canSAR2164066
FEATURES
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NAMES
    SMILES
    C[n+]1ccc(Sc2c(F)c(F)c(-c3c4nc(c(-c5c(F)c(F)c(Sc6cc[n+](C)cc6)c(F)c5F)c5ccc([nH]5)c(-c5c(F)c(F)c(Sc6cc[n+](C)cc6)c(F)c5F)c5nc(c(-c6c(F)c(F)c(Sc7cc[n+](C)cc7)c(F)c6F)c6ccc3[nH]6)C=C5)C=C4)c(F)c2F)cc1.[I-].[I-].[I-].[I-]
    InChI
    InChI=1S/C68H38F16N8S4.4HI/c1-89-21-13-29(14-22-89)93-65-57(77)49(69)45(50(70)58(65)78)41-33-5-7-35(85-33)42(46-51(71)59(79)66(60(80)52(46)72)94-30-15-23-90(2)24-16-30)37-9-11-39(87-37)44(48-55(75)63(83)68(64(84)56(48)76)96-32-19-27-92(4)28-20-32)40-12-10-38(88-40)43(36-8-6-34(41)86-36)47-53(73)61(81)67(62(82)54(47)74)95-31-17-25-91(3)26-18-31;;;;/h5-28,85,88H,1-4H3;4*1H/q+4;;;;/p-4/b41-33+,41-34+,42-35+,42-37+,43-36+,43-38+,44-39+,44-40+;;;;
    MOLECULAR FORMULA
    C68H38F16I4N8S4
    CROSS REFERENCES
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    canSAR2164066
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight1905.80
    AlogP5.47
    HBond donors2
    HBond acceptors8
    Atoms138
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2164066.