canSAR193194
FEATURES
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NAMES
    SMILES
    Nc1nc(N)c2nc(CNc3ccc(C(=O)NC(CCC(=O)Nc4ccc(O)c(O)c4)C(=O)O)cc3)cnc2n1
    InChI
    InChI=1S/C25H25N9O6/c26-21-20-22(34-25(27)33-21)29-11-15(31-20)10-28-13-3-1-12(2-4-13)23(38)32-16(24(39)40)6-8-19(37)30-14-5-7-17(35)18(36)9-14/h1-5,7,9,11,16,28,35-36H,6,8,10H2,(H,30,37)(H,32,38)(H,39,40)(H4,26,27,29,33,34)
    MOLECULAR FORMULA
    C25H25N9O6
    CROSS REFERENCES
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    canSAR193194
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight547.19
    AlogP1.21
    HBond donors10
    HBond acceptors15
    Atoms65
    Contains toxicophoreYes
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR193194.