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canSAR1122354
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NAMES
    SMILES
    COC(=O)C1=C(C(=O)OC)N(c2nc3ccc(OC)cc3s2)CN(c2nc3ccc(OC)cc3s2)C1
    InChI
    InChI=1S/C24H22N4O6S2/c1-31-13-5-7-16-18(9-13)35-23(25-16)27-11-15(21(29)33-3)20(22(30)34-4)28(12-27)24-26-17-8-6-14(32-2)10-19(17)36-24/h5-10H,11-12H2,1-4H3
    MOLECULAR FORMULA
    C24H22N4O6S2
    CROSS REFERENCES
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    canSAR1122354

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 526.10
    AlogP 3.81
    HBond donors 0
    HBond acceptors 10
    Atoms 58
    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 canSAR1122354.