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canSAR2085743
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NAMES
    SMILES
    COCC1CC2CCC(C1)N2c1nc(N2CCNC(=O)C2)nc2scc(-c3ccccc3OC)c12
    InChI
    InChI=1S/C26H31N5O3S/c1-33-14-16-11-17-7-8-18(12-16)31(17)24-23-20(19-5-3-4-6-21(19)34-2)15-35-25(23)29-26(28-24)30-10-9-27-22(32)13-30/h3-6,15-18H,7-14H2,1-2H3,(H,27,32)
    MOLECULAR FORMULA
    C26H31N5O3S
    CROSS REFERENCES
    2085743 logo

    canSAR2085743

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 493.21
    AlogP 3.70
    HBond donors 1
    HBond acceptors 8
    Atoms 66
    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 canSAR2085743.