CAS RN: 84888-34-6
CYSTEINE(FM)-OH
Product Availability
Available package options are listed below.
1 package records0 with current stock
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20251008 | 5g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS84888-34-6
- Purity/Analytical Methods: >99.0%
84888-34-6 / (2R)-2-amino-3-(9H-fluoren-9-ylmethylsulfanyl)propanoic acid;hydrochloride
Basic Information
CAS
84888-34-6
Multi CAS
Yes
Molecular Formula
C17H18CLNO2S
Molecular Weight
335.800000
Exact Mass
335.074678
InChI
InChI=1S/C17H17NO2S.ClH/c18-16(17(19)20)10-21-9-15-13-7-3-1-5-11(13)12-6-2-4-8-14(12)15;/h1-8,15-16H,9-10,18H2,(H,19,20);1H/t16-;/m0./s1
InChIKey
JPEGSXXJPHXBPA-NTISSMGPSA-N
Computed Properties
Structural Parameters
Heavy atom count
22
Aromatic heavy atom count
12
Fraction Csp3
0.24
Rotatable bonds
5
H-bond acceptors
3
H-bond donors
2
Molar refractivity
93.91
TPSA
63.32
LogP / Solubility
WLOGP
3.37
MLOGP
2.98
XLogP3
3.37
Consensus LogP
3.24
Log S (ESOL)
-4.12
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.74
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.24
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.38
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
3
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- Product Code: starshine_CAS84907-53-9
- Purity/Analytical method: >99.0%
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