TCMDC-132089
FEATURES
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NAMES
  • TCMDC-132089
SMILES
Cl.Clc1ccc(OC2CCC(Cn3ccnc3)(c3ccc(Cl)cc3Cl)CC2)c(Cl)c1
InChI
InChI=1S/C22H20Cl4N2O.ClH/c23-15-1-3-18(19(25)11-15)22(13-28-10-9-27-14-28)7-5-17(6-8-22)29-21-4-2-16(24)12-20(21)26;/h1-4,9-12,14,17H,5-8,13H2;1H
MOLECULAR FORMULA
C22H21Cl5N2O
CROSS REFERENCES
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TCMDC-132089
Compound Synopsis
OVERVIEW
PROPERTIES
Molecular weight504.01
AlogP7.88
HBond donors0
HBond acceptors3
Atoms51
Contains toxicophoreNo
Contains PAINSNo
Commercially availableUnknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by TCMDC-132089.