1637432 logo
canSAR1637432
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCn1ccc(Nc2ncc3c(n2)-c2c(nn(C)c2Cc2cccc(Cl)c2)CC3)n1
    InChI
    InChI=1S/C22H22ClN7/c1-3-30-10-9-19(28-30)25-22-24-13-15-7-8-17-20(21(15)26-22)18(29(2)27-17)12-14-5-4-6-16(23)11-14/h4-6,9-11,13H,3,7-8,12H2,1-2H3,(H,24,25,26,28)
    MOLECULAR FORMULA
    C22H22ClN7
    CROSS REFERENCES
    1637432 logo

    canSAR1637432

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 419.16
    AlogP 4.18
    HBond donors 1
    HBond acceptors 7
    Atoms 52
    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 canSAR1637432.