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canSAR1971957
FEATURES
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NAMES
    SMILES
    CS(=O)(=O)c1ccc(C2=C(CNC(=O)c3cccnc3)[C@H]3CC[C@@H](C2)N3Cc2ccco2)cc1
    InChI
    InChI=1S/C26H27N3O4S/c1-34(31,32)22-9-6-18(7-10-22)23-14-20-8-11-25(29(20)17-21-5-3-13-33-21)24(23)16-28-26(30)19-4-2-12-27-15-19/h2-7,9-10,12-13,15,20,25H,8,11,14,16-17H2,1H3,(H,28,30)/t20-,25+/m0/s1
    MOLECULAR FORMULA
    C26H27N3O4S
    CROSS REFERENCES
    1971957 logo

    canSAR1971957

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 477.17
    AlogP 3.70
    HBond donors 1
    HBond acceptors 7
    Atoms 61
    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 canSAR1971957.