2053222 logo
canSAR2053222
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCc1ccc(Cn2ccnc2CCc2c(Cl)c(O)cc(O)c2C(=O)OC)cc1
    InChI
    InChI=1S/C22H23ClN2O4/c1-3-14-4-6-15(7-5-14)13-25-11-10-24-19(25)9-8-16-20(22(28)29-2)17(26)12-18(27)21(16)23/h4-7,10-12,26-27H,3,8-9,13H2,1-2H3
    MOLECULAR FORMULA
    C22H23ClN2O4
    CROSS REFERENCES
    2053222 logo

    canSAR2053222

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 414.13
    AlogP 4.13
    HBond donors 2
    HBond acceptors 6
    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 canSAR2053222.