MCULE-1734278190
- InChIKey:
- SMILES:
- InChI:
- Formula:
Amount | Price
Optimized compound price excluding delivery costs. Please note that automatic quote generation will optimize the total price based on your preferences.
|
Guaranteed purity (%) | Delivery time
Estimated door-to-door delivery time for EU and US customers. It will be refined and optimized during quote generation after the shipping country is specified.
|
|
---|---|---|---|---|
1 mg | 33 USD | 90 | 19 working days | Get Quote |
5 mg | 50 USD | 90 | 19 working days | Get Quote |
10 mg | 63 USD | 90 | 19 working days | Get Quote |
- 1-Click Docking Predict the binding orientation and affinity of the ligand to a target.
- Toxicity checker Searching for substructures commonly found in toxic and promiscuous ligands.
- Property calculator Create a physicochemical property profile for the compound in a second.
- Similarity search Find analogs by similarity search.
- Substructure search Find analogs by substructure search.
Name | File |
---|---|
SDF | MCULE-1734278190.sdf |
SMILES | MCULE-1734278190.smiles |
Standard InChI | MCULE-1734278190.inchi |
InChIKey | MCULE-1734278190.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-886620009 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
P-875804213 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-612937390 | AK Scientific | Building Blocks | 95 | As is | in stock |
P-851904614 | AmBeed | On request | N/A | As is | by synthesis |
P-870024993 | Asinex | General screening catalog | 90 | As is | 889 mg |
P-889811273 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
P-591057312 | BLD pharm | Non-stock building blocks | 98 | As is | by synthesis |
P-619930488 | ChemDiv | Building Blocks on demand | 90 | As is | by synthesis |
P-874522471 | ChemDiv | Discovery Chemistry Library | 90 | As is | unavailable |
P-861552511 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
P-488548173 | InterBioScreen | Building Blocks | 90 | As is | in stock |
P-13587825 | InterBioScreen | Screening Compounds | 92 | As is | 300 mg |
P-596588499 | Key Organics | Building Blocks | 90 | As is | 1000 mg |
P-588250769 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
P-852387190 | Matrix Scientific | All | N/A | As is | in stock |
P-869013454 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-854913854 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-454367264 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
P-13753449 | Pharmeks LLC | Synthetic compounds | 92 | As is | 300 mg |
P-23969404 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
P-885517910 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
P-873237216 | TimTec | Building Block Collection | 90 | As is | in stock |
P-873212305 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
P-33588212 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
P-611601561 | Toronto Research | In stock | 90 | As is | in stock |
P-3229145 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 5.004 g |
P-2200808 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 5.004 g |
P-893724811 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
Property | Value |
---|---|
Components | 1 |
Mass | 213.231 |
logP | 2.4731 |
H-bond acceptors | 3 |
H-bond donors | 0 |
Rotatable bonds | 4 |
PSA | 39.19 |
RO5 violations | 0 |
RO3 violations | 1 |
Refractivity | 60.6035 |
Atoms | 27 |
Rings | 2 |
Heavy atoms | 16 |
Hydrogen atoms | 11 |
Heteroatoms | 3 |
N/O atoms | 3 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
Chiral centers | 0 |
R/S chiral centers | 0 |
Unknown chiral centers | 0 |
Undefined chiral centers | 0 |
Stereo double bonds | 0 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |