UCSF

ZINC02654062

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2004 11 Yes

Popular Name: 3-neopentylisoxazol-5-amine 3-neopentylisoxazol-5-amine

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CAS Number: 749902-10-1

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) 2.15 1.82 -6.19 2 3 0 52 154.213 2 ↓
Lo Low (pH 4.5-6) 2.15 1.41 -26.98 3 3 1 53 155.221 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 116 - 118 Enamine Building Blocks
MP 87 - 89 Enamine Building Blocks
MP 87...89 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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