UCSF

ZINC16735116

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 6th, 2008 35 No

Popular Name: (5S)-4-(4-allyloxybenzoyl)-5-(4-ethoxy-3-methoxy-phenyl)-3-hydroxy-1-(3-methoxypropyl)-5H-pyrrol-2-o (5S)-4-(4-allyloxybenzoyl)-5-(4-…

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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) 3.36 8.46 -16.79 1 8 0 95 481.545 13 ↓
Mid Mid (pH 6-8) 2.77 9.12 -24.01 0 8 0 91 481.545 13 ↓

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