canSAR1809954
FEATURES
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NAMES
    SMILES
    COc1cccc(C(c2nnnn2C(C)(C)C)N2CCN(C/C=C/c3ccccc3)CC2)c1OC
    InChI
    InChI=1S/C27H36N6O2/c1-27(2,3)33-26(28-29-30-33)24(22-14-9-15-23(34-4)25(22)35-5)32-19-17-31(18-20-32)16-10-13-21-11-7-6-8-12-21/h6-15,24H,16-20H2,1-5H3/b13-10+
    MOLECULAR FORMULA
    C27H36N6O2
    CROSS REFERENCES
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    canSAR1809954
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight476.29
    AlogP3.87
    HBond donors0
    HBond acceptors8
    Atoms71
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1809954.