canSAR2063440
FEATURES
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NAMES
    SMILES
    O=C(c1nc2ccccc2s1)N1CCN(c2ccccc2)CC1
    InChI
    InChI=1S/C18H17N3OS/c22-18(17-19-15-8-4-5-9-16(15)23-17)21-12-10-20(11-13-21)14-6-2-1-3-7-14/h1-9H,10-13H2
    MOLECULAR FORMULA
    C18H17N3OS
    CROSS REFERENCES
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    canSAR2063440
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight323.11
    AlogP3.26
    HBond donors0
    HBond acceptors4
    Atoms40
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2063440.