1433630 logo
canSAR1433630
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCOC(=O)c1ccc(NC(=O)C(C)Sc2nc(O)c(-c3ccccc3)c(O)n2)cc1
    InChI
    InChI=1S/C22H21N3O5S/c1-3-30-21(29)15-9-11-16(12-10-15)23-18(26)13(2)31-22-24-19(27)17(20(28)25-22)14-7-5-4-6-8-14/h4-13H,3H2,1-2H3,(H,23,26)(H2,24,25,27,28)
    MOLECULAR FORMULA
    C22H21N3O5S
    CROSS REFERENCES
    1433630 logo

    canSAR1433630

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 439.12
    AlogP 3.85
    HBond donors 3
    HBond acceptors 8
    Atoms 52
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1433630.