canSAR604004
FEATURES
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NAMES
    SMILES
    CCN1/C(=C/c2ccc3cc(C)ccc3[n+]2CC)Sc2cc(C)c(C)cc21
    InChI
    InChI=1S/C24H27N2S/c1-6-25-20(10-9-19-12-16(3)8-11-21(19)25)15-24-26(7-2)22-13-17(4)18(5)14-23(22)27-24/h8-15H,6-7H2,1-5H3/q+1
    MOLECULAR FORMULA
    C24H27N2S+
    CROSS REFERENCES
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    canSAR604004
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight375.19
    AlogP6.00
    HBond donors0
    HBond acceptors2
    Atoms54
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR604004.