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canSAR2001237
FEATURES
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NAMES
    SMILES
    COCCNC(=O)c1sc2ncnc(NCCc3ccc(OC)cc3)c2c1C
    InChI
    InChI=1S/C20H24N4O3S/c1-13-16-18(21-9-8-14-4-6-15(27-3)7-5-14)23-12-24-20(16)28-17(13)19(25)22-10-11-26-2/h4-7,12H,8-11H2,1-3H3,(H,22,25)(H,21,23,24)
    MOLECULAR FORMULA
    C20H24N4O3S
    CROSS REFERENCES
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    canSAR2001237

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 400.16
    AlogP 3.04
    HBond donors 2
    HBond acceptors 7
    Atoms 52
    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 canSAR2001237.