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canSAR1126530
FEATURES
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NAMES
    SMILES
    Cc1nc(C(=O)N2CCCC[C@H]2CNC(=O)c2cccc3cccnc23)c(-c2ccc(F)cc2)s1
    InChI
    InChI=1S/C27H25FN4O2S/c1-17-31-24(25(35-17)19-10-12-20(28)13-11-19)27(34)32-15-3-2-8-21(32)16-30-26(33)22-9-4-6-18-7-5-14-29-23(18)22/h4-7,9-14,21H,2-3,8,15-16H2,1H3,(H,30,33)/t21-/m0/s1
    MOLECULAR FORMULA
    C27H25FN4O2S
    CROSS REFERENCES
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    canSAR1126530

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 488.17
    AlogP 5.23
    HBond donors 1
    HBond acceptors 6
    Atoms 60
    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 canSAR1126530.