UCSF

ZINC69985656

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2011 12 No

Popular Name: 2-(methylsulfanylmethyl)-3H-imidazo[4,5-c]pyridine 2-(methylsulfanylmethyl)-3H-imid…

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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) 0.93 2.85 -37.23 0 3 -1 40 178.24 2 ↓
Mid Mid (pH 6-8) 0.93 3.32 -9.11 1 3 0 42 179.248 2 ↓

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

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