UCSF

ZINC41585456

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Substance Information

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

Popular Name: (2Z)-2-[(2,3-dimethoxyphenyl)methylene]-7-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]-6-hydroxy-benzo (2Z)-2-[(2,3-dimethoxyphenyl)met…

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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) 4.46 9.42 -11.77 1 7 0 75 490.531 6 ↓
Mid Mid (pH 6-8) 4.46 10.01 -46.77 0 7 -1 78 489.523 6 ↓
Mid Mid (pH 6-8) 4.46 12.23 -34.46 1 7 0 79 490.531 6 ↓
Mid Mid (pH 6-8) 4.46 11.67 -48.85 2 7 1 77 491.539 6 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )