TL;DR: N-Myristoyl-lysyl-arginyl-threonyl-leucyl-arginine (CAS 125678-68-4) is a chemical compound with molecular formula C42H82N12O8 and molecular weight 882.6379 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-6-amino-2-(tetradecanoylamino)hexanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-hydroxybutanoyl]amino]-4-methylpentanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid
Also Known As: Mlatla, Myristoyl-Lys-Arg-Thr-Leu-Arg-OH, N-m-KRTLR, MYRISTOYL-KRTLR-OH, N-Myristyl-lys-arg-thr-leu-arg
| Molecular Formula | C42H82N12O8 |
| Molecular Weight | 882.6379 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 358.0 Ų |
| Hydrogen Bond Donors | 12 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 37 |
| Exact Mass | 882.6379 Da |
| Heavy Atoms | 62 |
| Complexity | 1370.0 |
| SMILES | CCCCCCCCCCCCCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)O |
| InChIKey | UCADRBIEWWELGN-PGMVXXSLSA-N |
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Myristoyl-lysyl-arginyl-threonyl-leucyl-arginine. The TPSA of 358.0 Ų indicates high polarity, suggesting N-Myristoyl-lysyl-arginyl-threonyl-leucyl-arginine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-Myristoyl-lysyl-arginyl-threonyl-leucyl-arginine has 12 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of N-Myristoyl-lysyl-arginyl-threonyl-leucyl-arginine is 125678-68-4.
The molecular formula of N-Myristoyl-lysyl-arginyl-threonyl-leucyl-arginine is C42H82N12O8.
The molecular weight of N-Myristoyl-lysyl-arginyl-threonyl-leucyl-arginine is 882.6379 g/mol.
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