3-[[4-[2-(4-tert-butylcyclohexyl)-3-[[6-(2-methylpropyl)-3-pyridinyl]amino]-3-oxopropyl]benzoyl]amino]propanoic acid;3-[[4-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[(6-phenyl-3-pyridinyl)amino]propyl]benzoyl]amino]propanoic acid;3-[[5-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-2-carbonyl]amino]propanoic acid;3-[[6-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-3-carbonyl]amino]propanoic acid

C124H158F6N12O18 — CID 159797781

IUPAC3-[[4-[2-(4-tert-butylcyclohexyl)-3-[[6-(2-methylpropyl)-3-pyridinyl]amino]-3-oxopropyl]benzoyl]amino]propanoic acid;3-[[4-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[(6-phenyl-3-pyridinyl)amino]propyl]benzoyl]amino]propanoic acid;3-[[5-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-2-carbonyl]amino]propanoic acid;3-[[6-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-3-carbonyl]amino]propanoic acid
SMILESCC(C)(C)C1CCC(C(Cc2ccc(C(=O)NCCC(=O)O)cc2)C(=O)Nc2ccc(-c3ccccc3)nc2)CC1.CC(C)(C)C1CCC(C(Cc2ccc(C(=O)NCCC(=O)O)cn2)C(=O)Nc2ccc(OC(F)(F)F)cc2)CC1.CC(C)(C)C1CCC(C(Cc2ccc(C(=O)NCCC(=O)O)nc2)C(=O)Nc2ccc(OC(F)(F)F)cc2)CC1.CC(C)Cc1ccc(NC(=O)C(Cc2ccc(C(=O)NCCC(=O)O)cc2)C2CCC(C(C)(C)C)CC2)cn1
InChIInChI=1S/C34H41N3O4.C32H45N3O4.2C29H36F3N3O5/c1-34(2,3)27-15-13-24(14-16-27)29(21-23-9-11-26(12-10-23)32(40)35-20-19-31(38)39)33(41)37-28-17-18-30(36-22-28)25-7-5-4-6-8-25;1-21(2)18-26-14-15-27(20-34-26)35-31(39)28(23-10-12-25(13-11-23)32(3,4)5)19-22-6-8-24(9-7-22)30(38)33-17-16-29(36)37;1-28(2,3)20-7-5-19(6-8-20)23(26(38)35-21-9-11-22(12-10-21)40-29(30,31)32)16-18-4-13-24(34-17-18)27(39)33-15-14-25(36)37;1-28(2,3)20-7-4-18(5-8-20)24(27(39)35-21-10-12-23(13-11-21)40-29(30,31)32)16-22-9-6-19(17-34-22)26(38)33-15-14-25(36)37/h4-12,17-18,22,24,27,29H,13-16,19-21H2,1-3H3,(H,35,40)(H,37,41)(H,38,39);6-9,14-15,20-21,23,25,28H,10-13,16-19H2,1-5H3,(H,33,38)(H,35,39)(H,36,37);4,9-13,17,19-20,23H,5-8,14-16H2,1-3H3,(H,33,39)(H,35,38)(H,36,37);6,9-13,17-18,20,24H,4-5,7-8,14-16H2,1-3H3,(H,33,38)(H,35,39)(H,36,37)
InChIKeyNJJUXAZRFYOQOE-UHFFFAOYSA-N
MW2218.68 g/mol
LogP24.41
Rot. Bonds41

About 3-[[4-[2-(4-tert-butylcyclohexyl)-3-[[6-(2-methylpropyl)-3-pyridinyl]amino]-3-oxopropyl]benzoyl]amino]propanoic acid;3-[[4-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[(6-phenyl-3-pyridinyl)amino]propyl]benzoyl]amino]propanoic acid;3-[[5-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-2-carbonyl]amino]propanoic acid;3-[[6-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-3-carbonyl]amino]propanoic acid

3-[[4-[2-(4-tert-butylcyclohexyl)-3-[[6-(2-methylpropyl)-3-pyridinyl]amino]-3-oxopropyl]benzoyl]amino]propanoic acid;3-[[4-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[(6-phenyl-3-pyridinyl)amino]propyl]benzoyl]amino]propanoic acid;3-[[5-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-2-carbonyl]amino]propanoic acid;3-[[6-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-3-carbonyl]amino]propanoic acid (PubChem CID 159797781) has the molecular formula C124H158F6N12O18 and a molecular weight of 2218.68 g/mol. Its IUPAC name is 3-[[4-[2-(4-tert-butylcyclohexyl)-3-[[6-(2-methylpropyl)-3-pyridinyl]amino]-3-oxopropyl]benzoyl]amino]propanoic acid;3-[[4-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[(6-phenyl-3-pyridinyl)amino]propyl]benzoyl]amino]propanoic acid;3-[[5-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-2-carbonyl]amino]propanoic acid;3-[[6-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-3-carbonyl]amino]propanoic acid.

Molecular Properties

Compound Name3-[[4-[2-(4-tert-butylcyclohexyl)-3-[[6-(2-methylpropyl)-3-pyridinyl]amino]-3-oxopropyl]benzoyl]amino]propanoic acid;3-[[4-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[(6-phenyl-3-pyridinyl)amino]propyl]benzoyl]amino]propanoic acid;3-[[5-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-2-carbonyl]amino]propanoic acid;3-[[6-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-3-carbonyl]amino]propanoic acid
PubChem CID159797781
Molecular FormulaC124H158F6N12O18
Molecular Weight2218.68 g/mol
Exact Mass2217.17
IUPAC Name3-[[4-[2-(4-tert-butylcyclohexyl)-3-[[6-(2-methylpropyl)-3-pyridinyl]amino]-3-oxopropyl]benzoyl]amino]propanoic acid;3-[[4-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[(6-phenyl-3-pyridinyl)amino]propyl]benzoyl]amino]propanoic acid;3-[[5-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-2-carbonyl]amino]propanoic acid;3-[[6-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-3-carbonyl]amino]propanoic acid
SMILESCC(C)(C)C1CCC(C(Cc2ccc(C(=O)NCCC(=O)O)cc2)C(=O)Nc2ccc(-c3ccccc3)nc2)CC1.CC(C)(C)C1CCC(C(Cc2ccc(C(=O)NCCC(=O)O)cn2)C(=O)Nc2ccc(OC(F)(F)F)cc2)CC1.CC(C)(C)C1CCC(C(Cc2ccc(C(=O)NCCC(=O)O)nc2)C(=O)Nc2ccc(OC(F)(F)F)cc2)CC1.CC(C)Cc1ccc(NC(=O)C(Cc2ccc(C(=O)NCCC(=O)O)cc2)C2CCC(C(C)(C)C)CC2)cn1
InChIInChI=1S/C34H41N3O4.C32H45N3O4.2C29H36F3N3O5/c1-34(2,3)27-15-13-24(14-16-27)29(21-23-9-11-26(12-10-23)32(40)35-20-19-31(38)39)33(41)37-28-17-18-30(36-22-28)25-7-5-4-6-8-25;1-21(2)18-26-14-15-27(20-34-26)35-31(39)28(23-10-12-25(13-11-23)32(3,4)5)19-22-6-8-24(9-7-22)30(38)33-17-16-29(36)37;1-28(2,3)20-7-5-19(6-8-20)23(26(38)35-21-9-11-22(12-10-21)40-29(30,31)32)16-18-4-13-24(34-17-18)27(39)33-15-14-25(36)37;1-28(2,3)20-7-4-18(5-8-20)24(27(39)35-21-10-12-23(13-11-21)40-29(30,31)32)16-22-9-6-19(17-34-22)26(38)33-15-14-25(36)37/h4-12,17-18,22,24,27,29H,13-16,19-21H2,1-3H3,(H,35,40)(H,37,41)(H,38,39);6-9,14-15,20-21,23,25,28H,10-13,16-19H2,1-5H3,(H,33,38)(H,35,39)(H,36,37);4,9-13,17,19-20,23H,5-8,14-16H2,1-3H3,(H,33,39)(H,35,38)(H,36,37);6,9-13,17-18,20,24H,4-5,7-8,14-16H2,1-3H3,(H,33,38)(H,35,39)(H,36,37)
InChIKeyNJJUXAZRFYOQOE-UHFFFAOYSA-N
XLogP24.41
TPSA452.02 Ų
H-Bond Donors12
H-Bond Acceptors18
Rotatable Bonds41
Heavy Atoms160
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002218.68
LogP ≤ 524.41
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1018

Analyze 3-[[4-[2-(4-tert-butylcyclohexyl)-3-[[6-(2-methylpropyl)-3-pyridinyl]amino]-3-oxopropyl]benzoyl]amino]propanoic acid;3-[[4-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[(6-phenyl-3-pyridinyl)amino]propyl]benzoyl]amino]propanoic acid;3-[[5-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-2-carbonyl]amino]propanoic acid;3-[[6-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-3-carbonyl]amino]propanoic acid with MolForge

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Related Compounds

N-((trans)-3-fluoro-1-(4-(trifluoromethoxy)benzyl)piperidin-4-yl)-5-(4-(4-(methylsulfonyl)benzoyl)piperidine-1-carbonyl)picolinamide
CID 146676206
3-[[5-[2-(4-Tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-2-carbonyl]amino]propanoic acid
CID 20742447
3-[[6-[2-(4-Tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-3-carbonyl]amino]propanoic acid
CID 20742448
3-[[6-[(4-Tert-butylcyclohexyl)-[[4-(trifluoromethoxy)phenyl]carbamoylamino]methyl]pyridine-3-carbonyl]amino]propanoic acid
CID 22501916
6-[4-(4-acetylbenzoyl)piperidine-1-carbonyl]-N-[6-(4-fluorophenoxy)-3-pyridinyl]pyridine-3-carboxamide
CID 89843258
3-[[6-[[(4-Tert-butylcyclohexyl)-[[4-(trifluoromethoxy)phenyl]carbamoyl]amino]methyl]pyridine-3-carbonyl]amino]propanoic acid;ethyl 3-[[6-[[(4-tert-butylcyclohexyl)amino]methyl]pyridine-3-carbonyl]amino]propanoate;isocyanatoethane
CID 91605404
5-[4-[(4-fluorophenyl)methyl]piperazine-1-carbonyl]-N-[4-[2-[[4-[[8-[5-[4-[(4-fluorophenyl)methyl]piperazine-1-carbonyl]pyridine-2-carbonyl]-2,8-diazaspiro[4.5]decan-2-yl]methyl]phenyl]methyl]phenoxy]phenyl]pyridine-2-carboxamide
CID 144323737
5-[4-(4-ethylbenzoyl)piperidine-1-carbonyl]-N-[6-(4-fluorophenoxy)-3-pyridinyl]pyridine-2-carboxamide
CID 144819129
2-Methyl-6-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine;4-methyl-2-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine;5-methyl-2-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine;2-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine-4-carboxamide;6-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine-2-carboxamide;6-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine-3-carboxamide;2-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine-4-carboxylic acid;6-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine-2-carboxylic acid;6-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine-3-carboxylic acid
CID 157159584
CID 157583718
CID 157583718
2-Methoxy-6-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine;2-methyl-4-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine;3-methyl-2-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine;methyl 2-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine-4-carboxylate;methyl 6-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine-2-carboxylate;methyl 6-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine-3-carboxylate;2-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine-3-carboxamide;4-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine-2-carboxamide;2-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine-3-carboxylic acid;4-[3-[2-(trifluoromethoxy)phenyl]phenyl]pyridine-2-carboxylic acid
CID 157798340
(2R)-2-(5,5-dimethyl-2-oxopiperidin-1-yl)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methylpentanamide;3-[5-(2,6-dimethylphenyl)-6-methyl-3-pyridinyl]-3-[[2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetyl]amino]propanoic acid;(2S)-N-[(1R)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-(4-methyl-2-oxo-1-pyridinyl)pentanamide;(2R)-N-[(1S)-1-[5-(2-methoxy-6-methylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-(4-methyl-2-oxo-1-pyridinyl)pentanamide
CID 158710621

Frequently Asked Questions

What is the IUPAC name of 3-[[4-[2-(4-tert-butylcyclohexyl)-3-[[6-(2-methylpropyl)-3-pyridinyl]amino]-3-oxopropyl]benzoyl]amino]propanoic acid;3-[[4-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[(6-phenyl-3-pyridinyl)amino]propyl]benzoyl]amino]propanoic acid;3-[[5-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-2-carbonyl]amino]propanoic acid;3-[[6-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-3-carbonyl]amino]propanoic acid?
The IUPAC name of 3-[[4-[2-(4-tert-butylcyclohexyl)-3-[[6-(2-methylpropyl)-3-pyridinyl]amino]-3-oxopropyl]benzoyl]amino]propanoic acid;3-[[4-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[(6-phenyl-3-pyridinyl)amino]propyl]benzoyl]amino]propanoic acid;3-[[5-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-2-carbonyl]amino]propanoic acid;3-[[6-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-3-carbonyl]amino]propanoic acid (CID 159797781) is 3-[[4-[2-(4-tert-butylcyclohexyl)-3-[[6-(2-methylpropyl)-3-pyridinyl]amino]-3-oxopropyl]benzoyl]amino]propanoic acid;3-[[4-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[(6-phenyl-3-pyridinyl)amino]propyl]benzoyl]amino]propanoic acid;3-[[5-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-2-carbonyl]amino]propanoic acid;3-[[6-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-3-carbonyl]amino]propanoic acid.
What is the SMILES notation for 3-[[4-[2-(4-tert-butylcyclohexyl)-3-[[6-(2-methylpropyl)-3-pyridinyl]amino]-3-oxopropyl]benzoyl]amino]propanoic acid;3-[[4-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[(6-phenyl-3-pyridinyl)amino]propyl]benzoyl]amino]propanoic acid;3-[[5-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-2-carbonyl]amino]propanoic acid;3-[[6-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-3-carbonyl]amino]propanoic acid?
The canonical SMILES for 3-[[4-[2-(4-tert-butylcyclohexyl)-3-[[6-(2-methylpropyl)-3-pyridinyl]amino]-3-oxopropyl]benzoyl]amino]propanoic acid;3-[[4-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[(6-phenyl-3-pyridinyl)amino]propyl]benzoyl]amino]propanoic acid;3-[[5-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-2-carbonyl]amino]propanoic acid;3-[[6-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-3-carbonyl]amino]propanoic acid is CC(C)(C)C1CCC(C(Cc2ccc(C(=O)NCCC(=O)O)cc2)C(=O)Nc2ccc(-c3ccccc3)nc2)CC1.CC(C)(C)C1CCC(C(Cc2ccc(C(=O)NCCC(=O)O)cn2)C(=O)Nc2ccc(OC(F)(F)F)cc2)CC1.CC(C)(C)C1CCC(C(Cc2ccc(C(=O)NCCC(=O)O)nc2)C(=O)Nc2ccc(OC(F)(F)F)cc2)CC1.CC(C)Cc1ccc(NC(=O)C(Cc2ccc(C(=O)NCCC(=O)O)cc2)C2CCC(C(C)(C)C)CC2)cn1.
What is the InChIKey of 3-[[4-[2-(4-tert-butylcyclohexyl)-3-[[6-(2-methylpropyl)-3-pyridinyl]amino]-3-oxopropyl]benzoyl]amino]propanoic acid;3-[[4-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[(6-phenyl-3-pyridinyl)amino]propyl]benzoyl]amino]propanoic acid;3-[[5-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-2-carbonyl]amino]propanoic acid;3-[[6-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-3-carbonyl]amino]propanoic acid?
The InChIKey is NJJUXAZRFYOQOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H41N3O4.C32H45N3O4.2C29H36F3N3O5/c1-34(2,3)27-15-13-24(14-16-27)29(21-23-9-11-26(12-10-23)32(40)35-20-19-31(38)39)33(41)37-28-17-18-30(36-22-28)25-7-5-4-6-8-25;1-21(2)18-26-14-15-27(20-34-26)35-31(39)28(23-10-12-25(13-11-23)32(3,4)5)19-22-6-8-24(9-7-22)30(38)33-17-16-29(36)37;1-28(2,3)20-7-5-19(6-8-20)23(26(38)35-21-9-11-22(12-10-21)40-29(30,31)32)16-18-4-13-24(34-17-18)27(39)33-15-14-25(36)37;1-28(2,3)20-7-4-18(5-8-20)24(27(39)35-21-10-12-23(13-11-21)40-29(30,31)32)16-22-9-6-19(17-34-22)26(38)33-15-14-25(36)37/h4-12,17-18,22,24,27,29H,13-16,19-21H2,1-3H3,(H,35,40)(H,37,41)(H,38,39);6-9,14-15,20-21,23,25,28H,10-13,16-19H2,1-5H3,(H,33,38)(H,35,39)(H,36,37);4,9-13,17,19-20,23H,5-8,14-16H2,1-3H3,(H,33,39)(H,35,38)(H,36,37);6,9-13,17-18,20,24H,4-5,7-8,14-16H2,1-3H3,(H,33,38)(H,35,39)(H,36,37).
What are the key properties of 3-[[4-[2-(4-tert-butylcyclohexyl)-3-[[6-(2-methylpropyl)-3-pyridinyl]amino]-3-oxopropyl]benzoyl]amino]propanoic acid;3-[[4-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[(6-phenyl-3-pyridinyl)amino]propyl]benzoyl]amino]propanoic acid;3-[[5-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-2-carbonyl]amino]propanoic acid;3-[[6-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-3-carbonyl]amino]propanoic acid?
3-[[4-[2-(4-tert-butylcyclohexyl)-3-[[6-(2-methylpropyl)-3-pyridinyl]amino]-3-oxopropyl]benzoyl]amino]propanoic acid;3-[[4-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[(6-phenyl-3-pyridinyl)amino]propyl]benzoyl]amino]propanoic acid;3-[[5-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-2-carbonyl]amino]propanoic acid;3-[[6-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-3-carbonyl]amino]propanoic acid has a molecular weight of 2218.68 g/mol, XLogP of 24.41, 41 rotatable bonds, 12 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[4-[2-(4-tert-butylcyclohexyl)-3-[[6-(2-methylpropyl)-3-pyridinyl]amino]-3-oxopropyl]benzoyl]amino]propanoic acid;3-[[4-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[(6-phenyl-3-pyridinyl)amino]propyl]benzoyl]amino]propanoic acid;3-[[5-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-2-carbonyl]amino]propanoic acid;3-[[6-[2-(4-tert-butylcyclohexyl)-3-oxo-3-[4-(trifluoromethoxy)anilino]propyl]pyridine-3-carbonyl]amino]propanoic acid is sourced from PubChem (CID 159797781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).