UCSF

ZINC69697994

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2011 22 Yes

Popular Name: 1-[(2R)-2-(dimethylaminomethyl)-1-piperidyl]-2-imidazo[1,2-a]pyridin-2-yl-ethanone 1-[(2R)-2-(dimethylaminomethyl)-…

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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) 2.00 9.92 -37.69 1 5 1 42 301.414 4 ↓
Lo Low (pH 4.5-6) 2.00 9.86 -74.7 2 5 2 43 302.422 4 ↓

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

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