2-{[(2-Phenylpropyl)amino]carbonyl}cyclohexanecarboxylic acid
AlkaPlorer ID: AK413100
Synonym: None
IUPAC Name: 2-(2-phenylpropylcarbamoyl)cyclohexane-1-carboxylic acid
Structure
SMILES: CC(CNC(=O)C1CCCCC1C(=O)O)C1=CC=CC=C1
InChI: InChI=1S/C17H23NO3/c1-12(13-7-3-2-4-8-13)11-18-16(19)14-9-5-6-10-15(14)17(20)21/h2-4,7-8,12,14-15H,5-6,9-11H2,1H3,(H,18,19)(H,20,21)
InChIKey: INZTYXSLGLFGIE-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|
Properties Information
Molecule Weight: 289.375
TPSA？: 66.4
MolLogP？: 2.797300000000001
Number of H-Donors: 2
Number of H-Acceptors: 2
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | Chromobox protein homolog 1 | Potency | 89125.1 | nM | None |
| Homo sapiens | TAR DNA-binding protein 43 | Potency | 4466.8 | nM | None |
| Homo sapiens | Trace amine-associated receptor 1 | EC50 | 1108.0 | nM | None |
| Homo sapiens | Trace amine-associated receptor 1 | IC50 | 14367.0 | nM | None |
| Trypanosoma cruzi Dm28c | Aminopeptidase | Inhibition | -4.159 | % | 10.6019/CHEMBL5305021 |
| None | No relevant target | EC50 | 29905.0 | nM | None |
| None | No relevant target | IC50 | 29905.0 | nM | None |