UCSF

ZINC13542648

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 21st, 2008 11 Yes

Popular Name: 2,4'-Dihydroxyacetophenone 2,4'-Dihydroxyacetophenone

Find On: PubMed — Wikipedia — Google

CAS Numbers: 2491-39-6 , 5706-85-4 , 89-84-9

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) 0.35 0.05 -12.4 2 3 0 58 152.149 2 ↓
Hi High (pH 8-9.5) 0.47 0.86 -52.03 1 3 -1 60 151.141 2 ↓
Hi High (pH 8-9.5) 0.35 0.78 -46.94 1 3 -1 60 151.141 2 ↓

Activity (Go SEA)

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