Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-5607974068
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 | 7 USD | 98 | 20 working days | Get Quote |
| 5 mg | 7 USD | 98 | 20 working days | Get Quote |
| 10 mg | 7 USD | 98 | 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-5607974068.sdf |
| SMILES | MCULE-5607974068.smiles |
| Standard InChI | MCULE-5607974068.inchi |
| InChIKey | MCULE-5607974068.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867582730 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875741419 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869188957 | AK Scientific | Building Blocks | 97 | As is | in stock |
| P-505348047 | AK Scientific | Building Blocks | 99 | As is | in stock |
| P-580243018 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
| P-617061700 | Allbio Pharm | In stock | N/A | As is | in stock |
| P-606897578 | AmBeed | In stock | N/A | As is | in stock |
| P-489143962 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-489148451 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596953138 | Angene | Building Blocks in stock | 98 | As is | 32.5 kg |
| P-494346255 | Apollo Scientific | In Stock | 95 | As is | 141.269 kg |
| P-864184835 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-580735125 | BLD pharm | In-stock building blocks | 95 | As is | 1.825 kg |
| P-893233557 | Biosynth | In Stock | 95 | As is | in stock |
| P-881080772 | Career Henan Chemical Co. (coreychem) | All products | N/A | As is | in stock |
| P-868595948 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-580281876 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-861987723 | FluoroChem | General BB | N/A | As is | in stock |
| P-870656315 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-505492704 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-493674709 | Iris Biotech GmbH | Building Block Library | N/A | As is | in stock |
| P-454407621 | Key Organics | Building Blocks | 97 | As is | 100 mg |
| P-454330784 | Key Organics | Screening Compounds and Fragments | 97 | As is | 100 mg |
| P-31219138 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-852444479 | Matrix Scientific | All | N/A | As is | in stock |
| P-885539369 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-896077815 | Specs | Repurposed Compounds | N/A | As is | 25.849 g |
| P-502372773 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611434119 | Toronto Research | In stock | 90 | As is | in stock |
| P-615390283 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 196.244 |
| logP | 3.226 |
| H-bond acceptors | 1 |
| H-bond donors | 0 |
| Rotatable bonds | 2 |
| PSA | 17.07 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 61.2825 |
| Atoms | 27 |
| Rings | 2 |
| Heavy atoms | 15 |
| Hydrogen atoms | 12 |
| Heteroatoms | 1 |
| N/O atoms | 1 |
| 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 |
