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canSAR1067191
FEATURES
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NAMES
    SMILES
    CC(=O)NC1CC2CCC(C1)N2CCOc1ccc(Oc2nc3ncccc3s2)cc1
    InChI
    InChI=1S/C23H26N4O3S/c1-15(28)25-16-13-17-4-5-18(14-16)27(17)11-12-29-19-6-8-20(9-7-19)30-23-26-22-21(31-23)3-2-10-24-22/h2-3,6-10,16-18H,4-5,11-14H2,1H3,(H,25,28)
    MOLECULAR FORMULA
    C23H26N4O3S
    CROSS REFERENCES
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    canSAR1067191

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 438.17
    AlogP 3.99
    HBond donors 1
    HBond acceptors 7
    Atoms 57
    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 canSAR1067191.