UCSF

ZINC17058665

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 12th, 2008 34 No

Popular Name: N,N-diethyl-4-[(E)-hydroxy-[(2R)-2-(3-hydroxyphenyl)-1-(2-methoxyethyl)-4,5-dioxo-pyrrolidin-3-ylide N,N-diethyl-4-[(E)-hydroxy-[(2R)…

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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) 1.92 4.02 -69.13 1 9 -1 127 487.554 10 ↓
Mid Mid (pH 6-8) 2.37 5.67 -14.36 2 9 0 124 488.562 9 ↓
Mid Mid (pH 6-8) 1.34 4.8 -15.76 1 9 0 121 488.562 10 ↓

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