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canSAR1026369
FEATURES
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NAMES
    SMILES
    CSC[C@H](O)[C@@H](O)CN(C)Cc1c[nH]c2c(N)ncnc12
    InChI
    InChI=1S/C13H21N5O2S/c1-18(5-9(19)10(20)6-21-2)4-8-3-15-12-11(8)16-7-17-13(12)14/h3,7,9-10,15,19-20H,4-6H2,1-2H3,(H2,14,16,17)/t9-,10-/m0/s1
    MOLECULAR FORMULA
    C13H21N5O2S
    CROSS REFERENCES
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    canSAR1026369

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 311.14
    AlogP 0.06
    HBond donors 5
    HBond acceptors 7
    Atoms 42
    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 canSAR1026369.