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canSAR1502009
FEATURES
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NAMES
    SMILES
    CN(CC1CCCCC1)c1c(C#N)cnc2ccc(C#CCNC(=O)c3cccn(Cc4ccc(F)c(F)c4)c3=O)cc12
    InChI
    InChI=1S/C34H31F2N5O2/c1-40(21-24-7-3-2-4-8-24)32-26(19-37)20-39-31-14-12-23(17-28(31)32)9-5-15-38-33(42)27-10-6-16-41(34(27)43)22-25-11-13-29(35)30(36)18-25/h6,10-14,16-18,20,24H,2-4,7-8,15,21-22H2,1H3,(H,38,42)
    MOLECULAR FORMULA
    C34H31F2N5O2
    CROSS REFERENCES
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    canSAR1502009

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 579.24
    AlogP 5.39
    HBond donors 1
    HBond acceptors 7
    Atoms 74
    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 canSAR1502009.