UCSF

ZINC83811594

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 23rd, 2013 10 Yes

Popular Name: (+/-)-1-Methyl-7-azabicyclo[4.2.0]octan-8-one (+/-)-1-Methyl-7-azabicyclo[4.2.…

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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) 1.50 1.78 -6.84 1 2 0 29 139.198 0 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point n.d. Squarix

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

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