smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)n1c(-c2ccccc2)csc1=Nc1ccccc1	ZINC000001466370	169708438	/nfs/dbraw/zinc/70/84/38/169708438.db2.gz	JBSMNIUXRLXEEH-UHFFFAOYSA-O	0	0	295.431	5.027	40	10		CKCBRN
C1=C[C@@H]2c3c(ccc4ccccc43)N[C@@H](c3ccccc3)[C@@H]2C1	ZINC000001515151	169711137	/nfs/dbraw/zinc/71/11/37/169711137.db2.gz	QRNCQNCMEJDRCT-JQVVWYNYSA-N	0	0	297.401	5.666	40	10		CKCBRN
CCc1cccc(CC)c1-n1c(C)ccc1-c1ccccc1	ZINC000001667705	567840741	/nfs/dbraw/zinc/84/07/41/567840741.db2.gz	ZPGIOLFZGBOCJC-UHFFFAOYSA-N	0	0	289.422	5.578	40	10		CKCBRN
Oc1ccc2ccccc2c1CNc1ccc2ccccc2c1	ZINC000001679495	567937495	/nfs/dbraw/zinc/93/74/95/567937495.db2.gz	FDLFDSDZJXCTHE-UHFFFAOYSA-N	0	0	299.373	5.311	40	10		CKCBRN
Nc1ccc(CCCCc2ccc(Cl)cc2Cl)cc1	ZINC000001728039	169751603	/nfs/dbraw/zinc/75/16/03/169751603.db2.gz	VQRKSABHGWKAII-UHFFFAOYSA-N	0	0	294.225	5.141	40	10		CKCBRN
CC(C)c1cccc(C(C)C)c1NCc1ccccc1O	ZINC000003183003	169865795	/nfs/dbraw/zinc/86/57/95/169865795.db2.gz	IJFVECRAGWBIFQ-UHFFFAOYSA-N	0	0	283.415	5.251	40	10		CKCBRN
CN(C)c1ccc(/N=N/c2cccc(C(F)(F)F)c2)cc1	ZINC000003874078	570384339	/nfs/dbraw/zinc/38/43/39/570384339.db2.gz	VEPXTLDJAORPCZ-FMQUCBEESA-N	0	0	293.292	5.187	40	10		CKCBRN
CC1=CC(=O)C=C(C)C1=NNc1ccc2ccccc2c1	ZINC000004100715	169931369	/nfs/dbraw/zinc/93/13/69/169931369.db2.gz	XVLDHBCDNAEYAU-FMQUCBEESA-N	0	0	276.339	5.578	40	10		CKCBRN
Nc1ccc2ccccc2c1/N=N/c1ccc2ccccc2c1	ZINC000004100719	567855432	/nfs/dbraw/zinc/85/54/32/567855432.db2.gz	FFRDJVXTPLFGCD-GHVJWSGMSA-N	0	0	297.361	5.991	40	10		CKCBRN
CC1=CC(=O)C=C(C)C1=NNc1cccc2ccccc21	ZINC000004100722	567855298	/nfs/dbraw/zinc/85/52/98/567855298.db2.gz	CKLRNEUSRAHUFY-FMQUCBEESA-N	0	0	276.339	5.578	40	10		CKCBRN
Cc1ccc2ccccc2c1NN=C1C(C)=CC(=O)C=C1C	ZINC000004100723	169931227	/nfs/dbraw/zinc/93/12/27/169931227.db2.gz	KIFKIAJJIAXMGW-QZQOTICOSA-N	0	0	290.366	5.886	40	10		CKCBRN
O=C1c2ccccc2C=CC1=NNc1ccc(Cl)cc1	ZINC000004100726	567855457	/nfs/dbraw/zinc/85/54/57/567855457.db2.gz	LQGZWKYUPOEIJS-VHEBQXMUSA-N	0	0	282.730	5.614	40	10		CKCBRN
CC1=CC(=NNc2ccc3ccccc3c2)C=CC1=O	ZINC000004100730	567855448	/nfs/dbraw/zinc/85/54/48/567855448.db2.gz	LVDFXHJGWPGUGU-VHEBQXMUSA-N	0	0	262.312	5.269	40	10		CKCBRN
Cc1ccc(/N=N/c2cc(Cl)c3ccccc3c2N)cc1	ZINC000004100731	567855414	/nfs/dbraw/zinc/85/54/14/567855414.db2.gz	AUYQITFJBRADIB-QZQOTICOSA-N	0	0	295.773	5.799	40	10		CKCBRN
C1=C[C@@H]2c3c(ccc4ccccc43)N[C@H](c3ccccc3)[C@@H]2C1	ZINC000004131745	567932448	/nfs/dbraw/zinc/93/24/48/567932448.db2.gz	QRNCQNCMEJDRCT-NNMXDRDESA-N	0	0	297.401	5.666	40	10		CKCBRN
C1=C[C@@H]2c3c(ccc4ccccc43)N[C@H](c3ccccc3)[C@H]2C1	ZINC000004131751	567932249	/nfs/dbraw/zinc/93/22/49/567932249.db2.gz	QRNCQNCMEJDRCT-CNNODRBYSA-N	0	0	297.401	5.666	40	10		CKCBRN
C1=C[C@@H]2c3c(ccc4ccccc43)N[C@@H](c3ccccc3)[C@H]2C1	ZINC000004131753	567932483	/nfs/dbraw/zinc/93/24/83/567932483.db2.gz	QRNCQNCMEJDRCT-IPJJNNNSSA-N	0	0	297.401	5.666	40	10		CKCBRN
Fc1ccc([C@H]2Nc3ccc(Cl)cc3[C@H]3C=CC[C@H]32)cc1	ZINC000004155570	567073041	/nfs/dbraw/zinc/07/30/41/567073041.db2.gz	AHDBIRAJXUWVRI-HDMKZQKVSA-N	0	0	299.776	5.306	40	10		CKCBRN
Fc1ccc([C@H]2Nc3ccc(Cl)cc3[C@H]3C=CC[C@@H]32)cc1	ZINC000004155574	567073824	/nfs/dbraw/zinc/07/38/24/567073824.db2.gz	AHDBIRAJXUWVRI-RLFYNMQTSA-N	0	0	299.776	5.306	40	10		CKCBRN
Clc1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1ccccc1)N2	ZINC000004155578	567074946	/nfs/dbraw/zinc/07/49/46/567074946.db2.gz	RZBJBIDHOBSXEP-HDMKZQKVSA-N	0	0	281.786	5.167	40	10		CKCBRN
Clc1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1ccccc1)N2	ZINC000004155580	567074844	/nfs/dbraw/zinc/07/48/44/567074844.db2.gz	RZBJBIDHOBSXEP-DAYGRLMNSA-N	0	0	281.786	5.167	40	10		CKCBRN
Clc1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@@H](c1ccccc1)N2	ZINC000004155581	567073304	/nfs/dbraw/zinc/07/33/04/567073304.db2.gz	RZBJBIDHOBSXEP-RLFYNMQTSA-N	0	0	281.786	5.167	40	10		CKCBRN
Clc1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccccc1)N2	ZINC000004155583	169939243	/nfs/dbraw/zinc/93/92/43/169939243.db2.gz	RZBJBIDHOBSXEP-MPGHIAIKSA-N	0	0	281.786	5.167	40	10		CKCBRN
Fc1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1ccccc1Cl)N2	ZINC000004320908	567856768	/nfs/dbraw/zinc/85/67/68/567856768.db2.gz	QVDQZGUDCMASFY-JCGVRSQUSA-N	0	0	299.776	5.306	40	10		CKCBRN
COc1cccc(NN=C2Sc3ccccc3C2=O)c1	ZINC000004565506	567932644	/nfs/dbraw/zinc/93/26/44/567932644.db2.gz	FVVDHACVJPWFJB-WUKNDPDISA-N	0	0	284.340	5.031	40	10		CKCBRN
CCN(CC)c1ccc(/N=N/c2cccc(F)c2)cc1	ZINC000004774667	170015010	/nfs/dbraw/zinc/01/50/10/170015010.db2.gz	WBAPZYAUNDQWNB-VHEBQXMUSA-N	0	0	271.339	5.087	40	10		CKCBRN
ClC(Cl)=C/N=N/c1ccc(Cl)cc1Cl	ZINC000004827950	170025016	/nfs/dbraw/zinc/02/50/16/170025016.db2.gz	PODGOMIYICKHFP-BUHFOSPRSA-N	0	0	269.946	5.354	40	10		CKCBRN
CC1=C(C)C(=NNc2ccccc2)C(C)=C(C)C1=O	ZINC000004829256	170024857	/nfs/dbraw/zinc/02/48/57/170024857.db2.gz	GFBMQRZQDSJVCU-ISLYRVAYSA-N	0	0	254.333	5.041	40	10		CKCBRN
CC(C)(C)c1ccc(NN=C2C=CC(=O)C=C2)cc1	ZINC000004829427	170025401	/nfs/dbraw/zinc/02/54/01/170025401.db2.gz	QNPDODTZFASIHE-ISLYRVAYSA-N	0	0	254.333	5.105	40	10		CKCBRN
C1C2CC3CC1CC(/N=N/C14CC5CC(CC(C5)C1)C4)(C2)C3	ZINC000005133287	170069352	/nfs/dbraw/zinc/06/93/52/170069352.db2.gz	WVQRDPQFWSLLII-QURGRASLSA-N	0	0	298.474	5.376	40	10		CKCBRN
Cc1ccc(/N=N/c2ccc(/C=C/c3ccccc3)cc2)cc1	ZINC000005257109	170080533	/nfs/dbraw/zinc/08/05/33/170080533.db2.gz	OLYOVURPQJLKTQ-OVEXIPILSA-N	0	0	298.389	6.581	40	10		CKCBRN
CCCCCCc1ccc(O)c(N=Nc2cccnc2)c1	ZINC000005261181	170080704	/nfs/dbraw/zinc/08/07/04/170080704.db2.gz	WBBDYFOWCSIWSE-FMQUCBEESA-N	0	0	283.375	5.325	40	10		CKCBRN
CC(C)Nc1ccc(Nc2ccc(NC(C)C)cc2)cc1	ZINC000005498921	170104625	/nfs/dbraw/zinc/10/46/25/170104625.db2.gz	VDPQCTCYTUTBQU-UHFFFAOYSA-N	0	0	283.419	5.071	40	10		CKCBRN
C=COc1ccc(/N=N/c2ccc(N(CC)CC)cc2)cc1	ZINC000005585425	170116150	/nfs/dbraw/zinc/11/61/50/170116150.db2.gz	MHRPJACCGUZWBA-FMQUCBEESA-N	0	0	295.386	5.471	40	10		CKCBRN
Cc1ccc(-c2ccccc2)n1-c1cccc(Cl)c1	ZINC000005589207	170116769	/nfs/dbraw/zinc/11/67/69/170116769.db2.gz	PNVMUHHSUXQDSQ-UHFFFAOYSA-N	0	0	267.759	5.106	40	10		CKCBRN
CSc1ccccc1-n1c(C)ccc1-c1ccccc1	ZINC000005589213	170116616	/nfs/dbraw/zinc/11/66/16/170116616.db2.gz	BIVHTXFYQDEACX-UHFFFAOYSA-N	0	0	279.408	5.175	40	10		CKCBRN
Cc1ccc(-c2ccccc2)n1-c1cc(Cl)ccc1C	ZINC000005740492	170135847	/nfs/dbraw/zinc/13/58/47/170135847.db2.gz	BQXFGTPSCFCFBH-UHFFFAOYSA-N	0	0	281.786	5.415	40	10		CKCBRN
CCCCN(CCCC)/N=N/N(CCCC)CCCC	ZINC000005783509	170139820	/nfs/dbraw/zinc/13/98/20/170139820.db2.gz	ILPYEQCVYIUDHI-ISLYRVAYSA-N	0	0	284.492	5.073	40	10		CKCBRN
Cc1ccc(-c2ccccc2)n1-c1ccc(Cl)cc1	ZINC000005930999	170157293	/nfs/dbraw/zinc/15/72/93/170157293.db2.gz	BZPQLJRROGWWPZ-UHFFFAOYSA-N	0	0	267.759	5.106	40	10		CKCBRN
Cc1ccc(-c2ccc(Cl)cc2)n1-c1ccccc1	ZINC000005931015	170157362	/nfs/dbraw/zinc/15/73/62/170157362.db2.gz	ARPFEVLLURJSLY-UHFFFAOYSA-N	0	0	267.759	5.106	40	10		CKCBRN
O=C1C=CC(=NNc2cccc3ccccc32)c2cccnc21	ZINC000006345280	170194405	/nfs/dbraw/zinc/19/44/05/170194405.db2.gz	UBQQPYJRFSCNRS-QURGRASLSA-N	0	0	299.333	5.509	40	10		CKCBRN
CC(C)c1cccc2c1N[C@H](c1ccccc1)[C@H]1CC=C[C@H]21	ZINC000006347706	170194615	/nfs/dbraw/zinc/19/46/15/170194615.db2.gz	FWRPIAFDNHGBKT-CMKODMSKSA-N	0	0	289.422	5.637	40	10		CKCBRN
CC(C)c1cccc2c1N[C@H](c1ccccc1)[C@@H]1CC=C[C@H]21	ZINC000006347745	170194612	/nfs/dbraw/zinc/19/46/12/170194612.db2.gz	FWRPIAFDNHGBKT-NLWGTHIKSA-N	0	0	289.422	5.637	40	10		CKCBRN
CCc1ccc(-n2c(C)ccc2-c2ccccc2)cc1	ZINC000006871043	529579571	/nfs/dbraw/zinc/57/95/71/529579571.db2.gz	WJCOZJDMXNEIKD-UHFFFAOYSA-N	0	0	261.368	5.015	40	10		CKCBRN
CCc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(F)cc1)N2	ZINC000006943932	567927960	/nfs/dbraw/zinc/92/79/60/567927960.db2.gz	PBYKCQXSXMLSKZ-UWVAXJGDSA-N	0	0	293.385	5.215	40	10		CKCBRN
CCc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cccc(F)c1)N2	ZINC000006943952	567927808	/nfs/dbraw/zinc/92/78/08/567927808.db2.gz	QZXUDIHLOCFFAY-UWVAXJGDSA-N	0	0	293.385	5.215	40	10		CKCBRN
CCc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccccc1)N2	ZINC000006943962	567927987	/nfs/dbraw/zinc/92/79/87/567927987.db2.gz	WLLNLGXUQVPARG-UWVAXJGDSA-N	0	0	275.395	5.076	40	10		CKCBRN
CCc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccccc1F)N2	ZINC000006943987	567927940	/nfs/dbraw/zinc/92/79/40/567927940.db2.gz	UTLQYTRUXRYLAQ-QEEYODRMSA-N	0	0	293.385	5.215	40	10		CKCBRN
CCc1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccc(F)cc1)N2	ZINC000006944019	567927850	/nfs/dbraw/zinc/92/78/50/567927850.db2.gz	PBYKCQXSXMLSKZ-HLIPFELVSA-N	0	0	293.385	5.215	40	10		CKCBRN
CCc1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1cccc(F)c1)N2	ZINC000006944039	567928009	/nfs/dbraw/zinc/92/80/09/567928009.db2.gz	QZXUDIHLOCFFAY-HLIPFELVSA-N	0	0	293.385	5.215	40	10		CKCBRN
CCc1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccccc1)N2	ZINC000006944048	567928018	/nfs/dbraw/zinc/92/80/18/567928018.db2.gz	WLLNLGXUQVPARG-HLIPFELVSA-N	0	0	275.395	5.076	40	10		CKCBRN
CCc1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccccc1F)N2	ZINC000006944072	567927816	/nfs/dbraw/zinc/92/78/16/567927816.db2.gz	UTLQYTRUXRYLAQ-STXHMFSFSA-N	0	0	293.385	5.215	40	10		CKCBRN
CCc1cccc2c1N[C@H](c1ccc(F)cc1)[C@H]1CC=C[C@H]21	ZINC000006944788	567077355	/nfs/dbraw/zinc/07/73/55/567077355.db2.gz	POSGFPKBZGVYGA-IMFGXOCKSA-N	0	0	293.385	5.215	40	10		CKCBRN
CCc1cccc2c1N[C@H](c1cccc(F)c1)[C@H]1CC=C[C@H]21	ZINC000006944811	567076666	/nfs/dbraw/zinc/07/66/66/567076666.db2.gz	WDODSZFMLDWUMN-IMFGXOCKSA-N	0	0	293.385	5.215	40	10		CKCBRN
CCc1cccc2c1N[C@H](c1ccccc1)[C@H]1CC=C[C@H]21	ZINC000006944824	567927833	/nfs/dbraw/zinc/92/78/33/567927833.db2.gz	LWTXSNDMVFPJHX-IMFGXOCKSA-N	0	0	275.395	5.076	40	10		CKCBRN
CCc1cccc2c1N[C@H](c1ccccc1F)[C@H]1CC=C[C@H]21	ZINC000006944852	567077509	/nfs/dbraw/zinc/07/75/09/567077509.db2.gz	HMNUNZMMDKRMMW-IIMJZQEZSA-N	0	0	293.385	5.215	40	10		CKCBRN
CCc1cccc2c1N[C@H](c1ccc(F)cc1)[C@@H]1CC=C[C@H]21	ZINC000006944885	567077397	/nfs/dbraw/zinc/07/73/97/567077397.db2.gz	POSGFPKBZGVYGA-YVWKXTFCSA-N	0	0	293.385	5.215	40	10		CKCBRN
CCc1cccc2c1N[C@H](c1cccc(F)c1)[C@@H]1CC=C[C@H]21	ZINC000006944905	567927820	/nfs/dbraw/zinc/92/78/20/567927820.db2.gz	WDODSZFMLDWUMN-YVWKXTFCSA-N	0	0	293.385	5.215	40	10		CKCBRN
CCc1cccc2c1N[C@H](c1ccccc1)[C@@H]1CC=C[C@H]21	ZINC000006944916	570218140	/nfs/dbraw/zinc/21/81/40/570218140.db2.gz	LWTXSNDMVFPJHX-YVWKXTFCSA-N	0	0	275.395	5.076	40	10		CKCBRN
CCc1cccc2c1N[C@H](c1ccccc1F)[C@@H]1CC=C[C@H]21	ZINC000006944947	567075599	/nfs/dbraw/zinc/07/55/99/567075599.db2.gz	HMNUNZMMDKRMMW-KKVAFCGZSA-N	0	0	293.385	5.215	40	10		CKCBRN
Cc1cc(C)c2c(c1)N[C@H](c1cccc(F)c1)[C@H]1CC=C[C@H]21	ZINC000006962645	567078978	/nfs/dbraw/zinc/07/89/78/567078978.db2.gz	SXJJUACECWLPPI-ABSDTBQOSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1cc(C)c2c(c1)N[C@H](c1ccccc1F)[C@H]1CC=C[C@H]21	ZINC000006962654	567079309	/nfs/dbraw/zinc/07/93/09/567079309.db2.gz	CWRHHVYKQAVYHZ-AVYPCKFXSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1cc(C)c2c(c1)N[C@H](c1cccc(F)c1)[C@@H]1CC=C[C@H]21	ZINC000006962660	567078949	/nfs/dbraw/zinc/07/89/49/567078949.db2.gz	SXJJUACECWLPPI-SQGPQFPESA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1cc(C)c2c(c1)N[C@H](c1ccccc1F)[C@@H]1CC=C[C@H]21	ZINC000006962670	567078431	/nfs/dbraw/zinc/07/84/31/567078431.db2.gz	CWRHHVYKQAVYHZ-MDOVXXIYSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1cc(C)c2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(F)cc1)N2	ZINC000006962706	170259319	/nfs/dbraw/zinc/25/93/19/170259319.db2.gz	GHECMUFXGUDBEG-UWVAXJGDSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1cc(C)c2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cccc(F)c1)N2	ZINC000006962712	567079670	/nfs/dbraw/zinc/07/96/70/567079670.db2.gz	NRFOKLKPMHJQDA-UWVAXJGDSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1cc(C)c2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccccc1)N2	ZINC000006962715	170259286	/nfs/dbraw/zinc/25/92/86/170259286.db2.gz	RLKYJFIGCXLORB-UWVAXJGDSA-N	0	0	275.395	5.130	40	10		CKCBRN
Cc1cc(C)c2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccccc1F)N2	ZINC000006962725	567928234	/nfs/dbraw/zinc/92/82/34/567928234.db2.gz	RLLFAQSIIVGKAU-QEEYODRMSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1cc(C)c2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccc(F)cc1)N2	ZINC000006962731	170259265	/nfs/dbraw/zinc/25/92/65/170259265.db2.gz	GHECMUFXGUDBEG-HLIPFELVSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1cc(C)c2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1cccc(F)c1)N2	ZINC000006962737	567928246	/nfs/dbraw/zinc/92/82/46/567928246.db2.gz	NRFOKLKPMHJQDA-HLIPFELVSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1cc(C)c2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccccc1)N2	ZINC000006962741	170259323	/nfs/dbraw/zinc/25/93/23/170259323.db2.gz	RLKYJFIGCXLORB-HLIPFELVSA-N	0	0	275.395	5.130	40	10		CKCBRN
Cc1cc(C)c2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccccc1F)N2	ZINC000006962750	567928102	/nfs/dbraw/zinc/92/81/02/567928102.db2.gz	RLLFAQSIIVGKAU-STXHMFSFSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1ccc2c(c1C)N[C@H](c1ccc(F)cc1)[C@H]1CC=C[C@H]21	ZINC000006967080	170259683	/nfs/dbraw/zinc/25/96/83/170259683.db2.gz	MLDPKAWULSAJQA-ABSDTBQOSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1ccc2c(c1C)N[C@H](c1cccc(F)c1)[C@H]1CC=C[C@H]21	ZINC000006967083	567078617	/nfs/dbraw/zinc/07/86/17/567078617.db2.gz	JRCDQNOMXFJEEN-ABSDTBQOSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1ccc2c(c1C)N[C@H](c1ccccc1)[C@H]1CC=C[C@H]21	ZINC000006967085	170259489	/nfs/dbraw/zinc/25/94/89/170259489.db2.gz	QBUVBHCWTNGRPC-ABSDTBQOSA-N	0	0	275.395	5.130	40	10		CKCBRN
Cc1ccc2c(c1C)N[C@H](c1ccccc1F)[C@H]1CC=C[C@H]21	ZINC000006967090	567928205	/nfs/dbraw/zinc/92/82/05/567928205.db2.gz	RTWWMLTXWOBRFY-AVYPCKFXSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1ccc2c(c1C)N[C@H](c1ccc(F)cc1)[C@@H]1CC=C[C@H]21	ZINC000006967093	170259504	/nfs/dbraw/zinc/25/95/04/170259504.db2.gz	MLDPKAWULSAJQA-SQGPQFPESA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1ccc2c(c1C)N[C@H](c1cccc(F)c1)[C@@H]1CC=C[C@H]21	ZINC000006967096	567928165	/nfs/dbraw/zinc/92/81/65/567928165.db2.gz	JRCDQNOMXFJEEN-SQGPQFPESA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1ccc2c(c1C)N[C@H](c1ccccc1)[C@@H]1CC=C[C@H]21	ZINC000006967098	170259665	/nfs/dbraw/zinc/25/96/65/170259665.db2.gz	QBUVBHCWTNGRPC-SQGPQFPESA-N	0	0	275.395	5.130	40	10		CKCBRN
Cc1ccc2c(c1C)N[C@H](c1ccccc1F)[C@@H]1CC=C[C@H]21	ZINC000006967103	567938964	/nfs/dbraw/zinc/93/89/64/567938964.db2.gz	RTWWMLTXWOBRFY-MDOVXXIYSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1cccc2c1N[C@H](c1cccc(Cl)c1)[C@H]1CC=C[C@H]21	ZINC000006968657	567928130	/nfs/dbraw/zinc/92/81/30/567928130.db2.gz	XEOKFLFVCUVUPC-HHXXYDBFSA-N	0	0	295.813	5.475	40	10		CKCBRN
Cc1cccc2c1N[C@H](c1ccccc1Cl)[C@H]1CC=C[C@H]21	ZINC000006968671	567928229	/nfs/dbraw/zinc/92/82/29/567928229.db2.gz	PUZIBDYIROBOQZ-WTANOLMUSA-N	0	0	295.813	5.475	40	10		CKCBRN
Cc1cccc2c1N[C@H](c1cccc(Cl)c1)[C@@H]1CC=C[C@H]21	ZINC000006968682	567928110	/nfs/dbraw/zinc/92/81/10/567928110.db2.gz	XEOKFLFVCUVUPC-SZVBFZGTSA-N	0	0	295.813	5.475	40	10		CKCBRN
Cc1cccc2c1N[C@H](c1ccccc1Cl)[C@@H]1CC=C[C@H]21	ZINC000006968696	567928169	/nfs/dbraw/zinc/92/81/69/567928169.db2.gz	PUZIBDYIROBOQZ-MUKKUYKPSA-N	0	0	295.813	5.475	40	10		CKCBRN
Cc1ccc(C)n1-c1ccc(Oc2cccc(C)c2C)cc1	ZINC000007468529	567078726	/nfs/dbraw/zinc/07/87/26/567078726.db2.gz	ZIBXSKFANSWLBX-UHFFFAOYSA-N	0	0	291.394	5.503	40	10		CKCBRN
Cc1ccc(C)n1-c1ccc(Oc2ccc(C)c(C)c2)cc1	ZINC000007468533	567078440	/nfs/dbraw/zinc/07/84/40/567078440.db2.gz	JYFIGVATZYBVFL-UHFFFAOYSA-N	0	0	291.394	5.503	40	10		CKCBRN
CCc1ccc([C@@H]2Nc3ccc(F)cc3[C@H]3C=CC[C@H]32)cc1	ZINC000008087391	570268887	/nfs/dbraw/zinc/26/88/87/570268887.db2.gz	BQTFOQWXNJWOBU-QKLQHJQFSA-N	0	0	293.385	5.215	40	10		CKCBRN
CCc1ccc([C@@H]2Nc3c(F)cccc3[C@H]3C=CC[C@H]32)cc1	ZINC000008087404	570268871	/nfs/dbraw/zinc/26/88/71/570268871.db2.gz	LFYKWLHKPIEKIG-FCEWJHQRSA-N	0	0	293.385	5.215	40	10		CKCBRN
CCc1ccc([C@@H]2Nc3ccc(F)cc3[C@H]3C=CC[C@@H]32)cc1	ZINC000008087439	567079632	/nfs/dbraw/zinc/07/96/32/567079632.db2.gz	BQTFOQWXNJWOBU-ZWOKBUDYSA-N	0	0	293.385	5.215	40	10		CKCBRN
CCc1ccc([C@@H]2Nc3c(F)cccc3[C@H]3C=CC[C@@H]32)cc1	ZINC000008087451	567079236	/nfs/dbraw/zinc/07/92/36/567079236.db2.gz	LFYKWLHKPIEKIG-BXWFABGCSA-N	0	0	293.385	5.215	40	10		CKCBRN
Cc1c(Cl)ccc2c1N[C@H](c1ccccc1)[C@H]1CC=C[C@H]21	ZINC000008276616	170328593	/nfs/dbraw/zinc/32/85/93/170328593.db2.gz	NSGTXULNJIRAFW-YZVOILCLSA-N	0	0	295.813	5.475	40	10		CKCBRN
Cc1c(Cl)ccc2c1N[C@H](c1ccccc1)[C@@H]1CC=C[C@H]21	ZINC000008276816	170328457	/nfs/dbraw/zinc/32/84/57/170328457.db2.gz	NSGTXULNJIRAFW-QMTMVMCOSA-N	0	0	295.813	5.475	40	10		CKCBRN
Cc1cc(Cl)cc2c1N[C@H](c1ccccc1)[C@H]1CC=C[C@H]21	ZINC000008336070	567079078	/nfs/dbraw/zinc/07/90/78/567079078.db2.gz	QURTYLWRADFHJY-TXPKVOOTSA-N	0	0	295.813	5.475	40	10		CKCBRN
Cc1cc(Cl)cc2c1N[C@H](c1ccccc1)[C@@H]1CC=C[C@H]21	ZINC000008336100	567078577	/nfs/dbraw/zinc/07/85/77/567078577.db2.gz	QURTYLWRADFHJY-FRQCXROJSA-N	0	0	295.813	5.475	40	10		CKCBRN
Cc1ccc(Cl)c2c1N[C@H](c1ccccc1)[C@H]1CC=C[C@H]21	ZINC000008371312	170333433	/nfs/dbraw/zinc/33/34/33/170333433.db2.gz	MQNNJDXLAUOKQZ-YZVOILCLSA-N	0	0	295.813	5.475	40	10		CKCBRN
Cc1ccc(Cl)c2c1N[C@H](c1ccccc1)[C@@H]1CC=C[C@H]21	ZINC000008371339	170333216	/nfs/dbraw/zinc/33/32/16/170333216.db2.gz	MQNNJDXLAUOKQZ-QMTMVMCOSA-N	0	0	295.813	5.475	40	10		CKCBRN
Cc1ccc(-c2ccccc2)n1-c1ccc(C)cc1C	ZINC000008410725	170335184	/nfs/dbraw/zinc/33/51/84/170335184.db2.gz	JOXCYLWOYWOFLD-UHFFFAOYSA-N	0	0	261.368	5.070	40	10		CKCBRN
Cc1ccc(-c2ccccc2)n1-c1cc(C)ccc1C	ZINC000008411197	170335476	/nfs/dbraw/zinc/33/54/76/170335476.db2.gz	YFJYLECEJOQEFW-UHFFFAOYSA-N	0	0	261.368	5.070	40	10		CKCBRN
Cc1ccc(-c2ccccc2)n1-c1ccc(C)c(Cl)c1	ZINC000008412970	170335101	/nfs/dbraw/zinc/33/51/01/170335101.db2.gz	GCXLOOQXRGXMGZ-UHFFFAOYSA-N	0	0	281.786	5.415	40	10		CKCBRN
COc1ccc(-n2c(C)ccc2-c2ccccc2)cc1Cl	ZINC000008413262	170335169	/nfs/dbraw/zinc/33/51/69/170335169.db2.gz	ZHYGUBIPDIBDSV-UHFFFAOYSA-N	0	0	297.785	5.115	40	10		CKCBRN
Cc1ccc(-c2ccccc2)n1-c1ccc(C(C)C)cc1	ZINC000008413276	170335201	/nfs/dbraw/zinc/33/52/01/170335201.db2.gz	GJUQWKYEHYUUMW-UHFFFAOYSA-N	0	0	275.395	5.576	40	10		CKCBRN
Cc1ccc(-c2ccccc2)n1-c1ccc2ccccc2c1	ZINC000008413405	170335268	/nfs/dbraw/zinc/33/52/68/170335268.db2.gz	IUVWIAJLALJOAT-UHFFFAOYSA-N	0	0	283.374	5.606	40	10		CKCBRN
Cc1ccc(-c2ccccc2)n1-c1cccc(Cl)c1C	ZINC000008413464	170335828	/nfs/dbraw/zinc/33/58/28/170335828.db2.gz	IMLRRQGKNPJEJV-UHFFFAOYSA-N	0	0	281.786	5.415	40	10		CKCBRN
Cc1ccc(-c2ccccc2)n1-c1ccccc1C(C)C	ZINC000008413490	170335644	/nfs/dbraw/zinc/33/56/44/170335644.db2.gz	STKKCPQJONCWAF-UHFFFAOYSA-N	0	0	275.395	5.576	40	10		CKCBRN
Cc1ccc(-c2ccccc2)n1-c1ccccc1Cl	ZINC000008413498	170335635	/nfs/dbraw/zinc/33/56/35/170335635.db2.gz	VRUQYPOKKOFQGT-UHFFFAOYSA-N	0	0	267.759	5.106	40	10		CKCBRN
Cc1cccc(/N=N/c2cc(C)nc(-c3ccccc3)n2)c1	ZINC000013303679	567941485	/nfs/dbraw/zinc/94/14/85/567941485.db2.gz	XZIZWGBYMHABIB-QURGRASLSA-N	0	0	288.354	5.176	40	10		CKCBRN
c1ccc(/N=N/c2ccccc2/N=N/c2ccccc2)cc1	ZINC000013402458	567865890	/nfs/dbraw/zinc/86/58/90/567865890.db2.gz	HGRDUZITLBEBJY-FLFKKZLDSA-N	0	0	286.338	6.517	40	10		CKCBRN
c1ccc(/N=N\c2ccccc2NNc2ccccc2)cc1	ZINC000013402463	567866008	/nfs/dbraw/zinc/86/60/08/567866008.db2.gz	QMBCLWMHMHVQJG-XDOYNYLZSA-N	0	0	288.354	5.541	40	10		CKCBRN
Nc1ccc(-c2ccc(/N=N/c3ccccc3)cc2)cc1	ZINC000013403207	567865982	/nfs/dbraw/zinc/86/59/82/567865982.db2.gz	AJSGOWHOHHVXAV-QZQOTICOSA-N	0	0	273.339	5.351	40	10		CKCBRN
Clc1cccc(/N=N/c2cccc(Cl)c2)c1	ZINC000013410916	567866285	/nfs/dbraw/zinc/86/62/85/567866285.db2.gz	ZAUXEPYLONOZEK-FOCLMDBBSA-N	0	0	251.116	5.409	40	10		CKCBRN
CN(C)c1ccc(NN=C2C(=O)C=Cc3ccccc32)cc1	ZINC000013477080	567866155	/nfs/dbraw/zinc/86/61/55/567866155.db2.gz	KSGXGIDRHWKRFO-FMQUCBEESA-N	0	0	291.354	5.027	40	10		CKCBRN
Clc1cccc([C@@H]2Nc3ccccc3[C@@H]3C=CC[C@@H]32)c1	ZINC000014460176	170634701	/nfs/dbraw/zinc/63/47/01/170634701.db2.gz	VXXBDBLRCPPPPV-ZVZYQTTQSA-N	0	0	281.786	5.167	40	10		CKCBRN
Cc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cccc(Cl)c1)N2	ZINC000014460284	567943203	/nfs/dbraw/zinc/94/32/03/567943203.db2.gz	SALHZDXWFMJPAX-GJYPPUQNSA-N	0	0	295.813	5.475	40	10		CKCBRN
Clc1ccc([C@@H]2Nc3ccccc3[C@@H]3C=CC[C@@H]32)cc1	ZINC000014464793	567943262	/nfs/dbraw/zinc/94/32/62/567943262.db2.gz	PKTHILWDBNXPFM-ZVZYQTTQSA-N	0	0	281.786	5.167	40	10		CKCBRN
Cc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(Cl)cc1)N2	ZINC000014464957	567943225	/nfs/dbraw/zinc/94/32/25/567943225.db2.gz	BGXYZPIGOJSEAN-GJYPPUQNSA-N	0	0	295.813	5.475	40	10		CKCBRN
Fc1cccc2c1N[C@H](c1ccccc1Cl)[C@@H]1CC=C[C@H]21	ZINC000014466155	567943239	/nfs/dbraw/zinc/94/32/39/567943239.db2.gz	XTBIBSPEHQXEQQ-JKDFXYPNSA-N	0	0	299.776	5.306	40	10		CKCBRN
Fc1cccc2c1N[C@H](c1ccccc1Cl)[C@H]1CC=C[C@H]21	ZINC000014466159	567943305	/nfs/dbraw/zinc/94/33/05/567943305.db2.gz	XTBIBSPEHQXEQQ-PRXAMGSTSA-N	0	0	299.776	5.306	40	10		CKCBRN
c1ccc2c(c1)cccc2/N=N\c1cccc2ccccc21	ZINC000015657760	170673645	/nfs/dbraw/zinc/67/36/45/170673645.db2.gz	ICIDZHMCYAIUIJ-DQRAZIAOSA-N	0	0	282.346	6.408	40	10		CKCBRN
Cc1ccc(-c2nc(N)sc2/N=N/c2ccccc2)cc1	ZINC000016756752	567873789	/nfs/dbraw/zinc/87/37/89/567873789.db2.gz	MNALDZPGNUHUNL-FMQUCBEESA-N	0	0	294.383	5.116	40	10		CKCBRN
c1ccc(/N=N/c2ccc3c(c2)Cc2ccccc2-3)cc1	ZINC000016930120	567874241	/nfs/dbraw/zinc/87/42/41/567874241.db2.gz	CCYXIDZPPFRJML-QZQOTICOSA-N	0	0	270.335	5.673	40	10		CKCBRN
Cc1ccc(/N=N/c2ccc(N(C)C)cc2)c2cccnc12	ZINC000017001699	570226356	/nfs/dbraw/zinc/22/63/56/570226356.db2.gz	CGOSBNDARVLJIZ-QZQOTICOSA-N	0	0	290.370	5.025	40	10		CKCBRN
CC(C)(C)C=CN=NNc1cc2ccccc2s1	ZINC000017141716	567875075	/nfs/dbraw/zinc/87/50/75/567875075.db2.gz	LQDALNXHYVVZJL-HJWRWDBZSA-N	0	0	259.378	5.240	40	10		CKCBRN
Cc1ccccc1/N=N/c1c(N)ccc2ccccc21	ZINC000017145826	567875071	/nfs/dbraw/zinc/87/50/71/567875071.db2.gz	BWLVSYUUKOQICP-FMQUCBEESA-N	0	0	261.328	5.146	40	10	in-vitro	CKCBRN
O=C1C=Cc2ccccc2C1=NNc1cccc2ccccc21	ZINC000017303134	567875771	/nfs/dbraw/zinc/87/57/71/567875771.db2.gz	CYZWPZHRSZNWLS-QURGRASLSA-N	0	0	298.345	6.114	40	10		CKCBRN
Cc1ccccc1NN=C1C(=O)C=Cc2ccccc21	ZINC000017315617	567875802	/nfs/dbraw/zinc/87/58/02/567875802.db2.gz	BQFCCCIRTOLPEF-HNENSFHCSA-N	0	0	262.312	5.269	40	10		CKCBRN
Clc1ccccc1/N=N/Nc1ccccc1Cl	ZINC000017354821	326852735	/nfs/dbraw/zinc/85/27/35/326852735.db2.gz	YWFBICWAYSUKBW-UHFFFAOYSA-N	0	0	266.131	5.104	40	10		CKCBRN
CN(C)c1ccc(/N=N/c2ccc(C(C)(C)C)cc2)cc1	ZINC000017723653	567875946	/nfs/dbraw/zinc/87/59/46/567875946.db2.gz	JWLFMUICIGZZCE-FMQUCBEESA-N	0	0	281.403	5.466	40	10		CKCBRN
Clc1cc(Cl)cc(/N=N/c2ccccc2)c1	ZINC000017723708	567876281	/nfs/dbraw/zinc/87/62/81/567876281.db2.gz	HZILWDQYQBVWEQ-FOCLMDBBSA-N	0	0	251.116	5.409	40	10		CKCBRN
CN(C)c1ccc(/N=N/c2ccc(Cl)c(Cl)c2)cc1	ZINC000017778120	529775164	/nfs/dbraw/zinc/77/51/64/529775164.db2.gz	UFIRCJCHYJYING-ISLYRVAYSA-N	0	0	294.185	5.475	40	10		CKCBRN
O=C1C=Cc2ccccc2C1=NNc1ccc(F)cc1	ZINC000017887209	567876171	/nfs/dbraw/zinc/87/61/71/567876171.db2.gz	IVVQQRFRRJBPRA-VHEBQXMUSA-N	0	0	266.275	5.100	40	10		CKCBRN
c1ccc(/N=N/c2ccc(/N=N/c3ccccc3)cc2)cc1	ZINC000017918419	567875974	/nfs/dbraw/zinc/87/59/74/567875974.db2.gz	QLYZYCHWGGSYBD-FLFKKZLDSA-N	0	0	286.338	6.517	40	10		CKCBRN
Clc1ccc(/N=N/c2ccc(Br)cc2)cc1	ZINC000017920021	567876027	/nfs/dbraw/zinc/87/60/27/567876027.db2.gz	FICSPQVTDKNMFD-FOCLMDBBSA-N	0	0	295.567	5.518	40	10		CKCBRN
Clc1ccc(/N=N/Nc2ccc(Cl)cc2)cc1	ZINC000018029147	170740214	/nfs/dbraw/zinc/74/02/14/170740214.db2.gz	JGGKQOIDGHALJJ-UHFFFAOYSA-N	0	0	266.131	5.104	40	10		CKCBRN
CN(C)c1ccc(/N=N/c2cc(Cl)cc(Cl)c2)cc1	ZINC000018038431	567875943	/nfs/dbraw/zinc/87/59/43/567875943.db2.gz	GTRBBODTGWNQQF-ISLYRVAYSA-N	0	0	294.185	5.475	40	10		CKCBRN
c1ccc2cc(/N=N/Nc3ccc4ccccc4c3)ccc2c1	ZINC000018054873	567892226	/nfs/dbraw/zinc/89/22/26/567892226.db2.gz	IFIYWEWLCDTTHL-UHFFFAOYSA-N	0	0	297.361	6.104	40	10		CKCBRN
c1c2ccccc2[nH]c1/N=N/c1cccc2ccccc21	ZINC000018055200	567876571	/nfs/dbraw/zinc/87/65/71/567876571.db2.gz	ZZYLGLMHJRWQFL-QZQOTICOSA-N	0	0	271.323	5.737	40	10		CKCBRN
c1ccc(/N=N/c2ccc3c(ccc4ccccc43)c2)cc1	ZINC000018057547	170740826	/nfs/dbraw/zinc/74/08/26/170740826.db2.gz	LDXXLWOZELZFLU-QURGRASLSA-N	0	0	282.346	6.408	40	10		CKCBRN
CCn1c2ccccc2c2ccc(/N=N/c3ccccc3)cc21	ZINC000018067424	567876391	/nfs/dbraw/zinc/87/63/91/567876391.db2.gz	CNYXWEWFSUWBCI-QURGRASLSA-N	0	0	299.377	6.230	40	10		CKCBRN
O=C1C=Cc2ccccc2C1=NNc1ccc(Cl)cc1	ZINC000018067544	567876603	/nfs/dbraw/zinc/87/66/03/567876603.db2.gz	YDEBPHALQZHQLZ-VHEBQXMUSA-N	0	0	282.730	5.614	40	10		CKCBRN
CCN(/N=N/c1ccc(C)cc1)/N=N/c1ccc(C)cc1	ZINC000018067982	567876331	/nfs/dbraw/zinc/87/63/31/567876331.db2.gz	VQAVMXFAKOWZPK-XPWSMXQVSA-N	0	0	281.363	5.323	40	10		CKCBRN
Cc1ccc(/N=N/c2c(N)ccc3ccccc32)cc1	ZINC000018068323	567876708	/nfs/dbraw/zinc/87/67/08/567876708.db2.gz	BQGNKVPRHVXLFL-FMQUCBEESA-N	0	0	261.328	5.146	40	10		CKCBRN
Cc1ccc(NN=C2C(=O)C=Cc3ccccc32)cc1	ZINC000018083745	567876555	/nfs/dbraw/zinc/87/65/55/567876555.db2.gz	JCZUIEHTNMQCRK-VHEBQXMUSA-N	0	0	262.312	5.269	40	10		CKCBRN
Cc1nc(N=Nc2ccccc2)[nH]c1N=Nc1ccccc1	ZINC000018085106	567876393	/nfs/dbraw/zinc/87/63/93/567876393.db2.gz	JLRWIRBFDUKCMN-FLFKKZLDSA-N	0	0	290.330	5.549	40	10		CKCBRN
Cc1nc(N=Nc2ccccc2)[nH]c1N=Nc1ccccc1	ZINC000018085109	567876403	/nfs/dbraw/zinc/87/64/03/567876403.db2.gz	JLRWIRBFDUKCMN-WRBBJXAJSA-N	0	0	290.330	5.549	40	10		CKCBRN
CC(C)c1ccc(/N=N/c2ccc(C(C)C)cc2)cc1	ZINC000018085907	567876437	/nfs/dbraw/zinc/87/64/37/567876437.db2.gz	BCCJRCKGVMFWDL-FMQUCBEESA-N	0	0	266.388	6.349	40	10		CKCBRN
Cc1ccc(/N=N/c2ccc(C)cc2NC(=O)C2CC2)cc1	ZINC000018086973	170741968	/nfs/dbraw/zinc/74/19/68/170741968.db2.gz	DSWDPYAVLIHLGK-QZQOTICOSA-N	0	0	293.370	5.067	40	10		CKCBRN
CN(C)c1ccc(/N=N/c2cccc3ccccc32)cc1	ZINC000018099377	567876337	/nfs/dbraw/zinc/87/63/37/567876337.db2.gz	RKGIHRYVFSZPKN-FMQUCBEESA-N	0	0	275.355	5.321	40	10		CKCBRN
CN(C)c1ccc(/N=N/c2cccc(Cl)c2Cl)cc1	ZINC000018101195	170742696	/nfs/dbraw/zinc/74/26/96/170742696.db2.gz	ZLKSFACZQYTCIF-ISLYRVAYSA-N	0	0	294.185	5.475	40	10		CKCBRN
CC(C)(C)/C=C/N/N=N/c1cc2ccccc2s1	ZINC000018125186	567876660	/nfs/dbraw/zinc/87/66/60/567876660.db2.gz	LQDALNXHYVVZJL-CMDGGOBGSA-N	0	0	259.378	5.049	40	10		CKCBRN
c1ccc2cc(/N=N/c3cccc4ccccc43)ccc2c1	ZINC000018128283	567876560	/nfs/dbraw/zinc/87/65/60/567876560.db2.gz	INTYTLPOFHZKQE-QURGRASLSA-N	0	0	282.346	6.408	40	10		CKCBRN
CCc1ccc(/N=N/c2ccc(Br)cc2)cc1	ZINC000018154161	170744191	/nfs/dbraw/zinc/74/41/91/170744191.db2.gz	IBDPZJBJJPCQDD-WUKNDPDISA-N	0	0	289.176	5.427	40	10		CKCBRN
CC(C)c1ccc(/N=N/c2ccc(N(C)C)cc2)cc1	ZINC000018157568	170744694	/nfs/dbraw/zinc/74/46/94/170744694.db2.gz	GIYUBPYYTBWGPK-VHEBQXMUSA-N	0	0	267.376	5.291	40	10		CKCBRN
Clc1cccc(/N=N\Nc2cccc(Cl)c2)c1	ZINC000018178658	567876856	/nfs/dbraw/zinc/87/68/56/567876856.db2.gz	LJFGVHJIOVPLEQ-UHFFFAOYSA-N	0	0	266.131	5.104	40	10		CKCBRN
O=C1c2ccccc2-c2ccccc2C1=NNc1ccccc1	ZINC000018206013	567876850	/nfs/dbraw/zinc/87/68/50/567876850.db2.gz	WAVHCKVIMLPQQP-QURGRASLSA-N	0	0	298.345	6.114	40	10		CKCBRN
O=C1C=CC(=NNc2cc(Cl)ccc2Cl)C=C1	ZINC000018208236	567876990	/nfs/dbraw/zinc/87/69/90/567876990.db2.gz	AKIOYUFHFCDHTO-FOCLMDBBSA-N	0	0	267.115	5.114	40	10		CKCBRN
Cc1cc(N(C)C)ccc1/N=N/c1ccc2ncccc2c1	ZINC000018211623	567876830	/nfs/dbraw/zinc/87/68/30/567876830.db2.gz	PYUGLZIVWJGWCX-QZQOTICOSA-N	0	0	290.370	5.025	40	10		CKCBRN
Clc1ccccc1[C@H]1Nc2ccccc2[C@H]2C=CC[C@H]21	ZINC000020033480	170974358	/nfs/dbraw/zinc/97/43/58/170974358.db2.gz	VKLOEKYWXCWIBZ-DFHBCGBQSA-N	0	0	281.786	5.167	40	10		CKCBRN
Fc1cccc2c1N[C@H](c1ccccc1Cl)[C@H]1CC=C[C@@H]21	ZINC000020700400	171269963	/nfs/dbraw/zinc/26/99/63/171269963.db2.gz	XTBIBSPEHQXEQQ-PEBVRCNWSA-N	0	0	299.776	5.306	40	10		CKCBRN
Fc1cccc2c1N[C@H](c1ccccc1Cl)[C@@H]1CC=C[C@@H]21	ZINC000020700403	171269915	/nfs/dbraw/zinc/26/99/15/171269915.db2.gz	XTBIBSPEHQXEQQ-QFSBIZTOSA-N	0	0	299.776	5.306	40	10		CKCBRN
Cc1ccc(C)c2c1N[C@H](c1ccc(F)cc1)[C@H]1CC=C[C@@H]21	ZINC000020754203	171271779	/nfs/dbraw/zinc/27/17/79/171271779.db2.gz	NHZLDWKRYOQEFL-FUHIMQAGSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1ccc(C)c2c1N[C@H](c1ccc(F)cc1)[C@H]1CC=C[C@H]21	ZINC000020754206	567947107	/nfs/dbraw/zinc/94/71/07/567947107.db2.gz	NHZLDWKRYOQEFL-ABSDTBQOSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1ccc(C)c2c1N[C@H](c1ccc(F)cc1)[C@@H]1CC=C[C@@H]21	ZINC000020754209	171271852	/nfs/dbraw/zinc/27/18/52/171271852.db2.gz	NHZLDWKRYOQEFL-MBOZVWFJSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1ccc(C)c2c1N[C@H](c1ccc(F)cc1)[C@@H]1CC=C[C@H]21	ZINC000020754212	567943858	/nfs/dbraw/zinc/94/38/58/567943858.db2.gz	NHZLDWKRYOQEFL-SQGPQFPESA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1ccc2c(c1C)N[C@H](c1ccc(F)cc1)[C@H]1CC=C[C@@H]21	ZINC000020754354	171271829	/nfs/dbraw/zinc/27/18/29/171271829.db2.gz	MLDPKAWULSAJQA-FUHIMQAGSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1ccc2c(c1C)N[C@H](c1ccc(F)cc1)[C@@H]1CC=C[C@@H]21	ZINC000020754357	171271842	/nfs/dbraw/zinc/27/18/42/171271842.db2.gz	MLDPKAWULSAJQA-MBOZVWFJSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1ccc(C)c2c1N[C@H](c1ccccc1)[C@H]1CC=C[C@@H]21	ZINC000020757568	171271680	/nfs/dbraw/zinc/27/16/80/171271680.db2.gz	SWSQGMOBPLHQGY-FUHIMQAGSA-N	0	0	275.395	5.130	40	10		CKCBRN
Cc1ccc(C)c2c1N[C@H](c1ccccc1)[C@H]1CC=C[C@H]21	ZINC000020757572	567081916	/nfs/dbraw/zinc/08/19/16/567081916.db2.gz	SWSQGMOBPLHQGY-ABSDTBQOSA-N	0	0	275.395	5.130	40	10		CKCBRN
Cc1ccc(C)c2c1N[C@H](c1ccccc1)[C@@H]1CC=C[C@@H]21	ZINC000020757577	171271527	/nfs/dbraw/zinc/27/15/27/171271527.db2.gz	SWSQGMOBPLHQGY-MBOZVWFJSA-N	0	0	275.395	5.130	40	10		CKCBRN
Cc1ccc(C)c2c1N[C@H](c1ccccc1)[C@@H]1CC=C[C@H]21	ZINC000020757582	567082356	/nfs/dbraw/zinc/08/23/56/567082356.db2.gz	SWSQGMOBPLHQGY-SQGPQFPESA-N	0	0	275.395	5.130	40	10		CKCBRN
Cc1c(Cl)ccc2c1N[C@H](c1ccccc1)[C@H]1CC=C[C@@H]21	ZINC000020757608	171271640	/nfs/dbraw/zinc/27/16/40/171271640.db2.gz	NSGTXULNJIRAFW-ZRGWGRIASA-N	0	0	295.813	5.475	40	10		CKCBRN
Cc1c(Cl)ccc2c1N[C@H](c1ccccc1)[C@@H]1CC=C[C@@H]21	ZINC000020757613	171271653	/nfs/dbraw/zinc/27/16/53/171271653.db2.gz	NSGTXULNJIRAFW-SPYBWZPUSA-N	0	0	295.813	5.475	40	10		CKCBRN
Cc1ccc2c(c1C)N[C@H](c1ccccc1)[C@H]1CC=C[C@@H]21	ZINC000020757743	171271832	/nfs/dbraw/zinc/27/18/32/171271832.db2.gz	QBUVBHCWTNGRPC-FUHIMQAGSA-N	0	0	275.395	5.130	40	10		CKCBRN
Cc1ccc2c(c1C)N[C@H](c1ccccc1)[C@@H]1CC=C[C@@H]21	ZINC000020757747	171271594	/nfs/dbraw/zinc/27/15/94/171271594.db2.gz	QBUVBHCWTNGRPC-MBOZVWFJSA-N	0	0	275.395	5.130	40	10		CKCBRN
Cc1ccc(Cl)c2c1N[C@H](c1ccccc1)[C@H]1CC=C[C@@H]21	ZINC000020757938	171272015	/nfs/dbraw/zinc/27/20/15/171272015.db2.gz	MQNNJDXLAUOKQZ-ZRGWGRIASA-N	0	0	295.813	5.475	40	10		CKCBRN
Cc1ccc(Cl)c2c1N[C@H](c1ccccc1)[C@@H]1CC=C[C@@H]21	ZINC000020757941	171272042	/nfs/dbraw/zinc/27/20/42/171272042.db2.gz	MQNNJDXLAUOKQZ-SPYBWZPUSA-N	0	0	295.813	5.475	40	10		CKCBRN
CC(C)c1cccc2c1N[C@H](c1ccccc1)[C@H]1CC=C[C@@H]21	ZINC000020758142	171271930	/nfs/dbraw/zinc/27/19/30/171271930.db2.gz	FWRPIAFDNHGBKT-WSTZPKSXSA-N	0	0	289.422	5.637	40	10		CKCBRN
CC(C)c1cccc2c1N[C@H](c1ccccc1)[C@@H]1CC=C[C@@H]21	ZINC000020758145	171271949	/nfs/dbraw/zinc/27/19/49/171271949.db2.gz	FWRPIAFDNHGBKT-QWFCFKBJSA-N	0	0	289.422	5.637	40	10		CKCBRN
Cc1ccc(-c2cccc(Cl)c2)n1-c1ccccc1	ZINC000035273037	172093337	/nfs/dbraw/zinc/09/33/37/172093337.db2.gz	IYWUZAUEJUMXGU-UHFFFAOYSA-N	0	0	267.759	5.106	40	10		CKCBRN
Fc1cccc(Cl)c1[C@@H]1Nc2ccccc2[C@@H]2C=CC[C@@H]21	ZINC000058850551	567956256	/nfs/dbraw/zinc/95/62/56/567956256.db2.gz	BNVCIESZPIDWEG-RRUGBERISA-N	0	0	299.776	5.306	40	10		CKCBRN
CSc1ccc([C@@H]2Nc3ccccc3[C@@H]3C=CC[C@@H]32)cc1	ZINC000058850561	256796745	/nfs/dbraw/zinc/79/67/45/256796745.db2.gz	PCQPHVUEIGXODF-IEZWGBDMSA-N	0	0	293.435	5.235	40	10		CKCBRN
C1=C[C@H]2c3ccc4ccccc4c3N[C@@H](c3ccccn3)[C@H]2C1	ZINC000058850998	256796767	/nfs/dbraw/zinc/79/67/67/256796767.db2.gz	ORDNSCDXRSSVKF-LLGFUMIMSA-N	0	0	298.389	5.061	40	10		CKCBRN
C1=C[C@H]2c3ccc4ccccc4c3N[C@@H](c3cccnc3)[C@H]2C1	ZINC000058851003	567956227	/nfs/dbraw/zinc/95/62/27/567956227.db2.gz	KUNXDIRCJCHTJT-HBFSDRIKSA-N	0	0	298.389	5.061	40	10		CKCBRN
C1=C[C@H]2c3ccc4ccccc4c3N[C@@H](c3ccncc3)[C@H]2C1	ZINC000058851007	567956141	/nfs/dbraw/zinc/95/61/41/567956141.db2.gz	MHJXYKGBKSIBJM-HBFSDRIKSA-N	0	0	298.389	5.061	40	10		CKCBRN
CC(C)c1ccc([C@@H]2Nc3ccccc3[C@@H]3C=CC[C@@H]32)cc1	ZINC000058928466	567956384	/nfs/dbraw/zinc/95/63/84/567956384.db2.gz	BULDFLACLVIWBT-CUWPLCDZSA-N	0	0	289.422	5.637	40	10		CKCBRN
Cc1cc(C)c2c(c1)N[C@@H](c1ccccc1)[C@H]1CC=C[C@@H]21	ZINC000058928546	567956107	/nfs/dbraw/zinc/95/61/07/567956107.db2.gz	GYMMFRSDYROWLI-UWVAXJGDSA-N	0	0	275.395	5.130	40	10		CKCBRN
c1ccc2c(c1)cccc2/N=N/c1cccc2ccccc21	ZINC000090755055	180036259	/nfs/dbraw/zinc/03/62/59/180036259.db2.gz	ICIDZHMCYAIUIJ-QURGRASLSA-N	0	0	282.346	6.408	40	10		CKCBRN
Cc1cccc(/N=N\c2cc(C)nc(-c3ccccc3)n2)c1	ZINC000095276450	570317966	/nfs/dbraw/zinc/31/79/66/570317966.db2.gz	XZIZWGBYMHABIB-DQRAZIAOSA-N	0	0	288.354	5.176	40	10		CKCBRN
c1ccc(/N=N\c2ccccc2/N=N\c2ccccc2)cc1	ZINC000095470209	567909468	/nfs/dbraw/zinc/90/94/68/567909468.db2.gz	HGRDUZITLBEBJY-WRBBJXAJSA-N	0	0	286.338	6.517	40	10		CKCBRN
c1ccc(/N=N/c2ccccc2/N=N\c2ccccc2)cc1	ZINC000095470210	567909492	/nfs/dbraw/zinc/90/94/92/567909492.db2.gz	HGRDUZITLBEBJY-OLAQIDGISA-N	0	0	286.338	6.517	40	10		CKCBRN
c1ccc(/N=N/c2ccccc2NNc2ccccc2)cc1	ZINC000095470211	567909289	/nfs/dbraw/zinc/90/92/89/567909289.db2.gz	QMBCLWMHMHVQJG-LSDHQDQOSA-N	0	0	288.354	5.541	40	10		CKCBRN
Fc1ccc(-n2c(-c3ccccc3)cc3c2CCCC3)cc1	ZINC000095951751	185040014	/nfs/dbraw/zinc/04/00/14/185040014.db2.gz	DBHRGANISADCCD-UHFFFAOYSA-N	0	0	291.369	5.162	40	10		CKCBRN
Cc1ccccc1NN=C1C(=O)C=Cc2ccccc21	ZINC000100028391	185702204	/nfs/dbraw/zinc/70/22/04/185702204.db2.gz	BQFCCCIRTOLPEF-VHEBQXMUSA-N	0	0	262.312	5.269	40	10	in-vitro	CKCBRN
O=C1C=CC(Cl)=CC1=NNc1c(O)ccc2ccccc21	ZINC000100049462	570257583	/nfs/dbraw/zinc/25/75/83/570257583.db2.gz	HQKOBNMULFASAN-VHEBQXMUSA-N	0	0	298.729	5.320	40	10		CKCBRN
Cc1nc(N=Nc2ccccc2)[nH]c1N=Nc1ccccc1	ZINC000100365660	567913004	/nfs/dbraw/zinc/91/30/04/567913004.db2.gz	JLRWIRBFDUKCMN-OLAQIDGISA-N	0	0	290.330	5.549	40	10		CKCBRN
Cc1nc(N=Nc2ccccc2)[nH]c1N=Nc1ccccc1	ZINC000100365662	567912996	/nfs/dbraw/zinc/91/29/96/567912996.db2.gz	JLRWIRBFDUKCMN-FHGBILNFSA-N	0	0	290.330	5.549	40	10		CKCBRN
O=C1C=Cc2ccccc2C1=NNc1ccc(F)cc1	ZINC000100365758	185713431	/nfs/dbraw/zinc/71/34/31/185713431.db2.gz	IVVQQRFRRJBPRA-HNENSFHCSA-N	0	0	266.275	5.100	40	10		CKCBRN
O=C1C=CC(Cl)=CC1=NNc1c(O)ccc2ccccc21	ZINC000100455488	570258899	/nfs/dbraw/zinc/25/88/99/570258899.db2.gz	HQKOBNMULFASAN-HNENSFHCSA-N	0	0	298.729	5.320	40	10		CKCBRN
O=C1c2ccccc2C=CC1=NNc1ccc(F)cc1	ZINC000100717100	185723391	/nfs/dbraw/zinc/72/33/91/185723391.db2.gz	MASXPDHDCTUJJH-VHEBQXMUSA-N	0	0	266.275	5.100	40	10		CKCBRN
Cc1cccc(C)c1NN=C1C(C)=CC(=O)C=C1C	ZINC000100717103	567913694	/nfs/dbraw/zinc/91/36/94/567913694.db2.gz	SWHNYDMLYMUMPA-ISLYRVAYSA-N	0	0	254.333	5.041	40	10		CKCBRN
O=C1C=Cc2ccccc2C1=NNc1cccc2ccccc21	ZINC000102958348	570260146	/nfs/dbraw/zinc/26/01/46/570260146.db2.gz	CYZWPZHRSZNWLS-DQRAZIAOSA-N	0	0	298.345	6.114	40	10		CKCBRN
S=C1SC(c2ccccc2)=CC1=CNc1ccccc1	ZINC000103467302	567915667	/nfs/dbraw/zinc/91/56/67/567915667.db2.gz	ADTKZHDMVKAPGW-OWBHPGMISA-N	0	0	295.432	5.098	40	10		CKCBRN
Fc1cccc2c1N[C@@H](c1ccc(Cl)cc1)[C@H]1CC=C[C@@H]21	ZINC000103554407	567943760	/nfs/dbraw/zinc/94/37/60/567943760.db2.gz	OIYHGTMRFWZLSX-KEYYUXOJSA-N	0	0	299.776	5.306	40	10		CKCBRN
CN(C)c1ccc(/N=N\c2cccc3ccccc32)cc1	ZINC000104040464	567915792	/nfs/dbraw/zinc/91/57/92/567915792.db2.gz	RKGIHRYVFSZPKN-VXPUYCOJSA-N	0	0	275.355	5.321	40	10		CKCBRN
Cc1ccc(NN=C2C(=O)C=Cc3ccccc32)cc1	ZINC000104081686	567915929	/nfs/dbraw/zinc/91/59/29/567915929.db2.gz	JCZUIEHTNMQCRK-HNENSFHCSA-N	0	0	262.312	5.269	40	10		CKCBRN
CCN(/N=N/c1ccc(C)cc1)/N=N\c1ccc(C)cc1	ZINC000104141008	185908597	/nfs/dbraw/zinc/90/85/97/185908597.db2.gz	VQAVMXFAKOWZPK-YAFCTCPESA-N	0	0	281.363	5.323	40	10		CKCBRN
CN(C)c1ccc(/N=N\c2cccc(Cl)c2Cl)cc1	ZINC000104149060	567916100	/nfs/dbraw/zinc/91/61/00/567916100.db2.gz	ZLKSFACZQYTCIF-ZCXUNETKSA-N	0	0	294.185	5.475	40	10		CKCBRN
Cc1ccc(/N=N\c2ccc(N(C)C)cc2)c2cccnc12	ZINC000104149183	567916095	/nfs/dbraw/zinc/91/60/95/567916095.db2.gz	CGOSBNDARVLJIZ-MRCUWXFGSA-N	0	0	290.370	5.025	40	10		CKCBRN
CCCC(=O)Nc1cc(C)ccc1/N=N\c1ccc(C)cc1	ZINC000104166417	567916288	/nfs/dbraw/zinc/91/62/88/567916288.db2.gz	LRRGWTBYUQFSFV-MRCUWXFGSA-N	0	0	295.386	5.457	40	10		CKCBRN
Cc1ccc(/N=N\c2ccc(C)cc2NC(=O)C2CC2)cc1	ZINC000104171144	567916152	/nfs/dbraw/zinc/91/61/52/567916152.db2.gz	DSWDPYAVLIHLGK-MRCUWXFGSA-N	0	0	293.370	5.067	40	10		CKCBRN
Cc1ccccc1/N=N\c1c(N)ccc2ccccc21	ZINC000104179499	534794149	/nfs/dbraw/zinc/79/41/49/534794149.db2.gz	BWLVSYUUKOQICP-VXPUYCOJSA-N	0	0	261.328	5.146	40	10		CKCBRN
Cc1ccc(/N=N\c2c(N)ccc3ccccc32)cc1	ZINC000104186079	567916230	/nfs/dbraw/zinc/91/62/30/567916230.db2.gz	BQGNKVPRHVXLFL-VXPUYCOJSA-N	0	0	261.328	5.146	40	10		CKCBRN
Cc1noc(-c2ccccc2)c1/N=N\c1ccccc1	ZINC000104188678	567916412	/nfs/dbraw/zinc/91/64/12/567916412.db2.gz	LSTKIGHUFIJZML-ZCXUNETKSA-N	0	0	263.300	5.065	40	10		CKCBRN
c1c2ccccc2[nH]c1/N=N\c1cccc2ccccc21	ZINC000104208621	567916294	/nfs/dbraw/zinc/91/62/94/567916294.db2.gz	ZZYLGLMHJRWQFL-MRCUWXFGSA-N	0	0	271.323	5.737	40	10		CKCBRN
CCCCN(CCCC)/N=N\N(CCCC)CCCC	ZINC000104219526	185934671	/nfs/dbraw/zinc/93/46/71/185934671.db2.gz	ILPYEQCVYIUDHI-ZCXUNETKSA-N	0	0	284.492	5.073	40	10		CKCBRN
CN(C)c1ccc(NN=C2C(=O)C=Cc3ccccc32)cc1	ZINC000104223884	567916348	/nfs/dbraw/zinc/91/63/48/567916348.db2.gz	KSGXGIDRHWKRFO-VXPUYCOJSA-N	0	0	291.354	5.027	40	10		CKCBRN
O=C1C=CC(=NNc2cc(Cl)ccc2Cl)C=C1	ZINC000104251994	567916505	/nfs/dbraw/zinc/91/65/05/567916505.db2.gz	AKIOYUFHFCDHTO-NXVVXOECSA-N	0	0	267.115	5.114	40	10		CKCBRN
ClC(Cl)=C/N=N\c1ccc(Cl)cc1Cl	ZINC000104257855	567916506	/nfs/dbraw/zinc/91/65/06/567916506.db2.gz	PODGOMIYICKHFP-YPKPFQOOSA-N	0	0	269.946	5.354	40	10		CKCBRN
CC1=C(C)C(=NNc2ccccc2)C(C)=C(C)C1=O	ZINC000104260139	185947089	/nfs/dbraw/zinc/94/70/89/185947089.db2.gz	GFBMQRZQDSJVCU-ZCXUNETKSA-N	0	0	254.333	5.041	40	10		CKCBRN
CC(C)(C)c1ccc(NN=C2C=CC(=O)C=C2)cc1	ZINC000104260767	567916565	/nfs/dbraw/zinc/91/65/65/567916565.db2.gz	QNPDODTZFASIHE-ZCXUNETKSA-N	0	0	254.333	5.105	40	10		CKCBRN
c1ccc2cc(/N=N\c3cccc4ccccc43)ccc2c1	ZINC000104343860	567916825	/nfs/dbraw/zinc/91/68/25/567916825.db2.gz	INTYTLPOFHZKQE-DQRAZIAOSA-N	0	0	282.346	6.408	40	10		CKCBRN
O=C1c2ccccc2-c2ccccc2C1=NNc1ccccc1	ZINC000104356490	185982012	/nfs/dbraw/zinc/98/20/12/185982012.db2.gz	WAVHCKVIMLPQQP-DQRAZIAOSA-N	0	0	298.345	6.114	40	10		CKCBRN
O=C1C=C2c3ccccc3CC2=CC1=NNc1ccccc1	ZINC000104389634	567916849	/nfs/dbraw/zinc/91/68/49/567916849.db2.gz	FUEKEVTXXAJVPQ-MRCUWXFGSA-N	0	0	286.334	5.379	40	10		CKCBRN
O=C1C=C2c3ccccc3CC2=CC1=NNc1ccccc1	ZINC000104389639	567916762	/nfs/dbraw/zinc/91/67/62/567916762.db2.gz	FUEKEVTXXAJVPQ-QZQOTICOSA-N	0	0	286.334	5.379	40	10		CKCBRN
O=C1C=Cc2ccccc2C1=NNc1ccc(Cl)cc1	ZINC000104392890	185989802	/nfs/dbraw/zinc/98/98/02/185989802.db2.gz	YDEBPHALQZHQLZ-HNENSFHCSA-N	0	0	282.730	5.614	40	10		CKCBRN
Cc1ccc(-c2ccc(F)c(Cl)c2)n1-c1ccccc1	ZINC000199743760	567048733	/nfs/dbraw/zinc/04/87/33/567048733.db2.gz	ZCHMQKXNNIHVGG-UHFFFAOYSA-N	0	0	285.749	5.245	40	10		CKCBRN
COc1cccc(-n2c(C)ccc2-c2cccc(Cl)c2)c1	ZINC000199743899	567048664	/nfs/dbraw/zinc/04/86/64/567048664.db2.gz	XTTSSSQDLMDUSD-UHFFFAOYSA-N	0	0	297.785	5.115	40	10		CKCBRN
Cc1ccc(-c2cccc(F)c2)n1-c1ccc(C(C)C)cc1	ZINC000199744367	567048650	/nfs/dbraw/zinc/04/86/50/567048650.db2.gz	APJPTLOKNXFETB-UHFFFAOYSA-N	0	0	293.385	5.715	40	10		CKCBRN
COc1cccc(-n2c(C)ccc2-c2ccc(Cl)cc2)c1	ZINC000199744939	189683855	/nfs/dbraw/zinc/68/38/55/189683855.db2.gz	LFPYQZYUVMWKCK-UHFFFAOYSA-N	0	0	297.785	5.115	40	10		CKCBRN
CCc1ccc(-c2ccc(C)n2-c2cccc(OC)c2)cc1	ZINC000199745074	189683893	/nfs/dbraw/zinc/68/38/93/189683893.db2.gz	BEYRORVGAGWYGE-UHFFFAOYSA-N	0	0	291.394	5.024	40	10		CKCBRN
CCc1ccc(-c2ccc(C)n2-c2ccccc2)cc1	ZINC000199745120	567048562	/nfs/dbraw/zinc/04/85/62/567048562.db2.gz	JPQYLXVSULPUMK-UHFFFAOYSA-N	0	0	261.368	5.015	40	10		CKCBRN
Cc1ccc(-c2ccc(F)cc2)n1-c1ccc(C(C)C)cc1	ZINC000199745211	567049257	/nfs/dbraw/zinc/04/92/57/567049257.db2.gz	PEFGXYOPIWHJIA-UHFFFAOYSA-N	0	0	293.385	5.715	40	10		CKCBRN
Cc1ccc(-c2ccc(C(C)C)cc2)n1-c1ccccc1	ZINC000199745269	567049132	/nfs/dbraw/zinc/04/91/32/567049132.db2.gz	QIFMSDUVPSKURM-UHFFFAOYSA-N	0	0	275.395	5.576	40	10		CKCBRN
Cc1ccc(-c2cccc(C)n2)n1-c1ccc(C(C)C)cc1	ZINC000199746255	189683771	/nfs/dbraw/zinc/68/37/71/189683771.db2.gz	NWBMQXAHWYHQMH-UHFFFAOYSA-N	0	0	290.410	5.280	40	10		CKCBRN
Cc1ccc(-c2ccoc2)n1-c1ccc(C(C)C)cc1	ZINC000199760466	189683927	/nfs/dbraw/zinc/68/39/27/189683927.db2.gz	PYMSBYBNDNVNST-UHFFFAOYSA-N	0	0	265.356	5.169	40	10		CKCBRN
CCCOc1ccc(-c2ccc(C)n2-c2ccccc2)cc1	ZINC000199761124	189683827	/nfs/dbraw/zinc/68/38/27/189683827.db2.gz	BNIACRVWDWTHPP-UHFFFAOYSA-N	0	0	291.394	5.242	40	10		CKCBRN
CSc1ccc(-c2ccc(C)n2-c2ccccc2)cc1	ZINC000199761303	189684066	/nfs/dbraw/zinc/68/40/66/189684066.db2.gz	XCNSIRXXMNOTEO-UHFFFAOYSA-N	0	0	279.408	5.175	40	10		CKCBRN
Fc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cccc(Cl)c1)N2	ZINC000205875626	570381175	/nfs/dbraw/zinc/38/11/75/570381175.db2.gz	CLBTZGVPSWBYAI-VKJFTORMSA-N	0	0	299.776	5.306	40	10		CKCBRN
CCNc1ccc(Oc2cccc3ccccc32)cc1	ZINC000216780809	570346295	/nfs/dbraw/zinc/34/62/95/570346295.db2.gz	YQZYTJJKXWRHAI-UHFFFAOYSA-N	0	0	263.340	5.064	40	10		CKCBRN
Cc1ccc(-c2ccccc2Cl)n1-c1ccccc1	ZINC000222739692	567046736	/nfs/dbraw/zinc/04/67/36/567046736.db2.gz	BPROCOQFJWNIOX-UHFFFAOYSA-N	0	0	267.759	5.106	40	10		CKCBRN
Cc1ccc([C@@H]2Nc3c(Cl)cccc3[C@@H]3C=CC[C@@H]32)cc1	ZINC000226666609	256785401	/nfs/dbraw/zinc/78/54/01/256785401.db2.gz	LGJLMDROSPXVOC-VKJFTORMSA-N	0	0	295.813	5.475	40	10		CKCBRN
Cc1ccc([C@@H]2Nc3ccc(Cl)cc3[C@@H]3C=CC[C@@H]32)cc1	ZINC000226670737	256785221	/nfs/dbraw/zinc/78/52/21/256785221.db2.gz	NFDOHYKSKICDFC-GJYPPUQNSA-N	0	0	295.813	5.475	40	10		CKCBRN
Cc1ccc([C@@H]2Nc3ccc(C)cc3[C@@H]3C=CC[C@@H]32)cc1	ZINC000226683471	256785314	/nfs/dbraw/zinc/78/53/14/256785314.db2.gz	WKSCKFFSVXXGCK-UWVAXJGDSA-N	0	0	275.395	5.130	40	10		CKCBRN
Fc1cccc2c1N[C@@H](c1cccc(Cl)c1)[C@H]1CC=C[C@@H]21	ZINC000226721989	256785218	/nfs/dbraw/zinc/78/52/18/256785218.db2.gz	UVZWALWZTOXFRZ-KEYYUXOJSA-N	0	0	299.776	5.306	40	10		CKCBRN
Cc1cc(C)c2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(F)cc1)N2	ZINC000226903165	570374127	/nfs/dbraw/zinc/37/41/27/570374127.db2.gz	GHECMUFXGUDBEG-FUHIMQAGSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1cc(C)c2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccc(F)cc1)N2	ZINC000226903175	570374092	/nfs/dbraw/zinc/37/40/92/570374092.db2.gz	GHECMUFXGUDBEG-MBOZVWFJSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1cc(C)c2c(c1)N[C@@H](c1ccc(F)cc1)[C@H]1CC=C[C@@H]21	ZINC000226908906	570374115	/nfs/dbraw/zinc/37/41/15/570374115.db2.gz	XUJVSJNZLOPNPT-UWVAXJGDSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1ccc(-c2ccccc2F)n1-c1ccc(C(C)C)cc1	ZINC000228928884	570372921	/nfs/dbraw/zinc/37/29/21/570372921.db2.gz	FBRGIPHXOIHPSO-UHFFFAOYSA-N	0	0	293.385	5.715	40	10		CKCBRN
Cc1ccc(-c2cccc(C)c2)n1-c1ccc(C(C)C)cc1	ZINC000228929187	570372945	/nfs/dbraw/zinc/37/29/45/570372945.db2.gz	UBOOSCCCXRNRHK-UHFFFAOYSA-N	0	0	289.422	5.885	40	10		CKCBRN
COc1cccc(-n2c(C)ccc2-c2ccccc2Cl)c1	ZINC000228930634	570372951	/nfs/dbraw/zinc/37/29/51/570372951.db2.gz	MTQWORHJNFQXQM-UHFFFAOYSA-N	0	0	297.785	5.115	40	10		CKCBRN
FC(F)(F)C(=S)c1c2ccccc2cc2ccccc21	ZINC000228954813	570373354	/nfs/dbraw/zinc/37/33/54/570373354.db2.gz	ZSXYLVILJDDQLC-UHFFFAOYSA-N	0	0	290.309	5.273	40	10		CKCBRN
Cc1cccc(N=Nc2cc(C)nc(-c3ccccc3)n2)c1	ZINC000245232575	567099059	/nfs/dbraw/zinc/09/90/59/567099059.db2.gz	XZIZWGBYMHABIB-UHFFFAOYSA-N	0	0	288.354	5.176	40	10		CKCBRN
c1ccc(N=Nc2ccc(Nc3ccccc3)cc2)cc1	ZINC000254744471	189995588	/nfs/dbraw/zinc/99/55/88/189995588.db2.gz	VXLFYNFOITWQPM-UHFFFAOYSA-N	0	0	273.339	5.846	40	10		CKCBRN
O=C1C=CC(Cl)=CC1=NNc1c(O)ccc2ccccc21	ZINC000254853678	189996113	/nfs/dbraw/zinc/99/61/13/189996113.db2.gz	HQKOBNMULFASAN-UHFFFAOYSA-N	0	0	298.729	5.320	40	10		CKCBRN
Cc1cccc(Nc2ccc(N=Nc3ccccc3)cc2)c1	ZINC000256081143	190005821	/nfs/dbraw/zinc/00/58/21/190005821.db2.gz	ZVGJKUHDXJNCHH-UHFFFAOYSA-N	0	0	287.366	6.154	40	10		CKCBRN
Cc1ccccc1N=Nc1c(N)ccc2ccccc21	ZINC000256172346	190006189	/nfs/dbraw/zinc/00/61/89/190006189.db2.gz	BWLVSYUUKOQICP-UHFFFAOYSA-N	0	0	261.328	5.146	40	10		CKCBRN
O=C1C=CC(=NNc2cccc3ccccc32)c2ccccc21	ZINC000299888542	526351936	/nfs/dbraw/zinc/35/19/36/526351936.db2.gz	NSWKKBKROCMOHA-UHFFFAOYSA-N	0	0	298.345	6.114	40	10		CKCBRN
C1=C[C@H]2c3ccc4ccccc4c3N[C@@H](c3ccccc3)[C@H]2C1	ZINC000408736235	567882593	/nfs/dbraw/zinc/88/25/93/567882593.db2.gz	MZTDFHFITJWFJI-DYXWJJEUSA-N	0	0	297.401	5.666	40	10		CKCBRN
C1=C[C@H]2c3ccccc3N[C@@H](c3cccc4ccccc43)[C@H]2C1	ZINC000408736881	526419268	/nfs/dbraw/zinc/41/92/68/526419268.db2.gz	BLZLXIINCSYVNV-XJABCFGWSA-N	0	0	297.401	5.666	40	10		CKCBRN
Cc1cccc2c1N[C@@H](c1ccc(Cl)cc1)[C@H]1CC=C[C@@H]21	ZINC000408737104	567882577	/nfs/dbraw/zinc/88/25/77/567882577.db2.gz	IYOHWNMYJFTTTL-IEZWGBDMSA-N	0	0	295.813	5.475	40	10		CKCBRN
CCc1cccc2c1N[C@H](c1ccccc1F)[C@@H]1CC=C[C@@H]21	ZINC000409151614	529554726	/nfs/dbraw/zinc/55/47/26/529554726.db2.gz	HMNUNZMMDKRMMW-NBQZKYEYSA-N	0	0	293.385	5.215	40	10		CKCBRN
CCc1cccc2c1N[C@H](c1ccccc1F)[C@H]1CC=C[C@@H]21	ZINC000409151619	567934324	/nfs/dbraw/zinc/93/43/24/567934324.db2.gz	HMNUNZMMDKRMMW-UVFQYZLESA-N	0	0	293.385	5.215	40	10		CKCBRN
Cc1ccc(C)c2c1N[C@H](c1cccc(F)c1)[C@H]1CC=C[C@H]21	ZINC000409151781	567934332	/nfs/dbraw/zinc/93/43/32/567934332.db2.gz	CAPBQGWCFZQHBU-ABSDTBQOSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1ccc(C)c2c1N[C@H](c1cccc(F)c1)[C@H]1CC=C[C@@H]21	ZINC000409151784	570248844	/nfs/dbraw/zinc/24/88/44/570248844.db2.gz	CAPBQGWCFZQHBU-FUHIMQAGSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1ccc(C)c2c1N[C@H](c1cccc(F)c1)[C@@H]1CC=C[C@@H]21	ZINC000409151787	570248964	/nfs/dbraw/zinc/24/89/64/570248964.db2.gz	CAPBQGWCFZQHBU-MBOZVWFJSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1ccc(C)c2c1N[C@H](c1cccc(F)c1)[C@@H]1CC=C[C@H]21	ZINC000409151791	567934400	/nfs/dbraw/zinc/93/44/00/567934400.db2.gz	CAPBQGWCFZQHBU-SQGPQFPESA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1cc(C)c2c(c1)N[C@H](c1ccccc1F)[C@H]1CC=C[C@@H]21	ZINC000409153175	570249293	/nfs/dbraw/zinc/24/92/93/570249293.db2.gz	CWRHHVYKQAVYHZ-SIFCLUCFSA-N	0	0	293.385	5.269	40	10		CKCBRN
CCc1cccc2c1N[C@H](c1ccccc1)[C@@H]1CC=C[C@@H]21	ZINC000409153213	570249061	/nfs/dbraw/zinc/24/90/61/570249061.db2.gz	LWTXSNDMVFPJHX-ILZDJORESA-N	0	0	275.395	5.076	40	10		CKCBRN
CCc1cccc2c1N[C@H](c1ccccc1)[C@H]1CC=C[C@@H]21	ZINC000409153214	570249015	/nfs/dbraw/zinc/24/90/15/570249015.db2.gz	LWTXSNDMVFPJHX-XKGZKEIXSA-N	0	0	275.395	5.076	40	10		CKCBRN
Cc1cc(C)c2c(c1)N[C@H](c1ccccc1F)[C@@H]1CC=C[C@@H]21	ZINC000409153409	570249314	/nfs/dbraw/zinc/24/93/14/570249314.db2.gz	CWRHHVYKQAVYHZ-SXGZJXTBSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1ccc2c(c1C)N[C@H](c1cccc(F)c1)[C@H]1CC=C[C@@H]21	ZINC000409154055	534459117	/nfs/dbraw/zinc/45/91/17/534459117.db2.gz	JRCDQNOMXFJEEN-FUHIMQAGSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1ccc2c(c1C)N[C@H](c1cccc(F)c1)[C@@H]1CC=C[C@@H]21	ZINC000409154058	567901825	/nfs/dbraw/zinc/90/18/25/567901825.db2.gz	JRCDQNOMXFJEEN-MBOZVWFJSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1ccc(C)c2c1N[C@H](c1ccccc1F)[C@H]1CC=C[C@H]21	ZINC000409155212	567934298	/nfs/dbraw/zinc/93/42/98/567934298.db2.gz	COEJRUDAQJKXES-AVYPCKFXSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1ccc(C)c2c1N[C@H](c1ccccc1F)[C@@H]1CC=C[C@H]21	ZINC000409155215	567901789	/nfs/dbraw/zinc/90/17/89/567901789.db2.gz	COEJRUDAQJKXES-MDOVXXIYSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1ccc(C)c2c1N[C@H](c1ccccc1F)[C@H]1CC=C[C@@H]21	ZINC000409155217	567901653	/nfs/dbraw/zinc/90/16/53/567901653.db2.gz	COEJRUDAQJKXES-SIFCLUCFSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1ccc(C)c2c1N[C@H](c1ccccc1F)[C@@H]1CC=C[C@@H]21	ZINC000409155221	567901869	/nfs/dbraw/zinc/90/18/69/567901869.db2.gz	COEJRUDAQJKXES-SXGZJXTBSA-N	0	0	293.385	5.269	40	10		CKCBRN
Fc1ccccc1[C@@H]1Nc2ccc(Cl)cc2[C@@H]2C=CC[C@@H]21	ZINC000409157772	534534227	/nfs/dbraw/zinc/53/42/27/534534227.db2.gz	RWKRLBCXEIHTQK-FHSNZYRGSA-N	0	0	299.776	5.306	40	10		CKCBRN
Fc1ccccc1[C@@H]1Nc2ccc(Cl)cc2[C@@H]2C=CC[C@H]21	ZINC000409157781	534533768	/nfs/dbraw/zinc/53/37/68/534533768.db2.gz	RWKRLBCXEIHTQK-SNUQEOBHSA-N	0	0	299.776	5.306	40	10		CKCBRN
Fc1ccccc1[C@@H]1Nc2ccc(Cl)cc2[C@H]2C=CC[C@H]21	ZINC000409157785	567901937	/nfs/dbraw/zinc/90/19/37/567901937.db2.gz	RWKRLBCXEIHTQK-VEVIJQCQSA-N	0	0	299.776	5.306	40	10		CKCBRN
Fc1ccccc1[C@@H]1Nc2ccc(Cl)cc2[C@H]2C=CC[C@@H]21	ZINC000409157791	534535179	/nfs/dbraw/zinc/53/51/79/534535179.db2.gz	RWKRLBCXEIHTQK-ZJNRKIDTSA-N	0	0	299.776	5.306	40	10		CKCBRN
CCc1cccc2c1N[C@H](c1cccc(F)c1)[C@@H]1CC=C[C@@H]21	ZINC000409157903	567901821	/nfs/dbraw/zinc/90/18/21/567901821.db2.gz	WDODSZFMLDWUMN-ILZDJORESA-N	0	0	293.385	5.215	40	10		CKCBRN
CCc1cccc2c1N[C@H](c1cccc(F)c1)[C@H]1CC=C[C@@H]21	ZINC000409157906	567901934	/nfs/dbraw/zinc/90/19/34/567901934.db2.gz	WDODSZFMLDWUMN-XKGZKEIXSA-N	0	0	293.385	5.215	40	10		CKCBRN
Cc1cccc2c1N[C@H](c1cccc(Cl)c1)[C@@H]1CC=C[C@@H]21	ZINC000409158316	567934509	/nfs/dbraw/zinc/93/45/09/567934509.db2.gz	XEOKFLFVCUVUPC-KVSKMBFKSA-N	0	0	295.813	5.475	40	10		CKCBRN
Cc1cccc2c1N[C@H](c1cccc(Cl)c1)[C@H]1CC=C[C@@H]21	ZINC000409158323	567934507	/nfs/dbraw/zinc/93/45/07/567934507.db2.gz	XEOKFLFVCUVUPC-VDZJLULYSA-N	0	0	295.813	5.475	40	10		CKCBRN
CCc1ccc([C@@H]2Nc3c(F)cccc3[C@@H]3C=CC[C@@H]32)cc1	ZINC000409158467	567934390	/nfs/dbraw/zinc/93/43/90/567934390.db2.gz	LFYKWLHKPIEKIG-GJYPPUQNSA-N	0	0	293.385	5.215	40	10		CKCBRN
CCc1ccc([C@@H]2Nc3c(F)cccc3[C@@H]3C=CC[C@H]32)cc1	ZINC000409158472	567902525	/nfs/dbraw/zinc/90/25/25/567902525.db2.gz	LFYKWLHKPIEKIG-MDZRGWNJSA-N	0	0	293.385	5.215	40	10		CKCBRN
Cc1cc(Cl)cc2c1N[C@H](c1ccccc1)[C@@H]1CC=C[C@@H]21	ZINC000409159522	533772843	/nfs/dbraw/zinc/77/28/43/533772843.db2.gz	QURTYLWRADFHJY-GPMSIDNRSA-N	0	0	295.813	5.475	40	10		CKCBRN
Cc1cc(Cl)cc2c1N[C@H](c1ccccc1)[C@H]1CC=C[C@@H]21	ZINC000409159525	567934544	/nfs/dbraw/zinc/93/45/44/567934544.db2.gz	QURTYLWRADFHJY-JTDSTZFVSA-N	0	0	295.813	5.475	40	10		CKCBRN
Cc1cc(C)c2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccccc1F)N2	ZINC000409159619	567934379	/nfs/dbraw/zinc/93/43/79/567934379.db2.gz	RLLFAQSIIVGKAU-SIFCLUCFSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1cc(C)c2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccccc1F)N2	ZINC000409159621	567934352	/nfs/dbraw/zinc/93/43/52/567934352.db2.gz	RLLFAQSIIVGKAU-SXGZJXTBSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1ccc2c(c1C)N[C@H](c1ccccc1F)[C@H]1CC=C[C@@H]21	ZINC000409159676	534459070	/nfs/dbraw/zinc/45/90/70/534459070.db2.gz	RTWWMLTXWOBRFY-SIFCLUCFSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1ccc2c(c1C)N[C@H](c1ccccc1F)[C@@H]1CC=C[C@@H]21	ZINC000409159678	567934386	/nfs/dbraw/zinc/93/43/86/567934386.db2.gz	RTWWMLTXWOBRFY-SXGZJXTBSA-N	0	0	293.385	5.269	40	10		CKCBRN
CCc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccccc1F)N2	ZINC000409160600	567903166	/nfs/dbraw/zinc/90/31/66/567903166.db2.gz	UTLQYTRUXRYLAQ-SIFCLUCFSA-N	0	0	293.385	5.215	40	10		CKCBRN
CCc1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccccc1F)N2	ZINC000409160601	567934323	/nfs/dbraw/zinc/93/43/23/567934323.db2.gz	UTLQYTRUXRYLAQ-SXGZJXTBSA-N	0	0	293.385	5.215	40	10		CKCBRN
CCc1ccc([C@@H]2Nc3ccc(F)cc3[C@@H]3C=CC[C@H]32)cc1	ZINC000409161883	529718242	/nfs/dbraw/zinc/71/82/42/529718242.db2.gz	BQTFOQWXNJWOBU-HLIPFELVSA-N	0	0	293.385	5.215	40	10		CKCBRN
CCc1ccc([C@@H]2Nc3ccc(F)cc3[C@@H]3C=CC[C@@H]32)cc1	ZINC000409161885	529718288	/nfs/dbraw/zinc/71/82/88/529718288.db2.gz	BQTFOQWXNJWOBU-UWVAXJGDSA-N	0	0	293.385	5.215	40	10		CKCBRN
CCc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1cccc(F)c1)N2	ZINC000409163402	529731354	/nfs/dbraw/zinc/73/13/54/529731354.db2.gz	QZXUDIHLOCFFAY-FUHIMQAGSA-N	0	0	293.385	5.215	40	10		CKCBRN
CCc1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1cccc(F)c1)N2	ZINC000409163403	567903389	/nfs/dbraw/zinc/90/33/89/567903389.db2.gz	QZXUDIHLOCFFAY-MBOZVWFJSA-N	0	0	293.385	5.215	40	10		CKCBRN
Fc1cccc([C@@H]2Nc3ccc(Cl)cc3[C@H]3C=CC[C@H]32)c1	ZINC000409164203	567934533	/nfs/dbraw/zinc/93/45/33/567934533.db2.gz	DXUHKYNOBHAOSQ-DAYGRLMNSA-N	0	0	299.776	5.306	40	10		CKCBRN
Fc1cccc([C@@H]2Nc3ccc(Cl)cc3[C@H]3C=CC[C@@H]32)c1	ZINC000409164204	230412725	/nfs/dbraw/zinc/41/27/25/230412725.db2.gz	DXUHKYNOBHAOSQ-MPGHIAIKSA-N	0	0	299.776	5.306	40	10		CKCBRN
Fc1cccc([C@@H]2Nc3ccc(Cl)cc3[C@@H]3C=CC[C@H]32)c1	ZINC000409164205	567903387	/nfs/dbraw/zinc/90/33/87/567903387.db2.gz	DXUHKYNOBHAOSQ-RKVPGOIHSA-N	0	0	299.776	5.306	40	10		CKCBRN
Fc1cccc([C@@H]2Nc3ccc(Cl)cc3[C@@H]3C=CC[C@@H]32)c1	ZINC000409164206	230412666	/nfs/dbraw/zinc/41/26/66/230412666.db2.gz	DXUHKYNOBHAOSQ-VKJFTORMSA-N	0	0	299.776	5.306	40	10		CKCBRN
Cc1cc(C)c2c(c1)N[C@H](c1cccc(F)c1)[C@H]1CC=C[C@@H]21	ZINC000409165126	567903279	/nfs/dbraw/zinc/90/32/79/567903279.db2.gz	SXJJUACECWLPPI-FUHIMQAGSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1cc(C)c2c(c1)N[C@H](c1cccc(F)c1)[C@@H]1CC=C[C@@H]21	ZINC000409165127	567934453	/nfs/dbraw/zinc/93/44/53/567934453.db2.gz	SXJJUACECWLPPI-MBOZVWFJSA-N	0	0	293.385	5.269	40	10		CKCBRN
Fc1cccc([C@@H]2Nc3c(Cl)cccc3[C@@H]3C=CC[C@H]32)c1	ZINC000409166954	567934361	/nfs/dbraw/zinc/93/43/61/567934361.db2.gz	GISDWGLEAUMBLJ-CPUCHLNUSA-N	0	0	299.776	5.306	40	10		CKCBRN
Fc1cccc([C@@H]2Nc3c(Cl)cccc3[C@@H]3C=CC[C@@H]32)c1	ZINC000409166956	567934377	/nfs/dbraw/zinc/93/43/77/567934377.db2.gz	GISDWGLEAUMBLJ-KEYYUXOJSA-N	0	0	299.776	5.306	40	10		CKCBRN
Fc1cccc([C@@H]2Nc3c(Cl)cccc3[C@H]3C=CC[C@H]32)c1	ZINC000409166959	567903656	/nfs/dbraw/zinc/90/36/56/567903656.db2.gz	GISDWGLEAUMBLJ-VBQJREDUSA-N	0	0	299.776	5.306	40	10		CKCBRN
Fc1cccc([C@@H]2Nc3c(Cl)cccc3[C@H]3C=CC[C@@H]32)c1	ZINC000409166962	567903741	/nfs/dbraw/zinc/90/37/41/567903741.db2.gz	GISDWGLEAUMBLJ-ZQIUZPCESA-N	0	0	299.776	5.306	40	10		CKCBRN
CCc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(F)cc1)N2	ZINC000409169030	529731217	/nfs/dbraw/zinc/73/12/17/529731217.db2.gz	PBYKCQXSXMLSKZ-FUHIMQAGSA-N	0	0	293.385	5.215	40	10		CKCBRN
CCc1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccc(F)cc1)N2	ZINC000409169031	567903868	/nfs/dbraw/zinc/90/38/68/567903868.db2.gz	PBYKCQXSXMLSKZ-MBOZVWFJSA-N	0	0	293.385	5.215	40	10		CKCBRN
Cc1cccc2c1N[C@H](c1ccccc1Cl)[C@@H]1CC=C[C@@H]21	ZINC000409169108	567934503	/nfs/dbraw/zinc/93/45/03/567934503.db2.gz	PUZIBDYIROBOQZ-OHNRDTAOSA-N	0	0	295.813	5.475	40	10		CKCBRN
Cc1cccc2c1N[C@H](c1ccccc1Cl)[C@H]1CC=C[C@@H]21	ZINC000409169110	230412719	/nfs/dbraw/zinc/41/27/19/230412719.db2.gz	PUZIBDYIROBOQZ-RFUYNDQBSA-N	0	0	295.813	5.475	40	10		CKCBRN
Fc1ccccc1[C@@H]1Nc2c(Cl)cccc2[C@@H]2C=CC[C@@H]21	ZINC000409169536	567903762	/nfs/dbraw/zinc/90/37/62/567903762.db2.gz	QPAOQTHYMBRXEP-BWACUDIHSA-N	0	0	299.776	5.306	40	10		CKCBRN
Fc1ccccc1[C@@H]1Nc2c(Cl)cccc2[C@H]2C=CC[C@@H]21	ZINC000409169537	534534477	/nfs/dbraw/zinc/53/44/77/534534477.db2.gz	QPAOQTHYMBRXEP-NVGCLXPQSA-N	0	0	299.776	5.306	40	10		CKCBRN
Fc1ccccc1[C@@H]1Nc2c(Cl)cccc2[C@@H]2C=CC[C@H]21	ZINC000409169538	567903621	/nfs/dbraw/zinc/90/36/21/567903621.db2.gz	QPAOQTHYMBRXEP-PSTGCABASA-N	0	0	299.776	5.306	40	10		CKCBRN
Fc1ccccc1[C@@H]1Nc2c(Cl)cccc2[C@H]2C=CC[C@H]21	ZINC000409169539	534534952	/nfs/dbraw/zinc/53/49/52/534534952.db2.gz	QPAOQTHYMBRXEP-XWCIJXRUSA-N	0	0	299.776	5.306	40	10		CKCBRN
CCc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccccc1)N2	ZINC000409170786	567904139	/nfs/dbraw/zinc/90/41/39/567904139.db2.gz	WLLNLGXUQVPARG-FUHIMQAGSA-N	0	0	275.395	5.076	40	10		CKCBRN
CCc1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccccc1)N2	ZINC000409170789	567934675	/nfs/dbraw/zinc/93/46/75/567934675.db2.gz	WLLNLGXUQVPARG-MBOZVWFJSA-N	0	0	275.395	5.076	40	10		CKCBRN
Cc1cc(C)c2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1cccc(F)c1)N2	ZINC000409174567	567934305	/nfs/dbraw/zinc/93/43/05/567934305.db2.gz	NRFOKLKPMHJQDA-FUHIMQAGSA-N	0	0	293.385	5.269	40	10		CKCBRN
Cc1cc(C)c2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1cccc(F)c1)N2	ZINC000409174568	230412587	/nfs/dbraw/zinc/41/25/87/230412587.db2.gz	NRFOKLKPMHJQDA-MBOZVWFJSA-N	0	0	293.385	5.269	40	10		CKCBRN
CCc1cccc2c1N[C@H](c1ccc(F)cc1)[C@@H]1CC=C[C@@H]21	ZINC000409175074	567904547	/nfs/dbraw/zinc/90/45/47/567904547.db2.gz	POSGFPKBZGVYGA-ILZDJORESA-N	0	0	293.385	5.215	40	10		CKCBRN
CCc1cccc2c1N[C@H](c1ccc(F)cc1)[C@H]1CC=C[C@@H]21	ZINC000409175075	567934519	/nfs/dbraw/zinc/93/45/19/567934519.db2.gz	POSGFPKBZGVYGA-XKGZKEIXSA-N	0	0	293.385	5.215	40	10		CKCBRN