UCSF

ZINC33814197

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 20th, 2009 33 No

Popular Name: (4E,5S)-5-(3-bromo-4-hydroxy-5-methoxy-phenyl)-4-[hydroxy-(2-methylimidazo[1,2-a]pyridin-3-yl)methyl (4E,5S)-5-(3-bromo-4-hydroxy-5-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) 2.49 6.8 -51.6 1 9 -1 116 515.34 7 ↓
Mid Mid (pH 6-8) 2.49 7.55 -111.83 0 9 -2 119 514.332 7 ↓
Lo Low (pH 4.5-6) 2.49 5.65 -22.82 2 9 0 114 516.348 7 ↓

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