UCSF

ZINC20309494

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2008 36 No

Popular Name: (5S)-5-(3,4-dimethoxyphenyl)-3-hydroxy-4-(2-hydroxy-4-methoxy-benzoyl)-1-(2-morpholinoethyl)-5H-pyrr (5S)-5-(3,4-dimethoxyphenyl)-3-h…

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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) 1.87 4 -66.67 1 10 -1 121 497.524 9 ↓
Hi High (pH 8-9.5) 1.87 5.03 -135.48 0 10 -2 124 496.516 9 ↓
Mid Mid (pH 6-8) 1.87 6.41 -81.85 2 10 0 122 498.532 9 ↓

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