Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2746074430
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 | 5 USD | 98 | 9 working days | Get Quote |
| 5 mg | 5 USD | 98 | 9 working days | Get Quote |
| 10 mg | 5 USD | 98 | 9 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-2746074430.sdf |
| SMILES | MCULE-2746074430.smiles |
| Standard InChI | MCULE-2746074430.inchi |
| InChIKey | MCULE-2746074430.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867564514 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875723973 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-597027872 | AEchem | Building blocks | 97 | As is | in stock |
| P-597027405 | AEchem | Building blocks | 98 | As is | in stock |
| P-535627310 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505393321 | AK Scientific | Building Blocks | 97 | As is | in stock |
| P-580238620 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
| P-606831626 | AmBeed | In stock | N/A | As is | in stock |
| P-489157109 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596946485 | Angene | Building Blocks in stock | 98 | As is | 9.44 kg |
| P-494320191 | Apollo Scientific | In Stock | 95 | As is | in stock |
| P-864094491 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-580696216 | BLD pharm | In-stock building blocks | 98 | As is | 266 g |
| P-505604391 | Chemcia | Virtual compounds | 97 | As is | by synthesis |
| P-851244817 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868582432 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-580287384 | Debye Scientific | General Catalog | N/A | As is | by resynthesis (? - ? days) |
| P-861922130 | FluoroChem | General BB | N/A | As is | in stock |
| P-505496633 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-454343336 | Key Organics | Screening Compounds and Fragments | 90 | As is | 255 mg |
| P-579613263 | LabSeeker, Inc | Stock Collection | 98 | As is | in stock |
| P-31197381 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-580481398 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852377160 | Matrix Scientific | All | N/A | As is | in stock |
| P-428002300 | Maybridge | Screening Collection | 95 | As is | 175 g |
| P-854736481 | MedChemExpress | In stock Building Blocks | 95 | As is | in stock |
| P-500406698 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-596771899 | Synthonix | In-stock Building Blocks | 98 | As is | 9.939 kg |
| P-502371441 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611368494 | Toronto Research | In stock | 90 | As is | in stock |
| P-615394990 | eNovation Chemicals LLC | Building Blocks in stock | 97 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 156.111 |
| logP | 1.2295 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 57.53 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 35.3823 |
| Atoms | 16 |
| Rings | 1 |
| Heavy atoms | 11 |
| Hydrogen atoms | 5 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
