UCSF

ZINC13403797

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 18th, 2008 28 Yes

Popular Name: (4S,5R,6R)-5-(4-bromobenzoyl)-4-hydroxy-6-(p-tolyl)-4-(trifluoromethyl)hexahydropyrimidin-2-one (4S,5R,6R)-5-(4-bromobenzoyl)-4-…

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) 4.31 4.56 -11.42 3 5 0 78 457.246 4 ↓

Activity (Go SEA)

Rings

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