canSAR1083531
FEATURES
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NAMES
    SMILES
    CCCCOc1ccc(C(=O)Nc2ccc3nc(SC(C)C(=O)Nc4c(C)cc(C)cc4C)sc3c2)cc1
    InChI
    InChI=1S/C30H33N3O3S2/c1-6-7-14-36-24-11-8-22(9-12-24)29(35)31-23-10-13-25-26(17-23)38-30(32-25)37-21(5)28(34)33-27-19(3)15-18(2)16-20(27)4/h8-13,15-17,21H,6-7,14H2,1-5H3,(H,31,35)(H,33,34)
    MOLECULAR FORMULA
    C30H33N3O3S2
    CROSS REFERENCES
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    canSAR1083531
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight547.20
    AlogP7.77
    HBond donors2
    HBond acceptors6
    Atoms71
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1083531.