UCSF

ZINC41585175

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 34 No

Popular Name: (2E)-2-[(4-dimethylaminophenyl)methylene]-6-hydroxy-7-[(4-phenylpiperazin-1-yl)methyl]benzofuran-3-o (2E)-2-[(4-dimethylaminophenyl)m…

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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) 4.62 9.78 -10.82 1 6 0 60 455.558 5 ↓
Mid Mid (pH 6-8) 4.62 10.39 -44.78 0 6 -1 63 454.55 5 ↓
Mid Mid (pH 6-8) 4.62 12.04 -47.1 2 6 1 61 456.566 5 ↓
Mid Mid (pH 6-8) 4.62 12.61 -32.81 1 6 0 64 455.558 5 ↓
Lo Low (pH 4.5-6) 4.62 12.82 -82.18 3 6 0 63 457.574 5 ↓

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