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canSAR1523452
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NAMES
    SMILES
    Cn1cc(-c2cc(F)c3nnc(Sc4ccc5ncc(NC6CC(C)(C)NC(C)(C)C6)cc5c4)n3c2)cn1
    InChI
    InChI=1S/C28H31FN8S/c1-27(2)11-21(12-28(3,4)35-27)32-20-8-17-9-22(6-7-24(17)30-14-20)38-26-34-33-25-23(29)10-18(16-37(25)26)19-13-31-36(5)15-19/h6-10,13-16,21,32,35H,11-12H2,1-5H3
    MOLECULAR FORMULA
    C28H31FN8S
    CROSS REFERENCES
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    canSAR1523452

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 530.24
    AlogP 5.69
    HBond donors 2
    HBond acceptors 8
    Atoms 69
    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 canSAR1523452.