C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23	ZINC000000538273	74/62/94/524746294	GSDSWSVVBLHKDQ-JTQLQIEISA-N	0	361.373	FD	1.544	2	Anodyne	low	FDAALN	C[C@H]1COc2c(N3CC[NH+](C)CC3)c(F)cc3c(=O)c(C(=O)[O-])cn1c23	fda
C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23	ZINC000000538273	74/62/74/524746274	GSDSWSVVBLHKDQ-JTQLQIEISA-N	-1	361.373	FD	1.544	0	Anodyne	ref	FDAARM	C[C@H]1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)[O-])cn1c23	fda
COc1ccc(Cl)cc1C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000000641902	14/14/39/263141439	KVWWTCSJLGHLRM-UHFFFAOYSA-N	0	368.842	FD	1.969	0	Anodyne	ref	FDAARN	COc1ccc(Cl)cc1C(=O)NCCc1ccc(S(N)(=O)=O)cc1	in-vitro
CC(C)c1ccc(NC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1	ZINC000000898145	33/75/09/219337509	HEQDZPHDVAOBLN-UHFFFAOYSA-N	0	355.398	FD	1.196	0	Anodyne	ref	FDAARN	CC(C)c1ccc(NC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1	in-vivo
O=C(c1ccc(C(=O)O)c(C(=O)O)c1)c1ccc(C(=O)O)c(C(=O)O)c1	ZINC000001995075	23/67/18/518236718	UITKHKNFVCYWNG-UHFFFAOYSA-N	-4	358.258	FD	1.71	0	Anodyne	ref	FDAARL	O=C(c1ccc(C(=O)[O-])c(C(=O)[O-])c1)c1ccc(C(=O)[O-])c(C(=O)[O-])c1	 
CC1(C)CC(=O)N(CCCCN2CCN(c3ncccn3)CC2)C(=O)C1	ZINC000002021499	38/25/46/132382546	QOIGKGMMAGJZNZ-UHFFFAOYSA-N	0	359.474	FD	1.554	1	Anodyne	mid	FDAAMN	CC1(C)CC(=O)N(CCCCN2CCN(c3ncccn3)CC2)C(=O)C1	investigational
CC1(C)CC(=O)N(CCCCN2CCN(c3ncccn3)CC2)C(=O)C1	ZINC000002021499	38/25/45/132382545	QOIGKGMMAGJZNZ-UHFFFAOYSA-N	1	359.474	FD	1.554	0	Anodyne	ref	FDAARO	CC1(C)CC(=O)N(CCCC[NH+]2CCN(c3ncccn3)CC2)C(=O)C1	investigational
C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@]2(O)C(=O)CO	ZINC000003833821	28/04/39/518280439	OIGNJSKKLXVSLS-VWUMJDOOSA-N	0	360.45	FD	1.558	0	Mild	ref	FDEARN	C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@]2(O)C(=O)CO	fda
C=C1CC[C@H]2[C@@](C)(CC[C@@H](O)[C@@]2(C)CO)[C@@H]1C/C=C1/C(=O)OC[C@H]1O	ZINC000003881797	28/01/74/518280174	BOJKULTULYSRAS-OTESTREVSA-N	0	350.455	FD	1.963	0	Mild	ref	FDEARN	C=C1CC[C@H]2[C@@](C)(CC[C@@H](O)[C@@]2(C)CO)[C@@H]1C/C=C1/C(=O)OC[C@H]1O	investigational biogenic
C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]34O[C@H]4C[C@]2(C)[C@@]1(O)C(=O)CO	ZINC000006066702	36/19/29/518361929	GBDXNHBVYAMODG-DEGNENOVSA-N	0	372.461	FD	1.964	0	Anodyne	ref	FDAARN	C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]34O[C@H]4C[C@]2(C)[C@@]1(O)C(=O)CO	 
C[C@]12C[C@@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@]2(O)C(=O)CO	ZINC000006472665	67/47/99/210674799	OIGNJSKKLXVSLS-MKIDGPAKSA-N	0	360.45	FD	1.558	0	Mild	ref	FDEARN	C[C@]12C[C@@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@]2(O)C(=O)CO	 
CC(C)(C)OC(=O)N[C@@H](CNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)O	ZINC000015722147	73/16/02/518731602	XKHQTCSLBRZQAC-JTQLQIEISA-N	-1	370.318	FD	1.893	0	Bother	ref	FDBARM	CC(C)(C)OC(=O)N[C@@H](CNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)[O-]	 
COC(=O)c1[nH]c(C(C)(C)NC(=O)OCc2ccccc2)nc(=O)c1O	ZINC000021299554	87/00/84/518870084	NIVUTAZNLHLBAN-UHFFFAOYSA-N	-2	361.354	FD	1.424	3	Anodyne	high	FDAAHL	COC(=O)c1nc(C(C)(C)NC(=O)OCc2ccccc2)[n-]c(=O)c1[O-]	in-vitro
COC(=O)c1[nH]c(C(C)(C)NC(=O)OCc2ccccc2)nc(=O)c1O	ZINC000021299554	87/00/68/518870068	NIVUTAZNLHLBAN-UHFFFAOYSA-N	-1	361.354	FD	1.424	0	Anodyne	ref	FDAARM	COC(=O)c1nc(C(C)(C)NC(=O)OCc2ccccc2)[nH]c(=O)c1[O-]	in-vitro
CC(=O)OCC(CCn1cnc2c(Cl)nc(N)nc21)COC(C)=O	ZINC000021985917	37/29/87/220372987	KXPSHSVVYGZKAV-UHFFFAOYSA-N	0	355.782	FD	1.194	0	Anodyne	ref	FDAARN	CC(=O)OCC(CCn1cnc2c(Cl)nc(N)nc21)COC(C)=O	 
CO/N=C(\C(=O)O)c1csc(NC(=O)[C@H](C)NC(=O)OC(C)(C)C)n1	ZINC000022116348	34/04/42/211340442	GGQBZAQDZRIQNC-QLSOXSIMSA-N	-1	372.403	FD	1.43	0	Mild	ref	FDEBRM	CO/N=C(\C(=O)[O-])c1csc(NC(=O)[C@H](C)NC(=O)OC(C)(C)C)n1	 
CO[C@@H]1O[C@H](COS(=O)(=O)c2ccc(C)cc2)[C@H]2OC(C)(C)O[C@@H]12	ZINC000025757780	08/05/49/519080549	IAPMZKRZMYQZSW-KBUPBQIOSA-N	0	358.412	FD	1.592	0	Mild	ref	FDEARN	CO[C@@H]1O[C@H](COS(=O)(=O)c2ccc(C)cc2)[C@H]2OC(C)(C)O[C@@H]12	in-vitro
CC[C@@]1(O)C(=O)OCc2c1cc1n(c2=O)Cc2cc3c(N)cccc3nc2-1	ZINC000037866089	84/18/10/220841810	FUXVKZWTXQUGMW-FQEVSTJZSA-N	0	363.373	FD	1.662	0	Anodyne	ref	FDAARN	CC[C@@]1(O)C(=O)OCc2c1cc1n(c2=O)Cc2cc3c(N)cccc3nc2-1	investigational biogenic
COc1ncc(F)c2nc(S(=O)(=O)Nc3c(F)cccc3F)nn12	ZINC000038276325	04/06/99/205040699	QZXATCCPQKOEIH-UHFFFAOYSA-N	-1	359.289	FD	1.351	3	Anodyne	high	FDAAHM	COc1ncc(F)c2nc(S(=O)(=O)[N-]c3c(F)cccc3F)nn12	in-vitro
COc1ncc(F)c2nc(S(=O)(=O)Nc3c(F)cccc3F)nn12	ZINC000038276325	04/06/92/205040692	QZXATCCPQKOEIH-UHFFFAOYSA-N	0	359.289	FD	1.351	0	Anodyne	ref	FDAARN	COc1ncc(F)c2nc(S(=O)(=O)Nc3c(F)cccc3F)nn12	in-vitro
CCS(=O)(=O)N1CC(CC#N)(n2cc(-c3ncnc4[nH]ccc34)cn2)C1	ZINC000073069247	66/00/23/521660023	XUZMWHLSFXCVMG-UHFFFAOYSA-N	0	371.426	FD	1.096	0	Mild	ref	FDEARN	CCS(=O)(=O)N1CC(CC#N)(n2cc(-c3ncnc4[nH]ccc34)cn2)C1	investigational
CC[C@@]1(O)C(=O)OCc2c1cc1n(c2=O)CC2=C1Nc1ccccc1C2	ZINC000334163690	56/48/73/529564873	FYYHHJVHSKRZSA-FQEVSTJZSA-N	0	350.374	FD	1.896	0	Anodyne	ref	FDABRN	CC[C@@]1(O)C(=O)OCc2c1cc1n(c2=O)CC2=C1Nc1ccccc1C2