UCSF

ZINC09424272

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 26th, 2007 35 No

Popular Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-1-(2-furylmethyl)-3-hydroxy-5-(3-propoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one 4-(2,3-dihydro-1,4-benzodioxin-6…

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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) 3.45 9.48 -60.59 0 8 -1 101 474.489 8 ↓
Mid Mid (pH 6-8) 3.90 8.87 -29.55 1 8 0 98 475.497 7 ↓
Mid Mid (pH 6-8) 2.87 0.41 -21.37 0 8 0 95 475.497 8 ↓

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

No pre-computed analogs available. Try a structural similarity search.