UCSF

ZINC41661281

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 33 No

Popular Name: (2Z)-2-(1,3-benzodioxol-5-ylmethylene)-8-[2-(4-chlorophenyl)ethyl]-7,9-dihydrofuro[2,3-f][1,3]benzox (2Z)-2-(1,3-benzodioxol-5-ylmeth…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) 5.22 9.6 -10.88 0 6 0 61 461.901 4 ↓
Lo Low (pH 4.5-6) 5.22 12.44 -54.67 1 6 1 62 462.909 4 ↓

Activity (Go SEA)

Rings

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