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canSAR1099349
FEATURES
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NAMES
    SMILES
    CCN(CC)Cc1cc(Nc2ccnc3cc(Cl)ccc23)ccc1N1CCOCC1
    InChI
    InChI=1S/C24H29ClN4O/c1-3-28(4-2)17-18-15-20(6-8-24(18)29-11-13-30-14-12-29)27-22-9-10-26-23-16-19(25)5-7-21(22)23/h5-10,15-16H,3-4,11-14,17H2,1-2H3,(H,26,27)
    MOLECULAR FORMULA
    C24H29ClN4O
    CROSS REFERENCES
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    canSAR1099349

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 424.20
    AlogP 5.31
    HBond donors 1
    HBond acceptors 5
    Atoms 59
    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 canSAR1099349.