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canSAR1127999
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NAMES
    SMILES
    CN(C)c1ccccc1-c1cc(NCc2cncn2Cc2ccc(-c3ccccc3)cc2N)ccc1Cl
    InChI
    InChI=1S/C31H30ClN5/c1-36(2)31-11-7-6-10-27(31)28-17-25(14-15-29(28)32)35-19-26-18-34-21-37(26)20-24-13-12-23(16-30(24)33)22-8-4-3-5-9-22/h3-18,21,35H,19-20,33H2,1-2H3
    MOLECULAR FORMULA
    C31H30ClN5
    CROSS REFERENCES
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    canSAR1127999

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 507.22
    AlogP 7.18
    HBond donors 3
    HBond acceptors 5
    Atoms 67
    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 canSAR1127999.