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canSAR650359
FEATURES
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NAMES
    SMILES
    O=C(NC1CCCCC1)c1ccc(Nc2ccc(Cl)cc2)nc1
    InChI
    InChI=1S/C18H20ClN3O/c19-14-7-9-16(10-8-14)21-17-11-6-13(12-20-17)18(23)22-15-4-2-1-3-5-15/h6-12,15H,1-5H2,(H,20,21)(H,22,23)
    MOLECULAR FORMULA
    C18H20ClN3O
    CROSS REFERENCES
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    canSAR650359

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 329.13
    AlogP 4.54
    HBond donors 2
    HBond acceptors 4
    Atoms 43
    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 canSAR650359.