UCSF

ZINC09463266

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 27th, 2007 34 No

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

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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) 4.57 11.57 -55.66 0 6 -1 79 495.338 5 ↓
Mid Mid (pH 6-8) 5.01 9.74 -31.09 1 6 0 76 496.346 4 ↓
Mid Mid (pH 6-8) 3.99 10.74 -28.71 0 6 0 73 496.346 5 ↓

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