Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2413959384-0
Structure
Show compound
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 | 33 USD | 90 | 17 working days | Get Quote |
| 5 mg | 50 USD | 90 | 17 working days | Get Quote |
| 10 mg | 64 USD | 90 | 17 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-2413959384-0.sdf |
| SMILES | MCULE-2413959384-0.smiles |
| Standard InChI | MCULE-2413959384-0.inchi |
| InChIKey | MCULE-2413959384-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-886736733 | A2B Chem | Predominantly Building Block in stock | 97 | As is | in stock |
| P-890182568 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-851579256 | AmBeed | On request | N/A | As is | by synthesis |
| P-596280202 | Asinex | General screening catalog | 90 | As is | 1000 mg |
| P-596486922 | Asinex | General bb catalog | 90 | As is | 1000 mg |
| P-889844744 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-615691259 | BLD pharm | Non-stock building blocks | 98 | As is | by synthesis |
| P-887190812 | Combi-Blocks | Building Block on demand | 95 | As is | by synthesis |
| P-492230677 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-502917354 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-12381674 | InterBioScreen | Screening Compounds | 92 | As is | 173 mg |
| P-601066902 | Life Chemicals | Screening Compounds | 90 | As is | 105 mg |
| P-852383277 | Matrix Scientific | All | N/A | As is | in stock |
| P-872796439 | MedChemExpress | In stock Building Blocks | 95 | As is | in stock |
| P-650095350 | Otava | Tangible screening compounds | 90 | As is | by synthesis |
| P-19782967 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-491106859 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-502335002 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-22529481 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 30 mg |
| P-1636666 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 30 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 224.174 |
| logP | -1.4921 |
| H-bond acceptors | 8 |
| H-bond donors | 2 |
| Rotatable bonds | 2 |
| PSA | 109.98 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 53.7165 |
| Atoms | 24 |
| Rings | 2 |
| Heavy atoms | 16 |
| Hydrogen atoms | 8 |
| Heteroatoms | 8 |
| N/O atoms | 8 |
| 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 |
