UCSF

ZINC39848126

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2010 35 No

Popular Name: (2S)-2-(4-ethoxyphenyl)-4-hydroxy-3-(2-methoxybenzoyl)-1-(3-morpholinopropyl)-2H-pyrrol-5-one (2S)-2-(4-ethoxyphenyl)-4-hydrox…

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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) 2.97 8.54 -66.91 0 8 -1 91 479.553 10 ↓
Mid Mid (pH 6-8) 2.97 10.81 -84.61 1 8 0 93 480.561 10 ↓
Lo Low (pH 4.5-6) 2.97 10.04 -58.26 2 8 1 90 481.569 10 ↓

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