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canSAR829263
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NAMES
    SMILES
    N#Cc1cccc([C@]23CCC(N(CCN4CCC[C@H]4CO)C(=O)Nc4ccc(F)c(Cl)c4)CC2C3)c1
    InChI
    InChI=1S/C28H32ClFN4O2/c29-25-15-22(6-7-26(25)30)32-27(36)34(12-11-33-10-2-5-24(33)18-35)23-8-9-28(16-21(28)14-23)20-4-1-3-19(13-20)17-31/h1,3-4,6-7,13,15,21,23-24,35H,2,5,8-12,14,16,18H2,(H,32,36)/t21?,23?,24-,28+/m0/s1
    MOLECULAR FORMULA
    C28H32ClFN4O2
    CROSS REFERENCES
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    canSAR829263

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 510.22
    AlogP 5.15
    HBond donors 2
    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 canSAR829263.