Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1236760494
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 | 18 USD | 92 | 18 working days | Get Quote |
| 5 mg | 29 USD | 92 | 18 working days | Get Quote |
| 10 mg | 36 USD | 92 | 18 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-8997174704
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-1236760494.sdf |
| SMILES | MCULE-1236760494.smiles |
| Standard InChI | MCULE-1236760494.inchi |
| InChIKey | MCULE-1236760494.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-617652448 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-34603268 | Crea-Chim | HTS compounds | 90 | As is | unavailable |
| P-580771229 | Crea-Chim | Prepacked BB compounds with prompt delivery | 90 | As is | in stock |
| P-580783249 | Crea-Chim | Building Blocks | 90 | As is | by resynthesis (? - ? days) |
| P-580475521 | Manchester Organics | Compounds on demand | N/A | As is | by synthesis |
| P-852601349 | Matrix Scientific | All | N/A | As is | in stock |
| P-895725898 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-867407199 | A2B Chem | Predominantly Building Block on demand | N/A | Main component | by synthesis |
| P-612938190 | AK Scientific | Building Blocks | 95 | Main component | in stock |
| P-851476125 | AmBeed | On request | N/A | Main component | by synthesis |
| P-489205324 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | Main component | in stock |
| P-870065299 | Asinex | General screening catalog | 90 | Main component | 1000 mg |
| P-596515698 | Asinex | General bb catalog | 90 | Main component | 1000 mg |
| P-590763774 | BLD pharm | Non-stock building blocks | 95 | Main component | by synthesis |
| P-901454550 | Biosynth | Synthesis | 95 | Main component | by synthesis |
| P-5365248 | ChemBridge | EXPRESS-Pick Collection | 90 | Main component | 5 mg |
| P-577173123 | ChemDiv | Building Blocks on demand | 90 | Main component | by synthesis |
| P-874533497 | ChemDiv | Discovery Chemistry Library | 90 | Main component | unavailable |
| P-488552213 | InterBioScreen | Building Blocks | 90 | Main component | in stock |
| P-13785452 | InterBioScreen | Screening Compounds | 92 | Main component | 300 mg |
| P-31210261 | LaboTest | Screening Collection | 90 | Main component | unavailable |
| P-852382328 | Matrix Scientific | All | N/A | Main component | in stock |
| P-854869795 | MedChemExpress | Building Blocks on demand | 95 | Main component | by synthesis |
| P-454372829 | Pharmeks LLC | Building Blocks | 92 | Main component | in stock |
| P-13916120 | Pharmeks LLC | Synthetic compounds | 92 | Main component | 300 mg |
| P-19490897 | Princeton Biomolecular Research | Screening Compounds | 90 | Main component | in stock |
| P-454044656 | Specs | Screening Compounds | 90 | Main component | 16 mg |
| P-33464501 | TimTec | ActiMol 3 Week | 90 | Main component | in stock |
| P-502331411 | TimTec | Building Block Collection | 90 | Main component | in stock |
| P-611600207 | Toronto Research | In stock | 90 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 247.161 |
| logP | 4.3607 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 29.26 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 72.2704 |
| Atoms | 31 |
| Rings | 2 |
| Heavy atoms | 15 |
| Hydrogen atoms | 16 |
| Heteroatoms | 4 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 2 |
| 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 |
