UCSF

ZINC09186812

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 13th, 2007 36 No

Popular Name: 5-(3,4-dimethoxyphenyl)-1-[3-(dimethylamino)propyl]-4-[(2,8-dimethylimidazo[1,2-a]pyridin-3-yl)carbonyl]-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one 5-(3,4-dimethoxyphenyl)-1-[3-(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) 2.55 11.34 -77.92 1 9 0 101 492.576 9 ↓
Mid Mid (pH 6-8) 3.00 10.89 -48.64 2 9 1 98 493.584 8 ↓
Mid Mid (pH 6-8) 1.97 1.29 -55.83 1 9 1 94 493.584 9 ↓
Mid Mid (pH 6-8) 1.97 1.49 -84.21 2 9 2 95 494.592 9 ↓
Mid Mid (pH 6-8) 3.00 11.19 -85.66 3 9 2 99 494.592 8 ↓

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