1443580 logo
canSAR1443580
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COc1ccc(S(=O)(=O)N(C)C[C@H]2Oc3ncc(-c4ccncc4)cc3C(=O)N([C@@H](C)CO)C[C@@H]2C)cc1
    InChI
    InChI=1S/C27H32N4O6S/c1-18-15-31(19(2)17-32)27(33)24-13-21(20-9-11-28-12-10-20)14-29-26(24)37-25(18)16-30(3)38(34,35)23-7-5-22(36-4)6-8-23/h5-14,18-19,25,32H,15-17H2,1-4H3/t18-,19-,25+/m0/s1
    MOLECULAR FORMULA
    C27H32N4O6S
    CROSS REFERENCES
    1443580 logo

    canSAR1443580

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 540.20
    AlogP 2.69
    HBond donors 1
    HBond acceptors 10
    Atoms 70
    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 canSAR1443580.