Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4996549760
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 | 20 USD | 98 | 19 working days | Get Quote |
| 5 mg | 20 USD | 98 | 19 working days | Get Quote |
| 10 mg | 20 USD | 98 | 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.
| Name | File |
|---|---|
| SDF | MCULE-4996549760.sdf |
| SMILES | MCULE-4996549760.smiles |
| Standard InChI | MCULE-4996549760.inchi |
| InChIKey | MCULE-4996549760.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-588245901 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-886888934 | AmBeed | In stock | N/A | As is | in stock |
| P-489212708 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-866726674 | Apollo Scientific | In Stock | 95 | As is | 72.4976 kg |
| P-896034654 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-901461650 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-888619123 | ChemDiv | Discovery Chemistry Library | 90 | As is | unavailable |
| P-901364185 | Chemical Intelligence Co Limited | Stock Screening Compounds | 90 | As is | in stock |
| P-851282439 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868662776 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
| P-580404304 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-870655316 | Glentham Life Sciences | Compounds typically in stock | 97 | As is | in stock |
| P-675218983 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-488544602 | InterBioScreen | Building Blocks | 90 | As is | in stock |
| P-427918233 | InterBioScreen | Natural Compounds | 95 | As is | 1 mg |
| P-856009669 | Key Organics | Biochemicals | 95 | As is | unavailable |
| P-31247966 | LaboTest | Screening Collection | 90 | As is | 10 g |
| P-856042848 | LaboTest | Building Blocks | 90 | As is | 10 g |
| P-852510804 | Matrix Scientific | All | N/A | As is | in stock |
| P-854712898 | MedChemExpress | Screening compounds In stock | 95 | As is | in stock |
| P-878641206 | Molnova | Stock | 98 | As is | in stock |
| P-620069661 | Otava | In-House Stock Library | 90 | As is | 1000 mg |
| P-620224374 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 1000 mg |
| P-454364195 | Pharmeks LLC | Building Blocks | 92 | As is | in stock |
| P-889881034 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-519970726 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-617404861 | Selleck Biotechnology GmbH | Product Catalog | N/A | As is | in stock |
| P-596786444 | Synthonix | In-stock Building Blocks | 95 | As is | 17.4016 kg |
| P-869162672 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892298261 | TargetMol | In Stock BB | 95 | As is | 1.003 g |
| P-888658029 | TargetMol | Screening Compounds - stock amount | 95 | As is | 1.003 g |
| P-502366744 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-33790404 | TimTec | ActiMol 4 Week - On demand | 94 | As is | by resynthesis (? - ? days) |
| P-611516820 | Toronto Research | In stock | 90 | As is | in stock |
| P-855060097 | Toronto Research | In stock | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 158.153 |
| logP | 1.6218 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 0 |
| PSA | 34.14 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 44.243 |
| Atoms | 18 |
| Rings | 2 |
| Heavy atoms | 12 |
| Hydrogen atoms | 6 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| 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 |
