UCSF

ZINC24760115

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 20th, 2009 36 Yes

Popular Name: 2-Methyl-2-(4-(3-methyl-2-oxo-8-(quinolin-3-yl)-2,3-dihydro-1H-imidazo[4,5-c]quinolin-1-yl)phenyl)propanenitrile 2-Methyl-2-(4-(3-methyl-2-oxo-8-…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 915019-65-7 , [915019-65-7]

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 5.77 14.76 -17.99 0 6 0 77 469.548 3 ↓

Vendor Notes

Note Type Comments Provided By
Indications antineoplastic KeyOrganics Bioactives
Target mTOR, PI3K Selleck Chemicals
Reactome Database Links REACT_147854 ChEBI

Activity (Go SEA)

Direct Reactome Annotations (via ChEBI)

Description Species
Constitutive PI3K/AKT Signaling in Cancer

Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.