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canSAR1493501
FEATURES
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NAMES
    SMILES
    CCOC(=O)c1c(NC(=O)CSc2cn(CCNC(=O)c3ccc(OC)cc3)c3ccccc23)sc2c1CCC2
    InChI
    InChI=1S/C30H31N3O5S2/c1-3-38-30(36)27-22-8-6-10-24(22)40-29(27)32-26(34)18-39-25-17-33(23-9-5-4-7-21(23)25)16-15-31-28(35)19-11-13-20(37-2)14-12-19/h4-5,7,9,11-14,17H,3,6,8,10,15-16,18H2,1-2H3,(H,31,35)(H,32,34)
    MOLECULAR FORMULA
    C30H31N3O5S2
    CROSS REFERENCES
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    canSAR1493501

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 577.17
    AlogP 5.54
    HBond donors 2
    HBond acceptors 8
    Atoms 71
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1493501.