Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-9060761632
Compound
Show structures
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 | 19 USD | 92 | 18 working days | Get Quote |
| 5 mg | 29 USD | 92 | 18 working days | Get Quote |
| 10 mg | 36 USD | 92 | 18 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-9060761632.sdf |
| SMILES | MCULE-9060761632.smiles |
| Standard InChI | MCULE-9060761632.inchi |
| InChIKey | MCULE-9060761632.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-852118861 | 90 | As is | by synthesis |
| P-889945336 | 90 | As is | by synthesis |
| P-894678168 | 95 | As is | by resynthesis (? - ? days) |
| P-851570895 | N/A | As is | by synthesis |
| P-596472251 | 90 | As is | 1000 mg |
| P-596518869 | 90 | As is | 1000 mg |
| P-901362949 | 95 | As is | by synthesis |
| P-590897406 | 95 | As is | by synthesis |
| P-4990314 | 90 | As is | 50 mg |
| P-454735751 | 90 | As is | in stock |
| P-436474362 | 95 | As is | in stock |
| P-34861237 | 90 | As is | in stock |
| P-502529204 | 95 | As is | by synthesis |
| P-12861597 | 92 | As is | 300 mg |
| P-855978193 | 95 | As is | 1000 mg |
| P-31217100 | 90 | As is | 100 mg |
| P-852534208 | N/A | As is | by synthesis |
| P-854931144 | 95 | As is | by synthesis |
| P-13616368 | 92 | As is | 300 mg |
| P-19634086 | 90 | As is | in stock |
| P-502327212 | 90 | As is | in stock |
| P-22453200 | 90 | As is | 883 mg |
| P-855326140 | 90 | As is | in stock |
| P-2208412 | 90 | As is | 110 mg |
| P-1271517627 | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 267.351 |
| logP | 3.656 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 65.7 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 78.5967 |
| Atoms | 32 |
| Rings | 3 |
| Heavy atoms | 19 |
| Hydrogen atoms | 13 |
| Heteroatoms | 4 |
| 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 |
