UCSF

ZINC02539361

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 13 No

Popular Name: 3,4-Dimethoxy-5-hydroxybenzaldehyde 3,4-Dimethoxy-5-hydroxybenzaldehyde

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CAS Numbers: 29865-90-5 , [29865-90-5]

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) 1.05 1.31 -9.83 1 4 0 56 182.175 3 ↓

Vendor Notes

Note Type Comments Provided By
BP 180 / 12 TCI
MP 66 TCI
Purity 97% Fluorochem

Activity (Go SEA)

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