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CAS 2185-02-6 L-HOMOSERINE LACTONE, HYDROCHLORIDE molecular structure lightbox
CAS RN: 2185-02-6

L-HOMOSERINE LACTONE, HYDROCHLORIDE

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260108 25mg / 100mg / 250mg / 1g Confirm by inquiry Shanghai Inquiry
  • Product code: starshine_CAS2185-02-6
  • Purity/Analytical Methods: >99.0%
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2185-02-6 / (3S)-3-aminooxolan-2-one

Standard CAS: 2185-02-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
2185-02-6
Multi CAS
No
Molecular Formula
C4H7NO2
Molecular Weight
101.100000
Exact Mass
101.047678
SMILES
C1COC(=O)[C@H]1N
InChI
InChI=1S/C4H7NO2/c5-3-1-2-7-4(3)6/h3H,1-2,5H2/t3-/m0/s1
InChIKey
QJPWUUJVYOJNMH-VKHMYHEASA-N

Computed Properties

Structural Parameters

Heavy atom count
7
Fraction Csp3
0.75
H-bond acceptors
3
H-bond donors
1
Molar refractivity
23.55
TPSA
52.32

LogP / Solubility

WLOGP
-0.74
MLOGP
-0.66
XLogP3
-0.6
Consensus LogP
-0.67
Class (ESOL)
Very soluble
Log S (Ali)
0.14
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.3
Class (SILICOS-IT)
Highly soluble

ADME

GI absorption
Low
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)
-3.86

Drug-likeness / Medicinal Chemistry

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

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