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canSAR786282
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NAMES
    SMILES
    CN1[C@@H]2CCC[C@@H]1CC(NC(=O)c1cccc3oc(N4CCNCC4)nc13)C2
    InChI
    InChI=1S/C21H29N5O2/c1-25-15-4-2-5-16(25)13-14(12-15)23-20(27)17-6-3-7-18-19(17)24-21(28-18)26-10-8-22-9-11-26/h3,6-7,14-16,22H,2,4-5,8-13H2,1H3,(H,23,27)/t15-,16-/m1/s1
    MOLECULAR FORMULA
    C21H29N5O2
    CROSS REFERENCES
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    canSAR786282

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 383.23
    AlogP 1.98
    HBond donors 2
    HBond acceptors 7
    Atoms 57
    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 canSAR786282.