UCSF

ZINC33939918

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 3rd, 2009 37 Yes

Popular Name: (3-acetylphenyl)-N-tert-butyl-methyl-N-(5-methylisoxazol-3-yl)-oxo-BLAHdicarboxamide (3-acetylphenyl)-N-tert-butyl-me…

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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) 2.47 8.16 -32.77 2 10 0 131 506.559 6 ↓

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