
 CHEMBL11879

 56 59  0  0  0  0  0  0  0  0999 V2000
   -2.1635    1.0076   -3.8024 C   0  0  0  0  0
   -1.7182    2.4457   -4.0071 C   0  0  0  0  0
   -0.2049    2.3533   -4.0338 C   0  0  0  0  0
    0.0580    1.3446   -3.0065 N   0  0  0  0  0
   -0.9566    0.2993   -3.1952 C   0  0  0  0  0
    1.4170    0.7935   -3.0438 C   0  0  0  0  0
    2.5212    1.8430   -2.8213 C   0  0  0  0  0
    3.8933    1.2540   -2.7774 C   0  0  0  0  0
    4.9952    1.5732   -2.0134 C   0  0  0  0  0
    6.0565    0.7604   -2.3163 N   0  0  0  0  0
    5.6310   -0.0403   -3.2691 C   0  0  0  0  0
    4.3279    0.2379   -3.5922 N   0  0  0  0  0
    6.4112   -1.1000   -3.9638 C   0  0  0  0  0
    6.5034   -2.4072   -3.1689 C   0  0  0  0  0
    5.1581   -3.1070   -2.8495 C   0  0  0  0  0
    4.2496   -3.4220   -4.0402 C   0  0  0  0  0
    4.7458   -3.7092   -5.3218 C   0  0  0  0  0
    3.8862   -4.0988   -6.3513 C   0  0  0  0  0
    2.5189   -4.2150   -6.1151 C   0  0  0  0  0
    2.0072   -3.9330   -4.8517 C   0  0  0  0  0
    2.8645   -3.5382   -3.8228 C   0  0  0  0  0
    5.4315   -4.3528   -1.9971 C   0  0  0  0  0
    5.6877   -5.6094   -2.5727 C   0  0  0  0  0
    5.9325   -6.7285   -1.7750 C   0  0  0  0  0
    5.9444   -6.6067   -0.3892 C   0  0  0  0  0
    5.7127   -5.3649    0.1991 C   0  0  0  0  0
    5.4588   -4.2454   -0.5976 C   0  0  0  0  0
   -3.0448    0.9535   -3.1560 H   0  0  0  0  0
   -2.4200    0.5511   -4.7654 H   0  0  0  0  0
   -2.0488    3.0609   -3.1608 H   0  0  0  0  0
   -2.1279    2.8811   -4.9231 H   0  0  0  0  0
    0.1401    2.0278   -5.0229 H   0  0  0  0  0
    0.2496    3.3199   -3.7961 H   0  0  0  0  0
   -0.6207   -0.4884   -3.8817 H   0  0  0  0  0
   -1.2099   -0.1701   -2.2391 H   0  0  0  0  0
    1.5851    0.2839   -4.0020 H   0  0  0  0  0
    1.5057    0.0285   -2.2608 H   0  0  0  0  0
    2.3307    2.3720   -1.8785 H   0  0  0  0  0
    2.5020    2.5941   -3.6202 H   0  0  0  0  0
    5.0802    2.3474   -1.2617 H   0  0  0  0  0
    3.7897   -0.2450   -4.3021 H   0  0  0  0  0
    7.4295   -0.7228   -4.1230 H   0  0  0  0  0
    6.0010   -1.2732   -4.9638 H   0  0  0  0  0
    7.0203   -2.1955   -2.2214 H   0  0  0  0  0
    7.1634   -3.0944   -3.7145 H   0  0  0  0  0
    4.5850   -2.4117   -2.2185 H   0  0  0  0  0
    5.8128   -3.6752   -5.5283 H   0  0  0  0  0
    4.2899   -4.3387   -7.3321 H   0  0  0  0  0
    1.8561   -4.5461   -6.9101 H   0  0  0  0  0
    0.9439   -4.0478   -4.6579 H   0  0  0  0  0
    2.4502   -3.3625   -2.8309 H   0  0  0  0  0
    5.6880   -5.7396   -3.6517 H   0  0  0  0  0
    6.1126   -7.6943   -2.2398 H   0  0  0  0  0
    6.1370   -7.4769    0.2318 H   0  0  0  0  0
    5.7306   -5.2671    1.2813 H   0  0  0  0  0
    5.2854   -3.2846   -0.1170 H   0  0  0  0  0
  1  5  1  0  0  0
  1  2  1  0  0  0
  1 28  1  0  0  0
  1 29  1  0  0  0
  2  3  1  0  0  0
  2 30  1  0  0  0
  2 31  1  0  0  0
  3  4  1  0  0  0
  3 32  1  0  0  0
  3 33  1  0  0  0
  4  5  1  0  0  0
  4  6  1  0  0  0
  5 34  1  0  0  0
  5 35  1  0  0  0
  6  7  1  0  0  0
  6 36  1  0  0  0
  6 37  1  0  0  0
  7  8  1  0  0  0
  7 38  1  0  0  0
  7 39  1  0  0  0
  8  9  2  0  0  0
  8 12  1  0  0  0
  9 10  1  0  0  0
  9 40  1  0  0  0
 10 11  2  0  0  0
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 13 14  1  0  0  0
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 14 15  1  0  0  0
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 15 22  1  0  0  0
 15 16  1  0  0  0
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 27 56  1  0  0  0
M  END

>  <Chemical Name>
CHEMBL11879

>  <PubChem CID>
10689833

>  <Formula>
C24H29N3

>  <Molecular Weight>
359.517000

>  <IUPAC Name>
2-(3,3-diphenylpropyl)-5-(2-pyrrolidin-1-ylethyl)-1H-imidazole

>  <XlogP>
4.9

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
2

>  <Canonical SMILES>
C1CCN(C1)CCC2=CN=C(N2)CCC(C3=CC=CC=C3)C4=CC=CC=C4

>  <Isomeric SMILES>
C1CCN(C1)CCC2=CN=C(N2)CCC(C3=CC=CC=C3)C4=CC=CC=C4

>  <InChI Std. ID>
InChI=1S/C24H29N3/c1-3-9-20(10-4-1)23(21-11-5-2-6-12-21)13-14-24-25-19-22(26-24)15-18-27-16-7-8-17-27/h1-6,9-12,19,23H,7-8,13-18H2,(H,25,26)

>  <InChI Key>
HKZSTMPUPMSPLU-UHFFFAOYSA-N

