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88A
FEATURES
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NAMES
  • 88A
SMILES
CS(=O)(=O)c1ccc(-c2cccn3nc(Nc4ccc(N5CCOCC5)cc4)nc23)cc1
InChI
InChI=1S/C23H23N5O3S/c1-32(29,30)20-10-4-17(5-11-20)21-3-2-12-28-22(21)25-23(26-28)24-18-6-8-19(9-7-18)27-13-15-31-16-14-27/h2-12H,13-16H2,1H3,(H,24,26)
MOLECULAR FORMULA
C23H23N5O3S
CROSS REFERENCES
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88A

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 449.15
AlogP 3.38
HBond donors 1
HBond acceptors 8
Atoms 55
Contains toxicophore No
Contains PAINS Yes
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by 88A.