UCSF

ZINC09455259

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 27th, 2007 35 No

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

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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) 2.27 7.33 -65.43 0 9 -1 107 482.509 10 ↓
Mid Mid (pH 6-8) 2.72 6.33 -31.03 1 9 0 104 483.517 9 ↓

Activity (Go SEA)

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