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Name | SCHEMBL18993317 |
---|---|
Molecular formula | C23H29N5O |
IUPAC name | N-cyclopentyl-1-[6-methyl-3-(5-methyl-1,2,4-oxadiazol-3-yl)quinolin-2-yl]piperidin-4-amine |
Molecular weight | 391.519 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 4.7 |
Synonyms | BDBM156646 US9682966, 414 |
Inchi Key | ACEFGCIJTZPRJV-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C23H29N5O/c1-15-7-8-21-17(13-15)14-20(22-24-16(2)29-27-22)23(26-21)28-11-9-19(10-12-28)25-18-5-3-4-6-18/h7-8,13-14,18-19,25H,3-6,9-12H2,1-2H3 |
PubChem CID | 129252293 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 156646 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
535951 | Kappa-type opioid receptor | P41145 | OPRK1 | Homo sapiens (Human) | 380 |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417