CAS RN: 155050-17-2
(R)-3-AMINO-3-(3-PYRIDYL)-PROPIONIC ACID
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.20260214 | 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS155050-17-2
- Purity/Analytical Methods: >99.0%
155050-17-2 / (3R)-3-amino-3-pyridin-3-ylpropanoic acid
Basic Information
CAS
155050-17-2
Multi CAS
No
Molecular Formula
C8H10N2O2
Molecular Weight
166.180000
Exact Mass
166.074228
SMILES
C1=CC(=CN=C1)[C@@H](CC(=O)O)N
InChI
InChI=1S/C8H10N2O2/c9-7(4-8(11)12)6-2-1-3-10-5-6/h1-3,5,7H,4,9H2,(H,11,12)/t7-/m1/s1
InChIKey
QOTCEJINJFHMLO-SSDOTTSWSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.25
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
2
Molar refractivity
43.42
TPSA
76.21
LogP / Solubility
WLOGP
0.56
MLOGP
0.49
XLogP3
-3
Consensus LogP
-0.65
Log S (ESOL)
-1.39
Class (ESOL)
Soluble
Log S (Ali)
-1.32
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.56
Class (SILICOS-IT)
Soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.34
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
Customers Also Viewed
-
“4-Hydroxy-3-(3-methyl-2-buteyl)-5-(3-methyl-2-butenyl)benzoic acid”
- CAS RN: 155051-85-7
- Product Code: starshine_CAS155051-85-7
- Purity/Analytical method: >99.0%
-
4-IPAB
- CAS RN: 155054-42-5
- Product Code: starshine_CAS155054-42-5
- Purity/Analytical method: >99.0%
-
-
1,6-Naphthyridin-5(6H)-one,7,8-dihydro-(9CI)
- CAS RN: 155058-02-9
- Product Code: SSC-064377
-
CALCITONIN (8-32) (SALMON I)
- CAS RN: 155069-90-2
- Product Code: starshine_CAS155069-90-2
- Purity/Analytical method: >99.0%
-
11-Deoxyalisol B
- CAS RN: 155073-73-7
- Product Code: starshine_CAS155073-73-7
- Purity/Analytical method: >99.0%
