UCSF

ZINC69975898

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2011 16 Yes

Popular Name: N-[[2-[(1R,4S,5R)-7-oxabicyclo[2.2.1]heptan-5-yl]thiazol-4-yl]methyl]ethanamine N-[[2-[(1R,4S,5R)-7-oxabicyclo[2…

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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) 1.24 4.22 -36.62 2 3 1 39 239.364 4 ↓
Hi High (pH 8-9.5) 1.24 2.85 -4.8 1 3 0 34 238.356 4 ↓

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Rings

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

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