1649694 logo
canSAR1649694
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCc1ccc(Nc2nnc(SCC(=O)Nc3ccc(C(=O)O)cc3)s2)cc1
    InChI
    InChI=1S/C19H18N4O3S2/c1-2-12-3-7-15(8-4-12)21-18-22-23-19(28-18)27-11-16(24)20-14-9-5-13(6-10-14)17(25)26/h3-10H,2,11H2,1H3,(H,20,24)(H,21,22)(H,25,26)
    MOLECULAR FORMULA
    C19H18N4O3S2
    CROSS REFERENCES
    1649694 logo

    canSAR1649694

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 414.08
    AlogP 4.27
    HBond donors 3
    HBond acceptors 7
    Atoms 46
    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 canSAR1649694.