N(6)-acetimidoyl-L-lysine
PubChem CID: 2733506
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| Compound Synonyms | L-NIL, 53774-63-3, Lnil, N(6)-acetimidoyl-L-lysine, L-N6-(1-Iminoethyl)lysine, N-(5-amino-5-carboxypentyl)-acetamidine, n-iminoethyl-l-lysine, G5QA32XVN5, N6-(1-IMINOETHYL)-L-LYSINE, H-Lys(acetimidoyl)-OH, L-Lysine, N6-(1-iminoethyl)-, N(6)-acetimidoyllysine, epsilon-Acetimidoyllysine, UNII-G5QA32XVN5, N~6~-[(1z)-Ethanimidoyl]-L-Lysine, CHEMBL7889, N(6)-ethanimidoyl-L-lysine, (2S)-2-amino-6-(1-aminoethylideneamino)hexanoic acid, L-N(6)-(1-iminoethyl)lysine, CHEBI:63971, L-N(omega)-(1-iminoethyl)lysine, N-(iminoethyl)-L-lysine, 6-Acetimidamido-2-aminohexanoic acid, N-(5-amino-5-carboxypentyl)acetamidine, MFCD00792818, NCGC00015566-01, Tocris-1139, Lopac-I-8021, N6-ethanimidoyl-L-lysine, (L-N6-1-iminoethyl)lysine, SCHEMBL322091, L-Lysine,n6-(1-iminoethyl)-, DTXSID9041071, L-NIL, H-Lys(1-iminoethyl)-OH, N-(5-Amino-5-carboxypentyl)-acetamidine, SCHEMBL26908438, .EPSILON.-ACETIMIDOYLLYSINE, BDBM50063300, EX-A10387, AKOS006237613, CS-7870, 6-Acetimidoylamino-2-amino-hexanoic acid, NCGC00025026-01, (S)-6-acetimidamido-2-aminohexanoic acid, DA-65035, HY-12116, MS-23013, (S)-6-Acetimidoylamino-2-amino-hexanoic acid, BRD-K60036103-003-01-6, Q27132940, IEL |
|---|---|
| Topological Polar Surface Area | 102.0 |
| Hydrogen Bond Donor Count | 3.0 |
| Heavy Atom Count | 13.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 192.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 1.0 |
| Iupac Name | (2S)-2-amino-6-(1-aminoethylideneamino)hexanoic acid |
| Prediction Hob | 1.0 |
| Target Id | NPT3517, NPT3974, NPT3569 |
| Xlogp | -3.1 |
| Molecular Formula | C8H17N3O2 |
| Prediction Swissadme | 0.0 |
| Inchi Key | ONYFNWIHJBLQKE-ZETCQYMHSA-N |
| Fcsp3 | 0.75 |
| Logs | -1.527 |
| Rotatable Bond Count | 6.0 |
| Logd | -0.853 |
| Compound Name | N(6)-acetimidoyl-L-lysine |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 187.132 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 187.132 |
| Hydrogen Bond Acceptor Count | 4.0 |
| Molecular Weight | 187.24 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | 1.5211934 |
| Inchi | InChI=1S/C8H17N3O2/c1-6(9)11-5-3-2-4-7(10)8(12)13/h7H,2-5,10H2,1H3,(H2,9,11)(H,12,13)/t7-/m0/s1 |
| Smiles | CC(=NCCCC[C@@H](C(=O)O)N)N |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Chloranthus Serratus (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Patrinia Scabra (Plant) Rel Props:Source_db:cmaup_ingredients