1110329 logo
canSAR1110329
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COc1cc2c(Oc3ccc(NC(=O)c4cc(-c5ccccc5C)ccn4)cc3F)ccnc2cc1OCCCN1CCN(C)CC1
    InChI
    InChI=1S/C37H38FN5O4/c1-25-7-4-5-8-28(25)26-11-13-40-32(21-26)37(44)41-27-9-10-34(30(38)22-27)47-33-12-14-39-31-24-36(35(45-3)23-29(31)33)46-20-6-15-43-18-16-42(2)17-19-43/h4-5,7-14,21-24H,6,15-20H2,1-3H3,(H,41,44)
    MOLECULAR FORMULA
    C37H38FN5O4
    CROSS REFERENCES
    1110329 logo

    canSAR1110329

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 635.29
    AlogP 6.81
    HBond donors 1
    HBond acceptors 9
    Atoms 85
    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 canSAR1110329.