canSAR2100364
FEATURES
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NAMES
    SMILES
    Oc1nc([C@H]2CC[C@@H]2c2ccccn2)nc2c1cnn2C1CCOCC1
    InChI
    InChI=1S/C19H21N5O2/c25-19-15-11-21-24(12-6-9-26-10-7-12)18(15)22-17(23-19)14-5-4-13(14)16-3-1-2-8-20-16/h1-3,8,11-14H,4-7,9-10H2,(H,22,23,25)/t13-,14-/m0/s1
    MOLECULAR FORMULA
    C19H21N5O2
    CROSS REFERENCES
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    canSAR2100364
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight351.17
    AlogP2.94
    HBond donors1
    HBond acceptors7
    Atoms47
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2100364.