canSAR1387200
FEATURES
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NAMES
    SMILES
    CC[C@@](O)(C(=O)NC(C)C)c1cc2n(c(=O)c1CN1CCCC1)Cc1cc3ccccc3nc1-2
    InChI
    InChI=1S/C27H32N4O3/c1-4-27(34,26(33)28-17(2)3)21-14-23-24-19(13-18-9-5-6-10-22(18)29-24)15-31(23)25(32)20(21)16-30-11-7-8-12-30/h5-6,9-10,13-14,17,34H,4,7-8,11-12,15-16H2,1-3H3,(H,28,33)/t27-/m0/s1
    MOLECULAR FORMULA
    C27H32N4O3
    CROSS REFERENCES
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    canSAR1387200
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight460.25
    AlogP3.14
    HBond donors2
    HBond acceptors7
    Atoms66
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1387200.