Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1978708694
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 | 5 USD | 99 | 8 working days | Get Quote |
| 5 mg | 5 USD | 99 | 8 working days | Get Quote |
| 10 mg | 5 USD | 99 | 8 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.
-
1
MCULE-6282304706
- Component type: Main
-
1
MCULE-3188569799
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1978708694.sdf |
| SMILES | MCULE-1978708694.smiles |
| Standard InChI | MCULE-1978708694.inchi |
| InChIKey | MCULE-1978708694.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-875845806 | AA Blocks | AA Blocks - in stock | N/A | Main component | in stock |
| P-615724583 | AK Scientific | Building Blocks | 98 | Main component | in stock |
| P-893469883 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | Main component | 100.5 g |
| P-851934972 | AmBeed | In stock | N/A | Main component | in stock |
| P-619133430 | Angene | Building Blocks in stock | 98 | Main component | 50 g |
| P-895929672 | Apollo Scientific | On request | 95 | Main component | by resynthesis (? - ? days) |
| P-864187977 | AstaTech | In Stock BBs | 95 | Main component | in stock |
| P-608390630 | BLD pharm | In-stock building blocks | 98 | Main component | 111.5 g |
| P-871219986 | BOC Sciences | All products | N/A | Main component | by resynthesis (? - ? days) |
| P-868568706 | Combi-Blocks | Building Block in stock | 98 | Main component | in stock |
| P-868658360 | DC Chemicals Limited | Stock Products | 95 | Main component | in stock |
| P-889436142 | FluoroChem | General BB | 95 | Main component | in stock |
| P-502586408 | Innovapharm | Virtual Building Blocks | 95 | Main component | by synthesis |
| P-856008982 | Key Organics | Biochemicals | 97 | Main component | 895 mg |
| P-601069813 | Life Chemicals | Screening Compounds | 90 | Main component | in stock |
| P-867943594 | MedChemExpress | Screening compounds In stock | 95 | Main component | in stock |
| P-871069999 | MedKoo | In stock compounds | 95 | Main component | in stock |
| P-878643889 | Molnova | Stock | 98 | Main component | in stock |
| P-869164416 | TargetMol | Screening Compounds - synthesis | 95 | Main component | by synthesis |
| P-892300402 | TargetMol | In Stock BB | 95 | Main component | 998 mg |
| P-888659592 | TargetMol | Screening Compounds - stock amount | 95 | Main component | 998 mg |
| P-502335845 | TimTec | Building Block Collection | 90 | Main component | in stock |
| P-611452506 | Toronto Research | In stock | 90 | Main component | in stock |
| P-893945378 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component | in stock |
| P-867595596 | A2B Chem | Predominantly Building Block in stock | 99 | Main component as a main component | in stock |
| P-875754407 | AA Blocks | AA Blocks - in stock | N/A | Main component as a main component | in stock |
| P-535626844 | AK Scientific | Building Blocks | 95 | Main component as a main component | in stock |
| P-505389204 | AK Scientific | Building Blocks | 98 | Main component as a main component | in stock |
| P-505391090 | AK Scientific | Building Blocks | 98 | Main component as a main component | in stock |
| P-893617883 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | Main component as a main component | 3.5001 kg |
| P-617326161 | Alinda | Stock Screening Compounds | 90 | Main component as a main component | in stock |
| P-606866262 | AmBeed | In stock | N/A | Main component as a main component | in stock |
| P-596957980 | Angene | Building Blocks in stock | 99 | Main component as a main component | 3.5 kg |
| P-605394363 | Apollo Scientific | On request | 95 | Main component as a main component | by resynthesis (? - ? days) |
| P-864138551 | AstaTech | In Stock BBs | 98 | Main component as a main component | in stock |
| P-860056209 | AvaChem Scientific | On demand | 95 | Main component as a main component | by synthesis |
| P-868544891 | Axon Medchem | Axon predominantly SC catalog | 99 | Main component as a main component | in stock |
| P-580699261 | BLD pharm | In-stock building blocks | 99 | Main component as a main component | 657.35 g |
| P-871220386 | BOC Sciences | All products | N/A | Main component as a main component | by resynthesis (? - ? days) |
| P-893219127 | Biosynth | In Stock | 95 | Main component as a main component | in stock |
| P-893231320 | Biosynth | In Stock | 95 | Main component as a main component | in stock |
| P-505575252 | Bosche Scientific | Bosche Products | 98 | Main component as a main component | in stock |
| P-617651415 | ChemDiv | Building Blocks in stock | 90 | Main component as a main component | in stock |
| P-868595133 | Combi-Blocks | Building Block in stock | 98 | Main component as a main component | in stock |
| P-580759891 | Crea-Chim | HTS compounds | 90 | Main component as a main component | unavailable |
| P-579477087 | DC Chemicals Limited | Stock Products | 95 | Main component as a main component | in stock |
| P-889114473 | FluoroChem | In Stock BB | 95 | Main component as a main component | 10.5 g |
| P-870663032 | Glentham Life Sciences | Compounds maintained in stock | 98 | Main component as a main component | in stock |
| P-524444389 | Key Organics | Biochemicals | 97 | Main component as a main component | unavailable |
| P-852444593 | Matrix Scientific | All | N/A | Main component as a main component | in stock |
| P-895208056 | MedChemExpress | Screening compounds on demand | 95 | Main component as a main component | by synthesis |
| P-854719353 | MedChemExpress | Screening compounds In stock | 95 | Main component as a main component | in stock |
| P-584619728 | MedKoo | In stock compounds | 95 | Main component as a main component | in stock |
| P-608276877 | Molnova | Stock | 98 | Main component as a main component | in stock |
| P-500371906 | Pi Chemicals | Virtual Compounds | 98 | Main component as a main component | by synthesis |
| P-675127911 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component as a main component | in stock |
| P-579711849 | Selleckchem | Product Catalog | N/A | Main component as a main component | in stock |
| P-869108192 | TargetMol | Screening Compounds - synthesis | 95 | Main component as a main component | by synthesis |
| P-892286883 | TargetMol | In Stock BB | 95 | Main component as a main component | 898 mg |
| P-888627231 | TargetMol | Screening Compounds - stock amount | 95 | Main component as a main component | 898 mg |
| P-611452507 | Toronto Research | In stock | 90 | Main component as a main component | in stock |
| P-617793116 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | Main component as a main component | 47 mg |
| P-667016586 | eNovation Chemicals LLC | Building Blocks in stock | 95 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 417.951 |
| logP | 4.4028 |
| H-bond acceptors | 7 |
| H-bond donors | 4 |
| Rotatable bonds | 9 |
| PSA | 125.13 |
| RO5 violations | 0 |
| RO3 violations | 6 |
| Refractivity | 112.1076 |
| Atoms | 55 |
| Rings | 2 |
| Heavy atoms | 27 |
| Hydrogen atoms | 28 |
| Heteroatoms | 9 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
