
 CHEMBL1098187

 40 43  0  0  0  0  0  0  0  0999 V2000
    0.0351    0.5323   -1.7183 C   0  0  0  0  0
   -0.5384   -0.7932   -2.1944 C   0  0  0  0  0
    0.2332   -1.9771   -1.6185 C   0  0  0  0  0
    0.4079   -1.8965   -0.1638 N   0  0  0  0  0
    0.8115   -0.5951    0.3871 C   0  0  0  0  0
    0.0216    0.5739   -0.1956 C   0  0  0  0  0
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   -1.4796   -1.9031    1.2620 N   0  0  0  0  0
   -2.2806   -2.6521    2.0541 C   0  0  0  0  0
   -3.2725   -2.1974    2.8247 N   0  0  0  0  0
   -3.7330   -3.3070    3.4291 N   0  0  0  0  0
   -3.0688   -4.4660    3.0993 C   0  0  0  0  0
   -2.1354   -4.0715    2.1673 C   0  0  0  0  0
   -1.2042   -4.8725    1.5008 C   0  0  0  0  0
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    0.8043   -4.7248   -0.0261 C   0  0  0  0  0
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    1.7157   -4.1292    0.0874 H   0  0  0  0  0
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   -2.7487   -6.4274    3.6117 H   0  0  0  0  0
  1  6  1  0  0  0
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  3 25  1  0  0  0
  3 26  1  0  0  0
  4  5  1  0  0  0
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M  END

>  <Chemical Name>
CHEMBL1098187

>  <PubChem CID>
46887876

>  <Formula>
C14H20N6

>  <Molecular Weight>
272.356000

>  <IUPAC Name>
5-piperidin-1-yl-6,7,8,9-tetrahydro-2H-pyrazolo[3,4-c][2,7]naphthyridin-1-amine

>  <XlogP>
1.2

>  <Hydrogen Bond Donors>
3

>  <Hydrogen Bond Acceptors>
5

>  <Canonical SMILES>
C1CCN(CC1)C2=NC3=NNC(=C3C4=C2CNCC4)N

>  <Isomeric SMILES>
C1CCN(CC1)C2=NC3=NNC(=C3C4=C2CNCC4)N

>  <InChI Std. ID>
InChI=1S/C14H20N6/c15-12-11-9-4-5-16-8-10(9)14(17-13(11)19-18-12)20-6-2-1-3-7-20/h16H,1-8H2,(H3,15,17,18,19)

>  <InChI Key>
APCXMGDMFADVDF-UHFFFAOYSA-N

