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Name | CHEMBL3290093 |
---|---|
Molecular formula | C27H23ClF2N4O3 |
IUPAC name | (2S)-2-[[1-(7-chloroquinolin-4-yl)-5-(2,6-difluorophenyl)pyrazole-3-carbonyl]amino]-2-cyclohexylacetic acid |
Molecular weight | 524.953 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 2 |
XlogP | 6.3 |
Synonyms | BDBM50019409 SCHEMBL17114547 |
Inchi Key | XJSGFYNGKBZELF-VWLOTQADSA-N |
Inchi ID | InChI=1S/C27H23ClF2N4O3/c28-16-9-10-17-20(13-16)31-12-11-22(17)34-23(24-18(29)7-4-8-19(24)30)14-21(33-34)26(35)32-25(27(36)37)15-5-2-1-3-6-15/h4,7-15,25H,1-3,5-6H2,(H,32,35)(H,36,37)/t25-/m0/s1 |
PubChem CID | 90644386 |
ChEMBL | CHEMBL3290093 |
IUPHAR | N/A |
BindingDB | 50019409 |
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 |
---|---|---|---|---|---|
393642 | Neurotensin receptor type 1 | P20789 | Ntsr1 | Rattus norvegicus (Rat) | 424 |
393641 | Neurotensin receptor type 2 | Q63384 | Ntsr2 | Rattus norvegicus (Rat) | 416 |
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