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canSAR842056
FEATURES
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NAMES
    SMILES
    CCCCN1C(=O)[C@H]2Cc3c([nH]c4ccccc34)[C@H](c3ccccc3OC)N2C1=O
    InChI
    InChI=1S/C24H25N3O3/c1-3-4-13-26-23(28)19-14-17-15-9-5-7-11-18(15)25-21(17)22(27(19)24(26)29)16-10-6-8-12-20(16)30-2/h5-12,19,22,25H,3-4,13-14H2,1-2H3/t19-,22+/m1/s1
    MOLECULAR FORMULA
    C24H25N3O3
    CROSS REFERENCES
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    canSAR842056

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 403.19
    AlogP 4.25
    HBond donors 1
    HBond acceptors 6
    Atoms 55
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR842056.