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canSAR1861176
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NAMES
    SMILES
    CCC1=C[C@@H]2Cc3nc4cc(Cl)ccc4c(NCCCN4CCC(CC5Cc6cc(OC)c(OC)cc6C5)CC4)c3[C@H](C1)C2
    InChI
    InChI=1S/C38H48ClN3O2/c1-4-24-14-27-19-30(16-24)37-34(20-27)41-33-23-31(39)6-7-32(33)38(37)40-10-5-11-42-12-8-25(9-13-42)15-26-17-28-21-35(43-2)36(44-3)22-29(28)18-26/h6-7,14,21-23,25-27,30H,4-5,8-13,15-20H2,1-3H3,(H,40,41)/t27-,30+/m0/s1
    MOLECULAR FORMULA
    C38H48ClN3O2
    CROSS REFERENCES
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    canSAR1861176

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 613.34
    AlogP 8.61
    HBond donors 1
    HBond acceptors 5
    Atoms 92
    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 canSAR1861176.