You can:
Name | CHEMBL3939830 |
---|---|
Molecular formula | C23H25F3N6S |
IUPAC name | (2S,3S)-5-[3-[(4-methyl-5-pyridazin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propyl]-2-[4-(trifluoromethyl)phenyl]-5-azaspiro[2.4]heptane |
Molecular weight | 474.55 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 0 |
XlogP | 3.3 |
Synonyms | BDBM50192234 SCHEMBL19629527 |
Inchi Key | ACKJXZGTUCARLB-UGKGYDQZSA-N |
Inchi ID | InChI=1S/C23H25F3N6S/c1-31-20(17-7-9-27-28-14-17)29-30-21(31)33-12-2-10-32-11-8-22(15-32)13-19(22)16-3-5-18(6-4-16)23(24,25)26/h3-7,9,14,19H,2,8,10-13,15H2,1H3/t19-,22-/m0/s1 |
PubChem CID | 132156264 |
ChEMBL | CHEMBL3939830 |
IUPHAR | N/A |
BindingDB | 50192234 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
You can:
GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
535958 | D(2) dopamine receptor | P14416 | DRD2 | Homo sapiens (Human) | 443 |
535959 | D(3) dopamine receptor | P35462 | DRD3 | Homo sapiens (Human) | 400 |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417