canSAR2145683
FEATURES
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NAMES
    SMILES
    COc1cc(OC)cc(N(CC2CCN(CC(F)(F)F)CC2)c2ccc3ncc(-c4cnn(C)c4)nc3c2)c1
    InChI
    InChI=1S/C28H31F3N6O2/c1-35-17-20(14-33-35)27-15-32-25-5-4-21(12-26(25)34-27)37(22-10-23(38-2)13-24(11-22)39-3)16-19-6-8-36(9-7-19)18-28(29,30)31/h4-5,10-15,17,19H,6-9,16,18H2,1-3H3
    MOLECULAR FORMULA
    C28H31F3N6O2
    CROSS REFERENCES
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    canSAR2145683
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight540.25
    AlogP5.46
    HBond donors0
    HBond acceptors8
    Atoms70
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2145683.