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canSAR649607
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NAMES
    SMILES
    NC1(C(=O)NCc2ccc(Cl)cc2Cl)CCN(c2ncnc3[nH]ccc23)CC1
    InChI
    InChI=1S/C19H20Cl2N6O/c20-13-2-1-12(15(21)9-13)10-24-18(28)19(22)4-7-27(8-5-19)17-14-3-6-23-16(14)25-11-26-17/h1-3,6,9,11H,4-5,7-8,10,22H2,(H,24,28)(H,23,25,26)
    MOLECULAR FORMULA
    C19H20Cl2N6O
    CROSS REFERENCES
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    canSAR649607

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 418.11
    AlogP 2.88
    HBond donors 4
    HBond acceptors 7
    Atoms 48
    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 canSAR649607.