
 CHEMBL116278

 37 39  0  0  0  0  0  0  0  0999 V2000
   -0.5768   -0.5371   -3.4373 C   0  0  0  0  0
   -0.8621   -0.5333   -2.0731 C   0  0  0  0  0
    0.1770   -0.5460   -1.1409 C   0  0  0  0  0
    1.5133   -0.5599   -1.5659 C   0  0  0  0  0
    1.7877   -0.5553   -2.9422 C   0  0  0  0  0
    0.7472   -0.5491   -3.8717 C   0  0  0  0  0
    2.6419   -0.5625   -0.5582 C   0  0  0  0  0
    3.5161   -1.7691   -0.6159 C   0  0  0  0  0
    4.8703   -1.9431   -0.3766 C   0  0  0  0  0
    5.2175   -3.2703   -0.5418 N   0  0  0  0  0
    4.1255   -3.8815   -0.9154 C   0  0  0  0  0
    3.0654   -3.0226   -0.9603 N   0  0  0  0  0
    3.9901   -5.1718   -1.2363 N   0  0  0  0  0
    5.9068   -0.9449    0.0165 C   0  0  0  0  0
    6.3924   -0.2954   -1.2599 C   0  0  0  0  0
    7.0472   -1.0476   -2.2497 C   0  0  0  0  0
    7.5054   -0.4436   -3.4208 C   0  0  0  0  0
    7.3292    0.9242   -3.6128 C   0  0  0  0  0
    6.6963    1.6880   -2.6337 C   0  0  0  0  0
    6.2317    1.0834   -1.4633 C   0  0  0  0  0
   -1.3864   -0.5241   -4.1623 H   0  0  0  0  0
   -1.8953   -0.5148   -1.7351 H   0  0  0  0  0
   -0.0651   -0.5372   -0.0803 H   0  0  0  0  0
    2.8189   -0.5601   -3.2941 H   0  0  0  0  0
    0.9712   -0.5486   -4.9353 H   0  0  0  0  0
    2.2351   -0.4846    0.4582 H   0  0  0  0  0
    3.2366    0.3454   -0.7162 H   0  0  0  0  0
    2.1311   -3.2609   -1.2547 H   0  0  0  0  0
    3.0983   -5.6448   -1.1683 H   0  0  0  0  0
    4.7849   -5.7628   -1.0107 H   0  0  0  0  0
    6.7461   -1.4260    0.5312 H   0  0  0  0  0
    5.4808   -0.2054    0.7042 H   0  0  0  0  0
    7.1892   -2.1193   -2.1127 H   0  0  0  0  0
    7.9975   -1.0444   -4.1806 H   0  0  0  0  0
    7.6877    1.3946   -4.5241 H   0  0  0  0  0
    6.5657    2.7567   -2.7812 H   0  0  0  0  0
    5.7443    1.6980   -0.7103 H   0  0  0  0  0
  1  2  2  0  0  0
  1  6  1  0  0  0
  1 21  1  0  0  0
  2  3  1  0  0  0
  2 22  1  0  0  0
  3  4  2  0  0  0
  3 23  1  0  0  0
  4  5  1  0  0  0
  4  7  1  0  0  0
  5  6  2  0  0  0
  5 24  1  0  0  0
  6 25  1  0  0  0
  7  8  1  0  0  0
  7 26  1  0  0  0
  7 27  1  0  0  0
  8 12  1  0  0  0
  8  9  2  0  0  0
  9 10  1  0  0  0
  9 14  1  0  0  0
 10 11  2  0  0  0
 11 12  1  0  0  0
 11 13  1  0  0  0
 12 28  1  0  0  0
 13 29  1  0  0  0
 13 30  1  0  0  0
 14 15  1  0  0  0
 14 31  1  0  0  0
 14 32  1  0  0  0
 15 16  2  0  0  0
 15 20  1  0  0  0
 16 17  1  0  0  0
 16 33  1  0  0  0
 17 18  2  0  0  0
 17 34  1  0  0  0
 18 19  1  0  0  0
 18 35  1  0  0  0
 19 20  2  0  0  0
 19 36  1  0  0  0
 20 37  1  0  0  0
M  END

>  <Chemical Name>
CHEMBL116278

>  <PubChem CID>
44341265

>  <Formula>
C17H17N3

>  <Molecular Weight>
263.344000

>  <IUPAC Name>
4,5-dibenzyl-1H-imidazol-2-amine

>  <XlogP>
3.6

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
2

>  <Canonical SMILES>
C1=CC=C(C=C1)CC2=C(N=C(N2)N)CC3=CC=CC=C3

>  <Isomeric SMILES>
C1=CC=C(C=C1)CC2=C(N=C(N2)N)CC3=CC=CC=C3

>  <InChI Std. ID>
InChI=1S/C17H17N3/c18-17-19-15(11-13-7-3-1-4-8-13)16(20-17)12-14-9-5-2-6-10-14/h1-10H,11-12H2,(H3,18,19,20)

>  <InChI Key>
DBKZEJXYOKAKBV-UHFFFAOYSA-N

