UCSF

ZINC41585912

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 33 No

Popular Name: (2Z)-6-hydroxy-2-[(E)-3-phenylprop-2-enylidene]-7-[[4-(2-pyridyl)piperazin-1-yl]methyl]benzofuran-3- (2Z)-6-hydroxy-2-[(E)-3-phenylpr…

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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) 4.38 10.35 -35.42 2 6 1 71 440.523 5 ↓
Hi High (pH 8-9.5) 4.38 10.8 -45.26 0 6 -1 73 438.507 5 ↓
Mid Mid (pH 6-8) 4.38 10.04 -11.33 1 6 0 70 439.515 5 ↓
Mid Mid (pH 6-8) 4.38 12.58 -105.86 3 6 2 72 441.531 5 ↓
Lo Low (pH 4.5-6) 4.38 12.27 -47.24 2 6 1 71 440.523 5 ↓

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

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