UCSF

ZINC16737476

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 6th, 2008 33 No

Popular Name: (5R)-4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(2-methoxyethyl (5R)-4-(2,3-dihydro-1,4-benzodio…

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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) 1.52 5.91 -61.04 0 9 -1 107 454.455 8 ↓
Mid Mid (pH 6-8) 1.96 4.48 -31.44 1 9 0 104 455.463 7 ↓
Mid Mid (pH 6-8) 0.93 5.49 -27.25 0 9 0 101 455.463 8 ↓

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