canSAR541852
FEATURES
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NAMES
    SMILES
    COc1ccc2nccc([C@H](O)CN3CCC(NCc4cc5cccc6c5n(c4=O)CCC6)CC3)c2c1.O=C(O)C(=O)O
    InChI
    InChI=1S/C30H34N4O3.C2H2O4/c1-37-24-7-8-27-26(17-24)25(9-12-31-27)28(35)19-33-14-10-23(11-15-33)32-18-22-16-21-5-2-4-20-6-3-13-34(29(20)21)30(22)36;3-1(4)2(5)6/h2,4-5,7-9,12,16-17,23,28,32,35H,3,6,10-11,13-15,18-19H2,1H3;(H,3,4)(H,5,6)
    MOLECULAR FORMULA
    C32H36N4O7
    CROSS REFERENCES
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    canSAR541852
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight588.26
    AlogP2.95
    HBond donors4
    HBond acceptors11
    Atoms79
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR541852.