canSAR1388016
FEATURES
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NAMES
    SMILES
    Cc1cnc(N2CC[C@H]3[C@@H]2CCC(=O)N3c2ccccc2)nc1
    InChI
    InChI=1S/C18H20N4O/c1-13-11-19-18(20-12-13)21-10-9-16-15(21)7-8-17(23)22(16)14-5-3-2-4-6-14/h2-6,11-12,15-16H,7-10H2,1H3
    MOLECULAR FORMULA
    C18H20N4O
    CROSS REFERENCES
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    canSAR1388016
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight308.16
    AlogP2.56
    HBond donors0
    HBond acceptors5
    Atoms43
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1388016.