smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CN(C)CC(=O)N1CCN(C(=O)c2ccnc(-n3cccn3)c2)CC1	ZINC000159683117	206257515	/nfs/dbraw/zinc/25/75/15/206257515.db2.gz	MRZNJDZOGMIUHQ-UHFFFAOYSA-N	0	1	342.403	0.113	20	70		ECIDMN
Cc1ccc(NC(=O)C(=O)NCCCN2C[C@@H](C)O[C@@H](C)C2)cn1	ZINC000159926440	206270479	/nfs/dbraw/zinc/27/04/79/206270479.db2.gz	YMHKAGLONJQZEH-OKILXGFUSA-N	0	1	334.420	0.944	20	70		ECIDMN
CCC[C@H]1CN(C(=O)N[C@@H](C)Cn2cncn2)CCN1CCOC	ZINC000161420183	436889335	/nfs/dbraw/zinc/88/93/35/436889335.db2.gz	YMYLYRUCMXKTLA-GJZGRUSLSA-N	0	1	338.456	0.809	20	70		ECIDMN
C[C@@H](C(=O)N1CCN(c2ncccn2)CC1)N(C)C[C@H](O)C1CC1	ZINC000160744444	545849951	/nfs/dbraw/zinc/84/99/51/545849951.db2.gz	XKXJJZMKUNNIIY-ZFWWWQNUSA-N	0	1	333.436	0.216	20	70		ECIDMN
c1cn(CCN2CCN(c3cc(N4CCOCC4)ncn3)CC2)cn1	ZINC000159844604	206267204	/nfs/dbraw/zinc/26/72/04/206267204.db2.gz	VKKAJOXKLWQQNO-UHFFFAOYSA-N	0	1	343.435	0.332	20	70		ECIDMN
O=C(CS(=O)(=O)C1CCCC1)NCC1CCN(CCO)CC1	ZINC000160645239	436874336	/nfs/dbraw/zinc/87/43/36/436874336.db2.gz	IEWJZLWRYMJNPQ-UHFFFAOYSA-N	0	1	332.466	0.164	20	70		ECIDMN
COC(=O)Cn1cc(CCN2CCC[C@H]2[C@H](O)C(F)(F)F)nn1	ZINC000160100797	436869249	/nfs/dbraw/zinc/86/92/49/436869249.db2.gz	LNLWXOLWZMWGQS-JQWIXIFHSA-N	0	1	336.314	0.381	20	70		ECIDMN
CN(C)C(=O)N1CCN(C(=O)c2cccc(-c3nnc[nH]3)c2)CC1	ZINC000160158058	436869446	/nfs/dbraw/zinc/86/94/46/436869446.db2.gz	FVTUXMPTLCVAPN-UHFFFAOYSA-N	0	1	328.376	0.911	20	70		ECIDMN
CNS(=O)(=O)c1cccc(C(=O)N[C@@H](C)Cc2cc(C)[nH]n2)c1	ZINC000161208245	436886239	/nfs/dbraw/zinc/88/62/39/436886239.db2.gz	AGAJNWDCLUTLJZ-JTQLQIEISA-N	0	1	336.417	0.987	20	70		ECIDMN
C[N-]S(=O)(=O)c1ccc(C(=O)N2CCC([NH2+]CC3CC3)CC2)o1	ZINC000159876251	206268238	/nfs/dbraw/zinc/26/82/38/206268238.db2.gz	LUQPZTZJWYPQAU-UHFFFAOYSA-N	0	1	341.433	0.792	20	70		ECIDMN
C[N-]S(=O)(=O)c1cc(C(=O)N2CCC[C@H]3C[N@H+](C)CC[C@H]32)co1	ZINC000160380256	206294246	/nfs/dbraw/zinc/29/42/46/206294246.db2.gz	LVFFIDZUIMXABW-WCQYABFASA-N	0	1	341.433	0.744	20	70		ECIDMN
C[N-]S(=O)(=O)c1cc(C(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@H]32)co1	ZINC000160380256	206294251	/nfs/dbraw/zinc/29/42/51/206294251.db2.gz	LVFFIDZUIMXABW-WCQYABFASA-N	0	1	341.433	0.744	20	70		ECIDMN
Cc1cnn(Cc2cc(C(=O)NCCN3CCN(C)CC3)no2)c1	ZINC000161140601	206331279	/nfs/dbraw/zinc/33/12/79/206331279.db2.gz	BIJYWBLDORWIDD-UHFFFAOYSA-N	0	1	332.408	0.205	20	70		ECIDMN
Cc1cc(C[C@H](C)NC(=O)CN2CCN(c3ccccn3)CC2)n[nH]1	ZINC000161169504	206332520	/nfs/dbraw/zinc/33/25/20/206332520.db2.gz	CMLGOYLEXDCCJJ-AWEZNQCLSA-N	0	1	342.447	0.983	20	70		ECIDMN
Cc1cc(C[C@@H](C)NC(=O)CCCN2C(=O)NC(C)(C)C2=O)n[nH]1	ZINC000161235897	206337328	/nfs/dbraw/zinc/33/73/28/206337328.db2.gz	ACCZZCPGVBFBPW-SNVBAGLBSA-N	0	1	335.408	0.876	20	70		ECIDMN
CC(=O)NCC(=O)NCC(=O)Nc1[nH]nc(-c2ccc(C)o2)c1C	ZINC000161427182	206347807	/nfs/dbraw/zinc/34/78/07/206347807.db2.gz	ULIVALSCBTWWLE-UHFFFAOYSA-N	0	1	333.348	0.477	20	70		ECIDMN
C[NH+](C)C[C@](C)(O)C[N-]S(=O)(=O)c1cc(F)c(F)cc1F	ZINC000161444216	206348554	/nfs/dbraw/zinc/34/85/54/206348554.db2.gz	JIZCCFWLDNVUGR-GFCCVEGCSA-N	0	1	326.340	0.695	20	70		ECIDMN
CCN(C1CCN(C(=O)[C@@H](N)c2ccccc2)CC1)S(C)(=O)=O	ZINC000159531357	436857797	/nfs/dbraw/zinc/85/77/97/436857797.db2.gz	NBXMQTFMOUBOOK-HNNXBMFYSA-N	0	1	339.461	0.959	20	70		ECIDMN
O=C(CN1CCN(c2ccccn2)CC1)N1C[C@H]2CCC[C@@H](C1)N2	ZINC000159603233	436861475	/nfs/dbraw/zinc/86/14/75/436861475.db2.gz	YTHNANXJTDCHSL-IYBDPMFKSA-N	0	1	329.448	0.557	20	70		ECIDMN
CC[C@H](C(=O)Nc1ncn(CC(=O)N2CCCCCC2)n1)N(C)C	ZINC000160926526	436881468	/nfs/dbraw/zinc/88/14/68/436881468.db2.gz	WSUBTUGOUBKNKE-CYBMUJFWSA-N	0	1	336.440	0.959	20	70		ECIDMN
CCN(CCn1cnc2c1c(=O)n(C)c(=O)n2C)Cc1ccccn1	ZINC000161144333	206331213	/nfs/dbraw/zinc/33/12/13/206331213.db2.gz	XVFLDKMKBQAHLT-UHFFFAOYSA-N	0	1	342.403	0.351	20	70		ECIDMN
COC[C@H](O)CCNC(=O)c1ccc(CN2CCN(C)CC2)cc1	ZINC000161352191	206342827	/nfs/dbraw/zinc/34/28/27/206342827.db2.gz	LEHGDHZFMGQJEB-QGZVFWFLSA-N	0	1	335.448	0.561	20	70		ECIDMN
Cn1cc(N2CCC[C@H](N3CCN(CC(C)(C)O)CC3)C2=O)cn1	ZINC000160428996	436872620	/nfs/dbraw/zinc/87/26/20/436872620.db2.gz	IKLJVWIUNOSQJG-HNNXBMFYSA-N	0	1	335.452	0.304	20	70		ECIDMN
Cc1cc(C[C@H](C)NC(=O)[C@H]2CCCN(S(C)(=O)=O)C2)n[nH]1	ZINC000161230713	436884775	/nfs/dbraw/zinc/88/47/75/436884775.db2.gz	VPHSVHRQNJEWJE-JQWIXIFHSA-N	0	1	328.438	0.437	20	70		ECIDMN
Cc1ccc(S(=O)(=O)N(CCOCCO)CCN(C)C)c(F)c1	ZINC000161305874	436886776	/nfs/dbraw/zinc/88/67/76/436886776.db2.gz	XRNPWUYDEICFRY-UHFFFAOYSA-N	0	1	348.440	0.695	20	70		ECIDMN
Cc1cc(F)cc(S(=O)(=O)N(CCOCCO)CCN(C)C)c1	ZINC000161302138	436887230	/nfs/dbraw/zinc/88/72/30/436887230.db2.gz	CZHXKQWLBJMRRH-UHFFFAOYSA-N	0	1	348.440	0.695	20	70		ECIDMN
C[C@@H](O)C(=O)N1CCN(CC2CCN(C(=O)C(C)(C)C)CC2)CC1	ZINC000161309196	436888064	/nfs/dbraw/zinc/88/80/64/436888064.db2.gz	YCDTUUYSHZAGDN-CQSZACIVSA-N	0	1	339.480	0.796	20	70		ECIDMN
NC(=O)C1(CNC(=O)c2cccc(-c3nnc[nH]3)c2)CCOCC1	ZINC000160170432	206282051	/nfs/dbraw/zinc/28/20/51/206282051.db2.gz	WEYCOLHQJVFDLO-UHFFFAOYSA-N	0	1	329.360	0.484	20	70		ECIDMN
Cc1cc(C[C@@H](C)NC(=O)CN2C(=O)N[C@@](C)(C3CC3)C2=O)n[nH]1	ZINC000161326478	206341336	/nfs/dbraw/zinc/34/13/36/206341336.db2.gz	PMNQASKCPRUEQK-ABKXIKBNSA-N	0	1	333.392	0.486	20	70		ECIDMN
O=C(NCCO)c1n[nH]c2ccc(I)cc21	ZINC000159431470	436859126	/nfs/dbraw/zinc/85/91/26/436859126.db2.gz	UMLDOEOVNLZYGY-UHFFFAOYSA-N	0	1	331.113	0.890	20	70		ECIDMN
COC(=O)Cn1cc(CCN2CCC[C@@H]2[C@H](O)C(F)(F)F)nn1	ZINC000160100650	436869422	/nfs/dbraw/zinc/86/94/22/436869422.db2.gz	LNLWXOLWZMWGQS-PWSUYJOCSA-N	0	1	336.314	0.381	20	70		ECIDMN
CCOC(=O)[C@@H]1CCCN(C(=O)[C@H](C)N(C)C[C@H](O)C2CC2)C1	ZINC000160815835	436879694	/nfs/dbraw/zinc/87/96/94/436879694.db2.gz	QODGVVKVJQYZGD-CFVMTHIKSA-N	0	1	326.437	0.879	20	70		ECIDMN
CN(C)CCN(CCOCCO)S(=O)(=O)c1ccccc1F	ZINC000161307101	436888236	/nfs/dbraw/zinc/88/82/36/436888236.db2.gz	UBKYYVXOLIMVIR-UHFFFAOYSA-N	0	1	334.413	0.387	20	70		ECIDMN
O=C([C@H]1CC(=O)N(Cc2ccccn2)C1)N1C[C@H]2CCC[C@@H](C1)N2	ZINC000160602573	545850044	/nfs/dbraw/zinc/85/00/44/545850044.db2.gz	VOVCXIQZFRULMX-CWRNSKLLSA-N	0	1	328.416	0.783	20	70		ECIDMN
C[C@H](CNC(=O)c1csc(S(C)(=O)=O)c1)N1CCN(C)CC1	ZINC000160158033	206282415	/nfs/dbraw/zinc/28/24/15/206282415.db2.gz	RJVFMKHCYDLJAO-LLVKDONJSA-N	0	1	345.490	0.517	20	70		ECIDMN
Cc1cc(C[C@H](C)NC(=O)c2ccc(CNS(C)(=O)=O)o2)n[nH]1	ZINC000161303219	206340573	/nfs/dbraw/zinc/34/05/73/206340573.db2.gz	HWRFRINBZQONBS-VIFPVBQESA-N	0	1	340.405	0.721	20	70		ECIDMN
Cc1cc(C[C@H](C)NC(=O)[C@H]2CCCCN2S(C)(=O)=O)n[nH]1	ZINC000161493066	545853809	/nfs/dbraw/zinc/85/38/09/545853809.db2.gz	VOHRQBGRDGKARD-GXFFZTMASA-N	0	1	328.438	0.579	20	70		ECIDMN
O=C(c1ccc(C[C@H]2CC(=O)NC2=O)cc1)N1C[C@H]2CCC[C@@H](C1)N2	ZINC000159657355	436861016	/nfs/dbraw/zinc/86/10/16/436861016.db2.gz	LLMHCUWBLWKSGX-HRCADAONSA-N	0	1	341.411	0.858	20	70		ECIDMN
CS(=O)(=O)c1csc(C(=O)NCCCCN2CCOCC2)c1	ZINC000160682460	436877519	/nfs/dbraw/zinc/87/75/19/436877519.db2.gz	DPHYZEJXHFUZAA-UHFFFAOYSA-N	0	1	346.474	0.994	20	70		ECIDMN
CCN1CCN(CC(=O)Nc2cc(S(N)(=O)=O)ccc2C)CC1	ZINC000161075159	436882907	/nfs/dbraw/zinc/88/29/07/436882907.db2.gz	GDPGWGFNJWKXBC-UHFFFAOYSA-N	0	1	340.449	0.218	20	70		ECIDMN
CC(=O)NC[C@H]1CCCN([C@@H]2CCCN(c3cnn(C)c3)C2=O)C1	ZINC000159733775	206260376	/nfs/dbraw/zinc/26/03/76/206260376.db2.gz	SDTFWMOIKQYQSX-GDBMZVCRSA-N	0	1	333.436	0.764	20	70		ECIDMN
Cc1ccc(NC(=O)C(=O)NCCCN2C[C@H](C)O[C@@H](C)C2)cn1	ZINC000159926719	206271502	/nfs/dbraw/zinc/27/15/02/206271502.db2.gz	YMHKAGLONJQZEH-KBPBESRZSA-N	0	1	334.420	0.944	20	70		ECIDMN
CS(=O)(=O)N[C@@H]1CCC[C@H]1CNC(=O)c1[nH]nc2c1CCC2	ZINC000160699154	206309961	/nfs/dbraw/zinc/30/99/61/206309961.db2.gz	FXQFWIHXFAHPHU-GXSJLCMTSA-N	0	1	326.422	0.346	20	70		ECIDMN
CN(CC(=O)N1Cc2ccccc2C[C@H]1C(N)=O)[C@@H]1CCSC1	ZINC000160585807	436874588	/nfs/dbraw/zinc/87/45/88/436874588.db2.gz	LCDOOCHMRFWZTD-CABCVRRESA-N	0	1	333.457	0.863	20	70		ECIDMN
C[C@H](NC(=O)CN(C)C[C@@H]1CCC[C@@H]1O)C(=O)N1CCCCC1	ZINC000159509956	436858352	/nfs/dbraw/zinc/85/83/52/436858352.db2.gz	YMFGUWGAEFIGNF-KKUMJFAQSA-N	0	1	325.453	0.596	20	70		ECIDMN
NC(=O)c1cc(C(=O)N2C[C@H]3CCC[C@@H](C2)N3)nn1-c1ccccc1	ZINC000160257234	436868607	/nfs/dbraw/zinc/86/86/07/436868607.db2.gz	PNSXXVGMBATJLG-BETUJISGSA-N	0	1	339.399	0.938	20	70		ECIDMN
CCC[C@@H](NC(N)=O)C(=O)NC[C@@H]1C[C@@H](O)CN1Cc1ccccc1	ZINC000160660126	436877283	/nfs/dbraw/zinc/87/72/83/436877283.db2.gz	KAMINIUKHATXGG-ARFHVFGLSA-N	0	1	348.447	0.575	20	70		ECIDMN
CS(=O)(=O)N[C@H]1CCC[C@@H]1CNC(=O)c1[nH]nc2c1CCCC2	ZINC000160684071	545849871	/nfs/dbraw/zinc/84/98/71/545849871.db2.gz	JTZQSGPWMLOPLQ-PWSUYJOCSA-N	0	1	340.449	0.736	20	70		ECIDMN
C[N-]S(=O)(=O)c1cc(C(=O)N2CCC[C@H]3C[N@H+](C)CC[C@@H]32)co1	ZINC000160380083	206294359	/nfs/dbraw/zinc/29/43/59/206294359.db2.gz	LVFFIDZUIMXABW-AAEUAGOBSA-N	0	1	341.433	0.744	20	70		ECIDMN
C[N-]S(=O)(=O)c1cc(C(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)co1	ZINC000160380083	206294364	/nfs/dbraw/zinc/29/43/64/206294364.db2.gz	LVFFIDZUIMXABW-AAEUAGOBSA-N	0	1	341.433	0.744	20	70		ECIDMN
Cn1ccc(NC(=O)C(=O)N2CCC[C@H](c3n[nH]c(C4CC4)n3)C2)n1	ZINC000160410941	206295654	/nfs/dbraw/zinc/29/56/54/206295654.db2.gz	AXIQEHYOCOUOTI-NSHDSACASA-N	0	1	343.391	0.760	20	70		ECIDMN
CC[C@@H](O)CCNC(=O)NCc1ccc(N2CCN(C)CC2)nc1	ZINC000160872892	206316187	/nfs/dbraw/zinc/31/61/87/206316187.db2.gz	JQUXFKPWTRPGCW-OAHLLOKOSA-N	0	1	335.452	0.794	20	70		ECIDMN
CN(CC(=O)N1Cc2ccccc2C[C@H]1C(N)=O)[C@H]1CCSC1	ZINC000160585943	436874670	/nfs/dbraw/zinc/87/46/70/436874670.db2.gz	LCDOOCHMRFWZTD-GJZGRUSLSA-N	0	1	333.457	0.863	20	70		ECIDMN
CN(CC(=O)N1C[C@H]2CCC[C@@H](C1)N2)S(=O)(=O)c1ccccc1	ZINC000160285683	436870126	/nfs/dbraw/zinc/87/01/26/436870126.db2.gz	YFEWKXWJXCBCSG-OKILXGFUSA-N	0	1	337.445	0.660	20	70		ECIDMN
N[C@H](C(=O)N1CCN(CCc2cnccn2)CC1)c1ccccc1	ZINC000217355966	545920896	/nfs/dbraw/zinc/92/08/96/545920896.db2.gz	AAWCFTQJKVSDNG-KRWDZBQOSA-N	0	1	325.416	0.863	20	70		ECIDMN
CN1CCN(c2cc(CNC(=O)c3cccc(=O)n3C)ccn2)CC1	ZINC000159779811	529776703	/nfs/dbraw/zinc/77/67/03/529776703.db2.gz	PGKVWCXFDWVWLW-UHFFFAOYSA-N	0	1	341.415	0.462	20	70		ECIDMN
C[N-]S(=O)(=O)c1cc(C(=O)N2CC[C@H]3[C@@H](CCC[N@@H+]3C)C2)co1	ZINC000159724112	530025074	/nfs/dbraw/zinc/02/50/74/530025074.db2.gz	OCLYWTCPWZTYGL-AAEUAGOBSA-N	0	1	341.433	0.744	20	70		ECIDMN
C[N-]S(=O)(=O)c1cc(C(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)co1	ZINC000159724112	530025075	/nfs/dbraw/zinc/02/50/75/530025075.db2.gz	OCLYWTCPWZTYGL-AAEUAGOBSA-N	0	1	341.433	0.744	20	70		ECIDMN
Cc1cc(C[C@@H](C)NC(=O)[C@H](NS(C)(=O)=O)C(C)(C)C)n[nH]1	ZINC000159697852	301281161	/nfs/dbraw/zinc/28/11/61/301281161.db2.gz	DTBAAMBWANZWME-SKDRFNHKSA-N	0	1	330.454	0.729	20	70		ECIDMN
CCC[C@H]1CN(C(=O)NCC(=O)N2CCCC2)CCN1CCOC	ZINC000160098085	436869388	/nfs/dbraw/zinc/86/93/88/436869388.db2.gz	DIDQOEDQNJVDKP-HNNXBMFYSA-N	0	1	340.468	0.751	20	70		ECIDMN
Cc1cc(C[C@H](C)NC(=O)[C@@H]2CCCCN2S(C)(=O)=O)n[nH]1	ZINC000161492766	545854093	/nfs/dbraw/zinc/85/40/93/545854093.db2.gz	VOHRQBGRDGKARD-GWCFXTLKSA-N	0	1	328.438	0.579	20	70		ECIDMN
Cc1nc2ccccn2c1CN1CCC[C@H](CNS(N)(=O)=O)C1	ZINC000159588500	436859872	/nfs/dbraw/zinc/85/98/72/436859872.db2.gz	NKMFAIFHLQSWBV-CYBMUJFWSA-N	0	1	337.449	0.648	20	70		ECIDMN
C[C@H](CNC(=O)N(C)CC1CCOCC1)CN1CC[NH+](C)CC1	ZINC000159746791	436862462	/nfs/dbraw/zinc/86/24/62/436862462.db2.gz	LJWUBYRPXSXFBY-OAHLLOKOSA-N	0	1	326.485	0.938	20	70		ECIDMN
Cc1cccc2nc(CNC(=O)c3cn(CC(=O)N(C)C)nn3)[nH]c21	ZINC000160255658	436869398	/nfs/dbraw/zinc/86/93/98/436869398.db2.gz	HFBNDGNCSBCLEX-UHFFFAOYSA-N	0	1	341.375	0.481	20	70		ECIDMN
CCC[C@H]1CN(C(=O)NCCCNC(C)=O)CCN1CCOC	ZINC000160402398	436870063	/nfs/dbraw/zinc/87/00/63/436870063.db2.gz	KUOBKHIGVUGLLW-HNNXBMFYSA-N	0	1	328.457	0.655	20	70		ECIDMN
CCC[C@H]1CN(C(=O)NCCC(=O)N(C)C)CCN1CCOC	ZINC000160503846	436873405	/nfs/dbraw/zinc/87/34/05/436873405.db2.gz	KKQMXXLVUGOBPU-AWEZNQCLSA-N	0	1	328.457	0.607	20	70		ECIDMN
CC(=O)N1CCC[C@@H]1C(=O)NC[C@H]1C[C@H](O)CN1Cc1ccccc1	ZINC000160546269	436875800	/nfs/dbraw/zinc/87/58/00/436875800.db2.gz	XSYHWOXLZUVHOM-FGTMMUONSA-N	0	1	345.443	0.749	20	70		ECIDMN
CN(C(=O)N[C@H]1CCN(C2CCCC2)C1)[C@@H]1CCS(=O)(=O)C1	ZINC000160905688	436881582	/nfs/dbraw/zinc/88/15/82/436881582.db2.gz	YPSTXBHJJOIQBN-GXTWGEPZSA-N	0	1	329.466	0.832	20	70		ECIDMN
CC[C@@H](O)CCNC(=O)NCc1ccnc(N2CCN(C)CC2)c1	ZINC000160956891	436881774	/nfs/dbraw/zinc/88/17/74/436881774.db2.gz	AMKKMUZTLMGMEY-OAHLLOKOSA-N	0	1	335.452	0.794	20	70		ECIDMN
CCN(CCOc1ccc(S(N)(=O)=O)cc1)Cc1cnn(C)c1	ZINC000161108183	436883173	/nfs/dbraw/zinc/88/31/73/436883173.db2.gz	IHWASCKEXNQBGK-UHFFFAOYSA-N	0	1	338.433	0.968	20	70		ECIDMN
O=C(N[C@@H]1CCc2ncnn2C1)N1CCC[C@@H](CN2CCOCC2)C1	ZINC000161194081	436886446	/nfs/dbraw/zinc/88/64/46/436886446.db2.gz	FSOYIDNJJKZCRS-LSDHHAIUSA-N	0	1	348.451	0.347	20	70		ECIDMN
Cc1cc(C[C@@H](C)NC(=O)Cn2c(=O)[nH]c3ccccc3c2=O)n[nH]1	ZINC000161507894	436891495	/nfs/dbraw/zinc/89/14/95/436891495.db2.gz	NGDWHFVZRFFUDM-SNVBAGLBSA-N	0	1	341.371	0.469	20	70		ECIDMN
C[C@@H](CNC(=O)c1csc(S(C)(=O)=O)c1)N1CCN(C)CC1	ZINC000160157825	534049880	/nfs/dbraw/zinc/04/98/80/534049880.db2.gz	RJVFMKHCYDLJAO-NSHDSACASA-N	0	1	345.490	0.517	20	70		ECIDMN
CS(=O)(=O)CCCCN1CCC[C@H](C(=O)N2CCOCC2)C1	ZINC000161320723	545851510	/nfs/dbraw/zinc/85/15/10/545851510.db2.gz	SNMIFXBNVMPISP-AWEZNQCLSA-N	0	1	332.466	0.382	20	70		ECIDMN
CC1CCN(CCCNC(=O)NC[C@H]2CCCS2(=O)=O)CC1	ZINC000159869935	436865521	/nfs/dbraw/zinc/86/55/21/436865521.db2.gz	PHSXZSDMEJWJMA-CQSZACIVSA-N	0	1	331.482	0.985	20	70		ECIDMN
CCC[C@@H]1CN(C(=O)NCC(=O)N2CCCC2)CCN1CCOC	ZINC000160097962	436869099	/nfs/dbraw/zinc/86/90/99/436869099.db2.gz	DIDQOEDQNJVDKP-OAHLLOKOSA-N	0	1	340.468	0.751	20	70		ECIDMN
CN1CCC[C@@H]1CNC(=O)C(=O)Nc1ccc(Br)nc1	ZINC000160401333	436870720	/nfs/dbraw/zinc/87/07/20/436870720.db2.gz	LPPVBMZBRIHWGH-SNVBAGLBSA-N	0	1	341.209	0.993	20	70		ECIDMN
Cn1cc(NC(=O)C(=O)N2CCC[C@H](c3n[nH]c(C4CC4)n3)C2)cn1	ZINC000160407991	436871143	/nfs/dbraw/zinc/87/11/43/436871143.db2.gz	QBBITWBAAXYABS-NSHDSACASA-N	0	1	343.391	0.760	20	70		ECIDMN
Cc1cc(C[C@@H](C)NC(=O)CN2CCN(c3ccccn3)CC2)n[nH]1	ZINC000161169383	436885967	/nfs/dbraw/zinc/88/59/67/436885967.db2.gz	CMLGOYLEXDCCJJ-CQSZACIVSA-N	0	1	342.447	0.983	20	70		ECIDMN
Cc1ccc(S(=O)(=O)N(CCOCCO)CCN(C)C)cc1	ZINC000161299499	436887989	/nfs/dbraw/zinc/88/79/89/436887989.db2.gz	ZRTKVMYJKMXLRY-UHFFFAOYSA-N	0	1	330.450	0.556	20	70		ECIDMN
CNS(=O)(=O)c1cc(C(=O)N[C@H](C)Cc2cc(C)[nH]n2)co1	ZINC000160159075	530026223	/nfs/dbraw/zinc/02/62/23/530026223.db2.gz	MXLLBYGRRPJFMD-MRVPVSSYSA-N	0	1	326.378	0.580	20	70		ECIDMN
COC[C@@H](O)CNC(=O)NC1CCN([C@@H](C)c2ccncc2)CC1	ZINC000161201287	285249109	/nfs/dbraw/zinc/24/91/09/285249109.db2.gz	KICKZXZEMVLYPF-BBRMVZONSA-N	0	1	336.436	0.914	20	70		ECIDMN
CCOC(=O)C1CCN(C(=O)CN(C)C[C@H]2CCC[C@@H]2O)CC1	ZINC000159466279	436859322	/nfs/dbraw/zinc/85/93/22/436859322.db2.gz	RZCHEYKLTTUSMD-CABCVRRESA-N	0	1	326.437	0.881	20	70		ECIDMN
CCc1ncnc(NCCCCN2CC[NH+](CCO)CC2)c1F	ZINC000159775566	436863597	/nfs/dbraw/zinc/86/35/97/436863597.db2.gz	CIQLNIBQZHUSHH-UHFFFAOYSA-N	0	1	325.432	0.980	20	70		ECIDMN
Cc1nc2nc(N)nn2c(C)c1CCC(=O)N1C[C@H]2CCC[C@@H](C1)N2	ZINC000160412045	436869852	/nfs/dbraw/zinc/86/98/52/436869852.db2.gz	UTHXLPSUWGXMQZ-BETUJISGSA-N	0	1	343.435	0.609	20	70		ECIDMN
Cc1conc1NC(=O)C(=O)N1CCC[C@H](CN2CCOCC2)C1	ZINC000161163631	436886166	/nfs/dbraw/zinc/88/61/66/436886166.db2.gz	JQMCYSYVMXNYGB-CYBMUJFWSA-N	0	1	336.392	0.492	20	70		ECIDMN
C[N-]S(=O)(=O)c1cc(C(=O)NC2CC[NH+](C(C)C)CC2)co1	ZINC000160241309	530025478	/nfs/dbraw/zinc/02/54/78/530025478.db2.gz	SRGXJAKEDKHPQP-UHFFFAOYSA-N	0	1	329.422	0.790	20	70		ECIDMN
O=C(c1ccc2n[nH]cc2c1)N1CCC[C@H](C(=O)N2CCNCC2)C1	ZINC000159386379	436858300	/nfs/dbraw/zinc/85/83/00/436858300.db2.gz	OJHFZTOACAARQJ-AWEZNQCLSA-N	0	1	341.415	0.847	20	70		ECIDMN
Cc1nn(C)c(C)c1-c1cc(C(=O)N2C[C@H]3OCCN(C)[C@H]3C2)n[nH]1	ZINC000159685780	436861332	/nfs/dbraw/zinc/86/13/32/436861332.db2.gz	AOEBCIAECWBXQY-LSDHHAIUSA-N	0	1	344.419	0.582	20	70		ECIDMN
C[N@H+](CC(=O)NCCCN1CCCCCC1=O)C[C@@H]1CCC[C@@H]1O	ZINC000159721224	436862379	/nfs/dbraw/zinc/86/23/79/436862379.db2.gz	WWUZSNCLMVXIEW-HOTGVXAUSA-N	0	1	339.480	0.988	20	70		ECIDMN
CN(CC(=O)NCCCN1CCCCCC1=O)C[C@@H]1CCC[C@@H]1O	ZINC000159721224	436862383	/nfs/dbraw/zinc/86/23/83/436862383.db2.gz	WWUZSNCLMVXIEW-HOTGVXAUSA-N	0	1	339.480	0.988	20	70		ECIDMN
CNS(=O)(=O)c1cc(C(=O)N2C[C@H]3CCC[C@@H](C2)N3)ccc1F	ZINC000160431608	436872878	/nfs/dbraw/zinc/87/28/78/436872878.db2.gz	GOXLVMRVVNRRCA-TXEJJXNPSA-N	0	1	341.408	0.700	20	70		ECIDMN
CN(C)C(=O)CCCC(=O)NC[C@@H]1C[C@@H](O)CN1Cc1ccccc1	ZINC000160506245	436873931	/nfs/dbraw/zinc/87/39/31/436873931.db2.gz	RLNGZZIMQBDDLW-DLBZAZTESA-N	0	1	347.459	0.997	20	70		ECIDMN
NC(=O)COc1ccc(/C=C/C(=O)N2C[C@H]3CCC[C@@H](C2)N3)cc1	ZINC000160694920	436878274	/nfs/dbraw/zinc/87/82/74/436878274.db2.gz	KJQKBEKNLRAQTA-QHLGLPELSA-N	0	1	329.400	0.917	20	70		ECIDMN
Cc1cc(C(=O)N2C[C@H]3CCC[C@@H](C2)N3)cc(S(N)(=O)=O)c1C	ZINC000160703908	436878317	/nfs/dbraw/zinc/87/83/17/436878317.db2.gz	WHYSWMDWSFWJGZ-OKILXGFUSA-N	0	1	337.445	0.917	20	70		ECIDMN
O=C(N[C@H]1CCc2ncnn2C1)N1CCC[C@H](CN2CCOCC2)C1	ZINC000161193956	436885012	/nfs/dbraw/zinc/88/50/12/436885012.db2.gz	FSOYIDNJJKZCRS-CABCVRRESA-N	0	1	348.451	0.347	20	70		ECIDMN
Cn1cc(N2CCC[C@@H](N3CCC[C@H](CCC(N)=O)C3)C2=O)cn1	ZINC000160334809	534738818	/nfs/dbraw/zinc/73/88/18/534738818.db2.gz	SMMFYIIGDVBGCE-UKRRQHHQSA-N	0	1	333.436	0.893	20	70		ECIDMN
Cn1cc(N2CCC[C@@H](N3CCN(CC(C)(C)O)CC3)C2=O)cn1	ZINC000160428880	534739623	/nfs/dbraw/zinc/73/96/23/534739623.db2.gz	IKLJVWIUNOSQJG-OAHLLOKOSA-N	0	1	335.452	0.304	20	70		ECIDMN
CN1CCN(c2cc(CNC(=O)N3CCC[C@](C)(O)C3)ccn2)CC1	ZINC000160222612	529776623	/nfs/dbraw/zinc/77/66/23/529776623.db2.gz	TXMORGYBHCXAFX-SFHVURJKSA-N	0	1	347.463	0.890	20	70		ECIDMN
CN1CCC[C@H]1CNC(=O)C(=O)Nc1ccc(Br)nc1	ZINC000160401463	436869867	/nfs/dbraw/zinc/86/98/67/436869867.db2.gz	LPPVBMZBRIHWGH-JTQLQIEISA-N	0	1	341.209	0.993	20	70		ECIDMN
Cc1nnc(CN2CCN(C(=O)CN(C)[C@H]3CCSC3)CC2)[nH]1	ZINC000160707576	436877001	/nfs/dbraw/zinc/87/70/01/436877001.db2.gz	BTAZJRLBWRKCOB-ZDUSSCGKSA-N	0	1	338.481	0.195	20	70		ECIDMN
Cc1ccc(S(=O)(=O)N(CCOCCO)CCN(C)C)cc1F	ZINC000161299860	436887711	/nfs/dbraw/zinc/88/77/11/436887711.db2.gz	QXPFBGODPKVDCQ-UHFFFAOYSA-N	0	1	348.440	0.695	20	70		ECIDMN
CNC(=O)[C@@H](NC(=O)CN(C)C[C@@H]1CCC[C@@H]1O)c1ccccc1	ZINC000159480722	529895891	/nfs/dbraw/zinc/89/58/91/529895891.db2.gz	XEKFQTFWJJGVTM-ZOBUZTSGSA-N	0	1	333.432	0.683	20	70		ECIDMN
Cc1cc(C[C@H](C)NC(=O)[C@@H](NS(C)(=O)=O)C(C)(C)C)n[nH]1	ZINC000159698255	225263467	/nfs/dbraw/zinc/26/34/67/225263467.db2.gz	DTBAAMBWANZWME-JOYOIKCWSA-N	0	1	330.454	0.729	20	70		ECIDMN
CCn1ncc(C#N)c1NS(=O)(=O)CCCCS(=O)(=O)F	ZINC000460096347	267260675	/nfs/dbraw/zinc/26/06/75/267260675.db2.gz	ONYWAADSBDYYDC-UHFFFAOYSA-N	0	1	338.386	0.596	20	70		ECIDMN
CC[C@H]1CN(C(=O)c2cnc3c(c2)ncn3C)CCN1C[C@@H](C)O	ZINC000160639670	436874447	/nfs/dbraw/zinc/87/44/47/436874447.db2.gz	GMWRYTKBIOKXHQ-OCCSQVGLSA-N	0	1	331.420	0.886	20	70		ECIDMN
Cc1cc(C[C@H](C)NC(=O)c2coc(S(=O)(=O)N(C)C)c2)n[nH]1	ZINC000160159769	436869312	/nfs/dbraw/zinc/86/93/12/436869312.db2.gz	JMAOWQJYDBIIPN-VIFPVBQESA-N	0	1	340.405	0.922	20	70		ECIDMN
O=C(N[C@H]1CCc2ncnn2C1)N1CCC[C@@H](CN2CCOCC2)C1	ZINC000161194183	436886149	/nfs/dbraw/zinc/88/61/49/436886149.db2.gz	FSOYIDNJJKZCRS-GJZGRUSLSA-N	0	1	348.451	0.347	20	70		ECIDMN
CC(=O)NC[C@@H]1CCCN([C@@H]2CCCN(c3cnn(C)c3)C2=O)C1	ZINC000159733640	526773568	/nfs/dbraw/zinc/77/35/68/526773568.db2.gz	SDTFWMOIKQYQSX-GOEBONIOSA-N	0	1	333.436	0.764	20	70		ECIDMN
Cc1cc(C[C@@H](C)NC(=O)Cn2nnc3ccccc3c2=O)n[nH]1	ZINC000161254191	436888380	/nfs/dbraw/zinc/88/83/80/436888380.db2.gz	RSTNCJKDTPGKKM-SNVBAGLBSA-N	0	1	326.360	0.570	20	70		ECIDMN
COCCN1C[C@H](C(=O)Nc2nc(-c3ccc(C)o3)n[nH]2)CC1=O	ZINC000160283321	225379592	/nfs/dbraw/zinc/37/95/92/225379592.db2.gz	PAMZDVZDCWHJIW-SNVBAGLBSA-N	0	1	333.348	0.807	20	70		ECIDMN
C[C@H](C(=O)N1CCN(c2ncccn2)CC1)N(C)C[C@H](O)C1CC1	ZINC000160744579	545849822	/nfs/dbraw/zinc/84/98/22/545849822.db2.gz	XKXJJZMKUNNIIY-HIFRSBDPSA-N	0	1	333.436	0.216	20	70		ECIDMN
CCc1nn(C)c(Cl)c1C(=O)N1CCN(C(=O)CN(C)C)CC1	ZINC000160070012	529766917	/nfs/dbraw/zinc/76/69/17/529766917.db2.gz	ITSJOVDMGULUFV-UHFFFAOYSA-N	0	1	341.843	0.482	20	70		ECIDMN
C[N-]S(=O)(=O)c1cc(C(=O)N2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)co1	ZINC000159723695	530024929	/nfs/dbraw/zinc/02/49/29/530024929.db2.gz	OCLYWTCPWZTYGL-DGCLKSJQSA-N	0	1	341.433	0.744	20	70		ECIDMN
C[N-]S(=O)(=O)c1cc(C(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)co1	ZINC000159723695	530024930	/nfs/dbraw/zinc/02/49/30/530024930.db2.gz	OCLYWTCPWZTYGL-DGCLKSJQSA-N	0	1	341.433	0.744	20	70		ECIDMN
Cc1ccc(C)c(S(=O)(=O)N(CCOCCO)CCN(C)C)c1	ZINC000161307978	207637195	/nfs/dbraw/zinc/63/71/95/207637195.db2.gz	GLLWZFVQHJXJJQ-UHFFFAOYSA-N	0	1	344.477	0.865	20	70		ECIDMN
Cn1cc(N2CCC[C@H](N3CCC[C@H](CCC(N)=O)C3)C2=O)cn1	ZINC000160334692	225391158	/nfs/dbraw/zinc/39/11/58/225391158.db2.gz	SMMFYIIGDVBGCE-HIFRSBDPSA-N	0	1	333.436	0.893	20	70		ECIDMN
CS(=O)(=O)N1CC[C@H](CNC(=O)c2cccc(-c3nnc[nH]3)c2)C1	ZINC000160123036	225342806	/nfs/dbraw/zinc/34/28/06/225342806.db2.gz	OEGFHPYDUFQFRS-LLVKDONJSA-N	0	1	349.416	0.483	20	70		ECIDMN
COC(=O)[C@@H]1C[C@@H](O)CN1CC1CCN(C(=O)C(C)(C)C)CC1	ZINC000159557694	436861064	/nfs/dbraw/zinc/86/10/64/436861064.db2.gz	HSXLTXHEBVQWCQ-KGLIPLIRSA-N	0	1	326.437	0.879	20	70		ECIDMN
COCCNCC(=O)N[C@@H]1CCN(c2ccc(Cl)cc2)C1=O	ZINC000160400151	436870965	/nfs/dbraw/zinc/87/09/65/436870965.db2.gz	ODLDPXINVFPPDH-CYBMUJFWSA-N	0	1	325.796	0.798	20	70		ECIDMN
CC[C@H](O)CCNC(=O)NCc1ccnc(N2CCN(C)CC2)c1	ZINC000160956747	436881454	/nfs/dbraw/zinc/88/14/54/436881454.db2.gz	AMKKMUZTLMGMEY-HNNXBMFYSA-N	0	1	335.452	0.794	20	70		ECIDMN
Cc1conc1NC(=O)C(=O)N1CCC[C@@H](CN2CCOCC2)C1	ZINC000161163765	436885276	/nfs/dbraw/zinc/88/52/76/436885276.db2.gz	JQMCYSYVMXNYGB-ZDUSSCGKSA-N	0	1	336.392	0.492	20	70		ECIDMN
CC[N@H+]1CCC[C@@H](NC(=O)N2CC[C@H](S(=O)(=O)NC3CC3)C2)C1	ZINC000159736476	436863219	/nfs/dbraw/zinc/86/32/19/436863219.db2.gz	GITWKKAFINCVFB-KGLIPLIRSA-N	0	1	344.481	0.336	20	70		ECIDMN
CCC[C@@H](NC(N)=O)C(=O)NC[C@H]1C[C@@H](O)CN1Cc1ccccc1	ZINC000160660239	436877424	/nfs/dbraw/zinc/87/74/24/436877424.db2.gz	KAMINIUKHATXGG-BZUAXINKSA-N	0	1	348.447	0.575	20	70		ECIDMN
NC(=O)NC(=O)C1CCC(NC(=O)c2[nH]nc3c2CCCC3)CC1	ZINC000160797036	436879873	/nfs/dbraw/zinc/87/98/73/436879873.db2.gz	HECRREYNLKHUOD-UHFFFAOYSA-N	0	1	333.392	0.772	20	70		ECIDMN
CN1CCN(c2ccc(NC(=O)c3cccc(=O)n3C)nc2)CC1	ZINC000159921293	529777832	/nfs/dbraw/zinc/77/78/32/529777832.db2.gz	HHGHLWVWBGQOLP-UHFFFAOYSA-N	0	1	327.388	0.784	20	70		ECIDMN
CNC(=O)[C@H](NC(=O)CN(C)C[C@@H]1CCC[C@@H]1O)c1ccccc1	ZINC000159480606	529918879	/nfs/dbraw/zinc/91/88/79/529918879.db2.gz	XEKFQTFWJJGVTM-YQQAZPJKSA-N	0	1	333.432	0.683	20	70		ECIDMN
COC[C@H](O)CNC(=O)NC1CCN([C@@H](C)c2ccncc2)CC1	ZINC000161201511	285425355	/nfs/dbraw/zinc/42/53/55/285425355.db2.gz	KICKZXZEMVLYPF-XJKSGUPXSA-N	0	1	336.436	0.914	20	70		ECIDMN
Cc1nn(C)c(C)c1-c1cc(C(=O)N2C[C@@H]3OCCN(C)[C@H]3C2)n[nH]1	ZINC000159686058	436860431	/nfs/dbraw/zinc/86/04/31/436860431.db2.gz	AOEBCIAECWBXQY-GJZGRUSLSA-N	0	1	344.419	0.582	20	70		ECIDMN
CCC[C@@H](NC(N)=O)C(=O)NC[C@H]1C[C@H](O)CN1Cc1ccccc1	ZINC000160660010	436878206	/nfs/dbraw/zinc/87/82/06/436878206.db2.gz	KAMINIUKHATXGG-OWCLPIDISA-N	0	1	348.447	0.575	20	70		ECIDMN
C[NH+](C)C[C@](C)(O)C[N-]S(=O)(=O)c1ccc(F)c(F)c1F	ZINC000161447959	436892413	/nfs/dbraw/zinc/89/24/13/436892413.db2.gz	GNEKUQIEOCKWSB-GFCCVEGCSA-N	0	1	326.340	0.695	20	70		ECIDMN
CN1CCN(c2ccc(CNC(=O)N3CCC[C@](C)(O)C3)cn2)CC1	ZINC000160096074	529777210	/nfs/dbraw/zinc/77/72/10/529777210.db2.gz	OSKGXZSONGGRHW-SFHVURJKSA-N	0	1	347.463	0.890	20	70		ECIDMN
CN(CC(=O)N1CCN(C(=O)c2ccco2)CC1)C[C@@H]1CCC[C@@H]1O	ZINC000159597094	436860669	/nfs/dbraw/zinc/86/06/69/436860669.db2.gz	QIIFTRKTAOSTEP-GJZGRUSLSA-N	0	1	349.431	0.657	20	70		ECIDMN
CC(=O)NC[C@@H]1CCC[N@@H+](CCN2C(=O)NC3(CCCC3)C2=O)C1	ZINC000159730995	436864249	/nfs/dbraw/zinc/86/42/49/436864249.db2.gz	XQEKFJGURULLCT-AWEZNQCLSA-N	0	1	336.436	0.699	20	70		ECIDMN
Cn1cc(N2CCC[C@H](N3CCC(n4cncn4)CC3)C2=O)cn1	ZINC000159912239	436865427	/nfs/dbraw/zinc/86/54/27/436865427.db2.gz	GMLVCANTGKIOOB-HNNXBMFYSA-N	0	1	329.408	0.844	20	70		ECIDMN
CC(C)[C@H](CNC(=O)N1CCC[C@@](C)(O)C1)N1CCN(C)CC1	ZINC000160133906	436868781	/nfs/dbraw/zinc/86/87/81/436868781.db2.gz	WXRUSECJCOHMFU-DOTOQJQBSA-N	0	1	326.485	0.815	20	70		ECIDMN
CC[C@@H]1CN(C(=O)c2cnc3c(c2)ncn3C)CCN1C[C@@H](C)O	ZINC000160639553	436875131	/nfs/dbraw/zinc/87/51/31/436875131.db2.gz	GMWRYTKBIOKXHQ-TZMCWYRMSA-N	0	1	331.420	0.886	20	70		ECIDMN
COCc1nc2n(n1)C[C@@H](NC(=O)N1CCN(CC3CC3)CC1)CC2	ZINC000160585862	436876089	/nfs/dbraw/zinc/87/60/89/436876089.db2.gz	GPWREMVMHWGRDS-AWEZNQCLSA-N	0	1	348.451	0.477	20	70		ECIDMN
CC(C)CNS(=O)(=O)c1ccc(C(=O)N2CCNCC2)cc1	ZINC000159399104	528065845	/nfs/dbraw/zinc/06/58/45/528065845.db2.gz	YFDQFEDVGUKXPY-UHFFFAOYSA-N	0	1	325.434	0.666	20	70		ECIDMN
CCn1c(=O)[nH]c2cc(C(=O)N3C[C@H]4CCC[C@@H](C3)N4)ccc2c1=O	ZINC000159763035	436862820	/nfs/dbraw/zinc/86/28/20/436862820.db2.gz	GPVMGQBTPAVOGI-BETUJISGSA-N	0	1	342.399	0.676	20	70		ECIDMN
COC(=O)c1ncsc1S(=O)(=O)NC[C@]1(OC)CCOC1	ZINC000160014595	436865333	/nfs/dbraw/zinc/86/53/33/436865333.db2.gz	YLAJBWDKZUPIGD-LLVKDONJSA-N	0	1	336.391	0.014	20	70		ECIDMN
Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)N1C[C@H]2CCC[C@@H](C1)N2	ZINC000160296142	436871789	/nfs/dbraw/zinc/87/17/89/436871789.db2.gz	CEPQHCBCZVVCCX-TXEJJXNPSA-N	0	1	341.433	0.805	20	70		ECIDMN
Cc1cc(C[C@@H](C)NC(=O)Cc2c(C)nc3cc(=O)[nH]n3c2C)n[nH]1	ZINC000161157517	436885296	/nfs/dbraw/zinc/88/52/96/436885296.db2.gz	NAEFBECVCNFQAA-SECBINFHSA-N	0	1	342.403	0.961	20	70		ECIDMN
C[N-]S(=O)(=O)c1cc(C(=O)NC2CC[NH+](C3CC3)CC2)co1	ZINC000161294425	436888264	/nfs/dbraw/zinc/88/82/64/436888264.db2.gz	SWRIISUZCBIEGH-UHFFFAOYSA-N	0	1	327.406	0.544	20	70		ECIDMN
CC[C@@H](C(=O)Nc1ncn(CC(=O)N2CCCCCC2)n1)N(C)C	ZINC000160926384	436880637	/nfs/dbraw/zinc/88/06/37/436880637.db2.gz	WSUBTUGOUBKNKE-ZDUSSCGKSA-N	0	1	336.440	0.959	20	70		ECIDMN
Cc1cc(C[C@H](C)NC(=O)CCCN2C(=O)NC(C)(C)C2=O)n[nH]1	ZINC000161236017	436885106	/nfs/dbraw/zinc/88/51/06/436885106.db2.gz	ACCZZCPGVBFBPW-JTQLQIEISA-N	0	1	335.408	0.876	20	70		ECIDMN
Cc1cc(C[C@H](C)NC(=O)Cc2c(C)nc3cc(=O)[nH]n3c2C)n[nH]1	ZINC000161157662	436885816	/nfs/dbraw/zinc/88/58/16/436885816.db2.gz	NAEFBECVCNFQAA-VIFPVBQESA-N	0	1	342.403	0.961	20	70		ECIDMN
CN(C)CCN(CCOCCO)S(=O)(=O)c1ccc(F)cc1	ZINC000161300822	436887266	/nfs/dbraw/zinc/88/72/66/436887266.db2.gz	FOZFOJCXAYTRLZ-UHFFFAOYSA-N	0	1	334.413	0.387	20	70		ECIDMN
Cc1cc(C[C@H](C)NC(=O)Cn2nnc3ccccc3c2=O)n[nH]1	ZINC000161254309	436888169	/nfs/dbraw/zinc/88/81/69/436888169.db2.gz	RSTNCJKDTPGKKM-JTQLQIEISA-N	0	1	326.360	0.570	20	70		ECIDMN
Cc1ccc(F)cc1S(=O)(=O)N(CCOCCO)CCN(C)C	ZINC000161303724	436888355	/nfs/dbraw/zinc/88/83/55/436888355.db2.gz	AQWREISFOFCBHN-UHFFFAOYSA-N	0	1	348.440	0.695	20	70		ECIDMN
CN1CCN(c2ccc(CNC(=O)N3CCC[C@@](C)(O)C3)cn2)CC1	ZINC000160096181	529777074	/nfs/dbraw/zinc/77/70/74/529777074.db2.gz	OSKGXZSONGGRHW-GOSISDBHSA-N	0	1	347.463	0.890	20	70		ECIDMN
CN(CC(=O)N1CCN(C(=O)c2ccco2)CC1)C[C@H]1CCC[C@@H]1O	ZINC000159597234	436860086	/nfs/dbraw/zinc/86/00/86/436860086.db2.gz	QIIFTRKTAOSTEP-CABCVRRESA-N	0	1	349.431	0.657	20	70		ECIDMN
O=C(NCC(=O)N1C[C@H]2CCC[C@@H](C1)N2)NCc1ccc(F)cc1	ZINC000160061033	436867394	/nfs/dbraw/zinc/86/73/94/436867394.db2.gz	OFEDGFPYTWEASB-GASCZTMLSA-N	0	1	334.395	0.978	20	70		ECIDMN
C[C@H](NCC(=O)NCC(F)(F)F)c1ccc(-n2cnnn2)cc1	ZINC000160609274	436875840	/nfs/dbraw/zinc/87/58/40/436875840.db2.gz	XKIRYRVWWDDEFE-VIFPVBQESA-N	0	1	328.298	0.991	20	70		ECIDMN
Cc1cc(C[C@@H](C)NC(=O)CN2C(=O)NC3(CCCC3)C2=O)n[nH]1	ZINC000161339127	436887121	/nfs/dbraw/zinc/88/71/21/436887121.db2.gz	FSJPUMGHXQWEPQ-SNVBAGLBSA-N	0	1	333.392	0.630	20	70		ECIDMN
Cc1ccc(S(=O)(=O)N(CCOCCO)CCN(C)C)cc1C	ZINC000161307681	436887617	/nfs/dbraw/zinc/88/76/17/436887617.db2.gz	NBTSOHYUUWRGFZ-UHFFFAOYSA-N	0	1	344.477	0.865	20	70		ECIDMN
Cc1ccccc1S(=O)(=O)N(CCOCCO)CCN(C)C	ZINC000161303171	436887830	/nfs/dbraw/zinc/88/78/30/436887830.db2.gz	AGTQVSACUCWHJQ-UHFFFAOYSA-N	0	1	330.450	0.556	20	70		ECIDMN
COc1ccccc1N1CC[C@@H](NC(=O)CCc2nc[nH]n2)C1=O	ZINC000161366750	436889405	/nfs/dbraw/zinc/88/94/05/436889405.db2.gz	WXKWUXUJDVPQOL-LLVKDONJSA-N	0	1	329.360	0.668	20	70		ECIDMN
NS(=O)(=O)c1ccc(CCC(=O)N2C[C@H]3CCC[C@@H](C2)N3)cc1	ZINC000159557599	545848151	/nfs/dbraw/zinc/84/81/51/545848151.db2.gz	ADOXBDRVIZTKLH-OKILXGFUSA-N	0	1	337.445	0.620	20	70		ECIDMN
Cc1cc(C[C@@H](C)NC(=O)CCCS(=O)(=O)N2CCCC2)n[nH]1	ZINC000161210961	225575927	/nfs/dbraw/zinc/57/59/27/225575927.db2.gz	LLOMOHPRWQRDKK-GFCCVEGCSA-N	0	1	342.465	0.971	20	70		ECIDMN
CCOC(=O)C1CCN(C(=O)CN(C)C[C@@H]2CCC[C@@H]2O)CC1	ZINC000159466119	436857481	/nfs/dbraw/zinc/85/74/81/436857481.db2.gz	RZCHEYKLTTUSMD-GJZGRUSLSA-N	0	1	326.437	0.881	20	70		ECIDMN
COCc1nc2n(n1)C[C@H](NC(=O)N1CCN3CCCC[C@@H]3C1)CC2	ZINC000160593593	436875981	/nfs/dbraw/zinc/87/59/81/436875981.db2.gz	HNXRTYFHAQLPQH-ZIAGYGMSSA-N	0	1	348.451	0.619	20	70		ECIDMN
CCc1noc(C)c1NC(=O)C(=O)NC[C@@H]1CCCN1CCOC	ZINC000160670951	436878132	/nfs/dbraw/zinc/87/81/32/436878132.db2.gz	NRZSCRVHLUOXSV-LBPRGKRZSA-N	0	1	338.408	0.711	20	70		ECIDMN
CCCS(=O)(=O)N1CCC[C@H]1C(=O)N[C@@H](C)Cc1cc(C)[nH]n1	ZINC000161125964	436883841	/nfs/dbraw/zinc/88/38/41/436883841.db2.gz	CPJSKLSPAYFKLA-FZMZJTMJSA-N	0	1	342.465	0.970	20	70		ECIDMN
CCC(CC)(CNC(=O)N[C@H](C)CN1CCN(C)CC1)C(=O)OC	ZINC000159856902	282106790	/nfs/dbraw/zinc/10/67/90/282106790.db2.gz	OYOVPADUPUFQDB-CQSZACIVSA-N	0	1	342.484	0.901	20	70		ECIDMN
Cc1ccc(NC(=O)C(=O)NC[C@@H](C(C)C)N2CCN(C)CC2)cn1	ZINC000159940147	436866339	/nfs/dbraw/zinc/86/63/39/436866339.db2.gz	AZUOPNIITJBPTH-INIZCTEOSA-N	0	1	347.463	0.717	20	70		ECIDMN
COC(=O)c1[nH]c(C)c(C(=O)NC[C@H](C)N2CCN(C)CC2)c1C	ZINC000160509623	436872824	/nfs/dbraw/zinc/87/28/24/436872824.db2.gz	IBZZOIQKBONHHX-NSHDSACASA-N	0	1	336.436	0.784	20	70		ECIDMN
NC(=O)NC1(C(=O)NCCCN2CCN(c3ccccc3)CC2)CC1	ZINC000160123375	534390300	/nfs/dbraw/zinc/39/03/00/534390300.db2.gz	BZVFJACYGUQYFW-UHFFFAOYSA-N	0	1	345.447	0.516	20	70		ECIDMN
Cc1nc2ccccn2c1CN1CCC[C@@H](CNS(N)(=O)=O)C1	ZINC000159588659	436860581	/nfs/dbraw/zinc/86/05/81/436860581.db2.gz	NKMFAIFHLQSWBV-ZDUSSCGKSA-N	0	1	337.449	0.648	20	70		ECIDMN
CN(CC(=O)Nc1cc(-n2cnnn2)ccc1F)C[C@@H]1CCC[C@@H]1O	ZINC000159572693	436860017	/nfs/dbraw/zinc/86/00/17/436860017.db2.gz	UADKZRWBNNDITL-NHYWBVRUSA-N	0	1	348.382	0.833	20	70		ECIDMN
CC(=O)NC[C@H]1CCC[N@@H+](CCN2C(=O)NC3(CCCC3)C2=O)C1	ZINC000159731137	436862492	/nfs/dbraw/zinc/86/24/92/436862492.db2.gz	XQEKFJGURULLCT-CQSZACIVSA-N	0	1	336.436	0.699	20	70		ECIDMN
O=C(CNS(=O)(=O)c1cccs1)N1C[C@H]2CCC[C@@H](C1)N2	ZINC000160040179	436864880	/nfs/dbraw/zinc/86/48/80/436864880.db2.gz	PEPMXXKZWAPZCP-PHIMTYICSA-N	0	1	329.447	0.379	20	70		ECIDMN
Cn1cc(NC(=O)C(=O)N2CCC[C@@H](c3n[nH]c(C4CC4)n3)C2)cn1	ZINC000160408111	436871594	/nfs/dbraw/zinc/87/15/94/436871594.db2.gz	QBBITWBAAXYABS-LLVKDONJSA-N	0	1	343.391	0.760	20	70		ECIDMN
COC(=O)c1[nH]c(C)c(C(=O)NC[C@@H](C)N2CCN(C)CC2)c1C	ZINC000160509505	436872140	/nfs/dbraw/zinc/87/21/40/436872140.db2.gz	IBZZOIQKBONHHX-LLVKDONJSA-N	0	1	336.436	0.784	20	70		ECIDMN
O=C(CCS(=O)(=O)C1CCCC1)NCC1CCN(CCO)CC1	ZINC000160723190	436878304	/nfs/dbraw/zinc/87/83/04/436878304.db2.gz	CDTUMSLAAMWOMW-UHFFFAOYSA-N	0	1	346.493	0.554	20	70		ECIDMN
Cc1cc(C(=O)NCc2cccnc2N2CCN(C)CC2)ncn1	ZINC000160788125	436878975	/nfs/dbraw/zinc/87/89/75/436878975.db2.gz	GRFOUCDVJYRMSL-UHFFFAOYSA-N	0	1	326.404	0.862	20	70		ECIDMN
Cc1ccc(NC(=O)C(=O)N2CCC(CN3CCOCC3)CC2)cn1	ZINC000160886114	436879413	/nfs/dbraw/zinc/87/94/13/436879413.db2.gz	VSQQQNFRKLPXSF-UHFFFAOYSA-N	0	1	346.431	0.899	20	70		ECIDMN
Cn1ccnc1-c1cc(NC(=O)CS(=O)(=O)C(C)(C)C)[nH]n1	ZINC000160896202	436881682	/nfs/dbraw/zinc/88/16/82/436881682.db2.gz	ULUZGUJDBMNWDI-UHFFFAOYSA-N	0	1	325.394	0.962	20	70		ECIDMN
COCCOc1cccc(CC(=O)NCCN2CCN(C)CC2)c1	ZINC000161176287	436885960	/nfs/dbraw/zinc/88/59/60/436885960.db2.gz	OSEGQGRILFDMOC-UHFFFAOYSA-N	0	1	335.448	0.618	20	70		ECIDMN
CNS(=O)(=O)c1ccc(C(=O)N[C@H](C)Cc2cc(C)[nH]n2)cc1	ZINC000161365048	436890330	/nfs/dbraw/zinc/89/03/30/436890330.db2.gz	LUYSFDALWSNSJD-SNVBAGLBSA-N	0	1	336.417	0.987	20	70		ECIDMN
Cc1cc(C[C@H](C)NC(=O)[C@H](NS(C)(=O)=O)C(C)(C)C)n[nH]1	ZINC000159697991	225262347	/nfs/dbraw/zinc/26/23/47/225262347.db2.gz	DTBAAMBWANZWME-CABZTGNLSA-N	0	1	330.454	0.729	20	70		ECIDMN
Cc1cc(C[C@@H](C)NC(=O)[C@@H](NS(C)(=O)=O)C(C)(C)C)n[nH]1	ZINC000159698123	225263173	/nfs/dbraw/zinc/26/31/73/225263173.db2.gz	DTBAAMBWANZWME-BXKDBHETSA-N	0	1	330.454	0.729	20	70		ECIDMN
Cn1c2cc(C(=O)N3CCN(C4CCOCC4)CC3)ccc2[nH]c1=O	ZINC000160252455	225370803	/nfs/dbraw/zinc/37/08/03/225370803.db2.gz	LQVMIGNYZPYIIA-UHFFFAOYSA-N	0	1	344.415	0.803	20	70		ECIDMN
CCC[C@@H](NC(N)=O)C(=O)NC[C@@H]1C[C@H](O)CN1Cc1ccccc1	ZINC000160659898	276025298	/nfs/dbraw/zinc/02/52/98/276025298.db2.gz	KAMINIUKHATXGG-HRCADAONSA-N	0	1	348.447	0.575	20	70		ECIDMN
CNS(=O)(=O)[C@@H]1CCN(C(=O)c2cccc(-c3nnc[nH]3)c2)C1	ZINC000159609025	436861888	/nfs/dbraw/zinc/86/18/88/436861888.db2.gz	UUOOZNAOODLNPZ-GFCCVEGCSA-N	0	1	335.389	0.235	20	70		ECIDMN
CCN(CCCNC(=O)N1CCC[N@@H+](CC)CC1)S(C)(=O)=O	ZINC000159718598	436862677	/nfs/dbraw/zinc/86/26/77/436862677.db2.gz	WXKLTXSEKCEABF-UHFFFAOYSA-N	0	1	334.486	0.395	20	70		ECIDMN
CS(=O)(=O)N1CCc2cc(C(=O)N3C[C@H]4CCC[C@@H](C3)N4)ccc21	ZINC000159794009	436863567	/nfs/dbraw/zinc/86/35/67/436863567.db2.gz	NBWYEIDXCZYWSO-GASCZTMLSA-N	0	1	349.456	0.975	20	70		ECIDMN
CCN1CCN(CC(=O)NCc2nc3cccc(C)c3[nH]2)C(=O)C1=O	ZINC000160305920	436871421	/nfs/dbraw/zinc/87/14/21/436871421.db2.gz	RSLVUGGCQRIPSY-UHFFFAOYSA-N	0	1	343.387	0.178	20	70		ECIDMN
C[C@H]1CN(C2CCN(C(=O)N[C@@H]3CCc4ncnn4C3)CC2)CCO1	ZINC000160970188	436880977	/nfs/dbraw/zinc/88/09/77/436880977.db2.gz	NHGXZWAGXLLZLE-UONOGXRCSA-N	0	1	348.451	0.488	20	70		ECIDMN
Cc1cc(C[C@H](C)NC(=O)Cc2ccc(-n3cnnn3)cc2)n[nH]1	ZINC000161345741	436889980	/nfs/dbraw/zinc/88/99/80/436889980.db2.gz	KQAMXRNSIZLTDI-NSHDSACASA-N	0	1	325.376	0.984	20	70		ECIDMN
CS(=O)(=O)N[C@@H]1CCCN(C(=O)c2cccc(-c3nnc[nH]3)c2)C1	ZINC000160320104	545849595	/nfs/dbraw/zinc/84/95/95/545849595.db2.gz	BXVNUUFDBHCDFF-CYBMUJFWSA-N	0	1	349.416	0.626	20	70		ECIDMN
CS(=O)(=O)N[C@@H]1CCC[C@@H]1CNC(=O)c1[nH]nc2c1CCCC2	ZINC000160683949	545850312	/nfs/dbraw/zinc/85/03/12/545850312.db2.gz	JTZQSGPWMLOPLQ-ZYHUDNBSSA-N	0	1	340.449	0.736	20	70		ECIDMN
CC(C)(O)CN1CCN(C(=O)CN2CCCCCCC2=O)CC1	ZINC000216956136	165086617	/nfs/dbraw/zinc/08/66/17/165086617.db2.gz	QUCRBOSFMSCWNZ-UHFFFAOYSA-N	0	1	325.453	0.694	20	70		ECIDMN
CN(CC(=O)Nc1cc(-n2cnnn2)ccc1F)C[C@H]1CCC[C@@H]1O	ZINC000159572834	436861141	/nfs/dbraw/zinc/86/11/41/436861141.db2.gz	UADKZRWBNNDITL-ABAIWWIYSA-N	0	1	348.382	0.833	20	70		ECIDMN
CCc1nc(CN(C[C@@H]2CCCO2)[C@@H]2CCS(=O)(=O)C2)n[nH]1	ZINC000159583164	436861244	/nfs/dbraw/zinc/86/12/44/436861244.db2.gz	HWYJDLMPNXKMGG-NEPJUHHUSA-N	0	1	328.438	0.535	20	70		ECIDMN
CN(C)C(=O)CCCC(=O)NC[C@H]1C[C@@H](O)CN1Cc1ccccc1	ZINC000160506388	436873802	/nfs/dbraw/zinc/87/38/02/436873802.db2.gz	RLNGZZIMQBDDLW-IAGOWNOFSA-N	0	1	347.459	0.997	20	70		ECIDMN
CCOC(=O)[C@@H]1CCCN(C(=O)[C@@H](C)N(C)C[C@H](O)C2CC2)C1	ZINC000160815591	436879336	/nfs/dbraw/zinc/87/93/36/436879336.db2.gz	QODGVVKVJQYZGD-YUELXQCFSA-N	0	1	326.437	0.879	20	70		ECIDMN
CN(C(=O)N[C@@H]1CCN(C2CCCC2)C1)[C@H]1CCS(=O)(=O)C1	ZINC000160905569	436881957	/nfs/dbraw/zinc/88/19/57/436881957.db2.gz	YPSTXBHJJOIQBN-OCCSQVGLSA-N	0	1	329.466	0.832	20	70		ECIDMN
CC[NH2+]CC1CCN(C(=O)c2ccc(S(=O)(=O)[N-]C)o2)CC1	ZINC000161140349	436885002	/nfs/dbraw/zinc/88/50/02/436885002.db2.gz	ZXKOJMGXBNNXEU-UHFFFAOYSA-N	0	1	329.422	0.649	20	70		ECIDMN
COC(CN1CCCN(Cc2nc([C@H](C)OC)no2)CC1)OC	ZINC000161446375	436892354	/nfs/dbraw/zinc/89/23/54/436892354.db2.gz	LOYXRWHSCNJFAA-LBPRGKRZSA-N	0	1	328.413	0.904	20	70		ECIDMN
CN1CCN(c2cc(CNC(=O)N3CCC[C@@](C)(O)C3)ccn2)CC1	ZINC000160222718	529776963	/nfs/dbraw/zinc/77/69/63/529776963.db2.gz	TXMORGYBHCXAFX-GOSISDBHSA-N	0	1	347.463	0.890	20	70		ECIDMN
C[C@@H](CNC(=O)N(C)CC1CCOCC1)CN1CC[NH+](C)CC1	ZINC000159746674	436862917	/nfs/dbraw/zinc/86/29/17/436862917.db2.gz	LJWUBYRPXSXFBY-HNNXBMFYSA-N	0	1	326.485	0.938	20	70		ECIDMN
CC1CCC(NS(=O)(=O)CC(=O)N2C[C@H]3CCC[C@@H](C2)N3)CC1	ZINC000160250080	436868549	/nfs/dbraw/zinc/86/85/49/436868549.db2.gz	YUTWEHZVDBVHCJ-ZMYVRHLSSA-N	0	1	343.493	0.837	20	70		ECIDMN
CN(C(=O)N[C@H]1CCN(C2CCCC2)C1)[C@H]1CCS(=O)(=O)C1	ZINC000160905815	436881106	/nfs/dbraw/zinc/88/11/06/436881106.db2.gz	YPSTXBHJJOIQBN-JSGCOSHPSA-N	0	1	329.466	0.832	20	70		ECIDMN
Cc1cc(C[C@H](C)NC(=O)CCCS(=O)(=O)N2CCCC2)n[nH]1	ZINC000161211079	436885803	/nfs/dbraw/zinc/88/58/03/436885803.db2.gz	LLOMOHPRWQRDKK-LBPRGKRZSA-N	0	1	342.465	0.971	20	70		ECIDMN
CCn1cnnc1[C@H]1CCCN(CCn2nc3ccccn3c2=O)C1	ZINC000161273275	436887504	/nfs/dbraw/zinc/88/75/04/436887504.db2.gz	HMJWCEUYHOWEPM-AWEZNQCLSA-N	0	1	341.419	0.987	20	70		ECIDMN
Cc1cc(C[C@@H](C)NC(=O)c2ccc(CNS(C)(=O)=O)o2)n[nH]1	ZINC000161303093	436888219	/nfs/dbraw/zinc/88/82/19/436888219.db2.gz	HWRFRINBZQONBS-SECBINFHSA-N	0	1	340.405	0.721	20	70		ECIDMN
CCn1cnnc1[C@@H]1CCCN(CCn2nc3ccccn3c2=O)C1	ZINC000161273145	436888318	/nfs/dbraw/zinc/88/83/18/436888318.db2.gz	HMJWCEUYHOWEPM-CQSZACIVSA-N	0	1	341.419	0.987	20	70		ECIDMN
C[N-]S(=O)(=O)c1cc(C(=O)N2CCC[C@@H]3C[N@H+](C)CC[C@@H]32)co1	ZINC000160380162	530025145	/nfs/dbraw/zinc/02/51/45/530025145.db2.gz	LVFFIDZUIMXABW-YPMHNXCESA-N	0	1	341.433	0.744	20	70		ECIDMN
C[N-]S(=O)(=O)c1cc(C(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)co1	ZINC000160380162	530025147	/nfs/dbraw/zinc/02/51/47/530025147.db2.gz	LVFFIDZUIMXABW-YPMHNXCESA-N	0	1	341.433	0.744	20	70		ECIDMN
COC(=O)Cn1cc(CCN2CCN(c3ccccc3)CC2)nn1	ZINC000160566097	436875393	/nfs/dbraw/zinc/87/53/93/436875393.db2.gz	XGOVLBTXPVDVAH-UHFFFAOYSA-N	0	1	329.404	0.816	20	70		ECIDMN
CNS(=O)(=O)c1ccc(C(=O)N[C@@H](C)Cc2cc(C)[nH]n2)o1	ZINC000161138949	436886202	/nfs/dbraw/zinc/88/62/02/436886202.db2.gz	QRVLLUCWICQMDV-QMMMGPOBSA-N	0	1	326.378	0.580	20	70		ECIDMN
Cc1cc(C[C@@H](C)NC(=O)CNC(=O)COc2ccccc2)n[nH]1	ZINC000161335355	436886877	/nfs/dbraw/zinc/88/68/77/436886877.db2.gz	MIEUSAUTEZUMPM-GFCCVEGCSA-N	0	1	330.388	0.961	20	70		ECIDMN
C[N-]S(=O)(=O)c1cc(C(=O)N2CCC[C@@H]3C[N@H+](C)CC[C@H]32)co1	ZINC000160380346	206294785	/nfs/dbraw/zinc/29/47/85/206294785.db2.gz	LVFFIDZUIMXABW-DGCLKSJQSA-N	0	1	341.433	0.744	20	70		ECIDMN
C[N-]S(=O)(=O)c1cc(C(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)co1	ZINC000160380346	206294789	/nfs/dbraw/zinc/29/47/89/206294789.db2.gz	LVFFIDZUIMXABW-DGCLKSJQSA-N	0	1	341.433	0.744	20	70		ECIDMN
CNS(=O)(=O)c1ccc(C(=O)N[C@@H](C)Cc2cc(C)[nH]n2)cc1	ZINC000161365166	206344363	/nfs/dbraw/zinc/34/43/63/206344363.db2.gz	LUYSFDALWSNSJD-JTQLQIEISA-N	0	1	336.417	0.987	20	70		ECIDMN
C[C@H](C(=O)N(C)CC(=O)NC1CC1)N1CC[C@]2(O)CCCC[C@@H]2C1	ZINC000160943902	279184609	/nfs/dbraw/zinc/18/46/09/279184609.db2.gz	JZBGQXBYHHNGDB-HBUWYVDXSA-N	0	1	337.464	0.739	20	70		ECIDMN
CCC[NH+]1CCC(NC(=O)c2coc(S(=O)(=O)[N-]C)c2)CC1	ZINC000159749597	436862421	/nfs/dbraw/zinc/86/24/21/436862421.db2.gz	LRQFPCLEIWDIQB-UHFFFAOYSA-N	0	1	329.422	0.792	20	70		ECIDMN
CC(C)[C@@H](CNC(=O)N1CCC[C@](C)(O)C1)N1CCN(C)CC1	ZINC000160134025	436868407	/nfs/dbraw/zinc/86/84/07/436868407.db2.gz	WXRUSECJCOHMFU-WBVHZDCISA-N	0	1	326.485	0.815	20	70		ECIDMN
CCCN1CCN(C(=O)Cc2cccc(OCC(=O)NC)c2)CC1	ZINC000161166759	436884764	/nfs/dbraw/zinc/88/47/64/436884764.db2.gz	BVJSDUZTMYAPGE-UHFFFAOYSA-N	0	1	333.432	0.908	20	70		ECIDMN
C[C@@H](O)CN(C)[C@@H](C)C(=O)NCC(=O)Nc1ccc(F)c(F)c1F	ZINC000159391264	206242389	/nfs/dbraw/zinc/24/23/89/206242389.db2.gz	XRNUKHTXJCLWFM-BDAKNGLRSA-N	0	1	347.337	0.860	20	70		ECIDMN
NC(=O)[C@H]1CC[C@@H](CNC(=O)[C@H]2CCCN2Cc2ccccc2)O1	ZINC000160912618	206318761	/nfs/dbraw/zinc/31/87/61/206318761.db2.gz	NTZHLLMIMGZEOG-ARFHVFGLSA-N	0	1	331.416	0.800	20	70		ECIDMN
COC(=O)c1ncsc1S(=O)(=O)NC[C@@]1(OC)CCOC1	ZINC000160014735	292037297	/nfs/dbraw/zinc/03/72/97/292037297.db2.gz	YLAJBWDKZUPIGD-NSHDSACASA-N	0	1	336.391	0.014	20	70		ECIDMN
Cc1ccc2c(c1)C(=O)N(CC(=O)N1C[C@H]3CCC[C@@H](C1)N3)C2=O	ZINC000159555459	436860276	/nfs/dbraw/zinc/86/02/76/436860276.db2.gz	UUQAEJOKZLRQCE-BETUJISGSA-N	0	1	327.384	0.944	20	70		ECIDMN
COCc1nc2n(n1)C[C@H](NC(=O)N1CCN(CC3CC3)CC1)CC2	ZINC000160585736	436874596	/nfs/dbraw/zinc/87/45/96/436874596.db2.gz	GPWREMVMHWGRDS-CQSZACIVSA-N	0	1	348.451	0.477	20	70		ECIDMN
CC[N@H+]1CCC[C@H](NC(=O)N2CC[C@H](S(=O)(=O)NC3CC3)C2)C1	ZINC000159736318	436862773	/nfs/dbraw/zinc/86/27/73/436862773.db2.gz	GITWKKAFINCVFB-KBPBESRZSA-N	0	1	344.481	0.336	20	70		ECIDMN
O=C(CNC1=NS(=O)(=O)c2ccccc21)N1C[C@H]2CCC[C@@H](C1)N2	ZINC000160109890	436868900	/nfs/dbraw/zinc/86/89/00/436868900.db2.gz	KDIATQSXCQPVSR-TXEJJXNPSA-N	0	1	348.428	0.078	20	70		ECIDMN
CN(C)C(=O)CCCC(=O)NC[C@@H]1C[C@H](O)CN1Cc1ccccc1	ZINC000160505967	436873646	/nfs/dbraw/zinc/87/36/46/436873646.db2.gz	RLNGZZIMQBDDLW-IRXDYDNUSA-N	0	1	347.459	0.997	20	70		ECIDMN
CCC[C@@H]1CN(C(=O)NCCC(=O)N(C)C)CCN1CCOC	ZINC000160503725	436873725	/nfs/dbraw/zinc/87/37/25/436873725.db2.gz	KKQMXXLVUGOBPU-CQSZACIVSA-N	0	1	328.457	0.607	20	70		ECIDMN
Cc1nc(CN2CCN(C(=O)CN3CCCCCCC3=O)CC2)n[nH]1	ZINC000217234852	545920816	/nfs/dbraw/zinc/92/08/16/545920816.db2.gz	RNHNKQYFZPYIHD-UHFFFAOYSA-N	0	1	348.451	0.550	20	70		ECIDMN
COCCN(C)CCCNC(=O)c1cc(S(C)(=O)=O)cs1	ZINC000160343086	206291915	/nfs/dbraw/zinc/29/19/15/206291915.db2.gz	ONSSBARXJFZCQO-UHFFFAOYSA-N	0	1	334.463	0.850	20	70		ECIDMN
CN1CCN(c2ncccc2CNC(=O)N2CCC[C@@](C)(O)C2)CC1	ZINC000161131062	206329286	/nfs/dbraw/zinc/32/92/86/206329286.db2.gz	FKAWJPCOHDYAHM-GOSISDBHSA-N	0	1	347.463	0.890	20	70		ECIDMN
Cc1cc(C[C@H](C)NC(=O)CN2C(=O)NC3(CCCC3)C2=O)n[nH]1	ZINC000161339246	206341883	/nfs/dbraw/zinc/34/18/83/206341883.db2.gz	FSJPUMGHXQWEPQ-JTQLQIEISA-N	0	1	333.392	0.630	20	70		ECIDMN
CCN(C1CCN(C(=O)[C@H](N)c2ccccc2)CC1)S(C)(=O)=O	ZINC000159531195	436858288	/nfs/dbraw/zinc/85/82/88/436858288.db2.gz	NBXMQTFMOUBOOK-OAHLLOKOSA-N	0	1	339.461	0.959	20	70		ECIDMN
O=C(c1ccc(C[C@@H]2CC(=O)NC2=O)cc1)N1C[C@H]2CCC[C@@H](C1)N2	ZINC000159657224	436860750	/nfs/dbraw/zinc/86/07/50/436860750.db2.gz	LLMHCUWBLWKSGX-OAGGEKHMSA-N	0	1	341.411	0.858	20	70		ECIDMN
O=C(CCn1[nH]c(=O)c2ccccc2c1=O)N1C[C@H]2CCC[C@@H](C1)N2	ZINC000160706908	436877582	/nfs/dbraw/zinc/87/75/82/436877582.db2.gz	OYXAOVCALDIIEQ-BETUJISGSA-N	0	1	342.399	0.433	20	70		ECIDMN
Cc1cc(C[C@@H](C)NC(=O)[C@H]2CCCN(S(C)(=O)=O)C2)n[nH]1	ZINC000161230615	436885136	/nfs/dbraw/zinc/88/51/36/436885136.db2.gz	VPHSVHRQNJEWJE-PWSUYJOCSA-N	0	1	328.438	0.437	20	70		ECIDMN
C[C@@H](C(=O)N1C[C@H]2CCC[C@@H](C1)N2)N1C(=O)NC2(CCCC2)C1=O	ZINC000160646744	295756424	/nfs/dbraw/zinc/75/64/24/295756424.db2.gz	UCBLLUPLKHYGRA-RWMBFGLXSA-N	0	1	334.420	0.592	20	70		ECIDMN
Cn1c2cccc(C(=O)NCCCCN3CCOCC3)c2oc1=O	ZINC000159495381	206248878	/nfs/dbraw/zinc/24/88/78/206248878.db2.gz	DBPCKOZMCNAEOJ-UHFFFAOYSA-N	0	1	333.388	0.974	20	70		ECIDMN
C[N-]S(=O)(=O)c1cc(C(=O)N2CC[C@@H]3[C@@H](CCC[N@@H+]3C)C2)co1	ZINC000159723980	206260741	/nfs/dbraw/zinc/26/07/41/206260741.db2.gz	OCLYWTCPWZTYGL-WCQYABFASA-N	0	1	341.433	0.744	20	70		ECIDMN
C[N-]S(=O)(=O)c1cc(C(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)co1	ZINC000159723980	206260744	/nfs/dbraw/zinc/26/07/44/206260744.db2.gz	OCLYWTCPWZTYGL-WCQYABFASA-N	0	1	341.433	0.744	20	70		ECIDMN
C[N-]S(=O)(=O)c1cc(C(=O)N2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)co1	ZINC000159723831	206261056	/nfs/dbraw/zinc/26/10/56/206261056.db2.gz	OCLYWTCPWZTYGL-YPMHNXCESA-N	0	1	341.433	0.744	20	70		ECIDMN
C[N-]S(=O)(=O)c1cc(C(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)co1	ZINC000159723831	206261061	/nfs/dbraw/zinc/26/10/61/206261061.db2.gz	OCLYWTCPWZTYGL-YPMHNXCESA-N	0	1	341.433	0.744	20	70		ECIDMN
CN(C)CC(=O)N1CCN(C(=O)c2cccc(-c3nc[nH]n3)c2)CC1	ZINC000160070799	206277930	/nfs/dbraw/zinc/27/79/30/206277930.db2.gz	BUKWTXBBRHHCSE-UHFFFAOYSA-N	0	1	342.403	0.318	20	70		ECIDMN
Cc1n[nH]c(C(C)C)c1C(=O)N1CCCN(S(C)(=O)=O)CC1	ZINC000159630614	436861994	/nfs/dbraw/zinc/86/19/94/436861994.db2.gz	ZXEPZEDXVRBCNI-UHFFFAOYSA-N	0	1	328.438	0.949	20	70		ECIDMN
C[C@H](NS(=O)(=O)c1ccccc1)C(=O)N1C[C@H]2CCC[C@@H](C1)N2	ZINC000159824678	436863746	/nfs/dbraw/zinc/86/37/46/436863746.db2.gz	VNEYKCZLEPBXGE-MELADBBJSA-N	0	1	337.445	0.706	20	70		ECIDMN
CN(C(=O)N[C@@H]1CCN(C2CCCC2)C1)[C@@H]1CCS(=O)(=O)C1	ZINC000160905436	436880737	/nfs/dbraw/zinc/88/07/37/436880737.db2.gz	YPSTXBHJJOIQBN-TZMCWYRMSA-N	0	1	329.466	0.832	20	70		ECIDMN
Cc1ccc(F)c(S(=O)(=O)N(CCOCCO)CCN(C)C)c1	ZINC000161305724	436887048	/nfs/dbraw/zinc/88/70/48/436887048.db2.gz	JRAHIHBBIVAJGZ-UHFFFAOYSA-N	0	1	348.440	0.695	20	70		ECIDMN
O=C(NCCN1CCN(Cc2ccccc2)CC1)[C@@H]1CCCNC1=O	ZINC000216631495	545919305	/nfs/dbraw/zinc/91/93/05/545919305.db2.gz	XSGOANQVTSROGX-QGZVFWFLSA-N	0	1	344.459	0.447	20	70		ECIDMN
Cc1ccc(-c2n[nH]c(NC(=O)c3cn(CC(=O)N(C)C)nn3)n2)o1	ZINC000160215500	206285057	/nfs/dbraw/zinc/28/50/57/206285057.db2.gz	LMJOXJGXQJVYGZ-UHFFFAOYSA-N	0	1	344.335	0.305	20	70		ECIDMN
C[C@@H](NCC(=O)NCC(F)(F)F)c1ccc(-n2cnnn2)cc1	ZINC000160609400	206306045	/nfs/dbraw/zinc/30/60/45/206306045.db2.gz	XKIRYRVWWDDEFE-SECBINFHSA-N	0	1	328.298	0.991	20	70		ECIDMN
CCc1nc(CN(C[C@H]2CCCO2)[C@@H]2CCS(=O)(=O)C2)n[nH]1	ZINC000159583312	436860600	/nfs/dbraw/zinc/86/06/00/436860600.db2.gz	HWYJDLMPNXKMGG-VXGBXAGGSA-N	0	1	328.438	0.535	20	70		ECIDMN
Cc1c(F)cccc1S(=O)(=O)N(CCOCCO)CCN(C)C	ZINC000161309164	436887573	/nfs/dbraw/zinc/88/75/73/436887573.db2.gz	OCOWBQWKSZOKBI-UHFFFAOYSA-N	0	1	348.440	0.695	20	70		ECIDMN
C[NH+](C)C[C@@](C)(O)C[N-]S(=O)(=O)c1cc(F)c(F)cc1F	ZINC000161444343	206347560	/nfs/dbraw/zinc/34/75/60/206347560.db2.gz	JIZCCFWLDNVUGR-LBPRGKRZSA-N	0	1	326.340	0.695	20	70		ECIDMN
Cc1nc(C(=O)Nc2ccc(N3CCN(C)CC3)nc2)c(=O)[nH]c1C	ZINC000159479246	296711325	/nfs/dbraw/zinc/71/13/25/296711325.db2.gz	RGALASFLKJIWHF-UHFFFAOYSA-N	0	1	342.403	0.786	20	70		ECIDMN
Cn1cc(N2CCC[C@@H](N3CCC(n4cncn4)CC3)C2=O)cn1	ZINC000159912358	164802938	/nfs/dbraw/zinc/80/29/38/164802938.db2.gz	GMLVCANTGKIOOB-OAHLLOKOSA-N	0	1	329.408	0.844	20	70		ECIDMN
O=C(c1ccc2n[nH]cc2c1)N1CCC[C@@H](C(=O)N2CCNCC2)C1	ZINC000159386506	436858195	/nfs/dbraw/zinc/85/81/95/436858195.db2.gz	OJHFZTOACAARQJ-CQSZACIVSA-N	0	1	341.415	0.847	20	70		ECIDMN
CN(C)C(=O)CCCC(=O)NC[C@H]1C[C@H](O)CN1Cc1ccccc1	ZINC000160506098	436872308	/nfs/dbraw/zinc/87/23/08/436872308.db2.gz	RLNGZZIMQBDDLW-SJORKVTESA-N	0	1	347.459	0.997	20	70		ECIDMN
Cc1cc(C[C@@H](C)NC(=O)[C@@H]2CCCCN2S(C)(=O)=O)n[nH]1	ZINC000161492629	545852903	/nfs/dbraw/zinc/85/29/03/545852903.db2.gz	VOHRQBGRDGKARD-MFKMUULPSA-N	0	1	328.438	0.579	20	70		ECIDMN
CS(=O)(=O)N[C@H]1CCC[C@@H]1CNC(=O)c1[nH]nc2c1CCC2	ZINC000160699061	206310203	/nfs/dbraw/zinc/31/02/03/206310203.db2.gz	FXQFWIHXFAHPHU-KOLCDFICSA-N	0	1	326.422	0.346	20	70		ECIDMN
CC[C@H](O)CCNC(=O)NCc1ccc(N2CCN(C)CC2)nc1	ZINC000160872773	206317291	/nfs/dbraw/zinc/31/72/91/206317291.db2.gz	JQUXFKPWTRPGCW-HNNXBMFYSA-N	0	1	335.452	0.794	20	70		ECIDMN
O=C(NCCN1CCN(Cc2ccccc2)CC1)[C@@H]1CCNC(=O)C1	ZINC000159660988	296711951	/nfs/dbraw/zinc/71/19/51/296711951.db2.gz	ACMUMMCLMPWNEL-QGZVFWFLSA-N	0	1	344.459	0.447	20	70		ECIDMN
CNS(=O)(=O)[C@H]1CCN(C(=O)c2cccc(-c3nnc[nH]3)c2)C1	ZINC000159609153	436859736	/nfs/dbraw/zinc/85/97/36/436859736.db2.gz	UUOOZNAOODLNPZ-LBPRGKRZSA-N	0	1	335.389	0.235	20	70		ECIDMN
Cc1oc(C(=O)N2C[C@H]3CCC[C@@H](C2)N3)cc1S(=O)(=O)N(C)C	ZINC000159928286	436865323	/nfs/dbraw/zinc/86/53/23/436865323.db2.gz	IXZSTLWDLCLXRZ-TXEJJXNPSA-N	0	1	341.433	0.805	20	70		ECIDMN
Cc1cccc2nc(CNC(=O)CN3C(=O)NC(=O)C3(C)C)[nH]c21	ZINC000160417210	436870498	/nfs/dbraw/zinc/87/04/98/436870498.db2.gz	MYVVTYRDXYLFHN-UHFFFAOYSA-N	0	1	329.360	0.818	20	70		ECIDMN
Cc1cc(C[C@H](C)NC(=O)CNC(=O)COc2ccccc2)n[nH]1	ZINC000161335490	436887628	/nfs/dbraw/zinc/88/76/28/436887628.db2.gz	MIEUSAUTEZUMPM-LBPRGKRZSA-N	0	1	330.388	0.961	20	70		ECIDMN
CS(=O)(=O)N[C@H]1CCC[C@H]1CNC(=O)c1[nH]nc2c1CCCC2	ZINC000160684334	545850403	/nfs/dbraw/zinc/85/04/03/545850403.db2.gz	JTZQSGPWMLOPLQ-JQWIXIFHSA-N	0	1	340.449	0.736	20	70		ECIDMN
Cn1ccc(NC(=O)C(=O)N2CCC[C@@H](c3n[nH]c(C4CC4)n3)C2)n1	ZINC000160411058	206296511	/nfs/dbraw/zinc/29/65/11/206296511.db2.gz	AXIQEHYOCOUOTI-LLVKDONJSA-N	0	1	343.391	0.760	20	70		ECIDMN
Cc1ccc(S(N)(=O)=O)c(C(=O)N2CCN(CC3CC3)CC2)c1	ZINC000161182515	206332646	/nfs/dbraw/zinc/33/26/46/206332646.db2.gz	XXHYPFYRJRDDGL-UHFFFAOYSA-N	0	1	337.445	0.810	20	70		ECIDMN
Cc1ccc(C(=O)NCC(=O)N2CCNCC2)c(Br)c1	ZINC000161224071	296715298	/nfs/dbraw/zinc/71/52/98/296715298.db2.gz	SNNZZEGGOFJLEF-UHFFFAOYSA-N	0	1	340.221	0.919	20	70		ECIDMN
C[C@H](C(=O)N1C[C@H]2CCC[C@@H](C1)N2)N1C(=O)NC2(CCCC2)C1=O	ZINC000160646865	298107182	/nfs/dbraw/zinc/10/71/82/298107182.db2.gz	UCBLLUPLKHYGRA-UPJWGTAASA-N	0	1	334.420	0.592	20	70		ECIDMN
CC(C)[C@@H]1CN(C)CCN1C(=O)N[C@@H]1CCN(c2cnn(C)c2)C1=O	ZINC000160301374	436870172	/nfs/dbraw/zinc/87/01/72/436870172.db2.gz	RILVVTVMCLZZLN-CABCVRRESA-N	0	1	348.451	0.507	20	70		ECIDMN
Cn1nccc1NC(=O)C(=O)N1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1	ZINC000160404305	436870532	/nfs/dbraw/zinc/87/05/32/436870532.db2.gz	NZZKNFPEFVESKT-LLVKDONJSA-N	0	1	343.391	0.760	20	70		ECIDMN
CCc1noc(C)c1NC(=O)C(=O)NC[C@H]1CCCN1CCOC	ZINC000160671063	436878059	/nfs/dbraw/zinc/87/80/59/436878059.db2.gz	NRZSCRVHLUOXSV-GFCCVEGCSA-N	0	1	338.408	0.711	20	70		ECIDMN
O=C(Cn1cc(Br)ccc1=O)N1C[C@H]2CCC[C@@H](C1)N2	ZINC000159480554	164799695	/nfs/dbraw/zinc/79/96/95/164799695.db2.gz	LWJQZJSCOHAVTD-TXEJJXNPSA-N	0	1	340.221	0.964	20	70		ECIDMN
O=C(NCCN1CCN(Cc2ccccc2)CC1)[C@H]1CCNC(=O)C1	ZINC000159661124	436859917	/nfs/dbraw/zinc/85/99/17/436859917.db2.gz	ACMUMMCLMPWNEL-KRWDZBQOSA-N	0	1	344.459	0.447	20	70		ECIDMN
COCCN(C)CCNC(=O)C(=O)Nc1cnc(Cl)cc1C	ZINC000160418489	436871766	/nfs/dbraw/zinc/87/17/66/436871766.db2.gz	WBTGMGJLCJCLKB-UHFFFAOYSA-N	0	1	328.800	0.676	20	70		ECIDMN
COCC(=O)N1CCN(C(=O)c2cccc(-c3nnc[nH]3)c2)CC1	ZINC000160817067	436879095	/nfs/dbraw/zinc/87/90/95/436879095.db2.gz	IXVKAQXCDIAIPV-UHFFFAOYSA-N	0	1	329.360	0.403	20	70		ECIDMN
Cc1cc(C[C@H](C)NC(=O)Cn2c(=O)[nH]c3ccccc3c2=O)n[nH]1	ZINC000161508025	436892484	/nfs/dbraw/zinc/89/24/84/436892484.db2.gz	NGDWHFVZRFFUDM-JTQLQIEISA-N	0	1	341.371	0.469	20	70		ECIDMN
C[C@@H](C(=O)N1CCN(C(=O)c2ccco2)CC1)N(C)C[C@H](O)C1CC1	ZINC000160824116	545849498	/nfs/dbraw/zinc/84/94/98/545849498.db2.gz	YAGVNDYCVZJOQV-ZFWWWQNUSA-N	0	1	349.431	0.655	20	70		ECIDMN
CS(=O)(=O)N[C@@H]1CCC[C@H]1CNC(=O)c1[nH]nc2c1CCCC2	ZINC000160684205	545850026	/nfs/dbraw/zinc/85/00/26/545850026.db2.gz	JTZQSGPWMLOPLQ-CMPLNLGQSA-N	0	1	340.449	0.736	20	70		ECIDMN
CNS(=O)(=O)c1ccc(C)c(C(=O)N2C[C@H]3CCC[C@@H](C2)N3)c1	ZINC000159533034	296711916	/nfs/dbraw/zinc/71/19/16/296711916.db2.gz	GTYLVIDFGZTSIS-BETUJISGSA-N	0	1	337.445	0.870	20	70		ECIDMN
CCS(=O)(=O)N1CCC(C(=O)N2C[C@H]3CCC[C@@H](C2)N3)CC1	ZINC000159535500	436861181	/nfs/dbraw/zinc/86/11/81/436861181.db2.gz	ZPLJEZJFBZHJRL-OKILXGFUSA-N	0	1	329.466	0.401	20	70		ECIDMN
O=C(C[C@@H]1NC(=O)NC1=O)NC1CCN(Cc2ccsc2)CC1	ZINC000159660660	436861873	/nfs/dbraw/zinc/86/18/73/436861873.db2.gz	WDVNKIXIUPOPHX-LBPRGKRZSA-N	0	1	336.417	0.427	20	70		ECIDMN
CC(C)CN1CCO[C@H](CNC(=O)C[N@@H+](C)C[C@@H]2CCC[C@@H]2O)C1	ZINC000159725696	436864063	/nfs/dbraw/zinc/86/40/63/436864063.db2.gz	ADHUEONIASSBRV-BBWFWOEESA-N	0	1	341.496	0.552	20	70		ECIDMN
CCC(CC)(CNC(=O)N[C@@H](C)CN1CCN(C)CC1)C(=O)OC	ZINC000159856782	436867138	/nfs/dbraw/zinc/86/71/38/436867138.db2.gz	OYOVPADUPUFQDB-AWEZNQCLSA-N	0	1	342.484	0.901	20	70		ECIDMN
Cc1cc(C[C@@H](C)NC(=O)c2coc(S(=O)(=O)N(C)C)c2)n[nH]1	ZINC000160159635	436868762	/nfs/dbraw/zinc/86/87/62/436868762.db2.gz	JMAOWQJYDBIIPN-SECBINFHSA-N	0	1	340.405	0.922	20	70		ECIDMN
Cn1nccc1NC(=O)C(=O)N1CCC[C@H](c2n[nH]c(C3CC3)n2)C1	ZINC000160404187	436870370	/nfs/dbraw/zinc/87/03/70/436870370.db2.gz	NZZKNFPEFVESKT-NSHDSACASA-N	0	1	343.391	0.760	20	70		ECIDMN
Cc1cccc2nc(CNC(=O)Cn3nc4ccccn4c3=O)[nH]c21	ZINC000160277104	436870524	/nfs/dbraw/zinc/87/05/24/436870524.db2.gz	UWNNJCKDGNTJBE-UHFFFAOYSA-N	0	1	336.355	0.997	20	70		ECIDMN
Cc1cc(C[C@H](C)NC(=O)CN2C(=O)N[C@](C)(C3CC3)C2=O)n[nH]1	ZINC000161326340	436887676	/nfs/dbraw/zinc/88/76/76/436887676.db2.gz	PMNQASKCPRUEQK-XXFAHNHDSA-N	0	1	333.392	0.486	20	70		ECIDMN
COCC(=O)N(C)CC(=O)Nc1cccc(CN2CCN(C)CC2)c1	ZINC000159755906	225272173	/nfs/dbraw/zinc/27/21/73/225272173.db2.gz	SOEXWTUHLQMSEW-UHFFFAOYSA-N	0	1	348.447	0.477	20	70		ECIDMN
COCCNCC(=O)N[C@H]1CCN(c2ccc(Cl)cc2)C1=O	ZINC000160400294	436870202	/nfs/dbraw/zinc/87/02/02/436870202.db2.gz	ODLDPXINVFPPDH-ZDUSSCGKSA-N	0	1	325.796	0.798	20	70		ECIDMN
CC1CCN(CCCNC(=O)NC[C@@H]2CCCS2(=O)=O)CC1	ZINC000159869791	436865884	/nfs/dbraw/zinc/86/58/84/436865884.db2.gz	PHSXZSDMEJWJMA-AWEZNQCLSA-N	0	1	331.482	0.985	20	70		ECIDMN
CCOC(=O)C[C@H](C)NC(=O)c1ccnc(N2CCN(C)CC2)c1	ZINC000160602966	436874956	/nfs/dbraw/zinc/87/49/56/436874956.db2.gz	MANUVHIFZJNBPC-ZDUSSCGKSA-N	0	1	334.420	0.905	20	70		ECIDMN
CC1CCC2(CC1)NC(=O)N(CC(=O)N1C[C@H]3CCC[C@@H](C1)N3)C2=O	ZINC000160716576	436877227	/nfs/dbraw/zinc/87/72/27/436877227.db2.gz	NMYBYLHMPUCMKX-MBIJGJCISA-N	0	1	348.447	0.840	20	70		ECIDMN
Cc1nnc(CN2CCN(C(=O)CN(C)[C@@H]3CCSC3)CC2)[nH]1	ZINC000160707443	436877479	/nfs/dbraw/zinc/87/74/79/436877479.db2.gz	BTAZJRLBWRKCOB-CYBMUJFWSA-N	0	1	338.481	0.195	20	70		ECIDMN
CCN1CCN(c2ccc(CNC(=O)C3(NC(N)=O)CC3)cn2)CC1	ZINC000160757255	436877853	/nfs/dbraw/zinc/87/78/53/436877853.db2.gz	SCBVDJSOAVSXMW-UHFFFAOYSA-N	0	1	346.435	0.041	20	70		ECIDMN
COC(=O)Cn1cc(CCN2CCN(c3ccc(O)cc3)CC2)nn1	ZINC000161016080	296714942	/nfs/dbraw/zinc/71/49/42/296714942.db2.gz	JOBIPXJVGWJEFF-UHFFFAOYSA-N	0	1	345.403	0.521	20	70		ECIDMN
CCN(CC)S(=O)(=O)CCNC(=O)N1CCN(C)C[C@@H]1C(C)C	ZINC000160436769	436873298	/nfs/dbraw/zinc/87/32/98/436873298.db2.gz	HHTMVZVQZXGSME-CQSZACIVSA-N	0	1	348.513	0.640	20	70		ECIDMN
C[C@@H]1CN(C2CCN(C(=O)N[C@@H]3CCc4ncnn4C3)CC2)CCO1	ZINC000160970040	436882119	/nfs/dbraw/zinc/88/21/19/436882119.db2.gz	NHGXZWAGXLLZLE-ZIAGYGMSSA-N	0	1	348.451	0.488	20	70		ECIDMN
O=C(CN1CC[C@]2(O)CCCC[C@H]2C1)NCCCN1CCCC1=O	ZINC000161165661	545852075	/nfs/dbraw/zinc/85/20/75/545852075.db2.gz	BLNXMZATHYMXNZ-MAUKXSAKSA-N	0	1	337.464	0.742	20	70		ECIDMN
O=C(NCCCc1nc(=O)[nH][nH]1)c1ccncc1Br	ZINC000159843774	436862301	/nfs/dbraw/zinc/86/23/01/436862301.db2.gz	YCWFLEUQJYQHJF-UHFFFAOYSA-N	0	1	326.154	0.618	20	70		ECIDMN
Cc1cccc2nc(CNC(=O)CN3CCS(=O)(=O)CC3)[nH]c21	ZINC000160575641	436876008	/nfs/dbraw/zinc/87/60/08/436876008.db2.gz	XMSABAYBNLIFQT-UHFFFAOYSA-N	0	1	336.417	0.218	20	70		ECIDMN
Cc1cc(C[C@@H](C)NC(=O)CN2C(=O)N[C@](C)(C3CC3)C2=O)n[nH]1	ZINC000161326215	436888043	/nfs/dbraw/zinc/88/80/43/436888043.db2.gz	PMNQASKCPRUEQK-JDNHERCYSA-N	0	1	333.392	0.486	20	70		ECIDMN
Cc1cc(C[C@@H](C)NC(=O)[C@H]2CCCCN2S(C)(=O)=O)n[nH]1	ZINC000161492891	545853206	/nfs/dbraw/zinc/85/32/06/545853206.db2.gz	VOHRQBGRDGKARD-ZWNOBZJWSA-N	0	1	328.438	0.579	20	70		ECIDMN
COC[C@H](O)CNC(=O)NC1CCN([C@H](C)c2ccncc2)CC1	ZINC000161201640	277264618	/nfs/dbraw/zinc/26/46/18/277264618.db2.gz	KICKZXZEMVLYPF-CZUORRHYSA-N	0	1	336.436	0.914	20	70		ECIDMN
Cc1ccc(NC(=O)C(=O)NC[C@H](C(C)C)N2CCN(C)CC2)cn1	ZINC000159940270	436867105	/nfs/dbraw/zinc/86/71/05/436867105.db2.gz	AZUOPNIITJBPTH-MRXNPFEDSA-N	0	1	347.463	0.717	20	70		ECIDMN
CC(C)[C@H]1CN(C)CCN1C(=O)N[C@@H]1CCN(c2cnn(C)c2)C1=O	ZINC000160301531	436870693	/nfs/dbraw/zinc/87/06/93/436870693.db2.gz	RILVVTVMCLZZLN-HUUCEWRRSA-N	0	1	348.451	0.507	20	70		ECIDMN
Cc1conc1NC(=O)C(=O)N1CCC(CN2CCOCC2)CC1	ZINC000160422190	436871308	/nfs/dbraw/zinc/87/13/08/436871308.db2.gz	BEXXWHIDAPNTNW-UHFFFAOYSA-N	0	1	336.392	0.492	20	70		ECIDMN
Cc1cc(S(=O)(=O)N(CCOCCO)CCN(C)C)ccc1F	ZINC000161306150	436887932	/nfs/dbraw/zinc/88/79/32/436887932.db2.gz	VMMBLTMZGVJNTC-UHFFFAOYSA-N	0	1	348.440	0.695	20	70		ECIDMN
C[C@H](O)CN(C)[C@@H](C)C(=O)NCC(=O)Nc1ccc(F)c(F)c1F	ZINC000159391118	225209183	/nfs/dbraw/zinc/20/91/83/225209183.db2.gz	XRNUKHTXJCLWFM-IUCAKERBSA-N	0	1	347.337	0.860	20	70		ECIDMN
CCOC(=O)[C@@H]1CCCN(C(=O)CN(C)C[C@@H]2CCC[C@@H]2O)C1	ZINC000159520607	436858851	/nfs/dbraw/zinc/85/88/51/436858851.db2.gz	WDCIGAHVBUYPAC-ZNMIVQPWSA-N	0	1	326.437	0.881	20	70		ECIDMN
Cc1nn(C)c(C)c1-c1cc(C(=O)N2C[C@@H]3[C@H](C2)OCCN3C)n[nH]1	ZINC000159685919	436860697	/nfs/dbraw/zinc/86/06/97/436860697.db2.gz	AOEBCIAECWBXQY-CABCVRRESA-N	0	1	344.419	0.582	20	70		ECIDMN
CCNS(=O)(=O)c1cccc(C(=O)N2C[C@H]3CCC[C@@H](C2)N3)c1	ZINC000160348477	436871230	/nfs/dbraw/zinc/87/12/30/436871230.db2.gz	XXVHZBDIWBTQGN-OKILXGFUSA-N	0	1	337.445	0.951	20	70		ECIDMN
CCN(CC)S(=O)(=O)CCNC(=O)N1CCN(C)C[C@H]1C(C)C	ZINC000160436897	436872844	/nfs/dbraw/zinc/87/28/44/436872844.db2.gz	HHTMVZVQZXGSME-AWEZNQCLSA-N	0	1	348.513	0.640	20	70		ECIDMN
Cc1ccc(S(=O)(=O)N(CCOCCO)CCN(C)C)c(C)c1	ZINC000161301254	436888148	/nfs/dbraw/zinc/88/81/48/436888148.db2.gz	VZOTUOWHCPKRAC-UHFFFAOYSA-N	0	1	344.477	0.865	20	70		ECIDMN
COC[C@@H](O)CCNC(=O)c1ccc(CN2CCN(C)CC2)cc1	ZINC000161352072	436888703	/nfs/dbraw/zinc/88/87/03/436888703.db2.gz	LEHGDHZFMGQJEB-KRWDZBQOSA-N	0	1	335.448	0.561	20	70		ECIDMN
Cc1ccc(NC(=O)C(=O)NCCCN2C[C@@H](C)O[C@H](C)C2)cn1	ZINC000159926558	225303314	/nfs/dbraw/zinc/30/33/14/225303314.db2.gz	YMHKAGLONJQZEH-ZIAGYGMSSA-N	0	1	334.420	0.944	20	70		ECIDMN
Cc1nn(-c2nc(C)cc(C)n2)c(C)c1CC(=O)N1CCNCC1	ZINC000159429856	436857344	/nfs/dbraw/zinc/85/73/44/436857344.db2.gz	GDZCIVYWPWSQMJ-UHFFFAOYSA-N	0	1	328.420	0.870	20	70		ECIDMN
CC(C)[C@@H]1CN(C)CCN1C(=O)NCC(C)(C)NS(C)(=O)=O	ZINC000159525827	436858315	/nfs/dbraw/zinc/85/83/15/436858315.db2.gz	ODIWDOYPOBXSSV-LBPRGKRZSA-N	0	1	334.486	0.296	20	70		ECIDMN
CN1CCN(c2ncccc2CNC(=O)N2CCC[C@](C)(O)C2)CC1	ZINC000161130940	436884318	/nfs/dbraw/zinc/88/43/18/436884318.db2.gz	FKAWJPCOHDYAHM-SFHVURJKSA-N	0	1	347.463	0.890	20	70		ECIDMN
O=C([C@@H]1CC(=O)N(Cc2ccccn2)C1)N1C[C@H]2CCC[C@@H](C1)N2	ZINC000160602447	545849424	/nfs/dbraw/zinc/84/94/24/545849424.db2.gz	VOVCXIQZFRULMX-BMFZPTHFSA-N	0	1	328.416	0.783	20	70		ECIDMN
CS(=O)(=O)N[C@H]1CCCN(C(=O)c2cccc(-c3nnc[nH]3)c2)C1	ZINC000160320179	545849775	/nfs/dbraw/zinc/84/97/75/545849775.db2.gz	BXVNUUFDBHCDFF-ZDUSSCGKSA-N	0	1	349.416	0.626	20	70		ECIDMN
O=C(CCn1c(=O)[nH]c(=O)c2ccccc21)N1C[C@H]2CCC[C@@H](C1)N2	ZINC000160536560	436873652	/nfs/dbraw/zinc/87/36/52/436873652.db2.gz	NYQJUVNNMHFYAT-BETUJISGSA-N	0	1	342.399	0.433	20	70		ECIDMN
CCOC(=O)C1CCN(C(=O)[C@@H](C)N(C)C[C@H](O)C2CC2)CC1	ZINC000160731672	436877398	/nfs/dbraw/zinc/87/73/98/436877398.db2.gz	DRPQSERVRWAXCC-DOMZBBRYSA-N	0	1	326.437	0.879	20	70		ECIDMN
CN(C)CCN(CCOCCO)S(=O)(=O)c1cccc(F)c1	ZINC000161304290	436887840	/nfs/dbraw/zinc/88/78/40/436887840.db2.gz	IYNGQDRPXMUWLR-UHFFFAOYSA-N	0	1	334.413	0.387	20	70		ECIDMN
COc1ccccc1N1CC[C@H](NC(=O)CCc2nc[nH]n2)C1=O	ZINC000161366611	436888916	/nfs/dbraw/zinc/88/89/16/436888916.db2.gz	WXKWUXUJDVPQOL-NSHDSACASA-N	0	1	329.360	0.668	20	70		ECIDMN
C[NH+](C)C[C@@](C)(O)C[N-]S(=O)(=O)c1ccc(F)c(F)c1F	ZINC000161448072	436892573	/nfs/dbraw/zinc/89/25/73/436892573.db2.gz	GNEKUQIEOCKWSB-LBPRGKRZSA-N	0	1	326.340	0.695	20	70		ECIDMN
CS(=O)(=O)CCCCN1CCC[C@@H](C(=O)N2CCOCC2)C1	ZINC000161320848	545851364	/nfs/dbraw/zinc/85/13/64/545851364.db2.gz	SNMIFXBNVMPISP-CQSZACIVSA-N	0	1	332.466	0.382	20	70		ECIDMN
CN(CC(=O)N(CCC(N)=O)Cc1ccccc1)C[C@@H]1CCC[C@@H]1O	ZINC000159664531	529826259	/nfs/dbraw/zinc/82/62/59/529826259.db2.gz	BYSKRUGQJRUQIS-IRXDYDNUSA-N	0	1	347.459	0.983	20	70		ECIDMN
CS(=O)(=O)N1CCC[C@@H]1CNC(=O)c1cccc(-c2nnc[nH]2)c1	ZINC000160127310	225343552	/nfs/dbraw/zinc/34/35/52/225343552.db2.gz	SKUDUIYYXAYHSE-CYBMUJFWSA-N	0	1	349.416	0.626	20	70		ECIDMN
CC(C)[C@@H](CNC(=O)N1CCC[C@@](C)(O)C1)N1CCN(C)CC1	ZINC000160133760	436869000	/nfs/dbraw/zinc/86/90/00/436869000.db2.gz	WXRUSECJCOHMFU-NVXWUHKLSA-N	0	1	326.485	0.815	20	70		ECIDMN
CCOC(=O)C[C@@H](C)NC(=O)c1ccnc(N2CCN(C)CC2)c1	ZINC000160602834	436876172	/nfs/dbraw/zinc/87/61/72/436876172.db2.gz	MANUVHIFZJNBPC-CYBMUJFWSA-N	0	1	334.420	0.905	20	70		ECIDMN
O=C(CN1CC[C@@]2(O)CCCC[C@H]2C1)NCCCN1CCCC1=O	ZINC000161165546	545851766	/nfs/dbraw/zinc/85/17/66/545851766.db2.gz	BLNXMZATHYMXNZ-YJBOKZPZSA-N	0	1	337.464	0.742	20	70		ECIDMN
COCCN1C[C@H](C(=O)NCc2nc3cccc(C)c3[nH]2)CC1=O	ZINC000160573884	436875055	/nfs/dbraw/zinc/87/50/55/436875055.db2.gz	ROAUTUVLDAYXQO-GFCCVEGCSA-N	0	1	330.388	0.982	20	70		ECIDMN
CS(=O)(=O)N[C@H]1CCC[C@H]1CNC(=O)c1[nH]nc2c1CCC2	ZINC000160699237	436877458	/nfs/dbraw/zinc/87/74/58/436877458.db2.gz	FXQFWIHXFAHPHU-ONGXEEELSA-N	0	1	326.422	0.346	20	70		ECIDMN
O=C(CNC(=O)c1cccc(-c2nnc[nH]2)c1)NCC(F)(F)F	ZINC000160971576	436881092	/nfs/dbraw/zinc/88/10/92/436881092.db2.gz	BEMXQGUDKKGHQQ-UHFFFAOYSA-N	0	1	327.266	0.880	20	70		ECIDMN
Cc1ccc(S(=O)(=O)N(CCOCCO)CCN(C)C)s1	ZINC000161309012	436887347	/nfs/dbraw/zinc/88/73/47/436887347.db2.gz	VVURCALGSWZKME-UHFFFAOYSA-N	0	1	336.479	0.618	20	70		ECIDMN
CC1(C(=O)NN2CC(=O)[N-]C2=O)CC[NH+](Cc2ccccc2)CC1	ZINC000161350356	436890318	/nfs/dbraw/zinc/89/03/18/436890318.db2.gz	MRURSJGAQVRLFF-UHFFFAOYSA-N	0	1	330.388	0.872	20	70		ECIDMN
COC(CN1CCCN(Cc2nc([C@@H](C)OC)no2)CC1)OC	ZINC000161446494	436892669	/nfs/dbraw/zinc/89/26/69/436892669.db2.gz	LOYXRWHSCNJFAA-GFCCVEGCSA-N	0	1	328.413	0.904	20	70		ECIDMN
CN(CC(=O)N(CCC(N)=O)Cc1ccccc1)C[C@H]1CCC[C@@H]1O	ZINC000159664662	529826436	/nfs/dbraw/zinc/82/64/36/529826436.db2.gz	BYSKRUGQJRUQIS-SJORKVTESA-N	0	1	347.459	0.983	20	70		ECIDMN
CC(=O)N(C)C1CCN(CCN2C(=O)NC3(CCCC3)C2=O)CC1	ZINC000159663024	436861662	/nfs/dbraw/zinc/86/16/62/436861662.db2.gz	YRHYDOFTTBAWRD-UHFFFAOYSA-N	0	1	336.436	0.794	20	70		ECIDMN
CS(=O)(=O)N[C@@H]1CCC[C@@H]1CNC(=O)c1[nH]nc2c1CCC2	ZINC000160698950	436878069	/nfs/dbraw/zinc/87/80/69/436878069.db2.gz	FXQFWIHXFAHPHU-MWLCHTKSSA-N	0	1	326.422	0.346	20	70		ECIDMN
NC(=O)c1cccc(CCNC(=O)c2nnc3ccccc3c2O)c1	ZINC000217144785	590754123	/nfs/dbraw/zinc/75/41/23/590754123.db2.gz	JVNJROKDRKKCHH-UHFFFAOYSA-N	0	1	336.351	0.995	20	70		ECIDMN
CC[N@H+]1CCCN(C(=O)NC2CCN(CC(=O)N(C)C)CC2)CC1	ZINC000159842431	436864134	/nfs/dbraw/zinc/86/41/34/436864134.db2.gz	KHWJOYNGANUZPQ-UHFFFAOYSA-N	0	1	339.484	0.276	20	70		ECIDMN
CCCS(=O)(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)Cc1cc(C)[nH]n1	ZINC000161125837	436883504	/nfs/dbraw/zinc/88/35/04/436883504.db2.gz	CPJSKLSPAYFKLA-SMDDNHRTSA-N	0	1	342.465	0.970	20	70		ECIDMN
Cc1cc(C[C@H](C)NC(=O)CN2C(=O)N[C@@](C)(C3CC3)C2=O)n[nH]1	ZINC000161326602	436887562	/nfs/dbraw/zinc/88/75/62/436887562.db2.gz	PMNQASKCPRUEQK-FVMDXXJSSA-N	0	1	333.392	0.486	20	70		ECIDMN
O=S(=O)([N-]CC1CC[NH+](CCO)CC1)c1cc(F)ccc1F	ZINC000161407738	436890541	/nfs/dbraw/zinc/89/05/41/436890541.db2.gz	OKAMFDHOQFANII-UHFFFAOYSA-N	0	1	334.388	0.947	20	70		ECIDMN
O=C(CCNS(=O)(=O)c1cccnc1)N1C[C@H]2CCC[C@@H](C1)N2	ZINC000160604660	164805263	/nfs/dbraw/zinc/80/52/63/164805263.db2.gz	ZKVILFSUEXPPKV-BETUJISGSA-N	0	1	338.433	0.103	20	70		ECIDMN
Cc1nn(C)c(C)c1-c1cc(C(=O)N2C[C@H]3OCCN(C)[C@@H]3C2)n[nH]1	ZINC000159685640	436860236	/nfs/dbraw/zinc/86/02/36/436860236.db2.gz	AOEBCIAECWBXQY-HUUCEWRRSA-N	0	1	344.419	0.582	20	70		ECIDMN
CC(C)[C@H](CNC(=O)N1CCC[C@](C)(O)C1)N1CCN(C)CC1	ZINC000160134158	436868372	/nfs/dbraw/zinc/86/83/72/436868372.db2.gz	WXRUSECJCOHMFU-RDJZCZTQSA-N	0	1	326.485	0.815	20	70		ECIDMN
CCC[C@@H]1CN(C(=O)NCCCNC(C)=O)CCN1CCOC	ZINC000160402269	436869792	/nfs/dbraw/zinc/86/97/92/436869792.db2.gz	KUOBKHIGVUGLLW-OAHLLOKOSA-N	0	1	328.457	0.655	20	70		ECIDMN
Cc1cccc(F)c1NS(=O)(=O)c1cn(C)c(=O)n(C)c1=O	ZINC000160816562	436880205	/nfs/dbraw/zinc/88/02/05/436880205.db2.gz	GOGDNUKGKFEYKT-UHFFFAOYSA-N	0	1	327.337	0.332	20	70		ECIDMN
CNS(=O)(=O)c1ccc(C(=O)N[C@H](C)Cc2cc(C)[nH]n2)o1	ZINC000161138830	436884816	/nfs/dbraw/zinc/88/48/16/436884816.db2.gz	QRVLLUCWICQMDV-MRVPVSSYSA-N	0	1	326.378	0.580	20	70		ECIDMN
CNC(=O)COc1cccc(CC(=O)N2CCN(C(C)C)CC2)c1	ZINC000161181466	436885981	/nfs/dbraw/zinc/88/59/81/436885981.db2.gz	GHRKVGZXZNZGTH-UHFFFAOYSA-N	0	1	333.432	0.907	20	70		ECIDMN
Cc1cc(F)ccc1S(=O)(=O)N(CCOCCO)CCN(C)C	ZINC000161306682	436888053	/nfs/dbraw/zinc/88/80/53/436888053.db2.gz	ATBSFDPGKHEYIZ-UHFFFAOYSA-N	0	1	348.440	0.695	20	70		ECIDMN
CCOC(=O)C1CCN(C(=O)[C@H](C)N(C)C[C@H](O)C2CC2)CC1	ZINC000160731807	436878105	/nfs/dbraw/zinc/87/81/05/436878105.db2.gz	DRPQSERVRWAXCC-WFASDCNBSA-N	0	1	326.437	0.879	20	70		ECIDMN
Cc1cc(C[C@@H](C)NC(=O)Cc2ccc(-n3cnnn3)cc2)n[nH]1	ZINC000161345621	436890657	/nfs/dbraw/zinc/89/06/57/436890657.db2.gz	KQAMXRNSIZLTDI-LLVKDONJSA-N	0	1	325.376	0.984	20	70		ECIDMN
COCCN1C[C@@H](C(=O)NCc2nc3cccc(C)c3[nH]2)CC1=O	ZINC000160574020	436876118	/nfs/dbraw/zinc/87/61/18/436876118.db2.gz	ROAUTUVLDAYXQO-LBPRGKRZSA-N	0	1	330.388	0.982	20	70		ECIDMN
CCC[C@@H]1CN(C(=O)N[C@@H](C)Cn2cncn2)CCN1CCOC	ZINC000161420046	436890495	/nfs/dbraw/zinc/89/04/95/436890495.db2.gz	YMYLYRUCMXKTLA-LSDHHAIUSA-N	0	1	338.456	0.809	20	70		ECIDMN
O=C(NCCN1CCN(Cc2ccccc2)CC1)[C@H]1CCCNC1=O	ZINC000216631544	545919253	/nfs/dbraw/zinc/91/92/53/545919253.db2.gz	XSGOANQVTSROGX-KRWDZBQOSA-N	0	1	344.459	0.447	20	70		ECIDMN
COc1ccc(C(=O)NCc2c(C)nc3cc(=O)[nH]n3c2C)nn1	ZINC000160305740	533336283	/nfs/dbraw/zinc/33/62/83/533336283.db2.gz	AOYMFWNKMYWOTP-UHFFFAOYSA-N	0	1	328.332	0.368	20	70		ECIDMN
C[N@H+](CC(=O)NCCCN1CCCCCC1=O)C[C@H]1CCC[C@@H]1O	ZINC000159721363	436863769	/nfs/dbraw/zinc/86/37/69/436863769.db2.gz	WWUZSNCLMVXIEW-CVEARBPZSA-N	0	1	339.480	0.988	20	70		ECIDMN
CN(CC(=O)NCCCN1CCCCCC1=O)C[C@H]1CCC[C@@H]1O	ZINC000159721363	436863773	/nfs/dbraw/zinc/86/37/73/436863773.db2.gz	WWUZSNCLMVXIEW-CVEARBPZSA-N	0	1	339.480	0.988	20	70		ECIDMN
CN1CCN(c2ncccc2CNC(=O)c2cccc(=O)n2C)CC1	ZINC000161303810	436887073	/nfs/dbraw/zinc/88/70/73/436887073.db2.gz	FMVZDOAZBOVCHO-UHFFFAOYSA-N	0	1	341.415	0.462	20	70		ECIDMN
C[C@H](C(=O)N1CCN(C(=O)c2ccco2)CC1)N(C)C[C@H](O)C1CC1	ZINC000160824263	545851969	/nfs/dbraw/zinc/85/19/69/545851969.db2.gz	YAGVNDYCVZJOQV-HIFRSBDPSA-N	0	1	349.431	0.655	20	70		ECIDMN
C[C@@H](NS(=O)(=O)c1ccccc1)C(=O)N1C[C@H]2CCC[C@@H](C1)N2	ZINC000159824814	207630463	/nfs/dbraw/zinc/63/04/63/207630463.db2.gz	VNEYKCZLEPBXGE-MCIONIFRSA-N	0	1	337.445	0.706	20	70		ECIDMN
COCCN1C[C@@H](C(=O)Nc2nc(-c3ccc(C)o3)n[nH]2)CC1=O	ZINC000160283453	225379446	/nfs/dbraw/zinc/37/94/46/225379446.db2.gz	PAMZDVZDCWHJIW-JTQLQIEISA-N	0	1	333.348	0.807	20	70		ECIDMN
CC(C)[C@H]1CN(C)CCN1C(=O)NCC(C)(C)NS(C)(=O)=O	ZINC000159525965	436857915	/nfs/dbraw/zinc/85/79/15/436857915.db2.gz	ODIWDOYPOBXSSV-GFCCVEGCSA-N	0	1	334.486	0.296	20	70		ECIDMN
Nc1c(C(=O)CN2CC[C@@H]3CCCC[C@@H]32)c(=O)[nH]c(=O)n1C1CC1	ZINC000159602945	436859993	/nfs/dbraw/zinc/85/99/93/436859993.db2.gz	MFBRHMBWGOLPRV-JQWIXIFHSA-N	0	1	332.404	0.901	20	70		ECIDMN
CN(C)CC(=O)N1CCN(C(=O)CCCc2nc(C3CC3)no2)CC1	ZINC000159681864	436860570	/nfs/dbraw/zinc/86/05/70/436860570.db2.gz	IHAZTBAXPSCULL-UHFFFAOYSA-N	0	1	349.435	0.502	20	70		ECIDMN
Cc1nc2c(c(=O)[nH]n2C)c(C)c1CC(=O)N1C[C@H]2CCC[C@@H](C1)N2	ZINC000159965526	436866001	/nfs/dbraw/zinc/86/60/01/436866001.db2.gz	RNVBLUZNQLPGAN-BETUJISGSA-N	0	1	343.431	0.774	20	70		ECIDMN
O=C(N[C@@H]1CCc2ncnn2C1)N1CCC[C@H](CN2CCOCC2)C1	ZINC000161193833	436886322	/nfs/dbraw/zinc/88/63/22/436886322.db2.gz	FSOYIDNJJKZCRS-HUUCEWRRSA-N	0	1	348.451	0.347	20	70		ECIDMN
CS(=O)(=O)N1CC[C@@H](CNC(=O)c2cccc(-c3nnc[nH]3)c2)C1	ZINC000160123173	225342698	/nfs/dbraw/zinc/34/26/98/225342698.db2.gz	OEGFHPYDUFQFRS-NSHDSACASA-N	0	1	349.416	0.483	20	70		ECIDMN
CC(=O)N[C@@H]1CCCN(C(=O)CN2CC[C@]3(O)CCCC[C@@H]3C2)C1	ZINC000160588947	277044126	/nfs/dbraw/zinc/04/41/26/277044126.db2.gz	ITWBNAXCQITHRI-JFIYKMOQSA-N	0	1	337.464	0.741	20	70		ECIDMN
COC[C@@H](O)CNC(=O)NC1CCN([C@H](C)c2ccncc2)CC1	ZINC000161201373	292854197	/nfs/dbraw/zinc/85/41/97/292854197.db2.gz	KICKZXZEMVLYPF-CJNGLKHVSA-N	0	1	336.436	0.914	20	70		ECIDMN
CN1C(=O)N(CC(=O)N2C[C@H]3CCC[C@@H](C2)N3)C(=O)C12CCCCC2	ZINC000160065406	436869163	/nfs/dbraw/zinc/86/91/63/436869163.db2.gz	MFSMKSHRUCHSJJ-OKILXGFUSA-N	0	1	348.447	0.936	20	70		ECIDMN
COCc1nc2n(n1)C[C@@H](NC(=O)N1CCN3CCCC[C@@H]3C1)CC2	ZINC000160593662	436874881	/nfs/dbraw/zinc/87/48/81/436874881.db2.gz	HNXRTYFHAQLPQH-UONOGXRCSA-N	0	1	348.451	0.619	20	70		ECIDMN
CNS(=O)(=O)c1csc(C(=O)N2C[C@H]3CCC[C@@H](C2)N3)c1	ZINC000160626422	436875567	/nfs/dbraw/zinc/87/55/67/436875567.db2.gz	WPYRGPVJECWZHD-AOOOYVTPSA-N	0	1	329.447	0.623	20	70		ECIDMN
NC(=O)[C@H]1CC[C@@H](CNC(=O)[C@@H]2CCCN2Cc2ccccc2)O1	ZINC000160912777	436880895	/nfs/dbraw/zinc/88/08/95/436880895.db2.gz	NTZHLLMIMGZEOG-HRCADAONSA-N	0	1	331.416	0.800	20	70		ECIDMN
C[C@H](O)C(=O)N1CCN(CC2CCN(C(=O)C(C)(C)C)CC2)CC1	ZINC000161309053	436886942	/nfs/dbraw/zinc/88/69/42/436886942.db2.gz	YCDTUUYSHZAGDN-AWEZNQCLSA-N	0	1	339.480	0.796	20	70		ECIDMN
Cc1ccc(-c2n[nH]c(NC(=O)Cn3ccc(=O)n(C)c3=O)c2C)o1	ZINC000161491458	436891872	/nfs/dbraw/zinc/89/18/72/436891872.db2.gz	SOWYJFSTWWOPTD-UHFFFAOYSA-N	0	1	343.343	0.786	20	70		ECIDMN
CNS(=O)(=O)c1cc(C(=O)N[C@@H](C)Cc2cc(C)[nH]n2)co1	ZINC000160159207	530025769	/nfs/dbraw/zinc/02/57/69/530025769.db2.gz	MXLLBYGRRPJFMD-QMMMGPOBSA-N	0	1	326.378	0.580	20	70		ECIDMN
CN(C)S(=O)(=O)c1ccsc1C(=O)N1C[C@H]2CCC[C@@H](C1)N2	ZINC000159975639	436865079	/nfs/dbraw/zinc/86/50/79/436865079.db2.gz	GRYCAXJXDJAQBM-PHIMTYICSA-N	0	1	343.474	0.965	20	70		ECIDMN
O=C(COCC(=O)N1C[C@H]2CCC[C@@H](C1)N2)NCc1cccnc1	ZINC000160406102	436870626	/nfs/dbraw/zinc/87/06/26/436870626.db2.gz	OSBSCNWPNULSJR-GASCZTMLSA-N	0	1	332.404	0.067	20	70		ECIDMN
CNC(=O)Cn1cc(NC(=O)c2cccc(-c3nnc[nH]3)c2)cn1	ZINC000161123265	436882940	/nfs/dbraw/zinc/88/29/40/436882940.db2.gz	WUUSGKUYTSPPLL-UHFFFAOYSA-N	0	1	325.332	0.667	20	70		ECIDMN
CNS(=O)(=O)c1cccc(C(=O)N[C@H](C)Cc2cc(C)[nH]n2)c1	ZINC000161208106	436885629	/nfs/dbraw/zinc/88/56/29/436885629.db2.gz	AGAJNWDCLUTLJZ-SNVBAGLBSA-N	0	1	336.417	0.987	20	70		ECIDMN
C[C@@H](c1ccncc1)N1CCC(NC(=O)N2CCNC(=O)C2)CC1	ZINC000161266547	436888272	/nfs/dbraw/zinc/88/82/72/436888272.db2.gz	LTOFUEVNECNTDJ-ZDUSSCGKSA-N	0	1	331.420	0.748	20	70		ECIDMN
CC(=O)N1CCC[C@@H]1C(=O)NC[C@@H]1C[C@H](O)CN1Cc1ccccc1	ZINC000160546015	436873131	/nfs/dbraw/zinc/87/31/31/436873131.db2.gz	XSYHWOXLZUVHOM-OKZBNKHCSA-N	0	1	345.443	0.749	20	70		ECIDMN
C[C@H](c1ccncc1)N1CCC(NC(=O)N2CCNC(=O)C2)CC1	ZINC000161266682	436888108	/nfs/dbraw/zinc/88/81/08/436888108.db2.gz	LTOFUEVNECNTDJ-CYBMUJFWSA-N	0	1	331.420	0.748	20	70		ECIDMN
N[C@@H](C(=O)N1CCN(CCc2cnccn2)CC1)c1ccccc1	ZINC000217356048	545920751	/nfs/dbraw/zinc/92/07/51/545920751.db2.gz	AAWCFTQJKVSDNG-QGZVFWFLSA-N	0	1	325.416	0.863	20	70		ECIDMN