502239 logo
canSAR502239
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    C[C@H]1CN(Cc2ccccc2)[C@H](C)CN1[C@@H](c1cccc(F)c1)c1ccc2c(c1)CN(CCC(=O)O)CC2
    InChI
    InChI=1S/C32H38FN3O2/c1-23-20-36(24(2)19-35(23)21-25-7-4-3-5-8-25)32(27-9-6-10-30(33)18-27)28-12-11-26-13-15-34(16-14-31(37)38)22-29(26)17-28/h3-12,17-18,23-24,32H,13-16,19-22H2,1-2H3,(H,37,38)/t23-,24+,32+/m1/s1
    MOLECULAR FORMULA
    C32H38FN3O2
    CROSS REFERENCES
    502239 logo

    canSAR502239

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 515.29
    AlogP 5.34
    HBond donors 1
    HBond acceptors 5
    Atoms 76
    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 canSAR502239.