Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4993391700
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 | 37 USD | 92 | 18 working days | Get Quote |
| 5 mg | 54 USD | 90 | 19 working days | Get Quote |
| 10 mg | 69 USD | 90 | 19 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.
-
MCULE-8740794380
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-4993391700.sdf |
| SMILES | MCULE-4993391700.smiles |
| Standard InChI | MCULE-4993391700.inchi |
| InChIKey | MCULE-4993391700.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-893121011 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-852101674 | A2B Chem | Predominantly Building Block on demand | 98 | As is | by synthesis |
| P-867488599 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-901199616 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
| P-675189551 | AnalytiCon Discovery | Natural screening compounds (70%+) | 70 | As is | unavailable |
| P-25942897 | AnalytiCon Discovery | Natural screening compounds (70%+) | 70 | As is | 3 mg |
| P-888819395 | Angene | Building Blocks in stock | 98 | As is | unavailable |
| P-901416389 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-901416271 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-893246442 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-878203791 | Key Organics | Building Blocks | 95 | As is | 5 mg |
| P-878211350 | Key Organics | Building Blocks | 95 | As is | 5 mg |
| P-454414026 | Key Organics | Building Blocks | 90 | As is | 5 g |
| P-878204136 | Key Organics | Building Blocks | 95 | As is | 5 mg |
| P-878208639 | Key Organics | Building Blocks | 95 | As is | 5 mg |
| P-579619440 | LabSeeker, Inc | Stock Collection | 95 | As is | in stock |
| P-579648245 | LabSeeker, Inc | On demand Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-608272087 | Molnova | Stock | 98 | As is | in stock |
| P-33162606 | TimTec | ActiMol 1 Week - Stock | 90 | As is | 56 mg |
| P-894009088 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| P-893107519 | A2B Chem | Predominantly Building Block on demand | N/A | As a main component | by synthesis |
| P-870662588 | Glentham Life Sciences | Compounds maintained in stock | 98 | As a main component | in stock |
| P-856045441 | LaboTest | Building Blocks | 90 | As a main component | 2 g |
| P-13672595 | Pharmeks LLC | Natural & unique compounds | 92 | As a main component | 300 mg |
| P-675099019 | Princeton Biomolecular Research | Screening Compounds | 90 | As a main component | in stock |
| P-885533981 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As a main component | by synthesis |
| P-889852878 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As a main component | by synthesis |
| P-33162524 | TimTec | ActiMol 1 Week - Stock | 90 | As a main component | 58 mg |
| P-611480067 | Toronto Research | In stock | 90 | As a main component | in stock |
| P-617714394 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As a main component | 1.228 g |
| P-617769077 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As a main component | 1.228 g |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 354.442 |
| logP | 2.585 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 2 |
| PSA | 65.56 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 104.0235 |
| Atoms | 52 |
| Rings | 5 |
| Heavy atoms | 26 |
| Hydrogen atoms | 26 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 5 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 5 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
