CAS RN: 291758-32-2

N-OMEGA-HYDROXYL-NOR-L-ARGININE, DIHYDROCHLORIDE

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250330 100mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS291758-32-2
  • Purity/Analytical Methods: >99.0%
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291758-32-2 / (2S)-2-amino-4-[[amino-(hydroxyamino)methylidene]amino]butanoic acid

Standard CAS: 291758-32-2 Multi CAS: Yes

Basic Information

CAS
291758-32-2
Multi CAS
Yes
Molecular Formula
C5H12N4O3
Molecular Weight
176.170000
Exact Mass
176.090940
InChI
InChI=1S/C5H12N4O3/c6-3(4(10)11)1-2-8-5(7)9-12/h3,12H,1-2,6H2,(H,10,11)(H3,7,8,9)/t3-/m0/s1
InChIKey
KOBHCUDVWOTEKO-VKHMYHEASA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Fraction Csp3
0.6
Rotatable bonds
4
H-bond acceptors
4
H-bond donors
5
Molar refractivity
41.64
TPSA
133.96

LogP / Solubility

WLOGP
-1.92
MLOGP
-1.69
XLogP3
-4.6
Consensus LogP
-2.74
Log S (ESOL)
0.54
Class (ESOL)
Highly soluble
Log S (Ali)
0.38
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.31
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)
-5.16

Drug-likeness / Medicinal Chemistry

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

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