Compound 23
Identifiers
- Canonical SMILES:
COc1cccc(n1)-c1nc(C(O)=O)c(-c2ccc(F)c(Cl)c2)n1-c1cc(Cl)ccc1C
- InChi:
InChI=1S/C23H16Cl2FN3O3/c1-12-6-8-14(24)11-18(12)29-21(13-7-9-16(26)15(25)10-13)20(23(30)31)28-22(29)17-4-3-5-19(27-17)32-2/h3-11H,1-2H3,(H,30,31)
- InChiKey:
KONVKQXFIZORGX-UHFFFAOYSA-N
External links
67032159 |
External search
Bibliography (1)
Pharmacological data
Biochemical tests | Cellular tests | PK tests | Cytotoxicity tests |
---|---|---|---|
1 | 0 | 0 | 0 |
Targets
PPI family | Best activity | Diseases | MMoA |
---|---|---|---|
MDM2-Like / P53 | 8.17 | cancer | Inhibition |
Physicochemical filters
Descriptor | Lipinski's RO5 | Veber | Pfizer's 3/75 | |
---|---|---|---|---|
Compliance | ||||
MW | 471.06 g/mol | |||
HBA | 6 | |||
HBD | 1 | |||
HBA + HBD | 7 | |||
AlogP | 5.55 | |||
TPSA | 77.24 | |||
RB | 4 |