[email protected]
CAS 52809-07-1 QUISQUALIC ACID molecular structure lightbox
CAS RN: 52809-07-1

QUISQUALIC ACID

Product Availability

Choose a grade to view its available package options.

6 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250303 10mg In stock Shanghai Inquiry
Batchno.20260503 1mg In stock Shanghai Inquiry
Batchno.20260214 25mg Out of stock Inquiry
Batchno.20251125 50mg Out of stock Inquiry
Batchno.20250329 5mg In stock Shanghai Inquiry
Batchno.20260222 5mg In stock Shanghai Inquiry
  • Product code: starshine_CAS52809-07-1
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

52809-07-1 / 2-amino-3-(3,5-dioxo-1,2,4-oxadiazolidin-2-yl)propanoic acid

Standard CAS: 52809-07-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
52809-07-1
Multi CAS
Yes
Molecular Formula
C5H7N3O5
Molecular Weight
189.130000
Exact Mass
189.038570
InChI
InChI=1S/C5H7N3O5/c6-2(3(9)10)1-8-4(11)7-5(12)13-8/h2H,1,6H2,(H,9,10)(H,7,11,12)/t2-/m0/s1
InChIKey
ASNFTDCKZKHJSW-REOHCLBHSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
5
Fraction Csp3
0.4
Rotatable bonds
3
H-bond acceptors
6
H-bond donors
3
Molar refractivity
39.2
TPSA
131.32

LogP / Solubility

WLOGP
-2.46
MLOGP
-2.16
XLogP3
-3.9
Consensus LogP
-2.84
Log S (ESOL)
0.45
Class (ESOL)
Highly soluble
Log S (Ali)
0.66
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.79
Class (SILICOS-IT)
Highly 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)
-5.62

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

Get In Touch

Contact Us