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canSAR1156090
FEATURES
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NAMES
    SMILES
    CCC#CCOc1ccc(CCNC(=O)[C@H](CCC)NS(C)(=O)=O)cc1OC
    InChI
    InChI=1S/C20H30N2O5S/c1-5-7-8-14-27-18-11-10-16(15-19(18)26-3)12-13-21-20(23)17(9-6-2)22-28(4,24)25/h10-11,15,17,22H,5-6,9,12-14H2,1-4H3,(H,21,23)/t17-/m0/s1
    MOLECULAR FORMULA
    C20H30N2O5S
    CROSS REFERENCES
    1156090 logo

    canSAR1156090

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 410.19
    AlogP 1.86
    HBond donors 2
    HBond acceptors 7
    Atoms 58
    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 canSAR1156090.