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8-(3-Fluorophenoxymethyl)Caffeine
FEATURES
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NAMES
  • 8-(3-Fluorophenoxymethyl)Caffeine
SMILES
Cn1c(=O)c2c(nc(COc3cccc(F)c3)n2C)n(C)c1=O
InChI
InChI=1S/C15H15FN4O3/c1-18-11(8-23-10-6-4-5-9(16)7-10)17-13-12(18)14(21)20(3)15(22)19(13)2/h4-7H,8H2,1-3H3
MOLECULAR FORMULA
C15H15FN4O3
CROSS REFERENCES
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8-(3-Fluorophenoxymethyl)Caffeine

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 318.11
AlogP 0.69
HBond donors 0
HBond acceptors 7
Atoms 38
Contains toxicophore No
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by 8-(3-Fluorophenoxymethyl)Caffeine.