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canSAR1964194
FEATURES
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NAMES
    SMILES
    C[C@@H]1CN([C@H](C)CO)C(=O)CCCn2nncc2CO[C@H]1CN(C)S(=O)(=O)c1cccs1
    InChI
    InChI=1S/C20H31N5O5S2/c1-15-11-24(16(2)13-26)19(27)6-4-8-25-17(10-21-22-25)14-30-18(15)12-23(3)32(28,29)20-7-5-9-31-20/h5,7,9-10,15-16,18,26H,4,6,8,11-14H2,1-3H3/t15-,16-,18+/m1/s1
    MOLECULAR FORMULA
    C20H31N5O5S2
    CROSS REFERENCES
    1964194 logo

    canSAR1964194

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 485.18
    AlogP 1.18
    HBond donors 1
    HBond acceptors 10
    Atoms 63
    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 canSAR1964194.