UCSF

ZINC06165868

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 10th, 2006 36 No

Popular Name: 4-[[4-hydroxy-1-(3-morpholinopropyl)-5-oxo-2-(3-pyridyl)-2H-pyrrol-3-yl]carbonyl]-N,N-dimethyl-benze 4-[[4-hydroxy-1-(3-morpholinopro…

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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) 0.60 -5.62 -64.87 2 10 1 121 515.612 9 ↓
Mid Mid (pH 6-8) 0.02 -5.72 -77.59 1 10 1 118 515.612 9 ↓
Lo Low (pH 4.5-6) 1.05 -5.88 -132.04 3 10 2 122 516.62 8 ↓

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