UCSF

ZINC16741678

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Substance Information

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

Popular Name: (5S)-5-(4-tert-butylphenyl)-4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-3-hydroxy-1-(2-methoxyethyl) (5S)-5-(4-tert-butylphenyl)-4-(2…

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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) 3.58 9.11 -64.48 0 7 -1 88 450.511 7 ↓
Mid Mid (pH 6-8) 4.02 8 -30.15 1 7 0 85 451.519 6 ↓
Mid Mid (pH 6-8) 2.99 9.03 -22.75 0 7 0 82 451.519 7 ↓

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