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canSAR1445350
FEATURES
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NAMES
    SMILES
    C[C@H]1CN([C@@H](C)CO)C(=O)c2cc(NC(=O)Nc3ccc4c(c3)OCO4)ccc2O[C@H]1CN(C)S(=O)(=O)c1ccc(F)cc1
    InChI
    InChI=1S/C30H33FN4O8S/c1-18-14-35(19(2)16-36)29(37)24-12-21(32-30(38)33-22-7-11-26-27(13-22)42-17-41-26)6-10-25(24)43-28(18)15-34(3)44(39,40)23-8-4-20(31)5-9-23/h4-13,18-19,28,36H,14-17H2,1-3H3,(H2,32,33,38)/t18-,19-,28-/m0/s1
    MOLECULAR FORMULA
    C30H33FN4O8S
    CROSS REFERENCES
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    canSAR1445350

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 628.20
    AlogP 3.74
    HBond donors 3
    HBond acceptors 12
    Atoms 77
    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 canSAR1445350.