UCSF

ZINC11535672

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 16th, 2008 12 Yes

Popular Name: 1-methyl-2-methylsulfanyl-imidazo[4,5-c]pyridine 1-methyl-2-methylsulfanyl-imidaz…

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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) 1.32 4.37 -7.92 0 3 0 31 179.248 1 ↓
Mid Mid (pH 6-8) 1.32 4.81 -27.88 1 3 1 32 180.256 1 ↓
Lo Low (pH 4.5-6) 1.32 4.65 -33.3 1 3 1 32 180.256 1 ↓
Lo Low (pH 4.5-6) 1.32 5.08 -89.1 2 3 2 33 181.264 1 ↓

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

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