UCSF

ZINC41645919

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 35 No

Popular Name: (2Z)-8-(1,3-benzodioxol-5-ylmethyl)-2-[(4-isopropylphenyl)methylene]-4-methyl-7,9-dihydrofuro[2,3-f] (2Z)-8-(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) 6.03 10.77 -11.36 0 6 0 61 469.537 4 ↓
Lo Low (pH 4.5-6) 6.03 13.63 -57.06 1 6 1 62 470.545 4 ↓

Activity (Go SEA)

Rings

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

No pre-computed analogs available. Try a structural similarity search.