1835062 logo
canSAR1835062
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC[C@H](CC(=O)O)n1c(=O)c2ccncc2n(Cc2nsc3cc(C)cc(C)c23)c1=O
    InChI
    InChI=1S/C22H22N4O4S/c1-4-14(9-19(27)28)26-21(29)15-5-6-23-10-17(15)25(22(26)30)11-16-20-13(3)7-12(2)8-18(20)31-24-16/h5-8,10,14H,4,9,11H2,1-3H3,(H,27,28)/t14-/m1/s1
    MOLECULAR FORMULA
    C22H22N4O4S
    CROSS REFERENCES
    1835062 logo

    canSAR1835062

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 438.14
    AlogP 3.26
    HBond donors 1
    HBond acceptors 8
    Atoms 53
    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 canSAR1835062.