UCSF

ZINC69738493

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2011 17 Yes

Popular Name: 5-(cyclohexylmethyl)-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine 5-(cyclohexylmethyl)-1-methyl-6,…

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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) 1.76 8.52 -29.46 1 3 1 22 234.367 2 ↓
Hi High (pH 8-9.5) 1.76 8.05 -7.61 0 3 0 21 233.359 2 ↓
Mid Mid (pH 6-8) 1.76 10.44 -97.11 2 3 2 24 235.375 2 ↓
Lo Low (pH 4.5-6) 1.76 9.98 -38.7 1 3 1 22 234.367 2 ↓

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Rings

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

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