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LY-242551
FEATURES
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NAMES
  • LY-242551
SMILES
Cn1ccnc1SC1=C(C(=O)[O-])N2C(=O)[C@@H](NC(=O)/C(=N/OCCF)c3csc(N)n3)[C@H]2CC1.[Na+]
InChI
InChI=1S/C19H20FN7O5S2.Na/c1-26-6-5-22-19(26)34-11-3-2-10-13(16(29)27(10)14(11)17(30)31)24-15(28)12(25-32-7-4-20)9-8-33-18(21)23-9;/h5-6,8,10,13H,2-4,7H2,1H3,(H2,21,23)(H,24,28)(H,30,31);/q;+1/p-1/b25-12+;/t10-,13+;/m1./s1
MOLECULAR FORMULA
C19H19FN7NaO5S2
CROSS REFERENCES
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LY-242551

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 531.08
AlogP -3.60
HBond donors 3
HBond acceptors 12
Atoms 54
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-242551.