canSAR1809402
FEATURES
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NAMES
    SMILES
    CC1CN(S(=O)(=O)c2ccc(C(=O)Nc3nnc(-c4ccc5c(c4)CCCC5)o3)cc2)CC(C)O1
    InChI
    InChI=1S/C25H28N4O5S/c1-16-14-29(15-17(2)33-16)35(31,32)22-11-9-19(10-12-22)23(30)26-25-28-27-24(34-25)21-8-7-18-5-3-4-6-20(18)13-21/h7-13,16-17H,3-6,14-15H2,1-2H3,(H,26,28,30)
    MOLECULAR FORMULA
    C25H28N4O5S
    CROSS REFERENCES
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    canSAR1809402
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight496.18
    AlogP3.67
    HBond donors1
    HBond acceptors9
    Atoms63
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1809402.