UCSF

ZINC38537108

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 26th, 2010 16 Yes

Popular Name: 5-Amino-1-(3-chlorophenyl)-3-methyl-1H-pyrazole-4-carbonitrile 5-Amino-1-(3-chlorophenyl)-3-met…

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CAS Numbers: 107842-57-9 , [107842-57-9]

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) 2.04 6.15 -8.41 2 4 0 68 232.674 1 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem

Activity (Go SEA)

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