Chem Chloramphenicol Unilink

Compound 45
  CheckMol                        TMF02:r0:m0
MF=C11H12Cl2N2O5 MW=323.13
 20 20  0  1  0               999 V2000
    0.0000   -0.0000   -0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -0.0119   -1.4976   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3312   -2.2464   -0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.2836   -2.2464   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2717   -3.7439   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5792   -1.4857   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.8747   -2.2345   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8628   -3.7321   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1702   -1.4738   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5435   -4.4690   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1583   -4.4690   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    6.4657   -2.2226   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1464   -5.9665   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    6.4538   -3.7083   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    6.4419   -6.7153   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    7.7494   -4.4452   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    7.7375   -5.9546   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    9.0330   -6.7034   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.3285   -5.9428   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.0211   -8.2010   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  8 10  1  0  0  0  0
  8 11  1  0  0  0  0
  9 12  1  0  0  0  0
 11 13 02  0  1  0  0
 11 14 01  0  1  0  0
 13 15 01  0  1  0  0
 14 16 02  0  1  0  0
 15 17 02  0  1  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 18 20  1  0  0  0  0
 16 17 01  0  1  0  0
M  CHG  1  18   1
M  CHG  1  20  -1
M  END

Chloramphenicol

₹ 0.00 0.00

Chemical Name - Chloramphenicol
Mol Weight - 323.131
Smiles - [O-][N+](c1ccc(C(C(CO)NC(C(Cl)Cl)=O)O)cc1)=O

Property Name	Property Value
Mol Name	Chloramphenicol
Molweight	323.131
Monoisotopic Mass	322.012327
Clogp	-0.4248
Clogs	-2.367
H Acceptors	7
H Donors	3
Total Surface Area	220.94
Relative Psa	0.36716
Polar Surface Area	115.38
Druglikeness	-2.4605
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Shape Index	0.6
Molecular Flexibility	0.61417
Molecular Complexity	0.66888
Fragments	1
Non H Atoms	20
Non Ch Atoms	9
Electronegative Atoms	9
Stereo Centers	2
Rotatable Bonds	6
Rings Closures	1
Small Rings	1
Aromatic Rings	1
Aromatic Atoms	6
Sp3 Atoms	7
Symmetric Atoms	3
Amides	1
Acidic Oxygens	1
Smiles	[O-][N+](c1ccc(C(C(CO)NC(C(Cl)Cl)=O)O)cc1)=O
InChIKey	InChI=1S/C11H12Cl2N2O5/c12-10(13)11(18)14-8(5-16)9(17)6-1-3-7(4-2-6)15(19)20/h1-4,8-10,16-17H,5H2,(H,14,18)
InChI	WIIZWVCIJKGZOK-UHFFFAOYSA-N

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Chloramphenicol