TPW
FEATURES
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NAMES
  • 3-Deazathiamine Diphosphate
  • TPW
SMILES
Cc1ncc(Cc2csc(CCOP(=O)(O)OP(=O)(O)O)c2C)c(N)n1
InChI
InChI=1S/C13H19N3O7P2S/c1-8-11(5-10-6-15-9(2)16-13(10)14)7-26-12(8)3-4-22-25(20,21)23-24(17,18)19/h6-7H,3-5H2,1-2H3,(H,20,21)(H2,14,15,16)(H2,17,18,19)
MOLECULAR FORMULA
C13H19N3O7P2S
CROSS REFERENCES
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TPW
Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight423.04
AlogP2.10
HBond donors5
HBond acceptors10
Atoms45
Contains toxicophoreYes
Contains PAINSNo
Commercially availableUnknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by TPW.