canSAR2080517
FEATURES
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NAMES
    SMILES
    Nc1ncnc2c1c(-c1cccc(O)c1)cn2[C@H]1C[C@@H](CN2CCC2)C1
    InChI
    InChI=1S/C20H23N5O/c21-19-18-17(14-3-1-4-16(26)9-14)11-25(20(18)23-12-22-19)15-7-13(8-15)10-24-5-2-6-24/h1,3-4,9,11-13,15,26H,2,5-8,10H2,(H2,21,22,23)/t13-,15+
    MOLECULAR FORMULA
    C20H23N5O
    CROSS REFERENCES
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    canSAR2080517
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight349.19
    AlogP3.04
    HBond donors3
    HBond acceptors6
    Atoms49
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2080517.