UCSF

ZINC16741337

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Substance Information

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

Popular Name: (5R)-4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-5-(4-ethoxy-3-methoxy-phenyl)-3-hydroxy-1-(3-methox (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) 2.16 7.17 -63.78 0 9 -1 107 482.509 10 ↓
Mid Mid (pH 6-8) 2.61 6.1 -31.76 1 9 0 104 483.517 9 ↓
Mid Mid (pH 6-8) 1.58 7.09 -28.5 0 9 0 101 483.517 10 ↓

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