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canSAR1648392
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NAMES
    SMILES
    O=C(CSc1nc(N2CCCCC2)nc(N2CCCCC2)n1)NC1CCCCC1
    InChI
    InChI=1S/C21H34N6OS/c28-18(22-17-10-4-1-5-11-17)16-29-21-24-19(26-12-6-2-7-13-26)23-20(25-21)27-14-8-3-9-15-27/h17H,1-16H2,(H,22,28)
    MOLECULAR FORMULA
    C21H34N6OS
    CROSS REFERENCES
    1648392 logo

    canSAR1648392

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 418.25
    AlogP 3.39
    HBond donors 1
    HBond acceptors 7
    Atoms 63
    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 canSAR1648392.