UCSF

ZINC41584861

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 37 No

Popular Name: (2Z)-7-[(4-benzylpiperazin-1-yl)methyl]-2-[(2,3-dimethoxyphenyl)methylene]-6-hydroxy-4-methyl-benzof (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) 4.42 10.92 -50.73 2 7 1 77 501.603 7 ↓
Hi High (pH 8-9.5) 4.42 9.2 -43.2 0 7 -1 78 499.587 7 ↓
Mid Mid (pH 6-8) 4.42 10.89 -50.26 2 7 1 77 501.603 7 ↓
Mid Mid (pH 6-8) 4.42 11.5 -33.15 1 7 0 79 500.595 7 ↓
Mid Mid (pH 6-8) 4.42 8.63 -11.08 1 7 0 75 500.595 7 ↓

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