canSAR2148627
FEATURES
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NAMES
    SMILES
    COc1cc(C(=O)N2CC(OC)C2)ccc1Nc1cc2c(-c3cnn(C4CCN(C(=O)OC(C)(C)C)CC4)c3)cccc2cn1
    InChI
    InChI=1S/C34H40N6O5/c1-34(2,3)45-33(42)38-13-11-25(12-14-38)40-19-24(18-36-40)27-8-6-7-23-17-35-31(16-28(23)27)37-29-10-9-22(15-30(29)44-5)32(41)39-20-26(21-39)43-4/h6-10,15-19,25-26H,11-14,20-21H2,1-5H3,(H,35,37)
    MOLECULAR FORMULA
    C34H40N6O5
    CROSS REFERENCES
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    canSAR2148627
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight612.31
    AlogP5.89
    HBond donors1
    HBond acceptors11
    Atoms85
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2148627.