Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2673572287
Compound
Show structures
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 | 31 USD | 95 | 7 working days | Get Quote |
| 5 mg | 49 USD | 95 | 7 working days | Get Quote |
| 10 mg | 69 USD | N/A | 22 working days | Get Quote |
- 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-2673572287.sdf |
| SMILES | MCULE-2673572287.smiles |
| Standard InChI | MCULE-2673572287.inchi |
| InChIKey | MCULE-2673572287.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867555228 | N/A | As is | in stock |
| P-875714221 | N/A | As is | in stock |
| P-613847406 | 95 | As is | by resynthesis (? - ? days) |
| P-893457580 | 90 | As is | 800 mg |
| P-851716086 | N/A | As is | by synthesis |
| P-873290079 | 98 | As is | 400 mg |
| P-1273254442 | 95 | As is | by resynthesis (? - ? days) |
| P-905466766 | 95 | As is | in stock |
| P-591117893 | 98 | As is | by synthesis |
| P-580451053 | 98 | As is | in stock |
| P-1273142723 | 98 | As is | 400 mg |
| P-1273109614 | 97 | As is | 100 mg |
| P-895188538 | 95 | As is | by synthesis |
| P-892302697 | 95 | As is | in stock |
| P-892291669 | 95 | As is | unavailable |
| P-869128410 | 95 | As is | 100 mg |
| P-888641140 | 95 | As is | 100 mg |
| P-906892230 | 98 | As is | by synthesis |
| P-611448777 | 90 | As is | in stock |
| P-886896951 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 297.519 |
| logP | 6.3832 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 16 |
| PSA | 29.1 |
| RO5 violations | 1 |
| RO3 violations | 2 |
| Refractivity | 96.4487 |
| Atoms | 60 |
| Rings | 0 |
| Heavy atoms | 21 |
| Hydrogen atoms | 39 |
| 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 |
