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canSAR200200
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NAMES
    SMILES
    CCCCC1(CCCC)NC(c2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)Cc2c1[nH]c1ccccc21
    InChI
    InChI=1S/C34H38N4/c1-3-5-21-34(22-6-4-2)32-27(26-19-13-14-20-28(26)35-32)23-29(38-34)33-36-30(24-15-9-7-10-16-24)31(37-33)25-17-11-8-12-18-25/h7-20,29,35,38H,3-6,21-23H2,1-2H3,(H,36,37)
    MOLECULAR FORMULA
    C34H38N4
    CROSS REFERENCES
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    canSAR200200

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 502.31
    AlogP 8.69
    HBond donors 3
    HBond acceptors 4
    Atoms 76
    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 canSAR200200.