UCSF

ZINC41585114

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 35 No

Popular Name: (2Z)-2-(1,3-benzodioxol-5-ylmethylene)-6-hydroxy-4-methyl-7-[(4-phenylpiperazin-1-yl)methyl]benzofur (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) 4.79 11.12 -52.77 2 7 1 77 471.533 4 ↓
Mid Mid (pH 6-8) 4.79 8.86 -10.81 1 7 0 75 470.525 4 ↓
Mid Mid (pH 6-8) 4.79 9.46 -42.25 0 7 -1 78 469.517 4 ↓
Mid Mid (pH 6-8) 4.79 11.68 -33.51 1 7 0 79 470.525 4 ↓

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