UCSF

ZINC14571071

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 12th, 2008 28 Yes

Popular Name: N-[(7-chloro-4-oxo-3H-quinazolin-2-yl)methyl]-4-isopropyl-N-propyl-benzamide N-[(7-chloro-4-oxo-3H-quinazolin…

Find On: PubMed — Wikipedia — Google

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) 4.50 10.97 -12.18 1 5 0 66 397.906 6 ↓
Hi High (pH 8-9.5) 4.96 8.48 -47.2 0 5 -1 69 396.898 6 ↓

Activity (Go SEA)

Rings

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

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