Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-6120125470
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 | 6 USD | 98 | 22 working days | Get Quote |
| 5 mg | 6 USD | 98 | 22 working days | Get Quote |
| 10 mg | 6 USD | 98 | 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-6120125470.sdf |
| SMILES | MCULE-6120125470.smiles |
| Standard InChI | MCULE-6120125470.inchi |
| InChIKey | MCULE-6120125470.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867579240 | 98 | As is | in stock |
| P-875739243 | 98 | As is | in stock |
| P-1275154700 | 95 | As is | in stock |
| P-1275175696 | 98 | As is | in stock |
| P-903068995 | 98 | As is | 800 g |
| P-1270397496 | 97 | As is | in stock |
| P-580197867 | 95 | As is | 29 g |
| P-606948170 | N/A | As is | in stock |
| P-489159850 | 97 | As is | in stock |
| P-596931202 | 98 | As is | 2.3 kg |
| P-494345299 | 95 | As is | 443 g |
| P-864087021 | 95 | As is | in stock |
| P-580723861 | 97 | As is | 1.355 kg |
| P-901457885 | 95 | As is | by synthesis |
| P-454618690 | 90 | As is | in stock |
| P-436452346 | 95 | As is | in stock |
| P-868556925 | 97 | As is | in stock |
| P-580428455 | 95 | As is | by resynthesis (? - ? days) |
| P-905329175 | 96 | As is | 765 g |
| P-861926705 | 96 | As is | 10.38 kg |
| P-870658372 | N/A | As is | in stock |
| P-505504043 | 95 | As is | in stock |
| P-502445588 | 95 | As is | by synthesis |
| P-503087738 | 90 | As is | by synthesis |
| P-492222379 | 95 | As is | in stock |
| P-454384268 | 95 | As is | 80.881 g |
| P-454282773 | 95 | As is | 80.881 g |
| P-579613507 | 95 | As is | in stock |
| P-613278734 | 95 | As is | by synthesis |
| P-580477898 | 97 | As is | by synthesis |
| P-1272562042 | 97 | As is | 300 g |
| P-852377797 | 97 | As is | by synthesis |
| P-492285994 | 90 | As is | 787 mg |
| P-12961839 | 90 | As is | 787 mg |
| P-500382650 | 98 | As is | by synthesis |
| P-885515458 | 95 | As is | by synthesis |
| P-896078056 | N/A | As is | 8.896 g |
| P-498695938 | 98 | As is | 1.484 kg |
| P-23335340 | 90 | As is | in stock |
| P-502329467 | 90 | As is | in stock |
| P-903644399 | 94 | As is | by resynthesis (? - ? days) |
| P-855014848 | 90 | As is | in stock |
| P-1271255257 | 97 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 149.942 |
| logP | -0.8211 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 2 |
| PSA | 57.53 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 41.6551 |
| Atoms | 18 |
| Rings | 1 |
| Heavy atoms | 11 |
| Hydrogen atoms | 7 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| 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 |
