UCSF

ZINC41532477

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2010 24 No

Popular Name: (2R)-1-ethyl-3-[(E)-3-(2-furyl)prop-2-enoyl]-4-hydroxy-2-(2-pyridyl)-2H-pyrrol-5-one (2R)-1-ethyl-3-[(E)-3-(2-furyl)p…

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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) 1.03 6.56 -67.48 0 6 -1 86 323.328 5 ↓
Mid Mid (pH 6-8) 1.03 7.25 -68.84 1 6 0 88 324.336 5 ↓
Lo Low (pH 4.5-6) 1.03 6.37 -46.7 2 6 1 85 325.344 5 ↓
Lo Low (pH 4.5-6) 1.03 5.68 -16.88 1 6 0 84 324.336 5 ↓

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