UCSF

ZINC00283507

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 16 No

Popular Name: 5-Methyl-2-(4-nitrophenyl)-2H-pyrazol-3-ylamine 5-Methyl-2-(4-nitrophenyl)-2H-py…

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CAS Number: 16459-47-5

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) 1.45 5.89 -8.5 2 6 0 90 218.216 2 ↓
Lo Low (pH 4.5-6) 1.45 5.96 -34.97 3 6 1 91 219.224 2 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 97% Fluorochem

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