2-[2-oxo-4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]-1-pyridinyl]acetic acid;3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenol;6-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazine-2-carboxylic acid;1-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazole-4-carboxylic acid;2-[4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazol-1-yl]acetic acid;5-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyridine-2-carboxylic acid

C117H94N26O18 — CID 158245374

IUPAC2-[2-oxo-4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]-1-pyridinyl]acetic acid;3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenol;6-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazine-2-carboxylic acid;1-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazole-4-carboxylic acid;2-[4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazol-1-yl]acetic acid;5-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyridine-2-carboxylic acid
SMILESO=C(O)Cn1cc(-c2cccc(COc3ccc(-c4ccn[nH]4)nc3)c2)cn1.O=C(O)Cn1ccc(-c2cccc(COc3ccc(-c4ccn[nH]4)nc3)c2)cc1=O.O=C(O)c1ccc(-c2cccc(COc3ccc(-c4ccn[nH]4)nc3)c2)cn1.O=C(O)c1cncc(-c2cccc(COc3ccc(-c4ccn[nH]4)nc3)c2)n1.O=C(O)c1cnn(-c2cccc(COc3ccc(-c4ccn[nH]4)nc3)c2)c1.Oc1cccc(COc2ccc(-c3ccn[nH]3)nc2)c1
InChIInChI=1S/C22H18N4O4.C21H16N4O3.C20H17N5O3.C20H15N5O3.C19H15N5O3.C15H13N3O2/c27-21-11-17(7-9-26(21)13-22(28)29)16-3-1-2-15(10-16)14-30-18-4-5-19(23-12-18)20-6-8-24-25-20;26-21(27)20-6-4-16(11-22-20)15-3-1-2-14(10-15)13-28-17-5-7-18(23-12-17)19-8-9-24-25-19;26-20(27)12-25-11-16(9-23-25)15-3-1-2-14(8-15)13-28-17-4-5-18(21-10-17)19-6-7-22-24-19;26-20(27)19-11-21-10-18(24-19)14-3-1-2-13(8-14)12-28-15-4-5-16(22-9-15)17-6-7-23-25-17;25-19(26)14-9-22-24(11-14)15-3-1-2-13(8-15)12-27-16-4-5-17(20-10-16)18-6-7-21-23-18;19-12-3-1-2-11(8-12)10-20-13-4-5-14(16-9-13)15-6-7-17-18-15/h1-12H,13-14H2,(H,24,25)(H,28,29);1-12H,13H2,(H,24,25)(H,26,27);1-11H,12-13H2,(H,22,24)(H,26,27);1-11H,12H2,(H,23,25)(H,26,27);1-11H,12H2,(H,21,23)(H,25,26);1-9,19H,10H2,(H,17,18)
InChIKeyGGBAAGVCELLQEK-UHFFFAOYSA-N
MW2152.20 g/mol
LogP18.67
Rot. Bonds36

About 2-[2-oxo-4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]-1-pyridinyl]acetic acid;3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenol;6-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazine-2-carboxylic acid;1-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazole-4-carboxylic acid;2-[4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazol-1-yl]acetic acid;5-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyridine-2-carboxylic acid

2-[2-oxo-4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]-1-pyridinyl]acetic acid;3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenol;6-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazine-2-carboxylic acid;1-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazole-4-carboxylic acid;2-[4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazol-1-yl]acetic acid;5-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyridine-2-carboxylic acid (PubChem CID 158245374) has the molecular formula C117H94N26O18 and a molecular weight of 2152.20 g/mol. Its IUPAC name is 2-[2-oxo-4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]-1-pyridinyl]acetic acid;3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenol;6-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazine-2-carboxylic acid;1-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazole-4-carboxylic acid;2-[4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazol-1-yl]acetic acid;5-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name2-[2-oxo-4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]-1-pyridinyl]acetic acid;3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenol;6-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazine-2-carboxylic acid;1-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazole-4-carboxylic acid;2-[4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazol-1-yl]acetic acid;5-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyridine-2-carboxylic acid
PubChem CID158245374
Molecular FormulaC117H94N26O18
Molecular Weight2152.20 g/mol
Exact Mass2150.72
IUPAC Name2-[2-oxo-4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]-1-pyridinyl]acetic acid;3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenol;6-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazine-2-carboxylic acid;1-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazole-4-carboxylic acid;2-[4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazol-1-yl]acetic acid;5-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyridine-2-carboxylic acid
SMILESO=C(O)Cn1cc(-c2cccc(COc3ccc(-c4ccn[nH]4)nc3)c2)cn1.O=C(O)Cn1ccc(-c2cccc(COc3ccc(-c4ccn[nH]4)nc3)c2)cc1=O.O=C(O)c1ccc(-c2cccc(COc3ccc(-c4ccn[nH]4)nc3)c2)cn1.O=C(O)c1cncc(-c2cccc(COc3ccc(-c4ccn[nH]4)nc3)c2)n1.O=C(O)c1cnn(-c2cccc(COc3ccc(-c4ccn[nH]4)nc3)c2)c1.Oc1cccc(COc2ccc(-c3ccn[nH]3)nc2)c1
InChIInChI=1S/C22H18N4O4.C21H16N4O3.C20H17N5O3.C20H15N5O3.C19H15N5O3.C15H13N3O2/c27-21-11-17(7-9-26(21)13-22(28)29)16-3-1-2-15(10-16)14-30-18-4-5-19(23-12-18)20-6-8-24-25-20;26-21(27)20-6-4-16(11-22-20)15-3-1-2-14(10-15)13-28-17-5-7-18(23-12-17)19-8-9-24-25-19;26-20(27)12-25-11-16(9-23-25)15-3-1-2-14(8-15)13-28-17-4-5-18(21-10-17)19-6-7-22-24-19;26-20(27)19-11-21-10-18(24-19)14-3-1-2-13(8-14)12-28-15-4-5-16(22-9-15)17-6-7-23-25-17;25-19(26)14-9-22-24(11-14)15-3-1-2-13(8-15)12-27-16-4-5-17(20-10-16)18-6-7-21-23-18;19-12-3-1-2-11(8-12)10-20-13-4-5-14(16-9-13)15-6-7-17-18-15/h1-12H,13-14H2,(H,24,25)(H,28,29);1-12H,13H2,(H,24,25)(H,26,27);1-11H,12-13H2,(H,22,24)(H,26,27);1-11H,12H2,(H,23,25)(H,26,27);1-11H,12H2,(H,21,23)(H,25,26);1-9,19H,10H2,(H,17,18)
InChIKeyGGBAAGVCELLQEK-UHFFFAOYSA-N
XLogP18.67
TPSA607.84 Ų
H-Bond Donors12
H-Bond Acceptors33
Rotatable Bonds36
Heavy Atoms161
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002152.20
LogP ≤ 518.67
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1033

Analyze 2-[2-oxo-4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]-1-pyridinyl]acetic acid;3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenol;6-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazine-2-carboxylic acid;1-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazole-4-carboxylic acid;2-[4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazol-1-yl]acetic acid;5-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyridine-2-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-[(dimethylamino)methyl]-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(4-hydroxypiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(pyrrolidine-1-carbonyl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-N-[6-(pyrrolidine-1-carbonyl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-(5-phenoxy-3-pyridinyl)-N-[6-(pyrrolidine-1-carbonyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 157075936
5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-(6-methyl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenoxy)-3-pyridinyl]-5-[5-[(4-hydroxypiperidin-1-yl)methyl]-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(2-fluorophenoxy)-3-pyridinyl]-5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(2-fluorophenoxy)-3-pyridinyl]-5-(5-phenoxy-3-pyridinyl)-1H-indazole-3-carboxamide
CID 157572346
N-[1-[2-(diethylamino)ethyl]-3-pyridin-2-ylpyrazol-4-yl]-6-pyridin-4-ylpyridine-2-carboxamide;formic acid;N-(1-methyl-3-pyrazin-2-ylpyrazol-4-yl)-6-[6-(2-oxopropyl)-3-pyridinyl]pyridine-2-carboxamide;N-(1-methyl-3-pyrazin-2-ylpyrazol-4-yl)-6-(2-phenylmethoxy-4-pyridinyl)pyridine-2-carboxamide;N-(1-methyl-3-pyrazin-2-ylpyrazol-4-yl)-6-pyridin-3-ylpyridine-2-carboxamide;N-(1-methyl-3-pyrazin-2-ylpyrazol-4-yl)-6-pyridin-4-ylpyridine-2-carboxamide;N-(1-methyl-3-pyrazin-2-ylpyrazol-4-yl)-6-[5-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyridine-2-carboxamide
CID 157596548
formic acid;6-(furan-2-yl)-N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]pyridine-2-carboxamide;6-(furan-3-yl)-N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]pyridine-2-carboxamide;N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]-6-(1H-pyrazol-5-yl)pyridine-2-carboxamide;bis(2,2,2-trifluoroacetic acid)
CID 157611001
5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-(2-fluorophenyl)-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-(2-fluorophenyl)-1H-indazole-3-carboxamide;5-[5-[(4-hydroxypiperidin-1-yl)methyl]-3-pyridinyl]-N-(6-methyl-3-pyridinyl)-1H-indazole-3-carboxamide;N-(6-methyl-3-pyridinyl)-5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-(6-methyl-3-pyridinyl)-5-(5-phenoxy-3-pyridinyl)-1H-indazole-3-carboxamide
CID 158170368
5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-[(dimethylamino)methyl]-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-[(dimethylamino)methyl]-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(4-hydroxypiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(pyrrolidine-1-carbonyl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-N-[6-(pyrrolidine-1-carbonyl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-(5-phenoxy-3-pyridinyl)-N-[6-(pyrrolidine-1-carbonyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 158399370
5-(5-amino-3-pyridinyl)-N-[6-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-(4-hydroxycyclohexyl)oxy-3-pyridinyl]-N-[6-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(piperidin-1-ylmethyl)-3-pyridinyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide
CID 158431910
2-[4-[6-(5,6-diethoxy-3-pyridinyl)-4-methyl-3-oxo-1H-isoindol-2-yl]pyrazol-1-yl]acetonitrile;5-(5,6-diethoxy-3-pyridinyl)-7-methyl-2-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-3H-isoindol-1-one;2-[4-[6-(5,6-dimethoxy-3-pyridinyl)-4-methyl-3-oxo-1H-isoindol-2-yl]pyrazol-1-yl]acetonitrile;5-(5,6-dimethoxy-3-pyridinyl)-7-methyl-2-[1-[(2S)-1,1,1-trifluoro-3-hydroxypropan-2-yl]pyrazol-4-yl]-3H-isoindol-1-one;5-(5,6-dimethoxy-3-pyridinyl)-7-methyl-2-[1-[(2R)-1,1,1-trifluoro-3-hydroxypropan-2-yl]pyrazol-4-yl]-3H-isoindol-1-one;2-(5,6-dimethoxy-3-pyridinyl)-6-(1H-pyrazol-4-yl)-7H-pyrrolo[3,4-b]pyridin-5-one;5-(6-ethoxy-5-methoxy-3-pyridinyl)-7-methyl-2-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-3H-isoindol-1-one
CID 158576486
5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-[(dimethylamino)methyl]-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-[(dimethylamino)methyl]-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-[(dimethylamino)methyl]-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-[(dimethylamino)methyl]-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;5-[5-[(4-hydroxypiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(pyrrolidine-1-carbonyl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-N-[6-(pyrrolidine-1-carbonyl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-(5-phenoxy-3-pyridinyl)-N-[6-(pyrrolidine-1-carbonyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 159425514
5-(5-amino-3-pyridinyl)-N-phenyl-1H-indazole-3-carboxamide;5-[5-(azetidin-1-ylmethyl)-3-pyridinyl]-N-[3-[(dimethylamino)methyl]phenyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-phenyl-1H-indazole-3-carboxamide;N-[3-[(dimethylamino)methyl]phenyl]-5-[5-[(4-hydroxypiperidin-1-yl)methyl]-3-pyridinyl]-1H-indazole-3-carboxamide;N-[3-[(dimethylamino)methyl]phenyl]-5-(5-phenoxy-3-pyridinyl)-1H-indazole-3-carboxamide
CID 159806524
N-[1-[2-(diethylamino)ethyl]-3-pyridin-2-ylpyrazol-4-yl]-6-pyridin-4-ylpyridine-2-carboxamide;formic acid;N-(1-methyl-3-pyrazin-2-ylpyrazol-4-yl)-6-(2-phenylmethoxy-4-pyridinyl)pyridine-2-carboxamide;N-(1-methyl-3-pyrazin-2-ylpyrazol-4-yl)-6-[5-(2,2,2-trifluoroethoxy)-3-pyridinyl]pyridine-2-carboxamide;6-pyridin-4-yl-N-(5-pyridin-2-yl-1H-pyrazol-4-yl)pyridine-2-carboxamide
CID 159859038
1-(3,3-difluoroazetidin-1-yl)-3-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]propan-1-one;N,N-dimethyl-2-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]cyclopropane-1-carboxamide;1-morpholin-4-yl-3-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]propan-1-one;1-piperidin-1-yl-3-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]propan-1-one;3-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]cyclohexane-1-carboxylic acid;2-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]cyclopropane-1-carboxylic acid;3-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]-1-pyrrolidin-1-ylpropan-1-one
CID 159974930

Frequently Asked Questions

What is the IUPAC name of 2-[2-oxo-4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]-1-pyridinyl]acetic acid;3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenol;6-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazine-2-carboxylic acid;1-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazole-4-carboxylic acid;2-[4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazol-1-yl]acetic acid;5-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyridine-2-carboxylic acid?
The IUPAC name of 2-[2-oxo-4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]-1-pyridinyl]acetic acid;3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenol;6-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazine-2-carboxylic acid;1-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazole-4-carboxylic acid;2-[4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazol-1-yl]acetic acid;5-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyridine-2-carboxylic acid (CID 158245374) is 2-[2-oxo-4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]-1-pyridinyl]acetic acid;3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenol;6-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazine-2-carboxylic acid;1-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazole-4-carboxylic acid;2-[4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazol-1-yl]acetic acid;5-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyridine-2-carboxylic acid.
What is the SMILES notation for 2-[2-oxo-4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]-1-pyridinyl]acetic acid;3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenol;6-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazine-2-carboxylic acid;1-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazole-4-carboxylic acid;2-[4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazol-1-yl]acetic acid;5-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyridine-2-carboxylic acid?
The canonical SMILES for 2-[2-oxo-4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]-1-pyridinyl]acetic acid;3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenol;6-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazine-2-carboxylic acid;1-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazole-4-carboxylic acid;2-[4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazol-1-yl]acetic acid;5-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyridine-2-carboxylic acid is O=C(O)Cn1cc(-c2cccc(COc3ccc(-c4ccn[nH]4)nc3)c2)cn1.O=C(O)Cn1ccc(-c2cccc(COc3ccc(-c4ccn[nH]4)nc3)c2)cc1=O.O=C(O)c1ccc(-c2cccc(COc3ccc(-c4ccn[nH]4)nc3)c2)cn1.O=C(O)c1cncc(-c2cccc(COc3ccc(-c4ccn[nH]4)nc3)c2)n1.O=C(O)c1cnn(-c2cccc(COc3ccc(-c4ccn[nH]4)nc3)c2)c1.Oc1cccc(COc2ccc(-c3ccn[nH]3)nc2)c1.
What is the InChIKey of 2-[2-oxo-4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]-1-pyridinyl]acetic acid;3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenol;6-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazine-2-carboxylic acid;1-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazole-4-carboxylic acid;2-[4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazol-1-yl]acetic acid;5-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyridine-2-carboxylic acid?
The InChIKey is GGBAAGVCELLQEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N4O4.C21H16N4O3.C20H17N5O3.C20H15N5O3.C19H15N5O3.C15H13N3O2/c27-21-11-17(7-9-26(21)13-22(28)29)16-3-1-2-15(10-16)14-30-18-4-5-19(23-12-18)20-6-8-24-25-20;26-21(27)20-6-4-16(11-22-20)15-3-1-2-14(10-15)13-28-17-5-7-18(23-12-17)19-8-9-24-25-19;26-20(27)12-25-11-16(9-23-25)15-3-1-2-14(8-15)13-28-17-4-5-18(21-10-17)19-6-7-22-24-19;26-20(27)19-11-21-10-18(24-19)14-3-1-2-13(8-14)12-28-15-4-5-16(22-9-15)17-6-7-23-25-17;25-19(26)14-9-22-24(11-14)15-3-1-2-13(8-15)12-27-16-4-5-17(20-10-16)18-6-7-21-23-18;19-12-3-1-2-11(8-12)10-20-13-4-5-14(16-9-13)15-6-7-17-18-15/h1-12H,13-14H2,(H,24,25)(H,28,29);1-12H,13H2,(H,24,25)(H,26,27);1-11H,12-13H2,(H,22,24)(H,26,27);1-11H,12H2,(H,23,25)(H,26,27);1-11H,12H2,(H,21,23)(H,25,26);1-9,19H,10H2,(H,17,18).
What are the key properties of 2-[2-oxo-4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]-1-pyridinyl]acetic acid;3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenol;6-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazine-2-carboxylic acid;1-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazole-4-carboxylic acid;2-[4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazol-1-yl]acetic acid;5-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyridine-2-carboxylic acid?
2-[2-oxo-4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]-1-pyridinyl]acetic acid;3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenol;6-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazine-2-carboxylic acid;1-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazole-4-carboxylic acid;2-[4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazol-1-yl]acetic acid;5-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyridine-2-carboxylic acid has a molecular weight of 2152.20 g/mol, XLogP of 18.67, 36 rotatable bonds, 12 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-oxo-4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]-1-pyridinyl]acetic acid;3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenol;6-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazine-2-carboxylic acid;1-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazole-4-carboxylic acid;2-[4-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyrazol-1-yl]acetic acid;5-[3-[[6-(1H-pyrazol-5-yl)-3-pyridinyl]oxymethyl]phenyl]pyridine-2-carboxylic acid is sourced from PubChem (CID 158245374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).