canSAR1503781
FEATURES
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NAMES
    SMILES
    CCC/C=C/c1ccc(CN2C(C(C)C)C(=O)N(Cc3cn(CCC4OCCO4)nn3)CCS2(=O)=O)cc1
    InChI
    InChI=1S/C27H39N5O5S/c1-4-5-6-7-22-8-10-23(11-9-22)18-32-26(21(2)3)27(33)30(14-17-38(32,34)35)19-24-20-31(29-28-24)13-12-25-36-15-16-37-25/h6-11,20-21,25-26H,4-5,12-19H2,1-3H3/b7-6+
    MOLECULAR FORMULA
    C27H39N5O5S
    CROSS REFERENCES
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    canSAR1503781
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight545.27
    AlogP3.05
    HBond donors0
    HBond acceptors10
    Atoms77
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1503781.