Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3450011527
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 | 6 USD | 97 | 20 working days | Get Quote |
| 5 mg | 6 USD | 97 | 20 working days | Get Quote |
| 10 mg | 6 USD | 97 | 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-3450011527.sdf |
| SMILES | MCULE-3450011527.smiles |
| Standard InChI | MCULE-3450011527.inchi |
| InChIKey | MCULE-3450011527.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867565985 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875725437 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-535625074 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505398333 | AK Scientific | Building Blocks | 97 | As is | in stock |
| P-580199368 | Aldlab Chemicals | Building Block Stock | 95 | As is | 17 g |
| P-606948194 | AmBeed | In stock | N/A | As is | in stock |
| P-489111543 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596929194 | Angene | Building Blocks in stock | 97 | As is | 2 kg |
| P-494348497 | Apollo Scientific | In Stock | 95 | As is | 6.7217 kg |
| P-864117851 | AstaTech | In Stock BBs | 97 | As is | in stock |
| P-481172214 | Atlantic Research Chemicals Ltd | In-stock Building Blocks | 95 | As is | 486 g |
| P-893223645 | Biosynth | In Stock | 95 | As is | in stock |
| P-868598655 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
| P-580434423 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-896533154 | FluoroChem | In Stock BB | N/A | As is | 5 g |
| P-870657417 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-488551054 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-500150816 | J&W Pharmlab | In-stock compounds | 97 | As is | in stock |
| P-454400580 | Key Organics | Building Blocks | 95 | As is | 100 g |
| P-454316348 | Key Organics | Screening Compounds and Fragments | 95 | As is | 100 mg |
| P-579614957 | LabSeeker, Inc | Stock Collection | 95 | As is | in stock |
| P-613276637 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-580478204 | Manchester Organics | Compounds on demand | 97 | As is | by synthesis |
| P-852452843 | Matrix Scientific | All | N/A | As is | in stock |
| P-620075529 | Otava | In-House Stock Library | 90 | As is | 1000 mg |
| P-620225612 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 1000 mg |
| P-888883570 | PharmaBlock | In stock | N/A | As is | in stock |
| P-454369291 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-500381558 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-605214780 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885528502 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-596743994 | Synthonix | In-stock Building Blocks | 97 | As is | 85.941 kg |
| P-502362827 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611350315 | Toronto Research | In stock | 90 | As is | in stock |
| P-35131403 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1000 mg |
| P-464681288 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1000 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 138.991 |
| logP | 0.7637 |
| H-bond acceptors | 1 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 20.23 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 25.5668 |
| Atoms | 12 |
| Rings | 0 |
| Heavy atoms | 5 |
| Hydrogen atoms | 7 |
| Heteroatoms | 2 |
| N/O atoms | 1 |
| 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 |
