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canSAR1984016
FEATURES
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NAMES
    SMILES
    CC(C)N1CCc2c(sc(NC(=O)c3ccc(S(=O)(=O)N4CCc5ccccc54)cc3)c2C(N)=O)C1.Cl
    InChI
    InChI=1S/C26H28N4O4S2.ClH/c1-16(2)29-13-12-20-22(15-29)35-26(23(20)24(27)31)28-25(32)18-7-9-19(10-8-18)36(33,34)30-14-11-17-5-3-4-6-21(17)30;/h3-10,16H,11-15H2,1-2H3,(H2,27,31)(H,28,32);1H
    MOLECULAR FORMULA
    C26H29ClN4O4S2
    CROSS REFERENCES
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    canSAR1984016

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 560.13
    AlogP 4.04
    HBond donors 3
    HBond acceptors 8
    Atoms 66
    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 canSAR1984016.