
 CHEMBL540284

 44 46  0  0  0  0  0  0  0  0999 V2000
    6.8699    2.3703    2.1471 C   0  0  0  0  0
    6.5511    3.3893    1.1322 N   0  0  0  0  0
    7.4857    3.2768   -0.0147 C   0  0  0  0  0
    8.9367    3.6193    0.2796 C   0  0  0  0  0
    9.3134    4.5295    1.2785 C   0  0  0  0  0
   10.6595    4.8351    1.4945 C   0  0  0  0  0
   11.6443    4.2617    0.6931 C   0  0  0  0  0
   11.2846    3.3843   -0.3267 C   0  0  0  0  0
    9.9407    3.0674   -0.5334 C   0  0  0  0  0
    5.1589    3.1664    0.6892 C   0  0  0  0  0
    4.6526    4.2405   -0.2019 C   0  0  0  0  0
    3.8258    4.2084   -1.2995 C   0  0  0  0  0
    3.6631    5.4619   -1.8249 N   0  0  0  0  0
    4.3573    6.2819   -1.0542 C   0  0  0  0  0
    4.9614    5.5690   -0.0431 N   0  0  0  0  0
    4.5131    7.7240   -1.2532 C   0  0  0  0  0
    4.8759    8.5861   -0.2097 C   0  0  0  0  0
    5.0439    9.9572   -0.4324 C   0  0  0  0  0
    4.8228   10.4825   -1.7052 C   0  0  0  0  0
    4.4447    9.6387   -2.7507 C   0  0  0  0  0
    4.2919    8.2700   -2.5246 C   0  0  0  0  0
    5.3967   10.6780    0.6762 O   0  0  0  0  0
    6.0048   11.9408    0.4334 C   0  0  0  0  0
    6.1708    2.4379    2.9890 H   0  0  0  0  0
    7.8662    2.5181    2.5745 H   0  0  0  0  0
    6.8184    1.3531    1.7413 H   0  0  0  0  0
    7.1888    3.9680   -0.8126 H   0  0  0  0  0
    7.4323    2.2626   -0.4334 H   0  0  0  0  0
    8.5584    4.9968    1.9064 H   0  0  0  0  0
   10.9382    5.5251    2.2867 H   0  0  0  0  0
   12.6907    4.5046    0.8578 H   0  0  0  0  0
   12.0491    2.9493   -0.9649 H   0  0  0  0  0
    9.6784    2.3892   -1.3429 H   0  0  0  0  0
    4.4965    3.1467    1.5653 H   0  0  0  0  0
    5.0587    2.1919    0.1929 H   0  0  0  0  0
    3.3494    3.3477   -1.7506 H   0  0  0  0  0
    5.5944    5.9364    0.6529 H   0  0  0  0  0
    5.0273    8.2097    0.7977 H   0  0  0  0  0
    4.9157   11.5435   -1.9104 H   0  0  0  0  0
    4.2644   10.0452   -3.7426 H   0  0  0  0  0
    3.9976    7.6209   -3.3482 H   0  0  0  0  0
    6.3398   12.3388    1.3958 H   0  0  0  0  0
    5.2889   12.6535    0.0131 H   0  0  0  0  0
    6.8846   11.8369   -0.2105 H   0  0  0  0  0
  1  2  1  0  0  0
  1 24  1  0  0  0
  1 25  1  0  0  0
  1 26  1  0  0  0
  2 10  1  0  0  0
  2  3  1  0  0  0
  3  4  1  0  0  0
  3 27  1  0  0  0
  3 28  1  0  0  0
  4  5  2  0  0  0
  4  9  1  0  0  0
  5  6  1  0  0  0
  5 29  1  0  0  0
  6  7  2  0  0  0
  6 30  1  0  0  0
  7  8  1  0  0  0
  7 31  1  0  0  0
  8  9  2  0  0  0
  8 32  1  0  0  0
  9 33  1  0  0  0
 10 11  1  0  0  0
 10 34  1  0  0  0
 10 35  1  0  0  0
 11 12  2  0  0  0
 11 15  1  0  0  0
 12 13  1  0  0  0
 12 36  1  0  0  0
 13 14  2  0  0  0
 14 15  1  0  0  0
 14 16  1  0  0  0
 15 37  1  0  0  0
 16 17  2  0  0  0
 16 21  1  0  0  0
 17 18  1  0  0  0
 17 38  1  0  0  0
 18 19  2  0  0  0
 18 22  1  0  0  0
 19 20  1  0  0  0
 19 39  1  0  0  0
 20 21  2  0  0  0
 20 40  1  0  0  0
 21 41  1  0  0  0
 22 23  1  0  0  0
 23 42  1  0  0  0
 23 43  1  0  0  0
 23 44  1  0  0  0
M  END

>  <Chemical Name>
CHEMBL540284

>  <PubChem CID>
11722757

>  <Formula>
C19H21N3O

>  <Molecular Weight>
307.397000

>  <IUPAC Name>
N-[[2-(3-methoxyphenyl)-1H-imidazol-5-yl]methyl]-N-methyl-1-phenylmethanamine

>  <XlogP>
3.1

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
3

>  <Canonical SMILES>
CN(CC1=CC=CC=C1)CC2=CN=C(N2)C3=CC(=CC=C3)OC

>  <Isomeric SMILES>
CN(CC1=CC=CC=C1)CC2=CN=C(N2)C3=CC(=CC=C3)OC

>  <InChI Std. ID>
InChI=1S/C19H21N3O/c1-22(13-15-7-4-3-5-8-15)14-17-12-20-19(21-17)16-9-6-10-18(11-16)23-2/h3-12H,13-14H2,1-2H3,(H,20,21)

>  <InChI Key>
YBYXRZKQSJMQPW-UHFFFAOYSA-N

