843949 logo
canSAR843949
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCOC(=O)C1=C(C)N=c2s/c(=C3\C(=O)N(CC)c4ccccc43)c(=O)n2C1/C=C/c1ccccc1
    InChI
    InChI=1S/C28H25N3O4S/c1-4-30-20-14-10-9-13-19(20)23(25(30)32)24-26(33)31-21(16-15-18-11-7-6-8-12-18)22(27(34)35-5-2)17(3)29-28(31)36-24/h6-16,21H,4-5H2,1-3H3/b16-15+,24-23-
    MOLECULAR FORMULA
    C28H25N3O4S
    CROSS REFERENCES
    843949 logo

    canSAR843949

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 499.16
    AlogP 3.20
    HBond donors 0
    HBond acceptors 7
    Atoms 61
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR843949.