UCSF

ZINC52569875

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2010 24 Yes

Popular Name: N-[4-(1-piperidyl)phenyl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carboxamide N-[4-(1-piperidyl)phenyl]-1,4,6,…

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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) 2.61 8.73 -44.23 3 6 1 66 326.424 2 ↓
Mid Mid (pH 6-8) 2.61 8.27 -14.78 2 6 0 64 325.416 2 ↓
Mid Mid (pH 6-8) 2.61 9.44 -80.98 4 6 2 67 327.432 2 ↓

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Rings

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

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