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TCMDC-141277
FEATURES
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NAMES
  • TCMDC-141277
SMILES
O=C(Nc1ccc(Cl)c(Cl)c1)N1CCC(NCc2cccc([N+](=O)[O-])c2)CC1.O=C(O)C(F)(F)F
InChI
InChI=1S/C19H20Cl2N4O3.C2HF3O2/c20-17-5-4-15(11-18(17)21)23-19(26)24-8-6-14(7-9-24)22-12-13-2-1-3-16(10-13)25(27)28;3-2(4,5)1(6)7/h1-5,10-11,14,22H,6-9,12H2,(H,23,26);(H,6,7)
MOLECULAR FORMULA
C21H21Cl2F3N4O5
CROSS REFERENCES
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TCMDC-141277

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 536.08
AlogP 5.32
HBond donors 3
HBond acceptors 9
Atoms 56
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-141277.