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canSAR2050487
FEATURES
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NAMES
    SMILES
    N#Cc1ccc(OC(=O)N2CCC(c3nc(C4=NOC(c5ccccc5)C4)cs3)CC2)cc1
    InChI
    InChI=1S/C25H22N4O3S/c26-15-17-6-8-20(9-7-17)31-25(30)29-12-10-19(11-13-29)24-27-22(16-33-24)21-14-23(32-28-21)18-4-2-1-3-5-18/h1-9,16,19,23H,10-14H2
    MOLECULAR FORMULA
    C25H22N4O3S
    CROSS REFERENCES
    2050487 logo

    canSAR2050487

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 458.14
    AlogP 5.26
    HBond donors 0
    HBond acceptors 7
    Atoms 55
    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 canSAR2050487.