canSAR2058975
FEATURES
Loading...
NAMES
    SMILES
    Clc1ccc2[nH]cc([C@@H]3CCC[C@@H](c4c[nH]c5ccc(Cl)cc45)c4c3[nH]c3ccc(Cl)cc43)c2c1
    InChI
    InChI=1S/C29H22Cl3N3/c30-15-4-7-25-20(10-15)23(13-33-25)18-2-1-3-19(24-14-34-26-8-5-16(31)11-21(24)26)29-28(18)22-12-17(32)6-9-27(22)35-29/h4-14,18-19,33-35H,1-3H2/t18-,19-/m0/s1
    MOLECULAR FORMULA
    C29H22Cl3N3
    CROSS REFERENCES
    Loading...
    canSAR2058975
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight517.09
    AlogP9.54
    HBond donors3
    HBond acceptors3
    Atoms57
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2058975.