UCSF

ZINC09421978

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 25th, 2007 27 Yes

Popular Name: 2-(6-chloro-7-hydroxy-4-methyl-2-oxo-chromen-3-yl)-N-methyl-N-[2-(2-pyridyl)ethyl]acetamide 2-(6-chloro-7-hydroxy-4-methyl-2…

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) 2.85 0.25 -18.97 1 6 0 83 386.835 5 ↓
Lo Low (pH 4.5-6) 2.85 0.39 -47.13 2 6 1 84 387.843 5 ↓

Activity (Go SEA)

Rings

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

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