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canSAR1129729
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NAMES
    SMILES
    Cc1ccc(/N=C/c2c(-c3ccccc3)nc3sc(-c4ccc5c(c4)OCO5)nn23)cc1
    InChI
    InChI=1S/C25H18N4O2S/c1-16-7-10-19(11-8-16)26-14-20-23(17-5-3-2-4-6-17)27-25-29(20)28-24(32-25)18-9-12-21-22(13-18)31-15-30-21/h2-14H,15H2,1H3/b26-14+
    MOLECULAR FORMULA
    C25H18N4O2S
    CROSS REFERENCES
    1129729 logo

    canSAR1129729

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 438.12
    AlogP 5.91
    HBond donors 0
    HBond acceptors 6
    Atoms 50
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1129729.