CAS RN: 926281-37-0

GGSTOPTM

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7 package records6 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250407 100mg In stock Shanghai Inquiry
Batchno.20250727 10mg In stock Shanghai Inquiry
Batchno.20260118 1mg In stock Shanghai Inquiry
Batchno.20260320 25mg In stock Shanghai Inquiry
Batchno.20250831 50mg In stock Shanghai Inquiry
Batchno.20251121 5mg In stock Shanghai Inquiry
Batchno.20250514 5mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS926281-37-0
  • Purity/Analytical Methods: >99.0%
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926281-37-0 / 2-amino-4-[[3-(carboxymethyl)phenoxy]-methoxyphosphoryl]butanoic acid

Standard CAS: 926281-37-0 Multi CAS: Yes

Basic Information

CAS
926281-37-0
Multi CAS
Yes
Molecular Formula
C13H18NO7P
Molecular Weight
331.260000
Exact Mass
331.082089
InChI
InChI=1S/C13H18NO7P/c1-20-22(19,6-5-11(14)13(17)18)21-10-4-2-3-9(7-10)8-12(15)16/h2-4,7,11H,5-6,8,14H2,1H3,(H,15,16)(H,17,18)
InChIKey
NTFPDEDRMYYPAC-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
22
Aromatic heavy atom count
6
Fraction Csp3
0.38
Rotatable bonds
9
H-bond acceptors
6
H-bond donors
3
Molar refractivity
78.12
TPSA
136.15

LogP / Solubility

WLOGP
1.33
MLOGP
1.19
XLogP3
-2.5
Consensus LogP
0.01
Log S (ESOL)
-2.34
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.24
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.79

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
No
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3.5

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