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canSAR1723764
FEATURES
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NAMES
    SMILES
    CC(C)(CC(=O)C(=O)N1[C@H](C(=O)OCCCc2cccnc2)CSC1(C)C)c1ccccc1
    InChI
    InChI=1S/C26H32N2O4S/c1-25(2,20-12-6-5-7-13-20)16-22(29)23(30)28-21(18-33-26(28,3)4)24(31)32-15-9-11-19-10-8-14-27-17-19/h5-8,10,12-14,17,21H,9,11,15-16,18H2,1-4H3/t21-/m0/s1
    MOLECULAR FORMULA
    C26H32N2O4S
    CROSS REFERENCES
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    canSAR1723764

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 468.21
    AlogP 4.17
    HBond donors 0
    HBond acceptors 6
    Atoms 65
    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 canSAR1723764.