canSAR1387013
FEATURES
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NAMES
    SMILES
    COC(=O)c1cccc2c3nc(N4CCC[C@@H](N)C4)n(Cc4ccccc4Cl)c3c(=O)n(C)c12
    InChI
    InChI=1S/C25H26ClN5O3/c1-29-21-17(9-5-10-18(21)24(33)34-2)20-22(23(29)32)31(13-15-7-3-4-11-19(15)26)25(28-20)30-12-6-8-16(27)14-30/h3-5,7,9-11,16H,6,8,12-14,27H2,1-2H3/t16-/m1/s1
    MOLECULAR FORMULA
    C25H26ClN5O3
    CROSS REFERENCES
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    canSAR1387013
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight479.17
    AlogP3.30
    HBond donors2
    HBond acceptors8
    Atoms60
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1387013.