CAS RN: 61756-22-7
VAL-GLY-SER-GLU
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Inquiry |
|---|---|---|---|
| Batchno.20250301 | 1g | Out of stock | Inquiry |
- Product code: starshine_CAS61756-22-7
- Purity/Analytical Methods: >99.0%
61756-22-7 / 2-[[2-[[2-[(2-amino-3-methylbutanoyl)amino]acetyl]amino]-3-hydroxypropanoyl]amino]pentanedioic acid
Basic Information
CAS
61756-22-7
Multi CAS
Yes
Molecular Formula
C15H26N4O8
Molecular Weight
390.390000
Exact Mass
390.175064
InChI
InChI=1S/C15H26N4O8/c1-7(2)12(16)14(25)17-5-10(21)18-9(6-20)13(24)19-8(15(26)27)3-4-11(22)23/h7-9,12,20H,3-6,16H2,1-2H3,(H,17,25)(H,18,21)(H,19,24)(H,22,23)(H,26,27)
InChIKey
KDZIGQIDPXKMBA-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
27
Fraction Csp3
0.67
Rotatable bonds
12
H-bond acceptors
7
H-bond donors
7
Molar refractivity
91.28
TPSA
208.15
LogP / Solubility
WLOGP
-3
MLOGP
-2.62
XLogP3
-5.1
Consensus LogP
-3.57
Log S (ESOL)
0.42
Class (ESOL)
Highly soluble
Log S (Ali)
-0.59
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-1.15
Class (SILICOS-IT)
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)
-7.23
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
4
Customers Also Viewed
-
Oxaliplatin impurity D
- CAS RN: 61758-77-8
- Product Code: starshine_CAS61758-77-8
- Purity/Analytical method: >99.0%
-
-
-
Carbonic acid, methyl 2-propynyl ester
- CAS RN: 61764-71-4
- Product Code: starshine_CAS61764-71-4
- Purity/Analytical method: >99.0%
-
-
