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canSAR1968751
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NAMES
    SMILES
    CC1CCC(NC2=NC(=Cc3c[nH]c4ncccc34)C(=O)N2)CC1
    InChI
    InChI=1S/C18H21N5O/c1-11-4-6-13(7-5-11)21-18-22-15(17(24)23-18)9-12-10-20-16-14(12)3-2-8-19-16/h2-3,8-11,13H,4-7H2,1H3,(H,19,20)(H2,21,22,23,24)
    MOLECULAR FORMULA
    C18H21N5O
    CROSS REFERENCES
    1968751 logo

    canSAR1968751

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 323.17
    AlogP 2.56
    HBond donors 3
    HBond acceptors 6
    Atoms 45
    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 canSAR1968751.