Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2693804512
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 | 17 USD | 96 | 20 working days | Get Quote |
| 5 mg | 17 USD | 96 | 20 working days | Get Quote |
| 10 mg | 17 USD | 96 | 20 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-2693804512.sdf |
| SMILES | MCULE-2693804512.smiles |
| Standard InChI | MCULE-2693804512.inchi |
| InChIKey | MCULE-2693804512.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-875729992 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-597027286 | AEchem | Building blocks | 97 | As is | in stock |
| P-869180929 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505347741 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-893513714 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 737.26 g |
| P-580238501 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
| P-594279781 | Alinda | Building Blocks | 95 | As is | 1000 mg |
| P-851519086 | AmBeed | On request | N/A | As is | by synthesis |
| P-489126242 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-597002582 | Angene | Building Blocks in stock | 96 | As is | 300 g |
| P-589657799 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-864103471 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-615695461 | BLD pharm | Non-stock building blocks | 98 | As is | by synthesis |
| P-878235748 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868578434 | Combi-Blocks | Building Block in stock | 95 | As is | in stock |
| P-580407299 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-861985672 | FluoroChem | General BB | 95 | As is | in stock |
| P-505509747 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-454415417 | Key Organics | Building Blocks | 90 | As is | 15.811 g |
| P-18817578 | Key Organics | Screening Compounds and Fragments | 90 | As is | 15.811 g |
| P-580472626 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852441815 | Matrix Scientific | All | N/A | As is | in stock |
| P-854732158 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-500372736 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-896083800 | Specs | Repurposed Compounds | N/A | As is | 2.309 g |
| P-596785124 | Synthonix | In-stock Building Blocks | 95 | As is | 355.32 g |
| P-873223675 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611426755 | Toronto Research | In stock | 90 | As is | in stock |
| P-615451242 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 157.193 |
| logP | 1.2381 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 2 |
| PSA | 67.43 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 38.3595 |
| Atoms | 17 |
| Rings | 1 |
| Heavy atoms | 10 |
| Hydrogen atoms | 7 |
| Heteroatoms | 4 |
| 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 |
