Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-1206917186
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 | 39 USD | 95 | 21 working days | Get Quote |
| 5 mg | 39 USD | 95 | 21 working days | Get Quote |
| 10 mg | 39 USD | 95 | 21 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-3606621277
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1206917186.sdf |
| SMILES | MCULE-1206917186.smiles |
| Standard InChI | MCULE-1206917186.inchi |
| InChIKey | MCULE-1206917186.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-875801481 | N/A | As is | in stock |
| P-613850949 | 97 | As is | in stock |
| P-903156602 | 95 | As is | 10 g |
| P-617053753 | 95 | As is | by resynthesis (? - ? days) |
| P-489181851 | 97 | As is | in stock |
| P-889464336 | 97 | As is | by synthesis |
| P-901454500 | 95 | As is | by synthesis |
| P-505589531 | 95 | As is | in stock |
| P-868599980 | 95 | As is | in stock |
| P-890216211 | 90 | As is | in stock |
| P-590338645 | 90 | As is | 1000 mg |
| P-502572285 | 95 | As is | by synthesis |
| P-855939107 | 95 | As is | 5 g |
| P-905052307 | 95 | As is | by synthesis |
| P-868738234 | 95 | As is | by synthesis |
| P-611524287 | 90 | As is | in stock |
| P-892870763 | 98 | As a main component | in stock |
| P-901283997 | N/A | As a main component | in stock |
| P-590364548 | 95 | As a main component | in stock |
| P-903206021 | 97 | As a main component | 5 g |
| P-893368216 | 90 | As a main component | by synthesis |
| P-489184231 | 97 | As a main component | in stock |
| P-873297475 | 97 | As a main component | 10 g |
| P-864092853 | 95 | As a main component | in stock |
| P-901437600 | 95 | As a main component | by synthesis |
| P-868645450 | 98 | As a main component | in stock |
| P-905320412 | 95 | As a main component | in stock |
| P-563549781 | 95 | As a main component | 1000 mg |
| P-854809727 | 95 | As a main component | by synthesis |
| P-26368040 | 90 | As a main component | 166 mg |
| P-492274602 | 95 | As a main component | 166 mg |
| P-873225740 | 90 | As a main component | in stock |
| P-611595580 | 90 | As a main component | in stock |
| P-893789770 | 95 | As a main component | by synthesis |
| P-893866077 | 95 | As a main component | by synthesis |
| P-854669622 | 95 | As a main component | in stock |
| P-886895870 | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 167.205 |
| logP | 1.3876 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 55.48 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 46.5762 |
| Atoms | 25 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 13 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 |
