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canSAR1833415
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NAMES
    SMILES
    Oc1nc2cc3c(cc2cc1CN(Cc1cccnc1)C(S)=NCc1ccco1)OCCO3
    InChI
    InChI=1S/C24H22N4O4S/c29-23-18(9-17-10-21-22(11-20(17)27-23)32-8-7-31-21)15-28(14-16-3-1-5-25-12-16)24(33)26-13-19-4-2-6-30-19/h1-6,9-12H,7-8,13-15H2,(H,26,33)(H,27,29)
    MOLECULAR FORMULA
    C24H22N4O4S
    CROSS REFERENCES
    1833415 logo

    canSAR1833415

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 462.14
    AlogP 4.19
    HBond donors 1
    HBond acceptors 8
    Atoms 55
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1833415.