UCSF

ZINC09463553

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 27th, 2007 38 No

Popular Name: 1-benzyl-4-(2,5-dioxabicyclo[4.4.0]deca-7,9,11-trien-8-ylcarbonyl)-3-hydroxy-5-(4-pentoxyphenyl)-5H- 1-benzyl-4-(2,5-dioxabicyclo[4.4…

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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) 5.28 13.31 -62.11 0 7 -1 88 512.582 10 ↓
Mid Mid (pH 6-8) 5.73 12.21 -29.26 1 7 0 85 513.59 9 ↓
Mid Mid (pH 6-8) 4.70 13.18 -23.56 0 7 0 82 513.59 10 ↓

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