
 CHEMBL47482

 31 33  0  0  0  0  0  0  0  0999 V2000
   -0.0049    1.3387    0.6237 C   0  0  0  0  0
    1.2691    0.6592    0.1759 C   0  0  0  0  0
    2.4453    1.4041    0.0112 C   0  0  0  0  0
    3.6274    0.7794   -0.3863 C   0  0  0  0  0
    3.6484   -0.5944   -0.6137 C   0  0  0  0  0
    2.4887   -1.3488   -0.4381 C   0  0  0  0  0
    1.2924   -0.7321   -0.0395 C   0  0  0  0  0
    0.0386   -1.5694    0.1979 C   0  0  0  0  0
   -1.2382   -0.7697   -0.0424 C   0  0  0  0  0
   -2.4090   -1.4137   -0.4732 C   0  0  0  0  0
   -3.5886   -0.6926   -0.6570 C   0  0  0  0  0
   -3.6120    0.6777   -0.4129 C   0  0  0  0  0
   -2.4536    1.3328    0.0044 C   0  0  0  0  0
   -1.2577    0.6211    0.1770 C   0  0  0  0  0
    0.0902   -2.1637    1.6346 C   0  0  0  0  0
   -0.9462   -3.1668    1.9172 N   0  0  0  0  0
   -0.0055    1.4074    1.7181 H   0  0  0  0  0
   -0.0201    2.3573    0.2158 H   0  0  0  0  0
    2.4450    2.4775    0.1863 H   0  0  0  0  0
    4.5330    1.3655   -0.5194 H   0  0  0  0  0
    4.5698   -1.0801   -0.9240 H   0  0  0  0  0
    2.5218   -2.4226   -0.6096 H   0  0  0  0  0
    0.0558   -2.3892   -0.5345 H   0  0  0  0  0
   -2.4048   -2.4855   -0.6617 H   0  0  0  0  0
   -4.4892   -1.2021   -0.9892 H   0  0  0  0  0
   -4.5323    1.2388   -0.5537 H   0  0  0  0  0
   -2.4855    2.4051    0.1842 H   0  0  0  0  0
    0.0105   -1.3625    2.3806 H   0  0  0  0  0
    1.0608   -2.6478    1.7972 H   0  0  0  0  0
   -1.8587   -2.7109    1.8701 H   0  0  0  0  0
   -0.8457   -3.4784    2.8825 H   0  0  0  0  0
  1 14  1  0  0  0
  1  2  1  0  0  0
  1 17  1  0  0  0
  1 18  1  0  0  0
  2  7  1  0  0  0
  2  3  2  0  0  0
  3  4  1  0  0  0
  3 19  1  0  0  0
  4  5  2  0  0  0
  4 20  1  0  0  0
  5  6  1  0  0  0
  5 21  1  0  0  0
  6  7  2  0  0  0
  6 22  1  0  0  0
  7  8  1  0  0  0
  8  9  1  0  0  0
  8 15  1  0  0  0
  8 23  1  0  0  0
  9 10  2  0  0  0
  9 14  1  0  0  0
 10 11  1  0  0  0
 10 24  1  0  0  0
 11 12  2  0  0  0
 11 25  1  0  0  0
 12 13  1  0  0  0
 12 26  1  0  0  0
 13 14  2  0  0  0
 13 27  1  0  0  0
 15 16  1  0  0  0
 15 28  1  0  0  0
 15 29  1  0  0  0
 16 30  1  0  0  0
 16 31  1  0  0  0
M  END

>  <Chemical Name>
CHEMBL47482

>  <PubChem CID>
10398175

>  <Formula>
C15H15N

>  <Molecular Weight>
209.292000

>  <IUPAC Name>
9,10-dihydroanthracen-9-ylmethanamine

>  <XlogP>
2.700

>  <Hydrogen Bond Donors>
1

>  <Hydrogen Bond Acceptors>
1

>  <Canonical SMILES>
C1C2=CC=CC=C2C(C3=CC=CC=C31)CN

>  <Isomeric SMILES>
C1C2=CC=CC=C2C(C3=CC=CC=C31)CN

>  <InChI Std. ID>
InChI=1S/C15H15N/c16-10-15-13-7-3-1-5-11(13)9-12-6-2-4-8-14(12)15/h1-8,15H,9-10,16H2

>  <InChI Key>
GEICAQNIOJFRQN-UHFFFAOYSA-N

