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canSAR1523964
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NAMES
    SMILES
    CCc1noc(C)c1-c1cc2[nH]c3ccnc(Cl)c3c2cc1OC
    InChI
    InChI=1S/C18H16ClN3O2/c1-4-12-16(9(2)24-22-12)11-7-14-10(8-15(11)23-3)17-13(21-14)5-6-20-18(17)19/h5-8,21H,4H2,1-3H3
    MOLECULAR FORMULA
    C18H16ClN3O2
    CROSS REFERENCES
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    canSAR1523964

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 341.09
    AlogP 4.90
    HBond donors 1
    HBond acceptors 5
    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 canSAR1523964.