UCSF

ZINC12403049

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 12th, 2008 11 No

Popular Name: (1S,5R)-9-oxo-9$l^{4}-thiabicyclo[3.3.1]nonan-3-one (1S,5R)-9-oxo-9$l^{4}-thiabicycl…

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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 2.5 -13.77 0 2 0 34 172.249 0 ↓

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Rings

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

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