1689877 logo
canSAR1689877
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COc1ccccc1NC(=O)C1=C(C)Nc2nc(SCc3ccccc3)nn2C1c1cccc(O)c1
    InChI
    InChI=1S/C27H25N5O3S/c1-17-23(25(34)29-21-13-6-7-14-22(21)35-2)24(19-11-8-12-20(33)15-19)32-26(28-17)30-27(31-32)36-16-18-9-4-3-5-10-18/h3-15,24,33H,16H2,1-2H3,(H,29,34)(H,28,30,31)
    MOLECULAR FORMULA
    C27H25N5O3S
    CROSS REFERENCES
    1689877 logo

    canSAR1689877

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 499.17
    AlogP 5.21
    HBond donors 3
    HBond acceptors 8
    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 canSAR1689877.