canSAR1808748
FEATURES
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NAMES
    SMILES
    Cn1nc(C(C)(C)C)cc1C(=O)N1CCCC(c2cc(C(=O)NCc3ccccc3)no2)C1
    InChI
    InChI=1S/C25H31N5O3/c1-25(2,3)22-14-20(29(4)27-22)24(32)30-12-8-11-18(16-30)21-13-19(28-33-21)23(31)26-15-17-9-6-5-7-10-17/h5-7,9-10,13-14,18H,8,11-12,15-16H2,1-4H3,(H,26,31)
    MOLECULAR FORMULA
    C25H31N5O3
    CROSS REFERENCES
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    canSAR1808748
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight449.24
    AlogP3.66
    HBond donors1
    HBond acceptors8
    Atoms64
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1808748.