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canSAR835588
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NAMES
    SMILES
    Cc1cccc(-c2[nH]c(C(=O)[C@@H]3CCCN3C(=O)CCc3ccc(-c4ccccc4)cc3)nc2Cl)c1
    InChI
    InChI=1S/C30H28ClN3O2/c1-20-7-5-10-24(19-20)27-29(31)33-30(32-27)28(36)25-11-6-18-34(25)26(35)17-14-21-12-15-23(16-13-21)22-8-3-2-4-9-22/h2-5,7-10,12-13,15-16,19,25H,6,11,14,17-18H2,1H3,(H,32,33)/t25-/m0/s1
    MOLECULAR FORMULA
    C30H28ClN3O2
    CROSS REFERENCES
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    canSAR835588

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 497.19
    AlogP 6.51
    HBond donors 1
    HBond acceptors 5
    Atoms 64
    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 canSAR835588.