2019758 logo
canSAR2019758
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Cn1ccc(COc2cc(F)c3nc([C@@H]4CCCC[C@@H]4C(=O)O)n(Cc4ccc(Br)cc4F)c3c2)n1
    InChI
    InChI=1S/C26H25BrF2N4O3/c1-32-9-8-17(31-32)14-36-18-11-22(29)24-23(12-18)33(13-15-6-7-16(27)10-21(15)28)25(30-24)19-4-2-3-5-20(19)26(34)35/h6-12,19-20H,2-5,13-14H2,1H3,(H,34,35)/t19-,20+/m1/s1
    MOLECULAR FORMULA
    C26H25BrF2N4O3
    CROSS REFERENCES
    2019758 logo

    canSAR2019758

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 558.11
    AlogP 5.80
    HBond donors 1
    HBond acceptors 7
    Atoms 61
    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 canSAR2019758.