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canSAR1769014
FEATURES
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NAMES
    SMILES
    CO[C@H](C)CC(=O)N[C@H]1CC[C@H](CCN2CCC(c3noc4cc(Cl)ccc34)CC2)CC1
    InChI
    InChI=1S/C25H36ClN3O3/c1-17(31-2)15-24(30)27-21-6-3-18(4-7-21)9-12-29-13-10-19(11-14-29)25-22-8-5-20(26)16-23(22)32-28-25/h5,8,16-19,21H,3-4,6-7,9-15H2,1-2H3,(H,27,30)/t17-,18-,21-/m1/s1
    MOLECULAR FORMULA
    C25H36ClN3O3
    CROSS REFERENCES
    1769014 logo

    canSAR1769014

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 461.24
    AlogP 5.15
    HBond donors 1
    HBond acceptors 6
    Atoms 68
    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 canSAR1769014.