CAS RN: 193807-58-8
GELATINASE A
Product Availability
Choose a grade to view its available package options.
7 package records6 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250121 | 5mg | Out of stock | 8-10 business days | Inquiry |
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250310 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20250607 | 10mg | In stock | Shanghai | Inquiry | |
| Batchno.20251211 | 250mg | In stock | Shanghai | Inquiry | |
| Batchno.20260306 | 25mg | In stock | Shanghai | Inquiry | |
| Batchno.20260409 | 50mg | In stock | Shanghai | Inquiry | |
| Batchno.20250415 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS193807-58-8
- Purity/Analytical Methods: >99.0%
193807-58-8 / (2R)-3-phenyl-2-[(4-phenylphenyl)sulfonylamino]propanoic acid
Basic Information
CAS
193807-58-8
Multi CAS
No
Molecular Formula
C21H19NO4S
Molecular Weight
381.400000
Exact Mass
381.103479
SMILES
C1=CC=C(C=C1)C[C@H](C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)C3=CC=CC=C3
InChI
InChI=1S/C21H19NO4S/c23-21(24)20(15-16-7-3-1-4-8-16)22-27(25,26)19-13-11-18(12-14-19)17-9-5-2-6-10-17/h1-14,20,22H,15H2,(H,23,24)/t20-/m1/s1
InChIKey
JBYHBQIDTNHWJF-HXUWFJFHSA-N
Computed Properties
Structural Parameters
Heavy atom count
27
Aromatic heavy atom count
18
Fraction Csp3
0.1
Rotatable bonds
7
H-bond acceptors
3
H-bond donors
2
Molar refractivity
103.77
TPSA
83.47
LogP / Solubility
WLOGP
3.33
MLOGP
2.95
XLogP3
4.1
Consensus LogP
3.46
Log S (ESOL)
-4.33
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.09
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.74
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.68
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3
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