CC(C)NC[C@@H](O)c1ccccc1Cl	ZINC000000000178	11/08/85/167110885	SSMSBSWKLKKXGG-LLVKDONJSA-N	1	213.708	BE	2.371	0	Anodyne	ref	BEAARO	CC(C)[NH2+]C[C@@H](O)c1ccccc1Cl	in-man
Cc1cc(C2CCCCC2)n(O)c(=O)c1	ZINC000000001145	66/93/88/342669388	SCKYRAXSEDYPSA-UHFFFAOYSA-N	0	207.273	BE	2.442	1	Anodyne	mid	BEAAMN	Cc1cc(C2CCCCC2)n(O)c(=O)c1	fda
Cc1cc(C2CCCCC2)n(O)c(=O)c1	ZINC000000001145	66/93/86/342669386	SCKYRAXSEDYPSA-UHFFFAOYSA-N	-1	207.273	BE	2.442	0	Anodyne	ref	BEAARM	Cc1cc(C2CCCCC2)n([O-])c(=O)c1	fda
O=C1c2c(O)cccc2Cc2cccc(O)c21	ZINC000000001322	05/66/93/387056693	NUZWLKWWNNJHPT-UHFFFAOYSA-N	-1	226.231	BE	2.233	3	Anodyne	high	BEAAHM	O=C1c2c([O-])cccc2Cc2cccc(O)c21	world aggregator
O=C1c2c(O)cccc2Cc2cccc(O)c21	ZINC000000001322	05/66/84/387056684	NUZWLKWWNNJHPT-UHFFFAOYSA-N	0	226.231	BE	2.233	0	Anodyne	ref	BEAARN	O=C1c2c(O)cccc2Cc2cccc(O)c21	world aggregator
CCOC(=O)c1c(C)n(C)c2ccc(O)cc12	ZINC000000001652	28/85/49/170288549	YTBNTDMBGXAOCG-UHFFFAOYSA-N	0	233.267	BE	2.369	0	Anodyne	ref	BEAARN	CCOC(=O)c1c(C)n(C)c2ccc(O)cc12	in-man
O=C(Nc1ccc(O)cc1)c1ccccc1O	ZINC000000001856	36/07/74/182360774	LGCMKPRGGJRYGM-UHFFFAOYSA-N	-1	229.235	BE	2.35	1	Anodyne	mid	BEAAMM	O=C(Nc1ccc(O)cc1)c1ccccc1[O-]	in-man
O=C(Nc1ccc(O)cc1)c1ccccc1O	ZINC000000001856	36/07/68/182360768	LGCMKPRGGJRYGM-UHFFFAOYSA-N	0	229.235	BE	2.35	0	Anodyne	ref	BEAARN	O=C(Nc1ccc(O)cc1)c1ccccc1O	in-man
CC(=O)Oc1cc(C(F)(F)F)ccc1C(=O)O	ZINC000000002220	66/95/75/342669575	RMWVZGDJPAKBDE-UHFFFAOYSA-N	-1	248.156	BE	2.329	0	Anodyne	ref	BEAARM	CC(=O)Oc1cc(C(F)(F)F)ccc1C(=O)[O-]	world
O=C(O)/C=C/c1ccc(Cn2ccnc2)cc1	ZINC000000005389	81/80/05/383818005	SHZKQBHERIJWAO-AATRIKPKSA-N	0	228.251	BE	2.029	2	Anodyne	low	BEAALN	O=C([O-])/C=C/c1ccc(Cn2cc[nH+]c2)cc1	investigational
O=C(O)/C=C/c1ccc(Cn2ccnc2)cc1	ZINC000000005389	81/80/02/383818002	SHZKQBHERIJWAO-AATRIKPKSA-N	-1	228.251	BE	2.029	0	Anodyne	ref	BEAARM	O=C([O-])/C=C/c1ccc(Cn2ccnc2)cc1	investigational
NC1=NC[C@@H]2c3ccccc3Cc3ccccc3N12	ZINC000000006157	33/93/62/181339362	WHWZLSFABNNENI-OAHLLOKOSA-N	1	249.317	BE	2.467	0	Anodyne	ref	BEAARO	[NH2+]=C1NC[C@@H]2c3ccccc3Cc3ccccc3N12	fda
O=C(c1ccc2nccnc2c1)N1CCCCC1	ZINC000000006489	66/97/26/342669726	ANDGGVOPIJEHOF-UHFFFAOYSA-N	0	241.294	BE	2.256	0	Anodyne	ref	BEAARN	O=C(c1ccc2nccnc2c1)N1CCCCC1	investigational
C[C@@H](N)C1CCC(C(=O)Nc2ccncc2)CC1	ZINC000000006989	80/17/81/175801781	IYOZTVGMEWJPKR-VOMCLLRMSA-N	1	247.342	BE	2.174	0	Anodyne	ref	BEAARO	C[C@@H]([NH3+])C1CCC(C(=O)Nc2ccncc2)CC1	in-vitro
CC(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1	ZINC000000008596	81/80/11/383818011	DJKNRCWSXSZACF-UHFFFAOYSA-N	0	234.299	BE	2.173	0	Anodyne	ref	BEAARN	CC(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1	investigational
COc1ccc(C(=O)c2ccccc2O)c(O)c1	ZINC000000037293	09/84/02/188098402	MEZZCSHVIGVWFI-UHFFFAOYSA-N	0	244.246	BE	2.337	2	Anodyne	low	BEAALN	COc1ccc(C(=O)c2ccccc2O)c(O)c1	in-man
COc1ccc(C(=O)c2ccccc2O)c(O)c1	ZINC000000037293	09/84/00/188098400	MEZZCSHVIGVWFI-UHFFFAOYSA-N	-1	244.246	BE	2.337	1	Anodyne	mid	BEAAMM	COc1ccc(C(=O)c2ccccc2O)c([O-])c1	in-man
COc1ccc(C(=O)c2ccccc2O)c(O)c1	ZINC000000037293	09/83/98/188098398	MEZZCSHVIGVWFI-UHFFFAOYSA-N	0	244.246	BE	2.337	0	Anodyne	ref	BEAARN	COc1ccc(C(=O)c2ccccc2[O-])c([O-])c1	in-man
NC(=O)c1sc(-c2ccsc2)cc1N	ZINC000000081904	31/43/18/181314318	BMUACLADCKCNKZ-UHFFFAOYSA-N	0	224.31	BE	2.158	0	Anodyne	ref	BEAARN	NC(=O)c1sc(-c2ccsc2)cc1N	in-vivo
CN1CCCN=C1/C=C/c1cccs1	ZINC000000097996	01/90/65/173019065	YSAUAVHXTIETRK-AATRIKPKSA-N	1	206.314	BE	2.495	0	Anodyne	ref	BEAARO	CN1CCC[NH+]=C1/C=C/c1cccs1	in-man
c1ccc2c(c1)CCC[C@H]2C1=NCCN1	ZINC000000113426	82/74/74/383827474	BYJAVTDNIXVSPW-GFCCVEGCSA-N	1	200.285	BE	2.108	0	Anodyne	ref	BEAARO	c1ccc2c(c1)CCC[C@H]2C1=[NH+]CCN1	fda
c1ccc2c(c1)CCC[C@@H]2C1=NCCN1	ZINC000000113428	42/46/27/387424627	BYJAVTDNIXVSPW-LBPRGKRZSA-N	1	200.285	BE	2.108	0	Anodyne	ref	BEAARO	c1ccc2c(c1)CCC[C@@H]2C1=[NH+]CCN1	fda
c1ccc2c(CC3=NCCN3)cccc2c1	ZINC000000119717	42/54/08/387425408	CNIIGCLFLJGOGP-UHFFFAOYSA-N	1	210.28	BE	2.384	0	Anodyne	ref	BEAARO	c1ccc2c(CC3=[NH+]CCN3)cccc2c1	fda
c1ccc([C@H]2CN3CCSC3=N2)cc1	ZINC000000119839	83/11/80/383831180	HLFSDGLLUJUHTE-SNVBAGLBSA-N	1	204.298	BE	2.146	1	Anodyne	mid	BEAAMO	c1ccc([C@H]2CN3CCSC3=[NH+]2)cc1	world
c1ccc([C@H]2CN3CCSC3=N2)cc1	ZINC000000119839	83/11/75/383831175	HLFSDGLLUJUHTE-SNVBAGLBSA-N	0	204.298	BE	2.146	0	Anodyne	ref	BEAARN	c1ccc([C@H]2CN3CCSC3=N2)cc1	world
c1ccc([C@@H]2CN3CCSC3=N2)cc1	ZINC000000119842	83/12/59/383831259	HLFSDGLLUJUHTE-JTQLQIEISA-N	1	204.298	BE	2.146	1	Anodyne	mid	BEAAMO	c1ccc([C@@H]2CN3CCSC3=[NH+]2)cc1	in-man
c1ccc([C@@H]2CN3CCSC3=N2)cc1	ZINC000000119842	83/12/53/383831253	HLFSDGLLUJUHTE-JTQLQIEISA-N	0	204.298	BE	2.146	0	Anodyne	ref	BEAARN	c1ccc([C@@H]2CN3CCSC3=N2)cc1	in-man
C1CCN2C[C@H]3C[C@H](CN4CCCC[C@H]34)[C@@H]2C1	ZINC000000156956	09/65/06/188096506	SLRCCWJSBJZJBV-TUVASFSCSA-N	1	234.387	BE	2.345	1	Anodyne	mid	BEAAMO	C1CCN2C[C@H]3C[C@H](C[N@H+]4CCCC[C@H]34)[C@@H]2C1	in-man
C1CCN2C[C@H]3C[C@H](CN4CCCC[C@H]34)[C@@H]2C1	ZINC000000156956	09/65/04/188096504	SLRCCWJSBJZJBV-TUVASFSCSA-N	1	234.387	BE	2.345	1	Anodyne	mid	BEAAMO	C1CCN2C[C@H]3C[C@H](C[N@@H+]4CCCC[C@H]34)[C@@H]2C1	in-man
C1CCN2C[C@H]3C[C@H](CN4CCCC[C@H]34)[C@@H]2C1	ZINC000000156956	09/65/02/188096502	SLRCCWJSBJZJBV-TUVASFSCSA-N	1	234.387	BE	2.345	1	Anodyne	mid	BEAAMO	C1CC[N@@H+]2C[C@H]3C[C@H](CN4CCCC[C@H]34)[C@@H]2C1	in-man
C1CCN2C[C@H]3C[C@H](CN4CCCC[C@H]34)[C@@H]2C1	ZINC000000156956	09/65/00/188096500	SLRCCWJSBJZJBV-TUVASFSCSA-N	1	234.387	BE	2.345	1	Anodyne	mid	BEAAMO	C1CC[N@H+]2C[C@H]3C[C@H](CN4CCCC[C@H]34)[C@@H]2C1	in-man
C1CCN2C[C@H]3C[C@H](CN4CCCC[C@H]34)[C@@H]2C1	ZINC000000156956	09/64/99/188096499	SLRCCWJSBJZJBV-TUVASFSCSA-N	1	234.387	BE	2.345	1	Anodyne	mid	BEAAMO	C1CC[NH+]2C[C@H]3C[C@H](C[N@H+]4CCCC[C@H]34)[C@@H]2C1	in-man
C1CCN2C[C@H]3C[C@H](CN4CCCC[C@H]34)[C@@H]2C1	ZINC000000156956	09/64/97/188096497	SLRCCWJSBJZJBV-TUVASFSCSA-N	2	234.387	BE	2.345	1	Anodyne	mid	BEAAMP	C1CC[NH+]2C[C@H]3C[C@H](C[N@@H+]4CCCC[C@H]34)[C@@H]2C1	in-man
C1CCN2C[C@H]3C[C@H](CN4CCCC[C@H]34)[C@@H]2C1	ZINC000000156956	09/64/96/188096496	SLRCCWJSBJZJBV-TUVASFSCSA-N	2	234.387	BE	2.345	1	Anodyne	mid	BEAAMP	C1CC[N@H+]2C[C@H]3C[C@H](C[NH+]4CCCC[C@H]34)[C@@H]2C1	in-man
C1CCN2C[C@H]3C[C@H](CN4CCCC[C@H]34)[C@@H]2C1	ZINC000000156956	09/64/93/188096493	SLRCCWJSBJZJBV-TUVASFSCSA-N	2	234.387	BE	2.345	0	Anodyne	ref	BEAARP	C1CC[N@@H+]2C[C@H]3C[C@H](C[NH+]4CCCC[C@H]34)[C@@H]2C1	in-man
O=C(c1ccc(O)cc1)c1ccccc1O	ZINC000000340411	41/80/29/344418029	HUYKZYIAFUBPAQ-UHFFFAOYSA-N	-2	214.22	BE	2.329	3	Anodyne	high	BEAAHL	O=C(c1ccc([O-])cc1)c1ccccc1[O-]	in-vivo
O=C(c1ccc(O)cc1)c1ccccc1O	ZINC000000340411	41/80/26/344418026	HUYKZYIAFUBPAQ-UHFFFAOYSA-N	0	214.22	BE	2.329	1	Anodyne	mid	BEAAMN	O=C(c1ccc(O)cc1)c1ccccc1O	in-vivo
O=C(c1ccc(O)cc1)c1ccccc1O	ZINC000000340411	41/80/19/344418019	HUYKZYIAFUBPAQ-UHFFFAOYSA-N	-1	214.22	BE	2.329	0	Anodyne	ref	BEAARM	O=C(c1ccc(O)cc1)c1ccccc1[O-]	in-vivo
Clc1cccc(Cl)c1N=C1NCCN1	ZINC000000896484	69/44/13/342694413	GJSURZIOUXUGAL-UHFFFAOYSA-N	0	230.098	BE	2.174	3	Mild	high	BEEAHN	Clc1cccc(Cl)c1NC1=NCCN1	fda aggregator
Clc1cccc(Cl)c1N=C1NCCN1	ZINC000000896484	69/44/11/342694411	GJSURZIOUXUGAL-UHFFFAOYSA-N	0	230.098	BE	2.174	0	Mild	ref	BEEARN	Clc1cccc(Cl)c1NC1=[NH+]CCN1	fda aggregator
C=CCc1cc(OC)c(OC)c(OC)c1	ZINC000000899845	90/07/84/355900784	BPLQKQKXWHCZSS-UHFFFAOYSA-N	0	208.257	BE	2.441	0	Mild	ref	BEEARN	C=CCc1cc(OC)c(OC)c(OC)c1	in-man endogenous
CCCN[C@@H](C)C(=O)Nc1ccccc1C	ZINC000001530816	27/47/71/169274771	MVFGUOIZUNYYSO-NSHDSACASA-N	0	220.316	BE	2.322	3	Anodyne	high	BEAAHN	CCCN[C@@H](C)C(=O)Nc1ccccc1C	fda
CCCN[C@@H](C)C(=O)Nc1ccccc1C	ZINC000001530816	27/47/69/169274769	MVFGUOIZUNYYSO-NSHDSACASA-N	1	220.316	BE	2.322	0	Anodyne	ref	BEAARO	CCC[NH2+][C@@H](C)C(=O)Nc1ccccc1C	fda
CCCN[C@H](C)C(=O)Nc1ccccc1C	ZINC000001530817	28/49/11/169284911	MVFGUOIZUNYYSO-LLVKDONJSA-N	0	220.316	BE	2.322	3	Anodyne	high	BEAAHN	CCCN[C@H](C)C(=O)Nc1ccccc1C	fda
CCCN[C@H](C)C(=O)Nc1ccccc1C	ZINC000001530817	28/49/10/169284910	MVFGUOIZUNYYSO-LLVKDONJSA-N	1	220.316	BE	2.322	0	Anodyne	ref	BEAARO	CCC[NH2+][C@H](C)C(=O)Nc1ccccc1C	fda
O=C(O)CCCCCCCCC(=O)O	ZINC000001531045	90/26/63/383902663	CXMXRPHRNRROMY-UHFFFAOYSA-N	-2	202.25	BE	2.276	0	Anodyne	ref	BEAARL	O=C([O-])CCCCCCCCC(=O)[O-]	in-man endogenous
NC(=O)CCCC[C@H]1CCSS1	ZINC000001532582	68/00/98/571680098	FCCDDURTIIUXBY-ZETCQYMHSA-N	0	205.348	BE	2.186	0	Reactive	ref	BEGARN	NC(=O)CCCC[C@H]1CCSS1	world endogenous
NC(=O)CCCC[C@@H]1CCSS1	ZINC000001532583	67/99/40/571679940	FCCDDURTIIUXBY-SSDOTTSWSA-N	0	205.348	BE	2.186	0	Reactive	ref	BEGARN	NC(=O)CCCC[C@@H]1CCSS1	world endogenous
CN(CCc1ccccn1)CCc1ccccn1	ZINC000001562276	70/30/80/342703080	PQHKIDBZBKQYMR-UHFFFAOYSA-N	0	241.338	BE	2.194	3	Anodyne	high	BEAAHN	CN(CCc1ccccn1)CCc1ccccn1	in-vitro
CN(CCc1ccccn1)CCc1ccccn1	ZINC000001562276	70/30/76/342703076	PQHKIDBZBKQYMR-UHFFFAOYSA-N	1	241.338	BE	2.194	0	Anodyne	ref	BEAARO	C[NH+](CCc1ccccn1)CCc1ccccn1	in-vitro
CC(C)NC[C@H](O)c1ccccc1Cl	ZINC000001576350	11/56/34/167115634	SSMSBSWKLKKXGG-NSHDSACASA-N	1	213.708	BE	2.371	0	Anodyne	ref	BEAARO	CC(C)[NH2+]C[C@H](O)c1ccccc1Cl	in-man
CCCCOC(=O)c1ccccc1C(=O)O	ZINC000001586773	90/88/30/383908830	YZBOVSFWWNVKRJ-UHFFFAOYSA-N	-1	222.24	BE	2.342	0	Anodyne	ref	BEAARM	CCCCOC(=O)c1ccccc1C(=O)[O-]	in-man endogenous
CNC(=O)Oc1ccccc1OC(C)C	ZINC000001590885	29/37/12/173293712	ISRUGXGCCGIOQO-UHFFFAOYSA-N	0	209.245	BE	2.192	0	Anodyne	ref	BEAARN	CNC(=O)Oc1ccccc1OC(C)C	world biogenic
Nc1ccc(NC(=O)Nc2ccc(N)cc2)cc1	ZINC000001706915	71/01/49/342710149	MAPWYRGGJSHAAU-UHFFFAOYSA-N	0	242.282	BE	2.495	0	Clean	ref	BECARN	Nc1ccc(NC(=O)Nc2ccc(N)cc2)cc1	 
NC1=NC[C@H]2c3ccccc3Cc3ccccc3N12	ZINC000001999487	33/95/73/181339573	WHWZLSFABNNENI-HNNXBMFYSA-N	1	249.317	BE	2.467	0	Anodyne	ref	BEAARO	[NH2+]=C1NC[C@H]2c3ccccc3Cc3ccccc3N12	fda
O=C(NC1CC1)c1cc(-c2cccs2)on1	ZINC000002803051	09/93/39/182099339	SYENTKHGMVKGAQ-UHFFFAOYSA-N	0	234.28	BE	2.295	0	Anodyne	ref	BEAARN	O=C(NC1CC1)c1cc(-c2cccs2)on1	in-vitro
Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1	ZINC000003861498	35/11/81/351351181	PZPZDEIASIKHPY-UHFFFAOYSA-N	0	242.234	BE	2.408	0	Bother	ref	BEBARN	Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1	in-vitro
C[C@H](N)C1CCC(C(=O)Nc2ccncc2)CC1	ZINC000003873971	51/27/16/353512716	IYOZTVGMEWJPKR-UNXYVOJBSA-N	1	247.342	BE	2.174	0	Anodyne	ref	BEAARO	C[C@H]([NH3+])C1CCC(C(=O)Nc2ccncc2)CC1	in-vitro
CC1=C2[C@H]3OC(=O)[C@@H](C)[C@@H]3CC[C@@]2(C)C=CC1=O	ZINC000003881689	09/12/68/168091268	XJHDMGJURBVLLE-BOCCBSBMSA-N	0	246.306	BE	2.42	0	Mild	ref	BEEARN	CC1=C2[C@H]3OC(=O)[C@@H](C)[C@@H]3CC[C@@]2(C)C=CC1=O	in-man biogenic
Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1	ZINC000003888984	42/52/38/351425238	UTKUVRNVYFTEHF-UHFFFAOYSA-N	0	206.123	BE	2.196	0	Bother	ref	BEBARN	Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1	in-vitro
O=C(/C=C/c1cccnc1)c1ccncc1	ZINC000003997313	03/72/30/384037230	UOWGYMNWMDNSTL-ONEGZZNKSA-N	0	210.236	BE	2.373	0	Mild	ref	BEEARN	O=C(/C=C/c1cccnc1)c1ccncc1	in-vivo
Cc1cc(Cl)ccc1OCCCC(=O)NO	ZINC000004148260	06/87/22/178068722	JHSXDAWGLCZYSM-UHFFFAOYSA-N	-1	243.69	BE	2.313	3	Mild	high	BEEAHM	Cc1cc(Cl)ccc1OCCCC(=O)N[O-]	in-vitro
Cc1cc(Cl)ccc1OCCCC(=O)NO	ZINC000004148260	06/87/21/178068721	JHSXDAWGLCZYSM-UHFFFAOYSA-N	0	243.69	BE	2.313	0	Mild	ref	BEEARN	Cc1cc(Cl)ccc1OCCCC(=O)NO	in-vitro
CCC(=O)NC[C@@H]1C[C@H]1c1cccc2c1CCO2	ZINC000004392649	23/13/03/168231303	PTOIAAWZLUQTIO-GXFFZTMASA-N	0	245.322	BE	2.251	0	Anodyne	ref	BEAARN	CCC(=O)NC[C@@H]1C[C@H]1c1cccc2c1CCO2	fda
C1=C2CCCN[C@H]2[C@@H]2C[C@H]1[C@H]1CCCCN1C2	ZINC000005133859	75/86/79/342758679	SKOLRLSBMUGVOY-GBJTYRQASA-N	2	232.371	BE	2.169	1	Anodyne	mid	BEAAMP	C1=C2CCC[NH2+][C@H]2[C@@H]2C[C@H]1[C@H]1CCCC[N@H+]1C2	in-vitro biogenic
C1=C2CCCN[C@H]2[C@@H]2C[C@H]1[C@H]1CCCCN1C2	ZINC000005133859	75/86/77/342758677	SKOLRLSBMUGVOY-GBJTYRQASA-N	2	232.371	BE	2.169	1	Anodyne	mid	BEAAMP	C1=C2CCC[NH2+][C@H]2[C@@H]2C[C@H]1[C@H]1CCCC[N@@H+]1C2	in-vitro biogenic
C1=C2CCCN[C@H]2[C@@H]2C[C@H]1[C@H]1CCCCN1C2	ZINC000005133859	75/86/73/342758673	SKOLRLSBMUGVOY-GBJTYRQASA-N	1	232.371	BE	2.169	0	Anodyne	ref	BEAARO	C1=C2CCC[NH2+][C@H]2[C@@H]2C[C@H]1[C@H]1CCCCN1C2	in-vitro biogenic
COc1cccc2c1nc1ccccc1[n+]2C	ZINC000006068493	30/67/30/175306730	NIKBRKQHDZFDIQ-UHFFFAOYSA-N	1	225.271	BE	2.221	0	Bother	ref	BEBARO	COc1cccc2c1nc1ccccc1[n+]2C	in-vitro
CC(=O)c1cc2c(o1)C(=O)c1ccccc1C2=O	ZINC000013306865	44/99/28/166449928	DPHUWDIXHNQOSY-UHFFFAOYSA-N	0	240.214	BE	2.258	0	Clean	ref	BECARN	CC(=O)c1cc2c(o1)C(=O)c1ccccc1C2=O	investigational
COc1ccc2c(c1)CN(C)CCS2	ZINC000044676011	20/97/53/175209753	BGVCEGVSQDOGSB-UHFFFAOYSA-N	0	209.314	BE	2.233	1	Anodyne	mid	BEAAMN	COc1ccc2c(c1)CN(C)CCS2	in-vitro
COc1ccc2c(c1)CN(C)CCS2	ZINC000044676011	20/97/50/175209750	BGVCEGVSQDOGSB-UHFFFAOYSA-N	1	209.314	BE	2.233	1	Anodyne	mid	BEAAMO	COc1ccc2c(c1)C[N@H+](C)CCS2	in-vitro
COc1ccc2c(c1)CN(C)CCS2	ZINC000044676011	20/97/47/175209747	BGVCEGVSQDOGSB-UHFFFAOYSA-N	1	209.314	BE	2.233	0	Anodyne	ref	BEAARO	COc1ccc2c(c1)C[N@@H+](C)CCS2	in-vitro
NC1CCC(N[C@@H]2C[C@H]2c2ccccc2)CC1	ZINC000094088493	34/20/88/181342088	ALHBJBCQLJZYON-PFSRBDOWSA-N	2	230.355	BE	2.402	0	Anodyne	ref	BEAARP	[NH3+]C1CCC([NH2+][C@@H]2C[C@H]2c2ccccc2)CC1	in-vitro
O=C1C=CC=C/C1=C1/C=Cc2cccnc2N1	ZINC000100487560	85/42/94/384854294	WOJJESNAZFYOMY-VAWYXSNFSA-N	0	222.247	BE	2.47	0	Mild	ref	BEEARN	O=C1C=CC=CC1=c1ccc2c(n1)NC=CC=2	 
C[C@@H](N)[C@@H]1CC[C@@H](C(=O)Nc2ccncc2)CC1	ZINC000252286763	64/68/29/385646829	IYOZTVGMEWJPKR-IJLUTSLNSA-N	1	247.342	BE	2.174	0	Anodyne	ref	BEAARO	C[C@@H]([NH3+])[C@@H]1CC[C@@H](C(=O)Nc2ccncc2)CC1	world