UCSF

ZINC41584908

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Substance Information

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

Popular Name: (2Z)-7-[(4-benzylpiperazin-1-yl)methyl]-2-[(4-tert-butylphenyl)methylene]-6-hydroxy-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) 5.93 13.23 -44.72 2 5 1 58 483.632 6 ↓
Hi High (pH 8-9.5) 5.93 11.5 -42.06 0 5 -1 60 481.616 6 ↓
Mid Mid (pH 6-8) 5.93 13.8 -28.5 1 5 0 61 482.624 6 ↓
Mid Mid (pH 6-8) 5.93 10.94 -8.59 1 5 0 57 482.624 6 ↓
Mid Mid (pH 6-8) 5.93 13.19 -45.44 2 5 1 58 483.632 6 ↓

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