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canSAR2203986
FEATURES
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NAMES
    SMILES
    CCN(CC)c1ccc2c(-c3ccc(NC(=S)NCCCCCn4cc(-c5ccc(C(=O)N[C@@H]6CC[C@@]7(O)[C@H]8Cc9ccc(O)c%10c9[C@@]7(CCN8CC7CC7)[C@H]6O%10)cn5)nn4)cc3C(=O)O)c3ccc(=[N+](CC)CC)cc-3oc2c1
    InChI
    MOLECULAR FORMULA
    C62H71N10O7S+
    CROSS REFERENCES
    2203986 logo

    canSAR2203986

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 1099.52
    AlogP 8.44
    HBond donors 6
    HBond acceptors 17
    Atoms 151
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2203986.