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canSAR743189
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NAMES
    SMILES
    CC/N=c1/cc2oc3cc(NCCCN)c4cc5ccccc5cc4c3nc-2cc1C.Cl
    InChI
    InChI=1S/C26H26N4O.ClH/c1-3-28-21-14-24-23(11-16(21)2)30-26-20-13-18-8-5-4-7-17(18)12-19(20)22(15-25(26)31-24)29-10-6-9-27;/h4-5,7-8,11-15,29H,3,6,9-10,27H2,1-2H3;1H/b28-21-;
    MOLECULAR FORMULA
    C26H27ClN4O
    CROSS REFERENCES
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    canSAR743189

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 446.19
    AlogP 5.65
    HBond donors 3
    HBond acceptors 5
    Atoms 59
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR743189.