UCSF

ZINC64219936

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 14th, 2011 20 Yes

Popular Name: 6,8-Dichloro-4-methyl-3-phenylcoumarin 6,8-Dichloro-4-methyl-3-phenylco…

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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) 5.37 10.96 -8.33 0 2 0 30 305.16 1 ↓

Vendor Notes

Note Type Comments Provided By
M.P 179-181C Indofine
MP 179-181o C Indofine
APPEARANCE Light green crystalline solid Indofine
SOLUBILITY Soluble in Chloroform Indofine
SOLUBILITY Soluble in Chloroform, Ethyl acetate Indofine

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

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