccc(OC)cc1)C(C)C	ZINC000184986573	333134171	/nfs/dbraw/zinc/13/41/71/333134171.db2.gz	JTWSUVFPEVKBKI-WMLDXEAASA-N	0	0	289.419	4.111	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H](CC)c1ccc(Cl)cc1	ZINC000185026217	333134509	/nfs/dbraw/zinc/13/45/09/333134509.db2.gz	BJANLEYNHMIIKH-HNNXBMFYSA-N	0	0	277.795	4.101	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](C)c1cc(C)sc1C	ZINC000185094536	333135575	/nfs/dbraw/zinc/13/55/75/333135575.db2.gz	RPKXNTTWRPHRFD-CMPLNLGQSA-N	0	0	265.422	4.144	20	30		CIEDRN
CCN(C(=O)[C@@H](C)CC(C)C)[C@@H](C)c1ccc(C#N)cc1	ZINC000185170213	333136245	/nfs/dbraw/zinc/13/62/45/333136245.db2.gz	XEPRNRVAVLQRJH-GJZGRUSLSA-N	0	0	286.419	4.150	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCc1cccc2ccccc21	ZINC000185218658	333136817	/nfs/dbraw/zinc/13/68/17/333136817.db2.gz	CJVCMRPITOZHMT-AWEZNQCLSA-N	0	0	267.372	4.058	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(OCCC)cc1C	ZINC000185243730	333137531	/nfs/dbraw/zinc/13/75/31/333137531.db2.gz	MYGSSRXPNINOFZ-AWEZNQCLSA-N	0	0	275.392	4.325	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CCc2c1cccc2Cl	ZINC000185261207	333137649	/nfs/dbraw/zinc/13/76/49/333137649.db2.gz	CEIBTAOAKLWYMH-XHDPSFHLSA-N	0	0	277.795	4.046	20	30		CIEDRN
CC#CCCCC(=O)N1CCC[C@H]1[C@H](CC)c1ccccc1	ZINC000185335451	333138899	/nfs/dbraw/zinc/13/88/99/333138899.db2.gz	STLHFCVOVHDBJF-MOPGFXCFSA-N	0	0	297.442	4.365	20	30		CIEDRN
COc1ccc(C#N)cc1CNc1c(C)cccc1SC	ZINC000185430939	333140640	/nfs/dbraw/zinc/14/06/40/333140640.db2.gz	CCDOQXIYVDYSOV-UHFFFAOYSA-N	0	0	298.411	4.209	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(CSC)cc1	ZINC000185441040	333140755	/nfs/dbraw/zinc/14/07/55/333140755.db2.gz	JNPDEOKESJHEHJ-GFCCVEGCSA-N	0	0	263.406	4.090	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@H](c2ccccc2)CC1	ZINC000185439855	333140880	/nfs/dbraw/zinc/14/08/80/333140880.db2.gz	MKTJIVXYCZZANH-AEFFLSMTSA-N	0	0	285.431	4.385	20	30		CIEDRN
CC#CCCCC(=O)N[C@H](C)c1ccc(SCC)cc1	ZINC000185470079	333141330	/nfs/dbraw/zinc/14/13/30/333141330.db2.gz	OGNHVIXJDZMHCR-CQSZACIVSA-N	0	0	289.444	4.169	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](C)c1nc(C(C)(C)C)cs1	ZINC000185492802	333141878	/nfs/dbraw/zinc/14/18/78/333141878.db2.gz	PGOUSZIHONQDSR-NWDGAFQWSA-N	0	0	294.464	4.220	20	30		CIEDRN
N#CCN(CC1CCC(C(F)(F)F)CC1)C1CCCC1	ZINC000185515709	333142492	/nfs/dbraw/zinc/14/24/92/333142492.db2.gz	IRNYRHDCQASCOV-UHFFFAOYSA-N	0	0	288.357	4.123	20	30		CIEDRN
CCN(C(=O)[C@@H](C)CC(C)C)c1ccc(C#N)c(Cl)c1	ZINC000185537929	333143065	/nfs/dbraw/zinc/14/30/65/333143065.db2.gz	BOKYCZBYEOFDJR-LBPRGKRZSA-N	0	0	292.810	4.247	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(c1ccc(F)cc1)C(C)C	ZINC000185581230	333144193	/nfs/dbraw/zinc/14/41/93/333144193.db2.gz	HWZQAWJYSROCHY-ZDUSSCGKSA-N	0	0	263.356	4.169	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cccc2ccc(C)nc21	ZINC000185644343	333145581	/nfs/dbraw/zinc/14/55/81/333145581.db2.gz	FKVRYJJWSSRJLW-LBPRGKRZSA-N	0	0	268.360	4.084	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cc(F)ccc1OC(C)C	ZINC000185643135	333145594	/nfs/dbraw/zinc/14/55/94/333145594.db2.gz	OXNYTSKJAYBFFS-GFCCVEGCSA-N	0	0	279.355	4.154	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](CC)c1cc(F)ccc1F	ZINC000185648348	333146023	/nfs/dbraw/zinc/14/60/23/333146023.db2.gz	GRMDJZYKOFPCGA-XHDPSFHLSA-N	0	0	281.346	4.134	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N([C@H](C)[C@@H](C)CC)C1CC1	ZINC000185700209	333146756	/nfs/dbraw/zinc/14/67/56/333146756.db2.gz	OMJDXSMBCUAPHM-MELADBBJSA-N	0	0	251.414	4.014	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](C)C[C@@H]1c1ccc(C)o1	ZINC000185728851	333147424	/nfs/dbraw/zinc/14/74/24/333147424.db2.gz	JJQNEBXPCRCHNC-IJEWVQPXSA-N	0	0	289.419	4.490	20	30		CIEDRN
CCN(C(=O)[C@@H]1C[C@@]1(C)C(C)C)[C@@H](C)c1ccc(C#N)cc1	ZINC000185741311	333147863	/nfs/dbraw/zinc/14/78/63/333147863.db2.gz	BSDFMBLUHUIIBY-FNHZYXHNSA-N	0	0	298.430	4.150	20	30		CIEDRN
CC#CCCCC(=O)N1CC[C@@H](c2ccccc2)[C@@H](CC)C1	ZINC000185745321	333147918	/nfs/dbraw/zinc/14/79/18/333147918.db2.gz	VMQVYPJWOQNEDK-PKOBYXMFSA-N	0	0	297.442	4.222	20	30		CIEDRN
C=C(C)[C@H](NC(=O)N(C)[C@H](C)CC)c1ccc(F)c(F)c1	ZINC000185839914	333150133	/nfs/dbraw/zinc/15/01/33/333150133.db2.gz	DLDIPQZAQKWUEZ-ABAIWWIYSA-N	0	0	296.361	4.022	20	30		CIEDRN
Cc1cc2cccnc2c(N[C@H]2CCC[C@H](C#N)C2)c1	ZINC000185871596	333150727	/nfs/dbraw/zinc/15/07/27/333150727.db2.gz	GRZLYKQGYWQBLX-ZFWWWQNUSA-N	0	0	265.360	4.038	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H]1[C@@H](C)CCC	ZINC000185889472	333151164	/nfs/dbraw/zinc/15/11/64/333151164.db2.gz	MCSYNDIOJFHOHZ-SOUVJXGZSA-N	0	0	251.414	4.016	20	30		CIEDRN
Cc1ccc(N[C@@H]2CCC[C@@H](C#N)C2)c2cccnc12	ZINC000185888690	333151254	/nfs/dbraw/zinc/15/12/54/333151254.db2.gz	CABQWFKNQWQTRF-ZIAGYGMSSA-N	0	0	265.360	4.038	20	30		CIEDRN
CC(C)[N@H+](Cc1ccccc1)Cc1cccc(C#N)c1F	ZINC000219515081	333151441	/nfs/dbraw/zinc/15/14/41/333151441.db2.gz	KQSLBHSREYFOIB-UHFFFAOYSA-N	0	0	282.362	4.108	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H](C)[C@@H]1CCC	ZINC000185925618	333151845	/nfs/dbraw/zinc/15/18/45/333151845.db2.gz	RSBAPTVUNUMDDU-KKUMJFAQSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(F)cc1OCCC	ZINC000186031506	333153647	/nfs/dbraw/zinc/15/36/47/333153647.db2.gz	WACQCUGIOQKQGZ-GFCCVEGCSA-N	0	0	279.355	4.155	20	30		CIEDRN
CC#CCCCC(=O)N1CCc2ccc(C(C)(C)C)cc2C1	ZINC000186030094	333153819	/nfs/dbraw/zinc/15/38/19/333153819.db2.gz	ITFSZYGSFDJZKE-UHFFFAOYSA-N	0	0	297.442	4.062	20	30		CIEDRN
C=C(C)[C@@H](NC(=O)[C@H]1CC=CCC1)c1ccc(F)c(F)c1	ZINC000186044484	333154064	/nfs/dbraw/zinc/15/40/64/333154064.db2.gz	UYVROSTXQQDTTC-BLLLJJGKSA-N	0	0	291.341	4.055	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@H]1C(C)(C)CC	ZINC000186083535	333154780	/nfs/dbraw/zinc/15/47/80/333154780.db2.gz	LKTYUVNRCKSNNT-KGLIPLIRSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cc(C)ccc1Br	ZINC000186103508	333154947	/nfs/dbraw/zinc/15/49/47/333154947.db2.gz	PUMRJYCVPNGAKM-LLVKDONJSA-N	0	0	296.208	4.298	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1ccc(F)cc1C)c1ccccc1	ZINC000186109609	333155001	/nfs/dbraw/zinc/15/50/01/333155001.db2.gz	RDWMXBJWPKEAOH-INIZCTEOSA-N	0	0	283.346	4.433	20	30		CIEDRN
N#Cc1cccc(CSc2ccc(F)cc2)c1F	ZINC000219759599	333156513	/nfs/dbraw/zinc/15/65/13/333156513.db2.gz	MFUMFRFDDCGCDS-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)C[C@@H]1C=CCCC1	ZINC000186238670	333157100	/nfs/dbraw/zinc/15/71/00/333157100.db2.gz	KTBFFDSNIXXUNU-CQSZACIVSA-N	0	0	275.417	4.009	20	30		CIEDRN
C=CCC[C@@H](C(=O)Nc1ncccc1C)c1ccccc1	ZINC000186220607	333156876	/nfs/dbraw/zinc/15/68/76/333156876.db2.gz	QGZQFEKZDMAWHB-MRXNPFEDSA-N	0	0	280.371	4.079	20	30		CIEDRN
C=CCC[C@H](C(=O)Nc1cccc(C)n1)c1ccccc1	ZINC000186221469	333156968	/nfs/dbraw/zinc/15/69/68/333156968.db2.gz	FZWUPNSQBSHVLL-INIZCTEOSA-N	0	0	280.371	4.079	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1ccc2oc(C)c(C)c2c1	ZINC000186473655	333161536	/nfs/dbraw/zinc/16/15/36/333161536.db2.gz	NFISNSMJVVFKNN-UHFFFAOYSA-N	0	0	286.375	4.480	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@H](C)Cc1cccs1)c1ccccc1	ZINC000186629014	333163717	/nfs/dbraw/zinc/16/37/17/333163717.db2.gz	HFZVUQKTINJNEI-RHSMWYFYSA-N	0	0	299.439	4.155	20	30		CIEDRN
CCN(C(=O)C[C@@H]1CCC[C@@H]1C)[C@H](C)c1ccc(C#N)cc1	ZINC000186626969	333163802	/nfs/dbraw/zinc/16/38/02/333163802.db2.gz	VNZSHZFGCFDHSM-DAYGRLMNSA-N	0	0	298.430	4.294	20	30		CIEDRN
N#CCSCCCSCCCCc1ccccc1	ZINC000186725398	333164696	/nfs/dbraw/zinc/16/46/96/333164696.db2.gz	VUEOFPFZYBVXNE-UHFFFAOYSA-N	0	0	279.474	4.389	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1cccc2[nH]ccc21)c1ccccc1	ZINC000187407402	333170480	/nfs/dbraw/zinc/17/04/80/333170480.db2.gz	VREAWOALKYEEEY-OAHLLOKOSA-N	0	0	290.366	4.466	20	30		CIEDRN
Cc1ccc(C(=O)COc2ccc(C#N)c(Cl)c2)cc1C	ZINC000220986891	333171754	/nfs/dbraw/zinc/17/17/54/333171754.db2.gz	UUPRNFSCEJKEIV-UHFFFAOYSA-N	0	0	299.757	4.090	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(Cl)cc1F	ZINC000189779168	333199176	/nfs/dbraw/zinc/19/91/76/333199176.db2.gz	TWSSRGJZWSPCAD-CYBMUJFWSA-N	0	0	255.720	4.020	20	30		CIEDRN
C=CCCC(=O)N[C@@H](c1ccc(Cl)cc1)C1CCC1	ZINC000521511488	333174997	/nfs/dbraw/zinc/17/49/97/333174997.db2.gz	NFHCCFPWXINBHZ-MRXNPFEDSA-N	0	0	277.795	4.264	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC)Cc1c[nH]c2ccccc12	ZINC000188901222	333175574	/nfs/dbraw/zinc/17/55/74/333175574.db2.gz	CNIIKJRQOXHIKT-UHFFFAOYSA-N	0	0	296.414	4.285	20	30		CIEDRN
C=CCC[C@@H](C(=O)Nc1ccnc(C)c1)c1ccccc1	ZINC000188907292	333175853	/nfs/dbraw/zinc/17/58/53/333175853.db2.gz	XUUNFHQVOKTTLU-QGZVFWFLSA-N	0	0	280.371	4.079	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1ncccc1Cl)c1ccccc1	ZINC000188915878	333176081	/nfs/dbraw/zinc/17/60/81/333176081.db2.gz	RKKRMLBXTZVVNL-ZDUSSCGKSA-N	0	0	286.762	4.033	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1ncccc1Cl)c1ccccc1	ZINC000188915901	333176217	/nfs/dbraw/zinc/17/62/17/333176217.db2.gz	RKKRMLBXTZVVNL-CYBMUJFWSA-N	0	0	286.762	4.033	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1cc(C)c(OC)cc1Cl	ZINC000564174107	333182294	/nfs/dbraw/zinc/18/22/94/333182294.db2.gz	HXTBIMGKJLCQHK-UHFFFAOYSA-N	0	0	296.798	4.087	20	30		CIEDRN
C=C1CCN(Cc2cc(-c3ccc(Cl)cc3)no2)CC1	ZINC000521742313	333186404	/nfs/dbraw/zinc/18/64/04/333186404.db2.gz	ROBPLVJPOKGOMP-UHFFFAOYSA-N	0	0	288.778	4.147	20	30		CIEDRN
CCCN(c1ccc(C#N)cn1)[C@H](CC)c1ccccc1	ZINC000521763973	333187177	/nfs/dbraw/zinc/18/71/77/333187177.db2.gz	PMNHXUMLQPVYMY-QGZVFWFLSA-N	0	0	279.387	4.321	20	30		CIEDRN
C=CCC1(C(=O)N2CCC[C@H](CC(C)C)C2)CCC1	ZINC000189330830	333190587	/nfs/dbraw/zinc/19/05/87/333190587.db2.gz	PCKKVIHEUXBWNC-OAHLLOKOSA-N	0	0	263.425	4.018	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1ccc(C(C)=O)cc1)c1ccccc1	ZINC000189360596	333191002	/nfs/dbraw/zinc/19/10/02/333191002.db2.gz	GQSSCLLUFQUFHD-GOSISDBHSA-N	0	0	293.366	4.188	20	30		CIEDRN
C=CC[C@H](C(=O)N(C)C1CCCCC1)c1ccccc1	ZINC000189365813	333191168	/nfs/dbraw/zinc/19/11/68/333191168.db2.gz	QLFRLWWXEKUVEA-KRWDZBQOSA-N	0	0	271.404	4.137	20	30		CIEDRN
COC(=O)c1ccc(S[C@@H](C)c2ccc(C#N)cc2)cc1	ZINC000522822867	333191285	/nfs/dbraw/zinc/19/12/85/333191285.db2.gz	YVMDIBWGCLVYGA-LBPRGKRZSA-N	0	0	297.379	4.198	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1ccc(F)cc1F)c1ccccc1	ZINC000189443163	333193009	/nfs/dbraw/zinc/19/30/09/333193009.db2.gz	FVLNKIPZLXLMSY-CQSZACIVSA-N	0	0	287.309	4.263	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N(CC)Cc1c[nH]c2ccccc12	ZINC000189556511	333194983	/nfs/dbraw/zinc/19/49/83/333194983.db2.gz	RLCVGRKYOZTEED-SFHVURJKSA-N	0	0	284.403	4.119	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N(CC)Cc1c[nH]c2ccccc12	ZINC000189556497	333195100	/nfs/dbraw/zinc/19/51/00/333195100.db2.gz	RLCVGRKYOZTEED-GOSISDBHSA-N	0	0	284.403	4.119	20	30		CIEDRN
C=CCC1(C(=O)N2CCC(C)(c3ccccc3)CC2)CCC1	ZINC000189730308	333198486	/nfs/dbraw/zinc/19/84/86/333198486.db2.gz	XIZKVJZYVCPOLJ-UHFFFAOYSA-N	0	0	297.442	4.313	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@H](C)c1cccc(Cl)c1	ZINC000189859949	333199881	/nfs/dbraw/zinc/19/98/81/333199881.db2.gz	DCNSHFWAYAJSPQ-ABAIWWIYSA-N	0	0	265.784	4.120	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)c1cccc2ccccc21	ZINC000189919515	333200584	/nfs/dbraw/zinc/20/05/84/333200584.db2.gz	GRRGHBHSXKCMIV-UHFFFAOYSA-N	0	0	294.398	4.384	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@H]1CCSc2c(F)cccc21	ZINC000189962225	333201152	/nfs/dbraw/zinc/20/11/52/333201152.db2.gz	KJDJWLFWONZADF-BBRMVZONSA-N	0	0	293.407	4.081	20	30		CIEDRN
CCCc1cccc(C(C)C)c1NC(=O)N[C@H](C)CC#N	ZINC000189957750	333201183	/nfs/dbraw/zinc/20/11/83/333201183.db2.gz	WTRVAYSNOLVGCY-CYBMUJFWSA-N	0	0	287.407	4.186	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(C)cc2Cl)CCC1	ZINC000190324549	333205380	/nfs/dbraw/zinc/20/53/80/333205380.db2.gz	LSFGNBFSOBBTKL-UHFFFAOYSA-N	0	0	263.768	4.333	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCCSc2ccc(F)cc21	ZINC000190425329	333206864	/nfs/dbraw/zinc/20/68/64/333206864.db2.gz	GCRSNJNRJIQKRQ-LBPRGKRZSA-N	0	0	293.407	4.257	20	30		CIEDRN
C=CCC1(C(=O)Nc2cccc(C(C)(F)F)c2)CCC1	ZINC000190718105	333209892	/nfs/dbraw/zinc/20/98/92/333209892.db2.gz	NDVLMNIOJJIRIZ-UHFFFAOYSA-N	0	0	279.330	4.483	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCc2c(cccc2C(C)C)C1	ZINC000190708018	333209918	/nfs/dbraw/zinc/20/99/18/333209918.db2.gz	CPIBWPSVWUIZSJ-OAHLLOKOSA-N	0	0	285.431	4.297	20	30		CIEDRN
C[C@@H](Nc1ccc2scnc2c1)c1cccc(C#N)c1	ZINC000190699432	333209980	/nfs/dbraw/zinc/20/99/80/333209980.db2.gz	KPDIMZWPOZXYCY-LLVKDONJSA-N	0	0	279.368	4.341	20	30		CIEDRN
C=CCCCC(=O)Nc1cc(Cl)c(Cl)cc1OC	ZINC000190768016	333210529	/nfs/dbraw/zinc/21/05/29/333210529.db2.gz	MBQWMKIQYOMKIZ-UHFFFAOYSA-N	0	0	288.174	4.297	20	30		CIEDRN
N#Cc1cccc(CNc2cccc3ccccc32)c1F	ZINC000223726028	333211690	/nfs/dbraw/zinc/21/16/90/333211690.db2.gz	XLICGSXNQUJUSG-UHFFFAOYSA-N	0	0	276.314	4.463	20	30		CIEDRN
C[C@H](SCc1ccc(C#N)cc1)c1cccc(C#N)c1	ZINC000190903120	333212145	/nfs/dbraw/zinc/21/21/45/333212145.db2.gz	ILHWDSFIFDAPPU-ZDUSSCGKSA-N	0	0	278.380	4.424	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(COC(C)C)cc1	ZINC000190997244	333213015	/nfs/dbraw/zinc/21/30/15/333213015.db2.gz	UQERKOKKIXVGER-QGZVFWFLSA-N	0	0	275.392	4.152	20	30		CIEDRN
Cc1ncsc1CCS[C@H](C)c1cccc(C#N)c1	ZINC000191025083	333213741	/nfs/dbraw/zinc/21/37/41/333213741.db2.gz	ZNZKQSKEFWDMSS-GFCCVEGCSA-N	0	0	288.441	4.360	20	30		CIEDRN
CC(C)OCCCS[C@H](C)c1cccc(C#N)c1	ZINC000191024764	333213779	/nfs/dbraw/zinc/21/37/79/333213779.db2.gz	VQYPBCFYTAKAFV-CYBMUJFWSA-N	0	0	263.406	4.168	20	30		CIEDRN
C=CCCCC(=O)Nc1cnn(-c2ccccc2)c1C(C)C	ZINC000191046741	333214195	/nfs/dbraw/zinc/21/41/95/333214195.db2.gz	GEWMGCPXUCUCPX-UHFFFAOYSA-N	0	0	297.402	4.291	20	30		CIEDRN
CN(Cc1c(F)cccc1Cl)c1ccc(F)cc1C#N	ZINC000521916746	333223154	/nfs/dbraw/zinc/22/31/54/333223154.db2.gz	ZDXFXBGVPDLQBA-UHFFFAOYSA-N	0	0	292.716	4.126	20	30		CIEDRN
Cc1cc(C#N)ccc1C(=O)N1CC[C@@H](C(C)(C)C)C[C@H]1C	ZINC000521934973	333224019	/nfs/dbraw/zinc/22/40/19/333224019.db2.gz	KFPZSZCPHSXSBJ-GDBMZVCRSA-N	0	0	298.430	4.154	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(F)cc1Cl	ZINC000191795305	333225418	/nfs/dbraw/zinc/22/54/18/333225418.db2.gz	NRTDVVWKJYTJTR-ZDUSSCGKSA-N	0	0	255.720	4.020	20	30		CIEDRN
C=CCC1(C(=O)N2C[C@@H](c3ccccc3)C[C@@H]2C)CCC1	ZINC000191841473	333226353	/nfs/dbraw/zinc/22/63/53/333226353.db2.gz	XCWNJQXMXWPVLF-RDJZCZTQSA-N	0	0	283.415	4.137	20	30		CIEDRN
N#Cc1cc(F)ccc1NC(=O)c1ccc(C2CCC2)cc1	ZINC000191918855	333227174	/nfs/dbraw/zinc/22/71/74/333227174.db2.gz	VTDMMCVFCYCAEF-UHFFFAOYSA-N	0	0	294.329	4.217	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cc(F)ccc1OCC1CC1	ZINC000192277617	333233980	/nfs/dbraw/zinc/23/39/80/333233980.db2.gz	AFDIWUDYXSQMCK-KRWDZBQOSA-N	0	0	291.366	4.155	20	30		CIEDRN
C=CCC[C@H](NC(=O)c1ccoc1Cl)c1ccccc1	ZINC000192344242	333234525	/nfs/dbraw/zinc/23/45/25/333234525.db2.gz	SNBNTBSFKIXZEJ-AWEZNQCLSA-N	0	0	289.762	4.370	20	30		CIEDRN
C=CCCCCCS[C@@H](C)c1nc(C2CC2)no1	ZINC000192536259	333236254	/nfs/dbraw/zinc/23/62/54/333236254.db2.gz	VZXGFFMYBIENRS-NSHDSACASA-N	0	0	266.410	4.488	20	30		CIEDRN
C=CCOc1ccccc1CNCc1sccc1Cl	ZINC000193098406	333242543	/nfs/dbraw/zinc/24/25/43/333242543.db2.gz	AJRAXTLIEOKJAW-UHFFFAOYSA-N	0	0	293.819	4.256	20	30		CIEDRN
CCS[C@@H]1CCC[C@@H]1Nc1cc(C#N)c2ccccc2n1	ZINC000226126320	333251044	/nfs/dbraw/zinc/25/10/44/333251044.db2.gz	XKIHXTMDJUTUKV-JKSUJKDBSA-N	0	0	297.427	4.193	20	30		CIEDRN
CCS[C@H]1CCC[C@H]1Nc1cc(C#N)c2ccccc2n1	ZINC000226126348	333251154	/nfs/dbraw/zinc/25/11/54/333251154.db2.gz	XKIHXTMDJUTUKV-CVEARBPZSA-N	0	0	297.427	4.193	20	30		CIEDRN
CCCC[C@@H](CC)CNc1c(C#N)nnc2ccccc21	ZINC000226141267	333251562	/nfs/dbraw/zinc/25/15/62/333251562.db2.gz	GCGUKBHLPJSENF-CYBMUJFWSA-N	0	0	282.391	4.130	20	30		CIEDRN
N#Cc1ccc(Cl)cc1NCCc1ccc(F)cc1F	ZINC000575904777	335129673	/nfs/dbraw/zinc/12/96/73/335129673.db2.gz	OODFANPDLKHDMH-UHFFFAOYSA-N	0	0	292.716	4.144	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@@H](CC)c1ccccc1	ZINC000193643094	333254451	/nfs/dbraw/zinc/25/44/51/333254451.db2.gz	SPSAQICMLKHXIO-KRWDZBQOSA-N	0	0	299.439	4.457	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)NCCC1CCCC1	ZINC000193834182	333258687	/nfs/dbraw/zinc/25/86/87/333258687.db2.gz	LCWHBCPFQIKKOR-UHFFFAOYSA-N	0	0	292.448	4.026	20	30		CIEDRN
Cc1ccc(C#N)c(Oc2ccc(F)c(C(F)(F)F)c2)n1	ZINC000226459079	333261408	/nfs/dbraw/zinc/26/14/08/333261408.db2.gz	BFETZCROKHGXPA-UHFFFAOYSA-N	0	0	296.223	4.212	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)[C@H]1CCCCC1(C)C	ZINC000226583161	333265376	/nfs/dbraw/zinc/26/53/76/333265376.db2.gz	QNUWWQPMGIHALV-CQSZACIVSA-N	0	0	270.376	4.022	20	30		CIEDRN
CC[C@H]1CC[C@H](C(=O)Nc2scc(C)c2C#N)CC1	ZINC000564190090	333268749	/nfs/dbraw/zinc/26/87/49/333268749.db2.gz	LVOAEFMGAITQSR-HAQNSBGRSA-N	0	0	276.405	4.083	20	30		CIEDRN
C=CCSCc1csc(-c2ccc(F)cc2)n1	ZINC000522283181	333278834	/nfs/dbraw/zinc/27/88/34/333278834.db2.gz	HGXOBMVIQZEECI-UHFFFAOYSA-N	0	0	265.378	4.368	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)[C@H](C)C(C)(C)C)c1	ZINC000522335043	333283083	/nfs/dbraw/zinc/28/30/83/333283083.db2.gz	ZRGROEKXWKOGOK-ZDUSSCGKSA-N	0	0	275.392	4.262	20	30		CIEDRN
C[C@@H]1C[C@@H](c2ccccc2)CN1c1c(F)cc(C#N)cc1F	ZINC000522405282	333286520	/nfs/dbraw/zinc/28/65/20/333286520.db2.gz	ZNXUHMNBBUCUJH-IUODEOHRSA-N	0	0	298.336	4.219	20	30		CIEDRN
C=CCCC(=O)NCCSCc1cccc2ccccc21	ZINC000522537449	333289319	/nfs/dbraw/zinc/28/93/19/333289319.db2.gz	JAQCZVLRQUMWQI-UHFFFAOYSA-N	0	0	299.439	4.155	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@H](c1ccc(Cl)cc1)C1CC1	ZINC000522575733	333290538	/nfs/dbraw/zinc/29/05/38/333290538.db2.gz	CKJTXWZBGZUTRH-ABAIWWIYSA-N	0	0	292.810	4.055	20	30		CIEDRN
C=CCCC(=O)N[C@H](c1cccs1)C(CC)CC	ZINC000522569994	333290583	/nfs/dbraw/zinc/29/05/83/333290583.db2.gz	CEKUWQZHDUHTHW-HNNXBMFYSA-N	0	0	265.422	4.308	20	30		CIEDRN
N#Cc1c(F)cccc1Nc1ccc(NC2CCCC2)nc1	ZINC000522623426	333292644	/nfs/dbraw/zinc/29/26/44/333292644.db2.gz	MBLRMHJRCBOLEV-UHFFFAOYSA-N	0	0	296.349	4.190	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@@H](c1ccc(CC)cc1)C(C)C	ZINC000522631245	333293278	/nfs/dbraw/zinc/29/32/78/333293278.db2.gz	QVMRYWOLUXISJY-WMLDXEAASA-N	0	0	288.435	4.210	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@@H](c1ccc(CC)cc1)C(C)C	ZINC000522631244	333293495	/nfs/dbraw/zinc/29/34/95/333293495.db2.gz	QVMRYWOLUXISJY-RHSMWYFYSA-N	0	0	288.435	4.210	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000522661795	333295533	/nfs/dbraw/zinc/29/55/33/333295533.db2.gz	OFCUGBZYISRNJI-MRVPVSSYSA-N	0	0	273.163	4.080	20	30		CIEDRN
CN(Cc1ccc(F)c(F)c1)c1cc(Cl)ccc1C#N	ZINC000522903562	333299362	/nfs/dbraw/zinc/29/93/62/333299362.db2.gz	YVCFOZXXUYSAAH-UHFFFAOYSA-N	0	0	292.716	4.126	20	30		CIEDRN
C[C@@H](CCC(C)(C)C)Nc1ncc(C#N)cc1Cl	ZINC000522904879	333299455	/nfs/dbraw/zinc/29/94/55/333299455.db2.gz	VINIOVREXDBKCT-JTQLQIEISA-N	0	0	265.788	4.233	20	30		CIEDRN
C=CCCCN(C)C(=O)[C@@H](CC1CCCC1)C(C)C	ZINC000522947629	333300918	/nfs/dbraw/zinc/30/09/18/333300918.db2.gz	PZPKOPHBAKFQPP-INIZCTEOSA-N	0	0	265.441	4.264	20	30		CIEDRN
C=CCCCN(C)C(=O)COc1ccccc1[C@@H](C)CC	ZINC000522954885	333300950	/nfs/dbraw/zinc/30/09/50/333300950.db2.gz	SOZJELQYSMFDCZ-HNNXBMFYSA-N	0	0	289.419	4.004	20	30		CIEDRN
C=CCCCN(C)C(=O)c1ccc2c(c1)Cc1ccccc1-2	ZINC000522954807	333300967	/nfs/dbraw/zinc/30/09/67/333300967.db2.gz	NFSDSFGEJWARBW-UHFFFAOYSA-N	0	0	291.394	4.296	20	30		CIEDRN
CC(C)OCc1ccccc1CNc1ccc(C#N)cc1F	ZINC000523077118	333306807	/nfs/dbraw/zinc/30/68/07/333306807.db2.gz	RUSXITZXZSKCTM-UHFFFAOYSA-N	0	0	298.361	4.234	20	30		CIEDRN
C=C(C)CN(CC)C(=O)C1(c2cccs2)CCCCC1	ZINC000523086670	333307369	/nfs/dbraw/zinc/30/73/69/333307369.db2.gz	POESFUYEHHWSQF-UHFFFAOYSA-N	0	0	291.460	4.375	20	30		CIEDRN
Cc1ccccc1[C@@H]1C[C@H](C)N(c2ccc(C#N)cc2)C1	ZINC000523086075	333307400	/nfs/dbraw/zinc/30/74/00/333307400.db2.gz	HQZFZZSJNGNGJR-DOTOQJQBSA-N	0	0	276.383	4.249	20	30		CIEDRN
N#Cc1cc(CSc2ccccc2F)ccc1F	ZINC000229753135	333309206	/nfs/dbraw/zinc/30/92/06/333309206.db2.gz	JRGFKBQGMURKFG-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
CC[C@@H](Sc1ccc(C#N)cc1)C(=O)c1ccccc1	ZINC000523109942	333309429	/nfs/dbraw/zinc/30/94/29/333309429.db2.gz	GHYGNGJCFJLPDU-MRXNPFEDSA-N	0	0	281.380	4.312	20	30		CIEDRN
C=CCCC(=O)N1CCC[C@@H](C)[C@@H]1c1ccc(C)cc1	ZINC000523143456	333311134	/nfs/dbraw/zinc/31/11/34/333311134.db2.gz	CPBHKOUEPPJPQZ-CRAIPNDOSA-N	0	0	271.404	4.261	20	30		CIEDRN
C[C@H](CC(=O)N(C)c1cccc(C#N)c1)C1CCCCC1	ZINC000523381793	333325025	/nfs/dbraw/zinc/32/50/25/333325025.db2.gz	KXHILFPEPVCHSH-CQSZACIVSA-N	0	0	284.403	4.128	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)N[C@H](C)[C@H](C)CC)c1	ZINC000523420936	333326171	/nfs/dbraw/zinc/32/61/71/333326171.db2.gz	IAVCALZIELWLTL-ZIAGYGMSSA-N	0	0	290.407	4.198	20	30		CIEDRN
Cc1ccc(C[C@H](C)[N@H+](C)Cc2ccc(C#N)cc2F)cc1	ZINC000523442907	333327387	/nfs/dbraw/zinc/32/73/87/333327387.db2.gz	WHEFLYSPLCYXMO-HNNXBMFYSA-N	0	0	296.389	4.069	20	30		CIEDRN
C=CCCSCC(=O)Nc1ccc(C(C)(C)C)cc1	ZINC000523521182	333332028	/nfs/dbraw/zinc/33/20/28/333332028.db2.gz	SVZFWXAQSYRGSN-UHFFFAOYSA-N	0	0	277.433	4.232	20	30		CIEDRN
C=CCNC(=O)N[C@H](CC1CCCCC1)c1ccccc1	ZINC000523539350	333332498	/nfs/dbraw/zinc/33/24/98/333332498.db2.gz	VDTYDMXGSQGOFP-QGZVFWFLSA-N	0	0	286.419	4.183	20	30		CIEDRN
C=CCCCCCN(C)C(=O)NC1C[C@@H](C)C[C@H](C)C1	ZINC000523567329	333333291	/nfs/dbraw/zinc/33/32/91/333333291.db2.gz	XIXPFBDHDLPXPN-GJZGRUSLSA-N	0	0	280.456	4.199	20	30		CIEDRN
N#Cc1ccc(S[C@@H](C#N)C2CCCCC2)cc1	ZINC000523712840	333341120	/nfs/dbraw/zinc/34/11/20/333341120.db2.gz	JAITVVTTXXCJMS-HNNXBMFYSA-N	0	0	256.374	4.123	20	30		CIEDRN
C=CCOc1ccccc1CNC(=O)CCCC(C)(C)C	ZINC000303564857	333343919	/nfs/dbraw/zinc/34/39/19/333343919.db2.gz	XUJQSGVHOJCZMP-UHFFFAOYSA-N	0	0	289.419	4.084	20	30		CIEDRN
C=CCN(CC=C)C(=O)N[C@@H](CCC(C)C)C(C)(C)C	ZINC000523770401	333344781	/nfs/dbraw/zinc/34/47/81/333344781.db2.gz	SXWZBHUISFUAAV-HNNXBMFYSA-N	0	0	280.456	4.221	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)[C@@H](C)c1cccs1	ZINC000303911735	333348266	/nfs/dbraw/zinc/34/82/66/333348266.db2.gz	UNKDVBSKOKYOBL-AWEZNQCLSA-N	0	0	291.460	4.447	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@H](c1ccccc1)C1CCCC1	ZINC000523943902	333349795	/nfs/dbraw/zinc/34/97/95/333349795.db2.gz	OGJGSYHTJMGJHE-RHSMWYFYSA-N	0	0	286.419	4.182	20	30		CIEDRN
C=CCCC(=O)N[C@H](c1ccc(Cl)cc1)C(C)C	ZINC000523953846	333349990	/nfs/dbraw/zinc/34/99/90/333349990.db2.gz	YFMCLUFXGQRXRQ-HNNXBMFYSA-N	0	0	265.784	4.120	20	30		CIEDRN
CC(C)c1ccc(CCCNc2ncccc2C#N)cc1	ZINC000523971599	333350256	/nfs/dbraw/zinc/35/02/56/333350256.db2.gz	OGMUBBZDCKPBBT-UHFFFAOYSA-N	0	0	279.387	4.121	20	30		CIEDRN
CCN(CCCCC(C)(C)C#N)c1cccc(F)c1	ZINC000233444294	333352423	/nfs/dbraw/zinc/35/24/23/333352423.db2.gz	YEVHVQAZIIQEFJ-UHFFFAOYSA-N	0	0	262.372	4.372	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)[C@@H](CC)CC1CCCCC1	ZINC000524194713	333355992	/nfs/dbraw/zinc/35/59/92/333355992.db2.gz	ITGKYTFJIBLWGZ-HIFRSBDPSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)C1(c2ccccc2C)CCCCC1	ZINC000524194487	333356010	/nfs/dbraw/zinc/35/60/10/333356010.db2.gz	CUJQLOGJVZUCKI-MRXNPFEDSA-N	0	0	285.431	4.278	20	30		CIEDRN
C=CCCCSc1nc2ccccc2n1C(F)F	ZINC000524230301	333356918	/nfs/dbraw/zinc/35/69/18/333356918.db2.gz	YTYXXGWEJNTABD-UHFFFAOYSA-N	0	0	268.332	4.490	20	30		CIEDRN
CC[C@@H](CC(=O)Nc1ccccc1C#N)c1ccc(C)cc1	ZINC000524249376	333358025	/nfs/dbraw/zinc/35/80/25/333358025.db2.gz	CYJKUTQLBCNAMH-HNNXBMFYSA-N	0	0	292.382	4.389	20	30		CIEDRN
C=CCSCCOc1ccc(C(F)(F)F)cc1	ZINC000524458660	333362516	/nfs/dbraw/zinc/36/25/16/333362516.db2.gz	ZZLUHRXVEUSMNM-UHFFFAOYSA-N	0	0	262.296	4.003	20	30		CIEDRN
C=CCSCC(=O)N(CC)c1cccc2ccccc21	ZINC000524457072	333362575	/nfs/dbraw/zinc/36/25/75/333362575.db2.gz	FILQGNGKXVMZAK-UHFFFAOYSA-N	0	0	285.412	4.112	20	30		CIEDRN
C[C@@H](CC(=O)Nc1ccccc1C#N)C1CCCCC1	ZINC000524466452	333362751	/nfs/dbraw/zinc/36/27/51/333362751.db2.gz	HNLSRKSILRGUHF-ZDUSSCGKSA-N	0	0	270.376	4.103	20	30		CIEDRN
COc1cc(CNc2ccccc2C(C)C)ccc1C#N	ZINC000234908966	333362986	/nfs/dbraw/zinc/36/29/86/333362986.db2.gz	FIMZRDAFUCYWQL-UHFFFAOYSA-N	0	0	280.371	4.302	20	30		CIEDRN
C=CCCC(=O)N[C@H](c1ccccc1Cl)C(C)C	ZINC000524511134	333363984	/nfs/dbraw/zinc/36/39/84/333363984.db2.gz	RJLJPYVEKUOHDS-HNNXBMFYSA-N	0	0	265.784	4.120	20	30		CIEDRN
Cc1ccc([C@@H](C)Nc2nccc(C#N)c2Cl)cc1	ZINC000235285251	333367252	/nfs/dbraw/zinc/36/72/52/333367252.db2.gz	FDUHRQBVMQUBTD-LLVKDONJSA-N	0	0	271.751	4.088	20	30		CIEDRN
C=CCCSCc1cc(C(C)=O)ccc1OCC	ZINC000524604684	333368386	/nfs/dbraw/zinc/36/83/86/333368386.db2.gz	AYYPJCPKIDURFS-UHFFFAOYSA-N	0	0	264.390	4.097	20	30		CIEDRN
Cc1cc([C@H](C)Nc2nccc(C#N)c2Cl)c(C)s1	ZINC000235538697	333370748	/nfs/dbraw/zinc/37/07/48/333370748.db2.gz	PWXNERLCESAVMJ-VIFPVBQESA-N	0	0	291.807	4.458	20	30		CIEDRN
Cc1cc2ncn(CCCCC(C)(C)C#N)c2cc1C	ZINC000235884821	333372537	/nfs/dbraw/zinc/37/25/37/333372537.db2.gz	URIULUQMAVQORC-UHFFFAOYSA-N	0	0	269.392	4.373	20	30		CIEDRN
N#Cc1ccnc(NCc2ccc(F)c(Cl)c2)c1Cl	ZINC000236237771	333373490	/nfs/dbraw/zinc/37/34/90/333373490.db2.gz	LYAAPDLIGBFICS-UHFFFAOYSA-N	0	0	296.132	4.011	20	30		CIEDRN
CC[C@H](CC#N)NCc1ccc(OCc2ccccc2)cc1	ZINC000236919125	333376498	/nfs/dbraw/zinc/37/64/98/333376498.db2.gz	ZNDCFYIQEWIMMV-GOSISDBHSA-N	0	0	294.398	4.047	20	30		CIEDRN
COc1ccc(CNc2cccc3c2CCCC3)cc1C#N	ZINC000316300126	333388001	/nfs/dbraw/zinc/38/80/01/333388001.db2.gz	MCRVGRFUZXYBHA-UHFFFAOYSA-N	0	0	292.382	4.058	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@@H]1CCC(C)=C(C)C1	ZINC000575989834	335139301	/nfs/dbraw/zinc/13/93/01/335139301.db2.gz	AUNFGCJGLLUDAF-OAHLLOKOSA-N	0	0	289.444	4.399	20	30		CIEDRN
Cc1ccc2sc(CN3CCCC(C)(C)[C@@H]3C#N)nc2c1	ZINC000528474907	333440132	/nfs/dbraw/zinc/44/01/32/333440132.db2.gz	JBLUWHKZDFSGOR-HNNXBMFYSA-N	0	0	299.443	4.119	20	30		CIEDRN
Cc1ccc(CNc2ccc(C#N)c(Cl)c2)c(C)c1	ZINC000036964025	333443280	/nfs/dbraw/zinc/44/32/80/333443280.db2.gz	UEEMBVZPYOYELE-UHFFFAOYSA-N	0	0	270.763	4.441	20	30		CIEDRN
CC[C@H](Nc1ccc(CC#N)cc1)c1ccc(F)cc1	ZINC000037071492	333472183	/nfs/dbraw/zinc/47/21/83/333472183.db2.gz	HUVOKZDBJXFPIX-KRWDZBQOSA-N	0	0	268.335	4.455	20	30		CIEDRN
C=CC[C@H]1N(C(=O)Nc2ncsc2C)CCCC1(C)C	ZINC000529135040	333473312	/nfs/dbraw/zinc/47/33/12/333473312.db2.gz	AJBZFKLNAMQRRV-GFCCVEGCSA-N	0	0	293.436	4.050	20	30		CIEDRN
CN(C(=O)c1cc2ccccc2s1)c1ccc(C#N)cc1	ZINC000061954651	333483877	/nfs/dbraw/zinc/48/38/77/333483877.db2.gz	PMFNAACVSSJUIJ-UHFFFAOYSA-N	0	0	292.363	4.050	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cccc(C2CCOCC2)c1	ZINC000529936712	333515110	/nfs/dbraw/zinc/51/51/10/333515110.db2.gz	UWDNLEPMCZCAPZ-AWEZNQCLSA-N	0	0	287.403	4.121	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc3occc3c2)CCC1	ZINC000530002860	333517264	/nfs/dbraw/zinc/51/72/64/333517264.db2.gz	BYTCHXKAOPTUMJ-UHFFFAOYSA-N	0	0	255.317	4.118	20	30		CIEDRN
C=CC[C@H](c1nc(C2(OC)CCCC2)no1)c1ccccc1	ZINC000530159785	333525962	/nfs/dbraw/zinc/52/59/62/333525962.db2.gz	JRVZMKDTILOBOU-HNNXBMFYSA-N	0	0	298.386	4.193	20	30		CIEDRN
N#Cc1cccc(OCCSC2CCCCC2)c1	ZINC000037685573	333536326	/nfs/dbraw/zinc/53/63/26/333536326.db2.gz	XULLWYCVEDQKHL-UHFFFAOYSA-N	0	0	261.390	4.003	20	30		CIEDRN
CC(C)N(CCC#N)C(=O)CC(C)(C)C1CCCCC1	ZINC000530277878	333536898	/nfs/dbraw/zinc/53/68/98/333536898.db2.gz	BOKUZWBBXHRDEW-UHFFFAOYSA-N	0	0	278.440	4.134	20	30		CIEDRN
Cc1ccc(C#N)c(N[C@@H]2CC[C@H](c3cccc(F)c3)C2)n1	ZINC000530377466	333545506	/nfs/dbraw/zinc/54/55/06/333545506.db2.gz	WMKCUCMETNNLJR-WMLDXEAASA-N	0	0	295.361	4.149	20	30		CIEDRN
N#Cc1ccc(Oc2c(F)cccc2[N+](=O)[O-])c(Cl)c1	ZINC000124210884	333556978	/nfs/dbraw/zinc/55/69/78/333556978.db2.gz	QVRARXZFKRVZCU-UHFFFAOYSA-N	0	0	292.653	4.051	20	30		CIEDRN
N#Cc1ccc(NCCCCC(F)(F)F)c(Cl)c1	ZINC000125321011	333565773	/nfs/dbraw/zinc/56/57/73/333565773.db2.gz	MVHGIZPHXZCHSK-UHFFFAOYSA-N	0	0	276.689	4.356	20	30		CIEDRN
C=C(CC)CS[C@@H](C)C(=O)Nc1ccc(Cl)cc1	ZINC000537993590	333570017	/nfs/dbraw/zinc/57/00/17/333570017.db2.gz	XJIQKKPSAZJLHK-NSHDSACASA-N	0	0	283.824	4.366	20	30		CIEDRN
CSc1cccc(NCc2cccc(C#N)c2)c1C	ZINC000538122846	333575148	/nfs/dbraw/zinc/57/51/48/333575148.db2.gz	SPJABAQNRRWATP-UHFFFAOYSA-N	0	0	268.385	4.201	20	30		CIEDRN
CCCCc1noc([C@H](C)SCCC(C)(C)C#N)n1	ZINC000576067974	335148552	/nfs/dbraw/zinc/14/85/52/335148552.db2.gz	PUTBQXAFXZXINS-NSHDSACASA-N	0	0	281.425	4.146	20	30		CIEDRN
C=CCCOCCCCC(=O)Nc1ccccc1Cl	ZINC000538266765	333582125	/nfs/dbraw/zinc/58/21/25/333582125.db2.gz	KRSZNVOXDXDJDK-UHFFFAOYSA-N	0	0	281.783	4.042	20	30		CIEDRN
C[C@H](C#N)CN(C)c1ccc2ccc(Cl)c(Cl)c2n1	ZINC000538265338	333582200	/nfs/dbraw/zinc/58/22/00/333582200.db2.gz	PGUAOYUSWKKJQX-SECBINFHSA-N	0	0	294.185	4.137	20	30		CIEDRN
Cc1ccc(NC2CCC(C#N)(c3ccccc3)CC2)nc1	ZINC000538324707	333585341	/nfs/dbraw/zinc/58/53/41/333585341.db2.gz	CWDBDBNZUPNXMB-UHFFFAOYSA-N	0	0	291.398	4.206	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1ccc(OC)c(Cl)c1	ZINC000538341777	333586086	/nfs/dbraw/zinc/58/60/86/333586086.db2.gz	KJTKTRGWUNERHB-NSHDSACASA-N	0	0	296.798	4.215	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N1CCCC[C@H](SCC)C1	ZINC000538369616	333587297	/nfs/dbraw/zinc/58/72/97/333587297.db2.gz	DJJLQAZGOIOUGG-CABCVRRESA-N	0	0	298.496	4.048	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1cccc(C)c1F	ZINC000538392400	333587504	/nfs/dbraw/zinc/58/75/04/333587504.db2.gz	DUVCEUIGXIYSRD-LBPRGKRZSA-N	0	0	264.344	4.000	20	30		CIEDRN
CN(Cc1ccc(C#N)cc1F)c1cccc2ccccc21	ZINC000065590558	333598181	/nfs/dbraw/zinc/59/81/81/333598181.db2.gz	GPMXHAJWKJGXRY-UHFFFAOYSA-N	0	0	290.341	4.487	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@@H]1CCC[C@@H]1CC)c1ccccc1	ZINC000126519118	333599093	/nfs/dbraw/zinc/59/90/93/333599093.db2.gz	IXAVGZUCQCTWRF-ZMSDIMECSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CCCCCN(C)Cc1csc([C@@H](C)OCC)n1	ZINC000576075767	335149687	/nfs/dbraw/zinc/14/96/87/335149687.db2.gz	PAOZMTZOXQEYAC-CYBMUJFWSA-N	0	0	282.453	4.029	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1cc(Cl)ccn1)c1ccccc1	ZINC000126902829	333613765	/nfs/dbraw/zinc/61/37/65/333613765.db2.gz	ZRVARGSOYKVDAO-LBPRGKRZSA-N	0	0	286.762	4.033	20	30		CIEDRN
CC(C)c1ccc(CNc2cccc(C#N)c2)cc1[N+](=O)[O-]	ZINC000538862613	333639626	/nfs/dbraw/zinc/63/96/26/333639626.db2.gz	UEEGTJVIYHLJCE-UHFFFAOYSA-N	0	0	295.342	4.202	20	30		CIEDRN
C=CCN(C(=O)c1cc2c(s1)CCC2)c1ccccc1	ZINC000128205156	333644610	/nfs/dbraw/zinc/64/46/10/333644610.db2.gz	IUXYMJWOWFVJLP-UHFFFAOYSA-N	0	0	283.396	4.070	20	30		CIEDRN
C=C(CC)CSCC(=O)N(C)[C@H](C)c1ccc(F)cc1	ZINC000539093271	333657447	/nfs/dbraw/zinc/65/74/47/333657447.db2.gz	JDUZTKYRGFKLEY-CYBMUJFWSA-N	0	0	295.423	4.045	20	30		CIEDRN
C=C(CC)CS[C@H](C)c1nc(CCCC)no1	ZINC000539095067	333657741	/nfs/dbraw/zinc/65/77/41/333657741.db2.gz	PIPGMUYSTAJXRX-LLVKDONJSA-N	0	0	254.399	4.173	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N(C)CCCc1ccccc1	ZINC000539388878	333668438	/nfs/dbraw/zinc/66/84/38/333668438.db2.gz	VWOMKQAAVUGMGT-INIZCTEOSA-N	0	0	288.435	4.005	20	30		CIEDRN
C=CCCOCCCCC(=O)N1CCCC[C@@H]1CC(C)C	ZINC000539390567	333668674	/nfs/dbraw/zinc/66/86/74/333668674.db2.gz	BJPLWWNSYUUJEB-QGZVFWFLSA-N	0	0	295.467	4.177	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N1CCC[C@@]2(CC=CCC2)C1	ZINC000539390745	333668695	/nfs/dbraw/zinc/66/86/95/333668695.db2.gz	WBFLNWQIPYLLGK-WMZOPIPTSA-N	0	0	290.451	4.263	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1ccccc1OCC)c1ccccc1	ZINC000128512352	333679908	/nfs/dbraw/zinc/67/99/08/333679908.db2.gz	VLIZZZMCTKZUMU-HNNXBMFYSA-N	0	0	295.382	4.384	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc(OC(C)C)cc1F	ZINC000128625273	333691321	/nfs/dbraw/zinc/69/13/21/333691321.db2.gz	XTXGWKBUJJWIPK-UHFFFAOYSA-N	0	0	291.366	4.320	20	30		CIEDRN
CCCCCC(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1	ZINC000068454348	333700802	/nfs/dbraw/zinc/70/08/02/333700802.db2.gz	XWJAHYRNKWLZPQ-ZDUSSCGKSA-N	0	0	299.201	4.255	20	30		CIEDRN
CC(C)CCC(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1	ZINC000068458020	333702281	/nfs/dbraw/zinc/70/22/81/333702281.db2.gz	SLARNDZPIARFGH-ZDUSSCGKSA-N	0	0	299.201	4.110	20	30		CIEDRN
C=CCCCN(C)C(=O)C[C@H](C)Cc1ccc(Cl)cc1	ZINC000540107167	333709657	/nfs/dbraw/zinc/70/96/57/333709657.db2.gz	GPVBRHVMMZPGFE-CQSZACIVSA-N	0	0	293.838	4.333	20	30		CIEDRN
C=CCN(C(=O)Nc1ccc(SC)c(Cl)c1)C1CC1	ZINC000540108326	333709961	/nfs/dbraw/zinc/70/99/61/333709961.db2.gz	FUSZLKZWCGMFCM-UHFFFAOYSA-N	0	0	296.823	4.244	20	30		CIEDRN
N#Cc1cc(NCCC2=CCCCC2)nc2ccccc12	ZINC000068770160	333728753	/nfs/dbraw/zinc/72/87/53/333728753.db2.gz	NGUURWRVHKBSJY-UHFFFAOYSA-N	0	0	277.371	4.409	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N1CCC2(C1)CCCCC2	ZINC000540489130	333731990	/nfs/dbraw/zinc/73/19/90/333731990.db2.gz	PMEOMUKLBQXRKI-OAHLLOKOSA-N	0	0	278.440	4.097	20	30		CIEDRN
C=CCCN[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000540519123	333733448	/nfs/dbraw/zinc/73/34/48/333733448.db2.gz	ALAXTRFUNJPGDJ-NSHDSACASA-N	0	0	297.242	4.475	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)CCc1ccnc2ccccc12	ZINC000540534550	333734120	/nfs/dbraw/zinc/73/41/20/333734120.db2.gz	ABCLBURXMQQAFU-OAHLLOKOSA-N	0	0	296.414	4.028	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1cncc(-c2ccccc2)c1	ZINC000540532410	333734139	/nfs/dbraw/zinc/73/41/39/333734139.db2.gz	QYRZKHJIYCJNMD-HNNXBMFYSA-N	0	0	294.398	4.223	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)C(C)(C)c1ccc(C)cc1	ZINC000540533444	333734305	/nfs/dbraw/zinc/73/43/05/333734305.db2.gz	XWPUAZXYIJBZBV-OAHLLOKOSA-N	0	0	273.420	4.134	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1cccc(CSC)c1	ZINC000540557755	333735384	/nfs/dbraw/zinc/73/53/84/333735384.db2.gz	QTPDLIMYSZEYRH-ZDUSSCGKSA-N	0	0	292.448	4.416	20	30		CIEDRN
C[C@H](CCNc1ncc(C#N)cc1Cl)c1ccccc1	ZINC000540985079	333756849	/nfs/dbraw/zinc/75/68/49/333756849.db2.gz	STKGVXPETLYEQR-GFCCVEGCSA-N	0	0	285.778	4.212	20	30		CIEDRN
CC[C@@]1(C)C[C@@H]1C(=O)Nc1ccccc1SCCC#N	ZINC000129409052	333762047	/nfs/dbraw/zinc/76/20/47/333762047.db2.gz	AFHXETYJSKOJEZ-WBMJQRKESA-N	0	0	288.416	4.067	20	30		CIEDRN
C=CCC(C)(C)c1noc(/C=C\c2ccsc2)n1	ZINC000576128217	335158441	/nfs/dbraw/zinc/15/84/41/335158441.db2.gz	ZKQSXGNHFHNLMK-WAYWQWQTSA-N	0	0	260.362	4.155	20	30		CIEDRN
C=CCC(C)(C)c1noc(/C=C/c2ccsc2)n1	ZINC000576128216	335158461	/nfs/dbraw/zinc/15/84/61/335158461.db2.gz	ZKQSXGNHFHNLMK-AATRIKPKSA-N	0	0	260.362	4.155	20	30		CIEDRN
C[C@H](CCC(C)(C)C)C(=O)N(CCC#N)CC(C)(C)C	ZINC000541622675	333784625	/nfs/dbraw/zinc/78/46/25/333784625.db2.gz	ROHCGGVCUZACEO-CQSZACIVSA-N	0	0	280.456	4.237	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N[C@H](C)c1cc2ccccc2o1	ZINC000541782366	333792658	/nfs/dbraw/zinc/79/26/58/333792658.db2.gz	VDENTFSUEMLHFY-TZMCWYRMSA-N	0	0	286.375	4.148	20	30		CIEDRN
C[C@@H](Nc1cccc2ccncc21)c1ccc(C#N)cc1F	ZINC000541897173	333797570	/nfs/dbraw/zinc/79/75/70/333797570.db2.gz	KSTUCUZKVSBQDY-GFCCVEGCSA-N	0	0	291.329	4.419	20	30		CIEDRN
C=C[C@@H](CC(=O)N[C@@H]1CCCc2occc21)c1ccccc1	ZINC000129964427	333801548	/nfs/dbraw/zinc/80/15/48/333801548.db2.gz	MWBBDHNXHSAHFS-WMLDXEAASA-N	0	0	295.382	4.133	20	30		CIEDRN
C=CCCCSc1nnc(-c2cc(C)cc(C)c2)o1	ZINC000576143450	335159896	/nfs/dbraw/zinc/15/98/96/335159896.db2.gz	VGDQRZPFUKDHRO-UHFFFAOYSA-N	0	0	274.389	4.412	20	30		CIEDRN
C=CCCC(=O)N[C@H](c1ccc(Cl)cc1)C(F)(F)F	ZINC000130025477	333807545	/nfs/dbraw/zinc/80/75/45/333807545.db2.gz	AFZMIDLHWMYVJG-GFCCVEGCSA-N	0	0	291.700	4.026	20	30		CIEDRN
CC(C)(C)OCCSc1cccc(Cl)c1C#N	ZINC000542101561	333809971	/nfs/dbraw/zinc/80/99/71/333809971.db2.gz	BHDJPKWZSPHFCE-UHFFFAOYSA-N	0	0	269.797	4.119	20	30		CIEDRN
CC(C)(C)c1cnc(SCc2ccc(C#N)cc2)o1	ZINC000130185807	333822362	/nfs/dbraw/zinc/82/23/62/333822362.db2.gz	SLCMZPJZWARKOS-UHFFFAOYSA-N	0	0	272.373	4.136	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(NCc2ccc([C@@H]3C[C@@H]3C)o2)c1	ZINC000542519905	333830359	/nfs/dbraw/zinc/83/03/59/333830359.db2.gz	VASVWZAGGGIAFX-MEDUHNTESA-N	0	0	294.354	4.089	20	30		CIEDRN
C=C[C@H](CC(=O)NC[C@H](C)c1ccccc1)c1ccccc1	ZINC000542561479	333832153	/nfs/dbraw/zinc/83/21/53/333832153.db2.gz	BLPFPEBXCRVGGI-DLBZAZTESA-N	0	0	293.410	4.266	20	30		CIEDRN
N#Cc1cc(F)ccc1NC(=O)c1cccc(C2CCC2)c1	ZINC000542704111	333837536	/nfs/dbraw/zinc/83/75/36/333837536.db2.gz	TXGCHFLFUNQERQ-UHFFFAOYSA-N	0	0	294.329	4.217	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc([C@H]2CCOc3ccccc32)no1	ZINC000564258609	333838652	/nfs/dbraw/zinc/83/86/52/333838652.db2.gz	XBYPYAFLHBUQKQ-JSGCOSHPSA-N	0	0	284.359	4.054	20	30		CIEDRN
C=CCC[C@H](C)Nc1ccc(NC(=O)C(C)C)cc1	ZINC000130593913	333855700	/nfs/dbraw/zinc/85/57/00/333855700.db2.gz	MVTHVDQRDIPCOB-ZDUSSCGKSA-N	0	0	260.381	4.048	20	30		CIEDRN
N#Cc1cnc(N2CCCC[C@H]2c2ccccc2)c(Cl)c1	ZINC000543091365	333856583	/nfs/dbraw/zinc/85/65/83/333856583.db2.gz	HYIJPXXCDLUBEQ-INIZCTEOSA-N	0	0	297.789	4.338	20	30		CIEDRN
N#Cc1cnc(N2CCCC[C@@H]2c2ccccc2)c(Cl)c1	ZINC000543091367	333856628	/nfs/dbraw/zinc/85/66/28/333856628.db2.gz	HYIJPXXCDLUBEQ-MRXNPFEDSA-N	0	0	297.789	4.338	20	30		CIEDRN
C=CCC[C@@H](C)Nc1cc(OC)ccc1OC(F)F	ZINC000130645880	333863333	/nfs/dbraw/zinc/86/33/33/333863333.db2.gz	XWFSESBINSCZSB-SNVBAGLBSA-N	0	0	271.307	4.063	20	30		CIEDRN
C=C[C@@H](CC(=O)N(C)C[C@@H]1CC=CCC1)c1ccccc1	ZINC000543197352	333864130	/nfs/dbraw/zinc/86/41/30/333864130.db2.gz	ZSOUUKRUMMYGQW-SJORKVTESA-N	0	0	283.415	4.161	20	30		CIEDRN
C=CCC[C@H](Nc1nccc(C)c1C#N)c1ccccc1	ZINC000543206709	333864774	/nfs/dbraw/zinc/86/47/74/333864774.db2.gz	WRJVFPSSWXFMQD-KRWDZBQOSA-N	0	0	277.371	4.381	20	30		CIEDRN
C=CCC[C@@H](C)Nc1cc(OC)c(Cl)cc1OC	ZINC000130656984	333865289	/nfs/dbraw/zinc/86/52/89/333865289.db2.gz	HNWTXBWUMNWZIV-SNVBAGLBSA-N	0	0	269.772	4.124	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(N[C@H](C)CCc2ccc(C)o2)c1	ZINC000543435314	333874276	/nfs/dbraw/zinc/87/42/76/333874276.db2.gz	ARSRMOZAWMPZJX-GFCCVEGCSA-N	0	0	296.370	4.096	20	30		CIEDRN
COC1CCC(CCNc2c(Cl)cccc2C#N)CC1	ZINC000543450306	333875838	/nfs/dbraw/zinc/87/58/38/333875838.db2.gz	DWQHDAMIKFRSNG-UHFFFAOYSA-N	0	0	292.810	4.219	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N[C@H](CC)c1ccc(C)cc1	ZINC000543705401	333890002	/nfs/dbraw/zinc/89/00/02/333890002.db2.gz	TVQXGCCASGZCJS-JKSUJKDBSA-N	0	0	274.408	4.100	20	30		CIEDRN
C[C@H](NCc1ccc([C@@H]2C[C@H]2C)o1)c1ccc(C#N)cc1F	ZINC000543762214	333897044	/nfs/dbraw/zinc/89/70/44/333897044.db2.gz	JJBCSEAAAUFVNA-BFQNTYOBSA-N	0	0	298.361	4.265	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1cccc(COC)c1)c1ccccc1	ZINC000131147649	333905256	/nfs/dbraw/zinc/90/52/56/333905256.db2.gz	CXAQGLKUNNCAOU-MRXNPFEDSA-N	0	0	295.382	4.131	20	30		CIEDRN
CSCc1cccc(NCc2ccc(C#N)cc2)c1	ZINC000131224372	333910490	/nfs/dbraw/zinc/91/04/90/333910490.db2.gz	WLZGPROMEDKQAG-UHFFFAOYSA-N	0	0	268.385	4.033	20	30		CIEDRN
N#CCc1ccc(CSCCOc2ccccc2)cc1	ZINC000544083665	333915132	/nfs/dbraw/zinc/91/51/32/333915132.db2.gz	UBLZCIUXOFULCZ-UHFFFAOYSA-N	0	0	283.396	4.065	20	30		CIEDRN
CC[C@@H]1CN(CCCCC#N)c2cccc(Cl)c2O1	ZINC000544115909	333916967	/nfs/dbraw/zinc/91/69/67/333916967.db2.gz	CEICRRRJCRXMSH-GFCCVEGCSA-N	0	0	278.783	4.011	20	30		CIEDRN
N#Cc1ccc(Cc2nc(CCC3CCCCC3)no2)cc1	ZINC000544122504	333917560	/nfs/dbraw/zinc/91/75/60/333917560.db2.gz	VLFGUXDCTBORQL-UHFFFAOYSA-N	0	0	295.386	4.045	20	30		CIEDRN
CC[C@@H]1CCCCCN1C(=O)c1ccc(Cl)c(C#N)c1	ZINC000544399282	333929323	/nfs/dbraw/zinc/92/93/23/333929323.db2.gz	MOFPEIZURVVUKN-CQSZACIVSA-N	0	0	290.794	4.006	20	30		CIEDRN
CCC[C@@H]1CCCCN1C(=O)c1ccc(Cl)c(C#N)c1	ZINC000544485180	333933511	/nfs/dbraw/zinc/93/35/11/333933511.db2.gz	QSPYICSHIJWCQH-CQSZACIVSA-N	0	0	290.794	4.006	20	30		CIEDRN
C=CCCCc1nc(CSc2ccc(F)cc2)no1	ZINC000544903131	333951995	/nfs/dbraw/zinc/95/19/95/333951995.db2.gz	QFSZNQPVJDCSFX-UHFFFAOYSA-N	0	0	278.352	4.010	20	30		CIEDRN
C=CCCc1nc(-c2ccc(SC)cc2Cl)no1	ZINC000545098486	333962925	/nfs/dbraw/zinc/96/29/25/333962925.db2.gz	YRWAWFCQVMBZRB-UHFFFAOYSA-N	0	0	280.780	4.231	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC)c1nc2ccccc2s1	ZINC000545215186	333969850	/nfs/dbraw/zinc/96/98/50/333969850.db2.gz	DVKDUZIJADJDNJ-LBPRGKRZSA-N	0	0	288.416	4.252	20	30		CIEDRN
C=C[C@@H](Cc1nc(C(CC)CC)no1)c1ccccc1	ZINC000545670752	333994090	/nfs/dbraw/zinc/99/40/90/333994090.db2.gz	HAOIBLWXMBDABZ-AWEZNQCLSA-N	0	0	270.376	4.486	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2cccc(C)c2Cl)CC1	ZINC000174926983	335169682	/nfs/dbraw/zinc/16/96/82/335169682.db2.gz	CVHYGKSIYMSVIA-UHFFFAOYSA-N	0	0	278.783	4.078	20	30		CIEDRN
C/C(=C/c1cccc(C(F)(F)F)c1)CN(C)[C@H](C)CC#N	ZINC000564294863	334002792	/nfs/dbraw/zinc/00/27/92/334002792.db2.gz	LBLDZHQONRXPKK-KIWPFMIBSA-N	0	0	296.336	4.343	20	30		CIEDRN
CC#CCCCc1nc(-c2cccc3ccccc32)no1	ZINC000545933669	334007395	/nfs/dbraw/zinc/00/73/95/334007395.db2.gz	WYTSGZWYSRBKKI-UHFFFAOYSA-N	0	0	276.339	4.236	20	30		CIEDRN
N#Cc1cccc(NCc2cnc(-c3cccs3)s2)c1	ZINC000132874977	334008642	/nfs/dbraw/zinc/00/86/42/334008642.db2.gz	XQFMTRAWJNFPJK-UHFFFAOYSA-N	0	0	297.408	4.355	20	30		CIEDRN
N#Cc1cccc(NCc2cc(Cl)cc3cccnc32)c1	ZINC000132884817	334009117	/nfs/dbraw/zinc/00/91/17/334009117.db2.gz	BDQCKAVXBKADTP-UHFFFAOYSA-N	0	0	293.757	4.372	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(C)[C@@H]1CCCc2ccccc21	ZINC000545957902	334009165	/nfs/dbraw/zinc/00/91/65/334009165.db2.gz	UTEBMXHPMNOIRT-DOTOQJQBSA-N	0	0	286.419	4.060	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(C)[C@H]1CCCc2ccccc21	ZINC000545957905	334009202	/nfs/dbraw/zinc/00/92/02/334009202.db2.gz	UTEBMXHPMNOIRT-WBVHZDCISA-N	0	0	286.419	4.060	20	30		CIEDRN
C[C@@H](CCC(C)(C)C)NC(=O)Nc1ccc(CC#N)cc1	ZINC000133085108	334015707	/nfs/dbraw/zinc/01/57/07/334015707.db2.gz	RUWISYRZFXOPMN-ZDUSSCGKSA-N	0	0	287.407	4.089	20	30		CIEDRN
C[C@H](CCC(C)(C)C)NC(=O)Nc1ccc(CC#N)cc1	ZINC000133085293	334015813	/nfs/dbraw/zinc/01/58/13/334015813.db2.gz	RUWISYRZFXOPMN-CYBMUJFWSA-N	0	0	287.407	4.089	20	30		CIEDRN
N#CC1(CSCc2noc(C3CCCCC3)n2)CCC1	ZINC000576212744	335170998	/nfs/dbraw/zinc/17/09/98/335170998.db2.gz	USVYTSLVLOSKAX-UHFFFAOYSA-N	0	0	291.420	4.044	20	30		CIEDRN
C=CCCOCCCCc1nc([C@@H]2CCCC[C@@H]2C)no1	ZINC000546396790	334030702	/nfs/dbraw/zinc/03/07/02/334030702.db2.gz	ZAPOICHEWNEFPM-LSDHHAIUSA-N	0	0	292.423	4.279	20	30		CIEDRN
C[C@@H]1CCCC[C@H]1c1noc(CCc2ccc(C#N)cc2)n1	ZINC000546401015	334030806	/nfs/dbraw/zinc/03/08/06/334030806.db2.gz	QVLLYXKNJWLYBD-CZUORRHYSA-N	0	0	295.386	4.020	20	30		CIEDRN
C[C@@H](Oc1ccccc1C#N)c1nc([C@@H](C)C(C)(C)C)no1	ZINC000546418096	334031675	/nfs/dbraw/zinc/03/16/75/334031675.db2.gz	XEGGCZAXWVLSGO-VXGBXAGGSA-N	0	0	299.374	4.231	20	30		CIEDRN
CC[C@@H](CC(F)(F)F)Nc1ccc(Cl)cc1C#N	ZINC000546879851	334053470	/nfs/dbraw/zinc/05/34/70/334053470.db2.gz	NLOFEBWEKQAMEZ-JTQLQIEISA-N	0	0	276.689	4.355	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)Nc1ccc(C)s1	ZINC000075409329	334041475	/nfs/dbraw/zinc/04/14/75/334041475.db2.gz	DYICWFOLDMGGDP-UHFFFAOYSA-N	0	0	286.400	4.277	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](c1ccccc1)C(F)(F)F	ZINC000546630421	334042050	/nfs/dbraw/zinc/04/20/50/334042050.db2.gz	QTTZRNKFPFLTSJ-YPMHNXCESA-N	0	0	285.309	4.009	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](c1ccccc1)C(F)(F)F	ZINC000546630420	334042121	/nfs/dbraw/zinc/04/21/21/334042121.db2.gz	QTTZRNKFPFLTSJ-WCQYABFASA-N	0	0	285.309	4.009	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC(c2ccccc2F)CC1	ZINC000546634411	334042568	/nfs/dbraw/zinc/04/25/68/334042568.db2.gz	NXMBJJHEVBAKPL-AWEZNQCLSA-N	0	0	289.394	4.134	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cccc(CSC)c1	ZINC000546638336	334042631	/nfs/dbraw/zinc/04/26/31/334042631.db2.gz	DFDCVDDRPZUKHS-LBPRGKRZSA-N	0	0	263.406	4.090	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2ccc(Cl)cc2)no1	ZINC000546639665	334042880	/nfs/dbraw/zinc/04/28/80/334042880.db2.gz	MIALXLWIBCCYGR-SNVBAGLBSA-N	0	0	262.740	4.460	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2ccc(C)c(F)c2)no1	ZINC000546639598	334043031	/nfs/dbraw/zinc/04/30/31/334043031.db2.gz	ZRNAPURPNLCUMN-NSHDSACASA-N	0	0	260.312	4.254	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)CCc1ccc(Cl)cc1	ZINC000133507693	334043148	/nfs/dbraw/zinc/04/31/48/334043148.db2.gz	AEGUJIIIBTZKAI-UHFFFAOYSA-N	0	0	291.822	4.109	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccc(Cl)cc1OCC	ZINC000133656081	334048858	/nfs/dbraw/zinc/04/88/58/334048858.db2.gz	JUHCVTCJJWEVJP-UHFFFAOYSA-N	0	0	296.798	4.169	20	30		CIEDRN
CC(C)c1ccc(C(=O)Nc2ccc(CC#N)cc2)s1	ZINC000546860075	334051904	/nfs/dbraw/zinc/05/19/04/334051904.db2.gz	YFHZKIZSMXOIIE-UHFFFAOYSA-N	0	0	284.384	4.190	20	30		CIEDRN
CC(C)c1ccc(C(=O)N(C)Cc2cccc(C#N)c2)s1	ZINC000546860458	334051961	/nfs/dbraw/zinc/05/19/61/334051961.db2.gz	GZGIGLFLPIUDIY-UHFFFAOYSA-N	0	0	298.411	4.015	20	30		CIEDRN
C=CCC[C@H](NC(=O)c1ccoc1C)c1ccccc1	ZINC000133744185	334052250	/nfs/dbraw/zinc/05/22/50/334052250.db2.gz	YBUMXJIOUYHCRE-INIZCTEOSA-N	0	0	269.344	4.025	20	30		CIEDRN
C=C[C@@H](Cc1nc(-c2ccc(F)cc2)no1)c1ccccc1	ZINC000546956968	334057648	/nfs/dbraw/zinc/05/76/48/334057648.db2.gz	YJTYIULIBIBTID-ZDUSSCGKSA-N	0	0	294.329	4.388	20	30		CIEDRN
Cc1cccc(N(C)Cc2cccc(OCCCC#N)c2)c1	ZINC000546961517	334058032	/nfs/dbraw/zinc/05/80/32/334058032.db2.gz	FZMSZLHMMLCRAX-UHFFFAOYSA-N	0	0	294.398	4.314	20	30		CIEDRN
C=CCCCc1nc(-c2ccccc2OCC(C)C)no1	ZINC000547049751	334063777	/nfs/dbraw/zinc/06/37/77/334063777.db2.gz	RVJQEUAZORYYPO-UHFFFAOYSA-N	0	0	286.375	4.280	20	30		CIEDRN
C=CCC[C@H](NC(=O)C1CCCC1)c1ccccc1	ZINC000133939121	334073840	/nfs/dbraw/zinc/07/38/40/334073840.db2.gz	TZAYUUQAUWWMGT-INIZCTEOSA-N	0	0	257.377	4.000	20	30		CIEDRN
C=CCCCc1nc([C@H]2CCCc3cc(OC)ccc32)no1	ZINC000547232938	334074451	/nfs/dbraw/zinc/07/44/51/334074451.db2.gz	KLUKQTUTTJTCQC-INIZCTEOSA-N	0	0	298.386	4.055	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](C)c1ccccc1OC(C)C	ZINC000547337499	334080823	/nfs/dbraw/zinc/08/08/23/334080823.db2.gz	BZBSFWZUHGVRGE-HUUCEWRRSA-N	0	0	289.419	4.253	20	30		CIEDRN
Cc1cc(NC(=O)N2CCC(C)(C#N)CC2)ccc1C1CC1	ZINC000547520977	334097615	/nfs/dbraw/zinc/09/76/15/334097615.db2.gz	FNHPFWDJAVMRSG-UHFFFAOYSA-N	0	0	297.402	4.030	20	30		CIEDRN
C=CCCCNc1ccc(C(=O)NCC(C)C)c(Cl)c1	ZINC000077245407	334099777	/nfs/dbraw/zinc/09/97/77/334099777.db2.gz	NNIOHJOCVOSSGN-UHFFFAOYSA-N	0	0	294.826	4.104	20	30		CIEDRN
C=C[C@H](CC(=O)NC(C)(CC)CC)c1ccccc1	ZINC000134681901	334100352	/nfs/dbraw/zinc/10/03/52/334100352.db2.gz	NHYCWXUCDMURDZ-CQSZACIVSA-N	0	0	259.393	4.041	20	30		CIEDRN
C=CCCC[C@H](C)N1CCO[C@H](c2ccc(F)cc2F)C1	ZINC000547648058	334105548	/nfs/dbraw/zinc/10/55/48/334105548.db2.gz	SUBCCBZWYDTEMH-GUYCJALGSA-N	0	0	295.373	4.083	20	30		CIEDRN
C=CCC[C@@H](C(=O)NCCCC1CC1)c1ccccc1	ZINC000547651954	334106108	/nfs/dbraw/zinc/10/61/08/334106108.db2.gz	JKSJCJHIFKTVPW-QGZVFWFLSA-N	0	0	271.404	4.043	20	30		CIEDRN
N#Cc1cc(F)ccc1CSc1ncccc1Cl	ZINC000077566121	334108584	/nfs/dbraw/zinc/10/85/84/334108584.db2.gz	TWEGFSQCPWJLGW-UHFFFAOYSA-N	0	0	278.739	4.038	20	30		CIEDRN
Cc1cnc([C@H](C)Nc2cc(C#N)c3ccccc3n2)s1	ZINC000134932807	334108860	/nfs/dbraw/zinc/10/88/60/334108860.db2.gz	JPUYQYGRMKVFHA-NSHDSACASA-N	0	0	294.383	4.045	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1ccc(SC)cn1)c1ccccc1	ZINC000135002680	334111684	/nfs/dbraw/zinc/11/16/84/334111684.db2.gz	KYCKZYQVLQBWLX-CYBMUJFWSA-N	0	0	298.411	4.102	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)NCC2CC(C)(C)C2)cc1	ZINC000547750614	334114358	/nfs/dbraw/zinc/11/43/58/334114358.db2.gz	VRACDPJIWWMQGQ-UHFFFAOYSA-N	0	0	299.418	4.045	20	30		CIEDRN
C=CCCCN(C)C(=O)N[C@H](CC)c1cc(F)ccc1F	ZINC000077857948	334117007	/nfs/dbraw/zinc/11/70/07/334117007.db2.gz	QRXXCNKQWPKOOZ-OAHLLOKOSA-N	0	0	296.361	4.024	20	30		CIEDRN
C=CCCC(=O)Nc1cc(F)ccc1SCC(F)F	ZINC000078189355	334128015	/nfs/dbraw/zinc/12/80/15/334128015.db2.gz	JLEZZCDEZWDBOX-UHFFFAOYSA-N	0	0	289.322	4.088	20	30		CIEDRN
CC(C)CCC[C@@H](C)NC(=O)Nc1ccc(CC#N)cc1	ZINC000078311871	334130557	/nfs/dbraw/zinc/13/05/57/334130557.db2.gz	IXALJBGCPKMRMH-CQSZACIVSA-N	0	0	287.407	4.089	20	30		CIEDRN
CC(C)CC[C@@H](C)Nc1nc(C(F)(F)F)ccc1C#N	ZINC000078834766	334141176	/nfs/dbraw/zinc/14/11/76/334141176.db2.gz	CQUZQYDIYGJJFH-SNVBAGLBSA-N	0	0	285.313	4.209	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)N[C@@H](C)c1ccccc1	ZINC000079029335	334146172	/nfs/dbraw/zinc/14/61/72/334146172.db2.gz	LLIRRMSIIYNGQX-INIZCTEOSA-N	0	0	294.398	4.145	20	30		CIEDRN
C=C(C)CSCc1coc(-c2ccc(OC)cc2)n1	ZINC000079094279	334147798	/nfs/dbraw/zinc/14/77/98/334147798.db2.gz	ALKSMWKSIRMLGI-UHFFFAOYSA-N	0	0	275.373	4.160	20	30		CIEDRN
CCOc1cc(C)ccc1NCc1ccc(C#N)cc1F	ZINC000079180538	334149514	/nfs/dbraw/zinc/14/95/14/334149514.db2.gz	JPZYKLFPWHJONH-UHFFFAOYSA-N	0	0	284.334	4.017	20	30		CIEDRN
Cc1cc(C)cc(NC(=O)c2cccc(SCC#N)c2)c1	ZINC000079381369	334152981	/nfs/dbraw/zinc/15/29/81/334152981.db2.gz	VEUYCYBBSUIZHQ-UHFFFAOYSA-N	0	0	296.395	4.171	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)C[C@H](C)n1cccc1	ZINC000548420907	334155372	/nfs/dbraw/zinc/15/53/72/334155372.db2.gz	XRRIMDYSWLVNTA-KRWDZBQOSA-N	0	0	296.414	4.044	20	30		CIEDRN
C[C@@H](CCC(=O)Nc1ccccc1C#N)c1ccccc1	ZINC000136521725	334156758	/nfs/dbraw/zinc/15/67/58/334156758.db2.gz	LKISFXXCARZBSX-AWEZNQCLSA-N	0	0	278.355	4.081	20	30		CIEDRN
C=CCC[C@@H](C(=O)NCC(C1CC1)C1CC1)c1ccccc1	ZINC000548617796	334163971	/nfs/dbraw/zinc/16/39/71/334163971.db2.gz	PJRIZGCDEOGXDH-GOSISDBHSA-N	0	0	297.442	4.289	20	30		CIEDRN
C[C@@H](CCc1ccccc1F)Nc1ccc(CC#N)cc1	ZINC000136953679	334165873	/nfs/dbraw/zinc/16/58/73/334165873.db2.gz	JJWAKMCTMNYEKC-AWEZNQCLSA-N	0	0	282.362	4.325	20	30		CIEDRN
Cc1ccccc1C[C@@H](C)Nc1ccc(CC#N)cc1	ZINC000136953766	334165993	/nfs/dbraw/zinc/16/59/93/334165993.db2.gz	LLDKYLHYLWSRLE-OAHLLOKOSA-N	0	0	264.372	4.104	20	30		CIEDRN
C[C@H]1CC(=O)c2c1c(F)ccc2Oc1cccc(F)c1C#N	ZINC000548821970	334175458	/nfs/dbraw/zinc/17/54/58/334175458.db2.gz	QMDVKKXKFILGSC-VIFPVBQESA-N	0	0	299.276	4.319	20	30		CIEDRN
CC(C)(CNc1ccc(C#N)c(Cl)c1)C(F)(F)F	ZINC000548873500	334177967	/nfs/dbraw/zinc/17/79/67/334177967.db2.gz	LLZLAPHMNJJBRR-UHFFFAOYSA-N	0	0	276.689	4.212	20	30		CIEDRN
CCC(C)(C)C1CCC(CC(=O)NCC2(C#N)CC2)CC1	ZINC000548921397	334180520	/nfs/dbraw/zinc/18/05/20/334180520.db2.gz	WDWKQSKCFGIAAM-UHFFFAOYSA-N	0	0	290.451	4.039	20	30		CIEDRN
CCC(C)(C)C1CCC(CC(=O)NC(C)(C)C#N)CC1	ZINC000548980299	334181856	/nfs/dbraw/zinc/18/18/56/334181856.db2.gz	VVDRZWKWTGETNG-UHFFFAOYSA-N	0	0	278.440	4.037	20	30		CIEDRN
C=C[C@@H](CC(=O)NCC(C)(C)C(F)(F)F)c1ccccc1	ZINC000549061900	334184257	/nfs/dbraw/zinc/18/42/57/334184257.db2.gz	WURGUQZMGBEQER-LBPRGKRZSA-N	0	0	299.336	4.051	20	30		CIEDRN
C[C@@H](CCC(=O)N(C)c1cccc(C#N)c1)c1ccccc1	ZINC000138042459	334188381	/nfs/dbraw/zinc/18/83/81/334188381.db2.gz	VYRRNOYVQDLCAN-HNNXBMFYSA-N	0	0	292.382	4.105	20	30		CIEDRN
CCc1nc(C)cc(Oc2ccc(C#N)c3ccccc23)n1	ZINC000549296864	334189702	/nfs/dbraw/zinc/18/97/02/334189702.db2.gz	LBBOIERKDFRFRI-UHFFFAOYSA-N	0	0	289.338	4.165	20	30		CIEDRN
C[C@H]1CC[C@H](Sc2nc(C(F)(F)F)ccc2C#N)C1	ZINC000549393278	334192200	/nfs/dbraw/zinc/19/22/00/334192200.db2.gz	LPMRIXDQHLZIJE-WPRPVWTQSA-N	0	0	286.322	4.253	20	30		CIEDRN
Cc1c2ccccc2oc1C(=O)Nc1ccccc1CC#N	ZINC000549692221	334201855	/nfs/dbraw/zinc/20/18/55/334201855.db2.gz	FKCJZFBHQWEHRQ-UHFFFAOYSA-N	0	0	290.322	4.060	20	30		CIEDRN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)CC(C)(C)C1CC1	ZINC000549826725	334206127	/nfs/dbraw/zinc/20/61/27/334206127.db2.gz	PVHPBMOOSHNEFX-UHFFFAOYSA-N	0	0	298.430	4.122	20	30		CIEDRN
C[C@](C#N)(NC(=O)[C@H]1CCCC(C)(C)C1)C1CCCCC1	ZINC000550123338	334213745	/nfs/dbraw/zinc/21/37/45/334213745.db2.gz	WDXBSYNZABZDSU-KBXCAEBGSA-N	0	0	290.451	4.182	20	30		CIEDRN
C[C@@](C#N)(NC(=O)CCCC1CCCC1)C1CCCCC1	ZINC000550350858	334220787	/nfs/dbraw/zinc/22/07/87/334220787.db2.gz	FXGOJAKFQSYJIF-SFHVURJKSA-N	0	0	290.451	4.326	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc2nn(C(C)C)cc2c1	ZINC000550864537	334231055	/nfs/dbraw/zinc/23/10/55/334231055.db2.gz	IQSKVRHJVZZECV-UHFFFAOYSA-N	0	0	285.391	4.158	20	30		CIEDRN
C=CCC(F)(F)c1nc(-c2ccc(OCCC)cc2)no1	ZINC000550968472	334235114	/nfs/dbraw/zinc/23/51/14/334235114.db2.gz	XUEGTTUQQFUHKA-UHFFFAOYSA-N	0	0	294.301	4.193	20	30		CIEDRN
C=CCC(C)(C)c1noc(C(C)(C)c2ccccc2F)n1	ZINC000551134684	334239266	/nfs/dbraw/zinc/23/92/66/334239266.db2.gz	DRSLKMPJQLDDDO-UHFFFAOYSA-N	0	0	288.366	4.388	20	30		CIEDRN
C=CCC(C)(C)c1noc(/C=C/c2ccc([N+](=O)[O-])cc2)n1	ZINC000551142349	334239450	/nfs/dbraw/zinc/23/94/50/334239450.db2.gz	AURQFWLJBCDYAV-JXMROGBWSA-N	0	0	299.330	4.002	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H](CC)Cc1ccc(Cl)cc1	ZINC000551208453	334240835	/nfs/dbraw/zinc/24/08/35/334240835.db2.gz	KPJQWYUUTJPZHC-OAHLLOKOSA-N	0	0	293.838	4.380	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1cccc2ocnc21)c1ccccc1	ZINC000551282934	334244886	/nfs/dbraw/zinc/24/48/86/334244886.db2.gz	VKPZKHPGFDDNID-CYBMUJFWSA-N	0	0	292.338	4.126	20	30		CIEDRN
CC1(C)CCC[C@@H](CC(=O)N(C2CC2)C2(C#N)CCC2)C1	ZINC000551309377	334246280	/nfs/dbraw/zinc/24/62/80/334246280.db2.gz	VIDXTLFQVZNNHB-AWEZNQCLSA-N	0	0	288.435	4.030	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cccc(CSCC)c1	ZINC000551426076	334250117	/nfs/dbraw/zinc/25/01/17/334250117.db2.gz	VLHLISQPDUXNLB-UHFFFAOYSA-N	0	0	277.433	4.481	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ccc(C)c(C(C)=O)c2)n1	ZINC000551491760	334251495	/nfs/dbraw/zinc/25/14/95/334251495.db2.gz	HNULXUSMEXEOLI-UHFFFAOYSA-N	0	0	284.359	4.101	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H](C)c2ccc(F)c(F)c2)n1	ZINC000551493720	334251496	/nfs/dbraw/zinc/25/14/96/334251496.db2.gz	KAYBQEGVDMXRMT-JTQLQIEISA-N	0	0	292.329	4.353	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cc3ccccc3[nH]2)n1	ZINC000551489709	334251546	/nfs/dbraw/zinc/25/15/46/334251546.db2.gz	FEHDKIYFZKHBCO-UHFFFAOYSA-N	0	0	267.332	4.072	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H]2C[C@@H]2c2cccc(OC)c2)n1	ZINC000551493513	334251564	/nfs/dbraw/zinc/25/15/64/334251564.db2.gz	YWGXJSSFUHEVGG-HUUCEWRRSA-N	0	0	298.386	4.203	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2oc(CC)cc2C)n1	ZINC000551492151	334251570	/nfs/dbraw/zinc/25/15/70/334251570.db2.gz	NVSJZPRLPFXYCH-UHFFFAOYSA-N	0	0	260.337	4.054	20	30		CIEDRN
C=CCC(C)(C)c1noc(COc2ccc(C)cc2C)n1	ZINC000551493874	334251586	/nfs/dbraw/zinc/25/15/86/334251586.db2.gz	MMJDQTZERXTFLG-UHFFFAOYSA-N	0	0	286.375	4.119	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cccc(F)c2Cl)n1	ZINC000551493650	334251602	/nfs/dbraw/zinc/25/16/02/334251602.db2.gz	HTVJEXXQZQHJPW-UHFFFAOYSA-N	0	0	280.730	4.383	20	30		CIEDRN
C=CCC(C)(C)c1noc(/C=C(\C)c2ccc(OC)cc2)n1	ZINC000551493946	334251718	/nfs/dbraw/zinc/25/17/18/334251718.db2.gz	OWZAFYJFVWUKEK-OUKQBFOZSA-N	0	0	298.386	4.492	20	30		CIEDRN
CC(C)CN(C(=O)[C@@H]1CC=CC[C@H]1C)c1ccc(C#N)cc1	ZINC000551512881	334252032	/nfs/dbraw/zinc/25/20/32/334252032.db2.gz	MACAXNQZBOBWBO-CRAIPNDOSA-N	0	0	296.414	4.150	20	30		CIEDRN
C=CCNC(=O)N(CC(C)C)[C@H](C)c1ccccc1Cl	ZINC000551587916	334255398	/nfs/dbraw/zinc/25/53/98/334255398.db2.gz	JXVIWBGYDXOQLG-CYBMUJFWSA-N	0	0	294.826	4.255	20	30		CIEDRN
Cc1cc(OCc2ccc(Cl)cn2)c(C)c(C)c1C#N	ZINC000551932649	334266656	/nfs/dbraw/zinc/26/66/56/334266656.db2.gz	TUEYLZCDOPGDSA-UHFFFAOYSA-N	0	0	286.762	4.111	20	30		CIEDRN
N#Cc1csc(C(=O)Nc2cc(Cl)ccc2Cl)c1	ZINC000084057827	334269590	/nfs/dbraw/zinc/26/95/90/334269590.db2.gz	PVQCHOUHCYEISH-UHFFFAOYSA-N	0	0	297.166	4.179	20	30		CIEDRN
N#Cc1csc(CN2CC3(CCC3)[C@H]2c2ccccc2)c1	ZINC000552316582	334316063	/nfs/dbraw/zinc/31/60/63/334316063.db2.gz	GCUSENWKXYOSKM-QGZVFWFLSA-N	0	0	294.423	4.347	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1C[C@H](c2ccccc2C)C[C@H]1C	ZINC000249032053	334325042	/nfs/dbraw/zinc/32/50/42/334325042.db2.gz	BKCNCMGWIUFQEM-GPMSIDNRSA-N	0	0	285.431	4.302	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1C[C@@H](c2ccc(F)cc2)C[C@H]1C	ZINC000249093313	334327290	/nfs/dbraw/zinc/32/72/90/334327290.db2.gz	NTXCCYXVYGFTSW-QIIPPGSGSA-N	0	0	289.394	4.132	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1C[C@H](c2ccc(F)cc2)C[C@H]1C	ZINC000249093310	334327291	/nfs/dbraw/zinc/32/72/91/334327291.db2.gz	NTXCCYXVYGFTSW-DDUZABMNSA-N	0	0	289.394	4.132	20	30		CIEDRN
C=CCN(C(=O)Nc1ccc(C(C)(C)C)cc1)C1CC1	ZINC000552481068	334330422	/nfs/dbraw/zinc/33/04/22/334330422.db2.gz	QODAPMYIFLAIQC-UHFFFAOYSA-N	0	0	272.392	4.166	20	30		CIEDRN
C=CCn1c(SC[C@@H](C)CC)nnc1-c1ccoc1C	ZINC000088492520	334339096	/nfs/dbraw/zinc/33/90/96/334339096.db2.gz	WJYNPOMSYHLIHT-NSHDSACASA-N	0	0	291.420	4.171	20	30		CIEDRN
C=CCNc1ccc(Oc2ccc(Cl)cn2)cc1	ZINC000089116883	334342893	/nfs/dbraw/zinc/34/28/93/334342893.db2.gz	QLZTVWXNPQWZJB-UHFFFAOYSA-N	0	0	260.724	4.125	20	30		CIEDRN
CC(C)(C)CCCCC(=O)N[C@H](C#N)c1ccc(F)cc1	ZINC000552777679	334344531	/nfs/dbraw/zinc/34/45/31/334344531.db2.gz	OQGFRQCFQFTMPG-OAHLLOKOSA-N	0	0	290.382	4.113	20	30		CIEDRN
Cc1ccc(C#N)c(N[C@@H](c2ccccc2C)C2CC2)n1	ZINC000553047757	334358513	/nfs/dbraw/zinc/35/85/13/334358513.db2.gz	QRALSTLIZHNODZ-QGZVFWFLSA-N	0	0	277.371	4.133	20	30		CIEDRN
Cc1nsc(N[C@H]2CCC[C@@H]2c2ccccc2)c1C#N	ZINC000553058648	334359226	/nfs/dbraw/zinc/35/92/26/334359226.db2.gz	HWRGRZHLRVVMQX-HIFRSBDPSA-N	0	0	283.400	4.071	20	30		CIEDRN
Cc1nnc(S[C@H]2CCCc3ccccc32)c(C#N)c1C	ZINC000553108458	334361931	/nfs/dbraw/zinc/36/19/31/334361931.db2.gz	LBYBLVQFLPARCE-INIZCTEOSA-N	0	0	295.411	4.135	20	30		CIEDRN
C=CCCCC(=O)N([C@@H](C)c1ccccc1)C1CC1	ZINC000553142351	334364509	/nfs/dbraw/zinc/36/45/09/334364509.db2.gz	YCPRRBVUVLYDKT-AWEZNQCLSA-N	0	0	257.377	4.095	20	30		CIEDRN
Cc1cccnc1S[C@H](C)c1ccc(C#N)cc1	ZINC000553498855	334388871	/nfs/dbraw/zinc/38/88/71/334388871.db2.gz	WBJUUAPWBWAULN-GFCCVEGCSA-N	0	0	254.358	4.115	20	30		CIEDRN
CSc1cccc(F)c1CNc1ccc(C#N)cc1F	ZINC000553580349	334392494	/nfs/dbraw/zinc/39/24/94/334392494.db2.gz	LVJMUBQIGSVKIF-UHFFFAOYSA-N	0	0	290.338	4.170	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1ccccc1OC(F)F	ZINC000553608504	334393285	/nfs/dbraw/zinc/39/32/85/334393285.db2.gz	YHSOQQDYSIRBHN-LLVKDONJSA-N	0	0	298.333	4.154	20	30		CIEDRN
C=CC[C@H](C(=O)NC(C1CCC1)C1CCC1)c1ccccc1	ZINC000553628538	334393930	/nfs/dbraw/zinc/39/39/30/334393930.db2.gz	BUGBWBQTISYEKV-SFHVURJKSA-N	0	0	297.442	4.431	20	30		CIEDRN
C=CCOCCCC(=O)Nc1cccc(-c2ccccc2)c1	ZINC000553662574	334394780	/nfs/dbraw/zinc/39/47/80/334394780.db2.gz	TUTKMOWSQWHXPT-UHFFFAOYSA-N	0	0	295.382	4.275	20	30		CIEDRN
C=CCCCCNC(=O)N1C[C@H](C)C[C@H]1c1ccccc1	ZINC000553720143	334396636	/nfs/dbraw/zinc/39/66/36/334396636.db2.gz	QPKLPVNZZNSFHG-WBVHZDCISA-N	0	0	286.419	4.135	20	30		CIEDRN
N#CCC[C@H](C#N)CNc1cccc(-c2ccccc2)c1	ZINC000554406960	334428885	/nfs/dbraw/zinc/42/88/85/334428885.db2.gz	QAQPSWCKIKBSSB-OAHLLOKOSA-N	0	0	275.355	4.209	20	30		CIEDRN
C=CCn1c(C)nnc1SC[C@@H](C)C1CCCCC1	ZINC000554970985	334462735	/nfs/dbraw/zinc/46/27/35/334462735.db2.gz	COWVECWOYROBAJ-GFCCVEGCSA-N	0	0	279.453	4.081	20	30		CIEDRN
CCOCc1cccc(N[C@H]2CCc3ccc(C#N)cc32)c1	ZINC000554998831	334464229	/nfs/dbraw/zinc/46/42/29/334464229.db2.gz	WLUIGKLCQKTZCO-IBGZPJMESA-N	0	0	292.382	4.194	20	30		CIEDRN
N#CCCOCCSc1ccc(-c2ccccc2)cc1	ZINC000555014711	334465194	/nfs/dbraw/zinc/46/51/94/334465194.db2.gz	KWOLECFMXARNHW-UHFFFAOYSA-N	0	0	283.396	4.376	20	30		CIEDRN
C=CCOCCS[C@H](C)c1ccccc1Cl	ZINC000555014810	334465356	/nfs/dbraw/zinc/46/53/56/334465356.db2.gz	NCHGBFXUFOWPEQ-LLVKDONJSA-N	0	0	256.798	4.337	20	30		CIEDRN
N#Cc1cccc(Oc2ccc(C3CC3)cc2Cl)n1	ZINC000555139653	334469656	/nfs/dbraw/zinc/46/96/56/334469656.db2.gz	LDWZLVHVWCMAFG-UHFFFAOYSA-N	0	0	270.719	4.276	20	30		CIEDRN
C=CCCS[C@H](C)C(=O)N[C@H](C)c1ccc(Cl)cc1	ZINC000555428372	334478740	/nfs/dbraw/zinc/47/87/40/334478740.db2.gz	WKZWSOWDIWRYMA-VXGBXAGGSA-N	0	0	297.851	4.215	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)N(CC(C)C)c1ccccc1)OCC	ZINC000555586759	334483188	/nfs/dbraw/zinc/48/31/88/334483188.db2.gz	AQMZSCRCSPEKGD-QGZVFWFLSA-N	0	0	289.419	4.047	20	30		CIEDRN
Cc1ccc(Cl)cc1N(C)CCCC(C)(C)C#N	ZINC000555681222	334486941	/nfs/dbraw/zinc/48/69/41/334486941.db2.gz	XQEINFXPJPQAEJ-UHFFFAOYSA-N	0	0	264.800	4.415	20	30		CIEDRN
Cc1cccc([C@H](C)C(=O)N[C@@](C)(C#N)C2CCCCC2)c1	ZINC000555902372	334491634	/nfs/dbraw/zinc/49/16/34/334491634.db2.gz	DRWNJCBMBXDWML-KXBFYZLASA-N	0	0	298.430	4.077	20	30		CIEDRN
N#Cc1ccc(/C=C\c2cnc(-c3cccs3)s2)nc1	ZINC000254943465	334495309	/nfs/dbraw/zinc/49/53/09/334495309.db2.gz	SLELLILMJLDFFG-WAYWQWQTSA-N	0	0	295.392	4.309	20	30		CIEDRN
C=CCCCCCN(C)C(=O)C(C)(C)C(C)(C)C	ZINC000556289972	334505752	/nfs/dbraw/zinc/50/57/52/334505752.db2.gz	CQRZXARCESTSGK-UHFFFAOYSA-N	0	0	253.430	4.264	20	30		CIEDRN
C=CCCCN(C)C(=O)c1cncc(-c2cccc(C)c2)c1	ZINC000152687884	334507895	/nfs/dbraw/zinc/50/78/95/334507895.db2.gz	OHTACKSQOWXPQT-UHFFFAOYSA-N	0	0	294.398	4.095	20	30		CIEDRN
Cc1ccnc(N[C@H](c2ccc(F)c(C)c2)C2CC2)c1C#N	ZINC000564488271	334509501	/nfs/dbraw/zinc/50/95/01/334509501.db2.gz	QENRATBJYRFACO-KRWDZBQOSA-N	0	0	295.361	4.272	20	30		CIEDRN
CCOc1ccc(C#N)cc1NC(=O)[C@H]1CCC(C)=C(C)C1	ZINC000565006006	334534241	/nfs/dbraw/zinc/53/42/41/334534241.db2.gz	WXBIVRUMHZYENO-HNNXBMFYSA-N	0	0	298.386	4.032	20	30		CIEDRN
C=C(C)CCc1noc([C@H]2C[C@@H]2c2ccc(F)cc2F)n1	ZINC000565389673	334558763	/nfs/dbraw/zinc/55/87/63/334558763.db2.gz	FZUPLJRNILNVNV-OLZOCXBDSA-N	0	0	290.313	4.128	20	30		CIEDRN
C=C(C)CCc1noc(-c2ccccc2OC(C)C)n1	ZINC000565507501	334569483	/nfs/dbraw/zinc/56/94/83/334569483.db2.gz	YSCXSYRQQYQLID-UHFFFAOYSA-N	0	0	272.348	4.033	20	30		CIEDRN
N#Cc1ccnc(N[C@@H](Cc2ccccc2)c2ccccc2)c1	ZINC000565615652	334580248	/nfs/dbraw/zinc/58/02/48/334580248.db2.gz	MQWOVGUJTVSCHB-IBGZPJMESA-N	0	0	299.377	4.349	20	30		CIEDRN
N#Cc1ccc2c(c1)[C@H](Nc1ccc3scnc3c1)CC2	ZINC000565745397	334593394	/nfs/dbraw/zinc/59/33/94/334593394.db2.gz	JEOMAXHXDVOCIM-OAHLLOKOSA-N	0	0	291.379	4.267	20	30		CIEDRN
C[C@H](CC(=O)N[C@@](C)(C#N)C1CCCCC1)c1ccccc1	ZINC000565911449	334608286	/nfs/dbraw/zinc/60/82/86/334608286.db2.gz	IXRQGJBUKIRSOE-BEFAXECRSA-N	0	0	298.430	4.159	20	30		CIEDRN
C=CCN(CC=C)C(=O)Nc1ccc(CCC(C)C)cc1	ZINC000565969399	334613296	/nfs/dbraw/zinc/61/32/96/334613296.db2.gz	VLVRWAGSCHDNSY-UHFFFAOYSA-N	0	0	286.419	4.481	20	30		CIEDRN
Cc1csc(NC(=O)c2ccc(C(C)C)s2)c1C#N	ZINC000566643547	334658777	/nfs/dbraw/zinc/65/87/77/334658777.db2.gz	FLMRPTHCPOXTJI-UHFFFAOYSA-N	0	0	290.413	4.365	20	30		CIEDRN
CC[C@@H](CC#N)NCc1ccc([C@@H](C)C(F)(F)F)cc1	ZINC000566863964	334667498	/nfs/dbraw/zinc/66/74/98/334667498.db2.gz	NXIGPBNLIFLUNZ-RISCZKNCSA-N	0	0	284.325	4.134	20	30		CIEDRN
C=CCc1ccc(OC[C@@H](OC)c2ccccc2)c(OC)c1	ZINC000566927783	334669836	/nfs/dbraw/zinc/66/98/36/334669836.db2.gz	QBUBPXSGPIEWME-LJQANCHMSA-N	0	0	298.382	4.190	20	30		CIEDRN
C[C@@H](CSc1ccc(C#N)c([N+](=O)[O-])c1)c1ccccc1	ZINC000566947298	334670573	/nfs/dbraw/zinc/67/05/73/334670573.db2.gz	MMEKXBFFILKNIT-LBPRGKRZSA-N	0	0	298.367	4.362	20	30		CIEDRN
CC(C)Oc1ccc(F)cc1NCCCC(C)(C)C#N	ZINC000153775233	334679377	/nfs/dbraw/zinc/67/93/77/334679377.db2.gz	CWSVVRYBBSAYCO-UHFFFAOYSA-N	0	0	278.371	4.355	20	30		CIEDRN
N#CCCC1CCN(c2ccnc3cc(Cl)ccc32)CC1	ZINC000567107266	334681672	/nfs/dbraw/zinc/68/16/72/334681672.db2.gz	VQMYAWMYMYCDRC-UHFFFAOYSA-N	0	0	299.805	4.408	20	30		CIEDRN
C=CC1CCN(C(=O)c2ccc(C(C)(C)C)s2)CC1	ZINC000153966565	334684400	/nfs/dbraw/zinc/68/44/00/334684400.db2.gz	WGBGNDJUTPKBGM-UHFFFAOYSA-N	0	0	277.433	4.084	20	30		CIEDRN
CCc1ccc([C@@H]2C[C@H](C)CCN2c2ccnc(C#N)c2)o1	ZINC000567188458	334688870	/nfs/dbraw/zinc/68/88/70/334688870.db2.gz	SFYFLHJOCCCXML-DYVFJYSZSA-N	0	0	295.386	4.086	20	30		CIEDRN
CC[C@@](C)(C#N)NC(=O)C[C@@H]1C[C@@H](C(C)C)c2ccccc21	ZINC000567538286	334730064	/nfs/dbraw/zinc/73/00/64/334730064.db2.gz	DYTJGGVDTKBDRK-FNHZYXHNSA-N	0	0	298.430	4.112	20	30		CIEDRN
N#CCN(Cc1c(Cl)ccc2cccnc21)C1CCCC1	ZINC000156599349	334744942	/nfs/dbraw/zinc/74/49/42/334744942.db2.gz	CPQXSULVKIAQHT-UHFFFAOYSA-N	0	0	299.805	4.156	20	30		CIEDRN
CC1=C(C)C[C@@H](C(=O)N[C@](C)(C#N)C2CCCCC2)CC1	ZINC000567737614	334757018	/nfs/dbraw/zinc/75/70/18/334757018.db2.gz	SUWSLPZKBLVRCQ-MAUKXSAKSA-N	0	0	288.435	4.102	20	30		CIEDRN
CC[C@@H](C)CNc1ccccc1SC[C@@H](C)C#N	ZINC000157817134	334784749	/nfs/dbraw/zinc/78/47/49/334784749.db2.gz	DWGHIEIVRCOLOQ-OLZOCXBDSA-N	0	0	262.422	4.396	20	30		CIEDRN
C=CCCC(=O)NC[C@@H](c1ccc(Cl)cc1)C(C)C	ZINC000568065495	334789229	/nfs/dbraw/zinc/78/92/29/334789229.db2.gz	TXFNZADFWWDNID-OAHLLOKOSA-N	0	0	279.811	4.162	20	30		CIEDRN
C[C@@H](SCc1nc2ccccc2[nH]1)c1ccc(C#N)cc1	ZINC000568440917	334825005	/nfs/dbraw/zinc/82/50/05/334825005.db2.gz	UFCXUWZKERPASX-GFCCVEGCSA-N	0	0	293.395	4.429	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(-c2cccc(C)c2F)no1	ZINC000568446420	334825149	/nfs/dbraw/zinc/82/51/49/334825149.db2.gz	KZLMYXVRTXECFE-OAHLLOKOSA-N	0	0	260.312	4.038	20	30		CIEDRN
Cc1ccc(C(=O)CSc2cccc(F)c2C#N)cc1C	ZINC000568468295	334826208	/nfs/dbraw/zinc/82/62/08/334826208.db2.gz	NSOVNTDFYHXLJJ-UHFFFAOYSA-N	0	0	299.370	4.289	20	30		CIEDRN
C=CCCC1(c2nc([C@@H]3C[C@H]3c3ccccc3)no2)CC1	ZINC000569033921	334852479	/nfs/dbraw/zinc/85/24/79/334852479.db2.gz	AWVNDHZLWQGJGV-LSDHHAIUSA-N	0	0	280.371	4.339	20	30		CIEDRN
N#C[C@@]1(C(=O)Nc2ccc(F)c(C3CC3)c2)CC12CCCC2	ZINC000569316333	334866591	/nfs/dbraw/zinc/86/65/91/334866591.db2.gz	LWWIWXOPFDXFRG-GOSISDBHSA-N	0	0	298.361	4.116	20	30		CIEDRN
N#Cc1c(N[C@@H]2CCOC3(CCC3)C2)cccc1C(F)F	ZINC000572736517	334875074	/nfs/dbraw/zinc/87/50/74/334875074.db2.gz	ZNRZKLUTFAGIEB-LLVKDONJSA-N	0	0	292.329	4.009	20	30		CIEDRN
N#Cc1cnccc1Sc1nc(-c2ccccc2)cs1	ZINC000572812959	334880517	/nfs/dbraw/zinc/88/05/17/334880517.db2.gz	JXXRWTUEMCWPEC-UHFFFAOYSA-N	0	0	295.392	4.228	20	30		CIEDRN
C=CCCCNc1ccc(Oc2ccnc(C#N)c2)cc1	ZINC000573146536	334912871	/nfs/dbraw/zinc/91/28/71/334912871.db2.gz	JFZIPPPPAMAVRY-UHFFFAOYSA-N	0	0	279.343	4.124	20	30		CIEDRN
CCN(Cc1ccc(C)cc1)Cc1cccc(F)c1C#N	ZINC000576331540	335190467	/nfs/dbraw/zinc/19/04/67/335190467.db2.gz	YILJOPSNSOIDKL-UHFFFAOYSA-N	0	0	282.362	4.028	20	30		CIEDRN
CC(C)(C#N)CCSC[C@H]1CCc2ccccc2C1	ZINC000576665436	335232471	/nfs/dbraw/zinc/23/24/71/335232471.db2.gz	RECDPVDQXXSBJO-AWEZNQCLSA-N	0	0	273.445	4.465	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCCc1ccc(C(C)C)cc1	ZINC000576807837	335249680	/nfs/dbraw/zinc/24/96/80/335249680.db2.gz	RAVXMUZOXGHKKX-UHFFFAOYSA-N	0	0	273.420	4.071	20	30		CIEDRN
CC[C@@H](CC#N)NCc1ccc(-c2ccsc2)cc1	ZINC000576835611	335253780	/nfs/dbraw/zinc/25/37/80/335253780.db2.gz	HUOHBPFJIHUGDM-INIZCTEOSA-N	0	0	270.401	4.197	20	30		CIEDRN
C=C(C)CCc1noc([C@@H]2CC[C@H](C(F)(F)F)C2)n1	ZINC000577025788	335283786	/nfs/dbraw/zinc/28/37/86/335283786.db2.gz	SVLLVNWMHDZTAI-ZJUUUORDSA-N	0	0	274.286	4.024	20	30		CIEDRN
N#Cc1cc(NC(=O)CC2CCCCC2)nc2ccccc12	ZINC000577101111	335300200	/nfs/dbraw/zinc/30/02/00/335300200.db2.gz	WWOPCLMOZVEOKC-UHFFFAOYSA-N	0	0	293.370	4.015	20	30		CIEDRN
C[C@@H](CCC(C)(C)C)Nc1ccc([N+](=O)[O-])cc1C#N	ZINC000380127148	335327691	/nfs/dbraw/zinc/32/76/91/335327691.db2.gz	SAOBWGYOVSHSMZ-NSHDSACASA-N	0	0	275.352	4.093	20	30		CIEDRN
CC#CCCCc1nc(C2(OCCC)CCCCC2)no1	ZINC000577324049	335338798	/nfs/dbraw/zinc/33/87/98/335338798.db2.gz	HLVJGNFCLMZCDU-UHFFFAOYSA-N	0	0	290.407	4.002	20	30		CIEDRN
N#Cc1cnccc1/C=C\c1ccc(C(F)F)cc1	ZINC000577397819	335348172	/nfs/dbraw/zinc/34/81/72/335348172.db2.gz	HKTMKNDPWCCDOP-RJRFIUFISA-N	0	0	256.255	4.061	20	30		CIEDRN
CC[C@@H](CC1CCCCC1)C(=O)NCC(C)(C)CCC#N	ZINC000577650890	335386166	/nfs/dbraw/zinc/38/61/66/335386166.db2.gz	MFNNQKIBBGGKSA-INIZCTEOSA-N	0	0	292.467	4.429	20	30		CIEDRN
CCCCCNc1ccc(Oc2ccnc(C#N)c2)cc1	ZINC000577670548	335387473	/nfs/dbraw/zinc/38/74/73/335387473.db2.gz	UUZJJERWASLEAV-UHFFFAOYSA-N	0	0	281.359	4.348	20	30		CIEDRN
CC[C@H](NCc1ccccc1C#N)c1cc(F)ccc1F	ZINC000179093148	335473110	/nfs/dbraw/zinc/47/31/10/335473110.db2.gz	DYSPHNXPRKBVAM-KRWDZBQOSA-N	0	0	286.325	4.077	20	30		CIEDRN
Cc1cc(C)c(C(=O)Nc2cccc(C#N)c2C)c(C)c1	ZINC000179283704	335485602	/nfs/dbraw/zinc/48/56/02/335485602.db2.gz	CHVOTVAYERFQEC-UHFFFAOYSA-N	0	0	278.355	4.044	20	30		CIEDRN
C=C[C@H](CC(=O)NCC1(C2CC2)CCC1)c1ccccc1	ZINC000179511344	335498069	/nfs/dbraw/zinc/49/80/69/335498069.db2.gz	FIUYWJBWGSGELL-OAHLLOKOSA-N	0	0	283.415	4.043	20	30		CIEDRN
CCN(C(=O)[C@H]1C[C@@]1(C)CC)c1ccc(C#N)c(Cl)c1	ZINC000179526339	335498816	/nfs/dbraw/zinc/49/88/16/335498816.db2.gz	TWOKWDWHTFTGAH-CZUORRHYSA-N	0	0	290.794	4.001	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)Nc1cccc(C)c1F	ZINC000179974857	335537580	/nfs/dbraw/zinc/53/75/80/335537580.db2.gz	XNEDKTZEECLAMI-UHFFFAOYSA-N	0	0	298.361	4.354	20	30		CIEDRN
C=CCC[C@@H](NCc1nc(C(C)(C)C)no1)c1ccccc1	ZINC000180047369	335544902	/nfs/dbraw/zinc/54/49/02/335544902.db2.gz	XVKDJNYNFVZAJQ-OAHLLOKOSA-N	0	0	299.418	4.164	20	30		CIEDRN
C[C@H]1CC[C@H](C(=O)N[C@H](CCCC#N)c2ccccc2)CC1	ZINC000578240567	335590893	/nfs/dbraw/zinc/59/08/93/335590893.db2.gz	YBOMSXGQGCCKLC-KBAYOESNSA-N	0	0	298.430	4.364	20	30		CIEDRN
N#Cc1c(NCc2cc(F)cc(F)c2)cccc1C(F)F	ZINC000578405906	335628326	/nfs/dbraw/zinc/62/83/26/335628326.db2.gz	XOBRLTMTJAENNL-UHFFFAOYSA-N	0	0	294.251	4.386	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N[C@H](CCC#N)c1ccccc1	ZINC000180970744	335631590	/nfs/dbraw/zinc/63/15/90/335631590.db2.gz	DBZBNBKEVQQQIU-NVXWUHKLSA-N	0	0	299.418	4.075	20	30		CIEDRN
C=CCCCCCNC(=O)c1cccc(F)c1SC	ZINC000578518949	335644121	/nfs/dbraw/zinc/64/41/21/335644121.db2.gz	JAVRYCVYCQSYPS-UHFFFAOYSA-N	0	0	281.396	4.024	20	30		CIEDRN
CCc1ccc(NC(=O)c2cccc(CC#N)c2)cc1Cl	ZINC000579100869	335708795	/nfs/dbraw/zinc/70/87/95/335708795.db2.gz	GOXRWLAWHIPSAD-UHFFFAOYSA-N	0	0	298.773	4.221	20	30		CIEDRN
Cc1nsc(S[C@H]2CCCc3ccccc32)c1C#N	ZINC000579278893	335730841	/nfs/dbraw/zinc/73/08/41/335730841.db2.gz	MJIYLHCQRHOBGQ-AWEZNQCLSA-N	0	0	286.425	4.493	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N(Cc1cccs1)C1CC1	ZINC000181095707	335750253	/nfs/dbraw/zinc/75/02/53/335750253.db2.gz	ARZPJILJESTJCX-CYBMUJFWSA-N	0	0	292.448	4.167	20	30		CIEDRN
C[C@H]1c2c(C#N)c(NC(=O)CC3CC3)sc2CC[C@@H]1C	ZINC000579684225	335862945	/nfs/dbraw/zinc/86/29/45/335862945.db2.gz	VFTXVPRZZNUPFH-VHSXEESVSA-N	0	0	288.416	4.044	20	30		CIEDRN
C[C@@H]1CCc2sc(NC(=O)CC3CC3)c(C#N)c2[C@H]1C	ZINC000579684226	335862979	/nfs/dbraw/zinc/86/29/79/335862979.db2.gz	VFTXVPRZZNUPFH-ZJUUUORDSA-N	0	0	288.416	4.044	20	30		CIEDRN
CCc1cc(N[C@H](CCCC#N)c2ccccc2)nc(C)n1	ZINC000579788777	335883759	/nfs/dbraw/zinc/88/37/59/335883759.db2.gz	LBLWZOCDCMIVSX-QGZVFWFLSA-N	0	0	294.402	4.195	20	30		CIEDRN
C=CCCCCCNc1ccc(Cl)c(C(=O)N(C)C)c1	ZINC000579795593	335885442	/nfs/dbraw/zinc/88/54/42/335885442.db2.gz	GGSXJEOTGLFFKJ-UHFFFAOYSA-N	0	0	294.826	4.200	20	30		CIEDRN
C=C[C@H](CC(=O)N1C[C@H](C)[C@H]2CCCC[C@H]21)c1ccccc1	ZINC000183760303	335904813	/nfs/dbraw/zinc/90/48/13/335904813.db2.gz	KJXTYVOYKCHCPS-QFHJOOASSA-N	0	0	297.442	4.383	20	30		CIEDRN
C[C@@H](C#N)CNCc1ccc(-c2ccc(Cl)cc2)s1	ZINC000183828031	335908443	/nfs/dbraw/zinc/90/84/43/335908443.db2.gz	YHOJBNNOPKABPK-NSHDSACASA-N	0	0	290.819	4.318	20	30		CIEDRN
CC(C)OCc1ccc(NCc2ccc(C#N)cc2)cc1	ZINC000193697436	335984006	/nfs/dbraw/zinc/98/40/06/335984006.db2.gz	ZUAVPFJUTIGKDE-UHFFFAOYSA-N	0	0	280.371	4.095	20	30		CIEDRN
Cn1c2ccc(Cl)cc2nc1SCC(C)(C)CC#N	ZINC000581082127	336006309	/nfs/dbraw/zinc/00/63/09/336006309.db2.gz	HUZASPHKYCZWSM-UHFFFAOYSA-N	0	0	293.823	4.259	20	30		CIEDRN
N#Cc1ccc(NC[C@@H]2CCCC2(F)F)cc1Cl	ZINC000381480086	336066297	/nfs/dbraw/zinc/06/62/97/336066297.db2.gz	FGUHXUBLMAJDKV-JTQLQIEISA-N	0	0	270.710	4.059	20	30		CIEDRN
Cc1cc(OC[C@H]2CCCC2(F)F)c(C)c(C)c1C#N	ZINC000382078002	336081374	/nfs/dbraw/zinc/08/13/74/336081374.db2.gz	HTJZPFPHMAWUKY-CYBMUJFWSA-N	0	0	279.330	4.298	20	30		CIEDRN
CCOc1cc(C#N)ccc1OC[C@H]1CCCCC1(F)F	ZINC000382251748	336084918	/nfs/dbraw/zinc/08/49/18/336084918.db2.gz	XFPGBFVCMLBAHA-CYBMUJFWSA-N	0	0	295.329	4.161	20	30		CIEDRN
N#Cc1ccc(OC[C@H]2CCCCC2(F)F)cc1Cl	ZINC000382244156	336084978	/nfs/dbraw/zinc/08/49/78/336084978.db2.gz	WMCKHNGRUPOJGD-LLVKDONJSA-N	0	0	285.721	4.416	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(Cc2cc(C)cc(C)c2)no1	ZINC000581632674	336115013	/nfs/dbraw/zinc/11/50/13/336115013.db2.gz	FCGPXEWNGUTZFP-KRWDZBQOSA-N	0	0	270.376	4.131	20	30		CIEDRN
N#Cc1ccc(OCc2cnc3ccccc3c2)c(Cl)c1	ZINC000384745371	336130202	/nfs/dbraw/zinc/13/02/02/336130202.db2.gz	BKIZRHRXOZPRGC-UHFFFAOYSA-N	0	0	294.741	4.339	20	30		CIEDRN
Cc1cc(C#N)ccc1-c1nc([C@H]2CCCC[C@@H]2C)no1	ZINC000384959276	336135127	/nfs/dbraw/zinc/13/51/27/336135127.db2.gz	HCPCIUOILVOGFC-FZMZJTMJSA-N	0	0	281.359	4.210	20	30		CIEDRN
CN(C(=O)c1ccc(C(C)(C)C)cc1)c1ccc(C#N)cc1	ZINC000387257044	336190623	/nfs/dbraw/zinc/19/06/23/336190623.db2.gz	FUOMGDSHJGHEPF-UHFFFAOYSA-N	0	0	292.382	4.132	20	30		CIEDRN
C[C@H](Nc1nccc2ccc(F)cc21)c1ccc(C#N)cc1	ZINC000354556303	534032616	/nfs/dbraw/zinc/03/26/16/534032616.db2.gz	CFKXYICEIOCHAQ-LBPRGKRZSA-N	0	0	291.329	4.419	20	30		CIEDRN
Cc1ccc(-c2ccc(C)c(NC(=O)C3(C#N)CCC3)c2)o1	ZINC000336623710	534185698	/nfs/dbraw/zinc/18/56/98/534185698.db2.gz	GZFFGEDRRAILLO-UHFFFAOYSA-N	0	0	294.354	4.196	20	30		CIEDRN
Cc1ccc(-c2noc(C3(C#N)CCCC3)n2)cc1Cl	ZINC000331649844	534230567	/nfs/dbraw/zinc/23/05/67/534230567.db2.gz	ZBZMSDCAWYXSOH-UHFFFAOYSA-N	0	0	287.750	4.034	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)CCC1CCCCC1	ZINC000467826835	517322748	/nfs/dbraw/zinc/32/27/48/517322748.db2.gz	ZLRKEGJGNCPTBR-UHFFFAOYSA-N	0	0	263.425	4.184	20	30		CIEDRN
CC[C@@H](C)CC(=O)Nc1cc(C(C)(C)C)sc1C#N	ZINC000485732347	517754495	/nfs/dbraw/zinc/75/44/95/517754495.db2.gz	POONRXKIONVGOS-SNVBAGLBSA-N	0	0	278.421	4.292	20	30		CIEDRN
C#CCCCCC(=O)Nc1cc(C(=O)CC)ccc1Cl	ZINC000279638372	518247690	/nfs/dbraw/zinc/24/76/90/518247690.db2.gz	IMWIMMDYJSVSSY-UHFFFAOYSA-N	0	0	291.778	4.065	20	30		CIEDRN
C=CCCCC(=O)Nc1cc(C(=O)CC)ccc1Cl	ZINC000279654847	518698048	/nfs/dbraw/zinc/69/80/48/518698048.db2.gz	JYYUBIPCFUUKIF-UHFFFAOYSA-N	0	0	279.767	4.228	20	30		CIEDRN
CC(C)(C)Nc1ccccc1NCc1ccc(C#N)cc1	ZINC000277606135	518771833	/nfs/dbraw/zinc/77/18/33/518771833.db2.gz	XMZBRVRZSNRCGV-UHFFFAOYSA-N	0	0	279.387	4.381	20	30		CIEDRN
Cc1noc(C2CC2)c1NC(=O)c1sccc1Cl	ZINC000329090086	534386622	/nfs/dbraw/zinc/38/66/22/534386622.db2.gz	IVVTYRGTNQKZKZ-UHFFFAOYSA-N	0	0	282.752	4.212	20	30		CIEDRN
C=CC[C@@H](C)[C@@H](C)Nc1cccc(NC(=O)N(C)C)c1C	ZINC000279749168	519095521	/nfs/dbraw/zinc/09/55/21/519095521.db2.gz	YMHJCBRGLMAKBV-TZMCWYRMSA-N	0	0	289.423	4.101	20	30		CIEDRN
Cc1ccncc1NC(=O)c1coc(C2CCCCC2)n1	ZINC000330143125	534424400	/nfs/dbraw/zinc/42/44/00/534424400.db2.gz	QYNLVYBCIGQMDN-UHFFFAOYSA-N	0	0	285.347	4.062	20	30		CIEDRN
CC(C)Sc1ccccc1C(=O)Nc1cccc(C#N)c1	ZINC000049910458	519788362	/nfs/dbraw/zinc/78/83/62/519788362.db2.gz	CTGBSGONFPSKRA-UHFFFAOYSA-N	0	0	296.395	4.311	20	30		CIEDRN
CCN(C(=O)/C=C1/CC[C@@H](C)C1)[C@@H](C)c1ccc(C#N)cc1	ZINC000267883827	519898527	/nfs/dbraw/zinc/89/85/27/519898527.db2.gz	UTRHPHIFSIMCAL-URQAUJNWSA-N	0	0	296.414	4.214	20	30		CIEDRN
CCCCC(=O)Nc1cc(C(C)(C)C)sc1C#N	ZINC000154289769	519914207	/nfs/dbraw/zinc/91/42/07/519914207.db2.gz	HMBPTNXVCRYZFV-UHFFFAOYSA-N	0	0	264.394	4.046	20	30		CIEDRN
Cc1ccc2cccc(NCc3ccc(C#N)cc3F)c2n1	ZINC000347913676	534485052	/nfs/dbraw/zinc/48/50/52/534485052.db2.gz	MUDQLJOXYGTWTF-UHFFFAOYSA-N	0	0	291.329	4.166	20	30		CIEDRN
CCCC[C@@H](CC)C(=O)Nc1cc(C#N)ccc1C	ZINC000049524548	521021034	/nfs/dbraw/zinc/02/10/34/521021034.db2.gz	GBZWMZBTJWPRRX-CQSZACIVSA-N	0	0	258.365	4.022	20	30		CIEDRN
Cc1oc2ccc(NC(=O)[C@@]3(C)CCOC3)cc2c1C	ZINC000330040000	534549864	/nfs/dbraw/zinc/54/98/64/534549864.db2.gz	CBCYXQISUMUDIO-INIZCTEOSA-N	0	0	273.332	4.064	20	30		CIEDRN
Cc1oc2ccc(NC(=O)[C@@]3(C)CCCOC3)cc2c1C	ZINC000330066577	534550224	/nfs/dbraw/zinc/55/02/24/534550224.db2.gz	SZMGDNRPGYWTCN-KRWDZBQOSA-N	0	0	287.359	4.454	20	30		CIEDRN
Cc1oc2ccc(NC(=O)[C@@H]3[C@H]4CCCO[C@H]43)cc2c1C	ZINC000330049955	534550907	/nfs/dbraw/zinc/55/09/07/534550907.db2.gz	JZRUZMFPNOVNME-DAXOMENPSA-N	0	0	285.343	4.063	20	30		CIEDRN
Cc1oc2ccccc2c1CNc1ncc(C#N)cc1Cl	ZINC000302219084	534557519	/nfs/dbraw/zinc/55/75/19/534557519.db2.gz	LOXBNQCWUYDFJQ-UHFFFAOYSA-N	0	0	297.745	4.273	20	30		CIEDRN
CCC(CC)C(=O)N(Cc1ccco1)c1ccccc1C#N	ZINC000291218615	521486275	/nfs/dbraw/zinc/48/62/75/521486275.db2.gz	LGDRWOBGQUSQSB-UHFFFAOYSA-N	0	0	296.370	4.121	20	30		CIEDRN
CCCc1nc(C)c(CNc2cc(Cl)ccc2C#N)o1	ZINC000292161937	521499426	/nfs/dbraw/zinc/49/94/26/521499426.db2.gz	DDFKQSSECAFMME-UHFFFAOYSA-N	0	0	289.766	4.073	20	30		CIEDRN
CCS[C@@H]1CCC[C@@H](Nc2ccc(C#N)cc2)C1	ZINC000301517452	521724876	/nfs/dbraw/zinc/72/48/76/521724876.db2.gz	FTOJKYOTVSYCPD-HUUCEWRRSA-N	0	0	260.406	4.034	20	30		CIEDRN
Cc1sc(CNc2cccc(F)c2C#N)nc1C(C)C	ZINC000347192649	534607367	/nfs/dbraw/zinc/60/73/67/534607367.db2.gz	WBLDFZVDQYEAAW-UHFFFAOYSA-N	0	0	289.379	4.198	20	30		CIEDRN
CC[C@H](CSC)Nc1ccc(C(F)(F)F)cc1C#N	ZINC000163798527	522286836	/nfs/dbraw/zinc/28/68/36/522286836.db2.gz	OFGGSQGAFSYOIV-LLVKDONJSA-N	0	0	288.338	4.131	20	30		CIEDRN
Cc1nc2c(cccc2C(=O)N[C@@H]2CCC(C)(C)C2)o1	ZINC000329971162	534626324	/nfs/dbraw/zinc/62/63/24/534626324.db2.gz	YGGKELMNIMOEQY-LLVKDONJSA-N	0	0	272.348	4.020	20	30		CIEDRN
Cc1cnc([C@@H](C)S[C@H](C)c2ccc(C#N)cc2)o1	ZINC000356077669	534626460	/nfs/dbraw/zinc/62/64/60/534626460.db2.gz	LAMRDVAVTABYDU-VXGBXAGGSA-N	0	0	272.373	4.410	20	30		CIEDRN
CCc1nc([C@@H](C)Nc2c(F)cc(C#N)cc2F)cs1	ZINC000264748699	522425079	/nfs/dbraw/zinc/42/50/79/522425079.db2.gz	LRLLAMBVDCLGPG-MRVPVSSYSA-N	0	0	293.342	4.028	20	30		CIEDRN
CC[C@@H](CC#N)N[C@@H](C)c1ccc(Cl)c(Cl)c1	ZINC000054182630	522465821	/nfs/dbraw/zinc/46/58/21/522465821.db2.gz	AVLBWZJJYOAVIX-ONGXEEELSA-N	0	0	271.191	4.336	20	30		CIEDRN
CCc1noc([C@H](C)S[C@@H](C)c2ccc(C#N)cc2)n1	ZINC000076326701	522918058	/nfs/dbraw/zinc/91/80/58/522918058.db2.gz	REXGGPJRNRLJFE-QWRGUYRKSA-N	0	0	287.388	4.059	20	30		CIEDRN
CC[C@@H]1CC[C@@H](C)N1C(=O)Nc1ccc(C#N)cc1Cl	ZINC000271547645	523350343	/nfs/dbraw/zinc/35/03/43/523350343.db2.gz	ZXYDJAIFYZVUKF-ZYHUDNBSSA-N	0	0	291.782	4.006	20	30		CIEDRN
COc1ccc(C(=O)/C=C/c2ccc3ncccc3c2)cc1	ZINC000068301212	523542482	/nfs/dbraw/zinc/54/24/82/523542482.db2.gz	JRUSCYIWTRRNBN-VZUCSPMQSA-N	0	0	289.334	4.140	20	30		CIEDRN
N#CCc1cccc(C(=O)N[C@@H]2CC[C@@H]3CCC[C@H]3C2)c1	ZINC000329542092	534726812	/nfs/dbraw/zinc/72/68/12/534726812.db2.gz	DTRKHFJNOWXOOD-YQQAZPJKSA-N	0	0	282.387	4.026	20	30		CIEDRN
Cc1cccc([C@@H](C)Nc2ccc(C)c(C#N)n2)c1C	ZINC000302672876	534756322	/nfs/dbraw/zinc/75/63/22/534756322.db2.gz	SHCPVQRNKAGDSU-CQSZACIVSA-N	0	0	265.360	4.052	20	30		CIEDRN
C[C@@H]1CCC[C@@H](CCn2cc(C#N)c(=O)c3ccccc32)C1	ZINC000338404538	524286275	/nfs/dbraw/zinc/28/62/75/524286275.db2.gz	AMIAXFBBHGRDFW-CABCVRRESA-N	0	0	294.398	4.090	20	30		CIEDRN
Cc1ccc(CNc2cccc(Cl)c2C#N)cc1	ZINC000048727831	524617795	/nfs/dbraw/zinc/61/77/95/524617795.db2.gz	RYDSFFMRYVGXGW-UHFFFAOYSA-N	0	0	256.736	4.132	20	30		CIEDRN
Cc1nn(C(C)(C)C)c(C)c1CNc1cccc(C#N)c1C	ZINC000354749701	534807762	/nfs/dbraw/zinc/80/77/62/534807762.db2.gz	MQFUHFPODCMVSS-UHFFFAOYSA-N	0	0	296.418	4.047	20	30		CIEDRN
Cc1cccc([C@@H]2CCCN2c2ccc(C#N)c(Cl)c2)n1	ZINC000150929980	524853968	/nfs/dbraw/zinc/85/39/68/524853968.db2.gz	CRWXHVMZAVOJLS-KRWDZBQOSA-N	0	0	297.789	4.257	20	30		CIEDRN
C[C@H](NCc1ncc(C(C)(C)C)s1)c1ccc(C#N)cc1	ZINC000279039752	525489320	/nfs/dbraw/zinc/48/93/20/525489320.db2.gz	CLMGQWBEBFOWOD-LBPRGKRZSA-N	0	0	299.443	4.163	20	30		CIEDRN
Cc1ccc([C@H](C)Nc2nc3c(cc2C#N)CCCC3)s1	ZINC000044420079	525949340	/nfs/dbraw/zinc/94/93/40/525949340.db2.gz	QOPSHXFCAJDVMO-LBPRGKRZSA-N	0	0	297.427	4.375	20	30		CIEDRN
C[C@@H](SCc1nccn1C(F)F)c1ccc(C#N)cc1	ZINC000083633704	525981158	/nfs/dbraw/zinc/98/11/58/525981158.db2.gz	WLKMCGOEXDMUAZ-SNVBAGLBSA-N	0	0	293.342	4.144	20	30		CIEDRN
C[C@H](Sc1nc2c(cc1C#N)CCCC2)c1cccnc1	ZINC000299095400	526002691	/nfs/dbraw/zinc/00/26/91/526002691.db2.gz	VAIHYENGZVTKSA-LBPRGKRZSA-N	0	0	295.411	4.080	20	30		CIEDRN
C[C@H](Sc1nnc(C2CC2)s1)c1cccc(C#N)c1	ZINC000189853718	526012243	/nfs/dbraw/zinc/01/22/43/526012243.db2.gz	PMRVVTGYMDQXMQ-VIFPVBQESA-N	0	0	287.413	4.140	20	30		CIEDRN
C=CCN(Cc1cnc(CC)s1)Cc1ccccc1F	ZINC000352654019	526379162	/nfs/dbraw/zinc/37/91/62/526379162.db2.gz	GLEWKZVYPQNTSE-UHFFFAOYSA-N	0	0	290.407	4.033	20	30		CIEDRN
C=CCN(Cc1csc(C2CC2)n1)c1ccccc1	ZINC000355047938	526380510	/nfs/dbraw/zinc/38/05/10/526380510.db2.gz	DDANRITXTCETNR-UHFFFAOYSA-N	0	0	270.401	4.213	20	30		CIEDRN
C=C(C)CCSCc1nnc(Cc2ccccc2C)o1	ZINC000350720421	526462593	/nfs/dbraw/zinc/46/25/93/526462593.db2.gz	OUIPGWUQHCICIE-UHFFFAOYSA-N	0	0	288.416	4.168	20	30		CIEDRN
N#Cc1cc(NCc2ccccc2F)ccc1C(F)(F)F	ZINC000163911388	526572429	/nfs/dbraw/zinc/57/24/29/526572429.db2.gz	QDHUTMUFXUDNRJ-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
N#Cc1ccc(CNc2ccccc2N2CCCCC2)s1	ZINC000157520345	526629393	/nfs/dbraw/zinc/62/93/93/526629393.db2.gz	VAOLUQYRDHBYRA-UHFFFAOYSA-N	0	0	297.427	4.222	20	30		CIEDRN
CC(C)(C)[C@@H](Nc1ncccc1C#N)c1cccc(F)c1	ZINC000301537981	526640624	/nfs/dbraw/zinc/64/06/24/526640624.db2.gz	BFBPWOYXUWHRBJ-HNNXBMFYSA-N	0	0	283.350	4.292	20	30		CIEDRN
N#Cc1ccc(N[C@H]2CCc3c2cccc3O)cc1Cl	ZINC000036852698	526668276	/nfs/dbraw/zinc/66/82/76/526668276.db2.gz	ZQKOYXFSQVOCPA-HNNXBMFYSA-N	0	0	284.746	4.017	20	30		CIEDRN
N#Cc1ccc(Sc2nc(-c3ccccc3)cs2)nc1	ZINC000042817449	526686387	/nfs/dbraw/zinc/68/63/87/526686387.db2.gz	LQZLBTALXYTUQM-UHFFFAOYSA-N	0	0	295.392	4.228	20	30		CIEDRN
C=C(C)CSc1nnc(-c2ccc(C)cc2C)o1	ZINC000066260797	526691820	/nfs/dbraw/zinc/69/18/20/526691820.db2.gz	VYNIZIBGSJGCCY-UHFFFAOYSA-N	0	0	260.362	4.022	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC)c1ccc(C#N)c(Cl)c1	ZINC000186087843	526692729	/nfs/dbraw/zinc/69/27/29/526692729.db2.gz	ACGTWQTYILZCSJ-GFCCVEGCSA-N	0	0	290.794	4.167	20	30		CIEDRN
N#Cc1cccc(CN(Cc2c(F)cccc2F)C2CC2)c1	ZINC000339424613	526702109	/nfs/dbraw/zinc/70/21/09/526702109.db2.gz	VZZZIAADRWFULI-UHFFFAOYSA-N	0	0	298.336	4.001	20	30		CIEDRN
N#Cc1cccc(CSCc2cccc(F)c2)c1	ZINC000058240714	526711744	/nfs/dbraw/zinc/71/17/44/526711744.db2.gz	IXCPVQZQBKAFRZ-UHFFFAOYSA-N	0	0	257.333	4.131	20	30		CIEDRN
N#Cc1ccccc1OCc1ccc(C(F)(F)F)cc1	ZINC000049538250	526747120	/nfs/dbraw/zinc/74/71/20/526747120.db2.gz	LKPAKINSNBQAMR-UHFFFAOYSA-N	0	0	277.245	4.156	20	30		CIEDRN
N#Cc1cnc2ccccc2c1N1CCC2(CCCC2)CC1	ZINC000301143491	526776209	/nfs/dbraw/zinc/77/62/09/526776209.db2.gz	DLQXSTOXCDHEOM-UHFFFAOYSA-N	0	0	291.398	4.267	20	30		CIEDRN
C=C(C)[C@H](NC(=O)N(CC)C(C)C)c1ccc(F)c(F)c1	ZINC000186142041	526817972	/nfs/dbraw/zinc/81/79/72/526817972.db2.gz	JOMRYRRHPHSNHR-HNNXBMFYSA-N	0	0	296.361	4.022	20	30		CIEDRN
Cc1sc(NC(=O)[C@@H]2CCC[C@H](C)C2)c(C#N)c1C	ZINC000356602779	526882329	/nfs/dbraw/zinc/88/23/29/526882329.db2.gz	YPSMGZSBSOYLRM-JOYOIKCWSA-N	0	0	276.405	4.001	20	30		CIEDRN
CC(C)(CNC(=O)[C@H]1CCCCC(=O)N1)C1=CCCCC1	ZINC000329872611	526948649	/nfs/dbraw/zinc/94/86/49/526948649.db2.gz	BOSSVGVTCNARPH-CQSZACIVSA-N	0	0	292.423	4.369	20	30		CIEDRN
CC(C)(CNC(=O)c1cc(C2CC2)on1)C1=CCCCC1	ZINC000330010792	526948988	/nfs/dbraw/zinc/94/89/88/526948988.db2.gz	HHWBJTZZOFHMFK-UHFFFAOYSA-N	0	0	288.391	4.383	20	30		CIEDRN
C=CCC1(c2nc([C@H]3C[C@@H]3c3ccccc3)no2)CCC1	ZINC000347269275	527067080	/nfs/dbraw/zinc/06/70/80/527067080.db2.gz	RSURIMOAOZAERF-CABCVRRESA-N	0	0	280.371	4.339	20	30		CIEDRN
C=CCCC1(C(=O)N[C@@H]2CCCc3ccc(C)cc32)CC1	ZINC000344664274	527093464	/nfs/dbraw/zinc/09/34/64/527093464.db2.gz	JRJMWOGYFYIUDA-QGZVFWFLSA-N	0	0	283.415	4.235	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc3nc(C)sc3c2)CC1	ZINC000353517054	527097373	/nfs/dbraw/zinc/09/73/73/527097373.db2.gz	OQNWZRXCVBHDHC-UHFFFAOYSA-N	0	0	286.400	4.290	20	30		CIEDRN
C=CCCC1(C(=O)Nc2nnc(C(CC)CC)s2)CC1	ZINC000354977832	527098924	/nfs/dbraw/zinc/09/89/24/527098924.db2.gz	IZSHTVBTCHTLGX-UHFFFAOYSA-N	0	0	293.436	4.127	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@@H](CC1CCC1)c1ccccc1	ZINC000352153691	527132373	/nfs/dbraw/zinc/13/23/73/527132373.db2.gz	OOHMQZXTXJICBH-YOEHRIQHSA-N	0	0	286.419	4.182	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@H](CC1CCC1)c1ccccc1	ZINC000352153690	527133126	/nfs/dbraw/zinc/13/31/26/527133126.db2.gz	OOHMQZXTXJICBH-WMLDXEAASA-N	0	0	286.419	4.182	20	30		CIEDRN
C=CCCCN(C)C(=O)c1cc(F)ccc1-c1ccoc1	ZINC000348294945	527190208	/nfs/dbraw/zinc/19/02/08/527190208.db2.gz	UOGALFQMXBFPSF-UHFFFAOYSA-N	0	0	287.334	4.124	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(N2CCC[C@@]3(CC=CCC3)C2)c1	ZINC000302100259	527223454	/nfs/dbraw/zinc/22/34/54/527223454.db2.gz	LCZSZNSAJOWNKF-IBGZPJMESA-N	0	0	294.398	4.088	20	30		CIEDRN
C=CC[C@H]1N(C(=O)c2cc(C)oc2C)CCCC1(C)C	ZINC000347422266	527225570	/nfs/dbraw/zinc/22/55/70/527225570.db2.gz	TXZIMLDBSBOFPW-OAHLLOKOSA-N	0	0	275.392	4.103	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(NCc2coc3ccccc23)c1	ZINC000347417434	527226485	/nfs/dbraw/zinc/22/64/85/527226485.db2.gz	UHVFSTGEXLHKHA-UHFFFAOYSA-N	0	0	290.322	4.119	20	30		CIEDRN
C=CC[C@H]1N(C(=O)c2ccccc2F)CCCC1(C)C	ZINC000347448385	527226709	/nfs/dbraw/zinc/22/67/09/527226709.db2.gz	QPVWVLGOISGZRS-OAHLLOKOSA-N	0	0	275.367	4.033	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1nc(C)oc1C	ZINC000295062327	527260422	/nfs/dbraw/zinc/26/04/22/527260422.db2.gz	ZYGSKDYPSORYFY-UHFFFAOYSA-N	0	0	298.386	4.396	20	30		CIEDRN
C=CCn1c(S[C@H](C)c2ccccc2)nnc1C1CC1	ZINC000103973824	527347394	/nfs/dbraw/zinc/34/73/94/527347394.db2.gz	FVUQAIWAZLDBPH-GFCCVEGCSA-N	0	0	285.416	4.195	20	30		CIEDRN
C=CCC[C@@H](Nc1ccc(NC(C)=O)cc1)c1ccco1	ZINC000353652879	527450846	/nfs/dbraw/zinc/45/08/46/527450846.db2.gz	JJDCRYDIWIJZNV-MRXNPFEDSA-N	0	0	284.359	4.357	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1cc2[nH]ccc2cc1C	ZINC000336094499	527453094	/nfs/dbraw/zinc/45/30/94/527453094.db2.gz	SIUREPUEDSHNBU-CQSZACIVSA-N	0	0	283.375	4.049	20	30		CIEDRN
C=CCC[C@H](Nc1ccc(C)c(C#N)n1)c1ccccc1	ZINC000302688977	527487910	/nfs/dbraw/zinc/48/79/10/527487910.db2.gz	YWMHKOGMUKNDFO-INIZCTEOSA-N	0	0	277.371	4.381	20	30		CIEDRN
CC(C)(C(=O)Nc1cccc2c1CNC2=O)C1CCCC1	ZINC000329200540	527544935	/nfs/dbraw/zinc/54/49/35/527544935.db2.gz	BLVJRUOXPWVDRH-UHFFFAOYSA-N	0	0	286.375	4.309	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cnn([C@@H](C)CC)c1C1CC1	ZINC000353447337	527614025	/nfs/dbraw/zinc/61/40/25/527614025.db2.gz	JTSWMXSLSYKJKP-YVEFUNNKSA-N	0	0	289.423	4.272	20	30		CIEDRN
CC(C)C1CCC(NC(=O)Cc2ccc3n[nH]cc3c2)CC1	ZINC000330002213	527629542	/nfs/dbraw/zinc/62/95/42/527629542.db2.gz	AWHFNWIYDBVVJX-UHFFFAOYSA-N	0	0	299.418	4.277	20	30		CIEDRN
CC(C)(C)CN(CCC#N)C(=O)c1cccc2ccccc21	ZINC000355154315	527680127	/nfs/dbraw/zinc/68/01/27/527680127.db2.gz	BBSICDUYMLMNSJ-UHFFFAOYSA-N	0	0	294.398	4.242	20	30		CIEDRN
CC(C)CCN(CCC#N)Cc1cc2ccccc2o1	ZINC000353419202	527715092	/nfs/dbraw/zinc/71/50/92/527715092.db2.gz	BCJBZHOTJJHEAE-UHFFFAOYSA-N	0	0	270.376	4.195	20	30		CIEDRN
CC(C)[C@H]1CCCCN1C(=O)C[C@@H](CC#N)c1ccccc1	ZINC000356117173	527758646	/nfs/dbraw/zinc/75/86/46/527758646.db2.gz	LXYUAGIDIPSJEU-QZTJIDSGSA-N	0	0	298.430	4.111	20	30		CIEDRN
CC1(CC(=O)Nc2ncn(C3CCCCC3)n2)CCCC1	ZINC000329282147	527920564	/nfs/dbraw/zinc/92/05/64/527920564.db2.gz	AHDBUDXVCIDECF-UHFFFAOYSA-N	0	0	290.411	4.342	20	30		CIEDRN
CCO[C@H](CCNc1ccc(C#N)c(Cl)c1)C(C)C	ZINC000301438782	528051353	/nfs/dbraw/zinc/05/13/53/528051353.db2.gz	NTHWQUZBRKOIAI-OAHLLOKOSA-N	0	0	280.799	4.075	20	30		CIEDRN
CC(C)c1ccc(C(=O)Nc2sccc2C#N)s1	ZINC000336449060	528080738	/nfs/dbraw/zinc/08/07/38/528080738.db2.gz	RAEROBWOWWJEPV-UHFFFAOYSA-N	0	0	276.386	4.057	20	30		CIEDRN
CCC[C@H](NC(=O)[C@@H](C)C#N)c1ccc(Cl)c(Cl)c1	ZINC000347029254	528194561	/nfs/dbraw/zinc/19/45/61/528194561.db2.gz	AJTOFHMSCNJGPN-ZANVPECISA-N	0	0	299.201	4.110	20	30		CIEDRN
CC(C)c1cnc(S[C@@H](C)c2cccc(C#N)c2)n1C	ZINC000442906434	528226737	/nfs/dbraw/zinc/22/67/37/528226737.db2.gz	HNTVEJXPMXMFBY-LBPRGKRZSA-N	0	0	285.416	4.268	20	30		CIEDRN
CC(C)c1nc([C@@H](C)NCc2ccc(C#N)s2)cs1	ZINC000347783232	528300977	/nfs/dbraw/zinc/30/09/77/528300977.db2.gz	ZNZUNLPMVWKYAY-SNVBAGLBSA-N	0	0	291.445	4.050	20	30		CIEDRN
CCC(C)(C)C1CCC2(C[C@H]2C(=O)N[C@H](C)CC#N)CC1	ZINC000352102800	528492646	/nfs/dbraw/zinc/49/26/46/528492646.db2.gz	SJKQOMRTVREUCY-GBRKPNRJSA-N	0	0	290.451	4.037	20	30		CIEDRN
CC(C)c1scnc1NC(=O)N[C@H]1CCCC1(C)C	ZINC000329553429	528523110	/nfs/dbraw/zinc/52/31/10/528523110.db2.gz	KBGKTBXUKKQRMA-JTQLQIEISA-N	0	0	281.425	4.171	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)c1ccc(C(F)F)cc1	ZINC000348526774	528542190	/nfs/dbraw/zinc/54/21/90/528542190.db2.gz	XTOHZBABWWAKBU-UHFFFAOYSA-N	0	0	294.345	4.169	20	30		CIEDRN
CCCc1ccc([C@H](Nc2cnc(C#N)cn2)C(C)C)cc1	ZINC000302238272	528631553	/nfs/dbraw/zinc/63/15/53/528631553.db2.gz	LKXTXAJQBGWOHZ-GOSISDBHSA-N	0	0	294.402	4.110	20	30		CIEDRN
CC(C)[C@@H]1CCC[C@H](NC(=O)c2ocnc2C2CC2)CC1	ZINC000329642392	528683669	/nfs/dbraw/zinc/68/36/69/528683669.db2.gz	IPINOAKBJLHHAU-OCCSQVGLSA-N	0	0	290.407	4.462	20	30		CIEDRN
CC(C)Cc1nsc(Oc2ccc(C#N)cc2Cl)n1	ZINC000302232685	528688617	/nfs/dbraw/zinc/68/86/17/528688617.db2.gz	FBFDZVXJSOJETL-UHFFFAOYSA-N	0	0	293.779	4.054	20	30		CIEDRN
CCC(CC)CN(CCC#N)Cc1csc(C(C)C)n1	ZINC000353415410	528750888	/nfs/dbraw/zinc/75/08/88/528750888.db2.gz	HWGUFPCOPBBTFB-UHFFFAOYSA-N	0	0	293.480	4.418	20	30		CIEDRN
CC1(NC(=O)CCc2nc3ccccc3o2)CCCC1	ZINC000329082822	528831864	/nfs/dbraw/zinc/83/18/64/528831864.db2.gz	SHWDGPJLHZMOKP-UHFFFAOYSA-N	0	0	272.348	4.050	20	30		CIEDRN
CC1(C)CC(C(=O)Nc2cccc([C@@H]3CNC(=O)C3)c2)C1	ZINC000329176468	528882712	/nfs/dbraw/zinc/88/27/12/528882712.db2.gz	MLAVCBHCDJFDPC-LBPRGKRZSA-N	0	0	286.375	4.155	20	30		CIEDRN
CC1(C)CCCC[C@@H]1NC(=O)C[C@H]1CCCCNC1=O	ZINC000329554838	528914137	/nfs/dbraw/zinc/91/41/37/528914137.db2.gz	QCMZZYVVBYDFEE-OLZOCXBDSA-N	0	0	280.412	4.058	20	30		CIEDRN
CC(C)[C@H](C)CC(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000352226437	528940622	/nfs/dbraw/zinc/94/06/22/528940622.db2.gz	TZJZLZSPCVYEAL-NVXWUHKLSA-N	0	0	286.419	4.220	20	30		CIEDRN
CC1(C)CC[C@@H](C(=O)N[C@@H](CCCC#N)c2ccccc2)C1	ZINC000352218731	529016972	/nfs/dbraw/zinc/01/69/72/529016972.db2.gz	NPBCBWXYBUUQPK-SJORKVTESA-N	0	0	298.430	4.364	20	30		CIEDRN
CCc1cccc(NC(=O)C[C@@H]2CCCC(=O)N2)c1CC	ZINC000329667351	529177457	/nfs/dbraw/zinc/17/74/57/529177457.db2.gz	RLSMNRKPMAWLJG-ZDUSSCGKSA-N	0	0	288.391	4.299	20	30		CIEDRN
CC[C@H]1CCCN1C(=O)Nc1c(C)noc1-c1ccccc1	ZINC000330062255	529220097	/nfs/dbraw/zinc/22/00/97/529220097.db2.gz	APJNMVLODSXYLK-AWEZNQCLSA-N	0	0	299.374	4.070	20	30		CIEDRN
CC[C@H]1CC[C@H](C(=O)Nc2nc(C)cc(C3CC3)n2)CC1	ZINC000329782671	529253218	/nfs/dbraw/zinc/25/32/18/529253218.db2.gz	UNDASZZBKXRQNY-MQMHXKEQSA-N	0	0	287.407	4.467	20	30		CIEDRN
CC[C@@H](Sc1cccc(C#N)n1)c1ccccc1	ZINC000301848067	529253899	/nfs/dbraw/zinc/25/38/99/529253899.db2.gz	NVMVAHPKBLIIKY-CQSZACIVSA-N	0	0	254.358	4.197	20	30		CIEDRN
CC[C@@H]1CC[C@@H](C(=O)Nc2ccc3occ(C)c3c2)O1	ZINC000330068715	529335571	/nfs/dbraw/zinc/33/55/71/529335571.db2.gz	VRFRMYJOMUFKJP-DOMZBBRYSA-N	0	0	273.332	4.287	20	30		CIEDRN
N#Cc1ccc(OCc2ccccc2C(F)(F)F)cc1	ZINC000058868821	567181536	/nfs/dbraw/zinc/18/15/36/567181536.db2.gz	JJJHLPCSQUZOBK-UHFFFAOYSA-N	0	0	277.245	4.156	20	30		CIEDRN
N#CCCCSCCCOc1ccc(Cl)cc1	ZINC000082693297	178186734	/nfs/dbraw/zinc/18/67/34/178186734.db2.gz	FTCMNPXPAOMMFA-UHFFFAOYSA-N	0	0	269.797	4.146	20	30		CIEDRN
CC[C@@H]1C[C@@H](C)CN1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000336045276	529422422	/nfs/dbraw/zinc/42/24/22/529422422.db2.gz	ZBGVPIDBYORGFZ-CZUORRHYSA-N	0	0	299.418	4.140	20	30		CIEDRN
CCCCCCCCC(=O)N1CCC[C@H]1c1ccncc1	ZINC000127847147	187336215	/nfs/dbraw/zinc/33/62/15/187336215.db2.gz	MRRMZTZXXYOCCY-KRWDZBQOSA-N	0	0	288.435	4.496	20	30		CIEDRN
CC[C@@]1(C)C[C@H]1C(=O)Nc1c(C)[nH]nc1-c1ccccc1	ZINC000330172859	529537490	/nfs/dbraw/zinc/53/74/90/529537490.db2.gz	GUPFOMRZJYYLTC-GUYCJALGSA-N	0	0	283.375	4.409	20	30		CIEDRN
CCc1cnccc1C(=O)Nc1cc(C2CCCCC2)[nH]n1	ZINC000329231406	529672046	/nfs/dbraw/zinc/67/20/46/529672046.db2.gz	KONGDYVEBCOSQU-UHFFFAOYSA-N	0	0	298.390	4.051	20	30		CIEDRN
CC(C)c1ccc([S@@](=O)CCCC(C)(C)C#N)cc1	ZINC000087611207	260216128	/nfs/dbraw/zinc/21/61/28/260216128.db2.gz	URWXAVZULANHIZ-LJQANCHMSA-N	0	0	277.433	4.248	20	30		CIEDRN
C[C@H](CC#N)Sc1ccccc1NCCC(F)(F)F	ZINC000354324850	260231206	/nfs/dbraw/zinc/23/12/06/260231206.db2.gz	CCEIXIYLLISIBM-SNVBAGLBSA-N	0	0	288.338	4.445	20	30		CIEDRN
CC(C)c1ccccc1N(C)C(=O)c1ccc(CC#N)cc1	ZINC000573960272	334980529	/nfs/dbraw/zinc/98/05/29/334980529.db2.gz	UPKDTDSUSMCNSK-UHFFFAOYSA-N	0	0	292.382	4.153	20	30		CIEDRN
CCCc1ccccc1NC(=O)c1cc(C#N)ccc1Cl	ZINC000505342406	541309655	/nfs/dbraw/zinc/30/96/55/541309655.db2.gz	GVIQGFJMXGTJDG-UHFFFAOYSA-N	0	0	298.773	4.416	20	30		CIEDRN
CC(=O)Nc1cccc(CSCCCC(C)(C)C#N)c1	ZINC000161688943	261256459	/nfs/dbraw/zinc/25/64/59/261256459.db2.gz	CDFMHVZAUDTPIU-UHFFFAOYSA-N	0	0	290.432	4.208	20	30		CIEDRN
C=CCn1c2ccccc2nc1SCC(C)(C)CC#N	ZINC000574414705	335018316	/nfs/dbraw/zinc/01/83/16/335018316.db2.gz	RZXRYRXJSHSMRO-UHFFFAOYSA-N	0	0	285.416	4.254	20	30		CIEDRN
Cc1cccc([C@H](NCc2nc(C#N)cs2)C(C)(C)C)c1	ZINC000574441144	335019719	/nfs/dbraw/zinc/01/97/19/335019719.db2.gz	ADJXWQZMSLUSHV-INIZCTEOSA-N	0	0	299.443	4.200	20	30		CIEDRN
C=C(C)CCNc1cccc(-c2nc(C)cs2)c1	ZINC000574555553	335029203	/nfs/dbraw/zinc/02/92/03/335029203.db2.gz	VNIBXJKULFYTKW-UHFFFAOYSA-N	0	0	258.390	4.497	20	30		CIEDRN
C=C(C)CCc1noc(-c2ccc3nccc(C)c3c2)n1	ZINC000574605477	335033365	/nfs/dbraw/zinc/03/33/65/335033365.db2.gz	PMVVNPHNXUWVLD-UHFFFAOYSA-N	0	0	279.343	4.102	20	30		CIEDRN
N#Cc1csc(C(=O)Nc2cccc(C3CCC3)c2)c1	ZINC000574616463	335033984	/nfs/dbraw/zinc/03/39/84/335033984.db2.gz	RLMBBVAWKYBWMI-UHFFFAOYSA-N	0	0	282.368	4.140	20	30		CIEDRN
C=C(C)C(C)(C)c1nc(C(F)(F)c2ccc(F)cc2)no1	ZINC000574683816	335039239	/nfs/dbraw/zinc/03/92/39/335039239.db2.gz	WMNBBGGVGANPOQ-UHFFFAOYSA-N	0	0	296.292	4.203	20	30		CIEDRN
C=C(C)CCNc1cc(NC(=O)C(C)(C)C)ccc1C	ZINC000574674189	335038581	/nfs/dbraw/zinc/03/85/81/335038581.db2.gz	PMCBNVJWDBKSKS-UHFFFAOYSA-N	0	0	274.408	4.358	20	30		CIEDRN
CC(C)(C#N)c1ccc(C(=O)NC[C@H]2CCCC2(C)C)cc1	ZINC000574718399	335042467	/nfs/dbraw/zinc/04/24/67/335042467.db2.gz	PRPGHMRGUUFYNO-MRXNPFEDSA-N	0	0	298.430	4.044	20	30		CIEDRN
C=CCN1C(=O)c2ccccc2N[C@H]1c1ccccc1Cl	ZINC000024034395	184536673	/nfs/dbraw/zinc/53/66/73/184536673.db2.gz	KNELFTQUVJAOJW-MRXNPFEDSA-N	0	0	298.773	4.093	20	30		CIEDRN
N#CCCCSCc1ccc(Cl)c2cccnc12	ZINC000190902355	262186763	/nfs/dbraw/zinc/18/67/63/262186763.db2.gz	JFYCONIILYMHLL-UHFFFAOYSA-N	0	0	276.792	4.425	20	30		CIEDRN
CC[C@H](C)CC(=O)Nc1ccccc1SC[C@@H](C)C#N	ZINC000191482265	262192502	/nfs/dbraw/zinc/19/25/02/262192502.db2.gz	WJRLAJJNDGEPAY-STQMWFEESA-N	0	0	290.432	4.313	20	30		CIEDRN
C=CCN(CC=C)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000186960996	260024973	/nfs/dbraw/zinc/02/49/73/260024973.db2.gz	ILWHRRHYZFZMKF-UHFFFAOYSA-N	0	0	280.318	4.004	20	30		CIEDRN
N#Cc1ccc(NCc2cnc(-c3ccccc3)s2)cc1	ZINC000171257551	335061177	/nfs/dbraw/zinc/06/11/77/335061177.db2.gz	IYFBVCFGDFLPBZ-UHFFFAOYSA-N	0	0	291.379	4.294	20	30		CIEDRN
C[C@@H](CC#N)Nc1nc2ccccc2c(-c2ccccc2)n1	ZINC000171365926	335063348	/nfs/dbraw/zinc/06/33/48/335063348.db2.gz	XPGWFCITSOPPLP-ZDUSSCGKSA-N	0	0	288.354	4.011	20	30		CIEDRN
COc1cc(C#N)ccc1CNc1c(C)cc(C)cc1C	ZINC000347069728	533496112	/nfs/dbraw/zinc/49/61/12/533496112.db2.gz	RDQZKCMOAWCQNG-UHFFFAOYSA-N	0	0	280.371	4.104	20	30		CIEDRN
C[C@@H](Nc1c(F)cc(C#N)cc1F)c1cccc(F)c1F	ZINC000301874011	533551817	/nfs/dbraw/zinc/55/18/17/533551817.db2.gz	DSNUHIJFKDCPOZ-MRVPVSSYSA-N	0	0	294.251	4.288	20	30		CIEDRN
C[C@@H]1CCCC[C@H]1c1noc([C@@]2(C#N)CC23CCCC3)n1	ZINC000333784653	533631286	/nfs/dbraw/zinc/63/12/86/533631286.db2.gz	CEXYENVKWZBOGR-XNJGSVPQSA-N	0	0	285.391	4.089	20	30		CIEDRN
Cc1csc(NC(=O)c2cccc3ccsc32)c1C#N	ZINC000575091344	335064253	/nfs/dbraw/zinc/06/42/53/335064253.db2.gz	AKJZRJGXWAECMZ-UHFFFAOYSA-N	0	0	298.392	4.395	20	30		CIEDRN
CCc1cccc(C)c1NCc1cccc(C#N)c1F	ZINC000341807970	130070033	/nfs/dbraw/zinc/07/00/33/130070033.db2.gz	RDTGENHHPPYOGY-UHFFFAOYSA-N	0	0	268.335	4.180	20	30		CIEDRN
C[C@@H](SCc1ccc(F)cc1C#N)c1cccnc1	ZINC000341906491	130119988	/nfs/dbraw/zinc/11/99/88/130119988.db2.gz	YJWCTOAJQUFUTJ-LLVKDONJSA-N	0	0	272.348	4.087	20	30		CIEDRN
CC(C)(C)CCCC(=O)N(Cc1ccc(C#N)cc1)C1CC1	ZINC000171442828	335066174	/nfs/dbraw/zinc/06/61/74/335066174.db2.gz	SOHCXXBZIQXOOM-UHFFFAOYSA-N	0	0	298.430	4.266	20	30		CIEDRN
N#Cc1ccccc1COc1cccc2ccccc21	ZINC000005111795	170067253	/nfs/dbraw/zinc/06/72/53/170067253.db2.gz	SQMMQKBRDPYVGC-UHFFFAOYSA-N	0	0	259.308	4.290	20	30		CIEDRN
Cc1cc(C)c(C#N)c(SCc2cccc(F)c2)n1	ZINC000005642198	170123320	/nfs/dbraw/zinc/12/33/20/170123320.db2.gz	JXUDMVMALPRDOP-UHFFFAOYSA-N	0	0	272.348	4.002	20	30		CIEDRN
N#Cc1ccc(C(=O)Nc2ccccc2-c2ccccc2)cc1	ZINC000006287417	170188505	/nfs/dbraw/zinc/18/85/05/170188505.db2.gz	ZYKKLCLBBKHESB-UHFFFAOYSA-N	0	0	298.345	4.478	20	30		CIEDRN
C=CCNc1nc(-c2ccc(Cl)s2)cs1	ZINC000007843403	170304484	/nfs/dbraw/zinc/30/44/84/170304484.db2.gz	VMHFERGBLQUOJN-UHFFFAOYSA-N	0	0	256.783	4.123	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000009823830	170386556	/nfs/dbraw/zinc/38/65/56/170386556.db2.gz	ORVAOFYKUXMLOT-UHFFFAOYSA-N	0	0	282.343	4.286	20	30		CIEDRN
C=CCN(CC=C)C(=O)c1ccccc1SC(C)C	ZINC000020612813	171267739	/nfs/dbraw/zinc/26/77/39/171267739.db2.gz	CWLMDWXMNUIMCG-UHFFFAOYSA-N	0	0	275.417	4.001	20	30		CIEDRN
C=C(C)CSc1nnc(Nc2cccc(C)c2)s1	ZINC000020869741	171277507	/nfs/dbraw/zinc/27/75/07/171277507.db2.gz	ODTGPLQRNRCJJM-UHFFFAOYSA-N	0	0	277.418	4.258	20	30		CIEDRN
N#Cc1ccc(NCc2ccc(Cl)c(Cl)c2)cc1	ZINC000021033574	171291902	/nfs/dbraw/zinc/29/19/02/171291902.db2.gz	ASMBWQLQLGKLDM-UHFFFAOYSA-N	0	0	277.154	4.477	20	30		CIEDRN
N#Cc1cccc(NCc2ccc(Cl)cc2Cl)c1	ZINC000021057105	171295973	/nfs/dbraw/zinc/29/59/73/171295973.db2.gz	NWZGPUQQVWQWSC-UHFFFAOYSA-N	0	0	277.154	4.477	20	30		CIEDRN
N#Cc1ccccc1OCc1cc2ccccc2nc1Cl	ZINC000021181176	171298770	/nfs/dbraw/zinc/29/87/70/171298770.db2.gz	BPTOOZXXVFAGQG-UHFFFAOYSA-N	0	0	294.741	4.339	20	30		CIEDRN
Cc1ccc(SCc2ccccc2C#N)c(C)c1	ZINC000021517880	171314027	/nfs/dbraw/zinc/31/40/27/171314027.db2.gz	ITDOQDMSVWKRRD-UHFFFAOYSA-N	0	0	253.370	4.467	20	30		CIEDRN
CC(C)OC(=O)c1ccccc1Sc1ccccc1C#N	ZINC000022187150	171371893	/nfs/dbraw/zinc/37/18/93/171371893.db2.gz	XLYVCKDGXVJEIL-UHFFFAOYSA-N	0	0	297.379	4.275	20	30		CIEDRN
CCC(CC)CN(CCC#N)C(=O)c1ccc(Cl)s1	ZINC000171567674	335071006	/nfs/dbraw/zinc/07/10/06/335071006.db2.gz	XVHOUIACBJYYMY-UHFFFAOYSA-N	0	0	298.839	4.194	20	30		CIEDRN
CCOc1ccc([C@H](C)Nc2cccc(F)c2C#N)cc1	ZINC000035149565	172011753	/nfs/dbraw/zinc/01/17/53/172011753.db2.gz	ZJBBWBLEJVOGRI-LBPRGKRZSA-N	0	0	284.334	4.269	20	30		CIEDRN
C=CCn1c(SC(C)C)nnc1-c1ccc(Cl)cc1	ZINC000039763649	174172108	/nfs/dbraw/zinc/17/21/08/174172108.db2.gz	PJBWURKAEKWSOG-UHFFFAOYSA-N	0	0	293.823	4.285	20	30		CIEDRN
Cc1cc(Cl)ccc1NC(=O)C1(C#N)CCCCC1	ZINC000044385163	175169449	/nfs/dbraw/zinc/16/94/49/175169449.db2.gz	IAOFQQYSVCJOCU-UHFFFAOYSA-N	0	0	276.767	4.061	20	30		CIEDRN
N#CC1(C(=O)Nc2cccc(Cl)c2Cl)CCCCC1	ZINC000044385285	175169557	/nfs/dbraw/zinc/16/95/57/175169557.db2.gz	LSKCJUKAGXSVOU-UHFFFAOYSA-N	0	0	297.185	4.406	20	30		CIEDRN
N#CC1(C(=O)Nc2cc(Cl)cc(Cl)c2)CCCCC1	ZINC000044385192	175169699	/nfs/dbraw/zinc/16/96/99/175169699.db2.gz	IJIBBAKAFFXKRJ-UHFFFAOYSA-N	0	0	297.185	4.406	20	30		CIEDRN
Cc1cc([C@H](C)Nc2ccc(C#N)cc2F)c(C)o1	ZINC000044730870	175240106	/nfs/dbraw/zinc/24/01/06/175240106.db2.gz	VUPSHNBYURYATO-JTQLQIEISA-N	0	0	258.296	4.080	20	30		CIEDRN
C=CCn1c(SC2CCCC2)nnc1-c1ccoc1C	ZINC000072066519	176312067	/nfs/dbraw/zinc/31/20/67/176312067.db2.gz	XHCLFEYHXFRIIH-UHFFFAOYSA-N	0	0	289.404	4.067	20	30		CIEDRN
N#CCCCSc1nc2c(n1-c1ccccc1)CCCC2	ZINC000072099705	176315437	/nfs/dbraw/zinc/31/54/37/176315437.db2.gz	QXFLPYDWVKZRCI-UHFFFAOYSA-N	0	0	297.427	4.147	20	30		CIEDRN
C=CCCCN(C)C(=O)c1cc(SC)ccc1Cl	ZINC000078828071	177394870	/nfs/dbraw/zinc/39/48/70/177394870.db2.gz	WDMGFPNRDOLAMJ-UHFFFAOYSA-N	0	0	283.824	4.100	20	30		CIEDRN
N#C[C@H]1CC[C@@H](Nc2ccc3nc(C(F)F)sc3c2)C1	ZINC000334583063	225017037	/nfs/dbraw/zinc/01/70/37/225017037.db2.gz	RDIAXRAXKDLORY-DTWKUNHWSA-N	0	0	293.342	4.338	20	30		CIEDRN
N#CC1(CSCc2coc(-c3ccc(F)cc3)n2)CC1	ZINC000344460185	225064084	/nfs/dbraw/zinc/06/40/84/225064084.db2.gz	LWKQMJULEYHHEG-UHFFFAOYSA-N	0	0	288.347	4.018	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccccc1C(C)(F)F	ZINC000411031634	262676089	/nfs/dbraw/zinc/67/60/89/262676089.db2.gz	GSEBPIVVUVNYJZ-CQSZACIVSA-N	0	0	267.319	4.339	20	30		CIEDRN
Cc1ccc(-c2ncc(/C=C/c3ccncc3C#N)s2)o1	ZINC000349113141	226542041	/nfs/dbraw/zinc/54/20/41/226542041.db2.gz	QGEPKZXXJHEOJB-ONEGZZNKSA-N	0	0	293.351	4.149	20	30		CIEDRN
CO[C@@H](C)c1cccc(N[C@@H]2CCc3ccc(C#N)cc32)c1	ZINC000575168563	335074590	/nfs/dbraw/zinc/07/45/90/335074590.db2.gz	VVHWHOLPIPRRER-ORAYPTAESA-N	0	0	292.382	4.365	20	30		CIEDRN
Cn1ccc2ccc(NCc3ccc(Cl)cc3C#N)cc21	ZINC000442872122	226693095	/nfs/dbraw/zinc/69/30/95/226693095.db2.gz	JDLPRWXURJVLBY-UHFFFAOYSA-N	0	0	295.773	4.315	20	30		CIEDRN
C[C@H](CC#N)Sc1ccccc1NC(=O)C[C@H]1C[C@H]1C	ZINC000354224967	226936229	/nfs/dbraw/zinc/93/62/29/226936229.db2.gz	PDDVBFFDJXRZIO-JHJVBQTASA-N	0	0	288.416	4.065	20	30		CIEDRN
N#Cc1ccc(CN2CCC=C(c3ccco3)C2)c(Cl)c1	ZINC000352551010	227053884	/nfs/dbraw/zinc/05/38/84/227053884.db2.gz	SLQHSZDIDWTSBG-UHFFFAOYSA-N	0	0	298.773	4.094	20	30		CIEDRN
Cc1c(C#N)cccc1NCc1cnc2ccccc2c1	ZINC000354784267	227106839	/nfs/dbraw/zinc/10/68/39/227106839.db2.gz	HTVWOWOURXOQIG-UHFFFAOYSA-N	0	0	273.339	4.027	20	30		CIEDRN
N#Cc1ccc(CNc2ccc(F)c(C3CC3)c2)cc1	ZINC000352625389	227116590	/nfs/dbraw/zinc/11/65/90/227116590.db2.gz	BBHPTNQMRMULQN-UHFFFAOYSA-N	0	0	266.319	4.187	20	30		CIEDRN
CC(C)(CC#N)CSc1nc(C(F)(F)F)ccc1C#N	ZINC000575196212	335079461	/nfs/dbraw/zinc/07/94/61/335079461.db2.gz	GBRVAYKHSGQWBW-UHFFFAOYSA-N	0	0	299.321	4.004	20	30		CIEDRN
N#Cc1cccc(CNc2ccc(F)c(C3CC3)c2)c1	ZINC000352629079	227124669	/nfs/dbraw/zinc/12/46/69/227124669.db2.gz	OYLUAZJMQJQCCB-UHFFFAOYSA-N	0	0	266.319	4.187	20	30		CIEDRN
Cc1nc(CCNC(=O)CC2CCC(C)(C)CC2)c(C)o1	ZINC000329003624	227254557	/nfs/dbraw/zinc/25/45/57/227254557.db2.gz	HMPOOHLJFMKOFE-UHFFFAOYSA-N	0	0	292.423	4.397	20	30		CIEDRN
N#C[C@H](NC(=O)[C@@H]1CC12CCCC2)c1ccccc1Cl	ZINC000329005215	227254770	/nfs/dbraw/zinc/25/47/70/227254770.db2.gz	MMJMCDQBMIKAKJ-JSGCOSHPSA-N	0	0	288.778	4.441	20	30		CIEDRN
N#Cc1c(F)cccc1Nc1ccc(OC(F)F)c(F)c1	ZINC000301168624	227463970	/nfs/dbraw/zinc/46/39/70/227463970.db2.gz	WJFKCOSCJHYHIO-UHFFFAOYSA-N	0	0	296.223	4.181	20	30		CIEDRN
N#Cc1cccnc1N1Cc2ccccc2-c2ccccc2C1	ZINC000301173410	227464257	/nfs/dbraw/zinc/46/42/57/227464257.db2.gz	KPZJPJNLGIIOIT-UHFFFAOYSA-N	0	0	297.361	4.140	20	30		CIEDRN
N#Cc1cccnc1N[C@@H](c1ccc(F)cc1)C1CCC1	ZINC000301179416	227469319	/nfs/dbraw/zinc/46/93/19/227469319.db2.gz	HGQLFEDHSOCKQO-MRXNPFEDSA-N	0	0	281.334	4.046	20	30		CIEDRN
Cc1c2ccccc2oc1[C@@H](C)Nc1cccc(C#N)n1	ZINC000301280176	227498070	/nfs/dbraw/zinc/49/80/70/227498070.db2.gz	NTCRCEDBCVRSST-GFCCVEGCSA-N	0	0	277.327	4.181	20	30		CIEDRN
N#Cc1cccc(N[C@H](c2ccc(Cl)cc2)C2CC2)n1	ZINC000301496170	227560996	/nfs/dbraw/zinc/56/09/96/227560996.db2.gz	BBNPVRZFCXLFSC-INIZCTEOSA-N	0	0	283.762	4.170	20	30		CIEDRN
N#Cc1ccc(Nc2ccc(OC3CCCC3)c(F)c2)nc1	ZINC000301424690	227535080	/nfs/dbraw/zinc/53/50/80/227535080.db2.gz	DBHUUMLPCSPONS-UHFFFAOYSA-N	0	0	297.333	4.157	20	30		CIEDRN
C[C@H]1CCCc2ccccc2[C@H]1Nc1ncccc1C#N	ZINC000302183804	227813936	/nfs/dbraw/zinc/81/39/36/227813936.db2.gz	SELPBAGXHRPGOB-GUYCJALGSA-N	0	0	277.371	4.079	20	30		CIEDRN
N#Cc1cccc(C#N)c1SCc1ccc(Cl)cc1	ZINC000302384327	227843245	/nfs/dbraw/zinc/84/32/45/227843245.db2.gz	AKROCUREEKPXGO-UHFFFAOYSA-N	0	0	284.771	4.376	20	30		CIEDRN
N#Cc1cc(F)ccc1N1CCC(c2ccsc2)CC1	ZINC000302402511	227845530	/nfs/dbraw/zinc/84/55/30/227845530.db2.gz	HETQXZQIPKIMRP-UHFFFAOYSA-N	0	0	286.375	4.143	20	30		CIEDRN
Cc1ccc(N(C)[C@H](C)c2cccc(Cl)c2)nc1C#N	ZINC000302673609	227874770	/nfs/dbraw/zinc/87/47/70/227874770.db2.gz	SOIFZNSMIKADEH-GFCCVEGCSA-N	0	0	285.778	4.113	20	30		CIEDRN
N#Cc1cc(Cl)ccc1N[C@H]1CCCc2c(O)cccc21	ZINC000302700818	227877726	/nfs/dbraw/zinc/87/77/26/227877726.db2.gz	HVVFZSZRZOYBPT-INIZCTEOSA-N	0	0	298.773	4.407	20	30		CIEDRN
Cc1cc(C2CC2)nc(NC(=O)[C@@H]2CCC[C@@H](C)C2)n1	ZINC000329780735	227946316	/nfs/dbraw/zinc/94/63/16/227946316.db2.gz	SCHFGTFTSNDWAK-ZWNOBZJWSA-N	0	0	273.380	4.077	20	30		CIEDRN
Cc1nc(CC2CC2)oc1C(=O)N[C@@H]1CC[C@H](C)[C@@H](C)C1	ZINC000330002034	228013573	/nfs/dbraw/zinc/01/35/73/228013573.db2.gz	ATMCCCUESIFOIM-COPLHBTASA-N	0	0	290.407	4.065	20	30		CIEDRN
Cc1nc(CC2CC2)oc1C(=O)NC1C[C@H](C)C[C@@H](C)C1	ZINC000330005893	228013988	/nfs/dbraw/zinc/01/39/88/228013988.db2.gz	DPBZCHPDCUIPBX-GHMZBOCLSA-N	0	0	290.407	4.065	20	30		CIEDRN
Cc1ccccc1[C@@H](CC(C)C)NC(=O)CC(C)(C)C#N	ZINC000353470481	228107651	/nfs/dbraw/zinc/10/76/51/228107651.db2.gz	KKCYUMYZLHMVPM-MRXNPFEDSA-N	0	0	286.419	4.138	20	30		CIEDRN
Cc1ccc(-c2cccnc2)cc1NC(=O)[C@@H]1CC[C@H](C)O1	ZINC000330086147	228035806	/nfs/dbraw/zinc/03/58/06/228035806.db2.gz	LZJZILKDZVUWMH-GUYCJALGSA-N	0	0	296.370	4.213	20	30		CIEDRN
Cc1ccccc1NC(=O)C[C@H](CC#N)c1ccccc1	ZINC000353311171	228084554	/nfs/dbraw/zinc/08/45/54/228084554.db2.gz	IJTJDBWNYILTNR-INIZCTEOSA-N	0	0	278.355	4.021	20	30		CIEDRN
Cc1cc(C#N)cc(NC(=O)N2CCC[C@@H]2C2CCCC2)c1	ZINC000332010121	228143596	/nfs/dbraw/zinc/14/35/96/228143596.db2.gz	SXTSPUSQCCAIIE-QGZVFWFLSA-N	0	0	297.402	4.053	20	30		CIEDRN
Cc1csc([C@@H](C#N)C(=O)c2ccc3sccc3c2)n1	ZINC000351947704	228168164	/nfs/dbraw/zinc/16/81/64/228168164.db2.gz	VDOHCECFLXFXOT-LBPRGKRZSA-N	0	0	298.392	4.156	20	30		CIEDRN
Cc1cscc1C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000352165220	228190715	/nfs/dbraw/zinc/19/07/15/228190715.db2.gz	CICPRLICGCTNBV-MRXNPFEDSA-N	0	0	298.411	4.222	20	30		CIEDRN
N#C[C@@]1(C(=O)Nc2cccc3ccsc32)CC12CCCC2	ZINC000333550107	228203762	/nfs/dbraw/zinc/20/37/62/228203762.db2.gz	MKAIPRMECBKFKP-QGZVFWFLSA-N	0	0	296.395	4.314	20	30		CIEDRN
Cc1cc(C)cc(-c2noc([C@]3(C#N)CC34CCCC4)n2)c1	ZINC000333885399	228218957	/nfs/dbraw/zinc/21/89/57/228218957.db2.gz	XKEPKAVNBGDQRE-GOSISDBHSA-N	0	0	293.370	4.079	20	30		CIEDRN
N#Cc1c(N[C@H]2CCC[C@@H]3C[C@@H]32)cccc1C(F)F	ZINC000521370289	260088968	/nfs/dbraw/zinc/08/89/68/260088968.db2.gz	PCJRMJWANYHLNO-CDMKHQONSA-N	0	0	262.303	4.096	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@H](C)c1ccccc1)c1ccccc1	ZINC000187703467	260030170	/nfs/dbraw/zinc/03/01/70/260030170.db2.gz	OZTVAZNZWCXICE-CRAIPNDOSA-N	0	0	279.383	4.224	20	30		CIEDRN
C=CCCCSc1nnc(-c2ccccc2OCC)o1	ZINC000117548792	260035715	/nfs/dbraw/zinc/03/57/15/260035715.db2.gz	GELHLRFAPDHHSM-UHFFFAOYSA-N	0	0	290.388	4.194	20	30		CIEDRN
C=CCC[C@@H](C(=O)N[C@H](C)c1cccnc1)c1ccccc1	ZINC000187479751	260039118	/nfs/dbraw/zinc/03/91/18/260039118.db2.gz	JBTWFURTRSFOAZ-CRAIPNDOSA-N	0	0	294.398	4.009	20	30		CIEDRN
N#Cc1ccc(COc2c(F)cccc2Cl)cc1F	ZINC000404087778	260039198	/nfs/dbraw/zinc/03/91/98/260039198.db2.gz	SAWRZGXIWXBMPK-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
N#Cc1ccc(COc2ccc(Cl)cc2F)cc1F	ZINC000404112367	260044067	/nfs/dbraw/zinc/04/40/67/260044067.db2.gz	DTMUSPMJVJGSHD-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
C[C@H]1C[C@@H]1c1ccc(CNc2ccc(CC#N)cc2)o1	ZINC000037071309	260066479	/nfs/dbraw/zinc/06/64/79/260066479.db2.gz	DGHGYQFFNJAXKD-LRDDRELGSA-N	0	0	266.344	4.081	20	30		CIEDRN
CCCCn1ncc(N[C@H](CC)c2ccc(C#N)cc2)c1C	ZINC000447602754	260077919	/nfs/dbraw/zinc/07/79/19/260077919.db2.gz	UABFJRUVGAQQLK-QGZVFWFLSA-N	0	0	296.418	4.427	20	30		CIEDRN
CC(C)Oc1ccccc1CNc1ccc(CC#N)cc1	ZINC000037301821	260081641	/nfs/dbraw/zinc/08/16/41/260081641.db2.gz	JXKFQXFGWPUHCZ-UHFFFAOYSA-N	0	0	280.371	4.152	20	30		CIEDRN
C=C(C)CN(C)C(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1Cl	ZINC000180399264	260100623	/nfs/dbraw/zinc/10/06/23/260100623.db2.gz	FNLPRKTVDFFAMS-NEPJUHHUSA-N	0	0	298.213	4.131	20	30		CIEDRN
C=C(C)CN(C)C(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl	ZINC000180398466	260100644	/nfs/dbraw/zinc/10/06/44/260100644.db2.gz	OHLCOPBPJCJRPI-OLZOCXBDSA-N	0	0	298.213	4.131	20	30		CIEDRN
C=C(C)CN(C)C(=O)C(C)(C)c1cccc(C(F)(F)F)c1	ZINC000180475358	260103353	/nfs/dbraw/zinc/10/33/53/260103353.db2.gz	LDIUDSCXKKYOBF-UHFFFAOYSA-N	0	0	299.336	4.018	20	30		CIEDRN
C=CCCC(=O)N[C@@H](CC1CCC1)c1ccccc1	ZINC000180643777	260107843	/nfs/dbraw/zinc/10/78/43/260107843.db2.gz	CWRBOUOPBRBTHT-INIZCTEOSA-N	0	0	257.377	4.000	20	30		CIEDRN
C=CCCCS[C@@H](C)C(=O)Nc1c(C)cccc1C	ZINC000117944556	260117393	/nfs/dbraw/zinc/11/73/93/260117393.db2.gz	GTFSXMKQVGCPJN-AWEZNQCLSA-N	0	0	277.433	4.330	20	30		CIEDRN
C=CC(C)(C)C(=O)Nc1ccccc1CCC(F)(F)F	ZINC000297605732	260129726	/nfs/dbraw/zinc/12/97/26/260129726.db2.gz	GILBSBHUKQCUHW-UHFFFAOYSA-N	0	0	285.309	4.332	20	30		CIEDRN
Cc1nc(N2CCC[C@@H]2C2CCCC2)c(Cl)cc1C#N	ZINC000312497619	260131549	/nfs/dbraw/zinc/13/15/49/260131549.db2.gz	DKISMHWKIWXJNQ-OAHLLOKOSA-N	0	0	289.810	4.074	20	30		CIEDRN
C#CCCCCC(=O)N(C(C)C)[C@@H](C)c1ccccc1	ZINC000297767903	260134331	/nfs/dbraw/zinc/13/43/31/260134331.db2.gz	IHXZIILIDOPQOI-INIZCTEOSA-N	0	0	271.404	4.178	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@@H](C)c1ncc(-c2ccccc2)o1	ZINC000188489377	260149017	/nfs/dbraw/zinc/14/90/17/260149017.db2.gz	YRPAZYFIWCVFHT-UGSOOPFHSA-N	0	0	298.386	4.121	20	30		CIEDRN
N#CCc1ccc(N[C@@H]2CCC[C@@H](C(F)(F)F)C2)cc1	ZINC000069380427	260149856	/nfs/dbraw/zinc/14/98/56/260149856.db2.gz	QQRXEBSKAPTDHC-TZMCWYRMSA-N	0	0	282.309	4.286	20	30		CIEDRN
Cc1ccc(Nc2nc(C(F)(F)F)ccc2C#N)cc1	ZINC000078832068	260169477	/nfs/dbraw/zinc/16/94/77/260169477.db2.gz	LDFXBRUZXUDAEL-UHFFFAOYSA-N	0	0	277.249	4.024	20	30		CIEDRN
N#C[C@H](NC(=O)c1ccc2ccccc2c1)C1CCCCC1	ZINC000080288932	260179587	/nfs/dbraw/zinc/17/95/87/260179587.db2.gz	JSKDWDRROADUEQ-SFHVURJKSA-N	0	0	292.382	4.042	20	30		CIEDRN
C=CCn1c(C)nnc1S[C@H](CC)c1ccccc1	ZINC000299453347	260186814	/nfs/dbraw/zinc/18/68/14/260186814.db2.gz	STEZBAVSEBAJCE-CQSZACIVSA-N	0	0	273.405	4.016	20	30		CIEDRN
Cc1cc(Br)ccc1NCCCC(C)(C)C#N	ZINC000087596988	260191678	/nfs/dbraw/zinc/19/16/78/260191678.db2.gz	YISFSZCFFQWJMM-UHFFFAOYSA-N	0	0	295.224	4.499	20	30		CIEDRN
CC(C)(C#N)CCCNc1cccc(C(F)(F)F)c1	ZINC000087596978	260191696	/nfs/dbraw/zinc/19/16/96/260191696.db2.gz	BJKJZELAMSYONS-UHFFFAOYSA-N	0	0	270.298	4.447	20	30		CIEDRN
Cc1ccc(NCCCC(C)(C)C#N)c(Br)c1	ZINC000087596954	260191809	/nfs/dbraw/zinc/19/18/09/260191809.db2.gz	DEPVELHKCCAVNO-UHFFFAOYSA-N	0	0	295.224	4.499	20	30		CIEDRN
Cc1ccc(OCCCC(C)(C)C#N)c(Cl)c1	ZINC000087609049	260192326	/nfs/dbraw/zinc/19/23/26/260192326.db2.gz	LAOAVSYPZRGINC-UHFFFAOYSA-N	0	0	251.757	4.357	20	30		CIEDRN
CC(C)(C#N)CCCOc1cccc(C(F)(F)F)c1	ZINC000087608965	260192416	/nfs/dbraw/zinc/19/24/16/260192416.db2.gz	YPZHZUWLXJLRJU-UHFFFAOYSA-N	0	0	271.282	4.414	20	30		CIEDRN
C=C(C[NH2+]Cc1ccsc1Cl)c1ccccc1	ZINC000312772369	260200091	/nfs/dbraw/zinc/20/00/91/260200091.db2.gz	SSTONZYWTFPLHT-UHFFFAOYSA-N	0	0	263.793	4.205	20	30		CIEDRN
CCC[C@H](C)[C@@H]1CCCN1c1snc(Cl)c1C#N	ZINC000301688043	260208670	/nfs/dbraw/zinc/20/86/70/260208670.db2.gz	IUQNRUAZTUSCOB-ONGXEEELSA-N	0	0	283.828	4.073	20	30		CIEDRN
CC(C)CN(Cc1cccc(C#N)c1)c1ccccc1	ZINC000312843139	260211797	/nfs/dbraw/zinc/21/17/97/260211797.db2.gz	WKTGRTUWHYQMNC-UHFFFAOYSA-N	0	0	264.372	4.221	20	30		CIEDRN
N#Cc1ccc(Oc2ccc(Cl)cc2F)cc1[N+](=O)[O-]	ZINC000312856096	260212837	/nfs/dbraw/zinc/21/28/37/260212837.db2.gz	MMNUQNPMTXYZQO-UHFFFAOYSA-N	0	0	292.653	4.051	20	30		CIEDRN
CC(C)(C#N)CCCNc1ccc(OC(F)F)cc1	ZINC000087597266	260215425	/nfs/dbraw/zinc/21/54/25/260215425.db2.gz	QUJBVRRASWUDND-UHFFFAOYSA-N	0	0	268.307	4.030	20	30		CIEDRN
CC(C)(C#N)CCC[S@@](=O)c1ccc2ccccc2c1	ZINC000087611249	260216288	/nfs/dbraw/zinc/21/62/88/260216288.db2.gz	LXDWMDPRQXTJGM-FQEVSTJZSA-N	0	0	285.412	4.277	20	30		CIEDRN
N#Cc1ccc(SCCOc2ccccc2F)c(F)c1	ZINC000525503945	260217431	/nfs/dbraw/zinc/21/74/31/260217431.db2.gz	OJWYGPKEVSAVEE-UHFFFAOYSA-N	0	0	291.322	4.008	20	30		CIEDRN
N#Cc1ccc(SCCOc2cccc(F)c2)c(F)c1	ZINC000525504056	260217556	/nfs/dbraw/zinc/21/75/56/260217556.db2.gz	ZIWULBREWQEDJY-UHFFFAOYSA-N	0	0	291.322	4.008	20	30		CIEDRN
Cc1cc(C(=O)CSc2ccc(C#N)cc2)cc(C)c1F	ZINC000525519802	260232305	/nfs/dbraw/zinc/23/23/05/260232305.db2.gz	SPMLAGZAJIRZMZ-UHFFFAOYSA-N	0	0	299.370	4.289	20	30		CIEDRN
CC(C)(C#N)CCCNc1ccc(C#N)c(C(F)(F)F)c1	ZINC000088191469	260290411	/nfs/dbraw/zinc/29/04/11/260290411.db2.gz	LHHCBYXQBYQMPO-UHFFFAOYSA-N	0	0	295.308	4.319	20	30		CIEDRN
N#CCc1cccc(N[C@H]2CCC[C@H](C(F)(F)F)C2)c1	ZINC000313427921	260292968	/nfs/dbraw/zinc/29/29/68/260292968.db2.gz	NPRSUEKSVBSLMC-JSGCOSHPSA-N	0	0	282.309	4.286	20	30		CIEDRN
N#CCc1cccc(NC[C@H]2CCC3(CCCCC3)O2)c1	ZINC000313454577	260295665	/nfs/dbraw/zinc/29/56/65/260295665.db2.gz	WCQYHEVDQHUQSG-QGZVFWFLSA-N	0	0	284.403	4.046	20	30		CIEDRN
C=C(C)C[N@@H+](C)Cc1cnc(-c2c(F)cccc2F)s1	ZINC000449224659	260299105	/nfs/dbraw/zinc/29/91/05/260299105.db2.gz	IHBJCEFDOJPSTB-UHFFFAOYSA-N	0	0	294.370	4.096	20	30		CIEDRN
CCCc1ccc(C(=O)Nc2ccc(C#N)c(Cl)c2)cc1	ZINC000517907419	260315669	/nfs/dbraw/zinc/31/56/69/260315669.db2.gz	JPWLUQXBTDDODZ-UHFFFAOYSA-N	0	0	298.773	4.416	20	30		CIEDRN
N#CCCN(Cc1cc(Cl)cc2cccnc21)CC1CC1	ZINC000081070730	260330496	/nfs/dbraw/zinc/33/04/96/260330496.db2.gz	SNGBPSBGBHIUFW-UHFFFAOYSA-N	0	0	299.805	4.014	20	30		CIEDRN
CC(C)(C#N)CCNc1ccc(Cl)cc1Cl	ZINC000083637603	260353868	/nfs/dbraw/zinc/35/38/68/260353868.db2.gz	CIJJLAYOXPFGEW-UHFFFAOYSA-N	0	0	257.164	4.345	20	30		CIEDRN
CSCc1cccc(Nc2cccc(F)c2C#N)c1	ZINC000518318717	260376038	/nfs/dbraw/zinc/37/60/38/260376038.db2.gz	ZKNXFSXZSFUJNG-UHFFFAOYSA-N	0	0	272.348	4.304	20	30		CIEDRN
CSCc1cccc(Nc2ccc([N+](=O)[O-])cc2C#N)c1	ZINC000518318381	260376162	/nfs/dbraw/zinc/37/61/62/260376162.db2.gz	TXCGGIORMGTOOG-UHFFFAOYSA-N	0	0	299.355	4.073	20	30		CIEDRN
N#Cc1ccc(NCc2csc(C3CCCC3)n2)cc1	ZINC000086188578	260387084	/nfs/dbraw/zinc/38/70/84/260387084.db2.gz	ZOCGHIYJPSJGGX-UHFFFAOYSA-N	0	0	283.400	4.284	20	30		CIEDRN
C=CCCc1ccccc1NCc1c(C)onc1CC	ZINC000409880837	260434695	/nfs/dbraw/zinc/43/46/95/260434695.db2.gz	SZGZBMLJOOXBCW-UHFFFAOYSA-N	0	0	270.376	4.276	20	30		CIEDRN
CC(C)[C@@H](NC(=O)Nc1cccc(C#N)c1)c1ccccc1	ZINC000410094404	260460445	/nfs/dbraw/zinc/46/04/45/260460445.db2.gz	JGKVFKVJBICBNB-QGZVFWFLSA-N	0	0	293.370	4.077	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1oc2c(cccc2C)c1C	ZINC000410122408	260463734	/nfs/dbraw/zinc/46/37/34/260463734.db2.gz	CEDWAAVXSMXTFC-ZDUSSCGKSA-N	0	0	271.360	4.134	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)CCSc1ccc(Cl)cc1	ZINC000410133816	260464433	/nfs/dbraw/zinc/46/44/33/260464433.db2.gz	JQYQPHCHTQNBBG-CYBMUJFWSA-N	0	0	297.851	4.293	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1cc2cc(C)c(C)cc2o1	ZINC000410132518	260464540	/nfs/dbraw/zinc/46/45/40/260464540.db2.gz	WUKXUYLHJHGUQG-CQSZACIVSA-N	0	0	271.360	4.134	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)[C@H](C)CSCc1ccccc1	ZINC000410134321	260464560	/nfs/dbraw/zinc/46/45/60/260464560.db2.gz	IBTOKTIYIBSULP-GDBMZVCRSA-N	0	0	291.460	4.027	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Cc1coc2c1ccc(C)c2C	ZINC000410142889	260465850	/nfs/dbraw/zinc/46/58/50/260465850.db2.gz	NETJXQDJRFLYNI-HNNXBMFYSA-N	0	0	285.387	4.063	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)C[C@@H](C)Cc1ccc(Cl)cc1	ZINC000410139834	260466309	/nfs/dbraw/zinc/46/63/09/260466309.db2.gz	ZYYHZQQUKJKDHK-XJKSGUPXSA-N	0	0	293.838	4.380	20	30		CIEDRN
C=CCc1cc(C)cc(OC)c1OCCC(C)(C)C#N	ZINC000410313567	260481925	/nfs/dbraw/zinc/48/19/25/260481925.db2.gz	RWZJHOWYNHGJRC-UHFFFAOYSA-N	0	0	273.376	4.051	20	30		CIEDRN
C=CCCCC(=O)N[C@@]1(c2ccc(Cl)cc2)C[C@@H]1C	ZINC000410373581	260492434	/nfs/dbraw/zinc/49/24/34/260492434.db2.gz	KOOIMBYZWWERRR-LRDDRELGSA-N	0	0	277.795	4.048	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)C[C@@H](OCC)C(C)C	ZINC000410375560	260492807	/nfs/dbraw/zinc/49/28/07/260492807.db2.gz	QHDDFNAKJVFSIR-QGZVFWFLSA-N	0	0	289.419	4.195	20	30		CIEDRN
C=CCCCNC(=O)N1CCC[C@H]1c1ccc(C)c(C)c1	ZINC000448028955	260593770	/nfs/dbraw/zinc/59/37/70/260593770.db2.gz	FJBFBVOZWCSGHT-KRWDZBQOSA-N	0	0	286.419	4.116	20	30		CIEDRN
C=C(C)CN(C)C(=O)Nc1ccccc1OC1CCCC1	ZINC000181596108	260593914	/nfs/dbraw/zinc/59/39/14/260593914.db2.gz	NHJGBODVZMBYRS-UHFFFAOYSA-N	0	0	288.391	4.048	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@@H](C)c1ccc(SCC)cc1	ZINC000448912400	260642586	/nfs/dbraw/zinc/64/25/86/260642586.db2.gz	OHGCHKINTBFWAY-LBPRGKRZSA-N	0	0	277.433	4.188	20	30		CIEDRN
Cc1ccc([C@H](C)N[C@@H](C)c2ccc(C#N)cc2F)o1	ZINC000358599165	260666381	/nfs/dbraw/zinc/66/63/81/260666381.db2.gz	ZGPZJJXYUUUWBJ-RYUDHWBXSA-N	0	0	272.323	4.011	20	30		CIEDRN
CC(C)(C)c1csc(CO/N=C/c2cccs2)n1	ZINC000120616227	260703804	/nfs/dbraw/zinc/70/38/04/260703804.db2.gz	VDISTIMHSVMVFI-VGOFMYFVSA-N	0	0	280.418	4.053	20	30		CIEDRN
Cc1c2ccsc2nc(-c2ccccc2)c1C#N	ZINC000427471719	260744631	/nfs/dbraw/zinc/74/46/31/260744631.db2.gz	MXXUQWXTCDNUER-UHFFFAOYSA-N	0	0	250.326	4.143	20	30		CIEDRN
C=CCC[C@H](Nc1ccc2nccnc2n1)c1ccccc1	ZINC000154569815	260749732	/nfs/dbraw/zinc/74/97/32/260749732.db2.gz	FVAQRJIDFNHDQO-HNNXBMFYSA-N	0	0	290.370	4.144	20	30		CIEDRN
N#Cc1c(F)cccc1CNc1ccc(Cl)cc1F	ZINC000427517972	260756680	/nfs/dbraw/zinc/75/66/80/260756680.db2.gz	YZPMZLZCXDEAJC-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
CCCc1ccccc1NCc1cccc(F)c1C#N	ZINC000427542266	260764686	/nfs/dbraw/zinc/76/46/86/260764686.db2.gz	WRVAYBMGMWPWKB-UHFFFAOYSA-N	0	0	268.335	4.262	20	30		CIEDRN
C=CCC[C@H](C(=O)Nc1cc(F)ccc1O)c1ccccc1	ZINC000427660487	260800741	/nfs/dbraw/zinc/80/07/41/260800741.db2.gz	SSXNXXYNPDSBDU-HNNXBMFYSA-N	0	0	299.345	4.220	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1coc(-c2ccccc2)n1	ZINC000156859524	260809770	/nfs/dbraw/zinc/80/97/70/260809770.db2.gz	ROMVTGYQNWOAKF-UHFFFAOYSA-N	0	0	298.386	4.160	20	30		CIEDRN
CC(C)COc1ccccc1CNc1cccc(CC#N)c1	ZINC000449698521	260812060	/nfs/dbraw/zinc/81/20/60/260812060.db2.gz	NEYVOSVXIDMQPU-UHFFFAOYSA-N	0	0	294.398	4.400	20	30		CIEDRN
C=CCCCNC(=O)N[C@H](C)c1cccc2ccccc21	ZINC000448095233	260831073	/nfs/dbraw/zinc/83/10/73/260831073.db2.gz	UUYUZUUMKWOBLL-CQSZACIVSA-N	0	0	282.387	4.166	20	30		CIEDRN
C[C@H](C1CC1)n1cc(N[C@@H](C)c2ccc(C#N)c(F)c2)cn1	ZINC000427857435	260861386	/nfs/dbraw/zinc/86/13/86/260861386.db2.gz	QIIJJIKTFJHXNO-NWDGAFQWSA-N	0	0	298.365	4.038	20	30		CIEDRN
CCCCCc1ccc(NC(=O)c2ccc(C#N)o2)cc1	ZINC000427985149	260899047	/nfs/dbraw/zinc/89/90/47/260899047.db2.gz	SAZQIKISROZNMW-UHFFFAOYSA-N	0	0	282.343	4.136	20	30		CIEDRN
N#Cc1ccc(Cl)cc1NCc1cc(F)cc(F)c1	ZINC000169261151	260921107	/nfs/dbraw/zinc/92/11/07/260921107.db2.gz	LSWLQYHDKHZDBM-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
CC[C@H](C)c1ccc(OC[C@@H](C#N)CCC#N)cc1	ZINC000153052691	261073077	/nfs/dbraw/zinc/07/30/77/261073077.db2.gz	SPPFDCZUDYIDND-UONOGXRCSA-N	0	0	256.349	4.022	20	30		CIEDRN
Cc1cccc(C(=O)N[C@@H](CCC#N)c2ccccc2)c1C	ZINC000153368940	261077866	/nfs/dbraw/zinc/07/78/66/261077866.db2.gz	PHZHEFCTJCAMQS-SFHVURJKSA-N	0	0	292.382	4.078	20	30		CIEDRN
Cc1ccc(C)c(C(=O)N[C@H](CCC#N)c2ccccc2)c1	ZINC000153445141	261078365	/nfs/dbraw/zinc/07/83/65/261078365.db2.gz	HEYBJOVEJRMKAB-GOSISDBHSA-N	0	0	292.382	4.078	20	30		CIEDRN
C[C@H](C(=O)N[C@@H](CCC#N)c1ccccc1)c1cccs1	ZINC000153576070	261080450	/nfs/dbraw/zinc/08/04/50/261080450.db2.gz	KTZATSDPTFWIAK-ZFWWWQNUSA-N	0	0	298.411	4.013	20	30		CIEDRN
N#CCC[C@@H](NC(=O)C1CCCCCC1)c1ccccc1	ZINC000153689371	261081748	/nfs/dbraw/zinc/08/17/48/261081748.db2.gz	PJTCZZKZSZGKHI-QGZVFWFLSA-N	0	0	284.403	4.118	20	30		CIEDRN
CCCCCCCCC(=O)Nc1c(C)noc1CC	ZINC000154039303	261086711	/nfs/dbraw/zinc/08/67/11/261086711.db2.gz	AMHLXNMWTASUEX-UHFFFAOYSA-N	0	0	266.385	4.235	20	30		CIEDRN
N#CCC[C@@H](NC(=O)C1=CCCCCC1)c1ccccc1	ZINC000154140369	261087884	/nfs/dbraw/zinc/08/78/84/261087884.db2.gz	KLLGBIJKOPMPLL-QGZVFWFLSA-N	0	0	282.387	4.038	20	30		CIEDRN
N#CCC[C@H](NC(=O)C1=CCCCCC1)c1ccccc1	ZINC000154140474	261088037	/nfs/dbraw/zinc/08/80/37/261088037.db2.gz	KLLGBIJKOPMPLL-KRWDZBQOSA-N	0	0	282.387	4.038	20	30		CIEDRN
Cc1ccc(C(=O)Nc2cc(C(C)(C)C)sc2C#N)o1	ZINC000154277682	261089740	/nfs/dbraw/zinc/08/97/40/261089740.db2.gz	ADKAXZBTKILUOH-UHFFFAOYSA-N	0	0	288.372	4.071	20	30		CIEDRN
C=CCCN(C)C(=O)N[C@@H]1C[C@H](C(C)C)c2ccccc21	ZINC000448288888	261091520	/nfs/dbraw/zinc/09/15/20/261091520.db2.gz	FEUOZUADXOSNAQ-IAGOWNOFSA-N	0	0	286.419	4.089	20	30		CIEDRN
CC(C)(C#N)c1ccccc1CSc1nccs1	ZINC000154656942	261093935	/nfs/dbraw/zinc/09/39/35/261093935.db2.gz	AZJUYTLAXFHXNY-UHFFFAOYSA-N	0	0	274.414	4.237	20	30		CIEDRN
Cc1nc(NC(c2ccccc2)c2ccccc2)ccc1C#N	ZINC000323329640	261149993	/nfs/dbraw/zinc/14/99/93/261149993.db2.gz	LWENNROYBJWVSZ-UHFFFAOYSA-N	0	0	299.377	4.463	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)N[C@@H](C)C1CCCC1	ZINC000172194677	261153154	/nfs/dbraw/zinc/15/31/54/261153154.db2.gz	GQBOLWNWCXUWOR-ZDUSSCGKSA-N	0	0	292.448	4.024	20	30		CIEDRN
Cc1cc2cc(C(=O)NC3(C#N)CCCCC3)oc2cc1C	ZINC000172947336	261155080	/nfs/dbraw/zinc/15/50/80/261155080.db2.gz	NHKWDTHNDYUANX-UHFFFAOYSA-N	0	0	296.370	4.006	20	30		CIEDRN
CCCCCCCC(=O)N[C@H](CC)c1ccncc1	ZINC000158020102	261157498	/nfs/dbraw/zinc/15/74/98/261157498.db2.gz	PDIHMBNDJKTVGB-OAHLLOKOSA-N	0	0	262.397	4.009	20	30		CIEDRN
C[C@H](Nc1ccc2ncsc2c1)c1ccc(C#N)cc1	ZINC000173920365	261173282	/nfs/dbraw/zinc/17/32/82/261173282.db2.gz	GXOJUVKIKJGMPP-NSHDSACASA-N	0	0	279.368	4.341	20	30		CIEDRN
C[C@@H](C(=O)Nc1cccc(C#N)c1)c1ccc(Cl)s1	ZINC000174923895	261201098	/nfs/dbraw/zinc/20/10/98/261201098.db2.gz	YCTOVZPCRVQUNF-SECBINFHSA-N	0	0	290.775	4.015	20	30		CIEDRN
N#Cc1c(NC(=O)CC2CCC2)sc2c1CCCCC2	ZINC000175048332	261205707	/nfs/dbraw/zinc/20/57/07/261205707.db2.gz	MCPZOKHFPAHOEP-UHFFFAOYSA-N	0	0	288.416	4.017	20	30		CIEDRN
C[C@H](C(=O)Nc1ccc(C#N)cc1)c1ccc(Cl)s1	ZINC000175124168	261210078	/nfs/dbraw/zinc/21/00/78/261210078.db2.gz	YRNXTFILGRMOBK-VIFPVBQESA-N	0	0	290.775	4.015	20	30		CIEDRN
N#Cc1cc(F)ccc1N[C@H]1CCO[C@H](c2ccccc2)C1	ZINC000160623703	261220796	/nfs/dbraw/zinc/22/07/96/261220796.db2.gz	KAOQSXBQOOKWQG-WMZOPIPTSA-N	0	0	296.345	4.030	20	30		CIEDRN
N#Cc1c(F)cccc1N[C@@H]1CCO[C@H](c2ccccc2)C1	ZINC000160685231	261222456	/nfs/dbraw/zinc/22/24/56/261222456.db2.gz	YKJVSJBLKVKNHG-KDOFPFPSSA-N	0	0	296.345	4.030	20	30		CIEDRN
N#Cc1c(F)cccc1N[C@H]1CCO[C@@H](c2ccccc2)C1	ZINC000160685598	261222636	/nfs/dbraw/zinc/22/26/36/261222636.db2.gz	YKJVSJBLKVKNHG-KBXCAEBGSA-N	0	0	296.345	4.030	20	30		CIEDRN
CC[C@H]1CCCCN1C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000160730384	261225038	/nfs/dbraw/zinc/22/50/38/261225038.db2.gz	YXRHVRISDQJALZ-DLBZAZTESA-N	0	0	299.418	4.006	20	30		CIEDRN
N#C[C@H](Nc1ccc2c(c1)C(=O)CCC2)C1CCCCC1	ZINC000175514298	261231683	/nfs/dbraw/zinc/23/16/83/261231683.db2.gz	QNGVGIFZUJUHQK-KRWDZBQOSA-N	0	0	282.387	4.090	20	30		CIEDRN
CC(C)(C#N)CCCSCCOc1cccc(C#N)c1	ZINC000161551256	261250371	/nfs/dbraw/zinc/25/03/71/261250371.db2.gz	ODERAUWWXPSQPX-UHFFFAOYSA-N	0	0	288.416	4.000	20	30		CIEDRN
C[C@H](SCCCCC#N)c1c(F)cccc1F	ZINC000161556008	261251383	/nfs/dbraw/zinc/25/13/83/261251383.db2.gz	UIBQZXHICLFHLW-JTQLQIEISA-N	0	0	255.333	4.453	20	30		CIEDRN
N#CCCCCSCc1csc(-c2ccccn2)n1	ZINC000161612293	261253862	/nfs/dbraw/zinc/25/38/62/261253862.db2.gz	RGRUQBJZFZOXPZ-UHFFFAOYSA-N	0	0	289.429	4.132	20	30		CIEDRN
N#Cc1ccc(NCc2ccc(C(F)F)cc2)cc1	ZINC000150060327	261264715	/nfs/dbraw/zinc/26/47/15/261264715.db2.gz	RBQYZUCBTZOICE-UHFFFAOYSA-N	0	0	258.271	4.108	20	30		CIEDRN
CCC(CC)CN(CCC#N)C(=O)c1ccccc1Cl	ZINC000104542582	261296107	/nfs/dbraw/zinc/29/61/07/261296107.db2.gz	YYYYNPJWLZYJKL-UHFFFAOYSA-N	0	0	292.810	4.132	20	30		CIEDRN
C[C@@H](C#N)CSc1ccccc1NCc1nccs1	ZINC000163152330	261307385	/nfs/dbraw/zinc/30/73/85/261307385.db2.gz	XJHNXMRXCJFKAZ-NSHDSACASA-N	0	0	289.429	4.007	20	30		CIEDRN
N#CCc1cccc(C(=O)N2CCCC23CCCCCC3)c1	ZINC000368469323	261322999	/nfs/dbraw/zinc/32/29/99/261322999.db2.gz	FOAUCBYTVSDRST-UHFFFAOYSA-N	0	0	296.414	4.082	20	30		CIEDRN
N#Cc1cccnc1Oc1ccc(Cc2ccccc2)cc1	ZINC000301119495	261329943	/nfs/dbraw/zinc/32/99/43/261329943.db2.gz	PYZTZGPSOPIYDL-UHFFFAOYSA-N	0	0	286.334	4.336	20	30		CIEDRN
CCCc1nc(CSc2cccc(C#N)c2)cs1	ZINC000177098913	261332949	/nfs/dbraw/zinc/33/29/49/261332949.db2.gz	FEJVJSCFEMPHCV-UHFFFAOYSA-N	0	0	274.414	4.260	20	30		CIEDRN
C=CCCC[C@H](C)Nc1nc(C(F)(F)F)ccc1C#N	ZINC000301988539	261345106	/nfs/dbraw/zinc/34/51/06/261345106.db2.gz	DXHUVORHVFGJAK-JTQLQIEISA-N	0	0	283.297	4.129	20	30		CIEDRN
C[C@@H](NCc1ccc(C#N)cc1)c1c(F)cccc1Cl	ZINC000177714344	261367837	/nfs/dbraw/zinc/36/78/37/261367837.db2.gz	BBGMQIRLGVHGJI-LLVKDONJSA-N	0	0	288.753	4.202	20	30		CIEDRN
CCC(CC)c1cc(C(=O)Nc2cccc(C#N)c2C)on1	ZINC000178369572	261388168	/nfs/dbraw/zinc/38/81/68/261388168.db2.gz	NPCZIQAPTUWYBT-UHFFFAOYSA-N	0	0	297.358	4.011	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)C[C@@H](C)c1ccccc1F	ZINC000178380314	261389080	/nfs/dbraw/zinc/38/90/80/261389080.db2.gz	VVANWIPPSGLOQJ-GFCCVEGCSA-N	0	0	296.345	4.138	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)C/C=C/c1cccc(F)c1	ZINC000178403603	261389869	/nfs/dbraw/zinc/38/98/69/261389869.db2.gz	OZWNCVJALWOEHN-ZZXKWVIFSA-N	0	0	294.329	4.048	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)c1csc2ccccc21	ZINC000178626813	261399926	/nfs/dbraw/zinc/39/99/26/261399926.db2.gz	USQPBTXWPALMLE-UHFFFAOYSA-N	0	0	292.363	4.334	20	30		CIEDRN
CC(C)n1ccc(CS[C@H](C)c2ccc(C#N)cc2)n1	ZINC000172418074	261500668	/nfs/dbraw/zinc/50/06/68/261500668.db2.gz	YANAMSUODUUMBX-CYBMUJFWSA-N	0	0	285.416	4.330	20	30		CIEDRN
N#Cc1ccc(NCc2cc3ccccc3o2)c(F)c1	ZINC000112012039	261567882	/nfs/dbraw/zinc/56/78/82/261567882.db2.gz	OURXEIWQYYGEHP-UHFFFAOYSA-N	0	0	266.275	4.056	20	30		CIEDRN
N#Cc1c(F)cccc1Oc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000112012530	261568196	/nfs/dbraw/zinc/56/81/96/261568196.db2.gz	QNMMDIXASPZDGK-UHFFFAOYSA-N	0	0	292.653	4.051	20	30		CIEDRN
C=CCCN(C)C(=O)N[C@H](c1ccc(F)cc1)C(C)(C)C	ZINC000466978882	261619996	/nfs/dbraw/zinc/61/99/96/261619996.db2.gz	KCQXVIACQYKDSM-OAHLLOKOSA-N	0	0	292.398	4.130	20	30		CIEDRN
CCC(CC)CN(CCC#N)C(=O)Nc1ccccc1F	ZINC000176338665	261650147	/nfs/dbraw/zinc/65/01/47/261650147.db2.gz	RDONBTMDPUPTBF-UHFFFAOYSA-N	0	0	291.370	4.009	20	30		CIEDRN
C=CCc1ccc(OCc2ccccc2OC)c(OC)c1	ZINC000514490122	261748539	/nfs/dbraw/zinc/74/85/39/261748539.db2.gz	YXLZCXDPOXEARZ-UHFFFAOYSA-N	0	0	284.355	4.011	20	30		CIEDRN
C=CCOc1ccc(CN(C(=O)CCC)C(C)(C)C)cc1	ZINC000188078849	261841816	/nfs/dbraw/zinc/84/18/16/261841816.db2.gz	BENZPIGNXKLKRC-UHFFFAOYSA-N	0	0	289.419	4.179	20	30		CIEDRN
Cc1ccc(Br)cc1OCCCC(C)(C)C#N	ZINC000228334209	261934261	/nfs/dbraw/zinc/93/42/61/261934261.db2.gz	HWWVEZDXTBWHEX-UHFFFAOYSA-N	0	0	296.208	4.466	20	30		CIEDRN
CC[C@@H](CC#N)NC(=O)c1sccc1-c1ccc(C)cc1	ZINC000183824066	261990827	/nfs/dbraw/zinc/99/08/27/261990827.db2.gz	KLAVDNXWTVTIJF-AWEZNQCLSA-N	0	0	298.411	4.146	20	30		CIEDRN
C[C@H](CSC(C)(C)C)Nc1ccc(CC#N)cc1	ZINC000184746513	262027843	/nfs/dbraw/zinc/02/78/43/262027843.db2.gz	WYBUNEMFMWKBIV-GFCCVEGCSA-N	0	0	262.422	4.085	20	30		CIEDRN
CCOc1ccc2ccccc2c1OC[C@H](C#N)CCC#N	ZINC000184773959	262028623	/nfs/dbraw/zinc/02/86/23/262028623.db2.gz	IJRJZHFJQOOUDV-AWEZNQCLSA-N	0	0	294.354	4.061	20	30		CIEDRN
N#CCC[C@@H](C#N)CSCCCCc1ccccc1	ZINC000185081319	262040174	/nfs/dbraw/zinc/04/01/74/262040174.db2.gz	VFRMJSSKAASHLF-INIZCTEOSA-N	0	0	272.417	4.186	20	30		CIEDRN
CCCOc1cc(C)ccc1NCc1ccc(F)c(C#N)c1	ZINC000318755430	262051747	/nfs/dbraw/zinc/05/17/47/262051747.db2.gz	VLZQKJKGDUVGTM-UHFFFAOYSA-N	0	0	298.361	4.407	20	30		CIEDRN
C[C@@H]([NH2+]CCCCC#N)c1ccc(Cl)c(Cl)c1[O-]	ZINC000185339555	262051924	/nfs/dbraw/zinc/05/19/24/262051924.db2.gz	RNARZCZMLDKRLQ-SECBINFHSA-N	0	0	287.190	4.043	20	30		CIEDRN
N#C[C@H]1CCC[C@H](Nc2ccccc2N2CCCCC2)C1	ZINC000185731584	262068576	/nfs/dbraw/zinc/06/85/76/262068576.db2.gz	PYIVUEXCKIOPJD-HOTGVXAUSA-N	0	0	283.419	4.171	20	30		CIEDRN
N#C[C@@H]1CCC[C@@H](Nc2ccc(SC(F)F)cc2)C1	ZINC000185734749	262068634	/nfs/dbraw/zinc/06/86/34/262068634.db2.gz	LCTIKPNXLVCGBG-ZYHUDNBSSA-N	0	0	282.359	4.496	20	30		CIEDRN
CC(C)c1ccc(NC(=O)N[C@@H](C)CC#N)c(C(C)C)c1	ZINC000186061379	262077366	/nfs/dbraw/zinc/07/73/66/262077366.db2.gz	RKWZEYIOXFQOGJ-ZDUSSCGKSA-N	0	0	287.407	4.357	20	30		CIEDRN
COc1ccc(NCC(C)(C)CCC#N)cc1OC(C)C	ZINC000186282268	262087423	/nfs/dbraw/zinc/08/74/23/262087423.db2.gz	OBIKBDYYUIILRJ-UHFFFAOYSA-N	0	0	290.407	4.224	20	30		CIEDRN
CCN(C(=O)C[C@@H]1C=CCCC1)[C@H](C)c1ccc(C#N)cc1	ZINC000186525957	262097130	/nfs/dbraw/zinc/09/71/30/262097130.db2.gz	NCUFWQPXCQKPJS-HZPDHXFCSA-N	0	0	296.414	4.214	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC(c2cccc(F)c2)CC1	ZINC000364057950	262128714	/nfs/dbraw/zinc/12/87/14/262128714.db2.gz	RRXMNHBCOAUIHD-CQSZACIVSA-N	0	0	289.394	4.134	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)c1ccc(F)cc1Cl	ZINC000187528705	262139684	/nfs/dbraw/zinc/13/96/84/262139684.db2.gz	HIUBYDFSIIERTC-UHFFFAOYSA-N	0	0	296.773	4.024	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@@H](CC(C)C)c1cccs1	ZINC000497363522	262147227	/nfs/dbraw/zinc/14/72/27/262147227.db2.gz	GBSCPYSUNTZFKQ-ZDUSSCGKSA-N	0	0	280.437	4.053	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2ccc(/C=C\C)cc2)CC1	ZINC000497376648	262148872	/nfs/dbraw/zinc/14/88/72/262148872.db2.gz	MOOGCXDYPJLDHL-HYXAFXHYSA-N	0	0	270.376	4.150	20	30		CIEDRN
C=CCCCSCC(=O)N1CCC[C@@H]1c1ccsc1	ZINC000371802230	262158235	/nfs/dbraw/zinc/15/82/35/262158235.db2.gz	OSSYWLJKBNXHLB-CQSZACIVSA-N	0	0	295.473	4.111	20	30		CIEDRN
CC(C)c1ccc2occ(C(=O)N(C)CC(C)(C)C#N)c2c1	ZINC000497423812	262159444	/nfs/dbraw/zinc/15/94/44/262159444.db2.gz	ABPFDUAXXBKUNH-UHFFFAOYSA-N	0	0	298.386	4.178	20	30		CIEDRN
C=CCOc1ccc(C(=O)N(CC(C)C)CC(C)C)cc1	ZINC000497463415	262164562	/nfs/dbraw/zinc/16/45/62/262164562.db2.gz	GHXMAWBUZPFOCI-UHFFFAOYSA-N	0	0	289.419	4.006	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)[C@@H](C)CC1CCCC1	ZINC000189951700	262177579	/nfs/dbraw/zinc/17/75/79/262177579.db2.gz	XUVOPWBJOKSJJG-AWEZNQCLSA-N	0	0	278.440	4.134	20	30		CIEDRN
N#CCC[C@H](C#N)CSCc1ccccc1Cl	ZINC000190677880	262184951	/nfs/dbraw/zinc/18/49/51/262184951.db2.gz	SUOBPAXYWWQXAA-LLVKDONJSA-N	0	0	264.781	4.017	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cccc(O[C@H](C)CC)c1	ZINC000497657976	262186072	/nfs/dbraw/zinc/18/60/72/262186072.db2.gz	UKUCCRNVHUZAGS-CYBMUJFWSA-N	0	0	275.392	4.405	20	30		CIEDRN
N#CCCCSCc1ccn(-c2ccc(Cl)cc2)n1	ZINC000191019236	262187806	/nfs/dbraw/zinc/18/78/06/262187806.db2.gz	ZZTKXLUMXDGKNW-UHFFFAOYSA-N	0	0	291.807	4.063	20	30		CIEDRN
C[C@@H](Sc1cc(C#N)ccn1)c1ccc(F)c(F)c1	ZINC000497670982	262187950	/nfs/dbraw/zinc/18/79/50/262187950.db2.gz	JCHBDNXKWHUTPI-SECBINFHSA-N	0	0	276.311	4.085	20	30		CIEDRN
CC#CCCNC(=O)Nc1c(C(C)C)cccc1C(C)C	ZINC000497685096	262189824	/nfs/dbraw/zinc/18/98/24/262189824.db2.gz	CHPRYMQXMYSNAK-UHFFFAOYSA-N	0	0	286.419	4.468	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)c1ccc(CC)cc1	ZINC000497791938	262210205	/nfs/dbraw/zinc/21/02/05/262210205.db2.gz	XLRZVGVNXZKQBM-UHFFFAOYSA-N	0	0	279.383	4.077	20	30		CIEDRN
N#C[C@H]1CCC[C@@H](Nc2ccc3oc(C4CC4)nc3c2)C1	ZINC000193083932	262215524	/nfs/dbraw/zinc/21/55/24/262215524.db2.gz	AYYSQRCPXHMKPZ-WCQYABFASA-N	0	0	281.359	4.199	20	30		CIEDRN
N#Cc1ccc(CNc2cccc3ccccc32)c(F)c1	ZINC000020039257	262226977	/nfs/dbraw/zinc/22/69/77/262226977.db2.gz	QQSLKNIBSHHFFX-UHFFFAOYSA-N	0	0	276.314	4.463	20	30		CIEDRN
C[C@H]1C[C@@H](c2cccc(F)c2)[N@H+](Cc2ccc(C#N)cc2)C1	ZINC000525783951	262233099	/nfs/dbraw/zinc/23/30/99/262233099.db2.gz	ZMHXDBIPMAOTMG-LIRRHRJNSA-N	0	0	294.373	4.280	20	30		CIEDRN
CCCC[C@H](C)C(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1	ZINC000502994088	262235795	/nfs/dbraw/zinc/23/57/95/262235795.db2.gz	AAAKUXCUHGKIBU-RYQLBKOJSA-N	0	0	298.430	4.111	20	30		CIEDRN
CCCOc1cccc2c(NCCCCC#N)ccnc12	ZINC000194713023	262241856	/nfs/dbraw/zinc/24/18/56/262241856.db2.gz	VBWQEICHEWYMFT-UHFFFAOYSA-N	0	0	283.375	4.129	20	30		CIEDRN
Cc1cc(S[C@H](C)CCC#N)nc2ccccc12	ZINC000188223674	262285579	/nfs/dbraw/zinc/28/55/79/262285579.db2.gz	ATSMQXQENKUDMR-GFCCVEGCSA-N	0	0	256.374	4.328	20	30		CIEDRN
CCc1ccc(CNc2ccc(Cl)cc2C#N)s1	ZINC000221702842	262290915	/nfs/dbraw/zinc/29/09/15/262290915.db2.gz	RSXDWICJSWEPBE-UHFFFAOYSA-N	0	0	276.792	4.448	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cc(C)ccc1Cl	ZINC000188522107	262307576	/nfs/dbraw/zinc/30/75/76/262307576.db2.gz	ZPLVCDLHOKWQSE-CQSZACIVSA-N	0	0	251.757	4.189	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N(C)Cc1ccc(Cl)c(F)c1	ZINC000188554319	262316179	/nfs/dbraw/zinc/31/61/79/262316179.db2.gz	WFNOLKNJLBKYHP-OAHLLOKOSA-N	0	0	283.774	4.040	20	30		CIEDRN
CCCC[C@H](CCC)NC(=O)[C@H](C)c1cccc(C#N)c1	ZINC000462201862	262318197	/nfs/dbraw/zinc/31/81/97/262318197.db2.gz	FDSFUBWYMXXADF-PBHICJAKSA-N	0	0	286.419	4.137	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(OC)c(OC(C)C)c1	ZINC000188585258	262320817	/nfs/dbraw/zinc/32/08/17/262320817.db2.gz	GGBZKXIZOBZDOQ-KRWDZBQOSA-N	0	0	291.391	4.023	20	30		CIEDRN
C[C@@H]1C[C@H]1CC(=O)Nc1sc(-c2ccccc2)cc1C#N	ZINC000463465780	262326829	/nfs/dbraw/zinc/32/68/29/262326829.db2.gz	CEIRHGRHGZPAJA-YPMHNXCESA-N	0	0	296.395	4.271	20	30		CIEDRN
C=CCOc1ccccc1C(=O)Nc1ccsc1Cl	ZINC000186933770	262329551	/nfs/dbraw/zinc/32/95/51/262329551.db2.gz	UEWDNRISRDDXGO-UHFFFAOYSA-N	0	0	293.775	4.219	20	30		CIEDRN
Cc1cc(F)ccc1CNc1cccc(OCCCC#N)c1	ZINC000122193921	262344965	/nfs/dbraw/zinc/34/49/65/262344965.db2.gz	HYBGDTVPBBDDBS-UHFFFAOYSA-N	0	0	298.361	4.429	20	30		CIEDRN
N#Cc1ccc(Cl)cc1N[C@H]1CCOC2(CCCC2)C1	ZINC000094373971	262350027	/nfs/dbraw/zinc/35/00/27/262350027.db2.gz	CUOHYSJRVWYRCC-AWEZNQCLSA-N	0	0	290.794	4.115	20	30		CIEDRN
N#CCc1ccc(NCc2coc3ccccc23)cc1	ZINC000159809555	262375983	/nfs/dbraw/zinc/37/59/83/262375983.db2.gz	SUWQIFDYOALQTQ-UHFFFAOYSA-N	0	0	262.312	4.111	20	30		CIEDRN
Cc1cccc(NCCOc2cccc(C#N)c2)c1Cl	ZINC000525825594	262389590	/nfs/dbraw/zinc/38/95/90/262389590.db2.gz	LSEHGGFXARAWDN-UHFFFAOYSA-N	0	0	286.762	4.011	20	30		CIEDRN
CC1(C#N)CCN(Cc2cccc(Cl)c2Cl)CC1	ZINC000227521049	262391858	/nfs/dbraw/zinc/39/18/58/262391858.db2.gz	ONHYCYPCEQYKDW-UHFFFAOYSA-N	0	0	283.202	4.119	20	30		CIEDRN
C=CCc1ccccc1OCc1nc(C)sc1C	ZINC000337655122	262465066	/nfs/dbraw/zinc/46/50/66/262465066.db2.gz	DWKKHFLXGJKKIC-UHFFFAOYSA-N	0	0	259.374	4.067	20	30		CIEDRN
N#Cc1ccc(/C=C/c2ccc(C(F)F)cc2)nc1	ZINC000575230896	335085535	/nfs/dbraw/zinc/08/55/35/335085535.db2.gz	BSTUQNNHNRYXOQ-XVNBXDOJSA-N	0	0	256.255	4.061	20	30		CIEDRN
CCCC(CCC)C(=O)Nc1scc(C)c1C#N	ZINC000410863141	262669736	/nfs/dbraw/zinc/66/97/36/262669736.db2.gz	XMBYCDZPZFUDOL-UHFFFAOYSA-N	0	0	264.394	4.083	20	30		CIEDRN
C=CCCCC(=O)N(C(C)C)[C@@H](C)c1ccccc1	ZINC000410898541	262672453	/nfs/dbraw/zinc/67/24/53/262672453.db2.gz	WVSOTVJUPKADHS-HNNXBMFYSA-N	0	0	259.393	4.341	20	30		CIEDRN
CC(C)(C)c1csc(NC(=O)CC2(C)CC2)c1C#N	ZINC000410928702	262673379	/nfs/dbraw/zinc/67/33/79/262673379.db2.gz	JUDGEAIDSQTGFG-UHFFFAOYSA-N	0	0	276.405	4.046	20	30		CIEDRN
C[C@@H](CCC#N)Sc1nccn1-c1ccc(Cl)cc1	ZINC000412981836	262750024	/nfs/dbraw/zinc/75/00/24/262750024.db2.gz	HDFOSPXKCDENRL-NSHDSACASA-N	0	0	291.807	4.310	20	30		CIEDRN
N#CCCSCCOc1cc(Cl)ccc1Cl	ZINC000413012323	262752603	/nfs/dbraw/zinc/75/26/03/262752603.db2.gz	LELDVQNWYGGMAE-UHFFFAOYSA-N	0	0	276.188	4.019	20	30		CIEDRN
C=CCn1c(SCc2ccc(C)cc2C)nnc1C1CC1	ZINC000412975667	262753638	/nfs/dbraw/zinc/75/36/38/262753638.db2.gz	GKKGWJGRQIZWOE-UHFFFAOYSA-N	0	0	299.443	4.251	20	30		CIEDRN
Cc1c(Cl)cnc(NC2CCC(C(F)F)CC2)c1C#N	ZINC000413431609	262762907	/nfs/dbraw/zinc/76/29/07/262762907.db2.gz	ANVSGADNQVJXTL-UHFFFAOYSA-N	0	0	299.752	4.151	20	30		CIEDRN
CCCCC(=O)Nc1ccccc1SC[C@H](C)C#N	ZINC000264496496	262889408	/nfs/dbraw/zinc/88/94/08/262889408.db2.gz	FOMNHHWGLHSYAN-GFCCVEGCSA-N	0	0	276.405	4.067	20	30		CIEDRN
CCN(CCC#N)C(=O)Nc1cccc(-c2cccs2)c1	ZINC000267450163	262931583	/nfs/dbraw/zinc/93/15/83/262931583.db2.gz	MRTVPECOCGRTSJ-UHFFFAOYSA-N	0	0	299.399	4.183	20	30		CIEDRN
CC(C)(C)c1ccc(C[NH+]2CCC(C)(C#N)CC2)s1	ZINC000272512711	263005611	/nfs/dbraw/zinc/00/56/11/263005611.db2.gz	JIFPQDYPAWSFGV-UHFFFAOYSA-N	0	0	276.449	4.171	20	30		CIEDRN
C[C@@H](c1cccc(Cl)c1)[NH+]1CCC(C)(C#N)CC1	ZINC000272514004	263005737	/nfs/dbraw/zinc/00/57/37/263005737.db2.gz	GOXPUIWNRPWBRT-LBPRGKRZSA-N	0	0	262.784	4.027	20	30		CIEDRN
CC1(C#N)CC[NH+](C2c3ccccc3-c3ccccc32)CC1	ZINC000272580760	263006967	/nfs/dbraw/zinc/00/69/67/263006967.db2.gz	OFMYJMJFERYXBQ-UHFFFAOYSA-N	0	0	288.394	4.382	20	30		CIEDRN
Cc1ccc(N(CCC#N)C(=O)[C@@H](C)c2ccccc2)cc1	ZINC000273103679	263012692	/nfs/dbraw/zinc/01/26/92/263012692.db2.gz	JCFPSIQNLLVLAA-INIZCTEOSA-N	0	0	292.382	4.045	20	30		CIEDRN
N#CCCN(Cc1ccccc1OC1CCCC1)CC1CC1	ZINC000353418855	263023680	/nfs/dbraw/zinc/02/36/80/263023680.db2.gz	HOCOUSKYKIPKKP-UHFFFAOYSA-N	0	0	298.430	4.134	20	30		CIEDRN
CCCN(C(=O)CC#N)[C@H](C)c1ccc(Cl)c(Cl)c1	ZINC000274711396	263029560	/nfs/dbraw/zinc/02/95/60/263029560.db2.gz	LLXKIPNFCSQCOQ-SNVBAGLBSA-N	0	0	299.201	4.207	20	30		CIEDRN
C[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc(Cl)cn1	ZINC000274819117	263030866	/nfs/dbraw/zinc/03/08/66/263030866.db2.gz	BHRMQBDCSRPPLC-SUMWQHHRSA-N	0	0	299.805	4.431	20	30		CIEDRN
CC[C@@H](C#N)Nc1ccccc1COCc1ccccc1	ZINC000275464043	263033277	/nfs/dbraw/zinc/03/32/77/263033277.db2.gz	KSAVZRYRGYBGTB-KRWDZBQOSA-N	0	0	280.371	4.117	20	30		CIEDRN
C[C@H](CC#N)Sc1ccccc1NC(=O)CC(C)(F)F	ZINC000277013068	263039305	/nfs/dbraw/zinc/03/93/05/263039305.db2.gz	LVMHEBGUSZCHBN-SNVBAGLBSA-N	0	0	298.358	4.065	20	30		CIEDRN
C[C@@H](CC#N)Sc1ccccc1NC(=O)CC(C)(F)F	ZINC000277013066	263039310	/nfs/dbraw/zinc/03/93/10/263039310.db2.gz	LVMHEBGUSZCHBN-JTQLQIEISA-N	0	0	298.358	4.065	20	30		CIEDRN
CC(C)(C)[C@@H]1C[C@@H](Nc2ccc(CC#N)cc2)CS1	ZINC000277097085	263039649	/nfs/dbraw/zinc/03/96/49/263039649.db2.gz	GUGWIWIAZXMAFD-CABCVRRESA-N	0	0	274.433	4.085	20	30		CIEDRN
CCCCCCC[C@@H](CC(=O)[O-])[NH2+]Cc1cccs1	ZINC000277142377	263039872	/nfs/dbraw/zinc/03/98/72/263039872.db2.gz	CDDYESGWSJOOSM-ZDUSSCGKSA-N	0	0	283.437	4.042	20	30		CIEDRN
C/C=C(/CC)C(=O)N[C@@H](C#N)c1c(Cl)cccc1Cl	ZINC000277163274	263040006	/nfs/dbraw/zinc/04/00/06/263040006.db2.gz	LHKZYTSGOXQWAB-PPFSTCQPSA-N	0	0	297.185	4.031	20	30		CIEDRN
Cc1ccnc(Cl)c1OCCCCC(C)(C)C#N	ZINC000277507589	263041622	/nfs/dbraw/zinc/04/16/22/263041622.db2.gz	FKJVXCQHKXGTAR-UHFFFAOYSA-N	0	0	266.772	4.142	20	30		CIEDRN
Cc1ncc(CSCCCCC(C)(C)C#N)s1	ZINC000277925209	263044578	/nfs/dbraw/zinc/04/45/78/263044578.db2.gz	PNTNUUCOMAIRMQ-UHFFFAOYSA-N	0	0	268.451	4.405	20	30		CIEDRN
CC(C)(C#N)CCCC[S@@](=O)Cc1cccc(Cl)c1	ZINC000278285768	263046393	/nfs/dbraw/zinc/04/63/93/263046393.db2.gz	PNCHGSHUHIHMDX-LJQANCHMSA-N	0	0	297.851	4.309	20	30		CIEDRN
CCc1ccc(Cl)c(CC)c1NC(=O)CC(C)(C)C#N	ZINC000278305245	263046597	/nfs/dbraw/zinc/04/65/97/263046597.db2.gz	RYRQQEMFFVPFQC-UHFFFAOYSA-N	0	0	292.810	4.343	20	30		CIEDRN
CC(C)(C#N)CC(=O)Nc1ccccc1CCC(F)(F)F	ZINC000278292267	263046789	/nfs/dbraw/zinc/04/67/89/263046789.db2.gz	AFUJUJXJJGYSKE-UHFFFAOYSA-N	0	0	298.308	4.060	20	30		CIEDRN
CC(C)Oc1c(Cl)cccc1NC(=O)CC(C)(C)C#N	ZINC000278359893	263047244	/nfs/dbraw/zinc/04/72/44/263047244.db2.gz	NYQIYCZLOGETPZ-UHFFFAOYSA-N	0	0	294.782	4.006	20	30		CIEDRN
Cn1c2ccc(Cl)cc2nc1S[C@@H]1CC[C@H](C#N)C1	ZINC000278658130	263049408	/nfs/dbraw/zinc/04/94/08/263049408.db2.gz	WUUKSIKIQCHUKQ-GXSJLCMTSA-N	0	0	291.807	4.011	20	30		CIEDRN
CC(C)(C)Sc1ccc(NC(=O)CC(C)(C)C#N)cc1	ZINC000278727697	263050205	/nfs/dbraw/zinc/05/02/05/263050205.db2.gz	MXXOMLFDKCYHFV-UHFFFAOYSA-N	0	0	290.432	4.456	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)CC(C)(C)C#N	ZINC000278884118	263051509	/nfs/dbraw/zinc/05/15/09/263051509.db2.gz	WNQRSZNMRGQVEF-UHFFFAOYSA-N	0	0	284.403	4.417	20	30		CIEDRN
Cc1ccc(CSCCCC2(C#N)CCOCC2)cc1	ZINC000281954926	263073198	/nfs/dbraw/zinc/07/31/98/263073198.db2.gz	SLFWCIDBXSAKBB-UHFFFAOYSA-N	0	0	289.444	4.329	20	30		CIEDRN
CC(C)(C#N)CCOc1ccccc1-c1nccs1	ZINC000282035952	263073929	/nfs/dbraw/zinc/07/39/29/263073929.db2.gz	WYQGGNLHHPHDLJ-UHFFFAOYSA-N	0	0	272.373	4.129	20	30		CIEDRN
CC(C)c1ccc(NC(=O)NCC2CCC(C#N)CC2)cc1	ZINC000282612135	263077907	/nfs/dbraw/zinc/07/79/07/263077907.db2.gz	GSWTWCSRIQZZRI-UHFFFAOYSA-N	0	0	299.418	4.261	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)Nc1cccc(-c2cccs2)c1	ZINC000285286094	263091734	/nfs/dbraw/zinc/09/17/34/263091734.db2.gz	AWTOUWFCQOKIJR-MRXNPFEDSA-N	0	0	284.384	4.293	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)N[C@@H](C)c1cc(Cl)ccc1Cl	ZINC000286667701	263099131	/nfs/dbraw/zinc/09/91/31/263099131.db2.gz	DBWMUUCYFWBNQC-LKFCYVNXSA-N	0	0	299.201	4.110	20	30		CIEDRN
CC(C)(C#N)CCCOc1cc(C=O)cc(C(F)(F)F)c1	ZINC000289882231	263112430	/nfs/dbraw/zinc/11/24/30/263112430.db2.gz	RWZSUSCHDBQAAB-UHFFFAOYSA-N	0	0	299.292	4.227	20	30		CIEDRN
Cc1cccc([C@H](c2noc(CCCC#N)n2)C(C)C)c1	ZINC000291096607	263119962	/nfs/dbraw/zinc/11/99/62/263119962.db2.gz	QJYBRXNWQNARBF-MRXNPFEDSA-N	0	0	283.375	4.012	20	30		CIEDRN
CC(C)O[C@@H](CSCCCC#N)c1ccccc1	ZINC000292149793	263129044	/nfs/dbraw/zinc/12/90/44/263129044.db2.gz	VEEKLTYOMNCBFX-HNNXBMFYSA-N	0	0	263.406	4.190	20	30		CIEDRN
Cc1ccccc1[C@H](C)N(CC(C)C)C(=O)CCCC#N	ZINC000292183637	263129301	/nfs/dbraw/zinc/12/93/01/263129301.db2.gz	GMXXPYBHFNPQRY-INIZCTEOSA-N	0	0	286.419	4.235	20	30		CIEDRN
C=CCCCC(=O)Nc1ccccc1C(C)(F)F	ZINC000452669483	263129643	/nfs/dbraw/zinc/12/96/43/263129643.db2.gz	JVHNRFDROTUBOX-UHFFFAOYSA-N	0	0	253.292	4.093	20	30		CIEDRN
CCCCCCCCCN(C)C(=O)c1nc(C)oc1C	ZINC000292397860	263131824	/nfs/dbraw/zinc/13/18/24/263131824.db2.gz	CJYCKQPEAOLCQE-UHFFFAOYSA-N	0	0	280.412	4.114	20	30		CIEDRN
C=C(C)CCNC(=O)CCCCCO[C@@H]1CCC[C@@H](C)C1	ZINC000452718767	263136026	/nfs/dbraw/zinc/13/60/26/263136026.db2.gz	QWHIZSHIEBEOEA-IAGOWNOFSA-N	0	0	295.467	4.225	20	30		CIEDRN
CC[C@@H](CC(=O)N[C@H]1CC[C@@H](CC#N)C1)c1ccc(C)cc1	ZINC000295554223	263179326	/nfs/dbraw/zinc/17/93/26/263179326.db2.gz	MWONJFCYCCDXOI-BQFCYCMXSA-N	0	0	298.430	4.077	20	30		CIEDRN
CC[C@H](C)[C@H](C(=O)N[C@H]1CC[C@@H](CC#N)C1)c1ccccc1	ZINC000295600054	263180073	/nfs/dbraw/zinc/18/00/73/263180073.db2.gz	SGPHMCNNKSFUGD-LAQRGFTBSA-N	0	0	298.430	4.015	20	30		CIEDRN
C=CC[C@H](C)NC(=O)c1c(Cl)cc(Cl)cc1Cl	ZINC000295709773	263181443	/nfs/dbraw/zinc/18/14/43/263181443.db2.gz	CRMWTOJFYOEOPQ-ZETCQYMHSA-N	0	0	292.593	4.341	20	30		CIEDRN
CSCc1cnc(/C=C/C(=O)c2cc(C)c(C)o2)s1	ZINC000295754429	263181937	/nfs/dbraw/zinc/18/19/37/263181937.db2.gz	AESHKPDZDBCNFZ-SNAWJCMRSA-N	0	0	293.413	4.112	20	30		CIEDRN
CCc1ccc(C(=O)/C=C/c2ncc(CSC)s2)o1	ZINC000295823332	263182603	/nfs/dbraw/zinc/18/26/03/263182603.db2.gz	GOQRRSRUEVOBHN-FNORWQNLSA-N	0	0	293.413	4.058	20	30		CIEDRN
N#CCC[C@H](C#N)COc1ccc(C2CC2)cc1Cl	ZINC000295879478	263183162	/nfs/dbraw/zinc/18/31/62/263183162.db2.gz	FTHILKHOOFFRQH-LLVKDONJSA-N	0	0	274.751	4.040	20	30		CIEDRN
CCCc1ccccc1NC(=O)[C@]1(C#N)CC12CCCC2	ZINC000298173102	263215591	/nfs/dbraw/zinc/21/55/91/263215591.db2.gz	CNJHGHMMIKVIMN-GOSISDBHSA-N	0	0	282.387	4.052	20	30		CIEDRN
CCCCCCCCCC(=O)N(C)Cc1cc(C)on1	ZINC000298461389	263220002	/nfs/dbraw/zinc/22/00/02/263220002.db2.gz	ZGRRTVLYUZWYBJ-UHFFFAOYSA-N	0	0	280.412	4.082	20	30		CIEDRN
C[C@@H]([NH2+][C@@H](C)CCC#N)c1ccc(-c2cccnc2)cc1	ZINC000299007776	263229266	/nfs/dbraw/zinc/22/92/66/263229266.db2.gz	QPIWMXNIRXYIHY-LSDHHAIUSA-N	0	0	279.387	4.091	20	30		CIEDRN
C[C@@H](NCCC#N)c1ccc(Cl)c2ccccc21	ZINC000299190774	263234057	/nfs/dbraw/zinc/23/40/57/263234057.db2.gz	CRBPTSGKCCZTRZ-LLVKDONJSA-N	0	0	258.752	4.057	20	30		CIEDRN
N#CCC[C@H](Nc1ccc(C#N)cc1)c1ccccc1	ZINC000164312120	263277601	/nfs/dbraw/zinc/27/76/01/263277601.db2.gz	XBOPCNLOLPSDJU-KRWDZBQOSA-N	0	0	261.328	4.015	20	30		CIEDRN
N#CCC[C@H](Nc1ccc(F)cc1C#N)c1ccccc1	ZINC000164310705	263278018	/nfs/dbraw/zinc/27/80/18/263278018.db2.gz	OPKMNFXWMVCNQQ-INIZCTEOSA-N	0	0	279.318	4.154	20	30		CIEDRN
C#CCCCCC(=O)N1CC[C@H](C)C[C@@H]1c1ccc(C)o1	ZINC000120229205	263285165	/nfs/dbraw/zinc/28/51/65/263285165.db2.gz	CRYHESRSOMDTOI-GOEBONIOSA-N	0	0	287.403	4.081	20	30		CIEDRN
C[C@@H](NC(=O)C1(C#N)CCCC1)c1ccc(C(C)(C)C)cc1	ZINC000045413555	263301208	/nfs/dbraw/zinc/30/12/08/263301208.db2.gz	TYMRNBXRVQCUHC-CQSZACIVSA-N	0	0	298.430	4.245	20	30		CIEDRN
C=CCCC[C@@H](C)N(C)Cc1nc([C@H](C)SCC)no1	ZINC000340877360	263311014	/nfs/dbraw/zinc/31/10/14/263311014.db2.gz	AYVCTUNNNVLXOL-OLZOCXBDSA-N	0	0	297.468	4.060	20	30		CIEDRN
CC(C)(CCC#N)CNc1ccnc2ccsc21	ZINC000340941676	263313576	/nfs/dbraw/zinc/31/35/76/263313576.db2.gz	URLMLFVKOVOPMQ-UHFFFAOYSA-N	0	0	259.378	4.038	20	30		CIEDRN
CCCCCCCCCC(=O)N1CC[C@H]([C@@H]2CCOC2)C1	ZINC000366723809	263327439	/nfs/dbraw/zinc/32/74/39/263327439.db2.gz	ZBTBUISTRIGNFO-DLBZAZTESA-N	0	0	295.467	4.012	20	30		CIEDRN
C=CCC[C@H](NC(=O)[C@H]1CCCCS1)c1ccccc1	ZINC000341230688	263328366	/nfs/dbraw/zinc/32/83/66/263328366.db2.gz	TXPSMNPKDBXCMZ-JKSUJKDBSA-N	0	0	289.444	4.096	20	30		CIEDRN
C=CCC[C@@H](NC(=O)[C@H]1CCCCS1)c1ccccc1	ZINC000341230687	263328426	/nfs/dbraw/zinc/32/84/26/263328426.db2.gz	TXPSMNPKDBXCMZ-HZPDHXFCSA-N	0	0	289.444	4.096	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N[C@@H](CC)c1cc(F)ccc1F	ZINC000341455130	263336439	/nfs/dbraw/zinc/33/64/39/263336439.db2.gz	DKEMPKLHHGUAMZ-DOMZBBRYSA-N	0	0	296.361	4.070	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N[C@H](CC)c1cc(F)ccc1F	ZINC000341455139	263336531	/nfs/dbraw/zinc/33/65/31/263336531.db2.gz	DKEMPKLHHGUAMZ-SWLSCSKDSA-N	0	0	296.361	4.070	20	30		CIEDRN
C=CCCC[C@@H](C)Sc1nnc(C2CC2)n1CC	ZINC000341519492	263342021	/nfs/dbraw/zinc/34/20/21/263342021.db2.gz	CCPRZHZUYYYZBM-LLVKDONJSA-N	0	0	265.426	4.012	20	30		CIEDRN
Cc1ccccc1C(=O)Nc1ccccc1SCCC#N	ZINC000341830583	263353496	/nfs/dbraw/zinc/35/34/96/263353496.db2.gz	WICFHHNGSSTPNC-UHFFFAOYSA-N	0	0	296.395	4.253	20	30		CIEDRN
CC(C)(C#N)CCSCc1cnn(-c2ccccc2)c1	ZINC000341980721	263369629	/nfs/dbraw/zinc/36/96/29/263369629.db2.gz	RBHYLZAAIWKWGA-UHFFFAOYSA-N	0	0	285.416	4.045	20	30		CIEDRN
N#CCc1ccc(C(=O)Nc2ccc(F)c(C3CC3)c2)cc1	ZINC000342100570	263387672	/nfs/dbraw/zinc/38/76/72/263387672.db2.gz	PMJRZOPGTLAGTN-UHFFFAOYSA-N	0	0	294.329	4.021	20	30		CIEDRN
N#CC1(C(=O)Nc2ccc(-c3ccc[nH]3)cc2)CCCCC1	ZINC000342186639	263395744	/nfs/dbraw/zinc/39/57/44/263395744.db2.gz	YPIWYFRPUJVHKD-UHFFFAOYSA-N	0	0	293.370	4.094	20	30		CIEDRN
N#Cc1ccc(OCc2nc(C3CC3)cs2)c(Cl)c1	ZINC000342531840	263439956	/nfs/dbraw/zinc/43/99/56/263439956.db2.gz	UCYRABWLZASVEC-UHFFFAOYSA-N	0	0	290.775	4.125	20	30		CIEDRN
Cc1sc(NC(=O)c2occc2C(C)C)c(C#N)c1C	ZINC000334231370	263519708	/nfs/dbraw/zinc/51/97/08/263519708.db2.gz	LHKAIXOWECHEKL-UHFFFAOYSA-N	0	0	288.372	4.205	20	30		CIEDRN
CCN(CC1(C#N)CC1)[C@H](C)c1cc2ccccc2o1	ZINC000343145771	263594547	/nfs/dbraw/zinc/59/45/47/263594547.db2.gz	CWHQCCMSLYVFFR-CYBMUJFWSA-N	0	0	268.360	4.119	20	30		CIEDRN
C[C@H](Nc1ccc2ccn(C)c2c1)c1cccc(C#N)c1	ZINC000188019406	263617187	/nfs/dbraw/zinc/61/71/87/263617187.db2.gz	CCXCEXQBXJXHCN-ZDUSSCGKSA-N	0	0	275.355	4.223	20	30		CIEDRN
N#CC1CCC(CNc2ccc3ccc(Cl)cc3n2)CC1	ZINC000440646930	263624401	/nfs/dbraw/zinc/62/44/01/263624401.db2.gz	ZVUHURJFXYUEPO-UHFFFAOYSA-N	0	0	299.805	4.052	20	30		CIEDRN
CC[C@@H](CC1CCCC1)C(=O)N(C1CC1)C1(C#N)CCC1	ZINC000415511014	263638536	/nfs/dbraw/zinc/63/85/36/263638536.db2.gz	MEVMJTSLQYVWRQ-HNNXBMFYSA-N	0	0	288.435	4.030	20	30		CIEDRN
C[C@H](c1ccccc1)[S@@](=O)CCC1(C#N)CCCCC1	ZINC000417143189	263783835	/nfs/dbraw/zinc/78/38/35/263783835.db2.gz	GNRNRFRFGUODES-QRWLVFNGSA-N	0	0	289.444	4.360	20	30		CIEDRN
C[C@@H]1CCCC[C@H]1C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000424841288	263825440	/nfs/dbraw/zinc/82/54/40/263825440.db2.gz	HOTIGMDHQXFNOQ-KBAYOESNSA-N	0	0	298.430	4.364	20	30		CIEDRN
CC[C@@H]1CCCC[C@@H]1C(=O)N[C@H]1CCC(=O)NC12CCC2	ZINC000328713452	263849571	/nfs/dbraw/zinc/84/95/71/263849571.db2.gz	CAFWGIIVRIHEKT-RDBSUJKOSA-N	0	0	292.423	4.201	20	30		CIEDRN
CC(C)[C@H]1CC[C@@H](C)C[C@H]1NC(=O)c1ncoc1C1CC1	ZINC000328737767	263850782	/nfs/dbraw/zinc/85/07/82/263850782.db2.gz	HDPPRGPCMKGCLT-MRVWCRGKSA-N	0	0	290.407	4.317	20	30		CIEDRN
CC(C)CC[C@@H]1CCC[C@H]1NC(=O)c1ncoc1C1CC1	ZINC000328881420	263887271	/nfs/dbraw/zinc/88/72/71/263887271.db2.gz	WMMKCFOFNFZQLQ-GXTWGEPZSA-N	0	0	290.407	4.462	20	30		CIEDRN
Cn1nc(C2CCCCC2)cc1NCC(C)(C)CCC#N	ZINC000125418781	264007386	/nfs/dbraw/zinc/00/73/86/264007386.db2.gz	HUDDFAGVDHIHFR-UHFFFAOYSA-N	0	0	288.439	4.210	20	30		CIEDRN
Cc1noc(C)c1C(C)(C)NC(=O)c1csc(Cl)c1	ZINC000330671949	264013654	/nfs/dbraw/zinc/01/36/54/264013654.db2.gz	NOGIPJUFEZAFJV-UHFFFAOYSA-N	0	0	298.795	4.246	20	30		CIEDRN
CCc1noc(C)c1C(=O)N[C@@H](C)CCC(C)(C)C	ZINC000330835947	264051449	/nfs/dbraw/zinc/05/14/49/264051449.db2.gz	RGERBKJYRRWFCV-JTQLQIEISA-N	0	0	266.385	4.065	20	30		CIEDRN
Cc1nscc1C(=O)Nc1nc(CC(C)(C)C)cs1	ZINC000330788188	264053299	/nfs/dbraw/zinc/05/32/99/264053299.db2.gz	QLGKTMBTFXNFTG-UHFFFAOYSA-N	0	0	295.433	4.133	20	30		CIEDRN
CC(C)c1ccc(C(=O)N[C@@H]2CCC[C@@H]2C#N)cc1Cl	ZINC000330968424	264090981	/nfs/dbraw/zinc/09/09/81/264090981.db2.gz	QXTCDLIETJTPIZ-IUODEOHRSA-N	0	0	290.794	4.460	20	30		CIEDRN
CC(C)[C@H](C#N)NC(=O)CC1CCC(c2ccccc2)CC1	ZINC000330919758	264094167	/nfs/dbraw/zinc/09/41/67/264094167.db2.gz	OISDQMTUZMPWPR-VJFUWPCTSA-N	0	0	298.430	4.015	20	30		CIEDRN
CCO[C@H](C)c1ncc(C(=O)N[C@@H]2CCC[C@@H]2CC)s1	ZINC000330931965	264096278	/nfs/dbraw/zinc/09/62/78/264096278.db2.gz	WKQRUOWABIICMI-GRYCIOLGSA-N	0	0	296.436	4.124	20	30		CIEDRN
CCC(C)(C)NC(=O)N[C@H](C)c1cc2cccc(F)c2o1	ZINC000331028907	264099996	/nfs/dbraw/zinc/09/99/96/264099996.db2.gz	XGNXXYZRORMPEC-SNVBAGLBSA-N	0	0	292.354	4.325	20	30		CIEDRN
CC[C@@H]1CCC[C@H]1NC(=O)c1oc(CC(C)C)nc1C	ZINC000331057987	264109466	/nfs/dbraw/zinc/10/94/66/264109466.db2.gz	MDXOVWYUQYBZSG-CHWSQXEVSA-N	0	0	278.396	4.065	20	30		CIEDRN
C[C@@H]1CC[C@H](NC(=O)C[C@@H](CC#N)c2ccccc2)[C@@H](C)C1	ZINC000331066855	264112265	/nfs/dbraw/zinc/11/22/65/264112265.db2.gz	QICKXHQZORYKBQ-ATLSCFEFSA-N	0	0	298.430	4.015	20	30		CIEDRN
Cc1c(Cl)cccc1C(=O)N[C@@](C)(C#N)CC(C)C	ZINC000331116155	264128591	/nfs/dbraw/zinc/12/85/91/264128591.db2.gz	KKFJUNJVHAQZRD-OAHLLOKOSA-N	0	0	278.783	4.281	20	30		CIEDRN
CC[C@@H](C)n1ncc(NC(=O)NCC2CCCCC2)c1C	ZINC000331159249	264142608	/nfs/dbraw/zinc/14/26/08/264142608.db2.gz	WMAOLYVGPJIBAK-GFCCVEGCSA-N	0	0	292.427	4.069	20	30		CIEDRN
CC[C@H](C)n1ncc(NC(=O)NCC2CCCCC2)c1C	ZINC000331159250	264142743	/nfs/dbraw/zinc/14/27/43/264142743.db2.gz	WMAOLYVGPJIBAK-LBPRGKRZSA-N	0	0	292.427	4.069	20	30		CIEDRN
CCc1occc1C(=O)N[C@H](C)c1cc(C)oc1C	ZINC000331161214	264143411	/nfs/dbraw/zinc/14/34/11/264143411.db2.gz	GAIUUCNQWFLMKR-SNVBAGLBSA-N	0	0	261.321	4.118	20	30		CIEDRN
CCO[C@H](C)c1ncc(C(=O)N[C@H]2CCCC2(C)C)s1	ZINC000331198607	264159354	/nfs/dbraw/zinc/15/93/54/264159354.db2.gz	MIJRZZOIGVXRAL-PWSUYJOCSA-N	0	0	296.436	4.124	20	30		CIEDRN
CC1=C(C(=O)Nc2ccc(O)cc2OC(C)C)CCC1	ZINC000331209564	264162458	/nfs/dbraw/zinc/16/24/58/264162458.db2.gz	WVRNPKKLWACXCF-UHFFFAOYSA-N	0	0	275.348	4.268	20	30		CIEDRN
CCC(C)(C)NC(=O)Nc1ccc2nn(C(C)C)cc2c1	ZINC000331250608	264180863	/nfs/dbraw/zinc/18/08/63/264180863.db2.gz	ORZMIVPSNFPMLM-UHFFFAOYSA-N	0	0	288.395	4.132	20	30		CIEDRN
CC(=O)c1ccc(NC(=O)N[C@@H]2CC[C@H](C)C2)cc1Cl	ZINC000331308015	264185294	/nfs/dbraw/zinc/18/52/94/264185294.db2.gz	WXGMQMOVDQEAJO-GXSJLCMTSA-N	0	0	294.782	4.057	20	30		CIEDRN
CC(C)Oc1ccc(NC(=O)N[C@H]2CC[C@@H](C)C2)c(F)c1	ZINC000331295404	264197715	/nfs/dbraw/zinc/19/77/15/264197715.db2.gz	NGCIZVUGNKBUGR-NEPJUHHUSA-N	0	0	294.370	4.127	20	30		CIEDRN
C[C@@]1(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CC=CCC1	ZINC000331352324	264206786	/nfs/dbraw/zinc/20/67/86/264206786.db2.gz	ONQZFWLVROHBRX-CQSZACIVSA-N	0	0	294.738	4.052	20	30		CIEDRN
CC(C)c1ncc(CN(C)[C@@H](C)c2cccc(C#N)c2)s1	ZINC000425367286	264211878	/nfs/dbraw/zinc/21/18/78/264211878.db2.gz	SELBBMYASZJLLA-ZDUSSCGKSA-N	0	0	299.443	4.331	20	30		CIEDRN
C[C@@H](c1cccc(C#N)c1)N(C)Cc1sccc1Cl	ZINC000425367574	264212179	/nfs/dbraw/zinc/21/21/79/264212179.db2.gz	UFGCNXYEMKTUQS-NSHDSACASA-N	0	0	290.819	4.466	20	30		CIEDRN
C=CCC1(C(=O)Nc2cccc3ccccc32)CCOCC1	ZINC000425389034	264221532	/nfs/dbraw/zinc/22/15/32/264221532.db2.gz	TYBCGGCUHXTXLF-UHFFFAOYSA-N	0	0	295.382	4.151	20	30		CIEDRN
C=CCC1(CNC(=O)[C@H]2CCCC(F)(F)C2)CCCC1	ZINC000456505654	264225850	/nfs/dbraw/zinc/22/58/50/264225850.db2.gz	LYVRMPLKDPGEQV-ZDUSSCGKSA-N	0	0	285.378	4.065	20	30		CIEDRN
C=CCC1(CNC(=O)CC(C)(C)C(F)(F)F)CCCC1	ZINC000456505013	264225906	/nfs/dbraw/zinc/22/59/06/264225906.db2.gz	LCRQWUGQMBUXDK-UHFFFAOYSA-N	0	0	291.357	4.218	20	30		CIEDRN
CC1(NC(=O)N[C@@H](CCC#N)c2ccccc2)CCCCC1	ZINC000160525657	264250479	/nfs/dbraw/zinc/25/04/79/264250479.db2.gz	QOPXZRYFPUBWGV-INIZCTEOSA-N	0	0	299.418	4.053	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1cccc2ccc(C)nc21	ZINC000343263311	264263040	/nfs/dbraw/zinc/26/30/40/264263040.db2.gz	XUEDODXAEUPFIB-CYBMUJFWSA-N	0	0	282.387	4.018	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1sc2c(c1C#N)CCCC2	ZINC000425403129	264282922	/nfs/dbraw/zinc/28/29/22/264282922.db2.gz	HTDCACUFJPJNJG-UHFFFAOYSA-N	0	0	288.416	4.039	20	30		CIEDRN
Cc1sc(NC(=O)[C@@H]2CCCC[C@H]2C)c(C#N)c1C	ZINC000425404542	264282986	/nfs/dbraw/zinc/28/29/86/264282986.db2.gz	WTHJSXQYQXLFOT-BXKDBHETSA-N	0	0	276.405	4.001	20	30		CIEDRN
Cc1sc(NC(=O)[C@H]2CCCC[C@@H]2C)c(C#N)c1C	ZINC000425404547	264283472	/nfs/dbraw/zinc/28/34/72/264283472.db2.gz	WTHJSXQYQXLFOT-CABZTGNLSA-N	0	0	276.405	4.001	20	30		CIEDRN
Cc1ccc(S[C@H](C)c2cccc(C#N)c2)nc1	ZINC000189835654	264332356	/nfs/dbraw/zinc/33/23/56/264332356.db2.gz	AFCUDKNZBHCMCT-GFCCVEGCSA-N	0	0	254.358	4.115	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H](C)c1ccc(Cl)cc1	ZINC000189862517	264335395	/nfs/dbraw/zinc/33/53/95/264335395.db2.gz	CZDPRWNXFZLEGM-XHDPSFHLSA-N	0	0	265.784	4.120	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N(C)[C@@H](C)c1cccc(C#N)c1	ZINC000425488653	264354705	/nfs/dbraw/zinc/35/47/05/264354705.db2.gz	NDUXTOGHCIYVNW-CABCVRRESA-N	0	0	299.418	4.005	20	30		CIEDRN
C=CCC[C@H](NCc1noc(C(C)(C)C)n1)c1ccccc1	ZINC000180047834	264394790	/nfs/dbraw/zinc/39/47/90/264394790.db2.gz	KDTNHPQKEBVWKM-HNNXBMFYSA-N	0	0	299.418	4.164	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(-c2cnc(C)o2)cc1	ZINC000190047686	264394816	/nfs/dbraw/zinc/39/48/16/264394816.db2.gz	VJAIQDVJIWGHFF-QGZVFWFLSA-N	0	0	284.359	4.191	20	30		CIEDRN
C#CCCCCC(=O)N1CCC[C@H]1c1cccc(C)c1C	ZINC000180250585	264394832	/nfs/dbraw/zinc/39/48/32/264394832.db2.gz	PBYRUVPRDCQXEN-SFHVURJKSA-N	0	0	283.415	4.161	20	30		CIEDRN
C=CCC[C@H](NCc1nc(C)c(C)o1)c1ccccc1	ZINC000180048112	264395012	/nfs/dbraw/zinc/39/50/12/264395012.db2.gz	JHTKSJNMKAKPTJ-INIZCTEOSA-N	0	0	270.376	4.089	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)C[C@@H](C)c1c[nH]c2ccccc21	ZINC000280971709	264468963	/nfs/dbraw/zinc/46/89/63/264468963.db2.gz	AEUDUFGARRQQHI-KGLIPLIRSA-N	0	0	284.403	4.132	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)C[C@H](C)c1c[nH]c2ccccc21	ZINC000280971713	264469031	/nfs/dbraw/zinc/46/90/31/264469031.db2.gz	AEUDUFGARRQQHI-UONOGXRCSA-N	0	0	284.403	4.132	20	30		CIEDRN
C#CCCCCC(=O)N1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2	ZINC000283681734	264520972	/nfs/dbraw/zinc/52/09/72/264520972.db2.gz	SOTNKSIGEIWDKM-REPLKXPHSA-N	0	0	295.426	4.117	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)c2cc[nH]c2C2CC2)c1	ZINC000284114946	264524998	/nfs/dbraw/zinc/52/49/98/264524998.db2.gz	VBIJMGRQEPAZME-UHFFFAOYSA-N	0	0	296.370	4.099	20	30		CIEDRN
CC(C)(CCC#N)CNc1cccc(OC(F)F)c1	ZINC000135157712	264549297	/nfs/dbraw/zinc/54/92/97/264549297.db2.gz	XVAQZCUAFOVFRJ-UHFFFAOYSA-N	0	0	268.307	4.030	20	30		CIEDRN
CC[C@H](Nc1ccc(F)cc1C#N)c1ccc(OC)cc1	ZINC000135147331	264549451	/nfs/dbraw/zinc/54/94/51/264549451.db2.gz	YAROGUKUJBABFG-INIZCTEOSA-N	0	0	284.334	4.269	20	30		CIEDRN
C=CCC[C@H](NCc1ccccc1F)c1ccco1	ZINC000285609130	264554806	/nfs/dbraw/zinc/55/48/06/264554806.db2.gz	KECJXEPNMWCTNT-HNNXBMFYSA-N	0	0	259.324	4.216	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cnn(C2CCCC2)c1C	ZINC000192718152	264587832	/nfs/dbraw/zinc/58/78/32/264587832.db2.gz	SKRZBAOFYOJHLB-UHFFFAOYSA-N	0	0	287.407	4.014	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)NCCC2CCCC2)cc1	ZINC000193045161	264612527	/nfs/dbraw/zinc/61/25/27/264612527.db2.gz	NTYCJFPEEBMXKT-UHFFFAOYSA-N	0	0	299.418	4.190	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc([C@@H]2CCC(F)(F)C2)no1	ZINC000289027488	264699758	/nfs/dbraw/zinc/69/97/58/264699758.db2.gz	FZOFZDUEACAJNQ-VHSXEESVSA-N	0	0	256.296	4.042	20	30		CIEDRN
C=CCC(F)(F)C(=O)N1CCC[C@H]1c1cc(C)ccc1C	ZINC000293586758	264959303	/nfs/dbraw/zinc/95/93/03/264959303.db2.gz	CQEZWXYYNDKPLX-HNNXBMFYSA-N	0	0	293.357	4.178	20	30		CIEDRN
CC#CCCCC(=O)N1CCC[C@H]1c1ccccc1Cl	ZINC000185231084	265010819	/nfs/dbraw/zinc/01/08/19/265010819.db2.gz	XWDUWGGQHIKLDI-INIZCTEOSA-N	0	0	289.806	4.197	20	30		CIEDRN
Cc1cccc(CSc2cccc(F)c2C#N)c1	ZINC000093409199	265128328	/nfs/dbraw/zinc/12/83/28/265128328.db2.gz	LPOXOACJCOVASH-UHFFFAOYSA-N	0	0	257.333	4.298	20	30		CIEDRN
N#CCCN(CCCC1CCCCC1)Cc1ccccn1	ZINC000347779461	265136460	/nfs/dbraw/zinc/13/64/60/265136460.db2.gz	FBLBFYYTLCFMOM-UHFFFAOYSA-N	0	0	285.435	4.158	20	30		CIEDRN
Cc1cnc(NC(=O)[C@@H]2CCC[C@@H]3CCCC[C@H]23)o1	ZINC000329613828	265154857	/nfs/dbraw/zinc/15/48/57/265154857.db2.gz	CVNXCHQMLSGCKF-RWMBFGLXSA-N	0	0	262.353	4.178	20	30		CIEDRN
CCCOc1cccc(NCc2cc(C#N)cs2)c1	ZINC000093492482	265183720	/nfs/dbraw/zinc/18/37/20/265183720.db2.gz	BWBLLIPXCOPCJG-UHFFFAOYSA-N	0	0	272.373	4.021	20	30		CIEDRN
N#Cc1csc(CNc2cccc(-c3nccs3)c2)c1	ZINC000093687346	265188504	/nfs/dbraw/zinc/18/85/04/265188504.db2.gz	KODNMZRQNYRAKV-UHFFFAOYSA-N	0	0	297.408	4.355	20	30		CIEDRN
Cc1ccc(NCc2cc(C#N)cs2)c(Cl)c1	ZINC000093685571	265188586	/nfs/dbraw/zinc/18/85/86/265188586.db2.gz	JTCRUGGNRGVEED-UHFFFAOYSA-N	0	0	262.765	4.194	20	30		CIEDRN
Cc1ccc(Cl)cc1NCc1cc(C#N)cs1	ZINC000093684816	265189222	/nfs/dbraw/zinc/18/92/22/265189222.db2.gz	PUQOZXRPICHPGL-UHFFFAOYSA-N	0	0	262.765	4.194	20	30		CIEDRN
N#Cc1csc(CNc2cccc(C(F)(F)F)c2)c1	ZINC000093684918	265189953	/nfs/dbraw/zinc/18/99/53/265189953.db2.gz	CLKVBBQISYHARR-UHFFFAOYSA-N	0	0	282.290	4.251	20	30		CIEDRN
CC(C)CC1(C(=O)Nc2ccc(CC#N)cc2)CCCC1	ZINC000094815492	265256380	/nfs/dbraw/zinc/25/63/80/265256380.db2.gz	BNSGQKLNMDMAKJ-UHFFFAOYSA-N	0	0	284.403	4.298	20	30		CIEDRN
C=CC1CCN(C(=O)NC(CC(C)C)CC(C)C)CC1	ZINC000518972311	265263201	/nfs/dbraw/zinc/26/32/01/265263201.db2.gz	AAXZYNBVRMUCQI-UHFFFAOYSA-N	0	0	280.456	4.055	20	30		CIEDRN
C=CCCC1(c2nc(-c3ccccc3C)no2)CC1	ZINC000519029840	265301251	/nfs/dbraw/zinc/30/12/51/265301251.db2.gz	NFGCWRHSYSKBTD-UHFFFAOYSA-N	0	0	254.333	4.043	20	30		CIEDRN
C=CCC[C@H](NCc1nc2cc(C)ccc2[nH]1)c1ccco1	ZINC000519197344	265363116	/nfs/dbraw/zinc/36/31/16/265363116.db2.gz	RIZQJLTWNJFZHV-HNNXBMFYSA-N	0	0	295.386	4.261	20	30		CIEDRN
N#CCc1ccc(CNc2ccc(-c3ccccn3)cc2)cc1	ZINC000519245196	265375015	/nfs/dbraw/zinc/37/50/15/265375015.db2.gz	UIINOOZCGNUXQF-UHFFFAOYSA-N	0	0	299.377	4.427	20	30		CIEDRN
C=CCN1C(=O)c2ccccc2N[C@H]1c1cc(C)cc(C)c1	ZINC000519312136	265391809	/nfs/dbraw/zinc/39/18/09/265391809.db2.gz	JIRMCRZEGUWRIR-GOSISDBHSA-N	0	0	292.382	4.056	20	30		CIEDRN
Cc1cc(C)cc([C@@H](C)Nc2ccc(F)cc2C#N)c1	ZINC000097635590	265445816	/nfs/dbraw/zinc/44/58/16/265445816.db2.gz	HYINSUFGFYTAKU-CYBMUJFWSA-N	0	0	268.335	4.487	20	30		CIEDRN
N#CC[C@H](Cc1nc(-c2cccs2)no1)c1ccccc1	ZINC000519591308	265483150	/nfs/dbraw/zinc/48/31/50/265483150.db2.gz	IMUUZLJJHNVESI-CYBMUJFWSA-N	0	0	295.367	4.038	20	30		CIEDRN
N#Cc1cccc(CC(=O)Nc2ccc(C3CCC3)cc2)c1	ZINC000520683373	265891479	/nfs/dbraw/zinc/89/14/79/265891479.db2.gz	CPOZCDFVFATDPS-UHFFFAOYSA-N	0	0	290.366	4.007	20	30		CIEDRN
N#Cc1cccc(C#N)c1Oc1ccc(Cl)c(F)c1	ZINC000302887550	265992602	/nfs/dbraw/zinc/99/26/02/265992602.db2.gz	NYDVPYVTPZWPPV-UHFFFAOYSA-N	0	0	272.666	4.015	20	30		CIEDRN
CCC[C@H](C)C(=O)Nc1sc2c(c1C#N)CC[C@H](C)C2	ZINC000514607849	266019596	/nfs/dbraw/zinc/01/95/96/266019596.db2.gz	XDIXFFYYGJIHLY-QWRGUYRKSA-N	0	0	290.432	4.119	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)C1=CCC1	ZINC000356210159	266072967	/nfs/dbraw/zinc/07/29/67/266072967.db2.gz	GZEFBMGWMARCHI-UHFFFAOYSA-N	0	0	255.361	4.197	20	30		CIEDRN
Cc1cc(F)cc(NC(=O)C[C@H](CC#N)c2ccccc2)c1	ZINC000356488649	266124029	/nfs/dbraw/zinc/12/40/29/266124029.db2.gz	ZPYGYIFVAPDIDM-HNNXBMFYSA-N	0	0	296.345	4.160	20	30		CIEDRN
C=C(C)CSCC(=O)N[C@H](CC(C)C)c1ccccc1	ZINC000357024258	266234938	/nfs/dbraw/zinc/23/49/38/266234938.db2.gz	FDIMSYJVHKHSRR-MRXNPFEDSA-N	0	0	291.460	4.199	20	30		CIEDRN
CCc1noc([C@@H](C)Sc2cccc(Cl)c2C#N)n1	ZINC000357058693	266239450	/nfs/dbraw/zinc/23/94/50/266239450.db2.gz	RVVBUFRWEYGAPH-MRVPVSSYSA-N	0	0	293.779	4.010	20	30		CIEDRN
CC1CCC(N(C(=O)Nc2cccc(C#N)c2)C2CC2)CC1	ZINC000357152553	266255630	/nfs/dbraw/zinc/25/56/30/266255630.db2.gz	UBLZDUKCECQQHT-UHFFFAOYSA-N	0	0	297.402	4.133	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H]1CCCc2ccc(F)cc21	ZINC000357496938	266309715	/nfs/dbraw/zinc/30/97/15/266309715.db2.gz	REAJUVINLGALGH-QGZVFWFLSA-N	0	0	287.378	4.088	20	30		CIEDRN
C[C@@H]1c2cc(Cl)c(Cl)cc2CCN1CCCC#N	ZINC000357557831	266323798	/nfs/dbraw/zinc/32/37/98/266323798.db2.gz	XYSNMPMPXDLRPM-SNVBAGLBSA-N	0	0	283.202	4.216	20	30		CIEDRN
C[C@H]1c2cc(Cl)c(Cl)cc2CCN1CCCC#N	ZINC000357557830	266323912	/nfs/dbraw/zinc/32/39/12/266323912.db2.gz	XYSNMPMPXDLRPM-JTQLQIEISA-N	0	0	283.202	4.216	20	30		CIEDRN
CC(C)[C@H]1C[C@H](Nc2cccnc2C#N)c2ccccc21	ZINC000357662556	266342222	/nfs/dbraw/zinc/34/22/22/266342222.db2.gz	PFTXRLRBMLCDFM-WBVHZDCISA-N	0	0	277.371	4.250	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cc(-c3ncc[nH]3)ccc2C)CC1	ZINC000357923063	266386104	/nfs/dbraw/zinc/38/61/04/266386104.db2.gz	GBISXWMUVCGGIT-UHFFFAOYSA-N	0	0	295.386	4.070	20	30		CIEDRN
C=CCC[C@@H](NC(=O)C[C@@H](C)CC)c1ccccc1	ZINC000358179458	266434148	/nfs/dbraw/zinc/43/41/48/266434148.db2.gz	FSZYWAKJMGTLTM-GOEBONIOSA-N	0	0	259.393	4.246	20	30		CIEDRN
C=C(CC)CS[C@@H](C)C(=O)Nc1c(C)cccc1C	ZINC000358640717	266485824	/nfs/dbraw/zinc/48/58/24/266485824.db2.gz	XLWAEEJHXAHPOL-AWEZNQCLSA-N	0	0	277.433	4.330	20	30		CIEDRN
N#Cc1c(Cl)cccc1SCc1ncc(C2CC2)o1	ZINC000360944955	266758134	/nfs/dbraw/zinc/75/81/34/266758134.db2.gz	BECPTLMVPZYNCE-UHFFFAOYSA-N	0	0	290.775	4.369	20	30		CIEDRN
N#Cc1ccccc1NC(=O)c1ccc(C2=CCCC2)cc1	ZINC000361280656	266814590	/nfs/dbraw/zinc/81/45/90/266814590.db2.gz	KYUHWISPPXXGHC-UHFFFAOYSA-N	0	0	288.350	4.378	20	30		CIEDRN
N#Cc1cccc(CNc2ccc(C(=O)C3CCC3)cc2)c1	ZINC000362757157	267042142	/nfs/dbraw/zinc/04/21/42/267042142.db2.gz	QVUMURKQRFGFHI-UHFFFAOYSA-N	0	0	290.366	4.153	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N1CCC[C@H](C)[C@H]1C	ZINC000362816764	267050133	/nfs/dbraw/zinc/05/01/33/267050133.db2.gz	FDOHAXXAXSSIHW-UONOGXRCSA-N	0	0	289.444	4.225	20	30		CIEDRN
CC(C)(C#N)CCC[S@@](=O)Cc1cc2ccccc2o1	ZINC000362882732	267056503	/nfs/dbraw/zinc/05/65/03/267056503.db2.gz	KPEBUTUOUFHNFS-HXUWFJFHSA-N	0	0	289.400	4.011	20	30		CIEDRN
CC(C)CN(C(=O)CCC1CCC1)c1ccc(C#N)cc1	ZINC000363000543	267072436	/nfs/dbraw/zinc/07/24/36/267072436.db2.gz	HCVNBJDJGJRECM-UHFFFAOYSA-N	0	0	284.403	4.128	20	30		CIEDRN
COc1cc(CSC)ccc1OCc1cccc(C#N)c1	ZINC000116611968	267167601	/nfs/dbraw/zinc/16/76/01/267167601.db2.gz	YFWWMWOARRQTQR-UHFFFAOYSA-N	0	0	299.395	4.009	20	30		CIEDRN
C[C@H](Nc1cccc2c1OCCC2)c1ccc(C#N)s1	ZINC000371486047	267415956	/nfs/dbraw/zinc/41/59/56/267415956.db2.gz	SNIPRHNILLASPB-NSHDSACASA-N	0	0	284.384	4.118	20	30		CIEDRN
Cc1ccc2cccc(OCc3ccc(F)cc3C#N)c2n1	ZINC000303223014	267619352	/nfs/dbraw/zinc/61/93/52/267619352.db2.gz	VVGFQKGBIOYZFR-UHFFFAOYSA-N	0	0	292.313	4.133	20	30		CIEDRN
Cc1ccc(-c2cnccn2)cc1NCC(C)(C)CCC#N	ZINC000373483908	267681648	/nfs/dbraw/zinc/68/16/48/267681648.db2.gz	WITMFJXQGHOBTO-UHFFFAOYSA-N	0	0	294.402	4.194	20	30		CIEDRN
CCCC[C@H](C)C(=O)N1CC=C(c2ccc(C#N)cc2)CC1	ZINC000374415721	267788605	/nfs/dbraw/zinc/78/86/05/267788605.db2.gz	OKTDQZRMSGZILJ-HNNXBMFYSA-N	0	0	296.414	4.000	20	30		CIEDRN
CCCCCCCC(=O)N1CCCC[C@@H](CCOC)C1	ZINC000375155016	267835241	/nfs/dbraw/zinc/83/52/41/267835241.db2.gz	WNKZXOUMBOEILH-INIZCTEOSA-N	0	0	283.456	4.012	20	30		CIEDRN
C=CCCC(=O)N1CCC([C@@H](F)c2ccccc2F)CC1	ZINC000376025455	267932025	/nfs/dbraw/zinc/93/20/25/267932025.db2.gz	WMDMTHCGUNXXQM-QGZVFWFLSA-N	0	0	293.357	4.041	20	30		CIEDRN
CC#CCCCC(=O)N1C[C@@H]2CCCC[C@@]21c1ccccc1	ZINC000376953501	268033707	/nfs/dbraw/zinc/03/37/07/268033707.db2.gz	GGRJLSDILMLOPP-AZUAARDMSA-N	0	0	295.426	4.108	20	30		CIEDRN
C=C(C)CCc1noc(/C(F)=C\C2CCCCC2)n1	ZINC000575237174	335086806	/nfs/dbraw/zinc/08/68/06/335086806.db2.gz	DAKWTHAFISDNQL-JLHYYAGUSA-N	0	0	264.344	4.469	20	30		CIEDRN
C=CCCCNC(=O)N1CC[C@H](C)C[C@@H]1c1ccc(C)o1	ZINC000448387997	327613650	/nfs/dbraw/zinc/61/36/50/327613650.db2.gz	YJEHGEZTWAUJHG-DZGCQCFKSA-N	0	0	290.407	4.037	20	30		CIEDRN
C=CCCCSCC(=O)Nc1sc(C)c(C)c1C	ZINC000173828744	327632453	/nfs/dbraw/zinc/63/24/53/327632453.db2.gz	IYWJSUXTOJBWFI-UHFFFAOYSA-N	0	0	283.462	4.311	20	30		CIEDRN
C=C(C)CSCc1nc2c(cccc2F)n1CC	ZINC000574938586	327643252	/nfs/dbraw/zinc/64/32/52/327643252.db2.gz	INQKIIIPHJITFS-UHFFFAOYSA-N	0	0	264.369	4.005	20	30		CIEDRN
CCc1c(C)sc(NC(=O)C2(C)CCCCC2)c1C#N	ZINC000527073878	328823840	/nfs/dbraw/zinc/82/38/40/328823840.db2.gz	BBMCOWPSXQRABL-UHFFFAOYSA-N	0	0	290.432	4.400	20	30		CIEDRN
Cc1ccccc1SCc1ccc(C#N)cc1F	ZINC000037665737	328838416	/nfs/dbraw/zinc/83/84/16/328838416.db2.gz	HTXGDSDMBAHBMD-UHFFFAOYSA-N	0	0	257.333	4.298	20	30		CIEDRN
N#Cc1ccc(N[C@@H]2CCO[C@H](c3ccccc3)C2)c(F)c1	ZINC000160552636	327664807	/nfs/dbraw/zinc/66/48/07/327664807.db2.gz	DIVCYNYYODWWMZ-QAPCUYQASA-N	0	0	296.345	4.030	20	30		CIEDRN
N#Cc1ccc(/C=C/c2csc(-c3cccs3)n2)nc1	ZINC000170851581	327666316	/nfs/dbraw/zinc/66/63/16/327666316.db2.gz	NAMBOBLBZBGUIF-AATRIKPKSA-N	0	0	295.392	4.309	20	30		CIEDRN
C=C[C@@H](CC(=O)NCc1sccc1C)c1ccccc1	ZINC000533917730	327700887	/nfs/dbraw/zinc/70/08/87/327700887.db2.gz	HWTRPXCZLKKLHK-AWEZNQCLSA-N	0	0	285.412	4.033	20	30		CIEDRN
C=C(C)[C@@H](NCc1cccnc1C)c1ccc(F)c(F)c1	ZINC000187373400	327713975	/nfs/dbraw/zinc/71/39/75/327713975.db2.gz	VSJIQWLPDHHPFR-QGZVFWFLSA-N	0	0	288.341	4.075	20	30		CIEDRN
C=CCCCCNC(=O)Nc1ccc(-c2ccccn2)cc1	ZINC000580251046	327748558	/nfs/dbraw/zinc/74/85/58/327748558.db2.gz	UBTSJXSVRPGVKE-UHFFFAOYSA-N	0	0	295.386	4.226	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(C(C)(C)c2ccccc2)no1	ZINC000580257940	327749594	/nfs/dbraw/zinc/74/95/94/327749594.db2.gz	DQYLRLKUSKZMCK-ZDUSSCGKSA-N	0	0	270.376	4.465	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc(OC(C)C)cc1C	ZINC000580292599	327766883	/nfs/dbraw/zinc/76/68/83/327766883.db2.gz	PWOOMLQSHZBZKM-UHFFFAOYSA-N	0	0	275.392	4.323	20	30		CIEDRN
C[C@H]1CCN(CCCC(C)(C)C#N)c2ccccc21	ZINC000388113756	327837454	/nfs/dbraw/zinc/83/74/54/327837454.db2.gz	HWVXQZHGFHYMRQ-AWEZNQCLSA-N	0	0	256.393	4.330	20	30		CIEDRN
CC[C@@H](C(=O)N[C@](C)(C#N)C1CCCCC1)c1ccccc1	ZINC000582096605	327850661	/nfs/dbraw/zinc/85/06/61/327850661.db2.gz	JJPGXGFXHGCKQL-IEBWSBKVSA-N	0	0	298.430	4.159	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H]1c1ccc(C)s1	ZINC000364082357	327858589	/nfs/dbraw/zinc/85/85/89/327858589.db2.gz	QHEUMQFSVKKQLP-JSGCOSHPSA-N	0	0	277.433	4.322	20	30		CIEDRN
C[C@H](Nc1cccc(OCCCC#N)c1)[C@H]1CC1(C)C	ZINC000397634765	327885768	/nfs/dbraw/zinc/88/57/68/327885768.db2.gz	WRAFMDOOLLLZAV-XJKSGUPXSA-N	0	0	272.392	4.216	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC)[C@H]1CCCc2cccnc21	ZINC000365013302	327893068	/nfs/dbraw/zinc/89/30/68/327893068.db2.gz	ZTLPGJWVKRLHBP-KRWDZBQOSA-N	0	0	298.430	4.076	20	30		CIEDRN
CC(C)(C)c1ncc(CNc2ccc(F)c(C#N)c2)s1	ZINC000062839048	327895953	/nfs/dbraw/zinc/89/59/53/327895953.db2.gz	QFYLRTCXQDHLLU-UHFFFAOYSA-N	0	0	289.379	4.063	20	30		CIEDRN
CC(C)CCc1ccccc1NC(=O)c1cc(C#N)cs1	ZINC000531447236	327908226	/nfs/dbraw/zinc/90/82/26/327908226.db2.gz	YIGZWHMFFPKISD-UHFFFAOYSA-N	0	0	298.411	4.461	20	30		CIEDRN
Cc1oc2ccc(NC(=O)C3(C#N)CCCCC3)cc2c1C	ZINC000185393014	327915249	/nfs/dbraw/zinc/91/52/49/327915249.db2.gz	ZWTCIWVEMOIOAE-UHFFFAOYSA-N	0	0	296.370	4.462	20	30		CIEDRN
CCCc1ccccc1NCc1cc(C#N)ccc1OC	ZINC000129254134	327941944	/nfs/dbraw/zinc/94/19/44/327941944.db2.gz	YJTIITMGNMTUJZ-UHFFFAOYSA-N	0	0	280.371	4.131	20	30		CIEDRN
C=CCN(C(=O)CCO[C@@H](C)CC(C)C)c1ccccc1	ZINC000531500291	327943585	/nfs/dbraw/zinc/94/35/85/327943585.db2.gz	YPKODMIHAGGAMV-INIZCTEOSA-N	0	0	289.419	4.047	20	30		CIEDRN
CC[C@@H]1[C@@H](c2ccc(C)cc2)CCN1C(=O)CC(C)(C)C#N	ZINC000365991495	327976270	/nfs/dbraw/zinc/97/62/70/327976270.db2.gz	VGSFHMLVVYAUSB-IAGOWNOFSA-N	0	0	298.430	4.029	20	30		CIEDRN
N#Cc1ccc(CN2CCC[C@@H]2c2ccc(F)cc2)s1	ZINC000124083884	328015615	/nfs/dbraw/zinc/01/56/15/328015615.db2.gz	IXOVSTOUFVXYRP-MRXNPFEDSA-N	0	0	286.375	4.096	20	30		CIEDRN
N#Cc1ccc(SCC(=O)c2ccccc2)c(Cl)c1	ZINC000531544478	328015756	/nfs/dbraw/zinc/01/57/56/328015756.db2.gz	GGNCXYACBZOWOE-UHFFFAOYSA-N	0	0	287.771	4.187	20	30		CIEDRN
C=CCSCc1cc(Br)cc2cccnc21	ZINC000531587583	328016683	/nfs/dbraw/zinc/01/66/83/328016683.db2.gz	DTMPRBBQQKKRKB-UHFFFAOYSA-N	0	0	294.217	4.417	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCCC[C@@H]1[C@@H](C)CC	ZINC000531559885	328017780	/nfs/dbraw/zinc/01/77/80/328017780.db2.gz	PAAPNZKUUARKTC-GOEBONIOSA-N	0	0	263.425	4.182	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@H](C)[C@H]2CCCC[C@@H]21	ZINC000531823748	328040042	/nfs/dbraw/zinc/04/00/42/328040042.db2.gz	UZDFMSRWMALROM-UAGQMJEPSA-N	0	0	275.436	4.182	20	30		CIEDRN
C=CCCC(=O)N(CCC)c1ccc(Cl)cc1	ZINC000110417487	328049271	/nfs/dbraw/zinc/04/92/71/328049271.db2.gz	CYQDQHSGBAOUDP-UHFFFAOYSA-N	0	0	251.757	4.049	20	30		CIEDRN
C=C(C)[C@H](CC(=O)N(CC)c1cc(C)cc(C)c1)OCC	ZINC000534389895	328050352	/nfs/dbraw/zinc/05/03/52/328050352.db2.gz	MDGDVQSPCFOZNL-KRWDZBQOSA-N	0	0	289.419	4.028	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)N(C)c1cccc(C(C)C)c1)OCC	ZINC000534389301	328050455	/nfs/dbraw/zinc/05/04/55/328050455.db2.gz	WYOLWEDQWJATPP-QGZVFWFLSA-N	0	0	289.419	4.144	20	30		CIEDRN
C[C@@H](NC(=O)C[C@H]1CCCC(C)(C)C1)c1ccc(C#N)cc1	ZINC000534399984	328051332	/nfs/dbraw/zinc/05/13/32/328051332.db2.gz	DYDYCWVFWKIOBI-GDBMZVCRSA-N	0	0	298.430	4.342	20	30		CIEDRN
C[C@H](NC(=O)C[C@H]1CCCC(C)(C)C1)c1ccc(C#N)cc1	ZINC000534399985	328051342	/nfs/dbraw/zinc/05/13/42/328051342.db2.gz	DYDYCWVFWKIOBI-GOEBONIOSA-N	0	0	298.430	4.342	20	30		CIEDRN
N#Cc1c(F)cccc1/C=C/c1nc2ccccc2o1	ZINC000563330033	328055654	/nfs/dbraw/zinc/05/56/54/328055654.db2.gz	HMOYHNSMIGZTSR-CMDGGOBGSA-N	0	0	264.259	4.009	20	30		CIEDRN
Cc1csc(NC(=O)C[C@H]2CCCC[C@H]2C)c1C#N	ZINC000563649280	328081045	/nfs/dbraw/zinc/08/10/45/328081045.db2.gz	ILQMZAQXXGLXPR-ZYHUDNBSSA-N	0	0	276.405	4.083	20	30		CIEDRN
C=CCC1(c2nc([C@H](C)c3cccs3)no2)CCC1	ZINC000571085024	328084114	/nfs/dbraw/zinc/08/41/14/328084114.db2.gz	CSWBFZHSYSLGLD-LLVKDONJSA-N	0	0	274.389	4.281	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(-c2cc(C)cc(F)c2)no1	ZINC000571191555	328091083	/nfs/dbraw/zinc/09/10/83/328091083.db2.gz	YTIXRBIDRURLCB-HNNXBMFYSA-N	0	0	260.312	4.038	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2ccc(OCC)c(F)c2)no1	ZINC000571245057	328094859	/nfs/dbraw/zinc/09/48/59/328094859.db2.gz	LNKZBFVGMIWTAQ-NSHDSACASA-N	0	0	290.338	4.344	20	30		CIEDRN
C=CCCNc1ccccc1O[C@@H](C)C(F)(F)F	ZINC000571244052	328094953	/nfs/dbraw/zinc/09/49/53/328094953.db2.gz	SAAZVFCGGHIZKK-JTQLQIEISA-N	0	0	259.271	4.004	20	30		CIEDRN
CC(C)(C#N)CCSCCCc1ccsc1	ZINC000571240652	328095009	/nfs/dbraw/zinc/09/50/09/328095009.db2.gz	JVFZUWGOIMOQFK-UHFFFAOYSA-N	0	0	253.436	4.354	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(C(F)(F)c2ccc(F)cc2)no1	ZINC000571481831	328124697	/nfs/dbraw/zinc/12/46/97/328124697.db2.gz	OQWMYJFEYIOHNR-CQSZACIVSA-N	0	0	296.292	4.203	20	30		CIEDRN
CCc1cccc(OCCSCCCCC#N)c1	ZINC000161082777	328128744	/nfs/dbraw/zinc/12/87/44/328128744.db2.gz	YXTJNCTVXRUGNN-UHFFFAOYSA-N	0	0	263.406	4.055	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1cccc2c1ccn2CC(C)C	ZINC000445262826	328134539	/nfs/dbraw/zinc/13/45/39/328134539.db2.gz	JDXOLXGWGJIKKX-UHFFFAOYSA-N	0	0	298.430	4.336	20	30		CIEDRN
C[C@@H](CCSc1ccccc1)SCCC#N	ZINC000413013899	328140194	/nfs/dbraw/zinc/14/01/94/328140194.db2.gz	PCGVXUBWHGNWFH-LBPRGKRZSA-N	0	0	251.420	4.204	20	30		CIEDRN
N#CCCCSCc1cc(Cl)c2c(c1)OCCCO2	ZINC000571587734	328136017	/nfs/dbraw/zinc/13/60/17/328136017.db2.gz	NJKXQARKIGZJPR-UHFFFAOYSA-N	0	0	297.807	4.038	20	30		CIEDRN
C=C(C)CNC(=O)c1oc2c(ccc3ccccc23)c1C	ZINC000161153706	328137683	/nfs/dbraw/zinc/13/76/83/328137683.db2.gz	GSYDLSJDNJRKAR-UHFFFAOYSA-N	0	0	279.339	4.200	20	30		CIEDRN
C[C@@H](SCCC#N)c1ccc(Br)cc1	ZINC000413011455	328139783	/nfs/dbraw/zinc/13/97/83/328139783.db2.gz	CRYPNBVFSSGWJM-SECBINFHSA-N	0	0	270.195	4.157	20	30		CIEDRN
Cc1cc(C)cc(OCCCSCCCCC#N)c1	ZINC000161172742	328150889	/nfs/dbraw/zinc/15/08/89/328150889.db2.gz	IPESUIBBKVPRFY-UHFFFAOYSA-N	0	0	277.433	4.499	20	30		CIEDRN
Cc1cccc(C[S@](=O)CCC2(C#N)CCCCC2)c1	ZINC000414266951	328153967	/nfs/dbraw/zinc/15/39/67/328153967.db2.gz	MQGSFZSQWZSUAX-HXUWFJFHSA-N	0	0	289.444	4.108	20	30		CIEDRN
CC/C=C(\C)C(=O)Nc1ccccc1S[C@@H](C)CC#N	ZINC000264505933	328159901	/nfs/dbraw/zinc/15/99/01/328159901.db2.gz	QDBUASCBSHRNJY-WHGQRRHOSA-N	0	0	288.416	4.376	20	30		CIEDRN
N#CCCN(Cc1cc(Cl)ccc1Cl)CC1CC1	ZINC000353422904	328213760	/nfs/dbraw/zinc/21/37/60/328213760.db2.gz	PKHZGKNUVBMADF-UHFFFAOYSA-N	0	0	283.202	4.119	20	30		CIEDRN
CC(C)(C)[C@H]1CN(C(=O)NCCCCC#N)c2ccccc21	ZINC000278111797	328223663	/nfs/dbraw/zinc/22/36/63/328223663.db2.gz	KNDHXXRGNSBGJA-HNNXBMFYSA-N	0	0	299.418	4.040	20	30		CIEDRN
CCCOc1ccc(NC(=O)CC(C)(C)C#N)cc1Cl	ZINC000278180171	328224384	/nfs/dbraw/zinc/22/43/84/328224384.db2.gz	CHYFHZGKVHGIKW-UHFFFAOYSA-N	0	0	294.782	4.007	20	30		CIEDRN
C=C(C)CN(C)C(=O)Nc1c(C)cccc1C(C)C	ZINC000181501505	329233986	/nfs/dbraw/zinc/23/39/86/329233986.db2.gz	WMSBQUUQDBNASN-UHFFFAOYSA-N	0	0	260.381	4.158	20	30		CIEDRN
C[C@H](C#N)CSc1ccccc1NCCCCCF	ZINC000284016697	328245297	/nfs/dbraw/zinc/24/52/97/328245297.db2.gz	HXRWCHYYXMCVQZ-CYBMUJFWSA-N	0	0	280.412	4.490	20	30		CIEDRN
CC[C@H]([NH2+][C@@H](C)c1ccc(C#N)cc1)c1ccc(F)cc1[O-]	ZINC000286297166	328249483	/nfs/dbraw/zinc/24/94/83/328249483.db2.gz	WLJXZWGIHSTRKA-SJCJKPOMSA-N	0	0	298.361	4.205	20	30		CIEDRN
Cc1ccccc1[C@@H](c1noc(C2(C#N)CCC2)n1)C(C)C	ZINC000289244431	328254226	/nfs/dbraw/zinc/25/42/26/328254226.db2.gz	XWDZPDBCORIPSA-HNNXBMFYSA-N	0	0	295.386	4.111	20	30		CIEDRN
COc1ccccc1[C@H](C)S[C@@H]1CC[C@H](C#N)C1	ZINC000295943874	328288265	/nfs/dbraw/zinc/28/82/65/328288265.db2.gz	ICNBTZUAWDHPMB-RWMBFGLXSA-N	0	0	261.390	4.182	20	30		CIEDRN
N#C[C@]1(c2nc(-c3ccccc3Cl)no2)CC12CCCC2	ZINC000296066558	328288764	/nfs/dbraw/zinc/28/87/64/328288764.db2.gz	XPWQALXXQCDLIL-INIZCTEOSA-N	0	0	299.761	4.115	20	30		CIEDRN
CCCCCCCCC(=O)N[C@@H](C)c1cccnc1	ZINC000298181148	328295335	/nfs/dbraw/zinc/29/53/35/328295335.db2.gz	CIARKVOQGHYXBE-AWEZNQCLSA-N	0	0	262.397	4.009	20	30		CIEDRN
CCCCCCCCC(=O)N[C@H](C)c1cccnc1	ZINC000298181150	328295340	/nfs/dbraw/zinc/29/53/40/328295340.db2.gz	CIARKVOQGHYXBE-CQSZACIVSA-N	0	0	262.397	4.009	20	30		CIEDRN
Cc1cccc(C(=O)Nc2cc(C(C)(C)C)sc2C#N)c1	ZINC000534520144	328305333	/nfs/dbraw/zinc/30/53/33/328305333.db2.gz	GGXQKVKHAKHJEA-UHFFFAOYSA-N	0	0	298.411	4.478	20	30		CIEDRN
Cc1cc(Cl)ccc1NCCOc1ccc(C#N)cc1	ZINC000048429032	328308429	/nfs/dbraw/zinc/30/84/29/328308429.db2.gz	OXWMODWNKHWVBM-UHFFFAOYSA-N	0	0	286.762	4.011	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)[C@@H]2CC23CCCCC3)s1	ZINC000531923788	328315628	/nfs/dbraw/zinc/31/56/28/328315628.db2.gz	UNLHIBIZUBZUOE-ZDUSSCGKSA-N	0	0	288.416	4.091	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@H](C)CCC(C)C)c1ccccc1	ZINC000534604742	328321360	/nfs/dbraw/zinc/32/13/60/328321360.db2.gz	QKZSGYLAPYWEOU-HZPDHXFCSA-N	0	0	273.420	4.287	20	30		CIEDRN
CCC1CCN(c2ccc(C#N)c(C(F)(F)F)c2)CC1	ZINC000048908562	328324734	/nfs/dbraw/zinc/32/47/34/328324734.db2.gz	CDODPSLSHIHURK-UHFFFAOYSA-N	0	0	282.309	4.203	20	30		CIEDRN
CCCCS[C@H](C)C(=O)Nc1ccc(Cl)c(C#N)c1	ZINC000048824205	328324806	/nfs/dbraw/zinc/32/48/06/328324806.db2.gz	UWFNPNYXBAISPL-SNVBAGLBSA-N	0	0	296.823	4.072	20	30		CIEDRN
N#Cc1cc(NC(=O)c2ccc(Cl)cc2)ccc1Cl	ZINC000048824335	328324813	/nfs/dbraw/zinc/32/48/13/328324813.db2.gz	KMUYGSUJPKAMLN-UHFFFAOYSA-N	0	0	291.137	4.117	20	30		CIEDRN
CC(C)CC[C@H]1CCC[C@@H]1NC(=O)c1ccc(CC#N)cc1	ZINC000534613625	328325234	/nfs/dbraw/zinc/32/52/34/328325234.db2.gz	HXBFYBGRMUSRKG-AEFFLSMTSA-N	0	0	298.430	4.087	20	30		CIEDRN
CN(Cc1ccc(Cl)s1)c1c(F)cc(C#N)cc1F	ZINC000111142595	328327984	/nfs/dbraw/zinc/32/79/84/328327984.db2.gz	LBUKUUBAICRCJX-UHFFFAOYSA-N	0	0	298.745	4.188	20	30		CIEDRN
CCC[C@@H](C#N)NC(=O)CC1CCC(C(C)(C)C)CC1	ZINC000531952795	328334790	/nfs/dbraw/zinc/33/47/90/328334790.db2.gz	DGWUOFXKBTVMJT-NRXISQOPSA-N	0	0	278.440	4.037	20	30		CIEDRN
C=CC1CCN(C(=O)N[C@H](C)c2cccc(Cl)c2)CC1	ZINC000111435484	328355261	/nfs/dbraw/zinc/35/52/61/328355261.db2.gz	JKANTIROHUXGOK-GFCCVEGCSA-N	0	0	292.810	4.009	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1ccc(F)c(F)c1)c1ccccc1	ZINC000534709384	328358853	/nfs/dbraw/zinc/35/88/53/328358853.db2.gz	OYYHZFXPRFLZHI-LBPRGKRZSA-N	0	0	287.309	4.263	20	30		CIEDRN
C=C[C@@H](CC(=O)NCC1(CC)CCC1)c1ccccc1	ZINC000534720744	328359139	/nfs/dbraw/zinc/35/91/39/328359139.db2.gz	CHFRMBCESXJSDJ-HNNXBMFYSA-N	0	0	271.404	4.043	20	30		CIEDRN
Cc1ccc2oc(SCc3ccc(C#N)cc3)nc2c1	ZINC000303658456	328355897	/nfs/dbraw/zinc/35/58/97/328355897.db2.gz	VFXFSTKZJKTYMI-UHFFFAOYSA-N	0	0	280.352	4.300	20	30		CIEDRN
CC(C)(C)[C@H]1CCCN(C(=O)c2ccc(CC#N)cc2)CC1	ZINC000534675786	328356003	/nfs/dbraw/zinc/35/60/03/328356003.db2.gz	PJWDWCLGJRUXBH-KRWDZBQOSA-N	0	0	298.430	4.041	20	30		CIEDRN
C=C[C@@H](CC(=O)N(Cc1ccco1)C(C)C)c1ccccc1	ZINC000534706941	328357383	/nfs/dbraw/zinc/35/73/83/328357383.db2.gz	VGHFNFPQPDJBAZ-INIZCTEOSA-N	0	0	297.398	4.377	20	30		CIEDRN
N#Cc1cccc(OCc2csc(C3CCCC3)n2)c1	ZINC000049492675	328364269	/nfs/dbraw/zinc/36/42/69/328364269.db2.gz	LGZNJGIGRGPOGY-UHFFFAOYSA-N	0	0	284.384	4.251	20	30		CIEDRN
CCc1ccc([C@H]2C[C@H](C)CCN2c2cccc(C#N)n2)o1	ZINC000534881394	328366588	/nfs/dbraw/zinc/36/65/88/328366588.db2.gz	DTBFFKCEQIOXGX-CZUORRHYSA-N	0	0	295.386	4.086	20	30		CIEDRN
CCCc1ccccc1NCc1cc(C#N)ccc1F	ZINC000049556455	328373251	/nfs/dbraw/zinc/37/32/51/328373251.db2.gz	JULBSLPQTAAHOS-UHFFFAOYSA-N	0	0	268.335	4.262	20	30		CIEDRN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)C1CCCCCC1	ZINC000101812640	328377589	/nfs/dbraw/zinc/37/75/89/328377589.db2.gz	DFDXRDJKRLXNDG-UHFFFAOYSA-N	0	0	298.430	4.266	20	30		CIEDRN
Cc1ccc(C#N)c(NCc2cccc(Cl)c2Cl)n1	ZINC000535035425	328379176	/nfs/dbraw/zinc/37/91/76/328379176.db2.gz	AGIWEWQPXKKEOK-UHFFFAOYSA-N	0	0	292.169	4.181	20	30		CIEDRN
Cc1cccc(CSCc2ccc(C#N)cc2F)c1	ZINC000049956386	328379749	/nfs/dbraw/zinc/37/97/49/328379749.db2.gz	MQYLQYQAPLETFA-UHFFFAOYSA-N	0	0	271.360	4.439	20	30		CIEDRN
N#Cc1ccc(NCc2c(F)cccc2Cl)c(F)c1	ZINC000112012614	328381882	/nfs/dbraw/zinc/38/18/82/328381882.db2.gz	DWVJGZKXGCZMFK-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)c1ccc(Cl)o1	ZINC000112183781	328387130	/nfs/dbraw/zinc/38/71/30/328387130.db2.gz	XEAHNSHAOJTGKU-UHFFFAOYSA-N	0	0	281.783	4.142	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)N1CCC(CCC(C)C)CC1)OCC	ZINC000535151537	328390710	/nfs/dbraw/zinc/39/07/10/328390710.db2.gz	HSKOWJBQODZKCR-QGZVFWFLSA-N	0	0	295.467	4.033	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)c1ccc(SC)o1	ZINC000112247492	328393111	/nfs/dbraw/zinc/39/31/11/328393111.db2.gz	SCZVCWFKSVHARY-UHFFFAOYSA-N	0	0	293.432	4.210	20	30		CIEDRN
CC1(C)CCC[C@@H](c2noc(Cc3cccc(C#N)c3)n2)C1	ZINC000535249462	328397996	/nfs/dbraw/zinc/39/79/96/328397996.db2.gz	ZRMQOCGZEIHDDK-OAHLLOKOSA-N	0	0	295.386	4.216	20	30		CIEDRN
Cc1nc(NCc2cccc(Cl)c2)c(Cl)cc1C#N	ZINC000388791346	328396057	/nfs/dbraw/zinc/39/60/57/328396057.db2.gz	RXMSQKQIOBEISN-UHFFFAOYSA-N	0	0	292.169	4.181	20	30		CIEDRN
Cc1cc(C(C)(C)C)cc(C)c1CN(CCC#N)CCC#N	ZINC000340728639	328399168	/nfs/dbraw/zinc/39/91/68/328399168.db2.gz	HTZYDLHLHVMNMV-UHFFFAOYSA-N	0	0	297.446	4.230	20	30		CIEDRN
Cc1sc(NC(=O)C2CCC(F)(F)CC2)c(C#N)c1C	ZINC000334266782	328421313	/nfs/dbraw/zinc/42/13/13/328421313.db2.gz	ZGGDDUQLFYNVFW-UHFFFAOYSA-N	0	0	298.358	4.001	20	30		CIEDRN
CC[C@@H](C)N(C(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1)[C@@H](C)CC	ZINC000415406187	328427332	/nfs/dbraw/zinc/42/73/32/328427332.db2.gz	WZJCZIRAGSBTHB-IHETXDGRSA-N	0	0	298.430	4.087	20	30		CIEDRN
C=C[C@@H](CC(=O)N(CC(C)C)C(C)C)c1ccccc1	ZINC000535408236	328451742	/nfs/dbraw/zinc/45/17/42/328451742.db2.gz	KICBPBVVJUGCCP-INIZCTEOSA-N	0	0	273.420	4.239	20	30		CIEDRN
CC(C)Oc1ccc(NC(=O)NC2(C)CCCC2)c(F)c1	ZINC000330593316	328464629	/nfs/dbraw/zinc/46/46/29/328464629.db2.gz	SJBVXPWBVWPUKT-UHFFFAOYSA-N	0	0	294.370	4.081	20	30		CIEDRN
CC(C)c1ncncc1C(=O)N[C@H](C)CC1CCCCC1	ZINC000331017074	328474093	/nfs/dbraw/zinc/47/40/93/328474093.db2.gz	YQAGPULZRHDUAN-CYBMUJFWSA-N	0	0	289.423	4.264	20	30		CIEDRN
Cc1nnc(SCCCCC#N)n1[C@@H]1CCC[C@H](C)C1	ZINC000127861589	328481541	/nfs/dbraw/zinc/48/15/41/328481541.db2.gz	HAZPXJOCPKEIKF-GXTWGEPZSA-N	0	0	292.452	4.124	20	30		CIEDRN
CC[C@H](CC#N)Nc1c(Cl)cc([N+](=O)[O-])cc1Cl	ZINC000129932653	328486648	/nfs/dbraw/zinc/48/66/48/328486648.db2.gz	PLDRMPRUSXFKJB-SSDOTTSWSA-N	0	0	288.134	4.006	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1c[nH]cc1-c1ccc(C)s1	ZINC000281646033	328500560	/nfs/dbraw/zinc/50/05/60/328500560.db2.gz	HTLGETXXMLJHKP-GFCCVEGCSA-N	0	0	288.416	4.136	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1c(C)onc1-c1ccccc1C	ZINC000281523021	328502093	/nfs/dbraw/zinc/50/20/93/328502093.db2.gz	XFCGPHPCEVTYQG-AWEZNQCLSA-N	0	0	298.386	4.043	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1c(C)cccc1Cl	ZINC000281867826	328504419	/nfs/dbraw/zinc/50/44/19/328504419.db2.gz	FEIRADPJZIFINR-NSHDSACASA-N	0	0	266.772	4.125	20	30		CIEDRN
CC#CCCCC(=O)N1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2	ZINC000283608420	328513192	/nfs/dbraw/zinc/51/31/92/328513192.db2.gz	NBQJDZVHNHWISM-REPLKXPHSA-N	0	0	295.426	4.117	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1cc2c(cc1Cl)CCC2=O	ZINC000425560816	328537453	/nfs/dbraw/zinc/53/74/53/328537453.db2.gz	MXOCXIZGZLXEHQ-UHFFFAOYSA-N	0	0	291.778	4.010	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](C)c1ccc(OC(F)F)cc1	ZINC000184974397	328543357	/nfs/dbraw/zinc/54/33/57/328543357.db2.gz	DGLSZIRUXIZZNN-NEPJUHHUSA-N	0	0	297.345	4.068	20	30		CIEDRN
CCc1ccc(C(C)(C)C(=O)Nc2cccc(C#N)c2)cc1	ZINC000426051850	328540829	/nfs/dbraw/zinc/54/08/29/328540829.db2.gz	QPYQNDUBSQSIKT-UHFFFAOYSA-N	0	0	292.382	4.037	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@](C)(CCC)C1	ZINC000185729580	326799136	/nfs/dbraw/zinc/79/91/36/326799136.db2.gz	URMQWOIAIZWXJA-HOCLYGCPSA-N	0	0	251.414	4.018	20	30		CIEDRN
C=C(CC)CS[C@H](C)C(=O)N[C@@H](C)c1ccc(F)cc1	ZINC000537993607	326822883	/nfs/dbraw/zinc/82/28/83/326822883.db2.gz	ORBDNTJQYXYXGL-QWHCGFSZSA-N	0	0	295.423	4.091	20	30		CIEDRN
COc1ccc(CSCc2ccccc2F)cc1C#N	ZINC000533467916	326837316	/nfs/dbraw/zinc/83/73/16/326837316.db2.gz	QJLBXTVXGXRHQG-UHFFFAOYSA-N	0	0	287.359	4.139	20	30		CIEDRN
CC[C@](C)(NCC#Cc1ccc(Cl)cc1)C(F)(F)F	ZINC000533525919	326851706	/nfs/dbraw/zinc/85/17/06/326851706.db2.gz	DRNOEAGFZCIJID-ZDUSSCGKSA-N	0	0	289.728	4.012	20	30		CIEDRN
C=CCCC1(C(=O)N2CC[C@H](c3ccc(C)cc3)C2)CC1	ZINC000530538642	326856111	/nfs/dbraw/zinc/85/61/11/326856111.db2.gz	HTKDOEPSSYQYIY-KRWDZBQOSA-N	0	0	283.415	4.057	20	30		CIEDRN
N#CCCCOc1cccc(NCc2ccsc2)c1	ZINC000037777405	326861522	/nfs/dbraw/zinc/86/15/22/326861522.db2.gz	KAMFYHRLCOVVHS-UHFFFAOYSA-N	0	0	272.373	4.043	20	30		CIEDRN
CCCCC1CCC(C(=O)N(C[C@@H](C)C#N)C2CC2)CC1	ZINC000533599717	326873440	/nfs/dbraw/zinc/87/34/40/326873440.db2.gz	YYBIHUWOIQSXKH-FHERZECASA-N	0	0	290.451	4.134	20	30		CIEDRN
N#Cc1cc(F)ccc1COc1ccccc1C(F)(F)F	ZINC000260798514	326880553	/nfs/dbraw/zinc/88/05/53/326880553.db2.gz	LKHMYIYXURILNI-UHFFFAOYSA-N	0	0	295.235	4.295	20	30		CIEDRN
CCSc1ccccc1C(=O)Nc1cc(C#N)ccc1C	ZINC000530593612	326881467	/nfs/dbraw/zinc/88/14/67/326881467.db2.gz	CPLKKZHVPILKRJ-UHFFFAOYSA-N	0	0	296.395	4.231	20	30		CIEDRN
C[C@H]1CC(=O)c2c1c(F)ccc2OCCCC(C)(C)C#N	ZINC000530628784	326883208	/nfs/dbraw/zinc/88/32/08/326883208.db2.gz	UWNQAUWKYARQCA-NSHDSACASA-N	0	0	289.350	4.224	20	30		CIEDRN
CC(C)(C#N)CCNc1cccc(C(F)(F)F)c1	ZINC000087590869	326942319	/nfs/dbraw/zinc/94/23/19/326942319.db2.gz	YCECQLHXUQQZFN-UHFFFAOYSA-N	0	0	256.271	4.057	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)N(CCCC)c1ccccc1)OCC	ZINC000533703250	326912819	/nfs/dbraw/zinc/91/28/19/326912819.db2.gz	CLOICFAMRBVSMK-QGZVFWFLSA-N	0	0	289.419	4.191	20	30		CIEDRN
C[C@H](Cc1cccc(Cl)c1)C(=O)Nc1ccc(C#N)cc1	ZINC000533719909	326915743	/nfs/dbraw/zinc/91/57/43/326915743.db2.gz	ZCASQWBDZDCBLL-GFCCVEGCSA-N	0	0	298.773	4.029	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H]2CCc3cccc(OC)c32)n1	ZINC000556365005	326923359	/nfs/dbraw/zinc/92/33/59/326923359.db2.gz	LBNBIFDVCJTWEJ-CYBMUJFWSA-N	0	0	298.386	4.010	20	30		CIEDRN
C=C(C)CCSc1nnc(C)n1[C@H]1CCC[C@@H](C)C1	ZINC000506420184	332772666	/nfs/dbraw/zinc/77/26/66/332772666.db2.gz	DBBCXLUYCGJZNR-OCCSQVGLSA-N	0	0	279.453	4.396	20	30		CIEDRN
Cc1nc(C)c(COc2cc(C)c(C#N)c(C)c2C)s1	ZINC000506423142	332772726	/nfs/dbraw/zinc/77/27/26/332772726.db2.gz	PTDYZTHXFPZHHN-UHFFFAOYSA-N	0	0	286.400	4.136	20	30		CIEDRN
C=CCCO[C@H](C)c1nc([C@H]2CCCC[C@@H]2CC)no1	ZINC000556388733	326931164	/nfs/dbraw/zinc/93/11/64/326931164.db2.gz	VUCAOPNPKRWOJX-RDBSUJKOSA-N	0	0	278.396	4.407	20	30		CIEDRN
CC(C)(C#N)CCNc1ccccc1C(F)(F)F	ZINC000087590867	326942383	/nfs/dbraw/zinc/94/23/83/326942383.db2.gz	YNBBAZAHCMMMNI-UHFFFAOYSA-N	0	0	256.271	4.057	20	30		CIEDRN
C[C@@H](N[C@H](C)c1ccc(C#N)cc1Cl)c1cscn1	ZINC000565548180	326955774	/nfs/dbraw/zinc/95/57/74/326955774.db2.gz	FLGUEGSZVDQLIJ-NXEZZACHSA-N	0	0	291.807	4.080	20	30		CIEDRN
CC[C@@H](C)CC(=O)Nc1nc(-c2ccc(C#N)cc2)cs1	ZINC000556667495	326956793	/nfs/dbraw/zinc/95/67/93/326956793.db2.gz	MQULKANREYSLDU-LLVKDONJSA-N	0	0	299.399	4.056	20	30		CIEDRN
Cc1cc(N2CCC[C@@H]2c2ccc(Cl)cc2)cc(C#N)n1	ZINC000557520978	327011824	/nfs/dbraw/zinc/01/18/24/327011824.db2.gz	HXGYWQCSGHOQDU-QGZVFWFLSA-N	0	0	297.789	4.257	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Nc1scc(C)c1C#N	ZINC000568763935	327015187	/nfs/dbraw/zinc/01/51/87/327015187.db2.gz	LBOPHJPWJIAAQR-UHFFFAOYSA-N	0	0	291.420	4.138	20	30		CIEDRN
CCCCC[C@@H]1CCCN1c1nccc(C#N)c1Cl	ZINC000557625845	327016957	/nfs/dbraw/zinc/01/69/57/327016957.db2.gz	MFMNFNOXEOITSJ-CYBMUJFWSA-N	0	0	277.799	4.156	20	30		CIEDRN
N#Cc1ccnc(N2CCCC[C@H]2c2ccccc2)c1Cl	ZINC000557633854	327018003	/nfs/dbraw/zinc/01/80/03/327018003.db2.gz	VSJNBYZKMQJYAB-HNNXBMFYSA-N	0	0	297.789	4.338	20	30		CIEDRN
CCCC(=O)Nc1cccc(NCCCC(C)(C)C#N)c1	ZINC000153413731	327022936	/nfs/dbraw/zinc/02/29/36/327022936.db2.gz	QEPMSUPACHWHPP-UHFFFAOYSA-N	0	0	287.407	4.167	20	30		CIEDRN
N#Cc1ccc(NC(=O)c2cccc(C3CCC3)c2)cc1	ZINC000557795761	327027582	/nfs/dbraw/zinc/02/75/82/327027582.db2.gz	KJKDQGNKEULBAA-UHFFFAOYSA-N	0	0	276.339	4.078	20	30		CIEDRN
CC(C)(CCC#N)CNC(=O)C[C@H]1CCCCC1(C)C	ZINC000557984602	327038951	/nfs/dbraw/zinc/03/89/51/327038951.db2.gz	VEEGTQWMGGKGCB-CQSZACIVSA-N	0	0	278.440	4.039	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cccc(-c2ncco2)c1C	ZINC000584189168	327059588	/nfs/dbraw/zinc/05/95/88/327059588.db2.gz	NGNICDNELQXRNK-LBPRGKRZSA-N	0	0	284.359	4.191	20	30		CIEDRN
C=CCCCSCc1cc(C(C)=O)ccc1OCC	ZINC000584196385	327063043	/nfs/dbraw/zinc/06/30/43/327063043.db2.gz	RDOJLXZFUOAGFF-UHFFFAOYSA-N	0	0	278.417	4.487	20	30		CIEDRN
N#Cc1cnc(N[C@@H]2CCC[C@@H]2c2ccccc2)c(Cl)c1	ZINC000558116504	327074706	/nfs/dbraw/zinc/07/47/06/327074706.db2.gz	KEVRVBVGADEGCO-GDBMZVCRSA-N	0	0	297.789	4.355	20	30		CIEDRN
Cc1ccnc(NCc2cccc(Cl)c2Cl)c1C#N	ZINC000558149636	327076090	/nfs/dbraw/zinc/07/60/90/327076090.db2.gz	BKRYZDYGCAYTJC-UHFFFAOYSA-N	0	0	292.169	4.181	20	30		CIEDRN
C[C@H]1C[C@H](C(C)(C)C)CCN1C(=O)Nc1cccc(C#N)c1	ZINC000558227162	327079446	/nfs/dbraw/zinc/07/94/46/327079446.db2.gz	SPHZGGSQOKNWEB-DZGCQCFKSA-N	0	0	299.418	4.237	20	30		CIEDRN
N#CC1(C(=O)NCc2ccc(C3CCCCC3)cc2)CCC1	ZINC000558235811	327080291	/nfs/dbraw/zinc/08/02/91/327080291.db2.gz	PCECJUADHGUPJR-UHFFFAOYSA-N	0	0	296.414	4.044	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(-c2cc(C)c3ccccc3n2)no1	ZINC000558370730	327089183	/nfs/dbraw/zinc/08/91/83/327089183.db2.gz	VTUQJIKKOJSDDB-SFHVURJKSA-N	0	0	293.370	4.447	20	30		CIEDRN
N#Cc1c(NCc2ccccc2)cccc1C(F)F	ZINC000558511524	327100592	/nfs/dbraw/zinc/10/05/92/327100592.db2.gz	LHSMZFLHDRJKEX-UHFFFAOYSA-N	0	0	258.271	4.108	20	30		CIEDRN
C=CCCC1(C(=O)N[C@@H]2CCc3sc(Cl)cc32)CC1	ZINC000558578940	327107586	/nfs/dbraw/zinc/10/75/86/327107586.db2.gz	LIWCSTFLMRPJLM-LLVKDONJSA-N	0	0	295.835	4.251	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)NC(C)(C)C1CC1	ZINC000558638437	327111779	/nfs/dbraw/zinc/11/17/79/327111779.db2.gz	UUFIOGWYSYXGTK-UHFFFAOYSA-N	0	0	272.392	4.115	20	30		CIEDRN
N#CC1CCC(CNC(=O)c2ccc(C3CCC3)cc2)CC1	ZINC000558666889	327112855	/nfs/dbraw/zinc/11/28/55/327112855.db2.gz	UFXAKAACMWIVRZ-UHFFFAOYSA-N	0	0	296.414	4.014	20	30		CIEDRN
Cc1cc(Cl)c2ncc(C#N)c(NC3CCC3)c2c1	ZINC000558786113	327120340	/nfs/dbraw/zinc/12/03/40/327120340.db2.gz	BOYTULQZTXQRSQ-UHFFFAOYSA-N	0	0	271.751	4.033	20	30		CIEDRN
N#CCc1cccc(N[C@@H]2CCC[C@@H](C3CC3)C2)c1	ZINC000313421932	327128872	/nfs/dbraw/zinc/12/88/72/327128872.db2.gz	DCSWCMCBTSSZAK-NVXWUHKLSA-N	0	0	254.377	4.133	20	30		CIEDRN
Cc1cc(C)c(CNc2cccc(CC#N)c2)c(C)c1	ZINC000313440493	327130604	/nfs/dbraw/zinc/13/06/04/327130604.db2.gz	TWHBEMWUMMIDBM-UHFFFAOYSA-N	0	0	264.372	4.290	20	30		CIEDRN
C[C@H]1C[C@H]1c1ccc(CNc2cccc(CC#N)c2)o1	ZINC000313448091	327131531	/nfs/dbraw/zinc/13/15/31/327131531.db2.gz	MRPWKRXDKGOWJQ-BLLLJJGKSA-N	0	0	266.344	4.081	20	30		CIEDRN
Cc1cccc2c1[C@@H](C)C[C@H]2CC(=O)N(CCC#N)C(C)C	ZINC000559043034	327138939	/nfs/dbraw/zinc/13/89/39/327138939.db2.gz	CLOXBFMVTNQIJD-HOTGVXAUSA-N	0	0	298.430	4.127	20	30		CIEDRN
CC(C)[C@H]1CC[C@H](C(=O)Nc2ccccc2CC#N)CC1	ZINC000559252171	327150693	/nfs/dbraw/zinc/15/06/93/327150693.db2.gz	ZENUMXHOWHCANE-KOMQPUFPSA-N	0	0	284.403	4.154	20	30		CIEDRN
N#C[C@H](NC(=O)c1cccc2ccccc21)C1CCCCC1	ZINC000128952441	327154826	/nfs/dbraw/zinc/15/48/26/327154826.db2.gz	ZEZURILMENJEPI-SFHVURJKSA-N	0	0	292.382	4.042	20	30		CIEDRN
C=CCN(CCc1ccccc1)C(=O)CC(C)(C)C1CC1	ZINC000559295130	327155727	/nfs/dbraw/zinc/15/57/27/327155727.db2.gz	OXOSKWPAYIZEOT-UHFFFAOYSA-N	0	0	285.431	4.070	20	30		CIEDRN
C[C@@H](c1ccco1)N(Cc1cc(C#N)ccc1F)C1CC1	ZINC000086234426	327156292	/nfs/dbraw/zinc/15/62/92/327156292.db2.gz	IZVRLMGNROFDPJ-LBPRGKRZSA-N	0	0	284.334	4.016	20	30		CIEDRN
C=CCC[C@H](C)Nc1cccc(NC(=O)C(C)C)c1	ZINC000130603027	327158785	/nfs/dbraw/zinc/15/87/85/327158785.db2.gz	ZUCAROAQQAZQCD-ZDUSSCGKSA-N	0	0	260.381	4.048	20	30		CIEDRN
C=CCCc1ccccc1NCc1ccccc1C#N	ZINC000409838486	327165663	/nfs/dbraw/zinc/16/56/63/327165663.db2.gz	WADKNWAFCCBGSW-UHFFFAOYSA-N	0	0	262.356	4.289	20	30		CIEDRN
C=CCCc1ccccc1NCC(=O)Nc1ccc(C)cc1	ZINC000409863950	327166187	/nfs/dbraw/zinc/16/61/87/327166187.db2.gz	HZGMURRODPAYMT-UHFFFAOYSA-N	0	0	294.398	4.164	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)C[C@H](c1ccccc1)C(F)(F)F	ZINC000410146480	327181336	/nfs/dbraw/zinc/18/13/36/327181336.db2.gz	YKTKEBGGYKYURF-UONOGXRCSA-N	0	0	299.336	4.194	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1scnc1CC	ZINC000410355331	327187226	/nfs/dbraw/zinc/18/72/26/327187226.db2.gz	ZTDBXLPUELSKFN-UHFFFAOYSA-N	0	0	286.400	4.076	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)Cc1ccc(C)cc1	ZINC000410345487	327187541	/nfs/dbraw/zinc/18/75/41/327187541.db2.gz	PXSKHZMSMJYASS-UHFFFAOYSA-N	0	0	279.383	4.295	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1ccoc1Cl	ZINC000410376971	327188464	/nfs/dbraw/zinc/18/84/64/327188464.db2.gz	XJOJRTJLTGKERN-UHFFFAOYSA-N	0	0	275.735	4.304	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)[C@@H]1CC[C@@H](C)C1	ZINC000410382219	327189213	/nfs/dbraw/zinc/18/92/13/327189213.db2.gz	LNKQCKUJYYDJQV-UKRRQHHQSA-N	0	0	257.377	4.180	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1ccc(C(C)=O)s1	ZINC000410381864	327189251	/nfs/dbraw/zinc/18/92/51/327189251.db2.gz	LDULEUHNOIVZET-UHFFFAOYSA-N	0	0	299.395	4.322	20	30		CIEDRN
C[C@@H](c1ccc(C#N)cc1)N(C)Cc1c(F)cccc1F	ZINC000559366724	327196315	/nfs/dbraw/zinc/19/63/15/327196315.db2.gz	OZMQZPITADORRJ-LBPRGKRZSA-N	0	0	286.325	4.029	20	30		CIEDRN
C=CCC[C@H](CCC)Nc1cccc(C(=O)N(C)CC)c1	ZINC000584295212	327225646	/nfs/dbraw/zinc/22/56/46/327225646.db2.gz	VRRPUNWVIQOYGF-INIZCTEOSA-N	0	0	288.435	4.325	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(OCC)cc1C(F)(F)F	ZINC000102242254	327226265	/nfs/dbraw/zinc/22/62/65/327226265.db2.gz	FREKTQPGZZGDDA-UHFFFAOYSA-N	0	0	287.281	4.009	20	30		CIEDRN
N#Cc1cc(CNc2cccc(Cl)c2F)ccc1F	ZINC000123742578	327237125	/nfs/dbraw/zinc/23/71/25/327237125.db2.gz	LSSFJNYRRAAHFM-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C=CCN(C(=O)Nc1ccccc1CCC(C)C)C1CC1	ZINC000537928902	327239415	/nfs/dbraw/zinc/23/94/15/327239415.db2.gz	KJBFVVUKKUVQFJ-UHFFFAOYSA-N	0	0	286.419	4.458	20	30		CIEDRN
N#Cc1cccc(C2(NCc3sccc3Cl)CC2)c1	ZINC000555051590	327241627	/nfs/dbraw/zinc/24/16/27/327241627.db2.gz	NZHYZQLDFNHSFN-UHFFFAOYSA-N	0	0	288.803	4.052	20	30		CIEDRN
Cc1coc(-c2cc(N[C@H]3CC[C@@H](C#N)C3)ccc2C)n1	ZINC000555951446	327250319	/nfs/dbraw/zinc/25/03/19/327250319.db2.gz	TYVGFBOFAUZLIG-KGLIPLIRSA-N	0	0	281.359	4.063	20	30		CIEDRN
C=C[C@H](CC(=O)N1C[C@@H](C)c2ccccc21)c1ccccc1	ZINC000559667241	327257338	/nfs/dbraw/zinc/25/73/38/327257338.db2.gz	WOPNETNRSLPFLV-HZPDHXFCSA-N	0	0	291.394	4.497	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccnc(Oc2ccccc2)c1	ZINC000559756857	327260198	/nfs/dbraw/zinc/26/01/98/327260198.db2.gz	QJTJBBXSMFRCDH-UHFFFAOYSA-N	0	0	296.370	4.415	20	30		CIEDRN
CC(C)(C)[C@H]1CCCC[C@H]1NC(=O)c1ccc(CC#N)cc1	ZINC000533888781	327266796	/nfs/dbraw/zinc/26/67/96/327266796.db2.gz	JKVUQULFEQPYCL-DLBZAZTESA-N	0	0	298.430	4.087	20	30		CIEDRN
CC(C)(C)[C@@H]1CCCC[C@@H]1NC(=O)c1ccc(CC#N)cc1	ZINC000533888784	327266823	/nfs/dbraw/zinc/26/68/23/327266823.db2.gz	JKVUQULFEQPYCL-SJORKVTESA-N	0	0	298.430	4.087	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H](C)c1ccccc1C(F)(F)F	ZINC000560000339	327276602	/nfs/dbraw/zinc/27/66/02/327276602.db2.gz	UQEKYRSBLTVWOJ-NSHDSACASA-N	0	0	299.336	4.485	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)[C@@H]2CC=CC[C@H]2C)c1	ZINC000560020087	327277738	/nfs/dbraw/zinc/27/77/38/327277738.db2.gz	YUGKUDLHYBOYNZ-RHSMWYFYSA-N	0	0	285.387	4.182	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ccc(SC)cc2)n1	ZINC000560025520	327278341	/nfs/dbraw/zinc/27/83/41/327278341.db2.gz	BKJARFZVWSWJMI-UHFFFAOYSA-N	0	0	274.389	4.312	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)[C@@H]1CC=CC[C@H]1C	ZINC000560120355	327285297	/nfs/dbraw/zinc/28/52/97/327285297.db2.gz	KZFJMZAIMYMEFV-SJLPKXTDSA-N	0	0	283.415	4.194	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CC[C@H](Cc2ccccc2)[C@@H]1C	ZINC000560135687	327286066	/nfs/dbraw/zinc/28/60/66/327286066.db2.gz	WZFOSXFJKDKFCZ-DOTOQJQBSA-N	0	0	285.431	4.068	20	30		CIEDRN
Cc1c2cc(C#N)ccc2sc1C(=O)NCC1(C)CCC1	ZINC000560209006	327290453	/nfs/dbraw/zinc/29/04/53/327290453.db2.gz	KBBMSEZZHOPOAU-UHFFFAOYSA-N	0	0	298.411	4.001	20	30		CIEDRN
C=CCCCNC(=O)N(C)[C@H](C)c1cc2ccccc2o1	ZINC000448036171	327300802	/nfs/dbraw/zinc/30/08/02/327300802.db2.gz	WDJNABWFJJXLBK-CYBMUJFWSA-N	0	0	286.375	4.101	20	30		CIEDRN
Cc1cc(Cl)ccc1NCc1cc(C#N)ccc1F	ZINC000388687063	327302671	/nfs/dbraw/zinc/30/26/71/327302671.db2.gz	RPRZSCTUFSJTKS-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
C=CCC[C@H](Nc1ccc(N2CCCC2)nc1)c1ccco1	ZINC000560548232	327323283	/nfs/dbraw/zinc/32/32/83/327323283.db2.gz	CMFZXGAVDPRLDG-INIZCTEOSA-N	0	0	297.402	4.394	20	30		CIEDRN
C=CCC[C@H]([NH2+]CCc1ccc(F)c(F)c1)c1ccco1	ZINC000560552276	327323986	/nfs/dbraw/zinc/32/39/86/327323986.db2.gz	ODKPHGPPLLNQEW-INIZCTEOSA-N	0	0	291.341	4.397	20	30		CIEDRN
CCC[C@@H]1CCCCN1C(=O)c1cc(C#N)ccc1Cl	ZINC000560639436	327332806	/nfs/dbraw/zinc/33/28/06/327332806.db2.gz	CPPRFLWWYKEJHS-CYBMUJFWSA-N	0	0	290.794	4.006	20	30		CIEDRN
Cc1cccc2c1CC[C@@H]2Nc1ccc(C#N)cc1F	ZINC000560678896	327335586	/nfs/dbraw/zinc/33/55/86/327335586.db2.gz	QPTBUOFRQPLAIZ-INIZCTEOSA-N	0	0	266.319	4.105	20	30		CIEDRN
C[C@@H]1C[C@@H]1c1ccc(CNc2ccc(F)cc2C#N)o1	ZINC000097635459	327345388	/nfs/dbraw/zinc/34/53/88/327345388.db2.gz	CWFNPLXRKCUEKL-YGRLFVJLSA-N	0	0	270.307	4.026	20	30		CIEDRN
C=CCN(C(=O)N[C@@H](c1ccccc1)C1CCCC1)C1CC1	ZINC000560854608	327348260	/nfs/dbraw/zinc/34/82/60/327348260.db2.gz	IHKNKWCHWWSMJN-SFHVURJKSA-N	0	0	298.430	4.278	20	30		CIEDRN
C=CCN(C(=O)N[C@H](c1ccccc1)C1CCCC1)C1CC1	ZINC000560854607	327348380	/nfs/dbraw/zinc/34/83/80/327348380.db2.gz	IHKNKWCHWWSMJN-GOSISDBHSA-N	0	0	298.430	4.278	20	30		CIEDRN
C[C@@H]1C[C@H](CCNc2cccc(C(F)F)c2C#N)CCO1	ZINC000583451043	327373868	/nfs/dbraw/zinc/37/38/68/327373868.db2.gz	IXAHGADRZRJRMU-VXGBXAGGSA-N	0	0	294.345	4.113	20	30		CIEDRN
Cc1cc(-c2cccc(C#N)c2)nc2sccc21	ZINC000427437934	327376790	/nfs/dbraw/zinc/37/67/90/327376790.db2.gz	APTUNCGHFXOOHF-UHFFFAOYSA-N	0	0	250.326	4.143	20	30		CIEDRN
COc1ccccc1-c1nc2sccc2c(C)c1C#N	ZINC000427448221	327378695	/nfs/dbraw/zinc/37/86/95/327378695.db2.gz	GEUWOQYCBYJUAS-UHFFFAOYSA-N	0	0	280.352	4.152	20	30		CIEDRN
CCCC[C@@H](CC)C(=O)NC(C#N)(CCC)CCC	ZINC000464267184	331358920	/nfs/dbraw/zinc/35/89/20/331358920.db2.gz	PLHYWEPTHINOQE-CQSZACIVSA-N	0	0	266.429	4.182	20	30		CIEDRN
C=C(C)[C@H](Nc1ccc(F)cn1)c1ccc(F)c(F)c1	ZINC000561295125	327383309	/nfs/dbraw/zinc/38/33/09/327383309.db2.gz	LBHHQSUAOQLMPA-HNNXBMFYSA-N	0	0	278.277	4.228	20	30		CIEDRN
C=C(C)CS[C@@H](C)c1nc(-c2ccccc2)no1	ZINC000155060465	327389318	/nfs/dbraw/zinc/38/93/18/327389318.db2.gz	ZBYFZFWBQJEBGX-NSHDSACASA-N	0	0	260.362	4.107	20	30		CIEDRN
CCCC[C@H](C)N(CCCC)C(=O)c1sccc1C#N	ZINC000561369315	327389616	/nfs/dbraw/zinc/38/96/16/327389616.db2.gz	DZBZBJKXSZAVBU-ZDUSSCGKSA-N	0	0	292.448	4.441	20	30		CIEDRN
CC(C)(C#N)Cc1nc(-c2cc(Cl)cc(Cl)c2)no1	ZINC000561385240	327391291	/nfs/dbraw/zinc/39/12/91/327391291.db2.gz	LNNIEUQHSLNUKI-UHFFFAOYSA-N	0	0	296.157	4.136	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)NCc1cccc(SCC)c1	ZINC000561410338	327393225	/nfs/dbraw/zinc/39/32/25/327393225.db2.gz	NXPWOZARBOULHL-INIZCTEOSA-N	0	0	277.433	4.017	20	30		CIEDRN
C[C@H](Nc1cccc(C#N)n1)c1ccc(F)c2ccccc21	ZINC000561688292	327410537	/nfs/dbraw/zinc/41/05/37/327410537.db2.gz	IJQYEQAGTRBCHL-LBPRGKRZSA-N	0	0	291.329	4.419	20	30		CIEDRN
CC[C@](C)(C#N)c1nc(-c2ccc(C(C)C)cc2)no1	ZINC000561855907	327426284	/nfs/dbraw/zinc/42/62/84/327426284.db2.gz	GQCFVYWHWYWHFW-MRXNPFEDSA-N	0	0	269.348	4.051	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](c2ccc(CC)cc2)C1	ZINC000562119815	327450654	/nfs/dbraw/zinc/45/06/54/327450654.db2.gz	CIVROGBQBIYSMX-YJBOKZPZSA-N	0	0	285.431	4.167	20	30		CIEDRN
C=CCCC(=O)Nc1cc(Cl)ccc1OC(C)C	ZINC000562247047	327459038	/nfs/dbraw/zinc/45/90/38/327459038.db2.gz	NBUYVJJBEPNSBC-UHFFFAOYSA-N	0	0	267.756	4.032	20	30		CIEDRN
C=C[C@H](CC(=O)N1C[C@H](C)[C@@H]2CCCC[C@H]21)c1ccccc1	ZINC000248418517	327478433	/nfs/dbraw/zinc/47/84/33/327478433.db2.gz	KJXTYVOYKCHCPS-OGWHTMIXSA-N	0	0	297.442	4.383	20	30		CIEDRN
Cc1ccc(C)c(C(=O)CSc2cccc(F)c2C#N)c1	ZINC000562475920	327484339	/nfs/dbraw/zinc/48/43/39/327484339.db2.gz	VPLBOMDOMXONRM-UHFFFAOYSA-N	0	0	299.370	4.289	20	30		CIEDRN
CCOCCCSCc1ccccc1C(C)(C)C#N	ZINC000134056901	327485108	/nfs/dbraw/zinc/48/51/08/327485108.db2.gz	ZALGGJKNFLDXQJ-UHFFFAOYSA-N	0	0	277.433	4.148	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC(C)(c2ccccc2)CC1	ZINC000151700954	327494231	/nfs/dbraw/zinc/49/42/31/327494231.db2.gz	ICNVYPRPNAGIFO-UHFFFAOYSA-N	0	0	297.442	4.335	20	30		CIEDRN
C=CCCCCSCC(=O)N[C@@H](C)c1cccs1	ZINC000562823745	327517766	/nfs/dbraw/zinc/51/77/66/327517766.db2.gz	DTOVJVZGFZMISA-LBPRGKRZSA-N	0	0	283.462	4.015	20	30		CIEDRN
C=CCC(C)(C)C(=O)N(C)Cc1ccc(F)c(Cl)c1	ZINC000507457883	332806705	/nfs/dbraw/zinc/80/67/05/332806705.db2.gz	DIDGUFIPMKLJTO-UHFFFAOYSA-N	0	0	283.774	4.040	20	30		CIEDRN
C=C[C@](C)(CC)c1nc([C@@H](C)c2ccccc2C)no1	ZINC000584317153	327540930	/nfs/dbraw/zinc/54/09/30/327540930.db2.gz	AMHMJCPZPJKVCS-SUMWQHHRSA-N	0	0	270.376	4.384	20	30		CIEDRN
Cc1nsc(Nc2ccc(CC(F)(F)F)cc2)c1C#N	ZINC000570149951	327571863	/nfs/dbraw/zinc/57/18/63/327571863.db2.gz	BUHNEESUBDSGRV-UHFFFAOYSA-N	0	0	297.305	4.172	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H]1CCCc2sccc21	ZINC000159880138	327573406	/nfs/dbraw/zinc/57/34/06/327573406.db2.gz	PYGZUMVPFUTRED-AWEZNQCLSA-N	0	0	275.417	4.010	20	30		CIEDRN
N#Cc1cc(Cl)ccc1NCCc1ccc(F)cc1F	ZINC000570188258	327575190	/nfs/dbraw/zinc/57/51/90/327575190.db2.gz	MSFAHSKRPXTZGV-UHFFFAOYSA-N	0	0	292.716	4.144	20	30		CIEDRN
N#Cc1ccnc(N2CC3(CCC3)c3ccccc32)c1Cl	ZINC000570472926	327593763	/nfs/dbraw/zinc/59/37/63/327593763.db2.gz	QJGBGSZFPHBUIE-UHFFFAOYSA-N	0	0	295.773	4.180	20	30		CIEDRN
C=CCCCCS[C@H](C)C(=O)Nc1ccccc1OC	ZINC000570501641	327596273	/nfs/dbraw/zinc/59/62/73/327596273.db2.gz	IYHUBBUNAGMZQK-CYBMUJFWSA-N	0	0	293.432	4.112	20	30		CIEDRN
CCC[C@@H](C#N)NC(=O)C/C=C\c1ccc(C(C)C)cc1	ZINC000535730072	328620875	/nfs/dbraw/zinc/62/08/75/328620875.db2.gz	FBWGVOBDFCRWBC-WVRJYTFGSA-N	0	0	284.403	4.022	20	30		CIEDRN
CC(C)Oc1ccccc1CNc1ccc(F)c(C#N)c1	ZINC000051635909	328626540	/nfs/dbraw/zinc/62/65/40/328626540.db2.gz	SIHGLMWNARYQSO-UHFFFAOYSA-N	0	0	284.334	4.097	20	30		CIEDRN
CCSc1ccccc1OCc1ccc(F)cc1C#N	ZINC000535880746	328645384	/nfs/dbraw/zinc/64/53/84/328645384.db2.gz	VSJWKBNFMHLOKV-UHFFFAOYSA-N	0	0	287.359	4.388	20	30		CIEDRN
CC1(C)CCC[C@@H](c2noc(-c3ccc(C#N)cc3)n2)C1	ZINC000536003905	328652385	/nfs/dbraw/zinc/65/23/85/328652385.db2.gz	VCEKBWDQZYNDFQ-CQSZACIVSA-N	0	0	281.359	4.292	20	30		CIEDRN
C[C@@H](NC(=O)c1ccc(CC#N)cc1)[C@@H](C)C1CCCCC1	ZINC000536174351	328659953	/nfs/dbraw/zinc/65/99/53/328659953.db2.gz	WAJFRWYOIYMUJK-HUUCEWRRSA-N	0	0	298.430	4.087	20	30		CIEDRN
C=C[C@@H](CC(=O)N(CCCC)C1CC1)c1ccccc1	ZINC000536169825	328660607	/nfs/dbraw/zinc/66/06/07/328660607.db2.gz	RCHADTZDSXISPD-HNNXBMFYSA-N	0	0	271.404	4.137	20	30		CIEDRN
CCc1ccc(CC)c(NC(=O)c2ccc(CC#N)cc2)c1	ZINC000536200600	328661860	/nfs/dbraw/zinc/66/18/60/328661860.db2.gz	CHXFBOYLRJHOFB-UHFFFAOYSA-N	0	0	292.382	4.130	20	30		CIEDRN
C[C@H]1CCN(c2cc(C#N)c3ccccc3n2)CC12CCC2	ZINC000536630080	328671026	/nfs/dbraw/zinc/67/10/26/328671026.db2.gz	ICBAFMWPEAKUGV-AWEZNQCLSA-N	0	0	291.398	4.123	20	30		CIEDRN
CC(C)c1ccccc1NC(=O)N1CCC(CCC#N)CC1	ZINC000519826948	328698383	/nfs/dbraw/zinc/69/83/83/328698383.db2.gz	QYABKCJDVIMHDA-UHFFFAOYSA-N	0	0	299.418	4.358	20	30		CIEDRN
C=CCc1ccccc1OCc1ncc(C(C)(C)C)o1	ZINC000532109246	328700172	/nfs/dbraw/zinc/70/01/72/328700172.db2.gz	LFEVGZKYLHBBON-UHFFFAOYSA-N	0	0	271.360	4.280	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)Nc1cnn(C(C)C)c1	ZINC000583639055	328722420	/nfs/dbraw/zinc/72/24/20/328722420.db2.gz	UHLOGQSDYPUCRX-UHFFFAOYSA-N	0	0	298.390	4.227	20	30		CIEDRN
CC(C)(C)C(C)(C)C(=O)Nc1ccc(C#N)cc1Cl	ZINC000389367401	328728366	/nfs/dbraw/zinc/72/83/66/328728366.db2.gz	DGZALLBPFLLZQC-UHFFFAOYSA-N	0	0	278.783	4.222	20	30		CIEDRN
C[C@H](NCc1ccc(C#N)cc1F)c1ccccc1Cl	ZINC000042336064	328763126	/nfs/dbraw/zinc/76/31/26/328763126.db2.gz	DJPWKKYFTDXSHQ-NSHDSACASA-N	0	0	288.753	4.202	20	30		CIEDRN
C=CCOc1ccc(CNc2cccc3c2OCCC3)cc1	ZINC000532373544	328774105	/nfs/dbraw/zinc/77/41/05/328774105.db2.gz	IXDRMVGFIUSAPD-UHFFFAOYSA-N	0	0	295.382	4.189	20	30		CIEDRN
N#CCc1ccc(NCc2ccc(Cl)c(F)c2)cc1	ZINC000043389442	328789189	/nfs/dbraw/zinc/78/91/89/328789189.db2.gz	RMLONKIVYNUSIY-UHFFFAOYSA-N	0	0	274.726	4.157	20	30		CIEDRN
C/C=C/c1ccc(OCc2cccc(C#N)c2)c(OC)c1	ZINC000216658710	328821553	/nfs/dbraw/zinc/82/15/53/328821553.db2.gz	CMDAEZCHRBLEHN-HWKANZROSA-N	0	0	279.339	4.179	20	30		CIEDRN
N#Cc1ccc(NCCSCc2ccccc2F)cc1	ZINC000301078742	328826151	/nfs/dbraw/zinc/82/61/51/328826151.db2.gz	IQKRMINGXWOXIR-UHFFFAOYSA-N	0	0	286.375	4.043	20	30		CIEDRN
COc1ccccc1[C@@H](CC(C)C)Nc1ccc(C#N)cn1	ZINC000301473523	328828258	/nfs/dbraw/zinc/82/82/58/328828258.db2.gz	LWPYNIXPCZGGOW-MRXNPFEDSA-N	0	0	295.386	4.161	20	30		CIEDRN
Cc1ccc(Oc2ccc(Cl)c(C#N)n2)c(Cl)c1	ZINC000301558633	328828643	/nfs/dbraw/zinc/82/86/43/328828643.db2.gz	HWBUUQRTCOFIIJ-UHFFFAOYSA-N	0	0	279.126	4.361	20	30		CIEDRN
Cc1csc([C@@H](C)CNc2ccc(C#N)c(Cl)c2)n1	ZINC000302158509	328831040	/nfs/dbraw/zinc/83/10/40/328831040.db2.gz	XHRBREYSGXVNMC-VIFPVBQESA-N	0	0	291.807	4.192	20	30		CIEDRN
C=C(C)CCS[C@H](C)C(=O)Nc1cc(C)ccc1C	ZINC000507819031	332826223	/nfs/dbraw/zinc/82/62/23/332826223.db2.gz	LXZYCOGGEVLKEN-CQSZACIVSA-N	0	0	277.433	4.330	20	30		CIEDRN
N#Cc1ccc(/C=C\c2ccncc2C#N)c(C(F)(F)F)c1	ZINC000357066852	328865932	/nfs/dbraw/zinc/86/59/32/328865932.db2.gz	CTEPFFHMRUWJBW-ARJAWSKDSA-N	0	0	299.255	4.014	20	30		CIEDRN
C=C(C)CCSCC(=O)Nc1ccc(F)c(Cl)c1	ZINC000507835038	332826851	/nfs/dbraw/zinc/82/68/51/332826851.db2.gz	WPQNAPOIBHFZQY-UHFFFAOYSA-N	0	0	287.787	4.117	20	30		CIEDRN
N#Cc1ccc(F)c(CSCc2ncc(Cl)s2)c1	ZINC000358653080	328889377	/nfs/dbraw/zinc/88/93/77/328889377.db2.gz	FVUCPUXFEMTLIJ-UHFFFAOYSA-N	0	0	298.795	4.241	20	30		CIEDRN
N#Cc1ccccc1Oc1ccc(NC(=O)CC2CC2)cc1	ZINC000507888914	332829042	/nfs/dbraw/zinc/82/90/42/332829042.db2.gz	NUMUPXFVRJCDOU-UHFFFAOYSA-N	0	0	292.338	4.089	20	30		CIEDRN
CCCCN(C(=O)CCCC#N)[C@@H](C)c1ccccc1	ZINC000360139915	328904863	/nfs/dbraw/zinc/90/48/63/328904863.db2.gz	FLXFRMNBQYHSHT-HNNXBMFYSA-N	0	0	272.392	4.070	20	30		CIEDRN
CC1(C)CC[C@H]2C[C@H](NC(=O)CCCC#N)c3cccc1c32	ZINC000360715589	328910798	/nfs/dbraw/zinc/91/07/98/328910798.db2.gz	NHUZSHJYYFWIDM-BBRMVZONSA-N	0	0	296.414	4.096	20	30		CIEDRN
CCCCCCCCC(=O)N1CCC2(CCOCC2)CC1	ZINC000375268224	329002418	/nfs/dbraw/zinc/00/24/18/329002418.db2.gz	SYFARGVEQRJOBR-UHFFFAOYSA-N	0	0	295.467	4.156	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@H](c2csc(C)c2)C1	ZINC000375377632	329002975	/nfs/dbraw/zinc/00/29/75/329002975.db2.gz	NLYOQWMPDWBSEC-HNNXBMFYSA-N	0	0	289.444	4.141	20	30		CIEDRN
N#CC[C@@H]1C[C@H]2[C@@H](CCC[C@@H]2Nc2ccsc2Cl)O1	ZINC000377393929	329013952	/nfs/dbraw/zinc/01/39/52/329013952.db2.gz	VDMBJJDBRHBBIF-HNCHTBHHSA-N	0	0	296.823	4.053	20	30		CIEDRN
CC(C)CC1(C(=O)NCC2CCC(C#N)CC2)CCCC1	ZINC000508351360	332837331	/nfs/dbraw/zinc/83/73/31/332837331.db2.gz	ZPOJXYVIDVYAFK-UHFFFAOYSA-N	0	0	290.451	4.039	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1cc2cc(Cl)sc2[nH]1	ZINC000582459637	329062100	/nfs/dbraw/zinc/06/21/00/329062100.db2.gz	WFFNRTGMUKOOJR-SECBINFHSA-N	0	0	296.823	4.357	20	30		CIEDRN
C=CCn1c2ccccc2nc1SC1CCCC1	ZINC000508505629	332840045	/nfs/dbraw/zinc/84/00/45/332840045.db2.gz	BPKGQNBRUYIVHV-UHFFFAOYSA-N	0	0	258.390	4.257	20	30		CIEDRN
N#CCc1ccccc1NC(=O)c1cccc2ccccc21	ZINC000582475039	329094430	/nfs/dbraw/zinc/09/44/30/329094430.db2.gz	YJKFPWJMWWBBFY-UHFFFAOYSA-N	0	0	286.334	4.158	20	30		CIEDRN
C=C(C)CCc1noc([C@H](C)CCOc2ccccc2)n1	ZINC000508598448	332842986	/nfs/dbraw/zinc/84/29/86/332842986.db2.gz	HFRBOVWUIDSGKE-CQSZACIVSA-N	0	0	286.375	4.151	20	30		CIEDRN
N#CCc1ccccc1NC(=O)[C@@H]1CCC[C@@H]2CCCC[C@@H]12	ZINC000582748375	329142442	/nfs/dbraw/zinc/14/24/42/329142442.db2.gz	BGIHVKYBGUEMCI-USXIJHARSA-N	0	0	296.414	4.298	20	30		CIEDRN
C=C(C)CCc1noc(/C=C(/C)c2cccc(F)c2)n1	ZINC000508602010	332843526	/nfs/dbraw/zinc/84/35/26/332843526.db2.gz	BNPAXRJXVHHKKN-XFXZXTDPSA-N	0	0	272.323	4.278	20	30		CIEDRN
C=CCCC(=O)N1CC[C@@H](C)C[C@@H]1c1ccc(CC)o1	ZINC000173634539	329149727	/nfs/dbraw/zinc/14/97/27/329149727.db2.gz	OIUOLPXOMQSSCO-UKRRQHHQSA-N	0	0	275.392	4.108	20	30		CIEDRN
C=CCCC(=O)N1CC[C@H](C)C[C@@H]1c1ccc(CC)o1	ZINC000173634562	329149783	/nfs/dbraw/zinc/14/97/83/329149783.db2.gz	OIUOLPXOMQSSCO-DZGCQCFKSA-N	0	0	275.392	4.108	20	30		CIEDRN
C=C(C)CCc1noc(-c2ccc(C(F)F)cc2)n1	ZINC000508607646	332843719	/nfs/dbraw/zinc/84/37/19/332843719.db2.gz	BJCHYWARUARFTH-UHFFFAOYSA-N	0	0	264.275	4.183	20	30		CIEDRN
COc1cc(C#N)ccc1CNc1ccc(C2CCC2)cc1	ZINC000582765058	329154056	/nfs/dbraw/zinc/15/40/56/329154056.db2.gz	PXKZUQQXGUHVBS-UHFFFAOYSA-N	0	0	292.382	4.446	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)c1ccc(C)cc1F	ZINC000175382645	329165248	/nfs/dbraw/zinc/16/52/48/329165248.db2.gz	HWHKOMJCWMIANQ-UHFFFAOYSA-N	0	0	289.375	4.024	20	30		CIEDRN
N#Cc1ccc(F)c(COc2ccc(F)cc2Cl)c1	ZINC000037855662	329170131	/nfs/dbraw/zinc/17/01/31/329170131.db2.gz	JZCUSAUCLQQECE-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
C=CCCCC(=O)N1C[C@@H](C)C[C@@H]1c1cccc(F)c1	ZINC000175964710	329170875	/nfs/dbraw/zinc/17/08/75/329170875.db2.gz	KVNCDOUMSNMQML-XJKSGUPXSA-N	0	0	275.367	4.092	20	30		CIEDRN
C=CCCCC(=O)N1CC[C@@H](C)C[C@@H]1c1ccc(C)o1	ZINC000176106734	329173838	/nfs/dbraw/zinc/17/38/38/329173838.db2.gz	NMURBRTUNQDMBV-UKRRQHHQSA-N	0	0	275.392	4.244	20	30		CIEDRN
C=C(C)CCc1noc(-c2ccc(COC(C)C)cc2)n1	ZINC000508633837	332845237	/nfs/dbraw/zinc/84/52/37/332845237.db2.gz	CNBQXLSNNACPBF-UHFFFAOYSA-N	0	0	286.375	4.170	20	30		CIEDRN
C=CCCCC(=O)N(C)[C@H](C)c1nc2ccccc2s1	ZINC000177476018	329183790	/nfs/dbraw/zinc/18/37/90/329183790.db2.gz	SXYCRKWRIIURNK-GFCCVEGCSA-N	0	0	288.416	4.172	20	30		CIEDRN
C=CCCCC(=O)N1CCCCC[C@H]1c1ccc(C)o1	ZINC000177878896	329186994	/nfs/dbraw/zinc/18/69/94/329186994.db2.gz	CXUQFVKCNAACCL-HNNXBMFYSA-N	0	0	275.392	4.388	20	30		CIEDRN
C=C(C)CCc1noc(-c2oc3ccccc3c2C)n1	ZINC000508666698	332846562	/nfs/dbraw/zinc/84/65/62/332846562.db2.gz	PTWTVTKYIOXVST-UHFFFAOYSA-N	0	0	268.316	4.300	20	30		CIEDRN
C=CCCCCC[N@H+]1C[C@@H](C2CCCCC2)C[C@H]1C(=O)[O-]	ZINC000582796808	329208712	/nfs/dbraw/zinc/20/87/12/329208712.db2.gz	AOPNWOXNXYXQRF-IRXDYDNUSA-N	0	0	293.451	4.088	20	30		CIEDRN
C#CCCCCC(=O)Nc1cccc(NC2CCCC2)c1	ZINC000179844540	329212422	/nfs/dbraw/zinc/21/24/22/329212422.db2.gz	RGHDKWAKAGDWFM-UHFFFAOYSA-N	0	0	284.403	4.173	20	30		CIEDRN
CN(Cc1cccc(OCCCC#N)c1)c1ccccc1	ZINC000180412796	329216359	/nfs/dbraw/zinc/21/63/59/329216359.db2.gz	BDKYPLCWOTWOFB-UHFFFAOYSA-N	0	0	280.371	4.006	20	30		CIEDRN
C=C(C)CCc1noc(-c2ccc(Cl)cc2C)n1	ZINC000508681333	332847123	/nfs/dbraw/zinc/84/71/23/332847123.db2.gz	SCLHOXTVVBUQMZ-UHFFFAOYSA-N	0	0	262.740	4.207	20	30		CIEDRN
CCCCCCCC(=O)N1C[C@H](C)C[C@H]1c1cccnc1	ZINC000182163650	329240208	/nfs/dbraw/zinc/24/02/08/329240208.db2.gz	BDTAZFPBELKAAC-WBVHZDCISA-N	0	0	288.435	4.352	20	30		CIEDRN
CCCCCCCC(=O)N1C[C@H](C)C[C@@H]1c1cccnc1	ZINC000182163613	329240244	/nfs/dbraw/zinc/24/02/44/329240244.db2.gz	BDTAZFPBELKAAC-NVXWUHKLSA-N	0	0	288.435	4.352	20	30		CIEDRN
CC(C)(CCC#N)CNc1ccc(Cl)c(F)c1	ZINC000183867659	329253639	/nfs/dbraw/zinc/25/36/39/329253639.db2.gz	AFMYUHNQLZOHCZ-UHFFFAOYSA-N	0	0	254.736	4.221	20	30		CIEDRN
N#C[C@@H]1CCC[C@@H]1N[C@@H]1CCc2c1cc(Cl)cc2Cl	ZINC000459459732	329257453	/nfs/dbraw/zinc/25/74/53/329257453.db2.gz	HYRUBUNYZNGFOA-ULKVUYOBSA-N	0	0	295.213	4.263	20	30		CIEDRN
N#Cc1cc2c(nc1NCc1cccc3ccccc31)CCC2	ZINC000321131686	329263928	/nfs/dbraw/zinc/26/39/28/329263928.db2.gz	RVRMOTAJGQRXIS-UHFFFAOYSA-N	0	0	299.377	4.207	20	30		CIEDRN
CC1(C#N)CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000227354304	329272158	/nfs/dbraw/zinc/27/21/58/329272158.db2.gz	QYRRGVPHPAYIOC-UHFFFAOYSA-N	0	0	283.202	4.119	20	30		CIEDRN
Cc1ccsc1CN(C)c1cc(C#N)c2ccccc2n1	ZINC000395040279	329274806	/nfs/dbraw/zinc/27/48/06/329274806.db2.gz	JXYCYXDAOQOLFT-UHFFFAOYSA-N	0	0	293.395	4.113	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(Oc2cccnc2)cc1	ZINC000582930546	329286255	/nfs/dbraw/zinc/28/62/55/329286255.db2.gz	NJTJDNFGRSUNHF-GOSISDBHSA-N	0	0	296.370	4.415	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)C2(C3CCC3)CCC2)cc1	ZINC000583007228	329301581	/nfs/dbraw/zinc/30/15/81/329301581.db2.gz	QCUOQZKSFHFFDG-UHFFFAOYSA-N	0	0	296.414	4.397	20	30		CIEDRN
CC(C)N(CCC#N)Cc1csc(Cl)c1Cl	ZINC000583061708	329309191	/nfs/dbraw/zinc/30/91/91/329309191.db2.gz	FZPDCXNLVIUIFD-UHFFFAOYSA-N	0	0	277.220	4.179	20	30		CIEDRN
N#CCC1CCN(Cc2c(Cl)cccc2Cl)CC1	ZINC000397213521	329344508	/nfs/dbraw/zinc/34/45/08/329344508.db2.gz	FKIBGITTWDFPNB-UHFFFAOYSA-N	0	0	283.202	4.119	20	30		CIEDRN
C=CCCC(=O)Nc1cccnc1-c1csc(C)c1	ZINC000186874906	329351177	/nfs/dbraw/zinc/35/11/77/329351177.db2.gz	BVCXTOJHXKBLPS-UHFFFAOYSA-N	0	0	272.373	4.023	20	30		CIEDRN
CC(=O)c1ccc(NCc2ccc(Cl)cc2C#N)cc1	ZINC000187703050	329362734	/nfs/dbraw/zinc/36/27/34/329362734.db2.gz	ZESGGZZFOUVZFC-UHFFFAOYSA-N	0	0	284.746	4.026	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)COCCCC	ZINC000189906668	329389751	/nfs/dbraw/zinc/38/97/51/329389751.db2.gz	GIZLZURGLDKWHX-UHFFFAOYSA-N	0	0	289.419	4.294	20	30		CIEDRN
Cc1c(C#N)cccc1C(=O)N[C@H](C)c1cccc(Cl)c1	ZINC000509033410	332856720	/nfs/dbraw/zinc/85/67/20/332856720.db2.gz	LEBXNBGKTPGAIB-GFCCVEGCSA-N	0	0	298.773	4.011	20	30		CIEDRN
CO[C@@H](C)c1cccc(NCc2ccc(C#N)c(F)c2)c1	ZINC000190367247	329395371	/nfs/dbraw/zinc/39/53/71/329395371.db2.gz	MUBOTJXVPNIORH-LBPRGKRZSA-N	0	0	284.334	4.017	20	30		CIEDRN
N#CCCCSCc1ccc(OC(F)(F)F)cc1	ZINC000190892619	329401817	/nfs/dbraw/zinc/40/18/17/329401817.db2.gz	VASVHXYRLBCZQC-UHFFFAOYSA-N	0	0	275.295	4.122	20	30		CIEDRN
Cc1cc(C)cc(OCCCSCCCC#N)c1	ZINC000190888439	329401877	/nfs/dbraw/zinc/40/18/77/329401877.db2.gz	IMLCQXMIXMYSPL-UHFFFAOYSA-N	0	0	263.406	4.109	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NCc1cc(C)on1	ZINC000190913228	329403080	/nfs/dbraw/zinc/40/30/80/329403080.db2.gz	DVJJZNCBBPPIGO-UHFFFAOYSA-N	0	0	270.376	4.447	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CCC(F)(c2ccccc2)CC1	ZINC000509101476	332859221	/nfs/dbraw/zinc/85/92/21/332859221.db2.gz	WZNGTAIDCVIDDL-UHFFFAOYSA-N	0	0	289.394	4.076	20	30		CIEDRN
CC(C)c1ccc(NCc2ccc(CC#N)cc2)cc1	ZINC000399021446	329447519	/nfs/dbraw/zinc/44/75/19/329447519.db2.gz	HMYZOAQXGPZYIO-UHFFFAOYSA-N	0	0	264.372	4.488	20	30		CIEDRN
N#CCc1ccc(CSCc2ccccc2)cc1	ZINC000399128293	329448508	/nfs/dbraw/zinc/44/85/08/329448508.db2.gz	LSFXUAJYDQTBFM-UHFFFAOYSA-N	0	0	253.370	4.186	20	30		CIEDRN
CC(=O)c1cc(Cl)ccc1OCc1ccc(CC#N)cc1	ZINC000399235138	329449192	/nfs/dbraw/zinc/44/91/92/329449192.db2.gz	HGITZYRYIWDKMN-UHFFFAOYSA-N	0	0	299.757	4.188	20	30		CIEDRN
CCC[C@@H]1CCCCN1c1nc(C(F)(F)F)ccc1C#N	ZINC000211427340	329542681	/nfs/dbraw/zinc/54/26/81/329542681.db2.gz	CHLWKVBXEHIMPE-GFCCVEGCSA-N	0	0	297.324	4.131	20	30		CIEDRN
CC[C@H](C)c1ccc(OCc2nc(C#N)cs2)cc1	ZINC000418774164	329551033	/nfs/dbraw/zinc/55/10/33/329551033.db2.gz	CVVACRXVVMKDMT-NSHDSACASA-N	0	0	272.373	4.107	20	30		CIEDRN
Cc1cc(NC(=O)c2cccc(C#N)c2C)ccc1C1CC1	ZINC000509326640	332865248	/nfs/dbraw/zinc/86/52/48/332865248.db2.gz	WDONYMXXOVTHJF-UHFFFAOYSA-N	0	0	290.366	4.305	20	30		CIEDRN
CO[C@@H](C)c1cccc(NCc2ccc(F)c(C#N)c2)c1	ZINC000124338385	329569391	/nfs/dbraw/zinc/56/93/91/329569391.db2.gz	LKLQWEBUWPZAOF-LBPRGKRZSA-N	0	0	284.334	4.017	20	30		CIEDRN
Cc1noc(C)c1CSCCC1(C#N)CCCCC1	ZINC000418818361	329575121	/nfs/dbraw/zinc/57/51/21/329575121.db2.gz	OGYGVIFLYKPQDV-UHFFFAOYSA-N	0	0	278.421	4.389	20	30		CIEDRN
CCCC(CCC)C(=O)N(C)[C@H](C)c1cccc(C#N)c1	ZINC000425636340	329575985	/nfs/dbraw/zinc/57/59/85/329575985.db2.gz	JPVXKVRJCYALIQ-CQSZACIVSA-N	0	0	286.419	4.294	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccccc1C(F)F	ZINC000425094306	329586453	/nfs/dbraw/zinc/58/64/53/329586453.db2.gz	TULXNMCGJNGJJO-JTQLQIEISA-N	0	0	253.292	4.165	20	30		CIEDRN
C[C@H](c1cccc(C#N)c1)N(C)C(=O)[C@H]1CC[C@@H](C)[C@H](C)C1	ZINC000425108179	329595334	/nfs/dbraw/zinc/59/53/34/329595334.db2.gz	KMWSKQDYMNKIDP-ADAWSYLGSA-N	0	0	298.430	4.150	20	30		CIEDRN
N#CCCCSc1nnc(-c2cccc3ccccc32)o1	ZINC000126934148	329595593	/nfs/dbraw/zinc/59/55/93/329595593.db2.gz	JJJDHANNZNJLBC-UHFFFAOYSA-N	0	0	295.367	4.286	20	30		CIEDRN
CC(C)CCCCC(=O)N(C)[C@H](C)c1cccc(C#N)c1	ZINC000425119085	329597377	/nfs/dbraw/zinc/59/73/77/329597377.db2.gz	YWMVWQXKOIUBDC-OAHLLOKOSA-N	0	0	286.419	4.294	20	30		CIEDRN
C[C@@H](c1cccc(C#N)c1)N(C)C(=O)C1CCCCCC1	ZINC000425121337	329598029	/nfs/dbraw/zinc/59/80/29/329598029.db2.gz	BYRNBPCXHVMRPJ-AWEZNQCLSA-N	0	0	284.403	4.048	20	30		CIEDRN
Cc1cc(C(=O)N(C)[C@H](C)c2cccc(C#N)c2)sc1C	ZINC000425128317	329603480	/nfs/dbraw/zinc/60/34/80/329603480.db2.gz	KFJREUHJBNCTDW-GFCCVEGCSA-N	0	0	298.411	4.070	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1cccc(C#N)c1C)c1ccccc1	ZINC000188724720	329609837	/nfs/dbraw/zinc/60/98/37/329609837.db2.gz	NRGKGXCVVLBGKC-KRWDZBQOSA-N	0	0	290.366	4.165	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(Cc2ccc(Cl)cc2)no1	ZINC000525954578	329646226	/nfs/dbraw/zinc/64/62/26/329646226.db2.gz	CCQZQSMUGAXACY-OAHLLOKOSA-N	0	0	276.767	4.168	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@@H]1c1ccc(C)s1	ZINC000133768382	329655204	/nfs/dbraw/zinc/65/52/04/329655204.db2.gz	WVGHOCWDSGMSSK-OAHLLOKOSA-N	0	0	289.444	4.488	20	30		CIEDRN
CC[C@H](Nc1cccc(OCCCC#N)c1)[C@H]1C[C@H]1C	ZINC000322091916	329686367	/nfs/dbraw/zinc/68/63/67/329686367.db2.gz	WNNXFASRNQSSFG-COXVUDFISA-N	0	0	272.392	4.216	20	30		CIEDRN
C[C@@H](SCC1(C#N)CCC1)c1cc(F)ccc1F	ZINC000419394866	329722468	/nfs/dbraw/zinc/72/24/68/329722468.db2.gz	SYCJRMCRKSZHAL-SNVBAGLBSA-N	0	0	267.344	4.453	20	30		CIEDRN
C[C@H](SCC1(C#N)CCC1)c1cc(F)ccc1F	ZINC000419394865	329722546	/nfs/dbraw/zinc/72/25/46/329722546.db2.gz	SYCJRMCRKSZHAL-JTQLQIEISA-N	0	0	267.344	4.453	20	30		CIEDRN
N#CC1(CSCc2csc(-c3ccoc3)n2)CCC1	ZINC000419415499	329725116	/nfs/dbraw/zinc/72/51/16/329725116.db2.gz	VFLBYTLXDGNZMI-UHFFFAOYSA-N	0	0	290.413	4.330	20	30		CIEDRN
N#CC1(CSCc2coc(-c3cccs3)n2)CCC1	ZINC000419381424	329725925	/nfs/dbraw/zinc/72/59/25/329725925.db2.gz	VXPSCQKTOIFZTR-UHFFFAOYSA-N	0	0	290.413	4.330	20	30		CIEDRN
C[C@H](SCCC1(C#N)CCCCC1)c1cnccn1	ZINC000419443626	329729543	/nfs/dbraw/zinc/72/95/43/329729543.db2.gz	BNCBVIRGQCHEJL-ZDUSSCGKSA-N	0	0	275.421	4.135	20	30		CIEDRN
CCc1cccc(CSCc2nc(C#N)cs2)c1	ZINC000419459998	329731715	/nfs/dbraw/zinc/73/17/15/329731715.db2.gz	FDRREJRFBIFCDA-UHFFFAOYSA-N	0	0	274.414	4.011	20	30		CIEDRN
CCc1nc(C(C)C)ccc1CSCCCC#N	ZINC000419487273	329736576	/nfs/dbraw/zinc/73/65/76/329736576.db2.gz	AVWRTMXJZYEXSL-UHFFFAOYSA-N	0	0	262.422	4.304	20	30		CIEDRN
N#CC1(CSCc2ccc(-c3ncco3)cc2F)CC1	ZINC000419623146	329740468	/nfs/dbraw/zinc/74/04/68/329740468.db2.gz	UGACFBZWIGSRIH-UHFFFAOYSA-N	0	0	288.347	4.018	20	30		CIEDRN
C[C@@H](CCSCC1(C#N)CCC1)OCc1ccccc1	ZINC000419587239	329741509	/nfs/dbraw/zinc/74/15/09/329741509.db2.gz	RVVWHMWTCFBROM-HNNXBMFYSA-N	0	0	289.444	4.409	20	30		CIEDRN
CC(C)(C#N)c1ccccc1CSCC1(C#N)CCC1	ZINC000419591051	329741706	/nfs/dbraw/zinc/74/17/06/329741706.db2.gz	WVYRVFLNYYUQPZ-UHFFFAOYSA-N	0	0	284.428	4.415	20	30		CIEDRN
C[C@@H](SCC1(C#N)CCC1)c1ncc(C(C)(C)C)o1	ZINC000419591143	329741832	/nfs/dbraw/zinc/74/18/32/329741832.db2.gz	XAHZEJDOZCVATI-LLVKDONJSA-N	0	0	278.421	4.460	20	30		CIEDRN
CC(C)CSCCCSCC1(C#N)CCC1	ZINC000419592768	329742009	/nfs/dbraw/zinc/74/20/09/329742009.db2.gz	YXOKOVHXSVFWQG-UHFFFAOYSA-N	0	0	257.468	4.193	20	30		CIEDRN
Cc1c(C#N)cccc1C(=O)N1CC[C@H](C)c2ccccc21	ZINC000509622304	332875519	/nfs/dbraw/zinc/87/55/19/332875519.db2.gz	CMFPSPUEXBRVFV-ZDUSSCGKSA-N	0	0	290.366	4.021	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)N[C@H](c1ccccc1)C1CC1	ZINC000432102858	329804143	/nfs/dbraw/zinc/80/41/43/329804143.db2.gz	NBLIXQBOUJFHKV-MRXNPFEDSA-N	0	0	286.419	4.039	20	30		CIEDRN
C[C@@H](Sc1cccc([N+](=O)[O-])c1)c1cccc(C#N)c1	ZINC000509706728	332879972	/nfs/dbraw/zinc/87/99/72/332879972.db2.gz	BACCHHSCFASPBS-LLVKDONJSA-N	0	0	284.340	4.320	20	30		CIEDRN
C=C[C@H](CC(=O)N1CC[C@H](C2CCCC2)C1)c1ccccc1	ZINC000421644921	329861579	/nfs/dbraw/zinc/86/15/79/329861579.db2.gz	GFBSRGLNYMKSCV-APWZRJJASA-N	0	0	297.442	4.385	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@@H](C)c1ccccc1OC(C)C	ZINC000525960265	329887542	/nfs/dbraw/zinc/88/75/42/329887542.db2.gz	RPIJBWQFKSYUQB-KSSFIOAISA-N	0	0	289.419	4.253	20	30		CIEDRN
N#Cc1c(C(F)F)cccc1N1CCc2ccccc2C1	ZINC000571724294	329916982	/nfs/dbraw/zinc/91/69/82/329916982.db2.gz	DCHHMRYJBVCWNH-UHFFFAOYSA-N	0	0	284.309	4.059	20	30		CIEDRN
C=CCn1c(C)nnc1S[C@H](CC)c1ccc(F)cc1	ZINC000077907340	329937926	/nfs/dbraw/zinc/93/79/26/329937926.db2.gz	HRUZFOBNHQQMGW-CQSZACIVSA-N	0	0	291.395	4.155	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H](C)Oc2cccc(C)c2)n1	ZINC000572017829	329938032	/nfs/dbraw/zinc/93/80/32/329938032.db2.gz	QBRKGTJGPSOYNL-CYBMUJFWSA-N	0	0	286.375	4.372	20	30		CIEDRN
C=CCN(C(=O)Nc1ccc2c3c(cccc31)CC2)C1CC1	ZINC000536817565	329939823	/nfs/dbraw/zinc/93/98/23/329939823.db2.gz	SZPWACXFHULAML-UHFFFAOYSA-N	0	0	292.382	4.121	20	30		CIEDRN
C[C@@H](NCc1ccccc1C#N)c1nc(C(C)(C)C)cs1	ZINC000162055263	329970693	/nfs/dbraw/zinc/97/06/93/329970693.db2.gz	FLBOVGXGSNAQRU-GFCCVEGCSA-N	0	0	299.443	4.163	20	30		CIEDRN
C=CCCCCCNC(=O)Nc1ccc(-c2ncco2)cc1	ZINC000572375813	330021716	/nfs/dbraw/zinc/02/17/16/330021716.db2.gz	XUAUBHDYIMQXKQ-UHFFFAOYSA-N	0	0	299.374	4.210	20	30		CIEDRN
CCc1nc(CSCc2ccccc2C#N)cs1	ZINC000079329489	330022286	/nfs/dbraw/zinc/02/22/86/330022286.db2.gz	AOIRUPKMSWXHPE-UHFFFAOYSA-N	0	0	274.414	4.011	20	30		CIEDRN
C=CCC[C@@H](C(=O)Nc1ccc(C)c(O)c1)c1ccccc1	ZINC000510067719	332890495	/nfs/dbraw/zinc/89/04/95/332890495.db2.gz	BNPTYCASQYNXRY-QGZVFWFLSA-N	0	0	295.382	4.389	20	30		CIEDRN
C=CCCC(=O)N1CCCCC[C@@H]1c1ccc(OC)cc1	ZINC000263694325	330060141	/nfs/dbraw/zinc/06/01/41/330060141.db2.gz	SCLSDLMJBJYOCK-QGZVFWFLSA-N	0	0	287.403	4.105	20	30		CIEDRN
C=C1CCN([C@@H](C)c2nc3ccccc3n2C(F)F)CC1	ZINC000264421581	330061469	/nfs/dbraw/zinc/06/14/69/330061469.db2.gz	ABRWMPPLBOGQKJ-LBPRGKRZSA-N	0	0	291.345	4.144	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(Cc1cccs1)C(C)C	ZINC000268230066	330065619	/nfs/dbraw/zinc/06/56/19/330065619.db2.gz	VAKINDRZAPCCEF-UHFFFAOYSA-N	0	0	277.433	4.254	20	30		CIEDRN
C=CCCCC(=O)N(C(C)C)[C@@H](C)c1ccsc1	ZINC000421693794	330067598	/nfs/dbraw/zinc/06/75/98/330067598.db2.gz	SSBDTCWOOWBPCV-ZDUSSCGKSA-N	0	0	265.422	4.402	20	30		CIEDRN
C=CCC[C@H](NC(=O)Nc1c(C)noc1C)c1ccccc1	ZINC000269418685	330069972	/nfs/dbraw/zinc/06/99/72/330069972.db2.gz	VCLSFEREAJRISY-HNNXBMFYSA-N	0	0	299.374	4.120	20	30		CIEDRN
C=CCCCC(=O)N1CC[C@@H](c2ccccc2)C1(C)C	ZINC000421721222	330074136	/nfs/dbraw/zinc/07/41/36/330074136.db2.gz	GVZUQSINVLQLOW-INIZCTEOSA-N	0	0	271.404	4.137	20	30		CIEDRN
C#CC[C@@H](NCc1ccn(C(CC)CC)n1)c1ccccc1	ZINC000271737279	330081955	/nfs/dbraw/zinc/08/19/55/330081955.db2.gz	UMDZTBSXCDICKC-LJQANCHMSA-N	0	0	295.430	4.098	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H]1c1ccsc1	ZINC000274278092	330104215	/nfs/dbraw/zinc/10/42/15/330104215.db2.gz	JLEXBSGJKPQNKO-TZMCWYRMSA-N	0	0	263.406	4.014	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1c(C)cccc1Cl	ZINC000274367120	330105327	/nfs/dbraw/zinc/10/53/27/330105327.db2.gz	UWPYKHHNOOQHDD-LLVKDONJSA-N	0	0	251.757	4.189	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cccc(SC)c1C	ZINC000274339123	330105514	/nfs/dbraw/zinc/10/55/14/330105514.db2.gz	LVRPNVTYMMPIPL-NSHDSACASA-N	0	0	263.406	4.258	20	30		CIEDRN
C=C(C)CCSc1nnc(COc2ccc(C)cc2)o1	ZINC000274752799	330107513	/nfs/dbraw/zinc/10/75/13/330107513.db2.gz	OMNDWCDTIZVRPG-UHFFFAOYSA-N	0	0	290.388	4.015	20	30		CIEDRN
C=C(C)CCSc1nnc(-c2ccccc2C)o1	ZINC000274713404	330107732	/nfs/dbraw/zinc/10/77/32/330107732.db2.gz	DXHRKYWADIZPSB-UHFFFAOYSA-N	0	0	260.362	4.103	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1ccc(OC(C)C)cc1Cl	ZINC000276078711	330111639	/nfs/dbraw/zinc/11/16/39/330111639.db2.gz	NQOVCWIONPGHGM-UHFFFAOYSA-N	0	0	296.798	4.167	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1c(C)cccc1C(C)C	ZINC000276297870	330112606	/nfs/dbraw/zinc/11/26/06/330112606.db2.gz	KUWOPEKUAQPPSZ-UHFFFAOYSA-N	0	0	260.381	4.158	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(Cc2cccc3cccnc32)no1	ZINC000276207869	330112833	/nfs/dbraw/zinc/11/28/33/330112833.db2.gz	OPOQAQXEKGMSCL-GOSISDBHSA-N	0	0	293.370	4.062	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1ccc(SC(F)F)cc1	ZINC000276343320	330113317	/nfs/dbraw/zinc/11/33/17/330113317.db2.gz	SJNITMHEPJBOTM-UHFFFAOYSA-N	0	0	286.347	4.041	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1n[nH]c(C)c1C	ZINC000276638537	330114260	/nfs/dbraw/zinc/11/42/60/330114260.db2.gz	QMLRZYVKJPPTHV-UHFFFAOYSA-N	0	0	297.402	4.131	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CCC(c2ccsc2)CC1	ZINC000276912606	330115089	/nfs/dbraw/zinc/11/50/89/330115089.db2.gz	KYUOENLKGUHOOD-INIZCTEOSA-N	0	0	277.433	4.056	20	30		CIEDRN
C#CCCCC(=O)N(C)[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000277223140	330115577	/nfs/dbraw/zinc/11/55/77/330115577.db2.gz	MBGOCEHGYHPNLG-GFCCVEGCSA-N	0	0	297.320	4.028	20	30		CIEDRN
C=CCC[C@@H](Nc1nnc(C2CC2)o1)c1ccccc1	ZINC000278456643	330116907	/nfs/dbraw/zinc/11/69/07/330116907.db2.gz	SIMGBVHRSYCJDY-CQSZACIVSA-N	0	0	269.348	4.066	20	30		CIEDRN
C=CCCCN(C)C(=O)C[C@@H](C)c1c[nH]c2ccccc21	ZINC000278408744	330116909	/nfs/dbraw/zinc/11/69/09/330116909.db2.gz	VKXOHSUMBDFEDH-CQSZACIVSA-N	0	0	284.403	4.086	20	30		CIEDRN
C=C(C)CN(CC)C(=O)C[C@@H](C)c1c[nH]c2ccccc21	ZINC000278535454	330117479	/nfs/dbraw/zinc/11/74/79/330117479.db2.gz	MARZAQLWJJLVLG-CQSZACIVSA-N	0	0	284.403	4.086	20	30		CIEDRN
C=C(C)CN(Cc1ncc(C2CC2)o1)Cc1ccccc1	ZINC000279410857	330123394	/nfs/dbraw/zinc/12/33/94/330123394.db2.gz	VXHNOABDUDSZNW-UHFFFAOYSA-N	0	0	282.387	4.130	20	30		CIEDRN
C=CCC(CC=C)C(=O)NCC(C)(C)C1CCCC1	ZINC000510162107	332895643	/nfs/dbraw/zinc/89/56/43/332895643.db2.gz	UPACOTHRWWMSKO-UHFFFAOYSA-N	0	0	263.425	4.087	20	30		CIEDRN
C=C(C)CSc1nc(-c2ccccc2)ccc1C#N	ZINC000510204909	332897213	/nfs/dbraw/zinc/89/72/13/332897213.db2.gz	CUGSEKRXJUUGNF-UHFFFAOYSA-N	0	0	266.369	4.288	20	30		CIEDRN
N#CCCN(Cc1csc2ccccc12)CC1CC1	ZINC000081044545	330160882	/nfs/dbraw/zinc/16/08/82/330160882.db2.gz	QKMKQNIPAVKXHZ-UHFFFAOYSA-N	0	0	270.401	4.027	20	30		CIEDRN
CC(C)Cc1ccc(C(=O)COc2cccc(C#N)c2)cc1	ZINC000510281348	332899287	/nfs/dbraw/zinc/89/92/87/332899287.db2.gz	MKYVJEJISRQNJG-UHFFFAOYSA-N	0	0	293.366	4.018	20	30		CIEDRN
COc1ccc([C@@H](C)[C@H](C)Nc2cccc(C#N)c2)cc1	ZINC000527218657	330238312	/nfs/dbraw/zinc/23/83/12/330238312.db2.gz	UVBWQAGHBMCJGD-KBPBESRZSA-N	0	0	280.371	4.171	20	30		CIEDRN
C=CCCC1(C(=O)NCc2c(Cl)cccc2Cl)CC1	ZINC000527225068	330238977	/nfs/dbraw/zinc/23/89/77/330238977.db2.gz	STPKPUBKFKJQJR-UHFFFAOYSA-N	0	0	298.213	4.356	20	30		CIEDRN
C=CCCC1(C(=O)N[C@@H]2CCCCc3ccccc32)CC1	ZINC000527240491	330240922	/nfs/dbraw/zinc/24/09/22/330240922.db2.gz	OSVPXJYNWLZVKE-QGZVFWFLSA-N	0	0	283.415	4.317	20	30		CIEDRN
C[C@@H]1CC(F)(F)CC[N@@H+]1Cc1ccccc1C(C)(C)C#N	ZINC000528764364	330257665	/nfs/dbraw/zinc/25/76/65/330257665.db2.gz	FESMRFWYGBYFHW-CYBMUJFWSA-N	0	0	292.373	4.107	20	30		CIEDRN
N#C[C@@H]1CCC[C@H](Nc2cccc(C3CCOCC3)c2)C1	ZINC000527994192	330299399	/nfs/dbraw/zinc/29/93/99/330299399.db2.gz	HRVPPHDTFPZIST-PBHICJAKSA-N	0	0	284.403	4.075	20	30		CIEDRN
COc1c(C)cc(Cl)cc1N[C@H]1CCC[C@H](C#N)C1	ZINC000527973604	330301812	/nfs/dbraw/zinc/30/18/12/330301812.db2.gz	JXBMYNSBBPHGPA-AAEUAGOBSA-N	0	0	278.783	4.151	20	30		CIEDRN
N#Cc1c(F)cccc1N[C@H](c1ccccn1)C1CCC1	ZINC000528132543	330308820	/nfs/dbraw/zinc/30/88/20/330308820.db2.gz	CLALDVCLENMULZ-KRWDZBQOSA-N	0	0	281.334	4.046	20	30		CIEDRN
Cc1cc(C#N)cc(N[C@@H]2CCc3cc(Cl)ccc32)n1	ZINC000528193469	330312344	/nfs/dbraw/zinc/31/23/44/330312344.db2.gz	OOQLBMMHFRBXAW-OAHLLOKOSA-N	0	0	283.762	4.015	20	30		CIEDRN
CCC(C#N)(CC)c1nc(C2(c3cccc(C)c3)CC2)no1	ZINC000528199937	330312643	/nfs/dbraw/zinc/31/26/43/330312643.db2.gz	ZCQOULZTGKKDRR-UHFFFAOYSA-N	0	0	295.386	4.039	20	30		CIEDRN
Cc1ccc2sc(-c3ccc(C#N)cc3F)nc2c1	ZINC000532988657	330323269	/nfs/dbraw/zinc/32/32/69/330323269.db2.gz	RVCBCRQOQJPPLU-UHFFFAOYSA-N	0	0	268.316	4.283	20	30		CIEDRN
C[C@H](c1ccccc1F)N(C)CC#Cc1ccc(F)cc1	ZINC000533001642	330325004	/nfs/dbraw/zinc/32/50/04/330325004.db2.gz	JBKXRJBNQAZTRD-CQSZACIVSA-N	0	0	285.337	4.009	20	30		CIEDRN
N#CCCCN(CCc1ccccc1)c1ccccc1	ZINC000533046822	330326282	/nfs/dbraw/zinc/32/62/82/330326282.db2.gz	GUALJFDVPVICES-UHFFFAOYSA-N	0	0	264.372	4.039	20	30		CIEDRN
CCCCc1ccc(NC(=O)C2(C#N)CCCCC2)cc1	ZINC000044385230	330327998	/nfs/dbraw/zinc/32/79/98/330327998.db2.gz	YETMFVRIIIJIJE-UHFFFAOYSA-N	0	0	284.403	4.442	20	30		CIEDRN
C=C(C)C(C)(C)c1nc(-c2ccc(COCC)cc2)no1	ZINC000424338165	330343690	/nfs/dbraw/zinc/34/36/90/330343690.db2.gz	NFJSYAGQKVRAQB-UHFFFAOYSA-N	0	0	286.375	4.127	20	30		CIEDRN
C=C(C)C(C)(C)c1nc(Cc2c[nH]c3c2cccc3C)no1	ZINC000424343953	330344458	/nfs/dbraw/zinc/34/44/58/330344458.db2.gz	BEGZMUKCLMITFC-UHFFFAOYSA-N	0	0	295.386	4.304	20	30		CIEDRN
C=C(C)C(C)(C)c1nc(-c2ccc(F)cc2C)no1	ZINC000424347542	330344925	/nfs/dbraw/zinc/34/49/25/330344925.db2.gz	LPSABXGRZKNTNS-UHFFFAOYSA-N	0	0	260.312	4.038	20	30		CIEDRN
C=C[C@@H]1OCCC[C@H]1c1nc([C@@H]2CCCC(C)(C)C2)no1	ZINC000424361361	330346970	/nfs/dbraw/zinc/34/69/70/330346970.db2.gz	LJAPAPYKCSKJKN-MCIONIFRSA-N	0	0	290.407	4.202	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(-c2cnc3ccccc3c2)no1	ZINC000580496527	330350865	/nfs/dbraw/zinc/35/08/65/330350865.db2.gz	PEVQETPQOOOFJI-QGZVFWFLSA-N	0	0	279.343	4.139	20	30		CIEDRN
Cc1cc(C(=O)N(CC(C)C)c2ccc(C#N)cc2)oc1C	ZINC000533182347	330352647	/nfs/dbraw/zinc/35/26/47/330352647.db2.gz	FBIVCFYRVDHQNS-UHFFFAOYSA-N	0	0	296.370	4.071	20	30		CIEDRN
C[C@@H](c1ccccc1Cl)N(C)Cc1cccc(C#N)c1	ZINC000046517973	330353543	/nfs/dbraw/zinc/35/35/43/330353543.db2.gz	KUJNNIHYUMFFNV-ZDUSSCGKSA-N	0	0	284.790	4.405	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)CCc1cccc(Cl)c1	ZINC000533214330	330353948	/nfs/dbraw/zinc/35/39/48/330353948.db2.gz	JIVQOVLEFQXVLU-UHFFFAOYSA-N	0	0	298.773	4.091	20	30		CIEDRN
C=CCC[C@@H](NC(=O)C[C@@H](C)n1cccc1)c1ccccc1	ZINC000533261597	330355770	/nfs/dbraw/zinc/35/57/70/330355770.db2.gz	FPDHEDSZNPRJAL-SJLPKXTDSA-N	0	0	296.414	4.263	20	30		CIEDRN
C=CC1CCN(C(=O)c2cscc2-c2ccccc2)CC1	ZINC000580502177	330357074	/nfs/dbraw/zinc/35/70/74/330357074.db2.gz	IBDRPPZFFLWLAB-UHFFFAOYSA-N	0	0	297.423	4.453	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1ccc(SC(C)C)cc1	ZINC000055115799	330362867	/nfs/dbraw/zinc/36/28/67/330362867.db2.gz	CRQOSTAWGUMLRS-UHFFFAOYSA-N	0	0	277.433	4.225	20	30		CIEDRN
C=C(CC)CSc1nnc(-c2ccccc2C)o1	ZINC000536904919	330363667	/nfs/dbraw/zinc/36/36/67/330363667.db2.gz	LRSXKBNAPKDHHE-UHFFFAOYSA-N	0	0	260.362	4.103	20	30		CIEDRN
CCCC[C@@H](CC)CC(=O)N(C)Cc1ccc(C#N)cc1	ZINC000117128874	330363786	/nfs/dbraw/zinc/36/37/86/330363786.db2.gz	FSBMQZSGUOAIFE-OAHLLOKOSA-N	0	0	286.419	4.123	20	30		CIEDRN
CCCC[C@H](CC)CC(=O)N(C)Cc1ccc(C#N)cc1	ZINC000117128877	330363851	/nfs/dbraw/zinc/36/38/51/330363851.db2.gz	FSBMQZSGUOAIFE-HNNXBMFYSA-N	0	0	286.419	4.123	20	30		CIEDRN
C=CCCCSc1nnc(-c2ccc(C)cc2)o1	ZINC000117548279	330365976	/nfs/dbraw/zinc/36/59/76/330365976.db2.gz	VAKJOGZIDFPVLT-UHFFFAOYSA-N	0	0	260.362	4.103	20	30		CIEDRN
C=CCCC(=O)N[C@H](c1ccc(F)cc1F)C(C)(C)C	ZINC000119134726	330371208	/nfs/dbraw/zinc/37/12/08/330371208.db2.gz	VJIQWPGPCKQFPF-OAHLLOKOSA-N	0	0	281.346	4.134	20	30		CIEDRN
CC[C@H]1c2ccsc2CCN1Cc1ccc(C#N)s1	ZINC000119133164	330371284	/nfs/dbraw/zinc/37/12/84/330371284.db2.gz	JUYRKUZHZOFXSA-AWEZNQCLSA-N	0	0	288.441	4.191	20	30		CIEDRN
N#Cc1ccc(-c2csc(Cc3ccc(F)cc3)n2)cc1	ZINC000057362699	330373206	/nfs/dbraw/zinc/37/32/06/330373206.db2.gz	SXLDRQHLZMHGIE-UHFFFAOYSA-N	0	0	294.354	4.412	20	30		CIEDRN
CCCN(Cc1nc(C)c(C)s1)Cc1ccc(C#N)cc1	ZINC000088577838	330377516	/nfs/dbraw/zinc/37/75/16/330377516.db2.gz	QPLFNTLLTZZFQT-UHFFFAOYSA-N	0	0	299.443	4.044	20	30		CIEDRN
C[C@@H](c1ccc(Cl)c(Cl)c1)N1CCC(C#N)CC1	ZINC000057872717	330379156	/nfs/dbraw/zinc/37/91/56/330379156.db2.gz	KHYZLZGEPPZCGW-JTQLQIEISA-N	0	0	283.202	4.290	20	30		CIEDRN
C[C@@H](C#N)N[C@@H](Cc1ccccc1Cl)c1ccccc1	ZINC000119762622	330379605	/nfs/dbraw/zinc/37/96/05/330379605.db2.gz	UYIYTDPSQWVENQ-GUYCJALGSA-N	0	0	284.790	4.125	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@@H](CC)CCC)c1ccccc1	ZINC000119860277	330380453	/nfs/dbraw/zinc/38/04/53/330380453.db2.gz	CCQUHXHTKKUHRS-ZBFHGGJFSA-N	0	0	259.393	4.041	20	30		CIEDRN
C[C@H]1CCC[C@H](CCN(CCC#N)Cc2ccccn2)C1	ZINC000089129864	330380836	/nfs/dbraw/zinc/38/08/36/330380836.db2.gz	JNEOEFQSKIZCSO-DLBZAZTESA-N	0	0	285.435	4.014	20	30		CIEDRN
Cc1cc(Cl)cc(C)c1C[NH2+]Cc1cccc(C#N)c1	ZINC000119893469	330381320	/nfs/dbraw/zinc/38/13/20/330381320.db2.gz	VVLZAKLRCYESQB-UHFFFAOYSA-N	0	0	284.790	4.118	20	30		CIEDRN
COCc1cc(Cl)ccc1NCCCC(C)(C)C#N	ZINC000424578033	330386849	/nfs/dbraw/zinc/38/68/49/330386849.db2.gz	QPGCPFUAVLXSKS-UHFFFAOYSA-N	0	0	280.799	4.228	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@H](C)c1cc(C)sc1C	ZINC000424580897	330387349	/nfs/dbraw/zinc/38/73/49/330387349.db2.gz	GDGDXQICLCPHMV-LLVKDONJSA-N	0	0	265.422	4.144	20	30		CIEDRN
C[C@@H](Cc1ccccc1F)Nc1c(F)cc(C#N)cc1F	ZINC000303060963	332903542	/nfs/dbraw/zinc/90/35/42/332903542.db2.gz	YFVIENBMACPBPM-JTQLQIEISA-N	0	0	290.288	4.019	20	30		CIEDRN
C=CCCC[C@@H](C)N(C)Cc1csc([C@H](C)OCC)n1	ZINC000537048594	330394825	/nfs/dbraw/zinc/39/48/25/330394825.db2.gz	RDDMFFITWRDRDC-KGLIPLIRSA-N	0	0	296.480	4.417	20	30		CIEDRN
CN(C(=O)c1cc2ccccc2s1)c1cccc(C#N)c1	ZINC000059095692	330396090	/nfs/dbraw/zinc/39/60/90/330396090.db2.gz	TVRHJQOPQCPGEB-UHFFFAOYSA-N	0	0	292.363	4.050	20	30		CIEDRN
Cc1oc2ccccc2c1CNc1ccc(CC#N)cc1	ZINC000121261426	330398706	/nfs/dbraw/zinc/39/87/06/330398706.db2.gz	UTKWHYOIQKSOCN-UHFFFAOYSA-N	0	0	276.339	4.419	20	30		CIEDRN
C=CC[C@H](C)NC(=O)C[C@H](C)c1ccccc1C(F)(F)F	ZINC000121348055	330400722	/nfs/dbraw/zinc/40/07/22/330400722.db2.gz	SVOJOVAREZHLAX-RYUDHWBXSA-N	0	0	299.336	4.280	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)[C@@H](C)c1cccc(C)c1	ZINC000121843724	330406911	/nfs/dbraw/zinc/40/69/11/330406911.db2.gz	LMGRZYDMXWQJPJ-HNNXBMFYSA-N	0	0	286.419	4.077	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)[C@H](C)c1cccc(C)c1	ZINC000121843888	330406915	/nfs/dbraw/zinc/40/69/15/330406915.db2.gz	LMGRZYDMXWQJPJ-OAHLLOKOSA-N	0	0	286.419	4.077	20	30		CIEDRN
Cc1cnn(-c2ccc(C)cc2NCC(C)(C)CCC#N)c1	ZINC000092139325	330407391	/nfs/dbraw/zinc/40/73/91/330407391.db2.gz	XMNZWYSYRIQWLQ-UHFFFAOYSA-N	0	0	296.418	4.231	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N[C@H](C)c1ccc(C)cc1	ZINC000537186392	330412894	/nfs/dbraw/zinc/41/28/94/330412894.db2.gz	SZRSVBYBAKIVHI-HUUCEWRRSA-N	0	0	274.408	4.100	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N[C@@H](C)c1c(F)cccc1F	ZINC000537186255	330412981	/nfs/dbraw/zinc/41/29/81/330412981.db2.gz	NSCYDORECNRCGA-NEPJUHHUSA-N	0	0	296.361	4.070	20	30		CIEDRN
CC[C@H](C#N)N[C@@H](CCc1ccccc1)c1ccccc1	ZINC000122208395	330415696	/nfs/dbraw/zinc/41/56/96/330415696.db2.gz	VUANKSJXOWEHOF-MOPGFXCFSA-N	0	0	278.399	4.252	20	30		CIEDRN
CC[C@@H](C#N)N[C@H](CC(C)(C)C)c1ccc(F)cc1	ZINC000122247570	330416309	/nfs/dbraw/zinc/41/63/09/330416309.db2.gz	DHZOGAUUCYIHLI-LSDHHAIUSA-N	0	0	262.372	4.195	20	30		CIEDRN
CC[C@@H](C#N)Nc1cccc(CSC(C)C)c1C	ZINC000122249114	330416335	/nfs/dbraw/zinc/41/63/35/330416335.db2.gz	VATFHMKTLMSJPM-AWEZNQCLSA-N	0	0	262.422	4.351	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N(C)C1CCCCCC1	ZINC000069606966	330423727	/nfs/dbraw/zinc/42/37/27/330423727.db2.gz	ZRHAQTNFALKABD-UHFFFAOYSA-N	0	0	285.391	4.053	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)[C@@H](C)c1cc(F)ccc1F	ZINC000122696852	330427479	/nfs/dbraw/zinc/42/74/79/330427479.db2.gz	INBQOQJQSAHRRW-LBPRGKRZSA-N	0	0	293.357	4.253	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)C[C@H](C)Cc1cccc(F)c1	ZINC000537226505	330429400	/nfs/dbraw/zinc/42/94/00/330429400.db2.gz	YPAFIDOIHHVABD-CABCVRRESA-N	0	0	291.410	4.255	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)C[C@@H](C)c1ccc(F)cc1F	ZINC000537228062	330429507	/nfs/dbraw/zinc/42/95/07/330429507.db2.gz	BHJUVADZSXQWKY-CHWSQXEVSA-N	0	0	295.373	4.319	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@@H]1CCSc2ccccc21	ZINC000537229040	330429573	/nfs/dbraw/zinc/42/95/73/330429573.db2.gz	FNWFOARSYZXWAX-DZGCQCFKSA-N	0	0	289.444	4.127	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)CCc1cc(Cl)cs1	ZINC000537230762	330429763	/nfs/dbraw/zinc/42/97/63/330429763.db2.gz	SYDIKGHYMHWXEU-NSHDSACASA-N	0	0	285.840	4.195	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1cc2sccc2s1	ZINC000537233358	330429922	/nfs/dbraw/zinc/42/99/22/330429922.db2.gz	WZRXWHSVFMVEBL-SNVBAGLBSA-N	0	0	279.430	4.437	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1cccc(SC)c1	ZINC000537237401	330430068	/nfs/dbraw/zinc/43/00/68/330430068.db2.gz	JRCQYCSBFQXQSH-LBPRGKRZSA-N	0	0	278.421	4.275	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)[C@H]1CCCC(C)(C)C1	ZINC000537237222	330430082	/nfs/dbraw/zinc/43/00/82/330430082.db2.gz	PUZXNIRBIHYIPH-KGLIPLIRSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1c(C)cccc1F)c1ccccc1	ZINC000537330107	330432975	/nfs/dbraw/zinc/43/29/75/330432975.db2.gz	MERPONFGCSLUEV-AWEZNQCLSA-N	0	0	283.346	4.433	20	30		CIEDRN
C[C@@H](Nc1ccc(F)c(F)c1)c1ccc(C#N)c(F)c1	ZINC000537445170	330437069	/nfs/dbraw/zinc/43/70/69/330437069.db2.gz	PLODIUZFIBCQIV-SECBINFHSA-N	0	0	276.261	4.149	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1ccc2cnn(C(C)C)c2c1	ZINC000424647899	330441515	/nfs/dbraw/zinc/44/15/15/330441515.db2.gz	WAPIHFNSYCZIPC-UHFFFAOYSA-N	0	0	285.391	4.158	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N1CCC(c2ccccc2C)CC1	ZINC000424654522	330442302	/nfs/dbraw/zinc/44/23/02/330442302.db2.gz	USTSXBDFCZDBQN-UHFFFAOYSA-N	0	0	285.431	4.303	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1cc(C)ccc1Cl	ZINC000424724310	330453299	/nfs/dbraw/zinc/45/32/99/330453299.db2.gz	DYRBTPIAQSZZTF-UHFFFAOYSA-N	0	0	251.757	4.189	20	30		CIEDRN
CCC[C@H](C#N)NC(=O)[C@H](CCC)CC1CCCCC1	ZINC000537725162	330457381	/nfs/dbraw/zinc/45/73/81/330457381.db2.gz	OQZSGQKVJGRERT-HZPDHXFCSA-N	0	0	278.440	4.182	20	30		CIEDRN
C=C[C@H](CC(=O)N1CC[C@@H](C)C2(CCC2)C1)c1ccccc1	ZINC000537823012	330458379	/nfs/dbraw/zinc/45/83/79/330458379.db2.gz	HRNPAVOSMUSYOB-IAGOWNOFSA-N	0	0	297.442	4.385	20	30		CIEDRN
CCC(CC)N(CC)C(=O)C[C@H](CC#N)c1ccccc1	ZINC000514756628	330463731	/nfs/dbraw/zinc/46/37/31/330463731.db2.gz	ZGGVXPBTURCOTN-INIZCTEOSA-N	0	0	286.419	4.111	20	30		CIEDRN
Cc1ccc2c(cccc2OCc2ccc(CC#N)cc2)n1	ZINC000514762019	330464427	/nfs/dbraw/zinc/46/44/27/330464427.db2.gz	RITNYDZFOFKMPX-UHFFFAOYSA-N	0	0	288.350	4.188	20	30		CIEDRN
N#Cc1ccc(N[C@@H]2CSc3ccccc32)cc1Cl	ZINC000083748538	330482395	/nfs/dbraw/zinc/48/23/95/330482395.db2.gz	IIMIZXFKEZJIOO-CQSZACIVSA-N	0	0	286.787	4.471	20	30		CIEDRN
Cc1ccc(C[C@H](C)Nc2c(F)cc(C#N)cc2F)s1	ZINC000084219646	330484710	/nfs/dbraw/zinc/48/47/10/330484710.db2.gz	UKXYVAHFYXNAFQ-VIFPVBQESA-N	0	0	292.354	4.250	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)[C@@H](C)c1ccc2ccccc2c1	ZINC000084604753	330486965	/nfs/dbraw/zinc/48/69/65/330486965.db2.gz	CWJLMQYFVIUSEI-KGLIPLIRSA-N	0	0	267.372	4.024	20	30		CIEDRN
CC(C)c1ccc2ncc(C#N)c(N3CCC[C@@H](F)C3)c2c1	ZINC000516520778	330494376	/nfs/dbraw/zinc/49/43/76/330494376.db2.gz	QOZBLALCTUTZHP-OAHLLOKOSA-N	0	0	297.377	4.168	20	30		CIEDRN
CCS[C@@H]1CCCC[C@@H]1Nc1ncc(C#N)cc1Cl	ZINC000426355838	330505490	/nfs/dbraw/zinc/50/54/90/330505490.db2.gz	DRGRHLGZVRLNFI-QWHCGFSZSA-N	0	0	295.839	4.083	20	30		CIEDRN
Cc1nc2ccc(CNc3cccc(C#N)c3C)cc2s1	ZINC000426368939	330505830	/nfs/dbraw/zinc/50/58/30/330505830.db2.gz	FYKDLQDEYLTQAH-UHFFFAOYSA-N	0	0	293.395	4.397	20	30		CIEDRN
C=CCC(C)(C)c1nc([C@H](C)c2c(F)cccc2F)no1	ZINC000426416217	330507603	/nfs/dbraw/zinc/50/76/03/330507603.db2.gz	GTWYLVOBVPVCIQ-SNVBAGLBSA-N	0	0	292.329	4.353	20	30		CIEDRN
C=CCC(C)(C)c1nc(-c2ccccc2CC)no1	ZINC000426440437	330509404	/nfs/dbraw/zinc/50/94/04/330509404.db2.gz	PFZBSSITHGAAJM-UHFFFAOYSA-N	0	0	256.349	4.153	20	30		CIEDRN
CC#CCCCc1nc(-c2cccc(SCC)c2)no1	ZINC000426611116	330513087	/nfs/dbraw/zinc/51/30/87/330513087.db2.gz	PUHRFAALDLRQNS-UHFFFAOYSA-N	0	0	286.400	4.195	20	30		CIEDRN
CC#CCCCC(=O)N(c1cnc2ccccc2c1)C(C)C	ZINC000448460139	330544866	/nfs/dbraw/zinc/54/48/66/330544866.db2.gz	WKXSOSLDVKIMPN-UHFFFAOYSA-N	0	0	294.398	4.170	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)CC1CC(C)(C)C1	ZINC000429854037	330555816	/nfs/dbraw/zinc/55/58/16/330555816.db2.gz	NMNXPYCOTVMPSA-UHFFFAOYSA-N	0	0	271.404	4.028	20	30		CIEDRN
Cc1ccc(C)c(-n2ccnc2S[C@H]2CC[C@H](C#N)C2)c1	ZINC000430126991	330561947	/nfs/dbraw/zinc/56/19/47/330561947.db2.gz	WDJJWMKXEVKZSS-GJZGRUSLSA-N	0	0	297.427	4.274	20	30		CIEDRN
Cc1ccc2c(c1)nc(-c1ccc(F)c(C#N)c1Cl)n2C	ZINC000430892967	330576458	/nfs/dbraw/zinc/57/64/58/330576458.db2.gz	HGQVORYOOUDEQX-UHFFFAOYSA-N	0	0	299.736	4.213	20	30		CIEDRN
N#Cc1cc(F)ccc1N[C@H]1C[C@H](c2ccc(F)cc2)C1	ZINC000431496828	330585671	/nfs/dbraw/zinc/58/56/71/330585671.db2.gz	VLGNSPMIOMGVTM-YGUOUDRMSA-N	0	0	284.309	4.195	20	30		CIEDRN
CCC[C@H](C(=O)Nc1cccc(C#N)c1C)c1ccccc1	ZINC000432343193	330597674	/nfs/dbraw/zinc/59/76/74/330597674.db2.gz	SFGSVPNKVNYBFO-KRWDZBQOSA-N	0	0	292.382	4.389	20	30		CIEDRN
N#Cc1cc(NCc2ccccc2OCC2CC2)ccc1F	ZINC000432425947	330599120	/nfs/dbraw/zinc/59/91/20/330599120.db2.gz	XPZWNBMXQLEHEO-UHFFFAOYSA-N	0	0	296.345	4.098	20	30		CIEDRN
N#Cc1cc(NCc2cnc3ccccc3c2)ccc1Cl	ZINC000432425031	330599152	/nfs/dbraw/zinc/59/91/52/330599152.db2.gz	SQEWSKLVFANFGO-UHFFFAOYSA-N	0	0	293.757	4.372	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)N(C)Cc1ccccc1Cl	ZINC000432562695	330600927	/nfs/dbraw/zinc/60/09/27/330600927.db2.gz	NDXKWXBWYQFUDB-UHFFFAOYSA-N	0	0	294.826	4.084	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)Nc1ccc2ncsc2c1	ZINC000432717255	330604103	/nfs/dbraw/zinc/60/41/03/330604103.db2.gz	GRDKDZANCXCRGN-UHFFFAOYSA-N	0	0	289.404	4.020	20	30		CIEDRN
CC(C)(C)CN(CCC#N)C(=O)c1sccc1C1CC1	ZINC000432931391	330610800	/nfs/dbraw/zinc/61/08/00/330610800.db2.gz	KPKVNDDTLFZDMM-UHFFFAOYSA-N	0	0	290.432	4.027	20	30		CIEDRN
CSc1ccccc1NCC#Cc1ccc(F)cc1	ZINC000433437158	330627964	/nfs/dbraw/zinc/62/79/64/330627964.db2.gz	NMMUDMJORUMORK-UHFFFAOYSA-N	0	0	271.360	4.011	20	30		CIEDRN
COc1ccc(C#N)cc1CNc1cccc2ccccc21	ZINC000151883406	330628228	/nfs/dbraw/zinc/62/82/28/330628228.db2.gz	LHJBOXXHZAJUNG-UHFFFAOYSA-N	0	0	288.350	4.332	20	30		CIEDRN
C=CCN(C(=O)[C@@H]1CCCc2sccc21)c1ccccc1	ZINC000433997841	330633654	/nfs/dbraw/zinc/63/36/54/330633654.db2.gz	BTVOWRQNARSLHS-MRXNPFEDSA-N	0	0	297.423	4.387	20	30		CIEDRN
N#Cc1cccc(SCCCC(=O)c2ccc(F)cc2)c1	ZINC000435042425	330648629	/nfs/dbraw/zinc/64/86/29/330648629.db2.gz	MWDZWAQZKAXAPX-UHFFFAOYSA-N	0	0	299.370	4.453	20	30		CIEDRN
C=CCC[C@H](NC(=O)N1CCC(C=C)CC1)c1ccccc1	ZINC000435106809	330649410	/nfs/dbraw/zinc/64/94/10/330649410.db2.gz	DFCHOOMNXQBRJL-SFHVURJKSA-N	0	0	298.430	4.302	20	30		CIEDRN
C=CCC[C@@H](NC(=O)c1ccc(Cl)o1)c1ccccc1	ZINC000435267066	330651896	/nfs/dbraw/zinc/65/18/96/330651896.db2.gz	LLKHWTHRERZVEV-CYBMUJFWSA-N	0	0	289.762	4.370	20	30		CIEDRN
N#Cc1ccc(N[C@H]2C[C@H](c3ccccc3F)C2)cc1	ZINC000435582354	330657911	/nfs/dbraw/zinc/65/79/11/330657911.db2.gz	DFOHCIFJHSYHRE-CTYIDZIISA-N	0	0	266.319	4.055	20	30		CIEDRN
N#Cc1ccc(N[C@H]2C[C@H](c3cc(F)cc(F)c3)C2)cc1	ZINC000435585471	330658077	/nfs/dbraw/zinc/65/80/77/330658077.db2.gz	SEHPLJFHGCWJOK-WJYNOGRTSA-N	0	0	284.309	4.195	20	30		CIEDRN
CC[C@@H](C#N)Sc1nc2c(n1-c1ccccc1)CCCC2	ZINC000436040336	330667794	/nfs/dbraw/zinc/66/77/94/330667794.db2.gz	JRUVKKSVXGFQGI-AWEZNQCLSA-N	0	0	297.427	4.145	20	30		CIEDRN
C=C[C@@H](CC(=O)N(CC1CCC1)C(C)C)c1ccccc1	ZINC000436290142	330673815	/nfs/dbraw/zinc/67/38/15/330673815.db2.gz	NXPJGYHBAVQZEZ-KRWDZBQOSA-N	0	0	285.431	4.383	20	30		CIEDRN
Cc1ccccc1[C@H](Nc1c(C#N)cccc1C#N)C1CC1	ZINC000436392545	330676470	/nfs/dbraw/zinc/67/64/70/330676470.db2.gz	UACXJDRSSLLSLK-LJQANCHMSA-N	0	0	287.366	4.302	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(Cl)cc1Br	ZINC000155492128	330683796	/nfs/dbraw/zinc/68/37/96/330683796.db2.gz	FSQWCZKSJIGTRR-UHFFFAOYSA-N	0	0	288.572	4.007	20	30		CIEDRN
C=CCC[C@H](CC)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000437137466	330694581	/nfs/dbraw/zinc/69/45/81/330694581.db2.gz	NLDFUNDVQBZIPH-INIZCTEOSA-N	0	0	286.419	4.079	20	30		CIEDRN
C=CCCCS[C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000437269689	330696598	/nfs/dbraw/zinc/69/65/98/330696598.db2.gz	PSSIAXVOYCKLMW-LLVKDONJSA-N	0	0	251.351	4.355	20	30		CIEDRN
Cc1nc(-c2cccc(NCc3ccc(C#N)o3)c2)cs1	ZINC000155735333	330696962	/nfs/dbraw/zinc/69/69/62/330696962.db2.gz	QVWIFQAFSWTIIU-UHFFFAOYSA-N	0	0	295.367	4.195	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)C1=C(C)CCC1	ZINC000437367029	330698494	/nfs/dbraw/zinc/69/84/94/330698494.db2.gz	VHDDBBQKMDJOKL-UHFFFAOYSA-N	0	0	295.835	4.417	20	30		CIEDRN
Cc1ccccc1[C@H](NC(=O)c1cc(C#N)cs1)C(C)C	ZINC000437570449	330702960	/nfs/dbraw/zinc/70/29/60/330702960.db2.gz	RVNGBSFKFVPDAA-MRXNPFEDSA-N	0	0	298.411	4.055	20	30		CIEDRN
C[C@@H](C#N)CSc1ccccc1NCCC1CC1	ZINC000438324268	330720897	/nfs/dbraw/zinc/72/08/97/330720897.db2.gz	FCYMDXFFUVARSK-LBPRGKRZSA-N	0	0	260.406	4.150	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1ccccc1OC(C)(C)C	ZINC000439496867	330739713	/nfs/dbraw/zinc/73/97/13/330739713.db2.gz	WIALIVDUHMWEFM-ZDUSSCGKSA-N	0	0	290.407	4.340	20	30		CIEDRN
N#Cc1ccccc1SCc1cccc(OC(F)F)c1	ZINC000439712611	330742360	/nfs/dbraw/zinc/74/23/60/330742360.db2.gz	YJMSVZYVWSIHFP-UHFFFAOYSA-N	0	0	291.322	4.452	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1ccc(F)c(C2CC2)c1	ZINC000439790362	330743328	/nfs/dbraw/zinc/74/33/28/330743328.db2.gz	BUPHUVDRYHRDPB-GFCCVEGCSA-N	0	0	276.355	4.179	20	30		CIEDRN
C=CC(C)(C)C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000448624125	330744076	/nfs/dbraw/zinc/74/40/76/330744076.db2.gz	XCGBDPJCNHDUEX-UHFFFAOYSA-N	0	0	285.431	4.070	20	30		CIEDRN
C[C@H](CC(=O)N(C)c1ccc(C#N)cc1)C1CCCCC1	ZINC000440047667	330745872	/nfs/dbraw/zinc/74/58/72/330745872.db2.gz	BVVGZDSRIYWIMW-CQSZACIVSA-N	0	0	284.403	4.128	20	30		CIEDRN
C=C1CCN(C(=O)C(C)(C)Cc2cccc(Cl)c2)CC1	ZINC000440542860	330750373	/nfs/dbraw/zinc/75/03/73/330750373.db2.gz	HSDLBOCAKAYAEF-UHFFFAOYSA-N	0	0	291.822	4.087	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(Cl)cc(F)c1F	ZINC000441578398	330770979	/nfs/dbraw/zinc/77/09/79/330770979.db2.gz	XMXUQQNKUMZHAV-QMMMGPOBSA-N	0	0	273.710	4.159	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H](C)c2ccc(C#N)cc2)CCCCC1	ZINC000448662653	330773527	/nfs/dbraw/zinc/77/35/27/330773527.db2.gz	CQBNWLFNVHLBID-HNNXBMFYSA-N	0	0	296.414	4.262	20	30		CIEDRN
COc1cc(/C=C\c2nc3ccccc3s2)ccc1C#N	ZINC000442345835	330775343	/nfs/dbraw/zinc/77/53/43/330775343.db2.gz	FREFYRCBZHKOPZ-CLFYSBASSA-N	0	0	292.363	4.347	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2cc(C)c(Cl)c(C)c2)CC1	ZINC000442480306	330776167	/nfs/dbraw/zinc/77/61/67/330776167.db2.gz	RYRDODFMWBXPQC-UHFFFAOYSA-N	0	0	292.810	4.387	20	30		CIEDRN
Cc1cc(N[C@@H]2CC[C@@H](C#N)C2)ccc1C(F)(F)F	ZINC000442802913	330784755	/nfs/dbraw/zinc/78/47/55/330784755.db2.gz	UDXWTKCBRZWRDY-ZYHUDNBSSA-N	0	0	268.282	4.118	20	30		CIEDRN
N#Cc1cc(CNc2ccc3ccoc3c2)ccc1F	ZINC000442854960	330787388	/nfs/dbraw/zinc/78/73/88/330787388.db2.gz	BFKNDUNUTYKOMP-UHFFFAOYSA-N	0	0	266.275	4.056	20	30		CIEDRN
Cc1ccc(N[C@H]2CC[C@H](C#N)C2)cc1NC(=O)C(C)(C)C	ZINC000442859376	330787731	/nfs/dbraw/zinc/78/77/31/330787731.db2.gz	VDIPTGVPZVSHGC-KBPBESRZSA-N	0	0	299.418	4.084	20	30		CIEDRN
N#Cc1cccc(OCCCNc2ccc3ccoc3c2)c1	ZINC000442873776	330789489	/nfs/dbraw/zinc/78/94/89/330789489.db2.gz	LKBJYNYNHYLCGD-UHFFFAOYSA-N	0	0	292.338	4.185	20	30		CIEDRN
C[C@@H](NCc1cccc(C#N)c1F)c1cc2ccccc2o1	ZINC000442894100	330791059	/nfs/dbraw/zinc/79/10/59/330791059.db2.gz	UIAHFPZPOQGKPO-GFCCVEGCSA-N	0	0	294.329	4.294	20	30		CIEDRN
C[C@@H](Sc1nc2ccccc2[nH]1)c1cccc(C#N)c1	ZINC000442906932	330791377	/nfs/dbraw/zinc/79/13/77/330791377.db2.gz	YSHJTQNZRUPIHJ-LLVKDONJSA-N	0	0	279.368	4.288	20	30		CIEDRN
C[C@H](Sc1ccc(C#N)cc1F)c1cccc(C#N)c1	ZINC000442922612	330791563	/nfs/dbraw/zinc/79/15/63/330791563.db2.gz	UJNFJAKIYAILBK-NSHDSACASA-N	0	0	282.343	4.422	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cc2[nH]ccc2cc1C	ZINC000442931664	330791695	/nfs/dbraw/zinc/79/16/95/330791695.db2.gz	KCPAYDLNZRWESM-INIZCTEOSA-N	0	0	256.349	4.017	20	30		CIEDRN
Cc1cnc([C@@H](C)S[C@@H](C)c2cccc(C#N)c2)o1	ZINC000443138640	330795536	/nfs/dbraw/zinc/79/55/36/330795536.db2.gz	XJUUXPJVQJHDBH-NWDGAFQWSA-N	0	0	272.373	4.410	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1ccc2ccoc2c1	ZINC000443372976	330798438	/nfs/dbraw/zinc/79/84/38/330798438.db2.gz	VQVPJWMXIVWQOX-LBPRGKRZSA-N	0	0	272.348	4.299	20	30		CIEDRN
Cc1ccc(Oc2ccc(C(F)(F)F)c(C#N)n2)cc1C	ZINC000443409916	330798991	/nfs/dbraw/zinc/79/89/91/330798991.db2.gz	PIKMPGMNMIVNDK-UHFFFAOYSA-N	0	0	292.260	4.381	20	30		CIEDRN
CCCC[C@@H](C)C(=O)Nc1sc2c(c1C#N)CCCC2	ZINC000443456798	330799858	/nfs/dbraw/zinc/79/98/58/330799858.db2.gz	QVOYJFNCSCINLC-LLVKDONJSA-N	0	0	290.432	4.263	20	30		CIEDRN
Cc1ccnc(N[C@H](C)c2cc3ccccc3o2)c1C#N	ZINC000443510380	330800566	/nfs/dbraw/zinc/80/05/66/330800566.db2.gz	OCJJGOGKJBZDCN-GFCCVEGCSA-N	0	0	277.327	4.181	20	30		CIEDRN
CC(C)c1ccc(NC(=O)c2ccc(C#N)[nH]2)c(C(C)C)c1	ZINC000443579149	330801865	/nfs/dbraw/zinc/80/18/65/330801865.db2.gz	PSZNYZCYFBJOOE-UHFFFAOYSA-N	0	0	295.386	4.385	20	30		CIEDRN
Cc1cc(CNc2ccccc2OC(C)C)ccc1C#N	ZINC000443983337	330808466	/nfs/dbraw/zinc/80/84/66/330808466.db2.gz	CRRJETIMCFBWTO-UHFFFAOYSA-N	0	0	280.371	4.266	20	30		CIEDRN
CC(C)(c1noc(C2(C#N)CCCC2)n1)C1CCCCC1	ZINC000445499991	330829971	/nfs/dbraw/zinc/82/99/71/330829971.db2.gz	BRRRTFQOQONKKG-UHFFFAOYSA-N	0	0	287.407	4.263	20	30		CIEDRN
C=CCCCc1nc(C(C)(C)c2cccc(F)c2)no1	ZINC000445620319	330833098	/nfs/dbraw/zinc/83/30/98/330833098.db2.gz	YANLQGRSLZJEIE-UHFFFAOYSA-N	0	0	274.339	4.043	20	30		CIEDRN
CSCc1cccc(CNc2nc(C)cc(C)c2C#N)c1	ZINC000445672708	330834492	/nfs/dbraw/zinc/83/44/92/330834492.db2.gz	BJQVAQHHSSCEMF-UHFFFAOYSA-N	0	0	297.427	4.045	20	30		CIEDRN
C=CCCCCCSc1nnc(OC(C)C)s1	ZINC000447302828	330864076	/nfs/dbraw/zinc/86/40/76/330864076.db2.gz	QOLIOPPACNLKIO-UHFFFAOYSA-N	0	0	272.439	4.164	20	30		CIEDRN
N#CC1(CNC2(c3c(Cl)cccc3Cl)CCC2)CC1	ZINC000447386828	330865950	/nfs/dbraw/zinc/86/59/50/330865950.db2.gz	RTAKRVUMBMHEFI-UHFFFAOYSA-N	0	0	295.213	4.266	20	30		CIEDRN
C=CCCCCCNc1cc(F)c(F)cc1NC(C)=O	ZINC000447409042	330866563	/nfs/dbraw/zinc/86/65/63/330866563.db2.gz	TVHWKYPLDOAUEL-UHFFFAOYSA-N	0	0	282.334	4.082	20	30		CIEDRN
CC[C@@H](N[C@H](C)c1nc(C)cs1)c1ccc(C#N)cc1	ZINC000447539977	330868923	/nfs/dbraw/zinc/86/89/23/330868923.db2.gz	BIDRGNYMYHOSBV-IUODEOHRSA-N	0	0	285.416	4.125	20	30		CIEDRN
CC[C@H](Nc1ccccc1OC)c1ccc(C#N)cc1	ZINC000447579860	330871052	/nfs/dbraw/zinc/87/10/52/330871052.db2.gz	LYNKHKKQCOTYIM-HNNXBMFYSA-N	0	0	266.344	4.130	20	30		CIEDRN
CC[C@H](Nc1cc(F)ccc1OC)c1ccc(C#N)cc1	ZINC000447592727	330872327	/nfs/dbraw/zinc/87/23/27/330872327.db2.gz	NIQUOAZFDJHCJF-HNNXBMFYSA-N	0	0	284.334	4.269	20	30		CIEDRN
C=CCN(CC[C@H](C)c1ccccc1)CC(F)(F)F	ZINC000447736408	330874891	/nfs/dbraw/zinc/87/48/91/330874891.db2.gz	MCKKXHDUPPQDEX-ZDUSSCGKSA-N	0	0	271.326	4.231	20	30		CIEDRN
C=CCc1ccc(OCCCC2CCOCC2)c(OC)c1	ZINC000447776834	330876534	/nfs/dbraw/zinc/87/65/34/330876534.db2.gz	DGIISJVZDNDDAT-UHFFFAOYSA-N	0	0	290.403	4.009	20	30		CIEDRN
C=CCCCNC(=O)Nc1ccc(Cl)c(Cl)c1	ZINC000447896430	330879543	/nfs/dbraw/zinc/87/95/43/330879543.db2.gz	HPMRJNBUDALKIZ-UHFFFAOYSA-N	0	0	273.163	4.081	20	30		CIEDRN
N#Cc1cccc(NC2CCC(OC3CCCC3)CC2)c1	ZINC000449002396	330890825	/nfs/dbraw/zinc/89/08/25/330890825.db2.gz	KOQRRPGUIKBFCZ-UHFFFAOYSA-N	0	0	284.403	4.241	20	30		CIEDRN
C=CCCCC[C@@H](C)Nc1cccc(C[S@@](C)=O)c1	ZINC000449054903	330895700	/nfs/dbraw/zinc/89/57/00/330895700.db2.gz	RYVMJXLMBOTLGF-AUUYWEPGSA-N	0	0	279.449	4.112	20	30		CIEDRN
CC(F)(F)c1ccccc1N[C@H]1CCC[C@H](C#N)C1	ZINC000449471920	330928400	/nfs/dbraw/zinc/92/84/00/330928400.db2.gz	PPSCTRVAGOFGOA-RYUDHWBXSA-N	0	0	264.319	4.293	20	30		CIEDRN
N#CCc1cccc(N[C@H]2CCCC[C@H]2C2CC2)c1	ZINC000449692254	330943931	/nfs/dbraw/zinc/94/39/31/330943931.db2.gz	AWNYVILPZWYGRV-IRXDYDNUSA-N	0	0	254.377	4.133	20	30		CIEDRN
C=CCC1(C(=O)NCCc2ccc(Cl)s2)CCCC1	ZINC000449732160	330946405	/nfs/dbraw/zinc/94/64/05/330946405.db2.gz	YVLGYUHQYSRXMR-UHFFFAOYSA-N	0	0	297.851	4.197	20	30		CIEDRN
C[C@@H]1[C@@H](CC(F)(F)F)C[C@H](C)N1c1ccc(C#N)cc1	ZINC000450574473	330987526	/nfs/dbraw/zinc/98/75/26/330987526.db2.gz	ZBLXKYFUAVHYDA-DMDPSCGWSA-N	0	0	282.309	4.114	20	30		CIEDRN
N#CC1(CSCc2ccccc2Br)CCC1	ZINC000450585556	330987844	/nfs/dbraw/zinc/98/78/44/330987844.db2.gz	GFTFCAXAPWFSGX-UHFFFAOYSA-N	0	0	296.233	4.376	20	30		CIEDRN
C=CCn1c2ccccc2nc1S[C@H]1CC[C@H](C#N)C1	ZINC000450614155	330989355	/nfs/dbraw/zinc/98/93/55/330989355.db2.gz	VZZJJKJWWSVKPR-STQMWFEESA-N	0	0	283.400	4.007	20	30		CIEDRN
C[C@@H](NCC1(C#N)CCC1)c1ccc(C(F)(F)F)cc1	ZINC000450672545	330992535	/nfs/dbraw/zinc/99/25/35/330992535.db2.gz	ZXJRSWDHYLKZLV-LLVKDONJSA-N	0	0	282.309	4.050	20	30		CIEDRN
COc1ccccc1[C@H](CC(C)C)NCC1(C#N)CCC1	ZINC000450687816	330993653	/nfs/dbraw/zinc/99/36/53/330993653.db2.gz	WBNOISIQNUOOIR-INIZCTEOSA-N	0	0	286.419	4.066	20	30		CIEDRN
N#C[C@H]1CC[C@@H](Sc2ccc(F)c(Cl)c2)C1	ZINC000450707912	330994736	/nfs/dbraw/zinc/99/47/36/330994736.db2.gz	BYQUVOCLDKXYDK-DTWKUNHWSA-N	0	0	255.745	4.263	20	30		CIEDRN
Cc1c2ccccc2oc1[C@H](C)NCC1(C#N)CCC1	ZINC000450726627	330996221	/nfs/dbraw/zinc/99/62/21/330996221.db2.gz	VNVCWTQMHXOLBJ-ZDUSSCGKSA-N	0	0	268.360	4.086	20	30		CIEDRN
CCCc1nc(C)c(CSc2ccc(C#N)cc2)o1	ZINC000450814950	331000844	/nfs/dbraw/zinc/00/08/44/331000844.db2.gz	ZZLYXSYATQSNQY-UHFFFAOYSA-N	0	0	272.373	4.100	20	30		CIEDRN
N#Cc1cccc(SC[C@@H]2CCCC2(F)F)c1	ZINC000450854953	331003029	/nfs/dbraw/zinc/00/30/29/331003029.db2.gz	DSSHIUJXNWMPTM-NSHDSACASA-N	0	0	253.317	4.086	20	30		CIEDRN
N#Cc1cccnc1SC1CCC(C(F)(F)F)CC1	ZINC000450876930	331004350	/nfs/dbraw/zinc/00/43/50/331004350.db2.gz	SZGBJVPTBAAECX-UHFFFAOYSA-N	0	0	286.322	4.166	20	30		CIEDRN
C[C@@H]1CCC(=O)[C@H](Sc2cccc(Cl)c2C#N)C1	ZINC000450899829	331005770	/nfs/dbraw/zinc/00/57/70/331005770.db2.gz	DVDRLALLDQPVEM-YMTOWFKASA-N	0	0	279.792	4.061	20	30		CIEDRN
N#C[C@@H]1CC[C@H](SCc2ccccc2C2CC2)C1	ZINC000450904424	331006233	/nfs/dbraw/zinc/00/62/33/331006233.db2.gz	FGYHFMADRXXPPU-DOMZBBRYSA-N	0	0	257.402	4.489	20	30		CIEDRN
CSc1ccc(CS[C@H]2CC[C@H](C#N)C2)cc1	ZINC000450943393	331008384	/nfs/dbraw/zinc/00/83/84/331008384.db2.gz	SMFZLTMGQCEWGL-JSGCOSHPSA-N	0	0	263.431	4.334	20	30		CIEDRN
C=CCCN(C)C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F	ZINC000451061540	331014185	/nfs/dbraw/zinc/01/41/85/331014185.db2.gz	LLFBROFZZRCLNN-OCCSQVGLSA-N	0	0	295.785	4.007	20	30		CIEDRN
C[C@@H](c1ccc(CN(C)CC(C)(C)C#N)cc1)C(F)(F)F	ZINC000451062197	331014336	/nfs/dbraw/zinc/01/43/36/331014336.db2.gz	JNVYTCZXJKRLLU-LBPRGKRZSA-N	0	0	298.352	4.334	20	30		CIEDRN
C=CCCCCCN[C@H](c1nc(C)cs1)C(F)(F)F	ZINC000451130745	331016828	/nfs/dbraw/zinc/01/68/28/331016828.db2.gz	QLOPELCSLYTUGZ-LLVKDONJSA-N	0	0	292.370	4.391	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)CC2CC(F)(F)C2)CCCC1(C)C	ZINC000451216693	331020832	/nfs/dbraw/zinc/02/08/32/331020832.db2.gz	MQMVCVDVFFXDFA-ZDUSSCGKSA-N	0	0	285.378	4.015	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)C[C@@H]2CC[C@@H]3C[C@@H]32)CCCC1(C)C	ZINC000451218073	331020983	/nfs/dbraw/zinc/02/09/83/331020983.db2.gz	QUKFKSALQJMUKO-UGUYLWEFSA-N	0	0	275.436	4.016	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1Cl	ZINC000451248198	331021799	/nfs/dbraw/zinc/02/17/99/331021799.db2.gz	NSKHEFNIILEQIF-VHDGCEQUSA-N	0	0	289.806	4.011	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1cc(C)n(C(C)C)n1	ZINC000451451638	331030099	/nfs/dbraw/zinc/03/00/99/331030099.db2.gz	AXSRZWCMGKPPCX-UHFFFAOYSA-N	0	0	297.402	4.143	20	30		CIEDRN
C=CCC1(C(=O)N2CCC=C(c3ccccc3)C2)CCCC1	ZINC000451559985	331034556	/nfs/dbraw/zinc/03/45/56/331034556.db2.gz	GMVKDUJIKXUACM-UHFFFAOYSA-N	0	0	295.426	4.439	20	30		CIEDRN
C=CCC1(C(=O)N2CCCC[C@H]2C(F)F)CCCCC1	ZINC000451678042	331038717	/nfs/dbraw/zinc/03/87/17/331038717.db2.gz	HIXRXMYJPTWAOM-ZDUSSCGKSA-N	0	0	285.378	4.159	20	30		CIEDRN
C=CC(C)(C)C(=O)Nc1ccc2nc(C(F)F)sc2c1	ZINC000451718512	331040009	/nfs/dbraw/zinc/04/00/09/331040009.db2.gz	PVLMFAFKHJQHNX-UHFFFAOYSA-N	0	0	296.342	4.385	20	30		CIEDRN
C/C=C/c1ccc(NC(=O)[C@]2(C#N)CC23CCCC3)cc1	ZINC000451771086	331041523	/nfs/dbraw/zinc/04/15/23/331041523.db2.gz	QPVDHFGGEJYJHH-PSQUURQMSA-N	0	0	280.371	4.132	20	30		CIEDRN
CC(C)CC(CC(C)C)C(=O)NCC(C)(C)CCC#N	ZINC000451770959	331041548	/nfs/dbraw/zinc/04/15/48/331041548.db2.gz	GKIXDADHJMZBRW-UHFFFAOYSA-N	0	0	280.456	4.141	20	30		CIEDRN
C=CCC1(C(=O)N2CCC[C@@H](C3CC3)C2)CCCCC1	ZINC000451789115	331042018	/nfs/dbraw/zinc/04/20/18/331042018.db2.gz	QGKQWQCPUCSUDD-MRXNPFEDSA-N	0	0	275.436	4.162	20	30		CIEDRN
C=CCC1(C(=O)N2CCC(F)(F)[C@@H](C)C2)CCCCC1	ZINC000451833089	331044098	/nfs/dbraw/zinc/04/40/98/331044098.db2.gz	CKAZLWWGSABKIQ-ZDUSSCGKSA-N	0	0	285.378	4.017	20	30		CIEDRN
N#Cc1ccc(F)cc1CN1CC2(CCC2)[C@H]1c1ccco1	ZINC000451849333	331044736	/nfs/dbraw/zinc/04/47/36/331044736.db2.gz	HJCSHXSRYUPJAL-QGZVFWFLSA-N	0	0	296.345	4.018	20	30		CIEDRN
C[C@@H](c1cccc(C#N)c1)N1CC2(CCC2)[C@@H]1c1ccco1	ZINC000451856362	331044964	/nfs/dbraw/zinc/04/49/64/331044964.db2.gz	PPEVLWKPJDLJDA-KSSFIOAISA-N	0	0	292.382	4.439	20	30		CIEDRN
Cc1csc(C(=O)N[C@H](CCCC#N)c2ccccc2)c1	ZINC000452137313	331055565	/nfs/dbraw/zinc/05/55/65/331055565.db2.gz	CZYSOXQQVQVXKV-OAHLLOKOSA-N	0	0	298.411	4.222	20	30		CIEDRN
C=CC(C)(C)C(=O)NCC[C@@H](c1ccccc1)C(F)(F)F	ZINC000452138511	331055638	/nfs/dbraw/zinc/05/56/38/331055638.db2.gz	JFURLWMTJUUSQW-ZDUSSCGKSA-N	0	0	299.336	4.051	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1[C@H](C)[C@H](CC(F)(F)F)C[C@@H]1C	ZINC000452226074	331059307	/nfs/dbraw/zinc/05/93/07/331059307.db2.gz	ALQVDWHOKOHFCU-XQHKEYJVSA-N	0	0	291.357	4.167	20	30		CIEDRN
CC(C)C[C@@]1(C)CCCN1C(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000452514364	331067115	/nfs/dbraw/zinc/06/71/15/331067115.db2.gz	SQHMRYRTNSWQNW-HNAYVOBHSA-N	0	0	298.430	4.089	20	30		CIEDRN
CC[C@@H]1CCC[C@@H]1CNC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000452526917	331067504	/nfs/dbraw/zinc/06/75/04/331067504.db2.gz	KYWMCMNQUOAIOW-KBAYOESNSA-N	0	0	298.430	4.016	20	30		CIEDRN
CC[C@H](C(=O)N[C@H]1CC[C@@H](CC#N)C1)C1CCC(C)CC1	ZINC000452557967	331068745	/nfs/dbraw/zinc/06/87/45/331068745.db2.gz	SLYSUFVHMQRAOX-LZYVMWMOSA-N	0	0	290.451	4.037	20	30		CIEDRN
CC[C@H](CC1CCCCC1)C(=O)N[C@H]1CC[C@@H](CC#N)C1	ZINC000452560892	331069018	/nfs/dbraw/zinc/06/90/18/331069018.db2.gz	HYNXXKYKTRMGET-BBWFWOEESA-N	0	0	290.451	4.182	20	30		CIEDRN
CC[C@@H](CC1CCCCC1)C(=O)N[C@H]1CC[C@@H](CC#N)C1	ZINC000452560894	331069023	/nfs/dbraw/zinc/06/90/23/331069023.db2.gz	HYNXXKYKTRMGET-ULQDDVLXSA-N	0	0	290.451	4.182	20	30		CIEDRN
C[C@@H]1CCC[C@@H]1CC(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452642970	331070847	/nfs/dbraw/zinc/07/08/47/331070847.db2.gz	IEIUDGVFXMDCSL-DGCLKSJQSA-N	0	0	290.794	4.171	20	30		CIEDRN
CCC(CC)CC(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452644366	331070921	/nfs/dbraw/zinc/07/09/21/331070921.db2.gz	LTNQWIZNPSIMJU-UHFFFAOYSA-N	0	0	278.783	4.171	20	30		CIEDRN
CCC[C@@H](NC(=O)c1ccc(C2(C#N)CC2)cc1)C(C)(C)C	ZINC000452667704	331071724	/nfs/dbraw/zinc/07/17/24/331071724.db2.gz	HJSXEAIWQFSBNJ-MRXNPFEDSA-N	0	0	298.430	4.186	20	30		CIEDRN
C=C(C)CCNC(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1	ZINC000452722140	331073955	/nfs/dbraw/zinc/07/39/55/331073955.db2.gz	JAHSTFKGTJNBBL-QZTJIDSGSA-N	0	0	279.383	4.026	20	30		CIEDRN
C=C(C)CCNC(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1Cl	ZINC000452722943	331074061	/nfs/dbraw/zinc/07/40/61/331074061.db2.gz	LQRFIBRJRPGNDJ-NWDGAFQWSA-N	0	0	298.213	4.179	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@@H](Cc2ccccc2)[C@H]1C	ZINC000467330387	331075291	/nfs/dbraw/zinc/07/52/91/331075291.db2.gz	PIZDLZGERVOLIO-APWZRJJASA-N	0	0	297.442	4.235	20	30		CIEDRN
C=CC(C)(C)CNC(=O)c1c(C)[nH]c2ccc(Cl)cc21	ZINC000452772321	331075674	/nfs/dbraw/zinc/07/56/74/331075674.db2.gz	DSWNVBQWPQYYKM-UHFFFAOYSA-N	0	0	290.794	4.072	20	30		CIEDRN
C=CC(C)(C)CNC(=O)C(c1ccccc1)c1ccccc1	ZINC000452781199	331077621	/nfs/dbraw/zinc/07/76/21/331077621.db2.gz	ZUXVYYPNBHCPMP-UHFFFAOYSA-N	0	0	293.410	4.147	20	30		CIEDRN
C=CCCCC(=O)N1Cc2cccc(C)c2CC1(C)C	ZINC000452942007	331081456	/nfs/dbraw/zinc/08/14/56/331081456.db2.gz	QKMAVTCDJWEXKB-UHFFFAOYSA-N	0	0	271.404	4.015	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(C(=O)C(C)C)cc2)CCC1	ZINC000452983967	331082800	/nfs/dbraw/zinc/08/28/00/331082800.db2.gz	XIWBXCNJCKFGIZ-UHFFFAOYSA-N	0	0	285.387	4.210	20	30		CIEDRN
Cc1nc(CNc2ccc(CC#N)cc2Cl)sc1C	ZINC000453122886	331091581	/nfs/dbraw/zinc/09/15/81/331091581.db2.gz	GLKUZBKPBHUTLE-UHFFFAOYSA-N	0	0	291.807	4.092	20	30		CIEDRN
C=CCC1(c2nc(-c3ccncc3CC)no2)CCCC1	ZINC000453145471	331093985	/nfs/dbraw/zinc/09/39/85/331093985.db2.gz	WITWEXPKZXSTJU-UHFFFAOYSA-N	0	0	283.375	4.082	20	30		CIEDRN
N#CCc1cccc(NCc2csc(C3CCCC3)n2)c1	ZINC000453149299	331094410	/nfs/dbraw/zinc/09/44/10/331094410.db2.gz	QTJHQCKUEPOMFG-UHFFFAOYSA-N	0	0	297.427	4.479	20	30		CIEDRN
C=C(C)CCc1noc([C@@H]2C[C@@]2(C)c2ccccc2)n1	ZINC000453179338	331097881	/nfs/dbraw/zinc/09/78/81/331097881.db2.gz	IZNMUDUTFMBHSL-YOEHRIQHSA-N	0	0	268.360	4.024	20	30		CIEDRN
C=CCC1(c2nc(-c3ccoc3C)no2)CCCC1	ZINC000453187614	331098972	/nfs/dbraw/zinc/09/89/72/331098972.db2.gz	ZAYQMLVMUAMBNJ-UHFFFAOYSA-N	0	0	258.321	4.026	20	30		CIEDRN
C=CCCC1(c2nc([C@@H]3CSc4ccccc43)no2)CC1	ZINC000453211375	331101842	/nfs/dbraw/zinc/10/18/42/331101842.db2.gz	FEJJZXYECZLSKZ-CYBMUJFWSA-N	0	0	298.411	4.305	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc([C@@H]2CSc3ccccc32)no1	ZINC000453231373	331104589	/nfs/dbraw/zinc/10/45/89/331104589.db2.gz	VMWWUCGHPSPOFJ-WCQYABFASA-N	0	0	286.400	4.377	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc([C@@H](Cc2ccccc2)OC)no1	ZINC000453236094	331105133	/nfs/dbraw/zinc/10/51/33/331105133.db2.gz	UIIHAHZENXLRCQ-DZGCQCFKSA-N	0	0	286.375	4.070	20	30		CIEDRN
CC[C@@H](Nc1ccccc1OCCF)c1ccc(C#N)cc1	ZINC000453253195	331107903	/nfs/dbraw/zinc/10/79/03/331107903.db2.gz	JSCLDSQOWLGSLS-MRXNPFEDSA-N	0	0	298.361	4.470	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2cccc([N+](=O)[O-])c2C)no1	ZINC000453265798	331109143	/nfs/dbraw/zinc/10/91/43/331109143.db2.gz	WTVOYBVDLXIZRS-SNVBAGLBSA-N	0	0	287.319	4.023	20	30		CIEDRN
C=CC(C)(C)CNC(=O)Nc1c(CC)cccc1CC	ZINC000454203830	331141685	/nfs/dbraw/zinc/14/16/85/331141685.db2.gz	DCEAPVUOEBLNPF-UHFFFAOYSA-N	0	0	274.408	4.145	20	30		CIEDRN
C=CC(C)(C)CNC(=O)Nc1c(C)cccc1C(C)C	ZINC000454226179	331142222	/nfs/dbraw/zinc/14/22/22/331142222.db2.gz	REYPRQZLYVIJCH-UHFFFAOYSA-N	0	0	274.408	4.452	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N1C[C@H](C(C)C)[C@@H]1C(C)C	ZINC000454644910	331150303	/nfs/dbraw/zinc/15/03/03/331150303.db2.gz	OSMCNDKHPSIBFB-WBVHZDCISA-N	0	0	299.418	4.011	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1ccc([C@@H](C)C(F)(F)F)cc1	ZINC000454682710	331151319	/nfs/dbraw/zinc/15/13/19/331151319.db2.gz	RFNWYFNHVZUIFI-GFCCVEGCSA-N	0	0	299.336	4.391	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)N1CC(CC)C1	ZINC000455252370	331163222	/nfs/dbraw/zinc/16/32/22/331163222.db2.gz	UKXRURUYKPRIKD-UHFFFAOYSA-N	0	0	286.419	4.412	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](F)C1	ZINC000455250335	331163276	/nfs/dbraw/zinc/16/32/76/331163276.db2.gz	RJPKNXSCLADAMD-AWEZNQCLSA-N	0	0	290.382	4.114	20	30		CIEDRN
C=CC(C)(C)CNC(=O)N(C)[C@@H](C)c1cccc(Cl)c1	ZINC000455363501	331167142	/nfs/dbraw/zinc/16/71/42/331167142.db2.gz	HUAQODMIQIWYNE-LBPRGKRZSA-N	0	0	294.826	4.255	20	30		CIEDRN
C=CCCCCCSc1nnc(-c2ccoc2C)o1	ZINC000195420955	331173006	/nfs/dbraw/zinc/17/30/06/331173006.db2.gz	UVLILHMLTDQWBO-UHFFFAOYSA-N	0	0	278.377	4.477	20	30		CIEDRN
C=CCCCCCNc1cc(C[S@@](C)=O)ccc1Cl	ZINC000195449235	331173695	/nfs/dbraw/zinc/17/36/95/331173695.db2.gz	GIMYBUOVMWRLMF-LJQANCHMSA-N	0	0	299.867	4.377	20	30		CIEDRN
C=CC[C@H](C)NC(=O)c1ccc([C@H](C)C(F)(F)F)cc1	ZINC000455680034	331175321	/nfs/dbraw/zinc/17/53/21/331175321.db2.gz	CRYVVCUBUYUCLE-QWRGUYRKSA-N	0	0	285.309	4.047	20	30		CIEDRN
C=CCCCN(C)C(=O)c1ccc([C@H](C)C(F)(F)F)cc1	ZINC000455696464	331175656	/nfs/dbraw/zinc/17/56/56/331175656.db2.gz	GMVYAUCNXZGOTH-LBPRGKRZSA-N	0	0	299.336	4.391	20	30		CIEDRN
CCC[C@@H](C)N(C)C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000455699369	331175786	/nfs/dbraw/zinc/17/57/86/331175786.db2.gz	HCBAQVIBFUAPSX-LLVKDONJSA-N	0	0	293.798	4.058	20	30		CIEDRN
CCC[C@@H](CC)NC(=O)Nc1ccc(CC#N)cc1Cl	ZINC000455702865	331175882	/nfs/dbraw/zinc/17/58/82/331175882.db2.gz	LOGFKROUDZMAQG-GFCCVEGCSA-N	0	0	293.798	4.106	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1scnc1C(C)C	ZINC000455863549	331179203	/nfs/dbraw/zinc/17/92/03/331179203.db2.gz	KQMPMGRIAQMHCY-LLVKDONJSA-N	0	0	281.425	4.133	20	30		CIEDRN
CC(C)(C)C[C@H]1CCN(C(=O)Nc2cccc(CC#N)c2)C1	ZINC000455899399	331179885	/nfs/dbraw/zinc/17/98/85/331179885.db2.gz	AHPOWMCRMWXKST-OAHLLOKOSA-N	0	0	299.418	4.043	20	30		CIEDRN
CCCCC[C@@H]1CCCN1C(=O)Nc1cccc(CC#N)c1	ZINC000455904058	331180217	/nfs/dbraw/zinc/18/02/17/331180217.db2.gz	JJELMNGEVCBNTD-QGZVFWFLSA-N	0	0	299.418	4.329	20	30		CIEDRN
CC(C)C[C@]1(C)CCCN1C(=O)Nc1cccc(CC#N)c1	ZINC000455908520	331180411	/nfs/dbraw/zinc/18/04/11/331180411.db2.gz	RAYHSLUOKGSUEN-SFHVURJKSA-N	0	0	299.418	4.185	20	30		CIEDRN
CC(C)(C)[C@H]1CCCN(C(=O)Nc2cccc(CC#N)c2)C1	ZINC000455910978	331180661	/nfs/dbraw/zinc/18/06/61/331180661.db2.gz	VHEVCDDOCHWMTL-HNNXBMFYSA-N	0	0	299.418	4.043	20	30		CIEDRN
CC(C)CC[C@@H]1CCCN1C(=O)Nc1cccc(CC#N)c1	ZINC000455911614	331180744	/nfs/dbraw/zinc/18/07/44/331180744.db2.gz	WJMUXATVQHMONL-KRWDZBQOSA-N	0	0	299.418	4.185	20	30		CIEDRN
CC(C)C[C@@H]1CCCN(C(=O)Nc2cccc(CC#N)c2)C1	ZINC000455920210	331181117	/nfs/dbraw/zinc/18/11/17/331181117.db2.gz	NGNFPYTZSMJICR-INIZCTEOSA-N	0	0	299.418	4.043	20	30		CIEDRN
CC(C)(C)C[C@@H]1CCCN1C(=O)Nc1cccc(CC#N)c1	ZINC000455925838	331181329	/nfs/dbraw/zinc/18/13/29/331181329.db2.gz	YFMMZGPJCIKJIF-INIZCTEOSA-N	0	0	299.418	4.185	20	30		CIEDRN
CC(C)=CCC[C@@H](C)NC(=O)[C@H](C#N)CCc1ccccc1	ZINC000456050356	331183350	/nfs/dbraw/zinc/18/33/50/331183350.db2.gz	GCIXKQBTHSAPHR-AEFFLSMTSA-N	0	0	298.430	4.010	20	30		CIEDRN
C=C(C)CCNC(=O)C(C)(c1ccccc1)c1ccccc1	ZINC000456126776	331185172	/nfs/dbraw/zinc/18/51/72/331185172.db2.gz	YDHILZIQPJKVEV-UHFFFAOYSA-N	0	0	293.410	4.075	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC1CC1)c1ccc(OC)cc1	ZINC000456181880	331186252	/nfs/dbraw/zinc/18/62/52/331186252.db2.gz	SDKRTZXXHNZUJN-CQSZACIVSA-N	0	0	287.403	4.041	20	30		CIEDRN
C=CCC1(C(=O)N2C[C@H](C3CC3)[C@H]2C2CC2)CCCCC1	ZINC000456259496	331187645	/nfs/dbraw/zinc/18/76/45/331187645.db2.gz	RKSOCEKLZDKFCV-IAGOWNOFSA-N	0	0	287.447	4.160	20	30		CIEDRN
C=CCC1(NC(=O)CCCC[C@@H](C)C(C)=O)CCCCC1	ZINC000456359976	331190789	/nfs/dbraw/zinc/19/07/89/331190789.db2.gz	CURITDKWXURIRQ-OAHLLOKOSA-N	0	0	293.451	4.167	20	30		CIEDRN
C=CCC1(NC(=O)c2ccsc2C)CCCCC1	ZINC000456366353	331191184	/nfs/dbraw/zinc/19/11/84/331191184.db2.gz	MHVJNFMYGYUECP-UHFFFAOYSA-N	0	0	263.406	4.065	20	30		CIEDRN
C=CCC1(CNC(=O)[C@@H](C)c2ccsc2)CCCC1	ZINC000456485084	331193796	/nfs/dbraw/zinc/19/37/96/331193796.db2.gz	JZFLESIEAYQOKL-ZDUSSCGKSA-N	0	0	277.433	4.104	20	30		CIEDRN
C[C@H](CCC(=O)Nc1cccc(CC#N)c1)c1ccccc1	ZINC000456760535	331200778	/nfs/dbraw/zinc/20/07/78/331200778.db2.gz	WZXWYZBBBCJEAV-OAHLLOKOSA-N	0	0	292.382	4.275	20	30		CIEDRN
CC(C)(C#N)CC(=O)NC[C@@H]1CCCC[C@H]1c1ccccc1	ZINC000456773793	331202562	/nfs/dbraw/zinc/20/25/62/331202562.db2.gz	PMAQCVQEQIUVKD-IRXDYDNUSA-N	0	0	298.430	4.016	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@@H]1c1ccc(F)cc1C	ZINC000456838654	331207103	/nfs/dbraw/zinc/20/71/03/331207103.db2.gz	JHWSXEJHZCFEAE-MRXNPFEDSA-N	0	0	275.367	4.154	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H]1c1ccc(F)cc1C	ZINC000456844573	331207289	/nfs/dbraw/zinc/20/72/89/331207289.db2.gz	MUVHBIGWJSVAJO-RHSMWYFYSA-N	0	0	289.394	4.400	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H]1c1ccc(F)cc1F	ZINC000456854692	331207531	/nfs/dbraw/zinc/20/75/31/331207531.db2.gz	YUIMMYFKYNIFDE-LRDDRELGSA-N	0	0	293.357	4.231	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H]1c1ccc(F)cc1F	ZINC000456854691	331207598	/nfs/dbraw/zinc/20/75/98/331207598.db2.gz	YUIMMYFKYNIFDE-BLLLJJGKSA-N	0	0	293.357	4.231	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@@H](CC(C)(C)C)C2)CCC1	ZINC000457074480	331211414	/nfs/dbraw/zinc/21/14/14/331211414.db2.gz	ILCAHHLVAWJDIV-AWEZNQCLSA-N	0	0	263.425	4.018	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CC2(CCCC2)[C@H]1C(C)C	ZINC000457146947	331212933	/nfs/dbraw/zinc/21/29/33/331212933.db2.gz	PQMHYBGYVZAFCI-HUUCEWRRSA-N	0	0	263.425	4.016	20	30		CIEDRN
C[C@H](CC(C)(C)C)NC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000457194145	331214967	/nfs/dbraw/zinc/21/49/67/331214967.db2.gz	OGWFGAJYCJEABL-CYBMUJFWSA-N	0	0	286.419	4.042	20	30		CIEDRN
C[C@@H](CC(C)(C)C)NC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000457195416	331215033	/nfs/dbraw/zinc/21/50/33/331215033.db2.gz	QEADOLNRZNVXKM-GOEBONIOSA-N	0	0	286.419	4.015	20	30		CIEDRN
C[C@H](CC(C)(C)C)NC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000457195414	331215048	/nfs/dbraw/zinc/21/50/48/331215048.db2.gz	QEADOLNRZNVXKM-GDBMZVCRSA-N	0	0	286.419	4.015	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@H](C1CC1)C1CCC1)c1ccccc1	ZINC000457238054	331216890	/nfs/dbraw/zinc/21/68/90/331216890.db2.gz	JOLAKZFINRQWAB-KUHUBIRLSA-N	0	0	283.415	4.041	20	30		CIEDRN
C=CCCCC(=O)N1CC2(CCCC2)[C@@H]1c1ccccc1	ZINC000457280774	331218008	/nfs/dbraw/zinc/21/80/08/331218008.db2.gz	NNPXDSDMEBVNET-SFHVURJKSA-N	0	0	283.415	4.487	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)c1[nH]ccc1C1CC1	ZINC000457551649	331226640	/nfs/dbraw/zinc/22/66/40/331226640.db2.gz	BEOKSBICRMBSIQ-UHFFFAOYSA-N	0	0	286.419	4.101	20	30		CIEDRN
C=CCC[C@@H](NC(=O)[C@H](CC)CC(F)F)c1ccccc1	ZINC000457681306	331231017	/nfs/dbraw/zinc/23/10/17/331231017.db2.gz	PZOFRTFNTFSFPE-UKRRQHHQSA-N	0	0	295.373	4.492	20	30		CIEDRN
C=C(C)[C@@H](NC(=O)[C@@H](C)C1CCC1)c1ccc(F)c(F)c1	ZINC000457719254	331232321	/nfs/dbraw/zinc/23/23/21/331232321.db2.gz	QRSZSWBDAOYMBJ-MEDUHNTESA-N	0	0	293.357	4.134	20	30		CIEDRN
C=CCCC(=O)N1CC2(CCCCC2)[C@@H]1c1ccccc1	ZINC000458123370	331243461	/nfs/dbraw/zinc/24/34/61/331243461.db2.gz	JPRMUTWOMLNJMW-SFHVURJKSA-N	0	0	283.415	4.487	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N1Cc2ccc(Cl)cc2C1	ZINC000458625227	331254530	/nfs/dbraw/zinc/25/45/30/331254530.db2.gz	SPICUJSIXZLGRT-GFCCVEGCSA-N	0	0	292.810	4.110	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N1Cc2ccc(Cl)cc2C1	ZINC000458625228	331254639	/nfs/dbraw/zinc/25/46/39/331254639.db2.gz	SPICUJSIXZLGRT-LBPRGKRZSA-N	0	0	292.810	4.110	20	30		CIEDRN
C=C(C)CCNC(=O)N1CCCCC[C@H]1c1ccc(C)o1	ZINC000458997183	331265255	/nfs/dbraw/zinc/26/52/55/331265255.db2.gz	ISWRWAAVXSVSIB-HNNXBMFYSA-N	0	0	290.407	4.181	20	30		CIEDRN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)Nc1cccc2ccccc21	ZINC000459813253	331301969	/nfs/dbraw/zinc/30/19/69/331301969.db2.gz	ZAGIBPVVAOFUHW-WMZOPIPTSA-N	0	0	295.382	4.150	20	30		CIEDRN
Cc1sc(NC(=O)CCCC(C)C)c(C#N)c1C	ZINC000459844976	331302518	/nfs/dbraw/zinc/30/25/18/331302518.db2.gz	KPGWIRYHGOTGIX-UHFFFAOYSA-N	0	0	264.394	4.001	20	30		CIEDRN
Cc1sc(NC(=O)[C@]2(C)CCC[C@@H]2C)c(C#N)c1C	ZINC000459848467	331302576	/nfs/dbraw/zinc/30/25/76/331302576.db2.gz	ZKLGZHMOJZCPCY-BJOHPYRUSA-N	0	0	276.405	4.001	20	30		CIEDRN
Cc1sc(NC(=O)[C@@]2(C)CCC[C@@H]2C)c(C#N)c1C	ZINC000459848470	331302578	/nfs/dbraw/zinc/30/25/78/331302578.db2.gz	ZKLGZHMOJZCPCY-VFZGTOFNSA-N	0	0	276.405	4.001	20	30		CIEDRN
Cc1sc(NC(=O)C(C)(C)C2CCC2)c(C#N)c1C	ZINC000459848824	331302602	/nfs/dbraw/zinc/30/26/02/331302602.db2.gz	ZWWJWJRZJSTROG-UHFFFAOYSA-N	0	0	276.405	4.001	20	30		CIEDRN
C=CCC1(C(=O)N2CCC[C@H]3CCCC[C@@H]32)CCCC1	ZINC000459876560	331302687	/nfs/dbraw/zinc/30/26/87/331302687.db2.gz	ORDFBKDAKIJWNJ-CVEARBPZSA-N	0	0	275.436	4.304	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)C(C)(C)C1CCC1	ZINC000459880551	331302923	/nfs/dbraw/zinc/30/29/23/331302923.db2.gz	PVMMUNDLVJZDNA-UHFFFAOYSA-N	0	0	277.433	4.089	20	30		CIEDRN
CCCCN(C(=O)c1cscc1C#N)C1CCCCC1	ZINC000459970326	331303909	/nfs/dbraw/zinc/30/39/09/331303909.db2.gz	PLHCWOVEDFLTLI-UHFFFAOYSA-N	0	0	290.432	4.195	20	30		CIEDRN
C[C@H]1CCN(C(=O)[C@@]2(C#N)CC23CCCC3)c2ccccc21	ZINC000459988555	331304064	/nfs/dbraw/zinc/30/40/64/331304064.db2.gz	IZVUFEPINOJZSZ-LIRRHRJNSA-N	0	0	294.398	4.001	20	30		CIEDRN
C=CCC1(C(=O)N(CCC)CC(F)F)CCCCC1	ZINC000460080693	331305069	/nfs/dbraw/zinc/30/50/69/331305069.db2.gz	WIYIPNRBSJQRRU-UHFFFAOYSA-N	0	0	273.367	4.017	20	30		CIEDRN
Cc1ccc(C#N)c(SCc2ccc(Cl)cc2)n1	ZINC000165990608	331306452	/nfs/dbraw/zinc/30/64/52/331306452.db2.gz	HLCCYUUFJYNBFC-UHFFFAOYSA-N	0	0	274.776	4.207	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CCc2c1cccc2F)c1ccccc1	ZINC000461085055	331311171	/nfs/dbraw/zinc/31/11/71/331311171.db2.gz	JMRHRMCWLDMCPB-AWEZNQCLSA-N	0	0	295.357	4.075	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@H](CC)c1ccc(F)cc1	ZINC000461092873	331311404	/nfs/dbraw/zinc/31/14/04/331311404.db2.gz	GPSXNNFKCDXGJW-XJKSGUPXSA-N	0	0	277.383	4.180	20	30		CIEDRN
Cc1cc(Sc2ccc(C#N)cc2)c(F)cc1[N+](=O)[O-]	ZINC000461765573	331314619	/nfs/dbraw/zinc/31/46/19/331314619.db2.gz	FQCZNIWMNCCPQE-UHFFFAOYSA-N	0	0	288.303	4.065	20	30		CIEDRN
CCCCCc1ccc(NC(=O)CCCC#N)cc1	ZINC000461783811	331314689	/nfs/dbraw/zinc/31/46/89/331314689.db2.gz	ITXACCMTUFRYDO-UHFFFAOYSA-N	0	0	258.365	4.052	20	30		CIEDRN
Cc1ccccc1-c1noc([C@@H](C)c2cccc(C#N)c2)n1	ZINC000461800092	331314821	/nfs/dbraw/zinc/31/48/21/331314821.db2.gz	ZIDYDCOTMMCEHN-ZDUSSCGKSA-N	0	0	289.338	4.069	20	30		CIEDRN
C[C@@H](C(=O)N1CCC[C@@H]1CC(C)(C)C)c1cccc(C#N)c1	ZINC000462022749	331316820	/nfs/dbraw/zinc/31/68/20/331316820.db2.gz	HAQNIPMVYHTYFW-RHSMWYFYSA-N	0	0	298.430	4.089	20	30		CIEDRN
CC[C@H](C)[C@H](NC(=O)CCCC#N)c1ccc(Cl)cc1	ZINC000462139479	331317854	/nfs/dbraw/zinc/31/78/54/331317854.db2.gz	KFZJKOQLXALFME-LRDDRELGSA-N	0	0	292.810	4.237	20	30		CIEDRN
CCCC[C@H](NC(=O)[C@@H](C)c1cccc(C#N)c1)C1CCC1	ZINC000462174962	331318047	/nfs/dbraw/zinc/31/80/47/331318047.db2.gz	IZRXBRHTWCJHDD-KSSFIOAISA-N	0	0	298.430	4.137	20	30		CIEDRN
Cc1cc(Cl)ccc1NCCOc1cccc(C#N)c1	ZINC000462216638	331318567	/nfs/dbraw/zinc/31/85/67/331318567.db2.gz	VTILDQIMQZIFHO-UHFFFAOYSA-N	0	0	286.762	4.011	20	30		CIEDRN
Cc1ccc(NC(=O)[C@H](C)c2cccc(C#N)c2)c(Cl)c1	ZINC000462300043	331318990	/nfs/dbraw/zinc/31/89/90/331318990.db2.gz	RMUPKOVJHAHMCP-GFCCVEGCSA-N	0	0	298.773	4.262	20	30		CIEDRN
Cc1c(C#N)cccc1C(=O)Nc1cccc(C2CCC2)c1	ZINC000462372866	331320807	/nfs/dbraw/zinc/32/08/07/331320807.db2.gz	KZDBHDIWNCAUGZ-UHFFFAOYSA-N	0	0	290.366	4.387	20	30		CIEDRN
CC#CCCSCc1coc(-c2ccc(F)c(F)c2)n1	ZINC000462374589	331320838	/nfs/dbraw/zinc/32/08/38/331320838.db2.gz	ANLGKHAKZRPDCN-UHFFFAOYSA-N	0	0	293.338	4.266	20	30		CIEDRN
C[C@@H](CNc1ccc(F)cc1C#N)c1ccc(F)cc1	ZINC000462381240	331320988	/nfs/dbraw/zinc/32/09/88/331320988.db2.gz	OXFXFQOJSPHDAS-NSHDSACASA-N	0	0	272.298	4.052	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cccc(C2CCC2)c1	ZINC000462380805	331320994	/nfs/dbraw/zinc/32/09/94/331320994.db2.gz	RGBRNOKSXOSTJN-ZDUSSCGKSA-N	0	0	257.377	4.495	20	30		CIEDRN
Cc1ccc2c(c1)CC[C@H]2Nc1ccc(F)cc1C#N	ZINC000462384269	331321112	/nfs/dbraw/zinc/32/11/12/331321112.db2.gz	OAPMKMVHQMSRSE-QGZVFWFLSA-N	0	0	266.319	4.105	20	30		CIEDRN
CC#CCCSc1ncc(C(C)C)n1C(C)C	ZINC000462407620	331321473	/nfs/dbraw/zinc/32/14/73/331321473.db2.gz	LFXDDOCISKLONY-UHFFFAOYSA-N	0	0	250.411	4.093	20	30		CIEDRN
CC(C)C[C@@H](C)C(=O)N(CC(C)C)c1ccc(C#N)cc1	ZINC000462430524	331321903	/nfs/dbraw/zinc/32/19/03/331321903.db2.gz	HKBBUSMSNDSSJA-OAHLLOKOSA-N	0	0	286.419	4.229	20	30		CIEDRN
CCc1c(C)sc(NC(=O)[C@@H](C)CC(C)C)c1C#N	ZINC000462493421	331322853	/nfs/dbraw/zinc/32/28/53/331322853.db2.gz	ZDMBCTKZOVTLHL-JTQLQIEISA-N	0	0	278.421	4.111	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)[C@@H](C)CC(C)C	ZINC000462492725	331322875	/nfs/dbraw/zinc/32/28/75/331322875.db2.gz	RRJWNPLORFCJEP-AWEZNQCLSA-N	0	0	277.383	4.023	20	30		CIEDRN
CCc1ccc(NC(=O)[C@H](C)c2cccc(C#N)c2)cc1C	ZINC000462540290	331323238	/nfs/dbraw/zinc/32/32/38/331323238.db2.gz	RBKBBRMCLOAVSG-CQSZACIVSA-N	0	0	292.382	4.171	20	30		CIEDRN
C=CCCC(=O)N[C@@H]1c2ccccc2CC[C@@H]1C(C)C	ZINC000462589804	331323622	/nfs/dbraw/zinc/32/36/22/331323622.db2.gz	GQNFSSWVRIGGCG-QAPCUYQASA-N	0	0	271.404	4.029	20	30		CIEDRN
C=CCOc1ccc(OCc2cccc([N+](=O)[O-])c2C)cc1	ZINC000462653699	331324745	/nfs/dbraw/zinc/32/47/45/331324745.db2.gz	FVOKLNJRAHTHOW-UHFFFAOYSA-N	0	0	299.326	4.047	20	30		CIEDRN
C[C@@H](CCc1ccsc1)Nc1cccc(C#N)c1	ZINC000462795884	331329477	/nfs/dbraw/zinc/32/94/77/331329477.db2.gz	YDJADOVILQHQLO-LBPRGKRZSA-N	0	0	256.374	4.053	20	30		CIEDRN
CCc1cccc2c1OCC[C@@H]2Nc1ccc(F)cc1C#N	ZINC000462798382	331329554	/nfs/dbraw/zinc/32/95/54/331329554.db2.gz	KWAQSFWGHUYZJT-KRWDZBQOSA-N	0	0	296.345	4.195	20	30		CIEDRN
C[C@H](CNc1c(Cl)cccc1C#N)Oc1ccccc1	ZINC000462832816	331331961	/nfs/dbraw/zinc/33/19/61/331331961.db2.gz	JDHFWPJFXXGSND-GFCCVEGCSA-N	0	0	286.762	4.091	20	30		CIEDRN
C[C@H]1C[C@@H](c2ccc(F)cc2)CN1c1ccc(F)cc1C#N	ZINC000462857559	331332891	/nfs/dbraw/zinc/33/28/91/331332891.db2.gz	SRWHLOCXEYHCML-SWLSCSKDSA-N	0	0	298.336	4.219	20	30		CIEDRN
C=C[C@@H](C)NC(=O)Nc1c(C)cc(Cl)c2ccccc21	ZINC000462868223	331333140	/nfs/dbraw/zinc/33/31/40/331333140.db2.gz	AOJMELCSHZVCDB-LLVKDONJSA-N	0	0	288.778	4.498	20	30		CIEDRN
C=CCC[C@H](CC)Nc1ccc2c(C)nn(C)c2c1	ZINC000462876426	331333341	/nfs/dbraw/zinc/33/33/41/331333341.db2.gz	WMLPKLQXPZAVJA-ZDUSSCGKSA-N	0	0	257.381	4.038	20	30		CIEDRN
C=CCC[C@@H](CC)Nc1ccc2c(C)nn(C)c2c1	ZINC000462876425	331333711	/nfs/dbraw/zinc/33/37/11/331333711.db2.gz	WMLPKLQXPZAVJA-CYBMUJFWSA-N	0	0	257.381	4.038	20	30		CIEDRN
C[C@@H](CNc1cccc(F)c1C#N)Cc1cccs1	ZINC000462913927	331333925	/nfs/dbraw/zinc/33/39/25/331333925.db2.gz	VSYYAVOMXLGUEM-LLVKDONJSA-N	0	0	274.364	4.050	20	30		CIEDRN
N#Cc1cc(F)ccc1N[C@@H]1CC[C@@H]2CCC[C@@H]2C1	ZINC000462911611	331334871	/nfs/dbraw/zinc/33/48/71/331334871.db2.gz	LDPGWOOCFYSUIT-YWPYICTPSA-N	0	0	258.340	4.078	20	30		CIEDRN
N#Cc1cc(F)ccc1N[C@@H]1CC[C@H]2CCC[C@@H]2C1	ZINC000462911606	331334888	/nfs/dbraw/zinc/33/48/88/331334888.db2.gz	LDPGWOOCFYSUIT-LALPHHSUSA-N	0	0	258.340	4.078	20	30		CIEDRN
C[C@H](CNc1ccc(C#N)cc1F)Cc1cccs1	ZINC000462911558	331334956	/nfs/dbraw/zinc/33/49/56/331334956.db2.gz	OGAZYDZUCWICNQ-NSHDSACASA-N	0	0	274.364	4.050	20	30		CIEDRN
C[C@@H](CCc1ccco1)Nc1c(Cl)cccc1C#N	ZINC000462925545	331335293	/nfs/dbraw/zinc/33/52/93/331335293.db2.gz	IEQQLIDWFCAQJU-NSHDSACASA-N	0	0	274.751	4.238	20	30		CIEDRN
C=CCOc1ccc(Oc2ccc([N+](=O)[O-])cc2F)cc1	ZINC000462936287	331335376	/nfs/dbraw/zinc/33/53/76/331335376.db2.gz	OYOHCNFQFFWBKC-UHFFFAOYSA-N	0	0	289.262	4.091	20	30		CIEDRN
C=CCOc1ccc(Oc2cccc(F)c2C#N)cc1	ZINC000462937893	331335441	/nfs/dbraw/zinc/33/54/41/331335441.db2.gz	AXVAOIKHHFYLRH-UHFFFAOYSA-N	0	0	269.275	4.054	20	30		CIEDRN
C=CCOc1ccc(Oc2ncnc3cccc(F)c32)cc1	ZINC000462936858	331335449	/nfs/dbraw/zinc/33/54/49/331335449.db2.gz	UKDVWXIMOCTPTE-UHFFFAOYSA-N	0	0	296.301	4.126	20	30		CIEDRN
C[C@@H](CNc1ccc(C#N)cc1)c1ccc(F)cc1F	ZINC000463007887	331336905	/nfs/dbraw/zinc/33/69/05/331336905.db2.gz	DXMXXMGSIMSJJZ-NSHDSACASA-N	0	0	272.298	4.052	20	30		CIEDRN
CC(C)C[C@@H](Nc1ccc(C#N)cn1)c1ccc(Cl)cc1	ZINC000463017347	331337110	/nfs/dbraw/zinc/33/71/10/331337110.db2.gz	ZUHYRKGQYSPWLA-MRXNPFEDSA-N	0	0	299.805	4.228	20	30		CIEDRN
C=CCn1c(SCC2CCC2)nnc1-c1ccccc1	ZINC000463021051	331337259	/nfs/dbraw/zinc/33/72/59/331337259.db2.gz	NZPQVSWMFFIOFG-UHFFFAOYSA-N	0	0	285.416	4.023	20	30		CIEDRN
C=CCC[C@@H](C)Nc1ccc(-n2cnc(C)c2C)cc1	ZINC000463023488	331337351	/nfs/dbraw/zinc/33/73/51/331337351.db2.gz	MINRNXNSPONJMG-CYBMUJFWSA-N	0	0	269.392	4.256	20	30		CIEDRN
C[C@@H](c1nc([C@H]2CCCC[C@H]2C)no1)c1cccc(C#N)c1	ZINC000463052256	331338675	/nfs/dbraw/zinc/33/86/75/331338675.db2.gz	FAMCCPGBMCNVOY-IOASZLSFSA-N	0	0	295.386	4.387	20	30		CIEDRN
C[C@H](c1nc([C@@H](C)C(C)(C)C)no1)c1cccc(C#N)c1	ZINC000463054965	331338849	/nfs/dbraw/zinc/33/88/49/331338849.db2.gz	LSIZAZGEITYUIO-NWDGAFQWSA-N	0	0	283.375	4.243	20	30		CIEDRN
Cc1ccc(CC[C@@H](C)Nc2c(F)cc(C#N)cc2F)o1	ZINC000463071397	331339316	/nfs/dbraw/zinc/33/93/16/331339316.db2.gz	RCVPHUBSPQKLEU-SNVBAGLBSA-N	0	0	290.313	4.171	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)[C@@H]1C[C@H]1CCC	ZINC000463124537	331340843	/nfs/dbraw/zinc/34/08/43/331340843.db2.gz	ANHQPEIFSKHOQS-DGCLKSJQSA-N	0	0	297.851	4.352	20	30		CIEDRN
C=CCN(CC=C)C(=O)[C@H](c1cccc(Cl)c1)C(C)C	ZINC000463263531	331344554	/nfs/dbraw/zinc/34/45/54/331344554.db2.gz	UCMHNXMPIUQBTA-INIZCTEOSA-N	0	0	291.822	4.280	20	30		CIEDRN
C=CCN(C(=O)CCc1ccc(C)s1)c1ccccc1	ZINC000463265409	331344709	/nfs/dbraw/zinc/34/47/09/331344709.db2.gz	XMFDOMWCHWTOGA-UHFFFAOYSA-N	0	0	285.412	4.208	20	30		CIEDRN
C=CCN(C(=O)N[C@@H]1c2ccccc2CCC[C@H]1C)C1CC1	ZINC000463284063	331345151	/nfs/dbraw/zinc/34/51/51/331345151.db2.gz	GQVFTUYGBPJILW-KDOFPFPSSA-N	0	0	298.430	4.060	20	30		CIEDRN
Cc1ccc(N[C@@H]2CCC[C@H](C#N)C2)c(Br)c1	ZINC000463288413	331345328	/nfs/dbraw/zinc/34/53/28/331345328.db2.gz	OYOQOCCKQOKXQQ-NWDGAFQWSA-N	0	0	293.208	4.252	20	30		CIEDRN
Cc1ccc(Br)c(N[C@@H]2CCC[C@@H](C#N)C2)c1	ZINC000463290790	331345398	/nfs/dbraw/zinc/34/53/98/331345398.db2.gz	LCQVLCXYOZEVDP-VXGBXAGGSA-N	0	0	293.208	4.252	20	30		CIEDRN
CC(C)N(C(=O)[C@@H](C)c1cccc(C#N)c1)c1ccccc1	ZINC000463457002	331348023	/nfs/dbraw/zinc/34/80/23/331348023.db2.gz	JHNMVUXSOJRGMF-HNNXBMFYSA-N	0	0	292.382	4.103	20	30		CIEDRN
CCN(C(=O)[C@H](C)c1cccc(C#N)c1)[C@H]1CCCC[C@H]1C	ZINC000463716950	331350939	/nfs/dbraw/zinc/35/09/39/331350939.db2.gz	SWQDLLVPYIOHGZ-RKVPGOIHSA-N	0	0	298.430	4.089	20	30		CIEDRN
C=CCCCNC(=O)Nc1cccc(C2CCC2)c1	ZINC000463844610	331352497	/nfs/dbraw/zinc/35/24/97/331352497.db2.gz	DEFBIJYWJMWCHQ-UHFFFAOYSA-N	0	0	258.365	4.042	20	30		CIEDRN
CC[C@H](C)[C@@H](C)N(C(=O)[C@H](C)c1cccc(C#N)c1)C1CC1	ZINC000463941093	331354231	/nfs/dbraw/zinc/35/42/31/331354231.db2.gz	DCDYDYCHRKSBSB-RRFJBIMHSA-N	0	0	298.430	4.087	20	30		CIEDRN
N#CCN(C(=O)c1ccc(C2CCCC2)cc1)C1CCCC1	ZINC000464050379	331355397	/nfs/dbraw/zinc/35/53/97/331355397.db2.gz	LIQOUBBXXHEUKO-UHFFFAOYSA-N	0	0	296.414	4.253	20	30		CIEDRN
CC#CCSCc1csc(-c2ccc(OC)cc2)n1	ZINC000464076465	331356307	/nfs/dbraw/zinc/35/63/07/331356307.db2.gz	NYOHNADELFJKLY-UHFFFAOYSA-N	0	0	289.425	4.075	20	30		CIEDRN
CCC(C)(C)[C@@H]1CCCN1C(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000464213358	331358079	/nfs/dbraw/zinc/35/80/79/331358079.db2.gz	XLKNPWZDNZTHDO-YOEHRIQHSA-N	0	0	298.430	4.089	20	30		CIEDRN
CCC[C@@H](CC1CCCCC1)C(=O)N[C@@H](C#N)C(C)C	ZINC000464297514	331359325	/nfs/dbraw/zinc/35/93/25/331359325.db2.gz	ALFWKPAXHVQWSI-HOTGVXAUSA-N	0	0	278.440	4.037	20	30		CIEDRN
CC(C)(C)[C@](C)(C#N)NC(=O)c1ccc(C2CCCC2)cc1	ZINC000464291855	331359404	/nfs/dbraw/zinc/35/94/04/331359404.db2.gz	SISQLONIPYGZDX-IBGZPJMESA-N	0	0	298.430	4.402	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)[C@@H](CC)c1ccccc1	ZINC000464322002	331359643	/nfs/dbraw/zinc/35/96/43/331359643.db2.gz	RVVSOWZADZMRGJ-SFHVURJKSA-N	0	0	297.398	4.031	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H](CC(C)(C)C)C(F)(F)F	ZINC000498231132	331360324	/nfs/dbraw/zinc/36/03/24/331360324.db2.gz	HIAMUDOAVCFOFO-JTQLQIEISA-N	0	0	279.346	4.072	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](CC)c1ccc(C)cc1	ZINC000464443843	331360361	/nfs/dbraw/zinc/36/03/61/331360361.db2.gz	BZGYWIBOKFMJNS-HOCLYGCPSA-N	0	0	259.393	4.165	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCC(C)(C)c1ccccc1Cl	ZINC000464437327	331360618	/nfs/dbraw/zinc/36/06/18/331360618.db2.gz	NYQBZVIDEFGOMT-CYBMUJFWSA-N	0	0	293.838	4.336	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC1CCCCC1)C1CC1	ZINC000464440511	331360687	/nfs/dbraw/zinc/36/06/87/331360687.db2.gz	WWUXHDYTHQMPOI-CQSZACIVSA-N	0	0	263.425	4.160	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NC(CC(C)C)CC(C)C	ZINC000464440967	331360689	/nfs/dbraw/zinc/36/06/89/331360689.db2.gz	YSEMYEZVQTZRNG-AWEZNQCLSA-N	0	0	253.430	4.166	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccccc1OCCCC	ZINC000464443272	331360774	/nfs/dbraw/zinc/36/07/74/331360774.db2.gz	ZXYOVQSGWVLEFH-AWEZNQCLSA-N	0	0	275.392	4.406	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](CCC)Cc1ccccc1	ZINC000464445524	331360790	/nfs/dbraw/zinc/36/07/90/331360790.db2.gz	XCRNKTYHFHVKLI-NVXWUHKLSA-N	0	0	273.420	4.116	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCC(C)(C)c1ccc(Cl)cc1	ZINC000464449239	331360851	/nfs/dbraw/zinc/36/08/51/331360851.db2.gz	JGAUPGGMXJLFGM-CYBMUJFWSA-N	0	0	293.838	4.336	20	30		CIEDRN
CC#CCCCC(=O)Nc1cccc(-c2nc(C)cs2)c1	ZINC000464450134	331360897	/nfs/dbraw/zinc/36/08/97/331360897.db2.gz	MOGIZJUXIGDYPQ-UHFFFAOYSA-N	0	0	298.411	4.251	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1cscc1-c1ccccc1	ZINC000464492596	331361445	/nfs/dbraw/zinc/36/14/45/331361445.db2.gz	FBZGVIZOSCGRDD-CQSZACIVSA-N	0	0	285.412	4.500	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](c1ccccc1)C(C)C	ZINC000464529764	331361928	/nfs/dbraw/zinc/36/19/28/331361928.db2.gz	RDFBBQGQSSDVKR-HOCLYGCPSA-N	0	0	259.393	4.102	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)Cc1ccc2ccccc2c1	ZINC000464532196	331361942	/nfs/dbraw/zinc/36/19/42/331361942.db2.gz	XPXQUFHCTWKKLD-OAHLLOKOSA-N	0	0	281.399	4.401	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccc(C)c(C(F)(F)F)c1	ZINC000464570281	331362108	/nfs/dbraw/zinc/36/21/08/331362108.db2.gz	ZSEYCPJWODDNPQ-UHFFFAOYSA-N	0	0	283.293	4.146	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H](c1ccc(Cl)cc1)C(C)C	ZINC000464543291	331362214	/nfs/dbraw/zinc/36/22/14/331362214.db2.gz	LNFVRXHVTAHEEL-QGZVFWFLSA-N	0	0	291.822	4.347	20	30		CIEDRN
CCc1ccc([C@@H](C)C(=O)Nc2ccc(C#N)c(F)c2)cc1	ZINC000464650707	331364228	/nfs/dbraw/zinc/36/42/28/331364228.db2.gz	SYAMUOPFXYTFPZ-GFCCVEGCSA-N	0	0	296.345	4.002	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](C)CC(C)(C)c1ccccc1	ZINC000464649688	331364240	/nfs/dbraw/zinc/36/42/40/331364240.db2.gz	OBFLDALUDFVXRD-CVEARBPZSA-N	0	0	287.447	4.461	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCc1ccc(-c2ccccc2)o1	ZINC000464653775	331364340	/nfs/dbraw/zinc/36/43/40/331364340.db2.gz	WHHJSBZAUBWHPU-CQSZACIVSA-N	0	0	283.371	4.165	20	30		CIEDRN
CC[C@H](CC1CCCCC1)C(=O)N[C@@H](C#N)C(C)(C)C	ZINC000464706911	331364969	/nfs/dbraw/zinc/36/49/69/331364969.db2.gz	FFTSMTKRTXUFKV-CABCVRRESA-N	0	0	278.440	4.037	20	30		CIEDRN
C[C@@H]1C[C@@H](c2ccccc2F)N(Cc2ccccc2C#N)C1	ZINC000464729166	331365368	/nfs/dbraw/zinc/36/53/68/331365368.db2.gz	ZSLRVLBBPTXCLS-KUHUBIRLSA-N	0	0	294.373	4.280	20	30		CIEDRN
C=C[C@H](C)NC(=O)N(C)[C@H](C)[C@H](C)c1ccc(Cl)cc1	ZINC000464752927	331365621	/nfs/dbraw/zinc/36/56/21/331365621.db2.gz	QFLNJIRQSVKSPH-RWMBFGLXSA-N	0	0	294.826	4.048	20	30		CIEDRN
COc1ccc2c(c1)N(CCCC(C)(C)C#N)CCCC2	ZINC000464831118	331370012	/nfs/dbraw/zinc/37/00/12/331370012.db2.gz	RRFHZUOCMJYJQF-UHFFFAOYSA-N	0	0	286.419	4.168	20	30		CIEDRN
C=C[C@@H](C)NC(=O)c1cc2sc3ccccc3c2s1	ZINC000465113371	331378680	/nfs/dbraw/zinc/37/86/80/331378680.db2.gz	RANYFMHFMJSAAS-SECBINFHSA-N	0	0	287.409	4.420	20	30		CIEDRN
C=C[C@@H](C)NC(=O)c1cc(-c2ccccc2)ccc1Cl	ZINC000465111765	331378696	/nfs/dbraw/zinc/37/86/96/331378696.db2.gz	JHVUPZXGFSVSJP-GFCCVEGCSA-N	0	0	285.774	4.311	20	30		CIEDRN
C=C[C@H](C)NC(=O)Nc1cccc(Oc2ccccc2)c1	ZINC000465251364	331380702	/nfs/dbraw/zinc/38/07/02/331380702.db2.gz	IAFUWKWHDGIOOS-ZDUSSCGKSA-N	0	0	282.343	4.175	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)N[C@H](C)C[C@@H](C)CC	ZINC000466166818	331390320	/nfs/dbraw/zinc/39/03/20/331390320.db2.gz	OCPDDZKEIHXJHJ-UONOGXRCSA-N	0	0	294.464	4.270	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1c(F)cc(Cl)c(C)c1F	ZINC000466243827	331391546	/nfs/dbraw/zinc/39/15/46/331391546.db2.gz	VUIFQWJLVPKUHU-MRVPVSSYSA-N	0	0	287.737	4.467	20	30		CIEDRN
CC#CCCCC(=O)NC1(Cc2ccccc2)CCCCC1	ZINC000466259759	331391850	/nfs/dbraw/zinc/39/18/50/331391850.db2.gz	VHTNGXBYCNRYHF-UHFFFAOYSA-N	0	0	297.442	4.242	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(F)cc1OC(C)C	ZINC000466262815	331391852	/nfs/dbraw/zinc/39/18/52/331391852.db2.gz	VDQUCCZVLCCHFQ-LBPRGKRZSA-N	0	0	279.355	4.154	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCCc1c(C)oc2ccccc21	ZINC000466310421	331392652	/nfs/dbraw/zinc/39/26/52/331392652.db2.gz	ZRDZFKLSOPZUEY-ZDUSSCGKSA-N	0	0	285.387	4.002	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CCC[C@H]1c1ccccc1C	ZINC000466365802	331393481	/nfs/dbraw/zinc/39/34/81/331393481.db2.gz	ABLCHBOGWXAVNB-RDJZCZTQSA-N	0	0	286.419	4.196	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(C)[C@@H](C)c1ccc(C)cc1	ZINC000466367688	331393755	/nfs/dbraw/zinc/39/37/55/331393755.db2.gz	YJVBRWQXNSMUPM-HOCLYGCPSA-N	0	0	274.408	4.052	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(C)C/C(C)=C/c1ccccc1	ZINC000466377692	331393918	/nfs/dbraw/zinc/39/39/18/331393918.db2.gz	GUONRFZPAIWTSH-LCJXNMAOSA-N	0	0	286.419	4.086	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CCC[C@@H]1c1cccc(F)c1	ZINC000466380180	331394112	/nfs/dbraw/zinc/39/41/12/331394112.db2.gz	MDQOTVHUVHYLCH-JKSUJKDBSA-N	0	0	290.382	4.027	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N1CCc2sccc2[C@H]1CC	ZINC000466382447	331394170	/nfs/dbraw/zinc/39/41/70/331394170.db2.gz	GVEFOIGSWXOCLF-TZMCWYRMSA-N	0	0	292.448	4.122	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CCCC(C)(C)[C@H]1CC=C	ZINC000466384411	331394261	/nfs/dbraw/zinc/39/42/61/331394261.db2.gz	XBVPYVXYRGYBHS-LSDHHAIUSA-N	0	0	278.440	4.117	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(C)[C@H](C)c1ccc(C)cc1C	ZINC000466389931	331394482	/nfs/dbraw/zinc/39/44/82/331394482.db2.gz	RZGCFQRPGNTIOI-CVEARBPZSA-N	0	0	288.435	4.361	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1ccc(OCCC)cc1C	ZINC000466390677	331394524	/nfs/dbraw/zinc/39/45/24/331394524.db2.gz	UZQPVRYSPNGFOO-AWEZNQCLSA-N	0	0	290.407	4.260	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N1CC=C(c2cccc(C)c2)CC1	ZINC000466397492	331394863	/nfs/dbraw/zinc/39/48/63/331394863.db2.gz	FDELRFXOKIWPAM-GOSISDBHSA-N	0	0	298.430	4.148	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1ccc(OC(C)(C)C)cc1	ZINC000466400637	331395075	/nfs/dbraw/zinc/39/50/75/331395075.db2.gz	DXKGLRWKLOGLDL-ZDUSSCGKSA-N	0	0	290.407	4.340	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CCCCC[C@@H]1c1ccco1	ZINC000466405172	331395272	/nfs/dbraw/zinc/39/52/72/331395272.db2.gz	FRCWEBYONIMQRG-LSDHHAIUSA-N	0	0	290.407	4.261	20	30		CIEDRN
CC#CCCCC(=O)N[C@H](CC)C(C)(C)c1ccccc1	ZINC000466432743	331396887	/nfs/dbraw/zinc/39/68/87/331396887.db2.gz	YYYGBPVIKBSTBV-QGZVFWFLSA-N	0	0	285.431	4.053	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1C[C@H](C)Sc2ccccc21	ZINC000466440983	331396889	/nfs/dbraw/zinc/39/68/89/331396889.db2.gz	HPYRRMDYMCYLDT-OLZOCXBDSA-N	0	0	275.417	4.116	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)C1CCC(C)(C)CC1	ZINC000466439222	331397138	/nfs/dbraw/zinc/39/71/38/331397138.db2.gz	VLZLQVNBDBPXMB-CYBMUJFWSA-N	0	0	251.414	4.016	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H](c1ccccc1Cl)C(C)C	ZINC000466437281	331397171	/nfs/dbraw/zinc/39/71/71/331397171.db2.gz	ACJQLGLPNLBDFA-QGZVFWFLSA-N	0	0	291.822	4.347	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCCc2cccc(Cl)c21	ZINC000466441350	331397212	/nfs/dbraw/zinc/39/72/12/331397212.db2.gz	KCGRNSSOWGGOHJ-LBPRGKRZSA-N	0	0	277.795	4.222	20	30		CIEDRN
N#Cc1ccc(CNc2ccc(F)c(C3CC3)c2)s1	ZINC000466474866	331398072	/nfs/dbraw/zinc/39/80/72/331398072.db2.gz	QVMDWGVXWJMTAJ-UHFFFAOYSA-N	0	0	272.348	4.248	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@H](Sc1ccccc1)C(C)C	ZINC000466528020	331399109	/nfs/dbraw/zinc/39/91/09/331399109.db2.gz	GPCPGEWMQJDRME-GOEBONIOSA-N	0	0	291.460	4.274	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(OC2CCC2)c(F)c1	ZINC000466531899	331399179	/nfs/dbraw/zinc/39/91/79/331399179.db2.gz	ZZFNSGLRUKQSGO-LBPRGKRZSA-N	0	0	291.366	4.298	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCC1(Cc2ccccc2)CCC1	ZINC000466531796	331399337	/nfs/dbraw/zinc/39/93/37/331399337.db2.gz	REAJINQSWWDVKO-MRXNPFEDSA-N	0	0	285.431	4.118	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)C1(c2ccc(F)cc2)CCCC1	ZINC000466541608	331399621	/nfs/dbraw/zinc/39/96/21/331399621.db2.gz	RZJADJLKUZCIMU-MRXNPFEDSA-N	0	0	289.394	4.108	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H](C(C)(C)C)CC1	ZINC000466662662	331402093	/nfs/dbraw/zinc/40/20/93/331402093.db2.gz	ZLQXLMOVIVMATE-HUUCEWRRSA-N	0	0	265.441	4.264	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@H](C)c1ccc(SC)cc1	ZINC000466841298	331406324	/nfs/dbraw/zinc/40/63/24/331406324.db2.gz	LAYGNTXUALZPPF-CYBMUJFWSA-N	0	0	292.448	4.077	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCCc2c(C)ccc(F)c21	ZINC000466865562	331406737	/nfs/dbraw/zinc/40/67/37/331406737.db2.gz	CNUWHRPVHNWQKZ-CYBMUJFWSA-N	0	0	275.367	4.016	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCCc2c(C)ccc(F)c21	ZINC000466865563	331406784	/nfs/dbraw/zinc/40/67/84/331406784.db2.gz	CNUWHRPVHNWQKZ-ZDUSSCGKSA-N	0	0	275.367	4.016	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1nc2c(ccc(F)c2C)s1	ZINC000466871579	331406848	/nfs/dbraw/zinc/40/68/48/331406848.db2.gz	TUKXTERITVLTFS-VIFPVBQESA-N	0	0	292.379	4.285	20	30		CIEDRN
C=CCCN(C)C(=O)N[C@H](CC(C)(C)C)c1ccccc1	ZINC000466974577	331409495	/nfs/dbraw/zinc/40/94/95/331409495.db2.gz	LGGQHRDRRYTGMG-MRXNPFEDSA-N	0	0	288.435	4.381	20	30		CIEDRN
C=CCCN(C)C(=O)N[C@H](c1ccc(CC)cc1)C(C)C	ZINC000466973695	331409526	/nfs/dbraw/zinc/40/95/26/331409526.db2.gz	OOYJLOHQOFJYDV-KRWDZBQOSA-N	0	0	288.435	4.164	20	30		CIEDRN
C=CCCN(C)C(=O)N[C@@H](C)c1oc2ccccc2c1C	ZINC000466983711	331409542	/nfs/dbraw/zinc/40/95/42/331409542.db2.gz	ULHMEBLEWGRUBM-ZDUSSCGKSA-N	0	0	286.375	4.020	20	30		CIEDRN
C=CCCN(C)C(=O)N[C@H](CC)c1ccc(Cl)cc1	ZINC000466978100	331409588	/nfs/dbraw/zinc/40/95/88/331409588.db2.gz	CQTLUTHBDAPKLJ-CQSZACIVSA-N	0	0	280.799	4.009	20	30		CIEDRN
C=C(CC)CSc1nc(-c2ccccc2)c(C)c(=O)[nH]1	ZINC000467209239	331412530	/nfs/dbraw/zinc/41/25/30/331412530.db2.gz	YZXZSPFQUSMHGU-UHFFFAOYSA-N	0	0	286.400	4.216	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H]1CCC[C@H]1CCCC	ZINC000467360649	331416253	/nfs/dbraw/zinc/41/62/53/331416253.db2.gz	YXQZAUFNPNMFHN-GDBMZVCRSA-N	0	0	263.425	4.230	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000467520356	331421146	/nfs/dbraw/zinc/42/11/46/331421146.db2.gz	UPMHIVNPHABPEW-IAQYHMDHSA-N	0	0	299.336	4.485	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc(F)cc1NC(C)C	ZINC000467534922	331421279	/nfs/dbraw/zinc/42/12/79/331421279.db2.gz	DPAIPUQZEVEXTE-UHFFFAOYSA-N	0	0	290.382	4.353	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(Cc1ccccc1)CC(C)C	ZINC000467830004	331424318	/nfs/dbraw/zinc/42/43/18/331424318.db2.gz	XZQLVGSKQXOKCU-UHFFFAOYSA-N	0	0	285.431	4.440	20	30		CIEDRN
C=CCC(CC=C)C(=O)NCC(C)(C)c1ccccc1C	ZINC000467820279	331424333	/nfs/dbraw/zinc/42/43/33/331424333.db2.gz	XFPUGUFQPBJTBG-UHFFFAOYSA-N	0	0	285.431	4.157	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC)[C@@H]1CCCC[C@@H]1C	ZINC000467823418	331424338	/nfs/dbraw/zinc/42/43/38/331424338.db2.gz	OODSKAWIOZEGLH-GOEBONIOSA-N	0	0	263.425	4.182	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCCC[C@@H]1Cc1ccccc1	ZINC000467831438	331424345	/nfs/dbraw/zinc/42/43/45/331424345.db2.gz	JIBPGFDDMPLGBJ-LJQANCHMSA-N	0	0	297.442	4.379	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCCc2c(C)ccc(OC)c21	ZINC000467840192	331424573	/nfs/dbraw/zinc/42/45/73/331424573.db2.gz	SREYENLHJFUNLL-UHFFFAOYSA-N	0	0	299.414	4.051	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cc(C)c(Cl)cc1OC	ZINC000467858931	331424806	/nfs/dbraw/zinc/42/48/06/331424806.db2.gz	NJCFPCAYXUXSSC-OAHLLOKOSA-N	0	0	281.783	4.198	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H]1CC[C@@H](Cc2ccccc2)C1	ZINC000467879434	331425035	/nfs/dbraw/zinc/42/50/35/331425035.db2.gz	WOAYTJLIQKXVNJ-JENIJYKNSA-N	0	0	285.431	4.116	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@@H](C)c1ccc2ncsc2c1	ZINC000467881215	331425222	/nfs/dbraw/zinc/42/52/22/331425222.db2.gz	XLSFHKFKNDNICX-ZBEGNZNMSA-N	0	0	288.416	4.076	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N(CCC)CCc1cccs1	ZINC000467918691	331425654	/nfs/dbraw/zinc/42/56/54/331425654.db2.gz	LFKGMDGDRVHCCQ-INIZCTEOSA-N	0	0	279.449	4.132	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)NCc1csc2ccccc12	ZINC000467928217	331425739	/nfs/dbraw/zinc/42/57/39/331425739.db2.gz	VAHNPGCQTLNWKS-INIZCTEOSA-N	0	0	273.401	4.120	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)NCC1(c2ccccc2Cl)CC1	ZINC000467966407	331426168	/nfs/dbraw/zinc/42/61/68/331426168.db2.gz	AEVXLJGNUUHQAB-MRXNPFEDSA-N	0	0	291.822	4.090	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CC=C(c2ccc(CC)cc2)CC1	ZINC000467977245	331426209	/nfs/dbraw/zinc/42/62/09/331426209.db2.gz	KOJALGXWGMTXSR-HXUWFJFHSA-N	0	0	297.442	4.467	20	30		CIEDRN
C=CCCCNC(=O)[C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000468373943	331433005	/nfs/dbraw/zinc/43/30/05/331433005.db2.gz	UIOIUHACOZKMGQ-VXGBXAGGSA-N	0	0	298.213	4.179	20	30		CIEDRN
C=CCCCNC(=O)CCCCCc1ccc(F)cc1	ZINC000468378078	331433231	/nfs/dbraw/zinc/43/32/31/331433231.db2.gz	DECQIIBTBWTCII-UHFFFAOYSA-N	0	0	277.383	4.011	20	30		CIEDRN
C=CCCCNC(=O)[C@@H](C)c1ccc(Cl)c(Cl)c1	ZINC000468394364	331433800	/nfs/dbraw/zinc/43/38/00/331433800.db2.gz	HBEMFUOVUUBNBJ-JTQLQIEISA-N	0	0	286.202	4.179	20	30		CIEDRN
C=CCCCNC(=O)[C@H](C)c1ccc(Cl)c(Cl)c1	ZINC000468394365	331433814	/nfs/dbraw/zinc/43/38/14/331433814.db2.gz	HBEMFUOVUUBNBJ-SNVBAGLBSA-N	0	0	286.202	4.179	20	30		CIEDRN
C=CCCCNC(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl	ZINC000468402527	331434361	/nfs/dbraw/zinc/43/43/61/331434361.db2.gz	KILHCMKTWALFNV-QWHCGFSZSA-N	0	0	298.213	4.179	20	30		CIEDRN
N#Cc1cccc(SCC(=O)c2ccc3c(c2)CCC3)c1	ZINC000468630842	331437860	/nfs/dbraw/zinc/43/78/60/331437860.db2.gz	IHXOXACAUKKCGC-UHFFFAOYSA-N	0	0	293.391	4.022	20	30		CIEDRN
Cc1ccc(C#N)cc1OCc1ncc(-c2ccccc2)o1	ZINC000468814284	331440511	/nfs/dbraw/zinc/44/05/11/331440511.db2.gz	CPNJSYVNIWXMEJ-UHFFFAOYSA-N	0	0	290.322	4.101	20	30		CIEDRN
CCCCCN(C(=O)CC(C)(C)C#N)[C@@H](C)CCC	ZINC000468823581	331440581	/nfs/dbraw/zinc/44/05/81/331440581.db2.gz	DINXKXMKRXHDAP-AWEZNQCLSA-N	0	0	266.429	4.134	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CC[C@@](C)(c2ccc(C)cc2)C1	ZINC000468942247	331442696	/nfs/dbraw/zinc/44/26/96/331442696.db2.gz	JEZDIBZGPSNDNQ-RBUKOAKNSA-N	0	0	285.431	4.087	20	30		CIEDRN
N#Cc1cc(C(=O)Nc2cccc3ccccc32)ccc1F	ZINC000468973017	331443467	/nfs/dbraw/zinc/44/34/67/331443467.db2.gz	OSJXNKCJSVQZAL-UHFFFAOYSA-N	0	0	290.297	4.103	20	30		CIEDRN
CCCNc1ccc(C#N)cc1NC(=O)C[C@H](C)C(C)C	ZINC000469146583	331446580	/nfs/dbraw/zinc/44/65/80/331446580.db2.gz	ZXRYHUKQPMKKBS-ZDUSSCGKSA-N	0	0	287.407	4.001	20	30		CIEDRN
C=C(C)CN(C)C(=O)C[C@@H]1C[C@@H](C(C)C)c2ccccc21	ZINC000469759816	331457117	/nfs/dbraw/zinc/45/71/17/331457117.db2.gz	DJPYRSQJXBDNPC-YJBOKZPZSA-N	0	0	285.431	4.338	20	30		CIEDRN
C=CCCCCCN(C)C(=O)C[C@@H]1CCC[C@@H]1C	ZINC000469812515	331461721	/nfs/dbraw/zinc/46/17/21/331461721.db2.gz	YWJMFRMTNUXODF-GJZGRUSLSA-N	0	0	251.414	4.018	20	30		CIEDRN
C=C(C)CNC(=O)C1(c2c(Cl)cccc2Cl)CCC1	ZINC000469812003	331461799	/nfs/dbraw/zinc/46/17/99/331461799.db2.gz	XJBIPBSATOVUTH-UHFFFAOYSA-N	0	0	298.213	4.107	20	30		CIEDRN
C=CCCN(C)C(=O)C[C@@H]1C[C@@H](C(C)C)c2ccccc21	ZINC000469818697	331461896	/nfs/dbraw/zinc/46/18/96/331461896.db2.gz	KVWVWWDPUDVLAD-YJBOKZPZSA-N	0	0	285.431	4.338	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCCC(CC)(CC)CC1	ZINC000469932124	331465344	/nfs/dbraw/zinc/46/53/44/331465344.db2.gz	DGWFOZGCBYPFPU-HNNXBMFYSA-N	0	0	265.441	4.408	20	30		CIEDRN
C=CC[C@H]1N(C(=O)CC(C)(C)C)CCCC1(C)C	ZINC000470291328	331478286	/nfs/dbraw/zinc/47/82/86/331478286.db2.gz	FYEIXOZERGMAKG-CYBMUJFWSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)Cc1ccc(F)c(Cl)c1	ZINC000470002820	331469464	/nfs/dbraw/zinc/46/94/64/331469464.db2.gz	LZZJWTQRUPLNHK-NSHDSACASA-N	0	0	283.774	4.040	20	30		CIEDRN
C=CCC1(C(=O)N(C)Cc2cc(C)cc(C)c2)CCC1	ZINC000470094355	331471239	/nfs/dbraw/zinc/47/12/39/331471239.db2.gz	PJWQJRHLZQCSIF-UHFFFAOYSA-N	0	0	271.404	4.008	20	30		CIEDRN
C=CC[C@H]1N(C(=O)C2CCC(F)(F)CC2)CCCC1(C)C	ZINC000470284076	331477864	/nfs/dbraw/zinc/47/78/64/331477864.db2.gz	GMDXWDMHXHQNQM-CQSZACIVSA-N	0	0	299.405	4.405	20	30		CIEDRN
N#Cc1cnccc1/C=C/c1cnc(-c2ccccc2)s1	ZINC000470285808	331477865	/nfs/dbraw/zinc/47/78/65/331477865.db2.gz	VEXYWEHMRJAEMA-VOTSOKGWSA-N	0	0	289.363	4.247	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)C1=C(C)CCC1	ZINC000470643445	331486694	/nfs/dbraw/zinc/48/66/94/331486694.db2.gz	FRCZYIXFSFHNJJ-UHFFFAOYSA-N	0	0	269.388	4.092	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)c1cc(C(C)C)no1	ZINC000470642541	331486786	/nfs/dbraw/zinc/48/67/86/331486786.db2.gz	BHMRIPVLDMWWAK-UHFFFAOYSA-N	0	0	298.386	4.017	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)[C@H]1CC[C@H](C)C1	ZINC000470649793	331486855	/nfs/dbraw/zinc/48/68/55/331486855.db2.gz	VPNGAGPPSOQKIN-RDJZCZTQSA-N	0	0	271.404	4.028	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)[C@@H]1CC[C@H](C)C1	ZINC000470649691	331486883	/nfs/dbraw/zinc/48/68/83/331486883.db2.gz	VPNGAGPPSOQKIN-DOTOQJQBSA-N	0	0	271.404	4.028	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)[C@H]1C[C@]1(C)CC	ZINC000470647134	331486917	/nfs/dbraw/zinc/48/69/17/331486917.db2.gz	QYMHMNLCJJVXJE-AEFFLSMTSA-N	0	0	271.404	4.028	20	30		CIEDRN
CC1(C)CCCN(Cc2cccc(C(F)F)c2)[C@H]1C#N	ZINC000470864951	331493096	/nfs/dbraw/zinc/49/30/96/331493096.db2.gz	DIAVZTCURKMFMG-AWEZNQCLSA-N	0	0	278.346	4.138	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)[C@H]1CCCC(C)(C)C1	ZINC000471169822	331503030	/nfs/dbraw/zinc/50/30/30/331503030.db2.gz	QZNAHERLDKVHOI-AWEZNQCLSA-N	0	0	278.440	4.134	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@@H](c3ccc(C)cc3C)C2)CCC1	ZINC000471333221	331506696	/nfs/dbraw/zinc/50/66/96/331506696.db2.gz	UUALFIDSBVXXLQ-QGZVFWFLSA-N	0	0	297.442	4.366	20	30		CIEDRN
CCSc1cccc(/C=C/c2ccc(C#N)cn2)c1	ZINC000471454654	331509055	/nfs/dbraw/zinc/50/90/55/331509055.db2.gz	GOTBJBNWHGZKFN-SOFGYWHQSA-N	0	0	266.369	4.236	20	30		CIEDRN
C=CCCCCNC(=O)Cc1coc2cc(C)c(C)cc12	ZINC000471670009	331514562	/nfs/dbraw/zinc/51/45/62/331514562.db2.gz	YAJCQYGAOGJHCL-UHFFFAOYSA-N	0	0	285.387	4.065	20	30		CIEDRN
C=CCCCCNC(=O)c1ccc(-c2ccccc2F)o1	ZINC000471679133	331515227	/nfs/dbraw/zinc/51/52/27/331515227.db2.gz	NFOBLKVOCNDGOQ-UHFFFAOYSA-N	0	0	287.334	4.172	20	30		CIEDRN
C=CCCCCNC(=O)[C@@H](c1ccc(F)cc1)C(C)C	ZINC000471710632	331517428	/nfs/dbraw/zinc/51/74/28/331517428.db2.gz	CJHQXMQCNZKPKH-MRXNPFEDSA-N	0	0	277.383	4.038	20	30		CIEDRN
C=C[C@@H](C)NC(=O)Nc1c(CCC)cccc1C(C)C	ZINC000471871213	331522893	/nfs/dbraw/zinc/52/28/93/331522893.db2.gz	NJYPYYIODDCHFT-CYBMUJFWSA-N	0	0	274.408	4.459	20	30		CIEDRN
C=C[C@@H](C)NC(=O)c1ccc(O[C@@H](C)c2ccccc2)cc1	ZINC000472548300	331538202	/nfs/dbraw/zinc/53/82/02/331538202.db2.gz	NFUVQEHSKKQSJK-CABCVRRESA-N	0	0	295.382	4.131	20	30		CIEDRN
C=CCC[C@H](O)CN(Cc1ccsc1)c1ccccc1	ZINC000472682040	331541210	/nfs/dbraw/zinc/54/12/10/331541210.db2.gz	HKWWWYFDZYKOOT-KRWDZBQOSA-N	0	0	287.428	4.082	20	30		CIEDRN
C=CCCCCNC(=O)N1CCC[C@@H]1/C=C/c1ccccc1	ZINC000472854386	331544619	/nfs/dbraw/zinc/54/46/19/331544619.db2.gz	SCFMZGVLRFBHLM-KAUXGEHWSA-N	0	0	298.430	4.230	20	30		CIEDRN
CCCn1c2cc(F)ccc2nc1-c1ccc(C#N)cc1	ZINC000473449356	331551544	/nfs/dbraw/zinc/55/15/44/331551544.db2.gz	PJGCAZCDGVQDOQ-UHFFFAOYSA-N	0	0	279.318	4.124	20	30		CIEDRN
C=CCCCCNC(=O)Nc1cccc2ccsc21	ZINC000473757865	331556805	/nfs/dbraw/zinc/55/68/05/331556805.db2.gz	JPLLMOMMJKZRSQ-UHFFFAOYSA-N	0	0	274.389	4.379	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CCC[C@@](C)(CCC)C1	ZINC000473895627	331559673	/nfs/dbraw/zinc/55/96/73/331559673.db2.gz	POUVQKUKBPMQSY-HZPDHXFCSA-N	0	0	251.414	4.018	20	30		CIEDRN
CC(C)(C)[C@H](CC1CCCCC1)NC(=O)CC(C)(C)C#N	ZINC000498346772	331560816	/nfs/dbraw/zinc/56/08/16/331560816.db2.gz	SQIXWPCZRGEIOB-HNNXBMFYSA-N	0	0	292.467	4.428	20	30		CIEDRN
Cc1ccc(C)c(NC(=O)C[C@H](CC#N)c2ccccc2)c1	ZINC000474071866	331567790	/nfs/dbraw/zinc/56/77/90/331567790.db2.gz	GGTVZCJRBBZSMB-KRWDZBQOSA-N	0	0	292.382	4.330	20	30		CIEDRN
N#CC[C@@H](CC(=O)Nc1cccc(Cl)c1)c1ccccc1	ZINC000474080036	331568524	/nfs/dbraw/zinc/56/85/24/331568524.db2.gz	KVHSPYZPVGWBRM-AWEZNQCLSA-N	0	0	298.773	4.366	20	30		CIEDRN
Cc1cc(C(=O)Nc2cccc(C#N)c2)c(C)cc1Cl	ZINC000474081519	331568747	/nfs/dbraw/zinc/56/87/47/331568747.db2.gz	PUSHWYBBUHZRQU-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
N#CC[C@@H](CC(=O)Nc1ccccc1Cl)c1ccccc1	ZINC000474089695	331569476	/nfs/dbraw/zinc/56/94/76/331569476.db2.gz	OIZXNNWWOZSLIO-AWEZNQCLSA-N	0	0	298.773	4.366	20	30		CIEDRN
C[C@@H]1CCC[C@@H](NC(=O)c2ccc(C(C)(C)C#N)cc2)[C@H]1C	ZINC000474091278	331569721	/nfs/dbraw/zinc/56/97/21/331569721.db2.gz	WHALFLPNWNZMOU-JKIFEVAISA-N	0	0	298.430	4.042	20	30		CIEDRN
C[C@H](CC(=O)N[C@H](C)c1ccc(C#N)cc1)C1CCCCC1	ZINC000510789439	332917171	/nfs/dbraw/zinc/91/71/71/332917171.db2.gz	DOTAWZDRSXCGKS-HUUCEWRRSA-N	0	0	298.430	4.342	20	30		CIEDRN
C[C@@H](Nc1cccc(C#N)c1)C1CCC(F)(F)CC1	ZINC000474115994	331571995	/nfs/dbraw/zinc/57/19/95/331571995.db2.gz	HLUGGCZAQQGBSH-LLVKDONJSA-N	0	0	264.319	4.184	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)[C@H]1CC[C@H](CC)CC1	ZINC000474165134	331573948	/nfs/dbraw/zinc/57/39/48/331573948.db2.gz	RWKKSMIWLROIFG-WKILWMFISA-N	0	0	289.419	4.053	20	30		CIEDRN
C[C@H](Nc1ncc(C#N)cc1Cl)[C@@H](C)c1ccccc1	ZINC000474185753	331574533	/nfs/dbraw/zinc/57/45/33/331574533.db2.gz	RIGVALUYAKTHFP-NEPJUHHUSA-N	0	0	285.778	4.211	20	30		CIEDRN
C=CCCC1(C(=O)N[C@@H](C)c2ccc(CC)cc2)CC1	ZINC000474192916	331574965	/nfs/dbraw/zinc/57/49/65/331574965.db2.gz	DYNWRGKVLMXXMO-AWEZNQCLSA-N	0	0	271.404	4.173	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(Cl)cc2C)CC1	ZINC000474411553	331585508	/nfs/dbraw/zinc/58/55/08/331585508.db2.gz	LHYHPOFEWOVWTA-UHFFFAOYSA-N	0	0	263.768	4.333	20	30		CIEDRN
C=CCCC(=O)NC(C)(C)CC1CCCCCC1	ZINC000474419522	331586239	/nfs/dbraw/zinc/58/62/39/331586239.db2.gz	WERLYNHIRWABCB-UHFFFAOYSA-N	0	0	251.414	4.208	20	30		CIEDRN
CCc1ccccc1NC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000474427055	331586411	/nfs/dbraw/zinc/58/64/11/331586411.db2.gz	PAQPOEMDFUSONQ-QGZVFWFLSA-N	0	0	292.382	4.275	20	30		CIEDRN
CC(C)(CC(=O)NCc1cccc(C#N)c1)C1CCCCC1	ZINC000474696262	331594495	/nfs/dbraw/zinc/59/44/95/331594495.db2.gz	GGNKBQHDAUPRFJ-UHFFFAOYSA-N	0	0	298.430	4.171	20	30		CIEDRN
C=CCCC1(C(=O)N(CC)Cc2cccc(Cl)c2)CC1	ZINC000474694300	331594601	/nfs/dbraw/zinc/59/46/01/331594601.db2.gz	KJJWIBAOASLLDI-UHFFFAOYSA-N	0	0	291.822	4.435	20	30		CIEDRN
C=CCCC1(C(=O)N[C@@H](C)c2ccccc2OCC)CC1	ZINC000474712386	331595476	/nfs/dbraw/zinc/59/54/76/331595476.db2.gz	UZKNOIUTYGSCDS-AWEZNQCLSA-N	0	0	287.403	4.009	20	30		CIEDRN
CC[C@H]1CCCC[C@@H]1NC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000474784329	331598047	/nfs/dbraw/zinc/59/80/47/331598047.db2.gz	KNFFCODEJFUWBV-YOEHRIQHSA-N	0	0	298.430	4.186	20	30		CIEDRN
CC[C@@H]1CCCC[C@@H]1NC(=O)C[C@H](CC#N)c1ccccc1	ZINC000474785902	331598223	/nfs/dbraw/zinc/59/82/23/331598223.db2.gz	WBCWEBJSEMCDSL-NJAFHUGGSA-N	0	0	298.430	4.159	20	30		CIEDRN
C=CCCC1(C(=O)N(CC)CC(CC)CC)CC1	ZINC000474877227	331602307	/nfs/dbraw/zinc/60/23/07/331602307.db2.gz	FNPQGHNJALQTJE-UHFFFAOYSA-N	0	0	251.414	4.018	20	30		CIEDRN
CC(C)COc1cccc(/C=C/c2ccc(C#N)cn2)c1	ZINC000510919464	332920470	/nfs/dbraw/zinc/92/04/70/332920470.db2.gz	SZBQJSYUGGKIPB-SOFGYWHQSA-N	0	0	278.355	4.158	20	30		CIEDRN
C=CCNC(=O)N[C@@H](c1ccc(Cl)cc1)C1CCCC1	ZINC000510858370	332918938	/nfs/dbraw/zinc/91/89/38/332918938.db2.gz	BIOCJLDYNIPRSH-OAHLLOKOSA-N	0	0	292.810	4.057	20	30		CIEDRN
C=CCOc1cccc(NC(=O)c2cc3[nH]ccc3s2)c1	ZINC000475110612	331614905	/nfs/dbraw/zinc/61/49/05/331614905.db2.gz	BXACCSMAUWHWAM-UHFFFAOYSA-N	0	0	298.367	4.047	20	30		CIEDRN
CC(C)CCc1nc(CNc2ccc(C#N)cc2)cs1	ZINC000475163407	331616877	/nfs/dbraw/zinc/61/68/77/331616877.db2.gz	IMQKUWZPNXHGNM-UHFFFAOYSA-N	0	0	285.416	4.215	20	30		CIEDRN
CC1(C)CCCN(Cc2ccc(C(F)F)cc2)[C@@H]1C#N	ZINC000475197901	331617783	/nfs/dbraw/zinc/61/77/83/331617783.db2.gz	ZHPBCRZQIDLRLO-CQSZACIVSA-N	0	0	278.346	4.138	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@@H](C)CC(C)(C)C	ZINC000475286392	331622013	/nfs/dbraw/zinc/62/20/13/331622013.db2.gz	JVXHOGMMDLPBQB-ZDUSSCGKSA-N	0	0	279.449	4.335	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H]1CC[C@H](c2cccc(F)c2)C1	ZINC000510905757	332920122	/nfs/dbraw/zinc/92/01/22/332920122.db2.gz	IKONKPLVILKYKU-HOCLYGCPSA-N	0	0	289.394	4.180	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H]1CC[C@H](c2cccc(F)c2)C1	ZINC000510905756	332920124	/nfs/dbraw/zinc/92/01/24/332920124.db2.gz	IKONKPLVILKYKU-GOEBONIOSA-N	0	0	289.394	4.180	20	30		CIEDRN
C=CCCC1(C(=O)NCC(C)(C)c2ccccc2C)CC1	ZINC000475456221	331632199	/nfs/dbraw/zinc/63/21/99/331632199.db2.gz	HVLXCFGNTOHHEA-UHFFFAOYSA-N	0	0	285.431	4.135	20	30		CIEDRN
CC(C)[C@@](C)(C#N)NC(=O)CC(C)(C)C1CCCCC1	ZINC000475464008	331632378	/nfs/dbraw/zinc/63/23/78/331632378.db2.gz	KAWCTDVBEMFAKU-QGZVFWFLSA-N	0	0	278.440	4.037	20	30		CIEDRN
CC(C)CCN(C(=O)c1ccc(C#N)s1)C1CCCC1	ZINC000475520267	331635575	/nfs/dbraw/zinc/63/55/75/331635575.db2.gz	JIWLYVLQEUDKNS-UHFFFAOYSA-N	0	0	290.432	4.051	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)CCCC1CCCC1	ZINC000475729936	331643540	/nfs/dbraw/zinc/64/35/40/331643540.db2.gz	IFLJSUWAPDNCMU-UHFFFAOYSA-N	0	0	278.440	4.326	20	30		CIEDRN
CCCC[C@H](S[C@H](C)c1cccc(C#N)c1)C(=O)OC	ZINC000475884225	331647449	/nfs/dbraw/zinc/64/74/49/331647449.db2.gz	VZSCNKKSKNVWGT-DOMZBBRYSA-N	0	0	291.416	4.084	20	30		CIEDRN
C=CCCC1(C(=O)N[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000475900256	331648260	/nfs/dbraw/zinc/64/82/60/331648260.db2.gz	PWXLXGFKTZEYDN-SJORKVTESA-N	0	0	283.415	4.185	20	30		CIEDRN
Cc1cccc(O[C@@H](C)c2cccc(C#N)c2)c1F	ZINC000476039650	331651837	/nfs/dbraw/zinc/65/18/37/331651837.db2.gz	IFKKNKIJDOIIIX-LBPRGKRZSA-N	0	0	255.292	4.146	20	30		CIEDRN
CC[C@@H]1CCC[C@@H](NC(=O)C[C@H](CC#N)c2ccccc2)C1	ZINC000476096711	331654846	/nfs/dbraw/zinc/65/48/46/331654846.db2.gz	XCNSNVQZGSVEJC-BPQIPLTHSA-N	0	0	298.430	4.159	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](C)Oc2c(Cl)cccc21	ZINC000476116284	331655386	/nfs/dbraw/zinc/65/53/86/331655386.db2.gz	ZRGXGVXVDLQWKB-VXGBXAGGSA-N	0	0	293.794	4.056	20	30		CIEDRN
C=CCCC(=O)Nc1cc(Cl)cc(C(F)(F)F)c1	ZINC000476286889	331660073	/nfs/dbraw/zinc/66/00/73/331660073.db2.gz	MINYFZKGBTXNAH-UHFFFAOYSA-N	0	0	277.673	4.264	20	30		CIEDRN
C=CCCC1(C(=O)NC2CCC(C(C)C)CC2)CC1	ZINC000476316068	331661409	/nfs/dbraw/zinc/66/14/09/331661409.db2.gz	AKXCGYSEUPIMFV-UHFFFAOYSA-N	0	0	263.425	4.064	20	30		CIEDRN
C=CCCC1(C(=O)N2CCC[C@H](CC(C)C)C2)CC1	ZINC000476336723	331661808	/nfs/dbraw/zinc/66/18/08/331661808.db2.gz	WBXDKGVRHZISBV-OAHLLOKOSA-N	0	0	263.425	4.018	20	30		CIEDRN
CCC1(CNC(=O)C[C@@H](CC#N)c2ccccc2)CCCC1	ZINC000476336183	331661859	/nfs/dbraw/zinc/66/18/59/331661859.db2.gz	NAAKPAYNYQZAMP-QGZVFWFLSA-N	0	0	298.430	4.161	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(C)c(-c3ncco3)c2)CC1	ZINC000476353438	331662445	/nfs/dbraw/zinc/66/24/45/331662445.db2.gz	AGEUAMNRFYDZGB-UHFFFAOYSA-N	0	0	296.370	4.335	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cc(Cl)cc(C)c2O)CC1	ZINC000476450914	331664214	/nfs/dbraw/zinc/66/42/14/331664214.db2.gz	HNGSXXYTDDXWQM-UHFFFAOYSA-N	0	0	279.767	4.039	20	30		CIEDRN
Cc1ccc(C[C@H](C#N)Sc2ncc(C(C)C)n2C)cc1	ZINC000476548146	331666199	/nfs/dbraw/zinc/66/61/99/331666199.db2.gz	QVMLHOHWXIVWBV-OAHLLOKOSA-N	0	0	299.443	4.079	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cc(C)c(O)c(C)c2C)CC1	ZINC000476768613	331669700	/nfs/dbraw/zinc/66/97/00/331669700.db2.gz	WCQFQOOYDFIXPB-UHFFFAOYSA-N	0	0	273.376	4.002	20	30		CIEDRN
C=C(C)CS[C@@H](C)C(=O)N[C@@H](CCC)c1ccccc1	ZINC000477023385	331672920	/nfs/dbraw/zinc/67/29/20/331672920.db2.gz	XASZASKEYPIATG-HOCLYGCPSA-N	0	0	291.460	4.342	20	30		CIEDRN
N#Cc1ccncc1N[C@H]1CC=C(c2ccc(F)cc2)CC1	ZINC000477037408	331673657	/nfs/dbraw/zinc/67/36/57/331673657.db2.gz	ZEPRJDZXKXATTD-KRWDZBQOSA-N	0	0	293.345	4.140	20	30		CIEDRN
Cc1cc(Cl)cc(C(=O)N[C@H](C)c2ccc(C#N)cc2)c1	ZINC000477334436	331682009	/nfs/dbraw/zinc/68/20/09/331682009.db2.gz	WOGBBVFTYWJURY-GFCCVEGCSA-N	0	0	298.773	4.011	20	30		CIEDRN
C=CCCOCCCCC(=O)NCC1(C)CCC(C)CC1	ZINC000477351590	331682511	/nfs/dbraw/zinc/68/25/11/331682511.db2.gz	PHKLMBOPXKUFQW-UHFFFAOYSA-N	0	0	295.467	4.082	20	30		CIEDRN
C=CCC1(C(=O)NCC(CC)(CC)CC)CCC1	ZINC000477836661	331691348	/nfs/dbraw/zinc/69/13/48/331691348.db2.gz	XFUZQELPYAOMCN-UHFFFAOYSA-N	0	0	251.414	4.065	20	30		CIEDRN
C=CCC[C@@H](Nc1cnn([C@@H](C)CC)c1C)C1CC1	ZINC000477920440	331693751	/nfs/dbraw/zinc/69/37/51/331693751.db2.gz	YTLJVGBYLLWEJG-SWLSCSKDSA-N	0	0	261.413	4.319	20	30		CIEDRN
C=C[C@@H](CC(=O)N(CC)[C@@H](C)C(F)(F)F)c1ccccc1	ZINC000477944913	331695285	/nfs/dbraw/zinc/69/52/85/331695285.db2.gz	CWGGCOLUBZHDRA-STQMWFEESA-N	0	0	299.336	4.146	20	30		CIEDRN
N#Cc1cc(Cl)ccc1CNc1cccc(F)c1F	ZINC000478391347	331705214	/nfs/dbraw/zinc/70/52/14/331705214.db2.gz	QYGAMLURKYYOFV-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C=CCCOCCCCC(=O)N1CCC[C@@H](C(C)(C)C)C1	ZINC000478443314	331706280	/nfs/dbraw/zinc/70/62/80/331706280.db2.gz	DBWWADSWCNTFSA-MRXNPFEDSA-N	0	0	295.467	4.034	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@H]1C[C@H](c2ccc(Cl)cc2)C1	ZINC000478545950	331708220	/nfs/dbraw/zinc/70/82/20/331708220.db2.gz	XVSBHNDNHVBJFZ-QRTARXTBSA-N	0	0	291.822	4.305	20	30		CIEDRN
CC(C)(C#N)CCCCSCCC(F)(F)F	ZINC000478756666	331713429	/nfs/dbraw/zinc/71/34/29/331713429.db2.gz	QXDUBHBWCMHFGM-UHFFFAOYSA-N	0	0	253.333	4.392	20	30		CIEDRN
Cc1cc(CN(C#N)c2cccc(Cl)c2)ccc1C#N	ZINC000478765144	331713717	/nfs/dbraw/zinc/71/37/17/331713717.db2.gz	ZANUNHKJBOMAEO-UHFFFAOYSA-N	0	0	281.746	4.008	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)c1cc2c(cc(Cl)cc2Cl)[nH]1	ZINC000479089414	331720068	/nfs/dbraw/zinc/72/00/68/331720068.db2.gz	KFJLOPXAQCKBSJ-MRVPVSSYSA-N	0	0	297.185	4.169	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1cc(C(C)C)cc(C(C)C)c1O	ZINC000479211131	331721987	/nfs/dbraw/zinc/72/19/87/331721987.db2.gz	FGMACGFBAPGQRO-UHFFFAOYSA-N	0	0	289.419	4.287	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1ccccc1SCC=C(C)C	ZINC000479224704	331722322	/nfs/dbraw/zinc/72/23/22/331722322.db2.gz	YIPWORMMDFLBSN-UHFFFAOYSA-N	0	0	289.444	4.393	20	30		CIEDRN
CC(C)Oc1cc(F)ccc1OCc1cccc(C#N)c1	ZINC000479406513	331726889	/nfs/dbraw/zinc/72/68/89/331726889.db2.gz	BPOFOQHLVYTXNG-UHFFFAOYSA-N	0	0	285.318	4.064	20	30		CIEDRN
C=CCc1ccc(OCc2ccc(C#N)c(F)c2)c(OC)c1	ZINC000479402690	331727411	/nfs/dbraw/zinc/72/74/11/331727411.db2.gz	RQDZGEWNSUWSJG-UHFFFAOYSA-N	0	0	297.329	4.013	20	30		CIEDRN
C[C@@H](CC1CCCCC1)C(=O)N(CCC#N)CC(C)(C)C	ZINC000511146559	332928144	/nfs/dbraw/zinc/92/81/44/332928144.db2.gz	YDDNEEMJYUVDBC-HNNXBMFYSA-N	0	0	292.467	4.381	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000479508362	331733852	/nfs/dbraw/zinc/73/38/52/331733852.db2.gz	ZXNKFQWUNMLIGG-IBGZPJMESA-N	0	0	293.410	4.443	20	30		CIEDRN
N#CCCCSCCCc1ccccc1Br	ZINC000479547786	331736775	/nfs/dbraw/zinc/73/67/75/331736775.db2.gz	XYFNBSSWHOLELC-UHFFFAOYSA-N	0	0	298.249	4.419	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(OCCCC)cc1C	ZINC000479568978	331738068	/nfs/dbraw/zinc/73/80/68/331738068.db2.gz	RBUOUIJKOZKSJP-UHFFFAOYSA-N	0	0	275.392	4.469	20	30		CIEDRN
C=CCCCC(=O)N[C@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000479571428	331738174	/nfs/dbraw/zinc/73/81/74/331738174.db2.gz	SZIUGBRSWNVOGZ-JSGCOSHPSA-N	0	0	297.320	4.034	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@@H](CCC)C(C)C	ZINC000479589781	331739250	/nfs/dbraw/zinc/73/92/50/331739250.db2.gz	AIIOKDPCKLBRAB-HNNXBMFYSA-N	0	0	279.449	4.335	20	30		CIEDRN
C[C@@H](SCCCCC(C)(C)C#N)C(=O)OC(C)(C)C	ZINC000479708851	331744006	/nfs/dbraw/zinc/74/40/06/331744006.db2.gz	DPHRFNJZSRMUJC-GFCCVEGCSA-N	0	0	285.453	4.170	20	30		CIEDRN
COc1cc(N[C@@H](C#N)C2CCCCC2)c(C)cc1C	ZINC000479836788	331747024	/nfs/dbraw/zinc/74/70/24/331747024.db2.gz	CFSDGSLATNGZDK-INIZCTEOSA-N	0	0	272.392	4.196	20	30		CIEDRN
Cc1cccc2nc(Oc3ccc(C#N)cc3)sc21	ZINC000479867455	331749814	/nfs/dbraw/zinc/74/98/14/331749814.db2.gz	VFXOUUMFTOZQCR-UHFFFAOYSA-N	0	0	266.325	4.269	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H](C)c2cc(C)cc(C)c2)CCC1	ZINC000480174444	331761596	/nfs/dbraw/zinc/76/15/96/331761596.db2.gz	ZAYGDSPGWVNXNU-HNNXBMFYSA-N	0	0	271.404	4.227	20	30		CIEDRN
C[C@@H](NC(=O)c1cccc(CC#N)c1)[C@H](C)C1CCCCC1	ZINC000480354013	331769230	/nfs/dbraw/zinc/76/92/30/331769230.db2.gz	GKORIZBMPLTYBF-LSDHHAIUSA-N	0	0	298.430	4.087	20	30		CIEDRN
C=CCC1(C(=O)NCC(C)(C)C2=CCCCC2)CCC1	ZINC000480412737	331772037	/nfs/dbraw/zinc/77/20/37/331772037.db2.gz	OSJFYWVEDCRONB-UHFFFAOYSA-N	0	0	275.436	4.376	20	30		CIEDRN
C=CCC1(C(=O)N2CC(C)(C)CC(C)(C)C2)CCC1	ZINC000480426340	331772494	/nfs/dbraw/zinc/77/24/94/331772494.db2.gz	QFZAYFCQLLUERE-UHFFFAOYSA-N	0	0	263.425	4.018	20	30		CIEDRN
C=CCOc1ccc(CNc2cnn([C@H](C)CC)c2C)cc1	ZINC000480455507	331773273	/nfs/dbraw/zinc/77/32/73/331773273.db2.gz	UTGYZZUPHFXAEN-CQSZACIVSA-N	0	0	299.418	4.339	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](c1ccc(F)cc1)C(C)(C)C	ZINC000480737577	331786486	/nfs/dbraw/zinc/78/64/86/331786486.db2.gz	PEADAJWVZFKNNF-INIZCTEOSA-N	0	0	277.383	4.385	20	30		CIEDRN
C=C(C)CN(CC)C(=O)C[C@H](C)C1CCCCC1	ZINC000511441671	332932316	/nfs/dbraw/zinc/93/23/16/332932316.db2.gz	DPMPQUHHBQUXPA-AWEZNQCLSA-N	0	0	251.414	4.018	20	30		CIEDRN
Cc1ccnc(N[C@@H]2CCCCc3cc(C#N)ccc32)c1	ZINC000481671115	331811462	/nfs/dbraw/zinc/81/14/62/331811462.db2.gz	PFXJJBBGLLKARZ-QGZVFWFLSA-N	0	0	277.371	4.141	20	30		CIEDRN
Cc1ccccc1[C@H](CC(C)C)NC(=O)C1(C#N)CCCC1	ZINC000303434265	332930499	/nfs/dbraw/zinc/93/04/99/332930499.db2.gz	FRZGNRVKVGOOEF-KRWDZBQOSA-N	0	0	298.430	4.282	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H]1CC(C)(C)c2ccccc21	ZINC000482731449	331844970	/nfs/dbraw/zinc/84/49/70/331844970.db2.gz	IXTSFNWNWLWJHE-HNNXBMFYSA-N	0	0	271.404	4.128	20	30		CIEDRN
CCOc1ccc(CNc2ccc(Cl)cc2C#N)cc1	ZINC000511379957	332931114	/nfs/dbraw/zinc/93/11/14/332931114.db2.gz	GFDYPHMLMKLCPQ-UHFFFAOYSA-N	0	0	286.762	4.222	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)c1ccccc1F	ZINC000482792654	331846597	/nfs/dbraw/zinc/84/65/97/331846597.db2.gz	KJUKSJLZCXFNLA-UHFFFAOYSA-N	0	0	275.367	4.034	20	30		CIEDRN
CCS[C@@H]1CCCCN(c2ccc(Cl)cc2C#N)C1	ZINC000303457650	332931338	/nfs/dbraw/zinc/93/13/38/332931338.db2.gz	MYEAHFSXOZRGLG-CQSZACIVSA-N	0	0	294.851	4.324	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cc(Cl)ccc2F)CC1	ZINC000483102684	331857757	/nfs/dbraw/zinc/85/77/57/331857757.db2.gz	XKNUPBFUTANMES-UHFFFAOYSA-N	0	0	267.731	4.164	20	30		CIEDRN
C=CCCC1(C(=O)N2CCc3sccc3[C@@H]2CC)CC1	ZINC000483291513	331867279	/nfs/dbraw/zinc/86/72/79/331867279.db2.gz	AANIDDUTUVNORH-AWEZNQCLSA-N	0	0	289.444	4.330	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)[C@H]2CCCC[C@H]2CC)s1	ZINC000483345345	331870508	/nfs/dbraw/zinc/87/05/08/331870508.db2.gz	SCWLYSXLYVXBSJ-RISCZKNCSA-N	0	0	290.432	4.337	20	30		CIEDRN
CCCN(CC#N)Cc1c(OC(C)C)ccc2ccccc21	ZINC000511458011	332932501	/nfs/dbraw/zinc/93/25/01/332932501.db2.gz	FZAGWIMOKNBKSJ-UHFFFAOYSA-N	0	0	296.414	4.363	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(Cl)cc2OCC)CC1	ZINC000483853025	331886927	/nfs/dbraw/zinc/88/69/27/331886927.db2.gz	NEKVIBMJJJJQAP-UHFFFAOYSA-N	0	0	293.794	4.424	20	30		CIEDRN
Cc1sc(NC(=O)[C@@H]2CCCC2(C)C)c(C#N)c1C	ZINC000483919648	331889105	/nfs/dbraw/zinc/88/91/05/331889105.db2.gz	YATLCPVVXDUDIV-LBPRGKRZSA-N	0	0	276.405	4.001	20	30		CIEDRN
C[C@H](CC(C)(C)C)C(=O)Nc1cc(C#N)cn1C(C)(C)C	ZINC000484064192	331892011	/nfs/dbraw/zinc/89/20/11/331892011.db2.gz	GFYIBRXJIIVCKD-GFCCVEGCSA-N	0	0	289.423	4.126	20	30		CIEDRN
CCC[C@H](C(=O)Nc1sc2c(c1C#N)CCC2)C(C)C	ZINC000484670419	331903774	/nfs/dbraw/zinc/90/37/74/331903774.db2.gz	QQIXWDWLROYTEN-NSHDSACASA-N	0	0	290.432	4.119	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1c(F)cccc1SCC	ZINC000484928622	331907652	/nfs/dbraw/zinc/90/76/52/331907652.db2.gz	RUCPFZROZDTYEB-NSHDSACASA-N	0	0	281.396	4.479	20	30		CIEDRN
C=CCCCCNC(=O)c1ccccc1SCC=C	ZINC000485465468	331914915	/nfs/dbraw/zinc/91/49/15/331914915.db2.gz	KGKSFRHIRGWQSC-UHFFFAOYSA-N	0	0	275.417	4.051	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N[C@H](C)CCC1CC1	ZINC000485474253	331915143	/nfs/dbraw/zinc/91/51/43/331915143.db2.gz	BRBQJQSFYSZEAR-CYBMUJFWSA-N	0	0	289.444	4.273	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N[C@@H]1CCCC[C@H]1C	ZINC000485481470	331915268	/nfs/dbraw/zinc/91/52/68/331915268.db2.gz	UGSCTQBDEOMUOU-UKRRQHHQSA-N	0	0	289.444	4.273	20	30		CIEDRN
C=CCCCCCSCc1nc(CCC)no1	ZINC000485576601	331917624	/nfs/dbraw/zinc/91/76/24/331917624.db2.gz	QZRLYNAMAWGMEQ-UHFFFAOYSA-N	0	0	254.399	4.002	20	30		CIEDRN
C[C@H]1C[C@@H](CSCCCCC(C)(C)C#N)CCO1	ZINC000485575772	331917678	/nfs/dbraw/zinc/91/76/78/331917678.db2.gz	YAPGPYMEHMKGDH-KBPBESRZSA-N	0	0	269.454	4.255	20	30		CIEDRN
N#Cc1cccnc1/C=C\c1csc(-c2ccsc2)n1	ZINC000485977490	331928339	/nfs/dbraw/zinc/92/83/39/331928339.db2.gz	APIRDWJELLMFEG-ARJAWSKDSA-N	0	0	295.392	4.309	20	30		CIEDRN
Cc1cc(C)cc(/C=C\c2nc3ccccc3n2CC#N)c1	ZINC000485976965	331928373	/nfs/dbraw/zinc/92/83/73/331928373.db2.gz	LOGIGOKLTSDGRK-FPLPWBNLSA-N	0	0	287.366	4.347	20	30		CIEDRN
N#Cc1cccnc1/C=C/c1cccc(OC2CCCC2)c1	ZINC000485979140	331928397	/nfs/dbraw/zinc/92/83/97/331928397.db2.gz	DEFQZRRGMJQYIH-ZHACJKMWSA-N	0	0	290.366	4.445	20	30		CIEDRN
N#Cc1cccc(CNc2csc3ccccc23)c1	ZINC000486032300	331929670	/nfs/dbraw/zinc/92/96/70/331929670.db2.gz	USUFNKHZOVBCDQ-UHFFFAOYSA-N	0	0	264.353	4.385	20	30		CIEDRN
Cc1cc(/C=C/c2ncccc2C#N)ccc1Br	ZINC000486078304	331930926	/nfs/dbraw/zinc/93/09/26/331930926.db2.gz	PWMSYOLVOHYKRJ-FNORWQNLSA-N	0	0	299.171	4.195	20	30		CIEDRN
N#Cc1ccc(CNc2ccc(C(=O)C3CCC3)cc2)cc1	ZINC000486194503	331933216	/nfs/dbraw/zinc/93/32/16/331933216.db2.gz	NXJDOLGMOICSOH-UHFFFAOYSA-N	0	0	290.366	4.153	20	30		CIEDRN
CCN(C(=O)CC(C)(C)C#N)[C@H](C)c1cc2ccccc2o1	ZINC000486296005	331934352	/nfs/dbraw/zinc/93/43/52/331934352.db2.gz	XFZKQMJHAXMSBF-CYBMUJFWSA-N	0	0	298.386	4.282	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N(C)Cc1ccc(F)cc1C	ZINC000486487211	331938352	/nfs/dbraw/zinc/93/83/52/331938352.db2.gz	LQYCDVANNLMKIJ-AWEZNQCLSA-N	0	0	292.398	4.020	20	30		CIEDRN
Cc1c(Cl)cc(NC(=O)CC(C)(C)C#N)cc1Cl	ZINC000486538497	331939233	/nfs/dbraw/zinc/93/92/33/331939233.db2.gz	MBYSBARRDHDLJI-UHFFFAOYSA-N	0	0	285.174	4.180	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1cccc2c1CCCC2	ZINC000486753727	331943738	/nfs/dbraw/zinc/94/37/38/331943738.db2.gz	NMTRVDBRYMQMET-OAHLLOKOSA-N	0	0	284.403	4.138	20	30		CIEDRN
CC(C)(C#N)c1ccccc1COc1cc(F)cc(F)c1	ZINC000486894859	331948576	/nfs/dbraw/zinc/94/85/76/331948576.db2.gz	GMJPLIZHPIHWPD-UHFFFAOYSA-N	0	0	287.309	4.345	20	30		CIEDRN
CC(C)(C)[C@H]1C[C@H](Nc2cc(Cl)ccc2C#N)CCO1	ZINC000487070194	331955989	/nfs/dbraw/zinc/95/59/89/331955989.db2.gz	CCCJMSGORZFMRY-UKRRQHHQSA-N	0	0	292.810	4.217	20	30		CIEDRN
N#Cc1cccc(N[C@H]2CCC[C@@H](c3ccccc3)C2)n1	ZINC000487135451	331957007	/nfs/dbraw/zinc/95/70/07/331957007.db2.gz	INVICDQXVHAPFO-CVEARBPZSA-N	0	0	277.371	4.092	20	30		CIEDRN
COc1ccc(CS[C@H]2CC[C@H](C#N)C2)cc1Cl	ZINC000487176078	331958273	/nfs/dbraw/zinc/95/82/73/331958273.db2.gz	LCQRBBNTJKZNEM-JQWIXIFHSA-N	0	0	281.808	4.274	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)c2ccc(C)cc2F)c1	ZINC000487306072	331964751	/nfs/dbraw/zinc/96/47/51/331964751.db2.gz	GQQRDDORIBIDHR-UHFFFAOYSA-N	0	0	299.345	4.341	20	30		CIEDRN
C=CCC[C@@H](C(=O)NCc1ccccc1)c1ccccc1	ZINC000487584201	331976333	/nfs/dbraw/zinc/97/63/33/331976333.db2.gz	QNSMIGCMTJBNFY-GOSISDBHSA-N	0	0	279.383	4.053	20	30		CIEDRN
C=CC[C@H](C(=O)N(CC)Cc1ccccc1)c1ccccc1	ZINC000487593966	331976413	/nfs/dbraw/zinc/97/64/13/331976413.db2.gz	FWRGKUHEYSXPJM-IBGZPJMESA-N	0	0	293.410	4.395	20	30		CIEDRN
C=CCC[C@@H](C(=O)N1CCCC[C@H]1C)c1ccccc1	ZINC000487611065	331977171	/nfs/dbraw/zinc/97/71/71/331977171.db2.gz	XKRPWMZLGNJPKS-NVXWUHKLSA-N	0	0	271.404	4.137	20	30		CIEDRN
Cc1nc(N2C[C@H](C)CC[C@@H]2c2ccccc2)ccc1C#N	ZINC000487747441	331980497	/nfs/dbraw/zinc/98/04/97/331980497.db2.gz	FGBPJIHIGGDFSK-RDTXWAMCSA-N	0	0	291.398	4.239	20	30		CIEDRN
Cc1nc(N[C@@H](C)c2cc3ccccc3s2)ccc1C#N	ZINC000487760560	331980855	/nfs/dbraw/zinc/98/08/55/331980855.db2.gz	JMDOQQKRYHTXMC-LBPRGKRZSA-N	0	0	293.395	4.071	20	30		CIEDRN
Cc1nc(N[C@@H](C)c2ccc3ccccc3c2)ccc1C#N	ZINC000487907548	331983744	/nfs/dbraw/zinc/98/37/44/331983744.db2.gz	KVPHCPZDLDBHLX-ZDUSSCGKSA-N	0	0	287.366	4.010	20	30		CIEDRN
Cc1ccc([C@@H]2CCCCN2c2ccc(C#N)c(C)n2)cc1	ZINC000488130640	331991479	/nfs/dbraw/zinc/99/14/79/331991479.db2.gz	WLHAGSAAFNGMOX-SFHVURJKSA-N	0	0	291.398	4.302	20	30		CIEDRN
C=CCCCC(=O)Nc1cc(Cl)ccc1NCCC	ZINC000488152813	331992211	/nfs/dbraw/zinc/99/22/11/331992211.db2.gz	UUCCFIZORSUREJ-UHFFFAOYSA-N	0	0	280.799	4.457	20	30		CIEDRN
N#Cc1c(F)cccc1CSc1nc2ccccc2o1	ZINC000488233311	331995070	/nfs/dbraw/zinc/99/50/70/331995070.db2.gz	PJLRHIMVXKXOTK-UHFFFAOYSA-N	0	0	284.315	4.131	20	30		CIEDRN
CC[C@H](CC1CCCCC1)C(=O)NCc1ccc(C#N)cc1	ZINC000303589623	332940279	/nfs/dbraw/zinc/94/02/79/332940279.db2.gz	UPTHGIYVXPEQTH-GOSISDBHSA-N	0	0	298.430	4.171	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@H]1CC[C@H](C)CC1)c1ccccc1	ZINC000488337232	332000655	/nfs/dbraw/zinc/00/06/55/332000655.db2.gz	RRLLWEPGJCYYIL-XIRDDKMYSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1ccc(OC(C)C)cc1	ZINC000488351309	332001403	/nfs/dbraw/zinc/00/14/03/332001403.db2.gz	HAFKSVWEGJSMAQ-HNNXBMFYSA-N	0	0	288.391	4.046	20	30		CIEDRN
N#Cc1cccc(C#N)c1NCc1ccc(C2CC2)cc1F	ZINC000488502247	332014050	/nfs/dbraw/zinc/01/40/50/332014050.db2.gz	SEZXFQJNWNBTJV-UHFFFAOYSA-N	0	0	291.329	4.059	20	30		CIEDRN
C=CCC[C@H](NC(=O)N1CC[C@@H]2CCC[C@H]21)c1ccccc1	ZINC000488520776	332015383	/nfs/dbraw/zinc/01/53/83/332015383.db2.gz	TVDKCHWZGFMAET-OKZBNKHCSA-N	0	0	298.430	4.278	20	30		CIEDRN
CC[C@@H](CC1CCCCC1)C(=O)N[C@@](C)(C#N)C(C)C	ZINC000488690883	332021593	/nfs/dbraw/zinc/02/15/93/332021593.db2.gz	GDQIVJLOKSNJSK-RDJZCZTQSA-N	0	0	278.440	4.037	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)C[C@@H]1C=CCCC1	ZINC000488702087	332021869	/nfs/dbraw/zinc/02/18/69/332021869.db2.gz	LUODUISIAFAJAD-OAHLLOKOSA-N	0	0	287.378	4.087	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@H](C)c1cc(C)oc1C)c1ccccc1	ZINC000488707358	332022093	/nfs/dbraw/zinc/02/20/93/332022093.db2.gz	WWHAKZGFPIUCBK-RHSMWYFYSA-N	0	0	297.398	4.434	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1cccc(F)c1F)c1ccccc1	ZINC000488710615	332022294	/nfs/dbraw/zinc/02/22/94/332022294.db2.gz	FPWNOBHDRSXTSA-CYBMUJFWSA-N	0	0	287.309	4.263	20	30		CIEDRN
N#Cc1ccc(N[C@@H]2CCCc3sc(Cl)cc32)cn1	ZINC000488763182	332024425	/nfs/dbraw/zinc/02/44/25/332024425.db2.gz	QGDDTOORWPBKBG-GFCCVEGCSA-N	0	0	289.791	4.158	20	30		CIEDRN
C=C(C)CN(C)C(=O)C[C@@H]1C[C@H](C)c2c1cccc2C	ZINC000488782560	332025407	/nfs/dbraw/zinc/02/54/07/332025407.db2.gz	LJXINDBWYZUWSR-GJZGRUSLSA-N	0	0	271.404	4.010	20	30		CIEDRN
C=C(C)CN(C)C(=O)C[C@@H]1C[C@@H](C)c2c1cccc2C	ZINC000488782559	332025506	/nfs/dbraw/zinc/02/55/06/332025506.db2.gz	LJXINDBWYZUWSR-CABCVRRESA-N	0	0	271.404	4.010	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1ccccc1CSC	ZINC000488781681	332025537	/nfs/dbraw/zinc/02/55/37/332025537.db2.gz	JUFGVQSTSVNNRA-AWEZNQCLSA-N	0	0	290.432	4.122	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@@H](C)CCC(C)(C)C	ZINC000488817033	332025850	/nfs/dbraw/zinc/02/58/50/332025850.db2.gz	DIEXMNRRFBHHCK-UONOGXRCSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=CCN(C(=O)C[C@@H]1C[C@@H](C)c2c1cccc2C)C1CC1	ZINC000488812043	332026744	/nfs/dbraw/zinc/02/67/44/332026744.db2.gz	DICOOSWUOOOGOK-CABCVRRESA-N	0	0	283.415	4.153	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1ccc(-c2cccs2)o1	ZINC000488817425	332027100	/nfs/dbraw/zinc/02/71/00/332027100.db2.gz	OUGLTRRUOGUTEV-GFCCVEGCSA-N	0	0	287.384	4.189	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)C[C@@H](C)c1ccc(F)cc1F	ZINC000488822183	332027362	/nfs/dbraw/zinc/02/73/62/332027362.db2.gz	WCTPUNRHQDHXKN-TZMCWYRMSA-N	0	0	293.357	4.026	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1ccc(CSCC)cc1	ZINC000488829275	332027820	/nfs/dbraw/zinc/02/78/20/332027820.db2.gz	CVBIJHULKDVNJS-MRXNPFEDSA-N	0	0	289.444	4.120	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1cc2cc(C)ccc2nc1C	ZINC000488844014	332028791	/nfs/dbraw/zinc/02/87/91/332028791.db2.gz	WCRWLSBQJJKNSC-INIZCTEOSA-N	0	0	294.398	4.032	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1cc2ccccc2n1CCC	ZINC000488842282	332028795	/nfs/dbraw/zinc/02/87/95/332028795.db2.gz	QWCUQEKYAMOMSG-MRXNPFEDSA-N	0	0	296.414	4.232	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1ccc(-c2ccc(F)cc2)o1	ZINC000488855377	332029591	/nfs/dbraw/zinc/02/95/91/332029591.db2.gz	OLUVQZIKHHKFQE-OAHLLOKOSA-N	0	0	299.345	4.266	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1csc2c1CC[C@@H](C)C2	ZINC000488854700	332029700	/nfs/dbraw/zinc/02/97/00/332029700.db2.gz	NQXCNFUDAQHTPR-OLZOCXBDSA-N	0	0	289.444	4.054	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1	ZINC000488873045	332030777	/nfs/dbraw/zinc/03/07/77/332030777.db2.gz	ATSCNWWNORLJBI-OAGGEKHMSA-N	0	0	289.806	4.011	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1cccc(-c2ccoc2)c1	ZINC000488876707	332031193	/nfs/dbraw/zinc/03/11/93/332031193.db2.gz	JFRASJBQAUBMQU-KRWDZBQOSA-N	0	0	281.355	4.127	20	30		CIEDRN
C=CC[C@H](C)NC(=O)C[C@H]1C[C@@H](C)c2c1cccc2C	ZINC000488930010	332034175	/nfs/dbraw/zinc/03/41/75/332034175.db2.gz	DWGDDLZCSIUPHS-QLFBSQMISA-N	0	0	271.404	4.057	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@@H](C)C[C@@H](C)CC)c1ccccc1	ZINC000488982021	332036534	/nfs/dbraw/zinc/03/65/34/332036534.db2.gz	NGNUFQHTAVYNDC-ZOBUZTSGSA-N	0	0	273.420	4.287	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@@H]1CC[C@@H]2CCC[C@@H]2C1)c1ccccc1	ZINC000488995227	332037130	/nfs/dbraw/zinc/03/71/30/332037130.db2.gz	HUUAJZYKXGPHFG-AITUJVMLSA-N	0	0	297.442	4.431	20	30		CIEDRN
C[C@@H](c1cccc(C#N)c1)N(C)Cc1ccc(F)cc1F	ZINC000489095681	332041296	/nfs/dbraw/zinc/04/12/96/332041296.db2.gz	DCJFJRHZHVGJLM-LBPRGKRZSA-N	0	0	286.325	4.029	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@H]1CCCCC	ZINC000489290166	332045487	/nfs/dbraw/zinc/04/54/87/332045487.db2.gz	ASQIKFXJLYMYRN-MRXNPFEDSA-N	0	0	263.425	4.326	20	30		CIEDRN
C=C[C@H]1CCCCN1Cc1ncc(-c2ccc(C)cc2)o1	ZINC000489423051	332051058	/nfs/dbraw/zinc/05/10/58/332051058.db2.gz	HBADHXOWKFXFQV-INIZCTEOSA-N	0	0	282.387	4.191	20	30		CIEDRN
N#Cc1c(F)cccc1C(=O)Nc1csc2ccccc12	ZINC000489453239	332053463	/nfs/dbraw/zinc/05/34/63/332053463.db2.gz	WZGQZRUOSRYLGZ-UHFFFAOYSA-N	0	0	296.326	4.164	20	30		CIEDRN
C=C[C@H]1CCCCN1Cc1ncc(-c2cccc(F)c2)o1	ZINC000489460429	332053894	/nfs/dbraw/zinc/05/38/94/332053894.db2.gz	UWVYUUBKJGQFTI-HNNXBMFYSA-N	0	0	286.350	4.021	20	30		CIEDRN
CCc1cccc(NC(=O)c2ccc(C#N)cc2C)c1CC	ZINC000489491403	332055969	/nfs/dbraw/zinc/05/59/69/332055969.db2.gz	OVEGZLHWGNLSDM-UHFFFAOYSA-N	0	0	292.382	4.244	20	30		CIEDRN
C=C[C@@H]1CCCCN1Cc1coc(-c2ccc(C)cc2)n1	ZINC000489488748	332056007	/nfs/dbraw/zinc/05/60/07/332056007.db2.gz	UNEKKILOYKXXIQ-QGZVFWFLSA-N	0	0	282.387	4.191	20	30		CIEDRN
C=CCN(Cc1ccccc1F)Cc1ccc(F)cc1C#N	ZINC000489593625	332060700	/nfs/dbraw/zinc/06/07/00/332060700.db2.gz	DOIWIRADUCBTCB-UHFFFAOYSA-N	0	0	298.336	4.025	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@@H]1CC12CCCCC2)c1ccccc1	ZINC000489595489	332060788	/nfs/dbraw/zinc/06/07/88/332060788.db2.gz	ZCFVHMOSRKMISN-IAGOWNOFSA-N	0	0	283.415	4.185	20	30		CIEDRN
N#Cc1cc(F)ccc1CN(Cc1ccco1)C1CCCC1	ZINC000489632705	332062275	/nfs/dbraw/zinc/06/22/75/332062275.db2.gz	IGVZUHSPOVYXOU-UHFFFAOYSA-N	0	0	298.361	4.235	20	30		CIEDRN
C=CCC[C@@H](C(=O)Nc1cncc(C)c1)c1ccccc1	ZINC000489663883	332063860	/nfs/dbraw/zinc/06/38/60/332063860.db2.gz	IUFVHGKCZSACDF-QGZVFWFLSA-N	0	0	280.371	4.079	20	30		CIEDRN
C=CC[C@H](C(=O)N1Cc2ccccc2[C@@H]1C)c1ccccc1	ZINC000489683286	332064652	/nfs/dbraw/zinc/06/46/52/332064652.db2.gz	QQGKCPCXLRUIPB-KXBFYZLASA-N	0	0	291.394	4.450	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(C(=O)C3CCC3)cc2)CCC1	ZINC000489687212	332064894	/nfs/dbraw/zinc/06/48/94/332064894.db2.gz	FHBXLRNGRDXAKM-UHFFFAOYSA-N	0	0	297.398	4.354	20	30		CIEDRN
C=CCC[C@@H](C(=O)Nc1ccc(C)nc1C)c1ccccc1	ZINC000489694682	332065054	/nfs/dbraw/zinc/06/50/54/332065054.db2.gz	BOBFIEKJSREGLC-QGZVFWFLSA-N	0	0	294.398	4.387	20	30		CIEDRN
C=CCC[C@H](C(=O)N[C@@H](C)CC(C)C)c1ccccc1	ZINC000489696007	332065291	/nfs/dbraw/zinc/06/52/91/332065291.db2.gz	IERFCNPMEHXBLQ-RDJZCZTQSA-N	0	0	273.420	4.287	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccc(C2CCC2)cc1	ZINC000489780874	332067647	/nfs/dbraw/zinc/06/76/47/332067647.db2.gz	RBZMGYZTHMMCDL-UHFFFAOYSA-N	0	0	272.392	4.384	20	30		CIEDRN
C=CCOc1ccc(-c2nnc(S[C@H](C)CC)o2)cc1	ZINC000489794666	332068005	/nfs/dbraw/zinc/06/80/05/332068005.db2.gz	UIQFYUFKXOYRAJ-LLVKDONJSA-N	0	0	290.388	4.192	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)CCCc1cc(C)sc1C	ZINC000489821733	332068984	/nfs/dbraw/zinc/06/89/84/332068984.db2.gz	ACRVKAJHCVUWTN-UHFFFAOYSA-N	0	0	293.476	4.406	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@H](C)Cc1ccc(Cl)cc1	ZINC000489879751	332071367	/nfs/dbraw/zinc/07/13/67/332071367.db2.gz	CHYNBDWZTWCMFR-CYBMUJFWSA-N	0	0	293.838	4.237	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1occc1-c1ccccc1	ZINC000489883688	332071696	/nfs/dbraw/zinc/07/16/96/332071696.db2.gz	JXNVKFYHLMZJPL-UHFFFAOYSA-N	0	0	283.371	4.279	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)C1(Cc2ccccc2)CCC1	ZINC000489885265	332071741	/nfs/dbraw/zinc/07/17/41/332071741.db2.gz	NIOWTROQRPMSCK-UHFFFAOYSA-N	0	0	285.431	4.118	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)C1(c2cccc(Cl)c2)CC1	ZINC000489904433	332072650	/nfs/dbraw/zinc/07/26/50/332072650.db2.gz	BNYWZKMQATZCRM-UHFFFAOYSA-N	0	0	291.822	4.090	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1cc2cc(Cl)sc2[nH]1	ZINC000489911508	332072793	/nfs/dbraw/zinc/07/27/93/332072793.db2.gz	SXUVGOVUSGWTIC-UHFFFAOYSA-N	0	0	296.823	4.215	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1cc(SC)ccc1C	ZINC000489981387	332075505	/nfs/dbraw/zinc/07/55/05/332075505.db2.gz	UTHDBQKZHXTDRT-UHFFFAOYSA-N	0	0	277.433	4.049	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)C[C@@H](CC)c1ccccc1	ZINC000490007290	332076311	/nfs/dbraw/zinc/07/63/11/332076311.db2.gz	UWCVUCCOADOXTK-OAHLLOKOSA-N	0	0	273.420	4.289	20	30		CIEDRN
C=CCn1cccc1C(=O)N(C)[C@H](c1ccccc1)C(C)C	ZINC000490025648	332077325	/nfs/dbraw/zinc/07/73/25/332077325.db2.gz	IEWMSWXCQXFYQZ-SFHVURJKSA-N	0	0	296.414	4.143	20	30		CIEDRN
C=CCn1cccc1C(=O)Nc1ccc(C)cc1OCCC	ZINC000490070451	332079775	/nfs/dbraw/zinc/07/97/75/332079775.db2.gz	HNYXKMZOQRAWMB-UHFFFAOYSA-N	0	0	298.386	4.024	20	30		CIEDRN
N#CCc1ccc(CNc2ccc(F)c(C3CC3)c2)cc1	ZINC000490438685	332089554	/nfs/dbraw/zinc/08/95/54/332089554.db2.gz	WKMBHVBVVUFSCX-UHFFFAOYSA-N	0	0	280.346	4.381	20	30		CIEDRN
C=CCSCC(=O)Nc1ccc([C@H](C)CC)cc1	ZINC000490823263	332117967	/nfs/dbraw/zinc/11/79/67/332117967.db2.gz	SLWRSQKVLXFWPM-GFCCVEGCSA-N	0	0	263.406	4.058	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)Nc1cccc(CC)c1	ZINC000491270492	332178504	/nfs/dbraw/zinc/17/85/04/332178504.db2.gz	HXGYRBROQLZDOO-UHFFFAOYSA-N	0	0	298.386	4.105	20	30		CIEDRN
C=CCCC(=O)NC1(c2cccc(C(F)(F)F)c2)CCC1	ZINC000172801208	332947571	/nfs/dbraw/zinc/94/75/71/332947571.db2.gz	SEWZMKWERSQFMN-UHFFFAOYSA-N	0	0	297.320	4.167	20	30		CIEDRN
C#C[C@@H](N[C@@H](C)c1cc(C)ccn1)c1ccc(Cl)cc1	ZINC000491496726	332223216	/nfs/dbraw/zinc/22/32/16/332223216.db2.gz	SLSYKSIUGTUSBK-XJKSGUPXSA-N	0	0	284.790	4.069	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2cccc(SCC)c2)CC1	ZINC000172215169	335097786	/nfs/dbraw/zinc/09/77/86/335097786.db2.gz	BPLKOPPVMMFYKI-UHFFFAOYSA-N	0	0	290.432	4.229	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)C[C@@H](C)c1cccc(F)c1	ZINC000172231712	335098307	/nfs/dbraw/zinc/09/83/07/335098307.db2.gz	KURLRHQIZIYOQU-CYBMUJFWSA-N	0	0	296.345	4.138	20	30		CIEDRN
CCN(C(=O)/C=C\C(C)(C)C)[C@@H](C)c1ccc(C#N)cc1	ZINC000491683861	332285803	/nfs/dbraw/zinc/28/58/03/332285803.db2.gz	BKYIJONEQWZVCD-NYHXXUGCSA-N	0	0	284.403	4.070	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)[C@H](C)Cc1ccccc1	ZINC000491922043	332375331	/nfs/dbraw/zinc/37/53/31/332375331.db2.gz	WBHSJBZXXXFYJK-QGZVFWFLSA-N	0	0	293.410	4.080	20	30		CIEDRN
Cc1nc2ccc(CNc3ccc(C#N)cc3)cc2s1	ZINC000492259137	332389596	/nfs/dbraw/zinc/38/95/96/332389596.db2.gz	OIJMSQNDYBYHQF-UHFFFAOYSA-N	0	0	279.368	4.089	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)/C=C/c1cnc(C)s1	ZINC000492898055	332417749	/nfs/dbraw/zinc/41/77/49/332417749.db2.gz	MHPAHSZVMQSGJZ-ZHACJKMWSA-N	0	0	298.411	4.222	20	30		CIEDRN
CCOc1ccc(C#N)cc1N[C@@H](C)c1ccc(C#N)cc1	ZINC000172417718	335105004	/nfs/dbraw/zinc/10/50/04/335105004.db2.gz	WARXIWKINWFHFG-ZDUSSCGKSA-N	0	0	291.354	4.002	20	30		CIEDRN
COc1ccc(C#N)cc1N[C@@H](C)CCc1ccccc1	ZINC000493836411	332455975	/nfs/dbraw/zinc/45/59/75/332455975.db2.gz	PWSFAKDWCGWQRQ-AWEZNQCLSA-N	0	0	280.371	4.000	20	30		CIEDRN
C=CCN(CC=C)C(=O)Nc1csc2ccccc12	ZINC000493933090	332458554	/nfs/dbraw/zinc/45/85/54/332458554.db2.gz	NWZBNOUQZBPYAW-UHFFFAOYSA-N	0	0	272.373	4.107	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)CCSc1cccc(Cl)c1	ZINC000575737305	335110260	/nfs/dbraw/zinc/11/02/60/335110260.db2.gz	FKLFTHPXSORFOF-CYBMUJFWSA-N	0	0	297.851	4.293	20	30		CIEDRN
C=CC[C@@H](C)[C@@H](C)Nc1cnn(CC(C)C)c1C(F)F	ZINC000495146450	332508462	/nfs/dbraw/zinc/50/84/62/332508462.db2.gz	FEFQCKUDQSUURK-VXGBXAGGSA-N	0	0	285.382	4.489	20	30		CIEDRN
CCCCN(C(=O)c1cccc(CC#N)c1)C1CCCCC1	ZINC000553750199	334397847	/nfs/dbraw/zinc/39/78/47/334397847.db2.gz	ULYGXTHLXPESLH-UHFFFAOYSA-N	0	0	298.430	4.328	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CC[C@H](c2cccc(Cl)c2)C1	ZINC000497005678	332567028	/nfs/dbraw/zinc/56/70/28/332567028.db2.gz	ZVHCSRCSYMFHRD-AWEZNQCLSA-N	0	0	291.822	4.258	20	30		CIEDRN
C=CCCC(=O)NC1(c2ccc(F)cc2F)CCCCC1	ZINC000498810153	332573372	/nfs/dbraw/zinc/57/33/72/332573372.db2.gz	CHNIYJUKINURBZ-UHFFFAOYSA-N	0	0	293.357	4.207	20	30		CIEDRN
Cc1ccc([C@H](C)N(C)c2cccc(F)c2C#N)cc1	ZINC000498842215	332574040	/nfs/dbraw/zinc/57/40/40/332574040.db2.gz	YOMBYTQQNJEAFV-ZDUSSCGKSA-N	0	0	268.335	4.203	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CCC(C)(CC(C)C)CC1	ZINC000572548992	334459656	/nfs/dbraw/zinc/45/96/56/334459656.db2.gz	ALQNCWRQPZCSGI-UHFFFAOYSA-N	0	0	265.441	4.264	20	30		CIEDRN
Cc1ccc2oc(C(=O)Nc3ccc(C#N)c(F)c3)cc2c1	ZINC000308075584	332592819	/nfs/dbraw/zinc/59/28/19/332592819.db2.gz	DEKFWSDYQFDTTH-UHFFFAOYSA-N	0	0	294.285	4.004	20	30		CIEDRN
C=CCC[C@H](NC(=O)N1CCC(C)CC1)c1ccccc1	ZINC000499759673	332592849	/nfs/dbraw/zinc/59/28/49/332592849.db2.gz	ISRUFNQRCRLCBB-KRWDZBQOSA-N	0	0	286.419	4.135	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1ccc(Cl)cc1Cl	ZINC000500103331	332599476	/nfs/dbraw/zinc/59/94/76/332599476.db2.gz	IZBODOVAODXBET-JTQLQIEISA-N	0	0	287.190	4.470	20	30		CIEDRN
C=CCCCC(=O)N[C@H](C)Cc1ccc(C(C)C)cc1	ZINC000500161040	332600997	/nfs/dbraw/zinc/60/09/97/332600997.db2.gz	FQSNROHTOOMRQP-OAHLLOKOSA-N	0	0	273.420	4.214	20	30		CIEDRN
C=CCCc1ccccc1NCc1nc2ccccc2n1C	ZINC000500398314	332606908	/nfs/dbraw/zinc/60/69/08/332606908.db2.gz	OBZZELMDFIHKGU-UHFFFAOYSA-N	0	0	291.398	4.304	20	30		CIEDRN
C=CCCc1ccccc1NCc1ccc(COC)o1	ZINC000500448443	332609360	/nfs/dbraw/zinc/60/93/60/332609360.db2.gz	UYMGSWVQLKGGAC-UHFFFAOYSA-N	0	0	271.360	4.157	20	30		CIEDRN
Cc1c(C#N)cccc1NCc1ccc(OC(F)F)cc1	ZINC000500742470	332617491	/nfs/dbraw/zinc/61/74/91/332617491.db2.gz	AYBALERWYFQTFI-UHFFFAOYSA-N	0	0	288.297	4.080	20	30		CIEDRN
Cc1c(C#N)cccc1NCc1csc(C(C)(C)C)n1	ZINC000500751881	332617850	/nfs/dbraw/zinc/61/78/50/332617850.db2.gz	DAMRGNQQMCNQSO-UHFFFAOYSA-N	0	0	285.416	4.233	20	30		CIEDRN
COc1cc(C#N)ccc1CNc1ccc(C(C)C)cc1	ZINC000500868981	332620999	/nfs/dbraw/zinc/62/09/99/332620999.db2.gz	QTAKJJGRGKVOIT-UHFFFAOYSA-N	0	0	280.371	4.302	20	30		CIEDRN
Cc1ccc(C#N)cc1NCc1cnc(CC(C)C)s1	ZINC000500972319	332623132	/nfs/dbraw/zinc/62/31/32/332623132.db2.gz	IOQXAVXWUBJYBM-UHFFFAOYSA-N	0	0	285.416	4.134	20	30		CIEDRN
Cc1ccc(C#N)cc1NCc1nc2c(s1)C[C@@H](C)CC2	ZINC000501000400	332623762	/nfs/dbraw/zinc/62/37/62/332623762.db2.gz	JEHMQEKZASLSSN-NSHDSACASA-N	0	0	297.427	4.060	20	30		CIEDRN
CCOc1ccc(C#N)cc1NCc1ccc(C)c(F)c1	ZINC000500998211	332623895	/nfs/dbraw/zinc/62/38/95/332623895.db2.gz	FMDZZIRISBSVFD-UHFFFAOYSA-N	0	0	284.334	4.017	20	30		CIEDRN
Cc1ccc([C@@H]2CCC[C@@H]2N(C)C(=O)CC(C)(C)C#N)cc1	ZINC000501271231	332629729	/nfs/dbraw/zinc/62/97/29/332629729.db2.gz	CRAVMPLMCDZZII-IRXDYDNUSA-N	0	0	298.430	4.029	20	30		CIEDRN
N#CC1(CN(Cc2ccco2)c2cccc(Cl)c2)CC1	ZINC000501548676	332635474	/nfs/dbraw/zinc/63/54/74/332635474.db2.gz	LCJMRZVQDUAXNJ-UHFFFAOYSA-N	0	0	286.762	4.243	20	30		CIEDRN
C=CCCCC(=O)N[C@]1(c2cccc(C)c2)C[C@@H]1CC	ZINC000501629192	332637004	/nfs/dbraw/zinc/63/70/04/332637004.db2.gz	LPMVZCZYRHHREH-MAUKXSAKSA-N	0	0	271.404	4.093	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](c1ccc(F)cc1)C(C)C	ZINC000501655811	332637934	/nfs/dbraw/zinc/63/79/34/332637934.db2.gz	LEKIRNZWZLFEHI-CZUORRHYSA-N	0	0	277.383	4.241	20	30		CIEDRN
CCC1(CC)CN(C(=O)CC(C)(C)C#N)c2ccccc21	ZINC000502063931	332647481	/nfs/dbraw/zinc/64/74/81/332647481.db2.gz	OZOWCXSMERWGCK-UHFFFAOYSA-N	0	0	284.403	4.031	20	30		CIEDRN
C=CCCCCCN(C)C(=O)N[C@H](C)c1cc(C)oc1C	ZINC000502180207	332649987	/nfs/dbraw/zinc/64/99/87/332649987.db2.gz	FOQFXYKXMXXYSS-CQSZACIVSA-N	0	0	292.423	4.345	20	30		CIEDRN
CN(Cc1cccc(C#N)c1)C(=O)CC1CCC(C)(C)CC1	ZINC000502284945	332652614	/nfs/dbraw/zinc/65/26/14/332652614.db2.gz	SGPJDPKGKLJRNK-UHFFFAOYSA-N	0	0	298.430	4.123	20	30		CIEDRN
CC(C)C[C@@](C)(C#N)NC(=O)c1ccc(C(C)(C)C)cc1	ZINC000502420948	332658505	/nfs/dbraw/zinc/65/85/05/332658505.db2.gz	VTXNJAHBRUQOCD-SFHVURJKSA-N	0	0	286.419	4.042	20	30		CIEDRN
CCc1ccc(NC(=O)Nc2cc(C#N)ccc2C)cc1	ZINC000502487714	332663045	/nfs/dbraw/zinc/66/30/45/332663045.db2.gz	MAZUONQZPGIQKE-UHFFFAOYSA-N	0	0	279.343	4.073	20	30		CIEDRN
C=C(C)CN(CC)C(=O)[C@@H]1C[C@H]1c1cccc2ccccc21	ZINC000503097890	332681370	/nfs/dbraw/zinc/68/13/70/332681370.db2.gz	HAGBMYPSAKMTMQ-RBUKOAKNSA-N	0	0	293.410	4.368	20	30		CIEDRN
C[C@H](NC(=O)C[C@H]1CCCCC1(C)C)c1ccc(C#N)cc1	ZINC000504429581	332711705	/nfs/dbraw/zinc/71/17/05/332711705.db2.gz	SVEDGFDOUBNMQV-WMLDXEAASA-N	0	0	298.430	4.342	20	30		CIEDRN
C=CCN(CC=C)C(=O)c1ccc2c(c1)oc1ccccc12	ZINC000504580239	332715614	/nfs/dbraw/zinc/71/56/14/332715614.db2.gz	RGFYQBUHJMTQMR-UHFFFAOYSA-N	0	0	291.350	4.400	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)C[C@H]1CCC[C@@H](C)C1	ZINC000504590612	332715916	/nfs/dbraw/zinc/71/59/16/332715916.db2.gz	FDXJIXMWDWGJLI-OCCSQVGLSA-N	0	0	270.376	4.022	20	30		CIEDRN
CC(C)CC(CC(C)C)NC(=O)C1(C#N)CCCCC1	ZINC000504587472	332716023	/nfs/dbraw/zinc/71/60/23/332716023.db2.gz	UYONFEBZTQCRFQ-UHFFFAOYSA-N	0	0	278.440	4.037	20	30		CIEDRN
CC(C)COc1cccc(/C=C/c2ccncc2C#N)c1	ZINC000504742469	332719932	/nfs/dbraw/zinc/71/99/32/332719932.db2.gz	QFSXXSZYQNUZHV-VOTSOKGWSA-N	0	0	278.355	4.158	20	30		CIEDRN
C=CCOc1ccc(/C=C\c2ccncc2C#N)cc1Cl	ZINC000504743665	332720108	/nfs/dbraw/zinc/72/01/08/332720108.db2.gz	XQUQLMKOYFFXRW-HYXAFXHYSA-N	0	0	296.757	4.342	20	30		CIEDRN
Cc1ccccc1-c1noc(/C=C/c2ccccc2C#N)n1	ZINC000504990952	332727396	/nfs/dbraw/zinc/72/73/96/332727396.db2.gz	JNWSDTFLNHGIHT-ZHACJKMWSA-N	0	0	287.322	4.087	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1Cc2ccccc2C1	ZINC000505011430	332727692	/nfs/dbraw/zinc/72/76/92/332727692.db2.gz	VLGHFPZUDYCCKM-UHFFFAOYSA-N	0	0	292.382	4.353	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N(C)[C@H](C)C(C)C	ZINC000505011763	332727727	/nfs/dbraw/zinc/72/77/27/332727727.db2.gz	ZVBMBUVAKPOGEN-CQSZACIVSA-N	0	0	274.408	4.313	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1C[C@@H]2CCCC[C@H]2C1	ZINC000505036755	332728761	/nfs/dbraw/zinc/72/87/61/332728761.db2.gz	ZECGQFPPCSIVFR-IRXDYDNUSA-N	0	0	298.430	4.459	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CC[C@H](C)[C@H]1C	ZINC000505058511	332729550	/nfs/dbraw/zinc/72/95/50/332729550.db2.gz	WEUYQIUOVGIWDF-UONOGXRCSA-N	0	0	272.392	4.067	20	30		CIEDRN
C=CCCC(=O)N[C@@H](CC1CCCC1)c1ccccc1	ZINC000505269872	332735522	/nfs/dbraw/zinc/73/55/22/332735522.db2.gz	BQJLLDFBGHEPDF-KRWDZBQOSA-N	0	0	271.404	4.390	20	30		CIEDRN
CC(C)[C@@H]1CCc2ccccc2[C@@H]1NC(=O)CC(C)(C)C#N	ZINC000505275497	332735656	/nfs/dbraw/zinc/73/56/56/332735656.db2.gz	TYXFVXAOOZIPFX-MAUKXSAKSA-N	0	0	298.430	4.002	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CCCC(CC)(CC)CC1	ZINC000505460241	332741248	/nfs/dbraw/zinc/74/12/48/332741248.db2.gz	ALPHPJHPSBYLGT-UHFFFAOYSA-N	0	0	265.441	4.408	20	30		CIEDRN
CCC1(CC)CCCN(C(=O)c2cscc2C#N)CC1	ZINC000505462937	332741441	/nfs/dbraw/zinc/74/14/41/332741441.db2.gz	VQOMBUNLGIONPD-UHFFFAOYSA-N	0	0	290.432	4.052	20	30		CIEDRN
CC[C@H](CC(=O)N[C@@H](C#N)c1ccc(Cl)cc1)C(C)C	ZINC000505790247	332752926	/nfs/dbraw/zinc/75/29/26/332752926.db2.gz	LNWBBGGGDFBPGP-DOMZBBRYSA-N	0	0	292.810	4.093	20	30		CIEDRN
CC(C)C[C@@H](C)CC(=O)N[C@@H](C#N)c1ccc(Cl)cc1	ZINC000505819184	332753520	/nfs/dbraw/zinc/75/35/20/332753520.db2.gz	FIQYSZHRLDBEAM-DOMZBBRYSA-N	0	0	292.810	4.093	20	30		CIEDRN
CC(C)(C)c1ccc([C@@H](C#N)NC(=O)CC2CCCC2)cc1	ZINC000505830794	332753944	/nfs/dbraw/zinc/75/39/44/332753944.db2.gz	FIXNGOKHUFNUNW-QGZVFWFLSA-N	0	0	298.430	4.245	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)CC[C@H](C)CC	ZINC000505947213	332758234	/nfs/dbraw/zinc/75/82/34/332758234.db2.gz	GBCHOKWEFOQCGQ-CYBMUJFWSA-N	0	0	265.422	4.089	20	30		CIEDRN
CC(C)[C@](C)(C#N)NC(=O)C1CCC(c2ccccc2)CC1	ZINC000172947062	332954947	/nfs/dbraw/zinc/95/49/47/332954947.db2.gz	UHWAUWOMNUGNOB-TVPLGVNVSA-N	0	0	298.430	4.015	20	30		CIEDRN
C[C@H](NC1(c2cccc(F)c2)CC1)c1ccc(C#N)cc1F	ZINC000512283043	332961483	/nfs/dbraw/zinc/96/14/83/332961483.db2.gz	ONIXZCSFMCYGCW-LBPRGKRZSA-N	0	0	298.336	4.176	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CC[C@@H](c2ccccc2)C[C@H]1C	ZINC000512420089	332967667	/nfs/dbraw/zinc/96/76/67/332967667.db2.gz	GXPRUAFUXWCXAP-NVXWUHKLSA-N	0	0	285.431	4.383	20	30		CIEDRN
CCOc1cccc(N[C@@H](C)c2ccc(C#N)cc2F)c1	ZINC000512631014	332976624	/nfs/dbraw/zinc/97/66/24/332976624.db2.gz	PEOBMJYIKIXBFX-LBPRGKRZSA-N	0	0	284.334	4.269	20	30		CIEDRN
C=C(CNC(=O)N(CC(C)C)CC(C)C)c1ccccc1	ZINC000512678756	332979961	/nfs/dbraw/zinc/97/99/61/332979961.db2.gz	TVURGGAZRIUPDG-UHFFFAOYSA-N	0	0	288.435	4.023	20	30		CIEDRN
N#Cc1ccc(-c2nc3cc(Cl)ccc3n2C2CC2)o1	ZINC000173743849	332980285	/nfs/dbraw/zinc/98/02/85/332980285.db2.gz	XDAPJISIKYOCQP-UHFFFAOYSA-N	0	0	283.718	4.156	20	30		CIEDRN
N#Cc1cc(F)ccc1COc1ccc(Cl)cc1F	ZINC000513132724	333005796	/nfs/dbraw/zinc/00/57/96/333005796.db2.gz	XTYSHRPAEZPSIS-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
COc1ccc(F)cc1[C@H](C)Nc1ccc(F)cc1C#N	ZINC000174689856	333005833	/nfs/dbraw/zinc/00/58/33/333005833.db2.gz	CZYZEOAGFWFNKN-JTQLQIEISA-N	0	0	288.297	4.018	20	30		CIEDRN
N#Cc1cc(F)ccc1N[C@H](c1ccccc1)[C@@H]1CCCO1	ZINC000174721826	333006239	/nfs/dbraw/zinc/00/62/39/333006239.db2.gz	GMINFCRXAXAGOK-ZWKOTPCHSA-N	0	0	296.345	4.030	20	30		CIEDRN
C[C@H](CNc1cccc(F)c1C#N)c1ccc(F)cc1	ZINC000513182238	333007394	/nfs/dbraw/zinc/00/73/94/333007394.db2.gz	FTWQBDKHYZMDRL-LLVKDONJSA-N	0	0	272.298	4.052	20	30		CIEDRN
CCN(CCCC(C)(C)C#N)c1ccc(F)c(F)c1	ZINC000174830589	333008263	/nfs/dbraw/zinc/00/82/63/333008263.db2.gz	JUUXTNKKMQZWKF-UHFFFAOYSA-N	0	0	266.335	4.121	20	30		CIEDRN
N#CC1(CN(Cc2c(Cl)cccc2Cl)C2CC2)CC1	ZINC000513237044	333010324	/nfs/dbraw/zinc/01/03/24/333010324.db2.gz	SILZWUSMUHBIRB-UHFFFAOYSA-N	0	0	295.213	4.262	20	30		CIEDRN
C=CCN(CC=C)C(=O)Nc1cc(C(F)(F)F)ccc1C	ZINC000174930108	333011035	/nfs/dbraw/zinc/01/10/35/333011035.db2.gz	ROFUKVYXXOITAN-UHFFFAOYSA-N	0	0	298.308	4.220	20	30		CIEDRN
C=CCCCC(=O)N[C@H]1CCSc2ccc(Cl)cc21	ZINC000175141017	333015407	/nfs/dbraw/zinc/01/54/07/333015407.db2.gz	OHACHXASFZQHIL-ZDUSSCGKSA-N	0	0	295.835	4.349	20	30		CIEDRN
CC(C)C[C@H]1CCN(c2cc(Cl)ccc2C#N)C1	ZINC000307769396	333016451	/nfs/dbraw/zinc/01/64/51/333016451.db2.gz	CVHYEQDJRYIKIJ-GFCCVEGCSA-N	0	0	262.784	4.084	20	30		CIEDRN
N#CCCCCSC[C@H]1CCc2ccccc2C1	ZINC000513436324	333019214	/nfs/dbraw/zinc/01/92/14/333019214.db2.gz	DMMFORYUESLXQW-AWEZNQCLSA-N	0	0	259.418	4.219	20	30		CIEDRN
C=CCCCC(=O)N(Cc1ccc([C@H]2C[C@H]2C)o1)C1CC1	ZINC000175275980	333019562	/nfs/dbraw/zinc/01/95/62/333019562.db2.gz	ZDDGNTXNUCLKIL-CJNGLKHVSA-N	0	0	287.403	4.250	20	30		CIEDRN
C=C1CCN(Cc2csc(-c3ccc(F)cc3)n2)CC1	ZINC000513450259	333020318	/nfs/dbraw/zinc/02/03/18/333020318.db2.gz	HXPSCRQGYJAKOU-UHFFFAOYSA-N	0	0	288.391	4.101	20	30		CIEDRN
Cc1cc(C#N)cc(NCc2csc(C(C)(C)C)n2)c1	ZINC000308125563	333025042	/nfs/dbraw/zinc/02/50/42/333025042.db2.gz	ZLPWWJSIURLIND-UHFFFAOYSA-N	0	0	285.416	4.233	20	30		CIEDRN
Cc1ccccc1SCc1ccc(C#N)c(F)c1	ZINC000404761885	333025686	/nfs/dbraw/zinc/02/56/86/333025686.db2.gz	SEILLOHNZGEDOB-UHFFFAOYSA-N	0	0	257.333	4.298	20	30		CIEDRN
N#Cc1ccc(CSc2ccc(F)cc2F)cc1F	ZINC000404767348	333025840	/nfs/dbraw/zinc/02/58/40/333025840.db2.gz	XAVBTYIGOXECOB-UHFFFAOYSA-N	0	0	279.286	4.268	20	30		CIEDRN
COc1ccc(CNc2ccc(CC#N)cc2)c(Cl)c1	ZINC000513609421	333026456	/nfs/dbraw/zinc/02/64/56/333026456.db2.gz	SKHLHUUBFPFFRL-UHFFFAOYSA-N	0	0	286.762	4.027	20	30		CIEDRN
CC(C)(C)C[C@H]1CCCN1c1ncc(C#N)cc1Cl	ZINC000513640111	333028397	/nfs/dbraw/zinc/02/83/97/333028397.db2.gz	JWNJZMFJTMPOPU-GFCCVEGCSA-N	0	0	277.799	4.012	20	30		CIEDRN
C=CCCCC(=O)N1[C@H](C)C[C@H](c2ccccc2)[C@@H]1C	ZINC000175745361	333031401	/nfs/dbraw/zinc/03/14/01/333031401.db2.gz	NCMHBRAOVHFMCG-VYDXJSESSA-N	0	0	271.404	4.136	20	30		CIEDRN
CCN(C(=O)[C@@H]1CCC(C)(C)C1)[C@@H](C)c1ccc(C#N)cc1	ZINC000513709328	333034254	/nfs/dbraw/zinc/03/42/54/333034254.db2.gz	FWRFDLXCIDHMCB-WMLDXEAASA-N	0	0	298.430	4.294	20	30		CIEDRN
CC(C)(C)CN(CCC#N)Cc1ccc(F)cc1Cl	ZINC000513717191	333035242	/nfs/dbraw/zinc/03/52/42/333035242.db2.gz	MKRFCXKZUXYVQF-UHFFFAOYSA-N	0	0	282.790	4.241	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)[C@@H]2CCC(C)(C)C2)cc1	ZINC000513725210	333035681	/nfs/dbraw/zinc/03/56/81/333035681.db2.gz	OUTAMVPXQFRIKI-CYBMUJFWSA-N	0	0	284.403	4.253	20	30		CIEDRN
CC(C)(C)CN(CCC#N)Cc1cc(Cl)ccc1F	ZINC000513724342	333035708	/nfs/dbraw/zinc/03/57/08/333035708.db2.gz	FBPNXNKFEVNFLN-UHFFFAOYSA-N	0	0	282.790	4.241	20	30		CIEDRN
CCC(CC)CN(CCC#N)CC1=Cc2ccccc2OC1	ZINC000513724391	333035752	/nfs/dbraw/zinc/03/57/52/333035752.db2.gz	GFXAWJAOWXALKK-UHFFFAOYSA-N	0	0	298.430	4.114	20	30		CIEDRN
Cc1ccccc1-c1cccc(CN(C)[C@@H](C)CC#N)c1	ZINC000513726304	333035879	/nfs/dbraw/zinc/03/58/79/333035879.db2.gz	YNAWJVKDQPOMLS-INIZCTEOSA-N	0	0	278.399	4.396	20	30		CIEDRN
C=CC1CCN(c2ccnc3ccc(Cl)cc32)CC1	ZINC000513743909	333037184	/nfs/dbraw/zinc/03/71/84/333037184.db2.gz	DGALRQCGIIPROU-UHFFFAOYSA-N	0	0	272.779	4.291	20	30		CIEDRN
N#C[C@H](SCc1ccc([N+](=O)[O-])cc1)C1CCCCC1	ZINC000513814730	333040914	/nfs/dbraw/zinc/04/09/14/333040914.db2.gz	FYKMEJHNAMYSQG-HNNXBMFYSA-N	0	0	290.388	4.300	20	30		CIEDRN
N#Cc1ccc(/C=C/c2ccc3ccccc3n2)s1	ZINC000176398663	333041847	/nfs/dbraw/zinc/04/18/47/333041847.db2.gz	IUIXFXSMYSTSCC-BQYQJAHWSA-N	0	0	262.337	4.338	20	30		CIEDRN
C=CCCCN(C)C(=O)c1ccc(Oc2ccccc2)o1	ZINC000176436931	333042194	/nfs/dbraw/zinc/04/21/94/333042194.db2.gz	NHDSFHJSTOJSMJ-UHFFFAOYSA-N	0	0	285.343	4.110	20	30		CIEDRN
CCn1c2ccc(Cl)cc2nc1-c1cccc(C#N)c1	ZINC000513854103	333043275	/nfs/dbraw/zinc/04/32/75/333043275.db2.gz	JHCOYJQNZTYXND-UHFFFAOYSA-N	0	0	281.746	4.248	20	30		CIEDRN
C=CCOc1cccc(-c2nc3ccccc3n2CC)c1	ZINC000513854721	333043303	/nfs/dbraw/zinc/04/33/03/333043303.db2.gz	UBEDCUJHMPAVKP-UHFFFAOYSA-N	0	0	278.355	4.288	20	30		CIEDRN
COc1ccc(-c2nc3cc(C#N)ccc3[nH]2)c2ccccc12	ZINC000513857538	333043690	/nfs/dbraw/zinc/04/36/90/333043690.db2.gz	NCCMKBTYQYACAM-UHFFFAOYSA-N	0	0	299.333	4.263	20	30		CIEDRN
C=CCOc1ccc(-c2nc3cc(F)c(F)cc3[nH]2)cc1	ZINC000513858926	333043843	/nfs/dbraw/zinc/04/38/43/333043843.db2.gz	GAAXQNSCKFCCLE-UHFFFAOYSA-N	0	0	286.281	4.073	20	30		CIEDRN
Cc1cc(C)cc(-c2ccc(CNCC3(C#N)CC3)cc2)c1	ZINC000575814124	335118380	/nfs/dbraw/zinc/11/83/80/335118380.db2.gz	FARKFKKAAMWAEM-UHFFFAOYSA-N	0	0	290.410	4.364	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(C)cc1OCCC	ZINC000177558679	333060336	/nfs/dbraw/zinc/06/03/36/333060336.db2.gz	QKINFVNFYFJXIE-UHFFFAOYSA-N	0	0	261.365	4.079	20	30		CIEDRN
C[C@H](C(=O)Nc1ccccc1C#N)c1cc2ccccc2o1	ZINC000177565407	333060419	/nfs/dbraw/zinc/06/04/19/333060419.db2.gz	WFONWBCRJYBBLB-LBPRGKRZSA-N	0	0	290.322	4.047	20	30		CIEDRN
C=CCCCCN[C@@H](c1ccccc1)C(F)(F)F	ZINC000310991915	333063375	/nfs/dbraw/zinc/06/33/75/333063375.db2.gz	HWPNPXGOXSPYRL-ZDUSSCGKSA-N	0	0	257.299	4.236	20	30		CIEDRN
C=CCn1c(C)cc(C(=O)CSc2ccccc2)c1C	ZINC000514066078	333063537	/nfs/dbraw/zinc/06/35/37/333063537.db2.gz	JYWDOAJBHYUGLT-UHFFFAOYSA-N	0	0	285.412	4.266	20	30		CIEDRN
C=C(C)CS[C@@H](C)C(=O)Nc1ccccc1C(C)C	ZINC000177865399	333064561	/nfs/dbraw/zinc/06/45/61/333064561.db2.gz	WZZKEJSQBUIEOM-ZDUSSCGKSA-N	0	0	277.433	4.446	20	30		CIEDRN
N#Cc1cc(-c2ccccc2)sc1NC(=O)C1=CCCC1	ZINC000177913735	333065464	/nfs/dbraw/zinc/06/54/64/333065464.db2.gz	NAVOVJXUJXMTRJ-UHFFFAOYSA-N	0	0	294.379	4.336	20	30		CIEDRN
CCC[C@@H](C)[C@H]1CCCN1C(=O)Nc1cc(C#N)ccc1C	ZINC000178141145	333068355	/nfs/dbraw/zinc/06/83/55/333068355.db2.gz	QIKKYXMPAZJDQM-RHSMWYFYSA-N	0	0	299.418	4.299	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N1CCC[C@@H]1CCC(C)C	ZINC000178141207	333068583	/nfs/dbraw/zinc/06/85/83/333068583.db2.gz	RTNWVNNWXFVQLM-MRXNPFEDSA-N	0	0	299.418	4.299	20	30		CIEDRN
CC(C)OCCNc1cccc(Oc2ccc(C#N)cc2)c1	ZINC000178380674	333071745	/nfs/dbraw/zinc/07/17/45/333071745.db2.gz	OXAQWYOGQCEQLK-UHFFFAOYSA-N	0	0	296.370	4.187	20	30		CIEDRN
Cc1nc(N(C)[C@@H](C)c2cccs2)c(Cl)cc1C#N	ZINC000311763299	333072189	/nfs/dbraw/zinc/07/21/89/333072189.db2.gz	WPQBIUNXENVHMD-JTQLQIEISA-N	0	0	291.807	4.174	20	30		CIEDRN
C=CCn1c(S[C@@H](C)CCC)nnc1-c1ccoc1C	ZINC000178409031	333072395	/nfs/dbraw/zinc/07/23/95/333072395.db2.gz	LIHRBRSUJMKCDX-NSHDSACASA-N	0	0	291.420	4.313	20	30		CIEDRN
C=CCn1c(S[C@H](C)CCC)nnc1-c1ccco1	ZINC000178414336	333072466	/nfs/dbraw/zinc/07/24/66/333072466.db2.gz	TZUFFSZBXIWCSW-LLVKDONJSA-N	0	0	277.393	4.005	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)c1ccccc1C(C)C	ZINC000516639583	333079799	/nfs/dbraw/zinc/07/97/99/333079799.db2.gz	LPCGCSNIXKTRHF-AWEZNQCLSA-N	0	0	259.393	4.375	20	30		CIEDRN
C[C@H]1C[C@H](C(C)(C)C)CCN1C(=O)c1ccc(CC#N)cc1	ZINC000516677141	333080321	/nfs/dbraw/zinc/08/03/21/333080321.db2.gz	NDDLCKFARPOFBP-WMLDXEAASA-N	0	0	298.430	4.039	20	30		CIEDRN
C[C@@H]1CCCC[C@H]1OCCSc1ccc(C#N)cc1	ZINC000516788002	333082604	/nfs/dbraw/zinc/08/26/04/333082604.db2.gz	WUILLUCYMRTQEC-CZUORRHYSA-N	0	0	275.417	4.246	20	30		CIEDRN
C[C@H]1CCCC[C@H]1OCCSc1ccc(C#N)cc1	ZINC000516788003	333082636	/nfs/dbraw/zinc/08/26/36/333082636.db2.gz	WUILLUCYMRTQEC-XJKSGUPXSA-N	0	0	275.417	4.246	20	30		CIEDRN
CC(C)(C#N)CCSc1cccc(Br)c1	ZINC000087324220	333082814	/nfs/dbraw/zinc/08/28/14/333082814.db2.gz	PWDANBXJSDIAJC-UHFFFAOYSA-N	0	0	284.222	4.481	20	30		CIEDRN
CCC[C@H](Nc1ccc(C#N)c([N+](=O)[O-])c1)c1ccccc1	ZINC000516823773	333083424	/nfs/dbraw/zinc/08/34/24/333083424.db2.gz	BTHKGWWGVYLECQ-INIZCTEOSA-N	0	0	295.342	4.420	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2ccccc2OCC)no1	ZINC000516892253	333085475	/nfs/dbraw/zinc/08/54/75/333085475.db2.gz	BLRILZUQGZUCBG-GFCCVEGCSA-N	0	0	272.348	4.205	20	30		CIEDRN
N#Cc1cc(Sc2ccc(-c3ccccc3)cc2)ncn1	ZINC000516947896	333087807	/nfs/dbraw/zinc/08/78/07/333087807.db2.gz	ZJDGZLMRKBSJPG-UHFFFAOYSA-N	0	0	289.363	4.166	20	30		CIEDRN
N#Cc1ccc(SC[C@H]2CCC3(CCCC3)O2)c(F)c1	ZINC000517016841	333090129	/nfs/dbraw/zinc/09/01/29/333090129.db2.gz	OGLQQAUNGYGWEJ-CYBMUJFWSA-N	0	0	291.391	4.281	20	30		CIEDRN
Cc1ccc(Cl)cc1OCc1ccc(C#N)cc1F	ZINC000088729884	333091607	/nfs/dbraw/zinc/09/16/07/333091607.db2.gz	KRXWAMGMYJOMQP-UHFFFAOYSA-N	0	0	275.710	4.238	20	30		CIEDRN
C=CCOc1ccccc1CNC(=O)[C@@H](CC)CCCC	ZINC000517677364	333105700	/nfs/dbraw/zinc/10/57/00/333105700.db2.gz	FKSIFHCYRALPJP-HNNXBMFYSA-N	0	0	289.419	4.084	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1cc(F)ccc1Cl	ZINC000520850385	333106911	/nfs/dbraw/zinc/10/69/11/333106911.db2.gz	ASSMRDVAGWJADC-UHFFFAOYSA-N	0	0	283.774	4.298	20	30		CIEDRN
C=CCN(CC=C)C(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1	ZINC000520861730	333107215	/nfs/dbraw/zinc/10/72/15/333107215.db2.gz	BJCRICXUHLGPBB-MOPGFXCFSA-N	0	0	291.394	4.144	20	30		CIEDRN
CC1(C)CCc2cc(/C=C\c3ccc(C#N)cn3)ccc2O1	ZINC000520994503	333109590	/nfs/dbraw/zinc/10/95/90/333109590.db2.gz	LXNYLKAANKACTJ-UTCJRWHESA-N	0	0	290.366	4.227	20	30		CIEDRN
CC(C)C[N@H+](Cc1ccccc1)Cc1ccc(C#N)cc1F	ZINC000521189759	333114420	/nfs/dbraw/zinc/11/44/20/333114420.db2.gz	RVCMVWANRBCWRJ-UHFFFAOYSA-N	0	0	296.389	4.356	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)C[C@@H]2CCCC[C@H]2C)s1	ZINC000521249866	333116241	/nfs/dbraw/zinc/11/62/41/333116241.db2.gz	FOYSJHYCXLMZOL-NEPJUHHUSA-N	0	0	290.432	4.337	20	30		CIEDRN
N#CCCC1CCN(c2ccnc3c(Cl)cccc23)CC1	ZINC000567584089	333125042	/nfs/dbraw/zinc/12/50/42/333125042.db2.gz	CAQDBKMIVQYCAW-UHFFFAOYSA-N	0	0	299.805	4.408	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1c(C)cccc1SC	ZINC000184612323	333130588	/nfs/dbraw/zinc/13/05/88/333130588.db2.gz	CQCJGNQOZMMISD-GFCCVEGCSA-N	0	0	263.406	4.258	20	30		CIEDRN
CC(C)CCc1ccc(N[C@H]2CC[C@@H](C#N)C2)cc1	ZINC000564159327	333132302	/nfs/dbraw/zinc/13/23/02/333132302.db2.gz	UBUFFXGAOWISQW-WBVHZDCISA-N	0	0	256.393	4.379	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cccc(Cl)c1C	ZINC000184868810	333132863	/nfs/dbraw/zinc/13/28/63/333132863.db2.gz	KMZHBNBKQJXSKT-SNVBAGLBSA-N	0	0	251.757	4.189	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](C)c1ccccc1Cl	ZINC000184907247	333133098	/nfs/dbraw/zinc/13/30/98/333133098.db2.gz	HVKXNWWPDVIUKC-NEPJUHHUSA-N	0	0	265.784	4.120	20	30		CIEDRN
CC#CCCCC(=O)Nc1nc(-c2cccs2)cs1	ZINC000184913890	333133316	/nfs/dbraw/zinc/13/33/16/333133316.db2.gz	OBDLTYNUVXNAKV-UHFFFAOYSA-N	0	0	290.413	4.004	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(OCC)ccc1OCC	ZINC000184983341	333134045	/nfs/dbraw/zinc/13/40/45/333134045.db2.gz	LMSGDDIEVNDXOZ-ZDUSSCGKSA-N	0	0	291.391	4.025	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC)Cc1ccc(Cl)s1	ZINC000184991209	333134106	/nfs/dbraw/zinc/13/41/06/333134106.db2.gz	FZOVVGGIPRWRRF-NSHDSACASA-N	0	0	285.840	4.352	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cccc(Cl)c1F	ZINC000184980558	333134117	/nfs/dbraw/zinc/13/41/17/333134117.db2.gz	ZIVLTNZLDVIIKM-VIFPVBQESA-N	0	0	255.720	4.020	20	30		CIEDRN
CC#CCCCC(=O)N1CC[C@H](C)Sc2ccccc21	ZINC000184988623	333134154	/nfs/dbraw/zinc/13/41/54/333134154.db2.gz	AGXYGHCDYYGQHY-AWEZNQCLSA-N	0	0	287.428	4.098	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(N2CCCC2)cc1C	ZINC000184990119	333134162	/nfs/dbraw/zinc/13/41/62/333134162.db2.gz	AXUCVCHWYKXHPG-HNNXBMFYSA-N	0	0	286.419	4.136	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(-c2nccs2)cc1	ZINC000184995763	333134208	/nfs/dbraw/zinc/13/42/08/333134208.db2.gz	DAPDEZSXIOBCQY-LBPRGKRZSA-N	0	0	286.400	4.351	20	30		CIEDRN
CC#CCCCC(=O)N[C@H](c1ccc(Cl)cc1)C1CC1	ZINC000185003632	333134370	/nfs/dbraw/zinc/13/43/70/333134370.db2.gz	XNESOTKHBNCBAM-KRWDZBQOSA-N	0	0	289.806	4.101	20	30		CIEDRN
CC#CCCCC(=O)N(Cc1ccccc1)[C@@H](C)CC	ZINC000185009804	333134466	/nfs/dbraw/zinc/13/44/66/333134466.db2.gz	OOFKFFSRANMSHX-INIZCTEOSA-N	0	0	271.404	4.007	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(Cc2ccncc2)cc1	ZINC000185110411	333135652	/nfs/dbraw/zinc/13/56/52/333135652.db2.gz	CIUFGAKCYXSCEZ-OAHLLOKOSA-N	0	0	294.398	4.213	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccccc1N1CCCCCC1	ZINC000185138082	333136010	/nfs/dbraw/zinc/13/60/10/333136010.db2.gz	IIYFFHOOORJFAL-UHFFFAOYSA-N	0	0	298.430	4.199	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)Cc1csc2ccccc12	ZINC000185132644	333136038	/nfs/dbraw/zinc/13/60/38/333136038.db2.gz	IHOKSKQZNRYHOT-ZDUSSCGKSA-N	0	0	287.428	4.462	20	30		CIEDRN
CCN(C(=O)[C@@H](C)CC(C)C)[C@H](C)c1ccc(C#N)cc1	ZINC000185170232	333136269	/nfs/dbraw/zinc/13/62/69/333136269.db2.gz	XEPRNRVAVLQRJH-LSDHHAIUSA-N	0	0	286.419	4.150	20	30		CIEDRN
CCC(CC)(NC(=O)CC#N)c1ccc(Cl)c(Cl)c1	ZINC000185188119	333136395	/nfs/dbraw/zinc/13/63/95/333136395.db2.gz	ONCLTXNXDUGYQM-UHFFFAOYSA-N	0	0	299.201	4.039	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)Cc1cccc2ccccc21	ZINC000185197575	333136534	/nfs/dbraw/zinc/13/65/34/333136534.db2.gz	GFRPUPAYYDGBHK-HNNXBMFYSA-N	0	0	281.399	4.401	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H]1CCc1ccccc1	ZINC000185216116	333136873	/nfs/dbraw/zinc/13/68/73/333136873.db2.gz	BVBXVHBFUFHJHG-SJLPKXTDSA-N	0	0	285.431	4.213	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@H](C)c1cc(F)ccc1F	ZINC000185210507	333136880	/nfs/dbraw/zinc/13/68/80/333136880.db2.gz	OTBSDOQHCPUVTM-VXGBXAGGSA-N	0	0	281.346	4.087	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@@H](C)c1cccc(Cl)c1	ZINC000185223490	333137065	/nfs/dbraw/zinc/13/70/65/333137065.db2.gz	HHNRIRNKDDFKJN-STQMWFEESA-N	0	0	279.811	4.462	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(OCCC)cc1C	ZINC000185243746	333137510	/nfs/dbraw/zinc/13/75/10/333137510.db2.gz	MYGSSRXPNINOFZ-CQSZACIVSA-N	0	0	275.392	4.325	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H]1CCc2c1cccc2Cl	ZINC000185261240	333137693	/nfs/dbraw/zinc/13/76/93/333137693.db2.gz	CEIBTAOAKLWYMH-NHYWBVRUSA-N	0	0	277.795	4.046	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H]1CCc2c1cccc2Cl	ZINC000185261262	333137701	/nfs/dbraw/zinc/13/77/01/333137701.db2.gz	CEIBTAOAKLWYMH-ABAIWWIYSA-N	0	0	277.795	4.046	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccccc1-n1nc(C)cc1C	ZINC000185289679	333138442	/nfs/dbraw/zinc/13/84/42/333138442.db2.gz	BZWHOLURNUMNNT-CYBMUJFWSA-N	0	0	297.402	4.030	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cccc(-n2nc(C)cc2C)c1	ZINC000185324657	333138663	/nfs/dbraw/zinc/13/86/63/333138663.db2.gz	NZYWVYKYBYSFGE-ZDUSSCGKSA-N	0	0	297.402	4.030	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H](c2ccccc2)CC1	ZINC000185439876	333140767	/nfs/dbraw/zinc/14/07/67/333140767.db2.gz	MKTJIVXYCZZANH-FUHWJXTLSA-N	0	0	285.431	4.385	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C1CC1)[C@@H]1CCc2ccccc21	ZINC000185443955	333140820	/nfs/dbraw/zinc/14/08/20/333140820.db2.gz	KRUCRCLNDKCMJJ-RDTXWAMCSA-N	0	0	283.415	4.267	20	30		CIEDRN
C=C(C)[C@H](NC(=O)N(C)CCCC)c1ccc(F)c(F)c1	ZINC000185462447	333140963	/nfs/dbraw/zinc/14/09/63/333140963.db2.gz	HNUQGRSHLLUJMZ-HNNXBMFYSA-N	0	0	296.361	4.024	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC(c2ccccc2C)CC1	ZINC000185491377	333141858	/nfs/dbraw/zinc/14/18/58/333141858.db2.gz	BZXXYLIPSQFUIR-INIZCTEOSA-N	0	0	285.431	4.303	20	30		CIEDRN
CC#CCCCC(=O)N(C)[C@H](c1ccccc1)C(C)C	ZINC000185546214	333143498	/nfs/dbraw/zinc/14/34/98/333143498.db2.gz	CJVHOHDPMQMDQC-SFHVURJKSA-N	0	0	271.404	4.036	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@](C)(c2ccccc2)C1	ZINC000185557325	333143819	/nfs/dbraw/zinc/14/38/19/333143819.db2.gz	PFNDCHFEBRPJBR-QFBILLFUSA-N	0	0	285.431	4.169	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](CC)c1ccc(F)cc1F	ZINC000185628127	333145426	/nfs/dbraw/zinc/14/54/26/333145426.db2.gz	DWXSSFKHBMCXFX-IAQYHMDHSA-N	0	0	281.346	4.134	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccc(COC2CCCC2)cc1	ZINC000185644565	333145626	/nfs/dbraw/zinc/14/56/26/333145626.db2.gz	RFRKKZDZHDBZOK-UHFFFAOYSA-N	0	0	299.414	4.278	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@@H](c1ccccc1)C(F)(F)F	ZINC000185680621	333146576	/nfs/dbraw/zinc/14/65/76/333146576.db2.gz	ZHINTVMXVGJKPE-OCCSQVGLSA-N	0	0	299.336	4.351	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N([C@@H](C)[C@H](C)CC)C1CC1	ZINC000185700234	333146722	/nfs/dbraw/zinc/14/67/22/333146722.db2.gz	OMJDXSMBCUAPHM-RDBSUJKOSA-N	0	0	251.414	4.014	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N([C@H](C)[C@H](C)CC)C1CC1	ZINC000185700192	333146744	/nfs/dbraw/zinc/14/67/44/333146744.db2.gz	OMJDXSMBCUAPHM-HZSPNIEDSA-N	0	0	251.414	4.014	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC(F)(F)F)c1ccccc1	ZINC000185712729	333147076	/nfs/dbraw/zinc/14/70/76/333147076.db2.gz	OXNOJAYCLKPFHH-GFCCVEGCSA-N	0	0	285.309	4.184	20	30		CIEDRN
N#C[C@H]1CCC[C@@H](Nc2ccc(F)cc2OCC2CC2)C1	ZINC000185730183	333147429	/nfs/dbraw/zinc/14/74/29/333147429.db2.gz	XFRFDBQLZULVKT-DZGCQCFKSA-N	0	0	288.366	4.109	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](C)C[C@H]1c1ccc(C)o1	ZINC000185728835	333147532	/nfs/dbraw/zinc/14/75/32/333147532.db2.gz	JJQNEBXPCRCHNC-YCPHGPKFSA-N	0	0	289.419	4.490	20	30		CIEDRN
CC#CCCCC(=O)N1CC[C@H](c2ccccc2)[C@@H](CC)C1	ZINC000185745280	333147913	/nfs/dbraw/zinc/14/79/13/333147913.db2.gz	VMQVYPJWOQNEDK-HKUYNNGSSA-N	0	0	297.442	4.222	20	30		CIEDRN
C=C(C)COc1cccc(N[C@@H]2CCC[C@@H](C#N)C2)c1	ZINC000185745854	333147922	/nfs/dbraw/zinc/14/79/22/333147922.db2.gz	XPHHBGCATQNEDL-HUUCEWRRSA-N	0	0	270.376	4.136	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](C)c1c(F)cccc1Cl	ZINC000185766167	333148225	/nfs/dbraw/zinc/14/82/25/333148225.db2.gz	JIFSPTCOKIMZKR-WDEREUQCSA-N	0	0	283.774	4.259	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](C)c1c(F)cccc1Cl	ZINC000185766187	333148275	/nfs/dbraw/zinc/14/82/75/333148275.db2.gz	JIFSPTCOKIMZKR-GHMZBOCLSA-N	0	0	283.774	4.259	20	30		CIEDRN
N#Cc1c(F)cccc1OCc1ccc(C(F)F)cc1	ZINC000185798280	333149189	/nfs/dbraw/zinc/14/91/89/333149189.db2.gz	FMIHRPVRQJNQPH-UHFFFAOYSA-N	0	0	277.245	4.214	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccccc1OC(C)(C)C	ZINC000185810668	333149475	/nfs/dbraw/zinc/14/94/75/333149475.db2.gz	JBGKINOWOPEQPL-CYBMUJFWSA-N	0	0	275.392	4.405	20	30		CIEDRN
C=C(C)[C@@H](NC(=O)N(C)[C@@H](C)CC)c1ccc(F)c(F)c1	ZINC000185839900	333150102	/nfs/dbraw/zinc/15/01/02/333150102.db2.gz	DLDIPQZAQKWUEZ-XHDPSFHLSA-N	0	0	296.361	4.022	20	30		CIEDRN
CC[C@H](C(=O)Nc1cccc(C#N)c1C)c1ccc(F)cc1	ZINC000185968347	333152576	/nfs/dbraw/zinc/15/25/76/333152576.db2.gz	RXNJGZKYFVGPLF-INIZCTEOSA-N	0	0	296.345	4.138	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1cc(F)ccc1C)c1ccccc1	ZINC000186001468	333153177	/nfs/dbraw/zinc/15/31/77/333153177.db2.gz	QYEWLJPCWGFSKH-INIZCTEOSA-N	0	0	283.346	4.433	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)c1c(C)oc2ccccc21	ZINC000186008522	333153288	/nfs/dbraw/zinc/15/32/88/333153288.db2.gz	AZQLRKVBPKMJHE-UHFFFAOYSA-N	0	0	298.386	4.334	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](CC(C)(C)C)C(F)(F)F	ZINC000186018951	333153445	/nfs/dbraw/zinc/15/34/45/333153445.db2.gz	AYLXHHPATQDQAJ-GHMZBOCLSA-N	0	0	279.346	4.072	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1cc(C)ccc1F)c1ccccc1	ZINC000186038069	333153786	/nfs/dbraw/zinc/15/37/86/333153786.db2.gz	QKSOZYKCQWOSPX-OAHLLOKOSA-N	0	0	283.346	4.433	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](C(=C)C)c1ccc(F)c(F)c1	ZINC000186033988	333153826	/nfs/dbraw/zinc/15/38/26/333153826.db2.gz	OHRKSSMGYOSDTP-MLGOLLRUSA-N	0	0	293.357	4.301	20	30		CIEDRN
C=C(C)[C@H](NC(=O)[C@@H]1CC=CCC1)c1ccc(F)c(F)c1	ZINC000186044503	333153938	/nfs/dbraw/zinc/15/39/38/333153938.db2.gz	UYVROSTXQQDTTC-WBMJQRKESA-N	0	0	291.341	4.055	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](c2cc(C)cc(C)c2)C1	ZINC000186043264	333153951	/nfs/dbraw/zinc/15/39/51/333153951.db2.gz	PNKDQQZWUWYTEW-SJORKVTESA-N	0	0	285.431	4.222	20	30		CIEDRN
Cc1ccc2[nH]c(SCc3cccc(C#N)c3F)nc2c1	ZINC000219761613	333156365	/nfs/dbraw/zinc/15/63/65/333156365.db2.gz	ZJQPJTBBYBDKCT-UHFFFAOYSA-N	0	0	297.358	4.174	20	30		CIEDRN
N#Cc1cccc(CSc2ccccc2F)c1F	ZINC000219759795	333156551	/nfs/dbraw/zinc/15/65/51/333156551.db2.gz	DZJZXNHEEUMADH-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
C=CCC[C@H](C(=O)Nc1ccc(C)cn1)c1ccccc1	ZINC000186221811	333156938	/nfs/dbraw/zinc/15/69/38/333156938.db2.gz	DVGNKUWDSMOYSD-INIZCTEOSA-N	0	0	280.371	4.079	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)C[C@H]1C=CCCC1	ZINC000186238651	333157138	/nfs/dbraw/zinc/15/71/38/333157138.db2.gz	KTBFFDSNIXXUNU-AWEZNQCLSA-N	0	0	275.417	4.009	20	30		CIEDRN
C=C(C)[C@@H](N[C@H](C)c1cccnc1)c1ccc(F)c(F)c1	ZINC000186445962	333161157	/nfs/dbraw/zinc/16/11/57/333161157.db2.gz	QOSWZEXRZOXACB-SJKOYZFVSA-N	0	0	288.341	4.328	20	30		CIEDRN
CC(C)[C@@]1(C)C[C@H]1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000186463729	333161447	/nfs/dbraw/zinc/16/14/47/333161447.db2.gz	WZIBHRYCNRYDRK-MAUKXSAKSA-N	0	0	284.403	4.108	20	30		CIEDRN
C=C(C)CN(C)C(=O)Nc1ccc2oc(C)c(C)c2c1	ZINC000186504330	333162049	/nfs/dbraw/zinc/16/20/49/333162049.db2.gz	UTIOUCOYNYKGSB-UHFFFAOYSA-N	0	0	272.348	4.089	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1ccccc1COC)c1ccccc1	ZINC000186723428	333164788	/nfs/dbraw/zinc/16/47/88/333164788.db2.gz	IHIVQWLVPFXJTA-KRWDZBQOSA-N	0	0	295.382	4.131	20	30		CIEDRN
C[C@H]1CCC[C@@H]1CC(=O)N(C)c1cc(Cl)ccc1C#N	ZINC000186841531	333165531	/nfs/dbraw/zinc/16/55/31/333165531.db2.gz	USKLAAZYJXXISO-NWDGAFQWSA-N	0	0	290.794	4.001	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@@H](CC)CCC)c1ccccc1	ZINC000187244497	333168873	/nfs/dbraw/zinc/16/88/73/333168873.db2.gz	KEZSJPKAPZBGFN-JKSUJKDBSA-N	0	0	259.393	4.041	20	30		CIEDRN
C=C(C)[C@@H](NCc1ccc(C)o1)c1ccc(F)c(F)c1	ZINC000187373947	333169667	/nfs/dbraw/zinc/16/96/67/333169667.db2.gz	XLFZMQPNUCNDAD-MRXNPFEDSA-N	0	0	277.314	4.273	20	30		CIEDRN
C=C(C)[C@@H](NCc1ccccc1C#N)c1ccc(F)c(F)c1	ZINC000187373208	333169820	/nfs/dbraw/zinc/16/98/20/333169820.db2.gz	IRWLHWFUVNABRU-GOSISDBHSA-N	0	0	298.336	4.243	20	30		CIEDRN
C[C@H](NCc1ccc(Cl)cc1C#N)c1ccccc1	ZINC000187400429	333170390	/nfs/dbraw/zinc/17/03/90/333170390.db2.gz	GJOFEXIZSYEGKL-LBPRGKRZSA-N	0	0	270.763	4.062	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1cccc2[nH]ccc21)c1ccccc1	ZINC000187407383	333170615	/nfs/dbraw/zinc/17/06/15/333170615.db2.gz	VREAWOALKYEEEY-HNNXBMFYSA-N	0	0	290.366	4.466	20	30		CIEDRN
C[C@@H](NCc1ccc(Cl)cc1C#N)c1cccs1	ZINC000187493620	333171872	/nfs/dbraw/zinc/17/18/72/333171872.db2.gz	HGNACDFFRAURDV-SNVBAGLBSA-N	0	0	276.792	4.124	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(C)c(-c2ncco2)c1	ZINC000188851529	333174810	/nfs/dbraw/zinc/17/48/10/333174810.db2.gz	YURWDEGEPKIHSD-QGZVFWFLSA-N	0	0	284.359	4.191	20	30		CIEDRN
C=CCOc1cccc(CNc2ccccc2CCOC)c1	ZINC000188961427	333176662	/nfs/dbraw/zinc/17/66/62/333176662.db2.gz	AEUDLABFYYQNLE-UHFFFAOYSA-N	0	0	297.398	4.052	20	30		CIEDRN
C=CCCC(=O)NC(C)(C)Cc1ccc(C(F)(F)F)cc1	ZINC000189030699	333178611	/nfs/dbraw/zinc/17/86/11/333178611.db2.gz	AUXIMTTWXMMFRD-UHFFFAOYSA-N	0	0	299.336	4.109	20	30		CIEDRN
CSc1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[C@H](C#N)C1)CCC2	ZINC000572522628	333184902	/nfs/dbraw/zinc/18/49/02/333184902.db2.gz	IXVQDCRJJNAVIO-DXCKQFNASA-N	0	0	286.444	4.068	20	30		CIEDRN
C=CCCS[C@H](C)C(=O)Nc1ccc(C)cc1Cl	ZINC000575845561	335122833	/nfs/dbraw/zinc/12/28/33/335122833.db2.gz	RTPKEBAUEQRDEY-LLVKDONJSA-N	0	0	283.824	4.285	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)[C@@H]1C[C@H]1c1ccccc1C	ZINC000189911922	333200488	/nfs/dbraw/zinc/20/04/88/333200488.db2.gz	LNAUHMNWGJYTFN-DLBZAZTESA-N	0	0	298.430	4.029	20	30		CIEDRN
C=CCCCC(=O)N1CCc2c(cccc2C(C)C)C1	ZINC000189979269	333201234	/nfs/dbraw/zinc/20/12/34/333201234.db2.gz	BOARNTBBABJMLY-UHFFFAOYSA-N	0	0	271.404	4.051	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(Cc1c(F)cccc1F)C1CC1	ZINC000190021738	333201884	/nfs/dbraw/zinc/20/18/84/333201884.db2.gz	PDVWTHFAZKZGDE-LBPRGKRZSA-N	0	0	293.357	4.058	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)NCC=C(C)C	ZINC000190585303	333208568	/nfs/dbraw/zinc/20/85/68/333208568.db2.gz	ZIWPMELIIBBCSK-UHFFFAOYSA-N	0	0	298.839	4.065	20	30		CIEDRN
C=CCC1(C(=O)N[C@H](C)c2cc3ccccc3o2)CCC1	ZINC000190805309	333210735	/nfs/dbraw/zinc/21/07/35/333210735.db2.gz	YPMKWSDYFRDYTC-CYBMUJFWSA-N	0	0	283.371	4.356	20	30		CIEDRN
N#Cc1cccc(CNc2cc(Cl)ccc2F)c1F	ZINC000223728851	333211646	/nfs/dbraw/zinc/21/16/46/333211646.db2.gz	XVZBVYPWBOHQNE-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C[C@@H](SCc1ccc(C#N)cc1)c1cccc(C#N)c1	ZINC000190903140	333212137	/nfs/dbraw/zinc/21/21/37/333212137.db2.gz	ILHWDSFIFDAPPU-CYBMUJFWSA-N	0	0	278.380	4.424	20	30		CIEDRN
Cc1ncsc1CCS[C@@H](C)c1cccc(C#N)c1	ZINC000191025069	333213739	/nfs/dbraw/zinc/21/37/39/333213739.db2.gz	ZNZKQSKEFWDMSS-LBPRGKRZSA-N	0	0	288.441	4.360	20	30		CIEDRN
C=CCC1(C(=O)NCc2ccc(C(F)(F)F)cc2)CCC1	ZINC000191462337	333220238	/nfs/dbraw/zinc/22/02/38/333220238.db2.gz	SNBURPSJMCNSCL-UHFFFAOYSA-N	0	0	297.320	4.068	20	30		CIEDRN
CC[C@@H](C)CC(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1	ZINC000191541062	333221146	/nfs/dbraw/zinc/22/11/46/333221146.db2.gz	IOLYDKVFNSTYNL-NOZJJQNGSA-N	0	0	299.201	4.110	20	30		CIEDRN
Cc1ccc2c(c1)[C@@H](Nc1nccc(C)c1C#N)CCC2	ZINC000521937019	333224253	/nfs/dbraw/zinc/22/42/53/333224253.db2.gz	OCTIHLSRGSBNRS-KRWDZBQOSA-N	0	0	277.371	4.060	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(F)cc2Cl)CCC1	ZINC000191834604	333226108	/nfs/dbraw/zinc/22/61/08/333226108.db2.gz	OCJRDAQPQHUCMM-UHFFFAOYSA-N	0	0	267.731	4.164	20	30		CIEDRN
N#Cc1ccc(NCCCCCOC2CCCCC2)cc1	ZINC000521963416	333228205	/nfs/dbraw/zinc/22/82/05/333228205.db2.gz	ZBKBJPYSQHMWPH-UHFFFAOYSA-N	0	0	286.419	4.490	20	30		CIEDRN
CCC(C)(C)C1CCC2(C[C@H]2C(=O)NC(C)(C)C#N)CC1	ZINC000575889711	335128576	/nfs/dbraw/zinc/12/85/76/335128576.db2.gz	GPRURWFBFPIGET-FVRSWCFKSA-N	0	0	290.451	4.037	20	30		CIEDRN
CC(C)[C@@H](CC1CCCC1)C(=O)NCC(C)(C)CCC#N	ZINC000522027441	333230567	/nfs/dbraw/zinc/23/05/67/333230567.db2.gz	WABALLAIJACNCS-MRXNPFEDSA-N	0	0	292.467	4.285	20	30		CIEDRN
Cc1cc(C(=O)Nc2ccc(C#N)cc2Cl)sc1C	ZINC000225780826	333240467	/nfs/dbraw/zinc/24/04/67/333240467.db2.gz	JVSXHEBQKROEMC-UHFFFAOYSA-N	0	0	290.775	4.142	20	30		CIEDRN
N#Cc1cc(Cl)ccc1NCc1ccc2ncccc2c1	ZINC000193003224	333241355	/nfs/dbraw/zinc/24/13/55/333241355.db2.gz	YDQSPRUSJCDEBY-UHFFFAOYSA-N	0	0	293.757	4.372	20	30		CIEDRN
CCc1cccc2c(/C=C/c3ccc(C#N)cn3)c[nH]c21	ZINC000193446908	333250190	/nfs/dbraw/zinc/25/01/90/333250190.db2.gz	QXYAXPNKDVSVCC-VQHVLOKHSA-N	0	0	273.339	4.167	20	30		CIEDRN
CCC[C@@H](CC)NC(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000195363501	333251332	/nfs/dbraw/zinc/25/13/32/333251332.db2.gz	DLSOJWUXXGBWTQ-CQSZACIVSA-N	0	0	287.407	4.188	20	30		CIEDRN
Cc1csc(NC(=O)C[C@@H](C)C2CCCCC2)c1C#N	ZINC000564189011	333255458	/nfs/dbraw/zinc/25/54/58/333255458.db2.gz	IGXBPFDAMXLDOH-LLVKDONJSA-N	0	0	290.432	4.473	20	30		CIEDRN
C[C@H](CC(=O)Nc1ccc(C#N)cc1Cl)C(C)(C)C	ZINC000226345475	333257644	/nfs/dbraw/zinc/25/76/44/333257644.db2.gz	DDVXDWYTSYEZAH-SNVBAGLBSA-N	0	0	278.783	4.222	20	30		CIEDRN
CCCC(CCC)SCC(=O)Nc1ccc(C#N)cc1	ZINC000195735047	333262787	/nfs/dbraw/zinc/26/27/87/333262787.db2.gz	GUSIEUVFWQTZME-UHFFFAOYSA-N	0	0	290.432	4.199	20	30		CIEDRN
Cc1ccc(CC(=O)Nc2ccc(C(C)(C)C#N)cc2)s1	ZINC000194096445	333265336	/nfs/dbraw/zinc/26/53/36/333265336.db2.gz	ITWZIVDUDIMJCV-UHFFFAOYSA-N	0	0	298.411	4.039	20	30		CIEDRN
C[C@@H](Oc1ccc(C#N)c(Cl)c1)c1ccc(C#N)cc1	ZINC000194706661	333275929	/nfs/dbraw/zinc/27/59/29/333275929.db2.gz	FTEWZSYZBQBIMT-LLVKDONJSA-N	0	0	282.730	4.223	20	30		CIEDRN
CS[C@H]1CCC[C@@H](Nc2ccc(Cl)cc2C#N)C1	ZINC000227358035	333281805	/nfs/dbraw/zinc/28/18/05/333281805.db2.gz	UGQABLPTUVILGM-OLZOCXBDSA-N	0	0	280.824	4.298	20	30		CIEDRN
C=CCCC(=O)Nc1cccc(OCc2ccc(F)cc2)c1	ZINC000522473199	333287687	/nfs/dbraw/zinc/28/76/87/333287687.db2.gz	HLKQJGBDHXKEFB-UHFFFAOYSA-N	0	0	299.345	4.309	20	30		CIEDRN
C=CCCC(=O)N(CCc1ccccc1)Cc1ccccc1	ZINC000522476108	333287976	/nfs/dbraw/zinc/28/79/76/333287976.db2.gz	TZDKBEUMSDXGLR-UHFFFAOYSA-N	0	0	293.410	4.224	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(-c2nc(C)cs2)cc1	ZINC000522576689	333290778	/nfs/dbraw/zinc/29/07/78/333290778.db2.gz	YMQYGLMMMPTYHV-UHFFFAOYSA-N	0	0	272.373	4.023	20	30		CIEDRN
N#Cc1ccc(COc2cnc3ccccc3c2)c(Cl)c1	ZINC000228035302	333293140	/nfs/dbraw/zinc/29/31/40/333293140.db2.gz	OIWPGWMRQCCVLX-UHFFFAOYSA-N	0	0	294.741	4.339	20	30		CIEDRN
C=CC[C@H](C)NC(=O)C1(c2cccc(Cl)c2)CCCC1	ZINC000522643441	333294429	/nfs/dbraw/zinc/29/44/29/333294429.db2.gz	ZJXWENIJORCBQN-ZDUSSCGKSA-N	0	0	291.822	4.233	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)C1(c2cccc(F)c2)CCCCC1	ZINC000522645348	333294671	/nfs/dbraw/zinc/29/46/71/333294671.db2.gz	PKJRFWBDFLNFHT-CQSZACIVSA-N	0	0	289.394	4.108	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1ccc(C)c(C(F)(F)F)c1	ZINC000522660459	333295065	/nfs/dbraw/zinc/29/50/65/333295065.db2.gz	WZJIUMKVEWSEFV-JTQLQIEISA-N	0	0	286.297	4.100	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1ccc(OCCC)c(Cl)c1	ZINC000522654435	333295204	/nfs/dbraw/zinc/29/52/04/333295204.db2.gz	WWWLAUMGXDHSNL-LLVKDONJSA-N	0	0	296.798	4.215	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1ccc(OC(C)C)c(Cl)c1	ZINC000522661305	333295477	/nfs/dbraw/zinc/29/54/77/333295477.db2.gz	QNZZVGWFBVDWFN-LLVKDONJSA-N	0	0	296.798	4.213	20	30		CIEDRN
C[C@H](SCc1ccccc1[N+](=O)[O-])c1ccc(C#N)cc1	ZINC000522840619	333296550	/nfs/dbraw/zinc/29/65/50/333296550.db2.gz	VUAMEPVNRMDRED-LBPRGKRZSA-N	0	0	298.367	4.461	20	30		CIEDRN
Cc1cccc(Cl)c1OCc1ccc(F)cc1C#N	ZINC000522885583	333298566	/nfs/dbraw/zinc/29/85/66/333298566.db2.gz	GTBZUAQOUMKPLH-UHFFFAOYSA-N	0	0	275.710	4.238	20	30		CIEDRN
CC(C)[C@H](CC1CCCC1)C(=O)NCc1ccc(C#N)cc1	ZINC000522963729	333301721	/nfs/dbraw/zinc/30/17/21/333301721.db2.gz	CGLOZTOMHQMRHK-SFHVURJKSA-N	0	0	298.430	4.027	20	30		CIEDRN
C=CCCCN(C)C(=O)N[C@@H](CC(C)C)c1ccccc1	ZINC000522991366	333303657	/nfs/dbraw/zinc/30/36/57/333303657.db2.gz	GCYYCBQCTQVQTH-KRWDZBQOSA-N	0	0	288.435	4.381	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000523009353	333304411	/nfs/dbraw/zinc/30/44/11/333304411.db2.gz	XQTUWTSKDGRVSN-UHFFFAOYSA-N	0	0	287.190	4.423	20	30		CIEDRN
N#Cc1cc(COc2cccc(Cl)c2F)ccc1F	ZINC000229514092	333305814	/nfs/dbraw/zinc/30/58/14/333305814.db2.gz	QYUOZUQHMYRLKI-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
C=CCN(CCc1ccccc1)C(=O)CCC(C)(C)C	ZINC000523089830	333307494	/nfs/dbraw/zinc/30/74/94/333307494.db2.gz	JNBKJMQXFYXAPS-UHFFFAOYSA-N	0	0	273.420	4.070	20	30		CIEDRN
CC[C@H](Sc1ccc(C#N)cc1)C(=O)c1ccccc1	ZINC000523109941	333309329	/nfs/dbraw/zinc/30/93/29/333309329.db2.gz	GHYGNGJCFJLPDU-INIZCTEOSA-N	0	0	281.380	4.312	20	30		CIEDRN
C=CCCC(=O)N1CCC[C@@H](C)[C@H]1c1ccc(C)cc1	ZINC000523143458	333310997	/nfs/dbraw/zinc/31/09/97/333310997.db2.gz	CPBHKOUEPPJPQZ-QAPCUYQASA-N	0	0	271.404	4.261	20	30		CIEDRN
C=CCCC(=O)Nc1cccc(OCCC(C)C)c1	ZINC000523252901	333313433	/nfs/dbraw/zinc/31/34/33/333313433.db2.gz	GTBHFDMFBWYIMP-UHFFFAOYSA-N	0	0	261.365	4.016	20	30		CIEDRN
Cc1ccccc1C1(CNc2ccc(C#N)cc2)CC1	ZINC000523294984	333314569	/nfs/dbraw/zinc/31/45/69/333314569.db2.gz	OWULQRUZEOCDKB-UHFFFAOYSA-N	0	0	262.356	4.010	20	30		CIEDRN
Cc1cc(C#N)ccc1-c1nc(C2CCC(C)CC2)no1	ZINC000230997714	333323612	/nfs/dbraw/zinc/32/36/12/333323612.db2.gz	CJZKYJNPRCJLJR-UHFFFAOYSA-N	0	0	281.359	4.210	20	30		CIEDRN
C[C@@H](CC(=O)N(C)c1cccc(C#N)c1)C1CCCCC1	ZINC000523381792	333324944	/nfs/dbraw/zinc/32/49/44/333324944.db2.gz	KXHILFPEPVCHSH-AWEZNQCLSA-N	0	0	284.403	4.128	20	30		CIEDRN
C[C@H](CC(F)(F)F)Nc1ccc(C(F)(F)F)cc1C#N	ZINC000231749754	333329091	/nfs/dbraw/zinc/32/90/91/333329091.db2.gz	BRAVYGFKKSQWPL-SSDOTTSWSA-N	0	0	296.214	4.330	20	30		CIEDRN
C[C@H]1C[C@@H]1c1ccc(CNc2c(F)cc(C#N)cc2F)o1	ZINC000523478636	333329426	/nfs/dbraw/zinc/32/94/26/333329426.db2.gz	YSRHDAMDYDHCLO-CABZTGNLSA-N	0	0	288.297	4.165	20	30		CIEDRN
C=CCN(CC=C)C(=O)Cc1ccc(-c2ccccc2)cc1	ZINC000301324496	333329594	/nfs/dbraw/zinc/32/95/94/333329594.db2.gz	LHPIJWYGRHWYHY-UHFFFAOYSA-N	0	0	291.394	4.097	20	30		CIEDRN
C=CCCCCCN(C)C(=O)C1(c2ccccc2C)CC1	ZINC000523510890	333331311	/nfs/dbraw/zinc/33/13/11/333331311.db2.gz	IBLCCSXAMLQKGV-UHFFFAOYSA-N	0	0	285.431	4.231	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@H](SC)c1ccccc1	ZINC000523512823	333331624	/nfs/dbraw/zinc/33/16/24/333331624.db2.gz	UAXDSUMKOUFSOI-MRXNPFEDSA-N	0	0	291.460	4.296	20	30		CIEDRN
C=CCCSCc1nc(-c2ccc(CC)cc2)no1	ZINC000523520972	333331924	/nfs/dbraw/zinc/33/19/24/333331924.db2.gz	MGUHRKBDCIQTON-UHFFFAOYSA-N	0	0	274.389	4.108	20	30		CIEDRN
N#Cc1ccc(OCc2ccc(Cl)cc2F)c(F)c1	ZINC000232042981	333333218	/nfs/dbraw/zinc/33/32/18/333333218.db2.gz	DVQWVZLCLPDVSN-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
N#CC1(NC(=O)CCCC2CCCCC2)CCCCC1	ZINC000302379127	333334425	/nfs/dbraw/zinc/33/44/25/333334425.db2.gz	UHLLJEFYWIMDDU-UHFFFAOYSA-N	0	0	276.424	4.080	20	30		CIEDRN
COc1cc(CNc2cc(C)ccc2Cl)ccc1C#N	ZINC000232243974	333334754	/nfs/dbraw/zinc/33/47/54/333334754.db2.gz	WPDZNUIBRFZZGQ-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
C=CCNC(=O)[C@H](C)Sc1cc(C(C)(C)C)ccc1C	ZINC000302765921	333335016	/nfs/dbraw/zinc/33/50/16/333335016.db2.gz	HFFPPQDPLZSLCT-ZDUSSCGKSA-N	0	0	291.460	4.075	20	30		CIEDRN
C[C@H](CC1CCCCC1)C(=O)N(C)c1cccc(C#N)c1	ZINC000523676701	333337046	/nfs/dbraw/zinc/33/70/46/333337046.db2.gz	ZPRYWRWRRGHSIJ-CQSZACIVSA-N	0	0	284.403	4.128	20	30		CIEDRN
C[C@@H](CC1CCCCC1)C(=O)N(C)c1cccc(C#N)c1	ZINC000523676700	333337050	/nfs/dbraw/zinc/33/70/50/333337050.db2.gz	ZPRYWRWRRGHSIJ-AWEZNQCLSA-N	0	0	284.403	4.128	20	30		CIEDRN
Cc1cc(CNc2ccc(Cl)cc2C#N)ccc1F	ZINC000303226949	333339090	/nfs/dbraw/zinc/33/90/90/333339090.db2.gz	UGMBUSPGLQYMKR-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
CC[C@@H](CC(=O)Nc1ccc(Cl)c(C#N)c1)C(C)C	ZINC000303273841	333339587	/nfs/dbraw/zinc/33/95/87/333339587.db2.gz	KJZMTIBQABOUDT-NSHDSACASA-N	0	0	278.783	4.222	20	30		CIEDRN
Cn1c2ccccc2nc1S[C@H](C#N)C1CCCCC1	ZINC000523712473	333341208	/nfs/dbraw/zinc/34/12/08/333341208.db2.gz	WLCIEXQPCOFRHD-OAHLLOKOSA-N	0	0	285.416	4.138	20	30		CIEDRN
N#Cc1c(F)cccc1N1CCC[C@]2(CC=CCC2)C1	ZINC000303541381	333343672	/nfs/dbraw/zinc/34/36/72/333343672.db2.gz	HYLPPKWENZQWGF-QGZVFWFLSA-N	0	0	270.351	4.024	20	30		CIEDRN
C[C@H](Sc1nc2ccccc2n1C)c1ccc(C#N)cc1	ZINC000303702453	333345560	/nfs/dbraw/zinc/34/55/60/333345560.db2.gz	OFHRLEVFCBZZDD-LBPRGKRZSA-N	0	0	293.395	4.298	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@@H](CC(C)C)c1cccs1	ZINC000523949191	333349885	/nfs/dbraw/zinc/34/98/85/333349885.db2.gz	OGWCCHWLXJAPCJ-STQMWFEESA-N	0	0	280.437	4.099	20	30		CIEDRN
C=CCCC(=O)N(Cc1ccc(F)cc1)C1CCCCC1	ZINC000523955246	333350092	/nfs/dbraw/zinc/35/00/92/333350092.db2.gz	CKLFMXDANAZEBH-UHFFFAOYSA-N	0	0	289.394	4.453	20	30		CIEDRN
C=CC[C@H](C)NC(=O)c1cc2c(s1)-c1ccccc1CC2	ZINC000523961833	333350148	/nfs/dbraw/zinc/35/01/48/333350148.db2.gz	GWKLVEYZLQPWSR-LBPRGKRZSA-N	0	0	297.423	4.208	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)c1ccccc1N(C)c1ccccc1	ZINC000523960834	333350150	/nfs/dbraw/zinc/35/01/50/333350150.db2.gz	JUEUSKGPXSJVQO-OAHLLOKOSA-N	0	0	294.398	4.149	20	30		CIEDRN
C=CCCC(=O)N(CCCCC)Cc1ccc(F)cc1	ZINC000523954603	333350185	/nfs/dbraw/zinc/35/01/85/333350185.db2.gz	QNMMCPBGJPTTEL-UHFFFAOYSA-N	0	0	277.383	4.311	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)C(C)(C)CCCc1ccccc1	ZINC000523966353	333350329	/nfs/dbraw/zinc/35/03/29/333350329.db2.gz	POUGDDFZYDGURD-OAHLLOKOSA-N	0	0	273.420	4.116	20	30		CIEDRN
C[C@H](Sc1ccc(C#N)cc1)c1ccc(C#N)cc1	ZINC000524025492	333351972	/nfs/dbraw/zinc/35/19/72/333351972.db2.gz	NDIUNMLFYYRYOU-LBPRGKRZSA-N	0	0	264.353	4.283	20	30		CIEDRN
Cc1cc(COc2ccc(C#N)cc2C)c2ccccc2n1	ZINC000524050378	333352460	/nfs/dbraw/zinc/35/24/60/333352460.db2.gz	MKDQRCKYBXFUEO-UHFFFAOYSA-N	0	0	288.350	4.302	20	30		CIEDRN
CC(C)CC1(C)CCN(C(=O)C2(C#N)CCCCC2)CC1	ZINC000575961689	335135455	/nfs/dbraw/zinc/13/54/55/335135455.db2.gz	GIDQPDPRYQKMIP-UHFFFAOYSA-N	0	0	290.451	4.135	20	30		CIEDRN
CC(C)CC[C@@H](NC(=O)c1sccc1C#N)C(C)(C)C	ZINC000524185893	333355463	/nfs/dbraw/zinc/35/54/63/333355463.db2.gz	AOOLLTJJCAHJFK-CYBMUJFWSA-N	0	0	292.448	4.200	20	30		CIEDRN
C=CC[C@H](C)NC(=O)C1(c2ccccc2C)CCCCC1	ZINC000524194486	333356110	/nfs/dbraw/zinc/35/61/10/333356110.db2.gz	CUJQLOGJVZUCKI-INIZCTEOSA-N	0	0	285.431	4.278	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1ccc(OC2CCCC2)cc1	ZINC000524207407	333356506	/nfs/dbraw/zinc/35/65/06/333356506.db2.gz	DBHRMIZMWXPBQI-CYBMUJFWSA-N	0	0	288.391	4.094	20	30		CIEDRN
C=CCCCSc1nnc(C2CC2)n1-c1ccccc1	ZINC000524222143	333356569	/nfs/dbraw/zinc/35/65/69/333356569.db2.gz	HCEJGOKNBJOYDQ-UHFFFAOYSA-N	0	0	285.416	4.203	20	30		CIEDRN
C=CCCCSc1nncn1-c1ccc(C)c(Cl)c1	ZINC000524222362	333356644	/nfs/dbraw/zinc/35/66/44/333356644.db2.gz	QXSJXQJRXJUHQB-UHFFFAOYSA-N	0	0	293.823	4.287	20	30		CIEDRN
C[C@@H](CCNc1nccc(C#N)c1Cl)c1ccccc1	ZINC000235098456	333365962	/nfs/dbraw/zinc/36/59/62/333365962.db2.gz	VPCAJQPUPXUYKQ-LBPRGKRZSA-N	0	0	285.778	4.212	20	30		CIEDRN
C=CCCSCc1noc(-c2ccc(Cl)cc2)n1	ZINC000524604707	333368438	/nfs/dbraw/zinc/36/84/38/333368438.db2.gz	BTOSNQXFUPRJLJ-UHFFFAOYSA-N	0	0	280.780	4.199	20	30		CIEDRN
Cc1ccc([C@H](C)Nc2nccc(C#N)c2Cl)cc1F	ZINC000235538733	333370688	/nfs/dbraw/zinc/37/06/88/333370688.db2.gz	IVZBRWONIGUNBQ-JTQLQIEISA-N	0	0	289.741	4.227	20	30		CIEDRN
Cc1ccc(OCCCCC(C)(C)C#N)c([N+](=O)[O-])c1	ZINC000235781034	333372253	/nfs/dbraw/zinc/37/22/53/333372253.db2.gz	ZIZORFWUHKZJBN-UHFFFAOYSA-N	0	0	276.336	4.002	20	30		CIEDRN
N#Cc1ccnc(Sc2ccc(F)cc2F)c1Cl	ZINC000236161425	333373241	/nfs/dbraw/zinc/37/32/41/333373241.db2.gz	QIXKXSYKVDAWFV-UHFFFAOYSA-N	0	0	282.702	4.036	20	30		CIEDRN
COc1ccc(CC[C@@H](C)Nc2ccc(CC#N)cc2)cc1	ZINC000237250826	333378473	/nfs/dbraw/zinc/37/84/73/333378473.db2.gz	YXLJCEAOPGBLFK-OAHLLOKOSA-N	0	0	294.398	4.194	20	30		CIEDRN
N#Cc1ccc(CNc2ccccc2OC2CCCC2)cc1	ZINC000237844119	333381943	/nfs/dbraw/zinc/38/19/43/333381943.db2.gz	HXUJTMCHEOMAMS-UHFFFAOYSA-N	0	0	292.382	4.492	20	30		CIEDRN
Cc1ccccc1CN(C)c1cc(C#N)c2ccccc2n1	ZINC000315845708	333384142	/nfs/dbraw/zinc/38/41/42/333384142.db2.gz	FIDAAHAKJVIELL-UHFFFAOYSA-N	0	0	287.366	4.051	20	30		CIEDRN
N#Cc1ccc(N[C@H]2C[C@H]2c2c(F)cccc2Cl)cc1	ZINC000524842851	333389918	/nfs/dbraw/zinc/38/99/18/333389918.db2.gz	YFEHQJYJJBDPMF-DOMZBBRYSA-N	0	0	286.737	4.319	20	30		CIEDRN
C=CCCNc1cc([N+](=O)[O-])ccc1Nc1ccccc1	ZINC000525360080	333410014	/nfs/dbraw/zinc/41/00/14/333410014.db2.gz	SPPTYRIHMZGTEA-UHFFFAOYSA-N	0	0	283.331	4.326	20	30		CIEDRN
C=CCCCCS(=O)(=O)[C@H](C)c1ccc(Cl)cc1	ZINC000576003431	335140762	/nfs/dbraw/zinc/14/07/62/335140762.db2.gz	XMFLOWOUKAGXIN-GFCCVEGCSA-N	0	0	286.824	4.172	20	30		CIEDRN
C=CCCCCS(=O)(=O)[C@@H](C)c1ccc(Cl)cc1	ZINC000576003432	335140831	/nfs/dbraw/zinc/14/08/31/335140831.db2.gz	XMFLOWOUKAGXIN-LBPRGKRZSA-N	0	0	286.824	4.172	20	30		CIEDRN
CCC(C#N)(CC)C(=O)Nc1cccc(CC(F)(F)F)c1	ZINC000528695276	333452710	/nfs/dbraw/zinc/45/27/10/333452710.db2.gz	ZXSKKMHRJDOFHI-UHFFFAOYSA-N	0	0	298.308	4.060	20	30		CIEDRN
CCC(C#N)(CC)C(=O)Nc1cc(C(C)C)c(O)cc1C	ZINC000528875691	333462775	/nfs/dbraw/zinc/46/27/75/333462775.db2.gz	KWAXVZPWEQOZLR-UHFFFAOYSA-N	0	0	288.391	4.093	20	30		CIEDRN
CCN(C(=O)c1cccc(CC#N)c1)c1ccccc1Cl	ZINC000576021683	335142422	/nfs/dbraw/zinc/14/24/22/335142422.db2.gz	BHEQUEUIQIYTQI-UHFFFAOYSA-N	0	0	298.773	4.073	20	30		CIEDRN
N#CCc1ccc(NC2CC(c3cccc(F)c3)C2)cc1	ZINC000037071509	333472171	/nfs/dbraw/zinc/47/21/71/333472171.db2.gz	HBLZJHBSOYXVBD-UHFFFAOYSA-N	0	0	280.346	4.250	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)[C@@H]1[C@H](C)[C@@H]1C1CC1	ZINC000529270053	333480633	/nfs/dbraw/zinc/48/06/33/333480633.db2.gz	DNKQNRYXFMTKBH-CSMYWGQOSA-N	0	0	269.388	4.036	20	30		CIEDRN
Cc1ccc(NCc2cccc(C#N)c2)c2cccnc12	ZINC000037101321	333481717	/nfs/dbraw/zinc/48/17/17/333481717.db2.gz	QBGFPYLNEROVNA-UHFFFAOYSA-N	0	0	273.339	4.027	20	30		CIEDRN
CC(C)[C@H](Nc1ccc(C#N)cc1[N+](=O)[O-])c1ccccc1	ZINC000037122339	333487225	/nfs/dbraw/zinc/48/72/25/333487225.db2.gz	RGNRUUFXAGSPIB-KRWDZBQOSA-N	0	0	295.342	4.276	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(OC)c(O)c2ccccc12	ZINC000529543074	333495711	/nfs/dbraw/zinc/49/57/11/333495711.db2.gz	MTHDLFVZZMQHHH-LBPRGKRZSA-N	0	0	299.370	4.095	20	30		CIEDRN
N#Cc1ccc(OCCCSCc2ccccc2)cc1	ZINC000037139277	333497252	/nfs/dbraw/zinc/49/72/52/333497252.db2.gz	VHXPKUSRCHYGQF-UHFFFAOYSA-N	0	0	283.396	4.261	20	30		CIEDRN
C=CCOc1ccccc1CNc1cc(C)cc(C)c1	ZINC000037212421	333514865	/nfs/dbraw/zinc/51/48/65/333514865.db2.gz	AADXHIFMKSYCBW-UHFFFAOYSA-N	0	0	267.372	4.480	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cccc(C2CCOCC2)c1	ZINC000529935229	333514937	/nfs/dbraw/zinc/51/49/37/333514937.db2.gz	PQFLIKVPRLGCTG-UHFFFAOYSA-N	0	0	287.403	4.121	20	30		CIEDRN
C[C@@H](c1cccc(Cl)c1)N(C)c1ccc(C#N)cc1	ZINC000062016662	333526108	/nfs/dbraw/zinc/52/61/08/333526108.db2.gz	KOKXHFQIEDMFSB-LBPRGKRZSA-N	0	0	270.763	4.409	20	30		CIEDRN
CC(C)[C@H](C#N)c1ccc(-c2cnc(C3CC3)o2)cc1	ZINC000530251092	333530224	/nfs/dbraw/zinc/53/02/24/333530224.db2.gz	QBWCSZPMBUDKDQ-HNNXBMFYSA-N	0	0	266.344	4.482	20	30		CIEDRN
N#Cc1ccc(NCc2ccc3ccccc3n2)cc1Cl	ZINC000037393441	333532702	/nfs/dbraw/zinc/53/27/02/333532702.db2.gz	UUAYZMNVSRJRMN-UHFFFAOYSA-N	0	0	293.757	4.372	20	30		CIEDRN
CC(C)COc1cccc(NCc2ccc(C#N)cc2)c1	ZINC000037775773	333539294	/nfs/dbraw/zinc/53/92/94/333539294.db2.gz	FKLCHHNAONDKFX-UHFFFAOYSA-N	0	0	280.371	4.205	20	30		CIEDRN
N#Cc1cc(CNc2cc(Cl)ccc2F)ccc1F	ZINC000123763053	333552580	/nfs/dbraw/zinc/55/25/80/333552580.db2.gz	SDAZEBTZLSQYNM-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1ccc(C(C)C)nc1	ZINC000124261959	333557401	/nfs/dbraw/zinc/55/74/01/333557401.db2.gz	RKHDNSUKQIAIDO-UHFFFAOYSA-N	0	0	274.408	4.023	20	30		CIEDRN
N#Cc1cc(CNc2ccccc2OCC2CC2)ccc1F	ZINC000124605182	333560433	/nfs/dbraw/zinc/56/04/33/333560433.db2.gz	ZQLRULXAQMTNIC-UHFFFAOYSA-N	0	0	296.345	4.098	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)NCC1(CCC)CC1	ZINC000125280392	333565339	/nfs/dbraw/zinc/56/53/39/333565339.db2.gz	BHCDSXCJHAQIGD-UHFFFAOYSA-N	0	0	292.448	4.026	20	30		CIEDRN
C=C(CC)CS[C@H](C)C(=O)Nc1ccc(Cl)cc1	ZINC000537993582	333570009	/nfs/dbraw/zinc/57/00/09/333570009.db2.gz	XJIQKKPSAZJLHK-LLVKDONJSA-N	0	0	283.824	4.366	20	30		CIEDRN
C=CCN(C(=O)c1ccc(Cl)c(C#N)c1)c1ccccc1	ZINC000538267900	333582218	/nfs/dbraw/zinc/58/22/18/333582218.db2.gz	ZHBGQVVFJMOSDI-UHFFFAOYSA-N	0	0	296.757	4.044	20	30		CIEDRN
C=CCCOCCCCC(=O)N(CC)[C@H]1CCCC[C@H]1C	ZINC000538296759	333583712	/nfs/dbraw/zinc/58/37/12/333583712.db2.gz	LSZKLALJDAISGR-SJORKVTESA-N	0	0	295.467	4.177	20	30		CIEDRN
C=CCCOCCCCC(=O)NCC1CCC(C)(C)CC1	ZINC000538309317	333584908	/nfs/dbraw/zinc/58/49/08/333584908.db2.gz	UAZMDFZQNCCLJN-UHFFFAOYSA-N	0	0	295.467	4.082	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1ncsc1C(C)C	ZINC000576070065	335149088	/nfs/dbraw/zinc/14/90/88/335149088.db2.gz	JBWIGQUCJQPWKX-LLVKDONJSA-N	0	0	281.425	4.133	20	30		CIEDRN
CSc1ccc(C)c(NCCOc2ccc(C#N)cc2)c1	ZINC000538415873	333589742	/nfs/dbraw/zinc/58/97/42/333589742.db2.gz	MVFBDEQPYGSPKL-UHFFFAOYSA-N	0	0	298.411	4.080	20	30		CIEDRN
C=CCCOCCCCC(=O)N(C)[C@@H]1CCCC[C@@H]1CC	ZINC000538417962	333591207	/nfs/dbraw/zinc/59/12/07/333591207.db2.gz	WPUCGJYPQNYASJ-DLBZAZTESA-N	0	0	295.467	4.177	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2ccc3cc[nH]c3c2)no1	ZINC000576072037	335149354	/nfs/dbraw/zinc/14/93/54/335149354.db2.gz	SOJUOOBZPBZFPQ-NSHDSACASA-N	0	0	267.332	4.288	20	30		CIEDRN
C=CCOc1ccc(-c2nnc(SCCCC)o2)cc1	ZINC000126257349	333595480	/nfs/dbraw/zinc/59/54/80/333595480.db2.gz	NQYKSEAUCZUCHH-UHFFFAOYSA-N	0	0	290.388	4.194	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)c1cc(C)c(C)s1	ZINC000126364844	333596282	/nfs/dbraw/zinc/59/62/82/333596282.db2.gz	JXUMZSZHYYHUFZ-UHFFFAOYSA-N	0	0	291.441	4.255	20	30		CIEDRN
C=CCCCCCN(C)C(=O)NCCCc1cccs1	ZINC000538778879	333628686	/nfs/dbraw/zinc/62/86/86/333628686.db2.gz	BYCOANWHCHZFBJ-UHFFFAOYSA-N	0	0	294.464	4.069	20	30		CIEDRN
C=CCCCC(=O)N1[C@@H](C)Cc2cc(F)ccc2[C@@H]1C	ZINC000538798725	333631656	/nfs/dbraw/zinc/63/16/56/333631656.db2.gz	VLUNELDABMUJJI-STQMWFEESA-N	0	0	275.367	4.016	20	30		CIEDRN
C=CCN(C(=O)C/C=C/c1ccc(C(C)C)cc1)C1CC1	ZINC000539033285	333649702	/nfs/dbraw/zinc/64/97/02/333649702.db2.gz	ICXHUGVPCFMGRM-AATRIKPKSA-N	0	0	283.415	4.390	20	30		CIEDRN
C=CCN(C(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1)C1CC1	ZINC000539033699	333649728	/nfs/dbraw/zinc/64/97/28/333649728.db2.gz	RBRUEVNLAKVHNA-RBUKOAKNSA-N	0	0	291.394	4.120	20	30		CIEDRN
C=CCN(C(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1)C1CC1	ZINC000539033697	333649744	/nfs/dbraw/zinc/64/97/44/333649744.db2.gz	RBRUEVNLAKVHNA-MOPGFXCFSA-N	0	0	291.394	4.120	20	30		CIEDRN
C=C(CC)CNc1cccc(NC(=O)CCC)c1C	ZINC000539095003	333657671	/nfs/dbraw/zinc/65/76/71/333657671.db2.gz	JWVUXIKHXUCLDC-UHFFFAOYSA-N	0	0	260.381	4.112	20	30		CIEDRN
C=C(CC)CS[C@@H](C)C(=O)Nc1ccccc1CC	ZINC000539094786	333657687	/nfs/dbraw/zinc/65/76/87/333657687.db2.gz	MJBIBURZCWQYEX-ZDUSSCGKSA-N	0	0	277.433	4.275	20	30		CIEDRN
C=C(CC)CSCC(=O)N[C@@H](C)c1ccccc1Cl	ZINC000539094799	333657746	/nfs/dbraw/zinc/65/77/46/333657746.db2.gz	NISISINUJFVULH-LBPRGKRZSA-N	0	0	297.851	4.217	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)CC[C@H](C)SC)c1	ZINC000539121210	333659313	/nfs/dbraw/zinc/65/93/13/333659313.db2.gz	ZQRTVBZGUIKYKJ-ZDUSSCGKSA-N	0	0	293.432	4.112	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N1CCC[C@@H]1c1ccccc1	ZINC000539389457	333668822	/nfs/dbraw/zinc/66/88/22/333668822.db2.gz	IXXBUVLSTGIJBN-NVXWUHKLSA-N	0	0	286.419	4.278	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1sccc1C1CC1	ZINC000539522596	333676424	/nfs/dbraw/zinc/67/64/24/333676424.db2.gz	QFZYZAJIUCJEIQ-NSHDSACASA-N	0	0	263.406	4.100	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)[C@H]1CC[C@H](C)C1	ZINC000539548713	333678021	/nfs/dbraw/zinc/67/80/21/333678021.db2.gz	RXVUMDMEYAMKBY-RYUDHWBXSA-N	0	0	297.851	4.352	20	30		CIEDRN
C=C[C@@H](CC(=O)N(C)C1CCCCC1)c1ccccc1	ZINC000128574079	333688796	/nfs/dbraw/zinc/68/87/96/333688796.db2.gz	WGXWHQLOLJNDIR-HNNXBMFYSA-N	0	0	271.404	4.137	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)C1CCC(F)(F)CC1	ZINC000128687546	333699660	/nfs/dbraw/zinc/69/96/60/333699660.db2.gz	HKMWXJPFWIGTDD-UHFFFAOYSA-N	0	0	299.386	4.088	20	30		CIEDRN
C=CCCC(=O)Nc1cccc(-c2ccc3c(c2)CCO3)c1	ZINC000540101588	333709652	/nfs/dbraw/zinc/70/96/52/333709652.db2.gz	KXVGEBIUTQNOLN-UHFFFAOYSA-N	0	0	293.366	4.193	20	30		CIEDRN
C=CCN(C(=O)N[C@@H]1CCCC[C@@H]1c1ccccc1)C1CC1	ZINC000540110611	333710137	/nfs/dbraw/zinc/71/01/37/333710137.db2.gz	XBWPVGRTXNMMLI-QZTJIDSGSA-N	0	0	298.430	4.073	20	30		CIEDRN
C=CCN(C(=O)C[C@@H](C)c1ccc(C(C)C)cc1)C1CC1	ZINC000540133177	333711186	/nfs/dbraw/zinc/71/11/86/333711186.db2.gz	AWUCGIZWQILIMD-OAHLLOKOSA-N	0	0	285.431	4.481	20	30		CIEDRN
N#CCCC1CCN(C(=O)CCCC2CCCCC2)CC1	ZINC000576110055	335155857	/nfs/dbraw/zinc/15/58/57/335155857.db2.gz	FPNMHIQYUUVNJC-UHFFFAOYSA-N	0	0	290.451	4.279	20	30		CIEDRN
N#Cc1cc(NCc2cccc(Cl)c2)nc2ccccc12	ZINC000068770508	333728625	/nfs/dbraw/zinc/72/86/25/333728625.db2.gz	HPWZMKFRYOHGCO-UHFFFAOYSA-N	0	0	293.757	4.372	20	30		CIEDRN
Cc1cccc(C)c1NC(=O)c1ccc(Cl)c(C#N)c1	ZINC000540468650	333731307	/nfs/dbraw/zinc/73/13/07/333731307.db2.gz	SHJZWJUKAVOIHT-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N(C)C[C@@H](C)c1ccccc1	ZINC000540487799	333731955	/nfs/dbraw/zinc/73/19/55/333731955.db2.gz	AHVJQHKCPPSBEL-HZPDHXFCSA-N	0	0	288.435	4.176	20	30		CIEDRN
C=CCCOCCCCC(=O)NC1CCC(C(C)C)CC1	ZINC000540492432	333732246	/nfs/dbraw/zinc/73/22/46/333732246.db2.gz	XMBJBBYDQNEEFE-UHFFFAOYSA-N	0	0	295.467	4.080	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@H]1CCCC[C@H]1C(F)(F)F	ZINC000540531485	333733905	/nfs/dbraw/zinc/73/39/05/333733905.db2.gz	DTMRMTWCDSKNMH-RWMBFGLXSA-N	0	0	291.357	4.216	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)CCc1cc(C)cc(C)c1	ZINC000540533170	333734282	/nfs/dbraw/zinc/73/42/82/333734282.db2.gz	RMXIOLQWNPGFPR-INIZCTEOSA-N	0	0	273.420	4.097	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)CCCc1sccc1C	ZINC000540534342	333734303	/nfs/dbraw/zinc/73/43/03/333734303.db2.gz	JCZOEWPAZMWZJJ-AWEZNQCLSA-N	0	0	279.449	4.240	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1nc(-c2ccccc2)oc1C	ZINC000540539626	333734429	/nfs/dbraw/zinc/73/44/29/333734429.db2.gz	YGGRINOHRFNPKV-ZDUSSCGKSA-N	0	0	298.386	4.125	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1cccc(C)c1F)c1ccccc1	ZINC000540618582	333738604	/nfs/dbraw/zinc/73/86/04/333738604.db2.gz	QHZDDXUMQYNTRF-CQSZACIVSA-N	0	0	283.346	4.433	20	30		CIEDRN
CCOc1cccc(N[C@H](C)c2ccc(C#N)c(F)c2)c1	ZINC000540695494	333742207	/nfs/dbraw/zinc/74/22/07/333742207.db2.gz	UPGLEVCHBDDLNL-GFCCVEGCSA-N	0	0	284.334	4.269	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1ccc(C)c(C)c1Cl	ZINC000541239278	333767217	/nfs/dbraw/zinc/76/72/17/333767217.db2.gz	BZRULEJIWFPZAD-GFCCVEGCSA-N	0	0	279.811	4.431	20	30		CIEDRN
C=CCOc1ccc(OCc2nc(C3CC3)cs2)cc1	ZINC000541290094	333770596	/nfs/dbraw/zinc/77/05/96/333770596.db2.gz	GQDRIPWHHWSMLK-UHFFFAOYSA-N	0	0	287.384	4.164	20	30		CIEDRN
Cc1c(Cl)cnc(N[C@H](C)Cc2ccsc2)c1C#N	ZINC000541351323	333773714	/nfs/dbraw/zinc/77/37/14/333773714.db2.gz	YRLHOFGUTGHMHE-SECBINFHSA-N	0	0	291.807	4.020	20	30		CIEDRN
C=CCN(C(=O)C(C)(C)Cc1cccc(Cl)c1)C1CC1	ZINC000541592054	333783112	/nfs/dbraw/zinc/78/31/12/333783112.db2.gz	GCTAPEMYJUOFMA-UHFFFAOYSA-N	0	0	291.822	4.086	20	30		CIEDRN
C=CCOc1ccccc1CNCc1ccc([C@@H]2C[C@H]2C)o1	ZINC000069752715	333786814	/nfs/dbraw/zinc/78/68/14/333786814.db2.gz	JERCOBICDFPNQX-RHSMWYFYSA-N	0	0	297.398	4.258	20	30		CIEDRN
C=CCCCN(C)C(=O)c1ccc(-c2cccs2)o1	ZINC000542149248	333811942	/nfs/dbraw/zinc/81/19/42/333811942.db2.gz	AWHLVISNCZYLIM-UHFFFAOYSA-N	0	0	275.373	4.046	20	30		CIEDRN
CC(C)(C)c1cnc(SCc2cc(F)ccc2C#N)o1	ZINC000130093679	333813354	/nfs/dbraw/zinc/81/33/54/333813354.db2.gz	VFAQMELCUHQFKV-UHFFFAOYSA-N	0	0	290.363	4.275	20	30		CIEDRN
Cc1c(Cl)cnc(N2CCc3ccccc3[C@H]2C)c1C#N	ZINC000542210989	333816069	/nfs/dbraw/zinc/81/60/69/333816069.db2.gz	MCENWPHILOTFJK-GFCCVEGCSA-N	0	0	297.789	4.039	20	30		CIEDRN
N#Cc1cccc(CNc2c(F)cc(Cl)cc2F)c1F	ZINC000542224413	333817308	/nfs/dbraw/zinc/81/73/08/333817308.db2.gz	JXIQMOXIPOFZER-UHFFFAOYSA-N	0	0	296.679	4.241	20	30		CIEDRN
C=C[C@@H](CC(=O)NC[C@@H](C)c1ccccc1)c1ccccc1	ZINC000542561482	333832220	/nfs/dbraw/zinc/83/22/20/333832220.db2.gz	BLPFPEBXCRVGGI-SJORKVTESA-N	0	0	293.410	4.266	20	30		CIEDRN
Cc1nnc(SCC2CCCCCC2)c(C#N)c1C	ZINC000542766540	333839320	/nfs/dbraw/zinc/83/93/20/333839320.db2.gz	XEGVTMCQNYSQFR-UHFFFAOYSA-N	0	0	275.421	4.028	20	30		CIEDRN
C[C@H]1CCC[C@@H]1Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000071209378	333848835	/nfs/dbraw/zinc/84/88/35/333848835.db2.gz	GFHASAAOIBOKQY-ZANVPECISA-N	0	0	268.282	4.178	20	30		CIEDRN
N#CCC[C@H](NCc1ccc(F)cc1F)c1ccccc1	ZINC000130561302	333852385	/nfs/dbraw/zinc/85/23/85/333852385.db2.gz	YNIXBQAASQTIRO-KRWDZBQOSA-N	0	0	286.325	4.099	20	30		CIEDRN
CCOc1ccc(C#N)cc1N[C@@H](C)Cc1ccsc1	ZINC000543113579	333858153	/nfs/dbraw/zinc/85/81/53/333858153.db2.gz	OCZOGXWBWSBRJI-LBPRGKRZSA-N	0	0	286.400	4.062	20	30		CIEDRN
C=CCC[C@@H](C)Nc1cccc(OCCCC#N)c1	ZINC000130610657	333858716	/nfs/dbraw/zinc/85/87/16/333858716.db2.gz	IFLIXEOVDSVIFQ-CQSZACIVSA-N	0	0	258.365	4.136	20	30		CIEDRN
Cc1cccc([C@@H]2CCCN2c2nccc(C)c2C#N)c1C	ZINC000543135762	333859833	/nfs/dbraw/zinc/85/98/33/333859833.db2.gz	DIGKORJHKASDGG-SFHVURJKSA-N	0	0	291.398	4.220	20	30		CIEDRN
Cc1c(Cl)cnc(N2CCC[C@@H]2c2ccccc2)c1C#N	ZINC000543137466	333859986	/nfs/dbraw/zinc/85/99/86/333859986.db2.gz	OILRRVORCGMWGI-MRXNPFEDSA-N	0	0	297.789	4.257	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(NCc2ccc(C(C)C)cc2)c1	ZINC000543450101	333875844	/nfs/dbraw/zinc/87/58/44/333875844.db2.gz	ZSYUGGVXCMNJSW-UHFFFAOYSA-N	0	0	292.382	4.496	20	30		CIEDRN
C=CCN(C(=O)C1(c2cccs2)CCCCC1)C1CC1	ZINC000543450828	333875893	/nfs/dbraw/zinc/87/58/93/333875893.db2.gz	ZXTMUSXSWVRDSB-UHFFFAOYSA-N	0	0	289.444	4.127	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2ccc(C)cc2F)no1	ZINC000564268571	333877652	/nfs/dbraw/zinc/87/76/52/333877652.db2.gz	CLQIFRQPGQMKQX-LLVKDONJSA-N	0	0	260.312	4.254	20	30		CIEDRN
C=CCC1(c2nc(C[C@H](C)c3ccccc3)no2)CCC1	ZINC000564272442	333895708	/nfs/dbraw/zinc/89/57/08/333895708.db2.gz	REWPHNCMLGHMOA-AWEZNQCLSA-N	0	0	282.387	4.414	20	30		CIEDRN
C=CCC1(c2nc(C[C@@H](C)c3ccccc3)no2)CCC1	ZINC000564272443	333895791	/nfs/dbraw/zinc/89/57/91/333895791.db2.gz	REWPHNCMLGHMOA-CQSZACIVSA-N	0	0	282.387	4.414	20	30		CIEDRN
C=CCOc1cccc(NC(=O)N[C@@H](C)CCC(C)C)c1	ZINC000072025573	333895899	/nfs/dbraw/zinc/89/58/99/333895899.db2.gz	NQZONYRYVCOYKB-AWEZNQCLSA-N	0	0	290.407	4.198	20	30		CIEDRN
C=CCc1ccc(OCc2ccc(CC#N)cc2)c(OC)c1	ZINC000544081530	333915030	/nfs/dbraw/zinc/91/50/30/333915030.db2.gz	XYHNIGORQDKDMX-UHFFFAOYSA-N	0	0	293.366	4.069	20	30		CIEDRN
C=CCN(C(=O)c1cc(C(C)C)nc2ccccc21)C1CC1	ZINC000544416259	333930571	/nfs/dbraw/zinc/93/05/71/333930571.db2.gz	XKUHBTCWQWRDBX-UHFFFAOYSA-N	0	0	294.398	4.149	20	30		CIEDRN
CC(C)(C#N)c1ccccc1CNc1cccc([N+](=O)[O-])c1	ZINC000131402104	333934232	/nfs/dbraw/zinc/93/42/32/333934232.db2.gz	JHIQQNLJOFPIBK-UHFFFAOYSA-N	0	0	295.342	4.008	20	30		CIEDRN
Cc1ccc(C#N)cc1OCc1ncc(-c2cccs2)o1	ZINC000131531208	333946970	/nfs/dbraw/zinc/94/69/70/333946970.db2.gz	LKVOWOKWPXUTFT-UHFFFAOYSA-N	0	0	296.351	4.162	20	30		CIEDRN
C=C(C)CCc1noc(-c2ccc(OC)c(C3CC3)c2)n1	ZINC000564282303	333952172	/nfs/dbraw/zinc/95/21/72/333952172.db2.gz	HLTUIUZDCIEVCV-UHFFFAOYSA-N	0	0	284.359	4.131	20	30		CIEDRN
CC[C@H](CC#N)NC(=O)c1ccc(C2CCCCC2)cc1	ZINC000545156987	333965268	/nfs/dbraw/zinc/96/52/68/333965268.db2.gz	RJJXFKCJYKFYAN-QGZVFWFLSA-N	0	0	284.403	4.156	20	30		CIEDRN
Cc1ccc(Cl)c(NC(=O)c2ccc(C#N)cc2C)c1	ZINC000132234944	333975593	/nfs/dbraw/zinc/97/55/93/333975593.db2.gz	JTTMXVOYWJKGGZ-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
C=CCOc1ccc(CNc2nccc3sccc32)cc1	ZINC000545887520	334004256	/nfs/dbraw/zinc/00/42/56/334004256.db2.gz	FSZGEGJMTNWNQX-UHFFFAOYSA-N	0	0	296.395	4.473	20	30		CIEDRN
CC[C@@H](CC1CCCC1)C(=O)N(C)Cc1cccc(C#N)c1	ZINC000074435932	334005806	/nfs/dbraw/zinc/00/58/06/334005806.db2.gz	QMRRPTCEHKEQQZ-SFHVURJKSA-N	0	0	298.430	4.123	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@@H]1CCCc2ccccc21	ZINC000545924244	334006682	/nfs/dbraw/zinc/00/66/82/334006682.db2.gz	XFJOGJMOHWVZLT-WMLDXEAASA-N	0	0	271.404	4.125	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)N[C@@H]1CCC[C@H]1CC	ZINC000132860364	334008170	/nfs/dbraw/zinc/00/81/70/334008170.db2.gz	WEYWMODOJFDSFO-UKRRQHHQSA-N	0	0	292.448	4.024	20	30		CIEDRN
C=CCCCCNC(=O)Nc1cccc(Cl)c1Cl	ZINC000546031647	334013889	/nfs/dbraw/zinc/01/38/89/334013889.db2.gz	KNIJELHKETWMEH-UHFFFAOYSA-N	0	0	287.190	4.471	20	30		CIEDRN
Cc1ccc2c(cccc2OCc2ccc(C#N)cc2F)n1	ZINC000546072425	334015174	/nfs/dbraw/zinc/01/51/74/334015174.db2.gz	USNCKQXUUOUWMY-UHFFFAOYSA-N	0	0	292.313	4.133	20	30		CIEDRN
C=C[C@@H](CC(=O)N[C@H](CC)CC(F)(F)F)c1ccccc1	ZINC000546169447	334018032	/nfs/dbraw/zinc/01/80/32/334018032.db2.gz	UVWRTBFUNWQBQM-GXTWGEPZSA-N	0	0	299.336	4.194	20	30		CIEDRN
N#Cc1ccc(/C=C\c2nc(CC3=CCCCC3)no2)cc1	ZINC000546272965	334024254	/nfs/dbraw/zinc/02/42/54/334024254.db2.gz	ZIQRUYBOEVBALL-KHPPLWFESA-N	0	0	291.354	4.155	20	30		CIEDRN
C[C@@H]1CCC[C@@H](c2noc(-c3ccc(CC#N)cc3)n2)C1	ZINC000546349716	334028870	/nfs/dbraw/zinc/02/88/70/334028870.db2.gz	WZBBJDNYAMBICD-IUODEOHRSA-N	0	0	281.359	4.096	20	30		CIEDRN
C[C@H]1CCC[C@@H](c2noc(-c3ccc(CC#N)cc3)n2)C1	ZINC000546349717	334028913	/nfs/dbraw/zinc/02/89/13/334028913.db2.gz	WZBBJDNYAMBICD-SWLSCSKDSA-N	0	0	281.359	4.096	20	30		CIEDRN
C=CCCOCCCCc1nc([C@H]2CCC[C@H](C)C2)no1	ZINC000546358426	334029282	/nfs/dbraw/zinc/02/92/82/334029282.db2.gz	WGDQJZZDHWGKBW-GJZGRUSLSA-N	0	0	292.423	4.279	20	30		CIEDRN
C=CCCc1nc(-c2ccc3sccc3c2)no1	ZINC000546398551	334030783	/nfs/dbraw/zinc/03/07/83/334030783.db2.gz	KWCWJVKMZAMNHA-UHFFFAOYSA-N	0	0	256.330	4.070	20	30		CIEDRN
C[C@@H](c1noc([C@H](C)Oc2ccccc2C#N)n1)C(C)(C)C	ZINC000546418095	334031671	/nfs/dbraw/zinc/03/16/71/334031671.db2.gz	XEGGCZAXWVLSGO-RYUDHWBXSA-N	0	0	299.374	4.231	20	30		CIEDRN
CC(C)c1ccc(-c2nc(CN(C)CCC#N)cs2)cc1	ZINC000133268155	334032053	/nfs/dbraw/zinc/03/20/53/334032053.db2.gz	YGSZNVOGLLNHNA-UHFFFAOYSA-N	0	0	299.443	4.279	20	30		CIEDRN
Cc1ccccc1[C@H](C)c1noc(-c2ccc(C#N)s2)n1	ZINC000546542442	334037984	/nfs/dbraw/zinc/03/79/84/334037984.db2.gz	URLJXUGDLFDGFA-NSHDSACASA-N	0	0	295.367	4.130	20	30		CIEDRN
CCN(CCC#N)C(=O)C[C@H](C)c1ccc(C(C)C)cc1	ZINC000133406447	334040151	/nfs/dbraw/zinc/04/01/51/334040151.db2.gz	MSBWMQMLZBFIKD-HNNXBMFYSA-N	0	0	286.419	4.066	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc2oc(C(C)C)nc2c1	ZINC000546636145	334042779	/nfs/dbraw/zinc/04/27/79/334042779.db2.gz	PYOHEXDEZCJKBI-LBPRGKRZSA-N	0	0	286.375	4.492	20	30		CIEDRN
CC[C@H](CC(F)(F)F)Nc1ccc(Cl)cc1C#N	ZINC000546879852	334053435	/nfs/dbraw/zinc/05/34/35/334053435.db2.gz	NLOFEBWEKQAMEZ-SNVBAGLBSA-N	0	0	276.689	4.355	20	30		CIEDRN
Cc1ccc2oc(CN(CCC#N)Cc3ccco3)cc2c1	ZINC000133751511	334053681	/nfs/dbraw/zinc/05/36/81/334053681.db2.gz	MCDGVVWBMCYMLZ-UHFFFAOYSA-N	0	0	294.354	4.250	20	30		CIEDRN
C=CCCCc1nc(-c2ccc(Br)cc2)no1	ZINC000546939634	334055469	/nfs/dbraw/zinc/05/54/69/334055469.db2.gz	RPPOVXDVIOXNJS-UHFFFAOYSA-N	0	0	293.164	4.008	20	30		CIEDRN
C=CCCCc1nc(-c2ccccc2C(F)(F)F)no1	ZINC000546955906	334057728	/nfs/dbraw/zinc/05/77/28/334057728.db2.gz	JFKFCZXOJXIIQA-UHFFFAOYSA-N	0	0	282.265	4.264	20	30		CIEDRN
C=CCCCc1nc(-c2ccccc2OC(F)(F)F)no1	ZINC000547026935	334062815	/nfs/dbraw/zinc/06/28/15/334062815.db2.gz	VFEUHKQVEBXHRW-UHFFFAOYSA-N	0	0	298.264	4.144	20	30		CIEDRN
C=C[C@@H](Cc1nc(CCC(C)C)no1)c1ccccc1	ZINC000547121706	334067828	/nfs/dbraw/zinc/06/78/28/334067828.db2.gz	XKZHNKIOMRGKHA-AWEZNQCLSA-N	0	0	270.376	4.171	20	30		CIEDRN
C=CCCCc1nc([C@@H](C)c2c(F)cccc2F)no1	ZINC000547130544	334068321	/nfs/dbraw/zinc/06/83/21/334068321.db2.gz	PRIGRUSFNMGDBO-JTQLQIEISA-N	0	0	278.302	4.008	20	30		CIEDRN
C[C@H](c1noc(-c2ccc(C3(C#N)CC3)cc2)n1)C(C)(C)C	ZINC000547142838	334068893	/nfs/dbraw/zinc/06/88/93/334068893.db2.gz	GNVYJDVNMAGQPO-GFCCVEGCSA-N	0	0	295.386	4.441	20	30		CIEDRN
C[C@H](Cc1noc(C2(C#N)CCCCC2)n1)c1ccccc1	ZINC000547166943	334070433	/nfs/dbraw/zinc/07/04/33/334070433.db2.gz	JJBCPQNGJPWJFT-CQSZACIVSA-N	0	0	295.386	4.141	20	30		CIEDRN
C=CCC[C@H](NC(=O)Cc1ccsc1)c1ccccc1	ZINC000133985303	334076567	/nfs/dbraw/zinc/07/65/67/334076567.db2.gz	LLYUCWVJCYFBMY-INIZCTEOSA-N	0	0	285.412	4.114	20	30		CIEDRN
C=CCC[C@@H](NC(=O)CC1CCC1)c1ccccc1	ZINC000134016319	334077682	/nfs/dbraw/zinc/07/76/82/334077682.db2.gz	QTJMIQHEODWTBX-MRXNPFEDSA-N	0	0	257.377	4.000	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(Cl)c2cccnc12	ZINC000547341025	334081342	/nfs/dbraw/zinc/08/13/42/334081342.db2.gz	ZNUSUUQTZWICDR-NSHDSACASA-N	0	0	288.778	4.429	20	30		CIEDRN
CC[C@@H](C)N(C(=O)c1ccc(Cl)c(C#N)c1)[C@H](C)CC	ZINC000547348265	334082186	/nfs/dbraw/zinc/08/21/86/334082186.db2.gz	IHGFBVZTQCRSIR-VXGBXAGGSA-N	0	0	292.810	4.251	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1ccc2nc(C)ccc2c1	ZINC000134161964	334082582	/nfs/dbraw/zinc/08/25/82/334082582.db2.gz	QMIWHGUCXZCUED-UHFFFAOYSA-N	0	0	296.414	4.362	20	30		CIEDRN
CC(C)(C#N)c1ccccc1COc1ccc(C#N)cc1F	ZINC000134310508	334087701	/nfs/dbraw/zinc/08/77/01/334087701.db2.gz	NKRCGLCJQFCBBG-UHFFFAOYSA-N	0	0	294.329	4.078	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccc2c3c(cccc31)CC2	ZINC000077186452	334097793	/nfs/dbraw/zinc/09/77/93/334097793.db2.gz	QNCMFFQPAAZTPS-UHFFFAOYSA-N	0	0	294.398	4.368	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000077178738	334097798	/nfs/dbraw/zinc/09/77/98/334097798.db2.gz	ONARWFUSTNLXIP-UHFFFAOYSA-N	0	0	286.297	4.135	20	30		CIEDRN
C=CCCC(=O)CSc1nc2ccc(Cl)cc2o1	ZINC000134640336	334098645	/nfs/dbraw/zinc/09/86/45/334098645.db2.gz	PEHUBLSQVNQFJN-UHFFFAOYSA-N	0	0	281.764	4.109	20	30		CIEDRN
C=CCCC(=O)CSc1cc(C)c2ccccc2n1	ZINC000134649012	334099117	/nfs/dbraw/zinc/09/91/17/334099117.db2.gz	NTIYHYHGCAPCHG-UHFFFAOYSA-N	0	0	271.385	4.171	20	30		CIEDRN
N#Cc1cccc(NCc2csc(-c3ccccc3)n2)c1	ZINC000237849398	334100641	/nfs/dbraw/zinc/10/06/41/334100641.db2.gz	DTIITEDWKWCYKU-UHFFFAOYSA-N	0	0	291.379	4.294	20	30		CIEDRN
C=CCC[C@H](C(=O)N(CC1CC1)C(C)C)c1ccccc1	ZINC000547630038	334104139	/nfs/dbraw/zinc/10/41/39/334104139.db2.gz	YINBESKRBPHCEA-SFHVURJKSA-N	0	0	285.431	4.383	20	30		CIEDRN
CCC(=O)c1cccc(N[C@@H](C)c2ccc(C#N)cc2)c1	ZINC000135070230	334114494	/nfs/dbraw/zinc/11/44/94/334114494.db2.gz	GGFVUZOPDNDWOM-ZDUSSCGKSA-N	0	0	278.355	4.324	20	30		CIEDRN
CC(C)c1ccc(C(=O)Nc2ccc(F)cc2C#N)cc1	ZINC000135152066	334118021	/nfs/dbraw/zinc/11/80/21/334118021.db2.gz	PLQCKBCWMDKLNP-UHFFFAOYSA-N	0	0	282.318	4.073	20	30		CIEDRN
CC(C)(C)CN(CCC#N)Cc1ccccc1C(C)(C)C#N	ZINC000135215041	334119818	/nfs/dbraw/zinc/11/98/18/334119818.db2.gz	YHLFNAVIMOYDHP-UHFFFAOYSA-N	0	0	297.446	4.250	20	30		CIEDRN
CCCN(Cc1ccc(C#N)cc1)C(=O)CCC(C)(C)C	ZINC000078059454	334122974	/nfs/dbraw/zinc/12/29/74/334122974.db2.gz	VPMJMDMEZFQIOT-UHFFFAOYSA-N	0	0	286.419	4.123	20	30		CIEDRN
C=CCOc1cccc(NC(=O)[C@H](C)c2ccsc2)c1	ZINC000078087680	334123632	/nfs/dbraw/zinc/12/36/32/334123632.db2.gz	ZUTHAZLXRHUEAL-GFCCVEGCSA-N	0	0	287.384	4.055	20	30		CIEDRN
CC[C@H]1CCCC[C@@H]1N(C)C(=O)Nc1ccc(CC#N)cc1	ZINC000135360645	334127659	/nfs/dbraw/zinc/12/76/59/334127659.db2.gz	UFKFGOKNBKQQJC-RDJZCZTQSA-N	0	0	299.418	4.185	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1ccccc1SC(C)C	ZINC000135412711	334129256	/nfs/dbraw/zinc/12/92/56/334129256.db2.gz	FJCOYUXLKLHVMV-LBPRGKRZSA-N	0	0	278.421	4.273	20	30		CIEDRN
CC(C)CCC[C@H](C)NC(=O)Nc1ccc(CC#N)cc1	ZINC000078311877	334130583	/nfs/dbraw/zinc/13/05/83/334130583.db2.gz	IXALJBGCPKMRMH-AWEZNQCLSA-N	0	0	287.407	4.089	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H](C)c1cc2ccccc2o1	ZINC000135474196	334131147	/nfs/dbraw/zinc/13/11/47/334131147.db2.gz	KVMYGPKZSGEYGA-SJKOYZFVSA-N	0	0	271.360	4.212	20	30		CIEDRN
C=CC[C@@H](C(=O)NCCCC(C)(C)C)c1ccccc1	ZINC000547976930	334132809	/nfs/dbraw/zinc/13/28/09/334132809.db2.gz	APJCQSDFAOGGEO-MRXNPFEDSA-N	0	0	273.420	4.289	20	30		CIEDRN
CCc1ccc(NC(=O)N(CCC#N)CCC(C)C)cc1	ZINC000078453980	334133766	/nfs/dbraw/zinc/13/37/66/334133766.db2.gz	LANYEGBVWGUAAP-UHFFFAOYSA-N	0	0	287.407	4.043	20	30		CIEDRN
N#Cc1ccc(CN[C@@H](c2ccco2)c2ccccc2)s1	ZINC000135673199	334135828	/nfs/dbraw/zinc/13/58/28/334135828.db2.gz	FZXAKXUSCXFFNK-QGZVFWFLSA-N	0	0	294.379	4.092	20	30		CIEDRN
C[C@@H](c1ccccc1F)N(C)c1cccc(F)c1C#N	ZINC000078597949	334136970	/nfs/dbraw/zinc/13/69/70/334136970.db2.gz	ZRBISKCFRQGVIN-NSHDSACASA-N	0	0	272.298	4.034	20	30		CIEDRN
C[C@H](c1ccccc1F)N(C)c1cccc(F)c1C#N	ZINC000078597950	334136977	/nfs/dbraw/zinc/13/69/77/334136977.db2.gz	ZRBISKCFRQGVIN-LLVKDONJSA-N	0	0	272.298	4.034	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)CC1CCCCCC1	ZINC000135807652	334139085	/nfs/dbraw/zinc/13/90/85/334139085.db2.gz	CYJZQQBDAMRISV-UHFFFAOYSA-N	0	0	270.376	4.166	20	30		CIEDRN
N#Cc1ccc(C(F)(F)F)nc1NCCC1CCCCC1	ZINC000078833635	334141179	/nfs/dbraw/zinc/14/11/79/334141179.db2.gz	GDZPXMGBPJJSPJ-UHFFFAOYSA-N	0	0	297.324	4.354	20	30		CIEDRN
N#C[C@@H](Nc1cccc2cc[nH]c21)C1CCCCC1	ZINC000548134318	334141672	/nfs/dbraw/zinc/14/16/72/334141672.db2.gz	ORROZVOSUAPTOZ-OAHLLOKOSA-N	0	0	253.349	4.052	20	30		CIEDRN
CCc1cccc(NC(=O)c2ccc(C#N)c(Cl)c2)c1	ZINC000548278632	334148326	/nfs/dbraw/zinc/14/83/26/334148326.db2.gz	LUCOMTQERYDMFY-UHFFFAOYSA-N	0	0	284.746	4.026	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1ccc(SC)nc1)c1ccccc1	ZINC000548280053	334148416	/nfs/dbraw/zinc/14/84/16/334148416.db2.gz	FMCJRHRKNRXGBU-HNNXBMFYSA-N	0	0	298.411	4.102	20	30		CIEDRN
CCC[C@H]1CCCCN1C(=O)c1ccc(C#N)c(Cl)c1	ZINC000548288212	334148894	/nfs/dbraw/zinc/14/88/94/334148894.db2.gz	HEAUGXQJAHEKNW-AWEZNQCLSA-N	0	0	290.794	4.006	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@@H](C)c1cc(C)sc1C	ZINC000079336216	334151864	/nfs/dbraw/zinc/15/18/64/334151864.db2.gz	HHUWYTLHVZHRQK-LBPRGKRZSA-N	0	0	280.437	4.034	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(-c2c[nH]c3ccccc23)no1	ZINC000576264632	335179302	/nfs/dbraw/zinc/17/93/02/335179302.db2.gz	GVMKCPZHRIRQAT-INIZCTEOSA-N	0	0	267.332	4.072	20	30		CIEDRN
C=CCCSCc1c(Cl)cccc1[N+](=O)[O-]	ZINC000548619645	334163871	/nfs/dbraw/zinc/16/38/71/334163871.db2.gz	VFMPABWQBWGLQJ-UHFFFAOYSA-N	0	0	257.742	4.058	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)c1ccc(F)cc1C	ZINC000137152907	334170834	/nfs/dbraw/zinc/17/08/34/334170834.db2.gz	YCBNCKIBKXTFDW-UHFFFAOYSA-N	0	0	289.375	4.024	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1cccc(F)c1C)c1ccccc1	ZINC000137179798	334171092	/nfs/dbraw/zinc/17/10/92/334171092.db2.gz	BDMRFAMANYXZCG-AWEZNQCLSA-N	0	0	283.346	4.433	20	30		CIEDRN
C=CCN(CC=C)C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2	ZINC000243937337	334172312	/nfs/dbraw/zinc/17/23/12/334172312.db2.gz	RVMZFRHRGCNONH-HNNXBMFYSA-N	0	0	298.430	4.010	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)C[C@@H](C)n1cccc1	ZINC000548772115	334173570	/nfs/dbraw/zinc/17/35/70/334173570.db2.gz	VSFAKCVYRUIMCW-OAHLLOKOSA-N	0	0	282.387	4.197	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)C[C@H](C)n1cccc1	ZINC000548772113	334173643	/nfs/dbraw/zinc/17/36/43/334173643.db2.gz	VSFAKCVYRUIMCW-HNNXBMFYSA-N	0	0	282.387	4.197	20	30		CIEDRN
Fc1ccc(C(F)(F)F)cc1NCCC(F)(F)F	ZINC000080937028	334175464	/nfs/dbraw/zinc/17/54/64/334175464.db2.gz	SGSHKCQQRFONIM-UHFFFAOYSA-N	0	0	275.167	4.209	20	30		CIEDRN
C[C@H]1CC(CCNc2ccc(Cl)cc2C#N)C[C@H](C)O1	ZINC000549259860	334188979	/nfs/dbraw/zinc/18/89/79/334188979.db2.gz	PKQIVERPYCUDFT-RYUDHWBXSA-N	0	0	292.810	4.217	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N(C)Cc1ccc(C)o1	ZINC000549318081	334189900	/nfs/dbraw/zinc/18/99/00/334189900.db2.gz	OXZFQGHDIDURHK-UHFFFAOYSA-N	0	0	298.386	4.371	20	30		CIEDRN
C=CCCn1cc(Br)c(-c2ccc(F)cc2)n1	ZINC000549520833	334196145	/nfs/dbraw/zinc/19/61/45/334196145.db2.gz	RSQSJVYRZGUUCN-UHFFFAOYSA-N	0	0	295.155	4.028	20	30		CIEDRN
CCN(C(=O)CC(C)(C)C1CC1)[C@@H](C)c1ccc(C#N)cc1	ZINC000549560327	334197991	/nfs/dbraw/zinc/19/79/91/334197991.db2.gz	POVCXYIWGBFVQO-AWEZNQCLSA-N	0	0	298.430	4.294	20	30		CIEDRN
C=CCn1c(SCC=C(C)C)nnc1-c1ccoc1C	ZINC000549862574	334207229	/nfs/dbraw/zinc/20/72/29/334207229.db2.gz	UOXGUNOQGXSSEY-UHFFFAOYSA-N	0	0	289.404	4.091	20	30		CIEDRN
CO[C@H](CSCc1cccc(C#N)c1)c1ccccc1	ZINC000549954642	334210309	/nfs/dbraw/zinc/21/03/09/334210309.db2.gz	LIIYENZWRPTVOO-QGZVFWFLSA-N	0	0	283.396	4.179	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)N(CC)c1ccccc1Cl)OCC	ZINC000549958558	334210324	/nfs/dbraw/zinc/21/03/24/334210324.db2.gz	MMOPVYCZNLVMFW-OAHLLOKOSA-N	0	0	295.810	4.064	20	30		CIEDRN
C=CCn1c(S[C@@H]2C=CCCCCC2)nnc1C1CC1	ZINC000550004663	334211159	/nfs/dbraw/zinc/21/11/59/334211159.db2.gz	IYKQRJWMUORSMZ-CQSZACIVSA-N	0	0	289.448	4.323	20	30		CIEDRN
Cc1ccccc1[C@H](C)CC(=O)Nc1ccccc1CC#N	ZINC000550101814	334213194	/nfs/dbraw/zinc/21/31/94/334213194.db2.gz	VURWKGVBVMLCDF-OAHLLOKOSA-N	0	0	292.382	4.193	20	30		CIEDRN
Cc1ccccc1C(C)(C)NCc1ccc(F)cc1C#N	ZINC000550263509	334218001	/nfs/dbraw/zinc/21/80/01/334218001.db2.gz	PIOXZDOGPMAAAT-UHFFFAOYSA-N	0	0	282.362	4.031	20	30		CIEDRN
CC[C@H](CC(=O)N[C@@](C)(C#N)C1CCCCC1)C(C)C	ZINC000550351464	334220796	/nfs/dbraw/zinc/22/07/96/334220796.db2.gz	LLCVIFXHSGXLMT-PBHICJAKSA-N	0	0	278.440	4.037	20	30		CIEDRN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)CC1CC(C)(C)C1	ZINC000550500141	334223538	/nfs/dbraw/zinc/22/35/38/334223538.db2.gz	NOPDHXIEEYXSKC-UHFFFAOYSA-N	0	0	298.430	4.122	20	30		CIEDRN
CC1(C)CCC[C@@H](CC(=O)N2CCc3ccc(C#N)cc32)C1	ZINC000550522948	334223839	/nfs/dbraw/zinc/22/38/39/334223839.db2.gz	IATNRWRQYSKOGI-AWEZNQCLSA-N	0	0	296.414	4.054	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H]1CCC[C@@H]1c1ccccc1	ZINC000550628095	334225573	/nfs/dbraw/zinc/22/55/73/334225573.db2.gz	SVHZPPKPAIFWNQ-CVEARBPZSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000550628097	334225730	/nfs/dbraw/zinc/22/57/30/334225730.db2.gz	SVHZPPKPAIFWNQ-HZPDHXFCSA-N	0	0	271.404	4.041	20	30		CIEDRN
CC(C)(C)CCCC(=O)N[C@@](C)(C#N)C1CCCCC1	ZINC000550743001	334228124	/nfs/dbraw/zinc/22/81/24/334228124.db2.gz	NAWQDDMFNPCSPE-KRWDZBQOSA-N	0	0	278.440	4.182	20	30		CIEDRN
C[C@](C#N)(NC(=O)c1coc2ccccc21)C1CCCCC1	ZINC000550747284	334228224	/nfs/dbraw/zinc/22/82/24/334228224.db2.gz	BICDIPGMMMUAQF-GOSISDBHSA-N	0	0	296.370	4.025	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1c(C)[nH]c2ccccc21	ZINC000550921572	334233547	/nfs/dbraw/zinc/23/35/47/334233547.db2.gz	SPWSYSMPNQIFOH-UHFFFAOYSA-N	0	0	284.403	4.295	20	30		CIEDRN
CC(C)(C#N)CCOc1cnc2ccc(Cl)cc2c1	ZINC000550988406	334235368	/nfs/dbraw/zinc/23/53/68/334235368.db2.gz	NPCOJQYJPQVWQS-UHFFFAOYSA-N	0	0	274.751	4.207	20	30		CIEDRN
CCc1c(NCCCC(C)(C)C#N)cnn1CCC(C)C	ZINC000550987784	334235379	/nfs/dbraw/zinc/23/53/79/334235379.db2.gz	DHWTVXZBNXYOQO-UHFFFAOYSA-N	0	0	290.455	4.233	20	30		CIEDRN
N#Cc1cccc(CSCCCCCF)c1F	ZINC000551003537	334235945	/nfs/dbraw/zinc/23/59/45/334235945.db2.gz	LYHUEOJOGRXFJY-UHFFFAOYSA-N	0	0	255.333	4.070	20	30		CIEDRN
C=Cc1ccc(C(=O)Nc2sc(C)c(C)c2C#N)cc1	ZINC000551096837	334238702	/nfs/dbraw/zinc/23/87/02/334238702.db2.gz	DUCMQIQTQRDGJJ-UHFFFAOYSA-N	0	0	282.368	4.132	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H](C)Oc2cccc(F)c2)n1	ZINC000551109381	334238876	/nfs/dbraw/zinc/23/88/76/334238876.db2.gz	KFPIEOLLRJXYSE-LLVKDONJSA-N	0	0	290.338	4.202	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H]2C[C@@H]2c2ccc(F)cc2)n1	ZINC000551136919	334239210	/nfs/dbraw/zinc/23/92/10/334239210.db2.gz	RSSXCTAJGHCZDJ-KGLIPLIRSA-N	0	0	286.350	4.334	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ccc(C(F)(F)F)nc2)n1	ZINC000551136252	334239259	/nfs/dbraw/zinc/23/92/59/334239259.db2.gz	QCEHHIUCDIPOPA-UHFFFAOYSA-N	0	0	297.280	4.004	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H]2C[C@]23CCc2ccccc23)n1	ZINC000551140880	334239402	/nfs/dbraw/zinc/23/94/02/334239402.db2.gz	XNPKTTQXMSEJHF-KXBFYZLASA-N	0	0	294.398	4.295	20	30		CIEDRN
C=CCC(C)(C)c1noc(/C=C\c2cccc(F)c2)n1	ZINC000551142784	334239433	/nfs/dbraw/zinc/23/94/33/334239433.db2.gz	KSYZHYVKVCNLEL-HJWRWDBZSA-N	0	0	272.323	4.233	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H]2C[C@]23CCc2ccccc23)n1	ZINC000551140877	334239497	/nfs/dbraw/zinc/23/94/97/334239497.db2.gz	XNPKTTQXMSEJHF-BEFAXECRSA-N	0	0	294.398	4.295	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(Cc2cc3ccccc3o2)no1	ZINC000551183097	334240288	/nfs/dbraw/zinc/24/02/88/334240288.db2.gz	XXAKQIQNSAFQRD-QGZVFWFLSA-N	0	0	282.343	4.260	20	30		CIEDRN
CC[C@@H]1CCCC[C@H]1c1noc(-c2ccc(CC#N)cc2)n1	ZINC000551182961	334240290	/nfs/dbraw/zinc/24/02/90/334240290.db2.gz	SQGJJHNCAPSNDJ-GDBMZVCRSA-N	0	0	295.386	4.486	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(Cc2cc3ccccc3o2)no1	ZINC000551183096	334240291	/nfs/dbraw/zinc/24/02/91/334240291.db2.gz	XXAKQIQNSAFQRD-KRWDZBQOSA-N	0	0	282.343	4.260	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCCCCc1ccc(Cl)s1	ZINC000551305104	334245922	/nfs/dbraw/zinc/24/59/22/334245922.db2.gz	AUSJVQPBDJRNAW-GFCCVEGCSA-N	0	0	299.867	4.443	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1ccc(OC)c(Cl)c1	ZINC000551365028	334247939	/nfs/dbraw/zinc/24/79/39/334247939.db2.gz	HQIAPNYKNKRXPN-UHFFFAOYSA-N	0	0	295.810	4.167	20	30		CIEDRN
C=CCCCCCN(C)C(=O)CC(C)(C)C1CC1	ZINC000551365939	334248098	/nfs/dbraw/zinc/24/80/98/334248098.db2.gz	XXVHIHSNFCMYSB-UHFFFAOYSA-N	0	0	251.414	4.018	20	30		CIEDRN
CCC1(NC(=O)c2sc3ccc(C#N)cc3c2C)CCC1	ZINC000551390977	334248924	/nfs/dbraw/zinc/24/89/24/334248924.db2.gz	KMTQDIWJQDASKN-UHFFFAOYSA-N	0	0	298.411	4.144	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H]2C[C@@H]2c2cccc(OC)c2)n1	ZINC000551493511	334251559	/nfs/dbraw/zinc/25/15/59/334251559.db2.gz	YWGXJSSFUHEVGG-CABCVRRESA-N	0	0	298.386	4.203	20	30		CIEDRN
C=CCC(C)(C)c1noc(C[C@@H](CC#N)c2ccccc2)n1	ZINC000551493168	334251561	/nfs/dbraw/zinc/25/15/61/334251561.db2.gz	WDFYQBQPYQXDJW-OAHLLOKOSA-N	0	0	295.386	4.163	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cnc3c(F)cccc3c2)n1	ZINC000551498124	334251730	/nfs/dbraw/zinc/25/17/30/334251730.db2.gz	OAZQBAAMXXRXLJ-UHFFFAOYSA-N	0	0	297.333	4.278	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ncsc2C(C)C)n1	ZINC000551497653	334251769	/nfs/dbraw/zinc/25/17/69/334251769.db2.gz	BITYPIWBIHARNY-UHFFFAOYSA-N	0	0	277.393	4.170	20	30		CIEDRN
C[C@@H](C#N)CNCc1ccc(-c2ccc(Cl)cc2)cc1	ZINC000551552355	334254032	/nfs/dbraw/zinc/25/40/32/334254032.db2.gz	MCEPKOVQBPOEJK-ZDUSSCGKSA-N	0	0	284.790	4.256	20	30		CIEDRN
N#CC1(N(C(=O)CCCC2CCCCC2)C2CC2)CCC1	ZINC000551631127	334256456	/nfs/dbraw/zinc/25/64/56/334256456.db2.gz	ASVUEHOQASFNNE-UHFFFAOYSA-N	0	0	288.435	4.174	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NC(C)(C)c1ccc(Cl)cc1	ZINC000551695943	334257231	/nfs/dbraw/zinc/25/72/31/334257231.db2.gz	RBBKPZNRJDWELA-LBPRGKRZSA-N	0	0	279.811	4.294	20	30		CIEDRN
C=CCC[C@H](NCc1cc(F)ccc1F)c1ccco1	ZINC000552046837	334281050	/nfs/dbraw/zinc/28/10/50/334281050.db2.gz	ULLRDCKAYFKVDG-HNNXBMFYSA-N	0	0	277.314	4.355	20	30		CIEDRN
CC(C)[C@H]1CC[C@@H]1Nc1cccc(OCCCC#N)c1	ZINC000552061978	334283537	/nfs/dbraw/zinc/28/35/37/334283537.db2.gz	HVGAVDKONIWQQJ-SJORKVTESA-N	0	0	272.392	4.216	20	30		CIEDRN
CN(Cc1csc(Cl)c1Cl)CC(C)(C)C#N	ZINC000552084820	334287191	/nfs/dbraw/zinc/28/71/91/334287191.db2.gz	AJPHPZTZFQKYCT-UHFFFAOYSA-N	0	0	277.220	4.036	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)N[C@@H]1CCCc2ccc(C(C)C)cc21	ZINC000552135644	334293799	/nfs/dbraw/zinc/29/37/99/334293799.db2.gz	FTBAZOJIXGMIMP-MJGOQNOKSA-N	0	0	298.430	4.243	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)N[C@@H]1CCCc2ccc(C(C)C)cc21	ZINC000552135643	334293830	/nfs/dbraw/zinc/29/38/30/334293830.db2.gz	FTBAZOJIXGMIMP-IEBWSBKVSA-N	0	0	298.430	4.243	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@@H](C)Cn1ccc2ccccc21	ZINC000552152381	334295542	/nfs/dbraw/zinc/29/55/42/334295542.db2.gz	ZZHBCWWJTFUBPN-HOTGVXAUSA-N	0	0	298.430	4.138	20	30		CIEDRN
CN(Cc1ccc(-c2ccccc2)cc1)CC(C)(C)C#N	ZINC000552316757	334316299	/nfs/dbraw/zinc/31/62/99/334316299.db2.gz	LKOIEWYTCUBFIM-UHFFFAOYSA-N	0	0	278.399	4.335	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](c2ccccc2)[C@@H](C)C1	ZINC000249035275	334325477	/nfs/dbraw/zinc/32/54/77/334325477.db2.gz	CBDLIIGXLDEFBR-KVSKMBFKSA-N	0	0	285.431	4.241	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)N[C@H]1CC(C)(C)CCc2ccccc21	ZINC000552592687	334338380	/nfs/dbraw/zinc/33/83/80/334338380.db2.gz	RHFQMNDLCCGDAG-QFBILLFUSA-N	0	0	298.430	4.146	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)N[C@@H]1CC(C)(C)CCc2ccccc21	ZINC000552592688	334338395	/nfs/dbraw/zinc/33/83/95/334338395.db2.gz	RHFQMNDLCCGDAG-VQIMIIECSA-N	0	0	298.430	4.146	20	30		CIEDRN
C=CCN(CCC#N)C(=O)C/C=C/c1ccc(C(C)C)cc1	ZINC000552754948	334344133	/nfs/dbraw/zinc/34/41/33/334344133.db2.gz	PZWNBRKJSDXTST-FNORWQNLSA-N	0	0	296.414	4.142	20	30		CIEDRN
C=CCCC(=O)N1CCC[C@H]1c1ccc(C(C)C)cc1	ZINC000089355811	334344296	/nfs/dbraw/zinc/34/42/96/334344296.db2.gz	LENWUSHONXDNRW-KRWDZBQOSA-N	0	0	271.404	4.440	20	30		CIEDRN
N#Cc1ccnc(N2CCC[C@@H]2C2CCCCC2)c1Cl	ZINC000552953479	334352729	/nfs/dbraw/zinc/35/27/29/334352729.db2.gz	QTWUCIPKDATBQV-CQSZACIVSA-N	0	0	289.810	4.156	20	30		CIEDRN
C=CCOc1ccc(CNC(=O)[C@](C)(CC)CCC)cc1	ZINC000553063578	334359543	/nfs/dbraw/zinc/35/95/43/334359543.db2.gz	CLTKOANTPXMUKX-GOSISDBHSA-N	0	0	289.419	4.084	20	30		CIEDRN
Cc1nnc(S[C@@H]2CCCc3ccccc32)c(C#N)c1C	ZINC000553108459	334361936	/nfs/dbraw/zinc/36/19/36/334361936.db2.gz	LBYBLVQFLPARCE-MRXNPFEDSA-N	0	0	295.411	4.135	20	30		CIEDRN
Cc1ccc(C#N)c(N[C@@H](c2ccc(F)c(C)c2)C2CC2)n1	ZINC000553145185	334364690	/nfs/dbraw/zinc/36/46/90/334364690.db2.gz	RKDSPHHIEGUMAJ-QGZVFWFLSA-N	0	0	295.361	4.272	20	30		CIEDRN
C[C@@H]1CCN(c2nccc(C#N)c2Cl)[C@H]2CCCC[C@@H]12	ZINC000553152223	334365304	/nfs/dbraw/zinc/36/53/04/334365304.db2.gz	GNDIAPAVAHOJHC-XBFCOCLRSA-N	0	0	289.810	4.012	20	30		CIEDRN
Cc1occc1-c1noc(-c2ccc(C(C)(C)C#N)cc2)n1	ZINC000572534348	334366421	/nfs/dbraw/zinc/36/64/21/334366421.db2.gz	YBTRKRBDILDGIN-UHFFFAOYSA-N	0	0	293.326	4.106	20	30		CIEDRN
C=CCC[C@@H](Nc1cc(C#N)ccn1)c1ccccc1	ZINC000553172611	334366591	/nfs/dbraw/zinc/36/65/91/334366591.db2.gz	VDIBIJIGSBHCPS-MRXNPFEDSA-N	0	0	263.344	4.073	20	30		CIEDRN
C[C@H](Nc1cc(C#N)ccn1)c1cc2ccccc2s1	ZINC000553407875	334382918	/nfs/dbraw/zinc/38/29/18/334382918.db2.gz	CZTIYUGYHPGUAY-NSHDSACASA-N	0	0	279.368	4.341	20	30		CIEDRN
Cc1cc(C#N)nc(N[C@@H](c2ccccc2C)C(C)(C)C)n1	ZINC000553426946	334384084	/nfs/dbraw/zinc/38/40/84/334384084.db2.gz	OBCSOGRDIOQSTD-INIZCTEOSA-N	0	0	294.402	4.164	20	30		CIEDRN
CCC[C@@H](Nc1cc(C#N)ccn1)c1ccc(F)cc1F	ZINC000553443831	334385571	/nfs/dbraw/zinc/38/55/71/334385571.db2.gz	LXBVHWXONZGJGX-OAHLLOKOSA-N	0	0	287.313	4.185	20	30		CIEDRN
C=CCCCC(=O)N1C[C@@H](C)CC[C@@H]1c1ccccc1	ZINC000553510019	334389200	/nfs/dbraw/zinc/38/92/00/334389200.db2.gz	ORZSELNFKCSGKC-DOTOQJQBSA-N	0	0	271.404	4.343	20	30		CIEDRN
C=CC[C@H](C)NC(=O)CCCCCO[C@@H]1CCC[C@@H](C)C1	ZINC000163005591	334390729	/nfs/dbraw/zinc/39/07/29/334390729.db2.gz	KDLBDBXNYSMSKW-IXDOHACOSA-N	0	0	295.467	4.223	20	30		CIEDRN
C=CC[C@H](C)NC(=O)CCCCCO[C@H]1CCC[C@H](C)C1	ZINC000163005496	334390840	/nfs/dbraw/zinc/39/08/40/334390840.db2.gz	KDLBDBXNYSMSKW-ULQDDVLXSA-N	0	0	295.467	4.223	20	30		CIEDRN
C=CC[C@@H](C(=O)NC(C1CCC1)C1CCC1)c1ccccc1	ZINC000553628537	334393903	/nfs/dbraw/zinc/39/39/03/334393903.db2.gz	BUGBWBQTISYEKV-GOSISDBHSA-N	0	0	297.442	4.431	20	30		CIEDRN
Cc1ccnc(N2C[C@@H](C)CC[C@H]2c2ccccc2)c1C#N	ZINC000553675579	334395509	/nfs/dbraw/zinc/39/55/09/334395509.db2.gz	ZPTZZYDCSCAOMM-KSSFIOAISA-N	0	0	291.398	4.239	20	30		CIEDRN
C=CCC1(C(=O)NC[C@H](c2ccccc2)C2CC2)CCC1	ZINC000554124463	334413455	/nfs/dbraw/zinc/41/34/55/334413455.db2.gz	QZVTWRKLIVTOOG-QGZVFWFLSA-N	0	0	283.415	4.043	20	30		CIEDRN
CC(C)c1cccc(NC(=O)NCC(C)(C)CCC#N)c1	ZINC000554383138	334427343	/nfs/dbraw/zinc/42/73/43/334427343.db2.gz	AUWOYGIFZBLGCW-UHFFFAOYSA-N	0	0	287.407	4.261	20	30		CIEDRN
N#Cc1ccc(SCc2ccc(Cl)cn2)c(F)c1	ZINC000554425502	334429806	/nfs/dbraw/zinc/42/98/06/334429806.db2.gz	FPSXGMBRIRVOCM-UHFFFAOYSA-N	0	0	278.739	4.038	20	30		CIEDRN
Cc1csc(NC(=O)CCCC2CCCC2)c1C#N	ZINC000554774345	334451656	/nfs/dbraw/zinc/45/16/56/334451656.db2.gz	GTCZJPKGJLXVAG-UHFFFAOYSA-N	0	0	276.405	4.227	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(Cc2ccc(F)cc2Cl)no1	ZINC000554796216	334452913	/nfs/dbraw/zinc/45/29/13/334452913.db2.gz	LYDULTDBGPWPFY-OAHLLOKOSA-N	0	0	294.757	4.307	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2cc(OC3CCC3)ccn2)no1	ZINC000554806226	334453463	/nfs/dbraw/zinc/45/34/63/334453463.db2.gz	CTQNTJGHHMJMQK-GFCCVEGCSA-N	0	0	299.374	4.133	20	30		CIEDRN
C=CCC[C@H](CC)N[C@@H](C)c1noc(Cc2ccccc2)n1	ZINC000554867018	334457379	/nfs/dbraw/zinc/45/73/79/334457379.db2.gz	HNRLYRYNYQJDCK-HOCLYGCPSA-N	0	0	299.418	4.056	20	30		CIEDRN
CC(C)(C#N)CCCN1C[C@@H]2CCCCN2c2ccccc21	ZINC000555705095	334487908	/nfs/dbraw/zinc/48/79/08/334487908.db2.gz	IHOCXQZVLUROKR-INIZCTEOSA-N	0	0	297.446	4.195	20	30		CIEDRN
N#CCc1ccnc(NCc2csc(Cl)c2Cl)c1	ZINC000555759280	334488776	/nfs/dbraw/zinc/48/87/76/334488776.db2.gz	HIPKUFDGUWETLK-UHFFFAOYSA-N	0	0	298.198	4.128	20	30		CIEDRN
CC(C)C[C@@](C)(C#N)NC(=O)[C@@H](C)CC1CCCCC1	ZINC000555883273	334491097	/nfs/dbraw/zinc/49/10/97/334491097.db2.gz	UEFMSCKFQRIYSI-YOEHRIQHSA-N	0	0	278.440	4.037	20	30		CIEDRN
COc1cc(N[C@H](C)c2cccc(C#N)c2)cc(OC)c1C	ZINC000556210951	334499983	/nfs/dbraw/zinc/49/99/83/334499983.db2.gz	WFSQBCSEEOLGTH-CYBMUJFWSA-N	0	0	296.370	4.057	20	30		CIEDRN
C=CCC(F)(F)c1nc([C@@H]2CCCC[C@H]2C)no1	ZINC000556292198	334507052	/nfs/dbraw/zinc/50/70/52/334507052.db2.gz	IKBHFBXKPVDPIR-NXEZZACHSA-N	0	0	256.296	4.031	20	30		CIEDRN
C=CCC(F)(F)c1nc([C@@H]2CCCC[C@@H]2C)no1	ZINC000556292201	334507119	/nfs/dbraw/zinc/50/71/19/334507119.db2.gz	IKBHFBXKPVDPIR-VHSXEESVSA-N	0	0	256.296	4.031	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1cccc(Cl)c1Cl	ZINC000564700872	334517045	/nfs/dbraw/zinc/51/70/45/334517045.db2.gz	KGPVCFHXQSESCZ-SECBINFHSA-N	0	0	287.190	4.470	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc([C@@H]2CCN(C)c3ccccc32)no1	ZINC000565269680	334549178	/nfs/dbraw/zinc/54/91/78/334549178.db2.gz	LNDJGQIGHLQDQS-DZGCQCFKSA-N	0	0	297.402	4.111	20	30		CIEDRN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)CC1(C)CCCC1	ZINC000565443556	334564123	/nfs/dbraw/zinc/56/41/23/334564123.db2.gz	KOYNRHJKURKPOG-UHFFFAOYSA-N	0	0	298.430	4.266	20	30		CIEDRN
Cc1cc(C)cc(C(=O)N[C@@H](CCC#N)c2ccccc2)c1	ZINC000153204112	334570389	/nfs/dbraw/zinc/57/03/89/334570389.db2.gz	OSNZCHSJUBWHLZ-SFHVURJKSA-N	0	0	292.382	4.078	20	30		CIEDRN
Cc1nc(CSc2ccc(C#N)c(C)c2)sc1C	ZINC000565539397	334572328	/nfs/dbraw/zinc/57/23/28/334572328.db2.gz	NGORAHNAOMHYLR-UHFFFAOYSA-N	0	0	274.414	4.232	20	30		CIEDRN
N#Cc1ccc2c(c1)[C@@H](Nc1ccc3scnc3c1)CC2	ZINC000565745387	334593422	/nfs/dbraw/zinc/59/34/22/334593422.db2.gz	JEOMAXHXDVOCIM-HNNXBMFYSA-N	0	0	291.379	4.267	20	30		CIEDRN
C=C(C)CCc1noc(C(C2CCC2)C2CCC2)n1	ZINC000566340625	334643564	/nfs/dbraw/zinc/64/35/64/334643564.db2.gz	QMFLLNIEESBBRA-UHFFFAOYSA-N	0	0	260.381	4.262	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)c1cccc(C2CC2)c1	ZINC000566421232	334647632	/nfs/dbraw/zinc/64/76/32/334647632.db2.gz	LTKBOMIDLIJDNU-UHFFFAOYSA-N	0	0	284.403	4.108	20	30		CIEDRN
CO[C@@H](CSc1cccc(C#N)c1)c1ccccc1	ZINC000566902741	334668589	/nfs/dbraw/zinc/66/85/89/334668589.db2.gz	KMGVHLNOTYOPJX-INIZCTEOSA-N	0	0	269.369	4.038	20	30		CIEDRN
CC[C@@H](CC(=O)N[C@@H](CCC#N)c1ccccc1)C(C)C	ZINC000153639705	334675584	/nfs/dbraw/zinc/67/55/84/334675584.db2.gz	VQCBOTOHXMVUAL-RDJZCZTQSA-N	0	0	286.419	4.220	20	30		CIEDRN
C=CCN(C)C(=O)N[C@H](c1ccc(Cl)cc1)C1CCC1	ZINC000154489326	334695382	/nfs/dbraw/zinc/69/53/82/334695382.db2.gz	IIRIJEMHENNPJG-HNNXBMFYSA-N	0	0	292.810	4.009	20	30		CIEDRN
N#Cc1cnc2c(Cl)cccc2c1N[C@H]1CC[C@H](F)C1	ZINC000567264151	334699269	/nfs/dbraw/zinc/69/92/69/334699269.db2.gz	KNJMYANCICSVQN-QWRGUYRKSA-N	0	0	289.741	4.062	20	30		CIEDRN
CC[C@H](CC#N)NC(=O)Nc1ccccc1-c1ccccc1	ZINC000155514398	334722655	/nfs/dbraw/zinc/72/26/55/334722655.db2.gz	JYCGPXGTPCCWRB-OAHLLOKOSA-N	0	0	293.370	4.167	20	30		CIEDRN
Cc1cccc2c1ccnc2N[C@H]1CC[C@@H](CC#N)C1	ZINC000567497437	334725813	/nfs/dbraw/zinc/72/58/13/334725813.db2.gz	WYUVMXQTWUMBKP-KBPBESRZSA-N	0	0	265.360	4.038	20	30		CIEDRN
C=CCC[C@H](CC)Nc1ccc([C@@H]2CCOC2)cc1	ZINC000567573842	334735614	/nfs/dbraw/zinc/73/56/14/334735614.db2.gz	JFOWCZRZHMZCHC-CVEARBPZSA-N	0	0	259.393	4.347	20	30		CIEDRN
C=C(C)CNC(=O)N(C)[C@@H](C)[C@@H](C)c1ccc(Cl)cc1	ZINC000156362088	334740766	/nfs/dbraw/zinc/74/07/66/334740766.db2.gz	OKSSKJVIQFBGJM-OLZOCXBDSA-N	0	0	294.826	4.050	20	30		CIEDRN
COc1cc(C)c(N[C@H](C)c2cccc(C#N)c2)cc1OC	ZINC000271940147	334748161	/nfs/dbraw/zinc/74/81/61/334748161.db2.gz	LQMUNWUHMYIBCS-CYBMUJFWSA-N	0	0	296.370	4.057	20	30		CIEDRN
N#Cc1cc(Cl)cc(OC[C@H]2CCC3(CCCC3)O2)c1	ZINC000312891571	334755635	/nfs/dbraw/zinc/75/56/35/334755635.db2.gz	WMHNNQFFMDAOQK-CQSZACIVSA-N	0	0	291.778	4.082	20	30		CIEDRN
CC[C@H]1CCCCCN1C(=O)c1ccc(C#N)c(Cl)c1	ZINC000157485661	334772648	/nfs/dbraw/zinc/77/26/48/334772648.db2.gz	VXIKIQIUULPTQZ-AWEZNQCLSA-N	0	0	290.794	4.006	20	30		CIEDRN
C=CCCC(=O)Nc1cc(Cl)c(C)cc1Cl	ZINC000157709991	334781453	/nfs/dbraw/zinc/78/14/53/334781453.db2.gz	BPCLHTANKKQMPI-UHFFFAOYSA-N	0	0	258.148	4.207	20	30		CIEDRN
CC1(CC(=O)Nc2ccc(C#N)c(Cl)c2)CCCC1	ZINC000568039322	334787092	/nfs/dbraw/zinc/78/70/92/334787092.db2.gz	AHQKPPJDRXVULI-UHFFFAOYSA-N	0	0	276.767	4.121	20	30		CIEDRN
Cc1cc(=O)oc2cc(OCCCCC(C)(C)C#N)ccc12	ZINC000277802468	334817482	/nfs/dbraw/zinc/81/74/82/334817482.db2.gz	WLYQZVIDXIJXHB-UHFFFAOYSA-N	0	0	299.370	4.200	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc([C@@H](C)c2cccs2)no1	ZINC000568813191	334841811	/nfs/dbraw/zinc/84/18/11/334841811.db2.gz	REIFGBMWMDCKKR-QWRGUYRKSA-N	0	0	262.378	4.353	20	30		CIEDRN
C=CCCCNC(=O)N(CCCC)Cc1ccccc1F	ZINC000573194094	334915891	/nfs/dbraw/zinc/91/58/91/334915891.db2.gz	ONTYRQLPWRTFAL-UHFFFAOYSA-N	0	0	292.398	4.104	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(Cc2ccc(F)cc2C)no1	ZINC000573247509	334921291	/nfs/dbraw/zinc/92/12/91/334921291.db2.gz	UBNAQHXGDAZCSD-LBPRGKRZSA-N	0	0	274.339	4.178	20	30		CIEDRN
C[C@@H](C(=O)Nc1ccccc1C#N)c1ccc(Cl)s1	ZINC000175506036	335187110	/nfs/dbraw/zinc/18/71/10/335187110.db2.gz	JUWYGUFIDYDPLU-SECBINFHSA-N	0	0	290.775	4.015	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(-c2ccc3cc[nH]c3c2)no1	ZINC000576334833	335190622	/nfs/dbraw/zinc/19/06/22/335190622.db2.gz	JIYJWSRSGWKLSO-MRXNPFEDSA-N	0	0	267.332	4.072	20	30		CIEDRN
N#Cc1nc(SCc2c(F)cccc2F)ccc1Cl	ZINC000576440369	335203634	/nfs/dbraw/zinc/20/36/34/335203634.db2.gz	LTMIQAHAHCTMLY-UHFFFAOYSA-N	0	0	296.729	4.177	20	30		CIEDRN
CCCC[C@H](CC)CC(=O)NCC(C)(C)CCC#N	ZINC000576641792	335229836	/nfs/dbraw/zinc/22/98/36/335229836.db2.gz	VWMJYAMBYLTWLB-AWEZNQCLSA-N	0	0	266.429	4.039	20	30		CIEDRN
Cc1cc(NC(=O)N[C@H]2CC[C@@H](CC#N)C2)ccc1C1CC1	ZINC000576918568	335263691	/nfs/dbraw/zinc/26/36/91/335263691.db2.gz	SLRKUKVLYUULHA-BBRMVZONSA-N	0	0	297.402	4.076	20	30		CIEDRN
N#Cc1ccccc1CNc1ccc(-c2ccccn2)cc1	ZINC000577113127	335302080	/nfs/dbraw/zinc/30/20/80/335302080.db2.gz	IZWZIMVQUYKVKN-UHFFFAOYSA-N	0	0	285.350	4.232	20	30		CIEDRN
C[C@H](CCC(C)(C)C)Nc1ccc([N+](=O)[O-])cc1C#N	ZINC000380127142	335327743	/nfs/dbraw/zinc/32/77/43/335327743.db2.gz	SAOBWGYOVSHSMZ-LLVKDONJSA-N	0	0	275.352	4.093	20	30		CIEDRN
CCCCOc1cccc(NCc2ccc(C#N)s2)c1	ZINC000176953717	335344676	/nfs/dbraw/zinc/34/46/76/335344676.db2.gz	AYPHSOIMQPSMOE-UHFFFAOYSA-N	0	0	286.400	4.411	20	30		CIEDRN
C=CCN(C(=O)c1cc(C#N)ccc1Cl)c1ccccc1	ZINC000577415312	335350717	/nfs/dbraw/zinc/35/07/17/335350717.db2.gz	YBQPMFUSWOTQOD-UHFFFAOYSA-N	0	0	296.757	4.044	20	30		CIEDRN
COc1ccnc2c(NC3CCC(C)(C#N)CC3)cccc12	ZINC000577458935	335354332	/nfs/dbraw/zinc/35/43/32/335354332.db2.gz	SFXHSTMOQZLFFS-UHFFFAOYSA-N	0	0	295.386	4.128	20	30		CIEDRN
Cc1nc(CSc2cccc(C#N)c2)nc2ccccc12	ZINC000177098932	335360563	/nfs/dbraw/zinc/36/05/63/335360563.db2.gz	IORYIHDLVYFASV-UHFFFAOYSA-N	0	0	291.379	4.102	20	30		CIEDRN
N#Cc1csc(CNCc2ccc(Cl)cc2Cl)c1	ZINC000177680332	335378190	/nfs/dbraw/zinc/37/81/90/335378190.db2.gz	JUTPTQSCYBZEOR-UHFFFAOYSA-N	0	0	297.210	4.216	20	30		CIEDRN
CCCCOc1cccc(NCc2cc(C#N)cs2)c1	ZINC000177689216	335379224	/nfs/dbraw/zinc/37/92/24/335379224.db2.gz	NBRNVEJTUDHENO-UHFFFAOYSA-N	0	0	286.400	4.411	20	30		CIEDRN
CC[C@@H](Nc1cccc(F)c1)c1ccc(C#N)cc1	ZINC000577695145	335389532	/nfs/dbraw/zinc/38/95/32/335389532.db2.gz	YRUIBQKZBFDBBZ-MRXNPFEDSA-N	0	0	254.308	4.261	20	30		CIEDRN
C=CCN(C/C=C\c1ccc(F)c(F)c1)CC(F)(F)F	ZINC000577986267	335448789	/nfs/dbraw/zinc/44/87/89/335448789.db2.gz	ZMFKXSJBWHIENO-ARJAWSKDSA-N	0	0	291.263	4.028	20	30		CIEDRN
N#Cc1ccc(CNc2cccc(-c3cccs3)c2)o1	ZINC000178820406	335452519	/nfs/dbraw/zinc/45/25/19/335452519.db2.gz	XAPVEXUIPYNDNQ-UHFFFAOYSA-N	0	0	280.352	4.492	20	30		CIEDRN
CCN(C(=O)[C@@H]1C[C@@]1(C)CC)c1ccc(C#N)c(Cl)c1	ZINC000179526364	335498984	/nfs/dbraw/zinc/49/89/84/335498984.db2.gz	TWOKWDWHTFTGAH-XJKSGUPXSA-N	0	0	290.794	4.001	20	30		CIEDRN
C=CCC[C@H](NCc1nc(C(C)(C)C)no1)c1ccccc1	ZINC000180047350	335544726	/nfs/dbraw/zinc/54/47/26/335544726.db2.gz	XVKDJNYNFVZAJQ-HNNXBMFYSA-N	0	0	299.418	4.164	20	30		CIEDRN
CC(C)CCCS[C@@H](C)C(=O)Nc1ccccc1C#N	ZINC000180100992	335550506	/nfs/dbraw/zinc/55/05/06/335550506.db2.gz	UVDCIPALLFSXMS-ZDUSSCGKSA-N	0	0	290.432	4.055	20	30		CIEDRN
CC(C)(C)CN(CC(C)(C)C)C(=O)c1cc(C#N)cs1	ZINC000180632441	335614016	/nfs/dbraw/zinc/61/40/16/335614016.db2.gz	FOBRLBXJWAEVEV-UHFFFAOYSA-N	0	0	292.448	4.154	20	30		CIEDRN
C=C[C@@](C)(CCOC)c1nc([C@H]2CCCC(C)(C)C2)no1	ZINC000578367731	335621170	/nfs/dbraw/zinc/62/11/70/335621170.db2.gz	JTBFEHRFBDOZLY-GUYCJALGSA-N	0	0	292.423	4.234	20	30		CIEDRN
C[C@H](CCC(C)(C)C)NC(=O)c1ccc(C2(C#N)CC2)cc1	ZINC000180928884	335629887	/nfs/dbraw/zinc/62/98/87/335629887.db2.gz	WUGYJYJMOKURAO-CQSZACIVSA-N	0	0	298.430	4.186	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)NC(C)(C)C(C)C)c1	ZINC000579033221	335702843	/nfs/dbraw/zinc/70/28/43/335702843.db2.gz	GBKQBJOPNCJOID-UHFFFAOYSA-N	0	0	290.407	4.198	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N1CCC[C@H]1c1cccs1	ZINC000181429507	335761678	/nfs/dbraw/zinc/76/16/78/335761678.db2.gz	FPTVZKUHWMQXIL-KGLIPLIRSA-N	0	0	292.448	4.339	20	30		CIEDRN
COc1cccc(F)c1[C@@H](C)N[C@@H](C)c1cccc(C#N)c1	ZINC000181824134	335787130	/nfs/dbraw/zinc/78/71/30/335787130.db2.gz	YKSFFIODPZKFQF-QWHCGFSZSA-N	0	0	298.361	4.118	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)[C@H](c1ccccc1)C1CC1	ZINC000182608958	335830087	/nfs/dbraw/zinc/83/00/87/335830087.db2.gz	FBLPTZWQVFTRCY-RHSMWYFYSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)CCc1c[nH]c2ccc(C)cc12	ZINC000182650906	335834120	/nfs/dbraw/zinc/83/41/20/335834120.db2.gz	VKAXQDAJYJFGGI-OAHLLOKOSA-N	0	0	298.430	4.270	20	30		CIEDRN
C=CCC[C@@H](Nc1cccc(NC(=O)C(C)C)c1)C1CC1	ZINC000182945902	335852246	/nfs/dbraw/zinc/85/22/46/335852246.db2.gz	JCVHXPAZSYIWNW-QGZVFWFLSA-N	0	0	286.419	4.438	20	30		CIEDRN
C[C@H](C#N)CNCc1ccc(-c2ccccc2Cl)s1	ZINC000183821135	335907644	/nfs/dbraw/zinc/90/76/44/335907644.db2.gz	DMVUDMOKNGTWNQ-LLVKDONJSA-N	0	0	290.819	4.318	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H](SCC)C(C)C)n1	ZINC000580728645	335960369	/nfs/dbraw/zinc/96/03/69/335960369.db2.gz	DSRCLSZKIGPEGO-NSHDSACASA-N	0	0	268.426	4.374	20	30		CIEDRN
C[C@H](CCOc1cc(F)cc(C#N)c1)OCc1ccccc1	ZINC000581092906	336007552	/nfs/dbraw/zinc/00/75/52/336007552.db2.gz	DBRDRLDLCHSHCN-CQSZACIVSA-N	0	0	299.345	4.072	20	30		CIEDRN
C/C=C/c1ccc(NCc2cn3ccccc3c2C#N)cc1	ZINC000581276176	336035629	/nfs/dbraw/zinc/03/56/29/336035629.db2.gz	YGEYKVCYKYHZCC-GORDUTHDSA-N	0	0	287.366	4.456	20	30		CIEDRN
N#Cc1cc(Cl)cc(OC[C@@H]2CCCC2(F)F)c1	ZINC000381610212	336069439	/nfs/dbraw/zinc/06/94/39/336069439.db2.gz	IJQOFSQMSUJEKU-JTQLQIEISA-N	0	0	271.694	4.026	20	30		CIEDRN
N#Cc1ccc(CSCc2ccc(Cl)cc2)nc1	ZINC000581406371	336069888	/nfs/dbraw/zinc/06/98/88/336069888.db2.gz	QIVIXOXFMOTXBC-UHFFFAOYSA-N	0	0	274.776	4.040	20	30		CIEDRN
Cc1cc(Oc2nc(C)c(C#N)cc2Cl)ccc1F	ZINC000382262067	336085235	/nfs/dbraw/zinc/08/52/35/336085235.db2.gz	CRDSUUQPHJEPOY-UHFFFAOYSA-N	0	0	276.698	4.155	20	30		CIEDRN
C[C@@H](c1ccccc1)N(C)Cc1ccc(C#N)cc1Cl	ZINC000383898413	336119177	/nfs/dbraw/zinc/11/91/77/336119177.db2.gz	BWEWKFGYGRDIIC-ZDUSSCGKSA-N	0	0	284.790	4.405	20	30		CIEDRN
C=C(C)CS[C@H](C)C(=O)Nc1cccc2ccccc21	ZINC000581689032	336128609	/nfs/dbraw/zinc/12/86/09/336128609.db2.gz	ZBPBISRUDAPHED-CYBMUJFWSA-N	0	0	285.412	4.476	20	30		CIEDRN
C=CCC1(C(=O)N(CC)Cc2ccc(C)cc2)CCC1	ZINC000581701174	336129898	/nfs/dbraw/zinc/12/98/98/336129898.db2.gz	SFTOXMGVVRFCQH-UHFFFAOYSA-N	0	0	271.404	4.090	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1cc2ccccc2nc1C	ZINC000581717512	336136467	/nfs/dbraw/zinc/13/64/67/336136467.db2.gz	FPRGCJLVFIXPME-ZDUSSCGKSA-N	0	0	282.387	4.018	20	30		CIEDRN
N#Cc1ccc(CNc2ccccc2)c(C(F)(F)F)c1	ZINC000581755313	336142434	/nfs/dbraw/zinc/14/24/34/336142434.db2.gz	FWRVHVQMSOOMBQ-UHFFFAOYSA-N	0	0	276.261	4.189	20	30		CIEDRN
Cc1ccnc(N[C@@H](C)c2ccc(C#N)cc2)c1Cl	ZINC000581841576	336150653	/nfs/dbraw/zinc/15/06/53/336150653.db2.gz	PEYWYCAFXCYVNS-NSHDSACASA-N	0	0	271.751	4.088	20	30		CIEDRN
N#C[C@H](NC(=O)c1cccc2ccsc21)C1CCCCC1	ZINC000386228021	336168738	/nfs/dbraw/zinc/16/87/38/336168738.db2.gz	LOAMKMAGMHNHTI-HNNXBMFYSA-N	0	0	298.411	4.104	20	30		CIEDRN
N#Cc1ccc(NC(=O)c2cccc3ccsc32)cc1	ZINC000386229611	336168739	/nfs/dbraw/zinc/16/87/39/336168739.db2.gz	LXFUKIARJCWTNG-UHFFFAOYSA-N	0	0	278.336	4.025	20	30		CIEDRN
N#Cc1cc(N2CCC3(CCCC3)CC2)nc2ccccc12	ZINC000387201227	336187547	/nfs/dbraw/zinc/18/75/47/336187547.db2.gz	DCJUXGMUJPEGJN-UHFFFAOYSA-N	0	0	291.398	4.267	20	30		CIEDRN
C[C@H](CC1CCCCC1)NC(=O)[C@H]1CCCCC(=O)N1	ZINC000329865708	533775695	/nfs/dbraw/zinc/77/56/95/533775695.db2.gz	AMUBWEFARJLANQ-TZMCWYRMSA-N	0	0	280.412	4.201	20	30		CIEDRN
C[C@@H]1CCC[C@H](CCNC(=O)Cc2ccc3n[nH]cc3c2)C1	ZINC000330011864	533835273	/nfs/dbraw/zinc/83/52/73/533835273.db2.gz	JPTGTMGPJSQCSC-ZIAGYGMSSA-N	0	0	299.418	4.278	20	30		CIEDRN
COc1cccc2c1CC[C@H]2Nc1cc(Cl)ccc1C#N	ZINC000301651563	533874538	/nfs/dbraw/zinc/87/45/38/533874538.db2.gz	QENWKJKTUGIFBW-OAHLLOKOSA-N	0	0	298.773	4.320	20	30		CIEDRN
C[C@@H](SCC1(C#N)CC1)c1ccc(F)c(F)c1	ZINC000344490911	533989224	/nfs/dbraw/zinc/98/92/24/533989224.db2.gz	XRIACVXPMVNALT-SECBINFHSA-N	0	0	253.317	4.063	20	30		CIEDRN
C[C@@H]1C[C@H](c2cccnc2)N(c2c(Cl)cccc2C#N)C1	ZINC000302140874	534003541	/nfs/dbraw/zinc/00/35/41/534003541.db2.gz	OWASTJWXJGRCFM-MLGOLLRUSA-N	0	0	297.789	4.194	20	30		CIEDRN
C[C@H](Nc1ccc(C#N)nc1)c1cccc(C(F)(F)F)c1	ZINC000301501796	534021315	/nfs/dbraw/zinc/02/13/15/534021315.db2.gz	BDGJNEXIPZCGMQ-JTQLQIEISA-N	0	0	291.276	4.145	20	30		CIEDRN
CS[C@H]1CCC[C@@H](Nc2cc(C#N)nc3ccccc32)C1	ZINC000301406382	534092140	/nfs/dbraw/zinc/09/21/40/534092140.db2.gz	UXYUAXKSVAZJKI-OCCSQVGLSA-N	0	0	297.427	4.193	20	30		CIEDRN
C[C@H](SCC1(C#N)CC1)c1ccc(F)c(F)c1	ZINC000344490914	534123761	/nfs/dbraw/zinc/12/37/61/534123761.db2.gz	XRIACVXPMVNALT-VIFPVBQESA-N	0	0	253.317	4.063	20	30		CIEDRN
Cc1ccc(-c2ncc[nH]2)cc1NC(=O)[C@@H]1C[C@@H]1C1CC1	ZINC000330050165	534218426	/nfs/dbraw/zinc/21/84/26/534218426.db2.gz	KGCQHGLYAXMDHV-ZIAGYGMSSA-N	0	0	281.359	4.019	20	30		CIEDRN
Cc1ccc(C(=O)N[C@@H](CCCC#N)c2ccccc2)cc1	ZINC000352166580	534269873	/nfs/dbraw/zinc/26/98/73/534269873.db2.gz	OFDROKBIQDCHBA-SFHVURJKSA-N	0	0	292.382	4.160	20	30		CIEDRN
Cc1ccc(C(=O)N[C@@H](CCCC#N)c2ccccc2)s1	ZINC000352197721	534270017	/nfs/dbraw/zinc/27/00/17/534270017.db2.gz	CVJGOXIJMDEFRG-HNNXBMFYSA-N	0	0	298.411	4.222	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cnn(C(CC)CC)c1CC	ZINC000482702122	517315237	/nfs/dbraw/zinc/31/52/37/517315237.db2.gz	AIHFQESKXSQNFL-CYBMUJFWSA-N	0	0	291.439	4.347	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H]2CCC[C@H]2c2ccccc2)CCC1	ZINC000480107989	517322002	/nfs/dbraw/zinc/32/20/02/517322002.db2.gz	UGGRIBMNNHZWFS-DLBZAZTESA-N	0	0	283.415	4.185	20	30		CIEDRN
C=CCCCCCCNC(=O)C[C@H](C)c1c(C)noc1C	ZINC000287197233	517322847	/nfs/dbraw/zinc/32/28/47/517322847.db2.gz	URUSIWNSIAQMRB-ZDUSSCGKSA-N	0	0	292.423	4.038	20	30		CIEDRN
CC(C)c1cccc(N(C)C(=O)c2ccc(C#N)s2)c1	ZINC000486684489	517486778	/nfs/dbraw/zinc/48/67/78/517486778.db2.gz	MVZYDWBULUEABT-UHFFFAOYSA-N	0	0	284.384	4.020	20	30		CIEDRN
Cc1noc(C)c1CNC(=O)[C@@H]1CCC[C@@H]2CCCC[C@@H]12	ZINC000329006579	534331495	/nfs/dbraw/zinc/33/14/95/534331495.db2.gz	NBIMZPNSIWXMJK-RRFJBIMHSA-N	0	0	290.407	4.354	20	30		CIEDRN
O=C(Nc1ncc(C2CCCCC2)s1)[C@H]1CCCCO1	ZINC000329450608	534333400	/nfs/dbraw/zinc/33/34/00/534333400.db2.gz	LXOIDRHIVFJQLM-GFCCVEGCSA-N	0	0	294.420	4.348	20	30		CIEDRN
C[C@@H](SCc1ccccc1C#N)c1cccc(C#N)c1	ZINC000190778603	518178727	/nfs/dbraw/zinc/17/87/27/518178727.db2.gz	UEIRGQXKQZTYEB-CYBMUJFWSA-N	0	0	278.380	4.424	20	30		CIEDRN
CC(C)(C)c1cc(NC(=O)[C@H]2CC=CCC2)c(C#N)s1	ZINC000154263629	519002990	/nfs/dbraw/zinc/00/29/90/519002990.db2.gz	UKTCPKIGDICHOI-NSHDSACASA-N	0	0	288.416	4.212	20	30		CIEDRN
CC(C)[C@@H](c1ccccc1)N(C)C(=O)c1cc(C#N)cs1	ZINC000084110502	519801597	/nfs/dbraw/zinc/80/15/97/519801597.db2.gz	YDVGGYVRWXUDOC-INIZCTEOSA-N	0	0	298.411	4.089	20	30		CIEDRN
CCCCCCn1cc(C#N)c(=O)c2cc(Cl)ccc21	ZINC000103261271	520140094	/nfs/dbraw/zinc/14/00/94/520140094.db2.gz	ZEEBHKKTAUQZEI-UHFFFAOYSA-N	0	0	288.778	4.107	20	30		CIEDRN
CCOc1ccc(N[C@H](C)c2cccc(C#N)c2)cc1OC	ZINC000192996768	521138797	/nfs/dbraw/zinc/13/87/97/521138797.db2.gz	GPNXSFSGZOOYLJ-CYBMUJFWSA-N	0	0	296.370	4.139	20	30		CIEDRN
Cc1ccc2sc(C(=O)NC3(C#N)CCCCC3)cc2c1	ZINC000332220934	534541671	/nfs/dbraw/zinc/54/16/71/534541671.db2.gz	LXAIBTHBJIJSOL-UHFFFAOYSA-N	0	0	298.411	4.166	20	30		CIEDRN
Cc1oc2ccc(NC(=O)N[C@@H]3CC[C@@H](F)C3)cc2c1C	ZINC000329231946	534550994	/nfs/dbraw/zinc/55/09/94/534550994.db2.gz	FPRUCNITYGMMAF-VXGBXAGGSA-N	0	0	290.338	4.266	20	30		CIEDRN
CCCCc1nc(CSc2ccc(C#N)cn2)cs1	ZINC000298421440	521307488	/nfs/dbraw/zinc/30/74/88/521307488.db2.gz	OCKWFCNDLIJCOP-UHFFFAOYSA-N	0	0	289.429	4.045	20	30		CIEDRN
CCN(Cc1nc(C)c(C)s1)[C@@H](C)c1ccc(C#N)cc1	ZINC000081666131	521447933	/nfs/dbraw/zinc/44/79/33/521447933.db2.gz	OMGGZYDKECTEER-ZDUSSCGKSA-N	0	0	299.443	4.215	20	30		CIEDRN
CCS[C@H]1CCC[C@H]1Nc1ccc(C#N)c(Cl)c1	ZINC000226127683	521732273	/nfs/dbraw/zinc/73/22/73/521732273.db2.gz	BPKRBGYEWSGLNT-KGLIPLIRSA-N	0	0	280.824	4.298	20	30		CIEDRN
Cc1nc2c(cccc2C(=O)NC2(C)CCCCC2)o1	ZINC000329932096	534626360	/nfs/dbraw/zinc/62/63/60/534626360.db2.gz	AWRKVFJMYFBHBF-UHFFFAOYSA-N	0	0	272.348	4.164	20	30		CIEDRN
Cc1nc2cc(C(=O)N[C@H](C)C3CCCCC3)ccc2o1	ZINC000329923407	534637418	/nfs/dbraw/zinc/63/74/18/534637418.db2.gz	GZYAQEUSVMFVOK-LLVKDONJSA-N	0	0	286.375	4.410	20	30		CIEDRN
CC[C@@H](NC(=O)Nc1ccc(C#N)cc1)c1ccc(C)cc1	ZINC000337968992	522748136	/nfs/dbraw/zinc/74/81/36/522748136.db2.gz	RLTMHBQAZXXJGQ-QGZVFWFLSA-N	0	0	293.370	4.140	20	30		CIEDRN
Cc1cccc(C(C)C)c1NC(=O)c1cscc1C#N	ZINC000334513652	524243794	/nfs/dbraw/zinc/24/37/94/524243794.db2.gz	UDLJWFVMWVYDGG-UHFFFAOYSA-N	0	0	284.384	4.304	20	30		CIEDRN
Cc1cccc(C)c1[C@@H](C)Nc1ncc(C#N)cc1Cl	ZINC000302216335	524323566	/nfs/dbraw/zinc/32/35/66/524323566.db2.gz	JKGKSOVXKUNCQV-GFCCVEGCSA-N	0	0	285.778	4.397	20	30		CIEDRN
N#Cc1ccc(Cl)cc1NCCCNc1ccccc1	ZINC000302698216	534784639	/nfs/dbraw/zinc/78/46/39/534784639.db2.gz	ANKWKCWVISCCPB-UHFFFAOYSA-N	0	0	285.778	4.126	20	30		CIEDRN
Cc1ccc(CNc2ccc(Cl)cc2C#N)cc1	ZINC000052856892	524615666	/nfs/dbraw/zinc/61/56/66/524615666.db2.gz	NMWGDEJLBNTHSC-UHFFFAOYSA-N	0	0	256.736	4.132	20	30		CIEDRN
Cc1cc(Cl)c(C(C)C)cc1Oc1nccnc1C#N	ZINC000054380112	524846234	/nfs/dbraw/zinc/84/62/34/524846234.db2.gz	MZQRDNDBSHJXGA-UHFFFAOYSA-N	0	0	287.750	4.226	20	30		CIEDRN
Cc1cc(Cl)ccc1OCCCC(C)(C)C#N	ZINC000057713564	524904055	/nfs/dbraw/zinc/90/40/55/524904055.db2.gz	OTTKGLITGXZNPL-UHFFFAOYSA-N	0	0	251.757	4.357	20	30		CIEDRN
N#Cc1cccnc1Nc1cccc(N2CCCCCC2)c1	ZINC000301556561	534820671	/nfs/dbraw/zinc/82/06/71/534820671.db2.gz	SKQATWLRQHKKQP-UHFFFAOYSA-N	0	0	292.386	4.077	20	30		CIEDRN
Cc1ccccc1[C@H](C)CC(=O)Nc1sccc1C#N	ZINC000115974065	525402122	/nfs/dbraw/zinc/40/21/22/525402122.db2.gz	VAEMKASEAINMNA-GFCCVEGCSA-N	0	0	284.384	4.061	20	30		CIEDRN
Cc1ccc([C@@H](C)Nc2c(F)cc(C#N)cc2F)s1	ZINC000111143738	525749231	/nfs/dbraw/zinc/74/92/31/525749231.db2.gz	QJYCPFVGLNTPBE-SECBINFHSA-N	0	0	278.327	4.380	20	30		CIEDRN
Cc1nc(C)c(CNC(=O)C[C@@H](C)C2CCCCC2)o1	ZINC000329196423	534881508	/nfs/dbraw/zinc/88/15/08/534881508.db2.gz	UTSMXYIANPYHJD-LLVKDONJSA-N	0	0	278.396	4.354	20	30		CIEDRN
CS[C@@H]1CCC[C@@H](Nc2ccc(C#N)c(Cl)c2)C1	ZINC000227358476	525833125	/nfs/dbraw/zinc/83/31/25/525833125.db2.gz	KYCROBZDBRCWGO-DGCLKSJQSA-N	0	0	280.824	4.298	20	30		CIEDRN
CS[C@@H]1CCC[C@H](Nc2ccc(C#N)c(Cl)c2)C1	ZINC000227358487	525837401	/nfs/dbraw/zinc/83/74/01/525837401.db2.gz	KYCROBZDBRCWGO-WCQYABFASA-N	0	0	280.824	4.298	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N(C)[C@@H](C)c1cccs1	ZINC000058452167	525999278	/nfs/dbraw/zinc/99/92/78/525999278.db2.gz	BEKRYJXUMLRRBW-LBPRGKRZSA-N	0	0	299.399	4.153	20	30		CIEDRN
Cc1csc(CS[C@@H](C)c2ccc(C#N)cc2)n1	ZINC000088306825	526366273	/nfs/dbraw/zinc/36/62/73/526366273.db2.gz	DFRRBLZHHMWRAU-NSHDSACASA-N	0	0	274.414	4.318	20	30		CIEDRN
Cc1nnc(Oc2ccc(Cl)cc2Cl)c(C#N)c1C	ZINC000040217289	526376686	/nfs/dbraw/zinc/37/66/86/526376686.db2.gz	MQMOMERQGVQGII-UHFFFAOYSA-N	0	0	294.141	4.064	20	30		CIEDRN
Cc1nnc(Oc2ccc(Cl)c(Cl)c2)c(C#N)c1C	ZINC000040217299	526377311	/nfs/dbraw/zinc/37/73/11/526377311.db2.gz	XXVDTNZMHSVGEI-UHFFFAOYSA-N	0	0	294.141	4.064	20	30		CIEDRN
CNC(=O)c1cccc(NC(=O)C[C@H]2C=CCCC2)c1C	ZINC000330193459	526411116	/nfs/dbraw/zinc/41/11/16/526411116.db2.gz	OFBGCRQLOGIDEE-ZDUSSCGKSA-N	0	0	286.375	4.264	20	30		CIEDRN
Cc1nc(C(C)C)ccc1CSc1ccc(C#N)cn1	ZINC000338543450	526668975	/nfs/dbraw/zinc/66/89/75/526668975.db2.gz	PKLIFGOPZWNGHT-UHFFFAOYSA-N	0	0	283.400	4.072	20	30		CIEDRN
CC(C)(C)[C@@H]1NC(=O)CC[C@H]1NC(=O)[C@H]1CCCC1(C)C	ZINC000329212917	526681291	/nfs/dbraw/zinc/68/12/91/526681291.db2.gz	IQEONGWFESOGOV-YRGRVCCFSA-N	0	0	294.439	4.303	20	30		CIEDRN
CC(C)(C)[C@@H]1NC(=O)CC[C@H]1NC(=O)CC1=CCCCC1	ZINC000329172219	526681315	/nfs/dbraw/zinc/68/13/15/526681315.db2.gz	ACUJFYFWFNCJLC-CZUORRHYSA-N	0	0	292.423	4.367	20	30		CIEDRN
CC(C)(C)[C@H](Nc1cccc(C#N)n1)c1cccc(F)c1	ZINC000301824793	526711356	/nfs/dbraw/zinc/71/13/56/526711356.db2.gz	ILCQILDIQVATQI-MRXNPFEDSA-N	0	0	283.350	4.292	20	30		CIEDRN
CC(C)(C)[C@](C)(C#N)NC(=O)[C@@H]1CC[C@@H]2CCCC[C@H]2C1	ZINC000332714327	526742871	/nfs/dbraw/zinc/74/28/71/526742871.db2.gz	LYHUHIVPMBOPBM-AFIMGQEJSA-N	0	0	290.451	4.037	20	30		CIEDRN
N#Cc1sc(N2CCC[C@H]2c2cccs2)nc1Cl	ZINC000278465262	526800900	/nfs/dbraw/zinc/80/09/00/526800900.db2.gz	BPLHBLRCBCESRH-QMMMGPOBSA-N	0	0	295.820	4.071	20	30		CIEDRN
C=C(C)[C@H](Nc1cccc(F)n1)c1ccc(F)c(F)c1	ZINC000302381476	526821938	/nfs/dbraw/zinc/82/19/38/526821938.db2.gz	IDHAPISQJNCTSG-HNNXBMFYSA-N	0	0	278.277	4.228	20	30		CIEDRN
C=C(C)[C@H](Nc1ncc(C)s1)c1ccc(F)c(F)c1	ZINC000302899247	526822273	/nfs/dbraw/zinc/82/22/73/526822273.db2.gz	SEUFQFKNMLZUHA-ZDUSSCGKSA-N	0	0	280.343	4.459	20	30		CIEDRN
C=CCOc1ccc(CN(C)Cc2ccoc2)cc1Cl	ZINC000352649686	526862089	/nfs/dbraw/zinc/86/20/89/526862089.db2.gz	MXXHGMUQLRMUCH-UHFFFAOYSA-N	0	0	291.778	4.130	20	30		CIEDRN
C=CCOc1ccc(CNc2cc(C3CC3)ccn2)cc1	ZINC000353121754	526892116	/nfs/dbraw/zinc/89/21/16/526892116.db2.gz	PRPXFAUMPRCOTN-UHFFFAOYSA-N	0	0	280.371	4.136	20	30		CIEDRN
Cc1nc(CSCc2cccc(C#N)c2)sc1C	ZINC000088309534	526914182	/nfs/dbraw/zinc/91/41/82/526914182.db2.gz	DIRWHWIBDAJIRT-UHFFFAOYSA-N	0	0	274.414	4.065	20	30		CIEDRN
C=CCS[C@H](C)C(=O)Nc1ccccc1C(C)C	ZINC000114756900	527007845	/nfs/dbraw/zinc/00/78/45/527007845.db2.gz	VYKGOFRRELFQMW-GFCCVEGCSA-N	0	0	263.406	4.056	20	30		CIEDRN
C=CCC1(C(=O)N(C)c2ccc(OC(C)C)cc2)CCC1	ZINC000191650205	527038688	/nfs/dbraw/zinc/03/86/88/527038688.db2.gz	HRPFYNVWEIMKMA-UHFFFAOYSA-N	0	0	287.403	4.183	20	30		CIEDRN
C=CCCC1(C(=O)N[C@@H]2CCSc3ccccc32)CC1	ZINC000353676146	527093259	/nfs/dbraw/zinc/09/32/59/527093259.db2.gz	NINRDPQCHOEJPZ-CQSZACIVSA-N	0	0	287.428	4.086	20	30		CIEDRN
C=CCCC1(C(=O)N[C@H]2CCCc3ccc(C)cc32)CC1	ZINC000344664272	527094492	/nfs/dbraw/zinc/09/44/92/527094492.db2.gz	JRJMWOGYFYIUDA-KRWDZBQOSA-N	0	0	283.415	4.235	20	30		CIEDRN
C=CCCCC(=O)N[C@@H]1CCCc2sc(Cl)cc21	ZINC000344630681	527110157	/nfs/dbraw/zinc/11/01/57/527110157.db2.gz	QKOGTSLMHKDNBO-LLVKDONJSA-N	0	0	283.824	4.251	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)[C@@H](CC)CC(F)F)CCCC1(C)C	ZINC000457750096	527116828	/nfs/dbraw/zinc/11/68/28/527116828.db2.gz	BWISPKGDBFJHGP-STQMWFEESA-N	0	0	287.394	4.261	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(N(C)Cc2ccccc2Cl)c1	ZINC000302018425	527223707	/nfs/dbraw/zinc/22/37/07/527223707.db2.gz	GRPMUGMYAXOORH-UHFFFAOYSA-N	0	0	298.773	4.051	20	30		CIEDRN
C=CCCCSCC(=O)c1cc(C)n(C2CC2)c1C	ZINC000344566074	527247102	/nfs/dbraw/zinc/24/71/02/527247102.db2.gz	PJVNOCISNBVLBX-UHFFFAOYSA-N	0	0	277.433	4.322	20	30		CIEDRN
C=CCCCSCC(=O)N[C@@H](CCC)c1ccccc1	ZINC000344599205	527247998	/nfs/dbraw/zinc/24/79/98/527247998.db2.gz	DUXRJSIVGYXALK-INIZCTEOSA-N	0	0	291.460	4.343	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NCc1nc(CCC)no1	ZINC000352548026	527260164	/nfs/dbraw/zinc/26/01/64/527260164.db2.gz	MLUWBXPAKYVCKI-UHFFFAOYSA-N	0	0	299.418	4.486	20	30		CIEDRN
C=CCC[C@@H](NC(=O)Cc1ccsc1C)c1ccccc1	ZINC000345855707	527437911	/nfs/dbraw/zinc/43/79/11/527437911.db2.gz	LYRRKHJFCARTGL-QGZVFWFLSA-N	0	0	299.439	4.423	20	30		CIEDRN
C=CCCn1ccc(=O)c2cc(Oc3ccccc3)ccc21	ZINC000352208627	527530118	/nfs/dbraw/zinc/53/01/18/527530118.db2.gz	QSVGDANYTINWLJ-UHFFFAOYSA-N	0	0	291.350	4.370	20	30		CIEDRN
CC(C)(C)C[C@H](NC(=O)CC(C)(C)C#N)c1ccccc1	ZINC000351704558	527701423	/nfs/dbraw/zinc/70/14/23/527701423.db2.gz	CCGQFKNINYPWGS-HNNXBMFYSA-N	0	0	286.419	4.220	20	30		CIEDRN
CC(C)[C@H]1CC[C@@H](C)C[C@@H]1NC(=O)c1ocnc1C1CC1	ZINC000329324194	527807242	/nfs/dbraw/zinc/80/72/42/527807242.db2.gz	HYKDUSXFUOPOAU-BNOWGMLFSA-N	0	0	290.407	4.317	20	30		CIEDRN
CC(C)CCc1nc(CSCC2(C#N)CC2)cs1	ZINC000344468889	527870699	/nfs/dbraw/zinc/87/06/99/527870699.db2.gz	FRQBPZIEYFXYCW-UHFFFAOYSA-N	0	0	280.462	4.269	20	30		CIEDRN
CC(C)OCc1cccc(N[C@@H]2CCC[C@@H](C#N)C2)c1	ZINC000193086312	528041293	/nfs/dbraw/zinc/04/12/93/528041293.db2.gz	GNKYIPXVQIDPIQ-GDBMZVCRSA-N	0	0	272.392	4.106	20	30		CIEDRN
CC1=C(C(=O)Nc2cc(C#N)ccc2NC2CC2)CCC1	ZINC000329084904	528084105	/nfs/dbraw/zinc/08/41/05/528084105.db2.gz	FZONTYBNPCESAQ-UHFFFAOYSA-N	0	0	281.359	4.221	20	30		CIEDRN
CC(C)Oc1ccc(C#N)cc1NCc1ccsc1	ZINC000354855881	528136735	/nfs/dbraw/zinc/13/67/35/528136735.db2.gz	KSPHLDIURHTONS-UHFFFAOYSA-N	0	0	272.373	4.019	20	30		CIEDRN
CC(C)C[C@@H](C)C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000352217420	528247191	/nfs/dbraw/zinc/24/71/91/528247191.db2.gz	JQXUBJSOBVWKRB-NVXWUHKLSA-N	0	0	286.419	4.220	20	30		CIEDRN
CC(C)c1noc([C@@H](C)Sc2ccc(C#N)cc2F)n1	ZINC000356034640	528509968	/nfs/dbraw/zinc/50/99/68/528509968.db2.gz	BMMPMASJKWJZJI-SECBINFHSA-N	0	0	291.351	4.057	20	30		CIEDRN
CCN(C[C@@H](C)C#N)C(=O)c1cscc1-c1ccccc1	ZINC000353433037	528634847	/nfs/dbraw/zinc/63/48/47/528634847.db2.gz	SUVJFUJGXIESFV-ZDUSSCGKSA-N	0	0	298.411	4.037	20	30		CIEDRN
CC(C)[C@@H]1CCC[C@@H](NC(=O)Cc2ccc3n[nH]cc3c2)C1	ZINC000330031356	528676033	/nfs/dbraw/zinc/67/60/33/528676033.db2.gz	TVEVXCSSLOLOKM-GDBMZVCRSA-N	0	0	299.418	4.277	20	30		CIEDRN
CCOc1cccc([C@H](C)Nc2cccc(F)c2C#N)c1	ZINC000301069024	528691025	/nfs/dbraw/zinc/69/10/25/528691025.db2.gz	DRBBGPVJGCHKHF-LBPRGKRZSA-N	0	0	284.334	4.269	20	30		CIEDRN
CC(=O)Nc1cccc(C(=O)N[C@@H]2CC23CCCCC3)c1	ZINC000329104648	528747376	/nfs/dbraw/zinc/74/73/76/528747376.db2.gz	GTPNYVZDQQJDPO-OAHLLOKOSA-N	0	0	286.375	4.322	20	30		CIEDRN
CCC(CC)CN(CCC#N)C(=O)c1ccc(C)c(C)c1	ZINC000355206955	528747782	/nfs/dbraw/zinc/74/77/82/528747782.db2.gz	CXMHSAZBMFYHNA-UHFFFAOYSA-N	0	0	286.419	4.096	20	30		CIEDRN
CCCC[C@H](Nc1ncccc1C#N)c1ccc(OC)cc1	ZINC000301234969	528995885	/nfs/dbraw/zinc/99/58/85/528995885.db2.gz	CPZJALMKQDYIRG-KRWDZBQOSA-N	0	0	295.386	4.305	20	30		CIEDRN
CC[C@H](c1ccccc1)[C@@H]1CCCN1c1cccc(C#N)n1	ZINC000301874749	529183097	/nfs/dbraw/zinc/18/30/97/529183097.db2.gz	XZHGFPRPGDHMOT-MSOLQXFVSA-N	0	0	291.398	4.116	20	30		CIEDRN
CC[C@@H](c1ccccc1)[C@@H]1CCCN1c1cccc(C#N)n1	ZINC000301874751	529257471	/nfs/dbraw/zinc/25/74/71/529257471.db2.gz	XZHGFPRPGDHMOT-ROUUACIJSA-N	0	0	291.398	4.116	20	30		CIEDRN
CC[C@@H]1CCCC[C@H]1NC(=O)c1oc(CC2CC2)nc1C	ZINC000329997320	529284736	/nfs/dbraw/zinc/28/47/36/529284736.db2.gz	QIMUSKSBZYSKCO-ZIAGYGMSSA-N	0	0	290.407	4.209	20	30		CIEDRN
CC[C@H](CC1CCCCC1)C(=O)Nc1nncn1C1CC1	ZINC000329098664	529322329	/nfs/dbraw/zinc/32/23/29/529322329.db2.gz	CXZTUNWNVDLZLO-CYBMUJFWSA-N	0	0	290.411	4.198	20	30		CIEDRN
N#CCc1ccc(NCc2ccsc2Cl)cc1	ZINC000312558163	260148451	/nfs/dbraw/zinc/14/84/51/260148451.db2.gz	LEDHNUANZGVXJT-UHFFFAOYSA-N	0	0	262.765	4.080	20	30		CIEDRN
Cc1ccc(/C=C/C(=O)c2c[nH]c3ccccc23)cc1	ZINC000083192625	178354100	/nfs/dbraw/zinc/35/41/00/178354100.db2.gz	BCODXIOICRBUFT-ZHACJKMWSA-N	0	0	261.324	4.372	20	30		CIEDRN
CCc1cccc(C)c1NCc1ccccc1C#N	ZINC000083383462	178386429	/nfs/dbraw/zinc/38/64/29/178386429.db2.gz	JSUFPPLALQIZHR-UHFFFAOYSA-N	0	0	250.345	4.041	20	30		CIEDRN
N#Cc1ccc(CSCc2ccc(F)c(F)c2)cc1	ZINC000096953154	185140115	/nfs/dbraw/zinc/14/01/15/185140115.db2.gz	ZYBXCXMVNGVQCK-UHFFFAOYSA-N	0	0	275.323	4.270	20	30		CIEDRN
CC[C@@H]1C[C@H](C)CN1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000336045279	529438882	/nfs/dbraw/zinc/43/88/82/529438882.db2.gz	ZBGVPIDBYORGFZ-XJKSGUPXSA-N	0	0	299.418	4.140	20	30		CIEDRN
CC(C)(C#N)CCCOc1ccc(F)c(Cl)c1	ZINC000087609058	260192437	/nfs/dbraw/zinc/19/24/37/260192437.db2.gz	PICULNUSECERMM-UHFFFAOYSA-N	0	0	255.720	4.188	20	30		CIEDRN
CC(C)(C#N)c1ccccc1CSCCOC1CCC1	ZINC000573521802	334944276	/nfs/dbraw/zinc/94/42/76/334944276.db2.gz	VVVCSEGFDBVPEK-UHFFFAOYSA-N	0	0	289.444	4.290	20	30		CIEDRN
Cc1nsc(SC[C@H](C)c2ccccc2)c1C#N	ZINC000573638495	334954027	/nfs/dbraw/zinc/95/40/27/334954027.db2.gz	MIEVKQAXYWZPFX-JTQLQIEISA-N	0	0	274.414	4.219	20	30		CIEDRN
N#Cc1ccc(F)c(CNc2ccc(F)c(Cl)c2)c1	ZINC000097039405	185511599	/nfs/dbraw/zinc/51/15/99/185511599.db2.gz	OUEHFQFYRYJMSP-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(-c2ccccc2)c(C)n1	ZINC000573736606	334962221	/nfs/dbraw/zinc/96/22/21/334962221.db2.gz	BQRMOCBLPMMGGM-UHFFFAOYSA-N	0	0	280.371	4.352	20	30		CIEDRN
O=C1c2cc(Cl)ccc2OCC/C1=C/c1ccccc1	ZINC000103213616	185817565	/nfs/dbraw/zinc/81/75/65/185817565.db2.gz	RUEACKDVRAKDIG-RAXLEYEMSA-N	0	0	284.742	4.389	20	30		CIEDRN
C=CCCCCSCC(=O)Nc1c(C)cccc1C	ZINC000574299808	335008388	/nfs/dbraw/zinc/00/83/88/335008388.db2.gz	RYOMOCGGRSYZDZ-UHFFFAOYSA-N	0	0	277.433	4.331	20	30		CIEDRN
CCN(Cc1ccc2ccccc2c1)c1cc(C#N)ccn1	ZINC000574373571	335014187	/nfs/dbraw/zinc/01/41/87/335014187.db2.gz	USBXJRIQHIYCBE-UHFFFAOYSA-N	0	0	287.366	4.133	20	30		CIEDRN
CN(Cc1ccc(Oc2ccccc2)o1)CC(C)(C)C#N	ZINC000574387312	335015033	/nfs/dbraw/zinc/01/50/33/335015033.db2.gz	ZHSUWYGRFDPXER-UHFFFAOYSA-N	0	0	284.359	4.053	20	30		CIEDRN
C=CCCCCNc1cccc2c1CN(c1nccs1)C2	ZINC000574488678	335023484	/nfs/dbraw/zinc/02/34/84/335023484.db2.gz	INVKSQWGWXYASJ-UHFFFAOYSA-N	0	0	299.443	4.432	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H]2CCCc3c(O)cccc32)n1	ZINC000574657843	335037911	/nfs/dbraw/zinc/03/79/11/335037911.db2.gz	HKECCAJMPMTZNQ-CQSZACIVSA-N	0	0	298.386	4.097	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000190258692	262181379	/nfs/dbraw/zinc/18/13/79/262181379.db2.gz	CEIZVAZTYZSORV-QGZVFWFLSA-N	0	0	270.376	4.029	20	30		CIEDRN
C=CCCCCSCCCC1(C#N)CCOCC1	ZINC000575028411	335057049	/nfs/dbraw/zinc/05/70/49/335057049.db2.gz	WRACFJFWIIDRBU-UHFFFAOYSA-N	0	0	267.438	4.176	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)C[C@@H](C)c1ccccc1F	ZINC000171160152	335057050	/nfs/dbraw/zinc/05/70/50/335057050.db2.gz	YRTAGPUQUGRPPT-CYBMUJFWSA-N	0	0	296.345	4.138	20	30		CIEDRN
C=C(C)[C@H](NCc1nc(C)cs1)c1ccc(F)c(F)c1	ZINC000187373464	260033316	/nfs/dbraw/zinc/03/33/16/260033316.db2.gz	RKLBPVAJRYBARS-HNNXBMFYSA-N	0	0	294.370	4.137	20	30		CIEDRN
N#Cc1ccncc1C(=O)NC1CCC2(CCCCC2)CC1	ZINC000329242291	227375920	/nfs/dbraw/zinc/37/59/20/227375920.db2.gz	SGYDKQNEDSGOPY-UHFFFAOYSA-N	0	0	297.402	4.151	20	30		CIEDRN
N#Cc1c(NCC2CCSCC2)cccc1C(F)F	ZINC000575071851	335061984	/nfs/dbraw/zinc/06/19/84/335061984.db2.gz	IZNKOBDCRYPCPU-UHFFFAOYSA-N	0	0	282.359	4.051	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@@H](C)c1cc2ccccc2s1	ZINC000182756863	260054779	/nfs/dbraw/zinc/05/47/79/260054779.db2.gz	IQGDRMHLQDWCAI-LBPRGKRZSA-N	0	0	288.416	4.180	20	30		CIEDRN
C[C@@H](Nc1cc(Cl)nc(C2CC2)n1)c1cccc(C#N)c1	ZINC000301959548	533551772	/nfs/dbraw/zinc/55/17/72/533551772.db2.gz	HDEXCJGAIXZKDQ-SNVBAGLBSA-N	0	0	298.777	4.052	20	30		CIEDRN
C[C@H]1C[C@H]1c1ccc(CNc2ccc(CC#N)cc2)o1	ZINC000037071311	260066399	/nfs/dbraw/zinc/06/63/99/260066399.db2.gz	DGHGYQFFNJAXKD-BLLLJJGKSA-N	0	0	266.344	4.081	20	30		CIEDRN
CCSc1ccc([C@H](C)Nc2cc(C#N)ccn2)cc1	ZINC000341945764	130152726	/nfs/dbraw/zinc/15/27/26/130152726.db2.gz	PYTLGRDRXFJFCT-LBPRGKRZSA-N	0	0	283.400	4.238	20	30		CIEDRN
Cc1oc2ccccc2c1CNc1nc(C)cc(C)c1C#N	ZINC000341969069	130181717	/nfs/dbraw/zinc/18/17/17/130181717.db2.gz	LNFWCZBCZKYERV-UHFFFAOYSA-N	0	0	291.354	4.237	20	30		CIEDRN
O=C(/C=C\c1ccccc1F)c1cccc(Cl)c1	ZINC000211761762	130752876	/nfs/dbraw/zinc/75/28/76/130752876.db2.gz	HYXMAMXCRDQVBC-HJWRWDBZSA-N	0	0	260.695	4.375	20	30		CIEDRN
C=CC[N@@H+](CC)C(c1ccccc1)c1ccccc1	ZINC000575111068	335066468	/nfs/dbraw/zinc/06/64/68/335066468.db2.gz	ANESTDXJKVCPEO-UHFFFAOYSA-N	0	0	251.373	4.284	20	30		CIEDRN
C=CCNc1nnc(SCc2ccc(Cl)cc2)s1	ZINC000005784947	170140514	/nfs/dbraw/zinc/14/05/14/170140514.db2.gz	QLOJOZDSGZTLMW-UHFFFAOYSA-N	0	0	297.836	4.082	20	30		CIEDRN
O=C(/C=C/c1ccc(O)cc1)c1ccc(Cl)s1	ZINC000006339757	170194164	/nfs/dbraw/zinc/19/41/64/170194164.db2.gz	CCGJIBDJSYAUCX-ZZXKWVIFSA-N	0	0	264.733	4.003	20	30		CIEDRN
N#Cc1c(F)cccc1Oc1ccc(Br)cc1	ZINC000007906356	170306746	/nfs/dbraw/zinc/30/67/46/170306746.db2.gz	VGJLQGCTLRYOSM-UHFFFAOYSA-N	0	0	292.107	4.252	20	30		CIEDRN
CCC[C@H](Nc1ccc([N+](=O)[O-])cc1C#N)c1ccccc1	ZINC000008204904	170324410	/nfs/dbraw/zinc/32/44/10/170324410.db2.gz	SJEFWJRSASBHOY-INIZCTEOSA-N	0	0	295.342	4.420	20	30		CIEDRN
N#Cc1ccccc1COc1ccc(Cl)cc1Cl	ZINC000011834130	170445431	/nfs/dbraw/zinc/44/54/31/170445431.db2.gz	IJZZPORYPFYCJE-UHFFFAOYSA-N	0	0	278.138	4.444	20	30		CIEDRN
CC(C)c1ccccc1OCCOc1ccc(C#N)cc1	ZINC000011833159	170445436	/nfs/dbraw/zinc/44/54/36/170445436.db2.gz	JGCUKXSFQYIPQL-UHFFFAOYSA-N	0	0	281.355	4.139	20	30		CIEDRN
N#Cc1ccc(C(=O)CSc2ccc(Cl)cc2)cc1	ZINC000018187918	170746583	/nfs/dbraw/zinc/74/65/83/170746583.db2.gz	RNLIIGGYQKTWKP-UHFFFAOYSA-N	0	0	287.771	4.187	20	30		CIEDRN
Cc1nc2c(cc(OCCC#N)c3ccsc32)s1	ZINC000019517871	170823920	/nfs/dbraw/zinc/82/39/20/170823920.db2.gz	HFNZFTPVAQVHRM-UHFFFAOYSA-N	0	0	274.370	4.112	20	30		CIEDRN
CCCOc1ccc(OCc2ccc(C#N)cc2F)cc1	ZINC000020362241	171160831	/nfs/dbraw/zinc/16/08/31/171160831.db2.gz	PZFZCGRFIPPFSE-UHFFFAOYSA-N	0	0	285.318	4.065	20	30		CIEDRN
Cc1ccc(N[C@@H](C)c2ccc(C#N)cc2)c(F)c1	ZINC000020372031	171168463	/nfs/dbraw/zinc/16/84/63/171168463.db2.gz	FOFPXUVFJQTEPJ-LBPRGKRZSA-N	0	0	254.308	4.179	20	30		CIEDRN
CC(C)c1ccc(OCc2cccc(C#N)c2)cc1	ZINC000020547668	171245161	/nfs/dbraw/zinc/24/51/61/171245161.db2.gz	QTMKYYRBJQJLAY-UHFFFAOYSA-N	0	0	251.329	4.261	20	30		CIEDRN
CCCc1ccc(NCc2cccc(C#N)c2)cc1	ZINC000020564883	171253367	/nfs/dbraw/zinc/25/33/67/171253367.db2.gz	VTRHPESYEIJNHE-UHFFFAOYSA-N	0	0	250.345	4.123	20	30		CIEDRN
COc1ccc2cc(CNc3ccccc3C#N)ccc2c1	ZINC000020828292	171274984	/nfs/dbraw/zinc/27/49/84/171274984.db2.gz	RSDKOTDSNRYBLI-UHFFFAOYSA-N	0	0	288.350	4.332	20	30		CIEDRN
Cc1ccc(SCc2cccc(C#N)c2)cc1C	ZINC000021056156	171296120	/nfs/dbraw/zinc/29/61/20/171296120.db2.gz	LRASRSKPRGCGGH-UHFFFAOYSA-N	0	0	253.370	4.467	20	30		CIEDRN
N#Cc1cccc(Oc2ccc(Cl)c(Cl)c2)n1	ZINC000027433406	171517329	/nfs/dbraw/zinc/51/73/29/171517329.db2.gz	MNKQBSTVECREGH-UHFFFAOYSA-N	0	0	265.099	4.052	20	30		CIEDRN
CCOc1ccccc1/C=C\C(=O)c1ccc(C)cc1	ZINC000033686317	171817977	/nfs/dbraw/zinc/81/79/77/171817977.db2.gz	SOAAPUAQAQAWLI-SEYXRHQNSA-N	0	0	266.340	4.290	20	30		CIEDRN
C[C@@H](CCc1ccccc1)Nc1cccc(F)c1C#N	ZINC000035134939	172001400	/nfs/dbraw/zinc/00/14/00/172001400.db2.gz	VDOAXTZEJQAKID-ZDUSSCGKSA-N	0	0	268.335	4.131	20	30		CIEDRN
N#Cc1c(F)cccc1N[C@H]1CCSc2ccccc21	ZINC000035134980	172001403	/nfs/dbraw/zinc/00/14/03/172001403.db2.gz	IHNMPQBRNCXVEA-HNNXBMFYSA-N	0	0	284.359	4.346	20	30		CIEDRN
COc1ccc([C@H](C)Nc2cccc(F)c2C#N)cc1F	ZINC000035137400	172005001	/nfs/dbraw/zinc/00/50/01/172005001.db2.gz	HBMGDUSJAXHRQS-JTQLQIEISA-N	0	0	288.297	4.018	20	30		CIEDRN
N#CCOc1cccc(NC2CCCCCCC2)c1	ZINC000037069499	172931139	/nfs/dbraw/zinc/93/11/39/172931139.db2.gz	OBUHVTPRNSMGGV-UHFFFAOYSA-N	0	0	258.365	4.114	20	30		CIEDRN
N#Cc1ccc(NCc2ccccc2)cc1C(F)(F)F	ZINC000037306355	173110136	/nfs/dbraw/zinc/11/01/36/173110136.db2.gz	NLDJGWQOAXICMO-UHFFFAOYSA-N	0	0	276.261	4.189	20	30		CIEDRN
Cc1ccc(CNc2c(C#N)cnc3ccccc32)cc1	ZINC000037413201	173189535	/nfs/dbraw/zinc/18/95/35/173189535.db2.gz	KRSLYBGSJBCBCD-UHFFFAOYSA-N	0	0	273.339	4.027	20	30		CIEDRN
C=CCn1c(S[C@H](C)CC)nnc1-c1ccccc1	ZINC000039758211	174172315	/nfs/dbraw/zinc/17/23/15/174172315.db2.gz	KMKAMYSWZWFCFC-GFCCVEGCSA-N	0	0	273.405	4.022	20	30		CIEDRN
N#CC1(C(=O)Nc2ccc(Cl)cc2Cl)CCCCC1	ZINC000044385172	175169465	/nfs/dbraw/zinc/16/94/65/175169465.db2.gz	PDVGNNJOFRUXTJ-UHFFFAOYSA-N	0	0	297.185	4.406	20	30		CIEDRN
Cc1c(Cl)cccc1NC(=O)C1(C#N)CCCCC1	ZINC000044385169	175169554	/nfs/dbraw/zinc/16/95/54/175169554.db2.gz	XRSMIDABURBGEU-UHFFFAOYSA-N	0	0	276.767	4.061	20	30		CIEDRN
C[C@H]1OCC[C@@H]1C(=O)Nc1ncc(C2CCCCC2)s1	ZINC000329461674	225015510	/nfs/dbraw/zinc/01/55/10/225015510.db2.gz	PXRZFTGDKRSXNC-PWSUYJOCSA-N	0	0	294.420	4.204	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccccc2C(C)(F)F)CC1	ZINC000411034159	262675661	/nfs/dbraw/zinc/67/56/61/262675661.db2.gz	LGFFUWKKRITNJJ-UHFFFAOYSA-N	0	0	279.330	4.483	20	30		CIEDRN
C[C@@]1(C(=O)Nc2ccc(CC#N)cc2Cl)CC=CCC1	ZINC000334645701	225251663	/nfs/dbraw/zinc/25/16/63/225251663.db2.gz	UQZYXSMWWMDKRT-MRXNPFEDSA-N	0	0	288.778	4.091	20	30		CIEDRN
Cc1ccc([C@H](C)N(C)C(=O)c2cccc(C#N)c2)c(C)c1	ZINC000345048855	225405328	/nfs/dbraw/zinc/40/53/28/225405328.db2.gz	BVQIALHBPKKRJG-HNNXBMFYSA-N	0	0	292.382	4.008	20	30		CIEDRN
N#C[C@@H]1CC[C@H](Nc2ccc(Cl)cc2OC(F)F)C1	ZINC000442847446	225521351	/nfs/dbraw/zinc/52/13/51/225521351.db2.gz	CNNYZHLTWDEBKL-SCZZXKLOSA-N	0	0	286.709	4.046	20	30		CIEDRN
Cc1cc(C(=O)NCC(C)(C)CCC#N)c(C)cc1Cl	ZINC000345979874	225670391	/nfs/dbraw/zinc/67/03/91/225670391.db2.gz	BIQGNZDUAKKLQL-UHFFFAOYSA-N	0	0	292.810	4.017	20	30		CIEDRN
COc1ccc(C)cc1N[C@H](C)c1ccc(OCC#N)cc1	ZINC000192920552	227385198	/nfs/dbraw/zinc/38/51/98/227385198.db2.gz	OVUKQEWUVYCVOH-CQSZACIVSA-N	0	0	296.370	4.079	20	30		CIEDRN
N#CC1(CN(Cc2ccccc2)Cc2ccccc2F)CC1	ZINC000347418689	226152980	/nfs/dbraw/zinc/15/29/80/226152980.db2.gz	AQAASQGISVBBAS-UHFFFAOYSA-N	0	0	294.373	4.132	20	30		CIEDRN
Cc1cc(CN2Cc3cccc(Cl)c3C2)ccc1C#N	ZINC000347469007	226175456	/nfs/dbraw/zinc/17/54/56/226175456.db2.gz	SWQQRQHFPPXUKO-UHFFFAOYSA-N	0	0	282.774	4.036	20	30		CIEDRN
N#Cc1cnccc1/C=C/c1cc2cc(F)ccc2o1	ZINC000349104408	226546184	/nfs/dbraw/zinc/54/61/84/226546184.db2.gz	DNVZSWCCFRSQOW-HNQUOIGGSA-N	0	0	264.259	4.009	20	30		CIEDRN
CCC[C@H](C(=O)N[C@@H](C#N)c1ccc(CC)cc1)C(C)C	ZINC000575160641	335073840	/nfs/dbraw/zinc/07/38/40/335073840.db2.gz	OERVIDKYVUJMJK-IRXDYDNUSA-N	0	0	286.419	4.002	20	30		CIEDRN
CC[C@](C)(C#N)c1nc([C@@H](c2ccc(C)cc2)C(C)C)no1	ZINC000575162012	335073858	/nfs/dbraw/zinc/07/38/58/335073858.db2.gz	HXVZBOCIGQLUNF-CRAIPNDOSA-N	0	0	297.402	4.357	20	30		CIEDRN
Cc1ccc(Cl)c(NC(=O)c2ccc(C#N)s2)c1C	ZINC000336313597	226884546	/nfs/dbraw/zinc/88/45/46/226884546.db2.gz	KTEZOFKKCQTLBT-UHFFFAOYSA-N	0	0	290.775	4.142	20	30		CIEDRN
C[C@@H](CCSc1cccnc1C#N)OCc1ccccc1	ZINC000575195801	335079391	/nfs/dbraw/zinc/07/93/91/335079391.db2.gz	WBAHQGNDAGDFLO-AWEZNQCLSA-N	0	0	298.411	4.041	20	30		CIEDRN
N#CCc1cccc(-c2nc(-c3cccc(Cl)c3)no2)c1	ZINC000171783183	335079698	/nfs/dbraw/zinc/07/96/98/335079698.db2.gz	UMWCITRXHKMLMF-UHFFFAOYSA-N	0	0	295.729	4.123	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)[C@H](C)C(C)C	ZINC000171912213	335084616	/nfs/dbraw/zinc/08/46/16/335084616.db2.gz	FVNQWLYIXYRRCW-LLVKDONJSA-N	0	0	285.840	4.208	20	30		CIEDRN
Cc1ccc(C#N)cc1NCc1cc2cc(F)ccc2o1	ZINC000354870826	227187720	/nfs/dbraw/zinc/18/77/20/227187720.db2.gz	WSCHVUMZJSHZQM-UHFFFAOYSA-N	0	0	280.302	4.364	20	30		CIEDRN
N#C[C@H](NC(=O)[C@H]1CC12CCCC2)c1ccccc1Cl	ZINC000329005216	227254130	/nfs/dbraw/zinc/25/41/30/227254130.db2.gz	MMJMCDQBMIKAKJ-OCCSQVGLSA-N	0	0	288.778	4.441	20	30		CIEDRN
O=C(N[C@H]1CCCCNC1=O)[C@@H]1CCC[C@@H]2CCCC[C@H]12	ZINC000329031803	227264544	/nfs/dbraw/zinc/26/45/44/227264544.db2.gz	XISKKFZKJUJDIF-XQLPTFJDSA-N	0	0	292.423	4.058	20	30		CIEDRN
Cc1nc(CCNC(=O)[C@@H]2C[C@H]2C2CCCCC2)c(C)o1	ZINC000329034681	227267422	/nfs/dbraw/zinc/26/74/22/227267422.db2.gz	QVAGFXNHMWLHGH-LSDHHAIUSA-N	0	0	290.407	4.007	20	30		CIEDRN
N#Cc1ccc(NC2CC2)c(NC(=O)[C@@H]2CC23CCCC3)c1	ZINC000329086839	227289215	/nfs/dbraw/zinc/28/92/15/227289215.db2.gz	HARVIXRLDGKZEK-AWEZNQCLSA-N	0	0	295.386	4.301	20	30		CIEDRN
Cc1sccc1CNc1cc(C#N)ccc1OC(C)C	ZINC000352828363	227304935	/nfs/dbraw/zinc/30/49/35/227304935.db2.gz	CUONGWWONSUZBR-UHFFFAOYSA-N	0	0	286.400	4.328	20	30		CIEDRN
O=C(CNC(=O)CC1CCCC1)N[C@@H]1CC12CCCCC2	ZINC000329120045	227311067	/nfs/dbraw/zinc/31/10/67/227311067.db2.gz	POGOCUMDCLLZPK-CQSZACIVSA-N	0	0	292.423	4.203	20	30		CIEDRN
O=C(Nc1scnc1C1CC1)N[C@H]1CC12CCCCC2	ZINC000329122043	227311677	/nfs/dbraw/zinc/31/16/77/227311677.db2.gz	QVKJSXWXDIWGIM-NSHDSACASA-N	0	0	291.420	4.069	20	30		CIEDRN
C[C@@H]1C[C@H](CC(=O)Nc2nncn2C2CC2)CC(C)(C)C1	ZINC000329127915	227315948	/nfs/dbraw/zinc/31/59/48/227315948.db2.gz	VCDHWKZLOSPBLH-VXGBXAGGSA-N	0	0	290.411	4.054	20	30		CIEDRN
N#C[C@H](C(=O)c1ccc(C2=CCCC2)cc1)c1ccccn1	ZINC000355093381	227391787	/nfs/dbraw/zinc/39/17/87/227391787.db2.gz	DRLWPRJRHOMRRI-KRWDZBQOSA-N	0	0	288.350	4.139	20	30		CIEDRN
Cn1cc(Nc2cccc(NC(=O)C3CC(C)(C)C3)c2)cn1	ZINC000329186323	227344741	/nfs/dbraw/zinc/34/47/41/227344741.db2.gz	PUVKFQQZTSEJDY-UHFFFAOYSA-N	0	0	298.390	4.188	20	30		CIEDRN
N#Cc1csc(CNc2ccc(-c3ccco3)cc2F)n1	ZINC000352862153	227346187	/nfs/dbraw/zinc/34/61/87/227346187.db2.gz	MJGKOXPKOYEKQN-UHFFFAOYSA-N	0	0	299.330	4.026	20	30		CIEDRN
C[C@H](NC(=O)[C@@H]1CCC[C@@H]2CCCC[C@@H]12)c1ccon1	ZINC000329193389	227346250	/nfs/dbraw/zinc/34/62/50/227346250.db2.gz	SKQCELZNPKHISW-IGQOVBAYSA-N	0	0	276.380	4.299	20	30		CIEDRN
N#CCCCOc1cccc(Nc2ccc([N+](=O)[O-])cc2)c1	ZINC000301095334	227446547	/nfs/dbraw/zinc/44/65/47/227446547.db2.gz	OJCLIBPTPLSKKZ-UHFFFAOYSA-N	0	0	297.314	4.021	20	30		CIEDRN
N#Cc1nc(NCc2cccc3ccccc32)ccc1Cl	ZINC000301187334	227469865	/nfs/dbraw/zinc/46/98/65/227469865.db2.gz	VZTZLKCNUPCQDD-UHFFFAOYSA-N	0	0	293.757	4.372	20	30		CIEDRN
C[C@H]1CC[C@H](CC(=O)Nc2cccc3c2OCCC3=O)C1	ZINC000329373307	227477692	/nfs/dbraw/zinc/47/76/92/227477692.db2.gz	JVNHAEVCBOFHQT-RYUDHWBXSA-N	0	0	287.359	4.066	20	30		CIEDRN
C[C@H](Nc1cccc(C#N)n1)c1cccc(C(F)(F)F)c1	ZINC000301253881	227490004	/nfs/dbraw/zinc/49/00/04/227490004.db2.gz	CMDCMHWHQNJVCR-JTQLQIEISA-N	0	0	291.276	4.145	20	30		CIEDRN
Cc1cc(C)c2ncc(C#N)c(NCc3ccsc3)c2c1	ZINC000301361244	227520232	/nfs/dbraw/zinc/52/02/32/227520232.db2.gz	LYTIXITZNYWXAL-UHFFFAOYSA-N	0	0	293.395	4.397	20	30		CIEDRN
C[C@@H](Nc1cccc(C(F)(F)F)n1)c1cccc(C#N)c1	ZINC000301417920	227533165	/nfs/dbraw/zinc/53/31/65/227533165.db2.gz	CTGLWTPNTJLJDX-SNVBAGLBSA-N	0	0	291.276	4.145	20	30		CIEDRN
COCCC1(CNc2c(Cl)cccc2C#N)CCCC1	ZINC000301691359	227643723	/nfs/dbraw/zinc/64/37/23/227643723.db2.gz	YRJTVYRCURFVPS-UHFFFAOYSA-N	0	0	292.810	4.220	20	30		CIEDRN
Cc1ccc(Sc2snc(Cl)c2C#N)cc1C	ZINC000301928573	227732301	/nfs/dbraw/zinc/73/23/01/227732301.db2.gz	LLYCKKNLPDEGGC-UHFFFAOYSA-N	0	0	280.805	4.436	20	30		CIEDRN
N#Cc1c(Cl)nsc1Oc1ccc(Cl)c(F)c1	ZINC000301991716	227751387	/nfs/dbraw/zinc/75/13/87/227751387.db2.gz	YHQOHTYRBCFUGS-UHFFFAOYSA-N	0	0	289.118	4.253	20	30		CIEDRN
N#Cc1ccc([N+](=O)[O-])c(Oc2ccc(F)cc2Cl)c1	ZINC000302219940	227824989	/nfs/dbraw/zinc/82/49/89/227824989.db2.gz	RMDVVJJSZNABAH-UHFFFAOYSA-N	0	0	292.653	4.051	20	30		CIEDRN
C[C@@H](Nc1cccc(C#N)n1)c1cc(Cl)ccc1Cl	ZINC000302425315	227849119	/nfs/dbraw/zinc/84/91/19/227849119.db2.gz	NOKBBRACFDRRSS-SECBINFHSA-N	0	0	292.169	4.433	20	30		CIEDRN
Cc1ccc(N[C@@H](C)c2c(F)cccc2Cl)nc1C#N	ZINC000302666985	227874143	/nfs/dbraw/zinc/87/41/43/227874143.db2.gz	QIRYYQYAQNXPJC-JTQLQIEISA-N	0	0	289.741	4.227	20	30		CIEDRN
Cc1ccc(N[C@H](C)c2cccc(OC(C)C)c2)nc1C#N	ZINC000302692858	227876571	/nfs/dbraw/zinc/87/65/71/227876571.db2.gz	ZVZYDFRRIWAMAK-CQSZACIVSA-N	0	0	295.386	4.222	20	30		CIEDRN
N#Cc1cccc(C#N)c1Oc1ccc(Cl)cc1F	ZINC000302865554	227894383	/nfs/dbraw/zinc/89/43/83/227894383.db2.gz	YCQUCFLJYCPLPU-UHFFFAOYSA-N	0	0	272.666	4.015	20	30		CIEDRN
Cc1ccc(Cl)cc1Oc1c(C#N)cccc1C#N	ZINC000302872510	227895462	/nfs/dbraw/zinc/89/54/62/227895462.db2.gz	CKFZVXHVEHKKJE-UHFFFAOYSA-N	0	0	268.703	4.184	20	30		CIEDRN
Cc1noc(C(C)C)c1C(=O)N[C@@H]1C[C@H]1C1CCCCC1	ZINC000329874488	227972817	/nfs/dbraw/zinc/97/28/17/227972817.db2.gz	CWPMHEWKTSKNCL-UONOGXRCSA-N	0	0	290.407	4.380	20	30		CIEDRN
C[C@H](NC(=O)[C@@H]1CC12CCCC2)c1ccc2c(c1)CC(=O)N2	ZINC000329974597	228003672	/nfs/dbraw/zinc/00/36/72/228003672.db2.gz	XMGHCUSMCLAJME-FZMZJTMJSA-N	0	0	298.386	4.429	20	30		CIEDRN
Cc1oc(C#N)cc1-c1nc([C@H]2C[C@H](C)C[C@H](C)C2)no1	ZINC000331573572	228112696	/nfs/dbraw/zinc/11/26/96/228112696.db2.gz	MGNJPIIWAUCDNO-IAZYJMLFSA-N	0	0	285.347	4.049	20	30		CIEDRN
Cc1coc2ccc(NC(=O)C3CCC(=O)CC3)cc12	ZINC000330114616	228042747	/nfs/dbraw/zinc/04/27/47/228042747.db2.gz	SXPAENPJIHZSCD-UHFFFAOYSA-N	0	0	271.316	4.089	20	30		CIEDRN
N#CC1(C(=O)NCc2ccc(C3CCC3)cc2)CCC1	ZINC000330211221	228068170	/nfs/dbraw/zinc/06/81/70/228068170.db2.gz	CXDGGOHUFOQIIK-UHFFFAOYSA-N	0	0	268.360	4.104	20	30		CIEDRN
Cc1cccc(NC(=O)C[C@H](CC#N)c2ccccc2)c1	ZINC000353354855	228089830	/nfs/dbraw/zinc/08/98/30/228089830.db2.gz	QJMRFKZUDOTLEO-INIZCTEOSA-N	0	0	278.355	4.021	20	30		CIEDRN
Cc1cscc1N[C@H]1CCc2ccc(C#N)cc21	ZINC000353679594	228144463	/nfs/dbraw/zinc/14/44/63/228144463.db2.gz	POANMXXYMQPPAB-AWEZNQCLSA-N	0	0	254.358	4.028	20	30		CIEDRN
Cc1cc(C)c(NC(=O)c2cc(C#N)ccc2Cl)c(C)c1	ZINC000335941219	228168583	/nfs/dbraw/zinc/16/85/83/228168583.db2.gz	AZIRAFVGWGCEAP-UHFFFAOYSA-N	0	0	298.773	4.389	20	30		CIEDRN
Cc1csc(NC(=O)c2sccc2C2CC2)c1C#N	ZINC000335994152	228175614	/nfs/dbraw/zinc/17/56/14/228175614.db2.gz	UWSFNNDSYYQCIQ-UHFFFAOYSA-N	0	0	288.397	4.119	20	30		CIEDRN
Cc1ccc(Cl)cc1C(=O)N[C@@](C)(C#N)CC(C)C	ZINC000330407276	228178738	/nfs/dbraw/zinc/17/87/38/228178738.db2.gz	ZMYOOWSBIBZRHP-OAHLLOKOSA-N	0	0	278.783	4.281	20	30		CIEDRN
N#C[C@@]1(c2nc(-c3cccc(Cl)c3)no2)CC12CCCC2	ZINC000333862572	228217463	/nfs/dbraw/zinc/21/74/63/228217463.db2.gz	SAHRBLFTLPQZJM-MRXNPFEDSA-N	0	0	299.761	4.115	20	30		CIEDRN
C[C@H]1CCC[C@@](C#N)(NC(=O)c2cc3ccccc3s2)C1	ZINC000116800163	260006052	/nfs/dbraw/zinc/00/60/52/260006052.db2.gz	VJSOPAKDWXDDJP-YVEFUNNKSA-N	0	0	298.411	4.104	20	30		CIEDRN
CC(C)(C)c1cccc(Oc2ccc(C#N)cn2)c1	ZINC000036968744	260059594	/nfs/dbraw/zinc/05/95/94/260059594.db2.gz	RNJGGVUUVWFCNV-UHFFFAOYSA-N	0	0	252.317	4.043	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N(Cc1ccccc1)c1ccncc1	ZINC000188050396	260069723	/nfs/dbraw/zinc/06/97/23/260069723.db2.gz	PYDRFRPEHUWLLA-IBGZPJMESA-N	0	0	294.398	4.217	20	30		CIEDRN
C[C@@H](Nc1ccc(C#N)c(Cl)c1)c1cccc(C#N)c1	ZINC000037253483	260078752	/nfs/dbraw/zinc/07/87/52/260078752.db2.gz	ACXCPEUSJLEZNO-LLVKDONJSA-N	0	0	281.746	4.256	20	30		CIEDRN
N#Cc1cc(Cl)ccc1CNc1ccc(F)c(F)c1	ZINC000187708129	260080158	/nfs/dbraw/zinc/08/01/58/260080158.db2.gz	UAZDMRRRGQPQDE-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C=CCc1ccccc1OCc1ccc(-n2cccn2)cc1	ZINC000521346585	260082663	/nfs/dbraw/zinc/08/26/63/260082663.db2.gz	DHKRLFKYRFHPGY-UHFFFAOYSA-N	0	0	290.366	4.180	20	30		CIEDRN
C=C(C)CN(C)C(=O)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1	ZINC000180388239	260100142	/nfs/dbraw/zinc/10/01/42/260100142.db2.gz	IRWKHBVZTFDARB-UONOGXRCSA-N	0	0	298.213	4.131	20	30		CIEDRN
C=C(C)CN(C)C(=O)[C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000180398069	260100448	/nfs/dbraw/zinc/10/04/48/260100448.db2.gz	BPWFLGOXIYKJPW-VXGBXAGGSA-N	0	0	298.213	4.131	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1ccc(Oc2ccccc2)cc1	ZINC000180439410	260102264	/nfs/dbraw/zinc/10/22/64/260102264.db2.gz	BGSIJRFXBCAGKX-UHFFFAOYSA-N	0	0	281.355	4.127	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1ccc(-c2ccccc2Cl)o1	ZINC000180469088	260103341	/nfs/dbraw/zinc/10/33/41/260103341.db2.gz	GNNHKLJAATVQOZ-UHFFFAOYSA-N	0	0	289.762	4.248	20	30		CIEDRN
N#Cc1ccc(C[NH2+][C@@H]2CCSc3c(F)cccc32)cc1	ZINC000037489138	260110948	/nfs/dbraw/zinc/11/09/48/260110948.db2.gz	HGWHQQVMQHYDNA-MRXNPFEDSA-N	0	0	298.386	4.024	20	30		CIEDRN
C=CCCCS[C@H](C)C(=O)Nc1ccccc1OCC	ZINC000117944633	260117661	/nfs/dbraw/zinc/11/76/61/260117661.db2.gz	GVLQAQDOBQBMMU-CYBMUJFWSA-N	0	0	293.432	4.112	20	30		CIEDRN
C=CCCCS[C@@H](C)C(=O)Nc1ccccc1OCC	ZINC000117944635	260117663	/nfs/dbraw/zinc/11/76/63/260117663.db2.gz	GVLQAQDOBQBMMU-ZDUSSCGKSA-N	0	0	293.432	4.112	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)N(C)CC#CC	ZINC000297711059	260132607	/nfs/dbraw/zinc/13/26/07/260132607.db2.gz	IBILIYSSLWPZTD-UHFFFAOYSA-N	0	0	284.403	4.026	20	30		CIEDRN
Cc1nc(N2CCC3(CCCC3)CC2)c(Cl)cc1C#N	ZINC000312533010	260141750	/nfs/dbraw/zinc/14/17/50/260141750.db2.gz	KBHDCCVGFNERSO-UHFFFAOYSA-N	0	0	289.810	4.076	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H](C)c1ncc(-c2ccccc2)o1	ZINC000188489357	260149011	/nfs/dbraw/zinc/14/90/11/260149011.db2.gz	YRPAZYFIWCVFHT-SCLBCKFNSA-N	0	0	298.386	4.121	20	30		CIEDRN
CCc1cc(NCc2ccc(C#N)c(F)c2)ccc1C	ZINC000404152850	260149082	/nfs/dbraw/zinc/14/90/82/260149082.db2.gz	SYZVNZXJNZPEAU-UHFFFAOYSA-N	0	0	268.335	4.180	20	30		CIEDRN
N#CCc1ccc(N[C@@H]2CCC[C@H](C(F)(F)F)C2)cc1	ZINC000069380415	260150082	/nfs/dbraw/zinc/15/00/82/260150082.db2.gz	QQRXEBSKAPTDHC-GXTWGEPZSA-N	0	0	282.309	4.286	20	30		CIEDRN
N#CCCCOc1cc(C(F)(F)F)cc(C(F)(F)F)c1	ZINC000070192480	260154132	/nfs/dbraw/zinc/15/41/32/260154132.db2.gz	BRHROSLBOWGHHF-UHFFFAOYSA-N	0	0	297.198	4.407	20	30		CIEDRN
CC(C)Oc1ccc(NCC(C)(C)CCC#N)cc1	ZINC000080192387	260178212	/nfs/dbraw/zinc/17/82/12/260178212.db2.gz	VOPATQBMLSRFJN-UHFFFAOYSA-N	0	0	260.381	4.216	20	30		CIEDRN
N#Cc1ccc(N[C@@H]2CC=CCC2)cc1C(F)(F)F	ZINC000080120313	260178366	/nfs/dbraw/zinc/17/83/66/260178366.db2.gz	NJMUXTMDTKGAGD-LLVKDONJSA-N	0	0	266.266	4.098	20	30		CIEDRN
Cc1csc([C@H](C)Nc2cc(C#N)c3ccccc3n2)n1	ZINC000080119152	260178310	/nfs/dbraw/zinc/17/83/10/260178310.db2.gz	PHUOPMLMOPMFTJ-NSHDSACASA-N	0	0	294.383	4.045	20	30		CIEDRN
N#Cc1cc(NCc2ccsc2Cl)ccc1F	ZINC000312613458	260182873	/nfs/dbraw/zinc/18/28/73/260182873.db2.gz	AUNMYQQWZXRPCG-UHFFFAOYSA-N	0	0	266.728	4.024	20	30		CIEDRN
N#Cc1cccc(Oc2ccc(-c3ccccc3)cc2)n1	ZINC000081621370	260183680	/nfs/dbraw/zinc/18/36/80/260183680.db2.gz	WEPYMQFSXUFBJQ-UHFFFAOYSA-N	0	0	272.307	4.413	20	30		CIEDRN
CC(C)(C#N)CCCNc1ccc(Cl)c(F)c1	ZINC000087597634	260191705	/nfs/dbraw/zinc/19/17/05/260191705.db2.gz	VDUNCQNSFBLINM-UHFFFAOYSA-N	0	0	254.736	4.221	20	30		CIEDRN
CC(C)(C#N)CCCOc1ccc2c(c1)CCCC2	ZINC000087609032	260192231	/nfs/dbraw/zinc/19/22/31/260192231.db2.gz	YFVVYXFELCZBDI-UHFFFAOYSA-N	0	0	257.377	4.274	20	30		CIEDRN
CC(C)c1nnc(NC(=O)C(F)(F)c2ccccc2)s1	ZINC000047248898	260195102	/nfs/dbraw/zinc/19/51/02/260195102.db2.gz	QNQNPNYLUXDQCA-UHFFFAOYSA-N	0	0	297.330	4.042	20	30		CIEDRN
COc1cc(NCCCC(C)(C)C#N)c(OC)cc1Cl	ZINC000087596990	260215304	/nfs/dbraw/zinc/21/53/04/260215304.db2.gz	HLUMZMHKCOQDPR-UHFFFAOYSA-N	0	0	296.798	4.099	20	30		CIEDRN
CC[C@H]1CC[C@@H](C)N1C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000408091710	260225893	/nfs/dbraw/zinc/22/58/93/260225893.db2.gz	VZVIRPMCQQJQJH-MFKMUULPSA-N	0	0	291.782	4.006	20	30		CIEDRN
N#Cc1ccc(OC[C@@H]2CCCC(F)(F)C2)cc1Cl	ZINC000311161173	260239077	/nfs/dbraw/zinc/23/90/77/260239077.db2.gz	LHSCGFDLOLGNDL-SNVBAGLBSA-N	0	0	285.721	4.416	20	30		CIEDRN
CCCCNC(=O)Nc1ccccc1S[C@@H](C)CC#N	ZINC000066954490	260250236	/nfs/dbraw/zinc/25/02/36/260250236.db2.gz	UZECICJCNUCPTA-LBPRGKRZSA-N	0	0	291.420	4.002	20	30		CIEDRN
Cc1nc(Oc2cccc(C(C)C)c2)ccc1C#N	ZINC000311957177	260259461	/nfs/dbraw/zinc/25/94/61/260259461.db2.gz	KRMDNLNBZSFQRG-UHFFFAOYSA-N	0	0	252.317	4.177	20	30		CIEDRN
C=CCCO[C@H](C)C(=O)N(CC)c1cccc2ccccc21	ZINC000520000024	260266222	/nfs/dbraw/zinc/26/62/22/260266222.db2.gz	RQMMYTQATIAIIK-OAHLLOKOSA-N	0	0	297.398	4.174	20	30		CIEDRN
COC[C@@H](Nc1ccc(C#N)c(Cl)c1)c1ccccc1	ZINC000091981562	260267001	/nfs/dbraw/zinc/26/70/01/260267001.db2.gz	YLKBAMYPCSZLPJ-MRXNPFEDSA-N	0	0	286.762	4.011	20	30		CIEDRN
CC(C)Oc1ccccc1CNc1cccc(CC#N)c1	ZINC000313432924	260292992	/nfs/dbraw/zinc/29/29/92/260292992.db2.gz	ZBPXAOZDEOZRBQ-UHFFFAOYSA-N	0	0	280.371	4.152	20	30		CIEDRN
N#Cc1ccc(Cl)cc1OCc1cnc2ccccc2c1	ZINC000313444727	260294438	/nfs/dbraw/zinc/29/44/38/260294438.db2.gz	OXDJXJKEOPGUEJ-UHFFFAOYSA-N	0	0	294.741	4.339	20	30		CIEDRN
CC[C@@H](Cc1ccccc1)Nc1cccc(CC#N)c1	ZINC000313441781	260294533	/nfs/dbraw/zinc/29/45/33/260294533.db2.gz	VJBOVWIUTROJJU-KRWDZBQOSA-N	0	0	264.372	4.186	20	30		CIEDRN
CC(C)(C)c1ccc(C(=O)Nc2cccc(CC#N)c2)cc1	ZINC000313468540	260297461	/nfs/dbraw/zinc/29/74/61/260297461.db2.gz	VSKFISPEAVKBJM-UHFFFAOYSA-N	0	0	292.382	4.302	20	30		CIEDRN
C[C@H](CC#N)Sc1ccccc1NC(=O)CC1CCC1	ZINC000080172201	260312020	/nfs/dbraw/zinc/31/20/20/260312020.db2.gz	HASDVTJKUWTLRD-GFCCVEGCSA-N	0	0	288.416	4.210	20	30		CIEDRN
Cc1cccc2c1CC[C@@H]2Nc1cccc(F)c1C#N	ZINC000517873577	260313205	/nfs/dbraw/zinc/31/32/05/260313205.db2.gz	GEOYVLKPUKANKR-KRWDZBQOSA-N	0	0	266.319	4.105	20	30		CIEDRN
CCCc1ccc(C(=O)Nc2ccc(Cl)c(C#N)c2)cc1	ZINC000517908900	260316779	/nfs/dbraw/zinc/31/67/79/260316779.db2.gz	ZZHXDCRJHVNDOL-UHFFFAOYSA-N	0	0	298.773	4.416	20	30		CIEDRN
C=CCCC(=O)N(CC1CC1)c1cccc(C(F)(F)F)c1	ZINC000520910131	260327838	/nfs/dbraw/zinc/32/78/38/260327838.db2.gz	YCHKGPNKURLMRJ-UHFFFAOYSA-N	0	0	297.320	4.415	20	30		CIEDRN
C[C@@H](NCc1cc(C#N)ccc1F)c1cc2ccccc2o1	ZINC000090117623	260330758	/nfs/dbraw/zinc/33/07/58/260330758.db2.gz	BTRSFLOOOAEDJM-GFCCVEGCSA-N	0	0	294.329	4.294	20	30		CIEDRN
N#CCc1cccc(N[C@H]2CCCC23CCCC3)c1	ZINC000313427081	260332363	/nfs/dbraw/zinc/33/23/63/260332363.db2.gz	MIWMEXVAWGZYPK-INIZCTEOSA-N	0	0	254.377	4.277	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(C[C@@H](C)c2ccccc2)no1	ZINC000518006913	260333847	/nfs/dbraw/zinc/33/38/47/260333847.db2.gz	VDWFCQKEARZBKO-ZIAGYGMSSA-N	0	0	270.376	4.486	20	30		CIEDRN
N#Cc1cc(N[C@H]2CCCc3sccc32)ccc1[N+](=O)[O-]	ZINC000127813022	260371125	/nfs/dbraw/zinc/37/11/25/260371125.db2.gz	NACFVTYMKSDQTG-ZDUSSCGKSA-N	0	0	299.355	4.017	20	30		CIEDRN
N#Cc1cc(N[C@@H]2CCCc3sccc32)ccc1[N+](=O)[O-]	ZINC000127812765	260371132	/nfs/dbraw/zinc/37/11/32/260371132.db2.gz	NACFVTYMKSDQTG-CYBMUJFWSA-N	0	0	299.355	4.017	20	30		CIEDRN
C=CCCc1ccccc1N[C@H]1CCOC2(CCC2)C1	ZINC000449305911	260385035	/nfs/dbraw/zinc/38/50/35/260385035.db2.gz	ILLCQRGINRIWKN-INIZCTEOSA-N	0	0	271.404	4.319	20	30		CIEDRN
C=CCCc1ccccc1NCc1ccc(F)c(C#N)c1	ZINC000409873105	260435770	/nfs/dbraw/zinc/43/57/70/260435770.db2.gz	DERNSOKHFSSJSE-UHFFFAOYSA-N	0	0	280.346	4.428	20	30		CIEDRN
C=CCCc1ccccc1NCc1nc(CCC(C)C)no1	ZINC000409873011	260435816	/nfs/dbraw/zinc/43/58/16/260435816.db2.gz	XLUGBQAJJGKJLS-UHFFFAOYSA-N	0	0	299.418	4.389	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)CC1CC(c2ccccc2)C1	ZINC000410001929	260447477	/nfs/dbraw/zinc/44/74/77/260447477.db2.gz	CTCOTNKKVVJKKM-VJFUWPCTSA-N	0	0	283.415	4.137	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@@H]1C[C@H]1c1cccc2ccccc21	ZINC000410124174	260462544	/nfs/dbraw/zinc/46/25/44/260462544.db2.gz	VOHLKKCVALBQOP-ZYSHUDEJSA-N	0	0	293.410	4.414	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)CCc1ccc(-c2ccccc2)[nH]1	ZINC000410136136	260463676	/nfs/dbraw/zinc/46/36/76/260463676.db2.gz	QDUWDBSFBSBFNF-INIZCTEOSA-N	0	0	296.414	4.085	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)Cc1ccsc1C	ZINC000410346050	260487813	/nfs/dbraw/zinc/48/78/13/260487813.db2.gz	GLOWNMMJXPNSKQ-UHFFFAOYSA-N	0	0	285.412	4.356	20	30		CIEDRN
CC[C@@H]1CCC[C@H]1C(=O)N(C)c1cc(Cl)ccc1C#N	ZINC000410553805	260534468	/nfs/dbraw/zinc/53/44/68/260534468.db2.gz	BKROCXWBOOHDMO-BXUZGUMPSA-N	0	0	290.794	4.001	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC=C(c2cccs2)CC1	ZINC000150732255	260582682	/nfs/dbraw/zinc/58/26/82/260582682.db2.gz	PYOOPFCWQQSXDS-UHFFFAOYSA-N	0	0	287.428	4.132	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@@H](c2ccccc2)[C@@H]1C	ZINC000151781295	260606133	/nfs/dbraw/zinc/60/61/33/260606133.db2.gz	MFJOOSNURBLOKL-MAUKXSAKSA-N	0	0	283.415	4.159	20	30		CIEDRN
CC(C)[C@@H](C)CC(=O)Nc1ccccc1SCCC#N	ZINC000108199897	260639668	/nfs/dbraw/zinc/63/96/68/260639668.db2.gz	YCVOZSRLIGOGLS-ZDUSSCGKSA-N	0	0	290.432	4.313	20	30		CIEDRN
C=CCC[C@H](Nc1ncccc1C#N)c1ccccc1	ZINC000154590160	260747629	/nfs/dbraw/zinc/74/76/29/260747629.db2.gz	WNRAVOJSJRXZAO-INIZCTEOSA-N	0	0	263.344	4.073	20	30		CIEDRN
N#CCCCOc1cccc(CNc2cccc(F)c2)c1	ZINC000155587436	260767982	/nfs/dbraw/zinc/76/79/82/260767982.db2.gz	SGPPLOFGKZEWCN-UHFFFAOYSA-N	0	0	284.334	4.120	20	30		CIEDRN
Cc1cc(C#N)cc(NCc2cccc3ccccc32)n1	ZINC000161040443	260790697	/nfs/dbraw/zinc/79/06/97/260790697.db2.gz	GTCQIQJXYSXXFJ-UHFFFAOYSA-N	0	0	273.339	4.027	20	30		CIEDRN
N#Cc1c(F)cccc1CSCc1ncc(Cl)s1	ZINC000427669793	260805045	/nfs/dbraw/zinc/80/50/45/260805045.db2.gz	BMTAUASHCSDETO-UHFFFAOYSA-N	0	0	298.795	4.241	20	30		CIEDRN
N#Cc1ccc(Cl)cc1NC[C@H]1CCCC1(F)F	ZINC000394484643	260974839	/nfs/dbraw/zinc/97/48/39/260974839.db2.gz	VIAILSIBRUNULW-SNVBAGLBSA-N	0	0	270.710	4.059	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)[C@H]1CCCCC1(C)C	ZINC000448252480	261064409	/nfs/dbraw/zinc/06/44/09/261064409.db2.gz	PGCNMVWVNBKRDO-CQSZACIVSA-N	0	0	278.440	4.182	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)[C@@H]1CCCCC1(C)C	ZINC000448252479	261064392	/nfs/dbraw/zinc/06/43/92/261064392.db2.gz	PGCNMVWVNBKRDO-AWEZNQCLSA-N	0	0	278.440	4.182	20	30		CIEDRN
C[C@@]1(C(=O)Nc2cccc(OCCCC#N)c2)CC=CCC1	ZINC000448732261	261065330	/nfs/dbraw/zinc/06/53/30/261065330.db2.gz	KOTBQFFPPVMNIT-GOSISDBHSA-N	0	0	298.386	4.054	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@H](C)c1oc2ccccc2c1C	ZINC000448732222	261065415	/nfs/dbraw/zinc/06/54/15/261065415.db2.gz	BYWOOKCUEJFBSK-GFCCVEGCSA-N	0	0	271.360	4.131	20	30		CIEDRN
CC[C@@H](Nc1ccn(CCC#N)n1)c1ccc(Cl)cc1	ZINC000152771537	261069279	/nfs/dbraw/zinc/06/92/79/261069279.db2.gz	IAJMLZZPBDZEHJ-CQSZACIVSA-N	0	0	288.782	4.013	20	30		CIEDRN
CC[C@H](C)c1ccc(OC[C@H](C#N)CCC#N)cc1	ZINC000153052488	261072994	/nfs/dbraw/zinc/07/29/94/261072994.db2.gz	SPPFDCZUDYIDND-KBPBESRZSA-N	0	0	256.349	4.022	20	30		CIEDRN
CCOc1ccc(NCCCC(C)(C)C#N)c(C)c1	ZINC000153470814	261078659	/nfs/dbraw/zinc/07/86/59/261078659.db2.gz	JDTACBZMUGAXFC-UHFFFAOYSA-N	0	0	260.381	4.136	20	30		CIEDRN
Cc1ccc(NCCCC(C)(C)C#N)cc1OC(F)F	ZINC000153998855	261085927	/nfs/dbraw/zinc/08/59/27/261085927.db2.gz	FVVAPRXUSOBUBW-UHFFFAOYSA-N	0	0	282.334	4.338	20	30		CIEDRN
CC[C@@H](CC#N)NC(=O)Nc1cccc(-c2cccs2)c1	ZINC000155947501	261110748	/nfs/dbraw/zinc/11/07/48/261110748.db2.gz	JUTZGKNRZUTXQI-ZDUSSCGKSA-N	0	0	299.399	4.229	20	30		CIEDRN
CC(C)N(C)c1cccc(NC2CCC(C)(C#N)CC2)c1	ZINC000449052363	261133152	/nfs/dbraw/zinc/13/31/52/261133152.db2.gz	DMUAMUGXRSRPPY-UHFFFAOYSA-N	0	0	285.435	4.416	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N1CCC[C@@H](C(C)C)CC1	ZINC000172216012	261152966	/nfs/dbraw/zinc/15/29/66/261152966.db2.gz	KZFUZJDXRUDHOH-MRXNPFEDSA-N	0	0	299.418	4.157	20	30		CIEDRN
CCC[C@@H]1C[C@H]1C(=O)N[C@H](C#N)c1ccc(C(C)(C)C)cc1	ZINC000464398934	261174349	/nfs/dbraw/zinc/17/43/49/261174349.db2.gz	NAQXIRVARQUALA-DJIMGWMZSA-N	0	0	298.430	4.101	20	30		CIEDRN
N#Cc1ccc(C(=O)Nc2cccc(C3CCC3)c2)cc1	ZINC000462369032	261197614	/nfs/dbraw/zinc/19/76/14/261197614.db2.gz	ODIOCIZBGIHYPH-UHFFFAOYSA-N	0	0	276.339	4.078	20	30		CIEDRN
N#Cc1cc(F)ccc1N[C@@H]1CCO[C@@H](c2ccccc2)C1	ZINC000160623552	261220841	/nfs/dbraw/zinc/22/08/41/261220841.db2.gz	KAOQSXBQOOKWQG-SJLPKXTDSA-N	0	0	296.345	4.030	20	30		CIEDRN
N#CCCCCSCc1csc(-c2ccco2)n1	ZINC000161258715	261242476	/nfs/dbraw/zinc/24/24/76/261242476.db2.gz	UCINAYBNJFTFAK-UHFFFAOYSA-N	0	0	278.402	4.330	20	30		CIEDRN
N#CCCCCSCc1csc(Br)c1	ZINC000161539969	261250312	/nfs/dbraw/zinc/25/03/12/261250312.db2.gz	LAZUYGCFWYIQJC-UHFFFAOYSA-N	0	0	290.251	4.438	20	30		CIEDRN
CCC(C)(CC)NC(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000175917338	261256139	/nfs/dbraw/zinc/25/61/39/261256139.db2.gz	YSWBKVXYVWYAAD-UHFFFAOYSA-N	0	0	287.407	4.188	20	30		CIEDRN
N#CCCCCSCc1cccc(OC(F)F)c1	ZINC000161679292	261256495	/nfs/dbraw/zinc/25/64/95/261256495.db2.gz	ZHWALFZQAGAOQL-UHFFFAOYSA-N	0	0	271.332	4.215	20	30		CIEDRN
C[C@H](CCc1ccco1)Nc1ccccc1O[C@@H](C)C#N	ZINC000162276301	261275262	/nfs/dbraw/zinc/27/52/62/261275262.db2.gz	AQGOBMKYCXROFD-KGLIPLIRSA-N	0	0	284.359	4.004	20	30		CIEDRN
N#Cc1ccc(C[N@@H+]2CCC[C@H]2c2cccs2)s1	ZINC000162706230	261292377	/nfs/dbraw/zinc/29/23/77/261292377.db2.gz	HFVNORZSXNDNJL-ZDUSSCGKSA-N	0	0	274.414	4.018	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H]1c2ccccc2CCC[C@@H]1C	ZINC000466306393	261390225	/nfs/dbraw/zinc/39/02/25/261390225.db2.gz	JSQMGZGTYMTVCT-KXBFYZLASA-N	0	0	283.415	4.010	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)Cc1ccccc1CC	ZINC000466363218	261394665	/nfs/dbraw/zinc/39/46/65/261394665.db2.gz	VGZGIVWNHWYZNS-UHFFFAOYSA-N	0	0	299.439	4.068	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N[C@@H](C)c1ccc(SC)cc1	ZINC000466379081	261398570	/nfs/dbraw/zinc/39/85/70/261398570.db2.gz	VNEBIIMAMDIMCT-JSGCOSHPSA-N	0	0	292.448	4.123	20	30		CIEDRN
N#CCCCCNC(=O)Nc1cccc(-c2cccs2)c1	ZINC000171389486	261463138	/nfs/dbraw/zinc/46/31/38/261463138.db2.gz	CWUALHVXJLDFMV-UHFFFAOYSA-N	0	0	299.399	4.230	20	30		CIEDRN
CC/C=C(\C)C(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1	ZINC000171932901	261486757	/nfs/dbraw/zinc/48/67/57/261486757.db2.gz	WTFDCOFXETWAJR-FAFAAHBOSA-N	0	0	297.185	4.031	20	30		CIEDRN
CC(C)(C)[C@@H]1C[C@H](Nc2c(Cl)cccc2C#N)CCO1	ZINC000487109234	261645649	/nfs/dbraw/zinc/64/56/49/261645649.db2.gz	NUDQJDVSRNYCRR-OCCSQVGLSA-N	0	0	292.810	4.217	20	30		CIEDRN
Cc1cccc(C(C)C)c1NC(=O)c1cc(C#N)cs1	ZINC000176818058	261670643	/nfs/dbraw/zinc/67/06/43/261670643.db2.gz	WNBLYJWHXGPAJP-UHFFFAOYSA-N	0	0	284.384	4.304	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@@H]1CCCc2occc21)c1ccccc1	ZINC000187844501	261784577	/nfs/dbraw/zinc/78/45/77/261784577.db2.gz	VEOOYBNPXRGUJL-NVXWUHKLSA-N	0	0	295.382	4.133	20	30		CIEDRN
CCCC(CCC)C(=O)Nc1ccccc1O[C@H](C)C#N	ZINC000182149033	261925963	/nfs/dbraw/zinc/92/59/63/261925963.db2.gz	MPKFMQYNXVQLMQ-CYBMUJFWSA-N	0	0	288.391	4.132	20	30		CIEDRN
C[C@@H](C#N)Oc1ccccc1NCc1ccc2c(c1)CCC2	ZINC000182557581	261943721	/nfs/dbraw/zinc/94/37/21/261943721.db2.gz	LEUGYWHITUDSGH-AWEZNQCLSA-N	0	0	292.382	4.078	20	30		CIEDRN
CC(C)c1ccc([C@@H](C)Nc2ccn(CCC#N)n2)cc1	ZINC000183099465	261963448	/nfs/dbraw/zinc/96/34/48/261963448.db2.gz	HRMHGPJFDJGNPE-CQSZACIVSA-N	0	0	282.391	4.093	20	30		CIEDRN
CC(C)(C)N(Cc1ccccc1)C(=O)c1cc(C#N)cs1	ZINC000185536716	262059352	/nfs/dbraw/zinc/05/93/52/262059352.db2.gz	JALJKLWSTVKZCF-UHFFFAOYSA-N	0	0	298.411	4.061	20	30		CIEDRN
CC[C@@H]1[C@H](C)CCN1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000186088177	262079119	/nfs/dbraw/zinc/07/91/19/262079119.db2.gz	KRGLQDYNKQRQEB-CZUORRHYSA-N	0	0	299.418	4.140	20	30		CIEDRN
C[C@H]1CCCCN(C(=O)Nc2ccc(C(C)(C)C#N)cc2)C1	ZINC000186088929	262079275	/nfs/dbraw/zinc/07/92/75/262079275.db2.gz	MRRFLPJTZOKCQU-AWEZNQCLSA-N	0	0	299.418	4.142	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)C[C@H]2C=CCCC2)cc1	ZINC000186586055	262100751	/nfs/dbraw/zinc/10/07/51/262100751.db2.gz	DAEPIAMRSUMEGO-AWEZNQCLSA-N	0	0	282.387	4.173	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000186964911	262119073	/nfs/dbraw/zinc/11/90/73/262119073.db2.gz	SJUVMZYNASGRCI-UHFFFAOYSA-N	0	0	282.334	4.228	20	30		CIEDRN
CCc1ccccc1CNc1ccccc1O[C@H](C)C#N	ZINC000187307850	262131732	/nfs/dbraw/zinc/13/17/32/262131732.db2.gz	HLIXTEMOIOJHIT-CQSZACIVSA-N	0	0	280.371	4.152	20	30		CIEDRN
CC#CCCCC(=O)N1[C@@H](C)CCC[C@H]1c1ccccc1	ZINC000364067130	262134714	/nfs/dbraw/zinc/13/47/14/262134714.db2.gz	OWDBDBWJNWEVEG-WMZOPIPTSA-N	0	0	283.415	4.322	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](c2cccs2)C[C@H]1C	ZINC000364068472	262135395	/nfs/dbraw/zinc/13/53/95/262135395.db2.gz	SLTCNVLMZUUFFD-MJBXVCDLSA-N	0	0	277.433	4.055	20	30		CIEDRN
C=CCCc1ccccc1NCc1cnn(C(C)(C)C)c1	ZINC000500400111	262146731	/nfs/dbraw/zinc/14/67/31/262146731.db2.gz	RNOUXICQTZAECD-UHFFFAOYSA-N	0	0	283.419	4.369	20	30		CIEDRN
CCCC[C@@H](C)C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000500505160	262156728	/nfs/dbraw/zinc/15/67/28/262156728.db2.gz	WFGPHYORIBRSID-CYBMUJFWSA-N	0	0	272.392	4.253	20	30		CIEDRN
CC#CCCNC(=O)c1oc2c(ccc3ccccc23)c1C	ZINC000498604105	262167731	/nfs/dbraw/zinc/16/77/31/262167731.db2.gz	GTAILQCZXXATHZ-UHFFFAOYSA-N	0	0	291.350	4.038	20	30		CIEDRN
C=C(C)CN(CC)C(=O)CCc1ccc(-c2ccccc2)o1	ZINC000497491661	262169740	/nfs/dbraw/zinc/16/97/40/262169740.db2.gz	ZXZLHVIZAVRWRW-UHFFFAOYSA-N	0	0	297.398	4.304	20	30		CIEDRN
C=CCCC(=O)N1[C@@H](C)CCC[C@H]1c1ccccc1	ZINC000364177137	262180699	/nfs/dbraw/zinc/18/06/99/262180699.db2.gz	YBSCZRCDEDWTLG-HOCLYGCPSA-N	0	0	257.377	4.095	20	30		CIEDRN
Cc1nc(C(F)(F)F)c(CSCCCC#N)s1	ZINC000191015098	262187878	/nfs/dbraw/zinc/18/78/78/262187878.db2.gz	YLSVXYKALDFUMZ-UHFFFAOYSA-N	0	0	280.340	4.007	20	30		CIEDRN
C[C@@H](Sc1cc(C#N)ccn1)c1ccc(F)cc1F	ZINC000497671112	262188017	/nfs/dbraw/zinc/18/80/17/262188017.db2.gz	KUULDQLLRXGZKV-SECBINFHSA-N	0	0	276.311	4.085	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc(-c2ccc[nH]2)cc1	ZINC000497740870	262198468	/nfs/dbraw/zinc/19/84/68/262198468.db2.gz	VASFNIUAYRYWAG-UHFFFAOYSA-N	0	0	268.360	4.223	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)c1cc(C)ccc1C	ZINC000497791248	262209010	/nfs/dbraw/zinc/20/90/10/262209010.db2.gz	RZRPNURNZLOQFK-UHFFFAOYSA-N	0	0	279.383	4.132	20	30		CIEDRN
N#C[C@@H]1CCC[C@@H](Nc2ccc3oc(C4CC4)nc3c2)C1	ZINC000193083964	262215546	/nfs/dbraw/zinc/21/55/46/262215546.db2.gz	AYYSQRCPXHMKPZ-DGCLKSJQSA-N	0	0	281.359	4.199	20	30		CIEDRN
CCCC(=O)Nc1cccc(N[C@@H]2CCC[C@H](C#N)C2)c1C	ZINC000193087211	262215964	/nfs/dbraw/zinc/21/59/64/262215964.db2.gz	VZYHMHIYXHRCGG-LSDHHAIUSA-N	0	0	299.418	4.228	20	30		CIEDRN
Cc1coc(-c2cc(N[C@H]3CCC[C@@H](C#N)C3)ccc2C)n1	ZINC000193269198	262219795	/nfs/dbraw/zinc/21/97/95/262219795.db2.gz	VCACKMQDJHYNAC-CABCVRRESA-N	0	0	295.386	4.453	20	30		CIEDRN
N#CCN(C(=O)CCCC1CCCCC1)c1ccccc1	ZINC000497899957	262230167	/nfs/dbraw/zinc/23/01/67/262230167.db2.gz	QVKVMPOEKVFVSA-UHFFFAOYSA-N	0	0	284.403	4.294	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)[C@@H](OC(C)C)c1ccccc1	ZINC000497938943	262236358	/nfs/dbraw/zinc/23/63/58/262236358.db2.gz	SOGWNZLZWJBYJN-WBVHZDCISA-N	0	0	289.419	4.014	20	30		CIEDRN
C=CC1CCN(C(=O)c2ccccc2SC(C)C)CC1	ZINC000110363531	262257025	/nfs/dbraw/zinc/25/70/25/262257025.db2.gz	NJBVAOOESGDNGE-UHFFFAOYSA-N	0	0	289.444	4.225	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@H](c3ccc(C)cc3)C2)CCC1	ZINC000365084237	262277432	/nfs/dbraw/zinc/27/74/32/262277432.db2.gz	ILQXNGLUUZGDFE-KRWDZBQOSA-N	0	0	283.415	4.057	20	30		CIEDRN
Cc1cc(S[C@@H](C)CCC#N)nc2ccccc12	ZINC000188223649	262285770	/nfs/dbraw/zinc/28/57/70/262285770.db2.gz	ATSMQXQENKUDMR-LBPRGKRZSA-N	0	0	256.374	4.328	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](C)c1ccc(Cl)cc1	ZINC000184909246	262300020	/nfs/dbraw/zinc/30/00/20/262300020.db2.gz	ZDCNLLPAADUEQF-RYUDHWBXSA-N	0	0	265.784	4.120	20	30		CIEDRN
Cc1ccc(Br)cc1N[C@@H]1CCC[C@H](C#N)C1	ZINC000463285972	262305244	/nfs/dbraw/zinc/30/52/44/262305244.db2.gz	ZFRLEKDKLVUOOR-WCQYABFASA-N	0	0	293.208	4.252	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)c1cc2sccc2[nH]1	ZINC000188598684	262323856	/nfs/dbraw/zinc/32/38/56/262323856.db2.gz	KNAAYMFHYMDWKC-UHFFFAOYSA-N	0	0	296.395	4.058	20	30		CIEDRN
N#Cc1cccc(CSCc2ccccc2)c1F	ZINC000219762336	262350537	/nfs/dbraw/zinc/35/05/37/262350537.db2.gz	NEQJDHNSDZYABE-UHFFFAOYSA-N	0	0	257.333	4.131	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1cc(SC)ccc1C	ZINC000488573071	262377579	/nfs/dbraw/zinc/37/75/79/262377579.db2.gz	MCVZWIWYXKTUOQ-CYBMUJFWSA-N	0	0	290.432	4.289	20	30		CIEDRN
CCc1ccc(NC(=O)[C@@H](C)c2cccc(C#N)c2)cc1F	ZINC000462240334	262380334	/nfs/dbraw/zinc/38/03/34/262380334.db2.gz	WPCJAWZGYZQJKY-LBPRGKRZSA-N	0	0	296.345	4.002	20	30		CIEDRN
N#Cc1ccc(Oc2cccc(F)c2C#N)c(Cl)c1	ZINC000060205642	262391074	/nfs/dbraw/zinc/39/10/74/262391074.db2.gz	RFEZDOXBXWXNKY-UHFFFAOYSA-N	0	0	272.666	4.015	20	30		CIEDRN
C[C@H]1CC[C@H](NC(=O)C2(C#N)CCCCC2)c2ccccc21	ZINC000125210153	262593580	/nfs/dbraw/zinc/59/35/80/262593580.db2.gz	KBJWABRCQJFJMG-YOEHRIQHSA-N	0	0	296.414	4.215	20	30		CIEDRN
CCCC(CCC)C(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000410602255	262631677	/nfs/dbraw/zinc/63/16/77/262631677.db2.gz	LIGUOFCDTNVNNB-KRWDZBQOSA-N	0	0	286.419	4.364	20	30		CIEDRN
CC(C)(C)[C@](C)(C#N)NC(=O)c1cc(F)c2ccccc2c1	ZINC000410677965	262655170	/nfs/dbraw/zinc/65/51/70/262655170.db2.gz	VLNHXZDWBNMIJQ-SFHVURJKSA-N	0	0	298.361	4.037	20	30		CIEDRN
CC(C)c1ccccc1N(C)C(=O)[C@]1(C#N)CC12CCCC2	ZINC000410870630	262670592	/nfs/dbraw/zinc/67/05/92/262670592.db2.gz	ISWYLNJBSXOXKU-LJQANCHMSA-N	0	0	296.414	4.247	20	30		CIEDRN
Cc1cccc2c1N(C(=O)c1ccc(C#N)cc1)CC[C@H]2C	ZINC000410965094	262673894	/nfs/dbraw/zinc/67/38/94/262673894.db2.gz	DPCXCGJDMCTYOQ-CYBMUJFWSA-N	0	0	290.366	4.021	20	30		CIEDRN
C[C@@H]1CCC[C@@H]1CC(=O)Nc1ccc(Cl)cc1CC#N	ZINC000410965486	262673903	/nfs/dbraw/zinc/67/39/03/262673903.db2.gz	JHVCJOFNCPTKMQ-VXGBXAGGSA-N	0	0	290.794	4.171	20	30		CIEDRN
C=CCCC(=O)Nc1cc(Cl)ccc1OC(F)(F)F	ZINC000410967639	262673945	/nfs/dbraw/zinc/67/39/45/262673945.db2.gz	LCYQNHROBMSXTN-UHFFFAOYSA-N	0	0	293.672	4.143	20	30		CIEDRN
CC(C)CCCC(=O)Nc1ccc(Cl)cc1CC#N	ZINC000410962257	262674514	/nfs/dbraw/zinc/67/45/14/262674514.db2.gz	CGCOPUVSRQCTCV-UHFFFAOYSA-N	0	0	278.783	4.171	20	30		CIEDRN
N#CCCSCCCOc1cccc2ccccc21	ZINC000413016178	262752840	/nfs/dbraw/zinc/75/28/40/262752840.db2.gz	VKFKZRNUPNINTE-UHFFFAOYSA-N	0	0	271.385	4.256	20	30		CIEDRN
Clc1ccc(-c2nc(CON=C3CCC3)co2)cc1	ZINC000265454998	262907778	/nfs/dbraw/zinc/90/77/78/262907778.db2.gz	LRGGDSGPKJYOCR-UHFFFAOYSA-N	0	0	276.723	4.052	20	30		CIEDRN
C[C@@H]([NH2+]CCC(C)(C)C#N)c1ccc(-c2cccnc2)cc1	ZINC000272061412	263001953	/nfs/dbraw/zinc/00/19/53/263001953.db2.gz	WORHBEYFOTZMOY-OAHLLOKOSA-N	0	0	293.414	4.339	20	30		CIEDRN
CC(C)(C)c1ccccc1NC(=O)N1CCC(C)(C#N)CC1	ZINC000272460402	263004867	/nfs/dbraw/zinc/00/48/67/263004867.db2.gz	CFCHPIQWXSMCDE-UHFFFAOYSA-N	0	0	299.418	4.142	20	30		CIEDRN
CC1(C#N)CCN(c2cc3ccccc3c(Cl)n2)CC1	ZINC000272488946	263005362	/nfs/dbraw/zinc/00/53/62/263005362.db2.gz	PSWPYMAHLBXFEK-UHFFFAOYSA-N	0	0	285.778	4.018	20	30		CIEDRN
Cc1cccc(C(C)C)c1NC(=O)N1CCC(C)(C#N)CC1	ZINC000272573454	263007179	/nfs/dbraw/zinc/00/71/79/263007179.db2.gz	SIHRNKJZYAUCMN-UHFFFAOYSA-N	0	0	299.418	4.276	20	30		CIEDRN
CCCC[C@@H](ON=C(C)C)C(=O)Nc1c(C)cccc1C	ZINC000272641600	263007891	/nfs/dbraw/zinc/00/78/91/263007891.db2.gz	XSVCPSSEDCFTMQ-OAHLLOKOSA-N	0	0	290.407	4.213	20	30		CIEDRN
Cc1cc(N[C@@H](C)c2ccc(C(C)C)cc2)nn1CCC#N	ZINC000273008446	263010909	/nfs/dbraw/zinc/01/09/09/263010909.db2.gz	OHFYQSBRYFHALZ-HNNXBMFYSA-N	0	0	296.418	4.402	20	30		CIEDRN
CC(C)c1ccc(NC(=O)NCCCC#N)c(C(C)C)c1	ZINC000273279190	263014690	/nfs/dbraw/zinc/01/46/90/263014690.db2.gz	VVQZNOXUFRKLCX-UHFFFAOYSA-N	0	0	287.407	4.359	20	30		CIEDRN
Cc1c2cccc(C)c2oc1C(=O)N[C@@](C)(C#N)C(C)(C)C	ZINC000274355280	263023259	/nfs/dbraw/zinc/02/32/59/263023259.db2.gz	RXCYCNRRSDBRCB-SFHVURJKSA-N	0	0	298.386	4.108	20	30		CIEDRN
Cc1cc(Cl)c(C(=O)N[C@](C)(C#N)C(C)(C)C)cc1C	ZINC000274346506	263023301	/nfs/dbraw/zinc/02/33/01/263023301.db2.gz	PWNOSAUMNUPBBJ-MRXNPFEDSA-N	0	0	292.810	4.015	20	30		CIEDRN
CC(C)(C#N)CCSCc1ccn(-c2ccccc2)n1	ZINC000276622584	263037697	/nfs/dbraw/zinc/03/76/97/263037697.db2.gz	OENQSVMBHJZQGS-UHFFFAOYSA-N	0	0	285.416	4.045	20	30		CIEDRN
CCCCCCC[C@@H](CC(=O)[O-])[NH2+]Cc1ccc(C)s1	ZINC000277235185	263040402	/nfs/dbraw/zinc/04/04/02/263040402.db2.gz	IUSQFGWYIVOUAF-AWEZNQCLSA-N	0	0	297.464	4.350	20	30		CIEDRN
CCCCCCC[C@@H](CC(=O)[O-])[NH2+]Cc1ccc(CC)o1	ZINC000277333070	263040650	/nfs/dbraw/zinc/04/06/50/263040650.db2.gz	OLSCZHRPLIMZJV-AWEZNQCLSA-N	0	0	295.423	4.135	20	30		CIEDRN
CCCCCCC[C@@H](CC(=O)[O-])[NH2+]Cc1ccc(C)cc1	ZINC000277451004	263041303	/nfs/dbraw/zinc/04/13/03/263041303.db2.gz	VBCCYSQVLSJWID-KRWDZBQOSA-N	0	0	291.435	4.288	20	30		CIEDRN
C=CCC1(C(=O)N2CCC[C@@H](CSC)C2)CCCCC1	ZINC000452158383	263041452	/nfs/dbraw/zinc/04/14/52/263041452.db2.gz	HKIRZSGFOWWGHN-OAHLLOKOSA-N	0	0	295.492	4.115	20	30		CIEDRN
Cc1cc(C[S@](=O)CCCCC(C)(C)C#N)c(C)s1	ZINC000277495677	263041557	/nfs/dbraw/zinc/04/15/57/263041557.db2.gz	ASHNATMSFDRUFD-LJQANCHMSA-N	0	0	297.489	4.334	20	30		CIEDRN
CC(C)(C#N)CCSc1nc(-c2ccccc2)co1	ZINC000277535387	263041844	/nfs/dbraw/zinc/04/18/44/263041844.db2.gz	IAHMCCYLMXRYNM-UHFFFAOYSA-N	0	0	272.373	4.374	20	30		CIEDRN
CC(C)(C#N)CCCC[S@@](=O)C/C=C/c1ccccc1	ZINC000277847049	263044094	/nfs/dbraw/zinc/04/40/94/263044094.db2.gz	LBOAGXMCILWZJQ-OJLWIZQOSA-N	0	0	289.444	4.169	20	30		CIEDRN
Cc1ccc(C)c(C[S@@](=O)CCCCC(C)(C)C#N)c1	ZINC000278152089	263045693	/nfs/dbraw/zinc/04/56/93/263045693.db2.gz	CCERMCAXXJVABX-FQEVSTJZSA-N	0	0	291.460	4.272	20	30		CIEDRN
CC(C)(C#N)CCCC[S@](=O)Cc1cccc(Cl)c1	ZINC000278285763	263046528	/nfs/dbraw/zinc/04/65/28/263046528.db2.gz	PNCHGSHUHIHMDX-IBGZPJMESA-N	0	0	297.851	4.309	20	30		CIEDRN
N#C[C@@H]1CC[C@@H](Sc2nc3ccccc3n2C(F)F)C1	ZINC000278489946	263048466	/nfs/dbraw/zinc/04/84/66/263048466.db2.gz	BBCFLJLKRWKOTA-NXEZZACHSA-N	0	0	293.342	4.216	20	30		CIEDRN
N#C[C@@H]1CC[C@H](Sc2ccc3ccccc3n2)C1	ZINC000278566807	263049237	/nfs/dbraw/zinc/04/92/37/263049237.db2.gz	NDUSDHPEAUPFQL-YPMHNXCESA-N	0	0	254.358	4.019	20	30		CIEDRN
CSc1cccc(N[C@@H]2CCC[C@H](C#N)C2)c1C	ZINC000278776416	263050953	/nfs/dbraw/zinc/05/09/53/263050953.db2.gz	PNJGBQWFVDRBMX-QWHCGFSZSA-N	0	0	260.406	4.211	20	30		CIEDRN
CC(C)(C#N)Cc1nc(-c2c(Cl)cccc2Cl)no1	ZINC000278993594	263052188	/nfs/dbraw/zinc/05/21/88/263052188.db2.gz	LHASJIHHOXNATF-UHFFFAOYSA-N	0	0	296.157	4.136	20	30		CIEDRN
Cc1cccc(NC(=O)c2ccc(C(C)(C)C#N)cc2)c1C	ZINC000279578617	263056092	/nfs/dbraw/zinc/05/60/92/263056092.db2.gz	GQGSYWIRKNUUNT-UHFFFAOYSA-N	0	0	292.382	4.357	20	30		CIEDRN
C[C@H](C[S@@](=O)CCCCC(C)(C)C#N)c1ccccc1	ZINC000280072536	263059060	/nfs/dbraw/zinc/05/90/60/263059060.db2.gz	USDPNFNEDKIXLC-QRWLVFNGSA-N	0	0	291.460	4.259	20	30		CIEDRN
CCC[C@@](C)(CC)C(=O)Nc1ccccc1O[C@@H](C)C#N	ZINC000280448332	263061762	/nfs/dbraw/zinc/06/17/62/263061762.db2.gz	VXZTVRDWGZUPSI-SUMWQHHRSA-N	0	0	288.391	4.132	20	30		CIEDRN
CN(C(=O)c1ccc(C(C)(C)C#N)cc1)C1CCCCCC1	ZINC000280784597	263064325	/nfs/dbraw/zinc/06/43/25/263064325.db2.gz	FYHLTCGOHBAOOB-UHFFFAOYSA-N	0	0	298.430	4.283	20	30		CIEDRN
CC(C)(C#N)CCC[S@](=O)Cc1cccc(C(F)F)c1	ZINC000280990085	263065577	/nfs/dbraw/zinc/06/55/77/263065577.db2.gz	MRMXBEZCALLXFL-FQEVSTJZSA-N	0	0	299.386	4.203	20	30		CIEDRN
C[C@H]1CCCC[C@@H]1N(C)C(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000281031613	263065759	/nfs/dbraw/zinc/06/57/59/263065759.db2.gz	YPYNZWOLBDLMKZ-YOEHRIQHSA-N	0	0	298.430	4.138	20	30		CIEDRN
Cc1ccc(SCCCC2(C#N)CCOCC2)cc1C	ZINC000281054413	263066311	/nfs/dbraw/zinc/06/63/11/263066311.db2.gz	STAHGZFPEQODSG-UHFFFAOYSA-N	0	0	289.444	4.496	20	30		CIEDRN
CCCc1ccc(OCCCC2(C#N)CCOCC2)cc1	ZINC000281390923	263068559	/nfs/dbraw/zinc/06/85/59/263068559.db2.gz	PTWUSTWFGXBKQL-UHFFFAOYSA-N	0	0	287.403	4.118	20	30		CIEDRN
Cc1ccc(NCCCC2(C#N)CCOCC2)cc1Cl	ZINC000281382412	263068604	/nfs/dbraw/zinc/06/86/04/263068604.db2.gz	YXMJAWMZMIUDOA-UHFFFAOYSA-N	0	0	292.810	4.161	20	30		CIEDRN
N#CC1(CCCSCc2cccc(F)c2)CCOCC1	ZINC000281823235	263072171	/nfs/dbraw/zinc/07/21/71/263072171.db2.gz	KHMQXNNFRKOAIK-UHFFFAOYSA-N	0	0	293.407	4.159	20	30		CIEDRN
CC(C)(C#N)CCCCSCC(=O)Nc1ccccc1	ZINC000282132575	263074580	/nfs/dbraw/zinc/07/45/80/263074580.db2.gz	LIUGLAAKDFPROF-UHFFFAOYSA-N	0	0	290.432	4.078	20	30		CIEDRN
C[C@@H](C1CCCCC1)N(C)C(=O)Nc1ccc(CC#N)cc1	ZINC000282608212	263077752	/nfs/dbraw/zinc/07/77/52/263077752.db2.gz	ZRMIVEJERWCROF-AWEZNQCLSA-N	0	0	299.418	4.185	20	30		CIEDRN
CO[C@H](CSCCCC#N)c1ccc(Cl)cc1	ZINC000282742682	263078389	/nfs/dbraw/zinc/07/83/89/263078389.db2.gz	YCGDFLCMHUOGBP-CYBMUJFWSA-N	0	0	269.797	4.064	20	30		CIEDRN
CCC[C@@H](C(=O)NCC1CCC(C#N)CC1)c1ccccc1	ZINC000282851296	263079210	/nfs/dbraw/zinc/07/92/10/263079210.db2.gz	WVXHGZOGRFTXCU-LEOMRAHMSA-N	0	0	298.430	4.016	20	30		CIEDRN
CO[C@@H](CSCCC(C)(C)C#N)c1ccccc1	ZINC000282875397	263079228	/nfs/dbraw/zinc/07/92/28/263079228.db2.gz	AMSILBLTBSEBMU-AWEZNQCLSA-N	0	0	263.406	4.047	20	30		CIEDRN
CO[C@H](CSCCC(C)(C)C#N)c1ccccc1	ZINC000282875402	263079300	/nfs/dbraw/zinc/07/93/00/263079300.db2.gz	AMSILBLTBSEBMU-CQSZACIVSA-N	0	0	263.406	4.047	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)Nc1ccc2oc(C(C)(C)C)nc2c1	ZINC000284993494	263088833	/nfs/dbraw/zinc/08/88/33/263088833.db2.gz	CHUVECSWVAGHJO-KRWDZBQOSA-N	0	0	299.374	4.004	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)Nc1ccc2nc(C3CC3)sc2c1	ZINC000285053750	263089858	/nfs/dbraw/zinc/08/98/58/263089858.db2.gz	CYSPHWRGFNXMOA-MRXNPFEDSA-N	0	0	299.399	4.052	20	30		CIEDRN
Cc1ccc(N(CCC#N)C(=O)c2cc[nH]c2C(C)C)cc1	ZINC000285112916	263090301	/nfs/dbraw/zinc/09/03/01/263090301.db2.gz	LZXDYTFKFQZGLX-UHFFFAOYSA-N	0	0	295.386	4.007	20	30		CIEDRN
Cc1oc(C(C)C)cc1C(=O)Nc1ccc(CC#N)cc1	ZINC000285167817	263090857	/nfs/dbraw/zinc/09/08/57/263090857.db2.gz	YSGAOXHPGKNOHM-UHFFFAOYSA-N	0	0	282.343	4.030	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)Nc1ccc(SC(C)(C)C)cc1	ZINC000285823263	263095931	/nfs/dbraw/zinc/09/59/31/263095931.db2.gz	ZYPZVPBAQVUEDQ-INIZCTEOSA-N	0	0	290.432	4.456	20	30		CIEDRN
Cc1ccnc([C@@H](C)Nc2cccc(OCCCC#N)c2)c1	ZINC000286002660	263096852	/nfs/dbraw/zinc/09/68/52/263096852.db2.gz	HPZNRCWBGWKKRV-OAHLLOKOSA-N	0	0	295.386	4.246	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)Nc1cc(-c2ccc(C)o2)ccc1C	ZINC000286042732	263096948	/nfs/dbraw/zinc/09/69/48/263096948.db2.gz	SYWILCBAWJPHCM-SFHVURJKSA-N	0	0	296.370	4.442	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)N[C@H](C)c1cc(Cl)ccc1Cl	ZINC000286667711	263099087	/nfs/dbraw/zinc/09/90/87/263099087.db2.gz	DBWMUUCYFWBNQC-YMTOWFKASA-N	0	0	299.201	4.110	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)Nc1cc(C(F)F)ccc1Cl	ZINC000286771350	263099500	/nfs/dbraw/zinc/09/95/00/263099500.db2.gz	NPKTWVUDFFDJQA-ZDUSSCGKSA-N	0	0	286.709	4.156	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)Nc1ccccc1CCC(F)(F)F	ZINC000288563657	263104895	/nfs/dbraw/zinc/10/48/95/263104895.db2.gz	JZQJNLULTLECRB-AWEZNQCLSA-N	0	0	298.308	4.060	20	30		CIEDRN
CC(C)(C#N)CCNc1ccccc1CC(F)(F)F	ZINC000288633624	263105321	/nfs/dbraw/zinc/10/53/21/263105321.db2.gz	BKYMVHGHKOTBIU-UHFFFAOYSA-N	0	0	270.298	4.143	20	30		CIEDRN
N#CCCCC(=O)Nc1cc(Cl)c(Cl)cc1Cl	ZINC000291067369	263119753	/nfs/dbraw/zinc/11/97/53/263119753.db2.gz	DQFWMVJRWCZPOC-UHFFFAOYSA-N	0	0	291.565	4.279	20	30		CIEDRN
N#CC1CCC(CN[C@H](c2ccccc2)C(F)(F)F)CC1	ZINC000291188000	263120781	/nfs/dbraw/zinc/12/07/81/263120781.db2.gz	LEVYNFOZYNNIKZ-SSDMNJCBSA-N	0	0	296.336	4.210	20	30		CIEDRN
CCCN(C(=O)CCCC#N)[C@H](C)c1cc2ccccc2o1	ZINC000292195977	263129492	/nfs/dbraw/zinc/12/94/92/263129492.db2.gz	CAWMLXUJFOVYCQ-CQSZACIVSA-N	0	0	298.386	4.426	20	30		CIEDRN
N#CCCCC(=O)N1CCCCC[C@@H]1/C=C/c1ccccc1	ZINC000292285770	263130598	/nfs/dbraw/zinc/13/05/98/263130598.db2.gz	LZMIIKBKPYMCSF-KAUXGEHWSA-N	0	0	296.414	4.165	20	30		CIEDRN
CC(C)(C#N)CCCOc1cc(F)c(Cl)cc1C=O	ZINC000292631027	263133290	/nfs/dbraw/zinc/13/32/90/263133290.db2.gz	AZSWSSCBVCMQFH-UHFFFAOYSA-N	0	0	283.730	4.000	20	30		CIEDRN
N#C[C@@H]1CC[C@H](N2CCc3c(Cl)cc(Cl)cc3C2)C1	ZINC000292763004	263134891	/nfs/dbraw/zinc/13/48/91/263134891.db2.gz	IZTXUYVCKDVAAD-MFKMUULPSA-N	0	0	295.213	4.044	20	30		CIEDRN
C=C(C)CCNC(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1Cl	ZINC000452722945	263136875	/nfs/dbraw/zinc/13/68/75/263136875.db2.gz	LQRFIBRJRPGNDJ-VXGBXAGGSA-N	0	0	298.213	4.179	20	30		CIEDRN
CC/C(C)=C/C(=O)Nc1ccccc1SC[C@@H](C)C#N	ZINC000294779858	263167411	/nfs/dbraw/zinc/16/74/11/263167411.db2.gz	ZUYBMZGSUGABFL-SRXBQZRASA-N	0	0	288.416	4.233	20	30		CIEDRN
N#CC[C@@H]1CC[C@H](Nc2ccc(C(F)(F)F)c(C#N)c2)C1	ZINC000295075681	263172120	/nfs/dbraw/zinc/17/21/20/263172120.db2.gz	WYMBOGVFSBJALS-JQWIXIFHSA-N	0	0	293.292	4.071	20	30		CIEDRN
Cc1coc2ccc(NC(=O)[C@@]3(C#N)CC34CCCC4)cc12	ZINC000296098727	263185598	/nfs/dbraw/zinc/18/55/98/263185598.db2.gz	XBXMPAGDTHUYHE-SFHVURJKSA-N	0	0	294.354	4.154	20	30		CIEDRN
N#CCCCc1nc(C2CCC(c3ccccc3)CC2)no1	ZINC000296423335	263191516	/nfs/dbraw/zinc/19/15/16/263191516.db2.gz	LPJXYXWWIMFVQO-UHFFFAOYSA-N	0	0	295.386	4.357	20	30		CIEDRN
C[C@H](CC#N)N(C)Cc1ccc([C@@H](C)C(F)(F)F)cc1	ZINC000296889515	263197857	/nfs/dbraw/zinc/19/78/57/263197857.db2.gz	XWJPUNNBXJACBF-VXGBXAGGSA-N	0	0	284.325	4.086	20	30		CIEDRN
N#CC[C@@H]1CC[C@H](NC(=O)Nc2csc3ccccc23)C1	ZINC000296933047	263198238	/nfs/dbraw/zinc/19/82/38/263198238.db2.gz	UWNDUGQWWLUHHE-RYUDHWBXSA-N	0	0	299.399	4.105	20	30		CIEDRN
C=CCCO[C@@H](C)c1nc(-c2ccc(C)c(Cl)c2)no1	ZINC000453189988	263201299	/nfs/dbraw/zinc/20/12/99/263201299.db2.gz	UGXVJXPHNZMRLE-NSHDSACASA-N	0	0	292.766	4.352	20	30		CIEDRN
N#CCCSc1ccccc1NCC1CC(F)(F)C1	ZINC000297744165	263209385	/nfs/dbraw/zinc/20/93/85/263209385.db2.gz	OBEQVIQYFBHRFU-UHFFFAOYSA-N	0	0	282.359	4.150	20	30		CIEDRN
CCCCCCCC(=O)Nc1cc(NC(C)=O)ccc1C	ZINC000298415245	263219294	/nfs/dbraw/zinc/21/92/94/263219294.db2.gz	SIMPAAITFZREHA-UHFFFAOYSA-N	0	0	290.407	4.252	20	30		CIEDRN
CCCCCCCC(=O)Nc1ccccc1COC	ZINC000298498474	263220677	/nfs/dbraw/zinc/22/06/77/263220677.db2.gz	MZXZEJDCINKKPZ-UHFFFAOYSA-N	0	0	263.381	4.132	20	30		CIEDRN
CCCCCCCCC(=O)N1CCC[C@H]1c1ccc[nH]1	ZINC000298847312	263227157	/nfs/dbraw/zinc/22/71/57/263227157.db2.gz	DHHKGRSFUNOSJE-INIZCTEOSA-N	0	0	276.424	4.429	20	30		CIEDRN
C[C@H](CCC#N)[NH2+][C@@H](C)c1ccc(-c2cccnc2)cc1	ZINC000299007764	263228981	/nfs/dbraw/zinc/22/89/81/263228981.db2.gz	QPIWMXNIRXYIHY-CABCVRRESA-N	0	0	279.387	4.091	20	30		CIEDRN
CCN(Cc1ccc2ccccc2c1)C[C@@H](C#N)CCC#N	ZINC000299167000	263232905	/nfs/dbraw/zinc/23/29/05/263232905.db2.gz	PEXYTVBUFSDEIP-QGZVFWFLSA-N	0	0	291.398	4.105	20	30		CIEDRN
C[C@@H](c1cccs1)N(CCC#N)Cc1ccccc1	ZINC000299402632	263241952	/nfs/dbraw/zinc/24/19/52/263241952.db2.gz	MNYJJKMPHZGFQM-AWEZNQCLSA-N	0	0	270.401	4.225	20	30		CIEDRN
CC[C@@H](C)Sc1ccc(NC(=O)C(C)(C)C#N)c(C)c1	ZINC000299466013	263243250	/nfs/dbraw/zinc/24/32/50/263243250.db2.gz	FHSMCVRGXRLQFX-GFCCVEGCSA-N	0	0	290.432	4.374	20	30		CIEDRN
N#CCC[C@H](Nc1ncnc2sccc21)c1ccccc1	ZINC000164280513	263270305	/nfs/dbraw/zinc/27/03/05/263270305.db2.gz	HTJBLSOCXUGKSA-AWEZNQCLSA-N	0	0	294.383	4.148	20	30		CIEDRN
N#CCC[C@@H](Nc1ncnc2sccc21)c1ccccc1	ZINC000164280390	263270680	/nfs/dbraw/zinc/27/06/80/263270680.db2.gz	HTJBLSOCXUGKSA-CQSZACIVSA-N	0	0	294.383	4.148	20	30		CIEDRN
C#CCCCCC(=O)N(Cc1ccc([C@@H]2C[C@@H]2C)o1)C1CC1	ZINC000119590336	263276226	/nfs/dbraw/zinc/27/62/26/263276226.db2.gz	ALWQUHRQSNQTQD-WMLDXEAASA-N	0	0	299.414	4.088	20	30		CIEDRN
C[C@H]1CC[C@@H](CC(=O)Nc2ccc(C(C)(C)C#N)cc2)C1	ZINC000119856562	263280335	/nfs/dbraw/zinc/28/03/35/263280335.db2.gz	RXUGVATYLYFIDH-UONOGXRCSA-N	0	0	284.403	4.253	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1cc(-c2nc(C)co2)ccc1C	ZINC000121246544	263290853	/nfs/dbraw/zinc/29/08/53/263290853.db2.gz	YIUQMHRKNAKJJR-LBPRGKRZSA-N	0	0	299.374	4.045	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@H]1c1ccc(OC)cc1	ZINC000121562141	263295376	/nfs/dbraw/zinc/29/53/76/263295376.db2.gz	RPJZBARFNNAKNT-SFHVURJKSA-N	0	0	299.414	4.127	20	30		CIEDRN
C=CCCC[C@@H](C)N(C)Cc1nc([C@@H](C)SCC)no1	ZINC000340877348	263311060	/nfs/dbraw/zinc/31/10/60/263311060.db2.gz	AYVCTUNNNVLXOL-CHWSQXEVSA-N	0	0	297.468	4.060	20	30		CIEDRN
CC(C)(CCC#N)CNc1nccc2ccc(F)cc21	ZINC000340892401	263311864	/nfs/dbraw/zinc/31/18/64/263311864.db2.gz	IHCPLOQGGOKAFP-UHFFFAOYSA-N	0	0	271.339	4.116	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N[C@@H](CC)c1cc(F)ccc1F	ZINC000341455143	263336779	/nfs/dbraw/zinc/33/67/79/263336779.db2.gz	DKEMPKLHHGUAMZ-WFASDCNBSA-N	0	0	296.361	4.070	20	30		CIEDRN
N#CC1(CSCc2cccc(Cl)c2F)CC1	ZINC000342126263	263390372	/nfs/dbraw/zinc/39/03/72/263390372.db2.gz	ISJZQYHAJVZQFU-UHFFFAOYSA-N	0	0	255.745	4.016	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@H]1CCC(C)(C)c2ccccc21	ZINC000342502210	263443257	/nfs/dbraw/zinc/44/32/57/263443257.db2.gz	GLIFATRBAUSDIA-CJNGLKHVSA-N	0	0	286.419	4.063	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N[C@@H]1CCCc2sccc21	ZINC000342648585	263466667	/nfs/dbraw/zinc/46/66/67/263466667.db2.gz	FIUIVYSJLAXKOW-GXTWGEPZSA-N	0	0	292.448	4.170	20	30		CIEDRN
C=CCCOCCCCC(=O)N(c1ccccc1)C(C)C	ZINC000342866442	263535168	/nfs/dbraw/zinc/53/51/68/263535168.db2.gz	JGPSNLVLCNVDBE-UHFFFAOYSA-N	0	0	289.419	4.191	20	30		CIEDRN
CN(C(=O)CC(C)(C)C#N)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000416014440	263658861	/nfs/dbraw/zinc/65/88/61/263658861.db2.gz	SPGLPDWTBFRGEH-IAGOWNOFSA-N	0	0	298.430	4.111	20	30		CIEDRN
CC1(CC(=O)N[C@H]2CCCc3cc(C#N)ccc32)CCCC1	ZINC000416111813	263674757	/nfs/dbraw/zinc/67/47/57/263674757.db2.gz	VDOHICWRDFXCAW-KRWDZBQOSA-N	0	0	296.414	4.022	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H]1CC12CC2	ZINC000417042757	263777738	/nfs/dbraw/zinc/77/77/38/263777738.db2.gz	NVFWEFFCEYRGHH-OAHLLOKOSA-N	0	0	298.430	4.460	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1cc2cc(F)ccc2s1	ZINC000428049816	263804823	/nfs/dbraw/zinc/80/48/23/263804823.db2.gz	PPBMFHFDQNRLDQ-ZDUSSCGKSA-N	0	0	289.375	4.221	20	30		CIEDRN
C=CCOc1ccc(CNc2nccc3occc32)cc1	ZINC000343235537	263805400	/nfs/dbraw/zinc/80/54/00/263805400.db2.gz	POAZSOUQEKOWPU-UHFFFAOYSA-N	0	0	280.327	4.005	20	30		CIEDRN
C[C@@H](Nc1snc(Cl)c1C#N)c1ccccc1Cl	ZINC000048545198	263818448	/nfs/dbraw/zinc/81/84/48/263818448.db2.gz	FHBAUAWMUQZEDA-SSDOTTSWSA-N	0	0	298.198	4.495	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](c2ccc(CC)cc2)C1	ZINC000424846939	263827200	/nfs/dbraw/zinc/82/72/00/263827200.db2.gz	MVAFZQMHXUBLAI-QGZVFWFLSA-N	0	0	285.431	4.167	20	30		CIEDRN
C[C@@H]1CCC[C@@H]1NC(=O)CCc1ncc(C(C)(C)C)o1	ZINC000328661513	263835193	/nfs/dbraw/zinc/83/51/93/263835193.db2.gz	WSYXIECNCUSIML-NEPJUHHUSA-N	0	0	278.396	4.050	20	30		CIEDRN
Cc1ncc(NC(=O)[C@@H](C)c2cccs2)c(C2CC2)n1	ZINC000328751955	263854423	/nfs/dbraw/zinc/85/44/23/263854423.db2.gz	CPIYNXWJRFCQTD-VIFPVBQESA-N	0	0	287.388	4.116	20	30		CIEDRN
Cc1noc(C)c1CC(=O)N[C@@H]1CC[C@@H]2CCCC[C@H]2C1	ZINC000328921066	263902561	/nfs/dbraw/zinc/90/25/61/263902561.db2.gz	BLAVZMPPZIHJHG-SOUVJXGZSA-N	0	0	290.407	4.149	20	30		CIEDRN
Cc1cccc(C(=O)N[C@@](C)(C#N)CC(C)C)c1Cl	ZINC000330457881	263940866	/nfs/dbraw/zinc/94/08/66/263940866.db2.gz	OXUFQMCUJJITFL-OAHLLOKOSA-N	0	0	278.783	4.281	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N(C)[C@H](C)C1CCCCC1	ZINC000330444032	263953246	/nfs/dbraw/zinc/95/32/46/263953246.db2.gz	SKQYFNJKJNCGPJ-CQSZACIVSA-N	0	0	299.418	4.313	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cccc(-n2nc(C)cc2C)c1	ZINC000468113003	263960434	/nfs/dbraw/zinc/96/04/34/263960434.db2.gz	HTMCTCRDBWYITF-GOSISDBHSA-N	0	0	297.402	4.030	20	30		CIEDRN
Cc1oc(C(C)C)cc1C(=O)Nc1cc(C)ccn1	ZINC000330566775	263975396	/nfs/dbraw/zinc/97/53/96/263975396.db2.gz	GTQSKRCVWLCCOC-UHFFFAOYSA-N	0	0	258.321	4.051	20	30		CIEDRN
CCc1noc(C)c1C(=O)N[C@H](C)CCC(C)(C)C	ZINC000330835966	264051435	/nfs/dbraw/zinc/05/14/35/264051435.db2.gz	RGERBKJYRRWFCV-SNVBAGLBSA-N	0	0	266.385	4.065	20	30		CIEDRN
CCC1(CNC(=O)N[C@H](C)c2cccnc2)CCCCC1	ZINC000330873249	264059020	/nfs/dbraw/zinc/05/90/20/264059020.db2.gz	HPSJQAZEJBFPSP-CQSZACIVSA-N	0	0	289.423	4.007	20	30		CIEDRN
CC1(CC(=O)Nc2ccccc2CC#N)CCCCC1	ZINC000330846092	264066745	/nfs/dbraw/zinc/06/67/45/264066745.db2.gz	NXXWCJDOKCOLPY-UHFFFAOYSA-N	0	0	270.376	4.052	20	30		CIEDRN
CCc1[nH]nc(NC(=O)c2ccc(C(C)C)s2)c1C	ZINC000330890552	264076045	/nfs/dbraw/zinc/07/60/45/264076045.db2.gz	CCYFVGYUNWCJND-UHFFFAOYSA-N	0	0	277.393	4.102	20	30		CIEDRN
Cc1nc([C@H](C)NC(=O)NC(C)(C)CC(C)(C)C)cs1	ZINC000330975043	264100968	/nfs/dbraw/zinc/10/09/68/264100968.db2.gz	JIYLKBROGUYGSA-JTQLQIEISA-N	0	0	297.468	4.231	20	30		CIEDRN
C[C@@H]1CC[C@H](NC(=O)C[C@@H](CC#N)c2ccccc2)[C@H](C)C1	ZINC000331066854	264112316	/nfs/dbraw/zinc/11/23/16/264112316.db2.gz	QICKXHQZORYKBQ-AHCXZYCDSA-N	0	0	298.430	4.015	20	30		CIEDRN
CC1(C)CCC(NC(=O)C[C@H](CC#N)c2ccccc2)CC1	ZINC000331074641	264114318	/nfs/dbraw/zinc/11/43/18/264114318.db2.gz	UVZINNNAEIQJLO-INIZCTEOSA-N	0	0	298.430	4.159	20	30		CIEDRN
C=CCC(CC=C)C(=O)N([C@@H](C)c1ccco1)C1CC1	ZINC000126091639	264122932	/nfs/dbraw/zinc/12/29/32/264122932.db2.gz	DECNJKPXQRORRJ-ZDUSSCGKSA-N	0	0	273.376	4.100	20	30		CIEDRN
CC(C)c1ccc([C@H](C)CC(=O)N[C@@H]2CCC[C@@H]2C#N)cc1	ZINC000331115110	264128717	/nfs/dbraw/zinc/12/87/17/264128717.db2.gz	VBHLATDFSHNMIA-ZTFGCOKTSA-N	0	0	298.430	4.112	20	30		CIEDRN
Cc1nc([C@@H](C)NC(=O)c2ccoc2C(C)C)cs1	ZINC000331089817	264133180	/nfs/dbraw/zinc/13/31/80/264133180.db2.gz	URCCCAMQZLFHMA-SECBINFHSA-N	0	0	278.377	4.234	20	30		CIEDRN
Cc1cc(NC(=O)c2ccoc2C(C)C)nc(C(C)C)n1	ZINC000331156574	264140747	/nfs/dbraw/zinc/14/07/47/264140747.db2.gz	JMITXEZHDNSRRX-UHFFFAOYSA-N	0	0	287.363	4.261	20	30		CIEDRN
CCc1occc1C(=O)N[C@@H](C)c1cc(C)oc1C	ZINC000331161213	264143419	/nfs/dbraw/zinc/14/34/19/264143419.db2.gz	GAIUUCNQWFLMKR-JTQLQIEISA-N	0	0	261.321	4.118	20	30		CIEDRN
Cc1cc[nH]c1C(=O)N[C@H](C)c1nc(C(C)(C)C)cs1	ZINC000331218588	264165181	/nfs/dbraw/zinc/16/51/81/264165181.db2.gz	HOXFBUIOLZHWOE-SNVBAGLBSA-N	0	0	291.420	4.143	20	30		CIEDRN
Cc1cc(C)nc(NC(=O)c2csc(C(C)(C)C)n2)c1	ZINC000331221106	264166863	/nfs/dbraw/zinc/16/68/63/264166863.db2.gz	AOJMLEWPSOYOHB-UHFFFAOYSA-N	0	0	289.404	4.089	20	30		CIEDRN
CCCC[C@@H]1CCC[C@H]1NC(=O)c1cc(C#N)oc1C	ZINC000331223128	264167479	/nfs/dbraw/zinc/16/74/79/264167479.db2.gz	LGEKSUZBCTYXEL-IUODEOHRSA-N	0	0	274.364	4.123	20	30		CIEDRN
Cc1oc(C#N)cc1C(=O)NCC[C@@H](C)CC(C)(C)C	ZINC000331241837	264176796	/nfs/dbraw/zinc/17/67/96/264176796.db2.gz	OYVHVCQTVNKRPQ-LLVKDONJSA-N	0	0	276.380	4.227	20	30		CIEDRN
Cc1cc[nH]c1C(=O)N[C@@H]1CCCC[C@H]1OCCC(C)C	ZINC000331254307	264182749	/nfs/dbraw/zinc/18/27/49/264182749.db2.gz	SVJHGKSMGUSFLH-HUUCEWRRSA-N	0	0	292.423	4.002	20	30		CIEDRN
Cc1cc(C(=O)Nc2cccc(C(C)(C)C)c2O)co1	ZINC000331312377	264187366	/nfs/dbraw/zinc/18/73/66/264187366.db2.gz	ZWSZJFGERXHSNL-UHFFFAOYSA-N	0	0	273.332	4.227	20	30		CIEDRN
CC(C)c1ncc(CN(C)[C@H](C)c2cccc(C#N)c2)s1	ZINC000425367284	264212032	/nfs/dbraw/zinc/21/20/32/264212032.db2.gz	SELBBMYASZJLLA-CYBMUJFWSA-N	0	0	299.443	4.331	20	30		CIEDRN
C[C@H](c1cccc(C#N)c1)N(C)Cc1sccc1Cl	ZINC000425367573	264212044	/nfs/dbraw/zinc/21/20/44/264212044.db2.gz	UFGCNXYEMKTUQS-LLVKDONJSA-N	0	0	290.819	4.466	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N1C[C@@H](c2ccc(C)cc2)C[C@H]1C	ZINC000424857418	264233990	/nfs/dbraw/zinc/23/39/90/264233990.db2.gz	RHLVPVXFFPOTPY-WBVHZDCISA-N	0	0	285.431	4.302	20	30		CIEDRN
C[C@H]1CCCC[C@@H]1C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000424857298	264234149	/nfs/dbraw/zinc/23/41/49/264234149.db2.gz	WSNRWBPAQHCJAP-AAEUAGOBSA-N	0	0	290.794	4.171	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1cc(C)n(C(C)C)c1C	ZINC000343259615	264237176	/nfs/dbraw/zinc/23/71/76/264237176.db2.gz	NSLAJZIKLMALNH-ZDUSSCGKSA-N	0	0	276.424	4.160	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(C3CCC3)cc2)CCOCC1	ZINC000424861219	264246046	/nfs/dbraw/zinc/24/60/46/264246046.db2.gz	WTZDVTBKJKWFGF-UHFFFAOYSA-N	0	0	299.414	4.266	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1ccsc1Cl	ZINC000189431658	264297736	/nfs/dbraw/zinc/29/77/36/264297736.db2.gz	WDRGZWYGDIIJLX-VIFPVBQESA-N	0	0	272.801	4.268	20	30		CIEDRN
C=CCCSc1nnc(-c2ccc(C)cc2C)o1	ZINC000128821016	264307825	/nfs/dbraw/zinc/30/78/25/264307825.db2.gz	GFRCIFLLRFVQIM-UHFFFAOYSA-N	0	0	260.362	4.022	20	30		CIEDRN
COc1cccc(S[C@H](C)c2cccc(C#N)c2)c1	ZINC000189831115	264328072	/nfs/dbraw/zinc/32/80/72/264328072.db2.gz	DQDOBZQVSCZVJJ-GFCCVEGCSA-N	0	0	269.369	4.420	20	30		CIEDRN
C=C(CC)CNC(=O)CCCCCO[C@@H]1CCC[C@@H](C)C1	ZINC000456810712	264342675	/nfs/dbraw/zinc/34/26/75/264342675.db2.gz	GMGLAEDPFAYNGY-IAGOWNOFSA-N	0	0	295.467	4.225	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N(C)[C@H](C)c1cccc(C#N)c1	ZINC000425488656	264354485	/nfs/dbraw/zinc/35/44/85/264354485.db2.gz	NDUXTOGHCIYVNW-LSDHHAIUSA-N	0	0	299.418	4.005	20	30		CIEDRN
C=CCC[C@H](NCc1cc(C)cc(Cl)n1)c1ccco1	ZINC000287725826	264635237	/nfs/dbraw/zinc/63/52/37/264635237.db2.gz	YFIDGYCNKATGJX-AWEZNQCLSA-N	0	0	290.794	4.434	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](C)c1ncc(-c2ccccc2)o1	ZINC000184126768	264702106	/nfs/dbraw/zinc/70/21/06/264702106.db2.gz	HVTTZVJFDCPXBQ-KBPBESRZSA-N	0	0	298.386	4.121	20	30		CIEDRN
C=C1CCN(C(=O)c2cc3cc(C)ccc3s2)CC1	ZINC000290342767	264779758	/nfs/dbraw/zinc/77/97/58/264779758.db2.gz	XRGRRPWNPKMNTP-UHFFFAOYSA-N	0	0	271.385	4.002	20	30		CIEDRN
C#Cc1ccccc1CC(=O)Nc1c(C)cccc1C(C)C	ZINC000291116721	264826887	/nfs/dbraw/zinc/82/68/87/264826887.db2.gz	UGWVSPPKSADDTE-UHFFFAOYSA-N	0	0	291.394	4.281	20	30		CIEDRN
C=CCC(C)(C)C(=O)OCc1cnc(-c2cccs2)o1	ZINC000292314081	264860603	/nfs/dbraw/zinc/86/06/03/264860603.db2.gz	VTJYQNFZOXKYGN-UHFFFAOYSA-N	0	0	291.372	4.049	20	30		CIEDRN
C=C(C)CNC(=O)c1cc(C)ccc1SC1CCCC1	ZINC000428112005	264883989	/nfs/dbraw/zinc/88/39/89/264883989.db2.gz	VVAMGXSNMADTIL-UHFFFAOYSA-N	0	0	289.444	4.336	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H]1c1ccccc1C	ZINC000185231209	265011553	/nfs/dbraw/zinc/01/15/53/265011553.db2.gz	MHMWHKUIYNZMOK-RDJZCZTQSA-N	0	0	271.404	4.261	20	30		CIEDRN
N#Cc1cc(N[C@@H]2CCc3ccccc3C2)nc2ccccc12	ZINC000320700580	265021038	/nfs/dbraw/zinc/02/10/38/265021038.db2.gz	POTIJTIMWCYXOL-QGZVFWFLSA-N	0	0	299.377	4.076	20	30		CIEDRN
CC(C)Oc1cccc(CSCC2(C#N)CC2)c1	ZINC000344481301	265060584	/nfs/dbraw/zinc/06/05/84/265060584.db2.gz	HMTNWPISBSYYFA-UHFFFAOYSA-N	0	0	261.390	4.011	20	30		CIEDRN
N#Cc1csc(CN[C@H](c2ccco2)c2ccccc2)c1	ZINC000093492201	265182258	/nfs/dbraw/zinc/18/22/58/265182258.db2.gz	TWRAKAGMRLGNFQ-KRWDZBQOSA-N	0	0	294.379	4.092	20	30		CIEDRN
N#Cc1csc(CNc2ccc(F)c(Cl)c2)c1	ZINC000093685560	265188143	/nfs/dbraw/zinc/18/81/43/265188143.db2.gz	PUAADUZOFWLWQX-UHFFFAOYSA-N	0	0	266.728	4.024	20	30		CIEDRN
CC(C)COc1ccccc1NCc1cc(C#N)cs1	ZINC000093687378	265188160	/nfs/dbraw/zinc/18/81/60/265188160.db2.gz	MLADHGHGCOIMTH-UHFFFAOYSA-N	0	0	286.400	4.267	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)c1sccc1C1CC1	ZINC000335803489	265210607	/nfs/dbraw/zinc/21/06/07/265210607.db2.gz	IBZHJVXVOJFWAS-UHFFFAOYSA-N	0	0	282.368	4.058	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)C1(CC(C)C)CCCC1	ZINC000094817123	265255142	/nfs/dbraw/zinc/25/51/42/265255142.db2.gz	SMXKOTBKZOVTHZ-UHFFFAOYSA-N	0	0	284.403	4.412	20	30		CIEDRN
C[C@H]1CC[C@@H](C(=O)Nc2nc(C3CCOCC3)cs2)C1	ZINC000329211252	533686600	/nfs/dbraw/zinc/68/66/00/533686600.db2.gz	GXPHGEPXBDRNRE-CMPLNLGQSA-N	0	0	294.420	4.061	20	30		CIEDRN
C=CCC[C@H](Nc1cccc(OC)c1)c1ccco1	ZINC000520439281	265822119	/nfs/dbraw/zinc/82/21/19/265822119.db2.gz	FEVXPRUEGXYPRP-HNNXBMFYSA-N	0	0	257.333	4.408	20	30		CIEDRN
CCC(CC)CN(CCC#N)C(=O)C[C@@H](C)CC(C)C	ZINC000520524480	265847620	/nfs/dbraw/zinc/84/76/20/265847620.db2.gz	PIUDARYUAFHRMK-HNNXBMFYSA-N	0	0	280.456	4.237	20	30		CIEDRN
CC1(C)CCCN(C(=O)C[C@@H](CC#N)c2ccccc2)CC1	ZINC000356210242	266072906	/nfs/dbraw/zinc/07/29/06/266072906.db2.gz	UGGGGFIKBJYFOT-QGZVFWFLSA-N	0	0	298.430	4.113	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCSC1	ZINC000356221446	266074556	/nfs/dbraw/zinc/07/45/56/266074556.db2.gz	QWKAHXNUGYEDRO-CQSZACIVSA-N	0	0	289.444	4.230	20	30		CIEDRN
CC[C@@H]1CCCC[C@H]1C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000356490878	266124063	/nfs/dbraw/zinc/12/40/63/266124063.db2.gz	QVMOCFJYFWCTTN-KBAYOESNSA-N	0	0	298.430	4.364	20	30		CIEDRN
CC[C@@H]1CCCC[C@@H]1C(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000356490879	266124131	/nfs/dbraw/zinc/12/41/31/266124131.db2.gz	QVMOCFJYFWCTTN-NJAFHUGGSA-N	0	0	298.430	4.364	20	30		CIEDRN
Cc1cscc1NC(=O)C[C@H](CC#N)c1ccccc1	ZINC000356523890	266130356	/nfs/dbraw/zinc/13/03/56/266130356.db2.gz	WPXRALZBBUYZMV-AWEZNQCLSA-N	0	0	284.384	4.083	20	30		CIEDRN
C[C@@H](NC(=O)CC#N)c1ccccc1-c1ccc(Cl)cc1	ZINC000356818557	266179807	/nfs/dbraw/zinc/17/98/07/266179807.db2.gz	GUGKDNMGAWKYTC-GFCCVEGCSA-N	0	0	298.773	4.098	20	30		CIEDRN
C[C@@H]1CC[C@H](NC(=O)C[C@@H](CC#N)c2ccccc2)C[C@H]1C	ZINC000356817077	266179832	/nfs/dbraw/zinc/17/98/32/266179832.db2.gz	RCPXRAPGYPYTPP-AHCXZYCDSA-N	0	0	298.430	4.015	20	30		CIEDRN
CCOc1cc(C#N)ccc1OCc1cc(C)sc1C	ZINC000357387062	266288477	/nfs/dbraw/zinc/28/84/77/266288477.db2.gz	DXPRMFMTBYATMA-UHFFFAOYSA-N	0	0	287.384	4.214	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H]2CCCc3ccc(F)cc32)CCC1	ZINC000357481973	266305924	/nfs/dbraw/zinc/30/59/24/266305924.db2.gz	SIRSUEDVAZOEAC-MRXNPFEDSA-N	0	0	287.378	4.066	20	30		CIEDRN
Cc1ccc([C@@H]2CCCN2c2snc(C)c2C#N)s1	ZINC000367264181	266306874	/nfs/dbraw/zinc/30/68/74/266306874.db2.gz	KTSHTZPONOXXOV-LBPRGKRZSA-N	0	0	289.429	4.035	20	30		CIEDRN
C=CCN(C(=O)c1cn(CC(C)C)c2ccccc12)C1CC1	ZINC000357493206	266308796	/nfs/dbraw/zinc/30/87/96/266308796.db2.gz	NHZQNGFBBCKWGR-UHFFFAOYSA-N	0	0	296.414	4.088	20	30		CIEDRN
CC(C)[C@@H]1C[C@H](Nc2cccnc2C#N)c2ccccc21	ZINC000357662555	266342310	/nfs/dbraw/zinc/34/23/10/266342310.db2.gz	PFTXRLRBMLCDFM-RDJZCZTQSA-N	0	0	277.371	4.250	20	30		CIEDRN
Cc1cc(C)c(C#N)c(NCc2ccc(C3CC3)cc2)n1	ZINC000357763894	266357067	/nfs/dbraw/zinc/35/70/67/266357067.db2.gz	ZQEZBQWFOPJUSM-UHFFFAOYSA-N	0	0	277.371	4.060	20	30		CIEDRN
CC[C@H](C)n1ncc(N[C@H](C)c2cccc(C#N)c2)c1C	ZINC000357842120	266375562	/nfs/dbraw/zinc/37/55/62/266375562.db2.gz	AMAINEFIEVJHBC-QWHCGFSZSA-N	0	0	282.391	4.207	20	30		CIEDRN
C=CCc1ccc(OCc2ccc(C)nc2C)c(OC)c1	ZINC000358698782	266487147	/nfs/dbraw/zinc/48/71/47/266487147.db2.gz	XBHGBRRNRYGSRI-UHFFFAOYSA-N	0	0	283.371	4.015	20	30		CIEDRN
Cc1oc(-c2ccsc2)nc1CSCCCC#N	ZINC000359024441	266524587	/nfs/dbraw/zinc/52/45/87/266524587.db2.gz	DZNFPAQVIDONPV-UHFFFAOYSA-N	0	0	278.402	4.249	20	30		CIEDRN
N#CC1(CSCc2cccc(C(F)F)c2)CC1	ZINC000359112404	266536429	/nfs/dbraw/zinc/53/64/29/266536429.db2.gz	CGCKXCDLUJUMDX-UHFFFAOYSA-N	0	0	253.317	4.161	20	30		CIEDRN
CC[C@@H](c1ccccc1)N(CC(C)C)C(=O)CCCC#N	ZINC000361777836	266882821	/nfs/dbraw/zinc/88/28/21/266882821.db2.gz	YDSZXKGIPFPBLO-KRWDZBQOSA-N	0	0	286.419	4.316	20	30		CIEDRN
C=CCSc1ccccc1C(=O)Nc1ccsc1	ZINC000362760272	267043219	/nfs/dbraw/zinc/04/32/19/267043219.db2.gz	QBJUZJOWJSUUIS-UHFFFAOYSA-N	0	0	275.398	4.279	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N1C[C@@H](C)CC[C@@H]1C	ZINC000362819929	267051178	/nfs/dbraw/zinc/05/11/78/267051178.db2.gz	ISGQCSUMQUDUAR-KBPBESRZSA-N	0	0	289.444	4.225	20	30		CIEDRN
CCCCCCCC(=O)N1CCC([C@@H]2CCCOC2)CC1	ZINC000367856345	267122320	/nfs/dbraw/zinc/12/23/20/267122320.db2.gz	UEKZJOPXCGGNSW-QGZVFWFLSA-N	0	0	295.467	4.012	20	30		CIEDRN
CC(=O)Nc1ccc(S[C@@H](C)c2ccc(C#N)cc2)cc1	ZINC000118172748	267240520	/nfs/dbraw/zinc/24/05/20/267240520.db2.gz	TZRRXZYOXATJMJ-LBPRGKRZSA-N	0	0	296.395	4.370	20	30		CIEDRN
CCCCCCCC(=O)N1CCC[C@H]1c1cccc(C)n1	ZINC000119105752	267301718	/nfs/dbraw/zinc/30/17/18/267301718.db2.gz	VVOSIYZVYIUGOH-KRWDZBQOSA-N	0	0	288.435	4.414	20	30		CIEDRN
Cc1c(F)cccc1-c1ccc(CNCC2(C#N)CCC2)o1	ZINC000418145744	267366180	/nfs/dbraw/zinc/36/61/80/267366180.db2.gz	YUSUDKYMFUHUQW-UHFFFAOYSA-N	0	0	298.361	4.178	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cccc(C(C)(C)C)c1O	ZINC000443206613	267422239	/nfs/dbraw/zinc/42/22/39/267422239.db2.gz	BOSUFNOILZWXPO-KRWDZBQOSA-N	0	0	275.392	4.231	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@H]1/C=C/c1cccs1	ZINC000375119002	267831611	/nfs/dbraw/zinc/83/16/11/267831611.db2.gz	BHIBRPRMLZTONH-PQAPVRDISA-N	0	0	289.444	4.355	20	30		CIEDRN
CCCCCCCCC(=O)N1CCCC[C@H](COC)C1	ZINC000375143334	267833882	/nfs/dbraw/zinc/83/38/82/267833882.db2.gz	QJINLRSXIYVMJY-INIZCTEOSA-N	0	0	283.456	4.012	20	30		CIEDRN
C=CCC[C@H](CC)Nc1ccc(F)cc1-c1nnc(C)o1	ZINC000376134676	267942805	/nfs/dbraw/zinc/94/28/05/267942805.db2.gz	RHBZKESZVWKXAK-ZDUSSCGKSA-N	0	0	289.354	4.341	20	30		CIEDRN
N#CCCC1CCN(C(=O)c2csc3ccccc23)CC1	ZINC000335384073	335092109	/nfs/dbraw/zinc/09/21/09/335092109.db2.gz	BHBPEMPQLBSGIM-UHFFFAOYSA-N	0	0	298.411	4.057	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC(F)(F)F)c1ccccc1	ZINC000160475311	327613824	/nfs/dbraw/zinc/61/38/24/327613824.db2.gz	SWSIWZPYZADORI-UHFFFAOYSA-N	0	0	297.320	4.350	20	30		CIEDRN
C[C@@H](CC(=O)NCC(C)(C)CCC#N)C1CCCCC1	ZINC000570876226	327629799	/nfs/dbraw/zinc/62/97/99/327629799.db2.gz	UBGRZZTUVNIAPY-AWEZNQCLSA-N	0	0	278.440	4.039	20	30		CIEDRN
COc1cccc(F)c1[C@H](C)N[C@H](C)c1ccc(C#N)cc1	ZINC000174222622	327639713	/nfs/dbraw/zinc/63/97/13/327639713.db2.gz	OAKOLMGUWNKJJF-OLZOCXBDSA-N	0	0	298.361	4.118	20	30		CIEDRN
COc1ccc(F)cc1[C@H](C)Nc1ccc(C#N)cc1F	ZINC000170639728	327647510	/nfs/dbraw/zinc/64/75/10/327647510.db2.gz	BMCQTOZBVULULK-JTQLQIEISA-N	0	0	288.297	4.018	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)C[C@H]1CCCC[C@@H]1C	ZINC000527061172	328823201	/nfs/dbraw/zinc/82/32/01/328823201.db2.gz	ZHVZZGKDBVQDIO-LSDHHAIUSA-N	0	0	278.440	4.134	20	30		CIEDRN
Cc1scc(C(=O)Nc2ccc(C#N)cc2Cl)c1C	ZINC000334193226	327655798	/nfs/dbraw/zinc/65/57/98/327655798.db2.gz	IIUSEWPQDVSORW-UHFFFAOYSA-N	0	0	290.775	4.142	20	30		CIEDRN
CC1(C)CCC[C@@H](c2noc(-c3cccc(CC#N)c3)n2)C1	ZINC000533908413	327661194	/nfs/dbraw/zinc/66/11/94/327661194.db2.gz	FFUXFYDUJIAGAD-OAHLLOKOSA-N	0	0	295.386	4.486	20	30		CIEDRN
N#Cc1cccc(Sc2nc3ccccc3s2)c1	ZINC000229736903	327664318	/nfs/dbraw/zinc/66/43/18/327664318.db2.gz	KDRYRXXZEOHMAW-UHFFFAOYSA-N	0	0	268.366	4.319	20	30		CIEDRN
C[C@@H](SCCCCC#N)c1nc(-c2ccccc2)no1	ZINC000161956878	327687978	/nfs/dbraw/zinc/68/79/78/327687978.db2.gz	SCGLEGHSXOWVBU-GFCCVEGCSA-N	0	0	287.388	4.225	20	30		CIEDRN
CC(C)=CCC[C@H](C)CC(=O)N(C)Cc1cccc(C#N)c1	ZINC000580075838	327692646	/nfs/dbraw/zinc/69/26/46/327692646.db2.gz	BQEXKWGIDSYODY-INIZCTEOSA-N	0	0	298.430	4.289	20	30		CIEDRN
CC(C)=CCC[C@@H](C)CC(=O)N(C)Cc1cccc(C#N)c1	ZINC000580075839	327692714	/nfs/dbraw/zinc/69/27/14/327692714.db2.gz	BQEXKWGIDSYODY-MRXNPFEDSA-N	0	0	298.430	4.289	20	30		CIEDRN
Cc1ccc(C)c(NC(=O)Nc2ccc(CC#N)cc2)c1	ZINC000186536429	327695332	/nfs/dbraw/zinc/69/53/32/327695332.db2.gz	XWOFODBHBDHLDR-UHFFFAOYSA-N	0	0	279.343	4.014	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@@H]1CC12CCCCC2)c1ccccc1	ZINC000536533469	327709554	/nfs/dbraw/zinc/70/95/54/327709554.db2.gz	GENNLLNXNVMJSO-NVXWUHKLSA-N	0	0	283.415	4.185	20	30		CIEDRN
C=CCC[C@@H](C(=O)Nc1cccc(O)c1F)c1ccccc1	ZINC000187398228	327714432	/nfs/dbraw/zinc/71/44/32/327714432.db2.gz	BDHHGSMUIHTDLM-CQSZACIVSA-N	0	0	299.345	4.220	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCc1cc(C)cc2c(C)c(C)[nH]c21	ZINC000466417979	327737479	/nfs/dbraw/zinc/73/74/79/327737479.db2.gz	UJUAQNAAPPDTBF-CYBMUJFWSA-N	0	0	298.430	4.312	20	30		CIEDRN
CCC(CC)(CC)NC(=O)Nc1scc(C)c1C#N	ZINC000580272624	327754271	/nfs/dbraw/zinc/75/42/71/327754271.db2.gz	WEXSVKPHCYKWPX-UHFFFAOYSA-N	0	0	279.409	4.019	20	30		CIEDRN
C=CCC[C@@H](C(=O)Nc1cnn(C(C)C)c1)c1ccccc1	ZINC000580271039	327753637	/nfs/dbraw/zinc/75/36/37/327753637.db2.gz	KWBNSVLBWNAJRO-QGZVFWFLSA-N	0	0	297.402	4.153	20	30		CIEDRN
CC(C)CCc1ccccc1NC(=O)N[C@@H]1CC[C@H](C#N)C1	ZINC000563031201	327778805	/nfs/dbraw/zinc/77/88/05/327778805.db2.gz	JLFMHYGQOJSWRB-GOEBONIOSA-N	0	0	299.418	4.089	20	30		CIEDRN
C[C@@H]1CCC[C@@H](OCc2cccc(NCCC#N)c2)C1	ZINC000565300772	327785830	/nfs/dbraw/zinc/78/58/30/327785830.db2.gz	VPJRUNIORGYKHZ-RHSMWYFYSA-N	0	0	272.392	4.107	20	30		CIEDRN
CC(C)c1ccc(NC(=O)c2c[nH]c(C#N)c2)c(C(C)C)c1	ZINC000180377941	327805465	/nfs/dbraw/zinc/80/54/65/327805465.db2.gz	AWNVZHMBMFTNCM-UHFFFAOYSA-N	0	0	295.386	4.385	20	30		CIEDRN
CSCCc1ccc(N[C@@H]2CCC[C@H](C#N)C2)cc1	ZINC000185745546	327843972	/nfs/dbraw/zinc/84/39/72/327843972.db2.gz	HJMWYSHKKIDPBN-GOEBONIOSA-N	0	0	274.433	4.086	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1ccc(C)c(O)c1C)c1ccccc1	ZINC000186508165	327917004	/nfs/dbraw/zinc/91/70/04/327917004.db2.gz	MVJREUCCJIOHAC-INIZCTEOSA-N	0	0	295.382	4.307	20	30		CIEDRN
CCC[C@H](C)CC(=O)N(Cc1ccc(C#N)cc1)C(C)C	ZINC000522763303	327921378	/nfs/dbraw/zinc/92/13/78/327921378.db2.gz	UPWQQTORQDQILB-HNNXBMFYSA-N	0	0	286.419	4.122	20	30		CIEDRN
C=C[C@H](CC(=O)NCCCC(C)(C)C)c1ccccc1	ZINC000533949883	327943844	/nfs/dbraw/zinc/94/38/44/327943844.db2.gz	WREKWFSXIYNRIS-OAHLLOKOSA-N	0	0	273.420	4.289	20	30		CIEDRN
CCc1cccc(C)c1NC(=O)N1CCC(CCC#N)CC1	ZINC000571043862	327982318	/nfs/dbraw/zinc/98/23/18/327982318.db2.gz	VHEVRQKWQDZUEU-UHFFFAOYSA-N	0	0	299.418	4.105	20	30		CIEDRN
Cc1cn(Cc2ncc(-c3ccc(Cl)cc3)o2)cc1C#N	ZINC000531578014	328015925	/nfs/dbraw/zinc/01/59/25/328015925.db2.gz	OGMZTRXHXFUQAM-UHFFFAOYSA-N	0	0	297.745	4.025	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCCC[C@H]1[C@H](C)CC	ZINC000531559887	328017769	/nfs/dbraw/zinc/01/77/69/328017769.db2.gz	PAAPNZKUUARKTC-ZBFHGGJFSA-N	0	0	263.425	4.182	20	30		CIEDRN
CN(C(=O)CC1CCC(C(C)(C)C)CC1)C1(C#N)CCC1	ZINC000531697888	328025517	/nfs/dbraw/zinc/02/55/17/328025517.db2.gz	QGMLJSXPCRLWAH-UHFFFAOYSA-N	0	0	290.451	4.134	20	30		CIEDRN
CC(C)(C#N)c1ccccc1CSC[C@@H]1CCCCO1	ZINC000531749714	328030017	/nfs/dbraw/zinc/03/00/17/328030017.db2.gz	JTRHHSZXTIJBQG-HNNXBMFYSA-N	0	0	289.444	4.290	20	30		CIEDRN
C=CCCS[C@@H](C)c1nc(-c2ccc(OC)cc2)no1	ZINC000531759657	328030812	/nfs/dbraw/zinc/03/08/12/328030812.db2.gz	VYRJNUAVTKCOIG-NSHDSACASA-N	0	0	290.388	4.116	20	30		CIEDRN
C=C[C@H](CC(=O)N(CCC)C(C)(C)C)c1ccccc1	ZINC000534053229	328034098	/nfs/dbraw/zinc/03/40/98/328034098.db2.gz	MLSZLJQOGQVCHL-OAHLLOKOSA-N	0	0	273.420	4.383	20	30		CIEDRN
C=CCCc1csc(COc2ccc(C)cc2)n1	ZINC000534143473	328036720	/nfs/dbraw/zinc/03/67/20/328036720.db2.gz	FSQATHDRUZXXIW-UHFFFAOYSA-N	0	0	259.374	4.149	20	30		CIEDRN
CC(C)[C@@H]1CCc2ccccc2N1CCCSCC#N	ZINC000534218700	328039772	/nfs/dbraw/zinc/03/97/72/328039772.db2.gz	RQGNFXCCKZOCJT-INIZCTEOSA-N	0	0	288.460	4.111	20	30		CIEDRN
CC[N@H+](Cc1ccc(C)cc1)Cc1ccc(F)c(C#N)c1	ZINC000531833571	328041159	/nfs/dbraw/zinc/04/11/59/328041159.db2.gz	VEEPSKXCMGTHPT-UHFFFAOYSA-N	0	0	282.362	4.028	20	30		CIEDRN
Cc1cccc([C@@H]2CCCN2c2cccc(F)c2C#N)c1	ZINC000110195938	328042249	/nfs/dbraw/zinc/04/22/49/328042249.db2.gz	BDKSHTXBSARKKO-KRWDZBQOSA-N	0	0	280.346	4.347	20	30		CIEDRN
N#Cc1c(F)cccc1OCc1cc2ccccc2o1	ZINC000534384000	328050218	/nfs/dbraw/zinc/05/02/18/328050218.db2.gz	KCGBBEHAOHQFFS-UHFFFAOYSA-N	0	0	267.259	4.023	20	30		CIEDRN
C=C(C)[C@H](CC(=O)N(C)c1cccc(C(C)C)c1)OCC	ZINC000534389295	328050354	/nfs/dbraw/zinc/05/03/54/328050354.db2.gz	WYOLWEDQWJATPP-KRWDZBQOSA-N	0	0	289.419	4.144	20	30		CIEDRN
CCSc1ccccc1OCc1ccccc1C#N	ZINC000534387488	328050392	/nfs/dbraw/zinc/05/03/92/328050392.db2.gz	UWUJLTJDDDYNGF-UHFFFAOYSA-N	0	0	269.369	4.249	20	30		CIEDRN
C=CCCCN(C)C(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1	ZINC000534396143	328050882	/nfs/dbraw/zinc/05/08/82/328050882.db2.gz	ITLBGGLWTIQACI-ARFHVFGLSA-N	0	0	263.425	4.018	20	30		CIEDRN
C[C@H](NC(=O)C[C@@H]1CCCC(C)(C)C1)c1ccc(C#N)cc1	ZINC000534399986	328051249	/nfs/dbraw/zinc/05/12/49/328051249.db2.gz	DYDYCWVFWKIOBI-HOCLYGCPSA-N	0	0	298.430	4.342	20	30		CIEDRN
CN(Cc1ccc(C#N)cc1)C(=O)C[C@@H]1CCCC(C)(C)C1	ZINC000534401247	328051269	/nfs/dbraw/zinc/05/12/69/328051269.db2.gz	MOAIHMDZWYZMMS-KRWDZBQOSA-N	0	0	298.430	4.123	20	30		CIEDRN
C=CC1CCN(C(=O)[C@@H]2CC[C@@H]3CCCC[C@H]3C2)CC1	ZINC000534420674	328052480	/nfs/dbraw/zinc/05/24/80/328052480.db2.gz	FNHHUXTWKOATMK-YESZJQIVSA-N	0	0	275.436	4.018	20	30		CIEDRN
N#Cc1c(NCC2CCC(C#N)CC2)cccc1C(F)F	ZINC000563424810	328065751	/nfs/dbraw/zinc/06/57/51/328065751.db2.gz	DQSBYBQRWRAYTA-UHFFFAOYSA-N	0	0	289.329	4.238	20	30		CIEDRN
C[C@H](Oc1ccccc1N[C@@H]1CC[C@H](C#N)C1)C(F)(F)F	ZINC000563482386	328069614	/nfs/dbraw/zinc/06/96/14/328069614.db2.gz	KWFRWHIWAIFQPX-SDDRHHMPSA-N	0	0	298.308	4.120	20	30		CIEDRN
C=CCCCCS[C@H](C)C(=O)Nc1ccccc1C	ZINC000563622260	328077905	/nfs/dbraw/zinc/07/79/05/328077905.db2.gz	RQYVTBPWXCAAIJ-CQSZACIVSA-N	0	0	277.433	4.412	20	30		CIEDRN
CCN(C(=O)c1ccc(Cl)cc1C)c1ccc(C#N)cc1	ZINC000152189492	328079012	/nfs/dbraw/zinc/07/90/12/328079012.db2.gz	GVQQABXZIIBKLN-UHFFFAOYSA-N	0	0	298.773	4.187	20	30		CIEDRN
C=CCC1(c2nc([C@@H](C)c3cccs3)no2)CCC1	ZINC000571085025	328084125	/nfs/dbraw/zinc/08/41/25/328084125.db2.gz	CSWBFZHSYSLGLD-NSHDSACASA-N	0	0	274.389	4.281	20	30		CIEDRN
CCC(C)(C)C(=O)Nc1nc(-c2cccc(C#N)c2)cs1	ZINC000160899823	328093587	/nfs/dbraw/zinc/09/35/87/328093587.db2.gz	IXHIMFMLNWAVLS-UHFFFAOYSA-N	0	0	299.399	4.056	20	30		CIEDRN
CC(C)Oc1ccccc1CSc1cccnc1C#N	ZINC000571225241	328093678	/nfs/dbraw/zinc/09/36/78/328093678.db2.gz	XELGPPJEAPYGGI-UHFFFAOYSA-N	0	0	284.384	4.033	20	30		CIEDRN
N#CCCCCSCc1c(F)cccc1Cl	ZINC000160980629	328105256	/nfs/dbraw/zinc/10/52/56/328105256.db2.gz	FIWBNKWVNVCZFX-UHFFFAOYSA-N	0	0	257.761	4.406	20	30		CIEDRN
CC(C)(C#N)CCCSCCOc1ccc(F)cc1	ZINC000161024945	328118081	/nfs/dbraw/zinc/11/80/81/328118081.db2.gz	IOUAQXJZZVJZPQ-UHFFFAOYSA-N	0	0	281.396	4.268	20	30		CIEDRN
Cc1cc(C#N)nc(Sc2c(Cl)cccc2Cl)n1	ZINC000571469671	328124398	/nfs/dbraw/zinc/12/43/98/328124398.db2.gz	FDVZSCMQNURRNW-UHFFFAOYSA-N	0	0	296.182	4.115	20	30		CIEDRN
Cc1ccccc1CSCCOc1cccc(C#N)c1	ZINC000048349216	328130767	/nfs/dbraw/zinc/13/07/67/328130767.db2.gz	QTAICVYQBCARBL-UHFFFAOYSA-N	0	0	283.396	4.179	20	30		CIEDRN
C[C@H](c1ccc(CSCCC#N)cc1)C(F)(F)F	ZINC000413015336	328140289	/nfs/dbraw/zinc/14/02/89/328140289.db2.gz	JXAHGNRRYYYAQC-SNVBAGLBSA-N	0	0	273.323	4.499	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1cc(F)ccc1Cl	ZINC000571615120	328137972	/nfs/dbraw/zinc/13/79/72/328137972.db2.gz	CXYPQEFPUAMOIJ-LLVKDONJSA-N	0	0	282.746	4.052	20	30		CIEDRN
CCC(CC)C(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1	ZINC000161164271	328138547	/nfs/dbraw/zinc/13/85/47/328138547.db2.gz	SFEHFVYQGYUGHS-CYBMUJFWSA-N	0	0	299.201	4.110	20	30		CIEDRN
N#Cc1ccc(N2CC3(CCCC3)[C@H]2c2ccccc2)nc1	ZINC000413358008	328144050	/nfs/dbraw/zinc/14/40/50/328144050.db2.gz	DXINTKSTXGTJAZ-GOSISDBHSA-N	0	0	289.382	4.075	20	30		CIEDRN
Cc1ccc(C)c([S@@](=O)CCC2(C#N)CCCCC2)c1	ZINC000414219697	328153352	/nfs/dbraw/zinc/15/33/52/328153352.db2.gz	BDTNBRMBVHCLAJ-FQEVSTJZSA-N	0	0	289.444	4.275	20	30		CIEDRN
CC(C)CCC(=O)Nc1ccccc1SC[C@@H](C)C#N	ZINC000264502804	328159789	/nfs/dbraw/zinc/15/97/89/328159789.db2.gz	GUQAFVQKKFPSBX-ZDUSSCGKSA-N	0	0	290.432	4.313	20	30		CIEDRN
CC/C=C(\C)C(=O)N[C@H](C#N)c1cccc(Cl)c1Cl	ZINC000264552636	328160283	/nfs/dbraw/zinc/16/02/83/328160283.db2.gz	LQPHSVVDSXBWDE-BIPYJSMBSA-N	0	0	297.185	4.031	20	30		CIEDRN
N#C[C@@H]1CCC[C@@H](Nc2cccc(-c3nccs3)c2)C1	ZINC000274206287	328209536	/nfs/dbraw/zinc/20/95/36/328209536.db2.gz	MGFHFVHBGIWIAK-TZMCWYRMSA-N	0	0	283.400	4.304	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)c1cc2cc(C)ccc2o1	ZINC000276209488	328217355	/nfs/dbraw/zinc/21/73/55/328217355.db2.gz	HAUGVBWOYATTFY-UHFFFAOYSA-N	0	0	298.386	4.286	20	30		CIEDRN
Cc1cc(C)cc(-c2nnc(S[C@@H]3CC[C@H](C#N)C3)o2)c1	ZINC000278533814	328226466	/nfs/dbraw/zinc/22/64/66/328226466.db2.gz	IWDSICJXZFEWAQ-GXTWGEPZSA-N	0	0	299.399	4.138	20	30		CIEDRN
N#C[C@@H]1CC[C@@H](Sc2nc3ccccc3s2)C1	ZINC000278547942	328226920	/nfs/dbraw/zinc/22/69/20/328226920.db2.gz	KZQQDRHDBUEALD-NXEZZACHSA-N	0	0	260.387	4.081	20	30		CIEDRN
CCCCn1c(C)c(C)nc1S[C@H]1CC[C@@H](C#N)C1	ZINC000278691410	328229499	/nfs/dbraw/zinc/22/94/99/328229499.db2.gz	ZLAYRPKUBSITQW-KGLIPLIRSA-N	0	0	277.437	4.084	20	30		CIEDRN
N#Cc1sc(N[C@H](c2ccccc2)C2CC2)nc1Cl	ZINC000278692154	328229740	/nfs/dbraw/zinc/22/97/40/328229740.db2.gz	MCXHFOJJZBQLKB-GFCCVEGCSA-N	0	0	289.791	4.231	20	30		CIEDRN
CC(C)(C#N)CC(=O)Nc1cc(Cl)c(F)c(Cl)c1	ZINC000278899394	328232029	/nfs/dbraw/zinc/23/20/29/328232029.db2.gz	YHJQVHLRGZZTRG-UHFFFAOYSA-N	0	0	289.137	4.011	20	30		CIEDRN
N#CC1CCC(CNc2ccnc3ccsc32)CC1	ZINC000281616565	328240549	/nfs/dbraw/zinc/24/05/49/328240549.db2.gz	JQXFDUDTLXGNIY-UHFFFAOYSA-N	0	0	271.389	4.038	20	30		CIEDRN
CC(C)(C)c1ccc([C@H]2CCCN2C(=O)CCCC#N)cc1	ZINC000292511645	328270930	/nfs/dbraw/zinc/27/09/30/328270930.db2.gz	GISMRGAWHOURMN-QGZVFWFLSA-N	0	0	298.430	4.341	20	30		CIEDRN
C[C@@H](c1ccc(Cl)cc1Cl)N(C)C(=O)CCCC#N	ZINC000292801935	328273672	/nfs/dbraw/zinc/27/36/72/328273672.db2.gz	YPZXCIIONYGOCO-JTQLQIEISA-N	0	0	299.201	4.207	20	30		CIEDRN
CCC1(CC)CN(C(=O)Nc2ccc(C(C)(C)C#N)cc2)C1	ZINC000296491883	328290835	/nfs/dbraw/zinc/29/08/35/328290835.db2.gz	YBQWPPJDEUBOIP-UHFFFAOYSA-N	0	0	299.418	4.142	20	30		CIEDRN
CCCCCCCCC(=O)N[C@@H](C)c1ccccn1	ZINC000298189413	328295489	/nfs/dbraw/zinc/29/54/89/328295489.db2.gz	NJMBDQOYERITOO-AWEZNQCLSA-N	0	0	262.397	4.009	20	30		CIEDRN
Cc1ccc2sc(C(=O)Nc3cccc(C#N)c3)cc2c1	ZINC000582151280	328303993	/nfs/dbraw/zinc/30/39/93/328303993.db2.gz	QMUULGGJCMFXDB-UHFFFAOYSA-N	0	0	292.363	4.334	20	30		CIEDRN
CCc1ccc(C(=O)CSc2ccc(C#N)cc2)cc1	ZINC000048512186	328309192	/nfs/dbraw/zinc/30/91/92/328309192.db2.gz	JZKJBIUVPWPQIE-UHFFFAOYSA-N	0	0	281.380	4.096	20	30		CIEDRN
Cc1ccccc1C[C@@H](C)Nc1cccc(F)c1C#N	ZINC000048565905	328315492	/nfs/dbraw/zinc/31/54/92/328315492.db2.gz	JOEYXKDMWXVEIZ-CYBMUJFWSA-N	0	0	268.335	4.049	20	30		CIEDRN
C=C1CCN(C(=O)c2cc(CC)c(CCC)s2)CC1	ZINC000111032925	328323457	/nfs/dbraw/zinc/32/34/57/328323457.db2.gz	QRXSXXUPRREWBL-UHFFFAOYSA-N	0	0	277.433	4.055	20	30		CIEDRN
CC(C)C[C@@](C)(C#N)NC(=O)C[C@H]1CCCCC1(C)C	ZINC000534595652	328319343	/nfs/dbraw/zinc/31/93/43/328319343.db2.gz	HGBNMUUGCBPTAF-PBHICJAKSA-N	0	0	278.440	4.037	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@@H]1CCCC[C@H]1C)c1ccccc1	ZINC000534601069	328320470	/nfs/dbraw/zinc/32/04/70/328320470.db2.gz	SXIRNBLMEPXHCQ-BFYDXBDKSA-N	0	0	271.404	4.041	20	30		CIEDRN
N#Cc1c(Cl)cccc1NCc1ccccc1Cl	ZINC000048727841	328321672	/nfs/dbraw/zinc/32/16/72/328321672.db2.gz	AYSSCTMTAZURCA-UHFFFAOYSA-N	0	0	277.154	4.477	20	30		CIEDRN
C=C[C@H](CC(=O)N(C)C1CCC(C)CC1)c1ccccc1	ZINC000534607920	328322481	/nfs/dbraw/zinc/32/24/81/328322481.db2.gz	GYVISZVKEUFUHI-UPTPFMHGSA-N	0	0	285.431	4.383	20	30		CIEDRN
CC(C)(C)CN(CCC#N)Cc1csc(C(C)(C)C)n1	ZINC000111250309	328339483	/nfs/dbraw/zinc/33/94/83/328339483.db2.gz	KKSIJTHPZSNUBN-UHFFFAOYSA-N	0	0	293.480	4.202	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CCCC(C)(C)CC1)c1ccccc1	ZINC000534671015	328347577	/nfs/dbraw/zinc/34/75/77/328347577.db2.gz	CKMPRRUPHATYEH-INIZCTEOSA-N	0	0	285.431	4.385	20	30		CIEDRN
C=C[C@H](CC(=O)N1CCC[C@H](CCC)C1)c1ccccc1	ZINC000534720972	328359173	/nfs/dbraw/zinc/35/91/73/328359173.db2.gz	GTERPVIXJDXNPB-DLBZAZTESA-N	0	0	285.431	4.385	20	30		CIEDRN
CC(C)(C)[C@@H]1CCCN(C(=O)c2ccc(CC#N)cc2)CC1	ZINC000534675787	328356183	/nfs/dbraw/zinc/35/61/83/328356183.db2.gz	PJWDWCLGJRUXBH-QGZVFWFLSA-N	0	0	298.430	4.041	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)[C@H]1CCC[C@H](C)C1	ZINC000303805371	328357204	/nfs/dbraw/zinc/35/72/04/328357204.db2.gz	AVOKPNLSOPLRBR-GJZGRUSLSA-N	0	0	289.394	4.167	20	30		CIEDRN
Cc1nc(SCc2ccc(C#N)cc2Cl)oc1C	ZINC000220977881	328368513	/nfs/dbraw/zinc/36/85/13/328368513.db2.gz	MKMABNWBMRHVNZ-UHFFFAOYSA-N	0	0	278.764	4.109	20	30		CIEDRN
CC(C)(C)c1ccc([C@H](C#N)NC(=O)c2cccs2)cc1	ZINC000049904262	328381307	/nfs/dbraw/zinc/38/13/07/328381307.db2.gz	OJJVLFCREJCWAX-AWEZNQCLSA-N	0	0	298.411	4.040	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)Nc1cccc(SCC)c1)OCC	ZINC000535135018	328391242	/nfs/dbraw/zinc/39/12/42/328391242.db2.gz	XMDQOTMUMMUDCM-OAHLLOKOSA-N	0	0	293.432	4.108	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)[C@H]1CCCC(C)(C)C1	ZINC000535212411	328394692	/nfs/dbraw/zinc/39/46/92/328394692.db2.gz	SYULCHBFSVCNMG-AWEZNQCLSA-N	0	0	278.440	4.182	20	30		CIEDRN
CN(C(=O)C[C@H]1CCCC(C)(C)C1)c1ccc(C#N)cc1	ZINC000535212281	328394906	/nfs/dbraw/zinc/39/49/06/328394906.db2.gz	YZCWUFSKVMZENJ-OAHLLOKOSA-N	0	0	284.403	4.128	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)c1cccc(C2CCC2)c1	ZINC000341366127	328406929	/nfs/dbraw/zinc/40/69/29/328406929.db2.gz	LNCYDJYBORETIB-UHFFFAOYSA-N	0	0	298.430	4.499	20	30		CIEDRN
N#Cc1ccncc1NCCCCc1ccc(Cl)s1	ZINC000343155307	328423198	/nfs/dbraw/zinc/42/31/98/328423198.db2.gz	UJVMXCSPTVKGJH-UHFFFAOYSA-N	0	0	291.807	4.103	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@@H](C)C[C@H](C)CC)c1ccccc1	ZINC000535387251	328449303	/nfs/dbraw/zinc/44/93/03/328449303.db2.gz	JEFMILAJKYDDGF-OWCLPIDISA-N	0	0	273.420	4.287	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@@H]1CC[C@@H]2CCC[C@H]2C1)c1ccccc1	ZINC000535386516	328449184	/nfs/dbraw/zinc/44/91/84/328449184.db2.gz	VAGPVWUDEBUNDW-XGXHKWSGSA-N	0	0	297.442	4.431	20	30		CIEDRN
C=C[C@H](CC(=O)N(CC(C)C)C(C)C)c1ccccc1	ZINC000535408237	328451725	/nfs/dbraw/zinc/45/17/25/328451725.db2.gz	KICBPBVVJUGCCP-MRXNPFEDSA-N	0	0	273.420	4.239	20	30		CIEDRN
N#Cc1ccc(N2Cc3ccccc3C2)cc1C(F)(F)F	ZINC000050912531	328452353	/nfs/dbraw/zinc/45/23/53/328452353.db2.gz	LBWIKBJRVNMMEH-UHFFFAOYSA-N	0	0	288.272	4.097	20	30		CIEDRN
N#Cc1cc(C(F)(F)F)ccc1N1Cc2ccccc2C1	ZINC000050912532	328452583	/nfs/dbraw/zinc/45/25/83/328452583.db2.gz	DXLXRSMFOQEOCO-UHFFFAOYSA-N	0	0	288.272	4.097	20	30		CIEDRN
C=CCOc1cccc(NC(=O)c2sccc2CC)c1	ZINC000048975794	328457373	/nfs/dbraw/zinc/45/73/73/328457373.db2.gz	SJJRVAOVPQTLPG-UHFFFAOYSA-N	0	0	287.384	4.128	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1cc(Cl)c(Cl)cc1F	ZINC000281380328	328501073	/nfs/dbraw/zinc/50/10/73/328501073.db2.gz	SLGFXHLCMZGTPG-UHFFFAOYSA-N	0	0	291.153	4.172	20	30		CIEDRN
C=CCOc1cccc(NC(=O)[C@H]2CCCC(F)(F)C2)c1	ZINC000282288546	328508176	/nfs/dbraw/zinc/50/81/76/328508176.db2.gz	WDYAKFRHZQHEFZ-LBPRGKRZSA-N	0	0	295.329	4.015	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)NC(C)(C)C	ZINC000191424373	328510895	/nfs/dbraw/zinc/51/08/95/328510895.db2.gz	HVFGSTAAQBQDFD-UHFFFAOYSA-N	0	0	274.408	4.459	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)N(C)C1CC1	ZINC000191439457	328510965	/nfs/dbraw/zinc/51/09/65/328510965.db2.gz	VZMXCUBXWPPHEY-UHFFFAOYSA-N	0	0	272.392	4.165	20	30		CIEDRN
C[C@@H](Sc1ncccc1Cl)c1cccc(C#N)c1	ZINC000189824272	328527021	/nfs/dbraw/zinc/52/70/21/328527021.db2.gz	FRLYIWFYVNIGOX-SNVBAGLBSA-N	0	0	274.776	4.460	20	30		CIEDRN
Cc1csc([C@H](C)Nc2ccc(C#N)c(Cl)c2)n1	ZINC000096474677	328532361	/nfs/dbraw/zinc/53/23/61/328532361.db2.gz	KPMOCDLPQJURSF-VIFPVBQESA-N	0	0	277.780	4.150	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H]1CCSc2ccc(F)cc21	ZINC000292811287	328540464	/nfs/dbraw/zinc/54/04/64/328540464.db2.gz	NXJRVPIQIQVYAV-CYBMUJFWSA-N	0	0	293.407	4.081	20	30		CIEDRN
CC(C)Sc1cccc(Cl)c1CNCC1(C#N)CC1	ZINC000582158606	328565251	/nfs/dbraw/zinc/56/52/51/328565251.db2.gz	FAHMLFXDUZXDBJ-UHFFFAOYSA-N	0	0	294.851	4.234	20	30		CIEDRN
C=CCC1(c2nc(CSCc3ccco3)no2)CCC1	ZINC000345704027	328567768	/nfs/dbraw/zinc/56/77/68/328567768.db2.gz	ZZWRCFMCYUKALN-UHFFFAOYSA-N	0	0	290.388	4.094	20	30		CIEDRN
COCCCCCSCCC1(C#N)CCCCC1	ZINC000419412686	329724566	/nfs/dbraw/zinc/72/45/66/329724566.db2.gz	RHNCCEFPXXIBGD-UHFFFAOYSA-N	0	0	269.454	4.400	20	30		CIEDRN
N#Cc1cc(NCc2c(F)cccc2Cl)ccc1F	ZINC000051635465	328626548	/nfs/dbraw/zinc/62/65/48/328626548.db2.gz	AOGLLAYCEYCTTG-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
CC(C)c1ccc(CNc2ccc([N+](=O)[O-])c(C#N)c2)cc1	ZINC000388942280	328592451	/nfs/dbraw/zinc/59/24/51/328592451.db2.gz	XUYPPNKYAFHQDH-UHFFFAOYSA-N	0	0	295.342	4.202	20	30		CIEDRN
C=CCCO[C@@H](C)c1nc([C@@H]2CCCC(C)(C)C2)no1	ZINC000535961280	328650369	/nfs/dbraw/zinc/65/03/69/328650369.db2.gz	YROWWZQCDAKYHB-QWHCGFSZSA-N	0	0	278.396	4.407	20	30		CIEDRN
Cc1ccc(OCCNc2c(Cl)cccc2C#N)cc1	ZINC000518884715	328597888	/nfs/dbraw/zinc/59/78/88/328597888.db2.gz	JUIJWHRRAVIZTH-UHFFFAOYSA-N	0	0	286.762	4.011	20	30		CIEDRN
C[C@H]1CCC[C@](C#N)(NC(=O)c2ccc3ccccc3c2)C1	ZINC000116808273	326795063	/nfs/dbraw/zinc/79/50/63/326795063.db2.gz	BOKOXKKMDNKCPO-LIRRHRJNSA-N	0	0	292.382	4.042	20	30		CIEDRN
N#CCCCSc1ccc(Br)c(Cl)c1	ZINC000450963320	331008916	/nfs/dbraw/zinc/00/89/16/331008916.db2.gz	AUBVQSPDDTYJTJ-UHFFFAOYSA-N	0	0	290.613	4.498	20	30		CIEDRN
CC(C)(C#N)c1ccc(-c2nc(-c3ccccc3)no2)cc1	ZINC000583959924	326814263	/nfs/dbraw/zinc/81/42/63/326814263.db2.gz	YUUBQLPDMLFCMY-UHFFFAOYSA-N	0	0	289.338	4.205	20	30		CIEDRN
Oc1ccc(SCC#Cc2ccccc2Cl)cc1	ZINC000533468298	326837167	/nfs/dbraw/zinc/83/71/67/326837167.db2.gz	DMCJNNBKVCMKPR-UHFFFAOYSA-N	0	0	274.772	4.189	20	30		CIEDRN
COc1ccc([C@H](C)Nc2ccc(C#N)c(Cl)c2)cc1	ZINC000037393278	326850192	/nfs/dbraw/zinc/85/01/92/326850192.db2.gz	AVRAZRGOFOJUKF-NSHDSACASA-N	0	0	286.762	4.393	20	30		CIEDRN
CC1(C)Cc2cccc(NCc3cc(C#N)ccc3F)c2O1	ZINC000530542438	326862007	/nfs/dbraw/zinc/86/20/07/326862007.db2.gz	YDHDEVACWJCYCG-UHFFFAOYSA-N	0	0	296.345	4.023	20	30		CIEDRN
C=CCn1ccc(-c2cc(Cl)ccc2Cl)n1	ZINC000533627349	326885945	/nfs/dbraw/zinc/88/59/45/326885945.db2.gz	PGSGQGHAIWURJV-UHFFFAOYSA-N	0	0	253.132	4.043	20	30		CIEDRN
C=CCn1c(SCC[C@H](C)F)nnc1-c1cccs1	ZINC000506395646	332772086	/nfs/dbraw/zinc/77/20/86/332772086.db2.gz	OQUDTYNESOLLMM-JTQLQIEISA-N	0	0	297.424	4.033	20	30		CIEDRN
C[C@@H](F)CCSc1ccc(C#N)c(C(F)(F)F)c1	ZINC000506401487	332772209	/nfs/dbraw/zinc/77/22/09/332772209.db2.gz	ZPSVUCAUVJFZCB-MRVPVSSYSA-N	0	0	277.286	4.417	20	30		CIEDRN
C=C(C)CCSc1nnc(C)n1[C@@H]1CCC[C@@H](C)C1	ZINC000506420185	332772684	/nfs/dbraw/zinc/77/26/84/332772684.db2.gz	DBBCXLUYCGJZNR-TZMCWYRMSA-N	0	0	279.453	4.396	20	30		CIEDRN
Cc1ccc(NCCC(C)(C)C#N)cc1C(F)(F)F	ZINC000087591825	326942320	/nfs/dbraw/zinc/94/23/20/326942320.db2.gz	UJEPTWWNBCFCPQ-UHFFFAOYSA-N	0	0	270.298	4.366	20	30		CIEDRN
CC1(C)CCCC[C@@H]1CC(=O)N(C1CC1)C1(C#N)CCC1	ZINC000556456027	326943063	/nfs/dbraw/zinc/94/30/63/326943063.db2.gz	LGIDWJWOQQMSLW-CQSZACIVSA-N	0	0	288.435	4.030	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NC1(c2ccc(Cl)cc2)CCC1	ZINC000556492225	326944534	/nfs/dbraw/zinc/94/45/34/326944534.db2.gz	KDYOPZNRXUENOL-CYBMUJFWSA-N	0	0	291.822	4.438	20	30		CIEDRN
C=CCC[C@H](CCC)Nc1ccc2ccn(C)c(=O)c2c1	ZINC000556609063	326954530	/nfs/dbraw/zinc/95/45/30/326954530.db2.gz	PLOCUWDUKDEOLN-HNNXBMFYSA-N	0	0	284.403	4.085	20	30		CIEDRN
CCc1cccc2c(/C=C\c3ccc(C#N)cn3)c[nH]c21	ZINC000255328091	326964045	/nfs/dbraw/zinc/96/40/45/326964045.db2.gz	QXYAXPNKDVSVCC-CLFYSBASSA-N	0	0	273.339	4.167	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@@H]1CCC[C@H]2CCCC[C@H]21	ZINC000557041787	326990543	/nfs/dbraw/zinc/99/05/43/326990543.db2.gz	HMADJOUHTDZMON-QBPKDAKJSA-N	0	0	275.436	4.160	20	30		CIEDRN
CNc1ccc(C#N)cc1NC(=O)C1(CC(C)C)CCCC1	ZINC000557062214	326991848	/nfs/dbraw/zinc/99/18/48/326991848.db2.gz	WCJGUIYLMYMQHQ-UHFFFAOYSA-N	0	0	299.418	4.145	20	30		CIEDRN
CC(C)c1ccc(CSc2ccc(C#N)cn2)cc1	ZINC000506745195	332778711	/nfs/dbraw/zinc/77/87/11/332778711.db2.gz	YXDAQTBINYWBCR-UHFFFAOYSA-N	0	0	268.385	4.369	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(C[C@@H](C)c2ccccc2)no1	ZINC000564610449	327001317	/nfs/dbraw/zinc/00/13/17/327001317.db2.gz	OWFDMPIVMPUHSS-DYVFJYSZSA-N	0	0	270.376	4.270	20	30		CIEDRN
N#Cc1cccc(COc2ccnc3c(Cl)cccc23)c1	ZINC000506675267	332777341	/nfs/dbraw/zinc/77/73/41/332777341.db2.gz	OROQUIBYXODUPU-UHFFFAOYSA-N	0	0	294.741	4.339	20	30		CIEDRN
COc1ccc(CNc2ccc(C)c(Cl)c2)cc1C#N	ZINC000087822257	327022700	/nfs/dbraw/zinc/02/27/00/327022700.db2.gz	PIVWDSQBPXTIAV-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
COc1ccc(CSc2nc3ccccc3o2)cc1C#N	ZINC000087833701	327025635	/nfs/dbraw/zinc/02/56/35/327025635.db2.gz	PQYUNIZJJPUYKQ-UHFFFAOYSA-N	0	0	296.351	4.000	20	30		CIEDRN
N#Cc1ccc(C[NH2+]C2(c3ccc(Cl)cc3)CC2)s1	ZINC000557791593	327027368	/nfs/dbraw/zinc/02/73/68/327027368.db2.gz	WIRIWFXRARNWMV-UHFFFAOYSA-N	0	0	288.803	4.052	20	30		CIEDRN
C[C@@H](Cc1ccccc1)C(=O)Nc1ccc(Cl)c(C#N)c1	ZINC000557885701	327033788	/nfs/dbraw/zinc/03/37/88/327033788.db2.gz	INAXKZSYCIHRFU-LBPRGKRZSA-N	0	0	298.773	4.029	20	30		CIEDRN
C=CCCO[C@@H](C)C(=O)Nc1cccc(-c2ccccc2)c1	ZINC000557946697	327036717	/nfs/dbraw/zinc/03/67/17/327036717.db2.gz	SAVNZUYCOQRWBG-HNNXBMFYSA-N	0	0	295.382	4.273	20	30		CIEDRN
C=C(C)COc1cc(C(F)(F)F)ccc1Cl	ZINC000584136221	327046822	/nfs/dbraw/zinc/04/68/22/327046822.db2.gz	PWHSZNNBPAZYIZ-UHFFFAOYSA-N	0	0	250.647	4.314	20	30		CIEDRN
C=CCOc1cccc(NC(=O)c2sccc2Cl)c1	ZINC000506764676	332779266	/nfs/dbraw/zinc/77/92/66/332779266.db2.gz	AWURXMWXLRHEJD-UHFFFAOYSA-N	0	0	293.775	4.219	20	30		CIEDRN
N#Cc1c(F)cccc1N1CCC[C@H]1c1ccc(F)cc1	ZINC000506822425	332780687	/nfs/dbraw/zinc/78/06/87/332780687.db2.gz	IBYQHOTZARJQBG-INIZCTEOSA-N	0	0	284.309	4.178	20	30		CIEDRN
N#Cc1c(F)cccc1N1CCC[C@@H]1Cc1ccc(F)cc1	ZINC000506841543	332780880	/nfs/dbraw/zinc/78/08/80/332780880.db2.gz	SEXNCWWSOZDLOS-OAHLLOKOSA-N	0	0	298.336	4.048	20	30		CIEDRN
Cc1ccccc1C[C@@H](C)Nc1ccc(C#N)cc1F	ZINC000506835880	332780954	/nfs/dbraw/zinc/78/09/54/332780954.db2.gz	FKAADKOJZXPEOR-CYBMUJFWSA-N	0	0	268.335	4.049	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(Cc2cc(C)ccc2C)no1	ZINC000558296230	327086040	/nfs/dbraw/zinc/08/60/40/327086040.db2.gz	OWIYOSGHSRXZBO-KRWDZBQOSA-N	0	0	270.376	4.131	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@H](c3ccc(CC)cc3)C2)CCC1	ZINC000558306058	327086670	/nfs/dbraw/zinc/08/66/70/327086670.db2.gz	XLWFNLMCSCRMGK-SFHVURJKSA-N	0	0	297.442	4.311	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2ccc3c(n2)CCCC3)no1	ZINC000558375688	327089433	/nfs/dbraw/zinc/08/94/33/327089433.db2.gz	YPBPIYNWSDENJF-GFCCVEGCSA-N	0	0	283.375	4.080	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)Cc1coc2cc(C)ccc12	ZINC000558474921	327096871	/nfs/dbraw/zinc/09/68/71/327096871.db2.gz	FNSSWZGRTCSPNQ-UHFFFAOYSA-N	0	0	285.387	4.002	20	30		CIEDRN
C=CCC[C@H](C(=O)Nc1scnc1C)c1ccccc1	ZINC000558564077	327105539	/nfs/dbraw/zinc/10/55/39/327105539.db2.gz	BRYHZUZXABVLGH-AWEZNQCLSA-N	0	0	286.400	4.140	20	30		CIEDRN
C/C(=C/c1ccccc1C(F)(F)F)CNCC1(C#N)CC1	ZINC000558621049	327109119	/nfs/dbraw/zinc/10/91/19/327109119.db2.gz	BTHQQWVQYBTLRD-WQLSENKSSA-N	0	0	294.320	4.002	20	30		CIEDRN
CC[C@@](C)(C#N)NC(=O)c1ccc(C(C)(C)C)c(Cl)c1	ZINC000558670254	327113045	/nfs/dbraw/zinc/11/30/45/327113045.db2.gz	ZEAWWXOPOVTPLA-INIZCTEOSA-N	0	0	292.810	4.060	20	30		CIEDRN
C[C@H](CC(C)(C)C)C(=O)N[C@@](C)(C#N)C1CCCCC1	ZINC000558717326	327116633	/nfs/dbraw/zinc/11/66/33/327116633.db2.gz	NDGAJGZKSQFUFV-DYVFJYSZSA-N	0	0	278.440	4.037	20	30		CIEDRN
N#Cc1ccc(CSC2CCCC2)c(OC(F)F)c1	ZINC000530994827	327122518	/nfs/dbraw/zinc/12/25/18/327122518.db2.gz	OKEAYXUTLNLVRS-UHFFFAOYSA-N	0	0	283.343	4.335	20	30		CIEDRN
C=CCn1c(S[C@H]2CC[C@@H](C)C2)nnc1-c1ccco1	ZINC000558829669	327123530	/nfs/dbraw/zinc/12/35/30/327123530.db2.gz	ZDAWGRRZGJHEHJ-NEPJUHHUSA-N	0	0	289.404	4.005	20	30		CIEDRN
N#CCc1cccc(N[C@@H]2CCC[C@H](C3CC3)C2)c1	ZINC000313421931	327128986	/nfs/dbraw/zinc/12/89/86/327128986.db2.gz	DCSWCMCBTSSZAK-DOTOQJQBSA-N	0	0	254.377	4.133	20	30		CIEDRN
CC(C)c1ccc2ncc(C#N)c(N3CCC[C@H]3CF)c2c1	ZINC000558983959	327136946	/nfs/dbraw/zinc/13/69/46/327136946.db2.gz	HODJWOKPRQGLKS-HNNXBMFYSA-N	0	0	297.377	4.168	20	30		CIEDRN
CC(C)c1ccc2occ(C(=O)N[C@H](C#N)C(C)(C)C)c2c1	ZINC000569372485	327167696	/nfs/dbraw/zinc/16/76/96/327167696.db2.gz	SJKDJPSAEWFTNY-MRXNPFEDSA-N	0	0	298.386	4.224	20	30		CIEDRN
Cc1sc(NC(=O)c2cccc(C3CC3)c2)c(C#N)c1C	ZINC000569375401	327168731	/nfs/dbraw/zinc/16/87/31/327168731.db2.gz	QIOVZYUOOSVESS-UHFFFAOYSA-N	0	0	296.395	4.366	20	30		CIEDRN
Cc1ccc(C(F)(F)F)cc1NCc1ccc(C#N)cc1	ZINC000091478423	327170841	/nfs/dbraw/zinc/17/08/41/327170841.db2.gz	DDHUVEPXQBWUIN-UHFFFAOYSA-N	0	0	290.288	4.498	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)[C@@H](C)CSc1ccc(F)cc1	ZINC000410131337	327180185	/nfs/dbraw/zinc/18/01/85/327180185.db2.gz	QZMPDXXMRUROLX-GXTWGEPZSA-N	0	0	295.423	4.025	20	30		CIEDRN
C=CC[N@H+](CC1CCCCC1)[C@H](C)c1ccc(C(=O)[O-])o1	ZINC000569491900	327185011	/nfs/dbraw/zinc/18/50/11/327185011.db2.gz	DYTMWEWYOHPIKY-CYBMUJFWSA-N	0	0	291.391	4.107	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)CCC1CCC1	ZINC000410354237	327187287	/nfs/dbraw/zinc/18/72/87/327187287.db2.gz	ODYIXVDYHDHDFJ-UHFFFAOYSA-N	0	0	257.377	4.324	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1ccccc1C	ZINC000410353657	327187846	/nfs/dbraw/zinc/18/78/46/327187846.db2.gz	SZBLNWPVWDRQOW-UHFFFAOYSA-N	0	0	265.356	4.366	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc2ccc(Cl)cc2n1	ZINC000410386210	327188567	/nfs/dbraw/zinc/18/85/67/327188567.db2.gz	DVFOZHFHORTZPE-UHFFFAOYSA-N	0	0	274.751	4.183	20	30		CIEDRN
C=CCCCCCSCCc1scnc1C	ZINC000507103984	332786882	/nfs/dbraw/zinc/78/68/82/332786882.db2.gz	PGXRKWAGZKTNTI-UHFFFAOYSA-N	0	0	255.452	4.474	20	30		CIEDRN
CCC(CC)Nc1ccc(C#N)cc1C(F)(F)F	ZINC000036973715	327203408	/nfs/dbraw/zinc/20/34/08/327203408.db2.gz	XJSXIWKCCIOPAK-UHFFFAOYSA-N	0	0	256.271	4.178	20	30		CIEDRN
C=C(C)CN(C)C(=O)Nc1cccc(Cl)c1OC(C)C	ZINC000181733753	327214407	/nfs/dbraw/zinc/21/44/07/327214407.db2.gz	OYHBINPDEQSZQW-UHFFFAOYSA-N	0	0	296.798	4.167	20	30		CIEDRN
C[C@@H](Nc1cccc(Cl)c1C#N)c1ccc(C#N)cc1	ZINC000047873347	327216277	/nfs/dbraw/zinc/21/62/77/327216277.db2.gz	OPHRBFKNBDPEHM-LLVKDONJSA-N	0	0	281.746	4.256	20	30		CIEDRN
C=CCCC(=O)Nc1ccccc1Nc1ccccc1	ZINC000128586956	327220506	/nfs/dbraw/zinc/22/05/06/327220506.db2.gz	MDKDTENWERYWOR-UHFFFAOYSA-N	0	0	266.344	4.335	20	30		CIEDRN
CCC(CC)[C@@H](C)C(=O)Nc1ccc(C#N)cc1Cl	ZINC000536402271	327235860	/nfs/dbraw/zinc/23/58/60/327235860.db2.gz	YWBAZDCYVRAFNZ-SNVBAGLBSA-N	0	0	278.783	4.222	20	30		CIEDRN
CCC(CC)[C@H](C)C(=O)Nc1cc(C#N)cn1C(C)(C)C	ZINC000536429085	327237579	/nfs/dbraw/zinc/23/75/79/327237579.db2.gz	DACZSPNMTZMUCT-LBPRGKRZSA-N	0	0	289.423	4.126	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1scnc1C1CC1)c1ccccc1	ZINC000536487220	327241254	/nfs/dbraw/zinc/24/12/54/327241254.db2.gz	YKCYXIMZGYGVDC-GFCCVEGCSA-N	0	0	298.411	4.319	20	30		CIEDRN
CC1(C)CCCC[C@H]1CC(=O)N1CCc2ccc(C#N)cc21	ZINC000559473971	327247777	/nfs/dbraw/zinc/24/77/77/327247777.db2.gz	JYSBWSZSVXECMS-INIZCTEOSA-N	0	0	296.414	4.054	20	30		CIEDRN
CC(C)(C#N)CCCSc1ncnc2sccc21	ZINC000531106249	327248854	/nfs/dbraw/zinc/24/88/54/327248854.db2.gz	RJQNGXQMEUQCGN-UHFFFAOYSA-N	0	0	277.418	4.113	20	30		CIEDRN
Cc1c2cc(C#N)ccc2sc1C(=O)N(C(C)C)C1CC1	ZINC000559537607	327252903	/nfs/dbraw/zinc/25/29/03/327252903.db2.gz	RTEBAXGULITZOP-UHFFFAOYSA-N	0	0	298.411	4.094	20	30		CIEDRN
COc1cc(-c2nc3cc(C)ccc3s2)ccc1C#N	ZINC000559791925	327261663	/nfs/dbraw/zinc/26/16/63/327261663.db2.gz	CDNTYHPPKNZVAO-UHFFFAOYSA-N	0	0	280.352	4.152	20	30		CIEDRN
C=CCC[C@@H]([NH2+]CC1(OCC)CCCC1)c1ccco1	ZINC000559893080	327268902	/nfs/dbraw/zinc/26/89/02/327268902.db2.gz	MXNUORMRENYOMW-OAHLLOKOSA-N	0	0	277.408	4.226	20	30		CIEDRN
CC(C)Oc1cccc([C@H](NCCCCC#N)C(F)F)c1	ZINC000559894334	327269175	/nfs/dbraw/zinc/26/91/75/327269175.db2.gz	QIHSAJHANXOFTC-HNNXBMFYSA-N	0	0	296.361	4.063	20	30		CIEDRN
CC(C)(C#N)c1ccccc1CSCc1cccnc1	ZINC000564485325	327274357	/nfs/dbraw/zinc/27/43/57/327274357.db2.gz	BVHGELJTDBYBOH-UHFFFAOYSA-N	0	0	282.412	4.316	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H]2[C@H](C)[C@H]2c2ccccc2)n1	ZINC000560024377	327278096	/nfs/dbraw/zinc/27/80/96/327278096.db2.gz	SZDNPDOUWLQENJ-VHDGCEQUSA-N	0	0	282.387	4.440	20	30		CIEDRN
C=CCC(C)(C)c1noc(/C=C\c2nc3ccccc3o2)n1	ZINC000560024862	327278125	/nfs/dbraw/zinc/27/81/25/327278125.db2.gz	VVRIDUFRAMVNRQ-KTKRTIGZSA-N	0	0	295.342	4.235	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cnc3ccsc3c2)n1	ZINC000560023792	327278150	/nfs/dbraw/zinc/27/81/50/327278150.db2.gz	FBNUCDXPMLWGES-UHFFFAOYSA-N	0	0	285.372	4.200	20	30		CIEDRN
C=CCC(C)(C)c1noc(/C=C/c2nc3ccccc3o2)n1	ZINC000560024863	327278271	/nfs/dbraw/zinc/27/82/71/327278271.db2.gz	VVRIDUFRAMVNRQ-MDZDMXLPSA-N	0	0	295.342	4.235	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ccc(C(C)C)nc2)n1	ZINC000560026474	327278361	/nfs/dbraw/zinc/27/83/61/327278361.db2.gz	WUNWRAZLYNDVFW-UHFFFAOYSA-N	0	0	271.364	4.109	20	30		CIEDRN
C=CCC(C)(C)c1noc(/C=C\c2cccc(OC)c2)n1	ZINC000560027838	327278449	/nfs/dbraw/zinc/27/84/49/327278449.db2.gz	MMMGOAYLCOEGSC-KTKRTIGZSA-N	0	0	284.359	4.102	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ccn(C(CC)CC)n2)n1	ZINC000560029997	327278830	/nfs/dbraw/zinc/27/88/30/327278830.db2.gz	XYGWLOZLTYTYAN-UHFFFAOYSA-N	0	0	288.395	4.148	20	30		CIEDRN
C=CCC(C)(C)c1noc(/C=C\c2ccc3c(c2)CCO3)n1	ZINC000560029990	327279007	/nfs/dbraw/zinc/27/90/07/327279007.db2.gz	ZTEBYGXMMXKPIN-VURMDHGXSA-N	0	0	296.370	4.029	20	30		CIEDRN
C=CCC(C)(C)c1nc(Cc2cc3ccccc3o2)no1	ZINC000560042931	327280111	/nfs/dbraw/zinc/28/01/11/327280111.db2.gz	DJNGIQBWXYIECB-UHFFFAOYSA-N	0	0	282.343	4.260	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1c(C)cnc2c(OC)cccc21	ZINC000560100720	327284238	/nfs/dbraw/zinc/28/42/38/327284238.db2.gz	LHZJVHOYNCGYSX-GFCCVEGCSA-N	0	0	298.386	4.093	20	30		CIEDRN
C=CCC(CC=C)C(=O)NC(C)(C)c1ccc(Cl)cc1	ZINC000560153502	327287607	/nfs/dbraw/zinc/28/76/07/327287607.db2.gz	GNMXWBUEMQGUEE-UHFFFAOYSA-N	0	0	291.822	4.460	20	30		CIEDRN
CC(C)CN(CCC#N)[C@@H](C)c1ccccc1Cl	ZINC000560180084	327288723	/nfs/dbraw/zinc/28/87/23/327288723.db2.gz	ZFQBYXKQNOHQFH-ZDUSSCGKSA-N	0	0	264.800	4.273	20	30		CIEDRN
N#Cc1cnccc1SC1CCC(C(F)(F)F)CC1	ZINC000560232367	327291612	/nfs/dbraw/zinc/29/16/12/327291612.db2.gz	ZIWGDDRLXDVOEF-UHFFFAOYSA-N	0	0	286.322	4.166	20	30		CIEDRN
CC[C@H](C)CCC(=O)Nc1cccc(OCCCC#N)c1	ZINC000507187161	332793845	/nfs/dbraw/zinc/79/38/45/332793845.db2.gz	IYUVYKNLBXSGKQ-AWEZNQCLSA-N	0	0	288.391	4.134	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)N(C)c1ccc(-c2ccccc2)cc1	ZINC000560531863	327320124	/nfs/dbraw/zinc/32/01/24/327320124.db2.gz	FPUCUUNFRJUZBD-LJQANCHMSA-N	0	0	292.382	4.256	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)N1CC(CC)(CC)c2ccccc21	ZINC000560606709	327329677	/nfs/dbraw/zinc/32/96/77/327329677.db2.gz	YXOQKDUDAJRZOY-QGZVFWFLSA-N	0	0	284.403	4.031	20	30		CIEDRN
CCc1ccc(NC(=O)c2ccc(C#N)s2)cc1Cl	ZINC000560772905	327342402	/nfs/dbraw/zinc/34/24/02/327342402.db2.gz	USROZEAZRVVNFM-UHFFFAOYSA-N	0	0	290.775	4.088	20	30		CIEDRN
C=CCN(C(=O)N[C@H](CC)c1cccc(Cl)c1)C1CC1	ZINC000560855533	327348229	/nfs/dbraw/zinc/34/82/29/327348229.db2.gz	PQGASAJORCGYIL-OAHLLOKOSA-N	0	0	292.810	4.151	20	30		CIEDRN
C[C@H](CSCc1cccc(C#N)c1F)C(F)(F)F	ZINC000561064048	327362560	/nfs/dbraw/zinc/36/25/60/327362560.db2.gz	VCACBZODPYWNRE-MRVPVSSYSA-N	0	0	277.286	4.129	20	30		CIEDRN
CC[C@@H](CC(=O)Nc1cc(C#N)cn1C(C)(C)C)C(C)C	ZINC000561112818	327367423	/nfs/dbraw/zinc/36/74/23/327367423.db2.gz	LCCCOHHCHFMXGZ-AWEZNQCLSA-N	0	0	289.423	4.126	20	30		CIEDRN
Cc1nsc(NCc2cc3ccccc3s2)c1C#N	ZINC000561153539	327369979	/nfs/dbraw/zinc/36/99/79/327369979.db2.gz	IIIZQGRPUFXXCV-UHFFFAOYSA-N	0	0	285.397	4.150	20	30		CIEDRN
C[C@H]1C[C@H](CCNc2cccc(C(F)F)c2C#N)CCO1	ZINC000583451041	327373886	/nfs/dbraw/zinc/37/38/86/327373886.db2.gz	IXAHGADRZRJRMU-NWDGAFQWSA-N	0	0	294.345	4.113	20	30		CIEDRN
C[C@@H]1CCC[C@H](C(=O)Nc2ccc(C(C)(C)C#N)cc2)C1	ZINC000150781962	327377635	/nfs/dbraw/zinc/37/76/35/327377635.db2.gz	RRRZINYCQKJUBT-KGLIPLIRSA-N	0	0	284.403	4.253	20	30		CIEDRN
C=CCCCCSCC(=O)Nc1ccc(C)cc1F	ZINC000561244880	327378495	/nfs/dbraw/zinc/37/84/95/327378495.db2.gz	RLJYQOSLQHDGCG-UHFFFAOYSA-N	0	0	281.396	4.162	20	30		CIEDRN
Cc1ccccc1[C@@H]1CCCN1c1nccc(C#N)c1Cl	ZINC000561261413	327380923	/nfs/dbraw/zinc/38/09/23/327380923.db2.gz	QWISIRTXEJURPA-HNNXBMFYSA-N	0	0	297.789	4.257	20	30		CIEDRN
Cc1ccc(C#N)c(N[C@H]2C[C@H](c3cccc(Cl)c3)C2)n1	ZINC000561320895	327385428	/nfs/dbraw/zinc/38/54/28/327385428.db2.gz	QODGANPJDVGQRD-KOMQPUFPSA-N	0	0	297.789	4.273	20	30		CIEDRN
CC(C)(C#N)c1ccccc1COc1cc(F)cc(C#N)c1	ZINC000561375191	327390186	/nfs/dbraw/zinc/39/01/86/327390186.db2.gz	KBLQXBVNMSNHDX-UHFFFAOYSA-N	0	0	294.329	4.078	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@H]1CCC(C)C	ZINC000155571017	327394090	/nfs/dbraw/zinc/39/40/90/327394090.db2.gz	WJUGVLOGWBLSMK-INIZCTEOSA-N	0	0	263.425	4.182	20	30		CIEDRN
C[C@H]1C[C@H](c2ccccc2)N(c2ncc(C#N)cc2Cl)C1	ZINC000561447344	327395334	/nfs/dbraw/zinc/39/53/34/327395334.db2.gz	BKILDRQJWBJJSD-BLLLJJGKSA-N	0	0	297.789	4.194	20	30		CIEDRN
C[C@@H]1C[C@@H](c2ccccc2)N(c2ncc(C#N)cc2Cl)C1	ZINC000561447347	327395389	/nfs/dbraw/zinc/39/53/89/327395389.db2.gz	BKILDRQJWBJJSD-WBMJQRKESA-N	0	0	297.789	4.194	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC(C)C)c1ccccc1	ZINC000561467205	327397229	/nfs/dbraw/zinc/39/72/29/327397229.db2.gz	DCXXHHOFMIOUSY-OAHLLOKOSA-N	0	0	259.393	4.278	20	30		CIEDRN
C=CCCCc1nc(-c2cccc(C(F)(F)F)c2)no1	ZINC000531129120	327409341	/nfs/dbraw/zinc/40/93/41/327409341.db2.gz	TZJXOOKJTMZROC-UHFFFAOYSA-N	0	0	282.265	4.264	20	30		CIEDRN
C=CCC1(c2nc(-c3ccc4ncccc4c3)no2)CCC1	ZINC000561883443	327428101	/nfs/dbraw/zinc/42/81/01/327428101.db2.gz	XGORMRWSJXKGMP-UHFFFAOYSA-N	0	0	291.354	4.283	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(C2(c3cccc(OC)c3)CC2)no1	ZINC000561943087	327432120	/nfs/dbraw/zinc/43/21/20/327432120.db2.gz	GHPMQMZXAIHPNV-QGZVFWFLSA-N	0	0	298.386	4.012	20	30		CIEDRN
C=CC[C@H](C)NC(=O)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1	ZINC000246677055	327438099	/nfs/dbraw/zinc/43/80/99/327438099.db2.gz	IJKQNPIHYYZOON-QCZZGDTMSA-N	0	0	298.213	4.178	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CC[C@@H](c2ccc(CC)cc2)C1	ZINC000562119811	327450609	/nfs/dbraw/zinc/45/06/09/327450609.db2.gz	CIVROGBQBIYSMX-CRAIPNDOSA-N	0	0	285.431	4.167	20	30		CIEDRN
Cc1ccc(C#N)c(Nc2ccc(CC(F)(F)F)cc2)n1	ZINC000569637291	327455575	/nfs/dbraw/zinc/45/55/75/327455575.db2.gz	IUYHOBRHHTUHEG-UHFFFAOYSA-N	0	0	291.276	4.110	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)CCc1ccc(C)cc1	ZINC000247857472	327461437	/nfs/dbraw/zinc/46/14/37/327461437.db2.gz	DCLDOWMUTGGGHM-UHFFFAOYSA-N	0	0	299.439	4.204	20	30		CIEDRN
CC[C@@](C)(NCCCCC(C)(C)C#N)C(F)(F)F	ZINC000562470565	327483769	/nfs/dbraw/zinc/48/37/69/327483769.db2.gz	XTZNARFZYCQCGS-GFCCVEGCSA-N	0	0	264.335	4.027	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cc(F)ccc1OC(F)F	ZINC000159120817	327488839	/nfs/dbraw/zinc/48/88/39/327488839.db2.gz	MQVBUQJVGCAZTK-UHFFFAOYSA-N	0	0	299.292	4.134	20	30		CIEDRN
C=C(C)[C@H](CC(=O)Nc1ccc(/C=C/C)cc1)OCC	ZINC000565109027	327492411	/nfs/dbraw/zinc/49/24/11/327492411.db2.gz	BRQWFUUIGACVRB-YERXGYGTSA-N	0	0	273.376	4.030	20	30		CIEDRN
C[C@@H](C(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccsc1	ZINC000151823139	327510909	/nfs/dbraw/zinc/51/09/09/327510909.db2.gz	BIDWPBUJBVWWOR-GFCCVEGCSA-N	0	0	298.411	4.291	20	30		CIEDRN
CC[C@@H](C(=O)Nc1cc(C#N)ccc1C)c1ccc(F)cc1	ZINC000159517298	327511788	/nfs/dbraw/zinc/51/17/88/327511788.db2.gz	GRJPDENBQFNOSY-MRXNPFEDSA-N	0	0	296.345	4.138	20	30		CIEDRN
CCOCc1ccc(N[C@@H]2CCc3ccc(C#N)cc32)cc1	ZINC000562909711	327524002	/nfs/dbraw/zinc/52/40/02/327524002.db2.gz	NMXSKGBMQJSKIX-LJQANCHMSA-N	0	0	292.382	4.194	20	30		CIEDRN
C=C(C)CCc1noc(CO[C@H]2CCCC[C@@H]2CC)n1	ZINC000569766632	327545760	/nfs/dbraw/zinc/54/57/60/327545760.db2.gz	IPPVUXAIKRFBON-KBPBESRZSA-N	0	0	278.396	4.064	20	30		CIEDRN
Cc1cc(N2CCC[C@H]2c2cccc(Cl)c2)cc(C#N)n1	ZINC000570115184	327570191	/nfs/dbraw/zinc/57/01/91/327570191.db2.gz	MYKLOXNNYZFPSQ-KRWDZBQOSA-N	0	0	297.789	4.257	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2sc(CCC)nc2C)n1	ZINC000570149136	327572358	/nfs/dbraw/zinc/57/23/58/327572358.db2.gz	JEVZFRAKHBNLOM-UHFFFAOYSA-N	0	0	291.420	4.308	20	30		CIEDRN
C=CCOc1cccc(NC(=O)Nc2ccccc2C)c1	ZINC000113553560	328625602	/nfs/dbraw/zinc/62/56/02/328625602.db2.gz	FBWNLDKUHODLEK-UHFFFAOYSA-N	0	0	282.343	4.204	20	30		CIEDRN
C=CCCCCNc1cccc(NC(=O)CCC)c1	ZINC000583606746	328635081	/nfs/dbraw/zinc/63/50/81/328635081.db2.gz	XTJWFWXDOGVMQC-UHFFFAOYSA-N	0	0	260.381	4.193	20	30		CIEDRN
Cc1ccccc1-c1noc(/C=C/c2cccc(C#N)c2)n1	ZINC000113729721	328635482	/nfs/dbraw/zinc/63/54/82/328635482.db2.gz	PMTXVVVTTFMVPU-MDZDMXLPSA-N	0	0	287.322	4.087	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)[C@@H](C)CC1CCCC1	ZINC000114252694	328642944	/nfs/dbraw/zinc/64/29/44/328642944.db2.gz	UZJMEHZSKBCGRU-ZDUSSCGKSA-N	0	0	270.376	4.022	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)Nc1ccc(C(C)(C)C)cc1)OCC	ZINC000535882520	328645621	/nfs/dbraw/zinc/64/56/21/328645621.db2.gz	IPMYDCVLCZKVDI-MRXNPFEDSA-N	0	0	289.419	4.294	20	30		CIEDRN
C=C(C)[C@H](CC(=O)N(CC(C)C)C(CC)CC)OCC	ZINC000535914016	328648435	/nfs/dbraw/zinc/64/84/35/328648435.db2.gz	KITPYNRKOOOTFH-INIZCTEOSA-N	0	0	283.456	4.031	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)Nc1cccc2ccccc21)OCC	ZINC000535956858	328650424	/nfs/dbraw/zinc/65/04/24/328650424.db2.gz	YFWLFMUMHSREMC-QGZVFWFLSA-N	0	0	283.371	4.150	20	30		CIEDRN
C=C[C@@H](CC(=O)NCc1ccccc1Cl)c1ccccc1	ZINC000536084377	328655563	/nfs/dbraw/zinc/65/55/63/328655563.db2.gz	ILNWSSJBZDVUOJ-AWEZNQCLSA-N	0	0	299.801	4.316	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1ccc(F)cc1)c1ccccc1	ZINC000536084998	328655646	/nfs/dbraw/zinc/65/56/46/328655646.db2.gz	LZUVYEYBRNNLFN-ZDUSSCGKSA-N	0	0	269.319	4.124	20	30		CIEDRN
CC1(C)CCC[C@@H](c2noc(Cc3ccc(C#N)cc3)n2)C1	ZINC000536143202	328658314	/nfs/dbraw/zinc/65/83/14/328658314.db2.gz	WHVVNHWSLGKCKI-OAHLLOKOSA-N	0	0	295.386	4.216	20	30		CIEDRN
Cc1cc(NCc2ccc(CC#N)cc2)c(Cl)cc1F	ZINC000399048141	328660343	/nfs/dbraw/zinc/66/03/43/328660343.db2.gz	VMQZHFBNLWROKS-UHFFFAOYSA-N	0	0	288.753	4.466	20	30		CIEDRN
C=CCN(CC=C)C(=O)Nc1ccccc1OC(C)(C)C	ZINC000115776826	328668738	/nfs/dbraw/zinc/66/87/38/328668738.db2.gz	DJVYYGKFYTXVCX-UHFFFAOYSA-N	0	0	288.391	4.070	20	30		CIEDRN
C=CCCCNc1ccc(C)c(Br)c1	ZINC000070592428	328684566	/nfs/dbraw/zinc/68/45/66/328684566.db2.gz	PYJUQJGUYZSBQD-UHFFFAOYSA-N	0	0	254.171	4.136	20	30		CIEDRN
Cc1ccccc1[C@H](C)CC(=O)N(C)c1cccc(C#N)c1	ZINC000116004804	328688566	/nfs/dbraw/zinc/68/85/66/328688566.db2.gz	FMNQEQUBCGIRLY-OAHLLOKOSA-N	0	0	292.382	4.023	20	30		CIEDRN
C=CCCCc1nc(C(C)(C)Cc2ccccc2)no1	ZINC000519818725	328698340	/nfs/dbraw/zinc/69/83/40/328698340.db2.gz	UGJBNYCRUKIIBJ-UHFFFAOYSA-N	0	0	270.376	4.099	20	30		CIEDRN
C=CCC[C@H](NC(=O)C1=CCCCC1)c1ccccc1	ZINC000526123667	328750949	/nfs/dbraw/zinc/75/09/49/328750949.db2.gz	NANORTMXDYDHBZ-KRWDZBQOSA-N	0	0	269.388	4.311	20	30		CIEDRN
Cc1ccc(C)c(CNc2ccc(Cl)c(C#N)c2)c1	ZINC000042316689	328765290	/nfs/dbraw/zinc/76/52/90/328765290.db2.gz	YDCIHTVTPWGELH-UHFFFAOYSA-N	0	0	270.763	4.441	20	30		CIEDRN
COc1ccc(Cl)c(N[C@H](C)c2cccc(C#N)c2)c1	ZINC000043317101	328786274	/nfs/dbraw/zinc/78/62/74/328786274.db2.gz	ASODHIUTBLTBIM-LLVKDONJSA-N	0	0	286.762	4.393	20	30		CIEDRN
CC(C)(CCC#N)CN1CCc2ccc(Cl)cc21	ZINC000507721929	332820574	/nfs/dbraw/zinc/82/05/74/332820574.db2.gz	RWJUUKDPTJTWEY-UHFFFAOYSA-N	0	0	262.784	4.032	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1ccc(OCCC)cc1C	ZINC000105012363	328814179	/nfs/dbraw/zinc/81/41/79/328814179.db2.gz	OFISBCOVCNZFGK-UHFFFAOYSA-N	0	0	290.407	4.214	20	30		CIEDRN
Cc1nc(Sc2nc3ccccc3s2)ccc1C#N	ZINC000389407901	328825800	/nfs/dbraw/zinc/82/58/00/328825800.db2.gz	KFVJDIYKFIZRNX-UHFFFAOYSA-N	0	0	283.381	4.023	20	30		CIEDRN
C[C@@H](Nc1ccc2ccccc2n1)c1cccc(C#N)c1	ZINC000301431475	328827920	/nfs/dbraw/zinc/82/79/20/328827920.db2.gz	IZBYBCXXMNDMLB-CYBMUJFWSA-N	0	0	273.339	4.280	20	30		CIEDRN
C=C(C)CCS[C@@H](C)C(=O)Nc1cccc(Cl)c1	ZINC000507801970	332824485	/nfs/dbraw/zinc/82/44/85/332824485.db2.gz	QDOIWLQJTDFZPN-NSHDSACASA-N	0	0	283.824	4.366	20	30		CIEDRN
C=C(C)CCS[C@@H](C)C(=O)N1c2ccccc2C[C@H]1C	ZINC000507802676	332824625	/nfs/dbraw/zinc/82/46/25/332824625.db2.gz	WELBGFVWLPDZKC-KGLIPLIRSA-N	0	0	289.444	4.052	20	30		CIEDRN
C=CCOc1ccc(CNc2ccccc2CCOC)cc1	ZINC000389509701	328852517	/nfs/dbraw/zinc/85/25/17/328852517.db2.gz	YJEGVAMMXLRHMY-UHFFFAOYSA-N	0	0	297.398	4.052	20	30		CIEDRN
C=C(C)CCSCCC(=O)Nc1cccc(F)c1C	ZINC000507861428	332828168	/nfs/dbraw/zinc/82/81/68/332828168.db2.gz	QHARVDYKOKZQJW-UHFFFAOYSA-N	0	0	281.396	4.162	20	30		CIEDRN
C[C@H](CCNc1c(C#N)cccc1C#N)c1ccccc1	ZINC000358685022	328892085	/nfs/dbraw/zinc/89/20/85/328892085.db2.gz	RHZYBRCXHPTXTA-CQSZACIVSA-N	0	0	275.355	4.036	20	30		CIEDRN
Cc1occc1SCc1ccc(Cl)cc1C#N	ZINC000358786611	328895160	/nfs/dbraw/zinc/89/51/60/328895160.db2.gz	PTIWVNXRNCKMQW-UHFFFAOYSA-N	0	0	263.749	4.405	20	30		CIEDRN
CCCCOc1ccc(NCC(C)(C)CCC#N)cn1	ZINC000359126084	328895947	/nfs/dbraw/zinc/89/59/47/328895947.db2.gz	VZAPYEJGYYTTAX-UHFFFAOYSA-N	0	0	275.396	4.002	20	30		CIEDRN
CC1(C)CCCC[C@@H]1CC(=O)Nc1ccc(F)cc1C#N	ZINC000508003137	332831291	/nfs/dbraw/zinc/83/12/91/332831291.db2.gz	WSKKDNWVTAQJHF-CYBMUJFWSA-N	0	0	288.366	4.242	20	30		CIEDRN
CN(C(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1ccccc1C#N	ZINC000389566717	328945196	/nfs/dbraw/zinc/94/51/96/328945196.db2.gz	ZGGZZERCCBTAIN-ARFHVFGLSA-N	0	0	296.414	4.128	20	30		CIEDRN
CC[C@@](C)(NCCC1(C#N)CCCCC1)C(F)(F)F	ZINC000582406562	328981363	/nfs/dbraw/zinc/98/13/63/328981363.db2.gz	XKSPSCHAIIFFGX-GFCCVEGCSA-N	0	0	276.346	4.171	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1Cc2ccccc2C2(CCC2)C1	ZINC000375992964	329006132	/nfs/dbraw/zinc/00/61/32/329006132.db2.gz	OMJWFCUHNWAYJK-HNNXBMFYSA-N	0	0	283.415	4.053	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H](C)[C@H](C)c2ccccc2)CCC1	ZINC000188708031	329006188	/nfs/dbraw/zinc/00/61/88/329006188.db2.gz	YHUBDVPYPOFCOZ-GJZGRUSLSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CCCC(=O)N(C)[C@H](C)c1cccc(-c2ccncc2)c1	ZINC000377814368	329030353	/nfs/dbraw/zinc/03/03/53/329030353.db2.gz	NNNQHALMMOKLPA-OAHLLOKOSA-N	0	0	294.398	4.234	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@@H]1c1ccccc1OC	ZINC000378103548	329040024	/nfs/dbraw/zinc/04/00/24/329040024.db2.gz	NQZXUTSRDFXYLY-QGZVFWFLSA-N	0	0	299.414	4.127	20	30		CIEDRN
C[C@H](CC1CCCCC1)C(=O)N(C)c1ccccc1C#N	ZINC000508088910	332833394	/nfs/dbraw/zinc/83/33/94/332833394.db2.gz	PZAWYDCHQNRPJR-CQSZACIVSA-N	0	0	284.403	4.128	20	30		CIEDRN
N#CCCCOc1cccc(N[C@H]2CCc3ccccc32)c1	ZINC000193904603	329062661	/nfs/dbraw/zinc/06/26/61/329062661.db2.gz	GBZGENSDIFRBNO-IBGZPJMESA-N	0	0	292.382	4.469	20	30		CIEDRN
CC(C)Oc1cccc(CSc2cccnc2C#N)c1	ZINC000583703707	329086173	/nfs/dbraw/zinc/08/61/73/329086173.db2.gz	HHPCNESZXVTTOM-UHFFFAOYSA-N	0	0	284.384	4.033	20	30		CIEDRN
C=CCC1(C(=O)Nc2nc(C)cc(C3CC3)n2)CCCCC1	ZINC000582472643	329094049	/nfs/dbraw/zinc/09/40/49/329094049.db2.gz	IMWBNCIEOWRUQN-UHFFFAOYSA-N	0	0	299.418	4.128	20	30		CIEDRN
C=C(C)CSCc1ccc(Br)cc1C#N	ZINC000582538554	329108646	/nfs/dbraw/zinc/10/86/46/329108646.db2.gz	MTFKWTNTEDEXLV-UHFFFAOYSA-N	0	0	282.206	4.130	20	30		CIEDRN
C=C(C)CCc1noc(CC/C=C/c2ccccc2)n1	ZINC000508594534	332842670	/nfs/dbraw/zinc/84/26/70/332842670.db2.gz	JYROIONLWRKFEK-UXBLZVDNSA-N	0	0	268.360	4.224	20	30		CIEDRN
C=CCCC(=O)N1CC[C@@H](C)C[C@H]1c1ccc(CC)o1	ZINC000173634524	329149829	/nfs/dbraw/zinc/14/98/29/329149829.db2.gz	OIUOLPXOMQSSCO-HIFRSBDPSA-N	0	0	275.392	4.108	20	30		CIEDRN
C=C(C)CCc1noc(C[C@H](CC)c2ccccc2)n1	ZINC000508607756	332843648	/nfs/dbraw/zinc/84/36/48/332843648.db2.gz	CGARGLPEJXWQSX-AWEZNQCLSA-N	0	0	270.376	4.315	20	30		CIEDRN
C=C(C)CCc1noc(/C=C/c2ccccc2C)n1	ZINC000508609578	332844065	/nfs/dbraw/zinc/84/40/65/332844065.db2.gz	RCNBGZZOSXFISU-PKNBQFBNSA-N	0	0	254.333	4.057	20	30		CIEDRN
C=CCCCC(=O)N1C[C@H](C)C[C@@H]1c1ccccc1F	ZINC000176008019	329173129	/nfs/dbraw/zinc/17/31/29/329173129.db2.gz	MJSIKFPYMIRFRD-CZUORRHYSA-N	0	0	275.367	4.092	20	30		CIEDRN
C=C(C)CCc1noc(-c2[nH]c3ccccc3c2Cl)n1	ZINC000508634855	332845148	/nfs/dbraw/zinc/84/51/48/332845148.db2.gz	WXPWXJBZCWIJQL-UHFFFAOYSA-N	0	0	287.750	4.380	20	30		CIEDRN
CC(C)(C#N)CCCSc1nc2c(cc1C#N)CCCC2	ZINC000177226319	329182327	/nfs/dbraw/zinc/18/23/27/329182327.db2.gz	JOYBOZOOOMXYJO-UHFFFAOYSA-N	0	0	299.443	4.254	20	30		CIEDRN
C=C(C)CCc1noc(-c2cccn2C2CCCC2)n1	ZINC000508661826	332846379	/nfs/dbraw/zinc/84/63/79/332846379.db2.gz	AJBFSPONELPFJM-UHFFFAOYSA-N	0	0	271.364	4.162	20	30		CIEDRN
C=C(C)CCc1noc([C@@H](c2ccccc2)C2CC2)n1	ZINC000508666714	332846664	/nfs/dbraw/zinc/84/66/64/332846664.db2.gz	PXRLZTWWKNBROI-INIZCTEOSA-N	0	0	268.360	4.120	20	30		CIEDRN
C=C(C)CCc1noc(-c2cccc(C)c2Cl)n1	ZINC000508676305	332847079	/nfs/dbraw/zinc/84/70/79/332847079.db2.gz	CTQZNQXQYDIXLL-UHFFFAOYSA-N	0	0	262.740	4.207	20	30		CIEDRN
C=C(C)CCc1noc(-c2cc(C)c(F)cc2Cl)n1	ZINC000508680178	332847084	/nfs/dbraw/zinc/84/70/84/332847084.db2.gz	PACQSXLHMVOZTI-UHFFFAOYSA-N	0	0	280.730	4.346	20	30		CIEDRN
C[C@H](SCc1ccc(CO)cc1)c1ccc(C#N)cc1	ZINC000180707077	329222179	/nfs/dbraw/zinc/22/21/79/329222179.db2.gz	UDYIOJLSMNLUBY-ZDUSSCGKSA-N	0	0	283.396	4.045	20	30		CIEDRN
CC(=O)c1ccc(NCc2cccc(C#N)c2)cc1Cl	ZINC000181026797	329225214	/nfs/dbraw/zinc/22/52/14/329225214.db2.gz	DVALKYROCAQRDE-UHFFFAOYSA-N	0	0	284.746	4.026	20	30		CIEDRN
C[C@H]1CCCN(C(=O)c2sccc2C#N)c2ccccc21	ZINC000183941171	329254762	/nfs/dbraw/zinc/25/47/62/329254762.db2.gz	AOOPQRCJYJEHOH-LBPRGKRZSA-N	0	0	296.395	4.164	20	30		CIEDRN
CCc1ccc([C@@H](NCc2nc(C#N)cs2)C(C)C)cc1	ZINC000395165561	329278123	/nfs/dbraw/zinc/27/81/23/329278123.db2.gz	ORTVEMWVOMSGOY-KRWDZBQOSA-N	0	0	299.443	4.064	20	30		CIEDRN
Cc1csc(NC(=O)c2cc3cccc(C)c3o2)c1C#N	ZINC000582929415	329286163	/nfs/dbraw/zinc/28/61/63/329286163.db2.gz	KQJVLZPXQZYSJS-UHFFFAOYSA-N	0	0	296.351	4.235	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1C[C@@H](c2ccc(C)cc2)C[C@H]1C	ZINC000508895919	332852186	/nfs/dbraw/zinc/85/21/86/332852186.db2.gz	YHWIHGWJXYIZAD-WBVHZDCISA-N	0	0	285.431	4.302	20	30		CIEDRN
CCCCc1ccc(-c2csc(NC(=O)CC#N)n2)cc1	ZINC000185697551	329329175	/nfs/dbraw/zinc/32/91/75/329329175.db2.gz	PBDNGUVFRMALME-UHFFFAOYSA-N	0	0	299.399	4.005	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cccc(-c2nc(C)co2)c1	ZINC000186027693	329336298	/nfs/dbraw/zinc/33/62/98/329336298.db2.gz	REJUMQUSCAMKPD-GFCCVEGCSA-N	0	0	284.359	4.191	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC=C(c2ccccc2F)CC1	ZINC000186130362	329338393	/nfs/dbraw/zinc/33/83/93/329338393.db2.gz	FPGBZSGIQIIPEZ-AWEZNQCLSA-N	0	0	287.378	4.044	20	30		CIEDRN
CC#CCCCC(=O)Nc1cccnc1-c1csc(C)c1	ZINC000186889542	329351017	/nfs/dbraw/zinc/35/10/17/329351017.db2.gz	GCGSVTRVGDKHAA-UHFFFAOYSA-N	0	0	298.411	4.251	20	30		CIEDRN
CC(C)(C#N)CCC[S@@](=O)CCCCc1ccccc1	ZINC000187111346	329353359	/nfs/dbraw/zinc/35/33/59/329353359.db2.gz	BWPRPXYXDFNDFH-FQEVSTJZSA-N	0	0	291.460	4.088	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1cccc(C2CC2)n1)c1ccccc1	ZINC000498111962	329368865	/nfs/dbraw/zinc/36/88/65/329368865.db2.gz	ORCCPVCGBHZKOM-AWEZNQCLSA-N	0	0	292.382	4.257	20	30		CIEDRN
Cc1cccc2c1OCC[C@@H]2[NH2+][C@H](C)c1cccc(C#N)c1	ZINC000189460569	329381143	/nfs/dbraw/zinc/38/11/43/329381143.db2.gz	NNICOERYYOIEEM-KDOFPFPSSA-N	0	0	292.382	4.041	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccoc1	ZINC000189896727	329388075	/nfs/dbraw/zinc/38/80/75/329388075.db2.gz	JZJWSXVPKKHHSC-UHFFFAOYSA-N	0	0	283.371	4.313	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1cncc(F)c1	ZINC000189884074	329388096	/nfs/dbraw/zinc/38/80/96/329388096.db2.gz	CAGSNYHHZCPTBK-UHFFFAOYSA-N	0	0	298.361	4.325	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)CCSC	ZINC000189885601	329388902	/nfs/dbraw/zinc/38/89/02/329388902.db2.gz	BQEYWXLFOYBGJX-UHFFFAOYSA-N	0	0	277.433	4.230	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)CCCCOC	ZINC000189893867	329389262	/nfs/dbraw/zinc/38/92/62/329389262.db2.gz	TZKQGBFURJYXKD-UHFFFAOYSA-N	0	0	289.419	4.294	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2	ZINC000189901086	329390049	/nfs/dbraw/zinc/39/00/49/329390049.db2.gz	MRNBFDSGUIYBCE-OIISXLGYSA-N	0	0	299.414	4.045	20	30		CIEDRN
C=CCC1(C(=O)Nc2cccc(COC(C)C)c2)CCC1	ZINC000190131142	329392416	/nfs/dbraw/zinc/39/24/16/329392416.db2.gz	AYILCKLTRIWIPN-UHFFFAOYSA-N	0	0	287.403	4.297	20	30		CIEDRN
C=CCC1(C(=O)N(C)Cc2ccc(Cl)cc2)CCC1	ZINC000190559215	329399184	/nfs/dbraw/zinc/39/91/84/329399184.db2.gz	CWMIVMRGIOJCCN-UHFFFAOYSA-N	0	0	277.795	4.045	20	30		CIEDRN
N#CCCCSCc1ccc(Br)cc1F	ZINC000190872853	329401527	/nfs/dbraw/zinc/40/15/27/329401527.db2.gz	YDELANIZUUQWSB-UHFFFAOYSA-N	0	0	288.185	4.125	20	30		CIEDRN
N#CCCCSCCOc1ccc(C(F)(F)F)cc1	ZINC000190939636	329403223	/nfs/dbraw/zinc/40/32/23/329403223.db2.gz	JBAVMSXDVXMMHS-UHFFFAOYSA-N	0	0	289.322	4.121	20	30		CIEDRN
CCc1ccc(-c2nc(CN[C@@H](CC)CC#N)cs2)cc1	ZINC000516978072	329412874	/nfs/dbraw/zinc/41/28/74/329412874.db2.gz	ACTYPNZAMUQKML-HNNXBMFYSA-N	0	0	299.443	4.154	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)NCCC	ZINC000191513151	329417077	/nfs/dbraw/zinc/41/70/77/329417077.db2.gz	NYFBUBIBYNEISY-UHFFFAOYSA-N	0	0	260.381	4.070	20	30		CIEDRN
C=CCC1(C(=O)N2CCc3sccc3[C@H]2CC)CCC1	ZINC000191870763	329424255	/nfs/dbraw/zinc/42/42/55/329424255.db2.gz	FWGKIICYHIPMBX-CQSZACIVSA-N	0	0	289.444	4.330	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)c1cccc(Cl)c1C	ZINC000192849562	329436842	/nfs/dbraw/zinc/43/68/42/329436842.db2.gz	QWRVKVDRODOBBQ-UHFFFAOYSA-N	0	0	292.810	4.193	20	30		CIEDRN
N#CCc1ccc(COc2ccc3ccccc3c2)cc1	ZINC000399007869	329447527	/nfs/dbraw/zinc/44/75/27/329447527.db2.gz	ANILBQLAPRWOAP-UHFFFAOYSA-N	0	0	273.335	4.485	20	30		CIEDRN
C=CCCO[C@H](C)C(=O)N(c1ccc(Cl)cc1)C(C)C	ZINC000509156309	332860545	/nfs/dbraw/zinc/86/05/45/332860545.db2.gz	LCNVVLMUQSGILT-CYBMUJFWSA-N	0	0	295.810	4.063	20	30		CIEDRN
Cc1sc(NC(=O)[C@H](C)Cc2ccccc2)c(C#N)c1C	ZINC000584521772	329510819	/nfs/dbraw/zinc/51/08/19/329510819.db2.gz	CJXOAMABOVWLLH-LLVKDONJSA-N	0	0	298.411	4.054	20	30		CIEDRN
C=CCN(CC=C)C(=O)c1cc(CC)c(CCC)s1	ZINC000301947225	332863516	/nfs/dbraw/zinc/86/35/16/332863516.db2.gz	XVXVJUUPZIEYID-UHFFFAOYSA-N	0	0	277.433	4.077	20	30		CIEDRN
CCC(C)(C)C1CCC(CC(=O)N[C@@H](C#N)C2CC2)CC1	ZINC000509284752	332863609	/nfs/dbraw/zinc/86/36/09/332863609.db2.gz	XAQSIJJVMRMSLT-BCLQGDPASA-N	0	0	290.451	4.037	20	30		CIEDRN
CCc1nnc([C@H](C)S[C@@H](C)c2ccc(C#N)cc2)o1	ZINC000125636273	329585348	/nfs/dbraw/zinc/58/53/48/329585348.db2.gz	PAPDCXKDUOGJLE-QWRGUYRKSA-N	0	0	287.388	4.059	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)NCCc1c(C)oc2ccccc21	ZINC000424791214	329589140	/nfs/dbraw/zinc/58/91/40/329589140.db2.gz	YCRXIQURYBNSAB-UHFFFAOYSA-N	0	0	285.387	4.002	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N1CCc2c(cccc2C(C)C)C1	ZINC000424793698	329589530	/nfs/dbraw/zinc/58/95/30/329589530.db2.gz	NASJGCRIHLLYFJ-UHFFFAOYSA-N	0	0	285.431	4.297	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1cnn(CCC(C)C)c1CC	ZINC000424793997	329589614	/nfs/dbraw/zinc/58/96/14/329589614.db2.gz	AFEHBVUOBLDAGW-UHFFFAOYSA-N	0	0	291.439	4.032	20	30		CIEDRN
CC(C)CC(C)(C)C(=O)N(C)[C@@H](C)c1cccc(C#N)c1	ZINC000425640389	329591268	/nfs/dbraw/zinc/59/12/68/329591268.db2.gz	SBLSHEQINCUVNB-AWEZNQCLSA-N	0	0	286.419	4.150	20	30		CIEDRN
CC[C@@H](CC(C)C)C(=O)N(C)[C@@H](C)c1cccc(C#N)c1	ZINC000425106959	329595080	/nfs/dbraw/zinc/59/50/80/329595080.db2.gz	INXWSQXPSWQKIY-HOCLYGCPSA-N	0	0	286.419	4.150	20	30		CIEDRN
C[C@H](c1cccc(C#N)c1)N(C)C(=O)CCCC(C)(C)C	ZINC000425134902	329604971	/nfs/dbraw/zinc/60/49/71/329604971.db2.gz	VIWSMOKEMQCFDD-CQSZACIVSA-N	0	0	286.419	4.294	20	30		CIEDRN
CCSCc1cccc(NC(=O)c2cccc(C#N)c2)c1	ZINC000128704218	329611239	/nfs/dbraw/zinc/61/12/39/329611239.db2.gz	GPXKIIZXCUBJHZ-UHFFFAOYSA-N	0	0	296.395	4.064	20	30		CIEDRN
CC1(C)CCC[C@@H]1CNC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000564038797	329658683	/nfs/dbraw/zinc/65/86/83/329658683.db2.gz	VKXMVYNUQIMNIW-IAGOWNOFSA-N	0	0	298.430	4.016	20	30		CIEDRN
N#Cc1cccc(S[C@@H]2CCCc3ccccc32)n1	ZINC000152496388	329661170	/nfs/dbraw/zinc/66/11/70/329661170.db2.gz	AXPUJTHJTCAVLK-OAHLLOKOSA-N	0	0	266.369	4.123	20	30		CIEDRN
N#CC1(CCOc2ccnc(C(F)(F)F)c2)CCCCC1	ZINC000418970676	329702788	/nfs/dbraw/zinc/70/27/88/329702788.db2.gz	KYQSTPWJZXNWLK-UHFFFAOYSA-N	0	0	298.308	4.343	20	30		CIEDRN
Cc1ccc(OCCCC2(C#N)CCOCC2)cc1Cl	ZINC000419113666	329708469	/nfs/dbraw/zinc/70/84/69/329708469.db2.gz	LVCJELQBKPMOIL-UHFFFAOYSA-N	0	0	293.794	4.128	20	30		CIEDRN
C[C@H](NCc1cccc(F)c1C#N)c1ccc(C2CC2)cc1	ZINC000419342113	329718454	/nfs/dbraw/zinc/71/84/54/329718454.db2.gz	PASSJTNCQOLXHH-ZDUSSCGKSA-N	0	0	294.373	4.426	20	30		CIEDRN
Cc1cc(CSCc2nc(C#N)cs2)c(C)s1	ZINC000419399758	329723288	/nfs/dbraw/zinc/72/32/88/329723288.db2.gz	KMCUOZGFFCFJLW-UHFFFAOYSA-N	0	0	280.443	4.127	20	30		CIEDRN
C=CCCCSCc1cnc2c(cnn2C(C)C)c1	ZINC000419403452	329723634	/nfs/dbraw/zinc/72/36/34/329723634.db2.gz	DVEQTEHHEYHKBG-UHFFFAOYSA-N	0	0	275.421	4.212	20	30		CIEDRN
COC1(CCS[C@H](C)c2ccc(C#N)cc2)CCC1	ZINC000419416424	329725137	/nfs/dbraw/zinc/72/51/37/329725137.db2.gz	HBHGRFRIAZRHCT-CYBMUJFWSA-N	0	0	275.417	4.312	20	30		CIEDRN
C[C@H](SCC1(C#N)CCC1)c1ccc(F)c(F)c1	ZINC000419386670	329726514	/nfs/dbraw/zinc/72/65/14/329726514.db2.gz	BWFAOGFSJPUTOT-JTQLQIEISA-N	0	0	267.344	4.453	20	30		CIEDRN
N#CC1(CSCCOc2ccc(Cl)cc2)CCC1	ZINC000419386921	329726579	/nfs/dbraw/zinc/72/65/79/329726579.db2.gz	FAQJZEFCJSCFGU-UHFFFAOYSA-N	0	0	281.808	4.146	20	30		CIEDRN
C[C@@H](SCC1(C#N)CCC1)c1cccc(C#N)c1	ZINC000419466623	329726756	/nfs/dbraw/zinc/72/67/56/329726756.db2.gz	REZFKNOXLKCAPV-GFCCVEGCSA-N	0	0	256.374	4.046	20	30		CIEDRN
N#CC1(CSCc2ccc(F)c(Cl)c2)CCC1	ZINC000419468394	329726926	/nfs/dbraw/zinc/72/69/26/329726926.db2.gz	USPVZXHICAJXOM-UHFFFAOYSA-N	0	0	269.772	4.406	20	30		CIEDRN
N#CC1(CSCc2cccc(Cl)c2F)CCC1	ZINC000419468683	329726948	/nfs/dbraw/zinc/72/69/48/329726948.db2.gz	VKQITYLUQKQHIR-UHFFFAOYSA-N	0	0	269.772	4.406	20	30		CIEDRN
C[C@H](SCCc1cncs1)c1ccc(C#N)cc1	ZINC000419430549	329728360	/nfs/dbraw/zinc/72/83/60/329728360.db2.gz	VYRQIVOUSTYHDD-NSHDSACASA-N	0	0	274.414	4.052	20	30		CIEDRN
CCO[C@@H](C)c1nc(CSCC2(C#N)CCC2)cs1	ZINC000419429351	329728389	/nfs/dbraw/zinc/72/83/89/329728389.db2.gz	UNFILLPPAZPMJM-NSHDSACASA-N	0	0	296.461	4.168	20	30		CIEDRN
C[C@@H](SCCC1(C#N)CCCCC1)c1cnccn1	ZINC000419443625	329729575	/nfs/dbraw/zinc/72/95/75/329729575.db2.gz	BNCBVIRGQCHEJL-CYBMUJFWSA-N	0	0	275.421	4.135	20	30		CIEDRN
N#CC1(CSCc2nc(C(F)(F)F)cs2)CCC1	ZINC000419447775	329729946	/nfs/dbraw/zinc/72/99/46/329729946.db2.gz	PVOYPYGAKSFOGE-UHFFFAOYSA-N	0	0	292.351	4.089	20	30		CIEDRN
N#CC1(CCSCCOCC(F)(F)F)CCCCC1	ZINC000419449829	329730096	/nfs/dbraw/zinc/73/00/96/329730096.db2.gz	KLFAFVOPOKOKIS-UHFFFAOYSA-N	0	0	295.370	4.163	20	30		CIEDRN
N#CC1(CSC[C@@H]2C[C@H]2c2ccccc2)CCC1	ZINC000419500241	329732603	/nfs/dbraw/zinc/73/26/03/329732603.db2.gz	ZKEJXAUFWHLRFJ-GJZGRUSLSA-N	0	0	257.402	4.217	20	30		CIEDRN
COCc1ccc(CSCCCC(C)(C)C#N)cc1	ZINC000419473298	329735239	/nfs/dbraw/zinc/73/52/39/329735239.db2.gz	ADESLZOMWYUOFP-UHFFFAOYSA-N	0	0	277.433	4.396	20	30		CIEDRN
N#Cc1csc(CSCCC2=CCCCC2)n1	ZINC000419535883	329738221	/nfs/dbraw/zinc/73/82/21/329738221.db2.gz	AGWDHZRZSTXFNV-UHFFFAOYSA-N	0	0	264.419	4.138	20	30		CIEDRN
Cc1ccc(Br)cc1CSCC1(C#N)CC1	ZINC000419547401	329738740	/nfs/dbraw/zinc/73/87/40/329738740.db2.gz	PRMXFGQUGJABLW-UHFFFAOYSA-N	0	0	296.233	4.295	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@H](C)c1ccc(C2CC2)cc1	ZINC000419572756	329739628	/nfs/dbraw/zinc/73/96/28/329739628.db2.gz	QWZUPJHNKSZOPU-CQSZACIVSA-N	0	0	286.419	4.233	20	30		CIEDRN
CC#CCCSCc1ccc(-c2ncco2)cc1F	ZINC000419618503	329740062	/nfs/dbraw/zinc/74/00/62/329740062.db2.gz	OPCHTQJSZOTFIF-UHFFFAOYSA-N	0	0	275.348	4.127	20	30		CIEDRN
N#CCCCCSCc1ccc(-c2ncco2)cc1F	ZINC000419606248	329742625	/nfs/dbraw/zinc/74/26/25/329742625.db2.gz	FKQYZNWLZMCCSI-UHFFFAOYSA-N	0	0	290.363	4.408	20	30		CIEDRN
C=C(C)[C@H]1OCCC[C@H]1c1nc([C@@H]2CCCC[C@@H]2C)no1	ZINC000420501485	329770665	/nfs/dbraw/zinc/77/06/65/329770665.db2.gz	HMMCYSUVLSKLJC-GBJTYRQASA-N	0	0	290.407	4.202	20	30		CIEDRN
Cc1cc(Cl)cc(C#N)c1Oc1cc(C(C)C)ncn1	ZINC000420635407	329780370	/nfs/dbraw/zinc/78/03/70/329780370.db2.gz	FEHXDYINTNZUNL-UHFFFAOYSA-N	0	0	287.750	4.226	20	30		CIEDRN
C=CCCn1c2cc(Cl)ccc2c(=O)c2c1CCCC2	ZINC000421188339	329806901	/nfs/dbraw/zinc/80/69/01/329806901.db2.gz	JSIBPLLIRYUTSY-UHFFFAOYSA-N	0	0	287.790	4.110	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1cccc(-c2ncc(C)o2)c1	ZINC000066974594	329850190	/nfs/dbraw/zinc/85/01/90/329850190.db2.gz	IHEJLMBZYRNRPJ-UHFFFAOYSA-N	0	0	299.374	4.080	20	30		CIEDRN
C=CCN(Cc1csc(C)n1)Cc1ccc(Cl)s1	ZINC000072801796	329859121	/nfs/dbraw/zinc/85/91/21/329859121.db2.gz	XKZWEJFBOVLRRC-UHFFFAOYSA-N	0	0	298.864	4.355	20	30		CIEDRN
C=CCOCCCC(=O)Nc1c(C)cccc1C(C)C	ZINC000073850103	329862747	/nfs/dbraw/zinc/86/27/47/329862747.db2.gz	OYWYHTDUTOCRIQ-UHFFFAOYSA-N	0	0	275.392	4.040	20	30		CIEDRN
C[C@H](CC(C)(C)C)C(=O)N(CCC#N)c1ccc(F)cc1	ZINC000571944267	329932656	/nfs/dbraw/zinc/93/26/56/329932656.db2.gz	WSCGLKVHTWRFPY-CYBMUJFWSA-N	0	0	290.382	4.145	20	30		CIEDRN
CC(C)=CCC[C@H](C)CC(=O)Nc1ccccc1CC#N	ZINC000572002170	329936339	/nfs/dbraw/zinc/93/63/39/329936339.db2.gz	AUBXIJFFRBKSMQ-HNNXBMFYSA-N	0	0	284.403	4.464	20	30		CIEDRN
C=CCN(C)C(=O)c1oc2c(ccc3ccccc23)c1C	ZINC000161496999	329942951	/nfs/dbraw/zinc/94/29/51/329942951.db2.gz	BHVPRXIMCNJYPC-UHFFFAOYSA-N	0	0	279.339	4.152	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)CC1(C)CCCCC1	ZINC000510025314	332888503	/nfs/dbraw/zinc/88/85/03/332888503.db2.gz	BVGOPTLSRMHMSR-UHFFFAOYSA-N	0	0	270.376	4.166	20	30		CIEDRN
C[C@@H](NC(=O)[C@@H](C)CC1CCCCC1)c1ccc(C#N)cc1	ZINC000510045182	332889283	/nfs/dbraw/zinc/88/92/83/332889283.db2.gz	YDSBVKNFSZEMTN-LSDHHAIUSA-N	0	0	298.430	4.342	20	30		CIEDRN
C=CCSc1ccccc1C(=O)Nc1ccc(C)c(O)c1	ZINC000510057941	332889959	/nfs/dbraw/zinc/88/99/59/332889959.db2.gz	UPVWTYSKZWWHQG-UHFFFAOYSA-N	0	0	299.395	4.231	20	30		CIEDRN
C=CCC(F)(F)c1nc([C@@H]2CCCc3ccccc32)no1	ZINC000572384289	330037951	/nfs/dbraw/zinc/03/79/51/330037951.db2.gz	PJQSHNCTJBHUIP-CYBMUJFWSA-N	0	0	290.313	4.206	20	30		CIEDRN
C=CCCCCCN(C)C(=O)N[C@@H](C)c1ccc(C#N)cc1	ZINC000265730787	330063003	/nfs/dbraw/zinc/06/30/03/330063003.db2.gz	AYJBFVQMLIOAOL-HNNXBMFYSA-N	0	0	299.418	4.007	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1c(F)cccc1NC1CC1	ZINC000268276353	330065638	/nfs/dbraw/zinc/06/56/38/330065638.db2.gz	PINBHADNQSZLTK-UHFFFAOYSA-N	0	0	288.366	4.107	20	30		CIEDRN
C=C[C@@H](CC(=O)N[C@H](C)CCc1ccco1)c1ccccc1	ZINC000270189396	330073230	/nfs/dbraw/zinc/07/32/30/330073230.db2.gz	BSAWODDISHLZGA-CVEARBPZSA-N	0	0	297.398	4.077	20	30		CIEDRN
C#CC[C@H]([NH2+]Cc1cnc(C(C)(C)C)s1)c1ccccc1	ZINC000270216605	330074236	/nfs/dbraw/zinc/07/42/36/330074236.db2.gz	OXWBLPRDEUVQJZ-INIZCTEOSA-N	0	0	298.455	4.295	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1cccc(SC)c1C	ZINC000271651240	330081635	/nfs/dbraw/zinc/08/16/35/330081635.db2.gz	BEWQZXAPMNXBLT-UHFFFAOYSA-N	0	0	278.421	4.147	20	30		CIEDRN
C=CCC(CC=C)c1nc([C@H]2CCCCS2)no1	ZINC000274033969	330102973	/nfs/dbraw/zinc/10/29/73/330102973.db2.gz	OMGXXFVCUDSCBI-GFCCVEGCSA-N	0	0	264.394	4.264	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCCC[C@H]1c1ccc(F)cc1	ZINC000274364338	330105476	/nfs/dbraw/zinc/10/54/76/330105476.db2.gz	TWKJBLWCAFNYSY-YOEHRIQHSA-N	0	0	289.394	4.482	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCCCC[C@@H]1c1ccncc1	ZINC000274309736	330105502	/nfs/dbraw/zinc/10/55/02/330105502.db2.gz	WTIQAKZKPVUIPM-NVXWUHKLSA-N	0	0	286.419	4.128	20	30		CIEDRN
C=CCn1c(SCCC(=C)C)nnc1-c1ccoc1C	ZINC000274752778	330107403	/nfs/dbraw/zinc/10/74/03/330107403.db2.gz	QMMNAXPYJQMJCQ-UHFFFAOYSA-N	0	0	289.404	4.091	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1cc(C(F)(F)F)ccc1C	ZINC000276040760	330111397	/nfs/dbraw/zinc/11/13/97/330111397.db2.gz	GDIKRDURTVZBSU-UHFFFAOYSA-N	0	0	286.297	4.054	20	30		CIEDRN
C=CCCN(C)C(=O)N[C@@H](C)c1cc2ccccc2s1	ZINC000276051993	330111672	/nfs/dbraw/zinc/11/16/72/330111672.db2.gz	AGUNNBGKBVLRJA-LBPRGKRZSA-N	0	0	288.416	4.180	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1cc(C(F)F)ccc1Cl	ZINC000276085747	330111869	/nfs/dbraw/zinc/11/18/69/330111869.db2.gz	LZMOTDHOGUKBDM-UHFFFAOYSA-N	0	0	288.725	4.317	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1cccc(OC2CCCC2)c1	ZINC000276241097	330112551	/nfs/dbraw/zinc/11/25/51/330112551.db2.gz	CCKIZPPZRLNRSL-UHFFFAOYSA-N	0	0	288.391	4.048	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1ccc(OC(C)C)c(Cl)c1	ZINC000276336111	330113066	/nfs/dbraw/zinc/11/30/66/330113066.db2.gz	RJHYXZICVGBQQX-UHFFFAOYSA-N	0	0	296.798	4.167	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)/C(C)=C\C	ZINC000276468544	330113287	/nfs/dbraw/zinc/11/32/87/330113287.db2.gz	PMTVJPRHIKUYMD-QPEQYQDCSA-N	0	0	257.377	4.443	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)CC1CC1	ZINC000276400916	330113529	/nfs/dbraw/zinc/11/35/29/330113529.db2.gz	DHLVUKFMNDXWNB-UHFFFAOYSA-N	0	0	257.377	4.277	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1cncs1	ZINC000276452614	330113788	/nfs/dbraw/zinc/11/37/88/330113788.db2.gz	MHYZUPQCDLZZSL-UHFFFAOYSA-N	0	0	286.400	4.247	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)[C@]1(C)CCCO1	ZINC000276509120	330114060	/nfs/dbraw/zinc/11/40/60/330114060.db2.gz	YZHYOPLYYUJUDG-SFHVURJKSA-N	0	0	287.403	4.046	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)NC[C@@H](c1ccccc1)C(F)(F)F	ZINC000276961934	330114882	/nfs/dbraw/zinc/11/48/82/330114882.db2.gz	RZAZUQKCXXBCQA-DZGCQCFKSA-N	0	0	299.336	4.051	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cc2c(cc1Cl)CCC2=O	ZINC000277083347	330115431	/nfs/dbraw/zinc/11/54/31/330115431.db2.gz	JXDIZBIPHQSWPR-INIZCTEOSA-N	0	0	291.778	4.010	20	30		CIEDRN
C=CCC1(C(=O)N(C)Cc2ccc(Cl)s2)CCC1	ZINC000276706824	330116835	/nfs/dbraw/zinc/11/68/35/330116835.db2.gz	PYNOCPDUOPJSNK-UHFFFAOYSA-N	0	0	283.824	4.106	20	30		CIEDRN
C=CC[C@@H](C)[C@@H](C)Nc1cccc(NC(=O)NCC)c1C	ZINC000278927775	330121296	/nfs/dbraw/zinc/12/12/96/330121296.db2.gz	XBZFQRGOPBSIGA-TZMCWYRMSA-N	0	0	289.423	4.149	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)Nc1c(C)c(F)ccc1Cl)OCC	ZINC000279163700	330121928	/nfs/dbraw/zinc/12/19/28/330121928.db2.gz	GKCKKRRQFYXHMA-CYBMUJFWSA-N	0	0	299.773	4.097	20	30		CIEDRN
C=CCCCNC(=O)Nc1c(C)cccc1C(C)C	ZINC000279205934	330122315	/nfs/dbraw/zinc/12/23/15/330122315.db2.gz	VLZGQIBJCASOCE-UHFFFAOYSA-N	0	0	260.381	4.206	20	30		CIEDRN
CC(C)(C#N)CCC[S@](=O)c1ccc2c(c1)CCCC2	ZINC000422099161	330124804	/nfs/dbraw/zinc/12/48/04/330124804.db2.gz	NKDFXARYXUGUGX-FQEVSTJZSA-N	0	0	289.444	4.003	20	30		CIEDRN
C=CCSCC(=O)c1cc(C)n(CCC(C)C)c1C	ZINC000580470968	330144210	/nfs/dbraw/zinc/14/42/10/330144210.db2.gz	HQKBHZHENKXTDY-UHFFFAOYSA-N	0	0	279.449	4.253	20	30		CIEDRN
CC(C)Cc1ccc(C(=O)COc2ccc(C#N)cc2)cc1	ZINC000510292312	332899418	/nfs/dbraw/zinc/89/94/18/332899418.db2.gz	JEHMRRMXRGXFAV-UHFFFAOYSA-N	0	0	293.366	4.018	20	30		CIEDRN
C=CCn1c(S[C@@H]2CCC(C)(C)C2)nnc1C1CC1	ZINC000424097501	330227836	/nfs/dbraw/zinc/22/78/36/330227836.db2.gz	JVMNEGTVIRTZDC-GFCCVEGCSA-N	0	0	277.437	4.012	20	30		CIEDRN
C=CCN[C@H](c1cccc2ccccc21)C(F)(F)F	ZINC000510395407	332901900	/nfs/dbraw/zinc/90/19/00/332901900.db2.gz	JESBTYSWUBHMQN-CQSZACIVSA-N	0	0	265.278	4.219	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(CCCc2ccccc2)no1	ZINC000527196471	330234538	/nfs/dbraw/zinc/23/45/38/330234538.db2.gz	XTWHSQBKDSBOJS-QGZVFWFLSA-N	0	0	270.376	4.099	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1ccc2ccn(C)c2c1	ZINC000527199693	330235814	/nfs/dbraw/zinc/23/58/14/330235814.db2.gz	GRPRTGCPAXFATK-ZDUSSCGKSA-N	0	0	285.391	4.045	20	30		CIEDRN
C[C@@H](NC(=O)C1(C#N)CC(C)C1)c1cc2ccccc2s1	ZINC000527200920	330235872	/nfs/dbraw/zinc/23/58/72/330235872.db2.gz	XTTMGRQIALQLNO-VMBJYNEYSA-N	0	0	298.411	4.018	20	30		CIEDRN
C=CCCC1(C(=O)N(CC)Cc2ccc(C)cc2)CC1	ZINC000527224820	330238950	/nfs/dbraw/zinc/23/89/50/330238950.db2.gz	HAPJJGITVMARLG-UHFFFAOYSA-N	0	0	271.404	4.090	20	30		CIEDRN
C[C@H](Sc1ccc2c(c1)OCCO2)c1cccc(C#N)c1	ZINC000527486249	330249476	/nfs/dbraw/zinc/24/94/76/330249476.db2.gz	DHUOLURRNZHRIK-LBPRGKRZSA-N	0	0	297.379	4.183	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(-c2cccc(Cl)c2)no1	ZINC000527487748	330250659	/nfs/dbraw/zinc/25/06/59/330250659.db2.gz	NXGRLUPYKQYAKD-CQSZACIVSA-N	0	0	262.740	4.244	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc2oc(C(C)C)nc2c1	ZINC000527489420	330251251	/nfs/dbraw/zinc/25/12/51/330251251.db2.gz	ZBDOQUHWQMVZNJ-QGZVFWFLSA-N	0	0	286.375	4.492	20	30		CIEDRN
C[C@@H](Nc1cccc(OCCCC#N)c1)[C@@H]1C[C@H]1C1CC1	ZINC000527641780	330268614	/nfs/dbraw/zinc/26/86/14/330268614.db2.gz	GBVJTTLDSLBNDI-BVGQSLNGSA-N	0	0	284.403	4.216	20	30		CIEDRN
CO[C@@H](CSCc1ccccc1C(C)(C)C#N)C1CC1	ZINC000424148462	330294993	/nfs/dbraw/zinc/29/49/93/330294993.db2.gz	FPAHEMMROSCMJS-INIZCTEOSA-N	0	0	289.444	4.146	20	30		CIEDRN
N#CC1(CNc2nccc3ccccc32)CCCCC1	ZINC000528053062	330306131	/nfs/dbraw/zinc/30/61/31/330306131.db2.gz	GQUPDPZLCTZNGL-UHFFFAOYSA-N	0	0	265.360	4.121	20	30		CIEDRN
CC[C@@H](C)Oc1ccc(NC(=O)C(C#N)(CC)CC)cc1	ZINC000528164619	330310332	/nfs/dbraw/zinc/31/03/32/330310332.db2.gz	MGGFYXSEVCXYCI-CYBMUJFWSA-N	0	0	288.391	4.132	20	30		CIEDRN
CCC(C#N)(CC)c1nc(-c2oc3ccccc3c2C)no1	ZINC000528167204	330310453	/nfs/dbraw/zinc/31/04/53/330310453.db2.gz	QQGMBHGJDQSCHV-UHFFFAOYSA-N	0	0	295.342	4.373	20	30		CIEDRN
C=CC[C@H](C)NC(=O)c1sc2cccc(F)c2c1C	ZINC000116856130	330322755	/nfs/dbraw/zinc/32/27/55/330322755.db2.gz	VXLBMUYPXBBHLB-VIFPVBQESA-N	0	0	277.364	4.043	20	30		CIEDRN
COCc1cccc(CSc2ccc(C#N)cc2F)c1	ZINC000533009995	330323999	/nfs/dbraw/zinc/32/39/99/330323999.db2.gz	FNAOTWZYEIIUNH-UHFFFAOYSA-N	0	0	287.359	4.136	20	30		CIEDRN
Cc1cc(C)c(C#N)c(N[C@@H](C)CCc2ccccc2)n1	ZINC000044289515	330327298	/nfs/dbraw/zinc/32/72/98/330327298.db2.gz	KRUKPPFSVHXLGF-AWEZNQCLSA-N	0	0	279.387	4.003	20	30		CIEDRN
CN(Cc1ccc(Cl)s1)c1cccc(F)c1C#N	ZINC000105790911	330328261	/nfs/dbraw/zinc/32/82/61/330328261.db2.gz	PCPVYHAGQGNUEG-UHFFFAOYSA-N	0	0	280.755	4.049	20	30		CIEDRN
N#Cc1ccc2[nH]c(-c3ccc(C(F)(F)F)cc3)nc2c1	ZINC000105668530	330329517	/nfs/dbraw/zinc/32/95/17/330329517.db2.gz	YSDNRMCRQWJWJH-UHFFFAOYSA-N	0	0	287.244	4.120	20	30		CIEDRN
CCC(C#N)(CC)C(=O)Nc1ccc(Cl)c(Cl)c1	ZINC000044764824	330332925	/nfs/dbraw/zinc/33/29/25/330332925.db2.gz	YEYHHXHGRXETPE-UHFFFAOYSA-N	0	0	285.174	4.262	20	30		CIEDRN
CN(C(=O)C[C@H]1CCCCC1(C)C)c1cccc(C#N)c1	ZINC000533101268	330335765	/nfs/dbraw/zinc/33/57/65/330335765.db2.gz	JDJIAGSHECWDNS-OAHLLOKOSA-N	0	0	284.403	4.128	20	30		CIEDRN
C=CCOc1ccccc1C(=O)Nc1ccccc1Cl	ZINC000045158300	330338805	/nfs/dbraw/zinc/33/88/05/330338805.db2.gz	GYUNMGONMXWDDS-UHFFFAOYSA-N	0	0	287.746	4.157	20	30		CIEDRN
C=CCC1(c2nc([C@H](C)c3nccs3)no2)CCCC1	ZINC000424350105	330345208	/nfs/dbraw/zinc/34/52/08/330345208.db2.gz	ADJPINCSBPVDLN-NSHDSACASA-N	0	0	289.404	4.066	20	30		CIEDRN
C=C(C)C(C)(C)c1nc(-c2ccnc(C(F)(F)F)c2)no1	ZINC000424357539	330346473	/nfs/dbraw/zinc/34/64/73/330346473.db2.gz	DNBFXQJNZNZGLU-UHFFFAOYSA-N	0	0	297.280	4.004	20	30		CIEDRN
COC[C@@H](Nc1ccc(C#N)cc1)c1cccc(Cl)c1	ZINC000580489774	330347368	/nfs/dbraw/zinc/34/73/68/330347368.db2.gz	AQLVFRIOMVGJCY-MRXNPFEDSA-N	0	0	286.762	4.011	20	30		CIEDRN
COC[C@H](Nc1ccc(C#N)cc1)c1cccc(Cl)c1	ZINC000580489773	330347414	/nfs/dbraw/zinc/34/74/14/330347414.db2.gz	AQLVFRIOMVGJCY-INIZCTEOSA-N	0	0	286.762	4.011	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(-c2cnc3ccccc3c2)no1	ZINC000580496526	330350916	/nfs/dbraw/zinc/35/09/16/330350916.db2.gz	PEVQETPQOOOFJI-KRWDZBQOSA-N	0	0	279.343	4.139	20	30		CIEDRN
Cc1cc(CN(C)Cc2cc(C#N)ccc2F)c(C)s1	ZINC000533255702	330354889	/nfs/dbraw/zinc/35/48/89/330354889.db2.gz	XBDKTKBWRYTNNC-UHFFFAOYSA-N	0	0	288.391	4.008	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)CC1CCSCC1	ZINC000137193438	330354995	/nfs/dbraw/zinc/35/49/95/330354995.db2.gz	DPIZFALMHDUELD-UHFFFAOYSA-N	0	0	295.492	4.115	20	30		CIEDRN
C=CCC[C@H](NC(=O)c1cc(C)c(C)o1)c1ccccc1	ZINC000533261310	330355794	/nfs/dbraw/zinc/35/57/94/330355794.db2.gz	BATWBNITJLEPMQ-INIZCTEOSA-N	0	0	283.371	4.334	20	30		CIEDRN
Cc1c(CNCc2ccc(C#N)cc2F)oc2ccccc12	ZINC000533308817	330356816	/nfs/dbraw/zinc/35/68/16/330356816.db2.gz	NDRJMMCEZYZRBM-UHFFFAOYSA-N	0	0	294.329	4.042	20	30		CIEDRN
C=C(CC)CSCC(=O)N[C@@H](C)c1ccc(Cl)cc1	ZINC000536880812	330358274	/nfs/dbraw/zinc/35/82/74/330358274.db2.gz	FPXDLCFUNNUUNL-LBPRGKRZSA-N	0	0	297.851	4.217	20	30		CIEDRN
C=C(CC)CNc1ccc(C(=O)N(CC)CC)c(Cl)c1	ZINC000536881805	330360763	/nfs/dbraw/zinc/36/07/63/330360763.db2.gz	PPXLMKQXVATJAR-UHFFFAOYSA-N	0	0	294.826	4.200	20	30		CIEDRN
C=C(CC)CSCc1csc(-c2ccccn2)n1	ZINC000536881190	330360835	/nfs/dbraw/zinc/36/08/35/330360835.db2.gz	KRNRRMWIQXJOEB-UHFFFAOYSA-N	0	0	276.430	4.405	20	30		CIEDRN
C=C(CC)CS[C@@H](C)C(=O)N[C@@H](C)c1ccccc1C	ZINC000536881911	330360853	/nfs/dbraw/zinc/36/08/53/330360853.db2.gz	PJWAPYMPZYKRTQ-GJZGRUSLSA-N	0	0	291.460	4.260	20	30		CIEDRN
C=C(CC)CSCCC(=O)NCc1ccccc1Cl	ZINC000536882143	330360901	/nfs/dbraw/zinc/36/09/01/330360901.db2.gz	SNKVJNKIKQQUDT-UHFFFAOYSA-N	0	0	297.851	4.046	20	30		CIEDRN
C=C(CC)Cn1c2ccccc2nc1C(F)(F)F	ZINC000536882325	330360919	/nfs/dbraw/zinc/36/09/19/330360919.db2.gz	WSZHBBDYUWAOPF-UHFFFAOYSA-N	0	0	254.255	4.021	20	30		CIEDRN
C=C(CC)CSCCC(=O)Nc1ccc(OCC)cc1	ZINC000536882758	330360982	/nfs/dbraw/zinc/36/09/82/330360982.db2.gz	ZXSDVDLJVXNPFJ-UHFFFAOYSA-N	0	0	293.432	4.113	20	30		CIEDRN
C=CCCCS[C@@H](C)c1nc(C(C)(C)C)no1	ZINC000117943610	330366577	/nfs/dbraw/zinc/36/65/77/330366577.db2.gz	ZELWPDMWMXJATM-JTQLQIEISA-N	0	0	254.399	4.128	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N(C)[C@@H](C)c1ccccc1Cl	ZINC000116972639	330362847	/nfs/dbraw/zinc/36/28/47/330362847.db2.gz	IQUPTLVQNIABAH-NEPJUHHUSA-N	0	0	280.799	4.007	20	30		CIEDRN
C=C(CC)CSc1nnc(-c2ccc(C)cc2C)o1	ZINC000536905836	330363686	/nfs/dbraw/zinc/36/36/86/330363686.db2.gz	RSUIBKYIUFFFMF-UHFFFAOYSA-N	0	0	274.389	4.412	20	30		CIEDRN
C=C(CC)CSc1nnc(-c2ccco2)n1CC(C)C	ZINC000536903625	330363693	/nfs/dbraw/zinc/36/36/93/330363693.db2.gz	FNRBLBMXDCYMIE-UHFFFAOYSA-N	0	0	291.420	4.252	20	30		CIEDRN
C=CCN(C(=O)c1cc2cc(F)ccc2o1)c1ccccc1	ZINC000117593555	330365469	/nfs/dbraw/zinc/36/54/69/330365469.db2.gz	JZKCPEQHSMSUPH-UHFFFAOYSA-N	0	0	295.313	4.405	20	30		CIEDRN
CCc1ccsc1C(=O)Nc1ccc(Cl)c(C#N)c1	ZINC000117587046	330365563	/nfs/dbraw/zinc/36/55/63/330365563.db2.gz	JOQJYRNKXHRWOC-UHFFFAOYSA-N	0	0	290.775	4.088	20	30		CIEDRN
C[C@H](Sc1ccc([N+](=O)[O-])cc1)c1ccc(C#N)cc1	ZINC000118445232	330367195	/nfs/dbraw/zinc/36/71/95/330367195.db2.gz	UQVDWNJHTXEZNK-NSHDSACASA-N	0	0	284.340	4.320	20	30		CIEDRN
N#Cc1ccc(OCCCCC(F)(F)F)c(Cl)c1	ZINC000118999684	330368688	/nfs/dbraw/zinc/36/86/88/330368688.db2.gz	XVPVBUKXBXKEPD-UHFFFAOYSA-N	0	0	277.673	4.323	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@H](C)c1ccccc1	ZINC000119034352	330368746	/nfs/dbraw/zinc/36/87/46/330368746.db2.gz	BTYBLJBSSHILQF-CQSZACIVSA-N	0	0	285.412	4.066	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)c1cccc(C)c1Cl	ZINC000119291766	330371770	/nfs/dbraw/zinc/37/17/70/330371770.db2.gz	XUXVHQRKLQIOBG-UHFFFAOYSA-N	0	0	292.810	4.241	20	30		CIEDRN
Cc1nc(Cc2nc(-c3ccc(C#N)cc3)cs2)cs1	ZINC000057359192	330374238	/nfs/dbraw/zinc/37/42/38/330374238.db2.gz	KCBQDTDSYHDXPT-UHFFFAOYSA-N	0	0	297.408	4.038	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N(CC)Cc1ccc(Cl)s1	ZINC000424554541	330374793	/nfs/dbraw/zinc/37/47/93/330374793.db2.gz	CEFJOJSHQLXDCO-UHFFFAOYSA-N	0	0	285.840	4.352	20	30		CIEDRN
CC[C@@]1(C)C[C@@H]1C(=O)Nc1cc(C(C)(C)C)sc1C#N	ZINC000536972251	330374880	/nfs/dbraw/zinc/37/48/80/330374880.db2.gz	IILVKQJDQYWASO-HWPZZCPQSA-N	0	0	290.432	4.292	20	30		CIEDRN
C=CCCC[C@@H](C)N1CCO[C@H](c2ccc(F)c(F)c2)C1	ZINC000536995102	330375405	/nfs/dbraw/zinc/37/54/05/330375405.db2.gz	ODXUIRKLNFXTKM-DYVFJYSZSA-N	0	0	295.373	4.083	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@@H](C)c1ccc(OC(F)F)cc1	ZINC000424561976	330376161	/nfs/dbraw/zinc/37/61/61/330376161.db2.gz	JVKCNLFJDGNUBM-NSHDSACASA-N	0	0	297.345	4.068	20	30		CIEDRN
N#Cc1c(F)cccc1Sc1cc(F)ccc1F	ZINC000057680772	330378244	/nfs/dbraw/zinc/37/82/44/330378244.db2.gz	BAWZEBATUMWNPY-UHFFFAOYSA-N	0	0	265.259	4.127	20	30		CIEDRN
C[C@H](c1ccc(Cl)cc1Cl)N1CCC(C#N)CC1	ZINC000057872728	330379238	/nfs/dbraw/zinc/37/92/38/330379238.db2.gz	ZENXMBYZLLYFHC-SNVBAGLBSA-N	0	0	283.202	4.290	20	30		CIEDRN
CCC(CC)CC(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000119855913	330380503	/nfs/dbraw/zinc/38/05/03/330380503.db2.gz	OARHRQJFTCPPBR-UHFFFAOYSA-N	0	0	272.392	4.253	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@H]1CCCC[C@@H]1C	ZINC000424569809	330380653	/nfs/dbraw/zinc/38/06/53/330380653.db2.gz	VMOSWTBLMOTKIF-ZFWWWQNUSA-N	0	0	277.433	4.089	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1cc(-c2ncco2)ccc1C	ZINC000089335666	330383311	/nfs/dbraw/zinc/38/33/11/330383311.db2.gz	VRGZFEBKAWRIJV-UHFFFAOYSA-N	0	0	299.374	4.080	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000424574472	330384890	/nfs/dbraw/zinc/38/48/90/330384890.db2.gz	JWYNFLJBZCHPAC-UHFFFAOYSA-N	0	0	270.376	4.029	20	30		CIEDRN
Cc1nc(SCC#Cc2ccccc2Cl)oc1C	ZINC000162812512	330388964	/nfs/dbraw/zinc/38/89/64/330388964.db2.gz	PUIRNPGDRBOYFR-UHFFFAOYSA-N	0	0	277.776	4.089	20	30		CIEDRN
N#Cc1ccc(CNc2cccc(-c3nccs3)c2)s1	ZINC000120780161	330391301	/nfs/dbraw/zinc/39/13/01/330391301.db2.gz	CHTRTCXXZKKTMG-UHFFFAOYSA-N	0	0	297.408	4.355	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@@H]1CCc2c1cccc2Cl	ZINC000424591707	330394187	/nfs/dbraw/zinc/39/41/87/330394187.db2.gz	AMQRHXCEUYYITM-CQSZACIVSA-N	0	0	277.795	4.046	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cc(Cl)ccc1C	ZINC000121057250	330394232	/nfs/dbraw/zinc/39/42/32/330394232.db2.gz	VQRKCCYAPFSJRC-UHFFFAOYSA-N	0	0	263.768	4.355	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H](C)c1ccc(Cl)cc1	ZINC000121274110	330399110	/nfs/dbraw/zinc/39/91/10/330399110.db2.gz	SBWHDSWGLFVURF-GFCCVEGCSA-N	0	0	277.795	4.286	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N[C@H](c1ccccc1)C1CC1	ZINC000537184942	330412531	/nfs/dbraw/zinc/41/25/31/330412531.db2.gz	KLWQXLVJCUZXKC-WMLDXEAASA-N	0	0	286.419	4.182	20	30		CIEDRN
N#Cc1ccc(NCc2ccccc2C(F)(F)F)c(F)c1	ZINC000060941543	330427224	/nfs/dbraw/zinc/42/72/24/330427224.db2.gz	AXHVRNFMPHCIPN-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)CSc1ccccc1Cl	ZINC000537232618	330429741	/nfs/dbraw/zinc/42/97/41/330429741.db2.gz	QXVNLSXNUQGLHZ-GFCCVEGCSA-N	0	0	297.851	4.293	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)CCCc1cc(F)ccc1F	ZINC000537229756	330429772	/nfs/dbraw/zinc/42/97/72/330429772.db2.gz	PNMDAVLRZDPGMD-CYBMUJFWSA-N	0	0	295.373	4.149	20	30		CIEDRN
CCN(CCC(C)(C)C#N)c1cccc(Cl)c1	ZINC000537363303	330434098	/nfs/dbraw/zinc/43/40/98/330434098.db2.gz	NAEOWJYPYBCSOZ-UHFFFAOYSA-N	0	0	250.773	4.106	20	30		CIEDRN
N#CCCCOc1cccc(N[C@H]2CCC[C@@H]2C2CC2)c1	ZINC000537428135	330436638	/nfs/dbraw/zinc/43/66/38/330436638.db2.gz	RGJCIRDVLIKBJW-MSOLQXFVSA-N	0	0	284.403	4.360	20	30		CIEDRN
N#Cc1cc(NC(=O)c2ccc3ccccc3c2)ccc1F	ZINC000314915076	330466695	/nfs/dbraw/zinc/46/66/95/330466695.db2.gz	OTVFFXXYFKBZGC-UHFFFAOYSA-N	0	0	290.297	4.103	20	30		CIEDRN
CN(C(=O)[C@@H]1CCC[C@H]2CCCC[C@@H]21)c1ccc(C#N)cc1	ZINC000515327316	330475060	/nfs/dbraw/zinc/47/50/60/330475060.db2.gz	MXQVHWVJHZEDSL-BPQIPLTHSA-N	0	0	296.414	4.128	20	30		CIEDRN
CC[C@H](C)Oc1cccc(NCc2ccc(C#N)cc2F)c1	ZINC000315422482	330475919	/nfs/dbraw/zinc/47/59/19/330475919.db2.gz	JZMWKQILDRAQNZ-ZDUSSCGKSA-N	0	0	298.361	4.487	20	30		CIEDRN
Cc1ccc(C)c(OCCCSc2ccc(C#N)cn2)c1	ZINC000515363698	330476081	/nfs/dbraw/zinc/47/60/81/330476081.db2.gz	MYOTYSQVEISNMT-UHFFFAOYSA-N	0	0	298.411	4.131	20	30		CIEDRN
Cc1cc(C)c(C#N)c(N[C@H](C)c2c(F)cccc2F)n1	ZINC000515501944	330478633	/nfs/dbraw/zinc/47/86/33/330478633.db2.gz	XTGOHHOLRSATLK-LLVKDONJSA-N	0	0	287.313	4.021	20	30		CIEDRN
N#Cc1ccc(NCCOc2cccc3ccccc32)cc1	ZINC000515501584	330478641	/nfs/dbraw/zinc/47/86/41/330478641.db2.gz	JDVQHFQTRFTIHI-UHFFFAOYSA-N	0	0	288.350	4.202	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)c1cc(Cl)ccc1SCC	ZINC000084189662	330485075	/nfs/dbraw/zinc/48/50/75/330485075.db2.gz	RMBKMLYYLMROKS-SNVBAGLBSA-N	0	0	283.824	4.146	20	30		CIEDRN
C=CCCC(=O)CSc1ccc(Br)cc1	ZINC000085079868	330488304	/nfs/dbraw/zinc/48/83/04/330488304.db2.gz	OEZGYCMDICNEFX-UHFFFAOYSA-N	0	0	285.206	4.077	20	30		CIEDRN
C[C@@H](CC#N)N(C)C(=O)Nc1ccccc1-c1ccccc1	ZINC000086280542	330494545	/nfs/dbraw/zinc/49/45/45/330494545.db2.gz	CYLOEIONPSGHLU-AWEZNQCLSA-N	0	0	293.370	4.119	20	30		CIEDRN
CC[C@H](NC(=O)Nc1ccc(C#N)cc1Cl)C(C)(C)C	ZINC000426124775	330499961	/nfs/dbraw/zinc/49/99/61/330499961.db2.gz	VUPQBJRYFPCHJL-ZDUSSCGKSA-N	0	0	293.798	4.158	20	30		CIEDRN
C=CCC(C)(C)c1nc(CCCc2ccccc2)no1	ZINC000426458713	330510337	/nfs/dbraw/zinc/51/03/37/330510337.db2.gz	JCXOLMGEDICEEU-UHFFFAOYSA-N	0	0	270.376	4.099	20	30		CIEDRN
CC(C)(C)c1ccc(CC(=O)Nc2ccccc2C#N)cc1	ZINC000428354719	330521248	/nfs/dbraw/zinc/52/12/48/330521248.db2.gz	LOBAGWSIZNQPBG-UHFFFAOYSA-N	0	0	292.382	4.037	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N(C)Cc1cc(C)ccc1C	ZINC000428954818	330535342	/nfs/dbraw/zinc/53/53/42/330535342.db2.gz	SLCIETVBAXLAHA-MRXNPFEDSA-N	0	0	288.435	4.190	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCc1cccc(OCCCC)c1	ZINC000429841542	330555637	/nfs/dbraw/zinc/55/56/37/330555637.db2.gz	RFYZRMGSIDIMDG-UHFFFAOYSA-N	0	0	289.419	4.084	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H]1CCc2cc(Cl)ccc21	ZINC000429901652	330556205	/nfs/dbraw/zinc/55/62/05/330556205.db2.gz	VENUHBLGHKULHE-AWEZNQCLSA-N	0	0	277.795	4.046	20	30		CIEDRN
N#C[C@@H]1CC[C@H](S[C@H]2CCCc3ccccc32)C1	ZINC000430091949	330559682	/nfs/dbraw/zinc/55/96/82/330559682.db2.gz	VORKJOGQEBGPPQ-INWMFGNUSA-N	0	0	257.402	4.489	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N[C@H]1CC12CCCC2	ZINC000430238793	330565045	/nfs/dbraw/zinc/56/50/45/330565045.db2.gz	JAPBTNUEUWPJEQ-HNNXBMFYSA-N	0	0	287.428	4.027	20	30		CIEDRN
CCC[C@H](CC1CCCCC1)C(=O)NCC1(CC#N)CC1	ZINC000431173742	330581034	/nfs/dbraw/zinc/58/10/34/330581034.db2.gz	VCOYDLKWZTXFKZ-MRXNPFEDSA-N	0	0	290.451	4.183	20	30		CIEDRN
C=C(CC)COc1ccc(-c2c(C)noc2C)cc1	ZINC000432310544	330597178	/nfs/dbraw/zinc/59/71/78/330597178.db2.gz	BXOBVVLUPNSXIQ-UHFFFAOYSA-N	0	0	257.333	4.303	20	30		CIEDRN
CCCc1csc(CNc2ccc(Cl)c(C#N)c2)n1	ZINC000432416766	330598890	/nfs/dbraw/zinc/59/88/90/330598890.db2.gz	INKCHDIYXISFQK-UHFFFAOYSA-N	0	0	291.807	4.233	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCc1cc(C)cc2c(C)c(C)[nH]c21	ZINC000432785076	330606679	/nfs/dbraw/zinc/60/66/79/330606679.db2.gz	RPIOKMHCBXUVOE-UHFFFAOYSA-N	0	0	298.430	4.312	20	30		CIEDRN
N#Cc1ccc(NCc2cc(F)c(Cl)cc2F)cc1	ZINC000432932981	330610880	/nfs/dbraw/zinc/61/08/80/330610880.db2.gz	RTRRAFVQEYDBRY-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
Cc1cccc(C)c1C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000151500719	330611614	/nfs/dbraw/zinc/61/16/14/330611614.db2.gz	FFXLDOLQTVASGU-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
CN(Cc1csc(C2CCCCC2)n1)CC(C)(C)C#N	ZINC000433300402	330623817	/nfs/dbraw/zinc/62/38/17/330623817.db2.gz	DZPFNBNBOPQISR-UHFFFAOYSA-N	0	0	291.464	4.172	20	30		CIEDRN
CCCC[C@H](CC)CC(=O)N1CCCC(C)(C)[C@H]1C#N	ZINC000434032595	330634643	/nfs/dbraw/zinc/63/46/43/330634643.db2.gz	RHQOEMMNOURERR-LSDHHAIUSA-N	0	0	278.440	4.134	20	30		CIEDRN
CC(C)(C#N)CCCC[S@@](=O)CC1CCCCC1	ZINC000435422890	330654611	/nfs/dbraw/zinc/65/46/11/330654611.db2.gz	QKEFZQOIQFAHMM-GOSISDBHSA-N	0	0	269.454	4.035	20	30		CIEDRN
C=CCN(CC=C)C(=O)c1cccc2c1ccn2CC(C)C	ZINC000435142739	330650163	/nfs/dbraw/zinc/65/01/63/330650163.db2.gz	XUGCQKYWHWZOPU-UHFFFAOYSA-N	0	0	296.414	4.112	20	30		CIEDRN
COc1cccc([C@H](C)Sc2ccccc2C#N)c1	ZINC000435228805	330650969	/nfs/dbraw/zinc/65/09/69/330650969.db2.gz	CIGKHLIJZVCRRV-LBPRGKRZSA-N	0	0	269.369	4.420	20	30		CIEDRN
C=CCC[C@@H](NC(=O)[C@@H](C)C(F)(F)F)c1ccccc1	ZINC000435290464	330652507	/nfs/dbraw/zinc/65/25/07/330652507.db2.gz	REECFEZOZXAUKX-DGCLKSJQSA-N	0	0	285.309	4.009	20	30		CIEDRN
C=CCC[C@H](NC(=O)Cc1ccc(C)s1)c1ccccc1	ZINC000435298683	330652545	/nfs/dbraw/zinc/65/25/45/330652545.db2.gz	YXQDAVDBBBUZPC-KRWDZBQOSA-N	0	0	299.439	4.423	20	30		CIEDRN
CC(C)(C)c1ccc(NC(=O)[C@]2(C#N)CC23CCCC3)cc1	ZINC000448555469	330652560	/nfs/dbraw/zinc/65/25/60/330652560.db2.gz	AYBDRCYZCHPFCQ-LJQANCHMSA-N	0	0	296.414	4.397	20	30		CIEDRN
C=CCC[C@@H](NC(=O)[C@H]1Cc2ccccc21)c1ccccc1	ZINC000435301959	330652638	/nfs/dbraw/zinc/65/26/38/330652638.db2.gz	KTQFZZDRAZTHTD-RBUKOAKNSA-N	0	0	291.394	4.150	20	30		CIEDRN
C=CCC[C@@H](NC(=O)Cc1ccc(C)s1)c1ccccc1	ZINC000435298684	330652640	/nfs/dbraw/zinc/65/26/40/330652640.db2.gz	YXQDAVDBBBUZPC-QGZVFWFLSA-N	0	0	299.439	4.423	20	30		CIEDRN
CC(C)(C)CN(CCC#N)C(=O)CC1(C)CCCCC1	ZINC000510478701	332905072	/nfs/dbraw/zinc/90/50/72/332905072.db2.gz	XMLNBIVFEVSRMQ-UHFFFAOYSA-N	0	0	278.440	4.135	20	30		CIEDRN
Cc1nc(C(C)C)oc1COc1ccc(C#N)cc1Cl	ZINC000436473871	330678086	/nfs/dbraw/zinc/67/80/86/330678086.db2.gz	ITOKFPGLQMLEMZ-UHFFFAOYSA-N	0	0	290.750	4.211	20	30		CIEDRN
C=CCCSCc1ccc2oc(C(=O)OC)cc2c1	ZINC000437257410	330696097	/nfs/dbraw/zinc/69/60/97/330696097.db2.gz	HZAUKIKZPVLYFE-UHFFFAOYSA-N	0	0	276.357	4.029	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@@H]1C[C@H]1c1ccc2ccccc2c1	ZINC000437288349	330697171	/nfs/dbraw/zinc/69/71/71/330697171.db2.gz	MVMBDLVGHMKSOO-NSHGMRRFSA-N	0	0	293.410	4.414	20	30		CIEDRN
N#Cc1ccc(SCc2cc(F)ccc2Cl)nc1	ZINC000437620572	330705254	/nfs/dbraw/zinc/70/52/54/330705254.db2.gz	MPMQBBYFCRRQPO-UHFFFAOYSA-N	0	0	278.739	4.038	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CCCC[C@H]1OCCC(C)C	ZINC000438030837	330713883	/nfs/dbraw/zinc/71/38/83/330713883.db2.gz	UGXYOFJFMHCSJG-BRWVUGGUSA-N	0	0	295.467	4.079	20	30		CIEDRN
C=CCN(C)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000156071127	330718039	/nfs/dbraw/zinc/71/80/39/330718039.db2.gz	KACQKGYZEDIWNN-UHFFFAOYSA-N	0	0	282.343	4.129	20	30		CIEDRN
Cc1ccc([N+](=O)[O-])c(N[C@H](CCC#N)c2ccccc2)c1	ZINC000439105712	330733954	/nfs/dbraw/zinc/73/39/54/330733954.db2.gz	JIJKXSHSVKAZPG-OAHLLOKOSA-N	0	0	295.342	4.360	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@H]1CCSc2ccc(Cl)cc21	ZINC000448615839	330737071	/nfs/dbraw/zinc/73/70/71/330737071.db2.gz	YCBFVPUIZFWWEX-LBPRGKRZSA-N	0	0	295.835	4.205	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1cc(C)cc2cccnc21	ZINC000439424249	330738069	/nfs/dbraw/zinc/73/80/69/330738069.db2.gz	PAIHTKCLCKIDQL-CQSZACIVSA-N	0	0	283.375	4.019	20	30		CIEDRN
Cc1cscc1NC(=O)Nc1ccc(C#N)cc1Cl	ZINC000439497754	330739714	/nfs/dbraw/zinc/73/97/14/330739714.db2.gz	VWBXVFBKYMBSCI-UHFFFAOYSA-N	0	0	291.763	4.226	20	30		CIEDRN
C[C@H](CCC(=O)Nc1cccc(C#N)c1)c1ccccc1	ZINC000441296811	330765232	/nfs/dbraw/zinc/76/52/32/330765232.db2.gz	YBEJEVPAHNMITP-CQSZACIVSA-N	0	0	278.355	4.081	20	30		CIEDRN
C[C@@H](CCC(=O)Nc1ccc(C#N)cc1)c1ccccc1	ZINC000441296258	330765246	/nfs/dbraw/zinc/76/52/46/330765246.db2.gz	WCQFSTZGJAYKCZ-AWEZNQCLSA-N	0	0	278.355	4.081	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cc(Cl)cc(F)c1F	ZINC000441571663	330770958	/nfs/dbraw/zinc/77/09/58/330770958.db2.gz	LOISMQZAAWWWLT-UHFFFAOYSA-N	0	0	285.721	4.325	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cc(Cl)cc(F)c1F	ZINC000441579721	330771079	/nfs/dbraw/zinc/77/10/79/330771079.db2.gz	FBEVNWNBYBIZKM-ZDUSSCGKSA-N	0	0	273.710	4.159	20	30		CIEDRN
N#C[C@@H]1CC[C@@H](Nc2ccccc2OC2CCCC2)C1	ZINC000442849415	330786779	/nfs/dbraw/zinc/78/67/79/330786779.db2.gz	GXUBKABJYVIOHN-ZIAGYGMSSA-N	0	0	270.376	4.112	20	30		CIEDRN
Cc1ccc(N[C@H]2CC[C@@H](C#N)C2)cc1NC(=O)C(C)(C)C	ZINC000442859377	330787824	/nfs/dbraw/zinc/78/78/24/330787824.db2.gz	VDIPTGVPZVSHGC-KGLIPLIRSA-N	0	0	299.418	4.084	20	30		CIEDRN
N#C[C@@H]1CC[C@@H](Nc2ccc(CCC(F)(F)F)cc2)C1	ZINC000442867120	330788610	/nfs/dbraw/zinc/78/86/10/330788610.db2.gz	XUFAXMABCBNLQX-TZMCWYRMSA-N	0	0	282.309	4.286	20	30		CIEDRN
C[C@@H](Sc1ccc(C#N)cc1F)c1cccc(C#N)c1	ZINC000442922607	330791511	/nfs/dbraw/zinc/79/15/11/330791511.db2.gz	UJNFJAKIYAILBK-LLVKDONJSA-N	0	0	282.343	4.422	20	30		CIEDRN
N#Cc1cc(Cl)ccc1NCc1ccc2c(n1)CCCC2	ZINC000443958394	330807795	/nfs/dbraw/zinc/80/77/95/330807795.db2.gz	GLMCGXIEVCWEFN-UHFFFAOYSA-N	0	0	297.789	4.098	20	30		CIEDRN
Cc1nc2ccc(NCc3ccc(C#N)c(C)c3)cc2s1	ZINC000443977815	330808285	/nfs/dbraw/zinc/80/82/85/330808285.db2.gz	IFRHVIZMYAXNBT-UHFFFAOYSA-N	0	0	293.395	4.397	20	30		CIEDRN
Cc1cc(CNc2ccccc2OC(F)F)ccc1C#N	ZINC000443989358	330808549	/nfs/dbraw/zinc/80/85/49/330808549.db2.gz	OMCFPYUKPIQGPV-UHFFFAOYSA-N	0	0	288.297	4.080	20	30		CIEDRN
C=CCC(CC=C)c1nc(-c2ccc(C(C)C)nc2)no1	ZINC000445519712	330830557	/nfs/dbraw/zinc/83/05/57/330830557.db2.gz	PQRVAZXXPHQASQ-UHFFFAOYSA-N	0	0	283.375	4.491	20	30		CIEDRN
N#Cc1ccc(/C=C\c2nc(-c3ccc(Cl)o3)no2)cc1	ZINC000445601978	330832691	/nfs/dbraw/zinc/83/26/91/330832691.db2.gz	UCWYTBXSFWLSJC-YVMONPNESA-N	0	0	297.701	4.025	20	30		CIEDRN
C=CCCOCCCCc1nc(-c2cscc2C)no1	ZINC000445639540	330833798	/nfs/dbraw/zinc/83/37/98/330833798.db2.gz	HIVFJLPLWXVFFH-UHFFFAOYSA-N	0	0	292.404	4.022	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1ccc2cc[nH]c2c1	ZINC000194310800	330840941	/nfs/dbraw/zinc/84/09/41/330840941.db2.gz	OIHAMQUBPPNTHS-GFCCVEGCSA-N	0	0	271.364	4.034	20	30		CIEDRN
CC(C)C[C@@H](C)CC(=O)N(Cc1ccc(C#N)cc1)C1CC1	ZINC000171408392	330845787	/nfs/dbraw/zinc/84/57/87/330845787.db2.gz	HOUJZQLADGCERW-OAHLLOKOSA-N	0	0	298.430	4.122	20	30		CIEDRN
C=CCCCC(=O)N1CC(C)(C)Sc2ccccc21	ZINC000446430073	330848802	/nfs/dbraw/zinc/84/88/02/330848802.db2.gz	RVBQJPYSLCBDJH-UHFFFAOYSA-N	0	0	275.417	4.260	20	30		CIEDRN
Cc1cccc(C)c1NCc1cn2ccccc2c1C#N	ZINC000446620196	330851085	/nfs/dbraw/zinc/85/10/85/330851085.db2.gz	NKEKRUKWKZSYPW-UHFFFAOYSA-N	0	0	275.355	4.040	20	30		CIEDRN
Cc1c(C#N)cccc1NCc1cnc(-c2ccco2)s1	ZINC000194471887	330853303	/nfs/dbraw/zinc/85/33/03/330853303.db2.gz	YVBMVUMRXAIQDT-UHFFFAOYSA-N	0	0	295.367	4.195	20	30		CIEDRN
C=CCOc1ccccc1CNc1ccc(F)c(OC)c1	ZINC000160143134	330859753	/nfs/dbraw/zinc/85/97/53/330859753.db2.gz	CXKSBHQXIUXBCP-UHFFFAOYSA-N	0	0	287.334	4.011	20	30		CIEDRN
Cc1ccc([N+](=O)[O-])c(Sc2ccc(C#N)cc2F)c1	ZINC000447044869	330859992	/nfs/dbraw/zinc/85/99/92/330859992.db2.gz	PXFUCDDZQGEYEK-UHFFFAOYSA-N	0	0	288.303	4.065	20	30		CIEDRN
Cc1cc(CSc2ncc(C(C)C)n2C)ccc1C#N	ZINC000447291888	330863622	/nfs/dbraw/zinc/86/36/22/330863622.db2.gz	HLSDKNMBVWRBDI-UHFFFAOYSA-N	0	0	285.416	4.016	20	30		CIEDRN
C=CCCCCCOc1cc(OC)c(C(C)=O)cc1OC	ZINC000447296029	330863725	/nfs/dbraw/zinc/86/37/25/330863725.db2.gz	RUPYHEWOCOIQCD-UHFFFAOYSA-N	0	0	292.375	4.032	20	30		CIEDRN
Cc1ccc2oc(SCc3ccc(C#N)c(C)c3)nc2n1	ZINC000447305476	330863982	/nfs/dbraw/zinc/86/39/82/330863982.db2.gz	LTOGHPAEUOIHPQ-UHFFFAOYSA-N	0	0	295.367	4.004	20	30		CIEDRN
C=CCCCCCSc1nncc2ccccc21	ZINC000447311972	330864304	/nfs/dbraw/zinc/86/43/04/330864304.db2.gz	JSSQCEDJVCWCAZ-UHFFFAOYSA-N	0	0	258.390	4.468	20	30		CIEDRN
Cc1nc2ccc(N[C@H]3CCC[C@@H](C#N)C3)cc2s1	ZINC000447589933	330872020	/nfs/dbraw/zinc/87/20/20/330872020.db2.gz	ZGFOCAIZGHUKOD-NEPJUHHUSA-N	0	0	271.389	4.099	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)C(C1CC1)C1CC1	ZINC000510570490	332906905	/nfs/dbraw/zinc/90/69/05/332906905.db2.gz	NACCJCHWUPPTNU-UHFFFAOYSA-N	0	0	275.436	4.018	20	30		CIEDRN
Cc1cccc(OCc2ccc(CC#N)cc2)c1Cl	ZINC000447792814	330876773	/nfs/dbraw/zinc/87/67/73/330876773.db2.gz	AAMQBSAOFCYKSW-UHFFFAOYSA-N	0	0	271.747	4.294	20	30		CIEDRN
C=CCCCNC(=O)Nc1c(F)cc(Cl)c(C)c1F	ZINC000447993311	330882379	/nfs/dbraw/zinc/88/23/79/330882379.db2.gz	QWJQZQREXMGWIB-UHFFFAOYSA-N	0	0	288.725	4.014	20	30		CIEDRN
C=CCCCNC(=O)Nc1cccc(C(F)F)c1Cl	ZINC000447997585	330882595	/nfs/dbraw/zinc/88/25/95/330882595.db2.gz	DXKDNFJJPOKWKD-UHFFFAOYSA-N	0	0	288.725	4.365	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@H](C)CC(C)(C)c1ccccc1	ZINC000448807455	330884404	/nfs/dbraw/zinc/88/44/04/330884404.db2.gz	ZDXMYGMUSBRLAZ-CQSZACIVSA-N	0	0	273.420	4.071	20	30		CIEDRN
CC1(C#N)CCC(Nc2cccc(COCC3CC3)c2)CC1	ZINC000449042785	330894816	/nfs/dbraw/zinc/89/48/16/330894816.db2.gz	TYNOGMZXHBPIHP-UHFFFAOYSA-N	0	0	298.430	4.498	20	30		CIEDRN
CC1(C#N)CCC(Nc2cccc(OCCCC#N)c2)CC1	ZINC000449041995	330894837	/nfs/dbraw/zinc/89/48/37/330894837.db2.gz	PHNQMPDRLDBDHY-UHFFFAOYSA-N	0	0	297.402	4.254	20	30		CIEDRN
C=CCC1(C(=O)Nc2cc(F)ccc2C)CCCC1	ZINC000449057480	330895895	/nfs/dbraw/zinc/89/58/95/330895895.db2.gz	CJLQRDWCRMTAKC-UHFFFAOYSA-N	0	0	261.340	4.209	20	30		CIEDRN
C=CCCCC[C@@H](C)Nc1cnn(C2CCOCC2)c1C	ZINC000449368351	330919222	/nfs/dbraw/zinc/91/92/22/330919222.db2.gz	HMVQHEAIJBQQEZ-CQSZACIVSA-N	0	0	291.439	4.090	20	30		CIEDRN
N#C[C@@H]1CCC[C@H](Nc2ccc3c(c2)CCCC3)C1	ZINC000449414948	330923822	/nfs/dbraw/zinc/92/38/22/330923822.db2.gz	YZTIDMSCLMKZFH-CJNGLKHVSA-N	0	0	254.377	4.060	20	30		CIEDRN
CC(F)(F)c1ccccc1N[C@H]1CCC[C@@H](C#N)C1	ZINC000449471918	330928390	/nfs/dbraw/zinc/92/83/90/330928390.db2.gz	PPSCTRVAGOFGOA-NEPJUHHUSA-N	0	0	264.319	4.293	20	30		CIEDRN
C=CCCCC[C@H](C)Nc1cccc(NC(=O)N(C)C)c1	ZINC000449560638	330936631	/nfs/dbraw/zinc/93/66/31/330936631.db2.gz	NWUYMYFAPKTWTH-AWEZNQCLSA-N	0	0	289.423	4.327	20	30		CIEDRN
Cc1ccccc1C[C@H](C)Nc1cccc(CC#N)c1	ZINC000449693525	330943924	/nfs/dbraw/zinc/94/39/24/330943924.db2.gz	DXHPVGQRFGULRJ-HNNXBMFYSA-N	0	0	264.372	4.104	20	30		CIEDRN
CC(C)Cc1ncc(CNc2cccc(CC#N)c2)s1	ZINC000449692682	330943925	/nfs/dbraw/zinc/94/39/25/330943925.db2.gz	BZXZKPWPYSHMQY-UHFFFAOYSA-N	0	0	285.416	4.020	20	30		CIEDRN
N#CCc1cccc(NCc2ccc(OCC3CC3)cc2)c1	ZINC000449694478	330944099	/nfs/dbraw/zinc/94/40/99/330944099.db2.gz	GQGAIDHHIXFOSI-UHFFFAOYSA-N	0	0	292.382	4.154	20	30		CIEDRN
C[C@H](Nc1cccc(CC#N)c1)[C@@H](C)c1ccccc1	ZINC000449695117	330944264	/nfs/dbraw/zinc/94/42/64/330944264.db2.gz	HUFUKGMVESIKHK-CABCVRRESA-N	0	0	264.372	4.357	20	30		CIEDRN
Cc1cc(C#N)cc(NCc2ncc(C(C)C)s2)c1	ZINC000449756524	330948243	/nfs/dbraw/zinc/94/82/43/330948243.db2.gz	BJAZSAMIBYVNOW-UHFFFAOYSA-N	0	0	271.389	4.059	20	30		CIEDRN
Cc1cc(C#N)cc(NCc2cnc(C3CCC3)s2)c1	ZINC000449760009	330948278	/nfs/dbraw/zinc/94/82/78/330948278.db2.gz	LEYZKSXFJUAMMS-UHFFFAOYSA-N	0	0	283.400	4.203	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1cc2cccnc2s1	ZINC000449912017	330954545	/nfs/dbraw/zinc/95/45/45/330954545.db2.gz	DGXKOSKTJGOPAO-UHFFFAOYSA-N	0	0	288.416	4.115	20	30		CIEDRN
C=CCC1(C(=O)N[C@H]2CCCC(F)(F)C2)CCCCC1	ZINC000450157921	330963919	/nfs/dbraw/zinc/96/39/19/330963919.db2.gz	PLOCQZCFCKDRDY-ZDUSSCGKSA-N	0	0	285.378	4.207	20	30		CIEDRN
C=CCN(C)C(=O)N[C@H](c1cccs1)C(CC)CC	ZINC000162914643	330967009	/nfs/dbraw/zinc/96/70/09/330967009.db2.gz	WVVWRTNPGXMUQZ-AWEZNQCLSA-N	0	0	280.437	4.053	20	30		CIEDRN
C=CCC1(C(=O)Nc2scnc2CC)CCCCC1	ZINC000450284111	330970657	/nfs/dbraw/zinc/97/06/57/330970657.db2.gz	GLKASHLBZRASNE-UHFFFAOYSA-N	0	0	278.421	4.171	20	30		CIEDRN
N#Cc1ccc(COc2ccc(F)cc2F)c(Cl)c1	ZINC000162964792	330971327	/nfs/dbraw/zinc/97/13/27/330971327.db2.gz	OZXKGHQYMOZECF-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
CC(C)Sc1ccc([C@H](C)Nc2nccc(C#N)n2)cc1	ZINC000450314328	330972234	/nfs/dbraw/zinc/97/22/34/330972234.db2.gz	MTDYSKIEYFRZNF-LBPRGKRZSA-N	0	0	298.415	4.022	20	30		CIEDRN
C=CC(C)(C)C(=O)N1CC=C(c2ccccc2Cl)CC1	ZINC000450354368	330974381	/nfs/dbraw/zinc/97/43/81/330974381.db2.gz	LHGDEAZZHMXLSF-UHFFFAOYSA-N	0	0	289.806	4.168	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@H]1CC=C(c2ccc(F)cc2)CC1	ZINC000450466806	330981899	/nfs/dbraw/zinc/98/18/99/330981899.db2.gz	JTJAOJKQJZQPEU-INIZCTEOSA-N	0	0	287.378	4.090	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@H](C(C)(C)C)C2)CCCC1	ZINC000450565086	330986956	/nfs/dbraw/zinc/98/69/56/330986956.db2.gz	JNEMJXSJVVTBGB-AWEZNQCLSA-N	0	0	263.425	4.018	20	30		CIEDRN
N#Cc1ccc(N2CCCC[C@H]2c2ccc(Cl)cc2)nc1	ZINC000450822352	331001068	/nfs/dbraw/zinc/00/10/68/331001068.db2.gz	BADSTBFSNIGDOT-INIZCTEOSA-N	0	0	297.789	4.338	20	30		CIEDRN
CC(C)c1cnc(S[C@@H]2CC[C@@H](C#N)C2)n1C(C)C	ZINC000450843532	331002293	/nfs/dbraw/zinc/00/22/93/331002293.db2.gz	DYXJISAPPCMSHX-CHWSQXEVSA-N	0	0	277.437	4.372	20	30		CIEDRN
CC(C)c1cnc(S[C@H]2CC[C@@H](C#N)C2)n1C(C)C	ZINC000450843533	331002310	/nfs/dbraw/zinc/00/23/10/331002310.db2.gz	DYXJISAPPCMSHX-OLZOCXBDSA-N	0	0	277.437	4.372	20	30		CIEDRN
C=CC(C)(C)C(=O)Nc1cccc(C(F)F)c1Cl	ZINC000450847981	331002576	/nfs/dbraw/zinc/00/25/76/331002576.db2.gz	WNGDWJISDIDGED-UHFFFAOYSA-N	0	0	273.710	4.428	20	30		CIEDRN
C=CC[C@H]1N(Cc2nnc(C(C)C)s2)CCCC1(C)C	ZINC000450860431	331003273	/nfs/dbraw/zinc/00/32/73/331003273.db2.gz	CICNJEHTYKMAPJ-CYBMUJFWSA-N	0	0	293.480	4.228	20	30		CIEDRN
CC(F)(F)CCSc1ccc(C#N)cc1Cl	ZINC000450866236	331003750	/nfs/dbraw/zinc/00/37/50/331003750.db2.gz	JZGNDRXSLUIPOU-UHFFFAOYSA-N	0	0	261.724	4.349	20	30		CIEDRN
CCc1nc(C)c(CSc2cccc(Cl)c2C#N)o1	ZINC000450899230	331005870	/nfs/dbraw/zinc/00/58/70/331005870.db2.gz	DBCLJDYREUMWOF-UHFFFAOYSA-N	0	0	292.791	4.363	20	30		CIEDRN
N#CC1(CSCc2ccccc2Cl)CCC1	ZINC000450914270	331006857	/nfs/dbraw/zinc/00/68/57/331006857.db2.gz	MDIBUXKLVHORGG-UHFFFAOYSA-N	0	0	251.782	4.267	20	30		CIEDRN
Cc1ccc(N2CCC[C@@H]2c2ccc(F)cc2C)nc1C#N	ZINC000450915844	331007047	/nfs/dbraw/zinc/00/70/47/331007047.db2.gz	TWVUBIDVZZOGSU-QGZVFWFLSA-N	0	0	295.361	4.051	20	30		CIEDRN
CC(C)(C)c1cc(COc2cc(Cl)cc(C#N)c2)no1	ZINC000450969171	331009191	/nfs/dbraw/zinc/00/91/91/331009191.db2.gz	ZBEQUNFFAVTBAM-UHFFFAOYSA-N	0	0	290.750	4.076	20	30		CIEDRN
C=CC(C)(C)C(=O)NC[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000451030614	331012590	/nfs/dbraw/zinc/01/25/90/331012590.db2.gz	JFSVNRDBFPJEDU-LLVKDONJSA-N	0	0	299.336	4.137	20	30		CIEDRN
C[C@H](NCc1ccc(F)cc1C#N)c1cccc(C2CC2)c1	ZINC000451108868	331015739	/nfs/dbraw/zinc/01/57/39/331015739.db2.gz	BRPFHAHYMZUUCY-ZDUSSCGKSA-N	0	0	294.373	4.426	20	30		CIEDRN
CC(C)(C)c1ccc(NC(=O)Cc2ccc(C#N)cc2)cc1	ZINC000194705737	331015953	/nfs/dbraw/zinc/01/59/53/331015953.db2.gz	WCJQSMFVRLKTFM-UHFFFAOYSA-N	0	0	292.382	4.037	20	30		CIEDRN
C=CCC1(C(=O)N2CCc3cc(C)ccc3C2)CCCC1	ZINC000451132541	331016895	/nfs/dbraw/zinc/01/68/95/331016895.db2.gz	IXWYWNVANIGOMF-UHFFFAOYSA-N	0	0	283.415	4.016	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@@H]1CCC[C@@H](c2ccccc2)C1	ZINC000451172409	331018657	/nfs/dbraw/zinc/01/86/57/331018657.db2.gz	VYIAKCAYHMEDHT-HZPDHXFCSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@@H]1CCC[C@H](c2ccccc2)C1	ZINC000451172410	331018664	/nfs/dbraw/zinc/01/86/64/331018664.db2.gz	VYIAKCAYHMEDHT-JKSUJKDBSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CCC1(C(=O)N(C)Cc2cc(F)cc(F)c2)CCCC1	ZINC000451192135	331019822	/nfs/dbraw/zinc/01/98/22/331019822.db2.gz	NRGRLXADHCKHFB-UHFFFAOYSA-N	0	0	293.357	4.060	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)CC1CC(F)(F)C1	ZINC000451324944	331024502	/nfs/dbraw/zinc/02/45/02/331024502.db2.gz	MIAJVQDCLVHTLT-UHFFFAOYSA-N	0	0	293.357	4.027	20	30		CIEDRN
N#CC1(CN2CCCC[C@@H]2c2ccc(Cl)cc2)CC1	ZINC000451733256	331040535	/nfs/dbraw/zinc/04/05/35/331040535.db2.gz	IGHUVRSJAXWCEL-OAHLLOKOSA-N	0	0	274.795	4.171	20	30		CIEDRN
CC(C)(CCC#N)CNC(=O)[C@H]1CCC[C@H]1c1ccccc1	ZINC000451782376	331041877	/nfs/dbraw/zinc/04/18/77/331041877.db2.gz	YWYYBNWNOXPBHM-IRXDYDNUSA-N	0	0	298.430	4.016	20	30		CIEDRN
C[C@H](c1ccc(C#N)cc1)N1CC2(CCC2)[C@@H]1c1ccco1	ZINC000451834303	331044250	/nfs/dbraw/zinc/04/42/50/331044250.db2.gz	IUXFNOMICIDRLH-KDOFPFPSSA-N	0	0	292.382	4.439	20	30		CIEDRN
CC(C)(C#N)CCN1CCCC[C@@H]1c1nc2ccccc2[nH]1	ZINC000451879131	331045909	/nfs/dbraw/zinc/04/59/09/331045909.db2.gz	PGHYIXVFIFFIOP-MRXNPFEDSA-N	0	0	296.418	4.030	20	30		CIEDRN
C=CCC1(C(=O)N(C)Cc2occc2C)CCCCC1	ZINC000452123981	331054909	/nfs/dbraw/zinc/05/49/09/331054909.db2.gz	NWJXHQNXIDCBCO-UHFFFAOYSA-N	0	0	275.392	4.073	20	30		CIEDRN
C=CCC1(C(=O)N2CC(C)(C)[C@H]2C2CC2)CCCCC1	ZINC000452153395	331056304	/nfs/dbraw/zinc/05/63/04/331056304.db2.gz	PNSHKPGMZYLYBT-OAHLLOKOSA-N	0	0	275.436	4.160	20	30		CIEDRN
C=CCC1(C(=O)N2CC3(CCC3)[C@@H]2C2CC2)CCCCC1	ZINC000452157837	331056491	/nfs/dbraw/zinc/05/64/91/331056491.db2.gz	ZVBZJRUAUALVQM-INIZCTEOSA-N	0	0	287.447	4.304	20	30		CIEDRN
C=CCC1(C(=O)N2CC3(CCC3)[C@H]2C(C)C)CCCC1	ZINC000452261378	331060177	/nfs/dbraw/zinc/06/01/77/331060177.db2.gz	HPNAEDKFDWQGIK-OAHLLOKOSA-N	0	0	275.436	4.160	20	30		CIEDRN
C=CCCC(=O)N1CCc2ccc(-c3ccccc3)cc2C1	ZINC000452315484	331062032	/nfs/dbraw/zinc/06/20/32/331062032.db2.gz	WGWFCXWXVONPIY-UHFFFAOYSA-N	0	0	291.394	4.205	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H]1CCCC[C@H]1CC(F)(F)F	ZINC000452507089	331066765	/nfs/dbraw/zinc/06/67/65/331066765.db2.gz	COXZZMJTSVMSKL-AGIUHOORSA-N	0	0	291.357	4.216	20	30		CIEDRN
CC(C)=CCC[C@@H](C)NC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000452542809	331068031	/nfs/dbraw/zinc/06/80/31/331068031.db2.gz	OKYGOFPIQZXCEZ-OAHLLOKOSA-N	0	0	298.430	4.352	20	30		CIEDRN
CCC(C)(C)c1ccc(C(=O)N[C@H]2CC[C@@H](CC#N)C2)cc1	ZINC000452563062	331069180	/nfs/dbraw/zinc/06/91/80/331069180.db2.gz	SFDSGTKGCAAIRY-YOEHRIQHSA-N	0	0	298.430	4.186	20	30		CIEDRN
N#CCc1ccc(NC(=O)CCC2CCCC2)c(Cl)c1	ZINC000452640402	331070736	/nfs/dbraw/zinc/07/07/36/331070736.db2.gz	DSAPPLORUBHNTB-UHFFFAOYSA-N	0	0	290.794	4.315	20	30		CIEDRN
CC(C)[C@H](C)CC(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452639483	331070770	/nfs/dbraw/zinc/07/07/70/331070770.db2.gz	CCGDUFUQCUENLS-LLVKDONJSA-N	0	0	278.783	4.027	20	30		CIEDRN
CC(C)C[C@@H](C)C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452640232	331070803	/nfs/dbraw/zinc/07/08/03/331070803.db2.gz	AWZDRKGHDAFPTR-LLVKDONJSA-N	0	0	278.783	4.027	20	30		CIEDRN
CC[C@@H](C)[C@H](C)C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452648102	331071020	/nfs/dbraw/zinc/07/10/20/331071020.db2.gz	UJUXUZLVLUQUOL-MNOVXSKESA-N	0	0	278.783	4.027	20	30		CIEDRN
CC[C@@H](CC(=O)Nc1ccc(CC#N)cc1Cl)C(C)C	ZINC000452651046	331071099	/nfs/dbraw/zinc/07/10/99/331071099.db2.gz	WDZSPUVMCRMLJI-ZDUSSCGKSA-N	0	0	292.810	4.417	20	30		CIEDRN
C=C(C)CCNC(=O)c1sc2cc(F)ccc2c1C	ZINC000452717380	331073123	/nfs/dbraw/zinc/07/31/23/331073123.db2.gz	KXHUDKSTALWVLL-UHFFFAOYSA-N	0	0	277.364	4.045	20	30		CIEDRN
C=C(C)CCNC(=O)CC(c1ccccc1)c1ccccc1	ZINC000452721169	331073770	/nfs/dbraw/zinc/07/37/70/331073770.db2.gz	GKUSKVMZDCRABO-UHFFFAOYSA-N	0	0	293.410	4.291	20	30		CIEDRN
C=C(C)CCNC(=O)C[C@@H](C)c1ccccc1C(F)(F)F	ZINC000452721253	331073794	/nfs/dbraw/zinc/07/37/94/331073794.db2.gz	ZKAVTCDHIYPZNY-GFCCVEGCSA-N	0	0	299.336	4.281	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@H](Cc2ccccc2)[C@@H]1C	ZINC000467330389	331075320	/nfs/dbraw/zinc/07/53/20/331075320.db2.gz	PIZDLZGERVOLIO-QFBILLFUSA-N	0	0	297.442	4.235	20	30		CIEDRN
C=CC(C)(C)CNC(=O)CCCc1cc(C)sc1C	ZINC000452773049	331075932	/nfs/dbraw/zinc/07/59/32/331075932.db2.gz	HMLZFBJSIXGZRB-UHFFFAOYSA-N	0	0	279.449	4.016	20	30		CIEDRN
C=CC(C)(C)C(=O)Nc1cc(C)c(C)cc1Cl	ZINC000452893586	331080145	/nfs/dbraw/zinc/08/01/45/331080145.db2.gz	WZBQJWVSRDSFEH-UHFFFAOYSA-N	0	0	251.757	4.108	20	30		CIEDRN
C=CC(C)(C)c1nc(-c2ccccc2OC(F)(F)F)no1	ZINC000453055266	331085042	/nfs/dbraw/zinc/08/50/42/331085042.db2.gz	CIFUJVCEPONTKH-UHFFFAOYSA-N	0	0	298.264	4.099	20	30		CIEDRN
CCOc1ccc(Cl)c(NCCC(C)(C)C#N)c1	ZINC000453143481	331093757	/nfs/dbraw/zinc/09/37/57/331093757.db2.gz	FPMVXQIAGGMRPC-UHFFFAOYSA-N	0	0	266.772	4.090	20	30		CIEDRN
C=CCC1(c2nc(CCCSCC)no2)CCCC1	ZINC000453175373	331097271	/nfs/dbraw/zinc/09/72/71/331097271.db2.gz	NFEZZQJQCDAGFO-UHFFFAOYSA-N	0	0	280.437	4.143	20	30		CIEDRN
C=C(C)CCc1noc([C@H](CC)CC(F)(F)F)n1	ZINC000453177202	331097436	/nfs/dbraw/zinc/09/74/36/331097436.db2.gz	GGVJMGJXGMJGPL-SECBINFHSA-N	0	0	262.275	4.024	20	30		CIEDRN
C=CCCO[C@H](C)c1nc(-c2ccc(C)c(Cl)c2)no1	ZINC000453189987	331099132	/nfs/dbraw/zinc/09/91/32/331099132.db2.gz	UGXVJXPHNZMRLE-LLVKDONJSA-N	0	0	292.766	4.352	20	30		CIEDRN
C=CCC1(c2nc([C@](C)(OC)C3CC3)no2)CCCCC1	ZINC000453190656	331099368	/nfs/dbraw/zinc/09/93/68/331099368.db2.gz	VMPOIPLYCWXECX-MRXNPFEDSA-N	0	0	290.407	4.119	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc([C@@H]2CSc3ccccc32)no1	ZINC000453213128	331102125	/nfs/dbraw/zinc/10/21/25/331102125.db2.gz	GWPCRCWEBBLTBA-WBMJQRKESA-N	0	0	286.400	4.161	20	30		CIEDRN
C=CCCc1noc([C@H](CC)Oc2ccccc2C)n1	ZINC000453222717	331103258	/nfs/dbraw/zinc/10/32/58/331103258.db2.gz	ALFGUQTWFULOEF-ZDUSSCGKSA-N	0	0	272.348	4.027	20	30		CIEDRN
C=CCCc1noc([C@@H](C)c2ccc(C(=O)C(C)C)cc2)n1	ZINC000453234543	331104933	/nfs/dbraw/zinc/10/49/33/331104933.db2.gz	LHCRLXWMBWJPRL-ZDUSSCGKSA-N	0	0	298.386	4.179	20	30		CIEDRN
C=CCCc1noc([C@@H]2C[C@H]2c2ccc(Cl)s2)n1	ZINC000453242474	331106247	/nfs/dbraw/zinc/10/62/47/331106247.db2.gz	XZNQKZVCFXWLCF-RKDXNWHRSA-N	0	0	280.780	4.174	20	30		CIEDRN
C=CCCc1noc([C@@H]2C[C@@H]2c2ccc([C@@H]3C[C@H]3C)o2)n1	ZINC000453250692	331107523	/nfs/dbraw/zinc/10/75/23/331107523.db2.gz	YQPHMJKILZVBTD-FVCCEPFGSA-N	0	0	284.359	4.176	20	30		CIEDRN
C=CC(C)(C)c1nc(-c2cccc(C(C)(F)F)c2)no1	ZINC000453321956	331116463	/nfs/dbraw/zinc/11/64/63/331116463.db2.gz	ICPTZYBSTRVLIF-UHFFFAOYSA-N	0	0	278.302	4.312	20	30		CIEDRN
CC#CCCCc1nc(-c2cccc(C(C)(F)F)c2)no1	ZINC000453355425	331121575	/nfs/dbraw/zinc/12/15/75/331121575.db2.gz	LLYQGBGZZIAZPP-UHFFFAOYSA-N	0	0	290.313	4.194	20	30		CIEDRN
N#C[C@H]1CC[C@H](Nc2cc(Cl)cc(Br)c2)C1	ZINC000453407180	331129453	/nfs/dbraw/zinc/12/94/53/331129453.db2.gz	DIWNZASMTDJMDP-KWQFWETISA-N	0	0	299.599	4.207	20	30		CIEDRN
CC(C)(C)c1ccc(NC(=O)N[C@H]2CC[C@@H](CC#N)C2)cc1	ZINC000454176569	331140841	/nfs/dbraw/zinc/14/08/41/331140841.db2.gz	XHEMITNBDNEXEZ-BBRMVZONSA-N	0	0	299.418	4.188	20	30		CIEDRN
C=C(C)CCNC(=O)Nc1c(C)cccc1C(C)C	ZINC000454232474	331142360	/nfs/dbraw/zinc/14/23/60/331142360.db2.gz	ZMIPINIVFWRAND-UHFFFAOYSA-N	0	0	260.381	4.206	20	30		CIEDRN
CCC[C@H](NC(=O)Nc1ccc(CC#N)cc1)C(C)(C)C	ZINC000454350765	331144654	/nfs/dbraw/zinc/14/46/54/331144654.db2.gz	ZYRAXERVCFDOCS-HNNXBMFYSA-N	0	0	287.407	4.089	20	30		CIEDRN
C=CC(C)(C)CNC(=O)Nc1ccc2oc(C3CC3)nc2c1	ZINC000454421124	331145798	/nfs/dbraw/zinc/14/57/98/331145798.db2.gz	KPJGDLQYLZZKKO-UHFFFAOYSA-N	0	0	299.374	4.039	20	30		CIEDRN
C=CC(C)(C)CNC(=O)N[C@H](C)c1cc2ccccc2o1	ZINC000454508905	331147561	/nfs/dbraw/zinc/14/75/61/331147561.db2.gz	BSJLSUGNPQNVHN-GFCCVEGCSA-N	0	0	286.375	4.005	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N1C[C@@H](C(C)C)[C@@H]1C(C)C	ZINC000454644908	331150312	/nfs/dbraw/zinc/15/03/12/331150312.db2.gz	OSMCNDKHPSIBFB-RDJZCZTQSA-N	0	0	299.418	4.011	20	30		CIEDRN
CC(C)Oc1ccc(C#N)cc1NC(=O)C1=CC[C@H](C)CC1	ZINC000454985419	331158181	/nfs/dbraw/zinc/15/81/81/331158181.db2.gz	XHZQYNLQXWFEGD-ZDUSSCGKSA-N	0	0	298.386	4.030	20	30		CIEDRN
C=CCCCN(C)C(=O)N[C@H](C)c1cccc(C2CC2)c1	ZINC000455120424	331161152	/nfs/dbraw/zinc/16/11/52/331161152.db2.gz	SRJZJSYXBFDFFC-CQSZACIVSA-N	0	0	286.419	4.233	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)Nc1ccccc1CSC	ZINC000455136306	331161502	/nfs/dbraw/zinc/16/15/02/331161502.db2.gz	JRCODKUWFHXPPL-UHFFFAOYSA-N	0	0	292.448	4.273	20	30		CIEDRN
C=C(C)CCNC(=O)N(C)[C@H](C)c1cccc(Cl)c1	ZINC000455309110	331165258	/nfs/dbraw/zinc/16/52/58/331165258.db2.gz	KRJMABASRUTFLZ-GFCCVEGCSA-N	0	0	280.799	4.009	20	30		CIEDRN
C=C(C)CCNC(=O)N(CCC)[C@H]1CCc2ccccc21	ZINC000455316763	331165856	/nfs/dbraw/zinc/16/58/56/331165856.db2.gz	WCSWMDALFQLGFR-KRWDZBQOSA-N	0	0	286.419	4.062	20	30		CIEDRN
C=C(C)CCNC(=O)Nc1c(F)cccc1SCC	ZINC000455462791	331170285	/nfs/dbraw/zinc/17/02/85/331170285.db2.gz	LOYDUCPNYAYZOY-UHFFFAOYSA-N	0	0	282.384	4.025	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Nc1c(C)cc(C)nc1C	ZINC000455478488	331170561	/nfs/dbraw/zinc/17/05/61/331170561.db2.gz	GBNJYNFAOXHEHK-UHFFFAOYSA-N	0	0	289.423	4.217	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1cccc(-c2ncco2)c1C	ZINC000455487515	331170955	/nfs/dbraw/zinc/17/09/55/331170955.db2.gz	JNOLZABDODHUAG-UHFFFAOYSA-N	0	0	299.374	4.080	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)c1ccc([C@@H](C)C(F)(F)F)cc1	ZINC000455680031	331175369	/nfs/dbraw/zinc/17/53/69/331175369.db2.gz	CRYVVCUBUYUCLE-GHMZBOCLSA-N	0	0	285.309	4.047	20	30		CIEDRN
CCC[C@H](C)[C@@H]1CCCN1C(=O)Nc1cccc(CC#N)c1	ZINC000455899645	331179863	/nfs/dbraw/zinc/17/98/63/331179863.db2.gz	BAOKRPUUUZYGEP-YOEHRIQHSA-N	0	0	299.418	4.185	20	30		CIEDRN
C[C@H](C1CCCCC1)N(C)C(=O)Nc1cccc(CC#N)c1	ZINC000455908801	331180522	/nfs/dbraw/zinc/18/05/22/331180522.db2.gz	RJYZYJRCBPVNAQ-CQSZACIVSA-N	0	0	299.418	4.185	20	30		CIEDRN
CC(C)C[C@@H]1CCCCN1C(=O)Nc1cccc(CC#N)c1	ZINC000455916523	331180866	/nfs/dbraw/zinc/18/08/66/331180866.db2.gz	IQCFWRVVAUQHNQ-KRWDZBQOSA-N	0	0	299.418	4.185	20	30		CIEDRN
CC(C)(C)CC(C)(C)NC(=O)Nc1cccc(CC#N)c1	ZINC000455920406	331181120	/nfs/dbraw/zinc/18/11/20/331181120.db2.gz	NKHJRDXHJIDXQQ-UHFFFAOYSA-N	0	0	287.407	4.089	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1ccc2cnccc2c1	ZINC000455980736	331181745	/nfs/dbraw/zinc/18/17/45/331181745.db2.gz	HKLRAEHOGRDLBH-CYBMUJFWSA-N	0	0	283.375	4.101	20	30		CIEDRN
C=CC(C)(C)CNC(=O)c1c(Cl)cc(F)cc1Cl	ZINC000456113231	331184411	/nfs/dbraw/zinc/18/44/11/331184411.db2.gz	FUCSKAJBBQTIFD-UHFFFAOYSA-N	0	0	290.165	4.075	20	30		CIEDRN
C=C(C)CCNC(=O)C1(c2cccs2)CCCCC1	ZINC000456127027	331185116	/nfs/dbraw/zinc/18/51/16/331185116.db2.gz	YKPPTDOXTSPZJT-UHFFFAOYSA-N	0	0	277.433	4.032	20	30		CIEDRN
N#CCCCC(=O)N1CCCC[C@H]1c1ccc(Cl)cc1	ZINC000456343398	331190349	/nfs/dbraw/zinc/19/03/49/331190349.db2.gz	CVTDFOHEQIFGMB-HNNXBMFYSA-N	0	0	290.794	4.087	20	30		CIEDRN
C=CCC1(NC(=O)[C@@H](C)c2ccsc2)CCCCC1	ZINC000456365348	331191203	/nfs/dbraw/zinc/19/12/03/331191203.db2.gz	KYOLGQUSBWVNOF-ZDUSSCGKSA-N	0	0	277.433	4.247	20	30		CIEDRN
C=CCC1(NC(=O)[C@@H](CC)CC(F)(F)F)CCCCC1	ZINC000456367511	331191263	/nfs/dbraw/zinc/19/12/63/331191263.db2.gz	OEMCVPZNCBYBJL-LBPRGKRZSA-N	0	0	291.357	4.360	20	30		CIEDRN
C=CCC1(NC(=O)c2oc(C(C)C)nc2C)CCCCC1	ZINC000456368562	331191337	/nfs/dbraw/zinc/19/13/37/331191337.db2.gz	PHCQKVBHJSNDQT-UHFFFAOYSA-N	0	0	290.407	4.115	20	30		CIEDRN
C=CCC1(NC(=O)C2CCC(F)(F)CC2)CCCCC1	ZINC000456373427	331191678	/nfs/dbraw/zinc/19/16/78/331191678.db2.gz	VZQNSHGAUBXRCY-UHFFFAOYSA-N	0	0	285.378	4.207	20	30		CIEDRN
C=CCC1(CNC(=O)c2sccc2SC)CCCC1	ZINC000456490492	331194248	/nfs/dbraw/zinc/19/42/48/331194248.db2.gz	WWVWQCZJVRUJFX-UHFFFAOYSA-N	0	0	295.473	4.336	20	30		CIEDRN
CC(C)(C)c1ccc(C(=O)Nc2cccc(CC#N)c2)s1	ZINC000456729827	331199418	/nfs/dbraw/zinc/19/94/18/331199418.db2.gz	DALNQFLIJCFHMR-UHFFFAOYSA-N	0	0	298.411	4.364	20	30		CIEDRN
CC(C)[C@@H](C(=O)Nc1cccc(CC#N)c1)c1ccccc1	ZINC000456747454	331199908	/nfs/dbraw/zinc/19/99/08/331199908.db2.gz	JBODVQWFFAHVGI-GOSISDBHSA-N	0	0	292.382	4.131	20	30		CIEDRN
CC1(C(=O)Nc2cccc(CC#N)c2)CCCCCC1	ZINC000456752312	331200083	/nfs/dbraw/zinc/20/00/83/331200083.db2.gz	OVCMDQMNQSWMNT-UHFFFAOYSA-N	0	0	270.376	4.052	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)NC[C@H]1CCCC[C@H]1c1ccccc1	ZINC000456761353	331200926	/nfs/dbraw/zinc/20/09/26/331200926.db2.gz	JNVLALSDVBBXMX-ZIFCJYIRSA-N	0	0	298.430	4.016	20	30		CIEDRN
C=C(CC)CNC(=O)c1c(Cl)cc(Cl)cc1Cl	ZINC000456825875	331206129	/nfs/dbraw/zinc/20/61/29/331206129.db2.gz	CPWQTWXFCIBUEU-UHFFFAOYSA-N	0	0	292.593	4.343	20	30		CIEDRN
C=C(CC)CNC(=O)C(C)(C)c1cccc(C(F)(F)F)c1	ZINC000456829544	331206473	/nfs/dbraw/zinc/20/64/73/331206473.db2.gz	OLUCEBDAYWZMJI-UHFFFAOYSA-N	0	0	299.336	4.065	20	30		CIEDRN
C=C(CC)CNC(=O)[C@@H]1C[C@@H]1c1cccc2ccccc21	ZINC000456831941	331206812	/nfs/dbraw/zinc/20/68/12/331206812.db2.gz	VPTQIYBSJCDQBT-QZTJIDSGSA-N	0	0	279.383	4.026	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H]1c1ccc(F)cc1C	ZINC000456844574	331207267	/nfs/dbraw/zinc/20/72/67/331207267.db2.gz	MUVHBIGWJSVAJO-WMLDXEAASA-N	0	0	289.394	4.400	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H]1c1ccc(F)cc1C	ZINC000456844575	331207341	/nfs/dbraw/zinc/20/73/41/331207341.db2.gz	MUVHBIGWJSVAJO-YOEHRIQHSA-N	0	0	289.394	4.400	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C(C)C)C1CC(C)(C)C1	ZINC000457079885	331211745	/nfs/dbraw/zinc/21/17/45/331211745.db2.gz	UUWOKWKXNQNILI-UHFFFAOYSA-N	0	0	263.425	4.180	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CC2(CCCC2)[C@@H]1C(C)C	ZINC000457152714	331213061	/nfs/dbraw/zinc/21/30/61/331213061.db2.gz	XZWKYKQALCIKNJ-HOCLYGCPSA-N	0	0	263.425	4.016	20	30		CIEDRN
C[C@H](CC(C)(C)C)NC(=O)C[C@H](CC#N)c1ccccc1	ZINC000457195422	331214998	/nfs/dbraw/zinc/21/49/98/331214998.db2.gz	QEADOLNRZNVXKM-ZBFHGGJFSA-N	0	0	286.419	4.015	20	30		CIEDRN
CC#CCCCC(=O)N1CC2(CCCC2)[C@@H]1c1ccccc1	ZINC000457285533	331218138	/nfs/dbraw/zinc/21/81/38/331218138.db2.gz	RHUVOCPRWAQUOO-IBGZPJMESA-N	0	0	295.426	4.324	20	30		CIEDRN
CC[C@]1(C(C)C)C[C@H]1NC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000457308569	331218623	/nfs/dbraw/zinc/21/86/23/331218623.db2.gz	WKTOKOGAENFTMM-ZHALLVOQSA-N	0	0	298.430	4.015	20	30		CIEDRN
CCC[C@@H](NC(=O)[C@H](C)c1cccc(C#N)c1)C1CCCC1	ZINC000458314886	331248353	/nfs/dbraw/zinc/24/83/53/331248353.db2.gz	DALKNURXZODNBU-RDTXWAMCSA-N	0	0	298.430	4.137	20	30		CIEDRN
CC1(C)CCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000458799053	331259993	/nfs/dbraw/zinc/25/99/93/331259993.db2.gz	IZRRBDKRCLBHOB-INIZCTEOSA-N	0	0	299.418	4.006	20	30		CIEDRN
CC[C@H]1CCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000458798617	331260029	/nfs/dbraw/zinc/26/00/29/331260029.db2.gz	IFUQGSUBRLGMCC-IRXDYDNUSA-N	0	0	299.418	4.006	20	30		CIEDRN
CC(C)N(C(=O)N[C@@H](CCCC#N)c1ccccc1)C1CC1	ZINC000458801107	331260091	/nfs/dbraw/zinc/26/00/91/331260091.db2.gz	MNOZOKWTOZHUKK-KRWDZBQOSA-N	0	0	299.418	4.004	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@H](C)c1cccc(C2CC2)c1	ZINC000458874397	331262063	/nfs/dbraw/zinc/26/20/63/331262063.db2.gz	NAKJMQWGAZSXDN-CQSZACIVSA-N	0	0	286.419	4.233	20	30		CIEDRN
Cc1cccc(C(C)C)c1NC(=O)NCC(C)(C)CC#N	ZINC000459225219	331272066	/nfs/dbraw/zinc/27/20/66/331272066.db2.gz	BYRFCDLXDOOSEI-UHFFFAOYSA-N	0	0	287.407	4.180	20	30		CIEDRN
CC(C)[C@]1(C)C[C@@H]1NC(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000459264871	331274080	/nfs/dbraw/zinc/27/40/80/331274080.db2.gz	ZTBHQOZOZGRWIN-YJBOKZPZSA-N	0	0	299.418	4.044	20	30		CIEDRN
N#CCCCOc1cccc(NC2CC3(CCC3)C2)c1	ZINC000459346734	331277295	/nfs/dbraw/zinc/27/72/95/331277295.db2.gz	QECCOVYESRRXFA-UHFFFAOYSA-N	0	0	270.376	4.114	20	30		CIEDRN
CC(C)(CC#N)CNC(=O)Nc1cccc(C2CCC2)c1	ZINC000459594281	331289872	/nfs/dbraw/zinc/28/98/72/331289872.db2.gz	KPAPUCCQHNHTOU-UHFFFAOYSA-N	0	0	285.391	4.015	20	30		CIEDRN
C=CC(C)(C)C(=O)Nc1cc(Cl)ccc1Cl	ZINC000459810231	331301791	/nfs/dbraw/zinc/30/17/91/331301791.db2.gz	VCBOICGESPZWBH-UHFFFAOYSA-N	0	0	258.148	4.144	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc(C)cc1Br	ZINC000459833282	331302456	/nfs/dbraw/zinc/30/24/56/331302456.db2.gz	JZVCBIMYVOINDR-UHFFFAOYSA-N	0	0	296.208	4.298	20	30		CIEDRN
CC[C@@H]1CCC[C@H]1C(=O)Nc1sc(C)c(C)c1C#N	ZINC000459846906	331302529	/nfs/dbraw/zinc/30/25/29/331302529.db2.gz	RUXYFMJXOFFSIX-VXGBXAGGSA-N	0	0	276.405	4.001	20	30		CIEDRN
C=CCC1(C(=O)N(C)[C@@H](C)c2ccccc2)CCCC1	ZINC000459879131	331302939	/nfs/dbraw/zinc/30/29/39/331302939.db2.gz	BMDCRPMSEWROOD-HNNXBMFYSA-N	0	0	271.404	4.343	20	30		CIEDRN
C=CCN(C(=O)c1scnc1C(C)C)c1ccccc1	ZINC000459933087	331303560	/nfs/dbraw/zinc/30/35/60/331303560.db2.gz	QKRRUGNGTLSETI-UHFFFAOYSA-N	0	0	286.400	4.099	20	30		CIEDRN
C=CC(C)(C)C(=O)N(Cc1ccc(Cl)cc1)C1CC1	ZINC000459944282	331303727	/nfs/dbraw/zinc/30/37/27/331303727.db2.gz	JUJXQLMWJIOZFA-UHFFFAOYSA-N	0	0	277.795	4.043	20	30		CIEDRN
C=CCC(C)(C)C(=O)N(Cc1ccc(C#N)cc1)CC(C)C	ZINC000459972917	331303973	/nfs/dbraw/zinc/30/39/73/331303973.db2.gz	TYIHQFYKEVKGPD-UHFFFAOYSA-N	0	0	298.430	4.145	20	30		CIEDRN
C=CC(C)(C)C(=O)Nc1cc(OC)ccc1OCCCC	ZINC000459981126	331304067	/nfs/dbraw/zinc/30/40/67/331304067.db2.gz	AQOPYNUEJCVHOS-UHFFFAOYSA-N	0	0	291.391	4.025	20	30		CIEDRN
C=CCN(Cc1cccc(C#N)c1)C(=O)[C@H](CC)CC(C)C	ZINC000460060955	331304928	/nfs/dbraw/zinc/30/49/28/331304928.db2.gz	LJMDTFZQPHJZIE-GOSISDBHSA-N	0	0	298.430	4.145	20	30		CIEDRN
CC(C)(CCC#N)CNc1ccc(F)c(Cl)c1	ZINC000164812265	331305313	/nfs/dbraw/zinc/30/53/13/331305313.db2.gz	OXYYKWGCUGYLAQ-UHFFFAOYSA-N	0	0	254.736	4.221	20	30		CIEDRN
C[C@@H](CO)CSCc1ccc(-c2ccccc2C#N)cc1	ZINC000461544171	331313795	/nfs/dbraw/zinc/31/37/95/331313795.db2.gz	HOKDNSIOYSCSLB-AWEZNQCLSA-N	0	0	297.423	4.087	20	30		CIEDRN
CCN(C(=O)c1ccc(C(C)C)cc1)c1ccc(C#N)cc1	ZINC000461545476	331313798	/nfs/dbraw/zinc/31/37/98/331313798.db2.gz	ODVAQGOSUCIIIJ-UHFFFAOYSA-N	0	0	292.382	4.348	20	30		CIEDRN
N#Cc1ccc(CNc2cccc(C3CCC3)c2)cc1	ZINC000461740333	331314273	/nfs/dbraw/zinc/31/42/73/331314273.db2.gz	UGTMFDYXHAQPQY-UHFFFAOYSA-N	0	0	262.356	4.438	20	30		CIEDRN
CSc1cccc(NC(=O)[C@@H](C)c2cccc(C#N)c2)c1	ZINC000461743374	331314367	/nfs/dbraw/zinc/31/43/67/331314367.db2.gz	WAXVVEBPKXDDPZ-LBPRGKRZSA-N	0	0	296.395	4.022	20	30		CIEDRN
CSc1ccc(NC(=O)[C@H](C)c2cccc(C#N)c2)cc1	ZINC000461803262	331314915	/nfs/dbraw/zinc/31/49/15/331314915.db2.gz	PHICXYCKANWYOR-GFCCVEGCSA-N	0	0	296.395	4.022	20	30		CIEDRN
Cc1nc(N2CCc3ccccc3[C@H]2C)c(Cl)cc1C#N	ZINC000461933377	331315628	/nfs/dbraw/zinc/31/56/28/331315628.db2.gz	FSKILTRBLFGIHL-GFCCVEGCSA-N	0	0	297.789	4.039	20	30		CIEDRN
Cc1nc(N2[C@H](C)C[C@@H]3CCCC[C@H]32)c(Cl)cc1C#N	ZINC000461947414	331315991	/nfs/dbraw/zinc/31/59/91/331315991.db2.gz	JPOVRFUHUVWKPA-IFUGULHKSA-N	0	0	289.810	4.073	20	30		CIEDRN
Cc1nc(N2[C@H](C)C[C@@H]3CCCC[C@@H]32)c(Cl)cc1C#N	ZINC000461947412	331316006	/nfs/dbraw/zinc/31/60/06/331316006.db2.gz	JPOVRFUHUVWKPA-GMXABZIVSA-N	0	0	289.810	4.073	20	30		CIEDRN
Cc1cccc(C2(CNC(=O)CCCC#N)CCCCC2)c1	ZINC000461961224	331316271	/nfs/dbraw/zinc/31/62/71/331316271.db2.gz	XSHAXCPHXZVRLT-UHFFFAOYSA-N	0	0	298.430	4.007	20	30		CIEDRN
Cc1nc(N2C[C@@H](C)[C@@H]2c2ccccc2)c(Cl)cc1C#N	ZINC000461966783	331316447	/nfs/dbraw/zinc/31/64/47/331316447.db2.gz	PBEPZLSLAQXMKY-BDJLRTHQSA-N	0	0	297.789	4.113	20	30		CIEDRN
C[C@H](C(=O)N(C)CCC1CCCCC1)c1cccc(C#N)c1	ZINC000462025361	331316791	/nfs/dbraw/zinc/31/67/91/331316791.db2.gz	PUSGADYUHTVYLT-HNNXBMFYSA-N	0	0	298.430	4.091	20	30		CIEDRN
N#CCCCC(=O)NCC1(c2ccccc2)CCCCCC1	ZINC000462042495	331316883	/nfs/dbraw/zinc/31/68/83/331316883.db2.gz	ZWIVAOMZFRJZNX-UHFFFAOYSA-N	0	0	298.430	4.089	20	30		CIEDRN
Cc1cc(NCc2ccccc2C#N)ccc1C(F)(F)F	ZINC000462190438	331318217	/nfs/dbraw/zinc/31/82/17/331318217.db2.gz	PUBHGFGYVOFIJR-UHFFFAOYSA-N	0	0	290.288	4.498	20	30		CIEDRN
CC(C)c1ccc(NCCOc2cccc(C#N)c2)cc1	ZINC000462210676	331318455	/nfs/dbraw/zinc/31/84/55/331318455.db2.gz	MWNDBMZWHQQBRF-UHFFFAOYSA-N	0	0	280.371	4.173	20	30		CIEDRN
CCCCc1nc(CNc2cc(C#N)ccc2C)cs1	ZINC000462233438	331318715	/nfs/dbraw/zinc/31/87/15/331318715.db2.gz	QMTNLGVPGAMOIB-UHFFFAOYSA-N	0	0	285.416	4.278	20	30		CIEDRN
CC(C)CC[C@@H]1CCCN1C(=O)[C@H](C)c1cccc(C#N)c1	ZINC000462246854	331318783	/nfs/dbraw/zinc/31/87/83/331318783.db2.gz	MOAGPWBEHLXKCW-QAPCUYQASA-N	0	0	298.430	4.089	20	30		CIEDRN
CCCCC[C@H]1CCCN1C(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000462256427	331318803	/nfs/dbraw/zinc/31/88/03/331318803.db2.gz	SSIWQVOMKBKWSI-YJBOKZPZSA-N	0	0	298.430	4.233	20	30		CIEDRN
Cc1cc(Cl)ccc1NC(=O)[C@H](C)c1cccc(C#N)c1	ZINC000462286701	331318870	/nfs/dbraw/zinc/31/88/70/331318870.db2.gz	DXAHTSZLSDFCGV-GFCCVEGCSA-N	0	0	298.773	4.262	20	30		CIEDRN
C[C@H](C(=O)Nc1ccc2ccoc2c1)c1cccc(C#N)c1	ZINC000462322037	331319667	/nfs/dbraw/zinc/31/96/67/331319667.db2.gz	PEONYIDESXCAFV-LBPRGKRZSA-N	0	0	290.322	4.047	20	30		CIEDRN
CC#CCCSCc1csc(C2CCCC2)n1	ZINC000462374492	331320893	/nfs/dbraw/zinc/32/08/93/331320893.db2.gz	XACILFUCQAOQLG-UHFFFAOYSA-N	0	0	265.447	4.447	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cccc(C2CCC2)c1	ZINC000462380804	331321025	/nfs/dbraw/zinc/32/10/25/331321025.db2.gz	RGBRNOKSXOSTJN-CYBMUJFWSA-N	0	0	257.377	4.495	20	30		CIEDRN
C=CCCC[C@@H](C)Sc1nncc2ccccc21	ZINC000462391808	331321328	/nfs/dbraw/zinc/32/13/28/331321328.db2.gz	SURQQUATTVXDIG-GFCCVEGCSA-N	0	0	258.390	4.467	20	30		CIEDRN
CCc1cc(NC(=O)[C@H](C)c2cccc(C#N)c2)ccc1F	ZINC000462434668	331322029	/nfs/dbraw/zinc/32/20/29/331322029.db2.gz	FBKXQPYJLXIWEC-GFCCVEGCSA-N	0	0	296.345	4.002	20	30		CIEDRN
CCc1cc(NC(=O)[C@H](C)c2cccc(C#N)c2)ccc1C	ZINC000462536420	331323186	/nfs/dbraw/zinc/32/31/86/331323186.db2.gz	FATFJUCNRDQNHO-CQSZACIVSA-N	0	0	292.382	4.171	20	30		CIEDRN
C=CCCC(=O)N[C@@H]1c2ccccc2CC[C@H]1C(C)C	ZINC000462589805	331323637	/nfs/dbraw/zinc/32/36/37/331323637.db2.gz	GQNFSSWVRIGGCG-YJBOKZPZSA-N	0	0	271.404	4.029	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)CCc1cncc2ccccc21	ZINC000462619255	331324061	/nfs/dbraw/zinc/32/40/61/331324061.db2.gz	CWLVEPXCXFVPJK-HNNXBMFYSA-N	0	0	296.414	4.028	20	30		CIEDRN
C=CCOc1ccc(OCc2cccc3cccnc32)cc1	ZINC000462667731	331324896	/nfs/dbraw/zinc/32/48/96/331324896.db2.gz	TVJNYTPUEYWFHQ-UHFFFAOYSA-N	0	0	291.350	4.379	20	30		CIEDRN
COc1cc(CNc2cccc(C3CCC3)c2)ccc1C#N	ZINC000462868460	331333351	/nfs/dbraw/zinc/33/33/51/331333351.db2.gz	AHSSKGXKXRMHIY-UHFFFAOYSA-N	0	0	292.382	4.446	20	30		CIEDRN
N#C[C@@H]1CCC[C@@H](Nc2cccc(C3CCC3)c2)C1	ZINC000462872033	331333485	/nfs/dbraw/zinc/33/34/85/331333485.db2.gz	SSSDPIRKDDZHMC-CZUORRHYSA-N	0	0	254.377	4.448	20	30		CIEDRN
N#Cc1cccc(Cl)c1N[C@@H]1CSc2ccccc21	ZINC000462875888	331333727	/nfs/dbraw/zinc/33/37/27/331333727.db2.gz	UPBDVFSZKFLJGB-CYBMUJFWSA-N	0	0	286.787	4.471	20	30		CIEDRN
COc1ccc([C@H](C)CCNc2ccc(C#N)cc2)cc1	ZINC000462875047	331333748	/nfs/dbraw/zinc/33/37/48/331333748.db2.gz	FTLCKYLXZDHBAR-CQSZACIVSA-N	0	0	280.371	4.173	20	30		CIEDRN
N#Cc1ccc(N[C@@H]2C[C@H]2Cc2ccccc2)cc1Cl	ZINC000462883773	331333904	/nfs/dbraw/zinc/33/39/04/331333904.db2.gz	NNYDTSGGHOHMJQ-RHSMWYFYSA-N	0	0	282.774	4.255	20	30		CIEDRN
COc1ccc([C@@H](C)CCNc2cccc(F)c2C#N)cc1	ZINC000462883276	331333983	/nfs/dbraw/zinc/33/39/83/331333983.db2.gz	JGJDGSACGUEEJR-ZDUSSCGKSA-N	0	0	298.361	4.312	20	30		CIEDRN
C[C@@H]1CN(c2cccc(F)c2C#N)CC[C@H]1c1ccccc1	ZINC000462903143	331334430	/nfs/dbraw/zinc/33/44/30/331334430.db2.gz	QSBAWZORKBBBDW-GDBMZVCRSA-N	0	0	294.373	4.327	20	30		CIEDRN
C[C@@H](CNc1ccc(F)cc1C#N)c1ccc(F)cc1F	ZINC000463025751	331337434	/nfs/dbraw/zinc/33/74/34/331337434.db2.gz	WXLTVRAERCSZEJ-JTQLQIEISA-N	0	0	290.288	4.191	20	30		CIEDRN
Cc1ccc2sc(C(=O)Nc3ccccc3C#N)cc2c1	ZINC000463067714	331339264	/nfs/dbraw/zinc/33/92/64/331339264.db2.gz	IJPUMIKVRVYYGB-UHFFFAOYSA-N	0	0	292.363	4.334	20	30		CIEDRN
Cc1ccc2oc(Sc3ccc(C#N)cc3F)nc2c1	ZINC000463081987	331339765	/nfs/dbraw/zinc/33/97/65/331339765.db2.gz	LPEOPIFCDFJTPV-UHFFFAOYSA-N	0	0	284.315	4.298	20	30		CIEDRN
C=CCCCCC[N@@H+](C)Cc1cncc(C(F)(F)F)c1	ZINC000463102353	331340261	/nfs/dbraw/zinc/34/02/61/331340261.db2.gz	QARKKHZTSOEALM-UHFFFAOYSA-N	0	0	286.341	4.279	20	30		CIEDRN
C=CCCCSc1nnc(CCCc2ccccc2)o1	ZINC000463227221	331343086	/nfs/dbraw/zinc/34/30/86/331343086.db2.gz	DMAJMQNJONEKKP-UHFFFAOYSA-N	0	0	288.416	4.303	20	30		CIEDRN
CCCCN1CCc2ccc(N[C@@H]3CCC[C@H](C#N)C3)cc21	ZINC000463243352	331343959	/nfs/dbraw/zinc/34/39/59/331343959.db2.gz	PHDRJLKEYKFGNU-DOTOQJQBSA-N	0	0	297.446	4.343	20	30		CIEDRN
CCOc1ccccc1OCCSc1ccc(C#N)cc1	ZINC000463254708	331344489	/nfs/dbraw/zinc/34/44/89/331344489.db2.gz	JSGZGDGIBQSAKY-UHFFFAOYSA-N	0	0	299.395	4.128	20	30		CIEDRN
C=CCC[C@@H](C(=O)N(CCC)CC1CC1)c1ccccc1	ZINC000463261741	331344645	/nfs/dbraw/zinc/34/46/45/331344645.db2.gz	IZWCSYCFUGBWTN-GOSISDBHSA-N	0	0	285.431	4.385	20	30		CIEDRN
CCCOc1cc(C)ccc1N[C@H]1CCC[C@H](C#N)C1	ZINC000463278512	331344908	/nfs/dbraw/zinc/34/49/08/331344908.db2.gz	CSFPMVQZKCWIOQ-GJZGRUSLSA-N	0	0	272.392	4.278	20	30		CIEDRN
CCCOc1cc(C)ccc1N[C@@H]1CCC[C@@H](C#N)C1	ZINC000463278513	331344926	/nfs/dbraw/zinc/34/49/26/331344926.db2.gz	CSFPMVQZKCWIOQ-HUUCEWRRSA-N	0	0	272.392	4.278	20	30		CIEDRN
CCCOc1cc(C)ccc1N[C@H]1CCC[C@@H](C#N)C1	ZINC000463278511	331344932	/nfs/dbraw/zinc/34/49/32/331344932.db2.gz	CSFPMVQZKCWIOQ-CABCVRRESA-N	0	0	272.392	4.278	20	30		CIEDRN
CCCOc1cc(C)ccc1N[C@@H]1CCC[C@H](C#N)C1	ZINC000463278514	331344948	/nfs/dbraw/zinc/34/49/48/331344948.db2.gz	CSFPMVQZKCWIOQ-LSDHHAIUSA-N	0	0	272.392	4.278	20	30		CIEDRN
Cc1c(Br)cccc1N[C@@H]1CCC[C@@H](C#N)C1	ZINC000463287185	331345233	/nfs/dbraw/zinc/34/52/33/331345233.db2.gz	JESPOYDMTXPHJG-VXGBXAGGSA-N	0	0	293.208	4.252	20	30		CIEDRN
Cc1ccc(N[C@@H]2CCC[C@@H](C#N)C2)c(Br)c1	ZINC000463288415	331345253	/nfs/dbraw/zinc/34/52/53/331345253.db2.gz	OYOQOCCKQOKXQQ-VXGBXAGGSA-N	0	0	293.208	4.252	20	30		CIEDRN
CC#CCSCc1csc(-c2cccs2)n1	ZINC000464093850	331356791	/nfs/dbraw/zinc/35/67/91/331356791.db2.gz	QISIAWXWQLENBE-UHFFFAOYSA-N	0	0	265.428	4.128	20	30		CIEDRN
CCCC[C@H](CC)CC(=O)N[C@](C)(C#N)C(C)(C)C	ZINC000464155348	331357020	/nfs/dbraw/zinc/35/70/20/331357020.db2.gz	CUWLCPBIJNACMP-XJKSGUPXSA-N	0	0	266.429	4.037	20	30		CIEDRN
C[C@H](CC(=O)N[C@@](C)(C#N)C(C)(C)C)C1CCCCC1	ZINC000464158768	331357264	/nfs/dbraw/zinc/35/72/64/331357264.db2.gz	PNFQOTZCWZCIQS-DYVFJYSZSA-N	0	0	278.440	4.037	20	30		CIEDRN
C[C@@H](CC1CCCCC1)C(=O)N[C@](C)(C#N)C(C)(C)C	ZINC000464158098	331357276	/nfs/dbraw/zinc/35/72/76/331357276.db2.gz	MAKCTTXOZYLZRV-SUMWQHHRSA-N	0	0	278.440	4.037	20	30		CIEDRN
CCC(C)(C)[C@H]1CCCN1C(=O)[C@H](C)c1cccc(C#N)c1	ZINC000464213356	331358131	/nfs/dbraw/zinc/35/81/31/331358131.db2.gz	XLKNPWZDNZTHDO-RHSMWYFYSA-N	0	0	298.430	4.089	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)[C@@H](CC)CCCC	ZINC000464325349	331359671	/nfs/dbraw/zinc/35/96/71/331359671.db2.gz	BRKSUIFPRTZZIG-HNNXBMFYSA-N	0	0	277.408	4.053	20	30		CIEDRN
CC[C@H](C)N(C(=O)[C@@H](C)c1cccc(C#N)c1)[C@@H](C)CC	ZINC000464335299	331359776	/nfs/dbraw/zinc/35/97/76/331359776.db2.gz	MTBRPBSKMQQMLG-KKUMJFAQSA-N	0	0	286.419	4.087	20	30		CIEDRN
CCC(CC)C(=O)N[C@@H](C#N)c1c(Cl)cccc1Cl	ZINC000464395805	331360185	/nfs/dbraw/zinc/36/01/85/331360185.db2.gz	FZMSNFOKYVRFIW-LBPRGKRZSA-N	0	0	299.201	4.110	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](CC(F)(F)F)c1ccccc1	ZINC000464435168	331360477	/nfs/dbraw/zinc/36/04/77/331360477.db2.gz	CLOAIANIUPXCDI-JSGCOSHPSA-N	0	0	299.336	4.399	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC)[C@H](C)c1ccc(F)cc1	ZINC000464435417	331360515	/nfs/dbraw/zinc/36/05/15/331360515.db2.gz	DAWXCVJJVIDWON-UONOGXRCSA-N	0	0	277.383	4.338	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H](CCC)C1CCCCC1	ZINC000464436783	331360570	/nfs/dbraw/zinc/36/05/70/331360570.db2.gz	FLEKBOHMUULRHD-INIZCTEOSA-N	0	0	263.425	4.045	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(OCC)c(Cl)c1	ZINC000464439911	331360650	/nfs/dbraw/zinc/36/06/50/331360650.db2.gz	FYEYGFIUHPNIQI-NSHDSACASA-N	0	0	281.783	4.280	20	30		CIEDRN
CC#CCCCC(=O)N[C@H](c1ccccc1)C1CCCC1	ZINC000464440442	331360686	/nfs/dbraw/zinc/36/06/86/331360686.db2.gz	JKRXDZQMXCHJQM-LJQANCHMSA-N	0	0	283.415	4.228	20	30		CIEDRN
CC#CCCCC(=O)N(C1CC1)C1CCC(CC)CC1	ZINC000464439878	331360711	/nfs/dbraw/zinc/36/07/11/331360711.db2.gz	FTUHPVSOFJGDRI-UHFFFAOYSA-N	0	0	275.436	4.140	20	30		CIEDRN
CC[C@H](C(=O)N(CCC#N)C(C)(C)CC)c1ccccc1	ZINC000464463050	331361069	/nfs/dbraw/zinc/36/10/69/331361069.db2.gz	TZNATHCWYNBUDW-INIZCTEOSA-N	0	0	286.419	4.111	20	30		CIEDRN
N#CCCCC(=O)N1CCCCC[C@@H]1/C=C\c1ccccc1	ZINC000464495175	331361511	/nfs/dbraw/zinc/36/15/11/331361511.db2.gz	LZMIIKBKPYMCSF-SWNWVQGVSA-N	0	0	296.414	4.165	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NC(c1ccccc1)c1ccccc1	ZINC000464527186	331361795	/nfs/dbraw/zinc/36/17/95/331361795.db2.gz	PRURYMNUSIVOOX-MRXNPFEDSA-N	0	0	293.410	4.495	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@@H](C)c1cc(C)ccc1C	ZINC000464525796	331361803	/nfs/dbraw/zinc/36/18/03/331361803.db2.gz	OPXNGNPQRNOLHS-CVEARBPZSA-N	0	0	273.420	4.425	20	30		CIEDRN
CC#CCCCC(=O)N(C)[C@H](C)c1ccc(C)cc1C	ZINC000464518427	331361818	/nfs/dbraw/zinc/36/18/18/331361818.db2.gz	FPUUNXGNSZLEAZ-MRXNPFEDSA-N	0	0	271.404	4.016	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CCC)Cc1ccc(F)cc1	ZINC000464530987	331361929	/nfs/dbraw/zinc/36/19/29/331361929.db2.gz	VSXGMZFAEYKKGW-AWEZNQCLSA-N	0	0	277.383	4.167	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)Cc1ccc(C(C)C)cc1	ZINC000464546685	331362179	/nfs/dbraw/zinc/36/21/79/331362179.db2.gz	GJWXGXGDOKZGTL-OAHLLOKOSA-N	0	0	273.420	4.371	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCSc2ccc(Cl)cc21	ZINC000464547050	331362261	/nfs/dbraw/zinc/36/22/61/331362261.db2.gz	UCASUMSDXOZTTA-NSHDSACASA-N	0	0	295.835	4.381	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cccc2ccccc21	ZINC000464554529	331362431	/nfs/dbraw/zinc/36/24/31/331362431.db2.gz	MRZAETBGTUWTAX-CYBMUJFWSA-N	0	0	253.345	4.381	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000464553548	331362445	/nfs/dbraw/zinc/36/24/45/331362445.db2.gz	JOGBMUBBTUSHML-SECBINFHSA-N	0	0	255.720	4.020	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(C)c(Cl)c1	ZINC000464559007	331362472	/nfs/dbraw/zinc/36/24/72/331362472.db2.gz	SHVAGXNJTMBCQG-NSHDSACASA-N	0	0	251.757	4.189	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccnn1[C@@H](C)CC(C)C	ZINC000464563417	331362675	/nfs/dbraw/zinc/36/26/75/331362675.db2.gz	JZZCVSUOKSQBOD-KBPBESRZSA-N	0	0	277.412	4.031	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC)c1ccccc1Cl	ZINC000464564099	331362679	/nfs/dbraw/zinc/36/26/79/331362679.db2.gz	BELGXMQMLAOUOC-GFCCVEGCSA-N	0	0	265.784	4.295	20	30		CIEDRN
CC#CCCCC(=O)Nc1nc(-c2ccccc2C)cs1	ZINC000464566010	331362693	/nfs/dbraw/zinc/36/26/93/331362693.db2.gz	CWXLYPFKZARQLD-UHFFFAOYSA-N	0	0	298.411	4.251	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(Cc1ccc(Cl)cc1)C1CC1	ZINC000464565687	331362738	/nfs/dbraw/zinc/36/27/38/331362738.db2.gz	CPNANLUSANODLU-ZDUSSCGKSA-N	0	0	291.822	4.433	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H](c1ccc(F)cc1)C(C)(C)C	ZINC000464566327	331362888	/nfs/dbraw/zinc/36/28/88/331362888.db2.gz	ANHXGRKTOWNXSH-KRWDZBQOSA-N	0	0	289.394	4.223	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC(C)C)C1CCCC1	ZINC000464573076	331362953	/nfs/dbraw/zinc/36/29/53/331362953.db2.gz	XFPXMNDCVSVKCR-CQSZACIVSA-N	0	0	251.414	4.016	20	30		CIEDRN
CC#CCCCC(=O)N(Cc1ccccc1F)CC(C)C	ZINC000464575369	331363098	/nfs/dbraw/zinc/36/30/98/331363098.db2.gz	ZKQIJXBNFGBEPD-UHFFFAOYSA-N	0	0	289.394	4.004	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@H]1CCCC[C@H]1C(F)(F)F	ZINC000464607603	331363785	/nfs/dbraw/zinc/36/37/85/331363785.db2.gz	KOOHXRCIYDXFAP-UPJWGTAASA-N	0	0	291.357	4.168	20	30		CIEDRN
CC[C@H](CC(=O)Nc1ccc(C#N)c(F)c1)c1ccccc1	ZINC000464641601	331364037	/nfs/dbraw/zinc/36/40/37/331364037.db2.gz	FDOLTTFJYDNJDR-CYBMUJFWSA-N	0	0	296.345	4.220	20	30		CIEDRN
N#Cc1ccc(NC(=O)CC/C=C\c2ccccc2)cc1F	ZINC000464639304	331364045	/nfs/dbraw/zinc/36/40/45/331364045.db2.gz	TXQXCVGLQQXRBF-YWEYNIOJSA-N	0	0	294.329	4.129	20	30		CIEDRN
CC#CCCCC(=O)N1CCC[C@@H]1CC1CCCCC1	ZINC000464647069	331364112	/nfs/dbraw/zinc/36/41/12/331364112.db2.gz	DNDSSSXAMQXSJN-QGZVFWFLSA-N	0	0	275.436	4.141	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCC(C)(C)c1cccc(Cl)c1	ZINC000464645737	331364155	/nfs/dbraw/zinc/36/41/55/331364155.db2.gz	DNPSANYTYBPWJZ-CYBMUJFWSA-N	0	0	293.838	4.336	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCc1ccc2[nH]c(C)c(C)c2c1	ZINC000464648282	331364236	/nfs/dbraw/zinc/36/42/36/331364236.db2.gz	NDWDYURUQPMUIA-LBPRGKRZSA-N	0	0	284.403	4.003	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H]1CCCC[C@@H]1c1ccccc1	ZINC000464650694	331364239	/nfs/dbraw/zinc/36/42/39/331364239.db2.gz	AKVGNDARWVOESF-JQHSSLGASA-N	0	0	285.431	4.431	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)CCc1cccc2ccccc21	ZINC000464647988	331364258	/nfs/dbraw/zinc/36/42/58/331364258.db2.gz	OVUKIFBKJOMAPP-INIZCTEOSA-N	0	0	295.426	4.443	20	30		CIEDRN
C[C@H](CCC(=O)Nc1ccc(C#N)c(F)c1)c1ccccc1	ZINC000464650380	331364259	/nfs/dbraw/zinc/36/42/59/331364259.db2.gz	SHTMADWMFVFGNV-CYBMUJFWSA-N	0	0	296.345	4.220	20	30		CIEDRN
Cc1cccc2cc(C(=O)Nc3ccc(C#N)c(F)c3)oc21	ZINC000464651055	331364261	/nfs/dbraw/zinc/36/42/61/331364261.db2.gz	QGDHZIYEBYPCOE-UHFFFAOYSA-N	0	0	294.285	4.004	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(O[C@H](C)CC)cc1	ZINC000464647880	331364262	/nfs/dbraw/zinc/36/42/62/331364262.db2.gz	CDULQDAAKYFTQG-ZIAGYGMSSA-N	0	0	275.392	4.405	20	30		CIEDRN
CC#CCCCC(=O)N[C@H]1CCCC[C@@H]1c1ccccc1	ZINC000464653545	331364369	/nfs/dbraw/zinc/36/43/69/331364369.db2.gz	SPOVBWLQFGQDCB-MSOLQXFVSA-N	0	0	283.415	4.023	20	30		CIEDRN
CCCCC1CCC(C(=O)N[C@H](C#N)C(C)(C)C)CC1	ZINC000464708321	331364967	/nfs/dbraw/zinc/36/49/67/331364967.db2.gz	GTBNOCXMKKXLMH-YMAMQOFZSA-N	0	0	278.440	4.037	20	30		CIEDRN
CCCCC1CCC(C(=O)N[C@@H](C#N)C(C)(C)C)CC1	ZINC000464708318	331365037	/nfs/dbraw/zinc/36/50/37/331365037.db2.gz	GTBNOCXMKKXLMH-NRXISQOPSA-N	0	0	278.440	4.037	20	30		CIEDRN
CCC[C@H](CC1CCCC1)C(=O)N[C@H](C#N)C(C)(C)C	ZINC000464710255	331365055	/nfs/dbraw/zinc/36/50/55/331365055.db2.gz	JSQDNRCCNQOHQU-HUUCEWRRSA-N	0	0	278.440	4.037	20	30		CIEDRN
Cc1cccc2c1[C@H](C)C[C@@H]2CC(=O)N[C@@H](C#N)C(C)(C)C	ZINC000464712421	331365069	/nfs/dbraw/zinc/36/50/69/331365069.db2.gz	QIFKQWBROPQOFH-FMKPAKJESA-N	0	0	298.430	4.030	20	30		CIEDRN
CCC[C@@H](CC1CCCC1)C(=O)N[C@H](C#N)C(C)(C)C	ZINC000464710256	331365113	/nfs/dbraw/zinc/36/51/13/331365113.db2.gz	JSQDNRCCNQOHQU-LSDHHAIUSA-N	0	0	278.440	4.037	20	30		CIEDRN
C[C@@H]1CCN(Cc2ccc(F)cc2C#N)[C@@H](c2ccco2)C1	ZINC000464854814	331371332	/nfs/dbraw/zinc/37/13/32/331371332.db2.gz	RBRIMZBZFLMERM-CXAGYDPISA-N	0	0	298.361	4.264	20	30		CIEDRN
C=C[C@@H](C)NC(=O)CCCc1ccc(Cl)c(Cl)c1	ZINC000465108133	331378584	/nfs/dbraw/zinc/37/85/84/331378584.db2.gz	JWJCDBVWUINVJG-SNVBAGLBSA-N	0	0	286.202	4.007	20	30		CIEDRN
C=C[C@H](C)NC(=O)c1cc2sc3ccccc3c2s1	ZINC000465113376	331378708	/nfs/dbraw/zinc/37/87/08/331378708.db2.gz	RANYFMHFMJSAAS-VIFPVBQESA-N	0	0	287.409	4.420	20	30		CIEDRN
C=C[C@@H](C)NC(=O)c1ccc(-c2ccc(C)cc2)cc1F	ZINC000465112977	331378758	/nfs/dbraw/zinc/37/87/58/331378758.db2.gz	QRDLMSQOZRJUOM-CYBMUJFWSA-N	0	0	283.346	4.105	20	30		CIEDRN
C=C[C@@H](C)NC(=O)C(CC)(CC)c1ccc(Cl)cc1	ZINC000465116478	331378962	/nfs/dbraw/zinc/37/89/62/331378962.db2.gz	AWBAUSMTLDCBNO-GFCCVEGCSA-N	0	0	279.811	4.089	20	30		CIEDRN
C=C[C@H](C)NC(=O)Nc1ccccc1-c1cccs1	ZINC000465176954	331380242	/nfs/dbraw/zinc/38/02/42/331380242.db2.gz	MTZXERCOWYFUOO-NSHDSACASA-N	0	0	272.373	4.111	20	30		CIEDRN
C=C[C@@H](C)NC(=O)Nc1cccc(COC(C)(C)C)c1C	ZINC000465234558	331380697	/nfs/dbraw/zinc/38/06/97/331380697.db2.gz	NSHDIQJYRRNHGU-GFCCVEGCSA-N	0	0	290.407	4.006	20	30		CIEDRN
C=C[C@H](C)NC(=O)Nc1ccc2nc(C(C)C)sc2c1	ZINC000465250427	331380800	/nfs/dbraw/zinc/38/08/00/331380800.db2.gz	FXUKWGVSGAPXLJ-JTQLQIEISA-N	0	0	289.404	4.116	20	30		CIEDRN
C=C[C@@H](C)NC(=O)N[C@H](c1cccs1)C(CC)CC	ZINC000465287314	331381340	/nfs/dbraw/zinc/38/13/40/331381340.db2.gz	CPGHCFVANYVZLX-RISCZKNCSA-N	0	0	280.437	4.099	20	30		CIEDRN
CCOC(=O)CCCCSc1ccc(C#N)cc1Cl	ZINC000465387140	331382704	/nfs/dbraw/zinc/38/27/04/331382704.db2.gz	FZSMLLRXOLSSGW-UHFFFAOYSA-N	0	0	297.807	4.037	20	30		CIEDRN
C=CCCCCCN(C)C(=O)N[C@@H]1CC[C@H]2CCC[C@H]2C1	ZINC000466135839	331389633	/nfs/dbraw/zinc/38/96/33/331389633.db2.gz	RJEPSCPVUDWWDC-IXDOHACOSA-N	0	0	292.467	4.343	20	30		CIEDRN
C=CCOc1cccc(NC(=O)N[C@@H](C)C[C@@H](C)CC)c1	ZINC000466172757	331390608	/nfs/dbraw/zinc/39/06/08/331390608.db2.gz	KUSMBERCLFOKLB-KBPBESRZSA-N	0	0	290.407	4.198	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(OCCC)cc1	ZINC000466244428	331391558	/nfs/dbraw/zinc/39/15/58/331391558.db2.gz	JLCFWKXUCRWRHC-CYBMUJFWSA-N	0	0	261.365	4.016	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc2cccc(Cl)c2n1	ZINC000466269472	331391938	/nfs/dbraw/zinc/39/19/38/331391938.db2.gz	WRSFRRPZNDPQQU-NSHDSACASA-N	0	0	288.778	4.429	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000466267857	331391945	/nfs/dbraw/zinc/39/19/45/331391945.db2.gz	YRTKJPUQKITGJU-GGERZCOJSA-N	0	0	283.415	4.293	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(C)[C@@H](C)c1ccc(C)cc1	ZINC000466367687	331393586	/nfs/dbraw/zinc/39/35/86/331393586.db2.gz	YJVBRWQXNSMUPM-GOEBONIOSA-N	0	0	274.408	4.052	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(CC)[C@@H](C)c1ccc(F)cc1	ZINC000466366574	331393604	/nfs/dbraw/zinc/39/36/04/331393604.db2.gz	JIWTWXLDKSFSCI-BBRMVZONSA-N	0	0	292.398	4.273	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CCc2sccc2[C@@H]1CC	ZINC000466382443	331394149	/nfs/dbraw/zinc/39/41/49/331394149.db2.gz	GVEFOIGSWXOCLF-JSGCOSHPSA-N	0	0	292.448	4.122	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(C)CCCCc1ccccc1	ZINC000466385254	331394203	/nfs/dbraw/zinc/39/42/03/331394203.db2.gz	CBLKLKGKZZNROG-QGZVFWFLSA-N	0	0	288.435	4.005	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(CC(C)C)CC(C)(C)C	ZINC000466395907	331394726	/nfs/dbraw/zinc/39/47/26/331394726.db2.gz	MBJQDOBQGLVBNM-AWEZNQCLSA-N	0	0	268.445	4.055	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(C)[C@@H](C)c1c(F)cccc1F	ZINC000466402731	331395134	/nfs/dbraw/zinc/39/51/34/331395134.db2.gz	AGJNIJAUPAXBGB-RYUDHWBXSA-N	0	0	296.361	4.022	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1cccc(Cl)c1C	ZINC000466405807	331395392	/nfs/dbraw/zinc/39/53/92/331395392.db2.gz	ITYDCLKFYAATLS-NSHDSACASA-N	0	0	266.772	4.125	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1c(CC)cccc1CC	ZINC000466409816	331395648	/nfs/dbraw/zinc/39/56/48/331395648.db2.gz	OLXRKHRRCWCRIL-HNNXBMFYSA-N	0	0	274.408	4.288	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](c1ccccc1C)C(C)C	ZINC000466418055	331396019	/nfs/dbraw/zinc/39/60/19/331396019.db2.gz	UMFGVZJGUUKWGX-RDJZCZTQSA-N	0	0	273.420	4.411	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H](c1ccccc1C)C(C)(C)C	ZINC000466425616	331396638	/nfs/dbraw/zinc/39/66/38/331396638.db2.gz	ODSSMUCOMJQNPQ-SFHVURJKSA-N	0	0	285.431	4.392	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1C[C@H](c2ccccc2)C(C)(C)C1	ZINC000466428131	331396800	/nfs/dbraw/zinc/39/68/00/331396800.db2.gz	ITUUKYCZLFANCE-DOTOQJQBSA-N	0	0	285.431	4.241	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCCCC[C@@H]1CC(C)C	ZINC000466430680	331396901	/nfs/dbraw/zinc/39/69/01/331396901.db2.gz	HWBAHNSPAFWXIX-JKSUJKDBSA-N	0	0	265.441	4.406	20	30		CIEDRN
CC#CCCCC(=O)N(CC1CCC1)c1ccccc1	ZINC000466431761	331396918	/nfs/dbraw/zinc/39/69/18/331396918.db2.gz	RLJWGHQWSJXGAZ-UHFFFAOYSA-N	0	0	269.388	4.013	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC(C)C)C(CC)CC	ZINC000466435360	331397005	/nfs/dbraw/zinc/39/70/05/331397005.db2.gz	SLGZSMRNRKJNDI-AWEZNQCLSA-N	0	0	253.430	4.262	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@H](CC)Cc1ccc(C)cc1	ZINC000466438643	331397058	/nfs/dbraw/zinc/39/70/58/331397058.db2.gz	NIXQEPNOUFXGFY-FUHWJXTLSA-N	0	0	287.447	4.377	20	30		CIEDRN
CC#CCCCC(=O)N(CC)[C@H](CC)Cc1ccccc1	ZINC000466438150	331397118	/nfs/dbraw/zinc/39/71/18/331397118.db2.gz	JSPMMOPFCJPUCN-GOSISDBHSA-N	0	0	285.431	4.050	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NC[C@H]1CCC[C@H](C(F)(F)F)C1	ZINC000466437434	331397120	/nfs/dbraw/zinc/39/71/20/331397120.db2.gz	BVDVMGNYNLDOKD-AVGNSLFASA-N	0	0	291.357	4.074	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@H](CC)Cc1ccc(C)cc1	ZINC000466438644	331397139	/nfs/dbraw/zinc/39/71/39/331397139.db2.gz	NIXQEPNOUFXGFY-SJLPKXTDSA-N	0	0	287.447	4.377	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccnc(Oc2ccccc2)c1	ZINC000466443912	331397194	/nfs/dbraw/zinc/39/71/94/331397194.db2.gz	ODXYLMYJZTUWAJ-UHFFFAOYSA-N	0	0	294.354	4.006	20	30		CIEDRN
C=CCC[C@H](NC(=O)[C@H](C)CC(=C)C)c1ccccc1	ZINC000466441091	331397199	/nfs/dbraw/zinc/39/71/99/331397199.db2.gz	LPVFKRHBTUVMBN-WBVHZDCISA-N	0	0	271.404	4.412	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccnc(Oc2ccccc2)c1	ZINC000466443188	331397218	/nfs/dbraw/zinc/39/72/18/331397218.db2.gz	CCXGNDAMJMBZJI-CQSZACIVSA-N	0	0	296.370	4.415	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](C1CCCCC1)C(F)(F)F	ZINC000466440583	331397259	/nfs/dbraw/zinc/39/72/59/331397259.db2.gz	DFHPMGBHFJKJHU-YPMHNXCESA-N	0	0	291.357	4.216	20	30		CIEDRN
CC(C)(C)Nc1ccccc1NC(=O)c1ccc(C#N)cc1	ZINC000466472193	331397914	/nfs/dbraw/zinc/39/79/14/331397914.db2.gz	WOFPMCIBCPZANG-UHFFFAOYSA-N	0	0	293.370	4.021	20	30		CIEDRN
CC(C)(C)Nc1ccccc1NC(=O)c1cccc(C#N)c1	ZINC000466512224	331398748	/nfs/dbraw/zinc/39/87/48/331398748.db2.gz	DCYBYBNZLJDFBI-UHFFFAOYSA-N	0	0	293.370	4.021	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N[C@H](CC)CC=C	ZINC000466528162	331399061	/nfs/dbraw/zinc/39/90/61/331399061.db2.gz	KGJUOVBYWWHURZ-CYBMUJFWSA-N	0	0	275.417	4.049	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1ccccc1SC(C)C	ZINC000466526984	331399088	/nfs/dbraw/zinc/39/90/88/331399088.db2.gz	CTTZFGKWDNOYNZ-CYBMUJFWSA-N	0	0	277.433	4.272	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@@H](Sc1ccccc1)C(C)C	ZINC000466528021	331399125	/nfs/dbraw/zinc/39/91/25/331399125.db2.gz	GPCPGEWMQJDRME-HOCLYGCPSA-N	0	0	291.460	4.274	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)[C@H](CCC)c1ccccc1	ZINC000466534001	331399282	/nfs/dbraw/zinc/39/92/82/331399282.db2.gz	LXMVDKHOZXDLDW-HZPDHXFCSA-N	0	0	259.393	4.041	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)C1(CC(C)C)CCCC1	ZINC000466540062	331399469	/nfs/dbraw/zinc/39/94/69/331399469.db2.gz	DEYUZCLTGSNTLN-AWEZNQCLSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@@H](CC)Sc1ccccc1	ZINC000466542385	331399556	/nfs/dbraw/zinc/39/95/56/331399556.db2.gz	QMKPJQZPPLZPQI-DZGCQCFKSA-N	0	0	277.433	4.028	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)C(CC)(CC)c1ccccc1	ZINC000466543376	331399574	/nfs/dbraw/zinc/39/95/74/331399574.db2.gz	UHCKVMAGXIIMFO-INIZCTEOSA-N	0	0	273.420	4.215	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H](C(C)(C)C)CC1	ZINC000466662663	331402106	/nfs/dbraw/zinc/40/21/06/331402106.db2.gz	ZLQXLMOVIVMATE-LSDHHAIUSA-N	0	0	265.441	4.264	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@@]1(C)Cc1ccccc1	ZINC000466699413	331402511	/nfs/dbraw/zinc/40/25/11/331402511.db2.gz	IBWHBFLDDAWIRR-FQEVSTJZSA-N	0	0	297.442	4.379	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccc2ccn(CCC)c2c1	ZINC000466859463	331406498	/nfs/dbraw/zinc/40/64/98/331406498.db2.gz	OZOAULONNSFFMN-UHFFFAOYSA-N	0	0	282.387	4.183	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1sc(C)c(CC)c1C#N	ZINC000466868674	331406896	/nfs/dbraw/zinc/40/68/96/331406896.db2.gz	SPWYCYVLAJTLQS-JTQLQIEISA-N	0	0	276.405	4.031	20	30		CIEDRN
CC#CCCCC(=O)N(c1ccc(F)cc1)C1CCCC1	ZINC000466872981	331406962	/nfs/dbraw/zinc/40/69/62/331406962.db2.gz	GIQXDJBQUVESRU-UHFFFAOYSA-N	0	0	287.378	4.295	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](c2ccccc2)C[C@H]1C	ZINC000466893661	331407391	/nfs/dbraw/zinc/40/73/91/331407391.db2.gz	JBUCRACTDILTET-LZLYRXPVSA-N	0	0	285.431	4.383	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](c2ccccc2)C[C@H]1C	ZINC000466893660	331407393	/nfs/dbraw/zinc/40/73/93/331407393.db2.gz	JBUCRACTDILTET-JZXOWHBKSA-N	0	0	285.431	4.383	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CC[C@H](c2ccccc2)C[C@@H]1C	ZINC000466901727	331407544	/nfs/dbraw/zinc/40/75/44/331407544.db2.gz	ADWATEWWNCMLCP-VDZJLULYSA-N	0	0	285.431	4.383	20	30		CIEDRN
C=CCN(CC=C)C(=O)c1ccc(C(C)C)c(Cl)c1	ZINC000466900616	331407579	/nfs/dbraw/zinc/40/75/79/331407579.db2.gz	UCJOGRSCSUWQAU-UHFFFAOYSA-N	0	0	277.795	4.278	20	30		CIEDRN
C=CCCN(C)C(=O)N[C@H](C)c1cccc2ccccc21	ZINC000466940560	331408896	/nfs/dbraw/zinc/40/88/96/331408896.db2.gz	XXFMPRBLJQOQMT-CQSZACIVSA-N	0	0	282.387	4.118	20	30		CIEDRN
CC(C)C[C@H]1CCN(c2c(Cl)cccc2C#N)C1	ZINC000467017291	331410572	/nfs/dbraw/zinc/41/05/72/331410572.db2.gz	QOQIVUMMATXPNH-GFCCVEGCSA-N	0	0	262.784	4.084	20	30		CIEDRN
C=CCCN(C)C(=O)C1(c2ccc(Cl)cc2)CCCC1	ZINC000467082575	331410910	/nfs/dbraw/zinc/41/09/10/331410910.db2.gz	QZSQPOLQYABGJE-UHFFFAOYSA-N	0	0	291.822	4.186	20	30		CIEDRN
CC[C@@H]1CCCC[C@@H]1N(C)C(=O)Nc1cc(C#N)ccc1C	ZINC000467109382	331411186	/nfs/dbraw/zinc/41/11/86/331411186.db2.gz	GEIPIGWOWMCRMH-WBVHZDCISA-N	0	0	299.418	4.299	20	30		CIEDRN
C=CCCN(C)C(=O)N[C@@H]1CCC(C)(C)c2ccccc21	ZINC000467112888	331411215	/nfs/dbraw/zinc/41/12/15/331411215.db2.gz	XZVBREUNHLZNKS-MRXNPFEDSA-N	0	0	286.419	4.017	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H]1CCC[C@H]1Cc1ccccc1	ZINC000467336242	331415367	/nfs/dbraw/zinc/41/53/67/331415367.db2.gz	OHABDGHWYMGOHD-RBUKOAKNSA-N	0	0	297.442	4.282	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H]1CCC(C)(C)C[C@H]1C	ZINC000467371532	331416667	/nfs/dbraw/zinc/41/66/67/331416667.db2.gz	VKILCMORZDQAPT-UKRRQHHQSA-N	0	0	263.425	4.086	20	30		CIEDRN
CCC[C@@H](Nc1ccc(C#N)nc1)c1ccc(F)cc1F	ZINC000467440583	331419385	/nfs/dbraw/zinc/41/93/85/331419385.db2.gz	VKPQMVSOVHQSTM-MRXNPFEDSA-N	0	0	287.313	4.185	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@H](C)[C@@H]1CCC	ZINC000467521503	331421135	/nfs/dbraw/zinc/42/11/35/331421135.db2.gz	ZKVRPGZBTOGEAM-HOCLYGCPSA-N	0	0	263.425	4.182	20	30		CIEDRN
C=C(C)CN(CC)C(=O)[C@@H]1CCC[C@@H]2CCCC[C@H]12	ZINC000505356651	331422821	/nfs/dbraw/zinc/42/28/21/331422821.db2.gz	YWYQYYHOBWFRLK-HRCADAONSA-N	0	0	263.425	4.018	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000467743920	331423742	/nfs/dbraw/zinc/42/37/42/331423742.db2.gz	KRZYIGZJXWMPDU-UHFFFAOYSA-N	0	0	283.293	4.412	20	30		CIEDRN
N#Cc1cccc(Sc2ccnc(-c3ccccc3)n2)c1	ZINC000467786536	331424171	/nfs/dbraw/zinc/42/41/71/331424171.db2.gz	FOLUTRSMIQADSV-UHFFFAOYSA-N	0	0	289.363	4.166	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cc(Cl)ccc1N(C)C	ZINC000467823022	331424322	/nfs/dbraw/zinc/42/43/22/331424322.db2.gz	LTERNHFTBAGYHM-UHFFFAOYSA-N	0	0	292.810	4.113	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC)CC(CC)CC	ZINC000467824872	331424359	/nfs/dbraw/zinc/42/43/59/331424359.db2.gz	MTNZZQZGWRREQF-UHFFFAOYSA-N	0	0	251.414	4.040	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC)c1cc(C)ccc1C	ZINC000467824761	331424406	/nfs/dbraw/zinc/42/44/06/331424406.db2.gz	VRUONGUICZLXFK-UHFFFAOYSA-N	0	0	271.404	4.425	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cc(F)c(SC)c(F)c1	ZINC000467910159	331425350	/nfs/dbraw/zinc/42/53/50/331425350.db2.gz	MWLVUXXCFFCQBG-CQSZACIVSA-N	0	0	285.359	4.228	20	30		CIEDRN
C=CCOc1ccc(CN(C(=O)C2=CCC2)C(C)(C)C)cc1	ZINC000467912419	331425646	/nfs/dbraw/zinc/42/56/46/331425646.db2.gz	XHQKRLGFDFQDIH-UHFFFAOYSA-N	0	0	299.414	4.099	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(C(C)(C)C)ccc1O	ZINC000467941783	331425956	/nfs/dbraw/zinc/42/59/56/331425956.db2.gz	LXCJPQIGICYUDG-LBPRGKRZSA-N	0	0	275.392	4.231	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cccc2ccc(O)cc21	ZINC000467942128	331425962	/nfs/dbraw/zinc/42/59/62/331425962.db2.gz	ONNJZMCDTZEMMN-LBPRGKRZSA-N	0	0	269.344	4.086	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@@H](C)c1c(F)cccc1Cl	ZINC000467965442	331426156	/nfs/dbraw/zinc/42/61/56/331426156.db2.gz	ZEEMZDSIZXYCBR-BONVTDFDSA-N	0	0	283.774	4.259	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H](C)c1c(F)cccc1Cl	ZINC000467965443	331426184	/nfs/dbraw/zinc/42/61/84/331426184.db2.gz	ZEEMZDSIZXYCBR-MEBBXXQBSA-N	0	0	283.774	4.259	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](Cc2ccccc2)[C@H]1C	ZINC000467981391	331426204	/nfs/dbraw/zinc/42/62/04/331426204.db2.gz	FTVCYIHXORWPPV-HHXXYDBFSA-N	0	0	285.431	4.068	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H]1C[C@@H]1c1c(F)cccc1Cl	ZINC000468001181	331426572	/nfs/dbraw/zinc/42/65/72/331426572.db2.gz	BFCQRNJQFSDSGV-OWRWGESLSA-N	0	0	295.785	4.054	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H]1Cc1ccc(C)cc1	ZINC000468004518	331426588	/nfs/dbraw/zinc/42/65/88/331426588.db2.gz	MEXJIOZQYNEUNE-IEBWSBKVSA-N	0	0	285.431	4.131	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H]1CCC[C@@H]1c1ccccc1	ZINC000468025062	331426812	/nfs/dbraw/zinc/42/68/12/331426812.db2.gz	OZKZLZYVCFEHHG-SOLBZPMBSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cc(Br)ccc1C	ZINC000468102353	331428662	/nfs/dbraw/zinc/42/86/62/331428662.db2.gz	ORZHZGNMRXCQEX-CQSZACIVSA-N	0	0	296.208	4.298	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(OCCC)cc1C	ZINC000468105920	331428717	/nfs/dbraw/zinc/42/87/17/331428717.db2.gz	HLWLCCKBCSNNKF-KRWDZBQOSA-N	0	0	275.392	4.325	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@@H](C)c1ccccc1OC(F)F	ZINC000468118250	331428887	/nfs/dbraw/zinc/42/88/87/331428887.db2.gz	AQNIMILQRTXKRW-ZBEGNZNMSA-N	0	0	297.345	4.068	20	30		CIEDRN
Cc1cccc(C)c1Oc1ccccc1NC(=O)[C@H](C)C#N	ZINC000468130062	331429214	/nfs/dbraw/zinc/42/92/14/331429214.db2.gz	DRQBZRFSQPTIJJ-CQSZACIVSA-N	0	0	294.354	4.194	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@H](CC)CCCC	ZINC000468261396	331431341	/nfs/dbraw/zinc/43/13/41/331431341.db2.gz	OLDLHUKFXSTBBT-CQSZACIVSA-N	0	0	279.449	4.479	20	30		CIEDRN
CC1(C)CCC(SCCCSCC#N)CC1	ZINC000468388330	331433401	/nfs/dbraw/zinc/43/34/01/331433401.db2.gz	SFENAUBXFNCYBH-UHFFFAOYSA-N	0	0	257.468	4.335	20	30		CIEDRN
C=CCCCNC(=O)CSc1ccc2ccccc2c1	ZINC000468399682	331434199	/nfs/dbraw/zinc/43/41/99/331434199.db2.gz	NQBZIDUTWWPCGM-UHFFFAOYSA-N	0	0	285.412	4.014	20	30		CIEDRN
C[C@H]1CCCC[C@H]1OCCSc1cccc(C#N)c1	ZINC000468647890	331438130	/nfs/dbraw/zinc/43/81/30/331438130.db2.gz	MBJJSTSZDYODTE-XJKSGUPXSA-N	0	0	275.417	4.246	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)C[C@H]1CC[C@H](C)C1	ZINC000468812212	331440345	/nfs/dbraw/zinc/44/03/45/331440345.db2.gz	DGJGSOXRRLDHDP-GJZGRUSLSA-N	0	0	289.394	4.167	20	30		CIEDRN
Cc1cc(NCc2ccccc2C#N)ccc1C1CC1	ZINC000468835227	331440777	/nfs/dbraw/zinc/44/07/77/331440777.db2.gz	DIVMEDHYMHCIRG-UHFFFAOYSA-N	0	0	262.356	4.356	20	30		CIEDRN
Cc1ccc(C#N)cc1OCc1csc(C(C)(C)C)n1	ZINC000468882417	331441706	/nfs/dbraw/zinc/44/17/06/331441706.db2.gz	FUTUBNNTCDGWRB-UHFFFAOYSA-N	0	0	286.400	4.200	20	30		CIEDRN
C=CCOc1cccc(NC(=O)C2(CCC)CCC2)c1	ZINC000468923426	331442428	/nfs/dbraw/zinc/44/24/28/331442428.db2.gz	KXYVGEXTMYTARS-UHFFFAOYSA-N	0	0	273.376	4.160	20	30		CIEDRN
CCC(CC)CC(=O)Nc1sc2c(c1C#N)CCCC2	ZINC000469308428	331449381	/nfs/dbraw/zinc/44/93/81/331449381.db2.gz	VVSGMTHYZBOPIH-UHFFFAOYSA-N	0	0	290.432	4.263	20	30		CIEDRN
CC(C)[C@@H]1CCC[C@@H](NC(=O)c2ccc(CC#N)cc2)CC1	ZINC000469478594	331452558	/nfs/dbraw/zinc/45/25/58/331452558.db2.gz	UVKAYSALKALIGY-SJLPKXTDSA-N	0	0	298.430	4.087	20	30		CIEDRN
C=C(C)CNC(=O)c1sc2cc(C)c(C)cc2c1C	ZINC000469807812	331461544	/nfs/dbraw/zinc/46/15/44/331461544.db2.gz	ITRZLQBAHWMIPA-UHFFFAOYSA-N	0	0	273.401	4.132	20	30		CIEDRN
C=CCCCCCN(C)C(=O)C[C@H]1CCC[C@@H]1C	ZINC000469812519	331461752	/nfs/dbraw/zinc/46/17/52/331461752.db2.gz	YWJMFRMTNUXODF-LSDHHAIUSA-N	0	0	251.414	4.018	20	30		CIEDRN
Cc1ccccc1C(=O)NC1(C#N)CCC(C(C)(C)C)CC1	ZINC000470202599	331475291	/nfs/dbraw/zinc/47/52/91/331475291.db2.gz	JPPSYZVPPCZLBA-UHFFFAOYSA-N	0	0	298.430	4.224	20	30		CIEDRN
C=CC[C@H]1N(C(=O)c2cccc(C)c2)CCCC1(C)C	ZINC000470273988	331477437	/nfs/dbraw/zinc/47/74/37/331477437.db2.gz	OOHLYVXBSLIIKU-MRXNPFEDSA-N	0	0	271.404	4.202	20	30		CIEDRN
COc1ccc(/C=C\c2ccncc2C#N)c2ccccc12	ZINC000470280127	331477705	/nfs/dbraw/zinc/47/77/05/331477705.db2.gz	NHGJIDDVXFVGSD-SREVYHEPSA-N	0	0	286.334	4.285	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)C[C@@H](C)CC)CCCC1(C)C	ZINC000470287068	331478157	/nfs/dbraw/zinc/47/81/57/331478157.db2.gz	XZTPTDZESQZZBG-KBPBESRZSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=CC[C@H]1N(C(=O)[C@@H](C)CC(C)C)CCCC1(C)C	ZINC000470291549	331478233	/nfs/dbraw/zinc/47/82/33/331478233.db2.gz	ZRISLSKLEHJVQX-LSDHHAIUSA-N	0	0	265.441	4.262	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)[C@@H](C)C1CCCCC1	ZINC000470408910	331481779	/nfs/dbraw/zinc/48/17/79/331481779.db2.gz	SGZYYSTWISBGOP-AWEZNQCLSA-N	0	0	263.425	4.182	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)CC[C@@H](C)SC	ZINC000470638024	331486543	/nfs/dbraw/zinc/48/65/43/331486543.db2.gz	SXUFNJPQLZRBRY-OAHLLOKOSA-N	0	0	291.460	4.123	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CC[C@@H](c2ccc(C)cc2C)C1	ZINC000471337422	331506764	/nfs/dbraw/zinc/50/67/64/331506764.db2.gz	QOYNFGHFUFLOPR-IAGOWNOFSA-N	0	0	285.431	4.222	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@H](c3ccc(C)cc3C)C2)CCC1	ZINC000471333220	331506791	/nfs/dbraw/zinc/50/67/91/331506791.db2.gz	UUALFIDSBVXXLQ-KRWDZBQOSA-N	0	0	297.442	4.366	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CC[C@H](c2ccc(F)cc2)C1	ZINC000471541371	331510092	/nfs/dbraw/zinc/51/00/92/331510092.db2.gz	PZTNYAKJEQCJDL-JLJPHGGASA-N	0	0	289.394	4.180	20	30		CIEDRN
CC(C)CC[C@H]1CCCCN1C(=O)Nc1cccc(C#N)c1	ZINC000471595063	331511974	/nfs/dbraw/zinc/51/19/74/331511974.db2.gz	SCAVLAMYBNYOBM-QGZVFWFLSA-N	0	0	299.418	4.381	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NC(C)(C)c1cccc(Cl)c1F	ZINC000471647382	331514254	/nfs/dbraw/zinc/51/42/54/331514254.db2.gz	GSYPRAMFILSXKV-NSHDSACASA-N	0	0	297.801	4.433	20	30		CIEDRN
CCCC1(C(=O)Nc2sc(C)c(CC)c2C#N)CC1	ZINC000471709694	331517247	/nfs/dbraw/zinc/51/72/47/331517247.db2.gz	SMWYBEFYSCMUAB-UHFFFAOYSA-N	0	0	276.405	4.009	20	30		CIEDRN
C=C1CCN(C(=O)[C@@H](C)c2ccc(Cl)c(Cl)c2)CC1	ZINC000471870032	331522774	/nfs/dbraw/zinc/52/27/74/331522774.db2.gz	LWCQEAJZOQOKMO-NSHDSACASA-N	0	0	298.213	4.276	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1cccc2ccn(C)c21	ZINC000471876512	331522984	/nfs/dbraw/zinc/52/29/84/331522984.db2.gz	NDCBBAUUHVDOCG-CYBMUJFWSA-N	0	0	285.391	4.045	20	30		CIEDRN
C=C(C)[C@H](CC(=O)Nc1c(C)cccc1SC)OCC	ZINC000472233928	331532684	/nfs/dbraw/zinc/53/26/84/331532684.db2.gz	ZJSXJYCALFCFMM-ZDUSSCGKSA-N	0	0	293.432	4.027	20	30		CIEDRN
CC1(C)CCCN(Cc2ccccc2C(F)(F)F)[C@H]1C#N	ZINC000510754014	332915550	/nfs/dbraw/zinc/91/55/50/332915550.db2.gz	VMBFNOJMQDBPHG-AWEZNQCLSA-N	0	0	296.336	4.220	20	30		CIEDRN
C=CCCCCNC(=O)Nc1ccccc1C(C)C	ZINC000473499524	331552097	/nfs/dbraw/zinc/55/20/97/331552097.db2.gz	STYXAYCBAJRBMR-UHFFFAOYSA-N	0	0	260.381	4.288	20	30		CIEDRN
C=CCCCCNC(=O)Nc1ccc(Cl)cc1C	ZINC000473497794	331552135	/nfs/dbraw/zinc/55/21/35/331552135.db2.gz	SDFVORQXHUSQBE-UHFFFAOYSA-N	0	0	266.772	4.126	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cc(Cl)ccc2C)CC1	ZINC000474094167	331569818	/nfs/dbraw/zinc/56/98/18/331569818.db2.gz	FTCZSDAPMIQTNV-UHFFFAOYSA-N	0	0	263.768	4.333	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)C1(Cc2ccc(F)cc2)CC1	ZINC000474160779	331574075	/nfs/dbraw/zinc/57/40/75/331574075.db2.gz	VFEZXCMLWLJKNQ-AWEZNQCLSA-N	0	0	289.394	4.009	20	30		CIEDRN
C[C@@H](Nc1ncc(C#N)cc1Cl)[C@@H](C)c1ccccc1	ZINC000474185756	331574436	/nfs/dbraw/zinc/57/44/36/331574436.db2.gz	RIGVALUYAKTHFP-VXGBXAGGSA-N	0	0	285.778	4.211	20	30		CIEDRN
C[C@@H](CC1CCCCC1)C(=O)N(CC#N)c1ccccc1	ZINC000510794438	332917351	/nfs/dbraw/zinc/91/73/51/332917351.db2.gz	PCJPLSLMHIFFBT-HNNXBMFYSA-N	0	0	284.403	4.150	20	30		CIEDRN
N#CC[C@@H](CC(=O)NCCC1=CCCCC1)c1ccccc1	ZINC000474288013	331579847	/nfs/dbraw/zinc/57/98/47/331579847.db2.gz	ABUCSQZPEKWCTE-SFHVURJKSA-N	0	0	296.414	4.081	20	30		CIEDRN
CC(C)CN(C(=O)[C@@H]1CC12CCCC2)c1ccc(C#N)cc1	ZINC000474372030	331582332	/nfs/dbraw/zinc/58/23/32/331582332.db2.gz	FHXMXUXUFYVGLL-KRWDZBQOSA-N	0	0	296.414	4.128	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc2c(c1)O[C@](C)(CC)O2	ZINC000474648716	331593397	/nfs/dbraw/zinc/59/33/97/331593397.db2.gz	QWZPFUZOIBNGSW-IAGOWNOFSA-N	0	0	289.375	4.125	20	30		CIEDRN
C=CCCC1(C(=O)NC[C@@H](CC)CCCC)CC1	ZINC000474690326	331594432	/nfs/dbraw/zinc/59/44/32/331594432.db2.gz	CXNVWNIVAKHZSC-AWEZNQCLSA-N	0	0	251.414	4.065	20	30		CIEDRN
C=CCCC1(C(=O)NCc2ccccc2C(F)(F)F)CC1	ZINC000474709253	331595114	/nfs/dbraw/zinc/59/51/14/331595114.db2.gz	WYYROPMKPAXDFP-UHFFFAOYSA-N	0	0	297.320	4.068	20	30		CIEDRN
N#Cc1ccc(Cl)cc1Oc1ncnc2cccc(F)c21	ZINC000474788642	331598230	/nfs/dbraw/zinc/59/82/30/331598230.db2.gz	RXQMJPCSRJDXTI-UHFFFAOYSA-N	0	0	299.692	4.086	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCc1ccc(OCCC)cc1C	ZINC000474916417	331603973	/nfs/dbraw/zinc/60/39/73/331603973.db2.gz	GWFQNAQNSFTXLI-HNNXBMFYSA-N	0	0	289.419	4.002	20	30		CIEDRN
C=CCCC1(C(=O)N(C)CCCCc2ccccc2)CC1	ZINC000474960790	331606835	/nfs/dbraw/zinc/60/68/35/331606835.db2.gz	AHYTVHZTONDOGH-UHFFFAOYSA-N	0	0	285.431	4.214	20	30		CIEDRN
C=CCCC1(C(=O)N(C)c2cc(C)cc(C)c2)CC1	ZINC000475023451	331609266	/nfs/dbraw/zinc/60/92/66/331609266.db2.gz	CPZUAMPGKWZTOX-UHFFFAOYSA-N	0	0	257.377	4.013	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](C)c1cc2cccc(F)c2o1	ZINC000475084185	331614189	/nfs/dbraw/zinc/61/41/89/331614189.db2.gz	MMXHQKSEYJSPPJ-NEPJUHHUSA-N	0	0	289.350	4.351	20	30		CIEDRN
CCC1(CC)CCC(NC(=O)c2ccc(CC#N)cc2)CC1	ZINC000475098706	331614961	/nfs/dbraw/zinc/61/49/61/331614961.db2.gz	NYVYYABRGIRHPQ-UHFFFAOYSA-N	0	0	298.430	4.231	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@@H]1CCCC1(C)C	ZINC000475284252	331621860	/nfs/dbraw/zinc/62/18/60/331621860.db2.gz	CRDGXPLXBAXRQV-AWEZNQCLSA-N	0	0	277.433	4.089	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H]1CC[C@@H](c2cccc(F)c2)C1	ZINC000510905755	332920182	/nfs/dbraw/zinc/92/01/82/332920182.db2.gz	IKONKPLVILKYKU-GDBMZVCRSA-N	0	0	289.394	4.180	20	30		CIEDRN
C=CCOc1ccc(Oc2nc(CC(C)C)ns2)cc1	ZINC000475513273	331635169	/nfs/dbraw/zinc/63/51/69/331635169.db2.gz	KJVHUQPTQNPNAN-UHFFFAOYSA-N	0	0	290.388	4.094	20	30		CIEDRN
C=CCCCC(=O)N(CCC(C)C)C1CCCC1	ZINC000475528826	331635689	/nfs/dbraw/zinc/63/56/89/331635689.db2.gz	PPKFFYVKZCOROJ-UHFFFAOYSA-N	0	0	251.414	4.160	20	30		CIEDRN
CCN(C(=O)[C@@H]1CCCC1(C)C)[C@H](C)c1ccc(C#N)cc1	ZINC000475614646	331639484	/nfs/dbraw/zinc/63/94/84/331639484.db2.gz	WSFOJDGXOOJQQD-PBHICJAKSA-N	0	0	298.430	4.294	20	30		CIEDRN
C=C(C)[C@@H](NC(=O)[C@H](C)CC(C)C)c1ccc(F)c(F)c1	ZINC000475657909	331640488	/nfs/dbraw/zinc/64/04/88/331640488.db2.gz	BXGPORNEDOHZEZ-MLGOLLRUSA-N	0	0	295.373	4.380	20	30		CIEDRN
C=C(C)[C@@H](NC(=O)C1CCCCC1)c1ccc(F)c(F)c1	ZINC000475698220	331642685	/nfs/dbraw/zinc/64/26/85/331642685.db2.gz	ZVAOPRIGWYJFFC-MRXNPFEDSA-N	0	0	293.357	4.279	20	30		CIEDRN
C=C(C)[C@@H](Nc1cccc(C)n1)c1ccc(F)c(F)c1	ZINC000475722431	331643324	/nfs/dbraw/zinc/64/33/24/331643324.db2.gz	RFKDAZQAJXKGSY-MRXNPFEDSA-N	0	0	274.314	4.398	20	30		CIEDRN
C[C@H](CNc1cc(C#N)ccc1C(F)(F)F)C(F)(F)F	ZINC000475725958	331643387	/nfs/dbraw/zinc/64/33/87/331643387.db2.gz	GDPLPSFJZAEORL-SSDOTTSWSA-N	0	0	296.214	4.187	20	30		CIEDRN
C=C(C)[C@@H](Nc1ncc(Cl)cn1)c1ccc(F)c(F)c1	ZINC000475728563	331643654	/nfs/dbraw/zinc/64/36/54/331643654.db2.gz	UMXWPMFSWYCZCQ-CYBMUJFWSA-N	0	0	295.720	4.138	20	30		CIEDRN
C=C(C)[C@H](Nc1ncc(Cl)cn1)c1ccc(F)c(F)c1	ZINC000475728564	331643666	/nfs/dbraw/zinc/64/36/66/331643666.db2.gz	UMXWPMFSWYCZCQ-ZDUSSCGKSA-N	0	0	295.720	4.138	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)C[C@@H](C)CC(C)C	ZINC000475728375	331643754	/nfs/dbraw/zinc/64/37/54/331643754.db2.gz	ADJOGDALTPBSPE-AWEZNQCLSA-N	0	0	266.429	4.037	20	30		CIEDRN
C=CCCC1(C(=O)N[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000475900255	331648228	/nfs/dbraw/zinc/64/82/28/331648228.db2.gz	PWXLXGFKTZEYDN-IRXDYDNUSA-N	0	0	283.415	4.185	20	30		CIEDRN
C[C@@H]1CC[C@H](NC(=O)c2ccc(C(C)(C)C#N)cc2)[C@@H](C)C1	ZINC000476032866	331651702	/nfs/dbraw/zinc/65/17/02/331651702.db2.gz	NHXAVJCNDQJKMB-KEYYUXOJSA-N	0	0	298.430	4.042	20	30		CIEDRN
C[C@@H]1CCC[C@@H](C)C1NC(=O)C[C@H](CC#N)c1ccccc1	ZINC000476041098	331651705	/nfs/dbraw/zinc/65/17/05/331651705.db2.gz	GIGNWNVOSSORLY-INMHGKMJSA-N	0	0	298.430	4.015	20	30		CIEDRN
CCOc1ccc(O[C@@H](C)c2cccc(C#N)c2)cc1	ZINC000476049426	331651875	/nfs/dbraw/zinc/65/18/75/331651875.db2.gz	LJNYEAVDFFBDNX-ZDUSSCGKSA-N	0	0	267.328	4.097	20	30		CIEDRN
C=CC[C@H](C)NC(=O)CC(C)(C)C1CCCCC1	ZINC000476056718	331652134	/nfs/dbraw/zinc/65/21/34/331652134.db2.gz	UQONUYMZWQMKNT-ZDUSSCGKSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(C)c(OC(F)F)c2)CC1	ZINC000476067994	331652832	/nfs/dbraw/zinc/65/28/32/331652832.db2.gz	RMMHVNCTLNETBP-UHFFFAOYSA-N	0	0	295.329	4.281	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1C[C@H](C)Oc2c(Cl)cccc21	ZINC000476116281	331655326	/nfs/dbraw/zinc/65/53/26/331655326.db2.gz	ZRGXGVXVDLQWKB-NEPJUHHUSA-N	0	0	293.794	4.056	20	30		CIEDRN
C=CCCC1(C(=O)N2CCC[C@@](C)(CCC)C2)CC1	ZINC000476196886	331657039	/nfs/dbraw/zinc/65/70/39/331657039.db2.gz	ILLCAAUIYRDTBK-MRXNPFEDSA-N	0	0	263.425	4.162	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cc(C)nn2CCCCC)CC1	ZINC000476252611	331658094	/nfs/dbraw/zinc/65/80/94/331658094.db2.gz	LVMJZUNUMQEPLD-UHFFFAOYSA-N	0	0	289.423	4.067	20	30		CIEDRN
C=CCCC1(C(=O)N2CC[C@@H](c3ccccc3)[C@H]2C)CC1	ZINC000476280648	331659852	/nfs/dbraw/zinc/65/98/52/331659852.db2.gz	VXBUKTQGZHWBCT-NVXWUHKLSA-N	0	0	283.415	4.137	20	30		CIEDRN
C=CCCC1(C(=O)N[C@H]2CC(C)(C)c3ccccc32)CC1	ZINC000476394767	331663327	/nfs/dbraw/zinc/66/33/27/331663327.db2.gz	VFCROWMREJXUQE-INIZCTEOSA-N	0	0	283.415	4.272	20	30		CIEDRN
CCCc1ccc(-c2ccc(NC(=O)CC#N)cc2)cc1	ZINC000476766665	331669532	/nfs/dbraw/zinc/66/95/32/331669532.db2.gz	OGCVTZCXZZJIGJ-UHFFFAOYSA-N	0	0	278.355	4.158	20	30		CIEDRN
C=CCCC1(C(=O)N[C@H]2CC[C@@H](Cc3ccccc3)C2)CC1	ZINC000476927050	331671266	/nfs/dbraw/zinc/67/12/66/331671266.db2.gz	VXOIZHWTFOXBKI-ROUUACIJSA-N	0	0	297.442	4.260	20	30		CIEDRN
C[C@@H]1CCC[C@H](NC(=O)c2ccc(C(C)(C)C#N)cc2)CC1	ZINC000476932066	331671403	/nfs/dbraw/zinc/67/14/03/331671403.db2.gz	YZCBSSJVFCOZEP-PBHICJAKSA-N	0	0	298.430	4.186	20	30		CIEDRN
C=C(C)CS[C@@H]1CCCN(c2ccccc2Cl)C1=O	ZINC000477008702	331672652	/nfs/dbraw/zinc/67/26/52/331672652.db2.gz	IGSLKUKKYDJMJN-CQSZACIVSA-N	0	0	295.835	4.145	20	30		CIEDRN
N#Cc1ccc(N[C@@H]2CC=C(c3ccc(F)cc3)CC2)cn1	ZINC000477065888	331674915	/nfs/dbraw/zinc/67/49/15/331674915.db2.gz	DJCDMBNUSPXWSS-MRXNPFEDSA-N	0	0	293.345	4.140	20	30		CIEDRN
C=CCOc1cccc(NC(=O)c2cc3sccc3[nH]2)c1	ZINC000477634242	331688042	/nfs/dbraw/zinc/68/80/42/331688042.db2.gz	IOFBYSGYIHJJAA-UHFFFAOYSA-N	0	0	298.367	4.047	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CC[C@@H](c2cccc(F)c2)C1	ZINC000478267636	331702370	/nfs/dbraw/zinc/70/23/70/331702370.db2.gz	NOVGXLLOIIDLEF-YSVLISHTSA-N	0	0	289.394	4.180	20	30		CIEDRN
Cc1ccc(NCc2ccc(Cl)cc2C#N)cc1C	ZINC000478372420	331704784	/nfs/dbraw/zinc/70/47/84/331704784.db2.gz	SEQHHASXDLHCGP-UHFFFAOYSA-N	0	0	270.763	4.441	20	30		CIEDRN
COC1(CSc2cccc(Cl)c2C#N)CCCC1	ZINC000478720218	331712365	/nfs/dbraw/zinc/71/23/65/331712365.db2.gz	OFXIJLGQIDZFLM-UHFFFAOYSA-N	0	0	281.808	4.263	20	30		CIEDRN
C=CCC1(C(=O)Nc2nc3c(cccc3C)s2)CCC1	ZINC000478743877	331712945	/nfs/dbraw/zinc/71/29/45/331712945.db2.gz	ZVNJALPOUGDQSL-UHFFFAOYSA-N	0	0	286.400	4.290	20	30		CIEDRN
Cc1cc(CSCCC(F)(F)F)ccc1C#N	ZINC000478752916	331713202	/nfs/dbraw/zinc/71/32/02/331713202.db2.gz	IAFGFVVCTDCGFA-UHFFFAOYSA-N	0	0	259.296	4.052	20	30		CIEDRN
C=CCOCCCOc1c(OCC)ccc2ccccc21	ZINC000478788919	331713915	/nfs/dbraw/zinc/71/39/15/331713915.db2.gz	PZQSDPOWFPYWKQ-UHFFFAOYSA-N	0	0	286.371	4.210	20	30		CIEDRN
C[C@@H](Oc1ccc(F)cc1Cl)c1ccc(C#N)cc1	ZINC000478788708	331713931	/nfs/dbraw/zinc/71/39/31/331713931.db2.gz	VBQHDHNSVSFDQT-SNVBAGLBSA-N	0	0	275.710	4.491	20	30		CIEDRN
Cc1ccc(F)c(O[C@H](C)c2cccc(C#N)c2)c1	ZINC000478800724	331714452	/nfs/dbraw/zinc/71/44/52/331714452.db2.gz	VSYLMEHVHVHPET-GFCCVEGCSA-N	0	0	255.292	4.146	20	30		CIEDRN
COc1cc(C)ccc1OCc1ccc(Cl)cc1C#N	ZINC000478946457	331718066	/nfs/dbraw/zinc/71/80/66/331718066.db2.gz	IFQWEOBVHCBZKI-UHFFFAOYSA-N	0	0	287.746	4.108	20	30		CIEDRN
C=CC[C@H](C)NC(=O)c1cc2c(cc(Cl)cc2Cl)[nH]1	ZINC000479089415	331720143	/nfs/dbraw/zinc/72/01/43/331720143.db2.gz	KFJLOPXAQCKBSJ-QMMMGPOBSA-N	0	0	297.185	4.169	20	30		CIEDRN
C=CCCCS[C@@H]1CCCN(c2ccccc2F)C1=O	ZINC000479122382	331720515	/nfs/dbraw/zinc/72/05/15/331720515.db2.gz	SUQDARWHAIDWMO-OAHLLOKOSA-N	0	0	293.407	4.021	20	30		CIEDRN
C=C1CCN(C(=O)[C@H](CC)CC2CCCCC2)CC1	ZINC000511135628	332927925	/nfs/dbraw/zinc/92/79/25/332927925.db2.gz	PTFPFSRBVJWFDH-MRXNPFEDSA-N	0	0	263.425	4.162	20	30		CIEDRN
Cc1cc(NCc2ccc(C#N)c(F)c2)ccc1C1CC1	ZINC000479482983	331732685	/nfs/dbraw/zinc/73/26/85/331732685.db2.gz	XYLIYGMVQOMUMM-UHFFFAOYSA-N	0	0	280.346	4.495	20	30		CIEDRN
C=CCCCC(=O)N[C@H](C)c1cccc2ccccc21	ZINC000479499379	331733530	/nfs/dbraw/zinc/73/35/30/331733530.db2.gz	FFOVPSBNVBBWAH-CQSZACIVSA-N	0	0	267.372	4.373	20	30		CIEDRN
C=CCCCC(=O)N(CC)Cc1ccc(Cl)cc1	ZINC000479507211	331733914	/nfs/dbraw/zinc/73/39/14/331733914.db2.gz	WPEMSBBJDDIDSQ-UHFFFAOYSA-N	0	0	265.784	4.045	20	30		CIEDRN
CC[C@H](Nc1cccc2c1CCO2)c1ccc(C#N)cc1	ZINC000479531097	331735454	/nfs/dbraw/zinc/73/54/54/331735454.db2.gz	UXLWVGHYIKGXSL-INIZCTEOSA-N	0	0	278.355	4.056	20	30		CIEDRN
C=CCCCC(=O)N[C@H](CC(C)C)c1cccs1	ZINC000479551930	331736862	/nfs/dbraw/zinc/73/68/62/331736862.db2.gz	GMQYHXPOQBGIFS-CYBMUJFWSA-N	0	0	265.422	4.308	20	30		CIEDRN
C=CCCCC(=O)N(CCC)[C@H](C)c1ccccc1OC	ZINC000479574964	331738170	/nfs/dbraw/zinc/73/81/70/331738170.db2.gz	PKPACHQMAPJWSW-OAHLLOKOSA-N	0	0	289.419	4.351	20	30		CIEDRN
CC(C)C[C@@H](C)CC(=O)N(C)c1cc(Cl)ccc1C#N	ZINC000479575057	331738641	/nfs/dbraw/zinc/73/86/41/331738641.db2.gz	QEPODPHEMJZFRV-GFCCVEGCSA-N	0	0	292.810	4.247	20	30		CIEDRN
C=CCOCCCS[C@H](C)c1ncc(C(C)(C)C)o1	ZINC000479603400	331740171	/nfs/dbraw/zinc/74/01/71/331740171.db2.gz	CYMIYHNWIHJVEZ-GFCCVEGCSA-N	0	0	283.437	4.359	20	30		CIEDRN
C=CCOCCCSCCOC1CCCCCC1	ZINC000479609931	331740687	/nfs/dbraw/zinc/74/06/87/331740687.db2.gz	ZDNBKGUGJHKBDH-UHFFFAOYSA-N	0	0	272.454	4.052	20	30		CIEDRN
C=CCCCC(=O)N(C)[C@H](CC)Cc1ccc(C)cc1	ZINC000479849796	331746718	/nfs/dbraw/zinc/74/67/18/331746718.db2.gz	SAZCWTLAANSXLL-QGZVFWFLSA-N	0	0	273.420	4.131	20	30		CIEDRN
C=CCCCOc1ccc(N(C)C(=O)C(C)(C)C)cc1	ZINC000479941467	331752230	/nfs/dbraw/zinc/75/22/30/331752230.db2.gz	NBNNZFUGUQETNT-UHFFFAOYSA-N	0	0	275.392	4.041	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)[C@@H]1C[C@]1(C)C(C)C	ZINC000480016777	331754519	/nfs/dbraw/zinc/75/45/19/331754519.db2.gz	OPWAXAVPOBAUIQ-MAUKXSAKSA-N	0	0	289.394	4.023	20	30		CIEDRN
C=CCC1(C(=O)N[C@H]2CCC[C@H](C(C)C)C2)CCC1	ZINC000480176034	331761587	/nfs/dbraw/zinc/76/15/87/331761587.db2.gz	DRYWAOZVXKCWBO-GJZGRUSLSA-N	0	0	263.425	4.064	20	30		CIEDRN
C=C(C)COc1cccc(NCC2(OC)CCCC2)c1	ZINC000480301341	331767074	/nfs/dbraw/zinc/76/70/74/331767074.db2.gz	OCSWKUZHUFGXET-UHFFFAOYSA-N	0	0	275.392	4.013	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](C)[C@H](C)C1CCCCC1	ZINC000480356554	331769518	/nfs/dbraw/zinc/76/95/18/331769518.db2.gz	VIGBSIFAAPJUKY-KBPBESRZSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=CCNC(=O)[C@H](C)SCc1c(C)ccc2ccccc21	ZINC000480385510	331770973	/nfs/dbraw/zinc/77/09/73/331770973.db2.gz	POFWUNUIMJCFQS-AWEZNQCLSA-N	0	0	299.439	4.072	20	30		CIEDRN
N#Cc1ccc(F)cc1CSCCCC1CCOCC1	ZINC000516620846	332926312	/nfs/dbraw/zinc/92/63/12/332926312.db2.gz	NUBBSYOSTRTHHX-UHFFFAOYSA-N	0	0	293.407	4.137	20	30		CIEDRN
C=CCCCC(=O)NC1(c2ccc(F)cc2)CCCC1	ZINC000480869989	331790241	/nfs/dbraw/zinc/79/02/41/331790241.db2.gz	PFEHDGPDVWAXDT-UHFFFAOYSA-N	0	0	275.367	4.068	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)[C@H]1CCC(F)(F)C1	ZINC000481134295	331798760	/nfs/dbraw/zinc/79/87/60/331798760.db2.gz	BPLCPUOSNGDURB-HNNXBMFYSA-N	0	0	293.357	4.027	20	30		CIEDRN
C=CCn1c(S[C@@H](C)CCC)nnc1-c1cccs1	ZINC000481407542	331806154	/nfs/dbraw/zinc/80/61/54/331806154.db2.gz	ZHELAOLERKCTNE-NSHDSACASA-N	0	0	293.461	4.473	20	30		CIEDRN
CC(C)CC[C@@H](O)CSc1ccc(C#N)cc1Cl	ZINC000481708299	331812845	/nfs/dbraw/zinc/81/28/45/331812845.db2.gz	AIFASWSHUDWNBY-GFCCVEGCSA-N	0	0	283.824	4.101	20	30		CIEDRN
CC(C)[C@H]1CC[C@H](C(=O)Nc2ccc(F)cc2C#N)CC1	ZINC000511295085	332930141	/nfs/dbraw/zinc/93/01/41/332930141.db2.gz	DVGQAWCZNWXCDG-JOCQHMNTSA-N	0	0	288.366	4.098	20	30		CIEDRN
CC[C@H](N[C@H]1CCCCc2cc(C#N)ccc21)C(F)(F)F	ZINC000481996351	331820845	/nfs/dbraw/zinc/82/08/45/331820845.db2.gz	CMZVBVYRJCZQMK-GJZGRUSLSA-N	0	0	296.336	4.256	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)Nc1ccc(C#N)cc1	ZINC000482189383	331826582	/nfs/dbraw/zinc/82/65/82/331826582.db2.gz	WXCRIJWACSZBGT-UHFFFAOYSA-N	0	0	297.402	4.158	20	30		CIEDRN
C=C(C)CN(CC)C(=O)C[C@H](c1ccccc1)C(C)C	ZINC000482432141	331831894	/nfs/dbraw/zinc/83/18/94/331831894.db2.gz	CNAVUQIDFFDGMZ-KRWDZBQOSA-N	0	0	273.420	4.241	20	30		CIEDRN
CCC[C@H](C)CC(=O)N(CCC)Cc1ccc(C#N)cc1	ZINC000498444458	331841956	/nfs/dbraw/zinc/84/19/56/331841956.db2.gz	IOEXPEGUODPXNL-HNNXBMFYSA-N	0	0	286.419	4.123	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cnn(CCCC)c1C(C)C	ZINC000482730662	331844913	/nfs/dbraw/zinc/84/49/13/331844913.db2.gz	CYZXQVZTGCQSMZ-QGZVFWFLSA-N	0	0	291.439	4.347	20	30		CIEDRN
CCS[C@H]1CCCCN(c2ccc(C#N)c(Cl)c2)C1	ZINC000303455036	332931332	/nfs/dbraw/zinc/93/13/32/332931332.db2.gz	LYMOLQMIDXJCRN-AWEZNQCLSA-N	0	0	294.851	4.324	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H]1CC[C@H](c2ccccc2F)C1	ZINC000482901277	331851785	/nfs/dbraw/zinc/85/17/85/331851785.db2.gz	UKRAFARDLGBMMI-SUNYJGFJSA-N	0	0	289.394	4.180	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)CCc1cccs1	ZINC000482909223	331852150	/nfs/dbraw/zinc/85/21/50/331852150.db2.gz	FOSASTKYMTXLCP-UHFFFAOYSA-N	0	0	291.460	4.276	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cc(Cl)ccc2OC)CC1	ZINC000483050607	331856570	/nfs/dbraw/zinc/85/65/70/331856570.db2.gz	PUCVWAMPRXONHU-UHFFFAOYSA-N	0	0	279.767	4.034	20	30		CIEDRN
CC[C@H]1CCCC[C@H]1C(=O)Nc1sc(C)c(C)c1C#N	ZINC000483075483	331857048	/nfs/dbraw/zinc/85/70/48/331857048.db2.gz	PIZKVHCZUOYESO-QWHCGFSZSA-N	0	0	290.432	4.392	20	30		CIEDRN
Cc1cccc(SCc2ccc(F)cc2C#N)c1	ZINC000483295732	331867893	/nfs/dbraw/zinc/86/78/93/331867893.db2.gz	KOQBLUCUIGGGBS-UHFFFAOYSA-N	0	0	257.333	4.298	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)c1ccc(F)c(C)c1	ZINC000303487639	332932467	/nfs/dbraw/zinc/93/24/67/332932467.db2.gz	VIDKPHXGXQUGJG-UHFFFAOYSA-N	0	0	289.394	4.343	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@H](c1ccccc1C)C(C)C	ZINC000483637469	331880407	/nfs/dbraw/zinc/88/04/07/331880407.db2.gz	YHDBABJUSUVZMC-KRWDZBQOSA-N	0	0	288.435	4.300	20	30		CIEDRN
C=CCCC1(C(=O)N(C)C2CCC(C)(C)CC2)CC1	ZINC000483806213	331884966	/nfs/dbraw/zinc/88/49/66/331884966.db2.gz	JKXWIENDROWGHE-UHFFFAOYSA-N	0	0	263.425	4.160	20	30		CIEDRN
Cc1sc(NC(=O)[C@H]2CCCC2(C)C)c(C#N)c1C	ZINC000483919647	331889102	/nfs/dbraw/zinc/88/91/02/331889102.db2.gz	YATLCPVVXDUDIV-GFCCVEGCSA-N	0	0	276.405	4.001	20	30		CIEDRN
N#CCCCN1CCc2cc(-c3ccccc3)ccc21	ZINC000484067497	331892084	/nfs/dbraw/zinc/89/20/84/331892084.db2.gz	KAJITTKLUUOCGC-UHFFFAOYSA-N	0	0	262.356	4.020	20	30		CIEDRN
C=CCN(C(=O)CCSc1ccccc1)c1ccccc1	ZINC000484215581	331894516	/nfs/dbraw/zinc/89/45/16/331894516.db2.gz	BNOMONZXTYQGKX-UHFFFAOYSA-N	0	0	297.423	4.388	20	30		CIEDRN
C[C@H](CC(C)(C)C)C(=O)N(C)c1cc(Cl)ccc1C#N	ZINC000484319765	331896916	/nfs/dbraw/zinc/89/69/16/331896916.db2.gz	BLHGBTKXERHVOV-LLVKDONJSA-N	0	0	292.810	4.247	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000484442422	331898280	/nfs/dbraw/zinc/89/82/80/331898280.db2.gz	SPFMRRCNELXYFE-HNNXBMFYSA-N	0	0	289.394	4.278	20	30		CIEDRN
Cc1ccc(NC(=O)c2ccc(C(C)(C)C#N)cc2)c(F)c1	ZINC000485398902	331913609	/nfs/dbraw/zinc/91/36/09/331913609.db2.gz	DYNSCZNKDZTGGO-UHFFFAOYSA-N	0	0	296.345	4.188	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1ccc(F)c(Cl)c1	ZINC000485566649	331916917	/nfs/dbraw/zinc/91/69/17/331916917.db2.gz	GATLYTFNVXUCMZ-LLVKDONJSA-N	0	0	282.746	4.052	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1ccccc1C(F)(F)F	ZINC000485573057	331917349	/nfs/dbraw/zinc/91/73/49/331917349.db2.gz	UMFPQYWQIWBRPV-NSHDSACASA-N	0	0	298.308	4.278	20	30		CIEDRN
C=CCCCCCS[C@H](C)C(=O)NCc1cccs1	ZINC000485594566	331918324	/nfs/dbraw/zinc/91/83/24/331918324.db2.gz	UZSLJMZTSPYAIT-CYBMUJFWSA-N	0	0	297.489	4.232	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](C)c1ccc2ncsc2c1	ZINC000485659269	331919655	/nfs/dbraw/zinc/91/96/55/331919655.db2.gz	UTDLTYVFCCLAEQ-NEPJUHHUSA-N	0	0	288.416	4.076	20	30		CIEDRN
N#Cc1cccnc1/C=C\c1cccc(OC2CCCC2)c1	ZINC000485979139	331928410	/nfs/dbraw/zinc/92/84/10/331928410.db2.gz	DEFQZRRGMJQYIH-KHPPLWFESA-N	0	0	290.366	4.445	20	30		CIEDRN
N#CCn1c(/C=C/c2ccc(Cl)cc2)nc2ccccc21	ZINC000485980516	331928572	/nfs/dbraw/zinc/92/85/72/331928572.db2.gz	RIYLWXVIMCSVPP-JXMROGBWSA-N	0	0	293.757	4.384	20	30		CIEDRN
Fc1cc(C(F)(F)F)ccc1OCCC(F)(F)F	ZINC000486051265	331930085	/nfs/dbraw/zinc/93/00/85/331930085.db2.gz	KGNDCYBTHMNCEO-UHFFFAOYSA-N	0	0	276.151	4.176	20	30		CIEDRN
N#Cc1cccnc1/C=C\c1cccc(C(F)(F)F)c1	ZINC000486051223	331930109	/nfs/dbraw/zinc/93/01/09/331930109.db2.gz	JOXAOCQCBJXGPU-SREVYHEPSA-N	0	0	274.245	4.142	20	30		CIEDRN
Cc1cc(/C=C\c2ncccc2C#N)ccc1Cl	ZINC000486075821	331930846	/nfs/dbraw/zinc/93/08/46/331930846.db2.gz	NGWWOGILIZVSDO-ALCCZGGFSA-N	0	0	254.720	4.086	20	30		CIEDRN
Cc1cc(/C=C/c2ncccc2C#N)ccc1Cl	ZINC000486075825	331930932	/nfs/dbraw/zinc/93/09/32/331930932.db2.gz	NGWWOGILIZVSDO-FNORWQNLSA-N	0	0	254.720	4.086	20	30		CIEDRN
CC(C)c1ccc(/C=C\c2ncccc2C#N)cc1[N+](=O)[O-]	ZINC000486100584	331931513	/nfs/dbraw/zinc/93/15/13/331931513.db2.gz	FZHIWPZCQAXZDN-VURMDHGXSA-N	0	0	293.326	4.155	20	30		CIEDRN
N#Cc1ccc(CNc2csc3ccccc23)cc1	ZINC000486143150	331932267	/nfs/dbraw/zinc/93/22/67/331932267.db2.gz	AILBFHJORFRTAL-UHFFFAOYSA-N	0	0	264.353	4.385	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)c1cccn1C(C)C	ZINC000486299694	331934345	/nfs/dbraw/zinc/93/43/45/331934345.db2.gz	FSTAGXISCYBMMK-UHFFFAOYSA-N	0	0	288.435	4.278	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@@H](C)c1c(F)cccc1F	ZINC000486328264	331935103	/nfs/dbraw/zinc/93/51/03/331935103.db2.gz	QHZPPDSDYSNZIS-ZDUSSCGKSA-N	0	0	295.373	4.273	20	30		CIEDRN
Cc1c2cc(C)ccc2sc1C(=O)N(C)C1(C#N)CCC1	ZINC000486467294	331937835	/nfs/dbraw/zinc/93/78/35/331937835.db2.gz	ZUKUGBVKAVAIBU-UHFFFAOYSA-N	0	0	298.411	4.036	20	30		CIEDRN
CCCCCN(C(=O)c1ccc(C#N)s1)[C@H](C)CCC	ZINC000486711691	331942824	/nfs/dbraw/zinc/94/28/24/331942824.db2.gz	MLAZZCVXUCYEBD-CYBMUJFWSA-N	0	0	292.448	4.441	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1cccc2c1CCCC2	ZINC000486753725	331943711	/nfs/dbraw/zinc/94/37/11/331943711.db2.gz	NMTRVDBRYMQMET-HNNXBMFYSA-N	0	0	284.403	4.138	20	30		CIEDRN
CC(C)CCN(CCC(C)C)C(=O)c1ccc(C#N)s1	ZINC000486796822	331945343	/nfs/dbraw/zinc/94/53/43/331945343.db2.gz	BOABULZAGUOVSH-UHFFFAOYSA-N	0	0	292.448	4.154	20	30		CIEDRN
N#Cc1ccc(N[C@@H]2CCCC(F)(F)C2)cc1Cl	ZINC000486909617	331949214	/nfs/dbraw/zinc/94/92/14/331949214.db2.gz	DUGSAMAKAWIVAX-LLVKDONJSA-N	0	0	270.710	4.201	20	30		CIEDRN
Cc1ccccc1[C@H](C)N(C)c1ccc(Cl)c(C#N)n1	ZINC000486935843	331950344	/nfs/dbraw/zinc/95/03/44/331950344.db2.gz	DFSLKHASZIHCQN-LBPRGKRZSA-N	0	0	285.778	4.113	20	30		CIEDRN
CC(C)(C)[C@H]1C[C@@H](Nc2ccc(C#N)c(Cl)c2)CCO1	ZINC000487062478	331955748	/nfs/dbraw/zinc/95/57/48/331955748.db2.gz	QHVMVRRXBUJAJR-DZGCQCFKSA-N	0	0	292.810	4.217	20	30		CIEDRN
Cc1ccc(NCc2ccc(C#N)cc2)cc1OC(C)C	ZINC000487157405	331957538	/nfs/dbraw/zinc/95/75/38/331957538.db2.gz	LJUULBXOKNAMIW-UHFFFAOYSA-N	0	0	280.371	4.266	20	30		CIEDRN
CC(C)(C)c1cnc(COc2cc(Cl)cc(C#N)c2)o1	ZINC000487431406	331970029	/nfs/dbraw/zinc/97/00/29/331970029.db2.gz	SSMYWHNODYDXTK-UHFFFAOYSA-N	0	0	290.750	4.076	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@H](C)CCC(C)C)c1ccccc1	ZINC000487576392	331975874	/nfs/dbraw/zinc/97/58/74/331975874.db2.gz	SBDPBHXMZLYTQE-NVXWUHKLSA-N	0	0	273.420	4.287	20	30		CIEDRN
C=CCC[C@@H](C(=O)NCc1ccc(F)cc1)c1ccccc1	ZINC000487603023	331976663	/nfs/dbraw/zinc/97/66/63/331976663.db2.gz	DEAUUOSKLABBIK-GOSISDBHSA-N	0	0	297.373	4.192	20	30		CIEDRN
C=CCC[C@@H](C(=O)NCc1ccccc1F)c1ccccc1	ZINC000487597026	331976767	/nfs/dbraw/zinc/97/67/67/331976767.db2.gz	PSQHVIXHPOOYTH-QGZVFWFLSA-N	0	0	297.373	4.192	20	30		CIEDRN
C=CC[C@H](C(=O)NCc1ccc(Cl)cc1)c1ccccc1	ZINC000487646131	331978050	/nfs/dbraw/zinc/97/80/50/331978050.db2.gz	MOTMZVPMUAZCSC-KRWDZBQOSA-N	0	0	299.801	4.316	20	30		CIEDRN
C=CCC[C@@H](C(=O)NCc1cccc(F)c1)c1ccccc1	ZINC000487689492	331979003	/nfs/dbraw/zinc/97/90/03/331979003.db2.gz	OLXVBSHVHHHXCM-GOSISDBHSA-N	0	0	297.373	4.192	20	30		CIEDRN
C=CCN(CC=C)C(=O)N[C@@H]1CCC[C@@H](c2ccccc2)C1	ZINC000487753374	331980562	/nfs/dbraw/zinc/98/05/62/331980562.db2.gz	ULLPQNXTERWUSU-QZTJIDSGSA-N	0	0	298.430	4.096	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H]1C[C@H]1c1c(F)cccc1Cl	ZINC000511682545	332939498	/nfs/dbraw/zinc/93/94/98/332939498.db2.gz	OOUBCSRNNDDFDS-ZWNOBZJWSA-N	0	0	295.785	4.054	20	30		CIEDRN
Cc1nc(N[C@@H](C)c2cccc3ccccc32)ccc1C#N	ZINC000487909033	331983886	/nfs/dbraw/zinc/98/38/86/331983886.db2.gz	LUEWCSVRJDGWJB-AWEZNQCLSA-N	0	0	287.366	4.010	20	30		CIEDRN
Cc1nc(N(C)[C@H](C)c2cc3ccccc3o2)ccc1C#N	ZINC000487923048	331984569	/nfs/dbraw/zinc/98/45/69/331984569.db2.gz	VHYQVUHZUFTQAU-CYBMUJFWSA-N	0	0	291.354	4.205	20	30		CIEDRN
N#Cc1c(F)cccc1COc1ccc(Cl)cc1F	ZINC000488239715	331995594	/nfs/dbraw/zinc/99/55/94/331995594.db2.gz	YEURZUDWODZHIW-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
N#Cc1c(F)cccc1CSCc1ccccc1	ZINC000488254826	331996268	/nfs/dbraw/zinc/99/62/68/331996268.db2.gz	RROIEJVEHZDUKZ-UHFFFAOYSA-N	0	0	257.333	4.131	20	30		CIEDRN
C=CC[C@@H](C(=O)NCCc1cccc(C)c1)c1ccccc1	ZINC000488336098	332000464	/nfs/dbraw/zinc/00/04/64/332000464.db2.gz	ZECUMOWSWKQYMO-LJQANCHMSA-N	0	0	293.410	4.014	20	30		CIEDRN
C=CCn1cccc1C(=O)N(C)[C@H](C)c1ccc(C)cc1C	ZINC000488381611	332003178	/nfs/dbraw/zinc/00/31/78/332003178.db2.gz	CHONFNCWBDAFDE-MRXNPFEDSA-N	0	0	296.414	4.124	20	30		CIEDRN
C=CCC[C@H](NC(=O)N1CC[C@H]2CCC[C@@H]21)c1ccccc1	ZINC000488520777	332015342	/nfs/dbraw/zinc/01/53/42/332015342.db2.gz	TVDKCHWZGFMAET-SQNIBIBYSA-N	0	0	298.430	4.278	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1ccc(CC)c(C)c1	ZINC000488548643	332016626	/nfs/dbraw/zinc/01/66/26/332016626.db2.gz	VBSCREJWYUQYBR-INIZCTEOSA-N	0	0	272.392	4.130	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1ncc(C(C)(C)C)s1	ZINC000488547026	332016689	/nfs/dbraw/zinc/01/66/89/332016689.db2.gz	RPTMYZIBTKLWFD-LLVKDONJSA-N	0	0	293.436	4.013	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1csc2ccccc12	ZINC000488554080	332017174	/nfs/dbraw/zinc/01/71/74/332017174.db2.gz	FPVUUNWUQLTSAP-LBPRGKRZSA-N	0	0	286.400	4.474	20	30		CIEDRN
C=C(C)CNC(=O)N[C@@H](c1ccc(Cl)cc1F)C(C)C	ZINC000488562763	332017540	/nfs/dbraw/zinc/01/75/40/332017540.db2.gz	IQGSZNVQFRRSRK-CQSZACIVSA-N	0	0	298.789	4.052	20	30		CIEDRN
C=CCC[C@H](C(=O)NCc1ccc(C)s1)c1ccccc1	ZINC000488617966	332020319	/nfs/dbraw/zinc/02/03/19/332020319.db2.gz	GYKXDNVINVXLTC-KRWDZBQOSA-N	0	0	299.439	4.423	20	30		CIEDRN
C=CCC[C@H](C(=O)N(C)[C@@H](C)CCC)c1ccccc1	ZINC000488623427	332020341	/nfs/dbraw/zinc/02/03/41/332020341.db2.gz	DGJWXLVFLSWBGA-RDJZCZTQSA-N	0	0	273.420	4.383	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1c(C)cccc1Cl	ZINC000488621836	332020362	/nfs/dbraw/zinc/02/03/62/332020362.db2.gz	KRJPKUYVMJITEV-GFCCVEGCSA-N	0	0	278.783	4.221	20	30		CIEDRN
C=CCC[C@@H](C(=O)NCc1ccc(C)s1)c1ccccc1	ZINC000488617971	332020397	/nfs/dbraw/zinc/02/03/97/332020397.db2.gz	GYKXDNVINVXLTC-QGZVFWFLSA-N	0	0	299.439	4.423	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1ccc2occ(C)c2c1	ZINC000488657351	332021109	/nfs/dbraw/zinc/02/11/09/332021109.db2.gz	HAKDYKAJRSGPQU-CQSZACIVSA-N	0	0	284.359	4.314	20	30		CIEDRN
C=CC[C@H](C(=O)NCc1ccc(CC)s1)c1ccccc1	ZINC000488675197	332021199	/nfs/dbraw/zinc/02/11/99/332021199.db2.gz	MMDMDYDAFMBXGK-KRWDZBQOSA-N	0	0	299.439	4.287	20	30		CIEDRN
CCSc1cccc(CNc2snc(C)c2C#N)c1	ZINC000488667884	332021221	/nfs/dbraw/zinc/02/12/21/332021221.db2.gz	CKQBYUGGGKDYNR-UHFFFAOYSA-N	0	0	289.429	4.047	20	30		CIEDRN
C=CCC[C@H](C(=O)N[C@H](C)[C@H](C)CC)c1ccccc1	ZINC000488688575	332021682	/nfs/dbraw/zinc/02/16/82/332021682.db2.gz	IOIUQUAYGBKGHM-INMHGKMJSA-N	0	0	273.420	4.287	20	30		CIEDRN
Cc1nsc(N[C@@H]2CCCc3ccc(C)cc32)c1C#N	ZINC000488752452	332024088	/nfs/dbraw/zinc/02/40/88/332024088.db2.gz	XJWUMILOIWKZRJ-OAHLLOKOSA-N	0	0	283.400	4.121	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)C[C@H]1CCCC(C)(C)C1	ZINC000488812972	332026658	/nfs/dbraw/zinc/02/66/58/332026658.db2.gz	GDLMYHWHPVGLDR-HUUCEWRRSA-N	0	0	263.425	4.160	20	30		CIEDRN
C=CCN(C(=O)C[C@H]1C[C@@H](C)c2c1cccc2C)C1CC1	ZINC000488812045	332026748	/nfs/dbraw/zinc/02/67/48/332026748.db2.gz	DICOOSWUOOOGOK-HUUCEWRRSA-N	0	0	283.415	4.153	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Cc1ccc(Cl)c(Cl)c1	ZINC000488825209	332027660	/nfs/dbraw/zinc/02/76/60/332027660.db2.gz	NWHNVZNOBBULLC-LBPRGKRZSA-N	0	0	298.213	4.103	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1ccc(Cl)cc1Cl	ZINC000488840145	332028623	/nfs/dbraw/zinc/02/86/23/332028623.db2.gz	NPGNGPRQTDTXPM-NSHDSACASA-N	0	0	284.186	4.174	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1cc2ccccc2n1CCC	ZINC000488842281	332028904	/nfs/dbraw/zinc/02/89/04/332028904.db2.gz	QWCUQEKYAMOMSG-INIZCTEOSA-N	0	0	296.414	4.232	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1coc2cc(C)c(C)cc21	ZINC000488845294	332029047	/nfs/dbraw/zinc/02/90/47/332029047.db2.gz	YHMUXAPTZBRFLY-AWEZNQCLSA-N	0	0	283.371	4.230	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)C[C@H](C)c1ccccc1C	ZINC000488875468	332030953	/nfs/dbraw/zinc/03/09/53/332030953.db2.gz	DYAAJBBULUQJCP-HOTGVXAUSA-N	0	0	271.404	4.056	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1cccc2ccsc21	ZINC000488877134	332031151	/nfs/dbraw/zinc/03/11/51/332031151.db2.gz	JUVYJPFFORMSFA-CYBMUJFWSA-N	0	0	271.385	4.082	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1cccc(OCC=C(C)C)c1	ZINC000488888890	332032366	/nfs/dbraw/zinc/03/23/66/332032366.db2.gz	YVLFAFRNEVADPD-KRWDZBQOSA-N	0	0	299.414	4.212	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1cc(F)cc(Cl)c1	ZINC000488899801	332032936	/nfs/dbraw/zinc/03/29/36/332032936.db2.gz	IJKPXZMPDCUFEA-CYBMUJFWSA-N	0	0	282.746	4.052	20	30		CIEDRN
C=CCN(C)C(=O)N[C@H](c1ccc(Cl)cc1)[C@H](C)CC	ZINC000488921289	332033759	/nfs/dbraw/zinc/03/37/59/332033759.db2.gz	RIQXUGPFCBJVAB-DOMZBBRYSA-N	0	0	294.826	4.255	20	30		CIEDRN
C=CC1CCN(C(=O)C[C@@H]2C[C@H](C)c3c2cccc3C)CC1	ZINC000488952061	332034972	/nfs/dbraw/zinc/03/49/72/332034972.db2.gz	TYQGHFQFEVFYHM-RDJZCZTQSA-N	0	0	297.442	4.401	20	30		CIEDRN
C=CCC[C@H](C(=O)NC[C@H](C)C(C)C)c1ccccc1	ZINC000489006991	332037372	/nfs/dbraw/zinc/03/73/72/332037372.db2.gz	FQNBKZBOKSYMPS-RDJZCZTQSA-N	0	0	273.420	4.145	20	30		CIEDRN
C=CC[C@H](C(=O)N1CCC[C@@H]2CCC[C@H]21)c1ccccc1	ZINC000489026504	332038362	/nfs/dbraw/zinc/03/83/62/332038362.db2.gz	ZCSOVWRIBFZGLJ-OKZBNKHCSA-N	0	0	283.415	4.137	20	30		CIEDRN
C=CC[C@H](C(=O)N1CCC[C@H]2CCC[C@@H]21)c1ccccc1	ZINC000489026505	332038429	/nfs/dbraw/zinc/03/84/29/332038429.db2.gz	ZCSOVWRIBFZGLJ-SQNIBIBYSA-N	0	0	283.415	4.137	20	30		CIEDRN
C=CCn1cccc1C(=O)Nc1cc(C(C)C)c(O)cc1C	ZINC000489046692	332039258	/nfs/dbraw/zinc/03/92/58/332039258.db2.gz	UZZIFRBIGVRYPP-UHFFFAOYSA-N	0	0	298.386	4.064	20	30		CIEDRN
CCC[C@@H](C(=O)Nc1ccc(C#N)cc1Cl)C(C)C	ZINC000489168944	332042833	/nfs/dbraw/zinc/04/28/33/332042833.db2.gz	FRFPPDVRQWWOCQ-GFCCVEGCSA-N	0	0	278.783	4.222	20	30		CIEDRN
C=C[C@H]1CCCCN1Cc1csc(C2CCCC2)n1	ZINC000489461768	332053943	/nfs/dbraw/zinc/05/39/43/332053943.db2.gz	JCUJOCWTSMQQPB-HNNXBMFYSA-N	0	0	276.449	4.341	20	30		CIEDRN
C=C[C@@H]1CCCCN1Cc1nc(-c2ccccc2)oc1C	ZINC000489492140	332056403	/nfs/dbraw/zinc/05/64/03/332056403.db2.gz	YRDXNTKRJHXVIP-MRXNPFEDSA-N	0	0	282.387	4.191	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@@H](CC=C)c1ccccc1	ZINC000489643430	332062662	/nfs/dbraw/zinc/06/26/62/332062662.db2.gz	TYEDTABWBXEZNE-RDJZCZTQSA-N	0	0	271.404	4.207	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H]1CCC[C@H](c2ccccc2)C1	ZINC000489642900	332062730	/nfs/dbraw/zinc/06/27/30/332062730.db2.gz	RPOIEFPNYLMSLA-JENIJYKNSA-N	0	0	285.431	4.431	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)[C@@H](CC=C)c1ccccc1	ZINC000489643431	332062734	/nfs/dbraw/zinc/06/27/34/332062734.db2.gz	TYEDTABWBXEZNE-WBVHZDCISA-N	0	0	271.404	4.207	20	30		CIEDRN
C=CC[C@H](C(=O)NC1CCC(F)(F)CC1)c1ccccc1	ZINC000489661783	332063621	/nfs/dbraw/zinc/06/36/21/332063621.db2.gz	ZUWOHUVEBHCWDH-HNNXBMFYSA-N	0	0	293.357	4.040	20	30		CIEDRN
C=CCC[C@@H](C(=O)N[C@@H](C)CC(C)C)c1ccccc1	ZINC000489696004	332065208	/nfs/dbraw/zinc/06/52/08/332065208.db2.gz	IERFCNPMEHXBLQ-DOTOQJQBSA-N	0	0	273.420	4.287	20	30		CIEDRN
C=CCC[C@H](C(=O)N[C@H](C)CC(C)C)c1ccccc1	ZINC000489696008	332065245	/nfs/dbraw/zinc/06/52/45/332065245.db2.gz	IERFCNPMEHXBLQ-WBVHZDCISA-N	0	0	273.420	4.287	20	30		CIEDRN
C=CCC[C@@H](C(=O)NCC1(CC)CC1)c1ccccc1	ZINC000489724025	332066173	/nfs/dbraw/zinc/06/61/73/332066173.db2.gz	KQDCODOYIGMWFY-MRXNPFEDSA-N	0	0	271.404	4.043	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1ccc(C2CCC2)cc1	ZINC000489781930	332067622	/nfs/dbraw/zinc/06/76/22/332067622.db2.gz	UOMIEFQKLIAIEU-LBPRGKRZSA-N	0	0	258.365	4.040	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)C[C@H](C)c1ccc(F)cc1F	ZINC000489904293	332072630	/nfs/dbraw/zinc/07/26/30/332072630.db2.gz	CTXGQVVDQLLENU-LBPRGKRZSA-N	0	0	295.373	4.177	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@H](C)c1cc2ccccc2o1	ZINC000489954743	332074298	/nfs/dbraw/zinc/07/42/98/332074298.db2.gz	HMIIQUAOCZKVSM-CYBMUJFWSA-N	0	0	285.387	4.255	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@H](C)Cc1ccccc1Cl	ZINC000489960794	332074721	/nfs/dbraw/zinc/07/47/21/332074721.db2.gz	YDNNVDNIKSWTFH-CYBMUJFWSA-N	0	0	293.838	4.237	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@@H](C)SCc1ccccc1	ZINC000489967257	332074943	/nfs/dbraw/zinc/07/49/43/332074943.db2.gz	SUNVPIDKPSFCCA-CQSZACIVSA-N	0	0	291.460	4.027	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@H](c1ccncc1)C(C)C	ZINC000498576618	332074967	/nfs/dbraw/zinc/07/49/67/332074967.db2.gz	LIKXXAMJIRZEJJ-KRWDZBQOSA-N	0	0	288.435	4.026	20	30		CIEDRN
CC(C)c1ccc(/C=C\CC(=O)N[C@@H](C#N)C(C)(C)C)cc1	ZINC000489979883	332075469	/nfs/dbraw/zinc/07/54/69/332075469.db2.gz	IIHRCYHYCXTHAE-TUYSUELWSA-N	0	0	298.430	4.268	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)CCc1c[nH]c2cc(C)ccc12	ZINC000490001417	332076050	/nfs/dbraw/zinc/07/60/50/332076050.db2.gz	AFWDWKMPTYPLET-UHFFFAOYSA-N	0	0	298.430	4.127	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)C[C@H](C)c1ccc(F)cc1	ZINC000490001844	332076140	/nfs/dbraw/zinc/07/61/40/332076140.db2.gz	CDZQMANQRIVDKE-ZDUSSCGKSA-N	0	0	277.383	4.038	20	30		CIEDRN
C=CCCCC(=O)Nc1cnn(CCC(C)C)c1C(C)C	ZINC000490170716	332083471	/nfs/dbraw/zinc/08/34/71/332083471.db2.gz	VUOFQKCIIXPZRL-UHFFFAOYSA-N	0	0	291.439	4.347	20	30		CIEDRN
C=CCCCNC(=O)N[C@@H]1CCCc2sc(Cl)cc21	ZINC000490368038	332087472	/nfs/dbraw/zinc/08/74/72/332087472.db2.gz	BBHXVUZNTRYSNF-LLVKDONJSA-N	0	0	298.839	4.044	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccc(CC)c(Cl)c1	ZINC000490878926	332124692	/nfs/dbraw/zinc/12/46/92/332124692.db2.gz	YYDOPCBSGHFJIT-UHFFFAOYSA-N	0	0	280.799	4.332	20	30		CIEDRN
C=C(C)CN(CC)C(=O)C(C)(C)c1cccc(Cl)c1	ZINC000303666009	332945551	/nfs/dbraw/zinc/94/55/51/332945551.db2.gz	CDNKWQQAODXMAV-UHFFFAOYSA-N	0	0	279.811	4.042	20	30		CIEDRN
C#C[C@@H](C)N(C)C(=O)Nc1ccc(-c2ccccc2)cc1C	ZINC000491371136	332198551	/nfs/dbraw/zinc/19/85/51/332198551.db2.gz	CTJPVOPAUWMQKQ-OAHLLOKOSA-N	0	0	292.382	4.147	20	30		CIEDRN
C=CCN(CCc1ccco1)Cc1nc2ccccc2s1	ZINC000491394577	332203837	/nfs/dbraw/zinc/20/38/37/332203837.db2.gz	HCMIKXBZRLVZAT-UHFFFAOYSA-N	0	0	298.411	4.120	20	30		CIEDRN
CCCc1csc(-c2nc3cc(C#N)ccc3n2CC)n1	ZINC000491575181	332240948	/nfs/dbraw/zinc/24/09/48/332240948.db2.gz	ZBKFRACHIBCYCJ-UHFFFAOYSA-N	0	0	296.399	4.004	20	30		CIEDRN
C#C[C@@H](C)N(C)C(=O)Nc1c(CC=C)cccc1C(C)C	ZINC000491682306	332285134	/nfs/dbraw/zinc/28/51/34/332285134.db2.gz	RJCMLVBWVUIBOS-CQSZACIVSA-N	0	0	284.403	4.024	20	30		CIEDRN
C#CCN(C(=O)Nc1ccccc1C(F)F)C1CCCC1	ZINC000491758025	332330480	/nfs/dbraw/zinc/33/04/80/332330480.db2.gz	GOYZZBNBRRZNAZ-UHFFFAOYSA-N	0	0	292.329	4.034	20	30		CIEDRN
C#C[C@H](NCc1ccc(SC)s1)c1ccc(F)cc1	ZINC000491780070	332344613	/nfs/dbraw/zinc/34/46/13/332344613.db2.gz	IARAXRNUALJWTG-AWEZNQCLSA-N	0	0	291.416	4.073	20	30		CIEDRN
C#C[C@@H](C)N(C)C(=S)Nc1ccccc1-c1ccccc1	ZINC000491815834	332366840	/nfs/dbraw/zinc/36/68/40/332366840.db2.gz	VEZKAZCYVSNOPC-CQSZACIVSA-N	0	0	294.423	4.004	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)/C=C\C1CC1	ZINC000492032807	332379948	/nfs/dbraw/zinc/37/99/48/332379948.db2.gz	OIJNYYZFIHALOQ-QXMHVHEDSA-N	0	0	269.388	4.443	20	30		CIEDRN
C=CCCCC(=O)N1CC[C@@H](C(F)(F)F)c2ccccc21	ZINC000492292496	332391140	/nfs/dbraw/zinc/39/11/40/332391140.db2.gz	OENCIYUCDVRBEP-CYBMUJFWSA-N	0	0	297.320	4.426	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)/C=C/c1ccc(C)cn1	ZINC000492773493	332412901	/nfs/dbraw/zinc/41/29/01/332412901.db2.gz	WAJYSCBZQSVOIL-OUKQBFOZSA-N	0	0	292.382	4.161	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)/C=C/OCC	ZINC000492957294	332420203	/nfs/dbraw/zinc/42/02/03/332420203.db2.gz	KOZFPABAKPVZMB-VAWYXSNFSA-N	0	0	273.376	4.027	20	30		CIEDRN
N#CCc1cc(Cl)ccc1NC(=O)/C=C\C1CCCC1	ZINC000493141756	332427961	/nfs/dbraw/zinc/42/79/61/332427961.db2.gz	SKLSNDBYFNFXMU-YVMONPNESA-N	0	0	288.778	4.091	20	30		CIEDRN
CCN(C(=O)/C=C/C1CCCC1)[C@@H](C)c1ccc(C#N)cc1	ZINC000493373699	332437642	/nfs/dbraw/zinc/43/76/42/332437642.db2.gz	VNLMTJADUXOZPV-VOMSXAGXSA-N	0	0	296.414	4.214	20	30		CIEDRN
COc1ccc(C#N)cc1N[C@H](C)c1ccccc1Cl	ZINC000493837078	332455967	/nfs/dbraw/zinc/45/59/67/332455967.db2.gz	STFXDYBGZONZKD-LLVKDONJSA-N	0	0	286.762	4.393	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)N[C@H](C)c1ccc(CC)cc1	ZINC000494227863	332467262	/nfs/dbraw/zinc/46/72/62/332467262.db2.gz	RJPJMGAMDQDJRU-RHSMWYFYSA-N	0	0	286.419	4.060	20	30		CIEDRN
COc1cc(C)cc(N[C@H](C)c2ccc(C#N)cc2)c1C	ZINC000494515739	332476939	/nfs/dbraw/zinc/47/69/39/332476939.db2.gz	RGQYXUMECAYLTG-CQSZACIVSA-N	0	0	280.371	4.357	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)N[C@@H](C)c1cc(C)sc1C	ZINC000494698187	332483551	/nfs/dbraw/zinc/48/35/51/332483551.db2.gz	HZEKUVHIFPATMZ-JSGCOSHPSA-N	0	0	292.448	4.176	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N[C@H](C)CCCC(F)(F)F	ZINC000494793162	332485798	/nfs/dbraw/zinc/48/57/98/332485798.db2.gz	IMBMDULJKXMQGI-VXGBXAGGSA-N	0	0	294.361	4.152	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)N[C@@H](c1ccccc1)C1CCC1	ZINC000494906526	332490453	/nfs/dbraw/zinc/49/04/53/332490453.db2.gz	FILRJRPSTHGYLK-MSOLQXFVSA-N	0	0	298.430	4.278	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCc2sc(Cl)cc2C1	ZINC000575750103	335112092	/nfs/dbraw/zinc/11/20/92/335112092.db2.gz	MSPITSPVBWYMBY-UHFFFAOYSA-N	0	0	295.835	4.055	20	30		CIEDRN
CCC[C@H](C(=O)N[C@@H](C#N)c1ccccc1Cl)C(C)C	ZINC000495520993	332521658	/nfs/dbraw/zinc/52/16/58/332521658.db2.gz	KEIVQIXTAFKHCB-WFASDCNBSA-N	0	0	292.810	4.093	20	30		CIEDRN
C=C(CC)CSc1nnc(-c2cccc(Cl)c2)o1	ZINC000552962059	334353229	/nfs/dbraw/zinc/35/32/29/334353229.db2.gz	BTBLJGPRJAQAHO-UHFFFAOYSA-N	0	0	280.780	4.448	20	30		CIEDRN
C=C(CC)CSc1nnc2sc3ccccc3n12	ZINC000552962720	334353255	/nfs/dbraw/zinc/35/32/55/334353255.db2.gz	XXLXCULOIHKLAF-UHFFFAOYSA-N	0	0	275.402	4.002	20	30		CIEDRN
C=CCOc1ccccc1C(=O)N[C@@H](C)c1ccc(C)cc1	ZINC000496299005	332545318	/nfs/dbraw/zinc/54/53/18/332545318.db2.gz	AOZLCCYYSPJWRF-HNNXBMFYSA-N	0	0	295.382	4.051	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](c2cccc(Cl)c2)C1	ZINC000496650988	332555738	/nfs/dbraw/zinc/55/57/38/332555738.db2.gz	NGKKXLOPCWFERJ-DZGCQCFKSA-N	0	0	291.822	4.258	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](c2cccc(Cl)c2)C1	ZINC000496806419	332560739	/nfs/dbraw/zinc/56/07/39/332560739.db2.gz	PNTCVSCAEHMLGP-PBHICJAKSA-N	0	0	291.822	4.258	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CC[C@@H](C)C2(CCCCC2)C1	ZINC000500198386	332602428	/nfs/dbraw/zinc/60/24/28/332602428.db2.gz	DGHHKSYEEZMKJQ-OAHLLOKOSA-N	0	0	277.452	4.408	20	30		CIEDRN
C=CCC(C)(C)C(=O)N(CCC)CCc1cccs1	ZINC000500271106	332604153	/nfs/dbraw/zinc/60/41/53/332604153.db2.gz	JDHKVMUWJYPCLR-UHFFFAOYSA-N	0	0	279.449	4.132	20	30		CIEDRN
N#Cc1cccc(N[C@H]2CCC[C@@H](c3cccnc3)C2)c1	ZINC000500393025	332606303	/nfs/dbraw/zinc/60/63/03/332606303.db2.gz	AAUZFGBJRBXCFI-QAPCUYQASA-N	0	0	277.371	4.092	20	30		CIEDRN
C[C@]1(c2ccccc2)CCCN(c2ccc(C#N)cc2)C1	ZINC000500390532	332606363	/nfs/dbraw/zinc/60/63/63/332606363.db2.gz	RBYTYTYEZZZGAO-IBGZPJMESA-N	0	0	276.383	4.116	20	30		CIEDRN
CCCCCC(=O)N(Cc1ccco1)c1ccccc1C#N	ZINC000501004799	332623698	/nfs/dbraw/zinc/62/36/98/332623698.db2.gz	YUXPCSBTSPLJPC-UHFFFAOYSA-N	0	0	296.370	4.265	20	30		CIEDRN
COc1ccc(CNc2cc(C#N)ccc2C)c(Cl)c1	ZINC000501007693	332623908	/nfs/dbraw/zinc/62/39/08/332623908.db2.gz	YYJVTZKOJZXNDY-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
C=CCCC1(C(=O)N2CCC=C(c3ccccc3)C2)CC1	ZINC000501415969	332632598	/nfs/dbraw/zinc/63/25/98/332632598.db2.gz	BOCSEQYOLFRPRQ-UHFFFAOYSA-N	0	0	281.399	4.049	20	30		CIEDRN
Cc1cc(C)cc([C@H](C)NC(=O)Nc2ccc(C#N)cc2)c1	ZINC000501998434	332644963	/nfs/dbraw/zinc/64/49/63/332644963.db2.gz	YHTKJQCXJOSAAU-AWEZNQCLSA-N	0	0	293.370	4.058	20	30		CIEDRN
C=CCCCCCN(C)C(=O)N[C@@H](C)c1cc(C)oc1C	ZINC000502180206	332649981	/nfs/dbraw/zinc/64/99/81/332649981.db2.gz	FOQFXYKXMXXYSS-AWEZNQCLSA-N	0	0	292.423	4.345	20	30		CIEDRN
C=CCCc1ccccc1N[C@H](C)[C@@H]1CCCOC1	ZINC000502306053	332653072	/nfs/dbraw/zinc/65/30/72/332653072.db2.gz	ZEKKRIUJOLJRCY-GDBMZVCRSA-N	0	0	259.393	4.032	20	30		CIEDRN
CC1(C)CCC(CC(=O)Nc2ccc(CC#N)cc2)CC1	ZINC000502313455	332653438	/nfs/dbraw/zinc/65/34/38/332653438.db2.gz	BWDYFHNEAFXQRF-UHFFFAOYSA-N	0	0	284.403	4.298	20	30		CIEDRN
CC(C)C[C@@](C)(C#N)NC(=O)c1cc(Cl)cc(Cl)c1	ZINC000502424701	332658526	/nfs/dbraw/zinc/65/85/26/332658526.db2.gz	LUBWZLSVKOKASM-AWEZNQCLSA-N	0	0	299.201	4.052	20	30		CIEDRN
CC(C)c1ccc(NC(=O)Nc2ccc(F)c(C#N)c2)cc1	ZINC000502536660	332665002	/nfs/dbraw/zinc/66/50/02/332665002.db2.gz	BCJVLRBDJVLWMM-UHFFFAOYSA-N	0	0	297.333	4.465	20	30		CIEDRN
CCCC[C@H](C)C(=O)N(CC)[C@@H](C)c1ccc(C#N)cc1	ZINC000503132219	332682071	/nfs/dbraw/zinc/68/20/71/332682071.db2.gz	POKQJLJPJOHNFX-GJZGRUSLSA-N	0	0	286.419	4.294	20	30		CIEDRN
CCCC[C@@H](C)C(=O)N(CC)[C@H](C)c1ccc(C#N)cc1	ZINC000503132220	332682138	/nfs/dbraw/zinc/68/21/38/332682138.db2.gz	POKQJLJPJOHNFX-HUUCEWRRSA-N	0	0	286.419	4.294	20	30		CIEDRN
CCCC[C@@H](C)C(=O)Nc1cc(C#N)ccc1OC(C)C	ZINC000503170411	332683340	/nfs/dbraw/zinc/68/33/40/332683340.db2.gz	HAPRRUHZFXUNDK-CYBMUJFWSA-N	0	0	288.391	4.110	20	30		CIEDRN
CCC1CCC(N(C)C(=O)Nc2cc(C#N)ccc2C)CC1	ZINC000503356654	332687210	/nfs/dbraw/zinc/68/72/10/332687210.db2.gz	HBSNSQWDPDZVQQ-UHFFFAOYSA-N	0	0	299.418	4.299	20	30		CIEDRN
C=CCCCNC(=O)N1C[C@H](C)CC[C@@H]1c1ccccc1	ZINC000503394500	332688477	/nfs/dbraw/zinc/68/84/77/332688477.db2.gz	IKQXRPQEZGFVLA-NVXWUHKLSA-N	0	0	286.419	4.135	20	30		CIEDRN
Cc1cc(C)cc(NC(=O)c2cc(C#N)ccc2Cl)c1	ZINC000504524906	332714042	/nfs/dbraw/zinc/71/40/42/332714042.db2.gz	SCSLUDGANASSDL-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)C[C@@H]1CCC[C@H](C)C1	ZINC000504590610	332716003	/nfs/dbraw/zinc/71/60/03/332716003.db2.gz	FDXJIXMWDWGJLI-GXTWGEPZSA-N	0	0	270.376	4.022	20	30		CIEDRN
Cc1ccc(/C=C/c2ccncc2C#N)cc1Br	ZINC000504713177	332719243	/nfs/dbraw/zinc/71/92/43/332719243.db2.gz	UTIULWNBMDEGLZ-SNAWJCMRSA-N	0	0	299.171	4.195	20	30		CIEDRN
N#Cc1cnccc1/C=C/c1cc(Cl)ccc1Cl	ZINC000504731586	332719707	/nfs/dbraw/zinc/71/97/07/332719707.db2.gz	PPUJIPCEYGHSEP-OWOJBTEDSA-N	0	0	275.138	4.430	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N(C)CC1CCCC1	ZINC000505000864	332727354	/nfs/dbraw/zinc/72/73/54/332727354.db2.gz	LINCTNARSNCNBQ-UHFFFAOYSA-N	0	0	286.419	4.459	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CCCC1(C)C	ZINC000505000982	332727363	/nfs/dbraw/zinc/72/73/63/332727363.db2.gz	MSIJLPVAVCANLA-UHFFFAOYSA-N	0	0	272.392	4.212	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1C[C@H](C)CC[C@H]1C	ZINC000505002043	332727394	/nfs/dbraw/zinc/72/73/94/332727394.db2.gz	ZRWMCJPZRLHYLW-HUUCEWRRSA-N	0	0	286.419	4.458	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N(C)CCC1CC1	ZINC000505001619	332727446	/nfs/dbraw/zinc/72/74/46/332727446.db2.gz	WIOHPHYSELWCBJ-UHFFFAOYSA-N	0	0	272.392	4.069	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CCCC[C@H](C)C1	ZINC000505011169	332727741	/nfs/dbraw/zinc/72/77/41/332727741.db2.gz	QZQYWYOVXRJIGN-HNNXBMFYSA-N	0	0	286.419	4.459	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CCC(C=C)CC1	ZINC000505017811	332727904	/nfs/dbraw/zinc/72/79/04/332727904.db2.gz	ZOINEDCIFQFNJH-UHFFFAOYSA-N	0	0	284.403	4.235	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N(C)[C@H](C)C1CCC1	ZINC000505024522	332728279	/nfs/dbraw/zinc/72/82/79/332728279.db2.gz	UQEHJHYGFOQMCA-CQSZACIVSA-N	0	0	286.419	4.458	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N(C)[C@H]1CC[C@@H](C)C1	ZINC000505028214	332728385	/nfs/dbraw/zinc/72/83/85/332728385.db2.gz	AALXUBLSGGQMBE-ZBFHGGJFSA-N	0	0	286.419	4.458	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N(CC)C1CCC1	ZINC000505035204	332728646	/nfs/dbraw/zinc/72/86/46/332728646.db2.gz	LBVBNFQBAAVLMM-UHFFFAOYSA-N	0	0	272.392	4.212	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N(C)CCCC	ZINC000505045296	332728929	/nfs/dbraw/zinc/72/89/29/332728929.db2.gz	HVKOHMSTVFAYSY-UHFFFAOYSA-N	0	0	260.381	4.069	20	30		CIEDRN
CCc1sc(C(=O)N(CCC#N)CCC(C)C)cc1C	ZINC000505213698	332733852	/nfs/dbraw/zinc/73/38/52/332733852.db2.gz	QBFBPNNNRHVYDE-UHFFFAOYSA-N	0	0	292.448	4.021	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)c1sccc1Cl	ZINC000505275212	332735712	/nfs/dbraw/zinc/73/57/12/332735712.db2.gz	YSBZOFKDNAPHQO-UHFFFAOYSA-N	0	0	291.803	4.230	20	30		CIEDRN
C=C(C)CCSc1nnc(-c2ccccc2)n1CC	ZINC000505444928	332740807	/nfs/dbraw/zinc/74/08/07/332740807.db2.gz	VBLXURFHPFXBOY-UHFFFAOYSA-N	0	0	273.405	4.023	20	30		CIEDRN
C=C(C)CCSc1nnc(C[C@@H](C)c2ccccc2)o1	ZINC000505479815	332741877	/nfs/dbraw/zinc/74/18/77/332741877.db2.gz	JBCRMIDWUNBIIR-CYBMUJFWSA-N	0	0	288.416	4.474	20	30		CIEDRN
Cc1cc(C(F)(F)F)c(C#N)c(SCC[C@H](C)F)n1	ZINC000505481688	332741960	/nfs/dbraw/zinc/74/19/60/332741960.db2.gz	SSQFPUSGNLNJGI-ZETCQYMHSA-N	0	0	292.301	4.121	20	30		CIEDRN
C=C(C)CCn1nc(-c2cccs2)c2ccccc2c1=O	ZINC000505659785	332748197	/nfs/dbraw/zinc/74/81/97/332748197.db2.gz	KGNPWOBQPXHDNH-UHFFFAOYSA-N	0	0	296.395	4.091	20	30		CIEDRN
C[C@@H](CC(=O)N[C@H](C#N)c1ccccc1Cl)C(C)(C)C	ZINC000505684839	332749058	/nfs/dbraw/zinc/74/90/58/332749058.db2.gz	RUKHWGPGKJOURC-SMDDNHRTSA-N	0	0	292.810	4.093	20	30		CIEDRN
C=CCN(CC=C)Cc1ccc(-c2ccncc2)cc1F	ZINC000505893107	332756688	/nfs/dbraw/zinc/75/66/88/332756688.db2.gz	ANUDKCVGIIHUQM-UHFFFAOYSA-N	0	0	282.362	4.062	20	30		CIEDRN
C=CCN(Cc1ccc(C(F)(F)F)cc1)CC(F)(F)F	ZINC000511956445	332948630	/nfs/dbraw/zinc/94/86/30/332948630.db2.gz	JPJVRZMJDLXUKQ-UHFFFAOYSA-N	0	0	297.242	4.256	20	30		CIEDRN
Cc1ccc(-c2ccc(CN(CC#N)C3CC3)s2)cc1	ZINC000511979377	332949695	/nfs/dbraw/zinc/94/96/95/332949695.db2.gz	VJKKEWLVZOSRIG-UHFFFAOYSA-N	0	0	282.412	4.212	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)[C@@H](c1ccccc1)C(C)C	ZINC000172909972	332953046	/nfs/dbraw/zinc/95/30/46/332953046.db2.gz	GOXZOUJZJRAZRR-GOSISDBHSA-N	0	0	292.382	4.245	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1sc2ccc(C#N)cc2c1C	ZINC000512097687	332953723	/nfs/dbraw/zinc/95/37/23/332953723.db2.gz	GBBCCQYJEMEKCD-ZDUSSCGKSA-N	0	0	298.411	4.166	20	30		CIEDRN
CCOCc1cccc(N[C@@H](C)c2ccc(C#N)cc2F)c1	ZINC000512282083	332961069	/nfs/dbraw/zinc/96/10/69/332961069.db2.gz	TUYUHGFFKALDBT-ZDUSSCGKSA-N	0	0	298.361	4.407	20	30		CIEDRN
C[C@@H](NC1(c2ccc(F)cc2)CC1)c1ccc(C#N)cc1F	ZINC000512287528	332961757	/nfs/dbraw/zinc/96/17/57/332961757.db2.gz	IHGHQDUKUNNLBU-GFCCVEGCSA-N	0	0	298.336	4.176	20	30		CIEDRN
CCc1ccccc1N[C@@H](C)c1ccc(C#N)cc1F	ZINC000512656403	332978077	/nfs/dbraw/zinc/97/80/77/332978077.db2.gz	ZQSQDMNBQGEMQK-LBPRGKRZSA-N	0	0	268.335	4.433	20	30		CIEDRN
COc1c(C)ccc(N[C@@H](C)c2ccc(C#N)cc2F)c1C	ZINC000512655470	332978148	/nfs/dbraw/zinc/97/81/48/332978148.db2.gz	UQSKNSSAUMEUED-ZDUSSCGKSA-N	0	0	298.361	4.496	20	30		CIEDRN
Cc1cccc(N[C@@H](C)c2ccc(C#N)cc2F)c1	ZINC000512660525	332978371	/nfs/dbraw/zinc/97/83/71/332978371.db2.gz	NRRXWUOJMBGANJ-LBPRGKRZSA-N	0	0	254.308	4.179	20	30		CIEDRN
COc1ccccc1[C@@H](C)N[C@H](C)c1ccc(C#N)cc1F	ZINC000512661570	332978599	/nfs/dbraw/zinc/97/85/99/332978599.db2.gz	SPCKTLXOSVZRRR-CHWSQXEVSA-N	0	0	298.361	4.118	20	30		CIEDRN
C=CCCOCCCCC(=O)N(C)[C@H](C)C1CCCCC1	ZINC000512737810	332982606	/nfs/dbraw/zinc/98/26/06/332982606.db2.gz	JIHREESHLBMMNP-MRXNPFEDSA-N	0	0	295.467	4.177	20	30		CIEDRN
C=CCCC1(C(=O)N(C)[C@H](C)C2CCCCC2)CC1	ZINC000512775805	332985117	/nfs/dbraw/zinc/98/51/17/332985117.db2.gz	CQLZCOFXYNMROW-CQSZACIVSA-N	0	0	263.425	4.160	20	30		CIEDRN
C=CCCCC(=O)N[C@H](C)c1ccc(OC(C)C)cc1	ZINC000175241257	333018466	/nfs/dbraw/zinc/01/84/66/333018466.db2.gz	NFIJCVFDRXWFLF-CQSZACIVSA-N	0	0	275.392	4.007	20	30		CIEDRN
C=CCN(CC=C)C(=O)Nc1cccc(O[C@H](C)CC)c1	ZINC000513568048	333025247	/nfs/dbraw/zinc/02/52/47/333025247.db2.gz	JYOAELPKGHNJCD-CQSZACIVSA-N	0	0	288.391	4.070	20	30		CIEDRN
C=CCSCc1ccc(F)cc1Br	ZINC000308200272	333026071	/nfs/dbraw/zinc/02/60/71/333026071.db2.gz	UOXBEKALZIAZGV-UHFFFAOYSA-N	0	0	261.159	4.007	20	30		CIEDRN
Cc1ccc([C@@H]2CCCN2c2ncc(C#N)cc2Cl)cc1	ZINC000513602147	333026159	/nfs/dbraw/zinc/02/61/59/333026159.db2.gz	CXJFIOGCBCECJJ-INIZCTEOSA-N	0	0	297.789	4.257	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCCCCc1ccc(Cl)s1	ZINC000513611729	333026653	/nfs/dbraw/zinc/02/66/53/333026653.db2.gz	OBUHSBDODUOSTC-UHFFFAOYSA-N	0	0	299.867	4.443	20	30		CIEDRN
Cc1cc(N[C@@H](C)c2ccccc2Cl)cc(C#N)n1	ZINC000308283100	333026827	/nfs/dbraw/zinc/02/68/27/333026827.db2.gz	ZDKMAVSOJWZABF-NSHDSACASA-N	0	0	271.751	4.088	20	30		CIEDRN
Cc1ccc2oc(Sc3ccc(C#N)cc3)nc2c1	ZINC000513634521	333027958	/nfs/dbraw/zinc/02/79/58/333027958.db2.gz	BYVKYIPJJTWQFQ-UHFFFAOYSA-N	0	0	266.325	4.159	20	30		CIEDRN
Cc1ccc([C@@H](C)N(C)c2ncc(C#N)cc2Cl)cc1	ZINC000513645887	333028860	/nfs/dbraw/zinc/02/88/60/333028860.db2.gz	QZHZSPJFSNSSRU-GFCCVEGCSA-N	0	0	285.778	4.113	20	30		CIEDRN
N#Cc1cnc(Sc2ccc(F)c(F)c2)c(Cl)c1	ZINC000513651866	333029334	/nfs/dbraw/zinc/02/93/34/333029334.db2.gz	FTAXJXFGANXRMQ-UHFFFAOYSA-N	0	0	282.702	4.036	20	30		CIEDRN
C=CCCC(=O)N(C)[C@@H](C)[C@@H](C)c1ccc(Cl)cc1	ZINC000175705704	333029934	/nfs/dbraw/zinc/02/99/34/333029934.db2.gz	HNULXPNOHBNFND-OLZOCXBDSA-N	0	0	279.811	4.257	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)[C@@H]1CCC(C)(C)C1	ZINC000513673953	333031543	/nfs/dbraw/zinc/03/15/43/333031543.db2.gz	ACXJCDKIJISCEU-CQSZACIVSA-N	0	0	289.394	4.167	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(CC(F)(F)F)cc1	ZINC000175777902	333032545	/nfs/dbraw/zinc/03/25/45/333032545.db2.gz	AYMFBCDKRHJNMH-UHFFFAOYSA-N	0	0	271.282	4.086	20	30		CIEDRN
CCN(C(=O)[C@@H]1CCC(C)(C)C1)[C@H](C)c1ccc(C#N)cc1	ZINC000513709327	333034238	/nfs/dbraw/zinc/03/42/38/333034238.db2.gz	FWRFDLXCIDHMCB-RHSMWYFYSA-N	0	0	298.430	4.294	20	30		CIEDRN
CC(C)Oc1ccc(CN(CCC#N)CC(C)(C)C)cc1	ZINC000513725130	333035705	/nfs/dbraw/zinc/03/57/05/333035705.db2.gz	MPJQCKMOSZOSBQ-UHFFFAOYSA-N	0	0	288.435	4.236	20	30		CIEDRN
CC(C)CCN(C/C=C/c1ccc(F)cc1)CCC#N	ZINC000513736964	333036757	/nfs/dbraw/zinc/03/67/57/333036757.db2.gz	QFASMCLNNRPNOK-HWKANZROSA-N	0	0	274.383	4.101	20	30		CIEDRN
C=CCOc1ccc(CN(CCC#N)CC(C)(C)C)cc1	ZINC000513741152	333037063	/nfs/dbraw/zinc/03/70/63/333037063.db2.gz	GVWDCUIWNOWGML-UHFFFAOYSA-N	0	0	286.419	4.013	20	30		CIEDRN
Cc1ccccc1C[C@@H]1CCCN1c1cccc(F)c1C#N	ZINC000513744354	333037147	/nfs/dbraw/zinc/03/71/47/333037147.db2.gz	JTDUFKTUZZTXLJ-INIZCTEOSA-N	0	0	294.373	4.217	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccc(SC)c(Cl)c1	ZINC000176120327	333039388	/nfs/dbraw/zinc/03/93/88/333039388.db2.gz	IWOYRDCYQKIZTA-UHFFFAOYSA-N	0	0	298.839	4.492	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@@H](C)c1c(F)cccc1Cl	ZINC000176156456	333039792	/nfs/dbraw/zinc/03/97/92/333039792.db2.gz	ABRVGHMPKCMFJX-NSHDSACASA-N	0	0	298.789	4.148	20	30		CIEDRN
CCCn1c2ccc(C)cc2nc1-c1cccc(C#N)c1	ZINC000513858384	333043580	/nfs/dbraw/zinc/04/35/80/333043580.db2.gz	YZRRAAPBTJRTNT-UHFFFAOYSA-N	0	0	275.355	4.293	20	30		CIEDRN
C=CCCCNc1cc(Br)ccc1OCC	ZINC000309904325	333051326	/nfs/dbraw/zinc/05/13/26/333051326.db2.gz	JKLFYXPIZXTTQW-UHFFFAOYSA-N	0	0	284.197	4.226	20	30		CIEDRN
C=CCNC(=O)N[C@H](C)c1ccccc1Oc1ccccc1	ZINC000513924063	333051441	/nfs/dbraw/zinc/05/14/41/333051441.db2.gz	NRWUOMHSIUNJDX-CQSZACIVSA-N	0	0	296.370	4.025	20	30		CIEDRN
Cc1cc(C(C)(C)C)cc(C)c1CN(C)C[C@@H](C)C#N	ZINC000513958736	333054880	/nfs/dbraw/zinc/05/48/80/333054880.db2.gz	WVSMMRVHFHBUEV-ZDUSSCGKSA-N	0	0	272.436	4.192	20	30		CIEDRN
CC(C)(C#N)CCCSc1nc2cc(F)c(F)cc2[nH]1	ZINC000177244969	333055675	/nfs/dbraw/zinc/05/56/75/333055675.db2.gz	SAYNMJKOYBWSCL-UHFFFAOYSA-N	0	0	295.358	4.263	20	30		CIEDRN
C[C@@H](c1ccc(F)cc1)N(C)Cc1cc(F)ccc1C#N	ZINC000177259710	333056371	/nfs/dbraw/zinc/05/63/71/333056371.db2.gz	GSSPFEPAPQCQSD-LBPRGKRZSA-N	0	0	286.325	4.029	20	30		CIEDRN
C=CCCCC(=O)N(CC=C)Cc1ccc(Cl)s1	ZINC000177473833	333059504	/nfs/dbraw/zinc/05/95/04/333059504.db2.gz	JKIZTBPZVPMLSI-UHFFFAOYSA-N	0	0	283.824	4.272	20	30		CIEDRN
C=CCCCC(=O)Nc1cccc(C(F)(F)F)c1C	ZINC000177759803	333062726	/nfs/dbraw/zinc/06/27/26/333062726.db2.gz	UNRVRVFCEODZFB-UHFFFAOYSA-N	0	0	271.282	4.309	20	30		CIEDRN
C=CCCCC(=O)Nc1cnccc1Oc1ccccc1	ZINC000177787364	333063054	/nfs/dbraw/zinc/06/30/54/333063054.db2.gz	JDZVJZIEYGXBNP-UHFFFAOYSA-N	0	0	282.343	4.169	20	30		CIEDRN
C=C(C)CS[C@@H](C)C(=O)Nc1cc(Cl)ccc1C	ZINC000177864539	333064485	/nfs/dbraw/zinc/06/44/85/333064485.db2.gz	GOERGAJVSBXLKX-NSHDSACASA-N	0	0	283.824	4.285	20	30		CIEDRN
C=C(C)CS[C@@H](C)c1nc(Cc2ccccc2)no1	ZINC000177866338	333064523	/nfs/dbraw/zinc/06/45/23/333064523.db2.gz	FJBUAXXQLMIGLX-LBPRGKRZSA-N	0	0	274.389	4.031	20	30		CIEDRN
C=CCCCC(=O)Nc1cccc(Cl)c1OC(C)C	ZINC000177868796	333064640	/nfs/dbraw/zinc/06/46/40/333064640.db2.gz	IRWRJTDPEHXGTN-UHFFFAOYSA-N	0	0	281.783	4.422	20	30		CIEDRN
C=CCCCC(=O)N1CCCC[C@H]1c1ccc(C)cc1	ZINC000177888560	333064977	/nfs/dbraw/zinc/06/49/77/333064977.db2.gz	RYDLIXZMRSZAIP-KRWDZBQOSA-N	0	0	271.404	4.405	20	30		CIEDRN
CC(C)SCCNc1ccc(C(F)(F)F)cc1C#N	ZINC000311503659	333069370	/nfs/dbraw/zinc/06/93/70/333069370.db2.gz	YWRWETVEVJPFQL-UHFFFAOYSA-N	0	0	288.338	4.131	20	30		CIEDRN
N#Cc1ccc(N2CCC3(C2)CCCCC3)cc1Cl	ZINC000311627253	333070387	/nfs/dbraw/zinc/07/03/87/333070387.db2.gz	URZQRDAAEMIFRE-UHFFFAOYSA-N	0	0	274.795	4.372	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@H]1c1cc(C)ccc1C	ZINC000178295544	333070636	/nfs/dbraw/zinc/07/06/36/333070636.db2.gz	IWGKFJPVFSZQEL-KRWDZBQOSA-N	0	0	271.404	4.323	20	30		CIEDRN
CO[C@@H](C)c1cccc(NCc2cc(C#N)ccc2F)c1	ZINC000178360853	333071471	/nfs/dbraw/zinc/07/14/71/333071471.db2.gz	QRESYXXAGFUPJV-LBPRGKRZSA-N	0	0	284.334	4.017	20	30		CIEDRN
CC(C)CCNc1ccccc1SC[C@H](C)C#N	ZINC000178387237	333071963	/nfs/dbraw/zinc/07/19/63/333071963.db2.gz	OOHRVFQTJJXGIW-CYBMUJFWSA-N	0	0	262.422	4.396	20	30		CIEDRN
C=CCC[C@H](NC(=O)N(C)C1CCCC1)c1ccccc1	ZINC000178452086	333073086	/nfs/dbraw/zinc/07/30/86/333073086.db2.gz	MKCYGHLOLNHUQK-KRWDZBQOSA-N	0	0	286.419	4.278	20	30		CIEDRN
C[C@@H](CC(=O)Nc1ccc(C#N)c(Cl)c1)C(C)(C)C	ZINC000312029464	333075799	/nfs/dbraw/zinc/07/57/99/333075799.db2.gz	XOPKQERTOMOXOX-JTQLQIEISA-N	0	0	278.783	4.222	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(-c2ccccc2CC)no1	ZINC000516811290	333082964	/nfs/dbraw/zinc/08/29/64/333082964.db2.gz	MJAKEFFNQYEICG-MRXNPFEDSA-N	0	0	256.349	4.153	20	30		CIEDRN
Cc1cc(F)ccc1C[S@](=O)CCCCC(C)(C)C#N	ZINC000516842803	333083955	/nfs/dbraw/zinc/08/39/55/333083955.db2.gz	JWXREBWWQJELKC-HXUWFJFHSA-N	0	0	295.423	4.103	20	30		CIEDRN
CC(C)(C#N)CCCSCCCC1CCOCC1	ZINC000516847327	333084225	/nfs/dbraw/zinc/08/42/25/333084225.db2.gz	QUOWRSGZEDAQLE-UHFFFAOYSA-N	0	0	269.454	4.256	20	30		CIEDRN
O=C(Cc1cccc(F)c1)NC1C2CC3CC(C2)CC1C3	ZINC000007037230	333089971	/nfs/dbraw/zinc/08/99/71/333089971.db2.gz	LAGXWPHHSZUGNU-UHFFFAOYSA-N	0	0	287.378	4.149	20	30		CIEDRN
N#CCC[C@H](C#N)CNc1ccccc1CCC(F)(F)F	ZINC000517129224	333093015	/nfs/dbraw/zinc/09/30/15/333093015.db2.gz	GRQTVYLEWJGBNV-GFCCVEGCSA-N	0	0	295.308	4.037	20	30		CIEDRN
N#Cc1ccc(-c2nc(-c3ccc(Cl)cc3F)no2)cc1	ZINC000517187551	333094256	/nfs/dbraw/zinc/09/42/56/333094256.db2.gz	NJKGYMOWLIBIJO-UHFFFAOYSA-N	0	0	299.692	4.068	20	30		CIEDRN
C=CCN(CC=C)C(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1	ZINC000520861734	333107148	/nfs/dbraw/zinc/10/71/48/333107148.db2.gz	BJCRICXUHLGPBB-RBUKOAKNSA-N	0	0	291.394	4.144	20	30		CIEDRN
CC1(C)CCc2cc(/C=C/c3ccc(C#N)cn3)ccc2O1	ZINC000520994504	333109511	/nfs/dbraw/zinc/10/95/11/333109511.db2.gz	LXNYLKAANKACTJ-ZZXKWVIFSA-N	0	0	290.366	4.227	20	30		CIEDRN
CC(C)C[N@H+](Cc1ccccc1)Cc1ccccc1C#N	ZINC000521189092	333114263	/nfs/dbraw/zinc/11/42/63/333114263.db2.gz	ZVOHKSXBEJBQHK-UHFFFAOYSA-N	0	0	278.399	4.216	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1ccc(OCC)c(F)c1	ZINC000521289936	333117091	/nfs/dbraw/zinc/11/70/91/333117091.db2.gz	QYEBVBXJBOQVPB-LBPRGKRZSA-N	0	0	294.370	4.091	20	30		CIEDRN
CCC(=O)c1cccc(NCc2ccc(Cl)cc2C#N)c1	ZINC000184492753	333129289	/nfs/dbraw/zinc/12/92/89/333129289.db2.gz	TYHQOWMZCWSFFC-UHFFFAOYSA-N	0	0	298.773	4.416	20	30		CIEDRN
CC(C)CCc1ccc(N[C@@H]2CC[C@@H](C#N)C2)cc1	ZINC000564159312	333132184	/nfs/dbraw/zinc/13/21/84/333132184.db2.gz	UBUFFXGAOWISQW-NVXWUHKLSA-N	0	0	256.393	4.379	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(Cl)cc1C	ZINC000184868447	333132828	/nfs/dbraw/zinc/13/28/28/333132828.db2.gz	UJQIZGHPCIUWHI-NSHDSACASA-N	0	0	251.757	4.189	20	30		CIEDRN
CC#CCCCC(=O)Nc1cc(Cl)ccc1Cl	ZINC000184862385	333132920	/nfs/dbraw/zinc/13/29/20/333132920.db2.gz	HAMNGASLYCWHAP-UHFFFAOYSA-N	0	0	270.159	4.126	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccccc1N1CCCCC1	ZINC000184887374	333133043	/nfs/dbraw/zinc/13/30/43/333133043.db2.gz	DOVWKKFVFXVYTR-HNNXBMFYSA-N	0	0	286.419	4.218	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1sc2c(c1C#N)CCCC2	ZINC000184903688	333133075	/nfs/dbraw/zinc/13/30/75/333133075.db2.gz	LXKVFZOQGPMVCA-LLVKDONJSA-N	0	0	288.416	4.039	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(C)cc1Br	ZINC000184888643	333133105	/nfs/dbraw/zinc/13/31/05/333133105.db2.gz	XOASBSOQBHHORN-LLVKDONJSA-N	0	0	296.208	4.298	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](C)c1cc2ccccc2o1	ZINC000184920420	333133253	/nfs/dbraw/zinc/13/32/53/333133253.db2.gz	NEUVXHZCHBPWOR-STQMWFEESA-N	0	0	271.360	4.212	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1coc2cc(C)c(C)cc12	ZINC000184960242	333133987	/nfs/dbraw/zinc/13/39/87/333133987.db2.gz	BQARAKAKKVSUFT-UHFFFAOYSA-N	0	0	271.360	4.088	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(Cc1ccco1)Cc1ccccc1	ZINC000184989929	333134063	/nfs/dbraw/zinc/13/40/63/333134063.db2.gz	LZWYIBGOULJCTB-INIZCTEOSA-N	0	0	297.398	4.411	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](c1ccc(OC)cc1)C(C)C	ZINC000184986557	333134217	/nfs/dbraw/zinc/13/42/17/333134217.db2.gz	JTWSUVFPEVKBKI-YOEHRIQHSA-N	0	0	289.419	4.111	20	30		CIEDRN
CC#CCCCC(=O)N(Cc1ccccc1)[C@H](C)CC	ZINC000185009787	333134412	/nfs/dbraw/zinc/13/44/12/333134412.db2.gz	OOFKFFSRANMSHX-MRXNPFEDSA-N	0	0	271.404	4.007	20	30		CIEDRN
CC#CCCCC(=O)N(Cc1cccc(Cl)c1)C(C)C	ZINC000185235579	333137294	/nfs/dbraw/zinc/13/72/94/333137294.db2.gz	WSZNOOZSEPLHRP-UHFFFAOYSA-N	0	0	291.822	4.271	20	30		CIEDRN
CC#CCCCC(=O)N(C1CC1)[C@@H]1CCCc2ccccc21	ZINC000185246562	333137435	/nfs/dbraw/zinc/13/74/35/333137435.db2.gz	DXGYEJZOIYDJPL-LJQANCHMSA-N	0	0	295.426	4.249	20	30		CIEDRN
CC#CCCCC(=O)N(C1CC1)[C@H]1CCCc2ccccc21	ZINC000185246578	333137559	/nfs/dbraw/zinc/13/75/59/333137559.db2.gz	DXGYEJZOIYDJPL-IBGZPJMESA-N	0	0	295.426	4.249	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(Cc1ccc(C)s1)C(C)C	ZINC000185266584	333137888	/nfs/dbraw/zinc/13/78/88/333137888.db2.gz	OEVUPIVBDUOYEX-ZDUSSCGKSA-N	0	0	279.449	4.396	20	30		CIEDRN
CC#CCCCC(=O)N(C)[C@@H](c1ccccc1)C(C)C	ZINC000185546196	333143477	/nfs/dbraw/zinc/14/34/77/333143477.db2.gz	CJVHOHDPMQMDQC-GOSISDBHSA-N	0	0	271.404	4.036	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cnccc1Oc1ccccc1	ZINC000185565206	333143938	/nfs/dbraw/zinc/14/39/38/333143938.db2.gz	QRFGWFGSMOWGJW-CQSZACIVSA-N	0	0	296.370	4.415	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(c1ccc(OC)c(F)c1)C(C)C	ZINC000185608351	333144895	/nfs/dbraw/zinc/14/48/95/333144895.db2.gz	YDFFDGGXOAWDDP-CYBMUJFWSA-N	0	0	293.382	4.178	20	30		CIEDRN
CC#CCCCC(=O)N1CCC[C@H](C)[C@H]1c1ccc(C)cc1	ZINC000185634322	333145662	/nfs/dbraw/zinc/14/56/62/333145662.db2.gz	ZKORDELMDWNZPU-PXNSSMCTSA-N	0	0	297.442	4.488	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCC1(c2cccc(Cl)c2)CC1	ZINC000185640680	333145664	/nfs/dbraw/zinc/14/56/64/333145664.db2.gz	UCCCYVIIVIIWSJ-ZDUSSCGKSA-N	0	0	291.822	4.090	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](c2ccccc2)[C@@H](C)C1	ZINC000185680229	333146597	/nfs/dbraw/zinc/14/65/97/333146597.db2.gz	INGOZRJBQVTQNC-XYJFISCASA-N	0	0	285.431	4.241	20	30		CIEDRN
CCCOc1cc(F)ccc1N[C@H]1CCC[C@@H](C#N)C1	ZINC000185731441	333147476	/nfs/dbraw/zinc/14/74/76/333147476.db2.gz	YSHLDKYJBNGWBO-OCCSQVGLSA-N	0	0	276.355	4.109	20	30		CIEDRN
N#C[C@@H]1CCC[C@@H](Nc2cccc(C(F)(F)F)c2)C1	ZINC000185735186	333147697	/nfs/dbraw/zinc/14/76/97/333147697.db2.gz	MZASERLCGGRDHQ-ZYHUDNBSSA-N	0	0	268.282	4.200	20	30		CIEDRN
CC(C)COc1ccccc1N[C@H]1CCC[C@@H](C#N)C1	ZINC000185738359	333147700	/nfs/dbraw/zinc/14/77/00/333147700.db2.gz	BGRKMHNPBLOQAY-CABCVRRESA-N	0	0	272.392	4.216	20	30		CIEDRN
CC#CCCCC(=O)Nc1cc(C(F)(F)F)ccc1C	ZINC000185746792	333147831	/nfs/dbraw/zinc/14/78/31/333147831.db2.gz	CJIWFNCPCVBBHV-UHFFFAOYSA-N	0	0	283.293	4.146	20	30		CIEDRN
CC#CCCCC(=O)N(C)c1cc(Cl)cc(Cl)c1	ZINC000185787884	333148750	/nfs/dbraw/zinc/14/87/50/333148750.db2.gz	GNMGTXPUQQMAHN-UHFFFAOYSA-N	0	0	284.186	4.150	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)C[C@H]1CCC[C@H]1C	ZINC000185870264	333150690	/nfs/dbraw/zinc/15/06/90/333150690.db2.gz	LOZUZBLRYHHYOV-ZIAGYGMSSA-N	0	0	277.433	4.089	20	30		CIEDRN
Cc1ccc(N[C@H]2CCC[C@@H](C#N)C2)c2cccnc12	ZINC000185888707	333151159	/nfs/dbraw/zinc/15/11/59/333151159.db2.gz	CABQWFKNQWQTRF-KGLIPLIRSA-N	0	0	265.360	4.038	20	30		CIEDRN
Cc1ccc2cccc(N[C@@H]3CCC[C@@H](C#N)C3)c2n1	ZINC000185888853	333151183	/nfs/dbraw/zinc/15/11/83/333151183.db2.gz	OZFXZGYMFYFFMB-UKRRQHHQSA-N	0	0	265.360	4.038	20	30		CIEDRN
Cc1ccc(N[C@H]2CCC[C@H](C#N)C2)c2cccnc12	ZINC000185888669	333151244	/nfs/dbraw/zinc/15/12/44/333151244.db2.gz	CABQWFKNQWQTRF-KBPBESRZSA-N	0	0	265.360	4.038	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H](C)[C@H]1CCC	ZINC000185925564	333151868	/nfs/dbraw/zinc/15/18/68/333151868.db2.gz	RSBAPTVUNUMDDU-QLFBSQMISA-N	0	0	251.414	4.016	20	30		CIEDRN
Cc1oc2ccccc2c1C(=O)Nc1ccc(F)cc1C#N	ZINC000185988836	333153037	/nfs/dbraw/zinc/15/30/37/333153037.db2.gz	MFGFXEBOFVQAOE-UHFFFAOYSA-N	0	0	294.285	4.004	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)c1ccc(F)c(Cl)c1	ZINC000186010622	333153303	/nfs/dbraw/zinc/15/33/03/333153303.db2.gz	PPEMQSIPAHCFSL-JTQLQIEISA-N	0	0	269.747	4.044	20	30		CIEDRN
C=C(C)[C@@H](NC(=O)c1cccs1)c1ccc(F)c(F)c1	ZINC000186034558	333153801	/nfs/dbraw/zinc/15/38/01/333153801.db2.gz	IBSUIPNUWGYOAM-CQSZACIVSA-N	0	0	293.338	4.074	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(C2CCCCC2)nn1C	ZINC000186046540	333153963	/nfs/dbraw/zinc/15/39/63/333153963.db2.gz	NWASGDVDYSLSSM-ZDUSSCGKSA-N	0	0	289.423	4.009	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(OC)c(OC(C)C)c1	ZINC000186060910	333154265	/nfs/dbraw/zinc/15/42/65/333154265.db2.gz	KKINIENPWKJHPZ-CYBMUJFWSA-N	0	0	291.391	4.023	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1ccccc1C(C)=O)c1ccccc1	ZINC000186057766	333154278	/nfs/dbraw/zinc/15/42/78/333154278.db2.gz	IUXWOHMLASUEHA-KRWDZBQOSA-N	0	0	293.366	4.188	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CCC)CCc1cccs1	ZINC000186072288	333154372	/nfs/dbraw/zinc/15/43/72/333154372.db2.gz	FRFUQWGATMAJHW-AWEZNQCLSA-N	0	0	279.449	4.132	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H]1C(C)(C)CC	ZINC000186083496	333154709	/nfs/dbraw/zinc/15/47/09/333154709.db2.gz	LKTYUVNRCKSNNT-KBPBESRZSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ncccc1-c1ccccc1	ZINC000186116357	333155302	/nfs/dbraw/zinc/15/53/02/333155302.db2.gz	XUUJSRLCMXIDAL-AWEZNQCLSA-N	0	0	280.371	4.289	20	30		CIEDRN
C=CC[C@@H](C(=O)N(C)Cc1ccc(F)cc1)c1ccccc1	ZINC000186156375	333155628	/nfs/dbraw/zinc/15/56/28/333155628.db2.gz	SJWIAGNUGZVOBD-GOSISDBHSA-N	0	0	297.373	4.144	20	30		CIEDRN
C=CC[C@H](C(=O)N(CC)Cc1cccs1)c1ccccc1	ZINC000186239093	333157053	/nfs/dbraw/zinc/15/70/53/333157053.db2.gz	HHUWXZHRUOSUBH-KRWDZBQOSA-N	0	0	299.439	4.457	20	30		CIEDRN
C[C@@H](CCC1CC1)Nc1cccc(OCCCC#N)c1	ZINC000186454579	333161320	/nfs/dbraw/zinc/16/13/20/333161320.db2.gz	CULACODMPNVIER-AWEZNQCLSA-N	0	0	272.392	4.360	20	30		CIEDRN
CCCN(Cc1ccc(C#N)cc1)C(=O)C[C@H]1C=CCCC1	ZINC000186524017	333162576	/nfs/dbraw/zinc/16/25/76/333162576.db2.gz	OZNZEUODKLJRAC-INIZCTEOSA-N	0	0	296.414	4.043	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1ccc(F)cc1OC)c1ccccc1	ZINC000186582073	333163239	/nfs/dbraw/zinc/16/32/39/333163239.db2.gz	FGNFFDNMDQJWHQ-HNNXBMFYSA-N	0	0	299.345	4.133	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@H](C)Cc1cccs1)c1ccccc1	ZINC000186628982	333163728	/nfs/dbraw/zinc/16/37/28/333163728.db2.gz	HFZVUQKTINJNEI-PBHICJAKSA-N	0	0	299.439	4.155	20	30		CIEDRN
C=CCCC(=O)Nc1cccnc1-c1ccc(Cl)s1	ZINC000187114252	333167930	/nfs/dbraw/zinc/16/79/30/333167930.db2.gz	NDFOCBAPUWICNB-UHFFFAOYSA-N	0	0	292.791	4.368	20	30		CIEDRN
CC(C)(C#N)CCCOc1cccc(OC(F)(F)F)c1	ZINC000187169823	333168453	/nfs/dbraw/zinc/16/84/53/333168453.db2.gz	QKYCUOBOSZIWOP-UHFFFAOYSA-N	0	0	287.281	4.294	20	30		CIEDRN
C=C(C)[C@H](NCc1ccc(C)o1)c1ccc(F)c(F)c1	ZINC000187373968	333170054	/nfs/dbraw/zinc/17/00/54/333170054.db2.gz	XLFZMQPNUCNDAD-INIZCTEOSA-N	0	0	277.314	4.273	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NC1(Cc2cccc(F)c2)CCC1	ZINC000187533273	333172081	/nfs/dbraw/zinc/17/20/81/333172081.db2.gz	HOSDTXUIUFMSQG-CQSZACIVSA-N	0	0	289.394	4.009	20	30		CIEDRN
CCC1(CC)CCCN(C(=O)c2cc(C#N)cs2)CC1	ZINC000188869766	333175134	/nfs/dbraw/zinc/17/51/34/333175134.db2.gz	QJGULXTUXXFUDQ-UHFFFAOYSA-N	0	0	290.432	4.052	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1cccc(C)c1F)c1ccccc1	ZINC000188976055	333176933	/nfs/dbraw/zinc/17/69/33/333176933.db2.gz	GQLGDMBYHAGDJV-OAHLLOKOSA-N	0	0	283.346	4.433	20	30		CIEDRN
Cc1cccc(CN(CC(C)C)C(=O)C2(C#N)CCCC2)c1	ZINC000521555739	333178587	/nfs/dbraw/zinc/17/85/87/333178587.db2.gz	OBBSCBYHYDXDFC-UHFFFAOYSA-N	0	0	298.430	4.064	20	30		CIEDRN
C=CCC[C@H](C(=O)N(C)Cc1ccoc1C)c1ccccc1	ZINC000189043265	333178976	/nfs/dbraw/zinc/17/89/76/333178976.db2.gz	BULZJJITXAAURM-SFHVURJKSA-N	0	0	297.398	4.296	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2ccccc2CC)no1	ZINC000572523082	333184800	/nfs/dbraw/zinc/18/48/00/333184800.db2.gz	WKSXTTPBTBBULW-LBPRGKRZSA-N	0	0	256.349	4.369	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2ccccc2CC)no1	ZINC000572523081	333184863	/nfs/dbraw/zinc/18/48/63/333184863.db2.gz	WKSXTTPBTBBULW-GFCCVEGCSA-N	0	0	256.349	4.369	20	30		CIEDRN
C=C1CCN([C@H](C)c2ccc(F)c(Cl)c2)CC1	ZINC000521742382	333186484	/nfs/dbraw/zinc/18/64/84/333186484.db2.gz	SRVHAGYYGQFAIW-LLVKDONJSA-N	0	0	253.748	4.192	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1cccc(C(C)=O)c1)c1ccccc1	ZINC000189444948	333192885	/nfs/dbraw/zinc/19/28/85/333192885.db2.gz	WZLUAYJEJBTEES-SFHVURJKSA-N	0	0	293.366	4.188	20	30		CIEDRN
C[C@@H](CC#N)Sc1ccccc1NCC[C@H]1CCCO1	ZINC000189646523	333197252	/nfs/dbraw/zinc/19/72/52/333197252.db2.gz	DNENFSUNLXONJW-UONOGXRCSA-N	0	0	290.432	4.062	20	30		CIEDRN
CCCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)CC#N	ZINC000189957731	333201304	/nfs/dbraw/zinc/20/13/04/333201304.db2.gz	WTRVAYSNOLVGCY-ZDUSSCGKSA-N	0	0	287.407	4.186	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H](C)c1cc(C)sc1C	ZINC000190325845	333205393	/nfs/dbraw/zinc/20/53/93/333205393.db2.gz	CDHZIYZPQDOVND-IAQYHMDHSA-N	0	0	265.422	4.144	20	30		CIEDRN
C[C@H](Nc1ccc2scnc2c1)c1cccc(C#N)c1	ZINC000190699414	333209930	/nfs/dbraw/zinc/20/99/30/333209930.db2.gz	KPDIMZWPOZXYCY-NSHDSACASA-N	0	0	279.368	4.341	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](C(F)(F)F)C(C)(C)C1	ZINC000190735911	333210314	/nfs/dbraw/zinc/21/03/14/333210314.db2.gz	VBXVBSYFWUSZPM-NWDGAFQWSA-N	0	0	291.357	4.026	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cccc(-c2nc(C)c(C)o2)c1	ZINC000190822723	333211105	/nfs/dbraw/zinc/21/11/05/333211105.db2.gz	CRSXOBKQAVLBCQ-SFHVURJKSA-N	0	0	298.386	4.499	20	30		CIEDRN
CC(C)c1ccccc1NCc1cccc(C#N)c1F	ZINC000223728471	333211587	/nfs/dbraw/zinc/21/15/87/333211587.db2.gz	RHLWIJQXLZMKKZ-UHFFFAOYSA-N	0	0	268.335	4.433	20	30		CIEDRN
N#Cc1ccc(CSc2nc3ccccc3o2)cc1F	ZINC000191475801	333220434	/nfs/dbraw/zinc/22/04/34/333220434.db2.gz	ABTVPHYUFKYEOO-UHFFFAOYSA-N	0	0	284.315	4.131	20	30		CIEDRN
C=CCCCN(C)C(=O)c1cc2ccccc2n1CCC	ZINC000191722045	333224246	/nfs/dbraw/zinc/22/42/46/333224246.db2.gz	JSJZWVAYGIWBFK-UHFFFAOYSA-N	0	0	284.403	4.090	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cccc(Cl)c1F	ZINC000191804838	333225585	/nfs/dbraw/zinc/22/55/85/333225585.db2.gz	DPMZWURIBVPDHW-ZDUSSCGKSA-N	0	0	255.720	4.020	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cc(OCC)ccc1OCC	ZINC000191807204	333225635	/nfs/dbraw/zinc/22/56/35/333225635.db2.gz	ULJYTEISPVZPRL-KRWDZBQOSA-N	0	0	291.391	4.025	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(C)cc1Br	ZINC000191796720	333225714	/nfs/dbraw/zinc/22/57/14/333225714.db2.gz	AGVKWICUKKAINX-CQSZACIVSA-N	0	0	296.208	4.298	20	30		CIEDRN
N#CCN(C(=O)c1ccc(C2CCC2)cc1)c1ccccc1	ZINC000191888205	333226966	/nfs/dbraw/zinc/22/69/66/333226966.db2.gz	NHIXOAGMNAEBED-UHFFFAOYSA-N	0	0	290.366	4.124	20	30		CIEDRN
CC(C)[C@H](CC1CCCC1)C(=O)NCC(C)(C)CCC#N	ZINC000522027440	333230615	/nfs/dbraw/zinc/23/06/15/333230615.db2.gz	WABALLAIJACNCS-INIZCTEOSA-N	0	0	292.467	4.285	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(F)ccc1OCC1CC1	ZINC000192180583	333231973	/nfs/dbraw/zinc/23/19/73/333231973.db2.gz	YKJOGFGFPPHPPF-LBPRGKRZSA-N	0	0	291.366	4.155	20	30		CIEDRN
Cc1cc(OCCCC(C)(C)C#N)c2ccccc2n1	ZINC000192191907	333232110	/nfs/dbraw/zinc/23/21/10/333232110.db2.gz	PWLCLSSZNWLYLE-UHFFFAOYSA-N	0	0	268.360	4.252	20	30		CIEDRN
N#Cc1cccc(Cl)c1NCc1ccc2ncccc2c1	ZINC000193004726	333241366	/nfs/dbraw/zinc/24/13/66/333241366.db2.gz	ALUQXBGVKOFTTL-UHFFFAOYSA-N	0	0	293.757	4.372	20	30		CIEDRN
N#Cc1ccccc1CSCc1cc(-c2ccco2)on1	ZINC000193081180	333242209	/nfs/dbraw/zinc/24/22/09/333242209.db2.gz	AVSKDWOKQCQRST-UHFFFAOYSA-N	0	0	296.351	4.240	20	30		CIEDRN
CCCC[C@H](CC)CNc1c(C#N)nnc2ccccc21	ZINC000226141276	333251516	/nfs/dbraw/zinc/25/15/16/333251516.db2.gz	GCGUKBHLPJSENF-ZDUSSCGKSA-N	0	0	282.391	4.130	20	30		CIEDRN
C=CCOc1cccc(NC(=O)N2CCCC[C@H]2CC)c1	ZINC000193709094	333255947	/nfs/dbraw/zinc/25/59/47/333255947.db2.gz	HRTXCHBGAIUWAX-OAHLLOKOSA-N	0	0	288.391	4.048	20	30		CIEDRN
C=CCNC(=O)N(CCC)[C@@H](C)c1cc2ccccc2o1	ZINC000193798647	333257835	/nfs/dbraw/zinc/25/78/35/333257835.db2.gz	VUCKLEWSQLNWEN-ZDUSSCGKSA-N	0	0	286.375	4.101	20	30		CIEDRN
CC(C)COc1ccccc1NCc1ccccc1C#N	ZINC000226365809	333258202	/nfs/dbraw/zinc/25/82/02/333258202.db2.gz	GVELCTAWPFUEQL-UHFFFAOYSA-N	0	0	280.371	4.205	20	30		CIEDRN
C=CCN(C(=O)c1cccc2c1CCC2)c1ccccc1	ZINC000195647381	333259256	/nfs/dbraw/zinc/25/92/56/333259256.db2.gz	XODZBWZFDVXQDS-UHFFFAOYSA-N	0	0	277.367	4.008	20	30		CIEDRN
C[C@@H]1CCCC[C@H]1OCCNc1ccc(C#N)c(Cl)c1	ZINC000195708349	333261288	/nfs/dbraw/zinc/26/12/88/333261288.db2.gz	UQPAJKIQIHJVJV-MLGOLLRUSA-N	0	0	292.810	4.219	20	30		CIEDRN
C=CCN(C(=O)c1ccc2ncsc2c1)c1ccccc1	ZINC000194028667	333264032	/nfs/dbraw/zinc/26/40/32/333264032.db2.gz	QXVIFKAGELVYRV-UHFFFAOYSA-N	0	0	294.379	4.129	20	30		CIEDRN
CC(=O)c1ccc(O[C@@H](C)c2cccc(C#N)c2)c(F)c1	ZINC000194643801	333274493	/nfs/dbraw/zinc/27/44/93/333274493.db2.gz	MPHNSIHBWQLOEF-LBPRGKRZSA-N	0	0	283.302	4.040	20	30		CIEDRN
CS[C@@H]1CCC[C@H](Nc2ccc(Cl)cc2C#N)C1	ZINC000227358041	333281817	/nfs/dbraw/zinc/28/18/17/333281817.db2.gz	UGQABLPTUVILGM-QWHCGFSZSA-N	0	0	280.824	4.298	20	30		CIEDRN
CCC(CC)CN(CCC#N)C(=O)CC1CCC(C)CC1	ZINC000522392605	333286034	/nfs/dbraw/zinc/28/60/34/333286034.db2.gz	QQLBJXAEDOISKK-UHFFFAOYSA-N	0	0	292.467	4.381	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N(Cc1cccc(C)c1)CC(C)C	ZINC000522632655	333293641	/nfs/dbraw/zinc/29/36/41/333293641.db2.gz	JVMVCFXZJATEHK-INIZCTEOSA-N	0	0	288.435	4.127	20	30		CIEDRN
C=CC[C@H](C)NC(=O)c1sccc1-c1ccc(C)cc1	ZINC000522643378	333294246	/nfs/dbraw/zinc/29/42/46/333294246.db2.gz	UJMDABPXTWLBPI-ZDUSSCGKSA-N	0	0	285.412	4.418	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1cccc(OC2CCCC2)c1	ZINC000522660543	333295126	/nfs/dbraw/zinc/29/51/26/333295126.db2.gz	AEICOPPLLOWKKZ-ZDUSSCGKSA-N	0	0	288.391	4.094	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1ccc(C)c(C(F)(F)F)c1	ZINC000522660460	333295159	/nfs/dbraw/zinc/29/51/59/333295159.db2.gz	WZJIUMKVEWSEFV-SNVBAGLBSA-N	0	0	286.297	4.100	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@@H](CC(C)C)c1ccccc1C	ZINC000522665174	333295651	/nfs/dbraw/zinc/29/56/51/333295651.db2.gz	SEYHTOWTNYFTMF-RDJZCZTQSA-N	0	0	288.435	4.346	20	30		CIEDRN
N#CC1(C(=O)Nc2ccc3oc4ccccc4c3c2)CCC1	ZINC000522882579	333298285	/nfs/dbraw/zinc/29/82/85/333298285.db2.gz	GSZJPBZNNYMMRN-UHFFFAOYSA-N	0	0	290.322	4.218	20	30		CIEDRN
Cc1cccc(Cl)c1OCc1ccc(C#N)cc1	ZINC000522885530	333298504	/nfs/dbraw/zinc/29/85/04/333298504.db2.gz	CVUILFQJLRZPQO-UHFFFAOYSA-N	0	0	257.720	4.099	20	30		CIEDRN
C=CCCCN(C)C(=O)c1ccccc1Nc1ccccc1	ZINC000522953508	333301007	/nfs/dbraw/zinc/30/10/07/333301007.db2.gz	DJOLHTGVOAIEPF-UHFFFAOYSA-N	0	0	294.398	4.468	20	30		CIEDRN
CCCc1sc(C(=O)N(CCC#N)C(C)C)cc1CC	ZINC000522962302	333301427	/nfs/dbraw/zinc/30/14/27/333301427.db2.gz	SFYMYPPSEOKGEM-UHFFFAOYSA-N	0	0	292.448	4.027	20	30		CIEDRN
Cc1ccccc1[C@H]1C[C@H](C)N(c2ccc(C#N)cc2)C1	ZINC000523086077	333307324	/nfs/dbraw/zinc/30/73/24/333307324.db2.gz	HQZFZZSJNGNGJR-RDJZCZTQSA-N	0	0	276.383	4.249	20	30		CIEDRN
Cc1ccccc1[C@H]1C[C@@H](C)N(c2ccc(C#N)cc2)C1	ZINC000523086078	333307342	/nfs/dbraw/zinc/30/73/42/333307342.db2.gz	HQZFZZSJNGNGJR-WBVHZDCISA-N	0	0	276.383	4.249	20	30		CIEDRN
CC(C)(CCC#N)CNc1ccc(C(F)(F)F)cc1C#N	ZINC000229702359	333307929	/nfs/dbraw/zinc/30/79/29/333307929.db2.gz	FMKQJKRIJRUBIR-UHFFFAOYSA-N	0	0	295.308	4.319	20	30		CIEDRN
Cc1ccc(C[C@@H](C)Nc2ncc(C#N)cc2Cl)s1	ZINC000523101818	333308703	/nfs/dbraw/zinc/30/87/03/333308703.db2.gz	BNFVGUWYNSQUHO-SECBINFHSA-N	0	0	291.807	4.020	20	30		CIEDRN
N#Cc1cc(CSc2ccc(F)cc2F)ccc1F	ZINC000229753804	333309349	/nfs/dbraw/zinc/30/93/49/333309349.db2.gz	WOZGGIGGUPOXBI-UHFFFAOYSA-N	0	0	279.286	4.268	20	30		CIEDRN
CC[C@@H](Sc1cc(C#N)ccn1)c1ccc(F)cc1F	ZINC000523109593	333309395	/nfs/dbraw/zinc/30/93/95/333309395.db2.gz	QHTQZWMBPKQCCD-CQSZACIVSA-N	0	0	290.338	4.475	20	30		CIEDRN
Cc1ccc2[nH]c(SCc3ccc(F)c(C#N)c3)nc2c1	ZINC000229753445	333309457	/nfs/dbraw/zinc/30/94/57/333309457.db2.gz	GQSLJZVVMWJOCK-UHFFFAOYSA-N	0	0	297.358	4.174	20	30		CIEDRN
Cc1ccc(C#N)cc1OCc1nc(C(C)(C)C)cs1	ZINC000229947522	333311873	/nfs/dbraw/zinc/31/18/73/333311873.db2.gz	OQZQVOXCASRETG-UHFFFAOYSA-N	0	0	286.400	4.200	20	30		CIEDRN
N#Cc1ccc(F)cc1CSc1ccc(F)cc1F	ZINC000229949702	333312032	/nfs/dbraw/zinc/31/20/32/333312032.db2.gz	PBBMIUHSDVIYKT-UHFFFAOYSA-N	0	0	279.286	4.268	20	30		CIEDRN
N#Cc1ccc(F)cc1CSc1cc(F)ccc1F	ZINC000229949720	333312067	/nfs/dbraw/zinc/31/20/67/333312067.db2.gz	NCURQJJLYSMARZ-UHFFFAOYSA-N	0	0	279.286	4.268	20	30		CIEDRN
C=CCCC(=O)Nc1ccc2nc(C(C)C)sc2c1	ZINC000523273874	333313635	/nfs/dbraw/zinc/31/36/35/333313635.db2.gz	DVCPQLHCLHAJSD-UHFFFAOYSA-N	0	0	274.389	4.324	20	30		CIEDRN
N#Cc1cc(COc2ccc(Cl)c(F)c2)ccc1F	ZINC000230355767	333316766	/nfs/dbraw/zinc/31/67/66/333316766.db2.gz	UOVAVVNPNBOQQY-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
N#Cc1ccc(Nc2nc(-c3ccc(O)cc3)cs2)cc1	ZINC000523321422	333319189	/nfs/dbraw/zinc/31/91/89/333319189.db2.gz	MTWBXADHKXCHLA-UHFFFAOYSA-N	0	0	293.351	4.131	20	30		CIEDRN
CC(C)C1CCN(c2ccc(C#N)c(Cl)c2)CC1	ZINC000230914546	333322498	/nfs/dbraw/zinc/32/24/98/333322498.db2.gz	PJFPNYQLQXTEKW-UHFFFAOYSA-N	0	0	262.784	4.084	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)Nc1cc(Cl)c(F)c(Cl)c1	ZINC000232039476	333333223	/nfs/dbraw/zinc/33/32/23/333333223.db2.gz	YVVRTHHXSRNASF-GFCCVEGCSA-N	0	0	289.137	4.011	20	30		CIEDRN
C=CCCS[C@H](C)C(=O)N[C@H](C)c1ccc(CC)cc1	ZINC000523522771	333332145	/nfs/dbraw/zinc/33/21/45/333332145.db2.gz	ANRWVXPLVWLSLA-ZIAGYGMSSA-N	0	0	291.460	4.124	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(C)c(OCCC(C)C)c1	ZINC000523534879	333332308	/nfs/dbraw/zinc/33/23/08/333332308.db2.gz	SZJBFSQJMLYKKP-UHFFFAOYSA-N	0	0	275.392	4.325	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)C1CCCCCC1	ZINC000523540431	333332524	/nfs/dbraw/zinc/33/25/24/333332524.db2.gz	VGWFWPRAAPHXMB-UHFFFAOYSA-N	0	0	289.394	4.311	20	30		CIEDRN
C=CCNC(=O)[C@@H](C)Sc1cc(C(C)(C)C)ccc1C	ZINC000302765920	333335184	/nfs/dbraw/zinc/33/51/84/333335184.db2.gz	HFFPPQDPLZSLCT-CYBMUJFWSA-N	0	0	291.460	4.075	20	30		CIEDRN
CC(C)(C#N)CCCCOc1ccc(F)cc1F	ZINC000232520855	333337919	/nfs/dbraw/zinc/33/79/19/333337919.db2.gz	NGKDEGGULPTBOQ-UHFFFAOYSA-N	0	0	253.292	4.064	20	30		CIEDRN
CC(C)(C#N)CCCCOc1ccccc1Cl	ZINC000232522049	333337978	/nfs/dbraw/zinc/33/79/78/333337978.db2.gz	HTMCHYJELRMYLR-UHFFFAOYSA-N	0	0	251.757	4.439	20	30		CIEDRN
CC(C)(C#N)CCCCSc1nc2ccccc2[nH]1	ZINC000232525789	333337995	/nfs/dbraw/zinc/33/79/95/333337995.db2.gz	PKLCJZJKTBLUGC-UHFFFAOYSA-N	0	0	273.405	4.375	20	30		CIEDRN
N#Cc1cc(Cl)ccc1N[C@@H]1CCc2cc(F)ccc21	ZINC000303164631	333338417	/nfs/dbraw/zinc/33/84/17/333338417.db2.gz	FUGIJEZJPKWCLP-MRXNPFEDSA-N	0	0	286.737	4.450	20	30		CIEDRN
C=CCn1c(SC2CCCC2)nnc1-c1cccc(C)c1	ZINC000303179161	333338650	/nfs/dbraw/zinc/33/86/50/333338650.db2.gz	XZKKTSBYRGEMEV-UHFFFAOYSA-N	0	0	299.443	4.474	20	30		CIEDRN
N#Cc1ccc(S[C@H](C#N)C2CCCCC2)cc1	ZINC000523712842	333341186	/nfs/dbraw/zinc/34/11/86/333341186.db2.gz	JAITVVTTXXCJMS-OAHLLOKOSA-N	0	0	256.374	4.123	20	30		CIEDRN
CC(C)Oc1ccccc1N[C@@H](C#N)C1CCCCC1	ZINC000523740451	333342934	/nfs/dbraw/zinc/34/29/34/333342934.db2.gz	NMPWUUWKEDMPBD-INIZCTEOSA-N	0	0	272.392	4.358	20	30		CIEDRN
COc1ccc(Cl)cc1N[C@@H](C#N)C1CCCCC1	ZINC000523738522	333343003	/nfs/dbraw/zinc/34/30/03/333343003.db2.gz	ZGIDDXCGXROTAW-AWEZNQCLSA-N	0	0	278.783	4.233	20	30		CIEDRN
C=CCSc1nccn1-c1ccc(C(F)(F)F)cc1	ZINC000303502189	333343114	/nfs/dbraw/zinc/34/31/14/333343114.db2.gz	RQHKFXACUVIZDP-UHFFFAOYSA-N	0	0	284.306	4.169	20	30		CIEDRN
Cc1cccc([C@H](C)Nc2cccc(F)c2C#N)c1C	ZINC000523752566	333343958	/nfs/dbraw/zinc/34/39/58/333343958.db2.gz	FQFXLOVAUIJCTM-ZDUSSCGKSA-N	0	0	268.335	4.487	20	30		CIEDRN
CC1(C)CCC(c2noc(-c3ccc(C#N)cc3)n2)CC1	ZINC000232837610	333344089	/nfs/dbraw/zinc/34/40/89/333344089.db2.gz	JAMYILQBIBTATE-UHFFFAOYSA-N	0	0	281.359	4.292	20	30		CIEDRN
CC(C)[C@@H](CC1CCCC1)C(=O)NCC#Cc1ccccc1	ZINC000523840102	333347656	/nfs/dbraw/zinc/34/76/56/333347656.db2.gz	TZHFZCOMIGIWCS-LJQANCHMSA-N	0	0	297.442	4.007	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)CSc1ccc2ccccc2c1	ZINC000523950336	333349873	/nfs/dbraw/zinc/34/98/73/333349873.db2.gz	YBUDRBQVHXWUIX-CYBMUJFWSA-N	0	0	285.412	4.013	20	30		CIEDRN
C=CC[C@H](C)NC(=O)c1ccc(-c2ccc(F)cc2)s1	ZINC000523968425	333350267	/nfs/dbraw/zinc/35/02/67/333350267.db2.gz	SMVJPTOHHADSGT-NSHDSACASA-N	0	0	289.375	4.249	20	30		CIEDRN
C=CC[C@H](C)NC(=O)C(C)(C)CCCc1ccccc1	ZINC000523966352	333350306	/nfs/dbraw/zinc/35/03/06/333350306.db2.gz	POUGDDFZYDGURD-HNNXBMFYSA-N	0	0	273.420	4.116	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@H](c1ccccc1)C(C)(C)C	ZINC000523986501	333350650	/nfs/dbraw/zinc/35/06/50/333350650.db2.gz	FHCPDRXFUIZCBZ-UKRRQHHQSA-N	0	0	274.408	4.038	20	30		CIEDRN
C=CCCCCCN(C)C(=O)NCc1cccc(Cl)c1	ZINC000524148615	333354409	/nfs/dbraw/zinc/35/44/09/333354409.db2.gz	BLDNHCBOCPJIFO-UHFFFAOYSA-N	0	0	294.826	4.228	20	30		CIEDRN
CC[C@@H](Nc1nccc(C#N)c1Cl)c1cccs1	ZINC000233905968	333356079	/nfs/dbraw/zinc/35/60/79/333356079.db2.gz	VCXDKFLJTMUBCI-SNVBAGLBSA-N	0	0	277.780	4.231	20	30		CIEDRN
C=CCCCN(C)C(=O)c1ccc(F)c2ccccc12	ZINC000234261338	333359375	/nfs/dbraw/zinc/35/93/75/333359375.db2.gz	PLWIPNUBHDNSAM-UHFFFAOYSA-N	0	0	271.335	4.017	20	30		CIEDRN
CC(C)CC[C@H]1CCC[C@H]1NC(=O)c1cccc(CC#N)c1	ZINC000524329506	333360145	/nfs/dbraw/zinc/36/01/45/333360145.db2.gz	MHAGUVGEJUGVTG-SJLPKXTDSA-N	0	0	298.430	4.087	20	30		CIEDRN
COc1cc(CNc2cccc(C(C)C)c2)ccc1C#N	ZINC000234906706	333362957	/nfs/dbraw/zinc/36/29/57/333362957.db2.gz	NAOONBXQMXRSKF-UHFFFAOYSA-N	0	0	280.371	4.302	20	30		CIEDRN
COc1cc(CNc2cc(Cl)ccc2C)ccc1C#N	ZINC000234899462	333362987	/nfs/dbraw/zinc/36/29/87/333362987.db2.gz	AJCAPZNOLUKKAM-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
C=CCN(CC=C)C(=O)N[C@H](CCC)C1CCCCC1	ZINC000524530698	333365027	/nfs/dbraw/zinc/36/50/27/333365027.db2.gz	AEMACEHPKVBRNU-MRXNPFEDSA-N	0	0	278.440	4.119	20	30		CIEDRN
Cc1ccccc1CSc1nccc(C#N)c1Cl	ZINC000235788403	333372184	/nfs/dbraw/zinc/37/21/84/333372184.db2.gz	AXESKJDONRJCFS-UHFFFAOYSA-N	0	0	274.776	4.207	20	30		CIEDRN
N#Cc1ccc(-c2nc(-c3coc4ccccc43)no2)s1	ZINC000236170929	333373125	/nfs/dbraw/zinc/37/31/25/333373125.db2.gz	OPFWFGZSQBGULL-UHFFFAOYSA-N	0	0	293.307	4.083	20	30		CIEDRN
C=CCOc1ccccc1CNc1ccc2ncccc2c1	ZINC000236678594	333374657	/nfs/dbraw/zinc/37/46/57/333374657.db2.gz	CGFYIHYWHOZOLG-UHFFFAOYSA-N	0	0	290.366	4.412	20	30		CIEDRN
C[C@@H](NCc1cccc(C#N)c1)c1nc(C(C)(C)C)cs1	ZINC000237516885	333380005	/nfs/dbraw/zinc/38/00/05/333380005.db2.gz	FTYNQALRVQLCSR-GFCCVEGCSA-N	0	0	299.443	4.163	20	30		CIEDRN
C=CCN(C(=O)Nc1cccc(C(F)(F)F)c1C)C1CC1	ZINC000537906608	333382476	/nfs/dbraw/zinc/38/24/76/333382476.db2.gz	BBQVZIXZBJZMSH-UHFFFAOYSA-N	0	0	298.308	4.196	20	30		CIEDRN
CC(C)c1ccc(C(=O)COc2ccc(C#N)c(F)c2)cc1	ZINC000316236223	333386208	/nfs/dbraw/zinc/38/62/08/333386208.db2.gz	CLCKZMMFKGACJU-UHFFFAOYSA-N	0	0	297.329	4.082	20	30		CIEDRN
C=CCCNc1ccccc1C(=O)Nc1ccc(F)cc1	ZINC000524841802	333389968	/nfs/dbraw/zinc/38/99/68/333389968.db2.gz	ISTZZIUVLWMGMG-UHFFFAOYSA-N	0	0	284.334	4.066	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@H]1CCC[C@@H](C)C1	ZINC000524983870	333394714	/nfs/dbraw/zinc/39/47/14/333394714.db2.gz	FMCMOKYZBMZVMF-CABCVRRESA-N	0	0	251.414	4.018	20	30		CIEDRN
C[C@H]1CCCC[C@H]1OCCSc1ccc(C#N)cc1F	ZINC000525115864	333398686	/nfs/dbraw/zinc/39/86/86/333398686.db2.gz	DKKFCFWENLOKDS-SWLSCSKDSA-N	0	0	293.407	4.385	20	30		CIEDRN
C=CCCNc1ccccc1COCc1ccccc1	ZINC000525365359	333410474	/nfs/dbraw/zinc/41/04/74/333410474.db2.gz	DKXKUAILBFUFPU-UHFFFAOYSA-N	0	0	267.372	4.391	20	30		CIEDRN
C=CCCCCCN(C)C(=O)N[C@H]1CCC[C@@H](CC)C1	ZINC000525404851	333411456	/nfs/dbraw/zinc/41/14/56/333411456.db2.gz	KZMOSWZVRLCWNM-CVEARBPZSA-N	0	0	280.456	4.343	20	30		CIEDRN
C=CCCCCCN(C)C(=O)N[C@@H]1CCC[C@@H](CC)C1	ZINC000525404853	333411533	/nfs/dbraw/zinc/41/15/33/333411533.db2.gz	KZMOSWZVRLCWNM-HZPDHXFCSA-N	0	0	280.456	4.343	20	30		CIEDRN
C=CCCCCCN(C)C(=O)NCc1ccccc1CC	ZINC000525405460	333411540	/nfs/dbraw/zinc/41/15/40/333411540.db2.gz	GNPPDYLGQBLVDY-UHFFFAOYSA-N	0	0	288.435	4.137	20	30		CIEDRN
CC(C)C[C@@H]1CCCCCN1C(=O)Nc1cccc(C#N)c1	ZINC000525403614	333411557	/nfs/dbraw/zinc/41/15/57/333411557.db2.gz	OAAUQJJEFNRAGK-KRWDZBQOSA-N	0	0	299.418	4.381	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1ccc(F)c2ccccc12	ZINC000393840267	333415009	/nfs/dbraw/zinc/41/50/09/333415009.db2.gz	RIRGNCMLXXXZCH-GFCCVEGCSA-N	0	0	271.335	4.063	20	30		CIEDRN
C=CCN(C(=O)N[C@H]1CCC(C)(C)c2ccccc21)C1CC1	ZINC000537912553	333429783	/nfs/dbraw/zinc/42/97/83/333429783.db2.gz	UOUHWFFCESCHJD-KRWDZBQOSA-N	0	0	298.430	4.159	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1cc2cscc2s1	ZINC000529197515	333476620	/nfs/dbraw/zinc/47/66/20/333476620.db2.gz	DVVNCPKVXOKYEY-LLVKDONJSA-N	0	0	277.414	4.144	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)[C@@H]1[C@H](C)[C@H]1C1CC1	ZINC000529270057	333480638	/nfs/dbraw/zinc/48/06/38/333480638.db2.gz	DNKQNRYXFMTKBH-OAUYIBNBSA-N	0	0	269.388	4.036	20	30		CIEDRN
CN(C(=O)c1csc2ccccc12)c1ccc(C#N)cc1	ZINC000061954648	333483807	/nfs/dbraw/zinc/48/38/07/333483807.db2.gz	MGEMIBZFMUMFRM-UHFFFAOYSA-N	0	0	292.363	4.050	20	30		CIEDRN
COc1c(C)ccc(N[C@H](C)c2ccc(C#N)cc2)c1C	ZINC000037125846	333490341	/nfs/dbraw/zinc/49/03/41/333490341.db2.gz	QKMIMUFMQHUHNX-CQSZACIVSA-N	0	0	280.371	4.357	20	30		CIEDRN
C[C@@H](Nc1cccc(OCCCC#N)c1)C1CC(F)(F)C1	ZINC000529534629	333494459	/nfs/dbraw/zinc/49/44/59/333494459.db2.gz	RILRQUFFQFLLBL-GFCCVEGCSA-N	0	0	294.345	4.215	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cc(OC)c(O)c2ccccc12	ZINC000529549511	333496718	/nfs/dbraw/zinc/49/67/18/333496718.db2.gz	YPJYMGCHTNLXOD-SFHVURJKSA-N	0	0	299.370	4.095	20	30		CIEDRN
COc1ccc(CC[C@H](C)Nc2cccc(C#N)c2)cc1	ZINC000037203133	333513167	/nfs/dbraw/zinc/51/31/67/333513167.db2.gz	LJLRHAZDPSZWQC-AWEZNQCLSA-N	0	0	280.371	4.000	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cccc(C2CCOCC2)c1	ZINC000529935806	333514907	/nfs/dbraw/zinc/51/49/07/333514907.db2.gz	NSOBAYXFCOFWAU-GOSISDBHSA-N	0	0	287.403	4.121	20	30		CIEDRN
CCC[C@H](CC1CCCC1)C(=O)NCC(C)(C)CCC#N	ZINC000576047861	335145734	/nfs/dbraw/zinc/14/57/34/335145734.db2.gz	SEPBNSNNMNJAOZ-MRXNPFEDSA-N	0	0	292.467	4.429	20	30		CIEDRN
CCC[C@@H](CC1CCCC1)C(=O)NCC(C)(C)CCC#N	ZINC000576047860	335145760	/nfs/dbraw/zinc/14/57/60/335145760.db2.gz	SEPBNSNNMNJAOZ-INIZCTEOSA-N	0	0	292.467	4.429	20	30		CIEDRN
N#Cc1ccc(NCCc2cccs2)cc1C(F)(F)F	ZINC000037306393	333531754	/nfs/dbraw/zinc/53/17/54/333531754.db2.gz	POKMDRXSHIDZAN-UHFFFAOYSA-N	0	0	296.317	4.293	20	30		CIEDRN
CCC(CC)CC(=O)N(CC)[C@@H](C)c1ccc(C#N)cc1	ZINC000123924247	333554527	/nfs/dbraw/zinc/55/45/27/333554527.db2.gz	DCRSTFJFXVFRTP-AWEZNQCLSA-N	0	0	286.419	4.294	20	30		CIEDRN
CCCOc1cccc(NCc2ccc(F)c(C#N)c2)c1	ZINC000123987687	333555304	/nfs/dbraw/zinc/55/53/04/333555304.db2.gz	FOUWRLPGYXSEAZ-UHFFFAOYSA-N	0	0	284.334	4.098	20	30		CIEDRN
C[C@H](CC(=O)N(C)Cc1cccc(C#N)c1)C1CCCCC1	ZINC000124051703	333555807	/nfs/dbraw/zinc/55/58/07/333555807.db2.gz	LSJBKWAQZDZNNN-OAHLLOKOSA-N	0	0	298.430	4.123	20	30		CIEDRN
CC(C)(C#N)CCCOc1ccc([N+](=O)[O-])c2ccccc12	ZINC000124610707	333560380	/nfs/dbraw/zinc/56/03/80/333560380.db2.gz	RDSJAUXAKJZQHK-UHFFFAOYSA-N	0	0	298.342	4.457	20	30		CIEDRN
COc1ccc(CNc2cccc3ccccc32)cc1C#N	ZINC000124916577	333562503	/nfs/dbraw/zinc/56/25/03/333562503.db2.gz	UZHHZXIMZIMDPS-UHFFFAOYSA-N	0	0	288.350	4.332	20	30		CIEDRN
C=C(CC)CS[C@H](C)C(=O)NCc1ccc(Cl)cc1	ZINC000537993313	333569907	/nfs/dbraw/zinc/56/99/07/333569907.db2.gz	RZMGHUUOPSWSDG-GFCCVEGCSA-N	0	0	297.851	4.044	20	30		CIEDRN
C=C(CC)CSCC(=O)Nc1ccc(Cl)cc1C	ZINC000537993379	333569928	/nfs/dbraw/zinc/56/99/28/333569928.db2.gz	LBJILYTYWUPMFQ-UHFFFAOYSA-N	0	0	283.824	4.286	20	30		CIEDRN
C=C(CC)CSc1nnc(C2CC2)n1-c1ccccc1	ZINC000538011361	333571114	/nfs/dbraw/zinc/57/11/14/333571114.db2.gz	MWHUMDCWPTYYOF-UHFFFAOYSA-N	0	0	285.416	4.203	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)c1sc(C2CCCCC2)nc1C	ZINC000538251572	333581651	/nfs/dbraw/zinc/58/16/51/333581651.db2.gz	BVLPOWIGUAVIPP-LLVKDONJSA-N	0	0	292.448	4.194	20	30		CIEDRN
C[C@@H](C#N)CN(C)c1ccc2ccc(Cl)c(Cl)c2n1	ZINC000538265339	333582230	/nfs/dbraw/zinc/58/22/30/333582230.db2.gz	PGUAOYUSWKKJQX-VIFPVBQESA-N	0	0	294.185	4.137	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)COc1ccccc1C(C)C	ZINC000538325848	333585272	/nfs/dbraw/zinc/58/52/72/333585272.db2.gz	GXNXFZQJBPVMMV-OAHLLOKOSA-N	0	0	289.419	4.050	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)CCSc1ccccc1	ZINC000538331954	333585513	/nfs/dbraw/zinc/58/55/13/333585513.db2.gz	SZBAVGFSTRYFQL-AWEZNQCLSA-N	0	0	277.433	4.030	20	30		CIEDRN
C=CCOc1ccc(CNc2ncccc2C)cc1Cl	ZINC000538326663	333585556	/nfs/dbraw/zinc/58/55/56/333585556.db2.gz	URYSWPHFIIOQBM-UHFFFAOYSA-N	0	0	288.778	4.220	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)NC(C)(C)c1cccs1	ZINC000538368079	333587248	/nfs/dbraw/zinc/58/72/48/333587248.db2.gz	WHTWKLKEEWTRCW-GFCCVEGCSA-N	0	0	280.437	4.027	20	30		CIEDRN
N#CC1(CSCCCOc2ccc(Cl)cc2)CC1	ZINC000538414169	333589800	/nfs/dbraw/zinc/58/98/00/333589800.db2.gz	BCOYYGZQDPDTSY-UHFFFAOYSA-N	0	0	281.808	4.146	20	30		CIEDRN
COc1ccc(C#N)cc1CNc1cc(SC)ccc1C	ZINC000538419036	333591586	/nfs/dbraw/zinc/59/15/86/333591586.db2.gz	YSRIBFNHSRMYHW-UHFFFAOYSA-N	0	0	298.411	4.209	20	30		CIEDRN
C=CCCC1(c2nc(-c3cnc4ccccc4c3)no2)CC1	ZINC000576071865	335149343	/nfs/dbraw/zinc/14/93/43/335149343.db2.gz	LJLYIODLHYOGNT-UHFFFAOYSA-N	0	0	291.354	4.283	20	30		CIEDRN
CC[C@@H](C#N)Sc1nc(C)nc2sc(C)c(C)c21	ZINC000127007175	333615337	/nfs/dbraw/zinc/61/53/37/333615337.db2.gz	XSZWCNJDWXAXQJ-JTQLQIEISA-N	0	0	277.418	4.011	20	30		CIEDRN
N#CCN(Cc1cccc(OC2CCCC2)c1)C1CCCC1	ZINC000538728460	333618218	/nfs/dbraw/zinc/61/82/18/333618218.db2.gz	XZHNFWATKADZEQ-UHFFFAOYSA-N	0	0	298.430	4.276	20	30		CIEDRN
CC[C@H](C#N)Sc1nc(-c2ccco2)nc2ccccc21	ZINC000127388521	333628008	/nfs/dbraw/zinc/62/80/08/333628008.db2.gz	SNDNSHBOFIROAX-LLVKDONJSA-N	0	0	295.367	4.284	20	30		CIEDRN
C=C(C)CSCc1nnc(-c2ccccc2)s1	ZINC000127624170	333633207	/nfs/dbraw/zinc/63/32/07/333633207.db2.gz	AIXHNUBFBPBZSN-UHFFFAOYSA-N	0	0	262.403	4.014	20	30		CIEDRN
C[C@@H](NCc1csc(C(C)(C)C)n1)c1ccc(C#N)cc1	ZINC000067186173	333634691	/nfs/dbraw/zinc/63/46/91/333634691.db2.gz	CEYXPVKFZVUENZ-GFCCVEGCSA-N	0	0	299.443	4.163	20	30		CIEDRN
CC[C@@H](C#N)Sc1nnc(-c2cccc3ccccc32)o1	ZINC000127754441	333635501	/nfs/dbraw/zinc/63/55/01/333635501.db2.gz	YUHCNVLUTMKISD-LBPRGKRZSA-N	0	0	295.367	4.284	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@@H]1CC(C)(C)C	ZINC000128128323	333642865	/nfs/dbraw/zinc/64/28/65/333642865.db2.gz	GYHDDMGBPXAKMJ-OAHLLOKOSA-N	0	0	263.425	4.182	20	30		CIEDRN
C=C(CC)CS[C@H](C)C(=O)Nc1ccccc1CC	ZINC000539094785	333657674	/nfs/dbraw/zinc/65/76/74/333657674.db2.gz	MJBIBURZCWQYEX-CYBMUJFWSA-N	0	0	277.433	4.275	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N1CCc2ccccc2[C@@H]1C	ZINC000539388142	333668450	/nfs/dbraw/zinc/66/84/50/333668450.db2.gz	PQZJFMPOKIGSSH-CABCVRRESA-N	0	0	286.419	4.060	20	30		CIEDRN
C=CCCOCCCCC(=O)N1CCC[C@@H]1CC(C)(C)C	ZINC000539395946	333669038	/nfs/dbraw/zinc/66/90/38/333669038.db2.gz	MKVUZVYOAFKSKK-MRXNPFEDSA-N	0	0	295.467	4.177	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1ccccc1SCC	ZINC000539429411	333671088	/nfs/dbraw/zinc/67/10/88/333671088.db2.gz	NUOFEYJGQRJIAC-ZDUSSCGKSA-N	0	0	277.433	4.273	20	30		CIEDRN
C=C(C)CN(CC)C(=O)C1(Cc2ccc(Cl)cc2)CC1	ZINC000539945620	333703903	/nfs/dbraw/zinc/70/39/03/333703903.db2.gz	XFHKQXROXMTJLQ-UHFFFAOYSA-N	0	0	291.822	4.087	20	30		CIEDRN
C=CCN(C(=O)Nc1cccc(Cl)c1Cl)C1CC1	ZINC000540065520	333708022	/nfs/dbraw/zinc/70/80/22/333708022.db2.gz	ULRSHBRWQZKLHI-UHFFFAOYSA-N	0	0	285.174	4.176	20	30		CIEDRN
C=C(CC)CSCC(=O)N[C@@H](c1ccccc1)C(C)C	ZINC000540193229	333720031	/nfs/dbraw/zinc/72/00/31/333720031.db2.gz	HIFJFCRUJXOJLV-QGZVFWFLSA-N	0	0	291.460	4.199	20	30		CIEDRN
C=C(CC)CS[C@H](C)C(=O)Nc1cccc(Cl)c1	ZINC000540193235	333720092	/nfs/dbraw/zinc/72/00/92/333720092.db2.gz	HWZXCOMPJYCOPH-LLVKDONJSA-N	0	0	283.824	4.366	20	30		CIEDRN
CC(C)(C(=O)Nc1ccc(C#N)c(Cl)c1)c1ccccc1	ZINC000068682793	333722086	/nfs/dbraw/zinc/72/20/86/333722086.db2.gz	MMSRYGJYZKPGCK-UHFFFAOYSA-N	0	0	298.773	4.128	20	30		CIEDRN
C[C@@H]1CCC[C@H](N(C)c2cc(C#N)c3ccccc3n2)C1	ZINC000068772476	333728755	/nfs/dbraw/zinc/72/87/55/333728755.db2.gz	AWHKKXRWXZWQEY-HIFRSBDPSA-N	0	0	279.387	4.121	20	30		CIEDRN
C[C@@H](Nc1cc(C#N)c2ccccc2n1)c1ccccc1	ZINC000068769785	333728780	/nfs/dbraw/zinc/72/87/80/333728780.db2.gz	HHUYPJZVNLUCFJ-CYBMUJFWSA-N	0	0	273.339	4.280	20	30		CIEDRN
C=CCCOCCCCC(=O)Nc1cc(C)ccc1C	ZINC000540465214	333730880	/nfs/dbraw/zinc/73/08/80/333730880.db2.gz	DQPHIAVCJVJMFA-UHFFFAOYSA-N	0	0	275.392	4.005	20	30		CIEDRN
CCCC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1	ZINC000068824525	333732937	/nfs/dbraw/zinc/73/29/37/333732937.db2.gz	RHCOAACYVJPRIB-UHFFFAOYSA-N	0	0	280.327	4.089	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@]1(C)CCc2ccccc2C1	ZINC000540526482	333734075	/nfs/dbraw/zinc/73/40/75/333734075.db2.gz	MUDGANONCYFHKU-HNAYVOBHSA-N	0	0	285.431	4.043	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)COc1ccc2ccccc2c1	ZINC000540533613	333734165	/nfs/dbraw/zinc/73/41/65/333734165.db2.gz	VOHWDSDPXQOOPJ-HNNXBMFYSA-N	0	0	297.398	4.080	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1cc(Cl)ccc1C	ZINC000540533677	333734214	/nfs/dbraw/zinc/73/42/14/333734214.db2.gz	YDMFGAMSAGCATD-LBPRGKRZSA-N	0	0	265.784	4.123	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1ccc2[nH]c(C)cc2c1	ZINC000540554517	333735114	/nfs/dbraw/zinc/73/51/14/333735114.db2.gz	COIDQTKACXPTGT-LBPRGKRZSA-N	0	0	285.391	4.343	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N1CC=C(C(C)(C)C)CC1	ZINC000540563655	333735370	/nfs/dbraw/zinc/73/53/70/333735370.db2.gz	JLRGEYLPGGELLG-AWEZNQCLSA-N	0	0	278.440	4.119	20	30		CIEDRN
N#CC1(CN[C@H](Cc2ccccc2)c2ccccc2F)CC1	ZINC000540590536	333735980	/nfs/dbraw/zinc/73/59/80/333735980.db2.gz	JTGUALLIFLJDRA-GOSISDBHSA-N	0	0	294.373	4.003	20	30		CIEDRN
C[C@H](SCC1(C#N)CC1)c1ccc(Cl)cc1	ZINC000540614637	333738414	/nfs/dbraw/zinc/73/84/14/333738414.db2.gz	RZBOVRPKXYSROK-JTQLQIEISA-N	0	0	251.782	4.438	20	30		CIEDRN
C=CCCOCCCCC(=O)Nc1cc(C)cc(C)c1	ZINC000540615021	333738456	/nfs/dbraw/zinc/73/84/56/333738456.db2.gz	FFQIPUZKWBVNJX-UHFFFAOYSA-N	0	0	275.392	4.005	20	30		CIEDRN
N#CC1(CSCCOc2ccc3ccccc3c2)CC1	ZINC000540618917	333738613	/nfs/dbraw/zinc/73/86/13/333738613.db2.gz	GQCCQAVIAVGQLR-UHFFFAOYSA-N	0	0	283.396	4.256	20	30		CIEDRN
CCN(C(=O)[C@@H]1CC[C@H](C)C1)c1ccc(C#N)c(Cl)c1	ZINC000540658323	333740667	/nfs/dbraw/zinc/74/06/67/333740667.db2.gz	RFBXKHCIKZBPSZ-NWDGAFQWSA-N	0	0	290.794	4.001	20	30		CIEDRN
C=CCC[C@@H](CCC)Nc1cccc(-c2nnc(C)n2C)c1	ZINC000540825600	333748924	/nfs/dbraw/zinc/74/89/24/333748924.db2.gz	WZJAMBAKCHIXCT-MRXNPFEDSA-N	0	0	298.434	4.337	20	30		CIEDRN
C/C=C/c1ccc(OCCC(C)(C)C#N)c(OC)c1	ZINC000540845142	333750166	/nfs/dbraw/zinc/75/01/66/333750166.db2.gz	JTPQKLIOVQPDSU-AATRIKPKSA-N	0	0	259.349	4.047	20	30		CIEDRN
CC(C)(C#N)NC(=O)c1ccc2c(c1)C(C)(C)CCC2(C)C	ZINC000540972009	333756127	/nfs/dbraw/zinc/75/61/27/333756127.db2.gz	VBRVMDOPMRBUDV-UHFFFAOYSA-N	0	0	298.430	4.068	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(Cc2c[nH]c3ccc(F)cc23)no1	ZINC000564245805	333780348	/nfs/dbraw/zinc/78/03/48/333780348.db2.gz	ZHFAHWVDPJVWEE-LLVKDONJSA-N	0	0	299.349	4.351	20	30		CIEDRN
COC1CCC(CCNc2ccc(C#N)c(Cl)c2)CC1	ZINC000541625513	333784788	/nfs/dbraw/zinc/78/47/88/333784788.db2.gz	ZTSWBGSXDXVSQX-UHFFFAOYSA-N	0	0	292.810	4.219	20	30		CIEDRN
N#CC1(c2nc(-c3cc4ccccc4o3)no2)CCCCC1	ZINC000129666650	333786394	/nfs/dbraw/zinc/78/63/94/333786394.db2.gz	BSPIEAVKIYIKMG-UHFFFAOYSA-N	0	0	293.326	4.208	20	30		CIEDRN
N#Cc1cccc(SCCCOCc2ccccc2)c1	ZINC000541781616	333792506	/nfs/dbraw/zinc/79/25/06/333792506.db2.gz	LJXZCSYFBRZMBH-UHFFFAOYSA-N	0	0	283.396	4.257	20	30		CIEDRN
COc1cc(C#N)ccc1NCc1cccc(C(F)F)c1	ZINC000129879189	333797510	/nfs/dbraw/zinc/79/75/10/333797510.db2.gz	QCXPNFLQRAFFBK-UHFFFAOYSA-N	0	0	288.297	4.117	20	30		CIEDRN
CC(C)(C)c1cnc(SCc2ccccc2C#N)o1	ZINC000129964216	333801615	/nfs/dbraw/zinc/80/16/15/333801615.db2.gz	SMQHUOZSJAAOGC-UHFFFAOYSA-N	0	0	272.373	4.136	20	30		CIEDRN
N#Cc1c(Cl)cccc1SCCC(F)(F)F	ZINC000542101813	333809801	/nfs/dbraw/zinc/80/98/01/333809801.db2.gz	GAMSQNPVVJLQQQ-UHFFFAOYSA-N	0	0	265.687	4.256	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2ccc(C)c(OC)c2)no1	ZINC000576145354	335160174	/nfs/dbraw/zinc/16/01/74/335160174.db2.gz	CUTRUSNDCUMCFB-GFCCVEGCSA-N	0	0	272.348	4.123	20	30		CIEDRN
C=CCCC(=O)N1CCCCC[C@H]1/C=C/c1cccs1	ZINC000542181614	333813654	/nfs/dbraw/zinc/81/36/54/333813654.db2.gz	QEQOKKRSMGLLEO-RUMSDORHSA-N	0	0	289.444	4.499	20	30		CIEDRN
N#CCc1ccc(CSCc2cccc(F)c2F)cc1	ZINC000542225522	333817368	/nfs/dbraw/zinc/81/73/68/333817368.db2.gz	QNRUHFCOTDWZCL-UHFFFAOYSA-N	0	0	289.350	4.464	20	30		CIEDRN
C=CCC[C@@H](C)Nc1cccc2c1CN(c1nccs1)C2	ZINC000542704939	333837627	/nfs/dbraw/zinc/83/76/27/333837627.db2.gz	RIWHJDVPHZZLMM-CYBMUJFWSA-N	0	0	299.443	4.430	20	30		CIEDRN
CC(C)(C)[C@H]1CCCN(C(=O)C2(C#N)CCCCC2)CC1	ZINC000071202731	333848348	/nfs/dbraw/zinc/84/83/48/333848348.db2.gz	RCFVQUACNLFBCA-HNNXBMFYSA-N	0	0	290.451	4.135	20	30		CIEDRN
C=C[C@@H](CC(=O)N1Cc2ccccc2[C@@H]1C)c1ccccc1	ZINC000543086819	333856373	/nfs/dbraw/zinc/85/63/73/333856373.db2.gz	LFVLSZGUGXLUSG-HOTGVXAUSA-N	0	0	291.394	4.450	20	30		CIEDRN
Cc1ccc(C(=O)Nc2cccc(C#N)c2C)c(Cl)c1C	ZINC000543096104	333857102	/nfs/dbraw/zinc/85/71/02/333857102.db2.gz	WIVVKGBVQMYIMV-UHFFFAOYSA-N	0	0	298.773	4.389	20	30		CIEDRN
CC[C@@H](Nc1nccc(C)c1C#N)c1ccc(C)cc1	ZINC000543134206	333859720	/nfs/dbraw/zinc/85/97/20/333859720.db2.gz	OQLZWKGNCQUHPQ-MRXNPFEDSA-N	0	0	265.360	4.133	20	30		CIEDRN
COc1cccc([C@H]2C[C@@H](C)CN2c2ccc(C#N)cc2)c1	ZINC000543133216	333859754	/nfs/dbraw/zinc/85/97/54/333859754.db2.gz	MKPTXCQHJUXRJB-AUUYWEPGSA-N	0	0	292.382	4.154	20	30		CIEDRN
N#CCc1ccc(CSc2ncnc3ccsc32)cc1	ZINC000543149868	333861109	/nfs/dbraw/zinc/86/11/09/333861109.db2.gz	LCDSKQPXXVNPKN-UHFFFAOYSA-N	0	0	297.408	4.050	20	30		CIEDRN
C=CCC[C@@H](Nc1nccc(C)c1C#N)c1ccccc1	ZINC000543206710	333864789	/nfs/dbraw/zinc/86/47/89/333864789.db2.gz	WRJVFPSSWXFMQD-QGZVFWFLSA-N	0	0	277.371	4.381	20	30		CIEDRN
CC[C@@H](C)n1ncc(Nc2nccc(C)c2C#N)c1C1CC1	ZINC000543209912	333864915	/nfs/dbraw/zinc/86/49/15/333864915.db2.gz	CDEQWLCNGGARFW-GFCCVEGCSA-N	0	0	295.390	4.050	20	30		CIEDRN
C=CCn1c2ccccc2nc1SCCCC(=O)CC	ZINC000543694009	333888863	/nfs/dbraw/zinc/88/88/63/333888863.db2.gz	LOQAQGFVVLYLKV-UHFFFAOYSA-N	0	0	288.416	4.074	20	30		CIEDRN
C[C@H](NCc1ccc([C@@H]2C[C@@H]2C)o1)c1ccc(C#N)cc1F	ZINC000543762223	333897098	/nfs/dbraw/zinc/89/70/98/333897098.db2.gz	JJBCSEAAAUFVNA-MQIPJXDCSA-N	0	0	298.361	4.265	20	30		CIEDRN
N#Cc1cccnc1NC1CCC(c2ccc(F)cc2)CC1	ZINC000543790185	333898877	/nfs/dbraw/zinc/89/88/77/333898877.db2.gz	MVEOJYYMXBUDAX-UHFFFAOYSA-N	0	0	295.361	4.231	20	30		CIEDRN
Cc1cc(-c2cccc(C#N)c2)nc2cc(F)ccc12	ZINC000544045186	333912322	/nfs/dbraw/zinc/91/23/22/333912322.db2.gz	KIHKWUXZNMWKCX-UHFFFAOYSA-N	0	0	262.287	4.221	20	30		CIEDRN
Cc1c(Cl)cnc(N2CCC[C@H]2C2CCCC2)c1C#N	ZINC000544149388	333919121	/nfs/dbraw/zinc/91/91/21/333919121.db2.gz	DYURGEZVTQUDSQ-HNNXBMFYSA-N	0	0	289.810	4.074	20	30		CIEDRN
C=CCn1c(SCC2CCCCCC2)nnc1C1CC1	ZINC000544677886	333942841	/nfs/dbraw/zinc/94/28/41/333942841.db2.gz	RTJDXRWTALUFEC-UHFFFAOYSA-N	0	0	291.464	4.404	20	30		CIEDRN
CC[C@H](CC(F)(F)F)Nc1ccc(C#N)c(Cl)c1	ZINC000544846775	333949013	/nfs/dbraw/zinc/94/90/13/333949013.db2.gz	JXIYLDGTZJZFNT-SECBINFHSA-N	0	0	276.689	4.355	20	30		CIEDRN
C=CCCc1nc(CCCc2ccccc2Cl)no1	ZINC000544959579	333955022	/nfs/dbraw/zinc/95/50/22/333955022.db2.gz	OSUWCVBCBXNUGY-UHFFFAOYSA-N	0	0	276.767	4.017	20	30		CIEDRN
C=CCCO[C@@H](C)c1nc([C@H]2CCCc3ccccc32)no1	ZINC000544979453	333956219	/nfs/dbraw/zinc/95/62/19/333956219.db2.gz	TYGULTQQJFSGRZ-BBRMVZONSA-N	0	0	298.386	4.192	20	30		CIEDRN
N#Cc1c(F)cccc1SCc1c(F)cccc1F	ZINC000576200998	335168617	/nfs/dbraw/zinc/16/86/17/335168617.db2.gz	GFXVDZPNPJQKNB-UHFFFAOYSA-N	0	0	279.286	4.268	20	30		CIEDRN
C=CCC(CC=C)c1nc(-c2ccc(F)cc2)no1	ZINC000545543517	333987523	/nfs/dbraw/zinc/98/75/23/333987523.db2.gz	WKFMPXYXXIIIIN-UHFFFAOYSA-N	0	0	258.296	4.112	20	30		CIEDRN
C=CCC(CC=C)c1nc(Cc2ccc(C)cc2)no1	ZINC000545607636	333990967	/nfs/dbraw/zinc/99/09/67/333990967.db2.gz	ZEGDQAGNAWWTDR-UHFFFAOYSA-N	0	0	268.360	4.205	20	30		CIEDRN
C=C[C@H](Cc1nc([C@H](C)SCC)no1)c1ccccc1	ZINC000545783187	334000463	/nfs/dbraw/zinc/00/04/63/334000463.db2.gz	CPVBOFGBMQCNLH-QWHCGFSZSA-N	0	0	288.416	4.396	20	30		CIEDRN
CC[C@@H](CC#N)NCc1ccc(-c2cccc(F)c2C)o1	ZINC000545871221	334003315	/nfs/dbraw/zinc/00/33/15/334003315.db2.gz	GBUHMGOXOKPIBW-ZDUSSCGKSA-N	0	0	286.350	4.176	20	30		CIEDRN
CC[C@@H](CC#N)NC(=O)C/C=C/c1ccc(C(C)C)cc1	ZINC000545880716	334003631	/nfs/dbraw/zinc/00/36/31/334003631.db2.gz	UKNKOVLGRSKWBM-RTRPANQVSA-N	0	0	284.403	4.022	20	30		CIEDRN
CC[C@H](CC#N)NC(=O)C/C=C\c1ccc(C(C)C)cc1	ZINC000545880714	334003742	/nfs/dbraw/zinc/00/37/42/334003742.db2.gz	UKNKOVLGRSKWBM-KEGWNNHHSA-N	0	0	284.403	4.022	20	30		CIEDRN
C=CCCC(=O)NCC[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000074387725	334005212	/nfs/dbraw/zinc/00/52/12/334005212.db2.gz	PPNWLGKKSHANNO-GFCCVEGCSA-N	0	0	299.336	4.281	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@H]1CCCc2ccccc21	ZINC000545924239	334006706	/nfs/dbraw/zinc/00/67/06/334006706.db2.gz	XFJOGJMOHWVZLT-PBHICJAKSA-N	0	0	271.404	4.125	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2ccccc2Cl)no1	ZINC000545933540	334007432	/nfs/dbraw/zinc/00/74/32/334007432.db2.gz	CGNMRHSPCNJSEB-SNVBAGLBSA-N	0	0	262.740	4.460	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CC[C@@H](C)C(C)(C)C1)c1ccccc1	ZINC000546139322	334016492	/nfs/dbraw/zinc/01/64/92/334016492.db2.gz	JJBVWNRVNPBXGO-CVEARBPZSA-N	0	0	285.431	4.241	20	30		CIEDRN
C=CCCCc1nc(-c2ccc(OC(C)C)cc2)no1	ZINC000546283879	334024755	/nfs/dbraw/zinc/02/47/55/334024755.db2.gz	AEQZJTYBXPFHFP-UHFFFAOYSA-N	0	0	272.348	4.033	20	30		CIEDRN
C=C[C@@H](Cc1nc(-c2ccccc2F)no1)c1ccccc1	ZINC000546298296	334026412	/nfs/dbraw/zinc/02/64/12/334026412.db2.gz	KIJZRZNCTQSVDV-ZDUSSCGKSA-N	0	0	294.329	4.388	20	30		CIEDRN
C=C(C)[C@H](Cc1nc(CCC2CCCCC2)no1)OCC	ZINC000546343090	334028394	/nfs/dbraw/zinc/02/83/94/334028394.db2.gz	QNDKANLGUBZCEV-HNNXBMFYSA-N	0	0	292.423	4.106	20	30		CIEDRN
C=CCCOCCCCc1nc([C@H]2CCC[C@@H](C)C2)no1	ZINC000546358425	334029050	/nfs/dbraw/zinc/02/90/50/334029050.db2.gz	WGDQJZZDHWGKBW-CABCVRRESA-N	0	0	292.423	4.279	20	30		CIEDRN
C[C@H]1CCCC[C@@H]1c1noc(CCc2ccc(C#N)cc2)n1	ZINC000546401010	334030870	/nfs/dbraw/zinc/03/08/70/334030870.db2.gz	QVLLYXKNJWLYBD-BBRMVZONSA-N	0	0	295.386	4.020	20	30		CIEDRN
CC(C)c1ccc(CNc2ccc(C#N)cc2)cc1[N+](=O)[O-]	ZINC000546619115	334040704	/nfs/dbraw/zinc/04/07/04/334040704.db2.gz	BJDDQTZFWUBTPR-UHFFFAOYSA-N	0	0	295.342	4.202	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCc1cccc(Cl)c1Cl	ZINC000546630701	334041981	/nfs/dbraw/zinc/04/19/81/334041981.db2.gz	QERSISGCKPZXBG-SNVBAGLBSA-N	0	0	286.202	4.212	20	30		CIEDRN
N#CCc1ccnc(NCc2c(Cl)cccc2Cl)c1	ZINC000546633210	334042319	/nfs/dbraw/zinc/04/23/19/334042319.db2.gz	AYZOQICDZOVRDK-UHFFFAOYSA-N	0	0	292.169	4.067	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@@H]1Cc1ccc(C)cc1	ZINC000133491947	334042878	/nfs/dbraw/zinc/04/28/78/334042878.db2.gz	XTJAEWYARRZGQE-LJQANCHMSA-N	0	0	297.442	4.297	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N[C@H](c1ccccc1C)C1CC1	ZINC000546660893	334044364	/nfs/dbraw/zinc/04/43/64/334044364.db2.gz	VTLMMXYKUHDYKK-WBVHZDCISA-N	0	0	286.419	4.100	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)c1cc(Cl)ccc1OC	ZINC000133664618	334049125	/nfs/dbraw/zinc/04/91/25/334049125.db2.gz	LJACRVUSMRAMAY-UHFFFAOYSA-N	0	0	293.794	4.080	20	30		CIEDRN
C=CCC[C@H](NC(=O)[C@H](C)c1cccnc1)c1ccccc1	ZINC000133713760	334051008	/nfs/dbraw/zinc/05/10/08/334051008.db2.gz	QZEHQVGBRGTRMV-QAPCUYQASA-N	0	0	294.398	4.009	20	30		CIEDRN
C=CCC[C@@H](NC(=O)[C@H](C)c1cccnc1)c1ccccc1	ZINC000133714192	334051094	/nfs/dbraw/zinc/05/10/94/334051094.db2.gz	QZEHQVGBRGTRMV-CRAIPNDOSA-N	0	0	294.398	4.009	20	30		CIEDRN
CCSCC[NH2+]Cc1ccc(-c2ccccc2C#N)cc1	ZINC000547012815	334061592	/nfs/dbraw/zinc/06/15/92/334061592.db2.gz	QSRLVCFXAVEFBA-UHFFFAOYSA-N	0	0	296.439	4.068	20	30		CIEDRN
C=CCC[C@H](NC(=O)CC1CCC1)c1ccccc1	ZINC000134016111	334077578	/nfs/dbraw/zinc/07/75/78/334077578.db2.gz	QTJMIQHEODWTBX-INIZCTEOSA-N	0	0	257.377	4.000	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cc(Cl)cc2cccnc21	ZINC000547337417	334080947	/nfs/dbraw/zinc/08/09/47/334080947.db2.gz	GDZFDZVISDYOLM-LLVKDONJSA-N	0	0	288.778	4.429	20	30		CIEDRN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@H]1CCC[C@@H](C)C1	ZINC000134157728	334082457	/nfs/dbraw/zinc/08/24/57/334082457.db2.gz	VRINRXPADKZYFJ-QAPCUYQASA-N	0	0	298.430	4.122	20	30		CIEDRN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@@H]1CCC[C@@H](C)C1	ZINC000134158113	334082462	/nfs/dbraw/zinc/08/24/62/334082462.db2.gz	VRINRXPADKZYFJ-CRAIPNDOSA-N	0	0	298.430	4.122	20	30		CIEDRN
CC(C)(C)c1csc(COc2ccc(C#N)cc2F)n1	ZINC000134295893	334087321	/nfs/dbraw/zinc/08/73/21/334087321.db2.gz	YWLBPCPSFALEOI-UHFFFAOYSA-N	0	0	290.363	4.030	20	30		CIEDRN
N#CCCC[S@](=O)c1ccc(C2CCCCC2)cc1	ZINC000547484168	334092242	/nfs/dbraw/zinc/09/22/42/334092242.db2.gz	CIGQMTQNIJMJMC-IBGZPJMESA-N	0	0	275.417	4.146	20	30		CIEDRN
N#CCCC[S@@](=O)c1ccc(C2CCCCC2)cc1	ZINC000547484169	334092359	/nfs/dbraw/zinc/09/23/59/334092359.db2.gz	CIGQMTQNIJMJMC-LJQANCHMSA-N	0	0	275.417	4.146	20	30		CIEDRN
C=CCCCN(C)C(=O)N[C@@H](C)c1ccc(F)cc1Cl	ZINC000076978080	334092552	/nfs/dbraw/zinc/09/25/52/334092552.db2.gz	BFZLWBVFEFMUEP-NSHDSACASA-N	0	0	298.789	4.148	20	30		CIEDRN
N#Cc1ccc(NC[C@@H]2CCOc3ccccc32)cc1Cl	ZINC000134510539	334092833	/nfs/dbraw/zinc/09/28/33/334092833.db2.gz	NFJDJPYNLUKOAP-ZDUSSCGKSA-N	0	0	298.773	4.190	20	30		CIEDRN
C=CCOc1cccc(CNc2cccc3cc[nH]c32)c1	ZINC000547499131	334094804	/nfs/dbraw/zinc/09/48/04/334094804.db2.gz	NZFUQRRUYPGWSJ-UHFFFAOYSA-N	0	0	278.355	4.345	20	30		CIEDRN
Cc1cc(NCc2cccc(C#N)c2)ccc1C(F)(F)F	ZINC000237755589	334096964	/nfs/dbraw/zinc/09/69/64/334096964.db2.gz	NQRZBAXVPPXQOA-UHFFFAOYSA-N	0	0	290.288	4.498	20	30		CIEDRN
C=CCCCNc1ccccc1Oc1ncccc1C#N	ZINC000077245121	334099793	/nfs/dbraw/zinc/09/97/93/334099793.db2.gz	WLFGSCPCUXZDOB-UHFFFAOYSA-N	0	0	279.343	4.124	20	30		CIEDRN
C=CCCC(=O)CSc1nc2ccccc2n1C(F)F	ZINC000134692413	334100865	/nfs/dbraw/zinc/10/08/65/334100865.db2.gz	NKVCJDCCRGLYQD-UHFFFAOYSA-N	0	0	296.342	4.059	20	30		CIEDRN
N#Cc1ccc(Cl)cc1NC[C@H]1CCOc2ccccc21	ZINC000134826091	334105346	/nfs/dbraw/zinc/10/53/46/334105346.db2.gz	CIBHPWGNZJSUDT-CYBMUJFWSA-N	0	0	298.773	4.190	20	30		CIEDRN
C=CCN(C)C(=O)Nc1ccc(-c2ccccc2)cc1C	ZINC000547671635	334107849	/nfs/dbraw/zinc/10/78/49/334107849.db2.gz	VEDSMUCSCJHXJA-UHFFFAOYSA-N	0	0	280.371	4.312	20	30		CIEDRN
Cc1cc([C@@H](C)Nc2nccc(C)c2C#N)c(C)s1	ZINC000135068571	334114407	/nfs/dbraw/zinc/11/44/07/334114407.db2.gz	QCVJXOMMFJLWAU-LLVKDONJSA-N	0	0	271.389	4.113	20	30		CIEDRN
C=C[C@H](CC(=O)N1CCCC[C@@H]1C(C)C)c1ccccc1	ZINC000135100903	334115349	/nfs/dbraw/zinc/11/53/49/334115349.db2.gz	QVWRFHZFDGLHSC-SJLPKXTDSA-N	0	0	285.431	4.383	20	30		CIEDRN
C[C@@H](NCc1ccc(C#N)o1)c1ccc(Cl)cc1Cl	ZINC000135126563	334116828	/nfs/dbraw/zinc/11/68/28/334116828.db2.gz	LOCKKLPNZFVKKT-SECBINFHSA-N	0	0	295.169	4.309	20	30		CIEDRN
N#Cc1ccccc1CSCc1csc(C2CC2)n1	ZINC000135213769	334119863	/nfs/dbraw/zinc/11/98/63/334119863.db2.gz	IZKVLHSKKITMNN-UHFFFAOYSA-N	0	0	286.425	4.326	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1cccc(C(F)(F)F)c1C	ZINC000135237427	334120586	/nfs/dbraw/zinc/12/05/86/334120586.db2.gz	HEPVDORZEOEIAS-VIFPVBQESA-N	0	0	286.297	4.100	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)[C@@H](C)c1cccs1	ZINC000078060908	334122970	/nfs/dbraw/zinc/12/29/70/334122970.db2.gz	RJHZICRMIJDNFH-AWEZNQCLSA-N	0	0	285.412	4.066	20	30		CIEDRN
C=CCOc1cccc(NC(=O)[C@@H](C)c2ccsc2)c1	ZINC000078087678	334123586	/nfs/dbraw/zinc/12/35/86/334123586.db2.gz	ZUTHAZLXRHUEAL-LBPRGKRZSA-N	0	0	287.384	4.055	20	30		CIEDRN
C=CCSc1ccccc1C(=O)NC1CCCCCC1	ZINC000547931174	334129903	/nfs/dbraw/zinc/12/99/03/334129903.db2.gz	KLVIKNYZCGVBAQ-UHFFFAOYSA-N	0	0	289.444	4.417	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(Cc2ccncc2)cc1	ZINC000135461407	334130684	/nfs/dbraw/zinc/13/06/84/334130684.db2.gz	XZTQDMJWMAGTGF-LJQANCHMSA-N	0	0	294.398	4.213	20	30		CIEDRN
CN(Cc1cc2ccccc2o1)Cc1ccc(C#N)cc1F	ZINC000175197245	335177612	/nfs/dbraw/zinc/17/76/12/335177612.db2.gz	IHNFKEFRRKILON-UHFFFAOYSA-N	0	0	294.329	4.076	20	30		CIEDRN
CC(C)CCN(CCC#N)C(=O)C[C@H](C)C1CCCCC1	ZINC000078419711	334133307	/nfs/dbraw/zinc/13/33/07/334133307.db2.gz	WUCMVZDGTXFZSU-INIZCTEOSA-N	0	0	292.467	4.381	20	30		CIEDRN
CC[C@@H]1CCCC[C@H]1Nc1nc(C(F)(F)F)ccc1C#N	ZINC000078833804	334141258	/nfs/dbraw/zinc/14/12/58/334141258.db2.gz	KHEBKAUQNKCULJ-ZYHUDNBSSA-N	0	0	297.324	4.353	20	30		CIEDRN
C[C@@H]1CC[C@@H](Nc2nc(C(F)(F)F)ccc2C#N)[C@H](C)C1	ZINC000078836196	334141280	/nfs/dbraw/zinc/14/12/80/334141280.db2.gz	BGFRTCKAIMFYEN-CKYFFXLPSA-N	0	0	297.324	4.209	20	30		CIEDRN
C[C@@H]1CCCN(c2ccc(C#N)cc2C(F)(F)F)CC1	ZINC000078838950	334141398	/nfs/dbraw/zinc/14/13/98/334141398.db2.gz	LZGHTUYZTWKSJW-LLVKDONJSA-N	0	0	282.309	4.203	20	30		CIEDRN
N#C[C@H](Nc1cccc2cc[nH]c21)C1CCCCC1	ZINC000548134317	334141705	/nfs/dbraw/zinc/14/17/05/334141705.db2.gz	ORROZVOSUAPTOZ-HNNXBMFYSA-N	0	0	253.349	4.052	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N[C@@H](C(C)(C)C)C(F)(F)F	ZINC000548183803	334145696	/nfs/dbraw/zinc/14/56/96/334145696.db2.gz	OWDSYMMNHIJKFI-QWRGUYRKSA-N	0	0	294.361	4.007	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)N[C@H](C)c1ccccc1	ZINC000079029337	334146098	/nfs/dbraw/zinc/14/60/98/334146098.db2.gz	LLIRRMSIIYNGQX-MRXNPFEDSA-N	0	0	294.398	4.145	20	30		CIEDRN
C[C@@H](O)[C@H](C)SCc1ccc(-c2ccccc2C#N)cc1	ZINC000079046016	334146320	/nfs/dbraw/zinc/14/63/20/334146320.db2.gz	LZBHVWOGZSGMEX-KGLIPLIRSA-N	0	0	297.423	4.228	20	30		CIEDRN
C=C[C@H](CC(=O)N1CCCCC[C@H]1C)c1ccccc1	ZINC000548252265	334147219	/nfs/dbraw/zinc/14/72/19/334147219.db2.gz	CSQWXCDJBYNEJS-HZPDHXFCSA-N	0	0	271.404	4.137	20	30		CIEDRN
CCc1ccc(NC(=O)c2ccc(C#N)c(Cl)c2)cc1	ZINC000548278633	334148168	/nfs/dbraw/zinc/14/81/68/334148168.db2.gz	OAUCPWAHXOVTKC-UHFFFAOYSA-N	0	0	284.746	4.026	20	30		CIEDRN
CC[C@@H]1CCCN(c2c(C#N)cnc3ccccc32)CC1	ZINC000079343550	334151961	/nfs/dbraw/zinc/15/19/61/334151961.db2.gz	LIQJRYZHXDCQCX-CQSZACIVSA-N	0	0	279.387	4.123	20	30		CIEDRN
C=CCCCCNC(=O)c1cc2sccc2s1	ZINC000548437290	334156297	/nfs/dbraw/zinc/15/62/97/334156297.db2.gz	VOWRQBRCNUSMTE-UHFFFAOYSA-N	0	0	265.403	4.049	20	30		CIEDRN
CC[C@H](CC#N)NC(=O)Nc1ccc(CCC(C)C)cc1	ZINC000548442314	334156486	/nfs/dbraw/zinc/15/64/86/334156486.db2.gz	SXKJXLVMDMXZSY-OAHLLOKOSA-N	0	0	287.407	4.089	20	30		CIEDRN
N#CCC1CCN(c2ccc3ccc(Cl)cc3n2)CC1	ZINC000548490506	334160204	/nfs/dbraw/zinc/16/02/04/334160204.db2.gz	WUELVTSSKZNGQG-UHFFFAOYSA-N	0	0	285.778	4.018	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc2nc(C3CC3)oc2c1	ZINC000079726558	334161150	/nfs/dbraw/zinc/16/11/50/334161150.db2.gz	WJTDXBTYEXWEKU-UHFFFAOYSA-N	0	0	270.332	4.000	20	30		CIEDRN
CCN(C(=O)c1ccc(C#N)c(Cl)c1)c1cccc(C)c1	ZINC000548607430	334163508	/nfs/dbraw/zinc/16/35/08/334163508.db2.gz	VJGQSKFTEPDRAI-UHFFFAOYSA-N	0	0	298.773	4.187	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1cccc2cc[nH]c21)c1ccccc1	ZINC000548616366	334163968	/nfs/dbraw/zinc/16/39/68/334163968.db2.gz	YKRBUBIVDUPPIN-INIZCTEOSA-N	0	0	290.366	4.466	20	30		CIEDRN
CC(C)(C)c1ccccc1C(=O)Nc1ccc(CC#N)cc1	ZINC000136859775	334164872	/nfs/dbraw/zinc/16/48/72/334164872.db2.gz	SCVGLPIXRBHCHW-UHFFFAOYSA-N	0	0	292.382	4.302	20	30		CIEDRN
C=CCSc1ccccc1C(=O)NCC1CC(C)(C)C1	ZINC000548713497	334167014	/nfs/dbraw/zinc/16/70/14/334167014.db2.gz	RJNSGBJOCLHCTO-UHFFFAOYSA-N	0	0	289.444	4.131	20	30		CIEDRN
CC(C)(CCC#N)CNc1cccc2c1CCCC2	ZINC000080191922	334167403	/nfs/dbraw/zinc/16/74/03/334167403.db2.gz	DYQYMULLIPFKRY-UHFFFAOYSA-N	0	0	256.393	4.307	20	30		CIEDRN
N#CCN(Cc1ccc(Cl)c(Cl)c1)C1CCCC1	ZINC000080215656	334167512	/nfs/dbraw/zinc/16/75/12/334167512.db2.gz	SKDMOOQTGSMHTD-UHFFFAOYSA-N	0	0	283.202	4.262	20	30		CIEDRN
N#CCN(Cc1ccc(Cl)cc1Cl)C1CCCC1	ZINC000080215746	334167542	/nfs/dbraw/zinc/16/75/42/334167542.db2.gz	GKIMVMNKOXRQNB-UHFFFAOYSA-N	0	0	283.202	4.262	20	30		CIEDRN
Cc1ccc(C[C@H](C)Nc2ccc(C#N)cc2F)s1	ZINC000080245272	334168345	/nfs/dbraw/zinc/16/83/45/334168345.db2.gz	JCYBIIYLDMMOIR-JTQLQIEISA-N	0	0	274.364	4.110	20	30		CIEDRN
CC(C)(CNc1ccc(Cl)cc1C#N)C(F)(F)F	ZINC000549006550	334182335	/nfs/dbraw/zinc/18/23/35/334182335.db2.gz	KPIIDSWGKVAMBP-UHFFFAOYSA-N	0	0	276.689	4.212	20	30		CIEDRN
C[C@@H]1CC(=O)c2c1c(F)ccc2Oc1cccc(F)c1C#N	ZINC000548821963	334175469	/nfs/dbraw/zinc/17/54/69/334175469.db2.gz	QMDVKKXKFILGSC-SECBINFHSA-N	0	0	299.276	4.319	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N(C)[C@@H](C)C1CC1	ZINC000548879366	334178184	/nfs/dbraw/zinc/17/81/84/334178184.db2.gz	ZQZKHBILOUWFFQ-ZDUSSCGKSA-N	0	0	272.392	4.067	20	30		CIEDRN
C=CCN(CC(F)(F)F)C(=O)CC[C@H](C)c1ccccc1	ZINC000137898252	334182021	/nfs/dbraw/zinc/18/20/21/334182021.db2.gz	DJSTVBLSEUADOP-ZDUSSCGKSA-N	0	0	299.336	4.147	20	30		CIEDRN
C=CCCN[C@H](c1ccccc1C(F)(F)F)C(F)(F)F	ZINC000549064607	334184355	/nfs/dbraw/zinc/18/43/55/334184355.db2.gz	UKLXIADYWPZLBM-LLVKDONJSA-N	0	0	297.242	4.475	20	30		CIEDRN
C=CC[C@@H](C(=O)NCC(C)(C)C(F)(F)F)c1ccccc1	ZINC000549065880	334184366	/nfs/dbraw/zinc/18/43/66/334184366.db2.gz	QHMYKEBFORHYQR-CYBMUJFWSA-N	0	0	299.336	4.051	20	30		CIEDRN
N#Cc1cccc(C(=O)N2CCCC3(C2)CCCCCC3)c1	ZINC000081304724	334184398	/nfs/dbraw/zinc/18/43/98/334184398.db2.gz	IGYIVJXLVLQYDD-UHFFFAOYSA-N	0	0	296.414	4.135	20	30		CIEDRN
C=CCN(CCc1ccco1)Cc1sccc1Cl	ZINC000549067575	334184533	/nfs/dbraw/zinc/18/45/33/334184533.db2.gz	OQWIGOLCWNWACM-UHFFFAOYSA-N	0	0	281.808	4.225	20	30		CIEDRN
N#CCS[C@@H](c1ccccc1)c1ccc(F)cc1	ZINC000549200397	334187531	/nfs/dbraw/zinc/18/75/31/334187531.db2.gz	UXEYBMAXDGGPGU-HNNXBMFYSA-N	0	0	257.333	4.172	20	30		CIEDRN
C=CCN(Cc1ccc(COC)cc1)Cc1ccccc1F	ZINC000549366134	334191334	/nfs/dbraw/zinc/19/13/34/334191334.db2.gz	FXHWPIULEDQZKJ-UHFFFAOYSA-N	0	0	299.389	4.160	20	30		CIEDRN
CC(C)[C@H]1CC[C@H](C(=O)Nc2sccc2C#N)CC1	ZINC000245506542	334198402	/nfs/dbraw/zinc/19/84/02/334198402.db2.gz	HIRIIMJESKSEEN-HAQNSBGRSA-N	0	0	276.405	4.021	20	30		CIEDRN
C=CCOCC[NH2+][C@H](C)c1ccc(SC(C)C)cc1	ZINC000549927811	334209386	/nfs/dbraw/zinc/20/93/86/334209386.db2.gz	FEYOLSOLPQLPHT-CQSZACIVSA-N	0	0	279.449	4.040	20	30		CIEDRN
C=CCN(CC=C)C(=O)c1cc2cccc(C)c2s1	ZINC000564366745	334209819	/nfs/dbraw/zinc/20/98/19/334209819.db2.gz	CXGPDVOJBPUUMO-UHFFFAOYSA-N	0	0	271.385	4.024	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)[C@@H]2CCCC(C)(C)C2)s1	ZINC000549988485	334210724	/nfs/dbraw/zinc/21/07/24/334210724.db2.gz	SXVLVCZCACEVOL-LLVKDONJSA-N	0	0	290.432	4.337	20	30		CIEDRN
C[C@H](C#N)SC(c1ccccc1)c1ccccc1	ZINC000081970905	334215369	/nfs/dbraw/zinc/21/53/69/334215369.db2.gz	WTTYWIWVWGVSJN-CYBMUJFWSA-N	0	0	253.370	4.421	20	30		CIEDRN
C[C@@H]1CCN(Cc2ccc(C#N)s2)[C@@H](c2ccco2)C1	ZINC000245746728	334216938	/nfs/dbraw/zinc/21/69/38/334216938.db2.gz	MWCFLJCQBNLWBI-IUODEOHRSA-N	0	0	286.400	4.186	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccccc1N(C)C(C)C	ZINC000550245287	334217271	/nfs/dbraw/zinc/21/72/71/334217271.db2.gz	TZXPLZWGNIDNOI-UHFFFAOYSA-N	0	0	286.419	4.238	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc(Oc2ccncc2)cc1	ZINC000550286777	334219059	/nfs/dbraw/zinc/21/90/59/334219059.db2.gz	QUMGKIXBPBTFNX-UHFFFAOYSA-N	0	0	296.370	4.415	20	30		CIEDRN
C=CCC(F)(F)c1nc(C[C@@H](C)c2ccccc2)no1	ZINC000551015526	334236369	/nfs/dbraw/zinc/23/63/69/334236369.db2.gz	DXHGLCHSVYKXMD-LLVKDONJSA-N	0	0	278.302	4.084	20	30		CIEDRN
C=CCC(F)(F)c1nc(C(C)(C)c2cccc(F)c2)no1	ZINC000551052559	334237182	/nfs/dbraw/zinc/23/71/82/334237182.db2.gz	LFFLMZOMXPKCJC-UHFFFAOYSA-N	0	0	296.292	4.203	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cc(F)c(F)cc2F)n1	ZINC000551140160	334239126	/nfs/dbraw/zinc/23/91/26/334239126.db2.gz	QELYWAHQOMINTQ-UHFFFAOYSA-N	0	0	282.265	4.008	20	30		CIEDRN
C=CCC(C)(C)c1noc(C[C@H]2CCOc3ccccc32)n1	ZINC000551138216	334239277	/nfs/dbraw/zinc/23/92/77/334239277.db2.gz	ODRLPSCRMMUZQY-CYBMUJFWSA-N	0	0	298.386	4.032	20	30		CIEDRN
C=CCC(C)(C)c1noc(C/C=C\c2ccccc2F)n1	ZINC000551141407	334239376	/nfs/dbraw/zinc/23/93/76/334239376.db2.gz	ZXCHRKGQRCOOMM-CLFYSBASSA-N	0	0	286.350	4.318	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cccc(OC(F)F)c2)n1	ZINC000551140098	334239387	/nfs/dbraw/zinc/23/93/87/334239387.db2.gz	OUPDPDXQZRNECT-UHFFFAOYSA-N	0	0	294.301	4.192	20	30		CIEDRN
CCC(CC)[C@@H](C)C(=O)N[C@@](C)(C#N)C1CCCCC1	ZINC000551305110	334244935	/nfs/dbraw/zinc/24/49/35/334244935.db2.gz	AYLBZJKYXSHLND-DYVFJYSZSA-N	0	0	278.440	4.037	20	30		CIEDRN
C[C@@H](SCCCCCF)c1ccc(C#N)cc1	ZINC000551372936	334248138	/nfs/dbraw/zinc/24/81/38/334248138.db2.gz	AGMXWXHWCOOJKF-GFCCVEGCSA-N	0	0	251.370	4.492	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H](C)c1c(F)cccc1Cl	ZINC000551389636	334248752	/nfs/dbraw/zinc/24/87/52/334248752.db2.gz	LNXMRTUMROSUQQ-SNVBAGLBSA-N	0	0	283.774	4.259	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cccc3cccnc32)n1	ZINC000551471255	334251235	/nfs/dbraw/zinc/25/12/35/334251235.db2.gz	CPJQRLDURNQEMI-UHFFFAOYSA-N	0	0	279.343	4.139	20	30		CIEDRN
C=CCC(C)(C)c1noc(/C=C/c2ccccc2OC)n1	ZINC000551472834	334251260	/nfs/dbraw/zinc/25/12/60/334251260.db2.gz	ZUQWOYGJHUELMZ-ZHACJKMWSA-N	0	0	284.359	4.102	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)N[C@H]1CC[C@H](C)CC1	ZINC000247099051	334275646	/nfs/dbraw/zinc/27/56/46/334275646.db2.gz	JONLTJJAWSKWGL-HDJSIYSDSA-N	0	0	292.448	4.024	20	30		CIEDRN
C=CCC(C)(C)c1noc(Cc2c[nH]c3c2cccc3C)n1	ZINC000551498017	334251545	/nfs/dbraw/zinc/25/15/45/334251545.db2.gz	LBYXDEQYPWRYOI-UHFFFAOYSA-N	0	0	295.386	4.304	20	30		CIEDRN
C=CCC(C)(C)c1noc(C[C@@H](C)c2ccccc2F)n1	ZINC000551491731	334251554	/nfs/dbraw/zinc/25/15/54/334251554.db2.gz	GVJXQFOEAFKBHC-GFCCVEGCSA-N	0	0	288.366	4.409	20	30		CIEDRN
C=CCC(C)(C)c1noc(C[C@H](C)c2ccccc2F)n1	ZINC000551491732	334251592	/nfs/dbraw/zinc/25/15/92/334251592.db2.gz	GVJXQFOEAFKBHC-LBPRGKRZSA-N	0	0	288.366	4.409	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cccc(F)c2OCC)n1	ZINC000551497351	334251739	/nfs/dbraw/zinc/25/17/39/334251739.db2.gz	WBIIRCUVXZPFBJ-UHFFFAOYSA-N	0	0	290.338	4.128	20	30		CIEDRN
C=C(C)[C@H](Cc1nc([C@@H]2CCCC[C@H]2CC)no1)OCC	ZINC000551533589	334253172	/nfs/dbraw/zinc/25/31/72/334253172.db2.gz	BPTXHBUHTBBTBX-KFWWJZLASA-N	0	0	292.423	4.277	20	30		CIEDRN
C=C1CCN(Cc2cnc(C3CCCCC3)s2)CC1	ZINC000552032710	334278904	/nfs/dbraw/zinc/27/89/04/334278904.db2.gz	HMNJZODZTXELCQ-UHFFFAOYSA-N	0	0	276.449	4.343	20	30		CIEDRN
C=C(C)CCc1noc(C2CC(c3cccc(F)c3)C2)n1	ZINC000552043856	334280508	/nfs/dbraw/zinc/28/05/08/334280508.db2.gz	UTGWTRWMWKNJJD-UHFFFAOYSA-N	0	0	286.350	4.379	20	30		CIEDRN
C=CCC[C@@H](Nc1ccc(OC(F)F)nc1)c1ccco1	ZINC000552054447	334282330	/nfs/dbraw/zinc/28/23/30/334282330.db2.gz	YKVNNIXPOWFSRL-GFCCVEGCSA-N	0	0	294.301	4.395	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)[C@@H](C)Cn1ccc2ccccc21	ZINC000552152383	334295638	/nfs/dbraw/zinc/29/56/38/334295638.db2.gz	ZZHBCWWJTFUBPN-JKSUJKDBSA-N	0	0	298.430	4.138	20	30		CIEDRN
C=CCC(C)(C)C(=O)NC[C@H]1CCCC[C@H]1C(F)(F)F	ZINC000552178706	334299561	/nfs/dbraw/zinc/29/95/61/334299561.db2.gz	MQRGQDXZYGCHNW-VXGBXAGGSA-N	0	0	291.357	4.074	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1coc2ccc(CC)cc21	ZINC000552230823	334306205	/nfs/dbraw/zinc/30/62/05/334306205.db2.gz	BNHSZOGOJARFLC-ZDUSSCGKSA-N	0	0	271.360	4.080	20	30		CIEDRN
Cc1cc2cc(CN(C)CC(C)(C)C#N)oc2cc1C	ZINC000552316621	334316090	/nfs/dbraw/zinc/31/60/90/334316090.db2.gz	HHHXMXFKGCVOJG-UHFFFAOYSA-N	0	0	270.376	4.031	20	30		CIEDRN
CC(C)CCOc1ccc(CN(C)CC(C)(C)C#N)cc1	ZINC000552316895	334316319	/nfs/dbraw/zinc/31/63/19/334316319.db2.gz	QZHUOQWJVILRSV-UHFFFAOYSA-N	0	0	288.435	4.093	20	30		CIEDRN
C=CCC[C@@H](C)Nc1ccc(F)cc1OC1CCOCC1	ZINC000552326495	334317314	/nfs/dbraw/zinc/31/73/14/334317314.db2.gz	UQXZYIKEKJVZIS-CYBMUJFWSA-N	0	0	293.382	4.150	20	30		CIEDRN
C[C@@H](CCC(C)(C)C)C(=O)NC1(c2cccc(C#N)c2)CC1	ZINC000552471379	334330151	/nfs/dbraw/zinc/33/01/51/334330151.db2.gz	NIVMGEDUBYRFSH-AWEZNQCLSA-N	0	0	298.430	4.126	20	30		CIEDRN
C=CCN(Cc1csc(CCc2ccccc2)n1)C1CC1	ZINC000552493140	334331724	/nfs/dbraw/zinc/33/17/24/334331724.db2.gz	XKODVUUCKJNZER-UHFFFAOYSA-N	0	0	298.455	4.079	20	30		CIEDRN
N#Cc1ccc(NC2CC2)c(NC(=O)C2CCCCCC2)c1	ZINC000552586560	334338002	/nfs/dbraw/zinc/33/80/02/334338002.db2.gz	LUJKMSJCYRHVAV-UHFFFAOYSA-N	0	0	297.402	4.041	20	30		CIEDRN
N#Cc1cc(Cl)ccc1NCC(C1CC1)C1CC1	ZINC000088457798	334338835	/nfs/dbraw/zinc/33/88/35/334338835.db2.gz	PXHNWAHLZGGIHL-UHFFFAOYSA-N	0	0	260.768	4.060	20	30		CIEDRN
CC#CCCCC(=O)N1CCC[C@](C)(c2ccccc2)CC1	ZINC000552833360	334347210	/nfs/dbraw/zinc/34/72/10/334347210.db2.gz	QLLAMEUMASDVOD-FQEVSTJZSA-N	0	0	297.442	4.150	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cccc(C2CCC2)c1	ZINC000552880066	334349126	/nfs/dbraw/zinc/34/91/26/334349126.db2.gz	PKGKGZKZRSHFFF-UHFFFAOYSA-N	0	0	257.377	4.495	20	30		CIEDRN
Cc1nsc(NCc2ccc(Cl)cc2Cl)c1C#N	ZINC000552893476	334349638	/nfs/dbraw/zinc/34/96/38/334349638.db2.gz	AVFNKWJNGATLAT-UHFFFAOYSA-N	0	0	298.198	4.242	20	30		CIEDRN
C=CCCc1csc(-c2cccc(NC(=O)C3CC3)c2)n1	ZINC000090065498	334356627	/nfs/dbraw/zinc/35/66/27/334356627.db2.gz	GLYWKRMQLMADER-UHFFFAOYSA-N	0	0	298.411	4.277	20	30		CIEDRN
CN(Cc1ccccc1-c1ccccc1)c1cc(C#N)ccn1	ZINC000553045016	334358394	/nfs/dbraw/zinc/35/83/94/334358394.db2.gz	TUHYJMKXRWSCAM-UHFFFAOYSA-N	0	0	299.377	4.257	20	30		CIEDRN
Cc1ccc(C#N)c(N[C@H](c2ccccc2C)C2CC2)n1	ZINC000553047755	334358632	/nfs/dbraw/zinc/35/86/32/334358632.db2.gz	QRALSTLIZHNODZ-KRWDZBQOSA-N	0	0	277.371	4.133	20	30		CIEDRN
CCC[C@H](CC)Sc1nccc(C#N)c1Cl	ZINC000553223931	334370093	/nfs/dbraw/zinc/37/00/93/334370093.db2.gz	HJSPBCKOICNXAH-JTQLQIEISA-N	0	0	254.786	4.277	20	30		CIEDRN
Cc1cc(Oc2nc(C3CC3)ns2)c(C)c(C)c1C#N	ZINC000553387340	334381832	/nfs/dbraw/zinc/38/18/32/334381832.db2.gz	APMDZJGJXCJASU-UHFFFAOYSA-N	0	0	285.372	4.005	20	30		CIEDRN
C=CCOc1ccc(Oc2c(F)cccc2[N+](=O)[O-])cc1	ZINC000553405688	334382927	/nfs/dbraw/zinc/38/29/27/334382927.db2.gz	XJSNUXHRGAXWKM-UHFFFAOYSA-N	0	0	289.262	4.091	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@H]1CCCc2sc(Cl)cc21	ZINC000553490762	334388126	/nfs/dbraw/zinc/38/81/26/334388126.db2.gz	QKPAMBUYHFTIAY-NHYWBVRUSA-N	0	0	297.851	4.497	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CCCc2sc(Cl)cc21	ZINC000553507375	334388963	/nfs/dbraw/zinc/38/89/63/334388963.db2.gz	HCIXFDXVEQHGGW-ZYHUDNBSSA-N	0	0	297.851	4.497	20	30		CIEDRN
N#Cc1cccnc1N(Cc1ccccc1Cl)CC1CC1	ZINC000553603349	334393189	/nfs/dbraw/zinc/39/31/89/334393189.db2.gz	AYJISTYSMUTISS-UHFFFAOYSA-N	0	0	297.789	4.023	20	30		CIEDRN
CC(C)(C)c1ccc(C2CCC(NC(=O)CC#N)CC2)cc1	ZINC000553635584	334394131	/nfs/dbraw/zinc/39/41/31/334394131.db2.gz	OUHMOEGEONKHFB-UHFFFAOYSA-N	0	0	298.430	4.040	20	30		CIEDRN
Cc1ccnc(N2C[C@@H](C)CC[C@@H]2c2ccccc2)c1C#N	ZINC000553675570	334395217	/nfs/dbraw/zinc/39/52/17/334395217.db2.gz	ZPTZZYDCSCAOMM-KBXCAEBGSA-N	0	0	291.398	4.239	20	30		CIEDRN
C=CCCCCNC(=O)N1C[C@@H](C)C[C@@H]1c1ccccc1	ZINC000553720140	334396669	/nfs/dbraw/zinc/39/66/69/334396669.db2.gz	QPKLPVNZZNSFHG-DOTOQJQBSA-N	0	0	286.419	4.135	20	30		CIEDRN
C[C@@H]1C[C@@H](c2ccccc2)N(c2ccc(C#N)cc2)C1	ZINC000553729190	334397308	/nfs/dbraw/zinc/39/73/08/334397308.db2.gz	WXSGDMCWYWCGED-KDOFPFPSSA-N	0	0	262.356	4.146	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](c2ccc(CC)cc2)C1	ZINC000554155045	334414610	/nfs/dbraw/zinc/41/46/10/334414610.db2.gz	FXISDXXHWZMVBE-MJGOQNOKSA-N	0	0	285.431	4.167	20	30		CIEDRN
C[C@H]1CC[C@]2(CCN(c3cc(C#N)c4ccccc4n3)C2)C1	ZINC000554620355	334443691	/nfs/dbraw/zinc/44/36/91/334443691.db2.gz	VEEKLQSHWCCOIR-LIRRHRJNSA-N	0	0	291.398	4.123	20	30		CIEDRN
C/C=C/c1ccc(NCc2ccc(F)c(C#N)c2)cc1	ZINC000554781187	334451984	/nfs/dbraw/zinc/45/19/84/334451984.db2.gz	MJKQDGJYKSDNTL-NSCUHMNNSA-N	0	0	266.319	4.343	20	30		CIEDRN
C=CCC1(C(=O)NCc2ccc3sccc3c2)CCC1	ZINC000555116967	334468898	/nfs/dbraw/zinc/46/88/98/334468898.db2.gz	GUAAQLGSINRJHJ-UHFFFAOYSA-N	0	0	285.412	4.264	20	30		CIEDRN
C=CCCS[C@@H](C)C(=O)N[C@H](C)c1ccc(Cl)cc1	ZINC000555428369	334478718	/nfs/dbraw/zinc/47/87/18/334478718.db2.gz	WKZWSOWDIWRYMA-NEPJUHHUSA-N	0	0	297.851	4.215	20	30		CIEDRN
CC(C)C[C@H](C)CC(=O)N[C@](C)(C#N)C1CCCCC1	ZINC000555904675	334491592	/nfs/dbraw/zinc/49/15/92/334491592.db2.gz	QGYRXAWJFZPFIO-WMLDXEAASA-N	0	0	278.440	4.037	20	30		CIEDRN
C=C[C@@H](CC(=O)N[C@H]1CC2CCC1CC2)c1ccccc1	ZINC000556077711	334494368	/nfs/dbraw/zinc/49/43/68/334494368.db2.gz	JNRHYVVMCCZBLO-LSCKAKRGSA-N	0	0	283.415	4.041	20	30		CIEDRN
C=C(CC)CSCc1ccc(C(F)(F)F)cn1	ZINC000556295413	334507262	/nfs/dbraw/zinc/50/72/62/334507262.db2.gz	NIPTZLMHRNHULR-UHFFFAOYSA-N	0	0	261.312	4.300	20	30		CIEDRN
C=CCCCN(C)C(=O)c1occc1-c1ccc(F)cc1	ZINC000153100048	334554749	/nfs/dbraw/zinc/55/47/49/334554749.db2.gz	LYDMIABSZWLBNV-UHFFFAOYSA-N	0	0	287.334	4.124	20	30		CIEDRN
C[C@@H](CC(=O)N[C@H](CCC#N)c1ccccc1)C(C)(C)C	ZINC000153257936	334576907	/nfs/dbraw/zinc/57/69/07/334576907.db2.gz	FRWXRWVNMYPMIL-GOEBONIOSA-N	0	0	286.419	4.220	20	30		CIEDRN
C=CCCCN(C)C(=O)CCCc1ccc(SC)cc1	ZINC000565952414	334611469	/nfs/dbraw/zinc/61/14/69/334611469.db2.gz	SYUPGCUNACBBTB-UHFFFAOYSA-N	0	0	291.460	4.156	20	30		CIEDRN
Cc1oc(C#N)cc1C(=O)Nc1cccc(Cl)c1Cl	ZINC000566893848	334668433	/nfs/dbraw/zinc/66/84/33/334668433.db2.gz	AIPWIGKQLSPHAB-UHFFFAOYSA-N	0	0	295.125	4.019	20	30		CIEDRN
CC(C)C[C@@H](C)CC(=O)N[C@H](CCC#N)c1ccccc1	ZINC000153724833	334678327	/nfs/dbraw/zinc/67/83/27/334678327.db2.gz	KWBPJGPWZHSOQP-NVXWUHKLSA-N	0	0	286.419	4.220	20	30		CIEDRN
Cc1[nH]c(C#N)cc1C(=O)Nc1ccccc1CCC(C)C	ZINC000567069977	334678507	/nfs/dbraw/zinc/67/85/07/334678507.db2.gz	YPYFQQZLTBAQGV-UHFFFAOYSA-N	0	0	295.386	4.036	20	30		CIEDRN
Cc1nsc(Oc2cc(Cl)ccc2Cl)c1C#N	ZINC000567077209	334679119	/nfs/dbraw/zinc/67/91/19/334679119.db2.gz	RFEPUHZKEJHPLG-UHFFFAOYSA-N	0	0	285.155	4.422	20	30		CIEDRN
C=CCN(C(=O)c1ccc(C#N)c(Cl)c1)c1ccccc1	ZINC000154152722	334689210	/nfs/dbraw/zinc/68/92/10/334689210.db2.gz	IWTZBNCKSRDTQD-UHFFFAOYSA-N	0	0	296.757	4.044	20	30		CIEDRN
CC(C)CC1(C(=O)N(C)Cc2ccc(C#N)cc2)CCCC1	ZINC000154446717	334694405	/nfs/dbraw/zinc/69/44/05/334694405.db2.gz	SQKXGTXPUOJJET-UHFFFAOYSA-N	0	0	298.430	4.123	20	30		CIEDRN
N#CCc1ccnc(NCc2cccc(Cl)c2Cl)c1	ZINC000567256201	334698321	/nfs/dbraw/zinc/69/83/21/334698321.db2.gz	VGGWMZARNOQOJU-UHFFFAOYSA-N	0	0	292.169	4.067	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@@H](C(C)(C)C)C[C@@H]1C	ZINC000567304806	334702394	/nfs/dbraw/zinc/70/23/94/334702394.db2.gz	NCUMZFXADHYVDX-GOEBONIOSA-N	0	0	277.452	4.428	20	30		CIEDRN
C=C[C@@H](CC(=O)NCc1ccc(C)s1)c1ccccc1	ZINC000154734748	334703907	/nfs/dbraw/zinc/70/39/07/334703907.db2.gz	SMHPDGKMOPERMF-AWEZNQCLSA-N	0	0	285.412	4.033	20	30		CIEDRN
C=CCCSCC(=O)N[C@H](c1cccs1)C(C)(C)C	ZINC000154976425	334709573	/nfs/dbraw/zinc/70/95/73/334709573.db2.gz	IEPJNRNSHFMRII-CQSZACIVSA-N	0	0	297.489	4.261	20	30		CIEDRN
CC[C@@H](CC#N)NC(=O)Nc1ccccc1-c1ccccc1	ZINC000155514304	334722701	/nfs/dbraw/zinc/72/27/01/334722701.db2.gz	JYCGPXGTPCCWRB-HNNXBMFYSA-N	0	0	293.370	4.167	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Nc1ccc(F)cc1C	ZINC000157749676	334783019	/nfs/dbraw/zinc/78/30/19/334783019.db2.gz	FYLHPMQJODDPGK-UHFFFAOYSA-N	0	0	278.371	4.344	20	30		CIEDRN
Cc1nnc(Oc2ccc(C3CC3)cc2Cl)c(C#N)c1C	ZINC000568036704	334786514	/nfs/dbraw/zinc/78/65/14/334786514.db2.gz	QUGRHDANWMJWLZ-UHFFFAOYSA-N	0	0	299.761	4.288	20	30		CIEDRN
CC(C)(C)c1cccc(C(=O)Nc2cccc(CC#N)c2)c1	ZINC000568105362	334792695	/nfs/dbraw/zinc/79/26/95/334792695.db2.gz	SQAJSSDWDFVBDP-UHFFFAOYSA-N	0	0	292.382	4.302	20	30		CIEDRN
CC[C@@H](CC(=O)Nc1scc(C)c1C#N)c1ccccc1	ZINC000568134813	334795305	/nfs/dbraw/zinc/79/53/05/334795305.db2.gz	JGAKTEQDAWMELY-ZDUSSCGKSA-N	0	0	298.411	4.451	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1nc(C2CC2)cs1)c1ccccc1	ZINC000158731155	334812395	/nfs/dbraw/zinc/81/23/95/334812395.db2.gz	DFYQRHHFCSTKKA-GFCCVEGCSA-N	0	0	298.411	4.319	20	30		CIEDRN
N#Cc1cccc(SCc2nc3ccc(F)cc3o2)c1	ZINC000158785391	334813918	/nfs/dbraw/zinc/81/39/18/334813918.db2.gz	QGEMQNNKLARTON-UHFFFAOYSA-N	0	0	284.315	4.131	20	30		CIEDRN
N#Cc1c(Cl)cccc1SCCOc1ccccc1	ZINC000569030166	334852199	/nfs/dbraw/zinc/85/21/99/334852199.db2.gz	HKKJTJZSVJLXAX-UHFFFAOYSA-N	0	0	289.787	4.383	20	30		CIEDRN
CC[C@H]1CCCC[C@H]1c1noc(C2(C#N)CCCCC2)n1	ZINC000569126358	334856937	/nfs/dbraw/zinc/85/69/37/334856937.db2.gz	IQKGSQXPWFWJHJ-UONOGXRCSA-N	0	0	287.407	4.479	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2ccc(COCC)cc2)no1	ZINC000569170249	334858817	/nfs/dbraw/zinc/85/88/17/334858817.db2.gz	QAAGIPAEEODZJK-CYBMUJFWSA-N	0	0	286.375	4.343	20	30		CIEDRN
CCS[C@@H]1CCC[C@H]1Nc1nc(C)c(C#N)cc1Cl	ZINC000336815923	334913677	/nfs/dbraw/zinc/91/36/77/334913677.db2.gz	JTCPTCYOUUHUAU-CHWSQXEVSA-N	0	0	295.839	4.001	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2ccccc2COCC)no1	ZINC000576312048	335188201	/nfs/dbraw/zinc/18/82/01/335188201.db2.gz	GOOIQIKDPUFUJJ-CYBMUJFWSA-N	0	0	286.375	4.343	20	30		CIEDRN
C[C@@H](Sc1cccc(F)c1C#N)C(=O)c1ccccc1	ZINC000576539890	335216852	/nfs/dbraw/zinc/21/68/52/335216852.db2.gz	JFJFZGKSRFWACP-LLVKDONJSA-N	0	0	285.343	4.061	20	30		CIEDRN
C=CCCC1(C(=O)NC[C@@H]2CCCCC(F)(F)C2)CC1	ZINC000576537258	335216892	/nfs/dbraw/zinc/21/68/92/335216892.db2.gz	DBMQLJBTVQZJLM-CYBMUJFWSA-N	0	0	285.378	4.065	20	30		CIEDRN
Cc1cc(NCc2c(Cl)cccc2Cl)cc(C#N)n1	ZINC000576615826	335226720	/nfs/dbraw/zinc/22/67/20/335226720.db2.gz	GZUFYZLGEZBHBP-UHFFFAOYSA-N	0	0	292.169	4.181	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1C[C@H](c2ccccc2)[C@H]2CCC[C@@H]21	ZINC000576689917	335235061	/nfs/dbraw/zinc/23/50/61/335235061.db2.gz	HVYMYMWRXPKOFY-AITUJVMLSA-N	0	0	297.442	4.383	20	30		CIEDRN
C=CC1CCN(C(=O)c2c(Cl)cccc2Cl)CC1	ZINC000176275963	335255970	/nfs/dbraw/zinc/25/59/70/335255970.db2.gz	CKYUKGHLIYKGBT-UHFFFAOYSA-N	0	0	284.186	4.032	20	30		CIEDRN
C[C@@H]1C[C@H](CC(=O)Nc2ccccc2C#N)CC(C)(C)C1	ZINC000576890966	335261391	/nfs/dbraw/zinc/26/13/91/335261391.db2.gz	HNSJBBAVAFHXSO-ZIAGYGMSSA-N	0	0	284.403	4.349	20	30		CIEDRN
CC(C)c1ccc(NC(=O)NC[C@@H](C)C#N)c(C(C)C)c1	ZINC000176359164	335264538	/nfs/dbraw/zinc/26/45/38/335264538.db2.gz	SBTGKKXFZPRLBU-ZDUSSCGKSA-N	0	0	287.407	4.215	20	30		CIEDRN
CC#CCCCC(=O)N1CCC[C@@H](c2ccc(CC)cc2)C1	ZINC000580562092	335282183	/nfs/dbraw/zinc/28/21/83/335282183.db2.gz	LYYYAKIPLJWYKY-LJQANCHMSA-N	0	0	297.442	4.149	20	30		CIEDRN
C=C(C)CCc1noc([C@H]2CC[C@H](C(F)(F)F)C2)n1	ZINC000577025783	335283783	/nfs/dbraw/zinc/28/37/83/335283783.db2.gz	SVLLVNWMHDZTAI-UWVGGRQHSA-N	0	0	274.286	4.024	20	30		CIEDRN
Cc1nc(CSCc2ccccc2C(C)(C)C#N)co1	ZINC000577077222	335296489	/nfs/dbraw/zinc/29/64/89/335296489.db2.gz	PEJONFUEVCGDBM-UHFFFAOYSA-N	0	0	286.400	4.218	20	30		CIEDRN
COc1cc(CNc2ccc(Cl)cc2C)ccc1C#N	ZINC000380016106	335296729	/nfs/dbraw/zinc/29/67/29/335296729.db2.gz	FOYAQJKYIWHODZ-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cccc(-c2ncco2)c1C	ZINC000577307579	335337651	/nfs/dbraw/zinc/33/76/51/335337651.db2.gz	RZFRHUYFMDWTMN-UHFFFAOYSA-N	0	0	296.370	4.357	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(-c2cc(C)ccc2F)no1	ZINC000577323832	335338810	/nfs/dbraw/zinc/33/88/10/335338810.db2.gz	MGCYXVMMCHOIRT-OAHLLOKOSA-N	0	0	260.312	4.038	20	30		CIEDRN
Cc1ccc(NCc2ccc(C#N)s2)cc1OC(F)F	ZINC000176970362	335348965	/nfs/dbraw/zinc/34/89/65/335348965.db2.gz	YBARYYZIDZCLRA-UHFFFAOYSA-N	0	0	294.326	4.142	20	30		CIEDRN
CC[C@H](CC1CCCCC1)C(=O)NCC(C)(C)CCC#N	ZINC000577650891	335386096	/nfs/dbraw/zinc/38/60/96/335386096.db2.gz	MFNNQKIBBGGKSA-MRXNPFEDSA-N	0	0	292.467	4.429	20	30		CIEDRN
CCSc1cccc(NCc2ccc(OC)c(C#N)c2)c1	ZINC000178234730	335422839	/nfs/dbraw/zinc/42/28/39/335422839.db2.gz	WNPMFSGDQTYKJG-UHFFFAOYSA-N	0	0	298.411	4.291	20	30		CIEDRN
CC[C@@H](NCc1ccccc1C#N)c1cc(F)ccc1F	ZINC000179093158	335472922	/nfs/dbraw/zinc/47/29/22/335472922.db2.gz	DYSPHNXPRKBVAM-QGZVFWFLSA-N	0	0	286.325	4.077	20	30		CIEDRN
Cc1cc(Cl)c(C(=O)Nc2sccc2C#N)cc1C	ZINC000180283380	335566784	/nfs/dbraw/zinc/56/67/84/335566784.db2.gz	SVCAWAUJIXTOIW-UHFFFAOYSA-N	0	0	290.775	4.142	20	30		CIEDRN
C=CCCCCSc1nncn1[C@@H](C)c1ccccc1	ZINC000578310504	335599183	/nfs/dbraw/zinc/59/91/83/335599183.db2.gz	NQLKBGWRCFUKJZ-AWEZNQCLSA-N	0	0	287.432	4.336	20	30		CIEDRN
C[C@@H](CCC(C)(C)C)NC(=O)c1ccc(C2(C#N)CC2)cc1	ZINC000180928868	335629845	/nfs/dbraw/zinc/62/98/45/335629845.db2.gz	WUGYJYJMOKURAO-AWEZNQCLSA-N	0	0	298.430	4.186	20	30		CIEDRN
C=CCCCCSc1nnc(-c2ccccc2C)o1	ZINC000578428294	335632930	/nfs/dbraw/zinc/63/29/30/335632930.db2.gz	YOMBPJLIRFNACD-UHFFFAOYSA-N	0	0	274.389	4.493	20	30		CIEDRN
Cc1ccc(C#N)c(SC[C@H](C)c2ccccc2)n1	ZINC000578747827	335669349	/nfs/dbraw/zinc/66/93/49/335669349.db2.gz	SEISDDRTNYNRSO-LBPRGKRZSA-N	0	0	268.385	4.158	20	30		CIEDRN
C=CCCCCNC(=O)Nc1cc(C)c(OC)cc1Cl	ZINC000578914209	335689318	/nfs/dbraw/zinc/68/93/18/335689318.db2.gz	KGXAJRLGHVNREL-UHFFFAOYSA-N	0	0	296.798	4.135	20	30		CIEDRN
C[C@H](c1noc(C2(c3ccc(C#N)cc3)CC2)n1)C(C)(C)C	ZINC000578989591	335696438	/nfs/dbraw/zinc/69/64/38/335696438.db2.gz	YCXLZXDHRIXVRK-GFCCVEGCSA-N	0	0	295.386	4.171	20	30		CIEDRN
Cc1cnc([C@@H](N[C@@H](C)c2cccc(C#N)c2)C2CC2)s1	ZINC000181820638	335786821	/nfs/dbraw/zinc/78/68/21/335786821.db2.gz	OAJFLNXHNWRZCN-LRDDRELGSA-N	0	0	297.427	4.125	20	30		CIEDRN
CSc1c(F)cc(NCc2cccc(C#N)c2)cc1F	ZINC000181875345	335789290	/nfs/dbraw/zinc/78/92/90/335789290.db2.gz	YADVYUVUDMQNAE-UHFFFAOYSA-N	0	0	290.338	4.170	20	30		CIEDRN
C=CCCC(=O)Nc1sc(-c2ccccc2)nc1C	ZINC000182108685	335799365	/nfs/dbraw/zinc/79/93/65/335799365.db2.gz	ZKCBREPLXBGGAF-UHFFFAOYSA-N	0	0	272.373	4.023	20	30		CIEDRN
C=CCC[C@H](Nc1ccc(NC(=O)CC)cc1)C1CC1	ZINC000182223992	335804929	/nfs/dbraw/zinc/80/49/29/335804929.db2.gz	YIEORHCCZFRAOO-INIZCTEOSA-N	0	0	272.392	4.192	20	30		CIEDRN
C[C@@H](CC#N)N(C)C(=O)N(c1ccccc1)c1ccccc1	ZINC000182534894	335825823	/nfs/dbraw/zinc/82/58/23/335825823.db2.gz	ASJPAUNNGUHBDH-HNNXBMFYSA-N	0	0	293.370	4.179	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)C[C@@H](C)c1cccc(OC)c1	ZINC000182640025	335832918	/nfs/dbraw/zinc/83/29/18/335832918.db2.gz	XFIKQHFEOIKWTJ-HUUCEWRRSA-N	0	0	289.419	4.050	20	30		CIEDRN
C=CC[C@H]1N(C(=O)c2cc(C)c(C)o2)CCCC1(C)C	ZINC000579677057	335854060	/nfs/dbraw/zinc/85/40/60/335854060.db2.gz	UOXVLSOEXSVFBW-OAHLLOKOSA-N	0	0	275.392	4.103	20	30		CIEDRN
N#CCc1cccc(Br)c1OCC1CCCC1	ZINC000579778377	335881678	/nfs/dbraw/zinc/88/16/78/335881678.db2.gz	RBXQPADQSAOLSB-UHFFFAOYSA-N	0	0	294.192	4.084	20	30		CIEDRN
CSc1c(F)cc(NCC(C)(C)CCC#N)cc1F	ZINC000184176672	335919883	/nfs/dbraw/zinc/91/98/83/335919883.db2.gz	HLHKJVCXGHYFQN-UHFFFAOYSA-N	0	0	284.375	4.429	20	30		CIEDRN
CSc1c(F)cc(NCc2ccc(C#N)s2)cc1F	ZINC000184176989	335920120	/nfs/dbraw/zinc/92/01/20/335920120.db2.gz	DEUUNORTAZVFTC-UHFFFAOYSA-N	0	0	296.367	4.232	20	30		CIEDRN
C=CC[C@H](C)NC(=O)CCCc1cccc(C(F)(F)F)c1	ZINC000184561578	335928803	/nfs/dbraw/zinc/92/88/03/335928803.db2.gz	IZZMSUOVUMLWQE-LBPRGKRZSA-N	0	0	299.336	4.109	20	30		CIEDRN
CCC[C@@H](CC1CCCC1)C(=O)N1CCC(CC#N)CC1	ZINC000579937006	335931862	/nfs/dbraw/zinc/93/18/62/335931862.db2.gz	GFZVGRFSTOORPQ-KRWDZBQOSA-N	0	0	290.451	4.135	20	30		CIEDRN
CC[C@H](C)N(C(=O)c1cc(C#N)ccc1Cl)[C@@H](C)CC	ZINC000581035556	335999329	/nfs/dbraw/zinc/99/93/29/335999329.db2.gz	WWRQLFKHADLKKP-RYUDHWBXSA-N	0	0	292.810	4.251	20	30		CIEDRN
C=CCCCNC(=O)c1coc2ccc(C(C)C)cc21	ZINC000581088536	336007279	/nfs/dbraw/zinc/00/72/79/336007279.db2.gz	FWLKMBFAKVXPTJ-UHFFFAOYSA-N	0	0	271.360	4.252	20	30		CIEDRN
CC[C@@H](CC#N)NCc1c(OC(C)C)ccc2ccccc21	ZINC000581123896	336011229	/nfs/dbraw/zinc/01/12/29/336011229.db2.gz	RUNVCMUUZZLQFM-INIZCTEOSA-N	0	0	296.414	4.409	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)Nc1cccc(CSC)c1	ZINC000581169015	336018461	/nfs/dbraw/zinc/01/84/61/336018461.db2.gz	KQCHTYULGGQQQV-UHFFFAOYSA-N	0	0	292.448	4.273	20	30		CIEDRN
CC[C@](C)(C#N)c1nc(-c2ccc3sccc3c2)no1	ZINC000581276267	336035695	/nfs/dbraw/zinc/03/56/95/336035695.db2.gz	BDPMYZMYWLBLRS-OAHLLOKOSA-N	0	0	283.356	4.143	20	30		CIEDRN
Cc1nc(Oc2cccc(Cl)c2)c(Cl)cc1C#N	ZINC000380942616	336040335	/nfs/dbraw/zinc/04/03/35/336040335.db2.gz	MSQKDRZRKACZLH-UHFFFAOYSA-N	0	0	279.126	4.361	20	30		CIEDRN
C=CCCCCCNc1ccc(NC(=O)C2CC2)cc1	ZINC000195447408	336053884	/nfs/dbraw/zinc/05/38/84/336053884.db2.gz	UHVJBMRLXARVFO-UHFFFAOYSA-N	0	0	272.392	4.193	20	30		CIEDRN
N#Cc1ccc(Cl)cc1NC[C@@H]1CCCCC1(F)F	ZINC000381525012	336067381	/nfs/dbraw/zinc/06/73/81/336067381.db2.gz	NSPDXFYAPJLFCG-NSHDSACASA-N	0	0	284.737	4.449	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2ccc(F)cc2F)no1	ZINC000581479690	336086485	/nfs/dbraw/zinc/08/64/85/336086485.db2.gz	UDPLJTASUKMOLD-VIFPVBQESA-N	0	0	264.275	4.085	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2ccc(F)cc2F)no1	ZINC000581479689	336086580	/nfs/dbraw/zinc/08/65/80/336086580.db2.gz	UDPLJTASUKMOLD-SECBINFHSA-N	0	0	264.275	4.085	20	30		CIEDRN
C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cscn1	ZINC000581839215	336150537	/nfs/dbraw/zinc/15/05/37/336150537.db2.gz	WAXROGBZNAPXAX-UKRRQHHQSA-N	0	0	285.416	4.229	20	30		CIEDRN
Cc1cc(Oc2ccc(C#N)c(C)n2)ccc1Cl	ZINC000385615330	336152755	/nfs/dbraw/zinc/15/27/55/336152755.db2.gz	OQDBTFFMAGVYPZ-UHFFFAOYSA-N	0	0	258.708	4.016	20	30		CIEDRN
C[C@@H](Nc1ccc(C#N)c(Cl)c1)c1ccc2n[nH]cc2c1	ZINC000581961390	336179866	/nfs/dbraw/zinc/17/98/66/336179866.db2.gz	WSVSBAJQXFUWRW-SNVBAGLBSA-N	0	0	296.761	4.261	20	30		CIEDRN
Cc1ccccc1CN(C)c1c(C#N)cnc2ccccc21	ZINC000386953154	336182801	/nfs/dbraw/zinc/18/28/01/336182801.db2.gz	UICDSWPYVULMEJ-UHFFFAOYSA-N	0	0	287.366	4.051	20	30		CIEDRN
CC(C)c1ccc(CNc2nc3c(cc2C#N)CCC3)cc1	ZINC000387240903	336190078	/nfs/dbraw/zinc/19/00/78/336190078.db2.gz	BFYKVVAVSGONIY-UHFFFAOYSA-N	0	0	291.398	4.177	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)[C@@H]2CC3CCC2CC3)cc1	ZINC000582017724	336192928	/nfs/dbraw/zinc/19/29/28/336192928.db2.gz	ZNLOHRJPFCNSFQ-MQBCKMQZSA-N	0	0	296.414	4.253	20	30		CIEDRN
C[C@H]1CC[C@H](C(=O)Nc2nc(C3CCOCC3)cs2)C1	ZINC000329211253	533738323	/nfs/dbraw/zinc/73/83/23/533738323.db2.gz	GXPHGEPXBDRNRE-JQWIXIFHSA-N	0	0	294.420	4.061	20	30		CIEDRN
C[C@@H]1C[C@@H]1[C@@H](Nc1ncccc1C#N)c1ccc(Cl)cc1	ZINC000301468052	533741522	/nfs/dbraw/zinc/74/15/22/533741522.db2.gz	RDIVBRCJQCNPRU-RLCCDNCMSA-N	0	0	297.789	4.416	20	30		CIEDRN
C[C@@H]1CCC[C@@H](CCNC(=O)Cc2ccc3n[nH]cc3c2)C1	ZINC000330011863	533742972	/nfs/dbraw/zinc/74/29/72/533742972.db2.gz	JPTGTMGPJSQCSC-KGLIPLIRSA-N	0	0	299.418	4.278	20	30		CIEDRN
COc1cccc([C@H]2CCCN2c2ccc(C#N)cc2F)c1	ZINC000301496270	533792649	/nfs/dbraw/zinc/79/26/49/533792649.db2.gz	BDWYABONEDTDGL-QGZVFWFLSA-N	0	0	296.345	4.047	20	30		CIEDRN
C[C@@H]1CCC[C@H](c2noc([C@]3(C#N)CC34CCCC4)n2)C1	ZINC000333788828	533882917	/nfs/dbraw/zinc/88/29/17/533882917.db2.gz	CYDZMLSNHZTRGO-IIYDPXPESA-N	0	0	285.391	4.089	20	30		CIEDRN
C[C@H](NCc1nc(C#N)cs1)c1cc2ccccc2s1	ZINC000352841904	533940724	/nfs/dbraw/zinc/94/07/24/533940724.db2.gz	UAZBYTIDMFOSDP-JTQLQIEISA-N	0	0	299.424	4.080	20	30		CIEDRN
Cc1c2ccccc2oc1[C@@H](C)NC(=O)C[C@H]1CCOC1	ZINC000330033848	533979861	/nfs/dbraw/zinc/97/98/61/533979861.db2.gz	ANVAJAOYGTYNNX-CHWSQXEVSA-N	0	0	287.359	4.185	20	30		CIEDRN
C[C@H](SCC1(C#N)CC1)c1cc(F)ccc1F	ZINC000344488942	534124167	/nfs/dbraw/zinc/12/41/67/534124167.db2.gz	XEGAJNKCUGDFER-VIFPVBQESA-N	0	0	253.317	4.063	20	30		CIEDRN
C[C@@H]1CCCC[C@@H]1c1noc([C@@]2(C#N)CC23CCCC3)n1	ZINC000333784632	534166992	/nfs/dbraw/zinc/16/69/92/534166992.db2.gz	CEXYENVKWZBOGR-IGCXYCKISA-N	0	0	285.391	4.089	20	30		CIEDRN
C[C@@H]1OCC[C@@H]1C(=O)Nc1ncc(C2CCCCC2)s1	ZINC000329461670	534173157	/nfs/dbraw/zinc/17/31/57/534173157.db2.gz	PXRZFTGDKRSXNC-JQWIXIFHSA-N	0	0	294.420	4.204	20	30		CIEDRN
C[C@@H]1CC[C@H](C(=O)Nc2nc(C3CCOCC3)cs2)C1	ZINC000329211254	534216215	/nfs/dbraw/zinc/21/62/15/534216215.db2.gz	GXPHGEPXBDRNRE-PWSUYJOCSA-N	0	0	294.420	4.061	20	30		CIEDRN
Cc1ccc(-c2ncco2)cc1N[C@@H]1CCC[C@H](C#N)C1	ZINC000335310933	534222253	/nfs/dbraw/zinc/22/22/53/534222253.db2.gz	DRPNBUZDGIEAOK-DZGCQCFKSA-N	0	0	281.359	4.144	20	30		CIEDRN
Cc1ccc(-c2nnco2)cc1NC(=O)[C@@H]1CC12CCCC2	ZINC000329989998	534227415	/nfs/dbraw/zinc/22/74/15/534227415.db2.gz	IOWUHQOPBMPXFE-ZDUSSCGKSA-N	0	0	297.358	4.213	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1nc(C(C)(C)C)cs1	ZINC000485597141	517341497	/nfs/dbraw/zinc/34/14/97/517341497.db2.gz	HSRWKGKJXBBDEE-LLVKDONJSA-N	0	0	293.436	4.013	20	30		CIEDRN
CCCN(CC#N)Cc1ccc(-c2ccccc2)cc1F	ZINC000507815715	517576920	/nfs/dbraw/zinc/57/69/20/517576920.db2.gz	PNERXXZTKDAEDB-UHFFFAOYSA-N	0	0	282.362	4.228	20	30		CIEDRN
CCC[C@@H](CC)S[C@H](C)C(=O)Nc1ccccc1C#N	ZINC000477055968	517600689	/nfs/dbraw/zinc/60/06/89/517600689.db2.gz	IHTKITMSZRFYGI-TZMCWYRMSA-N	0	0	290.432	4.197	20	30		CIEDRN
Cc1noc(C)c1C(C)(C)C(=O)N[C@@H]1CC12CCCCC2	ZINC000330268393	534323735	/nfs/dbraw/zinc/32/37/35/534323735.db2.gz	IPPXHMANFNEKOM-CYBMUJFWSA-N	0	0	290.407	4.248	20	30		CIEDRN
C[C@@H](NCc1ccccc1C#N)c1cc2cccc(F)c2o1	ZINC000473986704	518178152	/nfs/dbraw/zinc/17/81/52/518178152.db2.gz	ALTDBTKWIDPLDB-GFCCVEGCSA-N	0	0	294.329	4.294	20	30		CIEDRN
C=C(C)CN(C)C(=O)C12CC3C[C@@](C)(C1)C[C@](C)(C3)C2	ZINC000055061108	518589627	/nfs/dbraw/zinc/58/96/27/518589627.db2.gz	MWCLFOXOEKGJSQ-JGAFYBCUSA-N	0	0	275.436	4.018	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(C(=O)CC)ccc1Cl	ZINC000279742544	518635516	/nfs/dbraw/zinc/63/55/16/518635516.db2.gz	TZDJWILLFMNMMW-NSHDSACASA-N	0	0	293.794	4.474	20	30		CIEDRN
C=CCC[C@@H](C(=O)N(C)c1ncccc1C)c1ccccc1	ZINC000279665950	518710937	/nfs/dbraw/zinc/71/09/37/518710937.db2.gz	LFGKCNCUDKZJFG-QGZVFWFLSA-N	0	0	294.398	4.103	20	30		CIEDRN
CC(C)[C@H](c1ccccc1)N(C)C(=O)c1cc(C#N)cs1	ZINC000084110503	519824081	/nfs/dbraw/zinc/82/40/81/519824081.db2.gz	YDVGGYVRWXUDOC-MRXNPFEDSA-N	0	0	298.411	4.089	20	30		CIEDRN
CC(C)c1cccc(N(C)C(=O)c2cc(C#N)cs2)c1	ZINC000084086560	519841496	/nfs/dbraw/zinc/84/14/96/519841496.db2.gz	GKNPMBAZCDYJNT-UHFFFAOYSA-N	0	0	284.384	4.020	20	30		CIEDRN
CC(C)n1ccnc1S[C@@H](C)c1cccc(C#N)c1	ZINC000275945852	520036152	/nfs/dbraw/zinc/03/61/52/520036152.db2.gz	DCOFKNFGUOAGTR-LBPRGKRZSA-N	0	0	271.389	4.189	20	30		CIEDRN
CCN(C(=O)c1cc(C)cs1)[C@H](C)c1ccc(C#N)cc1	ZINC000294395031	520062950	/nfs/dbraw/zinc/06/29/50/520062950.db2.gz	DLHUNQXZPFMOMB-CYBMUJFWSA-N	0	0	298.411	4.152	20	30		CIEDRN
Cc1ccsc1CNc1ccc(Cl)cc1C#N	ZINC000112750191	534475461	/nfs/dbraw/zinc/47/54/61/534475461.db2.gz	FEHVQXJWVKYOSY-UHFFFAOYSA-N	0	0	262.765	4.194	20	30		CIEDRN
Cc1c[nH]c(-c2ccccc2NC(=O)[C@@H]2C[C@H]2C2CC2)n1	ZINC000330220803	534517451	/nfs/dbraw/zinc/51/74/51/534517451.db2.gz	LCBRLBXWEVSSMZ-UONOGXRCSA-N	0	0	281.359	4.019	20	30		CIEDRN
Cc1c[nH]c(-c2ccccc2NC(=O)[C@H]2C[C@@H]2C2CC2)n1	ZINC000330220802	534520515	/nfs/dbraw/zinc/52/05/15/534520515.db2.gz	LCBRLBXWEVSSMZ-KGLIPLIRSA-N	0	0	281.359	4.019	20	30		CIEDRN
Cc1oc2ccc(NC(=O)[C@]3(C)CCOC3)cc2c1C	ZINC000330040002	534550868	/nfs/dbraw/zinc/55/08/68/534550868.db2.gz	CBCYXQISUMUDIO-MRXNPFEDSA-N	0	0	273.332	4.064	20	30		CIEDRN
CCC1(CC)CCN(c2snc(Cl)c2C#N)CC1	ZINC000302519845	521688183	/nfs/dbraw/zinc/68/81/83/521688183.db2.gz	YQBNHNIPIQUTBE-UHFFFAOYSA-N	0	0	283.828	4.075	20	30		CIEDRN
CCS[C@@H]1CCC[C@H]1Nc1ccc(C#N)c(Cl)c1	ZINC000226127674	521726620	/nfs/dbraw/zinc/72/66/20/521726620.db2.gz	BPKRBGYEWSGLNT-ZIAGYGMSSA-N	0	0	280.824	4.298	20	30		CIEDRN
Cc1sc(CNc2ccc(C#N)cc2)nc1C(C)C	ZINC000347193605	534607532	/nfs/dbraw/zinc/60/75/32/534607532.db2.gz	JGKVKLBKORWFBE-UHFFFAOYSA-N	0	0	271.389	4.059	20	30		CIEDRN
Cc1cnc([C@@H](Nc2cccc(F)c2C#N)C2CC2)s1	ZINC000301374862	534626909	/nfs/dbraw/zinc/62/69/09/534626909.db2.gz	VIYPKNXGBNNSCL-AWEZNQCLSA-N	0	0	287.363	4.026	20	30		CIEDRN
CCc1nc([C@@H](C)N[C@H](CC)c2ccc(C#N)cc2)cs1	ZINC000278827121	522423294	/nfs/dbraw/zinc/42/32/94/522423294.db2.gz	SYBYSWYCHAJTJG-IUODEOHRSA-N	0	0	299.443	4.379	20	30		CIEDRN
CC[C@H](Nc1cccc(COC)c1)c1ccc(C#N)cc1	ZINC000278389619	522771348	/nfs/dbraw/zinc/77/13/48/522771348.db2.gz	DRBOZTKWZWGBJG-SFHVURJKSA-N	0	0	280.371	4.268	20	30		CIEDRN
CC[C@@H](Nc1cccc(COC)c1)c1ccc(C#N)cc1	ZINC000278389616	522960942	/nfs/dbraw/zinc/96/09/42/522960942.db2.gz	DRBOZTKWZWGBJG-GOSISDBHSA-N	0	0	280.371	4.268	20	30		CIEDRN
CN(Cc1sccc1Cl)Cc1cc(C#N)ccc1F	ZINC000338546460	523616252	/nfs/dbraw/zinc/61/62/52/523616252.db2.gz	ODNHFFFSTJDGNN-UHFFFAOYSA-N	0	0	294.782	4.044	20	30		CIEDRN
Cc1ccc(C)c(N(C(=O)c2cccc(C#N)c2)C(C)C)c1	ZINC000263956347	524113174	/nfs/dbraw/zinc/11/31/74/524113174.db2.gz	YHLGREZPOCZTOH-UHFFFAOYSA-N	0	0	292.382	4.230	20	30		CIEDRN
C[C@@H]1CC[C@H](CC(=O)N(C)c2cc(Cl)ccc2C#N)C1	ZINC000156793861	524658804	/nfs/dbraw/zinc/65/88/04/524658804.db2.gz	JVTRKFCFZLAZJP-NEPJUHHUSA-N	0	0	290.794	4.001	20	30		CIEDRN
C[C@H](NCc1nc(C(C)(C)C)cs1)c1ccc(C#N)cc1	ZINC000094965501	525487349	/nfs/dbraw/zinc/48/73/49/525487349.db2.gz	RHNSFFFCXBTCHW-LBPRGKRZSA-N	0	0	299.443	4.163	20	30		CIEDRN
Cc1cc([C@H](C)NC(=O)c2ccc(C#N)cc2C)c(C)s1	ZINC000161234973	525514097	/nfs/dbraw/zinc/51/40/97/525514097.db2.gz	FUHSTEGJBBFQAO-LBPRGKRZSA-N	0	0	298.411	4.036	20	30		CIEDRN
C[C@@H](NCc1ncc(C(C)(C)C)s1)c1ccc(C#N)cc1	ZINC000279039750	525561064	/nfs/dbraw/zinc/56/10/64/525561064.db2.gz	CLMGQWBEBFOWOD-GFCCVEGCSA-N	0	0	299.443	4.163	20	30		CIEDRN
C[C@H](Nc1cc(C#N)ccn1)c1cccc(C(F)(F)F)c1	ZINC000339968828	525641612	/nfs/dbraw/zinc/64/16/12/525641612.db2.gz	HTHRZVWALWTSAO-JTQLQIEISA-N	0	0	291.276	4.145	20	30		CIEDRN
C[C@H](Nc1ccc(C(F)(F)F)c(C#N)c1)c1cccnc1	ZINC000163923309	525648342	/nfs/dbraw/zinc/64/83/42/525648342.db2.gz	WGVABENEATZTDA-JTQLQIEISA-N	0	0	291.276	4.145	20	30		CIEDRN
C[C@@H](Nc1ccnc(C#N)c1)c1ccc(Cl)cc1Cl	ZINC000061811551	525720956	/nfs/dbraw/zinc/72/09/56/525720956.db2.gz	FDDHUHXTXCITDP-SECBINFHSA-N	0	0	292.169	4.433	20	30		CIEDRN
CSc1ccccc1[C@@H](C)Nc1nccc(C)c1C#N	ZINC000336919244	526188262	/nfs/dbraw/zinc/18/82/62/526188262.db2.gz	FIMIPVYYNOBXBR-GFCCVEGCSA-N	0	0	283.400	4.157	20	30		CIEDRN
CC#CCCCC(=O)N1CC[C@@H](C)C[C@@H]1c1ccc(C)o1	ZINC000185728941	526294379	/nfs/dbraw/zinc/29/43/79/526294379.db2.gz	CFPDTCJHBIIKBI-GDBMZVCRSA-N	0	0	287.403	4.081	20	30		CIEDRN
CNC(=O)c1cccc(NC(=O)C[C@@H]2C=CCCC2)c1C	ZINC000330193458	526410925	/nfs/dbraw/zinc/41/09/25/526410925.db2.gz	OFBGCRQLOGIDEE-CYBMUJFWSA-N	0	0	286.375	4.264	20	30		CIEDRN
C=C(C)CCSCCC(=O)N1CCCc2ccccc21	ZINC000350720406	526460558	/nfs/dbraw/zinc/46/05/58/526460558.db2.gz	OLLDBCJDUDVMPK-UHFFFAOYSA-N	0	0	289.444	4.055	20	30		CIEDRN
C=C(C)CCS[C@H](C)C(=O)Nc1c(C)cccc1C	ZINC000350720466	526462952	/nfs/dbraw/zinc/46/29/52/526462952.db2.gz	PQOQNCYTSPCKNJ-CQSZACIVSA-N	0	0	277.433	4.330	20	30		CIEDRN
N#Cc1ccc(CN[C@@H]2CCCc3sc(Cl)cc32)o1	ZINC000291719996	526624552	/nfs/dbraw/zinc/62/45/52/526624552.db2.gz	MLFCKIDCLJMALM-GFCCVEGCSA-N	0	0	292.791	4.033	20	30		CIEDRN
N#Cc1ccc(NC(=O)N2CCCCCCC2)c(Cl)c1	ZINC000269171365	526653685	/nfs/dbraw/zinc/65/36/85/526653685.db2.gz	XLUIPEWYHMOZNF-UHFFFAOYSA-N	0	0	291.782	4.010	20	30		CIEDRN
N#Cc1ccc(SCc2cnoc2C2CC2)c(Cl)c1	ZINC000271403750	526686735	/nfs/dbraw/zinc/68/67/35/526686735.db2.gz	WCEOSMMEILDFJW-UHFFFAOYSA-N	0	0	290.775	4.369	20	30		CIEDRN
Cc1nc(C)c(C#N)c(S[C@@H]2CCCc3ccccc32)n1	ZINC000340942755	526688679	/nfs/dbraw/zinc/68/86/79/526688679.db2.gz	STWFQAVFFCBOPR-MRXNPFEDSA-N	0	0	295.411	4.135	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](c2ccc(F)cc2)C[C@H]1C	ZINC000185623035	526709879	/nfs/dbraw/zinc/70/98/79/526709879.db2.gz	UDYBTLJUQCIFAB-LZWOXQAQSA-N	0	0	289.394	4.132	20	30		CIEDRN
N#Cc1cccc(CSCc2ccc(F)cc2)c1	ZINC000058238466	526712627	/nfs/dbraw/zinc/71/26/27/526712627.db2.gz	GSDKDUSYNVWDLS-UHFFFAOYSA-N	0	0	257.333	4.131	20	30		CIEDRN
Cc1nsc(N[C@H]2CCc3cc(Cl)ccc32)c1C#N	ZINC000340013352	526716572	/nfs/dbraw/zinc/71/65/72/526716572.db2.gz	DAMHHFQBHZIOLT-ZDUSSCGKSA-N	0	0	289.791	4.076	20	30		CIEDRN
N#Cc1ccccc1CNc1ccccc1N1CCCCC1	ZINC000052917936	526736531	/nfs/dbraw/zinc/73/65/31/526736531.db2.gz	XYWQBDMRLVBYDV-UHFFFAOYSA-N	0	0	291.398	4.161	20	30		CIEDRN
N#Cc1ccccc1CSCc1ccc(F)cc1	ZINC000058238464	526738647	/nfs/dbraw/zinc/73/86/47/526738647.db2.gz	GYXVMJQWANRRGR-UHFFFAOYSA-N	0	0	257.333	4.131	20	30		CIEDRN
CC(C)(C)[C@](C)(C#N)NC(=O)[C@@H]1CCC[C@@H]2CCCC[C@H]12	ZINC000332656013	526742213	/nfs/dbraw/zinc/74/22/13/526742213.db2.gz	AKFJZCSIIVBRLD-AFIMGQEJSA-N	0	0	290.451	4.037	20	30		CIEDRN
C=CCOc1cccc(NC(=O)c2cccc(C(C)C)n2)c1	ZINC000353766793	526919603	/nfs/dbraw/zinc/91/96/03/526919603.db2.gz	LJCRELALZWOFBZ-UHFFFAOYSA-N	0	0	296.370	4.022	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@H](C)c1ccc(-c2cccnc2)cc1	ZINC000294821103	526946815	/nfs/dbraw/zinc/94/68/15/526946815.db2.gz	CQKXOMJMRGWCFH-CQSZACIVSA-N	0	0	294.398	4.138	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H]2CCCc3ccc(C)cc32)CCC1	ZINC000344696400	527058472	/nfs/dbraw/zinc/05/84/72/527058472.db2.gz	DFCDPBMOVUEAMI-QGZVFWFLSA-N	0	0	283.415	4.235	20	30		CIEDRN
C=CCCC(=O)N1CCCC[C@@H]1c1cc2ccccc2[nH]1	ZINC000108288456	527069928	/nfs/dbraw/zinc/06/99/28/527069928.db2.gz	HJPRWSQJGDIPJZ-QGZVFWFLSA-N	0	0	282.387	4.188	20	30		CIEDRN
C=CCCC(=O)N1C[C@@H](c2ccccc2)c2ccccc21	ZINC000347384121	527071863	/nfs/dbraw/zinc/07/18/63/527071863.db2.gz	WYNNYHVBNSAAAT-KRWDZBQOSA-N	0	0	277.367	4.131	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cccc(OCCCC#N)c2)CC1	ZINC000354696878	527097081	/nfs/dbraw/zinc/09/70/81/527097081.db2.gz	APHAMEIRLBASAC-UHFFFAOYSA-N	0	0	298.386	4.054	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cccc([C@@H](C)OC)c2)CC1	ZINC000355538718	527097522	/nfs/dbraw/zinc/09/75/22/527097522.db2.gz	CIJLVVNGWJEWHW-CYBMUJFWSA-N	0	0	273.376	4.079	20	30		CIEDRN
C=CC[C@H]1N(C(=O)c2cscc2C)CCCC1(C)C	ZINC000347478088	527226559	/nfs/dbraw/zinc/22/65/59/527226559.db2.gz	DYIBRZJCUDQHDR-CQSZACIVSA-N	0	0	277.433	4.263	20	30		CIEDRN
CC(=O)c1ccc(C#N)cc1N1CCC[C@@H]1c1ccsc1	ZINC000347401213	527228256	/nfs/dbraw/zinc/22/82/56/527228256.db2.gz	BSZMIALBTQTZRZ-MRXNPFEDSA-N	0	0	296.395	4.164	20	30		CIEDRN
C=CCCN(C)C(=O)c1cscc1-c1ccccc1	ZINC000355971266	527319237	/nfs/dbraw/zinc/31/92/37/527319237.db2.gz	FRYKKJVADAHSPB-UHFFFAOYSA-N	0	0	271.385	4.063	20	30		CIEDRN
C=CCC[C@@H](NC(=O)c1cc(C)n(C)c1C)c1ccccc1	ZINC000353477735	527443898	/nfs/dbraw/zinc/44/38/98/527443898.db2.gz	QVLLIUKVDBDEDM-GOSISDBHSA-N	0	0	296.414	4.079	20	30		CIEDRN
C=CCC[C@H](NC(=O)NCCC(C)(F)F)c1ccccc1	ZINC000296407660	527478887	/nfs/dbraw/zinc/47/88/87/527478887.db2.gz	HIJGEOKXBAYPSB-AWEZNQCLSA-N	0	0	296.361	4.038	20	30		CIEDRN
O=C(/C=C/c1ccc2ncccc2c1)c1ccc(F)cc1	ZINC000068301210	527622465	/nfs/dbraw/zinc/62/24/65/527622465.db2.gz	ZQQLKJMEZGGRCY-ONNFQVAWSA-N	0	0	277.298	4.270	20	30		CIEDRN
CC(C)[C@H]1CCCCN1C(=O)C[C@H](CC#N)c1ccccc1	ZINC000356117176	527758192	/nfs/dbraw/zinc/75/81/92/527758192.db2.gz	LXYUAGIDIPSJEU-ZWKOTPCHSA-N	0	0	298.430	4.111	20	30		CIEDRN
CC1(C)C[C@]1(C#N)NC(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1	ZINC000330165943	527769101	/nfs/dbraw/zinc/76/91/01/527769101.db2.gz	XMPVWOJNMGNDSD-ZOMKSWQUSA-N	0	0	274.408	4.242	20	30		CIEDRN
CC(C)CC[C@@H](C)NC(=O)C[C@H](CC#N)c1ccccc1	ZINC000353852572	527799437	/nfs/dbraw/zinc/79/94/37/527799437.db2.gz	OPRVKOMPBBNUQK-WBVHZDCISA-N	0	0	286.419	4.015	20	30		CIEDRN
CC(C)[C@]1(C)C[C@@H]1C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000352173753	527970625	/nfs/dbraw/zinc/97/06/25/527970625.db2.gz	FTECBWPJGHHBGG-AOIWGVFYSA-N	0	0	298.430	4.220	20	30		CIEDRN
CC(C)Oc1c(Cl)cccc1N[C@@H]1CC[C@@H](C#N)C1	ZINC000442856603	528094729	/nfs/dbraw/zinc/09/47/29/528094729.db2.gz	OHSCUUWNLDXEOJ-VXGBXAGGSA-N	0	0	278.783	4.231	20	30		CIEDRN
CCCCC[C@@H](Nc1cnc(C#N)cn1)c1ccccc1	ZINC000302281051	528256923	/nfs/dbraw/zinc/25/69/23/528256923.db2.gz	KFPWEARJSGMNSD-MRXNPFEDSA-N	0	0	280.375	4.082	20	30		CIEDRN
CC(C)C[C@@H](Nc1ncccc1C#N)c1cccs1	ZINC000301546101	528360835	/nfs/dbraw/zinc/36/08/35/528360835.db2.gz	LDCMVIPGEOODKM-CYBMUJFWSA-N	0	0	271.389	4.214	20	30		CIEDRN
CCOc1ccc(C#N)cc1NCc1cc(C)sc1C	ZINC000354861610	528381762	/nfs/dbraw/zinc/38/17/62/528381762.db2.gz	PYESNGUSDRRQPK-UHFFFAOYSA-N	0	0	286.400	4.247	20	30		CIEDRN
CCCc1ccccc1NC(=O)[C@H](C)c1cccc(C#N)c1	ZINC000461901874	528647413	/nfs/dbraw/zinc/64/74/13/528647413.db2.gz	OWSJLSFHWOMLTL-CQSZACIVSA-N	0	0	292.382	4.253	20	30		CIEDRN
CC(C)[C@@H]1CCC[C@H](NC(=O)C[C@H]2CCCC(=O)N2)C1	ZINC000329341587	528683467	/nfs/dbraw/zinc/68/34/67/528683467.db2.gz	SGABXVLDUYTHGM-HZSPNIEDSA-N	0	0	280.412	4.057	20	30		CIEDRN
CCC(CC)CN(CCC#N)Cc1nc(C2CC2)cs1	ZINC000343537317	528750200	/nfs/dbraw/zinc/75/02/00/528750200.db2.gz	MBEKOXLBRPSKGY-UHFFFAOYSA-N	0	0	291.464	4.172	20	30		CIEDRN
CCCC[C@@H](C)C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000352175661	528754938	/nfs/dbraw/zinc/75/49/38/528754938.db2.gz	WXESTNAOHNHWJU-NVXWUHKLSA-N	0	0	286.419	4.364	20	30		CIEDRN
CC1(C)C(C(=O)N[C@H](CCCC#N)c2ccccc2)C1(C)C	ZINC000352174888	528871352	/nfs/dbraw/zinc/87/13/52/528871352.db2.gz	PWOFFRAPIJDFRX-OAHLLOKOSA-N	0	0	298.430	4.220	20	30		CIEDRN
CCCC[C@H](CC)CC(=O)N(CCC#N)Cc1ccco1	ZINC000343757714	528903799	/nfs/dbraw/zinc/90/37/99/528903799.db2.gz	GABGEWHCCVPEHR-HNNXBMFYSA-N	0	0	290.407	4.128	20	30		CIEDRN
CCC[C@@H](C)[C@@H]1CCCN1c1ccc(Cl)c(C#N)n1	ZINC000301713059	528904122	/nfs/dbraw/zinc/90/41/22/528904122.db2.gz	VYERHABXBNXQKS-RISCZKNCSA-N	0	0	277.799	4.012	20	30		CIEDRN
CC1(C)CCCC[C@@H]1CC(=O)NCc1noc(C2CC2)n1	ZINC000329008928	528914416	/nfs/dbraw/zinc/91/44/16/528914416.db2.gz	ZARXXLAPCUBZAN-GFCCVEGCSA-N	0	0	291.395	4.010	20	30		CIEDRN
CCCC[C@H](Nc1cccc(C#N)n1)c1ccc(OC)cc1	ZINC000301807859	528996274	/nfs/dbraw/zinc/99/62/74/528996274.db2.gz	AQZLIPLEKSLPOP-KRWDZBQOSA-N	0	0	295.386	4.305	20	30		CIEDRN
CCC1(CNC(=O)[C@@H]2C[C@H](C)CC(=O)N2)CCCCC1	ZINC000329108636	529032294	/nfs/dbraw/zinc/03/22/94/529032294.db2.gz	FQYBRLXANCQSJT-STQMWFEESA-N	0	0	280.412	4.058	20	30		CIEDRN
CCC1(CC)CCC(NC(=O)CCc2cnccn2)CC1	ZINC000330091873	529034270	/nfs/dbraw/zinc/03/42/70/529034270.db2.gz	QJJMYVFDUFYRTB-UHFFFAOYSA-N	0	0	289.423	4.115	20	30		CIEDRN
CC(C)[C@H](Nc1ccc(Cl)c(C#N)n1)c1ccccc1	ZINC000301550572	529127237	/nfs/dbraw/zinc/12/72/37/529127237.db2.gz	VEARMEDTDGJKOZ-INIZCTEOSA-N	0	0	285.778	4.416	20	30		CIEDRN
CCS[C@H]1CCC[C@@H](Nc2ccc(F)cc2C#N)C1	ZINC000301570852	529229218	/nfs/dbraw/zinc/22/92/18/529229218.db2.gz	WXDNFJVUHDQTIV-KGLIPLIRSA-N	0	0	278.396	4.174	20	30		CIEDRN
CCSc1ccc([C@H](C)Nc2ncccc2C#N)cc1	ZINC000301187789	529248221	/nfs/dbraw/zinc/24/82/21/529248221.db2.gz	KJZNQINWJLCWJZ-LBPRGKRZSA-N	0	0	283.400	4.238	20	30		CIEDRN
CC[C@]1(C)C[C@H]1C(=O)Nc1cc(C#N)ccc1NC1CC1	ZINC000329078745	529412950	/nfs/dbraw/zinc/41/29/50/529412950.db2.gz	BRPBRBRGOPHRLM-SUMWQHHRSA-N	0	0	283.375	4.157	20	30		CIEDRN
C=CCC[C@H](C(=O)N[C@@H]1CCC[C@H](F)C1)c1ccccc1	ZINC000573372184	334932334	/nfs/dbraw/zinc/93/23/34/334932334.db2.gz	CYNOKHYVKUDGQX-BBWFWOEESA-N	0	0	289.394	4.133	20	30		CIEDRN
CC[C@H](Nc1ccc(C#N)cc1)c1cc(F)ccc1F	ZINC000301378784	529675598	/nfs/dbraw/zinc/67/55/98/529675598.db2.gz	XNQNPPVGENJQOY-INIZCTEOSA-N	0	0	272.298	4.400	20	30		CIEDRN
CCc1ccc([C@@H]2C[C@H](C)CCN2c2ncccc2C#N)o1	ZINC000301446412	529718265	/nfs/dbraw/zinc/71/82/65/529718265.db2.gz	OBPNRQNMWVZDIE-CJNGLKHVSA-N	0	0	295.386	4.086	20	30		CIEDRN
CN(C)c1nc2cc(NC(=O)[C@@H]3CC34CCCC4)ccc2o1	ZINC000330039817	529804484	/nfs/dbraw/zinc/80/44/84/529804484.db2.gz	FNKYAKZSWSFXPF-LBPRGKRZSA-N	0	0	299.374	4.062	20	30		CIEDRN
CN(CCC#N)Cc1cccc(SCc2ccccc2)c1	ZINC000347045853	529868715	/nfs/dbraw/zinc/86/87/15/529868715.db2.gz	GONMXKRLCGWRMF-UHFFFAOYSA-N	0	0	296.439	4.324	20	30		CIEDRN
CN(c1ccc(C#N)cn1)C1c2ccccc2-c2ccccc21	ZINC000301505044	530034745	/nfs/dbraw/zinc/03/47/45/530034745.db2.gz	ZESRQOFYAVAMPZ-UHFFFAOYSA-N	0	0	297.361	4.159	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccsc2Cl)CC1	ZINC000356963775	266219446	/nfs/dbraw/zinc/21/94/46/266219446.db2.gz	XWBVAIBRDXHCRN-UHFFFAOYSA-N	0	0	255.770	4.086	20	30		CIEDRN
CN(Cc1cccc(C#N)c1)c1cccc(C(F)F)c1C#N	ZINC000573734334	334961831	/nfs/dbraw/zinc/96/18/31/334961831.db2.gz	VQQCHBJFHIUHFC-UHFFFAOYSA-N	0	0	297.308	4.004	20	30		CIEDRN
C=CCN(C(=O)Cc1coc2ccccc12)c1ccccc1	ZINC000573833223	334970047	/nfs/dbraw/zinc/97/00/47/334970047.db2.gz	JNNOZNHQEQHKHA-UHFFFAOYSA-N	0	0	291.350	4.195	20	30		CIEDRN
Cc1nsc(Sc2cc(C)ccc2C)c1C#N	ZINC000573833238	334970083	/nfs/dbraw/zinc/97/00/83/334970083.db2.gz	JSFPPLPOZGXQAJ-UHFFFAOYSA-N	0	0	260.387	4.091	20	30		CIEDRN
C=C(C)CCc1noc(-c2c(C)onc2-c2ccccc2)n1	ZINC000573842702	334970674	/nfs/dbraw/zinc/97/06/74/334970674.db2.gz	PDOJEWNLDMLBPA-UHFFFAOYSA-N	0	0	295.342	4.209	20	30		CIEDRN
C=CCCC1(c2nc(-c3ccc4ncccc4c3)no2)CC1	ZINC000573910218	334976277	/nfs/dbraw/zinc/97/62/77/334976277.db2.gz	UWYKWWASKADYIS-UHFFFAOYSA-N	0	0	291.354	4.283	20	30		CIEDRN
CC[C@H](C)C[C@H](C)Nc1nc(C(F)(F)F)ccc1C#N	ZINC000090795427	260413319	/nfs/dbraw/zinc/41/33/19/260413319.db2.gz	WZGFSFTUMJAFEQ-UWVGGRQHSA-N	0	0	285.313	4.209	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)[C@@H]1C[C@]1(C)CC	ZINC000410343166	260487329	/nfs/dbraw/zinc/48/73/29/260487329.db2.gz	DIIJWPMSTFPBHV-YOEHRIQHSA-N	0	0	257.377	4.180	20	30		CIEDRN
CO[C@@H](CSCc1ccc(C#N)cc1)c1ccccc1	ZINC000574221481	335002426	/nfs/dbraw/zinc/00/24/26/335002426.db2.gz	CHBVBWNGZDCQFL-KRWDZBQOSA-N	0	0	283.396	4.179	20	30		CIEDRN
C=CCCSCC1(COc2cccc(COC)c2)CC1	ZINC000574295486	335008382	/nfs/dbraw/zinc/00/83/82/335008382.db2.gz	PDVPPFOFURWDOK-UHFFFAOYSA-N	0	0	292.444	4.301	20	30		CIEDRN
C[C@@H](Cc1ccccc1)C(=O)Nc1ccc(C#N)cc1Cl	ZINC000574313925	335009536	/nfs/dbraw/zinc/00/95/36/335009536.db2.gz	ZYJRKNIYCKUZMC-LBPRGKRZSA-N	0	0	298.773	4.029	20	30		CIEDRN
CCc1ccc([C@@H]2C[C@@H](C)CCN2c2cc(C#N)ccn2)o1	ZINC000574474850	335022767	/nfs/dbraw/zinc/02/27/67/335022767.db2.gz	ZNFACAJUUVADAC-BBRMVZONSA-N	0	0	295.386	4.086	20	30		CIEDRN
Cc1cc(C)c(C#N)c(SC[C@@H]2CCC(F)(F)C2)n1	ZINC000574764446	335045758	/nfs/dbraw/zinc/04/57/58/335045758.db2.gz	TYXNAXPSUNPBJP-LLVKDONJSA-N	0	0	282.359	4.098	20	30		CIEDRN
CSc1ccc(CNc2c(F)cc(C#N)cc2F)cc1	ZINC000301088519	532961396	/nfs/dbraw/zinc/96/13/96/532961396.db2.gz	HEZLPICYAHGUKU-UHFFFAOYSA-N	0	0	290.338	4.170	20	30		CIEDRN
CSc1ccc(Nc2ccc(C#N)cn2)cc1Cl	ZINC000301480686	532986838	/nfs/dbraw/zinc/98/68/38/532986838.db2.gz	RUVPSCHGHVKERP-UHFFFAOYSA-N	0	0	275.764	4.072	20	30		CIEDRN
Cc1nc(Oc2cccc(C(F)(F)F)c2)ccc1C#N	ZINC000312419267	260008714	/nfs/dbraw/zinc/00/87/14/260008714.db2.gz	GVOATVBEPOISMB-UHFFFAOYSA-N	0	0	278.233	4.073	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCC1(C)CCCCCC1	ZINC000497997518	262244334	/nfs/dbraw/zinc/24/43/34/262244334.db2.gz	HOXPRRQBIGRUHR-UHFFFAOYSA-N	0	0	251.414	4.065	20	30		CIEDRN
C=C(C)[C@@H](NCc1cnc(C)s1)c1ccc(F)c(F)c1	ZINC000187369278	260033385	/nfs/dbraw/zinc/03/33/85/260033385.db2.gz	WBMHGIDNRIQSAY-OAHLLOKOSA-N	0	0	294.370	4.137	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NC[C@H](c1ccccc1)C(F)(F)F	ZINC000187703331	260052353	/nfs/dbraw/zinc/05/23/53/260052353.db2.gz	LHPJFZUFQYTRFK-TZMCWYRMSA-N	0	0	299.336	4.051	20	30		CIEDRN
Cc1ccc(C(=O)Nc2ccccc2C#N)c(Cl)c1C	ZINC000335814153	533616630	/nfs/dbraw/zinc/61/66/30/533616630.db2.gz	DPBQVJMOJNIDKX-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
C[C@@H]1CCCC[C@H]1c1noc([C@]2(C#N)CC23CCCC3)n1	ZINC000333784646	533631133	/nfs/dbraw/zinc/63/11/33/533631133.db2.gz	CEXYENVKWZBOGR-PBFPGSCMSA-N	0	0	285.391	4.089	20	30		CIEDRN
C=CCC(CC=C)C(=O)NCc1ccc2sccc2c1	ZINC000575100937	335065047	/nfs/dbraw/zinc/06/50/47/335065047.db2.gz	WANVNNMSLHYGCX-UHFFFAOYSA-N	0	0	285.412	4.286	20	30		CIEDRN
C[C@@H]1C[C@@H]1c1ccc(CNc2ccc(CC#N)cc2)o1	ZINC000037071308	260066584	/nfs/dbraw/zinc/06/65/84/260066584.db2.gz	DGHGYQFFNJAXKD-WBMJQRKESA-N	0	0	266.344	4.081	20	30		CIEDRN
N#Cc1ccc(COc2cccc3ccccc32)cc1	ZINC000005111738	170067242	/nfs/dbraw/zinc/06/72/42/170067242.db2.gz	GSXSYXVUECBJHA-UHFFFAOYSA-N	0	0	259.308	4.290	20	30		CIEDRN
O=C(/C=C/c1ccc(Cl)s1)c1cccc(F)c1	ZINC000005249036	170079376	/nfs/dbraw/zinc/07/93/76/170079376.db2.gz	HQHCIXIVEMIPLA-GQCTYLIASA-N	0	0	266.724	4.437	20	30		CIEDRN
Cc1cc(C)c(C#N)c(SC/C=C\c2ccccc2)n1	ZINC000005897481	170151828	/nfs/dbraw/zinc/15/18/28/170151828.db2.gz	DMTTXJMXFQDEJS-TWGQIWQCSA-N	0	0	280.396	4.376	20	30		CIEDRN
COc1ccc(/C=C/C(=O)c2cc3ccccc3o2)cc1	ZINC000006181730	170181079	/nfs/dbraw/zinc/18/10/79/170181079.db2.gz	NXXLVUUHFUEPNT-DHZHZOJOSA-N	0	0	278.307	4.338	20	30		CIEDRN
N#Cc1ccccc1CSc1ccc2c(c1)OCCCO2	ZINC000007006460	170261799	/nfs/dbraw/zinc/26/17/99/170261799.db2.gz	HUISZZPQXBQFSK-UHFFFAOYSA-N	0	0	297.379	4.012	20	30		CIEDRN
CC[C@H](C)[C@@H](C(=O)Nc1cccc(C#N)c1)c1ccccc1	ZINC000007265455	170274907	/nfs/dbraw/zinc/27/49/07/170274907.db2.gz	XQKWYLLHJGCPTQ-KBXCAEBGSA-N	0	0	292.382	4.327	20	30		CIEDRN
Cc1ccccc1CSc1ccc([N+](=O)[O-])cc1C#N	ZINC000008063628	170317029	/nfs/dbraw/zinc/31/70/29/170317029.db2.gz	NUUDWJCPAGXGPZ-UHFFFAOYSA-N	0	0	284.340	4.067	20	30		CIEDRN
Cc1ccc(C)c(OCc2ccc(C#N)cc2)c1C	ZINC000011834254	170445370	/nfs/dbraw/zinc/44/53/70/170445370.db2.gz	BXDLFNUIBANNEH-UHFFFAOYSA-N	0	0	251.329	4.063	20	30		CIEDRN
N#Cc1ccccc1COc1ccc(Cl)c(Cl)c1	ZINC000011834187	170445586	/nfs/dbraw/zinc/44/55/86/170445586.db2.gz	UPVZQXWTJXUMCL-UHFFFAOYSA-N	0	0	278.138	4.444	20	30		CIEDRN
C=C(C)Cn1cnc2scc(-c3ccc(C)cc3)c2c1=O	ZINC000016619273	170705796	/nfs/dbraw/zinc/70/57/96/170705796.db2.gz	ZHKUGDSFFRKUJO-UHFFFAOYSA-N	0	0	296.395	4.010	20	30		CIEDRN
C#Cc1cccc(NCc2cccc(Br)c2)c1	ZINC000019876795	170905899	/nfs/dbraw/zinc/90/58/99/170905899.db2.gz	GOKXBUROVLRCTB-UHFFFAOYSA-N	0	0	286.172	4.043	20	30		CIEDRN
CSc1ccc([C@H](C)Nc2ccc(C#N)cc2)cc1	ZINC000019951662	170939865	/nfs/dbraw/zinc/93/98/65/170939865.db2.gz	OGMAPEWGHXCWIV-LBPRGKRZSA-N	0	0	268.385	4.453	20	30		CIEDRN
C[C@@H](Nc1ccc2[nH]ccc2c1)c1ccc(C#N)cc1	ZINC000020132441	171020835	/nfs/dbraw/zinc/02/08/35/171020835.db2.gz	YDDASWNIJREOTH-GFCCVEGCSA-N	0	0	261.328	4.213	20	30		CIEDRN
N#Cc1ccc(COc2ccc(C(F)(F)F)cc2)cc1	ZINC000020298123	171137858	/nfs/dbraw/zinc/13/78/58/171137858.db2.gz	SZDVVXGTAXKUCK-UHFFFAOYSA-N	0	0	277.245	4.156	20	30		CIEDRN
N#Cc1ccc(F)c(CNc2ccc(F)cc2Cl)c1	ZINC000020362980	171161368	/nfs/dbraw/zinc/16/13/68/171161368.db2.gz	LADQYXAFXXFLLV-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C#Cc1cccc(NCc2cc(Br)cs2)c1	ZINC000020475017	171219219	/nfs/dbraw/zinc/21/92/19/171219219.db2.gz	VGIVNZGOHVQHFM-UHFFFAOYSA-N	0	0	292.201	4.104	20	30		CIEDRN
CCCCCC[C@@H](C)Nc1ccc(OCC#N)cc1	ZINC000020520223	171233744	/nfs/dbraw/zinc/23/37/44/171233744.db2.gz	WILQCILHSFRXCU-CQSZACIVSA-N	0	0	260.381	4.360	20	30		CIEDRN
N#CC1(C(=O)Nc2cc(Cl)cc(Cl)c2)CCCC1	ZINC000020962420	171282475	/nfs/dbraw/zinc/28/24/75/171282475.db2.gz	XULNWKJDZKSZPP-UHFFFAOYSA-N	0	0	283.158	4.016	20	30		CIEDRN
C=CCOc1ccc(CNc2ccccc2F)cc1	ZINC000021062124	171297093	/nfs/dbraw/zinc/29/70/93/171297093.db2.gz	AMGGDJJBLNGGNF-UHFFFAOYSA-N	0	0	257.308	4.003	20	30		CIEDRN
COc1cccc(-c2nc(-c3ccc(C#N)cc3)cs2)c1	ZINC000021224906	171300070	/nfs/dbraw/zinc/30/00/70/171300070.db2.gz	NXURZEDHDZHLMI-UHFFFAOYSA-N	0	0	292.363	4.357	20	30		CIEDRN
CC(C)c1ccc(OCc2ccc(C#N)cc2F)cc1	ZINC000021812526	171330175	/nfs/dbraw/zinc/33/01/75/171330175.db2.gz	RBJVKSIICOMHBM-UHFFFAOYSA-N	0	0	269.319	4.400	20	30		CIEDRN
Cc1cccc(CNc2ccc(Cl)c(C#N)c2)c1	ZINC000035053526	171954452	/nfs/dbraw/zinc/95/44/52/171954452.db2.gz	DBTJMNFBSUROFK-UHFFFAOYSA-N	0	0	256.736	4.132	20	30		CIEDRN
CC[C@H](Nc1cccc(F)c1C#N)c1ccc(OC)cc1	ZINC000035135153	172002139	/nfs/dbraw/zinc/00/21/39/172002139.db2.gz	XCEBDIOWMWOBSF-INIZCTEOSA-N	0	0	284.334	4.269	20	30		CIEDRN
N#Cc1ccc(N[C@H]2CCSc3c(F)cccc32)cc1	ZINC000035254987	172084287	/nfs/dbraw/zinc/08/42/87/172084287.db2.gz	YJHHOTWMWXXRHR-HNNXBMFYSA-N	0	0	284.359	4.346	20	30		CIEDRN
N#CC1(C(=O)Nc2ccc(C(F)(F)F)cc2)CCCCC1	ZINC000044385319	175169653	/nfs/dbraw/zinc/16/96/53/175169653.db2.gz	WFFIGHGYHSIZLP-UHFFFAOYSA-N	0	0	296.292	4.118	20	30		CIEDRN
Cc1cc([C@@H](C)Nc2ccc(C#N)cc2F)c(C)o1	ZINC000044730869	175240177	/nfs/dbraw/zinc/24/01/77/175240177.db2.gz	VUPSHNBYURYATO-SNVBAGLBSA-N	0	0	258.296	4.080	20	30		CIEDRN
CCCCCCCCn1cnc2ccc(C)cc2c1=O	ZINC000071340753	176130652	/nfs/dbraw/zinc/13/06/52/176130652.db2.gz	POXIZHSPCNQABP-UHFFFAOYSA-N	0	0	272.392	4.065	20	30		CIEDRN
CC[C@@H](NC(=O)c1ccc(C#N)cc1)c1cccc(Cl)c1	ZINC000071861854	176279767	/nfs/dbraw/zinc/27/97/67/176279767.db2.gz	KMPZRRGGPJSHLY-MRXNPFEDSA-N	0	0	298.773	4.093	20	30		CIEDRN
Cc1ccc2sc(-c3ccc(C#N)cc3)nc2c1	ZINC000075873014	176810039	/nfs/dbraw/zinc/81/00/39/176810039.db2.gz	ONOYIUYGDOXYKP-UHFFFAOYSA-N	0	0	250.326	4.143	20	30		CIEDRN
N#Cc1ccc(NCCCc2ccc(Cl)cc2)cc1	ZINC000076287511	176970612	/nfs/dbraw/zinc/97/06/12/176970612.db2.gz	PDHOHDOOGFMMJQ-UHFFFAOYSA-N	0	0	270.763	4.256	20	30		CIEDRN
COc1ccc(CC[C@@H](C)Nc2ccc(C#N)cc2)cc1	ZINC000037212060	260074712	/nfs/dbraw/zinc/07/47/12/260074712.db2.gz	LCPYKIUYFDQHAM-CQSZACIVSA-N	0	0	280.371	4.000	20	30		CIEDRN
CCc1cccc(N[C@H](C)c2ccc(OCC#N)cc2)c1	ZINC000037214340	260074764	/nfs/dbraw/zinc/07/47/64/260074764.db2.gz	KYODQYLZGNYORB-CQSZACIVSA-N	0	0	280.371	4.324	20	30		CIEDRN
CC(C)(C)C(C)(C)C(=O)N[C@@H](C#N)c1ccccc1Cl	ZINC000410638472	262645119	/nfs/dbraw/zinc/64/51/19/262645119.db2.gz	DKVDJVNJQSKJPT-ZDUSSCGKSA-N	0	0	292.810	4.093	20	30		CIEDRN
CCc1cc(NCc2cccc(C#N)c2F)ccc1C	ZINC000312473856	260081952	/nfs/dbraw/zinc/08/19/52/260081952.db2.gz	BSQSGLAHGFMMGU-UHFFFAOYSA-N	0	0	268.335	4.180	20	30		CIEDRN
Cc1ccc(C#N)c(N[C@H]2CC(C)(C)c3ccccc32)n1	ZINC000346830997	225935312	/nfs/dbraw/zinc/93/53/12/225935312.db2.gz	LUGGIFDESZRVGY-INIZCTEOSA-N	0	0	277.371	4.096	20	30		CIEDRN
CN(C(=O)CCCCC(C)(C)C)c1ccc(C#N)cc1	ZINC000575156995	335073706	/nfs/dbraw/zinc/07/37/06/335073706.db2.gz	JKNGQONTOZRPDP-UHFFFAOYSA-N	0	0	272.392	4.128	20	30		CIEDRN
CCC[C@@H](C(=O)N[C@@H](C#N)c1ccc(CC)cc1)C(C)C	ZINC000575160642	335073913	/nfs/dbraw/zinc/07/39/13/335073913.db2.gz	OERVIDKYVUJMJK-SJORKVTESA-N	0	0	286.419	4.002	20	30		CIEDRN
Cc1c(COC(C)(C)C)cccc1N[C@H]1CC[C@H](C#N)C1	ZINC000442864801	226663484	/nfs/dbraw/zinc/66/34/84/226663484.db2.gz	GXPJLYPSUCNGTJ-HOCLYGCPSA-N	0	0	286.419	4.414	20	30		CIEDRN
N#Cc1cccnc1N[C@H]1CC=C(c2ccc(F)cc2)CC1	ZINC000349870037	226879601	/nfs/dbraw/zinc/87/96/01/226879601.db2.gz	UVGOVUCDLGOQFK-KRWDZBQOSA-N	0	0	293.345	4.140	20	30		CIEDRN
C[C@H](C(=O)Nc1ccc(C#N)cc1Cl)c1cccs1	ZINC000335849030	226933087	/nfs/dbraw/zinc/93/30/87/226933087.db2.gz	OIGNFINORFRYDT-VIFPVBQESA-N	0	0	290.775	4.015	20	30		CIEDRN
Cc1cc([C@H](C)Nc2ncc(C#N)cc2Cl)c(C)s1	ZINC000354722844	227082970	/nfs/dbraw/zinc/08/29/70/227082970.db2.gz	GQFNIMNQPXKDCU-VIFPVBQESA-N	0	0	291.807	4.458	20	30		CIEDRN
N#Cc1csc(CN[C@@H](CC2CCC2)c2ccccc2)n1	ZINC000352797712	227233856	/nfs/dbraw/zinc/23/38/56/227233856.db2.gz	NAEYVIDSPDTYPW-INIZCTEOSA-N	0	0	297.427	4.036	20	30		CIEDRN
C[C@H]1CC(=O)CC[C@H]1C(=O)Nc1ncc(C(C)(C)C)s1	ZINC000329000828	227252783	/nfs/dbraw/zinc/25/27/83/227252783.db2.gz	VUAKKEUIRSFZOK-GXSJLCMTSA-N	0	0	294.420	4.034	20	30		CIEDRN
Cc1nc(CCNC(=O)[C@@H]2C[C@@H]2C2CCCCC2)c(C)o1	ZINC000329034680	227266693	/nfs/dbraw/zinc/26/66/93/227266693.db2.gz	QVAGFXNHMWLHGH-HUUCEWRRSA-N	0	0	290.407	4.007	20	30		CIEDRN
Cc1nc(CCNC(=O)[C@H]2CCCC(C)(C)C2)c(C)o1	ZINC000329035520	227267207	/nfs/dbraw/zinc/26/72/07/227267207.db2.gz	RADDRWHZTPZYOT-ZDUSSCGKSA-N	0	0	278.396	4.007	20	30		CIEDRN
N#CC1(NC(=O)c2cccc(C3CCC3)c2)CCCCC1	ZINC000329267864	227394603	/nfs/dbraw/zinc/39/46/03/227394603.db2.gz	HXBYQDZZRCMYLK-UHFFFAOYSA-N	0	0	282.387	4.485	20	30		CIEDRN
N#CCCCOc1cccc(Nc2cccc(F)c2C#N)c1	ZINC000301140180	227460521	/nfs/dbraw/zinc/46/05/21/227460521.db2.gz	HJQIGRVYLVEHSI-UHFFFAOYSA-N	0	0	295.317	4.124	20	30		CIEDRN
C[C@H](OCCCNc1ccc(C#N)cc1F)c1ccccc1	ZINC000301174707	227465852	/nfs/dbraw/zinc/46/58/52/227465852.db2.gz	YMQZUHITLKFIBX-AWEZNQCLSA-N	0	0	298.361	4.277	20	30		CIEDRN
N#Cc1ccc(NCc2ccccc2OC2CCC2)c(F)c1	ZINC000301259718	227491702	/nfs/dbraw/zinc/49/17/02/227491702.db2.gz	CLDBBFFGDZGEHC-UHFFFAOYSA-N	0	0	296.345	4.241	20	30		CIEDRN
Cc1cc2cc(Nc3ccc(Cl)c(C#N)n3)ccc2[nH]1	ZINC000301545849	227580114	/nfs/dbraw/zinc/58/01/14/227580114.db2.gz	UBZFCNOJQNDVAC-UHFFFAOYSA-N	0	0	282.734	4.140	20	30		CIEDRN
Cc1csc([C@H](C)Nc2cc(C#N)nc3ccccc32)n1	ZINC000301409472	227531251	/nfs/dbraw/zinc/53/12/51/227531251.db2.gz	ODUBSTTVYSERDN-NSHDSACASA-N	0	0	294.383	4.045	20	30		CIEDRN
C[C@H](Nc1cccc(C(F)(F)F)n1)c1cccc(C#N)c1	ZINC000301417919	227533092	/nfs/dbraw/zinc/53/30/92/227533092.db2.gz	CTGLWTPNTJLJDX-JTQLQIEISA-N	0	0	291.276	4.145	20	30		CIEDRN
Cc1ccc(NCc2cccc3ccccc32)nc1C#N	ZINC000302669092	227873778	/nfs/dbraw/zinc/87/37/78/227873778.db2.gz	QUSXJMJJQLGNTG-UHFFFAOYSA-N	0	0	273.339	4.027	20	30		CIEDRN
Cc1ccc(N(C)[C@@H](C)c2cccc(Cl)c2)nc1C#N	ZINC000302673611	227874584	/nfs/dbraw/zinc/87/45/84/227874584.db2.gz	SOIFZNSMIKADEH-LBPRGKRZSA-N	0	0	285.778	4.113	20	30		CIEDRN
CSCCc1ccc(Nc2c(C#N)cccc2C#N)cc1	ZINC000302884330	533682946	/nfs/dbraw/zinc/68/29/46/533682946.db2.gz	LSTGUGFDMJMPGU-UHFFFAOYSA-N	0	0	293.395	4.079	20	30		CIEDRN
Cc1ccc(N[C@H](C)c2c(C)cccc2C)nc1C#N	ZINC000302746360	227883174	/nfs/dbraw/zinc/88/31/74/227883174.db2.gz	FMCWCEPHEWINDK-CQSZACIVSA-N	0	0	265.360	4.052	20	30		CIEDRN
Cc1ccc(-c2cccnc2)cc1NC(=O)[C@H]1CO[C@H](C)C1	ZINC000330060697	228029654	/nfs/dbraw/zinc/02/96/54/228029654.db2.gz	NBWPSECEVRWQAC-CZUORRHYSA-N	0	0	296.370	4.070	20	30		CIEDRN
O=C(NCc1c[nH]cn1)C1(C2CCCCC2)CCCCC1	ZINC000329973046	228002889	/nfs/dbraw/zinc/00/28/89/228002889.db2.gz	ZKAIFVPVBAUAEC-UHFFFAOYSA-N	0	0	289.423	4.397	20	30		CIEDRN
C[C@H](NC(=O)[C@H]1CC12CCCC2)c1ccc2c(c1)CC(=O)N2	ZINC000329974598	228004045	/nfs/dbraw/zinc/00/40/45/228004045.db2.gz	XMGHCUSMCLAJME-SMDDNHRTSA-N	0	0	298.386	4.429	20	30		CIEDRN
Cc1ncoc1C(=O)NCC1CCC(c2ccccc2)CC1	ZINC000329997958	228011500	/nfs/dbraw/zinc/01/15/00/228011500.db2.gz	RLTMDZNYIMGAAT-UHFFFAOYSA-N	0	0	298.386	4.262	20	30		CIEDRN
O=C(NC1CCC(C(=O)Nc2ccccc2)CC1)C1CC1	ZINC000329997825	228011727	/nfs/dbraw/zinc/01/17/27/228011727.db2.gz	REXUKZJXRNWYOF-UHFFFAOYSA-N	0	0	286.375	4.200	20	30		CIEDRN
N#Cc1ccccc1Oc1ccc(NC(=O)C2=CCC2)cc1	ZINC000355829554	228012826	/nfs/dbraw/zinc/01/28/26/228012826.db2.gz	LLPSLRNBGQQXAO-UHFFFAOYSA-N	0	0	290.322	4.009	20	30		CIEDRN
Cc1cc(CN(CCC#N)CCC(C)C)c(C)s1	ZINC000353420244	228098864	/nfs/dbraw/zinc/09/88/64/228098864.db2.gz	PNBKQTQSHGEBGI-UHFFFAOYSA-N	0	0	264.438	4.127	20	30		CIEDRN
N#Cc1csc(CN2CCCCC[C@H]2c2ccccc2)n1	ZINC000356069377	228109252	/nfs/dbraw/zinc/10/92/52/228109252.db2.gz	VGYNGVIGHGCBHS-INIZCTEOSA-N	0	0	297.427	4.132	20	30		CIEDRN
Cc1cc(NC(=O)C[C@@H]2C=CCCC2)cc2n[nH]cc21	ZINC000330221742	228071350	/nfs/dbraw/zinc/07/13/50/228071350.db2.gz	LXFCEDADXZKHLX-GFCCVEGCSA-N	0	0	269.348	4.206	20	30		CIEDRN
C[C@@H]1CCC[C@H](NC(=O)C[C@H](CC#N)c2ccccc2)CC1	ZINC000331999074	228142774	/nfs/dbraw/zinc/14/27/74/228142774.db2.gz	NQGVJADTOOUZSD-NJAFHUGGSA-N	0	0	298.430	4.159	20	30		CIEDRN
Cc1ccc(F)c(NC(=O)C[C@H](CC#N)c2ccccc2)c1	ZINC000353879243	228162353	/nfs/dbraw/zinc/16/23/53/228162353.db2.gz	TXMIOWCYOPUWJO-HNNXBMFYSA-N	0	0	296.345	4.160	20	30		CIEDRN
N#CCCC[C@H](NC(=O)CC1CCCC1)c1ccccc1	ZINC000352205581	228198247	/nfs/dbraw/zinc/19/82/47/228198247.db2.gz	GZSKGWARZCBPOM-KRWDZBQOSA-N	0	0	284.403	4.118	20	30		CIEDRN
Cc1cc(C(=O)N[C@H](CCCC#N)c2ccccc2)c(C)o1	ZINC000352215344	228200487	/nfs/dbraw/zinc/20/04/87/228200487.db2.gz	CJVLGEOVVHXJEU-QGZVFWFLSA-N	0	0	296.370	4.061	20	30		CIEDRN
Cc1coc(C)c1C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000352225206	228201348	/nfs/dbraw/zinc/20/13/48/228201348.db2.gz	JQNJOLLPLILNFT-INIZCTEOSA-N	0	0	296.370	4.061	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1ccccc1C(C)(C)C	ZINC000116997135	260019639	/nfs/dbraw/zinc/01/96/39/260019639.db2.gz	HXMZXBMSSJPFIC-LBPRGKRZSA-N	0	0	260.381	4.070	20	30		CIEDRN
CCCCCCCC(=O)N1CCC[C@@H]1c1cc(C)on1	ZINC000363332397	260058827	/nfs/dbraw/zinc/05/88/27/260058827.db2.gz	XNHQPQXQBDULST-OAHLLOKOSA-N	0	0	278.396	4.007	20	30		CIEDRN
C=C(C)CN(C)C(=O)Nc1cc(Cl)ccc1Cl	ZINC000180016278	260087588	/nfs/dbraw/zinc/08/75/88/260087588.db2.gz	ZIAKHOBKJONKJW-UHFFFAOYSA-N	0	0	273.163	4.033	20	30		CIEDRN
C=C(C)CN(C)C(=O)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1	ZINC000180388255	260099828	/nfs/dbraw/zinc/09/98/28/260099828.db2.gz	IRWKHBVZTFDARB-KBPBESRZSA-N	0	0	298.213	4.131	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1cc(Cl)ccc1SCC	ZINC000180387274	260099956	/nfs/dbraw/zinc/09/99/56/260099956.db2.gz	MHBONLWVANCZNY-UHFFFAOYSA-N	0	0	283.824	4.100	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1cc(C(C)C)nc2ccccc21	ZINC000180405101	260100705	/nfs/dbraw/zinc/10/07/05/260100705.db2.gz	BDMPSSOUQSCACU-UHFFFAOYSA-N	0	0	282.387	4.006	20	30		CIEDRN
C=C(C)CN(C)C(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1Cl	ZINC000180399285	260100770	/nfs/dbraw/zinc/10/07/70/260100770.db2.gz	FNLPRKTVDFFAMS-NWDGAFQWSA-N	0	0	298.213	4.131	20	30		CIEDRN
C=C(C)CN(C)C(=O)C[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000180448742	260102201	/nfs/dbraw/zinc/10/22/01/260102201.db2.gz	KWKDVEVTQFJBCU-LBPRGKRZSA-N	0	0	299.336	4.234	20	30		CIEDRN
C=C(C)CN(C)C(=O)C[C@H](C)c1ccccc1C(F)(F)F	ZINC000180464595	260102811	/nfs/dbraw/zinc/10/28/11/260102811.db2.gz	YYKAJFKEKGGXNL-LBPRGKRZSA-N	0	0	299.336	4.234	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1cc(C2CC2)nc2ccc(C)cc21	ZINC000180475009	260103292	/nfs/dbraw/zinc/10/32/92/260103292.db2.gz	LEKHSOLYLFAPLH-UHFFFAOYSA-N	0	0	294.398	4.069	20	30		CIEDRN
N#Cc1ccc(Cl)cc1NC[C@@H]1CCC(F)(F)C1	ZINC000305899415	260104409	/nfs/dbraw/zinc/10/44/09/260104409.db2.gz	PQIYCPNWOVLURN-SECBINFHSA-N	0	0	270.710	4.059	20	30		CIEDRN
C=CCCC(=O)N[C@H](CC1CCC1)c1ccccc1	ZINC000180643798	260107638	/nfs/dbraw/zinc/10/76/38/260107638.db2.gz	CWRBOUOPBRBTHT-MRXNPFEDSA-N	0	0	257.377	4.000	20	30		CIEDRN
C=CCCc1noc([C@H]2CCC[C@@H](C(F)(F)F)C2)n1	ZINC000297370879	260119799	/nfs/dbraw/zinc/11/97/99/260119799.db2.gz	QMFFHNMHPOIBCW-VHSXEESVSA-N	0	0	274.286	4.024	20	30		CIEDRN
N#Cc1cc(CSc2cc(F)ccc2F)ccc1F	ZINC000229753821	260139836	/nfs/dbraw/zinc/13/98/36/260139836.db2.gz	BZGCAFURCGMPMY-UHFFFAOYSA-N	0	0	279.286	4.268	20	30		CIEDRN
C=CCC(C)(C)C(=O)N(Cc1ccccc1)c1ccncc1	ZINC000298091021	260143355	/nfs/dbraw/zinc/14/33/55/260143355.db2.gz	ZVKFASGWPOCWHX-UHFFFAOYSA-N	0	0	294.398	4.217	20	30		CIEDRN
N#CCc1ccc(N[C@H]2CCC[C@@H](C(F)(F)F)C2)cc1	ZINC000069380431	260149849	/nfs/dbraw/zinc/14/98/49/260149849.db2.gz	QQRXEBSKAPTDHC-OCCSQVGLSA-N	0	0	282.309	4.286	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CCc2sccc2[C@H]1CC	ZINC000298452515	260154372	/nfs/dbraw/zinc/15/43/72/260154372.db2.gz	VUKXCGCGINXZBY-CYBMUJFWSA-N	0	0	277.433	4.186	20	30		CIEDRN
Cc1cc(Cl)c(C(C)C)cc1Oc1cnc(C#N)cn1	ZINC000071179282	260160363	/nfs/dbraw/zinc/16/03/63/260160363.db2.gz	NEGGDYBIJBWYDV-UHFFFAOYSA-N	0	0	287.750	4.226	20	30		CIEDRN
CC(C)(C#N)CCCNc1ccccc1OC(F)(F)F	ZINC000087597073	260191767	/nfs/dbraw/zinc/19/17/67/260191767.db2.gz	HMXIVWRWBJYUDZ-UHFFFAOYSA-N	0	0	286.297	4.327	20	30		CIEDRN
CC(C)(C#N)CCCNc1cccc(Cl)c1F	ZINC000087597247	260191793	/nfs/dbraw/zinc/19/17/93/260191793.db2.gz	JLMVWIQNHJUHAR-UHFFFAOYSA-N	0	0	254.736	4.221	20	30		CIEDRN
CC(C)(C#N)CCCNc1cccc(OC(F)(F)F)c1	ZINC000087597217	260191877	/nfs/dbraw/zinc/19/18/77/260191877.db2.gz	AEJYEWPMGQWTFE-UHFFFAOYSA-N	0	0	286.297	4.327	20	30		CIEDRN
C[C@@H]1Cc2ccccc2N(CCCC(C)(C)C#N)C1	ZINC000087608739	260192186	/nfs/dbraw/zinc/19/21/86/260192186.db2.gz	FQRXNGWMAJXNOT-CQSZACIVSA-N	0	0	256.393	4.015	20	30		CIEDRN
Cc1ccc2[nH]c(SCCCC(C)(C)C#N)nc2c1	ZINC000087609162	260192425	/nfs/dbraw/zinc/19/24/25/260192425.db2.gz	OCFCURBBUOHTMJ-UHFFFAOYSA-N	0	0	273.405	4.293	20	30		CIEDRN
COc1cc(OC)c(NCCCC(C)(C)C#N)cc1Cl	ZINC000087597037	260215423	/nfs/dbraw/zinc/21/54/23/260215423.db2.gz	DURMFAIAMOVKOF-UHFFFAOYSA-N	0	0	296.798	4.099	20	30		CIEDRN
CCCOc1ccc(NCCCC(C)(C)C#N)cc1	ZINC000087598090	260215555	/nfs/dbraw/zinc/21/55/55/260215555.db2.gz	AOBKFUAGISNHAH-UHFFFAOYSA-N	0	0	260.381	4.217	20	30		CIEDRN
CCCCn1c(C)c(C)nc1SCCCSCC#N	ZINC000075076131	260289616	/nfs/dbraw/zinc/28/96/16/260289616.db2.gz	AHLQJXBFKDYTPQ-UHFFFAOYSA-N	0	0	297.493	4.039	20	30		CIEDRN
CCCCCC(=O)Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000088191908	260290091	/nfs/dbraw/zinc/29/00/91/260290091.db2.gz	WYIVLPVMXGRFSU-UHFFFAOYSA-N	0	0	284.281	4.096	20	30		CIEDRN
N#CCc1cccc(NC2CC(c3cccc(F)c3)C2)c1	ZINC000313428633	260293182	/nfs/dbraw/zinc/29/31/82/260293182.db2.gz	OYZYAWGEUWPIQQ-UHFFFAOYSA-N	0	0	280.346	4.250	20	30		CIEDRN
N#CCc1cccc(NCc2cccc(C3CC3)c2)c1	ZINC000313475098	260297620	/nfs/dbraw/zinc/29/76/20/260297620.db2.gz	GYUPASRALVGGFD-UHFFFAOYSA-N	0	0	262.356	4.242	20	30		CIEDRN
CC(C)(C#N)CCCCSc1cccc([N+](=O)[O-])c1	ZINC000313546890	260301822	/nfs/dbraw/zinc/30/18/22/260301822.db2.gz	NLKHQURMRSDXDZ-UHFFFAOYSA-N	0	0	278.377	4.407	20	30		CIEDRN
CC(C)(C#N)CCCSc1cccc([N+](=O)[O-])c1	ZINC000313541031	260302077	/nfs/dbraw/zinc/30/20/77/260302077.db2.gz	IQXDVDNLDXWBBO-UHFFFAOYSA-N	0	0	264.350	4.017	20	30		CIEDRN
CC[C@@H](CC(=O)Nc1sc2c(c1C#N)CCC2)C(C)C	ZINC000517921414	260317202	/nfs/dbraw/zinc/31/72/02/260317202.db2.gz	LTYDBRFDARTFLE-NSHDSACASA-N	0	0	290.432	4.119	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(C[C@H](C)c2ccccc2)no1	ZINC000518006912	260334109	/nfs/dbraw/zinc/33/41/09/260334109.db2.gz	VDWFCQKEARZBKO-UONOGXRCSA-N	0	0	270.376	4.486	20	30		CIEDRN
CC(C)COc1ccc(/C=C\c2ccc(C#N)cn2)cc1	ZINC000518038130	260337239	/nfs/dbraw/zinc/33/72/39/260337239.db2.gz	DLFCWUZHBXOOEF-CLTKARDFSA-N	0	0	278.355	4.158	20	30		CIEDRN
CC[C@@H](C)n1ncc(NC2CCC(C)(C#N)CC2)c1C	ZINC000449287485	260362482	/nfs/dbraw/zinc/36/24/82/260362482.db2.gz	WTGIUYYMPDMUJM-XEBKBJJBSA-N	0	0	274.412	4.047	20	30		CIEDRN
Cc1ccsc1CNc1cccc(Cl)c1C#N	ZINC000085273689	260372579	/nfs/dbraw/zinc/37/25/79/260372579.db2.gz	AFSSHUCYSDCQRE-UHFFFAOYSA-N	0	0	262.765	4.194	20	30		CIEDRN
N#Cc1ccc(N[C@@H](c2ccccc2)C2CC2)c(F)c1	ZINC000094195335	260389743	/nfs/dbraw/zinc/38/97/43/260389743.db2.gz	FLDJJHDANYOBSY-KRWDZBQOSA-N	0	0	266.319	4.261	20	30		CIEDRN
C=CC1CCN(C(=O)C(C)(C)c2ccc(Cl)cc2)CC1	ZINC000518382413	260393316	/nfs/dbraw/zinc/39/33/16/260393316.db2.gz	VRQCDIGXLZLCOP-UHFFFAOYSA-N	0	0	291.822	4.042	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N[C@H](C)c1ccccc1SC	ZINC000409629583	260420760	/nfs/dbraw/zinc/42/07/60/260420760.db2.gz	ADFAFIYFWZTBKH-OLZOCXBDSA-N	0	0	292.448	4.123	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)C[C@@H](c1ccccc1)C(C)C	ZINC000410118398	260462042	/nfs/dbraw/zinc/46/20/42/260462042.db2.gz	HTPSMQUAFVLUCF-IAGOWNOFSA-N	0	0	273.420	4.287	20	30		CIEDRN
C[C@@H]1CCCCCN1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000408168434	260463556	/nfs/dbraw/zinc/46/35/56/260463556.db2.gz	JATUFMZSSKPYRM-CQSZACIVSA-N	0	0	299.418	4.284	20	30		CIEDRN
Cc1ccc([C@H](C)N[C@@H](CCC#N)c2ccccc2)o1	ZINC000090664832	260464862	/nfs/dbraw/zinc/46/48/62/260464862.db2.gz	JLWDOHMAZBVAEK-HOCLYGCPSA-N	0	0	268.360	4.284	20	30		CIEDRN
Cc1noc(C)c1-c1ccc(OCCC(C)(C)C#N)cc1	ZINC000410299055	260481248	/nfs/dbraw/zinc/48/12/48/260481248.db2.gz	TVBVPRFDBXIVCL-UHFFFAOYSA-N	0	0	284.359	4.277	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)CCc1ccccc1	ZINC000410349426	260488352	/nfs/dbraw/zinc/48/83/52/260488352.db2.gz	AGQQCNJVFKEPRL-UHFFFAOYSA-N	0	0	279.383	4.377	20	30		CIEDRN
CCn1c2ccc(C#N)cc2nc1-c1ccc(SC)cc1	ZINC000092235542	260491370	/nfs/dbraw/zinc/49/13/70/260491370.db2.gz	ODRUYQRASGIVAX-UHFFFAOYSA-N	0	0	293.395	4.317	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1sc(C)c(CC)c1C#N	ZINC000410438487	260527040	/nfs/dbraw/zinc/52/70/40/260527040.db2.gz	UXMXNNSZQQOLOD-UHFFFAOYSA-N	0	0	276.405	4.031	20	30		CIEDRN
C[C@H](NC(=O)C1(C#N)CCCCC1)c1ccc(Cl)s1	ZINC000044385929	260645674	/nfs/dbraw/zinc/64/56/74/260645674.db2.gz	GTUBSMLNRROMFD-JTQLQIEISA-N	0	0	296.823	4.053	20	30		CIEDRN
CCCc1ccccc1NC(=O)C1(C#N)CCCCC1	ZINC000044385937	260645738	/nfs/dbraw/zinc/64/57/38/260645738.db2.gz	ZGPRCNMIRSHBJT-UHFFFAOYSA-N	0	0	270.376	4.052	20	30		CIEDRN
CCSc1nnc(S[C@@H](C#N)C2CCCCC2)s1	ZINC000115184561	260674662	/nfs/dbraw/zinc/67/46/62/260674662.db2.gz	YJAMBHFNWYKVHJ-JTQLQIEISA-N	0	0	299.490	4.215	20	30		CIEDRN
CCCCCCCC(=O)N(C)Cc1ccc(Cl)nc1	ZINC000119253781	260692718	/nfs/dbraw/zinc/69/27/18/260692718.db2.gz	OGRUDESASBNIQC-UHFFFAOYSA-N	0	0	282.815	4.054	20	30		CIEDRN
Cc1ccc(Cl)cc1NCc1cccc(F)c1C#N	ZINC000427512402	260755699	/nfs/dbraw/zinc/75/56/99/260755699.db2.gz	UXQNGHXVIDONFT-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
CC(C)Oc1ccccc1NCc1cccc(F)c1C#N	ZINC000427543580	260765769	/nfs/dbraw/zinc/76/57/69/260765769.db2.gz	NDDVBBCANCFZSL-UHFFFAOYSA-N	0	0	284.334	4.097	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1csc(C(C)C)n1	ZINC000156841555	260809268	/nfs/dbraw/zinc/80/92/68/260809268.db2.gz	SZEYUWQQGAAPLX-UHFFFAOYSA-N	0	0	280.437	4.085	20	30		CIEDRN
CC(C)O[C@H](CSCC1(C#N)CC1)c1ccccc1	ZINC000427707767	260813430	/nfs/dbraw/zinc/81/34/30/260813430.db2.gz	SEQKGJNDXDHLII-OAHLLOKOSA-N	0	0	275.417	4.190	20	30		CIEDRN
Cc1ccc(N(CCC#N)C(=O)[C@H](C)c2cccs2)cc1	ZINC000157474982	260841443	/nfs/dbraw/zinc/84/14/43/260841443.db2.gz	SHQPWMBEGXQLIJ-CQSZACIVSA-N	0	0	298.411	4.107	20	30		CIEDRN
CCCn1c2cccc(F)c2nc1-c1ccc(C#N)cc1F	ZINC000448110382	260841968	/nfs/dbraw/zinc/84/19/68/260841968.db2.gz	RRWAQZKUGXZFPE-UHFFFAOYSA-N	0	0	297.308	4.263	20	30		CIEDRN
C=CCC[C@@H](C(=O)NC[C@H](C)C(F)(F)F)c1ccccc1	ZINC000427817461	260846301	/nfs/dbraw/zinc/84/63/01/260846301.db2.gz	LTUZCEZTAUAPTH-GXTWGEPZSA-N	0	0	299.336	4.051	20	30		CIEDRN
Cc1ccccc1[C@H](C)CC(=O)N[C@@]1(C#N)CCC[C@@H](C)C1	ZINC000247566267	260878596	/nfs/dbraw/zinc/87/85/96/260878596.db2.gz	VRYQNBBXQYOPRE-OGWOLHLISA-N	0	0	298.430	4.077	20	30		CIEDRN
CCCCCNC(=O)c1sc2ccc(C#N)cc2c1C	ZINC000428001756	260902455	/nfs/dbraw/zinc/90/24/55/260902455.db2.gz	SMERLKWYOOZTJO-UHFFFAOYSA-N	0	0	286.400	4.001	20	30		CIEDRN
Cc1c(F)cccc1NCc1cccc(OCCCC#N)c1	ZINC000159609446	260920498	/nfs/dbraw/zinc/92/04/98/260920498.db2.gz	YJDJKPPOSLZSKS-UHFFFAOYSA-N	0	0	298.361	4.429	20	30		CIEDRN
CSc1ccc(NCc2ccc(C#N)c(C)c2)cc1	ZINC000443980003	260944106	/nfs/dbraw/zinc/94/41/06/260944106.db2.gz	QMRAFXWDVKDLLN-UHFFFAOYSA-N	0	0	268.385	4.201	20	30		CIEDRN
C=CCCC(=O)N(Cc1ccsc1)c1ccccc1	ZINC000102259358	260970906	/nfs/dbraw/zinc/97/09/06/260970906.db2.gz	KCJRCILTAHLPER-UHFFFAOYSA-N	0	0	271.385	4.248	20	30		CIEDRN
C=CCOCCCC(=O)Nc1ccccc1CCC(C)C	ZINC000525709830	261055416	/nfs/dbraw/zinc/05/54/16/261055416.db2.gz	NFJLFTAGDNDSMS-UHFFFAOYSA-N	0	0	289.419	4.197	20	30		CIEDRN
CC(C)Oc1ccc(NCCCC(C)(C)C#N)cc1C#N	ZINC000151972982	261057771	/nfs/dbraw/zinc/05/77/71/261057771.db2.gz	HWBUSHOZYQZKBL-UHFFFAOYSA-N	0	0	285.391	4.087	20	30		CIEDRN
CC[C@H](Nc1ccn(CCC#N)n1)c1ccc(Cl)cc1	ZINC000152771437	261069303	/nfs/dbraw/zinc/06/93/03/261069303.db2.gz	IAJMLZZPBDZEHJ-AWEZNQCLSA-N	0	0	288.782	4.013	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N1CCC2(CCCC2)CC1	ZINC000153105176	261073481	/nfs/dbraw/zinc/07/34/81/261073481.db2.gz	PHFMMWFEXSNOOI-UHFFFAOYSA-N	0	0	297.402	4.055	20	30		CIEDRN
CC(C)(C#N)CCCNc1cccc(OCCCC#N)c1	ZINC000153416537	261078303	/nfs/dbraw/zinc/07/83/03/261078303.db2.gz	NWXJZNZWVBIAAD-UHFFFAOYSA-N	0	0	285.391	4.111	20	30		CIEDRN
N#CCC[C@H](C#N)COc1ccc(Cc2ccccc2)cc1	ZINC000153853513	261083793	/nfs/dbraw/zinc/08/37/93/261083793.db2.gz	FCQBNILPNWJKBX-GOSISDBHSA-N	0	0	290.366	4.100	20	30		CIEDRN
C/C=C(\C=C\C(=O)N(Cc1ccc(C#N)cc1)C(C)C)CC	ZINC000153965586	261086207	/nfs/dbraw/zinc/08/62/07/261086207.db2.gz	JYIGGMADYDVJIB-RHUIFCPUSA-N	0	0	296.414	4.208	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@@H]1C[C@H](C(C)C)c2ccccc21	ZINC000448285280	261089968	/nfs/dbraw/zinc/08/99/68/261089968.db2.gz	ILTOBFIVVZBQLJ-IAGOWNOFSA-N	0	0	286.419	4.089	20	30		CIEDRN
CCN(C[C@H](C)C#N)C(=O)C1=C(c2ccccc2)CCCC1	ZINC000448727810	261114410	/nfs/dbraw/zinc/11/44/10/261114410.db2.gz	ZWEFTTXWVNNCNI-OAHLLOKOSA-N	0	0	296.414	4.022	20	30		CIEDRN
Cc1c(C#N)cccc1NCc1ncc(C(C)(C)C)s1	ZINC000448337305	261118293	/nfs/dbraw/zinc/11/82/93/261118293.db2.gz	ODNJZONPFSXWSJ-UHFFFAOYSA-N	0	0	285.416	4.233	20	30		CIEDRN
C=CCCCNC(=O)N1CCCC[C@@H]1c1ccc(C)cc1	ZINC000448389746	261139223	/nfs/dbraw/zinc/13/92/23/261139223.db2.gz	SECPFFOTAWXTKH-QGZVFWFLSA-N	0	0	286.419	4.198	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)[C@@H]1CCCCC1(C)C	ZINC000448400385	261142855	/nfs/dbraw/zinc/14/28/55/261142855.db2.gz	RWGVXWLNCGSIEH-AWEZNQCLSA-N	0	0	278.440	4.134	20	30		CIEDRN
CC(C)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1	ZINC000173538306	261164790	/nfs/dbraw/zinc/16/47/90/261164790.db2.gz	DCNAFIZPUBRKFQ-UHFFFAOYSA-N	0	0	298.317	4.084	20	30		CIEDRN
N#Cc1ccccc1SCc1cnn(-c2ccccc2)c1	ZINC000173710146	261168876	/nfs/dbraw/zinc/16/88/76/261168876.db2.gz	OMYHPZZCTVQECO-UHFFFAOYSA-N	0	0	291.379	4.036	20	30		CIEDRN
CCN(Cc1ccc(OC(C)C)c(Cl)c1)C[C@H](C)C#N	ZINC000187792858	261196461	/nfs/dbraw/zinc/19/64/61/261196461.db2.gz	WTEUYIKSDULFKD-CYBMUJFWSA-N	0	0	294.826	4.109	20	30		CIEDRN
C=C[C@H](C)NC(=O)N(CC1CCC1)[C@@H](C)c1ccccc1	ZINC000464757132	261220832	/nfs/dbraw/zinc/22/08/32/261220832.db2.gz	UJHSVEAXBZYBSJ-GJZGRUSLSA-N	0	0	286.419	4.134	20	30		CIEDRN
CC[C@@H]1CCCCN1C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000160730278	261225069	/nfs/dbraw/zinc/22/50/69/261225069.db2.gz	YXRHVRISDQJALZ-IAGOWNOFSA-N	0	0	299.418	4.006	20	30		CIEDRN
CCc1ccccc1NC(=O)c1cccc(SCC#N)c1	ZINC000175517542	261232665	/nfs/dbraw/zinc/23/26/65/261232665.db2.gz	LJICAVDMABEWNG-UHFFFAOYSA-N	0	0	296.395	4.117	20	30		CIEDRN
Cc1ccc([C@H]2C[C@H](C)CCN2Cc2ccccc2C#N)o1	ZINC000464829435	261237330	/nfs/dbraw/zinc/23/73/30/261237330.db2.gz	JLHHEIHVDRIKLK-RDTXWAMCSA-N	0	0	294.398	4.433	20	30		CIEDRN
N#CCCCCSCc1ccccc1OC(F)F	ZINC000161191938	261240167	/nfs/dbraw/zinc/24/01/67/261240167.db2.gz	XVEUQZGNXHOKPU-UHFFFAOYSA-N	0	0	271.332	4.215	20	30		CIEDRN
CCc1nc(CSCCCC(C)(C)C#N)cs1	ZINC000161465399	261247638	/nfs/dbraw/zinc/24/76/38/261247638.db2.gz	STYRVLYZHXONKP-UHFFFAOYSA-N	0	0	268.451	4.269	20	30		CIEDRN
CO[C@H](C)c1nc(CSCCCC(C)(C)C#N)cs1	ZINC000161910608	261262513	/nfs/dbraw/zinc/26/25/13/261262513.db2.gz	VWUQNAIZYMUIRM-LLVKDONJSA-N	0	0	298.477	4.414	20	30		CIEDRN
C[C@H](C#N)Oc1ccccc1N[C@H](C)CCc1ccco1	ZINC000162276494	261275706	/nfs/dbraw/zinc/27/57/06/261275706.db2.gz	AQGOBMKYCXROFD-ZIAGYGMSSA-N	0	0	284.359	4.004	20	30		CIEDRN
CCC(CC)CN(CCC#N)C(=O)Nc1ccc(F)cc1	ZINC000176339061	261277084	/nfs/dbraw/zinc/27/70/84/261277084.db2.gz	FCYCRATWXMXEFV-UHFFFAOYSA-N	0	0	291.370	4.009	20	30		CIEDRN
CCN(CCC#N)C(=O)c1ccc(C2CCCCC2)cc1	ZINC000103208501	261277194	/nfs/dbraw/zinc/27/71/94/261277194.db2.gz	YPSFBOWGEFWBND-UHFFFAOYSA-N	0	0	284.403	4.110	20	30		CIEDRN
CCC(CC)CN(CCC#N)C(=O)c1cc(C)c(C)s1	ZINC000104544991	261296364	/nfs/dbraw/zinc/29/63/64/261296364.db2.gz	QSXXQCXYGSSAFR-UHFFFAOYSA-N	0	0	292.448	4.157	20	30		CIEDRN
COc1ccc2ccccc2c1CNc1ccc(C#N)cc1	ZINC000301115582	261330536	/nfs/dbraw/zinc/33/05/36/261330536.db2.gz	XQVLUFKHTNREIZ-UHFFFAOYSA-N	0	0	288.350	4.332	20	30		CIEDRN
CO[C@H](CNc1ccc(C#N)c(Cl)c1)c1ccccc1	ZINC000301340982	261332777	/nfs/dbraw/zinc/33/27/77/261332777.db2.gz	FQKBALZYWXGJFJ-MRXNPFEDSA-N	0	0	286.762	4.011	20	30		CIEDRN
N#Cc1cccc(SCCCC(=O)c2ccccc2)c1	ZINC000177103312	261333726	/nfs/dbraw/zinc/33/37/26/261333726.db2.gz	WGWFKVLSEMGDJP-UHFFFAOYSA-N	0	0	281.380	4.313	20	30		CIEDRN
CC(C)(C)SCCNc1c(C#N)cnc2ccccc21	ZINC000301435027	261333929	/nfs/dbraw/zinc/33/39/29/261333929.db2.gz	WOFJSHFZHJAWSD-UHFFFAOYSA-N	0	0	285.416	4.050	20	30		CIEDRN
CC(C)Sc1ccc(Cl)cc1N[C@H](C)C#N	ZINC000105413279	261358569	/nfs/dbraw/zinc/35/85/69/261358569.db2.gz	BSKJVWDSPDBCRP-SECBINFHSA-N	0	0	254.786	4.164	20	30		CIEDRN
C=CCCOc1ccc(Cl)cc1Br	ZINC000303813273	261363356	/nfs/dbraw/zinc/36/33/56/261363356.db2.gz	NYDMBOCEJFNAKC-UHFFFAOYSA-N	0	0	261.546	4.057	20	30		CIEDRN
C[C@H](NCc1cccc(C#N)c1)c1c(F)cccc1Cl	ZINC000177713984	261367546	/nfs/dbraw/zinc/36/75/46/261367546.db2.gz	BMFWVPIMSUJUMK-NSHDSACASA-N	0	0	288.753	4.202	20	30		CIEDRN
N#Cc1cccc(CNc2cccc(C(F)F)c2)c1	ZINC000178352398	261387246	/nfs/dbraw/zinc/38/72/46/261387246.db2.gz	SFMRXUXXZICIKI-UHFFFAOYSA-N	0	0	258.271	4.108	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)C[C@@H](C)c1cccc(F)c1	ZINC000178379969	261389146	/nfs/dbraw/zinc/38/91/46/261389146.db2.gz	BBRMIULGXAXCKE-GFCCVEGCSA-N	0	0	296.345	4.138	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000466360456	261394646	/nfs/dbraw/zinc/39/46/46/261394646.db2.gz	DTAFXIUJGKUMLR-ABAIWWIYSA-N	0	0	299.336	4.485	20	30		CIEDRN
CCCCCN(C(=O)Nc1cccc(C#N)c1C)C(C)C	ZINC000178572227	261398271	/nfs/dbraw/zinc/39/82/71/261398271.db2.gz	KFWWDFZUNAXVPK-UHFFFAOYSA-N	0	0	287.407	4.299	20	30		CIEDRN
Cc1ccc(F)cc1CNc1cccc(OCCCC#N)c1	ZINC000180089865	261421290	/nfs/dbraw/zinc/42/12/90/261421290.db2.gz	JXOWXNIEZAYFNT-UHFFFAOYSA-N	0	0	298.361	4.429	20	30		CIEDRN
CCc1cc(NCc2ccc(C#N)cc2)ccc1C	ZINC000182417006	261443135	/nfs/dbraw/zinc/44/31/35/261443135.db2.gz	ZDXDMYCXBZQPMO-UHFFFAOYSA-N	0	0	250.345	4.041	20	30		CIEDRN
CC[C@H](C)[C@@H]1CCCCN1c1ccc(Cl)c(C#N)n1	ZINC000462702389	261566239	/nfs/dbraw/zinc/56/62/39/261566239.db2.gz	PLOODLHCFZBPOZ-FZMZJTMJSA-N	0	0	277.799	4.012	20	30		CIEDRN
CC(C)c1cccc(C(C)C)c1NC(=O)N(C)CCC#N	ZINC000176539564	261657081	/nfs/dbraw/zinc/65/70/81/261657081.db2.gz	XBSPAKDPOSZCMP-UHFFFAOYSA-N	0	0	287.407	4.311	20	30		CIEDRN
N#Cc1ccc(CNc2cccc(COCC3CC3)c2)s1	ZINC000176956123	261678698	/nfs/dbraw/zinc/67/86/98/261678698.db2.gz	ZAOZLVWJHFSSOF-UHFFFAOYSA-N	0	0	298.411	4.158	20	30		CIEDRN
C[C@H](Nc1ccc(CC#N)cc1)c1ncc(C(C)(C)C)o1	ZINC000177414686	261699947	/nfs/dbraw/zinc/69/99/47/261699947.db2.gz	YZHUBTPNMPBVQW-LBPRGKRZSA-N	0	0	283.375	4.211	20	30		CIEDRN
N#Cc1ccc(CNc2ccccc2OC2CCCC2)o1	ZINC000178194944	261732442	/nfs/dbraw/zinc/73/24/42/261732442.db2.gz	ZJXOWOMTGBCVOS-UHFFFAOYSA-N	0	0	282.343	4.085	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cc(C)ccc1Br	ZINC000188043703	261830416	/nfs/dbraw/zinc/83/04/16/261830416.db2.gz	IBKJLJZOLXTASV-CQSZACIVSA-N	0	0	296.208	4.298	20	30		CIEDRN
C[C@H](C#N)Oc1ccccc1NC(=O)C=C1CCC(C)CC1	ZINC000182035727	261920974	/nfs/dbraw/zinc/92/09/74/261920974.db2.gz	YZLMGFWQUSIYPD-ARLHGKGLSA-N	0	0	298.386	4.052	20	30		CIEDRN
Cc1cncc([C@@H](C)Nc2cccc(OCCCC#N)c2)c1	ZINC000184437525	262020703	/nfs/dbraw/zinc/02/07/03/262020703.db2.gz	JYNAFUSLKCNCKY-OAHLLOKOSA-N	0	0	295.386	4.246	20	30		CIEDRN
CCCCCCCC(=O)N(C)C[C@@H](C)c1nccs1	ZINC000184975770	262036058	/nfs/dbraw/zinc/03/60/58/262036058.db2.gz	JLDUWZONUJZNPN-CYBMUJFWSA-N	0	0	282.453	4.066	20	30		CIEDRN
CCN(CCC#N)C(=O)CC1CCC(c2ccccc2)CC1	ZINC000108463232	262049515	/nfs/dbraw/zinc/04/95/15/262049515.db2.gz	ZJAOYIGRFSDTSW-UHFFFAOYSA-N	0	0	298.430	4.113	20	30		CIEDRN
C=CCn1c2ccccc2nc1SCCCOC(C)C	ZINC000491793232	262058173	/nfs/dbraw/zinc/05/81/73/262058173.db2.gz	DKSPQDOHUWGSPI-UHFFFAOYSA-N	0	0	290.432	4.130	20	30		CIEDRN
Cc1ccc(N[C@@H]2CCC[C@@H](C#N)C2)cc1OC(F)F	ZINC000185729769	262068477	/nfs/dbraw/zinc/06/84/77/262068477.db2.gz	SSBHVWPYLZQFKS-VXGBXAGGSA-N	0	0	280.318	4.091	20	30		CIEDRN
CCN(C(=O)C[C@H]1C=CCCC1)[C@@H](C)c1ccc(C#N)cc1	ZINC000186525899	262097337	/nfs/dbraw/zinc/09/73/37/262097337.db2.gz	NCUFWQPXCQKPJS-HOTGVXAUSA-N	0	0	296.414	4.214	20	30		CIEDRN
CC(F)(F)CCCNc1cccc(Cl)c1C#N	ZINC000390073284	262105004	/nfs/dbraw/zinc/10/50/04/262105004.db2.gz	ORVZGVNYZMHFHH-UHFFFAOYSA-N	0	0	258.699	4.059	20	30		CIEDRN
CC(F)(F)CCCNc1ccc(C#N)c(Cl)c1	ZINC000390073909	262106931	/nfs/dbraw/zinc/10/69/31/262106931.db2.gz	PPBAHJRHFJUHEE-UHFFFAOYSA-N	0	0	258.699	4.059	20	30		CIEDRN
N#CCCCOc1cccc(NC(=O)C[C@H]2C=CCCC2)c1	ZINC000186937046	262117350	/nfs/dbraw/zinc/11/73/50/262117350.db2.gz	AZMSEIHSQPLYIL-HNNXBMFYSA-N	0	0	298.386	4.054	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1C[C@H](c2cccs2)C[C@H]1C	ZINC000364068469	262135181	/nfs/dbraw/zinc/13/51/81/262135181.db2.gz	SLTCNVLMZUUFFD-BFHYXJOUSA-N	0	0	277.433	4.055	20	30		CIEDRN
C[C@@H](CCC#N)Sc1ccc(C#N)c(C(F)(F)F)c1	ZINC000188329217	262153954	/nfs/dbraw/zinc/15/39/54/262153954.db2.gz	NZHDZDVWIDWEER-VIFPVBQESA-N	0	0	284.306	4.361	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1ccc(/C=C/C)cc1	ZINC000497405613	262155888	/nfs/dbraw/zinc/15/58/88/262155888.db2.gz	KEKKPVXEIGKRTI-FNORWQNLSA-N	0	0	258.365	4.150	20	30		CIEDRN
C=CCOc1ccccc1C(=O)Nc1ccccc1CCC	ZINC000497440819	262161546	/nfs/dbraw/zinc/16/15/46/262161546.db2.gz	CDGBLNKNWBJPPQ-UHFFFAOYSA-N	0	0	295.382	4.456	20	30		CIEDRN
C=C(C)CNC1(c2c(Cl)cccc2Cl)CC1	ZINC000390257196	262166136	/nfs/dbraw/zinc/16/61/36/262166136.db2.gz	MLWVHGGXJHIXPS-UHFFFAOYSA-N	0	0	256.176	4.148	20	30		CIEDRN
COCCC1(CNc2ccc(CC#N)cc2)CCCCC1	ZINC000189062422	262167507	/nfs/dbraw/zinc/16/75/07/262167507.db2.gz	DKMSFRBAGIQMLA-UHFFFAOYSA-N	0	0	286.419	4.152	20	30		CIEDRN
C=C1CCN(C(=O)c2sc3cc(F)ccc3c2C)CC1	ZINC000497507605	262171289	/nfs/dbraw/zinc/17/12/89/262171289.db2.gz	OWBWBEGAIBIYDM-UHFFFAOYSA-N	0	0	289.375	4.141	20	30		CIEDRN
C=CCOc1ccccc1C(=O)Nc1ccc(C)c(C)c1	ZINC000497518670	262172936	/nfs/dbraw/zinc/17/29/36/262172936.db2.gz	ISBQSCHLURJFHM-UHFFFAOYSA-N	0	0	281.355	4.121	20	30		CIEDRN
Cc1cc(C(C)(C)C)cc(C)c1C[S@@](=O)CCCC#N	ZINC000190731696	262185359	/nfs/dbraw/zinc/18/53/59/262185359.db2.gz	VTLDHSQELFGLDJ-FQEVSTJZSA-N	0	0	291.460	4.153	20	30		CIEDRN
C[C@@H](Sc1cc(C#N)ccn1)c1cccc(Cl)c1	ZINC000497672189	262187591	/nfs/dbraw/zinc/18/75/91/262187591.db2.gz	URJMTIBZGUGWNS-SNVBAGLBSA-N	0	0	274.776	4.460	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H]1c1ccc(C)cc1	ZINC000364300143	262197001	/nfs/dbraw/zinc/19/70/01/262197001.db2.gz	AZMHGMGFSDBNFV-RDJZCZTQSA-N	0	0	271.404	4.261	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H]1c1ccc(F)c(F)c1	ZINC000364311780	262199021	/nfs/dbraw/zinc/19/90/21/262199021.db2.gz	AAOIWGGKBKTQNS-BLLLJJGKSA-N	0	0	293.357	4.231	20	30		CIEDRN
CC(C)OCc1ccc(N[C@@H]2CCC[C@@H](C#N)C2)cc1	ZINC000193087029	262216081	/nfs/dbraw/zinc/21/60/81/262216081.db2.gz	RSQMQBNLTAZQAM-NVXWUHKLSA-N	0	0	272.392	4.106	20	30		CIEDRN
C=CCCC(=O)N1CCCC[C@@H]1CCCc1ccccc1	ZINC000502460566	262216106	/nfs/dbraw/zinc/21/61/06/262216106.db2.gz	GSTBMWHVGRBKJC-GOSISDBHSA-N	0	0	285.431	4.357	20	30		CIEDRN
Cc1ccc(N[C@H]2CCC[C@@H](C#N)C2)cc1-c1ncco1	ZINC000193268219	262219157	/nfs/dbraw/zinc/21/91/57/262219157.db2.gz	ZOPOECXOTPZFCK-KGLIPLIRSA-N	0	0	281.359	4.144	20	30		CIEDRN
N#Cc1ccc(F)c(CNc2cccc3ccccc32)c1	ZINC000020039260	262227108	/nfs/dbraw/zinc/22/71/08/262227108.db2.gz	YECLTWJMUOZLPQ-UHFFFAOYSA-N	0	0	276.314	4.463	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1ccc(C(C)C)nc1CC	ZINC000497934716	262235632	/nfs/dbraw/zinc/23/56/32/262235632.db2.gz	BNVNESXQDYRUOL-AWEZNQCLSA-N	0	0	288.435	4.242	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1ccc(C(C)C)nc1CC	ZINC000497934717	262235714	/nfs/dbraw/zinc/23/57/14/262235714.db2.gz	BNVNESXQDYRUOL-CQSZACIVSA-N	0	0	288.435	4.242	20	30		CIEDRN
CC[C@@H](c1ccccc1)N(CC)C(=O)c1sccc1C#N	ZINC000497990007	262243688	/nfs/dbraw/zinc/24/36/88/262243688.db2.gz	NSBFAOLLNWWVJK-HNNXBMFYSA-N	0	0	298.411	4.233	20	30		CIEDRN
N#C[C@@H]1CCC[C@@H](Nc2csc3ccccc23)C1	ZINC000463237310	262279777	/nfs/dbraw/zinc/27/97/77/262279777.db2.gz	MCWNPNVJVNVUDX-VXGBXAGGSA-N	0	0	256.374	4.396	20	30		CIEDRN
COc1ccccc1[C@H](C)Sc1ccc(C#N)c(C)n1	ZINC000488054311	262280134	/nfs/dbraw/zinc/28/01/34/262280134.db2.gz	GODGKSFTUCWKBX-LBPRGKRZSA-N	0	0	284.384	4.124	20	30		CIEDRN
C=CCC1(C(=O)NC[C@H](C)Sc2ccccc2)CCC1	ZINC000188354071	262291414	/nfs/dbraw/zinc/29/14/14/262291414.db2.gz	UXKXGYMRBTYOII-AWEZNQCLSA-N	0	0	289.444	4.030	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cccc(Oc2ccccn2)c1	ZINC000188471959	262299223	/nfs/dbraw/zinc/29/92/23/262299223.db2.gz	HSIAAELDTQPUNH-GOSISDBHSA-N	0	0	296.370	4.415	20	30		CIEDRN
N#CCCCCSCCOc1ccccc1Cl	ZINC000161018909	262306977	/nfs/dbraw/zinc/30/69/77/262306977.db2.gz	BFXUGRWBHFHVTF-UHFFFAOYSA-N	0	0	269.797	4.146	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cc(C)ccc1Cl	ZINC000188522129	262307513	/nfs/dbraw/zinc/30/75/13/262307513.db2.gz	ZPLVCDLHOKWQSE-AWEZNQCLSA-N	0	0	251.757	4.189	20	30		CIEDRN
C=CCCCCSCc1nnc(-c2ccccc2)o1	ZINC000521412893	262316011	/nfs/dbraw/zinc/31/60/11/262316011.db2.gz	UFDLQEJXCCWFBZ-UHFFFAOYSA-N	0	0	274.389	4.326	20	30		CIEDRN
CC(C)Oc1ccccc1CSCCCCC#N	ZINC000161574869	262317451	/nfs/dbraw/zinc/31/74/51/262317451.db2.gz	BBKNLPDBJJDJGU-UHFFFAOYSA-N	0	0	263.406	4.401	20	30		CIEDRN
CC(C)(C)c1nc(CSCCCCC#N)cs1	ZINC000161581075	262317794	/nfs/dbraw/zinc/31/77/94/262317794.db2.gz	VILUSLYWWTUFMF-UHFFFAOYSA-N	0	0	268.451	4.368	20	30		CIEDRN
CCCC[C@H](CCC)NC(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000462201866	262318307	/nfs/dbraw/zinc/31/83/07/262318307.db2.gz	FDSFUBWYMXXADF-YOEHRIQHSA-N	0	0	286.419	4.137	20	30		CIEDRN
C=CCCCS[C@H](C)C(=O)NCc1ccc(Cl)cc1	ZINC000522758680	262339253	/nfs/dbraw/zinc/33/92/53/262339253.db2.gz	JBDUJGHXZQJJEZ-GFCCVEGCSA-N	0	0	297.851	4.044	20	30		CIEDRN
N#Cc1ccc(NCc2nc(-c3ccccc3)cs2)cc1	ZINC000058000504	262350327	/nfs/dbraw/zinc/35/03/27/262350327.db2.gz	MKKVUOSIRJXKKJ-UHFFFAOYSA-N	0	0	291.379	4.294	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@H](C)CCCc1ccccc1	ZINC000488812001	262397190	/nfs/dbraw/zinc/39/71/90/262397190.db2.gz	CSTJOGWNWDKIHA-SJLPKXTDSA-N	0	0	285.431	4.213	20	30		CIEDRN
C=CCC[C@H](NC(=O)N(C)CCCC)c1ccccc1	ZINC000160410214	262663140	/nfs/dbraw/zinc/66/31/40/262663140.db2.gz	ZHNPJEBBTLUOGN-INIZCTEOSA-N	0	0	274.408	4.135	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)C(C)(C)C(C)(F)F	ZINC000410823095	262666939	/nfs/dbraw/zinc/66/69/39/262666939.db2.gz	IPEGFIUNCSJYIE-UHFFFAOYSA-N	0	0	281.346	4.425	20	30		CIEDRN
C=CCC1(C(=O)Nc2cc(F)c(F)cc2OC)CCCC1	ZINC000410870508	262670545	/nfs/dbraw/zinc/67/05/45/262670545.db2.gz	DEWYLOSWTYTLFJ-UHFFFAOYSA-N	0	0	295.329	4.048	20	30		CIEDRN
C=CCCCC(=O)Nc1scc(C(C)(C)C)c1C#N	ZINC000410929427	262673509	/nfs/dbraw/zinc/67/35/09/262673509.db2.gz	MVSVUAXZILOOLN-UHFFFAOYSA-N	0	0	276.405	4.212	20	30		CIEDRN
CCCC(=O)Nc1sc2c(c1C#N)C[C@@H](C)C[C@@H]2C	ZINC000410969334	262674039	/nfs/dbraw/zinc/67/40/39/262674039.db2.gz	FLMRUBZYWMGZLH-UWVGGRQHSA-N	0	0	276.405	4.044	20	30		CIEDRN
C[C@@H]1CCc2sc(NC(=O)C3CCC3)c(C#N)c2[C@@H]1C	ZINC000410983084	262674646	/nfs/dbraw/zinc/67/46/46/262674646.db2.gz	IYCBAQPVSQXBDV-NXEZZACHSA-N	0	0	288.416	4.044	20	30		CIEDRN
C[C@H]1Cc2sc(NC(=O)CC3CC3)c(C#N)c2[C@H](C)C1	ZINC000411019918	262675158	/nfs/dbraw/zinc/67/51/58/262675158.db2.gz	VICZWNJMHRBXRJ-NXEZZACHSA-N	0	0	288.416	4.044	20	30		CIEDRN
CC(C)(C)c1cc(C#N)c(NC(=O)C2CCCC2)s1	ZINC000411007564	262675179	/nfs/dbraw/zinc/67/51/79/262675179.db2.gz	OBUYMDMYJLKTNJ-UHFFFAOYSA-N	0	0	276.405	4.046	20	30		CIEDRN
CC(C)[C@H](Nc1ncc(C#N)cc1F)c1ccc(F)cc1	ZINC000413043982	262754135	/nfs/dbraw/zinc/75/41/35/262754135.db2.gz	WOMUAWWRXVIZSH-HNNXBMFYSA-N	0	0	287.313	4.041	20	30		CIEDRN
Cc1ccc([C@@H]2CCCCN2c2ncc(C#N)cc2F)cc1	ZINC000413181530	262756185	/nfs/dbraw/zinc/75/61/85/262756185.db2.gz	ZWHKOWMXUTZDEM-KRWDZBQOSA-N	0	0	295.361	4.132	20	30		CIEDRN
N#Cc1cccc(N2CC3(CCCC3)[C@@H]2c2ccccc2)n1	ZINC000413365609	262761407	/nfs/dbraw/zinc/76/14/07/262761407.db2.gz	PFZLOICZSKPCCA-SFHVURJKSA-N	0	0	289.382	4.075	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)NC[C@@H](CC)CC(F)(F)F	ZINC000413447960	262764607	/nfs/dbraw/zinc/76/46/07/262764607.db2.gz	YLBPMRCWRCNOCD-NEPJUHHUSA-N	0	0	294.361	4.009	20	30		CIEDRN
CSc1cc(NC(=O)C2(C#N)CCCC2)ccc1Cl	ZINC000413948636	262793733	/nfs/dbraw/zinc/79/37/33/262793733.db2.gz	WKXUAGYBQWQOJI-UHFFFAOYSA-N	0	0	294.807	4.084	20	30		CIEDRN
C=CC[C@H](Cc1ccccc1)NC(=O)[C@@]1(C)CC=CCC1	ZINC000413985386	262796113	/nfs/dbraw/zinc/79/61/13/262796113.db2.gz	KAGVRJCTKRILSA-MJGOQNOKSA-N	0	0	283.415	4.036	20	30		CIEDRN
C=CC[C@@H](Cc1ccccc1)NC(=O)c1occc1C(C)C	ZINC000413990846	262797030	/nfs/dbraw/zinc/79/70/30/262797030.db2.gz	UKIHLAGFQSQONX-INIZCTEOSA-N	0	0	297.398	4.320	20	30		CIEDRN
CSc1cc(N[C@@H]2CC[C@H](C#N)C2)ccc1Cl	ZINC000414230839	262829387	/nfs/dbraw/zinc/82/93/87/262829387.db2.gz	GTAJXVBNDOGKBA-VHSXEESVSA-N	0	0	266.797	4.166	20	30		CIEDRN
C=CCC[C@@H](CCC)Nc1cccc([C@H]2CCC(=O)N2)c1	ZINC000414319880	262843236	/nfs/dbraw/zinc/84/32/36/262843236.db2.gz	RYCJWNYFXQFZSA-NVXWUHKLSA-N	0	0	286.419	4.185	20	30		CIEDRN
N#CCC[C@@H](NC(=O)C=C1CCCCC1)c1ccccc1	ZINC000269627089	262973537	/nfs/dbraw/zinc/97/35/37/262973537.db2.gz	UBZQPVKXHDTJGF-QGZVFWFLSA-N	0	0	282.387	4.038	20	30		CIEDRN
Cc1cccc(C)c1CNc1ccccc1O[C@H](C)C#N	ZINC000272428369	263004240	/nfs/dbraw/zinc/00/42/40/263004240.db2.gz	JBYLGOHVXCHXRZ-OAHLLOKOSA-N	0	0	280.371	4.206	20	30		CIEDRN
N#CCCN(CC1CC1)C(=O)Nc1csc2ccccc12	ZINC000272469436	263005004	/nfs/dbraw/zinc/00/50/04/263005004.db2.gz	RPZYSHYZNOKWEV-UHFFFAOYSA-N	0	0	299.399	4.059	20	30		CIEDRN
CC1(C#N)CCN(Cc2c(Cl)oc3ccccc32)CC1	ZINC000272472871	263005117	/nfs/dbraw/zinc/00/51/17/263005117.db2.gz	APTHNPXFXMYDCW-UHFFFAOYSA-N	0	0	288.778	4.212	20	30		CIEDRN
CC1(C#N)CCN(C(=O)Nc2csc3ccccc23)CC1	ZINC000272709702	263008414	/nfs/dbraw/zinc/00/84/14/263008414.db2.gz	XHXCROXDGIFAIE-UHFFFAOYSA-N	0	0	299.399	4.059	20	30		CIEDRN
N#CCOc1cccc(NC2CC(c3cccc(F)c3)C2)c1	ZINC000272918905	263010119	/nfs/dbraw/zinc/01/01/19/263010119.db2.gz	JJUTZVKRSMYIJJ-UHFFFAOYSA-N	0	0	296.345	4.086	20	30		CIEDRN
C[C@H](c1cccs1)c1noc(C2(C#N)CCCCC2)n1	ZINC000273877252	263020238	/nfs/dbraw/zinc/02/02/38/263020238.db2.gz	MMCODXWRNIAQFM-LLVKDONJSA-N	0	0	287.388	4.008	20	30		CIEDRN
N#C[C@@H]1CCC[C@H](Nc2ccc(N3CCCCC3)cc2)C1	ZINC000274220709	263022033	/nfs/dbraw/zinc/02/20/33/263022033.db2.gz	PQSRWTBYLBJLAW-WBVHZDCISA-N	0	0	283.419	4.171	20	30		CIEDRN
CC[C@@H](CC1CCCC1)C(=O)Nc1ccccc1C#N	ZINC000414670268	263028489	/nfs/dbraw/zinc/02/84/89/263028489.db2.gz	LWUIECPHEORKHN-AWEZNQCLSA-N	0	0	270.376	4.103	20	30		CIEDRN
CO[C@@H](C)c1nc(CSCCC(C)(C)C#N)cs1	ZINC000276618225	263037421	/nfs/dbraw/zinc/03/74/21/263037421.db2.gz	NEBJSTSKKXHSDF-JTQLQIEISA-N	0	0	284.450	4.024	20	30		CIEDRN
CC(C)(C#N)CCSCc1nc2ccccc2s1	ZINC000276652889	263037575	/nfs/dbraw/zinc/03/75/75/263037575.db2.gz	VMDCRCMMOBRFOD-UHFFFAOYSA-N	0	0	276.430	4.469	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)c1scc(C)c1Cl	ZINC000276919843	263038677	/nfs/dbraw/zinc/03/86/77/263038677.db2.gz	RSOKGBIYXVPQLV-UHFFFAOYSA-N	0	0	298.839	4.254	20	30		CIEDRN
CC(C)(C)[C@H]1C[C@H](Nc2ccc(CC#N)cc2)CS1	ZINC000277097102	263039763	/nfs/dbraw/zinc/03/97/63/263039763.db2.gz	GUGWIWIAZXMAFD-LSDHHAIUSA-N	0	0	274.433	4.085	20	30		CIEDRN
C=CCC1(C(=O)N2CCC[C@H](CSC)C2)CCCCC1	ZINC000452158380	263041500	/nfs/dbraw/zinc/04/15/00/263041500.db2.gz	HKIRZSGFOWWGHN-HNNXBMFYSA-N	0	0	295.492	4.115	20	30		CIEDRN
C[C@H](NC(=O)CC(C)(C)C#N)c1cccc(Cl)c1Cl	ZINC000278302795	263046769	/nfs/dbraw/zinc/04/67/69/263046769.db2.gz	ICPRRMNZLQELFC-VIFPVBQESA-N	0	0	299.201	4.110	20	30		CIEDRN
Cc1ccc([C@H]2[C@H](C)CCCN2C(=O)CC(C)(C)C#N)cc1	ZINC000278346302	263047050	/nfs/dbraw/zinc/04/70/50/263047050.db2.gz	MNWMVXQXDRETKZ-CRAIPNDOSA-N	0	0	298.430	4.235	20	30		CIEDRN
N#C[C@@H]1CC[C@H]([N@@H+]2CCC[C@@H]2c2nc3ccccc3s2)C1	ZINC000278562452	263048863	/nfs/dbraw/zinc/04/88/63/263048863.db2.gz	IMJYMKAPOXHYAR-VNHYZAJKSA-N	0	0	297.427	4.125	20	30		CIEDRN
Cn1c2ccc(Cl)cc2nc1S[C@H]1CC[C@H](C#N)C1	ZINC000278658151	263049534	/nfs/dbraw/zinc/04/95/34/263049534.db2.gz	WUUKSIKIQCHUKQ-ONGXEEELSA-N	0	0	291.807	4.011	20	30		CIEDRN
CC(C)(C#N)CC(=O)Nc1cccc(CCC(F)(F)F)c1	ZINC000278676756	263049774	/nfs/dbraw/zinc/04/97/74/263049774.db2.gz	BSDHDFRGNWPAIG-UHFFFAOYSA-N	0	0	298.308	4.060	20	30		CIEDRN
C=CC[C@H](C(=O)NCC(C)(C)C(C)C)c1ccccc1	ZINC000438398608	263056627	/nfs/dbraw/zinc/05/66/27/263056627.db2.gz	WOTVYLYNZFWQII-INIZCTEOSA-N	0	0	273.420	4.145	20	30		CIEDRN
C=CC[C@@H](C(=O)NCC(C)(C)C(C)C)c1ccccc1	ZINC000438398611	263056670	/nfs/dbraw/zinc/05/66/70/263056670.db2.gz	WOTVYLYNZFWQII-MRXNPFEDSA-N	0	0	273.420	4.145	20	30		CIEDRN
Cc1ccc(-c2ccc(C)c(NC(=O)C(C)(C)C#N)c2)o1	ZINC000279794089	263057465	/nfs/dbraw/zinc/05/74/65/263057465.db2.gz	KUNSANDPRSHQNX-UHFFFAOYSA-N	0	0	282.343	4.052	20	30		CIEDRN
CCN(C(=O)c1ccc(C(C)(C)C#N)cc1)c1ccccc1	ZINC000280191471	263059623	/nfs/dbraw/zinc/05/96/23/263059623.db2.gz	HEXCZGUSZBIGKY-UHFFFAOYSA-N	0	0	292.382	4.154	20	30		CIEDRN
CSc1ccc(CSC[C@H](C#N)CCC#N)cc1	ZINC000280228853	263059889	/nfs/dbraw/zinc/05/98/89/263059889.db2.gz	HCKFJVBNWDXWJI-ZDUSSCGKSA-N	0	0	276.430	4.085	20	30		CIEDRN
Cc1nn(C(C)C)cc1/C=C/C(=O)c1ccccc1Cl	ZINC000280885182	263064818	/nfs/dbraw/zinc/06/48/18/263064818.db2.gz	CPLSLOJMTSTRQH-CMDGGOBGSA-N	0	0	288.778	4.322	20	30		CIEDRN
CCN(C(=O)c1ccc(C(C)(C)C#N)cc1)C1CCCCC1	ZINC000280868930	263064902	/nfs/dbraw/zinc/06/49/02/263064902.db2.gz	MNGIPEGKQHAMJK-UHFFFAOYSA-N	0	0	298.430	4.283	20	30		CIEDRN
CCc1cccc(C)c1NCCCC1(C#N)CCOCC1	ZINC000280917563	263064978	/nfs/dbraw/zinc/06/49/78/263064978.db2.gz	CVTFNDRIADUEOZ-UHFFFAOYSA-N	0	0	286.419	4.070	20	30		CIEDRN
CN(CC1CCCCC1)C(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000280923085	263065070	/nfs/dbraw/zinc/06/50/70/263065070.db2.gz	PUVQCHWLNYHWRB-UHFFFAOYSA-N	0	0	298.430	4.140	20	30		CIEDRN
Cc1c(Cl)cccc1NCCCC1(C#N)CCOCC1	ZINC000280951921	263065314	/nfs/dbraw/zinc/06/53/14/263065314.db2.gz	GJTCHCCMIJCIIE-UHFFFAOYSA-N	0	0	292.810	4.161	20	30		CIEDRN
CC(C)c1cccc(C(C)C)c1NC(=O)N1CC(C)(C#N)C1	ZINC000281033385	263065959	/nfs/dbraw/zinc/06/59/59/263065959.db2.gz	UMGOOHIYHMGLNN-UHFFFAOYSA-N	0	0	299.418	4.311	20	30		CIEDRN
Cc1ccc(Cl)c(NCCCC2(C#N)CCOCC2)c1	ZINC000281202526	263067185	/nfs/dbraw/zinc/06/71/85/263067185.db2.gz	NGFGGWOHXXOIIR-UHFFFAOYSA-N	0	0	292.810	4.161	20	30		CIEDRN
N#CC1(CCCNc2cccc(C(F)F)c2)CCOCC1	ZINC000281340447	263068141	/nfs/dbraw/zinc/06/81/41/263068141.db2.gz	WJKIHEAOUZZFJM-UHFFFAOYSA-N	0	0	294.345	4.137	20	30		CIEDRN
C/C(=N\OCCC(C)(C)C#N)c1cc2ccccc2o1	ZINC000281785215	263071834	/nfs/dbraw/zinc/07/18/34/263071834.db2.gz	FBXMMMQAGXQDEX-LDADJPATSA-N	0	0	270.332	4.113	20	30		CIEDRN
CC[C@H](CC(=O)NCC1CCC(C#N)CC1)c1ccccc1	ZINC000282854804	263079147	/nfs/dbraw/zinc/07/91/47/263079147.db2.gz	XDNBVVGNVSGYNH-OFLPRAFFSA-N	0	0	298.430	4.016	20	30		CIEDRN
CCC[C@H](C(=O)NCC1CCC(C#N)CC1)c1ccccc1	ZINC000282851294	263079201	/nfs/dbraw/zinc/07/92/01/263079201.db2.gz	WVXHGZOGRFTXCU-HTWSVDAQSA-N	0	0	298.430	4.016	20	30		CIEDRN
N#CCCN1CCCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000340177593	263083267	/nfs/dbraw/zinc/08/32/67/263083267.db2.gz	RMFHNMIVROGYOY-CQSZACIVSA-N	0	0	282.309	4.146	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)Nc1ccc2oc(C(C)(C)C)nc2c1	ZINC000284993502	263088987	/nfs/dbraw/zinc/08/89/87/263088987.db2.gz	CHUVECSWVAGHJO-QGZVFWFLSA-N	0	0	299.374	4.004	20	30		CIEDRN
C[C@H](CC#N)Sc1ccccc1NCCCCF	ZINC000285244014	263091576	/nfs/dbraw/zinc/09/15/76/263091576.db2.gz	RHGXPDSLSVUBAV-GFCCVEGCSA-N	0	0	266.385	4.242	20	30		CIEDRN
CCCNc1ccc(C#N)cc1NCCCC(C)(C)C#N	ZINC000285303893	263091981	/nfs/dbraw/zinc/09/19/81/263091981.db2.gz	WIFMQXPGHGXEAD-UHFFFAOYSA-N	0	0	284.407	4.122	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)N[C@H](C)c1cccc(Cl)c1Cl	ZINC000285451872	263093057	/nfs/dbraw/zinc/09/30/57/263093057.db2.gz	JAKNUVPWMYNHFB-OTYXRUKQSA-N	0	0	299.201	4.110	20	30		CIEDRN
CCCCCCCC(=O)N1CCC=C(c2ccncc2)C1	ZINC000286254172	263097822	/nfs/dbraw/zinc/09/78/22/263097822.db2.gz	QJQZZAWYMAJXDK-UHFFFAOYSA-N	0	0	286.419	4.058	20	30		CIEDRN
C[C@@H](C#N)CSc1ccccc1NCCC(C)(C)C#N	ZINC000288685188	263105557	/nfs/dbraw/zinc/10/55/57/263105557.db2.gz	JHJVNOJJUCGDTG-ZDUSSCGKSA-N	0	0	287.432	4.290	20	30		CIEDRN
CC[C@@](C)(C#N)c1nc(-c2ccc3[nH]c(C)c(C)c3c2)no1	ZINC000288956951	263106806	/nfs/dbraw/zinc/10/68/06/263106806.db2.gz	PIKDDBDCTCEEIV-KRWDZBQOSA-N	0	0	294.358	4.026	20	30		CIEDRN
C[C@@H](SCCC(C)(C)C#N)c1cccc([N+](=O)[O-])c1	ZINC000289348625	263109147	/nfs/dbraw/zinc/10/91/47/263109147.db2.gz	GIKJERTZJWDHFI-LLVKDONJSA-N	0	0	278.377	4.329	20	30		CIEDRN
Cc1cccc([C@@H]2CCCCN2C(=O)CCCC#N)c1C	ZINC000291061053	263119749	/nfs/dbraw/zinc/11/97/49/263119749.db2.gz	AYMGSDCNULCTAK-KRWDZBQOSA-N	0	0	284.403	4.051	20	30		CIEDRN
Cc1cccc([C@@H](c2noc(CCCC#N)n2)C(C)C)c1	ZINC000291096605	263119939	/nfs/dbraw/zinc/11/99/39/263119939.db2.gz	QJYBRXNWQNARBF-INIZCTEOSA-N	0	0	283.375	4.012	20	30		CIEDRN
C[C@@H](OC(=O)CCCC#N)c1ccc(C(F)(F)F)cc1	ZINC000291624741	263124129	/nfs/dbraw/zinc/12/41/29/263124129.db2.gz	FFZYMUKPSHFCGQ-SNVBAGLBSA-N	0	0	285.265	4.003	20	30		CIEDRN
Cc1c2ccccc2oc1[C@H](NC(=O)CCCC#N)C(C)C	ZINC000291851563	263126025	/nfs/dbraw/zinc/12/60/25/263126025.db2.gz	CJPSABHUJHODOV-QGZVFWFLSA-N	0	0	298.386	4.248	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cccc(OC(C)C)c1	ZINC000452679834	263131022	/nfs/dbraw/zinc/13/10/22/263131022.db2.gz	XRFUMAGAYSIJDG-ZDUSSCGKSA-N	0	0	261.365	4.015	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000292900131	263136457	/nfs/dbraw/zinc/13/64/57/263136457.db2.gz	FFJYZSDERCIZKR-UHFFFAOYSA-N	0	0	270.376	4.029	20	30		CIEDRN
C=C(C)CCNC(=O)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl	ZINC000452725303	263137594	/nfs/dbraw/zinc/13/75/94/263137594.db2.gz	SIFVHYHBAGLKKS-CHWSQXEVSA-N	0	0	298.213	4.179	20	30		CIEDRN
CC/C(C)=C/C(=O)Nc1ccccc1SC[C@H](C)C#N	ZINC000294779854	263167236	/nfs/dbraw/zinc/16/72/36/263167236.db2.gz	ZUYBMZGSUGABFL-CNELAYHGSA-N	0	0	288.416	4.233	20	30		CIEDRN
C[C@H](SC[C@H](O)CC#N)c1ccc(Cl)c(Cl)c1	ZINC000296135764	263186600	/nfs/dbraw/zinc/18/66/00/263186600.db2.gz	WWCGHBILLVTOAI-WCBMZHEXSA-N	0	0	290.215	4.062	20	30		CIEDRN
CC#CCCCC(=O)Nc1sc(C(C)(C)C)cc1C#N	ZINC000297603351	263206772	/nfs/dbraw/zinc/20/67/72/263206772.db2.gz	ACOPNZNVNQITET-UHFFFAOYSA-N	0	0	288.416	4.049	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)Nc1cc(C)cc2ccccc21	ZINC000297833626	263210236	/nfs/dbraw/zinc/21/02/36/263210236.db2.gz	VYJFXHNNZGTUIQ-KRWDZBQOSA-N	0	0	266.344	4.027	20	30		CIEDRN
CCCCCCCC(=O)N1CCC[C@H]1c1cccn1C	ZINC000298203513	263216087	/nfs/dbraw/zinc/21/60/87/263216087.db2.gz	ZIAKNUINEURFPO-INIZCTEOSA-N	0	0	276.424	4.049	20	30		CIEDRN
CC[C@@H]([NH2+][C@H](C)CCC#N)c1ccc(Cl)s1	ZINC000299008345	263229373	/nfs/dbraw/zinc/22/93/73/263229373.db2.gz	QSPMUFKMCPEYKL-NXEZZACHSA-N	0	0	256.802	4.134	20	30		CIEDRN
C[C@H](NCCC#N)c1ccc(Cl)c2ccccc21	ZINC000299190775	263234021	/nfs/dbraw/zinc/23/40/21/263234021.db2.gz	CRBPTSGKCCZTRZ-NSHDSACASA-N	0	0	258.752	4.057	20	30		CIEDRN
C[C@@H](c1cccc(C(F)(F)F)c1)[N@H+](C)CCCC#N	ZINC000299340045	263240094	/nfs/dbraw/zinc/24/00/94/263240094.db2.gz	DTQJNELBLVBHRT-NSHDSACASA-N	0	0	270.298	4.002	20	30		CIEDRN
CCCCCCCCC(=O)N(C)[C@H](C)c1ccccn1	ZINC000299365228	263241044	/nfs/dbraw/zinc/24/10/44/263241044.db2.gz	CUCXRWNGVBUAAA-OAHLLOKOSA-N	0	0	276.424	4.352	20	30		CIEDRN
C[C@H](c1cccs1)N(CCC#N)Cc1ccccc1	ZINC000299402634	263241571	/nfs/dbraw/zinc/24/15/71/263241571.db2.gz	MNYJJKMPHZGFQM-CQSZACIVSA-N	0	0	270.401	4.225	20	30		CIEDRN
C#CCCCCC(=O)Nc1cccc(SC(F)F)c1	ZINC000119791294	263279197	/nfs/dbraw/zinc/27/91/97/263279197.db2.gz	BBLGIAMFMDJSGG-UHFFFAOYSA-N	0	0	283.343	4.133	20	30		CIEDRN
CC(C)(C)c1nccc(N[C@H](CCC#N)c2ccccc2)n1	ZINC000164337782	263285487	/nfs/dbraw/zinc/28/54/87/263285487.db2.gz	XCZBDJHIPDWQOG-OAHLLOKOSA-N	0	0	294.402	4.231	20	30		CIEDRN
C=CCN(C(=O)C1CCC(F)(F)CC1)c1ccccc1	ZINC000121403145	263293546	/nfs/dbraw/zinc/29/35/46/263293546.db2.gz	JVVZXOMNCIEOHO-UHFFFAOYSA-N	0	0	279.330	4.031	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)C(C)(C)CC(F)F	ZINC000415181385	263296194	/nfs/dbraw/zinc/29/61/94/263296194.db2.gz	GOKOWCUGZZTBQO-UHFFFAOYSA-N	0	0	287.394	4.263	20	30		CIEDRN
C=CCC(F)(F)c1nc([C@H]2C[C@@H]2c2ccccc2)no1	ZINC000340704703	263301083	/nfs/dbraw/zinc/30/10/83/263301083.db2.gz	PDLZSVZJRFQTBT-NEPJUHHUSA-N	0	0	276.286	4.009	20	30		CIEDRN
CCC(CC)CN(CCC#N)C(=O)c1coc2ccccc21	ZINC000113173030	263306295	/nfs/dbraw/zinc/30/62/95/263306295.db2.gz	LOVYHULKOPVAOU-UHFFFAOYSA-N	0	0	298.386	4.225	20	30		CIEDRN
C=CCC[C@H](NC(=O)[C@@H]1CCCCS1)c1ccccc1	ZINC000341230686	263328395	/nfs/dbraw/zinc/32/83/95/263328395.db2.gz	TXPSMNPKDBXCMZ-HOTGVXAUSA-N	0	0	289.444	4.096	20	30		CIEDRN
CC(C)(C#N)CCSCc1nc(C2CC2)cs1	ZINC000342026688	263380448	/nfs/dbraw/zinc/38/04/48/263380448.db2.gz	VLSAQUVTAIUGBQ-UHFFFAOYSA-N	0	0	266.435	4.194	20	30		CIEDRN
N#Cc1cccc(SCc2nc(C3CC3)cs2)c1	ZINC000342556531	263446749	/nfs/dbraw/zinc/44/67/49/263446749.db2.gz	DNKVKDGWBBPMAL-UHFFFAOYSA-N	0	0	272.398	4.184	20	30		CIEDRN
N#Cc1cccc(CSCc2nc(C3CC3)cs2)c1	ZINC000342559510	263448000	/nfs/dbraw/zinc/44/80/00/263448000.db2.gz	BCUHPIUYLNIKMX-UHFFFAOYSA-N	0	0	286.425	4.326	20	30		CIEDRN
Cc1ccc(C#N)c(SCc2ccccc2C2CC2)n1	ZINC000342968667	263566483	/nfs/dbraw/zinc/56/64/83/263566483.db2.gz	ZOYWXOKUTJEDOU-UHFFFAOYSA-N	0	0	280.396	4.431	20	30		CIEDRN
CSc1ccccc1[C@@H](C)Nc1cc(C#N)cc(C)n1	ZINC000343044428	263577900	/nfs/dbraw/zinc/57/79/00/263577900.db2.gz	XJHNKOBAJMAVEN-GFCCVEGCSA-N	0	0	283.400	4.157	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](C)c1ccc(C2CC2)cc1	ZINC000416072684	263671939	/nfs/dbraw/zinc/67/19/39/263671939.db2.gz	ZBSBOYXHFSMJNV-ZDUSSCGKSA-N	0	0	257.377	4.098	20	30		CIEDRN
CC(C)c1ccc([C@@H](C)CC(=O)NCC2(C#N)CCC2)cc1	ZINC000416348274	263699633	/nfs/dbraw/zinc/69/96/33/263699633.db2.gz	SYFIZOUMCNRKRQ-HNNXBMFYSA-N	0	0	298.430	4.114	20	30		CIEDRN
C=CCC[C@@H](NC(=O)[C@@H](C)C(C)(F)F)c1ccccc1	ZINC000343213785	263744629	/nfs/dbraw/zinc/74/46/29/263744629.db2.gz	XXWCCDWFSZLEDX-TZMCWYRMSA-N	0	0	281.346	4.101	20	30		CIEDRN
CC[C@H](SCc1nc(C#N)cs1)c1ccccc1	ZINC000416928661	263765107	/nfs/dbraw/zinc/76/51/07/263765107.db2.gz	VDLIKILQZCKMJH-ZDUSSCGKSA-N	0	0	274.414	4.399	20	30		CIEDRN
COc1cc(NCCCC(C)(C)C#N)cc(OC)c1Cl	ZINC000417055421	263778472	/nfs/dbraw/zinc/77/84/72/263778472.db2.gz	XDMQBQRDZPDZNV-UHFFFAOYSA-N	0	0	296.798	4.099	20	30		CIEDRN
Cc1nc(CCNC(=O)[C@@H](C)CC2CCCC2)c(C)o1	ZINC000328811919	263865718	/nfs/dbraw/zinc/86/57/18/263865718.db2.gz	BBWTZXYDCDGDMP-NSHDSACASA-N	0	0	278.396	4.007	20	30		CIEDRN
CCC1CCC(NC(=O)Nc2scnc2C2CC2)CC1	ZINC000328944622	263895260	/nfs/dbraw/zinc/89/52/60/263895260.db2.gz	USPUNXHZZAQEOP-UHFFFAOYSA-N	0	0	293.436	4.315	20	30		CIEDRN
C[C@H](NC(=O)[C@@H]1CCC(=O)[C@H](C)C1)c1cc2ccccc2o1	ZINC000328925691	263903086	/nfs/dbraw/zinc/90/30/86/263903086.db2.gz	WAKQFUSETSMXGC-MBNYWOFBSA-N	0	0	299.370	4.456	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)N(C)[C@H](C)C1CCCCC1	ZINC000330443462	263953435	/nfs/dbraw/zinc/95/34/35/263953435.db2.gz	SFBGJRQKLBUZFK-CQSZACIVSA-N	0	0	299.418	4.313	20	30		CIEDRN
Cc1nc(C(=O)NCC[C@@H](C)CC(C)(C)C)c(C)o1	ZINC000330564945	263975391	/nfs/dbraw/zinc/97/53/91/263975391.db2.gz	FPSKEEPSDCNOPV-SNVBAGLBSA-N	0	0	266.385	4.058	20	30		CIEDRN
Cc1nc(NC(=O)c2cc(C(C)C)oc2C)sc1C	ZINC000330574066	263978273	/nfs/dbraw/zinc/97/82/73/263978273.db2.gz	LACMIXPKVRUAHK-UHFFFAOYSA-N	0	0	278.377	4.421	20	30		CIEDRN
Cc1nc([C@@H](C)NC(=O)Nc2cc(C)cc(C)c2)cs1	ZINC000330634088	264000945	/nfs/dbraw/zinc/00/09/45/264000945.db2.gz	AZPMNZSZWYHUDJ-LLVKDONJSA-N	0	0	289.404	4.155	20	30		CIEDRN
CC1(C)CCC[C@@H](CC(=O)Nc2ccccc2CC#N)C1	ZINC000330827952	264049244	/nfs/dbraw/zinc/04/92/44/264049244.db2.gz	HYKOATDDONDQPH-AWEZNQCLSA-N	0	0	284.403	4.298	20	30		CIEDRN
Cc1cc([C@H](C)NC(=O)c2cc(C(C)(C)C)on2)c(C)o1	ZINC000330890278	264064275	/nfs/dbraw/zinc/06/42/75/264064275.db2.gz	WAWCOTZCTBECCS-JTQLQIEISA-N	0	0	290.363	4.248	20	30		CIEDRN
CCO[C@H](C)c1ncc(C(=O)NC2(C)CCCCC2)s1	ZINC000330907194	264074729	/nfs/dbraw/zinc/07/47/29/264074729.db2.gz	FDQPQOKFNHWNKN-LLVKDONJSA-N	0	0	296.436	4.268	20	30		CIEDRN
Cc1nc(CC(C)C)c(C(=O)Nc2scnc2C)s1	ZINC000330907791	264074775	/nfs/dbraw/zinc/07/47/75/264074775.db2.gz	OCEOXJSIZXQWGS-UHFFFAOYSA-N	0	0	295.433	4.051	20	30		CIEDRN
CCc1oc(C(=O)Nc2sc(C)c(C)c2C#N)cc1C	ZINC000330957961	264088187	/nfs/dbraw/zinc/08/81/87/264088187.db2.gz	AGODDCZACQDBEG-UHFFFAOYSA-N	0	0	288.372	4.337	20	30		CIEDRN
CCC(C)(C)NC(=O)N[C@@H](C)c1cc2cccc(F)c2o1	ZINC000331028906	264100178	/nfs/dbraw/zinc/10/01/78/264100178.db2.gz	XGNXXYZRORMPEC-JTQLQIEISA-N	0	0	292.354	4.325	20	30		CIEDRN
Cc1c2c(nc(SCCCC(C)(C)C#N)c1C#N)CCC2	ZINC000331045617	264108526	/nfs/dbraw/zinc/10/85/26/264108526.db2.gz	GDUXLVBRGXPPMV-UHFFFAOYSA-N	0	0	299.443	4.172	20	30		CIEDRN
CC1(C)CCC(NC(=O)C[C@@H](CC#N)c2ccccc2)CC1	ZINC000331074651	264114157	/nfs/dbraw/zinc/11/41/57/264114157.db2.gz	UVZINNNAEIQJLO-MRXNPFEDSA-N	0	0	298.430	4.159	20	30		CIEDRN
Cc1nc(C)c(C(=O)NCC(C)(C)C2=CCCCC2)o1	ZINC000331087762	264118682	/nfs/dbraw/zinc/11/86/82/264118682.db2.gz	QXYNWWCEVGTUAH-UHFFFAOYSA-N	0	0	276.380	4.123	20	30		CIEDRN
CC(C)c1occc1C(=O)NCCC[C@@H]1CCCC[C@H]1O	ZINC000331103762	264124101	/nfs/dbraw/zinc/12/41/01/264124101.db2.gz	PUDPEAKUYHHLLI-DZGCQCFKSA-N	0	0	293.407	4.039	20	30		CIEDRN
CC(C)c1ccc([C@H](C)CC(=O)N[C@H]2CCC[C@@H]2C#N)cc1	ZINC000331115108	264128746	/nfs/dbraw/zinc/12/87/46/264128746.db2.gz	VBHLATDFSHNMIA-OLMNPRSZSA-N	0	0	298.430	4.112	20	30		CIEDRN
C[C@@H](c1cccc(C#N)c1)N(C)Cc1ccsc1Cl	ZINC000425363114	264135745	/nfs/dbraw/zinc/13/57/45/264135745.db2.gz	ATYRKXRTEATRTO-NSHDSACASA-N	0	0	290.819	4.466	20	30		CIEDRN
CC[C@H](C)[C@@H](C)NC(=O)Nc1cc(C)cc(OC)c1C	ZINC000331165793	264145255	/nfs/dbraw/zinc/14/52/55/264145255.db2.gz	SJKYBIKSYTUVFE-WCQYABFASA-N	0	0	278.396	4.073	20	30		CIEDRN
CC[C@H](C)n1ncc(NC(=O)N[C@@H]2CCCC[C@@H]2C)c1C	ZINC000331170315	264145677	/nfs/dbraw/zinc/14/56/77/264145677.db2.gz	ZFHHZELCVLJFCK-SGMGOOAPSA-N	0	0	292.427	4.067	20	30		CIEDRN
CCc1cc(C)c(C(=O)Nc2sc(C)c(C)c2C#N)o1	ZINC000331199759	264160337	/nfs/dbraw/zinc/16/03/37/264160337.db2.gz	YDYDUHJNKKWZNU-UHFFFAOYSA-N	0	0	288.372	4.337	20	30		CIEDRN
CCc1cc(NC(=O)NCC2CCC(C#N)CC2)ccc1C	ZINC000331276494	264170434	/nfs/dbraw/zinc/17/04/34/264170434.db2.gz	QWQYFHVDUYZPDS-UHFFFAOYSA-N	0	0	299.418	4.213	20	30		CIEDRN
C[C@@H](CCC(C)(C)C)NC(=O)NCC1CCC(C#N)CC1	ZINC000331281800	264172255	/nfs/dbraw/zinc/17/22/55/264172255.db2.gz	GBLIHEJVLWPNIQ-NFOMZHRRSA-N	0	0	293.455	4.035	20	30		CIEDRN
CCCC1CCC(NC(=O)c2cc(C#N)oc2C)CC1	ZINC000331234469	264174554	/nfs/dbraw/zinc/17/45/54/264174554.db2.gz	SJLUWTXKOSQEOT-UHFFFAOYSA-N	0	0	274.364	4.123	20	30		CIEDRN
Cc1cc(C)c(NC(=O)N[C@@H](C)c2ccccc2C)c(C)n1	ZINC000331240255	264176385	/nfs/dbraw/zinc/17/63/85/264176385.db2.gz	PDHOTXXGEDKJQF-AWEZNQCLSA-N	0	0	297.402	4.402	20	30		CIEDRN
CCc1cc(C)cc(CC)c1NC(=O)N[C@@H]1CCC[C@@H]1C#N	ZINC000331244969	264178913	/nfs/dbraw/zinc/17/89/13/264178913.db2.gz	OWGCGRYQBQIZML-HZPDHXFCSA-N	0	0	299.418	4.138	20	30		CIEDRN
CC(=O)c1ccc(NC(=O)N[C@@H]2CC[C@@H](C)C2)cc1Cl	ZINC000331308016	264185531	/nfs/dbraw/zinc/18/55/31/264185531.db2.gz	WXGMQMOVDQEAJO-MWLCHTKSSA-N	0	0	294.782	4.057	20	30		CIEDRN
CCc1cncc(C(=O)Nc2ncc(C(C)(C)C)s2)c1	ZINC000331351475	264206494	/nfs/dbraw/zinc/20/64/94/264206494.db2.gz	WLIIRXCQELXDIA-UHFFFAOYSA-N	0	0	289.404	4.034	20	30		CIEDRN
Cc1ccc(C#N)c(N[C@H](C)c2cc3ccccc3o2)n1	ZINC000160369375	264242285	/nfs/dbraw/zinc/24/22/85/264242285.db2.gz	AKKZOGNHKGRRJW-GFCCVEGCSA-N	0	0	277.327	4.181	20	30		CIEDRN
C[C@H](CCC(=O)N[C@]1(C#N)CCC[C@@H](C)C1)c1ccccc1	ZINC000160318394	264242320	/nfs/dbraw/zinc/24/23/20/264242320.db2.gz	CVDXQWXURLIVNY-GPMSIDNRSA-N	0	0	298.430	4.159	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(N[C@@H]2CCCc3sccc32)c1	ZINC000161064988	264265413	/nfs/dbraw/zinc/26/54/13/264265413.db2.gz	IPZKVNZQMGDHOV-OAHLLOKOSA-N	0	0	296.395	4.312	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1cccc(C)c1Cl	ZINC000072580976	264268725	/nfs/dbraw/zinc/26/87/25/264268725.db2.gz	BSVFBRLDMQLABB-UHFFFAOYSA-N	0	0	266.772	4.078	20	30		CIEDRN
C=CCCCN(C)C(=O)c1c[nH]cc1-c1ccc(C)s1	ZINC000189712897	264322771	/nfs/dbraw/zinc/32/27/71/264322771.db2.gz	JAEXTFWYPREFJC-UHFFFAOYSA-N	0	0	288.416	4.090	20	30		CIEDRN
C[C@@H](Sc1nncc2ccccc21)c1cccc(C#N)c1	ZINC000189831358	264329074	/nfs/dbraw/zinc/32/90/74/264329074.db2.gz	LTYPJEGIECNRAO-GFCCVEGCSA-N	0	0	291.379	4.355	20	30		CIEDRN
C=C(CC)CNC(=O)CCCCCO[C@H]1CCC[C@@H](C)C1	ZINC000456810715	264344027	/nfs/dbraw/zinc/34/40/27/264344027.db2.gz	GMGLAEDPFAYNGY-SJORKVTESA-N	0	0	295.467	4.225	20	30		CIEDRN
CC[C@@H]1CCCN(C(=O)c2ccc(C(C)(C)C#N)cc2)CC1	ZINC000476062767	264344972	/nfs/dbraw/zinc/34/49/72/264344972.db2.gz	OZCJBSGSQCWZMO-OAHLLOKOSA-N	0	0	298.430	4.140	20	30		CIEDRN
C=C(C)[C@H](NCc1cncc(C)c1)c1ccc(F)c(F)c1	ZINC000190037850	264345909	/nfs/dbraw/zinc/34/59/09/264345909.db2.gz	XEFRPMFVCOVSOL-KRWDZBQOSA-N	0	0	288.341	4.075	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccc(C)cc1Cl	ZINC000077179198	264350013	/nfs/dbraw/zinc/35/00/13/264350013.db2.gz	BTFKEDNWSPYFLS-UHFFFAOYSA-N	0	0	266.772	4.078	20	30		CIEDRN
C=CCCCN(C)C(=O)N[C@@H](C)c1cc2ccccc2o1	ZINC000076976019	264350349	/nfs/dbraw/zinc/35/03/49/264350349.db2.gz	PIYRNISGKFGMGE-ZDUSSCGKSA-N	0	0	286.375	4.101	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccc(CCSC)cc1	ZINC000077442516	264356351	/nfs/dbraw/zinc/35/63/51/264356351.db2.gz	ZIMNPFBCALSAJR-UHFFFAOYSA-N	0	0	292.448	4.022	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC(C)(C(C)C)CC1	ZINC000190309130	264357348	/nfs/dbraw/zinc/35/73/48/264357348.db2.gz	JBQHXSQMMAOYQT-UHFFFAOYSA-N	0	0	263.425	4.040	20	30		CIEDRN
Cc1ccc(C(C)C)cc1Oc1nccc(C#N)c1[N+](=O)[O-]	ZINC000132464209	264390308	/nfs/dbraw/zinc/39/03/08/264390308.db2.gz	WTYNGIDYEAICJE-UHFFFAOYSA-N	0	0	297.314	4.086	20	30		CIEDRN
C=CCC[C@@H](NCc1nc(CC(C)C)no1)c1ccccc1	ZINC000180043240	264395007	/nfs/dbraw/zinc/39/50/07/264395007.db2.gz	LSYSSZCLBLXTMK-MRXNPFEDSA-N	0	0	299.418	4.065	20	30		CIEDRN
C#CCCCCC(=O)N1CCCCC[C@H]1c1ccc(C)o1	ZINC000180217540	264397490	/nfs/dbraw/zinc/39/74/90/264397490.db2.gz	FDPPUTBHCOLGNA-INIZCTEOSA-N	0	0	287.403	4.225	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc(SC)cc1OC	ZINC000192710063	264587914	/nfs/dbraw/zinc/58/79/14/264587914.db2.gz	RFPOLCWOJQFNQY-UHFFFAOYSA-N	0	0	291.416	4.124	20	30		CIEDRN
CC#CCCCC(=O)N1C[C@H](C)CC[C@@H]1c1ccccc1	ZINC000288466703	264663833	/nfs/dbraw/zinc/66/38/33/264663833.db2.gz	QFGUQPUDGTZOSQ-SJLPKXTDSA-N	0	0	283.415	4.180	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC(C)(C)[C@@H]1c1cccs1	ZINC000288522550	264684171	/nfs/dbraw/zinc/68/41/71/264684171.db2.gz	XLXBKXLDXBSDKC-JSGCOSHPSA-N	0	0	277.433	4.260	20	30		CIEDRN
C=CCC(CC=C)C(=O)NCc1ccc(C(F)F)cc1	ZINC000184573486	264813731	/nfs/dbraw/zinc/81/37/31/264813731.db2.gz	LEUJZXCJJGYXPN-UHFFFAOYSA-N	0	0	279.330	4.009	20	30		CIEDRN
CCC[C@H]1CCCCN1C(=O)Nc1cc(C#N)ccc1C	ZINC000184657897	264828156	/nfs/dbraw/zinc/82/81/56/264828156.db2.gz	JEKIRNPCVILVCF-HNNXBMFYSA-N	0	0	285.391	4.053	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@H]1c1ccccc1C	ZINC000185231237	265011425	/nfs/dbraw/zinc/01/14/25/265011425.db2.gz	MHMWHKUIYNZMOK-WBVHZDCISA-N	0	0	271.404	4.261	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(Cc1ccco1)C1CCCC1	ZINC000185231105	265011562	/nfs/dbraw/zinc/01/15/62/265011562.db2.gz	AYNHAAVSAKGNSE-AWEZNQCLSA-N	0	0	275.392	4.153	20	30		CIEDRN
CC[C@@](C)(NCc1ccc(C#N)cc1Cl)C(F)(F)F	ZINC000525886116	265035092	/nfs/dbraw/zinc/03/50/92/265035092.db2.gz	CDJLTBRZQUINLB-GFCCVEGCSA-N	0	0	290.716	4.032	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@H]1CCC(C)C	ZINC000185889234	265042720	/nfs/dbraw/zinc/04/27/20/265042720.db2.gz	QPLVCHWTXSGPKX-CABCVRRESA-N	0	0	251.414	4.016	20	30		CIEDRN
COc1ccc(SCc2cn3ccccc3c2C#N)cc1	ZINC000514524299	265173372	/nfs/dbraw/zinc/17/33/72/265173372.db2.gz	NRLSVZGQRNZHKI-UHFFFAOYSA-N	0	0	294.379	4.112	20	30		CIEDRN
N#Cc1csc(CNc2ccc(C(F)(F)F)cc2)c1	ZINC000093684999	265189321	/nfs/dbraw/zinc/18/93/21/265189321.db2.gz	GIBOQLUGGWQJQK-UHFFFAOYSA-N	0	0	282.290	4.251	20	30		CIEDRN
Cc1cc(C)c(C#N)c(N2CCCC3(CCCCC3)C2)n1	ZINC000518921016	265221074	/nfs/dbraw/zinc/22/10/74/265221074.db2.gz	DJQSKAHSBPQODE-UHFFFAOYSA-N	0	0	283.419	4.121	20	30		CIEDRN
CC[C@H](CNc1nc2c(cc1C#N)CCC2)c1ccccc1	ZINC000519152609	265339265	/nfs/dbraw/zinc/33/92/65/265339265.db2.gz	PXXLBXZABMMOHE-CQSZACIVSA-N	0	0	291.398	4.048	20	30		CIEDRN
CCC(CC)CN(CCC#N)C(=O)C1CCCCCC1	ZINC000519157642	265344095	/nfs/dbraw/zinc/34/40/95/265344095.db2.gz	PEQHQQABCNITII-UHFFFAOYSA-N	0	0	278.440	4.135	20	30		CIEDRN
C=CCOc1cccc(NC(=O)C2(C(F)F)CCCC2)c1	ZINC000519370062	265404041	/nfs/dbraw/zinc/40/40/41/265404041.db2.gz	OGWHEFGZEHZICJ-UHFFFAOYSA-N	0	0	295.329	4.015	20	30		CIEDRN
Cc1cc(C)cc([C@H](C)Nc2ccc(F)cc2C#N)c1	ZINC000097635591	265445759	/nfs/dbraw/zinc/44/57/59/265445759.db2.gz	HYINSUFGFYTAKU-ZDUSSCGKSA-N	0	0	268.335	4.487	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)C[C@H]1CCCC[C@@H]1C	ZINC000520392851	265788498	/nfs/dbraw/zinc/78/84/98/265788498.db2.gz	ARAALRQDCPWXML-FUHWJXTLSA-N	0	0	285.431	4.418	20	30		CIEDRN
N#Cc1cc(N2CCC[C@@H]2c2ccccc2)c2ccccc2n1	ZINC000301520097	265981897	/nfs/dbraw/zinc/98/18/97/265981897.db2.gz	KYJMIYWXDDKZHK-LJQANCHMSA-N	0	0	299.377	4.448	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H]2C[C@H]2c2cccc(C#N)c2)n1	ZINC000514593432	266008557	/nfs/dbraw/zinc/00/85/57/266008557.db2.gz	YBVJKNDMBDATHH-LSDHHAIUSA-N	0	0	293.370	4.066	20	30		CIEDRN
CCN(C(=O)[C@H]1CCC(C)=C(C)C1)c1ccc(C#N)cc1	ZINC000516971590	266010369	/nfs/dbraw/zinc/01/03/69/266010369.db2.gz	FKFDVQCMQNRRAH-INIZCTEOSA-N	0	0	282.387	4.048	20	30		CIEDRN
CCc1cccnc1[C@H](C)N[C@H](CCC#N)c1ccccc1	ZINC000356873563	266199919	/nfs/dbraw/zinc/19/99/19/266199919.db2.gz	PPEAODYFNUTFMK-MAUKXSAKSA-N	0	0	293.414	4.340	20	30		CIEDRN
CCc1cccnc1[C@H](C)N[C@@H](CCC#N)c1ccccc1	ZINC000356873566	266200224	/nfs/dbraw/zinc/20/02/24/266200224.db2.gz	PPEAODYFNUTFMK-YJBOKZPZSA-N	0	0	293.414	4.340	20	30		CIEDRN
N#Cc1cnccc1/C=C/c1cscc1C(F)(F)F	ZINC000357079575	266243297	/nfs/dbraw/zinc/24/32/97/266243297.db2.gz	TXKXXBIGMKXVSE-OWOJBTEDSA-N	0	0	280.274	4.204	20	30		CIEDRN
Cc1ccc2nc(/C=C\c3nc(C#N)cs3)ccc2c1	ZINC000357141800	266253635	/nfs/dbraw/zinc/25/36/35/266253635.db2.gz	AAHILPKACAXOHZ-ALCCZGGFSA-N	0	0	277.352	4.042	20	30		CIEDRN
CC(C)(C)[C@@H]1CN(C(=O)CC(C)(C)C#N)c2ccccc21	ZINC000357344917	266280176	/nfs/dbraw/zinc/28/01/76/266280176.db2.gz	IOSOGTRFHDPSJI-CQSZACIVSA-N	0	0	284.403	4.103	20	30		CIEDRN
Cc1nsc(NCc2ccc3sccc3c2)c1C#N	ZINC000357612376	266334916	/nfs/dbraw/zinc/33/49/16/266334916.db2.gz	WPSLCJFUUOAAII-UHFFFAOYSA-N	0	0	285.397	4.150	20	30		CIEDRN
C=CCCCC(=O)Nc1ccccc1-c1csc(C)n1	ZINC000357671568	266343914	/nfs/dbraw/zinc/34/39/14/266343914.db2.gz	HFWCRBDXDDPBCT-UHFFFAOYSA-N	0	0	286.400	4.413	20	30		CIEDRN
C=CC[C@H](CC)Nc1cc(-c2nc(C(C)C)no2)ccn1	ZINC000357687050	266347614	/nfs/dbraw/zinc/34/76/14/266347614.db2.gz	RNJPDZAZJUUSHY-ZDUSSCGKSA-N	0	0	286.379	4.022	20	30		CIEDRN
C[C@H](CSCCCC1(C#N)CCOCC1)C(F)(F)F	ZINC000357701446	266348613	/nfs/dbraw/zinc/34/86/13/266348613.db2.gz	AWHNSXRYNUMRJE-LLVKDONJSA-N	0	0	295.370	4.019	20	30		CIEDRN
C=CCS[C@H](C)C(=O)Nc1c(CC)cccc1CC	ZINC000114756810	266581170	/nfs/dbraw/zinc/58/11/70/266581170.db2.gz	KGTZQGJRDJRBGL-GFCCVEGCSA-N	0	0	277.433	4.058	20	30		CIEDRN
Cc1cc(F)cc2c1ncc(C#N)c2N1C[C@@H](C)C[C@H](C)C1	ZINC000359701372	266626926	/nfs/dbraw/zinc/62/69/26/266626926.db2.gz	SXESAJQEZRYCKU-RYUDHWBXSA-N	0	0	297.377	4.036	20	30		CIEDRN
COc1cc(N[C@H](C)c2ccc(C#N)cc2)ccc1Cl	ZINC000193345716	266668023	/nfs/dbraw/zinc/66/80/23/266668023.db2.gz	VLYZHJCSLRYYPB-LLVKDONJSA-N	0	0	286.762	4.393	20	30		CIEDRN
N#CCCCC(=O)Nc1ccc(Oc2cccc(F)c2)cc1	ZINC000360033403	266671503	/nfs/dbraw/zinc/67/15/03/266671503.db2.gz	PTKIPBQMCSFECS-UHFFFAOYSA-N	0	0	298.317	4.250	20	30		CIEDRN
Cc1ccc(N[C@H]2CCCCc3cc(C#N)ccc32)cn1	ZINC000360888302	266752447	/nfs/dbraw/zinc/75/24/47/266752447.db2.gz	ZPWAGVIORZFRTA-SFHVURJKSA-N	0	0	277.371	4.141	20	30		CIEDRN
Cc1cccc(CSc2cccc(Cl)c2C#N)n1	ZINC000360954846	266760520	/nfs/dbraw/zinc/76/05/20/266760520.db2.gz	UUCIBGWXOZOBDM-UHFFFAOYSA-N	0	0	274.776	4.207	20	30		CIEDRN
N#CCCCCSCc1sccc1Br	ZINC000361912066	266901974	/nfs/dbraw/zinc/90/19/74/266901974.db2.gz	BIEOLTBAPGWYSL-UHFFFAOYSA-N	0	0	290.251	4.438	20	30		CIEDRN
C=CCC1(C(=O)N(C)C2CCC(C)(C)CC2)CCC1	ZINC000362544885	267005038	/nfs/dbraw/zinc/00/50/38/267005038.db2.gz	JGYALCOYXGKJDZ-UHFFFAOYSA-N	0	0	263.425	4.160	20	30		CIEDRN
N#Cc1ccccc1CNc1ccc(C(=O)C2CCC2)cc1	ZINC000362752384	267042240	/nfs/dbraw/zinc/04/22/40/267042240.db2.gz	MRGHJBMJOURRHQ-UHFFFAOYSA-N	0	0	290.366	4.153	20	30		CIEDRN
C[C@H](Nc1ccc(C#N)cc1)c1nc(C(F)(F)F)cs1	ZINC000362855284	267053725	/nfs/dbraw/zinc/05/37/25/267053725.db2.gz	YRJNYAYTVRZAPR-QMMMGPOBSA-N	0	0	297.305	4.207	20	30		CIEDRN
C=CCCC(=O)N1CCc2sccc2[C@H]1c1ccccc1	ZINC000363018982	267072691	/nfs/dbraw/zinc/07/26/91/267072691.db2.gz	MWMIJGJQAVWCIA-GOSISDBHSA-N	0	0	297.423	4.188	20	30		CIEDRN
Cc1nc(S[C@H](C)c2ccc(C#N)cc2)oc1C	ZINC000118174931	267240645	/nfs/dbraw/zinc/24/06/45/267240645.db2.gz	BSTBSCLGTNWULF-LLVKDONJSA-N	0	0	258.346	4.016	20	30		CIEDRN
N#Cc1nc(N2CCC[C@@H]2c2ccsc2)ccc1Cl	ZINC000370091471	267290267	/nfs/dbraw/zinc/29/02/67/267290267.db2.gz	VZRIEEIRTKTEAQ-CYBMUJFWSA-N	0	0	289.791	4.010	20	30		CIEDRN
Cc1ccc(Sc2ccc(NC(=O)CC#N)cc2)c(C)c1	ZINC000119236208	267312354	/nfs/dbraw/zinc/31/23/54/267312354.db2.gz	QLCMWSXYAHBTEP-UHFFFAOYSA-N	0	0	296.395	4.307	20	30		CIEDRN
Cc1ccc(C)c(Sc2ccc(NC(=O)CC#N)cc2)c1	ZINC000119242543	267312578	/nfs/dbraw/zinc/31/25/78/267312578.db2.gz	OYFCUZDLPWYSPQ-UHFFFAOYSA-N	0	0	296.395	4.307	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1C[C@H](c2cccs2)C[C@@H]1C	ZINC000370448884	267319826	/nfs/dbraw/zinc/31/98/26/267319826.db2.gz	HNJFFFIRMSOJET-DZGCQCFKSA-N	0	0	289.444	4.221	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@H]1/C=C/c1cccs1	ZINC000373406836	267673809	/nfs/dbraw/zinc/67/38/09/267673809.db2.gz	KUDBEPVMMYCRNW-VNDWYCCKSA-N	0	0	275.417	4.109	20	30		CIEDRN
CCC(CC)SCC(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000520522915	328719131	/nfs/dbraw/zinc/71/91/31/328719131.db2.gz	LJORNPGSPYKDFF-UHFFFAOYSA-N	0	0	296.823	4.072	20	30		CIEDRN
CC[C@@H](C)N(C(=O)c1ccc(C#N)c(Cl)c1)[C@@H](C)CC	ZINC000160136487	327656907	/nfs/dbraw/zinc/65/69/07/327656907.db2.gz	QWGNVOONDJVIRX-TXEJJXNPSA-N	0	0	292.810	4.251	20	30		CIEDRN
N#CCCCCSCCOc1ccc(Cl)cc1	ZINC000161020588	327672126	/nfs/dbraw/zinc/67/21/26/327672126.db2.gz	MWNYKRGKLYZXKI-UHFFFAOYSA-N	0	0	269.797	4.146	20	30		CIEDRN
CC(C)c1ccc(C(=O)N[C@@H](C#N)C2CCCCC2)s1	ZINC000186212646	327683761	/nfs/dbraw/zinc/68/37/61/327683761.db2.gz	QKZRGTGKHHKISG-ZDUSSCGKSA-N	0	0	290.432	4.074	20	30		CIEDRN
CC(C)(C)Oc1ccccc1NCc1ccc(C#N)cc1	ZINC000115530119	327720330	/nfs/dbraw/zinc/72/03/30/327720330.db2.gz	YAHRYQMRUSNUFX-UHFFFAOYSA-N	0	0	280.371	4.348	20	30		CIEDRN
CC(C)CCc1ccccc1NC(=O)NCC1(CC#N)CC1	ZINC000580698526	327721073	/nfs/dbraw/zinc/72/10/73/327721073.db2.gz	PFHOPBPRUXOOOM-UHFFFAOYSA-N	0	0	299.418	4.091	20	30		CIEDRN
N#Cc1ccc(NC(=O)c2csc(Cl)c2)c(Cl)c1	ZINC000378992228	327774819	/nfs/dbraw/zinc/77/48/19/327774819.db2.gz	KUNSLINGNOPVGR-UHFFFAOYSA-N	0	0	297.166	4.179	20	30		CIEDRN
CCC[C@@H]1[C@@H](C)CCCN1C(=O)Nc1ccc(CC#N)cc1	ZINC000174717166	327778146	/nfs/dbraw/zinc/77/81/46/327778146.db2.gz	QTUPPQXPZNJQRE-WMLDXEAASA-N	0	0	299.418	4.185	20	30		CIEDRN
C[C@H]1CCC[C@H](OCc2cccc(NCCC#N)c2)C1	ZINC000565300783	327785758	/nfs/dbraw/zinc/78/57/58/327785758.db2.gz	VPJRUNIORGYKHZ-YOEHRIQHSA-N	0	0	272.392	4.107	20	30		CIEDRN
N#Cc1cc(F)ccc1N[C@H]1CCCc2sccc21	ZINC000113317683	327786156	/nfs/dbraw/zinc/78/61/56/327786156.db2.gz	HCWFRBDAFGJROT-AWEZNQCLSA-N	0	0	272.348	4.248	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1ccc(Cl)cc1SCC	ZINC000460786604	327794864	/nfs/dbraw/zinc/79/48/64/327794864.db2.gz	ZZFAZNLGLPFOPK-UHFFFAOYSA-N	0	0	297.851	4.490	20	30		CIEDRN
COc1ccc(CSCCCCC#N)cc1Cl	ZINC000179235722	327800674	/nfs/dbraw/zinc/80/06/74/327800674.db2.gz	DYQMCESFIOORTC-UHFFFAOYSA-N	0	0	269.797	4.276	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N(CCC)Cc1ccccc1	ZINC000538285422	327813842	/nfs/dbraw/zinc/81/38/42/327813842.db2.gz	DGSUPZDKRQSIAE-MRXNPFEDSA-N	0	0	288.435	4.353	20	30		CIEDRN
Cc1cccc2nc(N3CCC(CCC#N)CC3)sc21	ZINC000563049474	327816881	/nfs/dbraw/zinc/81/68/81/327816881.db2.gz	NUSWGZVEPHZOQS-UHFFFAOYSA-N	0	0	285.416	4.125	20	30		CIEDRN
CC[C@H](C(=O)N[C@@](C)(C#N)C1CCCCC1)c1ccccc1	ZINC000582096604	327850653	/nfs/dbraw/zinc/85/06/53/327850653.db2.gz	JJPGXGFXHGCKQL-HKUYNNGSSA-N	0	0	298.430	4.159	20	30		CIEDRN
CC[C@@H](C(=O)N[C@@](C)(C#N)C1CCCCC1)c1ccccc1	ZINC000582096606	327850657	/nfs/dbraw/zinc/85/06/57/327850657.db2.gz	JJPGXGFXHGCKQL-MJGOQNOKSA-N	0	0	298.430	4.159	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC(c2ccc(F)cc2)CC1	ZINC000364080400	327858099	/nfs/dbraw/zinc/85/80/99/327858099.db2.gz	OFSAVOGZBCYKKI-AWEZNQCLSA-N	0	0	289.394	4.134	20	30		CIEDRN
CCCCn1c(C)c(C)nc1S[C@@H](C)CCC#N	ZINC000188290005	327862944	/nfs/dbraw/zinc/86/29/44/327862944.db2.gz	PKSMWBSPTFBVSB-NSHDSACASA-N	0	0	265.426	4.084	20	30		CIEDRN
C[C@H](Nc1cccc(OCCCC#N)c1)[C@@H]1CC1(C)C	ZINC000397634750	327885680	/nfs/dbraw/zinc/88/56/80/327885680.db2.gz	WRAFMDOOLLLZAV-BBRMVZONSA-N	0	0	272.392	4.216	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(Cl)c(OC(F)F)c1	ZINC000182257476	327887025	/nfs/dbraw/zinc/88/70/25/327887025.db2.gz	AFENKLCUTKCORT-UHFFFAOYSA-N	0	0	289.709	4.236	20	30		CIEDRN
C=CCCCS[C@@H](C)C(=O)N(CC)c1ccccc1	ZINC000522756096	327920290	/nfs/dbraw/zinc/92/02/90/327920290.db2.gz	JBGJFPRRJBTPNB-AWEZNQCLSA-N	0	0	277.433	4.127	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CCS[C@@H]1CCC)c1ccccc1	ZINC000533940218	327943351	/nfs/dbraw/zinc/94/33/51/327943351.db2.gz	IVFUMXRSIFEKKO-WMLDXEAASA-N	0	0	289.444	4.048	20	30		CIEDRN
C=C(CC)CSCc1ncc(Br)s1	ZINC000308314398	327963463	/nfs/dbraw/zinc/96/34/63/327963463.db2.gz	UIQAQNSHQSIKGI-UHFFFAOYSA-N	0	0	278.240	4.105	20	30		CIEDRN
C[C@H]1CCC[C@@H](c2ccccc2)N1C(=O)CC(C)(C)C#N	ZINC000365982369	327970052	/nfs/dbraw/zinc/97/00/52/327970052.db2.gz	IGXDVXGSVZIFLJ-HOCLYGCPSA-N	0	0	284.403	4.069	20	30		CIEDRN
Cc1cccc(C(C)C)c1NC(=O)N(C[C@H](C)C#N)C1CC1	ZINC000338186483	327970241	/nfs/dbraw/zinc/97/02/41/327970241.db2.gz	RLWCXKHMPYAUSF-CYBMUJFWSA-N	0	0	299.418	4.274	20	30		CIEDRN
C=CCCCN(C)C(=O)CCCc1ccccc1Cl	ZINC000571010106	327974303	/nfs/dbraw/zinc/97/43/03/327974303.db2.gz	NKCFVJAUIAECHT-UHFFFAOYSA-N	0	0	279.811	4.087	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@H](c1ccccc1)C1CCCC1	ZINC000182414423	327994056	/nfs/dbraw/zinc/99/40/56/327994056.db2.gz	VEJYCAUTZBBILV-QGZVFWFLSA-N	0	0	286.419	4.135	20	30		CIEDRN
C[C@H](Nc1ncc(C#N)cc1Cl)c1ccc(F)c(F)c1	ZINC000339243770	328003256	/nfs/dbraw/zinc/00/32/56/328003256.db2.gz	NSUXWIODPCIYMR-QMMMGPOBSA-N	0	0	293.704	4.058	20	30		CIEDRN
Cc1ccccc1[C@@H](CC(C)C)NC(=O)C1(C#N)CC(C)C1	ZINC000531556535	328017315	/nfs/dbraw/zinc/01/73/15/328017315.db2.gz	DBADZMSHLBZULN-LTCLLZNKSA-N	0	0	298.430	4.138	20	30		CIEDRN
CCCN(C(=O)c1cccc(C#N)c1)c1ccc(Cl)cc1	ZINC000110416302	328048210	/nfs/dbraw/zinc/04/82/10/328048210.db2.gz	FIBYFXWULYRNQU-UHFFFAOYSA-N	0	0	298.773	4.268	20	30		CIEDRN
C=CC1CCN(C(=O)c2oc3c(cccc3C)c2C)CC1	ZINC000110362571	328048665	/nfs/dbraw/zinc/04/86/65/328048665.db2.gz	NRDOZYFQCNOTBL-UHFFFAOYSA-N	0	0	283.371	4.088	20	30		CIEDRN
CN(Cc1cccc(C#N)c1)C(=O)C[C@@H]1CCCC(C)(C)C1	ZINC000534404335	328051184	/nfs/dbraw/zinc/05/11/84/328051184.db2.gz	QQHBWPOJZIMUIP-HNNXBMFYSA-N	0	0	298.430	4.123	20	30		CIEDRN
N#Cc1ccc(SCCCc2ccsc2)cc1	ZINC000541172632	328051425	/nfs/dbraw/zinc/05/14/25/328051425.db2.gz	GQZJFDRZPLGJAZ-UHFFFAOYSA-N	0	0	259.399	4.345	20	30		CIEDRN
CC1(C)CCC[C@@H](CC(=O)Nc2ccccc2C#N)C1	ZINC000534433670	328053521	/nfs/dbraw/zinc/05/35/21/328053521.db2.gz	KPCYMSPDJZSBBS-ZDUSSCGKSA-N	0	0	270.376	4.103	20	30		CIEDRN
C=CCCCCCNC(=O)N(C)[C@H](C)c1cccs1	ZINC000563372581	328057872	/nfs/dbraw/zinc/05/78/72/328057872.db2.gz	ATFUCQVBOQGXEY-CYBMUJFWSA-N	0	0	280.437	4.197	20	30		CIEDRN
Cc1cc(C(=O)N(C)[C@H](C)CC#N)sc1-c1ccccc1	ZINC000563376807	328058378	/nfs/dbraw/zinc/05/83/78/328058378.db2.gz	KLPXSJXYDIKZAY-CYBMUJFWSA-N	0	0	298.411	4.098	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1ccc(-c2ncco2)cc1C	ZINC000563403143	328062699	/nfs/dbraw/zinc/06/26/99/328062699.db2.gz	IJIJIXOHWMSZOH-UHFFFAOYSA-N	0	0	284.359	4.191	20	30		CIEDRN
CC[C@](C)(C#N)c1nc([C@@H](c2ccccc2C)C(C)C)no1	ZINC000563479250	328068848	/nfs/dbraw/zinc/06/88/48/328068848.db2.gz	CWRLWCCDMMTPLK-CRAIPNDOSA-N	0	0	297.402	4.357	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cccc(CSC)c1	ZINC000563637798	328079657	/nfs/dbraw/zinc/07/96/57/328079657.db2.gz	UYYVKSNGHVAARN-UHFFFAOYSA-N	0	0	263.406	4.090	20	30		CIEDRN
COc1ccccc1[C@@H](C)SCC(C)(C)CC#N	ZINC000571179011	328089847	/nfs/dbraw/zinc/08/98/47/328089847.db2.gz	FFMHYSREFQIESF-GFCCVEGCSA-N	0	0	263.406	4.429	20	30		CIEDRN
C=CCCC1(c2nc(-c3ccc4cc[nH]c4c3)no2)CC1	ZINC000571243755	328094976	/nfs/dbraw/zinc/09/49/76/328094976.db2.gz	NQUCSQQRVZIXNO-UHFFFAOYSA-N	0	0	279.343	4.216	20	30		CIEDRN
N#Cc1ccc(F)c(CSc2cccc(F)c2C#N)c1	ZINC000571242401	328095025	/nfs/dbraw/zinc/09/50/25/328095025.db2.gz	CNYDYRMZXNJNPE-UHFFFAOYSA-N	0	0	286.306	4.000	20	30		CIEDRN
C=CCCCNC(=O)Nc1cc(Cl)ccc1Cl	ZINC000571275120	328097295	/nfs/dbraw/zinc/09/72/95/328097295.db2.gz	LYVNXRSOFCUSRF-UHFFFAOYSA-N	0	0	273.163	4.081	20	30		CIEDRN
CC(C)(C#N)CCCSCCOc1ccccc1F	ZINC000160999513	328116288	/nfs/dbraw/zinc/11/62/88/328116288.db2.gz	DDLRQHHWLZUDEI-UHFFFAOYSA-N	0	0	281.396	4.268	20	30		CIEDRN
Cc1nc(NCc2cc3ccccc3o2)c(Cl)cc1C#N	ZINC000571491778	328125642	/nfs/dbraw/zinc/12/56/42/328125642.db2.gz	DHFYXWTUNFLEKA-UHFFFAOYSA-N	0	0	297.745	4.273	20	30		CIEDRN
C=CCC[C@H](Nc1ccc([C@@H]2CCOC2)cc1)C1CC1	ZINC000571543810	328132830	/nfs/dbraw/zinc/13/28/30/328132830.db2.gz	ZUORZEMLFRNSDI-AEFFLSMTSA-N	0	0	271.404	4.347	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000451391651	328137482	/nfs/dbraw/zinc/13/74/82/328137482.db2.gz	DPZGLRZNIRKQDL-GXFFZTMASA-N	0	0	298.213	4.178	20	30		CIEDRN
C[C@@H](SCCC#N)c1nnc(-c2cccc(Cl)c2)o1	ZINC000413011686	328139834	/nfs/dbraw/zinc/13/98/34/328139834.db2.gz	JMHBWQHRFRKYJT-SECBINFHSA-N	0	0	293.779	4.098	20	30		CIEDRN
N#Cc1cccnc1N1CC2(CCCC2)[C@@H]1c1ccccc1	ZINC000413355668	328144075	/nfs/dbraw/zinc/14/40/75/328144075.db2.gz	BCTBRBZTGZRFED-KRWDZBQOSA-N	0	0	289.382	4.075	20	30		CIEDRN
CSc1ccc(C)c(NCC(C)(C)CCC#N)c1	ZINC000271814953	328197636	/nfs/dbraw/zinc/19/76/36/328197636.db2.gz	JTLLBGUAOQWPAE-UHFFFAOYSA-N	0	0	262.422	4.459	20	30		CIEDRN
Cc1ccc(/C=C/c2ccc(C#N)cn2)c(Br)c1	ZINC000512326690	332963377	/nfs/dbraw/zinc/96/33/77/332963377.db2.gz	VCZFOCVOVPVZIV-FNORWQNLSA-N	0	0	299.171	4.195	20	30		CIEDRN
Cc1cc(C)cc(-c2nnc(S[C@H]3CC[C@H](C#N)C3)o2)c1	ZINC000278533815	328226546	/nfs/dbraw/zinc/22/65/46/328226546.db2.gz	IWDSICJXZFEWAQ-JSGCOSHPSA-N	0	0	299.399	4.138	20	30		CIEDRN
CCOc1ccc2ccccc2c1OC(=O)CC(C)(C)C#N	ZINC000278887081	328231435	/nfs/dbraw/zinc/23/14/35/328231435.db2.gz	WZFFAVNLYABZPW-UHFFFAOYSA-N	0	0	297.354	4.084	20	30		CIEDRN
N#CC1(CCCSc2ccccc2F)CCOCC1	ZINC000281014742	328238291	/nfs/dbraw/zinc/23/82/91/328238291.db2.gz	OZMKCJSEVZDCEZ-UHFFFAOYSA-N	0	0	279.380	4.018	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@@H]1C[C@H]1c1sccc1C	ZINC000438823882	328245045	/nfs/dbraw/zinc/24/50/45/328245045.db2.gz	NFCCELUCWNZPTD-HUUCEWRRSA-N	0	0	291.460	4.365	20	30		CIEDRN
C[C@@H](CC#N)Sc1ccccc1NCCOC1CCC1	ZINC000288648798	328253187	/nfs/dbraw/zinc/25/31/87/328253187.db2.gz	DWCKATYWZCPXHB-ZDUSSCGKSA-N	0	0	290.432	4.062	20	30		CIEDRN
Cc1ccccc1[C@@H](c1noc(CC(C)(C)C#N)n1)C(C)C	ZINC000289024035	328253791	/nfs/dbraw/zinc/25/37/91/328253791.db2.gz	FTUVIULKZSUJFS-INIZCTEOSA-N	0	0	297.402	4.258	20	30		CIEDRN
C[C@@H](Nc1cccc(OCCCC#N)c1)c1ccncc1F	ZINC000340319727	328255253	/nfs/dbraw/zinc/25/52/53/328255253.db2.gz	ROFTZGBVKAPNNL-CYBMUJFWSA-N	0	0	299.349	4.076	20	30		CIEDRN
CN(Cc1ccccc1-c1ccccc1)C(=O)CCCC#N	ZINC000291750649	328266169	/nfs/dbraw/zinc/26/61/69/328266169.db2.gz	STBNUCCWTWZTSX-UHFFFAOYSA-N	0	0	292.382	4.006	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCc1oc2ccc(F)cc2c1C	ZINC000340520470	328288275	/nfs/dbraw/zinc/28/82/75/328288275.db2.gz	FUGPHXWMWHZDSF-UHFFFAOYSA-N	0	0	289.350	4.099	20	30		CIEDRN
C[C@@H](CC#N)N(C)Cc1ccc([C@H](C)C(F)(F)F)cc1	ZINC000296889497	328292548	/nfs/dbraw/zinc/29/25/48/328292548.db2.gz	XWJPUNNBXJACBF-RYUDHWBXSA-N	0	0	284.325	4.086	20	30		CIEDRN
CCCCCCCCCC(=O)Nc1c(C)nn(C)c1C	ZINC000298183207	328295337	/nfs/dbraw/zinc/29/53/37/328295337.db2.gz	GIKKKUXHJCBXBN-UHFFFAOYSA-N	0	0	279.428	4.116	20	30		CIEDRN
N#Cc1cc(/C=C\c2nc3ccccc3s2)ccc1F	ZINC000534481941	328304168	/nfs/dbraw/zinc/30/41/68/328304168.db2.gz	NEHLVZPGCPMBQQ-VURMDHGXSA-N	0	0	280.327	4.477	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)C[C@@H]1CCCC[C@@H]1C	ZINC000531896256	328305504	/nfs/dbraw/zinc/30/55/04/328305504.db2.gz	SPIBIQKBESHOMV-GJZGRUSLSA-N	0	0	278.440	4.182	20	30		CIEDRN
C#CCCCCC(=O)N(Cc1ccc([C@@H]2C[C@H]2C)o1)C1CC1	ZINC000119590190	328307389	/nfs/dbraw/zinc/30/73/89/328307389.db2.gz	ALWQUHRQSNQTQD-RHSMWYFYSA-N	0	0	299.414	4.088	20	30		CIEDRN
C=C[C@H](CC(=O)NC1CCCCCC1)c1ccccc1	ZINC000534601918	328320965	/nfs/dbraw/zinc/32/09/65/328320965.db2.gz	REMUFSAUDLIEFE-OAHLLOKOSA-N	0	0	271.404	4.185	20	30		CIEDRN
CC(C)CC[C@@H]1CCC[C@@H]1NC(=O)c1ccc(CC#N)cc1	ZINC000534613628	328325197	/nfs/dbraw/zinc/32/51/97/328325197.db2.gz	HXBFYBGRMUSRKG-WMZOPIPTSA-N	0	0	298.430	4.087	20	30		CIEDRN
N#Cc1c(Cl)cccc1NCCc1cccc(F)c1	ZINC000048936702	328326158	/nfs/dbraw/zinc/32/61/58/328326158.db2.gz	YJHWTCALOQRQLN-UHFFFAOYSA-N	0	0	274.726	4.005	20	30		CIEDRN
N#Cc1cc(F)c(NCCSc2ccccc2)c(F)c1	ZINC000111142678	328327931	/nfs/dbraw/zinc/32/79/31/328327931.db2.gz	ULIZIFLQVDZNPC-UHFFFAOYSA-N	0	0	290.338	4.041	20	30		CIEDRN
N#Cc1cc(F)c(NCc2ccc(Cl)s2)c(F)c1	ZINC000111143010	328327992	/nfs/dbraw/zinc/32/79/92/328327992.db2.gz	ILHAYOXAWIZQNY-UHFFFAOYSA-N	0	0	284.718	4.163	20	30		CIEDRN
N#Cc1cccc(-c2nc3cc4ccccc4cc3[nH]2)c1	ZINC000534629328	328328327	/nfs/dbraw/zinc/32/83/27/328328327.db2.gz	XBPIKFFQJVOXLM-UHFFFAOYSA-N	0	0	269.307	4.255	20	30		CIEDRN
C=C[C@@H](CC(=O)N[C@@H](C)Cc1ccsc1)c1ccccc1	ZINC000534644913	328330629	/nfs/dbraw/zinc/33/06/29/328330629.db2.gz	BOJLBAHDDCDPLE-HOCLYGCPSA-N	0	0	299.439	4.155	20	30		CIEDRN
C=CCOc1cccc(CNc2ccc(F)cc2F)c1	ZINC000526085223	328616840	/nfs/dbraw/zinc/61/68/40/328616840.db2.gz	KPCHVUOYCROFRM-UHFFFAOYSA-N	0	0	275.298	4.142	20	30		CIEDRN
CCC[C@H](C#N)NC(=O)CC1CCC(C(C)(C)C)CC1	ZINC000531952796	328334908	/nfs/dbraw/zinc/33/49/08/328334908.db2.gz	DGWUOFXKBTVMJT-YMAMQOFZSA-N	0	0	278.440	4.037	20	30		CIEDRN
C[C@H](CCC1CCCCC1)NC(=O)c1ccc(CC#N)cc1	ZINC000534677987	328352426	/nfs/dbraw/zinc/35/24/26/328352426.db2.gz	DPMRJFVBEWWZQM-OAHLLOKOSA-N	0	0	298.430	4.231	20	30		CIEDRN
C=CC1CCN(C(=O)N[C@H](C)c2ccccc2Cl)CC1	ZINC000111435424	328355348	/nfs/dbraw/zinc/35/53/48/328355348.db2.gz	QWQMOHNXFZZGGC-GFCCVEGCSA-N	0	0	292.810	4.009	20	30		CIEDRN
C=CC1CCN(C(=O)N[C@@H](C)c2ccc(Cl)cc2)CC1	ZINC000111435573	328355379	/nfs/dbraw/zinc/35/53/79/328355379.db2.gz	BZXKXHIPEWKVOM-LBPRGKRZSA-N	0	0	292.810	4.009	20	30		CIEDRN
C=C[C@H](CC(=O)N1CC[C@@H](C)C[C@H](C)C1)c1ccccc1	ZINC000534724274	328359378	/nfs/dbraw/zinc/35/93/78/328359378.db2.gz	ZBPGGPAKVLOJSA-IXDOHACOSA-N	0	0	285.431	4.241	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)[C@@H]1CCC[C@H](C)C1	ZINC000303805376	328357081	/nfs/dbraw/zinc/35/70/81/328357081.db2.gz	AVOKPNLSOPLRBR-LSDHHAIUSA-N	0	0	289.394	4.167	20	30		CIEDRN
C=C[C@H](CC(=O)NC1(C)CCCCC1)c1ccccc1	ZINC000534734667	328359851	/nfs/dbraw/zinc/35/98/51/328359851.db2.gz	BHEOXDVXTVGNGO-OAHLLOKOSA-N	0	0	271.404	4.185	20	30		CIEDRN
CCc1sc(C(=O)Nc2cc(C#N)ccc2C)cc1C	ZINC000049524606	328368758	/nfs/dbraw/zinc/36/87/58/328368758.db2.gz	AHCDDRIDBPOQRI-UHFFFAOYSA-N	0	0	284.384	4.051	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2cccc(Cl)c2Cl)CC1	ZINC000111703411	328376470	/nfs/dbraw/zinc/37/64/70/328376470.db2.gz	IGARDPFRQBDKBZ-UHFFFAOYSA-N	0	0	299.201	4.423	20	30		CIEDRN
CCOc1cc(C#N)ccc1OCc1ccc(CC)cc1	ZINC000049961539	328379846	/nfs/dbraw/zinc/37/98/46/328379846.db2.gz	CVUJSIWBZDNDLU-UHFFFAOYSA-N	0	0	281.355	4.098	20	30		CIEDRN
C[C@H]1C[C@@H]1c1ccc(CNc2ccc(C#N)cc2F)o1	ZINC000112012197	328381534	/nfs/dbraw/zinc/38/15/34/328381534.db2.gz	VKMHNFCZUZVXAM-GWCFXTLKSA-N	0	0	270.307	4.026	20	30		CIEDRN
C[C@H](Nc1ccc(C#N)cc1F)c1c(F)cccc1F	ZINC000112012235	328381655	/nfs/dbraw/zinc/38/16/55/328381655.db2.gz	VNJIWAXSBTUCIH-VIFPVBQESA-N	0	0	276.261	4.149	20	30		CIEDRN
CC#CCCCC(=O)N(C)Cc1ccc(C(C)(C)C)cc1	ZINC000546630766	328390416	/nfs/dbraw/zinc/39/04/16/328390416.db2.gz	OGLAITMOZXOHAN-UHFFFAOYSA-N	0	0	285.431	4.136	20	30		CIEDRN
C=C(C)CN(CC)C(=O)[C@@H]1CC[C@H]2CCCC[C@@H]2C1	ZINC000535139325	328392135	/nfs/dbraw/zinc/39/21/35/328392135.db2.gz	XHZYESAFUGITQG-BZUAXINKSA-N	0	0	263.425	4.018	20	30		CIEDRN
N#CCCN(CCC#N)Cc1ccc(C2CCCCC2)cc1	ZINC000340726175	328398936	/nfs/dbraw/zinc/39/89/36/328398936.db2.gz	XZUCRSSEGLDPBQ-UHFFFAOYSA-N	0	0	295.430	4.364	20	30		CIEDRN
CC(C)(CCC#N)CNc1ccc(C(F)(F)F)c(C#N)c1	ZINC000340939414	328402640	/nfs/dbraw/zinc/40/26/40/328402640.db2.gz	RMVUTJXGOYEBCI-UHFFFAOYSA-N	0	0	295.308	4.319	20	30		CIEDRN
C=CCCC(=O)N([C@@H](C)c1ccc(Cl)cc1)C1CC1	ZINC000102226204	328439449	/nfs/dbraw/zinc/43/94/49/328439449.db2.gz	IHJQHLFVBFRJSD-LBPRGKRZSA-N	0	0	277.795	4.358	20	30		CIEDRN
C=CCCC(=O)N(CCCC)[C@H](C)c1ccccc1	ZINC000102226974	328439531	/nfs/dbraw/zinc/43/95/31/328439531.db2.gz	SOWKHOZPLNFQLG-OAHLLOKOSA-N	0	0	259.393	4.343	20	30		CIEDRN
C=C[C@H](CC(=O)NCCc1cccc(C)c1)c1ccccc1	ZINC000535408063	328451741	/nfs/dbraw/zinc/45/17/41/328451741.db2.gz	ADFAEPZAYRGFNR-GOSISDBHSA-N	0	0	293.410	4.014	20	30		CIEDRN
C=C[C@H](CC(=O)N(C)[C@H]1CCCC[C@H]1C)c1ccccc1	ZINC000535418866	328452474	/nfs/dbraw/zinc/45/24/74/328452474.db2.gz	ZGPKKUXSKHTBEP-NUJGCVRESA-N	0	0	285.431	4.383	20	30		CIEDRN
CO[C@H]1CCC[C@H](CC(=O)Nc2cccc3ocnc32)C1	ZINC000328873282	328458983	/nfs/dbraw/zinc/45/89/83/328458983.db2.gz	IZXQTCCHVUGAEN-RYUDHWBXSA-N	0	0	288.347	4.011	20	30		CIEDRN
CCN(C(=O)[C@H](C)c1cccc(C)c1)c1ccc(C#N)cc1	ZINC000152303834	328469931	/nfs/dbraw/zinc/46/99/31/328469931.db2.gz	WASDIJLAXICATI-OAHLLOKOSA-N	0	0	292.382	4.023	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc(OC(C)C)c(C)c1	ZINC000571662390	328482858	/nfs/dbraw/zinc/48/28/58/328482858.db2.gz	LQPYAYCKKNEOKP-UHFFFAOYSA-N	0	0	275.392	4.323	20	30		CIEDRN
CC(C)OC1CCC(Nc2cc(Cl)ccc2C#N)CC1	ZINC000130107882	328487829	/nfs/dbraw/zinc/48/78/29/328487829.db2.gz	LLULWBRHUMCZAI-UHFFFAOYSA-N	0	0	292.810	4.360	20	30		CIEDRN
Cc1ccc2ccnc(N[C@H]3CC[C@@H](CC#N)C3)c2c1	ZINC000563711016	328486990	/nfs/dbraw/zinc/48/69/90/328486990.db2.gz	XZVWRQHZUCVFIZ-ZFWWWQNUSA-N	0	0	265.360	4.038	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1c(CC)cccc1CC	ZINC000184891061	328539135	/nfs/dbraw/zinc/53/91/35/328539135.db2.gz	QMQIGOPGCXAEMS-CYBMUJFWSA-N	0	0	259.393	4.352	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H](C)c1ccccc1OC(F)F	ZINC000293119357	328543353	/nfs/dbraw/zinc/54/33/53/328543353.db2.gz	YAJTWMYSMJBCEG-NSHDSACASA-N	0	0	297.345	4.068	20	30		CIEDRN
Cc1cc(Oc2ccncc2C#N)cc(C)c1Cl	ZINC000399471970	326799363	/nfs/dbraw/zinc/79/93/63/326799363.db2.gz	VUQQCUXCVVMHNW-UHFFFAOYSA-N	0	0	258.708	4.016	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1ccc(Cl)cc1Cl	ZINC000116996406	326817128	/nfs/dbraw/zinc/81/71/28/326817128.db2.gz	JMIVOYRAEJSNCF-QMMMGPOBSA-N	0	0	273.163	4.080	20	30		CIEDRN
N#Cc1ccccc1NC(=O)CC1CC(c2ccccc2)C1	ZINC000538402722	326829404	/nfs/dbraw/zinc/82/94/04/326829404.db2.gz	IMGABDJEUHZPRV-UHFFFAOYSA-N	0	0	290.366	4.081	20	30		CIEDRN
N#Cc1ccc(SCc2cccc(OC(F)F)c2)cc1	ZINC000109573368	326859940	/nfs/dbraw/zinc/85/99/40/326859940.db2.gz	YWWKSCGEXBKEMQ-UHFFFAOYSA-N	0	0	291.322	4.452	20	30		CIEDRN
Cc1ccsc1-c1noc(/C=C/c2ccc(C#N)cc2)n1	ZINC000584023755	326860639	/nfs/dbraw/zinc/86/06/39/326860639.db2.gz	BQDLBHAARADHRQ-VOTSOKGWSA-N	0	0	293.351	4.149	20	30		CIEDRN
C[C@@H](Nc1cccc(OCCCC#N)c1)c1ccco1	ZINC000037777346	326861348	/nfs/dbraw/zinc/86/13/48/326861348.db2.gz	UOYMXDDJWBZSHI-CYBMUJFWSA-N	0	0	270.332	4.135	20	30		CIEDRN
Cc1ccc(CNc2cccc(OCCCC#N)c2)cc1	ZINC000037777375	326861424	/nfs/dbraw/zinc/86/14/24/326861424.db2.gz	WOXVNKDALYGXLJ-UHFFFAOYSA-N	0	0	280.371	4.290	20	30		CIEDRN
C=CCCCNC(=O)Nc1ccc(OC2CCCC2)cc1	ZINC000584033641	326866550	/nfs/dbraw/zinc/86/65/50/326866550.db2.gz	WJYFENRYEWUYAI-UHFFFAOYSA-N	0	0	288.391	4.096	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(C2(c3ccccc3OC)CC2)no1	ZINC000556365002	326923369	/nfs/dbraw/zinc/92/33/69/326923369.db2.gz	KZOISYAIAPZLNH-ZDUSSCGKSA-N	0	0	298.386	4.228	20	30		CIEDRN
N#CCc1ccc(C(=O)Nc2cccc(C3CCC3)c2)cc1	ZINC000584087371	326925161	/nfs/dbraw/zinc/92/51/61/326925161.db2.gz	VGUDPFCTNOQBAX-UHFFFAOYSA-N	0	0	290.366	4.272	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@H]1CCC[C@@H]1CCC(C)C	ZINC000556423776	326940812	/nfs/dbraw/zinc/94/08/12/326940812.db2.gz	YAPZTIBYYSSCSI-CVEARBPZSA-N	0	0	280.456	4.199	20	30		CIEDRN
CC(C)(C#N)C(=O)Nc1cccc(-c2cccc(Cl)c2)c1	ZINC000556481691	326944365	/nfs/dbraw/zinc/94/43/65/326944365.db2.gz	RCXUDLUAHKCCRJ-UHFFFAOYSA-N	0	0	298.773	4.495	20	30		CIEDRN
Cc1ccc(/C=C\CC(=O)Nc2ccc(F)cc2C#N)cc1	ZINC000255195715	326957092	/nfs/dbraw/zinc/95/70/92/326957092.db2.gz	NVZNLKRUWPAISH-IHWYPQMZSA-N	0	0	294.329	4.048	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)Nc1ccc(CCC(C)C)cc1	ZINC000556807340	326966540	/nfs/dbraw/zinc/96/65/40/326966540.db2.gz	WWZURXKSUWFJHI-QGZVFWFLSA-N	0	0	272.392	4.154	20	30		CIEDRN
CCn1c2ccccc2c2cc(NCCC#N)ccc21	ZINC000556982368	326987927	/nfs/dbraw/zinc/98/79/27/326987927.db2.gz	QDYCTZTTXFLSII-UHFFFAOYSA-N	0	0	263.344	4.140	20	30		CIEDRN
C[C@@H](CC(C)(C)C)C(=O)Nc1cc(C#N)ccc1NC1CC1	ZINC000557065656	326991715	/nfs/dbraw/zinc/99/17/15/326991715.db2.gz	ZGQWNSFIHKCABZ-LBPRGKRZSA-N	0	0	299.418	4.143	20	30		CIEDRN
C=C(CC)CSc1n[nH]c(C=Cc2ccccc2)n1	ZINC000557298893	327000829	/nfs/dbraw/zinc/00/08/29/327000829.db2.gz	AUXUKCJIHVGRAD-KTKRTIGZSA-N	0	0	271.389	4.033	20	30		CIEDRN
C[C@@H](CC(C)(C)c1ccccc1)Nc1cc(C#N)ccn1	ZINC000557527780	327012034	/nfs/dbraw/zinc/01/20/34/327012034.db2.gz	VGOANJAGRGPRNE-AWEZNQCLSA-N	0	0	279.387	4.122	20	30		CIEDRN
CCCCC[C@H]1CCCN1c1nccc(C#N)c1Cl	ZINC000557625846	327017021	/nfs/dbraw/zinc/01/70/21/327017021.db2.gz	MFMNFNOXEOITSJ-ZDUSSCGKSA-N	0	0	277.799	4.156	20	30		CIEDRN
CCc1cc(CC)nc(N[C@@H](CCC#N)c2ccccc2)n1	ZINC000557643991	327018555	/nfs/dbraw/zinc/01/85/55/327018555.db2.gz	NRLLPJBQAAAYDJ-KRWDZBQOSA-N	0	0	294.402	4.058	20	30		CIEDRN
CC(C)C[C@@H]1CCCCN1c1nccc(C#N)c1Cl	ZINC000553448301	327028426	/nfs/dbraw/zinc/02/84/26/327028426.db2.gz	VLUARWWGGNTJBN-ZDUSSCGKSA-N	0	0	277.799	4.012	20	30		CIEDRN
C=CCc1ccc(OCc2ccc(F)cc2)c(OC)c1	ZINC000255935018	327032887	/nfs/dbraw/zinc/03/28/87/327032887.db2.gz	TVVYFSZGSZWOLZ-UHFFFAOYSA-N	0	0	272.319	4.142	20	30		CIEDRN
C=CCCOCCCCC(=O)Nc1ccc(/C=C\C)cc1	ZINC000557935128	327035778	/nfs/dbraw/zinc/03/57/78/327035778.db2.gz	LMQXXBPJNZCUKY-YWEYNIOJSA-N	0	0	287.403	4.421	20	30		CIEDRN
C[C@H](NC(=O)CC(C)(C)C#N)c1ccc(F)c2ccccc21	ZINC000557936431	327035978	/nfs/dbraw/zinc/03/59/78/327035978.db2.gz	HWZKQENKQSYIGL-LBPRGKRZSA-N	0	0	298.361	4.096	20	30		CIEDRN
C[C@@H](NC(=O)CC(C)(C)C#N)c1ccc(F)c2ccccc21	ZINC000557936430	327036007	/nfs/dbraw/zinc/03/60/07/327036007.db2.gz	HWZKQENKQSYIGL-GFCCVEGCSA-N	0	0	298.361	4.096	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N1Cc2cccc(Cl)c2C1	ZINC000557945966	327036684	/nfs/dbraw/zinc/03/66/84/327036684.db2.gz	CJACZLCPOMWMKX-LBPRGKRZSA-N	0	0	292.810	4.110	20	30		CIEDRN
CCc1cccc2c1OCC[C@H]2Nc1ccc(C#N)cc1	ZINC000506752678	332779004	/nfs/dbraw/zinc/77/90/04/332779004.db2.gz	UYZQRGQOVSKTQF-QGZVFWFLSA-N	0	0	278.355	4.056	20	30		CIEDRN
CC(C)(C)CCCCC(=O)N1CCCC(C)(C)[C@@H]1C#N	ZINC000584118538	327042698	/nfs/dbraw/zinc/04/26/98/327042698.db2.gz	ZOKRLGNARCDYQP-AWEZNQCLSA-N	0	0	278.440	4.134	20	30		CIEDRN
Cc1csc(NC(=O)Cc2c(C)cc(C)cc2C)c1C#N	ZINC000584196649	327063050	/nfs/dbraw/zinc/06/30/50/327063050.db2.gz	CJEUPVAEEQILSE-UHFFFAOYSA-N	0	0	298.411	4.035	20	30		CIEDRN
C=CCCCCNc1cc(Cl)ccc1NC(C)=O	ZINC000584214052	327064845	/nfs/dbraw/zinc/06/48/45/327064845.db2.gz	GYKCONIPBZAVCH-UHFFFAOYSA-N	0	0	266.772	4.067	20	30		CIEDRN
N#Cc1cnc(N[C@H]2CCC[C@@H]2c2ccccc2)c(Cl)c1	ZINC000558116520	327074661	/nfs/dbraw/zinc/07/46/61/327074661.db2.gz	KEVRVBVGADEGCO-ZBFHGGJFSA-N	0	0	297.789	4.355	20	30		CIEDRN
C=CCC1(C(=O)Nc2cccc(F)c2Cl)CCC1	ZINC000558264457	327083853	/nfs/dbraw/zinc/08/38/53/327083853.db2.gz	WGEHMMMIEOXNRX-UHFFFAOYSA-N	0	0	267.731	4.164	20	30		CIEDRN
C=C(C)CCNc1cc(Cl)ccc1OCCOCC	ZINC000558268814	327084214	/nfs/dbraw/zinc/08/42/14/327084214.db2.gz	UVHBPORIRJPPKT-UHFFFAOYSA-N	0	0	283.799	4.133	20	30		CIEDRN
CC(C)[C@H](CNc1cccc(F)c1C#N)Nc1ccccc1	ZINC000506849601	332781110	/nfs/dbraw/zinc/78/11/10/332781110.db2.gz	FVDGHXGEWZFCNU-SFHVURJKSA-N	0	0	297.377	4.246	20	30		CIEDRN
CC(C)(C#N)Cc1nc(-c2ccc3sccc3c2)no1	ZINC000558336765	327087433	/nfs/dbraw/zinc/08/74/33/327087433.db2.gz	SZJFTMZOVDTRCN-UHFFFAOYSA-N	0	0	283.356	4.044	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(-c2cc(C)c3ccccc3n2)no1	ZINC000558370722	327089140	/nfs/dbraw/zinc/08/91/40/327089140.db2.gz	VTUQJIKKOJSDDB-GOSISDBHSA-N	0	0	293.370	4.447	20	30		CIEDRN
Cc1ccsc1CNc1c(C#N)cnc2ccccc21	ZINC000090794595	327100607	/nfs/dbraw/zinc/10/06/07/327100607.db2.gz	UZHUKCMVBZFLJH-UHFFFAOYSA-N	0	0	279.368	4.089	20	30		CIEDRN
C=C(C)CCc1noc(-c2ccc3c(c2)CCCCC3=O)n1	ZINC000558520570	327101077	/nfs/dbraw/zinc/10/10/77/327101077.db2.gz	DRQJFWGFEMMMMN-UHFFFAOYSA-N	0	0	296.370	4.154	20	30		CIEDRN
C=C(C)CSCc1ncc(-c2ccccc2C)o1	ZINC000533816497	327107594	/nfs/dbraw/zinc/10/75/94/327107594.db2.gz	UQJYXYALHTWKPZ-UHFFFAOYSA-N	0	0	259.374	4.459	20	30		CIEDRN
C[C@@H](CC(C)(C)C)C(=O)N[C@@](C)(C#N)C1CCCCC1	ZINC000558717327	327116646	/nfs/dbraw/zinc/11/66/46/327116646.db2.gz	NDGAJGZKSQFUFV-GUYCJALGSA-N	0	0	278.440	4.037	20	30		CIEDRN
N#CCc1cccc(NC(=O)CC2CCCCCC2)c1	ZINC000313442859	327130995	/nfs/dbraw/zinc/13/09/95/327130995.db2.gz	JZGSCLRWXZDSEG-UHFFFAOYSA-N	0	0	270.376	4.052	20	30		CIEDRN
C[C@H](CCNc1ccc(C#N)c([N+](=O)[O-])c1)c1ccccc1	ZINC000317630460	327131276	/nfs/dbraw/zinc/13/12/76/327131276.db2.gz	WHWIGOXPNSCGOR-CYBMUJFWSA-N	0	0	295.342	4.072	20	30		CIEDRN
C=C[C@@H](Cc1nc(-c2ccoc2C)no1)c1ccccc1	ZINC000564455639	327131751	/nfs/dbraw/zinc/13/17/51/327131751.db2.gz	AJRQKPCAFIEWCO-ZDUSSCGKSA-N	0	0	280.327	4.150	20	30		CIEDRN
CN(Cc1c(Cl)cccc1Cl)[C@@H]1CC[C@@H](C#N)C1	ZINC000559067042	327139671	/nfs/dbraw/zinc/13/96/71/327139671.db2.gz	WENBIXDFBKEGGI-GHMZBOCLSA-N	0	0	283.202	4.117	20	30		CIEDRN
CN(Cc1c(Cl)cccc1Cl)[C@H]1CC[C@H](C#N)C1	ZINC000559067044	327139881	/nfs/dbraw/zinc/13/98/81/327139881.db2.gz	WENBIXDFBKEGGI-QWRGUYRKSA-N	0	0	283.202	4.117	20	30		CIEDRN
C=C1CCN(C(=O)c2ccccc2OC2CCCCC2)CC1	ZINC000525569305	327145060	/nfs/dbraw/zinc/14/50/60/327145060.db2.gz	SQRVXVXUDDBDOW-UHFFFAOYSA-N	0	0	299.414	4.190	20	30		CIEDRN
CC(C)(C)C[C@H]1CCCN1c1cccc(F)c1C#N	ZINC000507016553	332784247	/nfs/dbraw/zinc/78/42/47/332784247.db2.gz	ZESBEYBFYUFIGE-GFCCVEGCSA-N	0	0	260.356	4.102	20	30		CIEDRN
Cc1cc(C)c(C#N)c(NCc2ccc3ccccc3c2)n1	ZINC000507016207	332784294	/nfs/dbraw/zinc/78/42/94/332784294.db2.gz	WAYTYZHFLMWYQA-UHFFFAOYSA-N	0	0	287.366	4.335	20	30		CIEDRN
C[C@H](c1ccco1)N(Cc1cc(C#N)ccc1F)C1CC1	ZINC000086234428	327156387	/nfs/dbraw/zinc/15/63/87/327156387.db2.gz	IZVRLMGNROFDPJ-GFCCVEGCSA-N	0	0	284.334	4.016	20	30		CIEDRN
CC(=O)c1ccc(C#N)cc1N(C)Cc1cccc(Cl)c1	ZINC000130609475	327158872	/nfs/dbraw/zinc/15/88/72/327158872.db2.gz	CAJBJPQBQHQGQJ-UHFFFAOYSA-N	0	0	298.773	4.051	20	30		CIEDRN
CC(C)c1ccc(/C=C/CC(=O)NC2(C#N)CCCC2)cc1	ZINC000152670929	327162050	/nfs/dbraw/zinc/16/20/50/327162050.db2.gz	YYEUHHZSSGQFOM-AATRIKPKSA-N	0	0	296.414	4.166	20	30		CIEDRN
N#Cc1nc(N[C@H]2CCC23CCCC3)ccc1C(F)(F)F	ZINC000409659921	327163295	/nfs/dbraw/zinc/16/32/95/327163295.db2.gz	OZXGSTSXFDJJDY-LBPRGKRZSA-N	0	0	295.308	4.107	20	30		CIEDRN
CC[C@@H](C)CSc1ccc(C(F)(F)F)c(C#N)n1	ZINC000409724466	327163588	/nfs/dbraw/zinc/16/35/88/327163588.db2.gz	XHRXETIIIDTCJN-MRVPVSSYSA-N	0	0	274.311	4.110	20	30		CIEDRN
C=CCCc1ccccc1NCc1nc2cccnc2s1	ZINC000409835915	327165344	/nfs/dbraw/zinc/16/53/44/327165344.db2.gz	MEVNQPYOYSSOLZ-UHFFFAOYSA-N	0	0	295.411	4.422	20	30		CIEDRN
C=CCCc1ccccc1NCc1nc(C)sc1C	ZINC000409862491	327166302	/nfs/dbraw/zinc/16/63/02/327166302.db2.gz	PVBNNMLNMAPLRW-UHFFFAOYSA-N	0	0	272.417	4.491	20	30		CIEDRN
CC(C)COCCSCCCCC(C)(C)C#N	ZINC000409853189	327166586	/nfs/dbraw/zinc/16/65/86/327166586.db2.gz	AFXIBOSGWUSIPD-UHFFFAOYSA-N	0	0	257.443	4.112	20	30		CIEDRN
C=CCCCCNC(=O)[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000409920513	327167365	/nfs/dbraw/zinc/16/73/65/327167365.db2.gz	GIGMGOBEEIUTBJ-LBPRGKRZSA-N	0	0	299.336	4.281	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Cc1cccc(Cl)c1Cl	ZINC000410120368	327180111	/nfs/dbraw/zinc/18/01/11/327180111.db2.gz	LQKRSLGTTZUHAE-NSHDSACASA-N	0	0	286.202	4.007	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)C1CCC(c2ccccc2)CC1	ZINC000410146138	327181321	/nfs/dbraw/zinc/18/13/21/327181321.db2.gz	UDUXSDDLWMZWFG-DAWZGUTISA-N	0	0	285.431	4.431	20	30		CIEDRN
CC(C)c1ccc2occ(C(=O)NC3(C#N)CCCC3)c2c1	ZINC000569484946	327184846	/nfs/dbraw/zinc/18/48/46/327184846.db2.gz	JAXDJAYTPHGSAQ-UHFFFAOYSA-N	0	0	296.370	4.122	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)Cc1cccs1	ZINC000410354918	327187294	/nfs/dbraw/zinc/18/72/94/327187294.db2.gz	RPJJLJMIOGMOBT-UHFFFAOYSA-N	0	0	271.385	4.048	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1ccc(N(C)C)cc1	ZINC000410354808	327187335	/nfs/dbraw/zinc/18/73/35/327187335.db2.gz	PLUZJMOUZGYJOL-UHFFFAOYSA-N	0	0	294.398	4.124	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)CCc1cccs1	ZINC000410355216	327187340	/nfs/dbraw/zinc/18/73/40/327187340.db2.gz	QFRZWAOOLQBKOZ-UHFFFAOYSA-N	0	0	285.412	4.438	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)C1=C(C)CCC1	ZINC000410344870	327187462	/nfs/dbraw/zinc/18/74/62/327187462.db2.gz	MSPCHUMGLAZQNM-UHFFFAOYSA-N	0	0	255.361	4.244	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)[C@H]1CCCCS1	ZINC000410344776	327187597	/nfs/dbraw/zinc/18/75/97/327187597.db2.gz	LXZSWMVMXJGFAD-OAHLLOKOSA-N	0	0	275.417	4.029	20	30		CIEDRN
C=C(C)CCSCc1nnc(-c2ccccc2)s1	ZINC000507115429	332787599	/nfs/dbraw/zinc/78/75/99/332787599.db2.gz	GUPODPGRJKPNIF-UHFFFAOYSA-N	0	0	276.430	4.405	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N[C@@H](C)c1ccc(F)cc1F	ZINC000573587276	327200000	/nfs/dbraw/zinc/20/00/00/327200000.db2.gz	AKXJFSMPUHPIGO-RYUDHWBXSA-N	0	0	296.361	4.070	20	30		CIEDRN
CC(C)(C)CCCC(=O)N(CCC#N)c1ccc(F)cc1	ZINC000569584411	327201514	/nfs/dbraw/zinc/20/15/14/327201514.db2.gz	JFMZPQIFIONREV-UHFFFAOYSA-N	0	0	290.382	4.289	20	30		CIEDRN
C=C(C)CCSCc1nc(-c2ccc(F)c(F)c2)no1	ZINC000507131147	332788800	/nfs/dbraw/zinc/78/88/00/332788800.db2.gz	DCXRKYBOGPBRRY-UHFFFAOYSA-N	0	0	296.342	4.214	20	30		CIEDRN
C=C[C@@H](CC(=O)NCc1cccc(Cl)c1)c1ccccc1	ZINC000533879991	327231184	/nfs/dbraw/zinc/23/11/84/327231184.db2.gz	YZMJRTPHCWNEJP-HNNXBMFYSA-N	0	0	299.801	4.316	20	30		CIEDRN
CCCC[C@@H](CC)CC(=O)N[C@](C)(C#N)CC(C)C	ZINC000533878029	327231314	/nfs/dbraw/zinc/23/13/14/327231314.db2.gz	UOYKNHZQNCZHIA-ZBFHGGJFSA-N	0	0	266.429	4.037	20	30		CIEDRN
Cc1c(Cl)cc(F)c(NCc2ccc(C#N)cc2)c1F	ZINC000536390816	327235034	/nfs/dbraw/zinc/23/50/34/327235034.db2.gz	MQUCQOJXIUMBJT-UHFFFAOYSA-N	0	0	292.716	4.410	20	30		CIEDRN
C=CCN(C(=O)CCc1ccc(-c2ccccc2)o1)C1CC1	ZINC000537933085	327239409	/nfs/dbraw/zinc/23/94/09/327239409.db2.gz	KIGSFOVEAOCDJK-UHFFFAOYSA-N	0	0	295.382	4.056	20	30		CIEDRN
CC(C)[C@@H]1CCc2ccccc2N1CCCCC#N	ZINC000536471845	327240693	/nfs/dbraw/zinc/24/06/93/327240693.db2.gz	MCNJDOHAFCYPCP-INIZCTEOSA-N	0	0	256.393	4.158	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Nc1scnc1C1CC1	ZINC000536512955	327242689	/nfs/dbraw/zinc/24/26/89/327242689.db2.gz	KLAJUQILOYHRNZ-UHFFFAOYSA-N	0	0	293.436	4.231	20	30		CIEDRN
C=CCN(CCC#N)C(=O)Nc1ccc(CCC(C)C)cc1	ZINC000559438458	327245215	/nfs/dbraw/zinc/24/52/15/327245215.db2.gz	XMMPWZSNRALXNO-UHFFFAOYSA-N	0	0	299.418	4.209	20	30		CIEDRN
Cc1coc(-c2cc(N[C@@H]3CC[C@H](C#N)C3)ccc2C)n1	ZINC000555951447	327250240	/nfs/dbraw/zinc/25/02/40/327250240.db2.gz	TYVGFBOFAUZLIG-UONOGXRCSA-N	0	0	281.359	4.063	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc(Oc2ccccc2)cn1	ZINC000559553713	327253609	/nfs/dbraw/zinc/25/36/09/327253609.db2.gz	XRSHZIZADWQJRQ-UHFFFAOYSA-N	0	0	296.370	4.415	20	30		CIEDRN
C[C@@](C#N)(NC(=O)C1CCC(C)(C)CC1)C1CCCCC1	ZINC000559596378	327255092	/nfs/dbraw/zinc/25/50/92/327255092.db2.gz	MTAKTZQNWYSGMX-SFHVURJKSA-N	0	0	290.451	4.182	20	30		CIEDRN
N#Cc1ccc(N2CCC[C@H]2c2ccc(F)cc2)cc1	ZINC000507148958	332790914	/nfs/dbraw/zinc/79/09/14/332790914.db2.gz	ULKLBXQRINCYRB-KRWDZBQOSA-N	0	0	266.319	4.039	20	30		CIEDRN
CC(C)Oc1cccc([C@@H](NCCCCC#N)C(F)F)c1	ZINC000559894337	327269095	/nfs/dbraw/zinc/26/90/95/327269095.db2.gz	QIHSAJHANXOFTC-OAHLLOKOSA-N	0	0	296.361	4.063	20	30		CIEDRN
C=CC[C@H](C)[C@H](C)Nc1ccc([C@H]2CCOC2)cc1	ZINC000559896841	327269457	/nfs/dbraw/zinc/26/94/57/327269457.db2.gz	BNNRWGHYSDKTOC-DZKIICNBSA-N	0	0	259.393	4.203	20	30		CIEDRN
Cc1nc2c(cccc2OCc2ccc(C#N)cc2Cl)o1	ZINC000559948482	327273628	/nfs/dbraw/zinc/27/36/28/327273628.db2.gz	LRTRQDDFNDERBX-UHFFFAOYSA-N	0	0	298.729	4.240	20	30		CIEDRN
C=CCC(C)(C)c1noc(Cc2cccc3cccnc32)n1	ZINC000560021847	327278030	/nfs/dbraw/zinc/27/80/30/327278030.db2.gz	IWEKZTMLLPXZAC-UHFFFAOYSA-N	0	0	293.370	4.062	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H]2CC[C@H](C(F)(F)F)C2)n1	ZINC000560024005	327278090	/nfs/dbraw/zinc/27/80/90/327278090.db2.gz	RMCWRSMYPIYMAZ-ZJUUUORDSA-N	0	0	288.313	4.369	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H]2[C@H](C)[C@@H]2c2ccccc2)n1	ZINC000560024375	327278194	/nfs/dbraw/zinc/27/81/94/327278194.db2.gz	SZDNPDOUWLQENJ-BPLDGKMQSA-N	0	0	282.387	4.440	20	30		CIEDRN
C=CCC(C)(C)c1noc(/C=C/c2ccccc2)n1	ZINC000560026217	327278371	/nfs/dbraw/zinc/27/83/71/327278371.db2.gz	FTNVAZQNZCFCDX-ZHACJKMWSA-N	0	0	254.333	4.094	20	30		CIEDRN
C=CCC(C)(C)c1noc(CCc2ccccc2C)n1	ZINC000560025679	327278452	/nfs/dbraw/zinc/27/84/52/327278452.db2.gz	RKWDCNGTCIHPHN-UHFFFAOYSA-N	0	0	270.376	4.017	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cn(C)c3ccccc23)n1	ZINC000560025774	327278461	/nfs/dbraw/zinc/27/84/61/327278461.db2.gz	SSARCAGZLNAQAU-UHFFFAOYSA-N	0	0	281.359	4.082	20	30		CIEDRN
C=CCC(C)(C)c1noc(Cc2ccc(Cl)cc2)n1	ZINC000560028701	327278566	/nfs/dbraw/zinc/27/85/66/327278566.db2.gz	QSAPIGLTAHBYNM-UHFFFAOYSA-N	0	0	276.767	4.168	20	30		CIEDRN
N#C[C@H](NC(=O)c1cc2ccccc2s1)C1CCCCC1	ZINC000048855585	327280197	/nfs/dbraw/zinc/28/01/97/327280197.db2.gz	BWEWRILJYDCPHP-AWEZNQCLSA-N	0	0	298.411	4.104	20	30		CIEDRN
CC[C@@H]1CCCC[C@H]1c1noc(-c2cccc(C#N)c2)n1	ZINC000560048796	327280553	/nfs/dbraw/zinc/28/05/53/327280553.db2.gz	JPMRUMMDDRUBJL-UKRRQHHQSA-N	0	0	281.359	4.292	20	30		CIEDRN
C[C@@H](C(=O)Nc1ccc(CC#N)cc1)c1cccc(Cl)c1	ZINC000525623834	327282944	/nfs/dbraw/zinc/28/29/44/327282944.db2.gz	GGCDKDRMEUJOTF-GFCCVEGCSA-N	0	0	298.773	4.148	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)[C@@H](C)c1ccccc1	ZINC000163805478	327285643	/nfs/dbraw/zinc/28/56/43/327285643.db2.gz	QOUOZURSFRHDER-INIZCTEOSA-N	0	0	279.383	4.005	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)Nc1ccc2oc3ccccc3c2c1	ZINC000560421581	327306258	/nfs/dbraw/zinc/30/62/58/327306258.db2.gz	CZXPJOXPWNPMTN-SFHVURJKSA-N	0	0	292.338	4.464	20	30		CIEDRN
Cc1cccc(/C=C\c2ccncc2C#N)c1OC(F)F	ZINC000560422019	327306456	/nfs/dbraw/zinc/30/64/56/327306456.db2.gz	ZSMIUQAATHZACP-WAYWQWQTSA-N	0	0	286.281	4.034	20	30		CIEDRN
C=CCC[C@@H](Nc1ccc(N2CCCC2)nc1)c1ccco1	ZINC000560548235	327323261	/nfs/dbraw/zinc/32/32/61/327323261.db2.gz	CMFZXGAVDPRLDG-MRXNPFEDSA-N	0	0	297.402	4.394	20	30		CIEDRN
C=CCC[C@H](Nc1cnn(C(C)(C)C)c1)c1ccco1	ZINC000560549936	327323533	/nfs/dbraw/zinc/32/35/33/327323533.db2.gz	ZTESCRXZWXNQIV-AWEZNQCLSA-N	0	0	273.380	4.351	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1cccc(O[C@@H](C)CC)c1	ZINC000560744447	327340750	/nfs/dbraw/zinc/34/07/50/327340750.db2.gz	QVHWDMICLDYCAQ-AWEZNQCLSA-N	0	0	290.407	4.294	20	30		CIEDRN
CC(C)(CCC#N)CNc1ccc2ncsc2c1	ZINC000120683308	327345722	/nfs/dbraw/zinc/34/57/22/327345722.db2.gz	RFJCWLUNAPKMDM-UHFFFAOYSA-N	0	0	259.378	4.038	20	30		CIEDRN
Cc1cn(CC2CCC(C(F)(F)F)CC2)cc1C#N	ZINC000583415714	327351846	/nfs/dbraw/zinc/35/18/46/327351846.db2.gz	AWBCCUBRZMUIMH-UHFFFAOYSA-N	0	0	270.298	4.037	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cccc(-c2ncco2)c1C	ZINC000560988778	327356369	/nfs/dbraw/zinc/35/63/69/327356369.db2.gz	CJKVCFKBMNFUMX-KRWDZBQOSA-N	0	0	284.359	4.191	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)CCCCC(C)(C)C	ZINC000561306568	327384479	/nfs/dbraw/zinc/38/44/79/327384479.db2.gz	DFVHOLPMPUNNPF-AWEZNQCLSA-N	0	0	251.414	4.160	20	30		CIEDRN
C/C(=C\c1ccccc1)CN(C)c1nccc(C#N)c1Cl	ZINC000561340317	327386870	/nfs/dbraw/zinc/38/68/70/327386870.db2.gz	NNNCBACUXKFEPK-JLHYYAGUSA-N	0	0	297.789	4.146	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@H](c2ccccc2)[C@@H](C)C1	ZINC000150911434	327398760	/nfs/dbraw/zinc/39/87/60/327398760.db2.gz	BMRAXKAYDOFGBX-LPHOPBHVSA-N	0	0	297.442	4.407	20	30		CIEDRN
C[C@@](C#N)(NC(=O)c1cc2ccccc2o1)C1CCCCC1	ZINC000561601476	327404230	/nfs/dbraw/zinc/40/42/30/327404230.db2.gz	RDLUFSPMVAGIBW-SFHVURJKSA-N	0	0	296.370	4.025	20	30		CIEDRN
C[C@](C#N)(NC(=O)c1cc2ccccc2o1)C1CCCCC1	ZINC000561601475	327404272	/nfs/dbraw/zinc/40/42/72/327404272.db2.gz	RDLUFSPMVAGIBW-GOSISDBHSA-N	0	0	296.370	4.025	20	30		CIEDRN
C[C@@H](Nc1cccc(C#N)n1)c1ccc(F)c2ccccc21	ZINC000561688291	327410619	/nfs/dbraw/zinc/41/06/19/327410619.db2.gz	IJQYEQAGTRBCHL-GFCCVEGCSA-N	0	0	291.329	4.419	20	30		CIEDRN
C=CCN(C(=O)c1ccccc1OC1CC1)c1ccccc1	ZINC000561688427	327410790	/nfs/dbraw/zinc/41/07/90/327410790.db2.gz	OMDFJZPZXDCGDQ-UHFFFAOYSA-N	0	0	293.366	4.061	20	30		CIEDRN
C=CC[C@H](C)NC(=O)c1ccccc1Nc1ccc(C)cc1	ZINC000561752192	327417367	/nfs/dbraw/zinc/41/73/67/327417367.db2.gz	WCVMNYWROKGXGY-HNNXBMFYSA-N	0	0	294.398	4.433	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2cccc(C(F)(F)F)n2)no1	ZINC000561893415	327428944	/nfs/dbraw/zinc/42/89/44/327428944.db2.gz	DSTZXCPSCIMGNQ-SECBINFHSA-N	0	0	297.280	4.220	20	30		CIEDRN
CC1(Cc2noc(/C=C\c3cccc(C#N)c3)n2)CCCC1	ZINC000561934745	327431488	/nfs/dbraw/zinc/43/14/88/327431488.db2.gz	BVKVDSCVNQBOKD-FPLPWBNLSA-N	0	0	293.370	4.234	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)C[C@H](C)c1ccccc1	ZINC000248158914	327470587	/nfs/dbraw/zinc/47/05/87/327470587.db2.gz	KAELHXSZFLJUTN-HNNXBMFYSA-N	0	0	299.439	4.457	20	30		CIEDRN
C[C@H](C(=O)Nc1ccc(Cl)c(C#N)c1)c1ccsc1	ZINC000151545564	327476058	/nfs/dbraw/zinc/47/60/58/327476058.db2.gz	HNXDHRUEFCRSKO-VIFPVBQESA-N	0	0	290.775	4.015	20	30		CIEDRN
N#Cc1c(F)cccc1SCc1cc(F)cc(F)c1	ZINC000562440528	327481234	/nfs/dbraw/zinc/48/12/34/327481234.db2.gz	SGNNELFYOBIPSS-UHFFFAOYSA-N	0	0	279.286	4.268	20	30		CIEDRN
CC(C)CCc1ccccc1N[C@@H]1CC[C@H](C#N)C1	ZINC000562525216	327487417	/nfs/dbraw/zinc/48/74/17/327487417.db2.gz	QKHGOISISPTTFS-GOEBONIOSA-N	0	0	256.393	4.379	20	30		CIEDRN
Cc1ccccc1[C@@H](C)Sc1cc(C#N)ccn1	ZINC000151720958	327496615	/nfs/dbraw/zinc/49/66/15/327496615.db2.gz	TVJGWSRZTUMDFZ-GFCCVEGCSA-N	0	0	254.358	4.115	20	30		CIEDRN
C=CCC(CC=C)C(=O)NC(C)(C)c1ccc(F)c(F)c1	ZINC000151748538	327500156	/nfs/dbraw/zinc/50/01/56/327500156.db2.gz	QUCZCDRIUDIBAY-UHFFFAOYSA-N	0	0	293.357	4.085	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1[C@H](C)C[C@@H](c2ccccc2)[C@H]1C	ZINC000248635455	327507628	/nfs/dbraw/zinc/50/76/28/327507628.db2.gz	UEKXAQMZJYLUNL-BVIKNXMNSA-N	0	0	285.431	4.382	20	30		CIEDRN
C=C(C)CCc1noc(C(C)(C)Oc2ccc(F)cc2)n1	ZINC000569650038	327530564	/nfs/dbraw/zinc/53/05/64/327530564.db2.gz	XWURPVWBYKHOMB-UHFFFAOYSA-N	0	0	290.338	4.032	20	30		CIEDRN
N#Cc1c(F)cccc1/C=C/c1nc2ccccc2s1	ZINC000570094757	327568721	/nfs/dbraw/zinc/56/87/21/327568721.db2.gz	MGDGMKYNSXSQMD-CMDGGOBGSA-N	0	0	280.327	4.477	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(OC(C)C)cc2C)CC1	ZINC000570259620	327579531	/nfs/dbraw/zinc/57/95/31/327579531.db2.gz	DWSYQVDUXHDBSS-UHFFFAOYSA-N	0	0	287.403	4.467	20	30		CIEDRN
Cc1ccc(-c2ccc(C)c(NC[C@H](C#N)CCC#N)c2)o1	ZINC000570391107	327587935	/nfs/dbraw/zinc/58/79/35/327587935.db2.gz	UQDZTXLZXNUWEF-HNNXBMFYSA-N	0	0	293.370	4.419	20	30		CIEDRN
N#Cc1ccc(CNc2nc3cc(Cl)ccc3s2)cc1	ZINC000051354685	328608709	/nfs/dbraw/zinc/60/87/09/328608709.db2.gz	LFVFJYKFDMDOLW-UHFFFAOYSA-N	0	0	299.786	4.433	20	30		CIEDRN
N#Cc1cc(NCc2ccc(F)cc2Cl)ccc1F	ZINC000051636870	328626542	/nfs/dbraw/zinc/62/65/42/328626542.db2.gz	WGGBTDKESCZZBB-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C=CCCO[C@H](C)c1nc([C@@H]2CCCC(C)(C)C2)no1	ZINC000535961278	328650350	/nfs/dbraw/zinc/65/03/50/328650350.db2.gz	YROWWZQCDAKYHB-CHWSQXEVSA-N	0	0	278.396	4.407	20	30		CIEDRN
N#Cc1cc(F)ccc1COc1cc(Cl)ccc1F	ZINC000536017289	328652937	/nfs/dbraw/zinc/65/29/37/328652937.db2.gz	JJSNEQVNRNUUTL-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
C=CCCCC(=O)Nc1nc2cc(Cl)ccc2n1CC	ZINC000536572298	328666668	/nfs/dbraw/zinc/66/66/68/328666668.db2.gz	GAKOPVQKSGGMII-UHFFFAOYSA-N	0	0	291.782	4.004	20	30		CIEDRN
C=CCNc1ccc(C)c(Oc2cc(C)ccn2)c1	ZINC000532302189	328713731	/nfs/dbraw/zinc/71/37/31/328713731.db2.gz	MTJMMXZWLPJQTG-UHFFFAOYSA-N	0	0	254.333	4.089	20	30		CIEDRN
CC(C)[C@H](CC(=O)Nc1sccc1C#N)c1ccccc1	ZINC000102975916	328716335	/nfs/dbraw/zinc/71/63/35/328716335.db2.gz	NJIWEGLHMMNTJH-HNNXBMFYSA-N	0	0	298.411	4.388	20	30		CIEDRN
N#Cc1cc(F)cc(OCc2cc3ccccc3o2)c1	ZINC000583655938	328727487	/nfs/dbraw/zinc/72/74/87/328727487.db2.gz	YLWKKWJCBHSPJN-UHFFFAOYSA-N	0	0	267.259	4.023	20	30		CIEDRN
CN(C(=O)c1ccc2sccc2c1)c1ccc(C#N)cc1	ZINC000395333423	328736143	/nfs/dbraw/zinc/73/61/43/328736143.db2.gz	SMDQCFPOTBVYJL-UHFFFAOYSA-N	0	0	292.363	4.050	20	30		CIEDRN
COc1cc(N[C@@H](C)c2ccc(C#N)cc2)c(C)c(OC)c1	ZINC000507692439	332819263	/nfs/dbraw/zinc/81/92/63/332819263.db2.gz	LZNCYXXKNYEQQO-ZDUSSCGKSA-N	0	0	296.370	4.057	20	30		CIEDRN
C=CCC[C@@H](NC(=O)N(C)C[C@H](C)CC)c1ccccc1	ZINC000532495174	328782339	/nfs/dbraw/zinc/78/23/39/328782339.db2.gz	VQBHZLWWONYDHZ-NVXWUHKLSA-N	0	0	288.435	4.381	20	30		CIEDRN
C=CCC[C@H](NC(=O)N(C)C[C@H](C)CC)c1ccccc1	ZINC000532495176	328782368	/nfs/dbraw/zinc/78/23/68/328782368.db2.gz	VQBHZLWWONYDHZ-WBVHZDCISA-N	0	0	288.435	4.381	20	30		CIEDRN
COc1ccc(CSCc2ccccc2OC)cc1C#N	ZINC000532618908	328791464	/nfs/dbraw/zinc/79/14/64/328791464.db2.gz	OASHRJQOBVRJCG-UHFFFAOYSA-N	0	0	299.395	4.009	20	30		CIEDRN
C=CCC[C@H](NC(=O)c1occ2c1CCC2)c1ccccc1	ZINC000354209711	328857491	/nfs/dbraw/zinc/85/74/91/328857491.db2.gz	UNRDIUFFVMIRRK-KRWDZBQOSA-N	0	0	295.382	4.206	20	30		CIEDRN
C=C(C)CCS[C@@H](C)c1nc(Cc2ccccc2)no1	ZINC000507819146	332826198	/nfs/dbraw/zinc/82/61/98/332826198.db2.gz	RNFVOVXEXBPAFA-ZDUSSCGKSA-N	0	0	288.416	4.421	20	30		CIEDRN
CC(C)c1cccc(C(C)C)c1NC(=O)[C@H](C)C#N	ZINC000357787353	328875971	/nfs/dbraw/zinc/87/59/71/328875971.db2.gz	HFTLGHNVMUVETI-GFCCVEGCSA-N	0	0	258.365	4.032	20	30		CIEDRN
C=C(C)CCSCC(=O)N[C@@H](C)c1ccc(C)c(C)c1	ZINC000507832978	332826981	/nfs/dbraw/zinc/82/69/81/332826981.db2.gz	FKDZKJVDSHGCLL-HNNXBMFYSA-N	0	0	291.460	4.180	20	30		CIEDRN
CC(=O)CCCCSc1cccc(Cl)c1C#N	ZINC000360961361	328912790	/nfs/dbraw/zinc/91/27/90/328912790.db2.gz	PQZGXAXJPRRHJD-UHFFFAOYSA-N	0	0	267.781	4.063	20	30		CIEDRN
CC1(C)CCC(CC(=O)Nc2ccc(F)cc2C#N)CC1	ZINC000508003108	332831250	/nfs/dbraw/zinc/83/12/50/332831250.db2.gz	WGXIHOJQEVLQIC-UHFFFAOYSA-N	0	0	288.366	4.242	20	30		CIEDRN
CC1(C)CCCC[C@H]1CC(=O)Nc1ccc(F)cc1C#N	ZINC000508003138	332831276	/nfs/dbraw/zinc/83/12/76/332831276.db2.gz	WSKKDNWVTAQJHF-ZDUSSCGKSA-N	0	0	288.366	4.242	20	30		CIEDRN
N#Cc1cc(C(=O)Nc2ccsc2Cl)ccc1Cl	ZINC000527090941	328949577	/nfs/dbraw/zinc/94/95/77/328949577.db2.gz	MXFGKMRTELJEJN-UHFFFAOYSA-N	0	0	297.166	4.179	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(CO[C@@H]2CCCC[C@@H]2C)no1	ZINC000582385559	328977175	/nfs/dbraw/zinc/97/71/75/328977175.db2.gz	LKBVMHCAULQCQD-MELADBBJSA-N	0	0	278.396	4.235	20	30		CIEDRN
Cc1csc(NC(=O)C2CC(c3ccccc3)C2)c1C#N	ZINC000377427747	329015121	/nfs/dbraw/zinc/01/51/21/329015121.db2.gz	LSULHHYBPLTHJO-UHFFFAOYSA-N	0	0	296.395	4.061	20	30		CIEDRN
C=CCCCC(=O)N1CCCC[C@@H]1c1nc2ccccc2o1	ZINC000378145625	329041364	/nfs/dbraw/zinc/04/13/64/329041364.db2.gz	TYAOWJJWRUNHDO-OAHLLOKOSA-N	0	0	298.386	4.238	20	30		CIEDRN
C[C@H](Nc1cccc(OCCCC#N)c1)c1ccccc1O	ZINC000193905648	329062664	/nfs/dbraw/zinc/06/26/64/329062664.db2.gz	PTVOFNVEMGHGOM-AWEZNQCLSA-N	0	0	296.370	4.248	20	30		CIEDRN
C[C@@H](Nc1cccc(OCCCC#N)c1)c1ccccc1O	ZINC000193905662	329062786	/nfs/dbraw/zinc/06/27/86/329062786.db2.gz	PTVOFNVEMGHGOM-CQSZACIVSA-N	0	0	296.370	4.248	20	30		CIEDRN
N#CCc1ccc(NCCSCc2ccccc2)cc1	ZINC000193919060	329063705	/nfs/dbraw/zinc/06/37/05/329063705.db2.gz	OITCMOAQGUIYGJ-UHFFFAOYSA-N	0	0	282.412	4.098	20	30		CIEDRN
N#CCCCCNC(=O)Nc1ccccc1-c1ccccc1	ZINC000171358833	329073793	/nfs/dbraw/zinc/07/37/93/329073793.db2.gz	OGKKVLXSEWSLRY-UHFFFAOYSA-N	0	0	293.370	4.169	20	30		CIEDRN
C=CCCC(=O)N1Cc2ccccc2[C@@H](c2ccccc2)C1	ZINC000171428016	329075412	/nfs/dbraw/zinc/07/54/12/329075412.db2.gz	XIMFYWIXIBEFQJ-LJQANCHMSA-N	0	0	291.394	4.127	20	30		CIEDRN
N#Cc1cc(F)c(N2CCC[C@H]2c2ccsc2)c(F)c1	ZINC000486933907	329080109	/nfs/dbraw/zinc/08/01/09/329080109.db2.gz	XPAJOHJMWZINDI-AWEZNQCLSA-N	0	0	290.338	4.239	20	30		CIEDRN
CCC[C@H](C(=O)Nc1cc(C#N)c2ccccc2n1)C(C)C	ZINC000582510712	329099098	/nfs/dbraw/zinc/09/90/98/329099098.db2.gz	BFFHXYRSZUOKCY-AWEZNQCLSA-N	0	0	295.386	4.117	20	30		CIEDRN
C=C(C)CCc1noc(C[C@@H](C)c2ccc(F)cc2F)n1	ZINC000508596095	332842736	/nfs/dbraw/zinc/84/27/36/332842736.db2.gz	QWRWIZMLUHZKHC-LLVKDONJSA-N	0	0	292.329	4.203	20	30		CIEDRN
C=C(C)CCc1noc([C@@H]2C[C@@H]2c2sccc2C)n1	ZINC000508597977	332842969	/nfs/dbraw/zinc/84/29/69/332842969.db2.gz	YRDZHUCJMACRQE-NWDGAFQWSA-N	0	0	274.389	4.219	20	30		CIEDRN
C=C(C)CCc1noc(/C=C(\C)c2cccc(F)c2)n1	ZINC000508602008	332843575	/nfs/dbraw/zinc/84/35/75/332843575.db2.gz	BNPAXRJXVHHKKN-FMIVXFBMSA-N	0	0	272.323	4.278	20	30		CIEDRN
CC(C)OCc1cccc(NCC(C)(C)CCC#N)c1	ZINC000174307053	329159785	/nfs/dbraw/zinc/15/97/85/329159785.db2.gz	VZYPXQRREGNONI-UHFFFAOYSA-N	0	0	274.408	4.353	20	30		CIEDRN
C=CCCC(=O)N1Cc2ccccc2C[C@@H]1c1ccccc1	ZINC000174657248	329160105	/nfs/dbraw/zinc/16/01/05/329160105.db2.gz	JQBUGBSQMULJEA-LJQANCHMSA-N	0	0	291.394	4.279	20	30		CIEDRN
C=C(C)CCc1noc([C@@H](C)Cc2cccc(F)c2)n1	ZINC000508616200	332844377	/nfs/dbraw/zinc/84/43/77/332844377.db2.gz	UCUYDDTYVSZOJI-LBPRGKRZSA-N	0	0	274.339	4.064	20	30		CIEDRN
C=CCCCC(=O)Nc1cccc(-c2csc(C)n2)c1	ZINC000175202622	329166379	/nfs/dbraw/zinc/16/63/79/329166379.db2.gz	VJZGYDPBDPXTRN-UHFFFAOYSA-N	0	0	286.400	4.413	20	30		CIEDRN
C=C(C)CCc1noc(-c2cc(-c3ccc(C)cc3)no2)n1	ZINC000508624791	332844722	/nfs/dbraw/zinc/84/47/22/332844722.db2.gz	GKZZZTSIKXPTFK-UHFFFAOYSA-N	0	0	295.342	4.209	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](C)c1ccc(-c2ccncc2)cc1	ZINC000176322662	329174839	/nfs/dbraw/zinc/17/48/39/329174839.db2.gz	DKWMVMCBMSUUNT-HNNXBMFYSA-N	0	0	294.398	4.282	20	30		CIEDRN
Cc1ccccc1[C@H](C)CC(=O)N[C@H](C#N)C1CCCCC1	ZINC000176597033	329177155	/nfs/dbraw/zinc/17/71/55/329177155.db2.gz	QKJKNWSVNAMSRM-CRAIPNDOSA-N	0	0	298.430	4.077	20	30		CIEDRN
C=C(C)CCc1noc(/C(C)=C\c2ccc([N+](=O)[O-])cc2)n1	ZINC000508661968	332846362	/nfs/dbraw/zinc/84/63/62/332846362.db2.gz	BEXQSKDNQBPPBI-BENRWUELSA-N	0	0	299.330	4.047	20	30		CIEDRN
C=CCc1ccccc1OCc1csc([C@H](C)OC)n1	ZINC000177541394	329184879	/nfs/dbraw/zinc/18/48/79/329184879.db2.gz	ACARFAJNGKTMIR-LBPRGKRZSA-N	0	0	289.400	4.158	20	30		CIEDRN
C=CCCCC(=O)Nc1cc(-c2nc(C)co2)ccc1C	ZINC000177811984	329187202	/nfs/dbraw/zinc/18/72/02/329187202.db2.gz	WWSHGUXGHPRYEK-UHFFFAOYSA-N	0	0	284.359	4.253	20	30		CIEDRN
C[C@H](C(=O)Nc1sccc1C#N)c1cc2ccccc2o1	ZINC000177567232	329187571	/nfs/dbraw/zinc/18/75/71/329187571.db2.gz	MUKHBXYFHUXQOK-JTQLQIEISA-N	0	0	296.351	4.108	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)N1CCC[C@@H]1C1CCCC1	ZINC000178565168	329198640	/nfs/dbraw/zinc/19/86/40/329198640.db2.gz	DVRXLJHUSJGKEW-QGZVFWFLSA-N	0	0	297.402	4.053	20	30		CIEDRN
N#Cc1ccc(/C=C/c2cccc(-c3cccnc3)c2)nc1	ZINC000178366944	329199124	/nfs/dbraw/zinc/19/91/24/329199124.db2.gz	NGECNZXVEBOYER-SOFGYWHQSA-N	0	0	283.334	4.186	20	30		CIEDRN
N#CCC[C@H](Nc1ccncc1Cl)c1ccccc1	ZINC000178659283	329201963	/nfs/dbraw/zinc/20/19/63/329201963.db2.gz	LEHRVDMOKCJCBZ-AWEZNQCLSA-N	0	0	271.751	4.192	20	30		CIEDRN
C#CCCCCC(=O)N(C)[C@H](C)c1ccc(Cl)cc1	ZINC000179721655	329207595	/nfs/dbraw/zinc/20/75/95/329207595.db2.gz	PZYYWYIMFYHGRT-CYBMUJFWSA-N	0	0	277.795	4.053	20	30		CIEDRN
CCn1c2ccc(C#N)cc2nc1-c1cccc2cccnc21	ZINC000321013595	329210073	/nfs/dbraw/zinc/21/00/73/329210073.db2.gz	ONTBNFFBYWCMIN-UHFFFAOYSA-N	0	0	298.349	4.143	20	30		CIEDRN
C=C(C)CCc1noc(-c2ccc(SCC)cc2)n1	ZINC000508683269	332847027	/nfs/dbraw/zinc/84/70/27/332847027.db2.gz	YYNWKAQASNMLOO-UHFFFAOYSA-N	0	0	274.389	4.357	20	30		CIEDRN
C=C(C)CCc1noc([C@@H]2C[C@@H]2c2cc(F)ccc2F)n1	ZINC000508685509	332847255	/nfs/dbraw/zinc/84/72/55/332847255.db2.gz	HCJGXONOVCRSKY-DGCLKSJQSA-N	0	0	290.313	4.128	20	30		CIEDRN
C=C(C)CCc1noc(-c2cc(C(CC)CC)no2)n1	ZINC000508686902	332847563	/nfs/dbraw/zinc/84/75/63/332847563.db2.gz	QCGMQFHKNSGIET-UHFFFAOYSA-N	0	0	275.352	4.137	20	30		CIEDRN
CCCC[C@H](CC)CN(CCC#N)Cc1ccccn1	ZINC000183630190	329251586	/nfs/dbraw/zinc/25/15/86/329251586.db2.gz	QCAQTUBODVVELW-INIZCTEOSA-N	0	0	273.424	4.014	20	30		CIEDRN
CC[C@@H](CC#N)NCc1ccc(-c2ccc(C)cc2)o1	ZINC000184089162	329255804	/nfs/dbraw/zinc/25/58/04/329255804.db2.gz	YAJOGXQKHOPZRB-HNNXBMFYSA-N	0	0	268.360	4.037	20	30		CIEDRN
N#C[C@@H]1CCC[C@@H]1N[C@H]1CCc2c1cc(Cl)cc2Cl	ZINC000459459729	329257390	/nfs/dbraw/zinc/25/73/90/329257390.db2.gz	HYRUBUNYZNGFOA-LNHVQRHZSA-N	0	0	295.213	4.263	20	30		CIEDRN
COc1ccc(CSCc2ccc(C)nc2C)cc1C#N	ZINC000184832373	329263060	/nfs/dbraw/zinc/26/30/60/329263060.db2.gz	AFNOKDZZAUPGLR-UHFFFAOYSA-N	0	0	298.411	4.012	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CCSc2c(F)cccc21	ZINC000185076472	329267905	/nfs/dbraw/zinc/26/79/05/329267905.db2.gz	QFDIKRJZOSTRLX-SMDDNHRTSA-N	0	0	293.407	4.081	20	30		CIEDRN
CCC[C@@H](C)[C@@H]1CCCN1c1nccc(C#N)c1Cl	ZINC000582921473	329288986	/nfs/dbraw/zinc/28/89/86/329288986.db2.gz	CJVYUHYWLPSSTB-YPMHNXCESA-N	0	0	277.799	4.012	20	30		CIEDRN
C=CCOc1cccc(NC(=O)NC2(C)CCCCC2)c1	ZINC000583106532	329312661	/nfs/dbraw/zinc/31/26/61/329312661.db2.gz	LTKMLDKJPMWEAT-UHFFFAOYSA-N	0	0	288.391	4.096	20	30		CIEDRN
CCOc1cccc(N[C@H]2CCc3ccc(C#N)cc32)c1	ZINC000583113229	329312981	/nfs/dbraw/zinc/31/29/81/329312981.db2.gz	BWIGTESIYJHHIX-SFHVURJKSA-N	0	0	278.355	4.056	20	30		CIEDRN
C=C(C)CCc1noc(-c2coc(C3CCCCC3)n2)n1	ZINC000583136123	329319519	/nfs/dbraw/zinc/31/95/19/329319519.db2.gz	HOFQMKNXYNLJTB-UHFFFAOYSA-N	0	0	287.363	4.281	20	30		CIEDRN
C=CCC[C@H](NC(=O)N1CCCC2(CC2)C1)c1ccccc1	ZINC000185880151	329334360	/nfs/dbraw/zinc/33/43/60/329334360.db2.gz	KTOILHKRLMVOBR-KRWDZBQOSA-N	0	0	298.430	4.280	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cccc(-c2nc(C)co2)c1	ZINC000186027674	329336181	/nfs/dbraw/zinc/33/61/81/329336181.db2.gz	REJUMQUSCAMKPD-LBPRGKRZSA-N	0	0	284.359	4.191	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(-c3cnco3)cc2)CCC1	ZINC000188987001	329373258	/nfs/dbraw/zinc/37/32/58/329373258.db2.gz	OTUPWGLFONIAIP-UHFFFAOYSA-N	0	0	282.343	4.027	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(C2(c3cccc(C)c3)CC2)no1	ZINC000583234384	329386330	/nfs/dbraw/zinc/38/63/30/329386330.db2.gz	PMKFGVGQAHAEGD-QGZVFWFLSA-N	0	0	282.387	4.312	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCCCO1	ZINC000189895795	329389207	/nfs/dbraw/zinc/38/92/07/329389207.db2.gz	JZCFVWGNYOLHHI-MRXNPFEDSA-N	0	0	287.403	4.046	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)C=C(C)C	ZINC000189910270	329390011	/nfs/dbraw/zinc/39/00/11/329390011.db2.gz	KLSVWYGSSIKNSC-UHFFFAOYSA-N	0	0	257.377	4.443	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cccc(-n2cccc2)c1	ZINC000509067127	332858080	/nfs/dbraw/zinc/85/80/80/332858080.db2.gz	KAXGXVMBUAPPIA-CQSZACIVSA-N	0	0	268.360	4.018	20	30		CIEDRN
C=CCC1(C(=O)Nc2nc(-c3ccco3)cs2)CCC1	ZINC000192083298	329426437	/nfs/dbraw/zinc/42/64/37/329426437.db2.gz	CMIFPFTZARBQIH-UHFFFAOYSA-N	0	0	288.372	4.088	20	30		CIEDRN
Cc1cc(C#N)nc(N[C@@H](CC(C)C)c2ccccc2C)n1	ZINC000584427589	329467278	/nfs/dbraw/zinc/46/72/78/329467278.db2.gz	CXINZNWLQMYQMU-KRWDZBQOSA-N	0	0	294.402	4.164	20	30		CIEDRN
C[C@H](CCC(=O)N(C1CC1)C1(C#N)CCC1)c1ccccc1	ZINC000584520671	329510273	/nfs/dbraw/zinc/51/02/73/329510273.db2.gz	SGPHMVPASIMROT-OAHLLOKOSA-N	0	0	296.414	4.008	20	30		CIEDRN
Cc1ccc(Cl)c(NCc2ccc(C#N)c(F)c2)c1	ZINC000404103774	332987243	/nfs/dbraw/zinc/98/72/43/332987243.db2.gz	FPBSWBIPGDNNJJ-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CC[C@](C)(c2ccc(C)cc2)C1	ZINC000509263717	332862602	/nfs/dbraw/zinc/86/26/02/332862602.db2.gz	NRYVQLHUJMGSOT-IBGZPJMESA-N	0	0	285.431	4.087	20	30		CIEDRN
CC[C@@H](CC#N)NC(c1ccccc1)c1ccccc1	ZINC000036680880	329516764	/nfs/dbraw/zinc/51/67/64/329516764.db2.gz	LHYNEXHKVCIUAV-KRWDZBQOSA-N	0	0	264.372	4.058	20	30		CIEDRN
CCC[C@H](CC1CCCC1)C(=O)N1CCC(C)(C#N)CC1	ZINC000509371155	332866863	/nfs/dbraw/zinc/86/68/63/332866863.db2.gz	VMFRRGOQPRPNFL-MRXNPFEDSA-N	0	0	290.451	4.135	20	30		CIEDRN
C[C@@H](c1cccc(C#N)c1)N(C)C(=O)[C@@H]1CCCCC1(C)C	ZINC000425111756	329595957	/nfs/dbraw/zinc/59/59/57/329595957.db2.gz	OSXOMKWXANWRDT-YOEHRIQHSA-N	0	0	298.430	4.294	20	30		CIEDRN
C[C@@H](c1cccc(C#N)c1)N(C)C(=O)C1CCC(C)(C)CC1	ZINC000425121344	329597977	/nfs/dbraw/zinc/59/79/77/329597977.db2.gz	BYXJPQFQLBSWGS-AWEZNQCLSA-N	0	0	298.430	4.294	20	30		CIEDRN
Cc1ccc(C)c(C(=O)N(C)[C@@H](C)c2cccc(C#N)c2)c1	ZINC000425125791	329599047	/nfs/dbraw/zinc/59/90/47/329599047.db2.gz	GURXRZKLAOUKSA-HNNXBMFYSA-N	0	0	292.382	4.008	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CC12CC2	ZINC000425664569	329602898	/nfs/dbraw/zinc/60/28/98/329602898.db2.gz	PLGFDBHPLAMPKM-OAHLLOKOSA-N	0	0	284.403	4.213	20	30		CIEDRN
Cc1cccc(C(=O)N(C)[C@@H](C)c2cccc(C#N)c2)c1C	ZINC000425135323	329604960	/nfs/dbraw/zinc/60/49/60/329604960.db2.gz	VQDCEGAYZFWAPB-HNNXBMFYSA-N	0	0	292.382	4.008	20	30		CIEDRN
CC[C@H](CC(=O)N(C)[C@@H](C)c1cccc(C#N)c1)C(C)C	ZINC000425127957	329605875	/nfs/dbraw/zinc/60/58/75/329605875.db2.gz	JMCJJSYWPRQHQA-GOEBONIOSA-N	0	0	286.419	4.150	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)[C@@H]1CCC[C@@H](F)C1	ZINC000424805547	329616223	/nfs/dbraw/zinc/61/62/23/329616223.db2.gz	BGTJXRCBDNHQQR-IAGOWNOFSA-N	0	0	289.394	4.120	20	30		CIEDRN
N#CCN(C(=O)[C@@H]1CCC[C@@H]2CCCC[C@@H]12)c1ccccc1	ZINC000514686553	329684266	/nfs/dbraw/zinc/68/42/66/329684266.db2.gz	AKGNQDJCCBKUAH-CGTJXYLNSA-N	0	0	296.414	4.150	20	30		CIEDRN
C=CCCNc1cc(-c2cncc(F)c2)ccc1C	ZINC000509504708	332872026	/nfs/dbraw/zinc/87/20/26/332872026.db2.gz	CFWWGCUIBAVKEW-UHFFFAOYSA-N	0	0	256.324	4.184	20	30		CIEDRN
N#CC1(CCOc2ccc([C@H]3CCOC3)cc2)CCCCC1	ZINC000418985479	329701134	/nfs/dbraw/zinc/70/11/34/329701134.db2.gz	FTCPHLVFMVPOJF-KRWDZBQOSA-N	0	0	299.414	4.433	20	30		CIEDRN
CC(C)(C#N)CCOc1ccc(C#N)c2ccccc12	ZINC000419059702	329707050	/nfs/dbraw/zinc/70/70/50/329707050.db2.gz	XZJRPGDBEUQWJD-UHFFFAOYSA-N	0	0	264.328	4.030	20	30		CIEDRN
Cc1c(C#N)cccc1C(=O)N(CC1CCCCC1)C1CC1	ZINC000509538300	332872971	/nfs/dbraw/zinc/87/29/71/332872971.db2.gz	IFHGUXFGJQERSI-UHFFFAOYSA-N	0	0	296.414	4.052	20	30		CIEDRN
C[C@@H](SCC1(C#N)CCC1)c1ccc(C#N)cc1	ZINC000419411825	329724617	/nfs/dbraw/zinc/72/46/17/329724617.db2.gz	BWXZUJUQMLDSHF-GFCCVEGCSA-N	0	0	256.374	4.046	20	30		CIEDRN
C=CCOCCSCc1cccc(C(F)F)c1	ZINC000419469720	329727085	/nfs/dbraw/zinc/72/70/85/329727085.db2.gz	DIMYJPNYCQCLMS-UHFFFAOYSA-N	0	0	258.333	4.060	20	30		CIEDRN
CC(C)(C)Oc1cccc(CSCC2(C#N)CCC2)n1	ZINC000419441837	329729480	/nfs/dbraw/zinc/72/94/80/329729480.db2.gz	UNIRAOADIUFOFU-UHFFFAOYSA-N	0	0	290.432	4.186	20	30		CIEDRN
COc1cccc(CSCCC2(C#N)CCCCC2)n1	ZINC000419450817	329730381	/nfs/dbraw/zinc/73/03/81/329730381.db2.gz	BRVVBHATSHNZTP-UHFFFAOYSA-N	0	0	290.432	4.188	20	30		CIEDRN
N#CC1(CSCc2ncc(Cl)cc2Cl)CCC1	ZINC000419457975	329731255	/nfs/dbraw/zinc/73/12/55/329731255.db2.gz	XYCIAANKRRXPNX-UHFFFAOYSA-N	0	0	287.215	4.315	20	30		CIEDRN
C[C@@H](SCC1(C#N)CCC1)c1nc2ccccc2o1	ZINC000419458354	329731533	/nfs/dbraw/zinc/73/15/33/329731533.db2.gz	ZGUNQOIEZZFALG-LLVKDONJSA-N	0	0	272.373	4.316	20	30		CIEDRN
Cc1ccc(CSCC2(C#N)CC2)c(Br)c1	ZINC000419507146	329733542	/nfs/dbraw/zinc/73/35/42/329733542.db2.gz	NXGUGBJLIBTGJO-UHFFFAOYSA-N	0	0	296.233	4.295	20	30		CIEDRN
C=CCOCCSCc1ncc(-c2ccc(C)cc2)o1	ZINC000419508734	329733804	/nfs/dbraw/zinc/73/38/04/329733804.db2.gz	RNAFYEPCZXVWOL-UHFFFAOYSA-N	0	0	289.400	4.086	20	30		CIEDRN
N#CCc1ccc(CSCC2CC(F)(F)C2)cc1	ZINC000419512386	329734204	/nfs/dbraw/zinc/73/42/04/329734204.db2.gz	JOXMMNIKYGXDJH-UHFFFAOYSA-N	0	0	267.344	4.031	20	30		CIEDRN
N#CC1(CSCc2c(Cl)cccc2[N+](=O)[O-])CCC1	ZINC000419590476	329741828	/nfs/dbraw/zinc/74/18/28/329741828.db2.gz	WRPUNQYWGSXVKP-UHFFFAOYSA-N	0	0	296.779	4.175	20	30		CIEDRN
N#CCc1cccc(NC2CC3(C2)CCCCC3)c1	ZINC000421381006	329817862	/nfs/dbraw/zinc/81/78/62/329817862.db2.gz	LCAPZJWIVZEYOM-UHFFFAOYSA-N	0	0	254.377	4.277	20	30		CIEDRN
CCCn1c2ccc(C#N)cc2nc1-c1cccs1	ZINC000086635945	332875460	/nfs/dbraw/zinc/87/54/60/332875460.db2.gz	KSTRRADLBDZSDH-UHFFFAOYSA-N	0	0	267.357	4.046	20	30		CIEDRN
C=CCC[C@H](NC(=O)[C@@]12C[C@@H]1CCC2)c1ccccc1	ZINC000421519488	329841759	/nfs/dbraw/zinc/84/17/59/329841759.db2.gz	FQNQJCPTWBSPSO-BQFCYCMXSA-N	0	0	269.388	4.000	20	30		CIEDRN
C[C@@H](Oc1cc(F)ccc1Cl)c1ccc(C#N)cc1	ZINC000509773068	332881113	/nfs/dbraw/zinc/88/11/13/332881113.db2.gz	BRCGFZPUNRWGPO-SNVBAGLBSA-N	0	0	275.710	4.491	20	30		CIEDRN
C[C@H]1CC(C(=O)N[C@H](CCC#N)c2ccccc2)C[C@H](C)C1	ZINC000248629305	329896385	/nfs/dbraw/zinc/89/63/85/329896385.db2.gz	ZOACAZBBEPGJCW-IIDMSEBBSA-N	0	0	298.430	4.220	20	30		CIEDRN
Cc1ccc(-c2cccc(CNCC3(C#N)CC3)c2)cc1	ZINC000571716522	329912220	/nfs/dbraw/zinc/91/22/20/329912220.db2.gz	YLVYQKARUFQHNB-UHFFFAOYSA-N	0	0	276.383	4.055	20	30		CIEDRN
C=CCC1(C(=O)Nc2cccc3c2OC(C)(C)C3)CCC1	ZINC000571829948	329923733	/nfs/dbraw/zinc/92/37/33/329923733.db2.gz	GDENEPZEAOVNAV-UHFFFAOYSA-N	0	0	285.387	4.085	20	30		CIEDRN
Cc1ccnc(N[C@@H](C)c2ccc(OC(C)C)cc2)c1C#N	ZINC000571920453	329929195	/nfs/dbraw/zinc/92/91/95/329929195.db2.gz	UQAMAGHZZMPORT-AWEZNQCLSA-N	0	0	295.386	4.222	20	30		CIEDRN
C=CCN(C)C(=O)c1ccc(SCc2ccccc2)cc1	ZINC000161451222	329934781	/nfs/dbraw/zinc/93/47/81/329934781.db2.gz	XMNXPYFLGYDXSU-UHFFFAOYSA-N	0	0	297.423	4.237	20	30		CIEDRN
CCC(C)(C)OCc1ccccc1NC[C@H](C#N)CCC#N	ZINC000572029746	329938924	/nfs/dbraw/zinc/93/89/24/329938924.db2.gz	UMMSRBZNVQHOKX-HNNXBMFYSA-N	0	0	299.418	4.247	20	30		CIEDRN
C=CCC1(c2nc(-c3coc(CCC)n3)no2)CCCC1	ZINC000572092579	329943323	/nfs/dbraw/zinc/94/33/23/329943323.db2.gz	MOTXSDUJHMPKKZ-UHFFFAOYSA-N	0	0	287.363	4.065	20	30		CIEDRN
C=CCN(C)C(=O)[C@H](Sc1ccccc1)c1ccccc1	ZINC000161648015	329950149	/nfs/dbraw/zinc/95/01/49/329950149.db2.gz	ULLVRVQISMKWNV-QGZVFWFLSA-N	0	0	297.423	4.164	20	30		CIEDRN
C[C@@H](CCC(=O)N[C@H](C#N)C1CCCCC1)c1ccccc1	ZINC000161918774	329959585	/nfs/dbraw/zinc/95/95/85/329959585.db2.gz	ADYOINNNUHMSIJ-MAUKXSAKSA-N	0	0	298.430	4.159	20	30		CIEDRN
CC[C@H](CC1CCCC1)C(=O)N[C@@H](C)c1ccc(C#N)cc1	ZINC000510043437	332889278	/nfs/dbraw/zinc/88/92/78/332889278.db2.gz	SNBQKPJQEZKGFK-WMLDXEAASA-N	0	0	298.430	4.342	20	30		CIEDRN
CCC(C)(C)c1ccc(NC(=O)NCC2(CC#N)CC2)cc1	ZINC000432732659	330008680	/nfs/dbraw/zinc/00/86/80/330008680.db2.gz	YLSPBNHXLYDAQL-UHFFFAOYSA-N	0	0	299.418	4.190	20	30		CIEDRN
C=C(C)C[N@@H+]1CCC[C@H]1c1nc2ccccc2s1	ZINC000263841512	330060545	/nfs/dbraw/zinc/06/05/45/330060545.db2.gz	KMRFWZPAPNIRMS-ZDUSSCGKSA-N	0	0	258.390	4.009	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1ccccc1C(F)(F)F	ZINC000263928016	330060998	/nfs/dbraw/zinc/06/09/98/330060998.db2.gz	QYCMOKUERWMYHD-UHFFFAOYSA-N	0	0	286.297	4.135	20	30		CIEDRN
C=C1CCN(C(=O)[C@H]2C[C@H]2c2ccc3ccccc3c2)CC1	ZINC000264580959	330061723	/nfs/dbraw/zinc/06/17/23/330061723.db2.gz	VGXGTNOQRMEXFO-OALUTQOASA-N	0	0	291.394	4.122	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)[C@@H](C)c1ccc(F)c(F)c1	ZINC000268125637	330065437	/nfs/dbraw/zinc/06/54/37/330065437.db2.gz	DBKRGWBNVRUGJW-LBPRGKRZSA-N	0	0	293.357	4.253	20	30		CIEDRN
C=CCOCCCC(=O)N(C(C)C)[C@H](C)c1ccsc1	ZINC000421692307	330071307	/nfs/dbraw/zinc/07/13/07/330071307.db2.gz	OWKUKPHDVRBWAT-CQSZACIVSA-N	0	0	295.448	4.029	20	30		CIEDRN
C=C(C)[C@H](CC(=O)Nc1c(C)cccc1C(C)C)OCC	ZINC000270174527	330073755	/nfs/dbraw/zinc/07/37/55/330073755.db2.gz	LRKONIXSNLECEL-INIZCTEOSA-N	0	0	289.419	4.428	20	30		CIEDRN
C#CCCCSc1nnc(-c2c(C)cc(C)cc2C)o1	ZINC000270894393	330076899	/nfs/dbraw/zinc/07/68/99/330076899.db2.gz	SASGPKNVGORLRK-UHFFFAOYSA-N	0	0	286.400	4.167	20	30		CIEDRN
N#Cc1csc(CN(Cc2ccco2)Cc2ccco2)c1	ZINC000162574965	330078075	/nfs/dbraw/zinc/07/80/75/330078075.db2.gz	YVHOBVMLQGGUAX-UHFFFAOYSA-N	0	0	298.367	4.008	20	30		CIEDRN
C=C(C)[C@H](CC(=O)Nc1cccc(SC)c1C)OCC	ZINC000271616476	330081670	/nfs/dbraw/zinc/08/16/70/330081670.db2.gz	AOWVHDHIYHOTMH-AWEZNQCLSA-N	0	0	293.432	4.027	20	30		CIEDRN
C#CC[C@@H](NCc1csc(CCCC)n1)c1ccccc1	ZINC000271743793	330081934	/nfs/dbraw/zinc/08/19/34/330081934.db2.gz	WADYPXHXHUPLIB-QGZVFWFLSA-N	0	0	298.455	4.340	20	30		CIEDRN
N#Cc1cc(F)ccc1NCc1cc(F)c(Cl)cc1F	ZINC000432923526	330085243	/nfs/dbraw/zinc/08/52/43/330085243.db2.gz	GOMZWHUNPDDPIE-UHFFFAOYSA-N	0	0	296.679	4.241	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)Nc1ccc(C)cc1C	ZINC000272325786	330085459	/nfs/dbraw/zinc/08/54/59/330085459.db2.gz	VGAAJMKWECNVPB-UHFFFAOYSA-N	0	0	298.386	4.159	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@@H](c2cccc(C)c2)C1	ZINC000273022313	330090021	/nfs/dbraw/zinc/09/00/21/330090021.db2.gz	ASYLJLOLQMAYAL-GOSISDBHSA-N	0	0	283.415	4.079	20	30		CIEDRN
C=CCC(CC=C)c1nc([C@H](C)SCC)no1	ZINC000273813517	330100420	/nfs/dbraw/zinc/10/04/20/330100420.db2.gz	CKVMOGGPJHDLFT-JTQLQIEISA-N	0	0	252.383	4.120	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@H]1c1ccc(F)cc1	ZINC000274264613	330104094	/nfs/dbraw/zinc/10/40/94/330104094.db2.gz	DQSZDKKRGRDKBC-CJNGLKHVSA-N	0	0	275.367	4.092	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cccc(SC)c1C	ZINC000274339120	330105501	/nfs/dbraw/zinc/10/55/01/330105501.db2.gz	LVRPNVTYMMPIPL-LLVKDONJSA-N	0	0	263.406	4.258	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCCCC[C@@H]1c1ccncc1	ZINC000274309732	330105670	/nfs/dbraw/zinc/10/56/70/330105670.db2.gz	WTIQAKZKPVUIPM-DOTOQJQBSA-N	0	0	286.419	4.128	20	30		CIEDRN
C=C(C)CCSc1nnc(-c2ccccc2OCC)o1	ZINC000274749927	330107760	/nfs/dbraw/zinc/10/77/60/330107760.db2.gz	NUMQAXKVDBEUNO-UHFFFAOYSA-N	0	0	290.388	4.194	20	30		CIEDRN
C=CCCCCNC(=O)Nc1ccccc1CSC	ZINC000274847959	330108144	/nfs/dbraw/zinc/10/81/44/330108144.db2.gz	VVFJDENOHOYKRQ-UHFFFAOYSA-N	0	0	278.421	4.027	20	30		CIEDRN
C=CCC[C@H](C(=O)NCCCC(F)(F)F)c1ccccc1	ZINC000275063748	330108972	/nfs/dbraw/zinc/10/89/72/330108972.db2.gz	RRECPAQWIKFBGU-AWEZNQCLSA-N	0	0	299.336	4.195	20	30		CIEDRN
CC(C)Oc1ccccc1[C@H](C)Nc1ncc(C#N)cc1F	ZINC000572462777	330111309	/nfs/dbraw/zinc/11/13/09/330111309.db2.gz	BOBGCYIEGBISJL-LBPRGKRZSA-N	0	0	299.349	4.053	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1ccccc1OC1CCCC1	ZINC000276290620	330112628	/nfs/dbraw/zinc/11/26/28/330112628.db2.gz	JULPITZMODXUKB-UHFFFAOYSA-N	0	0	288.391	4.048	20	30		CIEDRN
C#C[C@@H](C)NC(=O)Nc1c(C(C)C)cccc1C(C)C	ZINC000276538435	330114079	/nfs/dbraw/zinc/11/40/79/330114079.db2.gz	OGRVQKACKQKFHA-CYBMUJFWSA-N	0	0	272.392	4.077	20	30		CIEDRN
C#CCCCC(=O)N(Cc1ccco1)c1ccc(F)cc1C	ZINC000277005485	330115375	/nfs/dbraw/zinc/11/53/75/330115375.db2.gz	KOVKYSNYHXELGU-UHFFFAOYSA-N	0	0	299.345	4.064	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Oc1ccc(-c2c(C)noc2C)cc1	ZINC000277059433	330115395	/nfs/dbraw/zinc/11/53/95/330115395.db2.gz	DCDDLFJYRAZEBR-LBPRGKRZSA-N	0	0	299.370	4.466	20	30		CIEDRN
C#CCCCCC(=O)Nc1ccccc1NC(C)(C)C	ZINC000277296612	330115583	/nfs/dbraw/zinc/11/55/83/330115583.db2.gz	JLAXSWHZKSGAEG-UHFFFAOYSA-N	0	0	272.392	4.029	20	30		CIEDRN
C#CCCCCC(=O)Oc1ccc(-c2c(C)noc2C)cc1	ZINC000277260566	330115644	/nfs/dbraw/zinc/11/56/44/330115644.db2.gz	QVWMUJBWHCEESX-UHFFFAOYSA-N	0	0	297.354	4.057	20	30		CIEDRN
C#CCN(C)C(=O)Nc1ccc(C(C)C)cc1C(C)C	ZINC000278571628	330117295	/nfs/dbraw/zinc/11/72/95/330117295.db2.gz	JFXOJYINSYVEGN-UHFFFAOYSA-N	0	0	272.392	4.030	20	30		CIEDRN
C=CCCO[C@@H](C)c1nc(C(C)(C)c2ccccc2)no1	ZINC000277845008	330118584	/nfs/dbraw/zinc/11/85/84/330118584.db2.gz	AFCYVFRMQOXSTB-ZDUSSCGKSA-N	0	0	286.375	4.049	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1c(C)c(F)ccc1Cl	ZINC000279233502	330122371	/nfs/dbraw/zinc/12/23/71/330122371.db2.gz	PJXMJNOTNBVNHN-SECBINFHSA-N	0	0	269.747	4.328	20	30		CIEDRN
C=CCN1C[C@H](c2cccc(C(F)(F)F)c2)OC(C)(C)C1	ZINC000433298349	330217363	/nfs/dbraw/zinc/21/73/63/330217363.db2.gz	ZDVADOBSHJMIBC-CQSZACIVSA-N	0	0	299.336	4.043	20	30		CIEDRN
C=CCC(C)(C)CNc1ccc([N+](=O)[O-])c2cnccc12	ZINC000314823903	330218623	/nfs/dbraw/zinc/21/86/23/330218623.db2.gz	WNAGVNYHZCCMGG-UHFFFAOYSA-N	0	0	285.347	4.157	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(CCCc2ccccc2)no1	ZINC000527196470	330234535	/nfs/dbraw/zinc/23/45/35/330234535.db2.gz	XTWHSQBKDSBOJS-KRWDZBQOSA-N	0	0	270.376	4.099	20	30		CIEDRN
CCC(CC)N(C(=O)c1ccc(C(C)(C)C#N)cc1)C1CC1	ZINC000527242845	330240070	/nfs/dbraw/zinc/24/00/70/330240070.db2.gz	YZEWVMXPBOZZIH-UHFFFAOYSA-N	0	0	298.430	4.281	20	30		CIEDRN
CC(C)(C)c1ccccc1C(=O)N1CCC(CCC#N)CC1	ZINC000399789661	330246462	/nfs/dbraw/zinc/24/64/62/330246462.db2.gz	XQNCEFRLJJASGG-UHFFFAOYSA-N	0	0	298.430	4.140	20	30		CIEDRN
N#Cc1c(F)cccc1NCc1c(F)cccc1Cl	ZINC000036138860	330249688	/nfs/dbraw/zinc/24/96/88/330249688.db2.gz	TUTNGCPWDSLVAU-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C[C@@H]1C[C@@H]1c1ccc(CNc2cccc(F)c2C#N)o1	ZINC000036138630	330249705	/nfs/dbraw/zinc/24/97/05/330249705.db2.gz	HOTUITBZPUMGBS-PWSUYJOCSA-N	0	0	270.307	4.026	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(-c2ccc(Cl)cc2)no1	ZINC000527487644	330250593	/nfs/dbraw/zinc/25/05/93/330250593.db2.gz	AXDNJUJPPWTNMB-CQSZACIVSA-N	0	0	262.740	4.244	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc2oc(C(C)C)nc2c1	ZINC000527489419	330251297	/nfs/dbraw/zinc/25/12/97/330251297.db2.gz	ZBDOQUHWQMVZNJ-KRWDZBQOSA-N	0	0	286.375	4.492	20	30		CIEDRN
CCN(C(=O)C[C@H]1CCC[C@@H](C)C1)c1ccc(C#N)cc1	ZINC000510380258	332901292	/nfs/dbraw/zinc/90/12/92/332901292.db2.gz	RBZIUJUEQYRNDR-ZBFHGGJFSA-N	0	0	284.403	4.128	20	30		CIEDRN
CCC(C#N)(CC)C(=O)Nc1nc(-c2ccccc2)cs1	ZINC000527694811	330279730	/nfs/dbraw/zinc/27/97/30/330279730.db2.gz	LANMDDMJEQMZAL-UHFFFAOYSA-N	0	0	299.399	4.079	20	30		CIEDRN
N#Cc1ccccc1CNc1cccc(C2CCOCC2)c1	ZINC000527797190	330284071	/nfs/dbraw/zinc/28/40/71/330284071.db2.gz	NEETTWWVSQZHNG-UHFFFAOYSA-N	0	0	292.382	4.064	20	30		CIEDRN
CC[C@H]([NH2+]Cc1cccc(C#N)c1)c1cc(C)ccc1C	ZINC000527824202	330286587	/nfs/dbraw/zinc/28/65/87/330286587.db2.gz	WQXCFFZZVZTZTH-IBGZPJMESA-N	0	0	278.399	4.416	20	30		CIEDRN
CCN(Cc1ccc(Cl)cc1)C(=O)C(C#N)(CC)CC	ZINC000527856602	330288862	/nfs/dbraw/zinc/28/88/62/330288862.db2.gz	URIRKROHYGEVTC-UHFFFAOYSA-N	0	0	292.810	4.018	20	30		CIEDRN
C[C@@H](CC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccco1	ZINC000527872438	330290785	/nfs/dbraw/zinc/29/07/85/330290785.db2.gz	VCPCDPVJVWTMLS-ZDUSSCGKSA-N	0	0	296.370	4.213	20	30		CIEDRN
CC1(C#N)CCC(Nc2cccc(C3CCOCC3)c2)CC1	ZINC000527996020	330299491	/nfs/dbraw/zinc/29/94/91/330299491.db2.gz	OAEQDPVGISGDQD-UHFFFAOYSA-N	0	0	298.430	4.465	20	30		CIEDRN
CCC(C#N)(CC)C(=O)N[C@@H](C)c1oc2ccccc2c1C	ZINC000528041563	330305800	/nfs/dbraw/zinc/30/58/00/330305800.db2.gz	YBQNGZOLLNORNK-ZDUSSCGKSA-N	0	0	298.386	4.248	20	30		CIEDRN
CCOc1ccc(NC(=O)C(C#N)(CC)CC)cc1Cl	ZINC000528042855	330305916	/nfs/dbraw/zinc/30/59/16/330305916.db2.gz	HYSDCDUSGRXECZ-UHFFFAOYSA-N	0	0	294.782	4.007	20	30		CIEDRN
CCC[C@H](CNc1cccc(C(F)F)c1C#N)OCC	ZINC000528087318	330307439	/nfs/dbraw/zinc/30/74/39/330307439.db2.gz	UTPGDBBVKOCLMJ-LLVKDONJSA-N	0	0	282.334	4.113	20	30		CIEDRN
CCC(C#N)(CC)c1nc([C@H](C)c2ccc(C)cc2)no1	ZINC000528134776	330308847	/nfs/dbraw/zinc/30/88/47/330308847.db2.gz	UCDVSNIPAMMKBE-CYBMUJFWSA-N	0	0	283.375	4.111	20	30		CIEDRN
CCC(C#N)(CC)c1nc(-c2ccc3ccccc3c2)no1	ZINC000528198456	330312542	/nfs/dbraw/zinc/31/25/42/330312542.db2.gz	QVKDMRPIDAFLHL-UHFFFAOYSA-N	0	0	291.354	4.471	20	30		CIEDRN
C[C@@H](CCc1ccccc1)Nc1ccc(C#N)cc1F	ZINC000044482821	330328422	/nfs/dbraw/zinc/32/84/22/330328422.db2.gz	MEOKJALNKLTVNT-ZDUSSCGKSA-N	0	0	268.335	4.131	20	30		CIEDRN
N#CCCN(CC1CC1)C(=O)Nc1cccc2ccsc21	ZINC000533102139	330336171	/nfs/dbraw/zinc/33/61/71/330336171.db2.gz	SVQOVFIIHUXAON-UHFFFAOYSA-N	0	0	299.399	4.059	20	30		CIEDRN
CCN(C(=O)CC1=CCCCC1)[C@@H](C)c1ccc(C#N)cc1	ZINC000106611378	330340788	/nfs/dbraw/zinc/34/07/88/330340788.db2.gz	TZNHATGZRKGVNM-HNNXBMFYSA-N	0	0	296.414	4.358	20	30		CIEDRN
C=C(C)C(C)(C)c1nc(-c2ccccc2OC(F)F)no1	ZINC000424338171	330343698	/nfs/dbraw/zinc/34/36/98/330343698.db2.gz	NFQYQTBZJJCPON-UHFFFAOYSA-N	0	0	294.301	4.192	20	30		CIEDRN
C=C(C)C(C)(C)c1nc(-c2ccc3[nH]ccc3c2)no1	ZINC000424341677	330344171	/nfs/dbraw/zinc/34/41/71/330344171.db2.gz	VOMSYAWXTXKDGB-UHFFFAOYSA-N	0	0	267.332	4.072	20	30		CIEDRN
N#Cc1ccc(NC(=O)[C@@H]2CC23CCCCC3)c(Cl)c1	ZINC000533199358	330353148	/nfs/dbraw/zinc/35/31/48/330353148.db2.gz	MKOFDOWONSCIGJ-LBPRGKRZSA-N	0	0	288.778	4.121	20	30		CIEDRN
CC[C@@H](Cc1ccccc1)C(=O)Nc1cccc(C#N)c1C	ZINC000533214327	330353963	/nfs/dbraw/zinc/35/39/63/330353963.db2.gz	JCAFWOYJCPVUQX-INIZCTEOSA-N	0	0	292.382	4.074	20	30		CIEDRN
CC(C)(CNc1ccc(C#N)cc1)c1cccs1	ZINC000083601560	330358604	/nfs/dbraw/zinc/35/86/04/330358604.db2.gz	UYOBKHIPUFXDTB-UHFFFAOYSA-N	0	0	256.374	4.009	20	30		CIEDRN
CC(C)[N@H+](Cc1cc(C#N)ccc1F)C1CCCCC1	ZINC000533370838	330360357	/nfs/dbraw/zinc/36/03/57/330360357.db2.gz	RHRYLJLVJGCKRL-UHFFFAOYSA-N	0	0	274.383	4.240	20	30		CIEDRN
C=C(CC)CS[C@H](C)C(=O)Nc1cc(C)ccc1OC	ZINC000536882895	330361091	/nfs/dbraw/zinc/36/10/91/330361091.db2.gz	XNPUSNGUDIFNMC-CYBMUJFWSA-N	0	0	293.432	4.030	20	30		CIEDRN
C=CC[C@H](C)NC(=O)NC(c1ccccc1)c1ccccc1	ZINC000116971254	330362707	/nfs/dbraw/zinc/36/27/07/330362707.db2.gz	BXUXWAVQWMXVIX-HNNXBMFYSA-N	0	0	294.398	4.040	20	30		CIEDRN
C=C[C@@H](CC(=O)NCCc1sccc1C)c1ccccc1	ZINC000536889679	330363380	/nfs/dbraw/zinc/36/33/80/330363380.db2.gz	JIZOCPVRHWLGFE-HNNXBMFYSA-N	0	0	299.439	4.075	20	30		CIEDRN
Cc1ccc(S[C@@H](C)c2ccc(C#N)cc2)nc1	ZINC000118175724	330366753	/nfs/dbraw/zinc/36/67/53/330366753.db2.gz	QRGZTWDZWCGVSF-LBPRGKRZSA-N	0	0	254.358	4.115	20	30		CIEDRN
C[C@@H](Sc1ccc([N+](=O)[O-])cc1)c1ccc(C#N)cc1	ZINC000118445234	330367297	/nfs/dbraw/zinc/36/72/97/330367297.db2.gz	UQVDWNJHTXEZNK-LLVKDONJSA-N	0	0	284.340	4.320	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1cc(Cl)ccc1C	ZINC000424544357	330372786	/nfs/dbraw/zinc/37/27/86/330372786.db2.gz	YVTDWHPCEBSSPU-UHFFFAOYSA-N	0	0	251.757	4.189	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@H](C)c1cccc(Cl)c1	ZINC000424548384	330373902	/nfs/dbraw/zinc/37/39/02/330373902.db2.gz	UCZYGNKMKIPLOT-LLVKDONJSA-N	0	0	265.784	4.120	20	30		CIEDRN
C=CCCC[C@H](C)N1CCO[C@@H](c2ccc(F)c(F)c2)C1	ZINC000536995104	330375374	/nfs/dbraw/zinc/37/53/74/330375374.db2.gz	ODXUIRKLNFXTKM-SUMWQHHRSA-N	0	0	295.373	4.083	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@H](C)c1ccc(OC(F)F)cc1	ZINC000424561974	330376254	/nfs/dbraw/zinc/37/62/54/330376254.db2.gz	JVKCNLFJDGNUBM-LLVKDONJSA-N	0	0	297.345	4.068	20	30		CIEDRN
Cc1cc(C#N)ccc1C(=O)N(CC1CC1)C1CCCCC1	ZINC000119696908	330378857	/nfs/dbraw/zinc/37/88/57/330378857.db2.gz	MEZLGJZQOOFNAT-UHFFFAOYSA-N	0	0	296.414	4.052	20	30		CIEDRN
C[C@H](C#N)N[C@@H](Cc1ccccc1Cl)c1ccccc1	ZINC000119762740	330379574	/nfs/dbraw/zinc/37/95/74/330379574.db2.gz	UYIYTDPSQWVENQ-DYVFJYSZSA-N	0	0	284.790	4.125	20	30		CIEDRN
C=CCOc1cccc(NC(=O)Nc2cscc2C)c1	ZINC000119781413	330379856	/nfs/dbraw/zinc/37/98/56/330379856.db2.gz	AMZJOQMZQLRYCD-UHFFFAOYSA-N	0	0	288.372	4.265	20	30		CIEDRN
CC[C@H]1CCC[C@@H]1NC(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000119921769	330380354	/nfs/dbraw/zinc/38/03/54/330380354.db2.gz	DYDFCJAZSXBEHX-BBRMVZONSA-N	0	0	299.418	4.188	20	30		CIEDRN
C[C@@H]1CCC[C@@H](CCN(CCC#N)Cc2ccccn2)C1	ZINC000089129865	330380824	/nfs/dbraw/zinc/38/08/24/330380824.db2.gz	JNEOEFQSKIZCSO-SJORKVTESA-N	0	0	285.435	4.014	20	30		CIEDRN
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000424579434	330385704	/nfs/dbraw/zinc/38/57/04/330385704.db2.gz	UZOFWBRLRIBXTQ-CJNGLKHVSA-N	0	0	284.403	4.253	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N(CC(C)C)CC(C)C	ZINC000058451985	330388012	/nfs/dbraw/zinc/38/80/12/330388012.db2.gz	ZQBAMDPFIQBTHD-UHFFFAOYSA-N	0	0	287.407	4.013	20	30		CIEDRN
N#Cc1cccc(CSCc2cccc(F)c2F)c1F	ZINC000537046764	330394359	/nfs/dbraw/zinc/39/43/59/330394359.db2.gz	GFFHUOZQZVDDCY-UHFFFAOYSA-N	0	0	293.313	4.409	20	30		CIEDRN
N#Cc1ccc(NC(=O)CCCc2ccccc2)cc1Cl	ZINC000059014436	330395083	/nfs/dbraw/zinc/39/50/83/330395083.db2.gz	AGUKLVSOERXWIF-UHFFFAOYSA-N	0	0	298.773	4.173	20	30		CIEDRN
CC(C)CCc1nc(-c2ccc(C#N)cc2)cs1	ZINC000059184058	330398184	/nfs/dbraw/zinc/39/81/84/330398184.db2.gz	VKZQVTDXCAACRN-UHFFFAOYSA-N	0	0	256.374	4.270	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H](C)c1cc2ccccc2o1	ZINC000121393115	330399871	/nfs/dbraw/zinc/39/98/71/330399871.db2.gz	YYDZJMAQWHZKBP-CYBMUJFWSA-N	0	0	283.371	4.378	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N[C@H](C)c1c(F)cccc1F	ZINC000537186256	330412978	/nfs/dbraw/zinc/41/29/78/330412978.db2.gz	NSCYDORECNRCGA-NWDGAFQWSA-N	0	0	296.361	4.070	20	30		CIEDRN
C=C[C@@H](CC(=O)NCCCc1ccccc1)c1ccccc1	ZINC000122133704	330413285	/nfs/dbraw/zinc/41/32/85/330413285.db2.gz	DWZZCJRTADNZCW-SFHVURJKSA-N	0	0	293.410	4.095	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N(CC)CCc1ccccc1	ZINC000537187306	330413292	/nfs/dbraw/zinc/41/32/92/330413292.db2.gz	AXODTMDYSWQZPQ-INIZCTEOSA-N	0	0	288.435	4.005	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)CC(C)(C)c1ccccc1	ZINC000537239953	330430238	/nfs/dbraw/zinc/43/02/38/330430238.db2.gz	VBZUCSSNJNCTPY-OAHLLOKOSA-N	0	0	273.420	4.215	20	30		CIEDRN
C=CCCOCCCCC(=O)Nc1ccc(F)c(Cl)c1	ZINC000537314345	330432357	/nfs/dbraw/zinc/43/23/57/330432357.db2.gz	PABAOJYDRPBADZ-UHFFFAOYSA-N	0	0	299.773	4.181	20	30		CIEDRN
N#CC1(CSCCc2ccc3ccccc3c2)CC1	ZINC000537319431	330432769	/nfs/dbraw/zinc/43/27/69/330432769.db2.gz	ZEPMSGWVZDEBJF-UHFFFAOYSA-N	0	0	267.397	4.419	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N1C[C@H](c2ccc(F)cc2)C[C@@H]1C	ZINC000424687523	330445933	/nfs/dbraw/zinc/44/59/33/330445933.db2.gz	VMUCNUNPMHQQTO-DZGCQCFKSA-N	0	0	289.394	4.132	20	30		CIEDRN
CCC[C@H](CC1CCCCC1)C(=O)N[C@H](C#N)CCC	ZINC000537725156	330457272	/nfs/dbraw/zinc/45/72/72/330457272.db2.gz	OQZSGQKVJGRERT-CVEARBPZSA-N	0	0	278.440	4.182	20	30		CIEDRN
C=CCN(CC=C)C(=O)C[C@H](C)Cc1ccc(Cl)cc1	ZINC000537855855	330459919	/nfs/dbraw/zinc/45/99/19/330459919.db2.gz	VJPJWWWZQNNRTF-CQSZACIVSA-N	0	0	291.822	4.109	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1ccc(-c2ccc(C)o2)s1	ZINC000514160426	330460441	/nfs/dbraw/zinc/46/04/41/330460441.db2.gz	OTQNUQMRGJZLAH-UHFFFAOYSA-N	0	0	289.400	4.355	20	30		CIEDRN
Cc1ccc2oc(C(=O)Nc3ccc(F)c(C#N)c3)cc2c1	ZINC000314953668	330468516	/nfs/dbraw/zinc/46/85/16/330468516.db2.gz	WBSYGXCITOTMLG-UHFFFAOYSA-N	0	0	294.285	4.004	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1cc2ccccc2nc1C	ZINC000515255789	330473774	/nfs/dbraw/zinc/47/37/74/330473774.db2.gz	NTDFOLRRCKBMAH-UHFFFAOYSA-N	0	0	296.414	4.362	20	30		CIEDRN
N#Cc1ccc(F)c(CSc2c(F)cc(F)cc2F)c1	ZINC000515592336	330480141	/nfs/dbraw/zinc/48/01/41/330480141.db2.gz	XMDBZXOFBDPZES-UHFFFAOYSA-N	0	0	297.276	4.407	20	30		CIEDRN
C=CCN(Cc1cccc(C#N)c1)C(=O)C(C)(C)CC(C)C	ZINC000084538585	330486288	/nfs/dbraw/zinc/48/62/88/330486288.db2.gz	SSGOKQHXTPWRLB-UHFFFAOYSA-N	0	0	298.430	4.145	20	30		CIEDRN
C=CC[C@H](C)NC(=O)[C@H](C)c1ccc2ccccc2c1	ZINC000084604755	330487046	/nfs/dbraw/zinc/48/70/46/330487046.db2.gz	CWJLMQYFVIUSEI-UONOGXRCSA-N	0	0	267.372	4.024	20	30		CIEDRN
C=CCC(C)(C)c1nc([C@H](C)c2cccs2)no1	ZINC000426410238	330507359	/nfs/dbraw/zinc/50/73/59/330507359.db2.gz	KWQOKYBLNXHFOP-SNVBAGLBSA-N	0	0	262.378	4.137	20	30		CIEDRN
N#CCSCCCN(c1ccccc1F)C1CCCC1	ZINC000426464511	330510527	/nfs/dbraw/zinc/51/05/27/330510527.db2.gz	ZDOSARZZYPUJQJ-UHFFFAOYSA-N	0	0	292.423	4.222	20	30		CIEDRN
CC(C)CCN(CCC#N)C(=O)CC1CCCCCC1	ZINC000426724729	330514485	/nfs/dbraw/zinc/51/44/85/330514485.db2.gz	VIXOPDJDYWFULS-UHFFFAOYSA-N	0	0	278.440	4.135	20	30		CIEDRN
Cc1cc([C@@H](C)NCc2cccc(F)c2C#N)c(C)s1	ZINC000428318271	330520123	/nfs/dbraw/zinc/52/01/23/330520123.db2.gz	AODDLWIJMFXKRU-LLVKDONJSA-N	0	0	288.391	4.227	20	30		CIEDRN
C[C@@H](CC#N)Sc1ccccc1NC(=O)CC1(C)CC1	ZINC000428722330	330530361	/nfs/dbraw/zinc/53/03/61/330530361.db2.gz	PGPBSRPWTCCFJQ-LBPRGKRZSA-N	0	0	288.416	4.210	20	30		CIEDRN
C=C(C)CNC(=O)N[C@@H](c1cccs1)C(CC)CC	ZINC000429761402	330554407	/nfs/dbraw/zinc/55/44/07/330554407.db2.gz	OPPNFYJPAGKEEV-CQSZACIVSA-N	0	0	280.437	4.101	20	30		CIEDRN
CCCN(Cc1ccc(C#N)cc1)C(=O)CC1CC(C)(C)C1	ZINC000429862585	330555914	/nfs/dbraw/zinc/55/59/14/330555914.db2.gz	VTLFIWRKFKZBHD-UHFFFAOYSA-N	0	0	298.430	4.123	20	30		CIEDRN
Cc1cc(S[C@H]2CC[C@H](C#N)C2)nc2ccccc12	ZINC000430129740	330561938	/nfs/dbraw/zinc/56/19/38/330561938.db2.gz	ZVZSMVBQSCKDBD-STQMWFEESA-N	0	0	268.385	4.328	20	30		CIEDRN
Cc1cc(S[C@@H]2CC[C@@H](C#N)C2)nc2ccccc12	ZINC000430129737	330561946	/nfs/dbraw/zinc/56/19/46/330561946.db2.gz	ZVZSMVBQSCKDBD-CHWSQXEVSA-N	0	0	268.385	4.328	20	30		CIEDRN
C=CCN(C)C(=O)N[C@H]1C[C@@H]2CCC(C)(C)c3cccc1c32	ZINC000430311190	330566893	/nfs/dbraw/zinc/56/68/93/330566893.db2.gz	HMEOLRVZIKDYQG-BBRMVZONSA-N	0	0	298.430	4.114	20	30		CIEDRN
CC(C)CC(C)(C)C(=O)Nc1ccc(C#N)cc1Cl	ZINC000430364826	330567506	/nfs/dbraw/zinc/56/75/06/330567506.db2.gz	YGSNHPYAFFGGGN-UHFFFAOYSA-N	0	0	278.783	4.222	20	30		CIEDRN
CC(C)c1ccc(/C=C\CC(=O)NCC2(CC#N)CC2)cc1	ZINC000431165801	330580745	/nfs/dbraw/zinc/58/07/45/330580745.db2.gz	HDKLGFPLLOUIOT-ARJAWSKDSA-N	0	0	296.414	4.023	20	30		CIEDRN
C=CCCS(=O)(=O)Nc1ccc(C(C)C)cc1C(C)C	ZINC000431201346	330582032	/nfs/dbraw/zinc/58/20/32/330582032.db2.gz	CQMJDFFSPKMQEM-UHFFFAOYSA-N	0	0	295.448	4.251	20	30		CIEDRN
Cc1ccc(CC(=O)Nc2cccc(C#N)c2C)c(Cl)c1	ZINC000431870181	330589943	/nfs/dbraw/zinc/58/99/43/330589943.db2.gz	MINVRFSWOFNAIB-UHFFFAOYSA-N	0	0	298.773	4.010	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCCCC1CCCCC1	ZINC000432006994	330591244	/nfs/dbraw/zinc/59/12/44/330591244.db2.gz	LQDJLWNHBFVMOW-UHFFFAOYSA-N	0	0	251.414	4.065	20	30		CIEDRN
C=CCCCCNC(=O)N1CC2(CCC2)[C@@H]1c1ccccc1	ZINC000432349874	330597898	/nfs/dbraw/zinc/59/78/98/330597898.db2.gz	XMWXHHBVYXOYAB-KRWDZBQOSA-N	0	0	298.430	4.280	20	30		CIEDRN
C[C@@H](C#N)CN(Cc1csc(Cl)c1Cl)C1CC1	ZINC000432730904	330604555	/nfs/dbraw/zinc/60/45/55/330604555.db2.gz	RDTFGRZOTHTFHS-QMMMGPOBSA-N	0	0	289.231	4.179	20	30		CIEDRN
CCN(C(=O)CC1CC(C)(C)C1)[C@H](C)c1ccc(C#N)cc1	ZINC000432775793	330606397	/nfs/dbraw/zinc/60/63/97/330606397.db2.gz	KCDLXIQPXCYXFE-CQSZACIVSA-N	0	0	298.430	4.294	20	30		CIEDRN
CC(C)(C)OC1CC(CCNc2cccc(F)c2C#N)C1	ZINC000432864992	330609422	/nfs/dbraw/zinc/60/94/22/330609422.db2.gz	NIVQWQPOXGUPJZ-UHFFFAOYSA-N	0	0	290.382	4.093	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H]1CCc2c1cccc2Cl	ZINC000432895877	330609998	/nfs/dbraw/zinc/60/99/98/330609998.db2.gz	AITBASDYVJRSLA-AWEZNQCLSA-N	0	0	277.795	4.046	20	30		CIEDRN
Cc1ccccc1[C@H](C)CC(=O)N1CCCC(C)(C)[C@H]1C#N	ZINC000434030110	330634576	/nfs/dbraw/zinc/63/45/76/330634576.db2.gz	GFRTUFIGBYSUAE-NVXWUHKLSA-N	0	0	298.430	4.029	20	30		CIEDRN
CC1(C)CCCN(C(=O)CC/C=C/c2ccccc2)[C@@H]1C#N	ZINC000434038377	330634822	/nfs/dbraw/zinc/63/48/22/330634822.db2.gz	UALSSJJIVUYPOR-SCBHQAGPSA-N	0	0	296.414	4.021	20	30		CIEDRN
Cc1cc(OCc2ccc(C(F)F)cc2)ccc1C#N	ZINC000434646574	330642250	/nfs/dbraw/zinc/64/22/50/330642250.db2.gz	BWFAENSIXSCRJN-UHFFFAOYSA-N	0	0	273.282	4.383	20	30		CIEDRN
C=CCC[C@H](NC(=O)N1CCC[C@H]1CC)c1ccccc1	ZINC000435103834	330649417	/nfs/dbraw/zinc/64/94/17/330649417.db2.gz	OIANXCOEMDOZID-SJORKVTESA-N	0	0	286.419	4.278	20	30		CIEDRN
COc1cccc([C@@H](C)Sc2ccccc2C#N)c1	ZINC000435228804	330650963	/nfs/dbraw/zinc/65/09/63/330650963.db2.gz	CIGKHLIJZVCRRV-GFCCVEGCSA-N	0	0	269.369	4.420	20	30		CIEDRN
C=CCC[C@H](NC(=O)[C@@H](C)CCC)c1ccccc1	ZINC000435278570	330652401	/nfs/dbraw/zinc/65/24/01/330652401.db2.gz	MNXWLKQMHFAWPJ-HOCLYGCPSA-N	0	0	259.393	4.246	20	30		CIEDRN
C=CCC[C@H](NC(=O)c1cscc1C)c1ccccc1	ZINC000435397259	330654052	/nfs/dbraw/zinc/65/40/52/330654052.db2.gz	DYHLHGUXQFPGCH-INIZCTEOSA-N	0	0	285.412	4.494	20	30		CIEDRN
C=CCC[C@@H](NC(=O)N(C)[C@H](C)C(C)C)c1ccccc1	ZINC000435758103	330662265	/nfs/dbraw/zinc/66/22/65/330662265.db2.gz	DPUVHGMSSFATPE-NVXWUHKLSA-N	0	0	288.435	4.380	20	30		CIEDRN
C=CCC[C@H](NC(=O)N1CCC12CCC2)c1ccccc1	ZINC000435762285	330662331	/nfs/dbraw/zinc/66/23/31/330662331.db2.gz	OBMIUAGPOOWBCP-INIZCTEOSA-N	0	0	284.403	4.032	20	30		CIEDRN
C=CCC[C@@H](NC(=O)N(CC)CCC)c1ccccc1	ZINC000435764587	330662332	/nfs/dbraw/zinc/66/23/32/330662332.db2.gz	PKPCBVISOSUOJQ-MRXNPFEDSA-N	0	0	274.408	4.135	20	30		CIEDRN
N#Cc1ccccc1OCc1nc(-c2ccccc2)cs1	ZINC000435787074	330663125	/nfs/dbraw/zinc/66/31/25/330663125.db2.gz	XTSXKEQLYSVFPE-UHFFFAOYSA-N	0	0	292.363	4.261	20	30		CIEDRN
CC(C)(C#N)CCCCSCC[C@H]1CCCO1	ZINC000435885502	330664449	/nfs/dbraw/zinc/66/44/49/330664449.db2.gz	KWBFIMROBQFADB-CYBMUJFWSA-N	0	0	255.427	4.009	20	30		CIEDRN
C=CCCCSCc1nc(-c2ccccc2F)no1	ZINC000435975153	330667101	/nfs/dbraw/zinc/66/71/01/330667101.db2.gz	WHHQLYJTSMYDQV-UHFFFAOYSA-N	0	0	278.352	4.075	20	30		CIEDRN
C=CC[C@H]1N(C(=O)Nc2ccc(F)cc2)CCCC1(C)C	ZINC000436098048	330668901	/nfs/dbraw/zinc/66/89/01/330668901.db2.gz	BWIAOMLHKJEXCG-OAHLLOKOSA-N	0	0	290.382	4.424	20	30		CIEDRN
N#Cc1cccc(C#N)c1N[C@H]1CCC[C@H]1c1ccccc1	ZINC000436397365	330676593	/nfs/dbraw/zinc/67/65/93/330676593.db2.gz	MOOPCTYKAPYBEK-ROUUACIJSA-N	0	0	287.366	4.178	20	30		CIEDRN
C=C1CCN(C(=O)c2c(C)c(C)oc2-c2ccccc2)CC1	ZINC000436422226	330677381	/nfs/dbraw/zinc/67/73/81/330677381.db2.gz	LOYWCXAIJCCDIO-UHFFFAOYSA-N	0	0	295.382	4.356	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@H](C)c1cccc2ccccc21	ZINC000448581597	330688029	/nfs/dbraw/zinc/68/80/29/330688029.db2.gz	KYUUXFRENSBFFQ-CYBMUJFWSA-N	0	0	267.372	4.229	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@@H]1C[C@H]1c1c(F)cccc1Cl	ZINC000437282179	330697086	/nfs/dbraw/zinc/69/70/86/330697086.db2.gz	BFCQRNJQFSDSGV-ZXIHIIQKSA-N	0	0	295.785	4.054	20	30		CIEDRN
C=CC(C)(C)C(=O)N(C)Cc1ccc2cc(OC)ccc2c1	ZINC000448590557	330705360	/nfs/dbraw/zinc/70/53/60/330705360.db2.gz	CYAPRZDINQWDTJ-UHFFFAOYSA-N	0	0	297.398	4.019	20	30		CIEDRN
CCCCCN(C(=O)Nc1ccc(F)c(C#N)c1)C(C)C	ZINC000437980075	330712563	/nfs/dbraw/zinc/71/25/63/330712563.db2.gz	SHVKERFPSFIFHJ-UHFFFAOYSA-N	0	0	291.370	4.130	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1ccc(C(C)=O)c(Cl)c1	ZINC000439376653	330737652	/nfs/dbraw/zinc/73/76/52/330737652.db2.gz	WEIBJFUIGOUMBH-NSHDSACASA-N	0	0	294.782	4.019	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1csc2ccccc12	ZINC000439389169	330737766	/nfs/dbraw/zinc/73/77/66/330737766.db2.gz	UQGKITUQMANCOU-LLVKDONJSA-N	0	0	274.389	4.378	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1c(C)noc1-c1ccccc1	ZINC000439387697	330737769	/nfs/dbraw/zinc/73/77/69/330737769.db2.gz	YWPNNPPJZOCFTI-AWEZNQCLSA-N	0	0	299.374	4.126	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1cccc(N(C)C(C)C)c1	ZINC000439518246	330740004	/nfs/dbraw/zinc/74/00/04/330740004.db2.gz	IHHNVSSDNKCFKB-CQSZACIVSA-N	0	0	289.423	4.007	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1cccc(CSCC)c1	ZINC000439592173	330740880	/nfs/dbraw/zinc/74/08/80/330740880.db2.gz	URJOXYLOCWEGJR-CQSZACIVSA-N	0	0	292.448	4.416	20	30		CIEDRN
C=CCCCN(C)C(=O)[C@H](C)c1ccc2ccccc2c1	ZINC000439739197	330742558	/nfs/dbraw/zinc/74/25/58/330742558.db2.gz	MQJUIBQLSQBLIV-OAHLLOKOSA-N	0	0	281.399	4.368	20	30		CIEDRN
CC[C@H](CC(=O)N(C)c1ccc(C#N)cc1)c1ccccc1	ZINC000440065577	330745980	/nfs/dbraw/zinc/74/59/80/330745980.db2.gz	VHRMVXMYUVUDBM-MRXNPFEDSA-N	0	0	292.382	4.105	20	30		CIEDRN
CC(C)CC1(C(=O)Nc2ccc(C(C)(C)C#N)cc2)CC1	ZINC000440754027	330755582	/nfs/dbraw/zinc/75/55/82/330755582.db2.gz	NOQZAECYZPJNOH-UHFFFAOYSA-N	0	0	284.403	4.253	20	30		CIEDRN
C=CCCC(=O)N1CCCCC[C@H]1/C=C/c1ccccc1	ZINC000440879494	330757320	/nfs/dbraw/zinc/75/73/20/330757320.db2.gz	WEPFOVQYVBUHLD-JJJPLKNQSA-N	0	0	283.415	4.437	20	30		CIEDRN
C=CCCC(=O)N1CCCCC[C@H]1/C=C\c1ccccc1	ZINC000440879499	330757352	/nfs/dbraw/zinc/75/73/52/330757352.db2.gz	WEPFOVQYVBUHLD-OUFNUQFJSA-N	0	0	283.415	4.437	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cc(Cl)cc(F)c1F	ZINC000441578397	330771003	/nfs/dbraw/zinc/77/10/03/330771003.db2.gz	XMXUQQNKUMZHAV-MRVPVSSYSA-N	0	0	273.710	4.159	20	30		CIEDRN
N#Cc1ccc(F)c(CNc2cc(Cl)cc(F)c2F)c1	ZINC000442085665	330773932	/nfs/dbraw/zinc/77/39/32/330773932.db2.gz	OHJSJPFVMVOPJG-UHFFFAOYSA-N	0	0	296.679	4.241	20	30		CIEDRN
C=CC(C)(C)C(=O)NC1CCC(c2ccccc2)CC1	ZINC000448666100	330774885	/nfs/dbraw/zinc/77/48/85/330774885.db2.gz	FHXRKWWZSDQUBN-UHFFFAOYSA-N	0	0	271.404	4.041	20	30		CIEDRN
CCCCCc1ccc(NCc2ccc(C#N)o2)cc1	ZINC000157437843	330775549	/nfs/dbraw/zinc/77/55/49/330775549.db2.gz	HSLXEKQYKKLCET-UHFFFAOYSA-N	0	0	268.360	4.496	20	30		CIEDRN
N#C[C@H]1CC[C@H](Nc2cc(Cl)cc(C(F)(F)F)c2)C1	ZINC000442836084	330786056	/nfs/dbraw/zinc/78/60/56/330786056.db2.gz	GHYGTJIFRDHJFL-KWQFWETISA-N	0	0	288.700	4.463	20	30		CIEDRN
CC(C)(C)Oc1cc(F)ccc1N[C@@H]1CC[C@H](C#N)C1	ZINC000442856708	330787570	/nfs/dbraw/zinc/78/75/70/330787570.db2.gz	OVJBGSZKDQMSPO-WCQYABFASA-N	0	0	276.355	4.107	20	30		CIEDRN
CC(C)CCn1ncc(N[C@@H]2CC[C@H](C#N)C2)c1C(C)C	ZINC000442858775	330787794	/nfs/dbraw/zinc/78/77/94/330787794.db2.gz	SYZNQIDQFURHTA-LSDHHAIUSA-N	0	0	288.439	4.157	20	30		CIEDRN
Cc1ccc2oc(S[C@@H](C)c3cccc(C#N)c3)nc2n1	ZINC000442904057	330791297	/nfs/dbraw/zinc/79/12/97/330791297.db2.gz	BYKSRVBRBWCEAW-NSHDSACASA-N	0	0	295.367	4.256	20	30		CIEDRN
N#Cc1ccc(SCCCCC(F)(F)F)cc1	ZINC000443531622	330800871	/nfs/dbraw/zinc/80/08/71/330800871.db2.gz	QKVIWQCAKFVDPU-UHFFFAOYSA-N	0	0	259.296	4.383	20	30		CIEDRN
COc1c(Cl)cccc1NCc1ccc(C#N)c(C)c1	ZINC000443999545	330808928	/nfs/dbraw/zinc/80/89/28/330808928.db2.gz	DAVMKIBSOIPRGC-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
C[C@@H](Nc1ncc(C#N)cc1Cl)c1cccc(F)c1F	ZINC000162896348	330810972	/nfs/dbraw/zinc/81/09/72/330810972.db2.gz	PZQVBLIDENMXPM-MRVPVSSYSA-N	0	0	293.704	4.058	20	30		CIEDRN
CC(C)(C#N)CCCCN1CCc2c1cc(F)cc2F	ZINC000444647715	330816466	/nfs/dbraw/zinc/81/64/66/330816466.db2.gz	LYMSBNWFFZXGTJ-UHFFFAOYSA-N	0	0	278.346	4.047	20	30		CIEDRN
C=C(C)CN[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F	ZINC000444813757	330826618	/nfs/dbraw/zinc/82/66/18/330826618.db2.gz	OCOOCMVRATUJMC-LLVKDONJSA-N	0	0	281.680	4.248	20	30		CIEDRN
Cc1ccc(F)cc1CSc1cccc(C#N)c1	ZINC000445603505	330832769	/nfs/dbraw/zinc/83/27/69/330832769.db2.gz	DSQSXOHNQKEORK-UHFFFAOYSA-N	0	0	257.333	4.298	20	30		CIEDRN
CCC1(c2noc(/C=C\c3cccc(C#N)c3)n2)CCCC1	ZINC000445786313	330836438	/nfs/dbraw/zinc/83/64/38/330836438.db2.gz	VSJRGWPTHMMOQU-HJWRWDBZSA-N	0	0	293.370	4.333	20	30		CIEDRN
CCC1(c2noc(/C=C/c3ccc(C#N)cc3)n2)CCCC1	ZINC000445786375	330836467	/nfs/dbraw/zinc/83/64/67/330836467.db2.gz	ZMUTULGDMBBSKZ-MDZDMXLPSA-N	0	0	293.370	4.333	20	30		CIEDRN
Cc1cscc1NC(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000159828368	330851933	/nfs/dbraw/zinc/85/19/33/330851933.db2.gz	YKYNGHWQLVTPOU-UHFFFAOYSA-N	0	0	291.763	4.226	20	30		CIEDRN
COCc1cccc(CSCc2cccc(C#N)c2)c1	ZINC000446944963	330858565	/nfs/dbraw/zinc/85/85/65/330858565.db2.gz	BGXZXCKDYITUMF-UHFFFAOYSA-N	0	0	283.396	4.138	20	30		CIEDRN
C[C@@H]1C[C@H](CSc2cccc(Cl)c2C#N)CCO1	ZINC000447289362	330863505	/nfs/dbraw/zinc/86/35/05/330863505.db2.gz	YLJWHZPHAHTDDR-GHMZBOCLSA-N	0	0	281.808	4.119	20	30		CIEDRN
C=CCCCCCSc1ccc(C(F)(F)F)nn1	ZINC000447287569	330863557	/nfs/dbraw/zinc/86/35/57/330863557.db2.gz	ZCIJTIPACFGXPH-UHFFFAOYSA-N	0	0	276.327	4.334	20	30		CIEDRN
Cc1cc(CSc2ccc(N)cc2Cl)ccc1C#N	ZINC000447307477	330864193	/nfs/dbraw/zinc/86/41/93/330864193.db2.gz	VNNDIFFWLNUMOU-UHFFFAOYSA-N	0	0	288.803	4.395	20	30		CIEDRN
C=CCC[C@H](NC(=O)N(C)CC1CCC1)c1ccccc1	ZINC000160420531	330865164	/nfs/dbraw/zinc/86/51/64/330865164.db2.gz	PLZJUEGMOBALIV-KRWDZBQOSA-N	0	0	286.419	4.135	20	30		CIEDRN
COc1cc(SC)ccc1N[C@@H](C)c1cccc(C#N)c1	ZINC000194524335	330867095	/nfs/dbraw/zinc/86/70/95/330867095.db2.gz	YPKJRAGYUVHEEN-LBPRGKRZSA-N	0	0	298.411	4.462	20	30		CIEDRN
CC[C@H](Nc1cccc2c1OCCC2)c1ccc(C#N)cc1	ZINC000447583211	330871318	/nfs/dbraw/zinc/87/13/18/330871318.db2.gz	AZLFGPBNOVLAIX-KRWDZBQOSA-N	0	0	292.382	4.446	20	30		CIEDRN
CC(C)=CCSc1cc(C#N)c2cc([N+](=O)[O-])ccc2n1	ZINC000447691489	330874188	/nfs/dbraw/zinc/87/41/88/330874188.db2.gz	RZQWVTCQKSTZFS-UHFFFAOYSA-N	0	0	299.355	4.073	20	30		CIEDRN
C=CCCCNC(=O)Nc1ccc(SC)c(Cl)c1	ZINC000448002027	330882607	/nfs/dbraw/zinc/88/26/07/330882607.db2.gz	WGUIDWQFHVHMBA-UHFFFAOYSA-N	0	0	284.812	4.150	20	30		CIEDRN
CC[C@H]1CCC[C@@H]1C(=O)N(Cc1ccc(C#N)cc1)C(C)C	ZINC000448818641	330884828	/nfs/dbraw/zinc/88/48/28/330884828.db2.gz	NWWFNWZSEIAOEU-ROUUACIJSA-N	0	0	298.430	4.122	20	30		CIEDRN
CCc1c2ccccc2oc1C(=O)N[C@](C)(C#N)CC(C)C	ZINC000448848331	330885855	/nfs/dbraw/zinc/88/58/55/330885855.db2.gz	OAMKPDARHACCHB-SFHVURJKSA-N	0	0	298.386	4.053	20	30		CIEDRN
C=CCC1(C(=O)NC[C@@H](C)c2ccccc2)CCCC1	ZINC000449041366	330894703	/nfs/dbraw/zinc/89/47/03/330894703.db2.gz	MSKZHLKDLGRNCL-OAHLLOKOSA-N	0	0	271.404	4.043	20	30		CIEDRN
CSc1ccc(NC2CCC(C)(C#N)CC2)cc1	ZINC000449041740	330894747	/nfs/dbraw/zinc/89/47/47/330894747.db2.gz	OJUIPPQUXLFXGR-UHFFFAOYSA-N	0	0	260.406	4.293	20	30		CIEDRN
CC1(C#N)CCC(Nc2ccccc2Br)CC1	ZINC000449044924	330895097	/nfs/dbraw/zinc/89/50/97/330895097.db2.gz	CYZNJIMFEYRMAD-UHFFFAOYSA-N	0	0	293.208	4.333	20	30		CIEDRN
CCc1ccc(NC2CCC(C)(C#N)CC2)cc1C	ZINC000449212185	330906500	/nfs/dbraw/zinc/90/65/00/330906500.db2.gz	IXBVXNPXLJTHOY-UHFFFAOYSA-N	0	0	256.393	4.442	20	30		CIEDRN
CC1(C#N)CCN(Cc2cc(Cl)sc2Cl)CC1	ZINC000449229526	330907828	/nfs/dbraw/zinc/90/78/28/330907828.db2.gz	BQXKFGKIYPIVJA-UHFFFAOYSA-N	0	0	289.231	4.181	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc3[nH]ccc3c2)CCCC1	ZINC000449256660	330910313	/nfs/dbraw/zinc/91/03/13/330910313.db2.gz	FDIPSKAYRLYTFX-UHFFFAOYSA-N	0	0	268.360	4.243	20	30		CIEDRN
C=CCCCC[C@H](C)Nc1cnn(C2CCOCC2)c1C	ZINC000449368350	330919178	/nfs/dbraw/zinc/91/91/78/330919178.db2.gz	HMVQHEAIJBQQEZ-AWEZNQCLSA-N	0	0	291.439	4.090	20	30		CIEDRN
N#CCc1cccc(NCc2ccccc2OCC2CC2)c1	ZINC000449691680	330943968	/nfs/dbraw/zinc/94/39/68/330943968.db2.gz	XQDVPSRCDOCQHA-UHFFFAOYSA-N	0	0	292.382	4.154	20	30		CIEDRN
C[C@@H]1[C@@H](Nc2cccc(CC#N)c2)C[C@@H]1c1ccccc1	ZINC000449701726	330945009	/nfs/dbraw/zinc/94/50/09/330945009.db2.gz	RJBCABZCPFJWHJ-JVPBZIDWSA-N	0	0	276.383	4.357	20	30		CIEDRN
COc1ccc([C@H](C)[C@H](C)Nc2cccc(CC#N)c2)cc1	ZINC000449704388	330945108	/nfs/dbraw/zinc/94/51/08/330945108.db2.gz	VUMCMSACLGAPDK-CABCVRRESA-N	0	0	294.398	4.365	20	30		CIEDRN
C=CC(C)(C)C(=O)Nc1ccc(OC(C)(C)C)cc1	ZINC000449935983	330955519	/nfs/dbraw/zinc/95/55/19/330955519.db2.gz	BAIMVJAPULAQKU-UHFFFAOYSA-N	0	0	261.365	4.015	20	30		CIEDRN
C=CC(C)(C)C(=O)N1CC[C@@H](c2ccccc2)[C@@H](CC)C1	ZINC000450020367	330958852	/nfs/dbraw/zinc/95/88/52/330958852.db2.gz	WVKVEOBFMUHHBW-DOTOQJQBSA-N	0	0	285.431	4.241	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@@H](C(C)C)C2)CCCCC1	ZINC000450086066	330960904	/nfs/dbraw/zinc/96/09/04/330960904.db2.gz	CQCQTJNHVONRIR-OAHLLOKOSA-N	0	0	263.425	4.018	20	30		CIEDRN
C=CC(C)(C)C(=O)Nc1ccc(C(=O)C(C)(C)C)cc1	ZINC000450104162	330961814	/nfs/dbraw/zinc/96/18/14/330961814.db2.gz	IAKBBLIYPREXCA-UHFFFAOYSA-N	0	0	273.376	4.066	20	30		CIEDRN
C=C(C)CN(C)C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000450472395	330982333	/nfs/dbraw/zinc/98/23/33/330982333.db2.gz	XMRXGAMKFWYHLQ-GXTWGEPZSA-N	0	0	295.785	4.007	20	30		CIEDRN
C[C@@H](NCC1(C#N)CCC1)c1cc(Cl)ccc1Cl	ZINC000450665355	330992002	/nfs/dbraw/zinc/99/20/02/330992002.db2.gz	FUGHGFYKNXHLBW-SNVBAGLBSA-N	0	0	283.202	4.338	20	30		CIEDRN
C[C@H](NCC1(C#N)CCC1)c1ccccc1C(F)(F)F	ZINC000450677420	330992963	/nfs/dbraw/zinc/99/29/63/330992963.db2.gz	GBGBFZWLQPZAHH-NSHDSACASA-N	0	0	282.309	4.050	20	30		CIEDRN
C[C@@H](SCC1(C#N)CCC1)c1c(F)cccc1F	ZINC000450824047	331001186	/nfs/dbraw/zinc/00/11/86/331001186.db2.gz	WCBUWEGHVDHIOD-SNVBAGLBSA-N	0	0	267.344	4.453	20	30		CIEDRN
C[C@H](SCC1(C#N)CCC1)c1c(F)cccc1F	ZINC000450824046	331001221	/nfs/dbraw/zinc/00/12/21/331001221.db2.gz	WCBUWEGHVDHIOD-JTQLQIEISA-N	0	0	267.344	4.453	20	30		CIEDRN
N#C[C@@H]1CC[C@@H](SCc2cccc(Cl)c2)C1	ZINC000450825330	331001320	/nfs/dbraw/zinc/00/13/20/331001320.db2.gz	YFOHQLUQIAXDMY-ZWNOBZJWSA-N	0	0	251.782	4.265	20	30		CIEDRN
CC(C)c1cnc(SCC2(C#N)CCC2)n1C(C)C	ZINC000450851020	331002793	/nfs/dbraw/zinc/00/27/93/331002793.db2.gz	ZKQYQLYYMGRMMR-UHFFFAOYSA-N	0	0	277.437	4.373	20	30		CIEDRN
N#Cc1cccc(SC2CCC(C(F)(F)F)CC2)n1	ZINC000450869958	331003857	/nfs/dbraw/zinc/00/38/57/331003857.db2.gz	KQUJEDBVYVCXTL-UHFFFAOYSA-N	0	0	286.322	4.166	20	30		CIEDRN
Cc1cc(C#N)cc(N2CCC[C@H]2c2ccc(F)cc2C)n1	ZINC000450907245	331006357	/nfs/dbraw/zinc/00/63/57/331006357.db2.gz	FJAMGMJGORGNIF-KRWDZBQOSA-N	0	0	295.361	4.051	20	30		CIEDRN
Cc1cc(F)ccc1[C@@H]1CCCN1c1ccc(C#N)c(C)n1	ZINC000450910613	331006585	/nfs/dbraw/zinc/00/65/85/331006585.db2.gz	JOHRVOFVJFRVGW-KRWDZBQOSA-N	0	0	295.361	4.051	20	30		CIEDRN
CN(CCCCC(C)(C)C#N)c1cccc2cccnc21	ZINC000450913255	331006767	/nfs/dbraw/zinc/00/67/67/331006767.db2.gz	YSPJIAWEXBDOPR-UHFFFAOYSA-N	0	0	281.403	4.391	20	30		CIEDRN
N#C[C@@H]1CC[C@@H](SCc2ccccc2Cl)C1	ZINC000450912326	331006788	/nfs/dbraw/zinc/00/67/88/331006788.db2.gz	GSSHWKFIVPJBPI-ZYHUDNBSSA-N	0	0	251.782	4.265	20	30		CIEDRN
Cc1nc(C(C)C)oc1COc1cc(Cl)cc(C#N)c1	ZINC000450967584	331009140	/nfs/dbraw/zinc/00/91/40/331009140.db2.gz	XBRAPTSXUPOMEO-UHFFFAOYSA-N	0	0	290.750	4.211	20	30		CIEDRN
C=CCN(CCC#N)Cc1ccc([C@@H](C)C(F)(F)F)cc1	ZINC000451061958	331014285	/nfs/dbraw/zinc/01/42/85/331014285.db2.gz	RQIKQDFZACPFLR-CYBMUJFWSA-N	0	0	296.336	4.254	20	30		CIEDRN
C=CCC1(C(=O)Nc2cnn([C@@H](C)CC)c2C)CCCC1	ZINC000451152235	331017847	/nfs/dbraw/zinc/01/78/47/331017847.db2.gz	XEYMIFUNCCKPET-ZDUSSCGKSA-N	0	0	289.423	4.238	20	30		CIEDRN
C=CCCCNC(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F	ZINC000451298093	331023742	/nfs/dbraw/zinc/02/37/42/331023742.db2.gz	VKXYLZOPVZWWGX-JSGCOSHPSA-N	0	0	295.785	4.055	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1nc(-c2ccccc2F)co1	ZINC000451361632	331025690	/nfs/dbraw/zinc/02/56/90/331025690.db2.gz	GUMAFXAGWNARDP-UHFFFAOYSA-N	0	0	288.322	4.022	20	30		CIEDRN
C=CCC1(C(=O)NCCCC(C)(C)COC)CCCCC1	ZINC000451767824	331041420	/nfs/dbraw/zinc/04/14/20/331041420.db2.gz	WWCICGSLZRZLTE-UHFFFAOYSA-N	0	0	295.467	4.082	20	30		CIEDRN
C[C@H](CCCC(F)(F)F)Nc1ccc(C#N)cc1F	ZINC000163475268	331044339	/nfs/dbraw/zinc/04/43/39/331044339.db2.gz	MDDSQZRZDUFNEG-SECBINFHSA-N	0	0	274.261	4.230	20	30		CIEDRN
C/C=C/c1ccc(OCc2ccc(F)cc2C#N)c(OC)c1	ZINC000303132579	332908133	/nfs/dbraw/zinc/90/81/33/332908133.db2.gz	BLTPVXMIPCGXSR-ONEGZZNKSA-N	0	0	297.329	4.318	20	30		CIEDRN
Cc1cc(F)ccc1[C@H]1CCC[N@@H+]1CCC(C)(C)C#N	ZINC000451995292	331049641	/nfs/dbraw/zinc/04/96/41/331049641.db2.gz	QXDIKOCYPXMPJT-MRXNPFEDSA-N	0	0	274.383	4.211	20	30		CIEDRN
Cc1sccc1C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000452138548	331055623	/nfs/dbraw/zinc/05/56/23/331055623.db2.gz	JLFOTMRLHQGTGN-INIZCTEOSA-N	0	0	298.411	4.222	20	30		CIEDRN
C=CCC1(C(=O)N2CC3(CCC3)[C@H]2C2CC2)CCCCC1	ZINC000452157838	331056473	/nfs/dbraw/zinc/05/64/73/331056473.db2.gz	ZVBZJRUAUALVQM-MRXNPFEDSA-N	0	0	287.447	4.304	20	30		CIEDRN
C=CCC1(C(=O)N2CC3(CCC3)[C@@H]2C(C)C)CCCC1	ZINC000452261376	331060252	/nfs/dbraw/zinc/06/02/52/331060252.db2.gz	HPNAEDKFDWQGIK-HNNXBMFYSA-N	0	0	275.436	4.160	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1ccc2cc[nH]c2c1)c1ccccc1	ZINC000194837384	331063254	/nfs/dbraw/zinc/06/32/54/331063254.db2.gz	KRVKSXWNRLDXIW-AWEZNQCLSA-N	0	0	290.366	4.466	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1ccc2cc[nH]c2c1)c1ccccc1	ZINC000194837400	331063294	/nfs/dbraw/zinc/06/32/94/331063294.db2.gz	KRVKSXWNRLDXIW-CQSZACIVSA-N	0	0	290.366	4.466	20	30		CIEDRN
C=CCN(Cc1cccc(C#N)c1)C(=O)C(CCC)CCC	ZINC000510630592	332908395	/nfs/dbraw/zinc/90/83/95/332908395.db2.gz	VPZQIMIPEJFUAX-UHFFFAOYSA-N	0	0	298.430	4.289	20	30		CIEDRN
CC(C)=CCC[C@@H](C)NC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000452540302	331067955	/nfs/dbraw/zinc/06/79/55/331067955.db2.gz	JDUPXAABGDCAOS-SJLPKXTDSA-N	0	0	298.430	4.325	20	30		CIEDRN
C[C@@H]1C[C@@H](CC(=O)N[C@H]2CC[C@@H](CC#N)C2)CC(C)(C)C1	ZINC000452560352	331068937	/nfs/dbraw/zinc/06/89/37/331068937.db2.gz	CPRDMNAHYFNIAQ-UGUYLWEFSA-N	0	0	290.451	4.037	20	30		CIEDRN
CC(C)[C@H](CC1CCCC1)C(=O)N[C@H]1CC[C@@H](CC#N)C1	ZINC000452561648	331069034	/nfs/dbraw/zinc/06/90/34/331069034.db2.gz	LNDSJKSDBFRAMI-ULQDDVLXSA-N	0	0	290.451	4.037	20	30		CIEDRN
CC1(C)CC[C@@H](C(=O)Nc2ccc(CC#N)cc2Cl)C1	ZINC000452648918	331071038	/nfs/dbraw/zinc/07/10/38/331071038.db2.gz	WDCSUMBFYHLQPU-GFCCVEGCSA-N	0	0	290.794	4.171	20	30		CIEDRN
N#CCc1ccc(NC(=O)CC2CCCCC2)c(Cl)c1	ZINC000452653163	331071222	/nfs/dbraw/zinc/07/12/22/331071222.db2.gz	ZDGMDBLJHKBDSM-UHFFFAOYSA-N	0	0	290.794	4.315	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)Nc1ccccc1C(C)(F)F)OCC	ZINC000452676645	331072027	/nfs/dbraw/zinc/07/20/27/331072027.db2.gz	TWCVVZNEQSIIBI-CQSZACIVSA-N	0	0	297.345	4.108	20	30		CIEDRN
C=C(C)CCNC(=O)[C@H](CC)c1cccc(C(F)(F)F)c1	ZINC000452716400	331072950	/nfs/dbraw/zinc/07/29/50/331072950.db2.gz	HLXWMHRZVFGMQH-CQSZACIVSA-N	0	0	299.336	4.281	20	30		CIEDRN
C=C(C)CCNC(=O)[C@H]1C[C@@H]1c1cccc2ccccc21	ZINC000452722578	331074050	/nfs/dbraw/zinc/07/40/50/331074050.db2.gz	KNMMDMGRJNVYHF-MSOLQXFVSA-N	0	0	279.383	4.026	20	30		CIEDRN
C=CC(C)(C)CNC(=O)[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000452774105	331076029	/nfs/dbraw/zinc/07/60/29/331076029.db2.gz	KGICTCLMAIEKAT-LLVKDONJSA-N	0	0	299.336	4.137	20	30		CIEDRN
C=CCCO[C@@H](C)C(=O)Nc1cc(C)cc2ccccc21	ZINC000452839076	331079140	/nfs/dbraw/zinc/07/91/40/331079140.db2.gz	DKKJCZUYTUNUON-AWEZNQCLSA-N	0	0	283.371	4.068	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc(C(=O)C(C)C)cc1	ZINC000452985702	331082943	/nfs/dbraw/zinc/08/29/43/331082943.db2.gz	ZTJHPCIOUHFIHR-UHFFFAOYSA-N	0	0	273.376	4.066	20	30		CIEDRN
CC(C)(C#N)CCCCS(=O)(=O)CC1(C)CCCCC1	ZINC000453040332	331084557	/nfs/dbraw/zinc/08/45/57/331084557.db2.gz	KBEWJRAAEMXXDZ-UHFFFAOYSA-N	0	0	299.480	4.092	20	30		CIEDRN
Cc1cccc(CNc2ccccc2S[C@H](C)CC#N)n1	ZINC000453077780	331087086	/nfs/dbraw/zinc/08/70/86/331087086.db2.gz	BSHKPDAYQOLJMX-CQSZACIVSA-N	0	0	297.427	4.396	20	30		CIEDRN
C=CCC1(c2nc([C@@H]3CCO[C@@H](C)C3)no2)CCCCC1	ZINC000453145664	331094055	/nfs/dbraw/zinc/09/40/55/331094055.db2.gz	HWANNIVMWHYGIR-UONOGXRCSA-N	0	0	290.407	4.130	20	30		CIEDRN
C=CCC1(c2nc([C@@H]3CCO[C@H](C)C3)no2)CCCCC1	ZINC000453145666	331094070	/nfs/dbraw/zinc/09/40/70/331094070.db2.gz	HWANNIVMWHYGIR-ZIAGYGMSSA-N	0	0	290.407	4.130	20	30		CIEDRN
CC[C@@H](Nc1cccc(OCCCC#N)c1)c1ccncc1	ZINC000453162284	331095776	/nfs/dbraw/zinc/09/57/76/331095776.db2.gz	KRWIXGPZZCRXJT-GOSISDBHSA-N	0	0	295.386	4.327	20	30		CIEDRN
C=CCC1(c2nc([C@@H]3CCC(F)(F)C3)no2)CCCC1	ZINC000453179178	331097665	/nfs/dbraw/zinc/09/76/65/331097665.db2.gz	WSFCHODQVOMIIP-LLVKDONJSA-N	0	0	282.334	4.360	20	30		CIEDRN
C=C(C)CCc1noc(-c2ccsc2Br)n1	ZINC000453179256	331097720	/nfs/dbraw/zinc/09/77/20/331097720.db2.gz	IPTUNBMNENOYFU-UHFFFAOYSA-N	0	0	299.193	4.069	20	30		CIEDRN
C=CCC1(c2nc([C@H]3CCC(F)(F)C3)no2)CCCC1	ZINC000453179179	331097742	/nfs/dbraw/zinc/09/77/42/331097742.db2.gz	WSFCHODQVOMIIP-NSHDSACASA-N	0	0	282.334	4.360	20	30		CIEDRN
C=CCCCC[C@H](C)Nc1ccc(F)c(NC(=O)NC)c1	ZINC000453215804	331102342	/nfs/dbraw/zinc/10/23/42/331102342.db2.gz	SHLXRRQSNLZSIE-LBPRGKRZSA-N	0	0	293.386	4.124	20	30		CIEDRN
C=CCCc1noc([C@H]2CCCO[C@H]2c2ccc(C)cc2)n1	ZINC000453240995	331106060	/nfs/dbraw/zinc/10/60/60/331106060.db2.gz	VAWOEGCRBSURJU-RDJZCZTQSA-N	0	0	298.386	4.132	20	30		CIEDRN
C=CCCc1noc([C@@H](C)CSc2ccc(F)cc2)n1	ZINC000453243641	331106593	/nfs/dbraw/zinc/10/65/93/331106593.db2.gz	ZNPAJVHJHCXYBD-NSHDSACASA-N	0	0	292.379	4.223	20	30		CIEDRN
C=CCCc1noc([C@@H]2C[C@@H]2c2ccc([C@H]3C[C@@H]3C)o2)n1	ZINC000453250699	331107596	/nfs/dbraw/zinc/10/75/96/331107596.db2.gz	YQPHMJKILZVBTD-ZDEQEGDKSA-N	0	0	284.359	4.176	20	30		CIEDRN
CCc1ccc(N[C@@H](C)c2ccc(C#N)cc2)cc1OC	ZINC000453337890	331118705	/nfs/dbraw/zinc/11/87/05/331118705.db2.gz	AWXPYLNNYUJCKL-ZDUSSCGKSA-N	0	0	280.371	4.302	20	30		CIEDRN
N#C[C@@H]1CC[C@@H](Nc2cc(Cl)cc(Br)c2)C1	ZINC000453407184	331129405	/nfs/dbraw/zinc/12/94/05/331129405.db2.gz	DIWNZASMTDJMDP-LDYMZIIASA-N	0	0	299.599	4.207	20	30		CIEDRN
N#Cc1ccc(COc2ccc3[nH]ccc3c2)c(Cl)c1	ZINC000163846925	331134576	/nfs/dbraw/zinc/13/45/76/331134576.db2.gz	KVUJABMLWXETGV-UHFFFAOYSA-N	0	0	282.730	4.272	20	30		CIEDRN
C[C@@H](CCC#N)Sc1nc(-c2ccccc2)co1	ZINC000195108742	331137899	/nfs/dbraw/zinc/13/78/99/331137899.db2.gz	YMKFNYYRFNVEFQ-NSHDSACASA-N	0	0	258.346	4.126	20	30		CIEDRN
C=C(C)CCNC(=O)Nc1cc(Cl)ccc1Cl	ZINC000454164676	331140518	/nfs/dbraw/zinc/14/05/18/331140518.db2.gz	JCUGFCUQROYNPB-UHFFFAOYSA-N	0	0	273.163	4.081	20	30		CIEDRN
CC(C)=CCC[C@@H](C)NC(=O)N[C@@H](C)c1ccc(C#N)cc1	ZINC000454353340	331144746	/nfs/dbraw/zinc/14/47/46/331144746.db2.gz	XIAZZTTXBWWRJH-CABCVRRESA-N	0	0	299.418	4.053	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1ccc([C@H](C)C(F)(F)F)cc1	ZINC000454682713	331151258	/nfs/dbraw/zinc/15/12/58/331151258.db2.gz	RFNWYFNHVZUIFI-LBPRGKRZSA-N	0	0	299.336	4.391	20	30		CIEDRN
C=CC(C)(C)CNC(=O)Nc1ccc2nc(C3CC3)oc2c1	ZINC000454933713	331157105	/nfs/dbraw/zinc/15/71/05/331157105.db2.gz	YBPWLRWMINFHHG-UHFFFAOYSA-N	0	0	299.374	4.039	20	30		CIEDRN
C=C(C)CCNC(=O)Nc1cccc(C(F)(F)F)c1C	ZINC000454954793	331157516	/nfs/dbraw/zinc/15/75/16/331157516.db2.gz	QOOZNXMLFUUJJL-UHFFFAOYSA-N	0	0	286.297	4.102	20	30		CIEDRN
C=C(C)CCNC(=O)Nc1ccc(C)c(-c2nc(C)co2)c1	ZINC000454971914	331157950	/nfs/dbraw/zinc/15/79/50/331157950.db2.gz	KDSFTIFVZCTPTC-UHFFFAOYSA-N	0	0	299.374	4.046	20	30		CIEDRN
C=CC(C)(C)CNC(=O)Nc1cc(SC)ccc1C	ZINC000455077731	331160247	/nfs/dbraw/zinc/16/02/47/331160247.db2.gz	VBGHZDFBCNAROX-UHFFFAOYSA-N	0	0	278.421	4.051	20	30		CIEDRN
C=CC(C)(C)CNC(=O)Nc1cccc(C(C)(F)F)c1	ZINC000455223885	331162856	/nfs/dbraw/zinc/16/28/56/331162856.db2.gz	KIYJESAYUAWWOF-UHFFFAOYSA-N	0	0	282.334	4.132	20	30		CIEDRN
C=CC(C)(C)CNC(=O)N1CCC[C@@H]1c1ccc(C)cc1	ZINC000455364631	331167207	/nfs/dbraw/zinc/16/72/07/331167207.db2.gz	JSZLEGUKESZODB-MRXNPFEDSA-N	0	0	286.419	4.054	20	30		CIEDRN
C=CC(C)(C)CNC(=O)N1CC[C@@H]1c1ccc(Cl)cc1	ZINC000455370393	331167444	/nfs/dbraw/zinc/16/74/44/331167444.db2.gz	QVJPOFVXDIMSKT-CQSZACIVSA-N	0	0	292.810	4.009	20	30		CIEDRN
C=CC(C)(C)CNC(=O)N(C)[C@H](C)c1ccccc1Cl	ZINC000455371489	331167556	/nfs/dbraw/zinc/16/75/56/331167556.db2.gz	SJYHWMUIBZYPAZ-GFCCVEGCSA-N	0	0	294.826	4.255	20	30		CIEDRN
C=CC(C)(C)CNC(=O)N(C)[C@H](C)c1ccc(Cl)cc1	ZINC000455371528	331167564	/nfs/dbraw/zinc/16/75/64/331167564.db2.gz	SMUKILUHJUBRNG-GFCCVEGCSA-N	0	0	294.826	4.255	20	30		CIEDRN
C=C(CC)CNC(=O)N(C)[C@@H](C)c1ccccc1Cl	ZINC000455523125	331171861	/nfs/dbraw/zinc/17/18/61/331171861.db2.gz	NERCPZYJJSWKPE-LBPRGKRZSA-N	0	0	280.799	4.009	20	30		CIEDRN
CC(C)(CNC(=O)Nc1cccc(CC#N)c1)C1CCCC1	ZINC000455907131	331180470	/nfs/dbraw/zinc/18/04/70/331180470.db2.gz	OWPMVXDTWBQURD-UHFFFAOYSA-N	0	0	299.418	4.091	20	30		CIEDRN
CC(C)=CCC[C@H](C)NC(=O)Nc1cccc(CC#N)c1	ZINC000455909244	331180518	/nfs/dbraw/zinc/18/05/18/331180518.db2.gz	RNYNXMAFQUUZLL-AWEZNQCLSA-N	0	0	285.391	4.009	20	30		CIEDRN
CCC[C@@H]1[C@H](C)CCCN1C(=O)Nc1cccc(CC#N)c1	ZINC000455924317	331181314	/nfs/dbraw/zinc/18/13/14/331181314.db2.gz	VNBUXZITSBIFCK-RHSMWYFYSA-N	0	0	299.418	4.185	20	30		CIEDRN
C=CCCCNC(=O)c1ccc([C@H](C)C(F)(F)F)cc1	ZINC000456015641	331182483	/nfs/dbraw/zinc/18/24/83/331182483.db2.gz	AULVWVNEOKHOIT-NSHDSACASA-N	0	0	285.309	4.048	20	30		CIEDRN
C=CCC1(NC(=O)CCC(=O)c2ccccc2)CCCCC1	ZINC000456384096	331191908	/nfs/dbraw/zinc/19/19/08/331191908.db2.gz	PRAXUQZOYFDXPI-UHFFFAOYSA-N	0	0	299.414	4.045	20	30		CIEDRN
C=CCC1(CNC(=O)[C@H](C)c2ccsc2)CCCC1	ZINC000456485083	331193817	/nfs/dbraw/zinc/19/38/17/331193817.db2.gz	JZFLESIEAYQOKL-CYBMUJFWSA-N	0	0	277.433	4.104	20	30		CIEDRN
C=CCC1(CNC(=O)[C@@H](CC)CC(F)(F)F)CCCC1	ZINC000456498538	331194418	/nfs/dbraw/zinc/19/44/18/331194418.db2.gz	ATOFYYWNVNAQFB-LBPRGKRZSA-N	0	0	291.357	4.218	20	30		CIEDRN
Cc1ccccc1[C@@H](C)CC(=O)Nc1cccc(CC#N)c1	ZINC000456739555	331199603	/nfs/dbraw/zinc/19/96/03/331199603.db2.gz	VPAFHARVGDXQRX-HNNXBMFYSA-N	0	0	292.382	4.193	20	30		CIEDRN
N#CCc1cccc(NC(=O)c2ccc(C3CCC3)cc2)c1	ZINC000456745591	331199836	/nfs/dbraw/zinc/19/98/36/331199836.db2.gz	HJMJHGBBUOXRIV-UHFFFAOYSA-N	0	0	290.366	4.272	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)NC[C@H]1CCCC[C@@H]1c1ccccc1	ZINC000456761352	331200890	/nfs/dbraw/zinc/20/08/90/331200890.db2.gz	JNVLALSDVBBXMX-ZHALLVOQSA-N	0	0	298.430	4.016	20	30		CIEDRN
CC(C)(C#N)CC(=O)NC[C@H]1CCCC[C@H]1c1ccccc1	ZINC000456773795	331202541	/nfs/dbraw/zinc/20/25/41/331202541.db2.gz	PMAQCVQEQIUVKD-SJORKVTESA-N	0	0	298.430	4.016	20	30		CIEDRN
CC[C@@H]1CC[C@H](C)N(C(=O)c2ccc(C(C)(C)C#N)cc2)C1	ZINC000456821237	331205723	/nfs/dbraw/zinc/20/57/23/331205723.db2.gz	PELFBOKSUAJIMA-LSDHHAIUSA-N	0	0	298.430	4.138	20	30		CIEDRN
C=C(CC)CNC(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1	ZINC000456828644	331206373	/nfs/dbraw/zinc/20/63/73/331206373.db2.gz	MOSCYYPDJXYQGW-ZWKOTPCHSA-N	0	0	279.383	4.026	20	30		CIEDRN
C=C(CC)CNC(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1	ZINC000456828642	331206387	/nfs/dbraw/zinc/20/63/87/331206387.db2.gz	MOSCYYPDJXYQGW-QZTJIDSGSA-N	0	0	279.383	4.026	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@H]1c1ccc(F)cc1C	ZINC000456844572	331207358	/nfs/dbraw/zinc/20/73/58/331207358.db2.gz	MUVHBIGWJSVAJO-PBHICJAKSA-N	0	0	289.394	4.400	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@H]1c1ccc(F)cc1F	ZINC000456854694	331207567	/nfs/dbraw/zinc/20/75/67/331207567.db2.gz	YUIMMYFKYNIFDE-WBMJQRKESA-N	0	0	293.357	4.231	20	30		CIEDRN
Cc1cc(C#N)cc(NC(=O)c2sccc2C2CC2)c1	ZINC000456970484	331209320	/nfs/dbraw/zinc/20/93/20/331209320.db2.gz	RIJOZDYFBYESMZ-UHFFFAOYSA-N	0	0	282.368	4.058	20	30		CIEDRN
C=CCCC(=O)N[C@@H]1CC[C@@H](c2cccc(Cl)c2)C1	ZINC000457052851	331210925	/nfs/dbraw/zinc/21/09/25/331210925.db2.gz	ATHBGEAVKFXMHU-UKRRQHHQSA-N	0	0	277.795	4.059	20	30		CIEDRN
CC(C)N(C(=O)[C@@H](C)c1cccc(C#N)c1)C1CC(C)(C)C1	ZINC000457069404	331211334	/nfs/dbraw/zinc/21/13/34/331211334.db2.gz	FTTVOHJVFSBZPZ-AWEZNQCLSA-N	0	0	298.430	4.087	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@H](CC(C)(C)C)C2)CCC1	ZINC000457074483	331211479	/nfs/dbraw/zinc/21/14/79/331211479.db2.gz	ILCAHHLVAWJDIV-CQSZACIVSA-N	0	0	263.425	4.018	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)[C@@H](C)C1CCC1	ZINC000457381592	331220587	/nfs/dbraw/zinc/22/05/87/331220587.db2.gz	HODSSNCHLVAOKH-NSHDSACASA-N	0	0	297.851	4.352	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1cnc2ccccc2c1	ZINC000457575059	331227456	/nfs/dbraw/zinc/22/74/56/331227456.db2.gz	KQDWQUDRQSOUMC-UHFFFAOYSA-N	0	0	282.387	4.053	20	30		CIEDRN
C=C(C)[C@@H](NC(=O)[C@H](C)C1CCC1)c1ccc(F)c(F)c1	ZINC000457719249	331232312	/nfs/dbraw/zinc/23/23/12/331232312.db2.gz	QRSZSWBDAOYMBJ-BDJLRTHQSA-N	0	0	293.357	4.134	20	30		CIEDRN
C=CC[C@H]1N(C(=O)[C@@H](C)C2CCC2)CCCC1(C)C	ZINC000457759741	331233524	/nfs/dbraw/zinc/23/35/24/331233524.db2.gz	KFFWWIQDOMABPX-DZGCQCFKSA-N	0	0	263.425	4.016	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1ccc(OC(C)C)cc1Cl	ZINC000457778180	331234148	/nfs/dbraw/zinc/23/41/48/331234148.db2.gz	CWUWCPBILVEGBP-GFCCVEGCSA-N	0	0	295.810	4.212	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)c1[nH]ccc1C1CC1	ZINC000457781122	331234173	/nfs/dbraw/zinc/23/41/73/331234173.db2.gz	XASBPEQGPXMJHZ-UHFFFAOYSA-N	0	0	294.398	4.111	20	30		CIEDRN
CC[C@@H](CC1CCCCC1)C(=O)NCC(C)(C)CC#N	ZINC000457994877	331239941	/nfs/dbraw/zinc/23/99/41/331239941.db2.gz	PBAFRNYLZRDDNA-HNNXBMFYSA-N	0	0	278.440	4.039	20	30		CIEDRN
CCC[C@@H](NC(=O)c1ccc(C(C)(C)C#N)cc1)C1CCC1	ZINC000458330140	331249022	/nfs/dbraw/zinc/24/90/22/331249022.db2.gz	MGVVKMOQISXJJJ-QGZVFWFLSA-N	0	0	298.430	4.186	20	30		CIEDRN
C[C@@H]1CC[C@H](C)N1C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000458797704	331259995	/nfs/dbraw/zinc/25/99/95/331259995.db2.gz	GNXJXCRLRSRKJQ-UXLLHSPISA-N	0	0	299.418	4.004	20	30		CIEDRN
CCN(C(=O)N[C@@H](CCCC#N)c1ccccc1)C1CCC1	ZINC000458804411	331260160	/nfs/dbraw/zinc/26/01/60/331260160.db2.gz	SMEHKKRRMHKYBY-KRWDZBQOSA-N	0	0	299.418	4.006	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@@H](C)c1cccc(C2CC2)c1	ZINC000458874394	331262115	/nfs/dbraw/zinc/26/21/15/331262115.db2.gz	NAKJMQWGAZSXDN-AWEZNQCLSA-N	0	0	286.419	4.233	20	30		CIEDRN
CC(C)[C@@]1(C)C[C@@H]1NC(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000459264869	331274024	/nfs/dbraw/zinc/27/40/24/331274024.db2.gz	ZTBHQOZOZGRWIN-MAUKXSAKSA-N	0	0	299.418	4.044	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)N[C@]2(C)CC=CCC2)cc1	ZINC000459342338	331277188	/nfs/dbraw/zinc/27/71/88/331277188.db2.gz	KNWWDZSFMYBSMI-GOSISDBHSA-N	0	0	297.402	4.108	20	30		CIEDRN
C[C@H](c1ccc(CN[C@@H]2CCC[C@H]2C#N)cc1)C(F)(F)F	ZINC000459451596	331281789	/nfs/dbraw/zinc/28/17/89/331281789.db2.gz	BDZQSYACZFUYQR-BYCMXARLSA-N	0	0	296.336	4.134	20	30		CIEDRN
Cc1cc(NC(=O)NCC(C)(C)CC#N)cc(C)c1Cl	ZINC000459545726	331287059	/nfs/dbraw/zinc/28/70/59/331287059.db2.gz	GTYPAFNEICXHKU-UHFFFAOYSA-N	0	0	293.798	4.018	20	30		CIEDRN
CC1(c2ccccc2)CC(Nc2cccc(CC#N)c2)C1	ZINC000459572315	331288680	/nfs/dbraw/zinc/28/86/80/331288680.db2.gz	PTSFBEHKQUMNKW-UHFFFAOYSA-N	0	0	276.383	4.285	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cc(C)c(Cl)cc1OC	ZINC000459824542	331302238	/nfs/dbraw/zinc/30/22/38/331302238.db2.gz	BQHGABCVGAGTBV-UHFFFAOYSA-N	0	0	281.783	4.198	20	30		CIEDRN
Cc1sc(NC(=O)C(C)(C)C(C)(C)C)c(C#N)c1C	ZINC000459845003	331302551	/nfs/dbraw/zinc/30/25/51/331302551.db2.gz	KVDRQNWVWHFHSI-UHFFFAOYSA-N	0	0	278.421	4.247	20	30		CIEDRN
CC[C@@H]1C[C@H]1C(=O)Nc1sc(-c2ccccc2)cc1C#N	ZINC000460031758	331304547	/nfs/dbraw/zinc/30/45/47/331304547.db2.gz	UWZICAWFIQEUGU-BXUZGUMPSA-N	0	0	296.395	4.271	20	30		CIEDRN
C=CC(C)(C)C(=O)N(Cc1ccccc1)CC1CCC1	ZINC000460035513	331304677	/nfs/dbraw/zinc/30/46/77/331304677.db2.gz	IXSIHGYFFMNYBL-UHFFFAOYSA-N	0	0	271.404	4.028	20	30		CIEDRN
Cc1nn(CC2CCC(c3ccccc3)CC2)cc1C#N	ZINC000461074915	331311009	/nfs/dbraw/zinc/31/10/09/331311009.db2.gz	NBFSIIFRTBOLSW-UHFFFAOYSA-N	0	0	279.387	4.037	20	30		CIEDRN
C=CCCC(=O)N1CC[C@H](Cc2ccc(C(C)C)cc2)C1	ZINC000461189784	331311847	/nfs/dbraw/zinc/31/18/47/331311847.db2.gz	IUSFGSFYXNDDPL-QGZVFWFLSA-N	0	0	285.431	4.167	20	30		CIEDRN
C=C(C)CCSCc1cncc(C(F)(F)F)c1	ZINC000461244490	331311999	/nfs/dbraw/zinc/31/19/99/331311999.db2.gz	KHNRXLMGUKGRIB-UHFFFAOYSA-N	0	0	261.312	4.300	20	30		CIEDRN
C=C(C)CS[C@H](C)C(=O)Nc1ccc(Cl)cc1C	ZINC000461242489	331312043	/nfs/dbraw/zinc/31/20/43/331312043.db2.gz	IEDVFHSMLIPFOW-LLVKDONJSA-N	0	0	283.824	4.285	20	30		CIEDRN
CC[C@H]1CCCN(c2c(C#N)cnc3ccc(Cl)cc32)C1	ZINC000461452763	331313463	/nfs/dbraw/zinc/31/34/63/331313463.db2.gz	JXOWTSHRWLJGLN-LBPRGKRZSA-N	0	0	299.805	4.386	20	30		CIEDRN
CCN(C(=O)CCC1CCCCC1)c1ccc(C#N)cc1	ZINC000461517442	331313709	/nfs/dbraw/zinc/31/37/09/331313709.db2.gz	BEZLQWOMHJMDLN-UHFFFAOYSA-N	0	0	284.403	4.272	20	30		CIEDRN
COc1ccc(CNc2cccc(C3CCC3)c2)cc1C#N	ZINC000461721181	331314078	/nfs/dbraw/zinc/31/40/78/331314078.db2.gz	DCOGVFIHXBOESS-UHFFFAOYSA-N	0	0	292.382	4.446	20	30		CIEDRN
N#Cc1ccccc1CNc1cccc(C2CCC2)c1	ZINC000461721960	331314086	/nfs/dbraw/zinc/31/40/86/331314086.db2.gz	GEVMVIQFRZJYKQ-UHFFFAOYSA-N	0	0	262.356	4.438	20	30		CIEDRN
C[C@@H](c1nc(C2CCCCC2)no1)c1cccc(C#N)c1	ZINC000461789138	331314703	/nfs/dbraw/zinc/31/47/03/331314703.db2.gz	BUROFUDBLQXYPB-GFCCVEGCSA-N	0	0	281.359	4.141	20	30		CIEDRN
Cc1ccc(NC(=O)[C@@H](C)c2cccc(C#N)c2)cc1Cl	ZINC000461788784	331314709	/nfs/dbraw/zinc/31/47/09/331314709.db2.gz	LDNKOIDGCCPVHY-LBPRGKRZSA-N	0	0	298.773	4.262	20	30		CIEDRN
Cc1cc(Cl)c2ncc(C#N)c(NCCCCF)c2c1	ZINC000461865381	331314929	/nfs/dbraw/zinc/31/49/29/331314929.db2.gz	LYATUVXCGIZKMW-UHFFFAOYSA-N	0	0	291.757	4.230	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1c(C)cccc1F	ZINC000461927341	331315511	/nfs/dbraw/zinc/31/55/11/331315511.db2.gz	UFNPVIKLYJDZGO-GFCCVEGCSA-N	0	0	264.344	4.000	20	30		CIEDRN
CC[C@H](Cc1ccc(C)cc1)Nc1ccc(CC#N)cc1	ZINC000462066871	331317124	/nfs/dbraw/zinc/31/71/24/331317124.db2.gz	VPTCKSSWLMPSHG-GOSISDBHSA-N	0	0	278.399	4.494	20	30		CIEDRN
CC[C@@H](C)[C@@H](NC(=O)CCCC#N)c1ccc(Cl)cc1	ZINC000462139480	331317399	/nfs/dbraw/zinc/31/73/99/331317399.db2.gz	KFZJKOQLXALFME-MLGOLLRUSA-N	0	0	292.810	4.237	20	30		CIEDRN
CC[C@@H](C)[C@H](NC(=O)CCCC#N)c1ccc(Cl)cc1	ZINC000462139481	331317434	/nfs/dbraw/zinc/31/74/34/331317434.db2.gz	KFZJKOQLXALFME-WBMJQRKESA-N	0	0	292.810	4.237	20	30		CIEDRN
C[C@@H](C(=O)N(C)C1CCC(C)(C)CC1)c1cccc(C#N)c1	ZINC000462190911	331318220	/nfs/dbraw/zinc/31/82/20/331318220.db2.gz	PSABLMIUBOFZLS-CQSZACIVSA-N	0	0	298.430	4.089	20	30		CIEDRN
Cc1ccc(NCCOc2cccc(C#N)c2)cc1Cl	ZINC000462223378	331318681	/nfs/dbraw/zinc/31/86/81/331318681.db2.gz	PBFDFMQZMWTWAX-UHFFFAOYSA-N	0	0	286.762	4.011	20	30		CIEDRN
CCCCC[C@@H]1CCCN1C(=O)[C@H](C)c1cccc(C#N)c1	ZINC000462256424	331318782	/nfs/dbraw/zinc/31/87/82/331318782.db2.gz	SSIWQVOMKBKWSI-CRAIPNDOSA-N	0	0	298.430	4.233	20	30		CIEDRN
CC#CCCSCc1coc(-c2c(F)cccc2F)n1	ZINC000462373794	331320825	/nfs/dbraw/zinc/32/08/25/331320825.db2.gz	RKKPNGJIJFHLGZ-UHFFFAOYSA-N	0	0	293.338	4.266	20	30		CIEDRN
CC#CCCSCc1nc(C(C)(C)C)cs1	ZINC000462375786	331320937	/nfs/dbraw/zinc/32/09/37/331320937.db2.gz	HDHCCCNDPQHCKH-UHFFFAOYSA-N	0	0	253.436	4.087	20	30		CIEDRN
CC(C)C[C@@H](C)C(=O)Nc1sc2c(c1C#N)CCCC2	ZINC000462382612	331321110	/nfs/dbraw/zinc/32/11/10/331321110.db2.gz	BUNHNLOXBRELSJ-LLVKDONJSA-N	0	0	290.432	4.119	20	30		CIEDRN
CC#CCCSc1ccc(C#N)c(C(F)(F)F)c1	ZINC000462399924	331321388	/nfs/dbraw/zinc/32/13/88/331321388.db2.gz	XCSNMUQMQWIMTL-UHFFFAOYSA-N	0	0	269.291	4.083	20	30		CIEDRN
C/C=C/c1ccc(NC(=O)[C@H](C)c2cccc(C#N)c2)cc1	ZINC000462475602	331322654	/nfs/dbraw/zinc/32/26/54/331322654.db2.gz	PJYVZTYCFFMXQE-LYKUJDHUSA-N	0	0	290.366	4.334	20	30		CIEDRN
CC1(C)CCN(c2c(C#N)cnc3ccc(Cl)cc32)CC1	ZINC000462803526	331329915	/nfs/dbraw/zinc/32/99/15/331329915.db2.gz	KDCMXWKVGWYMAL-UHFFFAOYSA-N	0	0	299.805	4.386	20	30		CIEDRN
N#Cc1cc(F)ccc1N1CCC[C@H](Cc2ccccc2)C1	ZINC000462820632	331331055	/nfs/dbraw/zinc/33/10/55/331331055.db2.gz	ORBRJYDWZAVWKY-MRXNPFEDSA-N	0	0	294.373	4.156	20	30		CIEDRN
Cc1cc(C)c2ncc(C#N)c(N3Cc4ccccc4C3)c2c1	ZINC000462827800	331331653	/nfs/dbraw/zinc/33/16/53/331331653.db2.gz	ZOJPHHOECHGDRW-UHFFFAOYSA-N	0	0	299.377	4.244	20	30		CIEDRN
C=CC1CCN(c2c(C#N)cnc3c(C)cc(C)cc32)CC1	ZINC000462847119	331332555	/nfs/dbraw/zinc/33/25/55/331332555.db2.gz	VTYOQJJDIVMFKB-UHFFFAOYSA-N	0	0	291.398	4.126	20	30		CIEDRN
C[C@@H]1C[C@@H](c2ccccc2)CN1c1ccc(F)cc1C#N	ZINC000462846635	331332575	/nfs/dbraw/zinc/33/25/75/331332575.db2.gz	BPNGEKBXUQMBHB-CZUORRHYSA-N	0	0	280.346	4.080	20	30		CIEDRN
C=C1CCN(c2nc3cc(C(F)(F)F)ccc3s2)CC1	ZINC000462845295	331332603	/nfs/dbraw/zinc/33/26/03/331332603.db2.gz	KXJKJYRDJBIWNE-UHFFFAOYSA-N	0	0	298.333	4.472	20	30		CIEDRN
N#Cc1ccc(Cl)cc1N1CC[C@@H](Cc2ccccc2)C1	ZINC000462854600	331332732	/nfs/dbraw/zinc/33/27/32/331332732.db2.gz	MFRHRONKQJQZPU-HNNXBMFYSA-N	0	0	296.801	4.281	20	30		CIEDRN
Cc1cccc2c(CCNc3ccc(F)cc3C#N)c[nH]c21	ZINC000462859905	331332875	/nfs/dbraw/zinc/33/28/75/331332875.db2.gz	MTKGVJKPPNZAAL-UHFFFAOYSA-N	0	0	293.345	4.142	20	30		CIEDRN
C[C@@H]1C[C@H](c2ccc(F)cc2)CN1c1ccc(F)cc1C#N	ZINC000462857557	331332950	/nfs/dbraw/zinc/33/29/50/331332950.db2.gz	SRWHLOCXEYHCML-DOMZBBRYSA-N	0	0	298.336	4.219	20	30		CIEDRN
C=C[C@H](C)NC(=O)Nc1c(C)cc(Cl)c2ccccc21	ZINC000462868225	331333120	/nfs/dbraw/zinc/33/31/20/331333120.db2.gz	AOJMELCSHZVCDB-NSHDSACASA-N	0	0	288.778	4.498	20	30		CIEDRN
N#Cc1cc(Cl)ccc1N1CC[C@@H](Cc2ccccc2)C1	ZINC000462867836	331333137	/nfs/dbraw/zinc/33/31/37/331333137.db2.gz	MRCKEQYVVIWZFC-HNNXBMFYSA-N	0	0	296.801	4.281	20	30		CIEDRN
N#Cc1ccc(CNc2cccc(C3CCC3)c2)s1	ZINC000462872115	331333469	/nfs/dbraw/zinc/33/34/69/331333469.db2.gz	CSOWJNFSJIXRSQ-UHFFFAOYSA-N	0	0	268.385	4.499	20	30		CIEDRN
C=CCNC(=O)Nc1c(C)cc(Cl)c2ccccc21	ZINC000462878992	331333798	/nfs/dbraw/zinc/33/37/98/331333798.db2.gz	VVNFSYRUGYHDLE-UHFFFAOYSA-N	0	0	274.751	4.109	20	30		CIEDRN
C[C@H](CNc1c(F)cc(C#N)cc1F)Cc1cccs1	ZINC000462894889	331334156	/nfs/dbraw/zinc/33/41/56/331334156.db2.gz	JWIOMORRTHRNJX-JTQLQIEISA-N	0	0	292.354	4.189	20	30		CIEDRN
N#Cc1c(F)cccc1N[C@@H]1CC[C@@H]2CCC[C@H]2C1	ZINC000462902734	331334454	/nfs/dbraw/zinc/33/44/54/331334454.db2.gz	PNCMJUOIFAETNH-RWMBFGLXSA-N	0	0	258.340	4.078	20	30		CIEDRN
C[C@H]1CN(c2ccc(C#N)cc2)CC[C@H]1c1ccccc1	ZINC000462910998	331334771	/nfs/dbraw/zinc/33/47/71/331334771.db2.gz	LYHZEQISRQNSBB-HNAYVOBHSA-N	0	0	276.383	4.188	20	30		CIEDRN
C[C@@H]1CN(c2ccc(C#N)cc2)CC[C@@H]1c1ccccc1	ZINC000462910996	331334800	/nfs/dbraw/zinc/33/48/00/331334800.db2.gz	LYHZEQISRQNSBB-BEFAXECRSA-N	0	0	276.383	4.188	20	30		CIEDRN
CN(Cc1ccccc1C#N)[C@H]1CCCC[C@H]1C(F)(F)F	ZINC000463033002	331337829	/nfs/dbraw/zinc/33/78/29/331337829.db2.gz	AEMFNWMYHMRJSU-CABCVRRESA-N	0	0	296.336	4.111	20	30		CIEDRN
C[C@H](c1nc(CC2CCCCC2)no1)c1cccc(C#N)c1	ZINC000463041545	331338203	/nfs/dbraw/zinc/33/82/03/331338203.db2.gz	GFQRVKBVIUUIEP-ZDUSSCGKSA-N	0	0	295.386	4.216	20	30		CIEDRN
CCC1(c2noc([C@H](C)c3cccc(C#N)c3)n2)CCCC1	ZINC000463054667	331338793	/nfs/dbraw/zinc/33/87/93/331338793.db2.gz	MOKUPSHYMPAVAZ-CYBMUJFWSA-N	0	0	295.386	4.315	20	30		CIEDRN
Cc1ccc([C@H]2CCC[C@@H]2N(C)c2ncccc2C#N)cc1	ZINC000463070482	331339324	/nfs/dbraw/zinc/33/93/24/331339324.db2.gz	NYTBROFUTLNHLR-MSOLQXFVSA-N	0	0	291.398	4.034	20	30		CIEDRN
Cc1ccc([C@@H]2CCC[C@@H]2N(C)c2ncccc2C#N)cc1	ZINC000463070484	331339326	/nfs/dbraw/zinc/33/93/26/331339326.db2.gz	NYTBROFUTLNHLR-ROUUACIJSA-N	0	0	291.398	4.034	20	30		CIEDRN
C[C@@H](CNc1ccc(C#N)cc1)Oc1cccc(Cl)c1	ZINC000463070566	331339334	/nfs/dbraw/zinc/33/93/34/331339334.db2.gz	OMSSDQHMBWAETC-LBPRGKRZSA-N	0	0	286.762	4.091	20	30		CIEDRN
C[C@H](CNc1ccc(F)cc1C#N)Sc1ccccc1	ZINC000463077121	331339674	/nfs/dbraw/zinc/33/96/74/331339674.db2.gz	FSXXQSPMRUIYPW-GFCCVEGCSA-N	0	0	286.375	4.290	20	30		CIEDRN
CC1(C)CC(Cc2noc(/C=C\c3ccc(C#N)cc3)n2)C1	ZINC000463185509	331341699	/nfs/dbraw/zinc/34/16/99/331341699.db2.gz	XJYVOYAHCGBUPW-FPLPWBNLSA-N	0	0	293.370	4.090	20	30		CIEDRN
CCc1ccc(N[C@H]2CCC[C@H](C#N)C2)cc1CC	ZINC000463236539	331343547	/nfs/dbraw/zinc/34/35/47/331343547.db2.gz	LLCMGBOHZHEZQF-BBRMVZONSA-N	0	0	256.393	4.306	20	30		CIEDRN
C=CCN(CC=C)C(=O)C1CCC(c2ccccc2)CC1	ZINC000463239438	331343671	/nfs/dbraw/zinc/34/36/71/331343671.db2.gz	WNHXEOABXOUSTF-UHFFFAOYSA-N	0	0	283.415	4.161	20	30		CIEDRN
CCCCN1CCc2ccc(N[C@H]3CCC[C@@H](C#N)C3)cc21	ZINC000463243355	331343994	/nfs/dbraw/zinc/34/39/94/331343994.db2.gz	PHDRJLKEYKFGNU-WBVHZDCISA-N	0	0	297.446	4.343	20	30		CIEDRN
Cc1ccc(N[C@H]2CCC[C@@H](C#N)C2)c(Br)c1	ZINC000463288412	331345226	/nfs/dbraw/zinc/34/52/26/331345226.db2.gz	OYOQOCCKQOKXQQ-NEPJUHHUSA-N	0	0	293.208	4.252	20	30		CIEDRN
Cc1ccc(N[C@@H]2CCC[C@@H](C#N)C2)cc1Br	ZINC000463288254	331345270	/nfs/dbraw/zinc/34/52/70/331345270.db2.gz	ZSRLMOWSSFCNAU-VXGBXAGGSA-N	0	0	293.208	4.252	20	30		CIEDRN
Cc1ccc(N[C@H]2CCC[C@H](C#N)C2)cc1Br	ZINC000463288253	331345349	/nfs/dbraw/zinc/34/53/49/331345349.db2.gz	ZSRLMOWSSFCNAU-RYUDHWBXSA-N	0	0	293.208	4.252	20	30		CIEDRN
Cc1ccc([C@H](C)Nc2ccc([N+](=O)[O-])c(C#N)c2)c(C)c1	ZINC000463420325	331347346	/nfs/dbraw/zinc/34/73/46/331347346.db2.gz	QVIVGKGBMCELBS-ZDUSSCGKSA-N	0	0	295.342	4.256	20	30		CIEDRN
CCN(C(=O)[C@H](C)c1cccc(C#N)c1)[C@@H]1CCCC[C@H]1C	ZINC000463716949	331350849	/nfs/dbraw/zinc/35/08/49/331350849.db2.gz	SWQDLLVPYIOHGZ-IIDMSEBBSA-N	0	0	298.430	4.089	20	30		CIEDRN
CCN(C(=O)[C@H](C)c1cccc(C#N)c1)[C@@H]1CCCC[C@@H]1C	ZINC000463716948	331350932	/nfs/dbraw/zinc/35/09/32/331350932.db2.gz	SWQDLLVPYIOHGZ-HDMKZQKVSA-N	0	0	298.430	4.089	20	30		CIEDRN
C=CCN(CC=C)C(=O)Nc1cccc(C2CCC2)c1	ZINC000463824058	331352115	/nfs/dbraw/zinc/35/21/15/331352115.db2.gz	JRQDVCORBIDFIE-UHFFFAOYSA-N	0	0	270.376	4.160	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)c1cccc2cc[nH]c21	ZINC000463836272	331352340	/nfs/dbraw/zinc/35/23/40/331352340.db2.gz	IAAJKUDTENGBKB-UHFFFAOYSA-N	0	0	296.414	4.376	20	30		CIEDRN
CC[C@H](C)[C@H](C)N(C(=O)[C@@H](C)c1cccc(C#N)c1)C1CC1	ZINC000463941092	331354208	/nfs/dbraw/zinc/35/42/08/331354208.db2.gz	DCDYDYCHRKSBSB-KKUMJFAQSA-N	0	0	298.430	4.087	20	30		CIEDRN
FC(F)(F)CCSCC#Cc1cccc(Cl)c1	ZINC000464086828	331356596	/nfs/dbraw/zinc/35/65/96/331356596.db2.gz	XIVMCHIRQXKWJL-UHFFFAOYSA-N	0	0	278.726	4.377	20	30		CIEDRN
CCCC[C@@H](CC)CC(=O)N[C@](C)(C#N)C(C)(C)C	ZINC000464155347	331356861	/nfs/dbraw/zinc/35/68/61/331356861.db2.gz	CUWLCPBIJNACMP-CZUORRHYSA-N	0	0	266.429	4.037	20	30		CIEDRN
C=CCCC(=O)Nc1ccc2nc(C(C)(C)C)sc2c1	ZINC000464150426	331357158	/nfs/dbraw/zinc/35/71/58/331357158.db2.gz	KONPREBFEVULAG-UHFFFAOYSA-N	0	0	288.416	4.499	20	30		CIEDRN
CC[C@H](CC(=O)N[C@@](C)(C#N)C(C)(C)C)c1ccccc1	ZINC000464160575	331357260	/nfs/dbraw/zinc/35/72/60/331357260.db2.gz	XFKDDGGUSDLMRQ-KDOFPFPSSA-N	0	0	286.419	4.015	20	30		CIEDRN
CC(C)(C)[C@@](C)(C#N)NC(=O)C[C@H]1CCCC(C)(C)C1	ZINC000464165600	331357416	/nfs/dbraw/zinc/35/74/16/331357416.db2.gz	FVNWGJKHRNBKOC-CXAGYDPISA-N	0	0	278.440	4.037	20	30		CIEDRN
CCC[C@@H]1C[C@H]1C(=O)N(CC)c1ccc(C#N)c(Cl)c1	ZINC000464188682	331357737	/nfs/dbraw/zinc/35/77/37/331357737.db2.gz	FUNBGIGTKFJGOH-BXUZGUMPSA-N	0	0	290.794	4.001	20	30		CIEDRN
CCC(C)(C)[C@@H]1CCCN1C(=O)[C@H](C)c1cccc(C#N)c1	ZINC000464213355	331358109	/nfs/dbraw/zinc/35/81/09/331358109.db2.gz	XLKNPWZDNZTHDO-PBHICJAKSA-N	0	0	298.430	4.089	20	30		CIEDRN
CCCC[C@@H](CC)C(=O)N(C)c1cc(Cl)ccc1C#N	ZINC000464271215	331359028	/nfs/dbraw/zinc/35/90/28/331359028.db2.gz	IMQUSRCHNNVFAI-GFCCVEGCSA-N	0	0	292.810	4.391	20	30		CIEDRN
CCC[C@H](CC1CCCCC1)C(=O)N[C@@H](C#N)C(C)C	ZINC000464297512	331359349	/nfs/dbraw/zinc/35/93/49/331359349.db2.gz	ALFWKPAXHVQWSI-CVEARBPZSA-N	0	0	278.440	4.037	20	30		CIEDRN
C=CCC[C@@H](NC(=O)N1CC(C)(CC)C1)c1ccccc1	ZINC000464383108	331360107	/nfs/dbraw/zinc/36/01/07/331360107.db2.gz	LTMMHEZQLSSVNZ-MRXNPFEDSA-N	0	0	286.419	4.135	20	30		CIEDRN
CCC(CC)C(=O)N[C@H](C#N)c1c(Cl)cccc1Cl	ZINC000464395804	331360149	/nfs/dbraw/zinc/36/01/49/331360149.db2.gz	FZMSNFOKYVRFIW-GFCCVEGCSA-N	0	0	299.201	4.110	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(Oc2ccccc2)cn1	ZINC000464435929	331360478	/nfs/dbraw/zinc/36/04/78/331360478.db2.gz	AYAKIOBKEMKIIX-AWEZNQCLSA-N	0	0	296.370	4.415	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C1CC1)C1CCC(C)CC1	ZINC000464435136	331360500	/nfs/dbraw/zinc/36/05/00/331360500.db2.gz	BYMCTYJTWQNCHX-SHARSMKWSA-N	0	0	263.425	4.158	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H]1CCCC[C@@H]1Cc1ccccc1	ZINC000464435133	331360510	/nfs/dbraw/zinc/36/05/10/331360510.db2.gz	BWWPRQPGAHGIKT-RTBURBONSA-N	0	0	297.442	4.098	20	30		CIEDRN
CC#CCCCC(=O)N(CC)c1cccc2ccccc21	ZINC000464437188	331360561	/nfs/dbraw/zinc/36/05/61/331360561.db2.gz	NUJDLIQXMCGGQP-UHFFFAOYSA-N	0	0	279.383	4.386	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(C)c(OCC(F)F)c1	ZINC000464438187	331360562	/nfs/dbraw/zinc/36/05/62/331360562.db2.gz	PRMCHCLEKGDCBB-GFCCVEGCSA-N	0	0	297.345	4.180	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NC(C)(C)Cc1ccccc1Cl	ZINC000464442071	331360806	/nfs/dbraw/zinc/36/08/06/331360806.db2.gz	MUMHEERKGVGKKB-CYBMUJFWSA-N	0	0	293.838	4.380	20	30		CIEDRN
C=C(C)[C@H](NC(=O)C(CC)CC)c1ccc(F)c(F)c1	ZINC000464447744	331360894	/nfs/dbraw/zinc/36/08/94/331360894.db2.gz	MGNNYOOEVLBUQF-HNNXBMFYSA-N	0	0	281.346	4.134	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1nc2c(cccc2C)s1	ZINC000464554504	331361891	/nfs/dbraw/zinc/36/18/91/331361891.db2.gz	MJNMXRRHPMZRKI-LLVKDONJSA-N	0	0	274.389	4.146	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@H](C)c1ccc(C)cc1C	ZINC000464528879	331361906	/nfs/dbraw/zinc/36/19/06/331361906.db2.gz	UQIYRBYPENIAGQ-HZPDHXFCSA-N	0	0	273.420	4.425	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCCSc1ccc(Cl)cc1	ZINC000464536505	331362048	/nfs/dbraw/zinc/36/20/48/331362048.db2.gz	SZMUSVPZFDBZOI-GFCCVEGCSA-N	0	0	297.851	4.151	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCSc2ccc(Cl)cc21	ZINC000464547049	331362310	/nfs/dbraw/zinc/36/23/10/331362310.db2.gz	UCASUMSDXOZTTA-LLVKDONJSA-N	0	0	295.835	4.381	20	30		CIEDRN
CC#CCCCC(=O)N(CCc1ccccc1)C1CCCC1	ZINC000464553528	331362361	/nfs/dbraw/zinc/36/23/61/331362361.db2.gz	JIAWBPOHHYQIAV-UHFFFAOYSA-N	0	0	297.442	4.194	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cccc2ccccc21	ZINC000464554530	331362447	/nfs/dbraw/zinc/36/24/47/331362447.db2.gz	MRZAETBGTUWTAX-ZDUSSCGKSA-N	0	0	253.345	4.381	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@H](C)c1c(F)cccc1F	ZINC000464558788	331362520	/nfs/dbraw/zinc/36/25/20/331362520.db2.gz	HAPNEZYATUZBMI-VXGBXAGGSA-N	0	0	281.346	4.087	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccc(OC(C)C)c(Cl)c1	ZINC000464555799	331362530	/nfs/dbraw/zinc/36/25/30/331362530.db2.gz	VGGZTBIUEIUIKS-UHFFFAOYSA-N	0	0	293.794	4.259	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CC[C@H]2CCCC[C@@H]2C1	ZINC000464561346	331362566	/nfs/dbraw/zinc/36/25/66/331362566.db2.gz	TUUYPFASDBHXRX-ZJIFWQFVSA-N	0	0	263.425	4.064	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCCCC1CCCCC1	ZINC000464566129	331362685	/nfs/dbraw/zinc/36/26/85/331362685.db2.gz	DFOWYKZZCVJWBN-CQSZACIVSA-N	0	0	251.414	4.065	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccc(C(C)(C)C)cc1	ZINC000464566755	331362790	/nfs/dbraw/zinc/36/27/90/331362790.db2.gz	BSGAZIWAIKVJEH-UHFFFAOYSA-N	0	0	257.377	4.116	20	30		CIEDRN
N#CCCCCN1CCc2c1cccc2-c1ccccc1	ZINC000464573161	331362903	/nfs/dbraw/zinc/36/29/03/331362903.db2.gz	UEFUCZBMYLBFPH-UHFFFAOYSA-N	0	0	276.383	4.410	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cccc(OCCC)c1	ZINC000464574316	331362990	/nfs/dbraw/zinc/36/29/90/331362990.db2.gz	YFRHPQJLGDKVTM-ZDUSSCGKSA-N	0	0	261.365	4.016	20	30		CIEDRN
Cc1ccc(/C=C\CC(=O)Nc2ccc(C#N)c(F)c2)cc1	ZINC000464635299	331364032	/nfs/dbraw/zinc/36/40/32/331364032.db2.gz	CVSKUJNLIRJHHA-IHWYPQMZSA-N	0	0	294.329	4.048	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](C)c1ccccc1C(F)(F)F	ZINC000464651154	331364178	/nfs/dbraw/zinc/36/41/78/331364178.db2.gz	CWYSBDVORHVPKI-NWDGAFQWSA-N	0	0	299.336	4.485	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](C)CC(C)(C)c1ccccc1	ZINC000464649689	331364231	/nfs/dbraw/zinc/36/42/31/331364231.db2.gz	OBFLDALUDFVXRD-HOTGVXAUSA-N	0	0	287.447	4.461	20	30		CIEDRN
Cc1ccccc1[C@H](C)CC(=O)Nc1ccc(C#N)c(F)c1	ZINC000464655192	331364295	/nfs/dbraw/zinc/36/42/95/331364295.db2.gz	NFIUVKNUYJOIAO-CYBMUJFWSA-N	0	0	296.345	4.138	20	30		CIEDRN
CC[C@@H](CC1CCCCC1)C(=O)N[C@H](C#N)C(C)(C)C	ZINC000464706914	331364962	/nfs/dbraw/zinc/36/49/62/331364962.db2.gz	FFTSMTKRTXUFKV-LSDHHAIUSA-N	0	0	278.440	4.037	20	30		CIEDRN
CC(C)(C)[C@H](C#N)NC(=O)c1ccc(C2CCCCC2)cc1	ZINC000464714896	331365156	/nfs/dbraw/zinc/36/51/56/331365156.db2.gz	WVUUIAJDYYNSTK-KRWDZBQOSA-N	0	0	298.430	4.402	20	30		CIEDRN
C=C[C@@H](C)NC(=O)N(CCCC)Cc1ccccc1Cl	ZINC000464754128	331366241	/nfs/dbraw/zinc/36/62/41/331366241.db2.gz	VQVHQFHXFICRQZ-CYBMUJFWSA-N	0	0	294.826	4.226	20	30		CIEDRN
C[C@H](c1ccc(-c2ccccc2)cc1)N(C)CCC#N	ZINC000464759530	331366556	/nfs/dbraw/zinc/36/65/56/331366556.db2.gz	VXRJZKFIGCGNHH-OAHLLOKOSA-N	0	0	264.372	4.260	20	30		CIEDRN
CCC[C@H](C)CC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1	ZINC000464952487	331374370	/nfs/dbraw/zinc/37/43/70/331374370.db2.gz	OBWLNWOOZOKDSR-CGTJXYLNSA-N	0	0	298.430	4.111	20	30		CIEDRN
C=C[C@@H](C)NC(=O)c1cc(-c2ccc(F)cc2)c(C)s1	ZINC000465106570	331378495	/nfs/dbraw/zinc/37/84/95/331378495.db2.gz	FEENMSBUIDDILO-SNVBAGLBSA-N	0	0	289.375	4.167	20	30		CIEDRN
C=C[C@H](C)NC(=O)CCCc1ccc(Cl)c(Cl)c1	ZINC000465108132	331378656	/nfs/dbraw/zinc/37/86/56/331378656.db2.gz	JWJCDBVWUINVJG-JTQLQIEISA-N	0	0	286.202	4.007	20	30		CIEDRN
C=C[C@@H](C)NC(=O)c1oc2c(ccc3ccccc23)c1C	ZINC000465147129	331379579	/nfs/dbraw/zinc/37/95/79/331379579.db2.gz	FBGQPAZRSUMXQK-LLVKDONJSA-N	0	0	279.339	4.199	20	30		CIEDRN
C=C[C@H](C)NC(=O)Nc1ccccc1SC1CCCC1	ZINC000465160535	331379800	/nfs/dbraw/zinc/37/98/00/331379800.db2.gz	ZZXROUHJDBZAFA-LBPRGKRZSA-N	0	0	290.432	4.417	20	30		CIEDRN
C=C[C@H](C)NC(=O)Nc1c(CC)ccc(Cl)c1CC	ZINC000465178586	331380174	/nfs/dbraw/zinc/38/01/74/331380174.db2.gz	UJBIGZXAIVFHLI-JTQLQIEISA-N	0	0	280.799	4.161	20	30		CIEDRN
C=C[C@@H](C)NC(=O)Nc1ccccc1Oc1ccccc1	ZINC000465179670	331380301	/nfs/dbraw/zinc/38/03/01/331380301.db2.gz	QVCSSCROYMMBDZ-CYBMUJFWSA-N	0	0	282.343	4.175	20	30		CIEDRN
C=C[C@@H](C)NC(=O)Nc1cccc(-c2ccccc2OC)c1	ZINC000465246726	331380831	/nfs/dbraw/zinc/38/08/31/331380831.db2.gz	OXPANKCXXNROPC-CYBMUJFWSA-N	0	0	296.370	4.058	20	30		CIEDRN
C=C[C@H](C)NC(=O)Nc1ccc(OC2CCCCC2)cc1	ZINC000465247631	331380870	/nfs/dbraw/zinc/38/08/70/331380870.db2.gz	AFVCHWDJMLLMCI-ZDUSSCGKSA-N	0	0	288.391	4.094	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)c1cccc(NCC(C)(C)C)c1C	ZINC000465432650	331383019	/nfs/dbraw/zinc/38/30/19/331383019.db2.gz	YLBBNMPIVTZMLV-CYBMUJFWSA-N	0	0	288.435	4.147	20	30		CIEDRN
C=CCCCCCN(C)C(=O)N[C@@H](C)C[C@@H](C)CC	ZINC000466175269	331390625	/nfs/dbraw/zinc/39/06/25/331390625.db2.gz	YNZJPEDMWQDNSF-GJZGRUSLSA-N	0	0	268.445	4.199	20	30		CIEDRN
C[C@@H]1CCC[C@@](C#N)(NC(=O)c2cccc3ccsc32)C1	ZINC000466234778	331391381	/nfs/dbraw/zinc/39/13/81/331391381.db2.gz	HIAUISNVURDGBM-SJKOYZFVSA-N	0	0	298.411	4.104	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccnc(-c2ccccc2)c1	ZINC000466246618	331391579	/nfs/dbraw/zinc/39/15/79/331391579.db2.gz	LTSXMEXFBSSRCZ-CQSZACIVSA-N	0	0	280.371	4.289	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(F)cc1OC(C)C	ZINC000466262813	331391771	/nfs/dbraw/zinc/39/17/71/331391771.db2.gz	VDQUCCZVLCCHFQ-GFCCVEGCSA-N	0	0	279.355	4.154	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CC=C(c2ccc(CC)cc2)CC1	ZINC000466267160	331391919	/nfs/dbraw/zinc/39/19/19/331391919.db2.gz	WREARRPKLIQFCW-MRXNPFEDSA-N	0	0	297.442	4.467	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(CC(=C)C)Cc1ccccc1	ZINC000466323970	331392813	/nfs/dbraw/zinc/39/28/13/331392813.db2.gz	CGUBTKSLBZNRKW-KRWDZBQOSA-N	0	0	286.419	4.129	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(CC1CCCCC1)C1CC1	ZINC000466326437	331392915	/nfs/dbraw/zinc/39/29/15/331392915.db2.gz	RRGXRGSUBULAEC-HNNXBMFYSA-N	0	0	278.440	4.095	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)NCC(CC)(CC)c1ccccc1	ZINC000466355039	331393229	/nfs/dbraw/zinc/39/32/29/331393229.db2.gz	FJZHUPIRDAUFSX-OAHLLOKOSA-N	0	0	288.435	4.008	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(C)[C@H](C)c1cccc(Cl)c1	ZINC000466366864	331393659	/nfs/dbraw/zinc/39/36/59/331393659.db2.gz	MJNAYHJLVZVSOG-IUODEOHRSA-N	0	0	294.826	4.397	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N[C@H](C)c1ccc(SC)cc1	ZINC000466367485	331393669	/nfs/dbraw/zinc/39/36/69/331393669.db2.gz	VNEBIIMAMDIMCT-OCCSQVGLSA-N	0	0	292.448	4.123	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(C)[C@@H](CC)Cc1ccccc1	ZINC000466367053	331393674	/nfs/dbraw/zinc/39/36/74/331393674.db2.gz	OVACJWDQFVUSQI-IRXDYDNUSA-N	0	0	288.435	4.004	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N[C@H](CC(C)(C)C)C(F)(F)F	ZINC000466379476	331394016	/nfs/dbraw/zinc/39/40/16/331394016.db2.gz	DHXLJQDBADWCNM-WDEREUQCSA-N	0	0	294.361	4.007	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(Cc1cccc(F)c1)C(C)C	ZINC000466379023	331394029	/nfs/dbraw/zinc/39/40/29/331394029.db2.gz	UUXSJSMQYJGDDK-MRXNPFEDSA-N	0	0	292.398	4.100	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CCc2sccc2[C@H]1CC	ZINC000466382441	331394130	/nfs/dbraw/zinc/39/41/30/331394130.db2.gz	GVEFOIGSWXOCLF-GXTWGEPZSA-N	0	0	292.448	4.122	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(CC)Cc1ccc(Cl)cc1	ZINC000466383343	331394207	/nfs/dbraw/zinc/39/42/07/331394207.db2.gz	PMWTWUPQYMKSRE-HNNXBMFYSA-N	0	0	294.826	4.226	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000466384527	331394245	/nfs/dbraw/zinc/39/42/45/331394245.db2.gz	YDMAOMSNWVEQLM-UHFFFAOYSA-N	0	0	280.371	4.393	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N1CCC[C@H]1C1CCCCC1	ZINC000466385878	331394284	/nfs/dbraw/zinc/39/42/84/331394284.db2.gz	LAOZUUGEHWYQDB-CVEARBPZSA-N	0	0	278.440	4.095	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(C)Cc1cccc2ccccc21	ZINC000466383554	331394305	/nfs/dbraw/zinc/39/43/05/331394305.db2.gz	RCPBQMVTTDHHJR-QGZVFWFLSA-N	0	0	296.414	4.336	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(C)[C@@H](C)c1ccc(C)cc1C	ZINC000466389932	331394498	/nfs/dbraw/zinc/39/44/98/331394498.db2.gz	RZGCFQRPGNTIOI-HOTGVXAUSA-N	0	0	288.435	4.361	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(CCC)CCc1cccs1	ZINC000466398490	331394867	/nfs/dbraw/zinc/39/48/67/331394867.db2.gz	XSZVRWCHJNPYMA-CQSZACIVSA-N	0	0	294.464	4.067	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N1CCCCC[C@H]1c1ccco1	ZINC000466405169	331395317	/nfs/dbraw/zinc/39/53/17/331395317.db2.gz	FRCWEBYONIMQRG-CABCVRRESA-N	0	0	290.407	4.261	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1ccc(C)cc1Cl	ZINC000466404235	331395354	/nfs/dbraw/zinc/39/53/54/331395354.db2.gz	BGYXLLWCQNAMEX-NSHDSACASA-N	0	0	266.772	4.125	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CCC[C@H]1c1cccc(C)c1	ZINC000466406330	331395450	/nfs/dbraw/zinc/39/54/50/331395450.db2.gz	SYOPZSODSXJPGQ-IRXDYDNUSA-N	0	0	286.419	4.196	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(CC1CC1)C1CCCCC1	ZINC000466409378	331395557	/nfs/dbraw/zinc/39/55/57/331395557.db2.gz	XCDZMKCLLMSOBC-HNNXBMFYSA-N	0	0	278.440	4.095	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)[C@H]1C[C@@]1(C)CC	ZINC000466414479	331395787	/nfs/dbraw/zinc/39/57/87/331395787.db2.gz	JYOXKBBNIDKMGH-IUODEOHRSA-N	0	0	297.851	4.352	20	30		CIEDRN
CC#CCCCC(=O)N(c1ccc(Cl)cc1)C(C)C	ZINC000466416718	331395958	/nfs/dbraw/zinc/39/59/58/331395958.db2.gz	LMYQOBYOCXFJTK-UHFFFAOYSA-N	0	0	277.795	4.275	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC(CCC(C)C)CC1	ZINC000466418212	331396002	/nfs/dbraw/zinc/39/60/02/331396002.db2.gz	XALXUXXVSQJQLN-HNNXBMFYSA-N	0	0	265.441	4.264	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(Cc1ccc(C)c(C)c1)C1CC1	ZINC000466428823	331396783	/nfs/dbraw/zinc/39/67/83/331396783.db2.gz	RPEXXMZXVIKWRG-INIZCTEOSA-N	0	0	285.431	4.397	20	30		CIEDRN
CC#CCCCC(=O)N(c1ccc(C)cn1)C1CCCCC1	ZINC000466436797	331397001	/nfs/dbraw/zinc/39/70/01/331397001.db2.gz	QPNYVHXFYKZPCF-UHFFFAOYSA-N	0	0	298.430	4.249	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](c1ccccc1C)C1CC1	ZINC000466433688	331397006	/nfs/dbraw/zinc/39/70/06/331397006.db2.gz	FLVXMDZPMBYRBA-RHSMWYFYSA-N	0	0	271.404	4.165	20	30		CIEDRN
CC#CCCCC(=O)N(C)[C@H](c1ccccc1C)C(C)C	ZINC000466434704	331397016	/nfs/dbraw/zinc/39/70/16/331397016.db2.gz	LWEJDJVRHNQYHM-IBGZPJMESA-N	0	0	285.431	4.344	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)c1cccc2ccsc21	ZINC000466438283	331397167	/nfs/dbraw/zinc/39/71/67/331397167.db2.gz	KNSNBVDIKLFJAH-UHFFFAOYSA-N	0	0	292.363	4.334	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](Cc1ccc(F)cc1)C(C)C	ZINC000466439654	331397231	/nfs/dbraw/zinc/39/72/31/331397231.db2.gz	UTWVGLDGFVMFRU-PBHICJAKSA-N	0	0	291.410	4.111	20	30		CIEDRN
N#Cc1ccc(SCc2cccc(Cl)c2F)nc1	ZINC000466480565	331398196	/nfs/dbraw/zinc/39/81/96/331398196.db2.gz	GUFYPKKMRNTRLZ-UHFFFAOYSA-N	0	0	278.739	4.038	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NC[C@@H]1CCCC[C@H]1C(F)(F)F	ZINC000466527848	331399091	/nfs/dbraw/zinc/39/90/91/331399091.db2.gz	FUJFWIZGIVCIID-RWMBFGLXSA-N	0	0	291.357	4.074	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)[C@@H](OC(C)(C)C)c1ccccc1	ZINC000466529203	331399162	/nfs/dbraw/zinc/39/91/62/331399162.db2.gz	NMITTWPTOKRDEK-CVEARBPZSA-N	0	0	289.419	4.014	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)[C@H](c1ccc(F)cc1)C(C)C	ZINC000466534294	331399234	/nfs/dbraw/zinc/39/92/34/331399234.db2.gz	OOWAIPYXDYAPSV-CVEARBPZSA-N	0	0	277.383	4.036	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)[C@@H](CCC)c1ccccc1	ZINC000466533999	331399262	/nfs/dbraw/zinc/39/92/62/331399262.db2.gz	LXMVDKHOZXDLDW-CVEARBPZSA-N	0	0	259.393	4.041	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)C1(c2ccc(F)cc2)CCCC1	ZINC000466541607	331399498	/nfs/dbraw/zinc/39/94/98/331399498.db2.gz	RZJADJLKUZCIMU-INIZCTEOSA-N	0	0	289.394	4.108	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1cc(F)ccc1-c1ccoc1	ZINC000466542883	331399559	/nfs/dbraw/zinc/39/95/59/331399559.db2.gz	VYLUGMOZFZRJNT-CQSZACIVSA-N	0	0	287.334	4.170	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1cc(-c2ccccc2)cnc1C	ZINC000466548981	331399834	/nfs/dbraw/zinc/39/98/34/331399834.db2.gz	WAEYHFDHXLXGQI-UHFFFAOYSA-N	0	0	295.386	4.097	20	30		CIEDRN
C=CCCC(=O)Nc1cc(Cl)c(Cl)cc1F	ZINC000466562829	331400013	/nfs/dbraw/zinc/40/00/13/331400013.db2.gz	BTSAKVCBYMPMEG-UHFFFAOYSA-N	0	0	262.111	4.037	20	30		CIEDRN
Cc1ccc(C)c(NC(=O)Nc2ccc(C#N)cc2Cl)c1	ZINC000466578507	331400247	/nfs/dbraw/zinc/40/02/47/331400247.db2.gz	NNJHONTVTIEIJQ-UHFFFAOYSA-N	0	0	299.761	4.473	20	30		CIEDRN
C=CCCN(C)C(=O)CCCc1cccc(C(F)(F)F)c1	ZINC000466633408	331401158	/nfs/dbraw/zinc/40/11/58/331401158.db2.gz	FRPHCKCNXYWQBJ-UHFFFAOYSA-N	0	0	299.336	4.063	20	30		CIEDRN
C=CCCN(C)C(=O)Cc1csc2ccc(Cl)cc12	ZINC000466641112	331401340	/nfs/dbraw/zinc/40/13/40/331401340.db2.gz	KZEHIONYLGUBSW-UHFFFAOYSA-N	0	0	293.819	4.132	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCCC[C@@H]1CCC(C)C	ZINC000466874013	331406939	/nfs/dbraw/zinc/40/69/39/331406939.db2.gz	MUGHLZHUWISFFD-JKSUJKDBSA-N	0	0	265.441	4.406	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(c1cccc(C)c1)C(C)C	ZINC000466873665	331406950	/nfs/dbraw/zinc/40/69/50/331406950.db2.gz	RNQDZQOADKDFJG-HNNXBMFYSA-N	0	0	259.393	4.339	20	30		CIEDRN
C=CCCN(C)C(=O)N[C@@H](c1ccc(Cl)cc1)C(C)C	ZINC000466981272	331409632	/nfs/dbraw/zinc/40/96/32/331409632.db2.gz	PNXGDCYCJMEFTQ-OAHLLOKOSA-N	0	0	294.826	4.255	20	30		CIEDRN
C=CCCN(C)C(=O)[C@@H](CC)c1cccc(C(F)(F)F)c1	ZINC000467056414	331410837	/nfs/dbraw/zinc/41/08/37/331410837.db2.gz	FKUOHOKWJYWBAO-AWEZNQCLSA-N	0	0	299.336	4.234	20	30		CIEDRN
C=CCCN(C)C(=O)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1	ZINC000467080331	331410847	/nfs/dbraw/zinc/41/08/47/331410847.db2.gz	FJWMAWOPVDCBFA-UONOGXRCSA-N	0	0	298.213	4.131	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000467127139	331411432	/nfs/dbraw/zinc/41/14/32/331411432.db2.gz	GNLWOUHCXBJXTF-CYBMUJFWSA-N	0	0	287.281	4.126	20	30		CIEDRN
Cc1cc(Cl)cc2c1N(CCCSCC#N)CCC2	ZINC000467147462	331411706	/nfs/dbraw/zinc/41/17/06/331411706.db2.gz	JGGMXBBFUZCAFL-UHFFFAOYSA-N	0	0	294.851	4.048	20	30		CIEDRN
C=CCC(CC=C)C(=O)NCC1(CC(C)C)CCC1	ZINC000467316563	331414840	/nfs/dbraw/zinc/41/48/40/331414840.db2.gz	MKWPTOXBFCYADM-UHFFFAOYSA-N	0	0	263.425	4.087	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H](CC)c1ccc(C)cc1	ZINC000467335182	331415324	/nfs/dbraw/zinc/41/53/24/331415324.db2.gz	JTQQASIMYJBYEP-KRWDZBQOSA-N	0	0	271.404	4.331	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N(C)Cc1ccc2ccccc2c1	ZINC000467428695	331418657	/nfs/dbraw/zinc/41/86/57/331418657.db2.gz	LVQCIMWNVGXSQK-LJQANCHMSA-N	0	0	281.399	4.401	20	30		CIEDRN
N#C[C@H]1CCC[C@H](Nc2ccc(F)c(C3CC3)c2)C1	ZINC000467446005	331419734	/nfs/dbraw/zinc/41/97/34/331419734.db2.gz	UYWVUCRFDHNGTK-AAEUAGOBSA-N	0	0	258.340	4.197	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)NC[C@@H](c1ccccc1)C(C)C	ZINC000467518316	331420934	/nfs/dbraw/zinc/42/09/34/331420934.db2.gz	KZZMADBSZSFEGV-AEFFLSMTSA-N	0	0	273.420	4.145	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H](C)c1cccc(OC(C)C)c1	ZINC000467604590	331422790	/nfs/dbraw/zinc/42/27/90/331422790.db2.gz	HNAWZUVXJANEAT-KBXCAEBGSA-N	0	0	289.419	4.253	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@H](C)c1ccc(OC(C)C)cc1	ZINC000467643889	331422925	/nfs/dbraw/zinc/42/29/25/331422925.db2.gz	OYDFCGSBBNOVOR-KDOFPFPSSA-N	0	0	289.419	4.253	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC)Cc1ccc(Cl)cc1	ZINC000467831121	331424320	/nfs/dbraw/zinc/42/43/20/331424320.db2.gz	RFBQPRLHMIZKHG-UHFFFAOYSA-N	0	0	291.822	4.457	20	30		CIEDRN
C=CCC(CC=C)C(=O)NCCc1ccc2ccccc2c1	ZINC000467822640	331424323	/nfs/dbraw/zinc/42/43/23/331424323.db2.gz	BPFKIOSMOACECS-UHFFFAOYSA-N	0	0	293.410	4.267	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCCc2c(F)cc(F)cc21	ZINC000467821257	331424362	/nfs/dbraw/zinc/42/43/62/331424362.db2.gz	LFCJTYKQFZROBP-UHFFFAOYSA-N	0	0	291.341	4.012	20	30		CIEDRN
C=CCC(CC=C)C(=O)NC[C@H](c1ccccc1)C(C)C	ZINC000467824596	331424374	/nfs/dbraw/zinc/42/43/74/331424374.db2.gz	LWRIPUKUBKOMBJ-SFHVURJKSA-N	0	0	285.431	4.311	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@@H](C)c2ccccc21	ZINC000467825776	331424380	/nfs/dbraw/zinc/42/43/80/331424380.db2.gz	HOVYGPMBWGROKK-CQSZACIVSA-N	0	0	269.388	4.295	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)[C@H]1CCCC[C@@H]1CC	ZINC000467861092	331424640	/nfs/dbraw/zinc/42/46/40/331424640.db2.gz	CSKRRYSPSZECAY-HOCLYGCPSA-N	0	0	263.425	4.182	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1nc(-c2cccs2)cs1	ZINC000467850050	331424648	/nfs/dbraw/zinc/42/46/48/331424648.db2.gz	JKQBVTGWYCZISN-CQSZACIVSA-N	0	0	292.429	4.412	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H](C)c1c(C)cccc1C	ZINC000467915025	331425652	/nfs/dbraw/zinc/42/56/52/331425652.db2.gz	ZFJWBXARHSMVRP-WMLDXEAASA-N	0	0	259.393	4.083	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CC[C@H](C)c2ccccc21	ZINC000467935891	331425824	/nfs/dbraw/zinc/42/58/24/331425824.db2.gz	UNFBTZKQKCJJQU-SUMWQHHRSA-N	0	0	257.377	4.129	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)NC[C@@H]1CCCC[C@@H]1C(F)(F)F	ZINC000467979616	331426229	/nfs/dbraw/zinc/42/62/29/331426229.db2.gz	VZYXBPSIEBFMHZ-SGMGOOAPSA-N	0	0	291.357	4.074	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(Cl)cc1OCC	ZINC000467982769	331426231	/nfs/dbraw/zinc/42/62/31/331426231.db2.gz	IUJQHMJPJIDNHC-HNNXBMFYSA-N	0	0	281.783	4.280	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H]1C[C@@H]1c1c(F)cccc1Cl	ZINC000468001182	331426597	/nfs/dbraw/zinc/42/65/97/331426597.db2.gz	BFCQRNJQFSDSGV-YNZJMPHRSA-N	0	0	295.785	4.054	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H]1CCC[C@H]1c1ccccc1	ZINC000468025063	331426832	/nfs/dbraw/zinc/42/68/32/331426832.db2.gz	OZKZLZYVCFEHHG-XYJFISCASA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CCCCNC(=O)C[C@@H]1C[C@H](C)c2c1cccc2C	ZINC000468374630	331433071	/nfs/dbraw/zinc/43/30/71/331433071.db2.gz	XRHWFALQXFPYSH-GJZGRUSLSA-N	0	0	271.404	4.058	20	30		CIEDRN
C=CCCCNC(=O)[C@H](c1cccc(Cl)c1)C(C)C	ZINC000468389794	331433528	/nfs/dbraw/zinc/43/35/28/331433528.db2.gz	LYGZZVLWQGCZMJ-HNNXBMFYSA-N	0	0	279.811	4.162	20	30		CIEDRN
C=CCCCNC(=O)CCCc1cccc(C(F)(F)F)c1	ZINC000468398226	331434072	/nfs/dbraw/zinc/43/40/72/331434072.db2.gz	AERQLQPJILXCJI-UHFFFAOYSA-N	0	0	299.336	4.111	20	30		CIEDRN
C=CCCCNC(=O)[C@H](SCc1ccccc1)C(C)C	ZINC000468400327	331434123	/nfs/dbraw/zinc/43/41/23/331434123.db2.gz	WIOBIGANUAFWCD-MRXNPFEDSA-N	0	0	291.460	4.027	20	30		CIEDRN
N#Cc1ccc(-c2ccc(OCC[C@@H]3CCCO3)cc2)cc1	ZINC000468481852	331435618	/nfs/dbraw/zinc/43/56/18/331435618.db2.gz	WLBRDFRNHSWQKY-SFHVURJKSA-N	0	0	293.366	4.173	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(c1ccc(F)cc1)C(C)C	ZINC000468724535	331439011	/nfs/dbraw/zinc/43/90/11/331439011.db2.gz	NJLROJTXYPMQPK-UHFFFAOYSA-N	0	0	275.367	4.336	20	30		CIEDRN
C=CC[C@H](C)NC(=O)C1(c2c(Cl)cccc2Cl)CC1	ZINC000468780321	331439850	/nfs/dbraw/zinc/43/98/50/331439850.db2.gz	BLFQWAAWWSILKV-JTQLQIEISA-N	0	0	298.213	4.106	20	30		CIEDRN
CC(C)(C#N)CC(=O)Nc1ccccc1-c1ccccc1	ZINC000468892231	331441864	/nfs/dbraw/zinc/44/18/64/331441864.db2.gz	JNOQRNNVCMRHTB-UHFFFAOYSA-N	0	0	278.355	4.232	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)[C@H]1[C@@H]2CCCC[C@@H]21	ZINC000468925282	331442347	/nfs/dbraw/zinc/44/23/47/331442347.db2.gz	LLNMLINNBYSIMR-FVQHAEBGSA-N	0	0	275.436	4.018	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CC[C@](C)(c2ccc(C)cc2)C1	ZINC000468939263	331442650	/nfs/dbraw/zinc/44/26/50/331442650.db2.gz	JEZDIBZGPSNDNQ-OALUTQOASA-N	0	0	285.431	4.087	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)C[C@H]1CC[C@H](C)C1	ZINC000469068210	331445117	/nfs/dbraw/zinc/44/51/17/331445117.db2.gz	VBFHSHGXOZNQMD-RDJZCZTQSA-N	0	0	271.404	4.028	20	30		CIEDRN
C=C(C)CN(C)C(=O)CCC[C@H](C)c1cccc(OC)c1	ZINC000469102544	331445775	/nfs/dbraw/zinc/44/57/75/331445775.db2.gz	UKIXZWIXSLSKDO-HNNXBMFYSA-N	0	0	289.419	4.004	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)CCC[C@H](C)c1cccc(OC)c1	ZINC000469256362	331448470	/nfs/dbraw/zinc/44/84/70/331448470.db2.gz	IQMRFSQFYIFJBT-LSDHHAIUSA-N	0	0	289.419	4.050	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Cc1cccc(Cl)c1Cl	ZINC000469256830	331448494	/nfs/dbraw/zinc/44/84/94/331448494.db2.gz	RXUKBDDSMQJRTK-LBPRGKRZSA-N	0	0	298.213	4.103	20	30		CIEDRN
CCCC1(C(=O)Nc2ccc(Cl)c(C#N)c2)CCC1	ZINC000469357348	331450136	/nfs/dbraw/zinc/45/01/36/331450136.db2.gz	QORIBFOEXBOHCA-UHFFFAOYSA-N	0	0	276.767	4.121	20	30		CIEDRN
CC(C)Cn1ccc2cc(NC(=O)CC(C)(C)C#N)ccc21	ZINC000469624674	331455216	/nfs/dbraw/zinc/45/52/16/331455216.db2.gz	DCWFTJTYOMZOQB-UHFFFAOYSA-N	0	0	297.402	4.176	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCCC(CC)(CC)CC1	ZINC000469932125	331465280	/nfs/dbraw/zinc/46/52/80/331465280.db2.gz	DGWFOZGCBYPFPU-OAHLLOKOSA-N	0	0	265.441	4.408	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)Cc1cc(Cl)ccc1F	ZINC000470093990	331471333	/nfs/dbraw/zinc/47/13/33/331471333.db2.gz	RKDWTTRHGKLXBJ-LLVKDONJSA-N	0	0	283.774	4.040	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)Cc1cc(Cl)ccc1F	ZINC000470093991	331471336	/nfs/dbraw/zinc/47/13/36/331471336.db2.gz	RKDWTTRHGKLXBJ-NSHDSACASA-N	0	0	283.774	4.040	20	30		CIEDRN
CCN(CC#N)[C@@H](C)c1ccc(-c2cccc(OC)c2)cc1	ZINC000470152783	331472726	/nfs/dbraw/zinc/47/27/26/331472726.db2.gz	OQMRJKGYRFNZTJ-HNNXBMFYSA-N	0	0	294.398	4.269	20	30		CIEDRN
C=CCC[C@@H](C(=O)NCCc1ccccc1)c1ccccc1	ZINC000470167101	331473504	/nfs/dbraw/zinc/47/35/04/331473504.db2.gz	LSXVBZBIZFLKNI-LJQANCHMSA-N	0	0	293.410	4.095	20	30		CIEDRN
N#Cc1cnccc1/C=C/c1ccc(Cl)c(Cl)c1	ZINC000470277722	331477709	/nfs/dbraw/zinc/47/77/09/331477709.db2.gz	BOUMWLXVUOKAMR-HNQUOIGGSA-N	0	0	275.138	4.430	20	30		CIEDRN
N#Cc1cnccc1/C=C/c1cccc(Cl)c1Cl	ZINC000470283763	331477875	/nfs/dbraw/zinc/47/78/75/331477875.db2.gz	FNVLRIZOPLFIKA-SNAWJCMRSA-N	0	0	275.138	4.430	20	30		CIEDRN
C=CC[C@H]1N(C(=O)C[C@@H](C)CC)CCCC1(C)C	ZINC000470287071	331478074	/nfs/dbraw/zinc/47/80/74/331478074.db2.gz	XZTPTDZESQZZBG-UONOGXRCSA-N	0	0	251.414	4.016	20	30		CIEDRN
CC(C)(C)[C@@H]1CN(C(=O)C2(C#N)CCCC2)c2ccccc21	ZINC000470286666	331478099	/nfs/dbraw/zinc/47/80/99/331478099.db2.gz	XBPUTFVRDKKUTF-OAHLLOKOSA-N	0	0	296.414	4.247	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)c2ccccc2C)CCCC1(C)C	ZINC000470300308	331478842	/nfs/dbraw/zinc/47/88/42/331478842.db2.gz	VDYRBCVUUYMPOK-INIZCTEOSA-N	0	0	271.404	4.202	20	30		CIEDRN
C=CC[C@H]1N(C(=O)c2cc(C(C)C)on2)CCCC1(C)C	ZINC000470305644	331478943	/nfs/dbraw/zinc/47/89/43/331478943.db2.gz	ABKNIWPWYQGBNO-OAHLLOKOSA-N	0	0	290.407	4.005	20	30		CIEDRN
Cc1cc(C#N)ccc1C(=O)Nc1ccc(C2CCC2)cc1	ZINC000470512568	331484345	/nfs/dbraw/zinc/48/43/45/331484345.db2.gz	VKOQLCBJPDUIFK-UHFFFAOYSA-N	0	0	290.366	4.387	20	30		CIEDRN
C=CCC1(C(=O)N2C[C@H](c3ccc(C)cc3)C[C@@H]2C)CCC1	ZINC000470561629	331485483	/nfs/dbraw/zinc/48/54/83/331485483.db2.gz	AHMSIOPGCQTNEH-FUHWJXTLSA-N	0	0	297.442	4.446	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1C[C@H](c2ccc(C)cc2)C[C@H]1C	ZINC000470563095	331485499	/nfs/dbraw/zinc/48/54/99/331485499.db2.gz	FYTFCCRMAAEQNP-LZLYRXPVSA-N	0	0	285.431	4.302	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)[C@@H]1CC[C@@H](C)C1	ZINC000470649792	331486910	/nfs/dbraw/zinc/48/69/10/331486910.db2.gz	VPNGAGPPSOQKIN-NVXWUHKLSA-N	0	0	271.404	4.028	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)CCSCc1ccccc1	ZINC000471105832	331501677	/nfs/dbraw/zinc/50/16/77/331501677.db2.gz	WMSLYRMVNHIUAA-OAHLLOKOSA-N	0	0	291.460	4.171	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)[C@H](C)c1cccc(C)c1	ZINC000471165703	331503010	/nfs/dbraw/zinc/50/30/10/331503010.db2.gz	PWBZJHJNVVJYCP-OAHLLOKOSA-N	0	0	286.419	4.029	20	30		CIEDRN
C=CCCCCNC(=O)[C@@H](C)CCCc1ccccc1	ZINC000471668456	331514616	/nfs/dbraw/zinc/51/46/16/331514616.db2.gz	QZXPCQWANOZBOZ-INIZCTEOSA-N	0	0	273.420	4.118	20	30		CIEDRN
C=CCCCCNC(=O)c1ccc(CSCC)cc1	ZINC000471672917	331514893	/nfs/dbraw/zinc/51/48/93/331514893.db2.gz	ACEFBPLYWAVOAD-UHFFFAOYSA-N	0	0	277.433	4.026	20	30		CIEDRN
N#CC1(CSCC2CCC(C(F)(F)F)CC2)CC1	ZINC000471936869	331524328	/nfs/dbraw/zinc/52/43/28/331524328.db2.gz	MIHIMKUEQUHEIC-UHFFFAOYSA-N	0	0	277.355	4.392	20	30		CIEDRN
CSc1cccc(C)c1NCc1cccc(C#N)c1F	ZINC000471993962	331525456	/nfs/dbraw/zinc/52/54/56/331525456.db2.gz	YGSJAYXKSOUXDD-UHFFFAOYSA-N	0	0	286.375	4.340	20	30		CIEDRN
C=CC1CCN(C(=O)[C@H](C)CC2CCCCC2)CC1	ZINC000510743544	332914769	/nfs/dbraw/zinc/91/47/69/332914769.db2.gz	VYXDXTHGKRSHIM-CQSZACIVSA-N	0	0	263.425	4.018	20	30		CIEDRN
C[C@@H]1CN(CCCC(C)(C)C#N)c2cc(Cl)ccc2O1	ZINC000472231325	331532522	/nfs/dbraw/zinc/53/25/22/331532522.db2.gz	PVDFRTPWRKNTOR-GFCCVEGCSA-N	0	0	292.810	4.257	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)Nc1c(C)cccc1SC)OCC	ZINC000472233927	331532646	/nfs/dbraw/zinc/53/26/46/331532646.db2.gz	ZJSXJYCALFCFMM-CYBMUJFWSA-N	0	0	293.432	4.027	20	30		CIEDRN
C=CCN(C)C(=O)c1ccc(O[C@@H](C)c2ccccc2)cc1	ZINC000472479463	331537784	/nfs/dbraw/zinc/53/77/84/331537784.db2.gz	VWNZHOISJFPALE-HNNXBMFYSA-N	0	0	295.382	4.085	20	30		CIEDRN
C=CCCCCNC(=O)N1CCC[C@@H]1c1ccc(F)cc1	ZINC000472849246	331544449	/nfs/dbraw/zinc/54/44/49/331544449.db2.gz	NFXBXQCIXNSYRU-MRXNPFEDSA-N	0	0	290.382	4.029	20	30		CIEDRN
C=CCC(CC=C)C(=O)NC1(Cc2ccccc2)CCC1	ZINC000472963806	331545674	/nfs/dbraw/zinc/54/56/74/331545674.db2.gz	FGUKKBVDGCXZDZ-UHFFFAOYSA-N	0	0	283.415	4.036	20	30		CIEDRN
CCC[C@@H]1[C@H](C)CCCN1C(=O)Nc1cc(C#N)ccc1C	ZINC000473338972	331550349	/nfs/dbraw/zinc/55/03/49/331550349.db2.gz	ZUVBPVIXFAXYOT-RHSMWYFYSA-N	0	0	299.418	4.299	20	30		CIEDRN
C=C[C@@](C)(CCOC)C(=O)N(C)c1cccc(C(C)C)c1	ZINC000473656038	331554806	/nfs/dbraw/zinc/55/48/06/331554806.db2.gz	AMMVVNAFDSTGAC-SFHVURJKSA-N	0	0	289.419	4.002	20	30		CIEDRN
C=CCCCCNC(=O)Nc1ccc(COC(C)C)cc1	ZINC000473656020	331554808	/nfs/dbraw/zinc/55/48/08/331554808.db2.gz	AJSCVGOMTXZNDC-UHFFFAOYSA-N	0	0	290.407	4.089	20	30		CIEDRN
C=CCCCCNC(=O)Nc1ccc(C)c(OC(F)F)c1	ZINC000473690994	331555848	/nfs/dbraw/zinc/55/58/48/331555848.db2.gz	FNZOIHZPDNCWAT-UHFFFAOYSA-N	0	0	298.333	4.074	20	30		CIEDRN
C=CCCCCNC(=O)Nc1cccc(-c2nc(C)co2)c1	ZINC000473704191	331555990	/nfs/dbraw/zinc/55/59/90/331555990.db2.gz	BJXNFMIZMALKTD-UHFFFAOYSA-N	0	0	299.374	4.128	20	30		CIEDRN
N#Cc1ccc(SC[C@H](O)CC2CCCC2)c(Cl)c1	ZINC000473756346	331556545	/nfs/dbraw/zinc/55/65/45/331556545.db2.gz	AHQVWNYAOCYYTR-CYBMUJFWSA-N	0	0	295.835	4.245	20	30		CIEDRN
C=CCCCCNC(=O)N(Cc1cccs1)C(C)C	ZINC000474088304	331569272	/nfs/dbraw/zinc/56/92/72/331569272.db2.gz	ILIOGWJCPBAYTC-UHFFFAOYSA-N	0	0	280.437	4.024	20	30		CIEDRN
C=CCCCCNC(=O)N(C)[C@@H](c1ccccc1)C(C)C	ZINC000474091102	331569736	/nfs/dbraw/zinc/56/97/36/331569736.db2.gz	VTFFOZRJCCBFOY-QGZVFWFLSA-N	0	0	288.435	4.381	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000474100492	331570642	/nfs/dbraw/zinc/57/06/42/331570642.db2.gz	XQFCDSUJGRITNP-UHFFFAOYSA-N	0	0	283.293	4.390	20	30		CIEDRN
CC[C@@H](CC1CCCC1)C(=O)Nc1cc(C#N)ccc1C	ZINC000510787688	332917156	/nfs/dbraw/zinc/91/71/56/332917156.db2.gz	MSQHCEHCQHORDH-INIZCTEOSA-N	0	0	284.403	4.412	20	30		CIEDRN
CC[C@H](CC1CCCC1)C(=O)Nc1cc(C#N)ccc1C	ZINC000510787689	332917168	/nfs/dbraw/zinc/91/71/68/332917168.db2.gz	MSQHCEHCQHORDH-MRXNPFEDSA-N	0	0	284.403	4.412	20	30		CIEDRN
CC(C)(C#N)c1ccc(C(=O)NCCC2=CCCCC2)cc1	ZINC000474289135	331579755	/nfs/dbraw/zinc/57/97/55/331579755.db2.gz	DQEXSQQOYXAPPY-UHFFFAOYSA-N	0	0	296.414	4.108	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H]1CC[C@@H](Cc2ccccc2)C1	ZINC000474325132	331580232	/nfs/dbraw/zinc/58/02/32/331580232.db2.gz	CYZMFURKLFMDIN-HKUYNNGSSA-N	0	0	297.442	4.282	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CCC[C@H](C(C)C)C1)c1ccccc1	ZINC000474402489	331584455	/nfs/dbraw/zinc/58/44/55/331584455.db2.gz	KUNZGDFIPSRABW-WMZOPIPTSA-N	0	0	285.431	4.241	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(C(F)(F)F)cc2)CC1	ZINC000474411023	331585319	/nfs/dbraw/zinc/58/53/19/331585319.db2.gz	IMTLNDCYXSALER-UHFFFAOYSA-N	0	0	283.293	4.390	20	30		CIEDRN
C=CCCC1(C(=O)N[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)CC1	ZINC000474419043	331586236	/nfs/dbraw/zinc/58/62/36/331586236.db2.gz	YTWNABCKOWPJPR-ARFHVFGLSA-N	0	0	275.436	4.208	20	30		CIEDRN
C=CCCC1(C(=O)N2CCC(c3ccccc3)CC2)CC1	ZINC000474593714	331591018	/nfs/dbraw/zinc/59/10/18/331591018.db2.gz	SXMHUDNNWFONCL-UHFFFAOYSA-N	0	0	283.415	4.139	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc2c(c1)O[C@@](C)(CC)O2	ZINC000474642844	331593368	/nfs/dbraw/zinc/59/33/68/331593368.db2.gz	YIABZTCGDHNCBI-SJCJKPOMSA-N	0	0	289.375	4.125	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc2c(c1)O[C@](C)(CC)O2	ZINC000474642846	331593473	/nfs/dbraw/zinc/59/34/73/331593473.db2.gz	YIABZTCGDHNCBI-YVEFUNNKSA-N	0	0	289.375	4.125	20	30		CIEDRN
CN(CC1CCCCC1)C(=O)C[C@@H](CC#N)c1ccccc1	ZINC000474696271	331594604	/nfs/dbraw/zinc/59/46/04/331594604.db2.gz	GKWCKYOAJHFTGV-GOSISDBHSA-N	0	0	298.430	4.113	20	30		CIEDRN
C=CCCC1(C(=O)N[C@@H](C)c2ccc(C)cc2C)CC1	ZINC000474698427	331594685	/nfs/dbraw/zinc/59/46/85/331594685.db2.gz	VQOJCDRVXCOZSB-HNNXBMFYSA-N	0	0	271.404	4.227	20	30		CIEDRN
C=CCOc1ccccc1CNCc1c(F)cccc1CC	ZINC000474730702	331596567	/nfs/dbraw/zinc/59/65/67/331596567.db2.gz	PPVQNMMAAXYKAK-UHFFFAOYSA-N	0	0	299.389	4.243	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(OCC)c(Cl)c2)CC1	ZINC000474954989	331606441	/nfs/dbraw/zinc/60/64/41/331606441.db2.gz	MCBXACXDBLSWOY-UHFFFAOYSA-N	0	0	293.794	4.424	20	30		CIEDRN
Cc1cc(C)c(C)c(OCc2ccc(F)cc2C#N)c1	ZINC000303221109	332919700	/nfs/dbraw/zinc/91/97/00/332919700.db2.gz	VFPWOMDTHFHLLQ-UHFFFAOYSA-N	0	0	269.319	4.202	20	30		CIEDRN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@@H]1CCCC1(C)C	ZINC000475320787	331624834	/nfs/dbraw/zinc/62/48/34/331624834.db2.gz	RGRFMCMQLSRGCO-KRWDZBQOSA-N	0	0	298.430	4.122	20	30		CIEDRN
C[C@@H]1CC[C@H](CNC(=O)Nc2ccc(C(C)(C)C#N)cc2)C1	ZINC000475477895	331632516	/nfs/dbraw/zinc/63/25/16/331632516.db2.gz	NBJUWUAEWDURCI-KGLIPLIRSA-N	0	0	299.418	4.045	20	30		CIEDRN
C[C@H]1CC[C@@H](CNC(=O)Nc2ccc(C(C)(C)C#N)cc2)C1	ZINC000475477897	331632520	/nfs/dbraw/zinc/63/25/20/331632520.db2.gz	NBJUWUAEWDURCI-UONOGXRCSA-N	0	0	299.418	4.045	20	30		CIEDRN
C=CCCC1(C(=O)N(C)c2cccc(SC)c2)CC1	ZINC000475528320	331635762	/nfs/dbraw/zinc/63/57/62/331635762.db2.gz	FSVMGRAUFHODFS-UHFFFAOYSA-N	0	0	275.417	4.118	20	30		CIEDRN
C=CCCC1(C(=O)N2CCC3(CCCCC3)CC2)CC1	ZINC000475535241	331636094	/nfs/dbraw/zinc/63/60/94/331636094.db2.gz	XQMGWWZXQRUALV-UHFFFAOYSA-N	0	0	275.436	4.306	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1ccc(SC)c(Cl)c1	ZINC000475975213	331650420	/nfs/dbraw/zinc/65/04/20/331650420.db2.gz	JVSOQOUZXMFPPF-UHFFFAOYSA-N	0	0	298.839	4.492	20	30		CIEDRN
C=CCOCCCSc1ncc(C(C)C)n1C(C)C	ZINC000475988428	331650812	/nfs/dbraw/zinc/65/08/12/331650812.db2.gz	ULTGQUVSVKEQPR-UHFFFAOYSA-N	0	0	282.453	4.272	20	30		CIEDRN
CC[C@@H]1CCCN(C(=O)C[C@H](CC#N)c2ccccc2)CC1	ZINC000476060295	331652369	/nfs/dbraw/zinc/65/23/69/331652369.db2.gz	ISDOSNQEVNKAMF-AEFFLSMTSA-N	0	0	298.430	4.113	20	30		CIEDRN
C=CCCC1(C(=O)N2CCC[C@@H](C(C)C)CC2)CC1	ZINC000476069057	331652822	/nfs/dbraw/zinc/65/28/22/331652822.db2.gz	CDTHBGMGNMFEAD-OAHLLOKOSA-N	0	0	263.425	4.018	20	30		CIEDRN
CC[C@H]1CCCCCN1C(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000476093090	331654696	/nfs/dbraw/zinc/65/46/96/331654696.db2.gz	XKGSICGPIBHPNJ-KRWDZBQOSA-N	0	0	298.430	4.283	20	30		CIEDRN
C[C@@H](NC(=O)C[C@H](CC#N)c1ccccc1)C1CCCCC1	ZINC000476169196	331656270	/nfs/dbraw/zinc/65/62/70/331656270.db2.gz	VYWLXJAZSWONBM-QAPCUYQASA-N	0	0	298.430	4.159	20	30		CIEDRN
C[C@H](NC(=O)C[C@@H](CC#N)c1ccccc1)C1CCCCC1	ZINC000476169192	331656548	/nfs/dbraw/zinc/65/65/48/331656548.db2.gz	VYWLXJAZSWONBM-MAUKXSAKSA-N	0	0	298.430	4.159	20	30		CIEDRN
C=CC1CCN(C(=O)N[C@@H](c2ccc(C)cc2)C2CC2)CC1	ZINC000476382499	331663108	/nfs/dbraw/zinc/66/31/08/331663108.db2.gz	SICJTJPZTNMGBR-SFHVURJKSA-N	0	0	298.430	4.054	20	30		CIEDRN
C=CC1CCN(C(=O)N[C@H](c2ccc(C)cc2)C2CC2)CC1	ZINC000476382498	331663123	/nfs/dbraw/zinc/66/31/23/331663123.db2.gz	SICJTJPZTNMGBR-GOSISDBHSA-N	0	0	298.430	4.054	20	30		CIEDRN
CC[C@H]1CCCC[C@@H]1C(=O)Nc1cccc(C#N)c1C	ZINC000476434888	331664141	/nfs/dbraw/zinc/66/41/41/331664141.db2.gz	WRVXYEDESRIJRJ-ZFWWWQNUSA-N	0	0	270.376	4.022	20	30		CIEDRN
C[C@H](C#N)CN(C(=O)CC(C)(C)C1CCCCC1)C1CC1	ZINC000476471762	331664561	/nfs/dbraw/zinc/66/45/61/331664561.db2.gz	NZFZCNSKLUQDCF-CQSZACIVSA-N	0	0	290.451	4.134	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(OCCC)cc2)CC1	ZINC000476523401	331665852	/nfs/dbraw/zinc/66/58/52/331665852.db2.gz	LDIAPLDBABKIJZ-UHFFFAOYSA-N	0	0	273.376	4.160	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1coc2cc(F)ccc12	ZINC000476539504	331666148	/nfs/dbraw/zinc/66/61/48/331666148.db2.gz	GGDSEFLUKQAXBX-LLVKDONJSA-N	0	0	275.323	4.047	20	30		CIEDRN
C=C(C)CN(C)C(=O)CC(C)(C)C1CCCCC1	ZINC000476560583	331666435	/nfs/dbraw/zinc/66/64/35/331666435.db2.gz	MDPCHTIZADATHT-UHFFFAOYSA-N	0	0	251.414	4.018	20	30		CIEDRN
C=C(C)CS[C@H](C(=O)N1CCCCC1)c1ccccc1	ZINC000477008839	331672538	/nfs/dbraw/zinc/67/25/38/331672538.db2.gz	XEADODNOBBVOFL-INIZCTEOSA-N	0	0	289.444	4.050	20	30		CIEDRN
C=CCCC1(C(=O)N2CC3(CCC3)c3ccccc32)CC1	ZINC000477024655	331673211	/nfs/dbraw/zinc/67/32/11/331673211.db2.gz	KPZHVEAUKYDEDU-UHFFFAOYSA-N	0	0	281.399	4.201	20	30		CIEDRN
CCC[C@H](CC)S[C@@H](C)C(=O)NC1(C#N)CCCCC1	ZINC000477058315	331674417	/nfs/dbraw/zinc/67/44/17/331674417.db2.gz	QSIOXTVQVILWJX-KBPBESRZSA-N	0	0	296.480	4.029	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)CCC1	ZINC000477890836	331693075	/nfs/dbraw/zinc/69/30/75/331693075.db2.gz	JBXTXETXVHWYOZ-ARFHVFGLSA-N	0	0	275.436	4.208	20	30		CIEDRN
CN(C(=O)c1ccc(C(C)(C)C#N)cc1)[C@H]1CCC(C)(C)C1	ZINC000478204641	331700497	/nfs/dbraw/zinc/70/04/97/331700497.db2.gz	GRSWCZWWNGWJCI-INIZCTEOSA-N	0	0	298.430	4.138	20	30		CIEDRN
Cc1ccc(F)cc1NCc1ccc(Cl)cc1C#N	ZINC000478331368	331704144	/nfs/dbraw/zinc/70/41/44/331704144.db2.gz	CNFJXDOHYFYRAI-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
C=CCCC1(C(=O)N2CCC[C@@H](C(C)(C)C)C2)CC1	ZINC000478465051	331706645	/nfs/dbraw/zinc/70/66/45/331706645.db2.gz	FXBMYXOAQFYFFG-CQSZACIVSA-N	0	0	263.425	4.018	20	30		CIEDRN
Cc1[nH]c2ccc(OCCCC(C)(C)C#N)cc2c1C	ZINC000478819809	331714901	/nfs/dbraw/zinc/71/49/01/331714901.db2.gz	BZERLZOSSSIBSP-UHFFFAOYSA-N	0	0	270.376	4.494	20	30		CIEDRN
C=C(C)[C@H](NC(=O)C1=C(C)CCC1)c1ccc(F)c(F)c1	ZINC000478918877	331717119	/nfs/dbraw/zinc/71/71/19/331717119.db2.gz	ZEQFTPZAFXMWRA-INIZCTEOSA-N	0	0	291.341	4.199	20	30		CIEDRN
CCOc1ccccc1OCc1ccc(Cl)cc1C#N	ZINC000478926161	331717535	/nfs/dbraw/zinc/71/75/35/331717535.db2.gz	MARYWNMVFXWGJY-UHFFFAOYSA-N	0	0	287.746	4.189	20	30		CIEDRN
C=CCC1(C(=O)N(C)CCc2ccc(Cl)cc2)CCC1	ZINC000479074969	331719825	/nfs/dbraw/zinc/71/98/25/331719825.db2.gz	HZAUFESNWCUTRL-UHFFFAOYSA-N	0	0	291.822	4.087	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1ccc(OC2CCCCC2)cc1	ZINC000479237857	331722409	/nfs/dbraw/zinc/72/24/09/331722409.db2.gz	DEHUTTTXFAPALX-UHFFFAOYSA-N	0	0	287.403	4.046	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1cccc(OC2CCCCC2)c1	ZINC000479251922	331722856	/nfs/dbraw/zinc/72/28/56/331722856.db2.gz	WBEGADLLALGYRT-UHFFFAOYSA-N	0	0	287.403	4.046	20	30		CIEDRN
N#Cc1ccc(COc2ccc(OCC3CC3)cc2)cc1F	ZINC000479407496	331727459	/nfs/dbraw/zinc/72/74/59/331727459.db2.gz	LSDURLFUYRECKO-UHFFFAOYSA-N	0	0	297.329	4.065	20	30		CIEDRN
C[C@H](CC1CCCCC1)C(=O)N(CCC#N)CC(C)(C)C	ZINC000511146562	332928154	/nfs/dbraw/zinc/92/81/54/332928154.db2.gz	YDDNEEMJYUVDBC-OAHLLOKOSA-N	0	0	292.467	4.381	20	30		CIEDRN
CC(C)COc1cccc(NCc2ccc(C#N)c(F)c2)c1	ZINC000479481494	331732504	/nfs/dbraw/zinc/73/25/04/331732504.db2.gz	SAWFSNRXVWAWMO-UHFFFAOYSA-N	0	0	298.361	4.344	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc2oc(C(C)(C)C)nc2c1	ZINC000479497819	331733512	/nfs/dbraw/zinc/73/35/12/331733512.db2.gz	BUUSUMGBRPLZFY-UHFFFAOYSA-N	0	0	286.375	4.420	20	30		CIEDRN
C=CCCCC(=O)N[C@H]1CCCC[C@@H]1C(C)(C)C	ZINC000479498806	331733525	/nfs/dbraw/zinc/73/35/25/331733525.db2.gz	GDNHPGIRHWZCNI-KBPBESRZSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=CCCCC(=O)N[C@H](CC(C)C)c1ccccc1	ZINC000479505968	331733977	/nfs/dbraw/zinc/73/39/77/331733977.db2.gz	VFQUIHJMAOUXJE-MRXNPFEDSA-N	0	0	259.393	4.246	20	30		CIEDRN
C=CCCCC(=O)N(Cc1ccco1)Cc1cccc(C)c1	ZINC000479531841	331735440	/nfs/dbraw/zinc/73/54/40/331735440.db2.gz	OZZSYRWYSMTKLM-UHFFFAOYSA-N	0	0	297.398	4.473	20	30		CIEDRN
Cc1cc2[nH]c(CNc3ccc(CC#N)cc3)cc2c(C)c1	ZINC000479535932	331735761	/nfs/dbraw/zinc/73/57/61/331735761.db2.gz	AXWTWQSLVRMDOL-UHFFFAOYSA-N	0	0	289.382	4.463	20	30		CIEDRN
C=CCCCC(=O)NCCCc1ccc(C(C)C)cc1	ZINC000479644888	331741356	/nfs/dbraw/zinc/74/13/56/331741356.db2.gz	WXEMDLCJDVTCHQ-UHFFFAOYSA-N	0	0	273.420	4.215	20	30		CIEDRN
C=CCCCC(=O)N[C@H](CCCC)c1ccc(OC)cc1	ZINC000479638531	331741796	/nfs/dbraw/zinc/74/17/96/331741796.db2.gz	BPTIHXYOAZFRBV-QGZVFWFLSA-N	0	0	289.419	4.399	20	30		CIEDRN
C=CCCCC(=O)Nc1sc2c(c1C)CCCC2	ZINC000479770389	331745661	/nfs/dbraw/zinc/74/56/61/331745661.db2.gz	GYSOPFOQLMWJND-UHFFFAOYSA-N	0	0	263.406	4.230	20	30		CIEDRN
C=CCC1(C(=O)N[C@H](C)Cc2cc(C)cc(C)c2)CCC1	ZINC000479802919	331746187	/nfs/dbraw/zinc/74/61/87/331746187.db2.gz	ISVMKHYMAZIUMF-MRXNPFEDSA-N	0	0	285.431	4.097	20	30		CIEDRN
C=CCCCC(=O)N1CCCC2(C1)CCCCCC2	ZINC000479987205	331753126	/nfs/dbraw/zinc/75/31/26/331753126.db2.gz	ODLYOSQMQDMFLC-UHFFFAOYSA-N	0	0	263.425	4.306	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](CC(C)C)c1ccccc1OC	ZINC000480009495	331754008	/nfs/dbraw/zinc/75/40/08/331754008.db2.gz	BZVXPAYICKEOAY-INIZCTEOSA-N	0	0	289.419	4.255	20	30		CIEDRN
C=CCC1(C(=O)NCCCCCc2ccccc2)CCC1	ZINC000480033537	331755249	/nfs/dbraw/zinc/75/52/49/331755249.db2.gz	DHMCYCFFIWCWGF-UHFFFAOYSA-N	0	0	285.431	4.262	20	30		CIEDRN
C=CCC1(C(=O)N(C)CCC2CCCCC2)CCC1	ZINC000480040981	331755554	/nfs/dbraw/zinc/75/55/54/331755554.db2.gz	QFUOFVYOULJQMJ-UHFFFAOYSA-N	0	0	263.425	4.162	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cccc(C(C)(C)C)c1O	ZINC000480055812	331756067	/nfs/dbraw/zinc/75/60/67/331756067.db2.gz	SIODIGKSQJZHNZ-UHFFFAOYSA-N	0	0	287.403	4.397	20	30		CIEDRN
C=CCOc1ccc(CNc2cnn([C@@H](C)CC)c2C)cc1	ZINC000480455505	331773297	/nfs/dbraw/zinc/77/32/97/331773297.db2.gz	UTGYZZUPHFXAEN-AWEZNQCLSA-N	0	0	299.418	4.339	20	30		CIEDRN
C=CCC1(C(=O)N[C@H]2CC[C@H](Cc3ccccc3)C2)CCC1	ZINC000480531121	331776226	/nfs/dbraw/zinc/77/62/26/331776226.db2.gz	SBYYZLBAWQEOMK-MSOLQXFVSA-N	0	0	297.442	4.260	20	30		CIEDRN
Cc1ccc([C@H](Nc2ccc(C#N)cc2)c2ccccn2)cc1	ZINC000480588790	331779005	/nfs/dbraw/zinc/77/90/05/331779005.db2.gz	KMPBKJHLERGRCU-FQEVSTJZSA-N	0	0	299.377	4.463	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](c1ccccc1)C(C)(C)C	ZINC000480711372	331785707	/nfs/dbraw/zinc/78/57/07/331785707.db2.gz	MPJAMUUHQOCZGT-INIZCTEOSA-N	0	0	259.393	4.246	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(Oc2ccccn2)cc1	ZINC000480838040	331789505	/nfs/dbraw/zinc/78/95/05/331789505.db2.gz	GZXMQUHLPYGUPE-UHFFFAOYSA-N	0	0	282.343	4.169	20	30		CIEDRN
CCC[C@H](CC)Sc1ccc(Cl)c(C#N)n1	ZINC000480850289	331789992	/nfs/dbraw/zinc/78/99/92/331789992.db2.gz	CPGORLMHMYEWBH-VIFPVBQESA-N	0	0	254.786	4.277	20	30		CIEDRN
C=CCCCC(=O)Nc1cc(-c2ccccc2)nn1C(C)C	ZINC000480856755	331790026	/nfs/dbraw/zinc/79/00/26/331790026.db2.gz	KUHIDVXYQRRHCT-UHFFFAOYSA-N	0	0	297.402	4.426	20	30		CIEDRN
C=CCCCC(=O)N(CCC)[C@@H]1CCc2ccccc2C1	ZINC000481152113	331799222	/nfs/dbraw/zinc/79/92/22/331799222.db2.gz	GQOQUDZGAPTJLK-GOSISDBHSA-N	0	0	285.431	4.139	20	30		CIEDRN
C=C(C)[C@@H](N[C@H](C)c1ncc(C)o1)c1ccc(F)c(F)c1	ZINC000481578107	331809808	/nfs/dbraw/zinc/80/98/08/331809808.db2.gz	BXWFDOPUQHVAEU-IAQYHMDHSA-N	0	0	292.329	4.229	20	30		CIEDRN
C=CCCCC(=O)Nc1sccc1C(=O)C(C)(C)C	ZINC000481848079	331816019	/nfs/dbraw/zinc/81/60/19/331816019.db2.gz	WGNRBJGHFGQJSX-UHFFFAOYSA-N	0	0	279.405	4.272	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccc(C2CC2)c(C)c1	ZINC000481919111	331818673	/nfs/dbraw/zinc/81/86/73/331818673.db2.gz	IBSRQDNBEZKHKW-UHFFFAOYSA-N	0	0	272.392	4.302	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)c1cccc(C(C)=O)c1	ZINC000482186381	331826538	/nfs/dbraw/zinc/82/65/38/331826538.db2.gz	ZCRJFXRUPSUOSY-UHFFFAOYSA-N	0	0	299.414	4.098	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1cccc(Nc2ccccc2)c1	ZINC000482215582	331827238	/nfs/dbraw/zinc/82/72/38/331827238.db2.gz	VAGHYUWWIRHFIZ-UHFFFAOYSA-N	0	0	280.371	4.078	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)c1cc(F)cc(F)c1	ZINC000482800849	331846701	/nfs/dbraw/zinc/84/67/01/331846701.db2.gz	VYJCQMUYIXJMRB-UHFFFAOYSA-N	0	0	293.357	4.173	20	30		CIEDRN
C=C(C)CN(CC)C(=O)NCC(C)(C)C1=CCCCC1	ZINC000483299182	331867656	/nfs/dbraw/zinc/86/76/56/331867656.db2.gz	TZQLHERVYJDJGY-UHFFFAOYSA-N	0	0	278.440	4.121	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)C1CCCCC1	ZINC000303475518	332932047	/nfs/dbraw/zinc/93/20/47/332932047.db2.gz	RSWYWGTXMNPAHK-UHFFFAOYSA-N	0	0	263.425	4.162	20	30		CIEDRN
C=C(C)CN(CC)C(=O)C[C@@H](C)C1CCCCC1	ZINC000511441672	332932285	/nfs/dbraw/zinc/93/22/85/332932285.db2.gz	DPMPQUHHBQUXPA-CQSZACIVSA-N	0	0	251.414	4.018	20	30		CIEDRN
C=C(C)[C@H](NCC#Cc1ccccc1)c1ccc(F)c(F)c1	ZINC000483707500	331882440	/nfs/dbraw/zinc/88/24/40/331882440.db2.gz	AFTZYCIIOCBHCF-IBGZPJMESA-N	0	0	297.348	4.223	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)[C@@H]1CCCC[C@H]1CC	ZINC000483842256	331886047	/nfs/dbraw/zinc/88/60/47/331886047.db2.gz	YZULXPQPXCSJFE-HUUCEWRRSA-N	0	0	278.440	4.182	20	30		CIEDRN
CCCC[C@H](CCC)NC(=O)Nc1ccc(CC#N)cc1	ZINC000483846776	331886374	/nfs/dbraw/zinc/88/63/74/331886374.db2.gz	HBRMAIPMAPQAOP-HNNXBMFYSA-N	0	0	287.407	4.233	20	30		CIEDRN
CCC(C)(C)c1ccc(NC(=O)NCC(C)(C)C#N)cc1	ZINC000483904295	331888854	/nfs/dbraw/zinc/88/88/54/331888854.db2.gz	FDYOFXMBXZMQDS-UHFFFAOYSA-N	0	0	287.407	4.045	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)NCCC(C)(C)C	ZINC000483911382	331888859	/nfs/dbraw/zinc/88/88/59/331888859.db2.gz	GUEZBPBFJYDHLE-UHFFFAOYSA-N	0	0	280.456	4.201	20	30		CIEDRN
C=CCCCC(=O)N(Cc1cccc(F)c1)C(C)(C)C	ZINC000484282603	331895420	/nfs/dbraw/zinc/89/54/20/331895420.db2.gz	XUSOVZSRYJBNFV-UHFFFAOYSA-N	0	0	277.383	4.309	20	30		CIEDRN
C=C(C)CCSCC(=O)N(C)[C@@H](C)c1ccc(F)cc1	ZINC000507861523	331896868	/nfs/dbraw/zinc/89/68/68/331896868.db2.gz	QVHLTICRCQJTCX-ZDUSSCGKSA-N	0	0	295.423	4.045	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)c1cccc(F)c1	ZINC000303505559	332933505	/nfs/dbraw/zinc/93/35/05/332933505.db2.gz	ZMGZUDGMKJNTJA-UHFFFAOYSA-N	0	0	275.367	4.034	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N1CCC(CC)CC1	ZINC000485465867	331915092	/nfs/dbraw/zinc/91/50/92/331915092.db2.gz	VVOLTHAKWCKILG-UHFFFAOYSA-N	0	0	289.444	4.227	20	30		CIEDRN
C=CCCC(=O)N([C@H](C)c1ccccc1)C1CCCC1	ZINC000485471351	331915099	/nfs/dbraw/zinc/91/50/99/331915099.db2.gz	SWVUQIUMPCLKPH-OAHLLOKOSA-N	0	0	271.404	4.485	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1ccccc1C(F)(F)F	ZINC000485573056	331917401	/nfs/dbraw/zinc/91/74/01/331917401.db2.gz	UMFPQYWQIWBRPV-LLVKDONJSA-N	0	0	298.308	4.278	20	30		CIEDRN
C[C@@H]1C[C@H](CSCCCCC(C)(C)C#N)CCO1	ZINC000485575775	331917681	/nfs/dbraw/zinc/91/76/81/331917681.db2.gz	YAPGPYMEHMKGDH-ZIAGYGMSSA-N	0	0	269.454	4.255	20	30		CIEDRN
C=CCCCCCSCC(=O)Nc1cccc(OC)c1	ZINC000485581858	331917957	/nfs/dbraw/zinc/91/79/57/331917957.db2.gz	RWRFVELJOZJWLN-UHFFFAOYSA-N	0	0	293.432	4.113	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](C)c1ccc2ncsc2c1	ZINC000485659270	331919692	/nfs/dbraw/zinc/91/96/92/331919692.db2.gz	UTDLTYVFCCLAEQ-NWDGAFQWSA-N	0	0	288.416	4.076	20	30		CIEDRN
C=CCC1(C(=O)N2CCC[C@H]2/C=C\c2ccccc2)CCC1	ZINC000485658083	331919712	/nfs/dbraw/zinc/91/97/12/331919712.db2.gz	RFCQPIGXJVKNML-JYBLJSLWSA-N	0	0	295.426	4.437	20	30		CIEDRN
CC(C)COc1cccc(/C=C\c2ncccc2C#N)c1	ZINC000486052585	331930103	/nfs/dbraw/zinc/93/01/03/331930103.db2.gz	JSQFPHJXXODBBH-HJWRWDBZSA-N	0	0	278.355	4.158	20	30		CIEDRN
N#Cc1cccnc1/C=C/c1csc(-c2ccccc2)n1	ZINC000486076893	331930855	/nfs/dbraw/zinc/93/08/55/331930855.db2.gz	LUSIZSOZWDFMBX-CMDGGOBGSA-N	0	0	289.363	4.247	20	30		CIEDRN
N#Cc1cccnc1/C=C/c1cc(Cl)cc(Cl)c1	ZINC000486099431	331931380	/nfs/dbraw/zinc/93/13/80/331931380.db2.gz	BPQGDWIXBHCMPU-ONEGZZNKSA-N	0	0	275.138	4.430	20	30		CIEDRN
CC#CCCCC(=O)Nc1nc2c(cccc2Cl)s1	ZINC000486158147	331932476	/nfs/dbraw/zinc/93/24/76/331932476.db2.gz	OWMGFUUMOOITJQ-UHFFFAOYSA-N	0	0	292.791	4.082	20	30		CIEDRN
Cc1ccc([C@H]2CCCN2c2ccc(Cl)c(C#N)n2)cc1	ZINC000486163707	331932682	/nfs/dbraw/zinc/93/26/82/331932682.db2.gz	JKJRMEXXYBLKHO-MRXNPFEDSA-N	0	0	297.789	4.257	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)c1cccc(Cl)c1C	ZINC000486190322	331933143	/nfs/dbraw/zinc/93/31/43/331933143.db2.gz	JJCIEWKLICBLJS-UHFFFAOYSA-N	0	0	292.810	4.241	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1ccc(Cl)cc1F	ZINC000486791023	331944820	/nfs/dbraw/zinc/94/48/20/331944820.db2.gz	ODRAVDZNDJBBJM-NSHDSACASA-N	0	0	282.746	4.052	20	30		CIEDRN
CC(C)(C)[C@@H]1C[C@H](Nc2cc(Cl)ccc2C#N)CCO1	ZINC000487070192	331955910	/nfs/dbraw/zinc/95/59/10/331955910.db2.gz	CCCJMSGORZFMRY-HIFRSBDPSA-N	0	0	292.810	4.217	20	30		CIEDRN
Cc1ccc(NCc2cccc(C#N)c2)cc1OC(C)C	ZINC000487166453	331957870	/nfs/dbraw/zinc/95/78/70/331957870.db2.gz	XBCBCYIGUYVKOI-UHFFFAOYSA-N	0	0	280.371	4.266	20	30		CIEDRN
CC(C)(C)c1cc(COc2ccc(C#N)c(Cl)c2)no1	ZINC000487175007	331958260	/nfs/dbraw/zinc/95/82/60/331958260.db2.gz	GTBVFWQJTBQJIM-UHFFFAOYSA-N	0	0	290.750	4.076	20	30		CIEDRN
Cc1ccc(NCc2ccc(C#N)s2)cc1OC(C)C	ZINC000487204686	331959273	/nfs/dbraw/zinc/95/92/73/331959273.db2.gz	AJRCIZXGELGOCE-UHFFFAOYSA-N	0	0	286.400	4.328	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1ccc(F)c(F)c1)c1ccccc1	ZINC000487604149	331976782	/nfs/dbraw/zinc/97/67/82/331976782.db2.gz	FRLFZHZGNLQKSY-CQSZACIVSA-N	0	0	287.309	4.263	20	30		CIEDRN
C=CCC[C@@H](C(=O)N1CCCC[C@@H]1C)c1ccccc1	ZINC000487611063	331977048	/nfs/dbraw/zinc/97/70/48/331977048.db2.gz	XKRPWMZLGNJPKS-DOTOQJQBSA-N	0	0	271.404	4.137	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@@H]1CCCC[C@H]1C)c1ccccc1	ZINC000487613644	331977182	/nfs/dbraw/zinc/97/71/82/331977182.db2.gz	FFHQNGGNKSYQST-HYVNUMGLSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CCC[C@H](C(=O)N1CCCCCC1)c1ccccc1	ZINC000487638704	331977926	/nfs/dbraw/zinc/97/79/26/331977926.db2.gz	UYTSINYNCVMBAV-KRWDZBQOSA-N	0	0	271.404	4.139	20	30		CIEDRN
C=CCC[C@@H](C(=O)N(C)Cc1ccccc1)c1ccccc1	ZINC000487652963	331978257	/nfs/dbraw/zinc/97/82/57/331978257.db2.gz	AULGYAZKHGSDLY-LJQANCHMSA-N	0	0	293.410	4.395	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N1CCC[C@@H]1CCC1CCCC1	ZINC000487683430	331978896	/nfs/dbraw/zinc/97/88/96/331978896.db2.gz	DOESCFIFFDQYRW-GDBMZVCRSA-N	0	0	278.440	4.095	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1ccccc1OC(C)C	ZINC000487886067	331983258	/nfs/dbraw/zinc/98/32/58/331983258.db2.gz	VUAODZUQMGYRCI-CQSZACIVSA-N	0	0	288.391	4.046	20	30		CIEDRN
Cc1ccccc1[C@@H](CC(C)C)Nc1ncccc1C#N	ZINC000488212755	331994066	/nfs/dbraw/zinc/99/40/66/331994066.db2.gz	YFMNCWNHYHUXNJ-QGZVFWFLSA-N	0	0	279.387	4.461	20	30		CIEDRN
N#Cc1ccc(SCc2cccc(F)c2C#N)c(F)c1	ZINC000488258554	331996496	/nfs/dbraw/zinc/99/64/96/331996496.db2.gz	YMQMCLGDDBTHTJ-UHFFFAOYSA-N	0	0	286.306	4.000	20	30		CIEDRN
CC(C)O[C@H](COc1ccc(C#N)cc1F)c1ccccc1	ZINC000488276201	331996959	/nfs/dbraw/zinc/99/69/59/331996959.db2.gz	CUQNTEQZSYVXGZ-GOSISDBHSA-N	0	0	299.345	4.242	20	30		CIEDRN
N#Cc1c(F)cccc1CSc1ccccc1F	ZINC000488278154	331997018	/nfs/dbraw/zinc/99/70/18/331997018.db2.gz	MIXZFIVVYVWZCS-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1ccc(CSC)cc1	ZINC000488294684	331997794	/nfs/dbraw/zinc/99/77/94/331997794.db2.gz	KORPNKIZXWGWKD-OAHLLOKOSA-N	0	0	290.432	4.122	20	30		CIEDRN
C=CCn1cccc1C(=O)N(C)Cc1ccc(C(C)C)cc1	ZINC000488363742	332002287	/nfs/dbraw/zinc/00/22/87/332002287.db2.gz	IBAPGEZMNYCLIC-UHFFFAOYSA-N	0	0	296.414	4.070	20	30		CIEDRN
Cc1cccc2c1[C@H](C)C[C@H]2CC(=O)N[C@](C)(C#N)C(C)C	ZINC000488396724	332003877	/nfs/dbraw/zinc/00/38/77/332003877.db2.gz	YPJVSQYPXPJWLS-ZRGWGRIASA-N	0	0	298.430	4.030	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1cc(CC)ccc1CC	ZINC000488508022	332014683	/nfs/dbraw/zinc/01/46/83/332014683.db2.gz	SENAIVFMGLKGDK-INIZCTEOSA-N	0	0	286.419	4.384	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1csc2ccccc12	ZINC000488554076	332017022	/nfs/dbraw/zinc/01/70/22/332017022.db2.gz	FPVUUNWUQLTSAP-GFCCVEGCSA-N	0	0	286.400	4.474	20	30		CIEDRN
N#Cc1cc(F)ccc1CSCc1ccc(F)cc1	ZINC000488587852	332019495	/nfs/dbraw/zinc/01/94/95/332019495.db2.gz	QZTPQORWOLZVMI-UHFFFAOYSA-N	0	0	275.323	4.270	20	30		CIEDRN
C=CCC[C@H](C(=O)N(CC)CC(C)C)c1ccccc1	ZINC000488613558	332020161	/nfs/dbraw/zinc/02/01/61/332020161.db2.gz	NOTMHIVJTBJAQU-KRWDZBQOSA-N	0	0	273.420	4.241	20	30		CIEDRN
C=CC[C@H](C(=O)NCc1ccc(C)s1)c1ccccc1	ZINC000488623935	332020300	/nfs/dbraw/zinc/02/03/00/332020300.db2.gz	ROVRSWXYLWXMLF-INIZCTEOSA-N	0	0	285.412	4.033	20	30		CIEDRN
C=CCC[C@H](C(=O)N(CC)CC(F)(F)F)c1ccccc1	ZINC000488626592	332020343	/nfs/dbraw/zinc/02/03/43/332020343.db2.gz	KVJNKWDCXNBWEL-AWEZNQCLSA-N	0	0	299.336	4.147	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1ccc2occ(C)c2c1	ZINC000488657346	332021029	/nfs/dbraw/zinc/02/10/29/332021029.db2.gz	HAKDYKAJRSGPQU-AWEZNQCLSA-N	0	0	284.359	4.314	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1ccccc1OC1CC1	ZINC000498550374	332021723	/nfs/dbraw/zinc/02/17/23/332021723.db2.gz	WVJXHWOHVWXQCD-UHFFFAOYSA-N	0	0	287.403	4.046	20	30		CIEDRN
C=CCC[C@H](C(=O)N[C@H](C)[C@@H](C)CC)c1ccccc1	ZINC000488688576	332021744	/nfs/dbraw/zinc/02/17/44/332021744.db2.gz	IOIUQUAYGBKGHM-UXLLHSPISA-N	0	0	273.420	4.287	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000488714876	332022306	/nfs/dbraw/zinc/02/23/06/332022306.db2.gz	VKJPTCUXXYKNDO-CQSZACIVSA-N	0	0	294.345	4.371	20	30		CIEDRN
C=CCC[C@@H](C(=O)NC[C@H]1CC=CCC1)c1ccccc1	ZINC000488719630	332022588	/nfs/dbraw/zinc/02/25/88/332022588.db2.gz	XISPQVZOZVDJJY-FUHWJXTLSA-N	0	0	283.415	4.209	20	30		CIEDRN
N#Cc1cccnc1N[C@H]1CCCc2sc(Cl)cc21	ZINC000488732953	332023015	/nfs/dbraw/zinc/02/30/15/332023015.db2.gz	IOMJSNXRIRGBAG-NSHDSACASA-N	0	0	289.791	4.158	20	30		CIEDRN
N#Cc1cccnc1N[C@@H]1CCCc2sc(Cl)cc21	ZINC000488732952	332023038	/nfs/dbraw/zinc/02/30/38/332023038.db2.gz	IOMJSNXRIRGBAG-LLVKDONJSA-N	0	0	289.791	4.158	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1ccc(SC2CC2)cc1	ZINC000488817349	332027048	/nfs/dbraw/zinc/02/70/48/332027048.db2.gz	ODPCRQQHQADEIZ-CQSZACIVSA-N	0	0	287.428	4.122	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1cc2cc(C)ccc2nc1C	ZINC000488844016	332028909	/nfs/dbraw/zinc/02/89/09/332028909.db2.gz	WCRWLSBQJJKNSC-MRXNPFEDSA-N	0	0	294.398	4.032	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1ccc2ccccc2c1	ZINC000488844966	332029100	/nfs/dbraw/zinc/02/91/00/332029100.db2.gz	PDOSBOSEPPBSRM-QGZVFWFLSA-N	0	0	265.356	4.021	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)CCSc1ccc(C)cc1	ZINC000488860349	332029898	/nfs/dbraw/zinc/02/98/98/332029898.db2.gz	TXGGQBHNVGXHSZ-OAHLLOKOSA-N	0	0	289.444	4.044	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@@H](C)c1ccc(Cl)s1	ZINC000488878809	332031594	/nfs/dbraw/zinc/03/15/94/332031594.db2.gz	NEDYQNWUPSBWPP-WDEREUQCSA-N	0	0	283.824	4.072	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)CCC(C)(C)c1ccccc1	ZINC000488881505	332031871	/nfs/dbraw/zinc/03/18/71/332031871.db2.gz	WNXPYNHQXXXYPO-KRWDZBQOSA-N	0	0	285.431	4.312	20	30		CIEDRN
C=CC[C@H](C)NC(=O)C[C@H]1C[C@H](C)c2c1cccc2C	ZINC000488930011	332034261	/nfs/dbraw/zinc/03/42/61/332034261.db2.gz	DWGDDLZCSIUPHS-SOUVJXGZSA-N	0	0	271.404	4.057	20	30		CIEDRN
C=CC1CCN(C(=O)C[C@H]2C[C@H](C)c3c2cccc3C)CC1	ZINC000488952054	332034998	/nfs/dbraw/zinc/03/49/98/332034998.db2.gz	TYQGHFQFEVFYHM-DOTOQJQBSA-N	0	0	297.442	4.401	20	30		CIEDRN
C=CCCCN(C)C(=O)C[C@H]1C[C@H](C)c2c1cccc2C	ZINC000488960534	332035606	/nfs/dbraw/zinc/03/56/06/332035606.db2.gz	LOORPGMCMPSKTE-JKSUJKDBSA-N	0	0	285.431	4.401	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@@H]1CC[C@H]2CCC[C@H]2C1)c1ccccc1	ZINC000488995229	332037178	/nfs/dbraw/zinc/03/71/78/332037178.db2.gz	HUUAJZYKXGPHFG-LULLPPNCSA-N	0	0	297.442	4.431	20	30		CIEDRN
C=C[C@H]1CCCCN1Cc1sc(C)nc1C(F)(F)F	ZINC000489440985	332052882	/nfs/dbraw/zinc/05/28/82/332052882.db2.gz	UCMFVNKSURJWQI-JTQLQIEISA-N	0	0	290.354	4.011	20	30		CIEDRN
C=C[C@@H]1CCCCN1Cc1sccc1Br	ZINC000489445815	332053149	/nfs/dbraw/zinc/05/31/49/332053149.db2.gz	HAPOTPTUHKZJTJ-SNVBAGLBSA-N	0	0	286.238	4.051	20	30		CIEDRN
CCc1cccc(NC(=O)c2cccc(CC#N)c2)c1CC	ZINC000489541607	332058556	/nfs/dbraw/zinc/05/85/56/332058556.db2.gz	BBSTWJNJNOXZOU-UHFFFAOYSA-N	0	0	292.382	4.130	20	30		CIEDRN
N#Cc1cc(F)ccc1CN1CCC(c2ccccc2)CC1	ZINC000489579117	332060135	/nfs/dbraw/zinc/06/01/35/332060135.db2.gz	RUESYYTZGRKINM-UHFFFAOYSA-N	0	0	294.373	4.077	20	30		CIEDRN
N#Cc1cc(F)ccc1CN1CCC[C@H]1c1cccc(F)c1	ZINC000489599969	332060830	/nfs/dbraw/zinc/06/08/30/332060830.db2.gz	VXWRNAGGCZXNAX-SFHVURJKSA-N	0	0	298.336	4.174	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H]1CCC[C@H](c2ccccc2)C1	ZINC000489642901	332062700	/nfs/dbraw/zinc/06/27/00/332062700.db2.gz	RPOIEFPNYLMSLA-YQVWRLOYSA-N	0	0	285.431	4.431	20	30		CIEDRN
C=CCCCC(=O)N[C@@H]1CCC[C@@H](c2ccccc2)C1	ZINC000489658287	332063361	/nfs/dbraw/zinc/06/33/61/332063361.db2.gz	BXGVMCLRSMKXRK-IAGOWNOFSA-N	0	0	271.404	4.185	20	30		CIEDRN
CC(C)(C)c1nsc(Oc2cc(Cl)ccc2C#N)n1	ZINC000489658813	332063375	/nfs/dbraw/zinc/06/33/75/332063375.db2.gz	KNJGXMPXKTVVBW-UHFFFAOYSA-N	0	0	293.779	4.153	20	30		CIEDRN
C=CCC1(C(=O)NCc2cc3ccccc3s2)CCC1	ZINC000489688777	332064827	/nfs/dbraw/zinc/06/48/27/332064827.db2.gz	QGRQTMWUHYEOQU-UHFFFAOYSA-N	0	0	285.412	4.264	20	30		CIEDRN
C=CC[C@H](C(=O)N(CC)C[C@H](C)CC)c1ccccc1	ZINC000489695865	332065170	/nfs/dbraw/zinc/06/51/70/332065170.db2.gz	FAWYOIKICJLUJX-WBVHZDCISA-N	0	0	273.420	4.241	20	30		CIEDRN
C=CC[C@H](C(=O)N(CC)C[C@@H](C)CC)c1ccccc1	ZINC000489695863	332065287	/nfs/dbraw/zinc/06/52/87/332065287.db2.gz	FAWYOIKICJLUJX-RDJZCZTQSA-N	0	0	273.420	4.241	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1cccc2ccsc21	ZINC000489733675	332066439	/nfs/dbraw/zinc/06/64/39/332066439.db2.gz	LWJLSOBZLPHDEZ-UHFFFAOYSA-N	0	0	273.401	4.233	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1cc(C)cc(F)c1)c1ccccc1	ZINC000489738765	332066472	/nfs/dbraw/zinc/06/64/72/332066472.db2.gz	OBLOYNDZAZRIQL-KRWDZBQOSA-N	0	0	283.346	4.433	20	30		CIEDRN
C=CCC[C@@H](NC(=O)NCc1occc1C)c1ccccc1	ZINC000489760428	332066994	/nfs/dbraw/zinc/06/69/94/332066994.db2.gz	JIPZWPRQXLXIHM-MRXNPFEDSA-N	0	0	298.386	4.095	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)C[C@H](C)c1cccc(F)c1	ZINC000489770218	332067484	/nfs/dbraw/zinc/06/74/84/332067484.db2.gz	PMVHMXUDJAQSMU-ZDUSSCGKSA-N	0	0	277.383	4.038	20	30		CIEDRN
C=CCN(C(=O)Nc1ccc(C2CCC2)cc1)C1CC1	ZINC000489783963	332067752	/nfs/dbraw/zinc/06/77/52/332067752.db2.gz	WUSFTMGKABXFBT-UHFFFAOYSA-N	0	0	270.376	4.136	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)CCc1cc2ccccc2o1	ZINC000489801470	332068375	/nfs/dbraw/zinc/06/83/75/332068375.db2.gz	OTCFXAJFIZWBIQ-UHFFFAOYSA-N	0	0	285.387	4.084	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)CC[C@H](C)c1ccccc1	ZINC000489825791	332069233	/nfs/dbraw/zinc/06/92/33/332069233.db2.gz	GXNLWYPHJVTUBR-HNNXBMFYSA-N	0	0	273.420	4.289	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1cccc2c(C)c(C)[nH]c21	ZINC000489905580	332072600	/nfs/dbraw/zinc/07/26/00/332072600.db2.gz	IRXCRGMJYSSHJA-UHFFFAOYSA-N	0	0	284.403	4.117	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)CCc1c[nH]c2c1cccc2C	ZINC000489964672	332074763	/nfs/dbraw/zinc/07/47/63/332074763.db2.gz	JVWFAVRZJUXLLQ-UHFFFAOYSA-N	0	0	298.430	4.127	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1ccc(F)c(CSC)c1	ZINC000490013871	332076610	/nfs/dbraw/zinc/07/66/10/332076610.db2.gz	OCDFKNDBBYNQIE-UHFFFAOYSA-N	0	0	295.423	4.021	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1	ZINC000490055327	332078915	/nfs/dbraw/zinc/07/89/15/332078915.db2.gz	BNCWJVLNJFOPLP-NEPJUHHUSA-N	0	0	291.357	4.074	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@@H]1CCCC[C@@H]1C(F)(F)F	ZINC000490060306	332079268	/nfs/dbraw/zinc/07/92/68/332079268.db2.gz	PGUWJKFLCNXCOP-NEPJUHHUSA-N	0	0	291.357	4.074	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)Cc1cccc2ccccc21	ZINC000490065025	332079573	/nfs/dbraw/zinc/07/95/73/332079573.db2.gz	CUVHVQPEYWZSJR-UHFFFAOYSA-N	0	0	281.399	4.101	20	30		CIEDRN
C=C(C)CNC(=O)C[C@@H](Cc1ccccc1)c1ccccc1	ZINC000490070020	332079896	/nfs/dbraw/zinc/07/98/96/332079896.db2.gz	GIIBNBHXNYVBKW-LJQANCHMSA-N	0	0	293.410	4.095	20	30		CIEDRN
C=C(C)CNC(=O)c1ccc(CSc2ccccc2)cc1	ZINC000490073215	332080155	/nfs/dbraw/zinc/08/01/55/332080155.db2.gz	DQNHFHXUPYFUFO-UHFFFAOYSA-N	0	0	297.423	4.285	20	30		CIEDRN
C=CCN(C)C(=O)Cc1coc2cc(C)c(C(C)C)cc12	ZINC000490078199	332080402	/nfs/dbraw/zinc/08/04/02/332080402.db2.gz	GHLQYICBJJVLAV-UHFFFAOYSA-N	0	0	285.387	4.052	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)CC1CCCCCC1	ZINC000490200295	332084397	/nfs/dbraw/zinc/08/43/97/332084397.db2.gz	XLABGWMGVRHHIV-UHFFFAOYSA-N	0	0	289.419	4.197	20	30		CIEDRN
C=CCC[C@H](C(=O)N(CC)CCC1CC1)c1ccccc1	ZINC000490236732	332085077	/nfs/dbraw/zinc/08/50/77/332085077.db2.gz	DVRPKQIOOLFSJA-SFHVURJKSA-N	0	0	285.431	4.385	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)C[C@@H]1CCC[C@@H](C)C1	ZINC000490279348	332086068	/nfs/dbraw/zinc/08/60/68/332086068.db2.gz	ZQPHIWUJWLCFFV-HZPDHXFCSA-N	0	0	289.419	4.053	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)C[C@H]1CCC[C@H](C)C1	ZINC000490279347	332086086	/nfs/dbraw/zinc/08/60/86/332086086.db2.gz	ZQPHIWUJWLCFFV-HOTGVXAUSA-N	0	0	289.419	4.053	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C(C)C)C1CCCCC1	ZINC000490427441	332089068	/nfs/dbraw/zinc/08/90/68/332089068.db2.gz	AAZPIBNPDMYNJP-UHFFFAOYSA-N	0	0	263.425	4.325	20	30		CIEDRN
C=CCN(C)C(=O)c1ccc(-c2cccc(C(C)C)c2)o1	ZINC000490918440	332129143	/nfs/dbraw/zinc/12/91/43/332129143.db2.gz	JOAFQDWEZVCRKZ-UHFFFAOYSA-N	0	0	283.371	4.328	20	30		CIEDRN
C/C=C/C=C\C(=O)Nc1ccccc1SC[C@@H](C)C#N	ZINC000491559865	332238319	/nfs/dbraw/zinc/23/83/19/332238319.db2.gz	BWVVDOJFGPOYNE-HWWURPQHSA-N	0	0	286.400	4.009	20	30		CIEDRN
C=CCn1c2ccccc2nc1SCCCCCOC	ZINC000491795319	332354628	/nfs/dbraw/zinc/35/46/28/332354628.db2.gz	KZGQAVPDCJKQHP-UHFFFAOYSA-N	0	0	290.432	4.131	20	30		CIEDRN
C#C[C@H](C)N(C)C(=O)Nc1ccc(SC(C)(C)C)cc1	ZINC000491817830	332368001	/nfs/dbraw/zinc/36/80/01/332368001.db2.gz	JOMLUKNISUGLNB-LBPRGKRZSA-N	0	0	290.432	4.063	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)/C=C/C1CC1	ZINC000492032808	332379860	/nfs/dbraw/zinc/37/98/60/332379860.db2.gz	OIJNYYZFIHALOQ-VAWYXSNFSA-N	0	0	269.388	4.443	20	30		CIEDRN
C/C=C(/C=C\C(=O)N[C@H](CCCC#N)c1ccccc1)CC	ZINC000492803023	332414135	/nfs/dbraw/zinc/41/41/35/332414135.db2.gz	FNKXKERQAUMFAX-SQXNCRALSA-N	0	0	296.414	4.450	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)CC/C=C/c1ccccc1	ZINC000172406524	335104689	/nfs/dbraw/zinc/10/46/89/335104689.db2.gz	KKKZSAZHQVSWCS-WEVVVXLNSA-N	0	0	290.366	4.299	20	30		CIEDRN
CCN(C(=O)/C=C/C1CCCC1)[C@H](C)c1ccc(C#N)cc1	ZINC000493373698	332437589	/nfs/dbraw/zinc/43/75/89/332437589.db2.gz	VNLMTJADUXOZPV-NRMKIYEFSA-N	0	0	296.414	4.214	20	30		CIEDRN
C[C@H](CCCC(F)(F)F)Nc1ncc(C#N)cc1Cl	ZINC000493471406	332441724	/nfs/dbraw/zinc/44/17/24/332441724.db2.gz	CQBQVYUDGAVZTA-MRVPVSSYSA-N	0	0	291.704	4.140	20	30		CIEDRN
N#CCc1ccccc1NC(=O)/C=C\c1ccc(Cl)cc1	ZINC000493857763	332456721	/nfs/dbraw/zinc/45/67/21/332456721.db2.gz	NXEHPTMFHAVLCW-YFHOEESVSA-N	0	0	296.757	4.058	20	30		CIEDRN
CC1(C(=O)Nc2ccc(Oc3ccccc3)c(C#N)c2)CC1	ZINC000493999758	332460331	/nfs/dbraw/zinc/46/03/31/332460331.db2.gz	LVSKDXSYMAATQR-UHFFFAOYSA-N	0	0	292.338	4.089	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)N[C@@H](c1ccccc1)C(C)C	ZINC000494214695	332466893	/nfs/dbraw/zinc/46/68/93/332466893.db2.gz	CHHZNIJRLIUESP-IAGOWNOFSA-N	0	0	286.419	4.134	20	30		CIEDRN
C=CC[C@H](C)[C@H](C)Nc1cc(NC(=O)NCC)ccc1C	ZINC000494440659	332473261	/nfs/dbraw/zinc/47/32/61/332473261.db2.gz	YPOHUQIMNMLTNZ-JSGCOSHPSA-N	0	0	289.423	4.149	20	30		CIEDRN
C=CCC[C@@H](CC)Nc1cc(NC(=O)NCC)ccc1C	ZINC000494513893	332476590	/nfs/dbraw/zinc/47/65/90/332476590.db2.gz	VPRGYVPTQFYGSU-CQSZACIVSA-N	0	0	289.423	4.293	20	30		CIEDRN
C[C@@H](CC(=O)Nc1ccc(C#N)cc1Cl)c1ccccc1	ZINC000494633575	332481118	/nfs/dbraw/zinc/48/11/18/332481118.db2.gz	QMMPAUUCEQHVRI-LBPRGKRZSA-N	0	0	298.773	4.344	20	30		CIEDRN
C=CC1CCN(C(=O)C(C)(C)CCCc2ccccc2)CC1	ZINC000494729320	332484555	/nfs/dbraw/zinc/48/45/55/332484555.db2.gz	HMZKWWCODHRVDL-UHFFFAOYSA-N	0	0	299.458	4.460	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N[C@@H](C)CCCC(F)(F)F	ZINC000494793158	332485840	/nfs/dbraw/zinc/48/58/40/332485840.db2.gz	IMBMDULJKXMQGI-NEPJUHHUSA-N	0	0	294.361	4.152	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)C1CCC(C)(C)CC1	ZINC000494809497	332486273	/nfs/dbraw/zinc/48/62/73/332486273.db2.gz	MGBJJIWPGOQUKA-UHFFFAOYSA-N	0	0	291.460	4.479	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cnn(CC(C)C)c1C(C)C	ZINC000495132085	332507960	/nfs/dbraw/zinc/50/79/60/332507960.db2.gz	SKNYCSBAYNBSJV-UHFFFAOYSA-N	0	0	291.439	4.203	20	30		CIEDRN
CC[C@@H](CC#N)NC(=O)Nc1cccc(-c2ccccc2)c1	ZINC000495594273	332524079	/nfs/dbraw/zinc/52/40/79/332524079.db2.gz	SIJXVWYBCZKMJI-INIZCTEOSA-N	0	0	293.370	4.167	20	30		CIEDRN
Cc1ccc([C@@H](C)N(C)c2cccc(F)c2C#N)cc1	ZINC000498842214	332574044	/nfs/dbraw/zinc/57/40/44/332574044.db2.gz	YOMBYTQQNJEAFV-CYBMUJFWSA-N	0	0	268.335	4.203	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@H]1CCCC(F)(F)C1	ZINC000499859518	332594779	/nfs/dbraw/zinc/59/47/79/332594779.db2.gz	XYHKJZURKDXZQH-ZDUSSCGKSA-N	0	0	273.367	4.017	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCC1(CC)CCCCC1	ZINC000499931709	332595988	/nfs/dbraw/zinc/59/59/88/332595988.db2.gz	PMXHXVPEKYKOFK-UHFFFAOYSA-N	0	0	251.414	4.065	20	30		CIEDRN
C=CCCC1(C(=O)N2CCCc3cc(Cl)ccc32)CC1	ZINC000500195582	332602487	/nfs/dbraw/zinc/60/24/87/332602487.db2.gz	BKNVCWGVXOYAPC-UHFFFAOYSA-N	0	0	289.806	4.366	20	30		CIEDRN
Cc1ccc(C#N)c(NC[C@@H]2CCCC[C@H]2C(F)(F)F)n1	ZINC000500296328	332604363	/nfs/dbraw/zinc/60/43/63/332604363.db2.gz	KKAWGPYKUQNSDM-QWHCGFSZSA-N	0	0	297.324	4.042	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@@H](CC)c1cccc(Cl)c1	ZINC000500440911	332609273	/nfs/dbraw/zinc/60/92/73/332609273.db2.gz	NTRXCAAJAWVHHW-HNNXBMFYSA-N	0	0	294.826	4.399	20	30		CIEDRN
C=CCCc1ccccc1NCc1ccc2c[nH]nc2c1	ZINC000500451666	332609673	/nfs/dbraw/zinc/60/96/73/332609673.db2.gz	NGPXAYOXBKAVQV-UHFFFAOYSA-N	0	0	277.371	4.294	20	30		CIEDRN
C=CCCc1ccccc1NCc1ccc(C)cn1	ZINC000500449934	332609728	/nfs/dbraw/zinc/60/97/28/332609728.db2.gz	FKFSYIKCNYQWJC-UHFFFAOYSA-N	0	0	252.361	4.121	20	30		CIEDRN
CCCc1ccccc1NCc1ccc(C#N)cc1OC	ZINC000500875729	332620959	/nfs/dbraw/zinc/62/09/59/332620959.db2.gz	JOOROCQFONCSOY-UHFFFAOYSA-N	0	0	280.371	4.131	20	30		CIEDRN
CCOc1ccc(C#N)cc1NCc1ccc(Cl)s1	ZINC000500974617	332623381	/nfs/dbraw/zinc/62/33/81/332623381.db2.gz	PJIMQUCCEWNDHD-UHFFFAOYSA-N	0	0	292.791	4.284	20	30		CIEDRN
C=CCOc1cccc(CNc2cc(C#N)ccc2C)c1	ZINC000501000594	332623897	/nfs/dbraw/zinc/62/38/97/332623897.db2.gz	KDFBEWSQAHJLIU-UHFFFAOYSA-N	0	0	278.355	4.044	20	30		CIEDRN
C=CCCCC(=O)N[C@@]1(c2cccc(C)c2)C[C@H]1CC	ZINC000501629194	332637051	/nfs/dbraw/zinc/63/70/51/332637051.db2.gz	LPMVZCZYRHHREH-QAPCUYQASA-N	0	0	271.404	4.093	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](c1ccc(F)cc1)C(C)C	ZINC000501655809	332637990	/nfs/dbraw/zinc/63/79/90/332637990.db2.gz	LEKIRNZWZLFEHI-BBRMVZONSA-N	0	0	277.383	4.241	20	30		CIEDRN
C=CCCc1ccccc1N[C@H]1CCC[C@@H](C#N)C1	ZINC000502310089	332653238	/nfs/dbraw/zinc/65/32/38/332653238.db2.gz	OCWYCWIWASOGAR-ZBFHGGJFSA-N	0	0	254.377	4.299	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)[C@@H](CC)c1ccccc1	ZINC000503090688	332681267	/nfs/dbraw/zinc/68/12/67/332681267.db2.gz	ZPKCURPJKYEAAR-IBGZPJMESA-N	0	0	293.410	4.395	20	30		CIEDRN
CNc1ccc(C#N)cc1NC(=O)[C@H]1CC[C@H](C(C)C)CC1	ZINC000503266732	332685242	/nfs/dbraw/zinc/68/52/42/332685242.db2.gz	KMZIVCMRKYAWQH-SHTZXODSSA-N	0	0	299.418	4.001	20	30		CIEDRN
Cc1ccc(NC(=O)c2cc(C#N)ccc2Cl)cc1C	ZINC000503448894	332689859	/nfs/dbraw/zinc/68/98/59/332689859.db2.gz	ZNDPHGUJOWIDKN-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
C/C(=C/c1ccccc1C(F)(F)F)CN(CC#N)C1CC1	ZINC000503953346	332700821	/nfs/dbraw/zinc/70/08/21/332700821.db2.gz	OATVDBYXOIOVAW-BENRWUELSA-N	0	0	294.320	4.097	20	30		CIEDRN
CC[C@H](CC(=O)Nc1cccc(C#N)c1)c1ccccc1	ZINC000504486607	332713081	/nfs/dbraw/zinc/71/30/81/332713081.db2.gz	BRXDQCORLKYASB-OAHLLOKOSA-N	0	0	278.355	4.081	20	30		CIEDRN
CCc1cccc(NC(=O)c2cc(C#N)ccc2Cl)c1	ZINC000504551297	332714555	/nfs/dbraw/zinc/71/45/55/332714555.db2.gz	AODFVWASYULCOL-UHFFFAOYSA-N	0	0	284.746	4.026	20	30		CIEDRN
C=CCCC(=O)N[C@@H](C)c1ccc(SC(C)C)cc1	ZINC000504734337	332719725	/nfs/dbraw/zinc/71/97/25/332719725.db2.gz	YGNIOHGKPRKRDL-ZDUSSCGKSA-N	0	0	277.433	4.331	20	30		CIEDRN
Cc1ccc([C@H](C)NC(=O)c2cc(C#N)ccc2Cl)cc1	ZINC000504826261	332721697	/nfs/dbraw/zinc/72/16/97/332721697.db2.gz	QERQJUARCKTIIX-LBPRGKRZSA-N	0	0	298.773	4.011	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N(C)[C@H](C)CC	ZINC000505023818	332728189	/nfs/dbraw/zinc/72/81/89/332728189.db2.gz	OXEDZIQASNQMCV-CYBMUJFWSA-N	0	0	260.381	4.067	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)NCCC1=CCCC1	ZINC000505046275	332729122	/nfs/dbraw/zinc/72/91/22/332729122.db2.gz	RFQOWTDEKJZRFC-UHFFFAOYSA-N	0	0	284.403	4.427	20	30		CIEDRN
C=CCN(C(=O)[C@H](CC)c1ccccc1)c1ccccc1	ZINC000505065146	332729729	/nfs/dbraw/zinc/72/97/29/332729729.db2.gz	LQLMRBGAEFIDCD-GOSISDBHSA-N	0	0	279.383	4.399	20	30		CIEDRN
CCC[C@H](C)C(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl	ZINC000505330613	332737554	/nfs/dbraw/zinc/73/75/54/332737554.db2.gz	LEHKQPCBBXEDKL-CABZTGNLSA-N	0	0	299.201	4.110	20	30		CIEDRN
C=C(C)CCSc1nnc(-c2ccco2)n1CC(C)C	ZINC000505449753	332741042	/nfs/dbraw/zinc/74/10/42/332741042.db2.gz	UARMNGWVNHFLJS-UHFFFAOYSA-N	0	0	291.420	4.252	20	30		CIEDRN
C=C(C)CCSc1nnc(C2CC2)n1-c1ccccc1	ZINC000505488798	332742211	/nfs/dbraw/zinc/74/22/11/332742211.db2.gz	XCMCNGWDLDJUMS-UHFFFAOYSA-N	0	0	285.416	4.203	20	30		CIEDRN
C=C(C)CCOc1ccc(N(C)C(=O)C(C)(C)C)cc1	ZINC000505540002	332743543	/nfs/dbraw/zinc/74/35/43/332743543.db2.gz	KFMCVJGITPVLFZ-UHFFFAOYSA-N	0	0	275.392	4.041	20	30		CIEDRN
CCC[C@@H](C)C(=O)N[C@@H](C#N)c1ccc(C(C)(C)C)cc1	ZINC000505825359	332753922	/nfs/dbraw/zinc/75/39/22/332753922.db2.gz	IVWZLOCJMWAYQN-CJNGLKHVSA-N	0	0	286.419	4.101	20	30		CIEDRN
COc1ccccc1[C@H](C)N[C@H](C)c1ccc(C#N)cc1F	ZINC000512661571	332978576	/nfs/dbraw/zinc/97/85/76/332978576.db2.gz	SPCKTLXOSVZRRR-OLZOCXBDSA-N	0	0	298.361	4.118	20	30		CIEDRN
CCCCC[C@H]1CCCN1C(=O)NCC(C)(C)CCC#N	ZINC000513107805	333004862	/nfs/dbraw/zinc/00/48/62/333004862.db2.gz	IJLAIADCWALNJF-HNNXBMFYSA-N	0	0	293.455	4.071	20	30		CIEDRN
CCCCC1CCC(CNC(=O)C2(C#N)CCCC2)CC1	ZINC000513126415	333005683	/nfs/dbraw/zinc/00/56/83/333005683.db2.gz	SFHOOZIWCWXMHP-UHFFFAOYSA-N	0	0	290.451	4.183	20	30		CIEDRN
C=C(C)CCN[C@@H](c1c[nH]c2ccccc21)C(F)(F)F	ZINC000513158107	333006650	/nfs/dbraw/zinc/00/66/50/333006650.db2.gz	GCVRVIDPLGJKLJ-AWEZNQCLSA-N	0	0	282.309	4.327	20	30		CIEDRN
C=CCCCC(=O)N[C@@H]1CCSc2ccc(Cl)cc21	ZINC000175141003	333015515	/nfs/dbraw/zinc/01/55/15/333015515.db2.gz	OHACHXASFZQHIL-CYBMUJFWSA-N	0	0	295.835	4.349	20	30		CIEDRN
C=CCCCN(C)C(=O)[C@@H]1CCC[C@H]2CCCC[C@H]21	ZINC000513377023	333016442	/nfs/dbraw/zinc/01/64/42/333016442.db2.gz	RHOJRHYGUSGJBU-BZUAXINKSA-N	0	0	263.425	4.018	20	30		CIEDRN
C=CCCCC(=O)N(CC)Cc1ccc(Cl)s1	ZINC000175202342	333017051	/nfs/dbraw/zinc/01/70/51/333017051.db2.gz	DGKYYDJXOHYDSK-UHFFFAOYSA-N	0	0	271.813	4.106	20	30		CIEDRN
CC(C)c1ccc(C(=O)Nc2ccc(C#N)c(F)c2)cc1	ZINC000307968726	333021719	/nfs/dbraw/zinc/02/17/19/333021719.db2.gz	VJHMTKXYKRKRQO-UHFFFAOYSA-N	0	0	282.318	4.073	20	30		CIEDRN
N#Cc1ccc(NC(=O)c2cccc3ccsc32)cc1F	ZINC000308119126	333025105	/nfs/dbraw/zinc/02/51/05/333025105.db2.gz	OAQMLGCBYMWVGP-UHFFFAOYSA-N	0	0	296.326	4.164	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(C)cc1Br	ZINC000175593242	333026914	/nfs/dbraw/zinc/02/69/14/333026914.db2.gz	STDBTNBMAGUNLK-UHFFFAOYSA-N	0	0	282.181	4.052	20	30		CIEDRN
C=CCCCC(=O)Nc1cccc(NC2CCCC2)c1	ZINC000175608629	333027060	/nfs/dbraw/zinc/02/70/60/333027060.db2.gz	ZDIBVDZBOASVAJ-UHFFFAOYSA-N	0	0	272.392	4.336	20	30		CIEDRN
N#Cc1cnc(Oc2ccc(F)cc2Cl)c(Cl)c1	ZINC000513636149	333028249	/nfs/dbraw/zinc/02/82/49/333028249.db2.gz	WPAYPRXHDIOGRO-UHFFFAOYSA-N	0	0	283.089	4.191	20	30		CIEDRN
C=CCCC(=O)N(C)[C@@H](C)[C@H](C)c1ccc(Cl)cc1	ZINC000175705718	333029781	/nfs/dbraw/zinc/02/97/81/333029781.db2.gz	HNULXPNOHBNFND-STQMWFEESA-N	0	0	279.811	4.257	20	30		CIEDRN
C[C@H](C#N)CN(C(=O)Nc1ccccc1C(C)(C)C)C1CC1	ZINC000513667147	333030963	/nfs/dbraw/zinc/03/09/63/333030963.db2.gz	RTNLAXVCNVSXHD-CYBMUJFWSA-N	0	0	299.418	4.140	20	30		CIEDRN
C=CCCCC(=O)N1[C@H](C)C[C@@H](c2ccccc2)[C@@H]1C	ZINC000175745398	333031382	/nfs/dbraw/zinc/03/13/82/333031382.db2.gz	NCMHBRAOVHFMCG-HLLBOEOZSA-N	0	0	271.404	4.136	20	30		CIEDRN
Cc1ccccc1-c1cccc(CN(C)[C@H](C)CC#N)c1	ZINC000513726305	333035919	/nfs/dbraw/zinc/03/59/19/333035919.db2.gz	YNAWJVKDQPOMLS-MRXNPFEDSA-N	0	0	278.399	4.396	20	30		CIEDRN
Cc1ccc(-c2cccc(CN(C)[C@H](C)CC#N)c2)cc1	ZINC000513727904	333036024	/nfs/dbraw/zinc/03/60/24/333036024.db2.gz	BWNUEMMWQXVCDB-MRXNPFEDSA-N	0	0	278.399	4.396	20	30		CIEDRN
C[C@H](Cc1ccccc1Cl)C(=O)Nc1cccc(C#N)c1	ZINC000513746610	333037429	/nfs/dbraw/zinc/03/74/29/333037429.db2.gz	AJHHJBZSSYASSJ-GFCCVEGCSA-N	0	0	298.773	4.029	20	30		CIEDRN
CC(C)Oc1cccc(CN(CCC#N)CC(C)(C)C)c1	ZINC000513751135	333037487	/nfs/dbraw/zinc/03/74/87/333037487.db2.gz	XMGCOPNKZAUWIM-UHFFFAOYSA-N	0	0	288.435	4.236	20	30		CIEDRN
C=CCCCC(=O)N1CCCCC[C@H]1c1ccccc1	ZINC000176108566	333039468	/nfs/dbraw/zinc/03/94/68/333039468.db2.gz	HXJRNTSQMWFQAF-KRWDZBQOSA-N	0	0	271.404	4.487	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)C/C=C/c1cccc(F)c1	ZINC000176262663	333040690	/nfs/dbraw/zinc/04/06/90/333040690.db2.gz	WKLYBIYTRNPXKH-HWKANZROSA-N	0	0	294.329	4.048	20	30		CIEDRN
N#C[C@@H](SCc1ccc([N+](=O)[O-])cc1)C1CCCCC1	ZINC000513814731	333040891	/nfs/dbraw/zinc/04/08/91/333040891.db2.gz	FYKMEJHNAMYSQG-OAHLLOKOSA-N	0	0	290.388	4.300	20	30		CIEDRN
N#Cc1csc(/C=C/c2ccc3cccc(O)c3n2)c1	ZINC000176840524	333048525	/nfs/dbraw/zinc/04/85/25/333048525.db2.gz	CRHNWXCDFWMYAH-VOTSOKGWSA-N	0	0	278.336	4.044	20	30		CIEDRN
N#Cc1ccc(/C=C/c2cc3ccccc3s2)nc1	ZINC000176988723	333051787	/nfs/dbraw/zinc/05/17/87/333051787.db2.gz	LOLFHUOKRLMELM-BQYQJAHWSA-N	0	0	262.337	4.338	20	30		CIEDRN
CC(C)(C#N)CCCSc1nnc(-c2ccccc2)o1	ZINC000177175509	333054559	/nfs/dbraw/zinc/05/45/59/333054559.db2.gz	AZWUHQGYMNLTNM-UHFFFAOYSA-N	0	0	287.388	4.159	20	30		CIEDRN
C=CCn1c(C)nnc1S[C@@H]1CCCCc2ccccc21	ZINC000177183557	333054801	/nfs/dbraw/zinc/05/48/01/333054801.db2.gz	YYNNXZGYWRFAOA-MRXNPFEDSA-N	0	0	299.443	4.332	20	30		CIEDRN
CC(C)CNc1nnc(SCCCC(C)(C)C#N)s1	ZINC000177219341	333055310	/nfs/dbraw/zinc/05/53/10/333055310.db2.gz	RDTKTRYFACNTPH-UHFFFAOYSA-N	0	0	298.481	4.028	20	30		CIEDRN
CC(C)(C#N)CCCSc1nncc2ccccc21	ZINC000177245956	333055773	/nfs/dbraw/zinc/05/57/73/333055773.db2.gz	ORSZTCKEPQWRTF-UHFFFAOYSA-N	0	0	271.389	4.052	20	30		CIEDRN
Cc1nc2ccccc2nc1SCCCC(C)(C)C#N	ZINC000177245757	333055819	/nfs/dbraw/zinc/05/58/19/333055819.db2.gz	LJTSMJGILLKHBU-UHFFFAOYSA-N	0	0	285.416	4.360	20	30		CIEDRN
C[C@H](c1ccc(F)cc1)N(C)Cc1cc(F)ccc1C#N	ZINC000177259729	333056424	/nfs/dbraw/zinc/05/64/24/333056424.db2.gz	GSSPFEPAPQCQSD-GFCCVEGCSA-N	0	0	286.325	4.029	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(Br)cc1C	ZINC000177468169	333059117	/nfs/dbraw/zinc/05/91/17/333059117.db2.gz	XXZRXFMSRMYGSZ-UHFFFAOYSA-N	0	0	282.181	4.052	20	30		CIEDRN
C[C@@H](Sc1ccccc1C#N)c1nc(C(C)(C)C)no1	ZINC000172682221	335118730	/nfs/dbraw/zinc/11/87/30/335118730.db2.gz	JOYZACMUKDYQIM-SNVBAGLBSA-N	0	0	287.388	4.092	20	30		CIEDRN
C[C@H](Sc1ccccc1C#N)c1nc(C(C)(C)C)no1	ZINC000172682219	335118862	/nfs/dbraw/zinc/11/88/62/335118862.db2.gz	JOYZACMUKDYQIM-JTQLQIEISA-N	0	0	287.388	4.092	20	30		CIEDRN
C=C(C)CS[C@@H](C)C(=O)Nc1cccc(Cl)c1C	ZINC000177865373	333064464	/nfs/dbraw/zinc/06/44/64/333064464.db2.gz	QEVPOBJRROKQLN-NSHDSACASA-N	0	0	283.824	4.285	20	30		CIEDRN
Cc1ccc(C#N)cc1OC[C@H]1CCCC(F)(F)C1	ZINC000311165122	333065579	/nfs/dbraw/zinc/06/55/79/333065579.db2.gz	QVXJRIPEIFRHCN-ZDUSSCGKSA-N	0	0	265.303	4.071	20	30		CIEDRN
CN(CC#N)[C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1	ZINC000178068710	333067465	/nfs/dbraw/zinc/06/74/65/333067465.db2.gz	GVIFBEKCJGLOJM-MRXNPFEDSA-N	0	0	288.753	4.024	20	30		CIEDRN
N#Cc1ccc(F)c(CNc2cccc(C(F)F)c2)c1	ZINC000178352856	333071520	/nfs/dbraw/zinc/07/15/20/333071520.db2.gz	GXZYJOJNTUTERB-UHFFFAOYSA-N	0	0	276.261	4.247	20	30		CIEDRN
Cc1cc(NCc2cccc(C#N)c2F)c(Cl)cc1F	ZINC000312219977	333078471	/nfs/dbraw/zinc/07/84/71/333078471.db2.gz	DNRHLSZGYYJFOV-UHFFFAOYSA-N	0	0	292.716	4.410	20	30		CIEDRN
Cc1c2ccccc2oc1[C@@H](C)NCc1ccccc1C#N	ZINC000179063552	333079605	/nfs/dbraw/zinc/07/96/05/333079605.db2.gz	AWNPZUQACLNIBK-CQSZACIVSA-N	0	0	290.366	4.464	20	30		CIEDRN
C=CC[NH+](CC=C)[C@H](C)c1ccc(OC(F)(F)F)cc1	ZINC000516675465	333080444	/nfs/dbraw/zinc/08/04/44/333080444.db2.gz	JEXWTRZJQPJLIZ-GFCCVEGCSA-N	0	0	285.309	4.320	20	30		CIEDRN
N#Cc1ccc(CNc2cccc(F)c2Cl)cc1F	ZINC000516681393	333080508	/nfs/dbraw/zinc/08/05/08/333080508.db2.gz	KUWJYGQGUZMQCX-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
CC[C@@H]1CCCCCN1C(=O)Nc1scc(C)c1C#N	ZINC000520833304	333081243	/nfs/dbraw/zinc/08/12/43/333081243.db2.gz	VKEYRXWVRHVDRC-GFCCVEGCSA-N	0	0	291.420	4.115	20	30		CIEDRN
CCS[C@H](C)c1noc([C@@H]2C[C@H]2c2cccc(C#N)c2)n1	ZINC000516857828	333084358	/nfs/dbraw/zinc/08/43/58/333084358.db2.gz	JBMHHCLWZCFHTE-DDTOSNHZSA-N	0	0	299.399	4.026	20	30		CIEDRN
CC(C)(C#N)CCSCc1cc(F)cc(F)c1	ZINC000516962409	333088111	/nfs/dbraw/zinc/08/81/11/333088111.db2.gz	IVIWRJQWTNNOEQ-UHFFFAOYSA-N	0	0	255.333	4.138	20	30		CIEDRN
C=C(CC)CS[C@H](C)C(=O)NCCC1=CCCCC1	ZINC000516992838	333089232	/nfs/dbraw/zinc/08/92/32/333089232.db2.gz	KBBHHEUQAFGDGA-CQSZACIVSA-N	0	0	281.465	4.081	20	30		CIEDRN
N#Cc1ccc(SC[C@@H]2CCC3(CCCC3)O2)c(F)c1	ZINC000517016846	333090047	/nfs/dbraw/zinc/09/00/47/333090047.db2.gz	OGLQQAUNGYGWEJ-ZDUSSCGKSA-N	0	0	291.391	4.281	20	30		CIEDRN
CCCC[C@H](C)N(C)C(=O)Nc1ccc(C#N)cc1Cl	ZINC000517060369	333091439	/nfs/dbraw/zinc/09/14/39/333091439.db2.gz	IQYCPNMJBIZZHS-NSHDSACASA-N	0	0	293.798	4.254	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)[C@@H](C#N)c1ccc(CC)cc1	ZINC000517387962	333098661	/nfs/dbraw/zinc/09/86/61/333098661.db2.gz	QTJUKYIGNIFTIT-SFHVURJKSA-N	0	0	296.414	4.040	20	30		CIEDRN
C=C1CCN(C(=O)C[C@H]2C[C@H](C)CC(C)(C)C2)CC1	ZINC000517454646	333099889	/nfs/dbraw/zinc/09/98/89/333099889.db2.gz	GKTXBRABUJUYKX-LSDHHAIUSA-N	0	0	263.425	4.018	20	30		CIEDRN
C=C1CCN(C(=O)CCc2ccc(Cl)cc2Cl)CC1	ZINC000517481235	333100413	/nfs/dbraw/zinc/10/04/13/333100413.db2.gz	LKXYENVLUIJLHG-UHFFFAOYSA-N	0	0	298.213	4.105	20	30		CIEDRN
N#Cc1ccc(NCc2cccc3cccnc32)c(Cl)c1	ZINC000211578463	333100613	/nfs/dbraw/zinc/10/06/13/333100613.db2.gz	DLVDHQRDWOGAML-UHFFFAOYSA-N	0	0	293.757	4.372	20	30		CIEDRN
C=CCN(C(=O)[C@@H](C)c1ccccc1F)c1ccccc1	ZINC000517518842	333100968	/nfs/dbraw/zinc/10/09/68/333100968.db2.gz	WILDNOGPYMHQLQ-AWEZNQCLSA-N	0	0	283.346	4.148	20	30		CIEDRN
Cc1csc(NC(=O)[C@@H](C)CC2CCCCC2)c1C#N	ZINC000517620358	333104060	/nfs/dbraw/zinc/10/40/60/333104060.db2.gz	LUWYDXMGRRWCCR-NSHDSACASA-N	0	0	290.432	4.473	20	30		CIEDRN
N#Cc1ccc(N[C@H]2CCC[C@H]2c2ccccc2)cc1	ZINC000517665129	333105531	/nfs/dbraw/zinc/10/55/31/333105531.db2.gz	SVXFLQFSVZVCQI-ROUUACIJSA-N	0	0	262.356	4.306	20	30		CIEDRN
C=CC1CCN(C(=O)CCc2ccc(C(C)C)cc2)CC1	ZINC000517701111	333106163	/nfs/dbraw/zinc/10/61/63/333106163.db2.gz	IQBJVFXOCDBCDN-UHFFFAOYSA-N	0	0	285.431	4.167	20	30		CIEDRN
C=CCCO[C@@H](C)C(=O)Nc1ccccc1CCC(C)C	ZINC000520924562	333107927	/nfs/dbraw/zinc/10/79/27/333107927.db2.gz	DRFJGTPBNQRMEN-HNNXBMFYSA-N	0	0	289.419	4.195	20	30		CIEDRN
C=CC1CCN(C(=O)c2cc3sccc3s2)CC1	ZINC000521095602	333111567	/nfs/dbraw/zinc/11/15/67/333111567.db2.gz	JKUBYMHLGXJSKA-UHFFFAOYSA-N	0	0	277.414	4.001	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)C[C@H]2CCCC[C@@H]2C)s1	ZINC000521249870	333116348	/nfs/dbraw/zinc/11/63/48/333116348.db2.gz	FOYSJHYCXLMZOL-NWDGAFQWSA-N	0	0	290.432	4.337	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@@H](CC1CCC1)c1ccccc1	ZINC000183627054	333121563	/nfs/dbraw/zinc/12/15/63/333121563.db2.gz	VKVVUUJUIKLBBW-KRWDZBQOSA-N	0	0	286.419	4.135	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@]1(C)Cc1ccccc1	ZINC000183997871	333124381	/nfs/dbraw/zinc/12/43/81/333124381.db2.gz	XJSYHPBATWBNRG-QFBILLFUSA-N	0	0	285.431	4.213	20	30		CIEDRN
C[C@H](SC[C@H]1CCC(C)(C)O1)c1ccc(C#N)cc1	ZINC000184824445	333132394	/nfs/dbraw/zinc/13/23/94/333132394.db2.gz	OXLKINVQMHGDAM-SWLSCSKDSA-N	0	0	275.417	4.310	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(C)c(Cl)cc1OC	ZINC000184892423	333133106	/nfs/dbraw/zinc/13/31/06/333133106.db2.gz	OMFVQILFRVJMTJ-NSHDSACASA-N	0	0	281.783	4.198	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cccc(Cl)c1F	ZINC000184980575	333133951	/nfs/dbraw/zinc/13/39/51/333133951.db2.gz	ZIVLTNZLDVIIKM-SECBINFHSA-N	0	0	255.720	4.020	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](c1ccc(OC)cc1)C(C)C	ZINC000184986591	333134099	/nfs/dbraw/zinc/13/40/99/333134099.db2.gz	JTWSUVFPEVKBKI-PBHICJAKSA-N	0	0	289.419	4.111	20	30		CIEDRN
CC#CCCCC(=O)N(Cc1ccc([C@H]2C[C@H]2C)o1)C1CC1	ZINC000185072274	333135082	/nfs/dbraw/zinc/13/50/82/333135082.db2.gz	KZQBFDPBEKISAU-PBHICJAKSA-N	0	0	299.414	4.088	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000185085987	333135394	/nfs/dbraw/zinc/13/53/94/333135394.db2.gz	TXAXBUHLBINESW-LBPRGKRZSA-N	0	0	297.320	4.076	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000185085809	333135399	/nfs/dbraw/zinc/13/53/99/333135399.db2.gz	HHTYXMOEHNGPFG-RYUDHWBXSA-N	0	0	299.336	4.485	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(Cc1ccccc1)C(C)C	ZINC000185118554	333135762	/nfs/dbraw/zinc/13/57/62/333135762.db2.gz	IXPQDCHNSGJMJJ-HNNXBMFYSA-N	0	0	259.393	4.026	20	30		CIEDRN
CC(C)CCN(CCC(C)C)C(=O)C1(C#N)CCCCC1	ZINC000218739813	333135812	/nfs/dbraw/zinc/13/58/12/333135812.db2.gz	YQMIXVWRNSDNRY-UHFFFAOYSA-N	0	0	292.467	4.381	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)Cc1csc2ccccc12	ZINC000185132664	333135918	/nfs/dbraw/zinc/13/59/18/333135918.db2.gz	IHOKSKQZNRYHOT-CYBMUJFWSA-N	0	0	287.428	4.462	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](C)c1cccc(OC(C)C)c1	ZINC000185142561	333135937	/nfs/dbraw/zinc/13/59/37/333135937.db2.gz	JCBZPSALCFIEHX-GJZGRUSLSA-N	0	0	289.419	4.253	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](C)c1cccc(OC(C)C)c1	ZINC000185142537	333136014	/nfs/dbraw/zinc/13/60/14/333136014.db2.gz	JCBZPSALCFIEHX-LSDHHAIUSA-N	0	0	289.419	4.253	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](C)c1ccc(OC(C)C)cc1	ZINC000185172886	333136371	/nfs/dbraw/zinc/13/63/71/333136371.db2.gz	FMCPRVKCTHGDKO-GJZGRUSLSA-N	0	0	289.419	4.253	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(OC(C)C)cc1	ZINC000185177166	333136401	/nfs/dbraw/zinc/13/64/01/333136401.db2.gz	FMBVZTOTEYKALI-ZDUSSCGKSA-N	0	0	261.365	4.015	20	30		CIEDRN
CCN(C(=O)[C@H](C)CC(C)C)[C@H](C)c1ccc(C#N)cc1	ZINC000185170267	333136413	/nfs/dbraw/zinc/13/64/13/333136413.db2.gz	XEPRNRVAVLQRJH-HUUCEWRRSA-N	0	0	286.419	4.150	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H](C)c1oc2ccccc2c1C	ZINC000185205066	333136663	/nfs/dbraw/zinc/13/66/63/333136663.db2.gz	BLZDLRXIBGRBDX-AWEZNQCLSA-N	0	0	283.371	4.112	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(Br)ccc1C	ZINC000185194173	333136668	/nfs/dbraw/zinc/13/66/68/333136668.db2.gz	GOHFTHYUOUUANS-NSHDSACASA-N	0	0	296.208	4.298	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCc1ccc2ccccc2c1	ZINC000185222313	333136953	/nfs/dbraw/zinc/13/69/53/333136953.db2.gz	PNNOEGLJDLSFEZ-AWEZNQCLSA-N	0	0	267.372	4.058	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@H](C)c1ccc(C)cc1	ZINC000185227555	333137079	/nfs/dbraw/zinc/13/70/79/333137079.db2.gz	HJPMMIHHGLJZOZ-LSDHHAIUSA-N	0	0	259.393	4.117	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(Cc1ccc(C)s1)C(C)C	ZINC000185266602	333137874	/nfs/dbraw/zinc/13/78/74/333137874.db2.gz	OEVUPIVBDUOYEX-CYBMUJFWSA-N	0	0	279.449	4.396	20	30		CIEDRN
C=CCCCC(=O)N(Cc1ccccc1)C(C)(C)C	ZINC000185536691	333143048	/nfs/dbraw/zinc/14/30/48/333143048.db2.gz	OGUKTKRKUGLFRV-UHFFFAOYSA-N	0	0	259.393	4.170	20	30		CIEDRN
CC#CCCCC(=O)Nc1cnccc1Oc1ccccc1	ZINC000185565232	333143764	/nfs/dbraw/zinc/14/37/64/333143764.db2.gz	ZASIIBWLYDAWSF-UHFFFAOYSA-N	0	0	294.354	4.006	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(C)c(OC(F)F)c1	ZINC000185573027	333144066	/nfs/dbraw/zinc/14/40/66/333144066.db2.gz	PPVHEMOSPZXYBQ-NSHDSACASA-N	0	0	283.318	4.137	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(Cc1ccc(F)cc1)CC1CC1	ZINC000185581089	333144260	/nfs/dbraw/zinc/14/42/60/333144260.db2.gz	CAVXJMMZZRQZEE-CQSZACIVSA-N	0	0	289.394	4.167	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](C)c1cccc(C)c1C	ZINC000185583385	333144307	/nfs/dbraw/zinc/14/43/07/333144307.db2.gz	MVXSTDXVIVDLPF-HIFRSBDPSA-N	0	0	259.393	4.083	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@H](CC)Cc1ccccc1	ZINC000185676096	333146495	/nfs/dbraw/zinc/14/64/95/333146495.db2.gz	WRDWZDQPSARRFG-NVXWUHKLSA-N	0	0	273.420	4.068	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](c2ccccc2)[C@H](C)C1	ZINC000185680176	333146515	/nfs/dbraw/zinc/14/65/15/333146515.db2.gz	INGOZRJBQVTQNC-JZXOWHBKSA-N	0	0	285.431	4.241	20	30		CIEDRN
Cc1cc(N2CCCC2)ccc1N[C@@H]1CCC[C@H](C#N)C1	ZINC000185722219	333147303	/nfs/dbraw/zinc/14/73/03/333147303.db2.gz	UUQKZPLNCSKGRM-JKSUJKDBSA-N	0	0	283.419	4.090	20	30		CIEDRN
N#C[C@H]1CCC[C@H](Nc2ccc(F)cc2OCC2CC2)C1	ZINC000185730200	333147475	/nfs/dbraw/zinc/14/74/75/333147475.db2.gz	XFRFDBQLZULVKT-ZFWWWQNUSA-N	0	0	288.366	4.109	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cccc(N(C)C(C)C)c1	ZINC000185747826	333147884	/nfs/dbraw/zinc/14/78/84/333147884.db2.gz	PGWYITMXXRWIFO-CQSZACIVSA-N	0	0	274.408	4.072	20	30		CIEDRN
CC#CCCCC(=O)Nc1cccc(CCC(F)(F)F)c1	ZINC000185811753	333149465	/nfs/dbraw/zinc/14/94/65/333149465.db2.gz	GVTFRKUDWSVNBK-UHFFFAOYSA-N	0	0	297.320	4.314	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC1CC1)c1ccccc1	ZINC000185807009	333149492	/nfs/dbraw/zinc/14/94/92/333149492.db2.gz	LYIUZQVWJKVONI-CQSZACIVSA-N	0	0	257.377	4.032	20	30		CIEDRN
C=C(C)[C@@H](NC(=O)N(C)[C@H](C)CC)c1ccc(F)c(F)c1	ZINC000185839880	333150156	/nfs/dbraw/zinc/15/01/56/333150156.db2.gz	DLDIPQZAQKWUEZ-IAQYHMDHSA-N	0	0	296.361	4.022	20	30		CIEDRN
Cc1cc2cccnc2c(N[C@@H]2CCC[C@@H](C#N)C2)c1	ZINC000185871617	333150735	/nfs/dbraw/zinc/15/07/35/333150735.db2.gz	GRZLYKQGYWQBLX-UKRRQHHQSA-N	0	0	265.360	4.038	20	30		CIEDRN
Cc1ccc2cccc(N[C@H]3CCC[C@H](C#N)C3)c2n1	ZINC000185888830	333151109	/nfs/dbraw/zinc/15/11/09/333151109.db2.gz	OZFXZGYMFYFFMB-ZFWWWQNUSA-N	0	0	265.360	4.038	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H]1[C@H](C)CCC	ZINC000185889451	333151195	/nfs/dbraw/zinc/15/11/95/333151195.db2.gz	MCSYNDIOJFHOHZ-QLFBSQMISA-N	0	0	251.414	4.016	20	30		CIEDRN
Cc1oc2ccccc2c1C(=O)Nc1cccc(C#N)c1C	ZINC000185901438	333151500	/nfs/dbraw/zinc/15/15/00/333151500.db2.gz	UQNGECRVZRKDCX-UHFFFAOYSA-N	0	0	290.322	4.174	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1ccccc1OCC)c1ccccc1	ZINC000186029009	333153777	/nfs/dbraw/zinc/15/37/77/333153777.db2.gz	WUIMZGDHUYRUPW-MRXNPFEDSA-N	0	0	295.382	4.384	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1sc(C)nc1CC(C)C	ZINC000186037045	333153791	/nfs/dbraw/zinc/15/37/91/333153791.db2.gz	ZEVKTVYLONNCJS-LLVKDONJSA-N	0	0	280.437	4.191	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(OC(C)C)c(OC)c1	ZINC000186075121	333154542	/nfs/dbraw/zinc/15/45/42/333154542.db2.gz	YXSALZCJHSHNIY-ZDUSSCGKSA-N	0	0	291.391	4.023	20	30		CIEDRN
C=CC[C@@H](C(=O)N(C)Cc1cccc(F)c1)c1ccccc1	ZINC000186133778	333155582	/nfs/dbraw/zinc/15/55/82/333155582.db2.gz	CXKFJFWDEMBXFW-GOSISDBHSA-N	0	0	297.373	4.144	20	30		CIEDRN
Cc1cccc(SCc2cccc(C#N)c2F)c1	ZINC000219766470	333156633	/nfs/dbraw/zinc/15/66/33/333156633.db2.gz	WJIHETRVICSAQD-UHFFFAOYSA-N	0	0	257.333	4.298	20	30		CIEDRN
C=CC[C@H](C(=O)N(C)c1ccccc1)c1ccccc1	ZINC000186215789	333156755	/nfs/dbraw/zinc/15/67/55/333156755.db2.gz	XMQWAMYQQXDDHI-KRWDZBQOSA-N	0	0	265.356	4.009	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1nc(C2CC2)cs1)c1ccccc1	ZINC000186589931	333163270	/nfs/dbraw/zinc/16/32/70/333163270.db2.gz	ICFHTBYSKXUZBN-AWEZNQCLSA-N	0	0	298.411	4.319	20	30		CIEDRN
CCN(C[C@@H](C)C#N)[C@@H](C)c1cccc(Cl)c1F	ZINC000186903936	333166356	/nfs/dbraw/zinc/16/63/56/333166356.db2.gz	UPSBSPNLLFXMIO-QWRGUYRKSA-N	0	0	268.763	4.022	20	30		CIEDRN
C=CC[C@H](C(=O)N(C)c1ccc(F)cc1)c1ccccc1	ZINC000186964872	333166784	/nfs/dbraw/zinc/16/67/84/333166784.db2.gz	ORCVRXKLQYDQSO-KRWDZBQOSA-N	0	0	283.346	4.148	20	30		CIEDRN
N#Cc1cccc(NCc2cccc(OC(F)(F)F)c2)c1	ZINC000220500253	333167080	/nfs/dbraw/zinc/16/70/80/333167080.db2.gz	NDMWRFXBFBABKV-UHFFFAOYSA-N	0	0	292.260	4.069	20	30		CIEDRN
C=CCCCC(=O)Nc1cccc(C)c1Br	ZINC000187122118	333168075	/nfs/dbraw/zinc/16/80/75/333168075.db2.gz	MZNOESHGRSEZPM-UHFFFAOYSA-N	0	0	282.181	4.052	20	30		CIEDRN
C=CC[C@H](C(=O)N(C)c1ccccc1F)c1ccccc1	ZINC000187343046	333169699	/nfs/dbraw/zinc/16/96/99/333169699.db2.gz	NNGAQNWUNKVFPY-HNNXBMFYSA-N	0	0	283.346	4.148	20	30		CIEDRN
N#Cc1ccc(COc2cccc3ncccc32)c(Cl)c1	ZINC000220978260	333171551	/nfs/dbraw/zinc/17/15/51/333171551.db2.gz	SNFDJQFNQMMWKB-UHFFFAOYSA-N	0	0	294.741	4.339	20	30		CIEDRN
N#Cc1ccc(OCc2cccc3cccnc32)cc1Cl	ZINC000220982118	333171554	/nfs/dbraw/zinc/17/15/54/333171554.db2.gz	HHSAVDBCZBKZAG-UHFFFAOYSA-N	0	0	294.741	4.339	20	30		CIEDRN
Cc1ccc(C)c(C(=O)COc2ccc(C#N)c(Cl)c2)c1	ZINC000220987642	333171784	/nfs/dbraw/zinc/17/17/84/333171784.db2.gz	DPGYZCVPDASVFN-UHFFFAOYSA-N	0	0	299.757	4.090	20	30		CIEDRN
CCC(CC)CN(CCC#N)C(=O)CCCC(C)(C)C	ZINC000521484020	333173588	/nfs/dbraw/zinc/17/35/88/333173588.db2.gz	ABCQWTDGSMNFPL-UHFFFAOYSA-N	0	0	280.456	4.381	20	30		CIEDRN
C=CCC[C@H](C(=O)Nc1ccnc(C)c1)c1ccccc1	ZINC000188907268	333175927	/nfs/dbraw/zinc/17/59/27/333175927.db2.gz	XUUNFHQVOKTTLU-KRWDZBQOSA-N	0	0	280.371	4.079	20	30		CIEDRN
N#Cc1ccc(F)c(CSCc2cccc(F)c2F)c1	ZINC000521558679	333178595	/nfs/dbraw/zinc/17/85/95/333178595.db2.gz	YWDCBSUMBDKHJI-UHFFFAOYSA-N	0	0	293.313	4.409	20	30		CIEDRN
CCN(C[C@@H](C)C#N)C(=O)c1ccc(C(C)C)c(Cl)c1	ZINC000189208131	333185111	/nfs/dbraw/zinc/18/51/11/333185111.db2.gz	PLJZMDWLBNWRDV-LBPRGKRZSA-N	0	0	292.810	4.085	20	30		CIEDRN
C=CC[C@H](C(=O)N(C)Cc1ccccc1)c1ccccc1	ZINC000189364518	333191109	/nfs/dbraw/zinc/19/11/09/333191109.db2.gz	JMFKNFFYABLGDJ-SFHVURJKSA-N	0	0	279.383	4.005	20	30		CIEDRN
COC(=O)c1ccc(S[C@H](C)c2ccc(C#N)cc2)cc1	ZINC000522822866	333191216	/nfs/dbraw/zinc/19/12/16/333191216.db2.gz	YVMDIBWGCLVYGA-GFCCVEGCSA-N	0	0	297.379	4.198	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1cc(F)ccc1F)c1ccccc1	ZINC000189443494	333192992	/nfs/dbraw/zinc/19/29/92/333192992.db2.gz	PCFCRLXXISURGD-CQSZACIVSA-N	0	0	287.309	4.263	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1ccc(C(C)C)c(Cl)c1	ZINC000189618462	333196885	/nfs/dbraw/zinc/19/68/85/333196885.db2.gz	WBAXLWWMFGNHKB-UHFFFAOYSA-N	0	0	265.784	4.112	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)c1cc(C)cc(Cl)c1	ZINC000189917741	333200526	/nfs/dbraw/zinc/20/05/26/333200526.db2.gz	AWVVOKCWQCJCMY-UHFFFAOYSA-N	0	0	292.810	4.193	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)[C@H](C)CC1CCCC1	ZINC000189951722	333200923	/nfs/dbraw/zinc/20/09/23/333200923.db2.gz	XUVOPWBJOKSJJG-CQSZACIVSA-N	0	0	278.440	4.134	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)c1cccc(C(F)F)c1	ZINC000189950064	333200966	/nfs/dbraw/zinc/20/09/66/333200966.db2.gz	RTWSJGWSVUEXLQ-UHFFFAOYSA-N	0	0	294.345	4.169	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N(CC)Cc1ccc(Cl)s1	ZINC000190027819	333202227	/nfs/dbraw/zinc/20/22/27/333202227.db2.gz	CWTILEKGYPMYNR-CQSZACIVSA-N	0	0	285.840	4.352	20	30		CIEDRN
N#Cc1ccc(CNc2ccc(Cl)c(F)c2)cc1F	ZINC000190345349	333205778	/nfs/dbraw/zinc/20/57/78/333205778.db2.gz	QERLBQVWPVYHCB-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C=CCC1(C(=O)NCc2cccc(C(F)(F)F)c2)CCC1	ZINC000190524682	333207820	/nfs/dbraw/zinc/20/78/20/333207820.db2.gz	RCRIUDJNHZKRRP-UHFFFAOYSA-N	0	0	297.320	4.068	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](C(F)(F)F)C(C)(C)C1	ZINC000190735895	333210329	/nfs/dbraw/zinc/21/03/29/333210329.db2.gz	VBXVBSYFWUSZPM-NEPJUHHUSA-N	0	0	291.357	4.026	20	30		CIEDRN
N#Cc1cccc(CNc2cccc3c2CCCC3)c1F	ZINC000223727290	333211536	/nfs/dbraw/zinc/21/15/36/333211536.db2.gz	DTGMJAZHSNPNGL-UHFFFAOYSA-N	0	0	280.346	4.188	20	30		CIEDRN
Cc1ccc(C(=O)Nc2cc(C#N)ccc2C)c(Cl)c1	ZINC000191272891	333217443	/nfs/dbraw/zinc/21/74/43/333217443.db2.gz	FGNGJISHXAVHOL-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
CC(C)c1ccc(C(=O)[C@H](C#N)c2ccccn2)cc1Cl	ZINC000191374193	333218770	/nfs/dbraw/zinc/21/87/70/333218770.db2.gz	JHPAFNKISIICQP-CQSZACIVSA-N	0	0	298.773	4.348	20	30		CIEDRN
CC(C)c1ccc(C(=O)[C@@H](C#N)c2ccccn2)cc1Cl	ZINC000191374174	333218827	/nfs/dbraw/zinc/21/88/27/333218827.db2.gz	JHPAFNKISIICQP-AWEZNQCLSA-N	0	0	298.773	4.348	20	30		CIEDRN
C=CCC1(C(=O)N(CC)Cc2ccc(Cl)s2)CCC1	ZINC000191669118	333223383	/nfs/dbraw/zinc/22/33/83/333223383.db2.gz	PQLMOEQJMGHSPZ-UHFFFAOYSA-N	0	0	297.851	4.496	20	30		CIEDRN
COc1cc(Cl)c(Cl)cc1NCc1ccc(C#N)o1	ZINC000191678341	333223512	/nfs/dbraw/zinc/22/35/12/333223512.db2.gz	WHIRPWUWXFDZGG-UHFFFAOYSA-N	0	0	297.141	4.079	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N(C)[C@H](CC)c1ccccc1OC	ZINC000521940248	333224400	/nfs/dbraw/zinc/22/44/00/333224400.db2.gz	CZELHTRTQVBLIG-QAPCUYQASA-N	0	0	289.419	4.207	20	30		CIEDRN
N#Cc1c(F)cccc1/C=C\c1ccc2ccccc2n1	ZINC000521947252	333225138	/nfs/dbraw/zinc/22/51/38/333225138.db2.gz	CXCDZHXGIGCREC-NTMALXAHSA-N	0	0	274.298	4.416	20	30		CIEDRN
C=CCC1(C(=O)N2CCC[C@H](C(C)C)CC2)CCC1	ZINC000191832758	333226069	/nfs/dbraw/zinc/22/60/69/333226069.db2.gz	VGRYRDSYOOUYID-HNNXBMFYSA-N	0	0	263.425	4.018	20	30		CIEDRN
C=CCC(C)(C)c1noc(Cn2c(C)cc3ccccc32)n1	ZINC000522005480	333229996	/nfs/dbraw/zinc/22/99/96/333229996.db2.gz	YCXPNFZBRCUBNQ-UHFFFAOYSA-N	0	0	295.386	4.235	20	30		CIEDRN
C=CCCCCCS[C@H](C)c1nc(C2CC2)no1	ZINC000192536268	333236175	/nfs/dbraw/zinc/23/61/75/333236175.db2.gz	VZXGFFMYBIENRS-LLVKDONJSA-N	0	0	266.410	4.488	20	30		CIEDRN
N#Cc1cc(F)c(NCCc2ccc(Cl)s2)c(F)c1	ZINC000225545931	333236792	/nfs/dbraw/zinc/23/67/92/333236792.db2.gz	KAFOFQJXVBVIRI-UHFFFAOYSA-N	0	0	298.745	4.206	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)N2CCC[C@H]2CC)c1	ZINC000522093223	333239729	/nfs/dbraw/zinc/23/97/29/333239729.db2.gz	LXBSHNMVNWGJBK-OAHLLOKOSA-N	0	0	288.391	4.048	20	30		CIEDRN
C[C@H](C#N)N[C@@H](CCCc1ccccc1)c1ccccc1	ZINC000193087629	333242559	/nfs/dbraw/zinc/24/25/59/333242559.db2.gz	ZMMPAEYSKONKBP-APWZRJJASA-N	0	0	278.399	4.252	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)N[C@@H](CC)CCC	ZINC000195281141	333249604	/nfs/dbraw/zinc/24/96/04/333249604.db2.gz	YOHVIPLYDYYLNJ-ZDUSSCGKSA-N	0	0	280.437	4.024	20	30		CIEDRN
C[C@H](SCCOc1ccccc1C#N)c1ccccc1	ZINC000195594925	333256604	/nfs/dbraw/zinc/25/66/04/333256604.db2.gz	XUPPNEGQIDYXRE-AWEZNQCLSA-N	0	0	283.396	4.431	20	30		CIEDRN
CC[C@H](C(=O)Nc1ccc(C#N)cc1Cl)c1ccccc1	ZINC000226345237	333257613	/nfs/dbraw/zinc/25/76/13/333257613.db2.gz	RKYADPQWIISYGB-AWEZNQCLSA-N	0	0	298.773	4.344	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC(F)F)c1ccc(F)cc1	ZINC000193859160	333259613	/nfs/dbraw/zinc/25/96/13/333259613.db2.gz	IAQAQWLAPSSERA-NSHDSACASA-N	0	0	285.309	4.026	20	30		CIEDRN
N#Cc1ccc(/C=C/c2cccc(OC3CCCC3)c2)nc1	ZINC000195689320	333260770	/nfs/dbraw/zinc/26/07/70/333260770.db2.gz	SFFXXVXLSJEIKY-CSKARUKUSA-N	0	0	290.366	4.445	20	30		CIEDRN
CC(C)(C#N)CCOc1ccc(F)c(C(F)(F)F)c1	ZINC000226459245	333261475	/nfs/dbraw/zinc/26/14/75/333261475.db2.gz	POEPRZGZDZFSGG-UHFFFAOYSA-N	0	0	275.245	4.163	20	30		CIEDRN
C[C@H](Oc1ccc(C#N)c(Cl)c1)c1ccc(C#N)cc1	ZINC000194706646	333276032	/nfs/dbraw/zinc/27/60/32/333276032.db2.gz	FTEWZSYZBQBIMT-NSHDSACASA-N	0	0	282.730	4.223	20	30		CIEDRN
C=CCSCCOc1c(Cl)cccc1Cl	ZINC000522282452	333278590	/nfs/dbraw/zinc/27/85/90/333278590.db2.gz	HBXPZPMCHFEOKF-UHFFFAOYSA-N	0	0	263.189	4.291	20	30		CIEDRN
COC(=O)c1ccc(S[C@@H](C#N)C2CCCCC2)cc1	ZINC000522333389	333282922	/nfs/dbraw/zinc/28/29/22/333282922.db2.gz	UORBXQNZFFOBKB-HNNXBMFYSA-N	0	0	289.400	4.038	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)CC2CCC(C)CC2)s1	ZINC000522334574	333283068	/nfs/dbraw/zinc/28/30/68/333283068.db2.gz	HTDFHKOTISUHHW-UHFFFAOYSA-N	0	0	290.432	4.337	20	30		CIEDRN
C=CCNC(=O)Nc1ccccc1O[C@H](C)c1ccccc1	ZINC000522462890	333287537	/nfs/dbraw/zinc/28/75/37/333287537.db2.gz	HELZQJJGLFXKMK-CQSZACIVSA-N	0	0	296.370	4.134	20	30		CIEDRN
C=CCCC(=O)Nc1nc(-c2ccc(C)c(C)c2)cs1	ZINC000522484352	333288079	/nfs/dbraw/zinc/28/80/79/333288079.db2.gz	GCRLNIRQNBEBNH-UHFFFAOYSA-N	0	0	286.400	4.332	20	30		CIEDRN
CC(C)(C)[C@@H]1CCCN(c2ccc(Cl)c(C#N)n2)CC1	ZINC000522568045	333290493	/nfs/dbraw/zinc/29/04/93/333290493.db2.gz	INWGJOCBECNWIG-GFCCVEGCSA-N	0	0	291.826	4.259	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@H](c1ccc(Cl)cc1)C(C)C	ZINC000522576129	333290521	/nfs/dbraw/zinc/29/05/21/333290521.db2.gz	TVDLBWCESUOAPG-DOMZBBRYSA-N	0	0	294.826	4.301	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@@H](c1ccc(Cl)cc1)C(C)C	ZINC000522576130	333290527	/nfs/dbraw/zinc/29/05/27/333290527.db2.gz	TVDLBWCESUOAPG-IUODEOHRSA-N	0	0	294.826	4.301	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Cc1coc2cc(C)c(C(C)C)cc12	ZINC000522643036	333294399	/nfs/dbraw/zinc/29/43/99/333294399.db2.gz	ZDOWWFSCJMGRCC-CQSZACIVSA-N	0	0	299.414	4.488	20	30		CIEDRN
C=CC[C@H](C)NC(=O)c1ccc(Oc2ccccc2)cc1	ZINC000522645684	333294639	/nfs/dbraw/zinc/29/46/39/333294639.db2.gz	HCAGHVPZHDEOMO-AWEZNQCLSA-N	0	0	281.355	4.173	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@H](CC(C)C)c1ccccc1C	ZINC000522665172	333295628	/nfs/dbraw/zinc/29/56/28/333295628.db2.gz	SEYHTOWTNYFTMF-DOTOQJQBSA-N	0	0	288.435	4.346	20	30		CIEDRN
CCCC[C@@H](CC)CC(=O)N(C)c1cccc(C#N)c1	ZINC000522666759	333295804	/nfs/dbraw/zinc/29/58/04/333295804.db2.gz	ZIQXMHRWFQZVOD-CQSZACIVSA-N	0	0	272.392	4.128	20	30		CIEDRN
N#Cc1c(F)cccc1Oc1ccc2cccnc2c1	ZINC000229033580	333300129	/nfs/dbraw/zinc/30/01/29/333300129.db2.gz	RAGVCCPRKZPHHY-UHFFFAOYSA-N	0	0	264.259	4.038	20	30		CIEDRN
Cc1ccc(CN(C)c2cc(C#N)c3ccccc3n2)s1	ZINC000522935751	333300466	/nfs/dbraw/zinc/30/04/66/333300466.db2.gz	JDWLIKMVBZJGLI-UHFFFAOYSA-N	0	0	293.395	4.113	20	30		CIEDRN
C=CCCCN(C)C(=O)c1ccccc1Cc1ccccc1	ZINC000522950574	333300934	/nfs/dbraw/zinc/30/09/34/333300934.db2.gz	JQCKUIWCMWXLAQ-UHFFFAOYSA-N	0	0	293.410	4.316	20	30		CIEDRN
C=CCCCN(C)C(=O)N[C@@H](CCC)C1CCCCC1	ZINC000523001515	333304179	/nfs/dbraw/zinc/30/41/79/333304179.db2.gz	BLNXKERZTSCYKH-INIZCTEOSA-N	0	0	280.456	4.343	20	30		CIEDRN
CC1(C)CCCC[C@@H]1C(=O)Nc1ccc(C#N)cc1Cl	ZINC000229418193	333304882	/nfs/dbraw/zinc/30/48/82/333304882.db2.gz	QYBVVFPCEAGORS-GFCCVEGCSA-N	0	0	290.794	4.367	20	30		CIEDRN
Cc1ccoc1CNc1ccc(C#N)c(C(F)(F)F)c1	ZINC000229478299	333305449	/nfs/dbraw/zinc/30/54/49/333305449.db2.gz	CRRTZTZRVRYEJA-UHFFFAOYSA-N	0	0	280.249	4.091	20	30		CIEDRN
Cc1ccoc1CNc1ccc(C(F)(F)F)cc1C#N	ZINC000229479537	333305523	/nfs/dbraw/zinc/30/55/23/333305523.db2.gz	PPSRDKZKVFFHMC-UHFFFAOYSA-N	0	0	280.249	4.091	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)[C@@H](C)c1ccsc1	ZINC000523088093	333307560	/nfs/dbraw/zinc/30/75/60/333307560.db2.gz	REVOFRHAPQDOKC-AWEZNQCLSA-N	0	0	291.460	4.447	20	30		CIEDRN
CSc1ccc([C@H](C)NCc2ccccc2C#N)cc1	ZINC000229803195	333309788	/nfs/dbraw/zinc/30/97/88/333309788.db2.gz	AVMIIKWKTTWZBQ-ZDUSSCGKSA-N	0	0	282.412	4.131	20	30		CIEDRN
CCc1ccc([C@@H](C)CC(=O)N(CC#N)C2CCCC2)cc1	ZINC000523137298	333310303	/nfs/dbraw/zinc/31/03/03/333310303.db2.gz	RQAIYSIFBHQUSV-HNNXBMFYSA-N	0	0	298.430	4.037	20	30		CIEDRN
C=CCCC(=O)N1CCC[C@H](C)[C@@H]1c1ccc(C)cc1	ZINC000523143457	333310979	/nfs/dbraw/zinc/31/09/79/333310979.db2.gz	CPBHKOUEPPJPQZ-MAUKXSAKSA-N	0	0	271.404	4.261	20	30		CIEDRN
C=CCN(C(=O)C1CCCCCC1)c1ccccc1	ZINC000523183690	333312184	/nfs/dbraw/zinc/31/21/84/333312184.db2.gz	JDWBFCVXJBTWTB-UHFFFAOYSA-N	0	0	257.377	4.176	20	30		CIEDRN
C=CCCC(=O)N[C@@H](C)C(c1ccccc1)c1ccccc1	ZINC000523223959	333312863	/nfs/dbraw/zinc/31/28/63/333312863.db2.gz	DEDLBKUBNDTASH-INIZCTEOSA-N	0	0	293.410	4.289	20	30		CIEDRN
C=CCCC(=O)N(CCC)[C@H](CC)c1ccccc1	ZINC000523222934	333312907	/nfs/dbraw/zinc/31/29/07/333312907.db2.gz	BCGRZGYVCIEFJN-MRXNPFEDSA-N	0	0	259.393	4.343	20	30		CIEDRN
C=CCCC(=O)N[C@H](c1ccc(F)cc1)C1CCCC1	ZINC000523286387	333314559	/nfs/dbraw/zinc/31/45/59/333314559.db2.gz	PZEJPTULHVOTKC-KRWDZBQOSA-N	0	0	275.367	4.139	20	30		CIEDRN
Cc1ccc(Cl)c(NCc2ccc(C#N)cc2F)c1	ZINC000230213113	333315683	/nfs/dbraw/zinc/31/56/83/333315683.db2.gz	BXXCGQZNYUSPHC-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)N[C@@H](C)[C@@H](C)CC)c1	ZINC000523420933	333326164	/nfs/dbraw/zinc/32/61/64/333326164.db2.gz	IAVCALZIELWLTL-KBPBESRZSA-N	0	0	290.407	4.198	20	30		CIEDRN
C=CCCSCc1cc(-c2cccs2)on1	ZINC000523522094	333332204	/nfs/dbraw/zinc/33/22/04/333332204.db2.gz	VKABNVBDINFUIL-UHFFFAOYSA-N	0	0	251.376	4.212	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1ccc(CCC)cc1	ZINC000523512838	333331622	/nfs/dbraw/zinc/33/16/22/333331622.db2.gz	UXPAQNQPAIQWBH-UHFFFAOYSA-N	0	0	273.420	4.458	20	30		CIEDRN
N#Cc1cccnc1NCC1(c2cccs2)CCCCC1	ZINC000523517004	333331806	/nfs/dbraw/zinc/33/18/06/333331806.db2.gz	IUZUCSLYBRVGCO-UHFFFAOYSA-N	0	0	297.427	4.329	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Nc1cccc2cccnc21	ZINC000523555476	333332814	/nfs/dbraw/zinc/33/28/14/333332814.db2.gz	JLUKHYWFOIJUQG-UHFFFAOYSA-N	0	0	297.402	4.445	20	30		CIEDRN
CC(C)(C#N)CCNc1cc(Cl)c(F)c(Cl)c1	ZINC000232034220	333333049	/nfs/dbraw/zinc/33/30/49/333333049.db2.gz	OPUWQVYXGXKNNV-UHFFFAOYSA-N	0	0	275.154	4.484	20	30		CIEDRN
C[C@H](C#N)N[C@H](CC1CCCCC1)c1ccccc1	ZINC000523624670	333334383	/nfs/dbraw/zinc/33/43/83/333334383.db2.gz	VWDPBXSIDFOGJO-RHSMWYFYSA-N	0	0	256.393	4.200	20	30		CIEDRN
CC(C)(C#N)CCCCOc1ccc(C#N)c(Cl)c1	ZINC000232519714	333337931	/nfs/dbraw/zinc/33/79/31/333337931.db2.gz	MHSDGFUAWWUORS-UHFFFAOYSA-N	0	0	276.767	4.311	20	30		CIEDRN
CC(=O)c1ccc(OCCCCC(C)(C)C#N)c(C)c1	ZINC000232566445	333338856	/nfs/dbraw/zinc/33/88/56/333338856.db2.gz	CEHLZSGYKHOPFN-UHFFFAOYSA-N	0	0	273.376	4.297	20	30		CIEDRN
N#Cc1cccc(Cl)c1NCCc1c[nH]c2ccccc12	ZINC000303430463	333342030	/nfs/dbraw/zinc/34/20/30/333342030.db2.gz	FQWABIZZVHMLDV-UHFFFAOYSA-N	0	0	295.773	4.348	20	30		CIEDRN
C=CCCCN(C)C(=O)C1(c2ccc(F)cc2)CCCC1	ZINC000303704156	333345743	/nfs/dbraw/zinc/34/57/43/333345743.db2.gz	BLXLXWFXIVVVCH-UHFFFAOYSA-N	0	0	289.394	4.062	20	30		CIEDRN
C=CCCC(=O)N(CCc1ccc(Cl)cc1)CC1CC1	ZINC000523891346	333349134	/nfs/dbraw/zinc/34/91/34/333349134.db2.gz	VJBXHCVWOXVICU-UHFFFAOYSA-N	0	0	291.822	4.087	20	30		CIEDRN
C=CCCC(=O)N(C)[C@@H](C)c1ccc(Cl)cc1Cl	ZINC000523944450	333349731	/nfs/dbraw/zinc/34/97/31/333349731.db2.gz	LVDYCRBCCMSLQV-JTQLQIEISA-N	0	0	286.202	4.479	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1ccccc1CCC(C)C	ZINC000523983841	333350629	/nfs/dbraw/zinc/35/06/29/333350629.db2.gz	SVYXLCSGPIXKNJ-AWEZNQCLSA-N	0	0	274.408	4.361	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1ccc2c(ccn2CCC)c1	ZINC000523986752	333350740	/nfs/dbraw/zinc/35/07/40/333350740.db2.gz	NJXPNHXYQOKJTC-CYBMUJFWSA-N	0	0	285.391	4.137	20	30		CIEDRN
Cc1ccc(C)c(CC(=O)Nc2ccc(Cl)c(C#N)c2)c1	ZINC000524139446	333354008	/nfs/dbraw/zinc/35/40/08/333354008.db2.gz	HDTPKUSEWQTWLU-UHFFFAOYSA-N	0	0	298.773	4.010	20	30		CIEDRN
CCOc1cc(C#N)ccc1OCCCCC(C)(C)C#N	ZINC000233762511	333354849	/nfs/dbraw/zinc/35/48/49/333354849.db2.gz	RVOVWOGIMGKJLK-UHFFFAOYSA-N	0	0	286.375	4.056	20	30		CIEDRN
C=CC1CCN(C(=O)C[C@@H](CC)CCCC)CC1	ZINC000524214387	333356679	/nfs/dbraw/zinc/35/66/79/333356679.db2.gz	JZGSJRPMUBWCID-HNNXBMFYSA-N	0	0	251.414	4.018	20	30		CIEDRN
C=CC1CCN(C(=O)C(C)(C)c2cccc(Cl)c2)CC1	ZINC000524240265	333357419	/nfs/dbraw/zinc/35/74/19/333357419.db2.gz	DCNPJHFCPICWEW-UHFFFAOYSA-N	0	0	291.822	4.042	20	30		CIEDRN
CCc1ccc(OCCCCC(C)(C)C#N)c([N+](=O)[O-])c1	ZINC000234113327	333358216	/nfs/dbraw/zinc/35/82/16/333358216.db2.gz	KRVJWXHYRDMMOS-UHFFFAOYSA-N	0	0	290.363	4.256	20	30		CIEDRN
COc1cc(CNc2cccc(Cl)c2C)ccc1C#N	ZINC000234907827	333362885	/nfs/dbraw/zinc/36/28/85/333362885.db2.gz	VSWVPGDGZAWJTO-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
C=CCCC(=O)N[C@@H](c1ccccc1Cl)C(C)C	ZINC000524511135	333364009	/nfs/dbraw/zinc/36/40/09/333364009.db2.gz	RJLJPYVEKUOHDS-OAHLLOKOSA-N	0	0	265.784	4.120	20	30		CIEDRN
Cc1cc([C@@H](C)Nc2nccc(C#N)c2Cl)c(C)s1	ZINC000235285080	333367210	/nfs/dbraw/zinc/36/72/10/333367210.db2.gz	PWXNERLCESAVMJ-SECBINFHSA-N	0	0	291.807	4.458	20	30		CIEDRN
C[C@H](Nc1nccc(C#N)c1Cl)c1ccccc1Cl	ZINC000235538977	333370653	/nfs/dbraw/zinc/37/06/53/333370653.db2.gz	UOVZKAGUAKEELU-VIFPVBQESA-N	0	0	292.169	4.433	20	30		CIEDRN
C[C@H]1Cc2ccccc2N1CCCCC(C)(C)C#N	ZINC000235705661	333371755	/nfs/dbraw/zinc/37/17/55/333371755.db2.gz	UAFVXGJYOFSCQO-AWEZNQCLSA-N	0	0	256.393	4.158	20	30		CIEDRN
Cc1cccc(OCCCCC(C)(C)C#N)c1[N+](=O)[O-]	ZINC000235794196	333372161	/nfs/dbraw/zinc/37/21/61/333372161.db2.gz	BITSWYHMZBFCRL-UHFFFAOYSA-N	0	0	276.336	4.002	20	30		CIEDRN
N#Cc1ccnc(N2CCC3(CCCCC3)CC2)c1Cl	ZINC000236029026	333372919	/nfs/dbraw/zinc/37/29/19/333372919.db2.gz	DVNVXTQTEFVBLR-UHFFFAOYSA-N	0	0	289.810	4.157	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)c2ccccc2F)c1	ZINC000009824250	333373293	/nfs/dbraw/zinc/37/32/93/333373293.db2.gz	MFQYTVYDAYQJMU-UHFFFAOYSA-N	0	0	285.318	4.033	20	30		CIEDRN
CC1(C)Cc2cc(CNc3ccc(CC#N)cc3)ccc2O1	ZINC000236763807	333375552	/nfs/dbraw/zinc/37/55/52/333375552.db2.gz	OTXPYFJJDJAYHD-UHFFFAOYSA-N	0	0	292.382	4.078	20	30		CIEDRN
C[C@H](NCc1cccc(C#N)c1)c1nc(C(C)(C)C)cs1	ZINC000237484563	333379766	/nfs/dbraw/zinc/37/97/66/333379766.db2.gz	FTYNQALRVQLCSR-LBPRGKRZSA-N	0	0	299.443	4.163	20	30		CIEDRN
CC(C)c1ccc(CNc2ccc([N+](=O)[O-])cc2C#N)cc1	ZINC000315646999	333382968	/nfs/dbraw/zinc/38/29/68/333382968.db2.gz	ZUMIWPRXRHNDSY-UHFFFAOYSA-N	0	0	295.342	4.202	20	30		CIEDRN
CCn1c2ccc(C#N)cc2nc1-c1coc2ccccc12	ZINC000316056318	333385313	/nfs/dbraw/zinc/38/53/13/333385313.db2.gz	ORQNPWVMSZOKIF-UHFFFAOYSA-N	0	0	287.322	4.341	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@H]1CCC[C@H](C)C1	ZINC000524983871	333394659	/nfs/dbraw/zinc/39/46/59/333394659.db2.gz	FMCMOKYZBMZVMF-GJZGRUSLSA-N	0	0	251.414	4.018	20	30		CIEDRN
CCc1ccccc1CNc1c(C#N)cnc2ccccc21	ZINC000316274579	333387693	/nfs/dbraw/zinc/38/76/93/333387693.db2.gz	SVFOHRDVOSTGSF-UHFFFAOYSA-N	0	0	287.366	4.281	20	30		CIEDRN
CCc1ccccc1CNc1cc(C#N)c2ccccc2n1	ZINC000316283152	333387892	/nfs/dbraw/zinc/38/78/92/333387892.db2.gz	UDRBROHQIPVJQI-UHFFFAOYSA-N	0	0	287.366	4.281	20	30		CIEDRN
C=CCCCNc1cccc(C(=O)N(C)c2ccccc2)c1	ZINC000524844513	333390248	/nfs/dbraw/zinc/39/02/48/333390248.db2.gz	MCJPNLWKVZWICB-UHFFFAOYSA-N	0	0	294.398	4.341	20	30		CIEDRN
Cc1ccc(Oc2ncc(C#N)cc2Cl)c(Cl)c1	ZINC000524845423	333390428	/nfs/dbraw/zinc/39/04/28/333390428.db2.gz	ZAOZBWXMALJSJR-UHFFFAOYSA-N	0	0	279.126	4.361	20	30		CIEDRN
N#Cc1nnc2ccccc2c1Sc1ccc(Cl)cc1	ZINC000524857866	333390923	/nfs/dbraw/zinc/39/09/23/333390923.db2.gz	RMBNMRTZZWCAHA-UHFFFAOYSA-N	0	0	297.770	4.306	20	30		CIEDRN
C[C@@H](CCNc1ccc([N+](=O)[O-])c(C#N)c1)c1ccccc1	ZINC000316522061	333398393	/nfs/dbraw/zinc/39/83/93/333398393.db2.gz	WMCUNQOALPGGTH-ZDUSSCGKSA-N	0	0	295.342	4.072	20	30		CIEDRN
C[C@@H]1CCCC[C@H]1OCCSc1ccc(C#N)cc1F	ZINC000525115863	333398739	/nfs/dbraw/zinc/39/87/39/333398739.db2.gz	DKKFCFWENLOKDS-IUODEOHRSA-N	0	0	293.407	4.385	20	30		CIEDRN
C=CCCCCCN(C)C(=O)N[C@H]1CCC[C@H](CC)C1	ZINC000525404852	333411443	/nfs/dbraw/zinc/41/14/43/333411443.db2.gz	KZMOSWZVRLCWNM-HOTGVXAUSA-N	0	0	280.456	4.343	20	30		CIEDRN
CCC(CC)N(C(=O)C[C@H](CC#N)c1ccccc1)C1CC1	ZINC000526001098	333418333	/nfs/dbraw/zinc/41/83/33/333418333.db2.gz	FEOGAMATWLXZCE-INIZCTEOSA-N	0	0	298.430	4.254	20	30		CIEDRN
C=CCC1(c2nc(-c3ccccc3Cl)no2)CCC1	ZINC000576025549	335142987	/nfs/dbraw/zinc/14/29/87/335142987.db2.gz	KLSGNCBBZDWRLT-UHFFFAOYSA-N	0	0	274.751	4.388	20	30		CIEDRN
CCC(C#N)(CC)C(=O)Nc1cc(C)c(C)cc1Cl	ZINC000529440295	333487237	/nfs/dbraw/zinc/48/72/37/333487237.db2.gz	AKFYJFMLAVLDIQ-UHFFFAOYSA-N	0	0	278.783	4.225	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1cc(OC)c(O)c2ccccc12	ZINC000529548576	333496539	/nfs/dbraw/zinc/49/65/39/333496539.db2.gz	UKSLMLPAQWNOTL-UHFFFAOYSA-N	0	0	299.370	4.095	20	30		CIEDRN
N#Cc1ccccc1OCCSc1ccccc1Cl	ZINC000037143589	333497903	/nfs/dbraw/zinc/49/79/03/333497903.db2.gz	SMSKOJRFWFJIOS-UHFFFAOYSA-N	0	0	289.787	4.383	20	30		CIEDRN
N#Cc1cccc(OCCSc2ccccc2Cl)c1	ZINC000037143590	333497908	/nfs/dbraw/zinc/49/79/08/333497908.db2.gz	KHBYVPUQVARFKW-UHFFFAOYSA-N	0	0	289.787	4.383	20	30		CIEDRN
N#Cc1ccccc1OCCSc1ccc(F)cc1F	ZINC000037143775	333500834	/nfs/dbraw/zinc/50/08/34/333500834.db2.gz	XOTHTFULLLSKFD-UHFFFAOYSA-N	0	0	291.322	4.008	20	30		CIEDRN
C[C@@H](CN(C)C(=O)c1ccc(CC#N)cc1)C1CCCCC1	ZINC000530040814	333521398	/nfs/dbraw/zinc/52/13/98/333521398.db2.gz	WRDRSFQXMIGYCQ-HNNXBMFYSA-N	0	0	298.430	4.041	20	30		CIEDRN
N#Cc1cnc(CNc2cccc(C3CCCCC3)c2)nc1	ZINC000530119534	333523635	/nfs/dbraw/zinc/52/36/35/333523635.db2.gz	SROGDQJFXPZTTR-UHFFFAOYSA-N	0	0	292.386	4.008	20	30		CIEDRN
C[C@H]1C[C@H](C)CN(c2ccc(C#N)c(C(F)(F)F)c2)C1	ZINC000037306402	333531757	/nfs/dbraw/zinc/53/17/57/333531757.db2.gz	OOHYGRHZSZVZSZ-QWRGUYRKSA-N	0	0	282.309	4.059	20	30		CIEDRN
N#Cc1cc(NCc2ccc(Cl)o2)ccc1Cl	ZINC000037508232	333534604	/nfs/dbraw/zinc/53/46/04/333534604.db2.gz	STZRYJMFOOKTCP-UHFFFAOYSA-N	0	0	267.115	4.070	20	30		CIEDRN
Cc1ccc(N[C@H](C)c2cccc(C#N)c2)c(C)c1	ZINC000037509810	333534774	/nfs/dbraw/zinc/53/47/74/333534774.db2.gz	MABYLSRBOMKZAF-CQSZACIVSA-N	0	0	250.345	4.348	20	30		CIEDRN
C[C@@H](N[C@H](C)c1c(F)cccc1F)c1ccc(C#N)cc1	ZINC000037508439	333534776	/nfs/dbraw/zinc/53/47/76/333534776.db2.gz	MIPDMRNZDZICGS-VXGBXAGGSA-N	0	0	286.325	4.248	20	30		CIEDRN
C=CCCCCCNC(=O)Nc1cnn([C@H](C)CC)c1C	ZINC000576050784	335146284	/nfs/dbraw/zinc/14/62/84/335146284.db2.gz	SNAYVFDMNUYUEA-CYBMUJFWSA-N	0	0	292.427	4.030	20	30		CIEDRN
C[C@H](N[C@@H](C)c1c(F)cccc1F)c1cccc(C#N)c1	ZINC000037771856	333538785	/nfs/dbraw/zinc/53/87/85/333538785.db2.gz	IRVLLZWORMNPQU-RYUDHWBXSA-N	0	0	286.325	4.248	20	30		CIEDRN
CCN(C(=O)C[C@@H]1CC[C@H](C)C1)[C@@H](C)c1ccc(C#N)cc1	ZINC000123924746	333554534	/nfs/dbraw/zinc/55/45/34/333554534.db2.gz	OPHGMCCDIINXOM-YQQAZPJKSA-N	0	0	298.430	4.294	20	30		CIEDRN
C=CCCOCCCCC(=O)N[C@H]1CCCC[C@H]1C(C)C	ZINC000538295004	333583551	/nfs/dbraw/zinc/58/35/51/333583551.db2.gz	ZUDKYMDYKBQIEV-IRXDYDNUSA-N	0	0	295.467	4.080	20	30		CIEDRN
C=CCCOCCCCC(=O)N(CC)[C@@H]1CCCC[C@@H]1C	ZINC000538296755	333583696	/nfs/dbraw/zinc/58/36/96/333583696.db2.gz	LSZKLALJDAISGR-DLBZAZTESA-N	0	0	295.467	4.177	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1cnc2ccccc2c1C	ZINC000538327920	333585568	/nfs/dbraw/zinc/58/55/68/333585568.db2.gz	QSGGWQAYOAZKNP-CYBMUJFWSA-N	0	0	282.387	4.018	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)C1(c2cccc(F)c2)CCC1	ZINC000538335889	333585863	/nfs/dbraw/zinc/58/58/63/333585863.db2.gz	OPGPMNYFFJKXIP-AWEZNQCLSA-N	0	0	289.394	4.108	20	30		CIEDRN
Cc1ccc(C)c(OCCCSCC2(C#N)CC2)c1	ZINC000538414650	333589743	/nfs/dbraw/zinc/58/97/43/333589743.db2.gz	NBICFUUBIFZEBH-UHFFFAOYSA-N	0	0	275.417	4.109	20	30		CIEDRN
Cc1ccc(NC2CCC(C#N)(c3ccccc3)CC2)cn1	ZINC000538422452	333591436	/nfs/dbraw/zinc/59/14/36/333591436.db2.gz	QBDCQLFQGUHAJM-UHFFFAOYSA-N	0	0	291.398	4.206	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)c1cc2ccccc2o1	ZINC000126262758	333595478	/nfs/dbraw/zinc/59/54/78/333595478.db2.gz	BVYHNGONACRHSB-UHFFFAOYSA-N	0	0	284.359	4.025	20	30		CIEDRN
C=C[C@H](C)NC(=O)c1cc(SC)c(Cl)cc1Cl	ZINC000127307266	333626130	/nfs/dbraw/zinc/62/61/30/333626130.db2.gz	OAQBRXKLJUGNPE-ZETCQYMHSA-N	0	0	290.215	4.020	20	30		CIEDRN
C/C=C/C=C/C(=O)Nc1ccccc1S[C@@H](C)CC#N	ZINC000066800832	333629295	/nfs/dbraw/zinc/62/92/95/333629295.db2.gz	XFTZVJQKOPOFMA-CGNPCLDQSA-N	0	0	286.400	4.152	20	30		CIEDRN
C=CCN(C(=O)CCCCCc1cccs1)C1CC1	ZINC000539034242	333649733	/nfs/dbraw/zinc/64/97/33/333649733.db2.gz	YPBJKIHGGKIVRT-UHFFFAOYSA-N	0	0	277.433	4.028	20	30		CIEDRN
N#Cc1ccc(CNc2cc(F)cc(Cl)c2)c(F)c1	ZINC000128415319	333669303	/nfs/dbraw/zinc/66/93/03/333669303.db2.gz	DZDODYXSODHPDC-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1ccc(C(C)=O)c(C)c1	ZINC000539429724	333671058	/nfs/dbraw/zinc/67/10/58/333671058.db2.gz	TWANRHMTSYXIKT-ZDUSSCGKSA-N	0	0	288.391	4.064	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@H]1C[C@@]12CCCc1ccccc12	ZINC000539433942	333671246	/nfs/dbraw/zinc/67/12/46/333671246.db2.gz	VPNWYKPQOPVSGZ-QKYXUNIQSA-N	0	0	297.442	4.142	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@@H]1C[C@@]12CCCc1ccccc12	ZINC000539433944	333671358	/nfs/dbraw/zinc/67/13/58/333671358.db2.gz	VPNWYKPQOPVSGZ-ZAAXVRCTSA-N	0	0	297.442	4.142	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1cc(OC)ccc1Cl	ZINC000539449603	333671897	/nfs/dbraw/zinc/67/18/97/333671897.db2.gz	SCADOXUGBLUGAA-LLVKDONJSA-N	0	0	296.798	4.215	20	30		CIEDRN
Cc1cc(C)cc(OCCCSCC2(C#N)CC2)c1	ZINC000539515184	333675554	/nfs/dbraw/zinc/67/55/54/333675554.db2.gz	GWNAWJJWUGNZDY-UHFFFAOYSA-N	0	0	275.417	4.109	20	30		CIEDRN
CC(C)C[C@H]1C[C@@H](Nc2c(Cl)cccc2C#N)CCO1	ZINC000539611892	333681401	/nfs/dbraw/zinc/68/14/01/333681401.db2.gz	HHNLIXAZLVWGMD-KBPBESRZSA-N	0	0	292.810	4.217	20	30		CIEDRN
C[C@H](C#N)S[C@@H](C)c1ccc(OC(F)(F)F)cc1	ZINC000068463306	333702213	/nfs/dbraw/zinc/70/22/13/333702213.db2.gz	COPMWACWSXFZTC-BDAKNGLRSA-N	0	0	275.295	4.291	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)CCCC(F)(F)F)cc1	ZINC000539943843	333703841	/nfs/dbraw/zinc/70/38/41/333703841.db2.gz	WVYPKJYOYCOXKW-UHFFFAOYSA-N	0	0	298.308	4.159	20	30		CIEDRN
C=CCn1c2ccccc2nc1S[C@H](C)c1ncc(C)o1	ZINC000539996833	333705767	/nfs/dbraw/zinc/70/57/67/333705767.db2.gz	VUEDJEGUIYLGOU-GFCCVEGCSA-N	0	0	299.399	4.372	20	30		CIEDRN
C=C(CC)CSc1nnc(-c2ccccc2Cl)o1	ZINC000540212935	333721511	/nfs/dbraw/zinc/72/15/11/333721511.db2.gz	WQSYRKUEDWXGJY-UHFFFAOYSA-N	0	0	280.780	4.448	20	30		CIEDRN
C=CCN(CCc1ccccc1)C(=O)c1csc(C)c1C	ZINC000540231394	333722264	/nfs/dbraw/zinc/72/22/64/333722264.db2.gz	AFFNRCFQJPIHSD-UHFFFAOYSA-N	0	0	299.439	4.236	20	30		CIEDRN
Cc1ccccc1CNc1cc(C#N)c2ccccc2n1	ZINC000068770053	333728739	/nfs/dbraw/zinc/72/87/39/333728739.db2.gz	MMZWYEJZCBVECY-UHFFFAOYSA-N	0	0	273.339	4.027	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@H]1CCCC[C@@H]1C(F)(F)F	ZINC000540531484	333734084	/nfs/dbraw/zinc/73/40/84/333734084.db2.gz	DTMRMTWCDSKNMH-AVGNSLFASA-N	0	0	291.357	4.216	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000540536483	333734485	/nfs/dbraw/zinc/73/44/85/333734485.db2.gz	FNPXFCMJGCNMTF-LLVKDONJSA-N	0	0	291.782	4.078	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)C[C@@H](CC)c1ccccc1	ZINC000540540170	333734690	/nfs/dbraw/zinc/73/46/90/333734690.db2.gz	SLRNZORMNMNKLA-JKSUJKDBSA-N	0	0	273.420	4.431	20	30		CIEDRN
C[C@@H](NCC1(C#N)CC1)c1cc(F)c(Cl)cc1Cl	ZINC000540589638	333736024	/nfs/dbraw/zinc/73/60/24/333736024.db2.gz	GVGDFXIGSWBQKW-MRVPVSSYSA-N	0	0	287.165	4.087	20	30		CIEDRN
C[C@@H]1[C@H](C)Sc2ccccc2N1CCC(C)(C)C#N	ZINC000540667878	333741226	/nfs/dbraw/zinc/74/12/26/333741226.db2.gz	OWVXKCIZJAMTTM-OLZOCXBDSA-N	0	0	274.433	4.316	20	30		CIEDRN
C[C@H]1Sc2ccccc2N(CCC(C)(C)C#N)[C@H]1C	ZINC000540667879	333741380	/nfs/dbraw/zinc/74/13/80/333741380.db2.gz	OWVXKCIZJAMTTM-QWHCGFSZSA-N	0	0	274.433	4.316	20	30		CIEDRN
C=CCC[C@H](Nc1ccc(NC(C)=O)c(Cl)c1)C1CC1	ZINC000540700636	333742294	/nfs/dbraw/zinc/74/22/94/333742294.db2.gz	DMNKMDCVEBLFRE-HNNXBMFYSA-N	0	0	292.810	4.455	20	30		CIEDRN
CCC[C@H](Sc1ccc(C#N)cc1Cl)C(=O)OCC	ZINC000541073968	333761561	/nfs/dbraw/zinc/76/15/61/333761561.db2.gz	NGQVVKYCNARICK-ZDUSSCGKSA-N	0	0	297.807	4.036	20	30		CIEDRN
CC[C@]1(C)C[C@@H]1C(=O)Nc1ccccc1SCCC#N	ZINC000129408870	333762109	/nfs/dbraw/zinc/76/21/09/333762109.db2.gz	AFHXETYJSKOJEZ-MLGOLLRUSA-N	0	0	288.416	4.067	20	30		CIEDRN
N#Cc1ccc(SCC[C@@H]2CCCCO2)c(Cl)c1	ZINC000541784021	333792571	/nfs/dbraw/zinc/79/25/71/333792571.db2.gz	RRVCRAZTQSPZCL-LBPRGKRZSA-N	0	0	281.808	4.263	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N1CC=C(c2ccccc2C)C1	ZINC000541830816	333793700	/nfs/dbraw/zinc/79/37/00/333793700.db2.gz	BARDWGAFJNJTDB-MRXNPFEDSA-N	0	0	298.430	4.148	20	30		CIEDRN
N#Cc1ccc(NC[C@@H]2CCCc3ccccc32)cc1	ZINC000070163660	333800147	/nfs/dbraw/zinc/80/01/47/333800147.db2.gz	XOGGRIIQRHMICL-INIZCTEOSA-N	0	0	262.356	4.090	20	30		CIEDRN
CC(C)(C)c1cnc(SCc2ccc(C#N)cc2F)o1	ZINC000130023414	333807528	/nfs/dbraw/zinc/80/75/28/333807528.db2.gz	LMOZQKCCSNOUAK-UHFFFAOYSA-N	0	0	290.363	4.275	20	30		CIEDRN
CC(C)(C)c1cnc(SCc2cccc(C#N)c2)o1	ZINC000130170873	333821456	/nfs/dbraw/zinc/82/14/56/333821456.db2.gz	FPIKXVVANRWTBC-UHFFFAOYSA-N	0	0	272.373	4.136	20	30		CIEDRN
CC(C)(C)c1cnc(SCc2ccc(F)c(C#N)c2)o1	ZINC000130255077	333827249	/nfs/dbraw/zinc/82/72/49/333827249.db2.gz	DICISESBFLMUFW-UHFFFAOYSA-N	0	0	290.363	4.275	20	30		CIEDRN
C[C@@H](CCC(C)(C)C)C(=O)N[C@@H](C)c1ccc(C#N)cc1	ZINC000542513019	333829725	/nfs/dbraw/zinc/82/97/25/333829725.db2.gz	CBYOUWYAOXUAPU-KBPBESRZSA-N	0	0	286.419	4.198	20	30		CIEDRN
C[C@H](CCC(C)(C)C)C(=O)N[C@@]1(C#N)CCC[C@@H](C)C1	ZINC000542527176	333830943	/nfs/dbraw/zinc/83/09/43/333830943.db2.gz	SPHJMKOCFOFBOY-CPUCHLNUSA-N	0	0	278.440	4.037	20	30		CIEDRN
C=C[C@@H](CC(=O)NC[C@H](C)c1ccccc1)c1ccccc1	ZINC000542561481	333832157	/nfs/dbraw/zinc/83/21/57/333832157.db2.gz	BLPFPEBXCRVGGI-IRXDYDNUSA-N	0	0	293.410	4.266	20	30		CIEDRN
C=CCC[C@H](C)Nc1cccc(CC(=O)OC(C)(C)C)c1	ZINC000542703505	333837534	/nfs/dbraw/zinc/83/75/34/333837534.db2.gz	UEFVJPNKWXWUNB-AWEZNQCLSA-N	0	0	289.419	4.337	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N[C@@H](C)c1cc(C)cc(C)c1	ZINC000542847748	333845133	/nfs/dbraw/zinc/84/51/33/333845133.db2.gz	SLTPRGWCCPTYCB-GOEBONIOSA-N	0	0	274.408	4.018	20	30		CIEDRN
C=CCC[C@@H](C)Nc1ccc2oc(C3CC3)nc2c1	ZINC000130612398	333858927	/nfs/dbraw/zinc/85/89/27/333858927.db2.gz	HJYSLMFAWLUBIM-LLVKDONJSA-N	0	0	256.349	4.472	20	30		CIEDRN
C=CCN(C(=O)C12CC3C[C@@](C)(C1)C[C@](C)(C3)C2)C1CC1	ZINC000543453276	333876205	/nfs/dbraw/zinc/87/62/05/333876205.db2.gz	KTUJIRJPILQLDT-KOCGSPDRSA-N	0	0	287.447	4.160	20	30		CIEDRN
CCc1nocc1CS[C@@H](C)c1ccc(C#N)cc1	ZINC000576172372	335165156	/nfs/dbraw/zinc/16/51/56/335165156.db2.gz	KTJMMIHIMOWMHE-NSHDSACASA-N	0	0	272.373	4.103	20	30		CIEDRN
CS[C@@H](CNc1c(F)cc(C#N)cc1F)C(C)(C)C	ZINC000544065116	333913766	/nfs/dbraw/zinc/91/37/66/333913766.db2.gz	KDEQSTRYWRJEPZ-LBPRGKRZSA-N	0	0	284.375	4.026	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(NC[C@@H](C)c2ccc(F)cc2)c1	ZINC000544393597	333928705	/nfs/dbraw/zinc/92/87/05/333928705.db2.gz	BEVBEGGETOYKND-GFCCVEGCSA-N	0	0	296.345	4.116	20	30		CIEDRN
C=CCN(CC(F)(F)F)C(=O)[C@@H](C)CCC(C)(C)C	ZINC000544432077	333931047	/nfs/dbraw/zinc/93/10/47/333931047.db2.gz	HAVNGUHAXNWSDJ-NSHDSACASA-N	0	0	279.346	4.026	20	30		CIEDRN
C[C@@H](CCC(C)(C)C)C(=O)N(CC#N)c1ccccc1	ZINC000544428743	333931083	/nfs/dbraw/zinc/93/10/83/333931083.db2.gz	RYFNXJIVMUBNPH-AWEZNQCLSA-N	0	0	272.392	4.006	20	30		CIEDRN
C[C@H](CCC(C)(C)C)C(=O)N(CC#N)c1ccccc1	ZINC000544428744	333931089	/nfs/dbraw/zinc/93/10/89/333931089.db2.gz	RYFNXJIVMUBNPH-CQSZACIVSA-N	0	0	272.392	4.006	20	30		CIEDRN
CC(C)(C#N)c1ccccc1CNc1ccccc1F	ZINC000131407892	333934455	/nfs/dbraw/zinc/93/44/55/333934455.db2.gz	SAHLEKJJPTWLOI-UHFFFAOYSA-N	0	0	268.335	4.239	20	30		CIEDRN
C=CCC(CC=C)c1nc(C2Cc3ccccc3C2)no1	ZINC000544587767	333938418	/nfs/dbraw/zinc/93/84/18/333938418.db2.gz	GMAMQJYWSOQSLK-UHFFFAOYSA-N	0	0	280.371	4.188	20	30		CIEDRN
COc1cc(C)ccc1NCc1ccccc1C(C)(C)C#N	ZINC000131586818	333952441	/nfs/dbraw/zinc/95/24/41/333952441.db2.gz	URQMHSQBZPGOCY-UHFFFAOYSA-N	0	0	294.398	4.417	20	30		CIEDRN
C=CCCc1nc(-c2ccc(C)cc2OC2CCCC2)no1	ZINC000545038077	333959794	/nfs/dbraw/zinc/95/97/94/333959794.db2.gz	IDXHZLKYEPHSMG-UHFFFAOYSA-N	0	0	298.386	4.485	20	30		CIEDRN
C=CCCc1ccccc1N[C@@H]1CCO[C@@H](C(F)(F)F)C1	ZINC000576193951	335167543	/nfs/dbraw/zinc/16/75/43/335167543.db2.gz	MHSZMNRBOGLUSJ-UKRRQHHQSA-N	0	0	299.336	4.327	20	30		CIEDRN
C=C[C@H](Cc1nc([C@@H](C)C2CC2)no1)c1ccccc1	ZINC000545103217	333963143	/nfs/dbraw/zinc/96/31/43/333963143.db2.gz	IJXNRYLWUCAPHW-QWHCGFSZSA-N	0	0	268.360	4.095	20	30		CIEDRN
Cc1ccccc1[C@H](C)c1noc(C2(C#N)CCCCC2)n1	ZINC000545133424	333964487	/nfs/dbraw/zinc/96/44/87/333964487.db2.gz	SCBDBPLOIHQKKI-AWEZNQCLSA-N	0	0	295.386	4.255	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H]1C[C@H]1c1ccc(Cl)cc1	ZINC000131731108	333964683	/nfs/dbraw/zinc/96/46/83/333964683.db2.gz	INXNVSNTNUJOQD-JKSUJKDBSA-N	0	0	289.806	4.081	20	30		CIEDRN
Cc1ccc(-c2ccc(OC[C@H](C#N)CCC#N)cc2)cc1	ZINC000073089927	333967982	/nfs/dbraw/zinc/96/79/82/333967982.db2.gz	HLFGRTFPAXTQRQ-INIZCTEOSA-N	0	0	290.366	4.484	20	30		CIEDRN
CCCC[C@@H](CC)CC(=O)Nc1ccc(C#N)cc1OC	ZINC000545298174	333976586	/nfs/dbraw/zinc/97/65/86/333976586.db2.gz	XFIZIQQHSRERQU-CYBMUJFWSA-N	0	0	288.391	4.112	20	30		CIEDRN
N#Cc1cccc(CNc2ccccc2CC(F)(F)F)c1	ZINC000174896119	335168814	/nfs/dbraw/zinc/16/88/14/335168814.db2.gz	UPVCGGSNGVUJRD-UHFFFAOYSA-N	0	0	290.288	4.275	20	30		CIEDRN
C=CCC(CC=C)c1nc(-c2cccc(F)c2)no1	ZINC000545527736	333986960	/nfs/dbraw/zinc/98/69/60/333986960.db2.gz	NYRILUCBJZGHLS-UHFFFAOYSA-N	0	0	258.296	4.112	20	30		CIEDRN
C=CCCc1nc(-c2ccc(Cl)c(Cl)c2)no1	ZINC000545535547	333987161	/nfs/dbraw/zinc/98/71/61/333987161.db2.gz	VOZUIFDIBKBVCV-UHFFFAOYSA-N	0	0	269.131	4.162	20	30		CIEDRN
C=CCCO[C@H](C)c1nc(-c2cc(Cl)ccc2C)no1	ZINC000545695091	333995436	/nfs/dbraw/zinc/99/54/36/333995436.db2.gz	IYONGBORTDWAQA-LLVKDONJSA-N	0	0	292.766	4.352	20	30		CIEDRN
C=C[C@H](Cc1nc([C@@H](C)SCC)no1)c1ccccc1	ZINC000545783185	334000521	/nfs/dbraw/zinc/00/05/21/334000521.db2.gz	CPVBOFGBMQCNLH-CHWSQXEVSA-N	0	0	288.416	4.396	20	30		CIEDRN
C/C(=C/c1cccc(C(F)(F)F)c1)CN(C)[C@@H](C)CC#N	ZINC000564294865	334002844	/nfs/dbraw/zinc/00/28/44/334002844.db2.gz	LBLDZHQONRXPKK-SUIFULHWSA-N	0	0	296.336	4.343	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)N[C@@H]1CCC[C@@H]1CC	ZINC000132860520	334008087	/nfs/dbraw/zinc/00/80/87/334008087.db2.gz	WEYWMODOJFDSFO-DZGCQCFKSA-N	0	0	292.448	4.024	20	30		CIEDRN
C=C[C@H](CC(=O)N1CC[C@@H](C)C(C)(C)C1)c1ccccc1	ZINC000546139324	334016417	/nfs/dbraw/zinc/01/64/17/334016417.db2.gz	JJBVWNRVNPBXGO-HZPDHXFCSA-N	0	0	285.431	4.241	20	30		CIEDRN
C=CCC(CC=C)c1nc(Cc2cccc(F)c2)no1	ZINC000546261620	334023587	/nfs/dbraw/zinc/02/35/87/334023587.db2.gz	XXVKRGABWJIZOX-UHFFFAOYSA-N	0	0	272.323	4.035	20	30		CIEDRN
C=C(C)[C@@H](Cc1nc(CCC2CCCCC2)no1)OCC	ZINC000546343091	334028331	/nfs/dbraw/zinc/02/83/31/334028331.db2.gz	QNDKANLGUBZCEV-OAHLLOKOSA-N	0	0	292.423	4.106	20	30		CIEDRN
C=CCCCc1nc(COc2ccc3ccccc3c2)no1	ZINC000546348574	334028736	/nfs/dbraw/zinc/02/87/36/334028736.db2.gz	DDBGQZRQRYFXBT-UHFFFAOYSA-N	0	0	294.354	4.311	20	30		CIEDRN
C[C@@H](Oc1ccccc1C#N)c1nc([C@H](C)C(C)(C)C)no1	ZINC000546418093	334031685	/nfs/dbraw/zinc/03/16/85/334031685.db2.gz	XEGGCZAXWVLSGO-NWDGAFQWSA-N	0	0	299.374	4.231	20	30		CIEDRN
Cc1cc(C#N)ccc1-c1nc([C@H](C)C(C)(C)C)no1	ZINC000546424452	334032045	/nfs/dbraw/zinc/03/20/45/334032045.db2.gz	FFXNVUVTFWGKSF-NSHDSACASA-N	0	0	269.348	4.066	20	30		CIEDRN
C=CCC(CC=C)c1nc(-c2ccc3c(n2)CCCC3)no1	ZINC000546478172	334034600	/nfs/dbraw/zinc/03/46/00/334034600.db2.gz	JVYATBFJNDIGOD-UHFFFAOYSA-N	0	0	295.386	4.246	20	30		CIEDRN
N#Cc1cccc(/C=C\c2nc([C@@H]3CCCCS3)no2)c1	ZINC000546515797	334036851	/nfs/dbraw/zinc/03/68/51/334036851.db2.gz	YWQMKKQKRWWREK-DANTVBBOSA-N	0	0	297.383	4.070	20	30		CIEDRN
N#Cc1ccc(/C=C\c2nc([C@H]3CCCCS3)no2)cc1	ZINC000546517844	334037007	/nfs/dbraw/zinc/03/70/07/334037007.db2.gz	FDWKMRIYFSGVCC-QIAWRQBBSA-N	0	0	297.383	4.070	20	30		CIEDRN
Cc1ccccc1[C@@H](C)c1noc(-c2ccc(C#N)s2)n1	ZINC000546542441	334037965	/nfs/dbraw/zinc/03/79/65/334037965.db2.gz	URLJXUGDLFDGFA-LLVKDONJSA-N	0	0	295.367	4.130	20	30		CIEDRN
C=CCCO[C@H](C)c1nc([C@H](C)c2ccccc2C)no1	ZINC000546546518	334038215	/nfs/dbraw/zinc/03/82/15/334038215.db2.gz	VHFKIKYHYARPIS-ZIAGYGMSSA-N	0	0	286.375	4.184	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2ccc(C)c(F)c2)no1	ZINC000546639594	334042908	/nfs/dbraw/zinc/04/29/08/334042908.db2.gz	ZRNAPURPNLCUMN-LLVKDONJSA-N	0	0	260.312	4.254	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N[C@H](c1ccccc1C)C1CC1	ZINC000546660892	334044498	/nfs/dbraw/zinc/04/44/98/334044498.db2.gz	VTLMMXYKUHDYKK-RDJZCZTQSA-N	0	0	286.419	4.100	20	30		CIEDRN
C=CCC(CC=C)c1nc(Cc2ccccc2C)no1	ZINC000546939184	334056983	/nfs/dbraw/zinc/05/69/83/334056983.db2.gz	NMSLLJPBPIUOEJ-UHFFFAOYSA-N	0	0	268.360	4.205	20	30		CIEDRN
CC(=O)c1cccc(OCc2ccccc2C(C)(C)C#N)c1	ZINC000133837644	334062840	/nfs/dbraw/zinc/06/28/40/334062840.db2.gz	HPYJSABSUQNRBG-UHFFFAOYSA-N	0	0	293.366	4.269	20	30		CIEDRN
N#Cc1cccc(Cc2nc(CCC3CCCCC3)no2)c1	ZINC000547047450	334063675	/nfs/dbraw/zinc/06/36/75/334063675.db2.gz	UAYFDCPRFZXPML-UHFFFAOYSA-N	0	0	295.386	4.045	20	30		CIEDRN
C=CCC(CC=C)c1nc(-c2ccc3cc[nH]c3c2)no1	ZINC000547054052	334064165	/nfs/dbraw/zinc/06/41/65/334064165.db2.gz	RGEOQZZOPOFSCS-UHFFFAOYSA-N	0	0	279.343	4.454	20	30		CIEDRN
C[C@H]1CCC[C@@H](c2noc(C3(C#N)CCCCC3)n2)C1	ZINC000547056553	334064308	/nfs/dbraw/zinc/06/43/08/334064308.db2.gz	JRLSQNMYMOBLHT-QWHCGFSZSA-N	0	0	273.380	4.089	20	30		CIEDRN
C=CCCO[C@@H](C)c1nc([C@@H](C)c2ccc(C)cc2)no1	ZINC000547087427	334065847	/nfs/dbraw/zinc/06/58/47/334065847.db2.gz	BUQANBLRWLTACP-KBPBESRZSA-N	0	0	286.375	4.184	20	30		CIEDRN
C[C@@H](Cc1noc(-c2cc(C#N)cs2)n1)c1ccccc1	ZINC000547177235	334070760	/nfs/dbraw/zinc/07/07/60/334070760.db2.gz	PLVVZIUUNOFHKG-NSHDSACASA-N	0	0	295.367	4.016	20	30		CIEDRN
C=CCC[C@H](NC(=O)[C@H]1CC=CCC1)c1ccccc1	ZINC000133947920	334074301	/nfs/dbraw/zinc/07/43/01/334074301.db2.gz	WBIODYUPGOZWSH-IRXDYDNUSA-N	0	0	269.388	4.166	20	30		CIEDRN
C=CCC[C@@H](NC(=O)[C@H]1CC=CCC1)c1ccccc1	ZINC000133948104	334074464	/nfs/dbraw/zinc/07/44/64/334074464.db2.gz	WBIODYUPGOZWSH-DLBZAZTESA-N	0	0	269.388	4.166	20	30		CIEDRN
C=CCC[C@H](NC(=O)CCc1ccoc1)c1ccccc1	ZINC000134009923	334077378	/nfs/dbraw/zinc/07/73/78/334077378.db2.gz	AKVAYHXNDFTVPH-KRWDZBQOSA-N	0	0	283.371	4.036	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(Cl)cc2cccnc21	ZINC000547337418	334080966	/nfs/dbraw/zinc/08/09/66/334080966.db2.gz	GDZFDZVISDYOLM-NSHDSACASA-N	0	0	288.778	4.429	20	30		CIEDRN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@@H]1CCC[C@H](C)C1	ZINC000134158322	334082470	/nfs/dbraw/zinc/08/24/70/334082470.db2.gz	VRINRXPADKZYFJ-MAUKXSAKSA-N	0	0	298.430	4.122	20	30		CIEDRN
C=CCC[C@H](Nc1cncc(Br)c1)C1CC1	ZINC000134370246	334089239	/nfs/dbraw/zinc/08/92/39/334089239.db2.gz	JRPATDNOEXCXLE-ZDUSSCGKSA-N	0	0	281.197	4.001	20	30		CIEDRN
C=CCN(Cc1csc(C2CC2)n1)Cc1cccs1	ZINC000134855104	334105815	/nfs/dbraw/zinc/10/58/15/334105815.db2.gz	IJYTWJPFFYYFRW-UHFFFAOYSA-N	0	0	290.457	4.270	20	30		CIEDRN
Cc1cnc([C@@H](C)Nc2cc(C#N)c3ccccc3n2)s1	ZINC000134932789	334108845	/nfs/dbraw/zinc/10/88/45/334108845.db2.gz	JPUYQYGRMKVFHA-LLVKDONJSA-N	0	0	294.383	4.045	20	30		CIEDRN
CCC(=O)c1cccc(N[C@H](C#N)C2CCCCC2)c1	ZINC000135067444	334114307	/nfs/dbraw/zinc/11/43/07/334114307.db2.gz	RULVPARSEUWHIL-MRXNPFEDSA-N	0	0	270.376	4.164	20	30		CIEDRN
N#Cc1cc(F)ccc1NC(=O)c1csc2ccccc21	ZINC000135159039	334118271	/nfs/dbraw/zinc/11/82/71/334118271.db2.gz	YVMJGYHJRKXDCX-UHFFFAOYSA-N	0	0	296.326	4.164	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(N2CCCC2)cc1C	ZINC000135465258	334130877	/nfs/dbraw/zinc/13/08/77/334130877.db2.gz	IMLQNWFKKHCWJC-GOSISDBHSA-N	0	0	286.419	4.136	20	30		CIEDRN
C=C[C@@H](CC(=O)N(C(C)C)C1CCC1)c1ccccc1	ZINC000135535847	334132690	/nfs/dbraw/zinc/13/26/90/334132690.db2.gz	SKLLBPRQIYWOHQ-HNNXBMFYSA-N	0	0	271.404	4.136	20	30		CIEDRN
C[C@@H]1CCCC[C@@H]1CNc1nc(C(F)(F)F)ccc1C#N	ZINC000078834827	334141230	/nfs/dbraw/zinc/14/12/30/334141230.db2.gz	JJUMYWJUQMKPMS-ZYHUDNBSSA-N	0	0	297.324	4.210	20	30		CIEDRN
Cc1cc(-c2nc3cc(C#N)ccc3[nH]2)ccc1Cl	ZINC000135992134	334143312	/nfs/dbraw/zinc/14/33/12/334143312.db2.gz	OQWZRHHAYRKQHT-UHFFFAOYSA-N	0	0	267.719	4.063	20	30		CIEDRN
C=C[C@H](CC(=O)N1CCC(C(C)C)CC1)c1ccccc1	ZINC000136040139	334144817	/nfs/dbraw/zinc/14/48/17/334144817.db2.gz	BABAWZCHADRUFG-MRXNPFEDSA-N	0	0	285.431	4.241	20	30		CIEDRN
C[C@@H](SCc1ccc(-c2ccccc2C#N)cc1)[C@H](C)O	ZINC000079045987	334146403	/nfs/dbraw/zinc/14/64/03/334146403.db2.gz	LZBHVWOGZSGMEX-UONOGXRCSA-N	0	0	297.423	4.228	20	30		CIEDRN
Cc1cc(Cl)ccc1CN(CCC#N)Cc1ccco1	ZINC000136138369	334147861	/nfs/dbraw/zinc/14/78/61/334147861.db2.gz	KIMIWPOEYIECLI-UHFFFAOYSA-N	0	0	288.778	4.157	20	30		CIEDRN
C=CCOCCCC(=O)Nc1ccccc1-c1ccccc1	ZINC000079350211	334152162	/nfs/dbraw/zinc/15/21/62/334152162.db2.gz	SPAIQXKGQLOKRF-UHFFFAOYSA-N	0	0	295.382	4.275	20	30		CIEDRN
C=C(C)CSCc1coc(-c2cccc(F)c2)n1	ZINC000079351388	334152244	/nfs/dbraw/zinc/15/22/44/334152244.db2.gz	CVNREADYCHVOMT-UHFFFAOYSA-N	0	0	263.337	4.290	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)N[C@H]1CCC[C@H](C)C1	ZINC000079517346	334156137	/nfs/dbraw/zinc/15/61/37/334156137.db2.gz	UKWOXWDSNRSDBZ-KBPBESRZSA-N	0	0	292.448	4.024	20	30		CIEDRN
C[C@H](CCC(=O)Nc1ccccc1C#N)c1ccccc1	ZINC000136521775	334156778	/nfs/dbraw/zinc/15/67/78/334156778.db2.gz	LKISFXXCARZBSX-CQSZACIVSA-N	0	0	278.355	4.081	20	30		CIEDRN
Cc1ccc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)cc1C	ZINC000080452294	334171660	/nfs/dbraw/zinc/17/16/60/334171660.db2.gz	AMAZDZHQQPACPF-AWEZNQCLSA-N	0	0	298.411	4.373	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N(C)[C@H](C)C1CC1	ZINC000548879365	334178055	/nfs/dbraw/zinc/17/80/55/334178055.db2.gz	ZQZKHBILOUWFFQ-CYBMUJFWSA-N	0	0	272.392	4.067	20	30		CIEDRN
C[C@H]1CC(CCNc2c(Cl)cccc2C#N)C[C@H](C)O1	ZINC000548991638	334182188	/nfs/dbraw/zinc/18/21/88/334182188.db2.gz	LLQFNDKRIHSIGT-RYUDHWBXSA-N	0	0	292.810	4.217	20	30		CIEDRN
CC[C@@H](C)C(=O)N(Cc1ccccc1)c1ccccc1C#N	ZINC000564361579	334183061	/nfs/dbraw/zinc/18/30/61/334183061.db2.gz	TWKMQMRAMKCALG-OAHLLOKOSA-N	0	0	292.382	4.138	20	30		CIEDRN
C[C@@H]1CCCC[C@H]1CC(=O)N[C@@](C)(C#N)C1CCCCC1	ZINC000550350080	334220747	/nfs/dbraw/zinc/22/07/47/334220747.db2.gz	KIMNFCQOXJBYJV-VKJFTORMSA-N	0	0	290.451	4.182	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCC1(Sc2ccccc2)CC1	ZINC000550557615	334224457	/nfs/dbraw/zinc/22/44/57/334224457.db2.gz	TXFAXDYTMJNSSM-UHFFFAOYSA-N	0	0	289.444	4.030	20	30		CIEDRN
C=C(C)CN(CC)C(=O)NCc1cc2ccccc2s1	ZINC000550593957	334224926	/nfs/dbraw/zinc/22/49/26/334224926.db2.gz	BURYWLRDUKMZTM-UHFFFAOYSA-N	0	0	288.416	4.009	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)c2c(C)coc2C)c1	ZINC000550685930	334226882	/nfs/dbraw/zinc/22/68/82/334226882.db2.gz	WMSFHDVWHRTDHE-UHFFFAOYSA-N	0	0	285.343	4.104	20	30		CIEDRN
COC(C)(C)CCSc1ccc(C#N)cc1Cl	ZINC000551084966	334238043	/nfs/dbraw/zinc/23/80/43/334238043.db2.gz	KDXVAGUIVPQSDT-UHFFFAOYSA-N	0	0	269.797	4.119	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H](C)Oc2cccc(F)c2)n1	ZINC000551109390	334238829	/nfs/dbraw/zinc/23/88/29/334238829.db2.gz	KFPIEOLLRJXYSE-NSHDSACASA-N	0	0	290.338	4.202	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H](C)Oc2ccc(F)cc2)n1	ZINC000551138112	334239228	/nfs/dbraw/zinc/23/92/28/334239228.db2.gz	LBBLVWCLCPTKLQ-LLVKDONJSA-N	0	0	290.338	4.202	20	30		CIEDRN
C=CCC(C)(C)c1noc(/C=C(/C)c2ccccc2OC)n1	ZINC000551139877	334239261	/nfs/dbraw/zinc/23/92/61/334239261.db2.gz	JKGOMVHFKTYQAS-SEYXRHQNSA-N	0	0	298.386	4.492	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1cccc2ocnc21)c1ccccc1	ZINC000551282935	334244847	/nfs/dbraw/zinc/24/48/47/334244847.db2.gz	VKPZKHPGFDDNID-ZDUSSCGKSA-N	0	0	292.338	4.126	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCCCCc1ccc(Cl)s1	ZINC000551305105	334245816	/nfs/dbraw/zinc/24/58/16/334245816.db2.gz	AUSJVQPBDJRNAW-LBPRGKRZSA-N	0	0	299.867	4.443	20	30		CIEDRN
C=CCCCN(C)C(=O)c1sc2ccc(C#N)cc2c1C	ZINC000551319823	334246866	/nfs/dbraw/zinc/24/68/66/334246866.db2.gz	XNZJUSOICGJLOV-UHFFFAOYSA-N	0	0	298.411	4.120	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(Cc2ccccc2C)no1	ZINC000551403094	334249322	/nfs/dbraw/zinc/24/93/22/334249322.db2.gz	LAEXWCXGOROJPC-ZDUSSCGKSA-N	0	0	256.349	4.039	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(Cc2ccccc2C)no1	ZINC000551403093	334249330	/nfs/dbraw/zinc/24/93/30/334249330.db2.gz	LAEXWCXGOROJPC-CYBMUJFWSA-N	0	0	256.349	4.039	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cc3ccc(OC)cc3[nH]2)n1	ZINC000551470906	334251223	/nfs/dbraw/zinc/25/12/23/334251223.db2.gz	WIIMASUSSDUVDJ-UHFFFAOYSA-N	0	0	297.358	4.080	20	30		CIEDRN
C=CCC(C)(C)c1noc(CO[C@@H]2CCCC[C@@H]2CC)n1	ZINC000551491758	334251591	/nfs/dbraw/zinc/25/15/91/334251591.db2.gz	HNDFETAYXGKIQS-UONOGXRCSA-N	0	0	292.423	4.409	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H](C)COc2ccccc2)n1	ZINC000551499598	334251752	/nfs/dbraw/zinc/25/17/52/334251752.db2.gz	TWBVKTFXTAFTOK-ZDUSSCGKSA-N	0	0	286.375	4.106	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ccc(C)cc2C)n1	ZINC000551498393	334251753	/nfs/dbraw/zinc/25/17/53/334251753.db2.gz	ZBLCGAWAMGWOJU-UHFFFAOYSA-N	0	0	256.349	4.207	20	30		CIEDRN
CCC(CC)[C@H](C)C(=O)N(C)c1cc(Cl)ccc1C#N	ZINC000551683362	334257640	/nfs/dbraw/zinc/25/76/40/334257640.db2.gz	RMFARQNOFYOBAZ-NSHDSACASA-N	0	0	292.810	4.247	20	30		CIEDRN
C=C1CCN(C(=O)CSc2ccc3ccccc3c2)CC1	ZINC000552106340	334290315	/nfs/dbraw/zinc/29/03/15/334290315.db2.gz	ARSDGXVMJKWWSV-UHFFFAOYSA-N	0	0	297.423	4.111	20	30		CIEDRN
CCN(C[C@H](C)C#N)[C@H](C)c1cccc(Cl)c1F	ZINC000248577897	334306887	/nfs/dbraw/zinc/30/68/87/334306887.db2.gz	UPSBSPNLLFXMIO-GHMZBOCLSA-N	0	0	268.763	4.022	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)N[C@@H]1CCC[C@H](C(C)(C)C)CC1	ZINC000552491529	334331690	/nfs/dbraw/zinc/33/16/90/334331690.db2.gz	RBOPJVSXTHNJMZ-JJRVBVJISA-N	0	0	278.440	4.037	20	30		CIEDRN
C=C(CC)CS[C@H](C)C(=O)Nc1ccc(C)cc1F	ZINC000552624957	334340099	/nfs/dbraw/zinc/34/00/99/334340099.db2.gz	HBKQCLSCSIJTCG-GFCCVEGCSA-N	0	0	281.396	4.161	20	30		CIEDRN
C=C(CC)CS[C@@H](C)C(=O)Nc1ccc(C)cc1F	ZINC000552624958	334340126	/nfs/dbraw/zinc/34/01/26/334340126.db2.gz	HBKQCLSCSIJTCG-LBPRGKRZSA-N	0	0	281.396	4.161	20	30		CIEDRN
C=C[C@H](CC(=O)NC(C#N)(CCC)CCC)c1ccccc1	ZINC000090000828	334355264	/nfs/dbraw/zinc/35/52/64/334355264.db2.gz	GFQAOHDGAWSLBD-MRXNPFEDSA-N	0	0	298.430	4.325	20	30		CIEDRN
C=CCCc1csc(-c2ccc(NC(=O)C3CC3)cc2)n1	ZINC000090065507	334356609	/nfs/dbraw/zinc/35/66/09/334356609.db2.gz	UPGOLYPVTDADIW-UHFFFAOYSA-N	0	0	298.411	4.277	20	30		CIEDRN
C=CCCc1csc(N[C@H]2CCOc3ccccc32)n1	ZINC000090065604	334356800	/nfs/dbraw/zinc/35/68/00/334356800.db2.gz	VZWFGZKKOUTNIW-AWEZNQCLSA-N	0	0	286.400	4.197	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccc2c(Cl)cccc2n1	ZINC000553134318	334363948	/nfs/dbraw/zinc/36/39/48/334363948.db2.gz	ZJGFCGGAWDKTFV-UHFFFAOYSA-N	0	0	286.762	4.020	20	30		CIEDRN
CC(C)c1ccc([C@H]2CCCN2c2ccnc(C#N)c2)cc1	ZINC000553146320	334364771	/nfs/dbraw/zinc/36/47/71/334364771.db2.gz	JLNGIKUFDFZQGC-LJQANCHMSA-N	0	0	291.398	4.418	20	30		CIEDRN
Cc1nsc(NCc2cccc(C(C)C)c2)c1C#N	ZINC000553207541	334368986	/nfs/dbraw/zinc/36/89/86/334368986.db2.gz	QAOXQALUFKNYLA-UHFFFAOYSA-N	0	0	271.389	4.059	20	30		CIEDRN
CC(C)[C@H](C)C(=O)Nc1cc(C(C)(C)C)sc1C#N	ZINC000091208314	334373614	/nfs/dbraw/zinc/37/36/14/334373614.db2.gz	JUQJYWPTDOHZOW-JTQLQIEISA-N	0	0	278.421	4.148	20	30		CIEDRN
CC(C)SCCNc1cc(C#N)ccc1C(F)(F)F	ZINC000553365453	334380905	/nfs/dbraw/zinc/38/09/05/334380905.db2.gz	JBDHXJGWZVUQQE-UHFFFAOYSA-N	0	0	288.338	4.131	20	30		CIEDRN
Cc1cc(Oc2ccc(Cl)c(C#N)n2)c(C)c(C)c1C#N	ZINC000553387572	334381807	/nfs/dbraw/zinc/38/18/07/334381807.db2.gz	HSXCJTSGGRNBEM-UHFFFAOYSA-N	0	0	297.745	4.196	20	30		CIEDRN
Cc1cc(Oc2cc(C(C)C)ncn2)c(C)c(C)c1C#N	ZINC000553390813	334382002	/nfs/dbraw/zinc/38/20/02/334382002.db2.gz	PRAIHOYVSLMSOJ-UHFFFAOYSA-N	0	0	281.359	4.189	20	30		CIEDRN
Cc1cccnc1SCc1ccccc1C(C)(C)C#N	ZINC000553513985	334389423	/nfs/dbraw/zinc/38/94/23/334389423.db2.gz	SVHOPCDRDWKELP-UHFFFAOYSA-N	0	0	282.412	4.484	20	30		CIEDRN
C=CCC[C@H](C(=O)NCCC1(F)CCC1)c1ccccc1	ZINC000553726426	334397054	/nfs/dbraw/zinc/39/70/54/334397054.db2.gz	IERIJQXAMUAMEN-INIZCTEOSA-N	0	0	289.394	4.135	20	30		CIEDRN
C=CCC[C@@H](C(=O)NCC(C)(C)CCC#N)c1ccccc1	ZINC000553731497	334397226	/nfs/dbraw/zinc/39/72/26/334397226.db2.gz	UZWVURIUQUIJLM-QGZVFWFLSA-N	0	0	298.430	4.183	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1c(C)cc(OC)c(C)c1C	ZINC000553736513	334397390	/nfs/dbraw/zinc/39/73/90/334397390.db2.gz	YYZKABOTONSXOX-LBPRGKRZSA-N	0	0	275.392	4.161	20	30		CIEDRN
CC(C)C[C@H]1C[C@@H](Nc2ccc(C#N)c(Cl)c2)CCO1	ZINC000553785978	334398613	/nfs/dbraw/zinc/39/86/13/334398613.db2.gz	ODVVZSQNJIFNPI-GJZGRUSLSA-N	0	0	292.810	4.217	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NC[C@H]1CCCC[C@H]1C(F)(F)F	ZINC000554075502	334409619	/nfs/dbraw/zinc/40/96/19/334409619.db2.gz	FUJFWIZGIVCIID-JHJVBQTASA-N	0	0	291.357	4.074	20	30		CIEDRN
C=CCC[C@@H](C)Nc1cnn(CC(C)C)c1C1CC1	ZINC000554401391	334428540	/nfs/dbraw/zinc/42/85/40/334428540.db2.gz	BCEMLCGHZWQUBX-CYBMUJFWSA-N	0	0	261.413	4.183	20	30		CIEDRN
C/C=C\c1ccc(NCc2ccc(F)c(C#N)c2)cc1	ZINC000554781186	334451843	/nfs/dbraw/zinc/45/18/43/334451843.db2.gz	MJKQDGJYKSDNTL-IHWYPQMZSA-N	0	0	266.319	4.343	20	30		CIEDRN
C=C[C@](C)(CC)c1nc([C@H](C)c2ccc(C)cc2)no1	ZINC000554805976	334453544	/nfs/dbraw/zinc/45/35/44/334453544.db2.gz	OOYNRUCTPOIJOG-CXAGYDPISA-N	0	0	270.376	4.384	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc([C@@H](C)c2ccc(C)cc2)no1	ZINC000554805978	334453551	/nfs/dbraw/zinc/45/35/51/334453551.db2.gz	OOYNRUCTPOIJOG-GUYCJALGSA-N	0	0	270.376	4.384	20	30		CIEDRN
CC(C)(CC(=O)Nc1ccccc1CC#N)c1ccccc1	ZINC000555525064	334480268	/nfs/dbraw/zinc/48/02/68/334480268.db2.gz	QJBADQMAZOIIJJ-UHFFFAOYSA-N	0	0	292.382	4.059	20	30		CIEDRN
Cc1cc(CNc2cncc3ccccc32)ccc1C#N	ZINC000555964510	334492831	/nfs/dbraw/zinc/49/28/31/334492831.db2.gz	HWPQQMCSMSEOAE-UHFFFAOYSA-N	0	0	273.339	4.027	20	30		CIEDRN
N#Cc1ccc(/C=C\c2cc(F)cc(C(F)(F)F)c2)nc1	ZINC000254916098	334494106	/nfs/dbraw/zinc/49/41/06/334494106.db2.gz	JNBJYNAYUJHMDB-IWQZZHSRSA-N	0	0	292.235	4.282	20	30		CIEDRN
C=CCC1(C(=O)N(C)[C@H]2CCCc3ccccc32)CCC1	ZINC000556097069	334495214	/nfs/dbraw/zinc/49/52/14/334495214.db2.gz	IXILPIWXJIRWKQ-KRWDZBQOSA-N	0	0	283.415	4.269	20	30		CIEDRN
C=CCC1(C(=O)N(C)[C@@H]2CCCc3ccccc32)CCC1	ZINC000556097074	334495319	/nfs/dbraw/zinc/49/53/19/334495319.db2.gz	IXILPIWXJIRWKQ-QGZVFWFLSA-N	0	0	283.415	4.269	20	30		CIEDRN
C=CCC(F)(F)c1nc(-c2ccc(CSC)cc2)no1	ZINC000556286974	334506278	/nfs/dbraw/zinc/50/62/78/334506278.db2.gz	WQDHXPRLZJJBCU-UHFFFAOYSA-N	0	0	296.342	4.268	20	30		CIEDRN
Cc1cc(C#N)ccc1C(=O)N1CCC(C)(CC(C)C)CC1	ZINC000565309328	334551649	/nfs/dbraw/zinc/55/16/49/334551649.db2.gz	IEMQUYADNCGYES-UHFFFAOYSA-N	0	0	298.430	4.155	20	30		CIEDRN
CC[C@@H]1CCCC[C@H]1C(=O)Nc1scc(C)c1C#N	ZINC000565328557	334553231	/nfs/dbraw/zinc/55/32/31/334553231.db2.gz	GFKIARUQTFQYED-VXGBXAGGSA-N	0	0	276.405	4.083	20	30		CIEDRN
C=CCCOCCCCc1nc(-c2sccc2C)no1	ZINC000565404545	334559803	/nfs/dbraw/zinc/55/98/03/334559803.db2.gz	OJLJSYKNDZTSMN-UHFFFAOYSA-N	0	0	292.404	4.022	20	30		CIEDRN
C[C@@H](CC(=O)N[C@@H](CCC#N)c1ccccc1)C(C)(C)C	ZINC000153257722	334576905	/nfs/dbraw/zinc/57/69/05/334576905.db2.gz	FRWXRWVNMYPMIL-HOCLYGCPSA-N	0	0	286.419	4.220	20	30		CIEDRN
CCc1sc(C(=O)Nc2scc(C)c2C#N)cc1C	ZINC000565857853	334603429	/nfs/dbraw/zinc/60/34/29/334603429.db2.gz	LVNYFPXUOZQTIH-UHFFFAOYSA-N	0	0	290.413	4.113	20	30		CIEDRN
CCCC(C)(C)CC(=O)Nc1cc(C#N)c2ccccc2n1	ZINC000566643932	334658951	/nfs/dbraw/zinc/65/89/51/334658951.db2.gz	JQBXHWOPZBJEJH-UHFFFAOYSA-N	0	0	295.386	4.261	20	30		CIEDRN
C[C@H](CCC(C)(C)C)C(=O)Nc1ccccc1CC#N	ZINC000566820918	334665833	/nfs/dbraw/zinc/66/58/33/334665833.db2.gz	MIIJGTWFODAZLB-CYBMUJFWSA-N	0	0	272.392	4.154	20	30		CIEDRN
Cc1ccc(C)c(OCCSCCC(C)(C)C#N)c1	ZINC000566936997	334670053	/nfs/dbraw/zinc/67/00/53/334670053.db2.gz	HZTQTUCUDGMARL-UHFFFAOYSA-N	0	0	277.433	4.355	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc([C@H](C)c2cccs2)no1	ZINC000566940181	334670406	/nfs/dbraw/zinc/67/04/06/334670406.db2.gz	SHTHUCDSPJAPBU-YGRLFVJLSA-N	0	0	262.378	4.137	20	30		CIEDRN
CC1(C)CCCN(Cc2cc3cc(F)ccc3o2)[C@@H]1C#N	ZINC000567013483	334672990	/nfs/dbraw/zinc/67/29/90/334672990.db2.gz	GINRPBWTLNLNFD-MRXNPFEDSA-N	0	0	286.350	4.086	20	30		CIEDRN
C[C@H](C(=O)N[C@H](CCC#N)c1ccccc1)c1ccsc1	ZINC000153651433	334675646	/nfs/dbraw/zinc/67/56/46/334675646.db2.gz	GQJOVIBFNCZSFC-XJKSGUPXSA-N	0	0	298.411	4.013	20	30		CIEDRN
C=CCC(C)(C)C(=O)N(CCC)CCc1cccc(F)c1	ZINC000567066869	334678091	/nfs/dbraw/zinc/67/80/91/334678091.db2.gz	GCGVVFJLZUBZCZ-UHFFFAOYSA-N	0	0	291.410	4.209	20	30		CIEDRN
CC(C)C[C@H](C)CC(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000153724733	334678307	/nfs/dbraw/zinc/67/83/07/334678307.db2.gz	KWBPJGPWZHSOQP-RDJZCZTQSA-N	0	0	286.419	4.220	20	30		CIEDRN
CO[C@H](C)c1cccc(NCCCC(C)(C)C#N)c1	ZINC000153749375	334678731	/nfs/dbraw/zinc/67/87/31/334678731.db2.gz	NLGAJSJVBQFBKY-CYBMUJFWSA-N	0	0	260.381	4.136	20	30		CIEDRN
Cc1ccc(C#N)cc1NCc1ccc2occc2c1	ZINC000567280656	334700462	/nfs/dbraw/zinc/70/04/62/334700462.db2.gz	NBZQJFKJUXJAEY-UHFFFAOYSA-N	0	0	262.312	4.225	20	30		CIEDRN
C=CCCS[C@H](C)c1nc(-c2ccccc2)no1	ZINC000154976057	334709712	/nfs/dbraw/zinc/70/97/12/334709712.db2.gz	MEGQNCTZAMPZOR-LLVKDONJSA-N	0	0	260.362	4.107	20	30		CIEDRN
Cc1ccc(C)c(N(C)C(=O)c2ccc(C#N)c(Cl)c2)c1	ZINC000155206691	334716155	/nfs/dbraw/zinc/71/61/55/334716155.db2.gz	NYBXKMAMFRGXIN-UHFFFAOYSA-N	0	0	298.773	4.105	20	30		CIEDRN
C=C[C@H](C)NC(=O)[C@H](Sc1ccccc1)c1ccccc1	ZINC000155510236	334722652	/nfs/dbraw/zinc/72/26/52/334722652.db2.gz	NPQMUCLPCDAXBM-WMLDXEAASA-N	0	0	297.423	4.211	20	30		CIEDRN
C=C[C@@H](C)NC(=O)[C@H](Sc1ccccc1)c1ccccc1	ZINC000155510337	334722664	/nfs/dbraw/zinc/72/26/64/334722664.db2.gz	NPQMUCLPCDAXBM-RHSMWYFYSA-N	0	0	297.423	4.211	20	30		CIEDRN
Cc1ccc(CNc2cccc(C(F)F)c2C#N)nc1C	ZINC000567520809	334728019	/nfs/dbraw/zinc/72/80/19/334728019.db2.gz	GBAGMFOXBRXMBU-UHFFFAOYSA-N	0	0	287.313	4.120	20	30		CIEDRN
C[C@H](Cc1ccccc1Cl)C(=O)Nc1ccccc1C#N	ZINC000156152428	334735756	/nfs/dbraw/zinc/73/57/56/334735756.db2.gz	JDHUMTNQHJQOAY-GFCCVEGCSA-N	0	0	298.773	4.029	20	30		CIEDRN
CC1=C(C)C[C@H](C(=O)N[C@@](C)(C#N)C2CCCCC2)CC1	ZINC000567737615	334757019	/nfs/dbraw/zinc/75/70/19/334757019.db2.gz	SUWSLPZKBLVRCQ-QAPCUYQASA-N	0	0	288.435	4.102	20	30		CIEDRN
CC[C@@H](CC1CCCC1)C(=O)NCC(C)(C)CCC#N	ZINC000567949725	334778249	/nfs/dbraw/zinc/77/82/49/334778249.db2.gz	NXIBFOPKKKADIE-HNNXBMFYSA-N	0	0	278.440	4.039	20	30		CIEDRN
CC[C@H](CC(=O)Nc1scc(C)c1C#N)c1ccccc1	ZINC000568134812	334795307	/nfs/dbraw/zinc/79/53/07/334795307.db2.gz	JGAKTEQDAWMELY-CYBMUJFWSA-N	0	0	298.411	4.451	20	30		CIEDRN
Cc1ccc(C[C@H](C#N)Sc2cccc(C#N)c2)cc1	ZINC000158654126	334808984	/nfs/dbraw/zinc/80/89/84/334808984.db2.gz	HUNQHKMVMUQARZ-QGZVFWFLSA-N	0	0	278.380	4.094	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2cc(C)cc(F)c2)no1	ZINC000568931521	334847394	/nfs/dbraw/zinc/84/73/94/334847394.db2.gz	OVNLLSOZFPHQPX-NSHDSACASA-N	0	0	260.312	4.254	20	30		CIEDRN
CC[C@@H]1CCCC[C@H]1c1noc(C2(C#N)CCCCC2)n1	ZINC000569126359	334856939	/nfs/dbraw/zinc/85/69/39/334856939.db2.gz	IQKGSQXPWFWJHJ-ZIAGYGMSSA-N	0	0	287.407	4.479	20	30		CIEDRN
CCCCOc1ccccc1NCc1cc(C#N)cs1	ZINC000159285171	334860651	/nfs/dbraw/zinc/86/06/51/334860651.db2.gz	JWBCFXAWKZWOSC-UHFFFAOYSA-N	0	0	286.400	4.411	20	30		CIEDRN
CCS[C@H]1CCC[C@H]1Nc1nc(C)c(C#N)cc1Cl	ZINC000336815924	334913636	/nfs/dbraw/zinc/91/36/36/334913636.db2.gz	JTCPTCYOUUHUAU-OLZOCXBDSA-N	0	0	295.839	4.001	20	30		CIEDRN
C=CCC(C)(C)c1noc(CSc2ccc(C#N)cc2)n1	ZINC000573192132	334915912	/nfs/dbraw/zinc/91/59/12/334915912.db2.gz	ZEMJLZSTGBUVLT-UHFFFAOYSA-N	0	0	299.399	4.087	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)c2cccc(C3CC3)c2)s1	ZINC000573216808	334918611	/nfs/dbraw/zinc/91/86/11/334918611.db2.gz	GTJSYLUBPSARIY-UHFFFAOYSA-N	0	0	296.395	4.312	20	30		CIEDRN
C[C@H](C(=O)Nc1sccc1C#N)c1ccc(Cl)s1	ZINC000175524407	335187320	/nfs/dbraw/zinc/18/73/20/335187320.db2.gz	QDHZSUJMHXDUDJ-ZETCQYMHSA-N	0	0	296.804	4.077	20	30		CIEDRN
C[C@H](CC(=O)N1CCC(CCC#N)CC1)C1CCCCC1	ZINC000576877347	335259170	/nfs/dbraw/zinc/25/91/70/335259170.db2.gz	VEMHRYIFGCBKHN-OAHLLOKOSA-N	0	0	290.451	4.135	20	30		CIEDRN
N#Cc1ccc(-c2nc(-c3cccc(F)c3)no2)cc1Cl	ZINC000576931173	335265186	/nfs/dbraw/zinc/26/51/86/335265186.db2.gz	CBSVJGFQQODWHE-UHFFFAOYSA-N	0	0	299.692	4.068	20	30		CIEDRN
Cc1ccc(C#N)c(Nc2cccc(NC3CCCC3)c2)n1	ZINC000577088870	335298372	/nfs/dbraw/zinc/29/83/72/335298372.db2.gz	DOAKJLIIHBJCQF-UHFFFAOYSA-N	0	0	292.386	4.360	20	30		CIEDRN
C=CCCOCCCCc1nc(C2CCCCCC2)no1	ZINC000577110533	335301873	/nfs/dbraw/zinc/30/18/73/335301873.db2.gz	IZBSFFBQVKMILU-UHFFFAOYSA-N	0	0	292.423	4.423	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2ccc(F)cc2C)no1	ZINC000577305440	335337216	/nfs/dbraw/zinc/33/72/16/335337216.db2.gz	OAWHOOYBOSJWHX-NSHDSACASA-N	0	0	260.312	4.254	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1nc(C(C)(C)C)co1)c1ccccc1	ZINC000577505722	335361291	/nfs/dbraw/zinc/36/12/91/335361291.db2.gz	KTSYHOHGHJGMHM-CQSZACIVSA-N	0	0	298.386	4.271	20	30		CIEDRN
Cc1ccnc(NCc2cc3ccccc3s2)c1C#N	ZINC000577795720	335401573	/nfs/dbraw/zinc/40/15/73/335401573.db2.gz	SGORNVAZTSWKCE-UHFFFAOYSA-N	0	0	279.368	4.089	20	30		CIEDRN
C=CCCSCc1ncc(-c2cccc(F)c2)o1	ZINC000177855954	335404237	/nfs/dbraw/zinc/40/42/37/335404237.db2.gz	CSMWWUKIOZFYAQ-UHFFFAOYSA-N	0	0	263.337	4.290	20	30		CIEDRN
N#Cc1ccccc1NC(=O)c1ccc2sccc2c1	ZINC000348410580	335425209	/nfs/dbraw/zinc/42/52/09/335425209.db2.gz	OVDSXCJDEJMTAB-UHFFFAOYSA-N	0	0	278.336	4.025	20	30		CIEDRN
C[C@H](Oc1ccc(C#N)cc1)c1ncc(-c2ccccc2)o1	ZINC000178301417	335425255	/nfs/dbraw/zinc/42/52/55/335425255.db2.gz	KYOWMJKZHYWMJD-ZDUSSCGKSA-N	0	0	290.322	4.353	20	30		CIEDRN
CCc1ccc([C@@H](C#N)NC(=O)[C@@H](C)C(CC)CC)cc1	ZINC000578047605	335471583	/nfs/dbraw/zinc/47/15/83/335471583.db2.gz	LDMWVQZUMHMIFC-SUMWQHHRSA-N	0	0	286.419	4.002	20	30		CIEDRN
C=C(C)CCNc1cc(Cl)ccc1OC[C@H]1CCOC1	ZINC000578046839	335471599	/nfs/dbraw/zinc/47/15/99/335471599.db2.gz	LXSPPCXOZSYNQW-ZDUSSCGKSA-N	0	0	295.810	4.133	20	30		CIEDRN
CCN(C(=O)[C@H]1C[C@]1(C)CC)c1ccc(C#N)c(Cl)c1	ZINC000179526351	335498869	/nfs/dbraw/zinc/49/88/69/335498869.db2.gz	TWOKWDWHTFTGAH-CJNGLKHVSA-N	0	0	290.794	4.001	20	30		CIEDRN
CCc1noc(C)c1CSc1ccc(C#N)c(C)c1	ZINC000578131601	335511647	/nfs/dbraw/zinc/51/16/47/335511647.db2.gz	KAIXUQJLOWHWSC-UHFFFAOYSA-N	0	0	272.373	4.018	20	30		CIEDRN
C=CCN(C(=O)[C@@H]1CC[C@H](C(F)(F)F)C1)c1ccccc1	ZINC000578167327	335540088	/nfs/dbraw/zinc/54/00/88/335540088.db2.gz	LNKIANZVQHGYAV-OLZOCXBDSA-N	0	0	297.320	4.184	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1cc2cc(C)ccc2s1	ZINC000578268678	335594087	/nfs/dbraw/zinc/59/40/87/335594087.db2.gz	VHBBGANQIOVEGU-AWEZNQCLSA-N	0	0	285.412	4.390	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(N2CCCCCC2)cc1C	ZINC000578388293	335625095	/nfs/dbraw/zinc/62/50/95/335625095.db2.gz	WLRNOHMQEIMODQ-UHFFFAOYSA-N	0	0	286.419	4.280	20	30		CIEDRN
C=CCCC1(c2nc(-c3ccc(COCC)cc3)no2)CC1	ZINC000579160818	335717224	/nfs/dbraw/zinc/71/72/24/335717224.db2.gz	QKCZQOICJUAXPD-UHFFFAOYSA-N	0	0	298.386	4.271	20	30		CIEDRN
N#CCC[C@@H](C#N)CNCc1ccc(C2CCCCC2)cc1	ZINC000579187745	335719533	/nfs/dbraw/zinc/71/95/33/335719533.db2.gz	HRRHMXODPBGSKN-KRWDZBQOSA-N	0	0	295.430	4.267	20	30		CIEDRN
CCC[C@](C)(CC)C(=O)Nc1cc(C#N)c2ccccc2n1	ZINC000579401950	335744814	/nfs/dbraw/zinc/74/48/14/335744814.db2.gz	DRGPBTVOBMUKNO-SFHVURJKSA-N	0	0	295.386	4.261	20	30		CIEDRN
C[C@H](NCc1nc(C#N)cs1)c1cccc2ccccc21	ZINC000352836004	335746637	/nfs/dbraw/zinc/74/66/37/335746637.db2.gz	QXUGMWNFAIYYLR-LBPRGKRZSA-N	0	0	293.395	4.019	20	30		CIEDRN
C=CCCCCCN(C)C(=O)CCc1ccc2[nH]ccc2c1	ZINC000180975004	335747130	/nfs/dbraw/zinc/74/71/30/335747130.db2.gz	NJXQUGAIFNDEJY-UHFFFAOYSA-N	0	0	298.430	4.305	20	30		CIEDRN
CC[C@H]1CCCCCN1C(=O)c1ccc(C2(C#N)CC2)cc1	ZINC000181035209	335748386	/nfs/dbraw/zinc/74/83/86/335748386.db2.gz	ABHLFEVGONIYNZ-KRWDZBQOSA-N	0	0	296.414	4.037	20	30		CIEDRN
CC(C)=CCC[C@@H](C)CC(=O)Nc1ccccc1C#N	ZINC000579595527	335817106	/nfs/dbraw/zinc/81/71/06/335817106.db2.gz	ZOSDVAGLUSLVQV-CQSZACIVSA-N	0	0	270.376	4.269	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@H](C)c1ccc(Cl)s1	ZINC000182620984	335831091	/nfs/dbraw/zinc/83/10/91/335831091.db2.gz	OXIDZHDGUCTXJJ-WDEREUQCSA-N	0	0	285.840	4.366	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@@H]1C[C@H]1c1sccc1C	ZINC000182629013	335831976	/nfs/dbraw/zinc/83/19/76/335831976.db2.gz	ZVVBRHFUTQTREC-BFHYXJOUSA-N	0	0	277.433	4.021	20	30		CIEDRN
N#Cc1ccc(CSc2cccc(F)c2C#N)c(F)c1	ZINC000579668859	335846886	/nfs/dbraw/zinc/84/68/86/335846886.db2.gz	IOZZWYNECZDWNG-UHFFFAOYSA-N	0	0	286.306	4.000	20	30		CIEDRN
C=CCCCCCNC(=O)Nc1scnc1C(C)C	ZINC000580784093	335966853	/nfs/dbraw/zinc/96/68/53/335966853.db2.gz	YPWHHFKAARBBMH-UHFFFAOYSA-N	0	0	281.425	4.134	20	30		CIEDRN
CC[C@@H](C)N(C(=O)c1cc(C#N)ccc1Cl)[C@@H](C)CC	ZINC000581035557	335999305	/nfs/dbraw/zinc/99/93/05/335999305.db2.gz	WWRQLFKHADLKKP-TXEJJXNPSA-N	0	0	292.810	4.251	20	30		CIEDRN
Cc1nc(N2CCC[C@H]3CCCC[C@@H]32)c(Cl)cc1C#N	ZINC000380605544	336004502	/nfs/dbraw/zinc/00/45/02/336004502.db2.gz	CVPSXPZDGHGOBF-DOMZBBRYSA-N	0	0	289.810	4.074	20	30		CIEDRN
C=C(C)CSCc1noc(-c2ccc(Cl)cc2)n1	ZINC000195540954	336056007	/nfs/dbraw/zinc/05/60/07/336056007.db2.gz	IZLBKMMSIKCLLC-UHFFFAOYSA-N	0	0	280.780	4.199	20	30		CIEDRN
Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(CC#N)cc1)[C@@H](C)C2	ZINC000581369628	336062807	/nfs/dbraw/zinc/06/28/07/336062807.db2.gz	MHVOAKUKEYMUOZ-MGPUTAFESA-N	0	0	290.410	4.084	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@H]1CC[C@@H](C(F)(F)F)CC1	ZINC000581395808	336067949	/nfs/dbraw/zinc/06/79/49/336067949.db2.gz	YNZMQGXWNKEDLX-UPJWGTAASA-N	0	0	291.357	4.168	20	30		CIEDRN
N#Cc1cc(NCC2CC(F)(F)C2)ccc1C(F)(F)F	ZINC000383300767	336106985	/nfs/dbraw/zinc/10/69/85/336106985.db2.gz	TURYAEGNLAGQEK-UHFFFAOYSA-N	0	0	290.235	4.034	20	30		CIEDRN
C=CC(C)(C)c1nc(-c2ccc3nc(C)sc3c2)no1	ZINC000581590015	336108210	/nfs/dbraw/zinc/10/82/10/336108210.db2.gz	IXBZHBPOZGJBHA-UHFFFAOYSA-N	0	0	285.372	4.118	20	30		CIEDRN
N#Cc1ccc(CN(Cc2ccccc2)C2CC2)c(Cl)c1	ZINC000384422869	336124386	/nfs/dbraw/zinc/12/43/86/336124386.db2.gz	GVJDUOSEQZPHPL-UHFFFAOYSA-N	0	0	296.801	4.376	20	30		CIEDRN
N#Cc1ccc(OCc2ccccc2C(F)(F)F)cc1F	ZINC000384968235	336135376	/nfs/dbraw/zinc/13/53/76/336135376.db2.gz	GNWKLBCPFGSKGG-UHFFFAOYSA-N	0	0	295.235	4.295	20	30		CIEDRN
CCc1ccc(NCc2ccc(C#N)c(OC)c2)cc1C	ZINC000385035636	336136228	/nfs/dbraw/zinc/13/62/28/336136228.db2.gz	DNPCHYPQHKKZKJ-UHFFFAOYSA-N	0	0	280.371	4.050	20	30		CIEDRN
Cc1ccnc(N[C@H](C)c2ccc(C#N)cc2)c1Cl	ZINC000581841575	336150675	/nfs/dbraw/zinc/15/06/75/336150675.db2.gz	PEYWYCAFXCYVNS-LLVKDONJSA-N	0	0	271.751	4.088	20	30		CIEDRN
CCc1c(NCCCC(C)(C)C#N)cnn1-c1ccccc1	ZINC000581877134	336156735	/nfs/dbraw/zinc/15/67/35/336156735.db2.gz	NXTJAGJRQNZMNH-UHFFFAOYSA-N	0	0	296.418	4.177	20	30		CIEDRN
N#Cc1ccc(CNc2cccc3ccsc32)s1	ZINC000386347198	336171527	/nfs/dbraw/zinc/17/15/27/336171527.db2.gz	UBFDSYNLKLYCTM-UHFFFAOYSA-N	0	0	270.382	4.447	20	30		CIEDRN
C[C@H](CC1CCCCC1)C(=O)N[C@H]1CCCc2c[nH]nc21	ZINC000330099536	533773350	/nfs/dbraw/zinc/77/33/50/533773350.db2.gz	DDZLWBIGVYWVNN-DOMZBBRYSA-N	0	0	289.423	4.350	20	30		CIEDRN
C[C@@H]1CCC[C@H](C(=O)N[C@@H]2CCC(=O)N[C@H]2C(C)(C)C)C1	ZINC000329272963	533815639	/nfs/dbraw/zinc/81/56/39/533815639.db2.gz	JUDXGHXSJFIQKA-QVHKTLOISA-N	0	0	294.439	4.303	20	30		CIEDRN
Cc1cc(F)ccc1NC(=O)C[C@H](CC#N)c1ccccc1	ZINC000353562782	533879068	/nfs/dbraw/zinc/87/90/68/533879068.db2.gz	PZPZIUZYTFCQDX-HNNXBMFYSA-N	0	0	296.345	4.160	20	30		CIEDRN
C[C@@H]1CCC[C@H](Nc2snc(Cl)c2C#N)CC1	ZINC000302674231	533880683	/nfs/dbraw/zinc/88/06/83/533880683.db2.gz	PDGXLYJGEAXRDW-BDAKNGLRSA-N	0	0	269.801	4.049	20	30		CIEDRN
Cc1c(N[C@@H]2CCC[C@H](C#N)C2)cccc1-c1ncco1	ZINC000334551723	533924373	/nfs/dbraw/zinc/92/43/73/533924373.db2.gz	UYDPLOINDBKTEB-UONOGXRCSA-N	0	0	281.359	4.144	20	30		CIEDRN
CS[C@@H]1CCC[C@@H](Nc2ncc(Cl)c(C)c2C#N)C1	ZINC000343524446	533951710	/nfs/dbraw/zinc/95/17/10/533951710.db2.gz	HISXIAWSAHJELN-GHMZBOCLSA-N	0	0	295.839	4.001	20	30		CIEDRN
C[C@@H](SCC1(C#N)CC1)c1c(F)cccc1F	ZINC000344485730	533988555	/nfs/dbraw/zinc/98/85/55/533988555.db2.gz	QGXCVGNOSUKDEH-SECBINFHSA-N	0	0	253.317	4.063	20	30		CIEDRN
C[C@H](Nc1cc(C#N)nc2ccccc21)c1ccccc1	ZINC000301374347	534015815	/nfs/dbraw/zinc/01/58/15/534015815.db2.gz	WVFVULTTYNCUHH-ZDUSSCGKSA-N	0	0	273.339	4.280	20	30		CIEDRN
C[C@H](Nc1c(C#N)cccc1C#N)c1cccc(Cl)c1	ZINC000302396721	534015837	/nfs/dbraw/zinc/01/58/37/534015837.db2.gz	CYWTVYYNLDOHOP-NSHDSACASA-N	0	0	281.746	4.256	20	30		CIEDRN
C[C@H](Nc1c(C#N)cccc1C#N)c1ccc(F)c(Cl)c1	ZINC000302848600	534016006	/nfs/dbraw/zinc/01/60/06/534016006.db2.gz	OWEVJJLVUJDRCC-JTQLQIEISA-N	0	0	299.736	4.396	20	30		CIEDRN
C[C@H](Nc1c(C#N)cccc1C#N)c1cc2ccccc2o1	ZINC000302857343	534016605	/nfs/dbraw/zinc/01/66/05/534016605.db2.gz	SJFIQZNCTZXNHN-LBPRGKRZSA-N	0	0	287.322	4.349	20	30		CIEDRN
C[C@H](Nc1cc(Cl)ccc1C#N)c1nc2ccccc2[nH]1	ZINC000301296569	534017633	/nfs/dbraw/zinc/01/76/33/534017633.db2.gz	XVFFNDIVBCTSHP-JTQLQIEISA-N	0	0	296.761	4.261	20	30		CIEDRN
C[C@@H]1NC(=O)CC[C@@H]1NC(=O)[C@@H]1CCC[C@@H]2CCCC[C@H]12	ZINC000329079198	534091666	/nfs/dbraw/zinc/09/16/66/534091666.db2.gz	BXHBYIDWQAKGRJ-LXFSFDBISA-N	0	0	292.423	4.057	20	30		CIEDRN
CSc1cc(C)ccc1CNc1ccc(C#N)cc1	ZINC000301614073	534147552	/nfs/dbraw/zinc/14/75/52/534147552.db2.gz	UHMOMDMHWDKKHT-UHFFFAOYSA-N	0	0	268.385	4.201	20	30		CIEDRN
Cc1ccc(-c2nc(/C=C/c3ccncc3C#N)co2)cc1	ZINC000347457301	534205565	/nfs/dbraw/zinc/20/55/65/534205565.db2.gz	YVPIQVLHCHQEEY-VOTSOKGWSA-N	0	0	287.322	4.087	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N1CCCC12CCCCC2	ZINC000540571985	517324638	/nfs/dbraw/zinc/32/46/38/517324638.db2.gz	NPSMBDTWAOAQTL-HNNXBMFYSA-N	0	0	278.440	4.240	20	30		CIEDRN
CC(C)(C)[C@@H]1CCC[C@@H](NC(=O)C2(C#N)CCCC2)CC1	ZINC000474287154	517390070	/nfs/dbraw/zinc/39/00/70/517390070.db2.gz	FXBXYWJKESFOIC-HUUCEWRRSA-N	0	0	290.451	4.182	20	30		CIEDRN
CCC[C@H](CC)Nc1c(C#N)cnc2ccccc21	ZINC000050405609	517608371	/nfs/dbraw/zinc/60/83/71/517608371.db2.gz	LYKWNIPGDFRXRS-ZDUSSCGKSA-N	0	0	253.349	4.097	20	30		CIEDRN
Cc1noc(C)c1C(C)(C)C(=O)N[C@H]1CC12CCCCC2	ZINC000330268394	534323084	/nfs/dbraw/zinc/32/30/84/534323084.db2.gz	IPPXHMANFNEKOM-ZDUSSCGKSA-N	0	0	290.407	4.248	20	30		CIEDRN
O=C(Nc1cc(C2CC2)[nH]n1)c1ccc(C2CCC2)cc1	ZINC000330133035	534329767	/nfs/dbraw/zinc/32/97/67/534329767.db2.gz	QTVVRUPQVBNBJN-UHFFFAOYSA-N	0	0	281.359	4.191	20	30		CIEDRN
O=C(Nc1csc(-c2ccccn2)n1)[C@H]1[C@@H]2CCCC[C@@H]21	ZINC000329284601	534331258	/nfs/dbraw/zinc/33/12/58/534331258.db2.gz	NXCAGOXQMYLUGK-YABSGUDNSA-N	0	0	299.399	4.229	20	30		CIEDRN
Cc1cc(Cl)cc(C#N)c1Oc1nc(C2CC2)ns1	ZINC000420640434	518187209	/nfs/dbraw/zinc/18/72/09/518187209.db2.gz	MQMUWJUGYQVCOY-UHFFFAOYSA-N	0	0	291.763	4.041	20	30		CIEDRN
N#Cc1ccc(CNc2nc(-c3ccccc3)cs2)cc1	ZINC000301124500	518196468	/nfs/dbraw/zinc/19/64/68/518196468.db2.gz	XMENYWLYRTVRGX-UHFFFAOYSA-N	0	0	291.379	4.294	20	30		CIEDRN
C=C(C)C(=O)Nc1cccc(-c2nc3ccccc3s2)c1	ZINC000059315616	518586152	/nfs/dbraw/zinc/58/61/52/518586152.db2.gz	LIFQWIGQWZGUEX-UHFFFAOYSA-N	0	0	294.379	4.478	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cc(C(=O)CC)ccc1Cl	ZINC000279742540	518630220	/nfs/dbraw/zinc/63/02/20/518630220.db2.gz	TZDJWILLFMNMMW-LLVKDONJSA-N	0	0	293.794	4.474	20	30		CIEDRN
C=CCN(C(=O)c1cccc(C)c1C)c1ccccc1	ZINC000057566211	518738532	/nfs/dbraw/zinc/73/85/32/518738532.db2.gz	LZGQKXUBOVLXPP-UHFFFAOYSA-N	0	0	265.356	4.136	20	30		CIEDRN
C=CCN(C(=O)c1cccc(Cl)c1)c1ccccc1	ZINC000057566324	518739226	/nfs/dbraw/zinc/73/92/26/518739226.db2.gz	VONBWTTUYROSAC-UHFFFAOYSA-N	0	0	271.747	4.173	20	30		CIEDRN
Cc1noc(NC(=O)c2cc3c(s2)CCCCC3)c1C	ZINC000330111138	534428407	/nfs/dbraw/zinc/42/84/07/534428407.db2.gz	QZJSGTZKXCWNLJ-UHFFFAOYSA-N	0	0	290.388	4.258	20	30		CIEDRN
CC(C)CN(CCC#N)C(=O)c1cc(Cl)ccc1Cl	ZINC000048151278	519714821	/nfs/dbraw/zinc/71/48/21/519714821.db2.gz	KUVSGECLKKYGKE-UHFFFAOYSA-N	0	0	299.201	4.005	20	30		CIEDRN
CC(C)c1nnc(CS[C@H](C)c2ccc(C#N)cc2)o1	ZINC000125634528	519888773	/nfs/dbraw/zinc/88/87/73/519888773.db2.gz	MYBGBOUPHQZUEN-LLVKDONJSA-N	0	0	287.388	4.059	20	30		CIEDRN
CCN(C(=O)C1=CCCCCC1)[C@H](C)c1ccc(C#N)cc1	ZINC000129541082	519900257	/nfs/dbraw/zinc/90/02/57/519900257.db2.gz	IBUBAXQLHUMNBF-OAHLLOKOSA-N	0	0	296.414	4.358	20	30		CIEDRN
CC1(CC(=O)N(Cc2ccc(C#N)cc2)C2CC2)CCCC1	ZINC000340941911	520690114	/nfs/dbraw/zinc/69/01/14/520690114.db2.gz	CZXJSXPGMRTHJY-UHFFFAOYSA-N	0	0	296.414	4.020	20	30		CIEDRN
CCC[C@H](NC(=O)Nc1ccc(C#N)cc1)c1ccccc1	ZINC000338313545	521135124	/nfs/dbraw/zinc/13/51/24/521135124.db2.gz	GNNLXMHRRJAKKR-KRWDZBQOSA-N	0	0	293.370	4.221	20	30		CIEDRN
Cc1oc2ccc(NC(=O)[C@H]3CCO[C@@H]3C)cc2c1C	ZINC000330086916	534550277	/nfs/dbraw/zinc/55/02/77/534550277.db2.gz	MSCIGJVAXFAXEQ-YPMHNXCESA-N	0	0	273.332	4.063	20	30		CIEDRN
CCS[C@H]1CCC[C@@H]1Nc1ccc(C#N)c(Cl)c1	ZINC000226127663	521731496	/nfs/dbraw/zinc/73/14/96/521731496.db2.gz	BPKRBGYEWSGLNT-KBPBESRZSA-N	0	0	280.824	4.298	20	30		CIEDRN
Cc1cnc([C@@H](C)Sc2ccc(C#N)c(C)c2)o1	ZINC000335470081	534626047	/nfs/dbraw/zinc/62/60/47/534626047.db2.gz	KVFACLDWKMKXBP-LLVKDONJSA-N	0	0	258.346	4.016	20	30		CIEDRN
Cc1nc2c(cccc2C(=O)N[C@H]2CCC(C)(C)C2)o1	ZINC000329971164	534626292	/nfs/dbraw/zinc/62/62/92/534626292.db2.gz	YGGKELMNIMOEQY-NSHDSACASA-N	0	0	272.348	4.020	20	30		CIEDRN
CCc1noc(C)c1CS[C@H](C)c1cccc(C#N)c1	ZINC000276248731	522853329	/nfs/dbraw/zinc/85/33/29/522853329.db2.gz	VSBFLNUVDPNJPZ-GFCCVEGCSA-N	0	0	286.400	4.412	20	30		CIEDRN
CCc1noc([C@@H](C)S[C@@H](C)c2ccc(C#N)cc2)n1	ZINC000076326693	522910947	/nfs/dbraw/zinc/91/09/47/522910947.db2.gz	REXGGPJRNRLJFE-WDEREUQCSA-N	0	0	287.388	4.059	20	30		CIEDRN
C[C@H]1CCC[C@H](CCn2cc(C#N)c(=O)c3ccccc32)C1	ZINC000338404542	524195530	/nfs/dbraw/zinc/19/55/30/524195530.db2.gz	AMIAXFBBHGRDFW-LSDHHAIUSA-N	0	0	294.398	4.090	20	30		CIEDRN
Cc1cccc(C)c1[C@@H](C)Nc1ccc(C#N)cc1	ZINC000302234287	524323065	/nfs/dbraw/zinc/32/30/65/524323065.db2.gz	UBZUZGKMCZFSHF-CQSZACIVSA-N	0	0	250.345	4.348	20	30		CIEDRN
Cc1cccc(CNc2c(C#N)cnc3ccccc32)c1	ZINC000044342293	524441326	/nfs/dbraw/zinc/44/13/26/524441326.db2.gz	MJMKNQCZPQMBJB-UHFFFAOYSA-N	0	0	273.339	4.027	20	30		CIEDRN
N#Cc1ccc(NC[C@H](c2ccccc2)C(F)(F)F)cc1	ZINC000302439500	534795630	/nfs/dbraw/zinc/79/56/30/534795630.db2.gz	MBMXFSIETPPHOR-OAHLLOKOSA-N	0	0	290.288	4.316	20	30		CIEDRN
C[C@@H](Cc1ccsc1)Nc1cc(Cl)ccc1C#N	ZINC000062785395	524940696	/nfs/dbraw/zinc/94/06/96/524940696.db2.gz	BAMJZXVCSSAUMQ-JTQLQIEISA-N	0	0	276.792	4.316	20	30		CIEDRN
Cc1cc(N(C)C)ccc1N[C@H](C)c1cccc(C#N)c1	ZINC000037274241	525025165	/nfs/dbraw/zinc/02/51/65/525025165.db2.gz	LARQKTIDKXVDAI-CQSZACIVSA-N	0	0	279.387	4.106	20	30		CIEDRN
Cc1ccccc1CNc1ccc(Cl)cc1C#N	ZINC000052857211	525170564	/nfs/dbraw/zinc/17/05/64/525170564.db2.gz	FXDYFVIIHDUBTQ-UHFFFAOYSA-N	0	0	256.736	4.132	20	30		CIEDRN
Cc1ccccc1[C@@H](C)CC(=O)N(C)c1ccc(C#N)cc1	ZINC000269667705	525342763	/nfs/dbraw/zinc/34/27/63/525342763.db2.gz	KXWLQCMYUBWMGQ-HNNXBMFYSA-N	0	0	292.382	4.023	20	30		CIEDRN
C[C@@H](Nc1ccc(C#N)cc1)c1cccc(N2CCCC2)c1	ZINC000154055552	525701051	/nfs/dbraw/zinc/70/10/51/525701051.db2.gz	HGTUWYGAQMOBSM-OAHLLOKOSA-N	0	0	291.398	4.332	20	30		CIEDRN
C[C@@H](Nc1ccc([C@@H]2CCOC2)cc1)c1cccc(C#N)c1	ZINC000294991440	525709682	/nfs/dbraw/zinc/70/96/82/525709682.db2.gz	LIPWZZCXZXLBAL-RDTXWAMCSA-N	0	0	292.382	4.235	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N1CC=C(C(C)(C)C)CC1	ZINC000270606086	525999561	/nfs/dbraw/zinc/99/95/61/525999561.db2.gz	DMDLTLKHDODEIE-UHFFFAOYSA-N	0	0	297.402	4.077	20	30		CIEDRN
C[C@@H](Sc1nnc(C(C)(C)C)o1)c1ccc(C#N)cc1	ZINC000118175890	526010191	/nfs/dbraw/zinc/01/01/91/526010191.db2.gz	MWZUUKDLXJPKLD-SNVBAGLBSA-N	0	0	287.388	4.092	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)c1ccccc1Cl	ZINC000344354441	526375188	/nfs/dbraw/zinc/37/51/88/526375188.db2.gz	PNHWWSXZBZYSJD-UHFFFAOYSA-N	0	0	291.803	4.230	20	30		CIEDRN
C=CCN(Cc1cccs1)Cc1ncc(Cl)s1	ZINC000352001694	526376879	/nfs/dbraw/zinc/37/68/79/526376879.db2.gz	HQXYNMVDPJVMSE-UHFFFAOYSA-N	0	0	284.837	4.046	20	30		CIEDRN
Cc1csc(NC(=O)CCCSC(C)(C)C)c1C#N	ZINC000288890931	526382090	/nfs/dbraw/zinc/38/20/90/526382090.db2.gz	SGCLUMUVYWTYTH-UHFFFAOYSA-N	0	0	296.461	4.179	20	30		CIEDRN
C=CCN(Cc1ncc(CSC)s1)c1ccccc1	ZINC000353141365	526382943	/nfs/dbraw/zinc/38/29/43/526382943.db2.gz	QMMRYXHXSIVSQK-UHFFFAOYSA-N	0	0	290.457	4.199	20	30		CIEDRN
N#Cc1cc(NCc2ccsc2)ccc1C(F)(F)F	ZINC000163999779	526572018	/nfs/dbraw/zinc/57/20/18/526572018.db2.gz	ROOJHISONFYHIF-UHFFFAOYSA-N	0	0	282.290	4.251	20	30		CIEDRN
N#Cc1cc(NCc2coc3ccccc23)ccc1F	ZINC000161099813	526572748	/nfs/dbraw/zinc/57/27/48/526572748.db2.gz	OXSDZEYPMGZCTB-UHFFFAOYSA-N	0	0	266.275	4.056	20	30		CIEDRN
Cc1noc(C)c1[C@H](C)CNc1cc(Cl)ccc1C#N	ZINC000129529604	526576191	/nfs/dbraw/zinc/57/61/91/526576191.db2.gz	XCOXUSZNLVPLOK-SECBINFHSA-N	0	0	289.766	4.032	20	30		CIEDRN
N#Cc1ccc(/C=C/c2nc([C@@H]3CCCCS3)no2)cc1	ZINC000273890737	526586253	/nfs/dbraw/zinc/58/62/53/526586253.db2.gz	FDWKMRIYFSGVCC-VFNNOXKTSA-N	0	0	297.383	4.070	20	30		CIEDRN
N#Cc1ccc(CN[C@H]2CCCc3sc(Cl)cc32)o1	ZINC000291719998	526626261	/nfs/dbraw/zinc/62/62/61/526626261.db2.gz	MLFCKIDCLJMALM-LBPRGKRZSA-N	0	0	292.791	4.033	20	30		CIEDRN
N#Cc1ccc(N2Cc3ccccc3-c3ccccc3C2)nc1	ZINC000301179490	526646215	/nfs/dbraw/zinc/64/62/15/526646215.db2.gz	MNLMUMTXIXIJHH-UHFFFAOYSA-N	0	0	297.361	4.140	20	30		CIEDRN
N#Cc1ccc(NC(=O)C2CCCCCC2)c(Cl)c1	ZINC000226348444	526648863	/nfs/dbraw/zinc/64/88/63/526648863.db2.gz	OIEDGQVDHXGTRO-UHFFFAOYSA-N	0	0	276.767	4.121	20	30		CIEDRN
N#Cc1ccc(N[C@H](c2ccc(Cl)cc2)C2CC2)nc1	ZINC000042847981	526666367	/nfs/dbraw/zinc/66/63/67/526666367.db2.gz	UKVPFASFBKTCTQ-INIZCTEOSA-N	0	0	283.762	4.170	20	30		CIEDRN
N#Cc1ccc(OCc2c(F)cccc2Cl)c(F)c1	ZINC000062670966	526677760	/nfs/dbraw/zinc/67/77/60/526677760.db2.gz	KXEBWRGQSKNUGC-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
N#Cc1ccc(Oc2ccnc(C3CC3)n2)c2ccccc12	ZINC000338826518	526680055	/nfs/dbraw/zinc/68/00/55/526680055.db2.gz	BZSVQKKXLJDFMD-UHFFFAOYSA-N	0	0	287.322	4.171	20	30		CIEDRN
CC(C)(C)[C@@H]1NC(=O)CC[C@H]1NC(=O)CC(C)(C)C1CC1	ZINC000329191671	526681435	/nfs/dbraw/zinc/68/14/35/526681435.db2.gz	RNOVTIMOLLVGHJ-IUODEOHRSA-N	0	0	294.439	4.303	20	30		CIEDRN
N#Cc1cccc(C#N)c1Sc1ccccc1Cl	ZINC000302424836	526695845	/nfs/dbraw/zinc/69/58/45/526695845.db2.gz	JUEQZVAREVXNFM-UHFFFAOYSA-N	0	0	270.744	4.235	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](C)C[C@H]1c1ccco1	ZINC000185735044	526708923	/nfs/dbraw/zinc/70/89/23/526708923.db2.gz	ICHANKHHNKYLLN-KKUMJFAQSA-N	0	0	275.392	4.182	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000352166333	526712447	/nfs/dbraw/zinc/71/24/47/526712447.db2.gz	MZENTVDDWLBRDD-DOTOQJQBSA-N	0	0	284.403	4.140	20	30		CIEDRN
Cc1nsc(Sc2nc(-c3ccccc3)co2)c1C#N	ZINC000340877228	526717919	/nfs/dbraw/zinc/71/79/19/526717919.db2.gz	RZVMIGKQZWGPMD-UHFFFAOYSA-N	0	0	299.380	4.129	20	30		CIEDRN
N#Cc1ccccc1CN(Cc1c(F)cccc1F)C1CC1	ZINC000339423669	526734920	/nfs/dbraw/zinc/73/49/20/526734920.db2.gz	MCXXYSZOPQNCAL-UHFFFAOYSA-N	0	0	298.336	4.001	20	30		CIEDRN
N#Cc1ccccc1NC(=O)c1ccc(-c2cccs2)o1	ZINC000341107182	526743294	/nfs/dbraw/zinc/74/32/94/526743294.db2.gz	YNJJTABVZMTWEC-UHFFFAOYSA-N	0	0	294.335	4.132	20	30		CIEDRN
N#Cc1cccnc1N[C@@H](c1cccnc1)C1CCCCC1	ZINC000363385135	526754359	/nfs/dbraw/zinc/75/43/59/526754359.db2.gz	UTDWOZHHBXHTJL-QGZVFWFLSA-N	0	0	292.386	4.082	20	30		CIEDRN
N#Cc1cccnc1N[C@H](c1cccnc1)C1CCCCC1	ZINC000363385134	526754808	/nfs/dbraw/zinc/75/48/08/526754808.db2.gz	UTDWOZHHBXHTJL-KRWDZBQOSA-N	0	0	292.386	4.082	20	30		CIEDRN
N#Cc1cnc2ccccc2c1NCc1ccccc1Cl	ZINC000037413167	526777048	/nfs/dbraw/zinc/77/70/48/526777048.db2.gz	QATRPZUBAHYTIK-UHFFFAOYSA-N	0	0	293.757	4.372	20	30		CIEDRN
Cc1nc(CS[C@H](C)c2ccc(C#N)cc2)cs1	ZINC000118444348	526915153	/nfs/dbraw/zinc/91/51/53/526915153.db2.gz	GSQZOZFFTMGMNE-SNVBAGLBSA-N	0	0	274.414	4.318	20	30		CIEDRN
C=CC(C)(C)C(=O)N1CCC(c2c[nH]c3ccccc32)CC1	ZINC000334667960	526942499	/nfs/dbraw/zinc/94/24/99/526942499.db2.gz	ZECUKROWZSEZCM-UHFFFAOYSA-N	0	0	296.414	4.086	20	30		CIEDRN
CC(C)(CC(=O)N1CCC(C)(C#N)CC1)C1CCCCC1	ZINC000334859172	526961976	/nfs/dbraw/zinc/96/19/76/526961976.db2.gz	FHFAJEQGSKHOHN-UHFFFAOYSA-N	0	0	290.451	4.135	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)c1ccc(OC(C)C)cc1	ZINC000191602879	527021515	/nfs/dbraw/zinc/02/15/15/527021515.db2.gz	QHSWCUBUPTYNHP-UHFFFAOYSA-N	0	0	287.403	4.205	20	30		CIEDRN
C=CCC1(C(=O)N(C)Cc2ccc(F)c(Cl)c2)CCC1	ZINC000347214856	527039517	/nfs/dbraw/zinc/03/95/17/527039517.db2.gz	QOQZBTHFARRFJK-UHFFFAOYSA-N	0	0	295.785	4.184	20	30		CIEDRN
C=CCCC1(C(=O)NC[C@]2(C)C[C@@H]2c2ccccc2)CC1	ZINC000355002884	527091063	/nfs/dbraw/zinc/09/10/63/527091063.db2.gz	RSSODOQDCGHRTA-AEFFLSMTSA-N	0	0	283.415	4.043	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1cc(C)n(C2CC2)c1C	ZINC000352274146	527127769	/nfs/dbraw/zinc/12/77/69/527127769.db2.gz	DAGZHKGLTGRQIK-UHFFFAOYSA-N	0	0	288.435	4.258	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(NCCc2c(C)cccc2C)c1	ZINC000302104133	527225037	/nfs/dbraw/zinc/22/50/37/527225037.db2.gz	MPUAMXOIDYAQRN-UHFFFAOYSA-N	0	0	292.382	4.032	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(NCc2ccc(Cl)cc2)c1	ZINC000302049920	527226461	/nfs/dbraw/zinc/22/64/61/527226461.db2.gz	WTBCRTLSYFJECZ-UHFFFAOYSA-N	0	0	284.746	4.026	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(N[C@@H]2CSc3ccccc32)c1	ZINC000347424560	527227954	/nfs/dbraw/zinc/22/79/54/527227954.db2.gz	UCXUHAZGNDMWOU-MRXNPFEDSA-N	0	0	294.379	4.020	20	30		CIEDRN
C=CCCCNC(=O)c1sc2ccc(F)cc2c1C	ZINC000344478451	527232412	/nfs/dbraw/zinc/23/24/12/527232412.db2.gz	DASGBBALMWQBDS-UHFFFAOYSA-N	0	0	277.364	4.045	20	30		CIEDRN
C=CCCCSCc1csc([C@@H](C)OCC)n1	ZINC000346976167	527247458	/nfs/dbraw/zinc/24/74/58/527247458.db2.gz	YYFUHDXFMLAZCC-LLVKDONJSA-N	0	0	271.451	4.440	20	30		CIEDRN
C=CCCN(C)C(=O)c1ccc2c(c1)oc1ccccc12	ZINC000355032900	527316985	/nfs/dbraw/zinc/31/69/85/527316985.db2.gz	PUFNNPMFWSNXSG-UHFFFAOYSA-N	0	0	279.339	4.234	20	30		CIEDRN
C=CCCO[C@@H](C)c1nc(-c2ccccc2Cl)no1	ZINC000113733610	527387300	/nfs/dbraw/zinc/38/73/00/527387300.db2.gz	AALYJMKFVUVGAE-JTQLQIEISA-N	0	0	278.739	4.044	20	30		CIEDRN
C=CCC[C@H](NCc1csc(CC)n1)c1ccco1	ZINC000356084448	527485730	/nfs/dbraw/zinc/48/57/30/527485730.db2.gz	CKIFHJCGCPEALE-ZDUSSCGKSA-N	0	0	276.405	4.096	20	30		CIEDRN
Cc1ncsc1CS[C@H](C)c1ccc(C#N)cc1	ZINC000290801296	527515110	/nfs/dbraw/zinc/51/51/10/527515110.db2.gz	PSOMNIPCWSYSFX-LLVKDONJSA-N	0	0	274.414	4.318	20	30		CIEDRN
C=C[C@@](C)(CCOC)C(=O)Nc1ccc(C2CC2)c(C)c1	ZINC000353517178	527533938	/nfs/dbraw/zinc/53/39/38/527533938.db2.gz	UEEMIUMQLCHLLG-SFHVURJKSA-N	0	0	287.403	4.040	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1ccc(C2=CCCC2)cc1	ZINC000356046619	527602649	/nfs/dbraw/zinc/60/26/49/527602649.db2.gz	BGMQTOSLKDVMAJ-SFHVURJKSA-N	0	0	281.399	4.435	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cnn([C@H](C)CC)c1C1CC1	ZINC000353447336	527614784	/nfs/dbraw/zinc/61/47/84/527614784.db2.gz	JTSWMXSLSYKJKP-SJKOYZFVSA-N	0	0	289.423	4.272	20	30		CIEDRN
CC(C)(C)CN(CCC#N)Cc1ccc2occc2c1	ZINC000347794670	527680903	/nfs/dbraw/zinc/68/09/03/527680903.db2.gz	ZGUXIWFDSIJACT-UHFFFAOYSA-N	0	0	270.376	4.195	20	30		CIEDRN
CC1(C)C[C@]1(C#N)NC(=O)[C@@H]1CC[C@@H]2CCCC[C@H]2C1	ZINC000330165942	527768681	/nfs/dbraw/zinc/76/86/81/527768681.db2.gz	XMPVWOJNMGNDSD-SZOQZIPDSA-N	0	0	274.408	4.242	20	30		CIEDRN
CC(C)c1ccc([C@H](Nc2cnc(C#N)cn2)C(C)C)cc1	ZINC000302252317	528145904	/nfs/dbraw/zinc/14/59/04/528145904.db2.gz	XGEOZKXVKIBZNI-GOSISDBHSA-N	0	0	294.402	4.281	20	30		CIEDRN
CC1CCC(N(C(=O)Nc2ccc(C#N)cc2)C2CC2)CC1	ZINC000343574861	528185753	/nfs/dbraw/zinc/18/57/53/528185753.db2.gz	POSMYGIIECGEAZ-UHFFFAOYSA-N	0	0	297.402	4.133	20	30		CIEDRN
CC(C)Sc1ccc([C@H](C)Nc2ccc(C#N)nn2)cc1	ZINC000301964569	528328873	/nfs/dbraw/zinc/32/88/73/528328873.db2.gz	JOXZBDKZGUAEKM-LBPRGKRZSA-N	0	0	298.415	4.022	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)c1ccc(C)cc1Cl	ZINC000191716096	528541160	/nfs/dbraw/zinc/54/11/60/528541160.db2.gz	KACBFAMOUKQSGH-UHFFFAOYSA-N	0	0	292.810	4.193	20	30		CIEDRN
CCCc1ccccc1NC(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000461901865	528646557	/nfs/dbraw/zinc/64/65/57/528646557.db2.gz	OWSJLSFHWOMLTL-AWEZNQCLSA-N	0	0	292.382	4.253	20	30		CIEDRN
CCC(CC)CN(CCC#N)C(=O)c1cccc(C)c1C	ZINC000353840093	528748647	/nfs/dbraw/zinc/74/86/47/528748647.db2.gz	ZSMYVSYUTPWLPX-UHFFFAOYSA-N	0	0	286.419	4.096	20	30		CIEDRN
CCCc1occc1C(=O)Nc1sc(C)c(C)c1C#N	ZINC000344269522	528805089	/nfs/dbraw/zinc/80/50/89/528805089.db2.gz	RMZUQBWAXMLBKN-UHFFFAOYSA-N	0	0	288.372	4.034	20	30		CIEDRN
CC1(C#N)CCC(Nc2ccccc2N2CCCC2)CC1	ZINC000336227377	528835338	/nfs/dbraw/zinc/83/53/38/528835338.db2.gz	QLHVXAQRUKXRND-UHFFFAOYSA-N	0	0	283.419	4.171	20	30		CIEDRN
CC1(C)CC(CC(=O)N[C@H](CCCC#N)c2ccccc2)C1	ZINC000352205574	528884451	/nfs/dbraw/zinc/88/44/51/528884451.db2.gz	GXGSCCQEFRCJOS-QGZVFWFLSA-N	0	0	298.430	4.364	20	30		CIEDRN
CC(C)[C@H](C)N(C(=O)C[C@H](CC#N)c1ccccc1)C1CC1	ZINC000355105996	528951737	/nfs/dbraw/zinc/95/17/37/528951737.db2.gz	IBUCYXAUGXQYBX-RDJZCZTQSA-N	0	0	298.430	4.109	20	30		CIEDRN
CCC1(NC(=O)CCc2nc3ccccc3o2)CCC1	ZINC000330013708	528981049	/nfs/dbraw/zinc/98/10/49/528981049.db2.gz	AENXVBIICUMWJH-UHFFFAOYSA-N	0	0	272.348	4.050	20	30		CIEDRN
CC1(C)CC[C@H](C(=O)N[C@H](CCCC#N)c2ccccc2)C1	ZINC000352218728	529036843	/nfs/dbraw/zinc/03/68/43/529036843.db2.gz	NPBCBWXYBUUQPK-DLBZAZTESA-N	0	0	298.430	4.364	20	30		CIEDRN
CCCCc1nc(CSCC2(C#N)CC2)cs1	ZINC000344486720	529043742	/nfs/dbraw/zinc/04/37/42/529043742.db2.gz	SIHBPJWDCAPBDN-UHFFFAOYSA-N	0	0	266.435	4.023	20	30		CIEDRN
CC(C)[C@H](Nc1ncccc1C#N)c1ccc(F)cc1F	ZINC000301656812	529127426	/nfs/dbraw/zinc/12/74/26/529127426.db2.gz	VNIBJBYACDKVFM-HNNXBMFYSA-N	0	0	287.313	4.041	20	30		CIEDRN
CC[C@H](Sc1nc(C)nc(C)c1C#N)c1ccccc1	ZINC000352855494	529178508	/nfs/dbraw/zinc/17/85/08/529178508.db2.gz	OTXFDNWDHCPETB-HNNXBMFYSA-N	0	0	283.400	4.209	20	30		CIEDRN
CC[C@H](C)[C@H](C)C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000352225962	529235919	/nfs/dbraw/zinc/23/59/19/529235919.db2.gz	QFAGLBHFVSBVFC-YQQAZPJKSA-N	0	0	286.419	4.220	20	30		CIEDRN
CC[C@@H](C)CCC(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000352206854	529310108	/nfs/dbraw/zinc/31/01/08/529310108.db2.gz	PPOBEOLRJZPBAG-WBVHZDCISA-N	0	0	286.419	4.364	20	30		CIEDRN
CC[C@H]1C[C@@H](C)CN1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000336045273	529315763	/nfs/dbraw/zinc/31/57/63/529315763.db2.gz	ZBGVPIDBYORGFZ-CJNGLKHVSA-N	0	0	299.418	4.140	20	30		CIEDRN
CC[C@]1(C)C[C@@H]1C(=O)Nc1c(C)[nH]nc1-c1ccccc1	ZINC000330172856	529411192	/nfs/dbraw/zinc/41/11/92/529411192.db2.gz	GUPFOMRZJYYLTC-CXAGYDPISA-N	0	0	283.375	4.409	20	30		CIEDRN
CCc1ccccc1-c1noc(C2(C#N)CCCCC2)n1	ZINC000331642088	529558984	/nfs/dbraw/zinc/55/89/84/529558984.db2.gz	JVGXCMKZCQJBMX-UHFFFAOYSA-N	0	0	281.359	4.024	20	30		CIEDRN
CC[C@H](C)CCC(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000352206851	529646710	/nfs/dbraw/zinc/64/67/10/529646710.db2.gz	PPOBEOLRJZPBAG-DOTOQJQBSA-N	0	0	286.419	4.364	20	30		CIEDRN
CCc1cnc(NC(=O)c2cc(C(C)C)oc2C)s1	ZINC000330610625	529656547	/nfs/dbraw/zinc/65/65/47/529656547.db2.gz	NPOMLAVKPUUIGY-UHFFFAOYSA-N	0	0	278.377	4.367	20	30		CIEDRN
CC[C@H](Nc1cc(C2CC2)ccn1)c1ccc(C#N)cc1	ZINC000353550632	529674683	/nfs/dbraw/zinc/67/46/83/529674683.db2.gz	RPTKZNPMKFWBGL-KRWDZBQOSA-N	0	0	277.371	4.394	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H](C)Oc2ccccc2)n1	ZINC000573510801	334943758	/nfs/dbraw/zinc/94/37/58/334943758.db2.gz	XVEGBWSMJUVMPW-LBPRGKRZSA-N	0	0	272.348	4.063	20	30		CIEDRN
Cc1nc2c(cccc2OCCC2(C#N)CCCCC2)o1	ZINC000573823231	334969550	/nfs/dbraw/zinc/96/95/50/334969550.db2.gz	JBDFGHKCRONXGL-UHFFFAOYSA-N	0	0	284.359	4.379	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2ccc3ncccc3c2)no1	ZINC000573841168	334970732	/nfs/dbraw/zinc/97/07/32/334970732.db2.gz	BHHTWBQXTSRWDV-GFCCVEGCSA-N	0	0	279.343	4.355	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)CCCc1cc(C)sc1C	ZINC000410123792	260462627	/nfs/dbraw/zinc/46/26/27/260462627.db2.gz	QPFOTDVBAOXJGK-HNNXBMFYSA-N	0	0	279.449	4.159	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)[C@H]1C[C@@]1(C)CC	ZINC000410343163	260487466	/nfs/dbraw/zinc/48/74/66/260487466.db2.gz	DIIJWPMSTFPBHV-RHSMWYFYSA-N	0	0	257.377	4.180	20	30		CIEDRN
N#Cc1ccc(Nc2ccc(CCC(F)(F)F)cc2)nc1	ZINC000301535421	541326178	/nfs/dbraw/zinc/32/61/78/541326178.db2.gz	AEOURGNZGRIQOC-UHFFFAOYSA-N	0	0	291.276	4.192	20	30		CIEDRN
C=CCCSCC(=O)Nc1c(C)cccc1C(C)C	ZINC000151989409	260625415	/nfs/dbraw/zinc/62/54/15/260625415.db2.gz	KDAVEEJWKRBZEC-UHFFFAOYSA-N	0	0	277.433	4.366	20	30		CIEDRN
CCc1ccc([C@H]2C[C@@H](C)CCN2c2cc(C#N)ccn2)o1	ZINC000574474855	335022745	/nfs/dbraw/zinc/02/27/45/335022745.db2.gz	ZNFACAJUUVADAC-XJKSGUPXSA-N	0	0	295.386	4.086	20	30		CIEDRN
CCc1ccc([C@H]2C[C@H](C)CCN2c2cc(C#N)ccn2)o1	ZINC000574474853	335022746	/nfs/dbraw/zinc/02/27/46/335022746.db2.gz	ZNFACAJUUVADAC-CZUORRHYSA-N	0	0	295.386	4.086	20	30		CIEDRN
CC1(C#N)CCC(Nc2cncc3ccccc32)CC1	ZINC000574517585	335025882	/nfs/dbraw/zinc/02/58/82/335025882.db2.gz	SPNJULAWJDHOBC-UHFFFAOYSA-N	0	0	265.360	4.119	20	30		CIEDRN
C=CCC(C)(C)c1noc(Cc2c[nH]c3cc(F)ccc23)n1	ZINC000574552865	335029041	/nfs/dbraw/zinc/02/90/41/335029041.db2.gz	OWPFCYTTWIHWAB-UHFFFAOYSA-N	0	0	299.349	4.135	20	30		CIEDRN
C=C(C)CCc1noc([C@H](C)Oc2ccc(Cl)cc2)n1	ZINC000574724177	335042561	/nfs/dbraw/zinc/04/25/61/335042561.db2.gz	GDGDEROANKYDCS-NSHDSACASA-N	0	0	292.766	4.372	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(C#N)cc2OC)CCCCC1	ZINC000574737016	335043341	/nfs/dbraw/zinc/04/33/41/335043341.db2.gz	LJSAJLCNVBFYNW-UHFFFAOYSA-N	0	0	298.386	4.032	20	30		CIEDRN
CSc1ccc(Cl)cc1N[C@@H]1CC[C@@H](C#N)C1	ZINC000442868533	532967999	/nfs/dbraw/zinc/96/79/99/532967999.db2.gz	NYOIRPWXOUSFRT-MWLCHTKSSA-N	0	0	266.797	4.166	20	30		CIEDRN
C=CCCCCNc1ccc2c(c1)CN(CC(F)(F)F)C2	ZINC000574845245	335051775	/nfs/dbraw/zinc/05/17/75/335051775.db2.gz	MOROMCBLFNPWMK-UHFFFAOYSA-N	0	0	298.352	4.333	20	30		CIEDRN
CCCCCCCC(=O)N1CCC[C@H]1c1csc(C)n1	ZINC000187016783	262120593	/nfs/dbraw/zinc/12/05/93/262120593.db2.gz	TVOKYJBZYHJABX-HNNXBMFYSA-N	0	0	294.464	4.476	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N(C)[C@H](C)c1ccc(Cl)cc1	ZINC000116973657	260019928	/nfs/dbraw/zinc/01/99/28/260019928.db2.gz	OBMPJBUHTNRDLT-VXGBXAGGSA-N	0	0	280.799	4.007	20	30		CIEDRN
CC(C)(C#N)CCCSC[C@@H]1Cc2ccccc2O1	ZINC000365070731	262276849	/nfs/dbraw/zinc/27/68/49/262276849.db2.gz	ZXJOOPWXXSDUHN-AWEZNQCLSA-N	0	0	275.417	4.053	20	30		CIEDRN
CC(C)CC(C)(C)C(=O)N[C@@H](C#N)c1ccccc1Cl	ZINC000179553123	260054791	/nfs/dbraw/zinc/05/47/91/260054791.db2.gz	QSBDZDGLIVZRET-AWEZNQCLSA-N	0	0	292.810	4.093	20	30		CIEDRN
C[C@H](Nc1ccc(C#N)cc1C(F)(F)F)c1ccccn1	ZINC000036973640	260061179	/nfs/dbraw/zinc/06/11/79/260061179.db2.gz	VRHOEVHZHBCICC-JTQLQIEISA-N	0	0	291.276	4.145	20	30		CIEDRN
C=CCC(C)(C)c1noc(C(F)=C2CCCC2)n1	ZINC000575077941	335062762	/nfs/dbraw/zinc/06/27/62/335062762.db2.gz	WUHWTKNJLJPVMC-UHFFFAOYSA-N	0	0	250.317	4.178	20	30		CIEDRN
N#Cc1c(F)cccc1N[C@H](c1ccccc1)[C@H]1CCCO1	ZINC000171372915	335063486	/nfs/dbraw/zinc/06/34/86/335063486.db2.gz	HJVYSTBIDAVUNY-QZTJIDSGSA-N	0	0	296.345	4.030	20	30		CIEDRN
C[C@@H](CC#N)N(C)Cc1cccc(Oc2ccccc2)c1	ZINC000353415873	533395292	/nfs/dbraw/zinc/39/52/92/533395292.db2.gz	KHCPTPSIAZKMTK-HNNXBMFYSA-N	0	0	280.371	4.213	20	30		CIEDRN
C[C@@H](Nc1c(C#N)cccc1C#N)c1ccccc1Cl	ZINC000302417135	533550350	/nfs/dbraw/zinc/55/03/50/533550350.db2.gz	HZLQRZCAVAVBAW-LLVKDONJSA-N	0	0	281.746	4.256	20	30		CIEDRN
C[C@@H](Nc1ccc(C#N)c(Cl)c1)[C@H]1COc2ccccc21	ZINC000301813286	533552590	/nfs/dbraw/zinc/55/25/90/533552590.db2.gz	CEFIWGHKBJRQJN-IAQYHMDHSA-N	0	0	298.773	4.188	20	30		CIEDRN
CC1CCC(OC2CCN(c3ccc(C#N)cc3)CC2)CC1	ZINC000341926327	130156623	/nfs/dbraw/zinc/15/66/23/130156623.db2.gz	AOCHAEXZMJRZJK-UHFFFAOYSA-N	0	0	298.430	4.122	20	30		CIEDRN
N#Cc1cc(Cl)ccc1CSCCOC1CCC1	ZINC000342051691	130222997	/nfs/dbraw/zinc/22/29/97/130222997.db2.gz	ABDKKLBGGCCQSB-UHFFFAOYSA-N	0	0	281.808	4.014	20	30		CIEDRN
Cc1cccc(C2(C(=O)NCCCCC#N)CCCCC2)c1	ZINC000171501538	335067637	/nfs/dbraw/zinc/06/76/37/335067637.db2.gz	WRVCKKOJLHAVPA-UHFFFAOYSA-N	0	0	298.430	4.007	20	30		CIEDRN
C[C@H](C#N)Sc1nnc(-c2ccccc2)c2ccccc21	ZINC000005339995	170087787	/nfs/dbraw/zinc/08/77/87/170087787.db2.gz	MABLNOYQNVOHNT-GFCCVEGCSA-N	0	0	291.379	4.301	20	30		CIEDRN
COc1ccc2c(c1)CC/C(=C/C=C\c1ccccc1)C2=O	ZINC000005908900	170153638	/nfs/dbraw/zinc/15/36/38/170153638.db2.gz	MLILABITTOVKMW-VDNNZNEESA-N	0	0	290.362	4.464	20	30		CIEDRN
CCc1c(C)sc(NC(=O)c2ccc(C)cc2)c1C#N	ZINC000006122895	170177619	/nfs/dbraw/zinc/17/76/19/170177619.db2.gz	VUXMDNKLXWDYEL-UHFFFAOYSA-N	0	0	284.384	4.051	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1ccccc1C(C)(C)C	ZINC000006779360	170242933	/nfs/dbraw/zinc/24/29/33/170242933.db2.gz	PADGLZWPLRIENG-UHFFFAOYSA-N	0	0	274.408	4.414	20	30		CIEDRN
N#Cc1cccc(COc2ccc(Cl)c3cccnc23)c1	ZINC000007441474	170285375	/nfs/dbraw/zinc/28/53/75/170285375.db2.gz	MFVFBHHUAZXTER-UHFFFAOYSA-N	0	0	294.741	4.339	20	30		CIEDRN
N#Cc1cccnc1Oc1cc(Cl)ccc1Cl	ZINC000019804611	170873853	/nfs/dbraw/zinc/87/38/53/170873853.db2.gz	GSXDLVARHBSIGN-UHFFFAOYSA-N	0	0	265.099	4.052	20	30		CIEDRN
N#Cc1cccc(C(=O)Nc2ccc(Cl)c(Cl)c2)c1	ZINC000019804357	170873969	/nfs/dbraw/zinc/87/39/69/170873969.db2.gz	QJDKXUAOEFGLMK-UHFFFAOYSA-N	0	0	291.137	4.117	20	30		CIEDRN
C[C@@H](Nc1ccc(C#N)cc1)c1c(F)cccc1F	ZINC000019951048	170939255	/nfs/dbraw/zinc/93/92/55/170939255.db2.gz	WPSHLQGLUZGKRS-SNVBAGLBSA-N	0	0	258.271	4.010	20	30		CIEDRN
C[C@H](NCc1nc2ccccc2s1)c1ccc(C#N)cc1	ZINC000020136114	171024097	/nfs/dbraw/zinc/02/40/97/171024097.db2.gz	KJGAJYLMDZCRMY-LBPRGKRZSA-N	0	0	293.395	4.019	20	30		CIEDRN
Cc1cc(C)c(C)c(OCc2ccc(C#N)cc2F)c1	ZINC000020362273	171160743	/nfs/dbraw/zinc/16/07/43/171160743.db2.gz	VLXZCEHHRRLJFZ-UHFFFAOYSA-N	0	0	269.319	4.202	20	30		CIEDRN
Cc1cc(Cl)ccc1OCc1cccc(C#N)c1	ZINC000021056450	171296038	/nfs/dbraw/zinc/29/60/38/171296038.db2.gz	IPGOMKFZCVQPRC-UHFFFAOYSA-N	0	0	257.720	4.099	20	30		CIEDRN
N#Cc1ccccc1COc1ccccc1C(F)(F)F	ZINC000021511337	171310381	/nfs/dbraw/zinc/31/03/81/171310381.db2.gz	WQPDDHUBXLEQTO-UHFFFAOYSA-N	0	0	277.245	4.156	20	30		CIEDRN
C[C@H](NCc1cc(C#N)ccc1F)c1ccccc1Cl	ZINC000022515457	171389712	/nfs/dbraw/zinc/38/97/12/171389712.db2.gz	OVZIBJMVLKOUPJ-NSHDSACASA-N	0	0	288.753	4.202	20	30		CIEDRN
Cc1ccc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)c(C)c1	ZINC000025438312	171458101	/nfs/dbraw/zinc/45/81/01/171458101.db2.gz	IVVKYIPQQDCOGW-UHFFFAOYSA-N	0	0	292.382	4.357	20	30		CIEDRN
Cc1cc2c(ncnc2SCc2ccccc2C#N)s1	ZINC000031944812	171666527	/nfs/dbraw/zinc/66/65/27/171666527.db2.gz	PXXULKWSKBZPMN-UHFFFAOYSA-N	0	0	297.408	4.164	20	30		CIEDRN
N#Cc1ccccc1OCCSc1ccc(Cl)cc1	ZINC000034651696	171847085	/nfs/dbraw/zinc/84/70/85/171847085.db2.gz	OFUZIPRRVDTBCL-UHFFFAOYSA-N	0	0	289.787	4.383	20	30		CIEDRN
N#Cc1cccc(CSc2cc(F)ccc2F)c1	ZINC000035121676	171991009	/nfs/dbraw/zinc/99/10/09/171991009.db2.gz	BWKZNUNIBPYZPE-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
CSc1cccc(N[C@H](C)c2cccc(C#N)c2)c1	ZINC000037188407	173017931	/nfs/dbraw/zinc/01/79/31/173017931.db2.gz	HBJXAACKHPTWFR-GFCCVEGCSA-N	0	0	268.385	4.453	20	30		CIEDRN
CSc1cccc(N[C@@H](C)c2cccc(C#N)c2)c1	ZINC000037188406	173018141	/nfs/dbraw/zinc/01/81/41/173018141.db2.gz	HBJXAACKHPTWFR-LBPRGKRZSA-N	0	0	268.385	4.453	20	30		CIEDRN
N#Cc1ccc(NCc2ccc(Cl)cc2)cc1Cl	ZINC000037389966	173172993	/nfs/dbraw/zinc/17/29/93/173172993.db2.gz	OCPFDDLCNPGUKA-UHFFFAOYSA-N	0	0	277.154	4.477	20	30		CIEDRN
N#CC1(C(=O)Nc2ccc(Cl)c(Cl)c2)CCCCC1	ZINC000044385091	175169757	/nfs/dbraw/zinc/16/97/57/175169757.db2.gz	KHOWYPLLCMDAFT-UHFFFAOYSA-N	0	0	297.185	4.406	20	30		CIEDRN
CCC1CCC(N(C(=O)c2ccc(C#N)cc2)C2CC2)CC1	ZINC000045416457	175376912	/nfs/dbraw/zinc/37/69/12/175376912.db2.gz	DTCMLPHFGCPGDJ-UHFFFAOYSA-N	0	0	296.414	4.132	20	30		CIEDRN
C=CCN(C(=O)c1ccc2ccccc2n1)c1ccccc1	ZINC000071846221	176275925	/nfs/dbraw/zinc/27/59/25/176275925.db2.gz	TXVFZAVRJJFSMU-UHFFFAOYSA-N	0	0	288.350	4.068	20	30		CIEDRN
CC(C)CCn1c2ccccc2nc1SCCCC#N	ZINC000072099202	176315554	/nfs/dbraw/zinc/31/55/54/176315554.db2.gz	WTNRCJQXXWQRSO-UHFFFAOYSA-N	0	0	287.432	4.478	20	30		CIEDRN
C=CCCC(=O)N[C@@H](CCCC)c1ccc(OC)cc1	ZINC000078483879	177345816	/nfs/dbraw/zinc/34/58/16/177345816.db2.gz	BMOGVCYKFBTFKG-INIZCTEOSA-N	0	0	275.392	4.009	20	30		CIEDRN
N#Cc1cccc(Cl)c1NCC1(c2ccccn2)CCC1	ZINC000343909997	224889570	/nfs/dbraw/zinc/88/95/70/224889570.db2.gz	BUHRLMFFPZKBBO-UHFFFAOYSA-N	0	0	297.789	4.140	20	30		CIEDRN
O=C(Cc1ccc2c[nH]nc2c1)N[C@@H]1CC[C@@H]2CCC[C@@H]2C1	ZINC000329246160	227378538	/nfs/dbraw/zinc/37/85/38/227378538.db2.gz	ANFUILCMTVDGQV-SQWLQELKSA-N	0	0	297.402	4.031	20	30		CIEDRN
C[C@H](SCc1cccc(C#N)c1)c1cccc(C#N)c1	ZINC000190881860	224967126	/nfs/dbraw/zinc/96/71/26/224967126.db2.gz	VIOJMGUCIVTTKI-ZDUSSCGKSA-N	0	0	278.380	4.424	20	30		CIEDRN
C[C@H]1OCC[C@H]1C(=O)Nc1ncc(C2CCCCC2)s1	ZINC000329461675	225014906	/nfs/dbraw/zinc/01/49/06/225014906.db2.gz	PXRZFTGDKRSXNC-ZYHUDNBSSA-N	0	0	294.420	4.204	20	30		CIEDRN
N#CC1(CSCc2coc(-c3cccc(F)c3)n2)CC1	ZINC000344473461	225068455	/nfs/dbraw/zinc/06/84/55/225068455.db2.gz	WIYXKVHBJONAPK-UHFFFAOYSA-N	0	0	288.347	4.018	20	30		CIEDRN
N#CCC[C@H](NCc1ccc(Cl)o1)c1ccccc1	ZINC000344862407	225205049	/nfs/dbraw/zinc/20/50/49/225205049.db2.gz	XKUFXCUFCBMUBZ-AWEZNQCLSA-N	0	0	274.751	4.068	20	30		CIEDRN
N#Cc1ccc(C[NH2+][C@H]2CCc3sc(Cl)cc32)s1	ZINC000334756058	225310125	/nfs/dbraw/zinc/31/01/25/225310125.db2.gz	MJTMZHDGIZEHPU-NSHDSACASA-N	0	0	294.832	4.112	20	30		CIEDRN
C[C@H]1CC(C)(C)CN1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000334910144	225361888	/nfs/dbraw/zinc/36/18/88/225361888.db2.gz	BGJWYCAKGYYWAU-ZDUSSCGKSA-N	0	0	299.418	4.140	20	30		CIEDRN
Cc1ccc([C@H](C)Nc2nc(C)ccc2C#N)c(C)c1	ZINC000346852027	225942275	/nfs/dbraw/zinc/94/22/75/225942275.db2.gz	PHGFNDDBQUVEKF-AWEZNQCLSA-N	0	0	265.360	4.052	20	30		CIEDRN
N#CCCN(CCC1CCCCCC1)Cc1cccnc1	ZINC000347655863	226228208	/nfs/dbraw/zinc/22/82/08/226228208.db2.gz	RPNWJOJYQQBPJM-UHFFFAOYSA-N	0	0	285.435	4.158	20	30		CIEDRN
N#Cc1cnccc1/C=C/c1cccc(-c2cccnc2)c1	ZINC000367014412	226387483	/nfs/dbraw/zinc/38/74/83/226387483.db2.gz	FFNYLFLENJRISZ-VOTSOKGWSA-N	0	0	283.334	4.186	20	30		CIEDRN
Cc1csc(NC(=O)c2ccc(C(F)F)cc2)c1C#N	ZINC000335673007	226537768	/nfs/dbraw/zinc/53/77/68/226537768.db2.gz	XPQIZQIWRLAAMY-UHFFFAOYSA-N	0	0	292.310	4.118	20	30		CIEDRN
N#Cc1cnccc1/C=C/c1cnc(-c2cccs2)s1	ZINC000349112723	226541700	/nfs/dbraw/zinc/54/17/00/226541700.db2.gz	PNAHSGZLRGMXBS-ONEGZZNKSA-N	0	0	295.392	4.309	20	30		CIEDRN
N#Cc1cnccc1/C=C/c1ncc(-c2ccccc2)s1	ZINC000349105809	226545921	/nfs/dbraw/zinc/54/59/21/226545921.db2.gz	HLPOOWHIAMAUDQ-VOTSOKGWSA-N	0	0	289.363	4.247	20	30		CIEDRN
CO[C@@H](C)c1cccc(N[C@H]2CCc3ccc(C#N)cc32)c1	ZINC000575168562	335074603	/nfs/dbraw/zinc/07/46/03/335074603.db2.gz	VVHWHOLPIPRRER-DJJJIMSYSA-N	0	0	292.382	4.365	20	30		CIEDRN
C[C@H](c1ccc(C(C)(C)C)cc1)[S@@](=O)CCCCC#N	ZINC000352369785	226857496	/nfs/dbraw/zinc/85/74/96/226857496.db2.gz	ACZPSBVLMSUKPP-VLIAUNLRSA-N	0	0	291.460	4.488	20	30		CIEDRN
Cc1noc([C@H](C)NC(=O)[C@@H]2CCC[C@@H]3CCCC[C@@H]23)n1	ZINC000329075219	227284637	/nfs/dbraw/zinc/28/46/37/227284637.db2.gz	PNLLWZYBYVKURB-SCUASFONSA-N	0	0	291.395	4.002	20	30		CIEDRN
N#Cc1ccc(NC2CC2)c(NC(=O)[C@H]2[C@@H]3CCCC[C@@H]32)c1	ZINC000329079183	227284928	/nfs/dbraw/zinc/28/49/28/227284928.db2.gz	BWPUIBWRSFDPFK-HALDLXJZSA-N	0	0	295.386	4.157	20	30		CIEDRN
Cc1nnc(NC(=O)C[C@@H]2CCCCC2(C)C)n1C1CC1	ZINC000329151473	227329007	/nfs/dbraw/zinc/32/90/07/227329007.db2.gz	SIUBQXFQPHQHJF-LBPRGKRZSA-N	0	0	290.411	4.116	20	30		CIEDRN
Cc1nnc(NC(=O)C[C@H]2CCCC(C)(C)C2)n1C1CC1	ZINC000329160086	227333478	/nfs/dbraw/zinc/33/34/78/227333478.db2.gz	XYSVXDPDSUTCND-GFCCVEGCSA-N	0	0	290.411	4.116	20	30		CIEDRN
N#Cc1nccnc1N[C@@H](c1ccccc1)C1CCCCC1	ZINC000301162711	227463595	/nfs/dbraw/zinc/46/35/95/227463595.db2.gz	HTHOLACFIXXZDO-KRWDZBQOSA-N	0	0	292.386	4.082	20	30		CIEDRN
Cc1c2ccccc2oc1[C@H](C)Nc1cccc(C#N)n1	ZINC000301280177	227498102	/nfs/dbraw/zinc/49/81/02/227498102.db2.gz	NTCRCEDBCVRSST-LBPRGKRZSA-N	0	0	277.327	4.181	20	30		CIEDRN
N#Cc1ccc(N[C@H]2CCc3ccc(F)cc32)cc1Cl	ZINC000301293186	227502839	/nfs/dbraw/zinc/50/28/39/227502839.db2.gz	XJVLGYZEXDGFFC-INIZCTEOSA-N	0	0	286.737	4.450	20	30		CIEDRN
N#Cc1nc(Oc2ccc(F)cc2Cl)ccc1Cl	ZINC000301512903	227568892	/nfs/dbraw/zinc/56/88/92/227568892.db2.gz	DOIQNLBVISXRTJ-UHFFFAOYSA-N	0	0	283.089	4.191	20	30		CIEDRN
N#Cc1cccc(N[C@@H](Cc2ccccc2)c2ccccc2)n1	ZINC000301516524	227569291	/nfs/dbraw/zinc/56/92/91/227569291.db2.gz	JWWVECGDMKFIQD-IBGZPJMESA-N	0	0	299.377	4.349	20	30		CIEDRN
Cc1cc(Cl)cnc1NC(=O)N[C@@H]1CC12CCCCC2	ZINC000329605877	227644883	/nfs/dbraw/zinc/64/48/83/227644883.db2.gz	HRHUVHUIIPMZEQ-GFCCVEGCSA-N	0	0	293.798	4.092	20	30		CIEDRN
N#Cc1ccc(NCc2ccccc2N2CCCCC2)cc1	ZINC000302070584	227781675	/nfs/dbraw/zinc/78/16/75/227781675.db2.gz	ULFUCSRNZXSTAE-UHFFFAOYSA-N	0	0	291.398	4.161	20	30		CIEDRN
Cc1cccc(C)c1[C@H](C)Nc1ccc(Cl)c(C#N)n1	ZINC000302228216	227826128	/nfs/dbraw/zinc/82/61/28/227826128.db2.gz	QRMYQPIONYFSJS-LBPRGKRZSA-N	0	0	285.778	4.397	20	30		CIEDRN
N#Cc1c(Cl)nsc1NCc1ccc(C2CC2)cc1	ZINC000302738832	227882493	/nfs/dbraw/zinc/88/24/93/227882493.db2.gz	XZWYHSUZINVLBS-UHFFFAOYSA-N	0	0	289.791	4.158	20	30		CIEDRN
N#C[C@@H]1CCC[C@@H]1NC(=O)C1(Cc2ccccc2)CCC1	ZINC000329826563	227961221	/nfs/dbraw/zinc/96/12/21/227961221.db2.gz	ISBMRWHKPMBFLQ-HOTGVXAUSA-N	0	0	282.387	4.048	20	30		CIEDRN
O=C(N[C@@H]1CCCCC12CCCC2)c1cc(C2CC2)on1	ZINC000329842806	227964774	/nfs/dbraw/zinc/96/47/74/227964774.db2.gz	XEADOYUZRMAHFV-OAHLLOKOSA-N	0	0	288.391	4.360	20	30		CIEDRN
O=C(Nc1cnc(-c2ccccc2)nc1)[C@H]1CC12CCCC2	ZINC000329965890	228000396	/nfs/dbraw/zinc/00/03/96/228000396.db2.gz	RMKZJSBQDRAZPR-OAHLLOKOSA-N	0	0	293.370	4.312	20	30		CIEDRN
Cc1ccc(NC(=O)[C@H]2CC23CCCC3)c2n[nH]cc21	ZINC000329973651	228003991	/nfs/dbraw/zinc/00/39/91/228003991.db2.gz	WWYUTYASXHDGPC-GFCCVEGCSA-N	0	0	269.348	4.040	20	30		CIEDRN
Cc1nc(CC2CC2)oc1C(=O)N[C@@H]1CCC[C@H](C)[C@@H]1C	ZINC000330029566	228021120	/nfs/dbraw/zinc/02/11/20/228021120.db2.gz	QGOYWJVOUBJIAM-COPLHBTASA-N	0	0	290.407	4.065	20	30		CIEDRN
Cc1coc2ccc(NC(=O)[C@H]3CCO[C@H](C)C3)cc12	ZINC000330047571	228026547	/nfs/dbraw/zinc/02/65/47/228026547.db2.gz	HUCJIQASPNZOCG-NEPJUHHUSA-N	0	0	273.332	4.144	20	30		CIEDRN
N#CCCN(Cc1cc(Cl)cc(Cl)c1)CC1CC1	ZINC000353433708	228101625	/nfs/dbraw/zinc/10/16/25/228101625.db2.gz	HLXRNWHMTHTFFO-UHFFFAOYSA-N	0	0	283.202	4.119	20	30		CIEDRN
Cc1ccc(-c2cccnc2)cc1NC(=O)[C@H]1CC[C@@H](C)O1	ZINC000330086143	228035930	/nfs/dbraw/zinc/03/59/30/228035930.db2.gz	LZJZILKDZVUWMH-CXAGYDPISA-N	0	0	296.370	4.213	20	30		CIEDRN
Cc1coc2ccc(NC(=O)[C@H]3CCC(=O)[C@H](C)C3)cc12	ZINC000330116497	228042736	/nfs/dbraw/zinc/04/27/36/228042736.db2.gz	VNKMGRYTGVGIEP-PWSUYJOCSA-N	0	0	285.343	4.335	20	30		CIEDRN
Cc1c(NCc2ccc(C#N)c(C)c2)cnn1C1CCCC1	ZINC000332013454	228143837	/nfs/dbraw/zinc/14/38/37/228143837.db2.gz	ZXGGOIHQYORICT-UHFFFAOYSA-N	0	0	294.402	4.099	20	30		CIEDRN
Cc1cscc1N[C@@H]1CCc2ccc(C#N)cc21	ZINC000353679595	228144135	/nfs/dbraw/zinc/14/41/35/228144135.db2.gz	POANMXXYMQPPAB-CQSZACIVSA-N	0	0	254.358	4.028	20	30		CIEDRN
Cc1cc(C#N)cc(NC(=O)N2[C@H](C)C[C@@H]3CCCC[C@H]32)c1	ZINC000332304618	228154852	/nfs/dbraw/zinc/15/48/52/228154852.db2.gz	VYDVMRQAGPGSPV-UKPHBRMFSA-N	0	0	297.402	4.052	20	30		CIEDRN
Cc1cc(C#N)cc(NC(=O)N2[C@H](C)C[C@H]3CCCC[C@H]32)c1	ZINC000332304403	228154985	/nfs/dbraw/zinc/15/49/85/228154985.db2.gz	VYDVMRQAGPGSPV-FRFSOERESA-N	0	0	297.402	4.052	20	30		CIEDRN
Cc1csc([C@H](C#N)C(=O)c2ccc3sccc3c2)n1	ZINC000351947703	228168233	/nfs/dbraw/zinc/16/82/33/228168233.db2.gz	VDOHCECFLXFXOT-GFCCVEGCSA-N	0	0	298.392	4.156	20	30		CIEDRN
C[C@@H]1CC=CC[C@@H]1C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000352174711	228191797	/nfs/dbraw/zinc/19/17/97/228191797.db2.gz	PDGYFUAIFGKLHR-BPQIPLTHSA-N	0	0	296.414	4.140	20	30		CIEDRN
Cc1ccc(C(=O)N[C@H](CCCC#N)c2ccccc2)s1	ZINC000352197722	228195650	/nfs/dbraw/zinc/19/56/50/228195650.db2.gz	CVJGOXIJMDEFRG-OAHLLOKOSA-N	0	0	298.411	4.222	20	30		CIEDRN
Cc1ccccc1C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000352205292	228198229	/nfs/dbraw/zinc/19/82/29/228198229.db2.gz	DOGSUHSLQOQUJK-GOSISDBHSA-N	0	0	292.382	4.160	20	30		CIEDRN
C[C@@H]1CCC[C@@H](c2noc([C@]3(C#N)CC34CCCC4)n2)C1	ZINC000333788832	228214664	/nfs/dbraw/zinc/21/46/64/228214664.db2.gz	CYDZMLSNHZTRGO-PBFPGSCMSA-N	0	0	285.391	4.089	20	30		CIEDRN
N#C[C@@]1(c2nc(-c3ccc(Cl)cc3)no2)CC12CCCC2	ZINC000333852351	228217259	/nfs/dbraw/zinc/21/72/59/228217259.db2.gz	PSQFTDGHROJLSH-MRXNPFEDSA-N	0	0	299.761	4.115	20	30		CIEDRN
Cc1ccccc1[C@H](C)CC(=O)N[C@@]1(C#N)CCC[C@H](C)C1	ZINC000116800979	260005752	/nfs/dbraw/zinc/00/57/52/260005752.db2.gz	VRYQNBBXQYOPRE-GMBSWORKSA-N	0	0	298.430	4.077	20	30		CIEDRN
C#CCCCCC(=O)Nc1cccnc1-c1ccc(C)s1	ZINC000187076849	260026352	/nfs/dbraw/zinc/02/63/52/260026352.db2.gz	DRHHXSCRWSSHQQ-UHFFFAOYSA-N	0	0	298.411	4.251	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@H](C)c1ccccc1)c1ccccc1	ZINC000187703450	260029932	/nfs/dbraw/zinc/02/99/32/260029932.db2.gz	OZTVAZNZWCXICE-QAPCUYQASA-N	0	0	279.383	4.224	20	30		CIEDRN
N#CCc1ccc(NC2CC(c3ccccc3)C2)cc1	ZINC000037071502	260066518	/nfs/dbraw/zinc/06/65/18/260066518.db2.gz	JHCAWWLCNLYZRO-UHFFFAOYSA-N	0	0	262.356	4.111	20	30		CIEDRN
N#CC[C@@H](CC(=O)N1CCCC12CCCC2)c1ccccc1	ZINC000370596077	260089310	/nfs/dbraw/zinc/08/93/10/260089310.db2.gz	CLMHPNRZOPDUIU-KRWDZBQOSA-N	0	0	296.414	4.009	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cncc(Cl)c1Cl	ZINC000180076457	260091989	/nfs/dbraw/zinc/09/19/89/260091989.db2.gz	WRCSQDFNXSXVMA-UHFFFAOYSA-N	0	0	285.174	4.095	20	30		CIEDRN
C=C(C)CN(C)C(=O)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl	ZINC000180398444	260100679	/nfs/dbraw/zinc/10/06/79/260100679.db2.gz	OHLCOPBPJCJRPI-CHWSQXEVSA-N	0	0	298.213	4.131	20	30		CIEDRN
N#Cc1ccc(C[NH2+][C@H]2CCSc3c(F)cccc32)cc1	ZINC000037489137	260111031	/nfs/dbraw/zinc/11/10/31/260111031.db2.gz	HGWHQQVMQHYDNA-INIZCTEOSA-N	0	0	298.386	4.024	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N(CC)c1nc2ccccc2s1	ZINC000526042491	260112507	/nfs/dbraw/zinc/11/25/07/260112507.db2.gz	CTCHAXXXDJUUFG-MRXNPFEDSA-N	0	0	288.416	4.252	20	30		CIEDRN
C=CCCCS[C@H](C)C(=O)Nc1c(C)cccc1C	ZINC000117944554	260116756	/nfs/dbraw/zinc/11/67/56/260116756.db2.gz	GTFSXMKQVGCPJN-CQSZACIVSA-N	0	0	277.433	4.330	20	30		CIEDRN
C=CCCCS[C@@H](C)C(=O)Nc1ccccc1C	ZINC000117944513	260117175	/nfs/dbraw/zinc/11/71/75/260117175.db2.gz	DNUQGGVXILKTAJ-ZDUSSCGKSA-N	0	0	263.406	4.021	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(OC(C)C)cc1Cl	ZINC000188301778	260124000	/nfs/dbraw/zinc/12/40/00/260124000.db2.gz	SMHGVDYUSMRAOB-UHFFFAOYSA-N	0	0	267.756	4.032	20	30		CIEDRN
C=CCC(F)(F)C(=O)Nc1onc(C2CCCCC2)c1C	ZINC000297857208	260136063	/nfs/dbraw/zinc/13/60/63/260136063.db2.gz	SJYDZAIXACGFJP-UHFFFAOYSA-N	0	0	298.333	4.181	20	30		CIEDRN
C#CCC(C)(C)C(=O)Nc1onc(C2CCCCC2)c1C	ZINC000297828295	260136151	/nfs/dbraw/zinc/13/61/51/260136151.db2.gz	QLDWGTOLWYSIJZ-UHFFFAOYSA-N	0	0	288.391	4.019	20	30		CIEDRN
C=CCC(F)(F)C(=O)Nc1c(F)cccc1SCC	ZINC000297884462	260136963	/nfs/dbraw/zinc/13/69/63/260136963.db2.gz	VCALNVGAMKRXTD-UHFFFAOYSA-N	0	0	289.322	4.088	20	30		CIEDRN
CCC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1	ZINC000069829398	260150890	/nfs/dbraw/zinc/15/08/90/260150890.db2.gz	WFOTWFIXVCWLET-UHFFFAOYSA-N	0	0	269.275	4.082	20	30		CIEDRN
Cc1csc([C@@H](C)Nc2cc(C#N)c3ccccc3n2)n1	ZINC000080119146	260178196	/nfs/dbraw/zinc/17/81/96/260178196.db2.gz	PHUOPMLMOPMFTJ-LLVKDONJSA-N	0	0	294.383	4.045	20	30		CIEDRN
Cc1nc(N2CCC3(C2)CCCCC3)c(Cl)cc1C#N	ZINC000312611454	260182422	/nfs/dbraw/zinc/18/24/22/260182422.db2.gz	UGFCHNIUJFXHQI-UHFFFAOYSA-N	0	0	289.810	4.076	20	30		CIEDRN
CC(C)(C)c1cccc(Oc2cccc(C#N)n2)c1	ZINC000081621259	260184096	/nfs/dbraw/zinc/18/40/96/260184096.db2.gz	MLCYFEOQTRXRRD-UHFFFAOYSA-N	0	0	252.317	4.043	20	30		CIEDRN
CC(C)(C#N)CCCNc1ccc(Cl)cc1F	ZINC000087597656	260191764	/nfs/dbraw/zinc/19/17/64/260191764.db2.gz	ZZVOWLIOJWZPFQ-UHFFFAOYSA-N	0	0	254.736	4.221	20	30		CIEDRN
Cc1ccc(OCCCC(C)(C)C#N)c(Br)c1	ZINC000087598979	260191788	/nfs/dbraw/zinc/19/17/88/260191788.db2.gz	DGMSDJVARGWHRF-UHFFFAOYSA-N	0	0	296.208	4.466	20	30		CIEDRN
Cc1ccc(NCCCC(C)(C)C#N)cc1Br	ZINC000087598329	260191942	/nfs/dbraw/zinc/19/19/42/260191942.db2.gz	SGFJEOWEJNFFRS-UHFFFAOYSA-N	0	0	295.224	4.499	20	30		CIEDRN
CCOc1ccc(OCC)c(NCCCC(C)(C)C#N)c1	ZINC000087597003	260191965	/nfs/dbraw/zinc/19/19/65/260191965.db2.gz	LYAAEXQCIRUEIV-UHFFFAOYSA-N	0	0	290.407	4.226	20	30		CIEDRN
COc1ccc(CNc2c(C)cc(C)cc2C)cc1C#N	ZINC000087823769	260218636	/nfs/dbraw/zinc/21/86/36/260218636.db2.gz	NWKLCYJZEBTTDD-UHFFFAOYSA-N	0	0	280.371	4.104	20	30		CIEDRN
Cc1cc(C#N)cc(C)c1OCc1cnc2ccccc2c1	ZINC000317504243	260241113	/nfs/dbraw/zinc/24/11/13/260241113.db2.gz	VNXLSCGFJNJRHF-UHFFFAOYSA-N	0	0	288.350	4.302	20	30		CIEDRN
N#Cc1ccc(NC(=O)CC2CCCCC2)cc1Cl	ZINC000311371049	260243638	/nfs/dbraw/zinc/24/36/38/260243638.db2.gz	RKZFFZHEKIGECL-UHFFFAOYSA-N	0	0	276.767	4.121	20	30		CIEDRN
COc1cc(NCC(C)(C)CCC#N)c(OC)cc1Cl	ZINC000092174831	260267549	/nfs/dbraw/zinc/26/75/49/260267549.db2.gz	IJLJKXJSMWDEKN-UHFFFAOYSA-N	0	0	296.798	4.099	20	30		CIEDRN
Cc1cc(C#N)cc(C)c1OCc1csc(C(C)C)n1	ZINC000088154543	260278268	/nfs/dbraw/zinc/27/82/68/260278268.db2.gz	PTPKXUQBBQQWKO-UHFFFAOYSA-N	0	0	286.400	4.334	20	30		CIEDRN
Cc1cc(C#N)cc(C)c1OCc1cccc(F)c1F	ZINC000088154093	260278275	/nfs/dbraw/zinc/27/82/75/260278275.db2.gz	KHAQNCNFGWHKHQ-UHFFFAOYSA-N	0	0	273.282	4.032	20	30		CIEDRN
Cc1ccc(CCN(CCCCC#N)CC(F)(F)F)cc1	ZINC000075886183	260291955	/nfs/dbraw/zinc/29/19/55/260291955.db2.gz	XYQYGBZHZKQOAP-UHFFFAOYSA-N	0	0	298.352	4.096	20	30		CIEDRN
CC(C)(C)c1ccccc1C(=O)Nc1cccc(CC#N)c1	ZINC000313429163	260293113	/nfs/dbraw/zinc/29/31/13/260293113.db2.gz	CRMFGAJNYHQDKT-UHFFFAOYSA-N	0	0	292.382	4.302	20	30		CIEDRN
C=C(C)CCc1noc(CO[C@@H]2CCCc3ccccc32)n1	ZINC000518005849	260333217	/nfs/dbraw/zinc/33/32/17/260333217.db2.gz	AIJHWCCHLZGYQD-MRXNPFEDSA-N	0	0	298.386	4.173	20	30		CIEDRN
C=CCN(C(=O)CC1=CCCCC1)c1ccccc1	ZINC000518038895	260337157	/nfs/dbraw/zinc/33/71/57/260337157.db2.gz	UVTPRAQPHSICIW-UHFFFAOYSA-N	0	0	255.361	4.096	20	30		CIEDRN
CC(C)c1ccc(C[S@@](=O)CCCC(C)(C)C#N)cc1	ZINC000083080123	260346088	/nfs/dbraw/zinc/34/60/88/260346088.db2.gz	QOKARMMYABZAPY-HXUWFJFHSA-N	0	0	291.460	4.389	20	30		CIEDRN
C=CCN(Cc1cccs1)Cc1c(C)nsc1C	ZINC000518211724	260356654	/nfs/dbraw/zinc/35/66/54/260356654.db2.gz	JLYVREUZTDNRGM-UHFFFAOYSA-N	0	0	278.446	4.010	20	30		CIEDRN
CC(C)c1ccc(CNc2cccc(CC#N)c2)cc1	ZINC000313434689	260361506	/nfs/dbraw/zinc/36/15/06/260361506.db2.gz	HXYQKYOXUXTSHD-UHFFFAOYSA-N	0	0	264.372	4.488	20	30		CIEDRN
C[C@@H](C#N)CN(C(=O)Nc1ccc(C2CCC2)cc1)C1CC1	ZINC000518281574	260368835	/nfs/dbraw/zinc/36/88/35/260368835.db2.gz	YUNCLEFSCCCDKI-ZDUSSCGKSA-N	0	0	297.402	4.110	20	30		CIEDRN
CN(Cc1ccc(F)cc1F)c1cc(Cl)ccc1C#N	ZINC000518350370	260381725	/nfs/dbraw/zinc/38/17/25/260381725.db2.gz	ODSUVNNCDXDNCL-UHFFFAOYSA-N	0	0	292.716	4.126	20	30		CIEDRN
CCCCCc1ccc(NC(=O)N(C)[C@H](C)CC#N)cc1	ZINC000086281095	260387889	/nfs/dbraw/zinc/38/78/89/260387889.db2.gz	OXWLXXIXFUMTNC-CQSZACIVSA-N	0	0	287.407	4.185	20	30		CIEDRN
Cc1ccc(Oc2cccc(F)c2C#N)c(Cl)c1	ZINC000086485529	260393117	/nfs/dbraw/zinc/39/31/17/260393117.db2.gz	XFGDBANDWCACOH-UHFFFAOYSA-N	0	0	261.683	4.452	20	30		CIEDRN
CCCNc1ccc(C#N)cc1NC(=O)CC(C)(C)C1CC1	ZINC000518408131	260401270	/nfs/dbraw/zinc/40/12/70/260401270.db2.gz	QHXPNYDETDDJRJ-UHFFFAOYSA-N	0	0	299.418	4.145	20	30		CIEDRN
CCc1cc(NC2CCC(C)(C#N)CC2)ccc1F	ZINC000449314730	260402103	/nfs/dbraw/zinc/40/21/03/260402103.db2.gz	DUDLERXEUKWNNO-UHFFFAOYSA-N	0	0	260.356	4.272	20	30		CIEDRN
CCc1cc(NCc2ccccc2C#N)ccc1C	ZINC000409446073	260405388	/nfs/dbraw/zinc/40/53/88/260405388.db2.gz	ROOWDGLVUAYUKB-UHFFFAOYSA-N	0	0	250.345	4.041	20	30		CIEDRN
Cc1ccc(N[C@H](c2ccc(F)cc2)C(C)C)nc1C#N	ZINC000409552975	260416715	/nfs/dbraw/zinc/41/67/15/260416715.db2.gz	WZCNRBYGLRNVRM-KRWDZBQOSA-N	0	0	283.350	4.210	20	30		CIEDRN
C=C(C)Cn1ccc(=O)c2cc(Oc3ccccc3)ccc21	ZINC000518444103	260421220	/nfs/dbraw/zinc/42/12/20/260421220.db2.gz	PESJKEGNLPKSLB-UHFFFAOYSA-N	0	0	291.350	4.370	20	30		CIEDRN
C=CCCc1ccccc1NCc1ccc(CC#N)cc1	ZINC000409876919	260434692	/nfs/dbraw/zinc/43/46/92/260434692.db2.gz	BCYSIIICLDJYFX-UHFFFAOYSA-N	0	0	276.383	4.483	20	30		CIEDRN
CC1(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)CCCC1	ZINC000091527591	260445875	/nfs/dbraw/zinc/44/58/75/260445875.db2.gz	BBKAHWZKLWFACW-UHFFFAOYSA-N	0	0	296.292	4.096	20	30		CIEDRN
C=CCCC(=O)NCc1ccccc1Oc1cccc(C)c1	ZINC000518559119	260452854	/nfs/dbraw/zinc/45/28/54/260452854.db2.gz	QIIAHBBIBQQHFL-UHFFFAOYSA-N	0	0	295.382	4.370	20	30		CIEDRN
CC(C)[C@H](NC(=O)Nc1cccc(C#N)c1)c1ccccc1	ZINC000410094403	260460279	/nfs/dbraw/zinc/46/02/79/260460279.db2.gz	JGKVFKVJBICBNB-KRWDZBQOSA-N	0	0	293.370	4.077	20	30		CIEDRN
CSCCCCNc1ccc(C(F)(F)F)c(C#N)c1	ZINC000133448426	260519244	/nfs/dbraw/zinc/51/92/44/260519244.db2.gz	CVXSLWHHWIXAJN-UHFFFAOYSA-N	0	0	288.338	4.132	20	30		CIEDRN
C=CCCCNC(=O)N1CCC[C@@H]1c1cc(C)ccc1C	ZINC000448032531	260636934	/nfs/dbraw/zinc/63/69/34/260636934.db2.gz	VPGRWPPKCPRDDD-QGZVFWFLSA-N	0	0	286.419	4.116	20	30		CIEDRN
C=CCCCNC(=O)N(CCC)[C@@H]1CCc2ccccc21	ZINC000448034501	260662032	/nfs/dbraw/zinc/66/20/32/260662032.db2.gz	JBTOZCMEPNBCSS-QGZVFWFLSA-N	0	0	286.419	4.062	20	30		CIEDRN
CC(C)[C@H]1CCCN(C(=O)Nc2ccc(CC#N)cc2)CC1	ZINC000114806878	260673114	/nfs/dbraw/zinc/67/31/14/260673114.db2.gz	SGBICQKPAAVIMB-INIZCTEOSA-N	0	0	299.418	4.043	20	30		CIEDRN
CCC[C@@H](C)[C@H]1CCCN1C(=O)Nc1ccc(CC#N)cc1	ZINC000121100391	260707815	/nfs/dbraw/zinc/70/78/15/260707815.db2.gz	WKRGKUXCPLECDT-RHSMWYFYSA-N	0	0	299.418	4.185	20	30		CIEDRN
N#Cc1cc(F)c(N[C@@H]2CCCc3sccc32)c(F)c1	ZINC000147771542	260906309	/nfs/dbraw/zinc/90/63/09/260906309.db2.gz	WIIIDTZLFMHMHL-CYBMUJFWSA-N	0	0	290.338	4.387	20	30		CIEDRN
C[C@H](c1cccc(Cl)c1)[S@@](=O)CCCC(C)(C)C#N	ZINC000150895153	260974789	/nfs/dbraw/zinc/97/47/89/260974789.db2.gz	WGVVFPCSOCPOAM-CWTRNNRKSA-N	0	0	297.851	4.480	20	30		CIEDRN
C=CCCCNC(=O)N(C)[C@@H](c1ccc(F)cc1)C(C)C	ZINC000448248996	261061844	/nfs/dbraw/zinc/06/18/44/261061844.db2.gz	SONIDTWHXDGPBZ-MRXNPFEDSA-N	0	0	292.398	4.130	20	30		CIEDRN
N#CCCCC(=O)N1CCCC[C@@H]1c1cccc(Cl)c1	ZINC000360455008	261062533	/nfs/dbraw/zinc/06/25/33/261062533.db2.gz	LNBGRPHHSWGZRS-OAHLLOKOSA-N	0	0	290.794	4.087	20	30		CIEDRN
CN(c1ccccc1NCc1ccc(C#N)o1)C1CCCC1	ZINC000152517051	261065051	/nfs/dbraw/zinc/06/50/51/261065051.db2.gz	BCYIKIVPQHKNHA-UHFFFAOYSA-N	0	0	295.386	4.142	20	30		CIEDRN
CC(C)(C)c1cc(NC(=O)c2ccsc2)c(C#N)s1	ZINC000154288520	261090336	/nfs/dbraw/zinc/09/03/36/261090336.db2.gz	FUOSEMVQDWHQNL-UHFFFAOYSA-N	0	0	290.413	4.231	20	30		CIEDRN
COc1cccc(OCCSCCCC(C)(C)C#N)c1	ZINC000155692005	261105785	/nfs/dbraw/zinc/10/57/85/261105785.db2.gz	AZDSULBQKXQRGM-UHFFFAOYSA-N	0	0	293.432	4.137	20	30		CIEDRN
Cc1noc(C)c1CCSc1cccc(Cl)c1C#N	ZINC000360946827	261133089	/nfs/dbraw/zinc/13/30/89/261133089.db2.gz	PYWPXBNZADUCPR-UHFFFAOYSA-N	0	0	292.791	4.151	20	30		CIEDRN
CCCC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1	ZINC000173534497	261165391	/nfs/dbraw/zinc/16/53/91/261165391.db2.gz	DWZDJSFOBMCCPG-UHFFFAOYSA-N	0	0	298.317	4.228	20	30		CIEDRN
N#Cc1cc(F)ccc1N[C@H]1CCO[C@@H](c2ccccc2)C1	ZINC000160623819	261220700	/nfs/dbraw/zinc/22/07/00/261220700.db2.gz	KAOQSXBQOOKWQG-FUHWJXTLSA-N	0	0	296.345	4.030	20	30		CIEDRN
N#Cc1c(Cl)nsc1N[C@H]1CCCc2sccc21	ZINC000161052971	261235274	/nfs/dbraw/zinc/23/52/74/261235274.db2.gz	NVXGEIHLZJVPCS-VIFPVBQESA-N	0	0	295.820	4.219	20	30		CIEDRN
CO[C@@H](C)c1nc(CSCCCC(C)(C)C#N)cs1	ZINC000161910522	261263026	/nfs/dbraw/zinc/26/30/26/261263026.db2.gz	VWUQNAIZYMUIRM-NSHDSACASA-N	0	0	298.477	4.414	20	30		CIEDRN
CCC(=O)N(Cc1ccccc1)c1cc(Cl)ccc1C#N	ZINC000103934279	261288441	/nfs/dbraw/zinc/28/84/41/261288441.db2.gz	KFIKVTLMXMNXHI-UHFFFAOYSA-N	0	0	298.773	4.155	20	30		CIEDRN
C[C@H](CC#N)Sc1ccccc1NCc1nccs1	ZINC000163155891	261307500	/nfs/dbraw/zinc/30/75/00/261307500.db2.gz	RGMGOTDVGXWOQP-LLVKDONJSA-N	0	0	289.429	4.149	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N1CCC[C@H]1c1cccc(C)c1C	ZINC000176860588	261311964	/nfs/dbraw/zinc/31/19/64/261311964.db2.gz	UXMWODJZSNCFNB-PBHICJAKSA-N	0	0	286.419	4.115	20	30		CIEDRN
CC(C)c1nc(CSc2ccc(C#N)cc2Cl)no1	ZINC000163321976	261312252	/nfs/dbraw/zinc/31/22/52/261312252.db2.gz	CWFMEXAQOFQXFV-UHFFFAOYSA-N	0	0	293.779	4.010	20	30		CIEDRN
N#Cc1ccc(NCc2ccc(F)c(Cl)c2)c(F)c1	ZINC000053158179	261318244	/nfs/dbraw/zinc/31/82/44/261318244.db2.gz	OKOPQLZPMRIFBF-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
Cc1cc([C@@H](C)Nc2c(C#N)cnc3ccccc32)c(C)o1	ZINC000301092050	261327129	/nfs/dbraw/zinc/32/71/29/261327129.db2.gz	FYZGJENNISEHFE-GFCCVEGCSA-N	0	0	291.354	4.489	20	30		CIEDRN
Cc1cc2ccccc2nc1N(C)Cc1cccc(C#N)c1	ZINC000301143956	261330333	/nfs/dbraw/zinc/33/03/33/261330333.db2.gz	DVSRXLXNVAXLSP-UHFFFAOYSA-N	0	0	287.366	4.051	20	30		CIEDRN
C[C@@H](Sc1cccc(C#N)c1)c1cccc([N+](=O)[O-])c1	ZINC000177109125	261331667	/nfs/dbraw/zinc/33/16/67/261331667.db2.gz	MHDHVJHPGDPNMY-LLVKDONJSA-N	0	0	284.340	4.320	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@@H](c1ccccc1C)C1CC1	ZINC000491128924	261342486	/nfs/dbraw/zinc/34/24/86/261342486.db2.gz	BOSIULYJEMKMJJ-QGZVFWFLSA-N	0	0	286.419	4.054	20	30		CIEDRN
CC(C)c1nnc(N[C@H](CCC#N)c2ccccc2)s1	ZINC000164321664	261348264	/nfs/dbraw/zinc/34/82/64/261348264.db2.gz	LSQRCROQVNCIBM-CYBMUJFWSA-N	0	0	286.404	4.118	20	30		CIEDRN
C[C@@H](NCc1cccc(C#N)c1)c1c(F)cccc1Cl	ZINC000177713997	261367423	/nfs/dbraw/zinc/36/74/23/261367423.db2.gz	BMFWVPIMSUJUMK-LLVKDONJSA-N	0	0	288.753	4.202	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)C[C@H](C)c1cccc(F)c1	ZINC000178379980	261388932	/nfs/dbraw/zinc/38/89/32/261388932.db2.gz	BBRMIULGXAXCKE-LBPRGKRZSA-N	0	0	296.345	4.138	20	30		CIEDRN
CC#CCCCC(=O)N[C@H]1c2ccccc2CCC[C@@H]1C	ZINC000466306392	261390504	/nfs/dbraw/zinc/39/05/04/261390504.db2.gz	JSQMGZGTYMTVCT-HNAYVOBHSA-N	0	0	283.415	4.010	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000466360457	261394776	/nfs/dbraw/zinc/39/47/76/261394776.db2.gz	DTAFXIUJGKUMLR-IAQYHMDHSA-N	0	0	299.336	4.485	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(Cc1ccccc1C)C1CC1	ZINC000466367166	261396887	/nfs/dbraw/zinc/39/68/87/261396887.db2.gz	QIPIDEMVWXNGSW-MRXNPFEDSA-N	0	0	286.419	4.024	20	30		CIEDRN
Cc1ccccc1[C@@H](C)NC(=O)Nc1cccc(C#N)c1C	ZINC000178555926	261397769	/nfs/dbraw/zinc/39/77/69/261397769.db2.gz	CHZJCGBXDLCPKT-CQSZACIVSA-N	0	0	293.370	4.058	20	30		CIEDRN
C=CCC[C@H](NC(=O)CCc1ccco1)c1ccccc1	ZINC000178741004	261404390	/nfs/dbraw/zinc/40/43/90/261404390.db2.gz	MPAAKUHXAJRLSI-KRWDZBQOSA-N	0	0	283.371	4.036	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1ccccc1COC(C)(C)C	ZINC000466542951	261419658	/nfs/dbraw/zinc/41/96/58/261419658.db2.gz	WQAKVWFEQHFGQF-OAHLLOKOSA-N	0	0	289.419	4.086	20	30		CIEDRN
CC(C)c1ccc(C[S@](=O)Cc2cccc(C#N)c2)cc1	ZINC000170982563	261453563	/nfs/dbraw/zinc/45/35/63/261453563.db2.gz	MVIVLSHGVYPYQL-NRFANRHFSA-N	0	0	297.423	4.131	20	30		CIEDRN
CC(C)c1ccc(/C=N/O[C@@H](C)c2nc(C3CC3)no2)cc1	ZINC000174089363	261557276	/nfs/dbraw/zinc/55/72/76/261557276.db2.gz	ILMPCLCCOXJQBA-NNLQFVHNSA-N	0	0	299.374	4.182	20	30		CIEDRN
CN(CC(C)(C)C)c1c(C#N)cnc2ccc(Cl)cc21	ZINC000462821568	261668225	/nfs/dbraw/zinc/66/82/25/261668225.db2.gz	ZTNZZRBYGWCELY-UHFFFAOYSA-N	0	0	287.794	4.242	20	30		CIEDRN
N#Cc1csc(C(=O)N(c2ccccc2)C2CCCC2)c1	ZINC000177052658	261683704	/nfs/dbraw/zinc/68/37/04/261683704.db2.gz	URRJVFCDVATZBS-UHFFFAOYSA-N	0	0	296.395	4.209	20	30		CIEDRN
COc1c(C)ccc(NCCCC(C)(C)C#N)c1C	ZINC000177580633	261706559	/nfs/dbraw/zinc/70/65/59/261706559.db2.gz	MCJHQNLRZJXWRJ-UHFFFAOYSA-N	0	0	260.381	4.054	20	30		CIEDRN
CCN(C(=O)c1ccc(C2(C#N)CC2)cc1)C1CCCCC1	ZINC000182629327	261946338	/nfs/dbraw/zinc/94/63/38/261946338.db2.gz	KUTHSOCCIALXKF-UHFFFAOYSA-N	0	0	296.414	4.037	20	30		CIEDRN
Cc1nc(C(F)(F)F)c(CSCCCCC#N)s1	ZINC000184532785	262022086	/nfs/dbraw/zinc/02/20/86/262022086.db2.gz	YAMGBTVITSNOCK-UHFFFAOYSA-N	0	0	294.367	4.397	20	30		CIEDRN
Cc1ccc([C@H](C)Nc2ccc(C#N)cc2[N+](=O)[O-])c(C)c1	ZINC000318678683	262028563	/nfs/dbraw/zinc/02/85/63/262028563.db2.gz	AJXXXQYUYGMVDU-ZDUSSCGKSA-N	0	0	295.342	4.256	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@H](C)c1cccc2ccccc21	ZINC000182216746	262047136	/nfs/dbraw/zinc/04/71/36/262047136.db2.gz	UALSHBKZGQNJML-CQSZACIVSA-N	0	0	282.387	4.118	20	30		CIEDRN
N#C[C@@H]1CCC[C@H](Nc2ccccc2N2CCCCC2)C1	ZINC000185731624	262068747	/nfs/dbraw/zinc/06/87/47/262068747.db2.gz	PYIVUEXCKIOPJD-CVEARBPZSA-N	0	0	283.419	4.171	20	30		CIEDRN
CCN(C(=O)C[C@H]1C=CCCC1)[C@H](C)c1ccc(C#N)cc1	ZINC000186525919	262097103	/nfs/dbraw/zinc/09/71/03/262097103.db2.gz	NCUFWQPXCQKPJS-CVEARBPZSA-N	0	0	296.414	4.214	20	30		CIEDRN
CC#CCCCC(=O)N[C@H](c1cccnc1)C1CCCCC1	ZINC000364055494	262127458	/nfs/dbraw/zinc/12/74/58/262127458.db2.gz	KKLCTFRQASRIBS-IBGZPJMESA-N	0	0	298.430	4.013	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H](c1cccnc1)C1CCCCC1	ZINC000364055497	262127520	/nfs/dbraw/zinc/12/75/20/262127520.db2.gz	KKLCTFRQASRIBS-LJQANCHMSA-N	0	0	298.430	4.013	20	30		CIEDRN
CC(F)(F)c1cccc(NC(=O)C2(C#N)CCCCC2)c1	ZINC000187356784	262133018	/nfs/dbraw/zinc/13/30/18/262133018.db2.gz	KBNSILDDLNECBP-UHFFFAOYSA-N	0	0	292.329	4.211	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)c1oc2ccccc2c1C	ZINC000187512131	262138576	/nfs/dbraw/zinc/13/85/76/262138576.db2.gz	SPDZTKKWPJDTNO-UHFFFAOYSA-N	0	0	298.386	4.286	20	30		CIEDRN
CSc1ccc(N(C)Cc2ccc(C#N)cc2F)cc1	ZINC000497473041	262167396	/nfs/dbraw/zinc/16/73/96/262167396.db2.gz	XTDLYNMHFZHIRA-UHFFFAOYSA-N	0	0	286.375	4.056	20	30		CIEDRN
CC(C)(CCC#N)CNc1cccc(-c2cnco2)c1	ZINC000119714742	262170575	/nfs/dbraw/zinc/17/05/75/262170575.db2.gz	KGGRNYQUGJGNBJ-UHFFFAOYSA-N	0	0	269.348	4.083	20	30		CIEDRN
CCCc1cccc(C(C)C)c1NC(=O)N(C)CCC#N	ZINC000189960054	262177486	/nfs/dbraw/zinc/17/74/86/262177486.db2.gz	ZXZIUFIFXHRZLV-UHFFFAOYSA-N	0	0	287.407	4.140	20	30		CIEDRN
CCCCCCCC(=O)Nc1ccccc1CCOC	ZINC000189986321	262178209	/nfs/dbraw/zinc/17/82/09/262178209.db2.gz	AQANINDSXMXJRE-UHFFFAOYSA-N	0	0	277.408	4.175	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@@H](CC(C)C)c1ccccc1C	ZINC000497635359	262184328	/nfs/dbraw/zinc/18/43/28/262184328.db2.gz	ZRDZNZFEMFZNMF-KRWDZBQOSA-N	0	0	288.435	4.300	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@H](CC(C)C)c1ccccc1C	ZINC000497635360	262184406	/nfs/dbraw/zinc/18/44/06/262184406.db2.gz	ZRDZNZFEMFZNMF-QGZVFWFLSA-N	0	0	288.435	4.300	20	30		CIEDRN
C=CCCCC(=O)Nc1cccc(O[C@H](C)CC)c1	ZINC000497657786	262185531	/nfs/dbraw/zinc/18/55/31/262185531.db2.gz	RSULCPAKXOIKRB-CYBMUJFWSA-N	0	0	261.365	4.159	20	30		CIEDRN
CCCCc1nc(CSCCCC#N)cs1	ZINC000190922742	262187249	/nfs/dbraw/zinc/18/72/49/262187249.db2.gz	PYUKYJXMVZSWPQ-UHFFFAOYSA-N	0	0	254.424	4.023	20	30		CIEDRN
CC[C@@H](C)CC(=O)Nc1ccccc1S[C@@H](C)CC#N	ZINC000191527783	262192992	/nfs/dbraw/zinc/19/29/92/262192992.db2.gz	JRSBEXPKKKFVDH-OLZOCXBDSA-N	0	0	290.432	4.456	20	30		CIEDRN
CN(Cc1cccc(C#N)c1)C(=O)C[C@H]1CCCCC1(C)C	ZINC000502279911	262203300	/nfs/dbraw/zinc/20/33/00/262203300.db2.gz	HLJUYNDCVRULAU-QGZVFWFLSA-N	0	0	298.430	4.123	20	30		CIEDRN
N#Cc1cccc(CNc2ccc(N3CCCCC3)cc2)c1	ZINC000120553955	262205062	/nfs/dbraw/zinc/20/50/62/262205062.db2.gz	VSTAJRQQOQLDTE-UHFFFAOYSA-N	0	0	291.398	4.161	20	30		CIEDRN
Cc1nc(Oc2ccc(Cl)cc2Cl)ccc1C#N	ZINC000311220230	262212092	/nfs/dbraw/zinc/21/20/92/262212092.db2.gz	UKXXDLDPWUYUPR-UHFFFAOYSA-N	0	0	279.126	4.361	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)c1cc(C)c(CC)s1	ZINC000497822381	262213911	/nfs/dbraw/zinc/21/39/11/262213911.db2.gz	RDWAKNFJBWWOON-UHFFFAOYSA-N	0	0	299.439	4.447	20	30		CIEDRN
C[C@H](OC(=O)C(C)(C)C#N)c1ccc(Cl)cc1Cl	ZINC000193461468	262222660	/nfs/dbraw/zinc/22/26/60/262222660.db2.gz	RAEDBDMAEKHTTH-QMMMGPOBSA-N	0	0	286.158	4.147	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@@H](c3ccccc3)[C@@H](C)C2)CCC1	ZINC000188165762	262226861	/nfs/dbraw/zinc/22/68/61/262226861.db2.gz	IXSBSVCNLWQAEY-FUHWJXTLSA-N	0	0	297.442	4.385	20	30		CIEDRN
CCCC[C@H](C)C(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1	ZINC000502994086	262235640	/nfs/dbraw/zinc/23/56/40/262235640.db2.gz	AAAKUXCUHGKIBU-JQHSSLGASA-N	0	0	298.430	4.111	20	30		CIEDRN
Cc1c(N[C@@H](C)c2cccc(C#N)c2)cnn1C1CCCC1	ZINC000194631967	262240365	/nfs/dbraw/zinc/24/03/65/262240365.db2.gz	SODLEHXEJOIJLN-ZDUSSCGKSA-N	0	0	294.402	4.351	20	30		CIEDRN
CCCCN(C(=O)c1sccc1C#N)C1CCCCC1	ZINC000497981695	262242778	/nfs/dbraw/zinc/24/27/78/262242778.db2.gz	JFLOFTJVWUDVQJ-UHFFFAOYSA-N	0	0	290.432	4.195	20	30		CIEDRN
Cc1cc(OCc2cccc(C#N)c2)ccc1Cl	ZINC000020551466	262249947	/nfs/dbraw/zinc/24/99/47/262249947.db2.gz	XHPDLMPGCFXJND-UHFFFAOYSA-N	0	0	257.720	4.099	20	30		CIEDRN
C=CCN(CC=C)C(=O)c1ccc(Cl)cc1SCC	ZINC000463254610	262294579	/nfs/dbraw/zinc/29/45/79/262294579.db2.gz	FMTBCRGGAOUXFZ-UHFFFAOYSA-N	0	0	295.835	4.266	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1C[C@@H](c2ccc(F)cc2)C[C@@H]1C	ZINC000188434285	262296304	/nfs/dbraw/zinc/29/63/04/262296304.db2.gz	NTXCCYXVYGFTSW-DHSIGJKJSA-N	0	0	289.394	4.132	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1C[C@H](c2ccccc2C)C[C@@H]1C	ZINC000188434651	262296345	/nfs/dbraw/zinc/29/63/45/262296345.db2.gz	BKCNCMGWIUFQEM-FRQCXROJSA-N	0	0	285.431	4.302	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](c2ccccc2)[C@H](C)C1	ZINC000188454569	262298158	/nfs/dbraw/zinc/29/81/58/262298158.db2.gz	CBDLIIGXLDEFBR-SZVBFZGTSA-N	0	0	285.431	4.241	20	30		CIEDRN
N#CCCCCSCc1cc(Cl)c2c(c1)OCCO2	ZINC000161136249	262310963	/nfs/dbraw/zinc/31/09/63/262310963.db2.gz	LQJHBQLEYCCPMW-UHFFFAOYSA-N	0	0	297.807	4.038	20	30		CIEDRN
C=CCC[C@H](C(=O)N1CCC2(CCC2)C1)c1ccccc1	ZINC000188547252	262314372	/nfs/dbraw/zinc/31/43/72/262314372.db2.gz	RCNUFHDOUPRCSD-KRWDZBQOSA-N	0	0	283.415	4.139	20	30		CIEDRN
CC(C)(C)C[C@H]1CCC[N@@H+]1Cc1ccc(C#N)cc1F	ZINC000488410258	262316936	/nfs/dbraw/zinc/31/69/36/262316936.db2.gz	JRPOELWMMSKKJH-OAHLLOKOSA-N	0	0	274.383	4.098	20	30		CIEDRN
CC#CCCCC(=O)N1CCCC2(CCCCC2)CC1	ZINC000188591754	262321770	/nfs/dbraw/zinc/32/17/70/262321770.db2.gz	LFTXAKREUKBTOC-UHFFFAOYSA-N	0	0	275.436	4.143	20	30		CIEDRN
C=CCN(CC=C)C(=O)c1ccc(C2=CCCC2)cc1	ZINC000354904275	262325561	/nfs/dbraw/zinc/32/55/61/262325561.db2.gz	SDWZOGGKMGYRIY-UHFFFAOYSA-N	0	0	267.372	4.068	20	30		CIEDRN
Cc1ccc2ccnc(NCC(C)(C)CCC#N)c2c1	ZINC000521430594	262333540	/nfs/dbraw/zinc/33/35/40/262333540.db2.gz	UBWOOJKFJVHFHS-UHFFFAOYSA-N	0	0	267.376	4.285	20	30		CIEDRN
C=CCCCSCC(=O)N[C@H](C)c1ccc(C)c(C)c1	ZINC000522758420	262339177	/nfs/dbraw/zinc/33/91/77/262339177.db2.gz	XFHUQIYVOPIZRU-OAHLLOKOSA-N	0	0	291.460	4.180	20	30		CIEDRN
CCCC(CCC)C(=O)Nc1ccc(C#N)cc1Cl	ZINC000228999627	262343458	/nfs/dbraw/zinc/34/34/58/262343458.db2.gz	FWEWMJSVZGEFBI-UHFFFAOYSA-N	0	0	278.783	4.367	20	30		CIEDRN
N#Cc1ccc(Cl)cc1N[C@@H]1CCOC2(CCCC2)C1	ZINC000094373970	262349695	/nfs/dbraw/zinc/34/96/95/262349695.db2.gz	CUOHYSJRVWYRCC-CQSZACIVSA-N	0	0	290.794	4.115	20	30		CIEDRN
COc1cc(CNc2cccc3c2CCCC3)ccc1C#N	ZINC000319959188	262380295	/nfs/dbraw/zinc/38/02/95/262380295.db2.gz	QANLXEBNFWBINJ-UHFFFAOYSA-N	0	0	292.382	4.058	20	30		CIEDRN
CCc1ccc(NC(=O)[C@H](C)c2cccc(C#N)c2)cc1F	ZINC000462240333	262380360	/nfs/dbraw/zinc/38/03/60/262380360.db2.gz	WPCJAWZGYZQJKY-GFCCVEGCSA-N	0	0	296.345	4.002	20	30		CIEDRN
C=CCOc1ccc(CNc2cc(C)ccc2OC)cc1	ZINC000021513122	262388258	/nfs/dbraw/zinc/38/82/58/262388258.db2.gz	WXFOAOWWKDXMKF-UHFFFAOYSA-N	0	0	283.371	4.181	20	30		CIEDRN
C=CCNC(=O)N(Cc1ccccc1)[C@@H](C)c1ccccc1	ZINC000461114838	262392945	/nfs/dbraw/zinc/39/29/45/262392945.db2.gz	RACZMGBIHZBPPI-INIZCTEOSA-N	0	0	294.398	4.145	20	30		CIEDRN
N#Cc1c(F)cccc1N[C@H]1CCCc2sccc21	ZINC000061325876	262394383	/nfs/dbraw/zinc/39/43/83/262394383.db2.gz	GJHJLCCQYSKYOC-ZDUSSCGKSA-N	0	0	272.348	4.248	20	30		CIEDRN
CSc1ccccc1NCc1ccc(F)c(C#N)c1	ZINC000123731067	262512895	/nfs/dbraw/zinc/51/28/95/262512895.db2.gz	UBCSZSJDLCBAFI-UHFFFAOYSA-N	0	0	272.348	4.031	20	30		CIEDRN
Cc1ccc2cc(CNc3cccc(C#N)c3)ccc2n1	ZINC000097861254	262572038	/nfs/dbraw/zinc/57/20/38/262572038.db2.gz	PFOYESDMENSRIM-UHFFFAOYSA-N	0	0	273.339	4.027	20	30		CIEDRN
CC[C@H](CC(C)C)C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000410605185	262632397	/nfs/dbraw/zinc/63/23/97/262632397.db2.gz	WIKYGPGMSAUCKC-NVXWUHKLSA-N	0	0	286.419	4.220	20	30		CIEDRN
CC(C)[C@@]1(C)C[C@@H]1C(=O)Nc1ccc(Cl)cc1CC#N	ZINC000410964290	262673956	/nfs/dbraw/zinc/67/39/56/262673956.db2.gz	HPAHQHOESBSLPV-CZUORRHYSA-N	0	0	290.794	4.027	20	30		CIEDRN
CC[C@@H](C)[C@@H](C)C(=O)Nc1ccc(Cl)cc1CC#N	ZINC000410961741	262674332	/nfs/dbraw/zinc/67/43/32/262674332.db2.gz	BECDQLCMCNFKMV-GHMZBOCLSA-N	0	0	278.783	4.027	20	30		CIEDRN
C=CCCC(=O)Nc1sc2c(c1C#N)[C@@H](C)C[C@@H](C)C2	ZINC000411023030	262675685	/nfs/dbraw/zinc/67/56/85/262675685.db2.gz	YGRVMSVYXNFYBE-MNOVXSKESA-N	0	0	288.416	4.210	20	30		CIEDRN
C=C[C@@H](CC(=O)N1[C@@H](C)CCC1(C)C)c1ccccc1	ZINC000411094357	262678952	/nfs/dbraw/zinc/67/89/52/262678952.db2.gz	XGLDEMRXUJTZJB-GJZGRUSLSA-N	0	0	271.404	4.136	20	30		CIEDRN
N#CC1(CCSCc2cccnc2)CCCCC1	ZINC000413001242	262751582	/nfs/dbraw/zinc/75/15/82/262751582.db2.gz	KQHLKJARRNWTAM-UHFFFAOYSA-N	0	0	260.406	4.179	20	30		CIEDRN
CC(C)CN(C(=O)c1ccc(CC#N)cc1)c1ccccc1	ZINC000270356599	262987064	/nfs/dbraw/zinc/98/70/64/262987064.db2.gz	QCYTYGADWXVLHI-UHFFFAOYSA-N	0	0	292.382	4.055	20	30		CIEDRN
CC(C)CCN(C(=O)c1ccc(CC#N)cc1)C1CCCC1	ZINC000270361869	262987199	/nfs/dbraw/zinc/98/71/99/262987199.db2.gz	RRPQDLIDNKSUMT-UHFFFAOYSA-N	0	0	298.430	4.184	20	30		CIEDRN
C[C@H](C#N)Oc1ccccc1NCCCCC(F)(F)F	ZINC000272437033	263004372	/nfs/dbraw/zinc/00/43/72/263004372.db2.gz	KMWJNQLOUPUHLU-LLVKDONJSA-N	0	0	286.297	4.122	20	30		CIEDRN
CC(C)(C)[C@@](C)(C#N)NC(=O)c1cccc(Cl)c1Cl	ZINC000272450511	263004602	/nfs/dbraw/zinc/00/46/02/263004602.db2.gz	VYQOUOAAFIZLTH-CQSZACIVSA-N	0	0	299.201	4.052	20	30		CIEDRN
Cc1cc(CNc2ccccc2O[C@H](C)C#N)c(C)s1	ZINC000272533532	263005960	/nfs/dbraw/zinc/00/59/60/263005960.db2.gz	KJKQUFIPLAGMOC-LLVKDONJSA-N	0	0	286.400	4.268	20	30		CIEDRN
CCCC[C@H](ON=C(C)C)C(=O)Nc1c(C)cccc1C	ZINC000272641598	263007937	/nfs/dbraw/zinc/00/79/37/263007937.db2.gz	XSVCPSSEDCFTMQ-HNNXBMFYSA-N	0	0	290.407	4.213	20	30		CIEDRN
Cc1cc(NC(=O)C2(C#N)CCC2)ccc1-c1ccccc1	ZINC000273943918	263020542	/nfs/dbraw/zinc/02/05/42/263020542.db2.gz	TWKTZRIBQVENCX-UHFFFAOYSA-N	0	0	290.366	4.294	20	30		CIEDRN
CC(C)(C)CN(CCC#N)Cc1cc2cc(F)ccc2o1	ZINC000353418546	263022989	/nfs/dbraw/zinc/02/29/89/263022989.db2.gz	FWARBSIJAZUOJU-UHFFFAOYSA-N	0	0	288.366	4.334	20	30		CIEDRN
C[C@H](CCC(=O)N[C@@](C)(C#N)C(C)(C)C)c1ccccc1	ZINC000274321111	263023179	/nfs/dbraw/zinc/02/31/79/263023179.db2.gz	KIRYNUPAFZPTSH-KDOFPFPSSA-N	0	0	286.419	4.015	20	30		CIEDRN
Cc1nc2ccccc2nc1CSCCC(C)(C)C#N	ZINC000276568485	263037331	/nfs/dbraw/zinc/03/73/31/263037331.db2.gz	DNYUYSYJDSWNHL-UHFFFAOYSA-N	0	0	285.416	4.111	20	30		CIEDRN
N#CCCCSCc1cc(Cl)cc2cccnc21	ZINC000276564231	263037356	/nfs/dbraw/zinc/03/73/56/263037356.db2.gz	CVWYHDQGXPRZTB-UHFFFAOYSA-N	0	0	276.792	4.425	20	30		CIEDRN
COCc1cccc(CSCCC(C)(C)C#N)c1	ZINC000276627793	263037620	/nfs/dbraw/zinc/03/76/20/263037620.db2.gz	PKDDDLIMYVGVEW-UHFFFAOYSA-N	0	0	263.406	4.006	20	30		CIEDRN
C[C@H](SCCC(C)(C)C#N)c1ccc(C#N)cc1	ZINC000276660472	263037759	/nfs/dbraw/zinc/03/77/59/263037759.db2.gz	WTKCTZUBXHRKQW-LBPRGKRZSA-N	0	0	258.390	4.292	20	30		CIEDRN
CCCCCCC[C@H](CC(=O)[O-])[NH2+]Cc1ccc(C)s1	ZINC000277235188	263040505	/nfs/dbraw/zinc/04/05/05/263040505.db2.gz	IUSQFGWYIVOUAF-CQSZACIVSA-N	0	0	297.464	4.350	20	30		CIEDRN
Cc1csc(C(=O)N(CCC#N)CC(C)(C)C)c1Cl	ZINC000277376599	263040953	/nfs/dbraw/zinc/04/09/53/263040953.db2.gz	ZZXYMCZWUSYCMU-UHFFFAOYSA-N	0	0	298.839	4.112	20	30		CIEDRN
CCCCCCC[C@H](CC(=O)[O-])[NH2+]Cc1ccc(C)cc1	ZINC000277451013	263041265	/nfs/dbraw/zinc/04/12/65/263041265.db2.gz	VBCCYSQVLSJWID-QGZVFWFLSA-N	0	0	291.435	4.288	20	30		CIEDRN
CC(C)(C#N)CC(=O)Nc1ccc2nc(C3CC3)sc2c1	ZINC000278268507	263046224	/nfs/dbraw/zinc/04/62/24/263046224.db2.gz	OQXSACFOOFADGU-UHFFFAOYSA-N	0	0	299.399	4.052	20	30		CIEDRN
CC(C)(C#N)CC(=O)Nc1ccc2c(c1)Cc1ccccc1-2	ZINC000278262843	263046316	/nfs/dbraw/zinc/04/63/16/263046316.db2.gz	NZURITDADBQUIN-UHFFFAOYSA-N	0	0	290.366	4.136	20	30		CIEDRN
C[C@H](c1ccccc1F)[S@](=O)CCCCC(C)(C)C#N	ZINC000278365926	263047318	/nfs/dbraw/zinc/04/73/18/263047318.db2.gz	XMQREEUEIMKHJT-ZUOKHONESA-N	0	0	295.423	4.355	20	30		CIEDRN
CSc1ccc(C)c(N[C@@H]2CCC[C@H](C#N)C2)c1	ZINC000278369486	263047569	/nfs/dbraw/zinc/04/75/69/263047569.db2.gz	CDMTVTWLHKSRJB-QWHCGFSZSA-N	0	0	260.406	4.211	20	30		CIEDRN
N#C[C@H]1CC[C@@H](Sc2nc3ccccc3n2C(F)F)C1	ZINC000278489956	263048405	/nfs/dbraw/zinc/04/84/05/263048405.db2.gz	BBCFLJLKRWKOTA-VHSXEESVSA-N	0	0	293.342	4.216	20	30		CIEDRN
N#C[C@H]1CC[C@@H](Sc2nc3cc(Cl)ccc3[nH]2)C1	ZINC000278665140	263049679	/nfs/dbraw/zinc/04/96/79/263049679.db2.gz	XJIWLDQSNYDQNB-WCBMZHEXSA-N	0	0	277.780	4.001	20	30		CIEDRN
CSc1cccc(N[C@H]2CCC[C@H](C#N)C2)c1C	ZINC000278776421	263050857	/nfs/dbraw/zinc/05/08/57/263050857.db2.gz	PNJGBQWFVDRBMX-STQMWFEESA-N	0	0	260.406	4.211	20	30		CIEDRN
C[C@H](C[S@](=O)CCCCC(C)(C)C#N)c1ccccc1	ZINC000280072534	263059072	/nfs/dbraw/zinc/05/90/72/263059072.db2.gz	USDPNFNEDKIXLC-FOIQADDNSA-N	0	0	291.460	4.259	20	30		CIEDRN
CC1CCC(N(C)C(=O)c2ccc(C(C)(C)C#N)cc2)CC1	ZINC000280431325	263061669	/nfs/dbraw/zinc/06/16/69/263061669.db2.gz	ZSMLBKVSLHFDQO-UHFFFAOYSA-N	0	0	298.430	4.138	20	30		CIEDRN
C[C@H]1CCC[C@@H](N(C)C(=O)c2ccc(C(C)(C)C#N)cc2)C1	ZINC000280858251	263064836	/nfs/dbraw/zinc/06/48/36/263064836.db2.gz	LVVPKKNJVIQQBE-WMLDXEAASA-N	0	0	298.430	4.138	20	30		CIEDRN
Cc1ccccc1SCCCC1(C#N)CCOCC1	ZINC000281009822	263065678	/nfs/dbraw/zinc/06/56/78/263065678.db2.gz	ONJPUGWSIYTDMB-UHFFFAOYSA-N	0	0	275.417	4.188	20	30		CIEDRN
CCCc1occc1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000281176580	263067010	/nfs/dbraw/zinc/06/70/10/263067010.db2.gz	LNYDPDZVAUYRBJ-UHFFFAOYSA-N	0	0	296.370	4.286	20	30		CIEDRN
Cc1ccc(-c2ccnn2C)cc1NCCCC(C)(C)C#N	ZINC000281174467	263067117	/nfs/dbraw/zinc/06/71/17/263067117.db2.gz	LJOQDWIREQLGHE-UHFFFAOYSA-N	0	0	296.418	4.137	20	30		CIEDRN
CC(C)(C#N)CCOc1ccc(Oc2nccs2)cc1	ZINC000281789790	263071844	/nfs/dbraw/zinc/07/18/44/263071844.db2.gz	FJPHJNNHFZMVCP-UHFFFAOYSA-N	0	0	288.372	4.254	20	30		CIEDRN
CC(C)(CCC#N)CNc1ccc(OC(F)F)cc1F	ZINC000282910507	263079548	/nfs/dbraw/zinc/07/95/48/263079548.db2.gz	GIRIYPUNGPMZSN-UHFFFAOYSA-N	0	0	286.297	4.169	20	30		CIEDRN
Cc1ccc(-c2csc(CON=C3CCC3)n2)cc1	ZINC000285224902	263091453	/nfs/dbraw/zinc/09/14/53/263091453.db2.gz	QHHGTQOMWOQUDA-UHFFFAOYSA-N	0	0	272.373	4.175	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)N[C@@H](C)c1cccc(Cl)c1Cl	ZINC000285451873	263092959	/nfs/dbraw/zinc/09/29/59/263092959.db2.gz	JAKNUVPWMYNHFB-XPTSAGLGSA-N	0	0	299.201	4.110	20	30		CIEDRN
Cc1ccnc([C@H](C)N[C@@H](CCC#N)c2ccccc2)c1	ZINC000286172480	263097457	/nfs/dbraw/zinc/09/74/57/263097457.db2.gz	PXGKCPUBJWCELE-RDJZCZTQSA-N	0	0	279.387	4.086	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)N[C@H](C)c1cc(Cl)ccc1Cl	ZINC000286667704	263099245	/nfs/dbraw/zinc/09/92/45/263099245.db2.gz	DBWMUUCYFWBNQC-OTYXRUKQSA-N	0	0	299.201	4.110	20	30		CIEDRN
CC[C@](C)(C#N)c1nc(-c2ccc3[nH]c(C)c(C)c3c2)no1	ZINC000288956954	263106664	/nfs/dbraw/zinc/10/66/64/263106664.db2.gz	PIKDDBDCTCEEIV-QGZVFWFLSA-N	0	0	294.358	4.026	20	30		CIEDRN
CC(C)(C#N)CCSCc1cccc2cccnc21	ZINC000289422141	263110087	/nfs/dbraw/zinc/11/00/87/263110087.db2.gz	PXMLUXVXEUMNMF-UHFFFAOYSA-N	0	0	270.401	4.408	20	30		CIEDRN
Cc1ccc(N(Cc2ccco2)C(=O)CCCC#N)cc1C	ZINC000291183229	263120736	/nfs/dbraw/zinc/12/07/36/263120736.db2.gz	IAKWGVYCQGNRNE-UHFFFAOYSA-N	0	0	296.370	4.124	20	30		CIEDRN
CC(C)Sc1ccc(Cl)cc1NC(=O)CCCC#N	ZINC000291890814	263126344	/nfs/dbraw/zinc/12/63/44/263126344.db2.gz	WHJSBHAEWMGKIH-UHFFFAOYSA-N	0	0	296.823	4.473	20	30		CIEDRN
N#CCCCC(=O)N1CCC[C@H]1c1cccc2ccccc21	ZINC000292321040	263131014	/nfs/dbraw/zinc/13/10/14/263131014.db2.gz	NUIRRCWKVIFSLC-SFHVURJKSA-N	0	0	292.382	4.197	20	30		CIEDRN
C=CCN(CCC#N)Cc1cnc(-c2ccc(C)cc2)s1	ZINC000292826278	263135531	/nfs/dbraw/zinc/13/55/31/263135531.db2.gz	QPFCCYPJSGOANI-UHFFFAOYSA-N	0	0	297.427	4.020	20	30		CIEDRN
C=C(C)CCNC(=O)CCCCCO[C@@H]1CCC[C@H](C)C1	ZINC000452718758	263135899	/nfs/dbraw/zinc/13/58/99/263135899.db2.gz	QWHIZSHIEBEOEA-DLBZAZTESA-N	0	0	295.467	4.225	20	30		CIEDRN
N#C[C@H]1CC[C@@H](Sc2nc3cc(Cl)ccc3o2)C1	ZINC000295023412	263171209	/nfs/dbraw/zinc/17/12/09/263171209.db2.gz	USCXBYSLPGDGON-WCBMZHEXSA-N	0	0	278.764	4.266	20	30		CIEDRN
Cc1nocc1/C=C1\C(=O)c2ccccc2[C@@H]1C(C)C	ZINC000295977565	263184198	/nfs/dbraw/zinc/18/41/98/263184198.db2.gz	QTYFGIFZDHIKHS-YMDFIQGPSA-N	0	0	267.328	4.003	20	30		CIEDRN
CC(C)(C#N)c1nc(C2CCC(c3ccccc3)CC2)no1	ZINC000296225013	263187754	/nfs/dbraw/zinc/18/77/54/263187754.db2.gz	AEFNKJFAZWZFBA-UHFFFAOYSA-N	0	0	295.386	4.312	20	30		CIEDRN
Cc1cc2ccccc2c(NC(=O)C2(C#N)CCCC2)c1	ZINC000297732087	263208703	/nfs/dbraw/zinc/20/87/03/263208703.db2.gz	MMUBVQZFVLUFHP-UHFFFAOYSA-N	0	0	278.355	4.171	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)Nc1cc(C)cc2ccccc21	ZINC000297833631	263210362	/nfs/dbraw/zinc/21/03/62/263210362.db2.gz	VYJFXHNNZGTUIQ-QGZVFWFLSA-N	0	0	266.344	4.027	20	30		CIEDRN
CC[C@H]([NH2+][C@@H](C)CCC#N)c1ccc(Cl)s1	ZINC000299008356	263228931	/nfs/dbraw/zinc/22/89/31/263228931.db2.gz	QSPMUFKMCPEYKL-UWVGGRQHSA-N	0	0	256.802	4.134	20	30		CIEDRN
CCN(Cc1ccc2ccccc2c1)C[C@H](C#N)CCC#N	ZINC000299166997	263232412	/nfs/dbraw/zinc/23/24/12/263232412.db2.gz	PEXYTVBUFSDEIP-KRWDZBQOSA-N	0	0	291.398	4.105	20	30		CIEDRN
C[C@H](c1cccc(C(F)(F)F)c1)[N@H+](C)CCCC#N	ZINC000299340042	263240298	/nfs/dbraw/zinc/24/02/98/263240298.db2.gz	DTQJNELBLVBHRT-LLVKDONJSA-N	0	0	270.298	4.002	20	30		CIEDRN
CCCCCCCCC(=O)N(C)[C@@H](C)c1ccccn1	ZINC000299365224	263241082	/nfs/dbraw/zinc/24/10/82/263241082.db2.gz	CUCXRWNGVBUAAA-HNNXBMFYSA-N	0	0	276.424	4.352	20	30		CIEDRN
CC(F)(F)c1cccc(NCc2cccc(C#N)c2)c1	ZINC000187573793	263262103	/nfs/dbraw/zinc/26/21/03/263262103.db2.gz	FWTRMBKHKNVSKE-UHFFFAOYSA-N	0	0	272.298	4.282	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)NC[C@H](c1ccccc1)C(C)C	ZINC000467518319	263262168	/nfs/dbraw/zinc/26/21/68/263262168.db2.gz	KZZMADBSZSFEGV-WMZOPIPTSA-N	0	0	273.420	4.145	20	30		CIEDRN
C#CCCCCC(=O)N(C)[C@H](C)c1ccccc1Cl	ZINC000119567056	263275445	/nfs/dbraw/zinc/27/54/45/263275445.db2.gz	FXLOVZRNGVKOBS-CYBMUJFWSA-N	0	0	277.795	4.053	20	30		CIEDRN
C#CCCCCC(=O)N(Cc1ccc([C@H]2C[C@@H]2C)o1)C1CC1	ZINC000119590040	263276263	/nfs/dbraw/zinc/27/62/63/263276263.db2.gz	ALWQUHRQSNQTQD-YOEHRIQHSA-N	0	0	299.414	4.088	20	30		CIEDRN
Cc1cc(N[C@@H](CCC#N)c2ccccc2)nc(C(C)C)n1	ZINC000164307860	263277031	/nfs/dbraw/zinc/27/70/31/263277031.db2.gz	JZTKABSDMTXZMH-INIZCTEOSA-N	0	0	294.402	4.365	20	30		CIEDRN
N#CCC[C@@H](Nc1ccccc1[N+](=O)[O-])c1ccccc1	ZINC000164352501	263288929	/nfs/dbraw/zinc/28/89/29/263288929.db2.gz	VQUBOIGZEMZUJJ-CQSZACIVSA-N	0	0	281.315	4.052	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@@H]1c1ccc(F)cc1	ZINC000121764223	263298121	/nfs/dbraw/zinc/29/81/21/263298121.db2.gz	BEMHTUDKXVVFPX-QGZVFWFLSA-N	0	0	287.378	4.258	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@H]1c1ccc(F)cc1	ZINC000121764333	263298153	/nfs/dbraw/zinc/29/81/53/263298153.db2.gz	BEMHTUDKXVVFPX-KRWDZBQOSA-N	0	0	287.378	4.258	20	30		CIEDRN
C=CCC(F)(F)c1nc([C@@H]2C[C@@H]2c2ccccc2)no1	ZINC000340704705	263301243	/nfs/dbraw/zinc/30/12/43/263301243.db2.gz	PDLZSVZJRFQTBT-VXGBXAGGSA-N	0	0	276.286	4.009	20	30		CIEDRN
CC(C)(CCC#N)CNc1cc(C#N)ccc1C(F)(F)F	ZINC000340946084	263313115	/nfs/dbraw/zinc/31/31/15/263313115.db2.gz	ZECRRSKAPIPBGJ-UHFFFAOYSA-N	0	0	295.308	4.319	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1ccc2nc(C)sc2c1	ZINC000341431086	263337821	/nfs/dbraw/zinc/33/78/21/263337821.db2.gz	JXBZOTMANNXNHD-NSHDSACASA-N	0	0	289.404	4.081	20	30		CIEDRN
CC[C@@H](c1ccccc1)[S@](=O)Cc1ccc(CC#N)cc1	ZINC000342142184	263398553	/nfs/dbraw/zinc/39/85/53/263398553.db2.gz	SFTXXBVICPXWCM-GHTZIAJQSA-N	0	0	297.423	4.153	20	30		CIEDRN
CO[C@@H](C)c1cccc(NCc2ccc(CC#N)cc2)c1	ZINC000342440648	263434641	/nfs/dbraw/zinc/43/46/41/263434641.db2.gz	RPFMTJRCIDWSLJ-AWEZNQCLSA-N	0	0	280.371	4.072	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)c2sccc2Cl)s1	ZINC000334222264	263495184	/nfs/dbraw/zinc/49/51/84/263495184.db2.gz	VFDWLVGKMINCMZ-UHFFFAOYSA-N	0	0	296.804	4.149	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(Cc1ccco1)Cc1ccco1	ZINC000122598315	263803813	/nfs/dbraw/zinc/80/38/13/263803813.db2.gz	LEYXHKWOKPMFDA-UHFFFAOYSA-N	0	0	299.370	4.170	20	30		CIEDRN
Cc1cccc([C@@H](Nc2ccc(C#N)cc2)c2ccccn2)c1	ZINC000123114495	263808120	/nfs/dbraw/zinc/80/81/20/263808120.db2.gz	VXGVOOWHOIQENS-HXUWFJFHSA-N	0	0	299.377	4.463	20	30		CIEDRN
C[C@]1(C(=O)NCc2ccc3ccccc3c2)CCC(=O)NC1	ZINC000328644303	263831429	/nfs/dbraw/zinc/83/14/29/263831429.db2.gz	AOLPBMUVSHNJAD-SFHVURJKSA-N	0	0	296.370	4.053	20	30		CIEDRN
O=C(Nc1c[nH]nc1-c1ccccc1F)[C@H]1CC12CCCC2	ZINC000328661993	263834611	/nfs/dbraw/zinc/83/46/11/263834611.db2.gz	ANSCYIVAPDMBJZ-GFCCVEGCSA-N	0	0	299.349	4.384	20	30		CIEDRN
CC(=O)c1c(C)[nH]c(C(=O)NC[C@@H](C)C(C)C)c1C(C)C	ZINC000330386579	263924303	/nfs/dbraw/zinc/92/43/03/263924303.db2.gz	AKDXSZUKVNMLKQ-LLVKDONJSA-N	0	0	292.423	4.246	20	30		CIEDRN
CC(=O)c1c(C)[nH]c(C(=O)NCC2CCCC2)c1C(C)C	ZINC000330395850	263927667	/nfs/dbraw/zinc/92/76/67/263927667.db2.gz	NNXLUYCIPITBCC-UHFFFAOYSA-N	0	0	290.407	4.144	20	30		CIEDRN
CC[C@@H](NC(=O)c1[nH]c(C)c(C(C)=O)c1C(C)C)C(C)C	ZINC000330398883	263928552	/nfs/dbraw/zinc/92/85/52/263928552.db2.gz	QTNHNEOFKHOKFT-CYBMUJFWSA-N	0	0	292.423	4.388	20	30		CIEDRN
CC(C)c1ncncc1C(=O)NCCCC1CCCCC1	ZINC000330513694	263957148	/nfs/dbraw/zinc/95/71/48/263957148.db2.gz	GQUZLZJSXYEMKC-UHFFFAOYSA-N	0	0	289.423	4.265	20	30		CIEDRN
CCc1nc(C)c(NC(=O)c2ccoc2C(C)C)s1	ZINC000330525421	263966973	/nfs/dbraw/zinc/96/69/73/263966973.db2.gz	JRPDPCWHXPPZSG-UHFFFAOYSA-N	0	0	278.377	4.367	20	30		CIEDRN
Cc1nc(C(=O)NCC[C@H](C)CC(C)(C)C)c(C)o1	ZINC000330564944	263975382	/nfs/dbraw/zinc/97/53/82/263975382.db2.gz	FPSKEEPSDCNOPV-JTQLQIEISA-N	0	0	266.385	4.058	20	30		CIEDRN
CC[C@@H](NC(=O)c1cnc2onc(C(C)C)c2c1)C(C)C	ZINC000330584610	263981186	/nfs/dbraw/zinc/98/11/86/263981186.db2.gz	UEYLFBVOAAQADS-CYBMUJFWSA-N	0	0	289.379	4.085	20	30		CIEDRN
Cc1cnc([C@@H](C)NC(=O)c2ccccc2C(C)(C)C)o1	ZINC000330694065	264004636	/nfs/dbraw/zinc/00/46/36/264004636.db2.gz	CRERTUZGPKYIDO-GFCCVEGCSA-N	0	0	286.375	4.346	20	30		CIEDRN
Cc1cnc([C@H](C)NC(=O)c2ccccc2C(C)(C)C)o1	ZINC000330694067	264004782	/nfs/dbraw/zinc/00/47/82/264004782.db2.gz	CRERTUZGPKYIDO-LBPRGKRZSA-N	0	0	286.375	4.346	20	30		CIEDRN
C[C@H]1CC[C@H](NC(=O)Nc2ccc(C(C)(C)C#N)cc2)CC1	ZINC000330711888	264021561	/nfs/dbraw/zinc/02/15/61/264021561.db2.gz	VMCDIMNELHXQNY-CTYIDZIISA-N	0	0	299.418	4.392	20	30		CIEDRN
CC(C)C[C@](C)(C#N)NC(=O)c1ccc(Cl)cc1F	ZINC000330751272	264029355	/nfs/dbraw/zinc/02/93/55/264029355.db2.gz	BJZDDRQUWHLUSA-CQSZACIVSA-N	0	0	282.746	4.112	20	30		CIEDRN
Cc1cc(C(=O)NCCCC#N)c(C)n1C1CCCCC1	ZINC000330837982	264052036	/nfs/dbraw/zinc/05/20/36/264052036.db2.gz	UKCQZHDKYFPHHV-UHFFFAOYSA-N	0	0	287.407	4.219	20	30		CIEDRN
Cc1sc(NC(=O)CCC(C)(C)C)c(C#N)c1C	ZINC000330866940	264058045	/nfs/dbraw/zinc/05/80/45/264058045.db2.gz	SAFHUWYCSRBKSK-UHFFFAOYSA-N	0	0	264.394	4.001	20	30		CIEDRN
CCO[C@H](C)c1ncc(C(=O)N[C@@H]2CCCC[C@@H]2C)s1	ZINC000330902837	264072900	/nfs/dbraw/zinc/07/29/00/264072900.db2.gz	BTIAYXMGZBCAJM-QJPTWQEYSA-N	0	0	296.436	4.124	20	30		CIEDRN
CCC(C)(CC)NC(=O)c1ccc(Cl)c(N)c1Cl	ZINC000330988048	264104639	/nfs/dbraw/zinc/10/46/39/264104639.db2.gz	XNUGBMBMJGWMNJ-UHFFFAOYSA-N	0	0	289.206	4.459	20	30		CIEDRN
CCOc1c(Cl)cc(NC(=O)NC(C)C)cc1Cl	ZINC000331007440	264106168	/nfs/dbraw/zinc/10/61/68/264106168.db2.gz	TWBRRICRTASYES-UHFFFAOYSA-N	0	0	291.178	4.126	20	30		CIEDRN
Cc1cc(Cl)cc(C(=O)Nc2nnc(C(C)C)s2)c1	ZINC000331059620	264109985	/nfs/dbraw/zinc/10/99/85/264109985.db2.gz	SNOMKFZVRFFKOL-UHFFFAOYSA-N	0	0	295.795	4.260	20	30		CIEDRN
Cc1cc(NC(=O)c2cccn2C(C)C)cc(C)c1O	ZINC000331088859	264113290	/nfs/dbraw/zinc/11/32/90/264113290.db2.gz	UDYOUZXPWLDLLX-UHFFFAOYSA-N	0	0	272.348	4.028	20	30		CIEDRN
Cc1nc(CC(C)C)oc1C(=O)NCC1CCCCC1	ZINC000331078817	264115809	/nfs/dbraw/zinc/11/58/09/264115809.db2.gz	XWRXZSSSVKQGHX-UHFFFAOYSA-N	0	0	278.396	4.066	20	30		CIEDRN
CC1(C)CCCC[C@H]1NC(=O)C[C@H](CC#N)c1ccccc1	ZINC000331079137	264116068	/nfs/dbraw/zinc/11/60/68/264116068.db2.gz	XAGISQYZIOKAOG-DLBZAZTESA-N	0	0	298.430	4.159	20	30		CIEDRN
Cc1cc(C(=O)N[C@@H]2CCCC[C@H]2OCCC(C)C)co1	ZINC000331231928	264152905	/nfs/dbraw/zinc/15/29/05/264152905.db2.gz	FEYTWXZBTCXOFK-HZPDHXFCSA-N	0	0	293.407	4.267	20	30		CIEDRN
CCC(C)(C)CNC(=O)Nc1cc2[nH]ccc2cc1C	ZINC000331207397	264161986	/nfs/dbraw/zinc/16/19/86/264161986.db2.gz	YUILZDVAMFFANH-UHFFFAOYSA-N	0	0	273.380	4.238	20	30		CIEDRN
Cc1cc(C)c(NC(=O)NC(C)(C)c2ccccc2)c(C)n1	ZINC000331246294	264179575	/nfs/dbraw/zinc/17/95/75/264179575.db2.gz	UUAWIGLALWQTOX-UHFFFAOYSA-N	0	0	297.402	4.077	20	30		CIEDRN
Cc1cc2cc[nH]c2cc1NC(=O)NCC(C)(C)C(C)C	ZINC000331320040	264188606	/nfs/dbraw/zinc/18/86/06/264188606.db2.gz	ISMOSXXZGFVPJT-UHFFFAOYSA-N	0	0	287.407	4.484	20	30		CIEDRN
CC[C@@H](NC(=O)c1coc(C2CCCCC2)n1)C(F)F	ZINC000331318161	264188674	/nfs/dbraw/zinc/18/86/74/264188674.db2.gz	JVRIWWWKKGMFCU-SNVBAGLBSA-N	0	0	286.322	4.071	20	30		CIEDRN
Cc1cccc(OC(F)F)c1NC(=O)N[C@@H]1CC[C@@H](C)C1	ZINC000331288683	264196134	/nfs/dbraw/zinc/19/61/34/264196134.db2.gz	IOXRCVZLXGJKTM-MWLCHTKSSA-N	0	0	298.333	4.111	20	30		CIEDRN
C[C@]1(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CC=CCC1	ZINC000331352323	264206852	/nfs/dbraw/zinc/20/68/52/264206852.db2.gz	ONQZFWLVROHBRX-AWEZNQCLSA-N	0	0	294.738	4.052	20	30		CIEDRN
CCO[C@H](C)c1ncc(C(=O)N[C@@]2(C)CC=CCC2)s1	ZINC000331356052	264208568	/nfs/dbraw/zinc/20/85/68/264208568.db2.gz	RKOCCXGPADOYBU-ABAIWWIYSA-N	0	0	294.420	4.044	20	30		CIEDRN
C=C(C)[C@@H](NCc1cnccc1C)c1ccc(F)c(F)c1	ZINC000474929006	264240194	/nfs/dbraw/zinc/24/01/94/264240194.db2.gz	OAXMSVWFLZRUNM-QGZVFWFLSA-N	0	0	288.341	4.075	20	30		CIEDRN
Cc1ccc(C#N)c(N[C@@H](C)c2cc3ccccc3o2)n1	ZINC000160369259	264242448	/nfs/dbraw/zinc/24/24/48/264242448.db2.gz	AKKZOGNHKGRRJW-LBPRGKRZSA-N	0	0	277.327	4.181	20	30		CIEDRN
CC(C)(CNC(=O)Nc1ccc(CC#N)cc1)C1CCCC1	ZINC000160419768	264244466	/nfs/dbraw/zinc/24/44/66/264244466.db2.gz	LICZOZRAFYHDLH-UHFFFAOYSA-N	0	0	299.418	4.091	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1cccc(OC(C)C)c1	ZINC000424871677	264258622	/nfs/dbraw/zinc/25/86/22/264258622.db2.gz	WRUNQGNSKCXEFD-UHFFFAOYSA-N	0	0	261.365	4.015	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1cccc(Cl)c1F	ZINC000425397651	264276643	/nfs/dbraw/zinc/27/66/43/264276643.db2.gz	AXNDRCLSKYCSJU-UHFFFAOYSA-N	0	0	255.720	4.020	20	30		CIEDRN
C=CCC1(C(=O)N[C@H](C)c2ccc(C)c(F)c2)CCC1	ZINC000189233856	264278785	/nfs/dbraw/zinc/27/87/85/264278785.db2.gz	DMTNZNUUGGTFPA-CYBMUJFWSA-N	0	0	275.367	4.058	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000189405287	264299763	/nfs/dbraw/zinc/29/97/63/264299763.db2.gz	CLCAUDFAPLIHMV-LLVKDONJSA-N	0	0	267.319	4.339	20	30		CIEDRN
C=C(C)COc1cccc(NCc2c(C)nn(CC)c2C)c1	ZINC000129262819	264320014	/nfs/dbraw/zinc/32/00/14/264320014.db2.gz	LVYYNNJZAWKEOS-UHFFFAOYSA-N	0	0	299.418	4.087	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N1CCc2sccc2[C@H]1CC	ZINC000425437560	264320137	/nfs/dbraw/zinc/32/01/37/264320137.db2.gz	ZXIDJMQYVONKDB-CYBMUJFWSA-N	0	0	277.433	4.186	20	30		CIEDRN
COc1cccc(S[C@@H](C)c2cccc(C#N)c2)c1	ZINC000189831095	264328101	/nfs/dbraw/zinc/32/81/01/264328101.db2.gz	DQDOBZQVSCZVJJ-LBPRGKRZSA-N	0	0	269.369	4.420	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)Cc1cncs1	ZINC000162786991	264334858	/nfs/dbraw/zinc/33/48/58/264334858.db2.gz	YZHZXXYDMONWQF-UHFFFAOYSA-N	0	0	284.837	4.046	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@H](C)c1ccc(Cl)cc1	ZINC000189862574	264335322	/nfs/dbraw/zinc/33/53/22/264335322.db2.gz	CZDPRWNXFZLEGM-ABAIWWIYSA-N	0	0	265.784	4.120	20	30		CIEDRN
C[C@@H](Sc1cccc(C#N)c1)c1cccc(C#N)c1	ZINC000189855325	264335434	/nfs/dbraw/zinc/33/54/34/264335434.db2.gz	QCKIQWAGRJNJQL-GFCCVEGCSA-N	0	0	264.353	4.283	20	30		CIEDRN
N#Cc1cc(NCc2cc[nH]c2)ccc1Oc1ccccc1	ZINC000189947687	264337843	/nfs/dbraw/zinc/33/78/43/264337843.db2.gz	MBKSWFTUTMRMFN-UHFFFAOYSA-N	0	0	289.338	4.291	20	30		CIEDRN
C=C[C@H](CC(=O)N(C)[C@@H](C)c1ccco1)c1ccccc1	ZINC000131361456	264369852	/nfs/dbraw/zinc/36/98/52/264369852.db2.gz	ZARBSVULEUCTPU-LSDHHAIUSA-N	0	0	283.371	4.159	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1c(C)cccc1Cl	ZINC000132761340	264392793	/nfs/dbraw/zinc/39/27/93/264392793.db2.gz	HQNBFOSSQQNZRY-UHFFFAOYSA-N	0	0	266.772	4.078	20	30		CIEDRN
C=CCC[C@@H](NCc1nc(C)c(C)o1)c1ccccc1	ZINC000180048131	264394820	/nfs/dbraw/zinc/39/48/20/264394820.db2.gz	JHTKSJNMKAKPTJ-MRXNPFEDSA-N	0	0	270.376	4.089	20	30		CIEDRN
C#CCCCCC(=O)N1CCC[C@@H]1c1cc(C)ccc1C	ZINC000180388399	264407081	/nfs/dbraw/zinc/40/70/81/264407081.db2.gz	JACOSLAHSDJMDO-GOSISDBHSA-N	0	0	283.415	4.161	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1C[C@H]1C	ZINC000191514336	264506837	/nfs/dbraw/zinc/50/68/37/264506837.db2.gz	RSJGOEIOWJFYKW-IUODEOHRSA-N	0	0	272.392	4.068	20	30		CIEDRN
CC[C@H]1CCCN(C(=O)Nc2ccc(C(C)(C)C#N)cc2)C1	ZINC000193045428	264611864	/nfs/dbraw/zinc/61/18/64/264611864.db2.gz	SHIQAHHZLWYHRH-AWEZNQCLSA-N	0	0	299.418	4.142	20	30		CIEDRN
C=CCN(C(=O)Nc1ccc2cc(OC)ccc2c1)C1CC1	ZINC000287295574	264617508	/nfs/dbraw/zinc/61/75/08/264617508.db2.gz	SJYFLSNYKVULLF-UHFFFAOYSA-N	0	0	296.370	4.031	20	30		CIEDRN
CC#CCCCC(=O)N1C[C@H](C)CC[C@H]1c1ccccc1	ZINC000288466698	264665117	/nfs/dbraw/zinc/66/51/17/264665117.db2.gz	QFGUQPUDGTZOSQ-AEFFLSMTSA-N	0	0	283.415	4.180	20	30		CIEDRN
C=CCCCCCCNC(=O)c1ccoc1C(F)(F)F	ZINC000290367994	264781283	/nfs/dbraw/zinc/78/12/83/264781283.db2.gz	AISIYHMBBNGDJV-UHFFFAOYSA-N	0	0	289.297	4.165	20	30		CIEDRN
C=CCCCCCN[C@H](c1nccs1)C(F)(F)F	ZINC000293119843	264908692	/nfs/dbraw/zinc/90/86/92/264908692.db2.gz	ZCHRXFTTYJCRKS-SNVBAGLBSA-N	0	0	278.343	4.083	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N(C)c1ccc(Cl)cc1F	ZINC000425587702	264948869	/nfs/dbraw/zinc/94/88/69/264948869.db2.gz	SDBNLUBCHIDFHP-UHFFFAOYSA-N	0	0	269.747	4.044	20	30		CIEDRN
CC#CCCCC(=O)N(C)[C@@H](C)c1cccc(Cl)c1	ZINC000185223562	265011551	/nfs/dbraw/zinc/01/15/51/265011551.db2.gz	OCJYSPBZGKRAKD-ZDUSSCGKSA-N	0	0	277.795	4.053	20	30		CIEDRN
N#Cc1cc(N2CC[C@@H](c3ccccc3)C2)nc2ccccc12	ZINC000320682125	265017180	/nfs/dbraw/zinc/01/71/80/265017180.db2.gz	NBRIVNIGLMYHBI-MRXNPFEDSA-N	0	0	299.377	4.100	20	30		CIEDRN
N#Cc1csc(CNc2ccc(-c3nccs3)cc2)c1	ZINC000093687210	265187771	/nfs/dbraw/zinc/18/77/71/265187771.db2.gz	ZJWOSTPVCPESHU-UHFFFAOYSA-N	0	0	297.408	4.355	20	30		CIEDRN
N#Cc1csc(CNc2ccccc2N2CCCCC2)c1	ZINC000093685305	265189882	/nfs/dbraw/zinc/18/98/82/265189882.db2.gz	WNSFQZYEEOPBRJ-UHFFFAOYSA-N	0	0	297.427	4.222	20	30		CIEDRN
CC[C@H](Nc1ccc(C#N)c([N+](=O)[O-])c1)c1cccs1	ZINC000094591799	265244034	/nfs/dbraw/zinc/24/40/34/265244034.db2.gz	XMWVOOLVKILMHO-LBPRGKRZSA-N	0	0	287.344	4.091	20	30		CIEDRN
CC(C)Cn1ncc(NCC(C)(C)CCC#N)c1C(F)F	ZINC000350342327	265248920	/nfs/dbraw/zinc/24/89/20/265248920.db2.gz	OGWSERFHRDLQEJ-UHFFFAOYSA-N	0	0	298.381	4.219	20	30		CIEDRN
C=CCOc1ccc(CNc2cc(OC)ccc2F)cc1	ZINC000094854199	265264164	/nfs/dbraw/zinc/26/41/64/265264164.db2.gz	WVGLRQDLJYVKQZ-UHFFFAOYSA-N	0	0	287.334	4.011	20	30		CIEDRN
Cc1ccc(C#N)cc1NCc1nc(C(C)(C)C)cs1	ZINC000094963998	265279345	/nfs/dbraw/zinc/27/93/45/265279345.db2.gz	UGALZUVXIDTUPD-UHFFFAOYSA-N	0	0	285.416	4.233	20	30		CIEDRN
C[C@H](Nc1ccc(F)cc1C#N)c1c(F)cccc1F	ZINC000097635466	265445600	/nfs/dbraw/zinc/44/56/00/265445600.db2.gz	AKJATPRRQINBGI-VIFPVBQESA-N	0	0	276.261	4.149	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)N[C@@H](C)c1ccc(F)c2ccccc21	ZINC000519726583	265567668	/nfs/dbraw/zinc/56/76/68/265567668.db2.gz	OUKKJRISTFQTMH-KPZWWZAWSA-N	0	0	298.361	4.096	20	30		CIEDRN
C=CCOc1cccc(NC(=O)N(C)C2CCCCC2)c1	ZINC000098029806	265641027	/nfs/dbraw/zinc/64/10/27/265641027.db2.gz	KGXHWQNZEOIHRW-UHFFFAOYSA-N	0	0	288.391	4.048	20	30		CIEDRN
C=CCN(CC=C)C(=O)[C@@H](c1ccccc1)[C@@H](C)CC	ZINC000216543703	265666058	/nfs/dbraw/zinc/66/60/58/265666058.db2.gz	LSQVUQIYQPZCQG-DOTOQJQBSA-N	0	0	271.404	4.017	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1ocnc1C	ZINC000356169210	266061658	/nfs/dbraw/zinc/06/16/58/266061658.db2.gz	OOMUBFFKVGXHNN-UHFFFAOYSA-N	0	0	284.359	4.087	20	30		CIEDRN
CC[C@H](C)C[C@@H](C)NC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000356186277	266066179	/nfs/dbraw/zinc/06/61/79/266066179.db2.gz	AXTVJKPUYYDFLY-ZMSDIMECSA-N	0	0	286.419	4.015	20	30		CIEDRN
CC1CCC(c2noc(C3(C#N)CCCCC3)n2)CC1	ZINC000356191673	266067564	/nfs/dbraw/zinc/06/75/64/266067564.db2.gz	KRXNVMWMRJIPIH-UHFFFAOYSA-N	0	0	273.380	4.089	20	30		CIEDRN
C=CCCC1(C(=O)N[C@@H]2CC[C@@H](C)c3ccccc32)CC1	ZINC000356569258	266138596	/nfs/dbraw/zinc/13/85/96/266138596.db2.gz	SXFYAVYIHOHDGU-RHSMWYFYSA-N	0	0	283.415	4.488	20	30		CIEDRN
C=CCCC1(C(=O)N(CC)Cc2c[nH]c3ccccc23)CC1	ZINC000356967867	266219989	/nfs/dbraw/zinc/21/99/89/266219989.db2.gz	IMFBRQFXCDXSLN-UHFFFAOYSA-N	0	0	296.414	4.263	20	30		CIEDRN
C[C@@H](CC#N)N(C)Cc1ccc(-c2ccccc2)cc1F	ZINC000356992555	266226842	/nfs/dbraw/zinc/22/68/42/266226842.db2.gz	MXZFUVGSUVCQSU-AWEZNQCLSA-N	0	0	282.362	4.227	20	30		CIEDRN
CC(C)(C)[C@H]1CN(C(=O)CC(C)(C)C#N)c2ccccc21	ZINC000357344911	266280751	/nfs/dbraw/zinc/28/07/51/266280751.db2.gz	IOSOGTRFHDPSJI-AWEZNQCLSA-N	0	0	284.403	4.103	20	30		CIEDRN
CC(C)[C@@H]1C[C@@H](Nc2cccnc2C#N)c2ccccc21	ZINC000357662548	266341879	/nfs/dbraw/zinc/34/18/79/266341879.db2.gz	PFTXRLRBMLCDFM-DOTOQJQBSA-N	0	0	277.371	4.250	20	30		CIEDRN
C[C@@H](Nc1cccnc1C#N)c1cc2cccc(F)c2o1	ZINC000357678807	266346181	/nfs/dbraw/zinc/34/61/81/266346181.db2.gz	FSFVDYZABKYOOE-SNVBAGLBSA-N	0	0	281.290	4.012	20	30		CIEDRN
C=CCC(CC=C)c1nc(CC2CCC(OC)CC2)no1	ZINC000357768414	266358122	/nfs/dbraw/zinc/35/81/22/266358122.db2.gz	XRVOTCJCIYCPMK-UHFFFAOYSA-N	0	0	290.407	4.053	20	30		CIEDRN
CC[C@H](C)n1ncc(N[C@@H](C)c2cccc(C#N)c2)c1C	ZINC000357842121	266375559	/nfs/dbraw/zinc/37/55/59/266375559.db2.gz	AMAINEFIEVJHBC-STQMWFEESA-N	0	0	282.391	4.207	20	30		CIEDRN
CC[C@@H](C)n1ncc(N[C@H](C)c2ccc(C#N)cc2)c1C	ZINC000357842070	266375759	/nfs/dbraw/zinc/37/57/59/266375759.db2.gz	AEMMJTXOVMJDTQ-CHWSQXEVSA-N	0	0	282.391	4.207	20	30		CIEDRN
N#Cc1ccc(/C=C\c2cc3cc(F)ccc3o2)nc1	ZINC000358006855	266396693	/nfs/dbraw/zinc/39/66/93/266396693.db2.gz	SRGIKIYERWCLBE-PLNGDYQASA-N	0	0	264.259	4.009	20	30		CIEDRN
C=C(CC)CNc1ccc(NC(C)=O)cc1C(F)(F)F	ZINC000358648454	266486722	/nfs/dbraw/zinc/48/67/22/266486722.db2.gz	AMFKJHLAJMNYFT-UHFFFAOYSA-N	0	0	286.297	4.042	20	30		CIEDRN
C=CCC[C@H](NC(=O)[C@H]1CCC(F)(F)C1)c1ccccc1	ZINC000359747531	266634122	/nfs/dbraw/zinc/63/41/22/266634122.db2.gz	KLFNKJRKKANJMT-GJZGRUSLSA-N	0	0	293.357	4.246	20	30		CIEDRN
N#CCCCCSCc1ccc(C#N)cc1OC(F)F	ZINC000359763387	266637110	/nfs/dbraw/zinc/63/71/10/266637110.db2.gz	GLASEUIQAFJNEX-UHFFFAOYSA-N	0	0	296.342	4.087	20	30		CIEDRN
C=CCC1(C(=O)Nc2cc(F)c(SC)c(F)c2)CCC1	ZINC000359860395	266648325	/nfs/dbraw/zinc/64/83/25/266648325.db2.gz	VMCYPRYJPBSRTI-UHFFFAOYSA-N	0	0	297.370	4.372	20	30		CIEDRN
Cc1ccc(-c2nc(CNc3ccc(C#N)cc3)cs2)o1	ZINC000360349395	266709314	/nfs/dbraw/zinc/70/93/14/266709314.db2.gz	OIPQBCVYXLKPFM-UHFFFAOYSA-N	0	0	295.367	4.195	20	30		CIEDRN
N#CCCCC(=O)Nc1ccccc1-c1cccs1	ZINC000361442568	266822996	/nfs/dbraw/zinc/82/29/96/266822996.db2.gz	JAPVEULROXUZQL-UHFFFAOYSA-N	0	0	270.357	4.047	20	30		CIEDRN
N#CCCCC(=O)Nc1ccccc1Sc1ccccc1	ZINC000361460504	266827897	/nfs/dbraw/zinc/82/78/97/266827897.db2.gz	YLXAUWGSKZEEEN-UHFFFAOYSA-N	0	0	296.395	4.470	20	30		CIEDRN
Cc1ccc2c(c1)scc2C(=O)C(C#N)c1ccccn1	ZINC000361664511	266867549	/nfs/dbraw/zinc/86/75/49/266867549.db2.gz	MVOBRXLBNVPFBL-CYBMUJFWSA-N	0	0	292.363	4.095	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cc(C)cc3cccnc32)CC1	ZINC000361844174	266893589	/nfs/dbraw/zinc/89/35/89/266893589.db2.gz	TZBAIPICHNHXFO-UHFFFAOYSA-N	0	0	280.371	4.228	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N1CCC[C@@H](C)CC1	ZINC000362390272	266977646	/nfs/dbraw/zinc/97/76/46/266977646.db2.gz	RXGXRARDOSIOMT-CQSZACIVSA-N	0	0	289.444	4.227	20	30		CIEDRN
Cc1cscc1CNc1c(Cl)cccc1C#N	ZINC000362673442	267033530	/nfs/dbraw/zinc/03/35/30/267033530.db2.gz	XIIMKVHGKZBGFD-UHFFFAOYSA-N	0	0	262.765	4.194	20	30		CIEDRN
C=CCCCSCC(=O)N1CCC[C@H]1c1cccs1	ZINC000363308465	267086968	/nfs/dbraw/zinc/08/69/68/267086968.db2.gz	FBWCBSKVZABIPY-ZDUSSCGKSA-N	0	0	295.473	4.111	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CC[C@@H]1c1ccc(Cl)cc1	ZINC000368434073	267171314	/nfs/dbraw/zinc/17/13/14/267171314.db2.gz	PMBOAKDDQONHJQ-IUODEOHRSA-N	0	0	277.795	4.216	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H]1c1ccc(Cl)cc1	ZINC000368434074	267171754	/nfs/dbraw/zinc/17/17/54/267171754.db2.gz	PMBOAKDDQONHJQ-SWLSCSKDSA-N	0	0	277.795	4.216	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1Cc2ccccc2SC[C@@H]1C	ZINC000372247037	267536576	/nfs/dbraw/zinc/53/65/76/267536576.db2.gz	JNXNWGNXOFSIKC-KGLIPLIRSA-N	0	0	289.444	4.112	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC(=Cc2ccccc2)CC1	ZINC000373363209	267669868	/nfs/dbraw/zinc/66/98/68/267669868.db2.gz	QDADCSPKXWQQMK-INIZCTEOSA-N	0	0	283.415	4.295	20	30		CIEDRN
N#CCc1ccc(N[C@H]2CCC[C@H](c3cccnc3)C2)cc1	ZINC000376739072	268013781	/nfs/dbraw/zinc/01/37/81/268013781.db2.gz	WMWHXMPMGLGMSY-LPHOPBHVSA-N	0	0	291.398	4.286	20	30		CIEDRN
Cc1csc([C@H](C#N)C(=O)c2ccc(C3CCC3)cc2)n1	ZINC000192187754	335091119	/nfs/dbraw/zinc/09/11/19/335091119.db2.gz	JRGOLVZOHFPVGH-OAHLLOKOSA-N	0	0	296.395	4.209	20	30		CIEDRN
C=CCCCNC(=O)N1CC[C@@H](C)C[C@H]1c1ccc(C)o1	ZINC000448387998	327613721	/nfs/dbraw/zinc/61/37/21/327613721.db2.gz	YJEHGEZTWAUJHG-HIFRSBDPSA-N	0	0	290.407	4.037	20	30		CIEDRN
C=C(C)CCc1noc(-c2nc3ccccc3cc2Cl)n1	ZINC000570734346	327615123	/nfs/dbraw/zinc/61/51/23/327615123.db2.gz	JOMIFYPSNCIBRO-UHFFFAOYSA-N	0	0	299.761	4.447	20	30		CIEDRN
CC1(Cc2noc(/C=C/c3ccc(C#N)cc3)n2)CCCC1	ZINC000570760121	327616556	/nfs/dbraw/zinc/61/65/56/327616556.db2.gz	ADZLKTBJGRTUSR-CMDGGOBGSA-N	0	0	293.370	4.234	20	30		CIEDRN
Cc1cc(C)c(CNc2ccc(C#N)c([N+](=O)[O-])c2)c(C)c1	ZINC000570768473	327617332	/nfs/dbraw/zinc/61/73/32/327617332.db2.gz	RWJORGJEPVJHTC-UHFFFAOYSA-N	0	0	295.342	4.004	20	30		CIEDRN
CSCCCCCNc1cccc(C(F)F)c1C#N	ZINC000570827714	327624123	/nfs/dbraw/zinc/62/41/23/327624123.db2.gz	VGRSHYYZWAKHAH-UHFFFAOYSA-N	0	0	284.375	4.441	20	30		CIEDRN
CCC[C@H](C)C(=O)Nc1nc(-c2cccc(C#N)c2)cs1	ZINC000160591023	327630333	/nfs/dbraw/zinc/63/03/33/327630333.db2.gz	UPIDDLXVNXEMQU-NSHDSACASA-N	0	0	299.399	4.056	20	30		CIEDRN
C[C@@H](Nc1ncc(Cl)cc1Cl)c1ccc(C#N)cc1	ZINC000037502097	328805557	/nfs/dbraw/zinc/80/55/57/328805557.db2.gz	AHTZPYALUQSQDF-SECBINFHSA-N	0	0	292.169	4.433	20	30		CIEDRN
N#CCCCCSCCCCC1CCOCC1	ZINC000358480521	328886084	/nfs/dbraw/zinc/88/60/84/328886084.db2.gz	FZVQMGHVSGVYSE-UHFFFAOYSA-N	0	0	255.427	4.010	20	30		CIEDRN
C[C@@H](NC(=O)C1(C#N)CCCCC1)c1ccc(C2CC2)cc1	ZINC000580291456	327766326	/nfs/dbraw/zinc/76/63/26/327766326.db2.gz	SPFCMYZWLHSMDR-CQSZACIVSA-N	0	0	296.414	4.215	20	30		CIEDRN
CC[C@H](C(=O)NCc1cccc(C#N)c1)C1CCC(C)CC1	ZINC000460764416	327793681	/nfs/dbraw/zinc/79/36/81/327793681.db2.gz	FGHGWUCHAVDZDX-UYJHFMRCSA-N	0	0	298.430	4.027	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1ccc(C2(C#N)CC2)cc1	ZINC000181039830	327808158	/nfs/dbraw/zinc/80/81/58/327808158.db2.gz	SFIIRWOLKMLNQF-UHFFFAOYSA-N	0	0	296.414	4.060	20	30		CIEDRN
C=C(CC)CS[C@@H](C)C(=O)Nc1ccc(SC)cc1	ZINC000540193418	327809042	/nfs/dbraw/zinc/80/90/42/327809042.db2.gz	HNQSWHIBTIURRW-LBPRGKRZSA-N	0	0	295.473	4.435	20	30		CIEDRN
Cc1coc(-c2ccc(C)c(N[C@@H]3CCC[C@H](C#N)C3)c2)n1	ZINC000185750746	327844137	/nfs/dbraw/zinc/84/41/37/327844137.db2.gz	BTPLDZREOFEBGZ-GOEBONIOSA-N	0	0	295.386	4.453	20	30		CIEDRN
C#CCC(C)(C)C(=O)Nc1cccc(CCC(F)(F)F)c1	ZINC000185811720	327846195	/nfs/dbraw/zinc/84/61/95/327846195.db2.gz	PAWRWXYRVYOASU-UHFFFAOYSA-N	0	0	297.320	4.170	20	30		CIEDRN
N#C[C@H]1CCC[C@H](Nc2ccc3nc(C4CC4)oc3c2)C1	ZINC000185861063	327848389	/nfs/dbraw/zinc/84/83/89/327848389.db2.gz	JTHPNZCALSJLAZ-AAEUAGOBSA-N	0	0	281.359	4.199	20	30		CIEDRN
C=CCN(C(=O)CSc1ccccc1C)c1ccccc1	ZINC000497561265	327868494	/nfs/dbraw/zinc/86/84/94/327868494.db2.gz	CDHILXHITRILQW-UHFFFAOYSA-N	0	0	297.423	4.306	20	30		CIEDRN
C=CCN(C(=O)CCO[C@H](C)CC(C)C)c1ccccc1	ZINC000531500292	327943624	/nfs/dbraw/zinc/94/36/24/327943624.db2.gz	YPKODMIHAGGAMV-MRXNPFEDSA-N	0	0	289.419	4.047	20	30		CIEDRN
C=CCCc1ccccc1NCc1nc(C)cs1	ZINC000336973805	327948408	/nfs/dbraw/zinc/94/84/08/327948408.db2.gz	SKOSQIJUNWINQI-UHFFFAOYSA-N	0	0	258.390	4.182	20	30		CIEDRN
C=CCCc1ccccc1NCc1csc(C)n1	ZINC000336977539	327948412	/nfs/dbraw/zinc/94/84/12/327948412.db2.gz	YLURCEHTQJBCFO-UHFFFAOYSA-N	0	0	258.390	4.182	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(-c2ccc(C)cc2F)no1	ZINC000570971875	327967163	/nfs/dbraw/zinc/96/71/63/327967163.db2.gz	KWFSETABVHPOLM-HNNXBMFYSA-N	0	0	260.312	4.038	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CC2(CCC2)c2ccccc21	ZINC000506191640	332765044	/nfs/dbraw/zinc/76/50/44/332765044.db2.gz	QOASDLNWDSBDLU-UHFFFAOYSA-N	0	0	269.388	4.057	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)c1cccc2c1CCCC2	ZINC000410725870	328022315	/nfs/dbraw/zinc/02/23/15/328022315.db2.gz	QCNDPBOQLLAVFO-UHFFFAOYSA-N	0	0	298.430	4.110	20	30		CIEDRN
CC(C)(C#N)c1ccccc1CSC[C@H]1CCCCO1	ZINC000531749715	328030225	/nfs/dbraw/zinc/03/02/25/328030225.db2.gz	JTRHHSZXTIJBQG-OAHLLOKOSA-N	0	0	289.444	4.290	20	30		CIEDRN
C=CCN(C(=O)c1ccc(Cl)c(C)c1)c1ccccc1	ZINC000531835754	328043510	/nfs/dbraw/zinc/04/35/10/328043510.db2.gz	AXTHYKCZYRLUID-UHFFFAOYSA-N	0	0	285.774	4.481	20	30		CIEDRN
Cc1ccccc1CNc1ccc(C#N)c(C(F)(F)F)c1	ZINC000048265904	328049144	/nfs/dbraw/zinc/04/91/44/328049144.db2.gz	CYYCEUCHNWTMMF-UHFFFAOYSA-N	0	0	290.288	4.498	20	30		CIEDRN
COc1c(F)cc(F)cc1N[C@H](C)c1ccc(C#N)cc1	ZINC000531859746	328051108	/nfs/dbraw/zinc/05/11/08/328051108.db2.gz	RRRGVIGNPWTWGB-SNVBAGLBSA-N	0	0	288.297	4.018	20	30		CIEDRN
CCCOc1cc(F)ccc1NCc1ccc(C#N)s1	ZINC000152060237	328054084	/nfs/dbraw/zinc/05/40/84/328054084.db2.gz	WQGFLDQZKBGHAD-UHFFFAOYSA-N	0	0	290.363	4.160	20	30		CIEDRN
C=CCC[C@H](NC(=O)N1CC=C(C)CC1)c1ccccc1	ZINC000534441237	328053423	/nfs/dbraw/zinc/05/34/23/328053423.db2.gz	PMENFDNYORGKNM-KRWDZBQOSA-N	0	0	284.403	4.056	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)c1cccc(C2CC2)c1	ZINC000563361947	328058998	/nfs/dbraw/zinc/05/89/98/328058998.db2.gz	VHCBJZPNYCVUOE-UHFFFAOYSA-N	0	0	295.382	4.028	20	30		CIEDRN
C=CCCCCCNC(=O)Nc1cccc2cc[nH]c21	ZINC000563365705	328059447	/nfs/dbraw/zinc/05/94/47/328059447.db2.gz	DNSGSMQXCHLERQ-UHFFFAOYSA-N	0	0	271.364	4.036	20	30		CIEDRN
C[C@H](Oc1ccccc1N[C@H]1CC[C@H](C#N)C1)C(F)(F)F	ZINC000563482387	328069902	/nfs/dbraw/zinc/06/99/02/328069902.db2.gz	KWFRWHIWAIFQPX-SRVKXCTJSA-N	0	0	298.308	4.120	20	30		CIEDRN
CCOC(=O)CC[C@H](C)Sc1ccc(C#N)cc1Cl	ZINC000563495746	328070319	/nfs/dbraw/zinc/07/03/19/328070319.db2.gz	IMXNXGLSBIZSMF-JTQLQIEISA-N	0	0	297.807	4.036	20	30		CIEDRN
C=CCCCCS[C@@H](C)C(=O)Nc1ccccc1C	ZINC000563622219	328077959	/nfs/dbraw/zinc/07/79/59/328077959.db2.gz	RQYVTBPWXCAAIJ-AWEZNQCLSA-N	0	0	277.433	4.412	20	30		CIEDRN
Cc1csc(NC(=O)C[C@@H]2CCCC[C@H]2C)c1C#N	ZINC000563649279	328081082	/nfs/dbraw/zinc/08/10/82/328081082.db2.gz	ILQMZAQXXGLXPR-PWSUYJOCSA-N	0	0	276.405	4.083	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Cc1csc2ccc(Cl)cc12	ZINC000152258629	328083048	/nfs/dbraw/zinc/08/30/48/328083048.db2.gz	WZSCPNGHVIOLDS-JTQLQIEISA-N	0	0	293.819	4.178	20	30		CIEDRN
Cc1ccc(C)c(OCCSCCCCC#N)c1	ZINC000161028173	328118261	/nfs/dbraw/zinc/11/82/61/328118261.db2.gz	GLPQUMRPCAMGKG-UHFFFAOYSA-N	0	0	263.406	4.109	20	30		CIEDRN
C[C@@H](c1cccc2ccccc21)[N@H+](C)CC(C)(C)C#N	ZINC000571480248	328124709	/nfs/dbraw/zinc/12/47/09/328124709.db2.gz	MLSHQIRZVJOGGZ-AWEZNQCLSA-N	0	0	266.388	4.382	20	30		CIEDRN
Cc1cccc(C)c1OCCSCCCCC#N	ZINC000161087696	328128761	/nfs/dbraw/zinc/12/87/61/328128761.db2.gz	QJTTZZLDKUTZFX-UHFFFAOYSA-N	0	0	263.406	4.109	20	30		CIEDRN
C=CCCCCNC(=O)N[C@@H](C)c1ccc(SC)cc1	ZINC000541772677	328130545	/nfs/dbraw/zinc/13/05/45/328130545.db2.gz	HIVIRRQDYPFXNZ-ZDUSSCGKSA-N	0	0	292.448	4.125	20	30		CIEDRN
C[C@H]1Sc2ccccc2N(CCCCC#N)[C@@H]1C	ZINC000161119820	328132874	/nfs/dbraw/zinc/13/28/74/328132874.db2.gz	ZTTHLGLRBQUXTK-CHWSQXEVSA-N	0	0	260.406	4.070	20	30		CIEDRN
CC(C)(CC#N)CSc1ccnc2ccccc21	ZINC000571537471	328133059	/nfs/dbraw/zinc/13/30/59/328133059.db2.gz	JBYAUDRDTIQKIO-UHFFFAOYSA-N	0	0	256.374	4.267	20	30		CIEDRN
C=C(C)CNC(=O)c1cc(SC)c(Cl)cc1Cl	ZINC000161121923	328133925	/nfs/dbraw/zinc/13/39/25/328133925.db2.gz	ANMYKEGCCZPGNW-UHFFFAOYSA-N	0	0	290.215	4.021	20	30		CIEDRN
Cc1ccc(C)c(-n2ccnc2S[C@@H]2CC[C@H](C#N)C2)c1	ZINC000430126993	328136980	/nfs/dbraw/zinc/13/69/80/328136980.db2.gz	WDJJWMKXEVKZSS-LSDHHAIUSA-N	0	0	297.427	4.274	20	30		CIEDRN
Cc1c(Cl)c(CSCCC#N)nc2ccccc12	ZINC000413011728	328139828	/nfs/dbraw/zinc/13/98/28/328139828.db2.gz	JPRWYYJRMHGDNI-UHFFFAOYSA-N	0	0	276.792	4.344	20	30		CIEDRN
N#Cc1ccc(N2CC3(CCCC3)[C@@H]2c2ccccc2)nc1	ZINC000413358009	328144107	/nfs/dbraw/zinc/14/41/07/328144107.db2.gz	DXINTKSTXGTJAZ-SFHVURJKSA-N	0	0	289.382	4.075	20	30		CIEDRN
C=CC[C@H](Cc1ccccc1)Nc1nccc(C(F)F)n1	ZINC000413570136	328149342	/nfs/dbraw/zinc/14/93/42/328149342.db2.gz	FXYYWMVQJXBPCT-CYBMUJFWSA-N	0	0	289.329	4.014	20	30		CIEDRN
C=C(C)COc1cccc(NCc2ccoc2C)c1	ZINC000414361858	328155356	/nfs/dbraw/zinc/15/53/56/328155356.db2.gz	QWZBJPOCHTZSSV-UHFFFAOYSA-N	0	0	257.333	4.155	20	30		CIEDRN
C=CCCCSCc1nc([C@H](C)SCC)no1	ZINC000268756831	328185665	/nfs/dbraw/zinc/18/56/65/328185665.db2.gz	XZQOKBZQULSFTO-JTQLQIEISA-N	0	0	272.439	4.083	20	30		CIEDRN
Cc1cc(CSCc2ccccc2C(C)(C)C#N)on1	ZINC000268988652	328188323	/nfs/dbraw/zinc/18/83/23/328188323.db2.gz	UGRLCKOLZRZNIS-UHFFFAOYSA-N	0	0	286.400	4.218	20	30		CIEDRN
Cc1nc(CON=C2CCC2)oc1-c1ccc(Cl)cc1	ZINC000269073823	328189442	/nfs/dbraw/zinc/18/94/42/328189442.db2.gz	HNELOSMBXWJEJO-UHFFFAOYSA-N	0	0	290.750	4.360	20	30		CIEDRN
N#C[C@H]1CCC[C@@H](Nc2cccc(-c3nccs3)c2)C1	ZINC000274206277	328209544	/nfs/dbraw/zinc/20/95/44/328209544.db2.gz	MGFHFVHBGIWIAK-GXTWGEPZSA-N	0	0	283.400	4.304	20	30		CIEDRN
C=C(C)CSCC(=O)Nc1ccccc1C(C)C	ZINC000177871842	329187183	/nfs/dbraw/zinc/18/71/83/329187183.db2.gz	ZTPVEPQMLMOSAI-UHFFFAOYSA-N	0	0	263.406	4.058	20	30		CIEDRN
CCCCn1c(C)c(C)nc1S[C@@H]1CC[C@@H](C#N)C1	ZINC000278691416	328229419	/nfs/dbraw/zinc/22/94/19/328229419.db2.gz	ZLAYRPKUBSITQW-ZIAGYGMSSA-N	0	0	277.437	4.084	20	30		CIEDRN
Cc1ccc(SCCCC2(C#N)CCOCC2)cc1	ZINC000280911582	328237140	/nfs/dbraw/zinc/23/71/40/328237140.db2.gz	FTFYNJGDXHLVQY-UHFFFAOYSA-N	0	0	275.417	4.188	20	30		CIEDRN
CC1(C#N)CCN(c2ccnc3c(Cl)cccc23)CC1	ZINC000286476512	328249799	/nfs/dbraw/zinc/24/97/99/328249799.db2.gz	LENKTZWHMWQCDP-UHFFFAOYSA-N	0	0	285.778	4.018	20	30		CIEDRN
CC(C)N(C(=O)CCCC#N)c1cccc(C(F)(F)F)c1	ZINC000291312389	328262787	/nfs/dbraw/zinc/26/27/87/328262787.db2.gz	JJAXBCWBYYEGQB-UHFFFAOYSA-N	0	0	298.308	4.141	20	30		CIEDRN
C[C@H](C#N)S[C@H](C)c1cccc(Br)c1	ZINC000291549408	328264929	/nfs/dbraw/zinc/26/49/29/328264929.db2.gz	AOIBCJMPASVNLB-RKDXNWHRSA-N	0	0	270.195	4.155	20	30		CIEDRN
C[C@H](c1ccccc1)N(CC1CCC1)C(=O)CCCC#N	ZINC000291836375	328266590	/nfs/dbraw/zinc/26/65/90/328266590.db2.gz	BJWSKJDNZRJBES-OAHLLOKOSA-N	0	0	284.403	4.070	20	30		CIEDRN
C=C(C)CCNC(=O)C1CCC(c2ccccc2)CC1	ZINC000452714776	328273404	/nfs/dbraw/zinc/27/34/04/328273404.db2.gz	AABDYDRJLGJFJG-UHFFFAOYSA-N	0	0	271.404	4.043	20	30		CIEDRN
Cc1sc2nc(C)nc(S[C@H](C)CCC#N)c2c1C	ZINC000340585930	328294949	/nfs/dbraw/zinc/29/49/49/328294949.db2.gz	ADUJWOHPUHKOIS-MRVPVSSYSA-N	0	0	291.445	4.401	20	30		CIEDRN
CCCCCCCCC(=O)N[C@H](C)c1ccccn1	ZINC000298189417	328295459	/nfs/dbraw/zinc/29/54/59/328295459.db2.gz	NJMBDQOYERITOO-CQSZACIVSA-N	0	0	262.397	4.009	20	30		CIEDRN
Cc1nc2ccc(NCc3ccccc3C#N)cc2s1	ZINC000048421900	328308099	/nfs/dbraw/zinc/30/80/99/328308099.db2.gz	YGECGHUAISDDTJ-UHFFFAOYSA-N	0	0	279.368	4.089	20	30		CIEDRN
N#Cc1c(Cl)cccc1NCc1cccc(Cl)c1	ZINC000048727840	328321619	/nfs/dbraw/zinc/32/16/19/328321619.db2.gz	ILJGVBXXJSCWQF-UHFFFAOYSA-N	0	0	277.154	4.477	20	30		CIEDRN
N#CCC[C@@H](Nc1c(F)cc(C#N)cc1F)c1ccccc1	ZINC000164322538	328321955	/nfs/dbraw/zinc/32/19/55/328321955.db2.gz	IVMCTNDVWQTMTQ-MRXNPFEDSA-N	0	0	297.308	4.293	20	30		CIEDRN
N#Cc1cc(NC(=O)c2ccccc2Cl)ccc1Cl	ZINC000048824380	328325125	/nfs/dbraw/zinc/32/51/25/328325125.db2.gz	PQFGGKGNBVCAFL-UHFFFAOYSA-N	0	0	291.137	4.117	20	30		CIEDRN
CN(Cc1ccccc1Cl)c1c(F)cc(C#N)cc1F	ZINC000111141817	328328008	/nfs/dbraw/zinc/32/80/08/328328008.db2.gz	ZDJWPZQHWNLBLV-UHFFFAOYSA-N	0	0	292.716	4.126	20	30		CIEDRN
C=C[C@H](CC(=O)N([C@H](C)C(C)C)C1CC1)c1ccccc1	ZINC000534646068	328333905	/nfs/dbraw/zinc/33/39/05/328333905.db2.gz	BECXTWUHKGKXCW-HZPDHXFCSA-N	0	0	285.431	4.382	20	30		CIEDRN
CCCCC1CCC(NC(=O)c2ccc(CC#N)cc2)CC1	ZINC000534638406	328334910	/nfs/dbraw/zinc/33/49/10/328334910.db2.gz	YEDQYSAJKOBEPJ-UHFFFAOYSA-N	0	0	298.430	4.231	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1cc(F)cc(F)c1)c1ccccc1	ZINC000534651993	328337528	/nfs/dbraw/zinc/33/75/28/328337528.db2.gz	KRCSOYDAHZVPTD-GFCCVEGCSA-N	0	0	287.309	4.263	20	30		CIEDRN
C=C[C@H](CC(=O)N1CCC(C)(CC)CC1)c1ccccc1	ZINC000534696430	328356964	/nfs/dbraw/zinc/35/69/64/328356964.db2.gz	OEYUAGYDQCNZRY-MRXNPFEDSA-N	0	0	285.431	4.385	20	30		CIEDRN
C=CCN(CCc1ccccc1)C(=O)[C@H]1CCC[C@H](C)C1	ZINC000303810426	328357304	/nfs/dbraw/zinc/35/73/04/328357304.db2.gz	BXERQXDWQIEXAI-WMZOPIPTSA-N	0	0	285.431	4.070	20	30		CIEDRN
C=CCN(CCc1ccccc1)C(=O)[C@@H]1CCC[C@H](C)C1	ZINC000303810421	328357352	/nfs/dbraw/zinc/35/73/52/328357352.db2.gz	BXERQXDWQIEXAI-FUHWJXTLSA-N	0	0	285.431	4.070	20	30		CIEDRN
CCN(C(=O)Nc1ccc(C#N)c(Cl)c1)[C@H](C)C(C)C	ZINC000049414304	328358742	/nfs/dbraw/zinc/35/87/42/328358742.db2.gz	RORIXQNWDGHREM-LLVKDONJSA-N	0	0	293.798	4.110	20	30		CIEDRN
C=CCCC(=O)N1CCCC(C)(C)c2ccccc21	ZINC000534843678	328363765	/nfs/dbraw/zinc/36/37/65/328363765.db2.gz	PJLQVAWKTPODTA-UHFFFAOYSA-N	0	0	257.377	4.057	20	30		CIEDRN
N#Cc1ccc(OCc2ccc3ncccc3c2)cc1Cl	ZINC000220990310	328369054	/nfs/dbraw/zinc/36/90/54/328369054.db2.gz	KDRDEGBYDSICIZ-UHFFFAOYSA-N	0	0	294.741	4.339	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2ccccc2C(C)C)CC1	ZINC000111702764	328376494	/nfs/dbraw/zinc/37/64/94/328376494.db2.gz	VIEFHKKXJPTMBH-UHFFFAOYSA-N	0	0	272.392	4.240	20	30		CIEDRN
C=CC1CCN(C(=O)N[C@H](C)c2cc3ccccc3o2)CC1	ZINC000111805670	328379127	/nfs/dbraw/zinc/37/91/27/328379127.db2.gz	BKWOBYHWYWIUMW-CYBMUJFWSA-N	0	0	298.386	4.101	20	30		CIEDRN
Cc1ccccc1CSCc1ccc(C#N)cc1F	ZINC000049956385	328379807	/nfs/dbraw/zinc/37/98/07/328379807.db2.gz	WDSAKYFCUMHOCJ-UHFFFAOYSA-N	0	0	271.360	4.439	20	30		CIEDRN
CC(C)(C)c1ccc([C@@H](C#N)NC(=O)c2cccs2)cc1	ZINC000049904261	328381397	/nfs/dbraw/zinc/38/13/97/328381397.db2.gz	OJJVLFCREJCWAX-CQSZACIVSA-N	0	0	298.411	4.040	20	30		CIEDRN
C[C@@H](Nc1ccc(C#N)cc1F)c1c(F)cccc1F	ZINC000112012240	328381515	/nfs/dbraw/zinc/38/15/15/328381515.db2.gz	VNJIWAXSBTUCIH-SECBINFHSA-N	0	0	276.261	4.149	20	30		CIEDRN
C[C@@H]1C[C@H]1c1ccc(CNc2ccc(C#N)cc2F)o1	ZINC000112012200	328381623	/nfs/dbraw/zinc/38/16/23/328381623.db2.gz	VKMHNFCZUZVXAM-ZWNOBZJWSA-N	0	0	270.307	4.026	20	30		CIEDRN
N#Cc1cc(F)c(NCc2ccc(F)c(Cl)c2)c(F)c1	ZINC000112013800	328381945	/nfs/dbraw/zinc/38/19/45/328381945.db2.gz	CUXJMXZVVHZCTI-UHFFFAOYSA-N	0	0	296.679	4.241	20	30		CIEDRN
CC(C)N(CCC#N)Cc1ccc(-c2ccccc2)o1	ZINC000535073069	328384357	/nfs/dbraw/zinc/38/43/57/328384357.db2.gz	SXVIRGCYQLVBMP-UHFFFAOYSA-N	0	0	268.360	4.071	20	30		CIEDRN
N#CCN(Cc1ccc(-c2ccc(Cl)cc2)o1)C1CC1	ZINC000535084367	328386086	/nfs/dbraw/zinc/38/60/86/328386086.db2.gz	LPMAAGBRAPQBGW-UHFFFAOYSA-N	0	0	286.762	4.088	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)c1ccc(C(C)=O)cc1	ZINC000112183755	328387138	/nfs/dbraw/zinc/38/71/38/328387138.db2.gz	NKKRHXFDGXJXKV-UHFFFAOYSA-N	0	0	299.414	4.098	20	30		CIEDRN
C=C(C)CN(CC)C(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1	ZINC000535139324	328392097	/nfs/dbraw/zinc/39/20/97/328392097.db2.gz	XHZYESAFUGITQG-ARFHVFGLSA-N	0	0	263.425	4.018	20	30		CIEDRN
C=C(C)CN(CC)C(=O)[C@@H]1CC[C@H]2CCCC[C@H]2C1	ZINC000535139327	328392142	/nfs/dbraw/zinc/39/21/42/328392142.db2.gz	XHZYESAFUGITQG-OWCLPIDISA-N	0	0	263.425	4.018	20	30		CIEDRN
N#CCC[C@@H](C#N)CSCc1ccccc1C1CC1	ZINC000341498350	328411180	/nfs/dbraw/zinc/41/11/80/328411180.db2.gz	JEHPBNIMEOICFP-ZDUSSCGKSA-N	0	0	270.401	4.241	20	30		CIEDRN
N#Cc1ccc(SCc2ccccc2C2CC2)nc1	ZINC000342458075	328419098	/nfs/dbraw/zinc/41/90/98/328419098.db2.gz	MBEHGPAZSDFSDT-UHFFFAOYSA-N	0	0	266.369	4.123	20	30		CIEDRN
Cc1ccccc1-c1cnc(CNc2cccc(C#N)c2)o1	ZINC000535266146	328419819	/nfs/dbraw/zinc/41/98/19/328419819.db2.gz	ZYJPURNTAOVPBS-UHFFFAOYSA-N	0	0	289.338	4.134	20	30		CIEDRN
N#Cc1cc(F)ccc1NCc1ccccc1C(F)(F)F	ZINC000113317693	328603167	/nfs/dbraw/zinc/60/31/67/328603167.db2.gz	AXYSZNOCIRTUGM-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
CC(C)c1ccc([C@H]2CCCN2c2cccc(C#N)n2)cc1	ZINC000535357214	328442287	/nfs/dbraw/zinc/44/22/87/328442287.db2.gz	MIDGLLBMVDZWQF-GOSISDBHSA-N	0	0	291.398	4.418	20	30		CIEDRN
C[C@H](CCc1ccccc1)Nc1ccc(F)cc1C#N	ZINC000113317575	328603232	/nfs/dbraw/zinc/60/32/32/328603232.db2.gz	FTAACPJEFMWEQV-CYBMUJFWSA-N	0	0	268.335	4.131	20	30		CIEDRN
C=CCCC(=O)N(Cc1ccccc1)c1ccc(OC)cc1	ZINC000102221346	328439502	/nfs/dbraw/zinc/43/95/02/328439502.db2.gz	CZJZZCUBTQSRPD-UHFFFAOYSA-N	0	0	295.382	4.195	20	30		CIEDRN
Cc1ccc(C#N)cc1NCc1ccc(Cl)s1	ZINC000050429685	328439538	/nfs/dbraw/zinc/43/95/38/328439538.db2.gz	WQWOGRCYYOJQMO-UHFFFAOYSA-N	0	0	262.765	4.194	20	30		CIEDRN
C=CCCC(=O)N1CCC[C@@H]1[C@H](CC)c1ccccc1	ZINC000102343232	328450337	/nfs/dbraw/zinc/45/03/37/328450337.db2.gz	OKSXOGHHGHCHFZ-IAGOWNOFSA-N	0	0	271.404	4.137	20	30		CIEDRN
C[C@@H](Sc1cccc(O)c1)c1cccc(C#N)c1	ZINC000189879992	328485955	/nfs/dbraw/zinc/48/59/55/328485955.db2.gz	PXWBVQRLXZYEJF-LLVKDONJSA-N	0	0	255.342	4.117	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@@H]1CCC[C@H]1c1ccccc1	ZINC000563720195	328495142	/nfs/dbraw/zinc/49/51/42/328495142.db2.gz	OZKZLZYVCFEHHG-JZXOWHBKSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CCOc1cccc(NC(=O)[C@@H]2CCCC(F)(F)C2)c1	ZINC000282288543	328508094	/nfs/dbraw/zinc/50/80/94/328508094.db2.gz	WDYAKFRHZQHEFZ-GFCCVEGCSA-N	0	0	295.329	4.015	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)N1CCCCO1	ZINC000283577252	328514771	/nfs/dbraw/zinc/51/47/71/328514771.db2.gz	KJOCBEYQDPMMRQ-UHFFFAOYSA-N	0	0	288.391	4.098	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)C1CC1	ZINC000191437601	328510911	/nfs/dbraw/zinc/51/09/11/328510911.db2.gz	XDNVUGVQIWWYET-CYBMUJFWSA-N	0	0	286.419	4.459	20	30		CIEDRN
C=C(C)CNC(=O)C(C)(C)c1ccc(-c2ccccc2)cc1	ZINC000428107628	328537792	/nfs/dbraw/zinc/53/77/92/328537792.db2.gz	MXBQRKAKVJSDQG-UHFFFAOYSA-N	0	0	293.410	4.324	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H]1c1cccs1	ZINC000184973008	328543542	/nfs/dbraw/zinc/54/35/42/328543542.db2.gz	PVIPVMAKRDZNQU-CHWSQXEVSA-N	0	0	263.406	4.014	20	30		CIEDRN
COc1ccc(CNc2ccc(F)c(C3CC3)c2)cc1C#N	ZINC000352618628	533707753	/nfs/dbraw/zinc/70/77/53/533707753.db2.gz	RNYPJEXYTOQIRX-UHFFFAOYSA-N	0	0	296.345	4.195	20	30		CIEDRN
Cc1oc2ccccc2c1/C=C\c1ccncc1C#N	ZINC000349107464	328588049	/nfs/dbraw/zinc/58/80/49/328588049.db2.gz	JYEOGGYYUJAUJA-SREVYHEPSA-N	0	0	260.296	4.178	20	30		CIEDRN
C=CCN(C(=O)[C@H]1C[C@H]1c1sccc1C)c1ccccc1	ZINC000533509856	326845441	/nfs/dbraw/zinc/84/54/41/326845441.db2.gz	KEUZTBREEBVUSJ-CVEARBPZSA-N	0	0	297.423	4.379	20	30		CIEDRN
C[C@H](CCc1ccco1)Nc1cc(Cl)ccc1C#N	ZINC000036954569	326877270	/nfs/dbraw/zinc/87/72/70/326877270.db2.gz	JFZWULBERGFJOV-LLVKDONJSA-N	0	0	274.751	4.238	20	30		CIEDRN
CC1(C)CCC(CC(=O)NCC2CCC(C#N)CC2)CC1	ZINC000407974113	326881318	/nfs/dbraw/zinc/88/13/18/326881318.db2.gz	LVJUJKNCCGZLIA-UHFFFAOYSA-N	0	0	290.451	4.039	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H](C)c2c(F)cccc2F)n1	ZINC000556364982	326923365	/nfs/dbraw/zinc/92/33/65/326923365.db2.gz	NTMMCZJXOZQGQV-JTQLQIEISA-N	0	0	292.329	4.353	20	30		CIEDRN
C=CCC(C)(C)c1noc(C[C@H](C=C)c2ccccc2)n1	ZINC000556362825	326924168	/nfs/dbraw/zinc/92/41/68/326924168.db2.gz	RCSGWLLEYBRYQG-AWEZNQCLSA-N	0	0	282.387	4.436	20	30		CIEDRN
CN(C(=O)C[C@H]1CCCC(C)(C)C1)c1ccccc1C#N	ZINC000533763526	326929828	/nfs/dbraw/zinc/92/98/28/326929828.db2.gz	IFGUUESEUDTTRC-CQSZACIVSA-N	0	0	284.403	4.128	20	30		CIEDRN
CC1(C)CCC[C@H](CC(=O)N(CC#N)c2ccccc2)C1	ZINC000533763606	326929863	/nfs/dbraw/zinc/92/98/63/326929863.db2.gz	CGDSFNADEJCTTI-OAHLLOKOSA-N	0	0	284.403	4.150	20	30		CIEDRN
N#Cc1cc(C(=O)Nc2ccc(C3CCC3)cc2)ccc1F	ZINC000556438127	326942056	/nfs/dbraw/zinc/94/20/56/326942056.db2.gz	VVRUMCWQYRRRFW-UHFFFAOYSA-N	0	0	294.329	4.217	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCCc1cc2ccccc2s1	ZINC000506532838	332774165	/nfs/dbraw/zinc/77/41/65/332774165.db2.gz	KVEBCGBJASGZMT-CYBMUJFWSA-N	0	0	287.428	4.162	20	30		CIEDRN
CC[C@@H](CC(=O)N[C@@H](C#N)C1CCCCC1)c1ccccc1	ZINC000506531693	332774175	/nfs/dbraw/zinc/77/41/75/332774175.db2.gz	MPBLSASXTAWBKJ-YJBOKZPZSA-N	0	0	298.430	4.159	20	30		CIEDRN
CC[C@H](CC(=O)N[C@@H](C#N)C1CCCCC1)c1ccccc1	ZINC000506531692	332774339	/nfs/dbraw/zinc/77/43/39/332774339.db2.gz	MPBLSASXTAWBKJ-QAPCUYQASA-N	0	0	298.430	4.159	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cnc(-c2ccccc2)s1	ZINC000556700649	326959390	/nfs/dbraw/zinc/95/93/90/326959390.db2.gz	VZVSABNKFSLWHO-UHFFFAOYSA-N	0	0	286.400	4.351	20	30		CIEDRN
N#Cc1ccc(/C=C\c2cccc(OC(F)(F)F)c2)nc1	ZINC000255298963	326962272	/nfs/dbraw/zinc/96/22/72/326962272.db2.gz	OALIYVLXFGBHED-XQRVVYSFSA-N	0	0	290.244	4.022	20	30		CIEDRN
Cc1ccc(N[C@H]2CCc3ccc(C#N)cc32)c(F)c1	ZINC000564432874	327001262	/nfs/dbraw/zinc/00/12/62/327001262.db2.gz	RVXWNXLMFWCNDM-INIZCTEOSA-N	0	0	266.319	4.105	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)C/C=C\c1cccc(F)c1	ZINC000255639140	327001969	/nfs/dbraw/zinc/00/19/69/327001969.db2.gz	OZWNCVJALWOEHN-UTCJRWHESA-N	0	0	294.329	4.048	20	30		CIEDRN
N#Cc1ccc(SCc2cc(-c3ccco3)on2)cc1	ZINC000557443686	327005881	/nfs/dbraw/zinc/00/58/81/327005881.db2.gz	DHZLLYRPQHJRNY-UHFFFAOYSA-N	0	0	282.324	4.099	20	30		CIEDRN
N#Cc1ccnc(N[C@@H](c2ccc(Cl)cc2)C2CC2)c1	ZINC000557479412	327007713	/nfs/dbraw/zinc/00/77/13/327007713.db2.gz	YGHOQUCJXLJUPF-MRXNPFEDSA-N	0	0	283.762	4.170	20	30		CIEDRN
CC[C@@H](Nc1cc(C#N)ccn1)c1ccc(Cl)cc1	ZINC000557479081	327007836	/nfs/dbraw/zinc/00/78/36/327007836.db2.gz	RODWHGNOHZHASJ-CQSZACIVSA-N	0	0	271.751	4.170	20	30		CIEDRN
C=C(C)CCc1noc([C@@H]2[C@H](C)[C@H]2c2ccccc2)n1	ZINC000557517266	327011066	/nfs/dbraw/zinc/01/10/66/327011066.db2.gz	JFNPBWAFDIROBY-UHOFOFEASA-N	0	0	268.360	4.095	20	30		CIEDRN
Cc1cc(N2CCC[C@H]2c2ccc(Cl)cc2)cc(C#N)n1	ZINC000557520977	327011645	/nfs/dbraw/zinc/01/16/45/327011645.db2.gz	HXGYWQCSGHOQDU-KRWDZBQOSA-N	0	0	297.789	4.257	20	30		CIEDRN
CC(C)(C)CCCCC(=O)N[C@H](C#N)C1CCCCC1	ZINC000557562671	327013328	/nfs/dbraw/zinc/01/33/28/327013328.db2.gz	BNWGMEKQJPRTFG-OAHLLOKOSA-N	0	0	278.440	4.182	20	30		CIEDRN
CC(C)CC[C@H]1CCCN1c1nccc(C#N)c1Cl	ZINC000557626799	327017195	/nfs/dbraw/zinc/01/71/95/327017195.db2.gz	ISUMSMHGOLGRCB-CYBMUJFWSA-N	0	0	277.799	4.012	20	30		CIEDRN
CCOC(=O)CC(C)(C)CCSc1ccc(C#N)cc1	ZINC000557757675	327025009	/nfs/dbraw/zinc/02/50/09/327025009.db2.gz	XWVIKJRXYIGIHZ-UHFFFAOYSA-N	0	0	291.416	4.020	20	30		CIEDRN
COc1ccc(CSc2ccccc2C)cc1C#N	ZINC000087833727	327025497	/nfs/dbraw/zinc/02/54/97/327025497.db2.gz	HXYFBVGNKJTJDM-UHFFFAOYSA-N	0	0	269.369	4.168	20	30		CIEDRN
C[C@H]1C[C@@H](c2ccccc2)N(c2nccc(C#N)c2Cl)C1	ZINC000557763091	327025644	/nfs/dbraw/zinc/02/56/44/327025644.db2.gz	PMUNUCWQPBNLKP-WFASDCNBSA-N	0	0	297.789	4.194	20	30		CIEDRN
C=CCC[C@H](C(=O)N[C@H]1CCC1(C)C)c1ccccc1	ZINC000557977630	327038423	/nfs/dbraw/zinc/03/84/23/327038423.db2.gz	LMJGIKIOVBZELM-HOTGVXAUSA-N	0	0	271.404	4.041	20	30		CIEDRN
C[C@H](Nc1ccc(F)cc1)c1ccc(C#N)c(F)c1	ZINC000558030615	327043497	/nfs/dbraw/zinc/04/34/97/327043497.db2.gz	IYHNBXJFLPHTSH-JTQLQIEISA-N	0	0	258.271	4.010	20	30		CIEDRN
Cc1nsc(Oc2ccc3ccccc3c2)c1C#N	ZINC000584134398	327046671	/nfs/dbraw/zinc/04/66/71/327046671.db2.gz	KGIQOICXSDKACG-UHFFFAOYSA-N	0	0	266.325	4.269	20	30		CIEDRN
Clc1ccc(C#CCSCc2cccnc2)cc1	ZINC000558103276	327073698	/nfs/dbraw/zinc/07/36/98/327073698.db2.gz	DRSGKRWYHWMLMT-UHFFFAOYSA-N	0	0	273.788	4.020	20	30		CIEDRN
CC1(C)CCCC[C@@H]1CC(=O)Nc1ccccc1C#N	ZINC000506841592	332780835	/nfs/dbraw/zinc/78/08/35/332780835.db2.gz	YDBLDMZBAJZKHN-CQSZACIVSA-N	0	0	270.376	4.103	20	30		CIEDRN
N#CCC[C@H](C#N)CSc1nc(-c2ccccc2)cs1	ZINC000066399974	327080309	/nfs/dbraw/zinc/08/03/09/327080309.db2.gz	XIRQTWCPFLJAQN-GFCCVEGCSA-N	0	0	299.424	4.346	20	30		CIEDRN
Cc1csc(NC(=O)C[C@@H](C)c2ccccc2C)c1C#N	ZINC000558244846	327081260	/nfs/dbraw/zinc/08/12/60/327081260.db2.gz	VIEYODFHNOGEPQ-GFCCVEGCSA-N	0	0	298.411	4.369	20	30		CIEDRN
C/C=C/c1ccc(NC(=O)Nc2ccc(CC#N)cc2)cc1	ZINC000558245250	327081293	/nfs/dbraw/zinc/08/12/93/327081293.db2.gz	JZRHDUXNDSHHTC-NSCUHMNNSA-N	0	0	291.354	4.430	20	30		CIEDRN
CC(C)OC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1	ZINC000506837992	332780887	/nfs/dbraw/zinc/78/08/87/332780887.db2.gz	NASPTUCOAHAUMQ-UHFFFAOYSA-N	0	0	299.301	4.055	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(Cc2cccc(Cl)c2)no1	ZINC000558279003	327084986	/nfs/dbraw/zinc/08/49/86/327084986.db2.gz	FNWWVEWRMWVBBX-NSHDSACASA-N	0	0	276.767	4.384	20	30		CIEDRN
CCCCOc1cccc(CNc2ccc(C#N)cc2F)c1	ZINC000506875036	332781552	/nfs/dbraw/zinc/78/15/52/332781552.db2.gz	OUZZYAVPAZZWNG-UHFFFAOYSA-N	0	0	298.361	4.488	20	30		CIEDRN
Cc1cc(C#N)ccc1C(=O)N(C)c1ccccc1C(C)C	ZINC000569341658	327098915	/nfs/dbraw/zinc/09/89/15/327098915.db2.gz	KOJYPEYGXRSVIC-UHFFFAOYSA-N	0	0	292.382	4.267	20	30		CIEDRN
CC(C)(C#N)CCCC[S@](=O)Cc1ccccc1Cl	ZINC000232526409	327102607	/nfs/dbraw/zinc/10/26/07/327102607.db2.gz	YWGRYWWWFIZTAL-IBGZPJMESA-N	0	0	297.851	4.309	20	30		CIEDRN
CC1(CNC(=O)C[C@@H](CC#N)c2ccccc2)CCCCC1	ZINC000558552102	327104475	/nfs/dbraw/zinc/10/44/75/327104475.db2.gz	KROLYLOPBIPFES-QGZVFWFLSA-N	0	0	298.430	4.161	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1cc(C)c(C)o1	ZINC000558591176	327107836	/nfs/dbraw/zinc/10/78/36/327107836.db2.gz	OXXDHBSOFQCRNC-UHFFFAOYSA-N	0	0	269.344	4.267	20	30		CIEDRN
C=CCn1c(S[C@@H]2CC[C@H](C)C2)nnc1-c1ccco1	ZINC000558829670	327123736	/nfs/dbraw/zinc/12/37/36/327123736.db2.gz	ZDAWGRRZGJHEHJ-NWDGAFQWSA-N	0	0	289.404	4.005	20	30		CIEDRN
CC(C)Oc1cc(F)ccc1NC1CCC(C)(C#N)CC1	ZINC000449228450	327134565	/nfs/dbraw/zinc/13/45/65/327134565.db2.gz	UFHRWAYTXULDIS-UHFFFAOYSA-N	0	0	290.382	4.497	20	30		CIEDRN
N#Cc1csc(CNc2cc(Cl)cc3cccnc32)c1	ZINC000093685743	327136511	/nfs/dbraw/zinc/13/65/11/327136511.db2.gz	XFFHHKKSFYWYAJ-UHFFFAOYSA-N	0	0	299.786	4.433	20	30		CIEDRN
Cc1cc(C[NH2+][C@H]2CCc3ccc(C#N)cc32)ccc1Cl	ZINC000573371293	327138850	/nfs/dbraw/zinc/13/88/50/327138850.db2.gz	UBSZMOOASMAYLZ-SFHVURJKSA-N	0	0	296.801	4.297	20	30		CIEDRN
C=CCCOc1ccc(N(C)C(=O)c2ccc(C)cc2)cc1	ZINC000559156106	327144029	/nfs/dbraw/zinc/14/40/29/327144029.db2.gz	JBBLJQUUBKFHEP-UHFFFAOYSA-N	0	0	295.382	4.227	20	30		CIEDRN
CC(C)(C)c1csc(NC(=O)c2ccccc2)c1C#N	ZINC000059751122	327153419	/nfs/dbraw/zinc/15/34/19/327153419.db2.gz	TUTHNZOANKPWTL-UHFFFAOYSA-N	0	0	284.384	4.170	20	30		CIEDRN
N#Cc1nc(N[C@@H]2CCC23CCCC3)ccc1C(F)(F)F	ZINC000409659920	327163267	/nfs/dbraw/zinc/16/32/67/327163267.db2.gz	OZXGSTSXFDJJDY-GFCCVEGCSA-N	0	0	295.308	4.107	20	30		CIEDRN
C=CCCc1ccccc1NCc1nc(-c2ccco2)no1	ZINC000409847247	327165262	/nfs/dbraw/zinc/16/52/62/327165262.db2.gz	KAGOAEMZVSCJFW-UHFFFAOYSA-N	0	0	295.342	4.060	20	30		CIEDRN
C=CCCc1ccccc1NC[C@@H]1CCO[C@H](C)C1	ZINC000409835732	327165324	/nfs/dbraw/zinc/16/53/24/327165324.db2.gz	KZXXDIODLYIUPA-HUUCEWRRSA-N	0	0	259.393	4.032	20	30		CIEDRN
C=CCCc1ccccc1NCCc1csc(C)n1	ZINC000409844873	327165806	/nfs/dbraw/zinc/16/58/06/327165806.db2.gz	VZZZZSITWKHYQK-UHFFFAOYSA-N	0	0	272.417	4.225	20	30		CIEDRN
Cc1cc(F)cc(N[C@H](C)c2cccc(C#N)c2)c1	ZINC000091510142	327170413	/nfs/dbraw/zinc/17/04/13/327170413.db2.gz	ZGHZZVWYZAZWOU-GFCCVEGCSA-N	0	0	254.308	4.179	20	30		CIEDRN
Cc1cc(F)cc(N[C@@H](C)c2ccc(C#N)cc2)c1	ZINC000091510813	327170759	/nfs/dbraw/zinc/17/07/59/327170759.db2.gz	IRESWPYJNWQBAK-LBPRGKRZSA-N	0	0	254.308	4.179	20	30		CIEDRN
C[C@H](Sc1cccc(F)c1C#N)c1ccc(C#N)cc1	ZINC000569429712	327175761	/nfs/dbraw/zinc/17/57/61/327175761.db2.gz	GUUCERSHKRRJAE-NSHDSACASA-N	0	0	282.343	4.422	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)C[C@@H](CC)c1ccc(OC)cc1	ZINC000410128951	327179990	/nfs/dbraw/zinc/17/99/90/327179990.db2.gz	WGKVFLMZRFIWHB-ZBFHGGJFSA-N	0	0	289.419	4.050	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)CCc1cccc(C(F)(F)F)c1	ZINC000410120484	327180250	/nfs/dbraw/zinc/18/02/50/327180250.db2.gz	UOGVYKMICWHELX-AWEZNQCLSA-N	0	0	299.336	4.109	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1cc(C(C)C)on1	ZINC000410344384	327187342	/nfs/dbraw/zinc/18/73/42/327187342.db2.gz	KTUZYRKYEWTWFR-UHFFFAOYSA-N	0	0	284.359	4.169	20	30		CIEDRN
C=CCCC1(c2nc(C[C@@H](C)c3ccccc3)no2)CC1	ZINC000569530118	327194282	/nfs/dbraw/zinc/19/42/82/327194282.db2.gz	HKVGUKGZLFJUFL-CQSZACIVSA-N	0	0	282.387	4.414	20	30		CIEDRN
C=C(C)CN(C)C(=O)Nc1ccc(OCCC)c(Cl)c1	ZINC000181623115	327211422	/nfs/dbraw/zinc/21/14/22/327211422.db2.gz	HCWCMIUVPGPPNR-UHFFFAOYSA-N	0	0	296.798	4.169	20	30		CIEDRN
CC(C)C[C@](C)(C#N)NC(=O)[C@@H]1CC[C@H]2CCCC[C@H]2C1	ZINC000533876817	327229757	/nfs/dbraw/zinc/22/97/57/327229757.db2.gz	RBZKUNGNFGJCMT-KYHPRHEASA-N	0	0	290.451	4.037	20	30		CIEDRN
CC(C)C[C@](C)(C#N)NC(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1	ZINC000533876812	327229883	/nfs/dbraw/zinc/22/98/83/327229883.db2.gz	RBZKUNGNFGJCMT-BVIKNXMNSA-N	0	0	290.451	4.037	20	30		CIEDRN
CC(C)C[C@](C)(C#N)NC(=O)[C@@H]1CC[C@@H]2CCCC[C@H]2C1	ZINC000533876819	327229887	/nfs/dbraw/zinc/22/98/87/327229887.db2.gz	RBZKUNGNFGJCMT-LISAXSMJSA-N	0	0	290.451	4.037	20	30		CIEDRN
CC(C)C[C@](C)(C#N)NC(=O)[C@@H]1CC[C@H]2CCCC[C@@H]2C1	ZINC000533876821	327229888	/nfs/dbraw/zinc/22/98/88/327229888.db2.gz	RBZKUNGNFGJCMT-YFHUEUNASA-N	0	0	290.451	4.037	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1cccc(C)c1)c1ccccc1	ZINC000533882663	327235883	/nfs/dbraw/zinc/23/58/83/327235883.db2.gz	UUDPXTJLKJHKIK-HNNXBMFYSA-N	0	0	265.356	4.293	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc([C@@H](OCC)c2ccccc2)no1	ZINC000573763938	327256299	/nfs/dbraw/zinc/25/62/99/327256299.db2.gz	UJWJRLBFJFJAPJ-HIFRSBDPSA-N	0	0	286.375	4.265	20	30		CIEDRN
C=C[C@@H](CC(=O)N1C[C@@H](C)c2ccccc21)c1ccccc1	ZINC000559667234	327257386	/nfs/dbraw/zinc/25/73/86/327257386.db2.gz	WOPNETNRSLPFLV-CVEARBPZSA-N	0	0	291.394	4.497	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@H]1CCC[C@@H](C)C1)c1ccccc1	ZINC000533888771	327266859	/nfs/dbraw/zinc/26/68/59/327266859.db2.gz	IZGTWABEDKQHSW-INMHGKMJSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CCCCCCSCc1ccc(S(C)(=O)=O)cc1	ZINC000559951815	327273431	/nfs/dbraw/zinc/27/34/31/327273431.db2.gz	GBQGTFUKPCKWIV-UHFFFAOYSA-N	0	0	298.473	4.070	20	30		CIEDRN
C=CCOc1ccccc1-c1nc(C(C)(C)CC=C)no1	ZINC000560008561	327276122	/nfs/dbraw/zinc/27/61/22/327276122.db2.gz	STDVHPBHYQBHPU-UHFFFAOYSA-N	0	0	284.359	4.155	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H]2[C@@H](C)[C@@H]2c2ccccc2)n1	ZINC000560024376	327278085	/nfs/dbraw/zinc/27/80/85/327278085.db2.gz	SZDNPDOUWLQENJ-NWANDNLSSA-N	0	0	282.387	4.440	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2coc3ccc(OC)cc23)n1	ZINC000560023671	327278123	/nfs/dbraw/zinc/27/81/23/327278123.db2.gz	GPFWXYXIRFSUOW-UHFFFAOYSA-N	0	0	298.342	4.345	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H](F)Cc2ccccc2)n1	ZINC000560024071	327278256	/nfs/dbraw/zinc/27/82/56/327278256.db2.gz	HTPVYYLBDHLKKS-CYBMUJFWSA-N	0	0	274.339	4.177	20	30		CIEDRN
C=CCC(C)(C)c1noc(/C=C\c2ccccc2)n1	ZINC000560026215	327278320	/nfs/dbraw/zinc/27/83/20/327278320.db2.gz	FTNVAZQNZCFCDX-KHPPLWFESA-N	0	0	254.333	4.094	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ccc(C(=O)CC)cc2)n1	ZINC000560029425	327278882	/nfs/dbraw/zinc/27/88/82/327278882.db2.gz	TWQNILPOGFMXPY-UHFFFAOYSA-N	0	0	284.359	4.183	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N(C)[C@H]1CCCc2ccccc21	ZINC000560033333	327278997	/nfs/dbraw/zinc/27/89/97/327278997.db2.gz	APVOLCNDWLBHII-FUHWJXTLSA-N	0	0	271.404	4.125	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)NCCCCc1ccc(Cl)s1	ZINC000560112264	327284491	/nfs/dbraw/zinc/28/44/91/327284491.db2.gz	FRDXOWWZMAKJIR-OAHLLOKOSA-N	0	0	299.867	4.443	20	30		CIEDRN
Cc1cccc(/C=C/c2ccncc2C#N)c1OC(F)F	ZINC000560422017	327306551	/nfs/dbraw/zinc/30/65/51/327306551.db2.gz	ZSMIUQAATHZACP-AATRIKPKSA-N	0	0	286.281	4.034	20	30		CIEDRN
C=C(C)CCc1noc([C@@H](C)Oc2ccc3c(c2)CCC3)n1	ZINC000560456625	327309347	/nfs/dbraw/zinc/30/93/47/327309347.db2.gz	XVDLDISKGYGILW-CYBMUJFWSA-N	0	0	298.386	4.207	20	30		CIEDRN
C=C(C)CCc1noc(-c2scnc2C2CCCC2)n1	ZINC000560456303	327309414	/nfs/dbraw/zinc/30/94/14/327309414.db2.gz	FRNMNFXTEBZABM-UHFFFAOYSA-N	0	0	289.404	4.359	20	30		CIEDRN
CC(C)(C)[C@H]1CCC[C@@H](NC(=O)CC(C)(C)C#N)CC1	ZINC000507187796	332794454	/nfs/dbraw/zinc/79/44/54/332794454.db2.gz	MAHJCXASIDVAMM-UONOGXRCSA-N	0	0	278.440	4.037	20	30		CIEDRN
CN(Cc1cccc(-c2ccccc2)c1)CC(C)(C)C#N	ZINC000560569490	327325536	/nfs/dbraw/zinc/32/55/36/327325536.db2.gz	KBFJKHHXETUHKS-UHFFFAOYSA-N	0	0	278.399	4.335	20	30		CIEDRN
CN(Cc1c(Cl)oc2ccccc21)CC(C)(C)C#N	ZINC000560568815	327325640	/nfs/dbraw/zinc/32/56/40/327325640.db2.gz	JCKFROOBEPNNKL-UHFFFAOYSA-N	0	0	276.767	4.068	20	30		CIEDRN
CCNc1ccc(C#N)cc1NC(=O)[C@@H](C)CC1CCCC1	ZINC000560587658	327328600	/nfs/dbraw/zinc/32/86/00/327328600.db2.gz	AAUNEJJHCFFBQY-ZDUSSCGKSA-N	0	0	299.418	4.145	20	30		CIEDRN
Cc1csc(NC(=O)c2ccc(C(C)(C)C)cc2)c1C#N	ZINC000569618336	327331506	/nfs/dbraw/zinc/33/15/06/327331506.db2.gz	AXJQYADZMASLNJ-UHFFFAOYSA-N	0	0	298.411	4.478	20	30		CIEDRN
C[C@@H]1C[C@H]1c1ccc(CNc2ccc(F)cc2C#N)o1	ZINC000097635461	327345250	/nfs/dbraw/zinc/34/52/50/327345250.db2.gz	CWFNPLXRKCUEKL-QMTHXVAHSA-N	0	0	270.307	4.026	20	30		CIEDRN
C=CC[C@H](C)NC(=O)c1coc2ccc(C(C)C)cc21	ZINC000561146158	327369775	/nfs/dbraw/zinc/36/97/75/327369775.db2.gz	GQRPSBAANIJBFL-LBPRGKRZSA-N	0	0	271.360	4.251	20	30		CIEDRN
Cc1ccc(C#N)c(S[C@@H](C)c2ccc(F)cc2)n1	ZINC000561158558	327370366	/nfs/dbraw/zinc/37/03/66/327370366.db2.gz	GFDLPZCSQLIKFB-NSHDSACASA-N	0	0	272.348	4.254	20	30		CIEDRN
Cc1ccc(C)c(CSc2nc(C)ccc2C#N)c1	ZINC000561209521	327375004	/nfs/dbraw/zinc/37/50/04/327375004.db2.gz	IEFVHUKWFZWSSJ-UHFFFAOYSA-N	0	0	268.385	4.171	20	30		CIEDRN
C[C@H]1CCC[C@@H](C(=O)Nc2ccc(C(C)(C)C#N)cc2)C1	ZINC000150782021	327377666	/nfs/dbraw/zinc/37/76/66/327377666.db2.gz	RRRZINYCQKJUBT-UONOGXRCSA-N	0	0	284.403	4.253	20	30		CIEDRN
N#CC1(c2nc(-c3cccc4ccccc43)no2)CCCC1	ZINC000531117377	327377950	/nfs/dbraw/zinc/37/79/50/327377950.db2.gz	CFPSGUTWUFZMDC-UHFFFAOYSA-N	0	0	289.338	4.225	20	30		CIEDRN
CN(C(=O)c1ccc(C(C)(C)C)s1)c1cccc(C#N)c1	ZINC000150866427	327392636	/nfs/dbraw/zinc/39/26/36/327392636.db2.gz	PNOPPRDUEKLKLO-UHFFFAOYSA-N	0	0	298.411	4.194	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc([C@@H]2C[C@H]2c2ccccc2)no1	ZINC000566587257	327414782	/nfs/dbraw/zinc/41/47/82/327414782.db2.gz	HZFAOKDHDNANMZ-VBQJREDUSA-N	0	0	268.360	4.194	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)CC2CCCCCC2)s1	ZINC000427691737	327415143	/nfs/dbraw/zinc/41/51/43/327415143.db2.gz	YSCRHKDWUJVAIC-UHFFFAOYSA-N	0	0	290.432	4.481	20	30		CIEDRN
C=CCN(C)C(=O)Nc1ccc(-c2ncc(C(C)C)o2)cc1	ZINC000157438645	327432952	/nfs/dbraw/zinc/43/29/52/327432952.db2.gz	CAPFRNYPWUZSKZ-UHFFFAOYSA-N	0	0	299.374	4.115	20	30		CIEDRN
C=CCC(CC=C)c1nc(-c2cc(F)cc(F)c2)no1	ZINC000562194081	327455196	/nfs/dbraw/zinc/45/51/96/327455196.db2.gz	UFSIJCDEXQXTOE-UHFFFAOYSA-N	0	0	276.286	4.251	20	30		CIEDRN
CC1(C)Cc2cccc(N[C@@H](C#N)C3CCCCC3)c2O1	ZINC000562304651	327465672	/nfs/dbraw/zinc/46/56/72/327465672.db2.gz	OSSGDNNKAPOVGC-INIZCTEOSA-N	0	0	284.403	4.284	20	30		CIEDRN
N#Cc1ccc(CNc2ccccc2CC(F)(F)F)s1	ZINC000151783794	327505450	/nfs/dbraw/zinc/50/54/50/327505450.db2.gz	FXSVLGJNWJMXIY-UHFFFAOYSA-N	0	0	296.317	4.337	20	30		CIEDRN
C=CCCc1noc([C@@H](C)Cc2cncc3ccccc32)n1	ZINC000562793200	327515376	/nfs/dbraw/zinc/51/53/76/327515376.db2.gz	PZWOXWGSPOGYCK-ZDUSSCGKSA-N	0	0	293.370	4.083	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2cc(C)ccc2F)no1	ZINC000569649133	327530639	/nfs/dbraw/zinc/53/06/39/327530639.db2.gz	VMDKHKZBLAXTAM-LLVKDONJSA-N	0	0	260.312	4.254	20	30		CIEDRN
Cc1cc(N2CCC[C@@H]2c2cccc(Cl)c2)cc(C#N)n1	ZINC000570115187	327570226	/nfs/dbraw/zinc/57/02/26/327570226.db2.gz	MYKLOXNNYZFPSQ-QGZVFWFLSA-N	0	0	297.789	4.257	20	30		CIEDRN
C=CCCCCCNC(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1	ZINC000570525809	327597743	/nfs/dbraw/zinc/59/77/43/327597743.db2.gz	TZRVDOIDRHMJPA-OLZOCXBDSA-N	0	0	291.357	4.218	20	30		CIEDRN
CN(C(=O)[C@@H]1CC[C@H]2CCCC[C@H]2C1)c1cccc(C#N)c1	ZINC000318138949	327605889	/nfs/dbraw/zinc/60/58/89/327605889.db2.gz	YHLYBKIRHCUDJU-IXDOHACOSA-N	0	0	296.414	4.128	20	30		CIEDRN
N#Cc1cc(NCc2cccc(C(F)(F)F)c2)ccc1F	ZINC000051635063	328626345	/nfs/dbraw/zinc/62/63/45/328626345.db2.gz	CJOWFDPYCXBQCO-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
N#Cc1cccc(-c2nc(-c3coc4ccccc34)no2)c1	ZINC000389136246	328627318	/nfs/dbraw/zinc/62/73/18/328627318.db2.gz	LNVGSMLERAKOTK-UHFFFAOYSA-N	0	0	287.278	4.021	20	30		CIEDRN
CC1(C)CCC[C@H](CC(=O)Nc2ccc(F)cc2C#N)C1	ZINC000535969015	328650104	/nfs/dbraw/zinc/65/01/04/328650104.db2.gz	OSAREBXCAUCNPH-GFCCVEGCSA-N	0	0	288.366	4.242	20	30		CIEDRN
CC(C)(C#N)c1ccc(Nc2ncc(C#N)cc2Cl)cc1	ZINC000114708732	328654985	/nfs/dbraw/zinc/65/49/85/328654985.db2.gz	ASKCXFBCYFDKRW-UHFFFAOYSA-N	0	0	296.761	4.151	20	30		CIEDRN
N#Cc1ccc(OCCCOc2cccc(Cl)c2)cc1	ZINC000034674991	328685630	/nfs/dbraw/zinc/68/56/30/328685630.db2.gz	ZPDSHMLKYXPWOH-UHFFFAOYSA-N	0	0	287.746	4.060	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N[C@@H]1CCC[C@@H](F)C1	ZINC000519823691	328698378	/nfs/dbraw/zinc/69/83/78/328698378.db2.gz	GZWVNVSWTSRZJD-HUUCEWRRSA-N	0	0	290.382	4.207	20	30		CIEDRN
CCc1cnc(CS[C@@H](C)c2ccc(C#N)cc2)o1	ZINC000532114378	328699517	/nfs/dbraw/zinc/69/95/17/328699517.db2.gz	JIVIPNZDFWHGHC-NSHDSACASA-N	0	0	272.373	4.103	20	30		CIEDRN
C=CCN(Cc1ccc(OC)cc1)C(=O)CC[C@@H](C)CC	ZINC000507755708	332822130	/nfs/dbraw/zinc/82/21/30/332822130.db2.gz	DYAPMGVDKSIZPP-HNNXBMFYSA-N	0	0	289.419	4.036	20	30		CIEDRN
CC[C@H](CC(=O)Nc1sccc1C#N)c1ccccc1	ZINC000103358333	328767824	/nfs/dbraw/zinc/76/78/24/328767824.db2.gz	HERVKIVFQWZCSC-GFCCVEGCSA-N	0	0	284.384	4.142	20	30		CIEDRN
CC(C)(CCC#N)CN1CCN(CC2CC2)c2ccccc21	ZINC000507697881	332819460	/nfs/dbraw/zinc/81/94/60/332819460.db2.gz	LLFMXJSXTAUXDG-UHFFFAOYSA-N	0	0	297.446	4.053	20	30		CIEDRN
Cc1c(NCc2ccc(C#N)cc2)cccc1C(F)(F)F	ZINC000532369391	328774963	/nfs/dbraw/zinc/77/49/63/328774963.db2.gz	SZUFZBAEVXXKHL-UHFFFAOYSA-N	0	0	290.288	4.498	20	30		CIEDRN
CO[C@H](CNc1ccc(C#N)cc1Cl)c1ccccc1	ZINC000379214520	328795300	/nfs/dbraw/zinc/79/53/00/328795300.db2.gz	OCANEKQRQWBCAI-MRXNPFEDSA-N	0	0	286.762	4.011	20	30		CIEDRN
C=C[C@@H](CC(=O)N(C)[C@H](C)CCCC)c1ccccc1	ZINC000580374152	328797849	/nfs/dbraw/zinc/79/78/49/328797849.db2.gz	AJNNFHPBSLKUQD-CVEARBPZSA-N	0	0	273.420	4.383	20	30		CIEDRN
C[C@H](CCNc1ccc(CC#N)cc1)c1ccccc1	ZINC000043533705	328802365	/nfs/dbraw/zinc/80/23/65/328802365.db2.gz	CXRDTXAVDGGGSE-OAHLLOKOSA-N	0	0	264.372	4.358	20	30		CIEDRN
CCCN(CCCCC#N)c1ccc(Cl)cc1	ZINC000532713611	328806736	/nfs/dbraw/zinc/80/67/36/328806736.db2.gz	HXSNSBGODLLRQP-UHFFFAOYSA-N	0	0	250.773	4.250	20	30		CIEDRN
C[C@@H](Nc1cccc2cc[nH]c21)c1cccc(C#N)c1	ZINC000526944355	328815782	/nfs/dbraw/zinc/81/57/82/328815782.db2.gz	CGZJQEYNAJSWAN-GFCCVEGCSA-N	0	0	261.328	4.213	20	30		CIEDRN
CCc1cnc(CS[C@@H](C)c2cccc(C#N)c2)o1	ZINC000526949122	328816244	/nfs/dbraw/zinc/81/62/44/328816244.db2.gz	UGCUPBWYXQXZAC-NSHDSACASA-N	0	0	272.373	4.103	20	30		CIEDRN
COc1cc(C)c([C@@H](C)Nc2ccc(C#N)cc2)cc1OC	ZINC000301111630	328826382	/nfs/dbraw/zinc/82/63/82/328826382.db2.gz	OWSWJWHLTVOPGX-CYBMUJFWSA-N	0	0	296.370	4.057	20	30		CIEDRN
CC[C@@H](CNc1ccc([N+](=O)[O-])c(C#N)c1)c1ccccc1	ZINC000302161148	328831090	/nfs/dbraw/zinc/83/10/90/328831090.db2.gz	HKERMHZUOOROHZ-ZDUSSCGKSA-N	0	0	295.342	4.072	20	30		CIEDRN
CC[C@H](CNc1ccc([N+](=O)[O-])c(C#N)c1)c1ccccc1	ZINC000302161147	328831121	/nfs/dbraw/zinc/83/11/21/328831121.db2.gz	HKERMHZUOOROHZ-CYBMUJFWSA-N	0	0	295.342	4.072	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@H]1CCC(C)(C)C1	ZINC000514136548	328833831	/nfs/dbraw/zinc/83/38/31/328833831.db2.gz	RENQTSDCXYFGDT-ZDUSSCGKSA-N	0	0	277.433	4.089	20	30		CIEDRN
C=C(C)CCS[C@H](C)C(=O)Nc1ccccc1C	ZINC000507802413	332824623	/nfs/dbraw/zinc/82/46/23/332824623.db2.gz	UXPKBPQAPJMSQO-CYBMUJFWSA-N	0	0	263.406	4.021	20	30		CIEDRN
N#Cc1ccc(CSCCCCCF)cc1F	ZINC000582255910	328851891	/nfs/dbraw/zinc/85/18/91/328851891.db2.gz	SELFUYXRWGWIRR-UHFFFAOYSA-N	0	0	255.333	4.070	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)c1cc2sccc2s1	ZINC000532892772	328853237	/nfs/dbraw/zinc/85/32/37/328853237.db2.gz	CNWUOHFAQXVPAH-UHFFFAOYSA-N	0	0	298.392	4.395	20	30		CIEDRN
C=CCC[C@@H](NC(=O)c1occ2c1CCC2)c1ccccc1	ZINC000354209712	328857531	/nfs/dbraw/zinc/85/75/31/328857531.db2.gz	UNRDIUFFVMIRRK-QGZVFWFLSA-N	0	0	295.382	4.206	20	30		CIEDRN
C=C(C)CCSCCC(=O)Nc1ccc(Cl)cc1	ZINC000507820019	332826452	/nfs/dbraw/zinc/82/64/52/332826452.db2.gz	YVTOVOMEMWUXIE-UHFFFAOYSA-N	0	0	283.824	4.368	20	30		CIEDRN
C=C(C)CCSCC(=O)N[C@H](C)c1ccc(CC)cc1	ZINC000507826243	332826727	/nfs/dbraw/zinc/82/67/27/332826727.db2.gz	VVRARSBMVXYKDO-CQSZACIVSA-N	0	0	291.460	4.126	20	30		CIEDRN
C=C(C)CCSCC(=O)Nc1cccc(C(C)C)c1	ZINC000507833701	332826992	/nfs/dbraw/zinc/82/69/92/332826992.db2.gz	ODWGPCNPPPJFNH-UHFFFAOYSA-N	0	0	277.433	4.448	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H]2CCc3cc(C)ccc3O2)n1	ZINC000582374779	328975107	/nfs/dbraw/zinc/97/51/07/328975107.db2.gz	FJZAMTRIJFVBAS-HNNXBMFYSA-N	0	0	298.386	4.298	20	30		CIEDRN
C=CCC1(C(=O)N[C@H](C)[C@@H](C)c2ccccc2)CCC1	ZINC000188707960	329006157	/nfs/dbraw/zinc/00/61/57/329006157.db2.gz	YHUBDVPYPOFCOZ-HUUCEWRRSA-N	0	0	271.404	4.041	20	30		CIEDRN
CCC[C@H](C)CC(=O)N1CC=C(c2ccc(C#N)cc2)CC1	ZINC000377282288	329009676	/nfs/dbraw/zinc/00/96/76/329009676.db2.gz	CVRPETOTOLRJNX-HNNXBMFYSA-N	0	0	296.414	4.000	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@@H]1c1ccc(OC)c(C)c1	ZINC000378645408	329057921	/nfs/dbraw/zinc/05/79/21/329057921.db2.gz	FBVJVGUOUWLXCB-MRXNPFEDSA-N	0	0	287.403	4.023	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1cc2cc(Cl)sc2[nH]1	ZINC000582459638	329062173	/nfs/dbraw/zinc/06/21/73/329062173.db2.gz	WFFNRTGMUKOOJR-VIFPVBQESA-N	0	0	296.823	4.357	20	30		CIEDRN
C=CCCC(=O)N1Cc2ccccc2[C@H](c2ccccc2)C1	ZINC000171428009	329074035	/nfs/dbraw/zinc/07/40/35/329074035.db2.gz	XIMFYWIXIBEFQJ-IBGZPJMESA-N	0	0	291.394	4.127	20	30		CIEDRN
C[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)C1CCCC1	ZINC000172207899	329083782	/nfs/dbraw/zinc/08/37/82/329083782.db2.gz	OWYVGEBYVMNHJE-ZDUSSCGKSA-N	0	0	299.418	4.188	20	30		CIEDRN
Cc1csc(CNc2cc(Cl)ccc2C#N)c1	ZINC000393319027	329085611	/nfs/dbraw/zinc/08/56/11/329085611.db2.gz	ZBLCDWPAJDZZAN-UHFFFAOYSA-N	0	0	262.765	4.194	20	30		CIEDRN
N#Cc1c(F)cccc1S[C@H](C#N)C1CCCCC1	ZINC000583704854	329086432	/nfs/dbraw/zinc/08/64/32/329086432.db2.gz	UFJAALWISUEPIC-OAHLLOKOSA-N	0	0	274.364	4.262	20	30		CIEDRN
C=C(C)CCc1noc([C@H](C)c2ccc(F)c(F)c2)n1	ZINC000508595668	332842722	/nfs/dbraw/zinc/84/27/22/332842722.db2.gz	ONKMIUCTSCSOCV-SNVBAGLBSA-N	0	0	278.302	4.008	20	30		CIEDRN
C=C(C)CCc1noc(CCCc2ccc(F)c(F)c2)n1	ZINC000508595720	332842751	/nfs/dbraw/zinc/84/27/51/332842751.db2.gz	PCYFSZHIDNYJIF-UHFFFAOYSA-N	0	0	292.329	4.032	20	30		CIEDRN
C=C(C)CCc1noc(C2(Cc3ccccc3)CCC2)n1	ZINC000508597974	332842926	/nfs/dbraw/zinc/84/29/26/332842926.db2.gz	YPUXMGWTRNDEAC-UHFFFAOYSA-N	0	0	282.387	4.243	20	30		CIEDRN
CCCNc1ccc(C#N)cc1NC(=O)c1ccc(C)s1	ZINC000173040879	329142642	/nfs/dbraw/zinc/14/26/42/329142642.db2.gz	PEGLJUHWVWGEJZ-UHFFFAOYSA-N	0	0	299.399	4.002	20	30		CIEDRN
C=C(C)CCc1noc([C@H](SCC)C(C)C)n1	ZINC000508599447	332843260	/nfs/dbraw/zinc/84/32/60/332843260.db2.gz	MFVPWKOANULPLD-GFCCVEGCSA-N	0	0	254.399	4.029	20	30		CIEDRN
C=C(C)CCc1noc([C@H](C)c2cccc(C)c2)n1	ZINC000508598933	332843266	/nfs/dbraw/zinc/84/32/66/332843266.db2.gz	JWQUTZRXRICJFU-CYBMUJFWSA-N	0	0	256.349	4.039	20	30		CIEDRN
C=CCCS[C@H](C)c1nc(Cc2ccccc2)no1	ZINC000173834016	329152201	/nfs/dbraw/zinc/15/22/01/329152201.db2.gz	RWOFZIKZVCBCNF-GFCCVEGCSA-N	0	0	274.389	4.031	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@@H]1c1ccccc1Cl	ZINC000175373547	329164681	/nfs/dbraw/zinc/16/46/81/329164681.db2.gz	SDPJFBGNPHGXGI-OAHLLOKOSA-N	0	0	277.795	4.360	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@H]1c1ccc(Cl)cc1	ZINC000175236730	329166457	/nfs/dbraw/zinc/16/64/57/329166457.db2.gz	BFBXSUWCRLLXLK-HNNXBMFYSA-N	0	0	277.795	4.360	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc2oc(C3CC3)nc2c1	ZINC000175265309	329166458	/nfs/dbraw/zinc/16/64/58/329166458.db2.gz	KXQIEYMWKGUBGF-UHFFFAOYSA-N	0	0	270.332	4.000	20	30		CIEDRN
C=CCCCC(=O)Nc1cccc(Oc2ccncc2)c1	ZINC000175633497	329167490	/nfs/dbraw/zinc/16/74/90/329167490.db2.gz	QMVZXUAOBGIYSD-UHFFFAOYSA-N	0	0	282.343	4.169	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(F)cc1C(F)(F)F	ZINC000175673273	329170121	/nfs/dbraw/zinc/17/01/21/329170121.db2.gz	AWBMONUFHGOSPT-UHFFFAOYSA-N	0	0	275.245	4.139	20	30		CIEDRN
C=CCCCC(=O)N1C[C@H](C)C[C@H]1c1ccccc1F	ZINC000176008050	329173161	/nfs/dbraw/zinc/17/31/61/329173161.db2.gz	MJSIKFPYMIRFRD-CJNGLKHVSA-N	0	0	275.367	4.092	20	30		CIEDRN
C=C(C)CCc1noc(-c2csc(Br)c2)n1	ZINC000508624799	332844729	/nfs/dbraw/zinc/84/47/29/332844729.db2.gz	GNZGHTUZFYEEHK-UHFFFAOYSA-N	0	0	299.193	4.069	20	30		CIEDRN
C=CCCCC(=O)N1CC[C@@H](C)[C@@H]1c1cccc(F)c1	ZINC000176339092	329174546	/nfs/dbraw/zinc/17/45/46/329174546.db2.gz	HGANKNMWJUODSO-CXAGYDPISA-N	0	0	275.367	4.092	20	30		CIEDRN
C=CCCCC(=O)N[C@H](C)c1ccc(-c2cccnc2)cc1	ZINC000176494639	329175315	/nfs/dbraw/zinc/17/53/15/329175315.db2.gz	QTKDKHXLUXVHMQ-OAHLLOKOSA-N	0	0	294.398	4.282	20	30		CIEDRN
Cc1ccccc1[C@@H](C)CC(=O)N[C@@H](C#N)C1CCCCC1	ZINC000176596991	329177199	/nfs/dbraw/zinc/17/71/99/329177199.db2.gz	QKJKNWSVNAMSRM-YJBOKZPZSA-N	0	0	298.430	4.077	20	30		CIEDRN
C[C@@H](c1ccc(Cl)cc1)[S@@](=O)CCCC(C)(C)C#N	ZINC000177112646	329181186	/nfs/dbraw/zinc/18/11/86/329181186.db2.gz	TXHSYTWFNYSDLE-BUXKBTBVSA-N	0	0	297.851	4.480	20	30		CIEDRN
CO[C@H](C)c1nc(CSc2ccccc2C#N)cs1	ZINC000177307241	329186097	/nfs/dbraw/zinc/18/60/97/329186097.db2.gz	BTCQAGLQIUJPMN-SNVBAGLBSA-N	0	0	290.413	4.014	20	30		CIEDRN
C=CCCCC(=O)N1CCCCC[C@@H]1c1ccc(C)o1	ZINC000177878909	329187119	/nfs/dbraw/zinc/18/71/19/329187119.db2.gz	CXUQFVKCNAACCL-OAHLLOKOSA-N	0	0	275.392	4.388	20	30		CIEDRN
CC(C)OCc1ccc(NCc2cc(C#N)cs2)cc1	ZINC000177690103	329189231	/nfs/dbraw/zinc/18/92/31/329189231.db2.gz	AROVGOWGVMRUHJ-UHFFFAOYSA-N	0	0	286.400	4.157	20	30		CIEDRN
CC(C)(C)[C@@H]1C[C@@H](Nc2cc(Cl)ccc2C#N)CCO1	ZINC000487070195	329195408	/nfs/dbraw/zinc/19/54/08/329195408.db2.gz	CCCJMSGORZFMRY-ZFWWWQNUSA-N	0	0	292.810	4.217	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1ccc2ccc(OC)cc2c1	ZINC000508644882	332845946	/nfs/dbraw/zinc/84/59/46/332845946.db2.gz	HTHXARLVCWURBH-KRWDZBQOSA-N	0	0	295.382	4.029	20	30		CIEDRN
Cc1scc(C(=O)Nc2ccc(Cl)c(C#N)c2)c1C	ZINC000179700246	329211626	/nfs/dbraw/zinc/21/16/26/329211626.db2.gz	MVMAGFVQDKOHKE-UHFFFAOYSA-N	0	0	290.775	4.142	20	30		CIEDRN
C#CCCCCC(=O)N1CCC[C@H]1c1cccc(Cl)c1	ZINC000179778356	329212124	/nfs/dbraw/zinc/21/21/24/329212124.db2.gz	MSLMFXKOUVFIBZ-INIZCTEOSA-N	0	0	289.806	4.197	20	30		CIEDRN
C=C(C)CCc1noc(-c2ccc(Cl)c(F)c2)n1	ZINC000508670483	332846973	/nfs/dbraw/zinc/84/69/73/332846973.db2.gz	HOZWPJJIRZAETF-UHFFFAOYSA-N	0	0	266.703	4.038	20	30		CIEDRN
C=C(C)CCc1noc(C2(c3ccc(Cl)cc3)CC2)n1	ZINC000508672294	332846974	/nfs/dbraw/zinc/84/69/74/332846974.db2.gz	RFRMYLHBZITWEE-UHFFFAOYSA-N	0	0	288.778	4.312	20	30		CIEDRN
C=C(C)CCc1noc(COc2cccc(Cl)c2C)n1	ZINC000508685373	332847271	/nfs/dbraw/zinc/84/72/71/332847271.db2.gz	GBBZXASZXADMQI-UHFFFAOYSA-N	0	0	292.766	4.119	20	30		CIEDRN
C=C(C)CCc1noc([C@@H](C)Cc2ccc(C)cc2)n1	ZINC000508682808	332847274	/nfs/dbraw/zinc/84/72/74/332847274.db2.gz	XIDGEPZZPKPSMG-AWEZNQCLSA-N	0	0	270.376	4.233	20	30		CIEDRN
C[C@@H](Nc1cccc(-c2cnco2)c1)c1ccc(C#N)s1	ZINC000182831034	329242439	/nfs/dbraw/zinc/24/24/39/329242439.db2.gz	ZIKJQDHNCXUPHD-LLVKDONJSA-N	0	0	295.367	4.448	20	30		CIEDRN
C[C@@H]1CCCN(C(=O)c2sccc2C#N)c2ccccc21	ZINC000183941153	329254658	/nfs/dbraw/zinc/25/46/58/329254658.db2.gz	AOOPQRCJYJEHOH-GFCCVEGCSA-N	0	0	296.395	4.164	20	30		CIEDRN
Cc1ccc(CSCc2ccc(F)cc2C#N)c(C)n1	ZINC000184821713	329263120	/nfs/dbraw/zinc/26/31/20/329263120.db2.gz	GCIHWEBXDDHKGG-UHFFFAOYSA-N	0	0	286.375	4.143	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](c1ccco1)c1ccccc1	ZINC000185059466	329265233	/nfs/dbraw/zinc/26/52/33/329265233.db2.gz	OBRAYMWLQODAPZ-WMLDXEAASA-N	0	0	283.371	4.088	20	30		CIEDRN
Cc1oc2ccccc2c1C(=O)Nc1ccc(F)c(C#N)c1	ZINC000185456830	329273787	/nfs/dbraw/zinc/27/37/87/329273787.db2.gz	FIQJIBHAWKSLML-UHFFFAOYSA-N	0	0	294.285	4.004	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2ccccc2OC(F)F)no1	ZINC000583050546	329303859	/nfs/dbraw/zinc/30/38/59/329303859.db2.gz	WYZSIPKUYRQCSR-JTQLQIEISA-N	0	0	294.301	4.408	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2cccc(C)c2F)no1	ZINC000583109839	329312789	/nfs/dbraw/zinc/31/27/89/329312789.db2.gz	XLAHPYKUIOEKBQ-NSHDSACASA-N	0	0	260.312	4.254	20	30		CIEDRN
CCOc1cccc(N[C@@H]2CCc3ccc(C#N)cc32)c1	ZINC000583113228	329313010	/nfs/dbraw/zinc/31/30/10/329313010.db2.gz	BWIGTESIYJHHIX-GOSISDBHSA-N	0	0	278.355	4.056	20	30		CIEDRN
COc1cc(C#N)ccc1OCc1ccc(C(F)F)cc1	ZINC000185780785	329331804	/nfs/dbraw/zinc/33/18/04/329331804.db2.gz	NEHMJHBMCQQGQN-UHFFFAOYSA-N	0	0	289.281	4.083	20	30		CIEDRN
C=CCC[C@@H](NC(=O)N1CCCC2(CC2)C1)c1ccccc1	ZINC000185880173	329334522	/nfs/dbraw/zinc/33/45/22/329334522.db2.gz	KTOILHKRLMVOBR-QGZVFWFLSA-N	0	0	298.430	4.280	20	30		CIEDRN
C=C(C)[C@@H](NCc1csc(C)n1)c1ccc(F)c(F)c1	ZINC000187373823	329356900	/nfs/dbraw/zinc/35/69/00/329356900.db2.gz	LXYOJRLBZVIYDN-OAHLLOKOSA-N	0	0	294.370	4.137	20	30		CIEDRN
C=C(C)[C@H](NCc1csc(C)n1)c1ccc(F)c(F)c1	ZINC000187373838	329356958	/nfs/dbraw/zinc/35/69/58/329356958.db2.gz	LXYOJRLBZVIYDN-HNNXBMFYSA-N	0	0	294.370	4.137	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc3oc(C4CC4)nc3c2)CCC1	ZINC000188502665	329369413	/nfs/dbraw/zinc/36/94/13/329369413.db2.gz	WEGQUTBQRPMVMN-UHFFFAOYSA-N	0	0	296.370	4.390	20	30		CIEDRN
N#Cc1c(C(F)F)cccc1N1CCc2ccsc2C1	ZINC000583215080	329370403	/nfs/dbraw/zinc/37/04/03/329370403.db2.gz	YINOXVQPBRTCKC-UHFFFAOYSA-N	0	0	290.338	4.120	20	30		CIEDRN
CC[C@@H](C)CC(=O)Nc1nc(-c2cccc(C#N)c2)cs1	ZINC000189711467	329385579	/nfs/dbraw/zinc/38/55/79/329385579.db2.gz	UAZQMKYYHQCCRZ-LLVKDONJSA-N	0	0	299.399	4.056	20	30		CIEDRN
CC(C)(C#N)CCCC[S@@](=O)c1ccccc1Cl	ZINC000232526275	329387330	/nfs/dbraw/zinc/38/73/30/329387330.db2.gz	IMHVNDDFPKSFNZ-GOSISDBHSA-N	0	0	283.824	4.168	20	30		CIEDRN
CC(C)(C#N)CCCCOc1ccc(C#N)cc1Cl	ZINC000232519791	329387471	/nfs/dbraw/zinc/38/74/71/329387471.db2.gz	BAXBPMHLUFAFED-UHFFFAOYSA-N	0	0	276.767	4.311	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1cccnc1C	ZINC000189871266	329388926	/nfs/dbraw/zinc/38/89/26/329388926.db2.gz	BHJZWNZGLWGLEG-UHFFFAOYSA-N	0	0	294.398	4.494	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)COC(C)(C)C	ZINC000189907864	329390006	/nfs/dbraw/zinc/39/00/06/329390006.db2.gz	WLSSOQWCIFJFBC-UHFFFAOYSA-N	0	0	289.419	4.292	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@H](c1ccc(CC)cc1)C(C)C	ZINC000498128056	329392196	/nfs/dbraw/zinc/39/21/96/329392196.db2.gz	SEHBFWCXYKEUCG-KRWDZBQOSA-N	0	0	288.435	4.164	20	30		CIEDRN
N#CCCCSCc1cccc(C(F)(F)F)c1	ZINC000190869665	329401486	/nfs/dbraw/zinc/40/14/86/329401486.db2.gz	LWVPNYIIZHSFCA-UHFFFAOYSA-N	0	0	259.296	4.242	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NCc1noc(CC)n1	ZINC000190914106	329402896	/nfs/dbraw/zinc/40/28/96/329402896.db2.gz	GDCGIETZPIWFCQ-UHFFFAOYSA-N	0	0	285.391	4.096	20	30		CIEDRN
N#CCCCSCCc1cccc(OC(F)(F)F)c1	ZINC000190982715	329404149	/nfs/dbraw/zinc/40/41/49/329404149.db2.gz	YNBPIVLAHBZWQN-UHFFFAOYSA-N	0	0	289.322	4.165	20	30		CIEDRN
CCc1ccc(-c2nc(CN[C@H](CC)CC#N)cs2)cc1	ZINC000516978073	329412817	/nfs/dbraw/zinc/41/28/17/329412817.db2.gz	ACTYPNZAMUQKML-OAHLLOKOSA-N	0	0	299.443	4.154	20	30		CIEDRN
C=CCC1(C(=O)N2CCC[C@]3(CC=CCC3)C2)CCC1	ZINC000191815881	329420690	/nfs/dbraw/zinc/42/06/90/329420690.db2.gz	SWWABLGUJGLICX-QGZVFWFLSA-N	0	0	273.420	4.082	20	30		CIEDRN
CCN(C(=O)c1cccc(C#N)c1C)c1cccc(Cl)c1	ZINC000509089527	332858828	/nfs/dbraw/zinc/85/88/28/332858828.db2.gz	KOGAMBGSNSFPOP-UHFFFAOYSA-N	0	0	298.773	4.187	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1ccc2[nH]c(C)c(C)c2c1	ZINC000398288947	329441766	/nfs/dbraw/zinc/44/17/66/329441766.db2.gz	WZYXEWKEDJWWKG-LBPRGKRZSA-N	0	0	284.403	4.259	20	30		CIEDRN
N#CCc1ccc(COc2ccc(F)c(Cl)c2)cc1	ZINC000398967956	329446920	/nfs/dbraw/zinc/44/69/20/329446920.db2.gz	SSBDLCCYKBGXBG-UHFFFAOYSA-N	0	0	275.710	4.124	20	30		CIEDRN
C=C(C)CCNC(=O)Nc1ccc2oc(C(C)C)nc2c1	ZINC000583735740	329471323	/nfs/dbraw/zinc/47/13/23/329471323.db2.gz	NFGJTBVMYKHUOT-UHFFFAOYSA-N	0	0	287.363	4.039	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N1C[C@@H](C)c2ccccc21	ZINC000583758990	329474697	/nfs/dbraw/zinc/47/46/97/329474697.db2.gz	HYVJZOQRWBECIZ-ZIAGYGMSSA-N	0	0	272.392	4.065	20	30		CIEDRN
C=CCN(CC=C)Cc1nc(-c2ccc(C)cc2)cs1	ZINC000509264235	332862739	/nfs/dbraw/zinc/86/27/39/332862739.db2.gz	PEBJIRXXLQCJDR-UHFFFAOYSA-N	0	0	284.428	4.293	20	30		CIEDRN
N#C[C@H]1CC[C@@H](Nc2ccc(-c3cnc(C4CC4)o3)cc2)C1	ZINC000520790380	329542550	/nfs/dbraw/zinc/54/25/50/329542550.db2.gz	XUXVNBXQLTYIIV-BLLLJJGKSA-N	0	0	293.370	4.323	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1ccc(OCCCCC)cc1	ZINC000301995744	332864777	/nfs/dbraw/zinc/86/47/77/332864777.db2.gz	JIHZBVXOODPWSA-UHFFFAOYSA-N	0	0	289.419	4.294	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N(C)[C@H](CC)c1ccccc1OC	ZINC000425615871	329555097	/nfs/dbraw/zinc/55/50/97/329555097.db2.gz	ZLGQWXHCSUSYSP-OAHLLOKOSA-N	0	0	289.419	4.207	20	30		CIEDRN
Cc1nc(CCS[C@H](C)c2ccc(C#N)cc2)cs1	ZINC000124096827	329566745	/nfs/dbraw/zinc/56/67/45/329566745.db2.gz	MYDKAPBNPLATBU-LLVKDONJSA-N	0	0	288.441	4.360	20	30		CIEDRN
CCC(CC)[C@@H](C)C(=O)N(C)[C@@H](C)c1cccc(C#N)c1	ZINC000425135780	329605072	/nfs/dbraw/zinc/60/50/72/329605072.db2.gz	VXXLNRLUJMTZFJ-KGLIPLIRSA-N	0	0	286.419	4.150	20	30		CIEDRN
N#Cc1cccc(NCc2cnc(C3CCCC3)s2)c1	ZINC000132884614	329649427	/nfs/dbraw/zinc/64/94/27/329649427.db2.gz	TWNNYCSSKHBMOR-UHFFFAOYSA-N	0	0	283.400	4.284	20	30		CIEDRN
C[C@@H](c1ccc(Cn2ccc(C#N)c2)cc1)C(F)(F)F	ZINC000418928031	329699309	/nfs/dbraw/zinc/69/93/09/329699309.db2.gz	YBVLYCATCISFIS-NSHDSACASA-N	0	0	278.277	4.074	20	30		CIEDRN
C[C@H](Nc1ncccc1C#N)c1ccc(C2CC2)cc1	ZINC000419009595	329705631	/nfs/dbraw/zinc/70/56/31/329705631.db2.gz	WHRIBPRGUVXLGJ-LBPRGKRZSA-N	0	0	263.344	4.004	20	30		CIEDRN
CC(F)(F)CCOc1ccc(C#N)c2ccccc12	ZINC000419058949	329706931	/nfs/dbraw/zinc/70/69/31/329706931.db2.gz	WXVVHLQWPYDPHI-UHFFFAOYSA-N	0	0	261.271	4.136	20	30		CIEDRN
CC(C)N(Cc1nc(C#N)cs1)c1ccc(Cl)cc1	ZINC000419223029	329712147	/nfs/dbraw/zinc/71/21/47/329712147.db2.gz	LWDOJVMICSYLHU-UHFFFAOYSA-N	0	0	291.807	4.083	20	30		CIEDRN
Cc1cc(CSCCC2(C#N)CCCCC2)no1	ZINC000419365694	329720648	/nfs/dbraw/zinc/72/06/48/329720648.db2.gz	RBNPDKJJNVPTHC-UHFFFAOYSA-N	0	0	264.394	4.080	20	30		CIEDRN
N#CC1(CCSCc2nc(C3CC3)no2)CCCCC1	ZINC000419379142	329725817	/nfs/dbraw/zinc/72/58/17/329725817.db2.gz	FDTLKWAOLPNBIH-UHFFFAOYSA-N	0	0	291.420	4.044	20	30		CIEDRN
N#CC1(CSCc2ccc(F)cc2Cl)CCC1	ZINC000419385060	329726305	/nfs/dbraw/zinc/72/63/05/329726305.db2.gz	BQVYWMGUCHQFOH-UHFFFAOYSA-N	0	0	269.772	4.406	20	30		CIEDRN
CC(C)(C)OCCSCCC1(C#N)CCCCC1	ZINC000419420289	329727407	/nfs/dbraw/zinc/72/74/07/329727407.db2.gz	TWBSCCVBTACWFZ-UHFFFAOYSA-N	0	0	269.454	4.399	20	30		CIEDRN
Cc1cc(CSCC2(C#N)CCC2)c2ccccc2n1	ZINC000419437200	329728973	/nfs/dbraw/zinc/72/89/73/329728973.db2.gz	MXXZUGMPKLMVIY-UHFFFAOYSA-N	0	0	282.412	4.470	20	30		CIEDRN
Cc1ccccc1[C@H](C)SCc1nc(C#N)cs1	ZINC000419444890	329729630	/nfs/dbraw/zinc/72/96/30/329729630.db2.gz	UHUZUMWWLFSGFR-NSHDSACASA-N	0	0	274.414	4.318	20	30		CIEDRN
C=C(CC)CSCc1cnc2c(cnn2C(C)C)c1	ZINC000419444743	329729633	/nfs/dbraw/zinc/72/96/33/329729633.db2.gz	QYVDWFHLVRPJBY-UHFFFAOYSA-N	0	0	275.421	4.212	20	30		CIEDRN
C=CCCCCCSCc1nnc(C2CC2)s1	ZINC000419507139	329733631	/nfs/dbraw/zinc/73/36/31/329733631.db2.gz	YFGSCSGZZILZDE-UHFFFAOYSA-N	0	0	268.451	4.395	20	30		CIEDRN
C=CCOCCCSCc1cnc2ccccc2c1	ZINC000419471827	329735071	/nfs/dbraw/zinc/73/50/71/329735071.db2.gz	ICWXGOUCKLXLBV-UHFFFAOYSA-N	0	0	273.401	4.061	20	30		CIEDRN
Cc1ccc([N+](=O)[O-])cc1[C@H](C)SCC1(C#N)CCC1	ZINC000419579534	329741056	/nfs/dbraw/zinc/74/10/56/329741056.db2.gz	JZNREAHWLBHDDL-LBPRGKRZSA-N	0	0	290.388	4.391	20	30		CIEDRN
COc1cc(CSCC2(C#N)CCC2)ccc1Cl	ZINC000419582509	329741275	/nfs/dbraw/zinc/74/12/75/329741275.db2.gz	KFERYEBUUPXGIU-UHFFFAOYSA-N	0	0	281.808	4.276	20	30		CIEDRN
COc1cc(CSCCCCC(C)(C)C#N)ccn1	ZINC000419632008	329744184	/nfs/dbraw/zinc/74/41/84/329744184.db2.gz	FJUDSRDLEWSGAV-UHFFFAOYSA-N	0	0	278.421	4.043	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N[C@H](CC(F)F)c1ccccc1	ZINC000420873353	329785766	/nfs/dbraw/zinc/78/57/66/329785766.db2.gz	XJOMJDQQNILBPA-ZIAGYGMSSA-N	0	0	296.361	4.037	20	30		CIEDRN
Cc1c2cc(C#N)ccc2sc1C(=O)NCCC1(C)CC1	ZINC000509748543	332880621	/nfs/dbraw/zinc/88/06/21/332880621.db2.gz	VINUXGGMGOYURQ-UHFFFAOYSA-N	0	0	298.411	4.001	20	30		CIEDRN
C[C@H]1C[C@H](C(=O)N[C@H](CCC#N)c2ccccc2)C[C@@H](C)C1	ZINC000248629306	329896355	/nfs/dbraw/zinc/89/63/55/329896355.db2.gz	ZOACAZBBEPGJCW-MXSMSXNCSA-N	0	0	298.430	4.220	20	30		CIEDRN
CCC(C)(C)OCc1ccccc1NC[C@@H](C#N)CCC#N	ZINC000572029747	329939031	/nfs/dbraw/zinc/93/90/31/329939031.db2.gz	UMMSRBZNVQHOKX-OAHLLOKOSA-N	0	0	299.418	4.247	20	30		CIEDRN
CC(C)(C#N)CCCSCc1ccc(F)cc1C#N	ZINC000161719485	329953236	/nfs/dbraw/zinc/95/32/36/329953236.db2.gz	ZMLLIDGRBFBNSF-UHFFFAOYSA-N	0	0	276.380	4.261	20	30		CIEDRN
CCc1ccc([C@@H](C#N)N(C)C(=O)CCC2CCCC2)cc1	ZINC000572188591	329953305	/nfs/dbraw/zinc/95/33/05/329953305.db2.gz	UTVREVDBXINVCT-GOSISDBHSA-N	0	0	298.430	4.242	20	30		CIEDRN
CC(C)(C#N)CCCSCc1ccn(-c2ccccc2)n1	ZINC000161740726	329953889	/nfs/dbraw/zinc/95/38/89/329953889.db2.gz	PNKMYTKQDUZPSQ-UHFFFAOYSA-N	0	0	299.443	4.435	20	30		CIEDRN
C=CCCCCSc1nnc(Cc2cccc(F)c2)o1	ZINC000572234158	329959498	/nfs/dbraw/zinc/95/94/98/329959498.db2.gz	QJHVBZHSYWGSAE-UHFFFAOYSA-N	0	0	292.379	4.248	20	30		CIEDRN
C=CCN(C(=O)C[C@H](C)Cc1ccc(Cl)cc1)C1CC1	ZINC000536820070	329968283	/nfs/dbraw/zinc/96/82/83/329968283.db2.gz	HFAROGRPKLMFHO-CYBMUJFWSA-N	0	0	291.822	4.086	20	30		CIEDRN
C=CCN(C(=O)[C@H](C)c1ccc(Cl)c(Cl)c1)C1CC1	ZINC000536821426	329968462	/nfs/dbraw/zinc/96/84/62/329968462.db2.gz	MMDIEBHJTSJAEY-SNVBAGLBSA-N	0	0	298.213	4.274	20	30		CIEDRN
Cc1nsc(N[C@@H](c2ccccc2C)C2CC2)c1C#N	ZINC000572316960	329976107	/nfs/dbraw/zinc/97/61/07/329976107.db2.gz	GRVUGQDKBLPOPQ-OAHLLOKOSA-N	0	0	283.400	4.195	20	30		CIEDRN
Cc1cc(C)c(NC(=O)c2ccc(C#N)cc2C)c(C)c1	ZINC000162357505	330003361	/nfs/dbraw/zinc/00/33/61/330003361.db2.gz	UWJMWRJEEGKJST-UHFFFAOYSA-N	0	0	278.355	4.044	20	30		CIEDRN
N#Cc1cccc(CNc2ncccc2-c2ccccc2)c1	ZINC000162391319	330008830	/nfs/dbraw/zinc/00/88/30/330008830.db2.gz	CGHFWCMTIAZEPQ-UHFFFAOYSA-N	0	0	285.350	4.232	20	30		CIEDRN
C=CCC(F)(F)c1nc([C@H]2CCCc3ccccc32)no1	ZINC000572384290	330037942	/nfs/dbraw/zinc/03/79/42/330037942.db2.gz	PJQSHNCTJBHUIP-ZDUSSCGKSA-N	0	0	290.313	4.206	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1sc(C2CCCC2)nc1C	ZINC000079512657	330040170	/nfs/dbraw/zinc/04/01/70/330040170.db2.gz	PBJDUULROZGJLK-UHFFFAOYSA-N	0	0	292.448	4.147	20	30		CIEDRN
C=CCCC(=O)N(Cc1ccco1)Cc1cccc(C)c1	ZINC000263658210	330060186	/nfs/dbraw/zinc/06/01/86/330060186.db2.gz	IYZSFMBTYZSDTK-UHFFFAOYSA-N	0	0	283.371	4.083	20	30		CIEDRN
C=CCCC(=O)N(C)[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000263685099	330060217	/nfs/dbraw/zinc/06/02/17/330060217.db2.gz	PYNRCCWUMGVKGS-NSHDSACASA-N	0	0	285.309	4.191	20	30		CIEDRN
CC(C)c1ccc(C(=O)Nc2ccccc2CC#N)s1	ZINC000572401827	330061258	/nfs/dbraw/zinc/06/12/58/330061258.db2.gz	JRQPBNIRNKRRFH-UHFFFAOYSA-N	0	0	284.384	4.190	20	30		CIEDRN
C#CCCNC(=O)Nc1ccc(SC(C)(C)C)cc1C	ZINC000264947581	330062043	/nfs/dbraw/zinc/06/20/43/330062043.db2.gz	AORBZYDTTDIINB-UHFFFAOYSA-N	0	0	290.432	4.030	20	30		CIEDRN
C=CCCCN(C)C(=O)c1ccc(SC(F)F)cc1	ZINC000265525692	330062679	/nfs/dbraw/zinc/06/26/79/330062679.db2.gz	PZAZQQAQIFAQPD-UHFFFAOYSA-N	0	0	285.359	4.040	20	30		CIEDRN
C=CCCSc1nnc(C[C@H](C)c2ccccc2)o1	ZINC000265690737	330062900	/nfs/dbraw/zinc/06/29/00/330062900.db2.gz	FZVCTYMTFZYAIC-LBPRGKRZSA-N	0	0	274.389	4.084	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H]1CCSc2ccccc21	ZINC000268131432	330065530	/nfs/dbraw/zinc/06/55/30/330065530.db2.gz	FNTBSJCTKNZPAK-HNNXBMFYSA-N	0	0	287.428	4.108	20	30		CIEDRN
C=CCCO[C@H](C)C(=O)N(C(C)C)[C@@H](C)c1ccsc1	ZINC000421694584	330067556	/nfs/dbraw/zinc/06/75/56/330067556.db2.gz	VLALOMVLIJKUBZ-UONOGXRCSA-N	0	0	295.448	4.027	20	30		CIEDRN
CC(C)N(C(=O)c1cccc(C#N)c1)[C@@H](C)c1ccsc1	ZINC000421694181	330067681	/nfs/dbraw/zinc/06/76/81/330067681.db2.gz	UMBGZYQIXRVEHO-ZDUSSCGKSA-N	0	0	298.411	4.232	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc2c(c1)C(=O)CCCC2	ZINC000421714213	330069669	/nfs/dbraw/zinc/06/96/69/330069669.db2.gz	IXTAEQFUMJRYAO-CYBMUJFWSA-N	0	0	285.387	4.137	20	30		CIEDRN
C=CCC[C@@H](NC(=O)Nc1c(C)noc1C)c1ccccc1	ZINC000269418687	330069942	/nfs/dbraw/zinc/06/99/42/330069942.db2.gz	VCLSFEREAJRISY-OAHLLOKOSA-N	0	0	299.374	4.120	20	30		CIEDRN
CC(C)N(C(=O)c1ccc(C#N)cc1)[C@@H](C)c1ccsc1	ZINC000421686475	330070481	/nfs/dbraw/zinc/07/04/81/330070481.db2.gz	BIWOEFUKONWCSD-ZDUSSCGKSA-N	0	0	298.411	4.232	20	30		CIEDRN
C#CCCCNc1ccccc1CCC(F)(F)F	ZINC000270898124	330076757	/nfs/dbraw/zinc/07/67/57/330076757.db2.gz	JAPCJIAISUJHSK-UHFFFAOYSA-N	0	0	255.283	4.007	20	30		CIEDRN
C=CCN(C(=O)Nc1ccc(Cl)cc1Cl)C1CC1	ZINC000271299551	330078676	/nfs/dbraw/zinc/07/86/76/330078676.db2.gz	BVHDJVHAUDLYTR-UHFFFAOYSA-N	0	0	285.174	4.176	20	30		CIEDRN
C=CCCO[C@H](C)c1nc([C@H]2CCCC[C@H]2C)no1	ZINC000273799046	330097647	/nfs/dbraw/zinc/09/76/47/330097647.db2.gz	HOHWHSNZHAQLGQ-UPJWGTAASA-N	0	0	264.369	4.017	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](C)c1ccccc1OC(F)F	ZINC000274290429	330104353	/nfs/dbraw/zinc/10/43/53/330104353.db2.gz	NZEKVYMAFQCRCJ-RYUDHWBXSA-N	0	0	297.345	4.068	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCCC[C@H]1c1ccc(F)cc1	ZINC000274364335	330105452	/nfs/dbraw/zinc/10/54/52/330105452.db2.gz	TWKJBLWCAFNYSY-PBHICJAKSA-N	0	0	289.394	4.482	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1c(C)cccc1Cl	ZINC000274367129	330105470	/nfs/dbraw/zinc/10/54/70/330105470.db2.gz	UWPYKHHNOOQHDD-NSHDSACASA-N	0	0	251.757	4.189	20	30		CIEDRN
C=C(C)[C@H](N[C@@H](C)c1cncs1)c1ccc(F)c(F)c1	ZINC000274758161	330107639	/nfs/dbraw/zinc/10/76/39/330107639.db2.gz	JLAONUNAUVYPGY-BONVTDFDSA-N	0	0	294.370	4.389	20	30		CIEDRN
CCN(Cc1ccc(Cl)s1)Cc1ccc(C#N)s1	ZINC000162748914	330111434	/nfs/dbraw/zinc/11/14/34/330111434.db2.gz	DUIMEOKPCCEORK-UHFFFAOYSA-N	0	0	296.848	4.357	20	30		CIEDRN
C=CCCN(C)C(=O)c1cc(C2CC2)nc2ccc(C)cc21	ZINC000276106796	330111992	/nfs/dbraw/zinc/11/19/92/330111992.db2.gz	HDNOYSSLVQIDHQ-UHFFFAOYSA-N	0	0	294.398	4.069	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C)C1	ZINC000276446730	330113504	/nfs/dbraw/zinc/11/35/04/330113504.db2.gz	SMSSFCOGVNTPOE-CQSZACIVSA-N	0	0	286.419	4.412	20	30		CIEDRN
C=CCC[C@@H]([NH2+]C[C@H](CCO)c1ccccc1)c1ccco1	ZINC000276479315	330113550	/nfs/dbraw/zinc/11/35/50/330113550.db2.gz	RIKXHRSBUNQKLA-ZWKOTPCHSA-N	0	0	299.414	4.043	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H]1C[C@H]1C	ZINC000276441977	330113928	/nfs/dbraw/zinc/11/39/28/330113928.db2.gz	RSTCXYZUCSRHME-UKRRQHHQSA-N	0	0	286.419	4.316	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccccc1NC(C)(C)C	ZINC000277410629	330116202	/nfs/dbraw/zinc/11/62/02/330116202.db2.gz	TVQGREDLWXENBE-UHFFFAOYSA-N	0	0	272.392	4.029	20	30		CIEDRN
C=CCCO[C@H](C)c1nc(C(C)(C)c2ccccc2)no1	ZINC000277845006	330118469	/nfs/dbraw/zinc/11/84/69/330118469.db2.gz	AFCYVFRMQOXSTB-CYBMUJFWSA-N	0	0	286.375	4.049	20	30		CIEDRN
C=CCCCNC(=O)c1ccc(Cl)cc1C(F)(F)F	ZINC000279286638	330122751	/nfs/dbraw/zinc/12/27/51/330122751.db2.gz	XLHVFIPRTMFEAB-UHFFFAOYSA-N	0	0	291.700	4.055	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)CCCCSC	ZINC000279379136	330122975	/nfs/dbraw/zinc/12/29/75/330122975.db2.gz	IAHMVZWXMCPEOL-UHFFFAOYSA-N	0	0	291.460	4.125	20	30		CIEDRN
Cc1ccc(CN(C)c2c(C#N)cnc3ccccc32)cc1	ZINC000302976858	332896026	/nfs/dbraw/zinc/89/60/26/332896026.db2.gz	UHFLMDPVXYFNPG-UHFFFAOYSA-N	0	0	287.366	4.051	20	30		CIEDRN
CCCSc1nc(-c2ccccc2)ccc1C#N	ZINC000510181172	332896344	/nfs/dbraw/zinc/89/63/44/332896344.db2.gz	OOOWGNFSZRDPDA-UHFFFAOYSA-N	0	0	254.358	4.122	20	30		CIEDRN
CC[C@H](CC1CCCC1)C(=O)Nc1ccc(C#N)cc1	ZINC000510203414	332897006	/nfs/dbraw/zinc/89/70/06/332897006.db2.gz	KNJZWISFNAXOKG-OAHLLOKOSA-N	0	0	270.376	4.103	20	30		CIEDRN
CC[C@@H](Nc1ccc2c(c1)CCN2)c1ccc(C#N)cc1	ZINC000423221167	330179368	/nfs/dbraw/zinc/17/93/68/330179368.db2.gz	WLVPRAGJAIRYLV-QGZVFWFLSA-N	0	0	277.371	4.089	20	30		CIEDRN
C=CCn1c(S[C@H]2CCC(C)(C)C2)nnc1C1CC1	ZINC000424097510	330227710	/nfs/dbraw/zinc/22/77/10/330227710.db2.gz	JVMNEGTVIRTZDC-LBPRGKRZSA-N	0	0	277.437	4.012	20	30		CIEDRN
C[C@@H](CNc1cccc(Cl)c1C#N)CC(F)(F)F	ZINC000396903148	330229263	/nfs/dbraw/zinc/22/92/63/330229263.db2.gz	ZXYAOAHTUPMRMT-MRVPVSSYSA-N	0	0	276.689	4.212	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)NCc1c(Cl)cccc1Cl	ZINC000527198251	330235577	/nfs/dbraw/zinc/23/55/77/330235577.db2.gz	PQFQRDDBCLVXIJ-CQSZACIVSA-N	0	0	286.202	4.212	20	30		CIEDRN
N#Cc1c(F)cccc1NCc1ccc2ccccc2c1	ZINC000036138547	330249700	/nfs/dbraw/zinc/24/97/00/330249700.db2.gz	KKXPFNWEVPEFLB-UHFFFAOYSA-N	0	0	276.314	4.463	20	30		CIEDRN
N#CC1(c2ccc(-c3ccc4c(c3)CCOC4)s2)CCC1	ZINC000527590091	330264735	/nfs/dbraw/zinc/26/47/35/330264735.db2.gz	YLRAQZOKZWSTDL-UHFFFAOYSA-N	0	0	295.407	4.433	20	30		CIEDRN
N#CCCOc1ccc(-c2ccc(OC3CC3)cc2)cc1	ZINC000527589871	330264742	/nfs/dbraw/zinc/26/47/42/330264742.db2.gz	WGGKWDGDNQGBDV-UHFFFAOYSA-N	0	0	279.339	4.187	20	30		CIEDRN
C[C@H](Nc1cccc(OCCCC#N)c1)[C@@H]1C[C@H]1C1CC1	ZINC000527641781	330268530	/nfs/dbraw/zinc/26/85/30/330268530.db2.gz	GBVJTTLDSLBNDI-KKXDTOCCSA-N	0	0	284.403	4.216	20	30		CIEDRN
CCC(C#N)(CC)C(=O)N(C)Cc1ccc(C(C)C)cc1	ZINC000527670293	330269897	/nfs/dbraw/zinc/26/98/97/330269897.db2.gz	OZXVJENZAARQLO-UHFFFAOYSA-N	0	0	286.419	4.098	20	30		CIEDRN
CC[C@@H]([NH2+]Cc1cccc(C#N)c1)c1cc(C)ccc1C	ZINC000527824205	330286498	/nfs/dbraw/zinc/28/64/98/330286498.db2.gz	WQXCFFZZVZTZTH-LJQANCHMSA-N	0	0	278.399	4.416	20	30		CIEDRN
C=CCC[C@@H](C)Nc1cccc(C2CCOCC2)c1	ZINC000527993241	330299258	/nfs/dbraw/zinc/29/92/58/330299258.db2.gz	DIYUZPQKFQLJKF-CQSZACIVSA-N	0	0	259.393	4.347	20	30		CIEDRN
CCC(C#N)(CC)c1nc(-c2cccc3ccccc32)no1	ZINC000528092079	330307547	/nfs/dbraw/zinc/30/75/47/330307547.db2.gz	LIEIRPRNTFKYQN-UHFFFAOYSA-N	0	0	291.354	4.471	20	30		CIEDRN
N#Cc1c(F)cccc1N[C@@H](c1ccccn1)C1CCC1	ZINC000528132544	330308774	/nfs/dbraw/zinc/30/87/74/330308774.db2.gz	CLALDVCLENMULZ-QGZVFWFLSA-N	0	0	281.334	4.046	20	30		CIEDRN
CCN(C(=O)[C@@H]1CCCC12CC2)[C@@H](C)c1ccc(C#N)cc1	ZINC000528152293	330309794	/nfs/dbraw/zinc/30/97/94/330309794.db2.gz	FAKTVCWPXGAPQX-YOEHRIQHSA-N	0	0	296.414	4.048	20	30		CIEDRN
C=C(C)CCc1noc(-c2cccc(C(F)F)c2F)n1	ZINC000528193987	330312516	/nfs/dbraw/zinc/31/25/16/330312516.db2.gz	VYUVLSLTQVBJBC-UHFFFAOYSA-N	0	0	282.265	4.322	20	30		CIEDRN
CCC(F)(F)C(C)(C)CNc1cc(C(C)=O)ccc1C#N	ZINC000528182606	330314137	/nfs/dbraw/zinc/31/41/37/330314137.db2.gz	PBRILADDBCWLLC-UHFFFAOYSA-N	0	0	294.345	4.244	20	30		CIEDRN
C=CCC1(c2nc(C(C)(C)c3cc(C)ccn3)no2)CCC1	ZINC000528262214	330317859	/nfs/dbraw/zinc/31/78/59/330317859.db2.gz	KIEQFEYCPWWKNI-UHFFFAOYSA-N	0	0	297.402	4.097	20	30		CIEDRN
CCCn1ccc2cc(NC(=O)C(C#N)(CC)CC)ccc21	ZINC000528322712	330320730	/nfs/dbraw/zinc/32/07/30/330320730.db2.gz	RHOIMSIFEIGQCM-UHFFFAOYSA-N	0	0	297.402	4.320	20	30		CIEDRN
C=CC[C@H](C)NC(=O)[C@H]1C[C@@H]1c1cccc2ccccc21	ZINC000116855105	330322756	/nfs/dbraw/zinc/32/27/56/330322756.db2.gz	DDQHJUBYPOVHEH-VHSSKADRSA-N	0	0	279.383	4.024	20	30		CIEDRN
C=CC[C@H](C)NC(=O)[C@@H]1C[C@@H]1c1cccc2ccccc21	ZINC000116855102	330322787	/nfs/dbraw/zinc/32/27/87/330322787.db2.gz	DDQHJUBYPOVHEH-MORSLUCNSA-N	0	0	279.383	4.024	20	30		CIEDRN
C=CC[C@H](C)NC(=O)[C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000116860582	330323090	/nfs/dbraw/zinc/32/30/90/330323090.db2.gz	UFPVLPBISGLAGP-MVWJERBFSA-N	0	0	298.213	4.178	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@H](c1ccccc1)C1CCC1	ZINC000105249331	330323097	/nfs/dbraw/zinc/32/30/97/330323097.db2.gz	DOEDINDXDVMBLZ-QGZVFWFLSA-N	0	0	286.419	4.135	20	30		CIEDRN
CC(C)c1ccc(-c2nc3cc(C#N)ccc3[nH]2)cc1	ZINC000105668425	330329482	/nfs/dbraw/zinc/32/94/82/330329482.db2.gz	IIDZQGBNEBSUQK-UHFFFAOYSA-N	0	0	261.328	4.225	20	30		CIEDRN
CSc1ccc(Nc2cccc(F)c2C#N)cc1	ZINC000105872290	330330533	/nfs/dbraw/zinc/33/05/33/330330533.db2.gz	RUIIDAGLGMCOGE-UHFFFAOYSA-N	0	0	258.321	4.163	20	30		CIEDRN
CN(C(=O)C[C@@H]1CCCCC1(C)C)c1cccc(C#N)c1	ZINC000533101267	330335694	/nfs/dbraw/zinc/33/56/94/330335694.db2.gz	JDJIAGSHECWDNS-HNNXBMFYSA-N	0	0	284.403	4.128	20	30		CIEDRN
C=C(C)C(C)(C)c1nc(-c2cccc3[nH]ccc32)no1	ZINC000424338029	330343721	/nfs/dbraw/zinc/34/37/21/330343721.db2.gz	MLGZXLWLSNXLRD-UHFFFAOYSA-N	0	0	267.332	4.072	20	30		CIEDRN
C=C(C)C(C)(C)c1nc(-c2c[nH]c3ccccc32)no1	ZINC000424350223	330345266	/nfs/dbraw/zinc/34/52/66/330345266.db2.gz	AZMKGGLMPDTWNT-UHFFFAOYSA-N	0	0	267.332	4.072	20	30		CIEDRN
C=C[C@@H]1OCCC[C@H]1c1nc([C@H]2CCCC[C@H]2CC)no1	ZINC000424356421	330346372	/nfs/dbraw/zinc/34/63/72/330346372.db2.gz	BKNKPIQLMNMTST-BARDWOONSA-N	0	0	290.407	4.202	20	30		CIEDRN
C=C(C)C(C)(C)c1nc([C@@H]2CSc3ccccc32)no1	ZINC000424363122	330347427	/nfs/dbraw/zinc/34/74/27/330347427.db2.gz	OSZWACMDNUUZAG-GFCCVEGCSA-N	0	0	286.400	4.161	20	30		CIEDRN
C[C@@H](C#N)CN(Cc1ccc(Cl)cc1Cl)C1CC1	ZINC000533137685	330350384	/nfs/dbraw/zinc/35/03/84/330350384.db2.gz	YWGUYWIDCHWGKF-JTQLQIEISA-N	0	0	283.202	4.117	20	30		CIEDRN
CC[C@H](Cc1ccccc1)C(=O)Nc1cccc(C#N)c1C	ZINC000533214328	330353942	/nfs/dbraw/zinc/35/39/42/330353942.db2.gz	JCAFWOYJCPVUQX-MRXNPFEDSA-N	0	0	292.382	4.074	20	30		CIEDRN
COc1ccc(C)cc1CSc1ccc(C#N)cc1	ZINC000580500105	330355509	/nfs/dbraw/zinc/35/55/09/330355509.db2.gz	FAXAKIFFXREGQI-UHFFFAOYSA-N	0	0	269.369	4.168	20	30		CIEDRN
C=CCC[C@H](NC(=O)c1ccccc1OC)c1ccccc1	ZINC000533261149	330355721	/nfs/dbraw/zinc/35/57/21/330355721.db2.gz	MYCYBCONWFAXMV-KRWDZBQOSA-N	0	0	295.382	4.133	20	30		CIEDRN
C=C[C@H](CC(=O)N(CC)Cc1cccs1)c1ccccc1	ZINC000123732345	330359753	/nfs/dbraw/zinc/35/97/53/330359753.db2.gz	MDHLYLGMPKIIJY-OAHLLOKOSA-N	0	0	299.439	4.457	20	30		CIEDRN
C=C(CC)CS[C@H](C)C(=O)N[C@H](C)c1ccccc1C	ZINC000536881912	330360840	/nfs/dbraw/zinc/36/08/40/330360840.db2.gz	PJWAPYMPZYKRTQ-HUUCEWRRSA-N	0	0	291.460	4.260	20	30		CIEDRN
C=C(CC)CS[C@@H](C)C(=O)Nc1cccc(C)c1	ZINC000536881882	330360851	/nfs/dbraw/zinc/36/08/51/330360851.db2.gz	ONCCOLMUQSOWIR-ZDUSSCGKSA-N	0	0	263.406	4.021	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N(C)[C@@H](C)c1cc2ccccc2o1	ZINC000116971273	330362746	/nfs/dbraw/zinc/36/27/46/330362746.db2.gz	FLIPIJNGIVHCJG-STQMWFEESA-N	0	0	286.375	4.100	20	30		CIEDRN
C=C(CC)CSc1nnc(C[C@H](C)c2ccccc2)o1	ZINC000536905694	330363648	/nfs/dbraw/zinc/36/36/48/330363648.db2.gz	PKPZHNBMNQXUQI-ZDUSSCGKSA-N	0	0	288.416	4.474	20	30		CIEDRN
C=CCC(CC=C)c1nc(Cc2ccc(F)c(F)c2)no1	ZINC000445447636	330363917	/nfs/dbraw/zinc/36/39/17/330363917.db2.gz	RCTQETBLLCXMSN-UHFFFAOYSA-N	0	0	290.313	4.174	20	30		CIEDRN
C=CCCCS[C@@H](C)C(=O)Nc1cccc(C)c1	ZINC000117944985	330366649	/nfs/dbraw/zinc/36/66/49/330366649.db2.gz	DTCCZBOSXIAHQY-ZDUSSCGKSA-N	0	0	263.406	4.021	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N1CCC(Cc2ccccc2)CC1	ZINC000424530207	330367530	/nfs/dbraw/zinc/36/75/30/330367530.db2.gz	SUCZWFQTBMMVHZ-UHFFFAOYSA-N	0	0	285.431	4.070	20	30		CIEDRN
C=CCN(C)C(=O)N(c1ccccc1)c1ccccc1	ZINC000118997984	330368631	/nfs/dbraw/zinc/36/86/31/330368631.db2.gz	HLHKXJUJDUXJLA-UHFFFAOYSA-N	0	0	266.344	4.063	20	30		CIEDRN
Cc1ccc(C2CC2)c(C(=O)Nc2ccc(CC#N)cc2)c1	ZINC000424539758	330371088	/nfs/dbraw/zinc/37/10/88/330371088.db2.gz	JJOYUMHWSQKCPG-UHFFFAOYSA-N	0	0	290.366	4.191	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@@H]1CCSc2c(F)cccc21	ZINC000424555402	330374718	/nfs/dbraw/zinc/37/47/18/330374718.db2.gz	FQGCWHUPUFXTNY-CYBMUJFWSA-N	0	0	293.407	4.081	20	30		CIEDRN
CC[C@]1(C)C[C@@H]1C(=O)Nc1cc(C(C)(C)C)sc1C#N	ZINC000536972254	330374835	/nfs/dbraw/zinc/37/48/35/330374835.db2.gz	IILVKQJDQYWASO-QLJPJBMISA-N	0	0	290.432	4.292	20	30		CIEDRN
CC[C@@]1(C)C[C@H]1C(=O)Nc1cc(C(C)(C)C)sc1C#N	ZINC000536972253	330374870	/nfs/dbraw/zinc/37/48/70/330374870.db2.gz	IILVKQJDQYWASO-QFYYESIMSA-N	0	0	290.432	4.292	20	30		CIEDRN
C=CCC(CC=C)c1nc(-c2c[nH]c3ccccc23)no1	ZINC000445449475	330376208	/nfs/dbraw/zinc/37/62/08/330376208.db2.gz	YUVLOYLRKZOYPO-UHFFFAOYSA-N	0	0	279.343	4.454	20	30		CIEDRN
C=CCSc1nnc(-c2ccco2)n1C1CCCCC1	ZINC000057652455	330377540	/nfs/dbraw/zinc/37/75/40/330377540.db2.gz	QGYDYIJMQXUPPN-UHFFFAOYSA-N	0	0	289.404	4.321	20	30		CIEDRN
CCCN(Cc1ccc(C#N)cc1)C(=O)CC(CC)CC	ZINC000119678490	330378516	/nfs/dbraw/zinc/37/85/16/330378516.db2.gz	YDDGAULLXWCRCV-UHFFFAOYSA-N	0	0	286.419	4.123	20	30		CIEDRN
C=C[C@@H](CC(=O)N[C@H](CC)CCC)c1ccccc1	ZINC000119860415	330380447	/nfs/dbraw/zinc/38/04/47/330380447.db2.gz	CCQUHXHTKKUHRS-GOEBONIOSA-N	0	0	259.393	4.041	20	30		CIEDRN
C[C@@H](c1cccc(Cl)c1)N(C)Cc1ccccc1C#N	ZINC000058000613	330381708	/nfs/dbraw/zinc/38/17/08/330381708.db2.gz	KPJGLACITFAHOL-ZDUSSCGKSA-N	0	0	284.790	4.405	20	30		CIEDRN
C[C@H]1CCCC[C@H]1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000424579436	330385721	/nfs/dbraw/zinc/38/57/21/330385721.db2.gz	UZOFWBRLRIBXTQ-XJKSGUPXSA-N	0	0	284.403	4.253	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cc(-c2ncco2)ccc1C	ZINC000089616744	330386528	/nfs/dbraw/zinc/38/65/28/330386528.db2.gz	GCGLAZQFDGHNIK-UHFFFAOYSA-N	0	0	296.370	4.357	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@@H](C)c1cc(C)sc1C	ZINC000424580898	330387307	/nfs/dbraw/zinc/38/73/07/330387307.db2.gz	GDGDXQICLCPHMV-NSHDSACASA-N	0	0	265.422	4.144	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cc(Cl)ccc1OC	ZINC000120886307	330392037	/nfs/dbraw/zinc/39/20/37/330392037.db2.gz	DSADMOCUGXYZIB-UHFFFAOYSA-N	0	0	279.767	4.056	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc(Cl)cc1F	ZINC000120981494	330393894	/nfs/dbraw/zinc/39/38/94/330393894.db2.gz	HODQBLHKODDMAP-UHFFFAOYSA-N	0	0	267.731	4.186	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N(C)Cc1csc2ccccc12	ZINC000424595306	330396493	/nfs/dbraw/zinc/39/64/93/330396493.db2.gz	RHIPXJOVOKFSPS-UHFFFAOYSA-N	0	0	287.428	4.462	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2ccc(CC)c(CC)c2)CC1	ZINC000537104290	330400218	/nfs/dbraw/zinc/40/02/18/330400218.db2.gz	QOGBFLSTYGOVRP-UHFFFAOYSA-N	0	0	286.419	4.241	20	30		CIEDRN
C=C[C@H](CC(=O)N(C)c1ccccc1)c1ccccc1	ZINC000121515469	330402335	/nfs/dbraw/zinc/40/23/35/330402335.db2.gz	HUPGUGRLEQUODX-OAHLLOKOSA-N	0	0	265.356	4.009	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1ccccc1C)c1ccccc1	ZINC000121532756	330402846	/nfs/dbraw/zinc/40/28/46/330402846.db2.gz	PRQQTSIOJCVGSO-OAHLLOKOSA-N	0	0	265.356	4.293	20	30		CIEDRN
Cc1ccc(NC(=O)c2ccc(Cl)c(C#N)c2)c(C)c1	ZINC000537165532	330410584	/nfs/dbraw/zinc/41/05/84/330410584.db2.gz	JXESODROVMYWLW-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
Cc1cccc(NC(=O)c2ccc(Cl)c(C#N)c2)c1C	ZINC000537165747	330410586	/nfs/dbraw/zinc/41/05/86/330410586.db2.gz	VIDNEOPPSFIUNY-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N[C@H](C)c1c(F)cccc1F	ZINC000537186258	330412986	/nfs/dbraw/zinc/41/29/86/330412986.db2.gz	NSCYDORECNRCGA-VXGBXAGGSA-N	0	0	296.361	4.070	20	30		CIEDRN
C=CCCOCCCCC(=O)N[C@@H]1CCC[C@H](C(C)C)C1	ZINC000537190330	330413361	/nfs/dbraw/zinc/41/33/61/330413361.db2.gz	CGOQFXJFLPQDGH-DLBZAZTESA-N	0	0	295.467	4.080	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)[C@@H]1CCSc2ccccc21	ZINC000537229056	330429544	/nfs/dbraw/zinc/42/95/44/330429544.db2.gz	FNWFOARSYZXWAX-UKRRQHHQSA-N	0	0	289.444	4.127	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)CCc1cc(Cl)cs1	ZINC000537230760	330429760	/nfs/dbraw/zinc/42/97/60/330429760.db2.gz	SYDIKGHYMHWXEU-LLVKDONJSA-N	0	0	285.840	4.195	20	30		CIEDRN
Cc1sc(NC(=O)Cc2c(C)cccc2C)c(C#N)c1C	ZINC000537392616	330435790	/nfs/dbraw/zinc/43/57/90/330435790.db2.gz	OTHDIOXBSFXMJG-UHFFFAOYSA-N	0	0	298.411	4.035	20	30		CIEDRN
N#Cc1ccc(SCc2cnc3ccccc3c2)cc1	ZINC000537511116	330439238	/nfs/dbraw/zinc/43/92/38/330439238.db2.gz	HZOCLIZMGHOKJG-UHFFFAOYSA-N	0	0	276.364	4.399	20	30		CIEDRN
C=CCC[C@H](NC(=O)[C@@H]1CCC[C@@H](F)C1)c1ccccc1	ZINC000424732158	330453841	/nfs/dbraw/zinc/45/38/41/330453841.db2.gz	GYNURPAAJCLUIO-ZACQAIPSSA-N	0	0	289.394	4.338	20	30		CIEDRN
C[C@@H](C#N)CN(Cc1cccc(Cl)c1Cl)C1CC1	ZINC000537660992	330454623	/nfs/dbraw/zinc/45/46/23/330454623.db2.gz	LCMBROBNZKHWCE-JTQLQIEISA-N	0	0	283.202	4.117	20	30		CIEDRN
CC(C)CCc1ccccc1NCc1ccc(C#N)o1	ZINC000537732199	330457607	/nfs/dbraw/zinc/45/76/07/330457607.db2.gz	LRWSSPADYDJJNH-UHFFFAOYSA-N	0	0	268.360	4.352	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@H]1CCC(C)(C)C1	ZINC000514185873	330460390	/nfs/dbraw/zinc/46/03/90/330460390.db2.gz	LKJRTMVXQLGJKU-AWEZNQCLSA-N	0	0	251.414	4.018	20	30		CIEDRN
CC(C)CCN(CC#N)Cc1ccc(Cl)c(Cl)c1	ZINC000515745332	330482204	/nfs/dbraw/zinc/48/22/04/330482204.db2.gz	AFIASBMFGMNIGD-UHFFFAOYSA-N	0	0	285.218	4.365	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000426213928	330501765	/nfs/dbraw/zinc/50/17/65/330501765.db2.gz	DIEBFMDWTNGBOF-HZPDHXFCSA-N	0	0	286.419	4.115	20	30		CIEDRN
C=CCC(C)(C)c1nc(Cc2csc(C(C)C)n2)no1	ZINC000426413504	330507539	/nfs/dbraw/zinc/50/75/39/330507539.db2.gz	XBJHSMQNQCUBNO-UHFFFAOYSA-N	0	0	291.420	4.094	20	30		CIEDRN
CC(=O)c1ccc(C#N)cc1N(C)Cc1cc(C)ccc1C	ZINC000428661128	330529030	/nfs/dbraw/zinc/52/90/30/330529030.db2.gz	GIQYVIAZADLLOX-UHFFFAOYSA-N	0	0	292.382	4.014	20	30		CIEDRN
C=CCC[C@@H](NC(=O)NCC(C)(C)C)c1ccccc1	ZINC000429073468	330538210	/nfs/dbraw/zinc/53/82/10/330538210.db2.gz	JXNZDEAVZDVNGH-OAHLLOKOSA-N	0	0	274.408	4.039	20	30		CIEDRN
C=C(C)CNC(=O)Nc1ccc2c(c1)oc1ccccc12	ZINC000429160797	330539437	/nfs/dbraw/zinc/53/94/37/330539437.db2.gz	IGMDYWQUGWLJJF-UHFFFAOYSA-N	0	0	280.327	4.284	20	30		CIEDRN
C=C(C)CNC(=O)Nc1cccc(-c2cccs2)c1	ZINC000429364437	330544479	/nfs/dbraw/zinc/54/44/79/330544479.db2.gz	MDEXFFFOWCPZDT-UHFFFAOYSA-N	0	0	272.373	4.113	20	30		CIEDRN
C=CCC(C)(C)C(=O)N(C)Cc1cccc(C(F)(F)F)c1	ZINC000429888820	330556071	/nfs/dbraw/zinc/55/60/71/330556071.db2.gz	HEZDJLRLSYVIRW-UHFFFAOYSA-N	0	0	299.336	4.266	20	30		CIEDRN
C=CCC(C)(C)C(=O)N(C)Cc1csc2ccccc12	ZINC000429900364	330556200	/nfs/dbraw/zinc/55/62/00/330556200.db2.gz	KGQORJYARJVSJK-UHFFFAOYSA-N	0	0	287.428	4.462	20	30		CIEDRN
N#C[C@H]1CC[C@@H](Sc2cccc(Br)c2)C1	ZINC000430096806	330559907	/nfs/dbraw/zinc/55/99/07/330559907.db2.gz	PZZBFTNKFWGFBU-JOYOIKCWSA-N	0	0	282.206	4.233	20	30		CIEDRN
C=CCC[C@H](NC(=O)N1CC(C)=C[C@@H](C)C1)c1ccccc1	ZINC000430903339	330576685	/nfs/dbraw/zinc/57/66/85/330576685.db2.gz	HSLWUPLFDAGMET-QAPCUYQASA-N	0	0	298.430	4.302	20	30		CIEDRN
C=C(C)CCS[C@H](C)c1cc(C(=O)OC)c(C)o1	ZINC000431076819	330578590	/nfs/dbraw/zinc/57/85/90/330578590.db2.gz	HAQAOVYVMWHMPS-LLVKDONJSA-N	0	0	268.378	4.135	20	30		CIEDRN
CC(C)(C)C1CCC(CC(=O)NCC2(CC#N)CC2)CC1	ZINC000431182666	330581305	/nfs/dbraw/zinc/58/13/05/330581305.db2.gz	PCWQZTZWWVQNEU-UHFFFAOYSA-N	0	0	290.451	4.039	20	30		CIEDRN
N#Cc1cccc(C#N)c1NC[C@H](c1ccccc1)C1CC1	ZINC000431488249	330585433	/nfs/dbraw/zinc/58/54/33/330585433.db2.gz	PCIQSVQUXARTCM-GOSISDBHSA-N	0	0	287.366	4.036	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)N[C@@H](C)CCCC(F)(F)F	ZINC000432349004	330597828	/nfs/dbraw/zinc/59/78/28/330597828.db2.gz	TZIDTACDOYXDHZ-NSHDSACASA-N	0	0	294.361	4.009	20	30		CIEDRN
N#Cc1nn(CCCc2ccccc2Cl)c2ccccc12	ZINC000432454917	330599379	/nfs/dbraw/zinc/59/93/79/330599379.db2.gz	HZRIGQRQDMWGNN-UHFFFAOYSA-N	0	0	295.773	4.194	20	30		CIEDRN
N#Cc1ccc(SCC(=O)C2CCCCCC2)cc1	ZINC000432532491	330600126	/nfs/dbraw/zinc/60/01/26/330600126.db2.gz	STZMRMYPDFRJSE-UHFFFAOYSA-N	0	0	273.401	4.190	20	30		CIEDRN
N#Cc1cc(F)ccc1NC(=O)CCCC1CCCCC1	ZINC000433987421	330633540	/nfs/dbraw/zinc/63/35/40/330633540.db2.gz	FLFLUWYSQWBBEB-UHFFFAOYSA-N	0	0	288.366	4.386	20	30		CIEDRN
CC[C@H](CC(=O)N1CCCC(C)(C)[C@H]1C#N)c1ccccc1	ZINC000434029122	330634556	/nfs/dbraw/zinc/63/45/56/330634556.db2.gz	AJJJUSKCTGLKHE-NVXWUHKLSA-N	0	0	298.430	4.111	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC(F)(c2ccccc2)CC1	ZINC000434055086	330634969	/nfs/dbraw/zinc/63/49/69/330634969.db2.gz	VSDBKUBUGMZFEX-OAHLLOKOSA-N	0	0	289.394	4.076	20	30		CIEDRN
C=CCCC(=O)N1CCc2cc(Cl)cc(Cl)c2[C@H]1C	ZINC000434152571	330636273	/nfs/dbraw/zinc/63/62/73/330636273.db2.gz	VFUHRJQAZTVXFU-SNVBAGLBSA-N	0	0	298.213	4.405	20	30		CIEDRN
N#Cc1ccccc1SCc1nccn1-c1ccccc1	ZINC000434643144	330642278	/nfs/dbraw/zinc/64/22/78/330642278.db2.gz	ARAIFORGKPNWOE-UHFFFAOYSA-N	0	0	291.379	4.036	20	30		CIEDRN
Cc1cc(OCc2csc(-c3ccoc3)n2)ccc1C#N	ZINC000434648694	330642289	/nfs/dbraw/zinc/64/22/89/330642289.db2.gz	NLOHSYFSDITFDC-UHFFFAOYSA-N	0	0	296.351	4.162	20	30		CIEDRN
CC(C)(C#N)CCCC[S@](=O)CC1CCCCC1	ZINC000435422891	330654610	/nfs/dbraw/zinc/65/46/10/330654610.db2.gz	QKEFZQOIQFAHMM-SFHVURJKSA-N	0	0	269.454	4.035	20	30		CIEDRN
C=CCC[C@H](NC(=O)N(C)[C@@H](C)C(C)C)c1ccccc1	ZINC000435758104	330662239	/nfs/dbraw/zinc/66/22/39/330662239.db2.gz	DPUVHGMSSFATPE-RDJZCZTQSA-N	0	0	288.435	4.380	20	30		CIEDRN
CC[C@H](C#N)Nc1cc(Cl)ccc1OC1CCCC1	ZINC000435931785	330665627	/nfs/dbraw/zinc/66/56/27/330665627.db2.gz	ZTFCRWXVJZQYTK-GFCCVEGCSA-N	0	0	278.783	4.375	20	30		CIEDRN
CC(C)c1cnc(SCCCCC(C)(C)C#N)n1C	ZINC000436196457	330670594	/nfs/dbraw/zinc/67/05/94/330670594.db2.gz	HOAIURKIEPRAHY-UHFFFAOYSA-N	0	0	279.453	4.356	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ccc3ccccc3c2O)n1	ZINC000436568256	330680221	/nfs/dbraw/zinc/68/02/21/330680221.db2.gz	WLVXAEWIKPRHDM-UHFFFAOYSA-N	0	0	294.354	4.449	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2ccc(O)cc2Cl)no1	ZINC000436869038	330687167	/nfs/dbraw/zinc/68/71/67/330687167.db2.gz	CFZOXZYGCNHAFQ-VIFPVBQESA-N	0	0	278.739	4.165	20	30		CIEDRN
CC(C)c1cccc(NC(=O)[C@]2(C#N)CC23CCCC3)c1	ZINC000448583473	330690051	/nfs/dbraw/zinc/69/00/51/330690051.db2.gz	SYGPHKFVBMLHQP-GOSISDBHSA-N	0	0	282.387	4.223	20	30		CIEDRN
N#Cc1ccc(CNc2ccc(N3CCCCC3)cc2)s1	ZINC000155646296	330692131	/nfs/dbraw/zinc/69/21/31/330692131.db2.gz	DCEHTEYFTPCBIL-UHFFFAOYSA-N	0	0	297.427	4.222	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H]1C[C@H]1c1ccc2ccccc2c1	ZINC000437288346	330697179	/nfs/dbraw/zinc/69/71/79/330697179.db2.gz	MVMBDLVGHMKSOO-NLWGTHIKSA-N	0	0	293.410	4.414	20	30		CIEDRN
C=C(C)CN(CC)C(=O)CS[C@H](C)c1cccc(C)c1	ZINC000437434104	330699604	/nfs/dbraw/zinc/69/96/04/330699604.db2.gz	TZHVZRPFVGUVTA-OAHLLOKOSA-N	0	0	291.460	4.214	20	30		CIEDRN
COC[C@@H](C)SCc1ccc(-c2ccccc2C#N)cc1	ZINC000437452149	330700068	/nfs/dbraw/zinc/70/00/68/330700068.db2.gz	KZQWYURMDVCWFU-CQSZACIVSA-N	0	0	297.423	4.493	20	30		CIEDRN
C=CCc1cc(C)cc(OC)c1OCc1nc(C)cs1	ZINC000438307560	330721308	/nfs/dbraw/zinc/72/13/08/330721308.db2.gz	SIDCPOJLBNYWJP-UHFFFAOYSA-N	0	0	289.400	4.076	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@H]1C[C@H]1c1sccc1C	ZINC000438823880	330729555	/nfs/dbraw/zinc/72/95/55/330729555.db2.gz	NFCCELUCWNZPTD-CABCVRRESA-N	0	0	291.460	4.365	20	30		CIEDRN
N#Cc1ccc(COc2ccc3ncccc3c2)c(Cl)c1	ZINC000438906765	330730738	/nfs/dbraw/zinc/73/07/38/330730738.db2.gz	GNRHQISWAXUIQJ-UHFFFAOYSA-N	0	0	294.741	4.339	20	30		CIEDRN
C[C@@H](CSCc1cc(C#N)ccc1F)C(F)(F)F	ZINC000439017175	330732444	/nfs/dbraw/zinc/73/24/44/330732444.db2.gz	ARBFUNAAFWJRPZ-QMMMGPOBSA-N	0	0	277.286	4.129	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1cc(C)ccc1Cl	ZINC000439447640	330738339	/nfs/dbraw/zinc/73/83/39/330738339.db2.gz	FFCJKBSGXDUPKI-LLVKDONJSA-N	0	0	266.772	4.125	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1cccc(N(C)C(C)C)c1	ZINC000439518243	330739955	/nfs/dbraw/zinc/73/99/55/330739955.db2.gz	IHHNVSSDNKCFKB-AWEZNQCLSA-N	0	0	289.423	4.007	20	30		CIEDRN
N#Cc1ccc(NC[C@H]2CCC[C@H](C(F)(F)F)C2)cc1	ZINC000439597258	330740942	/nfs/dbraw/zinc/74/09/42/330740942.db2.gz	NNTIZAWQXVJUPT-STQMWFEESA-N	0	0	282.309	4.339	20	30		CIEDRN
C[C@@H]1CCCC[C@@H]1OCCSc1ccccc1C#N	ZINC000439712318	330742072	/nfs/dbraw/zinc/74/20/72/330742072.db2.gz	WECPBQPNMHUTHX-HIFRSBDPSA-N	0	0	275.417	4.246	20	30		CIEDRN
C[C@H]1CCCC[C@@H]1OCCSc1ccccc1C#N	ZINC000439712320	330742108	/nfs/dbraw/zinc/74/21/08/330742108.db2.gz	WECPBQPNMHUTHX-ZFWWWQNUSA-N	0	0	275.417	4.246	20	30		CIEDRN
CCN(C(=O)c1ccc(C#N)cc1C)c1ccccc1Cl	ZINC000439847872	330744036	/nfs/dbraw/zinc/74/40/36/330744036.db2.gz	CKKAYHWPOZGXOM-UHFFFAOYSA-N	0	0	298.773	4.187	20	30		CIEDRN
C=CCN(CCc1ccccc1)C(=O)C1(CC(C)C)CC1	ZINC000440736578	330755541	/nfs/dbraw/zinc/75/55/41/330755541.db2.gz	LXNHUQFRLOCKOI-UHFFFAOYSA-N	0	0	285.431	4.070	20	30		CIEDRN
C=CCCN(C)C(=O)c1ccccc1Oc1cccc(C)c1	ZINC000440872151	330757353	/nfs/dbraw/zinc/75/73/53/330757353.db2.gz	HANAVFIPMMSPPD-UHFFFAOYSA-N	0	0	295.382	4.435	20	30		CIEDRN
C[C@@H](CCC(=O)Nc1cccc(C#N)c1)c1ccccc1	ZINC000441296810	330765111	/nfs/dbraw/zinc/76/51/11/330765111.db2.gz	YBEJEVPAHNMITP-AWEZNQCLSA-N	0	0	278.355	4.081	20	30		CIEDRN
C[C@@H]1CCC[C@@]1(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000448665267	330774689	/nfs/dbraw/zinc/77/46/89/330774689.db2.gz	BPNFTPUKZGJFSU-FZKQIMNGSA-N	0	0	284.403	4.253	20	30		CIEDRN
CC[C@H](F)CSCc1ccc(Cl)cc1C#N	ZINC000442560877	330777025	/nfs/dbraw/zinc/77/70/25/330777025.db2.gz	YHXSZKJZVYDLPX-LBPRGKRZSA-N	0	0	257.761	4.193	20	30		CIEDRN
N#C[C@@H]1CC[C@H](Nc2cc(Cl)cc(C(F)(F)F)c2)C1	ZINC000442836082	330786035	/nfs/dbraw/zinc/78/60/35/330786035.db2.gz	GHYGTJIFRDHJFL-KCJUWKMLSA-N	0	0	288.700	4.463	20	30		CIEDRN
Cc1ccc(N[C@@H]2CC[C@@H](C#N)C2)cc1NC(=O)C(C)(C)C	ZINC000442859379	330787829	/nfs/dbraw/zinc/78/78/29/330787829.db2.gz	VDIPTGVPZVSHGC-ZIAGYGMSSA-N	0	0	299.418	4.084	20	30		CIEDRN
Cc1c(N[C@H]2CC[C@H](C#N)C2)cccc1C(F)(F)F	ZINC000442861884	330787987	/nfs/dbraw/zinc/78/79/87/330787987.db2.gz	ZDBILBAXDPLFGU-QWRGUYRKSA-N	0	0	268.282	4.118	20	30		CIEDRN
Cc1ccc2oc(S[C@H](C)c3cccc(C#N)c3)nc2n1	ZINC000442904052	330791273	/nfs/dbraw/zinc/79/12/73/330791273.db2.gz	BYKSRVBRBWCEAW-LLVKDONJSA-N	0	0	295.367	4.256	20	30		CIEDRN
C[C@@H](Sc1nc2ccccc2n1C)c1cccc(C#N)c1	ZINC000442914289	330791419	/nfs/dbraw/zinc/79/14/19/330791419.db2.gz	LXLOYVDIOHRGRS-GFCCVEGCSA-N	0	0	293.395	4.298	20	30		CIEDRN
CCc1nnc([C@H](C)S[C@@H](C)c2cccc(C#N)c2)o1	ZINC000443147634	330795746	/nfs/dbraw/zinc/79/57/46/330795746.db2.gz	WCWCFHJWTSWTSG-QWRGUYRKSA-N	0	0	287.388	4.059	20	30		CIEDRN
C=CCCCCNC(=O)N(CC)Cc1c[nH]c2ccccc12	ZINC000443195018	330796478	/nfs/dbraw/zinc/79/64/78/330796478.db2.gz	QIVFCSCZIYJMSK-UHFFFAOYSA-N	0	0	299.418	4.056	20	30		CIEDRN
N#Cc1nc(Sc2cccs2)ccc1C(F)(F)F	ZINC000443508896	330800446	/nfs/dbraw/zinc/80/04/46/330800446.db2.gz	HLQSWPXUXYKJNW-UHFFFAOYSA-N	0	0	286.303	4.185	20	30		CIEDRN
N#CCN(Cc1ccccc1Cl)c1ccc(F)cc1	ZINC000443595692	330802137	/nfs/dbraw/zinc/80/21/37/330802137.db2.gz	ZXNMBFQPFWRWCM-UHFFFAOYSA-N	0	0	274.726	4.009	20	30		CIEDRN
N#Cc1ccc(CNc2ccccc2Cc2ccccc2)o1	ZINC000157825737	330805876	/nfs/dbraw/zinc/80/58/76/330805876.db2.gz	HWFJGTNWLQAGAE-UHFFFAOYSA-N	0	0	288.350	4.354	20	30		CIEDRN
CCCOc1cccc(NCc2ccc(C#N)c(C)c2)c1	ZINC000443978605	330808286	/nfs/dbraw/zinc/80/82/86/330808286.db2.gz	IHKGOHXGASRZIB-UHFFFAOYSA-N	0	0	280.371	4.268	20	30		CIEDRN
Cc1cc(CNc2cc(F)ccc2OC(C)C)ccc1C#N	ZINC000443998188	330808953	/nfs/dbraw/zinc/80/89/53/330808953.db2.gz	TVWZHGOFDRIENF-UHFFFAOYSA-N	0	0	298.361	4.405	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N(CC(C)C)C1CCCC1	ZINC000444391299	330812361	/nfs/dbraw/zinc/81/23/61/330812361.db2.gz	IPTXUDLKMPAMOB-UHFFFAOYSA-N	0	0	299.418	4.299	20	30		CIEDRN
N#CCCCCN1C[C@H](c2ccccc2)c2ccccc21	ZINC000444762569	330823703	/nfs/dbraw/zinc/82/37/03/330823703.db2.gz	AIKKGVJUBGFUDJ-GOSISDBHSA-N	0	0	276.383	4.332	20	30		CIEDRN
CC(C)N(C)c1ccccc1CNc1ccc(C#N)cc1F	ZINC000445611953	330832992	/nfs/dbraw/zinc/83/29/92/330832992.db2.gz	DZNBMQNQXYPXQD-UHFFFAOYSA-N	0	0	297.377	4.154	20	30		CIEDRN
C=CCCC(=O)NCc1ccc(C)cc1OCCC(C)C	ZINC000446377287	330848272	/nfs/dbraw/zinc/84/82/72/330848272.db2.gz	QNWDUMZFWINOPW-UHFFFAOYSA-N	0	0	289.419	4.002	20	30		CIEDRN
COc1ccc(SCc2ccc(C#N)c(C)c2)cc1	ZINC000447295489	330863642	/nfs/dbraw/zinc/86/36/42/330863642.db2.gz	KVPGGRURSNLOPY-UHFFFAOYSA-N	0	0	269.369	4.168	20	30		CIEDRN
CCCC(C)(C)CC(=O)Nc1sc(CC)cc1C#N	ZINC000447398696	330866303	/nfs/dbraw/zinc/86/63/03/330866303.db2.gz	UKAWEIQXFNAVMQ-UHFFFAOYSA-N	0	0	278.421	4.337	20	30		CIEDRN
C=CCCCCCNc1ccccc1O[C@H]1CCOC1	ZINC000447403767	330866430	/nfs/dbraw/zinc/86/64/30/330866430.db2.gz	HBVFANHKDLBWON-HNNXBMFYSA-N	0	0	275.392	4.013	20	30		CIEDRN
C=CCC[C@@H](Nc1cnn(C2CCCC2)c1C)C1CC1	ZINC000447571971	330870597	/nfs/dbraw/zinc/87/05/97/330870597.db2.gz	LZSHUFYJBLYEFH-MRXNPFEDSA-N	0	0	273.424	4.463	20	30		CIEDRN
CSCCN(C)c1c(C#N)cnc2ccc(C(C)C)cc21	ZINC000447689231	330874171	/nfs/dbraw/zinc/87/41/71/330874171.db2.gz	KIZNGWQZRLMIFH-UHFFFAOYSA-N	0	0	299.443	4.029	20	30		CIEDRN
CC(C)[C@H]1C[C@@H](Nc2cccc(C#N)n2)c2ccccc21	ZINC000447807595	330877451	/nfs/dbraw/zinc/87/74/51/330877451.db2.gz	SIPKRMCDDBSMLA-IAGOWNOFSA-N	0	0	277.371	4.250	20	30		CIEDRN
C=CCCCNC(=O)N[C@@H](C)c1oc2ccccc2c1C	ZINC000447979960	330881986	/nfs/dbraw/zinc/88/19/86/330881986.db2.gz	BUNQWDLVIXTRGZ-ZDUSSCGKSA-N	0	0	286.375	4.068	20	30		CIEDRN
C=CCCCC[C@H](C)Nc1cccc(-c2nncn2C)c1	ZINC000449039095	330894507	/nfs/dbraw/zinc/89/45/07/330894507.db2.gz	BBQBHRDUAPFKEQ-AWEZNQCLSA-N	0	0	284.407	4.029	20	30		CIEDRN
N#CCc1cccc(NCc2cnc(C3CCC3)s2)c1	ZINC000449691189	330943759	/nfs/dbraw/zinc/94/37/59/330943759.db2.gz	UUEGAKWBTZSQNN-UHFFFAOYSA-N	0	0	283.400	4.089	20	30		CIEDRN
N#CCc1cccc(NCCCCOc2ccccc2)c1	ZINC000449694807	330943996	/nfs/dbraw/zinc/94/39/96/330943996.db2.gz	HAAMOAPMZOWCEZ-UHFFFAOYSA-N	0	0	280.371	4.024	20	30		CIEDRN
N#CCc1cccc(N[C@@H]2CCC[C@@H](c3cccnc3)C2)c1	ZINC000449695431	330944241	/nfs/dbraw/zinc/94/42/41/330944241.db2.gz	IHZRCACNWKDOMP-VQIMIIECSA-N	0	0	291.398	4.286	20	30		CIEDRN
C=CCC1(C(=O)Nc2cc(OC)ccc2Cl)CCCC1	ZINC000449807871	330950936	/nfs/dbraw/zinc/95/09/36/330950936.db2.gz	XQZKJGBHSGABFU-UHFFFAOYSA-N	0	0	293.794	4.424	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(-c3ncc[nH]3)cc2)CCCC1	ZINC000449818456	330951224	/nfs/dbraw/zinc/95/12/24/330951224.db2.gz	LOTFPOZJWZIZNV-UHFFFAOYSA-N	0	0	295.386	4.152	20	30		CIEDRN
C=CCC1(C(=O)Nc2cccc([C@@H](C)OC)c2)CCCC1	ZINC000449829511	330951501	/nfs/dbraw/zinc/95/15/01/330951501.db2.gz	SVZMBFMLNOJDCF-CQSZACIVSA-N	0	0	287.403	4.469	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000449884945	330953278	/nfs/dbraw/zinc/95/32/78/330953278.db2.gz	CQLJEOODTNBJIF-DJIMGWMZSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@H](C)c1ccc(-c2ccncc2)cc1	ZINC000450018439	330958755	/nfs/dbraw/zinc/95/87/55/330958755.db2.gz	RUPPLIZQJMYGCU-CQSZACIVSA-N	0	0	294.398	4.138	20	30		CIEDRN
C=CC(C)(C)C(=O)N1CCc2cc(-c3ccccc3)oc2C1	ZINC000450025724	330958989	/nfs/dbraw/zinc/95/89/89/330958989.db2.gz	HGSPHECXXZTZPC-UHFFFAOYSA-N	0	0	295.382	4.044	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H](C)c2ncc(C)s2)CCCCC1	ZINC000450068228	330960421	/nfs/dbraw/zinc/96/04/21/330960421.db2.gz	RQMDGXMYVDVHRY-ZDUSSCGKSA-N	0	0	292.448	4.155	20	30		CIEDRN
C=CC(C)(C)C(=O)N1CCc2cc(Cl)cc(Cl)c2C1	ZINC000450080066	330960747	/nfs/dbraw/zinc/96/07/47/330960747.db2.gz	ZYTFQIBNNRSVSG-UHFFFAOYSA-N	0	0	298.213	4.090	20	30		CIEDRN
N#Cc1ccc(COc2ccc(F)c(F)c2)c(Cl)c1	ZINC000162983037	330972643	/nfs/dbraw/zinc/97/26/43/330972643.db2.gz	ITLVXNNVWQQNFU-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
CCC(=O)c1ccc(OCc2ccc(C#N)cc2Cl)cc1	ZINC000163120927	330985004	/nfs/dbraw/zinc/98/50/04/330985004.db2.gz	NJEBERCESXOSQH-UHFFFAOYSA-N	0	0	299.757	4.383	20	30		CIEDRN
C[C@H](Nc1ccc(C#N)nc1)c1cccc(C2CC2)c1	ZINC000450560468	330986526	/nfs/dbraw/zinc/98/65/26/330986526.db2.gz	PEDRSFDEHRHNSE-LBPRGKRZSA-N	0	0	263.344	4.004	20	30		CIEDRN
CCCCSc1nnc(S[C@@H]2CC[C@H](C#N)C2)s1	ZINC000450726310	330996278	/nfs/dbraw/zinc/99/62/78/330996278.db2.gz	UPWKXWZQIJIRSN-VHSXEESVSA-N	0	0	299.490	4.215	20	30		CIEDRN
C[C@@H](Sc1ccc(C#N)cc1)C(=O)C1CCCCC1	ZINC000450810548	331000716	/nfs/dbraw/zinc/00/07/16/331000716.db2.gz	NCDUMNQTFNUMDR-GFCCVEGCSA-N	0	0	273.401	4.188	20	30		CIEDRN
N#Cc1ccc(SC[C@H]2CCCC2(F)F)c(F)c1	ZINC000450850249	331002742	/nfs/dbraw/zinc/00/27/42/331002742.db2.gz	WTPAIJFUGZHPNB-SNVBAGLBSA-N	0	0	271.307	4.225	20	30		CIEDRN
COc1ccccc1[C@H](C)SCC1(C#N)CCC1	ZINC000450852093	331002859	/nfs/dbraw/zinc/00/28/59/331002859.db2.gz	DFLMHCAMNXTONV-LBPRGKRZSA-N	0	0	261.390	4.183	20	30		CIEDRN
CCCc1nc(C)c(COc2cc(Cl)ccc2C#N)o1	ZINC000450881065	331004383	/nfs/dbraw/zinc/00/43/83/331004383.db2.gz	YEIJWVYWASESIW-UHFFFAOYSA-N	0	0	290.750	4.040	20	30		CIEDRN
CC(=O)c1cccc(C(F)(F)F)c1OCCC(C)(C)C#N	ZINC000450929474	331007685	/nfs/dbraw/zinc/00/76/85/331007685.db2.gz	JGENDKPGAZXQEG-UHFFFAOYSA-N	0	0	299.292	4.227	20	30		CIEDRN
CSc1ccc(CS[C@H]2CC[C@@H](C#N)C2)cc1	ZINC000450943395	331008328	/nfs/dbraw/zinc/00/83/28/331008328.db2.gz	SMFZLTMGQCEWGL-OCCSQVGLSA-N	0	0	263.431	4.334	20	30		CIEDRN
C=CCC1(C(=O)Nc2cc(F)c(OC)cc2C)CCCC1	ZINC000450982267	331010059	/nfs/dbraw/zinc/01/00/59/331010059.db2.gz	SOMVFTMHUHDEEA-UHFFFAOYSA-N	0	0	291.366	4.218	20	30		CIEDRN
C=CCC1(C(=O)N2CCCC3(CCCC3)C2)CCCC1	ZINC000451001940	331011316	/nfs/dbraw/zinc/01/13/16/331011316.db2.gz	KMRZTXGEVKDLAZ-UHFFFAOYSA-N	0	0	275.436	4.306	20	30		CIEDRN
N#CC1(CN2CCc3ccc(-c4ccccc4)cc3C2)CC1	ZINC000451160108	331018186	/nfs/dbraw/zinc/01/81/86/331018186.db2.gz	SPVZBHUHVOODAA-UHFFFAOYSA-N	0	0	288.394	4.015	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@H]1CCC[C@@H](c2ccccc2)C1	ZINC000451172407	331018675	/nfs/dbraw/zinc/01/86/75/331018675.db2.gz	VYIAKCAYHMEDHT-CVEARBPZSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CC[C@H]1N(C(=O)CC2CC(F)(F)C2)CCCC1(C)C	ZINC000451216692	331020871	/nfs/dbraw/zinc/02/08/71/331020871.db2.gz	MQMVCVDVFFXDFA-CYBMUJFWSA-N	0	0	285.378	4.015	20	30		CIEDRN
C=CCC1(C(=O)N2CC(C3CCCC3)C2)CCCCC1	ZINC000451357011	331025548	/nfs/dbraw/zinc/02/55/48/331025548.db2.gz	FZDWVFUSYCGMNK-UHFFFAOYSA-N	0	0	275.436	4.162	20	30		CIEDRN
C=CCC1(C(=O)N2CCCC[C@@H]2C(F)F)CCCCC1	ZINC000451678041	331038804	/nfs/dbraw/zinc/03/88/04/331038804.db2.gz	HIXRXMYJPTWAOM-CYBMUJFWSA-N	0	0	285.378	4.159	20	30		CIEDRN
N#Cc1ccc(F)c(CN2CC3(CCC3)[C@@H]2c2ccco2)c1	ZINC000451833587	331044142	/nfs/dbraw/zinc/04/41/42/331044142.db2.gz	IEJQIRJFWWJKOO-KRWDZBQOSA-N	0	0	296.345	4.018	20	30		CIEDRN
N#Cc1c(F)cccc1CN1CC2(CCC2)[C@@H]1c1ccco1	ZINC000451853868	331044737	/nfs/dbraw/zinc/04/47/37/331044737.db2.gz	MICICFXCUQEHOO-KRWDZBQOSA-N	0	0	296.345	4.018	20	30		CIEDRN
CC[C@@H]1CCC[C@H]1C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000452139510	331055622	/nfs/dbraw/zinc/05/56/22/331055622.db2.gz	NVYGSIQQBQYPSN-KBAYOESNSA-N	0	0	298.430	4.364	20	30		CIEDRN
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000452142415	331055813	/nfs/dbraw/zinc/05/58/13/331055813.db2.gz	XFXGUXHZOGBISJ-KURKYZTESA-N	0	0	298.430	4.220	20	30		CIEDRN
C=CCC1(C(=O)NCCCC(C)(F)F)CCCCC1	ZINC000452204088	331058481	/nfs/dbraw/zinc/05/84/81/331058481.db2.gz	GSYSVFBWTQUSEO-UHFFFAOYSA-N	0	0	273.367	4.065	20	30		CIEDRN
C=CCC1(C(=O)Nc2cncc(Cl)c2C)CCCC1	ZINC000452224017	331059272	/nfs/dbraw/zinc/05/92/72/331059272.db2.gz	AYAHSLWUJYTDHF-UHFFFAOYSA-N	0	0	278.783	4.118	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1ccc2cc[nH]c2c1)c1ccccc1	ZINC000194817132	331060862	/nfs/dbraw/zinc/06/08/62/331060862.db2.gz	WVEAOVIWINZMQC-KRWDZBQOSA-N	0	0	290.366	4.466	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H](C)c1ccc(F)c(C)c1	ZINC000452321812	331062435	/nfs/dbraw/zinc/06/24/35/331062435.db2.gz	OPCRRVKKIJTQED-CYBMUJFWSA-N	0	0	275.367	4.080	20	30		CIEDRN
CC(C)=CCC[C@H](C)NC(=O)c1cc(C#N)ccc1Cl	ZINC000452540023	331067940	/nfs/dbraw/zinc/06/79/40/331067940.db2.gz	IJRBGBIYPWNXCC-LBPRGKRZSA-N	0	0	290.794	4.076	20	30		CIEDRN
C[C@H]1C[C@@H](CC(=O)N[C@H]2CC[C@@H](CC#N)C2)CC(C)(C)C1	ZINC000452560353	331068903	/nfs/dbraw/zinc/06/89/03/331068903.db2.gz	CPRDMNAHYFNIAQ-VGWMRTNUSA-N	0	0	290.451	4.037	20	30		CIEDRN
CC1(C)C(C(=O)Nc2ccc(CC#N)cc2Cl)C1(C)C	ZINC000452640645	331070716	/nfs/dbraw/zinc/07/07/16/331070716.db2.gz	BQSWIORDBCNYBA-UHFFFAOYSA-N	0	0	290.794	4.027	20	30		CIEDRN
CC(C)C[C@H](C)CC(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452646775	331070911	/nfs/dbraw/zinc/07/09/11/331070911.db2.gz	PJGHLVGQGPDQFD-LBPRGKRZSA-N	0	0	292.810	4.417	20	30		CIEDRN
CC(C)[C@@]1(C)C[C@H]1C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452644241	331070924	/nfs/dbraw/zinc/07/09/24/331070924.db2.gz	BNWDEQGHFWUNEC-BLLLJJGKSA-N	0	0	290.794	4.027	20	30		CIEDRN
N#CCc1ccc(NC(=O)C2=CCCCCC2)c(Cl)c1	ZINC000452644636	331070958	/nfs/dbraw/zinc/07/09/58/331070958.db2.gz	CBLPJRXXDOLFBF-UHFFFAOYSA-N	0	0	288.778	4.235	20	30		CIEDRN
CC1(C)CC[C@H](C(=O)Nc2ccc(CC#N)cc2Cl)C1	ZINC000452648919	331070999	/nfs/dbraw/zinc/07/09/99/331070999.db2.gz	WDCSUMBFYHLQPU-LBPRGKRZSA-N	0	0	290.794	4.171	20	30		CIEDRN
C[C@@H]1CCC[C@@H](C(=O)Nc2ccc(CC#N)cc2Cl)C1	ZINC000452649690	331071085	/nfs/dbraw/zinc/07/10/85/331071085.db2.gz	XJRRWVHHSVPPHF-DGCLKSJQSA-N	0	0	290.794	4.171	20	30		CIEDRN
CC(C)CCCC(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452653470	331071217	/nfs/dbraw/zinc/07/12/17/331071217.db2.gz	ZMSSXYOVFYADQL-UHFFFAOYSA-N	0	0	278.783	4.171	20	30		CIEDRN
CC[C@H]1CCC[C@H]1C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000452653255	331071252	/nfs/dbraw/zinc/07/12/52/331071252.db2.gz	ZHVRQBHAMOKDSY-QWHCGFSZSA-N	0	0	290.794	4.171	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cccc(OC(C)C)c1	ZINC000452679832	331072098	/nfs/dbraw/zinc/07/20/98/331072098.db2.gz	XRFUMAGAYSIJDG-CYBMUJFWSA-N	0	0	261.365	4.015	20	30		CIEDRN
C=C(C)CCNC(=O)c1ccc(C(C)(C)C(F)(F)F)cc1	ZINC000452718071	331073242	/nfs/dbraw/zinc/07/32/42/331073242.db2.gz	OBWQNKHAIOUBEG-UHFFFAOYSA-N	0	0	299.336	4.223	20	30		CIEDRN
C=C(C)CCNC(=O)C(C)(C)c1cccc(C(F)(F)F)c1	ZINC000452719263	331073481	/nfs/dbraw/zinc/07/34/81/331073481.db2.gz	STURTFHMWKXTFG-UHFFFAOYSA-N	0	0	299.336	4.065	20	30		CIEDRN
C=C(C)CCNC(=O)CCC[C@H](C)c1cccc(OC)c1	ZINC000452720986	331073774	/nfs/dbraw/zinc/07/37/74/331073774.db2.gz	YREUODVNAWMDAE-HNNXBMFYSA-N	0	0	289.419	4.051	20	30		CIEDRN
C=C(C)CCNC(=O)c1sc2ccc(F)cc2c1C	ZINC000452726510	331074430	/nfs/dbraw/zinc/07/44/30/331074430.db2.gz	VNPREKLBUZPTLD-UHFFFAOYSA-N	0	0	277.364	4.045	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@H](Cc2ccccc2)[C@H]1C	ZINC000467330390	331074705	/nfs/dbraw/zinc/07/47/05/331074705.db2.gz	PIZDLZGERVOLIO-VQIMIIECSA-N	0	0	297.442	4.235	20	30		CIEDRN
C=C[C@H](CC(=O)NC1(CC)CCCC1)c1ccccc1	ZINC000452974768	331082395	/nfs/dbraw/zinc/08/23/95/331082395.db2.gz	LWENJZJMBJKWRE-OAHLLOKOSA-N	0	0	271.404	4.185	20	30		CIEDRN
C=CC(C)(C)c1nc(-c2ccc(CSC)cc2)no1	ZINC000453083509	331087477	/nfs/dbraw/zinc/08/74/77/331087477.db2.gz	ILRIXHDMHMVTPN-UHFFFAOYSA-N	0	0	274.389	4.063	20	30		CIEDRN
N#CCCCOc1cccc(N[C@H](C2CC2)C2CCC2)c1	ZINC000453161954	331095779	/nfs/dbraw/zinc/09/57/79/331095779.db2.gz	KKRBZLOWIUHATR-SFHVURJKSA-N	0	0	284.403	4.360	20	30		CIEDRN
C=C(C)CCc1noc(C2CC(O)(CCC(C)(C)C)C2)n1	ZINC000453179207	331097764	/nfs/dbraw/zinc/09/77/64/331097764.db2.gz	IHLNRNWABIUUML-UHFFFAOYSA-N	0	0	292.423	4.013	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cc3cccnc3s2)n1	ZINC000453190625	331099339	/nfs/dbraw/zinc/09/93/39/331099339.db2.gz	VGKVYYNKBSBLFZ-UHFFFAOYSA-N	0	0	285.372	4.200	20	30		CIEDRN
C=CCC(CC=C)c1nc([C@H](Cc2ccccc2)OC)no1	ZINC000453212711	331102030	/nfs/dbraw/zinc/10/20/30/331102030.db2.gz	CQJKBEQUNNAUNX-INIZCTEOSA-N	0	0	298.386	4.236	20	30		CIEDRN
C=CCC(C)(C)c1nc([C@@H]2CSc3ccccc32)no1	ZINC000453214864	331102314	/nfs/dbraw/zinc/10/23/14/331102314.db2.gz	IHHBUKYFQFTVGR-GFCCVEGCSA-N	0	0	286.400	4.161	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc([C@H](Cc2ccccc2)OC)no1	ZINC000453236095	331105061	/nfs/dbraw/zinc/10/50/61/331105061.db2.gz	UIIHAHZENXLRCQ-HIFRSBDPSA-N	0	0	286.375	4.070	20	30		CIEDRN
C=CCCc1noc(CSc2ccc(C)cc2C)n1	ZINC000453250706	331107695	/nfs/dbraw/zinc/10/76/95/331107695.db2.gz	YRWJRXHCLNQDEX-UHFFFAOYSA-N	0	0	274.389	4.097	20	30		CIEDRN
CC(C)Oc1cccc(N[C@H]2CCc3ccc(C#N)cc32)c1	ZINC000453284910	331111041	/nfs/dbraw/zinc/11/10/41/331111041.db2.gz	GJAPPNVCJMOLLM-IBGZPJMESA-N	0	0	292.382	4.445	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1C[C@H](c2ccccc2C)C[C@H]1C	ZINC000467340739	331133979	/nfs/dbraw/zinc/13/39/79/331133979.db2.gz	KFRKIRVTCMTBPX-SJLPKXTDSA-N	0	0	297.442	4.468	20	30		CIEDRN
C=CCCCC(=O)N1C[C@@H](c2ccc(C)cc2)C[C@H]1C	ZINC000470573966	331138914	/nfs/dbraw/zinc/13/89/14/331138914.db2.gz	KKLVSWVREOHJLU-WBVHZDCISA-N	0	0	271.404	4.056	20	30		CIEDRN
Cc1ccccc1NC(=O)C(C)(C)Cc1ccc(C#N)cc1	ZINC000454163410	331140400	/nfs/dbraw/zinc/14/04/00/331140400.db2.gz	HZWSKEBWRMVZIE-UHFFFAOYSA-N	0	0	292.382	4.074	20	30		CIEDRN
C=CC(C)(C)CNC(=O)Nc1ccccc1C(C)(C)C	ZINC000454205099	331141677	/nfs/dbraw/zinc/14/16/77/331141677.db2.gz	NJFWAPYNGJTCCB-UHFFFAOYSA-N	0	0	274.408	4.318	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N1CC2(CCCC2)[C@H]1c1ccccc1	ZINC000454521152	331147878	/nfs/dbraw/zinc/14/78/78/331147878.db2.gz	JKJGTOMSQZRKRW-NVXWUHKLSA-N	0	0	298.430	4.278	20	30		CIEDRN
C=C(C)CCNC(=O)Nc1cccc(CSCC)c1	ZINC000454858463	331155135	/nfs/dbraw/zinc/15/51/35/331155135.db2.gz	SFYXGXORBGPYLW-UHFFFAOYSA-N	0	0	278.421	4.027	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)N1CCC[C@@]1(C)CC(C)C	ZINC000455005148	331158675	/nfs/dbraw/zinc/15/86/75/331158675.db2.gz	RXRBZVNCDXKLND-SFHVURJKSA-N	0	0	299.418	4.299	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)N1C[C@@H](C(C)C)[C@H]1C(C)C	ZINC000455004460	331158688	/nfs/dbraw/zinc/15/86/88/331158688.db2.gz	RPGFOUPCLLPOMZ-DOTOQJQBSA-N	0	0	299.418	4.011	20	30		CIEDRN
C=CC(C)(C)CNC(=O)Nc1c(C)cccc1SC	ZINC000455142420	331161603	/nfs/dbraw/zinc/16/16/03/331161603.db2.gz	CXWHSDBUHGXTOW-UHFFFAOYSA-N	0	0	278.421	4.051	20	30		CIEDRN
C=C(C)CCNC(=O)N(C)Cc1csc2ccccc12	ZINC000455308697	331165303	/nfs/dbraw/zinc/16/53/03/331165303.db2.gz	KAHWCMXWWTZYTD-UHFFFAOYSA-N	0	0	288.416	4.009	20	30		CIEDRN
C=C(C)CCNC(=O)N1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2	ZINC000455328135	331166417	/nfs/dbraw/zinc/16/64/17/331166417.db2.gz	QTZJBXXMSPAKQW-BCDXTJNWSA-N	0	0	298.430	4.073	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CC[C@H]1C(C)C	ZINC000455374269	331167659	/nfs/dbraw/zinc/16/76/59/331167659.db2.gz	BXUODICDOXLPMO-INIZCTEOSA-N	0	0	272.392	4.067	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1C[C@@H]2CCCC[C@@H]2C1	ZINC000455391856	331168558	/nfs/dbraw/zinc/16/85/58/331168558.db2.gz	ZECGQFPPCSIVFR-CALCHBBNSA-N	0	0	298.430	4.459	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1cccc(-c2ncco2)c1C	ZINC000455532820	331172472	/nfs/dbraw/zinc/17/24/72/331172472.db2.gz	OCKXGOBFPQBYAX-CYBMUJFWSA-N	0	0	299.374	4.126	20	30		CIEDRN
C=CCCCCCSc1nnc(C(C)(C)C)o1	ZINC000195438664	331173447	/nfs/dbraw/zinc/17/34/47/331173447.db2.gz	HNWDQGAUDIPCMD-UHFFFAOYSA-N	0	0	254.399	4.206	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1cc(OCC)ccc1Cl	ZINC000455782819	331177644	/nfs/dbraw/zinc/17/76/44/331177644.db2.gz	VFPURWXJTWIVMJ-UHFFFAOYSA-N	0	0	296.798	4.169	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1ccc(C(=O)C(C)C)cc1	ZINC000455804954	331177966	/nfs/dbraw/zinc/17/79/66/331177966.db2.gz	WOXIOAXQCBBGCK-CQSZACIVSA-N	0	0	288.391	4.002	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1ccc(CSCC)cc1	ZINC000455867600	331179169	/nfs/dbraw/zinc/17/91/69/331179169.db2.gz	UVRLJYMPTLKYDD-UHFFFAOYSA-N	0	0	292.448	4.370	20	30		CIEDRN
CCC[C@H](C)[C@H]1CCCN1C(=O)Nc1cccc(CC#N)c1	ZINC000455899643	331179908	/nfs/dbraw/zinc/17/99/08/331179908.db2.gz	BAOKRPUUUZYGEP-WMLDXEAASA-N	0	0	299.418	4.185	20	30		CIEDRN
CC(C)(CNC(=O)Nc1cccc(CC#N)c1)C1=CCCC1	ZINC000455907129	331180392	/nfs/dbraw/zinc/18/03/92/331180392.db2.gz	OWGJLOZCZQWIPI-UHFFFAOYSA-N	0	0	297.402	4.011	20	30		CIEDRN
CC(C)(C)[C@@H]1CCCN(C(=O)Nc2cccc(CC#N)c2)C1	ZINC000455910979	331180660	/nfs/dbraw/zinc/18/06/60/331180660.db2.gz	VHEVCDDOCHWMTL-OAHLLOKOSA-N	0	0	299.418	4.043	20	30		CIEDRN
CN(CCC1CCCCC1)C(=O)Nc1cccc(CC#N)c1	ZINC000455923718	331181217	/nfs/dbraw/zinc/18/12/17/331181217.db2.gz	UMFORCNKFPKXIB-UHFFFAOYSA-N	0	0	299.418	4.187	20	30		CIEDRN
CC(C)(C)CCCCNC(=O)Nc1cccc(CC#N)c1	ZINC000455922612	331181268	/nfs/dbraw/zinc/18/12/68/331181268.db2.gz	RBCNQOJLJUHOLM-UHFFFAOYSA-N	0	0	287.407	4.091	20	30		CIEDRN
CC(C)(C)C[C@H]1CCCN1C(=O)Nc1cccc(CC#N)c1	ZINC000455925844	331181309	/nfs/dbraw/zinc/18/13/09/331181309.db2.gz	YFMMZGPJCIKJIF-MRXNPFEDSA-N	0	0	299.418	4.185	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Nc1ccc2cnccc2c1	ZINC000455979964	331181702	/nfs/dbraw/zinc/18/17/02/331181702.db2.gz	FMESPZMMIHPYLX-UHFFFAOYSA-N	0	0	297.402	4.445	20	30		CIEDRN
C=C[C@H](CC(=O)NC(C)(C)C1CCC1)c1ccccc1	ZINC000456142294	331185396	/nfs/dbraw/zinc/18/53/96/331185396.db2.gz	GVKVBGAQPSQZAX-CQSZACIVSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CCC1(NC(=O)c2cc(O)ccc2Cl)CCCCC1	ZINC000456357869	331190708	/nfs/dbraw/zinc/19/07/08/331190708.db2.gz	AHULCVAFOLMAEX-UHFFFAOYSA-N	0	0	293.794	4.054	20	30		CIEDRN
C=CCC1(NC(=O)[C@@H](C)c2cccs2)CCCCC1	ZINC000456368100	331191311	/nfs/dbraw/zinc/19/13/11/331191311.db2.gz	OREXULYQZOOPEN-ZDUSSCGKSA-N	0	0	277.433	4.247	20	30		CIEDRN
C=CCC1(NC(=O)c2cc[nH]c2C(C)C)CCCCC1	ZINC000456374863	331191672	/nfs/dbraw/zinc/19/16/72/331191672.db2.gz	XJONCJNFDLNLHP-UHFFFAOYSA-N	0	0	274.408	4.147	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NC1(C(C)(C)c2ccccc2)CC1	ZINC000456803106	331204485	/nfs/dbraw/zinc/20/44/85/331204485.db2.gz	HJMZFAGGOIQFJD-OAHLLOKOSA-N	0	0	285.431	4.215	20	30		CIEDRN
C=C(CC)CNC(=O)c1ccc(Cl)cc1SCC	ZINC000456811197	331204891	/nfs/dbraw/zinc/20/48/91/331204891.db2.gz	IESILTHRKOPOLD-UHFFFAOYSA-N	0	0	283.824	4.148	20	30		CIEDRN
Cc1cc(C#N)cc(NC(=O)c2sccc2C(C)C)c1	ZINC000456933243	331208827	/nfs/dbraw/zinc/20/88/27/331208827.db2.gz	BFVDPGOZRHJLHR-UHFFFAOYSA-N	0	0	284.384	4.304	20	30		CIEDRN
C=CCCOCCCCC(=O)N[C@@H](C)[C@@H]1CCC[C@@H](C)C1	ZINC000456997410	331209762	/nfs/dbraw/zinc/20/97/62/331209762.db2.gz	ITJQLBGYIMXKKB-IXDOHACOSA-N	0	0	295.467	4.080	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@H]1CC[C@H](c2cccc(Cl)c2)C1	ZINC000457066118	331211233	/nfs/dbraw/zinc/21/12/33/331211233.db2.gz	GSOUQPNJCRRWAT-ZFWWWQNUSA-N	0	0	291.822	4.305	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C(C)C)C1CC(C)(C)C1	ZINC000457073578	331211482	/nfs/dbraw/zinc/21/14/82/331211482.db2.gz	MQTBSOVWFSBVGK-ZDUSSCGKSA-N	0	0	251.414	4.014	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C(C)C)C1CC(C)(C)C1	ZINC000457073577	331211492	/nfs/dbraw/zinc/21/14/92/331211492.db2.gz	MQTBSOVWFSBVGK-CYBMUJFWSA-N	0	0	251.414	4.014	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC2(CCCC2)[C@@H]1C(C)C	ZINC000457146946	331212877	/nfs/dbraw/zinc/21/28/77/331212877.db2.gz	PQMHYBGYVZAFCI-GJZGRUSLSA-N	0	0	263.425	4.016	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CC2(CCCC2)[C@H]1C(C)C	ZINC000457152715	331213101	/nfs/dbraw/zinc/21/31/01/331213101.db2.gz	XZWKYKQALCIKNJ-ZBFHGGJFSA-N	0	0	263.425	4.016	20	30		CIEDRN
C=CCCCN(C)C(=O)c1cccc(OCC=C(C)C)c1	ZINC000460146898	331213541	/nfs/dbraw/zinc/21/35/41/331213541.db2.gz	RUQPKDDLMFWLCK-UHFFFAOYSA-N	0	0	287.403	4.070	20	30		CIEDRN
C=CCCC(=O)N1CC2(CCCC2)[C@@H]1c1ccccc1	ZINC000457278061	331217876	/nfs/dbraw/zinc/21/78/76/331217876.db2.gz	LFBAMZLCBQFPTE-KRWDZBQOSA-N	0	0	269.388	4.097	20	30		CIEDRN
CC[C@H](CC(F)F)C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000457418359	331222215	/nfs/dbraw/zinc/22/22/15/331222215.db2.gz	HETRAJMJVJWXRI-LLVKDONJSA-N	0	0	294.345	4.108	20	30		CIEDRN
CC[C@@H](CC(F)F)C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000457418361	331222277	/nfs/dbraw/zinc/22/22/77/331222277.db2.gz	HETRAJMJVJWXRI-NSHDSACASA-N	0	0	294.345	4.108	20	30		CIEDRN
C=CC[C@H]1N(C(=O)[C@@H](CC)CC(F)F)CCCC1(C)C	ZINC000457750094	331233219	/nfs/dbraw/zinc/23/32/19/331233219.db2.gz	BWISPKGDBFJHGP-QWHCGFSZSA-N	0	0	287.394	4.261	20	30		CIEDRN
CC(C)c1ccc(/C=C\CC(=O)NCC(C)(C)CC#N)cc1	ZINC000457992514	331239604	/nfs/dbraw/zinc/23/96/04/331239604.db2.gz	LDWBYGNERGXLMY-WAYWQWQTSA-N	0	0	298.430	4.269	20	30		CIEDRN
C=CC(C)(C)C(=O)N1CC2(CCCCC2)[C@@H]1C(C)C	ZINC000458170831	331244186	/nfs/dbraw/zinc/24/41/86/331244186.db2.gz	IHILEDYDPAEDKN-AWEZNQCLSA-N	0	0	263.425	4.016	20	30		CIEDRN
C=CCC1(C(=O)N2Cc3ccc(Cl)cc3C2)CCCC1	ZINC000458287081	331247315	/nfs/dbraw/zinc/24/73/15/331247315.db2.gz	IMUWYYFGPGAZNL-UHFFFAOYSA-N	0	0	289.806	4.319	20	30		CIEDRN
C=CCC[C@H](C(=O)N[C@@H]1CCC[C@@H]2C[C@@H]21)c1ccccc1	ZINC000458307291	331247955	/nfs/dbraw/zinc/24/79/55/331247955.db2.gz	UGXCEJAPUCWSPZ-VSZNYVQBSA-N	0	0	283.415	4.041	20	30		CIEDRN
CCCC[C@@H](C)N(CCCC)C(=O)NCC1(CC#N)CC1	ZINC000458718694	331257685	/nfs/dbraw/zinc/25/76/85/331257685.db2.gz	BKJXSNKLICEJCO-OAHLLOKOSA-N	0	0	293.455	4.071	20	30		CIEDRN
C=CCCCN(C)C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000458795673	331259980	/nfs/dbraw/zinc/25/99/80/331259980.db2.gz	CVCQLZZUFFJJAI-QGZVFWFLSA-N	0	0	299.418	4.029	20	30		CIEDRN
C[C@@H]1CC[C@@H](C)N1C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000458797702	331259985	/nfs/dbraw/zinc/25/99/85/331259985.db2.gz	GNXJXCRLRSRKJQ-INMHGKMJSA-N	0	0	299.418	4.004	20	30		CIEDRN
C=CCN(CC=C)C(=O)N[C@@H](C)c1cccc(C2CC2)c1	ZINC000458872876	331262139	/nfs/dbraw/zinc/26/21/39/331262139.db2.gz	GTVGLNAIBTVLOB-AWEZNQCLSA-N	0	0	284.403	4.009	20	30		CIEDRN
C=C(C)CCNC(=O)N(C)[C@@H](c1ccc(F)cc1)C(C)C	ZINC000459007079	331266040	/nfs/dbraw/zinc/26/60/40/331266040.db2.gz	SGKUSTASCVXQIV-MRXNPFEDSA-N	0	0	292.398	4.130	20	30		CIEDRN
CC(C)(C)c1ccccc1NC(=O)NCC(C)(C)CC#N	ZINC000459234010	331272368	/nfs/dbraw/zinc/27/23/68/331272368.db2.gz	OAPRMWNCGVBXBI-UHFFFAOYSA-N	0	0	287.407	4.045	20	30		CIEDRN
N#C[C@@H]1CCC[C@@H]1NCc1ccc(-c2ccsc2)cc1	ZINC000459452313	331282087	/nfs/dbraw/zinc/28/20/87/331282087.db2.gz	BLJAQORRASWMHI-RDJZCZTQSA-N	0	0	282.412	4.197	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N[C@@H]1CCC[C@@H]2C[C@@H]21	ZINC000459547476	331287228	/nfs/dbraw/zinc/28/72/28/331287228.db2.gz	JZIAFALPCZYBRC-HLLBOEOZSA-N	0	0	284.403	4.115	20	30		CIEDRN
N#CCC[C@@H](C#N)CN1CC2(CCCC2)[C@H]1c1ccccc1	ZINC000459576969	331289044	/nfs/dbraw/zinc/28/90/44/331289044.db2.gz	VNWZXNHQJZJPDQ-FUHWJXTLSA-N	0	0	293.414	4.047	20	30		CIEDRN
Cc1sc(NC(=O)CC2CC(C)(C)C2)c(C#N)c1C	ZINC000459845520	331302565	/nfs/dbraw/zinc/30/25/65/331302565.db2.gz	MSAHQARTSPDALC-UHFFFAOYSA-N	0	0	276.405	4.001	20	30		CIEDRN
CCCCN(C(=O)c1cscc1C#N)c1ccccc1	ZINC000459869543	331302686	/nfs/dbraw/zinc/30/26/86/331302686.db2.gz	QHFJBPBVNFGNDO-UHFFFAOYSA-N	0	0	284.384	4.067	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@]1(C)CCC[C@@H]1C	ZINC000459876413	331302712	/nfs/dbraw/zinc/30/27/12/331302712.db2.gz	DJAJQSUBZWIDRS-XJKSGUPXSA-N	0	0	277.433	4.089	20	30		CIEDRN
CC[C@@H](c1ccccc1)N(CC)C(=O)c1cscc1C#N	ZINC000459973138	331303955	/nfs/dbraw/zinc/30/39/55/331303955.db2.gz	OEVYBRQQRYCBNM-INIZCTEOSA-N	0	0	298.411	4.233	20	30		CIEDRN
CCCCCN(C(=O)c1cscc1C#N)[C@H](C)CCC	ZINC000460049247	331304694	/nfs/dbraw/zinc/30/46/94/331304694.db2.gz	JRUADRVFMXCLJX-CYBMUJFWSA-N	0	0	292.448	4.441	20	30		CIEDRN
C=C(C)Cn1c([C@H](C)CC)nnc1N1CCCCC[C@H]1C	ZINC000460960268	331309449	/nfs/dbraw/zinc/30/94/49/331309449.db2.gz	RGKMXLXQTDRDBW-HUUCEWRRSA-N	0	0	290.455	4.137	20	30		CIEDRN
CC(C)(C#N)CCSC[C@@H]1C[C@H]1c1ccccc1	ZINC000461238795	331312013	/nfs/dbraw/zinc/31/20/13/331312013.db2.gz	DKAIPCOCTPCMHW-GJZGRUSLSA-N	0	0	259.418	4.463	20	30		CIEDRN
Cc1ccc(Cl)cc1NC(=O)[C@H](C)c1cccc(C#N)c1	ZINC000461777191	331314583	/nfs/dbraw/zinc/31/45/83/331314583.db2.gz	MVHCOTDZQFSJRI-GFCCVEGCSA-N	0	0	298.773	4.262	20	30		CIEDRN
Cc1ccc(NC(=O)[C@H](C)c2cccc(C#N)c2)cc1Cl	ZINC000461788783	331314648	/nfs/dbraw/zinc/31/46/48/331314648.db2.gz	LDNKOIDGCCPVHY-GFCCVEGCSA-N	0	0	298.773	4.262	20	30		CIEDRN
Cc1nc(Oc2ccc3ncccc3c2)c(Cl)cc1C#N	ZINC000461791058	331314690	/nfs/dbraw/zinc/31/46/90/331314690.db2.gz	SCKKNOXXDAIQAZ-UHFFFAOYSA-N	0	0	295.729	4.256	20	30		CIEDRN
CC[C@@H](Cc1ccc(C)cc1)Nc1ccc(CC#N)cc1	ZINC000462066873	331317224	/nfs/dbraw/zinc/31/72/24/331317224.db2.gz	VPTCKSSWLMPSHG-SFHVURJKSA-N	0	0	278.399	4.494	20	30		CIEDRN
CC[C@@H]1CCCC[C@@H]1N(C)C(=O)[C@H](C)c1cccc(C#N)c1	ZINC000462202383	331318420	/nfs/dbraw/zinc/31/84/20/331318420.db2.gz	WCYDMKZVGKAZDY-KYJSFNMBSA-N	0	0	298.430	4.089	20	30		CIEDRN
CC(C)CC[C@H]1CCCN1C(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000462246853	331318740	/nfs/dbraw/zinc/31/87/40/331318740.db2.gz	MOAGPWBEHLXKCW-MAUKXSAKSA-N	0	0	298.430	4.089	20	30		CIEDRN
CC#CCCSCc1csc(-c2ccc(C)o2)n1	ZINC000462359689	331320472	/nfs/dbraw/zinc/32/04/72/331320472.db2.gz	NPCMHCWCXUXSMC-UHFFFAOYSA-N	0	0	277.414	4.358	20	30		CIEDRN
N#Cc1cccc(Cl)c1N[C@@H]1CCc2c1cccc2F	ZINC000462379891	331320977	/nfs/dbraw/zinc/32/09/77/331320977.db2.gz	ZFQVBYQRAWWHQB-OAHLLOKOSA-N	0	0	286.737	4.450	20	30		CIEDRN
N#Cc1cccc(Cl)c1N[C@H]1CCc2c1cccc2F	ZINC000462379889	331321020	/nfs/dbraw/zinc/32/10/20/331321020.db2.gz	ZFQVBYQRAWWHQB-HNNXBMFYSA-N	0	0	286.737	4.450	20	30		CIEDRN
Cc1ccc2c(c1)CC[C@@H]2Nc1ccc(F)cc1C#N	ZINC000462384268	331321120	/nfs/dbraw/zinc/32/11/20/331321120.db2.gz	OAPMKMVHQMSRSE-KRWDZBQOSA-N	0	0	266.319	4.105	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H]1CCCCC12CCCC2	ZINC000462418064	331321695	/nfs/dbraw/zinc/32/16/95/331321695.db2.gz	XHWRKXIGKGYEDF-CABCVRRESA-N	0	0	263.425	4.208	20	30		CIEDRN
CCc1cc(NC(=O)[C@@H](C)c2cccc(C#N)c2)ccc1F	ZINC000462434670	331322045	/nfs/dbraw/zinc/32/20/45/331322045.db2.gz	FBKXQPYJLXIWEC-LBPRGKRZSA-N	0	0	296.345	4.002	20	30		CIEDRN
CSCCCOc1ccc(-c2ccc(C#N)cc2)cc1	ZINC000462562934	331323569	/nfs/dbraw/zinc/32/35/69/331323569.db2.gz	QBYLXGKZQNGAHQ-UHFFFAOYSA-N	0	0	283.396	4.357	20	30		CIEDRN
C=CCCCOc1cccc(NC(=O)c2cccs2)c1	ZINC000462647145	331324682	/nfs/dbraw/zinc/32/46/82/331324682.db2.gz	XXHZVHACMKLFSU-UHFFFAOYSA-N	0	0	287.384	4.345	20	30		CIEDRN
Cc1ccc(CNc2c(Cl)cccc2C#N)c(C)c1	ZINC000462779711	331328559	/nfs/dbraw/zinc/32/85/59/331328559.db2.gz	UEAOTABHKZNOHD-UHFFFAOYSA-N	0	0	270.763	4.441	20	30		CIEDRN
CC(C)COc1cccc(CNc2ccc(F)cc2C#N)c1	ZINC000462792954	331329329	/nfs/dbraw/zinc/32/93/29/331329329.db2.gz	YECIOETWWXKWKA-UHFFFAOYSA-N	0	0	298.361	4.344	20	30		CIEDRN
COc1ccc(C#N)cc1N[C@@H](C)CCc1ccsc1	ZINC000462792739	331329366	/nfs/dbraw/zinc/32/93/66/331329366.db2.gz	QMGFJLBTMCIKTC-LBPRGKRZSA-N	0	0	286.400	4.062	20	30		CIEDRN
CC(C)(C)C[C@@H]1CCCN1c1ccc(F)cc1C#N	ZINC000462813194	331330552	/nfs/dbraw/zinc/33/05/52/331330552.db2.gz	QOVCKEKJFIPHIY-AWEZNQCLSA-N	0	0	260.356	4.102	20	30		CIEDRN
C=CC[C@@H](C)[C@H](C)Nc1ncccc1CCCCOC	ZINC000462825639	331331400	/nfs/dbraw/zinc/33/14/00/331331400.db2.gz	MMORFIFBOOKMKL-CABCVRRESA-N	0	0	276.424	4.063	20	30		CIEDRN
C[C@@H](c1nc([C@@H]2CCC[C@@H](C)C2)no1)c1cccc(C#N)c1	ZINC000462830072	331331801	/nfs/dbraw/zinc/33/18/01/331331801.db2.gz	STICURVVMPTUDN-XJKCOSOUSA-N	0	0	295.386	4.387	20	30		CIEDRN
N#Cc1cc(F)ccc1N1CCC[C@@]2(CC=CCC2)C1	ZINC000462831466	331331913	/nfs/dbraw/zinc/33/19/13/331331913.db2.gz	CTROKKYZCGNHPP-KRWDZBQOSA-N	0	0	270.351	4.024	20	30		CIEDRN
C=CCCCN(C)c1c(C#N)cnc2ccc(Cl)cc21	ZINC000462857125	331332833	/nfs/dbraw/zinc/33/28/33/331332833.db2.gz	RQDFYFVMYHJRNO-UHFFFAOYSA-N	0	0	285.778	4.162	20	30		CIEDRN
N#Cc1cc(N[C@H]2C[C@@H]2Cc2ccccc2)nc2ccccc12	ZINC000462870563	331333498	/nfs/dbraw/zinc/33/34/98/331333498.db2.gz	KEZSXCXUFGQTBN-KXBFYZLASA-N	0	0	299.377	4.150	20	30		CIEDRN
COc1ccc([C@H](C)CCNc2ccc(C#N)cc2F)cc1	ZINC000462886836	331333992	/nfs/dbraw/zinc/33/39/92/331333992.db2.gz	VKNSYIYFMVNNFS-CYBMUJFWSA-N	0	0	298.361	4.312	20	30		CIEDRN
N#Cc1ccc(N[C@@H]2C[C@@H]2Cc2ccccc2)cc1Cl	ZINC000462883774	331334006	/nfs/dbraw/zinc/33/40/06/331334006.db2.gz	NNYDTSGGHOHMJQ-WMLDXEAASA-N	0	0	282.774	4.255	20	30		CIEDRN
CC[C@H](CC#N)NCc1ccc(C2CCCC2)cc1	ZINC000462916231	331335019	/nfs/dbraw/zinc/33/50/19/331335019.db2.gz	YWTQKPNUVJPTKK-QGZVFWFLSA-N	0	0	256.393	4.126	20	30		CIEDRN
C[C@H](CCc1ccco1)Nc1c(Cl)cccc1C#N	ZINC000462925544	331335254	/nfs/dbraw/zinc/33/52/54/331335254.db2.gz	IEQQLIDWFCAQJU-LLVKDONJSA-N	0	0	274.751	4.238	20	30		CIEDRN
CC[C@@]1(C)CCCN(c2c(C#N)cnc3ccccc32)C1	ZINC000462948928	331335708	/nfs/dbraw/zinc/33/57/08/331335708.db2.gz	XGDAWMTZXDZGGM-SFHVURJKSA-N	0	0	279.387	4.123	20	30		CIEDRN
CC(C)(C)[C@@](C)(C#N)NC(=O)CC1CC(c2ccccc2)C1	ZINC000463056781	331338920	/nfs/dbraw/zinc/33/89/20/331338920.db2.gz	XXCYOUKFHCCCIZ-GSQSYGFSSA-N	0	0	298.430	4.015	20	30		CIEDRN
CCCCN1CCc2ccc(N[C@@H]3CCC[C@@H](C#N)C3)cc21	ZINC000463243353	331343935	/nfs/dbraw/zinc/34/39/35/331343935.db2.gz	PHDRJLKEYKFGNU-NVXWUHKLSA-N	0	0	297.446	4.343	20	30		CIEDRN
CCN(C(=O)[C@@H](C)c1cccc(C#N)c1)c1ccccc1C	ZINC000463282944	331345013	/nfs/dbraw/zinc/34/50/13/331345013.db2.gz	ZGYQYVCSUZIZRD-HNNXBMFYSA-N	0	0	292.382	4.023	20	30		CIEDRN
C=CCN(C(=O)N[C@H]1c2ccccc2CCC[C@H]1C)C1CC1	ZINC000463284065	331345193	/nfs/dbraw/zinc/34/51/93/331345193.db2.gz	GQVFTUYGBPJILW-RDTXWAMCSA-N	0	0	298.430	4.060	20	30		CIEDRN
Cc1ccc(N[C@H]2CCC[C@H](C#N)C2)c(Br)c1	ZINC000463288414	331345304	/nfs/dbraw/zinc/34/53/04/331345304.db2.gz	OYOQOCCKQOKXQQ-RYUDHWBXSA-N	0	0	293.208	4.252	20	30		CIEDRN
CCCCOc1ccccc1N[C@@H]1CCC[C@@H](C#N)C1	ZINC000463290704	331345389	/nfs/dbraw/zinc/34/53/89/331345389.db2.gz	UCLRDVMKFJHQDM-HUUCEWRRSA-N	0	0	272.392	4.360	20	30		CIEDRN
C=CCOCCCC(=O)NC1CCC(C(C)(C)CC)CC1	ZINC000463298784	331345741	/nfs/dbraw/zinc/34/57/41/331345741.db2.gz	AUFIVLPCQAJKEM-UHFFFAOYSA-N	0	0	295.467	4.080	20	30		CIEDRN
CCC[C@@H](Nc1ccc([N+](=O)[O-])c(C#N)c1)c1ccccc1	ZINC000463435806	331347603	/nfs/dbraw/zinc/34/76/03/331347603.db2.gz	KFJHSCFLWGECOS-MRXNPFEDSA-N	0	0	295.342	4.420	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)[C@@H](CC)c2ccccc2)s1	ZINC000463458514	331348143	/nfs/dbraw/zinc/34/81/43/331348143.db2.gz	OATAAKARNPNFGG-HNNXBMFYSA-N	0	0	298.411	4.314	20	30		CIEDRN
Cc1cc([C@@H](C)Nc2ccc([N+](=O)[O-])c(C#N)c2)ccc1F	ZINC000463646938	331350176	/nfs/dbraw/zinc/35/01/76/331350176.db2.gz	CDGPUXZIWGBBTR-LLVKDONJSA-N	0	0	299.305	4.087	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2cccc(C3CCC3)c2)CC1	ZINC000463826904	331352190	/nfs/dbraw/zinc/35/21/90/331352190.db2.gz	UHZYFHLTSJBQGV-UHFFFAOYSA-N	0	0	284.403	4.384	20	30		CIEDRN
CC[C@H](C)[C@@H](C)N(C(=O)[C@@H](C)c1cccc(C#N)c1)C1CC1	ZINC000463941094	331354195	/nfs/dbraw/zinc/35/41/95/331354195.db2.gz	DCDYDYCHRKSBSB-SOUVJXGZSA-N	0	0	298.430	4.087	20	30		CIEDRN
C=CCNC(=O)N[C@@H](CC(C)(C)C)c1ccc(Cl)cc1	ZINC000463967449	331354762	/nfs/dbraw/zinc/35/47/62/331354762.db2.gz	KBNSIDLYLLSCEO-AWEZNQCLSA-N	0	0	294.826	4.303	20	30		CIEDRN
CC(C)C[C@](C)(C#N)NC(=O)c1ccc(C2=CCCC2)cc1	ZINC000464135427	331357027	/nfs/dbraw/zinc/35/70/27/331357027.db2.gz	JOFQIHITAKZFED-LJQANCHMSA-N	0	0	296.414	4.312	20	30		CIEDRN
Cc1ccc(Cl)c(NC(=O)[C@@H](C)c2cccc(C#N)c2)c1	ZINC000464142755	331357073	/nfs/dbraw/zinc/35/70/73/331357073.db2.gz	RYKLBQZAKURNBF-LBPRGKRZSA-N	0	0	298.773	4.262	20	30		CIEDRN
CC(C)(C)[C@@](C)(C#N)NC(=O)CC1CCC(C)(C)CC1	ZINC000464159550	331357274	/nfs/dbraw/zinc/35/72/74/331357274.db2.gz	NDNJWHHVORVDER-QGZVFWFLSA-N	0	0	278.440	4.037	20	30		CIEDRN
CCCC[C@H](CC)C(=O)N(C)c1cc(Cl)ccc1C#N	ZINC000464271216	331359115	/nfs/dbraw/zinc/35/91/15/331359115.db2.gz	IMQUSRCHNNVFAI-LBPRGKRZSA-N	0	0	292.810	4.391	20	30		CIEDRN
CC(C)(C)[C@](C)(C#N)NC(=O)c1ccc(C2=CCCC2)cc1	ZINC000464303875	331359441	/nfs/dbraw/zinc/35/94/41/331359441.db2.gz	QFKBICMYJFTHSI-IBGZPJMESA-N	0	0	296.414	4.312	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H](CC(C)(C)C)C(F)(F)F	ZINC000498231133	331360264	/nfs/dbraw/zinc/36/02/64/331360264.db2.gz	HIAMUDOAVCFOFO-SNVBAGLBSA-N	0	0	279.346	4.072	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cccc(-c2nccs2)c1	ZINC000464440724	331360667	/nfs/dbraw/zinc/36/06/67/331360667.db2.gz	JAJWLOPPWUJLDT-LBPRGKRZSA-N	0	0	286.400	4.351	20	30		CIEDRN
N#CCCCC(=O)N1CCCCC[C@H]1/C=C\c1ccccc1	ZINC000464495174	331361451	/nfs/dbraw/zinc/36/14/51/331361451.db2.gz	LZMIIKBKPYMCSF-HWOXTHGCSA-N	0	0	296.414	4.165	20	30		CIEDRN
C=CC[C@H](C(=O)N(C)[C@@H]1CCC(C)(C)C1)c1ccccc1	ZINC000464491572	331361472	/nfs/dbraw/zinc/36/14/72/331361472.db2.gz	YNFSWPPGASBSPM-SJORKVTESA-N	0	0	285.431	4.383	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@@H](C)c1ccc(C)cc1C	ZINC000464528878	331361855	/nfs/dbraw/zinc/36/18/55/331361855.db2.gz	UQIYRBYPENIAGQ-HOTGVXAUSA-N	0	0	273.420	4.425	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC)Cc1ccc(Cl)cc1	ZINC000464559709	331361939	/nfs/dbraw/zinc/36/19/39/331361939.db2.gz	KJBDFHDMFOLRGG-ZDUSSCGKSA-N	0	0	279.811	4.291	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(Cl)c(F)c1	ZINC000464563017	331361955	/nfs/dbraw/zinc/36/19/55/331361955.db2.gz	CLNBILGEAFHIQM-VIFPVBQESA-N	0	0	255.720	4.020	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(Cl)c(F)c1	ZINC000464563016	331361968	/nfs/dbraw/zinc/36/19/68/331361968.db2.gz	CLNBILGEAFHIQM-SECBINFHSA-N	0	0	255.720	4.020	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccnn1[C@H](C)CC(C)C	ZINC000464563420	331361993	/nfs/dbraw/zinc/36/19/93/331361993.db2.gz	JZZCVSUOKSQBOD-ZIAGYGMSSA-N	0	0	277.412	4.031	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC)c1cccc(Cl)c1	ZINC000464535468	331362000	/nfs/dbraw/zinc/36/20/00/331362000.db2.gz	DOKOSFAENKSRFP-LBPRGKRZSA-N	0	0	265.784	4.295	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](c1ccc(C)cc1)C1CC1	ZINC000464537918	331362033	/nfs/dbraw/zinc/36/20/33/331362033.db2.gz	HTEZFJADIWCDDT-PBHICJAKSA-N	0	0	271.404	4.165	20	30		CIEDRN
CC#CCCCC(=O)N(CCCC)c1ccccc1	ZINC000464543494	331362197	/nfs/dbraw/zinc/36/21/97/331362197.db2.gz	AGVOMPYQICUVAH-UHFFFAOYSA-N	0	0	257.377	4.013	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NC1CCC(c2ccccc2)CC1	ZINC000464554616	331362380	/nfs/dbraw/zinc/36/23/80/331362380.db2.gz	NEJXAYSRZHMQCY-ZLPCBKJTSA-N	0	0	285.431	4.431	20	30		CIEDRN
CC#CCCCC(=O)N(Cc1ccccc1)c1ccccc1	ZINC000464555673	331362440	/nfs/dbraw/zinc/36/24/40/331362440.db2.gz	OKWUCALNNGDODM-UHFFFAOYSA-N	0	0	291.394	4.413	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CCC(C)C)C1CCCC1	ZINC000464552503	331362450	/nfs/dbraw/zinc/36/24/50/331362450.db2.gz	HDYUZXHCVXPHDX-HNNXBMFYSA-N	0	0	265.441	4.406	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC)c1cccc(C)c1C	ZINC000464564510	331362666	/nfs/dbraw/zinc/36/26/66/331362666.db2.gz	DLSPKOLFBYGZOO-CQSZACIVSA-N	0	0	259.393	4.259	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](C)c2ccccc21	ZINC000464569384	331362846	/nfs/dbraw/zinc/36/28/46/331362846.db2.gz	ITSFGLBMZVSMIS-KGLIPLIRSA-N	0	0	257.377	4.129	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(Cc1ccc(C#N)cc1)CC(C)C	ZINC000464573073	331362900	/nfs/dbraw/zinc/36/29/00/331362900.db2.gz	XERCMRDKKMTTQY-MRXNPFEDSA-N	0	0	298.430	4.145	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC)C12CC3CC(CC(C3)C1)C2	ZINC000464572560	331362932	/nfs/dbraw/zinc/36/29/32/331362932.db2.gz	VVXCLPURCLRHDV-DGTBMVLOSA-N	0	0	289.463	4.406	20	30		CIEDRN
CCCC[C@H](CC)C(=O)Nc1scc(C)c1C#N	ZINC000464580155	331363087	/nfs/dbraw/zinc/36/30/87/331363087.db2.gz	GAGUMRMEDRWFFU-NSHDSACASA-N	0	0	264.394	4.083	20	30		CIEDRN
C=C[C@@](C)(CCOC)C(=O)Nc1cccc(C2CCC2)c1	ZINC000464586006	331363366	/nfs/dbraw/zinc/36/33/66/331363366.db2.gz	GBJSRXYFIXOUOV-SFHVURJKSA-N	0	0	287.403	4.121	20	30		CIEDRN
CC#CCCCC(=O)N(CC)Cc1ccc2ccccc2c1	ZINC000464642353	331364054	/nfs/dbraw/zinc/36/40/54/331364054.db2.gz	HCXYTQIAPNOIPD-UHFFFAOYSA-N	0	0	293.410	4.382	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H]1CC(C)(C)C	ZINC000464650300	331364182	/nfs/dbraw/zinc/36/41/82/331364182.db2.gz	YFYJQYHFJMCWSL-ZIAGYGMSSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(O[C@H](C)CC)cc1	ZINC000464647879	331364190	/nfs/dbraw/zinc/36/41/90/331364190.db2.gz	CDULQDAAKYFTQG-UONOGXRCSA-N	0	0	275.392	4.405	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCCc1ccc2ccccc2c1	ZINC000464651308	331364244	/nfs/dbraw/zinc/36/42/44/331364244.db2.gz	RFYFKSLMMOPUJB-OAHLLOKOSA-N	0	0	281.399	4.101	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cnc(C(F)(F)F)cc1C	ZINC000464659328	331364339	/nfs/dbraw/zinc/36/43/39/331364339.db2.gz	XVLKSYKORDBVOI-UHFFFAOYSA-N	0	0	298.308	4.116	20	30		CIEDRN
C=CCCCC(=O)Nc1cc(C(C)C)nn1-c1ccccc1	ZINC000464656397	331364343	/nfs/dbraw/zinc/36/43/43/331364343.db2.gz	XFYAEDIIXGKUCZ-UHFFFAOYSA-N	0	0	297.402	4.291	20	30		CIEDRN
CC#CCCCC(=O)N[C@H](C)c1ccccc1C(F)(F)F	ZINC000464654017	331364379	/nfs/dbraw/zinc/36/43/79/331364379.db2.gz	ZVXDXOMYFFFDTI-GFCCVEGCSA-N	0	0	297.320	4.076	20	30		CIEDRN
CC(C)(C)[C@H](C#N)NC(=O)CC(C)(C)C1CCCCC1	ZINC000464709196	331365083	/nfs/dbraw/zinc/36/50/83/331365083.db2.gz	HRWBTOURZAINKW-AWEZNQCLSA-N	0	0	278.440	4.037	20	30		CIEDRN
Cc1c(C(=O)N[C@H](C#N)C(C)(C)C)oc2c1c(C)ccc2C	ZINC000464712927	331365146	/nfs/dbraw/zinc/36/51/46/331365146.db2.gz	QWMVKLKAXUGEFS-CYBMUJFWSA-N	0	0	298.386	4.026	20	30		CIEDRN
C[C@@H]1C[C@H](c2ccccc2F)N(Cc2ccccc2C#N)C1	ZINC000464729161	331365523	/nfs/dbraw/zinc/36/55/23/331365523.db2.gz	ZSLRVLBBPTXCLS-AUUYWEPGSA-N	0	0	294.373	4.280	20	30		CIEDRN
C=C[C@H](C)NC(=O)N(CCC)[C@@H](CC)c1ccccc1	ZINC000464760134	331366502	/nfs/dbraw/zinc/36/65/02/331366502.db2.gz	CJZQPZCLAQUMKJ-HOCLYGCPSA-N	0	0	274.408	4.134	20	30		CIEDRN
Cc1ccc([C@H]2C[C@@H](C)CCN2Cc2ccccc2C#N)o1	ZINC000464829432	331369920	/nfs/dbraw/zinc/36/99/20/331369920.db2.gz	JLHHEIHVDRIKLK-KBXCAEBGSA-N	0	0	294.398	4.433	20	30		CIEDRN
C[C@@H]1CCN(Cc2ccc(F)cc2C#N)[C@H](c2ccco2)C1	ZINC000464854816	331371256	/nfs/dbraw/zinc/37/12/56/331371256.db2.gz	RBRIMZBZFLMERM-DYVFJYSZSA-N	0	0	298.361	4.264	20	30		CIEDRN
C=CCN(Cc1ccc(OC)cc1)C(=O)CC(C)(C)CC	ZINC000465075212	331377568	/nfs/dbraw/zinc/37/75/68/331377568.db2.gz	HYCGZAHPOHZSBT-UHFFFAOYSA-N	0	0	289.419	4.036	20	30		CIEDRN
C=C[C@@H](C)NC(=O)C[C@H](Cc1ccccc1)c1ccccc1	ZINC000465101940	331378280	/nfs/dbraw/zinc/37/82/80/331378280.db2.gz	IJWMJELVMKNWOY-APWZRJJASA-N	0	0	293.410	4.094	20	30		CIEDRN
C=C[C@H](C)NC(=O)C1(Cc2cccc(Cl)c2)CCCC1	ZINC000465124250	331379146	/nfs/dbraw/zinc/37/91/46/331379146.db2.gz	WFDAXCKOTLCBGN-ZDUSSCGKSA-N	0	0	291.822	4.134	20	30		CIEDRN
C=C[C@H](C)NC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000465164697	331379866	/nfs/dbraw/zinc/37/98/66/331379866.db2.gz	DGBNSGSJKCQCQX-ZETCQYMHSA-N	0	0	292.688	4.055	20	30		CIEDRN
C=C[C@H](C)NC(=O)Nc1ccccc1-c1ccccc1	ZINC000465167322	331379920	/nfs/dbraw/zinc/37/99/20/331379920.db2.gz	OFYGHAJOIHSGMT-ZDUSSCGKSA-N	0	0	266.344	4.050	20	30		CIEDRN
C=C[C@@H](C)NC(=O)Nc1c(CC)ccc(Cl)c1CC	ZINC000465178687	331380207	/nfs/dbraw/zinc/38/02/07/331380207.db2.gz	UJBIGZXAIVFHLI-SNVBAGLBSA-N	0	0	280.799	4.161	20	30		CIEDRN
C=C[C@@H](C)NC(=O)Nc1ccc(OC2CCCCC2)cc1	ZINC000465247630	331380826	/nfs/dbraw/zinc/38/08/26/331380826.db2.gz	AFVCHWDJMLLMCI-CYBMUJFWSA-N	0	0	288.391	4.094	20	30		CIEDRN
C=C[C@@H](C)NC(=O)N[C@@H](c1cccs1)C(CC)CC	ZINC000465287311	331381313	/nfs/dbraw/zinc/38/13/13/331381313.db2.gz	CPGHCFVANYVZLX-BXUZGUMPSA-N	0	0	280.437	4.099	20	30		CIEDRN
C=CCCC(=O)N1CCc2c(Cl)cc(Cl)cc2[C@@H]1C	ZINC000465614560	331385156	/nfs/dbraw/zinc/38/51/56/331385156.db2.gz	BSSAGEYXXXBVNR-JTQLQIEISA-N	0	0	298.213	4.405	20	30		CIEDRN
CC#CCCCC(=O)N1CCC[C@@H](C)c2ccccc21	ZINC000466233580	331391367	/nfs/dbraw/zinc/39/13/67/331391367.db2.gz	HMGYPDVQUAYCPA-OAHLLOKOSA-N	0	0	269.388	4.111	20	30		CIEDRN
CC#CCCCC(=O)NCC1(Cc2ccccc2)CCCC1	ZINC000466243313	331391469	/nfs/dbraw/zinc/39/14/69/331391469.db2.gz	GNTMFOIFFIAIPY-UHFFFAOYSA-N	0	0	297.442	4.099	20	30		CIEDRN
CC#CCCCC(=O)Nc1cc(-c2ccccc2)cnc1C	ZINC000466243863	331391527	/nfs/dbraw/zinc/39/15/27/331391527.db2.gz	HAVWHCFCHWTJFW-UHFFFAOYSA-N	0	0	292.382	4.189	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](CC)CSc1ccccc1	ZINC000466249928	331391664	/nfs/dbraw/zinc/39/16/64/331391664.db2.gz	NDKWYTVUTXFROA-LSDHHAIUSA-N	0	0	291.460	4.276	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(Cc1ccccc1)[C@@H](C)CC	ZINC000466321189	331392685	/nfs/dbraw/zinc/39/26/85/331392685.db2.gz	UGTNLJBJZINCEH-RDJZCZTQSA-N	0	0	288.435	4.351	20	30		CIEDRN
Cc1ccc(Cl)cc1Oc1cc(C#N)ccc1[N+](=O)[O-]	ZINC000466357394	331393262	/nfs/dbraw/zinc/39/32/62/331393262.db2.gz	NLFQAIBNUPELGM-UHFFFAOYSA-N	0	0	288.690	4.221	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N1CCC[C@H]1c1ccccc1C	ZINC000466365803	331393519	/nfs/dbraw/zinc/39/35/19/331393519.db2.gz	ABLCHBOGWXAVNB-WBVHZDCISA-N	0	0	286.419	4.196	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1ccc(CCCC)cc1	ZINC000466369173	331393690	/nfs/dbraw/zinc/39/36/90/331393690.db2.gz	UQFMOIPYUYMLSG-UHFFFAOYSA-N	0	0	260.381	4.069	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1ccccc1-c1cccs1	ZINC000466367714	331393773	/nfs/dbraw/zinc/39/37/73/331393773.db2.gz	YPPMCJKBQABSJO-UHFFFAOYSA-N	0	0	286.400	4.455	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N1CC2(CCCC2)c2ccccc21	ZINC000466377003	331393801	/nfs/dbraw/zinc/39/38/01/331393801.db2.gz	ALSXEFJVBGUTEN-OAHLLOKOSA-N	0	0	298.430	4.383	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(C1CC1)C1CCC(C)CC1	ZINC000466376057	331393840	/nfs/dbraw/zinc/39/38/40/331393840.db2.gz	CIRMCHFQSXFMEH-SLTAFYQDSA-N	0	0	278.440	4.094	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CCC[C@H]1/C=C\c1ccccc1	ZINC000466377529	331393950	/nfs/dbraw/zinc/39/39/50/331393950.db2.gz	ULROPJFLBCUBHQ-QUQQQVAWSA-N	0	0	298.430	4.229	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1ccc(OCC)c(Cl)c1	ZINC000466386550	331394334	/nfs/dbraw/zinc/39/43/34/331394334.db2.gz	QCDKCRLBSPGLBI-NSHDSACASA-N	0	0	296.798	4.215	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1ccc(COC(C)C)cc1	ZINC000466387975	331394503	/nfs/dbraw/zinc/39/45/03/331394503.db2.gz	HXTSTHNBZBUDFR-HNNXBMFYSA-N	0	0	290.407	4.088	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(CC)Cc1cccc(Cl)c1	ZINC000466400470	331394964	/nfs/dbraw/zinc/39/49/64/331394964.db2.gz	UKZNGYFSERORHT-OAHLLOKOSA-N	0	0	294.826	4.226	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1ccc(C)cc1Cl	ZINC000466404234	331395295	/nfs/dbraw/zinc/39/52/95/331395295.db2.gz	BGYXLLWCQNAMEX-LLVKDONJSA-N	0	0	266.772	4.125	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)[C@@H]1C[C@@]1(C)CC	ZINC000466414481	331395789	/nfs/dbraw/zinc/39/57/89/331395789.db2.gz	JYOXKBBNIDKMGH-SWLSCSKDSA-N	0	0	297.851	4.352	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H](c1ccccc1C)C(C)C	ZINC000466415259	331395951	/nfs/dbraw/zinc/39/59/51/331395951.db2.gz	FHPHJPKKOQIZEX-GOSISDBHSA-N	0	0	271.404	4.002	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000466425756	331396650	/nfs/dbraw/zinc/39/66/50/331396650.db2.gz	MZUDUONHOQHTSY-USXIJHARSA-N	0	0	271.404	4.041	20	30		CIEDRN
CC#CCCCC(=O)N1CCC[C@@H]1CCC1CCCC1	ZINC000466426898	331396779	/nfs/dbraw/zinc/39/67/79/331396779.db2.gz	TZGSMXHQXWRVDC-QGZVFWFLSA-N	0	0	275.436	4.141	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](CC)C(C)(C)c1ccccc1	ZINC000466431783	331396885	/nfs/dbraw/zinc/39/68/85/331396885.db2.gz	RUPCUHWSIKSIJY-WBVHZDCISA-N	0	0	287.447	4.461	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(-c2ccccc2)ns1	ZINC000466429840	331396893	/nfs/dbraw/zinc/39/68/93/331396893.db2.gz	DRNJXNXLCROKAG-LBPRGKRZSA-N	0	0	286.400	4.351	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H](C)c1cccc(Cl)c1Cl	ZINC000466430188	331396926	/nfs/dbraw/zinc/39/69/26/331396926.db2.gz	GVXKZBRVIWOZND-NSHDSACASA-N	0	0	298.213	4.364	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](CC)C(C)(C)c1ccccc1	ZINC000466431780	331396945	/nfs/dbraw/zinc/39/69/45/331396945.db2.gz	RUPCUHWSIKSIJY-DOTOQJQBSA-N	0	0	287.447	4.461	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@H](C)Cc1ccc(Cl)cc1	ZINC000466433977	331397082	/nfs/dbraw/zinc/39/70/82/331397082.db2.gz	MPWJNMKUVJUZKM-UONOGXRCSA-N	0	0	293.838	4.332	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@@H](CC)Cc1ccc(C)cc1	ZINC000466438642	331397133	/nfs/dbraw/zinc/39/71/33/331397133.db2.gz	NIXQEPNOUFXGFY-AEFFLSMTSA-N	0	0	287.447	4.377	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](Cc1ccc(F)cc1)C(C)C	ZINC000466439655	331397238	/nfs/dbraw/zinc/39/72/38/331397238.db2.gz	UTWVGLDGFVMFRU-RHSMWYFYSA-N	0	0	291.410	4.111	20	30		CIEDRN
C=CCC[C@H](NC(=O)[C@@H](C)CC(=C)C)c1ccccc1	ZINC000466441090	331397254	/nfs/dbraw/zinc/39/72/54/331397254.db2.gz	LPVFKRHBTUVMBN-RDJZCZTQSA-N	0	0	271.404	4.412	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(F)cc(Cl)c1	ZINC000466519474	331398863	/nfs/dbraw/zinc/39/88/63/331398863.db2.gz	QNMISEWMUYKFAK-VIFPVBQESA-N	0	0	255.720	4.020	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NC[C@H]1CCCC[C@H]1C(F)(F)F	ZINC000466527850	331399135	/nfs/dbraw/zinc/39/91/35/331399135.db2.gz	FUJFWIZGIVCIID-YNEHKIRRSA-N	0	0	291.357	4.074	20	30		CIEDRN
C=CCC[C@H](C(=O)N[C@@H](CC)CC=C)c1ccccc1	ZINC000466529292	331399185	/nfs/dbraw/zinc/39/91/85/331399185.db2.gz	JXUZYMHSKUPTCD-IRXDYDNUSA-N	0	0	271.404	4.207	20	30		CIEDRN
C=CCC[C@@H](C(=O)N[C@H](CC)CC=C)c1ccccc1	ZINC000466529291	331399228	/nfs/dbraw/zinc/39/92/28/331399228.db2.gz	JXUZYMHSKUPTCD-IAGOWNOFSA-N	0	0	271.404	4.207	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)C1(Cc2ccc(Cl)cc2)CC1	ZINC000466536462	331399398	/nfs/dbraw/zinc/39/93/98/331399398.db2.gz	ORMLCXADOWXMEE-OAHLLOKOSA-N	0	0	291.822	4.134	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)[C@@H](CC)CC1CCCC1	ZINC000466540249	331399482	/nfs/dbraw/zinc/39/94/82/331399482.db2.gz	JWEBTWKJDAALAT-LSDHHAIUSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)[C@@H](CC(C)C)c1ccccc1	ZINC000466540599	331399487	/nfs/dbraw/zinc/39/94/87/331399487.db2.gz	KWKCVMZRDVZPTM-SJORKVTESA-N	0	0	273.420	4.287	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)C(C)(C)c1cccc(Cl)c1F	ZINC000466546194	331399704	/nfs/dbraw/zinc/39/97/04/331399704.db2.gz	WBXYPIXCYDRBKX-NSHDSACASA-N	0	0	297.801	4.228	20	30		CIEDRN
C=CCCN(C)C(=O)[C@H](CCC)CC1CCCC1	ZINC000466632790	331401047	/nfs/dbraw/zinc/40/10/47/331401047.db2.gz	BZIAQNTUOKLOCK-OAHLLOKOSA-N	0	0	251.414	4.018	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cc(CC)ccc1CC	ZINC000466643753	331401529	/nfs/dbraw/zinc/40/15/29/331401529.db2.gz	ROPNXQOSUGZXBA-CYBMUJFWSA-N	0	0	259.393	4.352	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](C)c1ccc(SC)cc1	ZINC000466647145	331401640	/nfs/dbraw/zinc/40/16/40/331401640.db2.gz	HHYNXJCERJYHLD-CHWSQXEVSA-N	0	0	277.433	4.188	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCCCCC1CCCC1	ZINC000466652008	331401697	/nfs/dbraw/zinc/40/16/97/331401697.db2.gz	RQFBAKNCGPBESJ-AWEZNQCLSA-N	0	0	251.414	4.065	20	30		CIEDRN
C[C@H](SCCCSCC#N)c1ccc(F)cc1	ZINC000466653804	331401810	/nfs/dbraw/zinc/40/18/10/331401810.db2.gz	JVHGUWGUOXFNMP-NSHDSACASA-N	0	0	269.410	4.267	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc2nn(C(C)C)cc2c1	ZINC000466860312	331406518	/nfs/dbraw/zinc/40/65/18/331406518.db2.gz	YPPYRMWDRMEJIU-ZDUSSCGKSA-N	0	0	285.391	4.158	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCCc2c(F)ccc(C)c21	ZINC000466861576	331406634	/nfs/dbraw/zinc/40/66/34/331406634.db2.gz	DXWFXZKWMXEJSH-ZDUSSCGKSA-N	0	0	275.367	4.016	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@]1(CCC)C(F)(F)F	ZINC000466874168	331406960	/nfs/dbraw/zinc/40/69/60/331406960.db2.gz	NQGZGKIHXWIFGO-GXTWGEPZSA-N	0	0	291.357	4.312	20	30		CIEDRN
CC#CCCCc1nc(-c2c(Cl)cccc2Cl)no1	ZINC000466982222	331409555	/nfs/dbraw/zinc/40/95/55/331409555.db2.gz	DGYFQONUPGQIMD-UHFFFAOYSA-N	0	0	295.169	4.389	20	30		CIEDRN
C=CCCN(C)C(=O)N[C@H](C)c1ccc(SCC)cc1	ZINC000467009752	331410318	/nfs/dbraw/zinc/41/03/18/331410318.db2.gz	UWIKLERSWMRZFQ-CYBMUJFWSA-N	0	0	292.448	4.077	20	30		CIEDRN
CC[C@H]1CCCC[C@H]1N(C)C(=O)Nc1cc(C#N)ccc1C	ZINC000467109378	331411183	/nfs/dbraw/zinc/41/11/83/331411183.db2.gz	GEIPIGWOWMCRMH-DOTOQJQBSA-N	0	0	299.418	4.299	20	30		CIEDRN
CC[C@H]1CCCC[C@@H]1N(C)C(=O)Nc1cc(C#N)ccc1C	ZINC000467109380	331411226	/nfs/dbraw/zinc/41/12/26/331411226.db2.gz	GEIPIGWOWMCRMH-RDJZCZTQSA-N	0	0	299.418	4.299	20	30		CIEDRN
CC1(C)CN(CCCSCC#N)c2cccc(Cl)c21	ZINC000467196109	331412109	/nfs/dbraw/zinc/41/21/09/331412109.db2.gz	NSOGWUNVPFJTJP-UHFFFAOYSA-N	0	0	294.851	4.084	20	30		CIEDRN
CC/C=C\CCSCCOc1ccc(C#N)cc1OC	ZINC000467296724	331414084	/nfs/dbraw/zinc/41/40/84/331414084.db2.gz	JDJFBYPQMIOYFP-PLNGDYQASA-N	0	0	291.416	4.035	20	30		CIEDRN
N#Cc1ccc(CSCc2ccc(F)cc2F)cc1	ZINC000467310779	331414757	/nfs/dbraw/zinc/41/47/57/331414757.db2.gz	JPMBSZJNWYQFIS-UHFFFAOYSA-N	0	0	275.323	4.270	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H](C)c1cccc(C)c1C	ZINC000467318049	331414860	/nfs/dbraw/zinc/41/48/60/331414860.db2.gz	LFWXHGPSSWOFFA-OAHLLOKOSA-N	0	0	271.404	4.249	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H](C)c1cccc(C)c1C	ZINC000467318048	331414895	/nfs/dbraw/zinc/41/48/95/331414895.db2.gz	LFWXHGPSSWOFFA-HNNXBMFYSA-N	0	0	271.404	4.249	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)[C@@H](CC)Cc1ccccc1	ZINC000467516327	331420922	/nfs/dbraw/zinc/42/09/22/331420922.db2.gz	ITZYSCCHTULBCX-SFHVURJKSA-N	0	0	285.431	4.235	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@](C)(CCC)C1	ZINC000467530894	331421234	/nfs/dbraw/zinc/42/12/34/331421234.db2.gz	JBURZAVLGGYWOW-KRWDZBQOSA-N	0	0	263.425	4.184	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CCCC)[C@@H](C)CC	ZINC000467533526	331421244	/nfs/dbraw/zinc/42/12/44/331421244.db2.gz	VVLAQVVLWOCOKD-AWEZNQCLSA-N	0	0	251.414	4.182	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@@H](C)c1ccc(OC(C)C)cc1	ZINC000467643890	331422898	/nfs/dbraw/zinc/42/28/98/331422898.db2.gz	OYDFCGSBBNOVOR-KSSFIOAISA-N	0	0	289.419	4.253	20	30		CIEDRN
C=CCCCC(=O)Nc1cc(Cl)ccc1NC1CC1	ZINC000467686422	331423150	/nfs/dbraw/zinc/42/31/50/331423150.db2.gz	MMBFQEPPMTUUME-UHFFFAOYSA-N	0	0	278.783	4.209	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(Cl)c(F)c1	ZINC000467730231	331423258	/nfs/dbraw/zinc/42/32/58/331423258.db2.gz	CFNVNYJIUJSJOG-CYBMUJFWSA-N	0	0	255.720	4.020	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H]1CC[C@@H]2CCCC[C@H]2C1	ZINC000467733479	331423415	/nfs/dbraw/zinc/42/34/15/331423415.db2.gz	WXTLSYBEDQJNFO-BHYGNILZSA-N	0	0	275.436	4.230	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C1CC1)C1CCC(C)CC1	ZINC000467817143	331424371	/nfs/dbraw/zinc/42/43/71/331424371.db2.gz	ZDHKOJPKLQNYFU-UHFFFAOYSA-N	0	0	275.436	4.325	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CC2(CCC2)c2c1cccc2F	ZINC000467839106	331424490	/nfs/dbraw/zinc/42/44/90/331424490.db2.gz	MUXXVHLZPQPSTO-QGZVFWFLSA-N	0	0	287.378	4.196	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)NCCc1c(C)oc2ccccc21	ZINC000467918897	331425636	/nfs/dbraw/zinc/42/56/36/331425636.db2.gz	HPRPEINREVABBJ-SFHVURJKSA-N	0	0	285.387	4.002	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@@H](C)c1c(C)cccc1C	ZINC000467915026	331425665	/nfs/dbraw/zinc/42/56/65/331425665.db2.gz	ZFJWBXARHSMVRP-YOEHRIQHSA-N	0	0	259.393	4.083	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](C)c2ccccc21	ZINC000467935888	331425823	/nfs/dbraw/zinc/42/58/23/331425823.db2.gz	UNFBTZKQKCJJQU-CXAGYDPISA-N	0	0	257.377	4.129	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@@H](CC)c1ccccc1OCC	ZINC000467945516	331425960	/nfs/dbraw/zinc/42/59/60/331425960.db2.gz	KBNCFJYDXBJWLO-YJBOKZPZSA-N	0	0	289.419	4.255	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H](C#N)c1ccc(C(C)(C)C)cc1	ZINC000467972527	331426150	/nfs/dbraw/zinc/42/61/50/331426150.db2.gz	BFGOMMXIEDUOKV-VQIMIIECSA-N	0	0	298.430	4.267	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)NCc1ccc(C)cc1OCCC	ZINC000467968315	331426163	/nfs/dbraw/zinc/42/61/63/331426163.db2.gz	HXWPEZQXXFDQDL-GOSISDBHSA-N	0	0	289.419	4.002	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N(Cc1ccc(F)cc1)CC1CC1	ZINC000467998505	331426470	/nfs/dbraw/zinc/42/64/70/331426470.db2.gz	OXDXXCQDRADOLL-GOSISDBHSA-N	0	0	289.394	4.167	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cccc(SC)c1C	ZINC000467995301	331426473	/nfs/dbraw/zinc/42/64/73/331426473.db2.gz	SKHFOKRZMKSFIK-HNNXBMFYSA-N	0	0	263.406	4.258	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N(Cc1ccc(Cl)cc1)C1CC1	ZINC000468102009	331428647	/nfs/dbraw/zinc/42/86/47/331428647.db2.gz	BVKHBVRPNHWAAP-QGZVFWFLSA-N	0	0	291.822	4.433	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(C)cc1OCCC	ZINC000468112203	331428728	/nfs/dbraw/zinc/42/87/28/331428728.db2.gz	YNGZJVMXKHVJGL-KRWDZBQOSA-N	0	0	275.392	4.325	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N(Cc1ccccc1)CC(C)C	ZINC000468113498	331428851	/nfs/dbraw/zinc/42/88/51/331428851.db2.gz	NVXAKPHUEUEQSA-SFHVURJKSA-N	0	0	273.420	4.274	20	30		CIEDRN
C=CCCN(C)C(=O)C1(c2ccc(F)cc2)CCCCC1	ZINC000468184618	331429894	/nfs/dbraw/zinc/42/98/94/331429894.db2.gz	WYAUOIGOFUETSQ-UHFFFAOYSA-N	0	0	289.394	4.062	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Cc1cccc(C(F)F)c1	ZINC000468338137	331432641	/nfs/dbraw/zinc/43/26/41/331432641.db2.gz	VXIBNLULIJEGIL-UHFFFAOYSA-N	0	0	295.373	4.372	20	30		CIEDRN
C=CCCCNC(=O)c1cccc(Nc2ccccc2)c1	ZINC000468368028	331433011	/nfs/dbraw/zinc/43/30/11/331433011.db2.gz	LZOGSJVEELJCOF-UHFFFAOYSA-N	0	0	280.371	4.126	20	30		CIEDRN
C=CCCCNC(=O)CC(c1ccccc1)c1ccccc1	ZINC000468373978	331433033	/nfs/dbraw/zinc/43/30/33/331433033.db2.gz	USIUDAMNUJNWJC-UHFFFAOYSA-N	0	0	293.410	4.291	20	30		CIEDRN
C=CCCCNC(=O)C[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000468389672	331433485	/nfs/dbraw/zinc/43/34/85/331433485.db2.gz	KLPDSSBDVYTLBR-GFCCVEGCSA-N	0	0	299.336	4.281	20	30		CIEDRN
C=CCCCNC(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1	ZINC000468395028	331433919	/nfs/dbraw/zinc/43/39/19/331433919.db2.gz	KHYRYXPQLNJDFO-MSOLQXFVSA-N	0	0	279.383	4.026	20	30		CIEDRN
COc1ccc(C#N)cc1NC1CCC(C(F)(F)F)CC1	ZINC000468514986	331436281	/nfs/dbraw/zinc/43/62/81/331436281.db2.gz	KDPRASCHNLOSIX-UHFFFAOYSA-N	0	0	298.308	4.100	20	30		CIEDRN
C[C@H](Sc1cccc(C#N)c1)c1ccccc1[N+](=O)[O-]	ZINC000468635545	331437924	/nfs/dbraw/zinc/43/79/24/331437924.db2.gz	QMYOVEZGJXCCBL-NSHDSACASA-N	0	0	284.340	4.320	20	30		CIEDRN
Cc1ccc(C#N)cc1OCc1ccc(OC(F)F)cc1	ZINC000468767557	331439632	/nfs/dbraw/zinc/43/96/32/331439632.db2.gz	AQRDHGGORZDTEH-UHFFFAOYSA-N	0	0	289.281	4.047	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CC[C@](C)(c2ccc(C)cc2)C1	ZINC000468945014	331442822	/nfs/dbraw/zinc/44/28/22/331442822.db2.gz	JQWXRWTWZKILTR-FQEVSTJZSA-N	0	0	297.442	4.253	20	30		CIEDRN
C=CCCC(=O)Nc1ccccc1CN(C)c1ccccc1	ZINC000469153585	331446639	/nfs/dbraw/zinc/44/66/39/331446639.db2.gz	XGMHGQZNGDMBNJ-UHFFFAOYSA-N	0	0	294.398	4.228	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc2cn(C(C)C)nc2c1	ZINC000469207330	331447596	/nfs/dbraw/zinc/44/75/96/331447596.db2.gz	FTFZQUVVLMFBCL-ZDUSSCGKSA-N	0	0	285.391	4.158	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@](C)(c2ccc(C)cc2)C1	ZINC000469284061	331448981	/nfs/dbraw/zinc/44/89/81/331448981.db2.gz	TVCDLKCQBHJYRS-LPHOPBHVSA-N	0	0	285.431	4.087	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@](C)(c3ccc(C)cc3)C2)CCC1	ZINC000469333654	331449775	/nfs/dbraw/zinc/44/97/75/331449775.db2.gz	CMPRCJCFFIXLQZ-IBGZPJMESA-N	0	0	297.442	4.231	20	30		CIEDRN
C=CCCCC(=O)N(CC)[C@@H](CC)Cc1ccccc1	ZINC000469455737	331452060	/nfs/dbraw/zinc/45/20/60/331452060.db2.gz	YIMNCQADDDZHRQ-KRWDZBQOSA-N	0	0	273.420	4.213	20	30		CIEDRN
C=CCCCCNC(=O)[C@@H](C)Oc1cccc2ccccc21	ZINC000469785381	331458662	/nfs/dbraw/zinc/45/86/62/331458662.db2.gz	BJDFYDXPXYRMGE-OAHLLOKOSA-N	0	0	297.398	4.080	20	30		CIEDRN
C=C[C@@H](CC(=O)N[C@H](C)CCC1CC1)c1ccccc1	ZINC000469801073	331460747	/nfs/dbraw/zinc/46/07/47/331460747.db2.gz	PFSBLMJESBABRO-ZBFHGGJFSA-N	0	0	271.404	4.041	20	30		CIEDRN
CCc1c(C)sc(NC(=O)C[C@H]2CCC[C@H]2C)c1C#N	ZINC000469964368	331467062	/nfs/dbraw/zinc/46/70/62/331467062.db2.gz	LGJSBJZPPSGZFX-ZYHUDNBSSA-N	0	0	290.432	4.255	20	30		CIEDRN
N#Cc1cnccc1/C=C/c1cccc2ccccc12	ZINC000470281368	331477644	/nfs/dbraw/zinc/47/76/44/331477644.db2.gz	XHZJAGIBBIVBAH-CMDGGOBGSA-N	0	0	256.308	4.277	20	30		CIEDRN
C=CC[C@H]1N(C(=O)[C@@H](C)c2cccs2)CCCC1(C)C	ZINC000470278032	331477656	/nfs/dbraw/zinc/47/76/56/331477656.db2.gz	CWOUFAARVZEOLM-DZGCQCFKSA-N	0	0	291.460	4.445	20	30		CIEDRN
C=CC[C@H]1N(C(=O)C[C@H](C)CC)CCCC1(C)C	ZINC000470287073	331478083	/nfs/dbraw/zinc/47/80/83/331478083.db2.gz	XZTPTDZESQZZBG-ZIAGYGMSSA-N	0	0	251.414	4.016	20	30		CIEDRN
N#Cc1cnccc1/C=C/c1c(Cl)cccc1Cl	ZINC000470288853	331478149	/nfs/dbraw/zinc/47/81/49/331478149.db2.gz	KVAASQICUBMFMB-SNAWJCMRSA-N	0	0	275.138	4.430	20	30		CIEDRN
C=CC[C@H]1N(C(=O)CC[C@@H](C)SC)CCCC1(C)C	ZINC000470290717	331478219	/nfs/dbraw/zinc/47/82/19/331478219.db2.gz	WSKGHRGPSTYYKR-ZIAGYGMSSA-N	0	0	283.481	4.111	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)CC[C@@H](C)SC)CCCC1(C)C	ZINC000470290715	331478227	/nfs/dbraw/zinc/47/82/27/331478227.db2.gz	WSKGHRGPSTYYKR-KGLIPLIRSA-N	0	0	283.481	4.111	20	30		CIEDRN
C=CC[C@H]1N(C(=O)c2ccc(C)cc2)CCCC1(C)C	ZINC000470291872	331478260	/nfs/dbraw/zinc/47/82/60/331478260.db2.gz	HXYGGXYNMPALLB-MRXNPFEDSA-N	0	0	271.404	4.202	20	30		CIEDRN
C=CC[C@H]1N(C(=O)C2CCCCC2)CCCC1(C)C	ZINC000470292817	331478395	/nfs/dbraw/zinc/47/83/95/331478395.db2.gz	LLZGDMRKQHJJAW-OAHLLOKOSA-N	0	0	263.425	4.160	20	30		CIEDRN
C=CC[C@H]1N(C(=O)[C@H](C)CC(C)C)CCCC1(C)C	ZINC000470291548	331478401	/nfs/dbraw/zinc/47/84/01/331478401.db2.gz	ZRISLSKLEHJVQX-HUUCEWRRSA-N	0	0	265.441	4.262	20	30		CIEDRN
C=CCn1cccc1C(=O)N1C[C@@H](C(C)C)c2ccccc21	ZINC000470400788	331481298	/nfs/dbraw/zinc/48/12/98/331481298.db2.gz	KSMZDWLQNSFBQP-INIZCTEOSA-N	0	0	294.398	4.074	20	30		CIEDRN
C=CCn1cccc1C(=O)N1C[C@H](C(C)C)c2ccccc21	ZINC000470400789	331481299	/nfs/dbraw/zinc/48/12/99/331481299.db2.gz	KSMZDWLQNSFBQP-MRXNPFEDSA-N	0	0	294.398	4.074	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccc(C2CCC2)cc1	ZINC000470502622	331484122	/nfs/dbraw/zinc/48/41/22/331484122.db2.gz	AHBYJZVYTPQDLP-UHFFFAOYSA-N	0	0	255.361	4.086	20	30		CIEDRN
C=CCCCNc1cc(-c2nc(C)co2)ccc1C	ZINC000470526933	331484770	/nfs/dbraw/zinc/48/47/70/331484770.db2.gz	FFIYKMDTAFQLLH-UHFFFAOYSA-N	0	0	256.349	4.337	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)c1cccc(C)c1	ZINC000470642202	331486785	/nfs/dbraw/zinc/48/67/85/331486785.db2.gz	QQWWKVNRHBBCOP-UHFFFAOYSA-N	0	0	279.383	4.214	20	30		CIEDRN
CCC(CC)[C@@H](c1ccc(Cl)cc1)N(C)CC#N	ZINC000470949050	331496599	/nfs/dbraw/zinc/49/65/99/331496599.db2.gz	UYXLBPZTABLOSK-HNNXBMFYSA-N	0	0	264.800	4.273	20	30		CIEDRN
CC(C)[C@H](C#N)NC(=O)C1(C2CCCCC2)CCCCC1	ZINC000471124797	331501856	/nfs/dbraw/zinc/50/18/56/331501856.db2.gz	LZZBEPGYDYGRKS-INIZCTEOSA-N	0	0	290.451	4.182	20	30		CIEDRN
C=CCN(CC=C)C(=O)[C@@H](C)c1ccc(Cl)c(Cl)c1	ZINC000471298877	331505926	/nfs/dbraw/zinc/50/59/26/331505926.db2.gz	VTXCBZHYWMCWNU-NSHDSACASA-N	0	0	298.213	4.298	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](c2ccc(C)cc2C)C1	ZINC000471319775	331506457	/nfs/dbraw/zinc/50/64/57/331506457.db2.gz	IUFKFWDGOPIMKJ-VQIMIIECSA-N	0	0	285.431	4.222	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](c2ccc(C)cc2C)C1	ZINC000471337424	331506768	/nfs/dbraw/zinc/50/67/68/331506768.db2.gz	QOYNFGHFUFLOPR-SJORKVTESA-N	0	0	285.431	4.222	20	30		CIEDRN
C=CCCCSCc1noc(-c2ccccc2C)n1	ZINC000471411225	331507974	/nfs/dbraw/zinc/50/79/74/331507974.db2.gz	JIPQOVINRCJYFE-UHFFFAOYSA-N	0	0	274.389	4.244	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cc(C(=O)CC)ccc1Cl	ZINC000471401932	331508006	/nfs/dbraw/zinc/50/80/06/331508006.db2.gz	UZXDGTMPDWEBPA-INIZCTEOSA-N	0	0	293.794	4.474	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cc(C(=O)CC)ccc1Cl	ZINC000471401933	331508021	/nfs/dbraw/zinc/50/80/21/331508021.db2.gz	UZXDGTMPDWEBPA-MRXNPFEDSA-N	0	0	293.794	4.474	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H]1CC[C@H](c2ccc(F)cc2)C1	ZINC000471503189	331509607	/nfs/dbraw/zinc/50/96/07/331509607.db2.gz	FPMHRWDVCZQACC-YXJHDRRASA-N	0	0	289.394	4.180	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H]1CC[C@@H](c2ccc(F)cc2)C1	ZINC000471503188	331509610	/nfs/dbraw/zinc/50/96/10/331509610.db2.gz	FPMHRWDVCZQACC-UWWQBHOKSA-N	0	0	289.394	4.180	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)C2(CCC)CC2)c1	ZINC000471696787	331516100	/nfs/dbraw/zinc/51/61/00/331516100.db2.gz	IDPGWNAMPYMFEL-UHFFFAOYSA-N	0	0	273.376	4.160	20	30		CIEDRN
Cc1ccc2c(c1)N(CCCC(C)(C)C#N)CCC2	ZINC000472240893	331533113	/nfs/dbraw/zinc/53/31/13/331533113.db2.gz	OVQHAOZDXKPDIZ-UHFFFAOYSA-N	0	0	256.393	4.078	20	30		CIEDRN
N#Cc1ccc(SC[C@@H](O)CC2CCCC2)c(Cl)c1	ZINC000473756350	331556717	/nfs/dbraw/zinc/55/67/17/331556717.db2.gz	AHQVWNYAOCYYTR-ZDUSSCGKSA-N	0	0	295.835	4.245	20	30		CIEDRN
C=CCCCCNC(=O)Nc1cc(C)cc2cccnc21	ZINC000473773830	331557124	/nfs/dbraw/zinc/55/71/24/331557124.db2.gz	DTIYMVRSMNZLAM-UHFFFAOYSA-N	0	0	283.375	4.021	20	30		CIEDRN
C=CCCCCNC(=O)N(Cc1ccccc1)[C@H](C)CC	ZINC000474070734	331567705	/nfs/dbraw/zinc/56/77/05/331567705.db2.gz	BPHLKJUXNWYOGW-MRXNPFEDSA-N	0	0	288.435	4.353	20	30		CIEDRN
C=CCCCCNC(=O)N(C)[C@H](c1ccccc1)C(C)C	ZINC000474091101	331569723	/nfs/dbraw/zinc/56/97/23/331569723.db2.gz	VTFFOZRJCCBFOY-KRWDZBQOSA-N	0	0	288.435	4.381	20	30		CIEDRN
C[C@@H](NC(=O)C[C@H](C)C1CCCCC1)c1ccc(C#N)cc1	ZINC000510789440	332917097	/nfs/dbraw/zinc/91/70/97/332917097.db2.gz	DOTAWZDRSXCGKS-LSDHHAIUSA-N	0	0	298.430	4.342	20	30		CIEDRN
CC[C@H]1CC[C@H](C(=O)Nc2cccc(C#N)c2C)CC1	ZINC000474242493	331576487	/nfs/dbraw/zinc/57/64/87/331576487.db2.gz	NOWAPQMRTWZPMF-HDJSIYSDSA-N	0	0	270.376	4.022	20	30		CIEDRN
C=CCCC1(C(=O)N[C@H](C)c2cc3ccccc3o2)CC1	ZINC000474287808	331579782	/nfs/dbraw/zinc/57/97/82/331579782.db2.gz	YLIYBWQKGXZRBO-CYBMUJFWSA-N	0	0	283.371	4.356	20	30		CIEDRN
CC(C)CC[C@H](C)NC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000474412366	331585424	/nfs/dbraw/zinc/58/54/24/331585424.db2.gz	HXJPLYCTYBMJID-AWEZNQCLSA-N	0	0	286.419	4.042	20	30		CIEDRN
CN(CC1CCCCC1)C(=O)C[C@H](CC#N)c1ccccc1	ZINC000474696272	331594487	/nfs/dbraw/zinc/59/44/87/331594487.db2.gz	GKWCKYOAJHFTGV-SFHVURJKSA-N	0	0	298.430	4.113	20	30		CIEDRN
C=CCCC1(C(=O)N[C@H](C)c2ccc(Cl)s2)CC1	ZINC000474785885	331598101	/nfs/dbraw/zinc/59/81/01/331598101.db2.gz	VXLGKUSRJFISTE-SNVBAGLBSA-N	0	0	283.824	4.325	20	30		CIEDRN
CC[C@@H](CC1CCCC1)C(=O)Nc1ccc(F)c(C#N)c1	ZINC000510853959	332918930	/nfs/dbraw/zinc/91/89/30/332918930.db2.gz	SJCUBANQDFNFRD-ZDUSSCGKSA-N	0	0	288.366	4.242	20	30		CIEDRN
CCc1cccc(F)c1CNc1ccc(CC#N)cc1	ZINC000474921993	331603926	/nfs/dbraw/zinc/60/39/26/331603926.db2.gz	BKMAJJUXTPTJCS-UHFFFAOYSA-N	0	0	268.335	4.066	20	30		CIEDRN
C=C[C@H](CC(=O)N1C[C@H](C)C[C@H](C)[C@H]1C)c1ccccc1	ZINC000474979421	331607882	/nfs/dbraw/zinc/60/78/82/331607882.db2.gz	XQNXQWMVROZVQM-YYIAUSFCSA-N	0	0	285.431	4.239	20	30		CIEDRN
C[C@H]1CCC[C@@H](CNC(=O)c2ccc(C(C)(C)C#N)cc2)C1	ZINC000475118511	331615435	/nfs/dbraw/zinc/61/54/35/331615435.db2.gz	AARQICQSBYLIGX-LSDHHAIUSA-N	0	0	298.430	4.044	20	30		CIEDRN
C[C@@H]1CCC[C@@H](CNC(=O)C[C@@H](CC#N)c2ccccc2)C1	ZINC000475125796	331615680	/nfs/dbraw/zinc/61/56/80/331615680.db2.gz	WMVXXUHMJQVJCF-JFIYKMOQSA-N	0	0	298.430	4.016	20	30		CIEDRN
C=CCN(C(=O)N[C@H](CC1CCC1)c1ccccc1)C1CC1	ZINC000498360949	331616119	/nfs/dbraw/zinc/61/61/19/331616119.db2.gz	UEBTXPHFEBJUMB-GOSISDBHSA-N	0	0	298.430	4.278	20	30		CIEDRN
C[C@H]1CCCC[C@H]1CNC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000475177149	331616980	/nfs/dbraw/zinc/61/69/80/331616980.db2.gz	YBTQFVDMBLWQLZ-HOCLYGCPSA-N	0	0	298.430	4.044	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)[C@@H]1C[C@H]1C(C)C	ZINC000475303901	331623341	/nfs/dbraw/zinc/62/33/41/331623341.db2.gz	OYSCWVPUIFTUCI-QWHCGFSZSA-N	0	0	297.851	4.208	20	30		CIEDRN
CC(C)[C@](C)(C#N)NC(=O)CC(C)(C)C1CCCCC1	ZINC000475464007	331632374	/nfs/dbraw/zinc/63/23/74/331632374.db2.gz	KAWCTDVBEMFAKU-KRWDZBQOSA-N	0	0	278.440	4.037	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(CCSC)cc2)CC1	ZINC000475586980	331639138	/nfs/dbraw/zinc/63/91/38/331639138.db2.gz	FNTRZJMXWDTXAK-UHFFFAOYSA-N	0	0	289.444	4.277	20	30		CIEDRN
C=C(C)[C@H](NC(=O)[C@H](C)CC(C)C)c1ccc(F)c(F)c1	ZINC000475657910	331640527	/nfs/dbraw/zinc/64/05/27/331640527.db2.gz	BXGPORNEDOHZEZ-WBMJQRKESA-N	0	0	295.373	4.380	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)CC1CCC(C)CC1	ZINC000475743962	331644586	/nfs/dbraw/zinc/64/45/86/331644586.db2.gz	NNSGYEQAOPYNKN-UHFFFAOYSA-N	0	0	278.440	4.182	20	30		CIEDRN
CCC1(CC)CCC(NC(=O)c2cccc(CC#N)c2)CC1	ZINC000475785499	331645290	/nfs/dbraw/zinc/64/52/90/331645290.db2.gz	FCHQCBCOVBHFNW-UHFFFAOYSA-N	0	0	298.430	4.231	20	30		CIEDRN
Cc1cc(NC(=O)c2ccc(CC#N)cc2)ccc1C1CC1	ZINC000475844491	331645637	/nfs/dbraw/zinc/64/56/37/331645637.db2.gz	BDARHXYSFABEFT-UHFFFAOYSA-N	0	0	290.366	4.191	20	30		CIEDRN
C=CCOCCCSC[C@H](C)c1ccccc1	ZINC000475883508	331647600	/nfs/dbraw/zinc/64/76/00/331647600.db2.gz	VOFBFGSJGOGYOK-AWEZNQCLSA-N	0	0	250.407	4.116	20	30		CIEDRN
C[C@@H]1CC[C@@H](NC(=O)c2ccc(C(C)(C)C#N)cc2)[C@@H](C)C1	ZINC000476032864	331651646	/nfs/dbraw/zinc/65/16/46/331651646.db2.gz	NHXAVJCNDQJKMB-JKIFEVAISA-N	0	0	298.430	4.042	20	30		CIEDRN
C[C@@H]1CCC[C@H](C)[C@H]1NC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000476041097	331651718	/nfs/dbraw/zinc/65/17/18/331651718.db2.gz	GIGNWNVOSSORLY-GFIVTLFCSA-N	0	0	298.430	4.015	20	30		CIEDRN
C=CCCC1(C(=O)N2C[C@@H](c3ccccc3)C[C@@H]2C)CC1	ZINC000476044545	331651899	/nfs/dbraw/zinc/65/18/99/331651899.db2.gz	OJKPMKCLAAXBFH-RDJZCZTQSA-N	0	0	283.415	4.137	20	30		CIEDRN
C=CCCC1(C(=O)NCC(C)(C)Cc2ccccc2)CC1	ZINC000476057207	331652100	/nfs/dbraw/zinc/65/21/00/331652100.db2.gz	ABVWFGKMZHFEBS-UHFFFAOYSA-N	0	0	285.431	4.118	20	30		CIEDRN
C=CCCC1(C(=O)N2C[C@@H](c3ccccc3C)C[C@@H]2C)CC1	ZINC000476088561	331654372	/nfs/dbraw/zinc/65/43/72/331654372.db2.gz	CWWRBYVBPIHARB-IRXDYDNUSA-N	0	0	297.442	4.446	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(CC(F)(F)F)cc2)CC1	ZINC000476155979	331656280	/nfs/dbraw/zinc/65/62/80/331656280.db2.gz	QIXCQBNWBOFIMA-UHFFFAOYSA-N	0	0	297.320	4.476	20	30		CIEDRN
C=C(C)CSCc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000477017094	331672776	/nfs/dbraw/zinc/67/27/76/331672776.db2.gz	FIROVCAHQBAAEA-UHFFFAOYSA-N	0	0	257.742	4.058	20	30		CIEDRN
CCOC(=O)c1cccc(SCc2ccccc2C#N)c1	ZINC000477035557	331673429	/nfs/dbraw/zinc/67/34/29/331673429.db2.gz	PZBUYOLJCIMXIE-UHFFFAOYSA-N	0	0	297.379	4.027	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N(CC)C[C@@H](CC)c1ccccc1	ZINC000477037825	331673625	/nfs/dbraw/zinc/67/36/25/331673625.db2.gz	XBXFVNBXWQELNO-JKSUJKDBSA-N	0	0	288.435	4.176	20	30		CIEDRN
C=CCCC1(C(=O)NCc2ccc(C3CCC3)cc2)CC1	ZINC000477101617	331676422	/nfs/dbraw/zinc/67/64/22/331676422.db2.gz	UQFDAMGMQUHIJD-UHFFFAOYSA-N	0	0	283.415	4.317	20	30		CIEDRN
C=CCCCSCc1ccn(C2CCCC2)n1	ZINC000477363594	331682679	/nfs/dbraw/zinc/68/26/79/331682679.db2.gz	SNCWEXCKVABWIG-UHFFFAOYSA-N	0	0	250.411	4.198	20	30		CIEDRN
CCc1sc(C(=O)N(CCC#N)CC(C)(C)C)cc1C	ZINC000477775415	331690533	/nfs/dbraw/zinc/69/05/33/331690533.db2.gz	GEFATPGYOAUDNO-UHFFFAOYSA-N	0	0	292.448	4.021	20	30		CIEDRN
C=CCC1(C(=O)N(CC)Cc2cccc(Cl)c2)CCC1	ZINC000478104527	331697676	/nfs/dbraw/zinc/69/76/76/331697676.db2.gz	VZOUTIDPMPPXRR-UHFFFAOYSA-N	0	0	291.822	4.435	20	30		CIEDRN
CN(C(=O)c1ccc(C(C)(C)C#N)cc1)[C@@H]1CCC(C)(C)C1	ZINC000478204642	331700507	/nfs/dbraw/zinc/70/05/07/331700507.db2.gz	GRSWCZWWNGWJCI-MRXNPFEDSA-N	0	0	298.430	4.138	20	30		CIEDRN
N#Cc1cc(Cl)ccc1CNc1ccc(F)c(F)c1F	ZINC000478364276	331704643	/nfs/dbraw/zinc/70/46/43/331704643.db2.gz	YHIKWSHSTUMJMT-UHFFFAOYSA-N	0	0	296.679	4.241	20	30		CIEDRN
C=C[C@H](CC(=O)N(CC1CC1)C1CCC1)c1ccccc1	ZINC000478627121	331710756	/nfs/dbraw/zinc/71/07/56/331710756.db2.gz	CZXNMUHQEMIHAW-MRXNPFEDSA-N	0	0	283.415	4.137	20	30		CIEDRN
C[C@@H](SCc1ccc2c(c1)OCO2)c1cccc(C#N)c1	ZINC000478763048	331713434	/nfs/dbraw/zinc/71/34/34/331713434.db2.gz	VFEVCHVVAIIYRC-GFCCVEGCSA-N	0	0	297.379	4.281	20	30		CIEDRN
Cc1[nH]c2ccc(OCc3ccccc3C#N)cc2c1C	ZINC000478836707	331715326	/nfs/dbraw/zinc/71/53/26/331715326.db2.gz	XUQARSWYVBRFGA-UHFFFAOYSA-N	0	0	276.339	4.235	20	30		CIEDRN
CC(C)(C)n1cc(C#N)cc1NC(=O)[C@H]1CC12CCCCC2	ZINC000479060829	331719626	/nfs/dbraw/zinc/71/96/26/331719626.db2.gz	NJOHKTSBEHCSKU-CQSZACIVSA-N	0	0	299.418	4.024	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(C)c(OC(F)F)c2)CCC1	ZINC000479073556	331719885	/nfs/dbraw/zinc/71/98/85/331719885.db2.gz	DSOGSSDHQPWQBO-UHFFFAOYSA-N	0	0	295.329	4.281	20	30		CIEDRN
C=CCC1(C(=O)N[C@H](C)c2cccc(C)c2C)CCC1	ZINC000479091190	331720141	/nfs/dbraw/zinc/72/01/41/331720141.db2.gz	POCAQDJLAQIIJJ-OAHLLOKOSA-N	0	0	271.404	4.227	20	30		CIEDRN
C=CCN(C(=O)N[C@@H](C)c1oc2ccccc2c1C)C1CC1	ZINC000479342560	331725230	/nfs/dbraw/zinc/72/52/30/331725230.db2.gz	IICOFNRKVGCAQO-ZDUSSCGKSA-N	0	0	298.386	4.162	20	30		CIEDRN
CC(C)Oc1cccc(OCc2ccc(C#N)c(F)c2)c1	ZINC000479400817	331727151	/nfs/dbraw/zinc/72/71/51/331727151.db2.gz	BJQWMTDZEXZDPQ-UHFFFAOYSA-N	0	0	285.318	4.064	20	30		CIEDRN
C=CCCCC(=O)N(CCc1ccccc1)CC(C)C	ZINC000479498298	331733528	/nfs/dbraw/zinc/73/35/28/331733528.db2.gz	QRAZEWNCTQRKOE-UHFFFAOYSA-N	0	0	273.420	4.070	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](CC)c1ccc(Cl)cc1	ZINC000479525744	331734975	/nfs/dbraw/zinc/73/49/75/331734975.db2.gz	KRVUBFRGUIXBLM-AWEZNQCLSA-N	0	0	265.784	4.264	20	30		CIEDRN
C=CCC[C@H](Nc1cccc(-n2cc(C)[nH]c2=O)c1)C1CC1	ZINC000479545762	331736536	/nfs/dbraw/zinc/73/65/36/331736536.db2.gz	QPLQLOHSMXWNBA-KRWDZBQOSA-N	0	0	297.402	4.043	20	30		CIEDRN
CC[C@H](CC(=O)N(C)c1cc(Cl)ccc1C#N)C(C)C	ZINC000479575912	331738578	/nfs/dbraw/zinc/73/85/78/331738578.db2.gz	LLOCJDVGWGRMRV-GFCCVEGCSA-N	0	0	292.810	4.247	20	30		CIEDRN
C=CCOCCCSCc1ccccc1OC(C)C	ZINC000479588082	331739223	/nfs/dbraw/zinc/73/92/23/331739223.db2.gz	QBGPNSJRDVDPJE-UHFFFAOYSA-N	0	0	280.433	4.300	20	30		CIEDRN
C=CCOCCCSCc1ccc(C(F)F)cc1	ZINC000479589909	331739324	/nfs/dbraw/zinc/73/93/24/331739324.db2.gz	ILWWMHZRMSYIHZ-UHFFFAOYSA-N	0	0	272.360	4.450	20	30		CIEDRN
C=CCOCCCSCCCc1cccc(F)c1	ZINC000479604049	331740211	/nfs/dbraw/zinc/74/02/11/331740211.db2.gz	SQMSGNZILBZLJF-UHFFFAOYSA-N	0	0	268.397	4.084	20	30		CIEDRN
C=CCOCCCS[C@H](C)c1nc2ccccc2o1	ZINC000479607175	331740447	/nfs/dbraw/zinc/74/04/47/331740447.db2.gz	SUOWNRSIIDTVAG-GFCCVEGCSA-N	0	0	277.389	4.215	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](CCCC)c1ccc(OC)cc1	ZINC000479638530	331741848	/nfs/dbraw/zinc/74/18/48/331741848.db2.gz	BPTIHXYOAZFRBV-KRWDZBQOSA-N	0	0	289.419	4.399	20	30		CIEDRN
CC(C)c1cccc(CNC(=O)Nc2cccc(C#N)c2)c1	ZINC000479713442	331744274	/nfs/dbraw/zinc/74/42/74/331744274.db2.gz	LDKXHRPLNOKXBP-UHFFFAOYSA-N	0	0	293.370	4.003	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H](C)Cc2cc(C)cc(C)c2)CCC1	ZINC000479802918	331746261	/nfs/dbraw/zinc/74/62/61/331746261.db2.gz	ISVMKHYMAZIUMF-INIZCTEOSA-N	0	0	285.431	4.097	20	30		CIEDRN
C=C1CCN(C(=O)c2ccccc2NC2CCCCC2)CC1	ZINC000479958714	331752428	/nfs/dbraw/zinc/75/24/28/331752428.db2.gz	OCHCKEYBAZPFFT-UHFFFAOYSA-N	0	0	298.430	4.223	20	30		CIEDRN
C=CCC1(C(=O)Nc2cccc(OCC(=C)C)c2)CCC1	ZINC000480038325	331755397	/nfs/dbraw/zinc/75/53/97/331755397.db2.gz	KGOWEUYTWWPHNL-UHFFFAOYSA-N	0	0	285.387	4.326	20	30		CIEDRN
C=CCCCN(C)C(=O)c1csc2cc(C)ccc21	ZINC000480081658	331757389	/nfs/dbraw/zinc/75/73/89/331757389.db2.gz	CWQUZYAIBGCZQQ-UHFFFAOYSA-N	0	0	273.401	4.248	20	30		CIEDRN
C=CCCCC(=O)N1CC[C@H](C)Sc2ccccc21	ZINC000480559026	331777696	/nfs/dbraw/zinc/77/76/96/331777696.db2.gz	SIWASEBTJCXBST-ZDUSSCGKSA-N	0	0	275.417	4.260	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H](C)c2c(C)cccc2C)CCC1	ZINC000480588290	331779008	/nfs/dbraw/zinc/77/90/08/331779008.db2.gz	ZUHBAMONVAKVIR-HNNXBMFYSA-N	0	0	271.404	4.227	20	30		CIEDRN
C=CCC1(C(=O)NCc2ccc(Cl)c(C)c2)CCC1	ZINC000480587679	331779091	/nfs/dbraw/zinc/77/90/91/331779091.db2.gz	YLCLCWUHANRAFG-UHFFFAOYSA-N	0	0	277.795	4.011	20	30		CIEDRN
Cc1ccc([C@@H](Nc2ccc(C#N)cc2)c2ccccn2)cc1	ZINC000480588791	331779100	/nfs/dbraw/zinc/77/91/00/331779100.db2.gz	KMPBKJHLERGRCU-HXUWFJFHSA-N	0	0	299.377	4.463	20	30		CIEDRN
CCC[C@H](CC)Sc1ccc(C#N)cc1[N+](=O)[O-]	ZINC000480845467	331789699	/nfs/dbraw/zinc/78/96/99/331789699.db2.gz	LZVHTFJVRDJMIH-NSHDSACASA-N	0	0	264.350	4.137	20	30		CIEDRN
CSCCC(C#N)(c1ccccc1)c1ccccc1	ZINC000511262509	332929842	/nfs/dbraw/zinc/92/98/42/332929842.db2.gz	UFXHDIJKDISINL-UHFFFAOYSA-N	0	0	267.397	4.249	20	30		CIEDRN
CCC(=O)c1ccc(Oc2cccc(F)c2C#N)c(F)c1	ZINC000481807404	331816242	/nfs/dbraw/zinc/81/62/42/331816242.db2.gz	DDFDFTIPTVGCSV-UHFFFAOYSA-N	0	0	287.265	4.221	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@@H]1C(F)F	ZINC000511279175	332930133	/nfs/dbraw/zinc/93/01/33/332930133.db2.gz	BZIZIMLRJCYWLV-KBPBESRZSA-N	0	0	293.357	4.378	20	30		CIEDRN
COc1ccc(C#N)cc1N[C@H](C)CCCC(F)(F)F	ZINC000482169288	331826383	/nfs/dbraw/zinc/82/63/83/331826383.db2.gz	ZRZZBJHFUGNLQC-SNVBAGLBSA-N	0	0	286.297	4.100	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)Nc1ccccc1	ZINC000482186190	331826610	/nfs/dbraw/zinc/82/66/10/331826610.db2.gz	MQKTWHQCNXLODT-UHFFFAOYSA-N	0	0	272.392	4.287	20	30		CIEDRN
Cc1cccc2c1N(C1CC1)CCN2CC(C)(C)CCC#N	ZINC000482501451	331835633	/nfs/dbraw/zinc/83/56/33/331835633.db2.gz	BIUYFDMXKURYHJ-UHFFFAOYSA-N	0	0	297.446	4.114	20	30		CIEDRN
Cc1ccccc1OCCNc1ccc(Cl)cc1C#N	ZINC000511363598	332930865	/nfs/dbraw/zinc/93/08/65/332930865.db2.gz	YVBFOONGJIHOTI-UHFFFAOYSA-N	0	0	286.762	4.011	20	30		CIEDRN
C=C(C)[C@@H](NCC#Cc1ccccc1)c1ccc(F)c(F)c1	ZINC000483707501	331882403	/nfs/dbraw/zinc/88/24/03/331882403.db2.gz	AFTZYCIIOCBHCF-LJQANCHMSA-N	0	0	297.348	4.223	20	30		CIEDRN
C[C@@H](CC(C)(C)C)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000483907391	331888823	/nfs/dbraw/zinc/88/88/23/331888823.db2.gz	CSLUVKMRCBALEZ-JTQLQIEISA-N	0	0	290.432	4.119	20	30		CIEDRN
CC#CCCCC(=O)Nc1c(F)cccc1SCC	ZINC000484927536	331907591	/nfs/dbraw/zinc/90/75/91/331907591.db2.gz	ROPUTXOWGCWSBI-UHFFFAOYSA-N	0	0	279.380	4.070	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(-c2ccccn2)cc1	ZINC000485159242	331909838	/nfs/dbraw/zinc/90/98/38/331909838.db2.gz	LDPCZSAIPJRJBC-SFHVURJKSA-N	0	0	280.371	4.289	20	30		CIEDRN
C=CCSc1ccccc1C(=O)NCCC1CCCC1	ZINC000485469292	331915089	/nfs/dbraw/zinc/91/50/89/331915089.db2.gz	UWHAIMZBKKSZOV-UHFFFAOYSA-N	0	0	289.444	4.275	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N[C@H]1CCCC[C@@H]1C	ZINC000485481472	331915154	/nfs/dbraw/zinc/91/51/54/331915154.db2.gz	UGSCTQBDEOMUOU-ZFWWWQNUSA-N	0	0	289.444	4.273	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N[C@H]1CCC[C@@H](C)C1	ZINC000485475443	331915212	/nfs/dbraw/zinc/91/52/12/331915212.db2.gz	FQONFHWUJRQLOM-KGLIPLIRSA-N	0	0	289.444	4.273	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N1CCCC[C@H](C)C1	ZINC000485505034	331915977	/nfs/dbraw/zinc/91/59/77/331915977.db2.gz	VHXFAMDCCMVCCU-AWEZNQCLSA-N	0	0	289.444	4.227	20	30		CIEDRN
C=CCCCCCSCc1nc(CC(F)(F)F)no1	ZINC000485560536	331916811	/nfs/dbraw/zinc/91/68/11/331916811.db2.gz	KWHLPCREMDXMRF-UHFFFAOYSA-N	0	0	294.342	4.154	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1cccc2ccccc21	ZINC000485593274	331918395	/nfs/dbraw/zinc/91/83/95/331918395.db2.gz	MOZNAJONJQDMBN-HNNXBMFYSA-N	0	0	280.371	4.412	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](C)c1ccc2ncsc2c1	ZINC000485659272	331919638	/nfs/dbraw/zinc/91/96/38/331919638.db2.gz	UTDLTYVFCCLAEQ-VXGBXAGGSA-N	0	0	288.416	4.076	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](C)c1ccc2ncsc2c1	ZINC000485659271	331919728	/nfs/dbraw/zinc/91/97/28/331919728.db2.gz	UTDLTYVFCCLAEQ-RYUDHWBXSA-N	0	0	288.416	4.076	20	30		CIEDRN
C=CCC1(C(=O)N[C@H](CCC)CCCC)CCC1	ZINC000485766054	331923511	/nfs/dbraw/zinc/92/35/11/331923511.db2.gz	ZQEGLYCZURBEGG-CQSZACIVSA-N	0	0	251.414	4.208	20	30		CIEDRN
N#Cc1cccnc1/C=C/c1csc(-c2cccs2)n1	ZINC000485977008	331928425	/nfs/dbraw/zinc/92/84/25/331928425.db2.gz	LVGVBCJJCVPAEC-AATRIKPKSA-N	0	0	295.392	4.309	20	30		CIEDRN
N#Cc1cccnc1/C=C/c1ccc2ccccc2c1	ZINC000486049316	331930088	/nfs/dbraw/zinc/93/00/88/331930088.db2.gz	BYZIYFGFVOJGBY-CSKARUKUSA-N	0	0	256.308	4.277	20	30		CIEDRN
CC(C)COc1cccc(/C=C/c2ncccc2C#N)c1	ZINC000486052584	331930136	/nfs/dbraw/zinc/93/01/36/331930136.db2.gz	JSQFPHJXXODBBH-CMDGGOBGSA-N	0	0	278.355	4.158	20	30		CIEDRN
COc1cc(C#N)ccc1CNc1csc2ccccc12	ZINC000486105980	331931644	/nfs/dbraw/zinc/93/16/44/331931644.db2.gz	UQIHQNDZIJMOJZ-UHFFFAOYSA-N	0	0	294.379	4.394	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1sc(CCC)nc1C	ZINC000486348954	331935375	/nfs/dbraw/zinc/93/53/75/331935375.db2.gz	XSFUXMXPHYFERT-LLVKDONJSA-N	0	0	295.452	4.270	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000486763155	331943894	/nfs/dbraw/zinc/94/38/94/331943894.db2.gz	PJJWAJKSRIRXPS-CYBMUJFWSA-N	0	0	298.308	4.278	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1cccc(Cl)c1C	ZINC000486755262	331944022	/nfs/dbraw/zinc/94/40/22/331944022.db2.gz	PBSJEQCIATYBAS-LBPRGKRZSA-N	0	0	278.783	4.221	20	30		CIEDRN
CC(C)CN(Cc1ccc(C#N)cc1)C(=O)CCC1CCC1	ZINC000486868406	331947808	/nfs/dbraw/zinc/94/78/08/331947808.db2.gz	MITYZSCVHNMSPU-UHFFFAOYSA-N	0	0	298.430	4.123	20	30		CIEDRN
N#Cc1ccc(N[C@H]2CCC[C@@H](c3ccccc3)C2)cn1	ZINC000487136785	331956899	/nfs/dbraw/zinc/95/68/99/331956899.db2.gz	KPPVSSGBSYVTBB-CVEARBPZSA-N	0	0	277.371	4.092	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)CCC2CCC2)c1	ZINC000487307336	331965130	/nfs/dbraw/zinc/96/51/30/331965130.db2.gz	IXQNDZWYUAXHMD-UHFFFAOYSA-N	0	0	273.376	4.160	20	30		CIEDRN
Cc1cc(C#N)ccc1C(=O)Nc1csc2ccccc12	ZINC000487490360	331971490	/nfs/dbraw/zinc/97/14/90/331971490.db2.gz	ZZKBJVFLZBIWLC-UHFFFAOYSA-N	0	0	292.363	4.334	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)c2oc(CC)cc2C)c1	ZINC000487584400	331976321	/nfs/dbraw/zinc/97/63/21/331976321.db2.gz	OBMMGJKNVDJMAR-UHFFFAOYSA-N	0	0	299.370	4.358	20	30		CIEDRN
CC(C)C[C@H]1CCCCCN1C(=O)c1ccc(C#N)s1	ZINC000487593804	331976438	/nfs/dbraw/zinc/97/64/38/331976438.db2.gz	QXGNIEJKUXCERD-CYBMUJFWSA-N	0	0	290.432	4.051	20	30		CIEDRN
C=CC[C@@H](C(=O)N(CC)Cc1ccccc1)c1ccccc1	ZINC000487593967	331976468	/nfs/dbraw/zinc/97/64/68/331976468.db2.gz	FWRGKUHEYSXPJM-LJQANCHMSA-N	0	0	293.410	4.395	20	30		CIEDRN
C=CC[C@@H](C(=O)NCc1ccccc1Cl)c1ccccc1	ZINC000487590483	331976507	/nfs/dbraw/zinc/97/65/07/331976507.db2.gz	KUWIHLXMCVPQPZ-MRXNPFEDSA-N	0	0	299.801	4.316	20	30		CIEDRN
C=CCCCCCN(C)C(=O)C/C=C\c1cccc(F)c1	ZINC000487601015	331976660	/nfs/dbraw/zinc/97/66/60/331976660.db2.gz	DNYATESEKJNNIH-LUAWRHEFSA-N	0	0	289.394	4.434	20	30		CIEDRN
C=CC[C@@H](C(=O)NC1CCCCCC1)c1ccccc1	ZINC000487632910	331977729	/nfs/dbraw/zinc/97/77/29/331977729.db2.gz	BPVIYODSLJJFGK-QGZVFWFLSA-N	0	0	271.404	4.185	20	30		CIEDRN
C=CCC[C@H](C(=O)NCCCCC)c1ccccc1	ZINC000487640256	331977867	/nfs/dbraw/zinc/97/78/67/331977867.db2.gz	NPIOUGHKRPFYRX-INIZCTEOSA-N	0	0	259.393	4.043	20	30		CIEDRN
C=CCC[C@@H](C(=O)Nc1cccc(OC)c1)c1ccccc1	ZINC000487642811	331977981	/nfs/dbraw/zinc/97/79/81/331977981.db2.gz	YMNLNAICFJFYEI-GOSISDBHSA-N	0	0	295.382	4.384	20	30		CIEDRN
Cc1nc(Sc2nc(-c3ccccc3)co2)ccc1C#N	ZINC000487726943	331979908	/nfs/dbraw/zinc/97/99/08/331979908.db2.gz	FBRNFYBVFHAUMI-UHFFFAOYSA-N	0	0	293.351	4.068	20	30		CIEDRN
Cc1ccc2ncc(C#N)c(N3CC4(CCC4)C[C@H]3C)c2c1	ZINC000487739907	331980376	/nfs/dbraw/zinc/98/03/76/331980376.db2.gz	NGWZKKRPYCNNMD-CQSZACIVSA-N	0	0	291.398	4.184	20	30		CIEDRN
Cc1nc(N2C[C@@H](C)CC[C@H]2c2ccccc2)ccc1C#N	ZINC000487747440	331980409	/nfs/dbraw/zinc/98/04/09/331980409.db2.gz	FGBPJIHIGGDFSK-KSSFIOAISA-N	0	0	291.398	4.239	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1cc(F)cc(F)c1)c1ccccc1	ZINC000487792289	331981428	/nfs/dbraw/zinc/98/14/28/331981428.db2.gz	ALJUVWYUXCXEKE-MRXNPFEDSA-N	0	0	287.309	4.263	20	30		CIEDRN
Cc1nc(N2CCCC[C@H]2c2ccc(F)cc2)ccc1C#N	ZINC000488130370	331991379	/nfs/dbraw/zinc/99/13/79/331991379.db2.gz	WBTCELDCCNOCIQ-KRWDZBQOSA-N	0	0	295.361	4.132	20	30		CIEDRN
Cc1cccc(SCc2cccc(F)c2C#N)c1	ZINC000488261177	331996455	/nfs/dbraw/zinc/99/64/55/331996455.db2.gz	HENHXZVIMMIWIO-UHFFFAOYSA-N	0	0	257.333	4.298	20	30		CIEDRN
N#Cc1cccc(C(=O)N2CCC[C@H]2CCC2CCCC2)c1	ZINC000488259171	331996486	/nfs/dbraw/zinc/99/64/86/331996486.db2.gz	FTUMGWMOBMEGGQ-SFHVURJKSA-N	0	0	296.414	4.133	20	30		CIEDRN
Cc1ccc2ncc(C#N)c(OCc3ccccc3F)c2c1	ZINC000488284426	331997282	/nfs/dbraw/zinc/99/72/82/331997282.db2.gz	ZCIRYBDBZFAMSI-UHFFFAOYSA-N	0	0	292.313	4.133	20	30		CIEDRN
N#Cc1ccc(C(=O)N2CCC[C@H]2CCC2CCCC2)cc1	ZINC000488289716	331997553	/nfs/dbraw/zinc/99/75/53/331997553.db2.gz	AZOHNWRDJZUCDY-SFHVURJKSA-N	0	0	296.414	4.133	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@H]1CC[C@H](C)CC1)c1ccccc1	ZINC000488337231	332000777	/nfs/dbraw/zinc/00/07/77/332000777.db2.gz	RRLLWEPGJCYYIL-DJIMGWMZSA-N	0	0	271.404	4.041	20	30		CIEDRN
CC(C)(C)CN(CCC#N)Cc1cc2ccc(F)cc2[nH]1	ZINC000488341139	332000899	/nfs/dbraw/zinc/00/08/99/332000899.db2.gz	UKMVSBFLRWMPSR-UHFFFAOYSA-N	0	0	287.382	4.069	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@@H]1C[C@@H]1c1ccccc1)c1ccccc1	ZINC000488373977	332002772	/nfs/dbraw/zinc/00/27/72/332002772.db2.gz	XPZXRFQCNLRHKZ-IPMKNSEASA-N	0	0	291.394	4.019	20	30		CIEDRN
CCC[C@H](C(=O)Nc1sc(CC)cc1C#N)C(C)C	ZINC000488375934	332002847	/nfs/dbraw/zinc/00/28/47/332002847.db2.gz	LSRHPMJKNIDZOL-ZDUSSCGKSA-N	0	0	278.421	4.193	20	30		CIEDRN
C=CCn1cccc1C(=O)N(C)[C@@H](C)c1ccc(C)cc1C	ZINC000488381609	332003074	/nfs/dbraw/zinc/00/30/74/332003074.db2.gz	CHONFNCWBDAFDE-INIZCTEOSA-N	0	0	296.414	4.124	20	30		CIEDRN
C=CCC[C@@H](C(=O)N(C)C[C@H](C)CC)c1ccccc1	ZINC000488388817	332003363	/nfs/dbraw/zinc/00/33/63/332003363.db2.gz	RDZQAYNIKXPHCE-NVXWUHKLSA-N	0	0	273.420	4.241	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(C)c(OC(C)C)c1	ZINC000488424708	332006472	/nfs/dbraw/zinc/00/64/72/332006472.db2.gz	YRUIYPNXFZLGOY-AWEZNQCLSA-N	0	0	275.392	4.323	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(C)c(OC(C)C)c1	ZINC000488424709	332006617	/nfs/dbraw/zinc/00/66/17/332006617.db2.gz	YRUIYPNXFZLGOY-CQSZACIVSA-N	0	0	275.392	4.323	20	30		CIEDRN
C[C@H](Nc1ccc2scnc2c1)c1ccc(C#N)cc1F	ZINC000488470482	332012251	/nfs/dbraw/zinc/01/22/51/332012251.db2.gz	BMLMBDIJNOHLNJ-JTQLQIEISA-N	0	0	297.358	4.480	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1ccc(CC)c(C)c1	ZINC000488548644	332016720	/nfs/dbraw/zinc/01/67/20/332016720.db2.gz	VBSCREJWYUQYBR-MRXNPFEDSA-N	0	0	272.392	4.130	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1cc(C)cc2cccnc21	ZINC000488562687	332017555	/nfs/dbraw/zinc/01/75/55/332017555.db2.gz	IAZIVFPJQWAJMY-OAHLLOKOSA-N	0	0	295.386	4.116	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1cc(C)cc2cccnc21	ZINC000488562685	332017598	/nfs/dbraw/zinc/01/75/98/332017598.db2.gz	IAZIVFPJQWAJMY-HNNXBMFYSA-N	0	0	295.386	4.116	20	30		CIEDRN
C=CCn1cccc1C(=O)Nc1ccccc1C(C)C	ZINC000488578673	332018683	/nfs/dbraw/zinc/01/86/83/332018683.db2.gz	ZDGHNQZEASRRBC-UHFFFAOYSA-N	0	0	268.360	4.050	20	30		CIEDRN
C=C(C)CNC(=O)N[C@@H](C)c1ccc(SC(C)C)cc1	ZINC000488578873	332018912	/nfs/dbraw/zinc/01/89/12/332018912.db2.gz	HXKJGFIAZMOJHR-ZDUSSCGKSA-N	0	0	292.448	4.123	20	30		CIEDRN
C=CC[C@@H](C(=O)NCc1ccc(C)s1)c1ccccc1	ZINC000488623936	332020296	/nfs/dbraw/zinc/02/02/96/332020296.db2.gz	ROVRSWXYLWXMLF-MRXNPFEDSA-N	0	0	285.412	4.033	20	30		CIEDRN
C=CC[C@@H](C(=O)NCc1sccc1C)c1ccccc1	ZINC000488689391	332021709	/nfs/dbraw/zinc/02/17/09/332021709.db2.gz	AFTNHUYZEMWLML-OAHLLOKOSA-N	0	0	285.412	4.033	20	30		CIEDRN
C=CCC[C@H](C(=O)N(C)CCC(F)(F)F)c1ccccc1	ZINC000488695300	332021978	/nfs/dbraw/zinc/02/19/78/332021978.db2.gz	QXJHIDSPTARCLC-AWEZNQCLSA-N	0	0	299.336	4.147	20	30		CIEDRN
C=CCC[C@@H](C(=O)N(C)CCC(F)(F)F)c1ccccc1	ZINC000488695301	332021990	/nfs/dbraw/zinc/02/19/90/332021990.db2.gz	QXJHIDSPTARCLC-CQSZACIVSA-N	0	0	299.336	4.147	20	30		CIEDRN
C=CCC[C@H](C(=O)N(CCC)CC(F)F)c1ccccc1	ZINC000488712964	332022328	/nfs/dbraw/zinc/02/23/28/332022328.db2.gz	KPGXDZMBUKVEIZ-HNNXBMFYSA-N	0	0	295.373	4.240	20	30		CIEDRN
C=CCN(C(=O)[C@@H](C)SCCCC)c1ccccc1	ZINC000511629206	332937420	/nfs/dbraw/zinc/93/74/20/332937420.db2.gz	NWTHOSNAHNTXLN-CQSZACIVSA-N	0	0	277.433	4.127	20	30		CIEDRN
N#Cc1ncccc1N[C@@H]1CCCc2sc(Cl)cc21	ZINC000488744315	332023717	/nfs/dbraw/zinc/02/37/17/332023717.db2.gz	BQOCOBDTKUMAMW-SNVBAGLBSA-N	0	0	289.791	4.158	20	30		CIEDRN
N#Cc1ccncc1N[C@H]1CCCc2sc(Cl)cc21	ZINC000488765243	332024813	/nfs/dbraw/zinc/02/48/13/332024813.db2.gz	SPRCHQBRUIUOHS-NSHDSACASA-N	0	0	289.791	4.158	20	30		CIEDRN
C=CCN(C(=O)C[C@H]1C[C@H](C)c2c1cccc2C)C1CC1	ZINC000488812046	332026691	/nfs/dbraw/zinc/02/66/91/332026691.db2.gz	DICOOSWUOOOGOK-LSDHHAIUSA-N	0	0	283.415	4.153	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@H](C)Cc1cccc(Cl)c1	ZINC000488818720	332027299	/nfs/dbraw/zinc/02/72/99/332027299.db2.gz	RJAHQLATQXJQOB-CZUORRHYSA-N	0	0	291.822	4.086	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1	ZINC000488834537	332028183	/nfs/dbraw/zinc/02/81/83/332028183.db2.gz	XODFFYLDHQWJKQ-IJLUTSLNSA-N	0	0	295.835	4.072	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)CCCC1CCCCC1	ZINC000488835440	332028270	/nfs/dbraw/zinc/02/82/70/332028270.db2.gz	INQPYPKBXVZKQO-INIZCTEOSA-N	0	0	263.425	4.304	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1coc2cc(C)c(C)cc21	ZINC000488845295	332028948	/nfs/dbraw/zinc/02/89/48/332028948.db2.gz	YHMUXAPTZBRFLY-CQSZACIVSA-N	0	0	283.371	4.230	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1cc2c(s1)CC[C@H](C)C2	ZINC000488845037	332028977	/nfs/dbraw/zinc/02/89/77/332028977.db2.gz	PSKHRKMXJILBAQ-GXTWGEPZSA-N	0	0	289.444	4.054	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)C[C@@H](CC)CCCC	ZINC000488886490	332029399	/nfs/dbraw/zinc/02/93/99/332029399.db2.gz	VEJICMJSTNRTCQ-GJZGRUSLSA-N	0	0	251.414	4.160	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1ccc(C(C)(C)C)cc1	ZINC000488856984	332029587	/nfs/dbraw/zinc/02/95/87/332029587.db2.gz	NCXFYPSLQTVAPC-INIZCTEOSA-N	0	0	271.404	4.165	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)C[C@H](c1ccccc1)C(C)C	ZINC000488855511	332029649	/nfs/dbraw/zinc/02/96/49/332029649.db2.gz	ANAZIXPMIAJYMR-MSOLQXFVSA-N	0	0	285.431	4.383	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)CCSc1ccc(C)cc1	ZINC000488860347	332029839	/nfs/dbraw/zinc/02/98/39/332029839.db2.gz	TXGGQBHNVGXHSZ-HNNXBMFYSA-N	0	0	289.444	4.044	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1cccc2ccccc21	ZINC000488863510	332030001	/nfs/dbraw/zinc/03/00/01/332030001.db2.gz	XWSZHWOENWGURW-OAHLLOKOSA-N	0	0	265.356	4.021	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)C[C@@H](CC)c1ccccc1	ZINC000488862091	332030074	/nfs/dbraw/zinc/03/00/74/332030074.db2.gz	HEXLEKDZQJSFJM-NVXWUHKLSA-N	0	0	271.404	4.137	20	30		CIEDRN
C=CC[C@@H](C(=O)N1CCCCC[C@H]1C)c1ccccc1	ZINC000488866072	332030215	/nfs/dbraw/zinc/03/02/15/332030215.db2.gz	VZSGSQAOGWWODS-NVXWUHKLSA-N	0	0	271.404	4.137	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)C[C@H](C)C1CCCCC1	ZINC000488868385	332030240	/nfs/dbraw/zinc/03/02/40/332030240.db2.gz	JQVOOEQQTRLBIY-HOCLYGCPSA-N	0	0	263.425	4.160	20	30		CIEDRN
C=C1CCN(C(=O)C[C@H]2C[C@@H](C)c3c2cccc3C)CC1	ZINC000488870050	332030560	/nfs/dbraw/zinc/03/05/60/332030560.db2.gz	BQKBKYKAUAOGOJ-HZPDHXFCSA-N	0	0	283.415	4.155	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@H](C)Cc1ccc(Cl)cc1	ZINC000488875455	332030995	/nfs/dbraw/zinc/03/09/95/332030995.db2.gz	DXIOGASEFJKDJS-CZUORRHYSA-N	0	0	291.822	4.086	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)C[C@@H](C)c1c[nH]c2ccccc21	ZINC000488875874	332031052	/nfs/dbraw/zinc/03/10/52/332031052.db2.gz	GZLRBBRWEKKQKJ-HUUCEWRRSA-N	0	0	296.414	4.229	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1cccc(-c2ccoc2)c1	ZINC000488876709	332031098	/nfs/dbraw/zinc/03/10/98/332031098.db2.gz	JFRASJBQAUBMQU-QGZVFWFLSA-N	0	0	281.355	4.127	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)C[C@H]1CCCCC1(C)C	ZINC000488876442	332031203	/nfs/dbraw/zinc/03/12/03/332031203.db2.gz	IGXKNMPXCQAKOF-CABCVRRESA-N	0	0	263.425	4.160	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@H](C)Cc1ccccc1Cl	ZINC000488879923	332031709	/nfs/dbraw/zinc/03/17/09/332031709.db2.gz	POWQFSHQTPHBEX-UKRRQHHQSA-N	0	0	291.822	4.086	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)C[C@H](CC)CCCC	ZINC000488886488	332032118	/nfs/dbraw/zinc/03/21/18/332032118.db2.gz	VEJICMJSTNRTCQ-CABCVRRESA-N	0	0	251.414	4.160	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)CC/C=C/c1ccccc1	ZINC000488883880	332032174	/nfs/dbraw/zinc/03/21/74/332032174.db2.gz	XPBPOWSUAIZBAQ-USAXFFIDSA-N	0	0	269.388	4.047	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@@H]1CC[C@@H]2CCC[C@H]2C1)c1ccccc1	ZINC000488995228	332037133	/nfs/dbraw/zinc/03/71/33/332037133.db2.gz	HUUAJZYKXGPHFG-KANFNMMFSA-N	0	0	297.442	4.431	20	30		CIEDRN
C=CCn1cccc1C(=O)N1CCCC[C@@H]1CCC(C)C	ZINC000489007380	332037235	/nfs/dbraw/zinc/03/72/35/332037235.db2.gz	FSPSROVCXPXWIC-MRXNPFEDSA-N	0	0	288.435	4.105	20	30		CIEDRN
C=CCn1cccc1C(=O)N(CCC(C)C)C1CCCC1	ZINC000489034856	332038828	/nfs/dbraw/zinc/03/88/28/332038828.db2.gz	CPQAGVYMRVKHEV-UHFFFAOYSA-N	0	0	288.435	4.105	20	30		CIEDRN
C=CCn1cccc1C(=O)N(CCC)CC1CCCCC1	ZINC000489069368	332040327	/nfs/dbraw/zinc/04/03/27/332040327.db2.gz	HXUUFXAFWHDIIR-UHFFFAOYSA-N	0	0	288.435	4.107	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1[C@@H]2CCC[C@@H]21	ZINC000489090315	332041201	/nfs/dbraw/zinc/04/12/01/332041201.db2.gz	VOCFXFUNMKLJSK-VQFNDLOPSA-N	0	0	298.430	4.459	20	30		CIEDRN
C=C[C@@H]1CCCCN1Cc1cc(Br)cs1	ZINC000489403444	332050311	/nfs/dbraw/zinc/05/03/11/332050311.db2.gz	LILMYQXSJKBWOH-LLVKDONJSA-N	0	0	286.238	4.051	20	30		CIEDRN
C=C[C@H]1CCCCN1Cc1csc(Cc2ccccc2)n1	ZINC000489424275	332051138	/nfs/dbraw/zinc/05/11/38/332051138.db2.gz	IKENBPJVTVVRLU-KRWDZBQOSA-N	0	0	298.455	4.274	20	30		CIEDRN
C=C[C@@H]1CCCCN1Cc1csc(-c2cccs2)n1	ZINC000489488378	332056048	/nfs/dbraw/zinc/05/60/48/332056048.db2.gz	YCVDHITUQFREBJ-CYBMUJFWSA-N	0	0	290.457	4.412	20	30		CIEDRN
C=CCn1cccc1C(=O)N1CCCC(CC)(CC)CC1	ZINC000489553074	332059043	/nfs/dbraw/zinc/05/90/43/332059043.db2.gz	CNANGLUTQCKNEB-UHFFFAOYSA-N	0	0	288.435	4.107	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@@H]1CCC(C)(C)C1)c1ccccc1	ZINC000489632895	332062286	/nfs/dbraw/zinc/06/22/86/332062286.db2.gz	WTYCYQKBWOFSBU-HZPDHXFCSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CCN(C(=O)CCCCCc1ccc(F)cc1)C1CC1	ZINC000489638674	332062496	/nfs/dbraw/zinc/06/24/96/332062496.db2.gz	LPPDUVVHTXQQCL-UHFFFAOYSA-N	0	0	289.394	4.106	20	30		CIEDRN
C=C(C)CNC(=O)Nc1cc(Cl)ccc1C(F)(F)F	ZINC000489658079	332063343	/nfs/dbraw/zinc/06/33/43/332063343.db2.gz	ZDUAWRIAFZDEDQ-UHFFFAOYSA-N	0	0	292.688	4.056	20	30		CIEDRN
Cc1ccc([C@H]2CCCN2Cc2ccc(F)cc2C#N)cc1	ZINC000489657625	332063449	/nfs/dbraw/zinc/06/34/49/332063449.db2.gz	HGMYYBDRZMYKNK-LJQANCHMSA-N	0	0	294.373	4.343	20	30		CIEDRN
C=CC[C@H](C(=O)NCC12CCC(CC1)C2)c1ccccc1	ZINC000489663574	332063544	/nfs/dbraw/zinc/06/35/44/332063544.db2.gz	WJMOOVKNWCXERA-RMXPPQQLSA-N	0	0	283.415	4.043	20	30		CIEDRN
C=CCC[C@H](C(=O)Nc1cncc(C)c1)c1ccccc1	ZINC000489663882	332063803	/nfs/dbraw/zinc/06/38/03/332063803.db2.gz	IUFVHGKCZSACDF-KRWDZBQOSA-N	0	0	280.371	4.079	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H]1CCC[C@@H](c2ccccc2)C1	ZINC000489665798	332063868	/nfs/dbraw/zinc/06/38/68/332063868.db2.gz	MFVYLOIHLALNSY-JQHSSLGASA-N	0	0	285.431	4.431	20	30		CIEDRN
Cc1ccc([C@H](C)N(C)Cc2ccc(F)cc2C#N)cc1	ZINC000489677006	332064450	/nfs/dbraw/zinc/06/44/50/332064450.db2.gz	JUMYXHPJRMOGLB-AWEZNQCLSA-N	0	0	282.362	4.199	20	30		CIEDRN
C=CC[C@H](C(=O)NCC1(CCC)CC1)c1ccccc1	ZINC000489688135	332064836	/nfs/dbraw/zinc/06/48/36/332064836.db2.gz	QKUAUWVBYCIXGZ-INIZCTEOSA-N	0	0	271.404	4.043	20	30		CIEDRN
CC(C)N(Cc1ccccc1)Cc1ccc(F)cc1C#N	ZINC000489687828	332064858	/nfs/dbraw/zinc/06/48/58/332064858.db2.gz	VDWMFQXQUMXGOJ-UHFFFAOYSA-N	0	0	282.362	4.108	20	30		CIEDRN
C=CC[C@@H](C(=O)N(CC)C[C@H](C)CC)c1ccccc1	ZINC000489695862	332065313	/nfs/dbraw/zinc/06/53/13/332065313.db2.gz	FAWYOIKICJLUJX-NVXWUHKLSA-N	0	0	273.420	4.241	20	30		CIEDRN
C=C[C@@H](C)NC(=O)Nc1cc(Cl)ccc1C(F)(F)F	ZINC000489740191	332066543	/nfs/dbraw/zinc/06/65/43/332066543.db2.gz	WXJOOYTYWWBIIH-SSDOTTSWSA-N	0	0	292.688	4.055	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@@H]1C[C@@H]1c1ccccc1Cl	ZINC000489761770	332067079	/nfs/dbraw/zinc/06/70/79/332067079.db2.gz	BPCWAGPHNJVTCR-ZIAGYGMSSA-N	0	0	291.822	4.162	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1ccc(Cl)cc1Cl	ZINC000489862158	332070747	/nfs/dbraw/zinc/07/07/47/332070747.db2.gz	VDXMJKACZISKPH-UHFFFAOYSA-N	0	0	286.202	4.326	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@H]1C[C@H]1c1cccc(Cl)c1	ZINC000489881921	332071635	/nfs/dbraw/zinc/07/16/35/332071635.db2.gz	HVCSNCOYDRDBQC-GJZGRUSLSA-N	0	0	291.822	4.162	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1	ZINC000489881373	332071637	/nfs/dbraw/zinc/07/16/37/332071637.db2.gz	HVCSNCOYDRDBQC-CABCVRRESA-N	0	0	291.822	4.162	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1c(C)nc2ccccc2c1C	ZINC000489905990	332072519	/nfs/dbraw/zinc/07/25/19/332072519.db2.gz	HCGOSUWHFPENTA-UHFFFAOYSA-N	0	0	296.414	4.184	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@@H](C)Cc1ccccc1Cl	ZINC000489960797	332074676	/nfs/dbraw/zinc/07/46/76/332074676.db2.gz	YDNNVDNIKSWTFH-ZDUSSCGKSA-N	0	0	293.838	4.237	20	30		CIEDRN
C=CCn1cccc1C(=O)N1CCC[C@H](C)c2ccccc21	ZINC000489964077	332074716	/nfs/dbraw/zinc/07/47/16/332074716.db2.gz	RPVNKJMYIUFVTI-HNNXBMFYSA-N	0	0	294.398	4.218	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@@H](C)Sc1ccc(C)cc1	ZINC000489980533	332075413	/nfs/dbraw/zinc/07/54/13/332075413.db2.gz	RPSZWMXSWVUJIA-CQSZACIVSA-N	0	0	291.460	4.194	20	30		CIEDRN
C=CCn1cccc1C(=O)Nc1c(C)cccc1C(C)C	ZINC000490017561	332076741	/nfs/dbraw/zinc/07/67/41/332076741.db2.gz	CBVLYPFULPSLHL-UHFFFAOYSA-N	0	0	282.387	4.358	20	30		CIEDRN
C=C(C)CNC(=O)CC1CCC(c2ccccc2)CC1	ZINC000490027699	332077246	/nfs/dbraw/zinc/07/72/46/332077246.db2.gz	BJDLKCYLMAEEEF-UHFFFAOYSA-N	0	0	271.404	4.043	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@H](c1ccccc1)C(C)C	ZINC000490035375	332077713	/nfs/dbraw/zinc/07/77/13/332077713.db2.gz	WVPVACPSMLUDTA-INIZCTEOSA-N	0	0	273.420	4.145	20	30		CIEDRN
C=C(C)CNC(=O)c1ccc(SCc2ccccc2)cc1	ZINC000490038841	332077991	/nfs/dbraw/zinc/07/79/91/332077991.db2.gz	AXHBSHWUMRLBFS-UHFFFAOYSA-N	0	0	297.423	4.285	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)C1(c2ccc(Cl)cc2)CC1	ZINC000490065572	332079641	/nfs/dbraw/zinc/07/96/41/332079641.db2.gz	GVMZOVXDFYKUNF-UHFFFAOYSA-N	0	0	291.822	4.090	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)CCCC1CCCC1	ZINC000490218716	332084922	/nfs/dbraw/zinc/08/49/22/332084922.db2.gz	UMMFCEBSKWNVLM-UHFFFAOYSA-N	0	0	289.419	4.197	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@H](C)CCC1CC1)c1ccccc1	ZINC000490251668	332085421	/nfs/dbraw/zinc/08/54/21/332085421.db2.gz	OFXGJYDMMULSRD-PBHICJAKSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)c1ccc(C(C)C)cc1	ZINC000490263722	332085750	/nfs/dbraw/zinc/08/57/50/332085750.db2.gz	UKISAHZYADPGJI-UHFFFAOYSA-N	0	0	297.398	4.274	20	30		CIEDRN
C=CCCCNC(=O)N[C@H]1CCCc2sc(Cl)cc21	ZINC000490368040	332087633	/nfs/dbraw/zinc/08/76/33/332087633.db2.gz	BBHXVUZNTRYSNF-NSHDSACASA-N	0	0	298.839	4.044	20	30		CIEDRN
C=C(C)CN(C)C(=O)Nc1ccc(-c2ccco2)cc1F	ZINC000490488642	332090173	/nfs/dbraw/zinc/09/01/73/332090173.db2.gz	PKBJTMPZRYIXST-UHFFFAOYSA-N	0	0	288.322	4.126	20	30		CIEDRN
N#Cc1cc(NC(=O)CC2CC2)ccc1Oc1ccccc1	ZINC000490487173	332090221	/nfs/dbraw/zinc/09/02/21/332090221.db2.gz	TWYOYCQRELPRCN-UHFFFAOYSA-N	0	0	292.338	4.089	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(Cl)c2ccncc12	ZINC000490654637	332100359	/nfs/dbraw/zinc/10/03/59/332100359.db2.gz	MVWGWXFDTRZOBM-LLVKDONJSA-N	0	0	288.778	4.429	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)/C=C\c2ccsc2)cc1	ZINC000490732285	332109601	/nfs/dbraw/zinc/10/96/01/332109601.db2.gz	HOMLADLHJPFQFC-BAQGIRSFSA-N	0	0	296.395	4.201	20	30		CIEDRN
C=CC1CCN(C(=O)N[C@@H](c2ccccc2C)C2CC2)CC1	ZINC000491131614	332154621	/nfs/dbraw/zinc/15/46/21/332154621.db2.gz	HLLYMJLUSWEFNI-GOSISDBHSA-N	0	0	298.430	4.054	20	30		CIEDRN
C/C=C/C=C\C(=O)Nc1ccccc1SC[C@H](C)C#N	ZINC000491559866	332238327	/nfs/dbraw/zinc/23/83/27/332238327.db2.gz	BWVVDOJFGPOYNE-NTXAYVQDSA-N	0	0	286.400	4.009	20	30		CIEDRN
Cc1c(NCc2cc(C#N)cs2)cccc1-c1ncco1	ZINC000491573328	332240970	/nfs/dbraw/zinc/24/09/70/332240970.db2.gz	RSHJKRZTGSPWCM-UHFFFAOYSA-N	0	0	295.367	4.195	20	30		CIEDRN
Cc1c(NCc2ccc(C#N)s2)cccc1-c1ncco1	ZINC000491595537	332242074	/nfs/dbraw/zinc/24/20/74/332242074.db2.gz	BBOAGIKUVFBEBW-UHFFFAOYSA-N	0	0	295.367	4.195	20	30		CIEDRN
C=CCN(CC(F)(F)F)C(=O)C[C@@H](C)c1ccccc1C	ZINC000172229839	335098196	/nfs/dbraw/zinc/09/81/96/335098196.db2.gz	ABAWCYMFAWSROD-CYBMUJFWSA-N	0	0	299.336	4.066	20	30		CIEDRN
CCC[C@@H](CC1CCCCC1)C(=O)N(CC)CCC#N	ZINC000492075325	332381752	/nfs/dbraw/zinc/38/17/52/332381752.db2.gz	DUMZIGISGDBAOG-INIZCTEOSA-N	0	0	278.440	4.135	20	30		CIEDRN
CC(C)c1ccc(/C=C\CC(=O)N(C)C2(C#N)CCC2)cc1	ZINC000492167282	332385509	/nfs/dbraw/zinc/38/55/09/332385509.db2.gz	HPQMLDJGPAMAFS-XQRVVYSFSA-N	0	0	296.414	4.118	20	30		CIEDRN
C/C=C(/C=C/C(=O)N[C@@H](CCCC#N)c1ccccc1)CC	ZINC000492803025	332414151	/nfs/dbraw/zinc/41/41/51/332414151.db2.gz	FNKXKERQAUMFAX-WYSJIZJKSA-N	0	0	296.414	4.450	20	30		CIEDRN
CC(C)(C)/C=C/C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000492849002	332415866	/nfs/dbraw/zinc/41/58/66/332415866.db2.gz	ARPCVIYGSIVWPL-DBTPVHCXSA-N	0	0	284.403	4.140	20	30		CIEDRN
C/C=C(/C=C/C(=O)Nc1ccc(Cl)cc1CC#N)CC	ZINC000493117229	332426976	/nfs/dbraw/zinc/42/69/76/332426976.db2.gz	KUODLLPHYJWGNB-NBKHWYKPSA-N	0	0	288.778	4.257	20	30		CIEDRN
C/C=C(/C=C\C(=O)Nc1ccc(Cl)cc1CC#N)CC	ZINC000493117228	332426990	/nfs/dbraw/zinc/42/69/90/332426990.db2.gz	KUODLLPHYJWGNB-MLJMVLIVSA-N	0	0	288.778	4.257	20	30		CIEDRN
N#CCc1ccccc1NC(=O)/C=C\c1cccc(Cl)c1	ZINC000493189725	332430085	/nfs/dbraw/zinc/43/00/85/332430085.db2.gz	MUQRPRXGSPFFAE-HJWRWDBZSA-N	0	0	296.757	4.058	20	30		CIEDRN
N#CCCCOc1cccc(NC(=O)/C=C/C2CCCC2)c1	ZINC000493264116	332433126	/nfs/dbraw/zinc/43/31/26/332433126.db2.gz	LSRHRXBARQKNHS-ZHACJKMWSA-N	0	0	298.386	4.054	20	30		CIEDRN
C/C=C(/C=C/C(=O)N[C@H](CCC#N)c1ccccc1)CC	ZINC000493597767	332446577	/nfs/dbraw/zinc/44/65/77/332446577.db2.gz	NIBPBYQGIXTNPJ-STZKSOGGSA-N	0	0	282.387	4.060	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)N[C@@H](c1ccccc1)C(C)C	ZINC000494214694	332466750	/nfs/dbraw/zinc/46/67/50/332466750.db2.gz	CHHZNIJRLIUESP-DLBZAZTESA-N	0	0	286.419	4.134	20	30		CIEDRN
C=CCCCOc1ccc(Oc2nccs2)cc1	ZINC000494449561	332473784	/nfs/dbraw/zinc/47/37/84/332473784.db2.gz	CUAYZAXPRAKJHC-UHFFFAOYSA-N	0	0	261.346	4.280	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)CCSc1cccc(Cl)c1	ZINC000575737306	335110447	/nfs/dbraw/zinc/11/04/47/335110447.db2.gz	FKLFTHPXSORFOF-ZDUSSCGKSA-N	0	0	297.851	4.293	20	30		CIEDRN
CC(C)(C#N)CC[NH2+]C(C)(C)c1cccc(C(F)(F)F)c1	ZINC000553708901	334396188	/nfs/dbraw/zinc/39/61/88/334396188.db2.gz	RGHIFEFPCFNFBS-UHFFFAOYSA-N	0	0	298.352	4.470	20	30		CIEDRN
CCOc1cc(Cl)ccc1NCC(C)(C)CCC#N	ZINC000092136983	334397788	/nfs/dbraw/zinc/39/77/88/334397788.db2.gz	LSHLOFPFTLLKSG-UHFFFAOYSA-N	0	0	280.799	4.481	20	30		CIEDRN
CC(C)(CCC#N)CNC(=O)[C@@H]1CCC[C@@H]2CCCC[C@@H]12	ZINC000553755885	334397797	/nfs/dbraw/zinc/39/77/97/334397797.db2.gz	MXHZXOCJYOGCQA-ARFHVFGLSA-N	0	0	290.451	4.039	20	30		CIEDRN
C=C(C)CN(CC)c1nc(C)nc2sc(C)c(C)c21	ZINC000498826616	332573868	/nfs/dbraw/zinc/57/38/68/332573868.db2.gz	IGWLQFBPJHYUGE-UHFFFAOYSA-N	0	0	275.421	4.019	20	30		CIEDRN
N#CCC[C@@H](C#N)CNc1ccc2c(c1)Cc1ccccc1-2	ZINC000554538195	334436481	/nfs/dbraw/zinc/43/64/81/334436481.db2.gz	UYSUNLAVLHPFHY-AWEZNQCLSA-N	0	0	287.366	4.113	20	30		CIEDRN
C=C(C)CN(CC)C(=O)C(C)(C)c1cccc(Cl)c1F	ZINC000499183766	332581850	/nfs/dbraw/zinc/58/18/50/332581850.db2.gz	OGQUXQDUDZUTHN-UHFFFAOYSA-N	0	0	297.801	4.181	20	30		CIEDRN
CCC[C@@H](C)CC(=O)Nc1sc(C)c(C)c1C#N	ZINC000499307645	332583997	/nfs/dbraw/zinc/58/39/97/332583997.db2.gz	MYUCQVKSRTXHTD-SECBINFHSA-N	0	0	264.394	4.001	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1ccc(F)c(SC)c1	ZINC000499398669	332585257	/nfs/dbraw/zinc/58/52/57/332585257.db2.gz	BYEUMPNDTAWLHH-UHFFFAOYSA-N	0	0	295.423	4.366	20	30		CIEDRN
C=CCN(Cc1ccc(OC)cc1)C(=O)C[C@@H](C)CCC	ZINC000499435617	332585713	/nfs/dbraw/zinc/58/57/13/332585713.db2.gz	LPZBQDAAHWSVSX-HNNXBMFYSA-N	0	0	289.419	4.036	20	30		CIEDRN
CC(C)(C)c1ccc(C(=O)N[C@](C)(C#N)C(C)(C)C)cc1	ZINC000499486343	332586632	/nfs/dbraw/zinc/58/66/32/332586632.db2.gz	HWOGQWIVMOVCPH-GOSISDBHSA-N	0	0	286.419	4.042	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1ccc(F)cc1OC(C)(C)C	ZINC000500084374	332598868	/nfs/dbraw/zinc/59/88/68/332598868.db2.gz	UQHQFPLZYNQKJV-LLVKDONJSA-N	0	0	294.370	4.089	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1cc(Cl)ccc1Cl	ZINC000500117549	332599926	/nfs/dbraw/zinc/59/99/26/332599926.db2.gz	QVRWPGCYMUVZLT-SNVBAGLBSA-N	0	0	287.190	4.470	20	30		CIEDRN
CC[C@H]1C[C@]1(NCc1ccccc1C#N)c1cccc(C)c1	ZINC000500503559	332611642	/nfs/dbraw/zinc/61/16/42/332611642.db2.gz	OPINCTXHGOBCFS-AZUAARDMSA-N	0	0	290.410	4.282	20	30		CIEDRN
C=CCSCc1ccc(F)c(Br)c1	ZINC000308173012	332612973	/nfs/dbraw/zinc/61/29/73/332612973.db2.gz	DHHLCGFATCJBQA-UHFFFAOYSA-N	0	0	261.159	4.007	20	30		CIEDRN
Cc1c(C#N)cccc1NCc1cccc(OC(F)F)c1	ZINC000500753788	332617783	/nfs/dbraw/zinc/61/77/83/332617783.db2.gz	VHDCNDUPPLGVJR-UHFFFAOYSA-N	0	0	288.297	4.080	20	30		CIEDRN
C=CCCCCNC(=O)c1cc(Cl)c(F)cc1Cl	ZINC000500771373	332618350	/nfs/dbraw/zinc/61/83/50/332618350.db2.gz	NVKOPBAPRDDDNH-UHFFFAOYSA-N	0	0	290.165	4.219	20	30		CIEDRN
N#CC1(CN(CCc2ccccc2)c2ccccc2)CC1	ZINC000501550595	332635455	/nfs/dbraw/zinc/63/54/55/332635455.db2.gz	QWQVRKPPSJTVHM-UHFFFAOYSA-N	0	0	276.383	4.039	20	30		CIEDRN
C=CCCc1ccccc1NCc1c(CC)nn(C)c1CC	ZINC000502323936	332653834	/nfs/dbraw/zinc/65/38/34/332653834.db2.gz	ZJZDUHUYPSJPTN-UHFFFAOYSA-N	0	0	297.446	4.276	20	30		CIEDRN
CC[C@H](C)[C@H](C)C(=O)N(CC(C)C)c1ccc(C#N)cc1	ZINC000502752045	332672385	/nfs/dbraw/zinc/67/23/85/332672385.db2.gz	YHBYLWGALITMRU-GJZGRUSLSA-N	0	0	286.419	4.229	20	30		CIEDRN
C=C(C)CN(CC)C(=O)[C@H]1C[C@@H]1c1cccc2ccccc21	ZINC000503097886	332681408	/nfs/dbraw/zinc/68/14/08/332681408.db2.gz	HAGBMYPSAKMTMQ-MOPGFXCFSA-N	0	0	293.410	4.368	20	30		CIEDRN
CCc1cccc(CC)c1-n1ccnc1S[C@@H](C)C#N	ZINC000503253941	332684605	/nfs/dbraw/zinc/68/46/05/332684605.db2.gz	LBCPRCGNQDYXIC-LBPRGKRZSA-N	0	0	285.416	4.001	20	30		CIEDRN
CC(C)(C)c1cc(NC(=O)c2ccccc2)c(C#N)s1	ZINC000154273985	334691916	/nfs/dbraw/zinc/69/19/16/334691916.db2.gz	KYJAAPNCESDZIJ-UHFFFAOYSA-N	0	0	284.384	4.170	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@H](c1ccccc1)C(C)(C)C	ZINC000503374699	332687765	/nfs/dbraw/zinc/68/77/65/332687765.db2.gz	GXKZQOYCLFQZGO-MRXNPFEDSA-N	0	0	288.435	4.381	20	30		CIEDRN
C[C@H]1CC(C(=O)Nc2ccc(C#N)cc2Cl)C[C@H](C)C1	ZINC000503683398	332695161	/nfs/dbraw/zinc/69/51/61/332695161.db2.gz	WPQZWUSFTBGNKD-GHMZBOCLSA-N	0	0	290.794	4.222	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@H](CC(C)C)c1ccccc1	ZINC000504191816	332705708	/nfs/dbraw/zinc/70/57/08/332705708.db2.gz	RDPBEPWCRIDHBX-QGZVFWFLSA-N	0	0	288.435	4.381	20	30		CIEDRN
C=CCN(C(=O)CCc1ccccc1C)c1ccccc1	ZINC000504377646	332709927	/nfs/dbraw/zinc/70/99/27/332709927.db2.gz	ZFGMIRXSHHXONY-UHFFFAOYSA-N	0	0	279.383	4.147	20	30		CIEDRN
Cc1ccc2oc(SCc3ccc(C#N)cc3F)nc2c1	ZINC000504492891	332713111	/nfs/dbraw/zinc/71/31/11/332713111.db2.gz	LWJTYAOQMVIYIQ-UHFFFAOYSA-N	0	0	298.342	4.439	20	30		CIEDRN
Cc1cc(/C=C\c2ccncc2C#N)ccc1Br	ZINC000504711140	332719245	/nfs/dbraw/zinc/71/92/45/332719245.db2.gz	GXANEAHDONOCQK-RQOWECAXSA-N	0	0	299.171	4.195	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N(C)[C@@H]1CC[C@@H](C)C1	ZINC000505028211	332728388	/nfs/dbraw/zinc/72/83/88/332728388.db2.gz	AALXUBLSGGQMBE-GDBMZVCRSA-N	0	0	286.419	4.458	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1C[C@@H](C)C[C@@H]1C	ZINC000505034860	332728673	/nfs/dbraw/zinc/72/86/73/332728673.db2.gz	HZCDCQZJXIUJRS-KBPBESRZSA-N	0	0	272.392	4.067	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CCCCCC1	ZINC000505050617	332729429	/nfs/dbraw/zinc/72/94/29/332729429.db2.gz	DOOWYXQBLYPERB-UHFFFAOYSA-N	0	0	272.392	4.213	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N[C@@H]1CC[C@@H](C)C1	ZINC000505062077	332729544	/nfs/dbraw/zinc/72/95/44/332729544.db2.gz	PHFVIRCYZNNUIS-UKRRQHHQSA-N	0	0	272.392	4.115	20	30		CIEDRN
CC(C)(C)CCNC(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000505447187	332740846	/nfs/dbraw/zinc/74/08/46/332740846.db2.gz	CZEWNPJFTPKTOD-UHFFFAOYSA-N	0	0	287.407	4.045	20	30		CIEDRN
CC(C)(C)CCCC(=O)N[C@@H](C#N)c1ccc(Cl)cc1	ZINC000505815855	332753262	/nfs/dbraw/zinc/75/32/62/332753262.db2.gz	QVPPYZCXZHWBAK-AWEZNQCLSA-N	0	0	292.810	4.237	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](C#N)c1ccc(C(C)(C)C)cc1	ZINC000505822041	332753514	/nfs/dbraw/zinc/75/35/14/332753514.db2.gz	URPANNFQWVTPNH-INIZCTEOSA-N	0	0	284.403	4.021	20	30		CIEDRN
CCCC[C@H](CC)CC(=O)N[C@@H](C#N)c1ccccc1F	ZINC000505923648	332758013	/nfs/dbraw/zinc/75/80/13/332758013.db2.gz	WWDKHKOVOYCTRN-BBRMVZONSA-N	0	0	290.382	4.113	20	30		CIEDRN
C=CCCC(=O)N[C@@H](C)c1ccc(F)c2ccccc21	ZINC000572514311	332759523	/nfs/dbraw/zinc/75/95/23/332759523.db2.gz	JTMJZYKEZSAYKI-LBPRGKRZSA-N	0	0	271.335	4.122	20	30		CIEDRN
C=C(C)COc1cccc(NCc2ccc(CC)nc2)c1	ZINC000512021582	332950764	/nfs/dbraw/zinc/95/07/64/332950764.db2.gz	DNAWAHQBDPWSPQ-UHFFFAOYSA-N	0	0	282.387	4.211	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1cc(F)c2ccccc2c1	ZINC000512099135	332953675	/nfs/dbraw/zinc/95/36/75/332953675.db2.gz	MKZAKTMZEJDIRL-AWEZNQCLSA-N	0	0	271.335	4.063	20	30		CIEDRN
Cc1ccc(F)c(N[C@@H](C)c2ccc(C#N)cc2F)c1	ZINC000512282090	332961061	/nfs/dbraw/zinc/96/10/61/332961061.db2.gz	TYANNPYFYNQEPO-NSHDSACASA-N	0	0	272.298	4.318	20	30		CIEDRN
C[C@H](Nc1ccc(F)c(F)c1)c1ccc(C#N)cc1F	ZINC000512284294	332961521	/nfs/dbraw/zinc/96/15/21/332961521.db2.gz	XADOEJZKJIGYIW-VIFPVBQESA-N	0	0	276.261	4.149	20	30		CIEDRN
Cc1cscc1N[C@H](C)c1ccc(C#N)cc1F	ZINC000512289557	332961539	/nfs/dbraw/zinc/96/15/39/332961539.db2.gz	SYCZNBSOMJRSLG-SNVBAGLBSA-N	0	0	260.337	4.240	20	30		CIEDRN
C=CC[C@H](C)NC(=O)C1CCC(c2ccccc2)CC1	ZINC000173538154	332973735	/nfs/dbraw/zinc/97/37/35/332973735.db2.gz	VLMMWOQNMIWJJU-OOHWJJMZSA-N	0	0	271.404	4.041	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)Nc1cccc(Nc2ccccc2)c1	ZINC000512687538	332980379	/nfs/dbraw/zinc/98/03/79/332980379.db2.gz	TVDWISRPQQSFBS-SFHVURJKSA-N	0	0	293.370	4.309	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1oc(CCC)nc1C	ZINC000512777904	332985197	/nfs/dbraw/zinc/98/51/97/332985197.db2.gz	ARZPIVGYSFWFCY-UHFFFAOYSA-N	0	0	298.386	4.306	20	30		CIEDRN
C[C@@H](CCC(C)(C)C)NC(=O)c1cc(C#N)ccc1Cl	ZINC000512783750	332985780	/nfs/dbraw/zinc/98/57/80/332985780.db2.gz	REZVHTPKNRRIGT-NSHDSACASA-N	0	0	292.810	4.156	20	30		CIEDRN
Cc1ccc(C)c(CSCCCSCC#N)c1	ZINC000174017987	332989079	/nfs/dbraw/zinc/98/90/79/332989079.db2.gz	NCMIWACJUPZFRU-UHFFFAOYSA-N	0	0	265.447	4.184	20	30		CIEDRN
C=CCOc1ccc(CNc2cccc(CC)c2)cc1OC	ZINC000512928763	332994329	/nfs/dbraw/zinc/99/43/29/332994329.db2.gz	KSSVMLZVSUQWRN-UHFFFAOYSA-N	0	0	297.398	4.435	20	30		CIEDRN
CCC(CC)N(CC(C)C)C(=O)NCC(C)(C)CCC#N	ZINC000513129875	333005686	/nfs/dbraw/zinc/00/56/86/333005686.db2.gz	NXQDVXSSOIITFY-UHFFFAOYSA-N	0	0	295.471	4.173	20	30		CIEDRN
N#Cc1cc(F)ccc1N[C@@H](c1ccccc1)[C@H]1CCCO1	ZINC000174721842	333006260	/nfs/dbraw/zinc/00/62/60/333006260.db2.gz	GMINFCRXAXAGOK-MSOLQXFVSA-N	0	0	296.345	4.030	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1sccc1Cl	ZINC000513280954	333012164	/nfs/dbraw/zinc/01/21/64/333012164.db2.gz	IDESFNMRDNSVSK-UHFFFAOYSA-N	0	0	271.813	4.220	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](C)c1ccc(OC(C)C)cc1	ZINC000175241274	333018428	/nfs/dbraw/zinc/01/84/28/333018428.db2.gz	NFIJCVFDRXWFLF-AWEZNQCLSA-N	0	0	275.392	4.007	20	30		CIEDRN
C=CCCCC(=O)N(Cc1ccc([C@@H]2C[C@H]2C)o1)C1CC1	ZINC000175276014	333019504	/nfs/dbraw/zinc/01/95/04/333019504.db2.gz	ZDDGNTXNUCLKIL-CZUORRHYSA-N	0	0	287.403	4.250	20	30		CIEDRN
C=CCCCC(=O)N[C@H](C)c1oc2ccccc2c1C	ZINC000175356862	333022737	/nfs/dbraw/zinc/02/27/37/333022737.db2.gz	JNKNLMHXJZVXPE-CYBMUJFWSA-N	0	0	271.360	4.275	20	30		CIEDRN
N#Cc1ccc(CSc2ccc(F)c(F)c2)cc1F	ZINC000404733298	333024888	/nfs/dbraw/zinc/02/48/88/333024888.db2.gz	DEWLKKRQNBPGQE-UHFFFAOYSA-N	0	0	279.286	4.268	20	30		CIEDRN
Cc1cccc(SCc2ccc(C#N)c(F)c2)c1	ZINC000404764153	333025711	/nfs/dbraw/zinc/02/57/11/333025711.db2.gz	UNVBTFGQSYLALT-UHFFFAOYSA-N	0	0	257.333	4.298	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(Oc2ccncc2)cc1	ZINC000175484771	333025718	/nfs/dbraw/zinc/02/57/18/333025718.db2.gz	QVXPCUJRMFCWOY-UHFFFAOYSA-N	0	0	282.343	4.169	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@H](c2ccccc2)CC1	ZINC000175538231	333026477	/nfs/dbraw/zinc/02/64/77/333026477.db2.gz	NXLXSRJFUARYNE-KRWDZBQOSA-N	0	0	271.404	4.139	20	30		CIEDRN
CSc1ccc(Oc2ncc(C#N)cc2Cl)cc1	ZINC000513624446	333027227	/nfs/dbraw/zinc/02/72/27/333027227.db2.gz	KPQNQOHZVRBESC-UHFFFAOYSA-N	0	0	276.748	4.121	20	30		CIEDRN
CC(C)[C@H](Nc1ncc(C#N)cc1Cl)c1ccccc1	ZINC000513621684	333027309	/nfs/dbraw/zinc/02/73/09/333027309.db2.gz	YFBLSYBCAJQQRX-HNNXBMFYSA-N	0	0	285.778	4.416	20	30		CIEDRN
N#Cc1cnc(Sc2ccc(Cl)cc2)c(Cl)c1	ZINC000513620895	333027375	/nfs/dbraw/zinc/02/73/75/333027375.db2.gz	UULNQJPSABVCLY-UHFFFAOYSA-N	0	0	281.167	4.411	20	30		CIEDRN
Cc1ccc(Oc2ncc(C#N)cc2Cl)cc1C	ZINC000513636374	333028117	/nfs/dbraw/zinc/02/81/17/333028117.db2.gz	ZFXZWCFRLIVTER-UHFFFAOYSA-N	0	0	258.708	4.016	20	30		CIEDRN
Cc1ccc([C@H](C)N(C)c2ncc(C#N)cc2Cl)cc1	ZINC000513645888	333028932	/nfs/dbraw/zinc/02/89/32/333028932.db2.gz	QZHZSPJFSNSSRU-LBPRGKRZSA-N	0	0	285.778	4.113	20	30		CIEDRN
Cc1cccc(Sc2ncc(C#N)cc2Cl)c1	ZINC000513650471	333029072	/nfs/dbraw/zinc/02/90/72/333029072.db2.gz	NPGYUBQHFLEAAZ-UHFFFAOYSA-N	0	0	260.749	4.066	20	30		CIEDRN
C=CCCCC(=O)N1C[C@H](c2ccccc2C)C[C@H]1C	ZINC000175725671	333030915	/nfs/dbraw/zinc/03/09/15/333030915.db2.gz	FILTYLXSXPUZIE-HZPDHXFCSA-N	0	0	271.404	4.056	20	30		CIEDRN
C=CCCCC(=O)N1C[C@@H](c2ccccc2C)C[C@@H]1C	ZINC000175725657	333031094	/nfs/dbraw/zinc/03/10/94/333031094.db2.gz	FILTYLXSXPUZIE-HOTGVXAUSA-N	0	0	271.404	4.056	20	30		CIEDRN
CCCCc1ccc(NC(=O)N(C[C@@H](C)C#N)C2CC2)cc1	ZINC000513677513	333031669	/nfs/dbraw/zinc/03/16/69/333031669.db2.gz	XTVXAMAQPYZPDY-AWEZNQCLSA-N	0	0	299.418	4.185	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@H]1c1cccc(C)c1C	ZINC000175763276	333032113	/nfs/dbraw/zinc/03/21/13/333032113.db2.gz	CSDCZMQARNWAAS-KRWDZBQOSA-N	0	0	271.404	4.323	20	30		CIEDRN
CC(C)CCN(CCC#N)Cc1cccc(Cl)c1	ZINC000513714147	333034828	/nfs/dbraw/zinc/03/48/28/333034828.db2.gz	YYUHQWBZKMDBAG-UHFFFAOYSA-N	0	0	264.800	4.102	20	30		CIEDRN
CCC(CC)CN(CCC#N)Cc1ccc(F)c(F)c1	ZINC000513717493	333035214	/nfs/dbraw/zinc/03/52/14/333035214.db2.gz	PHOHZCHPNPWYNV-UHFFFAOYSA-N	0	0	280.362	4.117	20	30		CIEDRN
COc1ccc(CN(CCC#N)CC(C)(C)C)c(Cl)c1	ZINC000513730145	333036053	/nfs/dbraw/zinc/03/60/53/333036053.db2.gz	WIQOGCGYYSETCR-UHFFFAOYSA-N	0	0	294.826	4.110	20	30		CIEDRN
Cc1ccccc1[C@@H](Nc1ncc(C#N)cc1Cl)C1CC1	ZINC000513740069	333036768	/nfs/dbraw/zinc/03/67/68/333036768.db2.gz	QKXLLBYTHRABAD-INIZCTEOSA-N	0	0	297.789	4.478	20	30		CIEDRN
Cc1ccc([C@H]2CCCN2c2nc(C)cc(C)c2C#N)s1	ZINC000513748993	333037405	/nfs/dbraw/zinc/03/74/05/333037405.db2.gz	MRLMEXHALQPUGK-OAHLLOKOSA-N	0	0	297.427	4.282	20	30		CIEDRN
CC(C)(C)CN(CCC#N)Cc1ccc(F)c(Cl)c1	ZINC000513750632	333037593	/nfs/dbraw/zinc/03/75/93/333037593.db2.gz	LONVRSFSKZUREF-UHFFFAOYSA-N	0	0	282.790	4.241	20	30		CIEDRN
C=CCN(CC=C)C(=O)Nc1ccc(SC)c(Cl)c1	ZINC000176112256	333039408	/nfs/dbraw/zinc/03/94/08/333039408.db2.gz	LLLQGARSCLQVET-UHFFFAOYSA-N	0	0	296.823	4.268	20	30		CIEDRN
C=CCOc1cccc(-c2nc3cc(F)c(F)cc3[nH]2)c1	ZINC000513861037	333044086	/nfs/dbraw/zinc/04/40/86/333044086.db2.gz	FLHZPSYYMMRRSA-UHFFFAOYSA-N	0	0	286.281	4.073	20	30		CIEDRN
CCN(C[C@@H](C)C#N)C(c1ccccc1)c1ccccc1	ZINC000513898147	333048306	/nfs/dbraw/zinc/04/83/06/333048306.db2.gz	GFWPGYQBXQVJIT-INIZCTEOSA-N	0	0	278.399	4.258	20	30		CIEDRN
C[C@H](Sc1cccc(C#N)c1)C(=O)c1ccc(F)cc1	ZINC000177109362	333053713	/nfs/dbraw/zinc/05/37/13/333053713.db2.gz	JHHBKERUNXRCND-NSHDSACASA-N	0	0	285.343	4.061	20	30		CIEDRN
C[C@@H](C#N)CN(C)Cc1sc2ccccc2c1Cl	ZINC000513961313	333055155	/nfs/dbraw/zinc/05/51/55/333055155.db2.gz	AKYKCDCTVJLEMH-JTQLQIEISA-N	0	0	278.808	4.146	20	30		CIEDRN
CC(C)CC[C@@H]1CCCCN1C(=O)c1cc(C#N)cs1	ZINC000177499750	333059608	/nfs/dbraw/zinc/05/96/08/333059608.db2.gz	NRBUTNYYYRCJSF-AWEZNQCLSA-N	0	0	290.432	4.051	20	30		CIEDRN
C=CCCCC(=O)N(C)c1cccc2ccccc21	ZINC000177757963	333062668	/nfs/dbraw/zinc/06/26/68/333062668.db2.gz	ZXQRXIYGCNWGDG-UHFFFAOYSA-N	0	0	253.345	4.159	20	30		CIEDRN
C=CCCCC(=O)N(Cc1ccccc1)[C@H](C)CC	ZINC000177824858	333063542	/nfs/dbraw/zinc/06/35/42/333063542.db2.gz	QBNKXDWNRPISJT-OAHLLOKOSA-N	0	0	259.393	4.170	20	30		CIEDRN
C=CCCCC(=O)N(Cc1ccccc1)[C@@H](C)CC	ZINC000177824871	333063602	/nfs/dbraw/zinc/06/36/02/333063602.db2.gz	QBNKXDWNRPISJT-HNNXBMFYSA-N	0	0	259.393	4.170	20	30		CIEDRN
C=CCCCC(=O)N(C)[C@@H](c1ccccc1)C(C)C	ZINC000177847482	333063922	/nfs/dbraw/zinc/06/39/22/333063922.db2.gz	ZCUDGAVXQRPKFO-QGZVFWFLSA-N	0	0	259.393	4.198	20	30		CIEDRN
C=C(C)CS[C@@H](C)C(=O)Nc1cc(Cl)ccc1F	ZINC000177867113	333064573	/nfs/dbraw/zinc/06/45/73/333064573.db2.gz	MRTNPYAGLVYIFC-VIFPVBQESA-N	0	0	287.787	4.115	20	30		CIEDRN
CO[C@H](C)c1cccc(NCc2cc(C#N)ccc2F)c1	ZINC000178360866	333071577	/nfs/dbraw/zinc/07/15/77/333071577.db2.gz	QRESYXXAGFUPJV-GFCCVEGCSA-N	0	0	284.334	4.017	20	30		CIEDRN
CCc1cc(C)c(C(=O)Nc2ccc(C(C)(C)C#N)cc2)o1	ZINC000178480360	333073664	/nfs/dbraw/zinc/07/36/64/333073664.db2.gz	HFKJVZBSRORRME-UHFFFAOYSA-N	0	0	296.370	4.204	20	30		CIEDRN
N#Cc1ccc(Cl)cc1OCCCCC1CCOCC1	ZINC000312242150	333078909	/nfs/dbraw/zinc/07/89/09/333078909.db2.gz	QJYSLTYKULHUAB-UHFFFAOYSA-N	0	0	293.794	4.187	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2cc(F)ccc2C)no1	ZINC000516681201	333080515	/nfs/dbraw/zinc/08/05/15/333080515.db2.gz	HKBSFNPLOHZIIH-LLVKDONJSA-N	0	0	260.312	4.254	20	30		CIEDRN
C[C@@H]1CCCC[C@@H]1OCCSc1ccc(C#N)cc1	ZINC000516788001	333082524	/nfs/dbraw/zinc/08/25/24/333082524.db2.gz	WUILLUCYMRTQEC-CJNGLKHVSA-N	0	0	275.417	4.246	20	30		CIEDRN
N#Cc1ncccc1N[C@@H](c1ccc(Cl)cc1)C1CC1	ZINC000516823797	333083378	/nfs/dbraw/zinc/08/33/78/333083378.db2.gz	CYRXSTVDAXCDND-MRXNPFEDSA-N	0	0	283.762	4.170	20	30		CIEDRN
CC1(CC(=O)Nc2ccc(Cl)c(C#N)c2)CCCC1	ZINC000516991203	333088846	/nfs/dbraw/zinc/08/88/46/333088846.db2.gz	QLCHHAYWEIOCDZ-UHFFFAOYSA-N	0	0	276.767	4.121	20	30		CIEDRN
C=CCc1ccc(OCc2nc(C)c(C)s2)c(OC)c1	ZINC000088509535	333089557	/nfs/dbraw/zinc/08/95/57/333089557.db2.gz	ULEGVBOVQHLFRF-UHFFFAOYSA-N	0	0	289.400	4.076	20	30		CIEDRN
C=C1CCN(C(=O)C[C@@H]2C[C@H](C)CC(C)(C)C2)CC1	ZINC000517454644	333099850	/nfs/dbraw/zinc/09/98/50/333099850.db2.gz	GKTXBRABUJUYKX-GJZGRUSLSA-N	0	0	263.425	4.018	20	30		CIEDRN
C=CCn1c(S[C@@H]2C=CCCC2)nnc1-c1ccccc1	ZINC000517475516	333100322	/nfs/dbraw/zinc/10/03/22/333100322.db2.gz	HGGLHKQTICLSJI-OAHLLOKOSA-N	0	0	297.427	4.332	20	30		CIEDRN
C=CCn1c(S[C@H]2C=CCCC2)nnc1-c1ccccc1	ZINC000517475515	333100423	/nfs/dbraw/zinc/10/04/23/333100423.db2.gz	HGGLHKQTICLSJI-HNNXBMFYSA-N	0	0	297.427	4.332	20	30		CIEDRN
CC(C)=CCC[C@H](C)CC(=O)N(CC#N)C1CCCC1	ZINC000517571101	333102783	/nfs/dbraw/zinc/10/27/83/333102783.db2.gz	WQROIYVRZHKRJB-HNNXBMFYSA-N	0	0	276.424	4.054	20	30		CIEDRN
CCCC1CCC(NC(=O)Nc2cccc(C#N)c2)CC1	ZINC000517708092	333106251	/nfs/dbraw/zinc/10/62/51/333106251.db2.gz	BVPULHLEUCJSAD-UHFFFAOYSA-N	0	0	285.391	4.039	20	30		CIEDRN
CC(C)c1ccc(CNC(=O)Nc2cccc(C#N)c2)cc1	ZINC000517706455	333106387	/nfs/dbraw/zinc/10/63/87/333106387.db2.gz	NITNMJUXOAOQGK-UHFFFAOYSA-N	0	0	293.370	4.003	20	30		CIEDRN
N#CCc1cccc(-c2nc(-c3ccc(Cl)cc3)no2)c1	ZINC000521025351	333109916	/nfs/dbraw/zinc/10/99/16/333109916.db2.gz	DVKLSSTXSVRTLZ-UHFFFAOYSA-N	0	0	295.729	4.123	20	30		CIEDRN
N#Cc1cc([N+](=O)[O-])ccc1SCCCc1ccccc1	ZINC000521109379	333111682	/nfs/dbraw/zinc/11/16/82/333111682.db2.gz	PQSIMBIWIQJMFB-UHFFFAOYSA-N	0	0	298.367	4.191	20	30		CIEDRN
C=CC1CCN(C(=O)N[C@H](CCC)c2ccccc2)CC1	ZINC000521173917	333113676	/nfs/dbraw/zinc/11/36/76/333113676.db2.gz	MLKYXXYOZXLMEU-QGZVFWFLSA-N	0	0	286.419	4.135	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1ccccc1Nc1ccccc1	ZINC000183053398	333118780	/nfs/dbraw/zinc/11/87/80/333118780.db2.gz	FTXDVWIABQBUAS-UHFFFAOYSA-N	0	0	280.371	4.078	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1[nH]c2ccc(Cl)cc2c1Cl	ZINC000183046998	333118938	/nfs/dbraw/zinc/11/89/38/333118938.db2.gz	GJQYEKPCKGAASI-UHFFFAOYSA-N	0	0	297.185	4.123	20	30		CIEDRN
CC[C@H](CC1CCCCC1)C(=O)NCc1cccc(C#N)c1	ZINC000217193712	333119527	/nfs/dbraw/zinc/11/95/27/333119527.db2.gz	KETXQUXQVWPEKZ-GOSISDBHSA-N	0	0	298.430	4.171	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc2[nH]c(C)cc2c1	ZINC000184232141	333125881	/nfs/dbraw/zinc/12/58/81/333125881.db2.gz	DGAIKOFKTJJIPR-NSHDSACASA-N	0	0	256.349	4.017	20	30		CIEDRN
C[C@@H](SC[C@@H]1CCC(C)(C)O1)c1ccc(C#N)cc1	ZINC000184824426	333132480	/nfs/dbraw/zinc/13/24/80/333132480.db2.gz	OXLKINVQMHGDAM-DOMZBBRYSA-N	0	0	275.417	4.310	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccccc1N1CCCCC1	ZINC000184887390	333133036	/nfs/dbraw/zinc/13/30/36/333133036.db2.gz	DOVWKKFVFXVYTR-OAHLLOKOSA-N	0	0	286.419	4.218	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(Cl)ccc1C	ZINC000184896223	333133067	/nfs/dbraw/zinc/13/30/67/333133067.db2.gz	OYJVVDOOKGEDEK-NSHDSACASA-N	0	0	251.757	4.189	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](C)c1ccccc1Cl	ZINC000184907282	333133261	/nfs/dbraw/zinc/13/32/61/333133261.db2.gz	HVKXNWWPDVIUKC-VXGBXAGGSA-N	0	0	265.784	4.120	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](C)c1cc2ccccc2o1	ZINC000184920455	333133313	/nfs/dbraw/zinc/13/33/13/333133313.db2.gz	NEUVXHZCHBPWOR-QWHCGFSZSA-N	0	0	271.360	4.212	20	30		CIEDRN
CC#CCCCC(=O)N[C@H](C)c1cccc2ccccc21	ZINC000184913262	333133321	/nfs/dbraw/zinc/13/33/21/333133321.db2.gz	SGBIPCSCQMXDLK-OAHLLOKOSA-N	0	0	279.383	4.211	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000184910514	333133338	/nfs/dbraw/zinc/13/33/38/333133338.db2.gz	BANZUERUARKJRD-NWDGAFQWSA-N	0	0	299.336	4.485	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1c(C)cccc1SC	ZINC000184941138	333133408	/nfs/dbraw/zinc/13/34/08/333133408.db2.gz	FCSFGHPVJKLQPO-UHFFFAOYSA-N	0	0	278.421	4.147	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCc1c(OC)ccc2ccccc21	ZINC000184976498	333133990	/nfs/dbraw/zinc/13/39/90/333133990.db2.gz	WSHCSJJFNKQMPP-AWEZNQCLSA-N	0	0	297.398	4.067	20	30		CIEDRN
CC#CCCCC(=O)N(Cc1ccc([C@@H]2C[C@@H]2C)o1)C1CC1	ZINC000185072219	333135022	/nfs/dbraw/zinc/13/50/22/333135022.db2.gz	KZQBFDPBEKISAU-WMLDXEAASA-N	0	0	299.414	4.088	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000185085849	333135342	/nfs/dbraw/zinc/13/53/42/333135342.db2.gz	HHTYXMOEHNGPFG-NWDGAFQWSA-N	0	0	299.336	4.485	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(C)c2ncccc12	ZINC000185148386	333136189	/nfs/dbraw/zinc/13/61/89/333136189.db2.gz	MHWWUMURTQWCJF-CYBMUJFWSA-N	0	0	268.360	4.084	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCCc1csc2ccccc12	ZINC000185197255	333136595	/nfs/dbraw/zinc/13/65/95/333136595.db2.gz	JAFXVPPJAYUBAV-CYBMUJFWSA-N	0	0	287.428	4.162	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)Cc1cccc(C(F)(F)F)c1	ZINC000185208261	333136762	/nfs/dbraw/zinc/13/67/62/333136762.db2.gz	FSPXEMZVSJYOJS-GFCCVEGCSA-N	0	0	299.336	4.266	20	30		CIEDRN
CC#CCCCC(=O)N(C)Cc1cc(Cl)cc(Cl)c1	ZINC000185209671	333136793	/nfs/dbraw/zinc/13/67/93/333136793.db2.gz	MXCSLBGHMUCORC-UHFFFAOYSA-N	0	0	298.213	4.145	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCc1cccc2ccccc21	ZINC000185218679	333136883	/nfs/dbraw/zinc/13/68/83/333136883.db2.gz	CJVCMRPITOZHMT-CQSZACIVSA-N	0	0	267.372	4.058	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@H](C)c1ccccc1Cl	ZINC000185223698	333136927	/nfs/dbraw/zinc/13/69/27/333136927.db2.gz	FGJXWLQQAVCHDN-CHWSQXEVSA-N	0	0	279.811	4.462	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@H](C)c1ccccc1Cl	ZINC000185223679	333136987	/nfs/dbraw/zinc/13/69/87/333136987.db2.gz	FGJXWLQQAVCHDN-QWHCGFSZSA-N	0	0	279.811	4.462	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H]1CCc2cc(Cl)ccc21	ZINC000185262101	333137704	/nfs/dbraw/zinc/13/77/04/333137704.db2.gz	UISXKSHMKRBBSD-ABAIWWIYSA-N	0	0	277.795	4.046	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H]1CCc2cc(Cl)ccc21	ZINC000185262082	333137707	/nfs/dbraw/zinc/13/77/07/333137707.db2.gz	UISXKSHMKRBBSD-NHYWBVRUSA-N	0	0	277.795	4.046	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CCc2cc(Cl)ccc21	ZINC000185262063	333137727	/nfs/dbraw/zinc/13/77/27/333137727.db2.gz	UISXKSHMKRBBSD-IAQYHMDHSA-N	0	0	277.795	4.046	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cccc(COCC2CC2)c1	ZINC000185275840	333137931	/nfs/dbraw/zinc/13/79/31/333137931.db2.gz	BSAQDVHNQXQQJO-CQSZACIVSA-N	0	0	287.403	4.154	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H](C)CC(C)(C)c1ccccc1	ZINC000185289055	333138274	/nfs/dbraw/zinc/13/82/74/333138274.db2.gz	MVJMAXKYPNTZAB-INIZCTEOSA-N	0	0	285.431	4.053	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@](C)(CCC)C1	ZINC000185729615	333147509	/nfs/dbraw/zinc/14/75/09/333147509.db2.gz	URMQWOIAIZWXJA-ZBFHGGJFSA-N	0	0	251.414	4.018	20	30		CIEDRN
CC#CCCCC(=O)N(C)CCc1cccc2ccccc21	ZINC000185387042	333139926	/nfs/dbraw/zinc/13/99/26/333139926.db2.gz	OVJZYDJRVGGLJV-UHFFFAOYSA-N	0	0	293.410	4.034	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cccc(Br)c1C	ZINC000185421125	333140345	/nfs/dbraw/zinc/14/03/45/333140345.db2.gz	CCYITVXRNPGEQN-SNVBAGLBSA-N	0	0	296.208	4.298	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(CCSC)cc1	ZINC000185442245	333140792	/nfs/dbraw/zinc/14/07/92/333140792.db2.gz	MCQHMSTZDIKPPN-CYBMUJFWSA-N	0	0	277.433	4.133	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H](C)c1cc2ccccc2s1	ZINC000185500325	333142033	/nfs/dbraw/zinc/14/20/33/333142033.db2.gz	JGBCUASHIHKCKS-ZDUSSCGKSA-N	0	0	285.412	4.272	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCCC2(CCCCC2)C1	ZINC000185533020	333143071	/nfs/dbraw/zinc/14/30/71/333143071.db2.gz	LGAHOIDZUUGQOI-OAHLLOKOSA-N	0	0	263.425	4.162	20	30		CIEDRN
CCN(C(=O)[C@H](C)CC(C)C)c1ccc(C#N)c(Cl)c1	ZINC000185537951	333143156	/nfs/dbraw/zinc/14/31/56/333143156.db2.gz	BOKYCZBYEOFDJR-GFCCVEGCSA-N	0	0	292.810	4.247	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@](C)(c2ccccc2)C1	ZINC000185557347	333143818	/nfs/dbraw/zinc/14/38/18/333143818.db2.gz	PFNDCHFEBRPJBR-VQIMIIECSA-N	0	0	285.431	4.169	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](C)c1cccc(C)c1C	ZINC000185583349	333144235	/nfs/dbraw/zinc/14/42/35/333144235.db2.gz	MVXSTDXVIVDLPF-ZFWWWQNUSA-N	0	0	259.393	4.083	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(c1ccc(F)cc1)C(C)C	ZINC000185581249	333144330	/nfs/dbraw/zinc/14/43/30/333144330.db2.gz	HWZQAWJYSROCHY-CYBMUJFWSA-N	0	0	263.356	4.169	20	30		CIEDRN
CCC1(C(=O)Nc2ccc(CC#N)cc2)CCCCC1	ZINC000185603783	333144560	/nfs/dbraw/zinc/14/45/60/333144560.db2.gz	KCFLQVKGVQKMLX-UHFFFAOYSA-N	0	0	270.376	4.052	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(F)ccc1OC(C)C	ZINC000185643117	333145706	/nfs/dbraw/zinc/14/57/06/333145706.db2.gz	OXNYTSKJAYBFFS-LBPRGKRZSA-N	0	0	279.355	4.154	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cccc(CC(F)(F)F)c1	ZINC000185709963	333146968	/nfs/dbraw/zinc/14/69/68/333146968.db2.gz	AAZMAEVIUYZSML-NSHDSACASA-N	0	0	285.309	4.332	20	30		CIEDRN
N#CCc1ccccc1NC(=O)c1cc2sccc2s1	ZINC000564160215	333147068	/nfs/dbraw/zinc/14/70/68/333147068.db2.gz	GYFJFGTVRMROIB-UHFFFAOYSA-N	0	0	298.392	4.281	20	30		CIEDRN
CCOc1cc(Cl)ccc1N[C@@H]1CCC[C@@H](C#N)C1	ZINC000185731343	333147481	/nfs/dbraw/zinc/14/74/81/333147481.db2.gz	CBNUGTORXWIMHB-DGCLKSJQSA-N	0	0	278.783	4.233	20	30		CIEDRN
C=C(C)COc1cccc(N[C@@H]2CCC[C@H](C#N)C2)c1	ZINC000185745818	333147904	/nfs/dbraw/zinc/14/79/04/333147904.db2.gz	XPHHBGCATQNEDL-LSDHHAIUSA-N	0	0	270.376	4.136	20	30		CIEDRN
CC(C)(C)Oc1ccccc1N[C@H]1CCC[C@@H](C#N)C1	ZINC000185748371	333147944	/nfs/dbraw/zinc/14/79/44/333147944.db2.gz	RJIDNZNOCOFCTN-KGLIPLIRSA-N	0	0	272.392	4.358	20	30		CIEDRN
C[C@@H](CC(=O)Nc1ccccc1CC#N)C1CCCCC1	ZINC000564160964	333151437	/nfs/dbraw/zinc/15/14/37/333151437.db2.gz	NMSNUVFZCLXVTQ-AWEZNQCLSA-N	0	0	284.403	4.298	20	30		CIEDRN
C[C@H](NCc1cccc(C#N)c1F)c1ccccc1Cl	ZINC000219525847	333151772	/nfs/dbraw/zinc/15/17/72/333151772.db2.gz	GHDLLNPONDWVBM-NSHDSACASA-N	0	0	288.753	4.202	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC(C)(c2ccccc2)CC1	ZINC000185933328	333151978	/nfs/dbraw/zinc/15/19/78/333151978.db2.gz	WJPTYEFVFWTIHY-MRXNPFEDSA-N	0	0	285.431	4.169	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1cc(C)ccc1OC)c1ccccc1	ZINC000186005597	333153294	/nfs/dbraw/zinc/15/32/94/333153294.db2.gz	ZNJHDJGQDXDNMI-MRXNPFEDSA-N	0	0	295.382	4.302	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCCC[C@@H]1CC(C)C	ZINC000186025265	333153507	/nfs/dbraw/zinc/15/35/07/333153507.db2.gz	RGUQDBQPNZXXRN-LSDHHAIUSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](CC(C)(C)C)C(F)(F)F	ZINC000186018913	333153536	/nfs/dbraw/zinc/15/35/36/333153536.db2.gz	AYLXHHPATQDQAJ-MNOVXSKESA-N	0	0	279.346	4.072	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1cc(C)ccc1F)c1ccccc1	ZINC000186038051	333153673	/nfs/dbraw/zinc/15/36/73/333153673.db2.gz	QKSOZYKCQWOSPX-HNNXBMFYSA-N	0	0	283.346	4.433	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cc(C2CCCCC2)nn1C	ZINC000186046558	333154085	/nfs/dbraw/zinc/15/40/85/333154085.db2.gz	NWASGDVDYSLSSM-CYBMUJFWSA-N	0	0	289.423	4.009	20	30		CIEDRN
CC#CCCCC(=O)N(C)c1c(Cl)cccc1Cl	ZINC000186077340	333154550	/nfs/dbraw/zinc/15/45/50/333154550.db2.gz	NELOQYIZIRMNAJ-UHFFFAOYSA-N	0	0	284.186	4.150	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H]1C(C)(C)CC	ZINC000186083518	333154811	/nfs/dbraw/zinc/15/48/11/333154811.db2.gz	LKTYUVNRCKSNNT-UONOGXRCSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ncccc1-c1ccccc1	ZINC000186116372	333155268	/nfs/dbraw/zinc/15/52/68/333155268.db2.gz	XUUJSRLCMXIDAL-CQSZACIVSA-N	0	0	280.371	4.289	20	30		CIEDRN
N#Cc1cccc(CSc2nc3ccccc3o2)c1F	ZINC000219760194	333156435	/nfs/dbraw/zinc/15/64/35/333156435.db2.gz	YPLGAVDYUMGRJE-UHFFFAOYSA-N	0	0	284.315	4.131	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1nc(C)c(C)s1)c1ccccc1	ZINC000186191133	333156496	/nfs/dbraw/zinc/15/64/96/333156496.db2.gz	WXPYJRZRBAOGCL-CQSZACIVSA-N	0	0	286.400	4.058	20	30		CIEDRN
C=CCOc1ccccc1C(=O)N(C)[C@@H](C)c1ccccc1	ZINC000219907723	333159232	/nfs/dbraw/zinc/15/92/32/333159232.db2.gz	SCPVVGYXBUXVFS-HNNXBMFYSA-N	0	0	295.382	4.085	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2ccc3oc(C)c(C)c3c2)CC1	ZINC000186446630	333161130	/nfs/dbraw/zinc/16/11/30/333161130.db2.gz	IJROXBVAKBPGTO-UHFFFAOYSA-N	0	0	298.386	4.480	20	30		CIEDRN
C=CCN(CC=C)C(=O)Nc1ccc2oc(C)c(C)c2c1	ZINC000186451450	333161226	/nfs/dbraw/zinc/16/12/26/333161226.db2.gz	ISDLQPSSMMJRHW-UHFFFAOYSA-N	0	0	284.359	4.256	20	30		CIEDRN
C=C(C)[C@H](N[C@H](C)c1ccccn1)c1ccc(F)c(F)c1	ZINC000186448626	333161249	/nfs/dbraw/zinc/16/12/49/333161249.db2.gz	UFJJFOXYLDSASS-PXAZEXFGSA-N	0	0	288.341	4.328	20	30		CIEDRN
C[C@H](CCC1CC1)Nc1cccc(OCCCC#N)c1	ZINC000186454593	333161468	/nfs/dbraw/zinc/16/14/68/333161468.db2.gz	CULACODMPNVIER-CQSZACIVSA-N	0	0	272.392	4.360	20	30		CIEDRN
CCCN(Cc1ccc(C#N)cc1)C(=O)C[C@@H]1C=CCCC1	ZINC000186524030	333162596	/nfs/dbraw/zinc/16/25/96/333162596.db2.gz	OZNZEUODKLJRAC-MRXNPFEDSA-N	0	0	296.414	4.043	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1ccc(F)cc1OC)c1ccccc1	ZINC000186582094	333163328	/nfs/dbraw/zinc/16/33/28/333163328.db2.gz	FGNFFDNMDQJWHQ-OAHLLOKOSA-N	0	0	299.345	4.133	20	30		CIEDRN
CC(C)c1cccc(N(C)C(=O)c2cccc(F)c2C#N)c1	ZINC000187113463	333167833	/nfs/dbraw/zinc/16/78/33/333167833.db2.gz	FLEKOEFBYPOXAX-UHFFFAOYSA-N	0	0	296.345	4.097	20	30		CIEDRN
Cc1coc2ccc(NC(=O)c3ccc(C#N)cc3C)cc12	ZINC000187310397	333169251	/nfs/dbraw/zinc/16/92/51/333169251.db2.gz	OUKSLUUXNDAHPL-UHFFFAOYSA-N	0	0	290.322	4.174	20	30		CIEDRN
C=C(C)[C@@H](NCc1cccc(O)c1)c1ccc(F)c(F)c1	ZINC000187371502	333169690	/nfs/dbraw/zinc/16/96/90/333169690.db2.gz	HYVSGEQNZQCMQT-QGZVFWFLSA-N	0	0	289.325	4.077	20	30		CIEDRN
CC[C@@H](CN(CC)C(=O)C1(C#N)CCCC1)c1ccccc1	ZINC000187405336	333170646	/nfs/dbraw/zinc/17/06/46/333170646.db2.gz	RFTRIIDTNCELCK-INIZCTEOSA-N	0	0	298.430	4.113	20	30		CIEDRN
N#Cc1ccc(OCc2ccc(F)c(F)c2)cc1Cl	ZINC000220981229	333171643	/nfs/dbraw/zinc/17/16/43/333171643.db2.gz	ZXQZPZCDLQVVAN-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
CCc1sc(C(=O)N(CCC#N)C(C)(C)CC)cc1C	ZINC000187516141	333172176	/nfs/dbraw/zinc/17/21/76/333172176.db2.gz	QDNPBHUYPUBRMC-UHFFFAOYSA-N	0	0	292.448	4.163	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC)Cc1c[nH]c2ccccc12	ZINC000188903888	333175671	/nfs/dbraw/zinc/17/56/71/333175671.db2.gz	KJIUGJZQIZAKMK-AWEZNQCLSA-N	0	0	284.403	4.119	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1cc(F)ccc1OC)c1ccccc1	ZINC000188929654	333176376	/nfs/dbraw/zinc/17/63/76/333176376.db2.gz	HPBDISZMZCLHFQ-HNNXBMFYSA-N	0	0	299.345	4.133	20	30		CIEDRN
CCc1nc(C)c(CSc2ccc(C#N)c(C)c2)o1	ZINC000521625347	333180174	/nfs/dbraw/zinc/18/01/74/333180174.db2.gz	VFSOXXNVUTXEKV-UHFFFAOYSA-N	0	0	272.373	4.018	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@H](c3ccccc3)[C@@H]2C)CCC1	ZINC000189102559	333181152	/nfs/dbraw/zinc/18/11/52/333181152.db2.gz	ARPQQJKPAYMUAU-RDJZCZTQSA-N	0	0	283.415	4.137	20	30		CIEDRN
C=CCCCS[C@H](C)C(=O)N[C@@H](C)c1ccccc1C	ZINC000564166519	333181720	/nfs/dbraw/zinc/18/17/20/333181720.db2.gz	UVXBGQPOTIDODA-LSDHHAIUSA-N	0	0	291.460	4.260	20	30		CIEDRN
C=CCCCC(=O)NC[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000189138956	333182066	/nfs/dbraw/zinc/18/20/66/333182066.db2.gz	ZZBCVQZKLSGXLP-GFCCVEGCSA-N	0	0	299.336	4.281	20	30		CIEDRN
Cc1cccc2cc(C(=O)Nc3ccc(C#N)cc3)sc21	ZINC000521664598	333183107	/nfs/dbraw/zinc/18/31/07/333183107.db2.gz	UCCOBQKIOVBERH-UHFFFAOYSA-N	0	0	292.363	4.334	20	30		CIEDRN
C=C(C)CCc1noc(-c2ccccc2N2CCCCC2)n1	ZINC000521685758	333183914	/nfs/dbraw/zinc/18/39/14/333183914.db2.gz	KVPLQQSDLKXELP-UHFFFAOYSA-N	0	0	297.402	4.236	20	30		CIEDRN
CCCN(c1ccc(C#N)cn1)[C@@H](CC)c1ccccc1	ZINC000521763972	333187117	/nfs/dbraw/zinc/18/71/17/333187117.db2.gz	PMNHXUMLQPVYMY-KRWDZBQOSA-N	0	0	279.387	4.321	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1cccc(F)c1)c1ccccc1	ZINC000189381420	333191518	/nfs/dbraw/zinc/19/15/18/333191518.db2.gz	BDMJNZCQVMQELW-INIZCTEOSA-N	0	0	269.319	4.124	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1ccc(F)c(OC)c1)c1ccccc1	ZINC000189423264	333192440	/nfs/dbraw/zinc/19/24/40/333192440.db2.gz	PLCVECQECSPZFB-CYBMUJFWSA-N	0	0	299.345	4.133	20	30		CIEDRN
C[C@H](CC#N)Sc1ccccc1NCC[C@H]1CCCO1	ZINC000189646542	333197280	/nfs/dbraw/zinc/19/72/80/333197280.db2.gz	DNENFSUNLXONJW-ZIAGYGMSSA-N	0	0	290.432	4.062	20	30		CIEDRN
C[C@H](CC#N)Sc1ccccc1NCC[C@@H]1CCCO1	ZINC000189646509	333197305	/nfs/dbraw/zinc/19/73/05/333197305.db2.gz	DNENFSUNLXONJW-KGLIPLIRSA-N	0	0	290.432	4.062	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(C)cc1Cl	ZINC000189764308	333198938	/nfs/dbraw/zinc/19/89/38/333198938.db2.gz	MTTLKHKFXMXWSA-CQSZACIVSA-N	0	0	251.757	4.189	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H](C)c1ccccc1Cl	ZINC000189859495	333199820	/nfs/dbraw/zinc/19/98/20/333199820.db2.gz	HWOUORKOGDUISW-IAQYHMDHSA-N	0	0	265.784	4.120	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(Cl)cc1C	ZINC000189943384	333200983	/nfs/dbraw/zinc/20/09/83/333200983.db2.gz	HFBVMFHMTQDLBW-CQSZACIVSA-N	0	0	251.757	4.189	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(Cl)cc1C	ZINC000189943405	333201002	/nfs/dbraw/zinc/20/10/02/333201002.db2.gz	HFBVMFHMTQDLBW-AWEZNQCLSA-N	0	0	251.757	4.189	20	30		CIEDRN
C=CCC1(C(=O)N2CCC(Cc3ccccc3)CC2)CCC1	ZINC000190295806	333205256	/nfs/dbraw/zinc/20/52/56/333205256.db2.gz	VBKDKDKSMFKKDG-UHFFFAOYSA-N	0	0	297.442	4.214	20	30		CIEDRN
CCCOc1ccccc1NCc1ccc(C#N)c(F)c1	ZINC000190320861	333205397	/nfs/dbraw/zinc/20/53/97/333205397.db2.gz	ZXKHMNYYCHFYSF-UHFFFAOYSA-N	0	0	284.334	4.098	20	30		CIEDRN
CC(=O)c1ccc(NCC#Cc2ccccc2)cc1Cl	ZINC000190397685	333206354	/nfs/dbraw/zinc/20/63/54/333206354.db2.gz	BZAKBIDHLFLTQK-UHFFFAOYSA-N	0	0	283.758	4.006	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@H](C)c1cccc(OC(F)F)c1	ZINC000190573531	333208484	/nfs/dbraw/zinc/20/84/84/333208484.db2.gz	OBVMGTIGEMHXDC-BZNIZROVSA-N	0	0	297.345	4.068	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](C(F)(F)F)C(C)(C)C1	ZINC000190695852	333209797	/nfs/dbraw/zinc/20/97/97/333209797.db2.gz	HDIQJCCVHGXODO-RISCZKNCSA-N	0	0	291.357	4.026	20	30		CIEDRN
Cc1c(Cl)cccc1NCc1cccc(C#N)c1F	ZINC000223726381	333211634	/nfs/dbraw/zinc/21/16/34/333211634.db2.gz	KABANQXLEBNTOE-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
N#CCCCSCc1ccccc1C(F)(F)F	ZINC000190881233	333211886	/nfs/dbraw/zinc/21/18/86/333211886.db2.gz	OQJSXPWRPMWJET-UHFFFAOYSA-N	0	0	259.296	4.242	20	30		CIEDRN
CC(C)(C)OC(=O)c1ccc(CSCCCC#N)cc1	ZINC000190982917	333213182	/nfs/dbraw/zinc/21/31/82/333213182.db2.gz	BSCKAZIHRFIVTF-UHFFFAOYSA-N	0	0	291.416	4.179	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cccc(COC(C)C)c1	ZINC000191009950	333213523	/nfs/dbraw/zinc/21/35/23/333213523.db2.gz	HSMBRXQHPWZKMV-QGZVFWFLSA-N	0	0	275.392	4.152	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1ccc(O)cc1CC)c1ccccc1	ZINC000191082652	333215008	/nfs/dbraw/zinc/21/50/08/333215008.db2.gz	ZIKDKPOCELMHQA-CQSZACIVSA-N	0	0	295.382	4.253	20	30		CIEDRN
CC[C@@H](C)CC(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl	ZINC000191510273	333220737	/nfs/dbraw/zinc/22/07/37/333220737.db2.gz	BLBAADVVDCGMOO-SKDRFNHKSA-N	0	0	299.201	4.110	20	30		CIEDRN
CC[C@@H](C)CC(=O)N[C@H](C#N)c1cccc(Cl)c1Cl	ZINC000191510298	333220742	/nfs/dbraw/zinc/22/07/42/333220742.db2.gz	BLBAADVVDCGMOO-BXKDBHETSA-N	0	0	299.201	4.110	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cccc(Cl)c1F	ZINC000191804824	333225617	/nfs/dbraw/zinc/22/56/17/333225617.db2.gz	DPMZWURIBVPDHW-CYBMUJFWSA-N	0	0	255.720	4.020	20	30		CIEDRN
C=CCC1(C(=O)Nc2cc(Cl)ccc2F)CCC1	ZINC000191847840	333226336	/nfs/dbraw/zinc/22/63/36/333226336.db2.gz	DXNUYQCMFQHUAU-UHFFFAOYSA-N	0	0	267.731	4.164	20	30		CIEDRN
C=CC1CCN(C(=O)C(C)(C)c2ccccc2Cl)CC1	ZINC000521955576	333226976	/nfs/dbraw/zinc/22/69/76/333226976.db2.gz	OHXGVUUPZPCCMG-UHFFFAOYSA-N	0	0	291.822	4.042	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)c1ccoc1Cl	ZINC000192310770	333234269	/nfs/dbraw/zinc/23/42/69/333234269.db2.gz	UWQGCOLOLAMYDD-UHFFFAOYSA-N	0	0	281.783	4.142	20	30		CIEDRN
C=CCCCCCSCc1nccn1C(F)F	ZINC000192541260	333236339	/nfs/dbraw/zinc/23/63/39/333236339.db2.gz	WVCWSDYWHLCWIC-UHFFFAOYSA-N	0	0	260.353	4.258	20	30		CIEDRN
Cc1csc(NC(=O)c2cccc(Cl)c2C)c1C#N	ZINC000564187772	333240312	/nfs/dbraw/zinc/24/03/12/333240312.db2.gz	CVZFQILJEOCJHN-UHFFFAOYSA-N	0	0	290.775	4.142	20	30		CIEDRN
Cc1cccc(C(=O)Nc2ccc(C#N)cc2Cl)c1C	ZINC000225781127	333240545	/nfs/dbraw/zinc/24/05/45/333240545.db2.gz	BILSZARSHHUUTI-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
C=CCOc1cccc(NC(=O)N2CCCC[C@@H]2CC)c1	ZINC000193709111	333256000	/nfs/dbraw/zinc/25/60/00/333256000.db2.gz	HRTXCHBGAIUWAX-HNNXBMFYSA-N	0	0	288.391	4.048	20	30		CIEDRN
C[C@H]1CCCC[C@@H]1OCCNc1ccc(C#N)c(Cl)c1	ZINC000195708347	333261122	/nfs/dbraw/zinc/26/11/22/333261122.db2.gz	UQPAJKIQIHJVJV-LRDDRELGSA-N	0	0	292.810	4.219	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)N[C@H](CC)CCC	ZINC000195727539	333261987	/nfs/dbraw/zinc/26/19/87/333261987.db2.gz	BDRLEIIBPCEKRL-OAHLLOKOSA-N	0	0	292.398	4.102	20	30		CIEDRN
CC1(C)CCCC[C@H]1C(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000194391419	333270435	/nfs/dbraw/zinc/27/04/35/333270435.db2.gz	BLPPINGQLQHYSN-IRXDYDNUSA-N	0	0	298.430	4.364	20	30		CIEDRN
C=CCSCC(=O)N(c1ccccc1)C1CCCCC1	ZINC000522282945	333278913	/nfs/dbraw/zinc/27/89/13/333278913.db2.gz	DMAQTGCSUPBRKP-UHFFFAOYSA-N	0	0	289.444	4.272	20	30		CIEDRN
N#Cc1cccc(Sc2ccc(C(F)(F)F)cn2)c1	ZINC000227637792	333286956	/nfs/dbraw/zinc/28/69/56/333286956.db2.gz	TYFDUAFWHYAHLS-UHFFFAOYSA-N	0	0	280.274	4.123	20	30		CIEDRN
CS[C@@H]1CCC[C@H](Nc2cc(C#N)c3ccccc3n2)C1	ZINC000227652641	333287156	/nfs/dbraw/zinc/28/71/56/333287156.db2.gz	VWIKWCXBMCBWKE-UONOGXRCSA-N	0	0	297.427	4.193	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(OC(C)C)c(Cl)c1	ZINC000522475330	333287737	/nfs/dbraw/zinc/28/77/37/333287737.db2.gz	YOUZGMCBQXEOBW-UHFFFAOYSA-N	0	0	267.756	4.032	20	30		CIEDRN
C=CCCC(=O)Nc1ccccc1-c1nc2ccccc2[nH]1	ZINC000522483300	333288104	/nfs/dbraw/zinc/28/81/04/333288104.db2.gz	FFESSXRJYQSIJB-UHFFFAOYSA-N	0	0	291.354	4.135	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(OC2CCCCC2)cc1	ZINC000522497486	333288195	/nfs/dbraw/zinc/28/81/95/333288195.db2.gz	VPPCVENCKQKJQD-UHFFFAOYSA-N	0	0	273.376	4.303	20	30		CIEDRN
C=C(C)CN(CC)C(=O)[C@H](CC1CCCC1)C(C)C	ZINC000522505206	333288435	/nfs/dbraw/zinc/28/84/35/333288435.db2.gz	ODZBSKQWHUOXKO-MRXNPFEDSA-N	0	0	265.441	4.264	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N(CCCC)Cc1ccccc1F	ZINC000522636409	333293890	/nfs/dbraw/zinc/29/38/90/333293890.db2.gz	ZMHPZZVDKRSYDG-CQSZACIVSA-N	0	0	292.398	4.102	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)c1cc2ccc(C(C)(C)C)cc2[nH]1	ZINC000522642355	333294305	/nfs/dbraw/zinc/29/43/05/333294305.db2.gz	FXCJCIJXQUJIHQ-GFCCVEGCSA-N	0	0	284.403	4.160	20	30		CIEDRN
C[C@H]1CCC[C@](C#N)(NC(=O)CCCC2CCCCC2)C1	ZINC000522643850	333294450	/nfs/dbraw/zinc/29/44/50/333294450.db2.gz	RVSBMFFTZJNDBQ-YJBOKZPZSA-N	0	0	290.451	4.326	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1ccccc1-c1ccccc1	ZINC000522659040	333295052	/nfs/dbraw/zinc/29/50/52/333295052.db2.gz	BPHUIBXJWYGCFO-CQSZACIVSA-N	0	0	280.371	4.440	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1ccccc1-c1ccccc1	ZINC000522659039	333295242	/nfs/dbraw/zinc/29/52/42/333295242.db2.gz	BPHUIBXJWYGCFO-AWEZNQCLSA-N	0	0	280.371	4.440	20	30		CIEDRN
C=CCCCN(C)C(=O)CCc1ccc(C(C)(C)C)cc1	ZINC000522950609	333300949	/nfs/dbraw/zinc/30/09/49/333300949.db2.gz	LYVRSAUPFPVPIS-UHFFFAOYSA-N	0	0	287.447	4.341	20	30		CIEDRN
C=CCCCS[C@H](C)c1nc(CCCC)no1	ZINC000522968460	333302275	/nfs/dbraw/zinc/30/22/75/333302275.db2.gz	UJUJKABXZQKZGW-LLVKDONJSA-N	0	0	254.399	4.173	20	30		CIEDRN
N#Cc1cc(COc2ccc(F)cc2Cl)ccc1F	ZINC000229753426	333309328	/nfs/dbraw/zinc/30/93/28/333309328.db2.gz	QCCMUGJICHTXEN-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
CC[C@H](Sc1cc(C#N)ccn1)c1ccc(F)cc1F	ZINC000523109592	333309482	/nfs/dbraw/zinc/30/94/82/333309482.db2.gz	QHTQZWMBPKQCCD-AWEZNQCLSA-N	0	0	290.338	4.475	20	30		CIEDRN
C=CCCCN(C)C(=O)C[C@H](C)c1ccc(CC)cc1	ZINC000523159156	333311645	/nfs/dbraw/zinc/31/16/45/333311645.db2.gz	NAFQETRXMCWPGQ-HNNXBMFYSA-N	0	0	273.420	4.167	20	30		CIEDRN
N#Cc1ccc(F)cc1CSc1ccc(F)cc1	ZINC000229949298	333311904	/nfs/dbraw/zinc/31/19/04/333311904.db2.gz	JEKHWSITQCPBBH-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
N#Cc1ccc(F)cc1CSc1cccc(F)c1	ZINC000229950297	333312051	/nfs/dbraw/zinc/31/20/51/333312051.db2.gz	UZKVKKLAQQSZHD-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
C=CCCC(=O)N(C)C1CCC(C(C)(C)C)CC1	ZINC000523223043	333312762	/nfs/dbraw/zinc/31/27/62/333312762.db2.gz	IDFJEWVTXMGMJD-UHFFFAOYSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=CCCC(=O)NC[C@H](C)c1c(Cl)cccc1Cl	ZINC000523275995	333313520	/nfs/dbraw/zinc/31/35/20/333313520.db2.gz	WQZPPBFCXUCTTD-JTQLQIEISA-N	0	0	286.202	4.179	20	30		CIEDRN
C=CCCC(=O)Nc1cccc(CSc2ccccn2)c1	ZINC000523282485	333314096	/nfs/dbraw/zinc/31/40/96/333314096.db2.gz	OKDNVDDQZJQUAG-UHFFFAOYSA-N	0	0	298.411	4.279	20	30		CIEDRN
C=CCCC(=O)N[C@@H](c1ccc(F)cc1)C1CCCC1	ZINC000523286388	333314673	/nfs/dbraw/zinc/31/46/73/333314673.db2.gz	PZEJPTULHVOTKC-QGZVFWFLSA-N	0	0	275.367	4.139	20	30		CIEDRN
N#Cc1ccc(OCc2cc(Cl)ccc2F)c(F)c1	ZINC000230400867	333317003	/nfs/dbraw/zinc/31/70/03/333317003.db2.gz	ZCZUWJWGQZVIJK-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
CS[C@@H]1CCC[C@@H](Nc2c(C#N)cnc3ccccc32)C1	ZINC000230906974	333322463	/nfs/dbraw/zinc/32/24/63/333322463.db2.gz	JCOIBCATFMSFRB-ZIAGYGMSSA-N	0	0	297.427	4.193	20	30		CIEDRN
C[C@@H](CC(F)(F)F)Nc1ccc(C(F)(F)F)cc1C#N	ZINC000231749752	333329139	/nfs/dbraw/zinc/32/91/39/333329139.db2.gz	BRAVYGFKKSQWPL-ZETCQYMHSA-N	0	0	296.214	4.330	20	30		CIEDRN
C[C@@H]1C[C@H]1c1ccc(CNc2c(F)cc(C#N)cc2F)o1	ZINC000523478635	333329219	/nfs/dbraw/zinc/32/92/19/333329219.db2.gz	YSRHDAMDYDHCLO-BXKDBHETSA-N	0	0	288.297	4.165	20	30		CIEDRN
Cc1cc(Cl)ccc1CNc1cccc(C#N)c1	ZINC000231829662	333330124	/nfs/dbraw/zinc/33/01/24/333330124.db2.gz	GDLJGPXSAUWFON-UHFFFAOYSA-N	0	0	256.736	4.132	20	30		CIEDRN
C=CCN(C(=O)[C@H](C)c1cccc(C)c1)c1ccccc1	ZINC000523498531	333330140	/nfs/dbraw/zinc/33/01/40/333330140.db2.gz	QBSJSTQTXGIMBQ-MRXNPFEDSA-N	0	0	279.383	4.318	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1cc2ccccc2n1CC	ZINC000523510102	333331378	/nfs/dbraw/zinc/33/13/78/333331378.db2.gz	PIHUWVCCRPNKOO-UHFFFAOYSA-N	0	0	298.430	4.480	20	30		CIEDRN
Cc1cc(C#N)nc(Oc2ccc(Cl)c3ccccc23)n1	ZINC000231908581	333331797	/nfs/dbraw/zinc/33/17/97/333331797.db2.gz	GFSQUNGYHCPAOD-UHFFFAOYSA-N	0	0	295.729	4.256	20	30		CIEDRN
C=CCCS[C@H](C)C(=O)Nc1cc(Cl)ccc1F	ZINC000523522098	333332118	/nfs/dbraw/zinc/33/21/18/333332118.db2.gz	VVFHRPSQGNZCOK-SECBINFHSA-N	0	0	287.787	4.115	20	30		CIEDRN
C=CCCCCCN(C)C(=O)NC1C[C@H](C)C[C@@H](C)C1	ZINC000523567330	333333298	/nfs/dbraw/zinc/33/32/98/333333298.db2.gz	XIXPFBDHDLPXPN-HUUCEWRRSA-N	0	0	280.456	4.199	20	30		CIEDRN
C[C@@H](C#N)N[C@@H](CC1CCCCC1)c1ccccc1	ZINC000523624672	333334427	/nfs/dbraw/zinc/33/44/27/333334427.db2.gz	VWDPBXSIDFOGJO-YOEHRIQHSA-N	0	0	256.393	4.200	20	30		CIEDRN
C=CCN(CC=C)Cc1nc2ccccc2c(C)c1Cl	ZINC000302809428	333335396	/nfs/dbraw/zinc/33/53/96/333335396.db2.gz	KNSLLNKTIGBDOC-UHFFFAOYSA-N	0	0	286.806	4.371	20	30		CIEDRN
C[C@H](CC(=O)Nc1cccc(C#N)c1)C1CCCCC1	ZINC000303102465	333337702	/nfs/dbraw/zinc/33/77/02/333337702.db2.gz	IHAPOIKSDKXVOK-CYBMUJFWSA-N	0	0	270.376	4.103	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(Oc2ccc(C)cc2)nc1	ZINC000303106317	333337703	/nfs/dbraw/zinc/33/77/03/333337703.db2.gz	DYXSCHRBZXLYMQ-UHFFFAOYSA-N	0	0	282.343	4.087	20	30		CIEDRN
CC(C)(C#N)CCCCOc1cc(F)ccc1F	ZINC000232519188	333337771	/nfs/dbraw/zinc/33/77/71/333337771.db2.gz	DPIUYKNNOCWWJH-UHFFFAOYSA-N	0	0	253.292	4.064	20	30		CIEDRN
CC(C)(C#N)CCCCOc1c(F)cccc1F	ZINC000232518546	333337776	/nfs/dbraw/zinc/33/77/76/333337776.db2.gz	AQIWMUHIODRELF-UHFFFAOYSA-N	0	0	253.292	4.064	20	30		CIEDRN
Cc1ccc(CNc2ccc(Cl)cc2C#N)cc1F	ZINC000303138613	333338005	/nfs/dbraw/zinc/33/80/05/333338005.db2.gz	AQWGHXFZOHNVRT-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
CCc1c(C)sc(NC(=O)[C@@H](C)C(C)(C)C)c1C#N	ZINC000523714443	333341258	/nfs/dbraw/zinc/34/12/58/333341258.db2.gz	DVQGMMRMCPHGLY-SECBINFHSA-N	0	0	278.421	4.111	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)[C@H](C)C(C)(C)C	ZINC000523714472	333341275	/nfs/dbraw/zinc/34/12/75/333341275.db2.gz	FRHYELPQAHKIGB-ZDUSSCGKSA-N	0	0	277.383	4.023	20	30		CIEDRN
N#Cc1c(F)cccc1N1CCC[C@@]2(CC=CCC2)C1	ZINC000303541374	333343723	/nfs/dbraw/zinc/34/37/23/333343723.db2.gz	HYLPPKWENZQWGF-KRWDZBQOSA-N	0	0	270.351	4.024	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)C1CCCCCC1	ZINC000523834783	333347400	/nfs/dbraw/zinc/34/74/00/333347400.db2.gz	JISARMOIPJUNHW-UHFFFAOYSA-N	0	0	271.404	4.172	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)NC(C)(C)CCC)c1	ZINC000523926718	333349380	/nfs/dbraw/zinc/34/93/80/333349380.db2.gz	XRGNXWOCRRZEET-UHFFFAOYSA-N	0	0	290.407	4.342	20	30		CIEDRN
C=CCCC(=O)N(CCc1ccccc1F)C1CCCC1	ZINC000523945240	333349718	/nfs/dbraw/zinc/34/97/18/333349718.db2.gz	DOOSPADQIJLZCK-UHFFFAOYSA-N	0	0	289.394	4.106	20	30		CIEDRN
C=CCCC(=O)N(C)[C@H](C)c1ccc(Cl)cc1Cl	ZINC000523944451	333349828	/nfs/dbraw/zinc/34/98/28/333349828.db2.gz	LVDYCRBCCMSLQV-SNVBAGLBSA-N	0	0	286.202	4.479	20	30		CIEDRN
C=CC[C@H](C)NC(=O)[C@H](CCC)CC1CCCCC1	ZINC000523967370	333350332	/nfs/dbraw/zinc/35/03/32/333350332.db2.gz	LUJXTQLLLFAYNU-GOEBONIOSA-N	0	0	265.441	4.454	20	30		CIEDRN
CC(C)c1ccc(C(=O)N[C@@]2(C#N)CCC[C@@H](C)C2)cc1	ZINC000523969539	333350365	/nfs/dbraw/zinc/35/03/65/333350365.db2.gz	UTJRFJOQKPXTGA-KDOFPFPSSA-N	0	0	284.403	4.012	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1ccc(OCCCC)cc1C	ZINC000523986867	333350797	/nfs/dbraw/zinc/35/07/97/333350797.db2.gz	OSGZPIAWYLTUEE-AWEZNQCLSA-N	0	0	290.407	4.260	20	30		CIEDRN
CCCc1ccccc1NCc1ccc(C#N)c(OC)c1	ZINC000233400382	333352163	/nfs/dbraw/zinc/35/21/63/333352163.db2.gz	VGUHDHITYCKZMR-UHFFFAOYSA-N	0	0	280.371	4.131	20	30		CIEDRN
C=CCCCCCOc1ccc(C(C)=O)cc1OC	ZINC000234822345	333362278	/nfs/dbraw/zinc/36/22/78/333362278.db2.gz	KAMSZZRSPAXERZ-UHFFFAOYSA-N	0	0	262.349	4.023	20	30		CIEDRN
C[C@@H](Nc1nccc(C#N)c1Cl)c1ccc(Cl)cc1	ZINC000235285386	333367274	/nfs/dbraw/zinc/36/72/74/333367274.db2.gz	OOERCLHUFMMDGQ-SECBINFHSA-N	0	0	292.169	4.433	20	30		CIEDRN
C=C1CCN([C@H](CC)c2ccc(F)cc2F)CC1	ZINC000524597839	333368215	/nfs/dbraw/zinc/36/82/15/333368215.db2.gz	SSVIVLRRTGTMGF-OAHLLOKOSA-N	0	0	251.320	4.068	20	30		CIEDRN
N#Cc1ccc(NC[C@@H]2CCc3ccccc3N2)cc1Cl	ZINC000524687722	333371279	/nfs/dbraw/zinc/37/12/79/333371279.db2.gz	NLCAAIBIZVERII-HNNXBMFYSA-N	0	0	297.789	4.050	20	30		CIEDRN
CC1=C[C@@H](C)C[C@H](CNc2ccc(CC#N)cc2)C1	ZINC000235679918	333371572	/nfs/dbraw/zinc/37/15/72/333371572.db2.gz	ILFCVEJMFAKQMN-CJNGLKHVSA-N	0	0	254.377	4.157	20	30		CIEDRN
CC1=C[C@@H](C)C[C@@H](CNc2ccc(CC#N)cc2)C1	ZINC000235716139	333371731	/nfs/dbraw/zinc/37/17/31/333371731.db2.gz	ILFCVEJMFAKQMN-CZUORRHYSA-N	0	0	254.377	4.157	20	30		CIEDRN
Cc1cc(OCCCCC(C)(C)C#N)c(F)cc1[N+](=O)[O-]	ZINC000235757353	333372053	/nfs/dbraw/zinc/37/20/53/333372053.db2.gz	TVEYNRCUYCRPBV-UHFFFAOYSA-N	0	0	294.326	4.141	20	30		CIEDRN
Cc1ccc(Cl)c(Oc2nccc(C#N)c2Cl)c1	ZINC000235870122	333372355	/nfs/dbraw/zinc/37/23/55/333372355.db2.gz	OFYIIRUQVUQINQ-UHFFFAOYSA-N	0	0	279.126	4.361	20	30		CIEDRN
C=CCOc1ccc(CNc2cccc3cnccc32)cc1	ZINC000236684803	333374672	/nfs/dbraw/zinc/37/46/72/333374672.db2.gz	CMWNPWOFRIOXJM-UHFFFAOYSA-N	0	0	290.366	4.412	20	30		CIEDRN
CCCCOc1ccc(-c2nc3cc(C#N)ccc3[nH]2)cc1	ZINC000316152204	333385672	/nfs/dbraw/zinc/38/56/72/333385672.db2.gz	VWCHDVDLVPFJKG-UHFFFAOYSA-N	0	0	291.354	4.280	20	30		CIEDRN
Cc1cccc([C@H](C)CNc2nc(C)cc(C)c2C#N)c1	ZINC000524948253	333393981	/nfs/dbraw/zinc/39/39/81/333393981.db2.gz	BCGVNKOQNPHRDC-CQSZACIVSA-N	0	0	279.387	4.094	20	30		CIEDRN
Cc1ccc(C)c(CSc2ccccc2C#N)c1	ZINC000525085504	333398308	/nfs/dbraw/zinc/39/83/08/333398308.db2.gz	ISLICOGAIQHBJO-UHFFFAOYSA-N	0	0	253.370	4.467	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1cnc2ccsc2c1	ZINC000525162896	333401654	/nfs/dbraw/zinc/40/16/54/333401654.db2.gz	KINCXHIOYBCTMU-UHFFFAOYSA-N	0	0	288.416	4.115	20	30		CIEDRN
N#Cc1cc(NCc2c(F)cccc2F)ccc1Cl	ZINC000036972904	333445536	/nfs/dbraw/zinc/44/55/36/333445536.db2.gz	PVMVGWAKLIPUBB-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
CCC(C#N)(CC)C(=O)N1C[C@@H](c2ccccc2C)C[C@@H]1C	ZINC000528613354	333449389	/nfs/dbraw/zinc/44/93/89/333449389.db2.gz	USISKXKIOYUSOH-HOTGVXAUSA-N	0	0	298.430	4.029	20	30		CIEDRN
Cc1ccnc(N[C@@H](C)c2ccccc2Cl)c1C#N	ZINC000123322090	333454303	/nfs/dbraw/zinc/45/43/03/333454303.db2.gz	NVZHJZRNMUEVNR-NSHDSACASA-N	0	0	271.751	4.088	20	30		CIEDRN
C[C@H](Nc1ccc(CC#N)cc1)c1ccc(F)cc1F	ZINC000037071334	333472200	/nfs/dbraw/zinc/47/22/00/333472200.db2.gz	VJJAWDIWKKAZNT-NSHDSACASA-N	0	0	272.298	4.204	20	30		CIEDRN
CCC(C#N)(CC)C(=O)Nc1cccc(C2CCC2)c1	ZINC000529407708	333485014	/nfs/dbraw/zinc/48/50/14/333485014.db2.gz	CEOCWOSOKZRDOU-UHFFFAOYSA-N	0	0	270.376	4.223	20	30		CIEDRN
CCC(C#N)(CC)C(=O)N1CC2(CCCCC2)[C@@H]1C(C)C	ZINC000529483969	333489854	/nfs/dbraw/zinc/48/98/54/333489854.db2.gz	VHBLRUOUGOPLHS-HNNXBMFYSA-N	0	0	290.451	4.134	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cc(OC)c(O)c2ccccc12	ZINC000529546543	333496368	/nfs/dbraw/zinc/49/63/68/333496368.db2.gz	GPWSCCKKHDMPFG-UHFFFAOYSA-N	0	0	299.370	4.095	20	30		CIEDRN
CCOc1ccccc1N[C@H](C)c1cccc(C#N)c1	ZINC000037195945	333512177	/nfs/dbraw/zinc/51/21/77/333512177.db2.gz	BJBGUNNCLDGSLY-CYBMUJFWSA-N	0	0	266.344	4.130	20	30		CIEDRN
C[C@@H](Nc1ccccc1OC(F)F)c1cccc(C#N)c1	ZINC000037217547	333516011	/nfs/dbraw/zinc/51/60/11/333516011.db2.gz	SYMRVKDRJGTGDA-LLVKDONJSA-N	0	0	288.297	4.333	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@@H]1C[C@H]1c1ccsc1)c1ccccc1	ZINC000530002242	333517150	/nfs/dbraw/zinc/51/71/50/333517150.db2.gz	PJKUFFSIEKCOCC-IXDOHACOSA-N	0	0	297.423	4.080	20	30		CIEDRN
CCC(C#N)(CC)c1nc(C2CCCCCC2)no1	ZINC000530159573	333525970	/nfs/dbraw/zinc/52/59/70/333525970.db2.gz	HTBNPFBJMLUMGE-UHFFFAOYSA-N	0	0	261.369	4.089	20	30		CIEDRN
CCOc1cccc(CNc2ccc(Cl)c(C#N)c2)c1	ZINC000037678686	333536223	/nfs/dbraw/zinc/53/62/23/333536223.db2.gz	AEWXAMZSXATHTL-UHFFFAOYSA-N	0	0	286.762	4.222	20	30		CIEDRN
N#Cc1cnc2ccccc2c1NCCC1CCCC1	ZINC000037741467	333537250	/nfs/dbraw/zinc/53/72/50/333537250.db2.gz	GOSYRBHBRXZOFN-UHFFFAOYSA-N	0	0	265.360	4.099	20	30		CIEDRN
N#Cc1cccc(CNc2cccc(-c3nccs3)c2)c1	ZINC000037778349	333539648	/nfs/dbraw/zinc/53/96/48/333539648.db2.gz	LAPNMULDJKQPSI-UHFFFAOYSA-N	0	0	291.379	4.294	20	30		CIEDRN
CCC(CC)CC(=O)N(CC)[C@H](C)c1ccc(C#N)cc1	ZINC000123924437	333554504	/nfs/dbraw/zinc/55/45/04/333554504.db2.gz	DCRSTFJFXVFRTP-CQSZACIVSA-N	0	0	286.419	4.294	20	30		CIEDRN
C=CCCCN(C)C(=O)N[C@H](C)c1ccccc1Cl	ZINC000124951063	333562523	/nfs/dbraw/zinc/56/25/23/333562523.db2.gz	SUQBVEGFEIITGK-GFCCVEGCSA-N	0	0	280.799	4.009	20	30		CIEDRN
C=C(CC)Cn1cnc2cc(-c3ccccc3)sc2c1=O	ZINC000538014024	333571159	/nfs/dbraw/zinc/57/11/59/333571159.db2.gz	NMHSKYRRVOYFRY-UHFFFAOYSA-N	0	0	296.395	4.091	20	30		CIEDRN
C=CCCC[C@@H](C)Sc1nnc(-c2cccs2)n1C	ZINC000538172273	333577573	/nfs/dbraw/zinc/57/75/73/333577573.db2.gz	VTZVHANBQOKSQQ-LLVKDONJSA-N	0	0	293.461	4.381	20	30		CIEDRN
C=CCCC[C@H](C)Sc1nnc(C2CC2)s1	ZINC000538171458	333577707	/nfs/dbraw/zinc/57/77/07/333577707.db2.gz	RZNGTRRUDUFEOK-VIFPVBQESA-N	0	0	254.424	4.252	20	30		CIEDRN
CC(C)(C)CN(CC(C)(C)C)C(=O)c1ccc(C#N)s1	ZINC000538248539	333581353	/nfs/dbraw/zinc/58/13/53/333581353.db2.gz	FVDDETVQRWSHFU-UHFFFAOYSA-N	0	0	292.448	4.154	20	30		CIEDRN
C=CCn1c(SCCC2CCCC2)nnc1C1CC1	ZINC000125926115	333582304	/nfs/dbraw/zinc/58/23/04/333582304.db2.gz	ZSFTVPPOLYSXER-UHFFFAOYSA-N	0	0	277.437	4.014	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H](c1ccccc1)C(F)(F)F	ZINC000125969945	333585331	/nfs/dbraw/zinc/58/53/31/333585331.db2.gz	VAZHDUVBCKVTSS-CQSZACIVSA-N	0	0	297.320	4.175	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)CC/C=C/c1ccccc1	ZINC000538326162	333585484	/nfs/dbraw/zinc/58/54/84/333585484.db2.gz	NKLOFPMDIJCZOQ-SCZPIIQISA-N	0	0	271.404	4.341	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1ccc(OC)c(Cl)c1	ZINC000538341776	333586122	/nfs/dbraw/zinc/58/61/22/333586122.db2.gz	KJTKTRGWUNERHB-LLVKDONJSA-N	0	0	296.798	4.215	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1nc(C(C)C)cs1	ZINC000538355733	333586862	/nfs/dbraw/zinc/58/68/62/333586862.db2.gz	QWXIXYZMWNMFDO-LLVKDONJSA-N	0	0	281.425	4.133	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N1CCCC[C@H](SCC)C1	ZINC000538369617	333587299	/nfs/dbraw/zinc/58/72/99/333587299.db2.gz	DJJLQAZGOIOUGG-GJZGRUSLSA-N	0	0	298.496	4.048	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)C[C@@H](C)c1ccccc1	ZINC000126242634	333595327	/nfs/dbraw/zinc/59/53/27/333595327.db2.gz	IGLFDFGWRWUVCK-OAHLLOKOSA-N	0	0	286.419	4.159	20	30		CIEDRN
C=CCC[C@@H](Nc1cccc(COCC)c1)C1CC1	ZINC000538550842	333605617	/nfs/dbraw/zinc/60/56/17/333605617.db2.gz	IOBXOMQCQDZECG-QGZVFWFLSA-N	0	0	259.393	4.380	20	30		CIEDRN
Cc1cc(C)cc(CCC(=O)Nc2cccc(C#N)c2C)c1	ZINC000538564304	333606616	/nfs/dbraw/zinc/60/66/16/333606616.db2.gz	SEIJRERICGSOTL-UHFFFAOYSA-N	0	0	292.382	4.055	20	30		CIEDRN
C=CCN(C(=O)Nc1cccc(OCCCC)c1)C1CC1	ZINC000539028422	333649534	/nfs/dbraw/zinc/64/95/34/333649534.db2.gz	DMGZMXOHHMLLTD-UHFFFAOYSA-N	0	0	288.391	4.048	20	30		CIEDRN
C=CCN(C(=O)CCc1ccc(Cl)c(Cl)c1)C1CC1	ZINC000539035148	333649685	/nfs/dbraw/zinc/64/96/85/333649685.db2.gz	DNHDZZUTAWFOAM-UHFFFAOYSA-N	0	0	298.213	4.103	20	30		CIEDRN
C=C(CC)CSCC(=O)Nc1cc(Cl)ccc1C	ZINC000539095764	333657961	/nfs/dbraw/zinc/65/79/61/333657961.db2.gz	YXAWGYQLVDNESU-UHFFFAOYSA-N	0	0	283.824	4.286	20	30		CIEDRN
C=C(C)CSc1nnc([C@H](CC)c2ccccc2)o1	ZINC000067953960	333658420	/nfs/dbraw/zinc/65/84/20/333658420.db2.gz	TZJJQJKMPNQEKO-CYBMUJFWSA-N	0	0	274.389	4.280	20	30		CIEDRN
CSc1cccc(NCc2ccc(C#N)cc2)c1C	ZINC000539226717	333662393	/nfs/dbraw/zinc/66/23/93/333662393.db2.gz	OMLBISBNVYLZSB-UHFFFAOYSA-N	0	0	268.385	4.201	20	30		CIEDRN
C=C[C@H](C)NC(=O)N(C)Cc1ccccc1-c1ccccc1	ZINC000128368469	333663442	/nfs/dbraw/zinc/66/34/42/333663442.db2.gz	AQUQKTPRPNWUOX-HNNXBMFYSA-N	0	0	294.398	4.070	20	30		CIEDRN
C=C(C)CN[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000539421135	333670602	/nfs/dbraw/zinc/67/06/02/333670602.db2.gz	BJYIJJSUOZHXGL-LLVKDONJSA-N	0	0	297.242	4.475	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1cc2cc(C)ccc2o1	ZINC000539428569	333671114	/nfs/dbraw/zinc/67/11/14/333671114.db2.gz	ARIAFFMRPIFFLH-ZDUSSCGKSA-N	0	0	271.360	4.216	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)[C@H](c1ccccc1)C(C)C	ZINC000539435870	333671274	/nfs/dbraw/zinc/67/12/74/333671274.db2.gz	YWXVGXHRPJDOIH-RDJZCZTQSA-N	0	0	273.420	4.287	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Cc1ccc(SCC)cc1	ZINC000539435181	333671394	/nfs/dbraw/zinc/67/13/94/333671394.db2.gz	FEDBBOHTCXXFJX-CQSZACIVSA-N	0	0	291.460	4.202	20	30		CIEDRN
Cc1noc(C)c1CCSc1ccc(C#N)cc1Cl	ZINC000128479102	333676275	/nfs/dbraw/zinc/67/62/75/333676275.db2.gz	GYFDSBOHGLGIRA-UHFFFAOYSA-N	0	0	292.791	4.151	20	30		CIEDRN
CC(C)[C@@H](NCc1ccc(C#N)o1)c1ccccc1Cl	ZINC000174398706	335153825	/nfs/dbraw/zinc/15/38/25/335153825.db2.gz	LUOMAYNGMSOXET-MRXNPFEDSA-N	0	0	288.778	4.292	20	30		CIEDRN
CC(C)C[C@H]1C[C@H](Nc2c(Cl)cccc2C#N)CCO1	ZINC000539611893	333681233	/nfs/dbraw/zinc/68/12/33/333681233.db2.gz	HHNLIXAZLVWGMD-KGLIPLIRSA-N	0	0	292.810	4.217	20	30		CIEDRN
CC(C)C[C@@H]1C[C@H](Nc2c(Cl)cccc2C#N)CCO1	ZINC000539611895	333681291	/nfs/dbraw/zinc/68/12/91/333681291.db2.gz	HHNLIXAZLVWGMD-ZIAGYGMSSA-N	0	0	292.810	4.217	20	30		CIEDRN
C=CCCC(=O)Nc1ccccc1Nc1ccc(F)cc1	ZINC000539696229	333685757	/nfs/dbraw/zinc/68/57/57/333685757.db2.gz	JNYWAFJQPSVZSL-UHFFFAOYSA-N	0	0	284.334	4.474	20	30		CIEDRN
C[C@H](C#N)S[C@H](C)c1ccc(OC(F)(F)F)cc1	ZINC000068463308	333702179	/nfs/dbraw/zinc/70/21/79/333702179.db2.gz	COPMWACWSXFZTC-RKDXNWHRSA-N	0	0	275.295	4.291	20	30		CIEDRN
CC(C)N(C)c1cccc(NCc2ccc(C#N)cc2F)c1	ZINC000539920448	333702756	/nfs/dbraw/zinc/70/27/56/333702756.db2.gz	CEGQNVVCRMDFRQ-UHFFFAOYSA-N	0	0	297.377	4.154	20	30		CIEDRN
C=C[C@H](CC(=O)N1[C@H](C)CC[C@H]1CC)c1ccccc1	ZINC000540091860	333709710	/nfs/dbraw/zinc/70/97/10/333709710.db2.gz	RJEOAEPCEXGDKS-BFYDXBDKSA-N	0	0	271.404	4.136	20	30		CIEDRN
C=C(CC)CNc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000540194515	333720256	/nfs/dbraw/zinc/72/02/56/333720256.db2.gz	OXTCPDJHWQVFDC-UHFFFAOYSA-N	0	0	280.371	4.317	20	30		CIEDRN
C=C(CC)CS[C@@H](C)C(=O)Nc1ccc(C)c(F)c1	ZINC000540193600	333720356	/nfs/dbraw/zinc/72/03/56/333720356.db2.gz	MGXFQAOTISUGQX-LBPRGKRZSA-N	0	0	281.396	4.161	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cccc(SC)c1C	ZINC000540445656	333730430	/nfs/dbraw/zinc/73/04/30/333730430.db2.gz	PKODGRRJWAQAEQ-UHFFFAOYSA-N	0	0	275.417	4.424	20	30		CIEDRN
C=CCCOCCCCC(=O)Nc1ccc(C)c(C)c1	ZINC000540465298	333730925	/nfs/dbraw/zinc/73/09/25/333730925.db2.gz	MMAIASGMHKXYKR-UHFFFAOYSA-N	0	0	275.392	4.005	20	30		CIEDRN
C=CCCOCCCCC(=O)Nc1cccc(Cl)c1	ZINC000540466569	333730969	/nfs/dbraw/zinc/73/09/69/333730969.db2.gz	ODOZJZVGCXSWTH-UHFFFAOYSA-N	0	0	281.783	4.042	20	30		CIEDRN
CCc1cccc(NC(=O)c2ccc(Cl)c(C#N)c2)c1	ZINC000540469493	333731157	/nfs/dbraw/zinc/73/11/57/333731157.db2.gz	VDXGQVATAHHEDM-UHFFFAOYSA-N	0	0	284.746	4.026	20	30		CIEDRN
C=CCCOCCCCC(=O)N[C@H]1CCC(C)(C)C[C@H]1C	ZINC000540485657	333731823	/nfs/dbraw/zinc/73/18/23/333731823.db2.gz	NSPSVIDHVXAPQI-CVEARBPZSA-N	0	0	295.467	4.080	20	30		CIEDRN
CSc1ccc(C)c(NCc2ccc(C#N)cc2)c1	ZINC000540500779	333732539	/nfs/dbraw/zinc/73/25/39/333732539.db2.gz	MEBGSYXPAFOCKB-UHFFFAOYSA-N	0	0	268.385	4.201	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1cncc(-c2ccccc2)c1	ZINC000540532412	333734239	/nfs/dbraw/zinc/73/42/39/333734239.db2.gz	QYRZKHJIYCJNMD-OAHLLOKOSA-N	0	0	294.398	4.223	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1cc(F)ccc1Cl	ZINC000540555315	333735054	/nfs/dbraw/zinc/73/50/54/333735054.db2.gz	RRSOCYGJSLELDN-SNVBAGLBSA-N	0	0	284.762	4.345	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N1CCCC12CCCCC2	ZINC000540571986	333735547	/nfs/dbraw/zinc/73/55/47/333735547.db2.gz	NPSMBDTWAOAQTL-OAHLLOKOSA-N	0	0	278.440	4.240	20	30		CIEDRN
C=CCC[C@@H](NC(=O)N1CC[C@H]1C(C)C)c1ccccc1	ZINC000540583298	333736030	/nfs/dbraw/zinc/73/60/30/333736030.db2.gz	AVLMZSBVVRWGMM-SJORKVTESA-N	0	0	286.419	4.134	20	30		CIEDRN
CC(C)C[C@H]1C[C@@H](Nc2ccc(Cl)cc2C#N)CCO1	ZINC000540710588	333743169	/nfs/dbraw/zinc/74/31/69/333743169.db2.gz	GRJQTVQJTCACQQ-GJZGRUSLSA-N	0	0	292.810	4.217	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N[C@@H](C)c1cc(C)sc1C	ZINC000540768540	333746474	/nfs/dbraw/zinc/74/64/74/333746474.db2.gz	PNMCWBHGFOYIJL-WCQYABFASA-N	0	0	280.437	4.080	20	30		CIEDRN
COc1ccc(C#N)cc1CNc1c(C)cccc1Cl	ZINC000129258041	333754180	/nfs/dbraw/zinc/75/41/80/333754180.db2.gz	BEYVDHGFTIOIHY-UHFFFAOYSA-N	0	0	286.762	4.141	20	30		CIEDRN
C=CCCSc1ccc(C#N)c(C(F)(F)F)c1	ZINC000541077728	333761755	/nfs/dbraw/zinc/76/17/55/333761755.db2.gz	WUDVTVYOTOJOKG-UHFFFAOYSA-N	0	0	257.280	4.245	20	30		CIEDRN
N#Cc1ccc(Cl)cc1NCc1ccc2ncccc2c1	ZINC000069501113	333767477	/nfs/dbraw/zinc/76/74/77/333767477.db2.gz	SRXUFUNLVALAIJ-UHFFFAOYSA-N	0	0	293.757	4.372	20	30		CIEDRN
Cc1ccnc(N[C@H](c2ccc(Cl)cc2)C2CC2)c1C#N	ZINC000541280699	333769621	/nfs/dbraw/zinc/76/96/21/333769621.db2.gz	XMEMCGOKZUPUML-INIZCTEOSA-N	0	0	297.789	4.478	20	30		CIEDRN
Cc1ccc(C)c([C@H]2CCCN2c2nccc(C)c2C#N)c1	ZINC000541280549	333769640	/nfs/dbraw/zinc/76/96/40/333769640.db2.gz	QDUUAHGSTSVIAK-GOSISDBHSA-N	0	0	291.398	4.220	20	30		CIEDRN
CCOc1cccc(CS[C@@H](C)c2ccc(C#N)cc2)n1	ZINC000541294676	333770945	/nfs/dbraw/zinc/77/09/45/333770945.db2.gz	UAYVDGCZCWEUOY-ZDUSSCGKSA-N	0	0	298.411	4.346	20	30		CIEDRN
N#CCc1ccc(CNc2c(F)cc(Cl)cc2F)cc1	ZINC000541295937	333771070	/nfs/dbraw/zinc/77/10/70/333771070.db2.gz	OMHOEQAUPFVMPW-UHFFFAOYSA-N	0	0	292.716	4.296	20	30		CIEDRN
CCOc1cc(C)ccc1NCc1cccc(C#N)c1F	ZINC000541307724	333771473	/nfs/dbraw/zinc/77/14/73/333771473.db2.gz	YZVMZMUDFZYOKO-UHFFFAOYSA-N	0	0	284.334	4.017	20	30		CIEDRN
C=CCOc1ccccc1CNCc1ccc([C@H]2C[C@H]2C)o1	ZINC000069752711	333786784	/nfs/dbraw/zinc/78/67/84/333786784.db2.gz	JERCOBICDFPNQX-PBHICJAKSA-N	0	0	297.398	4.258	20	30		CIEDRN
C=CCC[C@H](C)Nc1ccccc1OC[C@H]1CCCCO1	ZINC000541774714	333791793	/nfs/dbraw/zinc/79/17/93/333791793.db2.gz	YVBGMEOKOBASIZ-JKSUJKDBSA-N	0	0	289.419	4.401	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@@H]1CCCc2occc21)c1ccccc1	ZINC000129964615	333801661	/nfs/dbraw/zinc/80/16/61/333801661.db2.gz	MWBBDHNXHSAHFS-RHSMWYFYSA-N	0	0	295.382	4.133	20	30		CIEDRN
Cc1c(Cl)cnc(N2CCc3ccccc3[C@@H]2C)c1C#N	ZINC000542210990	333816068	/nfs/dbraw/zinc/81/60/68/333816068.db2.gz	MCENWPHILOTFJK-LBPRGKRZSA-N	0	0	297.789	4.039	20	30		CIEDRN
C=CCCCN[C@H](c1cccc(F)c1F)C(F)(F)F	ZINC000542259795	333819116	/nfs/dbraw/zinc/81/91/16/333819116.db2.gz	PKXJRPNVOCMOPC-GFCCVEGCSA-N	0	0	279.252	4.124	20	30		CIEDRN
C=CCCCCCN(C)C(=O)Nc1ccc(SC)cn1	ZINC000542399015	333823777	/nfs/dbraw/zinc/82/37/77/333823777.db2.gz	KZEJCPSLLDNPRK-UHFFFAOYSA-N	0	0	293.436	4.014	20	30		CIEDRN
C[C@H](CCC(C)(C)C)C(=O)N[C@H](C)c1ccc(C#N)cc1	ZINC000542513022	333829684	/nfs/dbraw/zinc/82/96/84/333829684.db2.gz	CBYOUWYAOXUAPU-ZIAGYGMSSA-N	0	0	286.419	4.198	20	30		CIEDRN
C[C@H](CCC(C)(C)C)C(=O)N[C@]1(C#N)CCC[C@@H](C)C1	ZINC000542527175	333830917	/nfs/dbraw/zinc/83/09/17/333830917.db2.gz	SPHJMKOCFOFBOY-CKEIUWERSA-N	0	0	278.440	4.037	20	30		CIEDRN
CCSc1cccc(NC(=O)c2cccc(CC#N)c2)c1	ZINC000071020121	333841912	/nfs/dbraw/zinc/84/19/12/333841912.db2.gz	UXJLOLWJFRGSSR-UHFFFAOYSA-N	0	0	296.395	4.117	20	30		CIEDRN
N#CCC[C@@H](NCc1cc(F)ccc1F)c1ccccc1	ZINC000130420937	333841922	/nfs/dbraw/zinc/84/19/22/333841922.db2.gz	OIKJCQIPXTYEOY-QGZVFWFLSA-N	0	0	286.325	4.099	20	30		CIEDRN
C[C@@H]1CCC[C@H]1Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000071209379	333848708	/nfs/dbraw/zinc/84/87/08/333848708.db2.gz	GFHASAAOIBOKQY-NOZJJQNGSA-N	0	0	268.282	4.178	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N1Cc2ccccc2[C@H]1C	ZINC000543042642	333853897	/nfs/dbraw/zinc/85/38/97/333853897.db2.gz	LTVPHKFLCINQME-ZIAGYGMSSA-N	0	0	272.392	4.018	20	30		CIEDRN
C=CCC[C@@H](C)Nc1ccc(NC(C)=O)c(Cl)c1	ZINC000130599297	333856966	/nfs/dbraw/zinc/85/69/66/333856966.db2.gz	BEGAJRVJTLCEJW-SNVBAGLBSA-N	0	0	266.772	4.065	20	30		CIEDRN
C=CCC[C@H](C)Nc1ccc(NC(C)=O)c(Cl)c1	ZINC000130599065	333857110	/nfs/dbraw/zinc/85/71/10/333857110.db2.gz	BEGAJRVJTLCEJW-JTQLQIEISA-N	0	0	266.772	4.065	20	30		CIEDRN
Cc1c(Cl)cnc(N2C[C@H](C)[C@H]2c2ccccc2)c1C#N	ZINC000543133909	333859760	/nfs/dbraw/zinc/85/97/60/333859760.db2.gz	MHFYSJWQABQZRU-ZBEGNZNMSA-N	0	0	297.789	4.113	20	30		CIEDRN
CC(C)C[C@@](C)(C#N)NC(=O)CC1CC(c2ccccc2)C1	ZINC000543636588	333886658	/nfs/dbraw/zinc/88/66/58/333886658.db2.gz	CXMVJUDGYOITQR-KVWWFHCMSA-N	0	0	298.430	4.015	20	30		CIEDRN
Cc1ccc(NC(=O)Nc2cccc(C#N)c2)c(Cl)c1	ZINC000071947966	333892701	/nfs/dbraw/zinc/89/27/01/333892701.db2.gz	PNHPMFWZHNJOCV-UHFFFAOYSA-N	0	0	285.734	4.164	20	30		CIEDRN
N#Cc1ccc(CSCc2ccccc2Cl)nc1	ZINC000576182934	335166312	/nfs/dbraw/zinc/16/63/12/335166312.db2.gz	DDNIZPDGBMUACY-UHFFFAOYSA-N	0	0	274.776	4.040	20	30		CIEDRN
C[C@@H](C#N)CN(C)c1nc(-c2ccccc2Cl)cs1	ZINC000544066032	333914013	/nfs/dbraw/zinc/91/40/13/333914013.db2.gz	HURWKRUBEGPLEQ-JTQLQIEISA-N	0	0	291.807	4.059	20	30		CIEDRN
Cc1cccc([C@@H](C)Nc2nccc(C)c2C#N)c1C	ZINC000544143397	333918673	/nfs/dbraw/zinc/91/86/73/333918673.db2.gz	KFVLLXUJZKJPCH-CQSZACIVSA-N	0	0	265.360	4.052	20	30		CIEDRN
C=CCC(CC=C)c1nc(-c2ccnc(OC(C)C)c2)no1	ZINC000544610133	333940213	/nfs/dbraw/zinc/94/02/13/333940213.db2.gz	PREQKNGFFFTOAJ-UHFFFAOYSA-N	0	0	299.374	4.155	20	30		CIEDRN
CC[C@H](CNc1ccc(CC#N)cc1)c1ccccc1	ZINC000544725539	333944465	/nfs/dbraw/zinc/94/44/65/333944465.db2.gz	LXPVYROBTPVJPI-MRXNPFEDSA-N	0	0	264.372	4.358	20	30		CIEDRN
C=CCCc1ccccc1N[C@H]1CCO[C@H](C(F)(F)F)C1	ZINC000576193952	335167416	/nfs/dbraw/zinc/16/74/16/335167416.db2.gz	MHSZMNRBOGLUSJ-ZFWWWQNUSA-N	0	0	299.336	4.327	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)Cc1ccc(F)cc1Cl	ZINC000131667317	333962183	/nfs/dbraw/zinc/96/21/83/333962183.db2.gz	ONPFORBCIMFQGH-UHFFFAOYSA-N	0	0	295.785	4.206	20	30		CIEDRN
CC(C)N(C)c1cccc(NCc2cc(C#N)cs2)c1	ZINC000131732109	333964684	/nfs/dbraw/zinc/96/46/84/333964684.db2.gz	QTYMQKFEKIULAJ-UHFFFAOYSA-N	0	0	285.416	4.076	20	30		CIEDRN
CCN(CCC1CC1)C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000545504067	333985054	/nfs/dbraw/zinc/98/50/54/333985054.db2.gz	SKNIAHULWCRQJG-UHFFFAOYSA-N	0	0	299.418	4.142	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(C)[C@H]1CCCc2ccccc21	ZINC000545957904	334009014	/nfs/dbraw/zinc/00/90/14/334009014.db2.gz	UTEBMXHPMNOIRT-RDJZCZTQSA-N	0	0	286.419	4.060	20	30		CIEDRN
C=CCC[C@H](CCC)Nc1cccc2c1CCN2C(C)=O	ZINC000545985868	334010733	/nfs/dbraw/zinc/01/07/33/334010733.db2.gz	ULPLBZVRASOLCT-HNNXBMFYSA-N	0	0	286.419	4.142	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@@H](CC)CC(F)(F)F)c1ccccc1	ZINC000546169449	334017991	/nfs/dbraw/zinc/01/79/91/334017991.db2.gz	UVWRTBFUNWQBQM-OCCSQVGLSA-N	0	0	299.336	4.194	20	30		CIEDRN
N#Cc1cccc(/C=C\c2nc(CC3=CCCCC3)no2)c1	ZINC000546276014	334024507	/nfs/dbraw/zinc/02/45/07/334024507.db2.gz	BBGIBANPJINESD-KTKRTIGZSA-N	0	0	291.354	4.155	20	30		CIEDRN
N#CCSCCCS[C@H]1CCCc2ccccc21	ZINC000075076435	334027272	/nfs/dbraw/zinc/02/72/72/334027272.db2.gz	HJIRWAKESUUZMI-HNNXBMFYSA-N	0	0	277.458	4.444	20	30		CIEDRN
N#Cc1cccc(/C=C\c2nc([C@H]3CCCCS3)no2)c1	ZINC000546515798	334036805	/nfs/dbraw/zinc/03/68/05/334036805.db2.gz	YWQMKKQKRWWREK-WBTMPAOCSA-N	0	0	297.383	4.070	20	30		CIEDRN
C=CCOc1ccccc1CNc1nccc2sccc21	ZINC000546594645	334039305	/nfs/dbraw/zinc/03/93/05/334039305.db2.gz	PGOOJBSTIZAFFJ-UHFFFAOYSA-N	0	0	296.395	4.473	20	30		CIEDRN
CCN(CCC#N)C(=O)C[C@@H](C)c1ccc(C(C)C)cc1	ZINC000133406235	334040213	/nfs/dbraw/zinc/04/02/13/334040213.db2.gz	MSBWMQMLZBFIKD-OAHLLOKOSA-N	0	0	286.419	4.066	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N[C@@H](c1ccccc1C)C1CC1	ZINC000546660891	334044572	/nfs/dbraw/zinc/04/45/72/334044572.db2.gz	VTLMMXYKUHDYKK-NVXWUHKLSA-N	0	0	286.419	4.100	20	30		CIEDRN
N#CCc1ccc(NC/C=C\c2ccc(F)cc2F)cc1	ZINC000546782800	334050527	/nfs/dbraw/zinc/05/05/27/334050527.db2.gz	PMSQLXXJVKLFIJ-UPHRSURJSA-N	0	0	284.309	4.156	20	30		CIEDRN
C=CCC[C@@H](NC(=O)[C@@H](C)c1cccnc1)c1ccccc1	ZINC000133713975	334050963	/nfs/dbraw/zinc/05/09/63/334050963.db2.gz	QZEHQVGBRGTRMV-MAUKXSAKSA-N	0	0	294.398	4.009	20	30		CIEDRN
C[C@H]1CCC[C@@H](c2noc(-c3cccc(CC#N)c3)n2)C1	ZINC000547052025	334064117	/nfs/dbraw/zinc/06/41/17/334064117.db2.gz	CTGFYWPZTILYKK-GXTWGEPZSA-N	0	0	281.359	4.096	20	30		CIEDRN
C[C@H]1CCCC[C@@H]1c1noc(-c2ccc(CC#N)cc2)n1	ZINC000547108085	334067091	/nfs/dbraw/zinc/06/70/91/334067091.db2.gz	WVVSYCARXZCKFJ-WFASDCNBSA-N	0	0	281.359	4.096	20	30		CIEDRN
Cc1ccc(NCc2ccc(C#N)o2)cc1OCCC(C)C	ZINC000236779589	334070764	/nfs/dbraw/zinc/07/07/64/334070764.db2.gz	PVTZBMXIJTWKFH-UHFFFAOYSA-N	0	0	298.386	4.497	20	30		CIEDRN
CC#CCCCc1nc(-c2cccc(C(F)(F)F)c2)no1	ZINC000547346605	334081910	/nfs/dbraw/zinc/08/19/10/334081910.db2.gz	XKIPOBITRVKZLK-UHFFFAOYSA-N	0	0	294.276	4.101	20	30		CIEDRN
CC[C@@H](C)N(C(=O)c1ccc(Cl)c(C#N)c1)[C@@H](C)CC	ZINC000547348263	334082221	/nfs/dbraw/zinc/08/22/21/334082221.db2.gz	IHGFBVZTQCRSIR-TXEJJXNPSA-N	0	0	292.810	4.251	20	30		CIEDRN
C=CCCCN(C)C(=O)N[C@H](C)c1cccc(Cl)c1	ZINC000076939871	334091711	/nfs/dbraw/zinc/09/17/11/334091711.db2.gz	ZDCPRTBDZAUMMI-GFCCVEGCSA-N	0	0	280.799	4.009	20	30		CIEDRN
Cc1cccc(OC(F)F)c1NCc1ccccc1C#N	ZINC000076941379	334091732	/nfs/dbraw/zinc/09/17/32/334091732.db2.gz	WTTUUAZEKOFLLT-UHFFFAOYSA-N	0	0	288.297	4.080	20	30		CIEDRN
Cc1cccc(NCc2cccc(C#N)c2)c1Cl	ZINC000237694341	334095300	/nfs/dbraw/zinc/09/53/00/334095300.db2.gz	NAYSMEXCRKCBGH-UHFFFAOYSA-N	0	0	256.736	4.132	20	30		CIEDRN
Cc1ccnc(N(C)[C@H](C)c2cccc(Cl)c2)c1C#N	ZINC000135076723	334114544	/nfs/dbraw/zinc/11/45/44/334114544.db2.gz	PPVYJIAYVPKHKO-GFCCVEGCSA-N	0	0	285.778	4.113	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CCCC[C@H]1C(C)C)c1ccccc1	ZINC000135100921	334115404	/nfs/dbraw/zinc/11/54/04/334115404.db2.gz	QVWRFHZFDGLHSC-WMZOPIPTSA-N	0	0	285.431	4.383	20	30		CIEDRN
C[C@H](NCc1ccc(C#N)o1)c1ccc(Cl)cc1Cl	ZINC000135126541	334116871	/nfs/dbraw/zinc/11/68/71/334116871.db2.gz	LOCKKLPNZFVKKT-VIFPVBQESA-N	0	0	295.169	4.309	20	30		CIEDRN
N#CCN(Cc1csc2ccccc12)C1CCCC1	ZINC000078003545	334120272	/nfs/dbraw/zinc/12/02/72/334120272.db2.gz	AIKSGKXORQNZET-UHFFFAOYSA-N	0	0	270.401	4.169	20	30		CIEDRN
CCCNc1ccc(C#N)cc1NC(=O)C1=CCCCCC1	ZINC000547841592	334126111	/nfs/dbraw/zinc/12/61/11/334126111.db2.gz	NTVOIGAMBXQIMC-UHFFFAOYSA-N	0	0	297.402	4.209	20	30		CIEDRN
C=CCSc1ccccc1C(=O)Nc1ccc(F)cc1	ZINC000547931328	334129735	/nfs/dbraw/zinc/12/97/35/334129735.db2.gz	HNHNTOSZDJRCSV-UHFFFAOYSA-N	0	0	287.359	4.356	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(-c2nccs2)cc1	ZINC000135506052	334131979	/nfs/dbraw/zinc/13/19/79/334131979.db2.gz	YXNLZCIJJZEYGU-INIZCTEOSA-N	0	0	286.400	4.351	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H]1CCSc2ccc(F)cc21	ZINC000135501579	334132057	/nfs/dbraw/zinc/13/20/57/334132057.db2.gz	IPEPPCRHDDBCEY-CZUORRHYSA-N	0	0	293.407	4.081	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1ccc(-c2nccs2)cc1	ZINC000135506034	334132072	/nfs/dbraw/zinc/13/20/72/334132072.db2.gz	YXNLZCIJJZEYGU-MRXNPFEDSA-N	0	0	286.400	4.351	20	30		CIEDRN
C=CC[C@H](C(=O)NCCCC(C)(C)C)c1ccccc1	ZINC000547976929	334132898	/nfs/dbraw/zinc/13/28/98/334132898.db2.gz	APJCQSDFAOGGEO-INIZCTEOSA-N	0	0	273.420	4.289	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N1CCCC[C@@H]1CC(C)C	ZINC000135584946	334133891	/nfs/dbraw/zinc/13/38/91/334133891.db2.gz	VNSUKCVQLCPMKB-MRXNPFEDSA-N	0	0	299.418	4.299	20	30		CIEDRN
C=CCCC(=O)N(c1ccc(C)cn1)C1CCCCC1	ZINC000078568919	334136261	/nfs/dbraw/zinc/13/62/61/334136261.db2.gz	NRXWAZZDOCVEDO-UHFFFAOYSA-N	0	0	272.392	4.022	20	30		CIEDRN
CCCCc1nc(CSc2cc(C#N)ccn2)cs1	ZINC000078755163	334140292	/nfs/dbraw/zinc/14/02/92/334140292.db2.gz	XJOQGFPTRWRRDB-UHFFFAOYSA-N	0	0	289.429	4.045	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1ncc(CC)s1)c1ccccc1	ZINC000136355758	334152685	/nfs/dbraw/zinc/15/26/85/334152685.db2.gz	NIXPYCAXTYFMLG-GFCCVEGCSA-N	0	0	286.400	4.004	20	30		CIEDRN
Cc1ccc(NC(=O)c2cccc(SCC#N)c2)cc1C	ZINC000079380251	334152982	/nfs/dbraw/zinc/15/29/82/334152982.db2.gz	ZKKXZKQAKJSYMV-UHFFFAOYSA-N	0	0	296.395	4.171	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)N[C@H]1CCC[C@@H](C)C1	ZINC000079517343	334156105	/nfs/dbraw/zinc/15/61/05/334156105.db2.gz	UKWOXWDSNRSDBZ-KGLIPLIRSA-N	0	0	292.448	4.024	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(-c2c[nH]c3ccccc23)no1	ZINC000576264633	335179462	/nfs/dbraw/zinc/17/94/62/335179462.db2.gz	GVMKCPZHRIRQAT-MRXNPFEDSA-N	0	0	267.332	4.072	20	30		CIEDRN
CC[C@@H](C#N)Nc1ccc(-c2ccccc2)cc1C	ZINC000548683716	334165591	/nfs/dbraw/zinc/16/55/91/334165591.db2.gz	FHOSLQBMIDBXMB-INIZCTEOSA-N	0	0	250.345	4.376	20	30		CIEDRN
C=CCCCNC(=O)Cc1coc2ccc3ccccc3c12	ZINC000548719870	334167145	/nfs/dbraw/zinc/16/71/45/334167145.db2.gz	NTBNHFUDDBDZBE-UHFFFAOYSA-N	0	0	293.366	4.211	20	30		CIEDRN
CC(C)(C)c1ccc(CN(CC#N)C2CCCC2)cc1	ZINC000080215750	334167552	/nfs/dbraw/zinc/16/75/52/334167552.db2.gz	UIEHZMKMOFIBNC-UHFFFAOYSA-N	0	0	270.420	4.252	20	30		CIEDRN
C=C[C@H](CC(=O)N1CC[C@@H](CC(C)C)C1)c1ccccc1	ZINC000137086389	334169692	/nfs/dbraw/zinc/16/96/92/334169692.db2.gz	YNHMDSKDOPCNEC-DLBZAZTESA-N	0	0	285.431	4.241	20	30		CIEDRN
Cc1ccc(C#N)cc1NCc1ncc(-c2cccs2)o1	ZINC000080757353	334173202	/nfs/dbraw/zinc/17/32/02/334173202.db2.gz	HWLGRJSSCBAHKQ-UHFFFAOYSA-N	0	0	295.367	4.195	20	30		CIEDRN
Cc1cc(Cl)c2ncc(C#N)c(N3CCC[C@H]3C)c2c1	ZINC000548987664	334182039	/nfs/dbraw/zinc/18/20/39/334182039.db2.gz	GDQOGCGHKYWLFK-LLVKDONJSA-N	0	0	285.778	4.057	20	30		CIEDRN
C=CCCC(=O)COc1ccc(OCC2CC2)c(Cl)c1	ZINC000549060702	334184102	/nfs/dbraw/zinc/18/41/02/334184102.db2.gz	QPBIVFLEQGNFIK-UHFFFAOYSA-N	0	0	294.778	4.043	20	30		CIEDRN
C[C@@H]1CC[C@@H](Sc2nc(C(F)(F)F)ccc2C#N)C1	ZINC000549393275	334192202	/nfs/dbraw/zinc/19/22/02/334192202.db2.gz	LPMRIXDQHLZIJE-PSASIEDQSA-N	0	0	286.322	4.253	20	30		CIEDRN
C=C(C)Cn1c([C@H](C)CC)nnc1N(C)Cc1ccccc1	ZINC000549639800	334200728	/nfs/dbraw/zinc/20/07/28/334200728.db2.gz	PVQLSJNQEYGQRM-OAHLLOKOSA-N	0	0	298.434	4.004	20	30		CIEDRN
N#CCc1ccccc1NC(=O)c1cc2ccccc2s1	ZINC000549693694	334201762	/nfs/dbraw/zinc/20/17/62/334201762.db2.gz	LZKNXQPFJZXADN-UHFFFAOYSA-N	0	0	292.363	4.220	20	30		CIEDRN
CC(C)c1nccc(Oc2ccc(C#N)c3ccccc23)n1	ZINC000549697934	334202168	/nfs/dbraw/zinc/20/21/68/334202168.db2.gz	YRKKKVUXZZWRFL-UHFFFAOYSA-N	0	0	289.338	4.417	20	30		CIEDRN
C=CCn1c(S[C@H]2C=CCCCCC2)nnc1C1CC1	ZINC000550004661	334211240	/nfs/dbraw/zinc/21/12/40/334211240.db2.gz	IYKQRJWMUORSMZ-AWEZNQCLSA-N	0	0	289.448	4.323	20	30		CIEDRN
C[C@@](C#N)(NC(=O)[C@@H]1CCCC(C)(C)C1)C1CCCCC1	ZINC000550123339	334213598	/nfs/dbraw/zinc/21/35/98/334213598.db2.gz	WDXBSYNZABZDSU-KDOFPFPSSA-N	0	0	290.451	4.182	20	30		CIEDRN
C[C@H]1CCN(Cc2ccc(C#N)s2)[C@@H](c2ccco2)C1	ZINC000245746732	334217025	/nfs/dbraw/zinc/21/70/25/334217025.db2.gz	MWCFLJCQBNLWBI-SWLSCSKDSA-N	0	0	286.400	4.186	20	30		CIEDRN
CC1(C)CCC[C@H](CC(=O)N2CCc3ccc(C#N)cc32)C1	ZINC000550522949	334223846	/nfs/dbraw/zinc/22/38/46/334223846.db2.gz	IATNRWRQYSKOGI-CQSZACIVSA-N	0	0	296.414	4.054	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1nc(CC)cs1)c1ccccc1	ZINC000550581847	334224673	/nfs/dbraw/zinc/22/46/73/334224673.db2.gz	FOQLUHYFZZVCDL-GFCCVEGCSA-N	0	0	286.400	4.004	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H](CCC)Cc1ccccc1	ZINC000550604919	334225106	/nfs/dbraw/zinc/22/51/06/334225106.db2.gz	YZIZGHXOIXSMNM-INIZCTEOSA-N	0	0	273.420	4.116	20	30		CIEDRN
C=CCc1ccccc1OCc1csc(C2CC2)n1	ZINC000550857187	334230529	/nfs/dbraw/zinc/23/05/29/334230529.db2.gz	WFSAXNHDIDFPGI-UHFFFAOYSA-N	0	0	271.385	4.328	20	30		CIEDRN
CCc1c(NCc2ccc(C#N)cc2)cnn1C(CC)CC	ZINC000550986773	334235355	/nfs/dbraw/zinc/23/53/55/334235355.db2.gz	BYRZMPHGJRDZQS-UHFFFAOYSA-N	0	0	296.418	4.290	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1ccc2cc(C)ccc2n1	ZINC000550994283	334235781	/nfs/dbraw/zinc/23/57/81/334235781.db2.gz	KPDRIKOSPOKYJI-UHFFFAOYSA-N	0	0	296.414	4.362	20	30		CIEDRN
C=CCC(F)(F)c1nc(-c2cccc(CSC)c2)no1	ZINC000550998030	334235784	/nfs/dbraw/zinc/23/57/84/334235784.db2.gz	JYLRSAQMOWWGGD-UHFFFAOYSA-N	0	0	296.342	4.268	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2ccc3cc(C)ccc3n2)n1	ZINC000551108934	334238836	/nfs/dbraw/zinc/23/88/36/334238836.db2.gz	GVXNOLNPBHOYHU-UHFFFAOYSA-N	0	0	293.370	4.447	20	30		CIEDRN
C=CC[N@@H+](CCc1ccc(OC)cc1)Cc1ccccc1F	ZINC000551227641	334241608	/nfs/dbraw/zinc/24/16/08/334241608.db2.gz	PSBFRDQKQFPWOK-UHFFFAOYSA-N	0	0	299.389	4.065	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1ccc(F)c(C#N)c1	ZINC000551367923	334248114	/nfs/dbraw/zinc/24/81/14/334248114.db2.gz	FHMOCPFILPJHQS-UHFFFAOYSA-N	0	0	294.329	4.068	20	30		CIEDRN
C=CCC(F)(F)c1nc(-c2cnc3ccsc3c2)no1	ZINC000551383441	334248806	/nfs/dbraw/zinc/24/88/06/334248806.db2.gz	NAHDLYGKHPJOPQ-UHFFFAOYSA-N	0	0	293.298	4.014	20	30		CIEDRN
C=CCC(F)(F)c1nc(-c2cc3cc(C)ccc3o2)no1	ZINC000551429353	334250288	/nfs/dbraw/zinc/25/02/88/334250288.db2.gz	HVRNYAVQXBKZBN-UHFFFAOYSA-N	0	0	290.269	4.459	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2csc(C(C)(C)C)n2)n1	ZINC000551497506	334251686	/nfs/dbraw/zinc/25/16/86/334251686.db2.gz	ZMKQFIHJSXZQTE-UHFFFAOYSA-N	0	0	291.420	4.344	20	30		CIEDRN
C=C(C)[C@H](Cc1nc([C@H]2CCCC[C@H]2CC)no1)OCC	ZINC000551533588	334253094	/nfs/dbraw/zinc/25/30/94/334253094.db2.gz	BPTXHBUHTBBTBX-ILXRZTDVSA-N	0	0	292.423	4.277	20	30		CIEDRN
CC[C@@H]1CCCC[C@H]1c1noc(Cc2cccc(C#N)c2)n1	ZINC000551535390	334253326	/nfs/dbraw/zinc/25/33/26/334253326.db2.gz	XYCGTMWAVJPGIC-HZPDHXFCSA-N	0	0	295.386	4.216	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NC(C)(C)c1ccc(Cl)cc1	ZINC000551695942	334258148	/nfs/dbraw/zinc/25/81/48/334258148.db2.gz	RBBKPZNRJDWELA-GFCCVEGCSA-N	0	0	279.811	4.294	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc2nc(C3CC3)oc2c1	ZINC000551761456	334259967	/nfs/dbraw/zinc/25/99/67/334259967.db2.gz	NVDVWEUYHUGAQS-UHFFFAOYSA-N	0	0	284.359	4.246	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N1[C@H](C)C[C@@H]2CCCC[C@H]21	ZINC000246550634	334264186	/nfs/dbraw/zinc/26/41/86/334264186.db2.gz	TZOAMGSNBJCTGW-UKPHBRMFSA-N	0	0	297.402	4.052	20	30		CIEDRN
C=C(C)CCc1noc(Cc2coc3cc(C)ccc23)n1	ZINC000552044325	334280898	/nfs/dbraw/zinc/28/08/98/334280898.db2.gz	DARDETHUXAUITL-UHFFFAOYSA-N	0	0	282.343	4.224	20	30		CIEDRN
CCC(C)(C)C(=O)CSc1ccc(C#N)cc1Cl	ZINC000564390262	334316025	/nfs/dbraw/zinc/31/60/25/334316025.db2.gz	PIFVXVHXQKGCOJ-UHFFFAOYSA-N	0	0	281.808	4.309	20	30		CIEDRN
C=CCC[C@H](Nc1cccc(C(=O)NCC)c1)c1ccco1	ZINC000552070471	334285508	/nfs/dbraw/zinc/28/55/08/334285508.db2.gz	RBXDICUKIYCVBO-INIZCTEOSA-N	0	0	298.386	4.149	20	30		CIEDRN
CCC[N@H+](Cc1ccc(C)cc1)Cc1ccc(C#N)cc1	ZINC000248107346	334294840	/nfs/dbraw/zinc/29/48/40/334294840.db2.gz	PNNIHBLFNGKUSI-UHFFFAOYSA-N	0	0	278.399	4.279	20	30		CIEDRN
CCC(CC)NC(=O)c1ccccc1-c1ccccc1C#N	ZINC000248246201	334297632	/nfs/dbraw/zinc/29/76/32/334297632.db2.gz	HDDQEGVUICXTOW-UHFFFAOYSA-N	0	0	292.382	4.144	20	30		CIEDRN
C=CCC(C)(C)C(=O)N1CC[C@H](C(C)(C)C)C[C@@H]1C	ZINC000552195953	334301458	/nfs/dbraw/zinc/30/14/58/334301458.db2.gz	IRUNBCWGIBPBTR-KBPBESRZSA-N	0	0	265.441	4.262	20	30		CIEDRN
CCN(C[C@@H](C)C#N)[C@H](C)c1cccc(Cl)c1F	ZINC000248577899	334306851	/nfs/dbraw/zinc/30/68/51/334306851.db2.gz	UPSBSPNLLFXMIO-WDEREUQCSA-N	0	0	268.763	4.022	20	30		CIEDRN
CCC(CC)[C@@H](C)C(=O)Nc1cc(C#N)ccc1NC1CC1	ZINC000552245073	334307546	/nfs/dbraw/zinc/30/75/46/334307546.db2.gz	NIXQBYUDLAXYKD-GFCCVEGCSA-N	0	0	299.418	4.143	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)N[C@@H]1CCC[C@@H](C(C)(C)C)CC1	ZINC000552491527	334331683	/nfs/dbraw/zinc/33/16/83/334331683.db2.gz	RBOPJVSXTHNJMZ-CKEIUWERSA-N	0	0	278.440	4.037	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)N[C@H]1CCC[C@@H](C(C)(C)C)CC1	ZINC000552491530	334331688	/nfs/dbraw/zinc/33/16/88/334331688.db2.gz	RBOPJVSXTHNJMZ-JKIFEVAISA-N	0	0	278.440	4.037	20	30		CIEDRN
CCC(C)(C)c1ccc(NC(=O)[C@](C)(C#N)CC)cc1	ZINC000552541923	334334567	/nfs/dbraw/zinc/33/45/67/334334567.db2.gz	OIQCNCKFNUZLHW-KRWDZBQOSA-N	0	0	272.392	4.253	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1coc2ccc(CC)cc21	ZINC000552550658	334335014	/nfs/dbraw/zinc/33/50/14/334335014.db2.gz	HRLAQLYXGSNJRM-CQSZACIVSA-N	0	0	283.371	4.176	20	30		CIEDRN
CC[C@H](CC1CCCC1)C(=O)Nc1cc(C#N)ccc1NC	ZINC000552587486	334338005	/nfs/dbraw/zinc/33/80/05/334338005.db2.gz	NGPMYOZTWUASIB-OAHLLOKOSA-N	0	0	299.418	4.145	20	30		CIEDRN
C=CCN(CC=C)C(=O)c1coc2ccc(C(C)C)cc21	ZINC000552695979	334342777	/nfs/dbraw/zinc/34/27/77/334342777.db2.gz	OAKCFDPQNAISEI-UHFFFAOYSA-N	0	0	283.371	4.370	20	30		CIEDRN
CN(Cc1ccccc1)c1ccc(C#N)cc1C(F)(F)F	ZINC000552697213	334342935	/nfs/dbraw/zinc/34/29/35/334342935.db2.gz	XVIMEYRPBOJJJR-UHFFFAOYSA-N	0	0	290.288	4.213	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CC2(CCC2)[C@H]1C(C)C)c1ccccc1	ZINC000552723611	334343450	/nfs/dbraw/zinc/34/34/50/334343450.db2.gz	QKOGIXCTCQFZKQ-QFBILLFUSA-N	0	0	297.442	4.383	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc2c(Cl)cccc2n1	ZINC000552780270	334344846	/nfs/dbraw/zinc/34/48/46/334344846.db2.gz	JHYLXBLVMOGSDJ-LLVKDONJSA-N	0	0	288.778	4.429	20	30		CIEDRN
Cc1ccc(CSCc2cc(C#N)ccc2F)cc1	ZINC000552824747	334346660	/nfs/dbraw/zinc/34/66/60/334346660.db2.gz	MVAXKLWIIPVERE-UHFFFAOYSA-N	0	0	271.360	4.439	20	30		CIEDRN
CC(C)c1ccc2occ(C(=O)N(CCC#N)C(C)C)c2c1	ZINC000552896745	334349887	/nfs/dbraw/zinc/34/98/87/334349887.db2.gz	VTJYOIYNWSDDFP-UHFFFAOYSA-N	0	0	298.386	4.320	20	30		CIEDRN
C=C1CCN(CCOc2cc(Cl)ccc2Cl)CC1	ZINC000553026267	334357386	/nfs/dbraw/zinc/35/73/86/334357386.db2.gz	IDHMCJFATMKRKF-UHFFFAOYSA-N	0	0	286.202	4.024	20	30		CIEDRN
CC(C)C[C@](C)(C#N)NC(=O)CCCCC(C)(C)C	ZINC000553237179	334370908	/nfs/dbraw/zinc/37/09/08/334370908.db2.gz	OHKGMMGTNDBWJP-MRXNPFEDSA-N	0	0	266.429	4.037	20	30		CIEDRN
CCC[C@H]1[C@H](C)CCCN1c1nccc(C#N)c1Cl	ZINC000553154895	334365549	/nfs/dbraw/zinc/36/55/49/334365549.db2.gz	SMAGKCWIHOIUID-YPMHNXCESA-N	0	0	277.799	4.012	20	30		CIEDRN
CC(C)(C)CCCCC(=O)NCC1CCC(C#N)CC1	ZINC000553235080	334370778	/nfs/dbraw/zinc/37/07/78/334370778.db2.gz	CHDALLLETRVGEF-UHFFFAOYSA-N	0	0	278.440	4.039	20	30		CIEDRN
CCC[C@H](Nc1cc(C#N)ccn1)c1ccc(F)cc1F	ZINC000553443830	334385624	/nfs/dbraw/zinc/38/56/24/334385624.db2.gz	LXBVHWXONZGJGX-HNNXBMFYSA-N	0	0	287.313	4.185	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@@H]1CCCc2sc(Cl)cc21	ZINC000553490760	334388028	/nfs/dbraw/zinc/38/80/28/334388028.db2.gz	QKPAMBUYHFTIAY-ABAIWWIYSA-N	0	0	297.851	4.497	20	30		CIEDRN
C[C@@H](Nc1cc(C#N)ccn1)c1cc(Cl)ccc1Cl	ZINC000553542728	334390655	/nfs/dbraw/zinc/39/06/55/334390655.db2.gz	KMYUXQBKWYFMEY-SECBINFHSA-N	0	0	292.169	4.433	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1C[C@H](C)C[C@H]1c1ccccc1	ZINC000553792451	334398928	/nfs/dbraw/zinc/39/89/28/334398928.db2.gz	MSQWUJPVFISCFK-PVAVHDDUSA-N	0	0	286.419	4.134	20	30		CIEDRN
CC(C)(C#N)CCN1CC2(CCC2)c2c1cccc2F	ZINC000554053888	334407907	/nfs/dbraw/zinc/40/79/07/334407907.db2.gz	ZWDJARMHVGUQHY-UHFFFAOYSA-N	0	0	272.367	4.007	20	30		CIEDRN
CC(C)[C@H](NCc1ccc(C#N)cn1)c1ccccc1Cl	ZINC000554365221	334424777	/nfs/dbraw/zinc/42/47/77/334424777.db2.gz	CPUGRRZJIWPUMV-KRWDZBQOSA-N	0	0	299.805	4.094	20	30		CIEDRN
CCc1cc(C#N)c(NC(=O)CC2(C)CCCC2)s1	ZINC000554698392	334447336	/nfs/dbraw/zinc/44/73/36/334447336.db2.gz	WANBOFJSKRFFGO-UHFFFAOYSA-N	0	0	276.405	4.091	20	30		CIEDRN
Cc1csc(NC(=O)c2ccc3sccc3c2)c1C#N	ZINC000554774479	334451652	/nfs/dbraw/zinc/45/16/52/334451652.db2.gz	MGBUZIHSLHLLTH-UHFFFAOYSA-N	0	0	298.392	4.395	20	30		CIEDRN
C=CCCC1(c2nc([C@@H](C)Oc3ccccc3)no2)CC1	ZINC000554803562	334453277	/nfs/dbraw/zinc/45/32/77/334453277.db2.gz	QFSKUINUEJWKNZ-CYBMUJFWSA-N	0	0	284.359	4.207	20	30		CIEDRN
N#CCc1ccc(NCc2cscc2C(F)(F)F)cc1	ZINC000554978085	334463170	/nfs/dbraw/zinc/46/31/70/334463170.db2.gz	FOEXIXSSYLNWEH-UHFFFAOYSA-N	0	0	296.317	4.445	20	30		CIEDRN
C[C@@H]1C[C@@H](Sc2cccc(Cl)c2C#N)C[C@H](C)O1	ZINC000555041362	334465993	/nfs/dbraw/zinc/46/59/93/334465993.db2.gz	PCOFIKVVICPPJK-JGPRNRPPSA-N	0	0	281.808	4.260	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)NCc1ccc2sccc2c1	ZINC000555111067	334468948	/nfs/dbraw/zinc/46/89/48/334468948.db2.gz	FYBNQMJBXVTYKZ-MRXNPFEDSA-N	0	0	273.401	4.120	20	30		CIEDRN
N#CCc1ccccc1NC(=O)CC/C=C\c1ccccc1	ZINC000555526653	334480546	/nfs/dbraw/zinc/48/05/46/334480546.db2.gz	HOGLLXBPOLFTLP-WMZJFQQLSA-N	0	0	290.366	4.185	20	30		CIEDRN
C=C(C)[C@H](CC(=O)N(CC(C)C)c1ccccc1)OCC	ZINC000555586758	334483134	/nfs/dbraw/zinc/48/31/34/334483134.db2.gz	AQMZSCRCSPEKGD-KRWDZBQOSA-N	0	0	289.419	4.047	20	30		CIEDRN
CC(C)C[C@](C)(C#N)NC(=O)[C@H](C)CC1CCCCC1	ZINC000555883270	334491056	/nfs/dbraw/zinc/49/10/56/334491056.db2.gz	UEFMSCKFQRIYSI-RHSMWYFYSA-N	0	0	278.440	4.037	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc(-c2ccccn2)cc1	ZINC000564522245	334510705	/nfs/dbraw/zinc/51/07/05/334510705.db2.gz	VEVQJHKEHANEBF-UHFFFAOYSA-N	0	0	292.382	4.456	20	30		CIEDRN
C=CCCCCCNC(=O)N1Cc2ccccc2[C@@H]1C	ZINC000565177790	334543107	/nfs/dbraw/zinc/54/31/07/334543107.db2.gz	GBULCXHSLOMORR-AWEZNQCLSA-N	0	0	272.392	4.019	20	30		CIEDRN
N#Cc1c(NCCC2CC(F)(F)C2)cccc1C(F)F	ZINC000565225983	334546377	/nfs/dbraw/zinc/54/63/77/334546377.db2.gz	IFKKZHHLVMMSHE-UHFFFAOYSA-N	0	0	286.272	4.343	20	30		CIEDRN
C=CCCCC(=O)N1C[C@@H](C)CSc2ccccc21	ZINC000565586770	334576353	/nfs/dbraw/zinc/57/63/53/334576353.db2.gz	IXCNNDVQFKVQQX-CYBMUJFWSA-N	0	0	275.417	4.118	20	30		CIEDRN
Cc1cc(Oc2ncnc3ccsc32)c(C)c(C)c1C#N	ZINC000565648953	334583561	/nfs/dbraw/zinc/58/35/61/334583561.db2.gz	PTFBVXKXVXFDBA-UHFFFAOYSA-N	0	0	295.367	4.281	20	30		CIEDRN
CSCCCS[C@@H](C)c1ccc(C#N)cc1	ZINC000153352753	334592753	/nfs/dbraw/zinc/59/27/53/334592753.db2.gz	JQHLXOHBAPWLMG-NSHDSACASA-N	0	0	251.420	4.106	20	30		CIEDRN
CCc1ccc(C(=O)N[C@@H](CCC#N)c2ccccc2)cc1	ZINC000153445264	334603993	/nfs/dbraw/zinc/60/39/93/334603993.db2.gz	UWYSOMWUKIXLHL-SFHVURJKSA-N	0	0	292.382	4.024	20	30		CIEDRN
CC1(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)CC1	ZINC000153487320	334608742	/nfs/dbraw/zinc/60/87/42/334608742.db2.gz	RMSNVPDUELQODX-UHFFFAOYSA-N	0	0	292.338	4.089	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](C(C)(C)C)C[C@@H]1C	ZINC000565973404	334613382	/nfs/dbraw/zinc/61/33/82/334613382.db2.gz	RNQZVGUDKSCGHW-KKUMJFAQSA-N	0	0	265.441	4.262	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](C(C)(C)C)C[C@H]1C	ZINC000565973415	334613399	/nfs/dbraw/zinc/61/33/99/334613399.db2.gz	RNQZVGUDKSCGHW-ZNMIVQPWSA-N	0	0	265.441	4.262	20	30		CIEDRN
CCc1ccnc(CNc2cccc(C(F)F)c2C#N)c1	ZINC000566485850	334651949	/nfs/dbraw/zinc/65/19/49/334651949.db2.gz	WMGCFUXISPOWTD-UHFFFAOYSA-N	0	0	287.313	4.065	20	30		CIEDRN
Cc1nnc(SCc2ccccc2C2CC2)c(C#N)c1C	ZINC000566730701	334662047	/nfs/dbraw/zinc/66/20/47/334662047.db2.gz	QJBROFLAKPEVBD-UHFFFAOYSA-N	0	0	295.411	4.135	20	30		CIEDRN
CC(C)C[C@@H](C)CC(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000153724657	334678273	/nfs/dbraw/zinc/67/82/73/334678273.db2.gz	KWBPJGPWZHSOQP-WBVHZDCISA-N	0	0	286.419	4.220	20	30		CIEDRN
CCN(C(=O)c1ccc(C#N)c(Cl)c1)C1CCCCC1	ZINC000153987087	334684767	/nfs/dbraw/zinc/68/47/67/334684767.db2.gz	XYJQPRRKPRDOND-UHFFFAOYSA-N	0	0	290.794	4.006	20	30		CIEDRN
C[C@H](CNc1ccc(CC#N)cc1)Cc1ccccc1	ZINC000154244934	334691457	/nfs/dbraw/zinc/69/14/57/334691457.db2.gz	XLNNEFOSSOKFSY-HNNXBMFYSA-N	0	0	264.372	4.043	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1ccc(OC)c(F)c1)c1ccccc1	ZINC000154828728	334705350	/nfs/dbraw/zinc/70/53/50/334705350.db2.gz	RPFITJGTIRUWPA-CYBMUJFWSA-N	0	0	299.345	4.133	20	30		CIEDRN
CC#CCCS[C@@H](C)c1nc(-c2ccccc2C)no1	ZINC000154966549	334709375	/nfs/dbraw/zinc/70/93/75/334709375.db2.gz	NITMHIAHSWECGI-ZDUSSCGKSA-N	0	0	286.400	4.253	20	30		CIEDRN
CC(C)(C#N)c1ccccc1CNc1ccc2c(c1)COC2	ZINC000155545442	334723582	/nfs/dbraw/zinc/72/35/82/334723582.db2.gz	GCWZXZMDWKWJGM-UHFFFAOYSA-N	0	0	292.382	4.130	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@@H]1CCC(C)C	ZINC000155571136	334724342	/nfs/dbraw/zinc/72/43/42/334724342.db2.gz	WJUGVLOGWBLSMK-MRXNPFEDSA-N	0	0	263.425	4.182	20	30		CIEDRN
CC[C@](C)(C#N)NC(=O)C[C@@H]1C[C@@H](C(C)C)c2ccccc21	ZINC000567538287	334729990	/nfs/dbraw/zinc/72/99/90/334729990.db2.gz	DYTJGGVDTKBDRK-UCLAIMLFSA-N	0	0	298.430	4.112	20	30		CIEDRN
C=C(C)CNC(=O)N(C)[C@@H](C)[C@H](C)c1ccc(Cl)cc1	ZINC000156362201	334740809	/nfs/dbraw/zinc/74/08/09/334740809.db2.gz	OKSSKJVIQFBGJM-STQMWFEESA-N	0	0	294.826	4.050	20	30		CIEDRN
CC1(CC(=O)N(CCC#N)c2ccc(F)cc2)CCCC1	ZINC000567664509	334748816	/nfs/dbraw/zinc/74/88/16/334748816.db2.gz	RRYVEVQJYIMPNK-UHFFFAOYSA-N	0	0	288.366	4.043	20	30		CIEDRN
Cc1ccc(C)c(C(=O)N(C)c2cc(Cl)ccc2C#N)c1	ZINC000156765763	334749349	/nfs/dbraw/zinc/74/93/49/334749349.db2.gz	JZVOKDSBAHITKN-UHFFFAOYSA-N	0	0	298.773	4.105	20	30		CIEDRN
Cc1cc(NCc2cc(Cl)sc2Cl)cc(C#N)n1	ZINC000312753262	334753770	/nfs/dbraw/zinc/75/37/70/334753770.db2.gz	LGOLKWMZMLQTOV-UHFFFAOYSA-N	0	0	298.198	4.242	20	30		CIEDRN
CCCCN(C(=O)c1ccc(C#N)cc1)[C@@H]1CCC[C@@H](C)C1	ZINC000567948035	334778143	/nfs/dbraw/zinc/77/81/43/334778143.db2.gz	HVAHHUPCKDAWGH-CRAIPNDOSA-N	0	0	298.430	4.379	20	30		CIEDRN
Cc1ccc(C#N)c(S[C@H]2CCCc3ccccc32)n1	ZINC000568055248	334787954	/nfs/dbraw/zinc/78/79/54/334787954.db2.gz	QJAZYYRCSHVYPS-INIZCTEOSA-N	0	0	280.396	4.431	20	30		CIEDRN
N#CCc1ccc(NC2CC(c3cc(F)cc(F)c3)C2)cc1	ZINC000568139915	334795532	/nfs/dbraw/zinc/79/55/32/334795532.db2.gz	XRGVRNQMYNJCAO-UHFFFAOYSA-N	0	0	298.336	4.389	20	30		CIEDRN
C=CCCCCSCC(=O)c1[nH]c(C)c(C(C)=O)c1C	ZINC000568609972	334832432	/nfs/dbraw/zinc/83/24/32/334832432.db2.gz	ASBOZRHDUHNNOJ-UHFFFAOYSA-N	0	0	293.432	4.106	20	30		CIEDRN
C=C(C)CCc1noc(Cc2cccc(C)c2Cl)n1	ZINC000568681785	334836184	/nfs/dbraw/zinc/83/61/84/334836184.db2.gz	XVUKHDBKLZXSCM-UHFFFAOYSA-N	0	0	276.767	4.131	20	30		CIEDRN
N#Cc1cc(C(=O)Nc2cccc3ccsc32)ccc1F	ZINC000569246060	334863627	/nfs/dbraw/zinc/86/36/27/334863627.db2.gz	ZWXINVPOEZCLQP-UHFFFAOYSA-N	0	0	296.326	4.164	20	30		CIEDRN
N#Cc1ccc(S[C@H]2Cc3ccccc3C2=O)c(Cl)c1	ZINC000163326796	334866880	/nfs/dbraw/zinc/86/68/80/334866880.db2.gz	UNFHZMVRDVGHDU-HNNXBMFYSA-N	0	0	299.782	4.111	20	30		CIEDRN
Cc1cccnc1SCc1ccc(Cl)cc1C#N	ZINC000572730465	334874428	/nfs/dbraw/zinc/87/44/28/334874428.db2.gz	WLDOUCBUNOOSQQ-UHFFFAOYSA-N	0	0	274.776	4.207	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CCC[C@H]1c1ccccc1	ZINC000572744730	334875334	/nfs/dbraw/zinc/87/53/34/334875334.db2.gz	MZUDUONHOQHTSY-HYVNUMGLSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CCn1c2ccccc2nc1SCCCCC#N	ZINC000164623025	334884325	/nfs/dbraw/zinc/88/43/25/334884325.db2.gz	GFZZRKZZZSVPDD-UHFFFAOYSA-N	0	0	271.389	4.008	20	30		CIEDRN
CCN(C(=O)c1sc2ccc(C#N)cc2c1C)C1CCC1	ZINC000576365773	335195349	/nfs/dbraw/zinc/19/53/49/335195349.db2.gz	YEHWWKWBYLLHKJ-UHFFFAOYSA-N	0	0	298.411	4.096	20	30		CIEDRN
CCCN(Cc1ccc(C#N)cc1)C(=O)CC(C)(C)C1CC1	ZINC000576413450	335201402	/nfs/dbraw/zinc/20/14/02/335201402.db2.gz	APJGYFCDFGPMBJ-UHFFFAOYSA-N	0	0	298.430	4.123	20	30		CIEDRN
CC(C)(C#N)c1ccc(-c2nc(-c3cccs3)no2)cc1	ZINC000576548859	335217898	/nfs/dbraw/zinc/21/78/98/335217898.db2.gz	IQSBBIZYPAKWKH-UHFFFAOYSA-N	0	0	295.367	4.266	20	30		CIEDRN
Cc1csc(NC(=O)c2cc(Cl)ccc2C)c1C#N	ZINC000576619068	335226789	/nfs/dbraw/zinc/22/67/89/335226789.db2.gz	FEFZSCKQMJPWLD-UHFFFAOYSA-N	0	0	290.775	4.142	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1C[C@H](c2ccccc2)[C@@H]2CCC[C@@H]21	ZINC000576689925	335235064	/nfs/dbraw/zinc/23/50/64/335235064.db2.gz	HVYMYMWRXPKOFY-KANFNMMFSA-N	0	0	297.442	4.383	20	30		CIEDRN
C=C(C)CCc1noc([C@@H]2CC[C@@H](C(F)(F)F)C2)n1	ZINC000577025780	335283738	/nfs/dbraw/zinc/28/37/38/335283738.db2.gz	SVLLVNWMHDZTAI-NXEZZACHSA-N	0	0	274.286	4.024	20	30		CIEDRN
Cc1nsc(Sc2ccc(F)c(Cl)c2)c1C#N	ZINC000580671811	335320135	/nfs/dbraw/zinc/32/01/35/335320135.db2.gz	HBNCIFVGAZGZTE-UHFFFAOYSA-N	0	0	284.768	4.267	20	30		CIEDRN
CC(C)c1noc(-c2cn(CCCC#N)c3ccccc23)n1	ZINC000577246245	335329359	/nfs/dbraw/zinc/32/93/59/335329359.db2.gz	YCSIWULCHDBZBD-UHFFFAOYSA-N	0	0	294.358	4.118	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(C)c(OCC)c2)CC1	ZINC000577397219	335348280	/nfs/dbraw/zinc/34/82/80/335348280.db2.gz	HCRTYRKCVPEVIL-UHFFFAOYSA-N	0	0	273.376	4.079	20	30		CIEDRN
C=C(C)CCc1noc([C@@H](c2ccccc2)N(CC)CC)n1	ZINC000577560774	335368600	/nfs/dbraw/zinc/36/86/00/335368600.db2.gz	MCCGITUGCWINGG-QGZVFWFLSA-N	0	0	299.418	4.010	20	30		CIEDRN
C=C(C)CCc1noc([C@H](c2ccccc2)N(CC)CC)n1	ZINC000577560773	335368780	/nfs/dbraw/zinc/36/87/80/335368780.db2.gz	MCCGITUGCWINGG-KRWDZBQOSA-N	0	0	299.418	4.010	20	30		CIEDRN
C[C@@H](NCc1cc(C#N)cs1)c1c(F)cccc1Cl	ZINC000177714083	335381500	/nfs/dbraw/zinc/38/15/00/335381500.db2.gz	WZLDUTRTNVOPRS-SECBINFHSA-N	0	0	294.782	4.263	20	30		CIEDRN
C=CCCCC[C@@H](C)Nc1ccc2c(c1)CCC(=O)N2C	ZINC000577972458	335444412	/nfs/dbraw/zinc/44/44/12/335444412.db2.gz	WTDKQSCXILPLAG-CQSZACIVSA-N	0	0	286.419	4.142	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1cccc(C#N)c1C)c1ccccc1	ZINC000179387562	335490937	/nfs/dbraw/zinc/49/09/37/335490937.db2.gz	GABAJDHHHXYRRL-HNNXBMFYSA-N	0	0	290.366	4.165	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)C(C)(C)C1CCCC1	ZINC000179460613	335495685	/nfs/dbraw/zinc/49/56/85/335495685.db2.gz	HUEWLLAJZYZUJB-UHFFFAOYSA-N	0	0	270.376	4.022	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1oc(-c2ccccc2)nc1C	ZINC000179790727	335518623	/nfs/dbraw/zinc/51/86/23/335518623.db2.gz	DQYVTXFEXWFUDA-ZDUSSCGKSA-N	0	0	298.386	4.125	20	30		CIEDRN
Cc1nnc(-c2cccc(C#N)c2)n1CCC1=CCCCC1	ZINC000578428570	335632915	/nfs/dbraw/zinc/63/29/15/335632915.db2.gz	QPENUMNHVRFOSQ-UHFFFAOYSA-N	0	0	292.386	4.016	20	30		CIEDRN
N#Cc1cccc(SC[C@@H]2CCC(F)(F)C2)c1	ZINC000578878381	335683742	/nfs/dbraw/zinc/68/37/42/335683742.db2.gz	XMISMMWWBFDUCQ-LLVKDONJSA-N	0	0	253.317	4.086	20	30		CIEDRN
Cc1coc(-c2ccc(C)c(N[C@@H]3CC[C@@H](C#N)C3)c2)n1	ZINC000578957189	335693065	/nfs/dbraw/zinc/69/30/65/335693065.db2.gz	CIPXMNWYHIJNSM-UKRRQHHQSA-N	0	0	281.359	4.063	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N(C)[C@@H]1CCc2ccccc21	ZINC000181089392	335749990	/nfs/dbraw/zinc/74/99/90/335749990.db2.gz	ZGJXPUVSBFCSDM-RHSMWYFYSA-N	0	0	286.419	4.060	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N1CCC[C@@H]1c1cccs1	ZINC000181429457	335761833	/nfs/dbraw/zinc/76/18/33/335761833.db2.gz	FPTVZKUHWMQXIL-UONOGXRCSA-N	0	0	292.448	4.339	20	30		CIEDRN
COc1cccc(F)c1[C@@H](C)N[C@H](C)c1cccc(C#N)c1	ZINC000181824155	335786999	/nfs/dbraw/zinc/78/69/99/335786999.db2.gz	YKSFFIODPZKFQF-CHWSQXEVSA-N	0	0	298.361	4.118	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)C[C@H](C=C)c1ccccc1	ZINC000182619860	335831093	/nfs/dbraw/zinc/83/10/93/335831093.db2.gz	FNOGENVGIGDEBR-CVEARBPZSA-N	0	0	271.404	4.207	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)[C@H](C)c1ccc(Cl)s1	ZINC000182621001	335831258	/nfs/dbraw/zinc/83/12/58/335831258.db2.gz	OXIDZHDGUCTXJJ-GHMZBOCLSA-N	0	0	285.840	4.366	20	30		CIEDRN
CC[C@@H](CC#N)NC(=O)CC1CCC(c2ccccc2)CC1	ZINC000183940355	335913420	/nfs/dbraw/zinc/91/34/20/335913420.db2.gz	DWYOHFKROZHWFO-VJFUWPCTSA-N	0	0	298.430	4.159	20	30		CIEDRN
CC[C@@H]1CCCC[C@@H]1C(=O)N[C@](C)(C#N)C1CCCCC1	ZINC000579904883	335920373	/nfs/dbraw/zinc/92/03/73/335920373.db2.gz	HWFKPKOTAYPUBK-UWWQBHOKSA-N	0	0	290.451	4.182	20	30		CIEDRN
C=CCCCc1nc(C2(OCCC)CCCCC2)no1	ZINC000581157234	336016478	/nfs/dbraw/zinc/01/64/78/336016478.db2.gz	DRJCWZGERSJWBI-UHFFFAOYSA-N	0	0	278.396	4.164	20	30		CIEDRN
C/C=C\c1ccc(NCc2cn3ccccc3c2C#N)cc1	ZINC000581276175	336035666	/nfs/dbraw/zinc/03/56/66/336035666.db2.gz	YGEYKVCYKYHZCC-DJWKRKHSSA-N	0	0	287.366	4.456	20	30		CIEDRN
N#CCc1ccc(N[C@H]2CCCC23CCCC3)cc1	ZINC000380881816	336038294	/nfs/dbraw/zinc/03/82/94/336038294.db2.gz	CQVKHBQEYOEHPE-INIZCTEOSA-N	0	0	254.377	4.277	20	30		CIEDRN
C=CCCCCCNc1ccc(C(=O)N2CCCC2)cc1	ZINC000195447466	336053998	/nfs/dbraw/zinc/05/39/98/336053998.db2.gz	KKHAPPSMVYGXRO-UHFFFAOYSA-N	0	0	286.419	4.081	20	30		CIEDRN
N#Cc1ccc(OC[C@H]2CCCC2(F)F)c(Cl)c1	ZINC000381697093	336071182	/nfs/dbraw/zinc/07/11/82/336071182.db2.gz	OHXGHPAEAGQWSL-SNVBAGLBSA-N	0	0	271.694	4.026	20	30		CIEDRN
N#Cc1ccc(OC[C@@H]2CCCCC2(F)F)cc1Cl	ZINC000382244159	336084864	/nfs/dbraw/zinc/08/48/64/336084864.db2.gz	WMCKHNGRUPOJGD-NSHDSACASA-N	0	0	285.721	4.416	20	30		CIEDRN
N#Cc1ccc(NCC2CC(F)(F)C2)cc1C(F)(F)F	ZINC000383289465	336106871	/nfs/dbraw/zinc/10/68/71/336106871.db2.gz	QONWLILRTVOMEG-UHFFFAOYSA-N	0	0	290.235	4.034	20	30		CIEDRN
Cc1cc(C#N)ccc1-c1nc([C@@H]2CCCC[C@@H]2C)no1	ZINC000384959282	336135002	/nfs/dbraw/zinc/13/50/02/336135002.db2.gz	HCPCIUOILVOGFC-SMDDNHRTSA-N	0	0	281.359	4.210	20	30		CIEDRN
CN(Cc1ccccc1C(F)(F)F)c1ccc(C#N)cc1	ZINC000384996667	336135639	/nfs/dbraw/zinc/13/56/39/336135639.db2.gz	OIFBMKDJYMNGTN-UHFFFAOYSA-N	0	0	290.288	4.213	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCc1cccc(SCC)c1	ZINC000581731477	336139340	/nfs/dbraw/zinc/13/93/40/336139340.db2.gz	BMBDDUGSRPERFK-CYBMUJFWSA-N	0	0	277.433	4.017	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cc3ccncc3s2)n1	ZINC000581768200	336144658	/nfs/dbraw/zinc/14/46/58/336144658.db2.gz	UNAWHPISXOTIAP-UHFFFAOYSA-N	0	0	285.372	4.200	20	30		CIEDRN
N#Cc1cc(F)ccc1NC(=O)c1cccc2ccsc21	ZINC000386201228	336168028	/nfs/dbraw/zinc/16/80/28/336168028.db2.gz	FDKVTXFINXGXSG-UHFFFAOYSA-N	0	0	296.326	4.164	20	30		CIEDRN
CCCCCCCCCC(=O)Nc1cccc(CO)c1	ZINC000103321272	519977364	/nfs/dbraw/zinc/97/73/64/519977364.db2.gz	PMJMRQCNVDTQEN-UHFFFAOYSA-N	0	0	277.408	4.258	20	30		CIEDRN
C[C@@H]1C[C@@H]1c1ccc(CN(CCC#N)CC(C)(C)C)o1	ZINC000353421032	533743830	/nfs/dbraw/zinc/74/38/30/533743830.db2.gz	IVXXMBLHRGCRKO-HIFRSBDPSA-N	0	0	274.408	4.165	20	30		CIEDRN
C[C@@H]1CCC[C@@H](NC(=O)C[C@H](CC#N)c2ccccc2)CC1	ZINC000331999070	533766751	/nfs/dbraw/zinc/76/67/51/533766751.db2.gz	NQGVJADTOOUZSD-BPQIPLTHSA-N	0	0	298.430	4.159	20	30		CIEDRN
C[C@@H]1CCC[C@@H]1CC(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000352197951	533779933	/nfs/dbraw/zinc/77/99/33/533779933.db2.gz	HICHURONLHONDJ-NXHRZFHOSA-N	0	0	298.430	4.364	20	30		CIEDRN
C[C@@H]1CCC[C@H](c2noc([C@@]3(C#N)CC34CCCC4)n2)C1	ZINC000333788826	533882173	/nfs/dbraw/zinc/88/21/73/533882173.db2.gz	CYDZMLSNHZTRGO-IGCXYCKISA-N	0	0	285.391	4.089	20	30		CIEDRN
C[C@H](Nc1cc(C2CC2)ccn1)c1cccc(C#N)c1	ZINC000353536890	534015582	/nfs/dbraw/zinc/01/55/82/534015582.db2.gz	CPSHPHLGXVIOSZ-LBPRGKRZSA-N	0	0	263.344	4.004	20	30		CIEDRN
C[C@@H]1C[C@H]1[C@@H](Nc1ncccc1C#N)c1ccc(Cl)cc1	ZINC000301468050	534044410	/nfs/dbraw/zinc/04/44/10/534044410.db2.gz	RDIVBRCJQCNPRU-LYRGGWFBSA-N	0	0	297.789	4.416	20	30		CIEDRN
Cc1cc2cc(CN(CCC#N)CC3CC3)oc2cc1C	ZINC000353415830	534085725	/nfs/dbraw/zinc/08/57/25/534085725.db2.gz	JYPXYQYOANNVAQ-UHFFFAOYSA-N	0	0	282.387	4.175	20	30		CIEDRN
C[C@@H]1NC(=O)CC[C@@H]1NC(=O)[C@@H]1CCC[C@@H]2CCCC[C@@H]12	ZINC000329079197	534092891	/nfs/dbraw/zinc/09/28/91/534092891.db2.gz	BXHBYIDWQAKGRJ-AHDPXTMNSA-N	0	0	292.423	4.057	20	30		CIEDRN
C[C@@H]1CC(C)(C)CC[C@@H]1NC(=O)Cc1ccc2n[nH]cc2c1	ZINC000330012038	534143358	/nfs/dbraw/zinc/14/33/58/534143358.db2.gz	JXIKZLGYTKRBDB-DOMZBBRYSA-N	0	0	299.418	4.277	20	30		CIEDRN
C[C@@H]1CCCC[C@@H]1c1noc([C@]2(C#N)CC23CCCC3)n1	ZINC000333784641	534167459	/nfs/dbraw/zinc/16/74/59/534167459.db2.gz	CEXYENVKWZBOGR-IIYDPXPESA-N	0	0	285.391	4.089	20	30		CIEDRN
C[C@@H]1CC[C@H](CC(=O)N[C@@H](CCCC#N)c2ccccc2)C1	ZINC000352192483	534232123	/nfs/dbraw/zinc/23/21/23/534232123.db2.gz	MNFORDHFGKLMDL-RYRKJORJSA-N	0	0	298.430	4.364	20	30		CIEDRN
O=C(Nc1csc(-c2ccccn2)n1)C1CCCCC1	ZINC000329563900	534330684	/nfs/dbraw/zinc/33/06/84/534330684.db2.gz	SCVBYOCAQKILSC-UHFFFAOYSA-N	0	0	287.388	4.373	20	30		CIEDRN
O=C(Nc1nc(C2CC2)c[nH]1)[C@@H]1C[C@H]1C1CCCCC1	ZINC000329458274	534333133	/nfs/dbraw/zinc/33/31/33/534333133.db2.gz	OFGWDUKAAFSCNA-QWHCGFSZSA-N	0	0	273.380	4.092	20	30		CIEDRN
O=C(Nc1nc(C2CC2)c[nH]1)[C@@H]1CCC[C@@H]2CCCC[C@H]12	ZINC000329300865	534333717	/nfs/dbraw/zinc/33/37/17/534333717.db2.gz	MPXNCVWOIJAELJ-FPMFFAJLSA-N	0	0	287.407	4.482	20	30		CIEDRN
O=C(Nc1nnc(-c2ccccc2)s1)[C@@H]1CC12CCCC2	ZINC000329999863	534334899	/nfs/dbraw/zinc/33/48/99/534334899.db2.gz	VLYBVNPCGJBOOU-LBPRGKRZSA-N	0	0	299.399	4.373	20	30		CIEDRN
C[C@@H]1CCCC[C@H]1Nc1c(C#N)cnc2ccccc21	ZINC000037507641	518179163	/nfs/dbraw/zinc/17/91/63/518179163.db2.gz	DIUJTQWDJCBFQL-IUODEOHRSA-N	0	0	265.360	4.097	20	30		CIEDRN
CC(C)(C)Nc1ccccc1NCc1cccc(C#N)c1	ZINC000276513420	518775661	/nfs/dbraw/zinc/77/56/61/518775661.db2.gz	ZVHBBHVXONSFPS-UHFFFAOYSA-N	0	0	279.387	4.381	20	30		CIEDRN
Cc1noc(C2CC2)c1NC(=O)[C@@H]1CCc2ccccc21	ZINC000329686846	534386371	/nfs/dbraw/zinc/38/63/71/534386371.db2.gz	BGTLYJWQCMPYCX-CQSZACIVSA-N	0	0	282.343	4.178	20	30		CIEDRN
CC(C)(C)c1csc(Nc2ccc(C#N)cc2)n1	ZINC000049500115	519088293	/nfs/dbraw/zinc/08/82/93/519088293.db2.gz	KSONCWLNVAVWBH-UHFFFAOYSA-N	0	0	257.362	4.056	20	30		CIEDRN
CC(C)[C@@H](c1ccccc1)N(C)C(=O)c1cccc(C#N)c1	ZINC000112586512	519801500	/nfs/dbraw/zinc/80/15/00/519801500.db2.gz	TXNPMASRTNMIPO-SFHVURJKSA-N	0	0	292.382	4.028	20	30		CIEDRN
CCN(C(=O)/C=C/C(C)(C)C)[C@@H](C)c1ccc(C#N)cc1	ZINC000264593785	519897805	/nfs/dbraw/zinc/89/78/05/519897805.db2.gz	BKYIJONEQWZVCD-GETOMWPZSA-N	0	0	284.403	4.070	20	30		CIEDRN
CCN(C(=O)c1ccc(C)cc1)[C@@H](C)c1ccc(C#N)cc1	ZINC000045499001	520080222	/nfs/dbraw/zinc/08/02/22/520080222.db2.gz	QFKSWMXTERCCOD-HNNXBMFYSA-N	0	0	292.382	4.090	20	30		CIEDRN
CCCCSCCC(=O)Nc1ccc(C#N)cc1Cl	ZINC000269124242	520955193	/nfs/dbraw/zinc/95/51/93/520955193.db2.gz	FEUWMQKOLBXARV-UHFFFAOYSA-N	0	0	296.823	4.074	20	30		CIEDRN
Cc1oc(C(C)C)nc1C(=O)N[C@@H]1CC[C@@H]2CCC[C@@H]2C1	ZINC000329151996	534543426	/nfs/dbraw/zinc/54/34/26/534543426.db2.gz	BBSXMMQJUMOQOL-BFHYXJOUSA-N	0	0	290.407	4.380	20	30		CIEDRN
Cc1sc(NC(=O)C[C@@H]2CCC[C@H]2C)c(C#N)c1C	ZINC000346684558	534612715	/nfs/dbraw/zinc/61/27/15/534612715.db2.gz	GZRVXZOKRFIOMY-SKDRFNHKSA-N	0	0	276.405	4.001	20	30		CIEDRN
CC[C@@H](C)Oc1cc(C)ccc1CNc1cnccc1C#N	ZINC000354546484	522258706	/nfs/dbraw/zinc/25/87/06/522258706.db2.gz	VBAYZKBQNZGQPV-CQSZACIVSA-N	0	0	295.386	4.051	20	30		CIEDRN
CCc1nc([C@H](C)Nc2c(F)cc(C#N)cc2F)cs1	ZINC000264748703	522457873	/nfs/dbraw/zinc/45/78/73/522457873.db2.gz	LRLLAMBVDCLGPG-QMMMGPOBSA-N	0	0	293.342	4.028	20	30		CIEDRN
Cc1cnc([C@H](C)S[C@@H](C)c2ccc(C#N)cc2)o1	ZINC000356077667	534661549	/nfs/dbraw/zinc/66/15/49/534661549.db2.gz	LAMRDVAVTABYDU-RYUDHWBXSA-N	0	0	272.373	4.410	20	30		CIEDRN
N#CC[C@H](CC(=O)N(C1CCC1)C1CCC1)c1ccccc1	ZINC000346739632	534714174	/nfs/dbraw/zinc/71/41/74/534714174.db2.gz	VXBFFKGOLSIHFJ-MRXNPFEDSA-N	0	0	296.414	4.008	20	30		CIEDRN
CO[C@H](C)c1nc(CSc2ccc(C#N)cc2)cs1	ZINC000356561786	523917845	/nfs/dbraw/zinc/91/78/45/523917845.db2.gz	DKIZAKXOWMGYBB-SNVBAGLBSA-N	0	0	290.413	4.014	20	30		CIEDRN
C[C@H](CCc1ccco1)Nc1ccc(Cl)cc1C#N	ZINC000052858019	524261978	/nfs/dbraw/zinc/26/19/78/524261978.db2.gz	ZNXMRRFHORYWIZ-LLVKDONJSA-N	0	0	274.751	4.238	20	30		CIEDRN
C[C@H]1CC[C@@H](CC(=O)N(C)c2cc(Cl)ccc2C#N)C1	ZINC000156794246	524344106	/nfs/dbraw/zinc/34/41/06/524344106.db2.gz	JVTRKFCFZLAZJP-NWDGAFQWSA-N	0	0	290.794	4.001	20	30		CIEDRN
C[C@@H]1CCC[C@H](CCn2cc(C#N)c(=O)c3ccccc32)C1	ZINC000338404540	524373715	/nfs/dbraw/zinc/37/37/15/524373715.db2.gz	AMIAXFBBHGRDFW-HUUCEWRRSA-N	0	0	294.398	4.090	20	30		CIEDRN
Cc1csc(C(=O)Nc2cccc(C#N)c2C)c1Cl	ZINC000336584016	534789489	/nfs/dbraw/zinc/78/94/89/534789489.db2.gz	IFGZDBJOKZRTSY-UHFFFAOYSA-N	0	0	290.775	4.142	20	30		CIEDRN
N#Cc1cnccc1/C=C\c1csc(-c2cccs2)n1	ZINC000347425165	534828583	/nfs/dbraw/zinc/82/85/83/534828583.db2.gz	HIALRIZXLACZEM-ARJAWSKDSA-N	0	0	295.392	4.309	20	30		CIEDRN
N#Cc1ncccc1OCc1csc(C2CCCCC2)n1	ZINC000330042272	534831473	/nfs/dbraw/zinc/83/14/73/534831473.db2.gz	CBZSZJBBCGAKAF-UHFFFAOYSA-N	0	0	299.399	4.036	20	30		CIEDRN
C[C@H](Nc1ncc(C#N)cc1Cl)c1ccc(F)cc1F	ZINC000339244007	525681364	/nfs/dbraw/zinc/68/13/64/525681364.db2.gz	TYYFUDOHXLHEOJ-QMMMGPOBSA-N	0	0	293.704	4.058	20	30		CIEDRN
C[C@@H](Nc1cccc(C(F)(F)F)n1)c1ccc(C#N)cc1	ZINC000044271484	525715513	/nfs/dbraw/zinc/71/55/13/525715513.db2.gz	JJJZMPLULYQGER-SNVBAGLBSA-N	0	0	291.276	4.145	20	30		CIEDRN
Cc1nc(C)c(CNC(=O)C[C@H](C)C2CCCCC2)o1	ZINC000329196424	534881168	/nfs/dbraw/zinc/88/11/68/534881168.db2.gz	UTSMXYIANPYHJD-NSHDSACASA-N	0	0	278.396	4.354	20	30		CIEDRN
Cc1ccc(-c2ncco2)cc1NCc1ccc(C#N)s1	ZINC000157135320	525837384	/nfs/dbraw/zinc/83/73/84/525837384.db2.gz	IKFYKQGVBVRBKW-UHFFFAOYSA-N	0	0	295.367	4.195	20	30		CIEDRN
CSc1ccc(Nc2cccc(C#N)n2)cc1Cl	ZINC000301859599	526046306	/nfs/dbraw/zinc/04/63/06/526046306.db2.gz	SSJARMAHJKSVGK-UHFFFAOYSA-N	0	0	275.764	4.072	20	30		CIEDRN
Cc1cc(C#N)cc(N[C@@H]2CCSc3c(F)cccc32)n1	ZINC000341542821	526186698	/nfs/dbraw/zinc/18/66/98/526186698.db2.gz	FNHKKXPRBQDMLD-CQSZACIVSA-N	0	0	299.374	4.050	20	30		CIEDRN
C/C=C/c1ccc(NC(=O)NCC(C)(C)CCC#N)cc1	ZINC000353290799	526302992	/nfs/dbraw/zinc/30/29/92/526302992.db2.gz	SSBUGDVGFUUBGT-GQCTYLIASA-N	0	0	285.391	4.171	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)c1ccoc1C1CC1	ZINC000344255824	526375809	/nfs/dbraw/zinc/37/58/09/526375809.db2.gz	FSZMOKTVIGHCIM-UHFFFAOYSA-N	0	0	287.384	4.047	20	30		CIEDRN
C=CCN(Cc1ncc(CC)s1)Cc1ccccc1F	ZINC000346163731	526382900	/nfs/dbraw/zinc/38/29/00/526382900.db2.gz	CFVJZYRUSFRCGO-UHFFFAOYSA-N	0	0	290.407	4.033	20	30		CIEDRN
C=C(C)CCSCC(=O)c1cc(C)n(CC)c1C	ZINC000350722114	526460626	/nfs/dbraw/zinc/46/06/26/526460626.db2.gz	ZHEHSCPHBQXZLV-UHFFFAOYSA-N	0	0	265.422	4.007	20	30		CIEDRN
C=C(C)CCS[C@@H](C)C(=O)Nc1c(C)cccc1C	ZINC000350720465	526462811	/nfs/dbraw/zinc/46/28/11/526462811.db2.gz	PQOQNCYTSPCKNJ-AWEZNQCLSA-N	0	0	277.433	4.330	20	30		CIEDRN
C=C(C)CCc1noc(-c2sccc2C2CC2)n1	ZINC000347209401	526466241	/nfs/dbraw/zinc/46/62/41/526466241.db2.gz	GQYVQBZJLXYFGP-UHFFFAOYSA-N	0	0	260.362	4.184	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1cscc1-c1ccccc1	ZINC000355661606	526500301	/nfs/dbraw/zinc/50/03/01/526500301.db2.gz	XODVDOWTVLFXNI-UHFFFAOYSA-N	0	0	271.385	4.063	20	30		CIEDRN
N#Cc1ccc(NCc2cccc(C(F)F)c2)cc1	ZINC000155966515	526663892	/nfs/dbraw/zinc/66/38/92/526663892.db2.gz	LRIUBQGPPVUPLG-UHFFFAOYSA-N	0	0	258.271	4.108	20	30		CIEDRN
N#Cc1ccc(N[C@@H](c2ccc(Cl)cc2)C2CC2)nc1	ZINC000042847979	526665600	/nfs/dbraw/zinc/66/56/00/526665600.db2.gz	UKVPFASFBKTCTQ-MRXNPFEDSA-N	0	0	283.762	4.170	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000352166334	526702110	/nfs/dbraw/zinc/70/21/10/526702110.db2.gz	MZENTVDDWLBRDD-NVXWUHKLSA-N	0	0	284.403	4.140	20	30		CIEDRN
C=CCOCC(=O)Nc1c(C(C)C)cccc1C(C)C	ZINC000354732592	526718592	/nfs/dbraw/zinc/71/85/92/526718592.db2.gz	NZMFVRIEAWJDCV-UHFFFAOYSA-N	0	0	275.392	4.075	20	30		CIEDRN
CC(C)(C)[C@](C)(C#N)NC(=O)[C@@H]1CCC[C@@H]2CCCC[C@@H]12	ZINC000332656014	526741956	/nfs/dbraw/zinc/74/19/56/526741956.db2.gz	AKFJZCSIIVBRLD-BORJPKMPSA-N	0	0	290.451	4.037	20	30		CIEDRN
Cc1oc(C#N)cc1C(=O)N(C)c1ccc(C(C)(C)C)cc1	ZINC000280522342	526755662	/nfs/dbraw/zinc/75/56/62/526755662.db2.gz	FAUUJPBDMJRDEL-UHFFFAOYSA-N	0	0	296.370	4.034	20	30		CIEDRN
C=C(C)[C@@H](Nc1nc(C(C)C)no1)c1ccc(F)c(F)c1	ZINC000302435251	526758571	/nfs/dbraw/zinc/75/85/71/526758571.db2.gz	QHVNLBLEJVCGED-CYBMUJFWSA-N	0	0	293.317	4.201	20	30		CIEDRN
N#Cc1cnc(NCc2ccc(Cl)cc2F)c(Cl)c1	ZINC000302554418	526775164	/nfs/dbraw/zinc/77/51/64/526775164.db2.gz	XEFGAYAGSUCXJM-UHFFFAOYSA-N	0	0	296.132	4.011	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1c(C)cc(OC)c(C)c1C	ZINC000352906909	527047901	/nfs/dbraw/zinc/04/79/01/527047901.db2.gz	FBNJQLXAZPEICK-CQSZACIVSA-N	0	0	290.407	4.097	20	30		CIEDRN
C=CCC1(c2nc([C@H]3C[C@H]3c3ccccc3)no2)CCC1	ZINC000347269288	527067054	/nfs/dbraw/zinc/06/70/54/527067054.db2.gz	RSURIMOAOZAERF-GJZGRUSLSA-N	0	0	280.371	4.339	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)c2ccccc2F)CCCC1(C)C	ZINC000347448384	527117880	/nfs/dbraw/zinc/11/78/80/527117880.db2.gz	QPVWVLGOISGZRS-HNNXBMFYSA-N	0	0	275.367	4.033	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)c2cc(C)oc2C)CCCC1(C)C	ZINC000347422264	527117907	/nfs/dbraw/zinc/11/79/07/527117907.db2.gz	TXZIMLDBSBOFPW-HNNXBMFYSA-N	0	0	275.392	4.103	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1c[nH]c2cc(F)ccc12	ZINC000192945643	527127457	/nfs/dbraw/zinc/12/74/57/527127457.db2.gz	OUMVMJBGOUCLRP-UHFFFAOYSA-N	0	0	288.366	4.125	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(NCc2ccc(Cl)s2)c1	ZINC000347405249	527226052	/nfs/dbraw/zinc/22/60/52/527226052.db2.gz	YDOVFKFKENAMSP-UHFFFAOYSA-N	0	0	290.775	4.088	20	30		CIEDRN
C=CC[C@H]1N(C(=O)c2ccoc2Cl)CCCC1(C)C	ZINC000347476284	527226186	/nfs/dbraw/zinc/22/61/86/527226186.db2.gz	ZATWGWNVYIREHY-GFCCVEGCSA-N	0	0	281.783	4.140	20	30		CIEDRN
CC(C)(C#N)CC(=O)N1CCCC(C)(C)c2ccccc21	ZINC000346508327	527453640	/nfs/dbraw/zinc/45/36/40/527453640.db2.gz	SKSYTUVRFPGLBY-UHFFFAOYSA-N	0	0	284.403	4.031	20	30		CIEDRN
C=CCC[C@H](C(=O)NCCCC(C)(F)F)c1ccccc1	ZINC000295557232	527463905	/nfs/dbraw/zinc/46/39/05/527463905.db2.gz	KYOQYGWXRBXKHG-HNNXBMFYSA-N	0	0	295.373	4.288	20	30		CIEDRN
C=CCC[C@H](NC(=O)Cc1ccsc1C)c1ccccc1	ZINC000345855706	527475314	/nfs/dbraw/zinc/47/53/14/527475314.db2.gz	LYRRKHJFCARTGL-KRWDZBQOSA-N	0	0	299.439	4.423	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1nc(C2CC2)oc1C	ZINC000355810888	527511389	/nfs/dbraw/zinc/51/13/89/527511389.db2.gz	XUXFORJSLVKLAH-UHFFFAOYSA-N	0	0	296.370	4.231	20	30		CIEDRN
C=CCCc1noc(C[C@@H](C)c2c[nH]c3ccccc32)n1	ZINC000297269420	527513476	/nfs/dbraw/zinc/51/34/76/527513476.db2.gz	KPKFYAIVFGQHBQ-GFCCVEGCSA-N	0	0	281.359	4.016	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc2nc(C)sc2c1	ZINC000343736547	527525012	/nfs/dbraw/zinc/52/50/12/527525012.db2.gz	VSVPJMFPLUWAGV-HNNXBMFYSA-N	0	0	274.389	4.146	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cnn([C@H](C)CC)c1C1CC1	ZINC000353447334	527525351	/nfs/dbraw/zinc/52/53/51/527525351.db2.gz	JTSWMXSLSYKJKP-PXAZEXFGSA-N	0	0	289.423	4.272	20	30		CIEDRN
CC(=O)N[C@H](CC1CCC1)C(=O)N[C@@H]1CC12CCCCC2	ZINC000330112131	527544953	/nfs/dbraw/zinc/54/49/53/527544953.db2.gz	BPYFCSINOILHPT-HUUCEWRRSA-N	0	0	292.423	4.201	20	30		CIEDRN
CC(C)(C)C1CCC(CNC(=O)c2csc(=O)[nH]2)CC1	ZINC000329977289	527630820	/nfs/dbraw/zinc/63/08/20/527630820.db2.gz	FZQOUTVTHLZMFO-UHFFFAOYSA-N	0	0	296.436	4.006	20	30		CIEDRN
CC(C)(C)CN(CCC#N)C(=O)c1ccc(C(F)F)cc1	ZINC000344494993	527680169	/nfs/dbraw/zinc/68/01/69/527680169.db2.gz	RFGGBUGVTHNDPD-UHFFFAOYSA-N	0	0	294.345	4.026	20	30		CIEDRN
CC(C)CC[C@H](C)NC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000353852569	527837431	/nfs/dbraw/zinc/83/74/31/527837431.db2.gz	OPRVKOMPBBNUQK-DOTOQJQBSA-N	0	0	286.419	4.015	20	30		CIEDRN
CC1(CC(=O)Nc2cccc3c2OCCC3=O)CCCC1	ZINC000329327969	527919951	/nfs/dbraw/zinc/91/99/51/527919951.db2.gz	KEAYOHYZYCGODO-UHFFFAOYSA-N	0	0	287.359	4.210	20	30		CIEDRN
CC(C)[C@]1(C)C[C@H]1C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000352173755	527978826	/nfs/dbraw/zinc/97/88/26/527978826.db2.gz	FTECBWPJGHHBGG-LNLFQRSKSA-N	0	0	298.430	4.220	20	30		CIEDRN
CCCC1(C(=O)Nc2sc(C)c(C)c2C#N)CCC1	ZINC000345495580	528034294	/nfs/dbraw/zinc/03/42/94/528034294.db2.gz	RLVBQYVIKWRPPT-UHFFFAOYSA-N	0	0	276.405	4.146	20	30		CIEDRN
CC(C)Oc1c(Cl)cccc1N[C@H]1CC[C@H](C#N)C1	ZINC000442856599	528094612	/nfs/dbraw/zinc/09/46/12/528094612.db2.gz	OHSCUUWNLDXEOJ-RYUDHWBXSA-N	0	0	278.783	4.231	20	30		CIEDRN
CCC[C@H](CC)Nc1cc(C#N)c2cc([N+](=O)[O-])ccc2n1	ZINC000301388758	528107561	/nfs/dbraw/zinc/10/75/61/528107561.db2.gz	YTZXHOMPVABSMH-LBPRGKRZSA-N	0	0	298.346	4.005	20	30		CIEDRN
CCC[C@H](NC(=O)[C@H](C)C#N)c1ccc(Cl)c(Cl)c1	ZINC000347029252	528198562	/nfs/dbraw/zinc/19/85/62/528198562.db2.gz	AJTOFHMSCNJGPN-RNCFNFMXSA-N	0	0	299.201	4.110	20	30		CIEDRN
CC(C)Oc1ccc(Nc2snc(Cl)c2C#N)cc1	ZINC000301927486	528198913	/nfs/dbraw/zinc/19/89/13/528198913.db2.gz	KIMKJYNHNOGEIX-UHFFFAOYSA-N	0	0	293.779	4.199	20	30		CIEDRN
CC(C)Oc1ccc(Nc2ccc(Cl)c(C#N)n2)cc1	ZINC000301503494	528198930	/nfs/dbraw/zinc/19/89/30/528198930.db2.gz	FYARKGBWDOOVNZ-UHFFFAOYSA-N	0	0	287.750	4.137	20	30		CIEDRN
CC(C)c1ncc(NC(=O)C2CCCCCC2)cn1	ZINC000330103400	528355572	/nfs/dbraw/zinc/35/55/72/528355572.db2.gz	IRFKRTLZWMKHBM-UHFFFAOYSA-N	0	0	261.369	4.158	20	30		CIEDRN
CCN(CCC#N)C(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000353177323	528366816	/nfs/dbraw/zinc/36/68/16/528366816.db2.gz	WFPPKWFFVPJJHD-UHFFFAOYSA-N	0	0	293.370	4.121	20	30		CIEDRN
CCC(C)(C)C1CCC2(C[C@@H]2C(=O)N[C@@H](C)CC#N)CC1	ZINC000352102802	528492748	/nfs/dbraw/zinc/49/27/48/528492748.db2.gz	SJKQOMRTVREUCY-YOFIQYCBSA-N	0	0	290.451	4.037	20	30		CIEDRN
CC(C)C[C@H](NC(=O)c1sccc1C#N)c1ccccc1	ZINC000353603004	528569633	/nfs/dbraw/zinc/56/96/33/528569633.db2.gz	HZIOCOKJNWAVBE-HNNXBMFYSA-N	0	0	298.411	4.137	20	30		CIEDRN
CCOc1ccccc1N[C@H](C)c1ccc(OCC#N)cc1	ZINC000192911673	528746195	/nfs/dbraw/zinc/74/61/95/528746195.db2.gz	ADWPAEOWMWWSHD-CQSZACIVSA-N	0	0	296.370	4.161	20	30		CIEDRN
CC(C)[C@@H]1C[C@H](CC(=O)N(C)[C@@H](C)CC#N)c2ccccc21	ZINC000346043593	528775342	/nfs/dbraw/zinc/77/53/42/528775342.db2.gz	XBYRBQXFGQOUIJ-DAYGRLMNSA-N	0	0	298.430	4.064	20	30		CIEDRN
CCC(CC)SCCCC1(C#N)CCOCC1	ZINC000347782020	528806987	/nfs/dbraw/zinc/80/69/87/528806987.db2.gz	VZEZTNPEIKMGMI-UHFFFAOYSA-N	0	0	255.427	4.009	20	30		CIEDRN
CC1(C)CCC[C@@H]1C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000352207215	528961129	/nfs/dbraw/zinc/96/11/29/528961129.db2.gz	VDULKFBDCHJIFD-SJORKVTESA-N	0	0	298.430	4.364	20	30		CIEDRN
CC1(C)CCC[C@@H]1NC(=O)CCc1nc2ccccc2o1	ZINC000330228239	528961777	/nfs/dbraw/zinc/96/17/77/528961777.db2.gz	PNCPRJBGPBTWEJ-AWEZNQCLSA-N	0	0	286.375	4.296	20	30		CIEDRN
CCC1(NC(=O)C2CCC(NC(=O)C3CC3)CC2)CCC1	ZINC000330007601	528979386	/nfs/dbraw/zinc/97/93/86/528979386.db2.gz	FYTBPZNOLKDCLI-UHFFFAOYSA-N	0	0	292.423	4.201	20	30		CIEDRN
CCC1(C(=O)NCCc2nc(C)oc2C)CCCCC1	ZINC000329720068	528979709	/nfs/dbraw/zinc/97/97/09/528979709.db2.gz	DKZYSAVWLRFVBD-UHFFFAOYSA-N	0	0	278.396	4.151	20	30		CIEDRN
CC(C)[C@H](Nc1ncccc1C#N)c1ccccc1Cl	ZINC000301299990	529127126	/nfs/dbraw/zinc/12/71/26/529127126.db2.gz	QQFJCXGNAMXIQD-HNNXBMFYSA-N	0	0	285.778	4.416	20	30		CIEDRN
CC[C@H](C)[C@@H](C)C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000352225961	529200041	/nfs/dbraw/zinc/20/00/41/529200041.db2.gz	QFAGLBHFVSBVFC-UXLLHSPISA-N	0	0	286.419	4.220	20	30		CIEDRN
CCS[C@@H]1CCC[C@H](Nc2cccc(F)c2C#N)C1	ZINC000301522357	529216578	/nfs/dbraw/zinc/21/65/78/529216578.db2.gz	HIOTWMWEJRIZHC-NWDGAFQWSA-N	0	0	278.396	4.174	20	30		CIEDRN
CC[C@H]1CC[C@@H](C(=O)Nc2ccc3occ(C)c3c2)O1	ZINC000330068722	529247731	/nfs/dbraw/zinc/24/77/31/529247731.db2.gz	VRFRMYJOMUFKJP-WFASDCNBSA-N	0	0	273.332	4.287	20	30		CIEDRN
CC[C@@H]1CCCC[C@@H]1c1noc(C2(C#N)CCCC2)n1	ZINC000331590102	529284490	/nfs/dbraw/zinc/28/44/90/529284490.db2.gz	OPPALCWMRNFBBZ-OLZOCXBDSA-N	0	0	273.380	4.089	20	30		CIEDRN
CC(C)(c1ccnc(Cl)c1)N(CCC#N)C1CCCC1	ZINC001165016749	721836053	/nfs/dbraw/zinc/83/60/53/721836053.db2.gz	FUKDYLIIMANPOX-UHFFFAOYSA-N	0	0	291.826	4.128	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1nc(C)c(C(F)(F)F)s1	ZINC000573283759	334924323	/nfs/dbraw/zinc/92/43/23/334924323.db2.gz	OBMXBSFEHHCDPB-ZETCQYMHSA-N	0	0	292.326	4.011	20	30		CIEDRN
N#CCCCSCCOc1cccc2ccccc21	ZINC000082693294	178186697	/nfs/dbraw/zinc/18/66/97/178186697.db2.gz	ZOIKPFFKBHHRCN-UHFFFAOYSA-N	0	0	271.385	4.256	20	30		CIEDRN
N#Cc1cccc(CNc2ccc3c4c(cccc42)CC3)c1	ZINC000096993685	185148799	/nfs/dbraw/zinc/14/87/99/185148799.db2.gz	RKJMAJNLPZBMKV-UHFFFAOYSA-N	0	0	284.362	4.422	20	30		CIEDRN
CC[C@]1(C)C[C@H]1C(=O)Nc1c(C)[nH]nc1-c1ccccc1	ZINC000330172862	529412917	/nfs/dbraw/zinc/41/29/17/529412917.db2.gz	GUPFOMRZJYYLTC-SUMWQHHRSA-N	0	0	283.375	4.409	20	30		CIEDRN
CC[C@@]1(C)C[C@@H]1C(=O)Nc1c(C)[nH]nc1-c1ccccc1	ZINC000330172857	529536131	/nfs/dbraw/zinc/53/61/31/529536131.db2.gz	GUPFOMRZJYYLTC-DYVFJYSZSA-N	0	0	283.375	4.409	20	30		CIEDRN
CC[C@H](NC(=O)c1cccc(C#N)c1)c1cccc(Cl)c1	ZINC000344615388	529571044	/nfs/dbraw/zinc/57/10/44/529571044.db2.gz	HTVDCWAKTAYGQC-INIZCTEOSA-N	0	0	298.773	4.093	20	30		CIEDRN
CCc1cnc(CNC(=O)[C@@H]2CCC[C@@H]3CCCC[C@@H]23)o1	ZINC000329080341	529637788	/nfs/dbraw/zinc/63/77/88/529637788.db2.gz	COBOQXCSOVZBMY-NWANDNLSSA-N	0	0	290.407	4.300	20	30		CIEDRN
CCc1nc(C)c(C(=O)N[C@@H]2CCCCC23CCCC3)o1	ZINC000329132209	529717428	/nfs/dbraw/zinc/71/74/28/529717428.db2.gz	AQGLTIQRKDEPFF-CYBMUJFWSA-N	0	0	290.407	4.353	20	30		CIEDRN
CCc1ccc2c(c1)[C@H](CCNC(=O)C1(C)CC1)C(=O)N2	ZINC000329905524	529731303	/nfs/dbraw/zinc/73/13/03/529731303.db2.gz	JPUYJFUBIPBPEZ-LBPRGKRZSA-N	0	0	286.375	4.081	20	30		CIEDRN
C=C(C)CN(CC)C(=O)[C@H](c1ccccc1)[C@@H](C)CC	ZINC000098076121	185683287	/nfs/dbraw/zinc/68/32/87/185683287.db2.gz	VMDCAEQISYRKNB-RDJZCZTQSA-N	0	0	273.420	4.241	20	30		CIEDRN
C=C(C)CN(CC)C(=O)[C@@H](c1ccccc1)[C@H](C)CC	ZINC000098076122	185683325	/nfs/dbraw/zinc/68/33/25/185683325.db2.gz	VMDCAEQISYRKNB-NVXWUHKLSA-N	0	0	273.420	4.241	20	30		CIEDRN
Cc1ccc(Br)c(NCCCC(C)(C)C#N)c1	ZINC000090083966	260318250	/nfs/dbraw/zinc/31/82/50/260318250.db2.gz	YZPFFLVTCYLBFD-UHFFFAOYSA-N	0	0	295.224	4.499	20	30		CIEDRN
C=C(C)CCc1noc(-c2ccc(Cl)c3ncccc23)n1	ZINC000574238614	335003195	/nfs/dbraw/zinc/00/31/95/335003195.db2.gz	DHAACEMVGNKHSG-UHFFFAOYSA-N	0	0	299.761	4.447	20	30		CIEDRN
C[C@H](CC#N)Sc1ccccc1NCC1CCC1	ZINC000152723648	261068637	/nfs/dbraw/zinc/06/86/37/261068637.db2.gz	ZWNAQSJDWQEOPV-GFCCVEGCSA-N	0	0	260.406	4.293	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N(Cc1ccccc1)CC(C)(C)C	ZINC000574312379	335009227	/nfs/dbraw/zinc/00/92/27/335009227.db2.gz	HPKXFUINPUMKMH-HNNXBMFYSA-N	0	0	288.435	4.209	20	30		CIEDRN
CC(C)(C#N)CCSCCCOc1ccc(F)cc1	ZINC000574480399	335023041	/nfs/dbraw/zinc/02/30/41/335023041.db2.gz	VHTBVKQGRKFCJG-UHFFFAOYSA-N	0	0	281.396	4.268	20	30		CIEDRN
N#Cc1ccnc(NCC(c2ccccc2)c2ccccc2)c1	ZINC000574579303	335031499	/nfs/dbraw/zinc/03/14/99/335031499.db2.gz	BAWXGJIHIUWWNU-UHFFFAOYSA-N	0	0	299.377	4.197	20	30		CIEDRN
C=CCCCCCNc1cc(C(=O)N(C)C)ccc1Cl	ZINC000574715424	335042454	/nfs/dbraw/zinc/04/24/54/335042454.db2.gz	NJWPTIPRPSERSC-UHFFFAOYSA-N	0	0	294.826	4.200	20	30		CIEDRN
CSc1ccc(Cl)cc1NCc1nc(C#N)cs1	ZINC000352832315	532967959	/nfs/dbraw/zinc/96/79/59/532967959.db2.gz	FWHAOIIUNNCIGZ-UHFFFAOYSA-N	0	0	295.820	4.002	20	30		CIEDRN
C[C@H](CCC#N)Sc1ncc(C(C)(C)C)s1	ZINC000188325245	262153803	/nfs/dbraw/zinc/15/38/03/262153803.db2.gz	FAXWUSPETLWASP-SECBINFHSA-N	0	0	254.424	4.225	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](CC)c1cc(F)ccc1F	ZINC000185648335	260003394	/nfs/dbraw/zinc/00/33/94/260003394.db2.gz	GRMDJZYKOFPCGA-NHYWBVRUSA-N	0	0	281.346	4.134	20	30		CIEDRN
CCCCCCCCC[S@](=O)[C@@H](C)c1cnccn1	ZINC000190851924	262186501	/nfs/dbraw/zinc/18/65/01/262186501.db2.gz	LFANVXQHGLYKMJ-LIRRHRJNSA-N	0	0	282.453	4.037	20	30		CIEDRN
CCCCCN(CCCCC)C(=O)c1sccc1C#N	ZINC000497993885	262244332	/nfs/dbraw/zinc/24/43/32/262244332.db2.gz	OFXATIMIHCGQKF-UHFFFAOYSA-N	0	0	292.448	4.442	20	30		CIEDRN
C[C@@H](CCC#N)Sc1ccc(Br)cc1	ZINC000188210601	262284678	/nfs/dbraw/zinc/28/46/78/262284678.db2.gz	UNLPYEILDJNWTH-VIFPVBQESA-N	0	0	270.195	4.233	20	30		CIEDRN
C[C@@H](CC#N)Nc1nc(-c2cccs2)nc2ccccc21	ZINC000171365988	335063295	/nfs/dbraw/zinc/06/32/95/335063295.db2.gz	ADTZHKLFEZMWHD-NSHDSACASA-N	0	0	294.383	4.072	20	30		CIEDRN
CSCCCCCNc1ccc2cc(C#N)ccc2n1	ZINC000302420201	533553604	/nfs/dbraw/zinc/55/36/04/533553604.db2.gz	JKABULBSPSKWJO-UHFFFAOYSA-N	0	0	285.416	4.052	20	30		CIEDRN
Cc1[nH]nc(-c2ccccc2)c1NC(=O)[C@@H]1C[C@H]1C1CC1	ZINC000330139553	533655898	/nfs/dbraw/zinc/65/58/98/533655898.db2.gz	WJHZCFCAMJGCHZ-UONOGXRCSA-N	0	0	281.359	4.019	20	30		CIEDRN
Cc1[nH]nc(-c2ccccc2)c1NC(=O)[C@H]1[C@@H]2CCCC[C@@H]21	ZINC000330148630	533656181	/nfs/dbraw/zinc/65/61/81/533656181.db2.gz	JOXYMSJISJKWNR-FICVDOATSA-N	0	0	295.386	4.409	20	30		CIEDRN
N#Cc1cc(Cl)ccc1CSCc1cccnc1	ZINC000341996729	130188158	/nfs/dbraw/zinc/18/81/58/130188158.db2.gz	LGCZRHJKFTXRPU-UHFFFAOYSA-N	0	0	274.776	4.040	20	30		CIEDRN
N#Cc1ccsc1NC(=O)c1ccc(-c2ccccc2)o1	ZINC000342171466	130361879	/nfs/dbraw/zinc/36/18/79/130361879.db2.gz	IWTGONIIYKSCFF-UHFFFAOYSA-N	0	0	294.335	4.132	20	30		CIEDRN
C=CCCCNC(=O)Nc1cccc(Cl)c1Cl	ZINC000575114324	335067128	/nfs/dbraw/zinc/06/71/28/335067128.db2.gz	FJHIJIVSSXOCJU-UHFFFAOYSA-N	0	0	273.163	4.081	20	30		CIEDRN
CC(=O)Nc1ccc(SCc2ccc(CC#N)cc2)cc1	ZINC000342550936	335182782	/nfs/dbraw/zinc/18/27/82/335182782.db2.gz	WEXXRXNLPQSGLP-UHFFFAOYSA-N	0	0	296.395	4.003	20	30		CIEDRN
Cc1ccc(C#N)c(N[C@@H]2CCc3cc(Cl)ccc32)n1	ZINC000179763733	260068211	/nfs/dbraw/zinc/06/82/11/260068211.db2.gz	UCDJFUPWUGIMBP-OAHLLOKOSA-N	0	0	283.762	4.015	20	30		CIEDRN
Cc1cc(COc2ccc(-c3ccc(C#N)cc3)cc2)no1	ZINC000005281140	170082527	/nfs/dbraw/zinc/08/25/27/170082527.db2.gz	WHYUITLXKMORGT-UHFFFAOYSA-N	0	0	290.322	4.101	20	30		CIEDRN
N#Cc1cccc(C(=O)Nc2ccccc2-c2ccccc2)c1	ZINC000005455964	170100892	/nfs/dbraw/zinc/10/08/92/170100892.db2.gz	DHDSZNVDGMYDBS-UHFFFAOYSA-N	0	0	298.345	4.478	20	30		CIEDRN
COc1ccc2ccc(OCc3ccc(C#N)cc3)cc2c1	ZINC000005474622	170102850	/nfs/dbraw/zinc/10/28/50/170102850.db2.gz	XXSOPUXFHCZPBP-UHFFFAOYSA-N	0	0	289.334	4.299	20	30		CIEDRN
CCC[C@@H](C(=O)Nc1ccc(CC#N)cc1)c1ccccc1	ZINC000008126058	170320271	/nfs/dbraw/zinc/32/02/71/170320271.db2.gz	DIMHWNXDLZSLGL-GOSISDBHSA-N	0	0	292.382	4.275	20	30		CIEDRN
N#Cc1cccc(NC(=O)c2cc3c(s2)CCCCC3)c1	ZINC000008135345	170320431	/nfs/dbraw/zinc/32/04/31/170320431.db2.gz	HOCXZVYQNYSBAI-UHFFFAOYSA-N	0	0	296.395	4.141	20	30		CIEDRN
CC(=O)Nc1ccc(C(=O)/C=C/c2ccccc2Cl)cc1	ZINC000008187862	170323315	/nfs/dbraw/zinc/32/33/15/170323315.db2.gz	GKXDPGSIHAPCPD-DHZHZOJOSA-N	0	0	299.757	4.195	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)c2ccc(F)cc2)c1	ZINC000009823727	170386400	/nfs/dbraw/zinc/38/64/00/170386400.db2.gz	KLKQVWXWAXPAFE-UHFFFAOYSA-N	0	0	285.318	4.033	20	30		CIEDRN
N#Cc1cccc(/C=C/C(=O)c2ccc(Cl)cc2)c1	ZINC000014175601	170621797	/nfs/dbraw/zinc/62/17/97/170621797.db2.gz	OVBPSBCTPYQFQF-RUDMXATFSA-N	0	0	267.715	4.108	20	30		CIEDRN
N#Cc1cccc(NC(=O)c2cccc(Cl)c2Cl)c1	ZINC000015644298	170673314	/nfs/dbraw/zinc/67/33/14/170673314.db2.gz	XVCBVICNUWZPTF-UHFFFAOYSA-N	0	0	291.137	4.117	20	30		CIEDRN
CCOc1ccc(N[C@@H](C)c2ccc(C#N)cc2)cc1	ZINC000019902247	170914265	/nfs/dbraw/zinc/91/42/65/170914265.db2.gz	ZSNANVGLAYPDMK-ZDUSSCGKSA-N	0	0	266.344	4.130	20	30		CIEDRN
Cc1ccc(NCc2cc(C#N)ccc2F)cc1Cl	ZINC000020039142	170975419	/nfs/dbraw/zinc/97/54/19/170975419.db2.gz	LNDVRALCRUQKGR-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
Cc1c(Cl)cccc1NCc1cc(C#N)ccc1F	ZINC000020042727	170976397	/nfs/dbraw/zinc/97/63/97/170976397.db2.gz	ABEZISYUXGADNW-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
N#Cc1ccccc1OCc1cccc(C(F)(F)F)c1	ZINC000020297817	171138023	/nfs/dbraw/zinc/13/80/23/171138023.db2.gz	CXZCBYBJFVBAGI-UHFFFAOYSA-N	0	0	277.245	4.156	20	30		CIEDRN
CCCCCC[C@H](C)Nc1ccc(OCC#N)cc1	ZINC000020520224	171233739	/nfs/dbraw/zinc/23/37/39/171233739.db2.gz	WILQCILHSFRXCU-AWEZNQCLSA-N	0	0	260.381	4.360	20	30		CIEDRN
C=CCNc1nc(-c2cccc(Br)c2)cs1	ZINC000021264695	171300382	/nfs/dbraw/zinc/30/03/82/171300382.db2.gz	APQUTBSFXHQWTM-UHFFFAOYSA-N	0	0	295.205	4.171	20	30		CIEDRN
C#Cc1cccc(NC(=O)c2cc(Cl)cc(Cl)c2)c1	ZINC000022761102	171397911	/nfs/dbraw/zinc/39/79/11/171397911.db2.gz	KFOIEXYXNUAARG-UHFFFAOYSA-N	0	0	290.149	4.227	20	30		CIEDRN
N#Cc1cccc(COc2cc(Cl)cc(Cl)c2)c1	ZINC000035176812	172029832	/nfs/dbraw/zinc/02/98/32/172029832.db2.gz	AGJDVMDIRNJSIP-UHFFFAOYSA-N	0	0	278.138	4.444	20	30		CIEDRN
N#CCc1ccc(NCc2ccc(C(F)(F)F)cc2)cc1	ZINC000035224273	172068480	/nfs/dbraw/zinc/06/84/80/172068480.db2.gz	BRYRQVIIXSAUPE-UHFFFAOYSA-N	0	0	290.288	4.384	20	30		CIEDRN
N#Cc1cc(NCc2ccc(F)c(F)c2)ccc1Cl	ZINC000035224498	172068720	/nfs/dbraw/zinc/06/87/20/172068720.db2.gz	FGWDHFSUTQIYAA-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
N#Cc1ccc(NCc2ccc(F)cc2F)cc1Cl	ZINC000036964022	172831893	/nfs/dbraw/zinc/83/18/93/172831893.db2.gz	GCHRTAVUNJVNCY-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
N#CC1(C(=O)Nc2cccc(Cl)c2Cl)CCCC1	ZINC000044292977	175160082	/nfs/dbraw/zinc/16/00/82/175160082.db2.gz	FDCQVLCPVSNXJU-UHFFFAOYSA-N	0	0	283.158	4.016	20	30		CIEDRN
Cc1ccc2nc(NC(=O)C3(C#N)CCCCC3)sc2c1	ZINC000044385357	175169734	/nfs/dbraw/zinc/16/97/34/175169734.db2.gz	AXINLXMJYXVIHW-UHFFFAOYSA-N	0	0	299.399	4.017	20	30		CIEDRN
C[C@@H](NC(=O)Nc1ccc(C#N)cc1)c1cccc(Cl)c1	ZINC000045026941	175293448	/nfs/dbraw/zinc/29/34/48/175293448.db2.gz	QOLPHINHKMESFS-LLVKDONJSA-N	0	0	299.761	4.094	20	30		CIEDRN
C=CCCCN(C)C(=O)c1oc2c(cccc2Cl)c1C	ZINC000078827859	177394643	/nfs/dbraw/zinc/39/46/43/177394643.db2.gz	QCDAOXMAKBRSDV-UHFFFAOYSA-N	0	0	291.778	4.433	20	30		CIEDRN
CCc1ccccc1N[C@H](C)c1ccc(OCC#N)cc1	ZINC000037213321	260074904	/nfs/dbraw/zinc/07/49/04/260074904.db2.gz	GWFZDEBEWATXOY-CQSZACIVSA-N	0	0	280.371	4.324	20	30		CIEDRN
C[C@H](CCC#N)Sc1nnc(NC2CCCCC2)s1	ZINC000188221641	260075793	/nfs/dbraw/zinc/07/57/93/260075793.db2.gz	NYJUSJAMNMEZPS-SNVBAGLBSA-N	0	0	296.465	4.067	20	30		CIEDRN
N#CC1(CSCc2csc(-c3ccsc3)n2)CC1	ZINC000344484383	225072589	/nfs/dbraw/zinc/07/25/89/225072589.db2.gz	XPIGGCIGMPDQHP-UHFFFAOYSA-N	0	0	292.454	4.409	20	30		CIEDRN
N#CCCCN(Cc1cccs1)c1ccc(F)cc1	ZINC000113253000	225179284	/nfs/dbraw/zinc/17/92/84/225179284.db2.gz	IPHNUFMFMMNJJT-UHFFFAOYSA-N	0	0	274.364	4.198	20	30		CIEDRN
Cc1occc1C(=O)Nc1sc(C(C)(C)C)cc1C#N	ZINC000334819789	225345176	/nfs/dbraw/zinc/34/51/76/225345176.db2.gz	SBGOOSKGKQHRKA-UHFFFAOYSA-N	0	0	288.372	4.071	20	30		CIEDRN
N#C[C@@]1(C(=O)Nc2ccccc2C(F)F)CC12CCCC2	ZINC000335110783	225546522	/nfs/dbraw/zinc/54/65/22/225546522.db2.gz	PEMWGJYHAFBIEX-MRXNPFEDSA-N	0	0	290.313	4.037	20	30		CIEDRN
Cc1ccc(C#N)c(NCc2ccc(-c3ccccc3)o2)n1	ZINC000346855466	225945347	/nfs/dbraw/zinc/94/53/47/225945347.db2.gz	VMNZDLWICINMDP-UHFFFAOYSA-N	0	0	289.338	4.134	20	30		CIEDRN
N#CCC[C@H](Nc1ncccc1Cl)c1ccccc1	ZINC000347407572	226148344	/nfs/dbraw/zinc/14/83/44/226148344.db2.gz	AIMWFCUCYZECCK-AWEZNQCLSA-N	0	0	271.751	4.192	20	30		CIEDRN
CC[C@](C)(C#N)c1nc([C@H](c2ccc(C)cc2)C(C)C)no1	ZINC000575162013	335073885	/nfs/dbraw/zinc/07/38/85/335073885.db2.gz	HXVZBOCIGQLUNF-MAUKXSAKSA-N	0	0	297.402	4.357	20	30		CIEDRN
Cc1ccc(C(=O)N(CCC#N)CC(C)(C)C)c(Cl)c1	ZINC000191237362	226669942	/nfs/dbraw/zinc/66/99/42/226669942.db2.gz	SRIYZVNLVAGXLA-UHFFFAOYSA-N	0	0	292.810	4.050	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2cc(Cl)ccc2Cl)CC1	ZINC000171810563	335081022	/nfs/dbraw/zinc/08/10/22/335081022.db2.gz	NPRPHSHIOQBKIY-UHFFFAOYSA-N	0	0	299.201	4.423	20	30		CIEDRN
Cc1ccc(Cl)c(NC(=O)c2ccc(C#N)cc2)c1C	ZINC000336607228	227175569	/nfs/dbraw/zinc/17/55/69/227175569.db2.gz	HXFWDOKLYJDHLE-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
Cc1ccc(C#N)cc1NCc1cnc(C2CCC2)s1	ZINC000354858674	227175795	/nfs/dbraw/zinc/17/57/95/227175795.db2.gz	OHDBBJYJOUFIOA-UHFFFAOYSA-N	0	0	283.400	4.203	20	30		CIEDRN
N#CCc1ccc(NCc2ccc3occc3c2)cc1	ZINC000352781480	227217298	/nfs/dbraw/zinc/21/72/98/227217298.db2.gz	SUCUHICKCPYJEY-UHFFFAOYSA-N	0	0	262.312	4.111	20	30		CIEDRN
O=C(N[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1cc(C2CC2)on1	ZINC000329042182	227270071	/nfs/dbraw/zinc/27/00/71/227270071.db2.gz	TUPCWNFLFIDAAO-IACUBPJLSA-N	0	0	288.391	4.216	20	30		CIEDRN
Cc1cc(NC(=O)[C@H]2CC23CCCC3)cc2n[nH]cc21	ZINC000329047354	227270454	/nfs/dbraw/zinc/27/04/54/227270454.db2.gz	JUXWMGZEEXYTLT-CYBMUJFWSA-N	0	0	269.348	4.040	20	30		CIEDRN
N#Cc1cccc(C2(C(=O)N[C@@H]3CC34CCCCC4)CC2)c1	ZINC000329094288	227294065	/nfs/dbraw/zinc/29/40/65/227294065.db2.gz	AWTQDHRHWYTLOH-MRXNPFEDSA-N	0	0	294.398	4.269	20	30		CIEDRN
N#Cc1ccc(NC2CC2)c(NC(=O)C2CCCCC2)c1	ZINC000329094131	227294188	/nfs/dbraw/zinc/29/41/88/227294188.db2.gz	KLECOFIJMZJEKZ-UHFFFAOYSA-N	0	0	283.375	4.301	20	30		CIEDRN
Cc1ccccc1[C@@H](CC(C)C)NCc1nc(C#N)cs1	ZINC000352841363	227316478	/nfs/dbraw/zinc/31/64/78/227316478.db2.gz	QIYMCICYRWMXJB-MRXNPFEDSA-N	0	0	299.443	4.200	20	30		CIEDRN
Cc1ccc(NC(=O)[C@@H]2CCC(=O)[C@H](C)C2)c2cccnc12	ZINC000329153578	227329444	/nfs/dbraw/zinc/32/94/44/227329444.db2.gz	AFLXWFQYLNQTMU-CHWSQXEVSA-N	0	0	296.370	4.137	20	30		CIEDRN
Cc1ccnc(-c2cccc(NC(=O)C3CC(C)(C)C3)c2)n1	ZINC000329183974	227343188	/nfs/dbraw/zinc/34/31/88/227343188.db2.gz	PAPATXFKHJWCJX-UHFFFAOYSA-N	0	0	295.386	4.476	20	30		CIEDRN
Cc1nc(C)c(CNC(=O)CCC2CCCCC2)o1	ZINC000329185539	227344616	/nfs/dbraw/zinc/34/46/16/227344616.db2.gz	PNBFNIFGEXYKQZ-UHFFFAOYSA-N	0	0	264.369	4.108	20	30		CIEDRN
N#Cc1ccc(NCc2coc(-c3cccs3)n2)c(F)c1	ZINC000301148703	227461296	/nfs/dbraw/zinc/46/12/96/227461296.db2.gz	NHJOUYIXZGQBPW-UHFFFAOYSA-N	0	0	299.330	4.026	20	30		CIEDRN
N#Cc1nc(Oc2ccc(Cl)cc2)ccc1Cl	ZINC000301524748	227572144	/nfs/dbraw/zinc/57/21/44/227572144.db2.gz	IIEYRYNGZDFXLM-UHFFFAOYSA-N	0	0	265.099	4.052	20	30		CIEDRN
Cc1ccccc1[C@@H](Nc1ccc(C#N)cn1)C(C)(C)C	ZINC000301576143	227595487	/nfs/dbraw/zinc/59/54/87/227595487.db2.gz	QGLHVNLKNAONQX-QGZVFWFLSA-N	0	0	279.387	4.461	20	30		CIEDRN
N#Cc1cccc(Cl)c1NCc1cccc2cccnc21	ZINC000301340154	227515042	/nfs/dbraw/zinc/51/50/42/227515042.db2.gz	FHQQXDKBFZPTLV-UHFFFAOYSA-N	0	0	293.757	4.372	20	30		CIEDRN
N#Cc1c(F)cccc1NCc1ccccc1OCC1CC1	ZINC000301370772	227521937	/nfs/dbraw/zinc/52/19/37/227521937.db2.gz	SWHIXSGVJJMOHZ-UHFFFAOYSA-N	0	0	296.345	4.098	20	30		CIEDRN
Cc1ccc(C[C@H](C)Nc2ccc(Cl)c(C#N)n2)s1	ZINC000301386302	227526686	/nfs/dbraw/zinc/52/66/86/227526686.db2.gz	VWKFOWINYMIPIX-VIFPVBQESA-N	0	0	291.807	4.020	20	30		CIEDRN
N#Cc1cccc(Cl)c1N[C@H]1CCOC2(CCCC2)C1	ZINC000301691534	227643155	/nfs/dbraw/zinc/64/31/55/227643155.db2.gz	KSXDXSOQDIGIHJ-ZDUSSCGKSA-N	0	0	290.794	4.115	20	30		CIEDRN
N#Cc1ccc2nc(N3CCC[C@@H]3C3CCCC3)ccc2c1	ZINC000302004544	227754636	/nfs/dbraw/zinc/75/46/36/227754636.db2.gz	ZGGYMISLFNOBEE-GOSISDBHSA-N	0	0	291.398	4.265	20	30		CIEDRN
C[C@H]1C[C@@H](c2cccnc2)N(c2cc(Cl)ccc2C#N)C1	ZINC000302116923	227793652	/nfs/dbraw/zinc/79/36/52/227793652.db2.gz	DAZMXHKIXRXEOD-LRDDRELGSA-N	0	0	297.789	4.194	20	30		CIEDRN
Cc1oc2ccccc2c1CNc1ccc(Cl)c(C#N)n1	ZINC000302232971	227827990	/nfs/dbraw/zinc/82/79/90/227827990.db2.gz	YVXWESKYIFNBRW-UHFFFAOYSA-N	0	0	297.745	4.273	20	30		CIEDRN
C[C@@H](Nc1cccc(C#N)n1)c1cc2cccc(F)c2o1	ZINC000353042518	227935637	/nfs/dbraw/zinc/93/56/37/227935637.db2.gz	HSXBPUULMVCLAM-SNVBAGLBSA-N	0	0	281.290	4.012	20	30		CIEDRN
Cc1cccc(N(C)C(=O)C[C@H](CC#N)c2ccccc2)c1	ZINC000355542276	227881955	/nfs/dbraw/zinc/88/19/55/227881955.db2.gz	DZBSUPMSIAJRMR-KRWDZBQOSA-N	0	0	292.382	4.045	20	30		CIEDRN
N#Cc1cccc(C#N)c1N[C@@H]1CCc2c1cccc2Cl	ZINC000302866399	227894660	/nfs/dbraw/zinc/89/46/60/227894660.db2.gz	YQWSERQYJWQLNR-MRXNPFEDSA-N	0	0	293.757	4.183	20	30		CIEDRN
Cc1nnc([C@H](C)NC(=O)[C@@H]2C[C@@H]2C2CCCCC2)s1	ZINC000329812450	227955959	/nfs/dbraw/zinc/95/59/59/227955959.db2.gz	DDPCTUKLMYZVBP-ZWKOPEQDSA-N	0	0	293.436	4.080	20	30		CIEDRN
Cc1ccc(-c2cccnc2)cc1NC(=O)[C@@H]1CO[C@H](C)C1	ZINC000330060696	228029970	/nfs/dbraw/zinc/02/99/70/228029970.db2.gz	NBWPSECEVRWQAC-CJNGLKHVSA-N	0	0	296.370	4.070	20	30		CIEDRN
C[C@H](NC(=O)[C@H]1CC12CCCC2)c1nc2ccccc2[nH]1	ZINC000329995214	228009875	/nfs/dbraw/zinc/00/98/75/228009875.db2.gz	MZUWMKCTRQPKEK-NWDGAFQWSA-N	0	0	283.375	4.161	20	30		CIEDRN
N#CCCN(Cc1ccc(-c2ccc(F)cc2)o1)CC1CC1	ZINC000353420868	228100016	/nfs/dbraw/zinc/10/00/16/228100016.db2.gz	WAHHPASRPQHZMY-UHFFFAOYSA-N	0	0	298.361	4.211	20	30		CIEDRN
Cc1oc(C#N)cc1-c1nc(C2CCC(C)(C)CC2)no1	ZINC000331631779	228116225	/nfs/dbraw/zinc/11/62/25/228116225.db2.gz	VUZJAYDIEMEYLP-UHFFFAOYSA-N	0	0	285.347	4.194	20	30		CIEDRN
N#CC1(c2nc(-c3ccc(Cl)cc3)no2)CCCCC1	ZINC000331677881	228118715	/nfs/dbraw/zinc/11/87/15/228118715.db2.gz	PFTQMVQFTSCRTR-UHFFFAOYSA-N	0	0	287.750	4.115	20	30		CIEDRN
Cc1coc2ccc(NC(=O)[C@@H]3CC(=O)N[C@@H](C)C3)cc12	ZINC000330104983	228040177	/nfs/dbraw/zinc/04/01/77/228040177.db2.gz	JIBARBMKMJIZDU-QWRGUYRKSA-N	0	0	286.331	4.084	20	30		CIEDRN
Cc1coc2ccc(NC(=O)[C@H]3CCC(C)(C)O3)cc12	ZINC000330129094	228045593	/nfs/dbraw/zinc/04/55/93/228045593.db2.gz	JTUWEMXXIIYUQA-CQSZACIVSA-N	0	0	273.332	4.287	20	30		CIEDRN
CCc1noc(C)c1C(=O)N[C@@H]1CCCCC12CCCC2	ZINC000330143228	228049279	/nfs/dbraw/zinc/04/92/79/228049279.db2.gz	YRTRDJHUGKCDGT-CQSZACIVSA-N	0	0	290.407	4.353	20	30		CIEDRN
Cc1ccc(NC(=O)C[C@@H]2C=CCCC2)c2n[nH]cc21	ZINC000330205750	228064974	/nfs/dbraw/zinc/06/49/74/228064974.db2.gz	CQVYDOKDQOGPAB-GFCCVEGCSA-N	0	0	269.348	4.206	20	30		CIEDRN
N#Cc1cccc(NC(=O)c2ccc(C3=CCCC3)cc2)c1	ZINC000352133069	228187041	/nfs/dbraw/zinc/18/70/41/228187041.db2.gz	FJAYJQBSWOXUNF-UHFFFAOYSA-N	0	0	288.350	4.378	20	30		CIEDRN
C[C@@H]1CC=CC[C@@H]1C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000352174713	228191814	/nfs/dbraw/zinc/19/18/14/228191814.db2.gz	PDGYFUAIFGKLHR-NJAFHUGGSA-N	0	0	296.414	4.140	20	30		CIEDRN
C[C@@H]1CC[C@@H](CC(=O)N[C@H](CCCC#N)c2ccccc2)C1	ZINC000352192381	228194891	/nfs/dbraw/zinc/19/48/91/228194891.db2.gz	MNFORDHFGKLMDL-JFIYKMOQSA-N	0	0	298.430	4.364	20	30		CIEDRN
Cc1ccc(Cl)c(NC(=O)Cc2ccc(C#N)cc2)c1C	ZINC000336142748	228196670	/nfs/dbraw/zinc/19/66/70/228196670.db2.gz	KAYJPGSWUNBXDH-UHFFFAOYSA-N	0	0	298.773	4.010	20	30		CIEDRN
N#CCCC[C@@H](NC(=O)[C@H]1CC12CCCC2)c1ccccc1	ZINC000352207157	228199327	/nfs/dbraw/zinc/19/93/27/228199327.db2.gz	ULPXLUQSPXMQRF-IAGOWNOFSA-N	0	0	296.414	4.118	20	30		CIEDRN
N#CCCC[C@@H](NC(=O)C[C@H]1C=CCCC1)c1ccccc1	ZINC000352216374	228200668	/nfs/dbraw/zinc/20/06/68/228200668.db2.gz	HKKXTIVIBUETIN-FUHWJXTLSA-N	0	0	296.414	4.284	20	30		CIEDRN
CCc1occc1C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000352219971	228200797	/nfs/dbraw/zinc/20/07/97/228200797.db2.gz	UHTVBRXZALBPSO-INIZCTEOSA-N	0	0	296.370	4.007	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)NC2(C)CCCCC2)cc1	ZINC000116483723	259998695	/nfs/dbraw/zinc/99/86/95/259998695.db2.gz	WZZJIDIRXXORGB-UHFFFAOYSA-N	0	0	299.418	4.332	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N(C)[C@@H](C)c1cccc(Cl)c1	ZINC000116971235	260020042	/nfs/dbraw/zinc/02/00/42/260020042.db2.gz	RDVOBNDQBBCZIS-NEPJUHHUSA-N	0	0	280.799	4.007	20	30		CIEDRN
CCCCCCCCC(=O)N1CCC[C@@H]1c1cc(C)on1	ZINC000363332334	260058553	/nfs/dbraw/zinc/05/85/53/260058553.db2.gz	WYXMVPXMJLLMGI-MRXNPFEDSA-N	0	0	292.423	4.397	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccsc1Cl	ZINC000187835996	260060267	/nfs/dbraw/zinc/06/02/67/260060267.db2.gz	ZWUUCPHNLNCMST-UHFFFAOYSA-N	0	0	255.770	4.108	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cccc(C(F)F)c1	ZINC000187930525	260066875	/nfs/dbraw/zinc/06/68/75/260066875.db2.gz	XDCGKSUKBOQPFC-AWEZNQCLSA-N	0	0	253.292	4.165	20	30		CIEDRN
Cc1c(CNc2nc(C)ccc2C#N)oc2ccc(F)cc12	ZINC000179764342	260068337	/nfs/dbraw/zinc/06/83/37/260068337.db2.gz	SCNADVUABBIMBQ-UHFFFAOYSA-N	0	0	295.317	4.068	20	30		CIEDRN
C=C(C)CN[C@@H](c1ccccc1OC(F)F)C(F)(F)F	ZINC000179898690	260079296	/nfs/dbraw/zinc/07/92/96/260079296.db2.gz	PZGITDXKRJCXTM-NSHDSACASA-N	0	0	295.251	4.057	20	30		CIEDRN
Cc1ccc(Cl)c2ccc(NCCCCC#N)nc12	ZINC000180233108	260096202	/nfs/dbraw/zinc/09/62/02/260096202.db2.gz	ASSGHCMHIJTMKY-UHFFFAOYSA-N	0	0	273.767	4.302	20	30		CIEDRN
CC(C)(C)C[C@@H](NCc1ccc(C#N)cc1)C(F)(F)F	ZINC000180366358	260099341	/nfs/dbraw/zinc/09/93/41/260099341.db2.gz	NRGQRDBRNSPSRG-CYBMUJFWSA-N	0	0	284.325	4.015	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N(CC)c1nc2ccccc2s1	ZINC000526042490	260112598	/nfs/dbraw/zinc/11/25/98/260112598.db2.gz	CTCHAXXXDJUUFG-INIZCTEOSA-N	0	0	288.416	4.252	20	30		CIEDRN
C=CCCc1noc([C@@H]2CCC[C@@H](C(F)(F)F)C2)n1	ZINC000297370860	260119473	/nfs/dbraw/zinc/11/94/73/260119473.db2.gz	QMFFHNMHPOIBCW-NXEZZACHSA-N	0	0	274.286	4.024	20	30		CIEDRN
C=CCCc1noc(C2CCC(C(F)(F)F)CC2)n1	ZINC000297383226	260125872	/nfs/dbraw/zinc/12/58/72/260125872.db2.gz	REXWVDGQFAWANI-UHFFFAOYSA-N	0	0	274.286	4.024	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)N([C@@H](C)c1ccco1)C1CC1	ZINC000297536789	260128518	/nfs/dbraw/zinc/12/85/18/260128518.db2.gz	YKJQGEVJWFCDIW-ZDUSSCGKSA-N	0	0	290.407	4.117	20	30		CIEDRN
CC(C)(CCC#N)CNc1ccc2c(c1)CCCC2	ZINC000404505107	260134783	/nfs/dbraw/zinc/13/47/83/260134783.db2.gz	ATAPDLZZENZMTC-UHFFFAOYSA-N	0	0	256.393	4.307	20	30		CIEDRN
N#Cc1ccc(OCc2cccc(F)c2F)cc1Cl	ZINC000220986975	260142631	/nfs/dbraw/zinc/14/26/31/260142631.db2.gz	PLNQZMMHOYPZEU-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
COc1cccc(F)c1[C@@H](C)Nc1ccc(F)cc1C#N	ZINC000078420776	260166985	/nfs/dbraw/zinc/16/69/85/260166985.db2.gz	LWLPXTMWYSMIDE-SNVBAGLBSA-N	0	0	288.297	4.018	20	30		CIEDRN
N#Cc1ccc(C(F)(F)F)nc1NC1CCCCCC1	ZINC000078832431	260169436	/nfs/dbraw/zinc/16/94/36/260169436.db2.gz	JIGQNUIVJLTFQV-UHFFFAOYSA-N	0	0	283.297	4.107	20	30		CIEDRN
CC(C)(C#N)CCCNc1cccc2c1CCCC2	ZINC000087596993	260191854	/nfs/dbraw/zinc/19/18/54/260191854.db2.gz	NRYRHNCVGUNHAR-UHFFFAOYSA-N	0	0	256.393	4.307	20	30		CIEDRN
CC(C)(C#N)CCCNc1ccc(C(F)(F)F)cc1	ZINC000087597030	260191869	/nfs/dbraw/zinc/19/18/69/260191869.db2.gz	CBXZDXHFHOEZGM-UHFFFAOYSA-N	0	0	270.298	4.447	20	30		CIEDRN
CCCOc1ccccc1OCCCC(C)(C)C#N	ZINC000087608944	260192166	/nfs/dbraw/zinc/19/21/66/260192166.db2.gz	SAHYGSUZKNYDKH-UHFFFAOYSA-N	0	0	261.365	4.184	20	30		CIEDRN
CC(C)(C#N)CCCOc1ccc(C(F)(F)F)cc1	ZINC000087608997	260192337	/nfs/dbraw/zinc/19/23/37/260192337.db2.gz	VSVMLCCAQPXNDO-UHFFFAOYSA-N	0	0	271.282	4.414	20	30		CIEDRN
CC(C)(C#N)CCCOc1ccc(F)cc1Cl	ZINC000087609013	260192552	/nfs/dbraw/zinc/19/25/52/260192552.db2.gz	YPTCTJVJIFPUCX-UHFFFAOYSA-N	0	0	255.720	4.188	20	30		CIEDRN
CC(C)(C#N)CCCSc1cc(F)ccc1F	ZINC000087609126	260192560	/nfs/dbraw/zinc/19/25/60/260192560.db2.gz	GLWAHSSUCMXXHG-UHFFFAOYSA-N	0	0	255.333	4.387	20	30		CIEDRN
N#CCN(Cc1cc(Cl)ccc1Cl)C1CCCC1	ZINC000087759967	260225472	/nfs/dbraw/zinc/22/54/72/260225472.db2.gz	CXUVXANQDLAGNW-UHFFFAOYSA-N	0	0	283.202	4.262	20	30		CIEDRN
CC[C@@H](C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N	ZINC000066954486	260250214	/nfs/dbraw/zinc/25/02/14/260250214.db2.gz	FUEQPPDGCQNOKN-NEPJUHHUSA-N	0	0	291.420	4.001	20	30		CIEDRN
CC[C@@H](c1nnc(SCCCC#N)o1)c1ccccc1	ZINC000067953994	260254118	/nfs/dbraw/zinc/25/41/18/260254118.db2.gz	QZLXNSOUPVEQJY-CYBMUJFWSA-N	0	0	287.388	4.007	20	30		CIEDRN
CC(C)Oc1ccccc1NCC(C)(C)CCC#N	ZINC000092134725	260267673	/nfs/dbraw/zinc/26/76/73/260267673.db2.gz	XIPDINDQQAQQSJ-UHFFFAOYSA-N	0	0	260.381	4.216	20	30		CIEDRN
CCCOc1cccc(CNc2cccc(CC#N)c2)c1	ZINC000313432950	260292961	/nfs/dbraw/zinc/29/29/61/260292961.db2.gz	ZFDCSISPFCFTQN-UHFFFAOYSA-N	0	0	280.371	4.154	20	30		CIEDRN
N#CCc1cccc(N[C@H]2CCC[C@@H](C(F)(F)F)C2)c1	ZINC000313427922	260293038	/nfs/dbraw/zinc/29/30/38/260293038.db2.gz	NPRSUEKSVBSLMC-OCCSQVGLSA-N	0	0	282.309	4.286	20	30		CIEDRN
Cc1ccc(NC(=O)N(CCC#N)CCC(C)C)c(C)c1	ZINC000078438757	260300273	/nfs/dbraw/zinc/30/02/73/260300273.db2.gz	VXPOJGREDWZBFA-UHFFFAOYSA-N	0	0	287.407	4.097	20	30		CIEDRN
N#CCc1cccc(N[C@@H]2CCCC23CCCC3)c1	ZINC000313427082	260332377	/nfs/dbraw/zinc/33/23/77/260332377.db2.gz	MIWMEXVAWGZYPK-MRXNPFEDSA-N	0	0	254.377	4.277	20	30		CIEDRN
CC(C)(C#N)CCCNc1ccccc1Br	ZINC000083640738	260353933	/nfs/dbraw/zinc/35/39/33/260353933.db2.gz	UMADGWIEFWOOLJ-UHFFFAOYSA-N	0	0	281.197	4.191	20	30		CIEDRN
Cc1cccc(Cl)c1NCc1cc(C#N)ccc1F	ZINC000090533757	260366603	/nfs/dbraw/zinc/36/66/03/260366603.db2.gz	CDYYEABWOCLBNN-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
C[C@H](C#N)CN(C(=O)Nc1ccc(C2CCC2)cc1)C1CC1	ZINC000518281573	260368643	/nfs/dbraw/zinc/36/86/43/260368643.db2.gz	YUNCLEFSCCCDKI-CYBMUJFWSA-N	0	0	297.402	4.110	20	30		CIEDRN
N#Cc1csc(CNc2cccc(C(F)F)c2)c1	ZINC000128532152	260375965	/nfs/dbraw/zinc/37/59/65/260375965.db2.gz	HIFKJMIUQKWKQB-UHFFFAOYSA-N	0	0	264.300	4.169	20	30		CIEDRN
CC(C)(C#N)CCCSc1ccc(Br)cn1	ZINC000087609177	260412288	/nfs/dbraw/zinc/41/22/88/260412288.db2.gz	KMJXYMWTQUHMHQ-UHFFFAOYSA-N	0	0	299.237	4.266	20	30		CIEDRN
CSc1ccccc1[C@@H](C)Nc1ccc(C#N)cc1	ZINC000409637903	260419791	/nfs/dbraw/zinc/41/97/91/260419791.db2.gz	ZVGAZZUVTRYDBR-GFCCVEGCSA-N	0	0	268.385	4.453	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@H]1C[C@@H]1c1cccc2ccccc21	ZINC000410124171	260462808	/nfs/dbraw/zinc/46/28/08/260462808.db2.gz	VOHLKKCVALBQOP-IPELMVKDSA-N	0	0	293.410	4.414	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)C[C@@H](CC)c1ccc(C)cc1	ZINC000410121787	260463682	/nfs/dbraw/zinc/46/36/82/260463682.db2.gz	AJVCZOLOORNNSA-NVXWUHKLSA-N	0	0	273.420	4.350	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1oc2ccc(Cl)cc2c1C	ZINC000410134276	260464305	/nfs/dbraw/zinc/46/43/05/260464305.db2.gz	MCZISASENZZOCS-LBPRGKRZSA-N	0	0	291.778	4.479	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@@H](C)c1ccc(SC)cc1	ZINC000410247207	260475426	/nfs/dbraw/zinc/47/54/26/260475426.db2.gz	VJEDKRGTVGPNPV-ZDUSSCGKSA-N	0	0	289.444	4.354	20	30		CIEDRN
COc1ccc(OCCC(C)(C)C#N)c2ccccc12	ZINC000410313907	260481944	/nfs/dbraw/zinc/48/19/44/260481944.db2.gz	AWSJKPCGWPMTKD-UHFFFAOYSA-N	0	0	269.344	4.167	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)C1(CCC=C)CC1	ZINC000410349381	260488292	/nfs/dbraw/zinc/48/82/92/260488292.db2.gz	PLWKZETXCVETDN-UHFFFAOYSA-N	0	0	269.388	4.490	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccc2ccc(Cl)cc2n1	ZINC000410422013	260493597	/nfs/dbraw/zinc/49/35/97/260493597.db2.gz	UPDSYDVFIOJQKK-UHFFFAOYSA-N	0	0	286.762	4.020	20	30		CIEDRN
C=CCC(C)(C)c1nc(-c2cccc(C(F)(F)F)n2)no1	ZINC000426409775	260494175	/nfs/dbraw/zinc/49/41/75/260494175.db2.gz	IUDSWCRZEVTZRS-UHFFFAOYSA-N	0	0	297.280	4.004	20	30		CIEDRN
CCCN(CC#N)Cc1ccc(-c2ccccc2OC)cc1	ZINC000092398334	260495904	/nfs/dbraw/zinc/49/59/04/260495904.db2.gz	MZPHJNQFCMQIOV-UHFFFAOYSA-N	0	0	294.398	4.098	20	30		CIEDRN
N#CCCCCSCCOc1ccc(F)cc1Cl	ZINC000093881710	260526659	/nfs/dbraw/zinc/52/66/59/260526659.db2.gz	AJIQDYMZJWNTNT-UHFFFAOYSA-N	0	0	287.787	4.285	20	30		CIEDRN
C=CCCC(=O)Nc1cc(Cl)c(F)c(Cl)c1	ZINC000427153891	260562873	/nfs/dbraw/zinc/56/28/73/260562873.db2.gz	DWWPBAZFQMLCPQ-UHFFFAOYSA-N	0	0	262.111	4.037	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cnn(CCC(C)C)c1CC	ZINC000427209253	260570198	/nfs/dbraw/zinc/57/01/98/260570198.db2.gz	MJJVJLAGICKKSC-QGZVFWFLSA-N	0	0	291.439	4.032	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)NCc1ccc(C2CCC2)cc1	ZINC000427222098	260570557	/nfs/dbraw/zinc/57/05/57/260570557.db2.gz	FZCNMMFAFCMTMF-GOSISDBHSA-N	0	0	271.404	4.173	20	30		CIEDRN
C=CCCSCC(=O)Nc1c(Cl)cccc1Cl	ZINC000151994414	260625448	/nfs/dbraw/zinc/62/54/48/260625448.db2.gz	XTNKSUFKXVWUFH-UHFFFAOYSA-N	0	0	290.215	4.241	20	30		CIEDRN
CC[C@H](C)N(C(=O)c1ccc(C2(C#N)CC2)cc1)[C@@H](C)CC	ZINC000119629819	260696501	/nfs/dbraw/zinc/69/65/01/260696501.db2.gz	WZRJKBDBZHALTF-GJZGRUSLSA-N	0	0	298.430	4.281	20	30		CIEDRN
C=CCCCNC(=O)N1CCC[C@H]1c1ccccc1Cl	ZINC000448044571	260742745	/nfs/dbraw/zinc/74/27/45/260742745.db2.gz	VIACPZJBQUZJDD-HNNXBMFYSA-N	0	0	292.810	4.153	20	30		CIEDRN
Cc1c2ccsc2nc(-c2cccc([N+](=O)[O-])c2)c1C#N	ZINC000427462391	260743247	/nfs/dbraw/zinc/74/32/47/260743247.db2.gz	LHQYUULNRPNNKI-UHFFFAOYSA-N	0	0	295.323	4.052	20	30		CIEDRN
C=CCC[C@H](Nc1ccc(C#N)nc1)c1ccccc1	ZINC000154569446	260749214	/nfs/dbraw/zinc/74/92/14/260749214.db2.gz	TYPMRQSIUMAWAL-KRWDZBQOSA-N	0	0	263.344	4.073	20	30		CIEDRN
CCSCc1ccc(N[C@@H]2CCC[C@@H](C#N)C2)cc1	ZINC000449602878	260754977	/nfs/dbraw/zinc/75/49/77/260754977.db2.gz	UVZFYYNWEOFHQY-GDBMZVCRSA-N	0	0	274.433	4.434	20	30		CIEDRN
Cc1cc(Cl)ccc1NCc1cccc(F)c1C#N	ZINC000427526664	260759289	/nfs/dbraw/zinc/75/92/89/260759289.db2.gz	XQWFIVWRIWHDFN-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
N#Cc1c(F)cccc1CNc1cccc(C(F)(F)F)c1	ZINC000427541709	260764253	/nfs/dbraw/zinc/76/42/53/260764253.db2.gz	RJYNJTIVHZZYSV-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
C=CCC[C@@H](C(=O)Nc1ccc(O)cc1C)c1ccccc1	ZINC000427637272	260794841	/nfs/dbraw/zinc/79/48/41/260794841.db2.gz	FZHDCSPIIPBTLP-QGZVFWFLSA-N	0	0	295.382	4.389	20	30		CIEDRN
Cc1ccc2c(c1)scc2C(=O)NC1(C#N)CCCCC1	ZINC000408331252	260800005	/nfs/dbraw/zinc/80/00/05/260800005.db2.gz	WIBUZEFOINRCNT-UHFFFAOYSA-N	0	0	298.411	4.166	20	30		CIEDRN
C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H]1CC1(C)C	ZINC000129339706	260835398	/nfs/dbraw/zinc/83/53/98/260835398.db2.gz	NRCDSXQZRNUPNL-VXGBXAGGSA-N	0	0	288.416	4.065	20	30		CIEDRN
C[C@H](Nc1cccnc1C#N)c1ccc(C(F)(F)F)cc1	ZINC000427998650	260901571	/nfs/dbraw/zinc/90/15/71/260901571.db2.gz	WOPOSTGAADLSMU-JTQLQIEISA-N	0	0	291.276	4.145	20	30		CIEDRN
C[C@@H](Nc1cccnc1C#N)c1ccc(C(F)(F)F)cc1	ZINC000427998651	260901810	/nfs/dbraw/zinc/90/18/10/260901810.db2.gz	WOPOSTGAADLSMU-SNVBAGLBSA-N	0	0	291.276	4.145	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)c1ccc(C(C)C)nc1	ZINC000161235602	260969796	/nfs/dbraw/zinc/96/97/96/260969796.db2.gz	DESYTFDBIFRGOA-UHFFFAOYSA-N	0	0	294.398	4.033	20	30		CIEDRN
Cc1cccc(C(=O)N[C@H](CCC#N)c2ccccc2)c1C	ZINC000153369041	261077684	/nfs/dbraw/zinc/07/76/84/261077684.db2.gz	PHZHEFCTJCAMQS-GOSISDBHSA-N	0	0	292.382	4.078	20	30		CIEDRN
N#CCC[C@H](C#N)COc1ccc2oc3c(c2c1)CCCC3	ZINC000153372810	261077748	/nfs/dbraw/zinc/07/77/48/261077748.db2.gz	XOOIICYZNBBYKZ-CYBMUJFWSA-N	0	0	294.354	4.134	20	30		CIEDRN
N#CCC[C@@H](C#N)COc1ccc(Cc2ccccc2)cc1	ZINC000153853399	261084135	/nfs/dbraw/zinc/08/41/35/261084135.db2.gz	FCQBNILPNWJKBX-SFHVURJKSA-N	0	0	290.366	4.100	20	30		CIEDRN
N#Cc1ccc(CN[C@H](c2ccccc2F)C2CCCC2)o1	ZINC000154238015	261089784	/nfs/dbraw/zinc/08/97/84/261089784.db2.gz	HMFFAUYCNOFSRC-SFHVURJKSA-N	0	0	298.361	4.311	20	30		CIEDRN
CC(C)(C)Oc1ccc(C(=O)/C=C/c2cncs2)cc1	ZINC000154749470	261094793	/nfs/dbraw/zinc/09/47/93/261094793.db2.gz	WBTNVPCZCKMHBD-CMDGGOBGSA-N	0	0	287.384	4.217	20	30		CIEDRN
CC[C@H](CC#N)NC(=O)Nc1ccccc1-c1cccs1	ZINC000155635584	261105501	/nfs/dbraw/zinc/10/55/01/261105501.db2.gz	ZFGJPXJMEBNZKZ-GFCCVEGCSA-N	0	0	299.399	4.229	20	30		CIEDRN
C=CCCCNC(=O)N(CC)[C@H](CC)Cc1ccccc1	ZINC000448384117	261137008	/nfs/dbraw/zinc/13/70/08/261137008.db2.gz	DDLLXARVBAHVLT-QGZVFWFLSA-N	0	0	288.435	4.005	20	30		CIEDRN
C=CCCCNC(=O)N1CCCCC[C@H]1c1ccc(C)o1	ZINC000448389973	261139913	/nfs/dbraw/zinc/13/99/13/261139913.db2.gz	QABOSUSQLOVWMT-HNNXBMFYSA-N	0	0	290.407	4.181	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N1CCC[C@H](C(C)C)CC1	ZINC000172216009	261153209	/nfs/dbraw/zinc/15/32/09/261153209.db2.gz	KZFUZJDXRUDHOH-INIZCTEOSA-N	0	0	299.418	4.157	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(Cc1ccc(CC)cc1)C1CC1	ZINC000464556762	261193998	/nfs/dbraw/zinc/19/39/98/261193998.db2.gz	TYZWUTSFNHDBNF-OAHLLOKOSA-N	0	0	285.431	4.342	20	30		CIEDRN
C=C[C@H](C)NC(=O)N(CC)[C@H](C)c1cc2ccccc2o1	ZINC000464753181	261222671	/nfs/dbraw/zinc/22/26/71/261222671.db2.gz	HLSKXWVJADZKMQ-QWHCGFSZSA-N	0	0	286.375	4.100	20	30		CIEDRN
CC(C)c1nc(COc2cc(Cl)ccc2C#N)cs1	ZINC000161658872	261255645	/nfs/dbraw/zinc/25/56/45/261255645.db2.gz	PBKCYIZJYWYYDV-UHFFFAOYSA-N	0	0	292.791	4.371	20	30		CIEDRN
CN(C(=O)CCC1CCCC1)c1cc(Cl)ccc1C#N	ZINC000176426030	261285313	/nfs/dbraw/zinc/28/53/13/261285313.db2.gz	HDOLNSTXJSKFCA-UHFFFAOYSA-N	0	0	290.794	4.145	20	30		CIEDRN
N#Cc1ccc(SCC[C@@H]2CCCC2=O)c(Cl)c1	ZINC000163283455	261310531	/nfs/dbraw/zinc/31/05/31/261310531.db2.gz	QNQANVGKWKTHRA-NSHDSACASA-N	0	0	279.792	4.063	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N1CCC[C@@H]1c1cccc(C)c1C	ZINC000176859751	261313267	/nfs/dbraw/zinc/31/32/67/261313267.db2.gz	UXMWODJZSNCFNB-WMLDXEAASA-N	0	0	286.419	4.115	20	30		CIEDRN
N#Cc1ccc(NC(c2ccccc2)c2ccccc2)cn1	ZINC000301603764	261339197	/nfs/dbraw/zinc/33/91/97/261339197.db2.gz	XGOZWKAARMSOKI-UHFFFAOYSA-N	0	0	285.350	4.155	20	30		CIEDRN
N#Cc1cc(F)ccc1NC(=O)c1cccc2ccccc21	ZINC000177588824	261362156	/nfs/dbraw/zinc/36/21/56/261362156.db2.gz	VHFIKXPVQOZZAQ-UHFFFAOYSA-N	0	0	290.297	4.103	20	30		CIEDRN
N#Cc1cc(F)ccc1NC(=O)CC/C=C/c1ccccc1	ZINC000177596460	261363927	/nfs/dbraw/zinc/36/39/27/261363927.db2.gz	RWUVLLFDHRKATH-XBXARRHUSA-N	0	0	294.329	4.129	20	30		CIEDRN
C[C@H]1CCC[C@@](C#N)(NC(=O)c2cccc3ccsc32)C1	ZINC000466234779	261385533	/nfs/dbraw/zinc/38/55/33/261385533.db2.gz	HIAUISNVURDGBM-YVEFUNNKSA-N	0	0	298.411	4.104	20	30		CIEDRN
Cc1cc(C(=O)Nc2cccc(C#N)c2C)ccc1Cl	ZINC000178386420	261388309	/nfs/dbraw/zinc/38/83/09/261388309.db2.gz	FARYTKNOSSIHJG-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
Cc1c2ccccc2oc1C(=O)Nc1cccc(C#N)c1C	ZINC000178391504	261389084	/nfs/dbraw/zinc/38/90/84/261389084.db2.gz	BJLOLFBBWMUXHJ-UHFFFAOYSA-N	0	0	290.322	4.174	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)C/C=C/c1ccc(F)cc1	ZINC000178406437	261389473	/nfs/dbraw/zinc/38/94/73/261389473.db2.gz	MCQPBOFPODSYSE-DUXPYHPUSA-N	0	0	294.329	4.048	20	30		CIEDRN
CC#CCCCC(=O)Nc1cccc(C(F)F)c1Cl	ZINC000466318440	261391528	/nfs/dbraw/zinc/39/15/28/261391528.db2.gz	BMFQOJINLYLWQT-UHFFFAOYSA-N	0	0	285.721	4.410	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000466360458	261394705	/nfs/dbraw/zinc/39/47/05/261394705.db2.gz	DTAFXIUJGKUMLR-NHYWBVRUSA-N	0	0	299.336	4.485	20	30		CIEDRN
CCC(CC)CN(CC)C(=O)Nc1cccc(C#N)c1C	ZINC000178546989	261396765	/nfs/dbraw/zinc/39/67/65/261396765.db2.gz	YVLLDXTWNAJRSA-UHFFFAOYSA-N	0	0	287.407	4.157	20	30		CIEDRN
CC(C)[C@@H](C)C(=O)Nc1ccccc1S[C@H](C)CC#N	ZINC000171942874	261487938	/nfs/dbraw/zinc/48/79/38/261487938.db2.gz	FMOVBFPQERZQQR-CHWSQXEVSA-N	0	0	290.432	4.311	20	30		CIEDRN
C=C(C)CN(C)C(=O)Nc1ccccc1SC(C)C	ZINC000181798698	261591262	/nfs/dbraw/zinc/59/12/62/261591262.db2.gz	SYXGMDPEAJBDSV-UHFFFAOYSA-N	0	0	278.421	4.227	20	30		CIEDRN
C=CCCO[C@@H](C)c1nc(-c2cccc(Cl)c2F)no1	ZINC000460531899	261614666	/nfs/dbraw/zinc/61/46/66/261614666.db2.gz	USEMRIDZAFASPN-VIFPVBQESA-N	0	0	296.729	4.183	20	30		CIEDRN
C=CC[C@@H](C(=O)N[C@H]1CCCc2occc21)c1ccccc1	ZINC000187844560	261784607	/nfs/dbraw/zinc/78/46/07/261784607.db2.gz	VEOOYBNPXRGUJL-WBVHZDCISA-N	0	0	295.382	4.133	20	30		CIEDRN
C=CCC1(C(=O)N2C[C@H](c3ccccc3C)C[C@@H]2C)CCC1	ZINC000187848897	261785783	/nfs/dbraw/zinc/78/57/83/261785783.db2.gz	PSBSMWOQHYPNDW-DLBZAZTESA-N	0	0	297.442	4.446	20	30		CIEDRN
CCOc1ccc(OC)cc1N[C@@H](C)c1cccc(C#N)c1	ZINC000179792322	261815827	/nfs/dbraw/zinc/81/58/27/261815827.db2.gz	AZYFTUYCUNVVMD-ZDUSSCGKSA-N	0	0	296.370	4.139	20	30		CIEDRN
Cc1scc(C(=O)N[C@@H](CCC#N)c2ccccc2)c1C	ZINC000180448065	261860108	/nfs/dbraw/zinc/86/01/08/261860108.db2.gz	SCZGYSWJDXZSEX-INIZCTEOSA-N	0	0	298.411	4.140	20	30		CIEDRN
CC(C)c1ccc([C@H](C)Nc2ccn(CCC#N)n2)cc1	ZINC000183099482	261963476	/nfs/dbraw/zinc/96/34/76/261963476.db2.gz	HRMHGPJFDJGNPE-AWEZNQCLSA-N	0	0	282.391	4.093	20	30		CIEDRN
CC[C@H](CC#N)NCc1ccc(Cl)c(C(F)(F)F)c1	ZINC000184083570	262007871	/nfs/dbraw/zinc/00/78/71/262007871.db2.gz	ABOXGIXDLZNIOM-SNVBAGLBSA-N	0	0	290.716	4.141	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccccc1SCCC#N	ZINC000185727456	262068649	/nfs/dbraw/zinc/06/86/49/262068649.db2.gz	IXNQBAYTPBFUCC-CYBMUJFWSA-N	0	0	288.416	4.233	20	30		CIEDRN
C/C(=C\C(C)(C)C)C(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000185785842	262070772	/nfs/dbraw/zinc/07/07/72/262070772.db2.gz	MDJXCIKRVRWVCF-VUSFMPOISA-N	0	0	284.403	4.140	20	30		CIEDRN
CC#CCCCC(=O)N1[C@@H](c2ccccc2)CCC[C@@H]1C	ZINC000364067128	262134582	/nfs/dbraw/zinc/13/45/82/262134582.db2.gz	OWDBDBWJNWEVEG-FUHWJXTLSA-N	0	0	283.415	4.322	20	30		CIEDRN
C=CCCc1ccccc1NCc1ccc(NC(C)=O)cc1	ZINC000500400284	262147309	/nfs/dbraw/zinc/14/73/09/262147309.db2.gz	GIOXZUAHAMXVEI-UHFFFAOYSA-N	0	0	294.398	4.376	20	30		CIEDRN
Cc1sc2ncnc(S[C@@H](C)CCC#N)c2c1C	ZINC000188222980	262152061	/nfs/dbraw/zinc/15/20/61/262152061.db2.gz	QTPGCPLREAMXFZ-QMMMGPOBSA-N	0	0	277.418	4.093	20	30		CIEDRN
Cc1ccccc1C(=O)N(CC(C)C)c1ccc(C#N)cc1	ZINC000499319245	262156108	/nfs/dbraw/zinc/15/61/08/262156108.db2.gz	KMGVXBJOLWHBAR-UHFFFAOYSA-N	0	0	292.382	4.170	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCc1cc(Cl)sc1Cl	ZINC000497415554	262158293	/nfs/dbraw/zinc/15/82/93/262158293.db2.gz	HGMKRTBLTJLECH-UHFFFAOYSA-N	0	0	292.231	4.273	20	30		CIEDRN
CC(C)c1ccc([C@@H]2CCCCN2C(=O)[C@@H](C)C#N)cc1	ZINC000497474993	262166544	/nfs/dbraw/zinc/16/65/44/262166544.db2.gz	WACGPCYHVKKFNZ-YOEHRIQHSA-N	0	0	284.403	4.023	20	30		CIEDRN
CC(C)c1ccc([C@H]2CCCCN2C(=O)[C@H](C)C#N)cc1	ZINC000497474988	262167318	/nfs/dbraw/zinc/16/73/18/262167318.db2.gz	WACGPCYHVKKFNZ-RHSMWYFYSA-N	0	0	284.403	4.023	20	30		CIEDRN
C=CCCCC(=O)N1CCC(c2cccc(F)c2F)CC1	ZINC000364205947	262184198	/nfs/dbraw/zinc/18/41/98/262184198.db2.gz	DZVJDFWCPLBWIQ-UHFFFAOYSA-N	0	0	293.357	4.027	20	30		CIEDRN
CC#CCCNC(=O)Nc1cccc(Oc2ccccc2)c1	ZINC000497679105	262188722	/nfs/dbraw/zinc/18/87/22/262188722.db2.gz	DXVHOAQGAIBHLA-UHFFFAOYSA-N	0	0	294.354	4.014	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@@H]1CCC(C)(C)c2ccccc21	ZINC000497687119	262190452	/nfs/dbraw/zinc/19/04/52/262190452.db2.gz	MQSMDMFWBWIIGR-MRXNPFEDSA-N	0	0	286.419	4.017	20	30		CIEDRN
CCCCCCCCC(=O)N1CCC(OCC2CC2)CC1	ZINC000364269261	262192456	/nfs/dbraw/zinc/19/24/56/262192456.db2.gz	CPNGWILOXRVVEZ-UHFFFAOYSA-N	0	0	295.467	4.155	20	30		CIEDRN
CC[C@@H](C)CC(=O)Nc1ccccc1SC[C@@H](C)C#N	ZINC000191482252	262192620	/nfs/dbraw/zinc/19/26/20/262192620.db2.gz	WJRLAJJNDGEPAY-OLZOCXBDSA-N	0	0	290.432	4.313	20	30		CIEDRN
CC[C@H](C)CC(=O)Nc1ccccc1S[C@H](C)CC#N	ZINC000191527819	262193072	/nfs/dbraw/zinc/19/30/72/262193072.db2.gz	JRSBEXPKKKFVDH-QWHCGFSZSA-N	0	0	290.432	4.456	20	30		CIEDRN
C[C@H](Nc1ccc2[nH]ccc2c1)c1ccc(C#N)cc1	ZINC000020132444	262194075	/nfs/dbraw/zinc/19/40/75/262194075.db2.gz	YDDASWNIJREOTH-LBPRGKRZSA-N	0	0	261.328	4.213	20	30		CIEDRN
C#CCCCC(=O)N([C@@H](C)c1ccc(Cl)cc1)C1CC1	ZINC000192134965	262198411	/nfs/dbraw/zinc/19/84/11/262198411.db2.gz	BUWSJARGGNULTQ-ZDUSSCGKSA-N	0	0	289.806	4.196	20	30		CIEDRN
N#Cc1ccc(NCc2cccc(C(F)(F)F)c2)cc1	ZINC000019867518	262202237	/nfs/dbraw/zinc/20/22/37/262202237.db2.gz	HYOPSGJNHZQDBE-UHFFFAOYSA-N	0	0	276.261	4.189	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)CCC1CCCC1	ZINC000497789837	262208987	/nfs/dbraw/zinc/20/89/87/262208987.db2.gz	JQWSFKSKXOGBKE-UHFFFAOYSA-N	0	0	271.404	4.172	20	30		CIEDRN
N#C[C@@H]1CCC[C@H](Nc2ccc3oc(C4CC4)nc3c2)C1	ZINC000193083982	262215658	/nfs/dbraw/zinc/21/56/58/262215658.db2.gz	AYYSQRCPXHMKPZ-YPMHNXCESA-N	0	0	281.359	4.199	20	30		CIEDRN
C=CCCC(=O)N1CCCC[C@H]1CCCc1ccccc1	ZINC000502460567	262216046	/nfs/dbraw/zinc/21/60/46/262216046.db2.gz	GSTBMWHVGRBKJC-SFHVURJKSA-N	0	0	285.431	4.357	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@@H](c3ccccc3)[C@H](C)C2)CCC1	ZINC000188165740	262225816	/nfs/dbraw/zinc/22/58/16/262225816.db2.gz	IXSBSVCNLWQAEY-SJLPKXTDSA-N	0	0	297.442	4.385	20	30		CIEDRN
C=CCN(CC=C)C(=O)[C@@H]1C[C@H]1c1cccc2ccccc21	ZINC000502885582	262233059	/nfs/dbraw/zinc/23/30/59/262233059.db2.gz	AFWMVWVPNRMEKQ-RBUKOAKNSA-N	0	0	291.394	4.144	20	30		CIEDRN
N#Cc1ccc(NCCCCOCc2ccccc2)c(F)c1	ZINC000390708087	262242971	/nfs/dbraw/zinc/24/29/71/262242971.db2.gz	SWMKXCZFVXUIDF-UHFFFAOYSA-N	0	0	298.361	4.106	20	30		CIEDRN
CC[C@H](c1ccccc1)N(CC)C(=O)c1sccc1C#N	ZINC000497990008	262243642	/nfs/dbraw/zinc/24/36/42/262243642.db2.gz	NSBFAOLLNWWVJK-OAHLLOKOSA-N	0	0	298.411	4.233	20	30		CIEDRN
C=CCC1(C(=O)N2CC=C(c3cccc(F)c3)CC2)CCC1	ZINC000364515963	262253623	/nfs/dbraw/zinc/25/36/23/262253623.db2.gz	YTBSOTPFGVSNQK-UHFFFAOYSA-N	0	0	299.389	4.188	20	30		CIEDRN
N#C[C@H]1CCC[C@@H](Nc2ccc(C3CCC3)cc2)C1	ZINC000494475899	262272641	/nfs/dbraw/zinc/27/26/41/262272641.db2.gz	NGPWJDQGYGZRNC-SUMWQHHRSA-N	0	0	254.377	4.448	20	30		CIEDRN
N#C[C@H]1CCC[C@H](Nc2csc3ccccc23)C1	ZINC000463237309	262279677	/nfs/dbraw/zinc/27/96/77/262279677.db2.gz	MCWNPNVJVNVUDX-RYUDHWBXSA-N	0	0	256.374	4.396	20	30		CIEDRN
C[C@H](CCC#N)Sc1nccn1-c1cccc(Cl)c1	ZINC000188259953	262287628	/nfs/dbraw/zinc/28/76/28/262287628.db2.gz	CQAIIQKENIWYPV-LLVKDONJSA-N	0	0	291.807	4.310	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Nc1cccc(CC(F)(F)F)c1	ZINC000188465149	262298513	/nfs/dbraw/zinc/29/85/13/262298513.db2.gz	PWDLMJZQUYNJFY-CQSZACIVSA-N	0	0	285.309	4.332	20	30		CIEDRN
CC(C)CCCC(=O)N(C)c1cc(Cl)ccc1C#N	ZINC000410559419	262299012	/nfs/dbraw/zinc/29/90/12/262299012.db2.gz	SAFDKIZAGZCPDU-UHFFFAOYSA-N	0	0	278.783	4.001	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](C)c1ccc(F)cc1Cl	ZINC000185614337	262306347	/nfs/dbraw/zinc/30/63/47/262306347.db2.gz	KIKYRQCSSLAMRC-QWRGUYRKSA-N	0	0	283.774	4.259	20	30		CIEDRN
C[C@@H](SCCCCC#N)c1cc(F)ccc1F	ZINC000161576693	262317806	/nfs/dbraw/zinc/31/78/06/262317806.db2.gz	UAROHWZSTVWXIM-SNVBAGLBSA-N	0	0	255.333	4.453	20	30		CIEDRN
CC(C)(C)c1ncc(CNc2ccc(CC#N)cc2)s1	ZINC000059181095	262387030	/nfs/dbraw/zinc/38/70/30/262387030.db2.gz	DXYSDXTZOAFIBQ-UHFFFAOYSA-N	0	0	285.416	4.119	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@@H]1CC[C@H]2CCCC[C@H]2C1	ZINC000488812947	262396439	/nfs/dbraw/zinc/39/64/39/262396439.db2.gz	FVVVTBKDPAVGBB-YYIAUSFCSA-N	0	0	275.436	4.160	20	30		CIEDRN
Cc1cc(C)c(C#N)c(N[C@H]2CCCc3sccc32)n1	ZINC000061364209	262396486	/nfs/dbraw/zinc/39/64/86/262396486.db2.gz	KDSVJCANXIUFTM-AWEZNQCLSA-N	0	0	283.400	4.121	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@@H]1CC[C@H]2CCCC[C@@H]2C1	ZINC000488812945	262396497	/nfs/dbraw/zinc/39/64/97/262396497.db2.gz	FVVVTBKDPAVGBB-QBPKDAKJSA-N	0	0	275.436	4.160	20	30		CIEDRN
CSCCCCNc1ccc(C(F)(F)F)cc1C#N	ZINC000124671665	262558591	/nfs/dbraw/zinc/55/85/91/262558591.db2.gz	MREJSUCDVRQNRG-UHFFFAOYSA-N	0	0	288.338	4.132	20	30		CIEDRN
C[C@H]1CCC[C@H]1CC(=O)Nc1ccc(Cl)cc1CC#N	ZINC000410965483	262673836	/nfs/dbraw/zinc/67/38/36/262673836.db2.gz	JHVCJOFNCPTKMQ-RYUDHWBXSA-N	0	0	290.794	4.171	20	30		CIEDRN
Cc1cccc2c1N(C(=O)c1sccc1C#N)CC[C@@H]2C	ZINC000410963755	262673966	/nfs/dbraw/zinc/67/39/66/262673966.db2.gz	CCWSIHRXXGKHIE-NSHDSACASA-N	0	0	296.395	4.082	20	30		CIEDRN
C=CCCC(=O)N(CC(C)C)c1ccccc1Cl	ZINC000411084523	262677746	/nfs/dbraw/zinc/67/77/46/262677746.db2.gz	IGKMVUBDQJFQIR-UHFFFAOYSA-N	0	0	265.784	4.295	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCC(C)(C)c1ccc(Cl)cc1	ZINC000429897341	262679233	/nfs/dbraw/zinc/67/92/33/262679233.db2.gz	TVVAAIPLOXIJQK-UHFFFAOYSA-N	0	0	293.838	4.336	20	30		CIEDRN
N#Cc1ccc(-c2nc(-c3cccc4ccccc43)no2)cc1	ZINC000391503449	262686536	/nfs/dbraw/zinc/68/65/36/262686536.db2.gz	HYDQFKRZVSEPQX-UHFFFAOYSA-N	0	0	297.317	4.428	20	30		CIEDRN
C=CCC[C@H](NC(=O)c1c(C)coc1C)c1ccccc1	ZINC000339965466	262699421	/nfs/dbraw/zinc/69/94/21/262699421.db2.gz	QATQBKMTUCKADD-INIZCTEOSA-N	0	0	283.371	4.334	20	30		CIEDRN
C[C@H](CCC#N)Sc1nnc(-c2cccc(Cl)c2)o1	ZINC000412986168	262750062	/nfs/dbraw/zinc/75/00/62/262750062.db2.gz	HEPNENQAEBVPLR-SECBINFHSA-N	0	0	293.779	4.174	20	30		CIEDRN
C[C@@H](CCC#N)Sc1nc(-c2ccc(F)cc2)c[nH]1	ZINC000412988514	262750353	/nfs/dbraw/zinc/75/03/53/262750353.db2.gz	MEEWFWTVQRJSMK-JTQLQIEISA-N	0	0	275.352	4.000	20	30		CIEDRN
N#C[C@H](SCc1nc2ccccc2[nH]1)C1CCCCC1	ZINC000413020929	262753294	/nfs/dbraw/zinc/75/32/94/262753294.db2.gz	XQWXYWBPSAYEPM-HNNXBMFYSA-N	0	0	285.416	4.269	20	30		CIEDRN
C[C@@H](C#N)Oc1ccccc1NCCCCC(F)(F)F	ZINC000272437039	263004370	/nfs/dbraw/zinc/00/43/70/263004370.db2.gz	KMWJNQLOUPUHLU-NSHDSACASA-N	0	0	286.297	4.122	20	30		CIEDRN
CCCCCCCCC(=O)Nc1c(C)[nH]nc1C(F)F	ZINC000272476004	263005088	/nfs/dbraw/zinc/00/50/88/263005088.db2.gz	QXJLVXQKMNMVKI-UHFFFAOYSA-N	0	0	287.354	4.345	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1C[C@H]1c1c(F)cccc1Cl	ZINC000437312606	263013028	/nfs/dbraw/zinc/01/30/28/263013028.db2.gz	PDBJOOXHTCXBLD-MISXGVKJSA-N	0	0	295.785	4.054	20	30		CIEDRN
CC(C)c1cccc(C(C)C)c1NC(=O)NCCCC#N	ZINC000273209902	263014046	/nfs/dbraw/zinc/01/40/46/263014046.db2.gz	PUELXJIZLIAYEX-UHFFFAOYSA-N	0	0	287.407	4.359	20	30		CIEDRN
Cc1cc(Cl)c(C(=O)N[C@@](C)(C#N)C(C)(C)C)cc1C	ZINC000274346503	263023302	/nfs/dbraw/zinc/02/33/02/263023302.db2.gz	PWNOSAUMNUPBBJ-INIZCTEOSA-N	0	0	292.810	4.015	20	30		CIEDRN
CC(C)(C#N)CCSc1nc(C(F)(F)F)ccc1C#N	ZINC000275054338	263032310	/nfs/dbraw/zinc/03/23/10/263032310.db2.gz	ZGYZHABDZZMWBE-UHFFFAOYSA-N	0	0	299.321	4.004	20	30		CIEDRN
CCCc1cccc(C(C)C)c1NC(=O)NCCCC#N	ZINC000276503905	263036955	/nfs/dbraw/zinc/03/69/55/263036955.db2.gz	RVACTMFOUMBVMO-UHFFFAOYSA-N	0	0	287.407	4.188	20	30		CIEDRN
CC(C)(C#N)CCSCc1nccn1Cc1ccccc1	ZINC000276548484	263037120	/nfs/dbraw/zinc/03/71/20/263037120.db2.gz	ADSVQKZIDQXLSV-UHFFFAOYSA-N	0	0	299.443	4.104	20	30		CIEDRN
CC(C)(C#N)CCSCc1cc(-c2ccco2)on1	ZINC000276601836	263037524	/nfs/dbraw/zinc/03/75/24/263037524.db2.gz	KERBRKSDAUXWRM-UHFFFAOYSA-N	0	0	276.361	4.108	20	30		CIEDRN
CC(C)(C#N)CCSCc1cn2cc(Cl)ccc2n1	ZINC000276629225	263037616	/nfs/dbraw/zinc/03/76/16/263037616.db2.gz	PLNMHCZNLMUZIR-UHFFFAOYSA-N	0	0	293.823	4.161	20	30		CIEDRN
CC(C)(C)[C@@H]1C[C@H](Nc2ccc(CC#N)cc2)CS1	ZINC000277097092	263039758	/nfs/dbraw/zinc/03/97/58/263039758.db2.gz	GUGWIWIAZXMAFD-GJZGRUSLSA-N	0	0	274.433	4.085	20	30		CIEDRN
C=CCN(C)C(=O)N[C@H]1CCCc2ccc(C(C)C)cc21	ZINC000430321436	263041589	/nfs/dbraw/zinc/04/15/89/263041589.db2.gz	ZFGZMEZJSTZDAP-KRWDZBQOSA-N	0	0	286.419	4.015	20	30		CIEDRN
Cc1cccc(C)c1C[S@](=O)CCCCC(C)(C)C#N	ZINC000278000661	263045045	/nfs/dbraw/zinc/04/50/45/263045045.db2.gz	UYQUUNMYIIDCQP-HXUWFJFHSA-N	0	0	291.460	4.272	20	30		CIEDRN
C[C@@H](OC(=O)CC(C)(C)C#N)c1ccc(C(F)(F)F)cc1	ZINC000278285864	263046370	/nfs/dbraw/zinc/04/63/70/263046370.db2.gz	CBGWZVOSUNLBAN-SNVBAGLBSA-N	0	0	299.292	4.249	20	30		CIEDRN
Cc1ccc([C@@H]2[C@@H](C)CCCN2C(=O)CC(C)(C)C#N)cc1	ZINC000278346315	263047114	/nfs/dbraw/zinc/04/71/14/263047114.db2.gz	MNWMVXQXDRETKZ-YJBOKZPZSA-N	0	0	298.430	4.235	20	30		CIEDRN
CC(C)N(Cc1cccc(Cl)c1)C(=O)CC(C)(C)C#N	ZINC000278376903	263047497	/nfs/dbraw/zinc/04/74/97/263047497.db2.gz	HDTVQGHYEBMODY-UHFFFAOYSA-N	0	0	292.810	4.017	20	30		CIEDRN
CC(C)(C#N)CC(=O)Nc1ccccc1-c1cccs1	ZINC000278387123	263047803	/nfs/dbraw/zinc/04/78/03/263047803.db2.gz	INUAXALBHYSECD-UHFFFAOYSA-N	0	0	284.384	4.293	20	30		CIEDRN
Cc1sc2ncnc(S[C@@H]3CC[C@H](C#N)C3)c2c1C	ZINC000278566864	263049008	/nfs/dbraw/zinc/04/90/08/263049008.db2.gz	NEHWRIOVMAIOAH-WDEREUQCSA-N	0	0	289.429	4.093	20	30		CIEDRN
Cn1c2ccc(Cl)cc2nc1S[C@@H]1CC[C@@H](C#N)C1	ZINC000278658144	263049530	/nfs/dbraw/zinc/04/95/30/263049530.db2.gz	WUUKSIKIQCHUKQ-MWLCHTKSSA-N	0	0	291.807	4.011	20	30		CIEDRN
CC(C)N(C(=O)CC(C)(C)C#N)c1ccc(F)cc1Cl	ZINC000278744369	263050513	/nfs/dbraw/zinc/05/05/13/263050513.db2.gz	PCJIGMBXVKAVLR-UHFFFAOYSA-N	0	0	296.773	4.160	20	30		CIEDRN
CC(C)(C)c1cnc(CNc2ccc(CC#N)cc2)s1	ZINC000279171562	263053486	/nfs/dbraw/zinc/05/34/86/263053486.db2.gz	QWMAIMGCZUGFEJ-UHFFFAOYSA-N	0	0	285.416	4.119	20	30		CIEDRN
Cc1ccc(N(C)C(=O)c2ccc(C(C)(C)C#N)cc2)cc1	ZINC000279626557	263056416	/nfs/dbraw/zinc/05/64/16/263056416.db2.gz	AEJTVOMOHAYCIR-UHFFFAOYSA-N	0	0	292.382	4.073	20	30		CIEDRN
CC(C)c1occc1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000279879356	263057959	/nfs/dbraw/zinc/05/79/59/263057959.db2.gz	AVHHSBXDJFJRKU-UHFFFAOYSA-N	0	0	296.370	4.456	20	30		CIEDRN
Cc1cccc(C)c1NC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000280327460	263060454	/nfs/dbraw/zinc/06/04/54/263060454.db2.gz	ZOJLDKCSQHCJQP-UHFFFAOYSA-N	0	0	292.382	4.357	20	30		CIEDRN
CC(C)N(C(=O)c1ccc(C(C)(C)C#N)cc1)C1CCCC1	ZINC000280562037	263063052	/nfs/dbraw/zinc/06/30/52/263063052.db2.gz	QJNQPDCJBAZJRK-UHFFFAOYSA-N	0	0	298.430	4.281	20	30		CIEDRN
C[C@@H]1CCC[C@@H](N(C)C(=O)c2ccc(C(C)(C)C#N)cc2)C1	ZINC000280858248	263064745	/nfs/dbraw/zinc/06/47/45/263064745.db2.gz	LVVPKKNJVIQQBE-RHSMWYFYSA-N	0	0	298.430	4.138	20	30		CIEDRN
N#CC1(CCCOc2ccc3c(c2)CCCC3)CCOCC1	ZINC000281333289	263068310	/nfs/dbraw/zinc/06/83/10/263068310.db2.gz	MBAVCISFVWYWIC-UHFFFAOYSA-N	0	0	299.414	4.045	20	30		CIEDRN
CC(C)N(CCCC1(C#N)CCOCC1)c1ccccc1	ZINC000282017629	263073631	/nfs/dbraw/zinc/07/36/31/263073631.db2.gz	OWZWXWFCBUGXDL-UHFFFAOYSA-N	0	0	286.419	4.002	20	30		CIEDRN
CC(C)(C#N)CCCOc1cnc2ccc(F)cc2c1	ZINC000282301197	263075665	/nfs/dbraw/zinc/07/56/65/263075665.db2.gz	RNVTXFBWNNJDFR-UHFFFAOYSA-N	0	0	272.323	4.083	20	30		CIEDRN
Cc1ncsc1CCSCCCCC(C)(C)C#N	ZINC000284979312	263088944	/nfs/dbraw/zinc/08/89/44/263088944.db2.gz	FNJVPNGOACXBQQ-UHFFFAOYSA-N	0	0	282.478	4.447	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)N[C@@H](C)c1cccc(Cl)c1Cl	ZINC000285451871	263092941	/nfs/dbraw/zinc/09/29/41/263092941.db2.gz	JAKNUVPWMYNHFB-LKFCYVNXSA-N	0	0	299.201	4.110	20	30		CIEDRN
CC[C@](C)(C#N)c1nc(-c2c(Cl)cccc2Cl)no1	ZINC000285630072	263094809	/nfs/dbraw/zinc/09/48/09/263094809.db2.gz	WDHYWULXQSHEQJ-CYBMUJFWSA-N	0	0	296.157	4.235	20	30		CIEDRN
Cc1ccnc([C@@H](C)N[C@@H](CCC#N)c2ccccc2)c1	ZINC000286172484	263097571	/nfs/dbraw/zinc/09/75/71/263097571.db2.gz	PXGKCPUBJWCELE-WBVHZDCISA-N	0	0	279.387	4.086	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)O[C@@H](C)c1cccc(Cl)c1F	ZINC000286715788	263099364	/nfs/dbraw/zinc/09/93/64/263099364.db2.gz	IQVSRQSESUCHSD-LKFCYVNXSA-N	0	0	283.730	4.023	20	30		CIEDRN
CC(C)(C#N)CCNc1ccc(SC(F)F)cc1	ZINC000288738189	263105778	/nfs/dbraw/zinc/10/57/78/263105778.db2.gz	OTITZBFYLTWJFX-UHFFFAOYSA-N	0	0	270.348	4.353	20	30		CIEDRN
CC[C@](C)(C#N)c1nc(Cc2cccc3ccccc32)no1	ZINC000288877866	263106376	/nfs/dbraw/zinc/10/63/76/263106376.db2.gz	DBZVISOFQPJESF-GOSISDBHSA-N	0	0	291.354	4.005	20	30		CIEDRN
CC(C)(C#N)CCSCc1ccc2ccccc2n1	ZINC000289312675	263108976	/nfs/dbraw/zinc/10/89/76/263108976.db2.gz	APZMYZSJZPIMHI-UHFFFAOYSA-N	0	0	270.401	4.408	20	30		CIEDRN
Cc1ccc([C@@H](c2noc(CC(C)(C)C#N)n2)C(C)C)cc1	ZINC000289506819	263110710	/nfs/dbraw/zinc/11/07/10/263110710.db2.gz	ZBJFGYZWUCXASL-INIZCTEOSA-N	0	0	297.402	4.258	20	30		CIEDRN
Cc1ccccc1[C@@H](c1noc(CCCC#N)n1)C(C)C	ZINC000291038821	263119666	/nfs/dbraw/zinc/11/96/66/263119666.db2.gz	GCRQUWAKJHPXKG-INIZCTEOSA-N	0	0	283.375	4.012	20	30		CIEDRN
N#CC1CCC(CN[C@@H](c2ccccc2)C(F)(F)F)CC1	ZINC000291187995	263120712	/nfs/dbraw/zinc/12/07/12/263120712.db2.gz	LEVYNFOZYNNIKZ-PIMMBPRGSA-N	0	0	296.336	4.210	20	30		CIEDRN
Cc1ncn(-c2ccc(NCC(C)(C)CCC#N)cc2)c1C	ZINC000291275817	263121079	/nfs/dbraw/zinc/12/10/79/263121079.db2.gz	ODYFPUFJXOSBEU-UHFFFAOYSA-N	0	0	296.418	4.231	20	30		CIEDRN
CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)CCCC#N	ZINC000291412994	263122453	/nfs/dbraw/zinc/12/24/53/263122453.db2.gz	FLTRSKAZAFUWHF-UHFFFAOYSA-N	0	0	299.201	4.036	20	30		CIEDRN
CC(C)(C)Sc1ccc(NC(=O)CCCC#N)cc1	ZINC000291729691	263125066	/nfs/dbraw/zinc/12/50/66/263125066.db2.gz	QRFIUFPRRYILCP-UHFFFAOYSA-N	0	0	276.405	4.210	20	30		CIEDRN
Cc1cc(N2CCCCCC2)ccc1NC(=O)CCCC#N	ZINC000291816980	263125788	/nfs/dbraw/zinc/12/57/88/263125788.db2.gz	CRUJOKPJWNMKNU-UHFFFAOYSA-N	0	0	299.418	4.008	20	30		CIEDRN
N#CCCCC(=O)N1CCCC[C@H]1CCCc1ccccc1	ZINC000291828979	263125869	/nfs/dbraw/zinc/12/58/69/263125869.db2.gz	DRROHIZSEMAVPS-SFHVURJKSA-N	0	0	298.430	4.084	20	30		CIEDRN
C[C@@H](c1ccc(Cl)cc1)N(C(=O)CCCC#N)C1CC1	ZINC000291920995	263126599	/nfs/dbraw/zinc/12/65/99/263126599.db2.gz	SHMCFPRUBGZJRT-LBPRGKRZSA-N	0	0	290.794	4.086	20	30		CIEDRN
C[C@H](c1ccc(Cl)cc1)N(C(=O)CCCC#N)C1CC1	ZINC000291920988	263126654	/nfs/dbraw/zinc/12/66/54/263126654.db2.gz	SHMCFPRUBGZJRT-GFCCVEGCSA-N	0	0	290.794	4.086	20	30		CIEDRN
CC(C)O[C@H](CSCCCC#N)c1ccccc1	ZINC000292149799	263129048	/nfs/dbraw/zinc/12/90/48/263129048.db2.gz	VEEKLTYOMNCBFX-OAHLLOKOSA-N	0	0	263.406	4.190	20	30		CIEDRN
CCCN(C(=O)CCCC#N)[C@@H](C)c1cc2ccccc2o1	ZINC000292195974	263129507	/nfs/dbraw/zinc/12/95/07/263129507.db2.gz	CAWMLXUJFOVYCQ-AWEZNQCLSA-N	0	0	298.386	4.426	20	30		CIEDRN
CCCN(C(=O)CCCC#N)[C@@H](CC)c1ccccc1	ZINC000292389372	263131871	/nfs/dbraw/zinc/13/18/71/263131871.db2.gz	QSMCXTPIRNRGRB-INIZCTEOSA-N	0	0	272.392	4.070	20	30		CIEDRN
N#C[C@H]1CC[C@H](N2CCc3c(Cl)cc(Cl)cc3C2)C1	ZINC000292762990	263134801	/nfs/dbraw/zinc/13/48/01/263134801.db2.gz	IZTXUYVCKDVAAD-GWCFXTLKSA-N	0	0	295.213	4.044	20	30		CIEDRN
Cc1sccc1C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000294257144	263158505	/nfs/dbraw/zinc/15/85/05/263158505.db2.gz	GIFXKDRMJINRFQ-UHFFFAOYSA-N	0	0	284.384	4.110	20	30		CIEDRN
Cc1cc(Cl)ccc1NC(=O)[C@]1(C#N)CC12CCCC2	ZINC000294356116	263160260	/nfs/dbraw/zinc/16/02/60/263160260.db2.gz	JKFJFZVIWDSASZ-MRXNPFEDSA-N	0	0	288.778	4.061	20	30		CIEDRN
N#C[C@@H]1CC[C@H](Sc2nc3cc(Cl)ccc3o2)C1	ZINC000295023408	263171160	/nfs/dbraw/zinc/17/11/60/263171160.db2.gz	USCXBYSLPGDGON-SCZZXKLOSA-N	0	0	278.764	4.266	20	30		CIEDRN
Cc1[nH]c(S[C@H]2CC[C@@H](C#N)C2)nc1-c1ccccc1	ZINC000295154818	263173504	/nfs/dbraw/zinc/17/35/04/263173504.db2.gz	GMSWHHXUTDBRLJ-OCCSQVGLSA-N	0	0	283.400	4.170	20	30		CIEDRN
CC[C@H](C)[C@@H](C(=O)N[C@H]1CC[C@@H](CC#N)C1)c1ccccc1	ZINC000295600059	263180035	/nfs/dbraw/zinc/18/00/35/263180035.db2.gz	SGPHMCNNKSFUGD-UOVPBQLFSA-N	0	0	298.430	4.015	20	30		CIEDRN
CC(C)[C@@H](CC(=O)N[C@H]1CC[C@@H](CC#N)C1)c1ccccc1	ZINC000295598360	263180143	/nfs/dbraw/zinc/18/01/43/263180143.db2.gz	SBSHOHYZJSPYCH-RYQLBKOJSA-N	0	0	298.430	4.015	20	30		CIEDRN
Cc1ccc(Cl)c(NC(=O)[C@]2(C#N)CC23CCCC3)c1	ZINC000295617499	263180441	/nfs/dbraw/zinc/18/04/41/263180441.db2.gz	ZJHKLHHMWKOALK-MRXNPFEDSA-N	0	0	288.778	4.061	20	30		CIEDRN
Cc1cc(C(=O)/C=C/c2cn(C(C)C)nc2C)cs1	ZINC000295829710	263182852	/nfs/dbraw/zinc/18/28/52/263182852.db2.gz	HEKKLGPOVMJXGF-AATRIKPKSA-N	0	0	274.389	4.038	20	30		CIEDRN
Cc1nocc1/C=C1\C(=O)c2ccccc2[C@H]1C(C)C	ZINC000295977563	263184250	/nfs/dbraw/zinc/18/42/50/263184250.db2.gz	QTYFGIFZDHIKHS-MVMZHWFQSA-N	0	0	267.328	4.003	20	30		CIEDRN
C=CCC(F)(F)c1nc([C@@H]2CCC[C@H](C)C2)no1	ZINC000340594745	263215632	/nfs/dbraw/zinc/21/56/32/263215632.db2.gz	CLEORRAYGROSLK-VHSXEESVSA-N	0	0	256.296	4.031	20	30		CIEDRN
C[C@@H](CCC#N)Sc1nc2cc(Cl)ccc2o1	ZINC000298417959	263219464	/nfs/dbraw/zinc/21/94/64/263219464.db2.gz	RAXGNUOJVNOTDF-QMMMGPOBSA-N	0	0	266.753	4.266	20	30		CIEDRN
N#CCC[C@H](Nc1nc2ccccc2o1)c1ccccc1	ZINC000164293410	263270485	/nfs/dbraw/zinc/27/04/85/263270485.db2.gz	KUESAIFTQKGEHS-AWEZNQCLSA-N	0	0	277.327	4.285	20	30		CIEDRN
C#CCCCCC(=O)Nc1cc(-c2ccncc2)ccc1C	ZINC000119780818	263278744	/nfs/dbraw/zinc/27/87/44/263278744.db2.gz	FSIHVCDCLLAALV-UHFFFAOYSA-N	0	0	292.382	4.189	20	30		CIEDRN
C#CCCCCC(=O)N1CC[C@@H](C)C[C@H]1c1ccc(C)o1	ZINC000120228727	263283053	/nfs/dbraw/zinc/28/30/53/263283053.db2.gz	CRYHESRSOMDTOI-ZBFHGGJFSA-N	0	0	287.403	4.081	20	30		CIEDRN
C#CCCCCC(=O)Nc1cccc(Cl)c1OC(C)C	ZINC000120166224	263284095	/nfs/dbraw/zinc/28/40/95/263284095.db2.gz	LCHBFPIWSDDUKA-UHFFFAOYSA-N	0	0	293.794	4.259	20	30		CIEDRN
N#CCC[C@@H](Nc1ccnc(Cl)c1)c1ccccc1	ZINC000164343595	263285465	/nfs/dbraw/zinc/28/54/65/263285465.db2.gz	QCTQEMZBEXGQOY-CQSZACIVSA-N	0	0	271.751	4.192	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1cc(C)ccc1Cl	ZINC000120757150	263287709	/nfs/dbraw/zinc/28/77/09/263287709.db2.gz	OAHREVLKPXHHBI-UHFFFAOYSA-N	0	0	266.772	4.078	20	30		CIEDRN
C=CCC(CC=C)c1nc(-c2cccc3[nH]c(C)nc32)no1	ZINC000340687561	263292673	/nfs/dbraw/zinc/29/26/73/263292673.db2.gz	UNQUADVPIFXHDD-UHFFFAOYSA-N	0	0	294.358	4.157	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@@H]1c1ccccc1	ZINC000121699522	263295484	/nfs/dbraw/zinc/29/54/84/263295484.db2.gz	KDKKURDWIMAUJJ-QGZVFWFLSA-N	0	0	269.388	4.119	20	30		CIEDRN
Cc1cc(NCC(C)(C)CCC#N)c2cccc(F)c2n1	ZINC000340944344	263313466	/nfs/dbraw/zinc/31/34/66/263313466.db2.gz	WBUZPHMCQUFSJJ-UHFFFAOYSA-N	0	0	285.366	4.424	20	30		CIEDRN
CCO[C@H](C)c1nc(CSCCC(C)(C)C#N)cs1	ZINC000341972812	263372377	/nfs/dbraw/zinc/37/23/77/263372377.db2.gz	VWORSMPXBFMWOT-LLVKDONJSA-N	0	0	298.477	4.414	20	30		CIEDRN
C=CCCOCCCCC(=O)N1CCC=Cc2ccccc21	ZINC000342025515	263380049	/nfs/dbraw/zinc/38/00/49/263380049.db2.gz	ZAZHEPXWTCRAIY-UHFFFAOYSA-N	0	0	299.414	4.200	20	30		CIEDRN
N#CCc1cccc(C(=O)Nc2ccc(F)c(C3CC3)c2)c1	ZINC000342114222	263389514	/nfs/dbraw/zinc/38/95/14/263389514.db2.gz	RBXIXMZHWKQPPM-UHFFFAOYSA-N	0	0	294.329	4.021	20	30		CIEDRN
CCCc1ccc(C(=O)N(CCC#N)CC(C)(C)C)cc1	ZINC000343019657	263569215	/nfs/dbraw/zinc/56/92/15/263569215.db2.gz	BOMVEKVYJMAQAE-UHFFFAOYSA-N	0	0	286.419	4.041	20	30		CIEDRN
CC[C@@H](CSc1ccc(C#N)c(C(F)(F)F)c1)OC	ZINC000416915769	263763918	/nfs/dbraw/zinc/76/39/18/263763918.db2.gz	YGWCUQSWZGVAJY-JTQLQIEISA-N	0	0	289.322	4.094	20	30		CIEDRN
Cc1ccc(C[S@](=O)CCC2(C#N)CCCCC2)cc1	ZINC000417162408	263784377	/nfs/dbraw/zinc/78/43/77/263784377.db2.gz	RZRWCTGOPDEHBL-HXUWFJFHSA-N	0	0	289.444	4.108	20	30		CIEDRN
CC[C@@H](NC(=O)C1=C(C)CCC1)c1c(C)noc1C	ZINC000328815833	263866310	/nfs/dbraw/zinc/86/63/10/263866310.db2.gz	OJJXXYIOASDZNE-CYBMUJFWSA-N	0	0	262.353	4.199	20	30		CIEDRN
CC(C)[C@@H]1CCCC[C@@H]1NC(=O)c1ncoc1C1CC1	ZINC000328818367	263867180	/nfs/dbraw/zinc/86/71/80/263867180.db2.gz	PGAZVCLWHUIYKK-STQMWFEESA-N	0	0	276.380	4.071	20	30		CIEDRN
CO[C@@H]1CCC[C@@H](C(=O)Nc2nc(C3CCC3)cs2)C1	ZINC000328989890	263912549	/nfs/dbraw/zinc/91/25/49/263912549.db2.gz	HYFLRPGDGSRQNT-VXGBXAGGSA-N	0	0	294.420	4.204	20	30		CIEDRN
CC(C)C[C@](C)(C#N)NC(=O)c1cccc(F)c1Cl	ZINC000330476443	263946313	/nfs/dbraw/zinc/94/63/13/263946313.db2.gz	HRHGXSYUGXTRGY-CQSZACIVSA-N	0	0	282.746	4.112	20	30		CIEDRN
CO[C@H](C)c1cccc(NC(=O)NCC2CCCCC2)c1	ZINC000330446508	263954013	/nfs/dbraw/zinc/95/40/13/263954013.db2.gz	HQOYXJJQQANBCB-CYBMUJFWSA-N	0	0	290.407	4.300	20	30		CIEDRN
Cc1nnc(S[C@H](C)CCC#N)n1[C@@H]1CCC[C@H](C)C1	ZINC000330540149	263970703	/nfs/dbraw/zinc/97/07/03/263970703.db2.gz	XPGAZVWCSRVWFO-OUCADQQQSA-N	0	0	292.452	4.122	20	30		CIEDRN
CC(C)C[C@@](C)(C#N)NC(=O)c1ccc(Cl)cc1F	ZINC000330751271	264029237	/nfs/dbraw/zinc/02/92/37/264029237.db2.gz	BJZDDRQUWHLUSA-AWEZNQCLSA-N	0	0	282.746	4.112	20	30		CIEDRN
Cc1ccc(NC(=O)c2csc(C(C)(C)C)n2)cc1O	ZINC000330775522	264034939	/nfs/dbraw/zinc/03/49/39/264034939.db2.gz	SFYMUBSMSJNYRR-UHFFFAOYSA-N	0	0	290.388	4.091	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@@H]1c1cccc(C)c1	ZINC000125806907	264069159	/nfs/dbraw/zinc/06/91/59/264069159.db2.gz	VJYAHJREELSZIY-GOSISDBHSA-N	0	0	283.415	4.427	20	30		CIEDRN
CCO[C@H](C)c1ncc(C(=O)N[C@@H]2CCCC[C@H]2C)s1	ZINC000330902836	264072961	/nfs/dbraw/zinc/07/29/61/264072961.db2.gz	BTIAYXMGZBCAJM-IJLUTSLNSA-N	0	0	296.436	4.124	20	30		CIEDRN
CC[C@H](NC(=O)N[C@@H]1CCCC[C@@H]1CC)c1ccncc1	ZINC000330939067	264082416	/nfs/dbraw/zinc/08/24/16/264082416.db2.gz	WHGXGIBEJLVLLL-CWRNSKLLSA-N	0	0	289.423	4.005	20	30		CIEDRN
CC(C)c1ccc(C(=O)N[C@@H]2CCC[C@H]2C#N)cc1Cl	ZINC000330968425	264091410	/nfs/dbraw/zinc/09/14/10/264091410.db2.gz	QXTCDLIETJTPIZ-SWLSCSKDSA-N	0	0	290.794	4.460	20	30		CIEDRN
Cc1ccc(C)c(Cc2noc(C3(C#N)CCCCC3)n2)c1	ZINC000330919260	264093315	/nfs/dbraw/zinc/09/33/15/264093315.db2.gz	YGMKMMFSAKIMHF-UHFFFAOYSA-N	0	0	295.386	4.003	20	30		CIEDRN
CCO[C@H](C)c1ncc(C(=O)N[C@@H]2CCC[C@H](C)C2)s1	ZINC000330917019	264093334	/nfs/dbraw/zinc/09/33/34/264093334.db2.gz	LKKZRNZYTJBGET-QJPTWQEYSA-N	0	0	296.436	4.124	20	30		CIEDRN
CCC(C)(C)CC(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000330926934	264095188	/nfs/dbraw/zinc/09/51/88/264095188.db2.gz	JNKKSHRIJAEYJF-UHFFFAOYSA-N	0	0	272.392	4.253	20	30		CIEDRN
CC[C@@H]1CCC[C@@H]1NC(=O)c1sc([C@H](C)OC)nc1C	ZINC000330927125	264095285	/nfs/dbraw/zinc/09/52/85/264095285.db2.gz	JRKYIUGKMRNPMX-TUAOUCFPSA-N	0	0	296.436	4.042	20	30		CIEDRN
CCO[C@H](C)c1ncc(C(=O)N[C@@H]2CCC[C@H]2CC)s1	ZINC000330931966	264096257	/nfs/dbraw/zinc/09/62/57/264096257.db2.gz	WKQRUOWABIICMI-IJLUTSLNSA-N	0	0	296.436	4.124	20	30		CIEDRN
Cc1nc(C)c(NC(=O)N[C@H](C)c2ccc(C)cc2)s1	ZINC000330932968	264096853	/nfs/dbraw/zinc/09/68/53/264096853.db2.gz	BMIUIKLIWUWHPZ-SNVBAGLBSA-N	0	0	289.404	4.155	20	30		CIEDRN
CCC[C@@H](NC(=O)c1ccnc(C#N)c1)C1CCCCC1	ZINC000331065060	264111365	/nfs/dbraw/zinc/11/13/65/264111365.db2.gz	QBRIAGQYTUHXDD-MRXNPFEDSA-N	0	0	285.391	4.007	20	30		CIEDRN
Cc1noc(C)c1C(=O)NCC(C)(C)C1=CCCCC1	ZINC000331066571	264112146	/nfs/dbraw/zinc/11/21/46/264112146.db2.gz	QWUQPYJRPGSKBT-UHFFFAOYSA-N	0	0	276.380	4.123	20	30		CIEDRN
CC[C@H](C)n1ncc(NC(=O)N[C@@H]2CCC[C@H](C)C2)c1C	ZINC000331113761	264127985	/nfs/dbraw/zinc/12/79/85/264127985.db2.gz	JKVFGYXIFHJJFT-SGMGOOAPSA-N	0	0	292.427	4.067	20	30		CIEDRN
CCc1oc(C(=O)Nc2cc(C)c(O)c(C)c2)cc1C	ZINC000331089279	264133174	/nfs/dbraw/zinc/13/31/74/264133174.db2.gz	UOWYVINIDUFLIB-UHFFFAOYSA-N	0	0	273.332	4.109	20	30		CIEDRN
Cc1csc(C(=O)N[C@@](C)(C#N)CC(C)C)c1Cl	ZINC000331091903	264133882	/nfs/dbraw/zinc/13/38/82/264133882.db2.gz	XEGSOHORECQSNX-CYBMUJFWSA-N	0	0	284.812	4.343	20	30		CIEDRN
CC(C)c1nc(CN(C)[C@@H](C)c2cccc(C#N)c2)cs1	ZINC000425364726	264138539	/nfs/dbraw/zinc/13/85/39/264138539.db2.gz	HHGBUUKSKITNPG-ZDUSSCGKSA-N	0	0	299.443	4.331	20	30		CIEDRN
CCOC(C)(C)CNC(=O)Nc1c(Cl)ccc(C)c1C	ZINC000331231527	264153169	/nfs/dbraw/zinc/15/31/69/264153169.db2.gz	IGYSWJNLECIUSP-UHFFFAOYSA-N	0	0	298.814	4.098	20	30		CIEDRN
Cc1cc(C)c(NC(=O)N[C@@H](C)CCC(C)C)c(C)n1	ZINC000331232227	264153355	/nfs/dbraw/zinc/15/33/55/264153355.db2.gz	JDPSZHXOBBERQW-LBPRGKRZSA-N	0	0	277.412	4.157	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)N1CCC[C@@H]1CC(C)(C)C	ZINC000331211328	264162630	/nfs/dbraw/zinc/16/26/30/264162630.db2.gz	YPPOJPATFOPKKR-OAHLLOKOSA-N	0	0	299.418	4.313	20	30		CIEDRN
Cc1cc[nH]c1C(=O)N[C@@H](C)c1nc(C(C)(C)C)cs1	ZINC000331218587	264164863	/nfs/dbraw/zinc/16/48/63/264164863.db2.gz	HOXFBUIOLZHWOE-JTQLQIEISA-N	0	0	291.420	4.143	20	30		CIEDRN
CCCC[C@@H]1CCC[C@@H]1NC(=O)c1cc(C#N)oc1C	ZINC000331223127	264167504	/nfs/dbraw/zinc/16/75/04/264167504.db2.gz	LGEKSUZBCTYXEL-DOMZBBRYSA-N	0	0	274.364	4.123	20	30		CIEDRN
CC(C)C[C@H](C)n1nccc1NC(=O)N[C@@H]1CC[C@H](C)C1	ZINC000331284595	264173183	/nfs/dbraw/zinc/17/31/83/264173183.db2.gz	FXCCYYOMMQJMOS-MELADBBJSA-N	0	0	292.427	4.005	20	30		CIEDRN
Cc1cc[nH]c1C(=O)Nc1nc(CC(C)(C)C)cs1	ZINC000331242168	264177091	/nfs/dbraw/zinc/17/70/91/264177091.db2.gz	YCHATCQZHXKAOM-UHFFFAOYSA-N	0	0	277.393	4.005	20	30		CIEDRN
CC[C@H](C)NC(=O)Nc1cc2sc(C)nc2cc1Cl	ZINC000331247671	264179410	/nfs/dbraw/zinc/17/94/10/264179410.db2.gz	QNBNJZBRUVMNQW-ZETCQYMHSA-N	0	0	297.811	4.383	20	30		CIEDRN
CC[C@@H](C)NC(=O)Nc1cc2sc(C)nc2cc1Cl	ZINC000331247670	264179427	/nfs/dbraw/zinc/17/94/27/264179427.db2.gz	QNBNJZBRUVMNQW-SSDOTTSWSA-N	0	0	297.811	4.383	20	30		CIEDRN
CC[C@@H](Cc1ccccc1C)C(=O)Nc1ccccc1C#N	ZINC000425384433	264220080	/nfs/dbraw/zinc/22/00/80/264220080.db2.gz	MWXPIRAOSLUJES-HNNXBMFYSA-N	0	0	292.382	4.074	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cccc2ccc(O)cc21	ZINC000188955650	264259831	/nfs/dbraw/zinc/25/98/31/264259831.db2.gz	RJPPWXMLSHLBHS-KRWDZBQOSA-N	0	0	269.344	4.086	20	30		CIEDRN
N#Cc1cnc(N[C@H]2CCCc3sccc32)c(Cl)c1	ZINC000161066032	264265314	/nfs/dbraw/zinc/26/53/14/264265314.db2.gz	JVDPIELHHCWGMS-LBPRGKRZSA-N	0	0	289.791	4.158	20	30		CIEDRN
CC[C@H](Cc1ccccc1C)C(=O)Nc1sccc1C#N	ZINC000425393801	264274787	/nfs/dbraw/zinc/27/47/87/264274787.db2.gz	DKZLWEPNCQMWRT-CYBMUJFWSA-N	0	0	298.411	4.136	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cccc(C(C)(F)F)c1	ZINC000189405259	264299689	/nfs/dbraw/zinc/29/96/89/264299689.db2.gz	CLCAUDFAPLIHMV-NSHDSACASA-N	0	0	267.319	4.339	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1ccc(C)c(-c2ncco2)c1	ZINC000162130533	264310510	/nfs/dbraw/zinc/31/05/10/264310510.db2.gz	QNTQJZUBMYRTBW-UHFFFAOYSA-N	0	0	299.374	4.080	20	30		CIEDRN
N#Cc1ccnc(SCc2ccc(Cl)c(F)c2)c1	ZINC000189835819	264331871	/nfs/dbraw/zinc/33/18/71/264331871.db2.gz	HWTRXQHWTIFQMC-UHFFFAOYSA-N	0	0	278.739	4.038	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H](C)c1ccc(Cl)cc1	ZINC000189862555	264335409	/nfs/dbraw/zinc/33/54/09/264335409.db2.gz	CZDPRWNXFZLEGM-IAQYHMDHSA-N	0	0	265.784	4.120	20	30		CIEDRN
C=CCCO[C@@H](C)C(=O)Nc1c(C)cccc1C(C)C	ZINC000253608700	264336954	/nfs/dbraw/zinc/33/69/54/264336954.db2.gz	UTGAFGKHJUWHAQ-AWEZNQCLSA-N	0	0	275.392	4.038	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1c(CC)cccc1CC	ZINC000077181764	264349912	/nfs/dbraw/zinc/34/99/12/264349912.db2.gz	CNUBDGFVDOVWEQ-UHFFFAOYSA-N	0	0	274.408	4.241	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]1Cc1ccc(C)cc1	ZINC000425489050	264354720	/nfs/dbraw/zinc/35/47/20/264354720.db2.gz	NKLFOQVVTOKSCX-QGZVFWFLSA-N	0	0	285.431	4.131	20	30		CIEDRN
C=CCC[C@@H](NCc1nc(CCCC)no1)c1ccccc1	ZINC000180034626	264389945	/nfs/dbraw/zinc/38/99/45/264389945.db2.gz	AJPJIUILXIGTJH-MRXNPFEDSA-N	0	0	299.418	4.209	20	30		CIEDRN
C=CCC1(C(=O)Nc2cc(OC)ccc2Cl)CCC1	ZINC000190151765	264391960	/nfs/dbraw/zinc/39/19/60/264391960.db2.gz	MIGMSSIUIAMRQG-UHFFFAOYSA-N	0	0	279.767	4.034	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1c(C)cccc1CC	ZINC000281357781	264473358	/nfs/dbraw/zinc/47/33/58/264473358.db2.gz	NAIBWHUWJOLNHH-AWEZNQCLSA-N	0	0	260.381	4.034	20	30		CIEDRN
N#Cc1cc(F)ccc1N[C@@H](c1ccccc1)C1CC1	ZINC000135147376	264549907	/nfs/dbraw/zinc/54/99/07/264549907.db2.gz	OQUAPVZSXODZPD-KRWDZBQOSA-N	0	0	266.319	4.261	20	30		CIEDRN
C#CCCCC(=O)N1CCCC[C@@H]1c1cccc(C)c1C	ZINC000192360013	264564648	/nfs/dbraw/zinc/56/46/48/264564648.db2.gz	OGEVSQYQFZFTHC-GOSISDBHSA-N	0	0	283.415	4.161	20	30		CIEDRN
C=C[C@@H](CC(=O)N[C@@H](CC)c1ccncc1)c1ccccc1	ZINC000135624010	264598035	/nfs/dbraw/zinc/59/80/35/264598035.db2.gz	VBGJGKDUBVYWFV-YJBOKZPZSA-N	0	0	294.398	4.009	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc([C@H]2CCC(F)(F)C2)no1	ZINC000289027491	264700184	/nfs/dbraw/zinc/70/01/84/264700184.db2.gz	FZOFZDUEACAJNQ-ZJUUUORDSA-N	0	0	256.296	4.042	20	30		CIEDRN
CN(CC1CCCC1)C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000194564530	264799901	/nfs/dbraw/zinc/79/99/01/264799901.db2.gz	WWBIYPZORFMQFZ-UHFFFAOYSA-N	0	0	299.418	4.142	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H]1c1cccc(F)c1	ZINC000185236518	265010959	/nfs/dbraw/zinc/01/09/59/265010959.db2.gz	KLCUUOZAQSPYJJ-XJKSGUPXSA-N	0	0	275.367	4.092	20	30		CIEDRN
Cc1cc(N2CCCC2)ccc1NCc1cc(C#N)cs1	ZINC000093685963	265187721	/nfs/dbraw/zinc/18/77/21/265187721.db2.gz	RHFWYJWIQZIMIO-UHFFFAOYSA-N	0	0	297.427	4.141	20	30		CIEDRN
Cc1cc(Cl)ccc1NCc1cc(C#N)cs1	ZINC000093685250	265189651	/nfs/dbraw/zinc/18/96/51/265189651.db2.gz	JJLAHHSQHOBNRT-UHFFFAOYSA-N	0	0	262.765	4.194	20	30		CIEDRN
Cc1cc(C)c(CSc2nc(C)nc(C)c2C#N)c(C)c1	ZINC000518906534	265206005	/nfs/dbraw/zinc/20/60/05/265206005.db2.gz	WDERLCHDQGOROV-UHFFFAOYSA-N	0	0	297.427	4.183	20	30		CIEDRN
CC1(C)CCC[C@H]1Nc1cccc(OCCCC#N)c1	ZINC000094307468	265235135	/nfs/dbraw/zinc/23/51/35/265235135.db2.gz	XOPOJQWMIKDGAF-MRXNPFEDSA-N	0	0	272.392	4.360	20	30		CIEDRN
CC1(C)CCC[C@@H]1Nc1cccc(OCCCC#N)c1	ZINC000094307467	265235184	/nfs/dbraw/zinc/23/51/84/265235184.db2.gz	XOPOJQWMIKDGAF-INIZCTEOSA-N	0	0	272.392	4.360	20	30		CIEDRN
Cc1cc(N2CCCC2)ccc1NCc1ccc(C#N)cc1	ZINC000011094939	265235316	/nfs/dbraw/zinc/23/53/16/265235316.db2.gz	UMSBBTIKOYJZRY-UHFFFAOYSA-N	0	0	291.398	4.079	20	30		CIEDRN
Cc1ccc(Cl)c(Oc2ccc(C#N)c([N+](=O)[O-])c2)c1	ZINC000094593540	265244230	/nfs/dbraw/zinc/24/42/30/265244230.db2.gz	UKTJVSMVRJIRAT-UHFFFAOYSA-N	0	0	288.690	4.221	20	30		CIEDRN
CC[C@@H](Nc1ccc(C#N)c([N+](=O)[O-])c1)c1cccs1	ZINC000094591800	265244496	/nfs/dbraw/zinc/24/44/96/265244496.db2.gz	XMWVOOLVKILMHO-GFCCVEGCSA-N	0	0	287.344	4.091	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(Cl)c(Br)c1	ZINC000094670771	265248883	/nfs/dbraw/zinc/24/88/83/265248883.db2.gz	HPXABWVGWKIILQ-UHFFFAOYSA-N	0	0	288.572	4.007	20	30		CIEDRN
C=CCN(CC=C)C(=O)N[C@H](c1ccccc1)C1CCCC1	ZINC000519259604	265379274	/nfs/dbraw/zinc/37/92/74/265379274.db2.gz	XUIIAHVOTMSIFG-GOSISDBHSA-N	0	0	298.430	4.302	20	30		CIEDRN
C=CCN(CC=C)C(=O)Nc1ccccc1CCC(C)C	ZINC000520181975	265670270	/nfs/dbraw/zinc/67/02/70/265670270.db2.gz	LNRNUSLDWFJGPT-UHFFFAOYSA-N	0	0	286.419	4.481	20	30		CIEDRN
C=CC1CCN(C(=O)c2ccc(C(C)(C)C)cc2)CC1	ZINC000520327839	265770072	/nfs/dbraw/zinc/77/00/72/265770072.db2.gz	YWGLRVREPPWRTA-UHFFFAOYSA-N	0	0	271.404	4.022	20	30		CIEDRN
C=C(C)CCNc1cccc(Cl)c1OCCOCC	ZINC000520652630	265888304	/nfs/dbraw/zinc/88/83/04/265888304.db2.gz	LBZXJQAZDBYHIB-UHFFFAOYSA-N	0	0	283.799	4.133	20	30		CIEDRN
COc1cccc([C@@H]2CCCN2c2ccc(F)cc2C#N)c1	ZINC000301510308	265982178	/nfs/dbraw/zinc/98/21/78/265982178.db2.gz	IFANQMPZAZUHSZ-KRWDZBQOSA-N	0	0	296.345	4.047	20	30		CIEDRN
Cc1ccccc1CNc1cccc(C(F)F)c1C#N	ZINC000514636888	266022982	/nfs/dbraw/zinc/02/29/82/266022982.db2.gz	IWUFQPMBBKEQRE-UHFFFAOYSA-N	0	0	272.298	4.416	20	30		CIEDRN
CC[C@H](C)C[C@H](C)NC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000356186275	266065639	/nfs/dbraw/zinc/06/56/39/266065639.db2.gz	AXTVJKPUYYDFLY-YQQAZPJKSA-N	0	0	286.419	4.015	20	30		CIEDRN
C[C@@H]1CCC[C@@H](C)N(C(=O)C[C@H](CC#N)c2ccccc2)C1	ZINC000356190500	266067059	/nfs/dbraw/zinc/06/70/59/266067059.db2.gz	KSVLOPIAOVROET-NUJGCVRESA-N	0	0	298.430	4.111	20	30		CIEDRN
CC[C@]1(C)CCCN(C(=O)C[C@@H](CC#N)c2ccccc2)C1	ZINC000356248056	266080704	/nfs/dbraw/zinc/08/07/04/266080704.db2.gz	NUSOAZUJYXMUQE-IEBWSBKVSA-N	0	0	298.430	4.113	20	30		CIEDRN
CC(C)CC1(CNC(=O)C[C@@H](CC#N)c2ccccc2)CC1	ZINC000356323821	266096162	/nfs/dbraw/zinc/09/61/62/266096162.db2.gz	YSAQLAXZHHAAEN-QGZVFWFLSA-N	0	0	298.430	4.016	20	30		CIEDRN
C[C@@H](CC(C)(C)C)C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000356374569	266104137	/nfs/dbraw/zinc/10/41/37/266104137.db2.gz	VZHJFFJPQCCSOB-GOEBONIOSA-N	0	0	286.419	4.220	20	30		CIEDRN
Cc1cccc(NC(=O)C[C@H](CC#N)c2ccccc2)c1F	ZINC000356703007	266162233	/nfs/dbraw/zinc/16/22/33/266162233.db2.gz	OWILZRIZSNJPGE-HNNXBMFYSA-N	0	0	296.345	4.160	20	30		CIEDRN
Cc1cccc(NC(=O)C[C@@H](CC#N)c2ccccc2)c1F	ZINC000356703010	266162388	/nfs/dbraw/zinc/16/23/88/266162388.db2.gz	OWILZRIZSNJPGE-OAHLLOKOSA-N	0	0	296.345	4.160	20	30		CIEDRN
C=CCCC1(C(=O)NCc2c(C)oc3ccccc32)CC1	ZINC000356792400	266175959	/nfs/dbraw/zinc/17/59/59/266175959.db2.gz	CWQVOASOIQKWKP-UHFFFAOYSA-N	0	0	283.371	4.104	20	30		CIEDRN
C=C(C)CSCC(=O)c1cc(C)n(CCC)c1C	ZINC000357047467	266238237	/nfs/dbraw/zinc/23/82/37/266238237.db2.gz	ZNAANTMFLXSSOV-UHFFFAOYSA-N	0	0	265.422	4.007	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H]1CCCc2ccc(F)cc21	ZINC000357496927	266309295	/nfs/dbraw/zinc/30/92/95/266309295.db2.gz	REAJUVINLGALGH-KRWDZBQOSA-N	0	0	287.378	4.088	20	30		CIEDRN
Cc1ccc(C#N)c(N[C@H]2CCc3sc(Cl)cc32)n1	ZINC000357582434	266330787	/nfs/dbraw/zinc/33/07/87/266330787.db2.gz	PERCTECMLHKNOJ-NSHDSACASA-N	0	0	289.791	4.076	20	30		CIEDRN
C[C@@H](CSCCCC1(C#N)CCOCC1)C(F)(F)F	ZINC000357701448	266348263	/nfs/dbraw/zinc/34/82/63/266348263.db2.gz	AWHNSXRYNUMRJE-NSHDSACASA-N	0	0	295.370	4.019	20	30		CIEDRN
C=CCC[C@H](NC(=O)C[C@@H](C)CC)c1ccccc1	ZINC000358179459	266434377	/nfs/dbraw/zinc/43/43/77/266434377.db2.gz	FSZYWAKJMGTLTM-HOCLYGCPSA-N	0	0	259.393	4.246	20	30		CIEDRN
C=CCC[C@H](NC(=O)[C@@H]1CCC(F)(F)C1)c1ccccc1	ZINC000359747530	266633934	/nfs/dbraw/zinc/63/39/34/266633934.db2.gz	KLFNKJRKKANJMT-CABCVRRESA-N	0	0	293.357	4.246	20	30		CIEDRN
CC(C)(CCC#N)CNC(=O)c1ccc(F)c2ccccc12	ZINC000359764174	266637189	/nfs/dbraw/zinc/63/71/89/266637189.db2.gz	MTEIGZXODPCWCX-UHFFFAOYSA-N	0	0	298.361	4.039	20	30		CIEDRN
N#CCCCCSCc1cc(-c2ccc(F)cc2)no1	ZINC000359763276	266637320	/nfs/dbraw/zinc/63/73/20/266637320.db2.gz	BWHXUNKBXHGUQW-UHFFFAOYSA-N	0	0	290.363	4.408	20	30		CIEDRN
C=CCCC(=O)N1CCC[C@H]1c1cccc2ccccc21	ZINC000361503118	266835192	/nfs/dbraw/zinc/83/51/92/266835192.db2.gz	JRWVGXUCAZNUTB-SFHVURJKSA-N	0	0	279.383	4.470	20	30		CIEDRN
N#Cc1cccnc1Nc1ccc2nc(C3CC3)sc2c1	ZINC000362286048	266955549	/nfs/dbraw/zinc/95/55/49/266955549.db2.gz	MACYTPIMCVSCHO-UHFFFAOYSA-N	0	0	292.367	4.184	20	30		CIEDRN
Cc1nc(C)c(CSCc2ccc(C#N)c(C)c2)s1	ZINC000362457065	266989814	/nfs/dbraw/zinc/98/98/14/266989814.db2.gz	OPYZJOSRLNNASQ-UHFFFAOYSA-N	0	0	288.441	4.373	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N(CC)CC(C)C	ZINC000362530898	267002409	/nfs/dbraw/zinc/00/24/09/267002409.db2.gz	BVNJKACSHUIGTI-UHFFFAOYSA-N	0	0	277.433	4.083	20	30		CIEDRN
CC(C)C[C@@H](NC(=O)c1ccc(C#N)s1)c1ccccc1	ZINC000362881827	267056368	/nfs/dbraw/zinc/05/63/68/267056368.db2.gz	BGMHAOLDKBBILW-OAHLLOKOSA-N	0	0	298.411	4.137	20	30		CIEDRN
N#Cc1ccc(CNc2ccc(-c3ccco3)cc2F)o1	ZINC000362955504	267067567	/nfs/dbraw/zinc/06/75/67/267067567.db2.gz	RKZCHXBENHXEAJ-UHFFFAOYSA-N	0	0	282.274	4.162	20	30		CIEDRN
C=CCCC(=O)N1CCC[C@H]1c1ccccc1C(F)(F)F	ZINC000363017057	267072822	/nfs/dbraw/zinc/07/28/22/267072822.db2.gz	LBUYPYFWUFYPJB-AWEZNQCLSA-N	0	0	297.320	4.335	20	30		CIEDRN
CC(C)(C#N)CCCCN1Cc2cccc(Cl)c2C1	ZINC000367856014	267122661	/nfs/dbraw/zinc/12/26/61/267122661.db2.gz	KJVVYPXIIPUDAU-UHFFFAOYSA-N	0	0	276.811	4.376	20	30		CIEDRN
Cc1cnc([C@@H]2CCCCN2Cc2ccc(C#N)cc2)s1	ZINC000371346157	267393996	/nfs/dbraw/zinc/39/39/96/267393996.db2.gz	VHRXFIYVWPJHHP-INIZCTEOSA-N	0	0	297.427	4.050	20	30		CIEDRN
C=CCCCC(=O)N[C@H](CC)c1nc(-c2ccccc2)c[nH]1	ZINC000371882314	267478399	/nfs/dbraw/zinc/47/83/99/267478399.db2.gz	BLBHZULDOWKXGQ-OAHLLOKOSA-N	0	0	297.402	4.000	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1C[C@H](c2ccsc2)C[C@H]1C	ZINC000372013159	267496910	/nfs/dbraw/zinc/49/69/10/267496910.db2.gz	YMRFIOWHQWCYOP-GZBFAFLISA-N	0	0	277.433	4.055	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1Cc2ccccc2SC[C@H]1C	ZINC000372247038	267536602	/nfs/dbraw/zinc/53/66/02/267536602.db2.gz	JNXNWGNXOFSIKC-UONOGXRCSA-N	0	0	289.444	4.112	20	30		CIEDRN
CN(Cc1cnc(C2CCCCC2)s1)CC(C)(C)C#N	ZINC000575238001	335087457	/nfs/dbraw/zinc/08/74/57/335087457.db2.gz	GZFZSJKWCQWNDX-UHFFFAOYSA-N	0	0	291.464	4.172	20	30		CIEDRN
N#CCCC1CCN(C(=O)c2cc3ccccc3s2)CC1	ZINC000335384801	335092375	/nfs/dbraw/zinc/09/23/75/335092375.db2.gz	MXVAPSFCAHUSGB-UHFFFAOYSA-N	0	0	298.411	4.057	20	30		CIEDRN
C=CCCCNC(=O)N1CC[C@H](C)C[C@H]1c1ccc(C)o1	ZINC000448388000	327613651	/nfs/dbraw/zinc/61/36/51/327613651.db2.gz	YJEHGEZTWAUJHG-ZFWWWQNUSA-N	0	0	290.407	4.037	20	30		CIEDRN
N#Cc1ccc(CNc2cccc(C(F)F)c2)c(F)c1	ZINC000170642762	327647791	/nfs/dbraw/zinc/64/77/91/327647791.db2.gz	LERJJKQLTLFBLO-UHFFFAOYSA-N	0	0	276.261	4.247	20	30		CIEDRN
CC(C)CCC(=O)Nc1nc(-c2cccc(C#N)c2)cs1	ZINC000160975523	327671031	/nfs/dbraw/zinc/67/10/31/327671031.db2.gz	RDNIKVOEPWKGNC-UHFFFAOYSA-N	0	0	299.399	4.056	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)CCCc1ccccc1Cl	ZINC000580138015	327706748	/nfs/dbraw/zinc/70/67/48/327706748.db2.gz	YIRZHCAAPGYKAR-AWEZNQCLSA-N	0	0	279.811	4.134	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H](C)c1cc(C)cc(C)c1	ZINC000580220508	327738088	/nfs/dbraw/zinc/73/80/88/327738088.db2.gz	MEXBZOILKVTVED-CQSZACIVSA-N	0	0	259.393	4.083	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)CCCc1c[nH]c2ccccc12	ZINC000182599109	327750038	/nfs/dbraw/zinc/75/00/38/327750038.db2.gz	IGCYTBILLDSUJR-HNNXBMFYSA-N	0	0	298.430	4.352	20	30		CIEDRN
Cc1nc(N2CCC[C@@H]3CCCC[C@@H]32)c(Cl)cc1C#N	ZINC000378730230	327753821	/nfs/dbraw/zinc/75/38/21/327753821.db2.gz	CVPSXPZDGHGOBF-WFASDCNBSA-N	0	0	289.810	4.074	20	30		CIEDRN
C[C@H](Sc1cc(C#N)ccn1)c1ncc(C(C)(C)C)o1	ZINC000177250873	327788653	/nfs/dbraw/zinc/78/86/53/327788653.db2.gz	HZSRGCNTQGACHU-JTQLQIEISA-N	0	0	287.388	4.092	20	30		CIEDRN
C[C@@H]1CCN(CCCC(C)(C)C#N)c2ccccc21	ZINC000388113758	327837456	/nfs/dbraw/zinc/83/74/56/327837456.db2.gz	HWVXQZHGFHYMRQ-CQSZACIVSA-N	0	0	256.393	4.330	20	30		CIEDRN
Cc1ccc(NC(=O)C(C)C)cc1N[C@H]1CCC[C@@H](C#N)C1	ZINC000185722454	327843216	/nfs/dbraw/zinc/84/32/16/327843216.db2.gz	LCQCPHUPYHLICJ-CABCVRRESA-N	0	0	299.418	4.084	20	30		CIEDRN
Cc1cc(C#N)ccc1-c1nc(CC2CCCCC2)no1	ZINC000379084437	327875752	/nfs/dbraw/zinc/87/57/52/327875752.db2.gz	CODZJFZOZCAWEX-UHFFFAOYSA-N	0	0	281.359	4.040	20	30		CIEDRN
C[C@@H](Nc1cccc(OCCCC#N)c1)[C@@H]1CC1(C)C	ZINC000397634755	327885760	/nfs/dbraw/zinc/88/57/60/327885760.db2.gz	WRAFMDOOLLLZAV-CJNGLKHVSA-N	0	0	272.392	4.216	20	30		CIEDRN
Cc1ccc(C(=O)Nc2cc(C#N)ccc2C)cc1Cl	ZINC000063021692	327905531	/nfs/dbraw/zinc/90/55/31/327905531.db2.gz	RDWMEXXOACAWRD-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
CCCCN(CCCC)C(=O)Nc1ccc(F)cc1C#N	ZINC000531437765	327906714	/nfs/dbraw/zinc/90/67/14/327906714.db2.gz	KJJNDYHHBBOZKS-UHFFFAOYSA-N	0	0	291.370	4.131	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1ccc(C)c(O)c1C)c1ccccc1	ZINC000186508183	327916947	/nfs/dbraw/zinc/91/69/47/327916947.db2.gz	MVJREUCCJIOHAC-MRXNPFEDSA-N	0	0	295.382	4.307	20	30		CIEDRN
CCOc1ccc(F)c(NCCCC(C)(C)C#N)c1F	ZINC000533955880	327944026	/nfs/dbraw/zinc/94/40/26/327944026.db2.gz	WQQOKTNHNLTWAH-UHFFFAOYSA-N	0	0	282.334	4.105	20	30		CIEDRN
COc1ccc([C@H](C)Nc2ccc(F)cc2C#N)cc1F	ZINC000097635287	327990188	/nfs/dbraw/zinc/99/01/88/327990188.db2.gz	GXCHSABVOIPXDZ-JTQLQIEISA-N	0	0	288.297	4.018	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)N[C@@H](CCC)c1ccccc1)OCC	ZINC000339430587	328010705	/nfs/dbraw/zinc/01/07/05/328010705.db2.gz	FJDLPEOOFOVETP-DLBZAZTESA-N	0	0	289.419	4.015	20	30		CIEDRN
C=C(C)[C@H](CC(=O)N[C@@H](CCC)c1ccccc1)OCC	ZINC000339430589	328010708	/nfs/dbraw/zinc/01/07/08/328010708.db2.gz	FJDLPEOOFOVETP-IRXDYDNUSA-N	0	0	289.419	4.015	20	30		CIEDRN
C=C(C)[C@H](CC(=O)N[C@H](CCC)c1ccccc1)OCC	ZINC000339430590	328010734	/nfs/dbraw/zinc/01/07/34/328010734.db2.gz	FJDLPEOOFOVETP-SJORKVTESA-N	0	0	289.419	4.015	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)[C@H]1CCCc2ccccc21	ZINC000531518374	328013621	/nfs/dbraw/zinc/01/36/21/328013621.db2.gz	VAVYYQSOQXOSDY-KRWDZBQOSA-N	0	0	298.430	4.085	20	30		CIEDRN
Cc1cccc(SCc2cc(C#N)ccc2F)c1	ZINC000040696065	328016994	/nfs/dbraw/zinc/01/69/94/328016994.db2.gz	WWUUBFHKEYIIDF-UHFFFAOYSA-N	0	0	257.333	4.298	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(Cc1ccco1)C1CCCC1	ZINC000125990678	328037965	/nfs/dbraw/zinc/03/79/65/328037965.db2.gz	CBBSMZROIMROOD-UHFFFAOYSA-N	0	0	287.403	4.319	20	30		CIEDRN
C=CCCC(=O)Nc1nc(-c2cc3ccccc3o2)cs1	ZINC000110321214	328045222	/nfs/dbraw/zinc/04/52/22/328045222.db2.gz	ULELROGVNHTUDL-UHFFFAOYSA-N	0	0	298.367	4.461	20	30		CIEDRN
C=CC1CCN(C(=O)C[C@H](c2ccccc2)C(C)C)CC1	ZINC000110359673	328046637	/nfs/dbraw/zinc/04/66/37/328046637.db2.gz	NMYSRWINETWAOI-SFHVURJKSA-N	0	0	285.431	4.241	20	30		CIEDRN
C=CCCCC(=O)Nc1cnc(-c2ccccc2)s1	ZINC000534341812	328050023	/nfs/dbraw/zinc/05/00/23/328050023.db2.gz	XAJYTRCONKCBJS-UHFFFAOYSA-N	0	0	272.373	4.105	20	30		CIEDRN
CC(C)c1ccc(CSc2cccc(C#N)n2)cc1	ZINC000534396260	328050771	/nfs/dbraw/zinc/05/07/71/328050771.db2.gz	CDTVGZQGBOSXNX-UHFFFAOYSA-N	0	0	268.385	4.369	20	30		CIEDRN
C=CCCCN(C)C(=O)[C@@H]1CC[C@@H]2CCCC[C@H]2C1	ZINC000534396145	328050863	/nfs/dbraw/zinc/05/08/63/328050863.db2.gz	ITLBGGLWTIQACI-HRCADAONSA-N	0	0	263.425	4.018	20	30		CIEDRN
C=CC1CCN(C(=O)[C@@H]2CC[C@H]3CCCC[C@@H]3C2)CC1	ZINC000534420667	328052431	/nfs/dbraw/zinc/05/24/31/328052431.db2.gz	FNHHUXTWKOATMK-BRWVUGGUSA-N	0	0	275.436	4.018	20	30		CIEDRN
CCOc1cccc(CNc2cccc(Cl)c2C#N)c1	ZINC000048337128	328053298	/nfs/dbraw/zinc/05/32/98/328053298.db2.gz	YFCODVUZPYFBFY-UHFFFAOYSA-N	0	0	286.762	4.222	20	30		CIEDRN
C[C@@]1(CNc2cccc(C(F)F)c2C#N)CCCS1	ZINC000563426495	328065902	/nfs/dbraw/zinc/06/59/02/328065902.db2.gz	NHNDENDZIKKXAD-AWEZNQCLSA-N	0	0	282.359	4.193	20	30		CIEDRN
C[C@H](Oc1ccccc1N[C@@H]1CC[C@@H](C#N)C1)C(F)(F)F	ZINC000563482383	328069496	/nfs/dbraw/zinc/06/94/96/328069496.db2.gz	KWFRWHIWAIFQPX-QJPTWQEYSA-N	0	0	298.308	4.120	20	30		CIEDRN
C=CCC1(C(=O)N2CCC[C@@H](C(C)C)C2)CCCC1	ZINC000450981482	328099351	/nfs/dbraw/zinc/09/93/51/328099351.db2.gz	QBBYBZPVPOIMPB-OAHLLOKOSA-N	0	0	263.425	4.018	20	30		CIEDRN
N#Cc1ccc(NCCC2(F)CCC2)c(C(F)(F)F)c1	ZINC000571317822	328104912	/nfs/dbraw/zinc/10/49/12/328104912.db2.gz	DXHHQEQJKIBREU-UHFFFAOYSA-N	0	0	286.272	4.271	20	30		CIEDRN
Cc1cccnc1S[C@@H](C)c1cccc(C#N)c1	ZINC000571307353	328101464	/nfs/dbraw/zinc/10/14/64/328101464.db2.gz	WMAYWLCLTCTTBH-LBPRGKRZSA-N	0	0	254.358	4.115	20	30		CIEDRN
C=CCCC1(C(=O)N2CC(c3cccc(Cl)c3)C2)CC1	ZINC000412391796	328109597	/nfs/dbraw/zinc/10/95/97/328109597.db2.gz	ZSOOQUHIKIVAFQ-UHFFFAOYSA-N	0	0	289.806	4.012	20	30		CIEDRN
CCc1nc(C(C)C)ccc1CSc1cccnc1C#N	ZINC000571345528	328113623	/nfs/dbraw/zinc/11/36/23/328113623.db2.gz	RXQVUQSKNPINMP-UHFFFAOYSA-N	0	0	297.427	4.326	20	30		CIEDRN
CC(F)(F)CCNc1ccc(C#N)c(C(F)(F)F)c1	ZINC000393648882	329088494	/nfs/dbraw/zinc/08/84/94/329088494.db2.gz	LYYBWKNQINMUDB-UHFFFAOYSA-N	0	0	278.224	4.034	20	30		CIEDRN
C=C(C)[C@@H](Cc1nc(C2CCC(C)(C)CC2)no1)OCC	ZINC000571447384	328122684	/nfs/dbraw/zinc/12/26/84/328122684.db2.gz	XUQHPCQVMQUSHZ-CQSZACIVSA-N	0	0	292.423	4.277	20	30		CIEDRN
CC(C)(C)c1ccc(C(=O)NCCCCC#N)cc1Cl	ZINC000571454883	328123081	/nfs/dbraw/zinc/12/30/81/328123081.db2.gz	ZXDQAOIYLITVQX-UHFFFAOYSA-N	0	0	292.810	4.061	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H]1CCCc2ccc(C)cc21	ZINC000571476408	328124430	/nfs/dbraw/zinc/12/44/30/328124430.db2.gz	VWHNOIKPAAVKCP-FUHWJXTLSA-N	0	0	271.404	4.091	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(C(F)(F)c2ccc(F)cc2)no1	ZINC000571481824	328124531	/nfs/dbraw/zinc/12/45/31/328124531.db2.gz	OQWMYJFEYIOHNR-AWEZNQCLSA-N	0	0	296.292	4.203	20	30		CIEDRN
C=CCCOCCCCC(=O)N[C@@H]1CCC[C@@H]1C(C)(C)C	ZINC000412808497	328125873	/nfs/dbraw/zinc/12/58/73/328125873.db2.gz	GUPGHVFSDAHSMM-JKSUJKDBSA-N	0	0	295.467	4.080	20	30		CIEDRN
C=CCCOCCCCC(=O)N[C@H]1CCC[C@H]1C(C)(C)C	ZINC000412808490	328125884	/nfs/dbraw/zinc/12/58/84/328125884.db2.gz	GUPGHVFSDAHSMM-CVEARBPZSA-N	0	0	295.467	4.080	20	30		CIEDRN
CC(C)c1ccc(-c2noc(CSCCC#N)n2)cc1	ZINC000413015551	328140326	/nfs/dbraw/zinc/14/03/26/328140326.db2.gz	TWAHSTIWPJPWDF-UHFFFAOYSA-N	0	0	287.388	4.007	20	30		CIEDRN
N#CCCSCCCOc1ccc2ccccc2c1	ZINC000413010325	328139487	/nfs/dbraw/zinc/13/94/87/328139487.db2.gz	GBYXVILBJRCNCR-UHFFFAOYSA-N	0	0	271.385	4.256	20	30		CIEDRN
C[C@H](SCCC#N)c1ccc(Br)cc1	ZINC000413011465	328139799	/nfs/dbraw/zinc/13/97/99/328139799.db2.gz	CRYPNBVFSSGWJM-VIFPVBQESA-N	0	0	270.195	4.157	20	30		CIEDRN
Cc1cc([C@@H](Nc2ncc(C#N)cc2F)C2CC2)ccc1F	ZINC000413211363	328142609	/nfs/dbraw/zinc/14/26/09/328142609.db2.gz	PTVMAYBPHIAEAK-INIZCTEOSA-N	0	0	299.324	4.103	20	30		CIEDRN
CC(C)(C)c1ccncc1CNc1cccc(F)c1C#N	ZINC000413503888	328147290	/nfs/dbraw/zinc/14/72/90/328147290.db2.gz	CCRLTSUFKQHEEA-UHFFFAOYSA-N	0	0	283.350	4.002	20	30		CIEDRN
C=CCCCC(=O)N[C@H](CC)c1ccccc1OCC	ZINC000175509460	329169394	/nfs/dbraw/zinc/16/93/94/329169394.db2.gz	XRMBHNCRDZONNI-OAHLLOKOSA-N	0	0	275.392	4.009	20	30		CIEDRN
N#C[C@H]1CCC[C@H](Nc2cccc(-c3nccs3)c2)C1	ZINC000274206281	328209483	/nfs/dbraw/zinc/20/94/83/328209483.db2.gz	MGFHFVHBGIWIAK-JSGCOSHPSA-N	0	0	283.400	4.304	20	30		CIEDRN
C=C(C)CSCC(=O)Nc1c(C)cc(C)cc1Cl	ZINC000177865117	329187100	/nfs/dbraw/zinc/18/71/00/329187100.db2.gz	HRCNMFPTYXIZSX-UHFFFAOYSA-N	0	0	283.824	4.205	20	30		CIEDRN
N#C[C@H]1CC[C@@H](Sc2nc3ccccc3s2)C1	ZINC000278547947	328227265	/nfs/dbraw/zinc/22/72/65/328227265.db2.gz	KZQQDRHDBUEALD-VHSXEESVSA-N	0	0	260.387	4.081	20	30		CIEDRN
N#C[C@@H]1CC[C@H](Sc2ncc(-c3ccc(F)cc3)o2)C1	ZINC000278696231	328229753	/nfs/dbraw/zinc/22/97/53/328229753.db2.gz	ZVSVAAKMPHJRNZ-MFKMUULPSA-N	0	0	288.347	4.265	20	30		CIEDRN
CC(C)(C)c1nc2cc(NC(=O)CC(C)(C)C#N)ccc2o1	ZINC000278897698	328231934	/nfs/dbraw/zinc/23/19/34/328231934.db2.gz	YBXSCTLYGOJUGM-UHFFFAOYSA-N	0	0	299.374	4.004	20	30		CIEDRN
Cc1csc([C@H]([NH2+]CCCCC(C)(C)C#N)C2CC2)n1	ZINC000278899922	328231999	/nfs/dbraw/zinc/23/19/99/328231999.db2.gz	VEKCKTMBJOSKNU-CQSZACIVSA-N	0	0	291.464	4.212	20	30		CIEDRN
CSc1ccc(C(=O)/C=C/c2ccnn2C(C)C)cc1	ZINC000279990645	328233991	/nfs/dbraw/zinc/23/39/91/328233991.db2.gz	GQLIQAJKBKMOQF-RMKNXTFCSA-N	0	0	286.400	4.082	20	30		CIEDRN
Cc1cccc(Cl)c1NCCCC1(C#N)CCOCC1	ZINC000280948456	328237226	/nfs/dbraw/zinc/23/72/26/328237226.db2.gz	GFGCHXVWQYIKAY-UHFFFAOYSA-N	0	0	292.810	4.161	20	30		CIEDRN
N#CC1(CCCSc2ccc(F)cc2)CCOCC1	ZINC000280981818	328237782	/nfs/dbraw/zinc/23/77/82/328237782.db2.gz	LXPVLNGTPDPYKX-UHFFFAOYSA-N	0	0	279.380	4.018	20	30		CIEDRN
CC(C)(C#N)CC(=O)Nc1cc(Cl)c(Cl)cc1F	ZINC000281011900	328237876	/nfs/dbraw/zinc/23/78/76/328237876.db2.gz	FMCHUUUQTQBAKW-UHFFFAOYSA-N	0	0	289.137	4.011	20	30		CIEDRN
N#CC1(CCCN(CC2CC2)c2ccccc2)CCOCC1	ZINC000281871514	328241364	/nfs/dbraw/zinc/24/13/64/328241364.db2.gz	CIZRTTLHIXWSIX-UHFFFAOYSA-N	0	0	298.430	4.004	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)Nc1ccc(OC(C)C)cc1Cl	ZINC000285517803	328248077	/nfs/dbraw/zinc/24/80/77/328248077.db2.gz	ADAONALEPQJKFQ-OAHLLOKOSA-N	0	0	294.782	4.006	20	30		CIEDRN
N#C[C@@H]1CC[C@@H](Sc2nc(-c3ccccc3)co2)C1	ZINC000287506013	328251501	/nfs/dbraw/zinc/25/15/01/328251501.db2.gz	KYMQOOCMKSKDCJ-DGCLKSJQSA-N	0	0	270.357	4.126	20	30		CIEDRN
N#C[C@@H]1CC[C@H](Sc2nc(-c3ccccc3)co2)C1	ZINC000287506023	328251517	/nfs/dbraw/zinc/25/15/17/328251517.db2.gz	KYMQOOCMKSKDCJ-YPMHNXCESA-N	0	0	270.357	4.126	20	30		CIEDRN
C=C(C)CCNc1ccccc1S[C@H](C)CC#N	ZINC000288659810	328253331	/nfs/dbraw/zinc/25/33/31/328253331.db2.gz	GITCWQAYYFBAAX-CYBMUJFWSA-N	0	0	260.406	4.459	20	30		CIEDRN
C=C(C)CCNc1ccccc1S[C@@H](C)CC#N	ZINC000288659812	328253343	/nfs/dbraw/zinc/25/33/43/328253343.db2.gz	GITCWQAYYFBAAX-ZDUSSCGKSA-N	0	0	260.406	4.459	20	30		CIEDRN
CCSc1cccc(-c2noc([C@@](C)(C#N)CC)n2)c1	ZINC000292943950	328274103	/nfs/dbraw/zinc/27/41/03/328274103.db2.gz	GSYBUXYCXDIOHY-OAHLLOKOSA-N	0	0	287.388	4.040	20	30		CIEDRN
COc1ccccc1[C@H](C)S[C@H]1CC[C@H](C#N)C1	ZINC000295943871	328288259	/nfs/dbraw/zinc/28/82/59/328288259.db2.gz	ICNBTZUAWDHPMB-AVGNSLFASA-N	0	0	261.390	4.182	20	30		CIEDRN
CC(C)CN(C(=O)c1cccc(CC#N)c1)c1ccccc1	ZINC000298630159	328296909	/nfs/dbraw/zinc/29/69/09/328296909.db2.gz	VLRWNUOXZVFQTK-UHFFFAOYSA-N	0	0	292.382	4.055	20	30		CIEDRN
C[C@@H](CCC#N)Sc1nnc(-c2ccc(Cl)s2)o1	ZINC000298343223	328296042	/nfs/dbraw/zinc/29/60/42/328296042.db2.gz	OFCFTNPHDCKVLD-ZETCQYMHSA-N	0	0	299.808	4.236	20	30		CIEDRN
COc1ccc(CS[C@@H](C)CCC#N)cc1Cl	ZINC000298412720	328296235	/nfs/dbraw/zinc/29/62/35/328296235.db2.gz	WGDBFIHKKPTJAF-JTQLQIEISA-N	0	0	269.797	4.274	20	30		CIEDRN
CCN(C(=O)c1cccc(CC#N)c1)c1cccc(C)c1C	ZINC000298635678	328297078	/nfs/dbraw/zinc/29/70/78/328297078.db2.gz	YAZGFNUBFQKRPI-UHFFFAOYSA-N	0	0	292.382	4.036	20	30		CIEDRN
N#Cc1cc(/C=C/c2ccc3ccccc3n2)ccc1F	ZINC000534479713	328303962	/nfs/dbraw/zinc/30/39/62/328303962.db2.gz	IBIHIMGTTSFGDH-VMPITWQZSA-N	0	0	274.298	4.416	20	30		CIEDRN
N#Cc1cc(/C=C\c2ccc3ccccc3n2)ccc1F	ZINC000534479716	328303974	/nfs/dbraw/zinc/30/39/74/328303974.db2.gz	IBIHIMGTTSFGDH-YVMONPNESA-N	0	0	274.298	4.416	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)C[C@H]1CCCC[C@@H]1C	ZINC000531896258	328305412	/nfs/dbraw/zinc/30/54/12/328305412.db2.gz	SPIBIQKBESHOMV-LSDHHAIUSA-N	0	0	278.440	4.182	20	30		CIEDRN
C=CCCSCc1ncc(-c2ccccc2C)o1	ZINC000534527733	328305598	/nfs/dbraw/zinc/30/55/98/328305598.db2.gz	UONMFMRFUHMRGU-UHFFFAOYSA-N	0	0	259.374	4.459	20	30		CIEDRN
Cc1ccc(Cl)cc1NCCOc1ccc(C#N)cc1	ZINC000048429027	328308353	/nfs/dbraw/zinc/30/83/53/328308353.db2.gz	JJZFLUGCWWLVDM-UHFFFAOYSA-N	0	0	286.762	4.011	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@H]1CCCC[C@@H]1C)c1ccccc1	ZINC000534601071	328320433	/nfs/dbraw/zinc/32/04/33/328320433.db2.gz	SXIRNBLMEPXHCQ-UXLLHSPISA-N	0	0	271.404	4.041	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1ccc(OCC)cc1)c1ccccc1	ZINC000534601983	328321024	/nfs/dbraw/zinc/32/10/24/328321024.db2.gz	YIWZOCFVMZXUJO-OAHLLOKOSA-N	0	0	295.382	4.384	20	30		CIEDRN
C=C[C@@H](CC(=O)N[C@H](C)CCC(C)C)c1ccccc1	ZINC000534604740	328321449	/nfs/dbraw/zinc/32/14/49/328321449.db2.gz	QKZSGYLAPYWEOU-CVEARBPZSA-N	0	0	273.420	4.287	20	30		CIEDRN
N#Cc1cc(NC(=O)c2ccc(Cl)s2)ccc1Cl	ZINC000048824288	328324779	/nfs/dbraw/zinc/32/47/79/328324779.db2.gz	ZRNLAGREXXODQU-UHFFFAOYSA-N	0	0	297.166	4.179	20	30		CIEDRN
N#Cc1c(Cl)cccc1NCCc1ccccc1F	ZINC000048936444	328326114	/nfs/dbraw/zinc/32/61/14/328326114.db2.gz	IOTFVQMIWDQHMJ-UHFFFAOYSA-N	0	0	274.726	4.005	20	30		CIEDRN
N#Cc1c(Cl)cccc1NCCCOc1ccccc1	ZINC000048936625	328326257	/nfs/dbraw/zinc/32/62/57/328326257.db2.gz	WEHRGEWINKSQOH-UHFFFAOYSA-N	0	0	286.762	4.093	20	30		CIEDRN
C=C[C@H](Cc1nc(-c2ccsc2)no1)c1ccccc1	ZINC000534668764	328346485	/nfs/dbraw/zinc/34/64/85/328346485.db2.gz	IZDDSAYPUOCBSA-GFCCVEGCSA-N	0	0	282.368	4.310	20	30		CIEDRN
C=C[C@H](Cc1nc(-c2ccccc2)no1)c1ccccc1	ZINC000534673357	328348841	/nfs/dbraw/zinc/34/88/41/328348841.db2.gz	LAUDNPVFEHOUPY-CQSZACIVSA-N	0	0	276.339	4.249	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1ccc(F)c(F)c1)c1ccccc1	ZINC000534709364	328358817	/nfs/dbraw/zinc/35/88/17/328358817.db2.gz	OYYHZFXPRFLZHI-GFCCVEGCSA-N	0	0	287.309	4.263	20	30		CIEDRN
C=C[C@H](CC(=O)N(Cc1ccco1)C(C)C)c1ccccc1	ZINC000534706947	328357426	/nfs/dbraw/zinc/35/74/26/328357426.db2.gz	VGHFNFPQPDJBAZ-MRXNPFEDSA-N	0	0	297.398	4.377	20	30		CIEDRN
C=C(C)CN1CCSC[C@@H]1c1ccc(Cl)cc1	ZINC000303686653	328357703	/nfs/dbraw/zinc/35/77/03/328357703.db2.gz	UCCNZRVINQMWPL-CQSZACIVSA-N	0	0	267.825	4.006	20	30		CIEDRN
C=CCCNc1ccc(C(=O)NC2CCCCC2)cc1C	ZINC000303788472	328358241	/nfs/dbraw/zinc/35/82/41/328358241.db2.gz	DZJHZSHGCIRXCO-UHFFFAOYSA-N	0	0	286.419	4.046	20	30		CIEDRN
C=C(C)CSc1cc(Br)ccc1OC	ZINC000303895832	328364045	/nfs/dbraw/zinc/36/40/45/328364045.db2.gz	PHJGZUKQKRAZGO-UHFFFAOYSA-N	0	0	273.195	4.126	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)CCC1CCCCC1	ZINC000049495802	328365530	/nfs/dbraw/zinc/36/55/30/328365530.db2.gz	SMWCSHRPLXFIKA-UHFFFAOYSA-N	0	0	270.376	4.166	20	30		CIEDRN
CCc1ccc([C@@H]2C[C@@H](C)CCN2c2cccc(C#N)n2)o1	ZINC000534881392	328366693	/nfs/dbraw/zinc/36/66/93/328366693.db2.gz	DTBFFKCEQIOXGX-BBRMVZONSA-N	0	0	295.386	4.086	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)[C@@H](C)C(CC)CC	ZINC000534883620	328366909	/nfs/dbraw/zinc/36/69/09/328366909.db2.gz	DADNXNKDUHWXNA-ZDUSSCGKSA-N	0	0	266.429	4.037	20	30		CIEDRN
N#Cc1cccc(-c2csc(-c3cccc(O)c3)n2)c1	ZINC000070092544	328387780	/nfs/dbraw/zinc/38/77/80/328387780.db2.gz	ZAINBMGZRLUPFY-UHFFFAOYSA-N	0	0	278.336	4.054	20	30		CIEDRN
CC[C@@H](Nc1cccc(C#N)n1)c1ccc(Cl)s1	ZINC000535131051	328389733	/nfs/dbraw/zinc/38/97/33/328389733.db2.gz	YJQOLEOQAIZWOR-SNVBAGLBSA-N	0	0	277.780	4.231	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)c1cc2ccccc2s1	ZINC000050212905	328390150	/nfs/dbraw/zinc/39/01/50/328390150.db2.gz	ZOBBDKAVGMYAOH-UHFFFAOYSA-N	0	0	292.363	4.334	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)c1ccc(C(C)C)cc1	ZINC000050212866	328390180	/nfs/dbraw/zinc/39/01/80/328390180.db2.gz	WDNREJWCKPCUIO-UHFFFAOYSA-N	0	0	278.355	4.242	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@@H](C)c1oc2ccccc2c1C	ZINC000172062169	335093075	/nfs/dbraw/zinc/09/30/75/335093075.db2.gz	UUCJFEUOQHPOJL-YPMHNXCESA-N	0	0	286.375	4.066	20	30		CIEDRN
C=CCCC(=O)N(C)[C@@H](c1ccccc1C)C(C)C	ZINC000112258131	328394525	/nfs/dbraw/zinc/39/45/25/328394525.db2.gz	AJPBOILETDSONJ-QGZVFWFLSA-N	0	0	259.393	4.117	20	30		CIEDRN
N#CCN(C(=O)[C@@H]1CC[C@@H]2CCCC[C@H]2C1)c1ccccc1	ZINC000535211078	328394701	/nfs/dbraw/zinc/39/47/01/328394701.db2.gz	OAXCPLDUYKXMHL-YESZJQIVSA-N	0	0	296.414	4.150	20	30		CIEDRN
N#CCN(C(=O)[C@@H]1CC[C@H]2CCCC[C@@H]2C1)c1ccccc1	ZINC000535211063	328394843	/nfs/dbraw/zinc/39/48/43/328394843.db2.gz	OAXCPLDUYKXMHL-BRWVUGGUSA-N	0	0	296.414	4.150	20	30		CIEDRN
Cc1csc2nc(C)nc(NCC(C)(C)CCC#N)c12	ZINC000340935150	328402670	/nfs/dbraw/zinc/40/26/70/328402670.db2.gz	HOTKIYJUDFDOLJ-UHFFFAOYSA-N	0	0	288.420	4.050	20	30		CIEDRN
CCS[C@H](C)c1noc(CSCCC(C)(C)C#N)n1	ZINC000342020727	328416040	/nfs/dbraw/zinc/41/60/40/328416040.db2.gz	NXQNXVDACHDNEH-SNVBAGLBSA-N	0	0	299.465	4.057	20	30		CIEDRN
C=CCCC(=O)N(CC)Cc1ccc(Cl)c(Cl)c1	ZINC000102236207	328440040	/nfs/dbraw/zinc/44/00/40/328440040.db2.gz	XNQHURKRCJSQQG-UHFFFAOYSA-N	0	0	286.202	4.308	20	30		CIEDRN
C=CCCC(=O)N[C@@H](c1ccccc1)C1CCCC1	ZINC000102233727	328440044	/nfs/dbraw/zinc/44/00/44/328440044.db2.gz	COFFYXRSTJEPEO-KRWDZBQOSA-N	0	0	257.377	4.000	20	30		CIEDRN
C=C[C@H](CC(=O)N(C)[C@H]1CCC[C@@H](C)C1)c1ccccc1	ZINC000535331351	328440123	/nfs/dbraw/zinc/44/01/23/328440123.db2.gz	CMHUWWUGTHLQMA-NUJGCVRESA-N	0	0	285.431	4.383	20	30		CIEDRN
C=C[C@H](CC(=O)N(C)[C@H](C)C(C)(C)C)c1ccccc1	ZINC000535366675	328444672	/nfs/dbraw/zinc/44/46/72/328444672.db2.gz	BPEYMVZUEQDZBA-HUUCEWRRSA-N	0	0	273.420	4.239	20	30		CIEDRN
C=CCCC(=O)N1CCC[C@@H]1[C@@H](CC)c1ccccc1	ZINC000102343229	328450267	/nfs/dbraw/zinc/45/02/67/328450267.db2.gz	OKSXOGHHGHCHFZ-DLBZAZTESA-N	0	0	271.404	4.137	20	30		CIEDRN
N#CCc1ccc(C(=O)Nc2cccc3ccsc32)cc1	ZINC000535435443	328452217	/nfs/dbraw/zinc/45/22/17/328452217.db2.gz	HQUIDDZRPLSUCS-UHFFFAOYSA-N	0	0	292.363	4.220	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)c1cc2cc(F)ccc2o1	ZINC000172065290	335093165	/nfs/dbraw/zinc/09/31/65/335093165.db2.gz	WFJBXBQXJIUVFL-UHFFFAOYSA-N	0	0	294.285	4.004	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1c(C)cccc1Cl	ZINC000281867823	328504456	/nfs/dbraw/zinc/50/44/56/328504456.db2.gz	FEIRADPJZIFINR-LLVKDONJSA-N	0	0	266.772	4.125	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)[C@@H]1CCCC(F)(F)C1	ZINC000282661289	328511469	/nfs/dbraw/zinc/51/14/69/328511469.db2.gz	VCANXKMJUWRBIV-OAHLLOKOSA-N	0	0	293.357	4.027	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1c(F)cc(Cl)cc1F	ZINC000182886603	328513414	/nfs/dbraw/zinc/51/34/14/328513414.db2.gz	PJEBRXGQYPZGTQ-UHFFFAOYSA-N	0	0	288.725	4.048	20	30		CIEDRN
C[C@H](SCc1ccccc1C#N)c1cccc(C#N)c1	ZINC000190778584	328539113	/nfs/dbraw/zinc/53/91/13/328539113.db2.gz	UEIRGQXKQZTYEB-ZDUSSCGKSA-N	0	0	278.380	4.424	20	30		CIEDRN
CCCC(CCC)Sc1nnc(C)c(C)c1C#N	ZINC000580343220	328546198	/nfs/dbraw/zinc/54/61/98/328546198.db2.gz	VQWNREJTBINBOR-UHFFFAOYSA-N	0	0	263.410	4.026	20	30		CIEDRN
Cc1oc2ccccc2c1/C=C/c1ccncc1C#N	ZINC000349107473	328588044	/nfs/dbraw/zinc/58/80/44/328588044.db2.gz	JYEOGGYYUJAUJA-VOTSOKGWSA-N	0	0	260.296	4.178	20	30		CIEDRN
CC1(C)CN(CCCCC#N)c2cccc(Cl)c21	ZINC000533513589	326848966	/nfs/dbraw/zinc/84/89/66/326848966.db2.gz	OWRZGUXOHDOYPG-UHFFFAOYSA-N	0	0	262.784	4.131	20	30		CIEDRN
C=CCCC1(C(=O)N2CC[C@@H](c3ccc(C)cc3)C2)CC1	ZINC000530538643	326856086	/nfs/dbraw/zinc/85/60/86/326856086.db2.gz	HTKDOEPSSYQYIY-QGZVFWFLSA-N	0	0	283.415	4.057	20	30		CIEDRN
N#CCCCOc1cccc(NCCc2ccccc2)c1	ZINC000037777397	326861374	/nfs/dbraw/zinc/86/13/74/326861374.db2.gz	QYDUCJUKDSBFKH-UHFFFAOYSA-N	0	0	280.371	4.024	20	30		CIEDRN
CC(C)(C#N)CCCNc1cccc2c1OC(C)(C)C2	ZINC000530542532	326861933	/nfs/dbraw/zinc/86/19/33/326861933.db2.gz	VBFKYZUBFWAJCV-UHFFFAOYSA-N	0	0	272.392	4.142	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](C)c1ccccc1OC(C)C	ZINC000530644087	326883707	/nfs/dbraw/zinc/88/37/07/326883707.db2.gz	ZLKIQZHLQKCVHC-AWEZNQCLSA-N	0	0	275.392	4.007	20	30		CIEDRN
COc1ccc(S[C@@H](C#N)Cc2ccc(C)cc2)cc1	ZINC000067444149	326884735	/nfs/dbraw/zinc/88/47/35/326884735.db2.gz	UFJMNSXWFHKSAL-QGZVFWFLSA-N	0	0	283.396	4.231	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)CCC1CCCCC1	ZINC000530802757	326891914	/nfs/dbraw/zinc/89/19/14/326891914.db2.gz	UCDPGCICRNTKPE-UHFFFAOYSA-N	0	0	278.440	4.326	20	30		CIEDRN
C=CCCCC(=O)N(CCC)Cc1ccc(C)cc1	ZINC000530895539	326895280	/nfs/dbraw/zinc/89/52/80/326895280.db2.gz	MYYHREXTAMUAAE-UHFFFAOYSA-N	0	0	259.393	4.090	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)[C@@H]1CCCC(C)(C)C1	ZINC000533712835	326915245	/nfs/dbraw/zinc/91/52/45/326915245.db2.gz	UYGBMUCICVHZFC-CQSZACIVSA-N	0	0	270.376	4.022	20	30		CIEDRN
C=C[C@@](C)(CCOC)C(=O)N(C)c1ccccc1C(C)C	ZINC000584079058	326919997	/nfs/dbraw/zinc/91/99/97/326919997.db2.gz	MWSHHRUHAAOKKJ-SFHVURJKSA-N	0	0	289.419	4.002	20	30		CIEDRN
C=C(C)CCSc1ncnc2sc(C)cc21	ZINC000506432022	332772724	/nfs/dbraw/zinc/77/27/24/332772724.db2.gz	IXVWEEAMYLWCAJ-UHFFFAOYSA-N	0	0	250.392	4.058	20	30		CIEDRN
C=CCC(F)(F)c1nc(Cc2cc3ccccc3o2)no1	ZINC000556383342	326928431	/nfs/dbraw/zinc/92/84/31/326928431.db2.gz	ZAUQWLULSSWGTR-UHFFFAOYSA-N	0	0	290.269	4.075	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1cccc2ocnc21)c1ccccc1	ZINC000556452236	326942593	/nfs/dbraw/zinc/94/25/93/326942593.db2.gz	CPYKBEFDVHBZRX-CQSZACIVSA-N	0	0	292.338	4.126	20	30		CIEDRN
CCC(CC)CN(CC)C(=O)c1cc(C#N)ccc1Cl	ZINC000506498872	332773752	/nfs/dbraw/zinc/77/37/52/332773752.db2.gz	HJCBPZWCKHPAIM-UHFFFAOYSA-N	0	0	292.810	4.110	20	30		CIEDRN
C=CCC(C)(C)C(=O)NC[C@H]1CCC[C@H](C(F)(F)F)C1	ZINC000556567792	326951191	/nfs/dbraw/zinc/95/11/91/326951191.db2.gz	WUNNIJGRDOEEAZ-RYUDHWBXSA-N	0	0	291.357	4.074	20	30		CIEDRN
CCCC[C@@H](CCC)NC(=O)c1cc(C#N)ccc1Cl	ZINC000556880158	326977653	/nfs/dbraw/zinc/97/76/53/326977653.db2.gz	JPPTYHHVBRGQQK-CYBMUJFWSA-N	0	0	292.810	4.300	20	30		CIEDRN
C=C(CC)CSc1n[nH]c(C=Cc2ccccc2)n1	ZINC000557298897	327000917	/nfs/dbraw/zinc/00/09/17/327000917.db2.gz	AUXUKCJIHVGRAD-MDZDMXLPSA-N	0	0	271.389	4.033	20	30		CIEDRN
C=C(CC)CS[C@@H](C)C(=O)Nc1ccc(C)c(C)c1	ZINC000557306484	327001148	/nfs/dbraw/zinc/00/11/48/327001148.db2.gz	YWIGMDGRSPYNFB-AWEZNQCLSA-N	0	0	277.433	4.330	20	30		CIEDRN
CC(C)(C)CCCCC(=O)N[C@@H](C#N)C1CCCCC1	ZINC000557562670	327013288	/nfs/dbraw/zinc/01/32/88/327013288.db2.gz	BNWGMEKQJPRTFG-HNNXBMFYSA-N	0	0	278.440	4.182	20	30		CIEDRN
Cc1cccc([C@H](Nc2nc(C)cc(C#N)n2)C(C)(C)C)c1	ZINC000557604358	327015593	/nfs/dbraw/zinc/01/55/93/327015593.db2.gz	FTZMEHFJSUWSSG-INIZCTEOSA-N	0	0	294.402	4.164	20	30		CIEDRN
CC(C)CC[C@@H]1CCCN1c1nccc(C#N)c1Cl	ZINC000557626807	327017288	/nfs/dbraw/zinc/01/72/88/327017288.db2.gz	ISUMSMHGOLGRCB-ZDUSSCGKSA-N	0	0	277.799	4.012	20	30		CIEDRN
C=CCCOCCCCC(=O)Nc1ccc(/C=C/C)cc1	ZINC000557935126	327035696	/nfs/dbraw/zinc/03/56/96/327035696.db2.gz	LMQXXBPJNZCUKY-XBXARRHUSA-N	0	0	287.403	4.421	20	30		CIEDRN
C/C=C/c1ccc(NC(=O)c2ccc(C#N)cc2C)cc1	ZINC000557937735	327036408	/nfs/dbraw/zinc/03/64/08/327036408.db2.gz	OLCZHBHZPWOJGH-ONEGZZNKSA-N	0	0	276.339	4.152	20	30		CIEDRN
CC[C@@H](CC(=O)NCC(C)(C)CCC#N)c1ccccc1	ZINC000557996112	327039538	/nfs/dbraw/zinc/03/95/38/327039538.db2.gz	HEUDWEOWXRHXBR-HNNXBMFYSA-N	0	0	286.419	4.016	20	30		CIEDRN
CCc1cccc2c1OCC[C@@H]2Nc1ccc(C#N)cc1	ZINC000506752673	332779047	/nfs/dbraw/zinc/77/90/47/332779047.db2.gz	UYZQRGQOVSKTQF-KRWDZBQOSA-N	0	0	278.355	4.056	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cccc(-c2ncco2)c1C	ZINC000584189167	327059662	/nfs/dbraw/zinc/05/96/62/327059662.db2.gz	NGNICDNELQXRNK-GFCCVEGCSA-N	0	0	284.359	4.191	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1cccc(O[C@@H](C)CC)c1	ZINC000584224414	327073083	/nfs/dbraw/zinc/07/30/83/327073083.db2.gz	VDXAEMGRTQRJAN-AWEZNQCLSA-N	0	0	290.407	4.294	20	30		CIEDRN
CC(C)C[C@@](C)(C#N)NC(=O)c1ccc(-c2ccccc2)o1	ZINC000558140121	327075840	/nfs/dbraw/zinc/07/58/40/327075840.db2.gz	WHCICELEJWEANZ-SFHVURJKSA-N	0	0	296.370	4.005	20	30		CIEDRN
Cc1ccc(SCCNc2ccc(C#N)cc2F)cc1	ZINC000506838714	332780830	/nfs/dbraw/zinc/78/08/30/332780830.db2.gz	QICUUVKUZABFNG-UHFFFAOYSA-N	0	0	286.375	4.210	20	30		CIEDRN
C=C(C)CCNc1ccccc1OCC(F)(F)F	ZINC000558264482	327083957	/nfs/dbraw/zinc/08/39/57/327083957.db2.gz	WYHZYAKCXQFYLZ-UHFFFAOYSA-N	0	0	259.271	4.006	20	30		CIEDRN
C=C(C)CCNc1ccc(Oc2cccnc2)cc1	ZINC000558272392	327084757	/nfs/dbraw/zinc/08/47/57/327084757.db2.gz	AJMXRVVMJZFENN-UHFFFAOYSA-N	0	0	254.333	4.252	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(Cc2cccc(Cl)c2)no1	ZINC000558279002	327085049	/nfs/dbraw/zinc/08/50/49/327085049.db2.gz	FNWWVEWRMWVBBX-LLVKDONJSA-N	0	0	276.767	4.384	20	30		CIEDRN
CC[C@@](C)(C#N)c1nc([C@H](c2cccc(C)c2)C(C)C)no1	ZINC000558393068	327090125	/nfs/dbraw/zinc/09/01/25/327090125.db2.gz	JAOGGJZBIMTFSL-YJBOKZPZSA-N	0	0	297.402	4.357	20	30		CIEDRN
CC[C@](C)(C#N)c1nc([C@H](c2cccc(C)c2)C(C)C)no1	ZINC000558393066	327090183	/nfs/dbraw/zinc/09/01/83/327090183.db2.gz	JAOGGJZBIMTFSL-MAUKXSAKSA-N	0	0	297.402	4.357	20	30		CIEDRN
C=CCn1c([C@H](C)CC)nnc1N(C)[C@H](C)c1ccccc1	ZINC000558452080	327095437	/nfs/dbraw/zinc/09/54/37/327095437.db2.gz	CSWQGMIDGGFZAE-HUUCEWRRSA-N	0	0	298.434	4.175	20	30		CIEDRN
C=CCCCCNC(=O)N[C@@H]1CCc2sc(Cl)cc21	ZINC000558606687	327108614	/nfs/dbraw/zinc/10/86/14/327108614.db2.gz	QPFPAXALUUGBCT-LLVKDONJSA-N	0	0	298.839	4.044	20	30		CIEDRN
CC(C)(CNc1cc(Cl)ccc1C#N)C(F)(F)F	ZINC000558689494	327114314	/nfs/dbraw/zinc/11/43/14/327114314.db2.gz	GBFUALAHVNNUGQ-UHFFFAOYSA-N	0	0	276.689	4.212	20	30		CIEDRN
CC1(C)Cc2cccc(NCc3ccc(CC#N)cc3)c2O1	ZINC000558708224	327116209	/nfs/dbraw/zinc/11/62/09/327116209.db2.gz	YSHIRYWOHHFCMI-UHFFFAOYSA-N	0	0	292.382	4.078	20	30		CIEDRN
C=CCCSCC[C@H](C)OCc1ccccc1	ZINC000559156477	327144007	/nfs/dbraw/zinc/14/40/07/327144007.db2.gz	GIDFWSKTWCTLRN-AWEZNQCLSA-N	0	0	250.407	4.291	20	30		CIEDRN
C[C@@H](CNc1ccc(C#N)cc1F)c1ccc(F)cc1	ZINC000507015939	332784266	/nfs/dbraw/zinc/78/42/66/332784266.db2.gz	UMIXVDVBPCPROR-NSHDSACASA-N	0	0	272.298	4.052	20	30		CIEDRN
CC(C)(C)C[C@@H]1CCCN1c1cccc(F)c1C#N	ZINC000507016554	332784290	/nfs/dbraw/zinc/78/42/90/332784290.db2.gz	ZESBEYBFYUFIGE-LBPRGKRZSA-N	0	0	260.356	4.102	20	30		CIEDRN
N#Cc1csc(C(=O)Nc2cccc(Cl)c2Cl)c1	ZINC000084058731	327148920	/nfs/dbraw/zinc/14/89/20/327148920.db2.gz	QBDWCSCJWBQSIR-UHFFFAOYSA-N	0	0	297.166	4.179	20	30		CIEDRN
CC(C)OCc1ccc(Nc2cccc(F)c2C#N)cc1	ZINC000507041863	332784692	/nfs/dbraw/zinc/78/46/92/332784692.db2.gz	XQHIPROZIJUGDO-UHFFFAOYSA-N	0	0	284.334	4.366	20	30		CIEDRN
N#Cc1ccc(CNc2cccc(C(F)F)c2)s1	ZINC000128516275	327153301	/nfs/dbraw/zinc/15/33/01/327153301.db2.gz	WXEFMLYJVVRGDQ-UHFFFAOYSA-N	0	0	264.300	4.169	20	30		CIEDRN
C=CCC[C@H](C(=O)N[C@H]1CCC[C@@H]1C)c1ccccc1	ZINC000409658818	327162993	/nfs/dbraw/zinc/16/29/93/327162993.db2.gz	ZKAIJGBASZZUSR-XIRDDKMYSA-N	0	0	271.404	4.041	20	30		CIEDRN
C=CCCc1ccccc1NCc1ccnn1C(C)C	ZINC000409844918	327165858	/nfs/dbraw/zinc/16/58/58/327165858.db2.gz	WHNAINAXEROLSM-UHFFFAOYSA-N	0	0	269.392	4.195	20	30		CIEDRN
CCc1ccc([C@@H](Nc2nc(C)cc(C#N)n2)C(C)C)cc1	ZINC000569370024	327167691	/nfs/dbraw/zinc/16/76/91/327167691.db2.gz	MMTXLIZSGFAGCS-KRWDZBQOSA-N	0	0	294.402	4.028	20	30		CIEDRN
CCc1ccc([C@H](Nc2nc(C)cc(C#N)n2)C(C)C)cc1	ZINC000569370026	327167720	/nfs/dbraw/zinc/16/77/20/327167720.db2.gz	MMTXLIZSGFAGCS-QGZVFWFLSA-N	0	0	294.402	4.028	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1ccc(-c2ccccc2F)o1	ZINC000410128207	327179842	/nfs/dbraw/zinc/17/98/42/327179842.db2.gz	QUEOJDQCPBVNSJ-LBPRGKRZSA-N	0	0	287.334	4.170	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)c1cccc(OC2CCCC2)c1	ZINC000410131082	327180100	/nfs/dbraw/zinc/18/01/00/327180100.db2.gz	PQMJLGMDGVYTKS-HNNXBMFYSA-N	0	0	287.403	4.093	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1	ZINC000410130512	327180224	/nfs/dbraw/zinc/18/02/24/327180224.db2.gz	MOPGUBIDWJSJIM-OTWHNJEPSA-N	0	0	293.410	4.414	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)C[C@@H](c1ccccc1)C(F)(F)F	ZINC000410146478	327181358	/nfs/dbraw/zinc/18/13/58/327181358.db2.gz	YKTKEBGGYKYURF-KBPBESRZSA-N	0	0	299.336	4.194	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1ccc(OC)cc1C	ZINC000410354387	327187338	/nfs/dbraw/zinc/18/73/38/327187338.db2.gz	PVMLOQNURDMTOV-UHFFFAOYSA-N	0	0	295.382	4.375	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)[C@@H]1CCCCS1	ZINC000410344775	327187612	/nfs/dbraw/zinc/18/76/12/327187612.db2.gz	LXZSWMVMXJGFAD-HNNXBMFYSA-N	0	0	275.417	4.029	20	30		CIEDRN
COc1ccc(OC(C)C)c(NCC(C)(C)CCC#N)c1	ZINC000092169181	327188783	/nfs/dbraw/zinc/18/87/83/327188783.db2.gz	KGBIXWXVMJKADL-UHFFFAOYSA-N	0	0	290.407	4.224	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)[C@@H]1CC[C@H](C)C1	ZINC000410382217	327189056	/nfs/dbraw/zinc/18/90/56/327189056.db2.gz	LNKQCKUJYYDJQV-DZGCQCFKSA-N	0	0	257.377	4.180	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)c1ccc2c(c1)COC2	ZINC000410392570	327190014	/nfs/dbraw/zinc/19/00/14/327190014.db2.gz	LHRMSNXVOUEBIK-UHFFFAOYSA-N	0	0	293.366	4.088	20	30		CIEDRN
C=C(C)CCSCc1ccn(C2CCCC2)n1	ZINC000507105235	332786885	/nfs/dbraw/zinc/78/68/85/332786885.db2.gz	ULALICIMISHCEL-UHFFFAOYSA-N	0	0	250.411	4.198	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)CC[C@@H]1CC[C@@H](C)O1	ZINC000410388718	327190879	/nfs/dbraw/zinc/19/08/79/327190879.db2.gz	ZKLXNFZFTPYXFN-ZBFHGGJFSA-N	0	0	287.403	4.091	20	30		CIEDRN
C=C1CCN(Cc2coc(-c3ccc(Cl)cc3)n2)CC1	ZINC000518678050	327193560	/nfs/dbraw/zinc/19/35/60/327193560.db2.gz	IGKFOXCFVBKKDV-UHFFFAOYSA-N	0	0	288.778	4.147	20	30		CIEDRN
C[C@@H](c1cccc(C#N)c1)N(C)Cc1c(F)cccc1F	ZINC000559364741	327195750	/nfs/dbraw/zinc/19/57/50/327195750.db2.gz	LNLOIURQMKELMG-LBPRGKRZSA-N	0	0	286.325	4.029	20	30		CIEDRN
C[C@H](c1cccc(C#N)c1)N(C)Cc1c(F)cccc1F	ZINC000559364732	327195758	/nfs/dbraw/zinc/19/57/58/327195758.db2.gz	LNLOIURQMKELMG-GFCCVEGCSA-N	0	0	286.325	4.029	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCCc1cccc2ccccc21	ZINC000569597682	327208468	/nfs/dbraw/zinc/20/84/68/327208468.db2.gz	HDSAZGTUGVECIP-UHFFFAOYSA-N	0	0	281.399	4.101	20	30		CIEDRN
C=C(C)CCSCc1nc(-c2ccc(F)cc2)no1	ZINC000507118966	332788222	/nfs/dbraw/zinc/78/82/22/332788222.db2.gz	VHAJJTXVERSLTG-UHFFFAOYSA-N	0	0	278.352	4.075	20	30		CIEDRN
CCOC1CC(CSCc2ccc(C#N)cc2Cl)C1	ZINC000507120570	332788625	/nfs/dbraw/zinc/78/86/25/332788625.db2.gz	KPLGEHFUSRIOHK-UHFFFAOYSA-N	0	0	295.835	4.260	20	30		CIEDRN
CC(C)C[C@](C)(C#N)NC(=O)CCCC1CCCCC1	ZINC000533876957	327229752	/nfs/dbraw/zinc/22/97/52/327229752.db2.gz	YCJQDWHTHBRXLN-QGZVFWFLSA-N	0	0	278.440	4.182	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1cccc(C)c1)c1ccccc1	ZINC000533882664	327235830	/nfs/dbraw/zinc/23/58/30/327235830.db2.gz	UUDPXTJLKJHKIK-OAHLLOKOSA-N	0	0	265.356	4.293	20	30		CIEDRN
C=C[C@@H](CC(=O)N(C)Cc1cccs1)c1ccccc1	ZINC000533884794	327238744	/nfs/dbraw/zinc/23/87/44/327238744.db2.gz	OVGFVJNNKQTNMO-AWEZNQCLSA-N	0	0	285.412	4.066	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)C[C@H]1CCCC[C@@H]1C	ZINC000531070097	327238886	/nfs/dbraw/zinc/23/88/86/327238886.db2.gz	HFEOPVQSZCRMLM-SWLSCSKDSA-N	0	0	270.376	4.022	20	30		CIEDRN
N#CCN[C@H](CCCCc1ccccc1)c1ccccc1	ZINC000538222826	327244877	/nfs/dbraw/zinc/24/48/77/327244877.db2.gz	BYOWUKCSKFIMBE-LJQANCHMSA-N	0	0	278.399	4.254	20	30		CIEDRN
Cc1coc(-c2cc(N[C@@H]3CC[C@@H](C#N)C3)ccc2C)n1	ZINC000555951448	327250277	/nfs/dbraw/zinc/25/02/77/327250277.db2.gz	TYVGFBOFAUZLIG-ZIAGYGMSSA-N	0	0	281.359	4.063	20	30		CIEDRN
C[C@](C#N)(NC(=O)C1CCC(C)(C)CC1)C1CCCCC1	ZINC000559596377	327255193	/nfs/dbraw/zinc/25/51/93/327255193.db2.gz	MTAKTZQNWYSGMX-GOSISDBHSA-N	0	0	290.451	4.182	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)CCc1cc(Cl)cc(Cl)c1	ZINC000152374483	327255729	/nfs/dbraw/zinc/25/57/29/327255729.db2.gz	RDUXHLUGMUGEFR-SNVBAGLBSA-N	0	0	286.202	4.007	20	30		CIEDRN
N#Cc1c(F)cccc1SCCCOc1ccccc1	ZINC000559629694	327256339	/nfs/dbraw/zinc/25/63/39/327256339.db2.gz	CYDJPPLTJOHSIK-UHFFFAOYSA-N	0	0	287.359	4.259	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc([C@H](OCC)c2ccccc2)no1	ZINC000573763940	327256368	/nfs/dbraw/zinc/25/63/68/327256368.db2.gz	UJWJRLBFJFJAPJ-UKRRQHHQSA-N	0	0	286.375	4.265	20	30		CIEDRN
N#Cc1nc(NCC2(c3ccccc3)CCC2)ccc1Cl	ZINC000110076798	327266488	/nfs/dbraw/zinc/26/64/88/327266488.db2.gz	LZNCDONTBWRFRZ-UHFFFAOYSA-N	0	0	297.789	4.140	20	30		CIEDRN
C=Cc1ccc(C(=O)Nc2sc3c(c2C#N)CCC3)cc1	ZINC000560001425	327276512	/nfs/dbraw/zinc/27/65/12/327276512.db2.gz	YWXGZSDPBOCBCF-UHFFFAOYSA-N	0	0	294.379	4.004	20	30		CIEDRN
C=CCC(C)(C)c1noc(C2(c3ccccc3F)CC2)n1	ZINC000560021849	327278018	/nfs/dbraw/zinc/27/80/18/327278018.db2.gz	JASJMPWXOYGVRP-UHFFFAOYSA-N	0	0	286.350	4.142	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H]2CC[C@H](C(F)(F)F)C2)n1	ZINC000560023999	327278151	/nfs/dbraw/zinc/27/81/51/327278151.db2.gz	RMCWRSMYPIYMAZ-UWVGGRQHSA-N	0	0	288.313	4.369	20	30		CIEDRN
CC[C@@H]1CCCC[C@@H]1c1noc(-c2cccc(C#N)c2)n1	ZINC000560048795	327280424	/nfs/dbraw/zinc/28/04/24/327280424.db2.gz	JPMRUMMDDRUBJL-HIFRSBDPSA-N	0	0	281.359	4.292	20	30		CIEDRN
CC[C@H]1CCCC[C@@H]1c1noc(-c2cccc(C#N)c2)n1	ZINC000560048797	327280595	/nfs/dbraw/zinc/28/05/95/327280595.db2.gz	JPMRUMMDDRUBJL-ZFWWWQNUSA-N	0	0	281.359	4.292	20	30		CIEDRN
N#Cc1cccc(C2(NCc3ccsc3Cl)CC2)c1	ZINC000560069233	327282155	/nfs/dbraw/zinc/28/21/55/327282155.db2.gz	BETJHZGHZAPCJQ-UHFFFAOYSA-N	0	0	288.803	4.052	20	30		CIEDRN
C=C[C@](C)(CC)c1nc(Cc2c(F)cccc2Cl)no1	ZINC000583346839	327312362	/nfs/dbraw/zinc/31/23/62/327312362.db2.gz	LDSUFBSUOUMUFV-OAHLLOKOSA-N	0	0	294.757	4.307	20	30		CIEDRN
CC[C@@](C)(C#N)C(=O)N(C)c1ccc(-c2ccccc2)cc1	ZINC000560531862	327320189	/nfs/dbraw/zinc/32/01/89/327320189.db2.gz	FPUCUUNFRJUZBD-IBGZPJMESA-N	0	0	292.382	4.256	20	30		CIEDRN
Cc1ccc(-c2nc(CN(C)CC(C)(C)C#N)cs2)cc1	ZINC000560569635	327325624	/nfs/dbraw/zinc/32/56/24/327325624.db2.gz	ODGYKPIHJGIFHT-UHFFFAOYSA-N	0	0	299.443	4.100	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cccc(-c3ncco3)c2C)CC1	ZINC000560990069	327356221	/nfs/dbraw/zinc/35/62/21/327356221.db2.gz	WGCGLLYWXIDOFN-UHFFFAOYSA-N	0	0	296.370	4.335	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N1CCC2(CCCC2)CC1	ZINC000561295605	327383242	/nfs/dbraw/zinc/38/32/42/327383242.db2.gz	HXCXCSQOKXQDJX-OAHLLOKOSA-N	0	0	278.440	4.097	20	30		CIEDRN
C=CCCS[C@@H](C)c1nc(-c2ccccc2)no1	ZINC000154975954	327388368	/nfs/dbraw/zinc/38/83/68/327388368.db2.gz	MEGQNCTZAMPZOR-NSHDSACASA-N	0	0	260.362	4.107	20	30		CIEDRN
C=CCCC(=O)N(c1ccc(F)cc1)C1CCCC1	ZINC000155386177	327392466	/nfs/dbraw/zinc/39/24/66/327392466.db2.gz	BWHTYKOBXOPBRD-UHFFFAOYSA-N	0	0	261.340	4.068	20	30		CIEDRN
C/C=C\c1ccc(NC(=O)c2ccc(CC#N)cc2)cc1	ZINC000561652389	327407624	/nfs/dbraw/zinc/40/76/24/327407624.db2.gz	QXYBSQWTTNKNNR-IHWYPQMZSA-N	0	0	276.339	4.038	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)c1ccccc1Nc1ccc(C)cc1	ZINC000561752197	327417428	/nfs/dbraw/zinc/41/74/28/327417428.db2.gz	WCVMNYWROKGXGY-OAHLLOKOSA-N	0	0	294.398	4.433	20	30		CIEDRN
C=C[C@H](CC(=O)N1CCC[C@@H]2CCC[C@H]21)c1ccccc1	ZINC000245690471	327423025	/nfs/dbraw/zinc/42/30/25/327423025.db2.gz	XBYNEOPNOUBHEX-BPQIPLTHSA-N	0	0	283.415	4.137	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](C(C)(C)C)C[C@@H]1C	ZINC000561867854	327427502	/nfs/dbraw/zinc/42/75/02/327427502.db2.gz	OLBBYVQLGCCARP-JJRVBVJISA-N	0	0	265.441	4.262	20	30		CIEDRN
C[C@@H]1C[C@H](C(C)(C)C)CCN1C(=O)C1(C#N)CCCCC1	ZINC000561874701	327427854	/nfs/dbraw/zinc/42/78/54/327427854.db2.gz	WKXWOAOZJOYSGG-HUUCEWRRSA-N	0	0	290.451	4.134	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(-c2ccnc(OC3CCC3)c2)no1	ZINC000561891983	327428838	/nfs/dbraw/zinc/42/88/38/327428838.db2.gz	QUTGJSWOMHYDOS-GFCCVEGCSA-N	0	0	299.374	4.133	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@H](c2ccccc2)C1	ZINC000562117363	327451065	/nfs/dbraw/zinc/45/10/65/327451065.db2.gz	ALRXMLVVQSRUFM-SFHVURJKSA-N	0	0	283.415	4.161	20	30		CIEDRN
C=CCCCCCS[C@@H](C)C(=O)NC(C)(C)CC	ZINC000485593569	331918299	/nfs/dbraw/zinc/91/82/99/331918299.db2.gz	SZMMHFNJUPFAPP-ZDUSSCGKSA-N	0	0	271.470	4.159	20	30		CIEDRN
CCSCc1cccc(NCc2ccc(C#N)s2)c1	ZINC000151559600	327477748	/nfs/dbraw/zinc/47/77/48/327477748.db2.gz	YMJQLZNVSITQCK-UHFFFAOYSA-N	0	0	288.441	4.485	20	30		CIEDRN
CCCCc1oc2ccccc2c1CNCC(C)(C)C#N	ZINC000168932442	327493400	/nfs/dbraw/zinc/49/34/00/327493400.db2.gz	OQZVQWHPKWMPHF-UHFFFAOYSA-N	0	0	284.403	4.415	20	30		CIEDRN
C=C[C@](C)(CC)c1nc([C@H](C)c2ccccc2C)no1	ZINC000584317150	327540996	/nfs/dbraw/zinc/54/09/96/327540996.db2.gz	AMHMJCPZPJKVCS-CXAGYDPISA-N	0	0	270.376	4.384	20	30		CIEDRN
CSC[C@H]1CCCN(c2cccc(C(F)F)c2C#N)C1	ZINC000569825727	327550478	/nfs/dbraw/zinc/55/04/78/327550478.db2.gz	VCOXGGKIZVTCCJ-NSHDSACASA-N	0	0	296.386	4.075	20	30		CIEDRN
CC#CCCCc1nc(-c2ccccc2C(F)(F)F)no1	ZINC000569852762	327552077	/nfs/dbraw/zinc/55/20/77/327552077.db2.gz	PTXXERXEUQGXOW-UHFFFAOYSA-N	0	0	294.276	4.101	20	30		CIEDRN
CC(C(=O)N[C@@H](CCC#N)c1ccccc1)=C1CCCC1	ZINC000153654397	327575896	/nfs/dbraw/zinc/57/58/96/327575896.db2.gz	JNZWLWPDIAZWFZ-KRWDZBQOSA-N	0	0	282.387	4.038	20	30		CIEDRN
C/C=C\c1ccc(NCc2ccc(C#N)s2)cc1	ZINC000570311983	327582285	/nfs/dbraw/zinc/58/22/85/327582285.db2.gz	XROLGMYAVTUCFD-IHWYPQMZSA-N	0	0	254.358	4.265	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1sc(C)c(CC)c1C#N	ZINC000160394771	327607494	/nfs/dbraw/zinc/60/74/94/327607494.db2.gz	UJYNVYVKGXBLFE-UHFFFAOYSA-N	0	0	288.416	4.198	20	30		CIEDRN
Cc1ccccc1NC(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000113528641	328621794	/nfs/dbraw/zinc/62/17/94/328621794.db2.gz	FEALQXJTARSZMT-UHFFFAOYSA-N	0	0	285.734	4.164	20	30		CIEDRN
Cc1nc(Oc2ccc(F)cc2Cl)c(Cl)cc1C#N	ZINC000389164474	328634462	/nfs/dbraw/zinc/63/44/62/328634462.db2.gz	ZFZNGVVEWIVYLI-UHFFFAOYSA-N	0	0	297.116	4.500	20	30		CIEDRN
CCC[C@H](C#N)NC(=O)C1(c2ccccc2C)CCCCC1	ZINC000535852023	328644435	/nfs/dbraw/zinc/64/44/35/328644435.db2.gz	BNDUGOGAKQXLHE-MRXNPFEDSA-N	0	0	298.430	4.005	20	30		CIEDRN
CC1(C)C[C@@H]1C(=O)Nc1sc(-c2ccccc2)cc1C#N	ZINC000507561092	332814046	/nfs/dbraw/zinc/81/40/46/332814046.db2.gz	DVMBDPKDXHKYJS-CYBMUJFWSA-N	0	0	296.395	4.271	20	30		CIEDRN
N#Cc1ccccc1/C=C/c1ccc2ccccc2n1	ZINC000535905831	328647152	/nfs/dbraw/zinc/64/71/52/328647152.db2.gz	LNGGIEQXLQLBCU-PKNBQFBNSA-N	0	0	256.308	4.277	20	30		CIEDRN
C=C[C@@H](CC(=O)N(CC)C[C@@H](C)CC)c1ccccc1	ZINC000536171273	328660486	/nfs/dbraw/zinc/66/04/86/328660486.db2.gz	ZNTXUGNDGJMCCF-HOTGVXAUSA-N	0	0	273.420	4.241	20	30		CIEDRN
N#CCc1ccc(-c2nc(-c3ccc(Cl)cc3)no2)cc1	ZINC000536181749	328660955	/nfs/dbraw/zinc/66/09/55/328660955.db2.gz	UJOSUZUKOSZYJO-UHFFFAOYSA-N	0	0	295.729	4.123	20	30		CIEDRN
C=C1CCN(Cc2ccc(Oc3ccccc3)o2)CC1	ZINC000507770092	332822617	/nfs/dbraw/zinc/82/26/17/332822617.db2.gz	CKBOFADQANFXFL-UHFFFAOYSA-N	0	0	269.344	4.224	20	30		CIEDRN
CC[C@@H](CC(=O)Nc1sccc1C#N)c1ccccc1	ZINC000103358331	328767809	/nfs/dbraw/zinc/76/78/09/328767809.db2.gz	HERVKIVFQWZCSC-LBPRGKRZSA-N	0	0	284.384	4.142	20	30		CIEDRN
C=CCN(CC(F)(F)F)C(=O)C[C@H](CC)c1ccccc1	ZINC000103384739	328769857	/nfs/dbraw/zinc/76/98/57/328769857.db2.gz	VNKQEYLUPYKEDT-ZDUSSCGKSA-N	0	0	299.336	4.147	20	30		CIEDRN
CCOc1cc(Cl)ccc1NCc1ccc(C#N)cc1	ZINC000532345843	328773284	/nfs/dbraw/zinc/77/32/84/328773284.db2.gz	TUSOXYLDBCHLFR-UHFFFAOYSA-N	0	0	286.762	4.222	20	30		CIEDRN
CC[C@@](C)(C#N)NC(=O)CC1CCC(C(C)(C)C)CC1	ZINC000532469818	328781152	/nfs/dbraw/zinc/78/11/52/328781152.db2.gz	WSRKIJQZCWGLIJ-KVULBXGLSA-N	0	0	278.440	4.037	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)C[C@@H]1CCCC[C@H]1C	ZINC000527061169	328823228	/nfs/dbraw/zinc/82/32/28/328823228.db2.gz	ZHVZZGKDBVQDIO-CABCVRRESA-N	0	0	278.440	4.134	20	30		CIEDRN
N#Cc1nc(N2CCC3(CCCCC3)CC2)ccc1Cl	ZINC000301154668	328827081	/nfs/dbraw/zinc/82/70/81/328827081.db2.gz	APGQBVHCBKVIAL-UHFFFAOYSA-N	0	0	289.810	4.157	20	30		CIEDRN
N#Cc1c(Cl)nsc1NCc1ccc2ccccc2c1	ZINC000301167725	328827283	/nfs/dbraw/zinc/82/72/83/328827283.db2.gz	WBNBUSPWRDWTGD-UHFFFAOYSA-N	0	0	299.786	4.433	20	30		CIEDRN
C=C(C)CCSCCC(=O)Nc1cccc(Cl)c1	ZINC000507803217	332824708	/nfs/dbraw/zinc/82/47/08/332824708.db2.gz	GWVIGXHUOMRDJV-UHFFFAOYSA-N	0	0	283.824	4.368	20	30		CIEDRN
C=C(C)CCSCC(=O)N(Cc1ccccc1)C(C)C	ZINC000507864632	332828294	/nfs/dbraw/zinc/82/82/94/332828294.db2.gz	YEGLXHWKDWYZTK-UHFFFAOYSA-N	0	0	291.460	4.123	20	30		CIEDRN
Cc1ccccc1C1CC(Nc2c(C#N)cccc2C#N)C1	ZINC000358683956	328892014	/nfs/dbraw/zinc/89/20/14/328892014.db2.gz	PZCTZNQDKXHPCB-UHFFFAOYSA-N	0	0	287.366	4.096	20	30		CIEDRN
N#CCc1ccc(NC(=O)[C@@H]2CC[C@H]3CCCC[C@@H]3C2)cc1	ZINC000389669898	328949003	/nfs/dbraw/zinc/94/90/03/328949003.db2.gz	WIDYYTHBEOXZDK-BRWVUGGUSA-N	0	0	296.414	4.298	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CC(C)(C)[C@@H]1C1CC1	ZINC000582293907	328951559	/nfs/dbraw/zinc/95/15/59/328951559.db2.gz	BGAVZLCLFXNRDZ-KRWDZBQOSA-N	0	0	298.430	4.458	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H]2CCc3cc(C)ccc3O2)n1	ZINC000582374780	328975105	/nfs/dbraw/zinc/97/51/05/328975105.db2.gz	FJZAMTRIJFVBAS-OAHLLOKOSA-N	0	0	298.386	4.298	20	30		CIEDRN
CCCCCCCCC(=O)N1CCC2(CCOCC2)[C@@H]1C	ZINC000374974052	328998566	/nfs/dbraw/zinc/99/85/66/328998566.db2.gz	VZQDJNJFUXGDFW-INIZCTEOSA-N	0	0	295.467	4.155	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCCC[C@@H]1c1ncc(C)s1	ZINC000375102554	329000493	/nfs/dbraw/zinc/00/04/93/329000493.db2.gz	AGIPVUSYLSPWHF-GXTWGEPZSA-N	0	0	292.448	4.107	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H](C)[C@@H](C)c2ccccc2)CCC1	ZINC000188708009	329006134	/nfs/dbraw/zinc/00/61/34/329006134.db2.gz	YHUBDVPYPOFCOZ-CABCVRRESA-N	0	0	271.404	4.041	20	30		CIEDRN
CCOc1cccc(N[C@H](C)c2ccc(OCC#N)cc2)c1	ZINC000193913611	329063838	/nfs/dbraw/zinc/06/38/38/329063838.db2.gz	VAAJJVQBYHSOLM-CQSZACIVSA-N	0	0	296.370	4.161	20	30		CIEDRN
Cc1ccoc1CN(C)c1cccc(C(F)F)c1C#N	ZINC000584361093	329102486	/nfs/dbraw/zinc/10/24/86/329102486.db2.gz	BXCSRNPWNLIQSG-UHFFFAOYSA-N	0	0	276.286	4.034	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H](C)CC1CCCCC1	ZINC000508584879	332842170	/nfs/dbraw/zinc/84/21/70/332842170.db2.gz	AURAWSSLXYANSV-CYBMUJFWSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N1CC[C@H]1c1ccc(Cl)cc1	ZINC000582684076	329128191	/nfs/dbraw/zinc/12/81/91/329128191.db2.gz	SOEWNHPLUKBXEC-CABCVRRESA-N	0	0	292.810	4.151	20	30		CIEDRN
C=C(C)CCc1noc([C@H]2C[C@@H]2c2c(F)cccc2F)n1	ZINC000508595672	332842655	/nfs/dbraw/zinc/84/26/55/332842655.db2.gz	OOAXENZBIUFRJB-QWRGUYRKSA-N	0	0	290.313	4.128	20	30		CIEDRN
C=CCCCSCCC(=O)Nc1ccccc1C	ZINC000173828758	329152363	/nfs/dbraw/zinc/15/23/63/329152363.db2.gz	BXQABMSJXUKWCC-UHFFFAOYSA-N	0	0	263.406	4.023	20	30		CIEDRN
C#Cc1cccc(NCc2ncc(-c3ccccc3F)o2)c1	ZINC000174297475	329156531	/nfs/dbraw/zinc/15/65/31/329156531.db2.gz	PMRVXUUYUPIRTP-UHFFFAOYSA-N	0	0	292.313	4.074	20	30		CIEDRN
C=C(C)CCc1noc(CC(C)(C)c2ccccc2)n1	ZINC000508614636	332844302	/nfs/dbraw/zinc/84/43/02/332844302.db2.gz	KTFFYGZQAMRYIF-UHFFFAOYSA-N	0	0	270.376	4.099	20	30		CIEDRN
C=CCCCC(=O)N1CCC[C@@H]1c1ccccc1C	ZINC000175373749	329164638	/nfs/dbraw/zinc/16/46/38/329164638.db2.gz	KLXBYNWJNKLULI-MRXNPFEDSA-N	0	0	257.377	4.015	20	30		CIEDRN
C[C@H](Oc1ccccc1C#N)c1nc(CCC(C)(C)C)no1	ZINC000508615693	332844372	/nfs/dbraw/zinc/84/43/72/332844372.db2.gz	PTWFBDHVLRBGEF-LBPRGKRZSA-N	0	0	299.374	4.060	20	30		CIEDRN
C=CCCCC(=O)N[C@H](CC)c1ccccc1OC(F)F	ZINC000175276478	329167223	/nfs/dbraw/zinc/16/72/23/329167223.db2.gz	JFQDJWMEEIIGGG-CYBMUJFWSA-N	0	0	297.345	4.212	20	30		CIEDRN
C=CCCCC(=O)N1CC[C@H](C)C[C@@H]1c1ccc(C)o1	ZINC000176106769	329173847	/nfs/dbraw/zinc/17/38/47/329173847.db2.gz	NMURBRTUNQDMBV-DZGCQCFKSA-N	0	0	275.392	4.244	20	30		CIEDRN
C=C(C)CCc1noc(C2(c3ccccc3)CCC2)n1	ZINC000508660970	332846352	/nfs/dbraw/zinc/84/63/52/332846352.db2.gz	IOTIAQJXILJZJL-UHFFFAOYSA-N	0	0	268.360	4.048	20	30		CIEDRN
C=C(C)CSCc1nnc(-c2ccccc2Cl)o1	ZINC000177868581	329186907	/nfs/dbraw/zinc/18/69/07/329186907.db2.gz	VSVWQTCDMLYAME-UHFFFAOYSA-N	0	0	280.780	4.199	20	30		CIEDRN
C=C(C)CCc1noc(/C=C/c2ccc(C)cc2)n1	ZINC000508662494	332846386	/nfs/dbraw/zinc/84/63/86/332846386.db2.gz	CLKDNHCLLAOGFW-PKNBQFBNSA-N	0	0	254.333	4.057	20	30		CIEDRN
C=C(C)COc1cccc(NCc2cnn(C(C)C)c2)c1	ZINC000178221786	329194511	/nfs/dbraw/zinc/19/45/11/329194511.db2.gz	KOQQTIACZBDOEJ-UHFFFAOYSA-N	0	0	285.391	4.031	20	30		CIEDRN
Cc1c(C#N)cccc1NC(=O)N1CCC[C@H]1C1CCCC1	ZINC000178565174	329198545	/nfs/dbraw/zinc/19/85/45/329198545.db2.gz	DVRXLJHUSJGKEW-KRWDZBQOSA-N	0	0	297.402	4.053	20	30		CIEDRN
CC(C)(C)CCc1noc(/C=C\c2ccccc2C#N)n1	ZINC000508650100	332846124	/nfs/dbraw/zinc/84/61/24/332846124.db2.gz	IWUGFJCVXWTPCY-HJWRWDBZSA-N	0	0	281.359	4.090	20	30		CIEDRN
Cc1c(C#N)cccc1NCc1cccc2cccnc21	ZINC000179054127	329203859	/nfs/dbraw/zinc/20/38/59/329203859.db2.gz	ONQGIFZLTVZBOO-UHFFFAOYSA-N	0	0	273.339	4.027	20	30		CIEDRN
C#CCCCCC(=O)N(C)Cc1csc2ccccc12	ZINC000179757113	329207687	/nfs/dbraw/zinc/20/76/87/329207687.db2.gz	COQZXHKSHXRSJW-UHFFFAOYSA-N	0	0	285.412	4.053	20	30		CIEDRN
C=C(C)CCc1noc(-c2oc3ccccc3c2COC)n1	ZINC000508664643	332846635	/nfs/dbraw/zinc/84/66/35/332846635.db2.gz	UCUARYJMLSKSPL-UHFFFAOYSA-N	0	0	298.342	4.138	20	30		CIEDRN
C#CCCCCC(=O)Nc1ccc(SC(F)F)cc1	ZINC000179604519	329210022	/nfs/dbraw/zinc/21/00/22/329210022.db2.gz	WTGMJAQGSCFVFQ-UHFFFAOYSA-N	0	0	283.343	4.133	20	30		CIEDRN
C#CCCCCC(=O)N(CC=C)Cc1ccc(Cl)s1	ZINC000179645820	329210576	/nfs/dbraw/zinc/21/05/76/329210576.db2.gz	ABBNNWQEJJAIEV-UHFFFAOYSA-N	0	0	295.835	4.110	20	30		CIEDRN
Cc1cc(C(=O)NCCCCC#N)sc1-c1ccccc1	ZINC000521455951	329213394	/nfs/dbraw/zinc/21/33/94/329213394.db2.gz	XEFYPMSCIXXBLK-UHFFFAOYSA-N	0	0	298.411	4.147	20	30		CIEDRN
C=C[C@H](Cc1nc(CCC(=C)C)no1)c1ccccc1	ZINC000508679201	332847080	/nfs/dbraw/zinc/84/70/80/332847080.db2.gz	MJCVBHBDPWAXGA-CQSZACIVSA-N	0	0	268.360	4.091	20	30		CIEDRN
CC(=O)c1ccc(NCc2ccc(C#N)cc2)cc1Cl	ZINC000181039451	329225240	/nfs/dbraw/zinc/22/52/40/329225240.db2.gz	RUQKYMCSQVTHQV-UHFFFAOYSA-N	0	0	284.746	4.026	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccc(-c2csc(C)n2)cc1	ZINC000185062306	329267595	/nfs/dbraw/zinc/26/75/95/329267595.db2.gz	WLLGMURCLQIDAK-UHFFFAOYSA-N	0	0	298.411	4.251	20	30		CIEDRN
C=CCCC(=O)NCc1ccc(-c2ccccc2)cc1F	ZINC000583042277	329303125	/nfs/dbraw/zinc/30/31/25/329303125.db2.gz	LANDUNNGLNMFOJ-UHFFFAOYSA-N	0	0	283.346	4.075	20	30		CIEDRN
CC[C@H](Nc1ccc2c(c1)ncn2C)c1ccc(C#N)cc1	ZINC000584390572	329325267	/nfs/dbraw/zinc/32/52/67/329325267.db2.gz	RTIUOMHYXUVPAH-INIZCTEOSA-N	0	0	290.370	4.008	20	30		CIEDRN
CC#CCCCC(=O)Nc1cnccc1-c1cccc(F)c1	ZINC000185810144	329329537	/nfs/dbraw/zinc/32/95/37/329329537.db2.gz	APOFMUURURJWOR-UHFFFAOYSA-N	0	0	296.345	4.020	20	30		CIEDRN
N#CCC1CCN(Cc2ccc(Cl)cc2Cl)CC1	ZINC000397217470	329344494	/nfs/dbraw/zinc/34/44/94/329344494.db2.gz	HOULWJWEEADDLI-UHFFFAOYSA-N	0	0	283.202	4.119	20	30		CIEDRN
Cc1nc2ccc(CN3CCCC(C)(C)[C@@H]3C#N)cc2s1	ZINC000583183334	329348234	/nfs/dbraw/zinc/34/82/34/329348234.db2.gz	CQONVYPNDRBXFC-INIZCTEOSA-N	0	0	299.443	4.119	20	30		CIEDRN
CCCCCCCCC(=O)N1CCC([C@H]2CCCO2)CC1	ZINC000187498626	329358276	/nfs/dbraw/zinc/35/82/76/329358276.db2.gz	GREWVSUALMVTII-QGZVFWFLSA-N	0	0	295.467	4.155	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1cccnc1	ZINC000189885782	329388128	/nfs/dbraw/zinc/38/81/28/329388128.db2.gz	QDUPLZVFWSBDLN-UHFFFAOYSA-N	0	0	280.371	4.186	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)CSC	ZINC000189894541	329388569	/nfs/dbraw/zinc/38/85/69/329388569.db2.gz	CPWQTMYLDTYLFE-ZDUSSCGKSA-N	0	0	291.460	4.476	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1c(C)noc1C	ZINC000189887423	329388909	/nfs/dbraw/zinc/38/89/09/329388909.db2.gz	XYUDDFIKFNCXAO-UHFFFAOYSA-N	0	0	298.386	4.396	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1cscn1	ZINC000189900710	329388930	/nfs/dbraw/zinc/38/89/30/329388930.db2.gz	PNWWHTUQDLOVBU-UHFFFAOYSA-N	0	0	286.400	4.247	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H]1CCCO1	ZINC000189870023	329388957	/nfs/dbraw/zinc/38/89/57/329388957.db2.gz	SZWGYRLDYLXYRO-HNNXBMFYSA-N	0	0	287.403	4.046	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)CC(F)(F)F	ZINC000189899146	329388986	/nfs/dbraw/zinc/38/89/86/329388986.db2.gz	XOWYSPHPEVHNKF-UHFFFAOYSA-N	0	0	285.309	4.429	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)on1	ZINC000189880235	329389206	/nfs/dbraw/zinc/38/92/06/329389206.db2.gz	VFVINJPJOJFPAK-UHFFFAOYSA-N	0	0	284.359	4.087	20	30		CIEDRN
C=CCC1(C(=O)Nc2cc(CSCC)ccn2)CCC1	ZINC000189864809	329389684	/nfs/dbraw/zinc/38/96/84/329389684.db2.gz	IOKKGBVAUAPROH-UHFFFAOYSA-N	0	0	290.432	4.020	20	30		CIEDRN
CC(C)N(CCC#N)Cc1cc(Cl)sc1Cl	ZINC000583243859	329392251	/nfs/dbraw/zinc/39/22/51/329392251.db2.gz	BQGCKHHDZHFZBT-UHFFFAOYSA-N	0	0	277.220	4.179	20	30		CIEDRN
C=CCC1(C(=O)NCc2c(C)oc3ccccc32)CCC1	ZINC000190319923	329394739	/nfs/dbraw/zinc/39/47/39/329394739.db2.gz	DDFXEBLIDBFZHZ-UHFFFAOYSA-N	0	0	283.371	4.104	20	30		CIEDRN
CO[C@H](C)c1cccc(NCc2ccc(C#N)c(F)c2)c1	ZINC000190367263	329395435	/nfs/dbraw/zinc/39/54/35/329395435.db2.gz	MUBOTJXVPNIORH-GFCCVEGCSA-N	0	0	284.334	4.017	20	30		CIEDRN
N#CCCSc1ccccc1NCC#Cc1ccccc1	ZINC000190372559	329395562	/nfs/dbraw/zinc/39/55/62/329395562.db2.gz	OWBQSHLRVHUFCN-UHFFFAOYSA-N	0	0	292.407	4.156	20	30		CIEDRN
C=CCC1(C(=O)N(C)Cc2cccc(Cl)c2)CCC1	ZINC000190576328	329399454	/nfs/dbraw/zinc/39/94/54/329399454.db2.gz	YPTUOUCADSEBNZ-UHFFFAOYSA-N	0	0	277.795	4.045	20	30		CIEDRN
CC(C)c1cnc(CNc2ccc(Cl)c(C#N)c2)s1	ZINC000191157106	329404962	/nfs/dbraw/zinc/40/49/62/329404962.db2.gz	SZFROXUJSDADBO-UHFFFAOYSA-N	0	0	291.807	4.404	20	30		CIEDRN
N#CCc1ccc(CSc2ccc(F)cc2)cc1	ZINC000399122453	329448502	/nfs/dbraw/zinc/44/85/02/329448502.db2.gz	IKJFKCGNPGIOQA-UHFFFAOYSA-N	0	0	257.333	4.184	20	30		CIEDRN
N#Cc1ccnc(NC2CCC(c3ccc(F)cc3)CC2)c1	ZINC000584413907	329462318	/nfs/dbraw/zinc/46/23/18/329462318.db2.gz	CRTPTTAZKFURRF-UHFFFAOYSA-N	0	0	295.361	4.231	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2cccc3cnccc32)no1	ZINC000584555232	329521311	/nfs/dbraw/zinc/52/13/11/329521311.db2.gz	VMHLBWIGURPFFY-LBPRGKRZSA-N	0	0	279.343	4.355	20	30		CIEDRN
Cc1cccc(C)c1C(=O)N(C)[C@@H](C)c1cccc(C#N)c1	ZINC000425633715	329575217	/nfs/dbraw/zinc/57/52/17/329575217.db2.gz	FZPRQERPGYEIBN-HNNXBMFYSA-N	0	0	292.382	4.008	20	30		CIEDRN
C#Cc1cccc(NC(=O)N2CCC[C@@H]2c2cccs2)c1	ZINC000043985561	329588301	/nfs/dbraw/zinc/58/83/01/329588301.db2.gz	LWXAXHBZCKSKDW-OAHLLOKOSA-N	0	0	296.395	4.098	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@@H](CC(C)(C)C)C(F)(F)F	ZINC000424787981	329588490	/nfs/dbraw/zinc/58/84/90/329588490.db2.gz	NMIHEESEGXMLJX-JTQLQIEISA-N	0	0	279.346	4.072	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc(Cl)cc1COC	ZINC000425639486	329591042	/nfs/dbraw/zinc/59/10/42/329591042.db2.gz	ZAAPHKVUVJHTFH-UHFFFAOYSA-N	0	0	281.783	4.027	20	30		CIEDRN
CCC(CC)[C@@H](C)C(=O)N(C)[C@H](C)c1cccc(C#N)c1	ZINC000425135784	329605076	/nfs/dbraw/zinc/60/50/76/329605076.db2.gz	VXXLNRLUJMTZFJ-ZIAGYGMSSA-N	0	0	286.419	4.150	20	30		CIEDRN
Cc1scc(C(=O)N(C)[C@H](C)c2cccc(C#N)c2)c1C	ZINC000425140010	329607375	/nfs/dbraw/zinc/60/73/75/329607375.db2.gz	ZUPFBCPEUDRTBA-GFCCVEGCSA-N	0	0	298.411	4.070	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)[C@@H]2CCC[C@@H](F)C2)CCCC1(C)C	ZINC000424804558	329612506	/nfs/dbraw/zinc/61/25/06/329612506.db2.gz	FMXCVSVGPUMFCN-KFWWJZLASA-N	0	0	281.415	4.108	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)[C@H]1CCC[C@@H](F)C1	ZINC000424805546	329616266	/nfs/dbraw/zinc/61/62/66/329616266.db2.gz	BGTJXRCBDNHQQR-DLBZAZTESA-N	0	0	289.394	4.120	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N(C)Cc1ccc(F)c(Cl)c1	ZINC000424808666	329616797	/nfs/dbraw/zinc/61/67/97/329616797.db2.gz	LCLLLFNWQJRJRN-UHFFFAOYSA-N	0	0	283.774	4.040	20	30		CIEDRN
C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H]1CC1(C)C	ZINC000129339276	329616803	/nfs/dbraw/zinc/61/68/03/329616803.db2.gz	NRCDSXQZRNUPNL-NEPJUHHUSA-N	0	0	288.416	4.065	20	30		CIEDRN
Cc1cc(CNc2cc(C#N)ccc2C)c(C)s1	ZINC000050430079	329647753	/nfs/dbraw/zinc/64/77/53/329647753.db2.gz	AQQJSPDSZLVWJN-UHFFFAOYSA-N	0	0	256.374	4.157	20	30		CIEDRN
CC(=O)c1ccc(OCCC2(C#N)CCCCC2)c(F)c1	ZINC000418869832	329659800	/nfs/dbraw/zinc/65/98/00/329659800.db2.gz	OVIBENPMYNKFJM-UHFFFAOYSA-N	0	0	289.350	4.271	20	30		CIEDRN
N#CCN(C(=O)[C@@H]1CCC[C@H]2CCCC[C@@H]21)c1ccccc1	ZINC000514686552	329684303	/nfs/dbraw/zinc/68/43/03/329684303.db2.gz	AKGNQDJCCBKUAH-BPQIPLTHSA-N	0	0	296.414	4.150	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@@H](c1ccccc1)C(CC)CC	ZINC000498156007	329684621	/nfs/dbraw/zinc/68/46/21/329684621.db2.gz	LJADVHWYPPFMNE-QGZVFWFLSA-N	0	0	288.435	4.381	20	30		CIEDRN
CC(C)(CNc1cccc(F)c1C#N)c1ccccc1	ZINC000025503430	329686344	/nfs/dbraw/zinc/68/63/44/329686344.db2.gz	JDWDEWMJOXWQDH-UHFFFAOYSA-N	0	0	268.335	4.087	20	30		CIEDRN
C=C(C)CN(C)C(=O)N[C@H](CC(C)(C)C)c1ccccc1	ZINC000498162442	329690826	/nfs/dbraw/zinc/69/08/26/329690826.db2.gz	LLNAOUYIIUMTRI-MRXNPFEDSA-N	0	0	288.435	4.381	20	30		CIEDRN
C=CCOCCCn1c(C)c(C(C)C)c(=O)c2ccccc21	ZINC000418984477	329701241	/nfs/dbraw/zinc/70/12/41/329701241.db2.gz	LMCTWTPIBGXVKT-UHFFFAOYSA-N	0	0	299.414	4.026	20	30		CIEDRN
CCc1cccc(OCCSCC2(C#N)CCC2)c1	ZINC000419349828	329719351	/nfs/dbraw/zinc/71/93/51/329719351.db2.gz	VKDPHAZTKUGJDB-UHFFFAOYSA-N	0	0	275.417	4.055	20	30		CIEDRN
Cc1nc2ccccc2cc1OCCCC(C)(C)C#N	ZINC000514695264	329724107	/nfs/dbraw/zinc/72/41/07/329724107.db2.gz	TUSYXOWITMAJBY-UHFFFAOYSA-N	0	0	268.360	4.252	20	30		CIEDRN
N#CC1(CS[C@@H]2CCc3ccc(F)cc32)CCC1	ZINC000419417395	329725314	/nfs/dbraw/zinc/72/53/14/329725314.db2.gz	JZFRLKMSKXOQRA-CQSZACIVSA-N	0	0	261.365	4.240	20	30		CIEDRN
Cc1cccc(C)c1CSCc1nc(C#N)cs1	ZINC000419419263	329726277	/nfs/dbraw/zinc/72/62/77/329726277.db2.gz	IUXYNLRCYCCEFD-UHFFFAOYSA-N	0	0	274.414	4.065	20	30		CIEDRN
N#Cc1csc(CS[C@H]2CCc3ccc(F)cc32)n1	ZINC000419425147	329727830	/nfs/dbraw/zinc/72/78/30/329727830.db2.gz	VFLJNDNEUPHPFJ-ZDUSSCGKSA-N	0	0	290.388	4.075	20	30		CIEDRN
C[C@@H](SCCOCC1CCC1)c1ccc(C#N)cc1	ZINC000419428983	329728167	/nfs/dbraw/zinc/72/81/67/329728167.db2.gz	UFBSPDCJPGOPPO-CYBMUJFWSA-N	0	0	275.417	4.169	20	30		CIEDRN
COc1cccc(CCCSCC2(C#N)CCC2)c1	ZINC000419444178	329729708	/nfs/dbraw/zinc/72/97/08/329729708.db2.gz	STZQDUQITMTRKM-UHFFFAOYSA-N	0	0	275.417	4.055	20	30		CIEDRN
N#CC1(CSCc2cc(Cl)ccc2F)CCC1	ZINC000419462541	329731892	/nfs/dbraw/zinc/73/18/92/329731892.db2.gz	JQMFXNDJHZOUEA-UHFFFAOYSA-N	0	0	269.772	4.406	20	30		CIEDRN
N#CC1(CSCC2CCC(F)(F)CC2)CCC1	ZINC000419592727	329741894	/nfs/dbraw/zinc/74/18/94/329741894.db2.gz	YUBCHTJHJDHMPS-UHFFFAOYSA-N	0	0	259.365	4.239	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H]2C[C@@]2(F)c2ccccc2)n1	ZINC000420499560	329770154	/nfs/dbraw/zinc/77/01/54/329770154.db2.gz	CZGUKDSTNHHXTL-CXAGYDPISA-N	0	0	286.350	4.276	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H]2C[C@H]2c2ccccc2OC)n1	ZINC000420507184	329772120	/nfs/dbraw/zinc/77/21/20/329772120.db2.gz	XSVWUAWQFFIDBJ-UONOGXRCSA-N	0	0	298.386	4.203	20	30		CIEDRN
C=CCC1(c2nc(Cc3cccnc3C)no2)CCCCC1	ZINC000420510008	329772590	/nfs/dbraw/zinc/77/25/90/329772590.db2.gz	HBXHGELQFOIVEN-UHFFFAOYSA-N	0	0	297.402	4.142	20	30		CIEDRN
C[C@H](Sc1cccc([N+](=O)[O-])c1)c1ccc(C#N)cc1	ZINC000509651806	332876733	/nfs/dbraw/zinc/87/67/33/332876733.db2.gz	UXBIGSRZNMFOAC-NSHDSACASA-N	0	0	284.340	4.320	20	30		CIEDRN
Cn1cc(Cl)c(CSCCCCC(C)(C)C#N)n1	ZINC000421214040	329806405	/nfs/dbraw/zinc/80/64/05/329806405.db2.gz	BKXXFTKOESIHIV-UHFFFAOYSA-N	0	0	285.844	4.027	20	30		CIEDRN
C=C(C)Cn1c2cc(Cl)ccc2c(=O)c2c1CCCC2	ZINC000421189572	329807078	/nfs/dbraw/zinc/80/70/78/329807078.db2.gz	NXQFWNSGFUDPJK-UHFFFAOYSA-N	0	0	287.790	4.110	20	30		CIEDRN
Cn1cc(Cl)c(CSCCC2(C#N)CCCCC2)n1	ZINC000421224783	329809533	/nfs/dbraw/zinc/80/95/33/329809533.db2.gz	LWJDQMUYBRCTLQ-UHFFFAOYSA-N	0	0	297.855	4.171	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)[C@]12C[C@H]1CCC2	ZINC000421433129	329827890	/nfs/dbraw/zinc/82/78/90/329827890.db2.gz	VAVFPJMFVGPZLM-IAQYHMDHSA-N	0	0	295.835	4.106	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)C(C2CC2)C2CC2)c1	ZINC000509834045	332883436	/nfs/dbraw/zinc/88/34/36/332883436.db2.gz	IMRDKQGYPSRMKO-UHFFFAOYSA-N	0	0	285.387	4.016	20	30		CIEDRN
CCC(C)(C)C(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1	ZINC000161223663	329915697	/nfs/dbraw/zinc/91/56/97/329915697.db2.gz	LYKYMSYGKFIQGH-GFCCVEGCSA-N	0	0	299.201	4.110	20	30		CIEDRN
N#Cc1c(N[C@@H]2CCCC[C@H]2F)cccc1C(F)F	ZINC000571777120	329920352	/nfs/dbraw/zinc/92/03/52/329920352.db2.gz	RNYRGABOXKVMSK-DGCLKSJQSA-N	0	0	268.282	4.188	20	30		CIEDRN
CCCc1ccc(C(=O)Nc2scc(C)c2C#N)cc1	ZINC000571801301	329921823	/nfs/dbraw/zinc/92/18/23/329921823.db2.gz	IXEPMNFBWQWFJS-UHFFFAOYSA-N	0	0	284.384	4.133	20	30		CIEDRN
C=CCCNc1ccc(Cl)cc1NC(=O)c1ccco1	ZINC000077245162	329922350	/nfs/dbraw/zinc/92/23/50/329922350.db2.gz	SZCGQGLNJHDILV-UHFFFAOYSA-N	0	0	290.750	4.173	20	30		CIEDRN
Cc1ccc(N[C@@H](C)c2ccc(C#N)c(F)c2)cc1	ZINC000538509002	329929155	/nfs/dbraw/zinc/92/91/55/329929155.db2.gz	SSCYLACEYNAVDA-LBPRGKRZSA-N	0	0	254.308	4.179	20	30		CIEDRN
C=CC[C@H](C)NC(=O)C1(Cc2cccs2)CCCCC1	ZINC000571932614	329930411	/nfs/dbraw/zinc/93/04/11/329930411.db2.gz	ZFIRJLXINGSYFJ-AWEZNQCLSA-N	0	0	291.460	4.322	20	30		CIEDRN
CCCC[C@@H](C)N(CCCC)C(=O)c1ccc(C#N)cc1	ZINC000571915233	329931094	/nfs/dbraw/zinc/93/10/94/329931094.db2.gz	YRIOHZDWKAQOTF-OAHLLOKOSA-N	0	0	286.419	4.379	20	30		CIEDRN
CN(C(=O)[C@@H]1CCC[C@H]2CCCC[C@@H]21)c1ccccc1C#N	ZINC000564137451	330000402	/nfs/dbraw/zinc/00/04/02/330000402.db2.gz	IBDZZUGCYHXTLE-HYVNUMGLSA-N	0	0	296.414	4.128	20	30		CIEDRN
CCCN(CC1CCCCC1)C(=O)c1cscc1C#N	ZINC000572366562	330010525	/nfs/dbraw/zinc/01/05/25/330010525.db2.gz	VZAFXGLSEQPRSS-UHFFFAOYSA-N	0	0	290.432	4.052	20	30		CIEDRN
C=C1CCN(C(=O)[C@@H]2C[C@@H]2c2cccc3ccccc32)CC1	ZINC000264440425	330061413	/nfs/dbraw/zinc/06/14/13/330061413.db2.gz	BRUFLYUJPQZYLH-RTBURBONSA-N	0	0	291.394	4.122	20	30		CIEDRN
C=C1CCN(Cc2csc(-c3ccsc3)n2)CC1	ZINC000264467110	330061456	/nfs/dbraw/zinc/06/14/56/330061456.db2.gz	MGJAIVAVSNLEFK-UHFFFAOYSA-N	0	0	276.430	4.024	20	30		CIEDRN
C=C1CCN([C@H](C)c2ncc(-c3ccccc3)o2)CC1	ZINC000266049959	330063482	/nfs/dbraw/zinc/06/34/82/330063482.db2.gz	VFOYBFDPMCSXEB-CQSZACIVSA-N	0	0	268.360	4.055	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(C)[C@H](C)c1sc(C)nc1C	ZINC000268206506	330065429	/nfs/dbraw/zinc/06/54/29/330065429.db2.gz	NTVDYJXYAPFZQJ-GFCCVEGCSA-N	0	0	292.448	4.048	20	30		CIEDRN
C=CCCCC(=O)N1CCC(=Cc2ccccc2F)CC1	ZINC000268230977	330065649	/nfs/dbraw/zinc/06/56/49/330065649.db2.gz	LRSMJUHMIWTGNT-UHFFFAOYSA-N	0	0	287.378	4.188	20	30		CIEDRN
C=CCCC(=O)N(C(C)C)[C@@H](C)c1ccsc1	ZINC000421694907	330067807	/nfs/dbraw/zinc/06/78/07/330067807.db2.gz	WGPZIYAVFVRRPG-LBPRGKRZSA-N	0	0	251.395	4.012	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H](CC(F)F)c1ccccc1	ZINC000421698023	330068441	/nfs/dbraw/zinc/06/84/41/330068441.db2.gz	HLDWPFPIGXEBEE-OAHLLOKOSA-N	0	0	293.357	4.268	20	30		CIEDRN
C=CCC[C@H](NC(=O)Nc1nc(C)c(C)o1)c1ccccc1	ZINC000269375442	330069968	/nfs/dbraw/zinc/06/99/68/330069968.db2.gz	NQUCFJTTYSIMLD-HNNXBMFYSA-N	0	0	299.374	4.120	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)Nc1c(C)cccc1C(C)C)OCC	ZINC000270174528	330073431	/nfs/dbraw/zinc/07/34/31/330073431.db2.gz	LRKONIXSNLECEL-MRXNPFEDSA-N	0	0	289.419	4.428	20	30		CIEDRN
C=C[C@@H](CC(=O)N[C@@H](C)CCc1ccco1)c1ccccc1	ZINC000270189399	330073647	/nfs/dbraw/zinc/07/36/47/330073647.db2.gz	BSAWODDISHLZGA-HOTGVXAUSA-N	0	0	297.398	4.077	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1scnc1CC)c1ccccc1	ZINC000270560155	330076395	/nfs/dbraw/zinc/07/63/95/330076395.db2.gz	STSOXMYSHUYBQA-GFCCVEGCSA-N	0	0	286.400	4.004	20	30		CIEDRN
C=CCN(C(=O)Nc1ccccc1C(C)(C)C)C1CC1	ZINC000271359311	330079163	/nfs/dbraw/zinc/07/91/63/330079163.db2.gz	KXHYZUKTEVVLNX-UHFFFAOYSA-N	0	0	272.392	4.166	20	30		CIEDRN
C=CCN(C(=O)Nc1c(C)cccc1C(C)C)C1CC1	ZINC000271313467	330079339	/nfs/dbraw/zinc/07/93/39/330079339.db2.gz	AJCBNHUBKQXQBD-UHFFFAOYSA-N	0	0	272.392	4.301	20	30		CIEDRN
C#CCCCCC(=O)Nc1cc(C(F)F)ccc1Cl	ZINC000271516050	330081395	/nfs/dbraw/zinc/08/13/95/330081395.db2.gz	GFCOWEZKJOUYEN-UHFFFAOYSA-N	0	0	285.721	4.410	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1cc(SC)ccc1C	ZINC000271771931	330081977	/nfs/dbraw/zinc/08/19/77/330081977.db2.gz	AFXJGETZGUJMGC-UHFFFAOYSA-N	0	0	278.421	4.147	20	30		CIEDRN
C=CCN(CCc1ccco1)C(=O)Nc1c(C)cccc1C	ZINC000272334903	330085211	/nfs/dbraw/zinc/08/52/11/330085211.db2.gz	XDDDDSZHHWPAAM-UHFFFAOYSA-N	0	0	298.386	4.159	20	30		CIEDRN
N#Cc1csc(CSc2ccc3c(c2)CCCC3)n1	ZINC000421844825	330094809	/nfs/dbraw/zinc/09/48/09/330094809.db2.gz	UXVWKYQBYMYERV-UHFFFAOYSA-N	0	0	286.425	4.186	20	30		CIEDRN
C=CCCO[C@H](C)c1nc([C@@H]2CCC[C@@H](C)C2)no1	ZINC000273945289	330101304	/nfs/dbraw/zinc/10/13/04/330101304.db2.gz	NKATVSYPZWFUMT-JHJVBQTASA-N	0	0	264.369	4.017	20	30		CIEDRN
C=CCCCCNC(=O)Nc1cccc(C(F)F)c1	ZINC000274459486	330106188	/nfs/dbraw/zinc/10/61/88/330106188.db2.gz	GCZDQWALFDLDKY-UHFFFAOYSA-N	0	0	268.307	4.102	20	30		CIEDRN
C=C(C)[C@@H](NCc1scnc1C)c1ccc(F)c(F)c1	ZINC000274778645	330107828	/nfs/dbraw/zinc/10/78/28/330107828.db2.gz	KBPDDIOWRAMFMA-OAHLLOKOSA-N	0	0	294.370	4.137	20	30		CIEDRN
C=C(C)[C@@H](N[C@@H](C)c1cscn1)c1ccc(F)c(F)c1	ZINC000274804150	330108154	/nfs/dbraw/zinc/10/81/54/330108154.db2.gz	WBLVFOZQVHFKRM-ZUZCIYMTSA-N	0	0	294.370	4.389	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1sc(C)nc1C)c1ccccc1	ZINC000275082086	330108697	/nfs/dbraw/zinc/10/86/97/330108697.db2.gz	YJLKVDLMLRGYAI-AWEZNQCLSA-N	0	0	286.400	4.058	20	30		CIEDRN
C=CCC[C@@H](C(=O)NCCCC(F)(F)F)c1ccccc1	ZINC000275063750	330108784	/nfs/dbraw/zinc/10/87/84/330108784.db2.gz	RRECPAQWIKFBGU-CQSZACIVSA-N	0	0	299.336	4.195	20	30		CIEDRN
C=C(C)[C@H](CC(=O)Nc1cccc(C(C)(F)F)c1)OCC	ZINC000275626312	330110734	/nfs/dbraw/zinc/11/07/34/330110734.db2.gz	SBGLGIXLJUGXIC-AWEZNQCLSA-N	0	0	297.345	4.108	20	30		CIEDRN
C=CCC[C@H](NCc1nc(C2CC2)cs1)c1ccco1	ZINC000276498850	330113931	/nfs/dbraw/zinc/11/39/31/330113931.db2.gz	WQUUBSCFZRIBCL-ZDUSSCGKSA-N	0	0	288.416	4.411	20	30		CIEDRN
C=CCC1(C(=O)Nc2cccc(Cl)c2OC)CCC1	ZINC000276814081	330114657	/nfs/dbraw/zinc/11/46/57/330114657.db2.gz	YZCUZOSBTAAUNQ-UHFFFAOYSA-N	0	0	279.767	4.034	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)Oc1ccc(-c2c(C)noc2C)cc1	ZINC000277252990	330115602	/nfs/dbraw/zinc/11/56/02/330115602.db2.gz	QJWBAHOXNLIUFM-GOSISDBHSA-N	0	0	299.370	4.466	20	30		CIEDRN
C=C(C)[C@H](CC(=O)Nc1c(C)c(F)ccc1Cl)OCC	ZINC000279163704	330121824	/nfs/dbraw/zinc/12/18/24/330121824.db2.gz	GKCKKRRQFYXHMA-ZDUSSCGKSA-N	0	0	299.773	4.097	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cccc(Oc2ccccn2)c1	ZINC000580422771	330129416	/nfs/dbraw/zinc/12/94/16/330129416.db2.gz	KAOULUYFGAOXMT-UHFFFAOYSA-N	0	0	296.370	4.415	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2ccc(C)cc2OC)no1	ZINC000580482260	330146493	/nfs/dbraw/zinc/14/64/93/330146493.db2.gz	LRGYDCYMAMLSJZ-LBPRGKRZSA-N	0	0	272.348	4.123	20	30		CIEDRN
C=CCC[C@@H](Nc1ccc2c(c1)CCN2)c1ccco1	ZINC000423211874	330178005	/nfs/dbraw/zinc/17/80/05/330178005.db2.gz	HNXCLSMSWBDASP-MRXNPFEDSA-N	0	0	268.360	4.367	20	30		CIEDRN
C[C@H](CNc1ccc(C#N)c(Cl)c1)CC(F)(F)F	ZINC000396884283	330228142	/nfs/dbraw/zinc/22/81/42/330228142.db2.gz	KLDYVGZTPDKICN-QMMMGPOBSA-N	0	0	276.689	4.212	20	30		CIEDRN
COc1ccc([C@H](C)[C@H](C)Nc2cccc(C#N)c2)cc1	ZINC000527218658	330238269	/nfs/dbraw/zinc/23/82/69/330238269.db2.gz	UVBWQAGHBMCJGD-KGLIPLIRSA-N	0	0	280.371	4.171	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(-c2ccc(Cl)cc2)no1	ZINC000527487643	330250636	/nfs/dbraw/zinc/25/06/36/330250636.db2.gz	AXDNJUJPPWTNMB-AWEZNQCLSA-N	0	0	262.740	4.244	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(-c2nccc3ccccc32)no1	ZINC000527487856	330250796	/nfs/dbraw/zinc/25/07/96/330250796.db2.gz	WKRPWLNJLZYTQZ-KRWDZBQOSA-N	0	0	279.343	4.139	20	30		CIEDRN
C[C@@H]([NH2+][C@@H]1CC[C@H](C#N)C1)c1ccc2ccccc2c1	ZINC000424123817	330256440	/nfs/dbraw/zinc/25/64/40/330256440.db2.gz	LNAUTPAYARVLPS-QWQRMKEZSA-N	0	0	264.372	4.183	20	30		CIEDRN
CC[C@H](C#N)c1ccc(-c2ccc3c(c2)CCOC3)cc1	ZINC000527588518	330264554	/nfs/dbraw/zinc/26/45/54/330264554.db2.gz	AQOLXLGVSPIZCN-CQSZACIVSA-N	0	0	277.367	4.443	20	30		CIEDRN
CC[C@H](CNc1ccc(C#N)cc1[N+](=O)[O-])c1ccccc1	ZINC000036781879	330265383	/nfs/dbraw/zinc/26/53/83/330265383.db2.gz	TYSUOMSQJZALLA-CQSZACIVSA-N	0	0	295.342	4.072	20	30		CIEDRN
CCC(F)(F)C(C)(C)CNc1cccc(C#N)c1	ZINC000527686869	330271578	/nfs/dbraw/zinc/27/15/78/330271578.db2.gz	YHJLSHWARSJLGL-UHFFFAOYSA-N	0	0	252.308	4.042	20	30		CIEDRN
CCN(Cc1ccccc1Cl)C(=O)C(C#N)(CC)CC	ZINC000527853698	330288559	/nfs/dbraw/zinc/28/85/59/330288559.db2.gz	QQRGVIPWISMYKZ-UHFFFAOYSA-N	0	0	292.810	4.018	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1ccc(C)c(C(F)(F)F)c1	ZINC000527903761	330289632	/nfs/dbraw/zinc/28/96/32/330289632.db2.gz	SJADNKSZMIAPKH-UHFFFAOYSA-N	0	0	285.309	4.052	20	30		CIEDRN
N#Cc1cccc(NC2CC(c3ccc(F)cc3)C2)c1	ZINC000036842288	330292342	/nfs/dbraw/zinc/29/23/42/330292342.db2.gz	YBERHHPKEZWFKV-UHFFFAOYSA-N	0	0	266.319	4.055	20	30		CIEDRN
COc1c(C)cc(Cl)cc1N[C@H]1CCC[C@@H](C#N)C1	ZINC000527973607	330301881	/nfs/dbraw/zinc/30/18/81/330301881.db2.gz	JXBMYNSBBPHGPA-YPMHNXCESA-N	0	0	278.783	4.151	20	30		CIEDRN
CCCOc1cccc(-c2noc(C(C#N)(CC)CC)n2)c1	ZINC000528116961	330308588	/nfs/dbraw/zinc/30/85/88/330308588.db2.gz	WWCRSZYXYKSLNN-UHFFFAOYSA-N	0	0	299.374	4.107	20	30		CIEDRN
CC[C@H](C)Oc1ccc(NC(=O)C(C#N)(CC)CC)cc1	ZINC000528164620	330310338	/nfs/dbraw/zinc/31/03/38/330310338.db2.gz	MGGFYXSEVCXYCI-ZDUSSCGKSA-N	0	0	288.391	4.132	20	30		CIEDRN
C=CC[C@H](C)NC(=O)c1oc2ccc(Cl)cc2c1C	ZINC000116850701	330321543	/nfs/dbraw/zinc/32/15/43/330321543.db2.gz	NBDLFFPIOKLMKA-VIFPVBQESA-N	0	0	277.751	4.089	20	30		CIEDRN
CCCN(Cc1ccc(C#N)cc1)Cc1ncccc1Cl	ZINC000528354300	330321592	/nfs/dbraw/zinc/32/15/92/330321592.db2.gz	YEHGPOHVUHYOFC-UHFFFAOYSA-N	0	0	299.805	4.019	20	30		CIEDRN
CCN(Cc1ncccc1Cl)[C@H](C)c1ccc(C#N)cc1	ZINC000528360349	330322282	/nfs/dbraw/zinc/32/22/82/330322282.db2.gz	XALRUHIKLMMGTJ-CYBMUJFWSA-N	0	0	299.805	4.190	20	30		CIEDRN
Cc1ccc(CN(CC#N)[C@H]2CCc3ccccc32)cc1	ZINC000533028369	330324821	/nfs/dbraw/zinc/32/48/21/330324821.db2.gz	YZVDCNNQEDHMJN-IBGZPJMESA-N	0	0	276.383	4.008	20	30		CIEDRN
C[C@H](CC(=O)Nc1ccc(Cl)c(C#N)c1)c1ccccc1	ZINC000105414513	330326351	/nfs/dbraw/zinc/32/63/51/330326351.db2.gz	NMOFQXRYZKRBRR-GFCCVEGCSA-N	0	0	298.773	4.344	20	30		CIEDRN
C=CCN(C(=O)C[C@H](C)c1ccccc1)c1ccccc1	ZINC000105446343	330326492	/nfs/dbraw/zinc/32/64/92/330326492.db2.gz	PYNXUWHHGBJAMR-INIZCTEOSA-N	0	0	279.383	4.399	20	30		CIEDRN
C=C(C)C(C)(C)c1nc(Cc2c[nH]c3cccc(C)c23)no1	ZINC000424346215	330344816	/nfs/dbraw/zinc/34/48/16/330344816.db2.gz	IGHPBBIKKVCAPQ-UHFFFAOYSA-N	0	0	295.386	4.304	20	30		CIEDRN
CCC[C@H](C)C(=O)Nc1ccccc1SC[C@H](C)C#N	ZINC000108238146	330353359	/nfs/dbraw/zinc/35/33/59/330353359.db2.gz	WINKFUMOMQWAQU-OLZOCXBDSA-N	0	0	290.432	4.313	20	30		CIEDRN
CCC[C@H](C)C(=O)Nc1ccccc1SC[C@@H](C)C#N	ZINC000108238138	330353399	/nfs/dbraw/zinc/35/33/99/330353399.db2.gz	WINKFUMOMQWAQU-STQMWFEESA-N	0	0	290.432	4.313	20	30		CIEDRN
C=C(CC)CS[C@H](C)C(=O)N(CC)Cc1ccccc1	ZINC000536880597	330358289	/nfs/dbraw/zinc/35/82/89/330358289.db2.gz	DIFVSZMWPYSGCX-OAHLLOKOSA-N	0	0	291.460	4.123	20	30		CIEDRN
C=C(CC)CS[C@@H](C)C(=O)N(CC)Cc1ccccc1	ZINC000536880572	330358332	/nfs/dbraw/zinc/35/83/32/330358332.db2.gz	DIFVSZMWPYSGCX-HNNXBMFYSA-N	0	0	291.460	4.123	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N1CCC[C@H]1c1ccccc1Cl	ZINC000116974390	330362906	/nfs/dbraw/zinc/36/29/06/330362906.db2.gz	MFHHMOHBJDCXDO-DOMZBBRYSA-N	0	0	292.810	4.151	20	30		CIEDRN
C=C[C@H](CC(=O)NCCc1sccc1C)c1ccccc1	ZINC000536889681	330363392	/nfs/dbraw/zinc/36/33/92/330363392.db2.gz	JIZOCPVRHWLGFE-OAHLLOKOSA-N	0	0	299.439	4.075	20	30		CIEDRN
C=CCCCS[C@@H](C)C(=O)Nc1ccc(C)cc1C	ZINC000117944540	330366666	/nfs/dbraw/zinc/36/66/66/330366666.db2.gz	SDQNGTUEFQEAPJ-AWEZNQCLSA-N	0	0	277.433	4.330	20	30		CIEDRN
C=CCCCS[C@H](C)C(=O)Nc1cccc(C)c1	ZINC000117944983	330366670	/nfs/dbraw/zinc/36/66/70/330366670.db2.gz	DTCCZBOSXIAHQY-CYBMUJFWSA-N	0	0	263.406	4.021	20	30		CIEDRN
C[C@H](SCc1ccc(C#N)cc1)c1ccc(C#N)cc1	ZINC000118446107	330367258	/nfs/dbraw/zinc/36/72/58/330367258.db2.gz	FFFJKVPNVDRRKI-ZDUSSCGKSA-N	0	0	278.380	4.424	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)Nc1cccc(C)c1	ZINC000056356715	330367775	/nfs/dbraw/zinc/36/77/75/330367775.db2.gz	GHVUWCNHQQIXJL-UHFFFAOYSA-N	0	0	298.361	4.354	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@@H](C)c1ccccc1	ZINC000119034256	330369315	/nfs/dbraw/zinc/36/93/15/330369315.db2.gz	BTYBLJBSSHILQF-AWEZNQCLSA-N	0	0	285.412	4.066	20	30		CIEDRN
C=CCNC(=O)[C@@H](C)S[C@H](C)c1ccc(C(C)C)cc1	ZINC000543151972	330372051	/nfs/dbraw/zinc/37/20/51/330372051.db2.gz	XJBAPDKHMRXIQF-ZIAGYGMSSA-N	0	0	291.460	4.295	20	30		CIEDRN
CC(C)(C#N)CCNc1cc(Cl)ccc1OC(F)F	ZINC000424565600	330378599	/nfs/dbraw/zinc/37/85/99/330378599.db2.gz	HTOKEZFXCQPCBD-UHFFFAOYSA-N	0	0	288.725	4.293	20	30		CIEDRN
N#Cc1ccc(OCCCOc2ccccc2)c(Cl)c1	ZINC000058340931	330387026	/nfs/dbraw/zinc/38/70/26/330387026.db2.gz	SSWOVUMBVZYENE-UHFFFAOYSA-N	0	0	287.746	4.060	20	30		CIEDRN
CC(C)(C)CN(CCC#N)C(=O)CC/C=C/c1ccccc1	ZINC000120344015	330387129	/nfs/dbraw/zinc/38/71/29/330387129.db2.gz	LHTNOJNVPXPZIC-KPKJPENVSA-N	0	0	298.430	4.268	20	30		CIEDRN
N#Cc1ccc(-c2csc(CCc3ccccc3)n2)cc1	ZINC000058395686	330388455	/nfs/dbraw/zinc/38/84/55/330388455.db2.gz	LTBYUILQOGBHGU-UHFFFAOYSA-N	0	0	290.391	4.467	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)N[C@@H](C)c1cccc(OC(C)C)c1	ZINC000424585380	330389705	/nfs/dbraw/zinc/38/97/05/330389705.db2.gz	CGVQKWAFBACFGW-AWEZNQCLSA-N	0	0	289.419	4.253	20	30		CIEDRN
C=C(C)C(C)(C)C(=O)Nc1ccc2[nH]c(C)cc2c1	ZINC000424587032	330390775	/nfs/dbraw/zinc/39/07/75/330390775.db2.gz	VBGWYSMZMQPZMC-UHFFFAOYSA-N	0	0	256.349	4.017	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccccc1Br	ZINC000120862172	330393074	/nfs/dbraw/zinc/39/30/74/330393074.db2.gz	PELXJOBFMDLMHY-UHFFFAOYSA-N	0	0	294.192	4.156	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cccc(Cl)c1C	ZINC000120901552	330394076	/nfs/dbraw/zinc/39/40/76/330394076.db2.gz	YLHOBLUQDINDCC-UHFFFAOYSA-N	0	0	263.768	4.355	20	30		CIEDRN
N#Cc1cccc(CSc2c(F)cc(F)cc2F)c1F	ZINC000537046254	330394306	/nfs/dbraw/zinc/39/43/06/330394306.db2.gz	YTGIDNKZEZCNBF-UHFFFAOYSA-N	0	0	297.276	4.407	20	30		CIEDRN
CCc1c(C)sc(NC(=O)[C@H](C)c2ccccc2)c1C#N	ZINC000121076768	330396061	/nfs/dbraw/zinc/39/60/61/330396061.db2.gz	WOYUHUWCRVLBHM-LLVKDONJSA-N	0	0	298.411	4.233	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1c(C)cc(C)nc1C)c1ccccc1	ZINC000121375150	330399610	/nfs/dbraw/zinc/39/96/10/330399610.db2.gz	GUSFCGZODOMZLB-INIZCTEOSA-N	0	0	294.398	4.305	20	30		CIEDRN
Cc1ccc(NC(=O)c2ccc(Cl)c(C#N)c2)cc1C	ZINC000537165887	330410529	/nfs/dbraw/zinc/41/05/29/330410529.db2.gz	BZWIKAQISBWXKE-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N(C)[C@@H](C)c1ccc(C)cc1	ZINC000537187200	330413154	/nfs/dbraw/zinc/41/31/54/330413154.db2.gz	XPKOYKMXJNQBRR-CVEARBPZSA-N	0	0	288.435	4.442	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N(C)[C@H](C)c1ccc(C)cc1	ZINC000537187203	330413242	/nfs/dbraw/zinc/41/32/42/330413242.db2.gz	XPKOYKMXJNQBRR-JKSUJKDBSA-N	0	0	288.435	4.442	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N1CCc2sccc2[C@@H]1C	ZINC000537188045	330413286	/nfs/dbraw/zinc/41/32/86/330413286.db2.gz	LRKUGQHFNOREPF-OLZOCXBDSA-N	0	0	292.448	4.122	20	30		CIEDRN
CC(C)(C#N)CCCOc1ccc(Cl)c(F)c1	ZINC000122173883	330415245	/nfs/dbraw/zinc/41/52/45/330415245.db2.gz	MSPBDEDTCUQRAF-UHFFFAOYSA-N	0	0	255.720	4.188	20	30		CIEDRN
C=C[C@@H](CC(=O)N(C)Cc1cccc(F)c1)c1ccccc1	ZINC000122826819	330428999	/nfs/dbraw/zinc/42/89/99/330428999.db2.gz	PGCWWNZMSLLBDF-INIZCTEOSA-N	0	0	297.373	4.144	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)CCCc1ccc(C)cc1	ZINC000537228105	330429549	/nfs/dbraw/zinc/42/95/49/330429549.db2.gz	BVFDQRJIYBEEQV-INIZCTEOSA-N	0	0	273.420	4.179	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1cccc(Cl)c1OC	ZINC000537246051	330430449	/nfs/dbraw/zinc/43/04/49/330430449.db2.gz	FTUMLYDOVQKEBR-LLVKDONJSA-N	0	0	296.798	4.215	20	30		CIEDRN
Cc1ccc(-c2nc(CSCC3(C#N)CC3)co2)cc1	ZINC000537317272	330432583	/nfs/dbraw/zinc/43/25/83/330432583.db2.gz	HCVYMGSJARJTMA-UHFFFAOYSA-N	0	0	284.384	4.187	20	30		CIEDRN
N#CC1(CSc2ncc(-c3ccc(Cl)cc3)o2)CC1	ZINC000537556183	330441122	/nfs/dbraw/zinc/44/11/22/330441122.db2.gz	SEAWEICEAFWWGI-UHFFFAOYSA-N	0	0	290.775	4.391	20	30		CIEDRN
N#C[C@H](Nc1ccccc1OCC(F)F)C1CCCCC1	ZINC000123252017	330458206	/nfs/dbraw/zinc/45/82/06/330458206.db2.gz	HOBZUNOOVWYUFB-AWEZNQCLSA-N	0	0	294.345	4.215	20	30		CIEDRN
Cc1ccc(C)c([C@@H]2CCCN2c2cc(C)nc(C#N)c2)c1	ZINC000514806585	330465691	/nfs/dbraw/zinc/46/56/91/330465691.db2.gz	XHAHCSYOUWEWEE-IBGZPJMESA-N	0	0	291.398	4.220	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cc(C)c(F)cc2Cl)CC1	ZINC000515329064	330475030	/nfs/dbraw/zinc/47/50/30/330475030.db2.gz	WDJVDGVEDSKDJZ-UHFFFAOYSA-N	0	0	281.758	4.472	20	30		CIEDRN
CCCCOc1cccc(CNc2ccc(C#N)cc2)c1	ZINC000515480465	330478305	/nfs/dbraw/zinc/47/83/05/330478305.db2.gz	OXRPJDNKSGTKCP-UHFFFAOYSA-N	0	0	280.371	4.349	20	30		CIEDRN
Cc1ccc(-c2nc3ccccc3c(C)c2C#N)cc1	ZINC000515484341	330478399	/nfs/dbraw/zinc/47/83/99/330478399.db2.gz	RDOGMJCRRDXBOL-UHFFFAOYSA-N	0	0	258.324	4.390	20	30		CIEDRN
C=CCN(CC=C)Cc1nc(-c2ccc(C(C)C)cc2)no1	ZINC000515546943	330479265	/nfs/dbraw/zinc/47/92/65/330479265.db2.gz	AHTKLFMDMLVDSF-UHFFFAOYSA-N	0	0	297.402	4.034	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@H](c2ccccc2)C2CC2)n1	ZINC000515679254	330480859	/nfs/dbraw/zinc/48/08/59/330480859.db2.gz	NVBQZYZANYEFJH-OAHLLOKOSA-N	0	0	282.387	4.465	20	30		CIEDRN
CC(C)(CNc1cccc(F)c1C#N)c1cccs1	ZINC000083601554	330481933	/nfs/dbraw/zinc/48/19/33/330481933.db2.gz	MRDCFKHRHFCMEU-UHFFFAOYSA-N	0	0	274.364	4.149	20	30		CIEDRN
C=C(C)C[C@@H](C)c1nc(C2(c3cccc(OC)c3)CC2)no1	ZINC000515821523	330483078	/nfs/dbraw/zinc/48/30/78/330483078.db2.gz	DIAQMFHKBHHFQU-CYBMUJFWSA-N	0	0	298.386	4.228	20	30		CIEDRN
C=CCNC(=O)[C@@H](C)S[C@H](C)c1cccc2ccccc21	ZINC000516380782	330492135	/nfs/dbraw/zinc/49/21/35/330492135.db2.gz	CECLCOPZVYTBDO-ZIAGYGMSSA-N	0	0	299.439	4.325	20	30		CIEDRN
CC(C)c1ccoc1-c1noc(-c2cc(C#N)cs2)n1	ZINC000426244419	330502363	/nfs/dbraw/zinc/50/23/63/330502363.db2.gz	IBYZTRWTKOCDQX-UHFFFAOYSA-N	0	0	285.328	4.053	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)N[C@@H](C)c1ccccc1Cl	ZINC000426250176	330502472	/nfs/dbraw/zinc/50/24/72/330502472.db2.gz	HJECKIOSCJWEGC-STQMWFEESA-N	0	0	292.810	4.151	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)N[C@@H](C)c1ccccc1Cl	ZINC000426250175	330502476	/nfs/dbraw/zinc/50/24/76/330502476.db2.gz	HJECKIOSCJWEGC-QWHCGFSZSA-N	0	0	292.810	4.151	20	30		CIEDRN
CCS[C@H]1CCCC[C@H]1Nc1ncc(C#N)cc1Cl	ZINC000426355837	330505392	/nfs/dbraw/zinc/50/53/92/330505392.db2.gz	DRGRHLGZVRLNFI-OLZOCXBDSA-N	0	0	295.839	4.083	20	30		CIEDRN
C=CCC(C)(C)c1nc(-c2cnc3ccsc3c2)no1	ZINC000426421320	330508263	/nfs/dbraw/zinc/50/82/63/330508263.db2.gz	QZSJZBRRSZYYFG-UHFFFAOYSA-N	0	0	285.372	4.200	20	30		CIEDRN
C=CCC(C)(C)c1nc(-c2ccc(F)cc2C)no1	ZINC000426453735	330509965	/nfs/dbraw/zinc/50/99/65/330509965.db2.gz	IXYAMTZGELZIFB-UHFFFAOYSA-N	0	0	260.312	4.038	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCc1c(OC)ccc2ccccc21	ZINC000429839211	330555592	/nfs/dbraw/zinc/55/55/92/330555592.db2.gz	LCHDHHDEWGEEQQ-UHFFFAOYSA-N	0	0	297.398	4.067	20	30		CIEDRN
C=CCC(C)(C)C(=O)NCCSc1ccc(Cl)cc1	ZINC000429844535	330555730	/nfs/dbraw/zinc/55/57/30/330555730.db2.gz	VSNFNPFRTOMZIN-UHFFFAOYSA-N	0	0	297.851	4.151	20	30		CIEDRN
CC1CCC(CC(=O)Nc2ccc(C#N)cc2Cl)CC1	ZINC000430379766	330567675	/nfs/dbraw/zinc/56/76/75/330567675.db2.gz	UXYSOFCLSSEUKN-UHFFFAOYSA-N	0	0	290.794	4.367	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)[C@@H]1[C@H](C)[C@H]1c1ccccc1	ZINC000430794750	330574511	/nfs/dbraw/zinc/57/45/11/330574511.db2.gz	RCAUQWSXSFSSEF-HYVNUMGLSA-N	0	0	298.430	4.015	20	30		CIEDRN
N#CCCC[C@H](NC(=O)NC1CCCCC1)c1ccccc1	ZINC000430934096	330576965	/nfs/dbraw/zinc/57/69/65/330576965.db2.gz	KTTBUMWMVCLXLG-KRWDZBQOSA-N	0	0	299.418	4.053	20	30		CIEDRN
COCc1ccccc1/C=C(C)/C=C\c1ccncc1C#N	ZINC000431157728	330580399	/nfs/dbraw/zinc/58/03/99/330580399.db2.gz	XTSPJFJTTQYZFK-DUSHSTMDSA-N	0	0	290.366	4.216	20	30		CIEDRN
C=CCCCC(=O)Nc1c2c(ccc1Cl)CC(C)(C)O2	ZINC000431224747	330582431	/nfs/dbraw/zinc/58/24/31/330582431.db2.gz	YHGQGJNBZDXMDL-UHFFFAOYSA-N	0	0	293.794	4.348	20	30		CIEDRN
CC[C@@H](C)[C@H]1CCCCN1C(=O)Nc1cccc(C#N)c1C	ZINC000432258969	330596378	/nfs/dbraw/zinc/59/63/78/330596378.db2.gz	PUBNXPXZGZOOCD-CXAGYDPISA-N	0	0	299.418	4.299	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)N1CCC[C@@]2(CC=CCC2)C1	ZINC000432558281	330600628	/nfs/dbraw/zinc/60/06/28/330600628.db2.gz	OTCOLHGDKKOGBB-SFHVURJKSA-N	0	0	290.451	4.121	20	30		CIEDRN
N#Cc1ccc(C(F)(F)F)nc1NC1CCC2(CC2)CC1	ZINC000433807421	330631691	/nfs/dbraw/zinc/63/16/91/330631691.db2.gz	GUDQQBDNAPQBQV-UHFFFAOYSA-N	0	0	295.308	4.107	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1c(C)c(C)ccc1Cl	ZINC000434488974	330639938	/nfs/dbraw/zinc/63/99/38/330639938.db2.gz	MYCHYHGJLTYZEY-JTQLQIEISA-N	0	0	266.772	4.043	20	30		CIEDRN
C=CCC[C@@H](Nc1ncccc1F)c1ccccc1	ZINC000434947242	330646854	/nfs/dbraw/zinc/64/68/54/330646854.db2.gz	NSECXVNKFQCWRH-OAHLLOKOSA-N	0	0	256.324	4.340	20	30		CIEDRN
C=CCC[C@@H](NC(=O)NCc1ccccc1)c1ccccc1	ZINC000434987249	330647675	/nfs/dbraw/zinc/64/76/75/330647675.db2.gz	LVBPGJOUFBAPHN-GOSISDBHSA-N	0	0	294.398	4.193	20	30		CIEDRN
C=CCC[C@H](NC(=O)c1ccc(C#N)s1)c1ccccc1	ZINC000435276414	330652193	/nfs/dbraw/zinc/65/21/93/330652193.db2.gz	YKBMHHVPFPIITM-HNNXBMFYSA-N	0	0	296.395	4.057	20	30		CIEDRN
C=CCC[C@@H](NC(=O)c1ccc(OC)cc1)c1ccccc1	ZINC000435279443	330652347	/nfs/dbraw/zinc/65/23/47/330652347.db2.gz	KICAFXGKGMHMLH-GOSISDBHSA-N	0	0	295.382	4.133	20	30		CIEDRN
CC(C)(C)c1ccc(NC(=O)[C@@]2(C#N)CC23CCCC3)cc1	ZINC000448555465	330652524	/nfs/dbraw/zinc/65/25/24/330652524.db2.gz	AYBDRCYZCHPFCQ-IBGZPJMESA-N	0	0	296.414	4.397	20	30		CIEDRN
C=CCC[C@H](NC(=O)c1ccccc1)c1ccccc1	ZINC000435302063	330652555	/nfs/dbraw/zinc/65/25/55/330652555.db2.gz	ZBFJDPVSJGLETK-KRWDZBQOSA-N	0	0	265.356	4.124	20	30		CIEDRN
C=CCC[C@@H](NC(=O)c1ccsc1)c1ccccc1	ZINC000435296241	330652556	/nfs/dbraw/zinc/65/25/56/330652556.db2.gz	GHSQWICMFCZUAS-OAHLLOKOSA-N	0	0	271.385	4.185	20	30		CIEDRN
C=CCC[C@H](NC(=O)[C@H]1Cc2ccccc21)c1ccccc1	ZINC000435301958	330652632	/nfs/dbraw/zinc/65/26/32/330652632.db2.gz	KTQFZZDRAZTHTD-OALUTQOASA-N	0	0	291.394	4.150	20	30		CIEDRN
C=C[C@@H](CC(=O)N[C@@H]1C[C@H]1c1ccccc1)c1ccccc1	ZINC000435337663	330652999	/nfs/dbraw/zinc/65/29/99/330652999.db2.gz	XRKOTECKXYIIIR-ZYSHUDEJSA-N	0	0	291.394	4.019	20	30		CIEDRN
N#Cc1c(F)cccc1N[C@H]1C[C@H](c2ccccc2F)C1	ZINC000435590315	330658326	/nfs/dbraw/zinc/65/83/26/330658326.db2.gz	YGOLAAVHUBYBGM-HAQNSBGRSA-N	0	0	284.309	4.195	20	30		CIEDRN
Cc1occc1-c1nc2cccc(C)c2c(C)c1C#N	ZINC000435930946	330665539	/nfs/dbraw/zinc/66/55/39/330665539.db2.gz	QURHHUXGYNLAFO-UHFFFAOYSA-N	0	0	262.312	4.292	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1cc(C(C)C)c(O)cc1C	ZINC000436664543	330682428	/nfs/dbraw/zinc/68/24/28/330682428.db2.gz	LXVQPHNQNHWJLU-AWEZNQCLSA-N	0	0	287.403	4.005	20	30		CIEDRN
C=C(C)CN(CC)C(=O)CS[C@@H](C)c1cccc(C)c1	ZINC000437434100	330699585	/nfs/dbraw/zinc/69/95/85/330699585.db2.gz	TZHVZRPFVGUVTA-HNNXBMFYSA-N	0	0	291.460	4.214	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1ccc2ccn(CCC)c2c1	ZINC000438291201	330720920	/nfs/dbraw/zinc/72/09/20/330720920.db2.gz	FPJCKMOIAJBOGW-ZDUSSCGKSA-N	0	0	285.391	4.137	20	30		CIEDRN
Cc1ncc(CSCc2ccc(C#N)cc2Cl)s1	ZINC000438866733	330730210	/nfs/dbraw/zinc/73/02/10/330730210.db2.gz	PZVXDTDECAZGHP-UHFFFAOYSA-N	0	0	294.832	4.410	20	30		CIEDRN
N#Cc1cccc(C(=O)CSc2cccc(Cl)c2)c1	ZINC000439049838	330733074	/nfs/dbraw/zinc/73/30/74/330733074.db2.gz	JPSOCEYFVRRWDB-UHFFFAOYSA-N	0	0	287.771	4.187	20	30		CIEDRN
Cc1ccc(C)c(SCC(=O)c2cccc(C#N)c2)c1	ZINC000439048369	330733089	/nfs/dbraw/zinc/73/30/89/330733089.db2.gz	SNUAAXJEVLQVDC-UHFFFAOYSA-N	0	0	281.380	4.150	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)[C@H]1CC[C@H](CC)CC1	ZINC000439148326	330734662	/nfs/dbraw/zinc/73/46/62/330734662.db2.gz	XGVSLSAAWCNLBZ-SHTZXODSSA-N	0	0	291.460	4.479	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)[C@H]1CC[C@H](CC)CC1	ZINC000439170629	330734973	/nfs/dbraw/zinc/73/49/73/330734973.db2.gz	QRBYPUKVKLECMW-SHTZXODSSA-N	0	0	278.440	4.182	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1ccc(C)c(OC(C)C)c1	ZINC000439403667	330737827	/nfs/dbraw/zinc/73/78/27/330737827.db2.gz	NYHIJKDVONCJKM-CQSZACIVSA-N	0	0	290.407	4.258	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@H]1C[C@@]12CCc1ccccc12	ZINC000439494354	330739734	/nfs/dbraw/zinc/73/97/34/330739734.db2.gz	JLYGUDAFTXOIQL-UYAOXDASSA-N	0	0	297.442	4.095	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1ccc(C)c(OC(F)F)c1	ZINC000439523709	330740006	/nfs/dbraw/zinc/74/00/06/330740006.db2.gz	NNASKAJNCHHGBH-NSHDSACASA-N	0	0	298.333	4.073	20	30		CIEDRN
N#Cc1ccc(/C=C\c2cnc(-c3ccsc3)s2)nc1	ZINC000439533023	330740030	/nfs/dbraw/zinc/74/00/30/330740030.db2.gz	XEMXQNOJHXAFOV-ARJAWSKDSA-N	0	0	295.392	4.309	20	30		CIEDRN
N#Cc1ccc(CSCc2ccco2)c(OC(F)F)c1	ZINC000439548774	330740279	/nfs/dbraw/zinc/74/02/79/330740279.db2.gz	LWCZEOLSRCNELL-UHFFFAOYSA-N	0	0	295.310	4.186	20	30		CIEDRN
CC1CCC(CC(=O)N[C@H](CCC#N)c2ccccc2)CC1	ZINC000439675591	330741913	/nfs/dbraw/zinc/74/19/13/330741913.db2.gz	SFDLGKNLCCZZOV-LEOMRAHMSA-N	0	0	298.430	4.364	20	30		CIEDRN
Cc1cccc(C)c1CSc1ccccc1C#N	ZINC000439704278	330742195	/nfs/dbraw/zinc/74/21/95/330742195.db2.gz	FQTWPNDZRLTRTO-UHFFFAOYSA-N	0	0	253.370	4.467	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1ccc(F)c(C2CC2)c1	ZINC000439798210	330743382	/nfs/dbraw/zinc/74/33/82/330743382.db2.gz	DAVNESOKIFMWGE-UHFFFAOYSA-N	0	0	276.355	4.133	20	30		CIEDRN
C[C@@H](SCCC(=O)OC(C)(C)C)c1ccc(C#N)cc1	ZINC000440588705	330751465	/nfs/dbraw/zinc/75/14/65/330751465.db2.gz	OWTJEUFZNMZVPL-GFCCVEGCSA-N	0	0	291.416	4.084	20	30		CIEDRN
C=C1CCN(c2ncnc3sc4ccccc4c32)CC1	ZINC000440649507	330753545	/nfs/dbraw/zinc/75/35/45/330753545.db2.gz	GUFNGSGLFSGOSC-UHFFFAOYSA-N	0	0	281.384	4.001	20	30		CIEDRN
C[C@H]1CCC[C@@]1(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000448665268	330774693	/nfs/dbraw/zinc/77/46/93/330774693.db2.gz	BPNFTPUKZGJFSU-SCLBCKFNSA-N	0	0	284.403	4.253	20	30		CIEDRN
C=C(C)CNC(=O)Nc1cccc(-c2ccccc2OC)c1	ZINC000157389657	330774884	/nfs/dbraw/zinc/77/48/84/330774884.db2.gz	BKVUIONOAYVVOT-UHFFFAOYSA-N	0	0	296.370	4.060	20	30		CIEDRN
COc1cc(/C=C/c2nc3ccccc3s2)ccc1C#N	ZINC000442345849	330775434	/nfs/dbraw/zinc/77/54/34/330775434.db2.gz	FREFYRCBZHKOPZ-VQHVLOKHSA-N	0	0	292.363	4.347	20	30		CIEDRN
N#C[C@@H]1CC[C@H](Nc2cccc(C(F)F)c2Cl)C1	ZINC000442834714	330786026	/nfs/dbraw/zinc/78/60/26/330786026.db2.gz	KRLPJVPPNWLSEG-BDAKNGLRSA-N	0	0	270.710	4.382	20	30		CIEDRN
CCC(C)(C)OCc1ccccc1N[C@H]1CC[C@H](C#N)C1	ZINC000442840222	330786273	/nfs/dbraw/zinc/78/62/73/330786273.db2.gz	KEGJYDQPUDFJFZ-HOCLYGCPSA-N	0	0	286.419	4.496	20	30		CIEDRN
Cc1cc(N[C@@H]2CC[C@@H](C#N)C2)cc(C)c1Br	ZINC000442855347	330787403	/nfs/dbraw/zinc/78/74/03/330787403.db2.gz	BOJOZMPVZKQCQZ-VXGBXAGGSA-N	0	0	293.208	4.170	20	30		CIEDRN
COc1cc(Cl)c(Cl)cc1N[C@H]1CC[C@@H](C#N)C1	ZINC000442857375	330787625	/nfs/dbraw/zinc/78/76/25/330787625.db2.gz	NEPSZQRCPDLVBO-BDAKNGLRSA-N	0	0	285.174	4.106	20	30		CIEDRN
CC(C)CCn1ncc(N[C@H]2CC[C@H](C#N)C2)c1C(C)C	ZINC000442858770	330787744	/nfs/dbraw/zinc/78/77/44/330787744.db2.gz	SYZNQIDQFURHTA-GJZGRUSLSA-N	0	0	288.439	4.157	20	30		CIEDRN
Cc1csc(-c2ccc(N[C@H]3CC[C@@H](C#N)C3)cc2)n1	ZINC000442859012	330787785	/nfs/dbraw/zinc/78/77/85/330787785.db2.gz	PUROYUMGAAXBNB-DOMZBBRYSA-N	0	0	283.400	4.223	20	30		CIEDRN
N#C[C@@H]1CC[C@H](Nc2cccc(CCC(F)(F)F)c2)C1	ZINC000442870607	330788997	/nfs/dbraw/zinc/78/89/97/330788997.db2.gz	GGDBVEIIZIVFID-OCCSQVGLSA-N	0	0	282.309	4.286	20	30		CIEDRN
C[C@@H](Oc1ccc(Cl)cc1F)c1cccc(C#N)c1	ZINC000442902103	330791344	/nfs/dbraw/zinc/79/13/44/330791344.db2.gz	MIGGTZDTELLRNU-SNVBAGLBSA-N	0	0	275.710	4.491	20	30		CIEDRN
CCc1nnc([C@H](C)S[C@H](C)c2cccc(C#N)c2)o1	ZINC000443147632	330795741	/nfs/dbraw/zinc/79/57/41/330795741.db2.gz	WCWCFHJWTSWTSG-MNOVXSKESA-N	0	0	287.388	4.059	20	30		CIEDRN
C[C@@H](CNc1cccc(Cl)c1C#N)c1ccccc1	ZINC000157766138	330801571	/nfs/dbraw/zinc/80/15/71/330801571.db2.gz	LCDFOAAHBLAEDT-LBPRGKRZSA-N	0	0	270.763	4.427	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cc2[nH]ccc2cc1C	ZINC000444458494	330813213	/nfs/dbraw/zinc/81/32/13/330813213.db2.gz	UDRVFJQYJKXLFV-UHFFFAOYSA-N	0	0	268.360	4.183	20	30		CIEDRN
C[C@@H]1CN(CCCCC(C)(C)C#N)c2ccc(F)cc2O1	ZINC000444647278	330816457	/nfs/dbraw/zinc/81/64/57/330816457.db2.gz	KTWDLRWGKQQNBG-CYBMUJFWSA-N	0	0	290.382	4.133	20	30		CIEDRN
N#CCCCCN1C[C@@H](c2ccccc2)c2ccccc21	ZINC000444762570	330823646	/nfs/dbraw/zinc/82/36/46/330823646.db2.gz	AIKKGVJUBGFUDJ-SFHVURJKSA-N	0	0	276.383	4.332	20	30		CIEDRN
CC(C)(C)[C@H]1CN(CCCSCC#N)c2ccccc21	ZINC000444784459	330825376	/nfs/dbraw/zinc/82/53/76/330825376.db2.gz	NXOONDJRLUHEQD-HNNXBMFYSA-N	0	0	288.460	4.283	20	30		CIEDRN
C[C@@H](CC1CCCCC1)NC(=O)Nc1ccc(CC#N)cc1	ZINC000446133697	330845141	/nfs/dbraw/zinc/84/51/41/330845141.db2.gz	ATCKIJDXQFOGGH-AWEZNQCLSA-N	0	0	299.418	4.233	20	30		CIEDRN
Cc1ccc(CSCC2(C#N)CC2)c(Cl)c1	ZINC000446700463	330851832	/nfs/dbraw/zinc/85/18/32/330851832.db2.gz	HJNQWJSULCNILI-UHFFFAOYSA-N	0	0	251.782	4.185	20	30		CIEDRN
N#C[C@H]1CCC[C@H](Nc2cccc3ccsc32)C1	ZINC000446825001	330855173	/nfs/dbraw/zinc/85/51/73/330855173.db2.gz	HSHDKWFPERHAQM-AAEUAGOBSA-N	0	0	256.374	4.396	20	30		CIEDRN
N#C[C@@H]1CCC[C@@H](Nc2cccc3ccsc32)C1	ZINC000446825005	330855186	/nfs/dbraw/zinc/85/51/86/330855186.db2.gz	HSHDKWFPERHAQM-DGCLKSJQSA-N	0	0	256.374	4.396	20	30		CIEDRN
C(#Cc1ccccc1NCc1nccs1)c1ccccc1	ZINC000446893243	330857315	/nfs/dbraw/zinc/85/73/15/330857315.db2.gz	DUBMJHJYHCTMGQ-UHFFFAOYSA-N	0	0	290.391	4.155	20	30		CIEDRN
Cc1cc(CSc2ccccc2C#N)ccc1C#N	ZINC000447298413	330863754	/nfs/dbraw/zinc/86/37/54/330863754.db2.gz	HEMOZUKXEQAVRS-UHFFFAOYSA-N	0	0	264.353	4.031	20	30		CIEDRN
CC[C@@H](C#N)Sc1nc(C(C)C)nc2ccccc21	ZINC000447336250	330865002	/nfs/dbraw/zinc/86/50/02/330865002.db2.gz	SEEDRXPPEKPAHR-NSHDSACASA-N	0	0	271.389	4.147	20	30		CIEDRN
C=CCCCCCNc1cccc(Cn2nc(C)nc2C)c1	ZINC000447406512	330866567	/nfs/dbraw/zinc/86/65/67/330866567.db2.gz	VSCMDKMCXVFOLP-UHFFFAOYSA-N	0	0	298.434	4.102	20	30		CIEDRN
CC[C@H](Nc1ccc(C)cc1OC)c1ccc(C#N)cc1	ZINC000447594562	330872543	/nfs/dbraw/zinc/87/25/43/330872543.db2.gz	ZSGUNZFGFDJTPK-INIZCTEOSA-N	0	0	280.371	4.439	20	30		CIEDRN
CC(C)[C@H]1C[C@@H](Nc2ccc(C#N)nc2)c2ccccc21	ZINC000447814868	330877559	/nfs/dbraw/zinc/87/75/59/330877559.db2.gz	AMVCFZSLLSKIHO-QZTJIDSGSA-N	0	0	277.371	4.250	20	30		CIEDRN
N#Cc1ccc(F)c(CSCCCC2CCOCC2)c1	ZINC000447926328	330880302	/nfs/dbraw/zinc/88/03/02/330880302.db2.gz	MARZBFIOJWBCTM-UHFFFAOYSA-N	0	0	293.407	4.137	20	30		CIEDRN
C=CCCCNC(=O)N[C@H](c1ccc(Cl)cc1)C1CC1	ZINC000447968715	330881703	/nfs/dbraw/zinc/88/17/03/330881703.db2.gz	RLWVEVQRVZNKKX-HNNXBMFYSA-N	0	0	292.810	4.057	20	30		CIEDRN
CCC(C)(C)c1ccc(NCc2cc(C#N)n(C)c2)cc1	ZINC000447975224	330881954	/nfs/dbraw/zinc/88/19/54/330881954.db2.gz	ZCDKFVLBNKPABL-UHFFFAOYSA-N	0	0	281.403	4.196	20	30		CIEDRN
CCCCCN(C(=O)c1cc(C#N)[nH]c1C)[C@@H](C)CCC	ZINC000448805637	330884346	/nfs/dbraw/zinc/88/43/46/330884346.db2.gz	OZWOKJPNPIRLKR-ZDUSSCGKSA-N	0	0	289.423	4.016	20	30		CIEDRN
C=CC(C)(C)C(=O)Nc1cc(Cl)c(OC)c(Cl)c1	ZINC000448857105	330886017	/nfs/dbraw/zinc/88/60/17/330886017.db2.gz	OVJGVILEPJBSRJ-UHFFFAOYSA-N	0	0	288.174	4.153	20	30		CIEDRN
CC(C)C(=O)Nc1cccc(NC2CCC(C)(C#N)CC2)c1	ZINC000449041508	330894686	/nfs/dbraw/zinc/89/46/86/330894686.db2.gz	NDXUYHQJYMXJMJ-UHFFFAOYSA-N	0	0	299.418	4.165	20	30		CIEDRN
Cc1nc2ccc(NC3CCC(C)(C#N)CC3)cc2s1	ZINC000449089491	330898406	/nfs/dbraw/zinc/89/84/06/330898406.db2.gz	KQWDUMKTLLCDCA-UHFFFAOYSA-N	0	0	285.416	4.489	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc3oc(C)nc3c2)CCCC1	ZINC000449194778	330905421	/nfs/dbraw/zinc/90/54/21/330905421.db2.gz	YGUOLXNUSSWURG-UHFFFAOYSA-N	0	0	284.359	4.211	20	30		CIEDRN
Cn1ccc2cccc(NC3CCC(C)(C#N)CC3)c21	ZINC000449275464	330911320	/nfs/dbraw/zinc/91/13/20/330911320.db2.gz	MPLKMXGCFRSXPV-UHFFFAOYSA-N	0	0	267.376	4.063	20	30		CIEDRN
C=CCCCC[C@@H](C)NCc1noc(-c2cccs2)n1	ZINC000449550219	330936141	/nfs/dbraw/zinc/93/61/41/330936141.db2.gz	AKHCCGBZFCWRFD-GFCCVEGCSA-N	0	0	291.420	4.023	20	30		CIEDRN
CCSCc1ccc(N[C@H]2CC[C@@H](C#N)C2)cc1	ZINC000449597902	330938742	/nfs/dbraw/zinc/93/87/42/330938742.db2.gz	GWYNBJKJMIDRTA-HIFRSBDPSA-N	0	0	260.406	4.044	20	30		CIEDRN
Cc1ccccc1C[C@@H](C)Nc1cccc(CC#N)c1	ZINC000449693526	330943960	/nfs/dbraw/zinc/94/39/60/330943960.db2.gz	DXHPVGQRFGULRJ-OAHLLOKOSA-N	0	0	264.372	4.104	20	30		CIEDRN
N#CCc1cccc(N[C@H]2CCC[C@@H](c3cccnc3)C2)c1	ZINC000449695426	330944238	/nfs/dbraw/zinc/94/42/38/330944238.db2.gz	IHZRCACNWKDOMP-APWZRJJASA-N	0	0	291.398	4.286	20	30		CIEDRN
C[C@@H](CCc1ccc(F)cc1)Nc1cccc(CC#N)c1	ZINC000449697212	330944285	/nfs/dbraw/zinc/94/42/85/330944285.db2.gz	LAFXFLWRPVREMY-AWEZNQCLSA-N	0	0	282.362	4.325	20	30		CIEDRN
C=CC[C@H](C)NC(=O)C(C)(C)c1cccc2ccccc21	ZINC000449888626	330953616	/nfs/dbraw/zinc/95/36/16/330953616.db2.gz	OCNDTIDVRCDSGJ-AWEZNQCLSA-N	0	0	281.399	4.198	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H](C)CCc2ccc(C)o2)CCCC1	ZINC000449965394	330956888	/nfs/dbraw/zinc/95/68/88/330956888.db2.gz	MJIQINXANOMGEN-AWEZNQCLSA-N	0	0	289.419	4.162	20	30		CIEDRN
C=CC(C)(C)C(=O)N1CC[C@@](C)(CCc2ccccc2)C1	ZINC000450066568	330960260	/nfs/dbraw/zinc/96/02/60/330960260.db2.gz	GXCHIGMDBISXQQ-LJQANCHMSA-N	0	0	285.431	4.070	20	30		CIEDRN
C=CC(C)(C)C(=O)N1CCC[C@]2(CCCc3ccccc32)C1	ZINC000450077416	330960640	/nfs/dbraw/zinc/96/06/40/330960640.db2.gz	WPCHSCGZOUVNGS-HXUWFJFHSA-N	0	0	297.442	4.095	20	30		CIEDRN
N#CCCCCNc1nccc2cc(C(F)(F)F)ccc21	ZINC000450312999	330972168	/nfs/dbraw/zinc/97/21/68/330972168.db2.gz	JRWCEVJLVSJLHZ-UHFFFAOYSA-N	0	0	293.292	4.359	20	30		CIEDRN
N#Cc1ccc(COc2cccc(F)c2F)c(Cl)c1	ZINC000162989176	330972735	/nfs/dbraw/zinc/97/27/35/330972735.db2.gz	QZSXVYKOGFVHTF-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
C=CCN(C(=O)c1ccc(C)c(Cl)c1Cl)C1CC1	ZINC000450389391	330975774	/nfs/dbraw/zinc/97/57/74/330975774.db2.gz	NAGDPWJIZIIEKM-UHFFFAOYSA-N	0	0	284.186	4.092	20	30		CIEDRN
Cc1csc([C@H](C)CNc2cccc(Cl)c2C#N)n1	ZINC000450435552	330979401	/nfs/dbraw/zinc/97/94/01/330979401.db2.gz	FWVQGOJTXUHMIE-SECBINFHSA-N	0	0	291.807	4.192	20	30		CIEDRN
C=CCn1c2ccccc2nc1S[C@H]1CC[C@@H](C#N)C1	ZINC000450614151	330989331	/nfs/dbraw/zinc/98/93/31/330989331.db2.gz	VZZJJKJWWSVKPR-OLZOCXBDSA-N	0	0	283.400	4.007	20	30		CIEDRN
N#CC[C@@H]1CC[C@H](Nc2ccnc3c(Cl)cccc23)C1	ZINC000450672997	330992561	/nfs/dbraw/zinc/99/25/61/330992561.db2.gz	MVVLPFRVIOJAGW-RYUDHWBXSA-N	0	0	285.778	4.382	20	30		CIEDRN
CCC[C@@H](NCC1(C#N)CCC1)c1ccc(F)cc1F	ZINC000450681759	330993251	/nfs/dbraw/zinc/99/32/51/330993251.db2.gz	MWSIONWVZWWBTN-OAHLLOKOSA-N	0	0	278.346	4.089	20	30		CIEDRN
COc1ccc2oc([C@@H](C)NCC3(C#N)CCC3)c(C)c2c1	ZINC000450728544	330996402	/nfs/dbraw/zinc/99/64/02/330996402.db2.gz	LORKUVZROXVDER-CYBMUJFWSA-N	0	0	298.386	4.094	20	30		CIEDRN
CCCc1nc(C)c(COc2ccc(C#N)cc2Cl)o1	ZINC000450740424	330997282	/nfs/dbraw/zinc/99/72/82/330997282.db2.gz	UHDOLYMDVSXYFS-UHFFFAOYSA-N	0	0	290.750	4.040	20	30		CIEDRN
CC(C)c1cnc(S[C@H]2CC[C@H](C#N)C2)n1C(C)C	ZINC000450843535	331002350	/nfs/dbraw/zinc/00/23/50/331002350.db2.gz	DYXJISAPPCMSHX-STQMWFEESA-N	0	0	277.437	4.372	20	30		CIEDRN
Cc1nc(C(C)C)oc1CSc1ccc(C#N)cc1F	ZINC000450845167	331002444	/nfs/dbraw/zinc/00/24/44/331002444.db2.gz	KBBQXXZPRGTFPI-UHFFFAOYSA-N	0	0	290.363	4.410	20	30		CIEDRN
N#Cc1c(F)cccc1N1CC2(CCC2)[C@@H]1c1ccco1	ZINC000450857123	331003231	/nfs/dbraw/zinc/00/32/31/331003231.db2.gz	ILRUIEUFAFYWFN-INIZCTEOSA-N	0	0	282.318	4.022	20	30		CIEDRN
Cc1cc(F)ccc1[C@H]1CCCN1c1ccc(C#N)c(C)n1	ZINC000450910614	331006634	/nfs/dbraw/zinc/00/66/34/331006634.db2.gz	JOHRVOFVJFRVGW-QGZVFWFLSA-N	0	0	295.361	4.051	20	30		CIEDRN
N#C[C@H]1CC[C@@H](Sc2cc(Cl)ccc2F)C1	ZINC000450964947	331009002	/nfs/dbraw/zinc/00/90/02/331009002.db2.gz	UBZTWMRUOXWRJA-WCBMZHEXSA-N	0	0	255.745	4.263	20	30		CIEDRN
N#CC1(CSC2CCC(C(F)(F)F)CC2)CC1	ZINC000451038391	331013086	/nfs/dbraw/zinc/01/30/86/331013086.db2.gz	UHFAFLMEJWDCLT-UHFFFAOYSA-N	0	0	263.328	4.144	20	30		CIEDRN
C[C@H](CCCC(F)(F)F)Nc1ccc(CC#N)cc1	ZINC000163306563	331018125	/nfs/dbraw/zinc/01/81/25/331018125.db2.gz	RCGYJPFXZKAJBG-LLVKDONJSA-N	0	0	270.298	4.286	20	30		CIEDRN
C=CCC1(C(=O)N2CCc3cccc(C)c3C2)CCCC1	ZINC000451188168	331019668	/nfs/dbraw/zinc/01/96/68/331019668.db2.gz	FJCKCZHZHACVAC-UHFFFAOYSA-N	0	0	283.415	4.016	20	30		CIEDRN
C=CC(C)(C)C(=O)N1CCC[C@](C)(c2ccccc2)CC1	ZINC000451679708	331038898	/nfs/dbraw/zinc/03/88/98/331038898.db2.gz	KDAICORRSOTGMN-IBGZPJMESA-N	0	0	285.431	4.169	20	30		CIEDRN
CC(C)(CCC#N)CNC(=O)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000451782374	331041843	/nfs/dbraw/zinc/04/18/43/331041843.db2.gz	YWYYBNWNOXPBHM-IAGOWNOFSA-N	0	0	298.430	4.016	20	30		CIEDRN
N#Cc1cc(CN2CC3(CCC3)[C@H]2c2ccco2)ccc1F	ZINC000451862808	331045301	/nfs/dbraw/zinc/04/53/01/331045301.db2.gz	VRAIVAXBFGXZLW-QGZVFWFLSA-N	0	0	296.345	4.018	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@H]1CCCc2sc(Cl)cc21	ZINC000452124766	331055119	/nfs/dbraw/zinc/05/51/19/331055119.db2.gz	RNMUYFRBFMPECS-JTQLQIEISA-N	0	0	283.824	4.107	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@@H](C)c1ccc(F)cc1Cl	ZINC000452185336	331057401	/nfs/dbraw/zinc/05/74/01/331057401.db2.gz	LKRPFUAOWBSRMU-JTQLQIEISA-N	0	0	283.774	4.259	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N(CC)CC(=C)C	ZINC000505016423	331059247	/nfs/dbraw/zinc/05/92/47/331059247.db2.gz	HETXMNVQBXHDLW-UHFFFAOYSA-N	0	0	272.392	4.235	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1[C@H](C)[C@@H](CC(F)(F)F)C[C@@H]1C	ZINC000452226073	331059327	/nfs/dbraw/zinc/05/93/27/331059327.db2.gz	ALQVDWHOKOHFCU-WUHRBBMRSA-N	0	0	291.357	4.167	20	30		CIEDRN
C=CCCC1(C(=O)N[C@H](C)c2ccc(C)c(F)c2)CC1	ZINC000452325796	331062378	/nfs/dbraw/zinc/06/23/78/331062378.db2.gz	HNNYTGIBNJHHRV-CYBMUJFWSA-N	0	0	275.367	4.058	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H]1CCCC[C@H]1CC(F)(F)F	ZINC000452507090	331066713	/nfs/dbraw/zinc/06/67/13/331066713.db2.gz	COXZZMJTSVMSKL-AVGNSLFASA-N	0	0	291.357	4.216	20	30		CIEDRN
C[C@H](CC(=O)Nc1ccc(CC#N)cc1Cl)C(C)(C)C	ZINC000452642528	331070827	/nfs/dbraw/zinc/07/08/27/331070827.db2.gz	HWMAEDRIEMAQII-LLVKDONJSA-N	0	0	292.810	4.417	20	30		CIEDRN
C[C@H]1CC[C@H](CC(=O)Nc2ccc(CC#N)cc2Cl)C1	ZINC000452642206	331070862	/nfs/dbraw/zinc/07/08/62/331070862.db2.gz	GKSOQMPZRXDZAP-AAEUAGOBSA-N	0	0	290.794	4.171	20	30		CIEDRN
C[C@H]1CCC[C@H](C(=O)Nc2ccc(CC#N)cc2Cl)C1	ZINC000452649689	331071060	/nfs/dbraw/zinc/07/10/60/331071060.db2.gz	XJRRWVHHSVPPHF-AAEUAGOBSA-N	0	0	290.794	4.171	20	30		CIEDRN
C=C(C)CCNC(=O)C[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000452717995	331073280	/nfs/dbraw/zinc/07/32/80/331073280.db2.gz	NMUQLFFFMZGOTD-LBPRGKRZSA-N	0	0	299.336	4.281	20	30		CIEDRN
C=C(C)CCNC(=O)C1(c2c(Cl)cccc2Cl)CC1	ZINC000452718793	331073333	/nfs/dbraw/zinc/07/33/33/331073333.db2.gz	RABVVMFUNVCHQD-UHFFFAOYSA-N	0	0	298.213	4.107	20	30		CIEDRN
C=C(C)CCNC(=O)c1ccccc1SCC=C(C)C	ZINC000452719214	331073546	/nfs/dbraw/zinc/07/35/46/331073546.db2.gz	SKPYJSOMEUPTCX-UHFFFAOYSA-N	0	0	289.444	4.441	20	30		CIEDRN
C=C(C)CCNC(=O)CCc1cc(Cl)cc(Cl)c1	ZINC000452720835	331073705	/nfs/dbraw/zinc/07/37/05/331073705.db2.gz	XUHJUUWWZXRSLN-UHFFFAOYSA-N	0	0	286.202	4.008	20	30		CIEDRN
C=C(C)CCNC(=O)[C@H]1C[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000452722209	331073914	/nfs/dbraw/zinc/07/39/14/331073914.db2.gz	JMZCHPODHYEOHY-RYUDHWBXSA-N	0	0	298.213	4.179	20	30		CIEDRN
CC(C)(CNC(=O)C[C@H](CC#N)c1ccccc1)C1CCC1	ZINC000452784324	331077794	/nfs/dbraw/zinc/07/77/94/331077794.db2.gz	KFJQGHAMTVCWEK-INIZCTEOSA-N	0	0	298.430	4.016	20	30		CIEDRN
C=CC(C)(C)CNC(=O)c1cc(Cl)c(F)cc1Cl	ZINC000452785886	331077900	/nfs/dbraw/zinc/07/79/00/331077900.db2.gz	VYEUKOPZUWCTTB-UHFFFAOYSA-N	0	0	290.165	4.075	20	30		CIEDRN
CC#CCCCC(=O)Nc1cc(C)c(C)cc1Cl	ZINC000452869142	331079753	/nfs/dbraw/zinc/07/97/53/331079753.db2.gz	IDBBEDDOIKIEMA-UHFFFAOYSA-N	0	0	263.768	4.089	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(C(=O)C(C)C)cc2)CC1	ZINC000452970491	331082283	/nfs/dbraw/zinc/08/22/83/331082283.db2.gz	GBSHJQIZDVVXNG-UHFFFAOYSA-N	0	0	285.387	4.210	20	30		CIEDRN
C=CCC1(c2nc(COCc3ccccc3)no2)CCCC1	ZINC000453105313	331089592	/nfs/dbraw/zinc/08/95/92/331089592.db2.gz	WQRUXWXPLBTTLN-UHFFFAOYSA-N	0	0	298.386	4.174	20	30		CIEDRN
C=CC(C)(C)c1nc(-c2cccc(CSC)c2)no1	ZINC000453121458	331091292	/nfs/dbraw/zinc/09/12/92/331091292.db2.gz	WXTHXVKJFWZCOP-UHFFFAOYSA-N	0	0	274.389	4.063	20	30		CIEDRN
CC(C)(C)OCCCCNc1ccc(CC#N)cc1Cl	ZINC000453122197	331091461	/nfs/dbraw/zinc/09/14/61/331091461.db2.gz	GEKVEUNWMAYNGJ-UHFFFAOYSA-N	0	0	294.826	4.413	20	30		CIEDRN
CC(C)(C#N)CCNc1ccccc1C(C)(F)F	ZINC000453126617	331091903	/nfs/dbraw/zinc/09/19/03/331091903.db2.gz	AUCZDHJCEVJDQL-UHFFFAOYSA-N	0	0	252.308	4.150	20	30		CIEDRN
CCc1cnccc1[C@H](C)C1CCC(C)(C#N)CC1	ZINC000453151240	331094501	/nfs/dbraw/zinc/09/45/01/331094501.db2.gz	SWITVIMXIDXERS-BZOOQXSSSA-N	0	0	256.393	4.468	20	30		CIEDRN
CCc1cnccc1[C@@H](C)C1CCC(C)(C#N)CC1	ZINC000453151254	331094588	/nfs/dbraw/zinc/09/45/88/331094588.db2.gz	SWITVIMXIDXERS-KTAKPFMOSA-N	0	0	256.393	4.468	20	30		CIEDRN
C=CCCCC[C@H](C)Nc1ccc(NC(C)=O)cc1OC	ZINC000453167545	331096382	/nfs/dbraw/zinc/09/63/82/331096382.db2.gz	DEOLJAUEOJEMOW-ZDUSSCGKSA-N	0	0	290.407	4.200	20	30		CIEDRN
C=CCCc1noc([C@@H]2C[C@H]2c2cccc(Cl)c2)n1	ZINC000453220719	331103034	/nfs/dbraw/zinc/10/30/34/331103034.db2.gz	OBDGUPSLUHQYJG-QWHCGFSZSA-N	0	0	274.751	4.113	20	30		CIEDRN
C=CCCc1noc(-c2ccccc2CSCC)n1	ZINC000453236402	331105271	/nfs/dbraw/zinc/10/52/71/331105271.db2.gz	NRTHSVAPLQCGPI-UHFFFAOYSA-N	0	0	274.389	4.108	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1c(C)cccc1OC)c1ccccc1	ZINC000194985618	331106839	/nfs/dbraw/zinc/10/68/39/331106839.db2.gz	UEJRRRRBXPOVRU-OAHLLOKOSA-N	0	0	295.382	4.302	20	30		CIEDRN
C=CCCc1noc([C@@H](C)CSc2ccccc2)n1	ZINC000453247824	331107102	/nfs/dbraw/zinc/10/71/02/331107102.db2.gz	PASTXEDBCAFVCC-LBPRGKRZSA-N	0	0	274.389	4.084	20	30		CIEDRN
C=CCCOCCCCc1nc(-c2ccc(C)s2)no1	ZINC000453317654	331115871	/nfs/dbraw/zinc/11/58/71/331115871.db2.gz	AFULNQAOZHBNIE-UHFFFAOYSA-N	0	0	292.404	4.022	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1C[C@@H](c2ccccc2C)C[C@@H]1C	ZINC000467340740	331133531	/nfs/dbraw/zinc/13/35/31/331133531.db2.gz	KFRKIRVTCMTBPX-WMZOPIPTSA-N	0	0	297.442	4.468	20	30		CIEDRN
C=CCN(CC=C)C(=O)c1ccc([C@H](C)C(F)(F)F)cc1	ZINC000454147605	331139746	/nfs/dbraw/zinc/13/97/46/331139746.db2.gz	DBOVOCVFJVFVKX-LBPRGKRZSA-N	0	0	297.320	4.167	20	30		CIEDRN
C=C(C)CCNC(=O)Nc1ccc(Cl)cc1Cl	ZINC000454154252	331140017	/nfs/dbraw/zinc/14/00/17/331140017.db2.gz	JXPBWFLIMHFUSM-UHFFFAOYSA-N	0	0	273.163	4.081	20	30		CIEDRN
CC(C)=CCC[C@H](C)NC(=O)N[C@@H](C)c1ccc(C#N)cc1	ZINC000454353343	331144808	/nfs/dbraw/zinc/14/48/08/331144808.db2.gz	XIAZZTTXBWWRJH-GJZGRUSLSA-N	0	0	299.418	4.053	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N1CC2(CCCC2)[C@H]1c1ccccc1	ZINC000454521150	331147894	/nfs/dbraw/zinc/14/78/94/331147894.db2.gz	JKJGTOMSQZRKRW-DOTOQJQBSA-N	0	0	298.430	4.278	20	30		CIEDRN
C=C(C)CCNC(=O)Nc1ccc(C(=O)C(C)(C)C)cc1	ZINC000454926698	331157049	/nfs/dbraw/zinc/15/70/49/331157049.db2.gz	JIULXOVIOADVLU-UHFFFAOYSA-N	0	0	288.391	4.003	20	30		CIEDRN
CCN(C(=O)C1=CC[C@@H](C)CC1)[C@@H](C)c1ccc(C#N)cc1	ZINC000454981120	331158110	/nfs/dbraw/zinc/15/81/10/331158110.db2.gz	RZKBIVRAHXAHEB-CABCVRRESA-N	0	0	296.414	4.214	20	30		CIEDRN
C=C(C)CCNC(=O)Nc1c(C)c(C)ccc1Cl	ZINC000455281379	331164163	/nfs/dbraw/zinc/16/41/63/331164163.db2.gz	SVYIQCHGNGJBAT-UHFFFAOYSA-N	0	0	266.772	4.045	20	30		CIEDRN
C=C(C)CCNC(=O)N(C)[C@@H](C)c1cc2ccccc2o1	ZINC000455306992	331165031	/nfs/dbraw/zinc/16/50/31/331165031.db2.gz	HLSXJXMDTFTXLO-ZDUSSCGKSA-N	0	0	286.375	4.101	20	30		CIEDRN
C=C(C)CCNC(=O)N1CCC[C@@H]1c1ccc(Cl)cc1	ZINC000455315439	331165804	/nfs/dbraw/zinc/16/58/04/331165804.db2.gz	UBVOLROIRSHUFU-OAHLLOKOSA-N	0	0	292.810	4.153	20	30		CIEDRN
C=CC(C)(C)CNC(=O)N1CCC[C@H]1c1ccc(C)cc1	ZINC000455364630	331167261	/nfs/dbraw/zinc/16/72/61/331167261.db2.gz	JSZLEGUKESZODB-INIZCTEOSA-N	0	0	286.419	4.054	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CC(CC)(CC)C1	ZINC000455387685	331168355	/nfs/dbraw/zinc/16/83/55/331168355.db2.gz	SSRWXQPVBICKQZ-UHFFFAOYSA-N	0	0	286.419	4.459	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2cc(C)c(C)cc2Cl)CC1	ZINC000455730214	331176404	/nfs/dbraw/zinc/17/64/04/331176404.db2.gz	GHCSIFCGGRYNNC-UHFFFAOYSA-N	0	0	292.810	4.387	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1cc(OCC)ccc1Cl	ZINC000455766535	331177321	/nfs/dbraw/zinc/17/73/21/331177321.db2.gz	HBUQHGAULWNYBF-UHFFFAOYSA-N	0	0	296.798	4.169	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1ccc(C(=O)C(C)C)cc1	ZINC000455804950	331177979	/nfs/dbraw/zinc/17/79/79/331177979.db2.gz	WOXIOAXQCBBGCK-AWEZNQCLSA-N	0	0	288.391	4.002	20	30		CIEDRN
C=CCN(C(=O)Nc1ccc(CSCC)cc1)C1CC1	ZINC000455866208	331179145	/nfs/dbraw/zinc/17/91/45/331179145.db2.gz	SZZDNJBNJQUKOI-UHFFFAOYSA-N	0	0	290.432	4.122	20	30		CIEDRN
CCC[C@]1(C)CCCN(C(=O)Nc2cccc(CC#N)c2)C1	ZINC000455926702	331181291	/nfs/dbraw/zinc/18/12/91/331181291.db2.gz	YUPGVPQEJSRUCI-GOSISDBHSA-N	0	0	299.418	4.187	20	30		CIEDRN
CC(C)[C@@H]1CCCN(C(=O)Nc2cccc(CC#N)c2)CC1	ZINC000455925528	331181308	/nfs/dbraw/zinc/18/13/08/331181308.db2.gz	XLZFHHJBNXKTTL-MRXNPFEDSA-N	0	0	299.418	4.043	20	30		CIEDRN
CCC1(NC(=O)c2cc(C#N)ccc2Cl)CCCCC1	ZINC000456240080	331186921	/nfs/dbraw/zinc/18/69/21/331186921.db2.gz	WMLOKWVCPPSWSP-UHFFFAOYSA-N	0	0	290.794	4.054	20	30		CIEDRN
C=C[C@H](CC(=O)NC12CCC(CC1)CC2)c1ccccc1	ZINC000456290375	331189157	/nfs/dbraw/zinc/18/91/57/331189157.db2.gz	VXKMCNREEXXDMA-KOHRHEQBSA-N	0	0	283.415	4.185	20	30		CIEDRN
C=CCC1(NC(=O)c2sccc2Cl)CCCCC1	ZINC000456360005	331190853	/nfs/dbraw/zinc/19/08/53/331190853.db2.gz	DAQLHQGAIONLLV-UHFFFAOYSA-N	0	0	283.824	4.410	20	30		CIEDRN
C=CCC1(NC(=O)CCc2cccs2)CCCCC1	ZINC000456382607	331191834	/nfs/dbraw/zinc/19/18/34/331191834.db2.gz	NYTMCFPCFBRBMP-UHFFFAOYSA-N	0	0	277.433	4.076	20	30		CIEDRN
C=CCC1(CNC(=O)CCCC[C@H](C)C(C)=O)CCCC1	ZINC000456487330	331193856	/nfs/dbraw/zinc/19/38/56/331193856.db2.gz	OQNIFGCTPMWMNX-HNNXBMFYSA-N	0	0	293.451	4.025	20	30		CIEDRN
C=CCC1(CNC(=O)CCCC[C@@H](C)C(C)=O)CCCC1	ZINC000456487331	331193864	/nfs/dbraw/zinc/19/38/64/331193864.db2.gz	OQNIFGCTPMWMNX-OAHLLOKOSA-N	0	0	293.451	4.025	20	30		CIEDRN
CC[C@@H](CC(=O)Nc1cccc(CC#N)c1)c1ccccc1	ZINC000456724188	331199174	/nfs/dbraw/zinc/19/91/74/331199174.db2.gz	FUNOXORQYZOLSS-INIZCTEOSA-N	0	0	292.382	4.275	20	30		CIEDRN
CC[C@H](CC(=O)Nc1cccc(CC#N)c1)c1ccccc1	ZINC000456724190	331199230	/nfs/dbraw/zinc/19/92/30/331199230.db2.gz	FUNOXORQYZOLSS-MRXNPFEDSA-N	0	0	292.382	4.275	20	30		CIEDRN
CCC1(C(=O)Nc2cccc(CC#N)c2)CCCCC1	ZINC000456743434	331199775	/nfs/dbraw/zinc/19/97/75/331199775.db2.gz	GEVZQQJHBZRHAM-UHFFFAOYSA-N	0	0	270.376	4.052	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N[C@H](C)C1CCCC1	ZINC000456776983	331202944	/nfs/dbraw/zinc/20/29/44/331202944.db2.gz	XJLTVKFPMDWBQL-CYBMUJFWSA-N	0	0	289.444	4.273	20	30		CIEDRN
C=CCCCC(=O)NC1(C(C)(C)c2ccc(F)cc2)CC1	ZINC000456784319	331203726	/nfs/dbraw/zinc/20/37/26/331203726.db2.gz	UXKNTVNUURQURL-UHFFFAOYSA-N	0	0	289.394	4.108	20	30		CIEDRN
C=C(CC)CNC(=O)[C@@H](C)c1ccc2cc(OC)ccc2c1	ZINC000456810432	331204774	/nfs/dbraw/zinc/20/47/74/331204774.db2.gz	FTTHERZCFFYZCP-AWEZNQCLSA-N	0	0	297.398	4.034	20	30		CIEDRN
C=C(CC)CNC(=O)c1cc(Cl)ccc1SCC	ZINC000456812608	331205143	/nfs/dbraw/zinc/20/51/43/331205143.db2.gz	NQHCBXYKCMJZDV-UHFFFAOYSA-N	0	0	283.824	4.148	20	30		CIEDRN
CCC(CC)c1cc(C(=O)Nc2cc(C)cc(C#N)c2)on1	ZINC000456932132	331208811	/nfs/dbraw/zinc/20/88/11/331208811.db2.gz	AHJCFHZBPSZILF-UHFFFAOYSA-N	0	0	297.358	4.011	20	30		CIEDRN
CC(C)c1nccc(N[C@@H](CCC#N)c2ccccc2)n1	ZINC000164349721	331209367	/nfs/dbraw/zinc/20/93/67/331209367.db2.gz	NPYMWOHXVVOROV-HNNXBMFYSA-N	0	0	280.375	4.057	20	30		CIEDRN
C=CCCOCCCCC(=O)N[C@@H](C)[C@H]1CCC[C@@H](C)C1	ZINC000456997409	331209787	/nfs/dbraw/zinc/20/97/87/331209787.db2.gz	ITJQLBGYIMXKKB-IKGGRYGDSA-N	0	0	295.467	4.080	20	30		CIEDRN
C=CCCOCCCCC(=O)N[C@@H](C)[C@H]1CCC[C@H](C)C1	ZINC000456997411	331209790	/nfs/dbraw/zinc/20/97/90/331209790.db2.gz	ITJQLBGYIMXKKB-ULQDDVLXSA-N	0	0	295.467	4.080	20	30		CIEDRN
C=CCCC(=O)N[C@@H]1CC[C@H](c2cccc(Cl)c2)C1	ZINC000457052849	331210980	/nfs/dbraw/zinc/21/09/80/331210980.db2.gz	ATHBGEAVKFXMHU-DZGCQCFKSA-N	0	0	277.795	4.059	20	30		CIEDRN
C=CC(C)(C)C(=O)N[C@@H]1CC[C@@H](c2cccc(Cl)c2)C1	ZINC000457066117	331211216	/nfs/dbraw/zinc/21/12/16/331211216.db2.gz	GSOUQPNJCRRWAT-UKRRQHHQSA-N	0	0	291.822	4.305	20	30		CIEDRN
C=CCC1(C(=O)NCCC2CC(F)(F)C2)CCCCC1	ZINC000457185732	331214458	/nfs/dbraw/zinc/21/44/58/331214458.db2.gz	NJZWXMWTOVYWSX-UHFFFAOYSA-N	0	0	285.378	4.065	20	30		CIEDRN
C[C@@H](CC(C)(C)C)NC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000457194148	331214959	/nfs/dbraw/zinc/21/49/59/331214959.db2.gz	OGWFGAJYCJEABL-ZDUSSCGKSA-N	0	0	286.419	4.042	20	30		CIEDRN
C[C@@H](CC(C)(C)C)NC(=O)C[C@H](CC#N)c1ccccc1	ZINC000457195419	331215014	/nfs/dbraw/zinc/21/50/14/331215014.db2.gz	QEADOLNRZNVXKM-HOCLYGCPSA-N	0	0	286.419	4.015	20	30		CIEDRN
CC[C@]1(C(C)C)C[C@@H]1NC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000457308571	331218593	/nfs/dbraw/zinc/21/85/93/331218593.db2.gz	WKTOKOGAENFTMM-ZIFCJYIRSA-N	0	0	298.430	4.015	20	30		CIEDRN
C=CCN(Cc1ccccc1F)C(=O)[C@@H](CC)CC(F)F	ZINC000457483578	331224418	/nfs/dbraw/zinc/22/44/18/331224418.db2.gz	FWVZSEPKHQLCNI-LBPRGKRZSA-N	0	0	299.336	4.022	20	30		CIEDRN
C[C@H](C(=O)Nc1ccccc1SCCC#N)C1CCC1	ZINC000457555690	331226752	/nfs/dbraw/zinc/22/67/52/331226752.db2.gz	UDBPFIYXCMFLKD-LBPRGKRZSA-N	0	0	288.416	4.067	20	30		CIEDRN
C=CCC[C@@H](NC(=O)[C@H](C)CC(F)(F)F)c1ccccc1	ZINC000457674002	331230836	/nfs/dbraw/zinc/23/08/36/331230836.db2.gz	MEIRDCXKHJBIOU-TZMCWYRMSA-N	0	0	299.336	4.399	20	30		CIEDRN
CC(C)(C)C1CC(C(=O)N[C@H](CCC#N)c2ccccc2)C1	ZINC000457678388	331230961	/nfs/dbraw/zinc/23/09/61/331230961.db2.gz	ZXSPXNWXBMYMHL-OFLPRAFFSA-N	0	0	298.430	4.220	20	30		CIEDRN
C=C(C)[C@H](NC(=O)[C@H](C)C1CCC1)c1ccc(F)c(F)c1	ZINC000457719251	331232256	/nfs/dbraw/zinc/23/22/56/331232256.db2.gz	QRSZSWBDAOYMBJ-BZNIZROVSA-N	0	0	293.357	4.134	20	30		CIEDRN
Cc1cc(NCC(C)(C)CCC#N)ccc1Br	ZINC000164450718	331234205	/nfs/dbraw/zinc/23/42/05/331234205.db2.gz	ORHVXWZQAOTXIN-UHFFFAOYSA-N	0	0	295.224	4.499	20	30		CIEDRN
C=C(C)[C@H]1OCCC[C@H]1C(=O)Nc1ccc(/C=C/C)cc1	ZINC000457809573	331235088	/nfs/dbraw/zinc/23/50/88/331235088.db2.gz	OWDSXNUTLKLMJC-TZNLOLHFSA-N	0	0	285.387	4.030	20	30		CIEDRN
C=CC(C)(C)CNC(=O)c1ccc(OC(C)C)cc1Cl	ZINC000457834746	331235964	/nfs/dbraw/zinc/23/59/64/331235964.db2.gz	SDYJKLNIOQIMFW-UHFFFAOYSA-N	0	0	295.810	4.069	20	30		CIEDRN
N#CCCCC(=O)N1CC2(CCCCC2)[C@H]1c1ccccc1	ZINC000458121320	331243355	/nfs/dbraw/zinc/24/33/55/331243355.db2.gz	HQGUJJBLGAJKAN-GOSISDBHSA-N	0	0	296.414	4.214	20	30		CIEDRN
CCC[C@H](NC(=O)[C@@H](C)c1cccc(C#N)c1)C1CCCC1	ZINC000458314885	331248291	/nfs/dbraw/zinc/24/82/91/331248291.db2.gz	DALKNURXZODNBU-KSSFIOAISA-N	0	0	298.430	4.137	20	30		CIEDRN
CCC[C@H](NC(=O)C[C@H](CC#N)c1ccccc1)C1CCC1	ZINC000458333299	331249105	/nfs/dbraw/zinc/24/91/05/331249105.db2.gz	OOISRZBZKSELMB-ROUUACIJSA-N	0	0	298.430	4.159	20	30		CIEDRN
CC[C@H]1CCCN1C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000458798608	331259975	/nfs/dbraw/zinc/25/99/75/331259975.db2.gz	IFUQGSUBRLGMCC-DLBZAZTESA-N	0	0	299.418	4.006	20	30		CIEDRN
CCCN(C(=O)N[C@@H](CCCC#N)c1ccccc1)C1CC1	ZINC000458803254	331260144	/nfs/dbraw/zinc/26/01/44/331260144.db2.gz	QUWFECFDCXVXQH-KRWDZBQOSA-N	0	0	299.418	4.006	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)N(Cc1cccs1)C1CC1	ZINC000458806913	331260377	/nfs/dbraw/zinc/26/03/77/331260377.db2.gz	DQXLZOZYNYMKLE-UHFFFAOYSA-N	0	0	292.448	4.024	20	30		CIEDRN
C=CC(C)(C)CNC(=O)N(CC)[C@@H](C)c1ccc(F)cc1	ZINC000458982578	331263567	/nfs/dbraw/zinc/26/35/67/331263567.db2.gz	BKSGASJHYRNFAZ-ZDUSSCGKSA-N	0	0	292.398	4.130	20	30		CIEDRN
CCCCc1ccc(NC(=O)NCC(C)(C)CC#N)cc1	ZINC000459237553	331272590	/nfs/dbraw/zinc/27/25/90/331272590.db2.gz	SITLHSWWOCIODB-UHFFFAOYSA-N	0	0	287.407	4.091	20	30		CIEDRN
CN(C(=O)Nc1ccc(C(C)(C)C#N)cc1)C1CC(C)(C)C1	ZINC000459345592	331277278	/nfs/dbraw/zinc/27/72/78/331277278.db2.gz	NXUUQWOCDVSHKI-UHFFFAOYSA-N	0	0	299.418	4.140	20	30		CIEDRN
N#C[C@H]1CCC[C@H]1NCc1ccc(-c2ccsc2)cc1	ZINC000459452312	331281944	/nfs/dbraw/zinc/28/19/44/331281944.db2.gz	BLJAQORRASWMHI-NVXWUHKLSA-N	0	0	282.412	4.197	20	30		CIEDRN
C=CCOc1cccc(CN2CC(C)(CC(F)(F)F)C2)c1	ZINC000459641552	331291772	/nfs/dbraw/zinc/29/17/72/331291772.db2.gz	REXLDHFKXTWVPX-UHFFFAOYSA-N	0	0	299.336	4.026	20	30		CIEDRN
Cc1sc(NC(=O)[C@@]2(C)CCC[C@H]2C)c(C#N)c1C	ZINC000459848468	331302635	/nfs/dbraw/zinc/30/26/35/331302635.db2.gz	ZKLGZHMOJZCPCY-PSLIRLAXSA-N	0	0	276.405	4.001	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)C(C)(C)C=C	ZINC000459886303	331302960	/nfs/dbraw/zinc/30/29/60/331302960.db2.gz	JEPVPEGKBZQYOW-UHFFFAOYSA-N	0	0	283.824	4.128	20	30		CIEDRN
CC[C@@H](C)N(Cc1ccccc1)C(=O)c1cscc1C#N	ZINC000459897912	331303106	/nfs/dbraw/zinc/30/31/06/331303106.db2.gz	YVOFJTKFPABJOO-CYBMUJFWSA-N	0	0	298.411	4.061	20	30		CIEDRN
CCCC(CCC)C(=O)N(Cc1ccc(C#N)cc1)C1CC1	ZINC000459947559	331303722	/nfs/dbraw/zinc/30/37/22/331303722.db2.gz	NZVQKTKZTKOENN-UHFFFAOYSA-N	0	0	298.430	4.266	20	30		CIEDRN
N#Cc1ccc(CNc2cc(Cl)cc(Cl)c2)o1	ZINC000164836641	331305348	/nfs/dbraw/zinc/30/53/48/331305348.db2.gz	KJLFWKMWMGZNLC-UHFFFAOYSA-N	0	0	267.115	4.070	20	30		CIEDRN
COc1cccc(Cl)c1CNc1ccc(CC#N)cc1	ZINC000166231695	331306826	/nfs/dbraw/zinc/30/68/26/331306826.db2.gz	BRTVGEGPKAVEBO-UHFFFAOYSA-N	0	0	286.762	4.027	20	30		CIEDRN
CCC1(C(=O)Nc2cccc(C#N)c2C)CCCCC1	ZINC000461019532	331310553	/nfs/dbraw/zinc/31/05/53/331310553.db2.gz	ALGLPWPQBYLRLX-UHFFFAOYSA-N	0	0	270.376	4.166	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)C1(CC)CCCCC1	ZINC000461094700	331311409	/nfs/dbraw/zinc/31/14/09/331311409.db2.gz	MZGHSRUPOPGXEI-CQSZACIVSA-N	0	0	251.414	4.208	20	30		CIEDRN
C[C@H]1C[C@H](C)CN(c2c(C#N)cnc3ccc(Cl)cc32)C1	ZINC000461467320	331313573	/nfs/dbraw/zinc/31/35/73/331313573.db2.gz	ZNOTUIICBLWYHL-RYUDHWBXSA-N	0	0	299.805	4.242	20	30		CIEDRN
CCc1cc(C(=O)N(CC)c2ccc(C#N)cc2)sc1C	ZINC000461523223	331313644	/nfs/dbraw/zinc/31/36/44/331313644.db2.gz	MNDFRTHIFWMHMB-UHFFFAOYSA-N	0	0	298.411	4.157	20	30		CIEDRN
C[C@H](CO)CSCc1ccc(-c2ccccc2C#N)cc1	ZINC000461544172	331313781	/nfs/dbraw/zinc/31/37/81/331313781.db2.gz	HOKDNSIOYSCSLB-CQSZACIVSA-N	0	0	297.423	4.087	20	30		CIEDRN
C=C1CCN(C(=O)[C@@H](CC)C2CCC(C)CC2)CC1	ZINC000461656621	331313980	/nfs/dbraw/zinc/31/39/80/331313980.db2.gz	BQEVMCVRNLXOAD-BCLQGDPASA-N	0	0	263.425	4.018	20	30		CIEDRN
Cc1nc(N2CCC[C@@H]2c2ccccc2)c(Cl)cc1C#N	ZINC000461731104	331314172	/nfs/dbraw/zinc/31/41/72/331314172.db2.gz	ONVSPKDKZBEGNL-MRXNPFEDSA-N	0	0	297.789	4.257	20	30		CIEDRN
Cc1nc(NCc2cc3ccccc3[nH]2)c(Cl)cc1C#N	ZINC000461770598	331314588	/nfs/dbraw/zinc/31/45/88/331314588.db2.gz	BEUNKMKLASMZFC-UHFFFAOYSA-N	0	0	296.761	4.009	20	30		CIEDRN
Cc1ccc(Oc2ccc(NC(=O)CCCC#N)cc2)cc1	ZINC000461794777	331314747	/nfs/dbraw/zinc/31/47/47/331314747.db2.gz	HWAFBIFKRXVZKQ-UHFFFAOYSA-N	0	0	294.354	4.420	20	30		CIEDRN
CCCCN(CCCC)C(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000461898940	331315234	/nfs/dbraw/zinc/31/52/34/331315234.db2.gz	ADUYLNSGEXOJAA-HNNXBMFYSA-N	0	0	286.419	4.091	20	30		CIEDRN
CCCCCN(C(=O)N[C@@H]1CCC[C@@H]1C#N)[C@H](C)CCC	ZINC000461961661	331316312	/nfs/dbraw/zinc/31/63/12/331316312.db2.gz	BHURGMDTQDTHCI-BZUAXINKSA-N	0	0	293.455	4.069	20	30		CIEDRN
CCCC[C@@H]1CCC[C@@H]1NC(=O)[C@H](C)c1cccc(C#N)c1	ZINC000462021376	331316850	/nfs/dbraw/zinc/31/68/50/331316850.db2.gz	VNSKNEJOCDWOTC-KYJSFNMBSA-N	0	0	298.430	4.137	20	30		CIEDRN
N#CCCCC(=O)NCC1(C2CCCCC2)CCCCC1	ZINC000462269286	331318854	/nfs/dbraw/zinc/31/88/54/331318854.db2.gz	NFWXLQSPEJQMSX-UHFFFAOYSA-N	0	0	290.451	4.327	20	30		CIEDRN
CC1(C)CC(C)(C)c2cc(NC(=O)CCCC#N)ccc21	ZINC000462271696	331318859	/nfs/dbraw/zinc/31/88/59/331318859.db2.gz	XJGAOALMMLDPIG-UHFFFAOYSA-N	0	0	284.403	4.278	20	30		CIEDRN
CC#CCCSCc1csc(Cc2ccccc2)n1	ZINC000462363129	331320442	/nfs/dbraw/zinc/32/04/42/331320442.db2.gz	XHSSGHUREPWCLZ-UHFFFAOYSA-N	0	0	287.453	4.381	20	30		CIEDRN
CC#CCCSCc1csc(C(C)(C)C)n1	ZINC000462366369	331320550	/nfs/dbraw/zinc/32/05/50/331320550.db2.gz	RGPMYIANMMOAEN-UHFFFAOYSA-N	0	0	253.436	4.087	20	30		CIEDRN
CC#CCCSCc1csc(CCCC)n1	ZINC000462369634	331320675	/nfs/dbraw/zinc/32/06/75/331320675.db2.gz	KJEAVDSKGAPLIW-UHFFFAOYSA-N	0	0	253.436	4.132	20	30		CIEDRN
C=CCCC[C@H](C)Sc1nnc(SCC)s1	ZINC000462373405	331320781	/nfs/dbraw/zinc/32/07/81/331320781.db2.gz	WGEREHRJQNHTCU-VIFPVBQESA-N	0	0	274.480	4.487	20	30		CIEDRN
C=CCCC[C@H](C)Sc1nncc2ccccc21	ZINC000462391812	331321348	/nfs/dbraw/zinc/32/13/48/331321348.db2.gz	SURQQUATTVXDIG-LBPRGKRZSA-N	0	0	258.390	4.467	20	30		CIEDRN
C=CCCC[C@H](C)Sc1nc2nc(C)ccc2o1	ZINC000462405016	331321525	/nfs/dbraw/zinc/32/15/25/331321525.db2.gz	AUCKYOMINRDBQM-NSHDSACASA-N	0	0	262.378	4.368	20	30		CIEDRN
C=CCOc1ccc(OCc2cc(-c3ccco3)on2)cc1	ZINC000462671040	331324863	/nfs/dbraw/zinc/32/48/63/331324863.db2.gz	ZMHWSGJOSONOMV-UHFFFAOYSA-N	0	0	297.310	4.078	20	30		CIEDRN
Cc1cccc(-c2noc([C@@H](C)c3cccc(C#N)c3)n2)c1	ZINC000462825724	331331485	/nfs/dbraw/zinc/33/14/85/331331485.db2.gz	KVULMDGNOYIBPS-ZDUSSCGKSA-N	0	0	289.338	4.069	20	30		CIEDRN
C[C@H](c1nc([C@H]2CCC[C@@H](C)C2)no1)c1cccc(C#N)c1	ZINC000462830071	331331868	/nfs/dbraw/zinc/33/18/68/331331868.db2.gz	STICURVVMPTUDN-WWGRRREGSA-N	0	0	295.386	4.387	20	30		CIEDRN
C[C@@H](c1nc([C@H]2CCC[C@@H](C)C2)no1)c1cccc(C#N)c1	ZINC000462830070	331331893	/nfs/dbraw/zinc/33/18/93/331331893.db2.gz	STICURVVMPTUDN-IOASZLSFSA-N	0	0	295.386	4.387	20	30		CIEDRN
C=CCOc1ccccc1CNc1ccnc2ccsc21	ZINC000462834555	331332146	/nfs/dbraw/zinc/33/21/46/331332146.db2.gz	LRWTUFWYKZAMKP-UHFFFAOYSA-N	0	0	296.395	4.473	20	30		CIEDRN
C=CCOc1ccccc1CNc1c(Cl)cccc1C#N	ZINC000462840695	331332250	/nfs/dbraw/zinc/33/22/50/331332250.db2.gz	XIPKNULJJNRSAZ-UHFFFAOYSA-N	0	0	298.773	4.389	20	30		CIEDRN
CC(C)c1ccccc1OCCNc1ccc(F)cc1C#N	ZINC000462844562	331332473	/nfs/dbraw/zinc/33/24/73/331332473.db2.gz	ZSRWZYRDQDWXCH-UHFFFAOYSA-N	0	0	298.361	4.312	20	30		CIEDRN
Cc1cccc([C@@H](C)Nc2ccc(F)cc2C#N)c1C	ZINC000462845836	331332518	/nfs/dbraw/zinc/33/25/18/331332518.db2.gz	PJHUDRXKOQBCDH-CYBMUJFWSA-N	0	0	268.335	4.487	20	30		CIEDRN
C=CCCCCCN(C)c1cncc(Br)c1	ZINC000462859017	331332872	/nfs/dbraw/zinc/33/28/72/331332872.db2.gz	BVDLICDWDWRELC-UHFFFAOYSA-N	0	0	283.213	4.027	20	30		CIEDRN
N#Cc1cc(N[C@H]2C[C@H]2Cc2ccccc2)nc2ccccc12	ZINC000462870560	331333377	/nfs/dbraw/zinc/33/33/77/331333377.db2.gz	KEZSXCXUFGQTBN-BEFAXECRSA-N	0	0	299.377	4.150	20	30		CIEDRN
CCC(CC)(CNc1ncccc1C#N)c1ccccc1	ZINC000462947350	331335609	/nfs/dbraw/zinc/33/56/09/331335609.db2.gz	LPTBPGWAQUXWBA-UHFFFAOYSA-N	0	0	279.387	4.123	20	30		CIEDRN
CC[C@@]1(C)CCCN(c2cc(C#N)c3ccccc3n2)C1	ZINC000462945161	331335712	/nfs/dbraw/zinc/33/57/12/331335712.db2.gz	HIUSRORCUOXMNM-SFHVURJKSA-N	0	0	279.387	4.123	20	30		CIEDRN
C[C@H](CNc1ccc(C#N)cc1)Oc1ccc(Cl)cc1	ZINC000462951779	331335772	/nfs/dbraw/zinc/33/57/72/331335772.db2.gz	HSXBEOZXZGKDNR-GFCCVEGCSA-N	0	0	286.762	4.091	20	30		CIEDRN
C[C@H](CNc1cccc(F)c1C#N)c1ccc(F)cc1F	ZINC000463027116	331337470	/nfs/dbraw/zinc/33/74/70/331337470.db2.gz	CFSLZHSIVCWZNX-SNVBAGLBSA-N	0	0	290.288	4.191	20	30		CIEDRN
C=CCn1c(SCCC(C)(C)CC)nnc1C1CC1	ZINC000463043617	331338350	/nfs/dbraw/zinc/33/83/50/331338350.db2.gz	ODZRQXSNLBLSHG-UHFFFAOYSA-N	0	0	279.453	4.260	20	30		CIEDRN
Cc1cscc1-c1noc([C@H](C)c2cccc(C#N)c2)n1	ZINC000463048949	331338577	/nfs/dbraw/zinc/33/85/77/331338577.db2.gz	PDKZBPLJEAXDBJ-LLVKDONJSA-N	0	0	295.367	4.130	20	30		CIEDRN
C[C@H](c1nc(-c2ccc(Cl)o2)no1)c1cccc(C#N)c1	ZINC000463048824	331338596	/nfs/dbraw/zinc/33/85/96/331338596.db2.gz	OQEFUUAVEMQSTN-VIFPVBQESA-N	0	0	299.717	4.006	20	30		CIEDRN
C[C@@H](c1nc([C@@H]2CCCC[C@H]2C)no1)c1cccc(C#N)c1	ZINC000463052258	331338706	/nfs/dbraw/zinc/33/87/06/331338706.db2.gz	FAMCCPGBMCNVOY-XJKCOSOUSA-N	0	0	295.386	4.387	20	30		CIEDRN
C[C@@H](c1nc([C@@H](C)C(C)(C)C)no1)c1cccc(C#N)c1	ZINC000463054969	331338787	/nfs/dbraw/zinc/33/87/87/331338787.db2.gz	LSIZAZGEITYUIO-VXGBXAGGSA-N	0	0	283.375	4.243	20	30		CIEDRN
C[C@@H](c1nc([C@H](C)C(C)(C)C)no1)c1cccc(C#N)c1	ZINC000463054954	331338844	/nfs/dbraw/zinc/33/88/44/331338844.db2.gz	LSIZAZGEITYUIO-NEPJUHHUSA-N	0	0	283.375	4.243	20	30		CIEDRN
CCc1cccc(C)c1NC(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000463068141	331339177	/nfs/dbraw/zinc/33/91/77/331339177.db2.gz	GKZHKNNVJVYFDI-AWEZNQCLSA-N	0	0	292.382	4.171	20	30		CIEDRN
Cc1ccc([C@@H]2CCC[C@H]2N(C)c2ncccc2C#N)cc1	ZINC000463070485	331339293	/nfs/dbraw/zinc/33/92/93/331339293.db2.gz	NYTBROFUTLNHLR-ZWKOTPCHSA-N	0	0	291.398	4.034	20	30		CIEDRN
Cc1cc(C)c(C#N)c(NC[C@H](C)Sc2ccccc2)n1	ZINC000463077438	331339729	/nfs/dbraw/zinc/33/97/29/331339729.db2.gz	IUEFZEQFCGAAMT-AWEZNQCLSA-N	0	0	297.427	4.163	20	30		CIEDRN
Cc1ccc(CC[C@H](C)Nc2cccc(F)c2C#N)o1	ZINC000463078376	331339869	/nfs/dbraw/zinc/33/98/69/331339869.db2.gz	XBRMAIIVSIBQAI-NSHDSACASA-N	0	0	272.323	4.032	20	30		CIEDRN
CC1(C)CC(Cc2noc(/C=C/c3cccc(C#N)c3)n2)C1	ZINC000463169721	331341417	/nfs/dbraw/zinc/34/14/17/331341417.db2.gz	DIPVHCWWIVRAIQ-VOTSOKGWSA-N	0	0	293.370	4.090	20	30		CIEDRN
C[C@@H](c1nc(CC2CC(C)(C)C2)no1)c1cccc(C#N)c1	ZINC000463179676	331341565	/nfs/dbraw/zinc/34/15/65/331341565.db2.gz	GWBDOHDYXCLAFF-GFCCVEGCSA-N	0	0	295.386	4.072	20	30		CIEDRN
CC1(C)CC(Cc2noc(/C=C/c3ccc(C#N)cc3)n2)C1	ZINC000463185508	331341685	/nfs/dbraw/zinc/34/16/85/331341685.db2.gz	XJYVOYAHCGBUPW-BQYQJAHWSA-N	0	0	293.370	4.090	20	30		CIEDRN
CCc1ccc(CC)c(N[C@H]2CCC[C@@H](C#N)C2)c1	ZINC000463278924	331344283	/nfs/dbraw/zinc/34/42/83/331344283.db2.gz	FBITXRGXAKAPJP-ZBFHGGJFSA-N	0	0	256.393	4.306	20	30		CIEDRN
C=CCN(CC=C)C(=O)C(C)(C)Cc1cccc(Cl)c1	ZINC000463279082	331344913	/nfs/dbraw/zinc/34/49/13/331344913.db2.gz	OUPOKSMGAQGZGX-UHFFFAOYSA-N	0	0	291.822	4.109	20	30		CIEDRN
C=CCN(C(=O)N[C@H]1c2ccccc2CCC[C@@H]1C)C1CC1	ZINC000463284062	331345108	/nfs/dbraw/zinc/34/51/08/331345108.db2.gz	GQVFTUYGBPJILW-KBXCAEBGSA-N	0	0	298.430	4.060	20	30		CIEDRN
Cc1ccc(N[C@@H]2CCC[C@H](C#N)C2)cc1Br	ZINC000463288252	331345327	/nfs/dbraw/zinc/34/53/27/331345327.db2.gz	ZSRLMOWSSFCNAU-NWDGAFQWSA-N	0	0	293.208	4.252	20	30		CIEDRN
CCCCOc1ccccc1N[C@@H]1CCC[C@H](C#N)C1	ZINC000463290706	331345470	/nfs/dbraw/zinc/34/54/70/331345470.db2.gz	UCLRDVMKFJHQDM-LSDHHAIUSA-N	0	0	272.392	4.360	20	30		CIEDRN
CCCCN(C(=O)[C@@H](C)c1cccc(C#N)c1)[C@@H](C)CC	ZINC000463343044	331346341	/nfs/dbraw/zinc/34/63/41/331346341.db2.gz	AHTMDBBXYUBPHX-GJZGRUSLSA-N	0	0	286.419	4.089	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1cccc(C2CCC2)c1	ZINC000463838334	331352348	/nfs/dbraw/zinc/35/23/48/331352348.db2.gz	RLPWSDOLJRPONH-UHFFFAOYSA-N	0	0	272.392	4.384	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CC(C)(CC)C1	ZINC000463916868	331353850	/nfs/dbraw/zinc/35/38/50/331353850.db2.gz	BWAJXPLHYATUSB-UHFFFAOYSA-N	0	0	272.392	4.069	20	30		CIEDRN
CC[C@H](C(=O)N(CC)c1ccc(C#N)cc1)c1ccccc1	ZINC000463960640	331354741	/nfs/dbraw/zinc/35/47/41/331354741.db2.gz	WXZVPRNASCOFCL-SFHVURJKSA-N	0	0	292.382	4.105	20	30		CIEDRN
CC(C)C[C@@](C)(C#N)NC(=O)c1ccc(C2=CCCC2)cc1	ZINC000464135426	331357026	/nfs/dbraw/zinc/35/70/26/331357026.db2.gz	JOFQIHITAKZFED-IBGZPJMESA-N	0	0	296.414	4.312	20	30		CIEDRN
CC(C)C[C@@](C)(C#N)NC(=O)c1ccc(C2CCCC2)cc1	ZINC000464137942	331357050	/nfs/dbraw/zinc/35/70/50/331357050.db2.gz	OLNLHKQFNXSYMI-IBGZPJMESA-N	0	0	298.430	4.402	20	30		CIEDRN
C[C@H](CC1CCCCC1)C(=O)N[C@](C)(C#N)C(C)(C)C	ZINC000464158095	331357307	/nfs/dbraw/zinc/35/73/07/331357307.db2.gz	MAKCTTXOZYLZRV-CXAGYDPISA-N	0	0	278.440	4.037	20	30		CIEDRN
CC(C)(C)[C@@](C)(C#N)NC(=O)CCCC1CCCCC1	ZINC000464166854	331357347	/nfs/dbraw/zinc/35/73/47/331357347.db2.gz	IULGMDUUZGLJBN-QGZVFWFLSA-N	0	0	278.440	4.182	20	30		CIEDRN
CC(C)(C)[C@](C)(C#N)NC(=O)C[C@H]1CCCCC1(C)C	ZINC000464162516	331357395	/nfs/dbraw/zinc/35/73/95/331357395.db2.gz	NEKVBVRLJMUZPH-DYVFJYSZSA-N	0	0	278.440	4.037	20	30		CIEDRN
CC(C)(C)c1ccc(C(=O)N[C@@](C)(C#N)C(C)(C)C)s1	ZINC000464169919	331357444	/nfs/dbraw/zinc/35/74/44/331357444.db2.gz	NEGSPMOOQBNFEC-INIZCTEOSA-N	0	0	292.448	4.104	20	30		CIEDRN
CC#CCCCC(=O)N(Cc1ccccc1)CC(C)(C)C	ZINC000464435639	331360466	/nfs/dbraw/zinc/36/04/66/331360466.db2.gz	FVONYGFVDMZERE-UHFFFAOYSA-N	0	0	285.431	4.255	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC)[C@H](C)c1ccc(F)cc1	ZINC000464435418	331360479	/nfs/dbraw/zinc/36/04/79/331360479.db2.gz	DAWXCVJJVIDWON-ZIAGYGMSSA-N	0	0	277.383	4.338	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](CC(F)(F)F)c1ccccc1	ZINC000464435167	331360493	/nfs/dbraw/zinc/36/04/93/331360493.db2.gz	CLOAIANIUPXCDI-GXTWGEPZSA-N	0	0	299.336	4.399	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC1CCCCC1)C1CC1	ZINC000464440510	331360695	/nfs/dbraw/zinc/36/06/95/331360695.db2.gz	WWUXHDYTHQMPOI-AWEZNQCLSA-N	0	0	263.425	4.160	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccc(Oc2ccccc2)nc1	ZINC000464443266	331360810	/nfs/dbraw/zinc/36/08/10/331360810.db2.gz	ZTZMILVVYYGFST-UHFFFAOYSA-N	0	0	294.354	4.006	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CCC[C@H]1CCCC	ZINC000464443537	331360818	/nfs/dbraw/zinc/36/08/18/331360818.db2.gz	RLTFBIJOESFEJD-RRFJBIMHSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCCC[C@@H]1Cc1ccccc1	ZINC000464447991	331360873	/nfs/dbraw/zinc/36/08/73/331360873.db2.gz	UXIYMZSMIKRSQC-SJLPKXTDSA-N	0	0	285.431	4.213	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)c1cccc2ccccc21	ZINC000464450006	331360904	/nfs/dbraw/zinc/36/09/04/331360904.db2.gz	LPRLDXYMZPKTFM-CQSZACIVSA-N	0	0	267.372	4.405	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC)Cc1cccc(Cl)c1	ZINC000464553226	331362372	/nfs/dbraw/zinc/36/23/72/331362372.db2.gz	REYPNWIDZRKAPN-CYBMUJFWSA-N	0	0	279.811	4.291	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CC[C@@H]2CCCC[C@H]2C1	ZINC000464561345	331362587	/nfs/dbraw/zinc/36/25/87/331362587.db2.gz	TUUYPFASDBHXRX-YHUYYLMFSA-N	0	0	263.425	4.064	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCc1ccc(C(C)C)cc1	ZINC000464565212	331362698	/nfs/dbraw/zinc/36/26/98/331362698.db2.gz	BFTWNECMFVGWGP-CQSZACIVSA-N	0	0	259.393	4.029	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(CC(C)C)c1cccc(OC)c1	ZINC000464564281	331362692	/nfs/dbraw/zinc/36/26/92/331362692.db2.gz	CAVCGYMLTUABLN-HNNXBMFYSA-N	0	0	289.419	4.287	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccnn1[C@@H](C)CC(C)C	ZINC000464563418	331362737	/nfs/dbraw/zinc/36/27/37/331362737.db2.gz	JZZCVSUOKSQBOD-KGLIPLIRSA-N	0	0	277.412	4.031	20	30		CIEDRN
CCCC[C@@H](CC)C(=O)Nc1scc(C)c1C#N	ZINC000464580154	331363095	/nfs/dbraw/zinc/36/30/95/331363095.db2.gz	GAGUMRMEDRWFFU-LLVKDONJSA-N	0	0	264.394	4.083	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](C)c1ccccc1C(F)(F)F	ZINC000464651153	331364254	/nfs/dbraw/zinc/36/42/54/331364254.db2.gz	CWYSBDVORHVPKI-NEPJUHHUSA-N	0	0	299.336	4.485	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H]1CC(C)(C)C	ZINC000464650295	331364263	/nfs/dbraw/zinc/36/42/63/331364263.db2.gz	YFYJQYHFJMCWSL-KBPBESRZSA-N	0	0	251.414	4.016	20	30		CIEDRN
C[C@H]1CCN(Cc2ccc(F)cc2C#N)[C@@H](c2ccco2)C1	ZINC000464854819	331371364	/nfs/dbraw/zinc/37/13/64/331371364.db2.gz	RBRIMZBZFLMERM-SUMWQHHRSA-N	0	0	298.361	4.264	20	30		CIEDRN
C[C@@H]1CCN(Cc2cc(C#N)ccc2F)[C@H](c2ccco2)C1	ZINC000464855208	331371422	/nfs/dbraw/zinc/37/14/22/331371422.db2.gz	LLOVAQKSVVXHKU-DYVFJYSZSA-N	0	0	298.361	4.264	20	30		CIEDRN
C[C@H]1CCN(Cc2cc(C#N)ccc2F)[C@H](c2ccco2)C1	ZINC000464855209	331371511	/nfs/dbraw/zinc/37/15/11/331371511.db2.gz	LLOVAQKSVVXHKU-GUYCJALGSA-N	0	0	298.361	4.264	20	30		CIEDRN
C=CCCCCCN(C)C(=O)C1(CC)CCCC1	ZINC000464963435	331374524	/nfs/dbraw/zinc/37/45/24/331374524.db2.gz	FGEIVTKXPOLGBL-UHFFFAOYSA-N	0	0	251.414	4.162	20	30		CIEDRN
CCCN(Cc1ccc(C#N)cc1)C(=O)CC(C)(C)CC	ZINC000465039592	331376741	/nfs/dbraw/zinc/37/67/41/331376741.db2.gz	TWWIOXUGDBFBES-UHFFFAOYSA-N	0	0	286.419	4.123	20	30		CIEDRN
C=C[C@@H](C)NC(=O)CCCc1cc(Cl)sc1Cl	ZINC000465101387	331378347	/nfs/dbraw/zinc/37/83/47/331378347.db2.gz	GOZVCERVNBNNDH-MRVPVSSYSA-N	0	0	292.231	4.068	20	30		CIEDRN
C=C[C@H](C)NC(=O)c1cc(-c2ccc(F)cc2)c(C)s1	ZINC000465106569	331378569	/nfs/dbraw/zinc/37/85/69/331378569.db2.gz	FEENMSBUIDDILO-JTQLQIEISA-N	0	0	289.375	4.167	20	30		CIEDRN
C=C[C@H](C)NC(=O)c1cc(-c2ccccc2)ccc1Cl	ZINC000465111766	331378716	/nfs/dbraw/zinc/37/87/16/331378716.db2.gz	JHVUPZXGFSVSJP-LBPRGKRZSA-N	0	0	285.774	4.311	20	30		CIEDRN
C=C[C@@H](C)NC(=O)Nc1ccc(SC2CCCC2)cc1	ZINC000465154374	331379751	/nfs/dbraw/zinc/37/97/51/331379751.db2.gz	AQURADMCZOAOQN-GFCCVEGCSA-N	0	0	290.432	4.417	20	30		CIEDRN
C=C[C@@H](C)NC(=O)Nc1ccccc1-c1ccccc1	ZINC000465167321	331379977	/nfs/dbraw/zinc/37/99/77/331379977.db2.gz	OFYGHAJOIHSGMT-CYBMUJFWSA-N	0	0	266.344	4.050	20	30		CIEDRN
CC(C)CC1(CNC(=O)Nc2ccc(CC#N)cc2)CCC1	ZINC000465170117	331380159	/nfs/dbraw/zinc/38/01/59/331380159.db2.gz	QTHUMRSTNPPXPL-UHFFFAOYSA-N	0	0	299.418	4.091	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)N[C@@H](C)C[C@H](C)CC	ZINC000466176047	331390621	/nfs/dbraw/zinc/39/06/21/331390621.db2.gz	ZWAKYCXKFGARCV-CVEARBPZSA-N	0	0	288.435	4.209	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NC1(Cc2ccccc2)CCCC1	ZINC000466232687	331391348	/nfs/dbraw/zinc/39/13/48/331391348.db2.gz	FIBFAVKOUYTETO-INIZCTEOSA-N	0	0	285.431	4.260	20	30		CIEDRN
CC#CCCCC(=O)Nc1c(F)cc(Cl)c(C)c1F	ZINC000466235208	331391391	/nfs/dbraw/zinc/39/13/91/331391391.db2.gz	LZMWKZJMLDGAKM-UHFFFAOYSA-N	0	0	285.721	4.059	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cccc2ccsc21	ZINC000466255913	331391690	/nfs/dbraw/zinc/39/16/90/331391690.db2.gz	SLAVSMBKPGZRAR-NSHDSACASA-N	0	0	259.374	4.442	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1cc(F)c(OC(C)C)c(F)c1	ZINC000466262124	331391817	/nfs/dbraw/zinc/39/18/17/331391817.db2.gz	RHXYINVPNCGULR-LLVKDONJSA-N	0	0	297.345	4.293	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc2cccc(Cl)c2n1	ZINC000466269470	331391898	/nfs/dbraw/zinc/39/18/98/331391898.db2.gz	WRSFRRPZNDPQQU-LLVKDONJSA-N	0	0	288.778	4.429	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Cc1c(C)oc2ccccc21	ZINC000466267991	331391942	/nfs/dbraw/zinc/39/19/42/331391942.db2.gz	YWBANNVHUNPYEH-ZDUSSCGKSA-N	0	0	285.387	4.145	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCc2c1cccc2C(F)(F)F	ZINC000466304263	331392508	/nfs/dbraw/zinc/39/25/08/331392508.db2.gz	CCHWSZLISWTAKW-LLVKDONJSA-N	0	0	297.320	4.197	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](C)C2(CCCCC2)C1	ZINC000466314258	331392580	/nfs/dbraw/zinc/39/25/80/331392580.db2.gz	MKTPWIAEMKUELI-JKSUJKDBSA-N	0	0	277.452	4.408	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](C)C2(CCCCC2)C1	ZINC000466314256	331392650	/nfs/dbraw/zinc/39/26/50/331392650.db2.gz	MKTPWIAEMKUELI-HOTGVXAUSA-N	0	0	277.452	4.408	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(OCC)c2cccnc12	ZINC000466319815	331392759	/nfs/dbraw/zinc/39/27/59/331392759.db2.gz	VVMMZYXFZJXNOH-CYBMUJFWSA-N	0	0	298.386	4.174	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(Cc1ccccc1)[C@H](C)CC	ZINC000466321190	331392761	/nfs/dbraw/zinc/39/27/61/331392761.db2.gz	UGTNLJBJZINCEH-WBVHZDCISA-N	0	0	288.435	4.351	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CCC[C@@H]1c1ccccc1C	ZINC000466365800	331393568	/nfs/dbraw/zinc/39/35/68/331393568.db2.gz	ABLCHBOGWXAVNB-DOTOQJQBSA-N	0	0	286.419	4.196	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CC[C@@H](C)C[C@@H]1c1ccco1	ZINC000466367621	331393580	/nfs/dbraw/zinc/39/35/80/331393580.db2.gz	XJNGIANRWJFGMT-QLFBSQMISA-N	0	0	290.407	4.117	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1ccc(Cl)cc1C	ZINC000466367292	331393592	/nfs/dbraw/zinc/39/35/92/331393592.db2.gz	RYEOSHCJRNZEBA-LBPRGKRZSA-N	0	0	266.772	4.125	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(C1CC1)C1CCC(C)CC1	ZINC000466376056	331393808	/nfs/dbraw/zinc/39/38/08/331393808.db2.gz	CIRMCHFQSXFMEH-SHARSMKWSA-N	0	0	278.440	4.094	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N1CCC[C@H]1c1cccc(F)c1	ZINC000466380177	331394185	/nfs/dbraw/zinc/39/41/85/331394185.db2.gz	MDQOTVHUVHYLCH-CVEARBPZSA-N	0	0	290.382	4.027	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(C)Cc1cccc2ccccc21	ZINC000466383553	331394289	/nfs/dbraw/zinc/39/42/89/331394289.db2.gz	RCPBQMVTTDHHJR-KRWDZBQOSA-N	0	0	296.414	4.336	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N(Cc1ccc(F)cc1)C(C)C	ZINC000466386415	331394332	/nfs/dbraw/zinc/39/43/32/331394332.db2.gz	PNVDIRXADYWJNQ-INIZCTEOSA-N	0	0	292.398	4.100	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)Nc1ccccc1C(C)(C)C	ZINC000466385761	331394392	/nfs/dbraw/zinc/39/43/92/331394392.db2.gz	JOKZVGIUJDYLFR-CYBMUJFWSA-N	0	0	274.408	4.460	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(C)[C@H](C)c1ccc(C)cc1C	ZINC000466389933	331394502	/nfs/dbraw/zinc/39/45/02/331394502.db2.gz	RZGCFQRPGNTIOI-HZPDHXFCSA-N	0	0	288.435	4.361	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N(C)[C@H](C)c1c(F)cccc1F	ZINC000466402732	331395144	/nfs/dbraw/zinc/39/51/44/331395144.db2.gz	AGJNIJAUPAXBGB-VXGBXAGGSA-N	0	0	296.361	4.022	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)N1CCC[C@H]1c1cccc(C)c1	ZINC000466406332	331395427	/nfs/dbraw/zinc/39/54/27/331395427.db2.gz	SYOPZSODSXJPGQ-SJORKVTESA-N	0	0	286.419	4.196	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCC(CCC(C)C)CC1	ZINC000466418213	331396047	/nfs/dbraw/zinc/39/60/47/331396047.db2.gz	XALXUXXVSQJQLN-OAHLLOKOSA-N	0	0	265.441	4.264	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H](CCC)CCc1ccccc1	ZINC000466420291	331396138	/nfs/dbraw/zinc/39/61/38/331396138.db2.gz	YZSAPFFTFQZISP-SFHVURJKSA-N	0	0	285.431	4.098	20	30		CIEDRN
CC#CCCCC(=O)N[C@H](C)CCC1CCCCC1	ZINC000466420162	331396212	/nfs/dbraw/zinc/39/62/12/331396212.db2.gz	XCSFKYQQAZAXPA-OAHLLOKOSA-N	0	0	263.425	4.045	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccccc1N(C)C1CCCC1	ZINC000466428157	331396870	/nfs/dbraw/zinc/39/68/70/331396870.db2.gz	IYZVZVOKAQAMMY-UHFFFAOYSA-N	0	0	298.430	4.198	20	30		CIEDRN
CC#CCCCC(=O)NCC(CC)(CC)c1ccccc1	ZINC000466431477	331396968	/nfs/dbraw/zinc/39/69/68/331396968.db2.gz	OMEGOSVIYAGFPL-UHFFFAOYSA-N	0	0	285.431	4.054	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(C)[C@@H](C)Cc1ccc(Cl)cc1	ZINC000466433976	331396997	/nfs/dbraw/zinc/39/69/97/331396997.db2.gz	MPWJNMKUVJUZKM-KGLIPLIRSA-N	0	0	293.838	4.332	20	30		CIEDRN
CC#CCCCC(=O)N(C)[C@@H](c1ccccc1C)C(C)C	ZINC000466434705	331397054	/nfs/dbraw/zinc/39/70/54/331397054.db2.gz	LWEJDJVRHNQYHM-LJQANCHMSA-N	0	0	285.431	4.344	20	30		CIEDRN
CC#CCCCC(=O)Nc1ccc(SC)c(Cl)c1	ZINC000466442360	331397211	/nfs/dbraw/zinc/39/72/11/331397211.db2.gz	SEALWWOWQLGBJD-UHFFFAOYSA-N	0	0	281.808	4.194	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@H](Cc1ccc(F)cc1)C(C)C	ZINC000466439656	331397256	/nfs/dbraw/zinc/39/72/56/331397256.db2.gz	UTWVGLDGFVMFRU-WMLDXEAASA-N	0	0	291.410	4.111	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NC1(c2ccc(Cl)cc2)CC1	ZINC000466444159	331397317	/nfs/dbraw/zinc/39/73/17/331397317.db2.gz	RLIUTNUHGFPKPQ-GFCCVEGCSA-N	0	0	277.795	4.048	20	30		CIEDRN
C=C(C)CN(CC)C(=O)N[C@@H](C)c1ccc(SC)cc1	ZINC000466484902	331398163	/nfs/dbraw/zinc/39/81/63/331398163.db2.gz	LAYGNTXUALZPPF-ZDUSSCGKSA-N	0	0	292.448	4.077	20	30		CIEDRN
N#Cc1cccc(SCc2ccc(F)cc2F)c1	ZINC000466492257	331398452	/nfs/dbraw/zinc/39/84/52/331398452.db2.gz	DEYSGFVNAVSVIP-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)[C@@H](Sc1ccccc1)C(C)C	ZINC000466528022	331399120	/nfs/dbraw/zinc/39/91/20/331399120.db2.gz	GPCPGEWMQJDRME-ZBFHGGJFSA-N	0	0	291.460	4.274	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)C1(c2ccccc2F)CCCC1	ZINC000466530344	331399138	/nfs/dbraw/zinc/39/91/38/331399138.db2.gz	VCIWFXUWUYSGDK-CQSZACIVSA-N	0	0	289.394	4.108	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(OC2CCC2)c(F)c1	ZINC000466531897	331399157	/nfs/dbraw/zinc/39/91/57/331399157.db2.gz	ZZFNSGLRUKQSGO-GFCCVEGCSA-N	0	0	291.366	4.298	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)c1cc(C2CC2)nc2ccccc21	ZINC000466529082	331399164	/nfs/dbraw/zinc/39/91/64/331399164.db2.gz	QBSCQVVOQZXVAN-CQSZACIVSA-N	0	0	294.398	4.197	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)C1(c2ccccc2F)CCCC1	ZINC000466530343	331399180	/nfs/dbraw/zinc/39/91/80/331399180.db2.gz	VCIWFXUWUYSGDK-AWEZNQCLSA-N	0	0	289.394	4.108	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)C1(c2cccs2)CCCCC1	ZINC000466539699	331399444	/nfs/dbraw/zinc/39/94/44/331399444.db2.gz	IEXLJLZYUXEHSL-CQSZACIVSA-N	0	0	291.460	4.421	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)[C@H](CC(C)C)c1ccccc1	ZINC000466540595	331399451	/nfs/dbraw/zinc/39/94/51/331399451.db2.gz	KWKCVMZRDVZPTM-DLBZAZTESA-N	0	0	273.420	4.287	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CC[C@@](C)(CCc2ccccc2)C1	ZINC000466544065	331399544	/nfs/dbraw/zinc/39/95/44/331399544.db2.gz	NCEORKGGLVOEMJ-YLJYHZDGSA-N	0	0	299.458	4.460	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)C(CC)(CC)c1ccccc1	ZINC000466543378	331399565	/nfs/dbraw/zinc/39/95/65/331399565.db2.gz	UHCKVMAGXIIMFO-MRXNPFEDSA-N	0	0	273.420	4.215	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@@](C)(CCc2ccccc2)C1	ZINC000466544059	331399572	/nfs/dbraw/zinc/39/95/72/331399572.db2.gz	NCEORKGGLVOEMJ-FXAWDEMLSA-N	0	0	299.458	4.460	20	30		CIEDRN
C=CC[C@@H](CC)NC(=O)[C@H](CC)Sc1ccccc1	ZINC000466542386	331399625	/nfs/dbraw/zinc/39/96/25/331399625.db2.gz	QMKPJQZPPLZPQI-HIFRSBDPSA-N	0	0	277.433	4.028	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H]1c2cccc(F)c2CC[C@@H]1C	ZINC000466642723	331401453	/nfs/dbraw/zinc/40/14/53/331401453.db2.gz	RNQINFYKJZZELZ-DCGLDWPTSA-N	0	0	289.394	4.168	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H]1Cc1ccccc1C	ZINC000466662104	331401944	/nfs/dbraw/zinc/40/19/44/331401944.db2.gz	UWYYFMCSAKPBGZ-FUHWJXTLSA-N	0	0	285.431	4.131	20	30		CIEDRN
C=CCCN(C)C(=O)N(c1ccccc1)c1ccccc1	ZINC000466720994	331403076	/nfs/dbraw/zinc/40/30/76/331403076.db2.gz	BXYCUMZDDWEONV-UHFFFAOYSA-N	0	0	280.371	4.453	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1CCCC[C@@H]1CCC(C)C	ZINC000466874012	331406935	/nfs/dbraw/zinc/40/69/35/331406935.db2.gz	MUGHLZHUWISFFD-HZPDHXFCSA-N	0	0	265.441	4.406	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NC(C)(C)c1ccc(CC)cc1	ZINC000466871945	331406940	/nfs/dbraw/zinc/40/69/40/331406940.db2.gz	JKKAVHRENHLHCT-AWEZNQCLSA-N	0	0	273.420	4.203	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCCC[C@H]1CCC(C)C	ZINC000466874011	331406942	/nfs/dbraw/zinc/40/69/42/331406942.db2.gz	MUGHLZHUWISFFD-HOTGVXAUSA-N	0	0	265.441	4.406	20	30		CIEDRN
C=CCCCC(=O)N1CC[C@@H](c2ccccc2)C[C@H]1C	ZINC000466887103	331407154	/nfs/dbraw/zinc/40/71/54/331407154.db2.gz	IVNOOKVUEPFRHW-NVXWUHKLSA-N	0	0	271.404	4.137	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](c2ccccc2)C[C@@H]1C	ZINC000466893659	331407410	/nfs/dbraw/zinc/40/74/10/331407410.db2.gz	JBUCRACTDILTET-BQFCYCMXSA-N	0	0	285.431	4.383	20	30		CIEDRN
C=CCCN(C)C(=O)N[C@H](CC(C)C)c1ccccc1C	ZINC000467105016	331411227	/nfs/dbraw/zinc/41/12/27/331411227.db2.gz	DBLIZJDSLAWSJN-QGZVFWFLSA-N	0	0	288.435	4.300	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000467127140	331411558	/nfs/dbraw/zinc/41/15/58/331411558.db2.gz	GNLWOUHCXBJXTF-ZDUSSCGKSA-N	0	0	287.281	4.126	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H]1CCC[C@H]1Cc1ccccc1	ZINC000467336241	331415312	/nfs/dbraw/zinc/41/53/12/331415312.db2.gz	OHABDGHWYMGOHD-OALUTQOASA-N	0	0	297.442	4.282	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H](CC)c1ccc(C)cc1	ZINC000467335183	331415366	/nfs/dbraw/zinc/41/53/66/331415366.db2.gz	JTQQASIMYJBYEP-QGZVFWFLSA-N	0	0	271.404	4.331	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000467520359	331421103	/nfs/dbraw/zinc/42/11/03/331421103.db2.gz	UPMHIVNPHABPEW-NHYWBVRUSA-N	0	0	299.336	4.485	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCCc2ccc(C)cc21	ZINC000467531550	331421270	/nfs/dbraw/zinc/42/12/70/331421270.db2.gz	YBMOLPQSHLTOPN-UHFFFAOYSA-N	0	0	269.388	4.043	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cc(Cl)ccc1NC1CC1	ZINC000467756379	331423903	/nfs/dbraw/zinc/42/39/03/331423903.db2.gz	HGZZDEXIIZNXAX-NSHDSACASA-N	0	0	292.810	4.455	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1ccc(-c2ccccc2)cn1	ZINC000467830353	331424337	/nfs/dbraw/zinc/42/43/37/331424337.db2.gz	MACZPQCJARQNEA-UHFFFAOYSA-N	0	0	292.382	4.456	20	30		CIEDRN
C=CCC(CC=C)C(=O)N(CC)c1ccc(OCC)cc1	ZINC000467818130	331424348	/nfs/dbraw/zinc/42/43/48/331424348.db2.gz	WVBIYYUQUWUFFQ-UHFFFAOYSA-N	0	0	287.403	4.207	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H]1CCCC[C@H]1C(C)C	ZINC000467838458	331424421	/nfs/dbraw/zinc/42/44/21/331424421.db2.gz	IWLKDDTUDNHQGZ-HOTGVXAUSA-N	0	0	263.425	4.086	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1nc2ccc(C)cc2s1	ZINC000467839731	331424427	/nfs/dbraw/zinc/42/44/27/331424427.db2.gz	QIOUFKKZCQZMHT-UHFFFAOYSA-N	0	0	286.400	4.312	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc2occ(C)c2c1	ZINC000467885161	331425135	/nfs/dbraw/zinc/42/51/35/331425135.db2.gz	CJYMNYBVAHBJQE-INIZCTEOSA-N	0	0	257.333	4.282	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cc(C2CCCCC2)nn1C	ZINC000467972238	331426179	/nfs/dbraw/zinc/42/61/79/331426179.db2.gz	XWIRBTLBICEHCC-KRWDZBQOSA-N	0	0	289.423	4.009	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)NC[C@H]1CCCC[C@H]1C(F)(F)F	ZINC000467979619	331426241	/nfs/dbraw/zinc/42/62/41/331426241.db2.gz	VZYXBPSIEBFMHZ-YRGRVCCFSA-N	0	0	291.357	4.074	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)NC[C@H]1CCC[C@@H](C(F)(F)F)C1	ZINC000467995630	331426394	/nfs/dbraw/zinc/42/63/94/331426394.db2.gz	QLJNTSGVDQNVSL-OUCADQQQSA-N	0	0	291.357	4.074	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@@H](CCC)Cc1ccccc1	ZINC000468026338	331426822	/nfs/dbraw/zinc/42/68/22/331426822.db2.gz	NLLWIRJNLYIYET-WMZOPIPTSA-N	0	0	273.420	4.116	20	30		CIEDRN
C=CCCN(C)C(=O)c1cc2c(s1)-c1ccccc1CC2	ZINC000468177440	331429763	/nfs/dbraw/zinc/42/97/63/331429763.db2.gz	CVFSETPSSGKUOE-UHFFFAOYSA-N	0	0	297.423	4.162	20	30		CIEDRN
C=CCCCNC(=O)Cc1csc2ccc(Cl)cc12	ZINC000468360237	331432786	/nfs/dbraw/zinc/43/27/86/331432786.db2.gz	FOGKSEKFSJSYAM-UHFFFAOYSA-N	0	0	293.819	4.180	20	30		CIEDRN
C=CCCCNC(=O)c1[nH]c2ccc(Cl)cc2c1Cl	ZINC000468390393	331433541	/nfs/dbraw/zinc/43/35/41/331433541.db2.gz	VKPDBNWOIUXILT-UHFFFAOYSA-N	0	0	297.185	4.171	20	30		CIEDRN
C=CCCCNC(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1Cl	ZINC000468393195	331433801	/nfs/dbraw/zinc/43/38/01/331433801.db2.gz	AUXNIFSYJFGONH-NEPJUHHUSA-N	0	0	298.213	4.179	20	30		CIEDRN
CC(C)c1ccc(NC(=O)[C@@H](C)C#N)c(C(C)C)c1	ZINC000468476260	331435503	/nfs/dbraw/zinc/43/55/03/331435503.db2.gz	RRXQXMQPZJWJDW-LBPRGKRZSA-N	0	0	258.365	4.032	20	30		CIEDRN
CC(C)c1ccc(NC(=O)[C@H](C)C#N)c(C(C)C)c1	ZINC000468476259	331435507	/nfs/dbraw/zinc/43/55/07/331435507.db2.gz	RRXQXMQPZJWJDW-GFCCVEGCSA-N	0	0	258.365	4.032	20	30		CIEDRN
N#Cc1cc(COc2cc(Cl)ccc2F)ccc1F	ZINC000468641752	331438116	/nfs/dbraw/zinc/43/81/16/331438116.db2.gz	FSGQPJCTWJWRAU-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
CCCN(Cc1ccc(C#N)cc1)C(=O)C[C@@H]1CC[C@@H](C)C1	ZINC000468927540	331442477	/nfs/dbraw/zinc/44/24/77/331442477.db2.gz	ITIDEDAGRVJQJO-CRAIPNDOSA-N	0	0	298.430	4.123	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)C[C@H]1CC[C@@H](C)C1	ZINC000469068293	331445169	/nfs/dbraw/zinc/44/51/69/331445169.db2.gz	VBFHSHGXOZNQMD-WBVHZDCISA-N	0	0	271.404	4.028	20	30		CIEDRN
CCCNc1ccc(C#N)cc1NC(=O)CC(C)(C)CC	ZINC000469077621	331445210	/nfs/dbraw/zinc/44/52/10/331445210.db2.gz	UDSGYTNMPYAQJE-UHFFFAOYSA-N	0	0	287.407	4.145	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1c2ccccc2SC[C@H]1C	ZINC000469104164	331445801	/nfs/dbraw/zinc/44/58/01/331445801.db2.gz	RSFQKMLNFFTASZ-CYBMUJFWSA-N	0	0	287.428	4.282	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)N(C)c1ccc(F)cc1	ZINC000469204839	331447699	/nfs/dbraw/zinc/44/76/99/331447699.db2.gz	OIITVJYSCUUMHL-UHFFFAOYSA-N	0	0	298.361	4.070	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](C(C)C)Nc2ccccc21	ZINC000469276951	331448793	/nfs/dbraw/zinc/44/87/93/331448793.db2.gz	NGHFFTZKNVPGPO-ZBFHGGJFSA-N	0	0	286.419	4.072	20	30		CIEDRN
C=CC[C@H](C)NC(=O)c1sc2cc(F)ccc2c1C	ZINC000498289056	331448979	/nfs/dbraw/zinc/44/89/79/331448979.db2.gz	SBOSRSDKNBPHIV-VIFPVBQESA-N	0	0	277.364	4.043	20	30		CIEDRN
CC(C)(C)C(=O)c1ccc(NCc2ccccc2C#N)cc1	ZINC000469299219	331449161	/nfs/dbraw/zinc/44/91/61/331449161.db2.gz	ZMRMQYOMKNSNQU-UHFFFAOYSA-N	0	0	292.382	4.399	20	30		CIEDRN
C=CCCN(C)C(=O)c1cccc(Nc2ccccc2)c1	ZINC000469476150	331452454	/nfs/dbraw/zinc/45/24/54/331452454.db2.gz	KIFDBQBWWKIOEO-UHFFFAOYSA-N	0	0	280.371	4.078	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1cccc(Cl)c1C	ZINC000469748814	331456797	/nfs/dbraw/zinc/45/67/97/331456797.db2.gz	OCQHSWNOUXKCGR-NSHDSACASA-N	0	0	265.784	4.123	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1sc2cc(C)c(C)cc2c1C	ZINC000469762929	331457144	/nfs/dbraw/zinc/45/71/44/331457144.db2.gz	FAVYGQZXMWKQCO-UHFFFAOYSA-N	0	0	287.428	4.475	20	30		CIEDRN
C=CCCCCCN(C)C(=O)C[C@@H]1CCC[C@H]1C	ZINC000469812514	331461832	/nfs/dbraw/zinc/46/18/32/331461832.db2.gz	YWJMFRMTNUXODF-CABCVRRESA-N	0	0	251.414	4.018	20	30		CIEDRN
CC(C)(C)C1CCC(C#N)(NC(=O)C2CCCCC2)CC1	ZINC000470192956	331474817	/nfs/dbraw/zinc/47/48/17/331474817.db2.gz	IKDVTFJPDLNEIA-UHFFFAOYSA-N	0	0	290.451	4.182	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)C[C@@H](C)C(C)C)CCCC1(C)C	ZINC000470282813	331477881	/nfs/dbraw/zinc/47/78/81/331477881.db2.gz	LCENNQYUCBEOAF-CABCVRRESA-N	0	0	265.441	4.262	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)c2cccc(F)c2)CCCC1(C)C	ZINC000470295549	331478384	/nfs/dbraw/zinc/47/83/84/331478384.db2.gz	FKUDSPWVOWTUMH-HNNXBMFYSA-N	0	0	275.367	4.033	20	30		CIEDRN
C=CC[C@H]1N(C(=O)c2ccccc2C)CCCC1(C)C	ZINC000470300309	331478735	/nfs/dbraw/zinc/47/87/35/331478735.db2.gz	VDYRBCVUUYMPOK-MRXNPFEDSA-N	0	0	271.404	4.202	20	30		CIEDRN
CC(C)[C@@H]1CN(C(=O)C2(C#N)CCCCC2)c2ccccc21	ZINC000470422740	331481926	/nfs/dbraw/zinc/48/19/26/331481926.db2.gz	SBQWRXUSAAOAGP-INIZCTEOSA-N	0	0	296.414	4.247	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@H](C)CC1CCCCC1	ZINC000470479002	331483354	/nfs/dbraw/zinc/48/33/54/331483354.db2.gz	ZVYCJINNDINTBV-CZUORRHYSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=C(C)[C@@H](CC(=O)Nc1ccc(C2CCC2)cc1)OCC	ZINC000470475258	331483458	/nfs/dbraw/zinc/48/34/58/331483458.db2.gz	HTGFMHBTWSSJSG-QGZVFWFLSA-N	0	0	287.403	4.264	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)c1cc(C(C)C)on1	ZINC000470642420	331486687	/nfs/dbraw/zinc/48/66/87/331486687.db2.gz	QNWXSZPJZTVKKK-UHFFFAOYSA-N	0	0	298.386	4.017	20	30		CIEDRN
C=C(C)CN(Cc1ccccc1)C(=O)c1ccccc1C	ZINC000470651478	331487006	/nfs/dbraw/zinc/48/70/06/331487006.db2.gz	XLUBSVXRZLTBLO-UHFFFAOYSA-N	0	0	279.383	4.214	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)CCSCc1ccccc1	ZINC000471105831	331501630	/nfs/dbraw/zinc/50/16/30/331501630.db2.gz	WMSLYRMVNHIUAA-HNNXBMFYSA-N	0	0	291.460	4.171	20	30		CIEDRN
C=CCCCCNC(=O)[C@H](C)Oc1ccc2ccccc2c1	ZINC000471129483	331501794	/nfs/dbraw/zinc/50/17/94/331501794.db2.gz	BUNMSELBAKATCS-HNNXBMFYSA-N	0	0	297.398	4.080	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)C[C@H]1CCC[C@@H](C)C1	ZINC000471162260	331502751	/nfs/dbraw/zinc/50/27/51/331502751.db2.gz	UXCVKISVTVKMTD-CABCVRRESA-N	0	0	278.440	4.134	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](c2ccc(C)cc2C)C1	ZINC000471337423	331506781	/nfs/dbraw/zinc/50/67/81/331506781.db2.gz	QOYNFGHFUFLOPR-IRXDYDNUSA-N	0	0	285.431	4.222	20	30		CIEDRN
C=CCCCCNC(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1	ZINC000471699862	331516392	/nfs/dbraw/zinc/51/63/92/331516392.db2.gz	DGQKHPISXHNLIB-MOPGFXCFSA-N	0	0	293.410	4.416	20	30		CIEDRN
C=CCCCCNC(=O)CCOc1ccccc1C(C)C	ZINC000471711673	331517384	/nfs/dbraw/zinc/51/73/84/331517384.db2.gz	AZYIUKRETFTVIW-UHFFFAOYSA-N	0	0	289.419	4.051	20	30		CIEDRN
CCCOc1ccccc1OCc1ccc(F)cc1C#N	ZINC000303174615	332914859	/nfs/dbraw/zinc/91/48/59/332914859.db2.gz	JIRBILMGOKMHLI-UHFFFAOYSA-N	0	0	285.318	4.065	20	30		CIEDRN
C=CC[C@H](C)NC(=O)[C@@H](C)c1ccc(Cl)c(Cl)c1	ZINC000472164170	331530815	/nfs/dbraw/zinc/53/08/15/331530815.db2.gz	SNAFNKFTHGHESE-UWVGGRQHSA-N	0	0	286.202	4.178	20	30		CIEDRN
C=CCCCCCN(C)C(=O)c1ccc(C(=O)CC)cc1	ZINC000472263737	331534110	/nfs/dbraw/zinc/53/41/10/331534110.db2.gz	OKTUVNZMYSXLNL-UHFFFAOYSA-N	0	0	287.403	4.098	20	30		CIEDRN
CC(C)(C#N)CCCN1CCCc2cc(F)c(F)cc21	ZINC000472445760	331537137	/nfs/dbraw/zinc/53/71/37/331537137.db2.gz	GOCDMKLTMJYBEF-UHFFFAOYSA-N	0	0	278.346	4.047	20	30		CIEDRN
C=C[C@H](C)NC(=O)c1ccc(O[C@@H](C)c2ccccc2)cc1	ZINC000472548304	331538118	/nfs/dbraw/zinc/53/81/18/331538118.db2.gz	NFUVQEHSKKQSJK-GJZGRUSLSA-N	0	0	295.382	4.131	20	30		CIEDRN
C=CCCCCNC(=O)N1CCC[C@H]1c1cccc(F)c1	ZINC000472830459	331543773	/nfs/dbraw/zinc/54/37/73/331543773.db2.gz	JGCUTGBBDBQECL-INIZCTEOSA-N	0	0	290.382	4.029	20	30		CIEDRN
C=CCCCCNC(=O)N1CCC[C@@H]1c1ccccc1C	ZINC000472847554	331544383	/nfs/dbraw/zinc/54/43/83/331544383.db2.gz	FBEJILHDOHNEED-QGZVFWFLSA-N	0	0	286.419	4.198	20	30		CIEDRN
C=CCCCCNC(=O)N(C)[C@@H](C)c1ccc(F)c(F)c1	ZINC000472851593	331544772	/nfs/dbraw/zinc/54/47/72/331544772.db2.gz	PVFQUXCGVWCBKC-LBPRGKRZSA-N	0	0	296.361	4.024	20	30		CIEDRN
Cc1ccc(-n2cccn2)cc1N[C@@H](C#N)C1CCCCC1	ZINC000473453698	331551457	/nfs/dbraw/zinc/55/14/57/331551457.db2.gz	LKRACYLCOICMPN-SFHVURJKSA-N	0	0	294.402	4.065	20	30		CIEDRN
C=CCCCCNC(=O)Nc1ccc(C)cc1Cl	ZINC000473499973	331552194	/nfs/dbraw/zinc/55/21/94/331552194.db2.gz	VUYUMTAAHXYLHT-UHFFFAOYSA-N	0	0	266.772	4.126	20	30		CIEDRN
N#Cc1ccc(Cl)cc1Oc1ccc(C(F)(F)F)cn1	ZINC000473525692	331552835	/nfs/dbraw/zinc/55/28/35/331552835.db2.gz	ZFLDISWTHAOQNN-UHFFFAOYSA-N	0	0	298.651	4.418	20	30		CIEDRN
C=CCCCCNC(=O)Nc1ccc(CSC)cc1	ZINC000473672494	331555443	/nfs/dbraw/zinc/55/54/43/331555443.db2.gz	AYVZAVGUSTVGAY-UHFFFAOYSA-N	0	0	278.421	4.027	20	30		CIEDRN
N#Cc1ccc(SC[C@@H](O)C2CCCCC2)c(Cl)c1	ZINC000473757739	331556843	/nfs/dbraw/zinc/55/68/43/331556843.db2.gz	JHTKOWRNKMTZDP-CQSZACIVSA-N	0	0	295.835	4.245	20	30		CIEDRN
C[C@H](CCSc1cc(C#N)ccn1)OCc1ccccc1	ZINC000473791478	331557723	/nfs/dbraw/zinc/55/77/23/331557723.db2.gz	XMGHZLJKLNORHL-CQSZACIVSA-N	0	0	298.411	4.041	20	30		CIEDRN
C=CCCCCNC(=O)N1CCCCC[C@@H]1c1ccco1	ZINC000474090063	331569482	/nfs/dbraw/zinc/56/94/82/331569482.db2.gz	RCVYXAFOIOQVJX-OAHLLOKOSA-N	0	0	290.407	4.263	20	30		CIEDRN
C[C@@H]1CCC[C@@H](NC(=O)c2ccc(C(C)(C)C#N)cc2)[C@@H]1C	ZINC000474091244	331569675	/nfs/dbraw/zinc/56/96/75/331569675.db2.gz	WHALFLPNWNZMOU-CKEIUWERSA-N	0	0	298.430	4.042	20	30		CIEDRN
C=CCCC1(C(=O)N(C)Cc2ccccc2Cl)CC1	ZINC000474207766	331575385	/nfs/dbraw/zinc/57/53/85/331575385.db2.gz	DZYGQIKEBLWWLV-UHFFFAOYSA-N	0	0	277.795	4.045	20	30		CIEDRN
Cc1cc(C(=O)Nc2ccc(C#N)cc2)c(C)cc1Cl	ZINC000474413296	331585677	/nfs/dbraw/zinc/58/56/77/331585677.db2.gz	ORWUCHJVQISWGX-UHFFFAOYSA-N	0	0	284.746	4.081	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc2c(c1)O[C@](C)(CC)O2	ZINC000474642845	331593446	/nfs/dbraw/zinc/59/34/46/331593446.db2.gz	YIABZTCGDHNCBI-SJKOYZFVSA-N	0	0	289.375	4.125	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1nc2cc(F)c(C)cc2s1	ZINC000510842638	332918577	/nfs/dbraw/zinc/91/85/77/332918577.db2.gz	RCKCPISOIDILHK-UHFFFAOYSA-N	0	0	292.379	4.285	20	30		CIEDRN
C=CCCCC(=O)N1CCc2ccc(C(C)(C)C)cc2C1	ZINC000510854010	332919011	/nfs/dbraw/zinc/91/90/11/332919011.db2.gz	SVLYHJTYPVFZIM-UHFFFAOYSA-N	0	0	285.431	4.225	20	30		CIEDRN
C=CCCCC(=O)NCCCOc1ccc2ccccc2c1	ZINC000474991212	331608308	/nfs/dbraw/zinc/60/83/08/331608308.db2.gz	MOVCVHJYBPFNGQ-UHFFFAOYSA-N	0	0	297.398	4.081	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cc(OC)ccc2Cl)CC1	ZINC000475178297	331617003	/nfs/dbraw/zinc/61/70/03/331617003.db2.gz	SLWHMTXXIIJSEQ-UHFFFAOYSA-N	0	0	279.767	4.034	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H]1CC[C@@H](c2cccc(F)c2)C1	ZINC000510905758	332920085	/nfs/dbraw/zinc/92/00/85/332920085.db2.gz	IKONKPLVILKYKU-ZBFHGGJFSA-N	0	0	289.394	4.180	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)[C@H]1C[C@@H]1C(C)C	ZINC000475303900	331623369	/nfs/dbraw/zinc/62/33/69/331623369.db2.gz	OYSCWVPUIFTUCI-OLZOCXBDSA-N	0	0	297.851	4.208	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)[C@H]1C[C@H]1C(C)C	ZINC000475303902	331623383	/nfs/dbraw/zinc/62/33/83/331623383.db2.gz	OYSCWVPUIFTUCI-STQMWFEESA-N	0	0	297.851	4.208	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)[C@@H]1C[C@@H]1C(C)C	ZINC000475303899	331623446	/nfs/dbraw/zinc/62/34/46/331623446.db2.gz	OYSCWVPUIFTUCI-CHWSQXEVSA-N	0	0	297.851	4.208	20	30		CIEDRN
C=C(C)[C@H](NC(=O)CCC1CCC1)c1ccc(F)c(F)c1	ZINC000475674435	331641666	/nfs/dbraw/zinc/64/16/66/331641666.db2.gz	QHFKUWJTQZMUBS-KRWDZBQOSA-N	0	0	293.357	4.279	20	30		CIEDRN
C=C(C)[C@@H](Nc1ncccc1F)c1ccc(F)c(F)c1	ZINC000475723803	331643176	/nfs/dbraw/zinc/64/31/76/331643176.db2.gz	QNCFAOCRFSVLMT-CQSZACIVSA-N	0	0	278.277	4.228	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)C[C@H](C)C(C)(C)C	ZINC000475744187	331644556	/nfs/dbraw/zinc/64/45/56/331644556.db2.gz	ASNQLSRZWOTTTL-ZDUSSCGKSA-N	0	0	266.429	4.037	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)[C@@H](C)CC1CCCC1	ZINC000475743681	331644554	/nfs/dbraw/zinc/64/45/54/331644554.db2.gz	JVLNVPDZUSTHKX-AWEZNQCLSA-N	0	0	278.440	4.182	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)C[C@H]1CCC[C@@H](C)C1	ZINC000475742466	331644557	/nfs/dbraw/zinc/64/45/57/331644557.db2.gz	QMOJJYKDSFUZOQ-CABCVRRESA-N	0	0	278.440	4.182	20	30		CIEDRN
Cc1cc(OCc2cccc(C(F)F)c2)ccc1C#N	ZINC000475871883	331646701	/nfs/dbraw/zinc/64/67/01/331646701.db2.gz	XMKWXDJYJSZPDZ-UHFFFAOYSA-N	0	0	273.282	4.383	20	30		CIEDRN
C=CCCC1(C(=O)Nc2ccc(OCC3CC3)cc2)CC1	ZINC000476033335	331651728	/nfs/dbraw/zinc/65/17/28/331651728.db2.gz	MKZHOWVAAXDBPQ-UHFFFAOYSA-N	0	0	285.387	4.160	20	30		CIEDRN
Cc1cccc(O[C@H](C)c2cccc(C#N)c2)c1F	ZINC000476039631	331651826	/nfs/dbraw/zinc/65/18/26/331651826.db2.gz	IFKKNKIJDOIIIX-GFCCVEGCSA-N	0	0	255.292	4.146	20	30		CIEDRN
C[C@H]1CCC[C@H](C)N(C(=O)c2ccc(C(C)(C)C#N)cc2)C1	ZINC000476110423	331655400	/nfs/dbraw/zinc/65/54/00/331655400.db2.gz	BUOMGAZEWFKDEK-GJZGRUSLSA-N	0	0	298.430	4.138	20	30		CIEDRN
C[C@@H]1CCC[C@H](C)CN1C(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000476110673	331655449	/nfs/dbraw/zinc/65/54/49/331655449.db2.gz	BUOMGAZEWFKDEK-LSDHHAIUSA-N	0	0	298.430	4.138	20	30		CIEDRN
C=CCCC1(C(=O)Nc2cccc(CC(F)(F)F)c2)CC1	ZINC000476216594	331657423	/nfs/dbraw/zinc/65/74/23/331657423.db2.gz	HWFAWDMXJMQLQI-UHFFFAOYSA-N	0	0	297.320	4.476	20	30		CIEDRN
CCC[C@H]1CCCN(C(=O)C[C@H](CC#N)c2ccccc2)C1	ZINC000476297898	331660538	/nfs/dbraw/zinc/66/05/38/331660538.db2.gz	DLBWPQDJDJVUAR-WMZOPIPTSA-N	0	0	298.430	4.113	20	30		CIEDRN
C=CCCC1(C(=O)N2CCC(C)(C(C)C)CC2)CC1	ZINC000476844220	331670403	/nfs/dbraw/zinc/67/04/03/331670403.db2.gz	DYDDKYHUKUOUHY-UHFFFAOYSA-N	0	0	263.425	4.018	20	30		CIEDRN
N#Cc1ncccc1OCCCc1cccc2ccccc21	ZINC000477039497	331673641	/nfs/dbraw/zinc/67/36/41/331673641.db2.gz	JJVKLTGDUYPOJM-UHFFFAOYSA-N	0	0	288.350	4.118	20	30		CIEDRN
C=CCCCC(=O)N(CC)C[C@@H](CC)c1ccccc1	ZINC000477247464	331679970	/nfs/dbraw/zinc/67/99/70/331679970.db2.gz	IASPYVFPZOMOHW-MRXNPFEDSA-N	0	0	273.420	4.385	20	30		CIEDRN
C=CCOc1cccc(NC(=O)N(CCCC)C2CC2)c1	ZINC000510988139	332923183	/nfs/dbraw/zinc/92/31/83/332923183.db2.gz	YAKRLZLRTUBFEM-UHFFFAOYSA-N	0	0	288.391	4.048	20	30		CIEDRN
CC(C)(C)c1ccc(C(=O)Nc2cccc(C#N)c2)s1	ZINC000477497157	331685374	/nfs/dbraw/zinc/68/53/74/331685374.db2.gz	AYSMJDWFCUARTP-UHFFFAOYSA-N	0	0	284.384	4.170	20	30		CIEDRN
C=CCC1(C(=O)NCC2(Cc3ccccc3)CCC2)CCC1	ZINC000477861720	331692479	/nfs/dbraw/zinc/69/24/79/331692479.db2.gz	XCQJAPCRIFMUBC-UHFFFAOYSA-N	0	0	297.442	4.262	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1nc2cc(F)c(C)cc2s1	ZINC000478067316	331697195	/nfs/dbraw/zinc/69/71/95/331697195.db2.gz	OXJLKQKTEZVOKT-SNVBAGLBSA-N	0	0	292.379	4.285	20	30		CIEDRN
C=CCC1(C(=O)Nc2ccc(OC(F)(F)F)cc2)CCC1	ZINC000478242890	331701580	/nfs/dbraw/zinc/70/15/80/331701580.db2.gz	XURYLIHXQMICKB-UHFFFAOYSA-N	0	0	299.292	4.270	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N[C@@H]1CC[C@@H](c2cccc(F)c2)C1	ZINC000478255921	331701866	/nfs/dbraw/zinc/70/18/66/331701866.db2.gz	QTCVWXZOBWROJF-QGPMSJSTSA-N	0	0	289.394	4.180	20	30		CIEDRN
Cc1cc(NCc2ccc(C#N)cc2)ccc1C1CC1	ZINC000478347162	331704347	/nfs/dbraw/zinc/70/43/47/331704347.db2.gz	SZYFUUTZRMIJDX-UHFFFAOYSA-N	0	0	262.356	4.356	20	30		CIEDRN
C=CCCOCCCCC(=O)N1CCC[C@H](C(C)(C)C)C1	ZINC000478443313	331706298	/nfs/dbraw/zinc/70/62/98/331706298.db2.gz	DBWWADSWCNTFSA-INIZCTEOSA-N	0	0	295.467	4.034	20	30		CIEDRN
C=CCC1(C(=O)N2CCC[C@H](C(C)(C)C)C2)CCC1	ZINC000478489758	331707247	/nfs/dbraw/zinc/70/72/47/331707247.db2.gz	IUVRGMCEYRMSJN-AWEZNQCLSA-N	0	0	263.425	4.018	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cc(OC)c(C)cc1C	ZINC000478548312	331708259	/nfs/dbraw/zinc/70/82/59/331708259.db2.gz	PKULOWFZPWHHOO-UHFFFAOYSA-N	0	0	273.376	4.019	20	30		CIEDRN
C[C@H](SCc1ccc2c(c1)OCO2)c1cccc(C#N)c1	ZINC000478763050	331713473	/nfs/dbraw/zinc/71/34/73/331713473.db2.gz	VFEVCHVVAIIYRC-LBPRGKRZSA-N	0	0	297.379	4.281	20	30		CIEDRN
C=CCOc1ccc(O[C@@H](C)c2ccc(C#N)cc2)cc1	ZINC000478779650	331713711	/nfs/dbraw/zinc/71/37/11/331713711.db2.gz	COJXQOKWFWHBAC-AWEZNQCLSA-N	0	0	279.339	4.263	20	30		CIEDRN
C[C@@H](Oc1cc(Cl)ccc1F)c1ccc(C#N)cc1	ZINC000478785323	331713924	/nfs/dbraw/zinc/71/39/24/331713924.db2.gz	WIZFVKHIWHJBSG-SNVBAGLBSA-N	0	0	275.710	4.491	20	30		CIEDRN
Cc1ccc(O[C@@H](C)c2ccc(C#N)cc2)cc1F	ZINC000478843527	331715433	/nfs/dbraw/zinc/71/54/33/331715433.db2.gz	ZUGCMAZGGUFYES-LBPRGKRZSA-N	0	0	255.292	4.146	20	30		CIEDRN
Cc1ccc(O[C@H](C)c2ccc(C#N)cc2)cc1F	ZINC000478843525	331715467	/nfs/dbraw/zinc/71/54/67/331715467.db2.gz	ZUGCMAZGGUFYES-GFCCVEGCSA-N	0	0	255.292	4.146	20	30		CIEDRN
CC(=O)c1ccc(OCc2ccc(Cl)cc2C#N)c(C)c1	ZINC000478933292	331717864	/nfs/dbraw/zinc/71/78/64/331717864.db2.gz	XVGXNBIDAJUKOV-UHFFFAOYSA-N	0	0	299.757	4.302	20	30		CIEDRN
C=CCC1(C(=O)Nc2cccc(SCC)c2)CCC1	ZINC000479081884	331720126	/nfs/dbraw/zinc/72/01/26/331720126.db2.gz	VSIHYCZPDLFNFI-UHFFFAOYSA-N	0	0	275.417	4.484	20	30		CIEDRN
C=C(C)CN(C)C(=O)[C@@H](CC)CC1CCCCC1	ZINC000479212267	331721889	/nfs/dbraw/zinc/72/18/89/331721889.db2.gz	HLJVUILCKVREMC-HNNXBMFYSA-N	0	0	251.414	4.018	20	30		CIEDRN
C=C(C)CN(C)C(=O)C1(c2c(Cl)cccc2Cl)CC1	ZINC000479256995	331723016	/nfs/dbraw/zinc/72/30/16/331723016.db2.gz	ZLQYDFMUAUITBT-UHFFFAOYSA-N	0	0	298.213	4.060	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)[C@H]2CCC(F)(F)C2)c1	ZINC000479374725	331725884	/nfs/dbraw/zinc/72/58/84/331725884.db2.gz	IJZVIDVKNXVTDK-LBPRGKRZSA-N	0	0	295.329	4.015	20	30		CIEDRN
Cc1cc(NCc2ccc(C#N)s2)ccc1C1CC1	ZINC000479407033	331727430	/nfs/dbraw/zinc/72/74/30/331727430.db2.gz	DIQCMQKVTJMFMH-UHFFFAOYSA-N	0	0	268.385	4.418	20	30		CIEDRN
Cc1cccc(OC(F)F)c1NCC#Cc1ccccc1	ZINC000479488404	331732947	/nfs/dbraw/zinc/73/29/47/331732947.db2.gz	HJGLTAJDWVDBLK-UHFFFAOYSA-N	0	0	287.309	4.060	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](C)c1ccc2c(c1)CCCC2	ZINC000479493989	331733233	/nfs/dbraw/zinc/73/32/33/331733233.db2.gz	CXPUTNGIZBIKAK-AWEZNQCLSA-N	0	0	271.404	4.099	20	30		CIEDRN
C=CCCCC(=O)N(C)Cc1c(CC)oc2ccccc21	ZINC000479508314	331733910	/nfs/dbraw/zinc/73/39/10/331733910.db2.gz	ZGEIWULYONZEPL-UHFFFAOYSA-N	0	0	285.387	4.310	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](C)CC(C)(C)c1ccccc1	ZINC000479547709	331736765	/nfs/dbraw/zinc/73/67/65/331736765.db2.gz	BXDKREMVQXXOAO-HNNXBMFYSA-N	0	0	273.420	4.215	20	30		CIEDRN
C=CCCCC(=O)N(CC)[C@H](CC)c1ccccc1	ZINC000479562068	331737526	/nfs/dbraw/zinc/73/75/26/331737526.db2.gz	WYBXMRGQUZOZIM-MRXNPFEDSA-N	0	0	259.393	4.343	20	30		CIEDRN
C=CCCCC(=O)N[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000479571427	331738154	/nfs/dbraw/zinc/73/81/54/331738154.db2.gz	SZIUGBRSWNVOGZ-GXTWGEPZSA-N	0	0	297.320	4.034	20	30		CIEDRN
C=CCCCC(=O)NCC(C)(C)c1cccc(Cl)c1	ZINC000479573283	331738182	/nfs/dbraw/zinc/73/81/82/331738182.db2.gz	JHVXFUOEILIQIC-UHFFFAOYSA-N	0	0	279.811	4.090	20	30		CIEDRN
C=CCCCC(=O)N(Cc1ccccc1F)CC(C)C	ZINC000479599610	331739984	/nfs/dbraw/zinc/73/99/84/331739984.db2.gz	GYFPYQDIFSZLMS-UHFFFAOYSA-N	0	0	277.383	4.167	20	30		CIEDRN
C=CCOCCCS[C@H](C)c1cccc(F)c1	ZINC000479604127	331740266	/nfs/dbraw/zinc/74/02/66/331740266.db2.gz	UNGRRPMCVKMEMT-GFCCVEGCSA-N	0	0	254.370	4.213	20	30		CIEDRN
C=CCOCCCS[C@H](C)c1cc(F)ccc1F	ZINC000479606660	331740531	/nfs/dbraw/zinc/74/05/31/331740531.db2.gz	YWMMJJZXMULLBQ-LLVKDONJSA-N	0	0	272.360	4.352	20	30		CIEDRN
C=CCOCCCSCCOc1ccccc1Cl	ZINC000479605506	331740574	/nfs/dbraw/zinc/74/05/74/331740574.db2.gz	WJOREVGTEPEAIX-UHFFFAOYSA-N	0	0	286.824	4.045	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](CC)Cc1ccc(Cl)cc1	ZINC000479621782	331741191	/nfs/dbraw/zinc/74/11/91/331741191.db2.gz	SAIHKQBCFNZABV-HNNXBMFYSA-N	0	0	279.811	4.134	20	30		CIEDRN
C=CCOCCCSCc1ccccc1C(C)(C)C#N	ZINC000479618313	331741210	/nfs/dbraw/zinc/74/12/10/331741210.db2.gz	MJCIGKBIOVVTQP-UHFFFAOYSA-N	0	0	289.444	4.314	20	30		CIEDRN
C=CCC1(C(=O)N2CC[C@@H](Cc3ccccc3)[C@@H]2C)CCC1	ZINC000479869517	331749764	/nfs/dbraw/zinc/74/97/64/331749764.db2.gz	ZDJHAHHJWBEHPW-WMZOPIPTSA-N	0	0	297.442	4.213	20	30		CIEDRN
CCC[C@H](CC)[S@](=O)CCCCC(C)(C)C#N	ZINC000479886700	331750986	/nfs/dbraw/zinc/75/09/86/331750986.db2.gz	QMPCIPYMDIMMJJ-SUMWQHHRSA-N	0	0	257.443	4.034	20	30		CIEDRN
N#C[C@@H](NC(=O)c1ccc(C2CCC2)cc1)C1CCCCC1	ZINC000479901970	331751326	/nfs/dbraw/zinc/75/13/26/331751326.db2.gz	WHJIACBDMRCDBW-GOSISDBHSA-N	0	0	296.414	4.156	20	30		CIEDRN
C=CCC[C@@H](NC(=O)N1CC[C@@H](C2CC2)C1)c1ccccc1	ZINC000479950180	331752237	/nfs/dbraw/zinc/75/22/37/331752237.db2.gz	NAJKHSKDTCSIRF-QZTJIDSGSA-N	0	0	298.430	4.135	20	30		CIEDRN
C=CCC[C@H](NC(=O)N1CC[C@H](C2CC2)C1)c1ccccc1	ZINC000479950181	331752309	/nfs/dbraw/zinc/75/23/09/331752309.db2.gz	NAJKHSKDTCSIRF-ROUUACIJSA-N	0	0	298.430	4.135	20	30		CIEDRN
C=CCC1(C(=O)N[C@H](C)C(C)(C)c2ccccc2)CCC1	ZINC000480037872	331755458	/nfs/dbraw/zinc/75/54/58/331755458.db2.gz	DHAXGMZTPIKTGE-OAHLLOKOSA-N	0	0	285.431	4.215	20	30		CIEDRN
C=C(C)[C@H](CC(=O)Nc1ccc2occ(C)c2c1)OCC	ZINC000480053250	331755856	/nfs/dbraw/zinc/75/58/56/331755856.db2.gz	DTXUHOAUOMXMGV-INIZCTEOSA-N	0	0	287.359	4.051	20	30		CIEDRN
C=CCC1(C(=O)N2CCC[C@H](Cc3ccccc3)C2)CCC1	ZINC000480161458	331760254	/nfs/dbraw/zinc/76/02/54/331760254.db2.gz	JAILMDMIWVPXDG-GOSISDBHSA-N	0	0	297.442	4.214	20	30		CIEDRN
CC[C@H](C)CC(=O)N[C@H](C#N)c1c(Cl)cccc1Cl	ZINC000480178034	331761819	/nfs/dbraw/zinc/76/18/19/331761819.db2.gz	HFCDZTZWSQFXOZ-JOYOIKCWSA-N	0	0	299.201	4.110	20	30		CIEDRN
C[C@H](NC(=O)c1cccc(CC#N)c1)[C@@H](C)C1CCCCC1	ZINC000480353991	331769258	/nfs/dbraw/zinc/76/92/58/331769258.db2.gz	GKORIZBMPLTYBF-CABCVRRESA-N	0	0	298.430	4.087	20	30		CIEDRN
C=CCC1(C(=O)N(CCC)CCc2cccs2)CCC1	ZINC000480406399	331772032	/nfs/dbraw/zinc/77/20/32/331772032.db2.gz	DIHWMIIURRXNGA-UHFFFAOYSA-N	0	0	291.460	4.276	20	30		CIEDRN
C=CCC1(C(=O)N2CCC(CC)(CC)CC2)CCC1	ZINC000480426146	331772536	/nfs/dbraw/zinc/77/25/36/331772536.db2.gz	LXSPFVUHAMOKQF-UHFFFAOYSA-N	0	0	263.425	4.162	20	30		CIEDRN
C=CC[C@@H](C(=O)N1CC(C)(C)[C@@H]1C(C)C)c1ccccc1	ZINC000480483405	331774221	/nfs/dbraw/zinc/77/42/21/331774221.db2.gz	NDKJROVVSHPBOG-SJORKVTESA-N	0	0	285.431	4.239	20	30		CIEDRN
C=C(C)CN(C)C(=O)c1cc2c(cc(Cl)cc2Cl)[nH]1	ZINC000480560999	331777963	/nfs/dbraw/zinc/77/79/63/331777963.db2.gz	YERCOZYBNHROQK-UHFFFAOYSA-N	0	0	297.185	4.123	20	30		CIEDRN
CCC[C@@H](CC)Sc1c(C#N)nnc2ccccc21	ZINC000480847317	331789707	/nfs/dbraw/zinc/78/97/07/331789707.db2.gz	PMRSUEAFEWOOJD-LLVKDONJSA-N	0	0	271.389	4.172	20	30		CIEDRN
C=CCCCC(=O)N(CCC)[C@H]1CCc2ccccc2C1	ZINC000481152114	331799359	/nfs/dbraw/zinc/79/93/59/331799359.db2.gz	GQOQUDZGAPTJLK-SFHVURJKSA-N	0	0	285.431	4.139	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CC2(CCC2)c2ccccc21	ZINC000481450577	331807392	/nfs/dbraw/zinc/80/73/92/331807392.db2.gz	RAGQONMRAVENLM-QGZVFWFLSA-N	0	0	269.388	4.057	20	30		CIEDRN
Cc1ccccc1[C@@H](CC(C)C)NC(=O)C1(C#N)CCCC1	ZINC000303434267	332930451	/nfs/dbraw/zinc/93/04/51/332930451.db2.gz	FRZGNRVKVGOOEF-QGZVFWFLSA-N	0	0	298.430	4.282	20	30		CIEDRN
C=CCN(CC1CCCCC1)C(=O)c1cc(F)ccc1F	ZINC000482721278	331844652	/nfs/dbraw/zinc/84/46/52/331844652.db2.gz	HCFNLIATVCVHFY-UHFFFAOYSA-N	0	0	293.357	4.173	20	30		CIEDRN
C=CCC[C@@H](C(=O)N1CCC(C)=C(C)C1)c1ccccc1	ZINC000482893444	331851426	/nfs/dbraw/zinc/85/14/26/331851426.db2.gz	CCULPTFZYYBKII-GOSISDBHSA-N	0	0	283.415	4.305	20	30		CIEDRN
CCCC1CCC(N(C)C(=O)c2ccc(CC#N)cc2)CC1	ZINC000483072287	331857103	/nfs/dbraw/zinc/85/71/03/331857103.db2.gz	JYUMBJSCOAFLED-UHFFFAOYSA-N	0	0	298.430	4.184	20	30		CIEDRN
CC(C)(C)C1CCC(CNC(=O)C2(C#N)CCCC2)CC1	ZINC000483250732	331864882	/nfs/dbraw/zinc/86/48/82/331864882.db2.gz	BCOQGMGTOUQNBZ-UHFFFAOYSA-N	0	0	290.451	4.039	20	30		CIEDRN
C=C(C)[C@@H](NC(=O)NC(C)(C)CC)c1ccc(F)c(F)c1	ZINC000483305323	331868302	/nfs/dbraw/zinc/86/83/02/331868302.db2.gz	RSZGFZTVDJJQPF-CQSZACIVSA-N	0	0	296.361	4.070	20	30		CIEDRN
Cc1cc(C(=O)N(CC#N)c2ccccc2)c(C)cc1Cl	ZINC000483403348	331872656	/nfs/dbraw/zinc/87/26/56/331872656.db2.gz	HPTUYMJWINOQRA-UHFFFAOYSA-N	0	0	298.773	4.127	20	30		CIEDRN
CC#CCCNC(=O)N1CCCCC[C@@H]1c1cccc(C)c1	ZINC000483426435	331874653	/nfs/dbraw/zinc/87/46/53/331874653.db2.gz	DWOTYSTYDCRCDE-GOSISDBHSA-N	0	0	298.430	4.035	20	30		CIEDRN
C=CCOc1cccc(NC(=O)N(CC)C[C@H](C)CC)c1	ZINC000483450970	331876291	/nfs/dbraw/zinc/87/62/91/331876291.db2.gz	NHJVXOXSEISJGR-CQSZACIVSA-N	0	0	290.407	4.151	20	30		CIEDRN
CC[C@@H]1CCCC[C@H]1C(=O)N(CC)c1ccc(C#N)cc1	ZINC000483637971	331880192	/nfs/dbraw/zinc/88/01/92/331880192.db2.gz	IMPLNIIUQHYWKR-NVXWUHKLSA-N	0	0	284.403	4.128	20	30		CIEDRN
CC[C@H]1CCCC[C@@H]1C(=O)N(CC)c1ccc(C#N)cc1	ZINC000483637972	331880396	/nfs/dbraw/zinc/88/03/96/331880396.db2.gz	IMPLNIIUQHYWKR-RDJZCZTQSA-N	0	0	284.403	4.128	20	30		CIEDRN
CCCC[C@@H](CCC)NC(=O)Nc1ccc(CC#N)cc1	ZINC000483846779	331886451	/nfs/dbraw/zinc/88/64/51/331886451.db2.gz	HBRMAIPMAPQAOP-OAHLLOKOSA-N	0	0	287.407	4.233	20	30		CIEDRN
CCCC[C@H](CC)C(=O)Nc1ccc(Cl)c(C#N)c1	ZINC000483853475	331886880	/nfs/dbraw/zinc/88/68/80/331886880.db2.gz	HJHCCIRHNNUPHG-NSHDSACASA-N	0	0	278.783	4.367	20	30		CIEDRN
C[C@H](CC(C)(C)C)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000483907393	331888842	/nfs/dbraw/zinc/88/88/42/331888842.db2.gz	CSLUVKMRCBALEZ-SNVBAGLBSA-N	0	0	290.432	4.119	20	30		CIEDRN
CCN(CC#N)Cc1ccc(Sc2ccccc2)cc1	ZINC000511490211	332933098	/nfs/dbraw/zinc/93/30/98/332933098.db2.gz	VFGOWBXVQUZVEH-UHFFFAOYSA-N	0	0	282.412	4.183	20	30		CIEDRN
CCC[C@@](C)(CC)C(=O)N[C@H](C#N)c1ccc(Cl)cc1	ZINC000483984791	331890694	/nfs/dbraw/zinc/89/06/94/331890694.db2.gz	KJJZHPHTGSTJKF-GDBMZVCRSA-N	0	0	292.810	4.237	20	30		CIEDRN
C[C@H](C#N)CN(C)c1ccc2c(Cl)ccc(Cl)c2n1	ZINC000484143712	331893524	/nfs/dbraw/zinc/89/35/24/331893524.db2.gz	YFMSQPMARAADPB-SECBINFHSA-N	0	0	294.185	4.137	20	30		CIEDRN
C=CCN(C(=O)c1ccc2c(c1)CCCC2)c1ccccc1	ZINC000484235344	331894684	/nfs/dbraw/zinc/89/46/84/331894684.db2.gz	RIPCVBKBILSVLH-UHFFFAOYSA-N	0	0	291.394	4.398	20	30		CIEDRN
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)Sc1ccc(C#N)cn1	ZINC000484517238	331901426	/nfs/dbraw/zinc/90/14/26/331901426.db2.gz	ROJXHAZFACYJFF-LLVKDONJSA-N	0	0	299.355	4.023	20	30		CIEDRN
C=C(CNC(=O)N[C@@H](C)c1ccc(C)cc1)c1ccccc1	ZINC000484743359	331904887	/nfs/dbraw/zinc/90/48/87/331904887.db2.gz	CCWBJKPGMDLQRC-INIZCTEOSA-N	0	0	294.398	4.069	20	30		CIEDRN
CC(C)Oc1cc(F)ccc1N[C@@H](C#N)C1CCCCC1	ZINC000484962848	331908188	/nfs/dbraw/zinc/90/81/88/331908188.db2.gz	NCLYPPUPOPHWRD-INIZCTEOSA-N	0	0	290.382	4.497	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)Nc1cnn([C@@H](C)CC)c1C	ZINC000485330136	331911778	/nfs/dbraw/zinc/91/17/78/331911778.db2.gz	KWNPWAHFUQHATN-OLZOCXBDSA-N	0	0	292.427	4.029	20	30		CIEDRN
CCCN(CC#N)Cc1ccccc1OCc1ccccc1	ZINC000511521630	332934117	/nfs/dbraw/zinc/93/41/17/332934117.db2.gz	AFMHJWIAHXDYKT-UHFFFAOYSA-N	0	0	294.398	4.001	20	30		CIEDRN
C=CCSc1ccccc1C(=O)NC[C@@H]1CC=CCC1	ZINC000485470103	331914930	/nfs/dbraw/zinc/91/49/30/331914930.db2.gz	XCIKAHBESSEGIF-CQSZACIVSA-N	0	0	287.428	4.051	20	30		CIEDRN
C=CCCCCCSCc1noc(C(C)C)n1	ZINC000485578111	331917644	/nfs/dbraw/zinc/91/76/44/331917644.db2.gz	UEQZFHQQDKWJII-UHFFFAOYSA-N	0	0	254.399	4.173	20	30		CIEDRN
CC(C)(C)[C@](C)(C#N)NC(=O)c1ccc(C2CCC2)cc1	ZINC000485642670	331919543	/nfs/dbraw/zinc/91/95/43/331919543.db2.gz	KMTMEVCDKCEESK-SFHVURJKSA-N	0	0	284.403	4.012	20	30		CIEDRN
C=CCC1(C(=O)Nc2cc(CC)ccc2CC)CCC1	ZINC000485754664	331923393	/nfs/dbraw/zinc/92/33/93/331923393.db2.gz	ATIAKELUAJXIQH-UHFFFAOYSA-N	0	0	271.404	4.496	20	30		CIEDRN
Cc1cccc(Cl)c1CC(=O)Nc1cccc(C#N)c1C	ZINC000485965335	331927960	/nfs/dbraw/zinc/92/79/60/331927960.db2.gz	LIZFVEOWLQZLOT-UHFFFAOYSA-N	0	0	298.773	4.010	20	30		CIEDRN
N#Cc1cccnc1/C=C/c1ccc(Cl)cc1Cl	ZINC000485983975	331928561	/nfs/dbraw/zinc/92/85/61/331928561.db2.gz	XIXZTAFDZZPUEB-GQCTYLIASA-N	0	0	275.138	4.430	20	30		CIEDRN
N#Cc1cccnc1/C=C/c1csc2ccccc12	ZINC000486077862	331930871	/nfs/dbraw/zinc/93/08/71/331930871.db2.gz	SNVDNIBEVMROGR-BQYQJAHWSA-N	0	0	262.337	4.338	20	30		CIEDRN
N#CCn1c(/C=C/c2ccc(Cl)s2)nc2ccccc21	ZINC000486106038	331931641	/nfs/dbraw/zinc/93/16/41/331931641.db2.gz	VCGNEIHHQPCHLZ-SOFGYWHQSA-N	0	0	299.786	4.445	20	30		CIEDRN
Cc1cccc(/C=C\c2nc3ccccc3n2CC#N)c1	ZINC000486105415	331931676	/nfs/dbraw/zinc/93/16/76/331931676.db2.gz	WYPMAMGMUAFFQV-KTKRTIGZSA-N	0	0	273.339	4.039	20	30		CIEDRN
CCCCCN(CCCCC)C(=O)c1ccc(C#N)s1	ZINC000486774481	331944468	/nfs/dbraw/zinc/94/44/68/331944468.db2.gz	YFLLIEPLDYICFD-UHFFFAOYSA-N	0	0	292.448	4.442	20	30		CIEDRN
CC(C)(C)[C@@H](NC(=O)c1ccc(C#N)s1)c1ccccc1	ZINC000486783028	331944576	/nfs/dbraw/zinc/94/45/76/331944576.db2.gz	ZUECVHGIWMDHIJ-HNNXBMFYSA-N	0	0	298.411	4.137	20	30		CIEDRN
CC[C@@H](c1ccccc1)N(CC)C(=O)c1ccc(C#N)s1	ZINC000486909670	331949202	/nfs/dbraw/zinc/94/92/02/331949202.db2.gz	NZDSQGAGZSJGAK-HNNXBMFYSA-N	0	0	298.411	4.233	20	30		CIEDRN
Cc1sc2ncnc(Oc3ccc(C#N)cc3F)c2c1C	ZINC000486926997	331949838	/nfs/dbraw/zinc/94/98/38/331949838.db2.gz	PSVQPKXGNHPWJL-UHFFFAOYSA-N	0	0	299.330	4.111	20	30		CIEDRN
N#Cc1cccnc1N[C@@H]1CCC[C@@H](c2ccccc2)C1	ZINC000487107174	331956590	/nfs/dbraw/zinc/95/65/90/331956590.db2.gz	ZKTABEJGXIGXBZ-NVXWUHKLSA-N	0	0	277.371	4.092	20	30		CIEDRN
C=C(C)COc1cccc(NC/C=C\c2ccncc2)c1	ZINC000487272799	331961922	/nfs/dbraw/zinc/96/19/22/331961922.db2.gz	XBJKMMBNUSEMSY-PLNGDYQASA-N	0	0	280.371	4.162	20	30		CIEDRN
C=C1CCN(C(=O)[C@@H](c2cccc(Cl)c2)C(C)C)CC1	ZINC000487333985	331966796	/nfs/dbraw/zinc/96/67/96/331966796.db2.gz	LDAKHVFBWSEVES-MRXNPFEDSA-N	0	0	291.822	4.258	20	30		CIEDRN
C=CC[C@@H](C(=O)NC[C@@H](C)c1ccccc1)c1ccccc1	ZINC000487624642	331977237	/nfs/dbraw/zinc/97/72/37/331977237.db2.gz	FCRMHJHIPGZPRL-VQIMIIECSA-N	0	0	293.410	4.266	20	30		CIEDRN
C=CC[C@@H](C(=O)N(C)Cc1cccc(C)c1)c1ccccc1	ZINC000487680926	331978892	/nfs/dbraw/zinc/97/88/92/331978892.db2.gz	XCWKIWBKXXJILU-LJQANCHMSA-N	0	0	293.410	4.313	20	30		CIEDRN
Cc1ccc2ncc(C#N)c(N3CCCC4(CCC4)C3)c2c1	ZINC000487721696	331979690	/nfs/dbraw/zinc/97/96/90/331979690.db2.gz	POQOKBYIVQAMNF-UHFFFAOYSA-N	0	0	291.398	4.185	20	30		CIEDRN
Cc1nc(N2CC[C@H](c3ccccc3)C[C@@H]2C)ccc1C#N	ZINC000487722284	331979747	/nfs/dbraw/zinc/97/97/47/331979747.db2.gz	QAHNGFTWYUZRJT-YOEHRIQHSA-N	0	0	291.398	4.034	20	30		CIEDRN
C=CC[C@@H](C(=O)NCc1ccc(C)c(F)c1)c1ccccc1	ZINC000487754650	331980585	/nfs/dbraw/zinc/98/05/85/331980585.db2.gz	CZLLGAQJXWVLHJ-QGZVFWFLSA-N	0	0	297.373	4.110	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@H]1CCc2ccccc21)c1ccccc1	ZINC000487794547	331981449	/nfs/dbraw/zinc/98/14/49/331981449.db2.gz	CGNLNFJZBFMRFP-OALUTQOASA-N	0	0	291.394	4.150	20	30		CIEDRN
Cc1nc(N2CCC[C@H](c3ccccc3)CC2)ccc1C#N	ZINC000488080132	331989547	/nfs/dbraw/zinc/98/95/47/331989547.db2.gz	AGZUKXLFCAGIEX-KRWDZBQOSA-N	0	0	291.398	4.036	20	30		CIEDRN
Cc1nc(N2CCCC[C@@H]2c2ccc(F)cc2)ccc1C#N	ZINC000488130740	331991319	/nfs/dbraw/zinc/99/13/19/331991319.db2.gz	WBTCELDCCNOCIQ-QGZVFWFLSA-N	0	0	295.361	4.132	20	30		CIEDRN
C=C(CC)CNc1cc(Cl)ccc1OC[C@H]1CCOC1	ZINC000488188996	331993121	/nfs/dbraw/zinc/99/31/21/331993121.db2.gz	XSQHPSNFYSATCB-ZDUSSCGKSA-N	0	0	295.810	4.133	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)Nc1cccc2ccc(C)nc21	ZINC000488250992	331996007	/nfs/dbraw/zinc/99/60/07/331996007.db2.gz	HLZFBZAQARCVBJ-HNNXBMFYSA-N	0	0	295.386	4.116	20	30		CIEDRN
Cc1ccc(OC(F)F)c(COc2cccc(C#N)c2)c1	ZINC000488265819	331996523	/nfs/dbraw/zinc/99/65/23/331996523.db2.gz	OFXJAIXCHJLMEG-UHFFFAOYSA-N	0	0	289.281	4.047	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1ccc(Cl)c(F)c1	ZINC000488363452	332002118	/nfs/dbraw/zinc/00/21/18/332002118.db2.gz	GLWMEACEGNDYNV-LLVKDONJSA-N	0	0	282.746	4.052	20	30		CIEDRN
Cc1cc(C)c(C#N)c(N[C@@H]2CCc3c2cccc3Cl)n1	ZINC000511714053	332940432	/nfs/dbraw/zinc/94/04/32/332940432.db2.gz	HUCBRRKRVAPDKD-MRXNPFEDSA-N	0	0	297.789	4.323	20	30		CIEDRN
N#Cc1ccc(C(F)(F)F)c(NCC2CC(F)(F)C2)c1	ZINC000488449503	332010138	/nfs/dbraw/zinc/01/01/38/332010138.db2.gz	NSRXATZYKIEURS-UHFFFAOYSA-N	0	0	290.235	4.034	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(N(C)Cc2cccc(C)c2C)c1	ZINC000488457999	332011100	/nfs/dbraw/zinc/01/11/00/332011100.db2.gz	JNNXCTQRDOMQSG-UHFFFAOYSA-N	0	0	292.382	4.014	20	30		CIEDRN
C=C1CCN([C@@H](C)c2ccc(Br)cc2)CC1	ZINC000488585394	332016596	/nfs/dbraw/zinc/01/65/96/332016596.db2.gz	UTRWCDKCYLARPT-LBPRGKRZSA-N	0	0	280.209	4.162	20	30		CIEDRN
C=C(C)CNC(=O)N1CCC[C@H]1c1ccc(C(C)C)cc1	ZINC000488547039	332016677	/nfs/dbraw/zinc/01/66/77/332016677.db2.gz	IAWVJRDVIZACFR-KRWDZBQOSA-N	0	0	286.419	4.233	20	30		CIEDRN
Cc1nc(C)c(C#N)c(SCc2cc3ccccc3o2)n1	ZINC000488634082	332020500	/nfs/dbraw/zinc/02/05/00/332020500.db2.gz	BYNCACKNZWOANZ-UHFFFAOYSA-N	0	0	295.367	4.004	20	30		CIEDRN
CCN(C[C@H](C)C#N)[C@H]1CCc2c1cc(Cl)cc2Cl	ZINC000488641672	332020785	/nfs/dbraw/zinc/02/07/85/332020785.db2.gz	FDTZCHKWJZERGX-BMIGLBTASA-N	0	0	297.229	4.462	20	30		CIEDRN
Cc1cccc2cc(C(=O)Nc3cc(C#N)ccc3C)oc21	ZINC000488658299	332021057	/nfs/dbraw/zinc/02/10/57/332021057.db2.gz	VCGMTJFDKHAMRX-UHFFFAOYSA-N	0	0	290.322	4.174	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1cccc(OCC)c1)c1ccccc1	ZINC000488660569	332021081	/nfs/dbraw/zinc/02/10/81/332021081.db2.gz	PCKJYAFOOFGCEK-SFHVURJKSA-N	0	0	295.382	4.384	20	30		CIEDRN
C=CCC[C@H](C(=O)N[C@@H](C)[C@H](C)CC)c1ccccc1	ZINC000488688577	332021645	/nfs/dbraw/zinc/02/16/45/332021645.db2.gz	IOIUQUAYGBKGHM-VYDXJSESSA-N	0	0	273.420	4.287	20	30		CIEDRN
CC[C@@H](CC1CCCCC1)C(=O)N[C@](C)(C#N)C(C)C	ZINC000488690881	332021759	/nfs/dbraw/zinc/02/17/59/332021759.db2.gz	GDQIVJLOKSNJSK-DOTOQJQBSA-N	0	0	278.440	4.037	20	30		CIEDRN
N#Cc1ccc(N[C@H]2CCCc3sc(Cl)cc32)cn1	ZINC000488763184	332024490	/nfs/dbraw/zinc/02/44/90/332024490.db2.gz	QGDDTOORWPBKBG-LBPRGKRZSA-N	0	0	289.791	4.158	20	30		CIEDRN
C=CCCC[C@@H](C)Sc1ccc(C(F)(F)F)nn1	ZINC000488785573	332025755	/nfs/dbraw/zinc/02/57/55/332025755.db2.gz	SILUWSCAKGOXCX-SECBINFHSA-N	0	0	276.327	4.332	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1ccc(C(C)(C)C)s1	ZINC000488812128	332026734	/nfs/dbraw/zinc/02/67/34/332026734.db2.gz	DZCYJKKTLQEQND-GFCCVEGCSA-N	0	0	277.433	4.226	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1cc(Cl)ccc1Cl	ZINC000488816436	332027015	/nfs/dbraw/zinc/02/70/15/332027015.db2.gz	NDKVGXQLHGUXTQ-LLVKDONJSA-N	0	0	284.186	4.174	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)[C@@H](C)Cc1cccc(Cl)c1	ZINC000488818713	332027312	/nfs/dbraw/zinc/02/73/12/332027312.db2.gz	RJAHQLATQXJQOB-BBRMVZONSA-N	0	0	291.822	4.086	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1csc2ccccc12	ZINC000488830963	332028109	/nfs/dbraw/zinc/02/81/09/332028109.db2.gz	ADIRKMJBGLCYNU-GFCCVEGCSA-N	0	0	271.385	4.082	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)c1cc(SC)ccc1Cl	ZINC000488839717	332028577	/nfs/dbraw/zinc/02/85/77/332028577.db2.gz	MYZLNZJXXULBLO-NSHDSACASA-N	0	0	295.835	4.243	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@@H]1C[C@@H]1c1ccccc1Cl	ZINC000488839425	332028609	/nfs/dbraw/zinc/02/86/09/332028609.db2.gz	NSKHEFNIILEQIF-BPLDGKMQSA-N	0	0	289.806	4.011	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)CCCc1c[nH]c2ccccc12	ZINC000488843508	332028764	/nfs/dbraw/zinc/02/87/64/332028764.db2.gz	UJLFLMRBWAWAFJ-INIZCTEOSA-N	0	0	296.414	4.058	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1cc(Cl)sc1Cl	ZINC000488850234	332029436	/nfs/dbraw/zinc/02/94/36/332029436.db2.gz	GYJABDRXBZWDMM-MRVPVSSYSA-N	0	0	290.215	4.236	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)C[C@H](CC)c1ccccc1	ZINC000488862090	332030019	/nfs/dbraw/zinc/03/00/19/332030019.db2.gz	HEXLEKDZQJSFJM-DOTOQJQBSA-N	0	0	271.404	4.137	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)CCc1ccc(C(C)C)cc1	ZINC000488864627	332030110	/nfs/dbraw/zinc/03/01/10/332030110.db2.gz	YULNKPWIJODDHK-GOSISDBHSA-N	0	0	285.431	4.310	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@@H](C)Cc1ccc(Cl)cc1	ZINC000488875456	332031105	/nfs/dbraw/zinc/03/11/05/332031105.db2.gz	DXIOGASEFJKDJS-XJKSGUPXSA-N	0	0	291.822	4.086	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)C[C@@H](C)c1ccc(CC)cc1	ZINC000488876461	332031226	/nfs/dbraw/zinc/03/12/26/332031226.db2.gz	FYWFMSBYKSCQSF-CRAIPNDOSA-N	0	0	285.431	4.310	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)[C@@H](C)Cc1ccccc1Cl	ZINC000488879921	332031661	/nfs/dbraw/zinc/03/16/61/332031661.db2.gz	POWQFSHQTPHBEX-DZGCQCFKSA-N	0	0	291.822	4.086	20	30		CIEDRN
C=C[C@H]1CCCCN1C(=O)CC/C=C\c1ccccc1	ZINC000488883877	332032042	/nfs/dbraw/zinc/03/20/42/332032042.db2.gz	XPBPOWSUAIZBAQ-NYDKFZDJSA-N	0	0	269.388	4.047	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)c1cccc(OCC=C(C)C)c1	ZINC000488888892	332032425	/nfs/dbraw/zinc/03/24/25/332032425.db2.gz	YVLFAFRNEVADPD-QGZVFWFLSA-N	0	0	299.414	4.212	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@H]1CCc2ccc(C(C)C)cc21	ZINC000488914388	332033490	/nfs/dbraw/zinc/03/34/90/332033490.db2.gz	JJSWPZTVNAATLF-DYVFJYSZSA-N	0	0	286.419	4.061	20	30		CIEDRN
C=CC[C@H](C)NC(=O)C[C@@H]1C[C@H](C)c2c1cccc2C	ZINC000488930009	332034133	/nfs/dbraw/zinc/03/41/33/332034133.db2.gz	DWGDDLZCSIUPHS-KKUMJFAQSA-N	0	0	271.404	4.057	20	30		CIEDRN
CCC[C@H](C(=O)Nc1ccc(C#N)cc1Cl)C(C)C	ZINC000489168945	332042581	/nfs/dbraw/zinc/04/25/81/332042581.db2.gz	FRFPPDVRQWWOCQ-LBPRGKRZSA-N	0	0	278.783	4.222	20	30		CIEDRN
C=C[C@H]1CCCCN1Cc1coc(-c2ccc(F)cc2)n1	ZINC000489391417	332049653	/nfs/dbraw/zinc/04/96/53/332049653.db2.gz	AFPBLEUPIDGCJO-INIZCTEOSA-N	0	0	286.350	4.021	20	30		CIEDRN
C=C[C@H]1CCCCN1Cc1nc(-c2ccsc2)oc1C	ZINC000489451959	332053598	/nfs/dbraw/zinc/05/35/98/332053598.db2.gz	VISFRTONCZWGAC-AWEZNQCLSA-N	0	0	288.416	4.252	20	30		CIEDRN
C=C[C@@H]1CCCCN1Cc1csc(C2CCCC2)n1	ZINC000489461770	332053793	/nfs/dbraw/zinc/05/37/93/332053793.db2.gz	JCUJOCWTSMQQPB-OAHLLOKOSA-N	0	0	276.449	4.341	20	30		CIEDRN
C=C[C@@H]1CCCC[N@@H+]1Cc1cnc(-c2ccccc2)s1	ZINC000489469105	332054615	/nfs/dbraw/zinc/05/46/15/332054615.db2.gz	CZAWZNTVMXDOOL-OAHLLOKOSA-N	0	0	284.428	4.351	20	30		CIEDRN
C=C[C@H]1CCCCN1Cc1coc(-c2ccc(C)cc2)n1	ZINC000489488746	332055852	/nfs/dbraw/zinc/05/58/52/332055852.db2.gz	UNEKKILOYKXXIQ-KRWDZBQOSA-N	0	0	282.387	4.191	20	30		CIEDRN
C=CCCC(=O)Nc1cccc(-c2cccc(OCC)c2)n1	ZINC000489501749	332056872	/nfs/dbraw/zinc/05/68/72/332056872.db2.gz	QKBMRVBWGVJEHE-UHFFFAOYSA-N	0	0	296.370	4.052	20	30		CIEDRN
C=CCn1cccc1C(=O)N(C)C1CCC(CCC)CC1	ZINC000489556835	332059160	/nfs/dbraw/zinc/05/91/60/332059160.db2.gz	BCITZVVJRSNTNY-UHFFFAOYSA-N	0	0	288.435	4.105	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)NCc1cc2ccccc2s1	ZINC000489570564	332059763	/nfs/dbraw/zinc/05/97/63/332059763.db2.gz	VZXJESTZOJBPQD-LBPRGKRZSA-N	0	0	273.401	4.120	20	30		CIEDRN
C=CCC[C@H](C(=O)Nc1ccc(C)nc1C)c1ccccc1	ZINC000489694681	332064982	/nfs/dbraw/zinc/06/49/82/332064982.db2.gz	BOBFIEKJSREGLC-KRWDZBQOSA-N	0	0	294.398	4.387	20	30		CIEDRN
CC(C)Oc1ccc(NC(=O)C[C@@H]2C=CCCC2)cc1C#N	ZINC000489731471	332066309	/nfs/dbraw/zinc/06/63/09/332066309.db2.gz	BBAUUBOJIKYRJL-CQSZACIVSA-N	0	0	298.386	4.030	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@H]1CCCC(F)(F)C1)c1ccccc1	ZINC000489758938	332067075	/nfs/dbraw/zinc/06/70/75/332067075.db2.gz	ZRCPDBOVCDUZKE-GJZGRUSLSA-N	0	0	293.357	4.040	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)C[C@@H](C)Cc1cccc(F)c1	ZINC000489766812	332067137	/nfs/dbraw/zinc/06/71/37/332067137.db2.gz	LDDWJFPRMGHDFS-AWEZNQCLSA-N	0	0	291.410	4.113	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)C[C@H](C)Cc1cccc(F)c1	ZINC000489766813	332067165	/nfs/dbraw/zinc/06/71/65/332067165.db2.gz	LDDWJFPRMGHDFS-CQSZACIVSA-N	0	0	291.410	4.113	20	30		CIEDRN
C=CC1CCN(C(=O)Nc2ccc(C3CCC3)cc2)CC1	ZINC000489788969	332067873	/nfs/dbraw/zinc/06/78/73/332067873.db2.gz	IZYRZXYZEKCSFW-UHFFFAOYSA-N	0	0	284.403	4.384	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@H](C)c1cn(C)c2ccccc12	ZINC000489907692	332072490	/nfs/dbraw/zinc/07/24/90/332072490.db2.gz	LKSZLJICRRHGHQ-CQSZACIVSA-N	0	0	298.430	4.000	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1scc(C)c1Cl	ZINC000489912528	332072828	/nfs/dbraw/zinc/07/28/28/332072828.db2.gz	WKNOIFVAWCEUCY-UHFFFAOYSA-N	0	0	271.813	4.042	20	30		CIEDRN
C[C@@H](CC1CCCCC1)C(=O)Nc1ccc(F)c(C#N)c1	ZINC000303614518	332942392	/nfs/dbraw/zinc/94/23/92/332942392.db2.gz	ZMWHSPNGYNVTBV-LBPRGKRZSA-N	0	0	288.366	4.242	20	30		CIEDRN
C[C@H](CC1CCCCC1)C(=O)Nc1cccc(C#N)c1	ZINC000303611307	332942430	/nfs/dbraw/zinc/94/24/30/332942430.db2.gz	YYNRFZJTNJCWLJ-CYBMUJFWSA-N	0	0	270.376	4.103	20	30		CIEDRN
CCC[C@@H](C(=O)NC(C#N)(CCC)CCC)C(C)C	ZINC000489960666	332074300	/nfs/dbraw/zinc/07/43/00/332074300.db2.gz	WFLBNPSCAIRZBB-CQSZACIVSA-N	0	0	266.429	4.037	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)c1ccc(C(C)C)nc1CC	ZINC000490001862	332076070	/nfs/dbraw/zinc/07/60/70/332076070.db2.gz	CFHCDZKVHIBVFX-UHFFFAOYSA-N	0	0	288.435	4.100	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)C1(c2ccccc2C)CCC1	ZINC000490004578	332076329	/nfs/dbraw/zinc/07/63/29/332076329.db2.gz	MQXLDEHXHXRRBD-UHFFFAOYSA-N	0	0	285.431	4.135	20	30		CIEDRN
C=CCn1cccc1C(=O)N(CC1CCC1)c1ccccc1	ZINC000490013614	332076502	/nfs/dbraw/zinc/07/65/02/332076502.db2.gz	DDODKHUMPSWFDY-UHFFFAOYSA-N	0	0	294.398	4.121	20	30		CIEDRN
C=CCN(C)C(=O)c1cc(-c2ccccc2)ccc1Cl	ZINC000490034915	332077521	/nfs/dbraw/zinc/07/75/21/332077521.db2.gz	PGJJBYLWYDLIIV-UHFFFAOYSA-N	0	0	285.774	4.265	20	30		CIEDRN
C=CCN(C)C(=O)C1(c2ccc(Cl)cc2)CCCCC1	ZINC000490054710	332079092	/nfs/dbraw/zinc/07/90/92/332079092.db2.gz	NPPXXVAOBNJASC-UHFFFAOYSA-N	0	0	291.822	4.186	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@H]1CCCC[C@H]1C(F)(F)F	ZINC000490060308	332079163	/nfs/dbraw/zinc/07/91/63/332079163.db2.gz	PGUWJKFLCNXCOP-NWDGAFQWSA-N	0	0	291.357	4.074	20	30		CIEDRN
C=CCN(C)C(=O)C(CC)(CC)c1ccc(Cl)cc1	ZINC000490060326	332079390	/nfs/dbraw/zinc/07/93/90/332079390.db2.gz	VNCIKJBEIWWUBA-UHFFFAOYSA-N	0	0	279.811	4.042	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@@H](C)CCc1cccc(F)c1	ZINC000490067585	332079845	/nfs/dbraw/zinc/07/98/45/332079845.db2.gz	OAKFASIREVNVSK-AWEZNQCLSA-N	0	0	291.410	4.113	20	30		CIEDRN
C=CCC(C)(C)CNC(=O)[C@@H](c1ccc(F)cc1)C(C)C	ZINC000490086023	332080846	/nfs/dbraw/zinc/08/08/46/332080846.db2.gz	FQWWKVDBMOKTKL-MRXNPFEDSA-N	0	0	291.410	4.284	20	30		CIEDRN
C=CCn1cccc1C(=O)N(C)c1cccc(C(C)C)c1	ZINC000490086887	332080852	/nfs/dbraw/zinc/08/08/52/332080852.db2.gz	HCAKYHRTFDWSKU-UHFFFAOYSA-N	0	0	282.387	4.074	20	30		CIEDRN
C=C(C)CNC(=O)Cc1coc2cc(C)c(C(C)C)cc12	ZINC000490086101	332080856	/nfs/dbraw/zinc/08/08/56/332080856.db2.gz	GKXZBHNPIZNTQA-UHFFFAOYSA-N	0	0	285.387	4.099	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)NCc1ccc(C(C)(F)F)cc1	ZINC000490163461	332083374	/nfs/dbraw/zinc/08/33/74/332083374.db2.gz	DSNLKYSZNAATPF-OAHLLOKOSA-N	0	0	281.346	4.017	20	30		CIEDRN
C[C@H](C#N)CN(C)[C@@H]1CCc2c1cc(Cl)cc2Cl	ZINC000490189536	332083900	/nfs/dbraw/zinc/08/39/00/332083900.db2.gz	ZEJBOCDTYWNJOI-YMTOWFKASA-N	0	0	283.202	4.072	20	30		CIEDRN
C=C(C)CN(CC)C(=O)C1(c2ccccc2F)CCCC1	ZINC000490186527	332083928	/nfs/dbraw/zinc/08/39/28/332083928.db2.gz	CTUMCXTWTYCWJQ-UHFFFAOYSA-N	0	0	289.394	4.062	20	30		CIEDRN
C=CC[C@H](C(=O)N1CC[C@H](C(C)(C)C)C1)c1ccccc1	ZINC000490251454	332085321	/nfs/dbraw/zinc/08/53/21/332085321.db2.gz	POHUOUFEVACEHS-IRXDYDNUSA-N	0	0	285.431	4.241	20	30		CIEDRN
C=CCC[C@H](C(=O)N[C@H](C)CC(F)(F)F)c1ccccc1	ZINC000490260454	332085654	/nfs/dbraw/zinc/08/56/54/332085654.db2.gz	PKKCTGHBZFSUSK-OCCSQVGLSA-N	0	0	299.336	4.194	20	30		CIEDRN
C=CCN(C)C(=O)c1ccc(Sc2ccccc2C)cc1	ZINC000490905539	332128214	/nfs/dbraw/zinc/12/82/14/332128214.db2.gz	BXYLAENUCYTNMH-UHFFFAOYSA-N	0	0	297.423	4.404	20	30		CIEDRN
C[C@H](CNc1ccc(Cl)cc1C#N)Oc1ccccc1	ZINC000303682734	332947601	/nfs/dbraw/zinc/94/76/01/332947601.db2.gz	ZHLUWSLOVCVRHJ-GFCCVEGCSA-N	0	0	286.762	4.091	20	30		CIEDRN
C#C[C@H](N[C@@H](C)c1cc(C)ccn1)c1ccc(Cl)cc1	ZINC000491496723	332223200	/nfs/dbraw/zinc/22/32/00/332223200.db2.gz	SLSYKSIUGTUSBK-BBRMVZONSA-N	0	0	284.790	4.069	20	30		CIEDRN
N#Cc1ccc(N[C@@H](c2ccccc2)[C@@H]2CCCO2)c(F)c1	ZINC000172144761	335095964	/nfs/dbraw/zinc/09/59/64/335095964.db2.gz	QGSQMVITJNGLFF-ROUUACIJSA-N	0	0	296.345	4.030	20	30		CIEDRN
N#Cc1ccc(N[C@H](c2ccccc2)[C@H]2CCCO2)c(F)c1	ZINC000172144776	335095967	/nfs/dbraw/zinc/09/59/67/335095967.db2.gz	QGSQMVITJNGLFF-QZTJIDSGSA-N	0	0	296.345	4.030	20	30		CIEDRN
Cc1c(NCc2cccc(C#N)c2)cccc1-c1ncco1	ZINC000491557140	332238199	/nfs/dbraw/zinc/23/81/99/332238199.db2.gz	BDEYUNBNCWSVBT-UHFFFAOYSA-N	0	0	289.338	4.134	20	30		CIEDRN
Cc1c(NCc2ccccc2C#N)cccc1-c1ncco1	ZINC000491571667	332240786	/nfs/dbraw/zinc/24/07/86/332240786.db2.gz	GRCPWHOAVJGXCT-UHFFFAOYSA-N	0	0	289.338	4.134	20	30		CIEDRN
C#CCN(C(=O)Nc1cccc(C(F)F)c1)C1CCCC1	ZINC000491665211	332273879	/nfs/dbraw/zinc/27/38/79/332273879.db2.gz	PGCSAVAADDNZNW-UHFFFAOYSA-N	0	0	292.329	4.034	20	30		CIEDRN
C#C[C@@H](NCc1ccc(SC)s1)c1ccc(F)cc1	ZINC000491780072	332344744	/nfs/dbraw/zinc/34/47/44/332344744.db2.gz	IARAXRNUALJWTG-CQSZACIVSA-N	0	0	291.416	4.073	20	30		CIEDRN
C/C=C(/C=C/C(=O)N(Cc1ccc(C#N)cc1)C(C)C)CC	ZINC000492156625	332385002	/nfs/dbraw/zinc/38/50/02/332385002.db2.gz	JYIGGMADYDVJIB-DBPMKKMDSA-N	0	0	296.414	4.208	20	30		CIEDRN
C=CCCCC(=O)N1CC[C@H](C(F)(F)F)c2ccccc21	ZINC000492292497	332391141	/nfs/dbraw/zinc/39/11/41/332391141.db2.gz	OENCIYUCDVRBEP-ZDUSSCGKSA-N	0	0	297.320	4.426	20	30		CIEDRN
N#Cc1ccc(OCCCCC2CCOCC2)c(Cl)c1	ZINC000379858833	335104697	/nfs/dbraw/zinc/10/46/97/335104697.db2.gz	XDRPBMDZWXNCAO-UHFFFAOYSA-N	0	0	293.794	4.187	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)/C=C\c1cnc(C)s1	ZINC000492898047	332417747	/nfs/dbraw/zinc/41/77/47/332417747.db2.gz	MHPAHSZVMQSGJZ-KHPPLWFESA-N	0	0	298.411	4.222	20	30		CIEDRN
COc1ccc(C#N)cc1N[C@@H](C)c1cc(F)ccc1F	ZINC000493838813	332456122	/nfs/dbraw/zinc/45/61/22/332456122.db2.gz	ZJFDOKAASFZQHO-JTQLQIEISA-N	0	0	288.297	4.018	20	30		CIEDRN
Cc1ccc(N[C@H]2CCC[C@@H](C#N)C2)cc1OC(C)C	ZINC000494485042	332475369	/nfs/dbraw/zinc/47/53/69/332475369.db2.gz	QUYDPLAJUBJUBR-CABCVRRESA-N	0	0	272.392	4.277	20	30		CIEDRN
C=CCCN(C)C(=O)Nc1cc(Cl)c(F)c(Cl)c1	ZINC000494869707	332488845	/nfs/dbraw/zinc/48/88/45/332488845.db2.gz	FFJHWXLALRTKJQ-UHFFFAOYSA-N	0	0	291.153	4.172	20	30		CIEDRN
C=CCSc1ccccc1NC(=O)CSCC(C)C	ZINC000495174513	332510605	/nfs/dbraw/zinc/51/06/05/332510605.db2.gz	HMJGCTIUXWRQQU-UHFFFAOYSA-N	0	0	295.473	4.292	20	30		CIEDRN
CCC[C@@H](C(=O)N[C@H](C#N)c1ccccc1Cl)C(C)C	ZINC000495520991	332521738	/nfs/dbraw/zinc/52/17/38/332521738.db2.gz	KEIVQIXTAFKHCB-IUODEOHRSA-N	0	0	292.810	4.093	20	30		CIEDRN
Cc1ccc([C@@H](C)N(C)c2ccc(C#N)cc2)cc1	ZINC000498848971	332574207	/nfs/dbraw/zinc/57/42/07/332574207.db2.gz	GYECAPQABLCRCT-CQSZACIVSA-N	0	0	250.345	4.064	20	30		CIEDRN
C=C[C@@H](C)NC(=O)C12CC3(C)CC(C)(CC(C)(C3)C1)C2	ZINC000498959549	332576269	/nfs/dbraw/zinc/57/62/69/332576269.db2.gz	BWFFSBHKVOOFSM-MZHSRFCDSA-N	0	0	275.436	4.064	20	30		CIEDRN
C=CCN(C(=O)c1ccc(Cl)c(F)c1)c1ccccc1	ZINC000499284927	332583645	/nfs/dbraw/zinc/58/36/45/332583645.db2.gz	UDUIAFSXPCRKKB-UHFFFAOYSA-N	0	0	289.737	4.312	20	30		CIEDRN
COc1cc(C#N)ccc1CSc1ccccc1C	ZINC000499299246	332583761	/nfs/dbraw/zinc/58/37/61/332583761.db2.gz	HSYRTCDKLAUEIO-UHFFFAOYSA-N	0	0	269.369	4.168	20	30		CIEDRN
CC(C)CN(C(=O)c1ccccc1F)c1ccc(C#N)cc1	ZINC000499318052	332584193	/nfs/dbraw/zinc/58/41/93/332584193.db2.gz	WGQMTAFMQYGTMR-UHFFFAOYSA-N	0	0	296.345	4.000	20	30		CIEDRN
C=CCN(C(=O)c1ccc(C)c(OCC)c1)c1ccccc1	ZINC000499473253	332586494	/nfs/dbraw/zinc/58/64/94/332586494.db2.gz	RSTJKQCHSKEHEC-UHFFFAOYSA-N	0	0	295.382	4.227	20	30		CIEDRN
CCC[C@H](C)CC(=O)Nc1cc(C#N)ccc1OC(C)C	ZINC000499779704	332593359	/nfs/dbraw/zinc/59/33/59/332593359.db2.gz	OHUITVKNXWYEPZ-ZDUSSCGKSA-N	0	0	288.391	4.110	20	30		CIEDRN
C=CCC[C@@H](NC(=O)N1CC(C2CCC2)C1)c1ccccc1	ZINC000500186278	332602039	/nfs/dbraw/zinc/60/20/39/332602039.db2.gz	QCZMXXGEYJRYMG-GOSISDBHSA-N	0	0	298.430	4.135	20	30		CIEDRN
C=CCC1(C(=O)N2CCCc3cc(Cl)ccc32)CCC1	ZINC000500196704	332602439	/nfs/dbraw/zinc/60/24/39/332602439.db2.gz	GVEIARIXZCIZGE-UHFFFAOYSA-N	0	0	289.806	4.366	20	30		CIEDRN
Cc1ccc(C#N)c(N[C@@H](c2ccc(Cl)cc2)C2CC2)n1	ZINC000500280811	332604143	/nfs/dbraw/zinc/60/41/43/332604143.db2.gz	OGAISGMGFMGCSJ-MRXNPFEDSA-N	0	0	297.789	4.478	20	30		CIEDRN
Cc1ccc(C#N)c(NC[C@H]2CCCC[C@@H]2C(F)(F)F)n1	ZINC000500296327	332604286	/nfs/dbraw/zinc/60/42/86/332604286.db2.gz	KKAWGPYKUQNSDM-OLZOCXBDSA-N	0	0	297.324	4.042	20	30		CIEDRN
CC[C@@H]1C[C@]1(NCc1ccccc1C#N)c1cccc(C)c1	ZINC000500503565	332611506	/nfs/dbraw/zinc/61/15/06/332611506.db2.gz	OPINCTXHGOBCFS-UYAOXDASSA-N	0	0	290.410	4.282	20	30		CIEDRN
COc1ccc2oc(CNc3cc(C#N)ccc3C)cc2c1	ZINC000500978588	332623370	/nfs/dbraw/zinc/62/33/70/332623370.db2.gz	UOPPCEJFEOPZOQ-UHFFFAOYSA-N	0	0	292.338	4.234	20	30		CIEDRN
CCOc1ccc(C#N)cc1NCc1ccc([C@@H]2C[C@H]2C)o1	ZINC000500997350	332623837	/nfs/dbraw/zinc/62/38/37/332623837.db2.gz	HLHBHDAMFZCZBH-IUODEOHRSA-N	0	0	296.370	4.285	20	30		CIEDRN
Cc1ccc([C@H]2CCC[C@@H]2N(C)C(=O)CC(C)(C)C#N)cc1	ZINC000501271233	332629733	/nfs/dbraw/zinc/62/97/33/332629733.db2.gz	CRAVMPLMCDZZII-SJORKVTESA-N	0	0	298.430	4.029	20	30		CIEDRN
C=CCCCC(=O)N[C@]1(c2cccc(C)c2)C[C@H]1CC	ZINC000501629191	332637082	/nfs/dbraw/zinc/63/70/82/332637082.db2.gz	LPMVZCZYRHHREH-CRAIPNDOSA-N	0	0	271.404	4.093	20	30		CIEDRN
N#Cc1ccc(C(=O)Nc2cccc3ccsc32)s1	ZINC000501689502	332638808	/nfs/dbraw/zinc/63/88/08/332638808.db2.gz	NEZKXXKZYIRGOS-UHFFFAOYSA-N	0	0	284.365	4.087	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(C(C)(C)C)cc1O	ZINC000501967427	332643780	/nfs/dbraw/zinc/64/37/80/332643780.db2.gz	PVYQNVMPCQFOMN-LBPRGKRZSA-N	0	0	275.392	4.231	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(C(C)(C)C)cc1O	ZINC000501967426	332644183	/nfs/dbraw/zinc/64/41/83/332644183.db2.gz	PVYQNVMPCQFOMN-GFCCVEGCSA-N	0	0	275.392	4.231	20	30		CIEDRN
Cc1cc(/C=C\c2ccc(C#N)cn2)ccc1Cl	ZINC000502761961	332672379	/nfs/dbraw/zinc/67/23/79/332672379.db2.gz	XIGZSYKUAFFLER-DJWKRKHSSA-N	0	0	254.720	4.086	20	30		CIEDRN
CCCC[C@H](C)C(=O)Nc1cc(C#N)ccc1NCCC	ZINC000502969521	332677211	/nfs/dbraw/zinc/67/72/11/332677211.db2.gz	MIXCHUIFVDMPLE-ZDUSSCGKSA-N	0	0	287.407	4.145	20	30		CIEDRN
CCc1c(C)sc(NC(=O)[C@H](C)[C@@H](C)CC)c1C#N	ZINC000503027734	332678943	/nfs/dbraw/zinc/67/89/43/332678943.db2.gz	PMYYUELGIAKAOL-VHSXEESVSA-N	0	0	278.421	4.111	20	30		CIEDRN
N#Cc1c(Cl)cccc1NCc1cc(F)cc(F)c1	ZINC000503057789	332679988	/nfs/dbraw/zinc/67/99/88/332679988.db2.gz	UEPLJJWUZUSUDG-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N1CC(C)(C)[C@@H]1c1cccs1	ZINC000504079230	332703502	/nfs/dbraw/zinc/70/35/02/332703502.db2.gz	VASWMZQTLGUKCX-JSGCOSHPSA-N	0	0	292.448	4.195	20	30		CIEDRN
Cc1ccc(/C=C\c2ccc(C#N)cn2)cc1Br	ZINC000504396150	332711042	/nfs/dbraw/zinc/71/10/42/332711042.db2.gz	XTJJLQSBHPQTGC-XQRVVYSFSA-N	0	0	299.171	4.195	20	30		CIEDRN
CC(C)(CC1CCCCCC1)NC(=O)c1ccc(C#N)o1	ZINC000504439148	332712007	/nfs/dbraw/zinc/71/20/07/332712007.db2.gz	SPPAAJGRTTUEJI-UHFFFAOYSA-N	0	0	288.391	4.020	20	30		CIEDRN
CC(C)C[C@](C)(C#N)NC(=O)C[C@H](C)C1CCCCC1	ZINC000504568731	332715213	/nfs/dbraw/zinc/71/52/13/332715213.db2.gz	UCPOCRGNQKRURO-WMLDXEAASA-N	0	0	278.440	4.037	20	30		CIEDRN
C=CC[C@@H](C(=O)NC1CC(C(C)(C)C)C1)c1ccccc1	ZINC000504866877	332723133	/nfs/dbraw/zinc/72/31/33/332723133.db2.gz	GTNIJGYQYWJCIT-OFLPRAFFSA-N	0	0	285.431	4.287	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)Nc1cccc(OC)c1	ZINC000505001587	332727567	/nfs/dbraw/zinc/72/75/67/332727567.db2.gz	VWARDBCQFSCPSU-UHFFFAOYSA-N	0	0	296.370	4.458	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N[C@H](CC)CC=C	ZINC000505016852	332727961	/nfs/dbraw/zinc/72/79/61/332727961.db2.gz	MWEZOKDPESVUII-OAHLLOKOSA-N	0	0	272.392	4.281	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N(CC)CCC1CC1	ZINC000505037917	332728768	/nfs/dbraw/zinc/72/87/68/332728768.db2.gz	GGKRFHYJWUKHMQ-UHFFFAOYSA-N	0	0	286.419	4.459	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CCc2ccccc21	ZINC000505058208	332729320	/nfs/dbraw/zinc/72/93/20/332729320.db2.gz	RBTPOTRWJHGPLW-UHFFFAOYSA-N	0	0	292.382	4.400	20	30		CIEDRN
C=CCCc1ccccc1NC(=O)N1CCCC12CCC2	ZINC000505058682	332729642	/nfs/dbraw/zinc/72/96/42/332729642.db2.gz	YTGHXGWASGKYNY-UHFFFAOYSA-N	0	0	284.403	4.356	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1coc2ccc(CC)cc12	ZINC000505356132	332738833	/nfs/dbraw/zinc/73/88/33/332738833.db2.gz	RGZLFIALJDXNSE-UHFFFAOYSA-N	0	0	271.360	4.033	20	30		CIEDRN
C=C(C)CCSc1nc2ccccc2c(=O)n1C(C)C	ZINC000505439253	332740615	/nfs/dbraw/zinc/74/06/15/332740615.db2.gz	VZGDKTZHKAOVDY-UHFFFAOYSA-N	0	0	288.416	4.036	20	30		CIEDRN
CC(C)(C)CC(=O)N[C@@H](C#N)c1c(Cl)cccc1Cl	ZINC000505541336	332743531	/nfs/dbraw/zinc/74/35/31/332743531.db2.gz	XJGJKEUSSMTJJR-NSHDSACASA-N	0	0	299.201	4.110	20	30		CIEDRN
C=C(C)CCOc1ccc(Oc2nccs2)cc1	ZINC000505563290	332744124	/nfs/dbraw/zinc/74/41/24/332744124.db2.gz	CYOWQTRYYYOKFD-UHFFFAOYSA-N	0	0	261.346	4.280	20	30		CIEDRN
C=C(C)CCOc1cccc(Oc2cccnc2)c1	ZINC000505565130	332744425	/nfs/dbraw/zinc/74/44/25/332744425.db2.gz	SMPOSHMWEWAWCL-UHFFFAOYSA-N	0	0	255.317	4.219	20	30		CIEDRN
C=C(C)CCOc1ccc(Oc2ccccn2)cc1	ZINC000505655883	332748243	/nfs/dbraw/zinc/74/82/43/332748243.db2.gz	CCSOTLOHXLKAMQ-UHFFFAOYSA-N	0	0	255.317	4.219	20	30		CIEDRN
N#Cc1ccc(SCc2ccccc2C(F)(F)F)nc1	ZINC000505664369	332748563	/nfs/dbraw/zinc/74/85/63/332748563.db2.gz	SRJISIODMMJILW-UHFFFAOYSA-N	0	0	294.301	4.264	20	30		CIEDRN
C[C@@H](CC(=O)N[C@H](C#N)c1ccc(Cl)cc1)C(C)(C)C	ZINC000505800638	332752885	/nfs/dbraw/zinc/75/28/85/332752885.db2.gz	DFKQWPWWXXHJQE-SMDDNHRTSA-N	0	0	292.810	4.093	20	30		CIEDRN
C[C@@H](Cc1cccc(Cl)c1)C(=O)Nc1ccccc1C#N	ZINC000164743841	334886481	/nfs/dbraw/zinc/88/64/81/334886481.db2.gz	ZPWVHHZQZRALQG-LBPRGKRZSA-N	0	0	298.773	4.029	20	30		CIEDRN
COc1ccc(C)cc1N[C@@H](C)c1ccc(C#N)cc1F	ZINC000512289308	332961216	/nfs/dbraw/zinc/96/12/16/332961216.db2.gz	RXIQDUPRBUPBRJ-LBPRGKRZSA-N	0	0	284.334	4.188	20	30		CIEDRN
Cc1ccc(F)c(N[C@H](C)c2ccc(C#N)cc2F)c1	ZINC000512282089	332961320	/nfs/dbraw/zinc/96/13/20/332961320.db2.gz	TYANNPYFYNQEPO-LLVKDONJSA-N	0	0	272.298	4.318	20	30		CIEDRN
COc1ccc(F)cc1N[C@H](C)c1ccc(C#N)cc1F	ZINC000512295952	332961882	/nfs/dbraw/zinc/96/18/82/332961882.db2.gz	OLUIPXMDTROWNS-SNVBAGLBSA-N	0	0	288.297	4.018	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)N[C@@H](CC(C)C)c1ccccc1C	ZINC000512324253	332963012	/nfs/dbraw/zinc/96/30/12/332963012.db2.gz	RBVAEYIKIUQDJU-FUHWJXTLSA-N	0	0	286.419	4.138	20	30		CIEDRN
N#Cc1ccc(/C=C/c2cc(Cl)ccc2Cl)nc1	ZINC000512325603	332963281	/nfs/dbraw/zinc/96/32/81/332963281.db2.gz	LTLIOHCFSDKTBP-GORDUTHDSA-N	0	0	275.138	4.430	20	30		CIEDRN
C=C(C)[C@H](CC(=O)N1CC[C@@H](C(C)(C)C)C[C@H]1C)OCC	ZINC000572515840	332965143	/nfs/dbraw/zinc/96/51/43/332965143.db2.gz	SXWKFOJKCMTKSZ-OAGGEKHMSA-N	0	0	295.467	4.031	20	30		CIEDRN
N#Cc1cccc(CSCCCCC2CCOCC2)c1	ZINC000512378926	332965648	/nfs/dbraw/zinc/96/56/48/332965648.db2.gz	WWAJKDHJTQGVQS-UHFFFAOYSA-N	0	0	289.444	4.388	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc(Oc2ccccn2)cc1	ZINC000575766725	335113569	/nfs/dbraw/zinc/11/35/69/335113569.db2.gz	BUBIKKNBOKLZBW-UHFFFAOYSA-N	0	0	296.370	4.415	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N(C)[C@H](C)C1CCCCC1	ZINC000512726273	332981952	/nfs/dbraw/zinc/98/19/52/332981952.db2.gz	VPHXMVQNGXTIIS-CZUORRHYSA-N	0	0	251.414	4.016	20	30		CIEDRN
C=CC[C@H](C)NC(=O)[C@@H](C)c1cccc(CC(C)C)c1	ZINC000512745485	332983104	/nfs/dbraw/zinc/98/31/04/332983104.db2.gz	ZGENCOITLJUXRI-GJZGRUSLSA-N	0	0	273.420	4.069	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc(C(C)(C)C)cc1O	ZINC000512904471	332993272	/nfs/dbraw/zinc/99/32/72/332993272.db2.gz	UZROCKUXKKJVKN-UHFFFAOYSA-N	0	0	275.392	4.231	20	30		CIEDRN
C=CCN(CC=C)C(=O)N[C@H](CC)c1ccc(Cl)s1	ZINC000513079615	333003188	/nfs/dbraw/zinc/00/31/88/333003188.db2.gz	ARQHFTRXSYSNIX-LLVKDONJSA-N	0	0	298.839	4.236	20	30		CIEDRN
N#Cc1ccc(OC[C@@H]2CCC(F)(F)C2)c(Cl)c1	ZINC000305999379	333003216	/nfs/dbraw/zinc/00/32/16/333003216.db2.gz	NHDWYELTQQGJHT-SNVBAGLBSA-N	0	0	271.694	4.026	20	30		CIEDRN
C=C(C)CCN[C@H](c1c[nH]c2ccccc21)C(F)(F)F	ZINC000513158108	333006655	/nfs/dbraw/zinc/00/66/55/333006655.db2.gz	GCVRVIDPLGJKLJ-CQSZACIVSA-N	0	0	282.309	4.327	20	30		CIEDRN
CC[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)C(C)C	ZINC000513228223	333009824	/nfs/dbraw/zinc/00/98/24/333009824.db2.gz	IZZRJNWDBJVPBJ-OAHLLOKOSA-N	0	0	287.407	4.044	20	30		CIEDRN
N#Cc1ccc(F)c(CNc2ccccc2OCC2CC2)c1	ZINC000174890362	333009983	/nfs/dbraw/zinc/00/99/83/333009983.db2.gz	CJPLIXNFBHNZJX-UHFFFAOYSA-N	0	0	296.345	4.098	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1cc(C(F)(F)F)ccc1C	ZINC000174913334	333010617	/nfs/dbraw/zinc/01/06/17/333010617.db2.gz	ZXAFCMMAKIYAIR-SNVBAGLBSA-N	0	0	286.297	4.100	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](CC(C)C)c1nc2ccccc2[nH]1	ZINC000175137461	333015374	/nfs/dbraw/zinc/01/53/74/333015374.db2.gz	GHVGUQGJVCPLJR-INIZCTEOSA-N	0	0	299.418	4.123	20	30		CIEDRN
C=CCCCC(=O)N(C)Cc1cccc2ccccc21	ZINC000175237849	333018231	/nfs/dbraw/zinc/01/82/31/333018231.db2.gz	YRNZLFWEUXYKHJ-UHFFFAOYSA-N	0	0	267.372	4.155	20	30		CIEDRN
C=CCCCC(=O)NC1CCC(c2ccccc2)CC1	ZINC000175248343	333018522	/nfs/dbraw/zinc/01/85/22/333018522.db2.gz	XXACGSLJJSOFJZ-UHFFFAOYSA-N	0	0	271.404	4.185	20	30		CIEDRN
CC[C@@H](CC1CCCC1)C(=O)N(CCC#N)CC(C)(C)C	ZINC000513437465	333019258	/nfs/dbraw/zinc/01/92/58/333019258.db2.gz	MROZLVNMSHGDNN-INIZCTEOSA-N	0	0	292.467	4.381	20	30		CIEDRN
C=CCCCC(=O)N(Cc1ccc([C@H]2C[C@@H]2C)o1)C1CC1	ZINC000175275997	333019396	/nfs/dbraw/zinc/01/93/96/333019396.db2.gz	ZDDGNTXNUCLKIL-BBRMVZONSA-N	0	0	287.403	4.250	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](C)c1cc2ccccc2s1	ZINC000175597664	333026942	/nfs/dbraw/zinc/02/69/42/333026942.db2.gz	DKOAHAMDGPADQM-LBPRGKRZSA-N	0	0	273.401	4.435	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](C)Cc1ccc(C(F)(F)F)cc1	ZINC000175630318	333027480	/nfs/dbraw/zinc/02/74/80/333027480.db2.gz	SCGDUXRGZJYFDN-LBPRGKRZSA-N	0	0	299.336	4.109	20	30		CIEDRN
C=CCCCC(=O)N1C[C@@H](c2ccccc2C)C[C@H]1C	ZINC000175725692	333031096	/nfs/dbraw/zinc/03/10/96/333031096.db2.gz	FILTYLXSXPUZIE-CVEARBPZSA-N	0	0	271.404	4.056	20	30		CIEDRN
CCN(C(=O)[C@H]1CCC(C)(C)C1)[C@H](C)c1ccc(C#N)cc1	ZINC000513709326	333034437	/nfs/dbraw/zinc/03/44/37/333034437.db2.gz	FWRFDLXCIDHMCB-PBHICJAKSA-N	0	0	298.430	4.294	20	30		CIEDRN
CC(C)(C)CN(CCC#N)Cc1ccc(C(F)(F)F)cc1	ZINC000513725940	333035700	/nfs/dbraw/zinc/03/57/00/333035700.db2.gz	UQIPFOKIAVODPB-UHFFFAOYSA-N	0	0	298.352	4.467	20	30		CIEDRN
CC(C)(C#N)c1ccc(NC(=O)[C@H]2CCC(C)(C)C2)cc1	ZINC000513725211	333035809	/nfs/dbraw/zinc/03/58/09/333035809.db2.gz	OUTAMVPXQFRIKI-ZDUSSCGKSA-N	0	0	284.403	4.253	20	30		CIEDRN
CC(C)CCN(C/C=C\c1ccc(F)cc1)CCC#N	ZINC000513736965	333036678	/nfs/dbraw/zinc/03/66/78/333036678.db2.gz	QFASMCLNNRPNOK-HYXAFXHYSA-N	0	0	274.383	4.101	20	30		CIEDRN
N#CCCN(Cc1cccc(OC2CCCC2)c1)CC1CC1	ZINC000513745688	333037159	/nfs/dbraw/zinc/03/71/59/333037159.db2.gz	DSOFRVZGVQYETE-UHFFFAOYSA-N	0	0	298.430	4.134	20	30		CIEDRN
Cc1ccc([C@@H]2CCCN2c2nc(C)cc(C)c2C#N)s1	ZINC000513748992	333037485	/nfs/dbraw/zinc/03/74/85/333037485.db2.gz	MRLMEXHALQPUGK-HNNXBMFYSA-N	0	0	297.427	4.282	20	30		CIEDRN
C=CCCCC(=O)N1CC[C@@H](C)C[C@@H]1c1ccc(CC)o1	ZINC000176107133	333039508	/nfs/dbraw/zinc/03/95/08/333039508.db2.gz	IOQCXNNLIUEUPT-GDBMZVCRSA-N	0	0	289.419	4.498	20	30		CIEDRN
C[C@@H](SCc1ccc([N+](=O)[O-])cc1)c1ccc(C#N)cc1	ZINC000513813639	333040558	/nfs/dbraw/zinc/04/05/58/333040558.db2.gz	ILMRMDSBOAOFEO-GFCCVEGCSA-N	0	0	298.367	4.461	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(CNc2ccccc2)cc1	ZINC000176288234	333040853	/nfs/dbraw/zinc/04/08/53/333040853.db2.gz	QMQAKTMAPGWCLQ-UHFFFAOYSA-N	0	0	280.371	4.203	20	30		CIEDRN
C=CCCCC(=O)N1CCc2cc(-c3ccccc3)oc2C1	ZINC000176411049	333041750	/nfs/dbraw/zinc/04/17/50/333041750.db2.gz	ACYFYTXYPKWTEP-UHFFFAOYSA-N	0	0	295.382	4.188	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](C)c1c(F)cccc1Cl	ZINC000176515624	333042607	/nfs/dbraw/zinc/04/26/07/333042607.db2.gz	JQXVCJZSEIGCOI-JTQLQIEISA-N	0	0	269.747	4.013	20	30		CIEDRN
C=CC[C@H](C)[NH2+]Cc1ccc(F)c(Cl)c1Cl	ZINC000309755193	333048603	/nfs/dbraw/zinc/04/86/03/333048603.db2.gz	LHWNNFGXUNUXSD-QMMMGPOBSA-N	0	0	262.155	4.187	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(Cl)cc1OCC	ZINC000177172806	333054536	/nfs/dbraw/zinc/05/45/36/333054536.db2.gz	QQZYQQKRYGMXFD-UHFFFAOYSA-N	0	0	267.756	4.034	20	30		CIEDRN
C[C@H](C#N)CN(C)Cc1ccccc1Oc1ccccc1	ZINC000513957670	333054698	/nfs/dbraw/zinc/05/46/98/333054698.db2.gz	COCYYHXOMWSTKY-OAHLLOKOSA-N	0	0	280.371	4.070	20	30		CIEDRN
Cc1cc(NCCC(C)(C)C#N)c(F)cc1Br	ZINC000310358014	333057670	/nfs/dbraw/zinc/05/76/70/333057670.db2.gz	IXBZSEKBQRFUBF-UHFFFAOYSA-N	0	0	299.187	4.248	20	30		CIEDRN
N#Cc1ccc(NC[C@H]2CCC(F)(F)C2)cc1Cl	ZINC000310408145	333058289	/nfs/dbraw/zinc/05/82/89/333058289.db2.gz	HHOCITJJXQPWDN-VIFPVBQESA-N	0	0	270.710	4.059	20	30		CIEDRN
N#Cc1ccccc1SCc1ccn(-c2ccccc2)n1	ZINC000172681486	335118748	/nfs/dbraw/zinc/11/87/48/335118748.db2.gz	SCRSXUAKAADAFP-UHFFFAOYSA-N	0	0	291.379	4.036	20	30		CIEDRN
N#Cc1ccccc1SCc1cccc2cccnc21	ZINC000172680030	335118809	/nfs/dbraw/zinc/11/88/09/335118809.db2.gz	LIQZQWUQOXGWQA-UHFFFAOYSA-N	0	0	276.364	4.399	20	30		CIEDRN
C=CCCCC(=O)N(C1CC1)[C@@H]1CCc2ccccc21	ZINC000177775531	333062917	/nfs/dbraw/zinc/06/29/17/333062917.db2.gz	PQDHBWSTQYJOAC-QGZVFWFLSA-N	0	0	269.388	4.021	20	30		CIEDRN
Cc1ccc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)c(C)c1	ZINC000177775422	333062921	/nfs/dbraw/zinc/06/29/21/333062921.db2.gz	LYTMRECOFQCPQP-AWEZNQCLSA-N	0	0	298.411	4.373	20	30		CIEDRN
C=CCCCC(=O)Nc1ccc(-c2nc(C(C)C)no2)cc1	ZINC000177799728	333063355	/nfs/dbraw/zinc/06/33/55/333063355.db2.gz	VGLOXTYLQNJTDO-UHFFFAOYSA-N	0	0	299.374	4.155	20	30		CIEDRN
C=CCCCC(=O)N(Cc1ccccc1)[C@H](C)C1CC1	ZINC000177835781	333063719	/nfs/dbraw/zinc/06/37/19/333063719.db2.gz	YYLDUXDXAAWXTN-OAHLLOKOSA-N	0	0	271.404	4.170	20	30		CIEDRN
C=CCCCC(=O)Nc1ccccc1SC(C)C	ZINC000178049298	333067207	/nfs/dbraw/zinc/06/72/07/333067207.db2.gz	QGNHXUIKCVZJLN-UHFFFAOYSA-N	0	0	263.406	4.482	20	30		CIEDRN
N#Cc1ccc(NC(=O)C2CCCCCC2)cc1Cl	ZINC000311346011	333067447	/nfs/dbraw/zinc/06/74/47/333067447.db2.gz	KDYRIJPWAWOUOF-UHFFFAOYSA-N	0	0	276.767	4.121	20	30		CIEDRN
CCC[C@H](C)[C@H]1CCCN1C(=O)Nc1cc(C#N)ccc1C	ZINC000178141161	333068277	/nfs/dbraw/zinc/06/82/77/333068277.db2.gz	QIKKYXMPAZJDQM-WMLDXEAASA-N	0	0	299.418	4.299	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N1CCC[C@H]1CCC(C)C	ZINC000178141220	333068461	/nfs/dbraw/zinc/06/84/61/333068461.db2.gz	RTNWVNNWXFVQLM-INIZCTEOSA-N	0	0	299.418	4.299	20	30		CIEDRN
CCc1ccc(CNc2nc(C)c(C#N)cc2Cl)s1	ZINC000311536008	333069636	/nfs/dbraw/zinc/06/96/36/333069636.db2.gz	GGNSXIBYTPQGTB-UHFFFAOYSA-N	0	0	291.807	4.151	20	30		CIEDRN
Cc1cccc(OC(F)F)c1NCc1cccc(C#N)c1	ZINC000178348207	333071275	/nfs/dbraw/zinc/07/12/75/333071275.db2.gz	AMKAWCUBKYXAMX-UHFFFAOYSA-N	0	0	288.297	4.080	20	30		CIEDRN
Cc1cc(NCc2cccc(C#N)c2)c(Cl)cc1F	ZINC000311884480	333073981	/nfs/dbraw/zinc/07/39/81/333073981.db2.gz	VHXAYSBEPGZBJX-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
Cc1nc(N[C@H](C)c2ccccc2Cl)ccc1C#N	ZINC000311893523	333074168	/nfs/dbraw/zinc/07/41/68/333074168.db2.gz	YVWHUCCIGACTGW-LLVKDONJSA-N	0	0	271.751	4.088	20	30		CIEDRN
C[C@H](CC(=O)Nc1ccc(C#N)c(Cl)c1)C(C)(C)C	ZINC000312029470	333075780	/nfs/dbraw/zinc/07/57/80/333075780.db2.gz	XOPKQERTOMOXOX-SNVBAGLBSA-N	0	0	278.783	4.222	20	30		CIEDRN
C=CCC[C@@H](NC(=O)Nc1ncccc1C)c1ccccc1	ZINC000178824193	333077866	/nfs/dbraw/zinc/07/78/66/333077866.db2.gz	OAGXVPSDTVUXFC-MRXNPFEDSA-N	0	0	295.386	4.219	20	30		CIEDRN
C[C@H]1C[C@@H](C(C)(C)C)CCN1C(=O)c1ccc(CC#N)cc1	ZINC000516677142	333080401	/nfs/dbraw/zinc/08/04/01/333080401.db2.gz	NDDLCKFARPOFBP-YOEHRIQHSA-N	0	0	298.430	4.039	20	30		CIEDRN
CC(C)(C#N)CCSc1ccc(Br)cc1	ZINC000087324171	333082850	/nfs/dbraw/zinc/08/28/50/333082850.db2.gz	ACLVEYKBHSLFJW-UHFFFAOYSA-N	0	0	284.222	4.481	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(-c2ccccc2CC)no1	ZINC000516811289	333083016	/nfs/dbraw/zinc/08/30/16/333083016.db2.gz	MJAKEFFNQYEICG-INIZCTEOSA-N	0	0	256.349	4.153	20	30		CIEDRN
N#CC1(COc2c(Cl)cc(Cl)c3cccnc32)CC1	ZINC000516895404	333085586	/nfs/dbraw/zinc/08/55/86/333085586.db2.gz	QUHNMLUWCFTOPV-UHFFFAOYSA-N	0	0	293.153	4.224	20	30		CIEDRN
N#Cc1cccc(-c2nc(-c3cc4ccccc4o3)no2)c1	ZINC000088339502	333088182	/nfs/dbraw/zinc/08/81/82/333088182.db2.gz	POAZCTBCONHSTI-UHFFFAOYSA-N	0	0	287.278	4.021	20	30		CIEDRN
C=CCC1(C(=O)NCC(C)(C)C(F)(F)F)CCCCC1	ZINC000517011380	333089874	/nfs/dbraw/zinc/08/98/74/333089874.db2.gz	KFDJZFYYJPVAGF-UHFFFAOYSA-N	0	0	291.357	4.218	20	30		CIEDRN
Cc1ccc(Cl)cc1OCc1ccc(C#N)cc1	ZINC000088729867	333091637	/nfs/dbraw/zinc/09/16/37/333091637.db2.gz	CWVBPCJOLWHABI-UHFFFAOYSA-N	0	0	257.720	4.099	20	30		CIEDRN
C=CC[N@@H+](Cc1ccsc1C(=O)[O-])CC1CCCCC1	ZINC000517159759	333093643	/nfs/dbraw/zinc/09/36/43/333093643.db2.gz	XVQIDYAPVKZNOM-UHFFFAOYSA-N	0	0	293.432	4.015	20	30		CIEDRN
CC[C@@H](C)Oc1ccc(-c2noc([C@](C)(C#N)CC)n2)cc1	ZINC000517201566	333094422	/nfs/dbraw/zinc/09/44/22/333094422.db2.gz	ONONEROLZKISFL-PXAZEXFGSA-N	0	0	299.374	4.105	20	30		CIEDRN
CC(C)(C#N)CCSCc1c(F)cccc1F	ZINC000517615754	333104021	/nfs/dbraw/zinc/10/40/21/333104021.db2.gz	ALHPKJJBAJZSQM-UHFFFAOYSA-N	0	0	255.333	4.138	20	30		CIEDRN
CCCC(C#N)(CCC)NC(=O)c1ccc2c(c1)CCC=C2	ZINC000517616995	333104166	/nfs/dbraw/zinc/10/41/66/333104166.db2.gz	QVMASNZNHCAPIZ-UHFFFAOYSA-N	0	0	296.414	4.238	20	30		CIEDRN
CSCc1cccc(Nc2ccc(C#N)cc2[N+](=O)[O-])c1	ZINC000521012559	333109734	/nfs/dbraw/zinc/10/97/34/333109734.db2.gz	MCVOYABIIXITDD-UHFFFAOYSA-N	0	0	299.355	4.073	20	30		CIEDRN
N#Cc1cc(F)ccc1N1CCC[C@H]1c1cccs1	ZINC000521058016	333110779	/nfs/dbraw/zinc/11/07/79/333110779.db2.gz	HRARKDMAQWJDPR-AWEZNQCLSA-N	0	0	272.348	4.100	20	30		CIEDRN
CCc1cccc(NC(=O)Nc2cc(C#N)ccc2C)c1	ZINC000217184421	333119710	/nfs/dbraw/zinc/11/97/10/333119710.db2.gz	CCIOHLDXHPDAEV-UHFFFAOYSA-N	0	0	279.343	4.073	20	30		CIEDRN
C/C(=C\c1ccccc1)CNc1ccc(CC#N)cc1	ZINC000183280661	333119958	/nfs/dbraw/zinc/11/99/58/333119958.db2.gz	ZWJQLDXFLFIKLI-FYWRMAATSA-N	0	0	262.356	4.268	20	30		CIEDRN
C[C@H](Nc1cc(Cl)nc(C2CC2)n1)c1ccc(C#N)cc1	ZINC000217969696	333125388	/nfs/dbraw/zinc/12/53/88/333125388.db2.gz	LTWLTVSTPLQPCA-JTQLQIEISA-N	0	0	298.777	4.052	20	30		CIEDRN
C[C@@H]1CCC[C@@H]1CC(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000184641870	333130827	/nfs/dbraw/zinc/13/08/27/333130827.db2.gz	MIXXBFRXOGJMLK-ZIAGYGMSSA-N	0	0	284.403	4.253	20	30		CIEDRN
Cc1cc2occ(C(=O)Nc3sccc3C#N)c2cc1C	ZINC000184701565	333131420	/nfs/dbraw/zinc/13/14/20/333131420.db2.gz	LNVGLNSKJKAJKT-UHFFFAOYSA-N	0	0	296.351	4.235	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(C)cc1Cl	ZINC000184872075	333132901	/nfs/dbraw/zinc/13/29/01/333132901.db2.gz	WGYNLLZZEWHMOZ-LLVKDONJSA-N	0	0	251.757	4.189	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](C)c1cc2ccccc2o1	ZINC000184920435	333133244	/nfs/dbraw/zinc/13/32/44/333133244.db2.gz	NEUVXHZCHBPWOR-OLZOCXBDSA-N	0	0	271.360	4.212	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000184910492	333133283	/nfs/dbraw/zinc/13/32/83/333133283.db2.gz	BANZUERUARKJRD-NEPJUHHUSA-N	0	0	299.336	4.485	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H](C)c1cccc2ccccc21	ZINC000184913242	333133291	/nfs/dbraw/zinc/13/32/91/333133291.db2.gz	SGBIPCSCQMXDLK-HNNXBMFYSA-N	0	0	279.383	4.211	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CCC)Cc1ccccc1	ZINC000184969280	333133856	/nfs/dbraw/zinc/13/38/56/333133856.db2.gz	KZNBSTMHTNXNPL-OAHLLOKOSA-N	0	0	259.393	4.028	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(N2CCCC2)cc1C	ZINC000184990140	333134085	/nfs/dbraw/zinc/13/40/85/333134085.db2.gz	AXUCVCHWYKXHPG-OAHLLOKOSA-N	0	0	286.419	4.136	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(Cc1ccco1)Cc1ccccc1	ZINC000184989945	333134144	/nfs/dbraw/zinc/13/41/44/333134144.db2.gz	LZWYIBGOULJCTB-MRXNPFEDSA-N	0	0	297.398	4.411	20	30		CIEDRN
CC#CCCCC(=O)N1CC[C@@H](C)Sc2ccccc21	ZINC000184988644	333134152	/nfs/dbraw/zinc/13/41/52/333134152.db2.gz	AGXYGHCDYYGQHY-CQSZACIVSA-N	0	0	287.428	4.098	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccccc1OCCC	ZINC000184981055	333134219	/nfs/dbraw/zinc/13/42/19/333134219.db2.gz	PJCWWUYKNFUJFP-CYBMUJFWSA-N	0	0	261.365	4.016	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CCCSc2ccccc21	ZINC000185005757	333134334	/nfs/dbraw/zinc/13/43/34/333134334.db2.gz	PIIZVNZAXLWQFX-ZDUSSCGKSA-N	0	0	275.417	4.118	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@@H](C)c1cc(C)sc1C	ZINC000185094591	333135686	/nfs/dbraw/zinc/13/56/86/333135686.db2.gz	RPKXNTTWRPHRFD-PWSUYJOCSA-N	0	0	265.422	4.144	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(C)c2ncccc12	ZINC000185148363	333136239	/nfs/dbraw/zinc/13/62/39/333136239.db2.gz	MHWWUMURTQWCJF-ZDUSSCGKSA-N	0	0	268.360	4.084	20	30		CIEDRN
CCN(C(=O)[C@H](C)CC(C)C)[C@@H](C)c1ccc(C#N)cc1	ZINC000185170250	333136490	/nfs/dbraw/zinc/13/64/90/333136490.db2.gz	XEPRNRVAVLQRJH-CABCVRRESA-N	0	0	286.419	4.150	20	30		CIEDRN
N#Cc1ccc(OCc2cc(F)ccc2Cl)c(F)c1	ZINC000218819355	333136641	/nfs/dbraw/zinc/13/66/41/333136641.db2.gz	VZEKWQOMYHHAMN-UHFFFAOYSA-N	0	0	279.673	4.069	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)Cc1cccc(C(F)(F)F)c1	ZINC000185208244	333136792	/nfs/dbraw/zinc/13/67/92/333136792.db2.gz	FSPXEMZVSJYOJS-LBPRGKRZSA-N	0	0	299.336	4.266	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC)[C@@H](C)c1cccc(OC)c1	ZINC000185227824	333137076	/nfs/dbraw/zinc/13/70/76/333137076.db2.gz	WFLJNFKGSIXLDS-CABCVRRESA-N	0	0	289.419	4.207	20	30		CIEDRN
CC#CCCCC(=O)N1CCC[C@H]1[C@@H](CC)c1ccccc1	ZINC000185335432	333139082	/nfs/dbraw/zinc/13/90/82/333139082.db2.gz	STLHFCVOVHDBJF-OALUTQOASA-N	0	0	297.442	4.365	20	30		CIEDRN
CSc1cccc(C)c1NCc1cccc(C#N)c1	ZINC000185433095	333140584	/nfs/dbraw/zinc/14/05/84/333140584.db2.gz	LRGYMWUNHLGYQL-UHFFFAOYSA-N	0	0	268.385	4.201	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc(CSC)cc1	ZINC000185441023	333140782	/nfs/dbraw/zinc/14/07/82/333140782.db2.gz	JNPDEOKESJHEHJ-LBPRGKRZSA-N	0	0	263.406	4.090	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)NCC1(c2ccc(Cl)cc2)CC1	ZINC000185438775	333140869	/nfs/dbraw/zinc/14/08/69/333140869.db2.gz	DCNWGDBQJHEVGW-CYBMUJFWSA-N	0	0	291.822	4.090	20	30		CIEDRN
CC#CCCCC(=O)N(c1ccc(OC)cc1)[C@H](C)C1CC1	ZINC000185569734	333144026	/nfs/dbraw/zinc/14/40/26/333144026.db2.gz	VMRWMEAPVHFYOZ-OAHLLOKOSA-N	0	0	299.414	4.020	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1C[C@H](c2ccccc2C)C[C@@H]1C	ZINC000185623772	333145091	/nfs/dbraw/zinc/14/50/91/333145091.db2.gz	LKBDHVRSDFYKKM-YESZJQIVSA-N	0	0	285.431	4.302	20	30		CIEDRN
CC#CCCCC(=O)N1CCC[C@@H](C)[C@H]1c1ccc(C)cc1	ZINC000185634340	333145538	/nfs/dbraw/zinc/14/55/38/333145538.db2.gz	ZKORDELMDWNZPU-XLIONFOSSA-N	0	0	297.442	4.488	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N(C)[C@H](c1ccccc1)C(F)(F)F	ZINC000185680639	333146556	/nfs/dbraw/zinc/14/65/56/333146556.db2.gz	ZHINTVMXVGJKPE-GXTWGEPZSA-N	0	0	299.336	4.351	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](c2ccccc2)[C@H](C)C1	ZINC000185680212	333146668	/nfs/dbraw/zinc/14/66/68/333146668.db2.gz	INGOZRJBQVTQNC-LZLYRXPVSA-N	0	0	285.431	4.241	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N([C@@H](C)[C@@H](C)CC)C1CC1	ZINC000185700253	333146818	/nfs/dbraw/zinc/14/68/18/333146818.db2.gz	OMJDXSMBCUAPHM-IHRRRGAJSA-N	0	0	251.414	4.014	20	30		CIEDRN
C[C@H](SCc1ccccc1C(C)(C)C#N)c1cnccn1	ZINC000185706476	333147093	/nfs/dbraw/zinc/14/70/93/333147093.db2.gz	DXYPHPFXKDGYPA-ZDUSSCGKSA-N	0	0	297.427	4.272	20	30		CIEDRN
CCOc1cc(Cl)ccc1N[C@H]1CCC[C@@H](C#N)C1	ZINC000185731363	333147419	/nfs/dbraw/zinc/14/74/19/333147419.db2.gz	CBNUGTORXWIMHB-YPMHNXCESA-N	0	0	278.783	4.233	20	30		CIEDRN
N#C[C@H]1CCC[C@@H](Nc2cccc(C(F)(F)F)c2)C1	ZINC000185735146	333147682	/nfs/dbraw/zinc/14/76/82/333147682.db2.gz	MZASERLCGGRDHQ-CMPLNLGQSA-N	0	0	268.282	4.200	20	30		CIEDRN
CC1CCN(c2cccc(N[C@@H]3CCC[C@H](C#N)C3)c2)CC1	ZINC000185749379	333147799	/nfs/dbraw/zinc/14/77/99/333147799.db2.gz	KWTXLXAVOPIZBU-DLBZAZTESA-N	0	0	297.446	4.417	20	30		CIEDRN
Cc1ccc(N[C@H]2CCC[C@H](C#N)C2)cc1OCC(F)F	ZINC000185745310	333147845	/nfs/dbraw/zinc/14/78/45/333147845.db2.gz	OUPTZEXFGCXQCS-STQMWFEESA-N	0	0	294.345	4.133	20	30		CIEDRN
C=C(C)COc1cccc(N[C@H]2CCC[C@H](C#N)C2)c1	ZINC000185745835	333147860	/nfs/dbraw/zinc/14/78/60/333147860.db2.gz	XPHHBGCATQNEDL-GJZGRUSLSA-N	0	0	270.376	4.136	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1cccc(N(C)C(C)C)c1	ZINC000185747804	333147916	/nfs/dbraw/zinc/14/79/16/333147916.db2.gz	PGWYITMXXRWIFO-AWEZNQCLSA-N	0	0	274.408	4.072	20	30		CIEDRN
CC1CCN(c2cccc(N[C@H]3CCC[C@@H](C#N)C3)c2)CC1	ZINC000185749438	333148039	/nfs/dbraw/zinc/14/80/39/333148039.db2.gz	KWTXLXAVOPIZBU-SJORKVTESA-N	0	0	297.446	4.417	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N[C@@H](C)c1c(F)cccc1Cl	ZINC000185766133	333148231	/nfs/dbraw/zinc/14/82/31/333148231.db2.gz	JIFSPTCOKIMZKR-QWRGUYRKSA-N	0	0	283.774	4.259	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)C[C@@H]1CCC[C@@H]1C	ZINC000185870317	333150680	/nfs/dbraw/zinc/15/06/80/333150680.db2.gz	LOZUZBLRYHHYOV-KBPBESRZSA-N	0	0	277.433	4.089	20	30		CIEDRN
Cc1ccc2cccc(N[C@@H]3CCC[C@H](C#N)C3)c2n1	ZINC000185888813	333151221	/nfs/dbraw/zinc/15/12/21/333151221.db2.gz	OZFXZGYMFYFFMB-DZGCQCFKSA-N	0	0	265.360	4.038	20	30		CIEDRN
CC#CCCCC(=O)N1CC=C(c2cc(C)cc(C)c2)CC1	ZINC000185981727	333152800	/nfs/dbraw/zinc/15/28/00/333152800.db2.gz	MTXHJVFYBAFDJE-UHFFFAOYSA-N	0	0	295.426	4.113	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)Nc1ccc2nc(C3CC3)oc2c1	ZINC000185986930	333153026	/nfs/dbraw/zinc/15/30/26/333153026.db2.gz	OOLIMXCMNUPFCN-NSHDSACASA-N	0	0	284.359	4.246	20	30		CIEDRN
C=CCC[C@@H](C(=O)NC(CC)CC)c1ccccc1	ZINC000186009285	333153300	/nfs/dbraw/zinc/15/33/00/333153300.db2.gz	RUPJFTCJUVEQIL-MRXNPFEDSA-N	0	0	259.393	4.041	20	30		CIEDRN
C=C(C)[C@@H](NC(=O)c1ccccc1)c1ccc(F)c(F)c1	ZINC000186041315	333153936	/nfs/dbraw/zinc/15/39/36/333153936.db2.gz	LGTUUVGLAGVONV-MRXNPFEDSA-N	0	0	287.309	4.012	20	30		CIEDRN
C=C(C)[C@@H](NC(=O)[C@@H]1CC=CCC1)c1ccc(F)c(F)c1	ZINC000186044524	333153984	/nfs/dbraw/zinc/15/39/84/333153984.db2.gz	UYVROSTXQQDTTC-MLGOLLRUSA-N	0	0	291.341	4.055	20	30		CIEDRN
C=CCC[C@H](C(=O)Nc1ncc(C)s1)c1ccccc1	ZINC000186082028	333154376	/nfs/dbraw/zinc/15/43/76/333154376.db2.gz	RKUHWZXLLUSLBJ-AWEZNQCLSA-N	0	0	286.400	4.140	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)Nc1ccc(OC(C)C)c(OC)c1	ZINC000186075143	333154383	/nfs/dbraw/zinc/15/43/83/333154383.db2.gz	YXSALZCJHSHNIY-CYBMUJFWSA-N	0	0	291.391	4.023	20	30		CIEDRN
C=CCC[C@@H](C(=O)Nc1ncc(C)s1)c1ccccc1	ZINC000186082041	333154474	/nfs/dbraw/zinc/15/44/74/333154474.db2.gz	RKUHWZXLLUSLBJ-CQSZACIVSA-N	0	0	286.400	4.140	20	30		CIEDRN
C=CCCCC(=O)N[C@@H](C(=C)C)c1ccc(F)c(F)c1	ZINC000186074335	333154570	/nfs/dbraw/zinc/15/45/70/333154570.db2.gz	IEEVNAZUOOXYMR-INIZCTEOSA-N	0	0	279.330	4.055	20	30		CIEDRN
CC#CCCCC(=O)N(Cc1ccccc1)C(C)(C)C	ZINC000186123086	333155143	/nfs/dbraw/zinc/15/51/43/333155143.db2.gz	DIIVZGLBCJZLAF-UHFFFAOYSA-N	0	0	271.404	4.007	20	30		CIEDRN
C=CCC[C@H](C(=O)Nc1ncccc1C)c1ccccc1	ZINC000186220586	333157011	/nfs/dbraw/zinc/15/70/11/333157011.db2.gz	QGZQFEKZDMAWHB-INIZCTEOSA-N	0	0	280.371	4.079	20	30		CIEDRN
C=CCC[C@H](C(=O)NC(C1CC1)C1CC1)c1ccccc1	ZINC000186382902	333159852	/nfs/dbraw/zinc/15/98/52/333159852.db2.gz	UHGRVFXRTQRPHL-KRWDZBQOSA-N	0	0	283.415	4.041	20	30		CIEDRN
C=C(C)[C@H](N[C@@H](C)c1ccccn1)c1ccc(F)c(F)c1	ZINC000186448608	333161146	/nfs/dbraw/zinc/16/11/46/333161146.db2.gz	UFJJFOXYLDSASS-SJCJKPOMSA-N	0	0	288.341	4.328	20	30		CIEDRN
C=C(C)[C@H](NCc1ccccc1C#N)c1ccc(F)c(F)c1	ZINC000187373188	333169706	/nfs/dbraw/zinc/16/97/06/333169706.db2.gz	IRWLHWFUVNABRU-SFHVURJKSA-N	0	0	298.336	4.243	20	30		CIEDRN
CCc1ccc(C(=O)COc2ccc(C#N)c(Cl)c2)cc1	ZINC000220989636	333171756	/nfs/dbraw/zinc/17/17/56/333171756.db2.gz	QUMVJYXWJRBGGT-UHFFFAOYSA-N	0	0	299.757	4.036	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(C)cc1Cl	ZINC000189764326	333199084	/nfs/dbraw/zinc/19/90/84/333199084.db2.gz	MTTLKHKFXMXWSA-AWEZNQCLSA-N	0	0	251.757	4.189	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1ccc(F)c(OC)c1)c1ccccc1	ZINC000187649686	333173358	/nfs/dbraw/zinc/17/33/58/333173358.db2.gz	BQZWRDLUUFTEEV-HNNXBMFYSA-N	0	0	299.345	4.133	20	30		CIEDRN
C=CCC[C@H](C(=O)N1Cc2ccccc2C1)c1ccccc1	ZINC000187649411	333173379	/nfs/dbraw/zinc/17/33/79/333173379.db2.gz	DSMONWDWBXBKDB-IBGZPJMESA-N	0	0	291.394	4.279	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(Cl)cc1F	ZINC000189779193	333199139	/nfs/dbraw/zinc/19/91/39/333199139.db2.gz	TWSSRGJZWSPCAD-ZDUSSCGKSA-N	0	0	255.720	4.020	20	30		CIEDRN
C=CCCCS[C@@H](C)C(=O)N[C@H](C)c1ccccc1C	ZINC000564166508	333181735	/nfs/dbraw/zinc/18/17/35/333181735.db2.gz	UVXBGQPOTIDODA-CABCVRRESA-N	0	0	291.460	4.260	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(-c2cc(F)ccc2C)no1	ZINC000521680829	333183899	/nfs/dbraw/zinc/18/38/99/333183899.db2.gz	HOYQEEJKWADYSC-HNNXBMFYSA-N	0	0	260.312	4.038	20	30		CIEDRN
C=CCC[C@@H](C(=O)Nc1nc(C)cs1)c1ccccc1	ZINC000189446154	333192970	/nfs/dbraw/zinc/19/29/70/333192970.db2.gz	OCKHDAOUROSLCS-CQSZACIVSA-N	0	0	286.400	4.140	20	30		CIEDRN
Cn1ccc2cccc(N[C@H](C#N)C3CCCCC3)c21	ZINC000189587733	333195765	/nfs/dbraw/zinc/19/57/65/333195765.db2.gz	VXDBFFBAOALGJW-MRXNPFEDSA-N	0	0	267.376	4.063	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cc(Cl)ccc1C	ZINC000189797163	333199384	/nfs/dbraw/zinc/19/93/84/333199384.db2.gz	LREJYWPQOMYCPA-AWEZNQCLSA-N	0	0	251.757	4.189	20	30		CIEDRN
CCC(C)(C)N(CCC#N)C(=O)c1ccc(C(C)C)s1	ZINC000189961524	333201151	/nfs/dbraw/zinc/20/11/51/333201151.db2.gz	LTXNJHAZIBIDPJ-UHFFFAOYSA-N	0	0	292.448	4.416	20	30		CIEDRN
C=C[C@H](CC(=O)N(CCC#N)C(C)(C)CC)c1ccccc1	ZINC000189958486	333201257	/nfs/dbraw/zinc/20/12/57/333201257.db2.gz	OTSVJTXJPXDJGW-MRXNPFEDSA-N	0	0	298.430	4.277	20	30		CIEDRN
C=CCC1(C(=O)N[C@@H](CC(C)(C)C)C(F)(F)F)CCC1	ZINC000190060198	333202797	/nfs/dbraw/zinc/20/27/97/333202797.db2.gz	CJLYJTGTEVSLHH-NSHDSACASA-N	0	0	291.357	4.216	20	30		CIEDRN
N#Cc1cc(Cl)ccc1CSCC[C@H]1CCCO1	ZINC000190146805	333203734	/nfs/dbraw/zinc/20/37/34/333203734.db2.gz	YYPCSMWNVZSINO-CQSZACIVSA-N	0	0	281.808	4.014	20	30		CIEDRN
CC(C)(C#N)c1ccccc1CSCC[C@H]1CCCO1	ZINC000190163469	333203943	/nfs/dbraw/zinc/20/39/43/333203943.db2.gz	OFXUGWHBJJOZBI-OAHLLOKOSA-N	0	0	289.444	4.290	20	30		CIEDRN
C=CCC1(C(=O)Nc2cccc(COCC3CC3)c2)CCC1	ZINC000190171423	333203950	/nfs/dbraw/zinc/20/39/50/333203950.db2.gz	DZKKYYLTRRHMSM-UHFFFAOYSA-N	0	0	299.414	4.298	20	30		CIEDRN
N#Cc1ccc(CNc2cccc(C(F)F)c2)cc1F	ZINC000190366253	333206114	/nfs/dbraw/zinc/20/61/14/333206114.db2.gz	AMEZJBLWLHXMSU-UHFFFAOYSA-N	0	0	276.261	4.247	20	30		CIEDRN
N#Cc1ccc(CNc2cc(F)cc(Cl)c2)cc1F	ZINC000190390220	333206277	/nfs/dbraw/zinc/20/62/77/333206277.db2.gz	GPCXLYZTADTAKL-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)N[C@@H](C)c1ccc(Cl)s1	ZINC000190383010	333206294	/nfs/dbraw/zinc/20/62/94/333206294.db2.gz	SUDQDKQOIUXSJK-ZANVPECISA-N	0	0	271.813	4.181	20	30		CIEDRN
C=CCC1(C(=O)N[C@H](C)c2cccc(Cl)c2)CCC1	ZINC000190605251	333209028	/nfs/dbraw/zinc/20/90/28/333209028.db2.gz	ZWMJIHGILMBFJE-GFCCVEGCSA-N	0	0	277.795	4.264	20	30		CIEDRN
N#Cc1cccc(CNc2ccc(C(F)(F)F)cc2)c1F	ZINC000223727041	333211585	/nfs/dbraw/zinc/21/15/85/333211585.db2.gz	DHMXLFBUCGKUMZ-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
C=CC[C@H](C(=O)Nc1ccc(O)cc1CC)c1ccccc1	ZINC000191036520	333214124	/nfs/dbraw/zinc/21/41/24/333214124.db2.gz	SWPUNUFLHNAMQD-KRWDZBQOSA-N	0	0	295.382	4.253	20	30		CIEDRN
C=C[C@@H](CC(=O)Nc1ccc(O)cc1CC)c1ccccc1	ZINC000191082670	333214952	/nfs/dbraw/zinc/21/49/52/333214952.db2.gz	ZIKDKPOCELMHQA-AWEZNQCLSA-N	0	0	295.382	4.253	20	30		CIEDRN
C=CCC1(C(=O)NC[C@@H](CC)c2ccccc2)CCC1	ZINC000191386269	333218966	/nfs/dbraw/zinc/21/89/66/333218966.db2.gz	FJQJSBJQXFBAQF-OAHLLOKOSA-N	0	0	271.404	4.043	20	30		CIEDRN
Cc1cc(C#N)ccc1C(=O)N1CC[C@H](C(C)(C)C)C[C@H]1C	ZINC000521934976	333224073	/nfs/dbraw/zinc/22/40/73/333224073.db2.gz	KFPZSZCPHSXSBJ-ZBFHGGJFSA-N	0	0	298.430	4.154	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(Cc2ccc(C)c(OC)c2)no1	ZINC000521940605	333224499	/nfs/dbraw/zinc/22/44/99/333224499.db2.gz	YEPSFAYNOAZKBJ-ZDUSSCGKSA-N	0	0	286.375	4.047	20	30		CIEDRN
CCCC1CCC(N(C)C(=O)c2sccc2C#N)CC1	ZINC000192271816	333234031	/nfs/dbraw/zinc/23/40/31/333234031.db2.gz	YZOJYKZICJESKH-UHFFFAOYSA-N	0	0	290.432	4.051	20	30		CIEDRN
C=CCN(C(=O)c1ccccc1SC)c1ccccc1	ZINC000192742051	333238806	/nfs/dbraw/zinc/23/88/06/333238806.db2.gz	WNQGUGNHUMAJNO-UHFFFAOYSA-N	0	0	283.396	4.241	20	30		CIEDRN
CC(C)CCCNC(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000193049871	333242135	/nfs/dbraw/zinc/24/21/35/333242135.db2.gz	KTXCWUODNUVMGS-UHFFFAOYSA-N	0	0	287.407	4.045	20	30		CIEDRN
CCC[C@H](CC)NC(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000195363509	333251351	/nfs/dbraw/zinc/25/13/51/333251351.db2.gz	DLSOJWUXXGBWTQ-AWEZNQCLSA-N	0	0	287.407	4.188	20	30		CIEDRN
C=CCCCCC[NH2+][C@@H](CC)c1nc(C)cs1	ZINC000193547456	333252269	/nfs/dbraw/zinc/25/22/69/333252269.db2.gz	DORXMTATFGFZKR-ZDUSSCGKSA-N	0	0	252.427	4.239	20	30		CIEDRN
CC(C)(C(=O)Nc1ccc(C#N)cc1Cl)c1ccccc1	ZINC000226345377	333257610	/nfs/dbraw/zinc/25/76/10/333257610.db2.gz	DIKZGXHTFCZCKU-UHFFFAOYSA-N	0	0	298.773	4.128	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N(CC(F)F)c1ccc(F)cc1	ZINC000193859173	333259567	/nfs/dbraw/zinc/25/95/67/333259567.db2.gz	IAQAQWLAPSSERA-LLVKDONJSA-N	0	0	285.309	4.026	20	30		CIEDRN
CCCCOc1ccc(/C=C/c2ccc(C#N)cn2)cc1	ZINC000195673922	333260451	/nfs/dbraw/zinc/26/04/51/333260451.db2.gz	IKPOHDCXOXFHON-XBXARRHUSA-N	0	0	278.355	4.303	20	30		CIEDRN
N#Cc1ccc(COc2ccc(OCC3CC3)cc2)c(F)c1	ZINC000195732244	333262475	/nfs/dbraw/zinc/26/24/75/333262475.db2.gz	NRGJDMZUNOWLHK-UHFFFAOYSA-N	0	0	297.329	4.065	20	30		CIEDRN
C[C@@H](c1cccc(C#N)c1)N(C)C(=O)C[C@H]1CCCC[C@H]1C	ZINC000575917647	335130685	/nfs/dbraw/zinc/13/06/85/335130685.db2.gz	FQBPERPANPATLD-HLLBOEOZSA-N	0	0	298.430	4.294	20	30		CIEDRN
CC(=O)c1ccc(O[C@H](C)c2cccc(C#N)c2)c(F)c1	ZINC000194643815	333274339	/nfs/dbraw/zinc/27/43/39/333274339.db2.gz	MPHNSIHBWQLOEF-GFCCVEGCSA-N	0	0	283.302	4.040	20	30		CIEDRN
N#Cc1ccc(CN(Cc2cccc(F)c2F)C2CC2)cc1	ZINC000194963286	333280297	/nfs/dbraw/zinc/28/02/97/333280297.db2.gz	PNFZDIMPTVPVDJ-UHFFFAOYSA-N	0	0	298.336	4.001	20	30		CIEDRN
N#Cc1c(F)cccc1Nc1ccc2ncsc2c1	ZINC000227423601	333282519	/nfs/dbraw/zinc/28/25/19/333282519.db2.gz	CNZBYKAZWDYXCI-UHFFFAOYSA-N	0	0	269.304	4.051	20	30		CIEDRN
C=CCCC(=O)Nc1nc(-c2ccc(CC)s2)cs1	ZINC000522482582	333288100	/nfs/dbraw/zinc/28/81/00/333288100.db2.gz	VPSCBZBZAHENFN-UHFFFAOYSA-N	0	0	292.429	4.339	20	30		CIEDRN
C=CCCC(=O)Nc1cccc(-c2nc(C)cs2)c1	ZINC000522551068	333289899	/nfs/dbraw/zinc/28/98/99/333289899.db2.gz	MPDKLCLJDYQABX-UHFFFAOYSA-N	0	0	272.373	4.023	20	30		CIEDRN
C[C@@H](NCC(F)(F)c1ccccc1)c1ccc(C#N)cc1	ZINC000227899521	333290290	/nfs/dbraw/zinc/29/02/90/333290290.db2.gz	DKHVYJXHCGNFQT-CYBMUJFWSA-N	0	0	286.325	4.001	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@H](c1ccc(CC)cc1)C(C)C	ZINC000522631243	333293312	/nfs/dbraw/zinc/29/33/12/333293312.db2.gz	QVMRYWOLUXISJY-PBHICJAKSA-N	0	0	288.435	4.210	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)C1CCC(CCCC)CC1	ZINC000522636732	333293843	/nfs/dbraw/zinc/29/38/43/333293843.db2.gz	NNCLUXPJGKBADK-WLYUNCDWSA-N	0	0	251.414	4.064	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)c1ccc(C2CCCCC2)cc1	ZINC000522645405	333294628	/nfs/dbraw/zinc/29/46/28/333294628.db2.gz	RYFXRGUINJYNFP-CQSZACIVSA-N	0	0	271.404	4.429	20	30		CIEDRN
C=CC[C@H](C)NC(=O)c1ccc(C2CCCCC2)cc1	ZINC000522645404	333294678	/nfs/dbraw/zinc/29/46/78/333294678.db2.gz	RYFXRGUINJYNFP-AWEZNQCLSA-N	0	0	271.404	4.429	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)c1c[nH]cc1-c1ccc(Cl)s1	ZINC000522645286	333294695	/nfs/dbraw/zinc/29/46/95/333294695.db2.gz	MJCMGRGFWJISMX-SECBINFHSA-N	0	0	294.807	4.091	20	30		CIEDRN
CCCC[C@@H](CC)CC(=O)Nc1cc(C#N)ccc1OC	ZINC000522670298	333296046	/nfs/dbraw/zinc/29/60/46/333296046.db2.gz	IQBDMVXLRAKTOG-CYBMUJFWSA-N	0	0	288.391	4.112	20	30		CIEDRN
C[C@@H](SCc1ccccc1[N+](=O)[O-])c1ccc(C#N)cc1	ZINC000522840618	333296777	/nfs/dbraw/zinc/29/67/77/333296777.db2.gz	VUAMEPVNRMDRED-GFCCVEGCSA-N	0	0	298.367	4.461	20	30		CIEDRN
C[C@@H](CNc1cc(Cl)ccc1C#N)Oc1ccccc1	ZINC000522903696	333299469	/nfs/dbraw/zinc/29/94/69/333299469.db2.gz	BQJSPSXQBGOEHZ-LBPRGKRZSA-N	0	0	286.762	4.091	20	30		CIEDRN
N#Cc1cnc2ccccc2c1NCCC1=CCCC1	ZINC000229175218	333301167	/nfs/dbraw/zinc/30/11/67/333301167.db2.gz	RJKZOLYJKSVBKE-UHFFFAOYSA-N	0	0	263.344	4.019	20	30		CIEDRN
CC(C)N(CCC#N)C(=O)c1ccc(C2CCCCC2)cc1	ZINC000522960956	333301339	/nfs/dbraw/zinc/30/13/39/333301339.db2.gz	KKDVGDWBVXZHKK-UHFFFAOYSA-N	0	0	298.430	4.499	20	30		CIEDRN
CC(C)(CCC#N)CNc1ccc(C#N)c(C(F)(F)F)c1	ZINC000229697535	333307930	/nfs/dbraw/zinc/30/79/30/333307930.db2.gz	WBXYHLRGCOHHQL-UHFFFAOYSA-N	0	0	295.308	4.319	20	30		CIEDRN
Cc1ccc(NCc2ccc(F)c(C#N)c2)c(Cl)c1	ZINC000229721256	333308470	/nfs/dbraw/zinc/30/84/70/333308470.db2.gz	HWFWNVYYNDGPRZ-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
N#Cc1cc(CNc2ccccc2C(F)(F)F)ccc1F	ZINC000229721675	333308590	/nfs/dbraw/zinc/30/85/90/333308590.db2.gz	YWZXVWWZHGDGDV-UHFFFAOYSA-N	0	0	294.251	4.328	20	30		CIEDRN
C=C1CCN(C(=O)C[C@@H](CC)c2ccc(C)cc2)CC1	ZINC000523153059	333311543	/nfs/dbraw/zinc/31/15/43/333311543.db2.gz	PAUMZIXOVJNJSN-MRXNPFEDSA-N	0	0	271.404	4.057	20	30		CIEDRN
Cc1ccc(SCc2cc(F)ccc2C#N)cc1	ZINC000229949444	333312072	/nfs/dbraw/zinc/31/20/72/333312072.db2.gz	UKBUGOMYDNAZTF-UHFFFAOYSA-N	0	0	257.333	4.298	20	30		CIEDRN
Cc1cc(C)c(C(=O)Nc2ccc(C#N)cc2Cl)c(C)c1	ZINC000230351722	333316764	/nfs/dbraw/zinc/31/67/64/333316764.db2.gz	LDJHWDWOMDMDTH-UHFFFAOYSA-N	0	0	298.773	4.389	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)N(CC)C2CCC2)c1	ZINC000523420940	333326142	/nfs/dbraw/zinc/32/61/42/333326142.db2.gz	ICKNLAXLVAZFJF-UHFFFAOYSA-N	0	0	288.391	4.048	20	30		CIEDRN
C[C@@H](Nc1ccc(F)cc1C#N)c1cccc(F)c1F	ZINC000231631839	333326363	/nfs/dbraw/zinc/32/63/63/333326363.db2.gz	BNNCHYWHPZXBJW-SECBINFHSA-N	0	0	276.261	4.149	20	30		CIEDRN
C=CCCCCCN(C)C(=O)[C@@H](CC)c1ccccc1	ZINC000523512611	333331565	/nfs/dbraw/zinc/33/15/65/333331565.db2.gz	IXLUMBHQHQJTNR-KRWDZBQOSA-N	0	0	273.420	4.385	20	30		CIEDRN
C[C@H](Cc1ccc(Cl)cc1)Nc1ccc(CC#N)cc1	ZINC000231901384	333331891	/nfs/dbraw/zinc/33/18/91/333331891.db2.gz	YXLXCSRWIWWANH-CYBMUJFWSA-N	0	0	284.790	4.449	20	30		CIEDRN
C=CCCSCc1cc(Br)ccc1OC	ZINC000523520761	333331977	/nfs/dbraw/zinc/33/19/77/333331977.db2.gz	AENWSHXFISDETI-UHFFFAOYSA-N	0	0	287.222	4.267	20	30		CIEDRN
CCCN(Cc1ccc(C#N)cc1)C(=O)C1CCCCCC1	ZINC000523546224	333332717	/nfs/dbraw/zinc/33/27/17/333332717.db2.gz	NSPZSNJCBOTPEP-UHFFFAOYSA-N	0	0	298.430	4.267	20	30		CIEDRN
CC(C)(CNc1nccc(C#N)c1Cl)c1cccs1	ZINC000232520345	333337936	/nfs/dbraw/zinc/33/79/36/333337936.db2.gz	ZTJDMACMVOREAD-UHFFFAOYSA-N	0	0	291.807	4.058	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(OCc2ccccc2F)cc1	ZINC000303204114	333338826	/nfs/dbraw/zinc/33/88/26/333338826.db2.gz	YGDOXXZGIPIYRC-UHFFFAOYSA-N	0	0	299.345	4.309	20	30		CIEDRN
Cc1sc(NC(=O)CC2CCC(C)CC2)c(C#N)c1C	ZINC000523714939	333341280	/nfs/dbraw/zinc/34/12/80/333341280.db2.gz	YXLGGCCYPFOLFQ-UHFFFAOYSA-N	0	0	290.432	4.392	20	30		CIEDRN
Cc1ccc(CNc2c(Cl)cccc2C#N)cc1	ZINC000303435093	333341907	/nfs/dbraw/zinc/34/19/07/333341907.db2.gz	GSHZMHFREMYEKR-UHFFFAOYSA-N	0	0	256.736	4.132	20	30		CIEDRN
CC(C)c1ccc(CNc2nccc(C#N)c2Cl)cc1	ZINC000232780214	333342837	/nfs/dbraw/zinc/34/28/37/333342837.db2.gz	BQKSAIGXHIUECQ-UHFFFAOYSA-N	0	0	285.778	4.342	20	30		CIEDRN
N#Cc1cccc(Cl)c1NCCc1ccc(F)cc1	ZINC000303498241	333342926	/nfs/dbraw/zinc/34/29/26/333342926.db2.gz	QZEQKKZRBKAQQM-UHFFFAOYSA-N	0	0	274.726	4.005	20	30		CIEDRN
COc1ccc(Cl)cc1N[C@H](C#N)C1CCCCC1	ZINC000523738523	333343005	/nfs/dbraw/zinc/34/30/05/333343005.db2.gz	ZGIDDXCGXROTAW-CQSZACIVSA-N	0	0	278.783	4.233	20	30		CIEDRN
Cc1cccc([C@@H](C)Nc2cccc(F)c2C#N)c1C	ZINC000523752565	333343883	/nfs/dbraw/zinc/34/38/83/333343883.db2.gz	FQFXLOVAUIJCTM-CYBMUJFWSA-N	0	0	268.335	4.487	20	30		CIEDRN
C=CC[C@H](C)NC(=O)N[C@@H](C)CC(C)(C)c1ccccc1	ZINC000523877326	333348890	/nfs/dbraw/zinc/34/88/90/333348890.db2.gz	SYYQPLOGWNKRHW-GJZGRUSLSA-N	0	0	288.435	4.007	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@H](C)CC(C)(C)c1ccccc1	ZINC000523877327	333348988	/nfs/dbraw/zinc/34/89/88/333348988.db2.gz	SYYQPLOGWNKRHW-HUUCEWRRSA-N	0	0	288.435	4.007	20	30		CIEDRN
C=CCCC(=O)N(Cc1ccc2ccccc2c1)C1CC1	ZINC000523944529	333349822	/nfs/dbraw/zinc/34/98/22/333349822.db2.gz	NEZQDKLXGRNGMJ-UHFFFAOYSA-N	0	0	279.383	4.297	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N(CCC)[C@H]1CCc2ccccc21	ZINC000523948910	333349917	/nfs/dbraw/zinc/34/99/17/333349917.db2.gz	CJBIODUOGJKFSB-PBHICJAKSA-N	0	0	286.419	4.060	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@@H](c1cccs1)C(CC)CC	ZINC000523981588	333350420	/nfs/dbraw/zinc/35/04/20/333350420.db2.gz	HADZIFMCZYYGLE-IUODEOHRSA-N	0	0	294.464	4.489	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)N[C@H](c1cccs1)C(CC)CC	ZINC000523981584	333350469	/nfs/dbraw/zinc/35/04/69/333350469.db2.gz	HADZIFMCZYYGLE-DOMZBBRYSA-N	0	0	294.464	4.489	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)Nc1ccc(OCCCC)cc1C	ZINC000523986868	333350766	/nfs/dbraw/zinc/35/07/66/333350766.db2.gz	OSGZPIAWYLTUEE-CQSZACIVSA-N	0	0	290.407	4.260	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1ccc(F)c2ccccc12	ZINC000233439331	333352334	/nfs/dbraw/zinc/35/23/34/333352334.db2.gz	IUWYWUDGPAJATR-UHFFFAOYSA-N	0	0	271.335	4.017	20	30		CIEDRN
CC(C)C[C@@H](C)CC(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000524089710	333353297	/nfs/dbraw/zinc/35/32/97/333353297.db2.gz	ZYDIOHAZQHRBCZ-LLVKDONJSA-N	0	0	278.783	4.222	20	30		CIEDRN
C=CC[C@@H](C)NC(=O)[C@H](CC)CC1CCCCC1	ZINC000524194714	333356152	/nfs/dbraw/zinc/35/61/52/333356152.db2.gz	ITGKYTFJIBLWGZ-UKRRQHHQSA-N	0	0	251.414	4.064	20	30		CIEDRN
Cc1oc(-c2ccsc2)nc1COc1ccccc1C#N	ZINC000524210956	333356515	/nfs/dbraw/zinc/35/65/15/333356515.db2.gz	BRRLGRVWQIQLTF-UHFFFAOYSA-N	0	0	296.351	4.162	20	30		CIEDRN
C=CC1CCN(C(=O)C[C@H](CC)CCCC)CC1	ZINC000524214388	333356696	/nfs/dbraw/zinc/35/66/96/333356696.db2.gz	JZGSJRPMUBWCID-OAHLLOKOSA-N	0	0	251.414	4.018	20	30		CIEDRN
CC[C@H](Nc1nccc(C#N)c1Cl)c1ccccc1	ZINC000234040239	333357445	/nfs/dbraw/zinc/35/74/45/333357445.db2.gz	CVJHLZMEKPVFJA-ZDUSSCGKSA-N	0	0	271.751	4.170	20	30		CIEDRN
C=CCSCc1csc(-c2ccccc2F)n1	ZINC000524459316	333362600	/nfs/dbraw/zinc/36/26/00/333362600.db2.gz	UBMKPHJVKCYVIW-UHFFFAOYSA-N	0	0	265.378	4.368	20	30		CIEDRN
C=CCCC(=O)N[C@@H](CC1CCCCC1)C(C)(C)C	ZINC000524543686	333365725	/nfs/dbraw/zinc/36/57/25/333365725.db2.gz	QXZSZEPTLMFQLN-HNNXBMFYSA-N	0	0	265.441	4.454	20	30		CIEDRN
CSc1ccc(Oc2nccc(C#N)c2Cl)cc1	ZINC000235070039	333365739	/nfs/dbraw/zinc/36/57/39/333365739.db2.gz	UTSANDRDXGSABQ-UHFFFAOYSA-N	0	0	276.748	4.121	20	30		CIEDRN
C=CCCC(=O)N[C@H](CC1CCCCC1)C(C)(C)C	ZINC000524543687	333365794	/nfs/dbraw/zinc/36/57/94/333365794.db2.gz	QXZSZEPTLMFQLN-OAHLLOKOSA-N	0	0	265.441	4.454	20	30		CIEDRN
Cc1ccc([C@H](C)Nc2nccc(C#N)c2Cl)cc1	ZINC000235538751	333370660	/nfs/dbraw/zinc/37/06/60/333370660.db2.gz	FDUHRQBVMQUBTD-NSHDSACASA-N	0	0	271.751	4.088	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(Cl)cc1-n1cccc1	ZINC000524685174	333371125	/nfs/dbraw/zinc/37/11/25/333371125.db2.gz	JJTBNJPVHIDUSF-UHFFFAOYSA-N	0	0	274.751	4.035	20	30		CIEDRN
N#Cc1ccc(NC[C@H]2CCc3ccccc3N2)cc1Cl	ZINC000524687723	333371346	/nfs/dbraw/zinc/37/13/46/333371346.db2.gz	NLCAAIBIZVERII-OAHLLOKOSA-N	0	0	297.789	4.050	20	30		CIEDRN
N#Cc1ccnc(Oc2ccc(F)c(Cl)c2)c1Cl	ZINC000236257954	333373338	/nfs/dbraw/zinc/37/33/38/333373338.db2.gz	MFOOXSXCFGDPML-UHFFFAOYSA-N	0	0	283.089	4.191	20	30		CIEDRN
Cc1cc([C@@H](C)Nc2cc(C#N)c3ccccc3n2)c(C)o1	ZINC000316202670	333385905	/nfs/dbraw/zinc/38/59/05/333385905.db2.gz	CDAUQRYJOSTHDF-GFCCVEGCSA-N	0	0	291.354	4.489	20	30		CIEDRN
Cc1cccc(CCNc2cc(C#N)c3ccccc3n2)c1	ZINC000316210835	333386044	/nfs/dbraw/zinc/38/60/44/333386044.db2.gz	CYPVVBSPKLDGMV-UHFFFAOYSA-N	0	0	287.366	4.070	20	30		CIEDRN
Cc1ccc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)c(F)c1	ZINC000316428048	333393357	/nfs/dbraw/zinc/39/33/57/333393357.db2.gz	POPGWNUJCZXXLM-UHFFFAOYSA-N	0	0	296.345	4.188	20	30		CIEDRN
C[C@H](CCNc1ccc([N+](=O)[O-])c(C#N)c1)c1ccccc1	ZINC000316522059	333398372	/nfs/dbraw/zinc/39/83/72/333398372.db2.gz	WMCUNQOALPGGTH-CYBMUJFWSA-N	0	0	295.342	4.072	20	30		CIEDRN
C[C@@H](NCc1ccccc1C#N)c1ccccc1Cl	ZINC000026227428	333413503	/nfs/dbraw/zinc/41/35/03/333413503.db2.gz	ZTZGTTPVMAKPAM-GFCCVEGCSA-N	0	0	270.763	4.062	20	30		CIEDRN
CCCCC(=O)Nc1scc(C(C)(C)C)c1C#N	ZINC000075296493	333422937	/nfs/dbraw/zinc/42/29/37/333422937.db2.gz	ZVSMIUUFFPZHEO-UHFFFAOYSA-N	0	0	264.394	4.046	20	30		CIEDRN
N#Cc1ccc(NCCc2ccc(F)cc2)cc1Cl	ZINC000061845749	333449822	/nfs/dbraw/zinc/44/98/22/333449822.db2.gz	QTQWZBMPYMKIEW-UHFFFAOYSA-N	0	0	274.726	4.005	20	30		CIEDRN
CCC(C#N)(CC)C(=O)N[C@@H]1CCC[C@H](c2ccccc2)C1	ZINC000529163077	333475402	/nfs/dbraw/zinc/47/54/02/333475402.db2.gz	CYNACXXRVQGJOD-DLBZAZTESA-N	0	0	298.430	4.159	20	30		CIEDRN
CCC(C#N)(CC)C(=O)N1C[C@H](c2ccc(C)cc2)C[C@H]1C	ZINC000529203731	333477025	/nfs/dbraw/zinc/47/70/25/333477025.db2.gz	TZNUUXJMSDYGFT-NVXWUHKLSA-N	0	0	298.430	4.029	20	30		CIEDRN
C=CCOc1ccccc1CNc1cc(F)ccc1F	ZINC000037198334	333512652	/nfs/dbraw/zinc/51/26/52/333512652.db2.gz	OPZQBFIENANKCU-UHFFFAOYSA-N	0	0	275.298	4.142	20	30		CIEDRN
Cc1cc(C)cc(N[C@H](C)c2cccc(C#N)c2)c1	ZINC000037212561	333514849	/nfs/dbraw/zinc/51/48/49/333514849.db2.gz	ZSVXHWUXIWDKIH-CQSZACIVSA-N	0	0	250.345	4.348	20	30		CIEDRN
C[C@@H]1C[C@@H](C)CN(c2ccc(C#N)c(C(F)(F)F)c2)C1	ZINC000037306403	333531781	/nfs/dbraw/zinc/53/17/81/333531781.db2.gz	OOHYGRHZSZVZSZ-GHMZBOCLSA-N	0	0	282.309	4.059	20	30		CIEDRN
C=CCCCCCNC(=O)Nc1cnn([C@@H](C)CC)c1C	ZINC000576050785	335146090	/nfs/dbraw/zinc/14/60/90/335146090.db2.gz	SNAYVFDMNUYUEA-ZDUSSCGKSA-N	0	0	292.427	4.030	20	30		CIEDRN
N#Cc1ccc(CSc2ccc(F)c(F)c2)c(F)c1	ZINC000037375158	333532496	/nfs/dbraw/zinc/53/24/96/333532496.db2.gz	XRUJOVZUBPTPOE-UHFFFAOYSA-N	0	0	279.286	4.268	20	30		CIEDRN
N#Cc1cccc(CSc2ccc(F)c(F)c2)c1	ZINC000037374919	333532711	/nfs/dbraw/zinc/53/27/11/333532711.db2.gz	AVQFMYQTVOGJQO-UHFFFAOYSA-N	0	0	261.296	4.129	20	30		CIEDRN
C[C@H]1CCC[C@H](Nc2cccc(OCCCC#N)c2)C1	ZINC000037777391	333539517	/nfs/dbraw/zinc/53/95/17/333539517.db2.gz	KSTLNCYSPKHFSR-GJZGRUSLSA-N	0	0	272.392	4.360	20	30		CIEDRN
CCCOc1cc(C)ccc1NCc1cccc(C#N)c1	ZINC000037778186	333539683	/nfs/dbraw/zinc/53/96/83/333539683.db2.gz	FOPOLTSISQDCCZ-UHFFFAOYSA-N	0	0	280.371	4.268	20	30		CIEDRN
C=CCC[C@H](NC(=O)N(CC=C)C1CC1)c1ccccc1	ZINC000537925958	333540708	/nfs/dbraw/zinc/54/07/08/333540708.db2.gz	DASMQUAKQLHOAZ-KRWDZBQOSA-N	0	0	284.403	4.054	20	30		CIEDRN
CC1(C)Cc2cccc(NCc3ccc(F)c(C#N)c3)c2O1	ZINC000530383936	333545623	/nfs/dbraw/zinc/54/56/23/333545623.db2.gz	RVWGBOFRSTWKMX-UHFFFAOYSA-N	0	0	296.345	4.023	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1ccc(CC#N)cc1)c1ccccc1	ZINC000123870860	333554178	/nfs/dbraw/zinc/55/41/78/333554178.db2.gz	ZESOAXSEMXSQJN-MRXNPFEDSA-N	0	0	290.366	4.051	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)CCc1cccc(Cl)c1	ZINC000063961580	333562320	/nfs/dbraw/zinc/56/23/20/333562320.db2.gz	SRPUNQDIWMZCAR-UHFFFAOYSA-N	0	0	298.773	4.091	20	30		CIEDRN
C=C(CC)CNc1ccccc1SC[C@@H](C)C#N	ZINC000537994683	333569904	/nfs/dbraw/zinc/56/99/04/333569904.db2.gz	GFTLPWBZFTXKKU-ZDUSSCGKSA-N	0	0	260.406	4.316	20	30		CIEDRN
CCCCc1noc([C@@H](C)SCCC(C)(C)C#N)n1	ZINC000576067973	335148545	/nfs/dbraw/zinc/14/85/45/335148545.db2.gz	PUTBQXAFXZXINS-LLVKDONJSA-N	0	0	281.425	4.146	20	30		CIEDRN
C=CCCCN(C)C(=O)Nc1ccc(CC)c(CC)c1	ZINC000538217233	333579826	/nfs/dbraw/zinc/57/98/26/333579826.db2.gz	RXYKQAYEVKPDGQ-UHFFFAOYSA-N	0	0	274.408	4.241	20	30		CIEDRN
C=CCCOCCCCC(=O)N1CCC[C@](C)(CCC)C1	ZINC000538302119	333584250	/nfs/dbraw/zinc/58/42/50/333584250.db2.gz	RYDCSLCOYWYXSJ-SFHVURJKSA-N	0	0	295.467	4.178	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1ccc(Cl)cc1Cl	ZINC000538327703	333585564	/nfs/dbraw/zinc/58/55/64/333585564.db2.gz	IURFTCOOKNRZST-JTQLQIEISA-N	0	0	286.202	4.468	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)Nc1ncsc1C(C)C	ZINC000576070066	335149098	/nfs/dbraw/zinc/14/90/98/335149098.db2.gz	JBWIGQUCJQPWKX-NSHDSACASA-N	0	0	281.425	4.133	20	30		CIEDRN
CC(C)(C)c1cccc(OCCSCC2(C#N)CC2)c1	ZINC000538414320	333589798	/nfs/dbraw/zinc/58/97/98/333589798.db2.gz	GHBXMYIELBAUPL-UHFFFAOYSA-N	0	0	289.444	4.400	20	30		CIEDRN
CCC(C)(C)c1ccc(C(=O)[C@H](C#N)c2ccccn2)cc1	ZINC000126063067	333589878	/nfs/dbraw/zinc/58/98/78/333589878.db2.gz	GMLASRXVBWQMFB-MRXNPFEDSA-N	0	0	292.382	4.259	20	30		CIEDRN
C=C[C@H](CC(=O)N[C@H]1CCC[C@H]1CC)c1ccccc1	ZINC000126518492	333599031	/nfs/dbraw/zinc/59/90/31/333599031.db2.gz	IXAVGZUCQCTWRF-INMHGKMJSA-N	0	0	271.404	4.041	20	30		CIEDRN
COc1cc(C)nc(CS[C@H](C)c2ccc(C#N)cc2)c1	ZINC000538524861	333603990	/nfs/dbraw/zinc/60/39/90/333603990.db2.gz	CKFLHVNOBZAFGT-CYBMUJFWSA-N	0	0	298.411	4.265	20	30		CIEDRN
N#Cc1cc(/C=C\c2ccc3cccc(O)c3n2)ccc1F	ZINC000538857748	333638842	/nfs/dbraw/zinc/63/88/42/333638842.db2.gz	AQAWSKBHLRDCEH-DAXSKMNVSA-N	0	0	290.297	4.122	20	30		CIEDRN
C=CCN(C(=O)CCc1ccc(C(C)(C)C)cc1)C1CC1	ZINC000539033876	333649689	/nfs/dbraw/zinc/64/96/89/333649689.db2.gz	UXAWMWVWLBRCOI-UHFFFAOYSA-N	0	0	285.431	4.094	20	30		CIEDRN
Cc1csc(NC(=O)C/C=C\c2ccc(C)cc2)c1C#N	ZINC000576096397	335152484	/nfs/dbraw/zinc/15/24/84/335152484.db2.gz	FUWGVLYTGFKSPA-ARJAWSKDSA-N	0	0	296.395	4.279	20	30		CIEDRN
C=C(CC)CSc1nnc(-c2ccc(C)c(C)c2)o1	ZINC000539118503	333659211	/nfs/dbraw/zinc/65/92/11/333659211.db2.gz	LHHOYQBJXUEHIY-UHFFFAOYSA-N	0	0	274.389	4.412	20	30		CIEDRN
C=C(C)COc1cccc(NC(=O)CC[C@@H](C)SC)c1	ZINC000539121209	333659224	/nfs/dbraw/zinc/65/92/24/333659224.db2.gz	ZQRTVBZGUIKYKJ-CYBMUJFWSA-N	0	0	293.432	4.112	20	30		CIEDRN
CSc1cccc(NCc2ccccc2C#N)c1C	ZINC000539238025	333662631	/nfs/dbraw/zinc/66/26/31/333662631.db2.gz	AKPAQPHFBRWEAB-UHFFFAOYSA-N	0	0	268.385	4.201	20	30		CIEDRN
C=CCCOCCCCC(=O)N1CCC[C@H](CC(C)C)C1	ZINC000539388493	333668455	/nfs/dbraw/zinc/66/84/55/333668455.db2.gz	MHTSEJQFZOOKAL-QGZVFWFLSA-N	0	0	295.467	4.034	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N1CCC[C@@]2(CC=CCC2)C1	ZINC000539390740	333668767	/nfs/dbraw/zinc/66/87/67/333668767.db2.gz	WBFLNWQIPYLLGK-AEFFLSMTSA-N	0	0	290.451	4.263	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)[C@H](CC)Cc1ccccc1	ZINC000539433368	333671244	/nfs/dbraw/zinc/67/12/44/333671244.db2.gz	KUSMSYKUSBZGHG-NVXWUHKLSA-N	0	0	273.420	4.116	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1ccc(COC(C)C)cc1	ZINC000539433388	333671379	/nfs/dbraw/zinc/67/13/79/333671379.db2.gz	LNOLSEQRNYGGPK-OAHLLOKOSA-N	0	0	289.419	4.086	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N(C)C1CCCCCC1	ZINC000539468299	333672717	/nfs/dbraw/zinc/67/27/17/333672717.db2.gz	WSDKKHAEZDCMOC-AWEZNQCLSA-N	0	0	266.429	4.095	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N(C)C1CCCCCC1	ZINC000539468301	333672790	/nfs/dbraw/zinc/67/27/90/333672790.db2.gz	WSDKKHAEZDCMOC-CQSZACIVSA-N	0	0	266.429	4.095	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)c1sc(C(C)(C)C)nc1C	ZINC000539527144	333676339	/nfs/dbraw/zinc/67/63/39/333676339.db2.gz	INJGQYSWCZUUIO-LLVKDONJSA-N	0	0	294.464	4.224	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)C(=O)[C@@H]1CC[C@H](C)C1	ZINC000539548712	333677943	/nfs/dbraw/zinc/67/79/43/333677943.db2.gz	RXVUMDMEYAMKBY-NWDGAFQWSA-N	0	0	297.851	4.352	20	30		CIEDRN
C[C@H](NCc1ccc(C#N)o1)c1cccc(Cl)c1Cl	ZINC000174407612	335153928	/nfs/dbraw/zinc/15/39/28/335153928.db2.gz	YRQUVINKTJLHRG-VIFPVBQESA-N	0	0	295.169	4.309	20	30		CIEDRN
CCOCc1ccc(N[C@@H](C)c2ccc(C#N)c(F)c2)cc1	ZINC000539656273	333684007	/nfs/dbraw/zinc/68/40/07/333684007.db2.gz	XZXOBMMEDLDMNA-ZDUSSCGKSA-N	0	0	298.361	4.407	20	30		CIEDRN
CC(C)c1ccc(-c2nnc(SCC3(C#N)CC3)o2)cc1	ZINC000539756621	333689438	/nfs/dbraw/zinc/68/94/38/333689438.db2.gz	JWNBRKMFHOIAFI-UHFFFAOYSA-N	0	0	299.399	4.256	20	30		CIEDRN
CC(C)(C)CC(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1	ZINC000068454798	333700819	/nfs/dbraw/zinc/70/08/19/333700819.db2.gz	NRPRDVIXLUEHJD-GFCCVEGCSA-N	0	0	299.201	4.110	20	30		CIEDRN
C[C@H](CC(C)(C)c1ccccc1)Nc1cnccc1C#N	ZINC000539890358	333700944	/nfs/dbraw/zinc/70/09/44/333700944.db2.gz	XWOJVZUXSXCLGJ-CQSZACIVSA-N	0	0	279.387	4.122	20	30		CIEDRN
C=C(CC)CNc1ccccc1Oc1ncccc1C#N	ZINC000540194290	333720311	/nfs/dbraw/zinc/72/03/11/333720311.db2.gz	FKAYIINWDYGWDD-UHFFFAOYSA-N	0	0	279.343	4.124	20	30		CIEDRN
C=C(CC)CS[C@@H](C)c1cn(-c2ccccc2)nn1	ZINC000540194069	333720343	/nfs/dbraw/zinc/72/03/43/333720343.db2.gz	ZNSKNXLLECSQQE-ZDUSSCGKSA-N	0	0	273.405	4.028	20	30		CIEDRN
C[C@H]1CCC[C@H](N(C)c2cc(C#N)c3ccccc3n2)C1	ZINC000068772479	333728624	/nfs/dbraw/zinc/72/86/24/333728624.db2.gz	AWHKKXRWXZWQEY-ZFWWWQNUSA-N	0	0	279.387	4.121	20	30		CIEDRN
C[C@H](Nc1cc(C#N)c2ccccc2n1)c1ccccc1	ZINC000068769780	333728725	/nfs/dbraw/zinc/72/87/25/333728725.db2.gz	HHUYPJZVNLUCFJ-ZDUSSCGKSA-N	0	0	273.339	4.280	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N(C)C[C@H](C)c1ccccc1	ZINC000540487798	333731974	/nfs/dbraw/zinc/73/19/74/333731974.db2.gz	AHVJQHKCPPSBEL-HOTGVXAUSA-N	0	0	288.435	4.176	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)N1CCC[C@@H]1C1CCCC1	ZINC000540487778	333732009	/nfs/dbraw/zinc/73/20/09/333732009.db2.gz	NVOBFBVKLDEORD-GDBMZVCRSA-N	0	0	278.440	4.095	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)c1ccc(F)c(CSC)c1	ZINC000540530411	333733894	/nfs/dbraw/zinc/73/38/94/333733894.db2.gz	BVHBRZJIWPOMGF-LBPRGKRZSA-N	0	0	295.423	4.163	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N(CC=C)Cc1ccccc1	ZINC000540564178	333735386	/nfs/dbraw/zinc/73/53/86/333735386.db2.gz	OSUQCLUWKXLUAO-INIZCTEOSA-N	0	0	286.419	4.129	20	30		CIEDRN
C[C@H](SCC1(C#N)CC1)c1cccc(Cl)c1	ZINC000540615494	333735873	/nfs/dbraw/zinc/73/58/73/333735873.db2.gz	MYTXCPSFUAWFIU-JTQLQIEISA-N	0	0	251.782	4.438	20	30		CIEDRN
Cc1cccc(C)c1CC(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000540691403	333741945	/nfs/dbraw/zinc/74/19/45/333741945.db2.gz	CEUANVVPGINXPI-UHFFFAOYSA-N	0	0	298.773	4.010	20	30		CIEDRN
CCc1ccc(N[C@H](C)c2cccc(C#N)c2)cc1F	ZINC000540746242	333744794	/nfs/dbraw/zinc/74/47/94/333744794.db2.gz	SGKVLNIVEFGVSG-GFCCVEGCSA-N	0	0	268.335	4.433	20	30		CIEDRN
CCCC[C@@H](CCC)NC(=O)c1ccc(C2(C#N)CC2)cc1	ZINC000540758913	333746133	/nfs/dbraw/zinc/74/61/33/333746133.db2.gz	ZUJHCWOSKAHMQX-QGZVFWFLSA-N	0	0	298.430	4.330	20	30		CIEDRN
C[C@H]1CCCN(c2ccccc2OCCC(C)(C)C#N)C1	ZINC000540843200	333749986	/nfs/dbraw/zinc/74/99/86/333749986.db2.gz	KXWDPHOHZUNKRB-HNNXBMFYSA-N	0	0	286.419	4.242	20	30		CIEDRN
C=C(C)COc1cccc(NCC(C)(C)CCC#N)c1	ZINC000129255228	333754131	/nfs/dbraw/zinc/75/41/31/333754131.db2.gz	ZLCDXUTZBSBMOL-UHFFFAOYSA-N	0	0	272.392	4.383	20	30		CIEDRN
C=C(C)COc1cccc(NCc2cccc(C#N)c2)c1	ZINC000129254101	333754135	/nfs/dbraw/zinc/75/41/35/333754135.db2.gz	IONOEDPLWBLEJJ-UHFFFAOYSA-N	0	0	278.355	4.125	20	30		CIEDRN
Cc1ccc(Cl)c2ccc(N3CCC(CC#N)CC3)nc12	ZINC000541007355	333757965	/nfs/dbraw/zinc/75/79/65/333757965.db2.gz	WHCSPVYUSCTTMM-UHFFFAOYSA-N	0	0	299.805	4.327	20	30		CIEDRN
CC[C@@H](CC(=O)N1CCC(CC#N)CC1)c1ccc(C)cc1	ZINC000541049253	333760625	/nfs/dbraw/zinc/76/06/25/333760625.db2.gz	JFLKWPVRNOZNSO-KRWDZBQOSA-N	0	0	298.430	4.031	20	30		CIEDRN
C[C@@H]1CN(c2cc(C#N)c3ccccc3n2)[C@@H]2CCCC[C@H]21	ZINC000541111175	333762551	/nfs/dbraw/zinc/76/25/51/333762551.db2.gz	BTHIYFOMBDJCBR-QIIPPGSGSA-N	0	0	291.398	4.121	20	30		CIEDRN
CCCCCN(C(=O)c1ccc(Cl)c(C#N)c1)C(C)C	ZINC000541609694	333784035	/nfs/dbraw/zinc/78/40/35/333784035.db2.gz	CMAXWUXHECHPDV-UHFFFAOYSA-N	0	0	292.810	4.252	20	30		CIEDRN
C=CCCC(=O)Nc1ccccc1COC(C)(C)CC	ZINC000541631765	333784972	/nfs/dbraw/zinc/78/49/72/333784972.db2.gz	ZTINOIXUEOIWDP-UHFFFAOYSA-N	0	0	275.392	4.297	20	30		CIEDRN
C=CCCCC(=O)NC1(Cc2ccccc2)CCCC1	ZINC000541659914	333786407	/nfs/dbraw/zinc/78/64/07/333786407.db2.gz	COSKKYFRYBBJMP-UHFFFAOYSA-N	0	0	271.404	4.014	20	30		CIEDRN
C[C@@H]1CCCC[C@@H]1Nc1cc(C#N)c2ccccc2n1	ZINC000070543233	333815780	/nfs/dbraw/zinc/81/57/80/333815780.db2.gz	OFRFATYXYBBLKN-DOMZBBRYSA-N	0	0	265.360	4.097	20	30		CIEDRN
C/C(=C\c1cccc(C(F)(F)F)c1)CN(C)C[C@H](C)C#N	ZINC000576147930	335160403	/nfs/dbraw/zinc/16/04/03/335160403.db2.gz	SOSNXXSNBARWOI-BWODNOAJSA-N	0	0	296.336	4.200	20	30		CIEDRN
Cc1ccc(C)c(N(C)Cc2ccc(CC#N)cc2)c1	ZINC000542210861	333816196	/nfs/dbraw/zinc/81/61/96/333816196.db2.gz	WPHWOJXFIMINTE-UHFFFAOYSA-N	0	0	264.372	4.006	20	30		CIEDRN
Cc1ccc([C@@H]2CCCCN2c2nccc(C)c2C#N)cc1	ZINC000542211423	333816208	/nfs/dbraw/zinc/81/62/08/333816208.db2.gz	XCQXNALBYROTRF-SFHVURJKSA-N	0	0	291.398	4.302	20	30		CIEDRN
N#CCc1ccc(CNc2ccccc2OCC2CC2)cc1	ZINC000542223598	333817226	/nfs/dbraw/zinc/81/72/26/333817226.db2.gz	CGLNJRNZWDHYKY-UHFFFAOYSA-N	0	0	292.382	4.154	20	30		CIEDRN
C=C(C)CN(CC)C(=O)c1ccc(C(C)(C)C)s1	ZINC000130263638	333828811	/nfs/dbraw/zinc/82/88/11/333828811.db2.gz	JSWSJFZVSMMXTL-UHFFFAOYSA-N	0	0	265.422	4.084	20	30		CIEDRN
C=CCCCCCN(C)C(=O)NC[C@H](C)c1ccccc1	ZINC000542536129	333831333	/nfs/dbraw/zinc/83/13/33/333831333.db2.gz	ORMPWVYVLCFPBY-INIZCTEOSA-N	0	0	288.435	4.178	20	30		CIEDRN
CC(C)c1cccc(-c2ccc(C(=O)NC(C)(C)C#N)o2)c1	ZINC000542829858	333843697	/nfs/dbraw/zinc/84/36/97/333843697.db2.gz	HRMBMTGTLMYJOU-UHFFFAOYSA-N	0	0	296.370	4.102	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N[C@@H](C)c1cc(C)cc(C)c1	ZINC000542847749	333845038	/nfs/dbraw/zinc/84/50/38/333845038.db2.gz	SLTPRGWCCPTYCB-HOCLYGCPSA-N	0	0	274.408	4.018	20	30		CIEDRN
CCSc1ccccc1OCCOc1ccccc1C#N	ZINC000542925203	333850020	/nfs/dbraw/zinc/85/00/20/333850020.db2.gz	ZFMXFTDSMOBTBX-UHFFFAOYSA-N	0	0	299.395	4.128	20	30		CIEDRN
CC(C)n1ccc(CSc2cccc(Cl)c2C#N)n1	ZINC000543031321	333853511	/nfs/dbraw/zinc/85/35/11/333853511.db2.gz	BSVWYYQVZQNZMI-UHFFFAOYSA-N	0	0	291.807	4.281	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N1Cc2ccccc2[C@@H]1C	ZINC000543042634	333853650	/nfs/dbraw/zinc/85/36/50/333853650.db2.gz	LTVPHKFLCINQME-KBPBESRZSA-N	0	0	272.392	4.018	20	30		CIEDRN
Cc1ccnc(N2CC[C@H](c3ccccc3)C[C@H]2C)c1C#N	ZINC000543068492	333855272	/nfs/dbraw/zinc/85/52/72/333855272.db2.gz	YXRGIFJRVXKBPV-WBVHZDCISA-N	0	0	291.398	4.034	20	30		CIEDRN
COCc1cccc(CSCc2ccc(CC#N)cc2)c1	ZINC000543151469	333861360	/nfs/dbraw/zinc/86/13/60/333861360.db2.gz	GWKBRIHOUOQMAG-UHFFFAOYSA-N	0	0	297.423	4.332	20	30		CIEDRN
N#Cc1cc(F)ccc1N1CCC(Cc2ccccc2)CC1	ZINC000071650022	333868489	/nfs/dbraw/zinc/86/84/89/333868489.db2.gz	ITSXAFWUEKXHLG-UHFFFAOYSA-N	0	0	294.373	4.156	20	30		CIEDRN
CCN(C(=O)[C@H](C)CCC(C)(C)C)c1ccc(C#N)cc1	ZINC000543439811	333874699	/nfs/dbraw/zinc/87/46/99/333874699.db2.gz	UHOKWECATSSVFI-CQSZACIVSA-N	0	0	286.419	4.374	20	30		CIEDRN
C[C@@H](CCC(C)(C)C)C(=O)N[C@H](C#N)C1CCCCC1	ZINC000543453584	333876155	/nfs/dbraw/zinc/87/61/55/333876155.db2.gz	PROCVAVLVQPPQO-DZGCQCFKSA-N	0	0	278.440	4.037	20	30		CIEDRN
C=CC[C@H](C)NC(=O)Nc1cccc(C(F)F)c1Cl	ZINC000543649941	333887316	/nfs/dbraw/zinc/88/73/16/333887316.db2.gz	CTSNJWFAFJTWHK-QMMMGPOBSA-N	0	0	288.725	4.364	20	30		CIEDRN
C[C@H](NCc1ccc([C@H]2C[C@H]2C)o1)c1ccc(C#N)cc1F	ZINC000543762224	333897089	/nfs/dbraw/zinc/89/70/89/333897089.db2.gz	JJBCSEAAAUFVNA-WQGACYEGSA-N	0	0	298.361	4.265	20	30		CIEDRN
C=CCN(Cc1cccc(C#N)c1)C(=O)C1CCCCCC1	ZINC000072077292	333903303	/nfs/dbraw/zinc/90/33/03/333903303.db2.gz	SEKVZXKDMFWSOA-UHFFFAOYSA-N	0	0	296.414	4.043	20	30		CIEDRN
Cc1ccc([C@@H]2CCCN2c2nccc(C)c2C#N)cc1C	ZINC000544066207	333913845	/nfs/dbraw/zinc/91/38/45/333913845.db2.gz	LYVSPNYUENSNNL-SFHVURJKSA-N	0	0	291.398	4.220	20	30		CIEDRN
Cc1c(Cl)cnc(N(C)[C@H](C)c2cccs2)c1C#N	ZINC000544149567	333919293	/nfs/dbraw/zinc/91/92/93/333919293.db2.gz	JNOQOIQCCJOCRD-SNVBAGLBSA-N	0	0	291.807	4.174	20	30		CIEDRN
CCC(CC)[C@@H](C)C(=O)N(Cc1ccc(C#N)cc1)C1CC1	ZINC000544286965	333923675	/nfs/dbraw/zinc/92/36/75/333923675.db2.gz	YKMHODSZZGUWGD-CQSZACIVSA-N	0	0	298.430	4.122	20	30		CIEDRN
CCOc1ccc(C#N)cc1N[C@@H](C)CCC(F)(F)F	ZINC000544371274	333927543	/nfs/dbraw/zinc/92/75/43/333927543.db2.gz	OEODESMDICOXDV-JTQLQIEISA-N	0	0	286.297	4.100	20	30		CIEDRN
C=CCC[C@H](C)N[C@H](CCc1ccccc1)C(F)(F)F	ZINC000544573253	333936954	/nfs/dbraw/zinc/93/69/54/333936954.db2.gz	UUAWVXMYOWNTDC-DZGCQCFKSA-N	0	0	285.353	4.494	20	30		CIEDRN
C=CCC[C@H](C)Nc1cccc2c1CN(c1ccccn1)C2	ZINC000544602815	333939663	/nfs/dbraw/zinc/93/96/63/333939663.db2.gz	DCGPZRJBZPHTKK-HNNXBMFYSA-N	0	0	293.414	4.368	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC(c2ccccc2C)CC1	ZINC000131540648	333947792	/nfs/dbraw/zinc/94/77/92/333947792.db2.gz	ZSZLTKJSPWWVQA-UHFFFAOYSA-N	0	0	297.442	4.469	20	30		CIEDRN
Cc1csc(NC(=O)CC2(C)CCCCC2)c1C#N	ZINC000576190516	335167241	/nfs/dbraw/zinc/16/72/41/335167241.db2.gz	JVKWVHALIMIXQH-UHFFFAOYSA-N	0	0	276.405	4.227	20	30		CIEDRN
C=CCCc1ccccc1N[C@H]1CCO[C@@H](C(F)(F)F)C1	ZINC000576193949	335167508	/nfs/dbraw/zinc/16/75/08/335167508.db2.gz	MHSZMNRBOGLUSJ-DZGCQCFKSA-N	0	0	299.336	4.327	20	30		CIEDRN
Cc1ccc(-c2ccc(OC[C@@H](C#N)CCC#N)cc2)cc1	ZINC000073089929	333968048	/nfs/dbraw/zinc/96/80/48/333968048.db2.gz	HLFGRTFPAXTQRQ-MRXNPFEDSA-N	0	0	290.366	4.484	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)c1oc(CC)cc1C	ZINC000132189876	333974560	/nfs/dbraw/zinc/97/45/60/333974560.db2.gz	DVQNIMNTIPICAT-UHFFFAOYSA-N	0	0	289.400	4.040	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cccc(CSC)c1	ZINC000132194292	333974565	/nfs/dbraw/zinc/97/45/65/333974565.db2.gz	MBDHLJXMEJBBSF-UHFFFAOYSA-N	0	0	275.417	4.257	20	30		CIEDRN
C=CCCCc1nc(-c2ccc(C(F)(F)F)cc2)no1	ZINC000545584640	333990131	/nfs/dbraw/zinc/99/01/31/333990131.db2.gz	AGDFISOIQPZONH-UHFFFAOYSA-N	0	0	282.265	4.264	20	30		CIEDRN
C=C[C@H](Cc1nc(C(CC)CC)no1)c1ccccc1	ZINC000545670753	333994105	/nfs/dbraw/zinc/99/41/05/333994105.db2.gz	HAOIBLWXMBDABZ-CQSZACIVSA-N	0	0	270.376	4.486	20	30		CIEDRN
C[C@H](c1noc(/C=C/c2ccc(C#N)cc2)n1)C(C)(C)C	ZINC000545727002	333997097	/nfs/dbraw/zinc/99/70/97/333997097.db2.gz	HNEJGAMKXGJSSO-BZYZDCJZSA-N	0	0	281.359	4.261	20	30		CIEDRN
C=CCC(CC=C)c1nc(COc2ccccc2C)no1	ZINC000545735436	333997426	/nfs/dbraw/zinc/99/74/26/333997426.db2.gz	KSSYZLWZUMFLNF-UHFFFAOYSA-N	0	0	284.359	4.193	20	30		CIEDRN
N#Cc1ccc(/C=C/c2nc(CC3=CCCCC3)no2)cc1	ZINC000546272966	334024229	/nfs/dbraw/zinc/02/42/29/334024229.db2.gz	ZIQRUYBOEVBALL-ZHACJKMWSA-N	0	0	291.354	4.155	20	30		CIEDRN
C=C[C@H](Cc1nc(-c2ccccc2F)no1)c1ccccc1	ZINC000546298295	334026439	/nfs/dbraw/zinc/02/64/39/334026439.db2.gz	KIJZRZNCTQSVDV-CYBMUJFWSA-N	0	0	294.329	4.388	20	30		CIEDRN
C[C@H](CC(=O)Nc1sccc1C#N)C1CCCCC1	ZINC000133216933	334028124	/nfs/dbraw/zinc/02/81/24/334028124.db2.gz	CDHREQOKXACECG-LLVKDONJSA-N	0	0	276.405	4.165	20	30		CIEDRN
N#CCc1cccc(-c2nc(CCC3CCCCC3)no2)c1	ZINC000546340266	334028260	/nfs/dbraw/zinc/02/82/60/334028260.db2.gz	QIRLCWRQSANTRQ-UHFFFAOYSA-N	0	0	295.386	4.316	20	30		CIEDRN
C[C@@H]1CCC[C@H](c2noc(-c3ccc(CC#N)cc3)n2)C1	ZINC000546349715	334028902	/nfs/dbraw/zinc/02/89/02/334028902.db2.gz	WZBBJDNYAMBICD-DOMZBBRYSA-N	0	0	281.359	4.096	20	30		CIEDRN
C=CCCOCCCCc1nc([C@@H]2CCC[C@@H](C)C2)no1	ZINC000546358427	334029170	/nfs/dbraw/zinc/02/91/70/334029170.db2.gz	WGDQJZZDHWGKBW-HUUCEWRRSA-N	0	0	292.423	4.279	20	30		CIEDRN
C[C@H](c1noc(/C=C/c2cccc(C#N)c2)n1)C(C)(C)C	ZINC000546418523	334031662	/nfs/dbraw/zinc/03/16/62/334031662.db2.gz	GAGDSOHAEQAEGB-IDVQTMNDSA-N	0	0	281.359	4.261	20	30		CIEDRN
C=CCC(CC=C)c1nc(-c2ccc(F)cc2C)no1	ZINC000546498337	334035845	/nfs/dbraw/zinc/03/58/45/334035845.db2.gz	CKTMWRUACFPWSU-UHFFFAOYSA-N	0	0	272.323	4.420	20	30		CIEDRN
C=C(C)CSc1nnc(-c2c(C)cc(C)cc2C)o1	ZINC000075457031	334042254	/nfs/dbraw/zinc/04/22/54/334042254.db2.gz	JRHCYFHDHBGFIY-UHFFFAOYSA-N	0	0	274.389	4.330	20	30		CIEDRN
N#CCc1ccc(NCc2ccc(F)c3cccnc23)cc1	ZINC000546782158	334050456	/nfs/dbraw/zinc/05/04/56/334050456.db2.gz	QSVBEUQICWNGTN-UHFFFAOYSA-N	0	0	291.329	4.052	20	30		CIEDRN
C=CCC[C@@H](NC(=O)Cc1cccs1)c1ccccc1	ZINC000133743570	334052162	/nfs/dbraw/zinc/05/21/62/334052162.db2.gz	IOBOUTACRVBFOV-MRXNPFEDSA-N	0	0	285.412	4.114	20	30		CIEDRN
C=CCC(CC=C)C(=O)N[C@H](C)c1c(C)cccc1C	ZINC000546866744	334052377	/nfs/dbraw/zinc/05/23/77/334052377.db2.gz	RPSNRQKJAHREPO-OAHLLOKOSA-N	0	0	271.404	4.249	20	30		CIEDRN
C=CCC(CC=C)C(=O)N1CCC[C@@H]1C(C)(C)CC	ZINC000133776172	334055216	/nfs/dbraw/zinc/05/52/16/334055216.db2.gz	ZKLCSUJNWQCHEO-OAHLLOKOSA-N	0	0	263.425	4.182	20	30		CIEDRN
CC(=O)c1ccc(OCc2ccccc2C(C)(C)C#N)cc1	ZINC000133781724	334056570	/nfs/dbraw/zinc/05/65/70/334056570.db2.gz	VDQFIHKSGUFQNM-UHFFFAOYSA-N	0	0	293.366	4.269	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N[C@H](C)C(C)(C)C	ZINC000576231720	335175044	/nfs/dbraw/zinc/17/50/44/335175044.db2.gz	RQAMLMOTEAZIBJ-GFCCVEGCSA-N	0	0	277.433	4.129	20	30		CIEDRN
C[C@@H]1CCC[C@H](c2noc(C3(C#N)CCCCC3)n2)C1	ZINC000547056552	334064189	/nfs/dbraw/zinc/06/41/89/334064189.db2.gz	JRLSQNMYMOBLHT-OLZOCXBDSA-N	0	0	273.380	4.089	20	30		CIEDRN
C=CCC(CC=C)c1nc(-c2ccc(OC)c(C)c2)no1	ZINC000547128492	334068221	/nfs/dbraw/zinc/06/82/21/334068221.db2.gz	JYQNRYTWNWHMOB-UHFFFAOYSA-N	0	0	284.359	4.289	20	30		CIEDRN
C=CCCCc1nc([C@@H]2CCCc3cc(OC)ccc32)no1	ZINC000547232942	334074442	/nfs/dbraw/zinc/07/44/42/334074442.db2.gz	KLUKQTUTTJTCQC-MRXNPFEDSA-N	0	0	298.386	4.055	20	30		CIEDRN
CC[C@@H](CC#N)NCc1ccc(-c2ccccc2)cc1F	ZINC000547287173	334075998	/nfs/dbraw/zinc/07/59/98/334075998.db2.gz	FXGHBDJTNICNKC-KRWDZBQOSA-N	0	0	282.362	4.275	20	30		CIEDRN
CCn1c2ccccc2c2cc(CNC[C@@H](C)C#N)ccc21	ZINC000237228458	334084259	/nfs/dbraw/zinc/08/42/59/334084259.db2.gz	VZKFXMRNYLFZSW-AWEZNQCLSA-N	0	0	291.398	4.064	20	30		CIEDRN
N#CC1(C(=O)Nc2ccc(F)c(C3CC3)c2)CCCCC1	ZINC000547376943	334084787	/nfs/dbraw/zinc/08/47/87/334084787.db2.gz	NZWHZNVPIDZRLV-UHFFFAOYSA-N	0	0	286.350	4.116	20	30		CIEDRN
Cc1cc(COc2ccc(C#N)cc2F)c2ccccc2n1	ZINC000134318998	334087564	/nfs/dbraw/zinc/08/75/64/334087564.db2.gz	DYZJYWLSWDWOGH-UHFFFAOYSA-N	0	0	292.313	4.133	20	30		CIEDRN
Cc1cc(NC(=O)C2(C#N)CCCCC2)ccc1C1CC1	ZINC000547492957	334093803	/nfs/dbraw/zinc/09/38/03/334093803.db2.gz	YBRASCLPQZQHPT-UHFFFAOYSA-N	0	0	282.387	4.285	20	30		CIEDRN
C=C[C@H](CC(=O)Nc1cccc2cc[nH]c21)c1ccccc1	ZINC000547497837	334094461	/nfs/dbraw/zinc/09/44/61/334094461.db2.gz	XUZRRPQRFHWMMX-CQSZACIVSA-N	0	0	290.366	4.466	20	30		CIEDRN
C=CCCC(=O)CSc1ncc(-c2ccc(F)cc2)o1	ZINC000134696201	334100861	/nfs/dbraw/zinc/10/08/61/334100861.db2.gz	YDUXIXMVYQZJJN-UHFFFAOYSA-N	0	0	291.347	4.108	20	30		CIEDRN
C=CCSc1ccccc1C(=O)N(CC1CC1)C(C)C	ZINC000547607943	334102720	/nfs/dbraw/zinc/10/27/20/334102720.db2.gz	WFIGQZKWZVDSQG-UHFFFAOYSA-N	0	0	289.444	4.225	20	30		CIEDRN
C=CCN(C(=O)c1ccc2cc[nH]c2c1)c1ccccc1	ZINC000077588666	334109408	/nfs/dbraw/zinc/10/94/08/334109408.db2.gz	IZSDXKJTQKQERU-UHFFFAOYSA-N	0	0	276.339	4.001	20	30		CIEDRN
C=C[C@H](CC(=O)N1CCCC[C@H]1C(C)C)c1ccccc1	ZINC000135100885	334115376	/nfs/dbraw/zinc/11/53/76/334115376.db2.gz	QVWRFHZFDGLHSC-AEFFLSMTSA-N	0	0	285.431	4.383	20	30		CIEDRN
N#Cc1cc(F)ccc1NC(=O)c1cc2ccccc2s1	ZINC000135156261	334118314	/nfs/dbraw/zinc/11/83/14/334118314.db2.gz	KPWBPKUQAHSIEH-UHFFFAOYSA-N	0	0	296.326	4.164	20	30		CIEDRN
C[C@@H](Nc1ccc(C(F)(F)F)c(C#N)c1)c1ccccn1	ZINC000135306296	334124701	/nfs/dbraw/zinc/12/47/01/334124701.db2.gz	YOTDLKNNNBXFBH-SNVBAGLBSA-N	0	0	291.276	4.145	20	30		CIEDRN
CC[C@@H]1CCCC[C@@H]1N(C)C(=O)Nc1ccc(CC#N)cc1	ZINC000135360622	334127695	/nfs/dbraw/zinc/12/76/95/334127695.db2.gz	UFKFGOKNBKQQJC-WBVHZDCISA-N	0	0	299.418	4.185	20	30		CIEDRN
C=C(C)CN(CC)C(=O)Nc1sc(C)nc1CC(C)C	ZINC000135439191	334130123	/nfs/dbraw/zinc/13/01/23/334130123.db2.gz	JIVOKJLIDBFOCS-UHFFFAOYSA-N	0	0	295.452	4.080	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1ccc(Cc2ccncc2)cc1	ZINC000135461430	334130699	/nfs/dbraw/zinc/13/06/99/334130699.db2.gz	XZTQDMJWMAGTGF-IBGZPJMESA-N	0	0	294.398	4.213	20	30		CIEDRN
C=CCc1ccc(OCCCC(C)(C)C#N)c(OC)c1	ZINC000135478744	334131243	/nfs/dbraw/zinc/13/12/43/334131243.db2.gz	SANSZTLZPPQNBB-UHFFFAOYSA-N	0	0	273.376	4.132	20	30		CIEDRN
C=CC[C@H](C(=O)N[C@H](C)Cc1ccsc1)c1ccccc1	ZINC000547953917	334131254	/nfs/dbraw/zinc/13/12/54/334131254.db2.gz	CQXYRUPNSNVCJP-PBHICJAKSA-N	0	0	299.439	4.155	20	30		CIEDRN
Cc1cccc(Cl)c1OCCCC(C)(C)C#N	ZINC000135505101	334132090	/nfs/dbraw/zinc/13/20/90/334132090.db2.gz	VXLQSHKVDODGLN-UHFFFAOYSA-N	0	0	251.757	4.357	20	30		CIEDRN
CCn1c2ccc(C#N)cc2nc1-c1ccc(F)cc1C	ZINC000135520507	334132437	/nfs/dbraw/zinc/13/24/37/334132437.db2.gz	YFHRSRGUHGZVLB-UHFFFAOYSA-N	0	0	279.318	4.042	20	30		CIEDRN
C=C[C@H](CC(=O)N(C(C)C)C1CCC1)c1ccccc1	ZINC000135535831	334132585	/nfs/dbraw/zinc/13/25/85/334132585.db2.gz	SKLLBPRQIYWOHQ-OAHLLOKOSA-N	0	0	271.404	4.136	20	30		CIEDRN
CCC(C)(C)c1ccc(NC(=O)C2(C#N)CC(C)C2)cc1	ZINC000548074948	334138294	/nfs/dbraw/zinc/13/82/94/334138294.db2.gz	OTFOXZHWUKKEDO-UHFFFAOYSA-N	0	0	284.403	4.253	20	30		CIEDRN
C[C@H]1CCCC[C@@H]1CNc1nc(C(F)(F)F)ccc1C#N	ZINC000078834840	334141205	/nfs/dbraw/zinc/14/12/05/334141205.db2.gz	JJUMYWJUQMKPMS-CMPLNLGQSA-N	0	0	297.324	4.210	20	30		CIEDRN
CC[C@H]1CCCC[C@H]1Nc1nc(C(F)(F)F)ccc1C#N	ZINC000078833808	334141221	/nfs/dbraw/zinc/14/12/21/334141221.db2.gz	KHEBKAUQNKCULJ-CMPLNLGQSA-N	0	0	297.324	4.353	20	30		CIEDRN
C[C@H]1CCCN(c2ccc(C#N)cc2C(F)(F)F)CC1	ZINC000078838954	334141349	/nfs/dbraw/zinc/14/13/49/334141349.db2.gz	LZGHTUYZTWKSJW-NSHDSACASA-N	0	0	282.309	4.203	20	30		CIEDRN
CC(=O)c1ccc2cc(Oc3ccncc3C#N)ccc2c1	ZINC000548153627	334143433	/nfs/dbraw/zinc/14/34/33/334143433.db2.gz	RYSMFMDPGFHEIT-UHFFFAOYSA-N	0	0	288.306	4.101	20	30		CIEDRN
C=CC[C@H](C(=O)NCCCc1cccs1)c1ccccc1	ZINC000548288154	334148806	/nfs/dbraw/zinc/14/88/06/334148806.db2.gz	VIZRSNIDLBAZCE-KRWDZBQOSA-N	0	0	299.439	4.157	20	30		CIEDRN
CC[C@@H](CC#N)NC(=O)Nc1ccc(CCC(C)C)cc1	ZINC000548442313	334156478	/nfs/dbraw/zinc/15/64/78/334156478.db2.gz	SXKJXLVMDMXZSY-HNNXBMFYSA-N	0	0	287.407	4.089	20	30		CIEDRN
C[C@H](Nc1cccc2cc[nH]c21)c1ccc(C#N)cc1	ZINC000548462239	334157756	/nfs/dbraw/zinc/15/77/56/334157756.db2.gz	KFZCHIMIVJYAOP-LBPRGKRZSA-N	0	0	261.328	4.213	20	30		CIEDRN
C[C@@H](Nc1cccc2cc[nH]c21)c1ccc(C#N)cc1	ZINC000548462238	334157770	/nfs/dbraw/zinc/15/77/70/334157770.db2.gz	KFZCHIMIVJYAOP-GFCCVEGCSA-N	0	0	261.328	4.213	20	30		CIEDRN
Cn1ccc2c1cccc2NCc1ccc(Cl)cc1C#N	ZINC000548467764	334158106	/nfs/dbraw/zinc/15/81/06/334158106.db2.gz	WTAZMRCKXLIXQQ-UHFFFAOYSA-N	0	0	295.773	4.315	20	30		CIEDRN
N#CCSc1cccc(-c2nc(-c3ccsc3)no2)c1	ZINC000079942400	334164290	/nfs/dbraw/zinc/16/42/90/334164290.db2.gz	AJDJLBZOZBMKNR-UHFFFAOYSA-N	0	0	299.380	4.081	20	30		CIEDRN
N#CCN(Cc1c(Cl)cccc1Cl)C1CCCC1	ZINC000080215912	334167788	/nfs/dbraw/zinc/16/77/88/334167788.db2.gz	RPROMAXCNIPYMJ-UHFFFAOYSA-N	0	0	283.202	4.262	20	30		CIEDRN
Cc1ccc(C[C@@H](C)Nc2ccc(C#N)cc2F)s1	ZINC000080245269	334168351	/nfs/dbraw/zinc/16/83/51/334168351.db2.gz	JCYBIIYLDMMOIR-SNVBAGLBSA-N	0	0	274.364	4.110	20	30		CIEDRN
CCc1c(NCc2cccc(C#N)c2)cnn1C(CC)CC	ZINC000548746864	334169057	/nfs/dbraw/zinc/16/90/57/334169057.db2.gz	SBSCIIRUZRPHAX-UHFFFAOYSA-N	0	0	296.418	4.290	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CC[C@@H](CC(C)C)C1)c1ccccc1	ZINC000137086470	334169705	/nfs/dbraw/zinc/16/97/05/334169705.db2.gz	YNHMDSKDOPCNEC-IRXDYDNUSA-N	0	0	285.431	4.241	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)c1cccc2[nH]ccc21	ZINC000080509658	334172277	/nfs/dbraw/zinc/17/22/77/334172277.db2.gz	JXKMYOMKZPWWPQ-UHFFFAOYSA-N	0	0	296.395	4.058	20	30		CIEDRN
C[C@H](CCC(=O)N(C)c1cccc(C#N)c1)c1ccccc1	ZINC000138042566	334188373	/nfs/dbraw/zinc/18/83/73/334188373.db2.gz	VYRRNOYVQDLCAN-OAHLLOKOSA-N	0	0	292.382	4.105	20	30		CIEDRN
C=CCOCCS[C@@H](C)c1ccc(Cl)cc1	ZINC000549350473	334191081	/nfs/dbraw/zinc/19/10/81/334191081.db2.gz	XVEDXIAMHJTJAV-NSHDSACASA-N	0	0	256.798	4.337	20	30		CIEDRN
C[C@@H]1CC[C@H](Sc2nc(C(F)(F)F)ccc2C#N)C1	ZINC000549393276	334192165	/nfs/dbraw/zinc/19/21/65/334192165.db2.gz	LPMRIXDQHLZIJE-SCZZXKLOSA-N	0	0	286.322	4.253	20	30		CIEDRN
C[C@H]1CC[C@@H](Sc2nc(C(F)(F)F)ccc2C#N)C1	ZINC000549393277	334192322	/nfs/dbraw/zinc/19/23/22/334192322.db2.gz	LPMRIXDQHLZIJE-WCBMZHEXSA-N	0	0	286.322	4.253	20	30		CIEDRN
N#CCN[C@@H](c1cccc(C(F)(F)F)c1)C1CCCCC1	ZINC000549407579	334192987	/nfs/dbraw/zinc/19/29/87/334192987.db2.gz	YFFVINRYFJFDRY-OAHLLOKOSA-N	0	0	296.336	4.440	20	30		CIEDRN
Cc1cccc(NCc2cccc(C#N)c2F)c1Cl	ZINC000311375297	334197079	/nfs/dbraw/zinc/19/70/79/334197079.db2.gz	IAMCEMFYWSLMIW-UHFFFAOYSA-N	0	0	274.726	4.271	20	30		CIEDRN
C=CC[C@H](C(=O)N(C)Cc1sccc1C)c1ccccc1	ZINC000549574602	334198484	/nfs/dbraw/zinc/19/84/84/334198484.db2.gz	WUXLKEXNBJAZTF-INIZCTEOSA-N	0	0	299.439	4.375	20	30		CIEDRN
N#CCc1ccc(N[C@@H]2CCC[C@@H](C3CC3)C2)cc1	ZINC000081633382	334201094	/nfs/dbraw/zinc/20/10/94/334201094.db2.gz	ALYGSPBSECYYFS-NVXWUHKLSA-N	0	0	254.377	4.133	20	30		CIEDRN
N#CCc1ccc(N[C@@H]2CCC[C@H](C3CC3)C2)cc1	ZINC000081633374	334201243	/nfs/dbraw/zinc/20/12/43/334201243.db2.gz	ALYGSPBSECYYFS-DOTOQJQBSA-N	0	0	254.377	4.133	20	30		CIEDRN
C=CCN(Cc1ccc(Cl)s1)Cc1nc(C)cs1	ZINC000081645527	334201650	/nfs/dbraw/zinc/20/16/50/334201650.db2.gz	WNAMKIKNYXYDHW-UHFFFAOYSA-N	0	0	298.864	4.355	20	30		CIEDRN
Cc1ccc2oc(C(=O)Nc3ccccc3CC#N)cc2c1	ZINC000549715304	334202537	/nfs/dbraw/zinc/20/25/37/334202537.db2.gz	JMXGOGWKFZWRQO-UHFFFAOYSA-N	0	0	290.322	4.060	20	30		CIEDRN
C=CCOCC[NH2+][C@@H](C)c1ccc(SC(C)C)cc1	ZINC000549927810	334209504	/nfs/dbraw/zinc/20/95/04/334209504.db2.gz	FEYOLSOLPQLPHT-AWEZNQCLSA-N	0	0	279.449	4.040	20	30		CIEDRN
C=CCC(C)(C)C(=O)N(C)CCC1CCCCC1	ZINC000550432192	334222379	/nfs/dbraw/zinc/22/23/79/334222379.db2.gz	WKUYEFJMOBMCFR-UHFFFAOYSA-N	0	0	251.414	4.018	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc(C)c(OCC(F)F)c1	ZINC000550482519	334223216	/nfs/dbraw/zinc/22/32/16/334223216.db2.gz	CMJBFIJHSLQKNQ-UHFFFAOYSA-N	0	0	297.345	4.180	20	30		CIEDRN
CC[C@@H](CC1CCCC1)C(=O)N1CCc2ccc(C#N)cc21	ZINC000550522527	334223769	/nfs/dbraw/zinc/22/37/69/334223769.db2.gz	DCIMNUYHEKJLQJ-INIZCTEOSA-N	0	0	296.414	4.054	20	30		CIEDRN
C=C[C@@H](CC(=O)N1CCc2ccc(F)cc21)c1ccccc1	ZINC000550534297	334223968	/nfs/dbraw/zinc/22/39/68/334223968.db2.gz	XGEJVGWTQSUVKW-AWEZNQCLSA-N	0	0	295.357	4.075	20	30		CIEDRN
CC(C)(C)CCCC(=O)N[C@](C)(C#N)C1CCCCC1	ZINC000550743002	334228090	/nfs/dbraw/zinc/22/80/90/334228090.db2.gz	NAWQDDMFNPCSPE-QGZVFWFLSA-N	0	0	278.440	4.182	20	30		CIEDRN
C=CCC(C)(C)C(=O)N[C@H](C)c1cccc(C)c1C	ZINC000550843079	334229942	/nfs/dbraw/zinc/22/99/42/334229942.db2.gz	WLUCIANARXZVMA-CQSZACIVSA-N	0	0	259.393	4.083	20	30		CIEDRN
CCCCN(C(=O)c1ccc(CC#N)cc1)C1CCCCC1	ZINC000550917731	334233348	/nfs/dbraw/zinc/23/33/48/334233348.db2.gz	WNAMXKABADTAHZ-UHFFFAOYSA-N	0	0	298.430	4.328	20	30		CIEDRN
C=CCC(C)(C)c1noc(C2(c3ccccc3)CC2)n1	ZINC000551135302	334239250	/nfs/dbraw/zinc/23/92/50/334239250.db2.gz	CDQALMYIMXMTPQ-UHFFFAOYSA-N	0	0	268.360	4.003	20	30		CIEDRN
C=CCC(C)(C)c1noc(/C=C/c2ccccc2[N+](=O)[O-])n1	ZINC000551139770	334239308	/nfs/dbraw/zinc/23/93/08/334239308.db2.gz	LMEUUGPMFFRINQ-MDZDMXLPSA-N	0	0	299.330	4.002	20	30		CIEDRN
C=CCC(F)(F)c1nc([C@H]2CCCC[C@H]2CC)no1	ZINC000551182705	334240124	/nfs/dbraw/zinc/24/01/24/334240124.db2.gz	JHVMXNUPVOTCFC-MNOVXSKESA-N	0	0	270.323	4.421	20	30		CIEDRN
C=CCC(F)(F)c1nc([C@@H]2CCCC[C@@H]2CC)no1	ZINC000551182707	334240209	/nfs/dbraw/zinc/24/02/09/334240209.db2.gz	JHVMXNUPVOTCFC-WDEREUQCSA-N	0	0	270.323	4.421	20	30		CIEDRN
CC[C@H]1CCCC[C@H]1c1noc(-c2cc(C#N)oc2C)n1	ZINC000551184183	334240282	/nfs/dbraw/zinc/24/02/82/334240282.db2.gz	FOGZFAAQJLUCNP-WCQYABFASA-N	0	0	285.347	4.194	20	30		CIEDRN
CCC(CC)[C@@H](C)C(=O)N(CCC#N)c1ccc(F)cc1	ZINC000551321707	334246908	/nfs/dbraw/zinc/24/69/08/334246908.db2.gz	FHRNFUJNORETDX-CYBMUJFWSA-N	0	0	290.382	4.145	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1ccc(CC(F)(F)F)cc1	ZINC000551429224	334250324	/nfs/dbraw/zinc/25/03/24/334250324.db2.gz	JBNIBGQCSBFIQL-UHFFFAOYSA-N	0	0	285.309	4.332	20	30		CIEDRN
C=CCC(C)(C)c1noc(C[C@H](CC#N)c2ccccc2)n1	ZINC000551493164	334251514	/nfs/dbraw/zinc/25/15/14/334251514.db2.gz	WDFYQBQPYQXDJW-HNNXBMFYSA-N	0	0	295.386	4.163	20	30		CIEDRN
C=CCC(C)(C)c1noc([C@@H]2CCCC(F)(F)C2)n1	ZINC000551492101	334251581	/nfs/dbraw/zinc/25/15/81/334251581.db2.gz	LWBWZSAULDOYMA-SNVBAGLBSA-N	0	0	270.323	4.216	20	30		CIEDRN
CC[C@H]1CCCC[C@H]1c1noc(-c2ccc(C#N)cc2)n1	ZINC000551532511	334253027	/nfs/dbraw/zinc/25/30/27/334253027.db2.gz	WBNGRBDYIDEREI-DZGCQCFKSA-N	0	0	281.359	4.292	20	30		CIEDRN
Cc1ccc(C#N)cc1NC(=O)N1[C@H](C)C[C@H]2CCCC[C@H]21	ZINC000246550625	334264085	/nfs/dbraw/zinc/26/40/85/334264085.db2.gz	TZOAMGSNBJCTGW-FRFSOERESA-N	0	0	297.402	4.052	20	30		CIEDRN
CCN(C(=O)C[C@@H]1CC[C@@H](C)C1)[C@@H](C)c1ccc(C#N)cc1	ZINC000246635818	334266042	/nfs/dbraw/zinc/26/60/42/334266042.db2.gz	OPHGMCCDIINXOM-HLLBOEOZSA-N	0	0	298.430	4.294	20	30		CIEDRN
C=CCC1(C(=O)Nc2nc(-c3ccccc3)co2)CCC1	ZINC000551958192	334267824	/nfs/dbraw/zinc/26/78/24/334267824.db2.gz	JBFMXXLNXJSTAO-UHFFFAOYSA-N	0	0	282.343	4.027	20	30		CIEDRN
CC(C)c1cccc(C(C)C)c1NC(=O)NC[C@H](C)C#N	ZINC000084907440	334279093	/nfs/dbraw/zinc/27/90/93/334279093.db2.gz	VJCKHKULFCHRPC-CYBMUJFWSA-N	0	0	287.407	4.215	20	30		CIEDRN
C=CCC[C@@H](NCc1cc(F)ccc1F)c1ccco1	ZINC000552046838	334281044	/nfs/dbraw/zinc/28/10/44/334281044.db2.gz	ULLRDCKAYFKVDG-OAHLLOKOSA-N	0	0	277.314	4.355	20	30		CIEDRN
C=C[C@](C)(CC)C(=O)N1CC[C@H](c2ccccc2)[C@@H](C)C1	ZINC000249035279	334325370	/nfs/dbraw/zinc/32/53/70/334325370.db2.gz	CBDLIIGXLDEFBR-VDZJLULYSA-N	0	0	285.431	4.241	20	30		CIEDRN
CCc1ccc(CC)c(NCc2ccc(C#N)s2)c1	ZINC000552588648	334338156	/nfs/dbraw/zinc/33/81/56/334338156.db2.gz	KHZYAJGHNYGTKD-UHFFFAOYSA-N	0	0	270.401	4.357	20	30		CIEDRN
C=CCCC1(C(=O)N(C)Cc2cccc(C)c2C)CC1	ZINC000552653245	334341180	/nfs/dbraw/zinc/34/11/80/334341180.db2.gz	RTDHWLCPWBQOHE-UHFFFAOYSA-N	0	0	271.404	4.008	20	30		CIEDRN
C=CCCC(=O)N(Cc1ccc(F)cc1Cl)CC1CC1	ZINC000552716598	334343045	/nfs/dbraw/zinc/34/30/45/334343045.db2.gz	ZCTGVHWRMOHYQU-UHFFFAOYSA-N	0	0	295.785	4.184	20	30		CIEDRN
CC(C)(C)CCCCC(=O)N[C@@H](C#N)c1ccc(F)cc1	ZINC000552777676	334344514	/nfs/dbraw/zinc/34/45/14/334344514.db2.gz	OQGFRQCFQFTMPG-HNNXBMFYSA-N	0	0	290.382	4.113	20	30		CIEDRN
C=CCCC(=O)N(Cc1ccccc1Cl)CC1CC1	ZINC000552890084	334349571	/nfs/dbraw/zinc/34/95/71/334349571.db2.gz	HZDBMVNAINJSIF-UHFFFAOYSA-N	0	0	277.795	4.045	20	30		CIEDRN
Cc1nsc(N2C[C@H](c3ccccc3C)C[C@H]2C)c1C#N	ZINC000553102318	334361693	/nfs/dbraw/zinc/36/16/93/334361693.db2.gz	KIKJKISWTRYRDF-TZMCWYRMSA-N	0	0	297.427	4.014	20	30		CIEDRN
Cc1ccc(C#N)c(N[C@H](c2ccc(F)c(C)c2)C2CC2)n1	ZINC000553145184	334364683	/nfs/dbraw/zinc/36/46/83/334364683.db2.gz	RKDSPHHIEGUMAJ-KRWDZBQOSA-N	0	0	295.361	4.272	20	30		CIEDRN
N#Cc1cc(Cl)ccc1N1CCC=C(c2ccco2)C1	ZINC000553243355	334371495	/nfs/dbraw/zinc/37/14/95/334371495.db2.gz	YNNDSNVZLLPONV-UHFFFAOYSA-N	0	0	284.746	4.098	20	30		CIEDRN
C=CCCC[C@@H](C)Sc1nccn1Cc1ccccn1	ZINC000553253675	334371746	/nfs/dbraw/zinc/37/17/46/334371746.db2.gz	VVZKATYQXGTIDS-CQSZACIVSA-N	0	0	287.432	4.163	20	30		CIEDRN
C=CCCC(=O)Nc1ccc(COc2ccccc2)cc1	ZINC000091166455	334373046	/nfs/dbraw/zinc/37/30/46/334373046.db2.gz	BVBGFDPHFFWVAX-UHFFFAOYSA-N	0	0	281.355	4.170	20	30		CIEDRN
N#Cc1ccc(CNc2c(F)cc(Cl)cc2F)cc1	ZINC000091552251	334380429	/nfs/dbraw/zinc/38/04/29/334380429.db2.gz	ULKNVLABOZOSHN-UHFFFAOYSA-N	0	0	278.689	4.102	20	30		CIEDRN
N#CC1(CSCc2ccc(Cl)c3cccnc23)CC1	ZINC000553479230	334387208	/nfs/dbraw/zinc/38/72/08/334387208.db2.gz	YIIYYEBSGGGRCO-UHFFFAOYSA-N	0	0	288.803	4.425	20	30		CIEDRN
C=C(C)C[C@@H](C)C(=O)N[C@H]1CCCc2sc(Cl)cc21	ZINC000553507374	334388972	/nfs/dbraw/zinc/38/89/72/334388972.db2.gz	HCIXFDXVEQHGGW-PWSUYJOCSA-N	0	0	297.851	4.497	20	30		CIEDRN
C=CCCCC(=O)N1C[C@@H](C)CC[C@H]1c1ccccc1	ZINC000553510021	334389176	/nfs/dbraw/zinc/38/91/76/334389176.db2.gz	ORZSELNFKCSGKC-RDJZCZTQSA-N	0	0	271.404	4.343	20	30		CIEDRN
C=CCC[C@H](C(=O)NCC(C)(C)CCC#N)c1ccccc1	ZINC000553731496	334397210	/nfs/dbraw/zinc/39/72/10/334397210.db2.gz	UZWVURIUQUIJLM-KRWDZBQOSA-N	0	0	298.430	4.183	20	30		CIEDRN
C[C@H]1C[C@@H](c2ccccc2)N(c2ccc(C#N)cc2)C1	ZINC000553729191	334397303	/nfs/dbraw/zinc/39/73/03/334397303.db2.gz	WXSGDMCWYWCGED-KSSFIOAISA-N	0	0	262.356	4.146	20	30		CIEDRN
CC(C)C[C@@H]1C[C@H](Nc2ccc(C#N)c(Cl)c2)CCO1	ZINC000553785979	334398702	/nfs/dbraw/zinc/39/87/02/334398702.db2.gz	ODVVZSQNJIFNPI-HUUCEWRRSA-N	0	0	292.810	4.217	20	30		CIEDRN
CC(C)C[C@H]1C[C@H](Nc2ccc(C#N)c(Cl)c2)CCO1	ZINC000553785977	334398838	/nfs/dbraw/zinc/39/88/38/334398838.db2.gz	ODVVZSQNJIFNPI-CABCVRRESA-N	0	0	292.810	4.217	20	30		CIEDRN
C[C@@H]1C[C@H](C(C)(C)C)CCN1C(=O)Nc1ccc(C#N)cc1	ZINC000554055739	334408225	/nfs/dbraw/zinc/40/82/25/334408225.db2.gz	GSDFQHCPBHZRMZ-UKRRQHHQSA-N	0	0	299.418	4.237	20	30		CIEDRN
CC[C@](C)(C#N)C(=O)NCc1ccc(C2CCCCC2)cc1	ZINC000554359943	334424086	/nfs/dbraw/zinc/42/40/86/334424086.db2.gz	YBWXNTXMZXAERO-LJQANCHMSA-N	0	0	298.430	4.290	20	30		CIEDRN
CC(C)CCc1ccc(NCc2nc(C#N)cs2)cc1	ZINC000554971455	334462768	/nfs/dbraw/zinc/46/27/68/334462768.db2.gz	MSOFOECEEONOTN-UHFFFAOYSA-N	0	0	285.416	4.215	20	30		CIEDRN
C=CCCS[C@@H](C)C(=O)N[C@@H](C)c1ccc(Cl)cc1	ZINC000555428371	334478658	/nfs/dbraw/zinc/47/86/58/334478658.db2.gz	WKZWSOWDIWRYMA-RYUDHWBXSA-N	0	0	297.851	4.215	20	30		CIEDRN
Cc1cc(NCc2ccc(-c3ccccc3)o2)cc(C#N)n1	ZINC000564677017	334516007	/nfs/dbraw/zinc/51/60/07/334516007.db2.gz	ZJIGPUILACIWOJ-UHFFFAOYSA-N	0	0	289.338	4.134	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)Nc1cccc(Cl)c1Cl	ZINC000564700873	334516989	/nfs/dbraw/zinc/51/69/89/334516989.db2.gz	KGPVCFHXQSESCZ-VIFPVBQESA-N	0	0	287.190	4.470	20	30		CIEDRN
C=CCCCN(C)C(=O)C[C@H](CC)c1ccc(OC)cc1	ZINC000153100615	334554787	/nfs/dbraw/zinc/55/47/87/334554787.db2.gz	IJEANBSFLHFZCP-HNNXBMFYSA-N	0	0	289.419	4.004	20	30		CIEDRN
N#CCC[C@@H](NC(=O)c1ccc(Cl)cc1)c1ccccc1	ZINC000153122924	334559422	/nfs/dbraw/zinc/55/94/22/334559422.db2.gz	HPYFLBTZAIUADU-MRXNPFEDSA-N	0	0	298.773	4.115	20	30		CIEDRN
N#Cc1cc(Oc2ccc(C3CCCCC3)cc2)ncn1	ZINC000565459297	334565236	/nfs/dbraw/zinc/56/52/36/334565236.db2.gz	YLPHAWKSPDEVOK-UHFFFAOYSA-N	0	0	279.343	4.188	20	30		CIEDRN
N#CCC[C@H](NC(=O)c1ccccc1Cl)c1ccccc1	ZINC000153201804	334570338	/nfs/dbraw/zinc/57/03/38/334570338.db2.gz	CXHLPAIRKMYOLN-INIZCTEOSA-N	0	0	298.773	4.115	20	30		CIEDRN
CC(C)Oc1ccc(Cl)cc1N[C@@H]1CC[C@H](C#N)C1	ZINC000565804125	334598297	/nfs/dbraw/zinc/59/82/97/334598297.db2.gz	FKGQEAUXTONOOR-WCQYABFASA-N	0	0	278.783	4.231	20	30		CIEDRN
N#Cc1ccc(C(=O)Nc2cccc(Cl)c2)cc1Cl	ZINC000153478857	334607615	/nfs/dbraw/zinc/60/76/15/334607615.db2.gz	PPDVVHWMYUXVKD-UHFFFAOYSA-N	0	0	291.137	4.117	20	30		CIEDRN
COc1cc(F)c(F)cc1N[C@@H](C)c1ccc(C#N)cc1	ZINC000566590990	334656704	/nfs/dbraw/zinc/65/67/04/334656704.db2.gz	LKCVSGJMUZNHIK-JTQLQIEISA-N	0	0	288.297	4.018	20	30		CIEDRN
Cc1nc2ccccc2cc1OCc1ccc(C#N)c(F)c1	ZINC000567033221	334674920	/nfs/dbraw/zinc/67/49/20/334674920.db2.gz	QMKHQMCSZXGLGL-UHFFFAOYSA-N	0	0	292.313	4.133	20	30		CIEDRN
CC[C@@H](CC(=O)N[C@H](CCC#N)c1ccccc1)C(C)C	ZINC000153639899	334675546	/nfs/dbraw/zinc/67/55/46/334675546.db2.gz	VQCBOTOHXMVUAL-DOTOQJQBSA-N	0	0	286.419	4.220	20	30		CIEDRN
CCN(C[C@H](C)C#N)C(=O)c1coc2ccc(C(C)C)cc21	ZINC000567497821	334725930	/nfs/dbraw/zinc/72/59/30/334725930.db2.gz	PCGMDGACGCCITM-CYBMUJFWSA-N	0	0	298.386	4.178	20	30		CIEDRN
Cc1cc(C#N)ccc1C(=O)N(C(C)C)C1CCCCC1	ZINC000156025467	334733608	/nfs/dbraw/zinc/73/36/08/334733608.db2.gz	WBIDZGHMPKNTRD-UHFFFAOYSA-N	0	0	284.403	4.050	20	30		CIEDRN
C=CCC[C@@H](CC)Nc1ccc([C@@H]2CCOC2)cc1	ZINC000567573844	334735642	/nfs/dbraw/zinc/73/56/42/334735642.db2.gz	JFOWCZRZHMZCHC-HZPDHXFCSA-N	0	0	259.393	4.347	20	30		CIEDRN
C=CCC[C@H](CC)Nc1ccc([C@H]2CCOC2)cc1	ZINC000567573843	334735658	/nfs/dbraw/zinc/73/56/58/334735658.db2.gz	JFOWCZRZHMZCHC-HOTGVXAUSA-N	0	0	259.393	4.347	20	30		CIEDRN
CCC[C@H](C)C(=O)N(CC)c1ccc(C#N)c(Cl)c1	ZINC000156563503	334744437	/nfs/dbraw/zinc/74/44/37/334744437.db2.gz	GCGYLGCLXNSFJM-NSHDSACASA-N	0	0	278.783	4.001	20	30		CIEDRN
C=C(C)C[C@H](C)c1nc(-c2cnc3ccsc3c2)no1	ZINC000568325184	334815346	/nfs/dbraw/zinc/81/53/46/334815346.db2.gz	RQUACHSUZUGAOT-JTQLQIEISA-N	0	0	285.372	4.416	20	30		CIEDRN
CCC(CC)c1noc(/C=C\c2ccc(C#N)cc2)n1	ZINC000568337947	334816035	/nfs/dbraw/zinc/81/60/35/334816035.db2.gz	JOYKBRAXXJVPSW-KTKRTIGZSA-N	0	0	267.332	4.015	20	30		CIEDRN
CCC(CC)c1noc(/C=C/c2ccc(C#N)cc2)n1	ZINC000568337948	334816099	/nfs/dbraw/zinc/81/60/99/334816099.db2.gz	JOYKBRAXXJVPSW-MDZDMXLPSA-N	0	0	267.332	4.015	20	30		CIEDRN
CC(C)C[C@@H](C)NC(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000159104734	334819765	/nfs/dbraw/zinc/81/97/65/334819765.db2.gz	FMJODYTYALSUEF-CYBMUJFWSA-N	0	0	287.407	4.044	20	30		CIEDRN
N#Cc1ccccc1NCc1ccc(-c2ccccc2)o1	ZINC000568368658	334819948	/nfs/dbraw/zinc/81/99/48/334819948.db2.gz	OWRLUAFYAHKLEQ-UHFFFAOYSA-N	0	0	274.323	4.430	20	30		CIEDRN
CCc1ccc([C@H](C#N)NC(=O)C2(CC(C)C)CCC2)cc1	ZINC000568562329	334830392	/nfs/dbraw/zinc/83/03/92/334830392.db2.gz	QBUPFGYKYSMPNC-KRWDZBQOSA-N	0	0	298.430	4.146	20	30		CIEDRN
CCN(C[C@@H](C)C#N)C(=O)[C@@H](CC1CCCCC1)C(C)C	ZINC000569160844	334858765	/nfs/dbraw/zinc/85/87/65/334858765.db2.gz	ASPUFMRBIZQZBO-RDJZCZTQSA-N	0	0	292.467	4.237	20	30		CIEDRN
C=CCC(C)(C)c1noc(-c2cc3[nH]ccc3s2)n1	ZINC000569268284	334864745	/nfs/dbraw/zinc/86/47/45/334864745.db2.gz	VFUWLVQNECALBQ-UHFFFAOYSA-N	0	0	273.361	4.133	20	30		CIEDRN
CC[C@@H]1CCCN(c2cccc(C(F)F)c2C#N)C1	ZINC000569279635	334865286	/nfs/dbraw/zinc/86/52/86/334865286.db2.gz	UQDSROBQTWXNOL-LLVKDONJSA-N	0	0	264.319	4.122	20	30		CIEDRN
Cc1ncc(CSc2ccc(C#N)cc2Cl)s1	ZINC000163329405	334866904	/nfs/dbraw/zinc/86/69/04/334866904.db2.gz	STSLLDQRAJXHTM-UHFFFAOYSA-N	0	0	280.805	4.269	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)[C@H](C)c1ccccc1	ZINC000163805604	334872895	/nfs/dbraw/zinc/87/28/95/334872895.db2.gz	QOUOZURSFRHDER-MRXNPFEDSA-N	0	0	279.383	4.005	20	30		CIEDRN
CC(C)(C)c1cccc(C(=O)N(C2CC2)C2(C#N)CCC2)c1	ZINC000572778387	334877548	/nfs/dbraw/zinc/87/75/48/334877548.db2.gz	HASMLARCUIIGLP-UHFFFAOYSA-N	0	0	296.414	4.035	20	30		CIEDRN
CC1(C(=O)N[C@H]2CCCc3cc(C#N)ccc32)CCCCC1	ZINC000572942681	334893203	/nfs/dbraw/zinc/89/32/03/334893203.db2.gz	BWXOCPIQMBXKEE-KRWDZBQOSA-N	0	0	296.414	4.022	20	30		CIEDRN
Cc1ccc(C)c(CSCc2ccc(C#N)cn2)c1	ZINC000573048334	334903253	/nfs/dbraw/zinc/90/32/53/334903253.db2.gz	IMYQQMBHWIQZHX-UHFFFAOYSA-N	0	0	268.385	4.004	20	30		CIEDRN
C=CCCCCCNC(=O)N(Cc1cccs1)C1CC1	ZINC000573104527	334908554	/nfs/dbraw/zinc/90/85/54/334908554.db2.gz	BDDOTXQUEVNHJZ-UHFFFAOYSA-N	0	0	292.448	4.169	20	30		CIEDRN
C=CCCCN(C)C(=O)c1cc(F)c2ccccc2c1	ZINC000573151533	334913134	/nfs/dbraw/zinc/91/31/34/334913134.db2.gz	HCPFIZNRKADVTC-UHFFFAOYSA-N	0	0	271.335	4.017	20	30		CIEDRN
C=CCC1(c2nc(-c3ccc(F)cc3C)no2)CCC1	ZINC000573165438	334913969	/nfs/dbraw/zinc/91/39/69/334913969.db2.gz	AFJLRJHGXLGIAQ-UHFFFAOYSA-N	0	0	272.323	4.182	20	30		CIEDRN
CC(C)(C#N)CCSC[C@@H]1CCc2ccccc2C1	ZINC000576665441	335232414	/nfs/dbraw/zinc/23/24/14/335232414.db2.gz	RECDPVDQXXSBJO-CQSZACIVSA-N	0	0	273.445	4.465	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1C[C@H](c2ccccc2)[C@H]2CCC[C@H]21	ZINC000576689924	335235014	/nfs/dbraw/zinc/23/50/14/335235014.db2.gz	HVYMYMWRXPKOFY-JCHJZTRSSA-N	0	0	297.442	4.383	20	30		CIEDRN
C=C(C)C[C@H](C)C(=O)N1C[C@H](c2ccccc2)[C@@H]2CCC[C@H]21	ZINC000576689923	335235097	/nfs/dbraw/zinc/23/50/97/335235097.db2.gz	HVYMYMWRXPKOFY-GDAAHCPNSA-N	0	0	297.442	4.383	20	30		CIEDRN
C=C[C@@](C)(CC)c1nc(-c2ccc(OC(F)F)cc2)no1	ZINC000580599706	335296937	/nfs/dbraw/zinc/29/69/37/335296937.db2.gz	MUYCVKNHOZANSI-HNNXBMFYSA-N	0	0	294.301	4.192	20	30		CIEDRN
CC[C@H](Nc1cccc(CCCO)c1)c1ccc(C#N)cc1	ZINC000577143477	335308189	/nfs/dbraw/zinc/30/81/89/335308189.db2.gz	IQHYWICYBHMHHD-IBGZPJMESA-N	0	0	294.398	4.046	20	30		CIEDRN
N#Cc1cnccc1/C=C/c1ccc(C(F)F)cc1	ZINC000577397818	335348087	/nfs/dbraw/zinc/34/80/87/335348087.db2.gz	HKTMKNDPWCCDOP-DAFODLJHSA-N	0	0	256.255	4.061	20	30		CIEDRN
Cc1cn(Cc2ccc([C@H](C)C(F)(F)F)cc2)cc1C#N	ZINC000577713150	335391479	/nfs/dbraw/zinc/39/14/79/335391479.db2.gz	JACIRWBLFXXMNG-LBPRGKRZSA-N	0	0	292.304	4.382	20	30		CIEDRN
N#Cc1ccccc1SCc1csc(C2CC2)n1	ZINC000179382450	335490542	/nfs/dbraw/zinc/49/05/42/335490542.db2.gz	SCJUBSVKWFUHCC-UHFFFAOYSA-N	0	0	272.398	4.184	20	30		CIEDRN
CC(C)(C)CN(CC(C)(C)C)C(=O)c1cccc(C#N)c1	ZINC000180628187	335613918	/nfs/dbraw/zinc/61/39/18/335613918.db2.gz	GYHXCSSVLCXCCJ-UHFFFAOYSA-N	0	0	286.419	4.093	20	30		CIEDRN
Cc1cc(NCc2ccc(C#N)o2)ccc1C(F)(F)F	ZINC000180887454	335628174	/nfs/dbraw/zinc/62/81/74/335628174.db2.gz	XUZCAQHUANQTGQ-UHFFFAOYSA-N	0	0	280.249	4.091	20	30		CIEDRN
C[C@@H](N[C@@H](C)c1ccc(C#N)cc1)c1nc2ccccc2o1	ZINC000578486493	335639873	/nfs/dbraw/zinc/63/98/73/335639873.db2.gz	OBPAQEXOSZOAOV-QWHCGFSZSA-N	0	0	291.354	4.111	20	30		CIEDRN
Cc1cc(C#N)nc(S[C@@H](C)c2ccc(Cl)cc2)n1	ZINC000578657179	335660527	/nfs/dbraw/zinc/66/05/27/335660527.db2.gz	YHHMGPWIOIPYMJ-JTQLQIEISA-N	0	0	289.791	4.163	20	30		CIEDRN
Cc1nsc(S[C@@H]2CCCc3ccccc32)c1C#N	ZINC000579278894	335730850	/nfs/dbraw/zinc/73/08/50/335730850.db2.gz	MJIYLHCQRHOBGQ-CQSZACIVSA-N	0	0	286.425	4.493	20	30		CIEDRN
C=CCCC[C@H](C)NC(=O)N([C@@H](C)c1ccco1)C1CC1	ZINC000181098328	335750334	/nfs/dbraw/zinc/75/03/34/335750334.db2.gz	STJGJLOJZXXFKG-KBPBESRZSA-N	0	0	290.407	4.259	20	30		CIEDRN
C=CCCC[C@@H](C)NC(=O)[C@@H](c1ccccc1)C1CC1	ZINC000182608920	335830032	/nfs/dbraw/zinc/83/00/32/335830032.db2.gz	FBLPTZWQVFTRCY-PBHICJAKSA-N	0	0	271.404	4.041	20	30		CIEDRN
COc1ccc(C#N)cc1CNc1ccc(C2CCC2)cc1	ZINC000579672025	335850094	/nfs/dbraw/zinc/85/00/94/335850094.db2.gz	PMJYNYQFKIIFMT-UHFFFAOYSA-N	0	0	292.382	4.446	20	30		CIEDRN
CO[C@H](C)c1cccc(N[C@H](C)c2cccc(C#N)c2)c1	ZINC000183094482	335862610	/nfs/dbraw/zinc/86/26/10/335862610.db2.gz	PETAXLVREQLXKU-ZIAGYGMSSA-N	0	0	280.371	4.439	20	30		CIEDRN
C[C@@H]1CCc2sc(NC(=O)CC3CC3)c(C#N)c2[C@@H]1C	ZINC000579684223	335863090	/nfs/dbraw/zinc/86/30/90/335863090.db2.gz	VFTXVPRZZNUPFH-NXEZZACHSA-N	0	0	288.416	4.044	20	30		CIEDRN
Cc1ccsc1-c1nnc(SCC(C)(C)CC#N)o1	ZINC000579734598	335877568	/nfs/dbraw/zinc/87/75/68/335877568.db2.gz	ZJZGUVIWOKVTGW-UHFFFAOYSA-N	0	0	293.417	4.139	20	30		CIEDRN
N#CCN[C@@H](c1ccccc1)c1cc(Cl)ccc1Cl	ZINC000183734538	335904190	/nfs/dbraw/zinc/90/41/90/335904190.db2.gz	PBYGYSXGJHFAOC-HNNXBMFYSA-N	0	0	291.181	4.196	20	30		CIEDRN
C=CCC(CC=C)C(=O)Nc1cccc2ccc(O)cc21	ZINC000184060617	335916597	/nfs/dbraw/zinc/91/65/97/335916597.db2.gz	JFLMTLYTWGTSBN-UHFFFAOYSA-N	0	0	281.355	4.252	20	30		CIEDRN
CC(C)(C)N(Cc1ccccc1)C(=O)c1sccc1C#N	ZINC000185545027	335953409	/nfs/dbraw/zinc/95/34/09/335953409.db2.gz	GFESTMBXUBBULT-UHFFFAOYSA-N	0	0	298.411	4.061	20	30		CIEDRN
Cc1ccc(-c2cc(CNc3ccc(C#N)cc3)on2)cc1	ZINC000194035957	335999973	/nfs/dbraw/zinc/99/99/73/335999973.db2.gz	LOTKGUNTZYBLBA-UHFFFAOYSA-N	0	0	289.338	4.134	20	30		CIEDRN
CC(C)(C)CN(CCC#N)Cc1sccc1Cl	ZINC000194380123	336019238	/nfs/dbraw/zinc/01/92/38/336019238.db2.gz	VIWDEKYWMITCLE-UHFFFAOYSA-N	0	0	270.829	4.163	20	30		CIEDRN
N#Cc1ccc(OC[C@@H]2CCCC2(F)F)c(Cl)c1	ZINC000381697092	336071033	/nfs/dbraw/zinc/07/10/33/336071033.db2.gz	OHXGHPAEAGQWSL-JTQLQIEISA-N	0	0	271.694	4.026	20	30		CIEDRN
CCOc1cc(C#N)ccc1OC[C@@H]1CCCCC1(F)F	ZINC000382251751	336084868	/nfs/dbraw/zinc/08/48/68/336084868.db2.gz	XFPGBFVCMLBAHA-ZDUSSCGKSA-N	0	0	295.329	4.161	20	30		CIEDRN
N#Cc1cc(C(F)(F)F)ccc1NCC1CC(F)(F)C1	ZINC000383283545	336106725	/nfs/dbraw/zinc/10/67/25/336106725.db2.gz	PMIJOAVKQSIKIL-UHFFFAOYSA-N	0	0	290.235	4.034	20	30		CIEDRN
Cc1cc(NCc2ccc(F)c(C#N)c2)c(Cl)cc1F	ZINC000383525096	336112405	/nfs/dbraw/zinc/11/24/05/336112405.db2.gz	KBMYLUYJJVDPON-UHFFFAOYSA-N	0	0	292.716	4.410	20	30		CIEDRN
C=CCN(CC=C)C(=O)[C@H](CCc1ccccc1)C(C)C	ZINC000581619814	336113754	/nfs/dbraw/zinc/11/37/54/336113754.db2.gz	QKZXXAWVJOZZHP-GOSISDBHSA-N	0	0	285.431	4.092	20	30		CIEDRN
C=CC[C@@H](C(=O)Nc1cccc(SC)n1)c1ccccc1	ZINC000581628262	336114432	/nfs/dbraw/zinc/11/44/32/336114432.db2.gz	QKTAQRQANQNKCD-CQSZACIVSA-N	0	0	298.411	4.102	20	30		CIEDRN
Cc1nsc(Nc2cccc(CC(F)(F)F)c2)c1C#N	ZINC000581628738	336114472	/nfs/dbraw/zinc/11/44/72/336114472.db2.gz	LVJRNSYERHXOOF-UHFFFAOYSA-N	0	0	297.305	4.172	20	30		CIEDRN
Cc1cc(-c2noc(-c3ccc(C#N)c(Cl)c3)n2)c(C)o1	ZINC000581634071	336115082	/nfs/dbraw/zinc/11/50/82/336115082.db2.gz	XPEGQNRFAPXYSH-UHFFFAOYSA-N	0	0	299.717	4.139	20	30		CIEDRN
C=CCCO[C@H](C)c1nc(C2CCCCCC2)no1	ZINC000581726824	336138470	/nfs/dbraw/zinc/13/84/70/336138470.db2.gz	KKDZHWRDOWTCEV-GFCCVEGCSA-N	0	0	264.369	4.161	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](CC)OCC	ZINC000581772938	336145370	/nfs/dbraw/zinc/14/53/70/336145370.db2.gz	UQGJWXIVQTWZGO-MRXNPFEDSA-N	0	0	289.419	4.292	20	30		CIEDRN
C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cscn1	ZINC000581839214	336150495	/nfs/dbraw/zinc/15/04/95/336150495.db2.gz	WAXROGBZNAPXAX-HIFRSBDPSA-N	0	0	285.416	4.229	20	30		CIEDRN
C=C(C)CCc1noc([C@@H]2[C@@H](c3ccccc3)C2(F)F)n1	ZINC000581877246	336156637	/nfs/dbraw/zinc/15/66/37/336156637.db2.gz	UYEYBNXHSAOLRI-KGLIPLIRSA-N	0	0	290.313	4.095	20	30		CIEDRN
CC(C)c1ccc([C@@H]2CCCN2c2cc(C#N)ccn2)cc1	ZINC000581901392	336163587	/nfs/dbraw/zinc/16/35/87/336163587.db2.gz	ROCPUYZDWXGILZ-SFHVURJKSA-N	0	0	291.398	4.418	20	30		CIEDRN
N#Cc1cc(F)ccc1NC(=O)c1ccc2sccc2c1	ZINC000386162456	336167323	/nfs/dbraw/zinc/16/73/23/336167323.db2.gz	LGJHMFHWGSMOIX-UHFFFAOYSA-N	0	0	296.326	4.164	20	30		CIEDRN
N#CCCCOc1cccc(NCCCc2ccccc2)c1	ZINC000387149981	336186267	/nfs/dbraw/zinc/18/62/67/336186267.db2.gz	OBQURCZTJDVTOO-UHFFFAOYSA-N	0	0	294.398	4.414	20	30		CIEDRN
C=CCC(C)(C)c1noc(C2CCC(F)(F)CC2)n1	ZINC000582017922	336192875	/nfs/dbraw/zinc/19/28/75/336192875.db2.gz	KXPXUDGFXKABIV-UHFFFAOYSA-N	0	0	270.323	4.216	20	30		CIEDRN
COc1cccc2c1CC[C@H]2Nc1ccc(Cl)cc1C#N	ZINC000301623804	533874729	/nfs/dbraw/zinc/87/47/29/533874729.db2.gz	GMGHOJSIAOLGJO-MRXNPFEDSA-N	0	0	298.773	4.320	20	30		CIEDRN
C[C@H](NCc1nc(C#N)cs1)c1ccc2ccccc2c1	ZINC000352826090	533942139	/nfs/dbraw/zinc/94/21/39/533942139.db2.gz	VSGKKLZFKXSNOB-LBPRGKRZSA-N	0	0	293.395	4.019	20	30		CIEDRN
C[C@@H](S[C@@H](C)c1nc(C2CC2)no1)c1ccc(C#N)cc1	ZINC000118444181	534003009	/nfs/dbraw/zinc/00/30/09/534003009.db2.gz	FBLGMCPJWMNBLT-MNOVXSKESA-N	0	0	299.399	4.374	20	30		CIEDRN
C[C@@H](Sc1ccc([N+](=O)[O-])cc1)c1cccc(C#N)c1	ZINC000190907959	534009098	/nfs/dbraw/zinc/00/90/98/534009098.db2.gz	LRPWFQCXHLSSCK-LLVKDONJSA-N	0	0	284.340	4.320	20	30		CIEDRN
Cc1ccc(-n2ccnc2S[C@H](C)CCC#N)cc1C	ZINC000347590415	534241781	/nfs/dbraw/zinc/24/17/81/534241781.db2.gz	BMJNHHBKFVGDCA-CQSZACIVSA-N	0	0	285.416	4.274	20	30		CIEDRN
C=CCCC1(C(=O)NC[C@H](CC)CCCC)CC1	ZINC000474690327	517321126	/nfs/dbraw/zinc/32/11/26/517321126.db2.gz	CXNVWNIVAKHZSC-CQSZACIVSA-N	0	0	251.414	4.065	20	30		CIEDRN
C=CC[C@H](CC)NC(=O)N[C@H](C)c1ccccc1Cl	ZINC000541776836	517338785	/nfs/dbraw/zinc/33/87/85/517338785.db2.gz	WVXCYYNDHCAWIC-NEPJUHHUSA-N	0	0	280.799	4.055	20	30		CIEDRN
C[C@H](CC(=O)N[C@H]1CCCc2c[nH]nc21)C1CCCCC1	ZINC000330102401	534299117	/nfs/dbraw/zinc/29/91/17/534299117.db2.gz	GCVZHFWFKWYUGH-DOMZBBRYSA-N	0	0	289.423	4.350	20	30		CIEDRN
O=C(Nc1ncc(-c2ccccc2)cn1)C1CCCCC1	ZINC000330140302	534332294	/nfs/dbraw/zinc/33/22/94/534332294.db2.gz	WWDJOSBEGPXDOA-UHFFFAOYSA-N	0	0	281.359	4.312	20	30		CIEDRN
O=C(CC1=CCCCC1)Nc1cccc2ocnc21	ZINC000330088431	534337599	/nfs/dbraw/zinc/33/75/99/534337599.db2.gz	OCFMTTYUBAICRQ-UHFFFAOYSA-N	0	0	256.305	4.306	20	30		CIEDRN
C=CCCC(=O)N1CCC(c2cccc(Cl)c2)CC1	ZINC000279932660	518692856	/nfs/dbraw/zinc/69/28/56/518692856.db2.gz	HEAMWSOMUJGKKL-UHFFFAOYSA-N	0	0	277.795	4.012	20	30		CIEDRN
CC(C)(C)Nc1ccccc1NC(=O)c1cc(C#N)cs1	ZINC000277255602	518773084	/nfs/dbraw/zinc/77/30/84/518773084.db2.gz	FMZUQYFBEIPUSF-UHFFFAOYSA-N	0	0	299.399	4.082	20	30		CIEDRN
Cc1noc(C2CC2)c1NC(=O)COC1CCC(C)CC1	ZINC000330005958	534384946	/nfs/dbraw/zinc/38/49/46/534384946.db2.gz	CJFSIQVPVBHFAG-UHFFFAOYSA-N	0	0	292.379	4.044	20	30		CIEDRN
CC(C)(C)c1ccc([C@H](O)CNc2ccc(C#N)cc2)cc1	ZINC000049896267	519050282	/nfs/dbraw/zinc/05/02/82/519050282.db2.gz	LAEHKXOLYRTNST-GOSISDBHSA-N	0	0	294.398	4.001	20	30		CIEDRN
CC(C)(C)c1nsc(Oc2ccc(C#N)cc2Cl)n1	ZINC000157813086	519145047	/nfs/dbraw/zinc/14/50/47/519145047.db2.gz	BAOANDBLBZTJFX-UHFFFAOYSA-N	0	0	293.779	4.153	20	30		CIEDRN
CC(C)N(C(=O)c1cc(C#N)cs1)[C@H](C)c1ccccc1	ZINC000297778493	519576514	/nfs/dbraw/zinc/57/65/14/519576514.db2.gz	IXTICZYAMDVGBY-CYBMUJFWSA-N	0	0	298.411	4.232	20	30		CIEDRN
CC(C)c1ccoc1C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000340719069	519849485	/nfs/dbraw/zinc/84/94/85/519849485.db2.gz	URPQMZVLVRSMDI-UHFFFAOYSA-N	0	0	288.734	4.180	20	30		CIEDRN
CCN(C(=O)C1=CCCCCC1)[C@@H](C)c1ccc(C#N)cc1	ZINC000129540860	519900460	/nfs/dbraw/zinc/90/04/60/519900460.db2.gz	IBUBAXQLHUMNBF-HNNXBMFYSA-N	0	0	296.414	4.358	20	30		CIEDRN
Cc1ccc2cccc(NC(=O)[C@H]3CCC(=O)[C@H](C)C3)c2n1	ZINC000329000892	534479378	/nfs/dbraw/zinc/47/93/78/534479378.db2.gz	VUQVAAYCXMHYLQ-RISCZKNCSA-N	0	0	296.370	4.137	20	30		CIEDRN
Cc1nc(SCC2(C#N)CC2)n(C2CCCCC2)c1C	ZINC000347071109	534529439	/nfs/dbraw/zinc/52/94/39/534529439.db2.gz	ONZCJCGAUPYBAO-UHFFFAOYSA-N	0	0	289.448	4.401	20	30		CIEDRN
Cc1nc(S[C@H](C)c2cccc(C#N)c2)oc1C	ZINC000336432496	534533476	/nfs/dbraw/zinc/53/34/76/534533476.db2.gz	CCEJRLWQVKNEKA-LLVKDONJSA-N	0	0	258.346	4.016	20	30		CIEDRN
CCCC[C@H](CC)C(=O)Nc1cc(C#N)ccc1C	ZINC000049524549	521162996	/nfs/dbraw/zinc/16/29/96/521162996.db2.gz	GBZWMZBTJWPRRX-AWEZNQCLSA-N	0	0	258.365	4.022	20	30		CIEDRN
Cc1oc2ccccc2c1C(=O)Nc1ccccc1CC#N	ZINC000344400954	534553633	/nfs/dbraw/zinc/55/36/33/534553633.db2.gz	VWKFZVAJNXUJDZ-UHFFFAOYSA-N	0	0	290.322	4.060	20	30		CIEDRN
Cc1oc2ccc(NC(=O)N[C@@H]3CC[C@H](F)C3)cc2c1C	ZINC000329231945	534550969	/nfs/dbraw/zinc/55/09/69/534550969.db2.gz	FPRUCNITYGMMAF-NWDGAFQWSA-N	0	0	290.338	4.266	20	30		CIEDRN
CCN(Cc1nc(C)c(C)s1)[C@H](C)c1ccc(C#N)cc1	ZINC000081666135	521447698	/nfs/dbraw/zinc/44/76/98/521447698.db2.gz	OMGGZYDKECTEER-CYBMUJFWSA-N	0	0	299.443	4.215	20	30		CIEDRN
CCC(CC)c1cc(CNc2ccc(C#N)cc2)on1	ZINC000266269055	521634943	/nfs/dbraw/zinc/63/49/43/521634943.db2.gz	QSFBKRQYRZLMBQ-UHFFFAOYSA-N	0	0	269.348	4.062	20	30		CIEDRN
CC[C@@H](C(=O)Nc1scc(C)c1C#N)c1ccccc1	ZINC000291937679	521878512	/nfs/dbraw/zinc/87/85/12/521878512.db2.gz	BQDDSJYIWTXVFB-CYBMUJFWSA-N	0	0	284.384	4.061	20	30		CIEDRN
CC[C@@H](C)CC(=O)N(Cc1ccco1)c1ccccc1C#N	ZINC000276695082	521928920	/nfs/dbraw/zinc/92/89/20/521928920.db2.gz	ADMQZFWYONCFTJ-CQSZACIVSA-N	0	0	296.370	4.121	20	30		CIEDRN
Cc1cnc([C@@H](C)Sc2ccc(C#N)cc2Cl)cn1	ZINC000336547553	534625931	/nfs/dbraw/zinc/62/59/31/534625931.db2.gz	LBXDJJXELYSSFV-SNVBAGLBSA-N	0	0	289.791	4.163	20	30		CIEDRN
Cc1nc2c(cccc2C(=O)N[C@H]2CC23CCCCC3)o1	ZINC000329952753	534626134	/nfs/dbraw/zinc/62/61/34/534626134.db2.gz	NLAGINOQYIZRGU-AWEZNQCLSA-N	0	0	284.359	4.164	20	30		CIEDRN
CC[C@H](Nc1ccc(OC)c(OC)c1)c1ccc(C#N)cc1	ZINC000278387678	522767081	/nfs/dbraw/zinc/76/70/81/522767081.db2.gz	DOPVTNGFYRJIFC-INIZCTEOSA-N	0	0	296.370	4.139	20	30		CIEDRN
CCc1noc([C@H](C)S[C@H](C)c2ccc(C#N)cc2)n1	ZINC000076326709	522917063	/nfs/dbraw/zinc/91/70/63/522917063.db2.gz	REXGGPJRNRLJFE-MNOVXSKESA-N	0	0	287.388	4.059	20	30		CIEDRN
CC[C@H]1CC[C@H](C)N1C(=O)Nc1ccc(C#N)cc1Cl	ZINC000271547638	523202273	/nfs/dbraw/zinc/20/22/73/523202273.db2.gz	ZXYDJAIFYZVUKF-JQWIXIFHSA-N	0	0	291.782	4.006	20	30		CIEDRN
Cc1coc(C)c1C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000352225207	534750021	/nfs/dbraw/zinc/75/00/21/534750021.db2.gz	JQNJOLLPLILNFT-MRXNPFEDSA-N	0	0	296.370	4.061	20	30		CIEDRN
Cc1csc(-c2cccc(N[C@H]3CC[C@H](C#N)C3)c2)n1	ZINC000442849740	534763750	/nfs/dbraw/zinc/76/37/50/534763750.db2.gz	CMQFPRZRSXVCEH-WFASDCNBSA-N	0	0	283.400	4.223	20	30		CIEDRN
Cc1csc(-c2cccc(Nc3ccc(C#N)cn3)c2)n1	ZINC000301206516	534764008	/nfs/dbraw/zinc/76/40/08/534764008.db2.gz	ZIZNDYVSZGGDLT-UHFFFAOYSA-N	0	0	292.367	4.129	20	30		CIEDRN
N#Cc1ccc(NC[C@@H]2CCCO[C@H]2c2ccccc2)cc1	ZINC000301126347	534795895	/nfs/dbraw/zinc/79/58/95/534795895.db2.gz	QEQWYHRSMQPBER-HKUYNNGSSA-N	0	0	292.382	4.138	20	30		CIEDRN
Cc1cccc(NCc2ncc(-c3ccc(C#N)cc3)o2)c1	ZINC000157270026	524687373	/nfs/dbraw/zinc/68/73/73/524687373.db2.gz	BNXHGGGUDVBMOD-UHFFFAOYSA-N	0	0	289.338	4.134	20	30		CIEDRN
N#Cc1cnccc1/C=C\c1csc2ccccc12	ZINC000347417864	534827632	/nfs/dbraw/zinc/82/76/32/534827632.db2.gz	AHEHGBSXOWIBNQ-WAYWQWQTSA-N	0	0	262.337	4.338	20	30		CIEDRN
Cc1ccccc1[C@H](C)CC(=O)N(C)c1ccc(C#N)cc1	ZINC000269667707	525401376	/nfs/dbraw/zinc/40/13/76/525401376.db2.gz	KXWLQCMYUBWMGQ-OAHLLOKOSA-N	0	0	292.382	4.023	20	30		CIEDRN
C[C@@H](NCc1nc(C(C)(C)C)cs1)c1ccc(C#N)cc1	ZINC000094965502	525558653	/nfs/dbraw/zinc/55/86/53/525558653.db2.gz	RHNSFFFCXBTCHW-GFCCVEGCSA-N	0	0	299.443	4.163	20	30		CIEDRN
Cc1ccnc([C@H](C)Nc2ccc(OC(C)C)c(C#N)c2)c1	ZINC000290305569	525714632	/nfs/dbraw/zinc/71/46/32/525714632.db2.gz	IGTPYAUENHJZFV-AWEZNQCLSA-N	0	0	295.386	4.222	20	30		CIEDRN
Cc1ccc([C@H](C)N(C)C(=O)c2cccc(C#N)c2C)cc1	ZINC000337903832	525881919	/nfs/dbraw/zinc/88/19/19/525881919.db2.gz	SQDQUBASXRDALG-HNNXBMFYSA-N	0	0	292.382	4.008	20	30		CIEDRN
C[C@@H](SCCC(F)(F)F)c1ccc(C#N)cc1	ZINC000265882147	525971616	/nfs/dbraw/zinc/97/16/16/525971616.db2.gz	OVOSFKMQSVCOSP-SECBINFHSA-N	0	0	259.296	4.305	20	30		CIEDRN
C[C@H](c1ccco1)N(Cc1cccc(C#N)c1F)C1CC1	ZINC000340839877	526148026	/nfs/dbraw/zinc/14/80/26/526148026.db2.gz	IUHVMOQCKGUAEY-GFCCVEGCSA-N	0	0	284.334	4.016	20	30		CIEDRN
CC#CCCCC(=O)N[C@@H]1CCCc2sc(Cl)cc21	ZINC000344611639	526300135	/nfs/dbraw/zinc/30/01/35/526300135.db2.gz	VRCDKQXBWYALRC-GFCCVEGCSA-N	0	0	295.835	4.089	20	30		CIEDRN
C=CCN(Cc1ccccc1)C(=O)c1cccc(C(C)C)n1	ZINC000353539129	526357418	/nfs/dbraw/zinc/35/74/18/526357418.db2.gz	IWVLWRQEBFFMRB-UHFFFAOYSA-N	0	0	294.398	4.033	20	30		CIEDRN
C=CCN(Cc1cccs1)C(=O)c1ccc(F)c(C)c1	ZINC000348966241	526375275	/nfs/dbraw/zinc/37/52/75/526375275.db2.gz	OCBSEGQDSVMXPM-UHFFFAOYSA-N	0	0	289.375	4.024	20	30		CIEDRN
C=C(C)CCSCC(=O)c1cc(C)n(C2CC2)c1C	ZINC000350745377	526460517	/nfs/dbraw/zinc/46/05/17/526460517.db2.gz	LCBXESIJLDBDGL-UHFFFAOYSA-N	0	0	277.433	4.322	20	30		CIEDRN
N#Cc1ccc(NC(=O)c2ccc(SC3CC3)cc2)cc1	ZINC000341074003	526658399	/nfs/dbraw/zinc/65/83/99/526658399.db2.gz	CLQVIQGORPXHKZ-UHFFFAOYSA-N	0	0	294.379	4.065	20	30		CIEDRN
N#Cc1ccc(NCc2ccc(Cl)cc2)c(Cl)c1	ZINC000062790658	526663681	/nfs/dbraw/zinc/66/36/81/526663681.db2.gz	DMTGNIMNKZQTLT-UHFFFAOYSA-N	0	0	277.154	4.477	20	30		CIEDRN
N#Cc1ccc(NCc2cnoc2-c2ccco2)c(Cl)c1	ZINC000338206634	526665268	/nfs/dbraw/zinc/66/52/68/526665268.db2.gz	MTWPHRYNAVLYDD-UHFFFAOYSA-N	0	0	299.717	4.072	20	30		CIEDRN
N#Cc1cccc(C#N)c1NCC1CC(c2ccccc2)C1	ZINC000338486696	526696757	/nfs/dbraw/zinc/69/67/57/526696757.db2.gz	GHJSCBQYSRXKBC-UHFFFAOYSA-N	0	0	287.366	4.036	20	30		CIEDRN
CC(C)(C)[C@](C)(C#N)NC(=O)[C@@H]1CC[C@H]2CCCC[C@H]2C1	ZINC000332714331	526741791	/nfs/dbraw/zinc/74/17/91/526741791.db2.gz	LYHUHIVPMBOPBM-FSZRXZPDSA-N	0	0	290.451	4.037	20	30		CIEDRN
CC(C)(C)[C@](C)(C#N)NC(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1	ZINC000332714329	526742074	/nfs/dbraw/zinc/74/20/74/526742074.db2.gz	LYHUHIVPMBOPBM-BORJPKMPSA-N	0	0	290.451	4.037	20	30		CIEDRN
N#Cc1ccccc1SCc1ccc(C(F)(F)F)cn1	ZINC000340696238	526750126	/nfs/dbraw/zinc/75/01/26/526750126.db2.gz	NABNVHXHHIMUKS-UHFFFAOYSA-N	0	0	294.301	4.264	20	30		CIEDRN
N#Cc1ccsc1NC(=O)[C@@H]1CC[C@H]2CCCC[C@H]2C1	ZINC000245920062	526770299	/nfs/dbraw/zinc/77/02/99/526770299.db2.gz	OLTBCLSVRQZRNM-FRRDWIJNSA-N	0	0	288.416	4.165	20	30		CIEDRN
CC(C)(CCC#N)CNC(=O)c1cc(F)c2ccccc2c1	ZINC000354976646	526996633	/nfs/dbraw/zinc/99/66/33/526996633.db2.gz	NCPHCQLAGDFWID-UHFFFAOYSA-N	0	0	298.361	4.039	20	30		CIEDRN
C=CCC(C)(C)C(=O)Nc1cn(CC(C)C)nc1C(F)F	ZINC000344356935	526998497	/nfs/dbraw/zinc/99/84/97/526998497.db2.gz	RMRWGBTWIPCZEQ-UHFFFAOYSA-N	0	0	299.365	4.018	20	30		CIEDRN
C=CCC1(c2nc([C@@H]3C[C@@H]3c3ccccc3)no2)CCC1	ZINC000347269292	527065527	/nfs/dbraw/zinc/06/55/27/527065527.db2.gz	RSURIMOAOZAERF-HUUCEWRRSA-N	0	0	280.371	4.339	20	30		CIEDRN
C=CC[C@@H]1N(C(=O)c2cc[nH]c2C(C)C)CCCC1(C)C	ZINC000355334084	527118068	/nfs/dbraw/zinc/11/80/68/527118068.db2.gz	LWABQQQTQSDVOZ-HNNXBMFYSA-N	0	0	288.435	4.345	20	30		CIEDRN
CC(=O)c1ccc(C#N)c(NC2CC(c3ccccc3)C2)c1	ZINC000302097122	527224918	/nfs/dbraw/zinc/22/49/18/527224918.db2.gz	JPKPNCBYMGBRKY-UHFFFAOYSA-N	0	0	290.366	4.119	20	30		CIEDRN
C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CC[C@@H]1C	ZINC000351528011	527259177	/nfs/dbraw/zinc/25/91/77/527259177.db2.gz	CAHWFJHJJPRPJE-BBRMVZONSA-N	0	0	286.419	4.459	20	30		CIEDRN
C=CCn1cccc1-c1nc(-c2coc3ccccc23)no1	ZINC000347111846	527375020	/nfs/dbraw/zinc/37/50/20/527375020.db2.gz	KNGYGWHDFCAFLM-UHFFFAOYSA-N	0	0	291.310	4.137	20	30		CIEDRN
C=CCCO[C@H](C)c1nc(-c2ccccc2Cl)no1	ZINC000113733613	527405542	/nfs/dbraw/zinc/40/55/42/527405542.db2.gz	AALYJMKFVUVGAE-SNVBAGLBSA-N	0	0	278.739	4.044	20	30		CIEDRN
C=C[C@@H](Cc1nc([C@@H](CCC)OC)no1)c1ccccc1	ZINC000296314707	527444728	/nfs/dbraw/zinc/44/47/28/527444728.db2.gz	FLOAJQUIESVWKA-DZGCQCFKSA-N	0	0	286.375	4.070	20	30		CIEDRN
C=C[C@@H]1CCCCN1C(=O)Nc1ccccc1C(F)F	ZINC000335103925	527453543	/nfs/dbraw/zinc/45/35/43/527453543.db2.gz	GEDMMZHWTGWDBO-LLVKDONJSA-N	0	0	280.318	4.197	20	30		CIEDRN
C=CCC[C@H](Nc1cccc(NC(C)=O)c1)c1ccco1	ZINC000353626013	527488197	/nfs/dbraw/zinc/48/81/97/527488197.db2.gz	WWEWAQHANPHTLV-INIZCTEOSA-N	0	0	284.359	4.357	20	30		CIEDRN
C=CCC[C@H](Nc1nccn2nc(C)cc12)c1ccccc1	ZINC000302498606	527488421	/nfs/dbraw/zinc/48/84/21/527488421.db2.gz	VCBIPPLMNAEXCP-INIZCTEOSA-N	0	0	292.386	4.157	20	30		CIEDRN
C=CCCc1noc(C[C@H](C)c2c[nH]c3ccccc32)n1	ZINC000297269423	527513682	/nfs/dbraw/zinc/51/36/82/527513682.db2.gz	KPKFYAIVFGQHBQ-LBPRGKRZSA-N	0	0	281.359	4.016	20	30		CIEDRN
C=CCCc1noc([C@H](C)Sc2ccc(OC)cc2)n1	ZINC000297183666	527515334	/nfs/dbraw/zinc/51/53/34/527515334.db2.gz	DZMYGXZEKZFVSC-NSHDSACASA-N	0	0	290.388	4.050	20	30		CIEDRN
C=C[C@@](C)(CC)C(=O)Nc1cnn([C@@H](C)CC)c1C1CC1	ZINC000353447335	527525656	/nfs/dbraw/zinc/52/56/56/527525656.db2.gz	JTSWMXSLSYKJKP-SJCJKPOMSA-N	0	0	289.423	4.272	20	30		CIEDRN
C=CCN(C(=O)c1cc(Cl)ccc1SCC)C1CC1	ZINC000347898048	527548119	/nfs/dbraw/zinc/54/81/19/527548119.db2.gz	HGIYKAGOJQEWTL-UHFFFAOYSA-N	0	0	295.835	4.243	20	30		CIEDRN
CC(C)CC1(CNC(=O)c2conc2C2CC2)CCCC1	ZINC000329177640	527689334	/nfs/dbraw/zinc/68/93/34/527689334.db2.gz	CFYPVQMAWZTHCS-UHFFFAOYSA-N	0	0	290.407	4.463	20	30		CIEDRN
CC(C)CCN(CCC#N)Cc1coc2ccccc12	ZINC000353419923	527715417	/nfs/dbraw/zinc/71/54/17/527715417.db2.gz	DTSAVJWDOUYFOK-UHFFFAOYSA-N	0	0	270.376	4.195	20	30		CIEDRN
CCC1(c2noc(C3(C#N)CCCCC3)n2)CCCC1	ZINC000331614853	527820338	/nfs/dbraw/zinc/82/03/38/527820338.db2.gz	SCLUPPQBPBPTIX-UHFFFAOYSA-N	0	0	273.380	4.017	20	30		CIEDRN
CC(C)[C@]1(C)C[C@@H]1C(=O)N[C@@H]1CCC(=O)N[C@H]1C(C)(C)C	ZINC000329217257	527968900	/nfs/dbraw/zinc/96/89/00/527968900.db2.gz	PWFYXMRHKBBKMW-LGIULTMTSA-N	0	0	294.439	4.159	20	30		CIEDRN
CC1=C(C(=O)N[C@@H](CCCC#N)c2ccccc2)CCC1	ZINC000352205425	528078776	/nfs/dbraw/zinc/07/87/76/528078776.db2.gz	FXEJGIVGWWMZEG-KRWDZBQOSA-N	0	0	282.387	4.038	20	30		CIEDRN
CC1CCC(CNC(=O)C[C@H](CC#N)c2ccccc2)CC1	ZINC000354933604	528179331	/nfs/dbraw/zinc/17/93/31/528179331.db2.gz	WTQSXHARDZCXJN-HTWSVDAQSA-N	0	0	298.430	4.016	20	30		CIEDRN
CC(C)C[C@@H](Nc1ncccc1C#N)c1ccccc1	ZINC000301055459	528361820	/nfs/dbraw/zinc/36/18/20/528361820.db2.gz	BPYTVPZJMMKINX-MRXNPFEDSA-N	0	0	265.360	4.153	20	30		CIEDRN
CCOc1ccc(C#N)cc1NCc1cccc2cc[nH]c21	ZINC000354870751	528382444	/nfs/dbraw/zinc/38/24/44/528382444.db2.gz	VMBRWHCCLNWGHD-UHFFFAOYSA-N	0	0	291.354	4.050	20	30		CIEDRN
CC(C)[C@@H](C)CC(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000352226436	528388382	/nfs/dbraw/zinc/38/83/82/528388382.db2.gz	TZJZLZSPCVYEAL-DOTOQJQBSA-N	0	0	286.419	4.220	20	30		CIEDRN
CCC(C)(C)c1ccc(CN(CCC#N)CCC#N)cc1	ZINC000351735810	528602443	/nfs/dbraw/zinc/60/24/43/528602443.db2.gz	OEHYMPOGXRTIDD-UHFFFAOYSA-N	0	0	283.419	4.004	20	30		CIEDRN
CCC(CC)CC(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000352174694	528734694	/nfs/dbraw/zinc/73/46/94/528734694.db2.gz	PAMXBIMEMTZHMX-KRWDZBQOSA-N	0	0	286.419	4.364	20	30		CIEDRN
CC(=O)Nc1cccc(C(=O)N[C@H]2CC23CCCCC3)c1	ZINC000329104647	528747520	/nfs/dbraw/zinc/74/75/20/528747520.db2.gz	GTPNYVZDQQJDPO-HNNXBMFYSA-N	0	0	286.375	4.322	20	30		CIEDRN
CCCC[C@@H](C)C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000352175663	528753641	/nfs/dbraw/zinc/75/36/41/528753641.db2.gz	WXESTNAOHNHWJU-WBVHZDCISA-N	0	0	286.419	4.364	20	30		CIEDRN
CCC(CC)[C@@H]1C[C@@H](Nc2cccc(F)c2C#N)CCO1	ZINC000302043801	528837690	/nfs/dbraw/zinc/83/76/90/528837690.db2.gz	MHYGCJXGNKNUCO-GUYCJALGSA-N	0	0	290.382	4.093	20	30		CIEDRN
CC1(C(=O)Nc2ccc3c(c2)C(=O)NC3)CCCCCC1	ZINC000329284920	528863182	/nfs/dbraw/zinc/86/31/82/528863182.db2.gz	GGFJSQGQCZTLDO-UHFFFAOYSA-N	0	0	286.375	4.453	20	30		CIEDRN
CC1(C)C(C(=O)N[C@@H](CCCC#N)c2ccccc2)C1(C)C	ZINC000352174887	528870335	/nfs/dbraw/zinc/87/03/35/528870335.db2.gz	PWOFFRAPIJDFRX-HNNXBMFYSA-N	0	0	298.430	4.220	20	30		CIEDRN
CC1(C)CC(C(=O)Nc2ccccc2SCCC#N)C1	ZINC000352719920	528882080	/nfs/dbraw/zinc/88/20/80/528882080.db2.gz	OLBLFYVMKKEKPZ-UHFFFAOYSA-N	0	0	288.416	4.067	20	30		CIEDRN
CCC1(CNC(=O)c2oc(CC3CC3)nc2C)CCCC1	ZINC000330016225	529032975	/nfs/dbraw/zinc/03/29/75/529032975.db2.gz	PFWQFAOIACNUIN-UHFFFAOYSA-N	0	0	290.407	4.211	20	30		CIEDRN
CC[C@@H](Nc1ccc(Cl)c(C#N)n1)c1ccc(C)cc1	ZINC000301380854	529209728	/nfs/dbraw/zinc/20/97/28/529209728.db2.gz	YYTZOUPQDHDDGF-CQSZACIVSA-N	0	0	285.778	4.478	20	30		CIEDRN
CCS[C@H]1CCCC[C@@H]1Nc1ccc(C#N)cc1	ZINC000301567174	529226844	/nfs/dbraw/zinc/22/68/44/529226844.db2.gz	QFJFQPHFTNKJEW-GJZGRUSLSA-N	0	0	260.406	4.034	20	30		CIEDRN
CC[C@H](C)n1ncc(N[C@@H]2CCc3ccc(C#N)cc32)c1C	ZINC000353619671	529294918	/nfs/dbraw/zinc/29/49/18/529294918.db2.gz	CXEGTVCPGGUYMG-YVEFUNNKSA-N	0	0	294.402	4.134	20	30		CIEDRN