1620119 logo
canSAR1620119
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COc1ccc(S(=O)(=O)Nc2ccc3c(c2)C(=O)N([C@H](C)CO)C[C@H](C)[C@@H](CN(C)S(=O)(=O)c2c(C)noc2C)O3)cc1
    InChI
    InChI=1S/C28H36N4O9S2/c1-17-14-32(18(2)16-33)28(34)24-13-21(30-42(35,36)23-10-8-22(39-6)9-11-23)7-12-25(24)40-26(17)15-31(5)43(37,38)27-19(3)29-41-20(27)4/h7-13,17-18,26,30,33H,14-16H2,1-6H3/t17-,18+,26+/m0/s1
    MOLECULAR FORMULA
    C28H36N4O9S2
    CROSS REFERENCES
    1620119 logo

    canSAR1620119

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 636.19
    AlogP 2.64
    HBond donors 2
    HBond acceptors 13
    Atoms 79
    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 canSAR1620119.