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CAS 173039-10-6 PMPA(NAALADaseinhibitor) molecular structure lightbox
CAS RN: 173039-10-6

PMPA(NAALADaseinhibitor)

Product Availability

Choose a grade to view its available package options.

7 package records6 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250218 1ml Out of stock 8-10 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250115 100mg In stock Shanghai Inquiry
Batchno.20250709 10mg In stock Shanghai Inquiry
Batchno.20260228 250mg In stock Shanghai Inquiry
Batchno.20260428 25mg In stock Shanghai Inquiry
Batchno.20250617 50mg In stock Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260507 5mg / 10mg / 50mg / 100mg Confirm by inquiry Shanghai, Shandong Inquiry
  • Product code: SSC-076020
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 0.25g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 173039-10-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Shenzhen Inquiry

173039-10-6 / 2-(phosphonomethyl)pentanedioic acid

Standard CAS: 173039-10-6 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
173039-10-6
Multi CAS
No
Molecular Formula
C6H11O7P
Molecular Weight
226.120000
Exact Mass
226.024240
SMILES
C(CC(=O)O)C(CP(=O)(O)O)C(=O)O
InChI
InChI=1S/C6H11O7P/c7-5(8)2-1-4(6(9)10)3-14(11,12)13/h4H,1-3H2,(H,7,8)(H,9,10)(H2,11,12,13)
InChIKey
ISEYJGQFXSTPMQ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Fraction Csp3
0.67
Rotatable bonds
6
H-bond acceptors
3
H-bond donors
4
Molar refractivity
44.91
TPSA
132.13

LogP / Solubility

WLOGP
-0.27
MLOGP
-0.23
XLogP3
-2.2
Consensus LogP
-0.9
Log S (ESOL)
-0.68
Class (ESOL)
Very soluble
Log S (Ali)
-1.22
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.63
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)
-4.29

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364

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