Nc1ccc(/C=C/c2ccccc2)cc1	ZINC000001088043	29/03/08/169290308	VFPLSXYJYAKZCT-VOTSOKGWSA-N	0	195.265	AG	3.439	0	Anodyne	ref	AGAARN	Nc1ccc(/C=C/c2ccccc2)cc1	 
Nc1ccc(C2CCCCC2)cc1	ZINC000001231960	29/08/81/169290881	JLNMBIKJQAKQBH-UHFFFAOYSA-N	0	175.275	AG	3.317	0	Anodyne	ref	AGAARN	Nc1ccc(C2CCCCC2)cc1	 
CC[N+](CC)(CC)Cc1ccccc1	ZINC000001496993	71/33/17/167713317	VBQDSLGFSUGBBE-UHFFFAOYSA-N	1	192.326	AG	3.063	0	Bother	ref	AGBARO	CC[N+](CC)(CC)Cc1ccccc1	in-vitro
CCCCCCOc1ccc(N)cc1	ZINC000001670233	95/59/88/342955988	DJRKHTCUXRGYEU-UHFFFAOYSA-N	0	193.29	AG	3.228	0	Clean	ref	AGCARN	CCCCCCOc1ccc(N)cc1	 
Cc1cccc(C(C)C)c1	ZINC000001699438	86/23/67/168862367	XCYJPXQACVEIOS-UHFFFAOYSA-N	0	134.222	AG	3.118	0	Anodyne	ref	AGAARN	Cc1cccc(C(C)C)c1	in-man endogenous
c1ccc(COc2ccccc2)cc1	ZINC000001713876	29/67/61/351296761	BOTNYLSAWDQNEX-UHFFFAOYSA-N	0	184.238	AG	3.266	0	Anodyne	ref	AGAARN	c1ccc(COc2ccccc2)cc1	 
CCCCCCOc1cccc(N)c1	ZINC000002025168	96/70/53/342967053	NFUUFPNUOVKOIG-UHFFFAOYSA-N	0	193.29	AG	3.228	0	Anodyne	ref	AGAARN	CCCCCCOc1cccc(N)c1	 
O=C1CCCCCCCCCCCN1	ZINC000004521634	37/10/07/169371007	JHWNWJKBPDFINM-UHFFFAOYSA-N	0	197.322	AG	3.017	0	Anodyne	ref	AGAARN	O=C1CCCCCCCCCCCN1	 
CCCCNCc1ccccc1Cl	ZINC000005973592	01/06/72/343010672	PUEUFOKKVOOXEW-UHFFFAOYSA-N	0	197.709	AG	3.23	3	Anodyne	high	AGAAHN	CCCCNCc1ccccc1Cl	 
CCCCNCc1ccccc1Cl	ZINC000005973592	01/06/71/343010671	PUEUFOKKVOOXEW-UHFFFAOYSA-N	1	197.709	AG	3.23	0	Anodyne	ref	AGAARO	CCCC[NH2+]Cc1ccccc1Cl	 
CC[C@@H](C)NCc1ccccc1Cl	ZINC000008326037	35/63/13/351356313	AXSGEXKTBMNPPT-SECBINFHSA-N	0	197.709	AG	3.228	3	Anodyne	high	AGAAHN	CC[C@@H](C)NCc1ccccc1Cl	 
CC[C@@H](C)NCc1ccccc1Cl	ZINC000008326037	35/63/11/351356311	AXSGEXKTBMNPPT-SECBINFHSA-N	1	197.709	AG	3.228	0	Anodyne	ref	AGAARO	CC[C@@H](C)[NH2+]Cc1ccccc1Cl	 
CC[C@H](C)NCc1ccccc1Cl	ZINC000008326788	01/81/15/343018115	AXSGEXKTBMNPPT-VIFPVBQESA-N	0	197.709	AG	3.228	3	Anodyne	high	AGAAHN	CC[C@H](C)NCc1ccccc1Cl	 
CC[C@H](C)NCc1ccccc1Cl	ZINC000008326788	01/81/12/343018112	AXSGEXKTBMNPPT-VIFPVBQESA-N	1	197.709	AG	3.228	0	Anodyne	ref	AGAARO	CC[C@H](C)[NH2+]Cc1ccccc1Cl	 
Clc1ccc(NCC2CC2)cc1	ZINC000008699706	02/32/84/169023284	WFMRFDUZTOOYKV-UHFFFAOYSA-N	0	181.666	AG	3.162	0	Anodyne	ref	AGAARN	Clc1ccc(NCC2CC2)cc1	 
CCCCCCNC1CCCC1	ZINC000019738128	85/28/64/166852864	LKFYDKLTDCPTTJ-UHFFFAOYSA-N	1	169.312	AG	3.099	0	Anodyne	ref	AGAARO	CCCCCC[NH2+]C1CCCC1	 
CN[C@@H](C)c1ccc2ccccc2c1	ZINC000022141185	03/57/67/168035767	VRPIUODNLOVPNH-JTQLQIEISA-N	1	185.27	AG	3.12	0	Anodyne	ref	AGAARO	C[NH2+][C@@H](C)c1ccc2ccccc2c1	 
CN[C@H](C)c1ccc2ccccc2c1	ZINC000022141188	05/26/49/168052649	VRPIUODNLOVPNH-SNVBAGLBSA-N	1	185.27	AG	3.12	0	Anodyne	ref	AGAARO	C[NH2+][C@H](C)c1ccc2ccccc2c1