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canSAR503429
FEATURES
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NAMES
    SMILES
    CC1=C(NCCCNCCC/N=C2/C(=O)c3ccccc3C(O)=C2C)C(=O)c2ccccc2C1=O
    InChI
    InChI=1S/C28H29N3O4/c1-17-23(27(34)21-11-5-3-9-19(21)25(17)32)30-15-7-13-29-14-8-16-31-24-18(2)26(33)20-10-4-6-12-22(20)28(24)35/h3-6,9-12,29-30,33H,7-8,13-16H2,1-2H3/b31-24+
    MOLECULAR FORMULA
    C28H29N3O4
    CROSS REFERENCES
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    canSAR503429

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 471.22
    AlogP 3.93
    HBond donors 3
    HBond acceptors 7
    Atoms 64
    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 canSAR503429.