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canSAR2004215
FEATURES
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NAMES
    SMILES
    C=CCn1c(COc2cccc3ccc(C)nc23)nnc1SCC(=O)O
    InChI
    InChI=1S/C18H18N4O3S/c1-3-9-22-15(20-21-18(22)26-11-16(23)24)10-25-14-6-4-5-13-8-7-12(2)19-17(13)14/h3-8H,1,9-11H2,2H3,(H,23,24)
    MOLECULAR FORMULA
    C18H18N4O3S
    CROSS REFERENCES
    2004215 logo

    canSAR2004215

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 370.11
    AlogP 3.08
    HBond donors 1
    HBond acceptors 7
    Atoms 44
    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 canSAR2004215.