UCSF

ZINC40100293

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 23rd, 2010 36 No

Popular Name: (2S)-2-(3-ethoxy-4-propoxy-phenyl)-4-hydroxy-1-[2-(2-hydroxyethoxy)ethyl]-3-(3-methoxybenzoyl)-2H-py (2S)-2-(3-ethoxy-4-propoxy-pheny…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 2.57 6.5 -69.54 1 9 -1 118 498.552 14 ↓
Lo Low (pH 4.5-6) 2.57 5.75 -22.56 2 9 0 115 499.56 14 ↓

Activity (Go SEA)

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