
 CHEMBL544354

 33 34  0  0  0  0  0  0  0  0999 V2000
    1.0738    0.3462   -1.3695 C   0  0  0  0  0
    2.5092    0.2711   -0.9724 C   0  0  0  0  0
    3.3593    1.3425   -0.7863 C   0  0  0  0  0
    4.5507    0.8452   -0.4294 N   0  0  0  0  0
    5.7022    1.4913   -0.1397 C   0  0  0  0  0
    6.8113    0.7185    0.2074 C   0  0  0  0  0
    6.7009   -0.6428    0.2449 N   0  0  0  0  0
    5.5345   -1.3036   -0.0476 C   0  0  0  0  0
    4.4241   -0.4936   -0.3989 C   0  0  0  0  0
    3.1751   -0.8824   -0.7328 N   0  0  0  0  0
    5.5112   -2.7516    0.0215 N   0  0  0  0  0
    6.8115   -3.4256    0.0069 C   0  0  0  0  0
    6.7043   -4.8640    0.5215 C   0  0  0  0  0
    5.6758   -5.5997   -0.2183 N   0  0  0  0  0
    4.3780   -4.9552   -0.0058 C   0  0  0  0  0
    4.3813   -3.5079   -0.5219 C   0  0  0  0  0
    1.9659   -0.4790    2.5720 Cl  0  0  0  0  0
    0.6411   -0.6740   -1.4388 H   0  0  0  0  0
    0.9847    0.8459   -2.3564 H   0  0  0  0  0
    0.5085    0.9270   -0.6109 H   0  0  0  0  0
    3.1280    2.3941   -0.8999 H   0  0  0  0  0
    5.7626    2.5719   -0.1767 H   0  0  0  0  0
    7.7539    1.1922    0.4461 H   0  0  0  0  0
    7.5556   -2.9020    0.6447 H   0  0  0  0  0
    7.1906   -3.4408   -1.0387 H   0  0  0  0  0
    7.6853   -5.3737    0.4108 H   0  0  0  0  0
    6.4513   -4.8559    1.6057 H   0  0  0  0  0
    5.9072   -5.6180   -1.2398 H   0  0  0  0  0
    3.5791   -5.5330   -0.5186 H   0  0  0  0  0
    4.1435   -4.9594    1.0827 H   0  0  0  0  0
    4.4475   -3.5048   -1.6319 H   0  0  0  0  0
    3.4089   -3.1062   -0.1906 H   0  0  0  0  0
    1.9770    0.8003    2.0661 H   0  0  0  0  0
  1  2  1  0  0  0
  1 18  1  0  0  0
  1 19  1  0  0  0
  1 20  1  0  0  0
  2 10  1  0  0  0
  2  3  2  0  0  0
  3  4  1  0  0  0
  3 21  1  0  0  0
  4  9  1  0  0  0
  4  5  1  0  0  0
  5  6  2  0  0  0
  5 22  1  0  0  0
  6  7  1  0  0  0
  6 23  1  0  0  0
  7  8  2  0  0  0
  8  9  1  0  0  0
  8 11  1  0  0  0
  9 10  2  0  0  0
 11 16  1  0  0  0
 11 12  1  0  0  0
 12 13  1  0  0  0
 12 24  1  0  0  0
 12 25  1  0  0  0
 13 14  1  0  0  0
 13 26  1  0  0  0
 13 27  1  0  0  0
 14 15  1  0  0  0
 14 28  1  0  0  0
 15 16  1  0  0  0
 15 29  1  0  0  0
 15 30  1  0  0  0
 16 31  1  0  0  0
 16 32  1  0  0  0
 17 33  1  0  0  0
M  END

>  <Chemical Name>
CHEMBL544354

>  <PubChem CID>
45261774

>  <Formula>
C11H16ClN5

>  <Molecular Weight>
253.734000

>  <IUPAC Name>
2-methyl-8-piperazin-1-ylimidazo[1,2-a]pyrazine;hydrochloride

>  <XlogP>
-10000

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
CC1=CN2C=CN=C(C2=N1)N3CCNCC3.Cl

>  <Isomeric SMILES>
CC1=CN2C=CN=C(C2=N1)N3CCNCC3.Cl

>  <InChI Std. ID>
InChI=1S/C11H15N5.ClH/c1-9-8-16-7-4-13-10(11(16)14-9)15-5-2-12-3-6-15;/h4,7-8,12H,2-3,5-6H2,1H3;1H

>  <InChI Key>
LTYSNVXFXGUEMF-UHFFFAOYSA-N

