canSAR2065872
FEATURES
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NAMES
    SMILES
    CCN(CC)CCNC(=O)c1c(C)[nH]c(/C=C2\C(=O)Nc3ccc(-c4cccnc4)cc32)c1C
    InChI
    InChI=1S/C27H31N5O2/c1-5-32(6-2)13-12-29-27(34)25-17(3)24(30-18(25)4)15-22-21-14-19(20-8-7-11-28-16-20)9-10-23(21)31-26(22)33/h7-11,14-16,30H,5-6,12-13H2,1-4H3,(H,29,34)(H,31,33)/b22-15-
    MOLECULAR FORMULA
    C27H31N5O2
    CROSS REFERENCES
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    canSAR2065872
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight457.25
    AlogP4.26
    HBond donors3
    HBond acceptors7
    Atoms65
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2065872.