UCSF

ZINC03884317

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2005 16 Yes

Popular Name: 5-amino-1-(2,3-dimethylphenyl)-1H-pyrazole-4-carbonitrile 5-amino-1-(2,3-dimethylphenyl)-1…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 792953-00-5 , [792953-00-5]

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) 1.96 6.48 -7.55 2 4 0 68 212.256 1 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 140 - 142 KeyOrganics
MP 140-142° Matrix Scientific
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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