Compound 212
  CheckMol                        TMF02:r0:m0
MF=C7H5BrN2 MW=197.03
 10 11  0  3  0               999 V2000
    0.0000   -0.0000   -0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -1.3176   -0.7411   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -1.4823   -2.2234   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.7057   -0.1176   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.9645   -2.5293   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -0.4941   -3.3292   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.7174   -1.2235   -0.0000 N   0 00  0  0  0  0  0  0  0  0  0  0
   -3.4351   -3.9409   -0.0000 N   0 00  0  0  0  0  0  0  0  0  0  0
   -0.9646   -4.7409   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.4469   -5.0467   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3 01  0  1  0  0
  2  4 02  0  1  0  0
  3  5 02  0  2  0  0
  3  6 01  0  1  0  0
  4  7 01  0  1  0  0
  5  8 01  0  1  0  0
  6  9 02  0  1  0  0
  8 10 02  0  1  0  0
  5  7 01  0  1  0  0
  9 10 01  0  1  0  0
M  END

2D Structure

3- Bromo-7-Azaindole

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Chemical Name - 3- Bromo-7-Azaindole
Mol Weight - 197.035
Smiles - Brc1c[nH]c2c1cccn2

Property Name	Property Value
Mol Name	3- Bromo-7-Azaindole
Molweight	197.035
Monoisotopic Mass	195.963609
Clogp	1.7062
Clogs	-3.025
H Acceptors	2
H Donors	1
Total Surface Area	114.82
Relative Psa	0.21738
Polar Surface Area	28.68
Druglikeness	-5.9131
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.6
Molecular Complexity	0.80147
Fragments	1
Non H Atoms	10
Non Ch Atoms	3
Electronegative Atoms	3
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	9
Aromatic Nitrogens	2
Smiles	Brc1c[nH]c2c1cccn2
InChIKey	InChI=1S/C7H5BrN2/c8-6-4-10-7-5(6)2-1-3-9-7/h1-4H,(H,9,10)
InChI	VJDGIJDCXIEXPF-UHFFFAOYSA-N

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