canSAR1531376
FEATURES
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NAMES
    SMILES
    O=C(NNC(=O)c1ccc(Oc2ccc(C3SCCS3)cc2)o1)c1ccc(Cl)cc1
    InChI
    InChI=1S/C21H17ClN2O4S2/c22-15-5-1-13(2-6-15)19(25)23-24-20(26)17-9-10-18(28-17)27-16-7-3-14(4-8-16)21-29-11-12-30-21/h1-10,21H,11-12H2,(H,23,25)(H,24,26)
    MOLECULAR FORMULA
    C21H17ClN2O4S2
    CROSS REFERENCES
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    canSAR1531376
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight460.03
    AlogP5.28
    HBond donors2
    HBond acceptors6
    Atoms47
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1531376.