canSAR540693
FEATURES
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NAMES
    SMILES
    CCN1CCCC1CN(Cc1ccc(-c2ccc(C(F)(F)F)cc2)cc1)C(=O)Cn1c(CCc2cccc(F)c2F)nc(=O)c2ccccc21.O=C(O)[C@H](O)[C@@H](O)C(=O)O
    InChI
    InChI=1S/C39H37F5N4O2.C4H6O6/c1-2-46-22-6-8-31(46)24-47(23-26-12-14-27(15-13-26)28-16-19-30(20-17-28)39(42,43)44)36(49)25-48-34-11-4-3-9-32(34)38(50)45-35(48)21-18-29-7-5-10-33(40)37(29)41;5-1(3(7)8)2(6)4(9)10/h3-5,7,9-17,19-20,31H,2,6,8,18,21-25H2,1H3;1-2,5-6H,(H,7,8)(H,9,10)/t;1-,2-/m.1/s1
    MOLECULAR FORMULA
    C43H43F5N4O8
    CROSS REFERENCES
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    canSAR540693
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight838.30
    AlogP5.54
    HBond donors4
    HBond acceptors12
    Atoms103
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR540693.