UCSF

ZINC62824266

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 14th, 2011 17 Yes

Popular Name: 2-(3H-imidazo[4,5-b]pyridin-2-yl)-4-iodo-aniline 2-(3H-imidazo[4,5-b]pyridin-2-yl…

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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) 3.14 6.01 -9.98 3 4 0 68 336.136 1 ↓
Hi High (pH 8-9.5) 3.14 4.83 -42.11 2 4 -1 66 335.128 1 ↓

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

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