CAS RN: 21752-29-4
H-GLN-NH2 HCL
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250311 | 1g / 5g | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS21752-29-4
- Purity/Analytical Methods: >99.0%
21752-29-4 / (2S)-2-aminopentanediamide;hydrochloride
Basic Information
CAS
21752-29-4
Multi CAS
No
Molecular Formula
C5H12ClN3O2
Molecular Weight
181.620000
Exact Mass
181.061804
SMILES
C(CC(=O)N)[C@@H](C(=O)N)N.Cl
InChI
InChI=1S/C5H11N3O2.ClH/c6-3(5(8)10)1-2-4(7)9;/h3H,1-2,6H2,(H2,7,9)(H2,8,10);1H/t3-;/m0./s1
InChIKey
XXIALTSAXCJAST-DFWYDOINSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Fraction Csp3
0.6
Rotatable bonds
4
H-bond acceptors
3
H-bond donors
3
Molar refractivity
42.85
TPSA
112.2
LogP / Solubility
WLOGP
-1.51
MLOGP
-1.33
XLogP3
-1.51
Consensus LogP
-1.45
Log S (ESOL)
0.25
Class (ESOL)
Highly soluble
Log S (Ali)
0.04
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
-0.06
Class (SILICOS-IT)
Very 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)
-4.9
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
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