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CAS 35554-98-4 D-Cysteic acid molecular structure lightbox
CAS RN: 35554-98-4

D-Cysteic acid

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250928 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS35554-98-4
  • Purity/Analytical Methods: >99.0%
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35554-98-4 / 2-amino-3-sulfopropanoic acid

Standard CAS: 35554-98-4 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
35554-98-4
Multi CAS
Yes
Molecular Formula
C3H7NO5S
Molecular Weight
169.160000
Exact Mass
169.004494
InChI
InChI=1S/C3H7NO5S/c4-2(3(5)6)1-10(7,8)9/h2H,1,4H2,(H,5,6)(H,7,8,9)/t2-/m1/s1
InChIKey
XVOYSCVBGLVSOL-UWTATZPHSA-N

Physical Properties

Physical Description
Solid; [Merck Index] Solid
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
0.67
Rotatable bonds
3
H-bond acceptors
4
H-bond donors
3
Molar refractivity
32.03
TPSA
117.69

LogP / Solubility

WLOGP
-1.71
MLOGP
-1.51
XLogP3
-4.5
Consensus LogP
-2.57
Log S (ESOL)
0.39
Class (ESOL)
Highly soluble
Log S (Ali)
0.29
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.3
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)
-4.97

Drug-likeness / Medicinal Chemistry

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

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