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Name | 4-[((4-methoxybenzyl){[(2-methoxyphenyl)amino]carbonothioyl}amino)methyl]cyclohexanecarboxylic acid |
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Molecular formula | C24H30N2O4S |
IUPAC name | 4-[[(2-methoxyphenyl)carbamothioyl-[(4-methoxyphenyl)methyl]amino]methyl]cyclohexane-1-carboxylic acid |
Molecular weight | 442.574 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 2 |
XlogP | 4.1 |
Synonyms | CHEMBL1326627 US9247759, 5-112 MolPort-007-929-138 BDBM211166 SR-01000582766 [ Show all ] |
Inchi Key | GWTFPMQVFXBOOD-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C24H30N2O4S/c1-29-20-13-9-18(10-14-20)16-26(15-17-7-11-19(12-8-17)23(27)28)24(31)25-21-5-3-4-6-22(21)30-2/h3-6,9-10,13-14,17,19H,7-8,11-12,15-16H2,1-2H3,(H,25,31)(H,27,28) |
PubChem CID | 16189605 |
ChEMBL | CHEMBL1326627 |
IUPHAR | N/A |
BindingDB | 211166 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
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520148 | Taste receptor type 2 member 14 | Q9NYV8 | TAS2R14 | Homo sapiens (Human) | 317 |
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