canSAR740470
FEATURES
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NAMES
    SMILES
    O=C([O-])C[C@@H]1CCN([C@H](CCc2ccccc2)c2ccc(C(F)(F)F)nc2)[C@H](c2ccc(C(F)(F)F)cc2)C1.[Na+]
    InChI
    InChI=1S/C29H28F6N2O2.Na/c30-28(31,32)23-10-7-21(8-11-23)25-16-20(17-27(38)39)14-15-37(25)24(12-6-19-4-2-1-3-5-19)22-9-13-26(36-18-22)29(33,34)35;/h1-5,7-11,13,18,20,24-25H,6,12,14-17H2,(H,38,39);/q;+1/p-1/t20-,24-,25+;/m1./s1
    MOLECULAR FORMULA
    C29H27F6N2NaO2
    CROSS REFERENCES
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    canSAR740470
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight572.19
    AlogP3.39
    HBond donors0
    HBond acceptors4
    Atoms67
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR740470.