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CAS 439216-70-3 Glycine, N-(5-aminopentyl)- (9CI) molecular structure lightbox
CAS RN: 439216-70-3

Glycine, N-(5-aminopentyl)- (9CI)

  • Product code: SSC-151995
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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 439216-70-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Beijing Inquiry

439216-70-3 / 2-(5-aminopentylamino)acetic acid

Standard CAS: 439216-70-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
439216-70-3
Multi CAS
No
Molecular Formula
C7H16N2O2
Molecular Weight
160.210000
Exact Mass
160.121178
InChI
InChI=1S/C7H16N2O2/c8-4-2-1-3-5-9-6-7(10)11/h9H,1-6,8H2,(H,10,11)
InChIKey
RHTMZEMDWRPOIH-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
0.86
Rotatable bonds
7
H-bond acceptors
3
H-bond donors
3
Molar refractivity
43.41
TPSA
75.35

LogP / Solubility

WLOGP
-0.21
MLOGP
-0.19
XLogP3
-2.8
Consensus LogP
-1.07
Log S (ESOL)
-0.24
Class (ESOL)
Very soluble
Log S (Ali)
-0.72
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-1.37
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)
-3.85

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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