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TCMDC-138723
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NAMES
  • TCMDC-138723
SMILES
COc1cc2nc(NCC3CCN(c4nc(N)c5cc(OC)c(OC)cc5n4)CC3)nc(N)c2cc1OC
InChI
InChI=1S/C26H32N8O4/c1-35-19-9-15-17(11-21(19)37-3)30-25(32-23(15)27)29-13-14-5-7-34(8-6-14)26-31-18-12-22(38-4)20(36-2)10-16(18)24(28)33-26/h9-12,14H,5-8,13H2,1-4H3,(H2,28,31,33)(H3,27,29,30,32)
MOLECULAR FORMULA
C26H32N8O4
CROSS REFERENCES
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TCMDC-138723

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 520.25
AlogP 3.10
HBond donors 5
HBond acceptors 12
Atoms 70
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 TCMDC-138723.