Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7942000917
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 | 97 | 22 working days | Get Quote |
| 5 mg | 6 USD | 97 | 22 working days | Get Quote |
| 10 mg | 6 USD | 97 | 22 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.
-
MCULE-6824224070
- Component type: Main
-
MCULE-4648827619
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-7942000917.sdf |
| SMILES | MCULE-7942000917.smiles |
| Standard InChI | MCULE-7942000917.inchi |
| InChIKey | MCULE-7942000917.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867557216 | 97 | As is | in stock |
| P-875716263 | N/A | As is | in stock |
| P-890254207 | 97 | As is | by synthesis |
| P-903044504 | 97 | As is | 1.5 kg |
| P-905485573 | 97 | As is | 100 g |
| P-580239182 | 95 | As is | by synthesis |
| P-606948391 | N/A | As is | in stock |
| P-489153311 | 97 | As is | in stock |
| P-596943760 | 97 | As is | 1.5 kg |
| P-596345582 | 90 | As is | 1000 mg |
| P-596511473 | 90 | As is | 1000 mg |
| P-864107273 | 95 | As is | in stock |
| P-481174900 | 95 | As is | 47 g |
| P-580702028 | 97 | As is | 146 g |
| P-851284180 | 95 | As is | by synthesis |
| P-861277240 | 95 | As is | in stock |
| P-868597885 | 98 | As is | in stock |
| P-580407576 | 95 | As is | by resynthesis (? - ? days) |
| P-905331315 | 95 | As is | 70 g |
| P-861948855 | 95 | As is | 2.51693 kg |
| P-505515654 | 95 | As is | in stock |
| P-502452646 | 95 | As is | by synthesis |
| P-503247428 | 90 | As is | by synthesis |
| P-619811556 | 96 | As is | in stock |
| P-856006087 | 98 | As is | 100 mg |
| P-856006088 | 98 | As is | 100 mg |
| P-524187452 | 98 | As is | 5 g |
| P-524165847 | 98 | As is | 100 g |
| P-524165848 | 98 | As is | 100 g |
| P-579636311 | 95 | As is | by resynthesis (? - ? days) |
| P-580502467 | N/A | As is | by synthesis |
| P-852440685 | N/A | As is | in stock |
| P-854724340 | 95 | As is | in stock |
| P-500383890 | 97 | As is | by synthesis |
| P-885517858 | 95 | As is | by synthesis |
| P-906766649 | 98 | As is | by synthesis |
| P-906758374 | 98 | As is | by synthesis |
| P-611395140 | 90 | As is | in stock |
| P-611379293 | 90 | As is | in stock |
| P-615397314 | 95 | As is | in stock |
| P-867444798 | N/A | As a main component | by synthesis |
| P-595222409 | 97 | As a main component | in stock |
| P-617055204 | 95 | As a main component | by resynthesis (? - ? days) |
| P-851815470 | N/A | As a main component | by synthesis |
| P-489197359 | 97 | As a main component | in stock |
| P-864263896 | 95 | As a main component | by synthesis |
| P-591137740 | 95 | As a main component | by synthesis |
| P-675391112 | 90 | As a main component | in stock |
| P-675491505 | 95 | As a main component | in stock |
| P-854953499 | 95 | As a main component | by synthesis |
| P-873215564 | 90 | As a main component | in stock |
| P-873218483 | 90 | As a main component | in stock |
| P-903644468 | 94 | As a main component | by resynthesis (? - ? days) |
| P-906782942 | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 209.285 |
| logP | 3.2505 |
| H-bond acceptors | 1 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 12.03 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 70.2707 |
| Atoms | 31 |
| Rings | 3 |
| Heavy atoms | 16 |
| Hydrogen atoms | 15 |
| Heteroatoms | 1 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
