1986004 logo
canSAR1986004
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC(=N)C(C#N)=C(O)CSc1nc(C2CCCCC2)n(-c2ccccc2)n1
    InChI
    InChI=1S/C20H23N5OS/c1-14(22)17(12-21)18(26)13-27-20-23-19(15-8-4-2-5-9-15)25(24-20)16-10-6-3-7-11-16/h3,6-7,10-11,15,22,26H,2,4-5,8-9,13H2,1H3
    MOLECULAR FORMULA
    C20H23N5OS
    CROSS REFERENCES
    1986004 logo

    canSAR1986004

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 381.16
    AlogP 4.78
    HBond donors 2
    HBond acceptors 6
    Atoms 50
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1986004.