UCSF

ZINC09462670

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Substance Information

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

Popular Name: 3-hydroxy-1-(3-methoxypropyl)-5-(5-methyl-2-furyl)-4-[4-(m-tolylmethoxy)benzoyl]-5H-pyrrol-2-one 3-hydroxy-1-(3-methoxypropyl)-5-…

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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) 4.19 10.86 -61.53 0 7 -1 92 474.533 10 ↓
Mid Mid (pH 6-8) 4.63 9.79 -29.72 1 7 0 89 475.541 9 ↓
Mid Mid (pH 6-8) 3.60 10.85 -21.55 0 7 0 86 475.541 10 ↓

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