canSAR1586436
FEATURES
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NAMES
    SMILES
    CCOc1ccc(CCNC(=O)c2cnc3sc(N4CCC(C)CC4)nn3c2=O)cc1
    InChI
    InChI=1S/C22H27N5O3S/c1-3-30-17-6-4-16(5-7-17)8-11-23-19(28)18-14-24-21-27(20(18)29)25-22(31-21)26-12-9-15(2)10-13-26/h4-7,14-15H,3,8-13H2,1-2H3,(H,23,28)
    MOLECULAR FORMULA
    C22H27N5O3S
    CROSS REFERENCES
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    canSAR1586436
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight441.18
    AlogP2.76
    HBond donors1
    HBond acceptors8
    Atoms58
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1586436.