UCSF

ZINC09477399

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 27th, 2007 39 No

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

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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) 5.64 13.34 -60.55 0 7 -1 88 528.625 13 ↓
Mid Mid (pH 6-8) 6.09 12.32 -29.01 1 7 0 85 529.633 12 ↓
Mid Mid (pH 6-8) 5.06 13.3 -22.73 0 7 0 82 529.633 13 ↓

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