canSAR823913
FEATURES
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NAMES
    SMILES
    O=C(N[C@@H](Cc1ccc(-c2ccccc2)cc1)C(=O)N1CCC[C@H]1C(=O)c1nc2ccccc2[nH]1)OCC1c2ccccc2-c2ccccc21
    InChI
    InChI=1S/C42H36N4O4/c47-39(40-43-35-17-8-9-18-36(35)44-40)38-19-10-24-46(38)41(48)37(25-27-20-22-29(23-21-27)28-11-2-1-3-12-28)45-42(49)50-26-34-32-15-6-4-13-30(32)31-14-5-7-16-33(31)34/h1-9,11-18,20-23,34,37-38H,10,19,24-26H2,(H,43,44)(H,45,49)/t37-,38-/m0/s1
    MOLECULAR FORMULA
    C42H36N4O4
    CROSS REFERENCES
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    canSAR823913
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight660.27
    AlogP7.55
    HBond donors2
    HBond acceptors8
    Atoms86
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR823913.