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Name | AC1NDBVX |
---|---|
Molecular formula | C24H29ClN2O2S |
IUPAC name | 4-[[(4-chloro-3-methylphenyl)carbamothioyl-[(2-methylphenyl)methyl]amino]methyl]cyclohexane-1-carboxylic acid |
Molecular weight | 445.018 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 2 |
XlogP | 5.6 |
Synonyms | CHEMBL3980678 4-{[{[(4-chloro-3-methylphenyl)amino]carbonothioyl}(2-methylbenzyl)amino]methyl}cyclohexanecarboxylic acid SR-01000582978 BDBM211168 ZINC3036358 [ Show all ] |
Inchi Key | FZGLHZIPDFVDKB-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C24H29ClN2O2S/c1-16-5-3-4-6-20(16)15-27(14-18-7-9-19(10-8-18)23(28)29)24(30)26-21-11-12-22(25)17(2)13-21/h3-6,11-13,18-19H,7-10,14-15H2,1-2H3,(H,26,30)(H,28,29) |
PubChem CID | 4547698 |
ChEMBL | CHEMBL3980678 |
IUPHAR | N/A |
BindingDB | 211168 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
520075 | Taste receptor type 2 member 14 | Q9NYV8 | TAS2R14 | Homo sapiens (Human) | 317 |
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