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canSAR1507863
FEATURES
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NAMES
    SMILES
    CCNC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1C#CC(C)(C)NS(=O)(=O)c1ccc(C)cc1
    InChI
    InChI=1S/C27H31N3O6S/c1-7-28-26(33)24-19(25(36-29-24)21-14-20(16(2)3)22(31)15-23(21)32)12-13-27(5,6)30-37(34,35)18-10-8-17(4)9-11-18/h8-11,14-16,30-32H,7H2,1-6H3,(H,28,33)
    MOLECULAR FORMULA
    C27H31N3O6S
    CROSS REFERENCES
    1507863 logo

    canSAR1507863

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 525.19
    AlogP 4.04
    HBond donors 4
    HBond acceptors 9
    Atoms 68
    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 canSAR1507863.