1769278 logo
canSAR1769278
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=C(Nc1nnc(SCC(=O)N2CCCc3ccccc32)s1)c1ccccc1
    InChI
    InChI=1S/C20H18N4O2S2/c25-17(24-12-6-10-14-7-4-5-11-16(14)24)13-27-20-23-22-19(28-20)21-18(26)15-8-2-1-3-9-15/h1-5,7-9,11H,6,10,12-13H2,(H,21,22,26)
    MOLECULAR FORMULA
    C20H18N4O2S2
    CROSS REFERENCES
    1769278 logo

    canSAR1769278

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 410.09
    AlogP 3.86
    HBond donors 1
    HBond acceptors 6
    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 canSAR1769278.