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canSAR101689
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NAMES
    SMILES
    CC(=O)NC[C@H]1CN(c2cc(F)c3c(c2)CCCc2cn[nH]c2-3)C(=O)O1
    InChI
    InChI=1S/C18H19FN4O3/c1-10(24)20-8-14-9-23(18(25)26-14)13-5-11-3-2-4-12-7-21-22-17(12)16(11)15(19)6-13/h5-7,14H,2-4,8-9H2,1H3,(H,20,24)(H,21,22)/t14-/m0/s1
    MOLECULAR FORMULA
    C18H19FN4O3
    CROSS REFERENCES
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    canSAR101689

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 358.14
    AlogP 2.17
    HBond donors 2
    HBond acceptors 7
    Atoms 45
    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 canSAR101689.