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canSAR1621434
FEATURES
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NAMES
    SMILES
    C=CCn1nnnc1SCC(=O)Nc1cccc(OC)c1
    InChI
    InChI=1S/C13H15N5O2S/c1-3-7-18-13(15-16-17-18)21-9-12(19)14-10-5-4-6-11(8-10)20-2/h3-6,8H,1,7,9H2,2H3,(H,14,19)
    MOLECULAR FORMULA
    C13H15N5O2S
    CROSS REFERENCES
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    canSAR1621434

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 305.09
    AlogP 1.60
    HBond donors 1
    HBond acceptors 7
    Atoms 36
    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 canSAR1621434.