Chem Azinobis2 Pyridylmethane Dsrpl

Compound 320
  CheckMol                        TMF02:r0:m0
MF=C12H10N4 MW=210.24
 16 17  0  2  0               999 V2000
    0.0000   -0.0000   -0.0000 N   0 00  0  0  0  0  0  0  0  0  0  0
   -1.3066    0.7534   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.2831    0.7534   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -1.3184    2.2601   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6132    0.0235   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2713    2.2601   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -0.0353    3.0134   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.9198    0.7769   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2264    0.0471   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5330    0.8004   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8396    0.0706   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -9.1462    0.8358   -0.0000 N   0 00  0  0  0  0  0  0  0  0  0  0
   -7.8514   -1.4125   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
  -10.4528    0.1059   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -9.1580   -2.1424   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
  -10.4646   -1.3772   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
  1  2 02  0  1  0  0
  1  3 01  0  1  0  0
  2  4 01  0  1  0  0
  2  5  1  0  0  0  0
  3  6 02  0  1  0  0
  4  7 02  0  1  0  0
  5  8  2  3  0  0  0
  8  9  1  0  0  0  0
  9 10  2  3  0  0  0
 10 11  1  0  0  0  0
 11 12 02  0  1  0  0
 11 13 01  0  1  0  0
 12 14 01  0  1  0  0
 13 15 02  0  1  0  0
 14 16 02  0  1  0  0
  6  7 01  0  1  0  0
 15 16 01  0  1  0  0
M  END

Azinobis(2-pyridylmethane)

₹ 0.00 0.00

Chemical Name - Azinobis(2-pyridylmethane)
Mol Weight - 210.239
Smiles - C(c1ncccc1)=NN=Cc1ncccc1

Property Name	Property Value
Mol Name	Azinobis(2-pyridylmethane)
Molweight	210.239
Monoisotopic Mass	210.090546
Clogp	2.8918
Clogs	-2.59
H Acceptors	4
Total Surface Area	180.06
Relative Psa	0.24969
Polar Surface Area	50.5
Druglikeness	1.7972
Mutagenic	low
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.75
Molecular Flexibility	0.3518
Molecular Complexity	0.53395
Fragments	1
Non H Atoms	16
Non Ch Atoms	4
Electronegative Atoms	4
Rotatable Bonds	3
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Symmetric Atoms	8
Aromatic Nitrogens	2
Smiles	C(c1ncccc1)=NN=Cc1ncccc1
InChIKey	InChI=1S/C12H10N4/c1-3-7-13-11(5-1)9-15-16-10-12-6-2-4-8-14-12/h1-10H
InChI	DMQJTSJKMFPBMN-UHFFFAOYSA-N

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Azinobis(2-pyridylmethane)