UCSF

ZINC09471028

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Substance Information

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

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

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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) 3.34 8.16 -63.29 0 8 -1 97 466.51 10 ↓
Mid Mid (pH 6-8) 3.79 7.07 -29.12 1 8 0 95 467.518 9 ↓
Mid Mid (pH 6-8) 2.76 8.05 -24.96 0 8 0 91 467.518 10 ↓

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