UCSF

ZINC02575887

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 19 No

Popular Name: 3-Oxo-3-(3,4,5-trimethoxyphenyl)propionic acidmethyl ester 3-Oxo-3-(3,4,5-trimethoxyphenyl)…

Find On: PubMed — Wikipedia — Google

CAS Number: 139148-39-3

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) 0.92 3.82 -16.46 0 6 0 71 268.265 7 ↓

Activity (Go SEA)

Rings

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