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canSAR2087803
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NAMES
    SMILES
    O=C(/C=C/c1cn([C@@H]2C[C@H](C(=O)O)N(CCc3ccccc3)C2)nn1)NO
    InChI
    InChI=1S/C18H21N5O4/c24-17(20-27)7-6-14-11-23(21-19-14)15-10-16(18(25)26)22(12-15)9-8-13-4-2-1-3-5-13/h1-7,11,15-16,27H,8-10,12H2,(H,20,24)(H,25,26)/b7-6+/t15-,16-/m1/s1
    MOLECULAR FORMULA
    C18H21N5O4
    CROSS REFERENCES
    2087803 logo

    canSAR2087803

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 371.16
    AlogP 0.74
    HBond donors 3
    HBond acceptors 9
    Atoms 48
    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 canSAR2087803.