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TCMDC-135498
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NAMES
  • TCMDC-135498
SMILES
CC(C)N1CCN(C(CN2CCN(CCCOc3cccc(-c4ccccc4)c3)CC2)c2ccc(F)cc2)CC1.Cl
InChI
InChI=1S/C34H45FN4O.ClH/c1-28(2)38-21-23-39(24-22-38)34(30-12-14-32(35)15-13-30)27-37-19-17-36(18-20-37)16-7-25-40-33-11-6-10-31(26-33)29-8-4-3-5-9-29;/h3-6,8-15,26,28,34H,7,16-25,27H2,1-2H3;1H
MOLECULAR FORMULA
C34H46ClFN4O
CROSS REFERENCES
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TCMDC-135498

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 580.33
AlogP 6.07
HBond donors 0
HBond acceptors 5
Atoms 87
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-135498.