Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9911054913
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 | 4 USD | 98 | 20 working days | Get Quote |
| 5 mg | 4 USD | 98 | 20 working days | Get Quote |
| 10 mg | 4 USD | 98 | 20 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-9911054913.sdf |
| SMILES | MCULE-9911054913.smiles |
| Standard InChI | MCULE-9911054913.inchi |
| InChIKey | MCULE-9911054913.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867586087 | 98 | As is | in stock |
| P-867503105 | N/A | As is | by synthesis |
| P-867530402 | N/A | As is | by synthesis |
| P-875744517 | N/A | As is | in stock |
| P-869194335 | 98 | As is | in stock |
| P-505396240 | 99 | As is | in stock |
| P-903075657 | 98 | As is | 7 kg |
| P-905482377 | 98 | As is | 1000 g |
| P-875897296 | N/A | As is | in stock |
| P-606927573 | N/A | As is | in stock |
| P-596954253 | 98 | As is | 4 kg |
| P-579790171 | 95 | As is | by resynthesis (? - ? days) |
| P-869991937 | 90 | As is | 1000 mg |
| P-864136304 | 97 | As is | in stock |
| P-580711343 | 98 | As is | 4.075 kg |
| P-905517852 | 90 | As is | in stock |
| P-907008081 | 90 | As is | 1000 mg |
| P-868644432 | 97 | As is | in stock |
| P-580406381 | 95 | As is | by resynthesis (? - ? days) |
| P-861987715 | 95 | As is | 15.9059 kg |
| P-905338396 | 95 | As is | 55 g |
| P-494300422 | 98 | As is | in stock |
| P-505494292 | 95 | As is | in stock |
| P-502528358 | 95 | As is | by synthesis |
| P-524167943 | 98 | As is | 100 g |
| P-855993179 | 98 | As is | 100 mg |
| P-579628306 | 95 | As is | 250 g |
| P-852444468 | N/A | As is | in stock |
| P-854737785 | 95 | As is | in stock |
| P-424123455 | 90 | As is | 482 mg |
| P-617692622 | 95 | As is | 482 mg |
| P-888862186 | N/A | As is | in stock |
| P-500403055 | 98 | As is | by synthesis |
| P-889873850 | 95 | As is | by synthesis |
| P-18934540 | 90 | As is | in stock |
| P-502332538 | 90 | As is | in stock |
| P-23115129 | 94 | As is | by resynthesis (? - ? days) |
| P-906776069 | 98 | As is | by synthesis |
| P-611392799 | 90 | As is | in stock |
| P-3241194 | 90 | As is | 129 mg |
| P-666972915 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 85.104 |
| logP | 0.582 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 43.09 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 22.1354 |
| Atoms | 13 |
| Rings | 1 |
| Heavy atoms | 6 |
| Hydrogen atoms | 7 |
| 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 |
