CAS RN: 7776-34-3

L-Proline hydrochloride

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250316 1g / 5g / 25g Confirm by inquiry Shanghai Inquiry
  • Product code: starshine_CAS7776-34-3
  • Purity/Analytical Methods: >99.0%
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7776-34-3 / (2S)-pyrrolidine-2-carboxylic acid;hydrochloride

Standard CAS: 7776-34-3 Multi CAS: Yes

Basic Information

CAS
7776-34-3
Multi CAS
Yes
Molecular Formula
C5H10CLNO2
Molecular Weight
151.590000
Exact Mass
151.040006
InChI
InChI=1S/C5H9NO2.ClH/c7-5(8)4-2-1-3-6-4;/h4,6H,1-3H2,(H,7,8);1H/t4-;/m0./s1
InChIKey
UAGFTQCWTTYZKO-WCCKRBBISA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Fraction Csp3
0.8
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
35.91
TPSA
49.33

LogP / Solubility

WLOGP
0.24
MLOGP
0.21
XLogP3
0.24
Consensus LogP
0.23
Log S (ESOL)
-0.87
Class (ESOL)
Very soluble
Log S (Ali)
-0.98
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.97
Class (SILICOS-IT)
Very 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)
-3.47

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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