748096 logo
canSAR748096
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC(=O)c1ccccc1-c1ccc(-c2ccnc(NC(=O)Nc3cc(C(F)(F)F)cc(C(F)(F)F)c3)n2)cn1.Cl
    InChI
    InChI=1S/C26H17F6N5O2.ClH/c1-14(38)19-4-2-3-5-20(19)22-7-6-15(13-34-22)21-8-9-33-23(36-21)37-24(39)35-18-11-16(25(27,28)29)10-17(12-18)26(30,31)32;/h2-13H,1H3,(H2,33,35,36,37,39);1H
    MOLECULAR FORMULA
    C26H18ClF6N5O2
    CROSS REFERENCES
    748096 logo

    canSAR748096

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 581.11
    AlogP 7.51
    HBond donors 2
    HBond acceptors 7
    Atoms 58
    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 canSAR748096.