CAS RN: 24583-23-1

N-CARBAMOYL-L-CYSTEINE

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251216 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS24583-23-1
  • Purity/Analytical Methods: >99.0%
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24583-23-1 / (2R)-2-(carbamoylamino)-3-sulfanylpropanoic acid

Standard CAS: 24583-23-1 Multi CAS: No

Basic Information

CAS
24583-23-1
Multi CAS
No
Molecular Formula
C4H8N2O3S
Molecular Weight
164.190000
Exact Mass
164.025563
SMILES
C([C@@H](C(=O)O)NC(=O)N)S
InChI
InChI=1S/C4H8N2O3S/c5-4(9)6-2(1-10)3(7)8/h2,10H,1H2,(H,7,8)(H3,5,6,9)/t2-/m0/s1
InChIKey
APFSAMXTZRYBKF-REOHCLBHSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
0.5
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
4
Molar refractivity
38
TPSA
92.42

LogP / Solubility

WLOGP
-0.96
MLOGP
-0.85
XLogP3
-0.2
Consensus LogP
-0.67
Log S (ESOL)
-0.05
Class (ESOL)
Very soluble
Log S (Ali)
-0.21
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.29
Class (SILICOS-IT)
Very 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)
-4.4

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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