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LY-258817
FEATURES
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NAMES
  • LY-258817
SMILES
CCCCO/N=C(/C(=O)N[C@H]1CN2CC(C#N)=C(C(=O)O)N2C1=O)c1csc(N)n1
InChI
InChI=1S/C17H19N7O5S/c1-2-3-4-29-22-12(11-8-30-17(19)21-11)14(25)20-10-7-23-6-9(5-18)13(16(27)28)24(23)15(10)26/h8,10H,2-4,6-7H2,1H3,(H2,19,21)(H,20,25)(H,27,28)/b22-12+/t10-/m0/s1
MOLECULAR FORMULA
C17H19N7O5S
CROSS REFERENCES
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LY-258817

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 433.12
AlogP -0.33
HBond donors 4
HBond acceptors 12
Atoms 49
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 LY-258817.