canSAR2159179
FEATURES
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NAMES
    SMILES
    CCCN(CCC)C(=O)C1=Cc2ccc(C(=O)Nc3cncc(CCc4ccc(OC)cc4)c3)cc2N=C(N)C1
    InChI
    InChI=1S/C32H37N5O3/c1-4-14-37(15-5-2)32(39)26-17-24-10-11-25(18-29(24)36-30(33)19-26)31(38)35-27-16-23(20-34-21-27)7-6-22-8-12-28(40-3)13-9-22/h8-13,16-18,20-21H,4-7,14-15,19H2,1-3H3,(H2,33,36)(H,35,38)
    MOLECULAR FORMULA
    C32H37N5O3
    CROSS REFERENCES
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    canSAR2159179
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight539.29
    AlogP5.55
    HBond donors3
    HBond acceptors8
    Atoms77
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2159179.