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canSAR986560
FEATURES
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NAMES
    SMILES
    O=c1[nH]c2c(O)ccc([C@@H](O)CNCCCOCCOCCc3cccc4ccccc34)c2s1
    InChI
    InChI=1S/C26H30N2O5S/c29-22-10-9-21(25-24(22)28-26(31)34-25)23(30)17-27-12-4-13-32-15-16-33-14-11-19-7-3-6-18-5-1-2-8-20(18)19/h1-3,5-10,23,27,29-30H,4,11-17H2,(H,28,31)/t23-/m0/s1
    MOLECULAR FORMULA
    C26H30N2O5S
    CROSS REFERENCES
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    canSAR986560

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 482.19
    AlogP 3.74
    HBond donors 4
    HBond acceptors 7
    Atoms 64
    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 canSAR986560.