UCSF

ZINC40100451

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 23rd, 2010 33 No

Popular Name: (2S)-2-(4-allyloxy-3-ethoxy-phenyl)-4-hydroxy-1-(2-hydroxyethyl)-3-(3-methoxybenzoyl)-2H-pyrrol-5-on (2S)-2-(4-allyloxy-3-ethoxy-phen…

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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) 2.44 6.02 -68.08 1 8 -1 108 452.483 11 ↓
Lo Low (pH 4.5-6) 2.44 5.26 -21.27 2 8 0 106 453.491 11 ↓

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