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canSAR1004396
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NAMES
    SMILES
    CC(=O)C1=NN(c2ccccc2)C2C3N(c4ccccc4)N=C(C(C)=O)N3c3[nH]c(-c4ccccc4)cc3N12
    InChI
    InChI=1S/C30H25N7O2/c1-19(38)26-32-36(22-14-8-4-9-15-22)29-30-35(27(20(2)39)33-37(30)23-16-10-5-11-17-23)28-25(34(26)29)18-24(31-28)21-12-6-3-7-13-21/h3-18,29-31H,1-2H3
    MOLECULAR FORMULA
    C30H25N7O2
    CROSS REFERENCES
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    canSAR1004396

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 515.21
    AlogP 4.81
    HBond donors 1
    HBond acceptors 9
    Atoms 64
    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 canSAR1004396.