UCSF

ZINC34925286

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2009 13 Yes

Popular Name: (4-ethyl-3,5-dimethyl-1H-pyrazol-1-yl)acetic acid (4-ethyl-3,5-dimethyl-1H-pyrazol…

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CAS Numbers: 1177352-85-0 , [1177352-85-0]

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) 0.92 5.67 -49.15 0 4 -1 58 181.215 3 ↓
Lo Low (pH 4.5-6) 0.92 5.77 -33.41 1 4 0 59 182.223 3 ↓

Vendor Notes

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

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