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Chemistry

Mol. Mass

317.39

ALogP

2.45

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: O[C@@H](CNCCCCc1ccc(O)cc1)c2ccc(O)c(O)c2
  • InChIKey: IIRWWTKISYTTBL-SFHVURJKSA-N
    InChI=1S/C18H23NO4/c20-15-7-4-13(5-8-15)3-1-2-10-19-12-18(23)14-6-9-16(21)17(22)11-14/h4-9,11,18-23H,1-3,10,12H2/t18-/m0/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL1201251   ChEMBL
arbutamine *

CHEMBL1200385   ChEMBL
arbutamine hydrochloride

B07L15YAEV   NCATS
arbutamine *

Arbutamine   Wikipedia

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