
 CHEMBL354611

 35 38  0  0  0  0  0  0  0  0999 V2000
   -1.0109    1.5680   -1.0338 C   0  0  0  0  0
   -2.2168    0.6641   -0.7910 C   0  0  0  0  0
   -1.9252   -0.2793    0.3542 C   0  0  0  0  0
   -3.1017   -0.8309    1.1357 C   0  0  0  0  0
   -2.2209    0.2160    1.7703 C   0  0  0  0  0
   -1.3765   -0.1302    2.9674 C   0  0  0  0  0
   -2.0443    0.2854    4.3019 C   0  0  0  0  0
   -1.3713    1.5395    4.5812 N   0  0  0  0  0
   -0.2499    1.5590    3.8138 C   0  0  0  0  0
   -0.1172    0.6692    2.8811 N   0  0  0  0  0
   -0.7657   -1.2125    0.0613 C   0  0  0  0  0
    0.3977   -0.5017   -0.5986 C   0  0  0  0  0
    1.6258   -1.1748   -0.7019 C   0  0  0  0  0
    2.7207   -0.5722   -1.3214 C   0  0  0  0  0
    2.6016    0.7096   -1.8497 C   0  0  0  0  0
    1.3863    1.3876   -1.7629 C   0  0  0  0  0
    0.2746    0.7867   -1.1531 C   0  0  0  0  0
   -0.9031    2.2731   -0.2002 H   0  0  0  0  0
   -1.1836    2.1507   -1.9463 H   0  0  0  0  0
   -3.1008    1.2814   -0.5908 H   0  0  0  0  0
   -2.4378    0.0769   -1.6917 H   0  0  0  0  0
   -3.0422   -1.8524    1.4957 H   0  0  0  0  0
   -4.1032   -0.5369    0.8401 H   0  0  0  0  0
   -2.6129    1.2263    1.8520 H   0  0  0  0  0
   -1.1387   -1.1988    2.9996 H   0  0  0  0  0
   -1.8077   -0.4383    5.0893 H   0  0  0  0  0
   -3.1289    0.4069    4.2317 H   0  0  0  0  0
   -1.2792    1.8197    5.5496 H   0  0  0  0  0
    0.5001    2.3279    4.0582 H   0  0  0  0  0
   -1.1163   -1.9922   -0.6273 H   0  0  0  0  0
   -0.4171   -1.7164    0.9683 H   0  0  0  0  0
    1.7350   -2.1743   -0.2878 H   0  0  0  0  0
    3.6674   -1.1011   -1.3842 H   0  0  0  0  0
    3.4560    1.1851   -2.3227 H   0  0  0  0  0
    1.3092    2.3937   -2.1679 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  3  1  0  0  0
  2 20  1  0  0  0
  2 21  1  0  0  0
  3 11  1  0  0  0
  3  4  1  0  0  0
  3  5  1  0  0  0
  4  5  1  0  0  0
  4 22  1  0  0  0
  4 23  1  0  0  0
  5  6  1  0  0  0
  5 24  1  0  0  0
  6  7  1  0  0  0
  6 10  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  9  1  0  0  0
  8 28  1  0  0  0
  9 10  2  0  0  0
  9 29  1  0  0  0
 11 12  1  0  0  0
 11 30  1  0  0  0
 11 31  1  0  0  0
 12 13  2  0  0  0
 12 17  1  0  0  0
 13 14  1  0  0  0
 13 32  1  0  0  0
 14 15  2  0  0  0
 14 33  1  0  0  0
 15 16  1  0  0  0
 15 34  1  0  0  0
 16 17  2  0  0  0
 16 35  1  0  0  0
M  END

>  <Chemical Name>
CHEMBL354611

>  <PubChem CID>
135433755

>  <Formula>
C15H18N2

>  <Molecular Weight>
226.323000

>  <IUPAC Name>
(4R)-4-[(3R)-spiro[2,4-dihydro-1H-naphthalene-3,2'-cyclopropane]-1'-yl]-4,5-dihydro-1H-imidazole

>  <XlogP>
2.3

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
1

>  <Canonical SMILES>
C1CC2(CC2C3CNC=N3)CC4=CC=CC=C41

>  <Isomeric SMILES>
C1C[C@@]2(CC2[C@@H]3CNC=N3)CC4=CC=CC=C41

>  <InChI Std. ID>
InChI=1S/C15H18N2/c1-2-4-12-7-15(6-5-11(12)3-1)8-13(15)14-9-16-10-17-14/h1-4,10,13-14H,5-9H2,(H,16,17)/t13?,14-,15-/m0/s1

>  <InChI Key>
AMXWFUMPTGFRGD-FGRDXJNISA-N

