UCSF

ZINC54967291

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 9th, 2010 11 Yes

Popular Name: (1R,2R,5S)-7-oxobicyclo[3.2.0]heptane-2-carboxylic (1R,2R,5S)-7-oxobicyclo[3.2.0]he…

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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) 0.37 4.96 -49.96 0 3 -1 57 153.157 1 ↓
Lo Low (pH 4.5-6) 0.37 2.99 -7.89 1 3 0 54 154.165 1 ↓

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Rings

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

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