UCSF

ZINC41585761

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 36 No

Popular Name: (2Z)-2-(1,3-benzodioxol-5-ylmethylene)-6-hydroxy-7-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]benzof (2Z)-2-(1,3-benzodioxol-5-ylmeth…

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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) 4.47 7.52 -12.53 1 8 0 85 486.524 5 ↓
Mid Mid (pH 6-8) 4.47 10.34 -35.16 1 8 0 89 486.524 5 ↓
Mid Mid (pH 6-8) 4.47 9.76 -54.92 2 8 1 86 487.532 5 ↓
Mid Mid (pH 6-8) 4.47 8.11 -41.97 0 8 -1 87 485.516 5 ↓

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