Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-7252235773
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 | 92 USD | 97 | 17 working days | Get Quote |
| 5 mg | 92 USD | 97 | 17 working days | Get Quote |
| 10 mg | 106 USD | 97 | 10 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-7252235773.sdf |
| SMILES | MCULE-7252235773.smiles |
| Standard InChI | MCULE-7252235773.inchi |
| InChIKey | MCULE-7252235773.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867649312 | 97 | As is | in stock |
| P-875817432 | N/A | As is | in stock |
| P-612940744 | 95 | As is | in stock |
| P-903180643 | 97 | As is | 10 g |
| P-610976538 | 90 | As is | 55.2 g |
| P-851794895 | N/A | As is | by synthesis |
| P-873296707 | 97 | As is | 10 g |
| P-596448823 | 90 | As is | 1000 mg |
| P-864175217 | 97 | As is | in stock |
| P-591178112 | 97 | As is | by synthesis |
| P-893245176 | 95 | As is | in stock |
| P-851290748 | 95 | As is | by synthesis |
| P-887211749 | 95 | As is | by synthesis |
| P-580422188 | 95 | As is | by resynthesis (? - ? days) |
| P-502552582 | 95 | As is | by synthesis |
| P-500153194 | 96 | As is | in stock |
| P-862384338 | 97 | As is | 1000 mg |
| P-852387621 | N/A | As is | in stock |
| P-428012956 | 97 | As is | 979 g |
| P-854868731 | 95 | As is | by synthesis |
| P-502334699 | 90 | As is | in stock |
| P-33602514 | 94 | As is | by resynthesis (? - ? days) |
| P-873063805 | 94 | As is | by resynthesis (? - ? days) |
| P-611597534 | 90 | As is | in stock |
| P-615461771 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 206.284 |
| logP | 1.6157 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 38.49 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 64.0914 |
| Atoms | 33 |
| Rings | 2 |
| Heavy atoms | 15 |
| Hydrogen atoms | 18 |
| 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 |
