Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1154926005-0
Structure
Show compound
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 | 9 USD | 98 | 20 working days | Get Quote |
| 5 mg | 9 USD | 98 | 20 working days | Get Quote |
| 10 mg | 9 USD | 98 | 20 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-1154926005-0.sdf |
| SMILES | MCULE-1154926005-0.smiles |
| Standard InChI | MCULE-1154926005-0.inchi |
| InChIKey | MCULE-1154926005-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867604836 | 98 | As is | in stock |
| P-875762981 | 98 | As is | in stock |
| P-588247010 | 99 | As is | by resynthesis (? - ? days) |
| P-580194290 | 98 | As is | in stock |
| P-1264047987 | 99 | As is | in stock |
| P-893486440 | 90 | As is | 996.57 g |
| P-1270313585 | 98 | As is | in stock |
| P-606831854 | N/A | As is | in stock |
| P-596960326 | 98 | As is | 500 g |
| P-1273455414 | 95 | As is | by resynthesis (? - ? days) |
| P-1273459810 | 95 | As is | by resynthesis (? - ? days) |
| P-864169589 | 98 | As is | in stock |
| P-580700091 | 98 | As is | 12.4 g |
| P-893219306 | 95 | As is | in stock |
| P-893234717 | 95 | As is | in stock |
| P-851266925 | 95 | As is | by synthesis |
| P-868611650 | 98 | As is | in stock |
| P-608497539 | 95 | As is | in stock |
| P-862012577 | 98 | As is | 267.074 g |
| P-608220636 | 98 | As is | in stock |
| P-505509695 | 95 | As is | in stock |
| P-524442436 | 97 | As is | 466 mg |
| P-608115765 | 99 | As is | in stock |
| P-860795014 | 97 | As is | by synthesis |
| P-854711489 | 95 | As is | in stock |
| P-896628218 | 95 | As is | by synthesis |
| P-474025140 | 95 | As is | in stock |
| P-608275307 | 98 | As is | in stock |
| P-500373562 | 98 | As is | by synthesis |
| P-1263957056 | 90 | As is | in stock |
| P-1263958653 | 90 | As is | in stock |
| P-889867918 | 95 | As is | by synthesis |
| P-579711584 | 98 | As is | in stock |
| P-869114448 | 95 | As is | 1.001 g |
| P-892288031 | 95 | As is | 1.001 g |
| P-888630895 | 95 | As is | 1.001 g |
| P-611403063 | 90 | As is | in stock |
| P-611403066 | 90 | As is | in stock |
| P-868520482 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 228.285 |
| logP | 3.37 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 4 |
| PSA | 26.3 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 70.027 |
| Atoms | 33 |
| Rings | 2 |
| Heavy atoms | 17 |
| Hydrogen atoms | 16 |
| 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 |
