canSAR1416988
FEATURES
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NAMES
    SMILES
    Cc1cc(OCCCC(=O)NCCN2C(=O)S/C(=C\c3cccnc3)C2=O)ccc1Cl
    InChI
    InChI=1S/C22H22ClN3O4S/c1-15-12-17(6-7-18(15)23)30-11-3-5-20(27)25-9-10-26-21(28)19(31-22(26)29)13-16-4-2-8-24-14-16/h2,4,6-8,12-14H,3,5,9-11H2,1H3,(H,25,27)/b19-13-
    MOLECULAR FORMULA
    C22H22ClN3O4S
    CROSS REFERENCES
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    canSAR1416988
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight459.10
    AlogP4.06
    HBond donors1
    HBond acceptors7
    Atoms53
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1416988.