UCSF

ZINC39855604

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2010 24 No

Popular Name: (4E)-4-hydroxyimino-3,6,6-trimethyl-N-(4-methylpiperazin-1-yl)-5,7-dihydrobenzofuran-2-carboxamide (4E)-4-hydroxyimino-3,6,6-trimet…

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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) 0.87 4.65 -45.38 3 7 1 83 335.428 2 ↓
Mid Mid (pH 6-8) 0.87 2.29 -10.73 2 7 0 81 334.42 2 ↓
Mid Mid (pH 6-8) 0.87 3.47 -36.92 3 7 1 83 335.428 2 ↓

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