You can:
Name | CHEMBL446086 |
---|---|
Molecular formula | C36H47FN4O4 |
IUPAC name | 1-[[(E)-3-(3-fluorophenyl)prop-2-enoyl]amino]-N-[(2R)-1-[[1-(oxan-4-ylmethyl)piperidin-4-yl]methylamino]-1-oxo-3-phenylpropan-2-yl]cyclopentane-1-carboxamide |
Molecular weight | 618.794 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 3 |
XlogP | 4.8 |
Synonyms | N/A |
Inchi Key | KKZRKZNMXQNBRI-AVUDXHPJSA-N |
Inchi ID | InChI=1S/C36H47FN4O4/c37-31-10-6-9-28(23-31)11-12-33(42)40-36(17-4-5-18-36)35(44)39-32(24-27-7-2-1-3-8-27)34(43)38-25-29-13-19-41(20-14-29)26-30-15-21-45-22-16-30/h1-3,6-12,23,29-30,32H,4-5,13-22,24-26H2,(H,38,43)(H,39,44)(H,40,42)/b12-11+/t32-/m1/s1 |
PubChem CID | 44577898 |
ChEMBL | CHEMBL446086 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
You can:
GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
171711 | Substance-K receptor | Q64077 | TACR2 | Cavia porcellus (Guinea pig) | 402 |
171712 | Substance-K receptor | P21452 | TACR2 | Homo sapiens (Human) | 398 |
zhanglabzhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218