UCSF

ZINC65154169

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 5th, 2011 24 Yes

Popular Name: 2-(2-chlorophenyl)-N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]acetamide 2-(2-chlorophenyl)-N-[2-(3-ethyl…

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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) 2.80 8.76 -18.61 1 5 0 60 342.83 6 ↓
Lo Low (pH 4.5-6) 2.80 9.35 -39.51 2 5 1 61 343.838 6 ↓

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

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