UCSF

ZINC04674333

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 27th, 2005 9 Yes

Popular Name: 3-Cyclopropyl-1H-pyrazol-5-amine 3-Cyclopropyl-1H-pyrazol-5-amine

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1031791-16-8 , 175137-46-9 , N/A , [1031791-16-8] , [175137-46-9]

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) 0.56 2.55 -31.6 3 3 1 52 124.167 1 ↓
Mid Mid (pH 6-8) 0.51 1.91 -28.62 4 3 1 56 124.167 1 ↓
Mid Mid (pH 6-8) 0.51 1.96 -5.4 3 3 0 55 123.159 1 ↓

Vendor Notes

Note Type Comments Provided By
BP 163-165°/1mm Oakwood Chemical
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Purity 96% Fluorochem
Warnings IRRITANT Matrix Scientific
PUBCHEM_PATENT_ID WO2000021955A1 IBM Patent Data

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

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