UCSF

ZINC00873758

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 18th, 2005 14 Yes

Popular Name: 3-(4-Chloro-3,5-dimethyl-pyrazol-1-yl)-butyric acid 3-(4-Chloro-3,5-dimethyl-pyrazol…

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CAS Number: 956354-96-4

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) 1.32 5.02 -42.78 0 4 -1 58 215.66 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% )

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