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Name | CHEMBL499689 |
---|---|
Molecular formula | C37H52N4O5 |
IUPAC name | N-[1-[[(2R)-1-[[1-(oxan-4-ylmethyl)piperidin-4-yl]methylamino]-1-oxo-3-phenylpropan-2-yl]carbamoyl]cyclopentyl]-4-propoxybenzamide |
Molecular weight | 632.846 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 3 |
XlogP | 5.2 |
Synonyms | N/A |
Inchi Key | AIFJDFHLBQHZDX-MGBGTMOVSA-N |
Inchi ID | InChI=1S/C37H52N4O5/c1-2-22-46-32-12-10-31(11-13-32)34(42)40-37(18-6-7-19-37)36(44)39-33(25-28-8-4-3-5-9-28)35(43)38-26-29-14-20-41(21-15-29)27-30-16-23-45-24-17-30/h3-5,8-13,29-30,33H,2,6-7,14-27H2,1H3,(H,38,43)(H,39,44)(H,40,42)/t33-/m1/s1 |
PubChem CID | 44577889 |
ChEMBL | CHEMBL499689 |
IUPHAR | N/A |
BindingDB | N/A |
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 |
---|---|---|---|---|---|
6165 | Substance-K receptor | P21452 | TACR2 | Homo sapiens (Human) | 398 |
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