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)[C@H]1COC2(C1)CCN(Cc1cccs1)CC2	ZINC000096047898	185072442	/nfs/dbraw/zinc/07/24/42/185072442.db2.gz	QPMSFUGQSTYCKY-CQSZACIVSA-N	0	3	279.449	3.775	40	0		CHABHN
Cc1cc(N(C)C)ncc1[C@@H]1CCCN1Cc1ccccc1	ZINC000072218669	256708181	/nfs/dbraw/zinc/70/81/81/256708181.db2.gz	XKSDZYINVYPGIZ-SFHVURJKSA-N	0	3	295.430	3.793	40	0		CHABHN
C[C@@H](NCc1ccco1)C12CC3CC(CC(C3)C1)C2	ZINC000007519305	170288055	/nfs/dbraw/zinc/28/80/55/170288055.db2.gz	AOXHXNXGJDPPBV-JISDDCRVSA-N	0	3	259.393	3.974	40	0		CHABHN
CN1CCC[C@@H](c2cccc(Cc3ccccc3F)n2)C1	ZINC000072348570	176373439	/nfs/dbraw/zinc/37/34/39/176373439.db2.gz	AVNFRMNLXUIGIJ-OAHLLOKOSA-N	0	3	284.378	3.621	40	0		CHABHN
Cc1cccc(Cc2cccc([C@H]3CCCN(C)C3)n2)c1	ZINC000072348568	176373596	/nfs/dbraw/zinc/37/35/96/176373596.db2.gz	ADWGYSTZYWEQKD-KRWDZBQOSA-N	0	3	280.415	3.790	40	0		CHABHN
CN1CCC(c2cccc(Cc3ccc(F)cc3)n2)CC1	ZINC000072348571	176373766	/nfs/dbraw/zinc/37/37/66/176373766.db2.gz	GHGONBYSHAKIOK-UHFFFAOYSA-N	0	3	284.378	3.621	40	0		CHABHN
CCN1CCC2(CC1)CC(=O)c1ccc3ccccc3c1O2	ZINC000225824847	528989983	/nfs/dbraw/zinc/98/99/83/528989983.db2.gz	WOJRULMQFXMWON-UHFFFAOYSA-N	0	3	295.382	3.660	40	0		CHABHN
C[C@@H]1CCCN([C@@H](CN)c2cccc(Cl)c2Cl)C1	ZINC000019806666	566879956	/nfs/dbraw/zinc/87/99/56/566879956.db2.gz	GKTKLFLXYDSQAX-MFKMUULPSA-N	0	3	287.234	3.725	40	0		CHABHN
CN(Cc1ccccc1)C[C@H](O)c1ccccc1Cl	ZINC000031912059	567885450	/nfs/dbraw/zinc/88/54/50/567885450.db2.gz	YZHZTOJXJQQTES-INIZCTEOSA-N	0	3	275.779	3.505	40	0		CHABHN
Cc1ccc(-c2cc(C(F)(F)F)c(CN)cn2)cc1	ZINC000089263247	567907339	/nfs/dbraw/zinc/90/73/39/567907339.db2.gz	MZWBCFKTVDIESL-UHFFFAOYSA-N	0	3	266.266	3.535	40	0		CHABHN
CCOc1ccc([C@@H]2CCCCN2CC(C)C)cn1	ZINC000072211801	567917452	/nfs/dbraw/zinc/91/74/52/567917452.db2.gz	IBZRYTVPMNLIRI-HNNXBMFYSA-N	0	3	262.397	3.663	40	0		CHABHN
CC(C)CN1CCCC[C@H]1c1cccnc1Cl	ZINC000072211520	567917902	/nfs/dbraw/zinc/91/79/02/567917902.db2.gz	JKMUYIKSQWZHRV-ZDUSSCGKSA-N	0	3	252.789	3.918	40	0		CHABHN
CCN(CC)c1ccc([C@H]2CCCCN2C(C)C)cn1	ZINC000072212857	567918509	/nfs/dbraw/zinc/91/85/09/567918509.db2.gz	QTLWPMIWGWHSRB-MRXNPFEDSA-N	0	3	275.440	3.863	40	0		CHABHN
CN1CCCC[C@H]1c1cccnc1NC1CCCCC1	ZINC000072214033	567919974	/nfs/dbraw/zinc/91/99/74/567919974.db2.gz	IPXXQBCSVKDNDW-INIZCTEOSA-N	0	3	273.424	3.983	40	0		CHABHN
CCN1CCCC[C@H]1c1cccnc1N1CCCCC1	ZINC000072216119	567920113	/nfs/dbraw/zinc/92/01/13/567920113.db2.gz	LWUATPGLNROSFR-INIZCTEOSA-N	0	3	273.424	3.619	40	0		CHABHN
CCN1CCCC[C@@H]1c1cccnc1N1CCCCC1	ZINC000072216118	567920217	/nfs/dbraw/zinc/92/02/17/567920217.db2.gz	LWUATPGLNROSFR-MRXNPFEDSA-N	0	3	273.424	3.619	40	0		CHABHN
CC(C)CN1CCCC[C@H]1c1cccnc1N1CCCC1	ZINC000072216005	567920702	/nfs/dbraw/zinc/92/07/02/567920702.db2.gz	SGBPCIWUUUYJDB-KRWDZBQOSA-N	0	3	287.451	3.865	40	0		CHABHN
CNc1ncc([C@H]2CCCN2Cc2ccccc2)cc1C	ZINC000072218970	567921825	/nfs/dbraw/zinc/92/18/25/567921825.db2.gz	WDQOWOMHHOMROT-QGZVFWFLSA-N	0	3	281.403	3.769	40	0		CHABHN
COc1ccc(OC)c([C@H]2CCCCN2CC(C)C)c1	ZINC000072221887	567922260	/nfs/dbraw/zinc/92/22/60/567922260.db2.gz	TVEOYQPSTBZMKH-MRXNPFEDSA-N	0	3	277.408	3.887	40	0		CHABHN
Cc1nc(N2CCCCCC2)ccc1[C@H](N)c1ccccc1	ZINC000072224581	567922515	/nfs/dbraw/zinc/92/25/15/567922515.db2.gz	JPJZAPVLRVZSAE-LJQANCHMSA-N	0	3	295.430	3.819	40	0		CHABHN
CC[C@@H](C)Oc1ccccc1[C@@H](C)NC[C@@H]1CCCO1	ZINC000225162548	567952416	/nfs/dbraw/zinc/95/24/16/567952416.db2.gz	AEGZFYICSOOIQG-KFWWJZLASA-N	0	3	277.408	3.694	40	0		CHABHN
COc1cc(CN2CCCC2)ccc1OCc1ccccc1	ZINC000199404991	1129180279	/nfs/dbraw/zinc/18/02/79/1129180279.db2.gz	KAUCYAWOFKLHRG-UHFFFAOYSA-N	0	3	297.398	3.870	40	0		CHABHN
CO[C@@H]1CCN(Cc2ccc(F)cc2)[C@H]1Cc1ccccc1	ZINC000096061575	185083328	/nfs/dbraw/zinc/08/33/28/185083328.db2.gz	FJTLIFLOSNWIBO-RBUKOAKNSA-N	0	3	299.389	3.658	40	0		CHABHN
CC(C)N1CCCC[C@H]1c1ccc(NC2CCC2)nc1	ZINC000072213859	256712954	/nfs/dbraw/zinc/71/29/54/256712954.db2.gz	YCIFGKQBDORCGC-INIZCTEOSA-N	0	3	273.424	3.981	40	0		CHABHN
CC[C@H](C)NCc1cc(Cl)cc(Cl)c1OC	ZINC000005907912	170153415	/nfs/dbraw/zinc/15/34/15/170153415.db2.gz	WITQPGCGTLZPGK-QMMMGPOBSA-N	0	3	262.180	3.890	40	0		CHABHN
CCOc1ccc(Br)cc1CN[C@H](C)CC	ZINC000008325923	170331539	/nfs/dbraw/zinc/33/15/39/170331539.db2.gz	NIFRYWJSKNMIJW-SNVBAGLBSA-N	0	3	286.213	3.736	40	0		CHABHN
CC1CCN([C@@H](CN)c2cc(Cl)cc(Cl)c2)CC1	ZINC000037424716	173198924	/nfs/dbraw/zinc/19/89/24/173198924.db2.gz	BYAKMENAVNZXMC-AWEZNQCLSA-N	0	3	287.234	3.725	40	0		CHABHN
CC1CCN([C@@H](CN)c2ccc(Cl)c(Cl)c2)CC1	ZINC000039142596	174164540	/nfs/dbraw/zinc/16/45/40/174164540.db2.gz	GLMIRNAVPZGQJZ-AWEZNQCLSA-N	0	3	287.234	3.725	40	0		CHABHN
COc1ccc(-c2cccc([C@@H]3CCCN(C)C3)n2)cc1	ZINC000072348560	176373542	/nfs/dbraw/zinc/37/35/42/176373542.db2.gz	AWEYGYLEOJNSNG-OAHLLOKOSA-N	0	3	282.387	3.566	40	0		CHABHN
C[C@@H](c1ccco1)N(C)Cc1cccn1-c1ccncc1	ZINC000072397957	176395545	/nfs/dbraw/zinc/39/55/45/176395545.db2.gz	SWEZNQJICSXDKR-AWEZNQCLSA-N	0	3	281.359	3.658	40	0		CHABHN
CCCN1CCCC[C@H]1c1ccc(NC2CC2)nc1	ZINC000072213797	567919222	/nfs/dbraw/zinc/91/92/22/567919222.db2.gz	IIJCTIFSMHHDPY-HNNXBMFYSA-N	0	3	259.397	3.593	40	0		CHABHN
C[C@@H](C[C@@H]1OC[C@H](CN2CCCCC2)O1)CC(C)(C)C	ZINC000000171801	567073262	/nfs/dbraw/zinc/07/32/62/567073262.db2.gz	HFXRXQYPTWPANL-HRCADAONSA-N	0	3	283.456	3.676	40	0		CHABHN
CCOC(=O)CCN(Cc1ccccc1)Cc1ccccc1	ZINC000039988527	567084581	/nfs/dbraw/zinc/08/45/81/567084581.db2.gz	BBDKGMMFFHIING-UHFFFAOYSA-N	0	3	297.398	3.642	40	0		CHABHN
CN1CCC(=C2c3ccccc3C(O)c3ccccc32)CC1	ZINC000001481770	567837705	/nfs/dbraw/zinc/83/77/05/567837705.db2.gz	HLBRHTFSMMEHPK-UHFFFAOYSA-N	0	3	291.394	3.609	40	0	in-man	CHABHN
CN(C)Cc1cn(-c2ccccc2)c2ccccc12	ZINC000001713956	567842488	/nfs/dbraw/zinc/84/24/88/567842488.db2.gz	YQRFNATTXLUGAO-UHFFFAOYSA-N	0	3	250.345	3.692	40	0		CHABHN
N[C@H](c1cccs1)c1ccc(Br)cc1	ZINC000019841988	567879205	/nfs/dbraw/zinc/87/92/05/567879205.db2.gz	GSIUHOHMHXTASL-NSHDSACASA-N	0	3	268.179	3.559	40	0		CHABHN
CCCCN1CCCC[C@@H]1c1ccc(OCC)nc1	ZINC000072211803	567917709	/nfs/dbraw/zinc/91/77/09/567917709.db2.gz	YDCHWPGNUJLEBB-OAHLLOKOSA-N	0	3	262.397	3.807	40	0		CHABHN
CCN(C)c1ncccc1[C@@H]1CCCCN1CC(C)C	ZINC000072212798	567918005	/nfs/dbraw/zinc/91/80/05/567918005.db2.gz	UIZGWMKTAPBOJW-INIZCTEOSA-N	0	3	275.440	3.721	40	0		CHABHN
CCCCN1CCCC[C@H]1c1cccnc1N(C)CC	ZINC000072212801	567918109	/nfs/dbraw/zinc/91/81/09/567918109.db2.gz	HBOBUTOYRPXWQG-INIZCTEOSA-N	0	3	275.440	3.865	40	0		CHABHN
CCNc1ccc([C@@H]2CCCN2Cc2ccccc2)cn1	ZINC000072213063	567918278	/nfs/dbraw/zinc/91/82/78/567918278.db2.gz	WGKHQEBYJKKLFC-KRWDZBQOSA-N	0	3	281.403	3.851	40	0		CHABHN
CCCN1CCCC[C@H]1c1cccnc1OC(C)C	ZINC000072211978	567918401	/nfs/dbraw/zinc/91/84/01/567918401.db2.gz	XBPAHAWJYVGVIN-HNNXBMFYSA-N	0	3	262.397	3.806	40	0		CHABHN
CC(C)CN1CCCC[C@@H]1c1cccnc1NC1CC1	ZINC000072213740	567918893	/nfs/dbraw/zinc/91/88/93/567918893.db2.gz	GXWHTQNJNZIEAW-MRXNPFEDSA-N	0	3	273.424	3.839	40	0		CHABHN
CCCCN1CCCC[C@H]1c1cccnc1NC1CC1	ZINC000072213743	567919172	/nfs/dbraw/zinc/91/91/72/567919172.db2.gz	SAGIRACAGZQNDB-INIZCTEOSA-N	0	3	273.424	3.983	40	0		CHABHN
CC[C@@H](C)Nc1ncccc1[C@H]1CCCCN1CC	ZINC000072213423	567919185	/nfs/dbraw/zinc/91/91/85/567919185.db2.gz	XBZOOGRKJNEXNL-UKRRQHHQSA-N	0	3	261.413	3.839	40	0		CHABHN
CCN1CCC[C@H]1c1cccnc1N1CCCCCC1	ZINC000072216694	567920287	/nfs/dbraw/zinc/92/02/87/567920287.db2.gz	AGPVEGNGTKERKU-INIZCTEOSA-N	0	3	273.424	3.619	40	0		CHABHN
CN1CCCC[C@H]1c1cccnc1N1CCCCCC1	ZINC000072216717	567920493	/nfs/dbraw/zinc/92/04/93/567920493.db2.gz	NFNINGTYYYOWGT-INIZCTEOSA-N	0	3	273.424	3.619	40	0		CHABHN
CCCN1CCC[C@@H]1c1cccnc1N1CCCCC1	ZINC000072216103	567920801	/nfs/dbraw/zinc/92/08/01/567920801.db2.gz	IGGSKFWJCFUHCB-MRXNPFEDSA-N	0	3	273.424	3.619	40	0		CHABHN
CSc1ncccc1[C@H]1CCCCN1CC(C)C	ZINC000072216963	567921380	/nfs/dbraw/zinc/92/13/80/567921380.db2.gz	IKXRTGUYNPYBCK-CQSZACIVSA-N	0	3	264.438	3.987	40	0		CHABHN
CCN1CCC[C@H]1c1cnc(N2CCCCC2)c(C)c1	ZINC000072219152	567921692	/nfs/dbraw/zinc/92/16/92/567921692.db2.gz	DQUPOMYJQNNXPT-INIZCTEOSA-N	0	3	273.424	3.537	40	0		CHABHN
CCCCOc1cccc([C@@H](C)NC[C@H]2CCCO2)c1	ZINC000225167386	567952751	/nfs/dbraw/zinc/95/27/51/567952751.db2.gz	UGDAUCKIQJGURM-RHSMWYFYSA-N	0	3	277.408	3.695	40	0		CHABHN
CC(C)[C@@H]1COC2(C1)CCN(Cc1ccc(F)cc1)CC2	ZINC000096047905	185072313	/nfs/dbraw/zinc/07/23/13/185072313.db2.gz	UEZBNGBNVWKXSF-INIZCTEOSA-N	0	3	291.410	3.853	40	0		CHABHN
CCc1cccc2cc(CNCc3cccs3)c(=O)[nH]c21	ZINC000257282872	190026560	/nfs/dbraw/zinc/02/65/60/190026560.db2.gz	OVQALVUPBCLQFQ-UHFFFAOYSA-N	0	3	298.411	3.854	40	0		CHABHN
Cc1ccc(C)c2[nH]c(=O)c(CNCc3cccs3)cc12	ZINC000257343509	190037497	/nfs/dbraw/zinc/03/74/97/190037497.db2.gz	ZTHKGPDQUBRVJU-UHFFFAOYSA-N	0	3	298.411	3.909	40	0		CHABHN
Cc1cc(N2CCCCC2)ncc1[C@H]1CCCCN1C	ZINC000072219235	256707745	/nfs/dbraw/zinc/70/77/45/256707745.db2.gz	QAIJQHZQPHXPMR-MRXNPFEDSA-N	0	3	273.424	3.537	40	0		CHABHN
CNCc1cc(Cl)c(OCc2cccs2)c(OC)c1	ZINC000005910012	170153690	/nfs/dbraw/zinc/15/36/90/170153690.db2.gz	GTARXTKHPNEIBP-UHFFFAOYSA-N	0	3	297.807	3.709	40	0		CHABHN
CCCCCNCc1cc(Br)ccc1OC	ZINC000006427698	170200646	/nfs/dbraw/zinc/20/06/46/170200646.db2.gz	QMBDYFPOTUJWBS-UHFFFAOYSA-N	0	3	286.213	3.738	40	0		CHABHN
CC1CCN([C@H](CN)c2ccc(Cl)cc2Cl)CC1	ZINC000039142594	174164579	/nfs/dbraw/zinc/16/45/79/174164579.db2.gz	QAMHRNGQTWMTMW-CQSZACIVSA-N	0	3	287.234	3.725	40	0		CHABHN
CC[C@@H]1CNCc2cc3cccc(C(C)C)c3nc2O1	ZINC000072392285	176394509	/nfs/dbraw/zinc/39/45/09/176394509.db2.gz	WGHLVBCHXHMVNK-CQSZACIVSA-N	0	3	270.376	3.619	40	0		CHABHN
CCCN1CCCC[C@H]1c1ccc(OC(C)C)nc1	ZINC000072211918	567917646	/nfs/dbraw/zinc/91/76/46/567917646.db2.gz	FAXOELMBIDKOOE-HNNXBMFYSA-N	0	3	262.397	3.806	40	0		CHABHN
CCCN1CCC[C@@H]1c1cccnc1NCC(C)C	ZINC000072213255	567918363	/nfs/dbraw/zinc/91/83/63/567918363.db2.gz	RQCYYUSWBMBGSB-OAHLLOKOSA-N	0	3	261.413	3.696	40	0		CHABHN
c1[nH]c2ccccc2c1[C@H](c1ccccn1)N1CCCC1	ZINC000000101833	567818268	/nfs/dbraw/zinc/81/82/68/567818268.db2.gz	KMUFNTCIBVGBFX-GOSISDBHSA-N	0	3	277.371	3.748	40	0		CHABHN
CN1[C@@H](c2ccccc2)CC(C)(O)C[C@H]1c1ccccc1	ZINC000000208435	567822045	/nfs/dbraw/zinc/82/20/45/567822045.db2.gz	YKVNCLSIBPRPTL-DFNIBXOVSA-N	0	3	281.399	3.946	40	0		CHABHN
CCOc1ccc(CN[C@H](C)c2ccccc2)cc1	ZINC000000517047	567833357	/nfs/dbraw/zinc/83/33/57/567833357.db2.gz	JNVVIQPMHUDYTJ-CQSZACIVSA-N	0	3	255.361	3.936	40	0		CHABHN
C[C@@H](c1ccccc1)c1ccccc1OCCN(C)C	ZINC000001586332	567838748	/nfs/dbraw/zinc/83/87/48/567838748.db2.gz	PATHRCHITDYBRX-HNNXBMFYSA-N	0	3	269.388	3.779	40	0		CHABHN
CC(C)[C@H](C(=O)CCN(C)C)c1ccc(Cl)cc1	ZINC000001848526	567843825	/nfs/dbraw/zinc/84/38/25/567843825.db2.gz	NTFQBQOOTJCIEC-HNNXBMFYSA-N	0	3	267.800	3.600	40	0		CHABHN
Clc1ccc(CNCCOc2ccccn2)c(Cl)c1	ZINC000057353324	567895103	/nfs/dbraw/zinc/89/51/03/567895103.db2.gz	SESGMIJTJRFNOR-UHFFFAOYSA-N	0	3	297.185	3.557	40	0		CHABHN
Cc1cccc([C@H]2CCCN2Cc2ccccc2)n1	ZINC000072211068	567917613	/nfs/dbraw/zinc/91/76/13/567917613.db2.gz	POHOSRLWZRWRET-QGZVFWFLSA-N	0	3	252.361	3.727	40	0		CHABHN
Cc1ccncc1[C@@H]1CCCN1Cc1ccccc1	ZINC000072211387	567917931	/nfs/dbraw/zinc/91/79/31/567917931.db2.gz	SLWSFWBQMBDCQU-KRWDZBQOSA-N	0	3	252.361	3.727	40	0		CHABHN
CCCNc1ccc([C@@H]2CCCCN2C(C)C)cn1	ZINC000072213214	567918303	/nfs/dbraw/zinc/91/83/03/567918303.db2.gz	BIYOHDXNXRKWML-HNNXBMFYSA-N	0	3	261.413	3.839	40	0		CHABHN
CCCN1CCCC[C@H]1c1ccc(N(CC)CC)nc1	ZINC000072212855	567918482	/nfs/dbraw/zinc/91/84/82/567918482.db2.gz	AWYCWRQBRWEDHG-INIZCTEOSA-N	0	3	275.440	3.865	40	0		CHABHN
CCN(C)c1ccc([C@@H]2CCCN2Cc2ccccc2)cn1	ZINC000072212705	567918661	/nfs/dbraw/zinc/91/86/61/567918661.db2.gz	DSSJXQPTAVBGID-SFHVURJKSA-N	0	3	295.430	3.875	40	0		CHABHN
CCCN1CCCC[C@@H]1c1cccnc1NC1CC1	ZINC000072213736	567919257	/nfs/dbraw/zinc/91/92/57/567919257.db2.gz	WXOVPOGHKWDDNV-OAHLLOKOSA-N	0	3	259.397	3.593	40	0		CHABHN
CCCCNc1ncccc1[C@H]1CCCN1C(C)C	ZINC000072213598	567919260	/nfs/dbraw/zinc/91/92/60/567919260.db2.gz	QUBWBFPNQFCHPG-OAHLLOKOSA-N	0	3	261.413	3.839	40	0		CHABHN
CCCCNc1ncccc1[C@H]1CCCN1CCC	ZINC000072213600	567919328	/nfs/dbraw/zinc/91/93/28/567919328.db2.gz	KFHDIJORTGABBT-OAHLLOKOSA-N	0	3	261.413	3.841	40	0		CHABHN
CN1CCCC[C@H]1c1ccc(NC2CCCC2)nc1	ZINC000072213973	567919346	/nfs/dbraw/zinc/91/93/46/567919346.db2.gz	VXPHLIDMTIWLBX-HNNXBMFYSA-N	0	3	259.397	3.593	40	0		CHABHN
CCN1CCC[C@@H]1c1ccc(Nc2ccccc2)nc1	ZINC000072214069	567919650	/nfs/dbraw/zinc/91/96/50/567919650.db2.gz	LZNMMZXZLYHCQA-MRXNPFEDSA-N	0	3	267.376	3.982	40	0		CHABHN
CN1CCC[C@H]1c1ccc(Nc2ccccc2)nc1	ZINC000072214064	567919699	/nfs/dbraw/zinc/91/96/99/567919699.db2.gz	XIIKQNIHMBFIOB-HNNXBMFYSA-N	0	3	253.349	3.592	40	0		CHABHN
CCN1CCC[C@@H]1c1cccnc1Nc1ccccc1	ZINC000072214129	567920042	/nfs/dbraw/zinc/92/00/42/567920042.db2.gz	JLGZLQINNHAURH-MRXNPFEDSA-N	0	3	267.376	3.982	40	0		CHABHN
CCCCN1CCC[C@H]1c1cnc(Cl)cc1C	ZINC000072217846	567920152	/nfs/dbraw/zinc/92/01/52/567920152.db2.gz	XLJFJBKWYUYPCV-ZDUSSCGKSA-N	0	3	252.789	3.980	40	0		CHABHN
CCCCN1CCC[C@@H]1c1cccnc1N1CCCC1	ZINC000072215987	567920231	/nfs/dbraw/zinc/92/02/31/567920231.db2.gz	ASMHQXCDBNWZIE-MRXNPFEDSA-N	0	3	273.424	3.619	40	0		CHABHN
CC(C)N1CCC[C@@H]1c1cccnc1N1CCCCC1	ZINC000072216101	567920387	/nfs/dbraw/zinc/92/03/87/567920387.db2.gz	RNPBKBCUWLXFSK-MRXNPFEDSA-N	0	3	273.424	3.617	40	0		CHABHN
CCSc1ncccc1[C@@H]1CCCN1C(C)C	ZINC000072217180	567921414	/nfs/dbraw/zinc/92/14/14/567921414.db2.gz	QYFNRYJOGHHVLV-ZDUSSCGKSA-N	0	3	250.411	3.739	40	0		CHABHN
Cc1cc([C@H]2CCCCN2Cc2ccccc2)cnc1N	ZINC000072218467	567921907	/nfs/dbraw/zinc/92/19/07/567921907.db2.gz	RJGYWBIHTYKHIT-QGZVFWFLSA-N	0	3	281.403	3.699	40	0		CHABHN
CN(c1ccccc1)c1ccc([C@H](N)c2ccccc2)cn1	ZINC000072225332	567922336	/nfs/dbraw/zinc/92/23/36/567922336.db2.gz	ILUBAKYXMAHTMH-LJQANCHMSA-N	0	3	289.382	3.898	40	0		CHABHN
COc1ccc2[nH]c3c(c2c1)CCN1C[C@H]2CCCC[C@H]2[C@H]31	ZINC000002124592	567932069	/nfs/dbraw/zinc/93/20/69/567932069.db2.gz	HKCFIODYAGNXJQ-BBEGDGIKSA-N	0	3	296.414	3.896	40	0		CHABHN
O=C(CCN1CCCCC1)c1ccc2ccccc2c1	ZINC000001724559	567937498	/nfs/dbraw/zinc/93/74/98/567937498.db2.gz	SWVZNNNOKMRCOT-UHFFFAOYSA-N	0	3	267.372	3.899	40	0		CHABHN
C[C@@H](NC[C@@H]1CCCO1)c1ccccc1OC1CCCC1	ZINC000225162203	567952452	/nfs/dbraw/zinc/95/24/52/567952452.db2.gz	RDERECKJMXNEPY-ZBFHGGJFSA-N	0	3	289.419	3.838	40	0		CHABHN
CCNc1cc(N2Cc3ccccc3C(C)(C)C2)nc(C)n1	ZINC000329060218	1125452982	/nfs/dbraw/zinc/45/29/82/1125452982.db2.gz	WKHXOPUAGSLDNG-UHFFFAOYSA-N	0	3	296.418	3.515	40	0		CHABHN
C[C@H](NC[C@@H]1CCCO1)c1cccc(OC2CCCC2)c1	ZINC000225167517	189745160	/nfs/dbraw/zinc/74/51/60/189745160.db2.gz	LRNVTYKREVBMEX-KSSFIOAISA-N	0	3	289.419	3.838	40	0		CHABHN
COc1ccc2c(ccc3c2CC[C@]2(C)CCN=C32)c1	ZINC000005052839	170061976	/nfs/dbraw/zinc/06/19/76/170061976.db2.gz	ZACAJAJLRYUXFS-GOSISDBHSA-N	0	3	265.356	3.994	40	0		CHABHN
C[C@H]1C(O)[C@@H](C)[C@H](c2ccccc2)N[C@@H]1c1ccccc1	ZINC000005730032	170134316	/nfs/dbraw/zinc/13/43/16/170134316.db2.gz	GGCLDJYYOISOSI-URAHIKNTSA-N	0	3	281.399	3.705	40	0		CHABHN
CCN(CC)C[C@@H](Oc1ccccc1)C(=O)c1ccccc1	ZINC000006382431	170196611	/nfs/dbraw/zinc/19/66/11/170196611.db2.gz	QZQSOAHZXPHQCZ-GOSISDBHSA-N	0	3	297.398	3.659	40	0		CHABHN
Cc1ccc([C@@H](CN(C)C)C(=O)c2ccccc2)cc1C	ZINC000006522837	170209399	/nfs/dbraw/zinc/20/93/99/170209399.db2.gz	WCLJTAOTFJCZJL-GOSISDBHSA-N	0	3	281.399	3.832	40	0		CHABHN
Cc1c(CN(C)C)cccc1[C@H](O)C1CCCCC1	ZINC000008618954	170343402	/nfs/dbraw/zinc/34/34/02/170343402.db2.gz	SGJVHOSPVVRFED-QGZVFWFLSA-N	0	3	261.409	3.670	40	0		CHABHN
CN1CCC[C@@H](c2cccc(Cc3ccc(F)cc3)n2)C1	ZINC000072348573	176373578	/nfs/dbraw/zinc/37/35/78/176373578.db2.gz	JWUFYHSVNWVEOZ-OAHLLOKOSA-N	0	3	284.378	3.621	40	0		CHABHN
Cc1c(CN(C)C)cccc1[C@@H](O)C1CCCCC1	ZINC000001604268	567839349	/nfs/dbraw/zinc/83/93/49/567839349.db2.gz	SGJVHOSPVVRFED-KRWDZBQOSA-N	0	3	261.409	3.670	40	0		CHABHN
Cc1cc(C)c(C)c(C(=O)OCCN2CCCCC2)c1C	ZINC000001661315	567840400	/nfs/dbraw/zinc/84/04/00/567840400.db2.gz	UHSUMQHGAZPWAI-UHFFFAOYSA-N	0	3	289.419	3.563	40	0		CHABHN
C[C@@H]1CCCCN1CCCSC(=O)c1ccccc1	ZINC000002042393	567844323	/nfs/dbraw/zinc/84/43/23/567844323.db2.gz	WWWKIGOKQIQJRK-CQSZACIVSA-N	0	3	277.433	3.825	40	0		CHABHN
Cc1nn(-c2ccccc2)c2c1C(c1ccco1)S2	ZINC000016266279	567872215	/nfs/dbraw/zinc/87/22/15/567872215.db2.gz	HOXOCOMPXMLEAB-AWEZNQCLSA-N	0	3	268.341	3.969	40	0		CHABHN
CCCCN1CCN(CCCC)[C@H]2CCCC[C@@H]21	ZINC000019365564	567877326	/nfs/dbraw/zinc/87/73/26/567877326.db2.gz	UYPHWUXYKSXDIF-HOTGVXAUSA-N	0	3	252.446	3.515	40	0		CHABHN
CC(C)c1ccc2oc(C3=CCN(C)CC3)nc2c1	ZINC000073635997	567893031	/nfs/dbraw/zinc/89/30/31/567893031.db2.gz	YWQBBBFWYSHALN-UHFFFAOYSA-N	0	3	256.349	3.670	40	0		CHABHN
CCCN1CC=C(c2nc3cc(CC)ccc3o2)CC1	ZINC000073636269	567893304	/nfs/dbraw/zinc/89/33/04/567893304.db2.gz	ONTJCJDYNUBBRM-UHFFFAOYSA-N	0	3	270.376	3.889	40	0		CHABHN
NC1(n2sc(=S)c3c2CCCC3)CCCCC1	ZINC000100368025	567913082	/nfs/dbraw/zinc/91/30/82/567913082.db2.gz	AQXILPRHZTYRIE-UHFFFAOYSA-N	0	3	268.451	3.779	40	0		CHABHN
CCOC(=O)C[C@H](c1cccc(Cl)c1)N(CC)CC	ZINC000072210301	567917914	/nfs/dbraw/zinc/91/79/14/567917914.db2.gz	DGDZCGBZISARCE-CQSZACIVSA-N	0	3	283.799	3.676	40	0		CHABHN
CCCNc1ccc([C@@H]2CCCCN2CCC)cn1	ZINC000072213212	567918563	/nfs/dbraw/zinc/91/85/63/567918563.db2.gz	QJWLBMOLIOFMST-HNNXBMFYSA-N	0	3	261.413	3.841	40	0		CHABHN
CCN1CCC[C@@H]1c1ccc(NC(=O)OC(C)(C)C)nc1	ZINC000072214309	567919717	/nfs/dbraw/zinc/91/97/17/567919717.db2.gz	JYMVNBAHLKECBD-CYBMUJFWSA-N	0	3	291.395	3.585	40	0		CHABHN
CCCN1CCCC[C@@H]1c1cccnc1SC	ZINC000072216959	567921060	/nfs/dbraw/zinc/92/10/60/567921060.db2.gz	NQOCQQMVFUAUAX-CYBMUJFWSA-N	0	3	250.411	3.741	40	0		CHABHN
Cc1cc([C@@H]2CCCN2Cc2ccccc2)ccn1	ZINC000072219447	567921566	/nfs/dbraw/zinc/92/15/66/567921566.db2.gz	XLRWYEXAQQCLGG-KRWDZBQOSA-N	0	3	252.361	3.727	40	0		CHABHN
CNc1cc(C)c([C@H]2CCCN2Cc2ccccc2)cn1	ZINC000072219030	567921882	/nfs/dbraw/zinc/92/18/82/567921882.db2.gz	JIKHSVKCPHDXPW-QGZVFWFLSA-N	0	3	281.403	3.769	40	0		CHABHN
CCN1CCCC[C@H]1c1cnc(N2CCCC2)c(C)c1	ZINC000072218817	567921933	/nfs/dbraw/zinc/92/19/33/567921933.db2.gz	GQWRDJAZQAGEKG-INIZCTEOSA-N	0	3	273.424	3.537	40	0		CHABHN
COc1ccc2[nH]c3c(c2c1)CCN1C[C@H]2CCCC[C@@H]2[C@H]31	ZINC000004026531	567932364	/nfs/dbraw/zinc/93/23/64/567932364.db2.gz	HKCFIODYAGNXJQ-SPKLELGKSA-N	0	3	296.414	3.896	40	0		CHABHN
Cc1ccc(CN2CCC3(C[C@H](C(C)C)CO3)CC2)o1	ZINC000096047902	185072905	/nfs/dbraw/zinc/07/29/05/185072905.db2.gz	LOGUFWAFNNODDT-HNNXBMFYSA-N	0	3	277.408	3.615	40	0		CHABHN
Cc1nc(NC(C)C)cc(N2Cc3ccccc3C[C@@H]2C)n1	ZINC000329006756	136377193	/nfs/dbraw/zinc/37/71/93/136377193.db2.gz	LEGDZCPYMCIQPR-ZDUSSCGKSA-N	0	3	296.418	3.557	40	0		CHABHN
CC(C)n1nc(C2CC2)cc1CNCCc1ccccc1	ZINC000256049497	190002235	/nfs/dbraw/zinc/00/22/35/190002235.db2.gz	AESWHRLIKVZESH-UHFFFAOYSA-N	0	3	283.419	3.674	40	0		CHABHN
COc1c(Cl)cc(Cl)cc1CNCC(C)C	ZINC000005817283	170143124	/nfs/dbraw/zinc/14/31/24/170143124.db2.gz	ZKJBSOVDFVHZJG-UHFFFAOYSA-N	0	3	262.180	3.748	40	0		CHABHN
CCNCc1ccccc1OCc1ccccc1F	ZINC000006497346	170207380	/nfs/dbraw/zinc/20/73/80/170207380.db2.gz	IMJIKUUPHPBDOL-UHFFFAOYSA-N	0	3	259.324	3.514	40	0		CHABHN
CCOc1cc(CNCc2ccc(C)cc2)ccc1OC	ZINC000007538065	170290349	/nfs/dbraw/zinc/29/03/49/170290349.db2.gz	RVJZGQPRNWXBKB-UHFFFAOYSA-N	0	3	285.387	3.692	40	0		CHABHN
COc1ccc(C2=CCN(Cc3ccccc3)CC2)cc1	ZINC000022005456	171348675	/nfs/dbraw/zinc/34/86/75/171348675.db2.gz	DGODCJUPOVOBKP-UHFFFAOYSA-N	0	3	279.383	3.985	40	0		CHABHN
CN1CCC[C@H](c2cncc(-c3cccc(Cl)c3)n2)C1	ZINC000072359278	176376674	/nfs/dbraw/zinc/37/66/74/176376674.db2.gz	QQVMGTAWWUXOHI-ZDUSSCGKSA-N	0	3	287.794	3.606	40	0		CHABHN
CCSc1ncccc1[C@H]1CCCN1CC(C)C	ZINC000072217185	567920874	/nfs/dbraw/zinc/92/08/74/567920874.db2.gz	GAHLGKNYILYNJE-CQSZACIVSA-N	0	3	264.438	3.987	40	0		CHABHN
C[C@@H](CN1[C@@H](C)CCC[C@@H]1C)OC(=O)c1ccccc1F	ZINC000012342208	567073119	/nfs/dbraw/zinc/07/31/19/567073119.db2.gz	RVQIYLDWJBKUAL-IHRRRGAJSA-N	0	3	293.382	3.634	40	0		CHABHN
Cc1cc([C@@H](c2ccccc2)N(C)C)cc(C)c1O	ZINC000255189422	567110305	/nfs/dbraw/zinc/11/03/05/567110305.db2.gz	PUBUITBGPJKZIK-MRXNPFEDSA-N	0	3	255.361	3.660	40	0		CHABHN
CN(C)CCOc1ccccc1Cc1cccc(Cl)c1	ZINC000001586331	567838770	/nfs/dbraw/zinc/83/87/70/567838770.db2.gz	QPQOFPPOKWKBRZ-UHFFFAOYSA-N	0	3	289.806	3.871	40	0		CHABHN
CC[C@@H](C)[C@H](C(=O)OCCN(CC)CC)c1ccccc1	ZINC000001649105	567840113	/nfs/dbraw/zinc/84/01/13/567840113.db2.gz	LKQUJKDIEHGPLY-WBVHZDCISA-N	0	3	291.435	3.701	40	0		CHABHN
CC(C)CN(CC(=O)Nc1cccc(Cl)c1)CC(C)C	ZINC000001672729	567841156	/nfs/dbraw/zinc/84/11/56/567841156.db2.gz	FVECHTHFSUFXBF-UHFFFAOYSA-N	0	3	296.842	3.893	40	0		CHABHN
CCc1cc2ccccc2nc1SCCN1CCCC1	ZINC000004929974	567859141	/nfs/dbraw/zinc/85/91/41/567859141.db2.gz	XLTIXPHSSLZGQZ-UHFFFAOYSA-N	0	3	286.444	3.985	40	0		CHABHN
N[C@@H](c1cccs1)c1ccc(Br)cc1	ZINC000019841991	567879221	/nfs/dbraw/zinc/87/92/21/567879221.db2.gz	GSIUHOHMHXTASL-LLVKDONJSA-N	0	3	268.179	3.559	40	0		CHABHN
NCc1ccc(-c2ccc(Cl)cc2)nc1Cl	ZINC000089261635	567907348	/nfs/dbraw/zinc/90/73/48/567907348.db2.gz	UQCVFXUHHNEUDS-UHFFFAOYSA-N	0	3	253.132	3.514	40	0		CHABHN
O[C@H]1[C@@H]2CCC[C@H]1[C@H](c1ccccc1)N[C@H]2c1ccccc1	ZINC000100672325	567913714	/nfs/dbraw/zinc/91/37/14/567913714.db2.gz	USAKVYHRWZXKIZ-LJDSDSDDSA-N	0	3	293.410	3.849	40	0		CHABHN
c1ccc(Oc2ncccc2[C@H]2CCCCN2)cc1	ZINC000072212212	567918095	/nfs/dbraw/zinc/91/80/95/567918095.db2.gz	XLBLZEAWCCWOOE-OAHLLOKOSA-N	0	3	254.333	3.689	40	0		CHABHN
CCN1CCC[C@@H]1c1ccc(NC2CCCC2)nc1	ZINC000072213949	567918806	/nfs/dbraw/zinc/91/88/06/567918806.db2.gz	QEGUSAHYFCDTME-OAHLLOKOSA-N	0	3	259.397	3.593	40	0		CHABHN
CCN1CCC[C@H]1c1ccc(N2CCCCCC2)nc1	ZINC000072216634	567920303	/nfs/dbraw/zinc/92/03/03/567920303.db2.gz	NDGBCULDKIDPPN-INIZCTEOSA-N	0	3	273.424	3.619	40	0		CHABHN
CCCN1CCC[C@H]1c1cccnc1SCC	ZINC000072217183	567921125	/nfs/dbraw/zinc/92/11/25/567921125.db2.gz	NRNJUOHPUWCFMS-ZDUSSCGKSA-N	0	3	250.411	3.741	40	0		CHABHN
CCCN1CCCC[C@@H]1c1cnc(N2CCCC2)c(C)c1	ZINC000072218818	567921521	/nfs/dbraw/zinc/92/15/21/567921521.db2.gz	ZFXBBNMIPMTLQX-QGZVFWFLSA-N	0	3	287.451	3.927	40	0		CHABHN
O=C(c1ccc(F)cc1)C1CCN(Cc2ccccc2)CC1	ZINC000013731513	567942054	/nfs/dbraw/zinc/94/20/54/567942054.db2.gz	QQJOPKBZXNOJRJ-UHFFFAOYSA-N	0	3	297.373	3.921	40	0		CHABHN
COc1ccc([C@H](N)c2cccc(C(F)(F)F)c2)cc1	ZINC000019415865	567944814	/nfs/dbraw/zinc/94/48/14/567944814.db2.gz	QJIFUHQJTOGINK-AWEZNQCLSA-N	0	3	281.277	3.762	40	0		CHABHN
CC[C@H](C)Oc1ccccc1[C@H](C)NC[C@@H]1CCCO1	ZINC000225162661	567952225	/nfs/dbraw/zinc/95/22/25/567952225.db2.gz	AEGZFYICSOOIQG-KKUMJFAQSA-N	0	3	277.408	3.694	40	0		CHABHN
C[C@H](NC[C@@H]1CCCO1)c1ccccc1OC1CCCC1	ZINC000225162245	189744617	/nfs/dbraw/zinc/74/46/17/189744617.db2.gz	RDERECKJMXNEPY-HOCLYGCPSA-N	0	3	289.419	3.838	40	0		CHABHN
CC[C@@H](C)Oc1ccccc1[C@H](C)NCCCOC	ZINC000225161724	189744641	/nfs/dbraw/zinc/74/46/41/189744641.db2.gz	RVPYOISYUKKLEQ-KGLIPLIRSA-N	0	3	265.397	3.551	40	0		CHABHN
CC(C)COC(=O)C[C@@H](c1ccccc1)N1CCCCC1	ZINC000005962693	170163892	/nfs/dbraw/zinc/16/38/92/170163892.db2.gz	HYIJHOKIEBOURB-KRWDZBQOSA-N	0	3	289.419	3.803	40	0		CHABHN
CCNCc1cccc(OCC)c1OCc1ccccc1	ZINC000006326216	170191347	/nfs/dbraw/zinc/19/13/47/170191347.db2.gz	FASSSMGFACQTKT-UHFFFAOYSA-N	0	3	285.387	3.774	40	0		CHABHN
CN(Cc1nc2ccccc2n1C)CC1CCCCC1	ZINC000006677905	170225397	/nfs/dbraw/zinc/22/53/97/170225397.db2.gz	HZCHJZIOHZOQNK-UHFFFAOYSA-N	0	3	271.408	3.585	40	0		CHABHN
C[C@H](c1cccc(OCc2ccccc2)c1)N(C)C	ZINC000022051338	171350780	/nfs/dbraw/zinc/35/07/80/171350780.db2.gz	KSGZYOKUQUKFBY-CQSZACIVSA-N	0	3	255.361	3.888	40	0	in-vitro	CHABHN
CN(C)[C@@H](c1ccccc1)[C@H](c1ccccc1)N(C)C	ZINC000039934033	174175958	/nfs/dbraw/zinc/17/59/58/174175958.db2.gz	MYLJZKKJRGGLPH-ROUUACIJSA-N	0	3	268.404	3.592	40	0		CHABHN
CCN(Cc1cc(Br)cs1)C(C)C	ZINC000043687001	175094595	/nfs/dbraw/zinc/09/45/95/175094595.db2.gz	ZUZMOYGVAPHYRT-UHFFFAOYSA-N	0	3	262.216	3.741	40	0		CHABHN
CC(C)(C)N1Cc2ccc3c(c2C1)CN(C(C)(C)C)C3	ZINC000071256551	176095467	/nfs/dbraw/zinc/09/54/67/176095467.db2.gz	XBVLQMVMFSPGES-UHFFFAOYSA-N	0	3	272.436	3.915	40	0		CHABHN
CC[C@H]1CNCc2cc3cccc(C(C)C)c3nc2O1	ZINC000072392286	176394296	/nfs/dbraw/zinc/39/42/96/176394296.db2.gz	WGHLVBCHXHMVNK-AWEZNQCLSA-N	0	3	270.376	3.619	40	0		CHABHN
CCCCNCc1ccc(-c2ccc(C(=O)OC)cc2)o1	ZINC000007261711	261378326	/nfs/dbraw/zinc/37/83/26/261378326.db2.gz	PVEDOYLQROKOGD-UHFFFAOYSA-N	0	3	287.359	3.623	40	0		CHABHN
CCOC(=O)C[C@@H](c1ccccc1Cl)N(CC)CC	ZINC000072210302	567917423	/nfs/dbraw/zinc/91/74/23/567917423.db2.gz	DUCXPIVTPBAUBK-AWEZNQCLSA-N	0	3	283.799	3.676	40	0		CHABHN
CCOP(=O)(OCC)C(F)(F)[C@H](N)c1ccccc1	ZINC000095637881	567090217	/nfs/dbraw/zinc/09/02/17/567090217.db2.gz	VOMXDASMZHCKAZ-LLVKDONJSA-N	0	3	293.250	3.545	40	0		CHABHN
CCCN1CCC[C@H]1c1cccnc1N[C@H](C)CC	ZINC000108368496	567103520	/nfs/dbraw/zinc/10/35/20/567103520.db2.gz	NORPIJXUDNAOFT-HIFRSBDPSA-N	0	3	261.413	3.839	40	0		CHABHN
CCC[C@@H](NCc1cnc(SC)nc1)c1ccccc1	ZINC000062717243	567109360	/nfs/dbraw/zinc/10/93/60/567109360.db2.gz	CWMSLHSKHGNKAM-OAHLLOKOSA-N	0	3	287.432	3.830	40	0		CHABHN
CN1[C@H]2C=C(c3ccc(C(F)(F)F)cc3)C[C@@H]1CC2	ZINC000000007658	567816471	/nfs/dbraw/zinc/81/64/71/567816471.db2.gz	DFCVUTKHIIFWKJ-KGLIPLIRSA-N	0	3	267.294	3.955	40	0		CHABHN
CC(C)COC(=O)C[C@H](c1ccccc1)N1CCCCC1	ZINC000001569418	567838159	/nfs/dbraw/zinc/83/81/59/567838159.db2.gz	HYIJHOKIEBOURB-QGZVFWFLSA-N	0	3	289.419	3.803	40	0		CHABHN
CN(C)CCOc1ccc(Cl)cc1Cc1ccccc1	ZINC000001678375	567841244	/nfs/dbraw/zinc/84/12/44/567841244.db2.gz	QIYMBRBOACGJMB-UHFFFAOYSA-N	0	3	289.806	3.871	40	0		CHABHN
CN(Cc1ccccc1)C[C@H](O)c1ccc(Cl)cc1	ZINC000031961906	567885588	/nfs/dbraw/zinc/88/55/88/567885588.db2.gz	WWYMRAQFSAKRMQ-INIZCTEOSA-N	0	3	275.779	3.505	40	0		CHABHN
O=C1C(Cc2ccc(F)cc2)Sc2nc3ccccc3n21	ZINC000000034373	567901962	/nfs/dbraw/zinc/90/19/62/567901962.db2.gz	RKSSJIOPLVMIQL-AWEZNQCLSA-N	0	3	298.342	3.533	40	0		CHABHN
c1ccc(CN2CCCC[C@H]2c2ccccn2)cc1	ZINC000072210993	567917694	/nfs/dbraw/zinc/91/76/94/567917694.db2.gz	ZGNGBBMEYSSAIL-KRWDZBQOSA-N	0	3	252.361	3.809	40	0		CHABHN
CCOc1ccc([C@H]2CCCCN2CC(C)C)cn1	ZINC000072211802	567917826	/nfs/dbraw/zinc/91/78/26/567917826.db2.gz	IBZRYTVPMNLIRI-OAHLLOKOSA-N	0	3	262.397	3.663	40	0		CHABHN
CN(C)c1ccc([C@H]2CCCCN2Cc2ccccc2)cn1	ZINC000072212623	567918387	/nfs/dbraw/zinc/91/83/87/567918387.db2.gz	GETLSQLLUGEROE-GOSISDBHSA-N	0	3	295.430	3.875	40	0		CHABHN
c1ccc(CN2CCC[C@H]2c2ccc(NC3CC3)nc2)cc1	ZINC000072213768	567918747	/nfs/dbraw/zinc/91/87/47/567918747.db2.gz	WBMAGXOKSLEVFQ-SFHVURJKSA-N	0	3	293.414	3.993	40	0		CHABHN
CCCCNc1ncccc1[C@@H]1CCCN1C(C)C	ZINC000072213597	567919127	/nfs/dbraw/zinc/91/91/27/567919127.db2.gz	QUBWBFPNQFCHPG-HNNXBMFYSA-N	0	3	261.413	3.839	40	0		CHABHN
CCCN1CCCC[C@H]1c1cccnc1N1CCCC1	ZINC000072216001	567920143	/nfs/dbraw/zinc/92/01/43/567920143.db2.gz	BMQFPJHURSMONU-INIZCTEOSA-N	0	3	273.424	3.619	40	0		CHABHN
CC(C)CN1CCCC[C@@H]1c1cccnc1N1CCCC1	ZINC000072216004	567920425	/nfs/dbraw/zinc/92/04/25/567920425.db2.gz	SGBPCIWUUUYJDB-QGZVFWFLSA-N	0	3	287.451	3.865	40	0		CHABHN
CCN1CCC[C@@H]1c1cnc(N2CCCCC2)c(C)c1	ZINC000072219151	567921555	/nfs/dbraw/zinc/92/15/55/567921555.db2.gz	DQUPOMYJQNNXPT-MRXNPFEDSA-N	0	3	273.424	3.537	40	0		CHABHN
N[C@H](c1ccccc1)c1ccc(Nc2ccccc2)nc1	ZINC000072225311	567922053	/nfs/dbraw/zinc/92/20/53/567922053.db2.gz	OVHTVYYKRMZLTA-GOSISDBHSA-N	0	3	275.355	3.873	40	0		CHABHN
CCCN1CCCC[C@@H]1c1cc(OC)ccc1OC	ZINC000072221883	567922145	/nfs/dbraw/zinc/92/21/45/567922145.db2.gz	NRXFBSZHTWEPNJ-OAHLLOKOSA-N	0	3	263.381	3.641	40	0		CHABHN
CCCCOc1ccc(C(=O)CCN(CC)CC)cc1	ZINC000003068311	567932195	/nfs/dbraw/zinc/93/21/95/567932195.db2.gz	LPKOSRPOBBYLTA-UHFFFAOYSA-N	0	3	277.408	3.780	40	0		CHABHN
CC(C)[C@H](N)C(=O)N(C(C)C)[C@@H](C)c1cccc(Cl)c1	ZINC000079418690	570235143	/nfs/dbraw/zinc/23/51/43/570235143.db2.gz	HOUGXEVCNRRANU-WFASDCNBSA-N	0	3	296.842	3.621	40	0		CHABHN
CCCCn1c2ccc(Cl)cc2nc1[C@@H](C)N	ZINC000064874476	570392941	/nfs/dbraw/zinc/39/29/41/570392941.db2.gz	IHQLKRTWNIYTSQ-SECBINFHSA-N	0	3	251.761	3.510	40	0		CHABHN
COc1cc(OC2CCC(C)(C)CC2)c(F)cc1CN	ZINC000095802918	185028073	/nfs/dbraw/zinc/02/80/73/185028073.db2.gz	BKIQGJQEBQFKFM-UHFFFAOYSA-N	0	3	281.371	3.641	40	0		CHABHN
COc1cccc(OC)c1[C@H]1CCCCN1CC(C)C	ZINC000072221440	256706612	/nfs/dbraw/zinc/70/66/12/256706612.db2.gz	WULYAXYJAFCRGZ-CQSZACIVSA-N	0	3	277.408	3.887	40	0		CHABHN
C[C@H](c1ccccc1)c1ccccc1OCCN(C)C	ZINC000006494459	170206818	/nfs/dbraw/zinc/20/68/18/170206818.db2.gz	PATHRCHITDYBRX-OAHLLOKOSA-N	0	3	269.388	3.779	40	0		CHABHN
CCCNCc1cc(Cl)cc(Cl)c1OCC	ZINC000007262336	170274456	/nfs/dbraw/zinc/27/44/56/170274456.db2.gz	RFJYQSPOMQLONX-UHFFFAOYSA-N	0	3	262.180	3.892	40	0		CHABHN
Brc1ccc(-c2ccc(CNC3CC3)o2)cc1	ZINC000007524941	170288735	/nfs/dbraw/zinc/28/87/35/170288735.db2.gz	CYFQSVCEBZOKDM-UHFFFAOYSA-N	0	3	292.176	3.961	40	0		CHABHN
COc1cc(CNC2CC2)ccc1OCc1ccc(C)cc1	ZINC000008550126	170339452	/nfs/dbraw/zinc/33/94/52/170339452.db2.gz	KXYOMHYJIMULCK-UHFFFAOYSA-N	0	3	297.398	3.835	40	0		CHABHN
Cc1nn(C)c(C)c1CN[C@@H](C)c1ccc2c(c1)CCCC2	ZINC000008880136	170358160	/nfs/dbraw/zinc/35/81/60/170358160.db2.gz	XOXDIBPAIANJHB-ZDUSSCGKSA-N	0	3	297.446	3.767	40	0		CHABHN
CC(C)COc1ccc([C@H](C)NC[C@H]2CCCO2)cc1	ZINC000020092448	170991862	/nfs/dbraw/zinc/99/18/62/170991862.db2.gz	HZESBAYBKQOVNF-WMLDXEAASA-N	0	3	277.408	3.551	40	0		CHABHN
CNCc1ccc(-c2ccc(Cl)c(Cl)c2)o1	ZINC000020158551	171039966	/nfs/dbraw/zinc/03/99/66/171039966.db2.gz	DMMFHPJPBXAZPV-UHFFFAOYSA-N	0	3	256.132	3.973	40	0		CHABHN
Cc1sc2c([C@@H]3CCCN(C(C)C)C3)nc(C)n2c1C	ZINC000072367725	176382618	/nfs/dbraw/zinc/38/26/18/176382618.db2.gz	LWUDJBFLPAXBCU-CQSZACIVSA-N	0	3	291.464	3.909	40	0		CHABHN
CCN1CCC[C@H]1c1ccc(NC2CCCC2)nc1	ZINC000072213950	567918971	/nfs/dbraw/zinc/91/89/71/567918971.db2.gz	QEGUSAHYFCDTME-HNNXBMFYSA-N	0	3	259.397	3.593	40	0		CHABHN
CC[C@@H](C)Nc1ncccc1[C@H]1CCCN1C(C)C	ZINC000072213393	567919027	/nfs/dbraw/zinc/91/90/27/567919027.db2.gz	KLGIBIMDMHAGNL-UKRRQHHQSA-N	0	3	261.413	3.837	40	0		CHABHN
C[C@H]1CCCN([C@@H](CN)c2cccc(Cl)c2Cl)C1	ZINC000019806667	566880265	/nfs/dbraw/zinc/88/02/65/566880265.db2.gz	GKTKLFLXYDSQAX-GWCFXTLKSA-N	0	3	287.234	3.725	40	0		CHABHN
c1ccc(CN(CCN2CCCCC2)c2ccccn2)cc1	ZINC000001602367	567839514	/nfs/dbraw/zinc/83/95/14/567839514.db2.gz	AEFHEVVEKKHJHN-UHFFFAOYSA-N	0	3	295.430	3.574	40	0		CHABHN
CCN(CC)CCOC(=O)C1(CC(C)C)CCCCC1	ZINC000001719279	567842412	/nfs/dbraw/zinc/84/24/12/567842412.db2.gz	KWZXRLYIJVZVLX-UHFFFAOYSA-N	0	3	283.456	3.868	40	0		CHABHN
CC[C@@H]1[C@@H](O)C[C@H](c2ccccc2)N[C@@H]1c1ccccc1	ZINC000004119590	567855546	/nfs/dbraw/zinc/85/55/46/567855546.db2.gz	OKNRTYWYWMOJGO-AKHDSKFASA-N	0	3	281.399	3.849	40	0		CHABHN
Fc1ccc(C2CCN(Cc3cccnc3)CC2)cc1	ZINC000012113954	567862328	/nfs/dbraw/zinc/86/23/28/567862328.db2.gz	XURLKIVSAQCQLY-UHFFFAOYSA-N	0	3	270.351	3.600	40	0		CHABHN
COc1ccc(-c2cc([C@H]3CCCCCN3)no2)cc1	ZINC000012185175	567862423	/nfs/dbraw/zinc/86/24/23/567862423.db2.gz	SNDXHBVPZYXADZ-CQSZACIVSA-N	0	3	272.348	3.555	40	0		CHABHN
CN(C)Cc1c[nH]c2cccc(OCc3ccccc3)c12	ZINC000034091027	567886829	/nfs/dbraw/zinc/88/68/29/567886829.db2.gz	RRKLFSJBPYZCJV-UHFFFAOYSA-N	0	3	280.371	3.809	40	0	in-vitro	CHABHN
CC[C@H](N)c1cc2ccccc2n1C(=O)OC(C)(C)C	ZINC000096509789	567897452	/nfs/dbraw/zinc/89/74/52/567897452.db2.gz	ASFMTXUFPSDTNE-LBPRGKRZSA-N	0	3	274.364	3.834	40	0		CHABHN
COc1nc(-c2ccc(C)cc2)cc(C(F)(F)F)c1CN	ZINC000089263420	567907380	/nfs/dbraw/zinc/90/73/80/567907380.db2.gz	IVEJJAKDZKCMBX-UHFFFAOYSA-N	0	3	296.292	3.543	40	0		CHABHN
NCc1cnc(-c2ccc(Cl)cc2)cc1C(F)(F)F	ZINC000089261631	567907513	/nfs/dbraw/zinc/90/75/13/567907513.db2.gz	XYRJYQFJZQIRLC-UHFFFAOYSA-N	0	3	286.684	3.880	40	0		CHABHN
C([C@@H]1CO[C@@]2(CC[C@H]3CCCC[C@@H]3C2)O1)N1CCCCC1	ZINC000101120272	567914652	/nfs/dbraw/zinc/91/46/52/567914652.db2.gz	XBGMCAWJVPHBRD-TVFCKZIOSA-N	0	3	293.451	3.574	40	0		CHABHN
CCCCN1CCC[C@@H]1c1cccnc1NCCC	ZINC000072213139	567918267	/nfs/dbraw/zinc/91/82/67/567918267.db2.gz	QMZAOKKRICTAQZ-OAHLLOKOSA-N	0	3	261.413	3.841	40	0		CHABHN
CCNc1ccc([C@H]2CCCN2Cc2ccccc2)cn1	ZINC000072213064	567918343	/nfs/dbraw/zinc/91/83/43/567918343.db2.gz	WGKHQEBYJKKLFC-QGZVFWFLSA-N	0	3	281.403	3.851	40	0		CHABHN
CN1CCCC[C@@H]1c1ccc(NC(=O)OC(C)(C)C)nc1	ZINC000072214333	567919740	/nfs/dbraw/zinc/91/97/40/567919740.db2.gz	XAXNSOLNWQQLST-CYBMUJFWSA-N	0	3	291.395	3.585	40	0		CHABHN
CN(c1ccccc1)c1ccc([C@@H](N)c2ccccc2)cn1	ZINC000072225333	567922020	/nfs/dbraw/zinc/92/20/20/567922020.db2.gz	ILUBAKYXMAHTMH-IBGZPJMESA-N	0	3	289.382	3.898	40	0		CHABHN
COc1ccc2[nH]c3c(c2c1)CCN1C[C@H]2CCCC[C@H]2[C@@H]31	ZINC000004026529	567932422	/nfs/dbraw/zinc/93/24/22/567932422.db2.gz	HKCFIODYAGNXJQ-TVZGQMOCSA-N	0	3	296.414	3.896	40	0		CHABHN
C[C@@H](NC[C@@H]1CCCO1)c1ccc(OC2CCCC2)cc1	ZINC000225170384	567952611	/nfs/dbraw/zinc/95/26/11/567952611.db2.gz	GYUQTINHPPYZEQ-KDOFPFPSSA-N	0	3	289.419	3.838	40	0		CHABHN
C[C@H](NC[C@H]1CCCO1)c1cccc(OC2CCCC2)c1	ZINC000225167593	567952775	/nfs/dbraw/zinc/95/27/75/567952775.db2.gz	LRNVTYKREVBMEX-KBXCAEBGSA-N	0	3	289.419	3.838	40	0		CHABHN
CCCCOc1ccc([C@@H](C)NC[C@@H]2CCCO2)cc1	ZINC000225170229	567952813	/nfs/dbraw/zinc/95/28/13/567952813.db2.gz	SOKGFMQEYUVEBR-PBHICJAKSA-N	0	3	277.408	3.695	40	0		CHABHN
C[C@H](NC[C@H]1CCCO1)c1ccc(OC2CCCC2)cc1	ZINC000225170489	567952835	/nfs/dbraw/zinc/95/28/35/567952835.db2.gz	GYUQTINHPPYZEQ-KBXCAEBGSA-N	0	3	289.419	3.838	40	0		CHABHN
Cc1ccc(-n2cccc2CN2CCCCC2)cc1	ZINC000225309493	567953113	/nfs/dbraw/zinc/95/31/13/567953113.db2.gz	ATEHKEUPRGMGCE-UHFFFAOYSA-N	0	3	254.377	3.772	40	0		CHABHN
CCn1c(CNCc2ccccc2)ccc1Cc1ccco1	ZINC000226021656	567955351	/nfs/dbraw/zinc/95/53/51/567955351.db2.gz	IDVIOUCSAXUYLF-UHFFFAOYSA-N	0	3	294.398	3.982	40	0		CHABHN
COc1ccc(CNCc2ccc(CC(C)C)n2C)cc1	ZINC000226020248	567955369	/nfs/dbraw/zinc/95/53/69/567955369.db2.gz	IGVVCEOAVOGGNX-UHFFFAOYSA-N	0	3	286.419	3.522	40	0		CHABHN
CCCc1ccc(CNCc2ccc(OC)cc2)n1CC	ZINC000226020985	567955416	/nfs/dbraw/zinc/95/54/16/567955416.db2.gz	OYLZUWZVCXAMQV-UHFFFAOYSA-N	0	3	286.419	3.759	40	0		CHABHN
CCCCOc1ccccc1[C@@H](C)NC[C@@H]1CCCO1	ZINC000225162017	189744338	/nfs/dbraw/zinc/74/43/38/189744338.db2.gz	HIVCPSLTVHCDSA-CABCVRRESA-N	0	3	277.408	3.695	40	0		CHABHN
C[C@@H](NC[C@H]1CCCO1)c1cccc(OC2CCCC2)c1	ZINC000225167552	189744926	/nfs/dbraw/zinc/74/49/26/189744926.db2.gz	LRNVTYKREVBMEX-RDTXWAMCSA-N	0	3	289.419	3.838	40	0		CHABHN
CCN1CCCC[C@@H]1c1cnc(N2CCCCC2)c(C)c1	ZINC000072219176	256707042	/nfs/dbraw/zinc/70/70/42/256707042.db2.gz	GNGLWESGCAOIIN-QGZVFWFLSA-N	0	3	287.451	3.927	40	0		CHABHN
CCN1CCC[C@H]1c1cccnc1N(C(C)C)C(C)C	ZINC000072213008	256713567	/nfs/dbraw/zinc/71/35/67/256713567.db2.gz	KIWSFQSCLWRYQQ-INIZCTEOSA-N	0	3	275.440	3.862	40	0		CHABHN
CCN1CCC[C@@H]1c1cccnc1N(C(C)C)C(C)C	ZINC000072213007	256714343	/nfs/dbraw/zinc/71/43/43/256714343.db2.gz	KIWSFQSCLWRYQQ-MRXNPFEDSA-N	0	3	275.440	3.862	40	0		CHABHN
CC[C@@H](C)NCc1cc(Cl)cc(Cl)c1OC	ZINC000005907270	170153528	/nfs/dbraw/zinc/15/35/28/170153528.db2.gz	WITQPGCGTLZPGK-MRVPVSSYSA-N	0	3	262.180	3.890	40	0		CHABHN
Cc1ccc([C@H](CN(C)C)C(=O)c2ccccc2)cc1	ZINC000006522720	170209594	/nfs/dbraw/zinc/20/95/94/170209594.db2.gz	MTMMTHHYFQNUKN-KRWDZBQOSA-N	0	3	267.372	3.523	40	0		CHABHN
CCCNCc1ccc(-c2ccc(C(=O)OCC)cc2)o1	ZINC000007262389	170274404	/nfs/dbraw/zinc/27/44/04/170274404.db2.gz	GSMLPBHXEVZDGX-UHFFFAOYSA-N	0	3	287.359	3.623	40	0		CHABHN
CCOc1cc(CN[C@@H](C)c2ccccc2)ccc1OC	ZINC000008254366	170327506	/nfs/dbraw/zinc/32/75/06/170327506.db2.gz	KGBUIKSFEHSLDI-AWEZNQCLSA-N	0	3	285.387	3.945	40	0		CHABHN
CC1CCN([C@@H](CN)c2ccc(Cl)cc2Cl)CC1	ZINC000039142591	174164427	/nfs/dbraw/zinc/16/44/27/174164427.db2.gz	QAMHRNGQTWMTMW-AWEZNQCLSA-N	0	3	287.234	3.725	40	0		CHABHN
COc1cccc(-c2cccc([C@H]3CCCN(C)C3)n2)c1	ZINC000072348557	176373714	/nfs/dbraw/zinc/37/37/14/176373714.db2.gz	INNQXLRLCGSBCD-HNNXBMFYSA-N	0	3	282.387	3.566	40	0		CHABHN
Cc1cccc(-c2nccnc2C2CCN(C)CC2)c1C	ZINC000072365360	176380798	/nfs/dbraw/zinc/38/07/98/176380798.db2.gz	CBIAKWLZWOUMOV-UHFFFAOYSA-N	0	3	281.403	3.570	40	0		CHABHN
CC[C@H](C)Oc1ccc([C@H](C)NC[C@H]2CCCO2)cc1	ZINC000260571722	327856401	/nfs/dbraw/zinc/85/64/01/327856401.db2.gz	BHVLXDWIQYEEEP-GRDNDAEWSA-N	0	3	277.408	3.694	40	0		CHABHN
c1ccc(CN2CC[C@H](c3nc4ccccc4s3)C2)nc1	ZINC000049168952	560084909	/nfs/dbraw/zinc/08/49/09/560084909.db2.gz	MFJWGYFVAFNPDF-ZDUSSCGKSA-N	0	3	295.411	3.681	40	0	biogenic,in-vitro	CHABHN
C[C@@H]1CCCN([C@@H](CN)c2ccc(Cl)c(Cl)c2)C1	ZINC000020081650	567113186	/nfs/dbraw/zinc/11/31/86/567113186.db2.gz	QUIZRRFSKOTIJC-YGRLFVJLSA-N	0	3	287.234	3.725	40	0		CHABHN
Cc1ccc([C@@H](CN(C)C)C(=O)c2ccccc2)cc1	ZINC000001665769	567840712	/nfs/dbraw/zinc/84/07/12/567840712.db2.gz	MTMMTHHYFQNUKN-QGZVFWFLSA-N	0	3	267.372	3.523	40	0		CHABHN
CC1=C[C@H](C)[C@@H](CN2CCO[C@@H]2C(C)C)[C@H](C)C1	ZINC000002296810	567845645	/nfs/dbraw/zinc/84/56/45/567845645.db2.gz	ZINAYKAEPVIUEM-ZJIFWQFVSA-N	0	3	251.414	3.539	40	0		CHABHN
C([C@H]1CO[C@]2(CC[C@H]3CCCC[C@@H]3C2)O1)N1CCCCC1	ZINC000101120270	567914613	/nfs/dbraw/zinc/91/46/13/567914613.db2.gz	XBGMCAWJVPHBRD-ZJPYXAASSA-N	0	3	293.451	3.574	40	0		CHABHN
C([C@H]1CO[C@@]2(CC[C@H]3CCCC[C@@H]3C2)O1)N1CCCCC1	ZINC000101120275	567914684	/nfs/dbraw/zinc/91/46/84/567914684.db2.gz	XBGMCAWJVPHBRD-BDXSIMOUSA-N	0	3	293.451	3.574	40	0		CHABHN
CCOc1ncccc1[C@H]1CCCCN1CC(C)C	ZINC000072211862	567917889	/nfs/dbraw/zinc/91/78/89/567917889.db2.gz	ILNUDXWJUZUNGI-OAHLLOKOSA-N	0	3	262.397	3.663	40	0		CHABHN
CCN(CC)c1ccc([C@@H]2CCCCN2C(C)C)cn1	ZINC000072212856	567918552	/nfs/dbraw/zinc/91/85/52/567918552.db2.gz	QTLWPMIWGWHSRB-INIZCTEOSA-N	0	3	275.440	3.863	40	0		CHABHN
CC(C)N1CCCC[C@@H]1c1ccc(NC2CCC2)nc1	ZINC000072213858	567918750	/nfs/dbraw/zinc/91/87/50/567918750.db2.gz	YCIFGKQBDORCGC-MRXNPFEDSA-N	0	3	273.424	3.981	40	0		CHABHN
CCCCN1CCCC[C@@H]1c1cccnc1NC1CC1	ZINC000072213742	567918791	/nfs/dbraw/zinc/91/87/91/567918791.db2.gz	SAGIRACAGZQNDB-MRXNPFEDSA-N	0	3	273.424	3.983	40	0		CHABHN
CCN1CCCC[C@H]1c1ccc(NC2CCC2)nc1	ZINC000072213855	567919141	/nfs/dbraw/zinc/91/91/41/567919141.db2.gz	YNSLOTZERRBIHA-HNNXBMFYSA-N	0	3	259.397	3.593	40	0		CHABHN
c1cnc(NC2CCCCC2)c([C@H]2CCCCN2)c1	ZINC000072214031	567919538	/nfs/dbraw/zinc/91/95/38/567919538.db2.gz	LOFUKWMDHHUUGW-OAHLLOKOSA-N	0	3	259.397	3.641	40	0		CHABHN
CCCCN1CCC[C@@H]1c1cnc(Cl)cc1C	ZINC000072217845	567920736	/nfs/dbraw/zinc/92/07/36/567920736.db2.gz	XLJFJBKWYUYPCV-CYBMUJFWSA-N	0	3	252.789	3.980	40	0		CHABHN
CNc1cc(C)c([C@@H]2CCCN2Cc2ccccc2)cn1	ZINC000072219029	567921724	/nfs/dbraw/zinc/92/17/24/567921724.db2.gz	JIKHSVKCPHDXPW-KRWDZBQOSA-N	0	3	281.403	3.769	40	0		CHABHN
Cc1cc([C@@H](N)c2ccccc2)cnc1NC(C)(C)C	ZINC000072222937	567922217	/nfs/dbraw/zinc/92/22/17/567922217.db2.gz	LTWPMTCFBIOUAR-HNNXBMFYSA-N	0	3	269.392	3.649	40	0		CHABHN
COc1ccc2nc(Cl)c(CNC3CCCC3)cc2c1	ZINC000004436372	567932507	/nfs/dbraw/zinc/93/25/07/567932507.db2.gz	IGLSEDAKZNSEGN-UHFFFAOYSA-N	0	3	290.794	3.929	40	0		CHABHN
CCOC(=O)CN(C1CCCCC1)C1CCCCC1	ZINC000002035974	567937569	/nfs/dbraw/zinc/93/75/69/567937569.db2.gz	YFNGCKXAIRGJTA-UHFFFAOYSA-N	0	3	267.413	3.517	40	0		CHABHN
CCCCOc1ccc([C@H](C)NC[C@H]2CCCO2)cc1	ZINC000225170339	567952763	/nfs/dbraw/zinc/95/27/63/567952763.db2.gz	SOKGFMQEYUVEBR-WMLDXEAASA-N	0	3	277.408	3.695	40	0		CHABHN
CCCCn1c2ccc(Cl)cc2nc1[C@H](C)N	ZINC000064874477	570392877	/nfs/dbraw/zinc/39/28/77/570392877.db2.gz	IHQLKRTWNIYTSQ-VIFPVBQESA-N	0	3	251.761	3.510	40	0		CHABHN
N=C(N)c1c(Cl)c(Cl)cc(Cl)c1Cl	ZINC000199742559	1118697053	/nfs/dbraw/zinc/69/70/53/1118697053.db2.gz	BYSXBNWXLMHYRE-UHFFFAOYSA-N	0	3	257.935	3.584	40	0		CHABHN
C[C@@H](NC[C@H]1CCCO1)c1ccccc1OC1CCCC1	ZINC000225162280	189744413	/nfs/dbraw/zinc/74/44/13/189744413.db2.gz	RDERECKJMXNEPY-GDBMZVCRSA-N	0	3	289.419	3.838	40	0		CHABHN
C([C@H]1CO[C@@]2(CC[C@@H]3CCCC[C@@H]3C2)O1)N1CCCCC1	ZINC000004713523	170003510	/nfs/dbraw/zinc/00/35/10/170003510.db2.gz	XBGMCAWJVPHBRD-MHORFTMASA-N	0	3	293.451	3.574	40	0		CHABHN
Cc1ccc([C@H]2CN(C)CC[C@]2(O)c2ccc(C)cc2)cc1	ZINC000004963709	170045935	/nfs/dbraw/zinc/04/59/35/170045935.db2.gz	BVTSSYHMGQTDKX-UXHICEINSA-N	0	3	295.426	3.610	40	0		CHABHN
COc1c(Cl)cc(Cl)cc1CNC(C)(C)C	ZINC000005817168	170142952	/nfs/dbraw/zinc/14/29/52/170142952.db2.gz	UCXVNBOODSBJON-UHFFFAOYSA-N	0	3	262.180	3.890	40	0		CHABHN
CCOc1cc(CN[C@H](C)c2ccccc2)ccc1OC	ZINC000008254368	170327427	/nfs/dbraw/zinc/32/74/27/170327427.db2.gz	KGBUIKSFEHSLDI-CQSZACIVSA-N	0	3	285.387	3.945	40	0		CHABHN
COc1ccc(Cl)cc1CNCCc1ccc(F)cc1	ZINC000022076430	171352009	/nfs/dbraw/zinc/35/20/09/171352009.db2.gz	CMMWGALIYNONJL-UHFFFAOYSA-N	0	3	293.769	3.820	40	0		CHABHN
CN(C)Cc1cn(-c2ccccc2)nc1-c1cccs1	ZINC000072238806	176347310	/nfs/dbraw/zinc/34/73/10/176347310.db2.gz	WCBXDBDMOKDCJS-UHFFFAOYSA-N	0	3	283.400	3.662	40	0		CHABHN
CC(C)CN1CCC[C@H]1c1ccc(OC(C)C)nc1	ZINC000072211903	567917468	/nfs/dbraw/zinc/91/74/68/567917468.db2.gz	POQNGYIIPFTQAI-HNNXBMFYSA-N	0	3	262.397	3.662	40	0		CHABHN
Cc1nc(Cl)ccc1[C@@H]1CCCCN1C(C)C	ZINC000072217920	567920718	/nfs/dbraw/zinc/92/07/18/567920718.db2.gz	BNUMWGABLJBQDM-ZDUSSCGKSA-N	0	3	252.789	3.979	40	0		CHABHN
C[C@@H]1CCCN([C@@H](CN)c2ccc(Cl)cc2Cl)C1	ZINC000020081646	567112797	/nfs/dbraw/zinc/11/27/97/567112797.db2.gz	UJGDOGDFIJTPLX-YGRLFVJLSA-N	0	3	287.234	3.725	40	0		CHABHN
CCN(CC)C[C@H](Oc1ccccc1)C(=O)c1ccccc1	ZINC000001648434	567839937	/nfs/dbraw/zinc/83/99/37/567839937.db2.gz	QZQSOAHZXPHQCZ-SFHVURJKSA-N	0	3	297.398	3.659	40	0		CHABHN
Cc1ccc(C(C)C)cc1[C@@H](O)CN1CCCCC1	ZINC000001667135	567840730	/nfs/dbraw/zinc/84/07/30/567840730.db2.gz	KYZKBGNXPBDDHT-KRWDZBQOSA-N	0	3	261.409	3.638	40	0		CHABHN
O=C(CCN1CCCCC1)c1csc2ccccc12	ZINC000001701087	567842053	/nfs/dbraw/zinc/84/20/53/567842053.db2.gz	IVQOCTZDCXKGHW-UHFFFAOYSA-N	0	3	273.401	3.960	40	0	in-vitro	CHABHN
Cc1ccc([C@@H]2CN(C)CC[C@]2(O)c2ccc(C)cc2)cc1	ZINC000001719766	567842318	/nfs/dbraw/zinc/84/23/18/567842318.db2.gz	BVTSSYHMGQTDKX-PMACEKPBSA-N	0	3	295.426	3.610	40	0		CHABHN
C[C@@H]1C(O)[C@@H](C)[C@@H](c2ccccc2)N[C@H]1c1ccccc1	ZINC000004119585	567855478	/nfs/dbraw/zinc/85/54/78/567855478.db2.gz	GGCLDJYYOISOSI-HMWCEDEHSA-N	0	3	281.399	3.705	40	0		CHABHN
CCCn1c(/C=C/C2=CCN(C)CC2)nc2ccccc21	ZINC000012115900	567862385	/nfs/dbraw/zinc/86/23/85/567862385.db2.gz	DJKCLFVTIYZPRJ-CMDGGOBGSA-N	0	3	281.403	3.721	40	0		CHABHN
Cc1ccc2[nH]c(=O)c(CN[C@H](C)c3ccccc3)cc2c1	ZINC000013998778	567912917	/nfs/dbraw/zinc/91/29/17/567912917.db2.gz	GBFWEBZFSUQTBA-CQSZACIVSA-N	0	3	292.382	3.687	40	0		CHABHN
Cc1ncccc1[C@H]1CCCN1Cc1ccccc1	ZINC000072211281	567917899	/nfs/dbraw/zinc/91/78/99/567917899.db2.gz	AQBUYNFMAJUPBL-QGZVFWFLSA-N	0	3	252.361	3.727	40	0		CHABHN
CCN(C)c1ncccc1[C@@H]1CCCN1Cc1ccccc1	ZINC000072212765	567918047	/nfs/dbraw/zinc/91/80/47/567918047.db2.gz	TXDISWLOLSHQDY-SFHVURJKSA-N	0	3	295.430	3.875	40	0		CHABHN
CCN1CCC[C@@H]1c1ccc(OCc2ccccc2)nc1	ZINC000072212010	567918191	/nfs/dbraw/zinc/91/81/91/567918191.db2.gz	NAWKIGLSDYEGQW-QGZVFWFLSA-N	0	3	282.387	3.817	40	0		CHABHN
CN1CCC[C@@H]1c1ccc(Oc2ccccc2)nc1	ZINC000072212124	567918416	/nfs/dbraw/zinc/91/84/16/567918416.db2.gz	HHESBKMRILLWOC-OAHLLOKOSA-N	0	3	254.333	3.641	40	0		CHABHN
CCN(CC)c1ncccc1[C@@H]1CCCCN1C(C)C	ZINC000072212916	567918504	/nfs/dbraw/zinc/91/85/04/567918504.db2.gz	JUEIRAGVQPAVOU-INIZCTEOSA-N	0	3	275.440	3.863	40	0		CHABHN
CC(C)CN1CCC[C@@H]1c1cccnc1OC(C)C	ZINC000072211962	567918596	/nfs/dbraw/zinc/91/85/96/567918596.db2.gz	FRCYRFSDMRZTJJ-OAHLLOKOSA-N	0	3	262.397	3.662	40	0		CHABHN
CCN1CCCC[C@@H]1c1cccnc1NC1CCC1	ZINC000072213914	567918816	/nfs/dbraw/zinc/91/88/16/567918816.db2.gz	QIQPXMKILYEWBF-OAHLLOKOSA-N	0	3	259.397	3.593	40	0		CHABHN
CCCCN1CCC[C@@H]1c1cccnc1NC1CCC1	ZINC000072213903	567918918	/nfs/dbraw/zinc/91/89/18/567918918.db2.gz	ULRGLZRRGOLEMO-MRXNPFEDSA-N	0	3	273.424	3.983	40	0		CHABHN
CCN1CCCC[C@H]1c1ccc(NC2CCCC2)nc1	ZINC000072213975	567919068	/nfs/dbraw/zinc/91/90/68/567919068.db2.gz	ONIVZYZQKWPHHG-INIZCTEOSA-N	0	3	273.424	3.983	40	0		CHABHN
CCN1CCC[C@H]1c1ccc(NC(=O)OC(C)(C)C)nc1	ZINC000072214310	567919484	/nfs/dbraw/zinc/91/94/84/567919484.db2.gz	JYMVNBAHLKECBD-ZDUSSCGKSA-N	0	3	291.395	3.585	40	0		CHABHN
CCCN1CCCC[C@@H]1c1ccc(N2CCCC2)nc1	ZINC000072215940	567920252	/nfs/dbraw/zinc/92/02/52/567920252.db2.gz	BDRMMKLYWLGGIK-MRXNPFEDSA-N	0	3	273.424	3.619	40	0		CHABHN
COc1ncc([C@@H]2CCCCN2CC(C)C)cc1C	ZINC000072217743	567920639	/nfs/dbraw/zinc/92/06/39/567920639.db2.gz	RJJOSEROBQVSAB-HNNXBMFYSA-N	0	3	262.397	3.582	40	0		CHABHN
CCCN1CCCC[C@H]1c1ccc(N2CCCC2)nc1	ZINC000072215941	567920786	/nfs/dbraw/zinc/92/07/86/567920786.db2.gz	BDRMMKLYWLGGIK-INIZCTEOSA-N	0	3	273.424	3.619	40	0		CHABHN
Cc1nc(N2CCCCC2)ccc1[C@H]1CCCCN1C	ZINC000072219295	567921685	/nfs/dbraw/zinc/92/16/85/567921685.db2.gz	UYHMXXMEPCPVBC-MRXNPFEDSA-N	0	3	273.424	3.537	40	0		CHABHN
Cc1cc([C@H]2CCCCN2C)cnc1N1CCCCC1	ZINC000072219175	567921889	/nfs/dbraw/zinc/92/18/89/567921889.db2.gz	NCUPKNJPVVDCFO-MRXNPFEDSA-N	0	3	273.424	3.537	40	0		CHABHN
CCCCOc1ccccc1[C@H](C)NC[C@H]1CCCO1	ZINC000225162137	567952355	/nfs/dbraw/zinc/95/23/55/567952355.db2.gz	HIVCPSLTVHCDSA-LSDHHAIUSA-N	0	3	277.408	3.695	40	0		CHABHN
C[C@@H](NC[C@H]1CCCO1)c1ccc(OC2CCCC2)cc1	ZINC000225170458	567952709	/nfs/dbraw/zinc/95/27/09/567952709.db2.gz	GYUQTINHPPYZEQ-RDTXWAMCSA-N	0	3	289.419	3.838	40	0		CHABHN
CC(C)Cc1ccc(CNCc2ccccc2)n1C	ZINC000226020233	567955560	/nfs/dbraw/zinc/95/55/60/567955560.db2.gz	CCYUNOORNWRETN-UHFFFAOYSA-N	0	3	256.393	3.513	40	0		CHABHN
CCN(CC)CCOC(=O)C[C@@H](C)c1cc(C)ccc1C	ZINC000255190705	570323286	/nfs/dbraw/zinc/32/32/86/570323286.db2.gz	YXNWRLYGRLVNMZ-MRXNPFEDSA-N	0	3	291.435	3.682	40	0		CHABHN
CC(C)[C@@H]1COC2(C1)CCN(Cc1cccs1)CC2	ZINC000096047899	185073164	/nfs/dbraw/zinc/07/31/64/185073164.db2.gz	QPMSFUGQSTYCKY-AWEZNQCLSA-N	0	3	279.449	3.775	40	0		CHABHN
Cc1nc(Cl)ccc1[C@@H]1CCCN1CC(C)C	ZINC000072217903	256709451	/nfs/dbraw/zinc/70/94/51/256709451.db2.gz	PXAMAPUTXROFOZ-ZDUSSCGKSA-N	0	3	252.789	3.836	40	0		CHABHN
CSc1ccc([C@H]2CCCCN2CC(C)C)cn1	ZINC000072216903	256710670	/nfs/dbraw/zinc/71/06/70/256710670.db2.gz	ODKADYXKFLWGLT-CQSZACIVSA-N	0	3	264.438	3.987	40	0		CHABHN
CC1(O)C[C@H](c2ccccc2)N[C@H](c2ccccc2)C1	ZINC000004889361	170036468	/nfs/dbraw/zinc/03/64/68/170036468.db2.gz	GPNLJAZAPSEYDT-JWTNVVGKSA-N	0	3	267.372	3.603	40	0		CHABHN
Cc1[nH]c2c(C)c(Cl)ccc2c(=O)c1CN1CCCC1	ZINC000005687130	170129145	/nfs/dbraw/zinc/12/91/45/170129145.db2.gz	NMVXLKPEQJFIJB-UHFFFAOYSA-N	0	3	290.794	3.806	40	0		CHABHN
Cc1cc(C)c(NC(=O)[C@H]2CCCN2CC(C)C)c(C)c1	ZINC000005697538	170130471	/nfs/dbraw/zinc/13/04/71/170130471.db2.gz	SHQXUKQYDKBFSW-MRXNPFEDSA-N	0	3	288.435	3.671	40	0		CHABHN
CCCNCc1ccccc1OCc1ccccc1	ZINC000006430993	170200784	/nfs/dbraw/zinc/20/07/84/170200784.db2.gz	DOTQVYCNQKHGAJ-UHFFFAOYSA-N	0	3	255.361	3.765	40	0		CHABHN
CCOCCCNCc1cccc(Cl)c1Cl	ZINC000008253200	170326968	/nfs/dbraw/zinc/32/69/68/170326968.db2.gz	BJQPRAISPXEGID-UHFFFAOYSA-N	0	3	262.180	3.510	40	0		CHABHN
CC[C@@H](C)n1c2ccc(Cl)cc2nc1[C@@H](C)N	ZINC000040408267	174254049	/nfs/dbraw/zinc/25/40/49/174254049.db2.gz	UTULRFIGBDTCCG-RKDXNWHRSA-N	0	3	251.761	3.680	40	0		CHABHN
CN1CCC[C@H](c2cccc(Cc3ccccc3F)n2)C1	ZINC000072348569	176373894	/nfs/dbraw/zinc/37/38/94/176373894.db2.gz	AVNFRMNLXUIGIJ-HNNXBMFYSA-N	0	3	284.378	3.621	40	0		CHABHN
C[C@@H](NC(C)(C)C)C(=O)c1ccc(Cl)c(Cl)c1	ZINC000041610006	566842732	/nfs/dbraw/zinc/84/27/32/566842732.db2.gz	MXUDEADPGZWZCH-MRVPVSSYSA-N	0	3	274.191	3.953	40	0	in-vivo	CHABHN
CCCCN1CCC[C@@H]1c1cc(OC)ccc1OC	ZINC000057621209	566843878	/nfs/dbraw/zinc/84/38/78/566843878.db2.gz	YUEUWBBCKUTPEO-OAHLLOKOSA-N	0	3	263.381	3.641	40	0		CHABHN
c1ccc(-c2ccc(-c3noc4c3CNCC4)cc2)cc1	ZINC000019200223	566941876	/nfs/dbraw/zinc/94/18/76/566941876.db2.gz	NDUPVZLQAFWMNS-UHFFFAOYSA-N	0	3	276.339	3.654	40	0		CHABHN
N[C@H](Cc1nc(-c2ccc(Cl)cc2)no1)c1ccccc1	ZINC000021015761	567136051	/nfs/dbraw/zinc/13/60/51/567136051.db2.gz	BIXMJSZZOSNAGV-CQSZACIVSA-N	0	3	299.761	3.633	40	0		CHABHN
CN(C)Cc1c[nH]c2cc(OCc3ccccc3)ccc12	ZINC000001598256	567838917	/nfs/dbraw/zinc/83/89/17/567838917.db2.gz	ARPLSLHBKDIBNO-UHFFFAOYSA-N	0	3	280.371	3.809	40	0		CHABHN
CC(C)N(C(=O)c1ccccc1-c1cnccc1N)C(C)C	ZINC000002540023	567847827	/nfs/dbraw/zinc/84/78/27/567847827.db2.gz	KRDXCIKACUMFSP-UHFFFAOYSA-N	0	3	297.402	3.590	40	0		CHABHN
CCOc1cc2c(cc1OC)CCN(C)[C@H]2CC(C)C	ZINC000003847398	567853995	/nfs/dbraw/zinc/85/39/95/567853995.db2.gz	SVKASDAOKTXBIR-HNNXBMFYSA-N	0	3	277.408	3.669	40	0		CHABHN
Cc1cccc(CN2CC[C@H](c3nc(C(C)(C)C)no3)C2)c1	ZINC000019234947	567877177	/nfs/dbraw/zinc/87/71/77/567877177.db2.gz	WHZHZJXFJUHVRH-HNNXBMFYSA-N	0	3	299.418	3.665	40	0		CHABHN
CCOc1cc(Cl)c(CNC(C)C)cc1OCC	ZINC000013915577	567892469	/nfs/dbraw/zinc/89/24/69/567892469.db2.gz	MIPBWPUTKZQORI-UHFFFAOYSA-N	0	3	271.788	3.635	40	0		CHABHN
CCCN1CC=C(c2nc3cc(C)ccc3o2)CC1	ZINC000073636259	567892965	/nfs/dbraw/zinc/89/29/65/567892965.db2.gz	RXCVLBISAKMHEZ-UHFFFAOYSA-N	0	3	256.349	3.635	40	0		CHABHN
CCCN1CC=C(c2nc3cc(C)c(C)cc3o2)CC1	ZINC000073636273	567893140	/nfs/dbraw/zinc/89/31/40/567893140.db2.gz	HWKILRNTHYKZSE-UHFFFAOYSA-N	0	3	270.376	3.944	40	0		CHABHN
Cc1cccc([C@@H]2CCCN2Cc2ccccc2)n1	ZINC000072211067	567917676	/nfs/dbraw/zinc/91/76/76/567917676.db2.gz	POHOSRLWZRWRET-KRWDZBQOSA-N	0	3	252.361	3.727	40	0		CHABHN
CC(C)CN1CCCC[C@H]1c1ccc(Cl)nc1	ZINC000072211466	567917802	/nfs/dbraw/zinc/91/78/02/567917802.db2.gz	NXMZQKFCVOUEDO-ZDUSSCGKSA-N	0	3	252.789	3.918	40	0		CHABHN
CC(C)Oc1ncccc1[C@H]1CCCCN1C(C)C	ZINC000072211979	567918525	/nfs/dbraw/zinc/91/85/25/567918525.db2.gz	BEMMMKCMKCGQSW-OAHLLOKOSA-N	0	3	262.397	3.804	40	0		CHABHN
CN1CCCC[C@H]1c1ccc(NC(=O)OC(C)(C)C)nc1	ZINC000072214332	567919860	/nfs/dbraw/zinc/91/98/60/567919860.db2.gz	XAXNSOLNWQQLST-ZDUSSCGKSA-N	0	3	291.395	3.585	40	0		CHABHN
CCCN1CCC[C@H]1c1ccc(SCC)nc1	ZINC000072217123	567921426	/nfs/dbraw/zinc/92/14/26/567921426.db2.gz	HTKYFDSUNVNCOG-ZDUSSCGKSA-N	0	3	250.411	3.741	40	0		CHABHN
N[C@@H](c1ccccc1)c1ccc(Nc2ccccc2)nc1	ZINC000072225310	567922328	/nfs/dbraw/zinc/92/23/28/567922328.db2.gz	OVHTVYYKRMZLTA-SFHVURJKSA-N	0	3	275.355	3.873	40	0		CHABHN
COc1cc(CNC2CC2)ccc1OCc1cccc(C)c1	ZINC000016349274	567944542	/nfs/dbraw/zinc/94/45/42/567944542.db2.gz	POKSQEUNXFIQNR-UHFFFAOYSA-N	0	3	297.398	3.835	40	0		CHABHN
CC[C@H](C)Oc1ccccc1[C@@H](C)NCCCOC	ZINC000225161690	567952512	/nfs/dbraw/zinc/95/25/12/567952512.db2.gz	RVPYOISYUKKLEQ-UONOGXRCSA-N	0	3	265.397	3.551	40	0		CHABHN
CC[C@@H](C)Oc1ccc([C@@H](C)NC[C@@H]2CCCO2)cc1	ZINC000225170553	567952699	/nfs/dbraw/zinc/95/26/99/567952699.db2.gz	BHVLXDWIQYEEEP-CPUCHLNUSA-N	0	3	277.408	3.694	40	0		CHABHN
Cc1cc(NC(=O)Nc2cccc3ccccc32)n[nH]1	ZINC000006412800	170199643	/nfs/dbraw/zinc/19/96/43/170199643.db2.gz	RGCFYSNTXQIOMF-UHFFFAOYSA-N	0	3	266.304	3.515	40	0		CHABHN
C[C@H]1C[C@H](C)CN(Cc2ccc(N)cc2Br)C1	ZINC000037515908	173247320	/nfs/dbraw/zinc/24/73/20/173247320.db2.gz	DYZRRTDXJJNUOE-QWRGUYRKSA-N	0	3	297.240	3.509	40	0		CHABHN
CC[C@H](C)n1c2ccc(Cl)cc2nc1[C@@H](C)N	ZINC000040408270	174254199	/nfs/dbraw/zinc/25/41/99/174254199.db2.gz	UTULRFIGBDTCCG-DTWKUNHWSA-N	0	3	251.761	3.680	40	0		CHABHN
CN1CCC[C@H](c2cnc(-c3ccccc3Cl)cn2)C1	ZINC000072382918	176388460	/nfs/dbraw/zinc/38/84/60/176388460.db2.gz	HGACKBMYPPLRHE-LBPRGKRZSA-N	0	3	287.794	3.606	40	0		CHABHN
CCC[C@H](NCc1cnc(NCC)nc1)c1ccccc1	ZINC000062717559	333175746	/nfs/dbraw/zinc/17/57/46/333175746.db2.gz	OERWXDBLCLMWAV-INIZCTEOSA-N	0	3	284.407	3.539	40	0		CHABHN
CCC[C@@](C)(C(=O)c1ccccc1)N1CCCCC1	ZINC000002042015	567844576	/nfs/dbraw/zinc/84/45/76/567844576.db2.gz	GTOCZCPMZCJJJG-KRWDZBQOSA-N	0	3	259.393	3.914	40	0		CHABHN
CCOP(=O)(OCC)C(F)(F)[C@@H](N)c1ccccc1	ZINC000095637458	567909396	/nfs/dbraw/zinc/90/93/96/567909396.db2.gz	VOMXDASMZHCKAZ-NSHDSACASA-N	0	3	293.250	3.545	40	0		CHABHN
Cc1ccc(CN(Cc2sccc2C)C[C@H](C)O)s1	ZINC000013991518	567912225	/nfs/dbraw/zinc/91/22/25/567912225.db2.gz	GZLALKNPGIAFGK-LBPRGKRZSA-N	0	3	295.473	3.809	40	0		CHABHN
C[C@@H](CN1[C@@H](C)CCC[C@@H]1C)OC(=O)c1cccc(F)c1	ZINC000012342211	567073398	/nfs/dbraw/zinc/07/33/98/567073398.db2.gz	UBNHRPVZGCZIMM-IHRRRGAJSA-N	0	3	293.382	3.634	40	0		CHABHN
CCC(C(=O)CCN(C)C)(c1ccccc1)c1ccccc1	ZINC000001593250	567839040	/nfs/dbraw/zinc/83/90/40/567839040.db2.gz	XBBAATZGISSKRH-UHFFFAOYSA-N	0	3	295.426	3.904	40	0		CHABHN
OC1(CCN(Cc2ccccc2)Cc2ccccc2)CC1	ZINC000115324632	567916104	/nfs/dbraw/zinc/91/61/04/567916104.db2.gz	VXKDQBUZSZGESV-UHFFFAOYSA-N	0	3	281.399	3.604	40	0		CHABHN
CCCN1CCCC[C@@H]1c1ccc(OC(C)C)nc1	ZINC000072211917	567917911	/nfs/dbraw/zinc/91/79/11/567917911.db2.gz	FAXOELMBIDKOOE-OAHLLOKOSA-N	0	3	262.397	3.806	40	0		CHABHN
CCCCN1CCCC[C@@H]1c1cccnc1N(C)CC	ZINC000072212800	567918101	/nfs/dbraw/zinc/91/81/01/567918101.db2.gz	HBOBUTOYRPXWQG-MRXNPFEDSA-N	0	3	275.440	3.865	40	0		CHABHN
CCCCNc1ccc([C@@H]2CCCCN2CC)cn1	ZINC000072213674	567918744	/nfs/dbraw/zinc/91/87/44/567918744.db2.gz	MBMDAUZLYVOHAX-HNNXBMFYSA-N	0	3	261.413	3.841	40	0		CHABHN
CCCCNc1ncccc1[C@@H]1CCCN1CCC	ZINC000072213599	567918863	/nfs/dbraw/zinc/91/88/63/567918863.db2.gz	KFHDIJORTGABBT-HNNXBMFYSA-N	0	3	261.413	3.841	40	0		CHABHN
CC(C)N1CCCC[C@H]1c1cccnc1NC1CCC1	ZINC000072213919	567919296	/nfs/dbraw/zinc/91/92/96/567919296.db2.gz	JEQSLBQJRUUSGE-INIZCTEOSA-N	0	3	273.424	3.981	40	0		CHABHN
CCCN1CCCC[C@H]1c1ccc(Cl)nc1C	ZINC000072217919	567920435	/nfs/dbraw/zinc/92/04/35/567920435.db2.gz	LHNPETNSBCQQIC-ZDUSSCGKSA-N	0	3	252.789	3.980	40	0		CHABHN
Cc1cc([C@@H]2CCCCN2C(C)C)cnc1N1CCCC1	ZINC000072218820	567921580	/nfs/dbraw/zinc/92/15/80/567921580.db2.gz	UEMCCGXZFJMUHD-KRWDZBQOSA-N	0	3	287.451	3.926	40	0		CHABHN
CCN1CCCC[C@@H]1c1cnc(N2CCCC2)c(C)c1	ZINC000072218816	567921680	/nfs/dbraw/zinc/92/16/80/567921680.db2.gz	GQWRDJAZQAGEKG-MRXNPFEDSA-N	0	3	273.424	3.537	40	0		CHABHN
Cc1cc(N2CCCCC2)ncc1[C@@H]1CCCCN1C	ZINC000072219234	567921923	/nfs/dbraw/zinc/92/19/23/567921923.db2.gz	QAIJQHZQPHXPMR-INIZCTEOSA-N	0	3	273.424	3.537	40	0		CHABHN
N[C@@H](c1ccccc1)c1ccc(NCc2ccccc2)nc1	ZINC000072225356	567922225	/nfs/dbraw/zinc/92/22/25/567922225.db2.gz	UOROBKBCBIDAJN-IBGZPJMESA-N	0	3	289.382	3.742	40	0		CHABHN
COc1cccc(OC)c1[C@H]1CCCCN1C(C)C	ZINC000072221438	567922358	/nfs/dbraw/zinc/92/23/58/567922358.db2.gz	ONHLCMCKRGYGHY-CYBMUJFWSA-N	0	3	263.381	3.639	40	0		CHABHN
Cc1cc(N2CCCCCC2)ncc1[C@@H](N)c1ccccc1	ZINC000072223535	567922577	/nfs/dbraw/zinc/92/25/77/567922577.db2.gz	BOTWKVCGEBSPQX-IBGZPJMESA-N	0	3	295.430	3.819	40	0		CHABHN
CC(C)COc1cccc([C@@H](C)NC[C@H]2CCCO2)c1	ZINC000225167720	567952755	/nfs/dbraw/zinc/95/27/55/567952755.db2.gz	BDFLIQKTEPIHFU-RHSMWYFYSA-N	0	3	277.408	3.551	40	0		CHABHN
CCCc1ccc(CNCc2ccccc2)n1CC	ZINC000226020972	567955458	/nfs/dbraw/zinc/95/54/58/567955458.db2.gz	RGKPRYLEYWYFIM-UHFFFAOYSA-N	0	3	256.393	3.750	40	0		CHABHN
C=Cn1ccc2c1C[C@H]1CC[C@@H]2N1Cc1ccccc1	ZINC000013568933	570284750	/nfs/dbraw/zinc/28/47/50/570284750.db2.gz	FAIWHDAYVNRBGS-WBVHZDCISA-N	0	3	264.372	3.850	40	0		CHABHN
CC(C)N(c1ncccc1[C@@H]1CCCCN1)C(C)C	ZINC000072213028	256713795	/nfs/dbraw/zinc/71/37/95/256713795.db2.gz	WYPPABJRQGMXLY-HNNXBMFYSA-N	0	3	261.413	3.519	40	0		CHABHN
C[C@H]1C(O)[C@@H](C)[C@@H](c2ccccc2)N[C@H]1c1ccccc1	ZINC000004119584	169935195	/nfs/dbraw/zinc/93/51/95/169935195.db2.gz	GGCLDJYYOISOSI-WADNOCCSSA-N	0	3	281.399	3.705	40	0		CHABHN
NC1(c2ccccc2)c2ccccc2-c2ccccc21	ZINC000004777892	170015309	/nfs/dbraw/zinc/01/53/09/170015309.db2.gz	BAFVNIPRLVNQKZ-UHFFFAOYSA-N	0	3	257.336	3.918	40	0		CHABHN
Cc1cc2ccccc2nc1SCCN1CCCC1	ZINC000004858628	170031607	/nfs/dbraw/zinc/03/16/07/170031607.db2.gz	GNSKSDORBKQBTM-UHFFFAOYSA-N	0	3	272.417	3.731	40	0		CHABHN
C[C@@H]1C[C@H](C)CN(Cc2ccc(N)cc2Br)C1	ZINC000037515907	173247725	/nfs/dbraw/zinc/24/77/25/173247725.db2.gz	DYZRRTDXJJNUOE-PHIMTYICSA-N	0	3	297.240	3.509	40	0		CHABHN
Cc1ccc(Cc2cccc([C@@H]3CCCN3C)n2)cc1	ZINC000072357509	176376267	/nfs/dbraw/zinc/37/62/67/176376267.db2.gz	NTRRQRSESHIGMA-SFHVURJKSA-N	0	3	266.388	3.748	40	0		CHABHN
CCCN1CCC[C@H]1c1cccnc1N[C@@H](C)CC	ZINC000072213396	567919150	/nfs/dbraw/zinc/91/91/50/567919150.db2.gz	NORPIJXUDNAOFT-ZFWWWQNUSA-N	0	3	261.413	3.839	40	0		CHABHN
CC1CCN(CCC(=O)c2ccc(Cl)cc2)CC1	ZINC000001598703	567839103	/nfs/dbraw/zinc/83/91/03/567839103.db2.gz	KLCBGXAILJWLMK-UHFFFAOYSA-N	0	3	265.784	3.645	40	0		CHABHN
c1c2cccnc2[nH]c1[C@@H]1CCCN1Cc1ccccc1	ZINC000019372000	567878128	/nfs/dbraw/zinc/87/81/28/567878128.db2.gz	OGHBOGBOSGIMDF-KRWDZBQOSA-N	0	3	277.371	3.900	40	0		CHABHN
CCCN1CC=C(c2nc3ccc(C)cc3o2)CC1	ZINC000073636323	567893294	/nfs/dbraw/zinc/89/32/94/567893294.db2.gz	URWAPWUGZDRXPR-UHFFFAOYSA-N	0	3	256.349	3.635	40	0		CHABHN
CCN1CC=C(c2nc3ccc(C)cc3s2)CC1	ZINC000073638457	567893593	/nfs/dbraw/zinc/89/35/93/567893593.db2.gz	GNRSGMWCHRKVBR-UHFFFAOYSA-N	0	3	258.390	3.714	40	0		CHABHN
CCOC(=O)C[C@@H](c1cccc(Cl)c1)N(CC)CC	ZINC000072210300	567917724	/nfs/dbraw/zinc/91/77/24/567917724.db2.gz	DGDZCGBZISARCE-AWEZNQCLSA-N	0	3	283.799	3.676	40	0		CHABHN
Cc1cccnc1[C@H]1CCCN1Cc1ccccc1	ZINC000072211122	567917787	/nfs/dbraw/zinc/91/77/87/567917787.db2.gz	ASHBIZXTLZJOPU-MRXNPFEDSA-N	0	3	252.361	3.727	40	0		CHABHN
CC(C)Oc1ccc([C@@H]2CCCCN2C(C)C)cn1	ZINC000072211920	567917792	/nfs/dbraw/zinc/91/77/92/567917792.db2.gz	QIFGOQMSGVUKPP-HNNXBMFYSA-N	0	3	262.397	3.804	40	0		CHABHN
c1ccc(Oc2ncccc2[C@@H]2CCCCN2)cc1	ZINC000072212211	567918644	/nfs/dbraw/zinc/91/86/44/567918644.db2.gz	XLBLZEAWCCWOOE-HNNXBMFYSA-N	0	3	254.333	3.689	40	0		CHABHN
CC[C@H](C)Nc1ccc([C@@H]2CCCCN2CC)cn1	ZINC000072213534	567919002	/nfs/dbraw/zinc/91/90/02/567919002.db2.gz	ZRONWPSXWANAID-ZFWWWQNUSA-N	0	3	261.413	3.839	40	0		CHABHN
CC[C@H](C)Nc1ncccc1[C@H]1CCCCN1CC	ZINC000072213424	567919042	/nfs/dbraw/zinc/91/90/42/567919042.db2.gz	XBZOOGRKJNEXNL-DZGCQCFKSA-N	0	3	261.413	3.839	40	0		CHABHN
CCCN1CCCC[C@H]1c1cccnc1NC1CCC1	ZINC000072213917	567919088	/nfs/dbraw/zinc/91/90/88/567919088.db2.gz	WIIPSPUJVRHJEB-INIZCTEOSA-N	0	3	273.424	3.983	40	0		CHABHN
Cc1cc(Cl)ncc1[C@@H]1CCCN1CC(C)C	ZINC000072217843	567920349	/nfs/dbraw/zinc/92/03/49/567920349.db2.gz	QAXQVDCTZOAMSO-ZDUSSCGKSA-N	0	3	252.789	3.836	40	0		CHABHN
CCCN1CCCC[C@@H]1c1c(OC)cccc1OC	ZINC000072221436	567921867	/nfs/dbraw/zinc/92/18/67/567921867.db2.gz	YFXGOEPGTDXKKS-CYBMUJFWSA-N	0	3	263.381	3.641	40	0		CHABHN
Cc1nc(NC(C)(C)C)ccc1[C@@H](N)c1ccccc1	ZINC000072225023	567922556	/nfs/dbraw/zinc/92/25/56/567922556.db2.gz	ZSYPNXJCFCAXMO-INIZCTEOSA-N	0	3	269.392	3.649	40	0		CHABHN
NCc1ccc(C(F)(F)F)nc1C1CCCCC1	ZINC000146182115	567928754	/nfs/dbraw/zinc/92/87/54/567928754.db2.gz	ADUYOIGUFGURMR-UHFFFAOYSA-N	0	3	258.287	3.607	40	0		CHABHN
CCCCCNC(=O)c1ccc(CN2CCCCC2)cc1	ZINC000010434252	567939725	/nfs/dbraw/zinc/93/97/25/567939725.db2.gz	RHFZRIIZHNRWFG-UHFFFAOYSA-N	0	3	288.435	3.593	40	0		CHABHN
Fc1ccccc1CCNCc1c(F)cccc1Cl	ZINC000016449517	567944413	/nfs/dbraw/zinc/94/44/13/567944413.db2.gz	FTWBPHCZFFLUQM-UHFFFAOYSA-N	0	3	281.733	3.951	40	0		CHABHN
CCCCOc1ccccc1[C@@H](C)NC[C@H]1CCCO1	ZINC000225162096	567952184	/nfs/dbraw/zinc/95/21/84/567952184.db2.gz	HIVCPSLTVHCDSA-HUUCEWRRSA-N	0	3	277.408	3.695	40	0		CHABHN
CC[C@H](C)Oc1ccccc1[C@H](C)NCCCOC	ZINC000225161763	567952195	/nfs/dbraw/zinc/95/21/95/567952195.db2.gz	RVPYOISYUKKLEQ-KBPBESRZSA-N	0	3	265.397	3.551	40	0		CHABHN
COCCCN[C@@H](C)c1ccccc1OC1CCCC1	ZINC000225161460	189744568	/nfs/dbraw/zinc/74/45/68/189744568.db2.gz	WSUXAZJPGICAPM-AWEZNQCLSA-N	0	3	277.408	3.695	40	0		CHABHN
C(=C\c1ccccc1)\CNCCNC/C=C\c1ccccc1	ZINC000022580492	171392744	/nfs/dbraw/zinc/39/27/44/171392744.db2.gz	OCPXRFLUCJRFJO-PVRNWPCDSA-N	0	3	292.426	3.592	40	0		CHABHN
CC1CCN([C@@H](CN)c2cccc(Cl)c2Cl)CC1	ZINC000039034757	174161766	/nfs/dbraw/zinc/16/17/66/174161766.db2.gz	IEPJOPKFBLKRGT-ZDUSSCGKSA-N	0	3	287.234	3.725	40	0		CHABHN
Cc1ccccc1Cc1cccc(C2CCN(C)CC2)n1	ZINC000072348566	176373449	/nfs/dbraw/zinc/37/34/49/176373449.db2.gz	CUDKZPWLNYHZDV-UHFFFAOYSA-N	0	3	280.415	3.790	40	0		CHABHN
Cc1cc(Cl)ncc1[C@H]1CCCCN1C(C)C	ZINC000072217861	567920748	/nfs/dbraw/zinc/92/07/48/567920748.db2.gz	UXNLOLANLPYEGF-CYBMUJFWSA-N	0	3	252.789	3.979	40	0		CHABHN
CCCCNc1ncccc1[C@H]1CCCCN1CC	ZINC000072213615	567918763	/nfs/dbraw/zinc/91/87/63/567918763.db2.gz	GTQNORYTBPQAAV-OAHLLOKOSA-N	0	3	261.413	3.841	40	0		CHABHN
CN1CC=C(c2nc3cc(Cl)cc(Cl)c3o2)CC1	ZINC000226250034	567038954	/nfs/dbraw/zinc/03/89/54/567038954.db2.gz	UPMZAIOVWKZQMW-UHFFFAOYSA-N	0	3	283.158	3.854	40	0		CHABHN
CCCCN1CC=C(c2nc3ccccc3o2)CC1	ZINC000226250859	567039424	/nfs/dbraw/zinc/03/94/24/567039424.db2.gz	XFBCANVVRYQSMB-UHFFFAOYSA-N	0	3	256.349	3.717	40	0		CHABHN
CCCCOC(=O)C[C@H](c1ccccc1)N1CCCCC1	ZINC000001569382	567838177	/nfs/dbraw/zinc/83/81/77/567838177.db2.gz	WQDZHQZKJMNOAY-QGZVFWFLSA-N	0	3	289.419	3.947	40	0	in-man	CHABHN
COc1ccc(-c2cc([C@H]3CCCCCN3)on2)cc1	ZINC000012133670	567862322	/nfs/dbraw/zinc/86/23/22/567862322.db2.gz	ISCDBWHLZWAWPF-CQSZACIVSA-N	0	3	272.348	3.555	40	0		CHABHN
Cc1ccc2[nH]c(=O)c(CN[C@@H](C)c3ccccc3)cc2c1	ZINC000013998781	567912835	/nfs/dbraw/zinc/91/28/35/567912835.db2.gz	GBFWEBZFSUQTBA-AWEZNQCLSA-N	0	3	292.382	3.687	40	0		CHABHN
CC[C@@H](C)Nc1ccc([C@H]2CCCCN2CC)cn1	ZINC000072213535	567918758	/nfs/dbraw/zinc/91/87/58/567918758.db2.gz	ZRONWPSXWANAID-UKRRQHHQSA-N	0	3	261.413	3.839	40	0		CHABHN
CCN1CCC[C@H]1c1ccc(Nc2ccccc2)nc1	ZINC000072214070	567919764	/nfs/dbraw/zinc/91/97/64/567919764.db2.gz	LZNMMZXZLYHCQA-INIZCTEOSA-N	0	3	267.376	3.982	40	0		CHABHN
COc1cc(C)c([C@H]2CCCN2Cc2ccccc2)cn1	ZINC000072218006	567920126	/nfs/dbraw/zinc/92/01/26/567920126.db2.gz	IHSBZHOZMLNGCR-QGZVFWFLSA-N	0	3	282.387	3.736	40	0		CHABHN
CCN1CCC[C@@H]1c1cccnc1N1CCCCCC1	ZINC000072216693	567920445	/nfs/dbraw/zinc/92/04/45/567920445.db2.gz	AGPVEGNGTKERKU-MRXNPFEDSA-N	0	3	273.424	3.619	40	0		CHABHN
CSc1ccc([C@@H]2CCCCN2CC(C)C)cn1	ZINC000072216904	567920919	/nfs/dbraw/zinc/92/09/19/567920919.db2.gz	ODKADYXKFLWGLT-AWEZNQCLSA-N	0	3	264.438	3.987	40	0		CHABHN
S=c1ccc([C@@H]2CCCN2Cc2ccccc2)c[nH]1	ZINC000072216991	567920929	/nfs/dbraw/zinc/92/09/29/567920929.db2.gz	ONIYTUUGSULYPD-HNNXBMFYSA-N	0	3	270.401	3.707	40	0		CHABHN
CCSc1ncccc1[C@H]1CCCCN1CC	ZINC000072217197	567920992	/nfs/dbraw/zinc/92/09/92/567920992.db2.gz	SEWFQQDOTVLJDK-CYBMUJFWSA-N	0	3	250.411	3.741	40	0		CHABHN
Cc1nc(N(C)C)ccc1[C@H]1CCCN1Cc1ccccc1	ZINC000072218730	567921510	/nfs/dbraw/zinc/92/15/10/567921510.db2.gz	ZXLPGXHOXOAMHD-GOSISDBHSA-N	0	3	295.430	3.793	40	0		CHABHN
CCN1CCC[C@@H]1c1ccc(N2CCCCC2)nc1C	ZINC000072219271	567921663	/nfs/dbraw/zinc/92/16/63/567921663.db2.gz	BHIYMWBYGQCWBN-MRXNPFEDSA-N	0	3	273.424	3.537	40	0		CHABHN
Cc1cnccc1[C@H]1CCCN1Cc1ccccc1	ZINC000072219504	567921813	/nfs/dbraw/zinc/92/18/13/567921813.db2.gz	VKZHVDUEJBFGRM-QGZVFWFLSA-N	0	3	252.361	3.727	40	0		CHABHN
N[C@@H](c1ccccc1)c1ccc(Oc2ccccc2)nc1	ZINC000072225187	567922631	/nfs/dbraw/zinc/92/26/31/567922631.db2.gz	NQBAWANDOBTONJ-SFHVURJKSA-N	0	3	276.339	3.922	40	0		CHABHN
CC(C)COc1ccc([C@@H](C)NC[C@@H]2CCCO2)cc1	ZINC000020092442	567945349	/nfs/dbraw/zinc/94/53/49/567945349.db2.gz	HZESBAYBKQOVNF-PBHICJAKSA-N	0	3	277.408	3.551	40	0		CHABHN
CC(C)COc1ccc([C@@H](C)NC[C@H]2CCCO2)cc1	ZINC000020092446	567945352	/nfs/dbraw/zinc/94/53/52/567945352.db2.gz	HZESBAYBKQOVNF-RHSMWYFYSA-N	0	3	277.408	3.551	40	0		CHABHN
C[C@H](NC[C@@H]1CCCO1)c1ccc(OC2CCCC2)cc1	ZINC000225170418	567952789	/nfs/dbraw/zinc/95/27/89/567952789.db2.gz	GYUQTINHPPYZEQ-KSSFIOAISA-N	0	3	289.419	3.838	40	0		CHABHN
CC(C)[C@H]1C[C@H](N)c2ccccc2N1C(=O)OC(C)(C)C	ZINC000252492250	570391344	/nfs/dbraw/zinc/39/13/44/570391344.db2.gz	MGPYHEWUULDAER-DZGCQCFKSA-N	0	3	290.407	3.856	40	0		CHABHN
c1cc2c(cccc2CN2CCCC[C@H]2c2ccncn2)[nH]1	ZINC000257261747	190022143	/nfs/dbraw/zinc/02/21/43/190022143.db2.gz	LIQVWFPSDZPCKQ-SFHVURJKSA-N	0	3	292.386	3.685	40	0		CHABHN
c1cc2c(cccc2CN2CCCC[C@@H]2c2ccncn2)[nH]1	ZINC000257261746	190022670	/nfs/dbraw/zinc/02/26/70/190022670.db2.gz	LIQVWFPSDZPCKQ-GOSISDBHSA-N	0	3	292.386	3.685	40	0		CHABHN
Cc1ccsc1CN1CCC[C@@H](c2ccnc(C)n2)C1	ZINC000257288446	190027333	/nfs/dbraw/zinc/02/73/33/190027333.db2.gz	PUFOGGCWYZDSAJ-CQSZACIVSA-N	0	3	287.432	3.535	40	0		CHABHN
Cc1cc(N2CCCCCC2)ncc1[C@H](N)c1ccccc1	ZINC000072223534	256705333	/nfs/dbraw/zinc/70/53/33/256705333.db2.gz	BOTWKVCGEBSPQX-LJQANCHMSA-N	0	3	295.430	3.819	40	0		CHABHN
CN1CCC2=C(c3ccccc3)c3ccccc3[C@H]2C1	ZINC000005700911	170130958	/nfs/dbraw/zinc/13/09/58/170130958.db2.gz	JNDASOYIKNULGB-GOSISDBHSA-N	0	3	261.368	3.921	40	0		CHABHN
CCCNCc1ccccc1OCc1ccc(F)cc1	ZINC000006430989	170201143	/nfs/dbraw/zinc/20/11/43/170201143.db2.gz	HJQHSNPBVNCXPT-UHFFFAOYSA-N	0	3	273.351	3.904	40	0		CHABHN
CCNCc1ccccc1OCc1ccc(F)cc1	ZINC000006497344	170207383	/nfs/dbraw/zinc/20/73/83/170207383.db2.gz	KTSZZWSOZYCIPV-UHFFFAOYSA-N	0	3	259.324	3.514	40	0		CHABHN
CC[C@@H](C)n1c2ccc(Cl)cc2nc1[C@H](C)N	ZINC000040408274	174254331	/nfs/dbraw/zinc/25/43/31/174254331.db2.gz	UTULRFIGBDTCCG-BDAKNGLRSA-N	0	3	251.761	3.680	40	0		CHABHN
C[C@H](c1ccco1)N(C)Cc1cccn1-c1ccncc1	ZINC000072397958	176395666	/nfs/dbraw/zinc/39/56/66/176395666.db2.gz	SWEZNQJICSXDKR-CQSZACIVSA-N	0	3	281.359	3.658	40	0		CHABHN
CCCNc1ncc(CN[C@@H](CCC)c2ccccc2)cn1	ZINC000062717710	333175991	/nfs/dbraw/zinc/17/59/91/333175991.db2.gz	ZQPXSWANPHDERD-KRWDZBQOSA-N	0	3	298.434	3.930	40	0		CHABHN
Cc1c2oc3c(c2c(C)c2c1CCN=C2)CCCC3	ZINC000001704351	567842061	/nfs/dbraw/zinc/84/20/61/567842061.db2.gz	YWWVOUMWNWHVST-UHFFFAOYSA-N	0	3	253.345	3.903	40	0		CHABHN
Cc1ncccc1[C@@H]1CCCN1Cc1ccccc1	ZINC000072211280	567917627	/nfs/dbraw/zinc/91/76/27/567917627.db2.gz	AQBUYNFMAJUPBL-KRWDZBQOSA-N	0	3	252.361	3.727	40	0		CHABHN
CCOC(=O)C[C@H](c1ccccc1Cl)N(CC)CC	ZINC000072210303	567917641	/nfs/dbraw/zinc/91/76/41/567917641.db2.gz	DUCXPIVTPBAUBK-CQSZACIVSA-N	0	3	283.799	3.676	40	0		CHABHN
CNc1ccc([C@H]2CCCCN2Cc2ccccc2)cn1	ZINC000072212503	567918027	/nfs/dbraw/zinc/91/80/27/567918027.db2.gz	GULMEQUYLBFWMK-QGZVFWFLSA-N	0	3	281.403	3.851	40	0		CHABHN
CCN1CCC[C@H]1c1ccc(OCc2ccccc2)nc1	ZINC000072212011	567918499	/nfs/dbraw/zinc/91/84/99/567918499.db2.gz	NAWKIGLSDYEGQW-KRWDZBQOSA-N	0	3	282.387	3.817	40	0		CHABHN
c1ccc(CN2CCC[C@@H]2c2cccnc2NC2CC2)cc1	ZINC000072213707	567919109	/nfs/dbraw/zinc/91/91/09/567919109.db2.gz	FWJCJBGEVSBMHG-GOSISDBHSA-N	0	3	293.414	3.993	40	0		CHABHN
CCN1CCCC[C@@H]1c1ccc(NC2CCCC2)nc1	ZINC000072213974	567919119	/nfs/dbraw/zinc/91/91/19/567919119.db2.gz	ONIVZYZQKWPHHG-MRXNPFEDSA-N	0	3	273.424	3.983	40	0		CHABHN
CCN1CCC[C@H]1c1cccnc1NC1CCCCC1	ZINC000072214010	567919280	/nfs/dbraw/zinc/91/92/80/567919280.db2.gz	VONDLGQMKYSNBC-INIZCTEOSA-N	0	3	273.424	3.983	40	0		CHABHN
CCCCN1CCCC[C@@H]1c1ccc(OC)nc1C	ZINC000072218100	567919641	/nfs/dbraw/zinc/91/96/41/567919641.db2.gz	PGEDJJHDWPCGSS-OAHLLOKOSA-N	0	3	262.397	3.726	40	0		CHABHN
CC(C)(C)Sc1ccc([C@H]2CCCCN2)cn1	ZINC000072217374	567919878	/nfs/dbraw/zinc/91/98/78/567919878.db2.gz	XXMIDJNGHNKXOI-GFCCVEGCSA-N	0	3	250.411	3.787	40	0		CHABHN
CCN1CCCC[C@@H]1c1ccc(N2CCCCC2)nc1C	ZINC000072219296	567921729	/nfs/dbraw/zinc/92/17/29/567921729.db2.gz	XSABRXPCJBXZLH-QGZVFWFLSA-N	0	3	287.451	3.927	40	0		CHABHN
COc1ccc(OC)c([C@@H]2CCCCN2C(C)C)c1	ZINC000072221886	567922215	/nfs/dbraw/zinc/92/22/15/567922215.db2.gz	VNCWQGHNWUQNJB-HNNXBMFYSA-N	0	3	263.381	3.639	40	0		CHABHN
C[C@H]1C(O)[C@H](C)[C@@H](c2ccccc2)N[C@H]1c1ccccc1	ZINC000101140101	567937209	/nfs/dbraw/zinc/93/72/09/567937209.db2.gz	GGCLDJYYOISOSI-FPVYWFORSA-N	0	3	281.399	3.705	40	0		CHABHN
Cc1ccsc1CN1CCC[C@H](c2ccnc(C)n2)C1	ZINC000257288445	190027287	/nfs/dbraw/zinc/02/72/87/190027287.db2.gz	PUFOGGCWYZDSAJ-AWEZNQCLSA-N	0	3	287.432	3.535	40	0		CHABHN
CCSc1ccc([C@H]2CCCN2CC(C)C)cn1	ZINC000072217125	256709607	/nfs/dbraw/zinc/70/96/07/256709607.db2.gz	XIGWRLFXWBMVER-CQSZACIVSA-N	0	3	264.438	3.987	40	0		CHABHN
CCOc1ccc(Br)cc1CNC(C)(C)C	ZINC000007519225	170287901	/nfs/dbraw/zinc/28/79/01/170287901.db2.gz	FWZKHPJBMVZJMJ-UHFFFAOYSA-N	0	3	286.213	3.736	40	0		CHABHN
CC1CCN([C@H](CN)c2cccc(Cl)c2Cl)CC1	ZINC000039034758	174161890	/nfs/dbraw/zinc/16/18/90/174161890.db2.gz	IEPJOPKFBLKRGT-CYBMUJFWSA-N	0	3	287.234	3.725	40	0		CHABHN
C[C@H](NC(C)(C)C)C(=O)c1cc(Cl)cc(Cl)c1	ZINC000045302418	175355020	/nfs/dbraw/zinc/35/50/20/175355020.db2.gz	ZKFFJBXJJFDBJM-QMMMGPOBSA-N	0	3	274.191	3.953	40	0	in-vitro	CHABHN
CN1CCC[C@H](c2cccc(Cc3cccc(F)c3)n2)C1	ZINC000072348575	176373556	/nfs/dbraw/zinc/37/35/56/176373556.db2.gz	FYVKJQSHEDNGSG-HNNXBMFYSA-N	0	3	284.378	3.621	40	0		CHABHN
COc1cccc(-c2cccc([C@@H]3CCCN(C)C3)n2)c1	ZINC000072348558	176373609	/nfs/dbraw/zinc/37/36/09/176373609.db2.gz	INNQXLRLCGSBCD-OAHLLOKOSA-N	0	3	282.387	3.566	40	0		CHABHN
CN1CCC[C@H](c2cccc(-c3ccccc3F)n2)C1	ZINC000072348551	176373633	/nfs/dbraw/zinc/37/36/33/176373633.db2.gz	ARBLLYOSWTUVJU-ZDUSSCGKSA-N	0	3	270.351	3.697	40	0		CHABHN
CN1CCC[C@@H](c2cncc(-c3cccc(Cl)c3)n2)C1	ZINC000072359279	176377022	/nfs/dbraw/zinc/37/70/22/176377022.db2.gz	QQVMGTAWWUXOHI-CYBMUJFWSA-N	0	3	287.794	3.606	40	0		CHABHN
Cc1cccc(-c2nccnc2[C@H]2CCCN(C)C2)c1C	ZINC000072365359	176380549	/nfs/dbraw/zinc/38/05/49/176380549.db2.gz	HQGXDNFKGUCECR-HNNXBMFYSA-N	0	3	281.403	3.570	40	0		CHABHN
Cc1sc2c([C@H]3CCCN(C(C)C)C3)nc(C)n2c1C	ZINC000072367726	176382889	/nfs/dbraw/zinc/38/28/89/176382889.db2.gz	LWUDJBFLPAXBCU-AWEZNQCLSA-N	0	3	291.464	3.909	40	0		CHABHN
CCCCN1CCC[C@H]1c1ccc(Cl)nc1C	ZINC000072217906	567920545	/nfs/dbraw/zinc/92/05/45/567920545.db2.gz	PHCFOUXQJCTJOS-ZDUSSCGKSA-N	0	3	252.789	3.980	40	0		CHABHN
C[C@@H](C[C@H]1OC[C@H](CN2CCCCC2)O1)CC(C)(C)C	ZINC000001229976	567074351	/nfs/dbraw/zinc/07/43/51/567074351.db2.gz	HFXRXQYPTWPANL-JYJNAYRXSA-N	0	3	283.456	3.676	40	0		CHABHN
CCN(CC)Cc1c(C)[nH]c2c(C)c(Cl)ccc2c1=O	ZINC000000150221	567820397	/nfs/dbraw/zinc/82/03/97/567820397.db2.gz	IKYOFMXJLYDDOA-UHFFFAOYSA-N	0	3	292.810	3.640	40	0		CHABHN
Cc1ccc(CN(CCCO)Cc2sccc2C)s1	ZINC000013997330	567912542	/nfs/dbraw/zinc/91/25/42/567912542.db2.gz	LQGGUPXQZKVEOA-UHFFFAOYSA-N	0	3	295.473	3.811	40	0		CHABHN
CC1=C[C@@H](C)[C@@H](CN2CCO[C@@H]2C(C)C)[C@H](C)C1	ZINC000102136232	567915320	/nfs/dbraw/zinc/91/53/20/567915320.db2.gz	ZINAYKAEPVIUEM-KLHDSHLOSA-N	0	3	251.414	3.539	40	0		CHABHN
O=c1ccc([C@@H]2CCCCN2Cc2ccccc2)c[nH]1	ZINC000072212275	567918151	/nfs/dbraw/zinc/91/81/51/567918151.db2.gz	QQZUJZSQCHLLLV-INIZCTEOSA-N	0	3	268.360	3.514	40	0		CHABHN
CCN1CCC[C@@H]1c1ccc(N(C(C)C)C(C)C)nc1	ZINC000072212947	567918398	/nfs/dbraw/zinc/91/83/98/567918398.db2.gz	FXQSJNVYRPNRIR-MRXNPFEDSA-N	0	3	275.440	3.862	40	0		CHABHN
CC[C@@H](C)Nc1ncccc1[C@@H]1CCCN1C(C)C	ZINC000072213391	567918786	/nfs/dbraw/zinc/91/87/86/567918786.db2.gz	KLGIBIMDMHAGNL-HIFRSBDPSA-N	0	3	261.413	3.837	40	0		CHABHN
CCCN1CCC[C@@H]1c1cccnc1NC1CCC1	ZINC000072213899	567918858	/nfs/dbraw/zinc/91/88/58/567918858.db2.gz	JNEGTBDEUGWAEC-OAHLLOKOSA-N	0	3	259.397	3.593	40	0		CHABHN
CCCN1CCC[C@@H]1c1cccnc1N[C@@H](C)CC	ZINC000072213395	567919062	/nfs/dbraw/zinc/91/90/62/567919062.db2.gz	NORPIJXUDNAOFT-DZGCQCFKSA-N	0	3	261.413	3.839	40	0		CHABHN
CC[C@H](C)Nc1ccc([C@H]2CCCCN2CC)cn1	ZINC000072213536	567919325	/nfs/dbraw/zinc/91/93/25/567919325.db2.gz	ZRONWPSXWANAID-DZGCQCFKSA-N	0	3	261.413	3.839	40	0		CHABHN
CC(C)N1CCCC[C@H]1c1ccc(N2CCCC2)nc1	ZINC000072215943	567920515	/nfs/dbraw/zinc/92/05/15/567920515.db2.gz	YRGUPBPYDVPSEU-INIZCTEOSA-N	0	3	273.424	3.617	40	0		CHABHN
CCCCN1CCC[C@@H]1c1c(OC)cccc1OC	ZINC000072221425	567921528	/nfs/dbraw/zinc/92/15/28/567921528.db2.gz	CPPIRHUPMGLVJS-CYBMUJFWSA-N	0	3	263.381	3.641	40	0		CHABHN
Cc1nc(N)ccc1[C@@H]1CCCCN1Cc1ccccc1	ZINC000072218586	567921669	/nfs/dbraw/zinc/92/16/69/567921669.db2.gz	YHXULAKSYBDOCC-KRWDZBQOSA-N	0	3	281.403	3.699	40	0		CHABHN
Cc1cc([C@H](N)c2ccccc2)cnc1N1CCCCCC1	ZINC000072222494	567922050	/nfs/dbraw/zinc/92/20/50/567922050.db2.gz	LYMFPDUYMRWGKA-GOSISDBHSA-N	0	3	295.430	3.819	40	0		CHABHN
CNCc1cnc(SC2CCCCC2)c(C)c1	ZINC000072222805	567922076	/nfs/dbraw/zinc/92/20/76/567922076.db2.gz	RAISAAUHSMOAHO-UHFFFAOYSA-N	0	3	250.411	3.534	40	0		CHABHN
Fc1ccc(CCNCc2c(F)cccc2Cl)cc1	ZINC000016383721	567944298	/nfs/dbraw/zinc/94/42/98/567944298.db2.gz	QHAAPROFCQEUBT-UHFFFAOYSA-N	0	3	281.733	3.951	40	0		CHABHN
Cc1c(Cl)cccc1NC(=O)CNCC1CCCCC1	ZINC000000812208	567948170	/nfs/dbraw/zinc/94/81/70/567948170.db2.gz	SHSCPZSMBQIIHE-UHFFFAOYSA-N	0	3	294.826	3.757	40	0		CHABHN
CC(C)COc1cccc([C@H](C)NC[C@H]2CCCO2)c1	ZINC000225167758	567952736	/nfs/dbraw/zinc/95/27/36/567952736.db2.gz	BDFLIQKTEPIHFU-WMLDXEAASA-N	0	3	277.408	3.551	40	0		CHABHN
Cc1ccsc1CN(CCCO)Cc1cccs1	ZINC000013997282	570285221	/nfs/dbraw/zinc/28/52/21/570285221.db2.gz	CNWUPWIIOMJKLT-UHFFFAOYSA-N	0	3	281.446	3.503	40	0		CHABHN
CC(C)N1CCC[C@H]1c1cccnc1N1CCCCC1	ZINC000072216102	256712162	/nfs/dbraw/zinc/71/21/62/256712162.db2.gz	RNPBKBCUWLXFSK-INIZCTEOSA-N	0	3	273.424	3.617	40	0		CHABHN
CCN(C)c1ccc([C@H]2CCCN2Cc2ccccc2)cn1	ZINC000072212706	256714403	/nfs/dbraw/zinc/71/44/03/256714403.db2.gz	DSSJXQPTAVBGID-GOSISDBHSA-N	0	3	295.430	3.875	40	0		CHABHN
CN(Cc1cn(C)c2ccccc12)Cc1ccccc1	ZINC000005337994	170087346	/nfs/dbraw/zinc/08/73/46/170087346.db2.gz	UBXIJBMEJNLIMK-UHFFFAOYSA-N	0	3	264.372	3.810	40	0		CHABHN
Cc1cccc(Cc2cccc([C@@H]3CCCN(C)C3)n2)c1	ZINC000072348567	176373508	/nfs/dbraw/zinc/37/35/08/176373508.db2.gz	ADWGYSTZYWEQKD-QGZVFWFLSA-N	0	3	280.415	3.790	40	0		CHABHN
CN1CCC(c2cncc(-c3cccc(Cl)c3)n2)CC1	ZINC000072359277	176376620	/nfs/dbraw/zinc/37/66/20/176376620.db2.gz	SDGDXIDIYWKQDN-UHFFFAOYSA-N	0	3	287.794	3.606	40	0		CHABHN
CCNc1cc(N2Cc3ccccc3CC2(C)C)nc(C)n1	ZINC000329023399	535522213	/nfs/dbraw/zinc/52/22/13/535522213.db2.gz	OSPTXGDKTQWFHJ-UHFFFAOYSA-N	0	3	296.418	3.558	40	0		CHABHN
CCCNc1ccc([C@H]2CCCCN2C(C)C)cn1	ZINC000072213215	567918181	/nfs/dbraw/zinc/91/81/81/567918181.db2.gz	BIYOHDXNXRKWML-OAHLLOKOSA-N	0	3	261.413	3.839	40	0		CHABHN
CC[C@H]1[C@@H](O)C[C@H](c2ccccc2)N[C@@H]1c1ccccc1	ZINC000000088240	567817776	/nfs/dbraw/zinc/81/77/76/567817776.db2.gz	OKNRTYWYWMOJGO-ZSYWTGECSA-N	0	3	281.399	3.849	40	0		CHABHN
CCN(CC)CCOc1ccc2c(c1)C(=O)c1ccccc1-2	ZINC000001668207	567840602	/nfs/dbraw/zinc/84/06/02/567840602.db2.gz	LOQNPEFJQXRRJK-UHFFFAOYSA-N	0	3	295.382	3.619	40	0		CHABHN
C[C@H]1CCCCN1CCCSC(=O)c1ccccc1	ZINC000001706774	567842214	/nfs/dbraw/zinc/84/22/14/567842214.db2.gz	WWWKIGOKQIQJRK-AWEZNQCLSA-N	0	3	277.433	3.825	40	0		CHABHN
C[C@H]1C(O)[C@@H](C)[C@@H](c2cccs2)N[C@H]1c1cccs1	ZINC000004099756	567854902	/nfs/dbraw/zinc/85/49/02/567854902.db2.gz	CPNYMZKNSCYTRC-UCHNKNFPSA-N	0	3	293.457	3.828	40	0		CHABHN
COc1ccc(-c2cc([C@@H]3CCCCCN3)no2)cc1	ZINC000012185172	567862286	/nfs/dbraw/zinc/86/22/86/567862286.db2.gz	SNDXHBVPZYXADZ-AWEZNQCLSA-N	0	3	272.348	3.555	40	0		CHABHN
Cc1nc(Cl)ccc1[C@H]1CCCN1CC(C)C	ZINC000072217904	567890744	/nfs/dbraw/zinc/89/07/44/567890744.db2.gz	PXAMAPUTXROFOZ-CYBMUJFWSA-N	0	3	252.789	3.836	40	0		CHABHN
CCCN1CC=C(c2nc3cc(Cl)ccc3o2)CC1	ZINC000073636281	567893162	/nfs/dbraw/zinc/89/31/62/567893162.db2.gz	RMVJMDQEWVIYFE-UHFFFAOYSA-N	0	3	276.767	3.980	40	0		CHABHN
Cc1ccc([C@@H]2CCCN2Cc2ccccc2)cn1	ZINC000072211228	567917665	/nfs/dbraw/zinc/91/76/65/567917665.db2.gz	GUUZZZDTYVWJBB-KRWDZBQOSA-N	0	3	252.361	3.727	40	0		CHABHN
CCN(C)c1ncccc1[C@H]1CCCCN1CC(C)C	ZINC000072212799	567918621	/nfs/dbraw/zinc/91/86/21/567918621.db2.gz	UIZGWMKTAPBOJW-MRXNPFEDSA-N	0	3	275.440	3.721	40	0		CHABHN
CCCCN1CCC[C@H]1c1cccnc1NC1CCC1	ZINC000072213904	567918873	/nfs/dbraw/zinc/91/88/73/567918873.db2.gz	ULRGLZRRGOLEMO-INIZCTEOSA-N	0	3	273.424	3.983	40	0		CHABHN
CC(C)N1CCCC[C@@H]1c1ccc(N2CCCC2)nc1	ZINC000072215942	567920309	/nfs/dbraw/zinc/92/03/09/567920309.db2.gz	YRGUPBPYDVPSEU-MRXNPFEDSA-N	0	3	273.424	3.617	40	0		CHABHN
CCCN1CCCC[C@@H]1c1cccnc1N1CCCC1	ZINC000072216000	567920460	/nfs/dbraw/zinc/92/04/60/567920460.db2.gz	BMQFPJHURSMONU-MRXNPFEDSA-N	0	3	273.424	3.619	40	0		CHABHN
CCCCN1CCC[C@H]1c1cccnc1SC	ZINC000072216947	567921122	/nfs/dbraw/zinc/92/11/22/567921122.db2.gz	YQWDNOXRJQFJGA-ZDUSSCGKSA-N	0	3	250.411	3.741	40	0		CHABHN
CSc1ccc([C@@H]2CCCN2CC(C)C)cn1	ZINC000072216885	567921199	/nfs/dbraw/zinc/92/11/99/567921199.db2.gz	GUVOPQBEKLDFGV-ZDUSSCGKSA-N	0	3	250.411	3.596	40	0		CHABHN
CCCCN1CCC[C@H]1c1ccc(SC)nc1	ZINC000072216887	567921255	/nfs/dbraw/zinc/92/12/55/567921255.db2.gz	OHYXVVNRQYZVNA-ZDUSSCGKSA-N	0	3	250.411	3.741	40	0		CHABHN
N[C@H](COc1ccccc1)c1cccc2ccccc21	ZINC000019261070	567942970	/nfs/dbraw/zinc/94/29/70/567942970.db2.gz	YFAUMLMCDQTERU-GOSISDBHSA-N	0	3	263.340	3.919	40	0		CHABHN
CC[C@@H](C)Nc1cc(N2CCc3ccccc3C2)nc(C)n1	ZINC000244420074	136386577	/nfs/dbraw/zinc/38/65/77/136386577.db2.gz	YTAZBEXXALZAIB-CYBMUJFWSA-N	0	3	296.418	3.558	40	0		CHABHN
CCCCOc1ccc([C@H](C)NC[C@@H]2CCCO2)cc1	ZINC000225170269	189744784	/nfs/dbraw/zinc/74/47/84/189744784.db2.gz	SOKGFMQEYUVEBR-YOEHRIQHSA-N	0	3	277.408	3.695	40	0		CHABHN
OC1[C@@H]2CCC[C@H]1[C@H](c1ccccc1)N[C@H]2c1ccccc1	ZINC000001273298	169693150	/nfs/dbraw/zinc/69/31/50/169693150.db2.gz	USAKVYHRWZXKIZ-SWJQRLJCSA-N	0	3	293.410	3.849	40	0		CHABHN
C[C@@H]1CCC[C@@H](C)N1Cc1ccc(N)cc1Br	ZINC000037515912	173247545	/nfs/dbraw/zinc/24/75/45/173247545.db2.gz	FPVDVIKKPOYZMN-GHMZBOCLSA-N	0	3	297.240	3.794	40	0		CHABHN
CN(Cc1ccc(N)cc1Br)C1CCCCC1	ZINC000037515899	173247688	/nfs/dbraw/zinc/24/76/88/173247688.db2.gz	ZMDVXKWAAKZYPO-UHFFFAOYSA-N	0	3	297.240	3.796	40	0		CHABHN
CN1CCC[C@@H]1c1cccc(Cc2cccc(F)c2)n1	ZINC000072357515	176376377	/nfs/dbraw/zinc/37/63/77/176376377.db2.gz	UGDQORHOTIQOQM-QGZVFWFLSA-N	0	3	270.351	3.578	40	0		CHABHN
CC[C@H](C)Oc1ccc([C@@H](C)NC[C@H]2CCCO2)cc1	ZINC000260571727	327856403	/nfs/dbraw/zinc/85/64/03/327856403.db2.gz	BHVLXDWIQYEEEP-JJRVBVJISA-N	0	3	277.408	3.694	40	0		CHABHN
CCCCNc1c(CN)cnc2cc(Cl)ccc21	ZINC000001683338	566996169	/nfs/dbraw/zinc/99/61/69/566996169.db2.gz	LKEMVVCLTDWQJE-UHFFFAOYSA-N	0	3	263.772	3.559	40	0	in-vitro	CHABHN
COc1ccc2c(c1)CCN[C@@H]2c1ccc(Cl)cc1	ZINC000019625708	566998541	/nfs/dbraw/zinc/99/85/41/566998541.db2.gz	RICTYUOVIOEWRA-MRXNPFEDSA-N	0	3	273.763	3.584	40	0		CHABHN
NC12c3ccccc3C(c3ccccc31)c1ccccc12	ZINC000003852388	567853946	/nfs/dbraw/zinc/85/39/46/567853946.db2.gz	DJTAMOPOOXTTJD-UHFFFAOYSA-N	0	3	269.347	3.744	40	0		CHABHN
C[C@@H]1C(O)[C@@H](C)[C@@H](c2cccs2)N[C@@H]1c1cccs1	ZINC000004099761	567854830	/nfs/dbraw/zinc/85/48/30/567854830.db2.gz	CPNYMZKNSCYTRC-NUZBWSBOSA-N	0	3	293.457	3.828	40	0		CHABHN
Cc1cccc(CN2CC[C@@H](c3nc(C(C)(C)C)no3)C2)c1	ZINC000019234946	567877441	/nfs/dbraw/zinc/87/74/41/567877441.db2.gz	WHZHZJXFJUHVRH-OAHLLOKOSA-N	0	3	299.418	3.665	40	0		CHABHN
CN(Cc1ccccc1)C[C@H](O)c1cccc(Cl)c1	ZINC000031912053	567885627	/nfs/dbraw/zinc/88/56/27/567885627.db2.gz	GPPOVAQIFWICMY-INIZCTEOSA-N	0	3	275.779	3.505	40	0		CHABHN
CCOc1ccc([C@@H]2CCCN2Cc2ccccc2)cn1	ZINC000072211768	567917690	/nfs/dbraw/zinc/91/76/90/567917690.db2.gz	BEERZAFPMBKYJD-KRWDZBQOSA-N	0	3	282.387	3.817	40	0		CHABHN
Cc1ccnc([C@@H]2CCCN2Cc2ccccc2)c1	ZINC000072211175	567917771	/nfs/dbraw/zinc/91/77/71/567917771.db2.gz	SUJYLZIDRCMMTN-KRWDZBQOSA-N	0	3	252.361	3.727	40	0		CHABHN
Cc1ccc([C@H]2CCCN2Cc2ccccc2)cn1	ZINC000072211229	567917777	/nfs/dbraw/zinc/91/77/77/567917777.db2.gz	GUUZZZDTYVWJBB-QGZVFWFLSA-N	0	3	252.361	3.727	40	0		CHABHN
c1ccc(CN2CCCC[C@@H]2c2ccccn2)cc1	ZINC000072210992	567917895	/nfs/dbraw/zinc/91/78/95/567917895.db2.gz	ZGNGBBMEYSSAIL-QGZVFWFLSA-N	0	3	252.361	3.809	40	0		CHABHN
Cc1ccnc([C@H]2CCCN2Cc2ccccc2)c1	ZINC000072211176	567917939	/nfs/dbraw/zinc/91/79/39/567917939.db2.gz	SUJYLZIDRCMMTN-QGZVFWFLSA-N	0	3	252.361	3.727	40	0		CHABHN
CN1CCC[C@H]1c1ccc(Oc2ccccc2)nc1	ZINC000072212125	567918132	/nfs/dbraw/zinc/91/81/32/567918132.db2.gz	HHESBKMRILLWOC-HNNXBMFYSA-N	0	3	254.333	3.641	40	0		CHABHN
CCCN1CCCC[C@@H]1c1ccc(N(CC)CC)nc1	ZINC000072212854	567918633	/nfs/dbraw/zinc/91/86/33/567918633.db2.gz	AWYCWRQBRWEDHG-MRXNPFEDSA-N	0	3	275.440	3.865	40	0		CHABHN
CN(c1ccccc1)c1ncccc1[C@H]1CCCCN1	ZINC000072214271	567919614	/nfs/dbraw/zinc/91/96/14/567919614.db2.gz	BZIADAHDUSVRHP-MRXNPFEDSA-N	0	3	267.376	3.664	40	0		CHABHN
CCCCN1CCCC[C@H]1c1cnc(OC)cc1C	ZINC000072218041	567919754	/nfs/dbraw/zinc/91/97/54/567919754.db2.gz	YNOFBPFVXZURAW-HNNXBMFYSA-N	0	3	262.397	3.726	40	0		CHABHN
CCCCN1CCC[C@@H]1c1ccc(Cl)nc1C	ZINC000072217905	567920754	/nfs/dbraw/zinc/92/07/54/567920754.db2.gz	PHCFOUXQJCTJOS-CYBMUJFWSA-N	0	3	252.789	3.980	40	0		CHABHN
CCCN1CCCC[C@H]1c1cnc(N2CCCC2)c(C)c1	ZINC000072218819	567921920	/nfs/dbraw/zinc/92/19/20/567921920.db2.gz	ZFXBBNMIPMTLQX-KRWDZBQOSA-N	0	3	287.451	3.927	40	0		CHABHN
Cc1cc([C@H](N)c2ccccc2)cnc1NC(C)(C)C	ZINC000072222936	567922369	/nfs/dbraw/zinc/92/23/69/567922369.db2.gz	LTWPMTCFBIOUAR-OAHLLOKOSA-N	0	3	269.392	3.649	40	0		CHABHN
CC(C)N1CCN(c2ccc(SC(C)(C)C)cn2)CC1	ZINC000072225623	567922684	/nfs/dbraw/zinc/92/26/84/567922684.db2.gz	KMRQEVLOOBQAMR-UHFFFAOYSA-N	0	3	293.480	3.503	40	0		CHABHN
Cc1ccccc1CN(CCN(C)C)Cc1cccs1	ZINC000023247834	567948642	/nfs/dbraw/zinc/94/86/42/567948642.db2.gz	LUETYSXTMIBWIJ-UHFFFAOYSA-N	0	3	288.460	3.620	40	0		CHABHN
CC(C)COc1ccccc1[C@@H](C)NC[C@H]1CCCO1	ZINC000225162449	567952422	/nfs/dbraw/zinc/95/24/22/567952422.db2.gz	OKLWYSRAVNDOPU-HUUCEWRRSA-N	0	3	277.408	3.551	40	0		CHABHN
CC1(C)CN(Cc2ccccc2)CCN1Cc1ccccc1	ZINC000019366427	570237661	/nfs/dbraw/zinc/23/76/61/570237661.db2.gz	KROYEDGOMOKSBK-UHFFFAOYSA-N	0	3	294.442	3.783	40	0		CHABHN
Cc1ccc(CN2CCC3(C[C@@H](C(C)C)CO3)CC2)o1	ZINC000096047903	185072332	/nfs/dbraw/zinc/07/23/32/185072332.db2.gz	LOGUFWAFNNODDT-OAHLLOKOSA-N	0	3	277.408	3.615	40	0		CHABHN
Cc1ccsc1CN1CCC(c2cncc(C)n2)CC1	ZINC000257305555	190030914	/nfs/dbraw/zinc/03/09/14/190030914.db2.gz	SQNIDESPSGZXFR-UHFFFAOYSA-N	0	3	287.432	3.535	40	0		CHABHN
COc1ccc(OC)c([C@H]2CCCCN2C(C)C)c1	ZINC000072221885	256705742	/nfs/dbraw/zinc/70/57/42/256705742.db2.gz	VNCWQGHNWUQNJB-OAHLLOKOSA-N	0	3	263.381	3.639	40	0		CHABHN
CCN1CCC[C@H]1c1cccnc1SC(C)C	ZINC000072217533	256709165	/nfs/dbraw/zinc/70/91/65/256709165.db2.gz	KUJSNLZMMNYOPE-ZDUSSCGKSA-N	0	3	250.411	3.739	40	0		CHABHN
CN(c1ccccc1)c1ccc(C2=NCCCC2)cn1	ZINC000072214209	256711651	/nfs/dbraw/zinc/71/16/51/256711651.db2.gz	XAAGVLWTERYFDY-UHFFFAOYSA-N	0	3	265.360	3.823	40	0		CHABHN
CN(c1ccccc1)c1ccc([C@H]2CCCN2C)cn1	ZINC000072214183	256711885	/nfs/dbraw/zinc/71/18/85/256711885.db2.gz	NZTASPBDOPFPFL-MRXNPFEDSA-N	0	3	267.376	3.616	40	0		CHABHN
C([C@@H]1CO[C@@]2(CC[C@@H]3CCCC[C@@H]3C2)O1)N1CCCCC1	ZINC000004713522	170003833	/nfs/dbraw/zinc/00/38/33/170003833.db2.gz	XBGMCAWJVPHBRD-MLHJIOFPSA-N	0	3	293.451	3.574	40	0		CHABHN
CCCCNCc1cc(Cl)cc(Cl)c1OC	ZINC000007261650	170273855	/nfs/dbraw/zinc/27/38/55/170273855.db2.gz	YYEFCWZLUIIWLL-UHFFFAOYSA-N	0	3	262.180	3.892	40	0		CHABHN
N[C@@H](c1ccccc1)c1cccc(C(F)(F)F)c1	ZINC000019415297	170791301	/nfs/dbraw/zinc/79/13/01/170791301.db2.gz	CWFKHNVINSPTMT-ZDUSSCGKSA-N	0	3	251.251	3.754	40	0		CHABHN
CC1CCN([C@H](CN)c2cc(Cl)cc(Cl)c2)CC1	ZINC000037424717	173199382	/nfs/dbraw/zinc/19/93/82/173199382.db2.gz	BYAKMENAVNZXMC-CQSZACIVSA-N	0	3	287.234	3.725	40	0		CHABHN
CN1CCC[C@@H](c2cccc(-c3cccc(F)c3)n2)C1	ZINC000072348554	176373588	/nfs/dbraw/zinc/37/35/88/176373588.db2.gz	QQFZQZVZFZVBAY-CQSZACIVSA-N	0	3	270.351	3.697	40	0		CHABHN
CN1CCC[C@@H](c2cccc(-c3ccccc3F)n2)C1	ZINC000072348552	176373859	/nfs/dbraw/zinc/37/38/59/176373859.db2.gz	ARBLLYOSWTUVJU-CYBMUJFWSA-N	0	3	270.351	3.697	40	0		CHABHN
OC1[C@@H]2CCC[C@H]1[C@@H](c1ccccc1)N[C@H]2c1ccccc1	ZINC000002286011	326796760	/nfs/dbraw/zinc/79/67/60/326796760.db2.gz	USAKVYHRWZXKIZ-SYBFEITBSA-N	0	3	293.410	3.849	40	0		CHABHN
Cc1ccsc1CN(Cc1cccs1)C[C@@H](C)O	ZINC000013991346	567912301	/nfs/dbraw/zinc/91/23/01/567912301.db2.gz	LAEMBVJICWTPIR-GFCCVEGCSA-N	0	3	281.446	3.501	40	0		CHABHN
CCSc1ncccc1[C@H]1CCCN1C(C)C	ZINC000072217181	567920877	/nfs/dbraw/zinc/92/08/77/567920877.db2.gz	QYFNRYJOGHHVLV-CYBMUJFWSA-N	0	3	250.411	3.739	40	0		CHABHN
C[C@@H](CN1[C@@H](C)CCC[C@@H]1C)OC(=O)c1ccc(F)cc1	ZINC000012342215	567073063	/nfs/dbraw/zinc/07/30/63/567073063.db2.gz	UWBNPVDYTHSVEP-IHRRRGAJSA-N	0	3	293.382	3.634	40	0		CHABHN
O=C(c1ccccc1)[C@@H]1CCCN(CCc2ccccc2)C1	ZINC000001585572	567838685	/nfs/dbraw/zinc/83/86/85/567838685.db2.gz	ZONSOLSUMGWIOY-LJQANCHMSA-N	0	3	293.410	3.824	40	0		CHABHN
CCN(CC)CCOC(=O)c1c(C)c(C)c(C)c(C)c1C	ZINC000001646514	567839942	/nfs/dbraw/zinc/83/99/42/567839942.db2.gz	BJYOURZCFNZUMX-UHFFFAOYSA-N	0	3	291.435	3.727	40	0		CHABHN
Cc1ccccc1Cc1cccc(C)c1OCCN(C)C	ZINC000001677389	567841176	/nfs/dbraw/zinc/84/11/76/567841176.db2.gz	BBWFFXIZYMWKPC-UHFFFAOYSA-N	0	3	283.415	3.835	40	0		CHABHN
C[C@@H]1C(O)[C@@H](C)[C@@H](c2cccs2)N[C@H]1c1cccs1	ZINC000004099758	567855153	/nfs/dbraw/zinc/85/51/53/567855153.db2.gz	CPNYMZKNSCYTRC-ZRMABJORSA-N	0	3	293.457	3.828	40	0		CHABHN
c1c2cccnc2[nH]c1[C@H]1CCCN1Cc1ccccc1	ZINC000019372002	567877879	/nfs/dbraw/zinc/87/78/79/567877879.db2.gz	OGHBOGBOSGIMDF-QGZVFWFLSA-N	0	3	277.371	3.900	40	0		CHABHN
CCOc1ncccc1[C@@H]1CCCCN1CC(C)C	ZINC000072211861	567917492	/nfs/dbraw/zinc/91/74/92/567917492.db2.gz	ILNUDXWJUZUNGI-HNNXBMFYSA-N	0	3	262.397	3.663	40	0		CHABHN
CC(C)CN1CCCC[C@@H]1c1ccc(Cl)nc1	ZINC000072211465	567917655	/nfs/dbraw/zinc/91/76/55/567917655.db2.gz	NXMZQKFCVOUEDO-CYBMUJFWSA-N	0	3	252.789	3.918	40	0		CHABHN
Cc1cncc([C@H]2CCCN2Cc2ccccc2)c1	ZINC000072211333	567917798	/nfs/dbraw/zinc/91/77/98/567917798.db2.gz	WGQOXVXOBQPHQV-QGZVFWFLSA-N	0	3	252.361	3.727	40	0		CHABHN
CCCCN1CCC[C@@H]1c1cccnc1N(CC)CC	ZINC000072212901	567918021	/nfs/dbraw/zinc/91/80/21/567918021.db2.gz	ILACHNVAPFDVAQ-MRXNPFEDSA-N	0	3	275.440	3.865	40	0		CHABHN
c1ccc(Oc2ccc([C@@H]3CCCCN3)cn2)cc1	ZINC000072212151	567918332	/nfs/dbraw/zinc/91/83/32/567918332.db2.gz	LPMDCCWZEGVRIN-HNNXBMFYSA-N	0	3	254.333	3.689	40	0		CHABHN
CN(C)c1ccc([C@@H]2CCCCN2Cc2ccccc2)cn1	ZINC000072212622	567918355	/nfs/dbraw/zinc/91/83/55/567918355.db2.gz	GETLSQLLUGEROE-SFHVURJKSA-N	0	3	295.430	3.875	40	0		CHABHN
CCCCN1CCC[C@H]1c1cccnc1NC1CC1	ZINC000072213724	567918913	/nfs/dbraw/zinc/91/89/13/567918913.db2.gz	RDIAZRXASJIBCR-HNNXBMFYSA-N	0	3	259.397	3.593	40	0		CHABHN
CC[C@@H](C)Nc1ncccc1[C@@H]1CCCCN1CC	ZINC000072213421	567918923	/nfs/dbraw/zinc/91/89/23/567918923.db2.gz	XBZOOGRKJNEXNL-HIFRSBDPSA-N	0	3	261.413	3.839	40	0		CHABHN
CN1CCCC[C@@H]1c1cccnc1NC1CCCCC1	ZINC000072214032	567919744	/nfs/dbraw/zinc/91/97/44/567919744.db2.gz	IPXXQBCSVKDNDW-MRXNPFEDSA-N	0	3	273.424	3.983	40	0		CHABHN
COc1cc(C)c([C@@H]2CCCN2Cc2ccccc2)cn1	ZINC000072218005	567920212	/nfs/dbraw/zinc/92/02/12/567920212.db2.gz	IHSBZHOZMLNGCR-KRWDZBQOSA-N	0	3	282.387	3.736	40	0		CHABHN
CCCCN1CCC[C@H]1c1cccnc1N1CCCC1	ZINC000072215988	567920291	/nfs/dbraw/zinc/92/02/91/567920291.db2.gz	ASMHQXCDBNWZIE-INIZCTEOSA-N	0	3	273.424	3.619	40	0		CHABHN
CC(C)N1CCCC[C@@H]1c1cccnc1N1CCCC1	ZINC000072216002	567920634	/nfs/dbraw/zinc/92/06/34/567920634.db2.gz	RWFJJKPFLDBUNH-MRXNPFEDSA-N	0	3	273.424	3.617	40	0		CHABHN
CCSc1ncccc1[C@@H]1CCCCN1CC	ZINC000072217198	567921284	/nfs/dbraw/zinc/92/12/84/567921284.db2.gz	SEWFQQDOTVLJDK-ZDUSSCGKSA-N	0	3	250.411	3.741	40	0		CHABHN
CCN1CCCC[C@H]1c1cnc(N2CCCC2)cc1C	ZINC000072218877	567921807	/nfs/dbraw/zinc/92/18/07/567921807.db2.gz	YZSNRHOBRDSALU-INIZCTEOSA-N	0	3	273.424	3.537	40	0		CHABHN
N[C@H](c1ccccc1)c1ccc(Oc2ccccc2)nc1	ZINC000072225188	567922523	/nfs/dbraw/zinc/92/25/23/567922523.db2.gz	NQBAWANDOBTONJ-GOSISDBHSA-N	0	3	276.339	3.922	40	0		CHABHN
CC1=Nn2c3cc(Cl)ccc3nc2[C@@H]2C=CCC=C12	ZINC000001097446	567937259	/nfs/dbraw/zinc/93/72/59/567937259.db2.gz	JJOQSCCEZNINCQ-GFCCVEGCSA-N	0	3	269.735	3.730	40	0		CHABHN
CC(C)COc1cccc([C@H](C)NC[C@@H]2CCCO2)c1	ZINC000225167685	567952861	/nfs/dbraw/zinc/95/28/61/567952861.db2.gz	BDFLIQKTEPIHFU-YOEHRIQHSA-N	0	3	277.408	3.551	40	0		CHABHN
CNCc1cc(Cl)ccc1OCc1ccccc1	ZINC000005910016	170153606	/nfs/dbraw/zinc/15/36/06/170153606.db2.gz	QPGHZAPZIXMIKZ-UHFFFAOYSA-N	0	3	261.752	3.638	40	0		CHABHN
CC1CCN([C@H](CN)c2ccc(Cl)c(Cl)c2)CC1	ZINC000039142597	174164631	/nfs/dbraw/zinc/16/46/31/174164631.db2.gz	GLMIRNAVPZGQJZ-CQSZACIVSA-N	0	3	287.234	3.725	40	0		CHABHN
CN1CCC[C@H]1c1cccc(Cc2cccc(F)c2)n1	ZINC000072357516	176376273	/nfs/dbraw/zinc/37/62/73/176376273.db2.gz	UGDQORHOTIQOQM-KRWDZBQOSA-N	0	3	270.351	3.578	40	0		CHABHN
CCC[C@H](NCc1cnc(NC(C)C)nc1)c1ccccc1	ZINC000062717636	333175899	/nfs/dbraw/zinc/17/58/99/333175899.db2.gz	MBLRDTKBWNOLRH-KRWDZBQOSA-N	0	3	298.434	3.928	40	0		CHABHN
NCc1ccc2c(F)cc(Br)cc2c1Cl	ZINC000199713128	567049632	/nfs/dbraw/zinc/04/96/32/567049632.db2.gz	HQKWGRRAXWOAGB-UHFFFAOYSA-N	0	3	288.547	3.854	40	0		CHABHN
CCOc1ccc(CN[C@@H](C)c2ccccc2)cc1	ZINC000000517046	567833213	/nfs/dbraw/zinc/83/32/13/567833213.db2.gz	JNVVIQPMHUDYTJ-AWEZNQCLSA-N	0	3	255.361	3.936	40	0		CHABHN
CN1CCC2=C(c3ccccc3)c3ccccc3[C@@H]2C1	ZINC000001595112	567838956	/nfs/dbraw/zinc/83/89/56/567838956.db2.gz	JNDASOYIKNULGB-SFHVURJKSA-N	0	3	261.368	3.921	40	0		CHABHN
CC[C@H](C)[C@@H](C(=O)OCCN(CC)CC)c1ccccc1	ZINC000001649108	567839994	/nfs/dbraw/zinc/83/99/94/567839994.db2.gz	LKQUJKDIEHGPLY-DOTOQJQBSA-N	0	3	291.435	3.701	40	0		CHABHN
Cc1nn(-c2ccccc2)c2c1C(c1ccco1)S2	ZINC000016266281	567872146	/nfs/dbraw/zinc/87/21/46/567872146.db2.gz	HOXOCOMPXMLEAB-CQSZACIVSA-N	0	3	268.341	3.969	40	0		CHABHN
Cc1nc2ccccc2nc1CC(=N)c1ccccc1	ZINC000017064329	567874768	/nfs/dbraw/zinc/87/47/68/567874768.db2.gz	DGPWSSNOALSWDN-UHFFFAOYSA-N	0	3	261.328	3.549	40	0		CHABHN
CCOc1ccc([C@H]2CCCN2Cc2ccccc2)cn1	ZINC000072211769	567917548	/nfs/dbraw/zinc/91/75/48/567917548.db2.gz	BEERZAFPMBKYJD-QGZVFWFLSA-N	0	3	282.387	3.817	40	0		CHABHN
CCCCN1CCC[C@@H]1c1ccc(OC(C)C)nc1	ZINC000072211904	567917936	/nfs/dbraw/zinc/91/79/36/567917936.db2.gz	PXBCMBPYZHHYEH-OAHLLOKOSA-N	0	3	262.397	3.806	40	0		CHABHN
CCN1CCC[C@@H]1c1cccnc1OCc1ccccc1	ZINC000072212070	567918323	/nfs/dbraw/zinc/91/83/23/567918323.db2.gz	FIQUTTFKMAYIAA-QGZVFWFLSA-N	0	3	282.387	3.817	40	0		CHABHN
c1ccc(CN2CCC[C@@H]2c2ccc(NC3CC3)nc2)cc1	ZINC000072213767	567918781	/nfs/dbraw/zinc/91/87/81/567918781.db2.gz	WBMAGXOKSLEVFQ-GOSISDBHSA-N	0	3	293.414	3.993	40	0		CHABHN
CC[C@H](C)Nc1ncccc1[C@H]1CCCN1C(C)C	ZINC000072213394	567918797	/nfs/dbraw/zinc/91/87/97/567918797.db2.gz	KLGIBIMDMHAGNL-DZGCQCFKSA-N	0	3	261.413	3.837	40	0		CHABHN
CC[C@H](C)Nc1ncccc1[C@@H]1CCCCN1CC	ZINC000072213422	567918845	/nfs/dbraw/zinc/91/88/45/567918845.db2.gz	XBZOOGRKJNEXNL-ZFWWWQNUSA-N	0	3	261.413	3.839	40	0		CHABHN
CCN1CCC[C@@H]1c1cccnc1NC1CCCCC1	ZINC000072214009	567919167	/nfs/dbraw/zinc/91/91/67/567919167.db2.gz	VONDLGQMKYSNBC-MRXNPFEDSA-N	0	3	273.424	3.983	40	0		CHABHN
S=c1ccc([C@H]2CCCN2Cc2ccccc2)c[nH]1	ZINC000072216990	567921388	/nfs/dbraw/zinc/92/13/88/567921388.db2.gz	ONIYTUUGSULYPD-OAHLLOKOSA-N	0	3	270.401	3.707	40	0		CHABHN
CSc1ncccc1[C@@H]1CCCCN1CC(C)C	ZINC000072216964	567921418	/nfs/dbraw/zinc/92/14/18/567921418.db2.gz	IKXRTGUYNPYBCK-AWEZNQCLSA-N	0	3	264.438	3.987	40	0		CHABHN
COc1cccc(OC)c1[C@@H]1CCCCN1CC(C)C	ZINC000072221441	567922173	/nfs/dbraw/zinc/92/21/73/567922173.db2.gz	WULYAXYJAFCRGZ-AWEZNQCLSA-N	0	3	277.408	3.887	40	0		CHABHN
Cc1nc(N2CCCCCC2)ccc1[C@@H](N)c1ccccc1	ZINC000072224582	567922635	/nfs/dbraw/zinc/92/26/35/567922635.db2.gz	JPJZAPVLRVZSAE-IBGZPJMESA-N	0	3	295.430	3.819	40	0		CHABHN
CCCCCC[C@H](C)NCC(=O)Nc1ccccc1C	ZINC000001684137	567937418	/nfs/dbraw/zinc/93/74/18/567937418.db2.gz	KEAFRUJUNVFMKI-HNNXBMFYSA-N	0	3	276.424	3.882	40	0		CHABHN
CCCCOc1cccc([C@H](C)NC[C@@H]2CCCO2)c1	ZINC000225167350	567952858	/nfs/dbraw/zinc/95/28/58/567952858.db2.gz	UGDAUCKIQJGURM-YOEHRIQHSA-N	0	3	277.408	3.695	40	0		CHABHN
Cc1nc(NC(C)C)cc(N2Cc3ccccc3C[C@H]2C)n1	ZINC000329006755	136377444	/nfs/dbraw/zinc/37/74/44/136377444.db2.gz	LEGDZCPYMCIQPR-CYBMUJFWSA-N	0	3	296.418	3.557	40	0		CHABHN
CN1CCC([C@@H]2c3ccccc3CCc3cccnc32)CC1	ZINC000013775750	530050911	/nfs/dbraw/zinc/05/09/11/530050911.db2.gz	URXVQALXMZGZCV-LJQANCHMSA-N	0	3	292.426	3.654	40	0		CHABHN
CN1CCC[C@H]1c1cccnc1NC1CCCCC1	ZINC000072214004	256711825	/nfs/dbraw/zinc/71/18/25/256711825.db2.gz	ZWMHTWULULHERO-HNNXBMFYSA-N	0	3	259.397	3.593	40	0		CHABHN
CCCOC(=O)C[C@@H](c1ccccc1)N1CCCCC1	ZINC000006380578	170196412	/nfs/dbraw/zinc/19/64/12/170196412.db2.gz	GRDVFGSDHKMFIS-INIZCTEOSA-N	0	3	275.392	3.557	40	0		CHABHN
CCOC(=O)[C@H](CNCc1ccccc1)C1CCCCC1	ZINC000006403458	170198885	/nfs/dbraw/zinc/19/88/85/170198885.db2.gz	AJDXXPIOSIREGY-QGZVFWFLSA-N	0	3	289.419	3.536	40	0		CHABHN
CCOc1cccc(CNCc2ccc(F)cc2)c1	ZINC000008325239	170331472	/nfs/dbraw/zinc/33/14/72/170331472.db2.gz	YPIZZVRGUURFHY-UHFFFAOYSA-N	0	3	259.324	3.514	40	0		CHABHN
C[C@H]1CCCN([C@@H](CN)c2cc(Cl)cc(Cl)c2)C1	ZINC000037424745	173198948	/nfs/dbraw/zinc/19/89/48/173198948.db2.gz	FNAYOLSGFCLSAS-HZMBPMFUSA-N	0	3	287.234	3.725	40	0		CHABHN
Cc1ccc(-c2nn(-c3ccccc3)cc2CN(C)C)cc1	ZINC000072238803	176347274	/nfs/dbraw/zinc/34/72/74/176347274.db2.gz	YSGJTIZOEISSTD-UHFFFAOYSA-N	0	3	291.398	3.909	40	0		CHABHN
COc1ccccc1-c1cccc([C@H]2CCCN(C)C2)n1	ZINC000072348555	176373621	/nfs/dbraw/zinc/37/36/21/176373621.db2.gz	VUHCJFPZTHNUJI-AWEZNQCLSA-N	0	3	282.387	3.566	40	0		CHABHN
CCCNc1ncccc1[C@@H]1CCCCN1CCC	ZINC000072213152	567918090	/nfs/dbraw/zinc/91/80/90/567918090.db2.gz	VCXJHTFDJVRVOF-HNNXBMFYSA-N	0	3	261.413	3.841	40	0		CHABHN
CCCN(CC)[C@@H](CC)C(=O)Nc1c(C)cccc1C	ZINC000000000276	567816588	/nfs/dbraw/zinc/81/65/88/567816588.db2.gz	VTUSIVBDOCDNHS-HNNXBMFYSA-N	0	3	276.424	3.752	40	0	world	CHABHN
CCCOC(=O)C[C@H](c1ccccc1)N1CCCCC1	ZINC000001569381	567837877	/nfs/dbraw/zinc/83/78/77/567837877.db2.gz	GRDVFGSDHKMFIS-MRXNPFEDSA-N	0	3	275.392	3.557	40	0		CHABHN
N[C@H](c1ccccc1)c1cccc(C(F)(F)F)c1	ZINC000019415299	567878143	/nfs/dbraw/zinc/87/81/43/567878143.db2.gz	CWFKHNVINSPTMT-CYBMUJFWSA-N	0	3	251.251	3.754	40	0		CHABHN
Fc1ccccc1CCNCc1ccccc1Cl	ZINC000019912587	567879823	/nfs/dbraw/zinc/87/98/23/567879823.db2.gz	GIKZSLIXPVIZRL-UHFFFAOYSA-N	0	3	263.743	3.811	40	0		CHABHN
COc1cccc(C(=O)[C@H](C)CN(C)Cc2ccccc2)c1	ZINC000077028766	567890527	/nfs/dbraw/zinc/89/05/27/567890527.db2.gz	LPCUZXHCGXGQPJ-OAHLLOKOSA-N	0	3	297.398	3.646	40	0		CHABHN
CCCN1CC=C(c2nc3cc(C)cc(C)c3o2)CC1	ZINC000073636278	567892981	/nfs/dbraw/zinc/89/29/81/567892981.db2.gz	ZJFSLTUFSPBRTD-UHFFFAOYSA-N	0	3	270.376	3.944	40	0		CHABHN
CCCCN1CCC[C@H]1c1ccc(OC(C)C)nc1	ZINC000072211905	567917878	/nfs/dbraw/zinc/91/78/78/567917878.db2.gz	PXBCMBPYZHHYEH-HNNXBMFYSA-N	0	3	262.397	3.806	40	0		CHABHN
CCN(CC)c1ncccc1[C@H]1CCCCN1C(C)C	ZINC000072212917	567918537	/nfs/dbraw/zinc/91/85/37/567918537.db2.gz	JUEIRAGVQPAVOU-MRXNPFEDSA-N	0	3	275.440	3.863	40	0		CHABHN
CCN1CCCC[C@@H]1c1ccc(NC2CCC2)nc1	ZINC000072213854	567919389	/nfs/dbraw/zinc/91/93/89/567919389.db2.gz	YNSLOTZERRBIHA-OAHLLOKOSA-N	0	3	259.397	3.593	40	0		CHABHN
CN1CCCC[C@@H]1c1ccc(Nc2ccccc2)nc1	ZINC000072214092	567919644	/nfs/dbraw/zinc/91/96/44/567919644.db2.gz	KQFYUUSNMBEMMT-MRXNPFEDSA-N	0	3	267.376	3.982	40	0		CHABHN
CC(C)(C)Sc1ncccc1[C@@H]1CCCCN1	ZINC000072217433	567920001	/nfs/dbraw/zinc/92/00/01/567920001.db2.gz	OGWDRJSSQBNCOJ-LBPRGKRZSA-N	0	3	250.411	3.787	40	0		CHABHN
CN1CCCC[C@H]1c1ccc(N2CCCCCC2)nc1	ZINC000072216657	567920132	/nfs/dbraw/zinc/92/01/32/567920132.db2.gz	JSZKNZWRGNWSBD-INIZCTEOSA-N	0	3	273.424	3.619	40	0		CHABHN
CN1CCCC[C@@H]1c1cccnc1N1CCCCCC1	ZINC000072216716	567920190	/nfs/dbraw/zinc/92/01/90/567920190.db2.gz	NFNINGTYYYOWGT-MRXNPFEDSA-N	0	3	273.424	3.619	40	0		CHABHN
CC(C)N1CCCC[C@H]1c1cccnc1N1CCCC1	ZINC000072216003	567920763	/nfs/dbraw/zinc/92/07/63/567920763.db2.gz	RWFJJKPFLDBUNH-INIZCTEOSA-N	0	3	273.424	3.617	40	0		CHABHN
CCCN1CCC[C@@H]1c1cccnc1SCC	ZINC000072217182	567921337	/nfs/dbraw/zinc/92/13/37/567921337.db2.gz	NRNJUOHPUWCFMS-CYBMUJFWSA-N	0	3	250.411	3.741	40	0		CHABHN
N[C@@H](c1ccccc1)c1ccc(N2CCCCCC2)nc1	ZINC000072225478	567921815	/nfs/dbraw/zinc/92/18/15/567921815.db2.gz	NUQLBPUUHBXNEG-SFHVURJKSA-N	0	3	281.403	3.510	40	0		CHABHN
Cc1ccc(CN(CCN(C)C)Cc2cccs2)s1	ZINC000023247846	567948649	/nfs/dbraw/zinc/94/86/49/567948649.db2.gz	JEGOGINYVDHQDE-UHFFFAOYSA-N	0	3	294.489	3.682	40	0		CHABHN
CC[C@H](C)Oc1ccccc1[C@@H](C)NC[C@@H]1CCCO1	ZINC000225162588	567952530	/nfs/dbraw/zinc/95/25/30/567952530.db2.gz	AEGZFYICSOOIQG-ZNMIVQPWSA-N	0	3	277.408	3.694	40	0		CHABHN
CC(C)[C@@H]1C[C@@H](N)c2ccccc2N1C(=O)OC(C)(C)C	ZINC000252492251	570391445	/nfs/dbraw/zinc/39/14/45/570391445.db2.gz	MGPYHEWUULDAER-HIFRSBDPSA-N	0	3	290.407	3.856	40	0		CHABHN
CN1Cc2ccccc2[C@@H]2c3cccc4[nH]cc(c43)C[C@@H]21	ZINC000006169441	1120080680	/nfs/dbraw/zinc/08/06/80/1120080680.db2.gz	WRNKIDLXXXIELU-PKOBYXMFSA-N	0	3	274.367	3.670	40	0		CHABHN
Cc1cccc(Oc2ccc([C@@H]3CCCCN3)cn2)c1	ZINC000257197940	190010064	/nfs/dbraw/zinc/01/00/64/190010064.db2.gz	OBLXLISZKREQEI-INIZCTEOSA-N	0	3	268.360	3.997	40	0		CHABHN
CN1CCC[C@@H]1c1cccnc1Nc1ccccc1	ZINC000072214123	256712201	/nfs/dbraw/zinc/71/22/01/256712201.db2.gz	CIIHZEFUUKFYLH-OAHLLOKOSA-N	0	3	253.349	3.592	40	0		CHABHN
CCCNc1ncccc1[C@H]1CCCCN1CCC	ZINC000072213153	256712782	/nfs/dbraw/zinc/71/27/82/256712782.db2.gz	VCXJHTFDJVRVOF-OAHLLOKOSA-N	0	3	261.413	3.841	40	0		CHABHN
CC(C)N(c1ccc([C@H]2CCCCN2C)cn1)C(C)C	ZINC000072212971	256713832	/nfs/dbraw/zinc/71/38/32/256713832.db2.gz	NSIKWAUSYNIPQK-MRXNPFEDSA-N	0	3	275.440	3.862	40	0		CHABHN
O=C(c1ccccc1)[C@H]1CCCN(CCc2ccccc2)C1	ZINC000005551458	170112266	/nfs/dbraw/zinc/11/22/66/170112266.db2.gz	ZONSOLSUMGWIOY-IBGZPJMESA-N	0	3	293.410	3.824	40	0		CHABHN
C[C@H](NCc1ccco1)C12CC3CC(CC(C3)C1)C2	ZINC000007519284	170288057	/nfs/dbraw/zinc/28/80/57/170288057.db2.gz	AOXHXNXGJDPPBV-ORVZXPRGSA-N	0	3	259.393	3.974	40	0		CHABHN
CN1[C@@H](c2ccccc2)CC(O)C[C@H]1c1ccccc1	ZINC000008616952	170343114	/nfs/dbraw/zinc/34/31/14/170343114.db2.gz	CVCRCZBXPUGBNK-AYHJJNSGSA-N	0	3	267.372	3.556	40	0		CHABHN
c1ccc(CN2CCC3(CC2)OCCc2ccccc23)cc1	ZINC000013472060	170553317	/nfs/dbraw/zinc/55/33/17/170553317.db2.gz	XEDYSHNIVSNKMV-UHFFFAOYSA-N	0	3	293.410	3.751	40	0		CHABHN
CSc1ccc([C@@H]2NCCc3ccccc32)cc1	ZINC000019772825	170857207	/nfs/dbraw/zinc/85/72/07/170857207.db2.gz	RITXFPJDTKCQJJ-INIZCTEOSA-N	0	3	255.386	3.644	40	0		CHABHN
C[C@@H](NC(C)(C)C)C(=O)c1cc(Cl)cc(Cl)c1	ZINC000045302419	175355227	/nfs/dbraw/zinc/35/52/27/175355227.db2.gz	ZKFFJBXJJFDBJM-MRVPVSSYSA-N	0	3	274.191	3.953	40	0	in-vitro	CHABHN
CCCC1(C(=O)OCCN(CC)CC)CCCCC1	ZINC000001719273	567842282	/nfs/dbraw/zinc/84/22/82/567842282.db2.gz	RRFROFRULGOMKN-UHFFFAOYSA-N	0	3	269.429	3.622	40	0		CHABHN
CCC[C@](C)(C(=O)c1ccccc1)N1CCCCC1	ZINC000001622223	567839819	/nfs/dbraw/zinc/83/98/19/567839819.db2.gz	GTOCZCPMZCJJJG-QGZVFWFLSA-N	0	3	259.393	3.914	40	0		CHABHN
Fc1ccc(-c2cc([C@@H]3CCCCCN3)on2)cc1	ZINC000012133658	567862096	/nfs/dbraw/zinc/86/20/96/567862096.db2.gz	JQHVNJVSGSWEJX-ZDUSSCGKSA-N	0	3	260.312	3.685	40	0		CHABHN
Fc1ccc(-c2cc([C@H]3CCCCCN3)on2)cc1	ZINC000012133662	567862337	/nfs/dbraw/zinc/86/23/37/567862337.db2.gz	JQHVNJVSGSWEJX-CYBMUJFWSA-N	0	3	260.312	3.685	40	0		CHABHN
CN(Cc1ccccc1)C[C@@H](O)c1ccc(Cl)cc1	ZINC000031961902	567885516	/nfs/dbraw/zinc/88/55/16/567885516.db2.gz	WWYMRAQFSAKRMQ-MRXNPFEDSA-N	0	3	275.779	3.505	40	0		CHABHN
CCN1CC=C(c2nc3cc(C)cc(C)c3o2)CC1	ZINC000073636004	567893069	/nfs/dbraw/zinc/89/30/69/567893069.db2.gz	QPJORPPBUVEDTH-UHFFFAOYSA-N	0	3	256.349	3.554	40	0		CHABHN
CCCN1CC=C(c2nc3ccc(F)cc3s2)CC1	ZINC000073638885	567893675	/nfs/dbraw/zinc/89/36/75/567893675.db2.gz	ZJKBXDFWQHSHPW-UHFFFAOYSA-N	0	3	276.380	3.935	40	0		CHABHN
CCOc1cc(CNC[C@@H]2CCCO2)cc2ccccc21	ZINC000096527848	567897857	/nfs/dbraw/zinc/89/78/57/567897857.db2.gz	VHWOKDMIJJWSFO-INIZCTEOSA-N	0	3	285.387	3.507	40	0		CHABHN
CC(C)N1CCCC[C@@H]1c1cccnc1NC1CCC1	ZINC000072213918	567918853	/nfs/dbraw/zinc/91/88/53/567918853.db2.gz	JEQSLBQJRUUSGE-MRXNPFEDSA-N	0	3	273.424	3.981	40	0		CHABHN
CC(C)N1CCCC[C@@H]1c1cccnc1NC1CC1	ZINC000072213738	567919383	/nfs/dbraw/zinc/91/93/83/567919383.db2.gz	AZXVVTDPPRIPGL-OAHLLOKOSA-N	0	3	259.397	3.591	40	0		CHABHN
CCN1CCC[C@H]1c1ccc(SC(C)C)nc1	ZINC000072217473	567919702	/nfs/dbraw/zinc/91/97/02/567919702.db2.gz	XRFJEEBWVLLLOV-ZDUSSCGKSA-N	0	3	250.411	3.739	40	0		CHABHN
COc1ccc([C@H]2CCCN2Cc2ccccc2)c(C)n1	ZINC000072218066	567920082	/nfs/dbraw/zinc/92/00/82/567920082.db2.gz	SKESOOXQXBALIN-QGZVFWFLSA-N	0	3	282.387	3.736	40	0		CHABHN
CCN1CCCC[C@@H]1c1ccc(N2CCCCC2)nc1	ZINC000072216058	567920448	/nfs/dbraw/zinc/92/04/48/567920448.db2.gz	XUJVSWOCXJNOSD-MRXNPFEDSA-N	0	3	273.424	3.619	40	0		CHABHN
COc1ncc([C@@H]2CCCN2Cc2ccccc2)cc1C	ZINC000072217710	567920645	/nfs/dbraw/zinc/92/06/45/567920645.db2.gz	VKFCCANMAIBERQ-KRWDZBQOSA-N	0	3	282.387	3.736	40	0		CHABHN
CCSc1ncccc1[C@@H]1CCCN1CC(C)C	ZINC000072217184	567920964	/nfs/dbraw/zinc/92/09/64/567920964.db2.gz	GAHLGKNYILYNJE-AWEZNQCLSA-N	0	3	264.438	3.987	40	0		CHABHN
Cc1cc(NC(C)(C)C)ncc1[C@@H](N)c1ccccc1	ZINC000072223981	567922601	/nfs/dbraw/zinc/92/26/01/567922601.db2.gz	WBJQHVXETUCJGM-INIZCTEOSA-N	0	3	269.392	3.649	40	0		CHABHN
CC1=Nn2c3cc(Cl)ccc3nc2[C@H]2C=CCC=C12	ZINC000001097447	567937241	/nfs/dbraw/zinc/93/72/41/567937241.db2.gz	JJOQSCCEZNINCQ-LBPRGKRZSA-N	0	3	269.735	3.730	40	0		CHABHN
CCOP(=O)(C=CNC1CCCCC1)OCC	ZINC000016998166	570226373	/nfs/dbraw/zinc/22/63/73/570226373.db2.gz	GCOCYGLSBKOTBU-KHPPLWFESA-N	0	3	261.302	3.646	40	0		CHABHN
Cc1cccc(Oc2ccc([C@H]3CCCCN3)cn2)c1	ZINC000257197941	190010060	/nfs/dbraw/zinc/01/00/60/190010060.db2.gz	OBLXLISZKREQEI-MRXNPFEDSA-N	0	3	268.360	3.997	40	0		CHABHN
Cc1ccc(CN2CCC[C@H](c3ccnc(C)n3)C2)s1	ZINC000257307193	190031554	/nfs/dbraw/zinc/03/15/54/190031554.db2.gz	SXPAADJENOAHFO-AWEZNQCLSA-N	0	3	287.432	3.535	40	0		CHABHN
Cc1ccc(CN2CCC[C@@H](c3ccnc(C)n3)C2)s1	ZINC000257307194	190031183	/nfs/dbraw/zinc/03/11/83/190031183.db2.gz	SXPAADJENOAHFO-CQSZACIVSA-N	0	3	287.432	3.535	40	0		CHABHN
c1ccc(COc2ccccc2CNC2CC2)cc1	ZINC000004746617	170011209	/nfs/dbraw/zinc/01/12/09/170011209.db2.gz	KDVTZUXJTDAKCP-UHFFFAOYSA-N	0	3	253.345	3.518	40	0		CHABHN
CCCCC(=O)Nc1ccc(CN2CCCCC2)cc1	ZINC000006591902	170217486	/nfs/dbraw/zinc/21/74/86/170217486.db2.gz	KILALKZLGKPXQT-UHFFFAOYSA-N	0	3	274.408	3.801	40	0		CHABHN
CCOc1ccc(Br)cc1CN[C@@H](C)CC	ZINC000008326685	170331309	/nfs/dbraw/zinc/33/13/09/170331309.db2.gz	NIFRYWJSKNMIJW-JTQLQIEISA-N	0	3	286.213	3.736	40	0		CHABHN
COc1cc2c(cc1OC)CN(Cc1ccccc1)CCC2	ZINC000022050690	171350829	/nfs/dbraw/zinc/35/08/29/171350829.db2.gz	FRXHWVJZKYQAJG-UHFFFAOYSA-N	0	3	297.398	3.652	40	0	in-vitro	CHABHN
C[C@@H]1CCCN([C@@H](CN)c2cc(Cl)cc(Cl)c2)C1	ZINC000037424743	173199172	/nfs/dbraw/zinc/19/91/72/173199172.db2.gz	FNAYOLSGFCLSAS-YGRLFVJLSA-N	0	3	287.234	3.725	40	0		CHABHN
COc1ccccc1-c1cccc([C@@H]2CCCN(C)C2)n1	ZINC000072348556	176373628	/nfs/dbraw/zinc/37/36/28/176373628.db2.gz	VUHCJFPZTHNUJI-CQSZACIVSA-N	0	3	282.387	3.566	40	0		CHABHN
CN1CCC[C@@H](c2cnc(-c3ccccc3Cl)cn2)C1	ZINC000072382919	176388344	/nfs/dbraw/zinc/38/83/44/176388344.db2.gz	HGACKBMYPPLRHE-GFCCVEGCSA-N	0	3	287.794	3.606	40	0		CHABHN
CC(C)NCc1ccccc1OCCC(F)(F)F	ZINC000080936589	260182165	/nfs/dbraw/zinc/18/21/65/260182165.db2.gz	BSHWBOKCAZFYQJ-UHFFFAOYSA-N	0	3	261.287	3.516	40	0		CHABHN
COc1ccc2c(c1)CCN[C@H]2c1ccc(Cl)cc1	ZINC000019625712	566999465	/nfs/dbraw/zinc/99/94/65/566999465.db2.gz	RICTYUOVIOEWRA-INIZCTEOSA-N	0	3	273.763	3.584	40	0		CHABHN
CCCCN(CCCC)C(=N)c1c(OC)cccc1OC	ZINC000001583663	567838726	/nfs/dbraw/zinc/83/87/26/567838726.db2.gz	GSIKKPOQCRPINJ-UHFFFAOYSA-N	0	3	292.423	3.931	40	0		CHABHN
COc1ccc2c(ccc3c2CC[C@@]2(C)CCN=C32)c1	ZINC000001725925	567842790	/nfs/dbraw/zinc/84/27/90/567842790.db2.gz	ZACAJAJLRYUXFS-SFHVURJKSA-N	0	3	265.356	3.994	40	0		CHABHN
CNc1ncccc1[C@H]1CCCCN1Cc1ccccc1	ZINC000072212563	567918195	/nfs/dbraw/zinc/91/81/95/567918195.db2.gz	GQXHOCPFAXPEFT-QGZVFWFLSA-N	0	3	281.403	3.851	40	0		CHABHN
CCCCN1CCC[C@H]1c1cccnc1OC(C)C	ZINC000072211965	567918579	/nfs/dbraw/zinc/91/85/79/567918579.db2.gz	YLMJFHWUEORBEY-HNNXBMFYSA-N	0	3	262.397	3.806	40	0		CHABHN
CCCN1CCC[C@H]1c1cccnc1NC1CCC1	ZINC000072213900	567919177	/nfs/dbraw/zinc/91/91/77/567919177.db2.gz	JNEGTBDEUGWAEC-HNNXBMFYSA-N	0	3	259.397	3.593	40	0		CHABHN
CC(C)(C)Sc1ncccc1[C@H]1CCCCN1	ZINC000072217434	567920004	/nfs/dbraw/zinc/92/00/04/567920004.db2.gz	OGWDRJSSQBNCOJ-GFCCVEGCSA-N	0	3	250.411	3.787	40	0		CHABHN
CSc1ccc([C@H]2CCCN2CC(C)C)cn1	ZINC000072216884	567921131	/nfs/dbraw/zinc/92/11/31/567921131.db2.gz	GUVOPQBEKLDFGV-CYBMUJFWSA-N	0	3	250.411	3.596	40	0		CHABHN
Cc1cc(N)ncc1[C@@H]1CCCCN1Cc1ccccc1	ZINC000072218526	567921879	/nfs/dbraw/zinc/92/18/79/567921879.db2.gz	LXFACAOXDJECOJ-KRWDZBQOSA-N	0	3	281.403	3.699	40	0		CHABHN
N[C@H](c1ccccc1)c1ccc(OCc2ccccc2)nc1	ZINC000072225397	567922770	/nfs/dbraw/zinc/92/27/70/567922770.db2.gz	CUDSFAFYIALOFR-LJQANCHMSA-N	0	3	290.366	3.709	40	0		CHABHN
Cc1cc(NC(C)(C)C)ncc1[C@H](N)c1ccccc1	ZINC000072223980	567922784	/nfs/dbraw/zinc/92/27/84/567922784.db2.gz	WBJQHVXETUCJGM-MRXNPFEDSA-N	0	3	269.392	3.649	40	0		CHABHN
CC(C)[C@H](N)C(=O)N(C(C)C)[C@H](C)c1cccc(Cl)c1	ZINC000079418696	570235080	/nfs/dbraw/zinc/23/50/80/570235080.db2.gz	HOUGXEVCNRRANU-DOMZBBRYSA-N	0	3	296.842	3.621	40	0		CHABHN
CCCN1CCCC[C@@H]1c1ccc(SC)nc1	ZINC000072216899	256710737	/nfs/dbraw/zinc/71/07/37/256710737.db2.gz	FARFSKADGKVFGN-CYBMUJFWSA-N	0	3	250.411	3.741	40	0		CHABHN
C([C@H]1CO[C@]2(CC[C@@H]3CCCC[C@@H]3C2)O1)N1CCCCC1	ZINC000004713521	170003434	/nfs/dbraw/zinc/00/34/34/170003434.db2.gz	XBGMCAWJVPHBRD-XWTMOSNGSA-N	0	3	293.451	3.574	40	0		CHABHN
COC(=O)c1ccc(-c2ccc(CNC(C)(C)C)o2)cc1	ZINC000006882567	170252337	/nfs/dbraw/zinc/25/23/37/170252337.db2.gz	JBXPHFGCNVUICG-UHFFFAOYSA-N	0	3	287.359	3.621	40	0		CHABHN
COc1cc(CNC2CC2)ccc1OCc1ccccc1	ZINC000008471970	170336753	/nfs/dbraw/zinc/33/67/53/170336753.db2.gz	XFEHLCGMEAXYNK-UHFFFAOYSA-N	0	3	283.371	3.526	40	0		CHABHN
CC[C@H](C)n1c2ccc(Cl)cc2nc1[C@H](C)N	ZINC000040408278	174253995	/nfs/dbraw/zinc/25/39/95/174253995.db2.gz	UTULRFIGBDTCCG-IUCAKERBSA-N	0	3	251.761	3.680	40	0		CHABHN
Cc1ccc(Cc2cccc([C@H]3CCCN3C)n2)cc1	ZINC000072357510	176376051	/nfs/dbraw/zinc/37/60/51/176376051.db2.gz	NTRRQRSESHIGMA-GOSISDBHSA-N	0	3	266.388	3.748	40	0		CHABHN
CC(C)N1CCC[C@@H]1c1cccc(NCc2ccncc2)n1	ZINC000072364980	176380010	/nfs/dbraw/zinc/38/00/10/176380010.db2.gz	VYIFJYDUAXLIML-QGZVFWFLSA-N	0	3	296.418	3.634	40	0		CHABHN
CCCN1CCC[C@@H]1c1ccc(SCC)nc1	ZINC000072217122	567920980	/nfs/dbraw/zinc/92/09/80/567920980.db2.gz	HTKYFDSUNVNCOG-CYBMUJFWSA-N	0	3	250.411	3.741	40	0		CHABHN
CCCCNc1ncccc1[C@@H]1CCCCN1CC	ZINC000072213614	567918766	/nfs/dbraw/zinc/91/87/66/567918766.db2.gz	GTQNORYTBPQAAV-HNNXBMFYSA-N	0	3	261.413	3.841	40	0		CHABHN
C[C@H]1CCCN([C@H](CN)c2ccc(Cl)c(Cl)c2)C1	ZINC000108349953	567103623	/nfs/dbraw/zinc/10/36/23/567103623.db2.gz	QUIZRRFSKOTIJC-IINYFYTJSA-N	0	3	287.234	3.725	40	0		CHABHN
CCN(CC)CCC(=O)c1cccc2ccccc21	ZINC000001628195	567839723	/nfs/dbraw/zinc/83/97/23/567839723.db2.gz	NCHQFIZSGLIKAS-UHFFFAOYSA-N	0	3	255.361	3.754	40	0		CHABHN
CC[C@H](C)[C@H](C(=O)OCCN(CC)CC)c1ccccc1	ZINC000001649106	567840075	/nfs/dbraw/zinc/84/00/75/567840075.db2.gz	LKQUJKDIEHGPLY-RDJZCZTQSA-N	0	3	291.435	3.701	40	0		CHABHN
CCCN(CCC)CC(=O)Nc1cccc(Cl)c1C	ZINC000001668549	567840842	/nfs/dbraw/zinc/84/08/42/567840842.db2.gz	YQXIHPFOZOYMKX-UHFFFAOYSA-N	0	3	282.815	3.709	40	0		CHABHN
C[n+]1ccc(/C=C/c2ccc([O-])c3ccccc23)cc1	ZINC000001713039	567842383	/nfs/dbraw/zinc/84/23/83/567842383.db2.gz	RAMJSMYFUWBUPM-UHFFFAOYSA-O	0	3	262.332	3.540	40	0		CHABHN
CC[C@H]1[C@H](O)C[C@H](c2ccccc2)N[C@@H]1c1ccccc1	ZINC000004119589	567855253	/nfs/dbraw/zinc/85/52/53/567855253.db2.gz	OKNRTYWYWMOJGO-WJFTUGDTSA-N	0	3	281.399	3.849	40	0		CHABHN
C[C@H]1C(O)[C@@H](C)[C@@H](c2ccccc2)N[C@@H]1c1ccccc1	ZINC000004119586	567855325	/nfs/dbraw/zinc/85/53/25/567855325.db2.gz	GGCLDJYYOISOSI-KXJAXRNWSA-N	0	3	281.399	3.705	40	0		CHABHN
CCCCOC(=O)C[C@@H](c1ccccc1)N1CCCCC1	ZINC000004212244	567855677	/nfs/dbraw/zinc/85/56/77/567855677.db2.gz	WQDZHQZKJMNOAY-KRWDZBQOSA-N	0	3	289.419	3.947	40	0	in-man	CHABHN
Fc1ccc(C2CCN(Cc3ccncc3)CC2)cc1	ZINC000012113953	567862257	/nfs/dbraw/zinc/86/22/57/567862257.db2.gz	LNBLZVDGULAKKG-UHFFFAOYSA-N	0	3	270.351	3.600	40	0		CHABHN
C[C@@H](C(=O)Nc1cccc(Cl)c1)N1C[C@@H](C)C[C@H](C)C1	ZINC000016475843	567873102	/nfs/dbraw/zinc/87/31/02/567873102.db2.gz	MXNXUGZLEBGSEG-AVGNSLFASA-N	0	3	294.826	3.645	40	0		CHABHN
CCOc1cc(CNC[C@H]2CCCO2)cc2ccccc21	ZINC000096527850	567897898	/nfs/dbraw/zinc/89/78/98/567897898.db2.gz	VHWOKDMIJJWSFO-MRXNPFEDSA-N	0	3	285.387	3.507	40	0		CHABHN
CN(C)c1ncccc1[C@H]1CCCCN1Cc1ccccc1	ZINC000072212683	567918062	/nfs/dbraw/zinc/91/80/62/567918062.db2.gz	DCUQEPYYYKKNMG-GOSISDBHSA-N	0	3	295.430	3.875	40	0		CHABHN
CNc1ccc([C@@H]2CCCCN2Cc2ccccc2)cn1	ZINC000072212502	567918123	/nfs/dbraw/zinc/91/81/23/567918123.db2.gz	GULMEQUYLBFWMK-KRWDZBQOSA-N	0	3	281.403	3.851	40	0		CHABHN
c1ccc(Oc2ccc([C@H]3CCCCN3)cn2)cc1	ZINC000072212152	567918432	/nfs/dbraw/zinc/91/84/32/567918432.db2.gz	LPMDCCWZEGVRIN-OAHLLOKOSA-N	0	3	254.333	3.689	40	0		CHABHN
CCN1CCC[C@H]1c1cccnc1OCc1ccccc1	ZINC000072212071	567918520	/nfs/dbraw/zinc/91/85/20/567918520.db2.gz	FIQUTTFKMAYIAA-KRWDZBQOSA-N	0	3	282.387	3.817	40	0		CHABHN
CC[C@H](C)Nc1ncccc1[C@@H]1CCCN1C(C)C	ZINC000072213392	567918819	/nfs/dbraw/zinc/91/88/19/567918819.db2.gz	KLGIBIMDMHAGNL-ZFWWWQNUSA-N	0	3	261.413	3.837	40	0		CHABHN
CCCN1CCCC[C@@H]1c1cccnc1NC1CCC1	ZINC000072213916	567919059	/nfs/dbraw/zinc/91/90/59/567919059.db2.gz	WIIPSPUJVRHJEB-MRXNPFEDSA-N	0	3	273.424	3.983	40	0		CHABHN
CCCCN1CCCC[C@@H]1c1cnc(OC)cc1C	ZINC000072218040	567919492	/nfs/dbraw/zinc/91/94/92/567919492.db2.gz	YNOFBPFVXZURAW-OAHLLOKOSA-N	0	3	262.397	3.726	40	0		CHABHN
CN1CCC[C@@H]1c1ccc(Nc2ccccc2)nc1	ZINC000072214063	567919654	/nfs/dbraw/zinc/91/96/54/567919654.db2.gz	XIIKQNIHMBFIOB-OAHLLOKOSA-N	0	3	253.349	3.592	40	0		CHABHN
CCCN1CCC[C@H]1c1cccnc1N1CCCCC1	ZINC000072216104	567920256	/nfs/dbraw/zinc/92/02/56/567920256.db2.gz	IGGSKFWJCFUHCB-INIZCTEOSA-N	0	3	273.424	3.619	40	0		CHABHN
CCN1CCC[C@@H]1c1ccc(N2CCCCCC2)nc1	ZINC000072216633	567920476	/nfs/dbraw/zinc/92/04/76/567920476.db2.gz	NDGBCULDKIDPPN-MRXNPFEDSA-N	0	3	273.424	3.619	40	0		CHABHN
CCN1CCCC[C@H]1c1ccc(N2CCCCC2)nc1	ZINC000072216059	567920751	/nfs/dbraw/zinc/92/07/51/567920751.db2.gz	XUJVSWOCXJNOSD-INIZCTEOSA-N	0	3	273.424	3.619	40	0		CHABHN
CCSc1ccc([C@H]2CCCN2C(C)C)cn1	ZINC000072217121	567921047	/nfs/dbraw/zinc/92/10/47/567921047.db2.gz	RGVJOHMSTSIWDR-CYBMUJFWSA-N	0	3	250.411	3.739	40	0		CHABHN
CCN1CCCC[C@@H]1c1ccc(N2CCCC2)nc1C	ZINC000072218936	567921499	/nfs/dbraw/zinc/92/14/99/567921499.db2.gz	BOCUKFDXSLRECS-MRXNPFEDSA-N	0	3	273.424	3.537	40	0		CHABHN
Cc1cc(N(C)C)ncc1[C@H]1CCCN1Cc1ccccc1	ZINC000072218670	567921546	/nfs/dbraw/zinc/92/15/46/567921546.db2.gz	XKSDZYINVYPGIZ-GOSISDBHSA-N	0	3	295.430	3.793	40	0		CHABHN
Cc1nc(N)ccc1[C@H]1CCCCN1Cc1ccccc1	ZINC000072218587	567921625	/nfs/dbraw/zinc/92/16/25/567921625.db2.gz	YHXULAKSYBDOCC-QGZVFWFLSA-N	0	3	281.403	3.699	40	0		CHABHN
Cc1cc(N)ncc1[C@H]1CCCCN1Cc1ccccc1	ZINC000072218527	567921898	/nfs/dbraw/zinc/92/18/98/567921898.db2.gz	LXFACAOXDJECOJ-QGZVFWFLSA-N	0	3	281.403	3.699	40	0		CHABHN
CCCN1CCCC[C@H]1c1cc(OC)ccc1OC	ZINC000072221884	567922149	/nfs/dbraw/zinc/92/21/49/567922149.db2.gz	NRXFBSZHTWEPNJ-HNNXBMFYSA-N	0	3	263.381	3.641	40	0		CHABHN
COc1ccc2[nH]c3c(c2c1)CCN1C[C@H]2CCCC[C@@H]2[C@@H]31	ZINC000004026530	567932546	/nfs/dbraw/zinc/93/25/46/567932546.db2.gz	HKCFIODYAGNXJQ-UHYGZKCKSA-N	0	3	296.414	3.896	40	0		CHABHN
COc1ccc([C@@H](N)c2cccc(C(F)(F)F)c2)cc1	ZINC000019415863	567944742	/nfs/dbraw/zinc/94/47/42/567944742.db2.gz	QJIFUHQJTOGINK-CQSZACIVSA-N	0	3	281.277	3.762	40	0		CHABHN
C[C@H]1CCCN([C@@H](CN)c2ccc(Cl)c(Cl)c2)C1	ZINC000020081653	567947002	/nfs/dbraw/zinc/94/70/02/567947002.db2.gz	QUIZRRFSKOTIJC-HZMBPMFUSA-N	0	3	287.234	3.725	40	0		CHABHN
CC(C)COc1ccccc1[C@@H](C)NC[C@@H]1CCCO1	ZINC000225162378	567952283	/nfs/dbraw/zinc/95/22/83/567952283.db2.gz	OKLWYSRAVNDOPU-CABCVRRESA-N	0	3	277.408	3.551	40	0		CHABHN
CCCCOc1ccccc1[C@H](C)NCCCOC	ZINC000225161406	567952501	/nfs/dbraw/zinc/95/25/01/567952501.db2.gz	PKEXOJXHQQZJEM-AWEZNQCLSA-N	0	3	265.397	3.553	40	0		CHABHN
CC[C@H](C)Oc1ccc([C@@H](C)NC[C@@H]2CCCO2)cc1	ZINC000225170587	567952689	/nfs/dbraw/zinc/95/26/89/567952689.db2.gz	BHVLXDWIQYEEEP-VBQJREDUSA-N	0	3	277.408	3.694	40	0		CHABHN
CC[C@@H](C)Oc1ccccc1[C@@H](C)NCCCOC	ZINC000225161652	189744753	/nfs/dbraw/zinc/74/47/53/189744753.db2.gz	RVPYOISYUKKLEQ-ZIAGYGMSSA-N	0	3	265.397	3.551	40	0		CHABHN
CCCCCC[C@@H](C)NCC(=O)Nc1ccccc1C	ZINC000005973083	170164665	/nfs/dbraw/zinc/16/46/65/170164665.db2.gz	KEAFRUJUNVFMKI-OAHLLOKOSA-N	0	3	276.424	3.882	40	0		CHABHN
C[C@@H]1CCC[C@H](C)N1Cc1ccc(N)cc1Br	ZINC000037515910	173247613	/nfs/dbraw/zinc/24/76/13/173247613.db2.gz	FPVDVIKKPOYZMN-PHIMTYICSA-N	0	3	297.240	3.794	40	0		CHABHN
CCC[C@@H](NCc1cnc(NCC)nc1)c1ccccc1	ZINC000062717560	333175860	/nfs/dbraw/zinc/17/58/60/333175860.db2.gz	OERWXDBLCLMWAV-MRXNPFEDSA-N	0	3	284.407	3.539	40	0		CHABHN
Cc1ccc(CN(Cc2sccc2C)C[C@@H](C)O)s1	ZINC000013991515	567912306	/nfs/dbraw/zinc/91/23/06/567912306.db2.gz	GZLALKNPGIAFGK-GFCCVEGCSA-N	0	3	295.473	3.809	40	0		CHABHN
CCSc1ccc([C@@H]2CCCN2CC(C)C)cn1	ZINC000072217124	567921050	/nfs/dbraw/zinc/92/10/50/567921050.db2.gz	XIGWRLFXWBMVER-AWEZNQCLSA-N	0	3	264.438	3.987	40	0		CHABHN
CCCN1CCCC[C@H]1c1cccnc1SC	ZINC000072216960	567921103	/nfs/dbraw/zinc/92/11/03/567921103.db2.gz	NQOCQQMVFUAUAX-ZDUSSCGKSA-N	0	3	250.411	3.741	40	0		CHABHN
C[C@H]1CCCN([C@H](CN)c2cccc(Cl)c2Cl)C1	ZINC000108349980	567103041	/nfs/dbraw/zinc/10/30/41/567103041.db2.gz	GKTKLFLXYDSQAX-GXFFZTMASA-N	0	3	287.234	3.725	40	0		CHABHN
CN(C)Cc1ccccc1COC(=O)/C=C/c1ccccc1	ZINC000001716132	567842301	/nfs/dbraw/zinc/84/23/01/567842301.db2.gz	ORXYOWNKJSEEPD-OUKQBFOZSA-N	0	3	295.382	3.505	40	0		CHABHN
NCc1c(-c2ccc(F)cc2)nc2sc3ccccc3n12	ZINC000002508655	567846272	/nfs/dbraw/zinc/84/62/72/567846272.db2.gz	YUZWHSWIIKPNLP-UHFFFAOYSA-N	0	3	297.358	3.814	40	0		CHABHN
C(=C/c1ccccc1)\CNCCNC/C=C/c1ccccc1	ZINC000019365692	567877545	/nfs/dbraw/zinc/87/75/45/567877545.db2.gz	OCPXRFLUCJRFJO-FNCQTZNRSA-N	0	3	292.426	3.592	40	0		CHABHN
CCN1CC=C(c2nc3cc(Cl)c(C)cc3[nH]2)CC1	ZINC000073636247	567893015	/nfs/dbraw/zinc/89/30/15/567893015.db2.gz	IARQSPNWZJVMMM-UHFFFAOYSA-N	0	3	275.783	3.634	40	0		CHABHN
CC[C@@H](N)c1cc2ccccc2n1C(=O)OC(C)(C)C	ZINC000096509790	567897435	/nfs/dbraw/zinc/89/74/35/567897435.db2.gz	ASFMTXUFPSDTNE-GFCCVEGCSA-N	0	3	274.364	3.834	40	0		CHABHN
CC(C)CNc1ncccc1[C@@H]1CCCN1C(C)C	ZINC000072213253	567917986	/nfs/dbraw/zinc/91/79/86/567917986.db2.gz	UAWUNIWKMNGZSC-HNNXBMFYSA-N	0	3	261.413	3.695	40	0		CHABHN
CCN(C)c1ncccc1[C@H]1CCCN1Cc1ccccc1	ZINC000072212766	567918314	/nfs/dbraw/zinc/91/83/14/567918314.db2.gz	TXDISWLOLSHQDY-GOSISDBHSA-N	0	3	295.430	3.875	40	0		CHABHN
CCCCN1CCC[C@H]1c1cccnc1N(CC)CC	ZINC000072212902	567918369	/nfs/dbraw/zinc/91/83/69/567918369.db2.gz	ILACHNVAPFDVAQ-INIZCTEOSA-N	0	3	275.440	3.865	40	0		CHABHN
CCCN1CCCC[C@H]1c1cccnc1NC1CC1	ZINC000072213737	567918738	/nfs/dbraw/zinc/91/87/38/567918738.db2.gz	WXOVPOGHKWDDNV-HNNXBMFYSA-N	0	3	259.397	3.593	40	0		CHABHN
CC[C@@H](C)Nc1ccc([C@@H]2CCCCN2CC)cn1	ZINC000072213533	567919010	/nfs/dbraw/zinc/91/90/10/567919010.db2.gz	ZRONWPSXWANAID-HIFRSBDPSA-N	0	3	261.413	3.839	40	0		CHABHN
CN1CCCC[C@H]1c1ccc(Nc2ccccc2)nc1	ZINC000072214093	567919830	/nfs/dbraw/zinc/91/98/30/567919830.db2.gz	KQFYUUSNMBEMMT-INIZCTEOSA-N	0	3	267.376	3.982	40	0		CHABHN
COc1ccc([C@@H]2CCCN2Cc2ccccc2)c(C)n1	ZINC000072218065	567919945	/nfs/dbraw/zinc/91/99/45/567919945.db2.gz	SKESOOXQXBALIN-KRWDZBQOSA-N	0	3	282.387	3.736	40	0		CHABHN
CSc1ccc([C@@H]2CCCCN2C(C)C)cn1	ZINC000072216902	567921166	/nfs/dbraw/zinc/92/11/66/567921166.db2.gz	QKXLLSQVJCQSRY-ZDUSSCGKSA-N	0	3	250.411	3.739	40	0		CHABHN
Cc1nc(N(C)C)ccc1[C@@H]1CCCN1Cc1ccccc1	ZINC000072218729	567921631	/nfs/dbraw/zinc/92/16/31/567921631.db2.gz	ZXLPGXHOXOAMHD-SFHVURJKSA-N	0	3	295.430	3.793	40	0		CHABHN
Cc1cc([C@@H]2CCCCN2Cc2ccccc2)cnc1N	ZINC000072218466	567921638	/nfs/dbraw/zinc/92/16/38/567921638.db2.gz	RJGYWBIHTYKHIT-KRWDZBQOSA-N	0	3	281.403	3.699	40	0		CHABHN
CCN1CCCC[C@H]1c1cnc(N2CCCCC2)c(C)c1	ZINC000072219177	567921894	/nfs/dbraw/zinc/92/18/94/567921894.db2.gz	GNGLWESGCAOIIN-KRWDZBQOSA-N	0	3	287.451	3.927	40	0		CHABHN
Cc1cc([C@H]2CCCN2Cc2ccccc2)cnc1N(C)C	ZINC000072218610	567921966	/nfs/dbraw/zinc/92/19/66/567921966.db2.gz	PNMZGNULPKHLST-GOSISDBHSA-N	0	3	295.430	3.793	40	0		CHABHN
COc1ccc(OC)c([C@@H]2CCCCN2CC(C)C)c1	ZINC000072221888	567922028	/nfs/dbraw/zinc/92/20/28/567922028.db2.gz	TVEOYQPSTBZMKH-INIZCTEOSA-N	0	3	277.408	3.887	40	0		CHABHN
Cc1cc([C@@H](N)c2ccccc2)cnc1N1CCCCCC1	ZINC000072222495	567922381	/nfs/dbraw/zinc/92/23/81/567922381.db2.gz	LYMFPDUYMRWGKA-SFHVURJKSA-N	0	3	295.430	3.819	40	0		CHABHN
CCCN(CCC)c1ccc([C@@H](N)c2ccccc2)cn1	ZINC000072225288	567922464	/nfs/dbraw/zinc/92/24/64/567922464.db2.gz	QCFIARLMRRHPGJ-SFHVURJKSA-N	0	3	283.419	3.756	40	0		CHABHN
CC[C@H](C)Oc1cccc([C@H](C)NC[C@@H]2CCCO2)c1	ZINC000225167915	567952849	/nfs/dbraw/zinc/95/28/49/567952849.db2.gz	JLUASHWRFHLWRX-ZQIUZPCESA-N	0	3	277.408	3.694	40	0		CHABHN
CC(C)[C@H]1C[C@@H](N)c2ccccc2N1C(=O)OC(C)(C)C	ZINC000252492252	570391465	/nfs/dbraw/zinc/39/14/65/570391465.db2.gz	MGPYHEWUULDAER-UKRRQHHQSA-N	0	3	290.407	3.856	40	0		CHABHN
CCCCOc1ccccc1[C@@H](C)NCCCOC	ZINC000225161368	189744537	/nfs/dbraw/zinc/74/45/37/189744537.db2.gz	PKEXOJXHQQZJEM-CQSZACIVSA-N	0	3	265.397	3.553	40	0		CHABHN
CCCCOc1cccc([C@H](C)NC[C@H]2CCCO2)c1	ZINC000225167424	189745094	/nfs/dbraw/zinc/74/50/94/189745094.db2.gz	UGDAUCKIQJGURM-WMLDXEAASA-N	0	3	277.408	3.695	40	0		CHABHN
C[C@@H](C(=O)c1c[nH]c2ccccc12)N1C[C@@H](C)C[C@H](C)C1	ZINC000005557329	170112955	/nfs/dbraw/zinc/11/29/55/170112955.db2.gz	BMYNOEXNAKSRKS-IHRRRGAJSA-N	0	3	284.403	3.717	40	0		CHABHN
Cc1cc(C)c(NC(=O)[C@@H]2CCCN2CC(C)C)c(C)c1	ZINC000005697534	170130517	/nfs/dbraw/zinc/13/05/17/170130517.db2.gz	SHQXUKQYDKBFSW-INIZCTEOSA-N	0	3	288.435	3.671	40	0		CHABHN
CCCNCc1ccccc1OCc1ccccc1F	ZINC000007262416	170274245	/nfs/dbraw/zinc/27/42/45/170274245.db2.gz	XSKKFIVGPJGFJB-UHFFFAOYSA-N	0	3	273.351	3.904	40	0		CHABHN
C[C@@H](c1cccc(OCc2ccccc2)c1)N(C)C	ZINC000022051343	171350530	/nfs/dbraw/zinc/35/05/30/171350530.db2.gz	KSGZYOKUQUKFBY-AWEZNQCLSA-N	0	3	255.361	3.888	40	0	in-vitro	CHABHN
C[C@@H]1C[C@@H](C)CN(Cc2ccc(N)cc2Br)C1	ZINC000037515909	173247551	/nfs/dbraw/zinc/24/75/51/173247551.db2.gz	DYZRRTDXJJNUOE-GHMZBOCLSA-N	0	3	297.240	3.509	40	0		CHABHN
Cc1cccc(-c2cccc([C@@H]3CCCN(C)C3)n2)c1	ZINC000072348547	176373489	/nfs/dbraw/zinc/37/34/89/176373489.db2.gz	QTJOGVGUNQJIRW-MRXNPFEDSA-N	0	3	266.388	3.866	40	0		CHABHN
CCCNc1ncccc1[C@@H]1CCCCN1C(C)C	ZINC000072213154	567917976	/nfs/dbraw/zinc/91/79/76/567917976.db2.gz	MMOCIWKHBDAZJF-HNNXBMFYSA-N	0	3	261.413	3.839	40	0		CHABHN
CC1=C[C@@H](C)[C@H](CN2CCO[C@@H]2C(C)C)[C@H](C)C1	ZINC000061854986	566822171	/nfs/dbraw/zinc/82/21/71/566822171.db2.gz	ZINAYKAEPVIUEM-LVQVYYBASA-N	0	3	251.414	3.539	40	0		CHABHN
CCOP(=O)(C=CNC1CCCCC1)OCC	ZINC000031319837	567044858	/nfs/dbraw/zinc/04/48/58/567044858.db2.gz	GCOCYGLSBKOTBU-ZHACJKMWSA-N	0	3	261.302	3.646	40	0		CHABHN
c1ccc2c(c1)[nH]c1c2CCN[C@H]1c1cccc2cccnc21	ZINC000020111401	567126855	/nfs/dbraw/zinc/12/68/55/567126855.db2.gz	MFLKAHOBCOBBJX-IBGZPJMESA-N	0	3	299.377	3.951	40	0	biogenic	CHABHN
COc1ccc(C[C@@H]2C3=C(CCCC3)CCN2C)cc1	ZINC000001611834	567839206	/nfs/dbraw/zinc/83/92/06/567839206.db2.gz	CRXXSGLBECOUQH-GOSISDBHSA-N	0	3	271.404	3.812	40	0		CHABHN
CCN(CC)CCC(=O)c1ccc(Cl)c(Cl)c1	ZINC000001635908	567840136	/nfs/dbraw/zinc/84/01/36/567840136.db2.gz	UCWCWHQLUZVUQN-UHFFFAOYSA-N	0	3	274.191	3.908	40	0		CHABHN
CC(=O)C(CCN(C)C)(c1ccccc1)c1ccccc1	ZINC000001675317	567841094	/nfs/dbraw/zinc/84/10/94/567841094.db2.gz	ZUVZZEPDCCMCJG-UHFFFAOYSA-N	0	3	281.399	3.513	40	0		CHABHN
CCN1CC=C(c2nc3ccc(F)cc3s2)CC1	ZINC000073638886	567893462	/nfs/dbraw/zinc/89/34/62/567893462.db2.gz	UWDSGAFYZBKMTM-UHFFFAOYSA-N	0	3	262.353	3.544	40	0		CHABHN
Cc1cncc([C@@H]2CCCN2Cc2ccccc2)c1	ZINC000072211332	567917616	/nfs/dbraw/zinc/91/76/16/567917616.db2.gz	WGQOXVXOBQPHQV-KRWDZBQOSA-N	0	3	252.361	3.727	40	0		CHABHN
CC(C)Oc1ccc([C@H]2CCCCN2C(C)C)cn1	ZINC000072211919	567917630	/nfs/dbraw/zinc/91/76/30/567917630.db2.gz	QIFGOQMSGVUKPP-OAHLLOKOSA-N	0	3	262.397	3.804	40	0		CHABHN
CCN1CCC[C@H]1c1ccc(N(C(C)C)C(C)C)nc1	ZINC000072212948	567918171	/nfs/dbraw/zinc/91/81/71/567918171.db2.gz	FXQSJNVYRPNRIR-INIZCTEOSA-N	0	3	275.440	3.862	40	0		CHABHN
CC(C)N(c1ncccc1[C@H]1CCCCN1)C(C)C	ZINC000072213029	567918425	/nfs/dbraw/zinc/91/84/25/567918425.db2.gz	WYPPABJRQGMXLY-OAHLLOKOSA-N	0	3	261.413	3.519	40	0		CHABHN
CCN1CCCC[C@@H]1c1ccc(NCC(C)C)nc1	ZINC000072213330	567919349	/nfs/dbraw/zinc/91/93/49/567919349.db2.gz	VSZXZKKBEVPYOD-OAHLLOKOSA-N	0	3	261.413	3.696	40	0		CHABHN
c1ccc(Nc2ncccc2[C@H]2CCCCN2)cc1	ZINC000072214151	567919688	/nfs/dbraw/zinc/91/96/88/567919688.db2.gz	FTBBXBTXDNOLIR-OAHLLOKOSA-N	0	3	253.349	3.640	40	0		CHABHN
CC(C)(C)Sc1ccc([C@@H]2CCCCN2)cn1	ZINC000072217373	567919931	/nfs/dbraw/zinc/91/99/31/567919931.db2.gz	XXMIDJNGHNKXOI-LBPRGKRZSA-N	0	3	250.411	3.787	40	0		CHABHN
CN(c1ccccc1)c1ccc([C@@H]2CCCN2C)cn1	ZINC000072214184	567920070	/nfs/dbraw/zinc/92/00/70/567920070.db2.gz	NZTASPBDOPFPFL-INIZCTEOSA-N	0	3	267.376	3.616	40	0		CHABHN
COc1ncc([C@H]2CCCN2Cc2ccccc2)cc1C	ZINC000072217711	567920195	/nfs/dbraw/zinc/92/01/95/567920195.db2.gz	VKFCCANMAIBERQ-QGZVFWFLSA-N	0	3	282.387	3.736	40	0		CHABHN
Cc1cc([C@@H]2CCCN2CC(C)C)cnc1Cl	ZINC000072217783	567920234	/nfs/dbraw/zinc/92/02/34/567920234.db2.gz	MFIYDXZLLXPSHG-ZDUSSCGKSA-N	0	3	252.789	3.836	40	0		CHABHN
CSc1ccc([C@H]2CCCCN2C(C)C)cn1	ZINC000072216901	567921004	/nfs/dbraw/zinc/92/10/04/567921004.db2.gz	QKXLLSQVJCQSRY-CYBMUJFWSA-N	0	3	250.411	3.739	40	0		CHABHN
CCN1CCCC[C@H]1c1ccc(N2CCCC2)nc1C	ZINC000072218937	567921901	/nfs/dbraw/zinc/92/19/01/567921901.db2.gz	BOCUKFDXSLRECS-INIZCTEOSA-N	0	3	273.424	3.537	40	0		CHABHN
COCCCN[C@H](C)c1ccccc1OC1CCCC1	ZINC000225161498	567952441	/nfs/dbraw/zinc/95/24/41/567952441.db2.gz	WSUXAZJPGICAPM-CQSZACIVSA-N	0	3	277.408	3.695	40	0		CHABHN
C[C@@H](NC[C@@H]1CCCO1)c1cccc(OC2CCCC2)c1	ZINC000225167478	567952783	/nfs/dbraw/zinc/95/27/83/567952783.db2.gz	LRNVTYKREVBMEX-KDOFPFPSSA-N	0	3	289.419	3.838	40	0		CHABHN
CC(C)[C@@H]1C[C@H](N)c2ccccc2N1C(=O)OC(C)(C)C	ZINC000252492253	570391374	/nfs/dbraw/zinc/39/13/74/570391374.db2.gz	MGPYHEWUULDAER-ZFWWWQNUSA-N	0	3	290.407	3.856	40	0		CHABHN
CC(C)[C@H]1COC2(C1)CCN(Cc1ccc(F)cc1)CC2	ZINC000096047904	185072690	/nfs/dbraw/zinc/07/26/90/185072690.db2.gz	UEZBNGBNVWKXSF-MRXNPFEDSA-N	0	3	291.410	3.853	40	0		CHABHN
CCCCOc1ccccc1[C@H](C)NC[C@@H]1CCCO1	ZINC000225162061	189744653	/nfs/dbraw/zinc/74/46/53/189744653.db2.gz	HIVCPSLTVHCDSA-GJZGRUSLSA-N	0	3	277.408	3.695	40	0		CHABHN
CC(C)COc1cccc([C@@H](C)NC[C@@H]2CCCO2)c1	ZINC000225167644	189745099	/nfs/dbraw/zinc/74/50/99/189745099.db2.gz	BDFLIQKTEPIHFU-PBHICJAKSA-N	0	3	277.408	3.551	40	0		CHABHN
Cc1cc(NC(=O)Nc2ccc(Cl)c(Cl)c2)n[nH]1	ZINC000006412789	170199410	/nfs/dbraw/zinc/19/94/10/170199410.db2.gz	UIZZVANKTJPXKT-UHFFFAOYSA-N	0	3	285.134	3.669	40	0		CHABHN
Cc1ccc(C(C)C)cc1[C@H](O)CN1CCCCC1	ZINC000006522867	170209602	/nfs/dbraw/zinc/20/96/02/170209602.db2.gz	KYZKBGNXPBDDHT-QGZVFWFLSA-N	0	3	261.409	3.638	40	0		CHABHN
CCCCNCc1cc(Br)ccc1OCC	ZINC000007261654	170273827	/nfs/dbraw/zinc/27/38/27/170273827.db2.gz	YEPGZKOUVASLRH-UHFFFAOYSA-N	0	3	286.213	3.738	40	0		CHABHN
Cc1nn(C)c(C)c1CN[C@H](C)c1ccc2c(c1)CCCC2	ZINC000008880138	170358074	/nfs/dbraw/zinc/35/80/74/170358074.db2.gz	XOXDIBPAIANJHB-CYBMUJFWSA-N	0	3	297.446	3.767	40	0		CHABHN
c1ccc(CN2CCCC[C@H]2c2ccncc2)cc1	ZINC000072211050	176342781	/nfs/dbraw/zinc/34/27/81/176342781.db2.gz	XAEJVXZQIVOGMD-KRWDZBQOSA-N	0	3	252.361	3.809	40	0		CHABHN
CCN(Cc1cccc(F)c1)Cc1cccc(F)c1	ZINC000061799833	521348156	/nfs/dbraw/zinc/34/81/56/521348156.db2.gz	RUFUOOQAEJFOCC-UHFFFAOYSA-N	0	3	261.315	3.987	40	0		CHABHN
CCCNc1ncccc1[C@H]1CCCCN1C(C)C	ZINC000072213155	567918135	/nfs/dbraw/zinc/91/81/35/567918135.db2.gz	MMOCIWKHBDAZJF-OAHLLOKOSA-N	0	3	261.413	3.839	40	0		CHABHN
CCCCN1CCC[C@@H]1c1cccnc1NC1CC1	ZINC000072213723	567919394	/nfs/dbraw/zinc/91/93/94/567919394.db2.gz	RDIAZRXASJIBCR-OAHLLOKOSA-N	0	3	259.397	3.593	40	0		CHABHN
c1ccc2sc([C@H]3CCN(Cc4cccnc4)C3)nc2c1	ZINC000049168953	560084945	/nfs/dbraw/zinc/08/49/45/560084945.db2.gz	ZIQSDGOMSCHWKF-AWEZNQCLSA-N	0	3	295.411	3.681	40	0	biogenic,in-vitro	CHABHN
CN(C)Cc1cn(-c2ccccc2)nc1-c1ccc(F)cc1	ZINC000027986995	566892699	/nfs/dbraw/zinc/89/26/99/566892699.db2.gz	PBHMKDUYKWHYEX-UHFFFAOYSA-N	0	3	295.361	3.740	40	0		CHABHN
C[C@H]1CCCN([C@@H](CN)c2ccc(Cl)cc2Cl)C1	ZINC000020081648	567112063	/nfs/dbraw/zinc/11/20/63/567112063.db2.gz	UJGDOGDFIJTPLX-HZMBPMFUSA-N	0	3	287.234	3.725	40	0		CHABHN
c1[nH]c2ccccc2c1[C@@H](c1ccccn1)N1CCCC1	ZINC000000101813	567818167	/nfs/dbraw/zinc/81/81/67/567818167.db2.gz	KMUFNTCIBVGBFX-SFHVURJKSA-N	0	3	277.371	3.748	40	0		CHABHN
CCN(CC)CCC(=O)c1ccc(OC)c2ccccc12	ZINC000001628198	567839737	/nfs/dbraw/zinc/83/97/37/567839737.db2.gz	MNLZCBCLCDEQHW-UHFFFAOYSA-N	0	3	285.387	3.763	40	0		CHABHN
Cc1cc(/C=C/C2=CCN(C)CC2)c(C)n1C1CC1	ZINC000012154303	567862333	/nfs/dbraw/zinc/86/23/33/567862333.db2.gz	OLLFHPJVCGGLMI-SNAWJCMRSA-N	0	3	256.393	3.715	40	0		CHABHN
NCc1cc(-c2ccccc2)c(C(F)(F)F)s1	ZINC000016158432	567872309	/nfs/dbraw/zinc/87/23/09/567872309.db2.gz	ZOHCUDFCDXHXKZ-UHFFFAOYSA-N	0	3	257.280	3.893	40	0		CHABHN
Cc1ccc(CN(C)[C@@H]2COC[C@H]2c2ccc(F)cc2)cc1	ZINC000019210124	567877316	/nfs/dbraw/zinc/87/73/16/567877316.db2.gz	UZMXGIYKFYCYJU-RBUKOAKNSA-N	0	3	299.389	3.749	40	0		CHABHN
CCN1CC=C(c2nc3cc(C)c(C)cc3o2)CC1	ZINC000073636008	567892972	/nfs/dbraw/zinc/89/29/72/567892972.db2.gz	GJMMIKAHFWPIHI-UHFFFAOYSA-N	0	3	256.349	3.554	40	0		CHABHN
CCCN1CC=C(c2nc3ccccc3s2)CC1	ZINC000073636251	567892999	/nfs/dbraw/zinc/89/29/99/567892999.db2.gz	QNRPDEXZTUQSNG-UHFFFAOYSA-N	0	3	258.390	3.795	40	0		CHABHN
Cc1ccsc1CN(Cc1sccc1C)C[C@H](C)O	ZINC000013991513	567912315	/nfs/dbraw/zinc/91/23/15/567912315.db2.gz	AMMIRMZXVDDNBN-ZDUSSCGKSA-N	0	3	295.473	3.809	40	0		CHABHN
CCCCN1CCCC[C@@H]1c1cccnc1OCC	ZINC000072211863	567917621	/nfs/dbraw/zinc/91/76/21/567917621.db2.gz	JIZSCYOCYBZTCG-OAHLLOKOSA-N	0	3	262.397	3.807	40	0		CHABHN
CC(C)CN1CCCC[C@@H]1c1cccnc1Cl	ZINC000072211519	567917816	/nfs/dbraw/zinc/91/78/16/567917816.db2.gz	JKMUYIKSQWZHRV-CYBMUJFWSA-N	0	3	252.789	3.918	40	0		CHABHN
Cc1ccncc1[C@H]1CCCN1Cc1ccccc1	ZINC000072211388	567917908	/nfs/dbraw/zinc/91/79/08/567917908.db2.gz	SLWSFWBQMBDCQU-QGZVFWFLSA-N	0	3	252.361	3.727	40	0		CHABHN
CCCCN1CCC[C@H]1c1cccnc1NCCC	ZINC000072213140	567918175	/nfs/dbraw/zinc/91/81/75/567918175.db2.gz	QMZAOKKRICTAQZ-HNNXBMFYSA-N	0	3	261.413	3.841	40	0		CHABHN
O=c1ccc([C@H]2CCCCN2Cc2ccccc2)c[nH]1	ZINC000072212274	567918383	/nfs/dbraw/zinc/91/83/83/567918383.db2.gz	QQZUJZSQCHLLLV-MRXNPFEDSA-N	0	3	268.360	3.514	40	0		CHABHN
CN1CCCC[C@@H]1c1ccc(NC2CCCC2)nc1	ZINC000072213972	567919213	/nfs/dbraw/zinc/91/92/13/567919213.db2.gz	VXPHLIDMTIWLBX-OAHLLOKOSA-N	0	3	259.397	3.593	40	0		CHABHN
CN1CCCC[C@@H]1c1ccc(N2CCCCCC2)nc1	ZINC000072216656	567920454	/nfs/dbraw/zinc/92/04/54/567920454.db2.gz	JSZKNZWRGNWSBD-MRXNPFEDSA-N	0	3	273.424	3.619	40	0		CHABHN
Cc1cc(Cl)ncc1[C@H]1CCCN1CC(C)C	ZINC000072217844	567920482	/nfs/dbraw/zinc/92/04/82/567920482.db2.gz	QAXQVDCTZOAMSO-CYBMUJFWSA-N	0	3	252.789	3.836	40	0		CHABHN
CNc1ccc([C@@H]2CCCN2Cc2ccccc2)c(C)n1	ZINC000072219089	567921603	/nfs/dbraw/zinc/92/16/03/567921603.db2.gz	BFVRLGVVVMKXLJ-KRWDZBQOSA-N	0	3	281.403	3.769	40	0		CHABHN
CCN1CCCC[C@H]1c1cnc(N2CCCCC2)cc1C	ZINC000072219237	567921701	/nfs/dbraw/zinc/92/17/01/567921701.db2.gz	PVIZCTHGELKOQT-KRWDZBQOSA-N	0	3	287.451	3.927	40	0		CHABHN
CCCCN1CCC[C@H]1c1c(OC)cccc1OC	ZINC000072221426	567921752	/nfs/dbraw/zinc/92/17/52/567921752.db2.gz	CPPIRHUPMGLVJS-ZDUSSCGKSA-N	0	3	263.381	3.641	40	0		CHABHN
CCN1CCC[C@H]1c1ccc(N2CCCCC2)nc1C	ZINC000072219272	567921778	/nfs/dbraw/zinc/92/17/78/567921778.db2.gz	BHIYMWBYGQCWBN-INIZCTEOSA-N	0	3	273.424	3.537	40	0		CHABHN
CCN1CCC[C@H]1c1cnc(N2CCCCC2)cc1C	ZINC000072219212	567921873	/nfs/dbraw/zinc/92/18/73/567921873.db2.gz	UCHFJJKMYARSRW-INIZCTEOSA-N	0	3	273.424	3.537	40	0		CHABHN
CCN1CCC[C@@H]1c1cnc(N2CCCCC2)cc1C	ZINC000072219211	567921904	/nfs/dbraw/zinc/92/19/04/567921904.db2.gz	UCHFJJKMYARSRW-MRXNPFEDSA-N	0	3	273.424	3.537	40	0		CHABHN
CCOc1ccc(C(=O)CCN2CCCCCC2)cc1	ZINC000000340691	567929639	/nfs/dbraw/zinc/92/96/39/567929639.db2.gz	VAFZAQNRXMHCPL-UHFFFAOYSA-N	0	3	275.392	3.534	40	0	aggregator	CHABHN
Cc1ccc(CN(CCN(C)C)Cc2cccs2)cc1	ZINC000023247835	567948683	/nfs/dbraw/zinc/94/86/83/567948683.db2.gz	YRALUGBYQPLUQB-UHFFFAOYSA-N	0	3	288.460	3.620	40	0		CHABHN
C[C@H](NC[C@H]1CCCO1)c1ccccc1OC1CCCC1	ZINC000225162320	567952527	/nfs/dbraw/zinc/95/25/27/567952527.db2.gz	RDERECKJMXNEPY-GOEBONIOSA-N	0	3	289.419	3.838	40	0		CHABHN
CN1CCC([C@H]2c3ccccc3CCc3cccnc32)CC1	ZINC000013775751	530051109	/nfs/dbraw/zinc/05/11/09/530051109.db2.gz	URXVQALXMZGZCV-IBGZPJMESA-N	0	3	292.426	3.654	40	0		CHABHN
C[C@@H]1C(O)[C@@H](C)[C@@H](c2ccccc2)N[C@@H]1c1ccccc1	ZINC000004119587	169935020	/nfs/dbraw/zinc/93/50/20/169935020.db2.gz	GGCLDJYYOISOSI-USJZOSNVSA-N	0	3	281.399	3.705	40	0		CHABHN
O=C(CCN1CC[C@@H]2CC[C@@H](C2)C1)c1ccccc1F	ZINC000004934830	170042329	/nfs/dbraw/zinc/04/23/29/170042329.db2.gz	HJBRVVDCPXNIPI-KBPBESRZSA-N	0	3	275.367	3.521	40	0		CHABHN
CNCc1ccccc1OCc1ccccc1Cl	ZINC000005910048	170154328	/nfs/dbraw/zinc/15/43/28/170154328.db2.gz	DDTXJFUFDZFHPW-UHFFFAOYSA-N	0	3	261.752	3.638	40	0		CHABHN
CNCc1ccc(-c2ccc(Br)c(C)c2)o1	ZINC000020875778	171277086	/nfs/dbraw/zinc/27/70/86/171277086.db2.gz	RTWQIRHEESQIHA-UHFFFAOYSA-N	0	3	280.165	3.737	40	0		CHABHN
COc1ccc(Cl)cc1CNCCc1ccccc1F	ZINC000022076428	171351933	/nfs/dbraw/zinc/35/19/33/171351933.db2.gz	ISDUIGUUCLVJJX-UHFFFAOYSA-N	0	3	293.769	3.820	40	0		CHABHN
C[C@H]1CCC[C@H](C)N1Cc1ccc(N)cc1Br	ZINC000037515911	173247578	/nfs/dbraw/zinc/24/75/78/173247578.db2.gz	FPVDVIKKPOYZMN-QWRGUYRKSA-N	0	3	297.240	3.794	40	0		CHABHN
Cc1cccc(-c2cccc([C@H]3CCCN(C)C3)n2)c1	ZINC000072348548	176373875	/nfs/dbraw/zinc/37/38/75/176373875.db2.gz	QTJOGVGUNQJIRW-INIZCTEOSA-N	0	3	266.388	3.866	40	0		CHABHN
CN1CCC[C@H](c2nccnc2-c2cccc(Cl)c2)C1	ZINC000072358368	176376459	/nfs/dbraw/zinc/37/64/59/176376459.db2.gz	WUGBIZSYOULTQC-ZDUSSCGKSA-N	0	3	287.794	3.606	40	0		CHABHN
COc1ccccc1-c1ccc(C2CCN(C)CC2)nc1	ZINC000072365119	176379912	/nfs/dbraw/zinc/37/99/12/176379912.db2.gz	FSVFBGNFNZJNSB-UHFFFAOYSA-N	0	3	282.387	3.566	40	0		CHABHN
CC(C)N1CCC[C@H]1c1cccc(NCc2ccncc2)n1	ZINC000072364981	176379926	/nfs/dbraw/zinc/37/99/26/176379926.db2.gz	VYIFJYDUAXLIML-KRWDZBQOSA-N	0	3	296.418	3.634	40	0		CHABHN
Cc1ccsc1CN(Cc1cccs1)C[C@H](C)O	ZINC000013991349	567912251	/nfs/dbraw/zinc/91/22/51/567912251.db2.gz	LAEMBVJICWTPIR-LBPRGKRZSA-N	0	3	281.446	3.501	40	0		CHABHN
CC1CCN(CCOC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000015782086	566897526	/nfs/dbraw/zinc/89/75/26/566897526.db2.gz	WKKORWDCSLRDMB-UHFFFAOYSA-N	0	3	296.798	3.620	40	0		CHABHN
CCCN1CCC[C@@H]1c1cccnc1N[C@H](C)CC	ZINC000108368492	567104220	/nfs/dbraw/zinc/10/42/20/567104220.db2.gz	NORPIJXUDNAOFT-UKRRQHHQSA-N	0	3	261.413	3.839	40	0		CHABHN
Clc1ccccc1CNCCCc1nc2ccccc2[nH]1	ZINC000062718657	567109191	/nfs/dbraw/zinc/10/91/91/567109191.db2.gz	KRPNMMZDCPTDIM-UHFFFAOYSA-N	0	3	299.805	3.939	40	0		CHABHN
C[C@@H](CN1c2ccccc2Sc2cccnc21)N(C)C	ZINC000000000404	567816436	/nfs/dbraw/zinc/81/64/36/567816436.db2.gz	OQJBSDFFQWMKBQ-LBPRGKRZSA-N	0	3	285.416	3.634	40	0	world	CHABHN
C[C@@H]1CCCN(Cc2ccccc2Br)C1	ZINC000042205912	567891183	/nfs/dbraw/zinc/89/11/83/567891183.db2.gz	WPQXIRYYMZJHNN-LLVKDONJSA-N	0	3	268.198	3.681	40	0		CHABHN
Cc1ccc(CN[C@@H]2COC[C@H]2c2ccc(F)cc2)cc1C	ZINC000019214036	567877617	/nfs/dbraw/zinc/87/76/17/567877617.db2.gz	JLCGMILHMHLZPV-RBUKOAKNSA-N	0	3	299.389	3.715	40	0		CHABHN
CN(Cc1ccccc1)C[C@@H](O)c1ccccc1Cl	ZINC000031912055	567885677	/nfs/dbraw/zinc/88/56/77/567885677.db2.gz	YZHZTOJXJQQTES-MRXNPFEDSA-N	0	3	275.779	3.505	40	0		CHABHN
Cc1cccnc1[C@@H]1CCCN1Cc1ccccc1	ZINC000072211121	567917594	/nfs/dbraw/zinc/91/75/94/567917594.db2.gz	ASHBIZXTLZJOPU-INIZCTEOSA-N	0	3	252.361	3.727	40	0		CHABHN
CCCCN1CCC[C@@H]1c1cccnc1OC(C)C	ZINC000072211964	567917993	/nfs/dbraw/zinc/91/79/93/567917993.db2.gz	YLMJFHWUEORBEY-OAHLLOKOSA-N	0	3	262.397	3.806	40	0		CHABHN
CCCN1CCCC[C@H]1c1cccnc1N(CC)CC	ZINC000072212915	567918227	/nfs/dbraw/zinc/91/82/27/567918227.db2.gz	SXSUIIVLJSQHCG-INIZCTEOSA-N	0	3	275.440	3.865	40	0		CHABHN
CCCN1CCCC[C@@H]1c1ccc(NC2CCC2)nc1	ZINC000072213856	567919190	/nfs/dbraw/zinc/91/91/90/567919190.db2.gz	ZICVQQHMNWOSBL-MRXNPFEDSA-N	0	3	273.424	3.983	40	0		CHABHN
CN1CCC[C@@H]1c1cccnc1NC1CCCCC1	ZINC000072214003	567919209	/nfs/dbraw/zinc/91/92/09/567919209.db2.gz	ZWMHTWULULHERO-OAHLLOKOSA-N	0	3	259.397	3.593	40	0		CHABHN
CCCN1CCCC[C@H]1c1ccc(NC2CCC2)nc1	ZINC000072213857	567919287	/nfs/dbraw/zinc/91/92/87/567919287.db2.gz	ZICVQQHMNWOSBL-INIZCTEOSA-N	0	3	273.424	3.983	40	0		CHABHN
CC(C)N1CCCC[C@@H]1c1ccc(NC2CC2)nc1	ZINC000072213798	567919308	/nfs/dbraw/zinc/91/93/08/567919308.db2.gz	PTTNMSQWJDHPPA-OAHLLOKOSA-N	0	3	259.397	3.591	40	0		CHABHN
N[C@H](c1ccccc1)c1ccc(N2CCCCCC2)nc1	ZINC000072225479	567921961	/nfs/dbraw/zinc/92/19/61/567921961.db2.gz	NUQLBPUUHBXNEG-GOSISDBHSA-N	0	3	281.403	3.510	40	0		CHABHN
CC(C)COc1ccc([C@H](C)NC[C@@H]2CCCO2)cc1	ZINC000020092444	567945358	/nfs/dbraw/zinc/94/53/58/567945358.db2.gz	HZESBAYBKQOVNF-YOEHRIQHSA-N	0	3	277.408	3.551	40	0		CHABHN
[O-]c1ccc(Cl)c2ccc(CC[NH+]3CCCCC3)nc12	ZINC000059474702	567956185	/nfs/dbraw/zinc/95/61/85/567956185.db2.gz	WGVJKPYSOPMSGR-UHFFFAOYSA-N	0	3	290.794	3.622	40	0		CHABHN
CCC(=O)C(CCN(C)C)(c1ccccc1)c1ccccc1	ZINC000001847280	570370665	/nfs/dbraw/zinc/37/06/65/570370665.db2.gz	WCJFBSYALHQBSK-UHFFFAOYSA-N	0	3	295.426	3.904	40	0	world	CHABHN
C[C@@H]1CCCN([C@H](CN)c2ccc(Cl)c(Cl)c2)C1	ZINC000242648364	256698843	/nfs/dbraw/zinc/69/88/43/256698843.db2.gz	QUIZRRFSKOTIJC-QMTHXVAHSA-N	0	3	287.234	3.725	40	0		CHABHN
CN1CCC[C@H](c2cccc(Cc3ccc(F)cc3)n2)C1	ZINC000072348572	176373471	/nfs/dbraw/zinc/37/34/71/176373471.db2.gz	JWUFYHSVNWVEOZ-HNNXBMFYSA-N	0	3	284.378	3.621	40	0		CHABHN
CN1CCC[C@H](c2cccc(-c3cccc(F)c3)n2)C1	ZINC000072348553	176373707	/nfs/dbraw/zinc/37/37/07/176373707.db2.gz	QQFZQZVZFZVBAY-AWEZNQCLSA-N	0	3	270.351	3.697	40	0		CHABHN
CCSc1ncc(CNCCC2=CCCCC2)cn1	ZINC000062717327	262299081	/nfs/dbraw/zinc/29/90/81/262299081.db2.gz	QHURJJOZGKQPJT-UHFFFAOYSA-N	0	3	277.437	3.569	40	0		CHABHN
CCCCN1CCCC[C@H]1c1cnc(OC)c(C)c1	ZINC000072217746	567920664	/nfs/dbraw/zinc/92/06/64/567920664.db2.gz	WLRPOAYLXWZBFG-HNNXBMFYSA-N	0	3	262.397	3.726	40	0		CHABHN
C[C@H](N)c1cc2cccc(Cl)c2c(=O)n1-c1ccccc1	ZINC000113217218	566863643	/nfs/dbraw/zinc/86/36/43/566863643.db2.gz	MZINZXIFJMLTOK-NSHDSACASA-N	0	3	298.773	3.664	40	0		CHABHN
Cc1cc([C@H](c2ccccc2)N(C)C)cc(C)c1O	ZINC000255189421	567110085	/nfs/dbraw/zinc/11/00/85/567110085.db2.gz	PUBUITBGPJKZIK-INIZCTEOSA-N	0	3	255.361	3.660	40	0		CHABHN
CSc1ccc([C@H]2NCCc3ccccc32)cc1	ZINC000019772826	567123088	/nfs/dbraw/zinc/12/30/88/567123088.db2.gz	RITXFPJDTKCQJJ-MRXNPFEDSA-N	0	3	255.386	3.644	40	0		CHABHN
CCOc1cc2c(cc1OC)CCN(C)[C@@H]2CC(C)C	ZINC000003847397	567854039	/nfs/dbraw/zinc/85/40/39/567854039.db2.gz	SVKASDAOKTXBIR-OAHLLOKOSA-N	0	3	277.408	3.669	40	0		CHABHN
CC(C)Oc1ncccc1[C@@H]1CCCCN1C(C)C	ZINC000072211980	567918422	/nfs/dbraw/zinc/91/84/22/567918422.db2.gz	BEMMMKCMKCGQSW-HNNXBMFYSA-N	0	3	262.397	3.804	40	0		CHABHN
CC(C)N1CCCC[C@H]1c1ccc(NC2CC2)nc1	ZINC000072213799	567918772	/nfs/dbraw/zinc/91/87/72/567918772.db2.gz	PTTNMSQWJDHPPA-HNNXBMFYSA-N	0	3	259.397	3.591	40	0		CHABHN
CCCCNc1ccc([C@H]2CCCCN2CC)cn1	ZINC000072213675	567918987	/nfs/dbraw/zinc/91/89/87/567918987.db2.gz	MBMDAUZLYVOHAX-OAHLLOKOSA-N	0	3	261.413	3.841	40	0		CHABHN
CN(c1ccccc1)c1ncccc1C1=NCCCC1	ZINC000072214269	567919495	/nfs/dbraw/zinc/91/94/95/567919495.db2.gz	CKTGMTLBCICPJG-UHFFFAOYSA-N	0	3	265.360	3.823	40	0		CHABHN
CCN1CCC[C@H]1c1cccnc1Nc1ccccc1	ZINC000072214130	567919696	/nfs/dbraw/zinc/91/96/96/567919696.db2.gz	JLGZLQINNHAURH-INIZCTEOSA-N	0	3	267.376	3.982	40	0		CHABHN
CCCCN1CCCC[C@H]1c1ccc(OC)nc1C	ZINC000072218101	567919782	/nfs/dbraw/zinc/91/97/82/567919782.db2.gz	PGEDJJHDWPCGSS-HNNXBMFYSA-N	0	3	262.397	3.726	40	0		CHABHN
CN1CCC[C@H]1c1cccnc1Nc1ccccc1	ZINC000072214124	567920037	/nfs/dbraw/zinc/92/00/37/567920037.db2.gz	CIIHZEFUUKFYLH-HNNXBMFYSA-N	0	3	253.349	3.592	40	0		CHABHN
CCCCN1CCCC[C@@H]1c1cnc(OC)c(C)c1	ZINC000072217745	567920122	/nfs/dbraw/zinc/92/01/22/567920122.db2.gz	WLRPOAYLXWZBFG-OAHLLOKOSA-N	0	3	262.397	3.726	40	0		CHABHN
CSc1ncccc1[C@@H]1CCCCN1C(C)C	ZINC000072216962	567921042	/nfs/dbraw/zinc/92/10/42/567921042.db2.gz	ZSXAXJUGCFLXHX-ZDUSSCGKSA-N	0	3	250.411	3.739	40	0		CHABHN
Cc1cc([C@H]2CCCCN2C(C)C)cnc1N1CCCC1	ZINC000072218821	567921593	/nfs/dbraw/zinc/92/15/93/567921593.db2.gz	UEMCCGXZFJMUHD-QGZVFWFLSA-N	0	3	287.451	3.926	40	0		CHABHN
CCCN1CCCC[C@H]1c1c(OC)cccc1OC	ZINC000072221437	567921761	/nfs/dbraw/zinc/92/17/61/567921761.db2.gz	YFXGOEPGTDXKKS-ZDUSSCGKSA-N	0	3	263.381	3.641	40	0		CHABHN
Cc1nc(N2CCCCC2)ccc1[C@@H]1CCCCN1C	ZINC000072219294	567921842	/nfs/dbraw/zinc/92/18/42/567921842.db2.gz	UYHMXXMEPCPVBC-INIZCTEOSA-N	0	3	273.424	3.537	40	0		CHABHN
CCCN(CCC)c1ccc([C@H](N)c2ccccc2)cn1	ZINC000072225287	567922518	/nfs/dbraw/zinc/92/25/18/567922518.db2.gz	QCFIARLMRRHPGJ-GOSISDBHSA-N	0	3	283.419	3.756	40	0		CHABHN
N[C@@H](c1ccccc1)c1ccc(OCc2ccccc2)nc1	ZINC000072225398	567922534	/nfs/dbraw/zinc/92/25/34/567922534.db2.gz	CUDSFAFYIALOFR-IBGZPJMESA-N	0	3	290.366	3.709	40	0		CHABHN
Cc1ccsc1CN(CCN(C)C)Cc1cccs1	ZINC000023247845	567948634	/nfs/dbraw/zinc/94/86/34/567948634.db2.gz	DTMCSCQWGVAGIL-UHFFFAOYSA-N	0	3	294.489	3.682	40	0		CHABHN
CC[C@H](C)Oc1ccc([C@H](C)NC[C@@H]2CCCO2)cc1	ZINC000225170657	567952658	/nfs/dbraw/zinc/95/26/58/567952658.db2.gz	BHVLXDWIQYEEEP-ZQIUZPCESA-N	0	3	277.408	3.694	40	0		CHABHN
CCN(CC)CCOC(=O)C[C@H](C)c1cc(C)ccc1C	ZINC000255190704	570323324	/nfs/dbraw/zinc/32/33/24/570323324.db2.gz	YXNWRLYGRLVNMZ-INIZCTEOSA-N	0	3	291.435	3.682	40	0		CHABHN
CC[C@H](C)Nc1cc(N2CCc3ccccc3C2)nc(C)n1	ZINC000244420075	136386403	/nfs/dbraw/zinc/38/64/03/136386403.db2.gz	YTAZBEXXALZAIB-ZDUSSCGKSA-N	0	3	296.418	3.558	40	0		CHABHN
CCC[C@H](NCc1cnc(SC)nc1)c1ccccc1	ZINC000062717242	256722157	/nfs/dbraw/zinc/72/21/57/256722157.db2.gz	CWMSLHSKHGNKAM-HNNXBMFYSA-N	0	3	287.432	3.830	40	0		CHABHN
Cc1ccc2c(c1)nc1n2C(=O)[C@]2(C)CC[C@H]1C2(C)C	ZINC000006413541	170199682	/nfs/dbraw/zinc/19/96/82/170199682.db2.gz	XTWQSORRZBPXII-DIFFPNOSSA-N	0	3	268.360	3.908	40	0		CHABHN
CN(C)CCC(=O)c1ccc(C2CCCCC2)cc1	ZINC000006592101	170217557	/nfs/dbraw/zinc/21/75/57/170217557.db2.gz	GPORLFPFUPAQRA-UHFFFAOYSA-N	0	3	259.393	3.869	40	0		CHABHN
CCN(CC)CC(=O)N(C1CCCCC1)C1CCCCC1	ZINC000006660005	170223044	/nfs/dbraw/zinc/22/30/44/170223044.db2.gz	QAUDLDRYBDIOMF-UHFFFAOYSA-N	0	3	294.483	3.822	40	0		CHABHN
CCCCCCNCc1cccc(OC)c1OCC	ZINC000007261075	170273921	/nfs/dbraw/zinc/27/39/21/170273921.db2.gz	NKRRGYNMSUCXLS-UHFFFAOYSA-N	0	3	265.397	3.764	40	0		CHABHN
Cc1c(Cl)cccc1-c1ccc(CNC(C)(C)CO)o1	ZINC000007538800	170290381	/nfs/dbraw/zinc/29/03/81/170290381.db2.gz	CXGVBSYSOMVKOR-UHFFFAOYSA-N	0	3	293.794	3.769	40	0		CHABHN
CCOc1c(Cl)cc(Cl)cc1CNC1CC1	ZINC000008253409	170327242	/nfs/dbraw/zinc/32/72/42/170327242.db2.gz	CAEHYBPHGGRABE-UHFFFAOYSA-N	0	3	260.164	3.644	40	0		CHABHN
COc1ccc(-c2cccc([C@H]3CCCN(C)C3)n2)cc1	ZINC000072348559	176373455	/nfs/dbraw/zinc/37/34/55/176373455.db2.gz	AWEYGYLEOJNSNG-HNNXBMFYSA-N	0	3	282.387	3.566	40	0		CHABHN
CN1CCC[C@@H](c2cccc(Cc3cccc(F)c3)n2)C1	ZINC000072348576	176373744	/nfs/dbraw/zinc/37/37/44/176373744.db2.gz	FYVKJQSHEDNGSG-OAHLLOKOSA-N	0	3	284.378	3.621	40	0		CHABHN
Cc1ccc(C(=O)Nc2ccc3nc(C)cc(N)c3c2)cc1	ZINC000072414091	176398914	/nfs/dbraw/zinc/39/89/14/176398914.db2.gz	CPFGKNKBGHZQGA-UHFFFAOYSA-N	0	3	291.354	3.686	40	0		CHABHN
CNCc1cnc(SC2CCCCC2)cc1C	ZINC000072223849	567922802	/nfs/dbraw/zinc/92/28/02/567922802.db2.gz	IXHUTBACQBTZOO-UHFFFAOYSA-N	0	3	250.411	3.534	40	0		CHABHN
CCCCN1CCC[C@H]1c1cc(OC)ccc1OC	ZINC000057621210	566842335	/nfs/dbraw/zinc/84/23/35/566842335.db2.gz	YUEUWBBCKUTPEO-HNNXBMFYSA-N	0	3	263.381	3.641	40	0		CHABHN
C[C@@H]1CCCN([C@H](CN)c2ccc(Cl)cc2Cl)C1	ZINC000242687496	567066854	/nfs/dbraw/zinc/06/68/54/567066854.db2.gz	UJGDOGDFIJTPLX-QMTHXVAHSA-N	0	3	287.234	3.725	40	0		CHABHN
O=C1C(Cc2ccc(F)cc2)Sc2nc3ccccc3n21	ZINC000000034372	567074301	/nfs/dbraw/zinc/07/43/01/567074301.db2.gz	RKSSJIOPLVMIQL-CQSZACIVSA-N	0	3	298.342	3.533	40	0		CHABHN
Cc1cc2c(cc1C)CN(CCc1ccccc1)C2	ZINC000006611620	567076293	/nfs/dbraw/zinc/07/62/93/567076293.db2.gz	NEHQDNVXJKNBAH-UHFFFAOYSA-N	0	3	251.373	3.862	40	0		CHABHN
CCOC(=O)[C@@H](CNCc1ccccc1)C1CCCCC1	ZINC000001593555	567839019	/nfs/dbraw/zinc/83/90/19/567839019.db2.gz	AJDXXPIOSIREGY-KRWDZBQOSA-N	0	3	289.419	3.536	40	0		CHABHN
Cc1ccc([C@H](CN(C)C)C(=O)c2ccccc2)cc1C	ZINC000001669466	567840737	/nfs/dbraw/zinc/84/07/37/567840737.db2.gz	WCLJTAOTFJCZJL-SFHVURJKSA-N	0	3	281.399	3.832	40	0		CHABHN
C[C@H]1C(O)[C@@H](C)[C@@H](c2cccs2)N[C@@H]1c1cccs1	ZINC000004099760	567855003	/nfs/dbraw/zinc/85/50/03/567855003.db2.gz	CPNYMZKNSCYTRC-AMQKRFAPSA-N	0	3	293.457	3.828	40	0		CHABHN
COc1cccc(C(=O)[C@@H](C)CN(C)Cc2ccccc2)c1	ZINC000077028761	567890546	/nfs/dbraw/zinc/89/05/46/567890546.db2.gz	LPCUZXHCGXGQPJ-HNNXBMFYSA-N	0	3	297.398	3.646	40	0		CHABHN
CCCCN1CCCC[C@H]1c1ccc(OCC)nc1	ZINC000072211804	567917415	/nfs/dbraw/zinc/91/74/15/567917415.db2.gz	YDCHWPGNUJLEBB-HNNXBMFYSA-N	0	3	262.397	3.807	40	0		CHABHN
CCCCN1CCCC[C@H]1c1cccnc1OCC	ZINC000072211864	567917740	/nfs/dbraw/zinc/91/77/40/567917740.db2.gz	JIZSCYOCYBZTCG-HNNXBMFYSA-N	0	3	262.397	3.807	40	0		CHABHN
CC(C)N(c1ccc([C@@H]2CCCCN2C)cn1)C(C)C	ZINC000072212970	567918604	/nfs/dbraw/zinc/91/86/04/567918604.db2.gz	NSIKWAUSYNIPQK-INIZCTEOSA-N	0	3	275.440	3.862	40	0		CHABHN
CCN1CCCC[C@H]1c1cccnc1NCC(C)C	ZINC000072213271	567918822	/nfs/dbraw/zinc/91/88/22/567918822.db2.gz	BVJKSJNEVTYBPE-HNNXBMFYSA-N	0	3	261.413	3.696	40	0		CHABHN
CCN1CCCC[C@H]1c1cccnc1NC1CCC1	ZINC000072213915	567919054	/nfs/dbraw/zinc/91/90/54/567919054.db2.gz	QIQPXMKILYEWBF-HNNXBMFYSA-N	0	3	259.397	3.593	40	0		CHABHN
CCN1CCC[C@@H]1c1ccc(SC(C)C)nc1	ZINC000072217472	567919443	/nfs/dbraw/zinc/91/94/43/567919443.db2.gz	XRFJEEBWVLLLOV-CYBMUJFWSA-N	0	3	250.411	3.739	40	0		CHABHN
CCCN1CCCC[C@@H]1c1ccc(Cl)nc1C	ZINC000072217918	567920341	/nfs/dbraw/zinc/92/03/41/567920341.db2.gz	LHNPETNSBCQQIC-CYBMUJFWSA-N	0	3	252.789	3.980	40	0		CHABHN
CCN1CCC[C@@H]1c1cccnc1SC(C)C	ZINC000072217532	567920531	/nfs/dbraw/zinc/92/05/31/567920531.db2.gz	KUJSNLZMMNYOPE-CYBMUJFWSA-N	0	3	250.411	3.739	40	0		CHABHN
CCCN1CCCC[C@@H]1c1cnc(Cl)cc1C	ZINC000072217858	567920780	/nfs/dbraw/zinc/92/07/80/567920780.db2.gz	LKYVPOPVNWGHPE-CYBMUJFWSA-N	0	3	252.789	3.980	40	0		CHABHN
CSc1ncccc1[C@H]1CCCCN1C(C)C	ZINC000072216961	567921160	/nfs/dbraw/zinc/92/11/60/567921160.db2.gz	ZSXAXJUGCFLXHX-CYBMUJFWSA-N	0	3	250.411	3.739	40	0		CHABHN
CCSc1ccc([C@@H]2CCCN2C(C)C)cn1	ZINC000072217120	567921171	/nfs/dbraw/zinc/92/11/71/567921171.db2.gz	RGVJOHMSTSIWDR-ZDUSSCGKSA-N	0	3	250.411	3.739	40	0		CHABHN
Cc1nc(NC(C)(C)C)ccc1[C@H](N)c1ccccc1	ZINC000072225022	567922655	/nfs/dbraw/zinc/92/26/55/567922655.db2.gz	ZSYPNXJCFCAXMO-MRXNPFEDSA-N	0	3	269.392	3.649	40	0		CHABHN
CC(C)COc1ccccc1[C@H](C)NC[C@H]1CCCO1	ZINC000225162489	567952367	/nfs/dbraw/zinc/95/23/67/567952367.db2.gz	OKLWYSRAVNDOPU-LSDHHAIUSA-N	0	3	277.408	3.551	40	0		CHABHN
CC[C@@H](C)Oc1cccc([C@H](C)NC[C@@H]2CCCO2)c1	ZINC000225167874	567952593	/nfs/dbraw/zinc/95/25/93/567952593.db2.gz	JLUASHWRFHLWRX-KEYYUXOJSA-N	0	3	277.408	3.694	40	0		CHABHN
CCn1c(CNCc2ccccc2)ccc1CC(C)C	ZINC000226020434	567955565	/nfs/dbraw/zinc/95/55/65/567955565.db2.gz	TXKVBTPBHQUZHJ-UHFFFAOYSA-N	0	3	270.420	3.996	40	0		CHABHN
c1ccc(CN2CCC[C@H]2c2cccnc2NC2CC2)cc1	ZINC000072213708	256712521	/nfs/dbraw/zinc/71/25/21/256712521.db2.gz	FWJCJBGEVSBMHG-SFHVURJKSA-N	0	3	293.414	3.993	40	0		CHABHN
COc1ccc(C[C@H]2C3=C(CCCC3)CCN2C)cc1	ZINC000005766173	170138594	/nfs/dbraw/zinc/13/85/94/170138594.db2.gz	CRXXSGLBECOUQH-SFHVURJKSA-N	0	3	271.404	3.812	40	0		CHABHN
CC(C)[C@@H](C(=O)CCN(C)C)c1ccc(Cl)cc1	ZINC000005963258	170163666	/nfs/dbraw/zinc/16/36/66/170163666.db2.gz	NTFQBQOOTJCIEC-OAHLLOKOSA-N	0	3	267.800	3.600	40	0		CHABHN
CCN(Cc1ccncc1)Cc1ccc(SC)cc1	ZINC000006026433	170169912	/nfs/dbraw/zinc/16/99/12/170169912.db2.gz	AFACLIYIKSHPAI-UHFFFAOYSA-N	0	3	272.417	3.826	40	0		CHABHN
CNCc1ccc(-c2cccc(Cl)c2Cl)o1	ZINC000020158521	171040179	/nfs/dbraw/zinc/04/01/79/171040179.db2.gz	VNRZMBUVBJECRP-UHFFFAOYSA-N	0	3	256.132	3.973	40	0		CHABHN
Brc1ccc2c(c1)CCC(N1CCCC1)=C2	ZINC000045328520	175359776	/nfs/dbraw/zinc/35/97/76/175359776.db2.gz	OHXASHBAWOZUNU-UHFFFAOYSA-N	0	3	278.193	3.832	40	0		CHABHN
CN1CCC(c2cccc(Cc3cccc(F)c3)n2)CC1	ZINC000072348574	176373818	/nfs/dbraw/zinc/37/38/18/176373818.db2.gz	ZMQFGOAVPKGOHB-UHFFFAOYSA-N	0	3	284.378	3.621	40	0		CHABHN
CN1CCC[C@H]1c1cccc(Cc2ccc(F)cc2)n1	ZINC000072357514	176376068	/nfs/dbraw/zinc/37/60/68/176376068.db2.gz	YTACZXAEFUUTDZ-KRWDZBQOSA-N	0	3	270.351	3.578	40	0		CHABHN
CCN1CCCC[C@H]1c1ccc(NCC(C)C)nc1	ZINC000072213331	567919231	/nfs/dbraw/zinc/91/92/31/567919231.db2.gz	VSZXZKKBEVPYOD-HNNXBMFYSA-N	0	3	261.413	3.696	40	0		CHABHN
CC1=C[C@@H](C)[C@H](CN2CCO[C@@H]2C(C)C)[C@@H](C)C1	ZINC000061854987	566821687	/nfs/dbraw/zinc/82/16/87/566821687.db2.gz	ZINAYKAEPVIUEM-FXUDXRNXSA-N	0	3	251.414	3.539	40	0		CHABHN
CC[C@@H](C)[C@@H](C(=O)OCCN(CC)CC)c1ccccc1	ZINC000001649107	567840130	/nfs/dbraw/zinc/84/01/30/567840130.db2.gz	LKQUJKDIEHGPLY-NVXWUHKLSA-N	0	3	291.435	3.701	40	0		CHABHN
CC(C)N1CCC(O)(c2cc(Cl)cc(Cl)c2)CC1	ZINC000079030408	567861357	/nfs/dbraw/zinc/86/13/57/567861357.db2.gz	AEMKHASABZGBQV-UHFFFAOYSA-N	0	3	288.218	3.685	40	0		CHABHN
Nc1ccc2nc(CCc3ccc(Cl)cc3)[nH]c2c1	ZINC000013233738	567865735	/nfs/dbraw/zinc/86/57/35/567865735.db2.gz	XYPQTPXDSBANBQ-UHFFFAOYSA-N	0	3	271.751	3.584	40	0		CHABHN
CCOc1cc(Cl)c(CNC(C)(C)C)cc1OC	ZINC000036612613	567870448	/nfs/dbraw/zinc/87/04/48/567870448.db2.gz	NGWFSQHOIIZYDB-UHFFFAOYSA-N	0	3	271.788	3.635	40	0		CHABHN
N[C@@H](c1cccs1)c1ccccc1Br	ZINC000019841940	567879323	/nfs/dbraw/zinc/87/93/23/567879323.db2.gz	PFZWSTXOJJELPA-LLVKDONJSA-N	0	3	268.179	3.559	40	0		CHABHN
CN(Cc1ccccc1)C[C@@H](O)c1cccc(Cl)c1	ZINC000031912050	567885382	/nfs/dbraw/zinc/88/53/82/567885382.db2.gz	GPPOVAQIFWICMY-MRXNPFEDSA-N	0	3	275.779	3.505	40	0		CHABHN
CCCCN1CCC[C@@H]1c1cccnc1SC	ZINC000072216946	567890950	/nfs/dbraw/zinc/89/09/50/567890950.db2.gz	YQWDNOXRJQFJGA-CYBMUJFWSA-N	0	3	250.411	3.741	40	0		CHABHN
CC(C)CN1CCC[C@@H]1c1ccc(OC(C)C)nc1	ZINC000072211902	567917809	/nfs/dbraw/zinc/91/78/09/567917809.db2.gz	POQNGYIIPFTQAI-OAHLLOKOSA-N	0	3	262.397	3.662	40	0		CHABHN
CCCN1CCC[C@H]1c1cccnc1NCC(C)C	ZINC000072213256	567918106	/nfs/dbraw/zinc/91/81/06/567918106.db2.gz	RQCYYUSWBMBGSB-HNNXBMFYSA-N	0	3	261.413	3.696	40	0		CHABHN
CCCN1CCCC[C@@H]1c1cccnc1N(CC)CC	ZINC000072212914	567918112	/nfs/dbraw/zinc/91/81/12/567918112.db2.gz	SXSUIIVLJSQHCG-MRXNPFEDSA-N	0	3	275.440	3.865	40	0		CHABHN
CC(C)N1CCC[C@@H]1c1cccnc1NC1CCC1	ZINC000072213897	567918888	/nfs/dbraw/zinc/91/88/88/567918888.db2.gz	OVOWSUNNUJYNQK-OAHLLOKOSA-N	0	3	259.397	3.591	40	0		CHABHN
CN(c1ccccc1)c1ncccc1[C@@H]1CCCCN1	ZINC000072214270	567920055	/nfs/dbraw/zinc/92/00/55/567920055.db2.gz	BZIADAHDUSVRHP-INIZCTEOSA-N	0	3	267.376	3.664	40	0		CHABHN
COc1ncc([C@H]2CCCCN2CC(C)C)cc1C	ZINC000072217744	567920470	/nfs/dbraw/zinc/92/04/70/567920470.db2.gz	RJJOSEROBQVSAB-OAHLLOKOSA-N	0	3	262.397	3.582	40	0		CHABHN
CNc1ccc([C@H]2CCCN2Cc2ccccc2)c(C)n1	ZINC000072219090	567921487	/nfs/dbraw/zinc/92/14/87/567921487.db2.gz	BFVRLGVVVMKXLJ-QGZVFWFLSA-N	0	3	281.403	3.769	40	0		CHABHN
Cc1cc([C@H]2CCCN2Cc2ccccc2)ccn1	ZINC000072219448	567921516	/nfs/dbraw/zinc/92/15/16/567921516.db2.gz	XLRWYEXAQQCLGG-QGZVFWFLSA-N	0	3	252.361	3.727	40	0		CHABHN
CNc1ncc([C@@H]2CCCN2Cc2ccccc2)cc1C	ZINC000072218969	567921541	/nfs/dbraw/zinc/92/15/41/567921541.db2.gz	WDQOWOMHHOMROT-KRWDZBQOSA-N	0	3	281.403	3.769	40	0		CHABHN
Cc1cc([C@@H]2CCCN2Cc2ccccc2)cnc1N(C)C	ZINC000072218609	567921735	/nfs/dbraw/zinc/92/17/35/567921735.db2.gz	PNMZGNULPKHLST-SFHVURJKSA-N	0	3	295.430	3.793	40	0		CHABHN
CCN1CCCC[C@@H]1c1cnc(N2CCCCC2)cc1C	ZINC000072219236	567921810	/nfs/dbraw/zinc/92/18/10/567921810.db2.gz	PVIZCTHGELKOQT-QGZVFWFLSA-N	0	3	287.451	3.927	40	0		CHABHN
CNCc1ccc(SC2CCCCC2)nc1C	ZINC000072224891	567922730	/nfs/dbraw/zinc/92/27/30/567922730.db2.gz	ISHMPXYPSRCYGW-UHFFFAOYSA-N	0	3	250.411	3.534	40	0		CHABHN
CC[C@@H](C)Oc1ccccc1[C@H](C)NC[C@@H]1CCCO1	ZINC000225162627	567952211	/nfs/dbraw/zinc/95/22/11/567952211.db2.gz	AEGZFYICSOOIQG-ILXRZTDVSA-N	0	3	277.408	3.694	40	0		CHABHN
CC[C@H](C)Oc1cccc([C@@H](C)NC[C@@H]2CCCO2)c1	ZINC000225167843	567952770	/nfs/dbraw/zinc/95/27/70/567952770.db2.gz	JLUASHWRFHLWRX-VBQJREDUSA-N	0	3	277.408	3.694	40	0		CHABHN
COc1ccc(CNCc2ccc(CC(C)C)[nH]2)cc1	ZINC000226020011	567955532	/nfs/dbraw/zinc/95/55/32/567955532.db2.gz	QZRUVGQMZAGLAF-UHFFFAOYSA-N	0	3	272.392	3.512	40	0		CHABHN
CN(C)Cc1ccccc1COC(=O)/C=C\c1ccccc1	ZINC000017004235	570226358	/nfs/dbraw/zinc/22/63/58/570226358.db2.gz	ORXYOWNKJSEEPD-SEYXRHQNSA-N	0	3	295.382	3.505	40	0		CHABHN
Cc1nc(-c2cc(C3CCN(C)CC3)ccn2)sc1C	ZINC000585179625	570254750	/nfs/dbraw/zinc/25/47/50/570254750.db2.gz	OPNBBZNPQLGCSC-UHFFFAOYSA-N	0	3	287.432	3.631	40	0		CHABHN
C[C@@H]1CCCN([C@H](CN)c2cc(Cl)cc(Cl)c2)C1	ZINC000252469983	570391428	/nfs/dbraw/zinc/39/14/28/570391428.db2.gz	FNAYOLSGFCLSAS-QMTHXVAHSA-N	0	3	287.234	3.725	40	0		CHABHN
CC(C)CC(=O)Nc1ccc(CN2CCCCC2)cc1	ZINC000005817254	170142757	/nfs/dbraw/zinc/14/27/57/170142757.db2.gz	DYZVSMAMKSZEAT-UHFFFAOYSA-N	0	3	274.408	3.657	40	0		CHABHN
CNCc1cc(Cl)ccc1OCc1ccccc1F	ZINC000005910018	170153428	/nfs/dbraw/zinc/15/34/28/170153428.db2.gz	HYTFDCMTZCHTPS-UHFFFAOYSA-N	0	3	279.742	3.778	40	0		CHABHN
O=C(Nc1ccc(CN2CCCCC2)cc1)c1ccccc1	ZINC000005998917	170166320	/nfs/dbraw/zinc/16/63/20/170166320.db2.gz	XJWPQJMEHMDIOS-UHFFFAOYSA-N	0	3	294.398	3.925	40	0		CHABHN
CCOc1ccc(CNCc2ccccc2)cc1OCC	ZINC000008324915	170331328	/nfs/dbraw/zinc/33/13/28/170331328.db2.gz	XDZKOAFYIOYKPK-UHFFFAOYSA-N	0	3	285.387	3.774	40	0		CHABHN
Cc1ccc2oc([C@H]3CCN(Cc4ccccn4)C3)nc2c1	ZINC000035446506	172202926	/nfs/dbraw/zinc/20/29/26/172202926.db2.gz	BGFBBIFLCWTHAB-AWEZNQCLSA-N	0	3	293.370	3.521	40	0	biogenic,in-vitro	CHABHN
CCC[C@@H](NCc1cnc(NC(C)C)nc1)c1ccccc1	ZINC000062717637	333175828	/nfs/dbraw/zinc/17/58/28/333175828.db2.gz	MBLRDTKBWNOLRH-QGZVFWFLSA-N	0	3	298.434	3.928	40	0		CHABHN
CCCNc1ncc(CN[C@H](CCC)c2ccccc2)cn1	ZINC000062717711	333176017	/nfs/dbraw/zinc/17/60/17/333176017.db2.gz	ZQPXSWANPHDERD-QGZVFWFLSA-N	0	3	298.434	3.930	40	0		CHABHN
CC(C)CN1CCC[C@H]1c1cccnc1OC(C)C	ZINC000072211963	567918084	/nfs/dbraw/zinc/91/80/84/567918084.db2.gz	FRCYRFSDMRZTJJ-HNNXBMFYSA-N	0	3	262.397	3.662	40	0		CHABHN
C[C@H](NC(C)(C)C)C(=O)c1ccc(Cl)c(Cl)c1	ZINC000041610005	566842796	/nfs/dbraw/zinc/84/27/96/566842796.db2.gz	MXUDEADPGZWZCH-QMMMGPOBSA-N	0	3	274.191	3.953	40	0	in-vivo	CHABHN
C[C@H]1CCCN([C@H](CN)c2ccc(Cl)cc2Cl)C1	ZINC000108349959	567103173	/nfs/dbraw/zinc/10/31/73/567103173.db2.gz	UJGDOGDFIJTPLX-IINYFYTJSA-N	0	3	287.234	3.725	40	0		CHABHN
c1ccc2c(c1)[nH]c1c2CCN[C@@H]1c1cccc2cccnc21	ZINC000020111399	567127032	/nfs/dbraw/zinc/12/70/32/567127032.db2.gz	MFLKAHOBCOBBJX-LJQANCHMSA-N	0	3	299.377	3.951	40	0	biogenic	CHABHN
COc1ccc(-c2cc([C@@H]3CCCCCN3)on2)cc1	ZINC000012133667	567862108	/nfs/dbraw/zinc/86/21/08/567862108.db2.gz	ISCDBWHLZWAWPF-AWEZNQCLSA-N	0	3	272.348	3.555	40	0		CHABHN
C[C@H]1CCCN(Cc2ccccc2Br)C1	ZINC000042205914	567891301	/nfs/dbraw/zinc/89/13/01/567891301.db2.gz	WPQXIRYYMZJHNN-NSHDSACASA-N	0	3	268.198	3.681	40	0		CHABHN
CCN1CC=C(c2nc3cc(Cl)ccc3o2)CC1	ZINC000073636021	567893204	/nfs/dbraw/zinc/89/32/04/567893204.db2.gz	KCBWEDSXKIJTRA-UHFFFAOYSA-N	0	3	262.740	3.590	40	0		CHABHN
CCN1CC=C(c2nc3c(cccc3C)s2)CC1	ZINC000073638863	567893470	/nfs/dbraw/zinc/89/34/70/567893470.db2.gz	VCHPLODSWPPVRY-UHFFFAOYSA-N	0	3	258.390	3.714	40	0		CHABHN
OCCN(Cc1cccs1)Cc1cccc2ccccc21	ZINC000013997427	567912562	/nfs/dbraw/zinc/91/25/62/567912562.db2.gz	DVASXNQUZFXSIJ-UHFFFAOYSA-N	0	3	297.423	3.896	40	0		CHABHN
CN(C)c1ncccc1[C@@H]1CCCCN1Cc1ccccc1	ZINC000072212682	567918607	/nfs/dbraw/zinc/91/86/07/567918607.db2.gz	DCUQEPYYYKKNMG-SFHVURJKSA-N	0	3	295.430	3.875	40	0		CHABHN
c1cnc(NC2CCCCC2)c([C@@H]2CCCCN2)c1	ZINC000072214030	567918783	/nfs/dbraw/zinc/91/87/83/567918783.db2.gz	LOFUKWMDHHUUGW-HNNXBMFYSA-N	0	3	259.397	3.641	40	0		CHABHN
CCN1CCCC[C@@H]1c1cccnc1NCC(C)C	ZINC000072213270	567918842	/nfs/dbraw/zinc/91/88/42/567918842.db2.gz	BVJKSJNEVTYBPE-OAHLLOKOSA-N	0	3	261.413	3.696	40	0		CHABHN
CC(C)N1CCC[C@H]1c1cccnc1NC1CCC1	ZINC000072213898	567919065	/nfs/dbraw/zinc/91/90/65/567919065.db2.gz	OVOWSUNNUJYNQK-HNNXBMFYSA-N	0	3	259.397	3.591	40	0		CHABHN
CC(C)CN1CCCC[C@H]1c1cccnc1NC1CC1	ZINC000072213741	567919290	/nfs/dbraw/zinc/91/92/90/567919290.db2.gz	GXWHTQNJNZIEAW-INIZCTEOSA-N	0	3	273.424	3.839	40	0		CHABHN
Cc1cc([C@H]2CCCN2CC(C)C)cnc1Cl	ZINC000072217784	567920505	/nfs/dbraw/zinc/92/05/05/567920505.db2.gz	MFIYDXZLLXPSHG-CYBMUJFWSA-N	0	3	252.789	3.836	40	0		CHABHN
CCCCN1CCC[C@@H]1c1cnc(Cl)c(C)c1	ZINC000072217785	567920805	/nfs/dbraw/zinc/92/08/05/567920805.db2.gz	VPFQJANWZRRKAB-CYBMUJFWSA-N	0	3	252.789	3.980	40	0		CHABHN
CCCCN1CCC[C@@H]1c1ccc(SC)nc1	ZINC000072216886	567921406	/nfs/dbraw/zinc/92/14/06/567921406.db2.gz	OHYXVVNRQYZVNA-CYBMUJFWSA-N	0	3	250.411	3.741	40	0		CHABHN
Cc1cnccc1[C@@H]1CCCN1Cc1ccccc1	ZINC000072219503	567921822	/nfs/dbraw/zinc/92/18/22/567921822.db2.gz	VKZHVDUEJBFGRM-KRWDZBQOSA-N	0	3	252.361	3.727	40	0		CHABHN
Cc1cc([C@@H]2CCCCN2C)cnc1N1CCCCC1	ZINC000072219174	567921928	/nfs/dbraw/zinc/92/19/28/567921928.db2.gz	NCUPKNJPVVDCFO-INIZCTEOSA-N	0	3	273.424	3.537	40	0		CHABHN
N[C@@H](COc1ccccc1)c1cccc2ccccc21	ZINC000019261067	567943111	/nfs/dbraw/zinc/94/31/11/567943111.db2.gz	YFAUMLMCDQTERU-SFHVURJKSA-N	0	3	263.340	3.919	40	0		CHABHN
CC(C)COc1ccccc1[C@H](C)NC[C@@H]1CCCO1	ZINC000225162413	567952547	/nfs/dbraw/zinc/95/25/47/567952547.db2.gz	OKLWYSRAVNDOPU-GJZGRUSLSA-N	0	3	277.408	3.551	40	0		CHABHN
CC[C@@H](C)Oc1ccc([C@H](C)NC[C@@H]2CCCO2)cc1	ZINC000225170623	567952685	/nfs/dbraw/zinc/95/26/85/567952685.db2.gz	BHVLXDWIQYEEEP-KEYYUXOJSA-N	0	3	277.408	3.694	40	0		CHABHN
CCCCOc1ccc([C@@H](C)NC[C@H]2CCCO2)cc1	ZINC000225170304	567952732	/nfs/dbraw/zinc/95/27/32/567952732.db2.gz	SOKGFMQEYUVEBR-RHSMWYFYSA-N	0	3	277.408	3.695	40	0		CHABHN
CCCCOc1cccc([C@@H](C)NC[C@@H]2CCCO2)c1	ZINC000225167314	567952749	/nfs/dbraw/zinc/95/27/49/567952749.db2.gz	UGDAUCKIQJGURM-PBHICJAKSA-N	0	3	277.408	3.695	40	0		CHABHN
CNCc1cc(Cl)c(OCc2ccccc2)c(OC)c1	ZINC000005910010	170153774	/nfs/dbraw/zinc/15/37/74/170153774.db2.gz	IUXGNVLEJQCBHJ-UHFFFAOYSA-N	0	3	291.778	3.647	40	0		CHABHN
Fc1ccccc1CN1CC[C@H](c2nc3ccccc3o2)C1	ZINC000035446531	172202625	/nfs/dbraw/zinc/20/26/25/172202625.db2.gz	YAHYYWBITCKKAW-AWEZNQCLSA-N	0	3	296.345	3.956	40	0	biogenic,in-vitro	CHABHN
c1ccc(CN2CCCC[C@@H]2c2ccncc2)cc1	ZINC000072211049	176342677	/nfs/dbraw/zinc/34/26/77/176342677.db2.gz	XAEJVXZQIVOGMD-QGZVFWFLSA-N	0	3	252.361	3.809	40	0		CHABHN
CN1CCC[C@@H]1c1cccc(Cc2ccc(F)cc2)n1	ZINC000072357513	176375934	/nfs/dbraw/zinc/37/59/34/176375934.db2.gz	YTACZXAEFUUTDZ-QGZVFWFLSA-N	0	3	270.351	3.578	40	0		CHABHN
CN1CCC[C@@H](c2nccnc2-c2cccc(Cl)c2)C1	ZINC000072358369	176376425	/nfs/dbraw/zinc/37/64/25/176376425.db2.gz	WUGBIZSYOULTQC-CYBMUJFWSA-N	0	3	287.794	3.606	40	0		CHABHN
Cc1cccc(-c2nccnc2[C@@H]2CCCN(C)C2)c1C	ZINC000072365358	176380459	/nfs/dbraw/zinc/38/04/59/176380459.db2.gz	HQGXDNFKGUCECR-OAHLLOKOSA-N	0	3	281.403	3.570	40	0		CHABHN
Fc1cc(CNCc2ccccc2)ccc1Br	ZINC000043576952	260299421	/nfs/dbraw/zinc/29/94/21/260299421.db2.gz	RQNDUPXKAFEBKU-UHFFFAOYSA-N	0	3	294.167	3.878	40	0		CHABHN
CCCN1CCCC[C@H]1c1ccc(SC)nc1	ZINC000072216900	567920881	/nfs/dbraw/zinc/92/08/81/567920881.db2.gz	FARFSKADGKVFGN-ZDUSSCGKSA-N	0	3	250.411	3.741	40	0		CHABHN
CCCN1CCCC[C@@H]1c1cccnc1OC(C)C	ZINC000072211977	567918087	/nfs/dbraw/zinc/91/80/87/567918087.db2.gz	XBPAHAWJYVGVIN-OAHLLOKOSA-N	0	3	262.397	3.806	40	0		CHABHN
C[C@@H]1CCCN([C@H](CN)c2cccc(Cl)c2Cl)C1	ZINC000242495600	567142916	/nfs/dbraw/zinc/14/29/16/567142916.db2.gz	GKTKLFLXYDSQAX-ZWNOBZJWSA-N	0	3	287.234	3.725	40	0		CHABHN
C[C@H](CN1c2ccccc2Sc2cccnc21)N(C)C	ZINC000001678303	567841439	/nfs/dbraw/zinc/84/14/39/567841439.db2.gz	OQJBSDFFQWMKBQ-GFCCVEGCSA-N	0	3	285.416	3.634	40	0	world	CHABHN
COc1ccc([C@@H](C)NCc2ccccc2)cc1OC	ZINC000004240694	567856386	/nfs/dbraw/zinc/85/63/86/567856386.db2.gz	VWNXQIVCUARDPH-CYBMUJFWSA-N	0	3	271.360	3.555	40	0		CHABHN
N[C@H](c1cccs1)c1ccccc1Br	ZINC000019841944	567879294	/nfs/dbraw/zinc/87/92/94/567879294.db2.gz	PFZWSTXOJJELPA-NSHDSACASA-N	0	3	268.179	3.559	40	0		CHABHN
Cc1ccsc1CN(Cc1sccc1C)C[C@@H](C)O	ZINC000013991510	567912332	/nfs/dbraw/zinc/91/23/32/567912332.db2.gz	AMMIRMZXVDDNBN-CYBMUJFWSA-N	0	3	295.473	3.809	40	0		CHABHN
O[C@@H]1[C@@H]2CCC[C@H]1[C@H](c1ccccc1)N[C@H]2c1ccccc1	ZINC000100672332	567913725	/nfs/dbraw/zinc/91/37/25/567913725.db2.gz	USAKVYHRWZXKIZ-WPVAHCMFSA-N	0	3	293.410	3.849	40	0		CHABHN
CC(C)CNc1ncccc1[C@H]1CCCN1C(C)C	ZINC000072213254	567918098	/nfs/dbraw/zinc/91/80/98/567918098.db2.gz	UAWUNIWKMNGZSC-OAHLLOKOSA-N	0	3	261.413	3.695	40	0		CHABHN
CCCNc1ccc([C@H]2CCCCN2CCC)cn1	ZINC000072213213	567918469	/nfs/dbraw/zinc/91/84/69/567918469.db2.gz	QJWLBMOLIOFMST-OAHLLOKOSA-N	0	3	261.413	3.841	40	0		CHABHN
CNc1ncccc1[C@@H]1CCCCN1Cc1ccccc1	ZINC000072212562	567918650	/nfs/dbraw/zinc/91/86/50/567918650.db2.gz	GQXHOCPFAXPEFT-KRWDZBQOSA-N	0	3	281.403	3.851	40	0		CHABHN
CCCN1CCCC[C@@H]1c1ccc(NC2CC2)nc1	ZINC000072213796	567918778	/nfs/dbraw/zinc/91/87/78/567918778.db2.gz	IIJCTIFSMHHDPY-OAHLLOKOSA-N	0	3	259.397	3.593	40	0		CHABHN
CC(C)N1CCCC[C@H]1c1cccnc1NC1CC1	ZINC000072213739	567918902	/nfs/dbraw/zinc/91/89/02/567918902.db2.gz	AZXVVTDPPRIPGL-HNNXBMFYSA-N	0	3	259.397	3.591	40	0		CHABHN
c1ccc(Nc2ncccc2[C@@H]2CCCCN2)cc1	ZINC000072214150	567919455	/nfs/dbraw/zinc/91/94/55/567919455.db2.gz	FTBBXBTXDNOLIR-HNNXBMFYSA-N	0	3	253.349	3.640	40	0		CHABHN
CCCN1CCCC[C@H]1c1cnc(Cl)cc1C	ZINC000072217859	567920398	/nfs/dbraw/zinc/92/03/98/567920398.db2.gz	LKYVPOPVNWGHPE-ZDUSSCGKSA-N	0	3	252.789	3.980	40	0		CHABHN
Cc1nc(Cl)ccc1[C@H]1CCCCN1C(C)C	ZINC000072217921	567920591	/nfs/dbraw/zinc/92/05/91/567920591.db2.gz	BNUMWGABLJBQDM-CYBMUJFWSA-N	0	3	252.789	3.979	40	0		CHABHN
CCCCN1CCC[C@H]1c1cnc(Cl)c(C)c1	ZINC000072217786	567920757	/nfs/dbraw/zinc/92/07/57/567920757.db2.gz	VPFQJANWZRRKAB-ZDUSSCGKSA-N	0	3	252.789	3.980	40	0		CHABHN
Cc1cc(Cl)ncc1[C@@H]1CCCCN1C(C)C	ZINC000072217860	567920818	/nfs/dbraw/zinc/92/08/18/567920818.db2.gz	UXNLOLANLPYEGF-ZDUSSCGKSA-N	0	3	252.789	3.979	40	0		CHABHN
CCN1CCCC[C@@H]1c1cnc(N2CCCC2)cc1C	ZINC000072218876	567921910	/nfs/dbraw/zinc/92/19/10/567921910.db2.gz	YZSNRHOBRDSALU-MRXNPFEDSA-N	0	3	273.424	3.537	40	0		CHABHN
CCN1CCCC[C@H]1c1ccc(N2CCCCC2)nc1C	ZINC000072219297	567921956	/nfs/dbraw/zinc/92/19/56/567921956.db2.gz	XSABRXPCJBXZLH-KRWDZBQOSA-N	0	3	287.451	3.927	40	0		CHABHN
N[C@H](c1ccccc1)c1ccc(NCc2ccccc2)nc1	ZINC000072225355	567922239	/nfs/dbraw/zinc/92/22/39/567922239.db2.gz	UOROBKBCBIDAJN-LJQANCHMSA-N	0	3	289.382	3.742	40	0		CHABHN
COc1cccc(OC)c1[C@@H]1CCCCN1C(C)C	ZINC000072221439	567922256	/nfs/dbraw/zinc/92/22/56/567922256.db2.gz	ONHLCMCKRGYGHY-ZDUSSCGKSA-N	0	3	263.381	3.639	40	0		CHABHN
Fc1ccc(CNCc2ccc3[nH]ccc3c2)cc1	ZINC000015424178	567944082	/nfs/dbraw/zinc/94/40/82/567944082.db2.gz	GBRFRAWXJWVHHW-UHFFFAOYSA-N	0	3	254.308	3.597	40	0		CHABHN
CC[C@@H](C)Oc1cccc([C@@H](C)NC[C@@H]2CCCO2)c1	ZINC000225167810	567952785	/nfs/dbraw/zinc/95/27/85/567952785.db2.gz	JLUASHWRFHLWRX-CPUCHLNUSA-N	0	3	277.408	3.694	40	0		CHABHN