UCSF

ZINC02576888

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 23 Yes

Popular Name: 3(2',4'-Dichlorophenyl)-7-Ethoxy-4-Methylcoumarin 3(2',4'-Dichlorophenyl)-7-Ethoxy…

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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) 5.81 2.93 -12.5 0 3 0 39 349.213 3 ↓

Vendor Notes

Note Type Comments Provided By
M.P 189-191C Indofine
MP 189-191o C Indofine
SOLUBILITY Soluble in Chloroform Indofine
APPEARANCE White crystalline powder Indofine

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Rings

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

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