UCSF

ZINC00163369

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 17th, 2005 13 Yes

Popular Name: 5-Acetyl-2-hydroxybenzoic acid 5-Acetyl-2-hydroxybenzoic acid

Find On: PubMed — Wikipedia — Google

CAS Numbers: 13110-96-8 , [13110-96-8] , [37466-21-0]

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) 1.75 2.59 -61.45 1 4 -1 77 179.151 2 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 214-216? Alfa-Aesar
Melting_Point 214-216° Alfa-Aesar
MP 218 TCI
Purity 97% Fluorochem

Activity (Go SEA)

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