UCSF

ZINC40099464

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 23rd, 2010 32 No

Popular Name: (2R)-3-(4-allyloxybenzoyl)-2-(3-ethoxy-4-hydroxy-phenyl)-4-hydroxy-1-(2-hydroxyethyl)-2H-pyrrol-5-on (2R)-3-(4-allyloxybenzoyl)-2-(3-…

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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) 2.16 3.58 -62.6 2 8 -1 119 438.456 10 ↓
Lo Low (pH 4.5-6) 2.16 2.83 -17.36 3 8 0 117 439.464 10 ↓

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