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Name | CHEMBL245506 |
---|---|
Molecular formula | C23H28ClN5O2 |
IUPAC name | N-[[7-(2-chloro-4,6-dimethylphenyl)-4-methyl-2,5,7,9-tetrazatricyclo[6.4.0.02,6]dodeca-1(8),3,5,9,11-pentaen-3-yl]methyl]-1,3-dimethoxypropan-2-amine |
Molecular weight | 441.96 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 4.2 |
Synonyms | BDBM50203595 SCHEMBL5395279 [8-(2-chloro-4,6-dimethyl-phenyl)-2-methyl-8H-1,3a,7,8-tetraaza-cyclopenta[a]inden-3-ylmethyl]-(2-methoxy-1-methoxymethyl-ethyl)-amine |
Inchi Key | AKBFVFJQOIVWMW-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C23H28ClN5O2/c1-14-9-15(2)21(18(24)10-14)29-22-19(7-6-8-25-22)28-20(16(3)27-23(28)29)11-26-17(12-30-4)13-31-5/h6-10,17,26H,11-13H2,1-5H3 |
PubChem CID | 21916237 |
ChEMBL | CHEMBL245506 |
IUPHAR | N/A |
BindingDB | 50203595 |
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 |
---|---|---|---|---|---|
7398 | Corticotropin-releasing factor receptor 1 | P34998 | CRHR1 | Homo sapiens (Human) | 444 |
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