CAS RN: 26700-39-0
POLY(LYS, PHE) HYDROBROMIDE
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250902 | 5mg / 25mg | Confirm by inquiry | Shanghai | Inquiry |
- Product code: starshine_CAS26700-39-0
- Purity/Analytical Methods: >99.0%
26700-39-0 / (2S)-2-amino-3-phenylpropanoic acid;(2S)-2,6-diaminohexanoic acid
Basic Information
CAS
26700-39-0
Multi CAS
No
Molecular Formula
C15H25N3O4
Molecular Weight
311.380000
Exact Mass
311.184506
SMILES
C1=CC=C(C=C1)C[C@@H](C(=O)O)N.C(CCN)C[C@@H](C(=O)O)N
InChI
InChI=1S/C9H11NO2.C6H14N2O2/c10-8(9(11)12)6-7-4-2-1-3-5-7;7-4-2-1-3-5(8)6(9)10/h1-5,8H,6,10H2,(H,11,12);5H,1-4,7-8H2,(H,9,10)/t8-;5-/m00/s1
InChIKey
ALBODLTZUXKBGZ-JUUVMNCLSA-N
Computed Properties
Structural Parameters
Heavy atom count
22
Aromatic heavy atom count
6
Fraction Csp3
0.47
Rotatable bonds
8
H-bond acceptors
5
H-bond donors
5
Molar refractivity
84.27
TPSA
152.66
LogP / Solubility
WLOGP
0.17
MLOGP
0.16
XLogP3
0.17
Consensus LogP
0.17
Log S (ESOL)
-1.55
Class (ESOL)
Soluble
Log S (Ali)
-2.23
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.78
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.5
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3.5
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