N-Acetyl-D-cysteine
PubChem CID: 94364
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| Compound Synonyms | N-Acetyl-D-cysteine, 26117-28-2, D-Cysteine, N-acetyl-, (2S)-2-acetamido-3-sulfanylpropanoic acid, (S)-2-Acetamido-3-mercaptopropanoic acid, L305827QJJ, EINECS 247-470-5, UNII-L305827QJJ, DTXSID60180751, MFCD00269768, N-acetyl-d-cys, 2S-Acetylamino-3-mercaptopropanoic Acid, D-N-Acetylcysteine, N-Acetyl-(S)-cysteine, , n-acetyl-d-cystein, acetylcysteine, (D)-, Spectrum_000024, (S)-N-acetyl-cysteine, Lopac-A-7250, KBioSS_000384, DivK1c_000530, CHEMBL507900, SCHEMBL1384791, HMS501K12, KBio1_000530, KBio2_000384, KBio2_002952, KBio2_005520, DTXCID00103242, CHEBI:231077, NINDS_000530, Pharmakon1600-01500105, NSC755856, AKOS006275410, NSC-755856, IDI1_000530, NCGC00015086-01, NCGC00015086-02, NCGC00094578-01, NCGC00094578-02, AS-17941, (2S)-2-acetamido-3-sulanylpropanoic acid, DB-343785, HY-136386, CS-0128949, NS00084209, D94631, EN300-6991250, BRD-K67174965-001-02-7, Q27896281, 247-470-5 |
|---|---|
| Topological Polar Surface Area | 67.4 |
| Hydrogen Bond Donor Count | 3.0 |
| Heavy Atom Count | 10.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 148.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 1.0 |
| Uniprot Id | B2RXH2, P10636, P02791, P16050, P28482, Q99714 |
| Iupac Name | (2S)-2-acetamido-3-sulfanylpropanoic acid |
| Prediction Hob | 0.0 |
| Target Id | NPT48, NPT51, NPT792, NPT282, NPT149 |
| Xlogp | 0.4 |
| Molecular Formula | C5H9NO3S |
| Prediction Swissadme | 1.0 |
| Inchi Key | PWKSKIMOESPYIA-SCSAIBSYSA-N |
| Fcsp3 | 0.6 |
| Logs | -0.688 |
| Rotatable Bond Count | 3.0 |
| Logd | -0.913 |
| Compound Name | N-Acetyl-D-cysteine |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 163.03 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 163.03 |
| Hydrogen Bond Acceptor Count | 4.0 |
| Molecular Weight | 163.2 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -0.6475275999999999 |
| Inchi | InChI=1S/C5H9NO3S/c1-3(7)6-4(2-10)5(8)9/h4,10H,2H2,1H3,(H,6,7)(H,8,9)/t4-/m1/s1 |
| Smiles | CC(=O)N[C@H](CS)C(=O)O |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Allium Sativum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all