646623 logo
canSAR646623
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    C=C=CCCCCOc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2cc1O
    InChI
    InChI=1S/C21H19ClFN3O2/c1-2-3-4-5-6-9-28-20-11-15-18(12-19(20)27)24-13-25-21(15)26-14-7-8-17(23)16(22)10-14/h3,7-8,10-13,27H,1,4-6,9H2,(H,24,25,26)
    MOLECULAR FORMULA
    C21H19ClFN3O2
    CROSS REFERENCES
    646623 logo

    canSAR646623

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 399.11
    AlogP 5.76
    HBond donors 2
    HBond acceptors 5
    Atoms 47
    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 canSAR646623.