1122905 logo
canSAR1122905
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COC(=N)c1nc2ccc3ncnc(Nc4ccc(Cl)cc4)c3c2s1
    InChI
    InChI=1S/C17H12ClN5OS/c1-24-15(19)17-23-12-7-6-11-13(14(12)25-17)16(21-8-20-11)22-10-4-2-9(18)3-5-10/h2-8,19H,1H3,(H,20,21,22)
    MOLECULAR FORMULA
    C17H12ClN5OS
    CROSS REFERENCES
    1122905 logo

    canSAR1122905

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 369.05
    AlogP 4.61
    HBond donors 2
    HBond acceptors 6
    Atoms 37
    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 canSAR1122905.