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canSAR503812
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NAMES
    SMILES
    O=C(Nc1cc(Br)ccc1C(=O)N1CCCCC1)c1cccc2nsnc12
    InChI
    InChI=1S/C19H17BrN4O2S/c20-12-7-8-13(19(26)24-9-2-1-3-10-24)16(11-12)21-18(25)14-5-4-6-15-17(14)23-27-22-15/h4-8,11H,1-3,9-10H2,(H,21,25)
    MOLECULAR FORMULA
    C19H17BrN4O2S
    CROSS REFERENCES
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    canSAR503812

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 444.03
    AlogP 4.33
    HBond donors 1
    HBond acceptors 6
    Atoms 44
    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 canSAR503812.