Chem N Acetyl L Cysteine 2 Molychem

Compound 246
  CheckMol                        TMF02:r0:m0
MF=C5H9NO3S MW=163.19
 10  9  0  0  1               999 V2000
    0.0000   -0.0000   -0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3092    0.7548   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3210    2.2645   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0354    3.0194   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6302    3.0194   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2502    2.2763   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6420    4.5291   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9394    2.2763   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2384    0.7902   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5358    3.0312   -0.0000 C   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
  3  4  1  1  0  0  0
  3  5  1  0  0  0  0
  4  6  1  0  0  0  0
  5  7  2  0  0  0  0
  5  8  1  0  0  0  0
  6  9  2  0  0  0  0
  6 10  1  0  0  0  0
M  END

N-Acetyl-L-Cysteine

₹ 0.00 0.00

Chemical Name - N-Acetyl-L-Cysteine
Mol Weight - 163.196
Smiles - CC(N[C@@H](CS)C(O)=O)=O

Property Name	Property Value
Mol Name	N-Acetyl-L-Cysteine
Molweight	163.196
Monoisotopic Mass	163.030314
Clogp	-0.9233
Clogs	-1.261
H Acceptors	4
H Donors	2
Total Surface Area	121.19
Relative Psa	0.60442
Polar Surface Area	105.2
Druglikeness	-13.049
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.6
Molecular Flexibility	0.65377
Molecular Complexity	0.69315
Fragments	1
Non H Atoms	10
Non Ch Atoms	5
Electronegative Atoms	5
Stereo Centers	1
Rotatable Bonds	3
Sp3 Atoms	5
Amides	1
Acidic Oxygens	1
Smiles	CC(N[C@@H](CS)C(O)=O)=O
InChIKey	InChI=1S/C5H9NO3S/c1-3(7)6-4(2-10)5(8)9/h4,10H,2H2,1H3,(H,6,7)(H,8,9)/t4-/m0/s1
InChI	PWKSKIMOESPYIA-BYPYZUCNSA-N

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2 - N-Acetyl-L-Cysteine

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N-Acetyl-L-Cysteine