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canSAR2019021
FEATURES
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NAMES
    SMILES
    Cc1cc2cc(C)c3nnc(SCC(=O)NCc4ccc5c(c4)OCO5)n3c2cc1C
    InChI
    InChI=1S/C23H22N4O3S/c1-13-6-17-7-15(3)22-25-26-23(27(22)18(17)8-14(13)2)31-11-21(28)24-10-16-4-5-19-20(9-16)30-12-29-19/h4-9H,10-12H2,1-3H3,(H,24,28)
    MOLECULAR FORMULA
    C23H22N4O3S
    CROSS REFERENCES
    2019021 logo

    canSAR2019021

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 434.14
    AlogP 3.94
    HBond donors 1
    HBond acceptors 7
    Atoms 53
    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 canSAR2019021.