UCSF

ZINC26506532

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 7th, 2009 9 Yes

Popular Name: 1-(5-Methyl-1H-pyrazol-3-yl)ethanone 1-(5-Methyl-1H-pyrazol-3-yl)etha…

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CAS Number: 17357-74-3

Other Names:

N/A

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) 0.68 2.13 -7.42 1 3 0 46 124.143 1 ↓
Ref Reference (pH 7) 0.68 2.1 -7.42 1 3 0 46 124.143 1 ↓

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

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