UCSF

ZINC06355362

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 22nd, 2006 34 No

Popular Name: 5-(4-butoxyphenyl)-4-(2,5-dioxabicyclo[4.4.0]deca-7,9,11-trien-8-ylcarbonyl)-1-(2-methoxyethyl)pyrro 5-(4-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) 3.37 9.02 -60.88 0 8 -1 97 466.51 10 ↓
Mid Mid (pH 6-8) 3.81 1.54 -13.89 1 8 0 94 467.518 9 ↓
Mid Mid (pH 6-8) 2.78 1.77 -18.8 0 8 0 91 467.518 10 ↓

Activity (Go SEA)

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