
 CHEMBL59834

 51 54  0  0  0  0  0  0  0  0999 V2000
   -0.2420    2.6440    3.1458 C   0  0  0  0  0
    0.2664    2.3885    1.7272 C   0  0  0  0  0
   -0.8689    2.0739    0.7540 C   0  0  0  0  0
    1.1416    3.4401    1.2400 N   0  0  0  0  0
    0.8322    4.7926    1.0273 C   0  0  0  0  0
   -0.3528    5.4809    1.2077 C   0  0  0  0  0
   -0.3714    6.8442    0.8980 C   0  0  0  0  0
    0.7810    7.4892    0.4200 C   0  0  0  0  0
    1.9725    6.7817    0.2389 C   0  0  0  0  0
    1.9802    5.4320    0.5465 C   0  0  0  0  0
    3.0136    4.4766    0.4283 N   0  0  0  0  0
    2.4889    3.2248    0.8684 C   0  0  0  0  0
    3.0933    2.1582    0.9167 O   0  0  0  0  0
    4.3048    4.7476   -0.0177 C   0  0  0  0  0
    4.7515    5.8753   -0.2199 O   0  0  0  0  0
    5.0726    3.6232   -0.2414 N   0  0  0  0  0
    6.4689    3.6790   -0.6702 C   0  0  0  0  0
    7.4226    3.8924    0.5218 C   0  0  0  0  0
    7.9896    2.5848    1.1040 C   0  0  0  0  0
    6.8909    1.6367    1.5942 C   0  0  0  0  0
    6.5694    0.7613    0.3832 C   0  0  0  0  0
    7.4756    1.2956   -0.7273 C   0  0  0  0  0
    6.8323    2.4470   -1.5221 C   0  0  0  0  0
    8.6301    1.8730   -0.0174 N   0  0  0  0  0
    9.5839    0.8592    0.4285 C   0  0  0  0  0
    0.5928    2.8455    3.8259 H   0  0  0  0  0
   -0.7803    1.7681    3.5239 H   0  0  0  0  0
   -0.9255    3.4951    3.1986 H   0  0  0  0  0
    0.8756    1.4772    1.7858 H   0  0  0  0  0
   -1.5774    2.9014    0.6612 H   0  0  0  0  0
   -1.4292    1.1940    1.0879 H   0  0  0  0  0
   -0.4734    1.8619   -0.2455 H   0  0  0  0  0
   -1.2548    5.0033    1.5673 H   0  0  0  0  0
   -1.2898    7.4140    1.0244 H   0  0  0  0  0
    0.7456    8.5505    0.1821 H   0  0  0  0  0
    2.8515    7.2924   -0.1399 H   0  0  0  0  0
    4.6993    2.7480    0.1153 H   0  0  0  0  0
    6.5416    4.5627   -1.3174 H   0  0  0  0  0
    6.9354    4.4727    1.3148 H   0  0  0  0  0
    8.2699    4.4998    0.1734 H   0  0  0  0  0
    8.6964    2.8344    1.9038 H   0  0  0  0  0
    7.2638    1.0047    2.4090 H   0  0  0  0  0
    6.0097    2.1644    1.9714 H   0  0  0  0  0
    6.8210   -0.2811    0.6140 H   0  0  0  0  0
    5.5090    0.7803    0.1181 H   0  0  0  0  0
    7.7637    0.5043   -1.4291 H   0  0  0  0  0
    7.5539    2.7678   -2.2868 H   0  0  0  0  0
    5.9528    2.0807   -2.0662 H   0  0  0  0  0
   10.4191    1.3361    0.9530 H   0  0  0  0  0
   10.0116    0.3406   -0.4366 H   0  0  0  0  0
    9.1528    0.1055    1.0954 H   0  0  0  0  0
  1  2  1  0  0  0
  1 26  1  0  0  0
  1 27  1  0  0  0
  1 28  1  0  0  0
  2  4  1  0  0  0
  2  3  1  0  0  0
  2 29  1  0  0  0
  3 30  1  0  0  0
  3 31  1  0  0  0
  3 32  1  0  0  0
  4 12  1  0  0  0
  4  5  1  0  0  0
  5 10  1  0  0  0
  5  6  2  0  0  0
  6  7  1  0  0  0
  6 33  1  0  0  0
  7  8  2  0  0  0
  7 34  1  0  0  0
  8  9  1  0  0  0
  8 35  1  0  0  0
  9 10  2  0  0  0
  9 36  1  0  0  0
 10 11  1  0  0  0
 11 12  1  0  0  0
 11 14  1  0  0  0
 12 13  2  0  0  0
 14 16  1  0  0  0
 14 15  2  0  0  0
 16 17  1  0  0  0
 16 37  1  0  0  0
 17 23  1  0  0  0
 17 18  1  0  0  0
 17 38  1  0  0  0
 18 19  1  0  0  0
 18 39  1  0  0  0
 18 40  1  0  0  0
 19 20  1  0  0  0
 19 24  1  0  0  0
 19 41  1  0  0  0
 20 21  1  0  0  0
 20 42  1  0  0  0
 20 43  1  0  0  0
 21 22  1  0  0  0
 21 44  1  0  0  0
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 22 23  1  0  0  0
 22 24  1  0  0  0
 22 46  1  0  0  0
 23 47  1  0  0  0
 23 48  1  0  0  0
 24 25  1  0  0  0
 25 49  1  0  0  0
 25 50  1  0  0  0
 25 51  1  0  0  0
M  END

>  <Chemical Name>
CHEMBL59834

>  <PubChem CID>
131725

>  <Formula>
C19H26N4O2

>  <Molecular Weight>
342.443000

>  <IUPAC Name>
N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2-oxo-3-propan-2-ylbenzimidazole-1-carboxamide

>  <XlogP>
2.5

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
3

>  <Canonical SMILES>
CC(C)N1C2=CC=CC=C2N(C1=O)C(=O)NC3CC4CCC(C3)N4C

>  <Isomeric SMILES>
CC(C)N1C2=CC=CC=C2N(C1=O)C(=O)NC3CC4CCC(C3)N4C

>  <InChI Std. ID>
InChI=1S/C19H26N4O2/c1-12(2)22-16-6-4-5-7-17(16)23(19(22)25)18(24)20-13-10-14-8-9-15(11-13)21(14)3/h4-7,12-15H,8-11H2,1-3H3,(H,20,24)

>  <InChI Key>
AFOFVIBWSLOHFR-UHFFFAOYSA-N

