UCSF

ZINC40048698

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 22nd, 2010 34 No

Popular Name: (2S)-2-(3,4-diethoxyphenyl)-4-hydroxy-1-(3-hydroxypropyl)-3-(4-methoxy-3-methyl-benzoyl)-2H-pyrrol-5 (2S)-2-(3,4-diethoxyphenyl)-4-hy…

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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) 2.85 6.99 -61.73 1 8 -1 108 468.526 11 ↓
Lo Low (pH 4.5-6) 2.85 6.23 -17.37 2 8 0 106 469.534 11 ↓

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