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canSAR1489324
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NAMES
    SMILES
    CCc1cc(C2CCC2)c(-c2nnc(COC)[nH]2)cc1C(=O)N1CCC(F)(c2ccc(C#N)cc2)CC1
    InChI
    InChI=1S/C29H32FN5O2/c1-3-20-15-23(21-5-4-6-21)25(27-32-26(18-37-2)33-34-27)16-24(20)28(36)35-13-11-29(30,12-14-35)22-9-7-19(17-31)8-10-22/h7-10,15-16,21H,3-6,11-14,18H2,1-2H3,(H,32,33,34)
    MOLECULAR FORMULA
    C29H32FN5O2
    CROSS REFERENCES
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    canSAR1489324

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 501.25
    AlogP 5.42
    HBond donors 1
    HBond acceptors 7
    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 canSAR1489324.