canSAR1533433
FEATURES
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NAMES
    SMILES
    O=C1CCCN1CCCNc1nc2c(S(=O)(=O)c3ccccc3)nnn2c2ccc(Cl)cc12
    InChI
    InChI=1S/C22H21ClN6O3S/c23-15-9-10-18-17(14-15)20(24-11-5-13-28-12-4-8-19(28)30)25-21-22(26-27-29(18)21)33(31,32)16-6-2-1-3-7-16/h1-3,6-7,9-10,14H,4-5,8,11-13H2,(H,24,25)
    MOLECULAR FORMULA
    C22H21ClN6O3S
    CROSS REFERENCES
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    canSAR1533433
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight484.11
    AlogP3.19
    HBond donors1
    HBond acceptors9
    Atoms54
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1533433.