UCSF

ZINC67935354

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 17th, 2011 26 Yes

Popular Name: 6-[(1R,5S)-3,8-diazabicyclo[3.2.1]octan-8-yl]-N-[3-(2-pyridyl)propyl]pyridine-3-carboxamide 6-[(1R,5S)-3,8-diazabicyclo[3.2.…

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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) 0.92 7.06 -52.94 3 6 1 75 352.462 6 ↓
Hi High (pH 8-9.5) 0.92 5.97 -10.99 2 6 0 70 351.454 6 ↓
Lo Low (pH 4.5-6) 0.92 7.4 -89.63 4 6 2 76 353.47 6 ↓

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Rings

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

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