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canSAR1687237
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NAMES
    SMILES
    CCN(CC)CCn1c2c(c(SCC(=O)NCc3ccccc3)nc1=O)CCCC2
    InChI
    InChI=1S/C23H32N4O2S/c1-3-26(4-2)14-15-27-20-13-9-8-12-19(20)22(25-23(27)29)30-17-21(28)24-16-18-10-6-5-7-11-18/h5-7,10-11H,3-4,8-9,12-17H2,1-2H3,(H,24,28)
    MOLECULAR FORMULA
    C23H32N4O2S
    CROSS REFERENCES
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    canSAR1687237

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 428.22
    AlogP 2.87
    HBond donors 1
    HBond acceptors 6
    Atoms 62
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1687237.