(4R)-4-methyl-7-[2-[[5-methyl-2-(4-methylphenyl)imidazol-1-yl]methyl]phenoxy]heptan-2-one;2-methyl-5-[5-methyl-1-[(2-methylphenyl)methyl]imidazol-2-yl]pyridine;(3R)-3-methyl-6-[2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenoxy]hexanoic acid;2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenol;6-methyl-N-prop-2-ynylpyridine-3-carboxamide;6-methylpyridine-3-carboxylic acid

C102H114N14O9 — CID 158343239

IUPAC(4R)-4-methyl-7-[2-[[5-methyl-2-(4-methylphenyl)imidazol-1-yl]methyl]phenoxy]heptan-2-one;2-methyl-5-[5-methyl-1-[(2-methylphenyl)methyl]imidazol-2-yl]pyridine;(3R)-3-methyl-6-[2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenoxy]hexanoic acid;2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenol;6-methyl-N-prop-2-ynylpyridine-3-carboxamide;6-methylpyridine-3-carboxylic acid
SMILESC#CCNC(=O)c1ccc(C)nc1.CC(=O)C[C@H](C)CCCOc1ccccc1Cn1c(C)cnc1-c1ccc(C)cc1.Cc1ccc(-c2ncc(C)n2Cc2ccccc2C)cn1.Cc1ccc(-c2ncc(C)n2Cc2ccccc2O)cn1.Cc1ccc(-c2ncc(C)n2Cc2ccccc2OCCC[C@@H](C)CC(=O)O)cn1.Cc1ccc(C(=O)O)cn1
InChIInChI=1S/C26H32N2O2.C24H29N3O3.C18H19N3.C17H17N3O.C10H10N2O.C7H7NO2/c1-19-11-13-23(14-12-19)26-27-17-21(3)28(26)18-24-9-5-6-10-25(24)30-15-7-8-20(2)16-22(4)29;1-17(13-23(28)29)7-6-12-30-22-9-5-4-8-21(22)16-27-19(3)14-26-24(27)20-11-10-18(2)25-15-20;1-13-6-4-5-7-17(13)12-21-15(3)10-20-18(21)16-9-8-14(2)19-11-16;1-12-7-8-14(10-18-12)17-19-9-13(2)20(17)11-15-5-3-4-6-16(15)21;1-3-6-11-10(13)9-5-4-8(2)12-7-9;1-5-2-3-6(4-8-5)7(9)10/h5-6,9-14,17,20H,7-8,15-16,18H2,1-4H3;4-5,8-11,14-15,17H,6-7,12-13,16H2,1-3H3,(H,28,29);4-11H,12H2,1-3H3;3-10,21H,11H2,1-2H3;1,4-5,7H,6H2,2H3,(H,11,13);2-4H,1H3,(H,9,10)/t20-;17-;;;;/m11..../s1
InChIKeyGRKIPZQZHFXPAE-VDFXPJNJSA-N
MW1680.12 g/mol
LogP19.95
Rot. Bonds29

About (4R)-4-methyl-7-[2-[[5-methyl-2-(4-methylphenyl)imidazol-1-yl]methyl]phenoxy]heptan-2-one;2-methyl-5-[5-methyl-1-[(2-methylphenyl)methyl]imidazol-2-yl]pyridine;(3R)-3-methyl-6-[2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenoxy]hexanoic acid;2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenol;6-methyl-N-prop-2-ynylpyridine-3-carboxamide;6-methylpyridine-3-carboxylic acid

(4R)-4-methyl-7-[2-[[5-methyl-2-(4-methylphenyl)imidazol-1-yl]methyl]phenoxy]heptan-2-one;2-methyl-5-[5-methyl-1-[(2-methylphenyl)methyl]imidazol-2-yl]pyridine;(3R)-3-methyl-6-[2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenoxy]hexanoic acid;2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenol;6-methyl-N-prop-2-ynylpyridine-3-carboxamide;6-methylpyridine-3-carboxylic acid (PubChem CID 158343239) has the molecular formula C102H114N14O9 and a molecular weight of 1680.12 g/mol. Its IUPAC name is (4R)-4-methyl-7-[2-[[5-methyl-2-(4-methylphenyl)imidazol-1-yl]methyl]phenoxy]heptan-2-one;2-methyl-5-[5-methyl-1-[(2-methylphenyl)methyl]imidazol-2-yl]pyridine;(3R)-3-methyl-6-[2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenoxy]hexanoic acid;2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenol;6-methyl-N-prop-2-ynylpyridine-3-carboxamide;6-methylpyridine-3-carboxylic acid.

Molecular Properties

Compound Name(4R)-4-methyl-7-[2-[[5-methyl-2-(4-methylphenyl)imidazol-1-yl]methyl]phenoxy]heptan-2-one;2-methyl-5-[5-methyl-1-[(2-methylphenyl)methyl]imidazol-2-yl]pyridine;(3R)-3-methyl-6-[2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenoxy]hexanoic acid;2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenol;6-methyl-N-prop-2-ynylpyridine-3-carboxamide;6-methylpyridine-3-carboxylic acid
PubChem CID158343239
Molecular FormulaC102H114N14O9
Molecular Weight1680.12 g/mol
Exact Mass1678.89
IUPAC Name(4R)-4-methyl-7-[2-[[5-methyl-2-(4-methylphenyl)imidazol-1-yl]methyl]phenoxy]heptan-2-one;2-methyl-5-[5-methyl-1-[(2-methylphenyl)methyl]imidazol-2-yl]pyridine;(3R)-3-methyl-6-[2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenoxy]hexanoic acid;2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenol;6-methyl-N-prop-2-ynylpyridine-3-carboxamide;6-methylpyridine-3-carboxylic acid
SMILESC#CCNC(=O)c1ccc(C)nc1.CC(=O)C[C@H](C)CCCOc1ccccc1Cn1c(C)cnc1-c1ccc(C)cc1.Cc1ccc(-c2ncc(C)n2Cc2ccccc2C)cn1.Cc1ccc(-c2ncc(C)n2Cc2ccccc2O)cn1.Cc1ccc(-c2ncc(C)n2Cc2ccccc2OCCC[C@@H](C)CC(=O)O)cn1.Cc1ccc(C(=O)O)cn1
InChIInChI=1S/C26H32N2O2.C24H29N3O3.C18H19N3.C17H17N3O.C10H10N2O.C7H7NO2/c1-19-11-13-23(14-12-19)26-27-17-21(3)28(26)18-24-9-5-6-10-25(24)30-15-7-8-20(2)16-22(4)29;1-17(13-23(28)29)7-6-12-30-22-9-5-4-8-21(22)16-27-19(3)14-26-24(27)20-11-10-18(2)25-15-20;1-13-6-4-5-7-17(13)12-21-15(3)10-20-18(21)16-9-8-14(2)19-11-16;1-12-7-8-14(10-18-12)17-19-9-13(2)20(17)11-15-5-3-4-6-16(15)21;1-3-6-11-10(13)9-5-4-8(2)12-7-9;1-5-2-3-6(4-8-5)7(9)10/h5-6,9-14,17,20H,7-8,15-16,18H2,1-4H3;4-5,8-11,14-15,17H,6-7,12-13,16H2,1-3H3,(H,28,29);4-11H,12H2,1-3H3;3-10,21H,11H2,1-2H3;1,4-5,7H,6H2,2H3,(H,11,13);2-4H,1H3,(H,9,10)/t20-;17-;;;;/m11..../s1
InChIKeyGRKIPZQZHFXPAE-VDFXPJNJSA-N
XLogP19.95
TPSA295.19 Ų
H-Bond Donors4
H-Bond Acceptors20
Rotatable Bonds29
Heavy Atoms125
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001680.12
LogP ≤ 519.95
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze (4R)-4-methyl-7-[2-[[5-methyl-2-(4-methylphenyl)imidazol-1-yl]methyl]phenoxy]heptan-2-one;2-methyl-5-[5-methyl-1-[(2-methylphenyl)methyl]imidazol-2-yl]pyridine;(3R)-3-methyl-6-[2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenoxy]hexanoic acid;2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenol;6-methyl-N-prop-2-ynylpyridine-3-carboxamide;6-methylpyridine-3-carboxylic acid with MolForge

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Related Compounds

2-[5-[[4-[[4-(1,1-Difluoroethyl)phenyl]methyl]piperazin-1-yl]methyl]-1-methylimidazol-2-yl]pyridine-4-carboxylic acid;methane;methyl 2-[1-methyl-5-[[4-[[4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methyl]imidazol-2-yl]pyridine-4-carboxylate;2-[1-methyl-5-[[4-(3-phenoxypropyl)piperazin-1-yl]methyl]imidazol-2-yl]pyridine-4-carboxylic acid
CID 157534015
5-[(6-amino-3-pyridinyl)methyl]-3-but-2-ynyl-2-piperazin-1-ylimidazo[4,5-d]pyridazin-4-one;4-[(3-but-2-ynyl-4-oxo-2-piperazin-1-ylimidazo[4,5-d]pyridazin-5-yl)methyl]-3-cyano-5-ethoxy-N-methylbenzamide;4-[(3-but-2-ynyl-4-oxo-2-piperazin-1-ylimidazo[4,5-d]pyridazin-5-yl)methyl]-3,5-dicyano-N-methylbenzamide;methane;methyl 6-[(3-but-2-ynyl-4-oxo-2-piperazin-1-ylimidazo[4,5-d]pyridazin-5-yl)methyl]pyridine-3-carboxylate;tetrakis(2,2,2-trifluoroacetic acid)
CID 158962804
methane;2-methyl-5-[5-methyl-1-[(2-methylphenyl)methyl]imidazol-2-yl]pyridine;(4R)-4-methyl-7-[2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenoxy]heptan-2-one;(3R)-3-methyl-6-[2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenoxy]hexanoic acid;2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenol;N-prop-2-ynyl-6-(trifluoromethyl)pyridine-3-carboxamide;6-(trifluoromethyl)pyridine-3-carboxylic acid
CID 159752899
tert-butyl 4-[[[(7S)-7-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carbonyl]amino]methyl]piperidine-1-carboxylate;(7S)-N-[[2-[2-(dimethylamino)ethoxy]phenyl]methyl]-7-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide;(7S)-N-(3-imidazol-1-ylpropyl)-7-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide;(7S)-N-[2-(4-methylpiperazin-1-yl)ethyl]-7-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide;(7S)-N-[(1-methylpiperidin-4-yl)methyl]-7-propan-2-yl-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide;(7S)-7-propan-2-yl-N-(2-pyridin-2-ylethyl)-6-[[4-(trifluoromethyl)phenyl]methyl]-5,7-dihydropyrrolo[3,4-b]pyridine-3-carboxamide
CID 160333157
5-methyl-1-[(2-methylphenyl)methyl]-2-[4-(trifluoromethoxy)phenyl]imidazole;(4R)-4-methyl-7-[2-[[5-methyl-2-[4-(trifluoromethoxy)phenyl]imidazol-1-yl]methyl]phenoxy]heptan-2-one;(3R)-3-methyl-6-[2-[[5-methyl-2-[4-(trifluoromethoxy)phenyl]imidazol-1-yl]methyl]phenoxy]hexanoic acid;2-[[5-methyl-2-[4-(trifluoromethoxy)phenyl]imidazol-1-yl]methyl]phenol;N-prop-2-ynyl-4-(trifluoromethoxy)benzamide;4-(trifluoromethoxy)benzoic acid
CID 161026395
8-[4-(aminomethyl)-6-(trifluoromethyl)-3-pyridinyl]-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-N-prop-2-ynylimidazo[1,5-c]pyrimidine-1-carboxamide;8-[4-ethyl-6-(trifluoromethyl)-3-pyridinyl]-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]imidazo[1,5-c]pyrimidine-1-carboxylic acid;8-[4-ethyl-6-(trifluoromethyl)-3-pyridinyl]-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-N-prop-2-ynylimidazo[1,5-c]pyrimidine-1-carboxamide;prop-2-yn-1-amine
CID 165050039
N-[(1R)-2-oxo-1-phenyl-2-[(2S)-2-[5-[13-[2-[(2S)-1-[(2R)-2-phenyl-2-(pyridine-3-carbonylamino)acetyl]pyrrolidin-2-yl]-1H-imidazol-5-yl]-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4(16),5,7,11(15),12-hexaen-6-yl]-1H-imidazol-2-yl]pyrrolidin-1-yl]ethyl]pyridine-3-carboxamide
CID 88360200
N-[2-oxo-1-phenyl-2-[2-[5-[13-[2-[1-[2-phenyl-2-(pyridine-3-carbonylamino)acetyl]pyrrolidin-2-yl]-1H-imidazol-5-yl]-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4(16),5,7,11(15),12-hexaen-6-yl]-1H-imidazol-2-yl]pyrrolidin-1-yl]ethyl]pyridine-3-carboxamide
CID 123928586
ethyl 4-[2-methyl-6-(piperidine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]benzoate;[3-(3-hydroxyphenyl)-2-methylimidazo[1,2-a]pyridin-6-yl]-piperidin-1-ylmethanone;[3-(4-methoxyphenyl)-2-methylimidazo[1,2-a]pyridin-6-yl]-piperidin-1-ylmethanone;[2-methyl-3-(3-methylphenyl)imidazo[1,2-a]pyridin-6-yl]-piperidin-1-ylmethanone;[2-methyl-3-(4-methylphenyl)imidazo[1,2-a]pyridin-6-yl]-piperidin-1-ylmethanone;N-[3-[2-methyl-6-(piperidine-1-carbonyl)imidazo[1,2-a]pyridin-3-yl]phenyl]acetamide;[2-methyl-3-(3-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]-piperidin-1-ylmethanone
CID 157368765
2-[1-[4-[(4-Benzyl-1,4-diazepan-1-yl)methyl]phenyl]benzimidazol-2-yl]pyridine-4-carboxylic acid;2-[1-[(1-benzylpiperidin-4-yl)methyl]benzimidazol-2-yl]pyridine-4-carboxylic acid;methyl 2-[1-[(2-methoxy-4-methylphenyl)methyl]benzimidazol-2-yl]pyridine-4-carboxylate;2-[1-[(4-phenoxyphenyl)methyl]benzimidazol-2-yl]pyridine-4-carboxylic acid;2-[1-[4-[[(4-phenylphenyl)methylamino]methyl]phenyl]benzimidazol-2-yl]pyridine-4-carboxylic acid
CID 157567458
4-methylbenzoic acid;(4S)-4-methyl-7-[2-[[5-methyl-2-(4-methylphenyl)imidazol-1-yl]methyl]phenoxy]heptan-2-one;(3S)-3-methyl-6-[2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenoxy]hexanoic acid;2-[[5-methyl-2-(4-methylphenyl)imidazol-1-yl]methyl]phenol;5-methyl-2-(4-methylphenyl)-1-[(2-methylphenyl)methyl]imidazole;4-methyl-N-prop-2-ynylbenzamide;sulfane
CID 157699561
1-(2,3-dihydro-1H-inden-5-yl)-N-[(2,4-dimethylimidazo[1,5-a]pyrimidin-8-yl)methyl]methanamine;N-(2,3-dihydro-1H-inden-5-ylmethyl)-2,4,6-trimethylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[[4-(furan-2-yl)cyclohexyl]methyl]-2,4,6-trimethylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[[4-(furan-2-yl)phenyl]methyl]-2,4,6-trimethylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[[5-(furan-2-yl)-2-pyridinyl]methyl]-2,4,6-trimethylimidazo[1,5-a]pyrimidine-8-carboxamide;N-[[4-(3-methoxyprop-1-ynyl)phenyl]methyl]-2,4,6-trimethylimidazo[1,5-a]pyrimidine-8-carboxamide;2,4,6-trimethyl-N-[(4-pentoxyphenyl)methyl]imidazo[1,5-a]pyrimidine-8-carboxamide
CID 157850296

Frequently Asked Questions

What is the IUPAC name of (4R)-4-methyl-7-[2-[[5-methyl-2-(4-methylphenyl)imidazol-1-yl]methyl]phenoxy]heptan-2-one;2-methyl-5-[5-methyl-1-[(2-methylphenyl)methyl]imidazol-2-yl]pyridine;(3R)-3-methyl-6-[2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenoxy]hexanoic acid;2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenol;6-methyl-N-prop-2-ynylpyridine-3-carboxamide;6-methylpyridine-3-carboxylic acid?
The IUPAC name of (4R)-4-methyl-7-[2-[[5-methyl-2-(4-methylphenyl)imidazol-1-yl]methyl]phenoxy]heptan-2-one;2-methyl-5-[5-methyl-1-[(2-methylphenyl)methyl]imidazol-2-yl]pyridine;(3R)-3-methyl-6-[2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenoxy]hexanoic acid;2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenol;6-methyl-N-prop-2-ynylpyridine-3-carboxamide;6-methylpyridine-3-carboxylic acid (CID 158343239) is (4R)-4-methyl-7-[2-[[5-methyl-2-(4-methylphenyl)imidazol-1-yl]methyl]phenoxy]heptan-2-one;2-methyl-5-[5-methyl-1-[(2-methylphenyl)methyl]imidazol-2-yl]pyridine;(3R)-3-methyl-6-[2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenoxy]hexanoic acid;2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenol;6-methyl-N-prop-2-ynylpyridine-3-carboxamide;6-methylpyridine-3-carboxylic acid.
What is the SMILES notation for (4R)-4-methyl-7-[2-[[5-methyl-2-(4-methylphenyl)imidazol-1-yl]methyl]phenoxy]heptan-2-one;2-methyl-5-[5-methyl-1-[(2-methylphenyl)methyl]imidazol-2-yl]pyridine;(3R)-3-methyl-6-[2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenoxy]hexanoic acid;2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenol;6-methyl-N-prop-2-ynylpyridine-3-carboxamide;6-methylpyridine-3-carboxylic acid?
The canonical SMILES for (4R)-4-methyl-7-[2-[[5-methyl-2-(4-methylphenyl)imidazol-1-yl]methyl]phenoxy]heptan-2-one;2-methyl-5-[5-methyl-1-[(2-methylphenyl)methyl]imidazol-2-yl]pyridine;(3R)-3-methyl-6-[2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenoxy]hexanoic acid;2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenol;6-methyl-N-prop-2-ynylpyridine-3-carboxamide;6-methylpyridine-3-carboxylic acid is C#CCNC(=O)c1ccc(C)nc1.CC(=O)C[C@H](C)CCCOc1ccccc1Cn1c(C)cnc1-c1ccc(C)cc1.Cc1ccc(-c2ncc(C)n2Cc2ccccc2C)cn1.Cc1ccc(-c2ncc(C)n2Cc2ccccc2O)cn1.Cc1ccc(-c2ncc(C)n2Cc2ccccc2OCCC[C@@H](C)CC(=O)O)cn1.Cc1ccc(C(=O)O)cn1.
What is the InChIKey of (4R)-4-methyl-7-[2-[[5-methyl-2-(4-methylphenyl)imidazol-1-yl]methyl]phenoxy]heptan-2-one;2-methyl-5-[5-methyl-1-[(2-methylphenyl)methyl]imidazol-2-yl]pyridine;(3R)-3-methyl-6-[2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenoxy]hexanoic acid;2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenol;6-methyl-N-prop-2-ynylpyridine-3-carboxamide;6-methylpyridine-3-carboxylic acid?
The InChIKey is GRKIPZQZHFXPAE-VDFXPJNJSA-N. The full InChI is InChI=1S/C26H32N2O2.C24H29N3O3.C18H19N3.C17H17N3O.C10H10N2O.C7H7NO2/c1-19-11-13-23(14-12-19)26-27-17-21(3)28(26)18-24-9-5-6-10-25(24)30-15-7-8-20(2)16-22(4)29;1-17(13-23(28)29)7-6-12-30-22-9-5-4-8-21(22)16-27-19(3)14-26-24(27)20-11-10-18(2)25-15-20;1-13-6-4-5-7-17(13)12-21-15(3)10-20-18(21)16-9-8-14(2)19-11-16;1-12-7-8-14(10-18-12)17-19-9-13(2)20(17)11-15-5-3-4-6-16(15)21;1-3-6-11-10(13)9-5-4-8(2)12-7-9;1-5-2-3-6(4-8-5)7(9)10/h5-6,9-14,17,20H,7-8,15-16,18H2,1-4H3;4-5,8-11,14-15,17H,6-7,12-13,16H2,1-3H3,(H,28,29);4-11H,12H2,1-3H3;3-10,21H,11H2,1-2H3;1,4-5,7H,6H2,2H3,(H,11,13);2-4H,1H3,(H,9,10)/t20-;17-;;;;/m11..../s1.
What are the key properties of (4R)-4-methyl-7-[2-[[5-methyl-2-(4-methylphenyl)imidazol-1-yl]methyl]phenoxy]heptan-2-one;2-methyl-5-[5-methyl-1-[(2-methylphenyl)methyl]imidazol-2-yl]pyridine;(3R)-3-methyl-6-[2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenoxy]hexanoic acid;2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenol;6-methyl-N-prop-2-ynylpyridine-3-carboxamide;6-methylpyridine-3-carboxylic acid?
(4R)-4-methyl-7-[2-[[5-methyl-2-(4-methylphenyl)imidazol-1-yl]methyl]phenoxy]heptan-2-one;2-methyl-5-[5-methyl-1-[(2-methylphenyl)methyl]imidazol-2-yl]pyridine;(3R)-3-methyl-6-[2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenoxy]hexanoic acid;2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenol;6-methyl-N-prop-2-ynylpyridine-3-carboxamide;6-methylpyridine-3-carboxylic acid has a molecular weight of 1680.12 g/mol, XLogP of 19.95, 29 rotatable bonds, 4 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-methyl-7-[2-[[5-methyl-2-(4-methylphenyl)imidazol-1-yl]methyl]phenoxy]heptan-2-one;2-methyl-5-[5-methyl-1-[(2-methylphenyl)methyl]imidazol-2-yl]pyridine;(3R)-3-methyl-6-[2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenoxy]hexanoic acid;2-[[5-methyl-2-(6-methyl-3-pyridinyl)imidazol-1-yl]methyl]phenol;6-methyl-N-prop-2-ynylpyridine-3-carboxamide;6-methylpyridine-3-carboxylic acid is sourced from PubChem (CID 158343239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).