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canSAR1767042
FEATURES
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NAMES
    SMILES
    COc1ccc(C(=O)NN=Cc2sc(N3CCOCC3)nc2-c2ccccc2)cc1OC
    InChI
    InChI=1S/C23H24N4O4S/c1-29-18-9-8-17(14-19(18)30-2)22(28)26-24-15-20-21(16-6-4-3-5-7-16)25-23(32-20)27-10-12-31-13-11-27/h3-9,14-15H,10-13H2,1-2H3,(H,26,28)
    MOLECULAR FORMULA
    C23H24N4O4S
    CROSS REFERENCES
    1767042 logo

    canSAR1767042

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 452.15
    AlogP 3.43
    HBond donors 1
    HBond acceptors 8
    Atoms 56
    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 canSAR1767042.