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canSAR2207509
FEATURES
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NAMES
    SMILES
    COc1cc(F)c(C(C)C)cc1-c1cnc(N(C)C)nc1CN1C(=O)OC(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C12CCC2
    InChI
    InChI=1S/C31H31F7N4O3/c1-16(2)20-12-21(25(44-5)13-23(20)32)22-14-39-27(41(3)4)40-24(22)15-42-28(43)45-26(29(42)7-6-8-29)17-9-18(30(33,34)35)11-19(10-17)31(36,37)38/h9-14,16,26H,6-8,15H2,1-5H3
    MOLECULAR FORMULA
    C31H31F7N4O3
    CROSS REFERENCES
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    canSAR2207509

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 640.23
    AlogP 8.13
    HBond donors 0
    HBond acceptors 7
    Atoms 76
    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 canSAR2207509.