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canSAR1955491
FEATURES
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NAMES
    SMILES
    O=C(COC(=O)c1oc2ccccc2c1CSc1ccc(Cl)cc1)NC1CCCC1
    InChI
    InChI=1S/C23H22ClNO4S/c24-15-9-11-17(12-10-15)30-14-19-18-7-3-4-8-20(18)29-22(19)23(27)28-13-21(26)25-16-5-1-2-6-16/h3-4,7-12,16H,1-2,5-6,13-14H2,(H,25,26)
    MOLECULAR FORMULA
    C23H22ClNO4S
    CROSS REFERENCES
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    canSAR1955491

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 443.10
    AlogP 5.59
    HBond donors 1
    HBond acceptors 5
    Atoms 52
    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 canSAR1955491.