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canSAR1720004
FEATURES
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NAMES
    SMILES
    COC(=O)C1=C(c2ccc3ccccc3c2)C[C@@H]2CC[C@H]1N2C(=O)NCCO
    InChI
    InChI=1S/C22H24N2O4/c1-28-21(26)20-18(16-7-6-14-4-2-3-5-15(14)12-16)13-17-8-9-19(20)24(17)22(27)23-10-11-25/h2-7,12,17,19,25H,8-11,13H2,1H3,(H,23,27)/t17-,19+/m0/s1
    MOLECULAR FORMULA
    C22H24N2O4
    CROSS REFERENCES
    1720004 logo

    canSAR1720004

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 380.17
    AlogP 2.71
    HBond donors 2
    HBond acceptors 6
    Atoms 52
    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 canSAR1720004.