Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3421468277
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 | 8 USD | N/A | 9 working days | Get Quote |
| 5 mg | 8 USD | N/A | 9 working days | Get Quote |
| 10 mg | 8 USD | N/A | 9 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-3421468277.sdf |
| SMILES | MCULE-3421468277.smiles |
| Standard InChI | MCULE-3421468277.inchi |
| InChIKey | MCULE-3421468277.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867563586 | A2B Chem | Predominantly Building Block in stock | 97 | As is | in stock |
| P-875722768 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869184564 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-869221127 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-588247988 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-606911878 | AmBeed | In stock | N/A | As is | in stock |
| P-489119757 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-596945948 | Angene | Building Blocks in stock | 98 | As is | 300 g |
| P-494345478 | Apollo Scientific | In Stock | 95 | As is | unavailable |
| P-864215953 | AstaTech | Backordered BBs | 97 | As is | by synthesis |
| P-580721274 | BLD pharm | In-stock building blocks | 97 | As is | 640 g |
| P-448676991 | ChemDiv | Discovery Chemistry Library | 90 | As is | 361 mg |
| P-851306186 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868642410 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
| P-580292728 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-889115489 | FluoroChem | In Stock BB | 95 | As is | 10 g |
| P-505515194 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-502510887 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-502905505 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-492227109 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-454398714 | Key Organics | Building Blocks | 95 | As is | 182 mg |
| P-454311898 | Key Organics | Screening Compounds and Fragments | 95 | As is | 182 mg |
| P-613333448 | Life Chemicals | Building Blocks - virtual | 95 | As is | by synthesis |
| P-460524305 | Life Chemicals | Screening Compounds | 90 | As is | 7.268 g |
| P-580503747 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852506620 | Matrix Scientific | All | N/A | As is | in stock |
| P-35162986 | Maybridge | Screening Collection | 90 | As is | 8.937 kg |
| P-500405733 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-19010986 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885516473 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-596780511 | Synthonix | In-stock Building Blocks | 97 | As is | 2.01 kg |
| P-22824098 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-502370748 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611520374 | Toronto Research | In stock | 90 | As is | in stock |
| P-1115840 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 3.659 g |
| P-3219957 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 3.659 g |
| P-893996113 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 216.217 |
| logP | 2.8549 |
| H-bond acceptors | 6 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 114.36 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 51.2244 |
| Atoms | 22 |
| Rings | 1 |
| Heavy atoms | 14 |
| Hydrogen atoms | 8 |
| Heteroatoms | 7 |
| N/O atoms | 6 |
| 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 |
