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canSAR835946
FEATURES
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NAMES
    SMILES
    CN1c2ccc(OC(=O)NCC3CCCCC3)cc2[C@]2(C)CCN(CCc3ccccc3)[C@H]12
    InChI
    InChI=1S/C28H37N3O2/c1-28-16-18-31(17-15-21-9-5-3-6-10-21)26(28)30(2)25-14-13-23(19-24(25)28)33-27(32)29-20-22-11-7-4-8-12-22/h3,5-6,9-10,13-14,19,22,26H,4,7-8,11-12,15-18,20H2,1-2H3,(H,29,32)/t26-,28-/m0/s1
    MOLECULAR FORMULA
    C28H37N3O2
    CROSS REFERENCES
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    canSAR835946

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 447.29
    AlogP 5.34
    HBond donors 1
    HBond acceptors 5
    Atoms 70
    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 canSAR835946.