canSAR225737
FEATURES
Loading...
NAMES
    SMILES
    N#CN/C(=N\Cc1ccc[n+]([O-])c1)N1CCC(=C2c3ccc(Cl)cc3SCc3cccnc32)CC1
    InChI
    InChI=1S/C26H23ClN6OS/c27-21-5-6-22-23(13-21)35-16-20-4-1-9-29-25(20)24(22)19-7-11-32(12-8-19)26(31-17-28)30-14-18-3-2-10-33(34)15-18/h1-6,9-10,13,15H,7-8,11-12,14,16H2,(H,30,31)
    MOLECULAR FORMULA
    C26H23ClN6OS
    CROSS REFERENCES
    Loading...
    canSAR225737
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight502.13
    AlogP4.50
    HBond donors1
    HBond acceptors7
    Atoms58
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR225737.