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Xamoterol Fumarate
FEATURES
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NAMES
  • XAMOTEROL FUMARATE
SMILES
O=C(NCCNCC(O)COc1ccc(O)cc1)N1CCOCC1.O=C(O)/C=C/C(=O)O
InChI
InChI=1S/C16H25N3O5.C4H4O4/c20-13-1-3-15(4-2-13)24-12-14(21)11-17-5-6-18-16(22)19-7-9-23-10-8-19;5-3(6)1-2-4(7)8/h1-4,14,17,20-21H,5-12H2,(H,18,22);1-2H,(H,5,6)(H,7,8)/b;2-1+
MOLECULAR FORMULA
C20H29N3O9
CROSS REFERENCES
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Xamoterol Fumarate

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 455.19
AlogP -0.52
HBond donors 6
HBond acceptors 12
Atoms 61
Contains toxicophore Yes
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by Xamoterol Fumarate.