CAS RN: 16428-75-4

L-Serine hydrochloride

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Batchno.20250114 1g Out of stock 15 business days Inquiry
  • Product code: starshine_CAS16428-75-4
  • Purity/Analytical Methods: >99.0%
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16428-75-4 / (2S)-2-amino-3-hydroxypropanoic acid;hydrochloride

Standard CAS: 16428-75-4 Multi CAS: No

Basic Information

CAS
16428-75-4
Multi CAS
No
Molecular Formula
C3H8ClNO3
Molecular Weight
141.550000
Exact Mass
141.019271
SMILES
C([C@@H](C(=O)O)N)O.Cl
InChI
InChI=1S/C3H7NO3.ClH/c4-2(1-5)3(6)7;/h2,5H,1,4H2,(H,6,7);1H/t2-;/m0./s1
InChIKey
STMOVTSFWYRCOB-DKWTVANSSA-N

Computed Properties

Structural Parameters

Heavy atom count
8
Fraction Csp3
0.67
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
3
Molar refractivity
29.94
TPSA
83.55

LogP / Solubility

WLOGP
-1.19
MLOGP
-1.05
XLogP3
-1.19
Consensus LogP
-1.14
Log S (ESOL)
0.16
Class (ESOL)
Highly soluble
Log S (Ali)
0.14
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.17
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)
-4.43

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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