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Name | CHEMBL3290091 |
---|---|
Molecular formula | C29H29ClN4O5 |
IUPAC name | (2S)-2-[[1-(7-chloroquinolin-4-yl)-5-(2,4-dimethoxyphenyl)pyrazole-3-carbonyl]amino]-2-cyclohexylacetic acid |
Molecular weight | 549.024 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 2 |
XlogP | 6.0 |
Synonyms | BDBM50019407 SCHEMBL17114566 |
Inchi Key | HFQAFXRLXRULMH-MHZLTWQESA-N |
Inchi ID | InChI=1S/C29H29ClN4O5/c1-38-19-9-11-21(26(15-19)39-2)25-16-23(28(35)32-27(29(36)37)17-6-4-3-5-7-17)33-34(25)24-12-13-31-22-14-18(30)8-10-20(22)24/h8-17,27H,3-7H2,1-2H3,(H,32,35)(H,36,37)/t27-/m0/s1 |
PubChem CID | 90644384 |
ChEMBL | CHEMBL3290091 |
IUPHAR | N/A |
BindingDB | 50019407 |
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 |
---|---|---|---|---|---|
113661 | Neurotensin receptor type 1 | P20789 | Ntsr1 | Rattus norvegicus (Rat) | 424 |
113660 | Neurotensin receptor type 2 | Q63384 | Ntsr2 | Rattus norvegicus (Rat) | 416 |
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