UCSF

ZINC62883622

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 17th, 2011 32 No

Popular Name: [(2Z)-2-[[4-(diethylamino)phenyl]methylene]-7-methyl-3-oxo-benzofuran-6-yl] [(2Z)-2-[[4-(diethylamino)phenyl…

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) 5.02 13.92 -52.94 1 6 0 74 429.496 7 ↓
Mid Mid (pH 6-8) 5.02 13.82 -11.55 0 6 0 73 428.488 7 ↓

Activity (Go SEA)

Rings

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

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