Cc1ccc(NC(=O)c2cccnc2)cc1C	ZINC000000029317	66/99/61/342669961	MPWUJYHWSMZLRJ-UHFFFAOYSA-N	0	226.279	BF	2.951	0	Anodyne	ref	BFAARN	Cc1ccc(NC(=O)c2cccnc2)cc1C	 
O=C(Nc1ccc(Cl)cc1)c1cccnc1	ZINC000000029540	35/36/19/182353619	UHINZWOAWHEUAU-UHFFFAOYSA-N	0	232.67	BF	2.987	0	Anodyne	ref	BFAARN	O=C(Nc1ccc(Cl)cc1)c1cccnc1	 
O=C(Nc1cccc(Cl)c1)c1cccnc1	ZINC000000029652	36/86/42/182368642	XQPPPWLPXGVYAJ-UHFFFAOYSA-N	0	232.67	BF	2.987	0	Anodyne	ref	BFAARN	O=C(Nc1cccc(Cl)c1)c1cccnc1	 
CC(C)(C)c1cc(C(=O)O)nn1-c1ccccc1	ZINC000000032855	67/02/99/342670299	CBLDQVQVGAYZED-UHFFFAOYSA-N	-1	244.294	BF	2.868	0	Anodyne	ref	BFAARM	CC(C)(C)c1cc(C(=O)[O-])nn1-c1ccccc1	 
O=Cc1ccc(-c2ccccc2[N+](=O)[O-])o1	ZINC000000035744	33/70/08/384337008	QBYRUURYXPVDAK-UHFFFAOYSA-N	0	217.18	BF	2.667	0	Bother	ref	BFBARN	O=Cc1ccc(-c2ccccc2[N+](=O)[O-])o1	 
COc1cc(C=O)ccc1OCCC(C)C	ZINC000000035877	67/06/38/342670638	QMAVUZPWNRBYAO-UHFFFAOYSA-N	0	222.284	BF	2.933	0	Anodyne	ref	BFAARN	COc1cc(C=O)ccc1OCCC(C)C	 
O=C(NC1CCCCCC1)c1ccco1	ZINC000000037606	11/41/10/182114110	LRNVCPIPFWXJNU-UHFFFAOYSA-N	0	207.273	BF	2.732	0	Anodyne	ref	BFAARN	O=C(NC1CCCCCC1)c1ccco1	 
O=C(NCc1ccccc1Cl)c1ccco1	ZINC000000037613	25/65/33/182256533	RTIYXOTXOFVDJW-UHFFFAOYSA-N	0	235.67	BF	2.863	0	Anodyne	ref	BFAARN	O=C(NCc1ccccc1Cl)c1ccco1	 
Cc1ccc(C(C)C)c(OCC(=O)O)c1	ZINC000000038390	45/18/96/178451896	MURZAHIYMVFXCF-UHFFFAOYSA-N	-1	208.257	BF	2.582	0	Anodyne	ref	BFAARM	Cc1ccc(C(C)C)c(OCC(=O)[O-])c1	 
Cc1cccc(OCC(=O)NC2CCCCC2)c1	ZINC000000038396	16/27/69/179162769	PCPVQONPOOMGNS-UHFFFAOYSA-N	0	247.338	BF	2.823	0	Anodyne	ref	BFAARN	Cc1cccc(OCC(=O)NC2CCCCC2)c1	 
CCCC(=O)Nc1ccc(C(=O)OCC)cc1	ZINC000000038436	67/06/15/342670615	XBMADEYWGIHEIH-UHFFFAOYSA-N	0	235.283	BF	2.602	0	Anodyne	ref	BFAARN	CCCC(=O)Nc1ccc(C(=O)OCC)cc1	 
O=C(Oc1ccccc1)c1ccc([N+](=O)[O-])cc1	ZINC000000038464	61/06/00/182610600	LUSSRKMAXZEBEC-UHFFFAOYSA-N	0	243.218	BF	2.814	0	Bother	ref	BFBARN	O=C(Oc1ccccc1)c1ccc([N+](=O)[O-])cc1	 
O=C(Oc1ccccc1)c1ccccc1O	ZINC000000038545	67/06/22/342670622	ZQBAKBUEJOMQEX-UHFFFAOYSA-N	0	214.22	BF	2.611	0	Anodyne	ref	BFAARN	O=C(Oc1ccccc1)c1ccccc1O	world endogenous
Cc1ccc(C)c(OCC(=O)N2CCCCC2)c1	ZINC000000038568	81/93/33/383819333	MFPPLCWMIWBQJT-UHFFFAOYSA-N	0	247.338	BF	2.695	0	Anodyne	ref	BFAARN	Cc1ccc(C)c(OCC(=O)N2CCCCC2)c1	 
Cc1ccccc1C(=O)NCc1ccccc1	ZINC000000038648	25/08/16/179250816	SQDLPGKVRZFDKW-UHFFFAOYSA-N	0	225.291	BF	2.925	0	Anodyne	ref	BFAARN	Cc1ccccc1C(=O)NCc1ccccc1	 
O=C(/C=C/c1ccccc1)Nc1nccs1	ZINC000000038680	82/00/93/383820093	HKTMXBUQDTYWOK-VOTSOKGWSA-N	0	230.292	BF	2.795	0	Anodyne	ref	BFAARN	O=C(/C=C/c1ccccc1)Nc1nccs1	 
O=C(Nc1cccc([N+](=O)[O-])c1)c1cccs1	ZINC000000038818	37/23/44/182372344	VFDHCXRHENGDQA-UHFFFAOYSA-N	0	248.263	BF	2.909	0	Bother	ref	BFBARN	O=C(Nc1cccc([N+](=O)[O-])c1)c1cccs1	 
Cc1ccc(NC(=O)C(F)(F)F)cc1C	ZINC000000038843	67/07/49/342670749	FIUPCIWUFSPNFU-UHFFFAOYSA-N	0	217.19	BF	2.804	0	Anodyne	ref	BFAARN	Cc1ccc(NC(=O)C(F)(F)F)cc1C	 
Cc1ccc(NC(=O)c2ccco2)cc1F	ZINC000000038902	75/31/58/178753158	FOXCEPCWZSVGPZ-UHFFFAOYSA-N	0	219.215	BF	2.979	0	Anodyne	ref	BFAARN	Cc1ccc(NC(=O)c2ccco2)cc1F	 
C[C@H](NC(=O)c1cccc(N)c1)c1ccccc1	ZINC000000041953	18/31/81/518183181	ZNBFXLWERBRCIT-NSHDSACASA-N	0	240.306	BF	2.76	0	Anodyne	ref	BFAARN	C[C@H](NC(=O)c1cccc(N)c1)c1ccccc1	 
C[C@@H](NC(=O)c1cccc(N)c1)c1ccccc1	ZINC000000041954	84/95/30/175849530	ZNBFXLWERBRCIT-LLVKDONJSA-N	0	240.306	BF	2.76	0	Anodyne	ref	BFAARN	C[C@@H](NC(=O)c1cccc(N)c1)c1ccccc1	 
Cc1cc(C)c(NC(=O)C2CC2)c(C)c1	ZINC000000045941	24/44/60/187244460	RJGYHYNPOQXNHW-UHFFFAOYSA-N	0	203.285	BF	2.96	0	Anodyne	ref	BFAARN	Cc1cc(C)c(NC(=O)C2CC2)c(C)c1	 
COc1ccc2c(Cl)c(C(N)=O)sc2c1	ZINC000000045997	20/43/29/175204329	IWPCUYGXTLHCHD-UHFFFAOYSA-N	0	241.699	BF	2.662	0	Anodyne	ref	BFAARN	COc1ccc2c(Cl)c(C(N)=O)sc2c1	 
N#Cc1cccc(NC(=O)c2cccs2)c1	ZINC000000046151	24/41/25/187244125	UMGIUNNEDQZWNZ-UHFFFAOYSA-N	0	228.276	BF	2.872	0	Mild	ref	BFEARN	N#Cc1cccc(NC(=O)c2cccs2)c1	 
O=C(c1ccccc1)N1CCc2ccccc21	ZINC000000046197	67/14/05/342671405	NJZYEXUZNJGGPH-UHFFFAOYSA-N	0	223.275	BF	2.89	0	Anodyne	ref	BFAARN	O=C(c1ccccc1)N1CCc2ccccc21	 
N/C(S)=N/N=C/c1cccc(Cl)c1Cl	ZINC000000046220	18/45/40/181184540	MUEBZTOJMDYECK-UUILKARUSA-N	0	248.138	BF	2.572	0	Mild	ref	BFEARN	NC(=S)N=NCc1cccc(Cl)c1Cl	 
COc1ccc([N+](=O)[O-])cc1/N=C/c1ccc[nH]1	ZINC000000046232	20/06/65/175200665	KNTPEHUNPOHULQ-RIYZIHGNSA-N	0	245.238	BF	2.682	0	Mild	ref	BFEARN	COc1ccc([N+](=O)[O-])cc1/N=C/c1ccc[nH]1	 
Fc1ccc(NC(=S)N2CCCC2)cc1	ZINC000000046249	67/12/36/342671236	RSDGTYCVRPYQMS-UHFFFAOYSA-N	0	224.304	BF	2.618	0	Anodyne	ref	BFAARN	Fc1ccc(NC(=S)N2CCCC2)cc1	 
N#Cc1cccc(NC(=O)c2ccccc2)c1	ZINC000000046446	35/23/24/369352324	UCPDMPHZMMJOJJ-UHFFFAOYSA-N	0	222.247	BF	2.811	0	Mild	ref	BFEARN	N#Cc1cccc(NC(=O)c2ccccc2)c1	 
CN(C)c1ccc([C@H](O)c2cccs2)cc1	ZINC000000054668	67/16/73/342671673	IHKZCVPNQIENBH-ZDUSSCGKSA-N	0	233.336	BF	2.896	0	Anodyne	ref	BFAARN	CN(C)c1ccc([C@H](O)c2cccs2)cc1	 
CN(C)c1ccc([C@@H](O)c2cccs2)cc1	ZINC000000054669	67/16/64/342671664	IHKZCVPNQIENBH-CYBMUJFWSA-N	0	233.336	BF	2.896	0	Anodyne	ref	BFAARN	CN(C)c1ccc([C@@H](O)c2cccs2)cc1	 
CCOC(=O)c1c(C)n(CC)c2ccc(O)cc12	ZINC000000054901	28/81/92/170288192	FXMYTLXTYCIQED-UHFFFAOYSA-N	0	247.294	BF	2.852	0	Anodyne	ref	BFAARN	CCOC(=O)c1c(C)n(CC)c2ccc(O)cc12	 
CN(C)c1cccc2cccc(N(C)C)c12	ZINC000000056476	67/18/39/342671839	GJFNRSDCSTVPCJ-UHFFFAOYSA-N	0	214.312	BF	2.972	0	Anodyne	ref	BFAARN	CN(C)c1cccc2cccc(N(C)C)c12	in-vitro
C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)O	ZINC000000056613	02/23/13/177022313	MZHCENGPTKEIGP-YFKPBYRVSA-N	-1	235.066	BF	2.845	0	Anodyne	ref	BFAARM	C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)[O-]	in-vitro
C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)O	ZINC000000056614	00/38/36/176003836	MZHCENGPTKEIGP-RXMQYKEDSA-N	-1	235.066	BF	2.845	0	Anodyne	ref	BFAARM	C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)[O-]	in-vitro
O=[N+]([O-])c1ccc(F)cc1C(F)(F)F	ZINC000000056816	09/76/03/344097603	WMQOSURXFLBTPC-UHFFFAOYSA-N	0	209.098	BF	2.753	0	Bother	ref	BFBARN	O=[N+]([O-])c1ccc(F)cc1C(F)(F)F	in-vitro
O=c1cc(C(F)(F)F)c2ccc(O)cc2o1	ZINC000000057916	67/21/51/342672151	CCKWMCUOHJAVOL-UHFFFAOYSA-N	-1	230.141	BF	2.517	1	Anodyne	mid	BFAAMM	O=c1cc(C(F)(F)F)c2ccc([O-])cc2o1	 
O=c1cc(C(F)(F)F)c2ccc(O)cc2o1	ZINC000000057916	67/21/50/342672150	CCKWMCUOHJAVOL-UHFFFAOYSA-N	0	230.141	BF	2.517	0	Anodyne	ref	BFAARN	O=c1cc(C(F)(F)F)c2ccc(O)cc2o1	 
O=C(Nc1cccc([N+](=O)[O-])c1)c1ccccc1	ZINC000000061517	37/24/32/182372432	WLUMOMGZPNOSOG-UHFFFAOYSA-N	0	242.234	BF	2.847	0	Bother	ref	BFBARN	O=C(Nc1cccc([N+](=O)[O-])c1)c1ccccc1	 
COc1ccc(/C=N/c2ccc(O)cc2)cc1O	ZINC000000062893	04/88/48/175048848	XVGMUPQFDSWEHS-OQLLNIDSSA-N	-1	243.262	BF	2.857	3	Mild	high	BFEAHM	COc1ccc(/C=N/c2ccc([O-])cc2)cc1O	 
COc1ccc(/C=N/c2ccc(O)cc2)cc1O	ZINC000000062893	04/88/47/175048847	XVGMUPQFDSWEHS-OQLLNIDSSA-N	0	243.262	BF	2.857	0	Mild	ref	BFEARN	COc1ccc(/C=N/c2ccc(O)cc2)cc1O	 
CC(C)OC(=O)c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000000064916	17/13/36/167171336	SYAIBOZYDSNSJG-UHFFFAOYSA-N	0	243.646	BF	2.813	0	Bother	ref	BFBARN	CC(C)OC(=O)c1ccc(Cl)c([N+](=O)[O-])c1	 
Oc1ccc(Br)cc1Cl	ZINC000000064966	26/69/94/183266994	VIBJPUXLAKVICD-UHFFFAOYSA-N	-1	207.454	BF	2.808	1	Anodyne	mid	BFAAMM	[O-]c1ccc(Br)cc1Cl	in-vitro
Oc1ccc(Br)cc1Cl	ZINC000000064966	26/69/91/183266991	VIBJPUXLAKVICD-UHFFFAOYSA-N	0	207.454	BF	2.808	0	Anodyne	ref	BFAARN	Oc1ccc(Br)cc1Cl	in-vitro
Brc1cnc2ccccc2c1	ZINC000000066081	10/51/59/166105159	ZGIKWINFUGEQEO-UHFFFAOYSA-N	0	208.058	BF	2.997	0	Anodyne	ref	BFAARN	Brc1cnc2ccccc2c1	in-vitro
Cc1cccc(C(=O)Nc2nccs2)c1	ZINC000000066634	67/23/99/342672399	DSEARAKYUSKFIA-UHFFFAOYSA-N	0	218.281	BF	2.704	0	Anodyne	ref	BFAARN	Cc1cccc(C(=O)Nc2nccs2)c1	 
O=C(/C=C/c1ccco1)Nc1ccccc1	ZINC000000070484	82/09/32/383820932	MCMXBVCCALXJPS-CMDGGOBGSA-N	0	213.236	BF	2.932	0	Anodyne	ref	BFAARN	O=C(/C=C/c1ccco1)Nc1ccccc1	 
N#Cc1ccc(NC(=O)/C=C/c2ccco2)cc1	ZINC000000070501	11/70/58/181117058	OAKHGKHDVAFLEP-BQYQJAHWSA-N	0	238.246	BF	2.803	0	Mild	ref	BFEARN	N#Cc1ccc(NC(=O)/C=C/c2ccco2)cc1	 
Nc1cccc(-c2cn3ccccc3n2)c1	ZINC000000072851	67/27/29/342672729	NUVDPCZHQLYLPU-UHFFFAOYSA-N	0	209.252	BF	2.584	0	Anodyne	ref	BFAARN	Nc1cccc(-c2cn3ccccc3n2)c1	 
S=C(Nc1ccccc1)N1CCCCC1	ZINC000000075514	31/10/73/183311073	VYTYEDNCIFTZDH-UHFFFAOYSA-N	0	220.341	BF	2.869	0	Anodyne	ref	BFAARN	S=C(Nc1ccccc1)N1CCCCC1	 
Nc1ncc(Cc2ccc(Cl)cc2)s1	ZINC000000081539	79/81/83/181798183	KMPMCIAXAISHFL-UHFFFAOYSA-N	0	224.716	BF	2.97	0	Anodyne	ref	BFAARN	Nc1ncc(Cc2ccc(Cl)cc2)s1	 
COc1ccc([C@H](C#N)C(C)C)cc1OC	ZINC000000082538	24/46/55/187244655	NFXAXMOAVPLEBH-LLVKDONJSA-N	0	219.284	BF	2.967	0	Mild	ref	BFEARN	COc1ccc([C@H](C#N)C(C)C)cc1OC	 
COc1ccc([C@@H](C#N)C(C)C)cc1OC	ZINC000000082541	27/24/91/188272491	NFXAXMOAVPLEBH-NSHDSACASA-N	0	219.284	BF	2.967	0	Mild	ref	BFEARN	COc1ccc([C@@H](C#N)C(C)C)cc1OC	 
Cc1ccc(C)n1-c1ccc(C(=O)O)cc1	ZINC000000083790	50/93/33/178509333	WNZAIUIEXCYTCY-UHFFFAOYSA-N	-1	215.252	BF	2.792	0	Clean	ref	BFCARM	Cc1ccc(C)n1-c1ccc(C(=O)[O-])cc1	 
Nc1nnc(C23CC4CC(CC(C4)C2)C3)s1	ZINC000000089270	82/51/14/383825114	FBIPRWDBYYCKHA-UHFFFAOYSA-N	0	235.356	BF	2.588	0	Anodyne	ref	BFAARN	Nc1nnc(C23CC4CC(CC(C4)C2)C3)s1	 
Nc1cc(C(F)(F)F)ccc1N1CCCC1	ZINC000000091115	68/01/84/181680184	HPDFKXPVMXSXGE-UHFFFAOYSA-N	0	230.233	BF	2.888	0	Anodyne	ref	BFAARN	Nc1cc(C(F)(F)F)ccc1N1CCCC1	 
N#Cc1cccc(NC(=O)c2ccc(F)cc2)c1	ZINC000000095896	60/53/20/388605320	DQWQTJDJHRYEQK-UHFFFAOYSA-N	0	240.237	BF	2.95	0	Mild	ref	BFEARN	N#Cc1cccc(NC(=O)c2ccc(F)cc2)c1	 
O=[N+]([O-])c1cccc(/N=C/c2ccc[nH]2)c1	ZINC000000096009	67/40/83/342674083	LXPCHAVAMMUCJP-MDWZMJQESA-N	0	215.212	BF	2.673	0	Mild	ref	BFEARN	O=[N+]([O-])c1cccc(/N=C/c2ccc[nH]2)c1	 
O=C(NCc1ccccc1)c1ccccc1	ZINC000000101707	25/74/23/182257423	LKQUCICFTHBFAL-UHFFFAOYSA-N	0	211.264	BF	2.617	0	Anodyne	ref	BFAARN	O=C(NCc1ccccc1)c1ccccc1	 
CCOc1ccc(NC(=O)c2ccco2)cc1	ZINC000000102764	55/11/45/170551145	QHQMTIZGRHMXQJ-UHFFFAOYSA-N	0	231.251	BF	2.931	0	Anodyne	ref	BFAARN	CCOc1ccc(NC(=O)c2ccco2)cc1	 
O=C(c1ccccc1[N+](=O)[O-])N1CCCCCC1	ZINC000000103189	40/50/25/344405025	GPWWPUJHEXVVNL-UHFFFAOYSA-N	0	248.282	BF	2.611	0	Bother	ref	BFBARN	O=C(c1ccccc1[N+](=O)[O-])N1CCCCCC1	 
O=C(NC1CCCCC1)c1cccc([N+](=O)[O-])c1	ZINC000000103300	11/36/47/182113647	GIKBXMBZCABMCJ-UHFFFAOYSA-N	0	248.282	BF	2.657	0	Bother	ref	BFBARN	O=C(NC1CCCCC1)c1cccc([N+](=O)[O-])c1	 
O=C(Nc1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000000103330	37/83/61/182378361	VWIRWLAPFZXYSL-UHFFFAOYSA-N	0	242.234	BF	2.847	0	Bother	ref	BFBARN	O=C(Nc1ccccc1)c1cccc([N+](=O)[O-])c1	 
Nc1nnc(-c2ccccc2)c(-c2ccccc2)n1	ZINC000000105284	82/69/87/383826987	NZRHOWNFGASHMN-UHFFFAOYSA-N	0	248.289	BF	2.788	0	Anodyne	ref	BFAARN	Nc1nnc(-c2ccccc2)c(-c2ccccc2)n1	 
Cc1ccc(/C=C/C(=O)NCc2ccccc2)o1	ZINC000000106410	27/25/41/188272541	RWPSQULMQXEMSN-MDZDMXLPSA-N	0	241.29	BF	2.918	0	Anodyne	ref	BFAARN	Cc1ccc(/C=C/C(=O)NCc2ccccc2)o1	 
N#Cc1sc2nc3c(cc2c1N)CCCC3	ZINC000000107777	17/83/10/181178310	ZDJDVRCSNUJIQQ-UHFFFAOYSA-N	0	229.308	BF	2.629	0	Mild	ref	BFEARN	N#Cc1sc2nc3c(cc2c1N)CCCC3	 
CSc1nc2c(cc1C#N)CCCCC2	ZINC000000107785	28/91/17/398289117	PVMOBFWFZJAJJE-UHFFFAOYSA-N	0	218.325	BF	2.944	0	Mild	ref	BFEARN	CSc1nc2c(cc1C#N)CCCCC2	 
O=C1N[C@@H](c2ccccc2)Nc2ccccc21	ZINC000000115259	83/06/14/383830614	BIVGFFFLVZMILM-ZDUSSCGKSA-N	0	224.263	BF	2.541	0	Anodyne	ref	BFAARN	O=C1N[C@@H](c2ccccc2)Nc2ccccc21	 
O=C1N[C@H](c2ccccc2)Nc2ccccc21	ZINC000000115262	82/06/38/182820638	BIVGFFFLVZMILM-CYBMUJFWSA-N	0	224.263	BF	2.541	0	Anodyne	ref	BFAARN	O=C1N[C@H](c2ccccc2)Nc2ccccc21	 
O=C(O)COc1ccc(-c2ccccc2)cc1	ZINC000000116651	82/94/53/383829453	UEXMWDXKHUIBSJ-UHFFFAOYSA-N	-1	228.247	BF	2.817	0	Anodyne	ref	BFAARM	O=C([O-])COc1ccc(-c2ccccc2)cc1	 
Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000000123066	67/57/32/342675732	IRFCTHNJIWUUJZ-UHFFFAOYSA-N	0	212.252	BF	2.521	0	Anodyne	ref	BFAARN	Nc1cccc(NC(=O)c2ccccc2)c1	 
Nc1ccc(NC(=O)c2ccccc2)cc1	ZINC000000123070	67/56/74/342675674	GTTFJYUWPUKXJH-UHFFFAOYSA-N	0	212.252	BF	2.521	0	Clean	ref	BFCARN	Nc1ccc(NC(=O)c2ccccc2)cc1	in-vitro
CCOc1ccc(C(=O)N[C@H](C)CC)cc1	ZINC000000124991	67/57/99/342675799	LPVBWNAKEBOUAL-SNVBAGLBSA-N	0	221.3	BF	2.614	0	Anodyne	ref	BFAARN	CCOc1ccc(C(=O)N[C@H](C)CC)cc1	 
CCOc1ccc(C(=O)N[C@@H](C)CC)cc1	ZINC000000124995	67/57/12/342675712	LPVBWNAKEBOUAL-JTQLQIEISA-N	0	221.3	BF	2.614	0	Anodyne	ref	BFAARN	CCOc1ccc(C(=O)N[C@@H](C)CC)cc1	 
N#Cc1cccc(/N=C/c2cccc(O)c2O)c1	ZINC000000125119	13/49/97/181134997	LLZTUYOTUNPGML-CXUHLZMHSA-N	-1	238.246	BF	2.72	1	Mild	mid	BFEAMM	N#Cc1cccc(/N=C/c2cccc([O-])c2O)c1	 
N#Cc1cccc(/N=C/c2cccc(O)c2O)c1	ZINC000000125119	13/49/95/181134995	LLZTUYOTUNPGML-CXUHLZMHSA-N	0	238.246	BF	2.72	0	Mild	ref	BFEARN	N#Cc1cccc(/N=C/c2cccc(O)c2O)c1	 
COC(=O)CCC(=O)Nc1c(C)cc(C)cc1C	ZINC000000125228	52/65/01/173526501	QRJAZFXQMYFFRD-UHFFFAOYSA-N	0	249.31	BF	2.504	0	Anodyne	ref	BFAARN	COC(=O)CCC(=O)Nc1c(C)cc(C)cc1C	 
Cc1ccc(C(=O)N2CCC(C)CC2)cc1	ZINC000000127853	38/40/60/178384060	XJSQXVFZPMZDCQ-UHFFFAOYSA-N	0	217.312	BF	2.867	0	Anodyne	ref	BFAARN	Cc1ccc(C(=O)N2CCC(C)CC2)cc1	 
Cc1cccc(C(=O)NCc2ccccc2)c1	ZINC000000128757	01/95/40/179019540	KNQRVGSKGZJGQV-UHFFFAOYSA-N	0	225.291	BF	2.925	0	Anodyne	ref	BFAARN	Cc1cccc(C(=O)NCc2ccccc2)c1	 
Cc1ccccc1OCC(=O)NC1CCCCC1	ZINC000000130062	30/96/42/179309642	FIASLTIJWIWMTC-UHFFFAOYSA-N	0	247.338	BF	2.823	0	Anodyne	ref	BFAARN	Cc1ccccc1OCC(=O)NC1CCCCC1	 
Nc1sc(-c2ccccc2)cc1C(=O)O	ZINC000000131689	82/97/91/383829791	QSMQLBVCCAMZHD-UHFFFAOYSA-N	-1	219.265	BF	2.696	0	Anodyne	ref	BFAARM	Nc1sc(-c2ccccc2)cc1C(=O)[O-]	 
O=C(O)c1ccc(COc2ccc(F)cc2)o1	ZINC000000133373	67/64/33/342676433	KYVUAHUKHLAOMK-UHFFFAOYSA-N	-1	236.198	BF	2.696	0	Anodyne	ref	BFAARM	O=C([O-])c1ccc(COc2ccc(F)cc2)o1	 
Cc1ccc(-c2ccc(C(=O)O)[nH]2)cc1	ZINC000000135487	32/25/86/178322586	GUGAOFSHCGOMMW-UHFFFAOYSA-N	-1	201.225	BF	2.688	0	Anodyne	ref	BFAARM	Cc1ccc(-c2ccc(C(=O)[O-])[nH]2)cc1	 
N#Cc1ccc(NC(=O)c2cccs2)cc1	ZINC000000138189	11/93/41/181119341	LXYSTXOKGMXKEQ-UHFFFAOYSA-N	0	228.276	BF	2.872	0	Mild	ref	BFEARN	N#Cc1ccc(NC(=O)c2cccs2)cc1	 
N#Cc1cccc(NC(=O)Cc2ccccc2)c1	ZINC000000142250	14/05/42/181140542	AFBIVMWJUFLUNW-UHFFFAOYSA-N	0	236.274	BF	2.739	0	Mild	ref	BFEARN	N#Cc1cccc(NC(=O)Cc2ccccc2)c1	 
N#Cc1ccccc1NC(=O)Cc1ccccc1	ZINC000000142255	14/82/82/181148282	JJPHVTNXDLOCHU-UHFFFAOYSA-N	0	236.274	BF	2.739	0	Mild	ref	BFEARN	N#Cc1ccccc1NC(=O)Cc1ccccc1	 
N#Cc1ccc(NC(=O)Cc2ccccc2)cc1	ZINC000000142261	11/85/33/181118533	JNHXEOULFHSWMY-UHFFFAOYSA-N	0	236.274	BF	2.739	0	Mild	ref	BFEARN	N#Cc1ccc(NC(=O)Cc2ccccc2)cc1	 
COc1ccc(CC(=O)NC2CCCCC2)cc1	ZINC000000142289	40/72/48/187407248	OUQSDJMKYLLVED-UHFFFAOYSA-N	0	247.338	BF	2.687	0	Anodyne	ref	BFAARN	COc1ccc(CC(=O)NC2CCCCC2)cc1	in-vivo
C[C@H](C(=O)Nc1ccccn1)c1ccccc1	ZINC000000142446	67/70/47/342677047	LHPOUVZZNFLHER-NSHDSACASA-N	0	226.279	BF	2.824	0	Anodyne	ref	BFAARN	C[C@H](C(=O)Nc1ccccn1)c1ccccc1	 
C[C@@H](C(=O)Nc1ccccn1)c1ccccc1	ZINC000000142450	67/70/17/342677017	LHPOUVZZNFLHER-LLVKDONJSA-N	0	226.279	BF	2.824	0	Anodyne	ref	BFAARN	C[C@@H](C(=O)Nc1ccccn1)c1ccccc1	 
Cc1cc(C)n(C(=O)COc2ccccc2C)n1	ZINC000000142703	92/14/32/177921432	GJFWQXNVWWLNEL-UHFFFAOYSA-N	0	244.294	BF	2.528	0	Anodyne	ref	BFAARN	Cc1cc(C)n(C(=O)COc2ccccc2C)n1	 
N#Cc1ccccc1NC(=O)c1ccc(F)cc1	ZINC000000142732	14/81/18/181148118	BIGFKIVIYQNJSR-UHFFFAOYSA-N	0	240.237	BF	2.95	0	Mild	ref	BFEARN	N#Cc1ccccc1NC(=O)c1ccc(F)cc1	 
Nc1ccccc1C(=O)Nc1ccccc1	ZINC000000150129	75/29/47/181752947	FDPVTENMNDHFNK-UHFFFAOYSA-N	0	212.252	BF	2.521	0	Anodyne	ref	BFAARN	Nc1ccccc1C(=O)Nc1ccccc1	 
C[C@H](NC(=O)c1ccccc1N)c1ccccc1	ZINC000000150133	83/31/71/383833171	KBRHMOXICLSVTL-NSHDSACASA-N	0	240.306	BF	2.76	0	Anodyne	ref	BFAARN	C[C@H](NC(=O)c1ccccc1N)c1ccccc1	 
C[C@@H](NC(=O)c1ccccc1N)c1ccccc1	ZINC000000150134	85/06/70/175850670	KBRHMOXICLSVTL-LLVKDONJSA-N	0	240.306	BF	2.76	0	Anodyne	ref	BFAARN	C[C@@H](NC(=O)c1ccccc1N)c1ccccc1	 
O=C(O)C1c2ccccc2-c2ccccc21	ZINC000000154881	83/52/53/383835253	DNVJGJUGFFYUPT-UHFFFAOYSA-N	-1	210.232	BF	2.884	0	Anodyne	ref	BFAARM	O=C([O-])C1c2ccccc2-c2ccccc21	 
Cc1cccc(C(=O)Nc2ccc(N)cc2)c1	ZINC000000156716	67/80/56/342678056	HZZTVMGUTMBMPG-UHFFFAOYSA-N	0	226.279	BF	2.83	0	Clean	ref	BFCARN	Cc1cccc(C(=O)Nc2ccc(N)cc2)c1	 
O=C(O)c1ccccc1C(=O)c1ccccc1	ZINC000000157193	58/11/42/182581142	FGTYTUFKXYPTML-UHFFFAOYSA-N	-1	226.231	BF	2.616	0	Anodyne	ref	BFAARM	O=C([O-])c1ccccc1C(=O)c1ccccc1	 
O=C(NC1CCCCC1)NC1CCCCC1	ZINC000000157375	11/23/37/182112337	ADFXKUOMJKEIND-UHFFFAOYSA-N	0	224.348	BF	2.951	0	Anodyne	ref	BFAARN	O=C(NC1CCCCC1)NC1CCCCC1	in-vivo
Brc1cccc2cnccc12	ZINC000000158610	10/10/20/166101020	CYJZJGYYTFQQBY-UHFFFAOYSA-N	0	208.058	BF	2.997	0	Anodyne	ref	BFAARN	Brc1cccc2cnccc12	in-vitro