UCSF

ZINC00394563

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 12 Yes

Popular Name: 3-methyl-5-phenylisoxazole 3-methyl-5-phenylisoxazole

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1008-75-9 , [1008-75-9]

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) 2.56 2.42 -5.99 0 2 0 26 159.188 1 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 65 - 67 KeyOrganics

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