UCSF

ZINC16731706

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 6th, 2008 34 No

Popular Name: (5S)-4-(4-allyloxybenzoyl)-5-(3-ethoxy-4-hydroxy-phenyl)-3-hydroxy-1-(3-methoxypropyl)-5H-pyrrol-2-o (5S)-4-(4-allyloxybenzoyl)-5-(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) 3.05 7.13 -60.22 1 8 -1 108 466.51 12 ↓
Mid Mid (pH 6-8) 3.50 6.15 -29.75 2 8 0 106 467.518 11 ↓
Mid Mid (pH 6-8) 2.47 7.13 -24.03 1 8 0 102 467.518 12 ↓

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