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canSAR1145538
FEATURES
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NAMES
    SMILES
    COc1ccc2nccc(NC(=O)[C@H]3CC[C@H](NCc4ccc5c(n4)NC(=O)CS5)CC3)c2n1
    InChI
    InChI=1S/C24H26N6O3S/c1-33-21-9-7-17-22(30-21)18(10-11-25-17)28-24(32)14-2-4-15(5-3-14)26-12-16-6-8-19-23(27-16)29-20(31)13-34-19/h6-11,14-15,26H,2-5,12-13H2,1H3,(H,25,28,32)(H,27,29,31)/t14-,15-
    MOLECULAR FORMULA
    C24H26N6O3S
    CROSS REFERENCES
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    canSAR1145538

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 478.18
    AlogP 3.36
    HBond donors 3
    HBond acceptors 9
    Atoms 60
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1145538.