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TCMDC-140342
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NAMES
  • TCMDC-140342
SMILES
Cn1c(C2CC3CCC(C2)N3CC2CCC(NC(=O)/C=C/c3ccc(Cl)c(Cl)c3)CC2)nc2ccccc21
InChI
InChI=1S/C31H36Cl2N4O/c1-36-29-5-3-2-4-28(29)35-31(36)22-17-24-12-13-25(18-22)37(24)19-21-6-10-23(11-7-21)34-30(38)15-9-20-8-14-26(32)27(33)16-20/h2-5,8-9,14-16,21-25H,6-7,10-13,17-19H2,1H3,(H,34,38)/b15-9+
MOLECULAR FORMULA
C31H36Cl2N4O
CROSS REFERENCES
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TCMDC-140342

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 550.23
AlogP 6.98
HBond donors 1
HBond acceptors 5
Atoms 74
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-140342.