Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-3321247915
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 | 24 USD | 98 | 16 working days | Get Quote |
| 5 mg | 28 USD | 95 | 7 working days | Get Quote |
| 10 mg | 30 USD | N/A | 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-3321247915.sdf |
| SMILES | MCULE-3321247915.smiles |
| Standard InChI | MCULE-3321247915.inchi |
| InChIKey | MCULE-3321247915.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867593750 | N/A | As is | in stock |
| P-875752517 | 96 | As is | in stock |
| P-595215898 | 98 | As is | by resynthesis (? - ? days) |
| P-1264053613 | 98 | As is | in stock |
| P-893527394 | 90 | As is | 14.373 g |
| P-1270407761 | 98 | As is | in stock |
| P-851937867 | N/A | As is | in stock |
| P-489177384 | 97 | As is | in stock |
| P-619180031 | 98 | As is | 1000 mg |
| P-1273452643 | 95 | As is | by resynthesis (? - ? days) |
| P-868545263 | 98 | As is | in stock |
| P-851244781 | 95 | As is | by synthesis |
| P-860798837 | 98 | As is | in stock |
| P-580450897 | 99 | As is | in stock |
| P-861370664 | 95 | As is | by synthesis |
| P-579482439 | 95 | As is | in stock |
| P-901409863 | 96 | As is | 5 g |
| P-900324882 | 95 | As is | by synthesis |
| P-1273112081 | 97 | As is | 100 mg |
| P-1263157035 | 95 | As is | by synthesis |
| P-854720476 | 95 | As is | in stock |
| P-474026441 | 95 | As is | in stock |
| P-878640987 | 98 | As is | in stock |
| P-888873572 | N/A | As is | in stock |
| P-491318692 | 95 | As is | by synthesis |
| P-617401704 | 98 | As is | in stock |
| P-892295025 | 95 | As is | unavailable |
| P-869161020 | 95 | As is | 101 mg |
| P-888656250 | 95 | As is | 101 mg |
| P-611473830 | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 308.330 |
| logP | 2.5207 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 62.54 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 90.6085 |
| Atoms | 39 |
| Rings | 3 |
| Heavy atoms | 23 |
| Hydrogen atoms | 16 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| 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 |
