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canSAR1765093
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NAMES
    SMILES
    CC(C)N1CCc2c(sc(NC(=O)C3CCCCC3)c2C(N)=O)C1.Cl
    InChI
    InChI=1S/C18H27N3O2S.ClH/c1-11(2)21-9-8-13-14(10-21)24-18(15(13)16(19)22)20-17(23)12-6-4-3-5-7-12;/h11-12H,3-10H2,1-2H3,(H2,19,22)(H,20,23);1H
    MOLECULAR FORMULA
    C18H28ClN3O2S
    CROSS REFERENCES
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    canSAR1765093

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 385.16
    AlogP 3.55
    HBond donors 3
    HBond acceptors 5
    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 canSAR1765093.