canSAR1087902
FEATURES
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NAMES
    SMILES
    Cc1nc2cnccn2c1-c1ccnc(NCc2ccc(C(=O)Nc3ccccc3N)cc2)n1
    InChI
    InChI=1S/C25H22N8O/c1-16-23(33-13-12-27-15-22(33)30-16)21-10-11-28-25(32-21)29-14-17-6-8-18(9-7-17)24(34)31-20-5-3-2-4-19(20)26/h2-13,15H,14,26H2,1H3,(H,31,34)(H,28,29,32)
    MOLECULAR FORMULA
    C25H22N8O
    CROSS REFERENCES
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    canSAR1087902
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight450.19
    AlogP3.94
    HBond donors4
    HBond acceptors9
    Atoms56
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1087902.