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canSAR1129007
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NAMES
    SMILES
    N=c1c2c(=S)n(-c3ccccc3)c(=S)n(-c3ccccc3)c2nc(NNc2ccccc2)n1-c1ccccc1
    InChI
    InChI=1S/C30H23N7S2/c31-26-25-27(32-29(34-33-21-13-5-1-6-14-21)35(26)22-15-7-2-8-16-22)36(23-17-9-3-10-18-23)30(39)37(28(25)38)24-19-11-4-12-20-24/h1-20,31,33H,(H,32,34)
    MOLECULAR FORMULA
    C30H23N7S2
    CROSS REFERENCES
    1129007 logo

    canSAR1129007

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 545.15
    AlogP 6.98
    HBond donors 3
    HBond acceptors 7
    Atoms 62
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1129007.