canSAR2151561
FEATURES
Loading...
NAMES
    SMILES
    Br.CCOc1cc2c(c(F)c1OCC)C(=N)N(CC(=O)c1cc(N3CCN(CC#N)CC3)c(OC)c(C(C)(C)C)c1)C2
    InChI
    InChI=1S/C31H40FN5O4.BrH/c1-7-40-25-17-21-18-37(30(34)26(21)27(32)29(25)41-8-2)19-24(38)20-15-22(31(3,4)5)28(39-6)23(16-20)36-13-11-35(10-9-33)12-14-36;/h15-17,34H,7-8,10-14,18-19H2,1-6H3;1H
    MOLECULAR FORMULA
    C31H41BrFN5O4
    CROSS REFERENCES
    Loading...
    canSAR2151561
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight645.23
    AlogP5.18
    HBond donors1
    HBond acceptors9
    Atoms83
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2151561.