Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-2615630098-0
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 | 6 USD | 97 | 14 working days | Get Quote |
| 5 mg | 6 USD | 97 | 14 working days | Get Quote |
| 10 mg | 6 USD | 97 | 14 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-2615630098-0.sdf |
| SMILES | MCULE-2615630098-0.smiles |
| Standard InChI | MCULE-2615630098-0.inchi |
| InChIKey | MCULE-2615630098-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-893118153 | N/A | As is | by synthesis |
| P-867559742 | 97 | As is | in stock |
| P-875719789 | N/A | As is | in stock |
| P-869182396 | 95 | As is | in stock |
| P-575540017 | 98 | As is | in stock |
| P-903048837 | 97 | As is | 100 g |
| P-905486307 | 97 | As is | 100 g |
| P-580267910 | 95 | As is | by synthesis |
| P-606905137 | N/A | As is | in stock |
| P-489136946 | 97 | As is | in stock |
| P-596927595 | 97 | As is | 5 kg |
| P-895957984 | 95 | As is | 10 g |
| P-864130905 | 95 | As is | in stock |
| P-580728110 | 97 | As is | 677 g |
| P-674252847 | 90 | As is | 90 mg |
| P-675044898 | 90 | As is | in stock |
| P-851280019 | 95 | As is | by synthesis |
| P-868617656 | 98 | As is | in stock |
| P-34602143 | 90 | As is | in stock |
| P-580420647 | 95 | As is | by resynthesis (? - ? days) |
| P-905345304 | 95 | As is | 1.043 kg |
| P-862026998 | 95 | As is | 2.45672 kg |
| P-454406075 | 90 | As is | 100 g |
| P-18817585 | 90 | As is | 4.703 g |
| P-613362892 | 95 | As is | 100 g |
| P-666812485 | 95 | As is | by synthesis |
| P-601052172 | 90 | As is | 162 mg |
| P-868153997 | N/A | As is | by synthesis |
| P-854724038 | 95 | As is | in stock |
| P-888890272 | N/A | As is | in stock |
| P-500404394 | 98 | As is | by synthesis |
| P-885547375 | 95 | As is | by synthesis |
| P-19426198 | 90 | As is | in stock |
| P-596787234 | 95 | As is | 782.5 g |
| P-873222989 | 90 | As is | in stock |
| P-22633831 | 90 | As is | 10 mg |
| P-903956194 | 94 | As is | by resynthesis (? - ? days) |
| P-906898795 | 98 | As is | in stock |
| P-611560423 | 90 | As is | in stock |
| P-3249009 | 90 | As is | 122 mg |
| P-868499164 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 129.119 |
| logP | 0.82496 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 0 |
| PSA | 60.47 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 33.667 |
| Atoms | 13 |
| Rings | 1 |
| Heavy atoms | 10 |
| Hydrogen atoms | 3 |
| Heteroatoms | 3 |
| 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 |
