Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4649208475-0
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 | 5 USD | 98 | 14 working days | Get Quote |
| 5 mg | 5 USD | 98 | 14 working days | Get Quote |
| 10 mg | 5 USD | 98 | 14 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-4649208475-0.sdf |
| SMILES | MCULE-4649208475-0.smiles |
| Standard InChI | MCULE-4649208475-0.inchi |
| InChIKey | MCULE-4649208475-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867561716 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-867513386 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-875722201 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869182807 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505348199 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-869269613 | AK Scientific | Building Blocks | 99 | As is | in stock |
| P-903051468 | Aaron Chemicals LLC | Predominantly Building Block | 98 | As is | 49 kg |
| P-580237300 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
| P-606838232 | AmBeed | In stock | N/A | As is | in stock |
| P-489195776 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596927998 | Angene | Building Blocks in stock | 98 | As is | 300 g |
| P-494322462 | Apollo Scientific | In Stock | 95 | As is | 227.25 g |
| P-864117961 | AstaTech | In Stock BBs | 97 | As is | in stock |
| P-481171836 | Atlantic Research Chemicals Ltd | In-stock Building Blocks | 95 | As is | 1.6 kg |
| P-454639476 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-868583013 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-889110123 | FluoroChem | In Stock BB | N/A | As is | 25 g |
| P-870656422 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-505495215 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-492220397 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-488550455 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-12462491 | InterBioScreen | Screening Compounds | 95 | As is | 1 mg |
| P-856000801 | Key Organics | Screening Compounds and Fragments | 90 | As is | 100 mg |
| P-579613281 | LabSeeker, Inc | Stock Collection | 98 | As is | in stock |
| P-31208190 | LaboTest | Screening Collection | 90 | As is | unavailable |
| P-904195048 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-615308697 | Life Chemicals | Screening Compounds | 90 | As is | 284 mg |
| P-892092522 | Manchester Organics | Compounds on demand | 97 | As is | by synthesis |
| P-852381134 | Matrix Scientific | All | N/A | As is | in stock |
| P-855402376 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-454368813 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-590206018 | Pharmeks LLC | Synthetic compounds | 92 | As is | 300 mg |
| P-885523031 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-605208947 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-596762842 | Synthonix | In-stock Building Blocks | 98 | As is | 2.28 kg |
| P-502331146 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-1303830 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1000 mg |
| P-3220512 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1000 mg |
| P-575319172 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 215.985 |
| logP | 3.4072 |
| H-bond acceptors | 1 |
| H-bond donors | 0 |
| Rotatable bonds | 1 |
| PSA | 12.89 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 39.259 |
| Atoms | 14 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 2 |
| Heteroatoms | 6 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 5 |
| 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 |
