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canSAR1950027
FEATURES
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NAMES
    SMILES
    O=C(Nc1ccc(CCC2=NCCN2)cc1)c1ccc(C(=O)Nc2ccc(CCC3=NCCN3)cc2)cc1
    InChI
    InChI=1S/C30H32N6O2/c37-29(35-25-11-1-21(2-12-25)5-15-27-31-17-18-32-27)23-7-9-24(10-8-23)30(38)36-26-13-3-22(4-14-26)6-16-28-33-19-20-34-28/h1-4,7-14H,5-6,15-20H2,(H,31,32)(H,33,34)(H,35,37)(H,36,38)
    MOLECULAR FORMULA
    C30H32N6O2
    CROSS REFERENCES
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    canSAR1950027

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 508.26
    AlogP 4.06
    HBond donors 4
    HBond acceptors 8
    Atoms 70
    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 canSAR1950027.