canSAR1601102
FEATURES
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NAMES
    SMILES
    Cc1ccc(S(=O)(=O)N2CCN(c3ncnc4c3cnn4-c3ccccc3)CC2)cc1
    InChI
    InChI=1S/C22H22N6O2S/c1-17-7-9-19(10-8-17)31(29,30)27-13-11-26(12-14-27)21-20-15-25-28(22(20)24-16-23-21)18-5-3-2-4-6-18/h2-10,15-16H,11-14H2,1H3
    MOLECULAR FORMULA
    C22H22N6O2S
    CROSS REFERENCES
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    canSAR1601102
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight434.15
    AlogP2.63
    HBond donors0
    HBond acceptors8
    Atoms53
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1601102.