UCSF

ZINC01576947

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 10 Yes

Popular Name: 5-amino-1,3-dimethyl-1H-pyrazole-4-carbonitrile 5-amino-1,3-dimethyl-1H-pyrazole…

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CAS Numbers: 54820-92-7 , [5334-41-8] , [54820-92-7]

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) -0.10 2.12 -8.34 2 4 0 68 136.158 0 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 193 - 195 KeyOrganics
Purity 95% Fluorochem
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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