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canSAR1522312
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NAMES
    SMILES
    O=C(CSc1nnc(-c2cc(-c3cccs3)nc3ccccc23)o1)NC1CCCCC1
    InChI
    InChI=1S/C23H22N4O2S2/c28-21(24-15-7-2-1-3-8-15)14-31-23-27-26-22(29-23)17-13-19(20-11-6-12-30-20)25-18-10-5-4-9-16(17)18/h4-6,9-13,15H,1-3,7-8,14H2,(H,24,28)
    MOLECULAR FORMULA
    C23H22N4O2S2
    CROSS REFERENCES
    1522312 logo

    canSAR1522312

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 450.12
    AlogP 5.55
    HBond donors 1
    HBond acceptors 6
    Atoms 53
    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 canSAR1522312.