canSAR1833813
FEATURES
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NAMES
    SMILES
    Cc1ccccc1COc1ccc(C=NNC(=O)c2nnn(-c3nonc3N)c2CN2CCC(C)CC2)cc1
    InChI
    InChI=1S/C27H31N9O3/c1-18-11-13-35(14-12-18)16-23-24(30-34-36(23)26-25(28)32-39-33-26)27(37)31-29-15-20-7-9-22(10-8-20)38-17-21-6-4-3-5-19(21)2/h3-10,15,18H,11-14,16-17H2,1-2H3,(H2,28,32)(H,31,37)
    MOLECULAR FORMULA
    C27H31N9O3
    CROSS REFERENCES
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    canSAR1833813
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight529.25
    AlogP3.12
    HBond donors3
    HBond acceptors12
    Atoms70
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1833813.