1104427 logo
canSAR1104427
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COC(=O)CSc1c(-c2ccc3ccccc3c2)nc2ccccc2c1-c1ccccc1
    InChI
    InChI=1S/C28H21NO2S/c1-31-25(30)18-32-28-26(20-10-3-2-4-11-20)23-13-7-8-14-24(23)29-27(28)22-16-15-19-9-5-6-12-21(19)17-22/h2-17H,18H2,1H3
    MOLECULAR FORMULA
    C28H21NO2S
    CROSS REFERENCES
    1104427 logo

    canSAR1104427

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 435.13
    AlogP 6.99
    HBond donors 0
    HBond acceptors 3
    Atoms 53
    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 canSAR1104427.