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canSAR1155103
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NAMES
    SMILES
    S=C1NNC2(N1)C1CCCC2C(c2ccccc2)NC1c1ccccc1
    InChI
    InChI=1S/C21H24N4S/c26-20-23-21(25-24-20)16-12-7-13-17(21)19(15-10-5-2-6-11-15)22-18(16)14-8-3-1-4-9-14/h1-6,8-11,16-19,22,25H,7,12-13H2,(H2,23,24,26)
    MOLECULAR FORMULA
    C21H24N4S
    CROSS REFERENCES
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    canSAR1155103

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 364.17
    AlogP 3.17
    HBond donors 4
    HBond acceptors 4
    Atoms 50
    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 canSAR1155103.