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Name | CHEMBL429099 |
---|---|
Molecular formula | C31H34N6O |
IUPAC name | 3-benzyl-5-cyclohexyl-1-[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]-8-methyl-1,3,4-benzotriazepin-2-one |
Molecular weight | 506.654 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 2 |
XlogP | 5.3 |
Synonyms | BDBM50002927 |
Inchi Key | AEMYRYZUVIOIJG-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C31H34N6O/c1-22-12-17-27-28(20-22)37(26-15-13-25(14-16-26)34-30-32-18-19-33-30)31(38)36(21-23-8-4-2-5-9-23)35-29(27)24-10-6-3-7-11-24/h2,4-5,8-9,12-17,20,24H,3,6-7,10-11,18-19,21H2,1H3,(H2,32,33,34) |
PubChem CID | 23626402 |
ChEMBL | CHEMBL429099 |
IUPHAR | N/A |
BindingDB | 50002927 |
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 |
---|---|---|---|---|---|
3649 | Parathyroid hormone/parathyroid hormone-related peptide receptor | Q03431 | PTH1R | Homo sapiens (Human) | 593 |
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