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Name | CHEMBL2147477 |
---|---|
Molecular formula | C25H35FN6S |
IUPAC name | 2-[3-[(4S)-1-[(2S)-1-(benzylamino)propan-2-yl]-3-[2-(3-fluorophenyl)ethyl]-2-sulfanylideneimidazolidin-4-yl]propyl]guanidine |
Molecular weight | 470.655 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 3 |
XlogP | 2.9 |
Synonyms | 2-[3-[(4S)-3-[2-(3-fluorophenyl)ethyl]-1-[(2S)-1-(phenylmethylamino)propan-2-yl]-2-sulfanylideneimidazolidin-4-yl]propyl]guanidine SCHEMBL3956440 1055030-06-2 GTPL1315 BDBM50391543 [ Show all ] |
Inchi Key | DSJVYEAOYVHUJW-CVDCTZTESA-N |
Inchi ID | InChI=1S/C25H35FN6S/c1-19(16-29-17-21-7-3-2-4-8-21)32-18-23(11-6-13-30-24(27)28)31(25(32)33)14-12-20-9-5-10-22(26)15-20/h2-5,7-10,15,19,23,29H,6,11-14,16-18H2,1H3,(H4,27,28,30)/t19-,23-/m0/s1 |
PubChem CID | 11305934 |
ChEMBL | CHEMBL2147477 |
IUPHAR | 1315 |
BindingDB | N/A |
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 |
---|---|---|---|---|---|
67657 | Melanin-concentrating hormone receptor 1 | P97639 | Mchr1 | Rattus norvegicus (Rat) | 353 |
553595 | Melanin-concentrating hormone receptor 1 | Q99705 | MCHR1 | Homo sapiens (Human) | 422 |
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