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canSAR1065805
FEATURES
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NAMES
    SMILES
    Cc1cn([C@H]2CCCN([C@@H](C)c3ccc(C(=O)O)c(Oc4cccc(Cl)c4)c3)C2)c(=O)[nH]c1=O
    InChI
    InChI=1S/C25H26ClN3O5/c1-15-13-29(25(33)27-23(15)30)19-6-4-10-28(14-19)16(2)17-8-9-21(24(31)32)22(11-17)34-20-7-3-5-18(26)12-20/h3,5,7-9,11-13,16,19H,4,6,10,14H2,1-2H3,(H,31,32)(H,27,30,33)/t16-,19-/m0/s1
    MOLECULAR FORMULA
    C25H26ClN3O5
    CROSS REFERENCES
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    canSAR1065805

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 483.16
    AlogP 4.39
    HBond donors 2
    HBond acceptors 8
    Atoms 60
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1065805.