UCSF

ZINC01022285

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 6th, 2004 15 Yes

Popular Name: 5-Amino-3-methyl-1-phenyl-1H-pyrazole-4-carbonitrile 5-Amino-3-methyl-1-phenyl-1H-pyr…

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CAS Numbers: 5346-56-5 , [5346-56-5]

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) 1.17 5.64 -7.88 2 4 0 68 198.229 1 ↓

Vendor Notes

Note Type Comments Provided By
MP 129-131° Fluorochem
Purity 97% Fluorochem

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