UCSF

ZINC00542306

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 15 No

Popular Name: 4-(chloromethyl)-6-ethyl-2H-chromen-2-one 4-(chloromethyl)-6-ethyl-2H-chro…

Find On: PubMed — Wikipedia — Google

CAS Number: 637751-75-8

Other Names:

MFCD04183932

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) 3.41 2.77 -9.42 0 2 0 30 222.671 2 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem

Activity (Go SEA)

Rings

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

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