canSAR1503379
FEATURES
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NAMES
    SMILES
    CC(C)C[C@H]1CN([C@@H](CC(C)C)CN2CCCC2CN2C(=S)NC[C@@H]2Cc2ccc(O)cc2)C(=S)N1CC1CCCCCC1
    InChI
    InChI=1S/C36H59N5OS2/c1-26(2)18-32(41-25-33(19-27(3)4)40(36(41)44)22-29-10-7-5-6-8-11-29)23-38-17-9-12-30(38)24-39-31(21-37-35(39)43)20-28-13-15-34(42)16-14-28/h13-16,26-27,29-33,42H,5-12,17-25H2,1-4H3,(H,37,43)/t30?,31-,32-,33-/m0/s1
    MOLECULAR FORMULA
    C36H59N5OS2
    CROSS REFERENCES
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    canSAR1503379
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight641.42
    AlogP6.66
    HBond donors2
    HBond acceptors6
    Atoms103
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1503379.