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canSAR1024311
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NAMES
    SMILES
    NC(=O)[C@H]1Cc2c([nH]c3ccccc23)[C@@H](c2ccc3c(c2)OCO3)N1
    InChI
    InChI=1S/C19H17N3O3/c20-19(23)14-8-12-11-3-1-2-4-13(11)21-18(12)17(22-14)10-5-6-15-16(7-10)25-9-24-15/h1-7,14,17,21-22H,8-9H2,(H2,20,23)/t14-,17-/m1/s1
    MOLECULAR FORMULA
    C19H17N3O3
    CROSS REFERENCES
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    canSAR1024311

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 335.13
    AlogP 1.99
    HBond donors 4
    HBond acceptors 6
    Atoms 42
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1024311.