CCG258747 |
CCG258747 : Inhibitor of GRK2
Probe Summary
Selectivity
Potency
In Vivo
Control Compounds
Chemical Information
References
Vendors
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Probe Summary
| Targets | Biochemical/Biophysical Potency | Cellular Potency |
|---|---|---|
| GRK2 |
|
Inhibitor
up to 10 uM
Selectivity
In Vitro Selectivity Assessment
Potency Assay Off-Target:
Selectivity over GRK1, GRK5, PKA, and ROCK1 (518-, 83-, >5500-, and >550-fold, respectively) was ass ...
In Vitro Selectivity Assessment
Potency Assay Off-Target:
Kinome-wide selectivity of CCG258747 was evaluated at 1 μM in the scanELECT screen (DiscoverX) consi ...
Potency Cellular
In Vitro
GRK2
Mode of Action: Inhibitor
Structure-Activity-Relationship data available? Yes
DOI Reference: 10.1124/mol.119.118661
In Vivo Validations
Mouse
Dose: 10 mg/Kg
Route of delivery:
Intraperitoneal
Plasma half life:
7 h
Cmax:
1520 nM
Tmax:
0.5 h
Area Under the Curve::
4970 h*nM
DOI Reference: 10.1124/mol.119.118661
Chemical Information
| Molecular Formula | C28H27FN4O4 |
| SMILEs | O=C(NCc1[nH]nc2ccccc12)c1cc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)ccc1F |
| InChI | InChI=1S/C28H27FN4O4/c29-23-7-5-17(11-22(23)28(34)31-14-25-21-3-1-2-4-24(21)32-33-25)20-9-10-30-13-18(20)15-35-19-6-8-26-27(12-19)37-16-36-26/h1-8,11-12,18,20,30H,9-10,13-16H2,(H,31,34)(H,32,33)/t18-,20-/m0/s1 |
| Molecular weight | 502.20 Da |
| AlogP | 4.132800000000003 |
| HBond acceptors | 8 |
| HBond donors | 3 |
| Atoms | 64 |