UCSF

ZINC09425258

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 26th, 2007 36 No

Popular Name: 5-(3,4-diethoxyphenyl)-4-(2,5-dioxabicyclo[4.4.0]deca-7,9,11-trien-8-ylcarbonyl)-3-hydroxy-1-(3-meth 5-(3,4-diethoxyphenyl)-4-(2,5-di…

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) 2.54 8.09 -63.61 0 9 -1 107 496.536 11 ↓
Mid Mid (pH 6-8) 1.96 7.99 -28.14 0 9 0 101 497.544 11 ↓
Mid Mid (pH 6-8) 2.99 7.02 -30.29 1 9 0 104 497.544 10 ↓

Activity (Go SEA)

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