2085158 logo
canSAR2085158
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC1CCc2c(sc3ncnc(Nc4ccc(C(=O)O)cc4)c23)C1
    InChI
    InChI=1S/C18H17N3O2S/c1-10-2-7-13-14(8-10)24-17-15(13)16(19-9-20-17)21-12-5-3-11(4-6-12)18(22)23/h3-6,9-10H,2,7-8H2,1H3,(H,22,23)(H,19,20,21)
    MOLECULAR FORMULA
    C18H17N3O2S
    CROSS REFERENCES
    2085158 logo

    canSAR2085158

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 339.10
    AlogP 4.26
    HBond donors 2
    HBond acceptors 5
    Atoms 41
    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 canSAR2085158.