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3Q3
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NAMES
  • 3Q3
SMILES
Nc1nc(-c2ccc3c(N)[nH]nc3c2)cc(N2CCO[C@H](C(=O)Nc3ccccc3)C2)n1
InChI
InChI=1S/C22H22N8O2/c23-20-15-7-6-13(10-17(15)28-29-20)16-11-19(27-22(24)26-16)30-8-9-32-18(12-30)21(31)25-14-4-2-1-3-5-14/h1-7,10-11,18H,8-9,12H2,(H,25,31)(H3,23,28,29)(H2,24,26,27)/t18-/m0/s1
MOLECULAR FORMULA
C22H22N8O2
CROSS REFERENCES
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3Q3

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 430.19
AlogP 2.03
HBond donors 6
HBond acceptors 10
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 3Q3.