UCSF

ZINC41514758

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2010 29 Yes

Popular Name: 8-[[benzyl(methyl)amino]methyl]-3-(4-chlorophenyl)-7-hydroxy-chromen-2-one 8-[[benzyl(methyl)amino]methyl]-…

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) 5.51 13.09 -43.53 2 4 1 55 406.889 5 ↓
Mid Mid (pH 6-8) 5.51 10.74 -12.88 1 4 0 54 405.881 5 ↓

Activity (Go SEA)

Rings

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