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canSAR1646831
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NAMES
    SMILES
    CC(C)Cc1nnc(NC(=O)CCC(=O)N2CCN(c3ccccn3)CC2)s1
    InChI
    InChI=1S/C19H26N6O2S/c1-14(2)13-17-22-23-19(28-17)21-16(26)6-7-18(27)25-11-9-24(10-12-25)15-5-3-4-8-20-15/h3-5,8,14H,6-7,9-13H2,1-2H3,(H,21,23,26)
    MOLECULAR FORMULA
    C19H26N6O2S
    CROSS REFERENCES
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    canSAR1646831

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 402.18
    AlogP 2.20
    HBond donors 1
    HBond acceptors 8
    Atoms 54
    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 canSAR1646831.