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canSAR927180
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NAMES
    SMILES
    C=CCN1C[C@H]2c3nc4ccccc4c(C)c3C[C@@H]1CN2Cc1ccc(OC)cc1OC
    InChI
    InChI=1S/C27H31N3O2/c1-5-12-29-17-25-27-23(18(2)22-8-6-7-9-24(22)28-27)13-20(29)16-30(25)15-19-10-11-21(31-3)14-26(19)32-4/h5-11,14,20,25H,1,12-13,15-17H2,2-4H3/t20-,25+/m1/s1
    MOLECULAR FORMULA
    C27H31N3O2
    CROSS REFERENCES
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    canSAR927180

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 429.24
    AlogP 4.53
    HBond donors 0
    HBond acceptors 5
    Atoms 63
    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 canSAR927180.