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Name | CHEMBL374843 |
---|---|
Molecular formula | C28H33ClF2N4O |
IUPAC name | 3-(3-chloro-4-fluorophenyl)-1-[(3R,6S)-6-(3-cyanophenyl)-3-bicyclo[4.1.0]heptanyl]-1-[2-[2-fluoroethyl(propan-2-yl)amino]ethyl]urea |
Molecular weight | 515.046 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 6.0 |
Synonyms | 3-(3-chloro-4-fluorophenyl)-1-((3R,6S)-6-(3-cyanophenyl)bicyclo[4.1.0]heptan-3-yl)-1-(2-((2-fluoroethyl)(isopropyl)amino)ethyl)urea BDBM50215589 SCHEMBL14266155 |
Inchi Key | PSLHRUILNLJKQN-FKCQOYNMSA-N |
Inchi ID | InChI=1S/C28H33ClF2N4O/c1-19(2)34(11-10-30)12-13-35(27(36)33-23-6-7-26(31)25(29)16-23)24-8-9-28(17-22(28)15-24)21-5-3-4-20(14-21)18-32/h3-7,14,16,19,22,24H,8-13,15,17H2,1-2H3,(H,33,36)/t22?,24-,28-/m1/s1 |
PubChem CID | 44424211 |
ChEMBL | CHEMBL374843 |
IUPHAR | N/A |
BindingDB | 50215589 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
267700 | Melanin-concentrating hormone receptor 1 | Q99705 | MCHR1 | Homo sapiens (Human) | 422 |
267701 | Melanin-concentrating hormone receptor 1 | Q8JZL2 | Mchr1 | Mus musculus (Mouse) | 353 |
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