S91
FEATURES
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NAMES
  • S91
SMILES
Cc1cccc(Nc2nc(Nc3ccc(CC(=O)O)cc3)ncc2C(N)=O)c1
InChI
InChI=1S/C20H19N5O3/c1-12-3-2-4-15(9-12)23-19-16(18(21)28)11-22-20(25-19)24-14-7-5-13(6-8-14)10-17(26)27/h2-9,11H,10H2,1H3,(H2,21,28)(H,26,27)(H2,22,23,24,25)
MOLECULAR FORMULA
C20H19N5O3
CROSS REFERENCES
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S91
Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight377.15
AlogP3.00
HBond donors5
HBond acceptors8
Atoms47
Contains toxicophoreNo
Contains PAINSNo
Commercially availableUnknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by S91.