UCSF

ZINC65493426

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Substance Information

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

Popular Name: (1R,6S)-9-(3-fluoro-2-pyridyl)-4,9-diazabicyclo[4.2.1]nonan-3-one (1R,6S)-9-(3-fluoro-2-pyridyl)-4…

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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) 2.09 4.51 -7.97 1 4 0 45 235.262 1 ↓
Lo Low (pH 4.5-6) 2.09 4.91 -41.23 2 4 1 46 236.27 1 ↓

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

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