UCSF

ZINC04283826

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 18th, 2005 14 No

Popular Name: 2-Methyl-3-(3,4-methylenedioxyphenyl)propanal 2-Methyl-3-(3,4-methylenedioxyph…

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CAS Numbers: 1205-17-0 , [1205-17-0]

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) 2.57 1.3 -10.86 0 3 0 36 192.214 3 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem

Activity (Go SEA)

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