UCSF

ZINC41584844

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 32 No

Popular Name: (2Z)-7-[(4-benzylpiperazin-1-yl)methyl]-2-(2-furylmethylene)-6-hydroxy-4-methyl-benzofuran-3-one (2Z)-7-[(4-benzylpiperazin-1-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) 3.85 10.33 -42.45 2 6 1 71 431.512 5 ↓
Hi High (pH 8-9.5) 3.85 8.62 -46.38 0 6 -1 73 429.496 5 ↓
Mid Mid (pH 6-8) 3.85 10.29 -46.49 2 6 1 71 431.512 5 ↓
Mid Mid (pH 6-8) 3.85 10.9 -29.28 1 6 0 74 430.504 5 ↓
Mid Mid (pH 6-8) 3.85 8.04 -11.27 1 6 0 70 430.504 5 ↓

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