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canSAR787620
FEATURES
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NAMES
    SMILES
    C[C@]12CC[C@@H]3c4cc([N+](=O)[O-])c(=O)ccc4CC[C@H]3[C@@H]1CC[C@@H]2O
    InChI
    InChI=1S/C19H23NO4/c1-19-9-8-12-13(15(19)5-7-18(19)22)4-2-11-3-6-17(21)16(20(23)24)10-14(11)12/h3,6,10,12-13,15,18,22H,2,4-5,7-9H2,1H3/t12-,13+,15-,18-,19-/m0/s1
    MOLECULAR FORMULA
    C19H23NO4
    CROSS REFERENCES
    787620 logo

    canSAR787620

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 329.16
    AlogP 3.17
    HBond donors 1
    HBond acceptors 5
    Atoms 47
    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 canSAR787620.