UCSF

ZINC40067320

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 23rd, 2010 27 No

Popular Name: (2R)-2-(3-bromo-4-hydroxy-5-methoxy-phenyl)-4-hydroxy-1-(2-hydroxyethyl)-3-(thiophene-2-carbonyl)-2H (2R)-2-(3-bromo-4-hydroxy-5-meth…

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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) 1.95 1.86 -61.74 2 7 -1 110 453.29 6 ↓
Hi High (pH 8-9.5) 1.95 2.77 -110.13 1 7 -2 113 452.282 6 ↓
Lo Low (pH 4.5-6) 1.95 0.97 -16.79 3 7 0 107 454.298 6 ↓

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