UCSF

ZINC01304619

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 15th, 2004 12 Yes

Popular Name: 3H-Imidazo[4,5-b]pyridine-2-acetonitrile 3H-Imidazo[4,5-b]pyridine-2-acet…

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CAS Number: 107932-97-8

Download: MOL2 SDF SMILES Flexibase

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 3.57 -20.82 1 4 0 65 158.164 1 ↓
Mid Mid (pH 6-8) 0.60 3.12 -40.18 0 4 -1 64 157.156 1 ↓
Lo Low (pH 4.5-6) 0.60 3.88 -38.98 2 4 1 67 159.172 1 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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