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canSAR1429400
FEATURES
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NAMES
    SMILES
    COc1cccc2[nH]c3c(N4CC(C)CC(C)C4)ncnc3c12
    InChI
    InChI=1S/C18H22N4O/c1-11-7-12(2)9-22(8-11)18-17-16(19-10-20-18)15-13(21-17)5-4-6-14(15)23-3/h4-6,10-12,21H,7-9H2,1-3H3
    MOLECULAR FORMULA
    C18H22N4O
    CROSS REFERENCES
    1429400 logo

    canSAR1429400

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 310.18
    AlogP 3.60
    HBond donors 1
    HBond acceptors 5
    Atoms 45
    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 canSAR1429400.