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canSAR987106
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NAMES
    SMILES
    CC(=O)N[C@@H](CSC/C=C(/C)CC/C=C(/C)CCC=C(C)C)C(=O)O
    InChI
    InChI=1S/C20H33NO3S/c1-15(2)8-6-9-16(3)10-7-11-17(4)12-13-25-14-19(20(23)24)21-18(5)22/h8,10,12,19H,6-7,9,11,13-14H2,1-5H3,(H,21,22)(H,23,24)/b16-10-,17-12-/t19-/m0/s1
    MOLECULAR FORMULA
    C20H33NO3S
    CROSS REFERENCES
    987106 logo

    canSAR987106

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 367.22
    AlogP 4.73
    HBond donors 2
    HBond acceptors 4
    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 canSAR987106.