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canSAR783299
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NAMES
    SMILES
    CN(C)CCCN1CC[C@H]2Cn3c(c(C4CCCCC4)c4ccc(C(=O)O)cc43)-c3ccccc3[C@@H]21
    InChI
    InChI=1S/C31H39N3O2/c1-32(2)16-8-17-33-18-15-23-20-34-27-19-22(31(35)36)13-14-26(27)28(21-9-4-3-5-10-21)30(34)25-12-7-6-11-24(25)29(23)33/h6-7,11-14,19,21,23,29H,3-5,8-10,15-18,20H2,1-2H3,(H,35,36)/t23-,29+/m0/s1
    MOLECULAR FORMULA
    C31H39N3O2
    CROSS REFERENCES
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    canSAR783299

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 485.30
    AlogP 6.38
    HBond donors 1
    HBond acceptors 5
    Atoms 75
    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 canSAR783299.