canSAR855953
FEATURES
Loading...
NAMES
    SMILES
    C[C@@]12C[C@@H]3C[C@@H](CC(CC(=O)OCCCN4CCN(c5cccc(C(F)(F)F)c5)CC4)(C3)C1)C2.Cl
    InChI
    InChI=1S/C27H37F3N2O2.ClH/c1-25-14-20-12-21(15-25)17-26(16-20,19-25)18-24(33)34-11-3-6-31-7-9-32(10-8-31)23-5-2-4-22(13-23)27(28,29)30;/h2,4-5,13,20-21H,3,6-12,14-19H2,1H3;1H/t20-,21+,25-,26?;
    MOLECULAR FORMULA
    C27H38ClF3N2O2
    CROSS REFERENCES
    Loading...
    canSAR855953
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight514.26
    AlogP6.18
    HBond donors0
    HBond acceptors4
    Atoms73
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR855953.