Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2441163379
Compound
Show structure
In order to add this molecule to a collection you have to create an account.
Sign up for free
- 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 | 51 USD | N/A | 49 working days | Get Quote |
| 5 mg | 51 USD | N/A | 49 working days | Get Quote |
| 10 mg | 51 USD | N/A | 49 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
- 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-2441163379.sdf |
| SMILES | MCULE-2441163379.smiles |
| Standard InChI | MCULE-2441163379.inchi |
| InChIKey | MCULE-2441163379.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867624291 | A2B Chem | Predominantly Building Block in stock | 97 | As is | in stock |
| P-875786857 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-590373985 | AK Scientific | Building Blocks | 97 | As is | in stock |
| P-606907736 | AmBeed | In stock | N/A | As is | in stock |
| P-596964963 | Angene | Building Blocks in stock | 97 | As is | 1.75 g |
| P-596495623 | Asinex | General bb catalog | 90 | As is | 1000 mg |
| P-596439362 | Asinex | General screening catalog | 90 | As is | 1000 mg |
| P-864171514 | AstaTech | In Stock BBs | 97 | As is | in stock |
| P-580725022 | BLD pharm | In-stock building blocks | 97 | As is | 1000 mg |
| P-504736990 | ChemBridge | RUSH - EXPRESS PICK LIBRARY | 90 | As is | 5 mg |
| P-577173731 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-887066860 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-889358047 | FluoroChem | General BB | N/A | As is | in stock |
| P-488546345 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-13311389 | InterBioScreen | Screening Compounds | 92 | As is | 300 mg |
| P-524189966 | Key Organics | Building Blocks | 97 | As is | 250 mg |
| P-613335981 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-852402132 | Matrix Scientific | All | N/A | As is | in stock |
| P-854799897 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-888842413 | PharmaBlock | On demand | N/A | As is | by synthesis |
| P-454370786 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-13629930 | Pharmeks LLC | Synthetic compounds | 92 | As is | 300 mg |
| P-19063837 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-596782910 | Synthonix | In-stock Building Blocks | 97 | As is | 1.75 g |
| P-502333514 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611587655 | Toronto Research | In stock | 90 | As is | in stock |
| P-3238758 | VITAS M CHEMICAL LIMITED | Collections of Fragments for Fragment-based Drug Discovery | 90 | As is | 4.107 g |
| P-886950759 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 190.284 |
| logP | 3.1513 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 29.26 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 65.1024 |
| Atoms | 32 |
| Rings | 2 |
| Heavy atoms | 14 |
| Hydrogen atoms | 18 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| 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 |
