Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
UNKNOWN STEREO
MCULE-3783758021
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-3783758021.sdf |
| SMILES | MCULE-3783758021.smiles |
| Standard InChI | MCULE-3783758021.inchi |
| InChIKey | MCULE-3783758021.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867588524 | A2B Chem | Predominantly Building Block in stock | 97 | As is | in stock |
| P-875747836 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-535625924 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505353508 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-608431164 | Aldlab Chemicals | Building Block Stock | 95 | As is | 725.455 g |
| P-606918763 | AmBeed | In stock | N/A | As is | in stock |
| P-596955372 | Angene | Building Blocks in stock | 97 | As is | 26.53 kg |
| P-864136494 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-428630754 | Eximed | In-stock screening compounds | 90 | As is | 3.87 g |
| P-505506993 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-505537591 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-580005872 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-502967282 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-34030576 | Otava | In-House Stock Library | 90 | As is | 1000 mg |
| P-500403417 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 223.225 |
| logP | 1.7768 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 6 |
| PSA | 75.63 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 56.8835 |
| Atoms | 29 |
| Rings | 1 |
| Heavy atoms | 16 |
| Hydrogen atoms | 13 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
