UCSF

ZINC42137084

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 25th, 2010 20 Yes

Popular Name: 2-(4-hydroxypyrimidin-2-yl)sulfanylimidazo[1,2-a]pyridine-3-carboxylic 2-(4-hydroxypyrimidin-2-yl)sulfa…

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Annotations

None

Vendors

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) 1.37 4.8 -55.87 1 7 -1 103 287.28 3 ↓
Mid Mid (pH 6-8) 1.83 3.32 -78.17 1 7 -1 108 287.28 3 ↓
Mid Mid (pH 6-8) 1.83 3.03 -118.36 0 7 -2 106 286.272 3 ↓
Lo Low (pH 4.5-6) 1.37 5.2 -43.26 2 7 0 104 288.288 3 ↓

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Rings

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

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