
 CHEMBL521862

 40 43  0  0  0  0  0  0  0  0999 V2000
   -0.7319    1.2925   -0.2218 C   0  0  0  0  0
   -1.9446    0.4255   -0.7004 C   0  0  0  0  0
   -1.4255   -0.9069   -0.3879 N   0  0  0  0  0
   -0.0692   -0.8259   -0.1717 C   0  0  0  0  0
    0.4454    0.3762   -0.1008 N   0  0  0  0  0
    0.7833   -2.0337   -0.0461 C   0  0  0  0  0
    2.1703   -1.8987   -0.0308 C   0  0  0  0  0
    2.9320   -3.0447    0.1011 C   0  0  0  0  0
    2.4080   -4.2842    0.2167 N   0  0  0  0  0
    1.0617   -4.3822    0.2112 C   0  0  0  0  0
    0.2113   -3.2983    0.0841 C   0  0  0  0  0
   -3.1759    0.7569    0.1580 C   0  0  0  0  0
   -3.7004    2.0671    0.1568 C   0  0  0  0  0
   -4.8199    2.3929    0.9262 C   0  0  0  0  0
   -5.4278    1.4139    1.7016 C   0  0  0  0  0
   -4.9391    0.1164    1.7216 C   0  0  0  0  0
   -3.8197   -0.2127    0.9542 C   0  0  0  0  0
   -6.5006    1.7270    2.4378 F   0  0  0  0  0
   -2.2059    0.4605   -2.2226 C   0  0  0  0  0
   -1.1451    0.6127   -3.1416 C   0  0  0  0  0
   -1.3718    0.6018   -4.5211 C   0  0  0  0  0
   -2.6603    0.4280   -5.0030 C   0  0  0  0  0
   -3.7248    0.2530   -4.1318 C   0  0  0  0  0
   -3.4986    0.2573   -2.7519 C   0  0  0  0  0
   -2.8774    0.4159   -6.3244 F   0  0  0  0  0
   -0.8959    1.7275    0.7719 H   0  0  0  0  0
   -0.5004    2.1165   -0.9051 H   0  0  0  0  0
   -1.7403   -1.6367   -1.0157 H   0  0  0  0  0
    2.6464   -0.9277   -0.1137 H   0  0  0  0  0
    4.0172   -2.9960    0.1211 H   0  0  0  0  0
    0.6719   -5.3905    0.3217 H   0  0  0  0  0
   -0.8603   -3.4485    0.1107 H   0  0  0  0  0
   -3.2387    2.8457   -0.4491 H   0  0  0  0  0
   -5.2198    3.4018    0.9266 H   0  0  0  0  0
   -5.4272   -0.6327    2.3382 H   0  0  0  0  0
   -3.4495   -1.2350    0.9950 H   0  0  0  0  0
   -0.1187    0.7268   -2.7952 H   0  0  0  0  0
   -0.5481    0.7206   -5.2185 H   0  0  0  0  0
   -4.7250    0.1086   -4.5290 H   0  0  0  0  0
   -4.3552    0.0993   -2.0986 H   0  0  0  0  0
  1  2  1  0  0  0
  1  5  1  0  0  0
  1 26  1  0  0  0
  1 27  1  0  0  0
  2  3  1  0  0  0
  2 19  1  0  0  0
  2 12  1  0  0  0
  3  4  1  0  0  0
  3 28  1  0  0  0
  4  5  2  0  0  0
  4  6  1  0  0  0
  6  7  2  0  0  0
  6 11  1  0  0  0
  7  8  1  0  0  0
  7 29  1  0  0  0
  8  9  2  0  0  0
  8 30  1  0  0  0
  9 10  1  0  0  0
 10 11  2  0  0  0
 10 31  1  0  0  0
 11 32  1  0  0  0
 12 13  2  0  0  0
 12 17  1  0  0  0
 13 14  1  0  0  0
 13 33  1  0  0  0
 14 15  2  0  0  0
 14 34  1  0  0  0
 15 16  1  0  0  0
 15 18  1  0  0  0
 16 17  2  0  0  0
 16 35  1  0  0  0
 17 36  1  0  0  0
 19 20  2  0  0  0
 19 24  1  0  0  0
 20 21  1  0  0  0
 20 37  1  0  0  0
 21 22  2  0  0  0
 21 38  1  0  0  0
 22 23  1  0  0  0
 22 25  1  0  0  0
 23 24  2  0  0  0
 23 39  1  0  0  0
 24 40  1  0  0  0
M  END

>  <Chemical Name>
CHEMBL521862

>  <PubChem CID>
44573606

>  <Formula>
C20H15F2N3

>  <Molecular Weight>
335.358000

>  <IUPAC Name>
4-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]pyridine

>  <XlogP>
3.0

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
C1C(NC(=N1)C2=CC=NC=C2)(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

>  <Isomeric SMILES>
C1C(NC(=N1)C2=CC=NC=C2)(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

>  <InChI Std. ID>
InChI=1S/C20H15F2N3/c21-17-5-1-15(2-6-17)20(16-3-7-18(22)8-4-16)13-24-19(25-20)14-9-11-23-12-10-14/h1-12H,13H2,(H,24,25)

>  <InChI Key>
BUEYRPFHPSSVCG-UHFFFAOYSA-N

