canSAR1417252
FEATURES
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NAMES
    SMILES
    CC(C)CN(Cc1cc(Cl)c2c(c1)CCCCO2)C(=O)C1CN(Cc2cccc3[nH]ccc23)CCO1
    InChI
    InChI=1S/C29H36ClN3O3/c1-20(2)16-33(17-21-14-22-6-3-4-12-36-28(22)25(30)15-21)29(34)27-19-32(11-13-35-27)18-23-7-5-8-26-24(23)9-10-31-26/h5,7-10,14-15,20,27,31H,3-4,6,11-13,16-19H2,1-2H3
    MOLECULAR FORMULA
    C29H36ClN3O3
    CROSS REFERENCES
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    canSAR1417252
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight509.24
    AlogP5.42
    HBond donors1
    HBond acceptors6
    Atoms72
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1417252.