UCSF

ZINC13410215

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 18th, 2008 13 Yes

Popular Name: (1S,3S,5R)-1-(dimethylaminomethyl)-8-oxabicyclo[3.2.1]oct-6-en-3-ol (1S,3S,5R)-1-(dimethylaminomethy…

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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) 0.51 2.27 -34.14 2 3 1 34 184.259 2 ↓

Vendor Notes

Note Type Comments Provided By
mp 242 - 243 MolMall (formerly Molecular Diversity Preservation International)

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Rings

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