UCSF

ZINC41584993

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Substance Information

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

Popular Name: (2Z)-7-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-2-(2-furylmethylene)-6-hydroxy-4-methy (2Z)-7-[[4-(1,3-benzodioxol-5-yl…

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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) 3.75 9 -47.85 2 8 1 90 475.521 5 ↓
Hi High (pH 8-9.5) 3.75 7.28 -49.28 0 8 -1 91 473.505 5 ↓
Mid Mid (pH 6-8) 3.75 8.95 -53.79 2 8 1 90 475.521 5 ↓
Mid Mid (pH 6-8) 3.75 9.57 -34.48 1 8 0 93 474.513 5 ↓
Mid Mid (pH 6-8) 3.75 6.7 -14.35 1 8 0 89 474.513 5 ↓

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