canSAR72977
FEATURES
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NAMES
    SMILES
    CCCn1c(=O)c2nc(-c3ccc(OCC(=O)NCCc4c[nH]cn4)cc3O)[nH]c2n(CCC)c1=O
    InChI
    InChI=1S/C24H29N7O5/c1-3-9-30-22-20(23(34)31(10-4-2)24(30)35)28-21(29-22)17-6-5-16(11-18(17)32)36-13-19(33)26-8-7-15-12-25-14-27-15/h5-6,11-12,14,32H,3-4,7-10,13H2,1-2H3,(H,25,27)(H,26,33)(H,28,29)
    MOLECULAR FORMULA
    C24H29N7O5
    CROSS REFERENCES
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    canSAR72977
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight495.22
    AlogP1.54
    HBond donors4
    HBond acceptors12
    Atoms65
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR72977.