
 CHEMBL1641682

 29 31  0  0  0  0  0  0  0  0999 V2000
    1.6259   -0.7812   -0.9181 C   0  0  0  0  0
    3.0379   -0.4920   -0.4881 C   0  0  0  0  0
    3.5289    0.8130   -0.2093 C   0  0  0  0  0
    4.8505    0.9558    0.2051 C   0  0  0  0  0
    5.7411   -0.1108    0.3512 C   0  0  0  0  0
    5.2556   -1.3846    0.0654 C   0  0  0  0  0
    3.9359   -1.5726   -0.3431 C   0  0  0  0  0
    5.0234    2.2941    0.4128 N   0  0  0  0  0
    3.9402    3.0403    0.1665 N   0  0  0  0  0
    3.0097    2.1556   -0.2271 C   0  0  0  0  0
    1.7491    2.4462   -0.6273 N   0  0  0  0  0
    1.2293    3.6952   -0.6934 C   0  0  0  0  0
    0.2237    4.0056   -1.4738 N   0  0  0  0  0
    0.0178    5.4630   -1.2222 C   0  0  0  0  0
    1.2334    5.9407   -0.4205 C   0  0  0  0  0
    1.7259    4.6906    0.0906 N   0  0  0  0  0
    1.4393   -1.8569   -1.0023 H   0  0  0  0  0
    1.4315   -0.3314   -1.8959 H   0  0  0  0  0
    0.9193   -0.3806   -0.1837 H   0  0  0  0  0
    6.7665    0.0374    0.6739 H   0  0  0  0  0
    5.9131   -2.2454    0.1667 H   0  0  0  0  0
    3.5977   -2.5875   -0.5485 H   0  0  0  0  0
    5.8666    2.7618    0.7232 H   0  0  0  0  0
    1.2321    1.7863   -1.1886 H   0  0  0  0  0
   -0.0705    6.0059   -2.1680 H   0  0  0  0  0
   -0.9094    5.5963   -0.6537 H   0  0  0  0  0
    0.9600    6.6393    0.3742 H   0  0  0  0  0
    1.9772    6.4052   -1.0754 H   0  0  0  0  0
    2.7271    4.5959    0.2645 H   0  0  0  0  0
  1  2  1  0  0  0
  1 17  1  0  0  0
  1 18  1  0  0  0
  1 19  1  0  0  0
  2  7  1  0  0  0
  2  3  2  0  0  0
  3 10  1  0  0  0
  3  4  1  0  0  0
  4  8  1  0  0  0
  4  5  2  0  0  0
  5  6  1  0  0  0
  5 20  1  0  0  0
  6  7  2  0  0  0
  6 21  1  0  0  0
  7 22  1  0  0  0
  8  9  1  0  0  0
  8 23  1  0  0  0
  9 10  2  0  0  0
 10 11  1  0  0  0
 11 12  1  0  0  0
 11 24  1  0  0  0
 12 13  2  0  0  0
 12 16  1  0  0  0
 13 14  1  0  0  0
 14 15  1  0  0  0
 14 25  1  0  0  0
 14 26  1  0  0  0
 15 16  1  0  0  0
 15 27  1  0  0  0
 15 28  1  0  0  0
 16 29  1  0  0  0
M  END

>  <Chemical Name>
CHEMBL1641682

>  <PubChem CID>
50994258

>  <Formula>
C11H13N5

>  <Molecular Weight>
215.260000

>  <IUPAC Name>
N-(4,5-dihydro-1H-imidazol-2-yl)-4-methyl-1H-indazol-3-amine

>  <XlogP>
0.9

>  <Hydrogen Bond Donors>
3

>  <Hydrogen Bond Acceptors>
2

>  <Canonical SMILES>
CC1=C2C(=CC=C1)NN=C2NC3=NCCN3

>  <Isomeric SMILES>
CC1=C2C(=CC=C1)NN=C2NC3=NCCN3

>  <InChI Std. ID>
InChI=1S/C11H13N5/c1-7-3-2-4-8-9(7)10(16-15-8)14-11-12-5-6-13-11/h2-4H,5-6H2,1H3,(H3,12,13,14,15,16)

>  <InChI Key>
BILZSFIMYIREAG-UHFFFAOYSA-N

