canSAR1833301
FEATURES
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NAMES
    SMILES
    O=c1n(CCO)c2cnc3ccc(-c4cnn(CCO)c4)nc3c2n1C1CCOCC1
    InChI
    InChI=1S/C21H24N6O4/c28-7-5-25-13-14(11-23-25)16-1-2-17-19(24-16)20-18(12-22-17)26(6-8-29)21(30)27(20)15-3-9-31-10-4-15/h1-2,11-13,15,28-29H,3-10H2
    MOLECULAR FORMULA
    C21H24N6O4
    CROSS REFERENCES
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    canSAR1833301
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight424.19
    AlogP0.95
    HBond donors2
    HBond acceptors10
    Atoms55
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1833301.