CAS RN: 284664-88-6

DL-LYSINE-4,4,5,5-D4 2HCL

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Batchno.20250913 100mg Out of stock 30 business days Inquiry
  • Product code: starshine_CAS284664-88-6
  • Purity/Analytical Methods: >99.0%
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284664-88-6 / 2,6-diamino-4,4,5,5-tetradeuteriohexanoic acid;dihydrochloride

Standard CAS: 284664-88-6 Multi CAS: Yes

Basic Information

CAS
284664-88-6
Multi CAS
Yes
Molecular Formula
C6H16CL2N2O2
Molecular Weight
223.130000
Exact Mass
222.083990
InChI
InChI=1S/C6H14N2O2.2ClH/c7-4-2-1-3-5(8)6(9)10;;/h5H,1-4,7-8H2,(H,9,10);2*1H/i1D2,2D2;;
InChIKey
JBBURJFZIMRPCZ-RIZDZYNXSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Fraction Csp3
0.83
Rotatable bonds
5
H-bond acceptors
3
H-bond donors
3
Molar refractivity
53.01
TPSA
89.34

LogP / Solubility

WLOGP
0.37
MLOGP
0.33
XLogP3
0.37
Consensus LogP
0.36
Log S (ESOL)
-1.1
Class (ESOL)
Soluble
Log S (Ali)
-1.62
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.99
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
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)
-3.79

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
2

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