UCSF

ZINC05155448

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 23rd, 2006 14 Yes

Popular Name: 5-(2-methoxyphenyl)-1H-pyrazol-3-amine 5-(2-methoxyphenyl)-1H-pyrazol-3…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1239061-74-5 , 149246-82-2 , 909861-26-3 , [149246-82-2]

Download: MOL2 SDF SMILES Flexibase

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Vendors

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) 1.61 2.83 -7.57 3 4 0 64 189.218 2 ↓
Ref Reference (pH 7) 1.61 2.95 -9.73 3 4 0 64 189.218 2 ↓
Lo Low (pH 4.5-6) 1.61 2.98 -25.68 4 4 1 65 190.226 2 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks
MP 94 - 96 Enamine Building Blocks
MP 94...96 Enamine Building Blocks
purity 95 Enamine Building Blocks
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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

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