canSAR2160397
FEATURES
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NAMES
    SMILES
    O=C(NC1CCN(c2ccccn2)CC1)c1nn(-c2ccc(Cl)cc2Cl)c2c1CCC/C2=C\c1ccc(F)cc1
    InChI
    InChI=1S/C31H28Cl2FN5O/c32-22-9-12-27(26(33)19-22)39-30-21(18-20-7-10-23(34)11-8-20)4-3-5-25(30)29(37-39)31(40)36-24-13-16-38(17-14-24)28-6-1-2-15-35-28/h1-2,6-12,15,18-19,24H,3-5,13-14,16-17H2,(H,36,40)/b21-18+
    MOLECULAR FORMULA
    C31H28Cl2FN5O
    CROSS REFERENCES
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    canSAR2160397
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight575.17
    AlogP6.99
    HBond donors1
    HBond acceptors6
    Atoms68
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2160397.