UCSF

ZINC54967653

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 9th, 2010 10 No

Popular Name: 8-Exo-iodo-2-azabicyclo[3.3.0]octan-3-one 8-Exo-iodo-2-azabicyclo[3.3.0]oc…

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CAS Number: 100556-58-9

Other Names:

MFCD16038752

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) 1.31 2.97 -6.6 1 2 0 29 251.067 0 ↓

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Rings

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

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