1590607 logo
canSAR1590607
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Cc1c(N2C(=O)/C(=C\c3ccccc3O)SC2=S)c(=O)n(-c2ccccc2)n1C
    InChI
    InChI=1S/C21H17N3O3S2/c1-13-18(20(27)24(22(13)2)15-9-4-3-5-10-15)23-19(26)17(29-21(23)28)12-14-8-6-7-11-16(14)25/h3-12,25H,1-2H3/b17-12+
    MOLECULAR FORMULA
    C21H17N3O3S2
    CROSS REFERENCES
    1590607 logo

    canSAR1590607

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 423.07
    AlogP 3.60
    HBond donors 1
    HBond acceptors 6
    Atoms 46
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1590607.