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canSAR843220
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NAMES
    SMILES
    COC(=O)C1C2CC[C@H](C[C@@H]1c1cccc(I)c1)N2C
    InChI
    InChI=1S/C16H20INO2/c1-18-12-6-7-14(18)15(16(19)20-2)13(9-12)10-4-3-5-11(17)8-10/h3-5,8,12-15H,6-7,9H2,1-2H3/t12-,13-,14?,15?/m1/s1
    MOLECULAR FORMULA
    C16H20INO2
    CROSS REFERENCES
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    canSAR843220

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 385.05
    AlogP 3.03
    HBond donors 0
    HBond acceptors 3
    Atoms 40
    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 canSAR843220.