smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCN1CCN(C[C@H]2CC(c3ccc(Cl)cc3)=NO2)CC1	ZINC000159725177	186137257	/nfs/dbraw/zinc/13/72/57/186137257.db2.gz	XWGYAOHJFJXKFU-OAHLLOKOSA-N	0	3	307.825	2.471	10	70		DEIEHN
COc1nc(C)nc(NC2CCN(CCOC(C)C)CC2)c1C	ZINC000159416504	402323379	/nfs/dbraw/zinc/32/33/79/402323379.db2.gz	CBQOUMHPQVQSBJ-UHFFFAOYSA-N	0	3	322.453	2.403	10	70		DEIEHN
CSc1ccsc1C(=O)NC[C@H](O)CN1CCCCC1	ZINC000160325118	402340361	/nfs/dbraw/zinc/34/03/61/402340361.db2.gz	AOPKHAXDBLHGDN-NSHDSACASA-N	0	3	314.476	2.047	10	70		DEIEHN
C[C@@H](C(=O)N1CCC(C)CC1)N1CC[C@]2(O)CCCC[C@@H]2C1	ZINC000161062977	402371626	/nfs/dbraw/zinc/37/16/26/402371626.db2.gz	SHWCIHJTAOYMBF-LZLYRXPVSA-N	0	3	308.466	2.260	10	70		DEIEHN
CCOCCN1CCN(Cc2cnc3ccccn23)C[C@H]1CC	ZINC000159953796	402334427	/nfs/dbraw/zinc/33/44/27/402334427.db2.gz	USRNFBOXYNUYBN-MRXNPFEDSA-N	0	3	316.449	2.267	10	70		DEIEHN
CC[C@H](C(=O)N1C[C@@H](C)O[C@H](c2ccc(F)cc2)C1)N(C)C	ZINC000159978387	276542176	/nfs/dbraw/zinc/54/21/76/276542176.db2.gz	UERCIXGZUAHWHM-WQVCFCJDSA-N	0	3	308.397	2.454	10	70		DEIEHN
CCC[C@@H](C(=O)NC[C@@H](O)c1ccc(OC(C)C)cc1)N(C)C	ZINC000160302373	197399571	/nfs/dbraw/zinc/39/95/71/197399571.db2.gz	MFCULXJXJJVOJI-DLBZAZTESA-N	0	3	322.449	2.354	10	70		DEIEHN
CCN1CCC[C@H]1CN(C)C(=O)c1ccc(N(C)C)cc1F	ZINC000160002411	197379419	/nfs/dbraw/zinc/37/94/19/197379419.db2.gz	ZWOPMBJOHUWQQS-AWEZNQCLSA-N	0	3	307.413	2.448	10	70		DEIEHN
CCN(CC)C(=O)[C@@H](C)N[C@@H](C)c1ccc(-n2ccnn2)cc1	ZINC000159936650	197375211	/nfs/dbraw/zinc/37/52/11/197375211.db2.gz	HYKSOUQEXWLNBG-UONOGXRCSA-N	0	3	315.421	2.175	10	70		DEIEHN
CCN(CC)c1ncc(CN2C[C@@H](C(N)=O)CC[C@@H]2C)s1	ZINC000159508326	197358393	/nfs/dbraw/zinc/35/83/93/197358393.db2.gz	PVLHSIHOLNYJPV-RYUDHWBXSA-N	0	3	310.467	2.075	10	70		DEIEHN
CC(C)(C)[C@H]1CCN(S(=O)(=O)c2ccc(F)c(CN)c2)C1	ZINC000159419843	197352602	/nfs/dbraw/zinc/35/26/02/197352602.db2.gz	XGJZPFKGYJVDMV-LBPRGKRZSA-N	0	3	314.426	2.341	10	70		DEIEHN
CCC[C@H](C(=O)NC[C@H](c1ccco1)N1CCCC1)N(C)C	ZINC000160394684	402343637	/nfs/dbraw/zinc/34/36/37/402343637.db2.gz	DBKHWMAFBDHDBP-HUUCEWRRSA-N	0	3	307.438	2.263	10	70		DEIEHN
CCC[C@@H](C(=O)NCCc1ccc(OC)c(OC)c1)N(C)C	ZINC000161189078	402376509	/nfs/dbraw/zinc/37/65/09/402376509.db2.gz	JDXXHAHCEBELGW-AWEZNQCLSA-N	0	3	308.422	2.093	10	70		DEIEHN
CCC[C@@H](C(=O)N(C)CCOc1ccc(OC)cc1)N(C)C	ZINC000161262817	402379504	/nfs/dbraw/zinc/37/95/04/402379504.db2.gz	SJGSDRJLIMLSKX-INIZCTEOSA-N	0	3	308.422	2.263	10	70		DEIEHN
CCC[C@H](C(=O)NC[C@H](c1cccc(OC)c1)N(C)C)N(C)C	ZINC000161300792	402381594	/nfs/dbraw/zinc/38/15/94/402381594.db2.gz	FOCYYFGDSZFRDJ-IAGOWNOFSA-N	0	3	321.465	2.144	10	70		DEIEHN
O=C(NC[C@@H](O)c1cc2ccccc2s1)[C@H]1CCCCN1	ZINC000160274386	197397321	/nfs/dbraw/zinc/39/73/21/197397321.db2.gz	IABKQBWJKPKVGA-CHWSQXEVSA-N	0	3	304.415	2.193	10	70		DEIEHN
O=C([C@@H]1C[C@H]1c1ccc(Br)cc1)N1CCCNCC1	ZINC000160859787	402363204	/nfs/dbraw/zinc/36/32/04/402363204.db2.gz	KNZQCBXTTMEDLG-UONOGXRCSA-N	0	3	323.234	2.375	10	70		DEIEHN
CC(C)CNC(=O)[C@H](C)N[C@H](C)c1ccc(-n2ccnn2)cc1	ZINC000159931727	402333491	/nfs/dbraw/zinc/33/34/91/402333491.db2.gz	RFZSXYSMSXUUNU-KGLIPLIRSA-N	0	3	315.421	2.079	10	70		DEIEHN
O=C(NC[C@H](O)CN1CCCCC1)c1ccc(F)cc1Cl	ZINC000160255120	197395910	/nfs/dbraw/zinc/39/59/10/197395910.db2.gz	MBSLWILSCIUGSG-LBPRGKRZSA-N	0	3	314.788	2.056	10	70		DEIEHN
C[C@@H](CC(=O)NC[C@H](O)CN1CCCCC1)c1ccccc1	ZINC000160080312	197384381	/nfs/dbraw/zinc/38/43/81/197384381.db2.gz	HLVIQEQGPGJSLF-RDJZCZTQSA-N	0	3	304.434	2.143	10	70		DEIEHN
CCN(CC)C(=O)[C@H](C)N[C@@H](C)c1ccc(-n2ccnn2)cc1	ZINC000159936793	197374753	/nfs/dbraw/zinc/37/47/53/197374753.db2.gz	HYKSOUQEXWLNBG-KBPBESRZSA-N	0	3	315.421	2.175	10	70		DEIEHN
CC(C)N(C)C(=O)[C@H](C)N[C@@H](C)c1ccc(-n2ccnn2)cc1	ZINC000159874903	197369916	/nfs/dbraw/zinc/36/99/16/197369916.db2.gz	SAESHAMELCAYPX-KBPBESRZSA-N	0	3	315.421	2.173	10	70		DEIEHN
CCCNCc1ccc(S(=O)(=O)N(C)CC(F)F)s1	ZINC000159395020	197350181	/nfs/dbraw/zinc/35/01/81/197350181.db2.gz	VLOZPVPSNZVXNK-UHFFFAOYSA-N	0	3	312.407	2.133	10	70		DEIEHN
CCCCOC(=O)CCN1CCC[C@@H](c2nncn2CC)C1	ZINC000161419816	402387120	/nfs/dbraw/zinc/38/71/20/402387120.db2.gz	PREXMCRJPRPIFX-CQSZACIVSA-N	0	3	308.426	2.211	10	70		DEIEHN
Cc1ccc(/C=C/CC(=O)NC[C@@H](O)CN2CCCCC2)cc1	ZINC000160508046	402348881	/nfs/dbraw/zinc/34/88/81/402348881.db2.gz	ORJVMCIUHFYWFK-DUMMIQTOSA-N	0	3	316.445	2.361	10	70		DEIEHN
CC(C)CNC(=O)[C@H](C)N[C@@H](C)c1ccc(-n2ccnn2)cc1	ZINC000159931453	402333474	/nfs/dbraw/zinc/33/34/74/402333474.db2.gz	RFZSXYSMSXUUNU-KBPBESRZSA-N	0	3	315.421	2.079	10	70		DEIEHN
COCCCN(C)CCNC(=O)c1[nH]c2ccc(C)cc2c1C	ZINC000160008047	402335120	/nfs/dbraw/zinc/33/51/20/402335120.db2.gz	WGLKYHMVWOVTQE-UHFFFAOYSA-N	0	3	317.433	2.483	10	70		DEIEHN
CCC[C@H](C(=O)N1CCc2cc(OC)c(OC)cc2C1)N(C)C	ZINC000161439194	278920245	/nfs/dbraw/zinc/92/02/45/278920245.db2.gz	GVFFYJSDGDKSRI-OAHLLOKOSA-N	0	3	320.433	2.319	10	70		DEIEHN
O=C(/C=C/c1ccc(Cl)cc1)NC[C@H](O)CN1CCCCC1	ZINC000160672976	527608126	/nfs/dbraw/zinc/60/81/26/527608126.db2.gz	XWQFBYYKUVUPSF-FSNWXROXSA-N	0	3	322.836	2.316	10	70		DEIEHN
CO[C@]1(CNC[C@H](O)c2cc(Cl)ccc2Cl)CCOC1	ZINC000160293303	197398209	/nfs/dbraw/zinc/39/82/09/197398209.db2.gz	GXHJIKJUYAOSJK-KBPBESRZSA-N	0	3	320.216	2.422	10	70		DEIEHN
CC(C)(Cc1ccccc1)C(=O)NC[C@H](O)CN1CCCCC1	ZINC000159988378	197379029	/nfs/dbraw/zinc/37/90/29/197379029.db2.gz	YGKPEXDTFBBDQO-KRWDZBQOSA-N	0	3	318.461	2.218	10	70		DEIEHN
CCN(CC)c1ncc(CN2C[C@H](C(N)=O)CC[C@@H]2C)s1	ZINC000159508171	197359154	/nfs/dbraw/zinc/35/91/54/197359154.db2.gz	PVLHSIHOLNYJPV-NWDGAFQWSA-N	0	3	310.467	2.075	10	70		DEIEHN
CC(C)[C@@H]1CCN(S(=O)(=O)c2ccc(CN)cc2Cl)C1	ZINC000159427362	197353017	/nfs/dbraw/zinc/35/30/17/197353017.db2.gz	KXPIKEGUCMIFJH-GFCCVEGCSA-N	0	3	316.854	2.465	10	70		DEIEHN
O=C(NC[C@H](O)CN1CCCCC1)c1csc2ccccc12	ZINC000160450728	402345698	/nfs/dbraw/zinc/34/56/98/402345698.db2.gz	HNWDKWKZZQLGKT-ZDUSSCGKSA-N	0	3	318.442	2.478	10	70		DEIEHN
CCC[C@@H](C(=O)NC[C@@H](O)c1cccc(OC(C)C)c1)N(C)C	ZINC000160630373	402354347	/nfs/dbraw/zinc/35/43/47/402354347.db2.gz	HYOFDNNPKQWIDG-DLBZAZTESA-N	0	3	322.449	2.354	10	70		DEIEHN
CC(C)CNC(=O)[C@@H](C)N[C@@H](C)c1ccc(-n2ccnn2)cc1	ZINC000159931326	402333722	/nfs/dbraw/zinc/33/37/22/402333722.db2.gz	RFZSXYSMSXUUNU-UONOGXRCSA-N	0	3	315.421	2.079	10	70		DEIEHN
CCN(CCc1nccs1)C(=O)NC1CCN(C2CC2)CC1	ZINC000161487296	521175536	/nfs/dbraw/zinc/17/55/36/521175536.db2.gz	GDPSMKCOHAWWQK-UHFFFAOYSA-N	0	3	322.478	2.344	10	70		DEIEHN
CCC[C@H](C(=O)NC[C@@H](O)c1cccc(OC(C)C)c1)N(C)C	ZINC000160630499	197427974	/nfs/dbraw/zinc/42/79/74/197427974.db2.gz	HYOFDNNPKQWIDG-IAGOWNOFSA-N	0	3	322.449	2.354	10	70		DEIEHN
CC(C)N(C)C(=O)[C@@H](C)N[C@H](C)c1ccc(-n2ccnn2)cc1	ZINC000159875040	197370147	/nfs/dbraw/zinc/37/01/47/197370147.db2.gz	SAESHAMELCAYPX-ZIAGYGMSSA-N	0	3	315.421	2.173	10	70		DEIEHN
C[C@H](NCCNC(=O)N(C)C)c1ccc(OC(F)F)cc1	ZINC000160773256	197438175	/nfs/dbraw/zinc/43/81/75/197438175.db2.gz	HSKKQGSEXHYCJQ-JTQLQIEISA-N	0	3	301.337	2.210	10	70		DEIEHN
O=C(NC[C@H](O)CN1CCCCC1)c1cc2c(s1)CCCC2	ZINC000160194670	197392000	/nfs/dbraw/zinc/39/20/00/197392000.db2.gz	RXIRLJWMMBXQIC-AWEZNQCLSA-N	0	3	322.474	2.204	10	70		DEIEHN
C[C@@H]1C[C@H](C)CN1S(=O)(=O)c1cc(CN)ccc1Cl	ZINC000159514285	197360012	/nfs/dbraw/zinc/36/00/12/197360012.db2.gz	SYWCKJZNLJSEFB-VHSXEESVSA-N	0	3	302.827	2.218	10	70		DEIEHN
CCC[C@@H]1CCN(S(=O)(=O)c2ccc(F)c(CN)c2)C1	ZINC000159433854	197353707	/nfs/dbraw/zinc/35/37/07/197353707.db2.gz	ZMJQSAOPPSSATP-LLVKDONJSA-N	0	3	300.399	2.095	10	70		DEIEHN
CC(C)CN1CCC[C@@H]1CNS(=O)(=O)Cc1ccccc1	ZINC000160303143	402340417	/nfs/dbraw/zinc/34/04/17/402340417.db2.gz	TVJPGHDVAKSMPJ-MRXNPFEDSA-N	0	3	310.463	2.226	10	70		DEIEHN
Cc1nn(C)c2ncc(CN3CC[C@@]4(O)CCCC[C@@H]4C3)cc12	ZINC000160731025	402358580	/nfs/dbraw/zinc/35/85/80/402358580.db2.gz	DHBIVVUTUAKABU-QAPCUYQASA-N	0	3	314.433	2.404	10	70		DEIEHN
O=C([C@H]1C[C@@H]1c1ccc(Br)cc1)N1CCCNCC1	ZINC000160859685	402363199	/nfs/dbraw/zinc/36/31/99/402363199.db2.gz	KNZQCBXTTMEDLG-KGLIPLIRSA-N	0	3	323.234	2.375	10	70		DEIEHN
CCC[C@@H](C(=O)N1CCN(CCc2ccccc2)CC1)N(C)C	ZINC000161350390	402384248	/nfs/dbraw/zinc/38/42/48/402384248.db2.gz	RUIOSWOJBQACJK-SFHVURJKSA-N	0	3	317.477	2.104	10	70		DEIEHN
CC[C@H](C(=O)NC[C@H](O)CN1CCCCC1)c1ccccc1	ZINC000160198791	402338127	/nfs/dbraw/zinc/33/81/27/402338127.db2.gz	VGGHZPLAMJWSLD-IRXDYDNUSA-N	0	3	304.434	2.143	10	70		DEIEHN
CCN1CCC[C@@H]1CNC(=O)N1CCO[C@H](c2ccc(C)o2)C1	ZINC000161505704	402389837	/nfs/dbraw/zinc/38/98/37/402389837.db2.gz	SMSPYRLRDNPGNY-ZBFHGGJFSA-N	0	3	321.421	2.155	10	70		DEIEHN
CCN1CCC[C@@H]1CNC(=O)N(C)CCc1ncc(C)s1	ZINC000161500078	539592149	/nfs/dbraw/zinc/59/21/49/539592149.db2.gz	KORNZSBIGRCPPG-CYBMUJFWSA-N	0	3	310.467	2.120	10	70		DEIEHN
Brc1ccccc1-c1cncn1C[C@@H]1CNCCO1	ZINC000159789023	197364246	/nfs/dbraw/zinc/36/42/46/197364246.db2.gz	AQIJGBHEKGTCNH-NSHDSACASA-N	0	3	322.206	2.301	10	70		DEIEHN
Cc1ccccc1[C@@H](C)CC(=O)NC[C@H](O)CN1CCCCC1	ZINC000160582447	402352311	/nfs/dbraw/zinc/35/23/11/402352311.db2.gz	ALBJFBFFAUMBTA-IRXDYDNUSA-N	0	3	318.461	2.452	10	70		DEIEHN
CC(C)CN(C(=O)CN1CC[C@@]2(O)CCCC[C@@H]2C1)C1CC1	ZINC000160718051	277371160	/nfs/dbraw/zinc/37/11/60/277371160.db2.gz	MDGJSSZKPFEURK-QAPCUYQASA-N	0	3	308.466	2.260	10	70		DEIEHN
CC[C@@H](C(=O)NC[C@H](O)CN1CCCCC1)c1ccccc1	ZINC000160198917	521847118	/nfs/dbraw/zinc/84/71/18/521847118.db2.gz	VGGHZPLAMJWSLD-DLBZAZTESA-N	0	3	304.434	2.143	10	70		DEIEHN
Cc1ccc(SCC(=O)NC[C@H](O)CN2CCCCC2)cc1	ZINC000160176672	197391121	/nfs/dbraw/zinc/39/11/21/197391121.db2.gz	OSBKZNPGGGSBPG-HNNXBMFYSA-N	0	3	322.474	2.050	10	70		DEIEHN
CCN1CCC[C@@H](NC(=O)NCc2ccnc(OC(C)C)c2)C1	ZINC000159735826	402329529	/nfs/dbraw/zinc/32/95/29/402329529.db2.gz	UZJGFOGPJRDPKN-OAHLLOKOSA-N	0	3	320.437	2.152	10	70		DEIEHN
CCN1CCCN(C(=O)N[C@H]2CCCC[C@@H]2n2cccn2)CC1	ZINC000159937884	402334406	/nfs/dbraw/zinc/33/44/06/402334406.db2.gz	LPQAFSYUQQHDNG-HOTGVXAUSA-N	0	3	319.453	2.104	10	70		DEIEHN
CNC(=O)[C@H](C)NCc1ccc(Br)c2cccnc12	ZINC000160318267	197399759	/nfs/dbraw/zinc/39/97/59/197399759.db2.gz	WHAOUQXBCLIZNM-VIFPVBQESA-N	0	3	322.206	2.221	10	70		DEIEHN
C[C@@H](c1nnnn1-c1ccccc1)N1CCC(c2ccn[nH]2)CC1	ZINC000160550224	402350501	/nfs/dbraw/zinc/35/05/01/402350501.db2.gz	AHNVTSMSNPPILI-ZDUSSCGKSA-N	0	3	323.404	2.326	10	70		DEIEHN
CCCCNC(=O)[C@@H](C)N[C@H](C)c1ccc(-n2ccnn2)cc1	ZINC000159935230	402333633	/nfs/dbraw/zinc/33/36/33/402333633.db2.gz	SKWKJATVCQILGP-ZIAGYGMSSA-N	0	3	315.421	2.223	10	70		DEIEHN
CC(C)CN1CCC[C@@H]1CNS(=O)(=O)CCc1ccccc1	ZINC000160290245	402340080	/nfs/dbraw/zinc/34/00/80/402340080.db2.gz	APTGOVNGTNOXIQ-QGZVFWFLSA-N	0	3	324.490	2.269	10	70		DEIEHN
CCC[C@@H](C(=O)NC[C@@H](c1cccc(OC)c1)N(C)C)N(C)C	ZINC000161300451	402381537	/nfs/dbraw/zinc/38/15/37/402381537.db2.gz	FOCYYFGDSZFRDJ-IRXDYDNUSA-N	0	3	321.465	2.144	10	70		DEIEHN
C[C@@H](C(=O)NCc1ccccc1CN(C)C)C1CCOCC1	ZINC000160179733	402337552	/nfs/dbraw/zinc/33/75/52/402337552.db2.gz	WGDVFKWJNVWEBJ-CQSZACIVSA-N	0	3	304.434	2.427	10	70		DEIEHN
CN(C)CCOc1ccccc1C(=O)NCCCC(C)(C)CO	ZINC000160377362	521801846	/nfs/dbraw/zinc/80/18/46/521801846.db2.gz	UUVGSRGFOSBQFJ-UHFFFAOYSA-N	0	3	322.449	2.156	10	70		DEIEHN
CCn1cc(C2CCN(Cc3cccc(C(N)=O)c3)CC2)cn1	ZINC000160472134	523356558	/nfs/dbraw/zinc/35/65/58/523356558.db2.gz	HGAOJNLBXWPLHO-UHFFFAOYSA-N	0	3	312.417	2.382	10	70		DEIEHN
CCC[C@@H](C(=O)N1CCN(c2cccc(C)c2)CC1)N(C)C	ZINC000161342347	291674529	/nfs/dbraw/zinc/67/45/29/291674529.db2.gz	RCHWEZSAAMLTLQ-KRWDZBQOSA-N	0	3	303.450	2.374	10	70		DEIEHN
COCCC[C@H](N)C(=O)Nc1c2nsnc2ccc1Cl	ZINC000159489862	197357416	/nfs/dbraw/zinc/35/74/16/197357416.db2.gz	BMCSYWKTZVRAQD-QMMMGPOBSA-N	0	3	314.798	2.037	10	70		DEIEHN
CCN1CCC[C@H](NC(=O)Nc2ccn(CC(F)(F)F)n2)C1	ZINC000160398290	402344299	/nfs/dbraw/zinc/34/42/99/402344299.db2.gz	PBAAPCVUKQTCHV-JTQLQIEISA-N	0	3	319.331	2.051	10	70		DEIEHN
Cc1nc(C[C@@H]2CCCN(Cc3c(C)nn(C)c3C)C2)no1	ZINC000161051421	402370690	/nfs/dbraw/zinc/37/06/90/402370690.db2.gz	GDEIDMHHMIWQGZ-AWEZNQCLSA-N	0	3	303.410	2.183	10	70		DEIEHN
CCC[C@@H](C(=O)N1CCN(c2cccc(OC)c2)CC1)N(C)C	ZINC000161217584	402378181	/nfs/dbraw/zinc/37/81/81/402378181.db2.gz	NDTPYCUWYAQOFO-KRWDZBQOSA-N	0	3	319.449	2.074	10	70		DEIEHN
CCCCNC(=O)[C@H](C)N[C@@H](C)c1ccc(-n2ccnn2)cc1	ZINC000159935116	402333764	/nfs/dbraw/zinc/33/37/64/402333764.db2.gz	SKWKJATVCQILGP-KBPBESRZSA-N	0	3	315.421	2.223	10	70		DEIEHN
Cc1ccc(C(C)(C)C(=O)NC[C@H](O)CN2CCCCC2)cc1	ZINC000160066189	526243107	/nfs/dbraw/zinc/24/31/07/526243107.db2.gz	IHSQJEAQHGAUIP-KRWDZBQOSA-N	0	3	318.461	2.236	10	70		DEIEHN
Brc1cccc(-c2cncn2C[C@@H]2CNCCO2)c1	ZINC000159596607	186129562	/nfs/dbraw/zinc/12/95/62/186129562.db2.gz	XZRFIMVUCYHUPV-ZDUSSCGKSA-N	0	3	322.206	2.301	10	70		DEIEHN
CCN(CCc1nccs1)C[C@@H](O)COCc1ccco1	ZINC000159435364	402323508	/nfs/dbraw/zinc/32/35/08/402323508.db2.gz	QLRHOKDHUQYVAT-CYBMUJFWSA-N	0	3	310.419	2.178	10	70		DEIEHN
CC(C)(C(=O)NC[C@@H](O)CN1CCCCC1)c1ccccc1F	ZINC000160373760	402342757	/nfs/dbraw/zinc/34/27/57/402342757.db2.gz	NQEIIXUVASVUEE-CQSZACIVSA-N	0	3	322.424	2.066	10	70		DEIEHN
CC(C)(C(=O)NC[C@H](O)CN1CCCCC1)c1ccccc1F	ZINC000160373623	402342850	/nfs/dbraw/zinc/34/28/50/402342850.db2.gz	NQEIIXUVASVUEE-AWEZNQCLSA-N	0	3	322.424	2.066	10	70		DEIEHN
COC(=O)[C@H]1CCCCN1CCN(C)Cc1ccc(F)cc1	ZINC000160668028	402356066	/nfs/dbraw/zinc/35/60/66/402356066.db2.gz	BEGQGZSUSMZBCE-MRXNPFEDSA-N	0	3	308.397	2.285	10	70		DEIEHN
CC(C)Nc1ncccc1C(=O)N[C@H]1CN(C(C)C)C[C@@H]1C	ZINC000161156127	402375556	/nfs/dbraw/zinc/37/55/56/402375556.db2.gz	KACQNKPWEAUPPE-ZFWWWQNUSA-N	0	3	304.438	2.360	10	70		DEIEHN
CC[C@](C)(O)CN1CCc2c(cccc2N2CCOC2=O)C1	ZINC000161294511	402381245	/nfs/dbraw/zinc/38/12/45/402381245.db2.gz	FBEYEGYVQFTVIA-KRWDZBQOSA-N	0	3	304.390	2.162	10	70		DEIEHN
CCC[C@@H](C(=O)NCc1ccnc(N2CCCC2)c1)N(C)C	ZINC000161394246	402385926	/nfs/dbraw/zinc/38/59/26/402385926.db2.gz	QYFYCPHKQFIVGA-HNNXBMFYSA-N	0	3	304.438	2.028	10	70		DEIEHN
COCCOC1CCN(CCN(C)Cc2ccc(F)cc2)CC1	ZINC000159722124	402329159	/nfs/dbraw/zinc/32/91/59/402329159.db2.gz	JHBFNNGZEOGLKF-UHFFFAOYSA-N	0	3	324.440	2.385	10	70		DEIEHN
CC(C)N(CCN(C)C)C(=O)NCc1ccn(C2CCCC2)n1	ZINC000159786137	402330819	/nfs/dbraw/zinc/33/08/19/402330819.db2.gz	SMAODOUEFRYKPE-UHFFFAOYSA-N	0	3	321.469	2.480	10	70		DEIEHN
Cc1cc(C)nc(SCC(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)n1	ZINC000161268062	524598998	/nfs/dbraw/zinc/59/89/98/524598998.db2.gz	PHZIAALKIHAZOS-FZMZJTMJSA-N	0	3	322.478	2.030	10	70		DEIEHN
CN(C)CCN1CCN(Cc2cnc(Cl)cc2Cl)CC1	ZINC000159731270	186137799	/nfs/dbraw/zinc/13/77/99/186137799.db2.gz	OACSAGODHRGUIO-UHFFFAOYSA-N	0	3	317.264	2.068	10	70		DEIEHN
O=C(NC[C@@H](O)CN1CCCCC1)C1C2CC3CC(C2)CC1C3	ZINC000160302199	197398785	/nfs/dbraw/zinc/39/87/85/197398785.db2.gz	ZQSBAKNKMXNRGC-SVXFNXITSA-N	0	3	320.477	2.022	10	70		DEIEHN
CC(C)COC[C@H](O)CN(CCc1nccs1)C(C)C	ZINC000159867805	197370435	/nfs/dbraw/zinc/37/04/35/197370435.db2.gz	XYIQISNHQQZBSF-CQSZACIVSA-N	0	3	300.468	2.430	10	70		DEIEHN
CCNCc1ccc(S(=O)(=O)N2C[C@H](C)C[C@@H]2C)s1	ZINC000159512804	197359621	/nfs/dbraw/zinc/35/96/21/197359621.db2.gz	OKPXDDJMKPKUCX-MNOVXSKESA-N	0	3	302.465	2.277	10	70		DEIEHN
C[C@@H]1CC[C@H](C(N)=O)CN1Cc1cccc2c1OC(C)(C)C2	ZINC000159574379	402326007	/nfs/dbraw/zinc/32/60/07/402326007.db2.gz	KGXGSPVLUXLBRJ-DOMZBBRYSA-N	0	3	302.418	2.486	10	70		DEIEHN
CCC[C@@H](C(=O)N1CCCN(Cc2ccccc2)CC1)N(C)C	ZINC000161349039	402383887	/nfs/dbraw/zinc/38/38/87/402383887.db2.gz	FGDBZSXLBOWGQN-SFHVURJKSA-N	0	3	317.477	2.451	10	70		DEIEHN
CC(C)CNC(=O)[C@@H](C)N[C@H](C)c1ccc(-n2ccnn2)cc1	ZINC000159931620	402333767	/nfs/dbraw/zinc/33/37/67/402333767.db2.gz	RFZSXYSMSXUUNU-ZIAGYGMSSA-N	0	3	315.421	2.079	10	70		DEIEHN
CCCCNC(=O)[C@@H](C)N[C@@H](C)c1ccc(-n2ccnn2)cc1	ZINC000159935008	402333794	/nfs/dbraw/zinc/33/37/94/402333794.db2.gz	SKWKJATVCQILGP-UONOGXRCSA-N	0	3	315.421	2.223	10	70		DEIEHN
C[C@H](C(=O)NCc1ccccc1CN(C)C)C1CCOCC1	ZINC000160179587	402337627	/nfs/dbraw/zinc/33/76/27/402337627.db2.gz	WGDVFKWJNVWEBJ-AWEZNQCLSA-N	0	3	304.434	2.427	10	70		DEIEHN
C[C@@H]1CC[C@@H](C(N)=O)CN1Cc1cnn(-c2ccc(F)cc2)c1	ZINC000159696459	186136446	/nfs/dbraw/zinc/13/64/46/186136446.db2.gz	BLCNULBGWNEIOL-TZMCWYRMSA-N	0	3	316.380	2.097	10	70		DEIEHN
COCc1nc(C)c(C(=O)N[C@H](CC(C)C)CN(C)C)s1	ZINC000160249624	197395703	/nfs/dbraw/zinc/39/57/03/197395703.db2.gz	GJOBHHBAONSQQD-GFCCVEGCSA-N	0	3	313.467	2.304	10	70		DEIEHN
C[C@H](NC(=O)[C@]1(N)[C@@H]2CCCO[C@@H]2C1(C)C)c1cccs1	ZINC000160149233	197389201	/nfs/dbraw/zinc/38/92/01/197389201.db2.gz	SKPWHUMYBVSHHZ-NGOBNIPXSA-N	0	3	308.447	2.458	10	70		DEIEHN
CCN(CCc1nccs1)C[C@H](O)COCc1ccco1	ZINC000159435238	402323217	/nfs/dbraw/zinc/32/32/17/402323217.db2.gz	QLRHOKDHUQYVAT-ZDUSSCGKSA-N	0	3	310.419	2.178	10	70		DEIEHN
CN(CCN1CCC[C@H](n2cncn2)C1)Cc1ccc(F)cc1	ZINC000159465790	402323977	/nfs/dbraw/zinc/32/39/77/402323977.db2.gz	ZUBUSFQNDHMYKR-KRWDZBQOSA-N	0	3	317.412	2.186	10	70		DEIEHN
CCn1cnnc1[C@@H]1CCCN(CCCOCC(F)(F)F)C1	ZINC000161350879	402383793	/nfs/dbraw/zinc/38/37/93/402383793.db2.gz	LAEVEYUVNJHMOG-GFCCVEGCSA-N	0	3	320.359	2.446	10	70		DEIEHN
CCC[C@H](C(=O)NC[C@@H](c1cccc(F)c1)N(C)C)N(C)C	ZINC000161299450	283785629	/nfs/dbraw/zinc/78/56/29/283785629.db2.gz	LZDRZQGOIDPELF-CVEARBPZSA-N	0	3	309.429	2.275	10	70		DEIEHN
O=C(/C=C/c1ccccc1Cl)NC[C@@H](O)CN1CCCCC1	ZINC000160151382	197389858	/nfs/dbraw/zinc/38/98/58/197389858.db2.gz	OPRZTPDZCFLFKI-XVJNWHFHSA-N	0	3	322.836	2.316	10	70		DEIEHN
O=C(/C=C/c1ccccc1Cl)NC[C@H](O)CN1CCCCC1	ZINC000160151237	197389591	/nfs/dbraw/zinc/38/95/91/197389591.db2.gz	OPRZTPDZCFLFKI-HVHJFMEUSA-N	0	3	322.836	2.316	10	70		DEIEHN
CC[C@H]1CCN(S(=O)(=O)c2ccc(CN)c(Cl)c2)C1	ZINC000159431076	197353262	/nfs/dbraw/zinc/35/32/62/197353262.db2.gz	GHHZRCSEZVSVGX-JTQLQIEISA-N	0	3	302.827	2.219	10	70		DEIEHN
CCC[C@H](C(=O)N1CCN(c2ccccc2F)CC1)N(C)C	ZINC000161154787	402375509	/nfs/dbraw/zinc/37/55/09/402375509.db2.gz	NZGJNEUQIQRWLB-MRXNPFEDSA-N	0	3	307.413	2.205	10	70		DEIEHN
CCC[C@H](C(=O)N1CCCN(Cc2ccccc2)CC1)N(C)C	ZINC000161349181	402383823	/nfs/dbraw/zinc/38/38/23/402383823.db2.gz	FGDBZSXLBOWGQN-GOSISDBHSA-N	0	3	317.477	2.451	10	70		DEIEHN
Cc1nn(-c2ccccc2)cc1CN1C[C@H](C(N)=O)CC[C@@H]1C	ZINC000159532461	402325181	/nfs/dbraw/zinc/32/51/81/402325181.db2.gz	JULHMLITUBKBHF-DZGCQCFKSA-N	0	3	312.417	2.267	10	70		DEIEHN
O=C(NC[C@H](O)CN1CCCCC1)c1cccc2ccccc21	ZINC000160362388	267454731	/nfs/dbraw/zinc/45/47/31/267454731.db2.gz	VJPSNSNIDULUHH-INIZCTEOSA-N	0	3	312.413	2.416	10	70		DEIEHN
CCC[C@@H](C(=O)N(C)Cc1ccc(OC)cc1OC)N(C)C	ZINC000161221091	276020492	/nfs/dbraw/zinc/02/04/92/276020492.db2.gz	FKFPZZNYGAAILN-HNNXBMFYSA-N	0	3	308.422	2.393	10	70		DEIEHN
CCN1CCC[C@@H]1CN(C)C(=O)c1ccc(N(C)C)cc1F	ZINC000160002288	521631149	/nfs/dbraw/zinc/63/11/49/521631149.db2.gz	ZWOPMBJOHUWQQS-CQSZACIVSA-N	0	3	307.413	2.448	10	70		DEIEHN
CC[C@@H](CO)N1CCN(c2ccnc3c(F)cc(F)cc23)CC1	ZINC000159742053	186139201	/nfs/dbraw/zinc/13/92/01/186139201.db2.gz	RERNJULOXSGSBH-ZDUSSCGKSA-N	0	3	321.371	2.406	10	70		DEIEHN
CCN(Cc1cccs1)C(=O)[C@]1(N)[C@H]2CCO[C@@H]2C1(C)C	ZINC000160241480	197395081	/nfs/dbraw/zinc/39/50/81/197395081.db2.gz	VHZUWFIHDFHNOU-HEHGZKQESA-N	0	3	308.447	2.239	10	70		DEIEHN
CNC(=O)c1cccnc1N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000160230537	197394187	/nfs/dbraw/zinc/39/41/87/197394187.db2.gz	ILSVKWXOTFSTCM-YOEHRIQHSA-N	0	3	324.428	2.374	10	70		DEIEHN
CCSCC[C@H](C)N[C@@H]1CC(=O)N(C(CC)CC)C1=O	ZINC000160077363	197383935	/nfs/dbraw/zinc/38/39/35/197383935.db2.gz	MFPWWKHKJHZFFV-WCQYABFASA-N	0	3	300.468	2.424	10	70		DEIEHN
CC(C)(C)[C@@H]1CCN(S(=O)(=O)c2ccc(F)c(CN)c2)C1	ZINC000159419724	197352562	/nfs/dbraw/zinc/35/25/62/197352562.db2.gz	XGJZPFKGYJVDMV-GFCCVEGCSA-N	0	3	314.426	2.341	10	70		DEIEHN
COc1ccc(CN2CCC(c3ccnn3CCO)CC2)cc1	ZINC000160554064	402350625	/nfs/dbraw/zinc/35/06/25/402350625.db2.gz	LLXRZKCMSFNKNK-UHFFFAOYSA-N	0	3	315.417	2.264	10	70		DEIEHN
CC(C)Nc1ncccc1C(=O)N[C@H]1CN(C(C)C)C[C@H]1C	ZINC000161155995	402375477	/nfs/dbraw/zinc/37/54/77/402375477.db2.gz	KACQNKPWEAUPPE-HIFRSBDPSA-N	0	3	304.438	2.360	10	70		DEIEHN
CCC[C@H](C(=O)NCCc1cnn(-c2ccccc2)c1)N(C)C	ZINC000161373041	402385104	/nfs/dbraw/zinc/38/51/04/402385104.db2.gz	WLROCAYMFXSDOJ-QGZVFWFLSA-N	0	3	314.433	2.261	10	70		DEIEHN
Cc1ccccc1[C@@H]1C[C@H]1C(=O)NC[C@H](O)CN1CCCCC1	ZINC000159933747	402333572	/nfs/dbraw/zinc/33/35/72/402333572.db2.gz	AYYJQYWJJXMAKU-RYQLBKOJSA-N	0	3	316.445	2.062	10	70		DEIEHN
Cc1ccc(C(=O)NC[C@H](O)CN2CCCCC2)cc1Cl	ZINC000160240224	526178543	/nfs/dbraw/zinc/17/85/43/526178543.db2.gz	LRRWCVCDMHLVHB-AWEZNQCLSA-N	0	3	310.825	2.225	10	70		DEIEHN
COCc1nc(C)c(C(=O)N[C@@H](CC(C)C)CN(C)C)s1	ZINC000160249494	197395780	/nfs/dbraw/zinc/39/57/80/197395780.db2.gz	GJOBHHBAONSQQD-LBPRGKRZSA-N	0	3	313.467	2.304	10	70		DEIEHN
O=C(NC[C@H](O)CN1CCCCC1)c1c(F)cccc1Cl	ZINC000160272767	197396813	/nfs/dbraw/zinc/39/68/13/197396813.db2.gz	ODIOKGVCVVIQPK-NSHDSACASA-N	0	3	314.788	2.056	10	70		DEIEHN
CC[C@@H]1CCN([C@@H](C)C(=O)Nc2cccc(C(N)=S)c2)C1	ZINC000159908851	197372688	/nfs/dbraw/zinc/37/26/88/197372688.db2.gz	FZXZFNPQXDRGJR-NWDGAFQWSA-N	0	3	305.447	2.380	10	70		DEIEHN
C[C@H](c1nnnn1-c1ccccc1)N1CCC(c2ccn[nH]2)CC1	ZINC000160550368	402350650	/nfs/dbraw/zinc/35/06/50/402350650.db2.gz	AHNVTSMSNPPILI-CYBMUJFWSA-N	0	3	323.404	2.326	10	70		DEIEHN
C/C(=C/C(=O)NC[C@H](O)CN1CCCCC1)c1cccc(F)c1	ZINC000160563734	402351135	/nfs/dbraw/zinc/35/11/35/402351135.db2.gz	LXTCBYFGIYXUAP-QXSWTLKVSA-N	0	3	320.408	2.192	10	70		DEIEHN
O=C([C@H]1C[C@H]1c1ccc(Br)cc1)N1CCCNCC1	ZINC000160859546	402363120	/nfs/dbraw/zinc/36/31/20/402363120.db2.gz	KNZQCBXTTMEDLG-KBPBESRZSA-N	0	3	323.234	2.375	10	70		DEIEHN
Cc1nn(C)c2ncc(CN3CC[C@]4(O)CCCC[C@@H]4C3)cc12	ZINC000160730905	197434963	/nfs/dbraw/zinc/43/49/63/197434963.db2.gz	DHBIVVUTUAKABU-CRAIPNDOSA-N	0	3	314.433	2.404	10	70		DEIEHN
CCNCc1ccc(S(=O)(=O)N2C[C@@H](C)C[C@@H]2C)s1	ZINC000159512919	197360335	/nfs/dbraw/zinc/36/03/35/197360335.db2.gz	OKPXDDJMKPKUCX-QWRGUYRKSA-N	0	3	302.465	2.277	10	70		DEIEHN
Cc1nc(C[C@H]2CCCN(Cc3c(C)nn(C)c3C)C2)no1	ZINC000161051291	402370964	/nfs/dbraw/zinc/37/09/64/402370964.db2.gz	GDEIDMHHMIWQGZ-CQSZACIVSA-N	0	3	303.410	2.183	10	70		DEIEHN
CCN1CCC[C@H]1CNC(=O)N1CCO[C@H](c2ccc(C)o2)C1	ZINC000161505851	402390098	/nfs/dbraw/zinc/39/00/98/402390098.db2.gz	SMSPYRLRDNPGNY-HOCLYGCPSA-N	0	3	321.421	2.155	10	70		DEIEHN
Cc1cc(C)nc(SCC(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)n1	ZINC000161267924	524600078	/nfs/dbraw/zinc/60/00/78/524600078.db2.gz	PHZIAALKIHAZOS-SMDDNHRTSA-N	0	3	322.478	2.030	10	70		DEIEHN
CC1(OCc2nc(-c3cccc(Br)c3)no2)CNC1	ZINC000161048168	197459819	/nfs/dbraw/zinc/45/98/19/197459819.db2.gz	PFJCAIAYJWXGHG-UHFFFAOYSA-N	0	3	324.178	2.378	10	70		DEIEHN
CC(C)[C@@H]1CCN(CC(=O)Nc2ccc(C(N)=S)cc2)C1	ZINC000159891569	197372105	/nfs/dbraw/zinc/37/21/05/197372105.db2.gz	KHOUMAUUZWMTAI-CYBMUJFWSA-N	0	3	305.447	2.237	10	70		DEIEHN
C[C@H]1CC[C@H](C(N)=O)CN1Cc1cccc2c1OC(C)(C)C2	ZINC000159574507	402325999	/nfs/dbraw/zinc/32/59/99/402325999.db2.gz	KGXGSPVLUXLBRJ-WFASDCNBSA-N	0	3	302.418	2.486	10	70		DEIEHN
Cc1ccsc1CNC(=O)[C@]1(N)[C@@H]2CCCO[C@@H]2C1(C)C	ZINC000160679258	402356664	/nfs/dbraw/zinc/35/66/64/402356664.db2.gz	JOFYEUQCIAGWQD-PVXIVEMSSA-N	0	3	308.447	2.205	10	70		DEIEHN
CC(C)[C@H](C(=O)NC[C@H](O)CN1CCCCC1)c1ccccc1	ZINC000160206385	519809520	/nfs/dbraw/zinc/80/95/20/519809520.db2.gz	OADVHFWVMPCKQG-ROUUACIJSA-N	0	3	318.461	2.389	10	70		DEIEHN
C[C@H]1CC[C@@H](C(N)=O)CN1Cc1cnn(-c2ccc(F)cc2)c1	ZINC000159696599	186136335	/nfs/dbraw/zinc/13/63/35/186136335.db2.gz	BLCNULBGWNEIOL-GXTWGEPZSA-N	0	3	316.380	2.097	10	70		DEIEHN
CCSCC[C@H](C)NCc1ccc(S(=O)(=O)N(C)C)o1	ZINC000159943140	197374832	/nfs/dbraw/zinc/37/48/32/197374832.db2.gz	HSEZPXQKAWLAKE-NSHDSACASA-N	0	3	320.480	2.151	10	70		DEIEHN
C[C@@H]1OCC[C@@H]1N(C)CCOc1ccc(CC(N)=S)cc1	ZINC000159489811	197357757	/nfs/dbraw/zinc/35/77/57/197357757.db2.gz	RNGLOXVLOICLFT-WFASDCNBSA-N	0	3	308.447	2.003	10	70		DEIEHN
CC[C@](C)(O)CN1CCC[C@H](N(C)C(=O)OC(C)(C)C)C1	ZINC000160821513	402361921	/nfs/dbraw/zinc/36/19/21/402361921.db2.gz	ZPSMRUWXXHLWKE-BBRMVZONSA-N	0	3	300.443	2.479	10	70		DEIEHN
CCC[C@H](C(=O)N1CCN(Cc2ccccc2)CC1)N(C)C	ZINC000161140724	402374781	/nfs/dbraw/zinc/37/47/81/402374781.db2.gz	LMFSBUARFQJPSR-QGZVFWFLSA-N	0	3	303.450	2.061	10	70		DEIEHN
CCn1cnnc1[C@@H]1CCCN(C[C@H](O)c2ccc(F)cc2)C1	ZINC000161286130	402380492	/nfs/dbraw/zinc/38/04/92/402380492.db2.gz	REXNIQCIEHZVOL-ZBFHGGJFSA-N	0	3	318.396	2.350	10	70		DEIEHN
CCC[C@H](C(=O)NCc1ccnc(N2CCCC2)c1)N(C)C	ZINC000161394359	402385579	/nfs/dbraw/zinc/38/55/79/402385579.db2.gz	QYFYCPHKQFIVGA-OAHLLOKOSA-N	0	3	304.438	2.028	10	70		DEIEHN
C[C@H](CC(=O)NC[C@H](O)CN1CCCCC1)c1ccccc1F	ZINC000160212904	402338032	/nfs/dbraw/zinc/33/80/32/402338032.db2.gz	SJMGDHMGUWFJHK-CABCVRRESA-N	0	3	322.424	2.282	10	70		DEIEHN
CC[C@H](C(=O)N1C[C@@H](c2ccc(F)cc2)O[C@@H](C)C1)N(C)C	ZINC000159978107	276542129	/nfs/dbraw/zinc/54/21/29/276542129.db2.gz	UERCIXGZUAHWHM-MAZHCROVSA-N	0	3	308.397	2.454	10	70		DEIEHN
Brc1cccc(-c2cncn2C[C@H]2CNCCO2)c1	ZINC000159596751	186129517	/nfs/dbraw/zinc/12/95/17/186129517.db2.gz	XZRFIMVUCYHUPV-CYBMUJFWSA-N	0	3	322.206	2.301	10	70		DEIEHN
Brc1ccc(-c2cncn2C[C@H]2CNCCO2)cc1	ZINC000159597020	186129850	/nfs/dbraw/zinc/12/98/50/186129850.db2.gz	ITUXUZPOHDHJIM-CYBMUJFWSA-N	0	3	322.206	2.301	10	70		DEIEHN
CCN(CC)C(=O)[C@@H](C)N[C@H](C)c1ccc(-n2ccnn2)cc1	ZINC000159936887	197375152	/nfs/dbraw/zinc/37/51/52/197375152.db2.gz	HYKSOUQEXWLNBG-ZIAGYGMSSA-N	0	3	315.421	2.175	10	70		DEIEHN
C[C@H]1C[C@H](C)N(S(=O)(=O)c2cc(CN)ccc2Cl)C1	ZINC000159514024	197359527	/nfs/dbraw/zinc/35/95/27/197359527.db2.gz	SYWCKJZNLJSEFB-UWVGGRQHSA-N	0	3	302.827	2.218	10	70		DEIEHN
CCN(CC)c1nc(NC)nc(N2CCSC(C)(C)C2)n1	ZINC000159367792	197348333	/nfs/dbraw/zinc/34/83/33/197348333.db2.gz	UAWDVTPJNHFAHW-UHFFFAOYSA-N	0	3	310.471	2.091	10	70		DEIEHN
CC(C)c1nc(N[C@H]2CN(C(C)C)C[C@H]2C)nc(N(C)C)n1	ZINC000160467322	402346841	/nfs/dbraw/zinc/34/68/41/402346841.db2.gz	PSWMWQOOYDIJRK-OLZOCXBDSA-N	0	3	306.458	2.202	10	70		DEIEHN
CC(C)CN1CCC[C@@H]1CNC(=O)c1ccc([S@@](C)=O)cc1	ZINC000160593217	402352898	/nfs/dbraw/zinc/35/28/98/402352898.db2.gz	UTWDLZXZHWKPIZ-QRQCRPRQSA-N	0	3	322.474	2.274	10	70		DEIEHN
CCN1CCCC[C@@H]1CNC(=O)N1CCC(c2cc[nH]n2)CC1	ZINC000159624170	402327017	/nfs/dbraw/zinc/32/70/17/402327017.db2.gz	BLVBXVYSBGKGKM-OAHLLOKOSA-N	0	3	319.453	2.173	10	70		DEIEHN
CCN1CCCC[C@H]1CNC(=O)N1CCC(c2cc[nH]n2)CC1	ZINC000159624276	402327068	/nfs/dbraw/zinc/32/70/68/402327068.db2.gz	BLVBXVYSBGKGKM-HNNXBMFYSA-N	0	3	319.453	2.173	10	70		DEIEHN
CC[C@@H](C(=O)NCc1ccc(N2CCCCC2=O)cc1)N(C)C	ZINC000161475840	521849680	/nfs/dbraw/zinc/84/96/80/521849680.db2.gz	LXXQKUPGFAEOER-INIZCTEOSA-N	0	3	317.433	2.160	10	70		DEIEHN
Cc1nn(-c2ccccc2)cc1CN1C[C@@H](C(N)=O)CC[C@@H]1C	ZINC000159532608	282244809	/nfs/dbraw/zinc/24/48/09/282244809.db2.gz	JULHMLITUBKBHF-ZFWWWQNUSA-N	0	3	312.417	2.267	10	70		DEIEHN
C[C@H](c1cccs1)N(C)C(=O)[C@]1(N)[C@@H]2CCO[C@@H]2C1(C)C	ZINC000160269781	197396927	/nfs/dbraw/zinc/39/69/27/197396927.db2.gz	GVUOXPZSXMYQAF-RLSLPTNOSA-N	0	3	308.447	2.410	10	70		DEIEHN
CC[C@H]1CCN([C@@H](C)C(=O)Nc2ccccc2C(N)=S)C1	ZINC000159902211	197371751	/nfs/dbraw/zinc/37/17/51/197371751.db2.gz	YTPJBFHEVZVLRC-RYUDHWBXSA-N	0	3	305.447	2.380	10	70		DEIEHN
Cc1ccc(CNC(=O)[C@]2(N)[C@@H]3CCCO[C@@H]3C2(C)C)s1	ZINC000160439335	402345406	/nfs/dbraw/zinc/34/54/06/402345406.db2.gz	HOOREDARYJELFV-DVOMOZLQSA-N	0	3	308.447	2.205	10	70		DEIEHN
CC(C)(C(=O)NC[C@H](O)CN1CCCCC1)c1ccc(F)cc1	ZINC000160636855	402355011	/nfs/dbraw/zinc/35/50/11/402355011.db2.gz	MQVIBMRFHAGNMJ-INIZCTEOSA-N	0	3	322.424	2.066	10	70		DEIEHN
CCC[C@H](C(=O)NCc1cc(OC)c(OC)c(OC)c1)N(C)C	ZINC000161277504	402379845	/nfs/dbraw/zinc/37/98/45/402379845.db2.gz	GVUXBZHHXMZTEX-CYBMUJFWSA-N	0	3	324.421	2.059	10	70		DEIEHN
CCC[C@H](C(=O)NCc1cnn(-c2ccccc2)c1)N(C)C	ZINC000161371060	520982494	/nfs/dbraw/zinc/98/24/94/520982494.db2.gz	LFCZHCILTMAAAC-MRXNPFEDSA-N	0	3	300.406	2.219	10	70		DEIEHN
C[C@@H]1C[C@H]1CNS(=O)(=O)c1ccc(Cl)c(CN)c1Cl	ZINC000160897414	197447925	/nfs/dbraw/zinc/44/79/25/197447925.db2.gz	MFMZSTDTIFTWNE-SFYZADRCSA-N	0	3	323.245	2.386	10	70		DEIEHN
C/C(=C/C(=O)NC[C@H](O)CN1CCCCC1)c1ccc(F)cc1	ZINC000160024800	197379970	/nfs/dbraw/zinc/37/99/70/197379970.db2.gz	RAFJGXAQJCUWMU-IFCKCIONSA-N	0	3	320.408	2.192	10	70		DEIEHN
C[C@@H](N[C@H](C)c1ccc(-n2ccnn2)cc1)C(=O)NC(C)(C)C	ZINC000159953969	197376338	/nfs/dbraw/zinc/37/63/38/197376338.db2.gz	JVTYROGEVYEQMD-CHWSQXEVSA-N	0	3	315.421	2.221	10	70		DEIEHN
CC[C@H]1CCN([C@@H](C)C(=O)Nc2ccc(C(N)=S)cc2)C1	ZINC000159907114	197372555	/nfs/dbraw/zinc/37/25/55/197372555.db2.gz	RYXFKYZZLHOGGT-RYUDHWBXSA-N	0	3	305.447	2.380	10	70		DEIEHN
Cc1cc(Cl)ccc1C(=O)NC[C@H](O)CN1CCCCC1	ZINC000160535603	402349841	/nfs/dbraw/zinc/34/98/41/402349841.db2.gz	ARMBMXQCQFRDRS-AWEZNQCLSA-N	0	3	310.825	2.225	10	70		DEIEHN
COCCN(C)CCNC(=O)c1[nH]c2ccc(C)cc2c1C	ZINC000161175220	402376475	/nfs/dbraw/zinc/37/64/75/402376475.db2.gz	OBGLTQFFKZZFIP-UHFFFAOYSA-N	0	3	303.406	2.093	10	70		DEIEHN
CCC[C@@H](C(=O)NCc1ccc(N2CCCC2)nc1)N(C)C	ZINC000161464180	402388711	/nfs/dbraw/zinc/38/87/11/402388711.db2.gz	JXSUUVKOIVQKLP-HNNXBMFYSA-N	0	3	304.438	2.028	10	70		DEIEHN
CCC[C@H](C(=O)N1CCN(CCc2ccccc2)CC1)N(C)C	ZINC000161350508	402384117	/nfs/dbraw/zinc/38/41/17/402384117.db2.gz	RUIOSWOJBQACJK-GOSISDBHSA-N	0	3	317.477	2.104	10	70		DEIEHN
CCC[C@H](C(=O)NCc1ccccc1Cn1cccn1)N(C)C	ZINC000161350900	402384286	/nfs/dbraw/zinc/38/42/86/402384286.db2.gz	QLWHUHAERVJBRI-QGZVFWFLSA-N	0	3	314.433	2.278	10	70		DEIEHN
CCC[C@H](C(=O)N(C)Cc1ccc(OC)cc1OC)N(C)C	ZINC000161221224	276037174	/nfs/dbraw/zinc/03/71/74/276037174.db2.gz	FKFPZZNYGAAILN-OAHLLOKOSA-N	0	3	308.422	2.393	10	70		DEIEHN
CCC[C@@H](C(=O)NCc1ccc(F)c(CN(C)C)c1)N(C)C	ZINC000159633184	186132181	/nfs/dbraw/zinc/13/21/81/186132181.db2.gz	NAHQOJQQCPNDMU-INIZCTEOSA-N	0	3	309.429	2.234	10	70		DEIEHN
O=C(NC[C@H](O)CN1CCCCC1)C1C2CC3CC(C2)CC1C3	ZINC000160302362	197398835	/nfs/dbraw/zinc/39/88/35/197398835.db2.gz	ZQSBAKNKMXNRGC-NFSPANSCSA-N	0	3	320.477	2.022	10	70		DEIEHN
CC(C)(CO)CNCc1cccc(NC(=O)C(F)(F)F)c1	ZINC000160125179	197387970	/nfs/dbraw/zinc/38/79/70/197387970.db2.gz	MHSONLGRJIRAGS-UHFFFAOYSA-N	0	3	304.312	2.296	10	70		DEIEHN
O=C(NC[C@H](O)CN1CCCCC1)c1cc2ccccc2o1	ZINC000160005352	197379425	/nfs/dbraw/zinc/37/94/25/197379425.db2.gz	MBXOVLOBWYACEG-AWEZNQCLSA-N	0	3	302.374	2.009	10	70		DEIEHN
Cc1ccc2cc(C(=O)NC[C@H](O)CN3CCCCC3)[nH]c2c1	ZINC000159973843	197377989	/nfs/dbraw/zinc/37/79/89/197377989.db2.gz	RHLASJYWPFKCTB-HNNXBMFYSA-N	0	3	315.417	2.053	10	70		DEIEHN
CC[C@H]1CCN(S(=O)(=O)c2ccc(CN)cc2Cl)C1	ZINC000159432438	197353666	/nfs/dbraw/zinc/35/36/66/197353666.db2.gz	UDJZINLRXHAKAR-JTQLQIEISA-N	0	3	302.827	2.219	10	70		DEIEHN
CCN(CCc1nccs1)C[C@H](O)COc1ccccc1	ZINC000159437108	197353304	/nfs/dbraw/zinc/35/33/04/197353304.db2.gz	PRVZUSHAEGZYRM-AWEZNQCLSA-N	0	3	306.431	2.447	10	70		DEIEHN
CCC[C@@H](C(=O)N1CCN(Cc2ccccc2)CC1)N(C)C	ZINC000161140560	402374528	/nfs/dbraw/zinc/37/45/28/402374528.db2.gz	LMFSBUARFQJPSR-KRWDZBQOSA-N	0	3	303.450	2.061	10	70		DEIEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)c2c(Cl)nc3ccccn32)C1	ZINC000161283254	402380472	/nfs/dbraw/zinc/38/04/72/402380472.db2.gz	JQCFPEKCAXQFHR-NEPJUHHUSA-N	0	3	320.824	2.446	10	70		DEIEHN
CCC[C@H](C(=O)N(CC)Cc1ccc2c(c1)OCO2)N(C)C	ZINC000161405368	276037541	/nfs/dbraw/zinc/03/75/41/276037541.db2.gz	CUCYPHNDKMQMNQ-CQSZACIVSA-N	0	3	306.406	2.494	10	70		DEIEHN
C[C@@H](NC(=O)[C@]1(N)[C@@H]2CCCO[C@@H]2C1(C)C)c1cccs1	ZINC000160149378	197388720	/nfs/dbraw/zinc/38/87/20/197388720.db2.gz	SKPWHUMYBVSHHZ-RLSLPTNOSA-N	0	3	308.447	2.458	10	70		DEIEHN
C[C@H]1OCC[C@H]1N(C)c1nc2sccn2c1CNC1CC1	ZINC000160091451	197385283	/nfs/dbraw/zinc/38/52/83/197385283.db2.gz	SNUKWSSCFIAZRA-ZYHUDNBSSA-N	0	3	306.435	2.261	10	70		DEIEHN
Cc1ccsc1CNC(=O)[C@]1(N)[C@H]2CCCO[C@@H]2C1(C)C	ZINC000160679495	402356744	/nfs/dbraw/zinc/35/67/44/402356744.db2.gz	JOFYEUQCIAGWQD-DETPVDSQSA-N	0	3	308.447	2.205	10	70		DEIEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)[C@](C)(O)[C@@H](C)c2ccccc2)C1	ZINC000161091130	402372553	/nfs/dbraw/zinc/37/25/53/402372553.db2.gz	FYFNSAXNCOBRNI-WXSAJPJJSA-N	0	3	318.461	2.386	10	70		DEIEHN
CCN1CCC[C@H](NC(=O)NCc2cc(C)cc(OC)c2)C1	ZINC000159734466	402329773	/nfs/dbraw/zinc/32/97/73/402329773.db2.gz	JMZHFZGHWXOJLX-HNNXBMFYSA-N	0	3	305.422	2.287	10	70		DEIEHN
CCC[C@H](C(=O)NCCCN1CCc2ccccc2C1)N(C)C	ZINC000161504497	402389963	/nfs/dbraw/zinc/38/99/63/402389963.db2.gz	RQQJNZKQTCTGIW-GOSISDBHSA-N	0	3	317.477	2.281	10	70		DEIEHN
N[C@@H](Cc1ccc(F)cc1Cl)[C@@H]1CCCCS1(=O)=O	ZINC000160568185	197423168	/nfs/dbraw/zinc/42/31/68/197423168.db2.gz	DKQLEYUSTSRHCJ-STQMWFEESA-N	0	3	305.802	2.316	10	70		DEIEHN
CC(C)N(C)C(=O)[C@@H](C)N[C@@H](C)c1ccc(-n2ccnn2)cc1	ZINC000159874783	197369863	/nfs/dbraw/zinc/36/98/63/197369863.db2.gz	SAESHAMELCAYPX-UONOGXRCSA-N	0	3	315.421	2.173	10	70		DEIEHN
CC(C)(C)[C@@H]1CCN(S(=O)(=O)Cc2ccccc2CN)C1	ZINC000159419447	197352569	/nfs/dbraw/zinc/35/25/69/197352569.db2.gz	QJYCZBFYRBAFBW-OAHLLOKOSA-N	0	3	310.463	2.343	10	70		DEIEHN
CC(C)[C@H]1CCN(S(=O)(=O)c2ccc(CN)c(Cl)c2)C1	ZINC000159425621	197352291	/nfs/dbraw/zinc/35/22/91/197352291.db2.gz	KMOHGFPRAFKDSE-LBPRGKRZSA-N	0	3	316.854	2.465	10	70		DEIEHN
C[C@@H]1C[C@H](C)N(S(=O)(=O)c2cc(CN)ccc2Cl)C1	ZINC000159513899	197359617	/nfs/dbraw/zinc/35/96/17/197359617.db2.gz	SYWCKJZNLJSEFB-ZJUUUORDSA-N	0	3	302.827	2.218	10	70		DEIEHN
CCC[C@@H](C(=O)N1CCN(c2ccc(F)cc2)CC1)N(C)C	ZINC000161169018	402376056	/nfs/dbraw/zinc/37/60/56/402376056.db2.gz	HZVQAVVYZHMNJG-INIZCTEOSA-N	0	3	307.413	2.205	10	70		DEIEHN
Cc1ccccc1SCC(=O)NC[C@@H](O)CN1CCCCC1	ZINC000160055133	402335795	/nfs/dbraw/zinc/33/57/95/402335795.db2.gz	KJVOSGNOPOJOHT-OAHLLOKOSA-N	0	3	322.474	2.050	10	70		DEIEHN
CCC[C@@H](C(=O)NCc1cccc(Cn2ccnc2)c1)N(C)C	ZINC000161496174	402389390	/nfs/dbraw/zinc/38/93/90/402389390.db2.gz	QSMGTJAKZGGMNA-KRWDZBQOSA-N	0	3	314.433	2.278	10	70		DEIEHN
CCC[C@H](C(=O)NC[C@@H](c1ccco1)N1CCCC1)N(C)C	ZINC000160394423	520980684	/nfs/dbraw/zinc/98/06/84/520980684.db2.gz	DBKHWMAFBDHDBP-CABCVRRESA-N	0	3	307.438	2.263	10	70		DEIEHN
CCC[C@H](C(=O)NCc1ccc(F)c(CN(C)C)c1)N(C)C	ZINC000159633312	186132107	/nfs/dbraw/zinc/13/21/07/186132107.db2.gz	NAHQOJQQCPNDMU-MRXNPFEDSA-N	0	3	309.429	2.234	10	70		DEIEHN
O=C(NC[C@H](O)CN1CCCCC1)c1ccc(F)c(Cl)c1	ZINC000160334932	402341351	/nfs/dbraw/zinc/34/13/51/402341351.db2.gz	QSWYPXXCWDNJBR-LBPRGKRZSA-N	0	3	314.788	2.056	10	70		DEIEHN
Cc1ccc(/C=C/CC(=O)NC[C@H](O)CN2CCCCC2)cc1	ZINC000160507927	402348765	/nfs/dbraw/zinc/34/87/65/402348765.db2.gz	ORJVMCIUHFYWFK-QWNKOJSDSA-N	0	3	316.445	2.361	10	70		DEIEHN
CC1(C)[C@@H]2OCCC[C@@H]2[C@]1(N)C(=O)Nc1ccc(Cl)nc1	ZINC000160743562	402359018	/nfs/dbraw/zinc/35/90/18/402359018.db2.gz	WZLJMKQYGROZGR-NVBFEUDRSA-N	0	3	309.797	2.206	10	70		DEIEHN
CCC1(CNC(=O)NC[C@H]2CCCN2CCOC)CCCC1	ZINC000161097653	402372585	/nfs/dbraw/zinc/37/25/85/402372585.db2.gz	NJURFGWYRVPPEE-OAHLLOKOSA-N	0	3	311.470	2.367	10	70		DEIEHN
CCC[C@H](C(=O)NCc1ccc(N2CCCC2)nc1)N(C)C	ZINC000161464267	402388668	/nfs/dbraw/zinc/38/86/68/402388668.db2.gz	JXSUUVKOIVQKLP-OAHLLOKOSA-N	0	3	304.438	2.028	10	70		DEIEHN
CCC[C@@H](C(=O)NCc1ccccc1Cn1cccn1)N(C)C	ZINC000161350753	402383899	/nfs/dbraw/zinc/38/38/99/402383899.db2.gz	QLWHUHAERVJBRI-KRWDZBQOSA-N	0	3	314.433	2.278	10	70		DEIEHN
CNC(=O)c1cccnc1N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000160230397	402338520	/nfs/dbraw/zinc/33/85/20/402338520.db2.gz	ILSVKWXOTFSTCM-PBHICJAKSA-N	0	3	324.428	2.374	10	70		DEIEHN
CCCCNc1ccccc1C(=O)N1CCO[C@@H](CN(C)C)C1	ZINC000160450501	520697538	/nfs/dbraw/zinc/69/75/38/520697538.db2.gz	NXXQHSLRZQHTFF-HNNXBMFYSA-N	0	3	319.449	2.301	10	70		DEIEHN
CCOC(C)(C)CNS(=O)(=O)c1cccc([C@@H](C)NC)c1	ZINC000159553378	186126877	/nfs/dbraw/zinc/12/68/77/186126877.db2.gz	BAZOCQNEMPRAGU-GFCCVEGCSA-N	0	3	314.451	2.060	10	70		DEIEHN
CCOC(C)(C)CNS(=O)(=O)c1cccc([C@H](C)NC)c1	ZINC000159553503	186126999	/nfs/dbraw/zinc/12/69/99/186126999.db2.gz	BAZOCQNEMPRAGU-LBPRGKRZSA-N	0	3	314.451	2.060	10	70		DEIEHN
CC(C)CN1CCC[C@@H]1CNS(=O)(=O)c1cccc(F)c1	ZINC000160296284	197398340	/nfs/dbraw/zinc/39/83/40/197398340.db2.gz	QSAUQENPODBVBK-CQSZACIVSA-N	0	3	314.426	2.224	10	70		DEIEHN
Cc1ccsc1CN(C)C(=O)[C@]1(N)[C@H]2CCO[C@@H]2C1(C)C	ZINC000160240433	197395264	/nfs/dbraw/zinc/39/52/64/197395264.db2.gz	NYOLPSSWWGOJMV-DETPVDSQSA-N	0	3	308.447	2.157	10	70		DEIEHN
O=C(NC[C@H](O)CN1CCCCC1)c1coc2ccccc12	ZINC000160343695	402341557	/nfs/dbraw/zinc/34/15/57/402341557.db2.gz	BXEANEXHTBKOOC-ZDUSSCGKSA-N	0	3	302.374	2.009	10	70		DEIEHN
CNC(=O)c1ccc(CN2CC[C@]3(O)CCCC[C@@H]3C2)cc1	ZINC000161027038	402370037	/nfs/dbraw/zinc/37/00/37/402370037.db2.gz	GVRPPDRGYPHNAR-SJLPKXTDSA-N	0	3	302.418	2.173	10	70		DEIEHN
CCN1CCC[C@@H](NC(=O)NCc2cc(C)cc(OC)c2)C1	ZINC000159734588	402329695	/nfs/dbraw/zinc/32/96/95/402329695.db2.gz	JMZHFZGHWXOJLX-OAHLLOKOSA-N	0	3	305.422	2.287	10	70		DEIEHN
CCN1CCN(CCCNC(=O)[C@@H]2C[C@H]2C2CCCCC2)CC1	ZINC000160442655	535696077	/nfs/dbraw/zinc/69/60/77/535696077.db2.gz	BRBFELALVRFZEK-ZWKOTPCHSA-N	0	3	321.509	2.347	10	70		DEIEHN
O=C(CC1CCCC1)NC1CCN(CCn2ccnc2)CC1	ZINC000159814228	539584402	/nfs/dbraw/zinc/58/44/02/539584402.db2.gz	JEDAJFSDXXVCCP-UHFFFAOYSA-N	0	3	304.438	2.044	10	70		DEIEHN
CCN1CCC[C@H]1CNC(=O)N(C)CCc1ncc(C)s1	ZINC000161500195	539591891	/nfs/dbraw/zinc/59/18/91/539591891.db2.gz	KORNZSBIGRCPPG-ZDUSSCGKSA-N	0	3	310.467	2.120	10	70		DEIEHN
CCN1CCN(C[C@@H]2CC(c3ccc(Cl)cc3)=NO2)CC1	ZINC000159725034	186137158	/nfs/dbraw/zinc/13/71/58/186137158.db2.gz	XWGYAOHJFJXKFU-HNNXBMFYSA-N	0	3	307.825	2.471	10	70		DEIEHN
CCSc1cccc(N(C)CC2(O)CCOCC2)c1CN	ZINC000161215665	197475010	/nfs/dbraw/zinc/47/50/10/197475010.db2.gz	ZKGIBWDEBLZNIT-UHFFFAOYSA-N	0	3	310.463	2.235	10	70		DEIEHN
CCC[C@H](C(=O)N1CCN(c2cccc(OC)c2)CC1)N(C)C	ZINC000161217713	291673351	/nfs/dbraw/zinc/67/33/51/291673351.db2.gz	NDTPYCUWYAQOFO-QGZVFWFLSA-N	0	3	319.449	2.074	10	70		DEIEHN
CCC[C@@H](C(=O)N1CCc2cc(OC)c(OC)cc2C1)N(C)C	ZINC000161439084	402387630	/nfs/dbraw/zinc/38/76/30/402387630.db2.gz	GVFFYJSDGDKSRI-HNNXBMFYSA-N	0	3	320.433	2.319	10	70		DEIEHN
CCn1cnnc1[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000161281491	402381061	/nfs/dbraw/zinc/38/10/61/402381061.db2.gz	YGRLZVJBJHJERW-IAGOWNOFSA-N	0	3	314.433	2.081	10	70		DEIEHN
C[C@H](C(=O)N[C@@H](CN(C)C)c1ccccc1)C1CCOCC1	ZINC000160547227	539587225	/nfs/dbraw/zinc/58/72/25/539587225.db2.gz	FOHPSOUAOHMCLA-YOEHRIQHSA-N	0	3	304.434	2.468	10	70		DEIEHN
CCOc1cc(CN2C[C@H](C(N)=O)CC[C@@H]2C)ccc1OC	ZINC000159582893	186128922	/nfs/dbraw/zinc/12/89/22/186128922.db2.gz	DFDMFRLEZGGIQR-GXTWGEPZSA-N	0	3	306.406	2.180	10	70		DEIEHN
CCC[C@@H]1CCN(S(=O)(=O)c2cccc3c2CCNC3)C1	ZINC000159967125	197377025	/nfs/dbraw/zinc/37/70/25/197377025.db2.gz	BBFHFJQEAGKRNH-CYBMUJFWSA-N	0	3	308.447	2.143	10	70		DEIEHN
C[C@@H](NCc1cc2c(s1)CCC2)C(=O)NCC(F)(F)F	ZINC000159784700	197364624	/nfs/dbraw/zinc/36/46/24/197364624.db2.gz	UOOIFHWVKISZEG-MRVPVSSYSA-N	0	3	306.353	2.393	10	70		DEIEHN
CSc1ccc(C)c(C(=O)NC[C@H](O)CN2CCCCC2)c1	ZINC000160665674	402356219	/nfs/dbraw/zinc/35/62/19/402356219.db2.gz	COCSOXQWNKXUGP-AWEZNQCLSA-N	0	3	322.474	2.294	10	70		DEIEHN
CC[C@H](C(=O)NCc1ccc(N2CCCCC2=O)cc1)N(C)C	ZINC000161475978	523785376	/nfs/dbraw/zinc/78/53/76/523785376.db2.gz	LXXQKUPGFAEOER-MRXNPFEDSA-N	0	3	317.433	2.160	10	70		DEIEHN
O=C(NC[C@H](O)CN1CCCCC1)C1(c2ccccc2)CCC1	ZINC000160271694	526572476	/nfs/dbraw/zinc/57/24/76/526572476.db2.gz	KXMKLBNVFWZJIX-KRWDZBQOSA-N	0	3	316.445	2.071	10	70		DEIEHN
CCOC(C)(C)CNS(=O)(=O)c1cccc([C@H](N)CC)c1	ZINC000159554024	186126864	/nfs/dbraw/zinc/12/68/64/186126864.db2.gz	JVHGJDMPOHTZDM-CQSZACIVSA-N	0	3	314.451	2.190	10	70		DEIEHN
COc1cccc(C[C@@H](N)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000160644020	197428700	/nfs/dbraw/zinc/42/87/00/197428700.db2.gz	USOICMNYUDTCPK-MRXNPFEDSA-N	0	3	305.399	2.341	10	70		DEIEHN
CO[C@@]1(CNC[C@H](O)c2cc(Cl)ccc2Cl)CCOC1	ZINC000160293428	197398483	/nfs/dbraw/zinc/39/84/83/197398483.db2.gz	GXHJIKJUYAOSJK-UONOGXRCSA-N	0	3	320.216	2.422	10	70		DEIEHN
Cc1ccsc1CN(C)C(=O)[C@]1(N)[C@@H]2CCO[C@@H]2C1(C)C	ZINC000160240161	197394870	/nfs/dbraw/zinc/39/48/70/197394870.db2.gz	NYOLPSSWWGOJMV-PVXIVEMSSA-N	0	3	308.447	2.157	10	70		DEIEHN
CNC(=O)c1cccc(CN2CC[C@@]3(O)CCCC[C@@H]3C2)c1	ZINC000161003193	402368679	/nfs/dbraw/zinc/36/86/79/402368679.db2.gz	QXSRRRXYELMDFT-AEFFLSMTSA-N	0	3	302.418	2.173	10	70		DEIEHN
CN(CCN1CCC[C@H]1c1nncn1C)Cc1ccc(F)cc1	ZINC000161354039	402384515	/nfs/dbraw/zinc/38/45/15/402384515.db2.gz	QROLBWPLSNKLPL-INIZCTEOSA-N	0	3	317.412	2.223	10	70		DEIEHN
C[C@H](C1CC1)N(C(=O)CN1CC[C@]2(O)CCCC[C@@H]2C1)C1CC1	ZINC000160582781	279241362	/nfs/dbraw/zinc/24/13/62/279241362.db2.gz	ZEYFPVKPJRHOQZ-IDHHARJASA-N	0	3	320.477	2.403	10	70		DEIEHN
Cc1ccc(NC(=O)C[C@@H](O)C(C)C)c(OCCN(C)C)c1	ZINC000160585995	402352637	/nfs/dbraw/zinc/35/26/37/402352637.db2.gz	VTIPDUNXYMMYOI-OAHLLOKOSA-N	0	3	308.422	2.281	10	70		DEIEHN
CCc1ccc(CCC(=O)NC[C@H](O)CN2CCCCC2)cc1	ZINC000160701471	402357297	/nfs/dbraw/zinc/35/72/97/402357297.db2.gz	NAVINPKOQMUCCS-SFHVURJKSA-N	0	3	318.461	2.145	10	70		DEIEHN
CC[C@@](C)(O)CN1CCC[C@H](N(C)C(=O)OC(C)(C)C)C1	ZINC000160821623	402362154	/nfs/dbraw/zinc/36/21/54/402362154.db2.gz	ZPSMRUWXXHLWKE-XJKSGUPXSA-N	0	3	300.443	2.479	10	70		DEIEHN
CCC[C@H](C(=O)NC[C@H](c1cccc(F)c1)N(C)C)N(C)C	ZINC000161299647	402381419	/nfs/dbraw/zinc/38/14/19/402381419.db2.gz	LZDRZQGOIDPELF-HZPDHXFCSA-N	0	3	309.429	2.275	10	70		DEIEHN
CCC[C@@H](C(=O)NCCc1cnn(-c2ccccc2)c1)N(C)C	ZINC000161372946	402384929	/nfs/dbraw/zinc/38/49/29/402384929.db2.gz	WLROCAYMFXSDOJ-KRWDZBQOSA-N	0	3	314.433	2.261	10	70		DEIEHN
Cc1ccc(C(=O)CCN2C[C@@H](C)[C@H](N3CCOCC3)C2)cc1	ZINC000160077665	526044871	/nfs/dbraw/zinc/04/48/71/526044871.db2.gz	GZEFVOPJCJMSQF-SJLPKXTDSA-N	0	3	316.445	2.220	10	70		DEIEHN
C[C@@H]1OCC[C@@H]1N(C)c1nc2sccn2c1CNC1CC1	ZINC000160091849	197385151	/nfs/dbraw/zinc/38/51/51/197385151.db2.gz	SNUKWSSCFIAZRA-JQWIXIFHSA-N	0	3	306.435	2.261	10	70		DEIEHN
CCOCCN1CCN(Cc2cnc3ccccn23)C[C@@H]1CC	ZINC000159953932	197376316	/nfs/dbraw/zinc/37/63/16/197376316.db2.gz	USRNFBOXYNUYBN-INIZCTEOSA-N	0	3	316.449	2.267	10	70		DEIEHN
C[C@@H]1C[C@@H](C)N(S(=O)(=O)c2cc(CN)ccc2Cl)C1	ZINC000159514151	197359536	/nfs/dbraw/zinc/35/95/36/197359536.db2.gz	SYWCKJZNLJSEFB-NXEZZACHSA-N	0	3	302.827	2.218	10	70		DEIEHN
Cc1ccccc1SCC(=O)NC[C@H](O)CN1CCCCC1	ZINC000160055016	402335758	/nfs/dbraw/zinc/33/57/58/402335758.db2.gz	KJVOSGNOPOJOHT-HNNXBMFYSA-N	0	3	322.474	2.050	10	70		DEIEHN
O=C(NC[C@H](O)CN1CCCCC1)c1cccc(Cl)c1F	ZINC000160224046	197393785	/nfs/dbraw/zinc/39/37/85/197393785.db2.gz	XGSWXCUIHPYVEN-NSHDSACASA-N	0	3	314.788	2.056	10	70		DEIEHN
CCSCC[C@@H](C)N[C@H]1CC(=O)N(C(CC)CC)C1=O	ZINC000160077512	197384118	/nfs/dbraw/zinc/38/41/18/197384118.db2.gz	MFPWWKHKJHZFFV-YPMHNXCESA-N	0	3	300.468	2.424	10	70		DEIEHN
CCCCNC(=O)[C@H](C)N[C@H](C)c1ccc(-n2ccnn2)cc1	ZINC000159935338	291660995	/nfs/dbraw/zinc/66/09/95/291660995.db2.gz	SKWKJATVCQILGP-KGLIPLIRSA-N	0	3	315.421	2.223	10	70		DEIEHN
O=C(CCc1ccccc1Cl)NC[C@H](O)CN1CCCCC1	ZINC000160408520	402344171	/nfs/dbraw/zinc/34/41/71/402344171.db2.gz	QRFURVNLNKBUMU-HNNXBMFYSA-N	0	3	324.852	2.236	10	70		DEIEHN
CC(C)CN1CCC[C@@H]1CNC(=O)c1ccc([S@](C)=O)cc1	ZINC000160593061	402353147	/nfs/dbraw/zinc/35/31/47/402353147.db2.gz	UTWDLZXZHWKPIZ-IVZQSRNASA-N	0	3	322.474	2.274	10	70		DEIEHN
CCC[C@H](C(=O)N(C)Cc1cc(C(=O)OC)c(C)o1)N(C)C	ZINC000161345307	402383756	/nfs/dbraw/zinc/38/37/56/402383756.db2.gz	BJBLWKDPTLYIBJ-CQSZACIVSA-N	0	3	310.394	2.063	10	70		DEIEHN
C[C@H]1CC[C@H](C(N)=O)CN1Cc1cnn(-c2ccc(F)cc2)c1	ZINC000159696329	402329111	/nfs/dbraw/zinc/32/91/11/402329111.db2.gz	BLCNULBGWNEIOL-JSGCOSHPSA-N	0	3	316.380	2.097	10	70		DEIEHN
CCC[C@@H](C(=O)N(CC)Cc1ccc2c(c1)OCO2)N(C)C	ZINC000161405230	276268519	/nfs/dbraw/zinc/26/85/19/276268519.db2.gz	CUCYPHNDKMQMNQ-AWEZNQCLSA-N	0	3	306.406	2.494	10	70		DEIEHN
Cc1cc(C(=O)NC[C@H](O)CN2CCCCC2)ccc1Cl	ZINC000160160832	197389816	/nfs/dbraw/zinc/38/98/16/197389816.db2.gz	QIAJXQNIVUOJDL-AWEZNQCLSA-N	0	3	310.825	2.225	10	70		DEIEHN
CC(C)CN1CCC[C@@H]1CNS(=O)(=O)c1ccccc1F	ZINC000160277693	402340117	/nfs/dbraw/zinc/34/01/17/402340117.db2.gz	CZOSSFKXDSHBEY-CYBMUJFWSA-N	0	3	314.426	2.224	10	70		DEIEHN
CCOCCO[C@H]1CCN(CCN(C)Cc2ccc(F)cc2)C1	ZINC000160958728	402367141	/nfs/dbraw/zinc/36/71/41/402367141.db2.gz	VCTWOABMZGAHSQ-SFHVURJKSA-N	0	3	324.440	2.385	10	70		DEIEHN
CC(C)N1C[C@H](NC(=O)C(=O)c2ccc3c(c2)CCC3)[C@@H](C)C1	ZINC000161099389	402372902	/nfs/dbraw/zinc/37/29/02/402372902.db2.gz	WIJYQGZUIZEYTJ-GUYCJALGSA-N	0	3	314.429	2.203	10	70		DEIEHN
CCC[C@H](C(=O)NCCc1ccc(OC)c(OC)c1)N(C)C	ZINC000161189196	402376423	/nfs/dbraw/zinc/37/64/23/402376423.db2.gz	JDXXHAHCEBELGW-CQSZACIVSA-N	0	3	308.422	2.093	10	70		DEIEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)[C@@H]2CC(c3ccccc3)=NO2)C1	ZINC000161231313	402378085	/nfs/dbraw/zinc/37/80/85/402378085.db2.gz	PAQHVWULMCRWGV-COXVUDFISA-N	0	3	315.417	2.025	10	70		DEIEHN
O=C(NC[C@H](O)CN1CCCCC1)C12CC3CC(CC(C3)C1)C2	ZINC000159980823	402335110	/nfs/dbraw/zinc/33/51/10/402335110.db2.gz	RWSWJJQIKNJETQ-WCWCZOKXSA-N	0	3	320.477	2.166	10	70		DEIEHN
O=C(C/C=C/c1cccc(F)c1)NC[C@@H](O)CN1CCCCC1	ZINC000160159988	282177439	/nfs/dbraw/zinc/17/74/39/282177439.db2.gz	CKOOVHWEKAJQHX-QQOXCAACSA-N	0	3	320.408	2.192	10	70		DEIEHN
CC1(C)CN=C(NCc2ccc(S(C)(=O)=O)cc2)SC1	ZINC000160231952	197393875	/nfs/dbraw/zinc/39/38/75/197393875.db2.gz	SBGQZXGHBOLMTH-UHFFFAOYSA-N	0	3	312.460	2.309	10	70		DEIEHN
C(NC1=NCC2(CCCC2)CS1)[C@@H]1CN2CCC[C@@H]2CO1	ZINC000160246175	197394546	/nfs/dbraw/zinc/39/45/46/197394546.db2.gz	FDHOBRSYCDICEG-ZIAGYGMSSA-N	0	3	309.479	2.102	10	70		DEIEHN
Cc1ccc(C(=O)CCN2C[C@H](C)[C@H](N3CCOCC3)C2)cc1	ZINC000160077533	197384212	/nfs/dbraw/zinc/38/42/12/197384212.db2.gz	GZEFVOPJCJMSQF-FUHWJXTLSA-N	0	3	316.445	2.220	10	70		DEIEHN
CC[C@@H]1CCN([C@@H](C)C(=O)Nc2ccc(C(N)=S)cc2)C1	ZINC000159906986	197372977	/nfs/dbraw/zinc/37/29/77/197372977.db2.gz	RYXFKYZZLHOGGT-NWDGAFQWSA-N	0	3	305.447	2.380	10	70		DEIEHN
CCN1CCN(CCCNC(=O)[C@H]2C[C@H]2C2CCCCC2)CC1	ZINC000160442793	402345797	/nfs/dbraw/zinc/34/57/97/402345797.db2.gz	BRBFELALVRFZEK-ROUUACIJSA-N	0	3	321.509	2.347	10	70		DEIEHN
CN(C)[C@@H]1CCN(C(=O)N[C@H]2CCO[C@H](c3ccccc3)C2)C1	ZINC000160936375	402366732	/nfs/dbraw/zinc/36/67/32/402366732.db2.gz	LRHFIUSCLKTVSK-BBWFWOEESA-N	0	3	317.433	2.252	10	70		DEIEHN
Cc1noc(Cl)c1CC(=O)N[C@H](CC(C)C)CN(C)C	ZINC000161229590	402378057	/nfs/dbraw/zinc/37/80/57/402378057.db2.gz	BWGHWZXQBUOPIR-LLVKDONJSA-N	0	3	301.818	2.271	10	70		DEIEHN
CN(C)CCN(CC1CCCCC1)C(=O)NCC1(C)COC1	ZINC000159851066	402332372	/nfs/dbraw/zinc/33/23/72/402332372.db2.gz	SWZMIASLLYDGLF-UHFFFAOYSA-N	0	3	311.470	2.176	10	70		DEIEHN
CCC[C@@H](C(=O)NC1CCN(Cc2ccccc2)CC1)N(C)C	ZINC000161172463	520585242	/nfs/dbraw/zinc/58/52/42/520585242.db2.gz	KLOMVXMMFFUVRX-SFHVURJKSA-N	0	3	317.477	2.498	10	70		DEIEHN
CC(C)[C@H]1CCN(CC(=O)Nc2cccc(C(N)=S)c2)C1	ZINC000159892871	197371925	/nfs/dbraw/zinc/37/19/25/197371925.db2.gz	DRDJHLVSDCOFQE-ZDUSSCGKSA-N	0	3	305.447	2.237	10	70		DEIEHN
CCN1CCCN(C(=O)N[C@@H]2CCCC[C@@H]2n2cccn2)CC1	ZINC000159937731	285211875	/nfs/dbraw/zinc/21/18/75/285211875.db2.gz	LPQAFSYUQQHDNG-CVEARBPZSA-N	0	3	319.453	2.104	10	70		DEIEHN
CC[C@](C)(O)CN1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000160841840	402362387	/nfs/dbraw/zinc/36/23/87/402362387.db2.gz	VXKXOCZELTXOPF-KRWDZBQOSA-N	0	3	316.405	2.472	10	70		DEIEHN
CC[C@H](CO)N1CCN(c2ccnc3c(F)cc(F)cc23)CC1	ZINC000159742182	186139115	/nfs/dbraw/zinc/13/91/15/186139115.db2.gz	RERNJULOXSGSBH-CYBMUJFWSA-N	0	3	321.371	2.406	10	70		DEIEHN
COc1cccc(Cl)c1CC(=O)N(C)[C@@H]1CCCN(C)C1	ZINC000160142795	197388812	/nfs/dbraw/zinc/38/88/12/197388812.db2.gz	HUCDXFZIVNLXHN-GFCCVEGCSA-N	0	3	310.825	2.444	10	70		DEIEHN
CC(C)(C(=O)NC[C@H](O)CN1CCCCC1)c1cccc(F)c1	ZINC000160467363	402347039	/nfs/dbraw/zinc/34/70/39/402347039.db2.gz	IYZUBOVMMOJKAR-INIZCTEOSA-N	0	3	322.424	2.066	10	70		DEIEHN
CN(CCN1CC[C@@H](c2cnn(C)c2)C1)Cc1ccc(F)cc1	ZINC000159719331	402329199	/nfs/dbraw/zinc/32/91/99/402329199.db2.gz	GDRBXZQCRRDKPZ-MRXNPFEDSA-N	0	3	316.424	2.481	10	70		DEIEHN
CC(C)N1CCCC[C@H]1C(=O)N1CC[C@H](Oc2cccnc2)C1	ZINC000161409246	402386339	/nfs/dbraw/zinc/38/63/39/402386339.db2.gz	YJQGLOJFVLIYOR-IRXDYDNUSA-N	0	3	317.433	2.324	10	70		DEIEHN
C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2CCO[C@H](C3CC3)C2)CCN1C	ZINC000160413418	525416446	/nfs/dbraw/zinc/41/64/46/525416446.db2.gz	QHOVEKRRWUUVIQ-MIGQKNRLSA-N	0	3	309.454	2.068	10	70		DEIEHN
Cc1ccc(S(=O)(=O)NC[C@H]2CCCN2CC(C)C)cc1	ZINC000160272297	197396942	/nfs/dbraw/zinc/39/69/42/197396942.db2.gz	HWWCQIHCWSAPIH-OAHLLOKOSA-N	0	3	310.463	2.394	10	70		DEIEHN
C[C@@H](N[C@@H](C)c1ccc(-n2ccnn2)cc1)C(=O)NC(C)(C)C	ZINC000159953825	197376050	/nfs/dbraw/zinc/37/60/50/197376050.db2.gz	JVTYROGEVYEQMD-QWHCGFSZSA-N	0	3	315.421	2.221	10	70		DEIEHN
CCC[C@H](C(=O)N(C)CCOc1ccc(OC)cc1)N(C)C	ZINC000161262944	291673960	/nfs/dbraw/zinc/67/39/60/291673960.db2.gz	SJGSDRJLIMLSKX-MRXNPFEDSA-N	0	3	308.422	2.263	10	70		DEIEHN
C[C@H](NC(=O)[C@]1(N)[C@H]2CCCO[C@@H]2C1(C)C)c1cccs1	ZINC000160707800	402358043	/nfs/dbraw/zinc/35/80/43/402358043.db2.gz	SKPWHUMYBVSHHZ-XALPAYFRSA-N	0	3	308.447	2.458	10	70		DEIEHN
Cc1c2ccccc2oc1C(=O)NC[C@H](O)CN1CCCCC1	ZINC000160479731	278613984	/nfs/dbraw/zinc/61/39/84/278613984.db2.gz	AGAJCMOBSMADNH-AWEZNQCLSA-N	0	3	316.401	2.318	10	70		DEIEHN
CCc1sc(C(=O)NC[C@H](O)CN2CCCCC2)cc1C	ZINC000160219822	197393364	/nfs/dbraw/zinc/39/33/64/197393364.db2.gz	OVXJFBZDVOAEJO-ZDUSSCGKSA-N	0	3	310.463	2.196	10	70		DEIEHN
CC[C@@H]1CCN(S(=O)(=O)c2ccc(CN)c(Cl)c2)C1	ZINC000159430950	197353616	/nfs/dbraw/zinc/35/36/16/197353616.db2.gz	GHHZRCSEZVSVGX-SNVBAGLBSA-N	0	3	302.827	2.219	10	70		DEIEHN
CC(C)(C)[C@H]1CCN(S(=O)(=O)Cc2ccccc2CN)C1	ZINC000159419566	197351969	/nfs/dbraw/zinc/35/19/69/197351969.db2.gz	QJYCZBFYRBAFBW-HNNXBMFYSA-N	0	3	310.463	2.343	10	70		DEIEHN
C[C@@H](NCc1ccc(Cn2ccccc2=O)cc1)c1cnn(C)c1	ZINC000161063738	402371364	/nfs/dbraw/zinc/37/13/64/402371364.db2.gz	YTAYDYRYVKWOCS-OAHLLOKOSA-N	0	3	322.412	2.481	10	70		DEIEHN
CCCc1ccc(C(=O)NC[C@H](O)CN2CCCCC2)cc1	ZINC000160209201	402338195	/nfs/dbraw/zinc/33/81/95/402338195.db2.gz	QSHCJHCSPZKXON-KRWDZBQOSA-N	0	3	304.434	2.216	10	70		DEIEHN
CCC[C@@H](C(=O)NC[C@H](c1ccco1)N1CCCC1)N(C)C	ZINC000160394559	520590526	/nfs/dbraw/zinc/59/05/26/520590526.db2.gz	DBKHWMAFBDHDBP-LSDHHAIUSA-N	0	3	307.438	2.263	10	70		DEIEHN
COc1ccc([C@H](C)NCCCN2CCCC2=O)c(OC)c1	ZINC000159559532	291656162	/nfs/dbraw/zinc/65/61/62/291656162.db2.gz	KNPVRRDUJZAONB-ZDUSSCGKSA-N	0	3	306.406	2.367	10	70		DEIEHN
Cc1ccc(NC(=O)C[C@H](O)C(C)C)c(OCCN(C)C)c1	ZINC000160585863	402352470	/nfs/dbraw/zinc/35/24/70/402352470.db2.gz	VTIPDUNXYMMYOI-HNNXBMFYSA-N	0	3	308.422	2.281	10	70		DEIEHN
C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)CCN1C	ZINC000161000992	402368554	/nfs/dbraw/zinc/36/85/54/402368554.db2.gz	MXGXKRHEUPLWHK-LJIZCISZSA-N	0	3	321.465	2.068	10	70		DEIEHN
CC[C@@](C)(O)CN1CCc2c(cccc2N2CCOC2=O)C1	ZINC000161294642	402381354	/nfs/dbraw/zinc/38/13/54/402381354.db2.gz	FBEYEGYVQFTVIA-QGZVFWFLSA-N	0	3	304.390	2.162	10	70		DEIEHN
C[C@@H](CC(=O)NC[C@H](O)CN1CCCCC1)c1ccccc1F	ZINC000160212762	402338017	/nfs/dbraw/zinc/33/80/17/402338017.db2.gz	SJMGDHMGUWFJHK-GJZGRUSLSA-N	0	3	322.424	2.282	10	70		DEIEHN
C[C@H]1CC[C@@H](C(N)=O)CN1Cc1cccc2c1OC(C)(C)C2	ZINC000159574723	278377476	/nfs/dbraw/zinc/37/74/76/278377476.db2.gz	KGXGSPVLUXLBRJ-SWLSCSKDSA-N	0	3	302.418	2.486	10	70		DEIEHN
C[C@H](C(=O)N[C@H](CN(C)C)c1ccccc1)C1CCOCC1	ZINC000160547459	539587262	/nfs/dbraw/zinc/58/72/62/539587262.db2.gz	FOHPSOUAOHMCLA-WMLDXEAASA-N	0	3	304.434	2.468	10	70		DEIEHN
O=C(C/C=C/c1ccc(F)cc1)NC[C@@H](O)CN1CCCCC1	ZINC000160235568	197395222	/nfs/dbraw/zinc/39/52/22/197395222.db2.gz	QJMGGKDELKODSB-LAQIPUCWSA-N	0	3	320.408	2.192	10	70		DEIEHN
CC(C)[C@@H]1CCN(S(=O)(=O)c2ccc(CN)c(Cl)c2)C1	ZINC000159425494	197352183	/nfs/dbraw/zinc/35/21/83/197352183.db2.gz	KMOHGFPRAFKDSE-GFCCVEGCSA-N	0	3	316.854	2.465	10	70		DEIEHN
O=C(NC[C@H](O)CN1CCCCC1)c1cccc(F)c1Cl	ZINC000160346814	402341734	/nfs/dbraw/zinc/34/17/34/402341734.db2.gz	LMQXNQCKLVZYGX-NSHDSACASA-N	0	3	314.788	2.056	10	70		DEIEHN
CC(=O)c1c(C)[nH]c(C(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)c1C	ZINC000161331384	402383537	/nfs/dbraw/zinc/38/35/37/402383537.db2.gz	SWIDRTWJXMWAIL-HZMBPMFUSA-N	0	3	305.422	2.293	10	70		DEIEHN
COC(=O)Nc1ccccc1C(=O)N[C@H]1CN(C(C)C)C[C@H]1C	ZINC000161409997	402386112	/nfs/dbraw/zinc/38/61/12/402386112.db2.gz	HVAXLVRLIBQWHA-DOMZBBRYSA-N	0	3	319.405	2.323	10	70		DEIEHN
CC(C)(CC(=O)NC[C@H](O)CN1CCCCC1)c1ccccc1	ZINC000159914201	519190870	/nfs/dbraw/zinc/19/08/70/519190870.db2.gz	IOKISIBPHXHBAN-KRWDZBQOSA-N	0	3	318.461	2.317	10	70		DEIEHN
CCC[C@@H](C(=O)N1CCN(c2ccccc2OC)CC1)N(C)C	ZINC000161137899	520581884	/nfs/dbraw/zinc/58/18/84/520581884.db2.gz	CRGHIYBXYKUOAG-INIZCTEOSA-N	0	3	319.449	2.074	10	70		DEIEHN
Cc1cc(C)cc(CCC(=O)NC[C@H](O)CN2CCCCC2)c1	ZINC000160498049	524373475	/nfs/dbraw/zinc/37/34/75/524373475.db2.gz	IEXMGKFAAQXWOD-SFHVURJKSA-N	0	3	318.461	2.199	10	70		DEIEHN
Fc1ccc(CN2CCN(CCn3ccnc3)CC2)c(Cl)c1	ZINC000159724321	186137373	/nfs/dbraw/zinc/13/73/73/186137373.db2.gz	HOUQTTVRHNFXHN-UHFFFAOYSA-N	0	3	322.815	2.493	10	70		DEIEHN
COCCCN(CCOC)[C@H](CN)c1cc(Cl)ccc1F	ZINC000160974647	197453504	/nfs/dbraw/zinc/45/35/04/197453504.db2.gz	BGJOGOKONWXNIP-OAHLLOKOSA-N	0	3	318.820	2.464	10	70		DEIEHN
C[C@@H]1OCC[C@H]1N(C)c1nc2sccn2c1CNC1CC1	ZINC000160091586	197385162	/nfs/dbraw/zinc/38/51/62/197385162.db2.gz	SNUKWSSCFIAZRA-CMPLNLGQSA-N	0	3	306.435	2.261	10	70		DEIEHN
Cn1c(CN2CCN(CC3CC3)CC2)nnc1-c1ccccc1	ZINC000160815688	402361180	/nfs/dbraw/zinc/36/11/80/402361180.db2.gz	MZWZWQWCPRZDGZ-UHFFFAOYSA-N	0	3	311.433	2.010	10	70		DEIEHN
CCC1(CNC(=O)NC[C@@H]2CCCN2CCOC)CCCC1	ZINC000161097530	402372515	/nfs/dbraw/zinc/37/25/15/402372515.db2.gz	NJURFGWYRVPPEE-HNNXBMFYSA-N	0	3	311.470	2.367	10	70		DEIEHN
CCn1cnnc1[C@H]1CCCN(C[C@H](O)c2ccc(F)cc2)C1	ZINC000161286245	402380782	/nfs/dbraw/zinc/38/07/82/402380782.db2.gz	REXNIQCIEHZVOL-HOCLYGCPSA-N	0	3	318.396	2.350	10	70		DEIEHN
O=C(C/C=C/c1cccc(F)c1)NC[C@H](O)CN1CCCCC1	ZINC000160159855	282177529	/nfs/dbraw/zinc/17/75/29/282177529.db2.gz	CKOOVHWEKAJQHX-UABRLCRWSA-N	0	3	320.408	2.192	10	70		DEIEHN
O=C(NC[C@H](O)c1cc2ccccc2s1)[C@H]1CCCCN1	ZINC000160274505	197397220	/nfs/dbraw/zinc/39/72/20/197397220.db2.gz	IABKQBWJKPKVGA-OLZOCXBDSA-N	0	3	304.415	2.193	10	70		DEIEHN
O=C(C/C=C/c1ccc(F)cc1)NC[C@H](O)CN1CCCCC1	ZINC000160235432	197394994	/nfs/dbraw/zinc/39/49/94/197394994.db2.gz	QJMGGKDELKODSB-BDUNBXCCSA-N	0	3	320.408	2.192	10	70		DEIEHN
Cc1[nH]c2ccccc2c1C(=O)NC[C@H](O)CN1CCCCC1	ZINC000160051433	197381667	/nfs/dbraw/zinc/38/16/67/197381667.db2.gz	GECQOTJBMFTFNX-AWEZNQCLSA-N	0	3	315.417	2.053	10	70		DEIEHN
O=S1(=O)CC[C@@H](NCC2(CO)CCCC2)c2ccccc21	ZINC000160117242	197386847	/nfs/dbraw/zinc/38/68/47/197386847.db2.gz	BWMYLWWHXYEGDJ-CQSZACIVSA-N	0	3	309.431	2.047	10	70		DEIEHN
CCC[C@H]1CCN(S(=O)(=O)c2ccc(F)c(CN)c2)C1	ZINC000159433998	197353270	/nfs/dbraw/zinc/35/32/70/197353270.db2.gz	ZMJQSAOPPSSATP-NSHDSACASA-N	0	3	300.399	2.095	10	70		DEIEHN
CN(CCN1CCN2CCCC[C@@H]2C1)Cc1ccc(F)cc1	ZINC000160592883	402353060	/nfs/dbraw/zinc/35/30/60/402353060.db2.gz	NCIQWLBXZPSLRB-GOSISDBHSA-N	0	3	305.441	2.428	10	70		DEIEHN
CCC[C@H](C(=O)NC1CCN(Cc2ccccc2)CC1)N(C)C	ZINC000161172570	402376297	/nfs/dbraw/zinc/37/62/97/402376297.db2.gz	KLOMVXMMFFUVRX-GOSISDBHSA-N	0	3	317.477	2.498	10	70		DEIEHN
CCC[C@@H](C(=O)NC[C@H](c1cccc(OC)c1)N(C)C)N(C)C	ZINC000161300658	402381515	/nfs/dbraw/zinc/38/15/15/402381515.db2.gz	FOCYYFGDSZFRDJ-DLBZAZTESA-N	0	3	321.465	2.144	10	70		DEIEHN
CCC[C@@H](C(=O)NC[C@@H](c1cccc(F)c1)N(C)C)N(C)C	ZINC000161299392	402381524	/nfs/dbraw/zinc/38/15/24/402381524.db2.gz	LZDRZQGOIDPELF-HOTGVXAUSA-N	0	3	309.429	2.275	10	70		DEIEHN
CN(CCN1CCC[C@@H]1c1nncn1C)Cc1ccc(F)cc1	ZINC000161354175	402384678	/nfs/dbraw/zinc/38/46/78/402384678.db2.gz	QROLBWPLSNKLPL-MRXNPFEDSA-N	0	3	317.412	2.223	10	70		DEIEHN
CNC(=O)CC1CCN(CCN(C)Cc2ccc(F)cc2)CC1	ZINC000159945190	402334282	/nfs/dbraw/zinc/33/42/82/402334282.db2.gz	RWPLFEMPYUNFNF-UHFFFAOYSA-N	0	3	321.440	2.106	10	70		DEIEHN
CN(CCN(CCO)Cc1cccnc1)Cc1ccc(F)cc1	ZINC000160210580	402338140	/nfs/dbraw/zinc/33/81/40/402338140.db2.gz	JCGUEFCTZBISKR-UHFFFAOYSA-N	0	3	317.408	2.147	10	70		DEIEHN
CCOC(C)(C)CNS(=O)(=O)c1cccc([C@@H](N)CC)c1	ZINC000159553892	186126929	/nfs/dbraw/zinc/12/69/29/186126929.db2.gz	JVHGJDMPOHTZDM-AWEZNQCLSA-N	0	3	314.451	2.190	10	70		DEIEHN
CCC[C@@H](C(=O)N1CCN(c2ccccc2F)CC1)N(C)C	ZINC000161154692	197469574	/nfs/dbraw/zinc/46/95/74/197469574.db2.gz	NZGJNEUQIQRWLB-INIZCTEOSA-N	0	3	307.413	2.205	10	70		DEIEHN
COCCCN(CCOC)[C@H](CN)c1ccc(Cl)cc1F	ZINC000160974381	197453790	/nfs/dbraw/zinc/45/37/90/197453790.db2.gz	GISPEIVPZAUUSM-OAHLLOKOSA-N	0	3	318.820	2.464	10	70		DEIEHN
O=C(NC[C@H](O)CN1CCCCC1)c1cc2cc(F)ccc2o1	ZINC000160058780	197383080	/nfs/dbraw/zinc/38/30/80/197383080.db2.gz	WUBVBYJRGDEASY-AWEZNQCLSA-N	0	3	320.364	2.149	10	70		DEIEHN
C[C@@H](N[C@@H](C)C(=O)NC(C)(C)C)c1ccc(-n2ccnn2)cc1	ZINC000159953649	197376192	/nfs/dbraw/zinc/37/61/92/197376192.db2.gz	JVTYROGEVYEQMD-OLZOCXBDSA-N	0	3	315.421	2.221	10	70		DEIEHN
CCN1CCN(CCCNC(=O)[C@H]2C[C@@H]2C2CCCCC2)CC1	ZINC000160442514	402345967	/nfs/dbraw/zinc/34/59/67/402345967.db2.gz	BRBFELALVRFZEK-MSOLQXFVSA-N	0	3	321.509	2.347	10	70		DEIEHN
CCCOc1cccc(C(=O)NC[C@H](O)CN2CCCCC2)c1	ZINC000160519438	402349227	/nfs/dbraw/zinc/34/92/27/402349227.db2.gz	PSSZJXNJNKKDCA-INIZCTEOSA-N	0	3	320.433	2.052	10	70		DEIEHN
CN(Cc1cnc2ccccn12)[C@@H]1CCCN(c2cccnn2)C1	ZINC000159890638	402333047	/nfs/dbraw/zinc/33/30/47/402333047.db2.gz	WAHZABDEPXXIGI-OAHLLOKOSA-N	0	3	322.416	2.225	10	70		DEIEHN
CCC[C@H](C(=O)N1CCN(c2ccccc2OC)CC1)N(C)C	ZINC000161138019	520975659	/nfs/dbraw/zinc/97/56/59/520975659.db2.gz	CRGHIYBXYKUOAG-MRXNPFEDSA-N	0	3	319.449	2.074	10	70		DEIEHN
C[C@@H](C(=O)N[C@H](CN(C)C)c1ccccc1)C1CCOCC1	ZINC000160547597	539587102	/nfs/dbraw/zinc/58/71/02/539587102.db2.gz	FOHPSOUAOHMCLA-RHSMWYFYSA-N	0	3	304.434	2.468	10	70		DEIEHN
CCOc1cc(CN2C[C@@H](C(N)=O)CC[C@@H]2C)ccc1OC	ZINC000159583056	186128927	/nfs/dbraw/zinc/12/89/27/186128927.db2.gz	DFDMFRLEZGGIQR-JSGCOSHPSA-N	0	3	306.406	2.180	10	70		DEIEHN
CCC[C@H](C(=O)N1CCN(c2cccc(C)c2)CC1)N(C)C	ZINC000161342450	197487664	/nfs/dbraw/zinc/48/76/64/197487664.db2.gz	RCHWEZSAAMLTLQ-QGZVFWFLSA-N	0	3	303.450	2.374	10	70		DEIEHN
CC(C)[C@H]1CCN(CC(=O)Nc2ccc(C(N)=S)cc2)C1	ZINC000159891688	197372172	/nfs/dbraw/zinc/37/21/72/197372172.db2.gz	KHOUMAUUZWMTAI-ZDUSSCGKSA-N	0	3	305.447	2.237	10	70		DEIEHN
CCC[C@@H](C(=O)NC[C@H](O)c1cccc(OC(C)C)c1)N(C)C	ZINC000160630150	402354605	/nfs/dbraw/zinc/35/46/05/402354605.db2.gz	HYOFDNNPKQWIDG-IRXDYDNUSA-N	0	3	322.449	2.354	10	70		DEIEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)[C@@H](c2ccccc2)N(C)C)C1	ZINC000161348621	402384155	/nfs/dbraw/zinc/38/41/55/402384155.db2.gz	ICNJZYRMSBLSEI-HYVNUMGLSA-N	0	3	303.450	2.134	10	70		DEIEHN
O=S1(=O)CC[C@H](NCC2(CO)CCCC2)c2ccccc21	ZINC000160117353	197387316	/nfs/dbraw/zinc/38/73/16/197387316.db2.gz	BWMYLWWHXYEGDJ-AWEZNQCLSA-N	0	3	309.431	2.047	10	70		DEIEHN
COc1cc([C@H](CN)N(C)[C@@H](C)CSC)cc2c1OCO2	ZINC000159943270	197374840	/nfs/dbraw/zinc/37/48/40/197374840.db2.gz	MOFLCLOYAJLOSZ-JQWIXIFHSA-N	0	3	312.435	2.107	10	70		DEIEHN
CC[C@H]1CCN([C@@H](C)C(=O)Nc2cccc(C(N)=S)c2)C1	ZINC000159908995	197373075	/nfs/dbraw/zinc/37/30/75/197373075.db2.gz	FZXZFNPQXDRGJR-RYUDHWBXSA-N	0	3	305.447	2.380	10	70		DEIEHN
CC(C)COC[C@@H](O)CN(CCc1nccs1)C(C)C	ZINC000159867936	197370153	/nfs/dbraw/zinc/37/01/53/197370153.db2.gz	XYIQISNHQQZBSF-AWEZNQCLSA-N	0	3	300.468	2.430	10	70		DEIEHN
CCN1CCC[C@@H](NC(=O)Nc2ccn(CC(F)(F)F)n2)C1	ZINC000160398439	402344264	/nfs/dbraw/zinc/34/42/64/402344264.db2.gz	PBAAPCVUKQTCHV-SNVBAGLBSA-N	0	3	319.331	2.051	10	70		DEIEHN
CC1(C)[C@@H]2OCCC[C@H]2[C@]1(N)C(=O)Nc1ccc(Cl)nc1	ZINC000160743791	402359126	/nfs/dbraw/zinc/35/91/26/402359126.db2.gz	WZLJMKQYGROZGR-HCKVZZMMSA-N	0	3	309.797	2.206	10	70		DEIEHN
CN(CCN1CC[C@H](c2cnn(C)c2)C1)Cc1ccc(F)cc1	ZINC000159719417	402328686	/nfs/dbraw/zinc/32/86/86/402328686.db2.gz	GDRBXZQCRRDKPZ-INIZCTEOSA-N	0	3	316.424	2.481	10	70		DEIEHN
Brc1ccc(-c2cncn2C[C@@H]2CNCCO2)cc1	ZINC000159596881	186129576	/nfs/dbraw/zinc/12/95/76/186129576.db2.gz	ITUXUZPOHDHJIM-ZDUSSCGKSA-N	0	3	322.206	2.301	10	70		DEIEHN
CC[C@@H]1CCN(S(=O)(=O)c2ccc(CN)cc2Cl)C1	ZINC000159432329	197353736	/nfs/dbraw/zinc/35/37/36/197353736.db2.gz	UDJZINLRXHAKAR-SNVBAGLBSA-N	0	3	302.827	2.219	10	70		DEIEHN
CCC[C@@H](C(=O)NC[C@@H](c1ccco1)N1CCCC1)N(C)C	ZINC000160394303	402343671	/nfs/dbraw/zinc/34/36/71/402343671.db2.gz	DBKHWMAFBDHDBP-GJZGRUSLSA-N	0	3	307.438	2.263	10	70		DEIEHN
Cc1ccc(CNC(=O)[C@]2(N)[C@H]3CCCO[C@@H]3C2(C)C)s1	ZINC000160439605	402345213	/nfs/dbraw/zinc/34/52/13/402345213.db2.gz	HOOREDARYJELFV-HEHGZKQESA-N	0	3	308.447	2.205	10	70		DEIEHN
Cc1cc(Cl)cc(C(=O)NC[C@H](O)CN2CCCCC2)c1	ZINC000160611865	402353816	/nfs/dbraw/zinc/35/38/16/402353816.db2.gz	XHKLHPFPUCRBLL-HNNXBMFYSA-N	0	3	310.825	2.225	10	70		DEIEHN
CC(C)N1C[C@H](NC(=O)c2c(Cl)nc3ccccn32)[C@@H](C)C1	ZINC000161283343	402380971	/nfs/dbraw/zinc/38/09/71/402380971.db2.gz	JQCFPEKCAXQFHR-RYUDHWBXSA-N	0	3	320.824	2.446	10	70		DEIEHN
CCC[C@@H](C(=O)N(C)Cc1cc(C(=O)OC)c(C)o1)N(C)C	ZINC000161345175	402383908	/nfs/dbraw/zinc/38/39/08/402383908.db2.gz	BJBLWKDPTLYIBJ-AWEZNQCLSA-N	0	3	310.394	2.063	10	70		DEIEHN
CC(C)CN1CCC[C@@H]1CNS(=O)(=O)c1ccc(F)cc1	ZINC000160311142	197399705	/nfs/dbraw/zinc/39/97/05/197399705.db2.gz	KRZKNOQXBSCNRZ-CQSZACIVSA-N	0	3	314.426	2.224	10	70		DEIEHN
CCC[C@H](C(=O)NC[C@@H](O)c1ccc(OC(C)C)cc1)N(C)C	ZINC000160302485	197399486	/nfs/dbraw/zinc/39/94/86/197399486.db2.gz	MFCULXJXJJVOJI-IAGOWNOFSA-N	0	3	322.449	2.354	10	70		DEIEHN
CCCCOC(=O)CCN1CCC[C@H](c2nncn2CC)C1	ZINC000161419685	402386920	/nfs/dbraw/zinc/38/69/20/402386920.db2.gz	PREXMCRJPRPIFX-AWEZNQCLSA-N	0	3	308.426	2.211	10	70		DEIEHN
CNC(=O)c1cccc(CN2CC[C@]3(O)CCCC[C@@H]3C2)c1	ZINC000161003074	402368646	/nfs/dbraw/zinc/36/86/46/402368646.db2.gz	QXSRRRXYELMDFT-SJLPKXTDSA-N	0	3	302.418	2.173	10	70		DEIEHN
Cc1noc(Cl)c1CC(=O)N[C@@H](CC(C)C)CN(C)C	ZINC000161229470	402378518	/nfs/dbraw/zinc/37/85/18/402378518.db2.gz	BWGHWZXQBUOPIR-NSHDSACASA-N	0	3	301.818	2.271	10	70		DEIEHN
C[C@@H](C(=O)N[C@@H](CN(C)C)c1ccccc1)C1CCOCC1	ZINC000160547338	539587139	/nfs/dbraw/zinc/58/71/39/539587139.db2.gz	FOHPSOUAOHMCLA-PBHICJAKSA-N	0	3	304.434	2.468	10	70		DEIEHN
O=C(NC[C@H](O)CN1CCCCC1)c1ccc2ccccc2c1	ZINC000160462471	402346562	/nfs/dbraw/zinc/34/65/62/402346562.db2.gz	LDTPBSAFSUPPAN-SFHVURJKSA-N	0	3	312.413	2.416	10	70		DEIEHN
CC(C)c1nc(N[C@H]2CN(C(C)C)C[C@@H]2C)nc(N(C)C)n1	ZINC000160467461	402346910	/nfs/dbraw/zinc/34/69/10/402346910.db2.gz	PSWMWQOOYDIJRK-STQMWFEESA-N	0	3	306.458	2.202	10	70		DEIEHN
CCC[C@H](C(=O)NC[C@@H](c1cccc(OC)c1)N(C)C)N(C)C	ZINC000161300538	402381437	/nfs/dbraw/zinc/38/14/37/402381437.db2.gz	FOCYYFGDSZFRDJ-SJORKVTESA-N	0	3	321.465	2.144	10	70		DEIEHN
CNCc1cc(Cl)cc(S(=O)(=O)NC[C@@H]2C[C@H]2C)c1C	ZINC000160854988	197443826	/nfs/dbraw/zinc/44/38/26/197443826.db2.gz	VYLKZKLUXYGGMN-KOLCDFICSA-N	0	3	316.854	2.302	10	70		DEIEHN
O=C(CCc1ccc(Cl)cc1)NC[C@H](O)CN1CCCCC1	ZINC000160310309	197399157	/nfs/dbraw/zinc/39/91/57/197399157.db2.gz	DLMJEBUCEKBTBC-INIZCTEOSA-N	0	3	324.852	2.236	10	70		DEIEHN
Cc1ccc(OC[C@H](O)CN2CC[C@]3(O)CCCC[C@@H]3C2)cc1	ZINC000160884991	402364000	/nfs/dbraw/zinc/36/40/00/402364000.db2.gz	IUNRXFXFYKHBFA-ZHALLVOQSA-N	0	3	319.445	2.362	10	70		DEIEHN
CCc1ccc(C[C@@H](NC)[C@H]2CCCCS2(=O)=O)s1	ZINC000161188670	197473444	/nfs/dbraw/zinc/47/34/44/197473444.db2.gz	RIGVNSOARWVTBT-ZIAGYGMSSA-N	0	3	301.477	2.408	10	70		DEIEHN
Cc1ccc(CCC(=O)NC[C@H](O)CN2CCCCC2)c(C)c1	ZINC000160249763	197395856	/nfs/dbraw/zinc/39/58/56/197395856.db2.gz	SLXBVXRHRCUKQN-SFHVURJKSA-N	0	3	318.461	2.199	10	70		DEIEHN
CCC[C@@H](C(=O)N1CCN(c2ccccc2C)CC1)N(C)C	ZINC000160220699	197394263	/nfs/dbraw/zinc/39/42/63/197394263.db2.gz	CKDTZJSYKZFATM-KRWDZBQOSA-N	0	3	303.450	2.374	10	70		DEIEHN
CCSCC[C@@H](C)NCc1ccc(S(=O)(=O)N(C)C)o1	ZINC000159943003	197374773	/nfs/dbraw/zinc/37/47/73/197374773.db2.gz	HSEZPXQKAWLAKE-LLVKDONJSA-N	0	3	320.480	2.151	10	70		DEIEHN
C[C@H](NCc1cc2c(s1)CCC2)C(=O)NCC(F)(F)F	ZINC000159784559	197364209	/nfs/dbraw/zinc/36/42/09/197364209.db2.gz	UOOIFHWVKISZEG-QMMMGPOBSA-N	0	3	306.353	2.393	10	70		DEIEHN
CCN(CCc1nccs1)C[C@@H](O)COc1ccccc1	ZINC000159437257	197353584	/nfs/dbraw/zinc/35/35/84/197353584.db2.gz	PRVZUSHAEGZYRM-CQSZACIVSA-N	0	3	306.431	2.447	10	70		DEIEHN
Cc1cc(C(=O)NC[C@H](O)CN2CCCCC2)c(C)n1C(C)C	ZINC000160400081	402344249	/nfs/dbraw/zinc/34/42/49/402344249.db2.gz	CDSROEGVESDBOB-INIZCTEOSA-N	0	3	321.465	2.262	10	70		DEIEHN
CC[C@@](C)(O)CN1CCCN(C(=O)Oc2ccccc2)CC1	ZINC000161103811	402372656	/nfs/dbraw/zinc/37/26/56/402372656.db2.gz	ZXXODGLDWWEONX-QGZVFWFLSA-N	0	3	306.406	2.354	10	70		DEIEHN
CCn1cnnc1[C@H]1CCCN(CCC(=O)OC(C)(C)C)C1	ZINC000161412885	402386382	/nfs/dbraw/zinc/38/63/82/402386382.db2.gz	GNSADVNTXFDYQQ-ZDUSSCGKSA-N	0	3	308.426	2.209	10	70		DEIEHN
CCN(CC)C(=O)[C@H](C)N[C@H](C)c1ccc(-n2ccnn2)cc1	ZINC000159936992	402333515	/nfs/dbraw/zinc/33/35/15/402333515.db2.gz	HYKSOUQEXWLNBG-KGLIPLIRSA-N	0	3	315.421	2.175	10	70		DEIEHN
CC(C)[C@@H](C(=O)NC[C@H](O)CN1CCCCC1)c1ccccc1	ZINC000160206527	519789288	/nfs/dbraw/zinc/78/92/88/519789288.db2.gz	OADVHFWVMPCKQG-ZWKOTPCHSA-N	0	3	318.461	2.389	10	70		DEIEHN
O=C(NC[C@H](O)CN1CCCCC1)c1cc(Cl)ccc1F	ZINC000160196053	282177531	/nfs/dbraw/zinc/17/75/31/282177531.db2.gz	NDLZLVRKWXEVKI-LBPRGKRZSA-N	0	3	314.788	2.056	10	70		DEIEHN
C[C@H](N[C@@H](C)c1ccc(-n2ccnn2)cc1)C(=O)NC(C)(C)C	ZINC000159953509	197376340	/nfs/dbraw/zinc/37/63/40/197376340.db2.gz	JVTYROGEVYEQMD-STQMWFEESA-N	0	3	315.421	2.221	10	70		DEIEHN
CCSCC[C@H](C)N[C@H]1CC(=O)N(C(CC)CC)C1=O	ZINC000160077221	197383766	/nfs/dbraw/zinc/38/37/66/197383766.db2.gz	MFPWWKHKJHZFFV-AAEUAGOBSA-N	0	3	300.468	2.424	10	70		DEIEHN
CC(C)CN(C(=O)CN1CC[C@]2(O)CCCC[C@@H]2C1)C1CC1	ZINC000160717897	402358036	/nfs/dbraw/zinc/35/80/36/402358036.db2.gz	MDGJSSZKPFEURK-CRAIPNDOSA-N	0	3	308.466	2.260	10	70		DEIEHN
c1cc(-c2nc(CN3CCN4CCCC[C@@H]4C3)no2)cs1	ZINC000160895926	402364557	/nfs/dbraw/zinc/36/45/57/402364557.db2.gz	WURBMUMGUGACTA-CYBMUJFWSA-N	0	3	304.419	2.468	10	70		DEIEHN
CNC(=O)c1ccc(CN2CC[C@@]3(O)CCCC[C@@H]3C2)cc1	ZINC000161027169	402369584	/nfs/dbraw/zinc/36/95/84/402369584.db2.gz	GVRPPDRGYPHNAR-AEFFLSMTSA-N	0	3	302.418	2.173	10	70		DEIEHN
CCCCNc1ccccc1C(=O)N1CCO[C@H](CN(C)C)C1	ZINC000160450374	520698765	/nfs/dbraw/zinc/69/87/65/520698765.db2.gz	NXXQHSLRZQHTFF-OAHLLOKOSA-N	0	3	319.449	2.301	10	70		DEIEHN
C[C@@H]1CC[C@H](C(N)=O)CN1Cc1cnn(-c2ccc(F)cc2)c1	ZINC000159696187	186135872	/nfs/dbraw/zinc/13/58/72/186135872.db2.gz	BLCNULBGWNEIOL-OCCSQVGLSA-N	0	3	316.380	2.097	10	70		DEIEHN
C(NC1=NCC2(CCCC2)CS1)[C@H]1CN2CCC[C@@H]2CO1	ZINC000160246295	197394942	/nfs/dbraw/zinc/39/49/42/197394942.db2.gz	FDHOBRSYCDICEG-KGLIPLIRSA-N	0	3	309.479	2.102	10	70		DEIEHN
CCN(Cc1cccs1)C(=O)[C@]1(N)[C@@H]2CCO[C@@H]2C1(C)C	ZINC000160241230	197394525	/nfs/dbraw/zinc/39/45/25/197394525.db2.gz	VHZUWFIHDFHNOU-DVOMOZLQSA-N	0	3	308.447	2.239	10	70		DEIEHN
CC[C@@H]1CCN([C@@H](C)C(=O)Nc2ccccc2C(N)=S)C1	ZINC000159902074	197371728	/nfs/dbraw/zinc/37/17/28/197371728.db2.gz	YTPJBFHEVZVLRC-NWDGAFQWSA-N	0	3	305.447	2.380	10	70		DEIEHN
CC(C)N(C)C(=O)[C@H](C)N[C@H](C)c1ccc(-n2ccnn2)cc1	ZINC000159875176	197369765	/nfs/dbraw/zinc/36/97/65/197369765.db2.gz	SAESHAMELCAYPX-KGLIPLIRSA-N	0	3	315.421	2.173	10	70		DEIEHN
Brc1ccccc1-c1cncn1C[C@H]1CNCCO1	ZINC000159789171	197364513	/nfs/dbraw/zinc/36/45/13/197364513.db2.gz	AQIJGBHEKGTCNH-LLVKDONJSA-N	0	3	322.206	2.301	10	70		DEIEHN
C[C@H](NCc1ccc(Cn2ccccc2=O)cc1)c1cnn(C)c1	ZINC000161063604	402371650	/nfs/dbraw/zinc/37/16/50/402371650.db2.gz	YTAYDYRYVKWOCS-HNNXBMFYSA-N	0	3	322.412	2.481	10	70		DEIEHN
C/C(=C/C(=O)NC[C@H](O)CN1CCCCC1)c1ccccc1	ZINC000160545332	518409711	/nfs/dbraw/zinc/40/97/11/518409711.db2.gz	SDNLWENAENUTPF-KSVUCXBSSA-N	0	3	302.418	2.053	10	70		DEIEHN
Cc1ccc(F)c(S(=O)(=O)[N-]Cc2ccc(C[NH3+])cc2)c1	ZINC000159591802	186129501	/nfs/dbraw/zinc/12/95/01/186129501.db2.gz	MHQKEGBMNRPFFK-UHFFFAOYSA-N	0	3	308.378	2.071	10	70		DEIEHN
CCC[C@H](C(=O)N1CCN(c2ccccc2C)CC1)N(C)C	ZINC000160220792	197393542	/nfs/dbraw/zinc/39/35/42/197393542.db2.gz	CKDTZJSYKZFATM-QGZVFWFLSA-N	0	3	303.450	2.374	10	70		DEIEHN
COCCC[C@@H](N)C(=O)Nc1c2nsnc2ccc1Cl	ZINC000159489986	197357661	/nfs/dbraw/zinc/35/76/61/197357661.db2.gz	BMCSYWKTZVRAQD-MRVPVSSYSA-N	0	3	314.798	2.037	10	70		DEIEHN
CC(C)N(CCN(C)C)C(=O)NCCc1cc(F)ccc1F	ZINC000159387046	402322978	/nfs/dbraw/zinc/32/29/78/402322978.db2.gz	RRHAHKBOWJBOID-UHFFFAOYSA-N	0	3	313.392	2.489	10	70		DEIEHN
O=C(NC[C@@H](O)CN1CCCCC1)c1cccc2ccccc21	ZINC000160362518	402342895	/nfs/dbraw/zinc/34/28/95/402342895.db2.gz	VJPSNSNIDULUHH-MRXNPFEDSA-N	0	3	312.413	2.416	10	70		DEIEHN
CC[C@](C)(O)CN1CCCN(C(=O)Oc2ccccc2)CC1	ZINC000161103683	402372872	/nfs/dbraw/zinc/37/28/72/402372872.db2.gz	ZXXODGLDWWEONX-KRWDZBQOSA-N	0	3	306.406	2.354	10	70		DEIEHN
CCC[C@@H](C(=O)NC[C@H](c1cccc(F)c1)N(C)C)N(C)C	ZINC000161299547	402381361	/nfs/dbraw/zinc/38/13/61/402381361.db2.gz	LZDRZQGOIDPELF-JKSUJKDBSA-N	0	3	309.429	2.275	10	70		DEIEHN
O=C([C@@H]1C[C@@H]1c1ccc(Br)cc1)N1CCCNCC1	ZINC000160859870	304384018	/nfs/dbraw/zinc/38/40/18/304384018.db2.gz	KNZQCBXTTMEDLG-ZIAGYGMSSA-N	0	3	323.234	2.375	10	70		DEIEHN
CCC[C@@H](C(=O)NC[C@H](O)c1ccc(OC(C)C)cc1)N(C)C	ZINC000160302104	197398794	/nfs/dbraw/zinc/39/87/94/197398794.db2.gz	MFCULXJXJJVOJI-IRXDYDNUSA-N	0	3	322.449	2.354	10	70		DEIEHN
COc1ccc([C@@H](C)NCCCN2CCCC2=O)c(OC)c1	ZINC000159559684	291656202	/nfs/dbraw/zinc/65/62/02/291656202.db2.gz	KNPVRRDUJZAONB-CYBMUJFWSA-N	0	3	306.406	2.367	10	70		DEIEHN
CC(C)[C@H]1CCN(S(=O)(=O)c2ccc(CN)cc2Cl)C1	ZINC000159427500	197352904	/nfs/dbraw/zinc/35/29/04/197352904.db2.gz	KXPIKEGUCMIFJH-LBPRGKRZSA-N	0	3	316.854	2.465	10	70		DEIEHN
CCN1CCC[C@H](NC(=O)NCc2ccnc(OC(C)C)c2)C1	ZINC000159735698	402329356	/nfs/dbraw/zinc/32/93/56/402329356.db2.gz	UZJGFOGPJRDPKN-HNNXBMFYSA-N	0	3	320.437	2.152	10	70		DEIEHN
CCn1cnnc1[C@@H]1CCCN(CCC(=O)OC(C)(C)C)C1	ZINC000161412759	402386458	/nfs/dbraw/zinc/38/64/58/402386458.db2.gz	GNSADVNTXFDYQQ-CYBMUJFWSA-N	0	3	308.426	2.209	10	70		DEIEHN
CN1CCC(Oc2ccc(NCC3=CCCOC3)cn2)CC1	ZINC000160173036	402337525	/nfs/dbraw/zinc/33/75/25/402337525.db2.gz	VSJQWLYFLNDNFC-UHFFFAOYSA-N	0	3	303.406	2.313	10	70		DEIEHN
CN(Cc1cnc2ccccn12)[C@H]1CCCN(c2cccnn2)C1	ZINC000159890774	197372086	/nfs/dbraw/zinc/37/20/86/197372086.db2.gz	WAHZABDEPXXIGI-HNNXBMFYSA-N	0	3	322.416	2.225	10	70		DEIEHN
CCC[C@H](C(=O)N1CCN(c2ccc(F)cc2)CC1)N(C)C	ZINC000161169119	402376174	/nfs/dbraw/zinc/37/61/74/402376174.db2.gz	HZVQAVVYZHMNJG-MRXNPFEDSA-N	0	3	307.413	2.205	10	70		DEIEHN
CC(C)N1CCCC[C@@H]1C(=O)N1CC[C@H](Oc2cccnc2)C1	ZINC000161409117	402386485	/nfs/dbraw/zinc/38/64/85/402386485.db2.gz	YJQGLOJFVLIYOR-DLBZAZTESA-N	0	3	317.433	2.324	10	70		DEIEHN
CCC[C@H]1CCN(S(=O)(=O)c2cccc3c2CCNC3)C1	ZINC000159967252	197376839	/nfs/dbraw/zinc/37/68/39/197376839.db2.gz	BBFHFJQEAGKRNH-ZDUSSCGKSA-N	0	3	308.447	2.143	10	70		DEIEHN
C[C@@H]1CC[C@@H](C(N)=O)CN1Cc1cccc2c1OC(C)(C)C2	ZINC000159574604	402325737	/nfs/dbraw/zinc/32/57/37/402325737.db2.gz	KGXGSPVLUXLBRJ-IUODEOHRSA-N	0	3	302.418	2.486	10	70		DEIEHN
O=C(NC[C@H](O)CN1CCCCC1)c1ccc(Cl)cc1F	ZINC000160620217	402354537	/nfs/dbraw/zinc/35/45/37/402354537.db2.gz	CGWDLTFXOZGBPM-LBPRGKRZSA-N	0	3	314.788	2.056	10	70		DEIEHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)C(=O)c2ccc3c(c2)CCC3)C1	ZINC000161099258	402372809	/nfs/dbraw/zinc/37/28/09/402372809.db2.gz	WIJYQGZUIZEYTJ-DYVFJYSZSA-N	0	3	314.429	2.203	10	70		DEIEHN
CCC[C@@H](C(=O)NCc1cc(OC)c(OC)c(OC)c1)N(C)C	ZINC000161277364	402380393	/nfs/dbraw/zinc/38/03/93/402380393.db2.gz	GVUXBZHHXMZTEX-ZDUSSCGKSA-N	0	3	324.421	2.059	10	70		DEIEHN
CCn1cnnc1[C@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000161281623	402380863	/nfs/dbraw/zinc/38/08/63/402380863.db2.gz	YGRLZVJBJHJERW-DLBZAZTESA-N	0	3	314.433	2.081	10	70		DEIEHN
CCC[C@H](C(=O)NCc1cccc(Cn2ccnc2)c1)N(C)C	ZINC000161496306	402389492	/nfs/dbraw/zinc/38/94/92/402389492.db2.gz	QSMGTJAKZGGMNA-QGZVFWFLSA-N	0	3	314.433	2.278	10	70		DEIEHN
CCN1CCN(CCCNC(=O)[C@@H]2C[C@@H]2C2CCCCC2)CC1	ZINC000160442412	535696795	/nfs/dbraw/zinc/69/67/95/535696795.db2.gz	BRBFELALVRFZEK-QZTJIDSGSA-N	0	3	321.509	2.347	10	70		DEIEHN
CCC[C@H](C(=O)NC[C@H](O)c1ccc(OC(C)C)cc1)N(C)C	ZINC000160302239	197399361	/nfs/dbraw/zinc/39/93/61/197399361.db2.gz	MFCULXJXJJVOJI-SJORKVTESA-N	0	3	322.449	2.354	10	70		DEIEHN
CCC[C@@H](C(=O)NCc1cnn(-c2ccccc2)c1)N(C)C	ZINC000161370963	402385033	/nfs/dbraw/zinc/38/50/33/402385033.db2.gz	LFCZHCILTMAAAC-INIZCTEOSA-N	0	3	300.406	2.219	10	70		DEIEHN
CO[C@@]1(CNC[C@@H](O)c2cc(Cl)ccc2Cl)CCOC1	ZINC000160293714	197398641	/nfs/dbraw/zinc/39/86/41/197398641.db2.gz	GXHJIKJUYAOSJK-ZIAGYGMSSA-N	0	3	320.216	2.422	10	70		DEIEHN
O=C(CC/C=C/c1ccccc1)NC[C@H](O)CN1CCCCC1	ZINC000160178686	197391590	/nfs/dbraw/zinc/39/15/90/197391590.db2.gz	DFKVDPXYPRPRBK-CZIMKVFHSA-N	0	3	316.445	2.443	10	70		DEIEHN
CCSCC[C@@H](C)N[C@@H]1CC(=O)N(C(CC)CC)C1=O	ZINC000160077647	197384742	/nfs/dbraw/zinc/38/47/42/197384742.db2.gz	MFPWWKHKJHZFFV-DGCLKSJQSA-N	0	3	300.468	2.424	10	70		DEIEHN
C[C@H](CC(=O)NC[C@H](O)CN1CCCCC1)c1ccccc1	ZINC000160080440	197384496	/nfs/dbraw/zinc/38/44/96/197384496.db2.gz	HLVIQEQGPGJSLF-WBVHZDCISA-N	0	3	304.434	2.143	10	70		DEIEHN
CC[C@@](C)(O)CN1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000160841949	402362695	/nfs/dbraw/zinc/36/26/95/402362695.db2.gz	VXKXOCZELTXOPF-QGZVFWFLSA-N	0	3	316.405	2.472	10	70		DEIEHN
CC(=O)c1c(C)[nH]c(C(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)c1C	ZINC000161331271	402382571	/nfs/dbraw/zinc/38/25/71/402382571.db2.gz	SWIDRTWJXMWAIL-IINYFYTJSA-N	0	3	305.422	2.293	10	70		DEIEHN
CCn1cnnc1[C@H]1CCCN(CCCOCC(F)(F)F)C1	ZINC000161351007	402384173	/nfs/dbraw/zinc/38/41/73/402384173.db2.gz	LAEVEYUVNJHMOG-LBPRGKRZSA-N	0	3	320.359	2.446	10	70		DEIEHN
CN(C)[C@@H]1CCN(C(=O)N[C@@H]2CCO[C@H](c3ccccc3)C2)C1	ZINC000160936123	282198002	/nfs/dbraw/zinc/19/80/02/282198002.db2.gz	LRHFIUSCLKTVSK-ZACQAIPSSA-N	0	3	317.433	2.252	10	70		DEIEHN
O=C(NC[C@H](O)CN1CCCCC1)c1cc2ccccc2s1	ZINC000160147844	197389002	/nfs/dbraw/zinc/38/90/02/197389002.db2.gz	GPHWCSLOZFWRRO-AWEZNQCLSA-N	0	3	318.442	2.478	10	70		DEIEHN
COc1cccc(Cl)c1CC(=O)N(C)[C@H]1CCCN(C)C1	ZINC000160142668	197389071	/nfs/dbraw/zinc/38/90/71/197389071.db2.gz	HUCDXFZIVNLXHN-LBPRGKRZSA-N	0	3	310.825	2.444	10	70		DEIEHN
O=C(NC[C@H](O)CN1CCCCC1)c1ccc2c(c1)CCCC2	ZINC000160478967	402347120	/nfs/dbraw/zinc/34/71/20/402347120.db2.gz	YVTVMZDGMPHQOP-SFHVURJKSA-N	0	3	316.445	2.142	10	70		DEIEHN
Cc1ccccc1[C@H](C)CC(=O)NC[C@H](O)CN1CCCCC1	ZINC000160582607	402352507	/nfs/dbraw/zinc/35/25/07/402352507.db2.gz	ALBJFBFFAUMBTA-SJORKVTESA-N	0	3	318.461	2.452	10	70		DEIEHN
CCC[C@H](C(=O)NC[C@H](O)c1cccc(OC(C)C)c1)N(C)C	ZINC000160630259	402354290	/nfs/dbraw/zinc/35/42/90/402354290.db2.gz	HYOFDNNPKQWIDG-SJORKVTESA-N	0	3	322.449	2.354	10	70		DEIEHN
COC(=O)Nc1ccccc1C(=O)N[C@H]1CN(C(C)C)C[C@@H]1C	ZINC000161410127	402386278	/nfs/dbraw/zinc/38/62/78/402386278.db2.gz	HVAXLVRLIBQWHA-WFASDCNBSA-N	0	3	319.405	2.323	10	70		DEIEHN
CCC[C@@H](C(=O)NCCCN1CCc2ccccc2C1)N(C)C	ZINC000161504371	402389906	/nfs/dbraw/zinc/38/99/06/402389906.db2.gz	RQQJNZKQTCTGIW-SFHVURJKSA-N	0	3	317.477	2.281	10	70		DEIEHN