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canSAR1620397
FEATURES
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NAMES
    SMILES
    O=C(COC(=O)CNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1)NC(=O)NCc1ccco1
    InChI
    InChI=1S/C17H15ClN4O8/c18-11-4-10(5-12(6-11)22(27)28)16(25)19-8-15(24)30-9-14(23)21-17(26)20-7-13-2-1-3-29-13/h1-6H,7-9H2,(H,19,25)(H2,20,21,23,26)
    MOLECULAR FORMULA
    C17H15ClN4O8
    CROSS REFERENCES
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    canSAR1620397

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 438.06
    AlogP 1.14
    HBond donors 3
    HBond acceptors 12
    Atoms 45
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1620397.