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TCMDC-141276
FEATURES
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NAMES
  • TCMDC-141276
SMILES
Cn1cnc2c(Nc3ccncc3)nc(-c3ccc(OC(F)(F)F)cc3)nc21.O=C(O)C(F)(F)F
InChI
InChI=1S/C18H13F3N6O.C2HF3O2/c1-27-10-23-14-16(24-12-6-8-22-9-7-12)25-15(26-17(14)27)11-2-4-13(5-3-11)28-18(19,20)21;3-2(4,5)1(6)7/h2-10H,1H3,(H,22,24,25,26);(H,6,7)
MOLECULAR FORMULA
C20H14F6N6O3
CROSS REFERENCES
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TCMDC-141276

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 500.10
AlogP 4.70
HBond donors 2
HBond acceptors 9
Atoms 49
Contains toxicophore Yes
Contains PAINS No
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by TCMDC-141276.