UCSF

ZINC26512722

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 7th, 2009 12 Yes

Popular Name: 3-pyridin-4-ylisoxazol-5-amine 3-pyridin-4-ylisoxazol-5-amine

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CAS Number: 19790-96-6

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) 0.41 0.68 -10.05 2 4 0 65 161.164 1 ↓
Lo Low (pH 4.5-6) 0.41 1.11 -40.47 3 4 1 66 162.172 1 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem

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