UCSF

ZINC14985145

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 18th, 2008 12 Yes

Popular Name: 4-Chloro-3-ethyl-1-methyl-1H-pyrazole-5-carboxylic acid 4-Chloro-3-ethyl-1-methyl-1H-pyr…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 127892-62-0 , [127892-62-0]

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) 1.60 3.71 -42.12 0 4 -1 58 187.606 2 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem

Activity (Go SEA)

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