canSAR1416917
FEATURES
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NAMES
    SMILES
    Oc1nc(CN2CCCCC2)nc2c1C1(CCCC1)Cc1ccccc1-2
    InChI
    InChI=1S/C22H27N3O/c26-21-19-20(23-18(24-21)15-25-12-6-1-7-13-25)17-9-3-2-8-16(17)14-22(19)10-4-5-11-22/h2-3,8-9H,1,4-7,10-15H2,(H,23,24,26)
    MOLECULAR FORMULA
    C22H27N3O
    CROSS REFERENCES
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    canSAR1416917
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight349.22
    AlogP4.20
    HBond donors1
    HBond acceptors4
    Atoms53
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1416917.