UCSF

ZINC09456583

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 27th, 2007 37 No

Popular Name: 1-benzyl-5-(3-butoxyphenyl)-4-(2,5-dioxabicyclo[4.4.0]deca-7,9,11-trien-8-ylcarbonyl)-3-hydroxy-5H-p 1-benzyl-5-(3-butoxyphenyl)-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) 4.76 12.52 -60.7 0 7 -1 88 498.555 9 ↓
Mid Mid (pH 6-8) 5.20 11.49 -26.79 1 7 0 85 499.563 8 ↓
Mid Mid (pH 6-8) 4.17 12.49 -19.51 0 7 0 82 499.563 9 ↓

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