UCSF

ZINC19507920

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 2nd, 2008 16 No

Popular Name: 3,5-Dimethyl-1-(3-methylphenyl)-1H-pyrazole-4-carbaldehyde 3,5-Dimethyl-1-(3-methylphenyl)-…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 400876-66-6 , [400876-66-6]

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) 2.46 7.05 -11.91 0 3 0 35 214.268 2 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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