UCSF

ZINC67515559

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 10th, 2011 22 Yes

Popular Name: [(1R,5S)-3,8-diazabicyclo[3.2.1]octan-3-yl]-[1-[[(3R)-3-piperidyl]methyl]triazol-4-yl]methanone [(1R,5S)-3,8-diazabicyclo[3.2.1]…

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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) -0.24 4.15 -93.49 4 7 2 84 306.414 3 ↓
Mid Mid (pH 6-8) -0.24 2.88 -50.09 3 7 1 80 305.406 3 ↓

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Rings

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

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