1447172 logo
canSAR1447172
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCc1nn(CC(=O)NCCc2ccc(S(N)(=O)=O)cc2)c(=O)c2cc3sccc3n12
    InChI
    InChI=1S/C20H21N5O4S2/c1-2-18-23-24(20(27)16-11-17-15(25(16)18)8-10-30-17)12-19(26)22-9-7-13-3-5-14(6-4-13)31(21,28)29/h3-6,8,10-11H,2,7,9,12H2,1H3,(H,22,26)(H2,21,28,29)
    MOLECULAR FORMULA
    C20H21N5O4S2
    CROSS REFERENCES
    1447172 logo

    canSAR1447172

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 459.10
    AlogP 1.28
    HBond donors 3
    HBond acceptors 9
    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 canSAR1447172.