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canSAR1991664
FEATURES
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NAMES
    SMILES
    O=C(CSc1nnc(Cn2c(=O)sc3ccccc32)n1-c1ccccc1)NCC1CCCO1
    InChI
    InChI=1S/C23H23N5O3S2/c29-21(24-13-17-9-6-12-31-17)15-32-22-26-25-20(28(22)16-7-2-1-3-8-16)14-27-18-10-4-5-11-19(18)33-23(27)30/h1-5,7-8,10-11,17H,6,9,12-15H2,(H,24,29)
    MOLECULAR FORMULA
    C23H23N5O3S2
    CROSS REFERENCES
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    canSAR1991664

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 481.12
    AlogP 3.08
    HBond donors 1
    HBond acceptors 8
    Atoms 56
    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 canSAR1991664.