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canSAR660306
FEATURES
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NAMES
    SMILES
    CCCCN1C(=O)[C@H](CC2CCCCC2)NC(=O)C12CCN(CCc1cccc(Oc3ccc(OC)cc3)c1)CC2.Cl
    InChI
    InChI=1S/C34H47N3O4.ClH/c1-3-4-20-37-32(38)31(25-26-9-6-5-7-10-26)35-33(39)34(37)18-22-36(23-19-34)21-17-27-11-8-12-30(24-27)41-29-15-13-28(40-2)14-16-29;/h8,11-16,24,26,31H,3-7,9-10,17-23,25H2,1-2H3,(H,35,39);1H/t31-;/m0./s1
    MOLECULAR FORMULA
    C34H48ClN3O4
    CROSS REFERENCES
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    canSAR660306

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 597.33
    AlogP 6.38
    HBond donors 1
    HBond acceptors 7
    Atoms 90
    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 canSAR660306.