canSAR940593
FEATURES
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NAMES
    SMILES
    COc1cc(NC(C)CCCNC(=O)c2cccc(C(=O)NCCCC(C)Nc3cc(OC)cc4ccc(C(C)(C)C)nc34)n2)c2nc(C(C)(C)C)ccc2c1.Cl
    InChI
    InChI=1S/C45H59N7O4.ClH/c1-28(48-36-26-32(55-9)24-30-18-20-38(44(3,4)5)51-40(30)36)14-12-22-46-42(53)34-16-11-17-35(50-34)43(54)47-23-13-15-29(2)49-37-27-33(56-10)25-31-19-21-39(45(6,7)8)52-41(31)37;/h11,16-21,24-29,48-49H,12-15,22-23H2,1-10H3,(H,46,53)(H,47,54);1H
    MOLECULAR FORMULA
    C45H60ClN7O4
    CROSS REFERENCES
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    canSAR940593
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight797.44
    AlogP9.23
    HBond donors4
    HBond acceptors11
    Atoms117
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR940593.