canSAR2150274
FEATURES
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NAMES
    SMILES
    Cc1c(Cl)c(C(=O)NCc2ccc(-c3ccc(CC(=O)O)cc3)cc2)nn1-c1ccc(C(=O)NS(=O)(=O)c2ccc3c(c2)CCN3Cc2ccc(Cl)c(Cl)c2)cc1C(=O)N1CCc2ccccc2C1
    InChI
    InChI=1S/C52H43Cl3N6O7S/c1-31-48(55)49(51(65)56-28-33-8-13-37(14-9-33)36-11-6-32(7-12-36)25-47(62)63)57-61(31)46-18-15-39(27-42(46)52(66)60-23-20-35-4-2-3-5-40(35)30-60)50(64)58-69(67,68)41-16-19-45-38(26-41)21-22-59(45)29-34-10-17-43(53)44(54)24-34/h2-19,24,26-27H,20-23,25,28-30H2,1H3,(H,56,65)(H,58,64)(H,62,63)
    MOLECULAR FORMULA
    C52H43Cl3N6O7S
    CROSS REFERENCES
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    canSAR2150274
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight1000.20
    AlogP9.24
    HBond donors3
    HBond acceptors13
    Atoms112
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2150274.