canSAR1417679
FEATURES
Loading...
NAMES
    SMILES
    O=[N+]([O-])c1cccc(-c2csc(N/N=C3\NC/C(=C/c4ccc5c(c4)OCO5)S3)n2)c1
    InChI
    InChI=1S/C20H15N5O4S2/c26-25(27)14-3-1-2-13(8-14)16-10-30-20(22-16)24-23-19-21-9-15(31-19)6-12-4-5-17-18(7-12)29-11-28-17/h1-8,10H,9,11H2,(H,21,23)(H,22,24)/b15-6-
    MOLECULAR FORMULA
    C20H15N5O4S2
    CROSS REFERENCES
    Loading...
    canSAR1417679
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight453.06
    AlogP4.51
    HBond donors2
    HBond acceptors9
    Atoms46
    Contains toxicophoreYes
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1417679.