[email protected]
CAS 90495-95-7 N-(3-Aminopropyl)glycine Dihydrochloride molecular structure lightbox
CAS RN: 90495-95-7

N-(3-Aminopropyl)glycine Dihydrochloride

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250312 200mg / 1g / 5g Out of stock 5-7 business days Inquiry
  • Product code: ICTA1198
  • Purity/Analytical Methods: >97.0%(T)
GET A QUOTE

90495-95-7 / 2-(3-aminopropylamino)acetic acid;dihydrochloride

Standard CAS: 90495-95-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
90495-95-7
Multi CAS
No
Molecular Formula
C5H14CL2N2O2
Molecular Weight
205.080000
Exact Mass
204.043233
InChI
InChI=1S/C5H12N2O2.2ClH/c6-2-1-3-7-4-5(8)9;;/h7H,1-4,6H2,(H,8,9);2*1H
InChIKey
JQQTXSWVGCRXGJ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
0.8
Rotatable bonds
5
H-bond acceptors
3
H-bond donors
3
Molar refractivity
48.67
TPSA
75.35

LogP / Solubility

WLOGP
-0.15
MLOGP
-0.13
XLogP3
-0.15
Consensus LogP
-0.14
Log S (ESOL)
-0.69
Class (ESOL)
Very soluble
Log S (Ali)
-1.14
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.47
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)
-4.08

Drug-likeness / Medicinal Chemistry

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

Customers Also Viewed

Get In Touch

Contact Us