Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3233383617-0
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 | 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-3233383617-0.sdf |
| SMILES | MCULE-3233383617-0.smiles |
| Standard InChI | MCULE-3233383617-0.inchi |
| InChIKey | MCULE-3233383617-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867566788 | A2B Chem | Predominantly Building Block in stock | 97 | As is | in stock |
| P-867482258 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-875726736 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-893591373 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 33.192 kg |
| P-606847917 | AmBeed | In stock | N/A | As is | in stock |
| P-489134617 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-851151188 | Angene | Building Blocks in stock | 98 | As is | 3.5 kg |
| P-895927032 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-596308405 | Asinex | General screening catalog | 90 | As is | unavailable |
| P-864183641 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-590600442 | BLD pharm | In-stock building blocks | 97 | As is | 757 g |
| P-893239230 | Biosynth | In Stock | 95 | As is | in stock |
| P-868596106 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
| P-862147002 | FluoroChem | General BB | 97 | As is | in stock |
| P-870652382 | Glentham Life Sciences | Compounds typically in stock | N/A | As is | in stock |
| P-505494434 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-427916989 | InterBioScreen | Natural Compounds | 92 | As is | 27 mg |
| P-500382577 | Pi Chemicals | Virtual Compounds | 97 | As is | by synthesis |
| P-453923148 | Specs | Screening Compounds | 90 | As is | 411 mg |
| P-33178588 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 1 mg |
| P-893995651 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 309.278 |
| logP | -0.3118 |
| H-bond acceptors | 10 |
| H-bond donors | 2 |
| Rotatable bonds | 8 |
| PSA | 128.2 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 75.3214 |
| Atoms | 37 |
| Rings | 2 |
| Heavy atoms | 22 |
| Hydrogen atoms | 15 |
| Heteroatoms | 10 |
| N/O atoms | 10 |
| 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 |
