UCSF

ZINC05319845

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 29th, 2006 25 No

Popular Name: 3-(4-methoxyphenyl)-2-methyl-5-phenyldihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(3H,5H)-dione 3-(4-methoxyphenyl)-2-methyl-5-p…

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CAS Number: 318951-53-0

Other Names:

MFCD00244793

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) 2.39 6.39 -14.95 0 6 0 59 338.363 3 ↓
Ref Reference (pH 7) 2.39 6.62 -10.85 0 6 0 59 338.363 3 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 152 - 156 KeyOrganics

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