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canSAR49854
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NAMES
    SMILES
    O=C(NCc1ccc(Cc2c[nH]cn2)cc1)Nc1cc(Cl)nc(Cl)c1
    InChI
    InChI=1S/C17H15Cl2N5O/c18-15-6-13(7-16(19)24-15)23-17(25)21-8-12-3-1-11(2-4-12)5-14-9-20-10-22-14/h1-4,6-7,9-10H,5,8H2,(H,20,22)(H2,21,23,24,25)
    MOLECULAR FORMULA
    C17H15Cl2N5O
    CROSS REFERENCES
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    canSAR49854

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 375.07
    AlogP 4.02
    HBond donors 3
    HBond acceptors 6
    Atoms 40
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR49854.