Get optimized quotes instantly for 40M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »
MCULE-4037268306
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 | 25 USD | 95 | 15 working days | Get Quote |
| 5 mg | 25 USD | 95 | 15 working days | Get Quote |
| 10 mg | 25 USD | 95 | 15 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-4037268306.sdf |
| SMILES | MCULE-4037268306.smiles |
| Standard InChI | MCULE-4037268306.inchi |
| InChIKey | MCULE-4037268306.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867635718 | 95 | As is | in stock |
| P-875800011 | N/A | As is | in stock |
| P-615728113 | 95 | As is | in stock |
| P-903155608 | 99 | As is | 40 g |
| P-893601585 | 90 | As is | 114.68 g |
| P-907315738 | 95 | As is | by synthesis |
| P-875905825 | N/A | As is | in stock |
| P-875890639 | 99 | As is | 40 g |
| P-895954519 | 95 | As is | by resynthesis (? - ? days) |
| P-864153142 | 95 | As is | in stock |
| P-873437809 | 95 | As is | 30.7 g |
| P-901444271 | 95 | As is | by synthesis |
| P-861389398 | 95 | As is | by synthesis |
| P-580286245 | N/A | As is | by resynthesis (? - ? days) |
| P-889423062 | 98 | As is | 4 g |
| P-454302739 | 90 | As is | unavailable |
| P-852454355 | N/A | As is | in stock |
| P-35254896 | 90 | As is | 867 g |
| P-872796831 | 95 | As is | in stock |
| P-492277675 | 95 | As is | 2.994 g |
| P-12465579 | 90 | As is | 2.994 g |
| P-889880932 | 95 | As is | by synthesis |
| P-579252557 | 90 | As is | in stock |
| P-23113575 | 90 | As is | in stock |
| P-502364249 | 90 | As is | in stock |
| P-906907025 | 99 | As is | in stock |
| P-611572309 | 90 | As is | in stock |
| P-578054156 | 90 | As is | 1.953 g |
| P-872756184 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 165.146 |
| logP | 1.2145 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 61.55 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 40.5999 |
| Atoms | 19 |
| Rings | 2 |
| Heavy atoms | 12 |
| Hydrogen atoms | 7 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 |
