canSAR158333
FEATURES
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NAMES
    SMILES
    N=C(N)NCCC(=O)N1CCN(C(=O)[C@H](Cc2cccc(C(=N)N)c2)NS(=O)(=O)c2ccc(-c3ccccc3)cc2)CC1
    InChI
    InChI=1S/C30H36N8O4S/c31-28(32)24-8-4-5-21(19-24)20-26(29(40)38-17-15-37(16-18-38)27(39)13-14-35-30(33)34)36-43(41,42)25-11-9-23(10-12-25)22-6-2-1-3-7-22/h1-12,19,26,36H,13-18,20H2,(H3,31,32)(H4,33,34,35)/t26-/m0/s1
    MOLECULAR FORMULA
    C30H36N8O4S
    CROSS REFERENCES
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    canSAR158333
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight604.26
    AlogP1.07
    HBond donors8
    HBond acceptors12
    Atoms79
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR158333.