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canSAR1061921
FEATURES
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NAMES
    SMILES
    O=C(O)CCCCCNC(=O)CCCCCNC(=O)CCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12
    InChI
    InChI=1S/C21H36N4O5S/c26-17(22-13-6-2-4-11-19(28)29)9-3-1-5-12-23-18(27)10-7-8-16-20-15(14-31-16)24-21(30)25-20/h15-16,20H,1-14H2,(H,22,26)(H,23,27)(H,28,29)(H2,24,25,30)/t15-,16-,20-/m0/s1
    MOLECULAR FORMULA
    C21H36N4O5S
    CROSS REFERENCES
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    canSAR1061921

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 456.24
    AlogP 1.76
    HBond donors 5
    HBond acceptors 9
    Atoms 67
    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 canSAR1061921.